| 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 | 44.3 | Very low | 45.7 | Very low | 237 Ų | 237 | 148 Ų | 148 | 100% | 1.167 | 86% | 0.862 | S | S | * | * | 0 | 144.9 | 0 | -86 | 86.4 | 158.3 | 0 | 0 | 109.4 | |||||
| 2 | S | 44.3 | Very low | 45.3 | Very low | 116 Ų | 116 | 146.7 Ų | 146.7 | 81% | 0.811 | 86% | 0.862 | S | S | * | * | trans | 92.1 | 87.2 | 164.6 | -49.3 | 0 | 0 | 0 | 0 | 117.5 | ||||
| 3 | H | 42.6 | Very low | 45.4 | Very low | 194 Ų | 194 | 148 Ų | 148 | 90% | 0.898 | 86% | 0.862 | S | S | * | * | trans | -64.8 | 141.9 | 152.5 | -66.4 | 91.7 | 0 | 0 | 0 | 110.5 | ||||
| 4 | S | 52.5 | Low | 45.7 | Very low | 127 Ų | 127 | 145.4 Ų | 145.4 | 89% | 0.888 | 85% | 0.852 | S | S | * | * | trans | -132 | 115.8 | 154.8 | -65 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 5 | Q | 49.7 | Very low | 45.6 | Very low | 178 Ų | 178 | 145.1 Ų | 145.1 | 83% | 0.832 | 85% | 0.852 | S | S | * | * | trans | -63.4 | 141.5 | 170.8 | 175.8 | -164.2 | 103.4 | 0 | 0 | 111.6 | ||||
| 6 | Q | 46.7 | Very low | 45.8 | Very low | 193 Ų | 193 | 141.5 Ų | 141.5 | 90% | 0.902 | 85% | 0.845 | S | S | * | * | -167.1 | 148.3 | 129.1 | -152.4 | 149.4 | -19.7 | 0 | 0 | 113.2 | |||||
| 7 | Q | 50.3 | Low | 46.5 | Very low | 167 Ų | 167 | 140.4 Ų | 140.4 | 78% | 0.78 | 84% | 0.842 | S | S | * | * | trans | -112.3 | 147.5 | -160.8 | 166.7 | 171.4 | 2.8 | 0 | 0 | 111.5 | ||||
| 8 | S | 39.9 | Very low | 46.6 | Very low | 122 Ų | 122 | 140.8 Ų | 140.8 | 85% | 0.853 | 84% | 0.839 | S | S | * | * | trans | 178.6 | 129 | 141.2 | 21 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 9 | A | 43 | Very low | 46.6 | Very low | 95 Ų | 95 | 139 Ų | 139 | 79% | 0.785 | 83% | 0.834 | S | S | * | * | trans | -97 | 158.1 | 152.5 | 0 | 0 | 0 | 0 | 0 | 107.1 | ||||
| 10 | P | 44.4 | Very low | 46.7 | Very low | 127 Ų | 127 | 137.7 Ų | 137.7 | 83% | 0.825 | 83% | 0.829 | S | S | * | * | -141.4 | 173.2 | 56.4 | 30.3 | -6.3 | 0 | 0 | 0 | 114.9 | |||||
| 11 | G | 45 | Very low | 46.6 | Very low | 72 Ų | 72 | 135.8 Ų | 135.8 | 74% | 0.742 | 83% | 0.828 | S | S | * | * | trans | -70 | 176.3 | -174.2 | 0 | 0 | 0 | 0 | 0 | 116.5 | ||||
| 12 | P | 41 | Very low | 46.9 | Very low | 132 Ų | 132 | 133.2 Ų | 133.2 | 86% | 0.857 | 82% | 0.815 | S | S | * | * | -141.8 | 147.5 | 119.9 | 29.6 | -11.4 | 0 | 0 | 0 | 114.6 | |||||
| 13 | L | 47 | Very low | 47 | Very low | 164 Ų | 164 | 130 Ų | 130 | 86% | 0.859 | 80% | 0.8 | S | S | * | * | trans | -63.3 | -172.1 | 155.3 | -71.6 | 115.5 | 0 | 0 | 0 | 110.5 | ||||
| 14 | P | 49.8 | Very low | 47.4 | Very low | 112 Ų | 112 | 127.2 Ų | 127.2 | 73% | 0.727 | 80% | 0.797 | S | S | * | * | -121.1 | 148.5 | -59.1 | 32.7 | -17.7 | 0 | 0 | 0 | 110.4 | A16 | P14-A16 PolarHBondContact O-N 3.47Š| |||
| 15 | T | 43.2 | Very low | 47 | Very low | 140 Ų | 140 | 127 Ų | 127 | 86% | 0.859 | 79% | 0.79 | S | S | * | * | trans | -87.6 | 108.4 | 173 | -49.3 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 16 | A | 49.6 | Very low | 47.3 | Very low | 88 Ų | 88 | 124.8 Ų | 124.8 | 73% | 0.727 | 79% | 0.788 | S | S | * | * | trans | -85.3 | 144.7 | 155.1 | 0 | 0 | 0 | 0 | 0 | 109.1 | P14 | P14-A16 PolarHBondContact O-N 3.47Š| ||
| 17 | P | 56.7 | Low | 47.6 | Very low | 122 Ų | 122 | 120.3 Ų | 120.3 | 79% | 0.792 | 78% | 0.779 | S | S | * | * | trans | -122.8 | 116.7 | 138.5 | 26 | -12 | 0 | 0 | 0 | 109.9 | ||||
| 18 | D | 48.5 | Very low | 47.8 | Very low | 148 Ų | 148 | 114.6 Ų | 114.6 | 79% | 0.791 | 76% | 0.764 | S | S | * | * | trans | -73.1 | 120.7 | 163.5 | -174.3 | -88.4 | 0 | 0 | 0 | 109.1 | ||||
| 19 | S | 47.9 | Very low | 48.3 | Very low | 107 Ų | 107 | 115.7 Ų | 115.7 | 75% | 0.748 | 76% | 0.761 | S | S | * | * | trans | -171.5 | 131 | 145.9 | -83.3 | 0 | 0 | 0 | 0 | 110.6 | A21 | S19-A21 PolarHBondContact O-N 3.42Š| ||
| 20 | P | 46.9 | Very low | 48.7 | Very low | 113 Ų | 113 | 117.5 Ų | 117.5 | 73% | 0.734 | 76% | 0.762 | S | S | * | * | trans | -87.6 | 100.9 | -172.7 | 33.9 | -30.8 | 0 | 0 | 0 | 110.7 | M22 | P20-M22 PolarHBondContact O-N 3.05Š| ||
| 21 | A | 44.8 | Very low | 48.9 | Very low | 97 Ų | 97 | 117.6 Ų | 117.6 | 80% | 0.802 | 76% | 0.76 | S | S | * | * | trans | -73.1 | 111.1 | 162 | 0 | 0 | 0 | 0 | 0 | 108.5 | S19 G23 | S19-A21 PolarHBondContact O-N 3.42Å; A21-G23 PolarHBondContact O-N 2.96Å | ||
| 22 | M | 51.7 | Low | 49.1 | Very low | 183 Ų | 183 | 123.3 Ų | 123.3 | 90% | 0.901 | 77% | 0.765 | S | S | * | * | trans | -64.2 | 74.5 | 165.1 | -72.3 | -92.3 | 82.6 | 0 | 0 | 109.9 | P20 | P20-M22 PolarHBondContact O-N 3.05Š| ||
| 23 | G | 45.1 | Very low | 49.1 | Very low | 49 Ų | 49 | 127 Ų | 127 | 51% | 0.505 | 76% | 0.763 | S | S | . | * | trans | -116.6 | 102.3 | 163.1 | 0 | 0 | 0 | 0 | 0 | 107 | A21 T25 | A21-G23 PolarHBondContact O-N 2.96Å; G23-T25 PolarHBondContact O-N 3.11Å | ||
| 24 | V | 51 | Low | 49.5 | Very low | 135 Ų | 135 | 123.9 Ų | 123.9 | 82% | 0.818 | 76% | 0.761 | S | S | * | * | trans | -62.4 | 86.9 | 166.1 | 174.5 | 0 | 0 | 0 | 0 | 106.9 | V26 | V24-V26 HydrophobicContact CG1-CG2 4.02Å; V24-V26 PolarHBondContact O-N 3.47Å | ||
| 25 | T | 45.7 | Very low | 49.7 | Very low | 122 Ų | 122 | 124.4 Ų | 124.4 | 75% | 0.748 | 76% | 0.755 | S | S | * | * | trans | -80.9 | 98.8 | 165.4 | 51.5 | 0 | 0 | 0 | 0 | 105.8 | G23 S27 | G23-T25 PolarHBondContact O-N 3.11Å; T25-S27 PolarHBondContact O-N 3.4Å | ||
| 26 | V | 54.9 | Low | 49.9 | Very low | 132 Ų | 132 | 127 Ų | 127 | 80% | 0.8 | 76% | 0.755 | S | S | * | * | trans | -70.5 | 71 | 157.5 | 179.3 | 0 | 0 | 0 | 0 | 106.3 | V24 G28 | V24-V26 HydrophobicContact CG1-CG2 4.02Å; V24-V26 PolarHBondContact O-N 3.47Å; V26-G28 PolarHBondContact O-N 3.48Å | ||
| 27 | S | 52.8 | Low | 50.1 | Low | 100 Ų | 100 | 132.6 Ų | 132.6 | 70% | 0.699 | 76% | 0.762 | S | S | * | * | trans | -77.2 | 81.7 | 162.1 | -170.9 | 0 | 0 | 0 | 0 | 105.6 | T25 N29 | T25-S27 PolarHBondContact O-N 3.4Å; S27-N29 PolarHBondContact O-N 3.46Å | ||
| 28 | G | 56 | Low | 50.2 | Low | 46 Ų | 46 | 135.7 Ų | 135.7 | 47% | 0.474 | 76% | 0.763 | S | S | . | * | trans | -56.3 | 110.6 | 170.1 | 0 | 0 | 0 | 0 | 0 | 108.1 | V26 V30 | V26-G28 PolarHBondContact O-N 3.48Å; G28-V30 PolarHBondContact O-N 3.46Å | ||
| 29 | N | 48.5 | Very low | 50.9 | Low | 146 Ų | 146 | 134.4 Ų | 134.4 | 78% | 0.781 | 75% | 0.751 | S | S | * | * | trans | -71.6 | 75.2 | 172.3 | 33 | 18.8 | 0 | 0 | 0 | 109.5 | S27 T31 | S27-N29 PolarHBondContact O-N 3.46Å; N29-T31 PolarHBondContact O-N 3.1Å | ||
| 30 | V | 51.8 | Low | 52.4 | Low | 133 Ų | 133 | 131.8 Ų | 131.8 | 81% | 0.806 | 73% | 0.728 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79.4 | 38.5 | 176.9 | -159.4 | 0 | 0 | 0 | 0 | 112.1 | G28 | G28-V30 PolarHBondContact O-N 3.46Š|
| 31 | T | 49.2 | Very low | 54.3 | Low | 128 Ų | 128 | 126.5 Ų | 126.5 | 79% | 0.785 | 69% | 0.693 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -133.7 | 8.8 | -172 | -37.1 | 0 | 0 | 0 | 0 | 114.4 | N29 | N29-T31 PolarHBondContact O-N 3.1Š|
| 32 | K | 48.2 | Very low | 56.5 | Low | 193 Ų | 193 | 126.5 Ų | 126.5 | 84% | 0.839 | 68% | 0.68 | S | S | * | * | trans | -129 | 45.3 | 179.5 | -100.1 | -167 | 177.2 | -174.1 | 0 | 114.9 | ||||
| 33 | Y | 42.8 | Very low | 58.5 | Low | 208 Ų | 208 | 120.6 Ų | 120.6 | 82% | 0.816 | 66% | 0.66 | S | S | * | * | trans | -112.4 | 50.5 | 155.4 | -61.4 | -76.5 | 0 | 0 | 0 | 110.3 | M35 | Y33-M35 PolarHBondContact O-N 3.29Š| ||
| 34 | A | 55 | Low | 60.7 | Low | 100 Ų | 100 | 125.5 Ų | 125.5 | 83% | 0.826 | 67% | 0.67 | S | S | * | * | trans | -75 | 83.5 | 162.7 | 0 | 0 | 0 | 0 | 0 | 107.9 | K36 | A34-K36 PolarHBondContact O-N 2.98Š| ||
| 35 | M | 53.9 | Low | 62.7 | Low | 122 Ų | 122 | 120.1 Ų | 120.1 | 60% | 0.601 | 64% | 0.636 | S | S | * | * | trans | -69.8 | 111 | 178.6 | -55.2 | -164.6 | -90.1 | 0 | 0 | 109.2 | Y33 K37 I40 | Y33-M35 PolarHBondContact O-N 3.29Å; M35-K37 PolarHBondContact O-N 3.35Å; M35-K37 VanDerWaalsContact O-N 3.11Å; M35-I40 HydrophobicContact CE-CD1 4.15Å | ||
| 36 | K | 47.6 | Very low | 65 | Low | 196 Ų | 196 | 115.2 Ų | 115.2 | 85% | 0.852 | 61% | 0.606 | S | S | * | * | trans | -54.6 | 114.6 | 167.4 | 174.8 | 175.2 | 168.8 | 170.6 | 0 | 108.5 | A34 K38 | A34-K36 PolarHBondContact O-N 2.98Å; K36-K38 PolarHBondContact O-N 2.9Å | ||
| 37 | K | 53.7 | Low | 66.9 | Low | 205 Ų | 205 | 115.6 Ų | 115.6 | 89% | 0.891 | 60% | 0.599 | S | S | * | * | trans | -29.4 | 88.2 | -179.2 | -176.3 | -179.7 | 161.4 | 170 | 0 | 113.3 | M35 | M35-K37 PolarHBondContact O-N 3.35Å; M35-K37 VanDerWaalsContact O-N 3.11Å | ||
| 38 | K | 57.5 | Low | 68.9 | Low | 187 Ų | 187 | 114.9 Ų | 114.9 | 81% | 0.813 | 59% | 0.587 | S | S | * | * | trans | -106.4 | 130 | 153.7 | -67.1 | -178.4 | 78.6 | 163 | 0 | 104.2 | K36 I40 | K36-K38 PolarHBondContact O-N 2.9Å; K38-I40 PolarHBondContact O-N 3.31Å | ||
