| 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 | 35.5 | Very low | 31.1 | Very low | 237 Ų | 237 | 151.9 Ų | 151.9 | 100% | 1.167 | 82% | 0.82 | S | S | * | * | 0 | 113.1 | 0 | -88.9 | -176.6 | 152.1 | 0 | 0 | 107.8 | L3 | M1-L3 PolarHBondContact O-N 3.17Š| |||
| 2 | L | 27.4 | Very low | 31.4 | Very low | 184 Ų | 184 | 145.6 Ų | 145.6 | 96% | 0.963 | 80% | 0.804 | S | S | * | * | trans | -65.5 | 121.6 | 171.5 | -76 | 146.3 | 0 | 0 | 0 | 108 | ||||
| 3 | L | 35 | Very low | 31.6 | Very low | 157 Ų | 157 | 145.7 Ų | 145.7 | 82% | 0.822 | 80% | 0.803 | S | S | * | * | trans | -109.9 | 143.3 | 166.7 | -93.9 | 148.4 | 0 | 0 | 0 | 108.4 | M1 | M1-L3 PolarHBondContact O-N 3.17Š| ||
| 4 | P | 28.5 | Very low | 31.7 | Very low | 108 Ų | 108 | 141.4 Ų | 141.4 | 70% | 0.701 | 81% | 0.809 | S | S | * | * | trans | -85.7 | 159.6 | -145.9 | 33.5 | -36.6 | 0 | 0 | 0 | 113.7 | ||||
| 5 | P | 38.5 | Very low | 31.8 | Very low | 119 Ų | 119 | 143.3 Ų | 143.3 | 77% | 0.773 | 80% | 0.804 | S | S | * | * | trans | -77.1 | 158.6 | 170.4 | 34.9 | -30.9 | 0 | 0 | 0 | 109.8 | ||||
| 6 | E | 27.4 | Very low | 32.1 | Very low | 171 Ų | 171 | 142.3 Ų | 142.3 | 80% | 0.799 | 81% | 0.805 | S | S | * | * | trans | 91.4 | 77.1 | 174.8 | -50.2 | -169 | 179.5 | 0 | 0 | 116.9 | ||||
| 7 | L | 30.2 | Very low | 32.1 | Very low | 159 Ų | 159 | 142.5 Ų | 142.5 | 83% | 0.832 | 80% | 0.804 | S | S | * | * | trans | -122.1 | 80.2 | 137.3 | -95.1 | 159.7 | 0 | 0 | 0 | 107.8 | I9 | L7-I9 VanDerWaalsContact C-N 3.29Å; L7-I9 HydrophobicContact CD2-CD1 4.48Å; L7-I9 HydrophobicContact CD2-CG1 4.38Å; L7-I9 PolarHBondContact O-N 2.81Å | ||
| 8 | N | 26.6 | Very low | 32.5 | Very low | 140 Ų | 140 | 139.7 Ų | 139.7 | 75% | 0.749 | 79% | 0.794 | S | S | * | * | trans | -64.6 | 90.2 | 163 | -87.2 | -30.4 | 0 | 0 | 0 | 108.4 | ||||
| 9 | I | 31.5 | Very low | 32.8 | Very low | 143 Ų | 143 | 140.5 Ų | 140.5 | 73% | 0.733 | 79% | 0.788 | S | S | * | * | trans | -97.4 | 91.4 | 164.1 | -56.9 | 178.9 | 0 | 0 | 0 | 107 | L7 S11 | L7-I9 VanDerWaalsContact C-N 3.29Å; L7-I9 HydrophobicContact CD2-CD1 4.48Å; L7-I9 HydrophobicContact CD2-CG1 4.38Å; L7-I9 PolarHBondContact O-N 2.81Å; I9-S11 PolarHBondContact O-N 3.1Å | ||
| 10 | I | 27.5 | Very low | 32.9 | Very low | 153 Ų | 153 | 144.1 Ų | 144.1 | 79% | 0.785 | 80% | 0.795 | S | S | * | * | trans | -65.5 | 106.9 | 167.6 | -59.7 | 167.3 | 0 | 0 | 0 | 106.8 | ||||
| 11 | S | 33.6 | Very low | 33.1 | Very low | 100 Ų | 100 | 145.3 Ų | 145.3 | 70% | 0.699 | 79% | 0.789 | S | S | * | * | trans | -106.2 | 96 | 163.3 | -177.3 | 0 | 0 | 0 | 0 | 108.4 | I9 | I9-S11 PolarHBondContact O-N 3.1Š| ||
| 12 | A | 35.7 | Very low | 33.1 | Very low | 76 Ų | 76 | 138 Ų | 138 | 63% | 0.628 | 77% | 0.766 | S | S | * | * | trans | -64.5 | 134.8 | 164.4 | 0 | 0 | 0 | 0 | 0 | 109 | ||||
| 13 | N | 33 | Very low | 33.5 | Very low | 147 Ų | 147 | 137.5 Ų | 137.5 | 79% | 0.786 | 76% | 0.756 | S | S | * | * | S | Bend | trans | 85.8 | 70.8 | 173.8 | -54.5 | -21.3 | 0 | 0 | 0 | 117.3 | K15 | N13-K15 PolarHBondContact O-N 2.91Š|
| 14 | G | 34.2 | Very low | 33.7 | Very low | 86 Ų | 86 | 135.4 Ų | 135.4 | 89% | 0.887 | 75% | 0.75 | S | S | * | * | S | Bend | 59.7 | 7.7 | 114.1 | 0 | 0 | 0 | 0 | 0 | 120.4 | |||
| 15 | K | 32.2 | Very low | 33.8 | Very low | 170 Ų | 170 | 141.1 Ų | 141.1 | 74% | 0.739 | 76% | 0.757 | S | S | * | * | trans | -129.8 | 122.3 | 172.3 | -72.1 | -175.4 | 178.7 | 179.2 | 0 | 109.4 | N13 N17 | N13-K15 PolarHBondContact O-N 2.91Å; K15-N17 PolarHBondContact O-N 3.31Å | ||
| 16 | P | 37.1 | Very low | 34 | Very low | 126 Ų | 126 | 139.3 Ų | 139.3 | 82% | 0.818 | 74% | 0.744 | S | S | * | * | trans | -77.5 | 77 | 171.7 | 32.8 | -30.6 | 0 | 0 | 0 | 108.1 | C18 | P16-C18 PolarHBondContact O-N 3.39Š| ||
| 17 | N | 32.7 | Very low | 34.4 | Very low | 147 Ų | 147 | 139.5 Ų | 139.5 | 79% | 0.786 | 75% | 0.745 | S | S | * | * | trans | -74.6 | 104.5 | 161.2 | -87.3 | -9 | 0 | 0 | 0 | 107.2 | K15 | K15-N17 PolarHBondContact O-N 3.31Š| ||
| 18 | C | 38.2 | Very low | 35 | Very low | 91 Ų | 91 | 134.7 Ų | 134.7 | 62% | 0.615 | 72% | 0.724 | S | S | * | * | trans | -37.3 | 154 | 145.9 | -63.4 | 0 | 0 | 0 | 0 | 110.7 | P16 | P16-C18 PolarHBondContact O-N 3.39Š| ||
| 19 | F | 37.6 | Very low | 36.2 | Very low | 156 Ų | 156 | 134.2 Ų | 134.2 | 68% | 0.684 | 73% | 0.729 | S | S | * | * | trans | 89.4 | 74.9 | 175.3 | -53.2 | -76.7 | 0 | 0 | 0 | 116.5 | Y21 | F19-Y21 AromaticContact CD1-CD2 3.77Å; F19-Y21 HydrophobicContact CD1-CD2 3.77Å; F19-Y21 AromaticContact CD1-CE2 3.43Å; F19-Y21 HydrophobicContact CD1-CE2 3.43Å; F19-Y21 VanDerWaalsContact CD1-CE2 3.43Å; F19-Y21 AromaticContact CE1-CE2 3.74Å; F19-Y21 HydrophobicContact CE1-CE2 3.74Å | ||
| 20 | F | 35.3 | Very low | 37.3 | Very low | 212 Ų | 212 | 130.8 Ų | 130.8 | 93% | 0.93 | 72% | 0.715 | S | S | * | * | trans | -110.2 | 94.9 | 134.3 | -101.1 | -88.9 | 0 | 0 | 0 | 108.2 | A22 | F20-A22 PolarHBondContact O-N 2.71Š| ||
| 21 | Y | 37.8 | Very low | 38.7 | Very low | 170 Ų | 170 | 128.4 Ų | 128.4 | 67% | 0.667 | 71% | 0.709 | S | S | * | * | trans | -59.7 | 83 | 160.8 | -89.6 | -86 | 0 | 0 | 0 | 108.3 | F19 F23 | F19-Y21 AromaticContact CD1-CD2 3.77Å; F19-Y21 HydrophobicContact CD1-CD2 3.77Å; F19-Y21 AromaticContact CD1-CE2 3.43Å; F19-Y21 HydrophobicContact CD1-CE2 3.43Å; F19-Y21 VanDerWaalsContact CD1-CE2 3.43Å; F19-Y21 AromaticContact CE1-CE2 3.74Å; F19-Y21 HydrophobicContact CE1-CE2 3.74Å; Y21-F23 AromaticContact CD1-CD2 3.59Å; Y21-F23 HydrophobicContact CD1-CD2 3.59Å; Y21-F23 AromaticContact CD1-CE2 3.48Å; Y21-F23 HydrophobicContact CD1-CE2 3.48Å; Y21-F23 VanDerWaalsContact CD1-CE2 3.48Å; Y21-F23 HydrophobicContact CE1-CD2 4.3Å; Y21-F23 AromaticContact CE1-CE2 3.71Å; Y21-F23 HydrophobicContact CE1-CE2 3.71Å; Y21-F23 HydrophobicContact CG-CD2 4.45Å; Y21-F23 PolarHBondContact O-N 3.46Å | ||
| 22 | A | 36.2 | Very low | 39.7 | Very low | 83 Ų | 83 | 131.9 Ų | 131.9 | 69% | 0.686 | 71% | 0.708 | S | S | * | * | trans | -76.2 | 75.1 | 158.7 | 0 | 0 | 0 | 0 | 0 | 107.1 | F20 V24 | F20-A22 PolarHBondContact O-N 2.71Å; A22-V24 HydrophobicContact CB-CG2 4.35Å; A22-V24 PolarHBondContact O-N 3.21Å | ||
| 23 | F | 34.1 | Very low | 40.4 | Very low | 174 Ų | 174 | 132.1 Ų | 132.1 | 76% | 0.763 | 70% | 0.695 | S | S | * | * | trans | -65 | 85.6 | 156.1 | -96.9 | -78.9 | 0 | 0 | 0 | 106.1 | Y21 R25 | Y21-F23 AromaticContact CD1-CD2 3.59Å; Y21-F23 HydrophobicContact CD1-CD2 3.59Å; Y21-F23 AromaticContact CD1-CE2 3.48Å; Y21-F23 HydrophobicContact CD1-CE2 3.48Å; Y21-F23 VanDerWaalsContact CD1-CE2 3.48Å; Y21-F23 HydrophobicContact CE1-CD2 4.3Å; Y21-F23 AromaticContact CE1-CE2 3.71Å; Y21-F23 HydrophobicContact CE1-CE2 3.71Å; Y21-F23 HydrophobicContact CG-CD2 4.45Å; Y21-F23 PolarHBondContact O-N 3.46Å; F23-R25 PolarHBondContact O-N 2.74Å | ||
| 24 | V | 39.4 | Very low | 41.5 | Very low | 113 Ų | 113 | 131.8 Ų | 131.8 | 69% | 0.685 | 69% | 0.689 | S | S | * | * | trans | -64.5 | 91.7 | 167.1 | 173.6 | 0 | 0 | 0 | 0 | 106 | A22 V26 | A22-V24 HydrophobicContact CB-CG2 4.35Å; A22-V24 PolarHBondContact O-N 3.21Å; V24-V26 HydrophobicContact CG1-CB 4.21Å; V24-V26 HydrophobicContact CG1-CG2 3.34Å; V24-V26 PolarHBondContact O-N 2.82Å | ||
| 25 | R | 30.8 | Very low | 43 | Very low | 228 Ų | 228 | 132.1 Ų | 132.1 | 86% | 0.86 | 67% | 0.673 | S | S | * | * | trans | -74.7 | 74.8 | 174.9 | -158.5 | -177.2 | -157.6 | 177.8 | 5.1 | 107.6 | F23 | F23-R25 PolarHBondContact O-N 2.74Š| ||
| 26 | V | 43.4 | Very low | 44.7 | Very low | 81 Ų | 81 | 130 Ų | 130 | 49% | 0.491 | 67% | 0.67 | S | S | . | * | trans | -96.8 | 108.4 | 172.7 | 169.5 | 0 | 0 | 0 | 0 | 107.4 | V24 S28 K33 | V24-V26 HydrophobicContact CG1-CB 4.21Å; V24-V26 HydrophobicContact CG1-CG2 3.34Å; V24-V26 PolarHBondContact O-N 2.82Å; V26-S28 PolarHBondContact O-N 2.77Å; V26-K33 PolarHBondContact O-NZ 3.43Å | ||
| 27 | E | 35.8 | Very low | 46.4 | Very low | 174 Ų | 174 | 130 Ų | 130 | 81% | 0.813 | 66% | 0.662 | S | S | * | * | trans | -74.3 | 99.5 | 172.9 | -69.2 | 178.6 | 168.5 | 0 | 0 | 109.1 | ||||
| 28 | S | 43.1 | Very low | 48.4 | Very low | 58 Ų | 58 | 128.5 Ų | 128.5 | 41% | 0.406 | 65% | 0.653 | S | S | . | * | trans | -164.3 | 140 | 159.7 | 67.2 | 0 | 0 | 0 | 0 | 110.2 | V26 T30 K33 | V26-S28 PolarHBondContact O-N 2.77Å; S28-T30 PolarHBondContact O-N 2.98Å; S28-K33 PolarHBondContact O-NZ 2.85Å | ||
| 29 | P | 50.2 | Low | 50.3 | Low | 131 Ų | 131 | 127.7 Ų | 127.7 | 85% | 0.851 | 65% | 0.645 | S | S | * | * | trans | -94.8 | 96.6 | -173.3 | 34.7 | -27.2 | 0 | 0 | 0 | 109.9 | ||||
| 30 | T | 56 | Low | 52.2 | Low | 70 Ų | 70 | 121.6 Ų | 121.6 | 43% | 0.429 | 63% | 0.626 | S | S | . | * | trans | -136.9 | 141.4 | 170.3 | 55.2 | 0 | 0 | 0 | 0 | 111.7 | S28 Y32 K33 | S28-T30 PolarHBondContact O-N 2.98Å; T30-Y32 PolarHBondContact O-N 3.48Å; T30-Y32 VanDerWaalsContact O-N 3.14Å; T30-K33 PolarHBondContact O-N 2.81Å | ||
| 31 | P | 55.7 | Low | 54.3 | Low | 103 Ų | 103 | 118.9 Ų | 118.9 | 67% | 0.669 | 61% | 0.611 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -63.9 | -18.2 | -178.1 | 25.2 | -34 | 0 | 0 | 0 | 113.4 | K33 H34 | P31-K33 PolarHBondContact O-N 3.47Å; P31-K33 VanDerWaalsContact O-N 3.15Å; P31-H34 PolarHBondContact O-N 3.28Å |
| 32 | Y | 54.6 | Low | 56.3 | Low | 174 Ų | 174 | 120.1 Ų | 120.1 | 68% | 0.682 | 61% | 0.614 | S | S | * | * | H | α-helix | trans | -58.4 | -24.4 | 175.5 | -70.8 | -79 | 0 | 0 | 0 | 113.6 | T30 L36 | T30-Y32 PolarHBondContact O-N 3.48Å; T30-Y32 VanDerWaalsContact O-N 3.14Å; Y32-L36 WeakPolarHBondContact O-CB 3.43Å; Y32-L36 PolarHBondContact O-N 3.18Å |
| 33 | K | 51.9 | Low | 58.5 | Low | 81 Ų | 81 | 122.2 Ų | 122.2 | 35% | 0.352 | 61% | 0.61 | S | S | . | * | H | α-helix | trans | -61.9 | -43.6 | 177 | -87.7 | -179.6 | 175.6 | 165.3 | 0 | 113.7 | V26 S28 T30 P31 L36 L37 | V26-K33 PolarHBondContact O-NZ 3.43Å; S28-K33 PolarHBondContact O-NZ 2.85Å; T30-K33 PolarHBondContact O-N 2.81Å; P31-K33 PolarHBondContact O-N 3.47Å; P31-K33 VanDerWaalsContact O-N 3.15Å; K33-L36 PolarHBondContact O-N 2.82Å; K33-L37 VanDerWaalsContact O-CB 3.29Å; K33-L37 WeakPolarHBondContact O-CB 3.37Å; K33-L37 WeakPolarHBondContact O-CG 3.33Å; K33-L37 PolarHBondContact O-N 3.21Å |
| 34 | H | 56.1 | Low | 60.8 | Low | 140 Ų | 140 | 119.4 Ų | 119.4 | 65% | 0.648 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -65.8 | -42.6 | -177.5 | -79.4 | -73.8 | 0 | 0 | 0 | 110.9 | P31 L37 I38 | P31-H34 PolarHBondContact O-N 3.28Å; H34-L37 PolarHBondContact O-N 3.48Å; H34-I38 WeakPolarHBondContact O-CB 3.46Å; H34-I38 WeakPolarHBondContact O-CD1 3.31Å; H34-I38 WeakPolarHBondContact O-CG1 3.46Å; H34-I38 PolarHBondContact O-N 3.25Å |
| 35 | T | 64.4 | Low | 62.8 | Low | 92 Ų | 92 | 117.4 Ų | 117.4 | 56% | 0.564 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -65.6 | -44.9 | 177.7 | -46.2 | 0 | 0 | 0 | 0 | 111.8 | I38 V39 | T35-I38 PolarHBondContact O-N 2.84Å; T35-V39 VanDerWaalsContact O-CG2 3.28Å; T35-V39 WeakPolarHBondContact O-CG2 3.31Å; T35-V39 PolarHBondContact O-N 3.29Å |
| 36 | L | 67.5 | Low | 65.5 | Low | 127 Ų | 127 | 112.8 Ų | 112.8 | 67% | 0.665 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -63.5 | -41.1 | 176.5 | -95.7 | 143.2 | 0 | 0 | 0 | 112.4 | Y32 K33 V39 G40 | Y32-L36 WeakPolarHBondContact O-CB 3.43Å; Y32-L36 PolarHBondContact O-N 3.18Å; K33-L36 PolarHBondContact O-N 2.82Å; L36-V39 PolarHBondContact O-N 2.87Å; L36-G40 PolarHBondContact O-N 2.77Å |
| 37 | L | 72.8 | Confident | 67.4 | Low | 125 Ų | 125 | 112.6 Ų | 112.6 | 65% | 0.654 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -62.9 | -43.1 | 174.4 | -86.8 | 162 | 0 | 0 | 0 | 111.9 | K33 H34 G40 Y41 | K33-L37 VanDerWaalsContact O-CB 3.29Å; K33-L37 WeakPolarHBondContact O-CB 3.37Å; K33-L37 WeakPolarHBondContact O-CG 3.33Å; K33-L37 PolarHBondContact O-N 3.21Å; H34-L37 PolarHBondContact O-N 3.48Å; L37-G40 PolarHBondContact O-N 3.43Å; L37-Y41 VanDerWaalsContact O-CB 3.28Å; L37-Y41 WeakPolarHBondContact O-CB 3.45Å; L37-Y41 PolarHBondContact O-N 2.92Å |
| 38 | I | 76.1 | Confident | 69.8 | Low | 115 Ų | 115 | 110.5 Ų | 110.5 | 59% | 0.59 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -65.2 | -44.3 | 178.1 | -68.7 | 163.7 | 0 | 0 | 0 | 110.9 | H34 T35 Y41 R42 | H34-I38 WeakPolarHBondContact O-CB 3.46Å; H34-I38 WeakPolarHBondContact O-CD1 3.31Å; H34-I38 WeakPolarHBondContact O-CG1 3.46Å; H34-I38 PolarHBondContact O-N 3.25Å; T35-I38 PolarHBondContact O-N 2.84Å; I38-Y41 PolarHBondContact O-N 2.8Å; I38-R42 WeakPolarHBondContact O-CB 3.45Å; I38-R42 PolarHBondContact O-N 3.34Å |
| 39 | V | 76.7 | Confident | 72 | Confident | 74 Ų | 74 | 111.5 Ų | 111.5 | 45% | 0.448 | 57% | 0.568 | S | S | . | * | H | α-helix | trans | -64 | -45 | 178 | 173.2 | 0 | 0 | 0 | 0 | 110.8 | T35 L36 R42 Q43 | T35-V39 VanDerWaalsContact O-CG2 3.28Å; T35-V39 WeakPolarHBondContact O-CG2 3.31Å; T35-V39 PolarHBondContact O-N 3.29Å; L36-V39 PolarHBondContact O-N 2.87Å; V39-R42 PolarHBondContact O-N 3.36Å; V39-Q43 PolarHBondContact O-N 3.1Å |
| 40 | G | 78.6 | Confident | 73.9 | Confident | 28 Ų | 28 | 108.6 Ų | 108.6 | 29% | 0.289 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -62.5 | -43.6 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | L36 L37 Q43 L44 | L36-G40 PolarHBondContact O-N 2.77Å; L37-G40 PolarHBondContact O-N 3.43Å; G40-Q43 PolarHBondContact O-N 3.43Å; G40-L44 WeakPolarHBondContact O-CB 3.27Å; G40-L44 WeakPolarHBondContact O-CG 3.34Å; G40-L44 PolarHBondContact O-N 3.33Å |
| 41 | Y | 80.1 | Confident | 75.5 | Confident | 156 Ų | 156 | 111 Ų | 111 | 61% | 0.612 | 55% | 0.55 | S | S | * | . | H | α-helix | trans | -64.9 | -40.3 | 176.5 | -167.2 | -104.6 | 0 | 0 | 0 | 111.9 | L37 I38 L44 L45 | L37-Y41 VanDerWaalsContact O-CB 3.28Å; L37-Y41 WeakPolarHBondContact O-CB 3.45Å; L37-Y41 PolarHBondContact O-N 2.92Å; I38-Y41 PolarHBondContact O-N 2.8Å; Y41-L44 PolarHBondContact O-N 2.77Å; Y41-L45 HydrophobicContact CD1-CD1 3.61Å; Y41-L45 HydrophobicContact CD1-CG 4.12Å; Y41-L45 HydrophobicContact CE1-CD1 3.31Å; Y41-L45 HydrophobicContact CE1-CD2 4.37Å; Y41-L45 HydrophobicContact CE1-CG 3.86Å; Y41-L45 WeakPolarHBondContact O-CB 3.4Å; Y41-L45 WeakPolarHBondContact O-CG 3.48Å; Y41-L45 PolarHBondContact O-N 2.81Å |
| 42 | R | 79.5 | Confident | 77.2 | Confident | 196 Ų | 196 | 107.3 Ų | 107.3 | 74% | 0.74 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -63.2 | -41.8 | 174.8 | -171.2 | 178.5 | 179.7 | -176.8 | 0.1 | 112 | I38 V39 F46 | I38-R42 WeakPolarHBondContact O-CB 3.45Å; I38-R42 PolarHBondContact O-N 3.34Å; V39-R42 PolarHBondContact O-N 3.36Å; R42-F46 VanDerWaalsContact O-CB 3.29Å; R42-F46 WeakPolarHBondContact O-CB 3.47Å; R42-F46 PolarHBondContact O-N 3.24Å |
| 43 | Q | 81.9 | Confident | 79 | Confident | 126 Ų | 126 | 105.7 Ų | 105.7 | 59% | 0.589 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -66.8 | -41.3 | 175.1 | -83.8 | 172.8 | -24.5 | 0 | 0 | 112.3 | V39 G40 F46 C47 | V39-Q43 PolarHBondContact O-N 3.1Å; G40-Q43 PolarHBondContact O-N 3.43Å; Q43-F46 PolarHBondContact O-N 2.58Å; Q43-C47 WeakPolarHBondContact O-CB 3.48Å; Q43-C47 PolarHBondContact O-N 2.87Å; Q43-C47 PolarHBondContact O-SG 3.46Å |
| 44 | L | 81.2 | Confident | 80.9 | Confident | 115 Ų | 115 | 104.1 Ų | 104.1 | 60% | 0.602 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -63.4 | -47.2 | 175.6 | -78.7 | 168.9 | 0 | 0 | 0 | 111.9 | G40 Y41 F46 C47 Q48 | G40-L44 WeakPolarHBondContact O-CB 3.27Å; G40-L44 WeakPolarHBondContact O-CG 3.34Å; G40-L44 PolarHBondContact O-N 3.33Å; Y41-L44 PolarHBondContact O-N 2.77Å; L44-F46 VanDerWaalsContact C-N 3.32Å; L44-F46 PolarHBondContact O-N 3.36Å; L44-C47 PolarHBondContact O-N 3.47Å; L44-Q48 WeakPolarHBondContact O-CG 3.17Å; L44-Q48 PolarHBondContact O-N 3.19Å |
| 45 | L | 82.8 | Confident | 82.6 | Confident | 71 Ų | 71 | 99.6 Ų | 99.6 | 37% | 0.372 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -59.9 | -43.1 | 174.5 | -77.6 | 176.8 | 0 | 0 | 0 | 111.5 | Y41 Q48 V49 | Y41-L45 HydrophobicContact CD1-CD1 3.61Å; Y41-L45 HydrophobicContact CD1-CG 4.12Å; Y41-L45 HydrophobicContact CE1-CD1 3.31Å; Y41-L45 HydrophobicContact CE1-CD2 4.37Å; Y41-L45 HydrophobicContact CE1-CG 3.86Å; Y41-L45 WeakPolarHBondContact O-CB 3.4Å; Y41-L45 WeakPolarHBondContact O-CG 3.48Å; Y41-L45 PolarHBondContact O-N 2.81Å; L45-Q48 PolarHBondContact O-N 2.84Å; L45-V49 VanDerWaalsContact O-CG2 3.3Å; L45-V49 WeakPolarHBondContact O-CG2 3.42Å; L45-V49 PolarHBondContact O-N 3.34Å |
| 46 | F | 86.2 | Confident | 84 | Confident | 131 Ų | 131 | 100.8 Ų | 100.8 | 58% | 0.575 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -61.2 | -45 | 176.1 | -175.1 | -94.8 | 0 | 0 | 0 | 111.5 | R42 Q43 L44 Q48 V49 E50 | R42-F46 VanDerWaalsContact O-CB 3.29Å; R42-F46 WeakPolarHBondContact O-CB 3.47Å; R42-F46 PolarHBondContact O-N 3.24Å; Q43-F46 PolarHBondContact O-N 2.58Å; L44-F46 VanDerWaalsContact C-N 3.32Å; L44-F46 PolarHBondContact O-N 3.36Å; F46-Q48 PolarHBondContact O-N 3.44Å; F46-V49 PolarHBondContact O-N 2.98Å; F46-E50 HydrophobicContact CD1-CG 4.16Å; F46-E50 HydrophobicContact CE1-CG 3.67Å; F46-E50 HydrophobicContact CE2-CG 4.26Å; F46-E50 HydrophobicContact CZ-CG 3.73Å; F46-E50 WeakPolarHBondContact O-CB 3.31Å; F46-E50 PolarHBondContact O-N 2.89Å |
| 47 | C | 84.3 | Confident | 85.2 | Confident | 78 Ų | 78 | 101.5 Ų | 101.5 | 53% | 0.527 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -62 | -40.8 | 175.6 | -69.1 | 0 | 0 | 0 | 0 | 112 | Q43 L44 H51 | Q43-C47 WeakPolarHBondContact O-CB 3.48Å; Q43-C47 PolarHBondContact O-N 2.87Å; Q43-C47 PolarHBondContact O-SG 3.46Å; L44-C47 PolarHBondContact O-N 3.47Å; C47-H51 WeakPolarHBondContact O-CB 3.4Å; C47-H51 PolarHBondContact O-N 3.38Å |