| 39 | K | 64.8 | Low | 70.8 | Confident | 120 Ų | 120 | 113.6 Ų | 113.6 | 52% | 0.522 | 57% | 0.569 | S | S | . | * | trans | -52.2 | 115.2 | 175.4 | -165.9 | -170.8 | 173.2 | -166.4 | 0 | 106.7 | L41 N42 S46 | K39-L41 WeakPolarHBondContact CD-O 3.3Å; K39-L41 VanDerWaalsContact CE-O 3.32Å; K39-L41 WeakPolarHBondContact CE-O 3.38Å; K39-L41 WeakPolarHBondContact CG-O 3.47Å; K39-L41 PolarHBondContact O-N 2.92Å; K39-N42 PolarHBondContact NZ-O 3.25Å; K39-N42 VanDerWaalsContact NZ-O 3.11Å; K39-S46 VanDerWaalsContact CE-CB 3.4Å; K39-S46 VanDerWaalsContact CE-OG 3.25Å; K39-S46 WeakPolarHBondContact CE-OG 3.42Å; K39-S46 PolarHBondContact NZ-OG 2.96Å; K39-S46 VanDerWaalsContact NZ-OG 3.07Å | ||
| 40 | I | 78.2 | Confident | 73 | Confident | 52 Ų | 52 | 112.5 Ų | 112.5 | 27% | 0.267 | 56% | 0.559 | S | S | . | * | S | Bend | trans | -67.4 | -24.6 | -175.7 | -159.2 | 138.6 | 0 | 0 | 0 | 110.3 | M35 K38 Q61 E62 K65 | M35-I40 HydrophobicContact CE-CD1 4.15Å; K38-I40 PolarHBondContact O-N 3.31Å; I40-Q61 HydrophobicContact CG2-CB 3.87Å; I40-E62 HydrophobicContact CD1-CG 4.38Å; I40-K65 HydrophobicContact CG1-CD 3.72Å; I40-K65 VanDerWaalsContact O-CD 3.31Å; I40-K65 WeakPolarHBondContact O-CD 3.25Å; I40-K65 VanDerWaalsContact O-CE 3.3Å; I40-K65 WeakPolarHBondContact O-CE 3.31Å; I40-K65 PolarHBondContact O-NZ 2.96Å |
| 41 | L | 87.4 | Confident | 75.2 | Confident | 3 Ų | 3 | 111.8 Ų | 111.8 | 2% | 0.016 | 55% | 0.55 | C | S | . | . | S | Bend | trans | -98.8 | 140.3 | 175 | -57 | -179 | 0 | 0 | 0 | 112 | K39 E45 F49 Q61 F64 K65 | K39-L41 WeakPolarHBondContact CD-O 3.3Å; K39-L41 VanDerWaalsContact CE-O 3.32Å; K39-L41 WeakPolarHBondContact CE-O 3.38Å; K39-L41 WeakPolarHBondContact CG-O 3.47Å; K39-L41 PolarHBondContact O-N 2.92Å; L41-E45 HydrophobicContact CB-CB 4.02Å; L41-E45 HydrophobicContact CD2-CB 4.24Å; L41-F49 HydrophobicContact CD1-CB 3.63Å; L41-F49 HydrophobicContact CD1-CD1 4.23Å; L41-F49 HydrophobicContact CD1-CD2 4.32Å; L41-F49 HydrophobicContact CD1-CG 3.8Å; L41-Q61 HydrophobicContact CD1-CB 4.24Å; L41-Q61 HydrophobicContact CD1-CG 4.08Å; L41-Q61 VanDerWaalsContact CD1-OE1 3.3Å; L41-Q61 HydrophobicContact CG-CB 4.49Å; L41-F64 HydrophobicContact CD1-CD1 4.04Å; L41-F64 HydrophobicContact CD1-CE1 4.38Å; L41-F64 HydrophobicContact CD2-CD1 3.76Å; L41-F64 HydrophobicContact CD2-CE1 4.22Å; L41-K65 HydrophobicContact CD2-CB 3.82Å; L41-K65 HydrophobicContact CD2-CG 4.26Å |
| 42 | N | 91.4 | Very high | 77.4 | Confident | 97 Ų | 97 | 107 Ų | 107 | 52% | 0.519 | 52% | 0.52 | S | S | . | . | trans | -65.9 | 176.3 | 167.7 | -167.3 | 17 | 0 | 0 | 0 | 111.8 | K39 E45 S46 | K39-N42 PolarHBondContact NZ-O 3.25Å; K39-N42 VanDerWaalsContact NZ-O 3.11Å; N42-E45 HydrophobicContact CB-CB 4.37Å; N42-E45 HydrophobicContact CB-CG 4.16Å; N42-E45 PolarHBondContact N-OE2 3.24Å; N42-S46 VanDerWaalsContact O-CB 3.25Å; N42-S46 WeakPolarHBondContact O-CB 3.4Å; N42-S46 PolarHBondContact O-N 2.88Å | ||
| 43 | A | 92.8 | Very high | 79.6 | Confident | 58 Ų | 58 | 102.4 Ų | 102.4 | 48% | 0.479 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -56 | -54.1 | 173.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | E45 S46 E47 | A43-E45 PolarHBondContact O-N 3.37Å; A43-S46 VanDerWaalsContact O-CB 3.31Å; A43-S46 WeakPolarHBondContact O-CB 3.33Å; A43-S46 PolarHBondContact O-N 3.05Å; A43-E47 PolarHBondContact O-N 3.46Å |
| 44 | E | 92.5 | Very high | 82.2 | Confident | 153 Ų | 153 | 96.6 Ų | 96.6 | 72% | 0.715 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -63.4 | -41.4 | 179.8 | -60.9 | 179 | 155.5 | 0 | 0 | 112.7 | S46 E47 L48 | E44-S46 PolarHBondContact O-N 3.11Å; E44-E47 PolarHBondContact O-N 3.05Å; E44-L48 PolarHBondContact O-N 3.48Å; E44-L48 VanDerWaalsContact O-N 3.15Å |
| 45 | E | 93 | Very high | 84.2 | Confident | 22 Ų | 22 | 95.4 Ų | 95.4 | 10% | 0.103 | 49% | 0.487 | C | S | . | . | H | α-helix | trans | -65.5 | -29.7 | 178.1 | -65 | 174.2 | 166.9 | 0 | 0 | 111.7 | L41 N42 A43 F49 F64 K65 K72 | L41-E45 HydrophobicContact CB-CB 4.02Å; L41-E45 HydrophobicContact CD2-CB 4.24Å; N42-E45 HydrophobicContact CB-CB 4.37Å; N42-E45 HydrophobicContact CB-CG 4.16Å; N42-E45 PolarHBondContact N-OE2 3.24Å; A43-E45 PolarHBondContact O-N 3.37Å; E45-F49 WeakPolarHBondContact O-CB 3.21Å; E45-F49 PolarHBondContact O-N 3.15Å; E45-F64 HydrophobicContact CB-CE1 4.45Å; E45-F64 WeakPolarHBondContact O-CE1 3.2Å; E45-K65 IonicContact OE2-NZ 3.39Å; E45-K65 PolarHBondContact OE2-NZ 3.44Å; E45-K72 IonicContact OE1-NZ 2.88Å; E45-K72 PolarHBondContact OE1-NZ 3.32Å |
| 46 | S | 93 | Very high | 86.1 | Confident | 18 Ų | 18 | 92.8 Ų | 92.8 | 13% | 0.126 | 49% | 0.491 | C | S | . | . | H | α-helix | trans | -73.6 | -39.4 | 178.2 | -170.9 | 0 | 0 | 0 | 0 | 112.8 | K39 N42 A43 E44 L48 F49 E50 | K39-S46 VanDerWaalsContact CE-CB 3.4Å; K39-S46 VanDerWaalsContact CE-OG 3.25Å; K39-S46 WeakPolarHBondContact CE-OG 3.42Å; K39-S46 PolarHBondContact NZ-OG 2.96Å; K39-S46 VanDerWaalsContact NZ-OG 3.07Å; N42-S46 VanDerWaalsContact O-CB 3.25Å; N42-S46 WeakPolarHBondContact O-CB 3.4Å; N42-S46 PolarHBondContact O-N 2.88Å; A43-S46 VanDerWaalsContact O-CB 3.31Å; A43-S46 WeakPolarHBondContact O-CB 3.33Å; A43-S46 PolarHBondContact O-N 3.05Å; E44-S46 PolarHBondContact O-N 3.11Å; S46-L48 VanDerWaalsContact C-N 3.29Å; S46-F49 PolarHBondContact O-N 3.49Å; S46-E50 WeakPolarHBondContact O-CG 3.33Å; S46-E50 PolarHBondContact O-N 2.92Å |
| 47 | E | 94.9 | Very high | 88.3 | Confident | 141 Ų | 141 | 87.6 Ų | 87.6 | 66% | 0.659 | 47% | 0.472 | S | S | * | . | H | α-helix | trans | -64.4 | -39.6 | 173 | -70.8 | -179.3 | -161.6 | 0 | 0 | 110.6 | A43 E44 F49 E50 L51 | A43-E47 PolarHBondContact O-N 3.46Å; E44-E47 PolarHBondContact O-N 3.05Å; E47-F49 VanDerWaalsContact C-N 3.34Å; E47-F49 PolarHBondContact O-N 3.37Å; E47-E50 PolarHBondContact O-N 3.37Å; E47-L51 WeakPolarHBondContact O-CB 3.46Å; E47-L51 PolarHBondContact O-N 3.33Å |
| 48 | L | 95.3 | Very high | 90.1 | Very high | 85 Ų | 85 | 82.2 Ų | 82.2 | 45% | 0.445 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -66.5 | -36.9 | 176 | -170.4 | 64.6 | 0 | 0 | 0 | 112.1 | E44 S46 T52 F64 V68 | E44-L48 PolarHBondContact O-N 3.48Å; E44-L48 VanDerWaalsContact O-N 3.15Å; S46-L48 VanDerWaalsContact C-N 3.29Å; L48-T52 WeakPolarHBondContact O-CB 3.3Å; L48-T52 PolarHBondContact O-N 3.24Å; L48-T52 PolarHBondContact O-OG1 2.72Å; L48-F64 HydrophobicContact CB-CZ 3.82Å; L48-F64 HydrophobicContact CD2-CZ 3.87Å; L48-F64 HydrophobicContact CG-CE2 4.23Å; L48-F64 HydrophobicContact CG-CZ 3.7Å; L48-V68 HydrophobicContact CD2-CG2 4.49Å |
| 49 | F | 95.4 | Very high | 91.7 | Very high | 18 Ų | 18 | 75.7 Ų | 75.7 | 8% | 0.079 | 44% | 0.438 | C | S | . | . | H | α-helix | trans | -64.2 | -43.6 | 172.4 | 178.3 | -104.3 | 0 | 0 | 0 | 111.9 | L41 E45 S46 E47 T52 Q53 M59 Q61 F64 | L41-F49 HydrophobicContact CD1-CB 3.63Å; L41-F49 HydrophobicContact CD1-CD1 4.23Å; L41-F49 HydrophobicContact CD1-CD2 4.32Å; L41-F49 HydrophobicContact CD1-CG 3.8Å; E45-F49 WeakPolarHBondContact O-CB 3.21Å; E45-F49 PolarHBondContact O-N 3.15Å; S46-F49 PolarHBondContact O-N 3.49Å; E47-F49 VanDerWaalsContact C-N 3.34Å; E47-F49 PolarHBondContact O-N 3.37Å; F49-T52 WeakPolarHBondContact O-CB 3.47Å; F49-T52 PolarHBondContact O-N 3.3Å; F49-Q53 HydrophobicContact CE1-CG 4.32Å; F49-Q53 HydrophobicContact CZ-CG 4.2Å; F49-Q53 PolarHBondContact O-N 2.97Å; F49-M59 HydrophobicContact CE2-CG 4.04Å; F49-M59 WeakPolarHBondContact CE2-O 3.46Å; F49-M59 WeakPolarHBondContact CZ-O 3.47Å; F49-Q61 HydrophobicContact CD1-CG 4.17Å; F49-Q61 HydrophobicContact CD2-CG 4.45Å; F49-Q61 HydrophobicContact CE1-CG 3.69Å; F49-Q61 HydrophobicContact CE2-CG 3.99Å; F49-Q61 HydrophobicContact CZ-CG 3.6Å; F49-F64 HydrophobicContact CB-CD1 3.95Å; F49-F64 HydrophobicContact CB-CE1 3.81Å; F49-F64 HydrophobicContact CB-CE2 4.39Å; F49-F64 HydrophobicContact CB-CG 4.3Å; F49-F64 HydrophobicContact CB-CZ 4.04Å; F49-F64 HydrophobicContact CD2-CB 3.74Å; F49-F64 AromaticContact CD2-CD1 3.98Å; F49-F64 HydrophobicContact CD2-CD1 3.98Å; F49-F64 HydrophobicContact CD2-CD2 4Å; F49-F64 AromaticContact CD2-CG 3.63Å; F49-F64 HydrophobicContact CD2-CG 3.63Å; F49-F64 HydrophobicContact CE2-CB 4.17Å; F49-F64 HydrophobicContact CG-CD1 4.4Å; F49-F64 HydrophobicContact CG-CG 4.44Å |
| 50 | E | 94.8 | Very high | 93 | Very high | 124 Ų | 124 | 75.8 Ų | 75.8 | 58% | 0.579 | 45% | 0.445 | S | S | * | . | H | α-helix | trans | -63.6 | -42.1 | 175.6 | -76.4 | 179.9 | -154.1 | 0 | 0 | 112.3 | S46 E47 T52 Q53 A54 | S46-E50 WeakPolarHBondContact O-CG 3.33Å; S46-E50 PolarHBondContact O-N 2.92Å; E47-E50 PolarHBondContact O-N 3.37Å; E50-T52 VanDerWaalsContact C-N 3.29Å; E50-T52 PolarHBondContact O-N 2.79Å; E50-Q53 PolarHBondContact O-N 3.49Å; E50-A54 WeakPolarHBondContact O-CB 3.38Å; E50-A54 PolarHBondContact O-N 3.32Å |