| 48 | Q | 87.1 | Confident | 86.3 | Confident | 130 Ų | 130 | 102 Ų | 102 | 61% | 0.607 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -64.5 | -41.9 | 175.7 | -76.9 | -174.8 | -22.1 | 0 | 0 | 112.2 | L44 L45 F46 G52 | L44-Q48 WeakPolarHBondContact O-CG 3.17Å; L44-Q48 PolarHBondContact O-N 3.19Å; L45-Q48 PolarHBondContact O-N 2.84Å; F46-Q48 PolarHBondContact O-N 3.44Å; Q48-G52 PolarHBondContact O-N 2.86Å |
| 49 | V | 89.1 | Confident | 87.1 | Confident | 78 Ų | 78 | 101.2 Ų | 101.2 | 47% | 0.473 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -67.4 | -44.9 | 177.8 | 171.6 | 0 | 0 | 0 | 0 | 111.2 | L45 F46 G52 R53 | L45-V49 VanDerWaalsContact O-CG2 3.3Å; L45-V49 WeakPolarHBondContact O-CG2 3.42Å; L45-V49 PolarHBondContact O-N 3.34Å; F46-V49 PolarHBondContact O-N 2.98Å; V49-G52 CarbonylContact O-C 3.6Å; V49-G52 PolarHBondContact O-N 3.2Å; V49-R53 WeakPolarHBondContact O-CB 3.42Å; V49-R53 WeakPolarHBondContact O-CG 3.49Å; V49-R53 PolarHBondContact O-N 3.35Å |
| 50 | E | 89.7 | Confident | 88 | Confident | 70 Ų | 70 | 100.8 Ų | 100.8 | 33% | 0.327 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -67.6 | -37.6 | 177.1 | -75.2 | -57 | 137.8 | 0 | 0 | 111.9 | F46 R53 S54 | F46-E50 HydrophobicContact CD1-CG 4.16Å; F46-E50 HydrophobicContact CE1-CG 3.67Å; F46-E50 HydrophobicContact CE2-CG 4.26Å; F46-E50 HydrophobicContact CZ-CG 3.73Å; F46-E50 WeakPolarHBondContact O-CB 3.31Å; F46-E50 PolarHBondContact O-N 2.89Å; E50-R53 PolarHBondContact O-N 3.2Å; E50-R53 WeakPolarHBondContact OE1-CD 3.4Å; E50-R53 IonicContact OE1-CZ 3.28Å; E50-R53 IonicContact OE1-NE 2.69Å; E50-R53 IonicContact OE1-NH1 2.94Å; E50-R53 PolarHBondContact OE1-NH1 2.93Å; E50-S54 WeakPolarHBondContact O-CB 3.49Å; E50-S54 PolarHBondContact O-N 3.33Å; E50-S54 PolarHBondContact O-OG 3.39Å |
| 51 | H | 89.9 | Confident | 88.8 | Confident | 121 Ų | 121 | 103.8 Ų | 103.8 | 56% | 0.56 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -61.1 | -47.5 | 170.6 | -171.2 | 70 | 0 | 0 | 0 | 110.8 | C47 R53 S54 T55 | C47-H51 WeakPolarHBondContact O-CB 3.4Å; C47-H51 PolarHBondContact O-N 3.38Å; H51-R53 VanDerWaalsContact C-N 3.33Å; H51-R53 PolarHBondContact O-N 2.82Å; H51-S54 PolarHBondContact O-N 2.87Å; H51-S54 VanDerWaalsContact O-N 3.14Å; H51-S54 PolarHBondContact O-OG 3.02Å; H51-T55 WeakPolarHBondContact O-CG2 3.26Å; H51-T55 PolarHBondContact O-N 3Å; H51-T55 PolarHBondContact O-OG1 3.43Å |
| 52 | G | 91 | Very high | 89.5 | Confident | 25 Ų | 25 | 101.8 Ų | 101.8 | 26% | 0.258 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -58.4 | -39.4 | 174.2 | 0 | 0 | 0 | 0 | 0 | 113.6 | Q48 V49 T55 L56 | Q48-G52 PolarHBondContact O-N 2.86Å; V49-G52 CarbonylContact O-C 3.6Å; V49-G52 PolarHBondContact O-N 3.2Å; G52-T55 WeakPolarHBondContact CA-OG1 3.35Å; G52-T55 PolarHBondContact O-OG1 3.24Å; G52-L56 VanDerWaalsContact O-CB 3.32Å; G52-L56 WeakPolarHBondContact O-CB 3.34Å; G52-L56 WeakPolarHBondContact O-CG 3.26Å; G52-L56 PolarHBondContact O-N 2.78Å |
| 53 | R | 92.7 | Very high | 90.3 | Very high | 140 Ų | 140 | 97.9 Ų | 97.9 | 53% | 0.528 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -66.1 | -42.1 | 173.7 | -77 | 173 | 170.6 | -173.7 | -4.9 | 111.8 | V49 E50 H51 L56 K57 | V49-R53 WeakPolarHBondContact O-CB 3.42Å; V49-R53 WeakPolarHBondContact O-CG 3.49Å; V49-R53 PolarHBondContact O-N 3.35Å; E50-R53 PolarHBondContact O-N 3.2Å; E50-R53 WeakPolarHBondContact OE1-CD 3.4Å; E50-R53 IonicContact OE1-CZ 3.28Å; E50-R53 IonicContact OE1-NE 2.69Å; E50-R53 IonicContact OE1-NH1 2.94Å; E50-R53 PolarHBondContact OE1-NH1 2.93Å; H51-R53 VanDerWaalsContact C-N 3.33Å; H51-R53 PolarHBondContact O-N 2.82Å; R53-L56 PolarHBondContact O-N 3.37Å; R53-K57 WeakPolarHBondContact O-CB 3.36Å; R53-K57 WeakPolarHBondContact O-CG 3.34Å; R53-K57 PolarHBondContact O-N 3.41Å |
| 54 | S | 91.4 | Very high | 91 | Very high | 48 Ų | 48 | 97.1 Ų | 97.1 | 34% | 0.336 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -65.3 | -42.5 | 178.4 | 75.6 | 0 | 0 | 0 | 0 | 111.7 | E50 H51 K57 Q58 | E50-S54 WeakPolarHBondContact O-CB 3.49Å; E50-S54 PolarHBondContact O-N 3.33Å; E50-S54 PolarHBondContact O-OG 3.39Å; H51-S54 PolarHBondContact O-N 2.87Å; H51-S54 VanDerWaalsContact O-N 3.14Å; H51-S54 PolarHBondContact O-OG 3.02Å; S54-K57 PolarHBondContact O-N 3.12Å; S54-Q58 WeakPolarHBondContact O-CG 3.32Å; S54-Q58 PolarHBondContact O-N 3.08Å |
| 55 | T | 92 | Very high | 91.7 | Very high | 45 Ų | 45 | 100.4 Ų | 100.4 | 28% | 0.276 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -67.7 | -40.7 | 176.7 | 53.9 | 0 | 0 | 0 | 0 | 111.3 | H51 G52 K57 Q58 L59 | H51-T55 WeakPolarHBondContact O-CG2 3.26Å; H51-T55 PolarHBondContact O-N 3Å; H51-T55 PolarHBondContact O-OG1 3.43Å; G52-T55 WeakPolarHBondContact CA-OG1 3.35Å; G52-T55 PolarHBondContact O-OG1 3.24Å; T55-K57 PolarHBondContact O-N 2.79Å; T55-Q58 PolarHBondContact O-N 3.4Å; T55-L59 WeakPolarHBondContact O-CB 3.49Å; T55-L59 WeakPolarHBondContact O-CG 3.42Å; T55-L59 PolarHBondContact O-N 3.1Å |
| 56 | L | 93.4 | Very high | 92.4 | Very high | 118 Ų | 118 | 101.2 Ų | 101.2 | 62% | 0.618 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -62.2 | -40.9 | 173.5 | -76.2 | 173.1 | 0 | 0 | 0 | 112.6 | G52 R53 L59 S60 | G52-L56 VanDerWaalsContact O-CB 3.32Å; G52-L56 WeakPolarHBondContact O-CB 3.34Å; G52-L56 WeakPolarHBondContact O-CG 3.26Å; G52-L56 PolarHBondContact O-N 2.78Å; R53-L56 PolarHBondContact O-N 3.37Å; L56-L59 PolarHBondContact O-N 3.05Å; L56-S60 PolarHBondContact O-N 3.41Å |
| 57 | K | 93.6 | Very high | 92.9 | Very high | 142 Ų | 142 | 102.8 Ų | 102.8 | 62% | 0.617 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -64.3 | -40.9 | 173.9 | -76.6 | 176.7 | -179.7 | 178.3 | 0 | 112.1 | R53 S54 T55 S60 L61 | R53-K57 WeakPolarHBondContact O-CB 3.36Å; R53-K57 WeakPolarHBondContact O-CG 3.34Å; R53-K57 PolarHBondContact O-N 3.41Å; S54-K57 PolarHBondContact O-N 3.12Å; T55-K57 PolarHBondContact O-N 2.79Å; K57-S60 PolarHBondContact O-N 3.46Å; K57-S60 PolarHBondContact O-OG 3.42Å; K57-L61 WeakPolarHBondContact O-CG 3.4Å; K57-L61 PolarHBondContact O-N 2.82Å |
| 58 | Q | 94.1 | Very high | 93.4 | Very high | 135 Ų | 135 | 102.9 Ų | 102.9 | 63% | 0.631 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -64.4 | -42.7 | 175.7 | -75.1 | 177.5 | -12.1 | 0 | 0 | 111.4 | S54 T55 L61 F62 | S54-Q58 WeakPolarHBondContact O-CG 3.32Å; S54-Q58 PolarHBondContact O-N 3.08Å; T55-Q58 PolarHBondContact O-N 3.4Å; Q58-L61 PolarHBondContact O-N 3.35Å; Q58-F62 WeakPolarHBondContact O-CB 3.43Å; Q58-F62 PolarHBondContact O-N 3.21Å |
| 59 | L | 94.3 | Very high | 93.9 | Very high | 98 Ų | 98 | 99.8 Ų | 99.8 | 51% | 0.513 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -63 | -42.2 | 174.7 | -74.5 | 170.5 | 0 | 0 | 0 | 111.7 | T55 L56 L61 F62 L63 | T55-L59 WeakPolarHBondContact O-CB 3.49Å; T55-L59 WeakPolarHBondContact O-CG 3.42Å; T55-L59 PolarHBondContact O-N 3.1Å; L56-L59 PolarHBondContact O-N 3.05Å; L59-L61 PolarHBondContact O-N 3.03Å; L59-F62 PolarHBondContact O-N 3.03Å; L59-L63 WeakPolarHBondContact O-CB 3.26Å; L59-L63 VanDerWaalsContact O-CG 3.31Å; L59-L63 WeakPolarHBondContact O-CG 3.37Å; L59-L63 PolarHBondContact O-N 3.1Å |
| 60 | S | 94.9 | Very high | 94.2 | Very high | 65 Ų | 65 | 100.4 Ų | 100.4 | 46% | 0.455 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -63.2 | -43.5 | 178.2 | 73.1 | 0 | 0 | 0 | 0 | 111.9 | L56 K57 L63 E64 | L56-S60 PolarHBondContact O-N 3.41Å; K57-S60 PolarHBondContact O-N 3.46Å; K57-S60 PolarHBondContact O-OG 3.42Å; S60-L63 PolarHBondContact O-N 2.71Å; S60-E64 WeakPolarHBondContact O-CB 3.35Å; S60-E64 PolarHBondContact O-N 3.23Å |
| 61 | L | 95.7 | Very high | 94.5 | Very high | 92 Ų | 92 | 101.7 Ų | 101.7 | 48% | 0.482 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -64.5 | -39.2 | 175 | -71.7 | 172 | 0 | 0 | 0 | 112.1 | K57 Q58 L59 E64 R65 | K57-L61 WeakPolarHBondContact O-CG 3.4Å; K57-L61 PolarHBondContact O-N 2.82Å; Q58-L61 PolarHBondContact O-N 3.35Å; L59-L61 PolarHBondContact O-N 3.03Å; L61-E64 PolarHBondContact O-N 3.39Å; L61-R65 WeakPolarHBondContact O-CG 3.37Å; L61-R65 PolarHBondContact O-N 2.75Å |
| 62 | F | 95.6 | Very high | 94.8 | Very high | 113 Ų | 113 | 97.9 Ų | 97.9 | 50% | 0.496 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -62.9 | -48.7 | 175.3 | 177.9 | -97.1 | 0 | 0 | 0 | 111.2 | Q58 L59 E64 R65 Q66 | Q58-F62 WeakPolarHBondContact O-CB 3.43Å; Q58-F62 PolarHBondContact O-N 3.21Å; L59-F62 PolarHBondContact O-N 3.03Å; F62-E64 VanDerWaalsContact C-N 3.3Å; F62-E64 PolarHBondContact O-N 2.98Å; F62-R65 PolarHBondContact O-N 2.8Å; F62-Q66 HydrophobicContact CD1-CG 4.11Å; F62-Q66 HydrophobicContact CE1-CG 3.68Å; F62-Q66 HydrophobicContact CE2-CG 4.3Å; F62-Q66 HydrophobicContact CZ-CG 3.8Å; F62-Q66 WeakPolarHBondContact O-CG 3.46Å; F62-Q66 PolarHBondContact O-N 3.34Å |
| 63 | L | 96.2 | Very high | 95 | Very high | 114 Ų | 114 | 98.7 Ų | 98.7 | 60% | 0.597 | 49% | 0.489 | S | S | * | . | H | α-helix | trans | -61.7 | -37.6 | 177.7 | -70.4 | 176 | 0 | 0 | 0 | 112.1 | L59 S60 Q66 R67 | L59-L63 WeakPolarHBondContact O-CB 3.26Å; L59-L63 VanDerWaalsContact O-CG 3.31Å; L59-L63 WeakPolarHBondContact O-CG 3.37Å; L59-L63 PolarHBondContact O-N 3.1Å; S60-L63 PolarHBondContact O-N 2.71Å; L63-Q66 PolarHBondContact O-N 3.39Å; L63-R67 WeakPolarHBondContact O-CB 3.47Å; L63-R67 PolarHBondContact O-N 3.44Å |
| 64 | E | 96.1 | Very high | 95.1 | Very high | 111 Ų | 111 | 94.6 Ų | 94.6 | 52% | 0.519 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -65.9 | -43.4 | 175.4 | -173.1 | 171.6 | -166.1 | 0 | 0 | 112.2 | S60 L61 F62 Q66 R67 N68 | S60-E64 WeakPolarHBondContact O-CB 3.35Å; S60-E64 PolarHBondContact O-N 3.23Å; L61-E64 PolarHBondContact O-N 3.39Å; F62-E64 VanDerWaalsContact C-N 3.3Å; F62-E64 PolarHBondContact O-N 2.98Å; E64-Q66 PolarHBondContact O-N 2.83Å; E64-R67 PolarHBondContact O-N 3.24Å; E64-N68 WeakPolarHBondContact O-CB 3.3Å; E64-N68 VanDerWaalsContact O-CG 3.3Å; E64-N68 PolarHBondContact O-N 3.45Å; E64-N68 PolarHBondContact O-ND2 3.35Å |
| 65 | R | 96.5 | Very high | 95.4 | Very high | 183 Ų | 183 | 97 Ų | 97 | 69% | 0.691 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -60.2 | -44.3 | 172.6 | -74.2 | 177.4 | -175.4 | 174.6 | 1.9 | 111.7 | L61 F62 N68 S69 | L61-R65 WeakPolarHBondContact O-CG 3.37Å; L61-R65 PolarHBondContact O-N 2.75Å; F62-R65 PolarHBondContact O-N 2.8Å; R65-N68 PolarHBondContact O-N 3.33Å; R65-S69 WeakPolarHBondContact O-CB 3.38Å; R65-S69 PolarHBondContact O-N 3.07Å |
| 66 | Q | 96.7 | Very high | 95.6 | Very high | 88 Ų | 88 | 102.1 Ų | 102.1 | 41% | 0.411 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -62.2 | -45.3 | 176.2 | -67.9 | -55.3 | -34.3 | 0 | 0 | 111.2 | F62 L63 E64 N68 S69 V70 | F62-Q66 HydrophobicContact CD1-CG 4.11Å; F62-Q66 HydrophobicContact CE1-CG 3.68Å; F62-Q66 HydrophobicContact CE2-CG 4.3Å; F62-Q66 HydrophobicContact CZ-CG 3.8Å; F62-Q66 WeakPolarHBondContact O-CG 3.46Å; F62-Q66 PolarHBondContact O-N 3.34Å; L63-Q66 PolarHBondContact O-N 3.39Å; E64-Q66 PolarHBondContact O-N 2.83Å; Q66-N68 VanDerWaalsContact C-N 3.33Å; Q66-N68 PolarHBondContact O-N 3.01Å; Q66-S69 WeakPolarHBondContact O-CB 3.47Å; Q66-S69 PolarHBondContact O-N 2.78Å; Q66-V70 WeakPolarHBondContact O-CG2 3.24Å; Q66-V70 PolarHBondContact O-N 2.68Å |
| 67 | R | 96.1 | Very high | 95.7 | Very high | 165 Ų | 165 | 102.4 Ų | 102.4 | 62% | 0.623 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -58 | -44.6 | 175.8 | -176.6 | -178.6 | -176.7 | -170.6 | -0.4 | 111.8 | L63 E64 V70 K71 | L63-R67 WeakPolarHBondContact O-CB 3.47Å; L63-R67 PolarHBondContact O-N 3.44Å; E64-R67 PolarHBondContact O-N 3.24Å; R67-V70 PolarHBondContact O-N 3.41Å; R67-K71 HydrophobicContact CG-CD 4.47Å; R67-K71 VanDerWaalsContact O-CG 3.31Å; R67-K71 WeakPolarHBondContact O-CG 3.42Å; R67-K71 PolarHBondContact O-N 3.19Å |
| 68 | N | 96.2 | Very high | 95.9 | Very high | 80 Ų | 80 | 100.2 Ų | 100.2 | 43% | 0.428 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -69.3 | -37.7 | 179.2 | -69.7 | -19.4 | 0 | 0 | 0 | 111.9 | E64 R65 Q66 K71 A72 | E64-N68 WeakPolarHBondContact O-CB 3.3Å; E64-N68 VanDerWaalsContact O-CG 3.3Å; E64-N68 PolarHBondContact O-N 3.45Å; E64-N68 PolarHBondContact O-ND2 3.35Å; R65-N68 PolarHBondContact O-N 3.33Å; Q66-N68 VanDerWaalsContact C-N 3.33Å; Q66-N68 PolarHBondContact O-N 3.01Å; N68-K71 PolarHBondContact O-N 2.75Å; N68-A72 WeakPolarHBondContact O-CB 3.19Å; N68-A72 PolarHBondContact O-N 3.25Å |
| 69 | S | 95.9 | Very high | 96 | Very high | 64 Ų | 64 | 100.3 Ų | 100.3 | 45% | 0.448 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -60.2 | -47.7 | 172.9 | -175.3 | 0 | 0 | 0 | 0 | 111.8 | R65 Q66 K71 A72 S73 | R65-S69 WeakPolarHBondContact O-CB 3.38Å; R65-S69 PolarHBondContact O-N 3.07Å; Q66-S69 WeakPolarHBondContact O-CB 3.47Å; Q66-S69 PolarHBondContact O-N 2.78Å; S69-K71 PolarHBondContact O-N 3.32Å; S69-A72 PolarHBondContact O-N 2.84Å; S69-S73 PolarHBondContact O-N 2.95Å; S69-S73 PolarHBondContact O-OG 2.8Å |
| 70 | V | 96.2 | Very high | 96.1 | Very high | 91 Ų | 91 | 99.6 Ų | 99.6 | 55% | 0.552 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -64.8 | -39.5 | 178 | 173.4 | 0 | 0 | 0 | 0 | 111.8 | Q66 R67 S73 S74 | Q66-V70 WeakPolarHBondContact O-CG2 3.24Å; Q66-V70 PolarHBondContact O-N 2.68Å; R67-V70 PolarHBondContact O-N 3.41Å; V70-S73 WeakPolarHBondContact CA-OG 3.13Å; V70-S73 PolarHBondContact O-N 2.8Å; V70-S73 PolarHBondContact O-OG 3.16Å; V70-S74 VanDerWaalsContact O-CB 3.32Å; V70-S74 WeakPolarHBondContact O-CB 3.41Å; V70-S74 PolarHBondContact O-N 3.48Å |
| 71 | K | 96.3 | Very high | 96.2 | Very high | 98 Ų | 98 | 104.4 Ų | 104.4 | 43% | 0.426 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -62 | -44.5 | 173.1 | -76.1 | 174.8 | 178.6 | 179.4 | 0 | 111.6 | R67 N68 S69 S74 N75 | R67-K71 HydrophobicContact CG-CD 4.47Å; R67-K71 VanDerWaalsContact O-CG 3.31Å; R67-K71 WeakPolarHBondContact O-CG 3.42Å; R67-K71 PolarHBondContact O-N 3.19Å; N68-K71 PolarHBondContact O-N 2.75Å; S69-K71 PolarHBondContact O-N 3.32Å; K71-S74 WeakPolarHBondContact O-CB 3.36Å; K71-S74 PolarHBondContact O-N 2.85Å; K71-N75 VanDerWaalsContact O-CG 3.3Å; K71-N75 PolarHBondContact O-N 3.45Å |
| 72 | A | 95.8 | Very high | 96.3 | Very high | 41 Ų | 41 | 107.2 Ų | 107.2 | 34% | 0.339 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -63.5 | -42.3 | 177.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | N68 S69 N75 R76 | N68-A72 WeakPolarHBondContact O-CB 3.19Å; N68-A72 PolarHBondContact O-N 3.25Å; S69-A72 PolarHBondContact O-N 2.84Å; A72-N75 PolarHBondContact O-N 3.27Å; A72-R76 WeakPolarHBondContact O-CG 3.37Å; A72-R76 PolarHBondContact O-N 3.26Å |
| 73 | S | 95.5 | Very high | 96.4 | Very high | 42 Ų | 42 | 104.6 Ų | 104.6 | 29% | 0.294 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -65.6 | -38.9 | 174.6 | 58.9 | 0 | 0 | 0 | 0 | 112.5 | S69 V70 R76 L77 | S69-S73 PolarHBondContact O-N 2.95Å; S69-S73 PolarHBondContact O-OG 2.8Å; V70-S73 WeakPolarHBondContact CA-OG 3.13Å; V70-S73 PolarHBondContact O-N 2.8Å; V70-S73 PolarHBondContact O-OG 3.16Å; S73-R76 PolarHBondContact O-N 3.34Å; S73-L77 WeakPolarHBondContact O-CG 3.31Å; S73-L77 PolarHBondContact O-N 2.69Å |
| 74 | S | 95.6 | Very high | 96.4 | Very high | 53 Ų | 53 | 104.5 Ų | 104.5 | 37% | 0.371 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -60.8 | -45.1 | 174.9 | -175.1 | 0 | 0 | 0 | 0 | 111.7 | V70 K71 R76 L77 Q78 | V70-S74 VanDerWaalsContact O-CB 3.32Å; V70-S74 WeakPolarHBondContact O-CB 3.41Å; V70-S74 PolarHBondContact O-N 3.48Å; K71-S74 WeakPolarHBondContact O-CB 3.36Å; K71-S74 PolarHBondContact O-N 2.85Å; S74-R76 PolarHBondContact O-N 3.4Å; S74-L77 PolarHBondContact O-N 2.79Å; S74-Q78 WeakPolarHBondContact O-CG 3.38Å; S74-Q78 PolarHBondContact O-N 3.37Å |
| 75 | N | 96.7 | Very high | 96.4 | Very high | 99 Ų | 99 | 103.9 Ų | 103.9 | 53% | 0.529 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -62.3 | -41.6 | 176.5 | -70 | -11.3 | 0 | 0 | 0 | 112.1 | K71 A72 Q78 Q79 | K71-N75 VanDerWaalsContact O-CG 3.3Å; K71-N75 PolarHBondContact O-N 3.45Å; A72-N75 PolarHBondContact O-N 3.27Å; N75-Q78 PolarHBondContact O-N 2.99Å; N75-Q79 PolarHBondContact O-N 2.85Å |
| 76 | R | 97 | Very high | 96.4 | Very high | 153 Ų | 153 | 101.7 Ų | 101.7 | 58% | 0.577 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -61.2 | -44.2 | 174.1 | -72.3 | -172.1 | -64.9 | -116.4 | 2.1 | 111.8 | A72 S73 S74 Q78 Q79 V80 | A72-R76 WeakPolarHBondContact O-CG 3.37Å; A72-R76 PolarHBondContact O-N 3.26Å; S73-R76 PolarHBondContact O-N 3.34Å; S74-R76 PolarHBondContact O-N 3.4Å; R76-Q78 VanDerWaalsContact C-N 3.35Å; R76-Q78 PolarHBondContact O-N 3.28Å; R76-Q79 WeakPolarHBondContact O-CB 3.39Å; R76-Q79 PolarHBondContact O-N 2.77Å; R76-V80 WeakPolarHBondContact O-CG2 3.47Å; R76-V80 PolarHBondContact O-N 2.77Å |
| 77 | L | 95.8 | Very high | 96.4 | Very high | 124 Ų | 124 | 103.9 Ų | 103.9 | 65% | 0.649 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -62.9 | -40.3 | 176.4 | -75.3 | 171.9 | 0 | 0 | 0 | 112.1 | S73 S74 Q79 V80 R81 | S73-L77 WeakPolarHBondContact O-CG 3.31Å; S73-L77 PolarHBondContact O-N 2.69Å; S74-L77 PolarHBondContact O-N 2.79Å; L77-Q79 VanDerWaalsContact C-N 3.31Å; L77-Q79 PolarHBondContact O-N 3.36Å; L77-V80 PolarHBondContact O-N 3.05Å; L77-R81 WeakPolarHBondContact O-CB 3.43Å; L77-R81 PolarHBondContact O-N 3Å |
| 78 | Q | 96.7 | Very high | 96.4 | Very high | 95 Ų | 95 | 104.5 Ų | 104.5 | 44% | 0.444 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -64 | -35.8 | 174.6 | -73.2 | -176.5 | -7 | 0 | 0 | 112.5 | S74 N75 R76 R82 | S74-Q78 WeakPolarHBondContact O-CG 3.38Å; S74-Q78 PolarHBondContact O-N 3.37Å; N75-Q78 PolarHBondContact O-N 2.99Å; R76-Q78 VanDerWaalsContact C-N 3.35Å; R76-Q78 PolarHBondContact O-N 3.28Å; Q78-R82 WeakPolarHBondContact O-CG 3.13Å; Q78-R82 PolarHBondContact O-N 3.39Å |
| 79 | Q | 97.1 | Very high | 96.4 | Very high | 137 Ų | 137 | 103.5 Ų | 103.5 | 64% | 0.64 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -68 | -43.7 | 175.1 | -172.5 | 174.2 | 11.5 | 0 | 0 | 111.6 | N75 R76 L77 R81 R82 C83 | N75-Q79 PolarHBondContact O-N 2.85Å; R76-Q79 WeakPolarHBondContact O-CB 3.39Å; R76-Q79 PolarHBondContact O-N 2.77Å; L77-Q79 VanDerWaalsContact C-N 3.31Å; L77-Q79 PolarHBondContact O-N 3.36Å; Q79-R81 VanDerWaalsContact C-N 3.33Å; Q79-R81 PolarHBondContact O-N 3.24Å; Q79-R82 PolarHBondContact O-N 2.76Å; Q79-C83 WeakPolarHBondContact O-CB 3.14Å; Q79-C83 PolarHBondContact O-N 2.97Å |
| 80 | V | 96.4 | Very high | 96.3 | Very high | 83 Ų | 83 | 104.6 Ų | 104.6 | 50% | 0.503 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -60.9 | -44.1 | 174.3 | 172.7 | 0 | 0 | 0 | 0 | 110.6 | R76 L77 R82 C83 L84 | R76-V80 WeakPolarHBondContact O-CG2 3.47Å; R76-V80 PolarHBondContact O-N 2.77Å; L77-V80 PolarHBondContact O-N 3.05Å; V80-R82 PolarHBondContact O-N 3.24Å; V80-C83 WeakPolarHBondContact O-CB 3.45Å; V80-C83 PolarHBondContact O-N 3.46Å; V80-L84 HydrophobicContact CG1-CD1 4.1Å; V80-L84 HydrophobicContact CG1-CG 4.39Å; V80-L84 WeakPolarHBondContact O-CG 3.38Å; V80-L84 PolarHBondContact O-N 2.95Å |
| 81 | R | 97.2 | Very high | 96.1 | Very high | 166 Ų | 166 | 104.6 Ų | 104.6 | 63% | 0.626 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -57.7 | -48.5 | 176.3 | -179.3 | 178.5 | 174.4 | 171.9 | 3.9 | 111.9 | L77 Q79 C83 L84 E85 | L77-R81 WeakPolarHBondContact O-CB 3.43Å; L77-R81 PolarHBondContact O-N 3Å; Q79-R81 VanDerWaalsContact C-N 3.33Å; Q79-R81 PolarHBondContact O-N 3.24Å; R81-C83 VanDerWaalsContact C-N 3.32Å; R81-C83 PolarHBondContact O-N 2.71Å; R81-L84 PolarHBondContact O-N 3.29Å; R81-E85 WeakPolarHBondContact CG-OE1 3.41Å; R81-E85 IonicContact CZ-OE1 3.96Å; R81-E85 IonicContact NE-OE1 2.8Å; R81-E85 PolarHBondContact NE-OE1 3.24Å; R81-E85 IonicContact NH2-OE1 3.72Å; R81-E85 WeakPolarHBondContact O-CG 3.37Å; R81-E85 PolarHBondContact O-N 2.89Å |
| 82 | R | 97.4 | Very high | 96.1 | Very high | 152 Ų | 152 | 103.6 Ų | 103.6 | 57% | 0.574 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -59.9 | -41.1 | 176.2 | -76.6 | -175.8 | -111.1 | 172.3 | -7.2 | 112.3 | Q78 Q79 V80 E85 Q86 | Q78-R82 WeakPolarHBondContact O-CG 3.13Å; Q78-R82 PolarHBondContact O-N 3.39Å; Q79-R82 PolarHBondContact O-N 2.76Å; V80-R82 PolarHBondContact O-N 3.24Å; R82-E85 PolarHBondContact O-N 3.37Å; R82-Q86 WeakPolarHBondContact O-CG 3.32Å; R82-Q86 PolarHBondContact O-N 2.88Å |
| 83 | C | 97.1 | Very high | 96.1 | Very high | 58 Ų | 58 | 110.6 Ų | 110.6 | 39% | 0.392 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -63.3 | -41.3 | 176.1 | -177.6 | 0 | 0 | 0 | 0 | 112 | Q79 V80 R81 Q86 K87 | Q79-C83 WeakPolarHBondContact O-CB 3.14Å; Q79-C83 PolarHBondContact O-N 2.97Å; V80-C83 WeakPolarHBondContact O-CB 3.45Å; V80-C83 PolarHBondContact O-N 3.46Å; R81-C83 VanDerWaalsContact C-N 3.32Å; R81-C83 PolarHBondContact O-N 2.71Å; C83-Q86 PolarHBondContact O-N 3.46Å; C83-K87 WeakPolarHBondContact O-CG 3.19Å; C83-K87 PolarHBondContact O-N 2.89Å |
| 84 | L | 95.9 | Very high | 96 | Very high | 111 Ų | 111 | 112.6 Ų | 112.6 | 58% | 0.581 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -66.9 | -41.2 | 176.3 | -71.4 | 174.7 | 0 | 0 | 0 | 112.3 | V80 R81 Q86 K87 R88 | V80-L84 HydrophobicContact CG1-CD1 4.1Å; V80-L84 HydrophobicContact CG1-CG 4.39Å; V80-L84 WeakPolarHBondContact O-CG 3.38Å; V80-L84 PolarHBondContact O-N 2.95Å; R81-L84 PolarHBondContact O-N 3.29Å; L84-Q86 VanDerWaalsContact C-N 3.33Å; L84-Q86 PolarHBondContact O-N 3.48Å; L84-K87 PolarHBondContact O-N 3.19Å; L84-R88 WeakPolarHBondContact O-CB 3.28Å; L84-R88 PolarHBondContact O-N 2.99Å |
| 85 | E | 97.3 | Very high | 95.8 | Very high | 98 Ų | 98 | 115.8 Ų | 115.8 | 46% | 0.458 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -61.8 | -41.5 | 175.5 | -73.3 | 166.6 | -179.6 | 0 | 0 | 111.2 | R81 R82 R88 A89 | R81-E85 WeakPolarHBondContact CG-OE1 3.41Å; R81-E85 IonicContact CZ-OE1 3.96Å; R81-E85 IonicContact NE-OE1 2.8Å; R81-E85 PolarHBondContact NE-OE1 3.24Å; R81-E85 IonicContact NH2-OE1 3.72Å; R81-E85 WeakPolarHBondContact O-CG 3.37Å; R81-E85 PolarHBondContact O-N 2.89Å; R82-E85 PolarHBondContact O-N 3.37Å; E85-R88 PolarHBondContact O-N 3.28Å; E85-A89 PolarHBondContact O-N 3.05Å; E85-A89 VanDerWaalsContact O-N 3.07Å |
| 86 | Q | 96.6 | Very high | 95.6 | Very high | 138 Ų | 138 | 115.9 Ų | 115.9 | 65% | 0.645 | 55% | 0.55 | S | S | * | * | H | α-helix | trans | -62.7 | -45.8 | 173.4 | -74.1 | 174.2 | -12.2 | 0 | 0 | 112.4 | R82 C83 L84 R88 A89 V90 | R82-Q86 WeakPolarHBondContact O-CG 3.32Å; R82-Q86 PolarHBondContact O-N 2.88Å; C83-Q86 PolarHBondContact O-N 3.46Å; L84-Q86 VanDerWaalsContact C-N 3.33Å; L84-Q86 PolarHBondContact O-N 3.48Å; Q86-R88 VanDerWaalsContact C-N 3.33Å; Q86-R88 PolarHBondContact O-N 3.45Å; Q86-A89 PolarHBondContact O-N 3.33Å; Q86-V90 WeakPolarHBondContact O-CG2 3.38Å; Q86-V90 PolarHBondContact O-N 3.3Å; Q86-V90 VanDerWaalsContact O-N 3.16Å |
| 87 | K | 96.6 | Very high | 95.4 | Very high | 133 Ų | 133 | 113.2 Ų | 113.2 | 58% | 0.578 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -63 | -40.5 | 177.4 | -75.4 | -168.7 | 176.9 | -168 | 0 | 111.9 | C83 L84 V90 I91 | C83-K87 WeakPolarHBondContact O-CG 3.19Å; C83-K87 PolarHBondContact O-N 2.89Å; L84-K87 PolarHBondContact O-N 3.19Å; K87-V90 PolarHBondContact O-N 2.93Å; K87-I91 WeakPolarHBondContact O-CG1 3.42Å; K87-I91 PolarHBondContact O-N 2.69Å |
| 88 | R | 95.4 | Very high | 95.1 | Very high | 179 Ų | 179 | 112.6 Ų | 112.6 | 68% | 0.675 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -60.3 | -45.7 | 176.4 | -172.4 | 173.2 | -175.7 | 174.4 | 2.3 | 111.6 | L84 E85 Q86 V90 I91 D92 | L84-R88 WeakPolarHBondContact O-CB 3.28Å; L84-R88 PolarHBondContact O-N 2.99Å; E85-R88 PolarHBondContact O-N 3.28Å; Q86-R88 VanDerWaalsContact C-N 3.33Å; Q86-R88 PolarHBondContact O-N 3.45Å; R88-V90 VanDerWaalsContact C-N 3.26Å; R88-V90 PolarHBondContact O-N 3.48Å; R88-I91 PolarHBondContact O-N 3.4Å; R88-I91 VanDerWaalsContact O-N 3.1Å; R88-D92 VanDerWaalsContact O-CG 3.26Å; R88-D92 PolarHBondContact O-N 3.09Å |
| 89 | A | 95.3 | Very high | 94.7 | Very high | 59 Ų | 59 | 111.9 Ų | 111.9 | 49% | 0.488 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -61 | -34 | 176.5 | 0 | 0 | 0 | 0 | 0 | 113.2 | E85 Q86 R93 | E85-A89 PolarHBondContact O-N 3.05Å; E85-A89 VanDerWaalsContact O-N 3.07Å; Q86-A89 PolarHBondContact O-N 3.33Å; A89-R93 WeakPolarHBondContact O-CB 3.25Å; A89-R93 PolarHBondContact O-N 2.91Å; A89-R93 VanDerWaalsContact O-N 3.13Å |
| 90 | V | 95 | Very high | 94.3 | Very high | 87 Ų | 87 | 114.7 Ų | 114.7 | 53% | 0.527 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -69.1 | -42 | 173.9 | 174.3 | 0 | 0 | 0 | 0 | 111.3 | Q86 K87 R88 R93 L94 | Q86-V90 WeakPolarHBondContact O-CG2 3.38Å; Q86-V90 PolarHBondContact O-N 3.3Å; Q86-V90 VanDerWaalsContact O-N 3.16Å; K87-V90 PolarHBondContact O-N 2.93Å; R88-V90 VanDerWaalsContact C-N 3.26Å; R88-V90 PolarHBondContact O-N 3.48Å; V90-R93 PolarHBondContact O-N 2.61Å; V90-L94 HydrophobicContact CG1-CD1 4.05Å; V90-L94 HydrophobicContact CG1-CG 4.45Å; V90-L94 WeakPolarHBondContact O-CG 3.49Å; V90-L94 PolarHBondContact O-N 2.95Å |
| 91 | I | 92.3 | Very high | 93.9 | Very high | 90 Ų | 90 | 115.2 Ų | 115.2 | 46% | 0.462 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -60.7 | -50.1 | 176.2 | -66.6 | 170.2 | 0 | 0 | 0 | 110 | K87 R88 R93 L94 E95 | K87-I91 WeakPolarHBondContact O-CG1 3.42Å; K87-I91 PolarHBondContact O-N 2.69Å; R88-I91 PolarHBondContact O-N 3.4Å; R88-I91 VanDerWaalsContact O-N 3.1Å; I91-R93 PolarHBondContact O-N 3.14Å; I91-L94 PolarHBondContact O-N 3.24Å; I91-E95 HydrophobicContact CG2-CG 4.31Å; I91-E95 WeakPolarHBondContact O-CG 3.31Å; I91-E95 PolarHBondContact O-N 3.49Å |
| 92 | D | 94.5 | Very high | 93.3 | Very high | 78 Ų | 78 | 114 Ų | 114 | 42% | 0.417 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -58.2 | -37.7 | 179.4 | -61 | -18.8 | 0 | 0 | 0 | 111.3 | R88 V96 | R88-D92 VanDerWaalsContact O-CG 3.26Å; R88-D92 PolarHBondContact O-N 3.09Å; D92-V96 WeakPolarHBondContact O-CG2 3.26Å; D92-V96 PolarHBondContact O-N 3.46Å |
| 93 | R | 95.9 | Very high | 92.7 | Very high | 188 Ų | 188 | 110.3 Ų | 110.3 | 71% | 0.709 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -65.6 | -44.4 | 174.8 | -178.2 | 179.6 | 175.8 | 178.8 | -0.1 | 112.3 | A89 V90 I91 V96 E97 | A89-R93 WeakPolarHBondContact O-CB 3.25Å; A89-R93 PolarHBondContact O-N 2.91Å; A89-R93 VanDerWaalsContact O-N 3.13Å; V90-R93 PolarHBondContact O-N 2.61Å; I91-R93 PolarHBondContact O-N 3.14Å; R93-V96 PolarHBondContact O-N 3.07Å; R93-E97 PolarHBondContact O-N 2.93Å; R93-E97 VanDerWaalsContact O-N 3.13Å |
| 94 | L | 93.6 | Very high | 92 | Very high | 84 Ų | 84 | 108.7 Ų | 108.7 | 44% | 0.44 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -67.8 | -36.7 | 179.8 | -72.7 | 172.3 | 0 | 0 | 0 | 111.9 | V90 I91 V96 E97 I98 | V90-L94 HydrophobicContact CG1-CD1 4.05Å; V90-L94 HydrophobicContact CG1-CG 4.45Å; V90-L94 WeakPolarHBondContact O-CG 3.49Å; V90-L94 PolarHBondContact O-N 2.95Å; I91-L94 PolarHBondContact O-N 3.24Å; L94-V96 VanDerWaalsContact C-N 3.33Å; L94-V96 PolarHBondContact O-N 2.95Å; L94-E97 PolarHBondContact O-N 3.38Å; L94-I98 WeakPolarHBondContact O-CB 3.44Å; L94-I98 VanDerWaalsContact O-CG1 3.24Å; L94-I98 WeakPolarHBondContact O-CG1 3.34Å; L94-I98 PolarHBondContact O-N 2.85Å |
| 95 | E | 91.7 | Very high | 91.3 | Very high | 120 Ų | 120 | 109.5 Ų | 109.5 | 56% | 0.561 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -60.4 | -43.3 | 175.7 | -73.8 | -179.6 | 168.8 | 0 | 0 | 111.6 | I91 E99 | I91-E95 HydrophobicContact CG2-CG 4.31Å; I91-E95 WeakPolarHBondContact O-CG 3.31Å; I91-E95 PolarHBondContact O-N 3.49Å; E95-E99 WeakPolarHBondContact O-CB 3.24Å; E95-E99 PolarHBondContact O-N 2.84Å |
| 96 | V | 93.7 | Very high | 90.2 | Very high | 100 Ų | 100 | 107.9 Ų | 107.9 | 61% | 0.606 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -65.6 | -38.5 | 175.6 | 174.8 | 0 | 0 | 0 | 0 | 111.7 | D92 R93 L94 R100 | D92-V96 WeakPolarHBondContact O-CG2 3.26Å; D92-V96 PolarHBondContact O-N 3.46Å; R93-V96 PolarHBondContact O-N 3.07Å; L94-V96 VanDerWaalsContact C-N 3.33Å; L94-V96 PolarHBondContact O-N 2.95Å; V96-R100 WeakPolarHBondContact O-CB 3.48Å; V96-R100 PolarHBondContact O-N 3.26Å |
| 97 | E | 91.1 | Very high | 89.5 | Confident | 97 Ų | 97 | 107.1 Ų | 107.1 | 45% | 0.453 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -67.7 | -44.5 | 178.4 | -167.7 | 164.6 | -165.2 | 0 | 0 | 111.8 | R93 L94 E99 R100 D101 | R93-E97 PolarHBondContact O-N 2.93Å; R93-E97 VanDerWaalsContact O-N 3.13Å; L94-E97 PolarHBondContact O-N 3.38Å; E97-E99 VanDerWaalsContact C-N 3.34Å; E97-E99 PolarHBondContact O-N 3.29Å; E97-R100 WeakPolarHBondContact O-CB 3.46Å; E97-R100 PolarHBondContact O-N 2.76Å; E97-D101 PolarHBondContact O-N 3.42Å |
| 98 | I | 89.5 | Confident | 88.7 | Confident | 112 Ų | 112 | 107.9 Ų | 107.9 | 57% | 0.574 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -60.3 | -44.1 | 174.7 | -69.7 | 165.6 | 0 | 0 | 0 | 110.9 | L94 R100 D101 R102 | L94-I98 WeakPolarHBondContact O-CB 3.44Å; L94-I98 VanDerWaalsContact O-CG1 3.24Å; L94-I98 WeakPolarHBondContact O-CG1 3.34Å; L94-I98 PolarHBondContact O-N 2.85Å; I98-R100 VanDerWaalsContact C-N 3.33Å; I98-R100 PolarHBondContact O-N 2.81Å; I98-D101 PolarHBondContact O-N 3.46Å; I98-R102 WeakPolarHBondContact O-CB 3.49Å; I98-R102 PolarHBondContact O-N 3.24Å |
| 99 | E | 88.6 | Confident | 87.8 | Confident | 80 Ų | 80 | 103.7 Ų | 103.7 | 37% | 0.374 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -65.7 | -39.1 | 178.5 | -173.9 | 56.1 | -147.8 | 0 | 0 | 111.4 | E95 E97 R102 V103 | E95-E99 WeakPolarHBondContact O-CB 3.24Å; E95-E99 PolarHBondContact O-N 2.84Å; E97-E99 VanDerWaalsContact C-N 3.34Å; E97-E99 PolarHBondContact O-N 3.29Å; E99-R102 VanDerWaalsContact CD-NH2 3.31Å; E99-R102 PolarHBondContact O-N 2.93Å; E99-R102 IonicContact OE1-CZ 2.68Å; E99-R102 IonicContact OE1-NE 3.84Å; E99-R102 PolarHBondContact OE1-NE 3.06Å; E99-R102 IonicContact OE1-NH2 3.95Å; E99-R102 PolarHBondContact OE1-NH2 2.9Å; E99-R102 IonicContact OE2-CZ 3.62Å; E99-R102 VanDerWaalsContact OE2-CZ 3.24Å; E99-R102 IonicContact OE2-NE 3.68Å; E99-R102 PolarHBondContact OE2-NE 3.33Å; E99-R102 VanDerWaalsContact OE2-NE 3.07Å; E99-R102 IonicContact OE2-NH2 3.69Å; E99-R102 PolarHBondContact OE2-NH2 3.28Å; E99-R102 VanDerWaalsContact OE2-NH2 3.14Å; E99-V103 WeakPolarHBondContact O-CG2 3.46Å; E99-V103 PolarHBondContact O-N 3.45Å |
| 100 | R | 90 | Very high | 86.8 | Confident | 196 Ų | 196 | 108.7 Ų | 108.7 | 74% | 0.74 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -63.3 | -44.1 | 175.6 | -166.5 | -176.3 | -141.8 | 155.3 | 5.9 | 112 | V96 E97 I98 V103 G104 | V96-R100 WeakPolarHBondContact O-CB 3.48Å; V96-R100 PolarHBondContact O-N 3.26Å; E97-R100 WeakPolarHBondContact O-CB 3.46Å; E97-R100 PolarHBondContact O-N 2.76Å; I98-R100 VanDerWaalsContact C-N 3.33Å; I98-R100 PolarHBondContact O-N 2.81Å; R100-V103 PolarHBondContact O-N 3.34Å; R100-G104 PolarHBondContact O-N 3.42Å |
| 101 | D | 87.7 | Confident | 86 | Confident | 93 Ų | 93 | 109.5 Ų | 109.5 | 50% | 0.497 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -65 | -41.6 | 176.6 | -76.6 | -12.5 | 0 | 0 | 0 | 111.1 | E97 I98 V103 G104 H105 | E97-D101 PolarHBondContact O-N 3.42Å; I98-D101 PolarHBondContact O-N 3.46Å; D101-V103 PolarHBondContact O-N 3.16Å; D101-G104 PolarHBondContact O-N 3.28Å; D101-H105 WeakPolarHBondContact O-CB 3.25Å; D101-H105 PolarHBondContact O-CD2 3.28Å; D101-H105 PolarHBondContact O-N 3.45Å |
| 102 | R | 84.1 | Confident | 84.9 | Confident | 140 Ų | 140 | 111.6 Ų | 111.6 | 53% | 0.528 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -57.9 | -49.6 | 175.4 | -171.8 | -179.7 | 77.5 | 147.9 | 2.5 | 111.6 | I98 E99 G104 H105 D106 | I98-R102 WeakPolarHBondContact O-CB 3.49Å; I98-R102 PolarHBondContact O-N 3.24Å; E99-R102 VanDerWaalsContact CD-NH2 3.31Å; E99-R102 PolarHBondContact O-N 2.93Å; E99-R102 IonicContact OE1-CZ 2.68Å; E99-R102 IonicContact OE1-NE 3.84Å; E99-R102 PolarHBondContact OE1-NE 3.06Å; E99-R102 IonicContact OE1-NH2 3.95Å; E99-R102 PolarHBondContact OE1-NH2 2.9Å; E99-R102 IonicContact OE2-CZ 3.62Å; E99-R102 VanDerWaalsContact OE2-CZ 3.24Å; E99-R102 IonicContact OE2-NE 3.68Å; E99-R102 PolarHBondContact OE2-NE 3.33Å; E99-R102 VanDerWaalsContact OE2-NE 3.07Å; E99-R102 IonicContact OE2-NH2 3.69Å; E99-R102 PolarHBondContact OE2-NH2 3.28Å; E99-R102 VanDerWaalsContact OE2-NH2 3.14Å; R102-G104 VanDerWaalsContact C-N 3.35Å; R102-G104 PolarHBondContact O-N 3.01Å; R102-H105 PolarHBondContact O-N 3.06Å; R102-D106 PolarHBondContact O-N 2.76Å |
| 103 | V | 85.5 | Confident | 83.8 | Confident | 76 Ų | 76 | 112.5 Ų | 112.5 | 46% | 0.461 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -62.7 | -42.5 | 177.9 | 173.8 | 0 | 0 | 0 | 0 | 111 | E99 R100 D101 H105 D106 E107 | E99-V103 WeakPolarHBondContact O-CG2 3.46Å; E99-V103 PolarHBondContact O-N 3.45Å; R100-V103 PolarHBondContact O-N 3.34Å; D101-V103 PolarHBondContact O-N 3.16Å; V103-H105 VanDerWaalsContact C-N 3.35Å; V103-H105 PolarHBondContact O-N 3Å; V103-D106 PolarHBondContact O-N 3.33Å; V103-E107 WeakPolarHBondContact O-CB 3.25Å; V103-E107 PolarHBondContact O-N 3.44Å |
| 104 | G | 81.7 | Confident | 82.5 | Confident | 24 Ų | 24 | 105.7 Ų | 105.7 | 25% | 0.247 | 51% | 0.508 | C | S | . | . | H | α-helix | trans | -64.3 | -36.5 | 176.6 | 0 | 0 | 0 | 0 | 0 | 113.5 | R100 D101 R102 K108 | R100-G104 PolarHBondContact O-N 3.42Å; D101-G104 PolarHBondContact O-N 3.28Å; R102-G104 VanDerWaalsContact C-N 3.35Å; R102-G104 PolarHBondContact O-N 3.01Å; G104-K108 VanDerWaalsContact O-CG 3.31Å; G104-K108 WeakPolarHBondContact O-CG 3.48Å; G104-K108 PolarHBondContact O-N 2.81Å; G104-K108 VanDerWaalsContact O-N 3.13Å |
| 105 | H | 80.7 | Confident | 81.5 | Confident | 128 Ų | 128 | 107.5 Ų | 107.5 | 59% | 0.593 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -67.9 | -43.1 | 173.1 | -84.2 | -67.8 | 0 | 0 | 0 | 112.1 | D101 R102 V103 K108 L109 | D101-H105 WeakPolarHBondContact O-CB 3.25Å; D101-H105 PolarHBondContact O-CD2 3.28Å; D101-H105 PolarHBondContact O-N 3.45Å; R102-H105 PolarHBondContact O-N 3.06Å; V103-H105 VanDerWaalsContact C-N 3.35Å; V103-H105 PolarHBondContact O-N 3Å; H105-K108 PolarHBondContact O-N 3.16Å; H105-L109 VanDerWaalsContact O-CB 3.26Å; H105-L109 WeakPolarHBondContact O-CB 3.18Å; H105-L109 PolarHBondContact O-N 2.84Å |
| 106 | D | 75.7 | Confident | 80.3 | Confident | 63 Ų | 63 | 108.9 Ų | 108.9 | 34% | 0.337 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -63 | -40.9 | 176.6 | -84 | -6.5 | 0 | 0 | 0 | 112.1 | R102 V103 L109 R110 | R102-D106 PolarHBondContact O-N 2.76Å; V103-D106 PolarHBondContact O-N 3.33Å; D106-L109 PolarHBondContact O-N 2.79Å; D106-R110 WeakPolarHBondContact O-CB 3.3Å; D106-R110 VanDerWaalsContact O-CG 3.24Å; D106-R110 WeakPolarHBondContact O-CG 3.44Å; D106-R110 PolarHBondContact O-N 2.89Å; D106-R110 IonicContact OD2-NH2 3.75Å |