| 51 | L | 96.9 | Very high | 93.7 | Very high | 117 Ų | 117 | 77.3 Ų | 77.3 | 61% | 0.613 | 45% | 0.451 | S | S | * | . | H | α-helix | trans | -63 | -37.7 | 174.8 | -176.5 | 61.1 | 0 | 0 | 0 | 111.8 | E47 A54 A55 | E47-L51 WeakPolarHBondContact O-CB 3.46Å; E47-L51 PolarHBondContact O-N 3.33Å; L51-A54 PolarHBondContact O-N 2.93Å; L51-A55 WeakPolarHBondContact O-CB 3.4Å; L51-A55 PolarHBondContact O-N 2.88Å |
| 52 | T | 95.8 | Very high | 93.9 | Very high | 27 Ų | 27 | 82.1 Ų | 82.1 | 17% | 0.166 | 47% | 0.473 | C | S | . | . | H | α-helix | trans | -63.7 | -42.3 | 176.3 | -60.2 | 0 | 0 | 0 | 0 | 111.2 | L48 F49 E50 A55 I57 M59 | L48-T52 WeakPolarHBondContact O-CB 3.3Å; L48-T52 PolarHBondContact O-N 3.24Å; L48-T52 PolarHBondContact O-OG1 2.72Å; F49-T52 WeakPolarHBondContact O-CB 3.47Å; F49-T52 PolarHBondContact O-N 3.3Å; E50-T52 VanDerWaalsContact C-N 3.29Å; E50-T52 PolarHBondContact O-N 2.79Å; T52-A55 WeakPolarHBondContact O-CB 3.28Å; T52-A55 PolarHBondContact O-N 3.3Å; T52-I57 HydrophobicContact CG2-CB 3.93Å; T52-I57 HydrophobicContact CG2-CD1 4.38Å; T52-I57 HydrophobicContact CG2-CG2 4.38Å; T52-I57 PolarHBondContact O-N 2.88Å; T52-M59 HydrophobicContact CG2-CE 3.51Å; T52-M59 HydrophobicContact CG2-SD 4.25Å |
| 53 | Q | 95.8 | Very high | 94 | Very high | 98 Ų | 98 | 80.4 Ų | 80.4 | 46% | 0.458 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -67.4 | -39.4 | 172.9 | -70.3 | -152.4 | 100.9 | 0 | 0 | 112.5 | F49 E50 A55 G56 | F49-Q53 HydrophobicContact CE1-CG 4.32Å; F49-Q53 HydrophobicContact CZ-CG 4.2Å; F49-Q53 PolarHBondContact O-N 2.97Å; E50-Q53 PolarHBondContact O-N 3.49Å; Q53-A55 PolarHBondContact O-N 3.39Å; Q53-G56 WeakPolarHBondContact O-CA 3.45Å; Q53-G56 PolarHBondContact O-N 2.93Å |
| 54 | A | 96.6 | Very high | 94.1 | Very high | 85 Ų | 85 | 78.1 Ų | 78.1 | 70% | 0.702 | 45% | 0.445 | S | S | * | . | H | α-helix | trans | -62.7 | -28 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | E50 L51 G56 | E50-A54 WeakPolarHBondContact O-CB 3.38Å; E50-A54 PolarHBondContact O-N 3.32Å; L51-A54 PolarHBondContact O-N 2.93Å; A54-G56 PolarHBondContact O-N 3.15Å |
| 55 | A | 96.5 | Very high | 94.2 | Very high | 75 Ų | 75 | 73.2 Ų | 73.2 | 62% | 0.62 | 42% | 0.422 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -74.6 | 2 | 170.5 | 0 | 0 | 0 | 0 | 0 | 113.6 | L51 T52 Q53 | L51-A55 WeakPolarHBondContact O-CB 3.4Å; L51-A55 PolarHBondContact O-N 2.88Å; T52-A55 WeakPolarHBondContact O-CB 3.28Å; T52-A55 PolarHBondContact O-N 3.3Å; Q53-A55 PolarHBondContact O-N 3.39Å |
| 56 | G | 95.1 | Very high | 94.3 | Very high | 67 Ų | 67 | 76.7 Ų | 76.7 | 69% | 0.691 | 44% | 0.44 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 83.9 | 14.2 | 178.1 | 0 | 0 | 0 | 0 | 0 | 114.3 | Q53 A54 | Q53-G56 WeakPolarHBondContact O-CA 3.45Å; Q53-G56 PolarHBondContact O-N 2.93Å; A54-G56 PolarHBondContact O-N 3.15Å |
| 57 | I | 93.2 | Very high | 94.4 | Very high | 88 Ų | 88 | 77.8 Ų | 77.8 | 45% | 0.451 | 44% | 0.444 | S | S | . | . | trans | -100.9 | 105.5 | 179.9 | -47.4 | 177 | 0 | 0 | 0 | 109.3 | T52 M59 | T52-I57 HydrophobicContact CG2-CB 3.93Å; T52-I57 HydrophobicContact CG2-CD1 4.38Å; T52-I57 HydrophobicContact CG2-CG2 4.38Å; T52-I57 PolarHBondContact O-N 2.88Å; I57-M59 HydrophobicContact CB-CE 4.14Å; I57-M59 HydrophobicContact CG2-CE 3.26Å | ||
| 58 | A | 92.1 | Very high | 94.4 | Very high | 91 Ų | 91 | 72 Ų | 72 | 75% | 0.752 | 42% | 0.418 | S | S | * | . | trans | -86 | 126.4 | 174.9 | 0 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 59 | M | 90.1 | Very high | 94.5 | Very high | 50 Ų | 50 | 70.9 Ų | 70.9 | 25% | 0.246 | 41% | 0.413 | C | S | . | . | trans | -155.7 | 156.5 | 177.2 | 65.4 | -175.6 | 71.6 | 0 | 0 | 111.2 | F49 T52 I57 F64 | F49-M59 HydrophobicContact CE2-CG 4.04Å; F49-M59 WeakPolarHBondContact CE2-O 3.46Å; F49-M59 WeakPolarHBondContact CZ-O 3.47Å; T52-M59 HydrophobicContact CG2-CE 3.51Å; T52-M59 HydrophobicContact CG2-SD 4.25Å; I57-M59 HydrophobicContact CB-CE 4.14Å; I57-M59 HydrophobicContact CG2-CE 3.26Å; M59-F64 HydrophobicContact CG-CB 4.21Å; M59-F64 HydrophobicContact SD-CB 3.75Å; M59-F64 HydrophobicContact SD-CD2 3.83Å; M59-F64 HydrophobicContact SD-CG 4.29Å | ||
| 60 | D | 93.1 | Very high | 94.6 | Very high | 122 Ų | 122 | 73 Ų | 73 | 65% | 0.652 | 42% | 0.424 | S | S | * | . | trans | -66.8 | 147 | 173.3 | -64.1 | -35.8 | 0 | 0 | 0 | 111.3 | E62 V63 F64 | D60-E62 PolarHBondContact O-N 3.47Å; D60-V63 HydrophobicContact CB-CB 4.42Å; D60-V63 HydrophobicContact CB-CG2 4.06Å; D60-V63 PolarHBondContact O-N 3.31Å; D60-V63 VanDerWaalsContact O-N 3.17Å; D60-F64 PolarHBondContact O-N 2.89Å | ||
| 61 | Q | 91.9 | Very high | 94.6 | Very high | 85 Ų | 85 | 70.6 Ų | 70.6 | 40% | 0.397 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -60.1 | -31.5 | 179.1 | -73.2 | -165 | 53.1 | 0 | 0 | 113 | I40 L41 F49 K65 | I40-Q61 HydrophobicContact CG2-CB 3.87Å; L41-Q61 HydrophobicContact CD1-CB 4.24Å; L41-Q61 HydrophobicContact CD1-CG 4.08Å; L41-Q61 VanDerWaalsContact CD1-OE1 3.3Å; L41-Q61 HydrophobicContact CG-CB 4.49Å; F49-Q61 HydrophobicContact CD1-CG 4.17Å; F49-Q61 HydrophobicContact CD2-CG 4.45Å; F49-Q61 HydrophobicContact CE1-CG 3.69Å; F49-Q61 HydrophobicContact CE2-CG 3.99Å; F49-Q61 HydrophobicContact CZ-CG 3.6Å; Q61-K65 WeakPolarHBondContact O-CB 3.41Å; Q61-K65 PolarHBondContact O-N 3.49Å |
| 62 | E | 92.1 | Very high | 94.5 | Very high | 103 Ų | 103 | 71 Ų | 71 | 48% | 0.481 | 41% | 0.412 | S | S | . | . | H | α-helix | trans | -74.4 | -37.7 | 179.5 | -163.5 | 148.3 | -155.6 | 0 | 0 | 111.6 | I40 D60 K65 I66 | I40-E62 HydrophobicContact CD1-CG 4.38Å; D60-E62 PolarHBondContact O-N 3.47Å; E62-K65 PolarHBondContact O-N 3.45Å; E62-I66 HydrophobicContact CG-CD1 4.4Å; E62-I66 WeakPolarHBondContact O-CD1 3.38Å; E62-I66 WeakPolarHBondContact O-CG1 3.34Å; E62-I66 PolarHBondContact O-N 3.25Å |
| 63 | V | 93.7 | Very high | 94.6 | Very high | 61 Ų | 61 | 76.3 Ų | 76.3 | 37% | 0.37 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -63.9 | -44.7 | 173.3 | 177.3 | 0 | 0 | 0 | 0 | 110.5 | D60 K65 I66 I67 | D60-V63 HydrophobicContact CB-CB 4.42Å; D60-V63 HydrophobicContact CB-CG2 4.06Å; D60-V63 PolarHBondContact O-N 3.31Å; D60-V63 VanDerWaalsContact O-N 3.17Å; V63-K65 VanDerWaalsContact C-N 3.34Å; V63-K65 PolarHBondContact O-N 2.91Å; V63-I66 PolarHBondContact O-N 3.05Å; V63-I67 HydrophobicContact CG1-CD1 4.07Å; V63-I67 WeakPolarHBondContact O-CG1 3.25Å; V63-I67 PolarHBondContact O-N 3.07Å |
| 64 | F | 94.9 | Very high | 94.6 | Very high | 11 Ų | 11 | 78.9 Ų | 78.9 | 5% | 0.048 | 45% | 0.454 | C | S | . | . | H | α-helix | trans | -57.7 | -47 | 173.8 | 176.7 | -96.4 | 0 | 0 | 0 | 111.6 | L41 E45 L48 F49 M59 D60 I66 I67 V68 | L41-F64 HydrophobicContact CD1-CD1 4.04Å; L41-F64 HydrophobicContact CD1-CE1 4.38Å; L41-F64 HydrophobicContact CD2-CD1 3.76Å; L41-F64 HydrophobicContact CD2-CE1 4.22Å; E45-F64 HydrophobicContact CB-CE1 4.45Å; E45-F64 WeakPolarHBondContact O-CE1 3.2Å; L48-F64 HydrophobicContact CB-CZ 3.82Å; L48-F64 HydrophobicContact CD2-CZ 3.87Å; L48-F64 HydrophobicContact CG-CE2 4.23Å; L48-F64 HydrophobicContact CG-CZ 3.7Å; F49-F64 HydrophobicContact CB-CD1 3.95Å; F49-F64 HydrophobicContact CB-CE1 3.81Å; F49-F64 HydrophobicContact CB-CE2 4.39Å; F49-F64 HydrophobicContact CB-CG 4.3Å; F49-F64 HydrophobicContact CB-CZ 4.04Å; F49-F64 HydrophobicContact CD2-CB 3.74Å; F49-F64 AromaticContact CD2-CD1 3.98Å; F49-F64 HydrophobicContact CD2-CD1 3.98Å; F49-F64 HydrophobicContact CD2-CD2 4Å; F49-F64 AromaticContact CD2-CG 3.63Å; F49-F64 HydrophobicContact CD2-CG 3.63Å; F49-F64 HydrophobicContact CE2-CB 4.17Å; F49-F64 HydrophobicContact CG-CD1 4.4Å; F49-F64 HydrophobicContact CG-CG 4.44Å; M59-F64 HydrophobicContact CG-CB 4.21Å; M59-F64 HydrophobicContact SD-CB 3.75Å; M59-F64 HydrophobicContact SD-CD2 3.83Å; M59-F64 HydrophobicContact SD-CG 4.29Å; D60-F64 PolarHBondContact O-N 2.89Å; F64-I66 VanDerWaalsContact C-N 3.35Å; F64-I66 PolarHBondContact O-N 3.17Å; F64-I67 PolarHBondContact O-N 3.11Å; F64-V68 HydrophobicContact CD1-CG2 4.19Å; F64-V68 HydrophobicContact CE1-CG2 3.74Å; F64-V68 HydrophobicContact CE2-CG2 4.11Å; F64-V68 HydrophobicContact CZ-CG2 3.69Å; F64-V68 WeakPolarHBondContact O-CG2 3.28Å; F64-V68 PolarHBondContact O-N 3.26Å |
| 65 | K | 94.5 | Very high | 94.7 | Very high | 50 Ų | 50 | 77.2 Ų | 77.2 | 22% | 0.217 | 44% | 0.435 | C | S | . | . | H | α-helix | trans | -59.5 | -44.7 | 177.8 | -170.9 | 178.1 | -175.9 | 74.6 | 0 | 112 | I40 L41 E45 Q61 E62 V63 I67 V68 D69 | I40-K65 HydrophobicContact CG1-CD 3.72Å; I40-K65 VanDerWaalsContact O-CD 3.31Å; I40-K65 WeakPolarHBondContact O-CD 3.25Å; I40-K65 VanDerWaalsContact O-CE 3.3Å; I40-K65 WeakPolarHBondContact O-CE 3.31Å; I40-K65 PolarHBondContact O-NZ 2.96Å; L41-K65 HydrophobicContact CD2-CB 3.82Å; L41-K65 HydrophobicContact CD2-CG 4.26Å; E45-K65 IonicContact OE2-NZ 3.39Å; E45-K65 PolarHBondContact OE2-NZ 3.44Å; Q61-K65 WeakPolarHBondContact O-CB 3.41Å; Q61-K65 PolarHBondContact O-N 3.49Å; E62-K65 PolarHBondContact O-N 3.45Å; V63-K65 VanDerWaalsContact C-N 3.34Å; V63-K65 PolarHBondContact O-N 2.91Å; K65-I67 VanDerWaalsContact C-N 3.35Å; K65-I67 PolarHBondContact O-N 3.45Å; K65-V68 PolarHBondContact O-N 2.95Å; K65-D69 WeakPolarHBondContact O-CB 3.42Å; K65-D69 VanDerWaalsContact O-CG 3.26Å; K65-D69 PolarHBondContact O-N 3.24Å |
| 66 | I | 94.8 | Very high | 94.7 | Very high | 94 Ų | 94 | 76.3 Ų | 76.3 | 48% | 0.482 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -60.3 | -45.8 | 177.4 | -67.5 | 160 | 0 | 0 | 0 | 110.5 | E62 V63 F64 V68 D69 L70 | E62-I66 HydrophobicContact CG-CD1 4.4Å; E62-I66 WeakPolarHBondContact O-CD1 3.38Å; E62-I66 WeakPolarHBondContact O-CG1 3.34Å; E62-I66 PolarHBondContact O-N 3.25Å; V63-I66 PolarHBondContact O-N 3.05Å; F64-I66 VanDerWaalsContact C-N 3.35Å; F64-I66 PolarHBondContact O-N 3.17Å; I66-V68 VanDerWaalsContact C-N 3.34Å; I66-V68 PolarHBondContact O-N 3.47Å; I66-D69 PolarHBondContact O-N 3Å; I66-L70 HydrophobicContact CG2-CD1 4.28Å; I66-L70 HydrophobicContact CG2-CG 4.46Å; I66-L70 VanDerWaalsContact O-CG 3.28Å; I66-L70 WeakPolarHBondContact O-CG 3.11Å; I66-L70 PolarHBondContact O-N 3.43Å |
| 67 | I | 95.6 | Very high | 94.8 | Very high | 42 Ų | 42 | 77.4 Ų | 77.4 | 22% | 0.215 | 42% | 0.422 | C | S | . | . | H | α-helix | trans | -59.6 | -46.8 | 177.6 | -67 | 166.3 | 0 | 0 | 0 | 110.3 | V63 F64 K65 L70 L71 L84 | V63-I67 HydrophobicContact CG1-CD1 4.07Å; V63-I67 WeakPolarHBondContact O-CG1 3.25Å; V63-I67 PolarHBondContact O-N 3.07Å; F64-I67 PolarHBondContact O-N 3.11Å; K65-I67 VanDerWaalsContact C-N 3.35Å; K65-I67 PolarHBondContact O-N 3.45Å; I67-L70 PolarHBondContact O-N 3.3Å; I67-L71 HydrophobicContact CG2-CD1 4.42Å; I67-L71 WeakPolarHBondContact O-CG 3.3Å; I67-L71 PolarHBondContact O-N 2.98Å; I67-L71 VanDerWaalsContact O-N 3.15Å; I67-L84 HydrophobicContact CD1-CD1 4.19Å; I67-L84 HydrophobicContact CG1-CD1 4.38Å |
| 68 | V | 95.2 | Very high | 95 | Very high | 20 Ų | 20 | 79.3 Ų | 79.3 | 12% | 0.121 | 43% | 0.432 | C | S | . | . | H | α-helix | trans | -63.6 | -42.2 | 178.4 | 170.7 | 0 | 0 | 0 | 0 | 111.6 | L48 F64 K65 I66 L70 L71 K72 | L48-V68 HydrophobicContact CD2-CG2 4.49Å; F64-V68 HydrophobicContact CD1-CG2 4.19Å; F64-V68 HydrophobicContact CE1-CG2 3.74Å; F64-V68 HydrophobicContact CE2-CG2 4.11Å; F64-V68 HydrophobicContact CZ-CG2 3.69Å; F64-V68 WeakPolarHBondContact O-CG2 3.28Å; F64-V68 PolarHBondContact O-N 3.26Å; K65-V68 PolarHBondContact O-N 2.95Å; I66-V68 VanDerWaalsContact C-N 3.34Å; I66-V68 PolarHBondContact O-N 3.47Å; V68-L70 PolarHBondContact O-N 2.91Å; V68-L71 PolarHBondContact O-N 3.45Å; V68-K72 HydrophobicContact CG1-CD 3.64Å; V68-K72 HydrophobicContact CG1-CG 4.42Å; V68-K72 VanDerWaalsContact O-CG 3.3Å; V68-K72 WeakPolarHBondContact O-CG 3.31Å; V68-K72 PolarHBondContact O-N 3.02Å |
| 69 | D | 96 | Very high | 95.2 | Very high | 61 Ų | 61 | 76.9 Ų | 76.9 | 33% | 0.326 | 41% | 0.412 | S | S | . | . | H | α-helix | trans | -65.6 | -37.6 | 178.8 | -74.3 | -18 | 0 | 0 | 0 | 111.6 | K65 I66 L71 K72 M73 | K65-D69 WeakPolarHBondContact O-CB 3.42Å; K65-D69 VanDerWaalsContact O-CG 3.26Å; K65-D69 PolarHBondContact O-N 3.24Å; I66-D69 PolarHBondContact O-N 3Å; D69-L71 VanDerWaalsContact C-N 3.35Å; D69-L71 PolarHBondContact O-N 3.28Å; D69-K72 PolarHBondContact O-N 3.39Å; D69-K72 IonicContact OD1-NZ 3.85Å; D69-M73 WeakPolarHBondContact O-CB 3.32Å; D69-M73 PolarHBondContact O-N 2.78Å |
| 70 | L | 97.3 | Very high | 95.5 | Very high | 62 Ų | 62 | 75.1 Ų | 75.1 | 33% | 0.325 | 40% | 0.404 | S | S | . | . | H | α-helix | trans | -62.1 | -42 | 173.1 | -71.7 | 176 | 0 | 0 | 0 | 112 | I66 I67 V68 M73 V75 V80 | I66-L70 HydrophobicContact CG2-CD1 4.28Å; I66-L70 HydrophobicContact CG2-CG 4.46Å; I66-L70 VanDerWaalsContact O-CG 3.28Å; I66-L70 WeakPolarHBondContact O-CG 3.11Å; I66-L70 PolarHBondContact O-N 3.43Å; I67-L70 PolarHBondContact O-N 3.3Å; V68-L70 PolarHBondContact O-N 2.91Å; L70-M73 WeakPolarHBondContact O-CB 3.05Å; L70-M73 PolarHBondContact O-N 3.3Å; L70-V75 HydrophobicContact CB-CB 4.46Å; L70-V75 HydrophobicContact CD2-CG2 4.39Å; L70-V75 VanDerWaalsContact O-CB 3.3Å; L70-V75 WeakPolarHBondContact O-CB 3.44Å; L70-V75 WeakPolarHBondContact O-CG2 3.49Å; L70-V75 PolarHBondContact O-N 3.28Å; L70-V75 VanDerWaalsContact O-N 3.1Å; L70-V80 HydrophobicContact CB-CG2 4.25Å; L70-V80 HydrophobicContact CD1-CG1 4.31Å; L70-V80 HydrophobicContact CD1-CG2 4.33Å |
| 71 | L | 95.9 | Very high | 95.6 | Very high | 73 Ų | 73 | 75.4 Ų | 75.4 | 38% | 0.382 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -66.4 | -41.3 | 176.8 | -65.3 | 176.1 | 0 | 0 | 0 | 111.2 | I67 V68 D69 M73 N74 P77 V80 | I67-L71 HydrophobicContact CG2-CD1 4.42Å; I67-L71 WeakPolarHBondContact O-CG 3.3Å; I67-L71 PolarHBondContact O-N 2.98Å; I67-L71 VanDerWaalsContact O-N 3.15Å; V68-L71 PolarHBondContact O-N 3.45Å; D69-L71 VanDerWaalsContact C-N 3.35Å; D69-L71 PolarHBondContact O-N 3.28Å; L71-M73 PolarHBondContact O-N 2.9Å; L71-N74 PolarHBondContact O-N 3.3Å; L71-P77 HydrophobicContact CD2-CB 4.02Å; L71-P77 HydrophobicContact CD2-CG 3.82Å; L71-V80 HydrophobicContact CD2-CG2 4.5Å |
| 72 | K | 94.9 | Very high | 95.8 | Very high | 127 Ų | 127 | 77.4 Ų | 77.4 | 55% | 0.552 | 41% | 0.409 | S | S | * | . | H | α-helix | trans | -64.1 | -28.7 | 174.6 | -71.2 | 162.6 | 76.4 | -178.5 | 0 | 112.2 | E45 V68 D69 N74 | E45-K72 IonicContact OE1-NZ 2.88Å; E45-K72 PolarHBondContact OE1-NZ 3.32Å; V68-K72 HydrophobicContact CG1-CD 3.64Å; V68-K72 HydrophobicContact CG1-CG 4.42Å; V68-K72 VanDerWaalsContact O-CG 3.3Å; V68-K72 WeakPolarHBondContact O-CG 3.31Å; V68-K72 PolarHBondContact O-N 3.02Å; D69-K72 PolarHBondContact O-N 3.39Å; D69-K72 IonicContact OD1-NZ 3.85Å; K72-N74 PolarHBondContact O-N 3.29Å |
| 73 | M | 97.4 | Very high | 95.9 | Very high | 138 Ų | 138 | 76.2 Ų | 76.2 | 68% | 0.68 | 41% | 0.409 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -74.9 | 5.5 | 170.7 | -97.4 | -178.4 | 56.2 | 0 | 0 | 114.5 | D69 L70 L71 V75 | D69-M73 WeakPolarHBondContact O-CB 3.32Å; D69-M73 PolarHBondContact O-N 2.78Å; L70-M73 WeakPolarHBondContact O-CB 3.05Å; L70-M73 PolarHBondContact O-N 3.3Å; L71-M73 PolarHBondContact O-N 2.9Å; M73-V75 VanDerWaalsContact C-N 3.28Å; M73-V75 HydrophobicContact CB-CG2 4.46Å; M73-V75 PolarHBondContact O-N 2.84Å |
| 74 | N | 96.1 | Very high | 95.9 | Very high | 152 Ų | 152 | 76.4 Ų | 76.4 | 81% | 0.813 | 41% | 0.408 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 65.5 | 24 | -176.2 | -55 | -77.6 | 0 | 0 | 0 | 114.5 | L71 K72 | L71-N74 PolarHBondContact O-N 3.3Å; K72-N74 PolarHBondContact O-N 3.29Å |
| 75 | V | 98.3 | Very high | 95.7 | Very high | 50 Ų | 50 | 83 Ų | 83 | 30% | 0.303 | 44% | 0.436 | S | S | . | . | trans | -71.5 | 130.9 | 167 | -176.6 | 0 | 0 | 0 | 0 | 108.5 | L70 M73 A79 V80 | L70-V75 HydrophobicContact CB-CB 4.46Å; L70-V75 HydrophobicContact CD2-CG2 4.39Å; L70-V75 VanDerWaalsContact O-CB 3.3Å; L70-V75 WeakPolarHBondContact O-CB 3.44Å; L70-V75 WeakPolarHBondContact O-CG2 3.49Å; L70-V75 PolarHBondContact O-N 3.28Å; L70-V75 VanDerWaalsContact O-N 3.1Å; M73-V75 VanDerWaalsContact C-N 3.28Å; M73-V75 HydrophobicContact CB-CG2 4.46Å; M73-V75 PolarHBondContact O-N 2.84Å; V75-A79 HydrophobicContact CG1-CB 4.36Å; V75-V80 HydrophobicContact CB-CG2 4.3Å; V75-V80 HydrophobicContact CG1-CG2 3.73Å | ||
| 76 | A | 97.7 | Very high | 95.5 | Very high | 55 Ų | 55 | 84 Ų | 84 | 46% | 0.455 | 45% | 0.454 | S | S | . | . | trans | -60.6 | 132.7 | -178.7 | 0 | 0 | 0 | 0 | 0 | 111.2 | L78 A79 V80 | A76-L78 PolarHBondContact O-N 3.01Å; A76-L78 VanDerWaalsContact O-N 3.11Å; A76-A79 HydrophobicContact CB-CB 4.34Å; A76-A79 WeakPolarHBondContact O-CB 3.42Å; A76-A79 PolarHBondContact O-N 3.25Å; A76-V80 PolarHBondContact O-N 3.24Å | ||
| 77 | P | 96.1 | Very high | 95.1 | Very high | 90 Ų | 90 | 84.7 Ų | 84.7 | 58% | 0.584 | 46% | 0.456 | S | S | * | . | H | α-helix | trans | -55.7 | -35.2 | -179.3 | -23.7 | 29.2 | 0 | 0 | 0 | 113.2 | L71 A79 V80 F81 | L71-P77 HydrophobicContact CD2-CB 4.02Å; L71-P77 HydrophobicContact CD2-CG 3.82Å; P77-A79 VanDerWaalsContact C-N 3.31Å; P77-A79 PolarHBondContact O-N 3.42Å; P77-V80 PolarHBondContact O-N 2.91Å; P77-F81 WeakPolarHBondContact O-CB 3.44Å; P77-F81 PolarHBondContact O-N 3.19Å |