| 107 | E | 81.2 | Confident | 78.4 | Confident | 123 Ų | 123 | 111.4 Ų | 111.4 | 58% | 0.575 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -64.1 | -48.8 | 176.4 | -170.4 | 175.6 | -167.7 | 0 | 0 | 111.2 | V103 L109 R110 D111 | V103-E107 WeakPolarHBondContact O-CB 3.25Å; V103-E107 PolarHBondContact O-N 3.44Å; E107-L109 VanDerWaalsContact C-N 3.28Å; E107-L109 PolarHBondContact O-N 3.34Å; E107-R110 WeakPolarHBondContact O-CB 3.04Å; E107-R110 PolarHBondContact O-N 3.27Å; E107-D111 PolarHBondContact O-N 3.45Å |
| 108 | K | 79.9 | Confident | 77 | Confident | 148 Ų | 148 | 114.1 Ų | 114.1 | 64% | 0.643 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -58.6 | -39.5 | 174.1 | -73.7 | 174.1 | -176.8 | 172.8 | 0 | 112.2 | G104 H105 Y112 | G104-K108 VanDerWaalsContact O-CG 3.31Å; G104-K108 WeakPolarHBondContact O-CG 3.48Å; G104-K108 PolarHBondContact O-N 2.81Å; G104-K108 VanDerWaalsContact O-N 3.13Å; H105-K108 PolarHBondContact O-N 3.16Å; K108-Y112 VanDerWaalsContact O-CB 3.29Å; K108-Y112 WeakPolarHBondContact O-CB 3.32Å; K108-Y112 PolarHBondContact O-N 3.08Å |
| 109 | L | 76.9 | Confident | 75.7 | Confident | 91 Ų | 91 | 115.7 Ų | 115.7 | 48% | 0.476 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -67.4 | -43.5 | 177.3 | -179.1 | 61.5 | 0 | 0 | 0 | 111.2 | H105 D106 E107 Y112 I113 | H105-L109 VanDerWaalsContact O-CB 3.26Å; H105-L109 WeakPolarHBondContact O-CB 3.18Å; H105-L109 PolarHBondContact O-N 2.84Å; D106-L109 PolarHBondContact O-N 2.79Å; E107-L109 VanDerWaalsContact C-N 3.28Å; E107-L109 PolarHBondContact O-N 3.34Å; L109-Y112 PolarHBondContact O-N 3.49Å; L109-I113 HydrophobicContact CD1-CD1 4.03Å; L109-I113 HydrophobicContact CD1-CG1 4.27Å; L109-I113 HydrophobicContact CG-CD1 3.87Å; L109-I113 WeakPolarHBondContact O-CB 3.34Å; L109-I113 VanDerWaalsContact O-CG1 3.23Å; L109-I113 WeakPolarHBondContact O-CG1 3.17Å; L109-I113 PolarHBondContact O-N 2.88Å |
| 110 | R | 73.5 | Confident | 73.9 | Confident | 165 Ų | 165 | 114.9 Ų | 114.9 | 62% | 0.623 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -59.7 | -46 | 174.6 | -75.5 | 174.4 | -140.5 | -94.4 | -1.2 | 111.2 | D106 E107 I113 A114 | D106-R110 WeakPolarHBondContact O-CB 3.3Å; D106-R110 VanDerWaalsContact O-CG 3.24Å; D106-R110 WeakPolarHBondContact O-CG 3.44Å; D106-R110 PolarHBondContact O-N 2.89Å; D106-R110 IonicContact OD2-NH2 3.75Å; E107-R110 WeakPolarHBondContact O-CB 3.04Å; E107-R110 PolarHBondContact O-N 3.27Å; R110-I113 PolarHBondContact O-N 3.35Å; R110-A114 VanDerWaalsContact O-CB 3.26Å; R110-A114 WeakPolarHBondContact O-CB 3.26Å; R110-A114 PolarHBondContact O-N 2.92Å |
| 111 | D | 77.7 | Confident | 72 | Confident | 104 Ų | 104 | 113.1 Ų | 113.1 | 56% | 0.556 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -64.3 | -41.8 | 177.1 | -81.4 | -13 | 0 | 0 | 0 | 112.1 | E107 A114 H115 | E107-D111 PolarHBondContact O-N 3.45Å; D111-A114 PolarHBondContact O-N 3.11Å; D111-H115 WeakPolarHBondContact O-CB 3.27Å; D111-H115 PolarHBondContact O-N 3.42Å |
| 112 | Y | 70.6 | Confident | 70.3 | Confident | 133 Ų | 133 | 115.7 Ų | 115.7 | 52% | 0.522 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -61.6 | -45.6 | 174.6 | 176.3 | -101.7 | 0 | 0 | 0 | 111.7 | K108 L109 R116 | K108-Y112 VanDerWaalsContact O-CB 3.29Å; K108-Y112 WeakPolarHBondContact O-CB 3.32Å; K108-Y112 PolarHBondContact O-N 3.08Å; L109-Y112 PolarHBondContact O-N 3.49Å; Y112-R116 WeakPolarHBondContact O-CB 3.46Å; Y112-R116 PolarHBondContact O-N 2.73Å; Y112-R116 PolarHBondContact OH-NH1 3.01Å |
| 113 | I | 69.8 | Low | 68.8 | Low | 98 Ų | 98 | 116 Ų | 116 | 50% | 0.503 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -63.5 | -46.3 | 176.3 | -68.4 | 167.2 | 0 | 0 | 0 | 110.2 | L109 R110 H115 R116 Y117 | L109-I113 HydrophobicContact CD1-CD1 4.03Å; L109-I113 HydrophobicContact CD1-CG1 4.27Å; L109-I113 HydrophobicContact CG-CD1 3.87Å; L109-I113 WeakPolarHBondContact O-CB 3.34Å; L109-I113 VanDerWaalsContact O-CG1 3.23Å; L109-I113 WeakPolarHBondContact O-CG1 3.17Å; L109-I113 PolarHBondContact O-N 2.88Å; R110-I113 PolarHBondContact O-N 3.35Å; I113-H115 PolarHBondContact O-N 2.75Å; I113-R116 PolarHBondContact O-N 3.06Å; I113-Y117 VanDerWaalsContact O-CB 3.24Å; I113-Y117 WeakPolarHBondContact O-CB 3.38Å; I113-Y117 PolarHBondContact O-N 2.86Å |
| 114 | A | 69.6 | Low | 66.9 | Low | 44 Ų | 44 | 115.7 Ų | 115.7 | 36% | 0.364 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -62.8 | -43.6 | 179.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | R110 D111 Y117 K118 | R110-A114 VanDerWaalsContact O-CB 3.26Å; R110-A114 WeakPolarHBondContact O-CB 3.26Å; R110-A114 PolarHBondContact O-N 2.92Å; D111-A114 PolarHBondContact O-N 3.11Å; A114-Y117 PolarHBondContact O-N 3.5Å; A114-K118 WeakPolarHBondContact O-CB 3.35Å; A114-K118 WeakPolarHBondContact O-CG 3.36Å; A114-K118 PolarHBondContact O-N 3.26Å |
| 115 | H | 72.9 | Confident | 65.3 | Low | 123 Ų | 123 | 121.1 Ų | 121.1 | 57% | 0.569 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -65.9 | -43.8 | 175.9 | -176.6 | -98 | 0 | 0 | 0 | 111.6 | D111 I113 Y117 K118 R119 | D111-H115 WeakPolarHBondContact O-CB 3.27Å; D111-H115 PolarHBondContact O-N 3.42Å; I113-H115 PolarHBondContact O-N 2.75Å; H115-Y117 VanDerWaalsContact C-N 3.34Å; H115-Y117 PolarHBondContact O-N 3.23Å; H115-K118 PolarHBondContact O-N 2.77Å; H115-R119 WeakPolarHBondContact O-CB 3.49Å; H115-R119 PolarHBondContact O-N 3.49Å |
| 116 | R | 65.2 | Low | 63.8 | Low | 148 Ų | 148 | 117.4 Ų | 117.4 | 56% | 0.558 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -63.8 | -39.5 | 175.5 | -171.6 | 174.3 | -178.8 | 94.7 | 1.5 | 111.5 | Y112 I113 S120 | Y112-R116 WeakPolarHBondContact O-CB 3.46Å; Y112-R116 PolarHBondContact O-N 2.73Å; Y112-R116 PolarHBondContact OH-NH1 3.01Å; I113-R116 PolarHBondContact O-N 3.06Å; R116-S120 WeakPolarHBondContact O-CB 3.44Å; R116-S120 PolarHBondContact O-N 2.94Å; R116-S120 PolarHBondContact O-OG 2.87Å |
| 117 | Y | 55.4 | Low | 62.7 | Low | 153 Ų | 153 | 121.5 Ų | 121.5 | 60% | 0.6 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -68.1 | -45.8 | 176.6 | -167.2 | -102.6 | 0 | 0 | 0 | 111.3 | I113 A114 H115 R119 S120 R121 | I113-Y117 VanDerWaalsContact O-CB 3.24Å; I113-Y117 WeakPolarHBondContact O-CB 3.38Å; I113-Y117 PolarHBondContact O-N 2.86Å; A114-Y117 PolarHBondContact O-N 3.5Å; H115-Y117 VanDerWaalsContact C-N 3.34Å; H115-Y117 PolarHBondContact O-N 3.23Å; Y117-R119 PolarHBondContact O-N 2.84Å; Y117-S120 PolarHBondContact O-N 3.13Å; Y117-R121 WeakPolarHBondContact O-CB 3.28Å; Y117-R121 PolarHBondContact O-N 3.47Å |
| 118 | K | 61.9 | Low | 61.1 | Low | 154 Ų | 154 | 119 Ų | 119 | 67% | 0.67 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -58.2 | -47.7 | 173.6 | -78.1 | 179.2 | -178.5 | 176.4 | 0 | 111.8 | A114 H115 R121 F122 | A114-K118 WeakPolarHBondContact O-CB 3.35Å; A114-K118 WeakPolarHBondContact O-CG 3.36Å; A114-K118 PolarHBondContact O-N 3.26Å; H115-K118 PolarHBondContact O-N 2.77Å; K118-R121 PolarHBondContact O-N 2.91Å; K118-F122 WeakPolarHBondContact O-CB 3.34Å; K118-F122 PolarHBondContact O-N 2.77Å |
| 119 | R | 62.1 | Low | 59.6 | Low | 145 Ų | 145 | 113.4 Ų | 113.4 | 55% | 0.547 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -65.5 | -39.9 | 179.5 | -167.6 | 173.8 | -174.3 | 172.3 | 2.7 | 112.2 | H115 Y117 R123 | H115-R119 WeakPolarHBondContact O-CB 3.49Å; H115-R119 PolarHBondContact O-N 3.49Å; Y117-R119 PolarHBondContact O-N 2.84Å; R119-R123 PolarHBondContact O-N 2.89Å; R119-R123 VanDerWaalsContact O-N 3.16Å |
| 120 | S | 49.4 | Very low | 58.7 | Low | 64 Ų | 64 | 112.3 Ų | 112.3 | 45% | 0.448 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -69.9 | -43 | 176.8 | -57.7 | 0 | 0 | 0 | 0 | 111.3 | R116 Y117 R123 F124 | R116-S120 WeakPolarHBondContact O-CB 3.44Å; R116-S120 PolarHBondContact O-N 2.94Å; R116-S120 PolarHBondContact O-OG 2.87Å; Y117-S120 PolarHBondContact O-N 3.13Å; S120-R123 PolarHBondContact O-N 2.89Å; S120-F124 WeakPolarHBondContact O-CB 3.2Å; S120-F124 PolarHBondContact O-N 3.23Å |
| 121 | R | 50.1 | Low | 57.6 | Low | 159 Ų | 159 | 107.8 Ų | 107.8 | 60% | 0.6 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -64.4 | -41.1 | 176.7 | -175.4 | 178.3 | 168.2 | 106.9 | -3.2 | 111.9 | Y117 K118 F124 F125 | Y117-R121 WeakPolarHBondContact O-CB 3.28Å; Y117-R121 PolarHBondContact O-N 3.47Å; K118-R121 PolarHBondContact O-N 2.91Å; R121-F124 PolarHBondContact O-N 2.89Å; R121-F125 WeakPolarHBondContact O-CB 3.48Å; R121-F125 PolarHBondContact O-N 3.04Å |
| 122 | F | 51.6 | Low | 56.4 | Low | 146 Ų | 146 | 107.4 Ų | 107.4 | 64% | 0.64 | 48% | 0.48 | S | S | * | . | H | α-helix | trans | -64.7 | -50.2 | 176.2 | -175.6 | -96.1 | 0 | 0 | 0 | 111.6 | K118 F124 F125 C126 | K118-F122 WeakPolarHBondContact O-CB 3.34Å; K118-F122 PolarHBondContact O-N 2.77Å; F122-F124 VanDerWaalsContact C-N 3.26Å; F122-F124 PolarHBondContact O-N 3.27Å; F122-F125 PolarHBondContact O-N 3.05Å; F122-C126 PolarHBondContact O-N 3.34Å; F122-C126 PolarHBondContact O-SG 2.88Å |
| 123 | R | 53.1 | Low | 55.4 | Low | 147 Ų | 147 | 109.3 Ų | 109.3 | 56% | 0.555 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -59.9 | -38 | 174.6 | -80.3 | -179.2 | 171.2 | 170.4 | -3.9 | 112 | R119 S120 R127 | R119-R123 PolarHBondContact O-N 2.89Å; R119-R123 VanDerWaalsContact O-N 3.16Å; S120-R123 PolarHBondContact O-N 2.89Å; R123-R127 WeakPolarHBondContact O-CB 3.42Å; R123-R127 WeakPolarHBondContact O-CG 3.34Å; R123-R127 PolarHBondContact O-N 3.01Å |
| 124 | F | 45.7 | Very low | 54.7 | Low | 69 Ų | 69 | 112.9 Ų | 112.9 | 30% | 0.303 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -65.5 | -49.1 | 175.7 | 179.9 | -105 | 0 | 0 | 0 | 111.4 | S120 R121 F122 C126 R127 F128 L197 | S120-F124 WeakPolarHBondContact O-CB 3.2Å; S120-F124 PolarHBondContact O-N 3.23Å; R121-F124 PolarHBondContact O-N 2.89Å; F122-F124 VanDerWaalsContact C-N 3.26Å; F122-F124 PolarHBondContact O-N 3.27Å; F124-C126 VanDerWaalsContact C-N 3.34Å; F124-C126 PolarHBondContact O-N 2.98Å; F124-R127 CarbonylContact O-C 3.5Å; F124-R127 PolarHBondContact O-N 2.78Å; F124-F128 HydrophobicContact CD1-CB 4.47Å; F124-F128 HydrophobicContact CE1-CB 4.16Å; F124-F128 HydrophobicContact CE1-CD2 4.31Å; F124-F128 HydrophobicContact CE1-CG 4.31Å; F124-F128 HydrophobicContact CE2-CB 4.42Å; F124-F128 HydrophobicContact CE2-CD2 4.49Å; F124-F128 HydrophobicContact CZ-CB 4.15Å; F124-F128 AromaticContact CZ-CD2 3.84Å; F124-F128 HydrophobicContact CZ-CD2 3.84Å; F124-F128 HydrophobicContact CZ-CG 4.23Å; F124-F128 WeakPolarHBondContact O-CA 3.18Å; F124-F128 WeakPolarHBondContact O-CB 2.88Å; F124-F128 PolarHBondContact O-N 2.86Å; F124-L197 HydrophobicContact CD2-CD1 3.65Å; F124-L197 HydrophobicContact CD2-CD2 3.5Å; F124-L197 VanDerWaalsContact CD2-CD2 3.5Å; F124-L197 HydrophobicContact CD2-CG 4.17Å; F124-L197 HydrophobicContact CE2-CB 4.4Å; F124-L197 HydrophobicContact CE2-CD1 3.74Å; F124-L197 HydrophobicContact CE2-CD2 3.16Å; F124-L197 HydrophobicContact CE2-CG 3.91Å; F124-L197 HydrophobicContact CZ-CD2 3.93Å |
| 125 | F | 48.6 | Very low | 53.7 | Low | 138 Ų | 138 | 112.3 Ų | 112.3 | 61% | 0.605 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -61 | -42.2 | 179.6 | -171.7 | -95.5 | 0 | 0 | 0 | 111.7 | R121 F122 S129 | R121-F125 WeakPolarHBondContact O-CB 3.48Å; R121-F125 PolarHBondContact O-N 3.04Å; F122-F125 PolarHBondContact O-N 3.05Å; F125-S129 VanDerWaalsContact O-CB 3.31Å; F125-S129 WeakPolarHBondContact O-CB 3.13Å; F125-S129 PolarHBondContact O-N 2.96Å; F125-S129 PolarHBondContact O-OG 2.77Å |
| 126 | C | 49.4 | Very low | 52.7 | Low | 51 Ų | 51 | 109.2 Ų | 109.2 | 35% | 0.345 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -62.6 | -48.6 | 174.3 | -68.6 | 0 | 0 | 0 | 0 | 111.7 | F122 F124 S129 T130 | F122-C126 PolarHBondContact O-N 3.34Å; F122-C126 PolarHBondContact O-SG 2.88Å; F124-C126 VanDerWaalsContact C-N 3.34Å; F124-C126 PolarHBondContact O-N 2.98Å; C126-S129 PolarHBondContact O-OG 2.87Å; C126-T130 PolarHBondContact O-N 3.43Å; C126-T130 VanDerWaalsContact O-N 3.1Å; C126-T130 PolarHBondContact O-OG1 2.88Å |
| 127 | R | 52.6 | Low | 52.2 | Low | 149 Ų | 149 | 104.6 Ų | 104.6 | 56% | 0.562 | 47% | 0.472 | S | S | * | . | H | α-helix | trans | -65.5 | -40.8 | 178.1 | -77.5 | -178.4 | 174.5 | 169.2 | -4 | 112.4 | R123 F124 T130 F131 V189 | R123-R127 WeakPolarHBondContact O-CB 3.42Å; R123-R127 WeakPolarHBondContact O-CG 3.34Å; R123-R127 PolarHBondContact O-N 3.01Å; F124-R127 CarbonylContact O-C 3.5Å; F124-R127 PolarHBondContact O-N 2.78Å; R127-T130 PolarHBondContact O-N 2.94Å; R127-F131 VanDerWaalsContact O-CB 3.24Å; R127-F131 WeakPolarHBondContact O-CB 3.14Å; R127-F131 PolarHBondContact O-N 3.19Å; R127-V189 VanDerWaalsContact NH1-CG2 3.3Å |
| 128 | F | 46.6 | Very low | 52.3 | Low | 71 Ų | 71 | 101.8 Ų | 101.8 | 31% | 0.311 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -65.3 | -45.6 | 177.6 | -177.1 | -94.7 | 0 | 0 | 0 | 110.9 | F124 T130 F131 H132 F201 | F124-F128 HydrophobicContact CD1-CB 4.47Å; F124-F128 HydrophobicContact CE1-CB 4.16Å; F124-F128 HydrophobicContact CE1-CD2 4.31Å; F124-F128 HydrophobicContact CE1-CG 4.31Å; F124-F128 HydrophobicContact CE2-CB 4.42Å; F124-F128 HydrophobicContact CE2-CD2 4.49Å; F124-F128 HydrophobicContact CZ-CB 4.15Å; F124-F128 AromaticContact CZ-CD2 3.84Å; F124-F128 HydrophobicContact CZ-CD2 3.84Å; F124-F128 HydrophobicContact CZ-CG 4.23Å; F124-F128 WeakPolarHBondContact O-CA 3.18Å; F124-F128 WeakPolarHBondContact O-CB 2.88Å; F124-F128 PolarHBondContact O-N 2.86Å; F128-T130 VanDerWaalsContact C-N 3.26Å; F128-T130 PolarHBondContact O-N 3.43Å; F128-F131 PolarHBondContact O-N 3.47Å; F128-H132 HydrophobicContact CE1-CB 4.38Å; F128-H132 WeakPolarHBondContact O-CB 3.18Å; F128-H132 PolarHBondContact O-N 3.11Å; F128-F201 HydrophobicContact CE2-CD2 4.26Å |
| 129 | S | 49.1 | Very low | 51.8 | Low | 30 Ų | 30 | 97.8 Ų | 97.8 | 21% | 0.21 | 46% | 0.458 | C | S | . | . | H | α-helix | trans | -63.1 | -34.6 | 176.3 | 74.8 | 0 | 0 | 0 | 0 | 112.3 | F125 C126 R133 | F125-S129 VanDerWaalsContact O-CB 3.31Å; F125-S129 WeakPolarHBondContact O-CB 3.13Å; F125-S129 PolarHBondContact O-N 2.96Å; F125-S129 PolarHBondContact O-OG 2.77Å; C126-S129 PolarHBondContact O-OG 2.87Å; S129-R133 WeakPolarHBondContact O-CB 3.49Å; S129-R133 VanDerWaalsContact O-CG 3.3Å; S129-R133 WeakPolarHBondContact O-CG 3.2Å; S129-R133 PolarHBondContact O-N 2.7Å; S129-R133 VanDerWaalsContact O-N 3.1Å; S129-R133 PolarHBondContact O-NE 3.18Å |
| 130 | T | 57.1 | Low | 51.8 | Low | 67 Ų | 67 | 93.9 Ų | 93.9 | 41% | 0.411 | 45% | 0.452 | S | S | . | . | H | α-helix | trans | -72.2 | -42.1 | 176.2 | -48.8 | 0 | 0 | 0 | 0 | 110.8 | C126 R127 F128 R134 | C126-T130 PolarHBondContact O-N 3.43Å; C126-T130 VanDerWaalsContact O-N 3.1Å; C126-T130 PolarHBondContact O-OG1 2.88Å; R127-T130 PolarHBondContact O-N 2.94Å; F128-T130 VanDerWaalsContact C-N 3.26Å; F128-T130 PolarHBondContact O-N 3.43Å; T130-R134 WeakPolarHBondContact O-CG 3.27Å; T130-R134 PolarHBondContact O-N 3.39Å; T130-R134 VanDerWaalsContact O-N 3.08Å |
| 131 | F | 52.1 | Low | 52.1 | Low | 71 Ų | 71 | 95.7 Ų | 95.7 | 31% | 0.311 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -66.3 | -48.4 | 176.6 | 179.9 | -102.1 | 0 | 0 | 0 | 111.7 | R127 F128 R133 R134 C135 L184 F201 | R127-F131 VanDerWaalsContact O-CB 3.24Å; R127-F131 WeakPolarHBondContact O-CB 3.14Å; R127-F131 PolarHBondContact O-N 3.19Å; F128-F131 PolarHBondContact O-N 3.47Å; F131-R133 VanDerWaalsContact C-N 3.32Å; F131-R133 PolarHBondContact O-N 3.14Å; F131-R134 CarbonylContact O-C 3.55Å; F131-R134 WeakPolarHBondContact O-CA 3.26Å; F131-R134 WeakPolarHBondContact O-CB 3.27Å; F131-R134 PolarHBondContact O-N 2.9Å; F131-C135 WeakPolarHBondContact CE1-SG 3.48Å; F131-C135 WeakPolarHBondContact CZ-SG 3.39Å; F131-C135 PolarHBondContact O-N 2.99Å; F131-L184 HydrophobicContact CE2-CD1 4.26Å; F131-F201 HydrophobicContact CD1-CE2 4.39Å; F131-F201 HydrophobicContact CE1-CD1 4.38Å; F131-F201 AromaticContact CE1-CD2 3.94Å; F131-F201 HydrophobicContact CE1-CD2 3.94Å; F131-F201 HydrophobicContact CE1-CE1 4.22Å; F131-F201 AromaticContact CE1-CE2 3.76Å; F131-F201 HydrophobicContact CE1-CE2 3.76Å; F131-F201 HydrophobicContact CE1-CG 4.25Å; F131-F201 AromaticContact CE1-CZ 3.91Å; F131-F201 HydrophobicContact CE1-CZ 3.91Å |
| 132 | H | 51 | Low | 52.3 | Low | 95 Ų | 95 | 93.8 Ų | 93.8 | 44% | 0.44 | 45% | 0.449 | S | S | . | . | H | α-helix | trans | -56.3 | -45.7 | 175.3 | -175.2 | -78.6 | 0 | 0 | 0 | 110.8 | F128 R134 C135 S136 | F128-H132 HydrophobicContact CE1-CB 4.38Å; F128-H132 WeakPolarHBondContact O-CB 3.18Å; F128-H132 PolarHBondContact O-N 3.11Å; H132-R134 VanDerWaalsContact C-N 3.33Å; H132-R134 PolarHBondContact O-N 3.38Å; H132-C135 PolarHBondContact O-N 3.49Å; H132-S136 PolarHBondContact CE1-OG 3.37Å; H132-S136 WeakPolarHBondContact O-CB 3.13Å; H132-S136 PolarHBondContact O-N 3.16Å; H132-S136 PolarHBondContact O-OG 2.97Å; H132-S136 VanDerWaalsContact O-OG 3.05Å |
| 133 | R | 50.8 | Low | 52.7 | Low | 174 Ų | 174 | 93.7 Ų | 93.7 | 66% | 0.657 | 45% | 0.451 | S | S | * | . | H | α-helix | trans | -58.5 | -42.5 | 173.8 | -81 | -173.9 | -105.2 | -157.7 | -4.3 | 112.6 | S129 F131 A137 | S129-R133 WeakPolarHBondContact O-CB 3.49Å; S129-R133 VanDerWaalsContact O-CG 3.3Å; S129-R133 WeakPolarHBondContact O-CG 3.2Å; S129-R133 PolarHBondContact O-N 2.7Å; S129-R133 VanDerWaalsContact O-N 3.1Å; S129-R133 PolarHBondContact O-NE 3.18Å; F131-R133 VanDerWaalsContact C-N 3.32Å; F131-R133 PolarHBondContact O-N 3.14Å; R133-A137 WeakPolarHBondContact O-CB 3.26Å; R133-A137 PolarHBondContact O-N 3.14Å |