| 78 | L | 97.2 | Very high | 94.4 | Very high | 129 Ų | 129 | 87 Ų | 87 | 68% | 0.675 | 48% | 0.475 | S | S | * | . | H | α-helix | trans | -64.7 | -33.6 | 176.5 | -63.6 | 178.8 | 0 | 0 | 0 | 112.7 | A76 Q82 | A76-L78 PolarHBondContact O-N 3.01Å; A76-L78 VanDerWaalsContact O-N 3.11Å; L78-Q82 WeakPolarHBondContact O-CB 3.43Å; L78-Q82 WeakPolarHBondContact O-CG 3.27Å; L78-Q82 PolarHBondContact O-N 3.26Å; L78-Q82 PolarHBondContact O-NE2 3.03Å |
| 79 | A | 97 | Very high | 93 | Very high | 39 Ų | 39 | 90.4 Ų | 90.4 | 32% | 0.322 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -71.6 | -43.5 | 177.1 | 0 | 0 | 0 | 0 | 0 | 110.7 | V75 A76 P77 F81 Q82 T83 | V75-A79 HydrophobicContact CG1-CB 4.36Å; A76-A79 HydrophobicContact CB-CB 4.34Å; A76-A79 WeakPolarHBondContact O-CB 3.42Å; A76-A79 PolarHBondContact O-N 3.25Å; P77-A79 VanDerWaalsContact C-N 3.31Å; P77-A79 PolarHBondContact O-N 3.42Å; A79-F81 VanDerWaalsContact C-N 3.33Å; A79-F81 PolarHBondContact O-N 3.44Å; A79-Q82 PolarHBondContact O-N 3.39Å; A79-T83 WeakPolarHBondContact O-CB 3.48Å; A79-T83 PolarHBondContact O-N 3.17Å; A79-T83 PolarHBondContact O-OG1 2.93Å |
| 80 | V | 96.6 | Very high | 91.3 | Very high | 13 Ų | 13 | 90.3 Ų | 90.3 | 8% | 0.079 | 52% | 0.519 | C | S | . | . | H | α-helix | trans | -59.2 | -46.7 | 175.2 | -176.8 | 0 | 0 | 0 | 0 | 110.4 | L70 L71 V75 A76 P77 Q82 T83 L84 | L70-V80 HydrophobicContact CB-CG2 4.25Å; L70-V80 HydrophobicContact CD1-CG1 4.31Å; L70-V80 HydrophobicContact CD1-CG2 4.33Å; L71-V80 HydrophobicContact CD2-CG2 4.5Å; V75-V80 HydrophobicContact CB-CG2 4.3Å; V75-V80 HydrophobicContact CG1-CG2 3.73Å; A76-V80 PolarHBondContact O-N 3.24Å; P77-V80 PolarHBondContact O-N 2.91Å; V80-Q82 PolarHBondContact O-N 3.27Å; V80-T83 PolarHBondContact O-N 3.2Å; V80-L84 HydrophobicContact CG1-CD1 3.83Å; V80-L84 HydrophobicContact CG1-CG 4.34Å; V80-L84 WeakPolarHBondContact O-CB 3.38Å; V80-L84 VanDerWaalsContact O-CG 3.28Å; V80-L84 WeakPolarHBondContact O-CG 3.22Å; V80-L84 PolarHBondContact O-N 2.9Å |
| 81 | F | 94.4 | Very high | 89.6 | Confident | 129 Ų | 129 | 94 Ų | 94 | 57% | 0.566 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -59.9 | -46.1 | 177.3 | 178.8 | -106.9 | 0 | 0 | 0 | 112.8 | P77 A79 L84 K85 | P77-F81 WeakPolarHBondContact O-CB 3.44Å; P77-F81 PolarHBondContact O-N 3.19Å; A79-F81 VanDerWaalsContact C-N 3.33Å; A79-F81 PolarHBondContact O-N 3.44Å; F81-L84 PolarHBondContact O-N 3.25Å; F81-K85 HydrophobicContact CE1-CD 4.36Å; F81-K85 VanDerWaalsContact O-CB 3.27Å; F81-K85 WeakPolarHBondContact O-CB 3.4Å; F81-K85 PolarHBondContact O-N 3.38Å |
| 82 | Q | 95.6 | Very high | 87.6 | Confident | 126 Ų | 126 | 102.1 Ų | 102.1 | 59% | 0.589 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -64.9 | -43 | 179.7 | -76.2 | 176.4 | 101.7 | 0 | 0 | 112 | L78 A79 V80 K85 A86 | L78-Q82 WeakPolarHBondContact O-CB 3.43Å; L78-Q82 WeakPolarHBondContact O-CG 3.27Å; L78-Q82 PolarHBondContact O-N 3.26Å; L78-Q82 PolarHBondContact O-NE2 3.03Å; A79-Q82 PolarHBondContact O-N 3.39Å; V80-Q82 PolarHBondContact O-N 3.27Å; Q82-K85 PolarHBondContact O-N 3.06Å; Q82-A86 WeakPolarHBondContact O-CB 3.21Å; Q82-A86 PolarHBondContact O-N 3.32Å |
| 83 | T | 94.9 | Very high | 85.5 | Confident | 79 Ų | 79 | 103 Ų | 103 | 49% | 0.485 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -63.7 | -48.6 | 177.2 | -56.8 | 0 | 0 | 0 | 0 | 110.7 | A79 V80 K85 A86 M87 | A79-T83 WeakPolarHBondContact O-CB 3.48Å; A79-T83 PolarHBondContact O-N 3.17Å; A79-T83 PolarHBondContact O-OG1 2.93Å; V80-T83 PolarHBondContact O-N 3.2Å; T83-K85 VanDerWaalsContact C-N 3.34Å; T83-K85 PolarHBondContact O-N 2.86Å; T83-A86 PolarHBondContact O-N 3.35Å; T83-M87 HydrophobicContact CG2-CE 3.95Å; T83-M87 HydrophobicContact CG2-CG 4.41Å; T83-M87 HydrophobicContact CG2-SD 4.04Å; T83-M87 WeakPolarHBondContact O-CB 3.5Å; T83-M87 VanDerWaalsContact O-CG 3.22Å; T83-M87 WeakPolarHBondContact O-CG 3.39Å; T83-M87 PolarHBondContact O-N 3.15Å |
| 84 | L | 92.9 | Very high | 82.7 | Confident | 65 Ų | 65 | 100.7 Ų | 100.7 | 34% | 0.34 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -56.5 | -46.6 | 174.9 | -71.5 | 170.8 | 0 | 0 | 0 | 111.6 | I67 V80 F81 A86 M87 C88 | I67-L84 HydrophobicContact CD1-CD1 4.19Å; I67-L84 HydrophobicContact CG1-CD1 4.38Å; V80-L84 HydrophobicContact CG1-CD1 3.83Å; V80-L84 HydrophobicContact CG1-CG 4.34Å; V80-L84 WeakPolarHBondContact O-CB 3.38Å; V80-L84 VanDerWaalsContact O-CG 3.28Å; V80-L84 WeakPolarHBondContact O-CG 3.22Å; V80-L84 PolarHBondContact O-N 2.9Å; F81-L84 PolarHBondContact O-N 3.25Å; L84-A86 PolarHBondContact O-N 3.33Å; L84-M87 HydrophobicContact CD2-CE 3.73Å; L84-M87 HydrophobicContact CG-CE 4.36Å; L84-M87 PolarHBondContact O-N 3.43Å; L84-C88 PolarHBondContact O-N 2.98Å; L84-C88 PolarHBondContact O-SG 2.78Å |
| 85 | K | 91.1 | Very high | 80.2 | Confident | 148 Ų | 148 | 100.4 Ų | 100.4 | 64% | 0.643 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -61.2 | -42.3 | 178.3 | -176.6 | 178.6 | 176.5 | 179.3 | 0 | 112.7 | F81 Q82 T83 | F81-K85 HydrophobicContact CE1-CD 4.36Å; F81-K85 VanDerWaalsContact O-CB 3.27Å; F81-K85 WeakPolarHBondContact O-CB 3.4Å; F81-K85 PolarHBondContact O-N 3.38Å; Q82-K85 PolarHBondContact O-N 3.06Å; T83-K85 VanDerWaalsContact C-N 3.34Å; T83-K85 PolarHBondContact O-N 2.86Å |
| 86 | A | 90.9 | Very high | 77.7 | Confident | 71 Ų | 71 | 105 Ų | 105 | 59% | 0.587 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -68.8 | -36.2 | 177.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | Q82 T83 L84 A89 | Q82-A86 WeakPolarHBondContact O-CB 3.21Å; Q82-A86 PolarHBondContact O-N 3.32Å; T83-A86 PolarHBondContact O-N 3.35Å; L84-A86 PolarHBondContact O-N 3.33Å; A86-A89 WeakPolarHBondContact O-CB 3.4Å; A86-A89 PolarHBondContact O-N 3.26Å |
| 87 | M | 85.9 | Confident | 75 | Confident | 110 Ų | 110 | 107.6 Ų | 107.6 | 54% | 0.542 | 61% | 0.614 | S | S | . | * | H | α-helix | trans | -68.3 | -32.5 | 177.4 | -70.9 | -174.1 | -52.5 | 0 | 0 | 112.5 | T83 L84 A89 Q91 | T83-M87 HydrophobicContact CG2-CE 3.95Å; T83-M87 HydrophobicContact CG2-CG 4.41Å; T83-M87 HydrophobicContact CG2-SD 4.04Å; T83-M87 WeakPolarHBondContact O-CB 3.5Å; T83-M87 VanDerWaalsContact O-CG 3.22Å; T83-M87 WeakPolarHBondContact O-CG 3.39Å; T83-M87 PolarHBondContact O-N 3.15Å; L84-M87 HydrophobicContact CD2-CE 3.73Å; L84-M87 HydrophobicContact CG-CE 4.36Å; L84-M87 PolarHBondContact O-N 3.43Å; M87-A89 VanDerWaalsContact C-N 3.26Å; M87-A89 PolarHBondContact O-N 3.01Å; M87-Q91 PolarHBondContact O-OE1 2.99Å |
| 88 | C | 80.3 | Confident | 72.6 | Confident | 89 Ų | 89 | 112.5 Ų | 112.5 | 60% | 0.601 | 63% | 0.631 | S | S | * | * | G | 310 helix | trans | -71.2 | -15.8 | 176.2 | -64.9 | 0 | 0 | 0 | 0 | 114.2 | L84 G90 Q91 | L84-C88 PolarHBondContact O-N 2.98Å; L84-C88 PolarHBondContact O-SG 2.78Å; C88-G90 PolarHBondContact O-N 3.11Å; C88-G90 VanDerWaalsContact O-N 3.15Å; C88-Q91 PolarHBondContact O-N 3.19Å |
| 89 | A | 66.4 | Low | 69.7 | Low | 92 Ų | 92 | 110 Ų | 110 | 76% | 0.76 | 64% | 0.637 | S | S | * | * | G | 310 helix | trans | -71.1 | -6.1 | -174.4 | 0 | 0 | 0 | 0 | 0 | 114.9 | A86 M87 | A86-A89 WeakPolarHBondContact O-CB 3.4Å; A86-A89 PolarHBondContact O-N 3.26Å; M87-A89 VanDerWaalsContact C-N 3.26Å; M87-A89 PolarHBondContact O-N 3.01Å |
| 90 | G | 60 | Low | 67.1 | Low | 59 Ų | 59 | 115.3 Ų | 115.3 | 61% | 0.608 | 66% | 0.659 | S | S | * | * | G | 310 helix | trans | -109.4 | -6.2 | 176.3 | 0 | 0 | 0 | 0 | 0 | 115.1 | C88 | C88-G90 PolarHBondContact O-N 3.11Å; C88-G90 VanDerWaalsContact O-N 3.15Å |
| 91 | Q | 62.3 | Low | 64.3 | Low | 141 Ų | 141 | 120.3 Ų | 120.3 | 66% | 0.659 | 70% | 0.695 | S | S | * | * | trans | -121.2 | 100.3 | -171.8 | -88.3 | 66 | 48.8 | 0 | 0 | 110.5 | M87 C88 I93 | M87-Q91 PolarHBondContact O-OE1 2.99Å; C88-Q91 PolarHBondContact O-N 3.19Å; Q91-I93 PolarHBondContact O-N 3.03Å | ||
| 92 | R | 52.5 | Low | 61.8 | Low | 243 Ų | 243 | 119.3 Ų | 119.3 | 92% | 0.917 | 70% | 0.704 | S | S | * | * | trans | -69 | 111 | 164.9 | 57.3 | -147.4 | -121.1 | -94.5 | 2.2 | 108.6 | A94 | R92-A94 PolarHBondContact O-N 2.9Å; R92-A94 VanDerWaalsContact O-N 3.09Å | ||
| 93 | I | 51 | Low | 59.2 | Low | 146 Ų | 146 | 120 Ų | 120 | 75% | 0.749 | 72% | 0.717 | S | S | * | * | trans | -57.3 | 110.5 | 177.7 | -62.7 | 140.3 | 0 | 0 | 0 | 107.6 | Q91 | Q91-I93 PolarHBondContact O-N 3.03Š| ||
| 94 | A | 40 | Very low | 56.5 | Low | 88 Ų | 88 | 120.1 Ų | 120.1 | 73% | 0.727 | 73% | 0.726 | S | S | * | * | trans | -83.7 | 110.8 | 158.4 | 0 | 0 | 0 | 0 | 0 | 105.6 | R92 T96 | R92-A94 PolarHBondContact O-N 2.9Å; R92-A94 VanDerWaalsContact O-N 3.09Å; A94-T96 PolarHBondContact O-N 3.03Å | ||
| 95 | D | 43 | Very low | 53.6 | Low | 146 Ų | 146 | 122.3 Ų | 122.3 | 78% | 0.781 | 75% | 0.747 | S | S | * | * | trans | -53.7 | 119.4 | -175.8 | -59.7 | -69.6 | 0 | 0 | 0 | 111.8 | ||||
| 96 | T | 46.5 | Very low | 51.2 | Low | 146 Ų | 146 | 126 Ų | 126 | 90% | 0.896 | 76% | 0.759 | S | S | * | * | trans | -99 | 84.6 | 164 | 59.6 | 0 | 0 | 0 | 0 | 108.7 | A94 | A94-T96 PolarHBondContact O-N 3.03Š| ||
| 97 | S | 40 | Very low | 49.3 | Very low | 111 Ų | 111 | 128.1 Ų | 128.1 | 78% | 0.776 | 77% | 0.766 | S | S | * | * | trans | -130.4 | 98.7 | 160.4 | -175.7 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 98 | M | 45.8 | Very low | 46.9 | Very low | 192 Ų | 192 | 129.8 Ų | 129.8 | 95% | 0.946 | 78% | 0.777 | S | S | * | * | trans | 39 | 112.2 | 149.6 | -120.9 | 178.6 | 70.2 | 0 | 0 | 119.1 | ||||
| 99 | G | 35.8 | Very low | 44.7 | Very low | 77 Ų | 77 | 131 Ų | 131 | 79% | 0.794 | 78% | 0.782 | S | S | * | * | trans | 165.2 | 110.2 | 160.3 | 0 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 100 | D | 42.7 | Very low | 43.4 | Very low | 150 Ų | 150 | 132.2 Ų | 132.2 | 80% | 0.802 | 78% | 0.78 | S | S | * | * | trans | -39.4 | 124.6 | 169.7 | -169.2 | -37.4 | 0 | 0 | 0 | 114.9 | ||||
| 101 | S | 37.2 | Very low | 42.3 | Very low | 118 Ų | 118 | 135.3 Ų | 135.3 | 83% | 0.825 | 79% | 0.787 | S | S | * | * | trans | -169.5 | 131.9 | 136.9 | -93.3 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 102 | S | 42.3 | Very low | 41.1 | Very low | 108 Ų | 108 | 134.7 Ų | 134.7 | 76% | 0.755 | 79% | 0.794 | S | S | * | * | trans | -65.3 | 157.8 | -177.1 | -64.4 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 103 | T | 42.2 | Very low | 40.5 | Very low | 140 Ų | 140 | 129.1 Ų | 129.1 | 86% | 0.859 | 79% | 0.786 | S | S | * | * | trans | 64.5 | 117.5 | 146.6 | -106.3 | 0 | 0 | 0 | 0 | 118.6 | ||||
| 104 | A | 37.3 | Very low | 39.7 | Very low | 83 Ų | 83 | 128.6 Ų | 128.6 | 69% | 0.686 | 79% | 0.79 | S | S | * | * | trans | 166.4 | 91.2 | 136 | 0 | 0 | 0 | 0 | 0 | 107.2 | ||||
| 105 | S | 33.3 | Very low | 39.6 | Very low | 111 Ų | 111 | 128.9 Ų | 128.9 | 78% | 0.776 | 79% | 0.793 | S | S | * | * | 72.2 | 101 | 102.7 | 66.1 | 0 | 0 | 0 | 0 | 114.2 | |||||
| 106 | Y | 40.1 | Very low | 39.8 | Very low | 226 Ų | 226 | 127.5 Ų | 127.5 | 89% | 0.886 | 79% | 0.792 | S | S | * | * | trans | -49.8 | 155 | 137.7 | -60.5 | -83 | 0 | 0 | 0 | 109 | ||||
| 107 | P | 50.4 | Low | 39.4 | Very low | 114 Ų | 114 | 127.7 Ų | 127.7 | 74% | 0.74 | 79% | 0.793 | S | S | * | * | cis | -143.6 | 168 | 32.7 | 38.7 | -19.5 | 0 | 0 | 0 | 115.1 | ||||
| 108 | N | 35.9 | Very low | 39.2 | Very low | 145 Ų | 145 | 130.8 Ų | 130.8 | 78% | 0.775 | 80% | 0.795 | S | S | * | * | -162.6 | 131.3 | 122.8 | -140.4 | -3.6 | 0 | 0 | 0 | 115.1 | |||||
| 109 | T | 33.5 | Very low | 39.4 | Very low | 114 Ų | 114 | 126.3 Ų | 126.3 | 70% | 0.699 | 78% | 0.781 | S | S | * | * | trans | 59 | 110.3 | 143.9 | 21.5 | 0 | 0 | 0 | 0 | 123.6 | ||||
| 110 | T | 40 | Very low | 39.3 | Very low | 119 Ų | 119 | 133.2 Ų | 133.2 | 73% | 0.73 | 78% | 0.783 | S | S | * | * | trans | -57.7 | 154.9 | 142.2 | -34.3 | 0 | 0 | 0 | 0 | 113 | ||||
| 111 | T | 36.3 | Very low | 39.2 | Very low | 123 Ų | 123 | 133.4 Ų | 133.4 | 76% | 0.755 | 78% | 0.779 | S | S | * | * | trans | 74.6 | 125.4 | 165.1 | 64.6 | 0 | 0 | 0 | 0 | 115.7 | ||||
| 112 | T | 38 | Very low | 39 | Very low | 129 Ų | 129 | 136.6 Ų | 136.6 | 79% | 0.791 | 78% | 0.781 | S | S | * | * | -168.2 | 144.6 | 61.8 | -49.8 | 0 | 0 | 0 | 0 | 110.8 | |||||
| 113 | T | 40.2 | Very low | 38.7 | Very low | 125 Ų | 125 | 138.2 Ų | 138.2 | 77% | 0.767 | 78% | 0.781 | S | S | * | * | trans | -67.1 | 136.5 | 168 | -141.1 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 114 | T | 33 | Very low | 38.7 | Very low | 135 Ų | 135 | 137 Ų | 137 | 83% | 0.828 | 78% | 0.778 | S | S | * | * | trans | 162.9 | 113 | 144.5 | 31.3 | 0 | 0 | 0 | 0 | 110 | ||||
| 115 | A | 38.5 | Very low | 38.7 | Very low | 95 Ų | 95 | 138.6 Ų | 138.6 | 79% | 0.785 | 78% | 0.779 | S | S | * | * | trans | -86.8 | -175 | 163.2 | 0 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 116 | P | 47.3 | Very low | 38.8 | Very low | 116 Ų | 116 | 140.1 Ų | 140.1 | 75% | 0.753 | 78% | 0.783 | S | S | * | * | cis | -133.2 | 161.5 | -17.1 | 36.9 | -20.6 | 0 | 0 | 0 | 112.7 | ||||
| 117 | T | 37.2 | Very low | 38.8 | Very low | 150 Ų | 150 | 135.2 Ų | 135.2 | 92% | 0.92 | 78% | 0.782 | S | S | * | * | trans | -156.7 | 140.1 | 152 | -63.9 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 118 | E | 35.4 | Very low | 38.1 | Very low | 176 Ų | 176 | 133.1 Ų | 133.1 | 82% | 0.822 | 78% | 0.781 | S | S | * | * | trans | -59.8 | 167.6 | -161.8 | -100.2 | -125.1 | 118.1 | 0 | 0 | 120.7 | ||||
| 119 | P | 50.7 | Low | 38.2 | Very low | 99 Ų | 99 | 132.8 Ų | 132.8 | 64% | 0.643 | 78% | 0.784 | S | S | * | * | trans | -83.5 | 149.7 | 176.6 | 35.9 | -26.2 | 0 | 0 | 0 | 111.5 | ||||
| 120 | R | 33 | Very low | 38.4 | Very low | 221 Ų | 221 | 136.1 Ų | 136.1 | 83% | 0.834 | 79% | 0.789 | S | S | * | * | trans | -151.3 | 131.7 | 167.8 | -165.9 | 168.8 | 173.3 | 163.4 | -2.7 | 112.9 | ||||
| 121 | E | 41 | Very low | 38.5 | Very low | 154 Ų | 154 | 135.2 Ų | 135.2 | 72% | 0.72 | 79% | 0.788 | S | S | * | * | trans | -45.7 | 149.6 | 170.4 | 59.8 | -118.4 | 63.1 | 0 | 0 | 116.2 | ||||
| 122 | E | 34.3 | Very low | 38.6 | Very low | 186 Ų | 186 | 139.8 Ų | 139.8 | 87% | 0.869 | 80% | 0.798 | S | S | * | * | -160.8 | 125.9 | 120.4 | -138.1 | -161.2 | 124.5 | 0 | 0 | 113 | |||||
| 123 | D | 35 | Very low | 38.9 | Very low | 141 Ų | 141 | 142.9 Ų | 142.9 | 75% | 0.754 | 80% | 0.8 | S | S | * | * | trans | -45.7 | 136.2 | 160.2 | -126.4 | -102 | 0 | 0 | 0 | 112 | ||||
| 124 | S | 41.5 | Very low | 39.2 | Very low | 114 Ų | 114 | 142.6 Ų | 142.6 | 80% | 0.797 | 80% | 0.8 | S | S | * | * | trans | -127 | 84.6 | 162.4 | -152.6 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 125 | V | 37.2 | Very low | 39.7 | Very low | 118 Ų | 118 | 142.2 Ų | 142.2 | 72% | 0.715 | 80% | 0.8 | S | S | * | * | trans | 42.2 | 109.9 | 142 | -73.3 | 0 | 0 | 0 | 0 | 119.3 | ||||
| 126 | V | 37.2 | Very low | 39.9 | Very low | 142 Ų | 142 | 142.3 Ų | 142.3 | 86% | 0.861 | 80% | 0.801 | S | S | * | * | trans | -43.4 | 137.3 | 153.8 | 74.6 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 127 | S | 39.1 | Very low | 40.1 | Very low | 124 Ų | 124 | 142.1 Ų | 142.1 | 87% | 0.867 | 80% | 0.8 | S | S | * | * | trans | -138.1 | 103.5 | 160 | -135.6 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 128 | G | 34.8 | Very low | 40.4 | Very low | 70 Ų | 70 | 141.2 Ų | 141.2 | 72% | 0.722 | 80% | 0.796 | S | S | * | * | 71.3 | 95.9 | 122.3 | 0 | 0 | 0 | 0 | 0 | 119.4 | |||||
| 129 | T | 39.2 | Very low | 40.7 | Very low | 137 Ų | 137 | 140.6 Ų | 140.6 | 84% | 0.84 | 80% | 0.798 | S | S | * | * | trans | -53.7 | 138 | 161 | 49 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 130 | K | 37.2 | Very low | 40 | Very low | 185 Ų | 185 | 142.1 Ų | 142.1 | 80% | 0.804 | 81% | 0.806 | S | S | * | * | 175.2 | 107.5 | 128.3 | 52 | -160.8 | 173.3 | -177.9 | 0 | 114.7 | |||||
| 131 | S | 42.6 | Very low | 40.2 | Very low | 100 Ų | 100 | 136.8 Ų | 136.8 | 70% | 0.699 | 80% | 0.802 | S | S | * | * | trans | 33 | 112.8 | 137.5 | 52.6 | 0 | 0 | 0 | 0 | 121.1 | ||||
| 132 | F | 39.3 | Very low | 39.9 | Very low | 218 Ų | 218 | 134.4 Ų | 134.4 | 96% | 0.956 | 80% | 0.802 | S | S | * | * | trans | -150.2 | 145.4 | 142.3 | -78.8 | -72.3 | 0 | 0 | 0 | 112.3 | ||||
| 133 | K | 44.3 | Very low | 39.8 | Very low | 195 Ų | 195 | 131.3 Ų | 131.3 | 85% | 0.848 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -81.9 | 146.2 | -166.4 | -179.7 | 173.4 | -179.8 | 178.5 | 0 | 112.7 | ||
| 134 | P | 46.3 | Very low | 39.8 | Very low | 118 Ų | 118 | 130.5 Ų | 130.5 | 77% | 0.766 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -87.2 | 140.6 | 176.3 | 32.9 | -31.5 | 0 | 0 | 0 | 112.5 | ||
| 135 | P | 42.2 | Very low | 39.6 | Very low | 127 Ų | 127 | 129.9 Ų | 129.9 | 83% | 0.825 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -91.2 | 148.6 | 162 | 32.8 | -26.6 | 0 | 0 | 0 | 112.1 | ||
| 136 | A | 42.8 | Very low | 39.6 | Very low | 97 Ų | 97 | 130 Ų | 130 | 80% | 0.802 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -75.1 | 167.4 | -175.9 | 0 | 0 | 0 | 0 | 0 | 113.8 | ||
| 137 | P | 52.7 | Low | 39.6 | Very low | 113 Ų | 113 | 129.3 Ų | 129.3 | 73% | 0.734 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -93.9 | 162.8 | -163 | 37.4 | -33.9 | 0 | 0 | 0 | 114.3 | ||
| 138 | P | 42.3 | Very low | 39.7 | Very low | 130 Ų | 130 | 128.6 Ų | 128.6 | 84% | 0.844 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -87.3 | 131.6 | 161.9 | 32.7 | -27.8 | 0 | 0 | 0 | 111.8 | ||
| 139 | L | 41.7 | Very low | 40 | Very low | 164 Ų | 164 | 128.8 Ų | 128.8 | 86% | 0.859 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -80.7 | 144 | 167 | -69.6 | 154.5 | 0 | 0 | 0 | 109.9 | ||