| 134 | R | 55.4 | Low | 53 | Low | 172 Ų | 172 | 91.9 Ų | 91.9 | 65% | 0.649 | 45% | 0.449 | S | S | * | . | H | α-helix | trans | -66.6 | -41.5 | 175.6 | -72.7 | 177.6 | 179.6 | -176.3 | -0.7 | 112.4 | T130 F131 H132 A137 L138 | T130-R134 WeakPolarHBondContact O-CG 3.27Å; T130-R134 PolarHBondContact O-N 3.39Å; T130-R134 VanDerWaalsContact O-N 3.08Å; F131-R134 CarbonylContact O-C 3.55Å; F131-R134 WeakPolarHBondContact O-CA 3.26Å; F131-R134 WeakPolarHBondContact O-CB 3.27Å; F131-R134 PolarHBondContact O-N 2.9Å; H132-R134 VanDerWaalsContact C-N 3.33Å; H132-R134 PolarHBondContact O-N 3.38Å; R134-A137 PolarHBondContact O-N 3.26Å; R134-L138 WeakPolarHBondContact O-CB 3.14Å; R134-L138 WeakPolarHBondContact O-CG 3.15Å; R134-L138 PolarHBondContact O-N 2.83Å |
| 135 | C | 47.3 | Very low | 53.9 | Low | 32 Ų | 32 | 93.3 Ų | 93.3 | 22% | 0.216 | 46% | 0.459 | C | S | . | . | H | α-helix | trans | -64.9 | -45.8 | 176.4 | -75.9 | 0 | 0 | 0 | 0 | 111.6 | F131 H132 A137 L138 S139 | F131-C135 WeakPolarHBondContact CE1-SG 3.48Å; F131-C135 WeakPolarHBondContact CZ-SG 3.39Å; F131-C135 PolarHBondContact O-N 2.99Å; H132-C135 PolarHBondContact O-N 3.49Å; C135-A137 VanDerWaalsContact C-N 3.31Å; C135-A137 PolarHBondContact O-N 2.95Å; C135-L138 PolarHBondContact O-N 3.21Å; C135-S139 WeakPolarHBondContact O-CB 3.23Å; C135-S139 PolarHBondContact O-N 3.39Å; C135-S139 PolarHBondContact O-OG 3.46Å; C135-S139 VanDerWaalsContact O-OG 3.12Å |
| 136 | S | 51.2 | Low | 54.6 | Low | 58 Ų | 58 | 91 Ų | 91 | 41% | 0.406 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -60.2 | -41.9 | 175 | -58.6 | 0 | 0 | 0 | 0 | 111.6 | H132 S139 C140 | H132-S136 PolarHBondContact CE1-OG 3.37Å; H132-S136 WeakPolarHBondContact O-CB 3.13Å; H132-S136 PolarHBondContact O-N 3.16Å; H132-S136 PolarHBondContact O-OG 2.97Å; H132-S136 VanDerWaalsContact O-OG 3.05Å; S136-S139 PolarHBondContact O-N 2.9Å; S136-C140 WeakPolarHBondContact O-CB 3.5Å; S136-C140 PolarHBondContact O-N 2.84Å |
| 137 | A | 56.7 | Low | 55.3 | Low | 52 Ų | 52 | 96.5 Ų | 96.5 | 43% | 0.43 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -64.1 | -41.9 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | R133 R134 C135 C140 L141 | R133-A137 WeakPolarHBondContact O-CB 3.26Å; R133-A137 PolarHBondContact O-N 3.14Å; R134-A137 PolarHBondContact O-N 3.26Å; C135-A137 VanDerWaalsContact C-N 3.31Å; C135-A137 PolarHBondContact O-N 2.95Å; A137-C140 PolarHBondContact O-N 3.44Å; A137-L141 WeakPolarHBondContact O-CG 3.39Å; A137-L141 PolarHBondContact O-N 3.2Å |
| 138 | L | 57.2 | Low | 55.6 | Low | 93 Ų | 93 | 92.4 Ų | 92.4 | 49% | 0.487 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -66.7 | -40.7 | 176.2 | -80.5 | 164.2 | 0 | 0 | 0 | 112.4 | R134 C135 C140 L141 R142 | R134-L138 WeakPolarHBondContact O-CB 3.14Å; R134-L138 WeakPolarHBondContact O-CG 3.15Å; R134-L138 PolarHBondContact O-N 2.83Å; C135-L138 PolarHBondContact O-N 3.21Å; L138-C140 VanDerWaalsContact C-N 3.33Å; L138-L141 PolarHBondContact O-N 3.49Å; L138-R142 VanDerWaalsContact O-CB 3.26Å; L138-R142 WeakPolarHBondContact O-CB 3.4Å; L138-R142 PolarHBondContact O-N 2.91Å |
| 139 | S | 51.3 | Low | 56.3 | Low | 70 Ų | 70 | 92.9 Ų | 92.9 | 49% | 0.49 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -61.3 | -43.7 | 174.2 | -65.4 | 0 | 0 | 0 | 0 | 110.7 | C135 S136 R142 E143 | C135-S139 WeakPolarHBondContact O-CB 3.23Å; C135-S139 PolarHBondContact O-N 3.39Å; C135-S139 PolarHBondContact O-OG 3.46Å; C135-S139 VanDerWaalsContact O-OG 3.12Å; S136-S139 PolarHBondContact O-N 2.9Å; S139-R142 PolarHBondContact O-N 3.39Å; S139-E143 WeakPolarHBondContact O-CG 3.25Å; S139-E143 PolarHBondContact O-N 2.64Å |
| 140 | C | 60.8 | Low | 57 | Low | 63 Ų | 63 | 93.7 Ų | 93.7 | 43% | 0.426 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -61.2 | -47.6 | 174.8 | -176.4 | 0 | 0 | 0 | 0 | 112 | S136 A137 L138 R142 E143 Q144 | S136-C140 WeakPolarHBondContact O-CB 3.5Å; S136-C140 PolarHBondContact O-N 2.84Å; A137-C140 PolarHBondContact O-N 3.44Å; L138-C140 VanDerWaalsContact C-N 3.33Å; C140-R142 VanDerWaalsContact C-N 3.26Å; C140-R142 PolarHBondContact O-N 3.09Å; C140-E143 PolarHBondContact O-N 3.05Å; C140-Q144 WeakPolarHBondContact O-CG 3.33Å; C140-Q144 PolarHBondContact O-N 3.47Å |
| 141 | L | 56.5 | Low | 57.6 | Low | 103 Ų | 103 | 94.2 Ų | 94.2 | 54% | 0.539 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -61.9 | -34.5 | 174.9 | -75.1 | 169.3 | 0 | 0 | 0 | 112.3 | A137 L138 Q144 L145 | A137-L141 WeakPolarHBondContact O-CG 3.39Å; A137-L141 PolarHBondContact O-N 3.2Å; L138-L141 PolarHBondContact O-N 3.49Å; L141-Q144 WeakPolarHBondContact O-CB 3.45Å; L141-Q144 PolarHBondContact O-N 3.02Å; L141-L145 WeakPolarHBondContact O-CB 3.47Å; L141-L145 PolarHBondContact O-N 3.26Å |
| 142 | R | 55 | Low | 58.4 | Low | 118 Ų | 118 | 95.3 Ų | 95.3 | 45% | 0.445 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -72.1 | -41.1 | 178.5 | -167.9 | 179.2 | -175.4 | -158.6 | 1 | 111.5 | L138 S139 C140 Q144 L145 V146 | L138-R142 VanDerWaalsContact O-CB 3.26Å; L138-R142 WeakPolarHBondContact O-CB 3.4Å; L138-R142 PolarHBondContact O-N 2.91Å; S139-R142 PolarHBondContact O-N 3.39Å; C140-R142 VanDerWaalsContact C-N 3.26Å; C140-R142 PolarHBondContact O-N 3.09Å; R142-Q144 VanDerWaalsContact C-N 3.3Å; R142-L145 PolarHBondContact O-N 3.21Å; R142-V146 VanDerWaalsContact O-CG2 3.32Å; R142-V146 WeakPolarHBondContact O-CG2 3.47Å; R142-V146 PolarHBondContact O-N 3.42Å |
| 143 | E | 59.2 | Low | 59.2 | Low | 144 Ų | 144 | 94.1 Ų | 94.1 | 67% | 0.673 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -60.4 | -43 | 171.9 | -76.2 | 179 | -176.3 | 0 | 0 | 110.9 | S139 C140 L145 V146 W147 | S139-E143 WeakPolarHBondContact O-CG 3.25Å; S139-E143 PolarHBondContact O-N 2.64Å; C140-E143 PolarHBondContact O-N 3.05Å; E143-L145 VanDerWaalsContact C-N 3.35Å; E143-L145 PolarHBondContact O-N 2.86Å; E143-V146 PolarHBondContact O-N 3.48Å; E143-W147 WeakPolarHBondContact O-CB 3.26Å; E143-W147 PolarHBondContact O-N 3.28Å |
| 144 | Q | 59.3 | Low | 60.3 | Low | 109 Ų | 109 | 90.6 Ų | 90.6 | 51% | 0.509 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -59.4 | -44.4 | 172.1 | -71.6 | 176.2 | -9.2 | 0 | 0 | 111.6 | C140 L141 R142 W147 V148 | C140-Q144 WeakPolarHBondContact O-CG 3.33Å; C140-Q144 PolarHBondContact O-N 3.47Å; L141-Q144 WeakPolarHBondContact O-CB 3.45Å; L141-Q144 PolarHBondContact O-N 3.02Å; R142-Q144 VanDerWaalsContact C-N 3.3Å; Q144-W147 PolarHBondContact O-N 3.19Å; Q144-V148 WeakPolarHBondContact O-CB 3.43Å; Q144-V148 VanDerWaalsContact O-CG2 3.26Å; Q144-V148 WeakPolarHBondContact O-CG2 3.31Å; Q144-V148 PolarHBondContact O-N 3.45Å |
| 145 | L | 63.9 | Low | 60.9 | Low | 99 Ų | 99 | 89.7 Ų | 89.7 | 52% | 0.518 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -67.1 | -38.9 | 178.4 | -173.6 | 68.4 | 0 | 0 | 0 | 112.6 | L141 R142 E143 W147 V148 N149 | L141-L145 WeakPolarHBondContact O-CB 3.47Å; L141-L145 PolarHBondContact O-N 3.26Å; R142-L145 PolarHBondContact O-N 3.21Å; E143-L145 VanDerWaalsContact C-N 3.35Å; E143-L145 PolarHBondContact O-N 2.86Å; L145-W147 VanDerWaalsContact C-N 3.33Å; L145-V148 PolarHBondContact O-N 3.33Å; L145-N149 VanDerWaalsContact O-CB 3.26Å; L145-N149 WeakPolarHBondContact O-CB 3.32Å; L145-N149 PolarHBondContact O-N 2.69Å; L145-N149 PolarHBondContact O-ND2 2.76Å |
| 146 | V | 63.4 | Low | 61.7 | Low | 90 Ų | 90 | 95 Ų | 95 | 55% | 0.545 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -64.2 | -42.7 | 174.9 | 169.9 | 0 | 0 | 0 | 0 | 109.9 | R142 E143 N149 A150 | R142-V146 VanDerWaalsContact O-CG2 3.32Å; R142-V146 WeakPolarHBondContact O-CG2 3.47Å; R142-V146 PolarHBondContact O-N 3.42Å; E143-V146 PolarHBondContact O-N 3.48Å; V146-N149 PolarHBondContact O-N 2.81Å; V146-A150 WeakPolarHBondContact O-CB 3.36Å; V146-A150 PolarHBondContact O-N 3.35Å |
| 147 | W | 65.4 | Low | 62.2 | Low | 166 Ų | 166 | 97.3 Ų | 97.3 | 63% | 0.629 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -61.3 | -48.5 | 174.7 | -174.9 | 90.5 | 0 | 0 | 0 | 111.4 | E143 Q144 L145 N149 A150 Q151 | E143-W147 WeakPolarHBondContact O-CB 3.26Å; E143-W147 PolarHBondContact O-N 3.28Å; Q144-W147 PolarHBondContact O-N 3.19Å; L145-W147 VanDerWaalsContact C-N 3.33Å; W147-N149 VanDerWaalsContact C-N 3.35Å; W147-N149 PolarHBondContact O-N 2.84Å; W147-A150 WeakPolarHBondContact O-CB 3.48Å; W147-A150 PolarHBondContact O-N 2.8Å; W147-Q151 HydrophobicContact CD2-CG 4.1Å; W147-Q151 HydrophobicContact CE3-CG 4.08Å; W147-Q151 HydrophobicContact CH2-CG 3.99Å; W147-Q151 HydrophobicContact CZ2-CG 4Å; W147-Q151 HydrophobicContact CZ3-CG 4.03Å; W147-Q151 WeakPolarHBondContact O-CG 3.37Å; W147-Q151 PolarHBondContact O-N 2.98Å |
| 148 | V | 58.7 | Low | 62.7 | Low | 63 Ų | 63 | 100.3 Ų | 100.3 | 38% | 0.382 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -60.5 | -44.5 | 175.8 | 170.8 | 0 | 0 | 0 | 0 | 110.9 | Q144 L145 A150 Q151 L152 | Q144-V148 WeakPolarHBondContact O-CB 3.43Å; Q144-V148 VanDerWaalsContact O-CG2 3.26Å; Q144-V148 WeakPolarHBondContact O-CG2 3.31Å; Q144-V148 PolarHBondContact O-N 3.45Å; L145-V148 PolarHBondContact O-N 3.33Å; V148-A150 PolarHBondContact O-N 3.07Å; V148-Q151 PolarHBondContact O-N 3.43Å; V148-L152 HydrophobicContact CG1-CD1 4Å; V148-L152 HydrophobicContact CG1-CG 4.31Å; V148-L152 WeakPolarHBondContact O-CB 3.31Å; V148-L152 VanDerWaalsContact O-CG 3.31Å; V148-L152 WeakPolarHBondContact O-CG 3.33Å; V148-L152 PolarHBondContact O-N 2.94Å |
| 149 | N | 60.3 | Low | 62.8 | Low | 82 Ų | 82 | 102.9 Ų | 102.9 | 44% | 0.439 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -62.7 | -43.7 | 177.3 | -84.7 | -34.9 | 0 | 0 | 0 | 111 | L145 V146 W147 Q151 L152 T153 | L145-N149 VanDerWaalsContact O-CB 3.26Å; L145-N149 WeakPolarHBondContact O-CB 3.32Å; L145-N149 PolarHBondContact O-N 2.69Å; L145-N149 PolarHBondContact O-ND2 2.76Å; V146-N149 PolarHBondContact O-N 2.81Å; W147-N149 VanDerWaalsContact C-N 3.35Å; W147-N149 PolarHBondContact O-N 2.84Å; N149-Q151 VanDerWaalsContact C-N 3.33Å; N149-Q151 PolarHBondContact O-N 3.18Å; N149-L152 CarbonylContact O-C 3.51Å; N149-L152 PolarHBondContact O-N 3.47Å; N149-T153 PolarHBondContact O-N 3.42Å; N149-T153 PolarHBondContact O-OG1 2.83Å |
| 150 | A | 64.3 | Low | 62.9 | Low | 46 Ų | 46 | 102.5 Ų | 102.5 | 38% | 0.38 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -58.6 | -44.9 | 175.3 | 0 | 0 | 0 | 0 | 0 | 111.3 | V146 W147 V148 T153 L154 | V146-A150 WeakPolarHBondContact O-CB 3.36Å; V146-A150 PolarHBondContact O-N 3.35Å; W147-A150 WeakPolarHBondContact O-CB 3.48Å; W147-A150 PolarHBondContact O-N 2.8Å; V148-A150 PolarHBondContact O-N 3.07Å; A150-T153 PolarHBondContact O-N 3.46Å; A150-T153 VanDerWaalsContact O-N 3.1Å; A150-L154 WeakPolarHBondContact O-CG 3.45Å; A150-L154 PolarHBondContact O-N 3.34Å |
| 151 | Q | 70.7 | Confident | 62.5 | Low | 78 Ų | 78 | 106.2 Ų | 106.2 | 36% | 0.364 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -61.4 | -44.7 | 174.5 | -68 | -58.2 | -34.5 | 0 | 0 | 112 | W147 V148 N149 T153 L154 R155 | W147-Q151 HydrophobicContact CD2-CG 4.1Å; W147-Q151 HydrophobicContact CE3-CG 4.08Å; W147-Q151 HydrophobicContact CH2-CG 3.99Å; W147-Q151 HydrophobicContact CZ2-CG 4Å; W147-Q151 HydrophobicContact CZ3-CG 4.03Å; W147-Q151 WeakPolarHBondContact O-CG 3.37Å; W147-Q151 PolarHBondContact O-N 2.98Å; V148-Q151 PolarHBondContact O-N 3.43Å; N149-Q151 VanDerWaalsContact C-N 3.33Å; N149-Q151 PolarHBondContact O-N 3.18Å; Q151-T153 VanDerWaalsContact C-N 3.25Å; Q151-T153 PolarHBondContact O-N 2.94Å; Q151-L154 PolarHBondContact O-N 3Å; Q151-R155 WeakPolarHBondContact O-CB 3.49Å; Q151-R155 WeakPolarHBondContact O-CG 3.49Å; Q151-R155 PolarHBondContact O-N 3.41Å |
| 152 | L | 67.4 | Low | 62.2 | Low | 94 Ų | 94 | 112.1 Ų | 112.1 | 49% | 0.492 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -62.8 | -32.5 | 173.5 | -70.7 | 173 | 0 | 0 | 0 | 112 | V148 N149 R156 | V148-L152 HydrophobicContact CG1-CD1 4Å; V148-L152 HydrophobicContact CG1-CG 4.31Å; V148-L152 WeakPolarHBondContact O-CB 3.31Å; V148-L152 VanDerWaalsContact O-CG 3.31Å; V148-L152 WeakPolarHBondContact O-CG 3.33Å; V148-L152 PolarHBondContact O-N 2.94Å; N149-L152 CarbonylContact O-C 3.51Å; N149-L152 PolarHBondContact O-N 3.47Å; L152-R156 WeakPolarHBondContact O-CB 3.4Å; L152-R156 PolarHBondContact O-N 3.08Å |
| 153 | T | 69.4 | Low | 61.5 | Low | 70 Ų | 70 | 111.9 Ų | 111.9 | 43% | 0.429 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -74.7 | -37.9 | 178.5 | -28.5 | 0 | 0 | 0 | 0 | 110.6 | N149 A150 Q151 R156 K157 | N149-T153 PolarHBondContact O-N 3.42Å; N149-T153 PolarHBondContact O-OG1 2.83Å; A150-T153 PolarHBondContact O-N 3.46Å; A150-T153 VanDerWaalsContact O-N 3.1Å; Q151-T153 VanDerWaalsContact C-N 3.25Å; Q151-T153 PolarHBondContact O-N 2.94Å; T153-R156 PolarHBondContact O-N 3.04Å; T153-K157 WeakPolarHBondContact O-CB 3.36Å; T153-K157 WeakPolarHBondContact O-CG 3.38Å; T153-K157 PolarHBondContact O-N 3.2Å |
| 154 | L | 73.1 | Confident | 60.6 | Low | 101 Ų | 101 | 108 Ų | 108 | 53% | 0.529 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -64.6 | -46.7 | 172.3 | -70.2 | 173.1 | 0 | 0 | 0 | 111 | A150 Q151 R156 K157 E158 | A150-L154 WeakPolarHBondContact O-CG 3.45Å; A150-L154 PolarHBondContact O-N 3.34Å; Q151-L154 PolarHBondContact O-N 3Å; L154-R156 VanDerWaalsContact C-N 3.34Å; L154-R156 PolarHBondContact O-N 3.32Å; L154-K157 CarbonylContact O-C 3.51Å; L154-K157 WeakPolarHBondContact O-CB 3.05Å; L154-K157 PolarHBondContact O-N 2.82Å; L154-E158 WeakPolarHBondContact O-CB 3.31Å; L154-E158 PolarHBondContact O-N 2.84Å |
| 155 | R | 66.9 | Low | 59.7 | Low | 152 Ų | 152 | 111.6 Ų | 111.6 | 57% | 0.574 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -62.7 | -39.4 | 174.5 | -72.6 | -62.1 | -169 | -171.6 | 4 | 112.5 | Q151 E158 M159 | Q151-R155 WeakPolarHBondContact O-CB 3.49Å; Q151-R155 WeakPolarHBondContact O-CG 3.49Å; Q151-R155 PolarHBondContact O-N 3.41Å; R155-E158 WeakPolarHBondContact CD-OE2 3.36Å; R155-E158 IonicContact CZ-OE2 3.74Å; R155-E158 IonicContact NE-OE2 3.99Å; R155-E158 IonicContact NH1-OE1 3.87Å; R155-E158 IonicContact NH1-OE2 2.77Å; R155-E158 PolarHBondContact NH1-OE2 3.03Å; R155-E158 PolarHBondContact O-N 2.81Å; R155-M159 WeakPolarHBondContact O-CG 3.35Å; R155-M159 PolarHBondContact O-N 2.87Å |
| 156 | R | 64.9 | Low | 58.5 | Low | 143 Ų | 143 | 114.3 Ų | 114.3 | 54% | 0.54 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -63.2 | -44.8 | 173.1 | -172.8 | -178.6 | -61.4 | 175.1 | 1.7 | 110.5 | L152 T153 L154 E158 M159 T160 | L152-R156 WeakPolarHBondContact O-CB 3.4Å; L152-R156 PolarHBondContact O-N 3.08Å; T153-R156 PolarHBondContact O-N 3.04Å; L154-R156 VanDerWaalsContact C-N 3.34Å; L154-R156 PolarHBondContact O-N 3.32Å; R156-E158 VanDerWaalsContact C-N 3.31Å; R156-E158 PolarHBondContact O-N 3.46Å; R156-M159 CarbonylContact O-C 3.58Å; R156-M159 PolarHBondContact O-N 3.05Å; R156-T160 HydrophobicContact CG-CG2 4.01Å; R156-T160 WeakPolarHBondContact O-CB 3.2Å; R156-T160 VanDerWaalsContact O-CG2 3.27Å; R156-T160 WeakPolarHBondContact O-CG2 3.34Å; R156-T160 PolarHBondContact O-N 2.86Å; R156-T160 PolarHBondContact O-OG1 3.32Å |
| 157 | K | 61.8 | Low | 57.2 | Low | 108 Ų | 108 | 118.5 Ų | 118.5 | 47% | 0.47 | 58% | 0.583 | S | S | . | * | H | α-helix | trans | -60.8 | -39.1 | 174.1 | -78.2 | -178.9 | 177.3 | -174.5 | 0 | 112.3 | T153 L154 M159 T160 N161 | T153-K157 WeakPolarHBondContact O-CB 3.36Å; T153-K157 WeakPolarHBondContact O-CG 3.38Å; T153-K157 PolarHBondContact O-N 3.2Å; L154-K157 CarbonylContact O-C 3.51Å; L154-K157 WeakPolarHBondContact O-CB 3.05Å; L154-K157 PolarHBondContact O-N 2.82Å; K157-M159 VanDerWaalsContact C-N 3.35Å; K157-T160 VanDerWaalsContact CA-OG1 3.31Å; K157-T160 WeakPolarHBondContact CA-OG1 3.47Å; K157-T160 CarbonylContact O-C 3.59Å; K157-T160 PolarHBondContact O-N 3.26Å; K157-T160 PolarHBondContact O-OG1 2.96Å; K157-N161 VanDerWaalsContact O-CB 3.31Å; K157-N161 WeakPolarHBondContact O-CB 3.49Å; K157-N161 PolarHBondContact O-N 3.25Å; K157-N161 PolarHBondContact O-OD1 2.79Å |
| 158 | E | 68.1 | Low | 55.9 | Low | 114 Ų | 114 | 115.9 Ų | 115.9 | 53% | 0.533 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -65.2 | -38.1 | 175.6 | -160.9 | 173.7 | -160.6 | 0 | 0 | 111.6 | L154 R155 R156 | L154-E158 WeakPolarHBondContact O-CB 3.31Å; L154-E158 PolarHBondContact O-N 2.84Å; R155-E158 WeakPolarHBondContact CD-OE2 3.36Å; R155-E158 IonicContact CZ-OE2 3.74Å; R155-E158 IonicContact NE-OE2 3.99Å; R155-E158 IonicContact NH1-OE1 3.87Å; R155-E158 IonicContact NH1-OE2 2.77Å; R155-E158 PolarHBondContact NH1-OE2 3.03Å; R155-E158 PolarHBondContact O-N 2.81Å; R156-E158 VanDerWaalsContact C-N 3.31Å; R156-E158 PolarHBondContact O-N 3.46Å |
| 159 | M | 59.1 | Low | 54.8 | Low | 147 Ų | 147 | 119.4 Ų | 119.4 | 72% | 0.724 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -73.4 | -39.4 | 171.9 | -71.6 | -169.8 | -175.5 | 0 | 0 | 113.2 | R155 R156 K157 R162 | R155-M159 WeakPolarHBondContact O-CG 3.35Å; R155-M159 PolarHBondContact O-N 2.87Å; R156-M159 CarbonylContact O-C 3.58Å; R156-M159 PolarHBondContact O-N 3.05Å; K157-M159 VanDerWaalsContact C-N 3.35Å; M159-R162 WeakPolarHBondContact O-CB 3.21Å; M159-R162 PolarHBondContact O-N 3.33Å |
| 160 | T | 53.3 | Low | 53.5 | Low | 62 Ų | 62 | 123 Ų | 123 | 38% | 0.38 | 62% | 0.621 | S | S | . | * | H | α-helix | trans | -82.8 | -10.9 | -179.9 | 61.8 | 0 | 0 | 0 | 0 | 112.6 | R156 K157 R162 V163 | R156-T160 HydrophobicContact CG-CG2 4.01Å; R156-T160 WeakPolarHBondContact O-CB 3.2Å; R156-T160 VanDerWaalsContact O-CG2 3.27Å; R156-T160 WeakPolarHBondContact O-CG2 3.34Å; R156-T160 PolarHBondContact O-N 2.86Å; R156-T160 PolarHBondContact O-OG1 3.32Å; K157-T160 VanDerWaalsContact CA-OG1 3.31Å; K157-T160 WeakPolarHBondContact CA-OG1 3.47Å; K157-T160 CarbonylContact O-C 3.59Å; K157-T160 PolarHBondContact O-N 3.26Å; K157-T160 PolarHBondContact O-OG1 2.96Å; T160-R162 PolarHBondContact O-N 3.48Å; T160-R162 VanDerWaalsContact O-N 3.1Å; T160-V163 CarbonylContact O-C 3.54Å; T160-V163 WeakPolarHBondContact O-CA 3.37Å; T160-V163 PolarHBondContact O-N 2.7Å |