| 140 | T | 35.7 | Very low | 40.4 | Very low | 131 Ų | 131 | 128.4 Ų | 128.4 | 80% | 0.804 | 80% | 0.804 | S | S | * | * | trans | -168.4 | 121.9 | 130 | 50.5 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 141 | S | 37.8 | Very low | 40.9 | Very low | 108 Ų | 108 | 130.7 Ų | 130.7 | 76% | 0.755 | 81% | 0.807 | S | S | * | * | trans | 45.4 | 117.2 | 141.9 | 60.7 | 0 | 0 | 0 | 0 | 121.4 | ||||
| 142 | S | 35.4 | Very low | 40.9 | Very low | 104 Ų | 104 | 132.3 Ų | 132.3 | 73% | 0.727 | 82% | 0.815 | S | S | * | * | 171.3 | 120.5 | 86.2 | 65.2 | 0 | 0 | 0 | 0 | 113.1 | |||||
| 143 | T | 32.3 | Very low | 41.2 | Very low | 121 Ų | 121 | 128.1 Ų | 128.1 | 74% | 0.742 | 81% | 0.808 | S | S | * | * | trans | 66.3 | 127.9 | 138.2 | 0.5 | 0 | 0 | 0 | 0 | 124.4 | ||||
| 144 | T | 34.8 | Very low | 41.6 | Very low | 125 Ų | 125 | 130.5 Ų | 130.5 | 77% | 0.767 | 81% | 0.811 | S | S | * | * | trans | 72.6 | 131.8 | 153.5 | 70 | 0 | 0 | 0 | 0 | 117.2 | ||||
| 145 | S | 37.3 | Very low | 41.5 | Very low | 101 Ų | 101 | 130.9 Ų | 130.9 | 71% | 0.706 | 81% | 0.811 | S | S | * | * | cis | -175.6 | 143 | 10.6 | 29.2 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 146 | S | 37.5 | Very low | 41.6 | Very low | 119 Ų | 119 | 131.4 Ų | 131.4 | 83% | 0.832 | 81% | 0.807 | S | S | * | * | trans | 72 | 100.1 | 143.1 | -49.8 | 0 | 0 | 0 | 0 | 121.7 | ||||
| 147 | S | 37.4 | Very low | 41.8 | Very low | 128 Ų | 128 | 131.6 Ų | 131.6 | 90% | 0.895 | 80% | 0.802 | S | S | * | * | -173 | 105.2 | 116.5 | 58.8 | 0 | 0 | 0 | 0 | 111.2 | |||||
| 148 | A | 40.6 | Very low | 41.6 | Very low | 109 Ų | 109 | 135.3 Ų | 135.3 | 90% | 0.901 | 81% | 0.807 | S | S | * | * | trans | -140.2 | 103 | 169.4 | 0 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 149 | G | 40.3 | Very low | 42.2 | Very low | 75 Ų | 75 | 138.1 Ų | 138.1 | 77% | 0.773 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -97.2 | 141.4 | 172.4 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||
| 150 | P | 48.1 | Very low | 42.4 | Very low | 129 Ų | 129 | 135.3 Ų | 135.3 | 84% | 0.838 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -93.7 | 153 | -156.9 | 35.5 | -34.9 | 0 | 0 | 0 | 115.4 | ||
| 151 | R | 46.9 | Very low | 42.6 | Very low | 233 Ų | 233 | 138.3 Ų | 138.3 | 88% | 0.879 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -59.1 | 144 | 166.3 | -80.5 | 175.3 | 155.8 | -154.2 | -3.9 | 111.7 | T153 | R151-T153 PolarHBondContact O-N 3.29Š|
| 152 | P | 43 | Very low | 42.6 | Very low | 134 Ų | 134 | 140.1 Ų | 140.1 | 87% | 0.87 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -80 | 121 | 175.4 | 30.9 | -30.7 | 0 | 0 | 0 | 111.3 | ||
| 153 | T | 46.8 | Very low | 43.1 | Very low | 130 Ų | 130 | 140.8 Ų | 140.8 | 80% | 0.798 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -97.9 | 129 | 167.7 | 51 | 0 | 0 | 0 | 0 | 109.6 | R151 V155 | R151-T153 PolarHBondContact O-N 3.29Å; T153-V155 PolarHBondContact O-N 2.82Å |
| 154 | R | 50.8 | Low | 43.6 | Very low | 245 Ų | 245 | 140.3 Ų | 140.3 | 93% | 0.925 | 80% | 0.801 | S | S | * | * | trans | -76.5 | 110.1 | 178.7 | 174.1 | -179.6 | 166.8 | -111.4 | 2.3 | 109.4 | ||||
| 155 | V | 45.3 | Very low | 43.9 | Very low | 126 Ų | 126 | 140.1 Ų | 140.1 | 76% | 0.764 | 81% | 0.805 | S | S | * | * | trans | -126.1 | 126.3 | 162.1 | 167.2 | 0 | 0 | 0 | 0 | 109.6 | T153 | T153-V155 PolarHBondContact O-N 2.82Š| ||
| 156 | N | 43.2 | Very low | 44.5 | Very low | 138 Ų | 138 | 140.6 Ų | 140.6 | 74% | 0.738 | 81% | 0.806 | S | S | * | * | trans | -88.2 | 120.8 | 178.7 | 170.4 | 31.3 | 0 | 0 | 0 | 108.3 | ||||
| 157 | S | 48.1 | Very low | 44.6 | Very low | 100 Ų | 100 | 143 Ų | 143 | 70% | 0.699 | 80% | 0.803 | S | S | * | * | trans | -134 | 109.4 | 170.8 | -64 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 158 | K | 48.6 | Very low | 44.8 | Very low | 192 Ų | 192 | 141.8 Ų | 141.8 | 84% | 0.835 | 80% | 0.795 | S | S | * | * | trans | -68.2 | 125.1 | 158.9 | -74.9 | 176.7 | 171.8 | 174 | 0 | 107.7 | ||||
| 159 | M | 55.6 | Low | 45.1 | Very low | 189 Ų | 189 | 144.9 Ų | 144.9 | 93% | 0.931 | 79% | 0.791 | S | S | * | * | trans | -123.8 | 137.6 | 151.6 | -80.4 | -126.7 | -67.9 | 0 | 0 | 109.6 | ||||
| 160 | V | 44.2 | Very low | 44.9 | Very low | 105 Ų | 105 | 147.7 Ų | 147.7 | 64% | 0.636 | 79% | 0.793 | S | S | * | * | trans | -102.2 | 145.1 | -164.6 | 115.3 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 161 | Y | 39.9 | Very low | 44.6 | Very low | 194 Ų | 194 | 152.4 Ų | 152.4 | 76% | 0.761 | 79% | 0.794 | S | S | * | * | trans | -12.6 | 147 | 172.7 | 54.1 | -96.2 | 0 | 0 | 0 | 121 | ||||
| 162 | D | 37.8 | Very low | 44.5 | Very low | 146 Ų | 146 | 146.5 Ų | 146.5 | 78% | 0.781 | 79% | 0.788 | S | S | * | * | -173.7 | 157.4 | 100.6 | -153.1 | 8.8 | 0 | 0 | 0 | 114.6 | |||||
| 163 | T | 47.6 | Very low | 44.5 | Very low | 117 Ų | 117 | 150.2 Ų | 150.2 | 72% | 0.718 | 79% | 0.79 | S | S | * | * | trans | -58.6 | 142.7 | -167.6 | -60 | 0 | 0 | 0 | 0 | 120.7 | ||||
| 164 | S | 41.2 | Very low | 44.1 | Very low | 112 Ų | 112 | 151 Ų | 151 | 78% | 0.783 | 80% | 0.795 | S | S | * | * | -175.8 | 106.5 | 127.6 | 62.8 | 0 | 0 | 0 | 0 | 115.9 | |||||
| 165 | S | 41.8 | Very low | 43.5 | Very low | 120 Ų | 120 | 143.1 Ų | 143.1 | 84% | 0.839 | 79% | 0.79 | S | S | * | * | trans | 69.9 | 154.3 | 136.4 | -92.2 | 0 | 0 | 0 | 0 | 124.3 | ||||
| 166 | P | 50.6 | Low | 43.3 | Very low | 111 Ų | 111 | 142.4 Ų | 142.4 | 72% | 0.721 | 80% | 0.798 | S | S | * | * | trans | -117.8 | 179.4 | -140.3 | 42.4 | -30.7 | 0 | 0 | 0 | 114.9 | ||||
| 167 | H | 38.8 | Very low | 43.1 | Very low | 169 Ų | 169 | 139.2 Ų | 139.2 | 78% | 0.782 | 80% | 0.798 | S | S | * | * | trans | 87.9 | 101.4 | 148.8 | -151 | 83.5 | 0 | 0 | 0 | 117.8 | ||||
| 168 | S | 43 | Very low | 42.7 | Very low | 104 Ų | 104 | 142.8 Ų | 142.8 | 73% | 0.727 | 80% | 0.803 | S | S | * | * | -164.8 | 117.3 | 113.8 | -160.8 | 0 | 0 | 0 | 0 | 110.7 | |||||
| 169 | Q | 46.2 | Very low | 42.2 | Very low | 174 Ų | 174 | 137.1 Ų | 137.1 | 81% | 0.813 | 80% | 0.799 | S | S | * | * | trans | -73.7 | 122.6 | 165.6 | -75.2 | 176.1 | -21.7 | 0 | 0 | 109 | ||||
| 170 | V | 35 | Very low | 41.8 | Very low | 133 Ų | 133 | 136.1 Ų | 136.1 | 81% | 0.806 | 79% | 0.792 | S | S | * | * | trans | -157.4 | 107.2 | 139.6 | -145.5 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 171 | R | 43.3 | Very low | 42 | Very low | 229 Ų | 229 | 140.9 Ų | 140.9 | 86% | 0.864 | 80% | 0.804 | S | S | * | * | trans | 64.1 | 95.7 | 134.9 | -160.6 | 166.8 | -176.3 | 168.1 | -0.6 | 121.1 | ||||
| 172 | S | 43.1 | Very low | 42.1 | Very low | 108 Ų | 108 | 137.3 Ų | 137.3 | 76% | 0.755 | 81% | 0.807 | S | S | * | * | 60.9 | 111.4 | 119.9 | -53.5 | 0 | 0 | 0 | 0 | 122.9 | |||||
| 173 | K | 44.6 | Very low | 42.6 | Very low | 212 Ų | 212 | 141.9 Ų | 141.9 | 92% | 0.922 | 81% | 0.814 | S | S | * | * | 69.3 | 93.6 | 129.9 | -87.9 | -179.3 | 172.8 | 176.8 | 0 | 119.1 | |||||
| 174 | T | 38.5 | Very low | 42.2 | Very low | 146 Ų | 146 | 144.4 Ų | 144.4 | 90% | 0.896 | 82% | 0.817 | S | S | * | * | trans | -122.9 | 151.6 | 143.6 | 40.6 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 175 | G | 38.5 | Very low | 42.4 | Very low | 80 Ų | 80 | 141.8 Ų | 141.8 | 83% | 0.825 | 81% | 0.808 | S | S | * | * | trans | 102.4 | 124.6 | 141.6 | 0 | 0 | 0 | 0 | 0 | 117.4 | ||||
| 176 | A | 40.4 | Very low | 42.8 | Very low | 112 Ų | 112 | 141.3 Ų | 141.3 | 93% | 0.926 | 81% | 0.805 | S | S | * | * | trans | -85.9 | 175.2 | -180 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 177 | G | 37.8 | Very low | 42.9 | Very low | 71 Ų | 71 | 141.8 Ų | 141.8 | 73% | 0.732 | 81% | 0.811 | S | S | * | * | trans | 126.6 | 95.5 | 160.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 178 | H | 40 | Very low | 43.8 | Very low | 175 Ų | 175 | 141.9 Ų | 141.9 | 81% | 0.81 | 81% | 0.811 | S | S | * | * | 72.9 | 118.7 | 86.6 | -169.1 | 36.8 | 0 | 0 | 0 | 113 | |||||
| 179 | G | 39.4 | Very low | 44.4 | Very low | 72 Ų | 72 | 148 Ų | 148 | 74% | 0.742 | 82% | 0.818 | S | S | * | * | trans | 173.9 | 73.1 | 178 | 0 | 0 | 0 | 0 | 0 | 112.3 | K181 | G179-K181 PolarHBondContact O-N 2.76Š| ||
| 180 | E | 47.1 | Very low | 44.8 | Very low | 168 Ų | 168 | 146 Ų | 146 | 79% | 0.785 | 82% | 0.818 | S | S | * | * | trans | -72.8 | 118.6 | -178.8 | -40.7 | -166.8 | 126.8 | 0 | 0 | 110.1 | ||||
| 181 | K | 48.3 | Very low | 45.7 | Very low | 205 Ų | 205 | 145 Ų | 145 | 89% | 0.891 | 81% | 0.814 | S | S | * | * | trans | -177.9 | 67.4 | 153.4 | 51.9 | -178.8 | -178.7 | -166.7 | 0 | 110.6 | G179 | G179-K181 PolarHBondContact O-N 2.76Š| ||
| 182 | S | 42.1 | Very low | 46.3 | Very low | 119 Ų | 119 | 144.8 Ų | 144.8 | 83% | 0.832 | 81% | 0.813 | S | S | * | * | trans | -94.8 | 114.4 | 162.2 | -162.7 | 0 | 0 | 0 | 0 | 108 | E184 | S182-E184 PolarHBondContact O-N 2.78Å; S182-E184 VanDerWaalsContact O-N 3.11Å | ||
| 183 | R | 47.8 | Very low | 46.8 | Very low | 243 Ų | 243 | 148.2 Ų | 148.2 | 92% | 0.917 | 82% | 0.817 | S | S | * | * | trans | -60.7 | 107.7 | 174.7 | -75.6 | 169.5 | 166.5 | 159.3 | -5.8 | 108.4 | G185 | R183-G185 PolarHBondContact O-N 3.26Š| ||
| 184 | E | 39.2 | Very low | 47.1 | Very low | 170 Ų | 170 | 143.7 Ų | 143.7 | 79% | 0.794 | 81% | 0.81 | S | S | * | * | trans | -62.5 | 100.2 | 169.8 | -167.4 | 65.7 | -148.9 | 0 | 0 | 108.5 | S182 | S182-E184 PolarHBondContact O-N 2.78Å; S182-E184 VanDerWaalsContact O-N 3.11Å | ||
| 185 | G | 45.1 | Very low | 47.5 | Very low | 57 Ų | 57 | 142.6 Ų | 142.6 | 59% | 0.588 | 81% | 0.808 | S | S | * | * | trans | -78.8 | 127.5 | 171.9 | 0 | 0 | 0 | 0 | 0 | 110.2 | R183 | R183-G185 PolarHBondContact O-N 3.26Š| ||
| 186 | S | 50.8 | Low | 48.1 | Very low | 110 Ų | 110 | 143.1 Ų | 143.1 | 77% | 0.769 | 80% | 0.804 | S | S | * | * | trans | 62.3 | 68 | 145.4 | -156.2 | 0 | 0 | 0 | 0 | 116.7 | Q188 | S186-Q188 PolarHBondContact O-N 3.09Š| ||
| 187 | S | 51.1 | Low | 48.8 | Very low | 121 Ų | 121 | 144.8 Ų | 144.8 | 85% | 0.846 | 80% | 0.803 | S | S | * | * | trans | -76.6 | 75.6 | 152.4 | -80 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 188 | Q | 57.7 | Low | 49.2 | Very low | 171 Ų | 171 | 153.1 Ų | 153.1 | 80% | 0.799 | 81% | 0.813 | S | S | * | * | trans | -122 | 82 | 159.7 | -169.5 | 167.6 | 10.2 | 0 | 0 | 108.9 | S186 | S186-Q188 PolarHBondContact O-N 3.09Š| ||
| 189 | R | 56.3 | Low | 49.4 | Very low | 232 Ų | 232 | 148.4 Ų | 148.4 | 88% | 0.875 | 81% | 0.812 | S | S | * | * | trans | -141.4 | 98.9 | 159.5 | -74 | -165.3 | -179.7 | -155.7 | 0.4 | 110 | ||||
| 190 | V | 54.6 | Low | 49.8 | Very low | 132 Ų | 132 | 153.5 Ų | 153.5 | 80% | 0.8 | 82% | 0.816 | S | S | * | * | trans | -103.4 | 107.4 | 152.6 | -175.8 | 0 | 0 | 0 | 0 | 107.1 | R192 | V190-R192 HydrophobicContact CG1-CG 4.33Š| ||
| 191 | P | 55.1 | Low | 49.6 | Very low | 111 Ų | 111 | 154 Ų | 154 | 72% | 0.721 | 82% | 0.816 | S | S | * | * | trans | -96.5 | 110 | 152.3 | -1.3 | 21.2 | 0 | 0 | 0 | 107.9 | Q193 | P191-Q193 PolarHBondContact O-N 3.26Š| ||
| 192 | R | 55 | Low | 49.5 | Very low | 225 Ų | 225 | 150.1 Ų | 150.1 | 85% | 0.849 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -54 | 131.8 | 172.1 | -61.9 | 165.6 | 85.5 | -177.2 | 6.2 | 109.1 | V190 P194 | V190-R192 HydrophobicContact CG1-CG 4.33Å; R192-P194 WeakPolarHBondContact O-CD 3.46Å |
| 193 | Q | 53.4 | Low | 49.5 | Very low | 180 Ų | 180 | 150.2 Ų | 150.2 | 84% | 0.841 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -65.7 | 125.8 | 167.4 | -79.2 | -87.8 | -68.3 | 0 | 0 | 109.3 | P191 S195 | P191-Q193 PolarHBondContact O-N 3.26Å; Q193-S195 PolarHBondContact O-N 3.32Å |
| 194 | P | 51.3 | Low | 49.4 | Very low | 118 Ų | 118 | 147.9 Ų | 147.9 | 77% | 0.766 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -75.8 | 117.8 | 171.7 | 27.4 | -28.9 | 0 | 0 | 0 | 110.4 | R192 | R192-P194 WeakPolarHBondContact O-CD 3.46Š|
| 195 | S | 47.5 | Very low | 49.8 | Very low | 123 Ų | 123 | 145.5 Ų | 145.5 | 86% | 0.86 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -65.3 | 127.7 | 163.8 | -57.4 | 0 | 0 | 0 | 0 | 110.5 | Q193 | Q193-S195 PolarHBondContact O-N 3.32Š|
| 196 | A | 49.1 | Very low | 49.7 | Very low | 90 Ų | 90 | 148.5 Ų | 148.5 | 74% | 0.744 | 82% | 0.816 | S | S | * | * | trans | 152.7 | 117.1 | 137.6 | 0 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 197 | T | 55.3 | Low | 49.1 | Very low | 148 Ų | 148 | 147 Ų | 147 | 91% | 0.908 | 82% | 0.817 | S | S | * | * | trans | -142.3 | 104.5 | 134.2 | -58.2 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 198 | R | 46.8 | Very low | 48.7 | Very low | 245 Ų | 245 | 147 Ų | 147 | 93% | 0.925 | 82% | 0.817 | S | S | * | * | trans | -39 | 134.2 | 161.4 | 172.7 | -177 | 179.6 | -175 | 0.2 | 113.8 | ||||
| 199 | G | 43.6 | Very low | 47.9 | Very low | 77 Ų | 77 | 144.2 Ų | 144.2 | 79% | 0.794 | 82% | 0.816 | S | S | * | * | trans | -178.1 | 76.6 | 166.8 | 0 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 200 | Q | 48.3 | Very low | 47.2 | Very low | 178 Ų | 178 | 138.6 Ų | 138.6 | 83% | 0.832 | 81% | 0.813 | S | S | * | * | trans | -65.1 | 142.1 | 171.3 | -65.7 | 174.3 | -38.9 | 0 | 0 | 111.3 | ||||
| 201 | K | 43.7 | Very low | 46.5 | Very low | 179 Ų | 179 | 138.1 Ų | 138.1 | 78% | 0.778 | 82% | 0.815 | S | S | * | * | 169.3 | 128.2 | 117.7 | -87.6 | 159.3 | -165 | -70.7 | 0 | 111.4 | |||||
| 202 | T | 44.8 | Very low | 46.1 | Very low | 124 Ų | 124 | 137.7 Ų | 137.7 | 76% | 0.761 | 82% | 0.815 | S | S | * | * | trans | 54.1 | 119.2 | 148.6 | 65.3 | 0 | 0 | 0 | 0 | 116.7 | ||||
| 203 | T | 42.1 | Very low | 45.9 | Very low | 120 Ų | 120 | 132.3 Ų | 132.3 | 74% | 0.736 | 81% | 0.812 | S | S | * | * | -175.6 | 139.8 | 67.8 | 41.4 | 0 | 0 | 0 | 0 | 110.6 | |||||
| 204 | K | 46.4 | Very low | 45.5 | Very low | 195 Ų | 195 | 132 Ų | 132 | 85% | 0.848 | 81% | 0.81 | S | S | * | * | trans | 56.3 | 116.3 | 142.5 | -61.4 | 178.6 | 178.3 | 175.5 | 0 | 119.2 | ||||
| 205 | S | 47.4 | Very low | 45.2 | Very low | 119 Ų | 119 | 132.7 Ų | 132.7 | 83% | 0.832 | 81% | 0.812 | S | S | * | * | trans | -30.1 | 134.2 | 158.5 | 50.8 | 0 | 0 | 0 | 0 | 117.7 | ||||
| 206 | S | 43.8 | Very low | 45.6 | Very low | 121 Ų | 121 | 132.9 Ų | 132.9 | 85% | 0.846 | 81% | 0.809 | S | S | * | * | trans | -166.8 | 122.5 | 147.1 | 54.6 | 0 | 0 | 0 | 0 | 105.9 | ||||
| 207 | G | 38.1 | Very low | 45.8 | Very low | 77 Ų | 77 | 134.2 Ų | 134.2 | 79% | 0.794 | 81% | 0.809 | S | S | * | * | cis | 139.1 | 110.2 | 26.4 | 0 | 0 | 0 | 0 | 0 | 104.6 | ||||
| 208 | S | 42.6 | Very low | 45.7 | Very low | 121 Ų | 121 | 133.2 Ų | 133.2 | 85% | 0.846 | 80% | 0.803 | S | S | * | * | trans | -64.5 | 144.7 | 170.1 | -46.8 | 0 | 0 | 0 | 0 | 110 | ||||
| 209 | S | 40.7 | Very low | 45.8 | Very low | 113 Ų | 113 | 128.2 Ų | 128.2 | 79% | 0.79 | 80% | 0.8 | S | S | * | * | trans | 168.1 | 119.7 | 148.6 | -71 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 210 | S | 41.4 | Very low | 46.3 | Very low | 114 Ų | 114 | 130.6 Ų | 130.6 | 80% | 0.797 | 80% | 0.799 | S | S | * | * | 63.5 | 112.1 | 67.7 | -61.3 | 0 | 0 | 0 | 0 | 114.3 | |||||
| 211 | S | 39.9 | Very low | 46.3 | Very low | 122 Ų | 122 | 132.9 Ų | 132.9 | 85% | 0.853 | 82% | 0.817 | S | S | * | * | trans | 52.6 | 121.4 | 139.1 | -152.5 | 0 | 0 | 0 | 0 | 120.3 | ||||
| 212 | S | 47.9 | Very low | 46.4 | Very low | 103 Ų | 103 | 130.6 Ų | 130.6 | 72% | 0.72 | 82% | 0.819 | S | S | * | * | trans | -172.1 | 120.1 | 131.1 | -162.1 | 0 | 0 | 0 | 0 | 112 | ||||
| 213 | S | 49.1 | Very low | 46.5 | Very low | 111 Ų | 111 | 130.9 Ų | 130.9 | 78% | 0.776 | 82% | 0.822 | S | S | * | * | trans | -69.5 | 145.1 | 161.4 | -57.5 | 0 | 0 | 0 | 0 | 110 | ||||
| 214 | Q | 46.9 | Very low | 46.7 | Very low | 173 Ų | 173 | 131.5 Ų | 131.5 | 81% | 0.808 | 83% | 0.827 | S | S | * | * | trans | -126.7 | 120.3 | 166.7 | -72.7 | -76.2 | 43.2 | 0 | 0 | 109.1 | ||||
| 215 | V | 44.6 | Very low | 46.7 | Very low | 134 Ų | 134 | 127.8 Ų | 127.8 | 81% | 0.812 | 83% | 0.826 | S | S | * | * | trans | -94.4 | 130.6 | 168.7 | -75.4 | 0 | 0 | 0 | 0 | 108 | ||||
| 216 | T | 54.6 | Low | 46.7 | Very low | 127 Ų | 127 | 128.3 Ų | 128.3 | 78% | 0.779 | 83% | 0.826 | S | S | * | * | trans | -97.2 | 121.7 | 175.2 | 49.3 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 217 | P | 53.1 | Low | 46.9 | Very low | 117 Ų | 117 | 128.8 Ų | 128.8 | 76% | 0.76 | 82% | 0.824 | S | S | * | * | trans | -94.7 | 115 | 158.2 | 30.5 | -25 | 0 | 0 | 0 | 109.9 | T219 | P217-T219 PolarHBondContact O-N 3.43Š| ||
| 218 | T | 54.1 | Low | 47.5 | Very low | 127 Ų | 127 | 132.5 Ų | 132.5 | 78% | 0.779 | 83% | 0.826 | S | S | * | * | trans | -83.3 | 107.3 | 169.9 | -47.9 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 219 | T | 48.3 | Very low | 47.9 | Very low | 140 Ų | 140 | 133.4 Ų | 133.4 | 86% | 0.859 | 83% | 0.825 | S | S | * | * | trans | -91.2 | 116.8 | 162.9 | -64.8 | 0 | 0 | 0 | 0 | 107.7 | P217 | P217-T219 PolarHBondContact O-N 3.43Š| ||
| 220 | T | 54.7 | Low | 48.5 | Very low | 127 Ų | 127 | 135.1 Ų | 135.1 | 78% | 0.779 | 83% | 0.828 | S | S | * | * | trans | -118.5 | 134.5 | 165 | -100.3 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 221 | N | 47.5 | Very low | 49.1 | Very low | 226 Ų | 226 | 137 Ų | 137 | 100% | 1.209 | 83% | 0.83 | S | S | * | * | trans | -39.8 | 0 | 177.1 | -154.8 | -1.2 | 0 | 0 | 0 | 115.1 |
Retrieved 221 of 221 residues in 65.6 ms
(Link to these results)