| 161 | N | 52.2 | Low | 51.9 | Low | 141 Ų | 141 | 130 Ų | 130 | 75% | 0.754 | 64% | 0.637 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -64.5 | -7 | 161.9 | -78.5 | -7.7 | 0 | 0 | 0 | 111.4 | K157 | K157-N161 VanDerWaalsContact O-CB 3.31Å; K157-N161 WeakPolarHBondContact O-CB 3.49Å; K157-N161 PolarHBondContact O-N 3.25Å; K157-N161 PolarHBondContact O-OD1 2.79Å |
| 162 | R | 50.4 | Low | 50 | Low | 227 Ų | 227 | 134.6 Ų | 134.6 | 86% | 0.857 | 66% | 0.661 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92.9 | -9.5 | 163.9 | -60.6 | -174.3 | 170.1 | -176.5 | -3.5 | 114.5 | M159 T160 | M159-R162 WeakPolarHBondContact O-CB 3.21Å; M159-R162 PolarHBondContact O-N 3.33Å; T160-R162 PolarHBondContact O-N 3.48Å; T160-R162 VanDerWaalsContact O-N 3.1Å |
| 163 | V | 39.7 | Very low | 48.4 | Very low | 114 Ų | 114 | 134.1 Ų | 134.1 | 69% | 0.691 | 67% | 0.67 | S | S | * | * | S | Bend | trans | -144.8 | 90.2 | 175.6 | -173.6 | 0 | 0 | 0 | 0 | 108.3 | T160 | T160-V163 CarbonylContact O-C 3.54Å; T160-V163 WeakPolarHBondContact O-CA 3.37Å; T160-V163 PolarHBondContact O-N 2.7Å |
| 164 | G | 40.4 | Very low | 46.7 | Very low | 61 Ų | 61 | 135.9 Ų | 135.9 | 63% | 0.629 | 68% | 0.681 | S | S | * | * | trans | -56.4 | 151.6 | -171.9 | 0 | 0 | 0 | 0 | 0 | 115 | ||||
| 165 | E | 40.3 | Very low | 44.9 | Very low | 186 Ų | 186 | 136 Ų | 136 | 87% | 0.869 | 69% | 0.686 | S | S | * | * | trans | 41.4 | 104.3 | 152 | -61.6 | -172.7 | 159.9 | 0 | 0 | 117.1 | ||||
| 166 | I | 38 | Very low | 43.6 | Very low | 155 Ų | 155 | 134 Ų | 134 | 80% | 0.795 | 70% | 0.695 | S | S | * | * | trans | 175.9 | 130.5 | 137.4 | -86.5 | 147.7 | 0 | 0 | 0 | 107.2 | ||||
| 167 | F | 36.2 | Very low | 42.4 | Very low | 179 Ų | 179 | 133.3 Ų | 133.3 | 79% | 0.785 | 70% | 0.701 | S | S | * | * | trans | 83.3 | 76 | 179 | -69.3 | -80 | 0 | 0 | 0 | 119.9 | ||||
| 168 | V | 39.4 | Very low | 41.2 | Very low | 110 Ų | 110 | 132 Ų | 132 | 67% | 0.667 | 70% | 0.699 | S | S | * | * | trans | -121.3 | -11.9 | 159.3 | 178.4 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 169 | V | 35.7 | Very low | 39.7 | Very low | 138 Ų | 138 | 129.3 Ų | 129.3 | 84% | 0.836 | 69% | 0.691 | S | S | * | * | S | Bend | trans | -85.9 | -22.8 | -173.5 | -174.4 | 0 | 0 | 0 | 0 | 114.6 | R171 | V169-R171 PolarHBondContact O-N 3.42Š|
| 170 | Q | 32.6 | Very low | 38.7 | Very low | 157 Ų | 157 | 129.1 Ų | 129.1 | 73% | 0.734 | 69% | 0.687 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79.4 | -16.8 | -173.9 | -152.8 | 88.2 | -5.3 | 0 | 0 | 114.9 | ||
| 171 | R | 31.2 | Very low | 37.7 | Very low | 192 Ų | 192 | 134.7 Ų | 134.7 | 73% | 0.725 | 71% | 0.706 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -94.6 | -7.7 | -166.2 | -140.7 | 176.2 | -176.6 | 144.8 | 1.4 | 115.7 | V169 | V169-R171 PolarHBondContact O-N 3.42Š|
| 172 | M | 30.4 | Very low | 36.6 | Very low | 176 Ų | 176 | 137.7 Ų | 137.7 | 87% | 0.867 | 71% | 0.707 | S | S | * | * | S | Bend | trans | -85.5 | -14.3 | 178.3 | -76.3 | -165.9 | 165.2 | 0 | 0 | 114.2 | ||
| 173 | A | 34.1 | Very low | 35.8 | Very low | 83 Ų | 83 | 132.9 Ų | 132.9 | 69% | 0.686 | 70% | 0.697 | S | S | * | * | S | Bend | trans | -85.9 | -21.8 | -177.9 | 0 | 0 | 0 | 0 | 0 | 114.4 | ||
| 174 | T | 33 | Very low | 35.6 | Very low | 108 Ų | 108 | 131.4 Ų | 131.4 | 66% | 0.663 | 68% | 0.684 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92.7 | -1.6 | -176 | 50.3 | 0 | 0 | 0 | 0 | 114.7 | ||
| 175 | V | 35.2 | Very low | 35.2 | Very low | 103 Ų | 103 | 134.3 Ų | 134.3 | 62% | 0.624 | 69% | 0.69 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -83.4 | -11.4 | 179.2 | -179.5 | 0 | 0 | 0 | 0 | 112.9 | ||
| 176 | S | 40.2 | Very low | 34.7 | Very low | 111 Ų | 111 | 131.6 Ų | 131.6 | 78% | 0.776 | 69% | 0.686 | S | S | * | * | S | Bend | trans | -92.6 | -9.7 | -175.3 | -155.2 | 0 | 0 | 0 | 0 | 115.1 | ||
| 177 | I | 39.3 | Very low | 34.4 | Very low | 127 Ų | 127 | 129 Ų | 129 | 65% | 0.651 | 68% | 0.677 | S | S | * | * | S | Bend | trans | -134.5 | 54.6 | -177.4 | -41.5 | 177 | 0 | 0 | 0 | 111.8 | ||
| 178 | D | 36.1 | Very low | 34.4 | Very low | 81 Ų | 81 | 127.3 Ų | 127.3 | 43% | 0.433 | 68% | 0.681 | S | S | . | * | trans | 178.9 | 130.2 | 148.1 | -127.8 | -15.4 | 0 | 0 | 0 | 108.8 | R182 | D178-R182 IonicContact OD2-NE 3.79Š| ||
| 179 | P | 37.4 | Very low | 34.2 | Very low | 57 Ų | 57 | 123.9 Ų | 123.9 | 37% | 0.37 | 66% | 0.66 | S | S | . | * | S | Bend | -146.1 | 29.2 | 61.7 | 38.5 | -16.2 | 0 | 0 | 0 | 114.8 | F181 | P179-F181 PolarHBondContact O-N 3.45Š| |
| 180 | F | 37.7 | Very low | 34.6 | Very low | 143 Ų | 143 | 123.2 Ų | 123.2 | 63% | 0.627 | 65% | 0.652 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -66.7 | -21.6 | 171.9 | -83.3 | -82.8 | 0 | 0 | 0 | 112.3 | ||
| 181 | F | 32.2 | Very low | 35.3 | Very low | 179 Ų | 179 | 122.1 Ų | 122.1 | 79% | 0.785 | 65% | 0.651 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.3 | -31 | -175.9 | -113.5 | -92.2 | 0 | 0 | 0 | 113.8 | P179 | P179-F181 PolarHBondContact O-N 3.45Š|
| 182 | R | 30.2 | Very low | 36 | Very low | 204 Ų | 204 | 122.7 Ų | 122.7 | 77% | 0.77 | 65% | 0.653 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87.5 | -26.4 | -170.5 | -78.8 | -173.6 | 176.1 | -143.9 | -3.3 | 116.2 | D178 | D178-R182 IonicContact OD2-NE 3.79Š|
| 183 | I | 32.7 | Very low | 36.7 | Very low | 127 Ų | 127 | 117.8 Ų | 117.8 | 65% | 0.651 | 63% | 0.633 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.7 | -4.5 | -170.4 | -69.4 | 176.5 | 0 | 0 | 0 | 114.1 | ||
| 184 | L | 35.7 | Very low | 37.4 | Very low | 82 Ų | 82 | 116.8 Ų | 116.8 | 43% | 0.429 | 61% | 0.611 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -117.5 | 33.4 | -171.9 | -148.6 | 77.1 | 0 | 0 | 0 | 115.7 | F131 F198 | F131-L184 HydrophobicContact CE2-CD1 4.26Å; L184-F198 HydrophobicContact CD2-CB 4.36Å; L184-F198 HydrophobicContact CD2-CD2 3.27Å; L184-F198 HydrophobicContact CD2-CE2 3.8Å; L184-F198 HydrophobicContact CD2-CG 4.09Å |
| 185 | V | 31.8 | Very low | 38.2 | Very low | 123 Ų | 123 | 116 Ų | 116 | 75% | 0.745 | 60% | 0.602 | S | S | * | * | S | Bend | trans | -96.3 | -13.8 | 172.4 | 177.2 | 0 | 0 | 0 | 0 | 113.1 | ||
| 186 | V | 29.5 | Very low | 38.8 | Very low | 128 Ų | 128 | 113.7 Ų | 113.7 | 78% | 0.776 | 59% | 0.589 | S | S | * | * | trans | -116.5 | 103.5 | -173 | -170.9 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 187 | V | 32.7 | Very low | 39.3 | Very low | 102 Ų | 102 | 111.7 Ų | 111.7 | 62% | 0.618 | 57% | 0.569 | S | S | * | * | S | Bend | trans | -175.2 | 160.4 | 137.4 | 166.2 | 0 | 0 | 0 | 0 | 105 | R194 | V187-R194 VanDerWaalsContact CB-NH2 3.25Å; V187-R194 VanDerWaalsContact CG1-NH2 3.31Å; V187-R194 PolarHBondContact O-NE 2.73Å; V187-R194 PolarHBondContact O-NH1 3.44Å; V187-R194 PolarHBondContact O-NH2 2.98Å |
| 188 | V | 35.2 | Very low | 40 | Very low | 143 Ų | 143 | 108.4 Ų | 108.4 | 87% | 0.867 | 55% | 0.55 | S | S | * | * | trans | -94.7 | 106 | -176.2 | 177.8 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 189 | V | 35.1 | Very low | 40.8 | Very low | 38 Ų | 38 | 104.6 Ų | 104.6 | 23% | 0.23 | 53% | 0.53 | C | S | . | . | S | Bend | trans | -153.6 | 130.8 | 162.6 | -177.9 | 0 | 0 | 0 | 0 | 106.4 | R127 D191 R194 | R127-V189 VanDerWaalsContact NH1-CG2 3.3Å; V189-D191 PolarHBondContact O-N 3.36Å; V189-R194 HydrophobicContact CB-CG 4.29Å; V189-R194 WeakPolarHBondContact O-CD 3.37Å; V189-R194 WeakPolarHBondContact O-CG 3.41Å; V189-R194 PolarHBondContact O-NE 3.24Å |
| 190 | D | 43.8 | Very low | 41.6 | Very low | 124 Ų | 124 | 106.7 Ų | 106.7 | 66% | 0.663 | 53% | 0.533 | S | S | * | . | trans | -14.7 | 111.7 | 172.4 | -131.7 | -55 | 0 | 0 | 0 | 114.2 | R192 V193 R194 | D190-R192 PolarHBondContact O-N 3.16Å; D190-V193 HydrophobicContact CB-CG2 4.32Å; D190-V193 PolarHBondContact O-N 3.24Å; D190-R194 PolarHBondContact O-N 3.47Å | ||
| 191 | D | 47.1 | Very low | 42.3 | Very low | 133 Ų | 133 | 101.9 Ų | 101.9 | 71% | 0.711 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -53.6 | -32.5 | -168.3 | -71.8 | -32.5 | 0 | 0 | 0 | 112.9 | V189 R194 L195 | V189-D191 PolarHBondContact O-N 3.36Å; D191-R194 PolarHBondContact O-N 3.04Å; D191-L195 WeakPolarHBondContact O-CB 3.45Å; D191-L195 PolarHBondContact O-N 3.38Å |
| 192 | R | 46 | Very low | 43.3 | Very low | 205 Ų | 205 | 95.4 Ų | 95.4 | 77% | 0.774 | 48% | 0.484 | S | S | * | . | H | α-helix | trans | -65.8 | -45.4 | 178.2 | -63.6 | -171.1 | -178.1 | -168.8 | 2.1 | 112.2 | D190 R194 L195 T196 | D190-R192 PolarHBondContact O-N 3.16Å; R192-R194 VanDerWaalsContact C-N 3.34Å; R192-L195 PolarHBondContact O-N 2.89Å; R192-T196 PolarHBondContact O-N 3.41Å; R192-T196 PolarHBondContact O-OG1 3.07Å |
| 193 | V | 46.8 | Very low | 44.7 | Very low | 72 Ų | 72 | 86.7 Ų | 86.7 | 44% | 0.436 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -66.6 | -40.4 | 179.6 | -179.9 | 0 | 0 | 0 | 0 | 109.9 | D190 T196 L197 | D190-V193 HydrophobicContact CB-CG2 4.32Å; D190-V193 PolarHBondContact O-N 3.24Å; V193-T196 PolarHBondContact O-N 3.27Å; V193-L197 HydrophobicContact CG1-CD1 3.85Å; V193-L197 HydrophobicContact CG1-CG 4.09Å; V193-L197 VanDerWaalsContact O-CB 3.3Å; V193-L197 WeakPolarHBondContact O-CB 3.3Å; V193-L197 WeakPolarHBondContact O-CG 3.43Å; V193-L197 PolarHBondContact O-N 3.12Å |
| 194 | R | 47.6 | Very low | 45.6 | Very low | 62 Ų | 62 | 83.2 Ų | 83.2 | 23% | 0.234 | 44% | 0.439 | C | S | . | . | H | α-helix | trans | -61.1 | -48.4 | 174.6 | -76.6 | 177.5 | -178.4 | -107.5 | -27.2 | 112.5 | V187 V189 D190 D191 R192 T196 L197 F198 | V187-R194 VanDerWaalsContact CB-NH2 3.25Å; V187-R194 VanDerWaalsContact CG1-NH2 3.31Å; V187-R194 PolarHBondContact O-NE 2.73Å; V187-R194 PolarHBondContact O-NH1 3.44Å; V187-R194 PolarHBondContact O-NH2 2.98Å; V189-R194 HydrophobicContact CB-CG 4.29Å; V189-R194 WeakPolarHBondContact O-CD 3.37Å; V189-R194 WeakPolarHBondContact O-CG 3.41Å; V189-R194 PolarHBondContact O-NE 3.24Å; D190-R194 PolarHBondContact O-N 3.47Å; D191-R194 PolarHBondContact O-N 3.04Å; R192-R194 VanDerWaalsContact C-N 3.34Å; R194-T196 VanDerWaalsContact C-N 3.33Å; R194-T196 PolarHBondContact O-N 3.2Å; R194-L197 PolarHBondContact O-N 3.48Å; R194-F198 WeakPolarHBondContact O-CB 3.5Å; R194-F198 PolarHBondContact O-N 3.01Å |
| 195 | L | 50.4 | Low | 46.3 | Very low | 91 Ų | 91 | 81.5 Ų | 81.5 | 48% | 0.476 | 43% | 0.432 | S | S | . | . | H | α-helix | trans | -60 | -48.7 | 179.9 | -170.1 | 70.2 | 0 | 0 | 0 | 109.3 | D191 R192 L197 F198 L199 | D191-L195 WeakPolarHBondContact O-CB 3.45Å; D191-L195 PolarHBondContact O-N 3.38Å; R192-L195 PolarHBondContact O-N 2.89Å; L195-L197 PolarHBondContact O-N 3.19Å; L195-F198 PolarHBondContact O-N 3.4Å; L195-L199 HydrophobicContact CD1-CD1 4.44Å; L195-L199 HydrophobicContact CD2-CD1 4.47Å; L195-L199 HydrophobicContact CG-CD1 3.83Å; L195-L199 HydrophobicContact CG-CG 4.39Å; L195-L199 VanDerWaalsContact O-CB 3.26Å; L195-L199 WeakPolarHBondContact O-CB 3.48Å; L195-L199 WeakPolarHBondContact O-CD1 3.39Å; L195-L199 WeakPolarHBondContact O-CG 3.5Å; L195-L199 PolarHBondContact O-N 2.85Å |
| 196 | T | 48 | Very low | 47.4 | Very low | 55 Ų | 55 | 76.4 Ų | 76.4 | 34% | 0.337 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -59.7 | -44.5 | 176.4 | -53.8 | 0 | 0 | 0 | 0 | 112.4 | R192 V193 R194 L199 F200 | R192-T196 PolarHBondContact O-N 3.41Å; R192-T196 PolarHBondContact O-OG1 3.07Å; V193-T196 PolarHBondContact O-N 3.27Å; R194-T196 VanDerWaalsContact C-N 3.33Å; R194-T196 PolarHBondContact O-N 3.2Å; T196-L199 PolarHBondContact O-N 3.32Å; T196-F200 VanDerWaalsContact O-CB 3.28Å; T196-F200 WeakPolarHBondContact O-CB 3.45Å; T196-F200 PolarHBondContact O-N 2.84Å |
| 197 | L | 49.1 | Very low | 48.6 | Very low | 69 Ų | 69 | 71.1 Ų | 71.1 | 36% | 0.361 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -69.2 | -36.9 | 179.3 | -70.2 | -177.6 | 0 | 0 | 0 | 113 | F124 V193 R194 L195 F200 F201 | F124-L197 HydrophobicContact CD2-CD1 3.65Å; F124-L197 HydrophobicContact CD2-CD2 3.5Å; F124-L197 VanDerWaalsContact CD2-CD2 3.5Å; F124-L197 HydrophobicContact CD2-CG 4.17Å; F124-L197 HydrophobicContact CE2-CB 4.4Å; F124-L197 HydrophobicContact CE2-CD1 3.74Å; F124-L197 HydrophobicContact CE2-CD2 3.16Å; F124-L197 HydrophobicContact CE2-CG 3.91Å; F124-L197 HydrophobicContact CZ-CD2 3.93Å; V193-L197 HydrophobicContact CG1-CD1 3.85Å; V193-L197 HydrophobicContact CG1-CG 4.09Å; V193-L197 VanDerWaalsContact O-CB 3.3Å; V193-L197 WeakPolarHBondContact O-CB 3.3Å; V193-L197 WeakPolarHBondContact O-CG 3.43Å; V193-L197 PolarHBondContact O-N 3.12Å; R194-L197 PolarHBondContact O-N 3.48Å; L195-L197 PolarHBondContact O-N 3.19Å; L197-F200 PolarHBondContact O-N 3.03Å; L197-F201 WeakPolarHBondContact O-CB 3.42Å; L197-F201 PolarHBondContact O-N 2.91Å |
| 198 | F | 54 | Low | 49.4 | Very low | 58 Ų | 58 | 69.4 Ų | 69.4 | 25% | 0.254 | 36% | 0.36 | S | S | . | . | H | α-helix | trans | -66.1 | -44.8 | 174.5 | 176.7 | -102.2 | 0 | 0 | 0 | 110.7 | L184 R194 L195 F200 F201 Q202 | L184-F198 HydrophobicContact CD2-CB 4.36Å; L184-F198 HydrophobicContact CD2-CD2 3.27Å; L184-F198 HydrophobicContact CD2-CE2 3.8Å; L184-F198 HydrophobicContact CD2-CG 4.09Å; R194-F198 WeakPolarHBondContact O-CB 3.5Å; R194-F198 PolarHBondContact O-N 3.01Å; L195-F198 PolarHBondContact O-N 3.4Å; F198-F200 VanDerWaalsContact C-N 3.33Å; F198-F201 PolarHBondContact O-N 2.89Å; F198-Q202 HydrophobicContact CD1-CG 4.34Å; F198-Q202 VanDerWaalsContact CE1-CD 3.49Å; F198-Q202 HydrophobicContact CE1-CG 3.95Å; F198-Q202 HydrophobicContact CE2-CG 4.48Å; F198-Q202 HydrophobicContact CZ-CG 4.04Å; F198-Q202 WeakPolarHBondContact O-CG 3.3Å; F198-Q202 PolarHBondContact O-N 3.03Å |
| 199 | L | 54.6 | Low | 50 | Low | 2 Ų | 2 | 66.4 Ų | 66.4 | 1% | 0.01 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -63.8 | -40.4 | 174.7 | -68.4 | 166.6 | 0 | 0 | 0 | 111.3 | L195 T196 Q202 L203 V267 R270 I271 | L195-L199 HydrophobicContact CD1-CD1 4.44Å; L195-L199 HydrophobicContact CD2-CD1 4.47Å; L195-L199 HydrophobicContact CG-CD1 3.83Å; L195-L199 HydrophobicContact CG-CG 4.39Å; L195-L199 VanDerWaalsContact O-CB 3.26Å; L195-L199 WeakPolarHBondContact O-CB 3.48Å; L195-L199 WeakPolarHBondContact O-CD1 3.39Å; L195-L199 WeakPolarHBondContact O-CG 3.5Å; L195-L199 PolarHBondContact O-N 2.85Å; T196-L199 PolarHBondContact O-N 3.32Å; L199-Q202 PolarHBondContact O-N 3.49Å; L199-L203 WeakPolarHBondContact O-CB 3.46Å; L199-L203 PolarHBondContact O-N 3.17Å; L199-V267 HydrophobicContact CB-CG1 4.12Å; L199-V267 HydrophobicContact CD2-CB 4.28Å; L199-V267 HydrophobicContact CD2-CG1 4.1Å; L199-V267 HydrophobicContact CD2-CG2 4.04Å; L199-V267 VanDerWaalsContact O-CG1 3.31Å; L199-V267 WeakPolarHBondContact O-CG1 3.21Å; L199-R270 HydrophobicContact CD1-CB 3.3Å; L199-R270 HydrophobicContact CD1-CG 4.36Å; L199-R270 HydrophobicContact CD2-CB 4.16Å; L199-R270 HydrophobicContact CG-CB 4.37Å; L199-I271 HydrophobicContact CB-CD1 4.08Å; L199-I271 HydrophobicContact CB-CG1 3.59Å; L199-I271 HydrophobicContact CD1-CG1 4.38Å |
| 200 | F | 52.7 | Low | 50.5 | Low | 100 Ų | 100 | 65.3 Ų | 65.3 | 44% | 0.439 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -65.3 | -39.1 | 174.8 | -161.5 | -92.5 | 0 | 0 | 0 | 111.4 | T196 L197 F198 L203 C204 | T196-F200 VanDerWaalsContact O-CB 3.28Å; T196-F200 WeakPolarHBondContact O-CB 3.45Å; T196-F200 PolarHBondContact O-N 2.84Å; L197-F200 PolarHBondContact O-N 3.03Å; F198-F200 VanDerWaalsContact C-N 3.33Å; F200-L203 CarbonylContact O-C 2.96Å; F200-L203 PolarHBondContact O-N 3.39Å; F200-C204 WeakPolarHBondContact CE1-SG 3.26Å; F200-C204 WeakPolarHBondContact O-CB 3.45Å; F200-C204 PolarHBondContact O-N 3.25Å; F200-C204 PolarHBondContact O-SG 3.08Å |
| 201 | F | 52.3 | Low | 50.5 | Low | 43 Ų | 43 | 64 Ų | 64 | 19% | 0.189 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -64.7 | -45.5 | 172.8 | 179.3 | -97.9 | 0 | 0 | 0 | 111.7 | F128 F131 L197 F198 L203 C204 V205 | F128-F201 HydrophobicContact CE2-CD2 4.26Å; F131-F201 HydrophobicContact CD1-CE2 4.39Å; F131-F201 HydrophobicContact CE1-CD1 4.38Å; F131-F201 AromaticContact CE1-CD2 3.94Å; F131-F201 HydrophobicContact CE1-CD2 3.94Å; F131-F201 HydrophobicContact CE1-CE1 4.22Å; F131-F201 AromaticContact CE1-CE2 3.76Å; F131-F201 HydrophobicContact CE1-CE2 3.76Å; F131-F201 HydrophobicContact CE1-CG 4.25Å; F131-F201 AromaticContact CE1-CZ 3.91Å; F131-F201 HydrophobicContact CE1-CZ 3.91Å; L197-F201 WeakPolarHBondContact O-CB 3.42Å; L197-F201 PolarHBondContact O-N 2.91Å; F198-F201 PolarHBondContact O-N 2.89Å; F201-L203 VanDerWaalsContact C-N 3.28Å; F201-L203 PolarHBondContact O-N 3.3Å; F201-C204 PolarHBondContact O-N 2.71Å; F201-V205 HydrophobicContact CD1-CG2 4.13Å; F201-V205 HydrophobicContact CE1-CG2 3.66Å; F201-V205 HydrophobicContact CE2-CG2 4.11Å; F201-V205 HydrophobicContact CZ-CG2 3.66Å; F201-V205 WeakPolarHBondContact O-CG2 3.44Å; F201-V205 PolarHBondContact O-N 3.41Å |
| 202 | Q | 54 | Low | 49.9 | Very low | 42 Ų | 42 | 60.3 Ų | 60.3 | 20% | 0.196 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -58.2 | -43 | 173.4 | -74.9 | -160.3 | -47.3 | 0 | 0 | 110.8 | F198 L199 V205 Y206 H263 V267 | F198-Q202 HydrophobicContact CD1-CG 4.34Å; F198-Q202 VanDerWaalsContact CE1-CD 3.49Å; F198-Q202 HydrophobicContact CE1-CG 3.95Å; F198-Q202 HydrophobicContact CE2-CG 4.48Å; F198-Q202 HydrophobicContact CZ-CG 4.04Å; F198-Q202 WeakPolarHBondContact O-CG 3.3Å; F198-Q202 PolarHBondContact O-N 3.03Å; L199-Q202 PolarHBondContact O-N 3.49Å; Q202-V205 PolarHBondContact O-N 3.03Å; Q202-Y206 WeakPolarHBondContact O-CB 3.45Å; Q202-Y206 PolarHBondContact O-N 3.34Å; Q202-H263 PolarHBondContact OE1-CE1 2.9Å; Q202-V267 HydrophobicContact CB-CG2 4.41Å |
| 203 | L | 58.8 | Low | 49.8 | Very low | 22 Ų | 22 | 56.3 Ų | 56.3 | 12% | 0.115 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -63.2 | -44.9 | 174.5 | -175.8 | 67.4 | 0 | 0 | 0 | 111.5 | L199 F200 F201 Y206 V207 L264 V267 L268 I271 L366 | L199-L203 WeakPolarHBondContact O-CB 3.46Å; L199-L203 PolarHBondContact O-N 3.17Å; F200-L203 CarbonylContact O-C 2.96Å; F200-L203 PolarHBondContact O-N 3.39Å; F201-L203 VanDerWaalsContact C-N 3.28Å; F201-L203 PolarHBondContact O-N 3.3Å; L203-Y206 PolarHBondContact O-N 3.14Å; L203-V207 HydrophobicContact CD1-CG2 3.96Å; L203-V207 HydrophobicContact CG-CG2 4.08Å; L203-V207 VanDerWaalsContact O-CB 3.26Å; L203-V207 WeakPolarHBondContact O-CB 2.95Å; L203-V207 WeakPolarHBondContact O-CG2 3.35Å; L203-V207 PolarHBondContact O-N 3.38Å; L203-L264 HydrophobicContact CD1-CD1 3.48Å; L203-L264 VanDerWaalsContact CD1-CD1 3.48Å; L203-V267 HydrophobicContact CB-CG1 4.15Å; L203-L268 HydrophobicContact CD1-CD2 3.74Å; L203-L268 HydrophobicContact CD1-CG 4.39Å; L203-L268 HydrophobicContact CD2-CD2 4.02Å; L203-I271 HydrophobicContact CB-CD1 3.97Å; L203-I271 HydrophobicContact CD2-CD1 3.71Å; L203-I271 HydrophobicContact CG-CD1 4.39Å; L203-L366 HydrophobicContact CD1-CD2 4.39Å |
| 204 | C | 51.4 | Low | 49.5 | Very low | 53 Ų | 53 | 56 Ų | 56 | 36% | 0.358 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -62.1 | -44.5 | 177.3 | -74.8 | 0 | 0 | 0 | 0 | 111.9 | F200 F201 Y206 S208 | F200-C204 WeakPolarHBondContact CE1-SG 3.26Å; F200-C204 WeakPolarHBondContact O-CB 3.45Å; F200-C204 PolarHBondContact O-N 3.25Å; F200-C204 PolarHBondContact O-SG 3.08Å; F201-C204 PolarHBondContact O-N 2.71Å; C204-Y206 VanDerWaalsContact C-N 3.33Å; C204-S208 WeakPolarHBondContact O-CB 3.29Å; C204-S208 PolarHBondContact O-N 2.79Å; C204-S208 PolarHBondContact O-OG 3.07Å; C204-S208 VanDerWaalsContact O-OG 3.05Å |
| 205 | V | 51.8 | Low | 48.9 | Very low | 47 Ų | 47 | 59.8 Ų | 59.8 | 29% | 0.285 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -60.1 | -49.2 | 174.9 | 171.4 | 0 | 0 | 0 | 0 | 109.1 | F201 Q202 V207 S208 E209 | F201-V205 HydrophobicContact CD1-CG2 4.13Å; F201-V205 HydrophobicContact CE1-CG2 3.66Å; F201-V205 HydrophobicContact CE2-CG2 4.11Å; F201-V205 HydrophobicContact CZ-CG2 3.66Å; F201-V205 WeakPolarHBondContact O-CG2 3.44Å; F201-V205 PolarHBondContact O-N 3.41Å; Q202-V205 PolarHBondContact O-N 3.03Å; V205-V207 PolarHBondContact O-N 3.2Å; V205-S208 WeakPolarHBondContact CA-OG 3.49Å; V205-S208 PolarHBondContact O-N 3.27Å; V205-S208 PolarHBondContact O-OG 2.81Å; V205-E209 HydrophobicContact CG1-CG 4.41Å; V205-E209 WeakPolarHBondContact O-CB 3.26Å; V205-E209 WeakPolarHBondContact O-CG 3.29Å; V205-E209 PolarHBondContact O-N 2.81Å |
| 206 | Y | 55 | Low | 48.3 | Very low | 15 Ų | 15 | 61.3 Ų | 61.3 | 6% | 0.059 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -60.3 | -48.4 | 179.9 | -153.6 | -79.4 | 0 | 0 | 0 | 112.4 | Q202 L203 C204 E209 T210 I235 V236 H260 T261 L264 | Q202-Y206 WeakPolarHBondContact O-CB 3.45Å; Q202-Y206 PolarHBondContact O-N 3.34Å; L203-Y206 PolarHBondContact O-N 3.14Å; C204-Y206 VanDerWaalsContact C-N 3.33Å; Y206-E209 PolarHBondContact O-N 3.05Å; Y206-T210 HydrophobicContact CD1-CG2 3.87Å; Y206-T210 HydrophobicContact CE1-CG2 3.89Å; Y206-T210 WeakPolarHBondContact O-CB 3.45Å; Y206-T210 VanDerWaalsContact O-CG2 3.27Å; Y206-T210 WeakPolarHBondContact O-CG2 3.14Å; Y206-T210 PolarHBondContact O-N 3.16Å; Y206-T210 PolarHBondContact O-OG1 3.27Å; Y206-T210 VanDerWaalsContact O-OG1 3.06Å; Y206-I235 HydrophobicContact CE1-CD1 3.76Å; Y206-I235 HydrophobicContact CE1-CG1 3.62Å; Y206-I235 WeakPolarHBondContact OH-CD1 3.12Å; Y206-I235 WeakPolarHBondContact OH-CG1 3.47Å; Y206-V236 HydrophobicContact CE2-CG2 4.3Å; Y206-H260 HydrophobicContact CE2-CB 4.28Å; Y206-H260 VanDerWaalsContact OH-CB 3.27Å; Y206-H260 WeakPolarHBondContact OH-CB 3.44Å; Y206-H260 PolarHBondContact OH-O 3.29Å; Y206-T261 PolarHBondContact OH-N 3Å; Y206-L264 HydrophobicContact CD1-CB 4.37Å; Y206-L264 HydrophobicContact CD1-CD1 3.89Å; Y206-L264 HydrophobicContact CD1-CD2 4.09Å; Y206-L264 HydrophobicContact CD1-CG 4.34Å; Y206-L264 HydrophobicContact CE1-CB 3.88Å; Y206-L264 HydrophobicContact CE1-CD1 4.19Å; Y206-L264 HydrophobicContact CE1-CD2 3.71Å; Y206-L264 HydrophobicContact CE1-CG 4.14Å; Y206-L264 HydrophobicContact CE2-CB 4.26Å; Y206-L264 HydrophobicContact CG-CD1 4.24Å |
| 207 | V | 54.1 | Low | 47.9 | Very low | 18 Ų | 18 | 61.8 Ų | 61.8 | 11% | 0.109 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -64.5 | -39.3 | 177.2 | 170.4 | 0 | 0 | 0 | 0 | 111.1 | L203 V205 T210 R211 L366 T370 | L203-V207 HydrophobicContact CD1-CG2 3.96Å; L203-V207 HydrophobicContact CG-CG2 4.08Å; L203-V207 VanDerWaalsContact O-CB 3.26Å; L203-V207 WeakPolarHBondContact O-CB 2.95Å; L203-V207 WeakPolarHBondContact O-CG2 3.35Å; L203-V207 PolarHBondContact O-N 3.38Å; V205-V207 PolarHBondContact O-N 3.2Å; V207-T210 VanDerWaalsContact CA-OG1 3.27Å; V207-T210 WeakPolarHBondContact CA-OG1 3.24Å; V207-T210 PolarHBondContact O-N 2.96Å; V207-T210 PolarHBondContact O-OG1 3.45Å; V207-R211 HydrophobicContact CG1-CG 4.06Å; V207-R211 WeakPolarHBondContact O-CB 3.44Å; V207-R211 VanDerWaalsContact O-CG 3.26Å; V207-R211 WeakPolarHBondContact O-CG 3.16Å; V207-R211 PolarHBondContact O-N 3.44Å; V207-L366 HydrophobicContact CG2-CD2 3.94Å; V207-T370 HydrophobicContact CG1-CG2 4.49Å |
| 208 | S | 49.1 | Very low | 47.4 | Very low | 65 Ų | 65 | 65 Ų | 65 | 46% | 0.455 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -67.6 | -41.1 | 177.2 | 70.3 | 0 | 0 | 0 | 0 | 111.7 | C204 V205 A212 | C204-S208 WeakPolarHBondContact O-CB 3.29Å; C204-S208 PolarHBondContact O-N 2.79Å; C204-S208 PolarHBondContact O-OG 3.07Å; C204-S208 VanDerWaalsContact O-OG 3.05Å; V205-S208 WeakPolarHBondContact CA-OG 3.49Å; V205-S208 PolarHBondContact O-N 3.27Å; V205-S208 PolarHBondContact O-OG 2.81Å; S208-A212 WeakPolarHBondContact O-CB 3.45Å; S208-A212 PolarHBondContact O-N 3.38Å |
| 209 | E | 47.4 | Very low | 46.5 | Very low | 80 Ų | 80 | 67.5 Ų | 67.5 | 37% | 0.374 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -70.6 | -33.6 | 176.6 | -73.6 | -177.1 | 178.9 | 0 | 0 | 112.2 | V205 Y206 R213 | V205-E209 HydrophobicContact CG1-CG 4.41Å; V205-E209 WeakPolarHBondContact O-CB 3.26Å; V205-E209 WeakPolarHBondContact O-CG 3.29Å; V205-E209 PolarHBondContact O-N 2.81Å; Y206-E209 PolarHBondContact O-N 3.05Å; E209-R213 WeakPolarHBondContact O-CG 3.47Å |
| 210 | T | 45.8 | Very low | 45.4 | Very low | 15 Ų | 15 | 76.9 Ų | 76.9 | 9% | 0.092 | 39% | 0.389 | C | S | . | . | H | α-helix | trans | -73.4 | -47.4 | 172.5 | 56.8 | 0 | 0 | 0 | 0 | 111.3 | Y206 V207 R213 V214 I235 | Y206-T210 HydrophobicContact CD1-CG2 3.87Å; Y206-T210 HydrophobicContact CE1-CG2 3.89Å; Y206-T210 WeakPolarHBondContact O-CB 3.45Å; Y206-T210 VanDerWaalsContact O-CG2 3.27Å; Y206-T210 WeakPolarHBondContact O-CG2 3.14Å; Y206-T210 PolarHBondContact O-N 3.16Å; Y206-T210 PolarHBondContact O-OG1 3.27Å; Y206-T210 VanDerWaalsContact O-OG1 3.06Å; V207-T210 VanDerWaalsContact CA-OG1 3.27Å; V207-T210 WeakPolarHBondContact CA-OG1 3.24Å; V207-T210 PolarHBondContact O-N 2.96Å; V207-T210 PolarHBondContact O-OG1 3.45Å; T210-R213 PolarHBondContact O-N 2.75Å; T210-V214 WeakPolarHBondContact O-CG2 3.3Å; T210-V214 PolarHBondContact O-N 2.86Å; T210-I235 HydrophobicContact CG2-CG1 4.2Å |
| 211 | R | 44.1 | Very low | 44.7 | Very low | 96 Ų | 96 | 77.4 Ų | 77.4 | 36% | 0.362 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -63.5 | -47.7 | -178.7 | -81.5 | -177.6 | 171.7 | -167.3 | -9.1 | 112.8 | V207 R213 V214 Q215 T370 | V207-R211 HydrophobicContact CG1-CG 4.06Å; V207-R211 WeakPolarHBondContact O-CB 3.44Å; V207-R211 VanDerWaalsContact O-CG 3.26Å; V207-R211 WeakPolarHBondContact O-CG 3.16Å; V207-R211 PolarHBondContact O-N 3.44Å; R211-R213 PolarHBondContact O-N 2.92Å; R211-V214 PolarHBondContact O-N 3.26Å; R211-Q215 PolarHBondContact O-N 3.07Å; R211-T370 PolarHBondContact NH2-OG1 3.14Å |
| 212 | A | 35.6 | Very low | 44.1 | Very low | 56 Ų | 56 | 81.2 Ų | 81.2 | 46% | 0.463 | 43% | 0.429 | S | S | . | . | H | α-helix | trans | -59.4 | -19.1 | 179.6 | 0 | 0 | 0 | 0 | 0 | 112.8 | S208 L216 | S208-A212 WeakPolarHBondContact O-CB 3.45Å; S208-A212 PolarHBondContact O-N 3.38Å; A212-L216 VanDerWaalsContact O-CD1 3.28Å; A212-L216 WeakPolarHBondContact O-CD1 3.43Å; A212-L216 WeakPolarHBondContact O-CG 3.3Å |
| 213 | R | 42.9 | Very low | 43.4 | Very low | 121 Ų | 121 | 83.4 Ų | 83.4 | 46% | 0.457 | 45% | 0.449 | S | S | . | . | H | α-helix | trans | -105.1 | -22.5 | -177.8 | -66.8 | -176.8 | 178.6 | 175.3 | 4 | 114.3 | E209 T210 R211 V236 | E209-R213 WeakPolarHBondContact O-CG 3.47Å; T210-R213 PolarHBondContact O-N 2.75Å; R211-R213 PolarHBondContact O-N 2.92Å; R213-V236 PolarHBondContact NH1-O 2.94Å |
| 214 | V | 40.9 | Very low | 42.4 | Very low | 66 Ų | 66 | 91.1 Ų | 91.1 | 40% | 0.4 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -67.8 | -42.8 | 169.5 | 172.1 | 0 | 0 | 0 | 0 | 110.2 | T210 R211 L216 L374 | T210-V214 WeakPolarHBondContact O-CG2 3.3Å; T210-V214 PolarHBondContact O-N 2.86Å; R211-V214 PolarHBondContact O-N 3.26Å; V214-L216 PolarHBondContact O-N 2.97Å; V214-L374 HydrophobicContact CG1-CD1 4.49Å; V214-L374 HydrophobicContact CG1-CD2 4.34Å |
| 215 | Q | 35.8 | Very low | 42.1 | Very low | 141 Ų | 141 | 91.8 Ų | 91.8 | 66% | 0.659 | 49% | 0.485 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -71.2 | -22.4 | -179.2 | -90.1 | 168.8 | -36.2 | 0 | 0 | 115.4 | R211 | R211-Q215 PolarHBondContact O-N 3.07Š|
| 216 | L | 37.4 | Very low | 42.3 | Very low | 123 Ų | 123 | 101.2 Ų | 101.2 | 64% | 0.644 | 52% | 0.516 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -78.9 | -19.7 | -178.9 | -76.5 | 171.1 | 0 | 0 | 0 | 113.4 | A212 V214 | A212-L216 VanDerWaalsContact O-CD1 3.28Å; A212-L216 WeakPolarHBondContact O-CD1 3.43Å; A212-L216 WeakPolarHBondContact O-CG 3.3Å; V214-L216 PolarHBondContact O-N 2.97Å |
| 217 | D | 39.9 | Very low | 42.4 | Very low | 65 Ų | 65 | 101.8 Ų | 101.8 | 35% | 0.348 | 52% | 0.521 | S | S | . | . | S | Bend | trans | -82.8 | -13.2 | -175.6 | -129.3 | -8.2 | 0 | 0 | 0 | 113.1 | R234 | D217-R234 IonicContact OD1-NH2 3.46Å; D217-R234 IonicContact OD2-CZ 2.71Å; D217-R234 IonicContact OD2-NE 3.83Å; D217-R234 PolarHBondContact OD2-NE 3.04Å; D217-R234 IonicContact OD2-NH2 3.26Å; D217-R234 PolarHBondContact OD2-NH2 3.21Å |
| 218 | D | 38.5 | Very low | 42.8 | Very low | 138 Ų | 138 | 105.1 Ų | 105.1 | 74% | 0.738 | 56% | 0.56 | S | S | * | * | S | Bend | trans | -83.5 | -20.6 | 177.8 | -79.2 | -30.1 | 0 | 0 | 0 | 114.4 | ||
| 219 | T | 34.4 | Very low | 43.4 | Very low | 110 Ų | 110 | 103.1 Ų | 103.1 | 68% | 0.675 | 55% | 0.546 | S | S | * | . | S | Bend | trans | -120.2 | 4.4 | -168.2 | 56.8 | 0 | 0 | 0 | 0 | 117 | ||
| 220 | R | 31.2 | Very low | 44.1 | Very low | 199 Ų | 199 | 103.8 Ų | 103.8 | 75% | 0.751 | 56% | 0.559 | S | S | * | * | trans | -172.3 | 116.2 | 162.6 | -104.8 | 149.5 | -168.7 | -170.9 | 5.1 | 109.9 | T222 | R220-T222 PolarHBondContact O-N 3.47Š| ||
| 221 | P | 38.1 | Very low | 44.6 | Very low | 111 Ų | 111 | 106.6 Ų | 106.6 | 72% | 0.721 | 58% | 0.578 | S | S | * | * | trans | -73.1 | 79.5 | 174.8 | 30.4 | -32.7 | 0 | 0 | 0 | 109.2 | S223 | P221-S223 VanDerWaalsContact C-N 3.31Å; P221-S223 PolarHBondContact O-N 2.85Å | ||
| 222 | T | 39.3 | Very low | 45.4 | Very low | 123 Ų | 123 | 104.6 Ų | 104.6 | 76% | 0.755 | 57% | 0.574 | S | S | * | * | S | Bend | trans | -73 | 96.7 | 163.6 | 52.2 | 0 | 0 | 0 | 0 | 106.6 | R220 | R220-T222 PolarHBondContact O-N 3.47Š|
| 223 | S | 40.6 | Very low | 46.9 | Very low | 87 Ų | 87 | 105.6 Ų | 105.6 | 61% | 0.608 | 57% | 0.566 | S | S | * | * | S | Bend | trans | 76.7 | 120.8 | -170.1 | 75.7 | 0 | 0 | 0 | 0 | 114.5 | P221 | P221-S223 VanDerWaalsContact C-N 3.31Å; P221-S223 PolarHBondContact O-N 2.85Å |
| 224 | K | 37.5 | Very low | 47.7 | Very low | 184 Ų | 184 | 103.6 Ų | 103.6 | 80% | 0.8 | 56% | 0.559 | S | S | * | * | trans | -43 | 141.9 | 162.9 | -75.4 | 175.6 | 174.9 | 176.4 | 0 | 109.2 | R226 | K224-R226 PolarHBondContact O-N 3.42Å; K224-R226 VanDerWaalsContact O-N 3.13Å | ||
| 225 | P | 45.2 | Very low | 48.6 | Very low | 67 Ų | 67 | 100.6 Ų | 100.6 | 44% | 0.435 | 54% | 0.54 | S | S | . | . | trans | -54.6 | 126.9 | 173.1 | 26.7 | -34.7 | 0 | 0 | 0 | 107.9 | C227 L232 | P225-C227 WeakPolarHBondContact CB-O 3.37Å; P225-C227 PolarHBondContact O-N 3.45Å; P225-L232 HydrophobicContact CB-CD1 3.88Å | ||
| 226 | R | 54.6 | Low | 50.1 | Low | 246 Ų | 246 | 95.3 Ų | 95.3 | 93% | 0.928 | 52% | 0.517 | S | S | * | . | S | Bend | trans | -56 | -19.6 | -176.1 | -69.6 | -176.6 | 175.8 | -160.4 | -1.7 | 112.5 | K224 | K224-R226 PolarHBondContact O-N 3.42Å; K224-R226 VanDerWaalsContact O-N 3.13Å |
| 227 | C | 58.5 | Low | 51.1 | Low | 26 Ų | 26 | 90.6 Ų | 90.6 | 18% | 0.176 | 50% | 0.498 | C | S | . | . | S | Bend | trans | -129.3 | 136.4 | 176.6 | 51.8 | 0 | 0 | 0 | 0 | 109.2 | P225 C229 H239 H249 | P225-C227 WeakPolarHBondContact CB-O 3.37Å; P225-C227 PolarHBondContact O-N 3.45Å; C227-C229 PolarHBondContact O-N 3.07Å; C227-H239 PolarHBondContact SG-CD2 3.02Å; C227-H239 PolarHBondContact SG-NE2 3.24Å; C227-H249 WeakPolarHBondContact CB-CE1 3.14Å; C227-H249 PolarHBondContact SG-CE1 3.03Å |
| 228 | G | 61.2 | Low | 52.4 | Low | 89 Ų | 89 | 89.6 Ų | 89.6 | 92% | 0.918 | 49% | 0.493 | S | S | * | . | trans | -74 | 40.8 | -179.6 | 0 | 0 | 0 | 0 | 0 | 115 | ||||
| 229 | C | 63.5 | Low | 53.7 | Low | 23 Ų | 23 | 83.4 Ų | 83.4 | 16% | 0.155 | 46% | 0.459 | C | S | . | . | trans | -90.8 | 134.6 | -176.6 | -60.9 | 0 | 0 | 0 | 0 | 111.9 | C227 H249 | C227-C229 PolarHBondContact O-N 3.07Å; C229-H249 PolarHBondContact SG-NE2 3Å | ||
| 230 | S | 62 | Low | 55.3 | Low | 93 Ų | 93 | 78.3 Ų | 78.3 | 65% | 0.65 | 43% | 0.428 | S | S | * | . | S | Bend | trans | -129.5 | 142.9 | 167.2 | 59.5 | 0 | 0 | 0 | 0 | 109.8 | ||
| 231 | P | 55.4 | Low | 57 | Low | 75 Ų | 75 | 69 Ų | 69 | 49% | 0.487 | 39% | 0.393 | S | S | . | . | S | Bend | cis | -69.1 | 155.3 | -12.3 | 30.8 | -35.4 | 0 | 0 | 0 | 113 | Y233 | P231-Y233 HydrophobicContact CB-CE2 4Å; P231-Y233 HydrophobicContact CG-CD2 4.25Å; P231-Y233 HydrophobicContact CG-CE2 3.62Å |
| 232 | L | 61.7 | Low | 58.5 | Low | 53 Ų | 53 | 65.4 Ų | 65.4 | 28% | 0.277 | 37% | 0.368 | S | S | . | . | trans | -103.2 | 93.2 | -174.1 | -157.7 | 103.5 | 0 | 0 | 0 | 111.4 | P225 R234 H239 | P225-L232 HydrophobicContact CB-CD1 3.88Å; L232-R234 HydrophobicContact CD2-CG 4.22Å; L232-R234 VanDerWaalsContact CD2-NE 3.28Å; L232-H239 VanDerWaalsContact CD1-CE1 3.49Å; L232-H239 WeakPolarHBondContact CD1-CE1 3.3Å | ||
| 233 | Y | 65.5 | Low | 60 | Low | 78 Ų | 78 | 60.8 Ų | 60.8 | 31% | 0.306 | 34% | 0.343 | S | S | . | . | trans | -90.4 | 138.4 | 173.3 | -67.1 | -71.8 | 0 | 0 | 0 | 111.7 | P231 H239 L240 L359 A360 A363 | P231-Y233 HydrophobicContact CB-CE2 4Å; P231-Y233 HydrophobicContact CG-CD2 4.25Å; P231-Y233 HydrophobicContact CG-CE2 3.62Å; Y233-H239 PolarHBondContact O-ND1 3.22Å; Y233-L240 PolarHBondContact O-N 2.93Å; Y233-L240 VanDerWaalsContact O-N 3.09Å; Y233-L359 HydrophobicContact CD1-CD2 3.83Å; Y233-L359 HydrophobicContact CG-CB 4.32Å; Y233-L359 HydrophobicContact CG-CD2 3.88Å; Y233-A360 HydrophobicContact CD2-CB 4.45Å; Y233-A360 HydrophobicContact CE2-CB 3.75Å; Y233-A363 HydrophobicContact CD1-CB 4.22Å; Y233-A363 HydrophobicContact CE1-CB 3.94Å | ||
| 234 | R | 60.1 | Low | 61.2 | Low | 79 Ų | 79 | 62.5 Ų | 62.5 | 30% | 0.298 | 34% | 0.341 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -130 | 141 | 177.1 | -57.2 | -172.9 | -166.9 | -140.2 | 11.6 | 112 | D217 L232 L238 H239 | D217-R234 IonicContact OD1-NH2 3.46Å; D217-R234 IonicContact OD2-CZ 2.71Å; D217-R234 IonicContact OD2-NE 3.83Å; D217-R234 PolarHBondContact OD2-NE 3.04Å; D217-R234 IonicContact OD2-NH2 3.26Å; D217-R234 PolarHBondContact OD2-NH2 3.21Å; L232-R234 HydrophobicContact CD2-CG 4.22Å; L232-R234 VanDerWaalsContact CD2-NE 3.28Å; R234-L238 CarbonylContact C-O 3.57Å; R234-L238 WeakPolarHBondContact CA-O 3.34Å; R234-L238 WeakPolarHBondContact CB-O 3.26Å; R234-H239 HydrophobicContact CG-CB 4.48Å |
| 235 | I | 61.2 | Low | 62.6 | Low | 3 Ų | 3 | 57 Ų | 57 | 2% | 0.015 | 32% | 0.317 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -125.1 | 122.3 | 175.2 | -156.5 | 162 | 0 | 0 | 0 | 108.9 | Y206 T210 G237 L238 A257 H260 T261 L359 | Y206-I235 HydrophobicContact CE1-CD1 3.76Å; Y206-I235 HydrophobicContact CE1-CG1 3.62Å; Y206-I235 WeakPolarHBondContact OH-CD1 3.12Å; Y206-I235 WeakPolarHBondContact OH-CG1 3.47Å; T210-I235 HydrophobicContact CG2-CG1 4.2Å; I235-G237 PolarHBondContact O-N 3.42Å; I235-G237 VanDerWaalsContact O-N 3.11Å; I235-L238 PolarHBondContact N-O 3.28Å; I235-L238 WeakPolarHBondContact O-CB 3.49Å; I235-L238 PolarHBondContact O-N 3.45Å; I235-A257 HydrophobicContact CG2-CB 3.66Å; I235-H260 HydrophobicContact CG1-CB 4.44Å; I235-H260 HydrophobicContact CG2-CB 4.24Å; I235-T261 VanDerWaalsContact CD1-OG1 3.31Å; I235-T261 WeakPolarHBondContact CD1-OG1 3.44Å; I235-L359 HydrophobicContact CB-CD1 3.93Å; I235-L359 HydrophobicContact CG2-CD1 4.4Å |
| 236 | V | 66 | Low | 64.1 | Low | 29 Ų | 29 | 54.3 Ų | 54.3 | 18% | 0.176 | 30% | 0.298 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 51.3 | 37.3 | -172.2 | -164.9 | 0 | 0 | 0 | 0 | 111.3 | Y206 R213 L238 H260 | Y206-V236 HydrophobicContact CE2-CG2 4.3Å; R213-V236 PolarHBondContact NH1-O 2.94Å; V236-L238 PolarHBondContact O-N 3.01Å; V236-H260 HydrophobicContact CG2-CB 4.41Å |
| 237 | G | 59.6 | Low | 64.8 | Low | 24 Ų | 24 | 48 Ų | 48 | 25% | 0.247 | 28% | 0.282 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 74.1 | -3 | -178.5 | 0 | 0 | 0 | 0 | 0 | 116.6 | I235 | I235-G237 PolarHBondContact O-N 3.42Å; I235-G237 VanDerWaalsContact O-N 3.11Å |
| 238 | L | 66.7 | Low | 65.5 | Low | 44 Ų | 44 | 57.2 Ų | 57.2 | 23% | 0.23 | 31% | 0.313 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -85.6 | 132.4 | 175.2 | -58.3 | 173.5 | 0 | 0 | 0 | 109.8 | R234 I235 V236 L240 E253 T256 A257 | R234-L238 CarbonylContact C-O 3.57Å; R234-L238 WeakPolarHBondContact CA-O 3.34Å; R234-L238 WeakPolarHBondContact CB-O 3.26Å; I235-L238 PolarHBondContact N-O 3.28Å; I235-L238 WeakPolarHBondContact O-CB 3.49Å; I235-L238 PolarHBondContact O-N 3.45Å; V236-L238 PolarHBondContact O-N 3.01Å; L238-L240 PolarHBondContact O-N 3.15Å; L238-E253 HydrophobicContact CB-CG 4.31Å; L238-E253 HydrophobicContact CD2-CG 4.27Å; L238-T256 HydrophobicContact CD1-CG2 3.46Å; L238-T256 VanDerWaalsContact CD1-CG2 3.46Å; L238-A257 HydrophobicContact CB-CB 4.05Å; L238-A257 HydrophobicContact CD1-CB 4.39Å |
| 239 | H | 64.6 | Low | 66.1 | Low | 8 Ų | 8 | 53.9 Ų | 53.9 | 4% | 0.037 | 27% | 0.273 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -77.6 | 123.3 | 176.8 | 176.5 | 49.7 | 0 | 0 | 0 | 110 | C227 L232 Y233 R234 H249 E253 | C227-H239 PolarHBondContact SG-CD2 3.02Å; C227-H239 PolarHBondContact SG-NE2 3.24Å; L232-H239 VanDerWaalsContact CD1-CE1 3.49Å; L232-H239 WeakPolarHBondContact CD1-CE1 3.3Å; Y233-H239 PolarHBondContact O-ND1 3.22Å; R234-H239 HydrophobicContact CG-CB 4.48Å; H239-H249 AromaticContact CD2-CE1 3.45Å; H239-H249 PolarHBondContact CD2-CE1 3.43Å; H239-H249 VanDerWaalsContact CD2-CE1 3.45Å; H239-H249 AromaticContact CD2-ND1 3.69Å; H239-H249 AromaticContact NE2-CE1 3.47Å; H239-H249 PolarHBondContact NE2-CE1 3.35Å; H239-E253 PolarHBondContact N-OE1 3.38Å; H239-E253 VanDerWaalsContact N-OE1 3.08Å |
| 240 | L | 69.1 | Low | 66.8 | Low | 3 Ų | 3 | 57.3 Ų | 57.3 | 2% | 0.016 | 29% | 0.29 | C | S | . | . | trans | -111.7 | 105.2 | 172.1 | -170.2 | 62.7 | 0 | 0 | 0 | 108.4 | Y233 L238 Y246 V254 A257 L258 L359 | Y233-L240 PolarHBondContact O-N 2.93Å; Y233-L240 VanDerWaalsContact O-N 3.09Å; L238-L240 PolarHBondContact O-N 3.15Å; L240-Y246 HydrophobicContact CD1-CD1 4.46Å; L240-Y246 HydrophobicContact CD1-CE1 3.51Å; L240-Y246 HydrophobicContact CG-CE1 4.19Å; L240-V254 HydrophobicContact CD1-CG1 4.08Å; L240-A257 HydrophobicContact CB-CB 3.97Å; L240-A257 HydrophobicContact CD1-CB 3.83Å; L240-A257 HydrophobicContact CD2-CB 4.36Å; L240-A257 HydrophobicContact CG-CB 4.27Å; L240-L258 HydrophobicContact CD1-CD2 4.27Å; L240-L258 HydrophobicContact CD1-CG 4.03Å; L240-L258 HydrophobicContact CD2-CD2 4.08Å; L240-L359 HydrophobicContact CB-CD1 3.78Å; L240-L359 HydrophobicContact CD2-CB 4.29Å; L240-L359 HydrophobicContact CD2-CD1 4.17Å | ||
| 241 | P | 66 | Low | 67.5 | Low | 4 Ų | 4 | 57 Ų | 57 | 3% | 0.026 | 28% | 0.278 | C | S | . | . | trans | -74.3 | 174 | 175 | 34.9 | -38.8 | 0 | 0 | 0 | 110.7 | K245 Y246 H249 | P241-K245 HydrophobicContact CB-CB 4Å; P241-K245 HydrophobicContact CG-CB 4.45Å; P241-Y246 HydrophobicContact CG-CD1 3.77Å; P241-Y246 HydrophobicContact CG-CE1 4.07Å; P241-Y246 WeakPolarHBondContact O-CE1 3.13Å; P241-H249 HydrophobicContact CG-CB 4.45Å | ||
| 242 | D | 70.5 | Confident | 68.6 | Low | 35 Ų | 35 | 59 Ų | 59 | 19% | 0.187 | 28% | 0.283 | C | S | . | . | trans | -61.1 | 153.8 | 171.9 | -53.7 | -46.6 | 0 | 0 | 0 | 111.3 | E244 K245 | D242-E244 PolarHBondContact O-N 3.16Å; D242-K245 PolarHBondContact O-N 3.24Å; D242-K245 IonicContact OD2-NZ 3.14Å | ||
| 243 | A | 69.6 | Low | 69.2 | Low | 27 Ų | 27 | 59 Ų | 59 | 22% | 0.223 | 28% | 0.281 | C | S | . | . | G | 310 helix | trans | -55.5 | -31.1 | -171.9 | 0 | 0 | 0 | 0 | 0 | 114.5 | K245 Y246 V321 R356 | A243-K245 VanDerWaalsContact C-N 3.3Å; A243-K245 PolarHBondContact O-N 3.23Å; A243-Y246 VanDerWaalsContact CA-CE2 3.42Å; A243-Y246 HydrophobicContact CB-CD2 4.29Å; A243-Y246 HydrophobicContact CB-CE2 3.79Å; A243-Y246 VanDerWaalsContact O-CD2 3.29Å; A243-Y246 WeakPolarHBondContact O-CD2 3.38Å; A243-V321 HydrophobicContact CB-CG1 4.29Å; A243-R356 WeakPolarHBondContact CB-O 3.42Å; A243-R356 PolarHBondContact N-O 3.01Å |
| 244 | E | 66.6 | Low | 69.8 | Low | 123 Ų | 123 | 55.4 Ų | 55.4 | 58% | 0.575 | 27% | 0.267 | S | S | * | . | G | 310 helix | trans | -68.5 | -27.1 | 178.1 | -60.6 | -176.7 | 175.2 | 0 | 0 | 113.5 | D242 R356 | D242-E244 PolarHBondContact O-N 3.16Å; E244-R356 WeakPolarHBondContact OE1-CD 3.45Å; E244-R356 IonicContact OE1-CZ 3.07Å; E244-R356 IonicContact OE1-NE 3.21Å; E244-R356 IonicContact OE1-NH1 2.69Å; E244-R356 PolarHBondContact OE1-NH1 2.94Å |
| 245 | K | 67.9 | Low | 70.7 | Confident | 69 Ų | 69 | 51.9 Ų | 51.9 | 30% | 0.3 | 26% | 0.255 | S | S | . | . | G | 310 helix | trans | -93.7 | -3.3 | -174.4 | -68 | 172.4 | -171.3 | 156.7 | 0 | 112.6 | P241 D242 A243 I247 R248 H249 | P241-K245 HydrophobicContact CB-CB 4Å; P241-K245 HydrophobicContact CG-CB 4.45Å; D242-K245 PolarHBondContact O-N 3.24Å; D242-K245 IonicContact OD2-NZ 3.14Å; A243-K245 VanDerWaalsContact C-N 3.3Å; A243-K245 PolarHBondContact O-N 3.23Å; K245-I247 PolarHBondContact O-N 3.16Å; K245-R248 PolarHBondContact O-N 2.92Å; K245-H249 PolarHBondContact O-CD2 3.38Å |
| 246 | Y | 74.8 | Confident | 71.4 | Confident | 10 Ų | 10 | 53.6 Ų | 53.6 | 4% | 0.039 | 27% | 0.266 | C | S | . | . | G | 310 helix | trans | -52.7 | -32.2 | -178.6 | -69.3 | -28.2 | 0 | 0 | 0 | 114.3 | L240 P241 A243 R248 H249 V254 L258 F317 V321 T358 | L240-Y246 HydrophobicContact CD1-CD1 4.46Å; L240-Y246 HydrophobicContact CD1-CE1 3.51Å; L240-Y246 HydrophobicContact CG-CE1 4.19Å; P241-Y246 HydrophobicContact CG-CD1 3.77Å; P241-Y246 HydrophobicContact CG-CE1 4.07Å; P241-Y246 WeakPolarHBondContact O-CE1 3.13Å; A243-Y246 VanDerWaalsContact CA-CE2 3.42Å; A243-Y246 HydrophobicContact CB-CD2 4.29Å; A243-Y246 HydrophobicContact CB-CE2 3.79Å; A243-Y246 VanDerWaalsContact O-CD2 3.29Å; A243-Y246 WeakPolarHBondContact O-CD2 3.38Å; Y246-R248 PolarHBondContact O-N 3.5Å; Y246-H249 PolarHBondContact O-N 3.02Å; Y246-V254 HydrophobicContact CD1-CB 4.34Å; Y246-V254 HydrophobicContact CD1-CG1 3.44Å; Y246-V254 VanDerWaalsContact CD1-CG1 3.44Å; Y246-V254 HydrophobicContact CD1-CG2 3.88Å; Y246-V254 HydrophobicContact CD2-CG1 4.17Å; Y246-V254 HydrophobicContact CE1-CG1 3.74Å; Y246-V254 HydrophobicContact CE2-CG1 4.37Å; Y246-V254 HydrophobicContact CG-CG1 3.72Å; Y246-L258 HydrophobicContact CE2-CD1 4.29Å; Y246-F317 AromaticContact CD2-CE1 3.65Å; Y246-F317 HydrophobicContact CD2-CE1 3.65Å; Y246-F317 AromaticContact CD2-CZ 3.66Å; Y246-F317 HydrophobicContact CD2-CZ 3.66Å; Y246-F317 HydrophobicContact CE2-CE1 4.39Å; Y246-F317 HydrophobicContact CE2-CZ 4.1Å; Y246-F317 HydrophobicContact CG-CE1 4.4Å; Y246-F317 HydrophobicContact CG-CZ 4.37Å; Y246-V321 HydrophobicContact CE2-CG1 4.15Å; Y246-V321 HydrophobicContact CE2-CG2 4.11Å; Y246-T358 PolarHBondContact OH-OG1 3.46Å |
| 247 | I | 70.1 | Confident | 71.8 | Confident | 112 Ų | 112 | 52.2 Ų | 52.2 | 57% | 0.574 | 26% | 0.257 | S | S | * | . | G | 310 helix | trans | -61.7 | -29.7 | 179.1 | -56.2 | 168.5 | 0 | 0 | 0 | 112.1 | K245 H249 | K245-I247 PolarHBondContact O-N 3.16Å; I247-H249 VanDerWaalsContact C-N 3.3Å; I247-H249 PolarHBondContact O-N 2.64Å |
| 248 | R | 73.5 | Confident | 72.8 | Confident | 220 Ų | 220 | 51.1 Ų | 51.1 | 83% | 0.83 | 25% | 0.245 | S | C | * | . | G | 310 helix | trans | -86.5 | 0.2 | -177.3 | -61.4 | -173.3 | -178.5 | -124.6 | 2 | 113.5 | K245 Y246 | K245-R248 PolarHBondContact O-N 2.92Å; Y246-R248 PolarHBondContact O-N 3.5Å |
| 249 | H | 74.3 | Confident | 73.3 | Confident | 20 Ų | 20 | 49.1 Ų | 49.1 | 9% | 0.093 | 24% | 0.236 | C | C | . | . | S | Bend | trans | -122.2 | 164.8 | -173.2 | -67.6 | -115.5 | 0 | 0 | 0 | 111.1 | C227 C229 H239 P241 K245 Y246 I247 H251 V254 | C227-H249 WeakPolarHBondContact CB-CE1 3.14Å; C227-H249 PolarHBondContact SG-CE1 3.03Å; C229-H249 PolarHBondContact SG-NE2 3Å; H239-H249 AromaticContact CD2-CE1 3.45Å; H239-H249 PolarHBondContact CD2-CE1 3.43Å; H239-H249 VanDerWaalsContact CD2-CE1 3.45Å; H239-H249 AromaticContact CD2-ND1 3.69Å; H239-H249 AromaticContact NE2-CE1 3.47Å; H239-H249 PolarHBondContact NE2-CE1 3.35Å; P241-H249 HydrophobicContact CG-CB 4.45Å; K245-H249 PolarHBondContact O-CD2 3.38Å; Y246-H249 PolarHBondContact O-N 3.02Å; I247-H249 VanDerWaalsContact C-N 3.3Å; I247-H249 PolarHBondContact O-N 2.64Å; H249-H251 PolarHBondContact O-N 3.4Å; H249-H251 VanDerWaalsContact O-N 3.16Å; H249-V254 HydrophobicContact CB-CG2 3.93Å |
| 250 | N | 76.8 | Confident | 73.7 | Confident | 95 Ų | 95 | 51.8 Ų | 51.8 | 51% | 0.508 | 25% | 0.248 | S | C | . | . | trans | -63.3 | 119 | 177.2 | -175.9 | -5.1 | 0 | 0 | 0 | 110.3 | M252 E253 V254 | N250-M252 PolarHBondContact O-N 3Å; N250-M252 VanDerWaalsContact O-N 3.14Å; N250-M252 PolarHBondContact OD1-N 3.22Å; N250-E253 HydrophobicContact CB-CB 4.04Å; N250-E253 WeakPolarHBondContact O-CB 3.32Å; N250-E253 PolarHBondContact O-N 3Å; N250-V254 PolarHBondContact O-N 3.12Å | ||
| 251 | H | 78.2 | Confident | 74.2 | Confident | 85 Ų | 85 | 51.6 Ų | 51.6 | 39% | 0.394 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -51.5 | -37.1 | 177.4 | -66 | -73.2 | 0 | 0 | 0 | 112.6 | H249 S255 S309 | H249-H251 PolarHBondContact O-N 3.4Å; H249-H251 VanDerWaalsContact O-N 3.16Å; H251-S255 VanDerWaalsContact O-CB 3.25Å; H251-S255 WeakPolarHBondContact O-CB 3.38Å; H251-S255 PolarHBondContact O-N 3.18Å; H251-S255 PolarHBondContact O-OG 3.33Å; H251-S309 WeakPolarHBondContact CB-OG 3.35Å; H251-S309 WeakPolarHBondContact ND1-CB 3.45Å; H251-S309 PolarHBondContact ND1-OG 2.98Å |
| 252 | M | 77.4 | Confident | 75 | Confident | 119 Ų | 119 | 51.4 Ų | 51.4 | 59% | 0.586 | 25% | 0.246 | S | C | * | . | H | α-helix | trans | -70 | -38.2 | 178.4 | -70.2 | -62.4 | -67 | 0 | 0 | 112.7 | N250 T256 | N250-M252 PolarHBondContact O-N 3Å; N250-M252 VanDerWaalsContact O-N 3.14Å; N250-M252 PolarHBondContact OD1-N 3.22Å; M252-T256 WeakPolarHBondContact O-CB 3.44Å; M252-T256 PolarHBondContact O-N 2.89Å; M252-T256 PolarHBondContact O-OG1 2.89Å |
| 253 | E | 75 | Confident | 75.4 | Confident | 53 Ų | 53 | 52.2 Ų | 52.2 | 25% | 0.248 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -66.2 | -49.2 | 177.6 | -177.4 | 173.1 | -170.6 | 0 | 0 | 110.3 | L238 H239 N250 S255 T256 A257 | L238-E253 HydrophobicContact CB-CG 4.31Å; L238-E253 HydrophobicContact CD2-CG 4.27Å; H239-E253 PolarHBondContact N-OE1 3.38Å; H239-E253 VanDerWaalsContact N-OE1 3.08Å; N250-E253 HydrophobicContact CB-CB 4.04Å; N250-E253 WeakPolarHBondContact O-CB 3.32Å; N250-E253 PolarHBondContact O-N 3Å; E253-S255 PolarHBondContact O-N 2.93Å; E253-T256 PolarHBondContact O-N 2.74Å; E253-A257 WeakPolarHBondContact O-CB 3.31Å; E253-A257 PolarHBondContact O-N 3.18Å |
| 254 | V | 78.5 | Confident | 75.8 | Confident | 1 Ų | 1 | 51 Ų | 51 | 1% | 0.006 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -59 | -46.9 | 176.7 | 174 | 0 | 0 | 0 | 0 | 111.2 | L240 Y246 H249 N250 T256 A257 L258 F317 | L240-V254 HydrophobicContact CD1-CG1 4.08Å; Y246-V254 HydrophobicContact CD1-CB 4.34Å; Y246-V254 HydrophobicContact CD1-CG1 3.44Å; Y246-V254 VanDerWaalsContact CD1-CG1 3.44Å; Y246-V254 HydrophobicContact CD1-CG2 3.88Å; Y246-V254 HydrophobicContact CD2-CG1 4.17Å; Y246-V254 HydrophobicContact CE1-CG1 3.74Å; Y246-V254 HydrophobicContact CE2-CG1 4.37Å; Y246-V254 HydrophobicContact CG-CG1 3.72Å; H249-V254 HydrophobicContact CB-CG2 3.93Å; N250-V254 PolarHBondContact O-N 3.12Å; V254-T256 VanDerWaalsContact C-N 3.33Å; V254-T256 PolarHBondContact O-N 3.27Å; V254-A257 PolarHBondContact O-N 2.84Å; V254-L258 HydrophobicContact CG1-CD1 3.84Å; V254-L258 HydrophobicContact CG1-CG 4.36Å; V254-L258 WeakPolarHBondContact O-CB 3.39Å; V254-L258 WeakPolarHBondContact O-CG 3.36Å; V254-L258 PolarHBondContact O-N 3.37Å; V254-F317 HydrophobicContact CG1-CZ 4.17Å |
| 255 | S | 78.6 | Confident | 76.4 | Confident | 5 Ų | 5 | 45.2 Ų | 45.2 | 4% | 0.035 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -64.3 | -38 | -179.4 | -56 | 0 | 0 | 0 | 0 | 112.2 | H251 E253 G259 S285 F308 | H251-S255 VanDerWaalsContact O-CB 3.25Å; H251-S255 WeakPolarHBondContact O-CB 3.38Å; H251-S255 PolarHBondContact O-N 3.18Å; H251-S255 PolarHBondContact O-OG 3.33Å; E253-S255 PolarHBondContact O-N 2.93Å; S255-G259 PolarHBondContact O-N 2.68Å; S255-S285 WeakPolarHBondContact CB-O 3.24Å; S255-F308 VanDerWaalsContact OG-CA 3.25Å; S255-F308 WeakPolarHBondContact OG-CA 3.33Å; S255-F308 VanDerWaalsContact OG-CB 3.31Å; S255-F308 WeakPolarHBondContact OG-CB 3.44Å |
| 256 | T | 75.2 | Confident | 77 | Confident | 40 Ų | 40 | 42.3 Ų | 42.3 | 25% | 0.245 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -70.1 | -43.2 | 177.6 | -52.3 | 0 | 0 | 0 | 0 | 110.8 | L238 M252 E253 V254 G259 H260 S285 | L238-T256 HydrophobicContact CD1-CG2 3.46Å; L238-T256 VanDerWaalsContact CD1-CG2 3.46Å; M252-T256 WeakPolarHBondContact O-CB 3.44Å; M252-T256 PolarHBondContact O-N 2.89Å; M252-T256 PolarHBondContact O-OG1 2.89Å; E253-T256 PolarHBondContact O-N 2.74Å; V254-T256 VanDerWaalsContact C-N 3.33Å; V254-T256 PolarHBondContact O-N 3.27Å; T256-G259 PolarHBondContact O-N 3.13Å; T256-H260 PolarHBondContact O-CD2 3.06Å; T256-H260 PolarHBondContact O-N 3.49Å; T256-S285 WeakPolarHBondContact OG1-CB 3.42Å |
| 257 | A | 74.4 | Confident | 77 | Confident | 0 Ų | 0 | 42 Ų | 42 | 0% | 0 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -63 | -45 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | I235 L238 L240 E253 V254 G259 H260 T261 | I235-A257 HydrophobicContact CG2-CB 3.66Å; L238-A257 HydrophobicContact CB-CB 4.05Å; L238-A257 HydrophobicContact CD1-CB 4.39Å; L240-A257 HydrophobicContact CB-CB 3.97Å; L240-A257 HydrophobicContact CD1-CB 3.83Å; L240-A257 HydrophobicContact CD2-CB 4.36Å; L240-A257 HydrophobicContact CG-CB 4.27Å; E253-A257 WeakPolarHBondContact O-CB 3.31Å; E253-A257 PolarHBondContact O-N 3.18Å; V254-A257 PolarHBondContact O-N 2.84Å; A257-G259 VanDerWaalsContact C-N 3.33Å; A257-G259 PolarHBondContact O-N 2.94Å; A257-H260 WeakPolarHBondContact O-CB 3.4Å; A257-H260 PolarHBondContact O-N 2.88Å; A257-T261 PolarHBondContact O-N 3.42Å; A257-T261 PolarHBondContact O-OG1 3.32Å; A257-T261 VanDerWaalsContact O-OG1 3.05Å |
| 258 | L | 80.4 | Confident | 77.1 | Confident | 0 Ų | 0 | 36.6 Ų | 36.6 | 0% | 0 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -62.9 | -38.4 | 173.5 | -74.4 | 172.1 | 0 | 0 | 0 | 112.5 | L240 Y246 V254 H260 T261 A262 L307 F317 V321 L324 T358 | L240-L258 HydrophobicContact CD1-CD2 4.27Å; L240-L258 HydrophobicContact CD1-CG 4.03Å; L240-L258 HydrophobicContact CD2-CD2 4.08Å; Y246-L258 HydrophobicContact CE2-CD1 4.29Å; V254-L258 HydrophobicContact CG1-CD1 3.84Å; V254-L258 HydrophobicContact CG1-CG 4.36Å; V254-L258 WeakPolarHBondContact O-CB 3.39Å; V254-L258 WeakPolarHBondContact O-CG 3.36Å; V254-L258 PolarHBondContact O-N 3.37Å; L258-H260 VanDerWaalsContact C-N 3.33Å; L258-T261 WeakPolarHBondContact O-CB 3.47Å; L258-T261 PolarHBondContact O-N 3.38Å; L258-A262 VanDerWaalsContact O-CB 3.31Å; L258-A262 WeakPolarHBondContact O-CB 3.36Å; L258-A262 PolarHBondContact O-N 3.34Å; L258-L307 HydrophobicContact CB-CB 4.26Å; L258-L307 WeakPolarHBondContact CD1-O 3.36Å; L258-F317 HydrophobicContact CD1-CE2 3.61Å; L258-F317 HydrophobicContact CD1-CZ 3.79Å; L258-V321 HydrophobicContact CD1-CG2 3.81Å; L258-V321 HydrophobicContact CD2-CG2 4.38Å; L258-L324 HydrophobicContact CD2-CD2 4.32Å; L258-T358 HydrophobicContact CD2-CG2 4.31Å |
| 259 | G | 77.8 | Confident | 77.1 | Confident | 3 Ų | 3 | 26.6 Ų | 26.6 | 3% | 0.031 | 13% | 0.134 | C | C | . | . | H | α-helix | trans | -60.8 | -42.2 | 173.8 | 0 | 0 | 0 | 0 | 0 | 112.7 | S255 T256 A257 H263 G284 | S255-G259 PolarHBondContact O-N 2.68Å; T256-G259 PolarHBondContact O-N 3.13Å; A257-G259 VanDerWaalsContact C-N 3.33Å; A257-G259 PolarHBondContact O-N 2.94Å; G259-H263 PolarHBondContact O-N 3.18Å; G259-G284 VanDerWaalsContact CA-O 3.24Å; G259-G284 WeakPolarHBondContact CA-O 3.31Å |
| 260 | H | 73.5 | Confident | 77.1 | Confident | 63 Ų | 63 | 30.7 Ų | 30.7 | 29% | 0.292 | 15% | 0.149 | S | C | . | . | H | α-helix | trans | -62.8 | -46.6 | 171.5 | -80 | -61 | 0 | 0 | 0 | 111 | Y206 I235 V236 T256 A257 L258 A262 H263 L264 | Y206-H260 HydrophobicContact CE2-CB 4.28Å; Y206-H260 VanDerWaalsContact OH-CB 3.27Å; Y206-H260 WeakPolarHBondContact OH-CB 3.44Å; Y206-H260 PolarHBondContact OH-O 3.29Å; I235-H260 HydrophobicContact CG1-CB 4.44Å; I235-H260 HydrophobicContact CG2-CB 4.24Å; V236-H260 HydrophobicContact CG2-CB 4.41Å; T256-H260 PolarHBondContact O-CD2 3.06Å; T256-H260 PolarHBondContact O-N 3.49Å; A257-H260 WeakPolarHBondContact O-CB 3.4Å; A257-H260 PolarHBondContact O-N 2.88Å; L258-H260 VanDerWaalsContact C-N 3.33Å; H260-A262 VanDerWaalsContact C-N 3.34Å; H260-A262 PolarHBondContact O-N 3.1Å; H260-H263 WeakPolarHBondContact O-CB 3.43Å; H260-H263 PolarHBondContact O-N 3.24Å; H260-H263 VanDerWaalsContact O-N 3.14Å; H260-L264 PolarHBondContact O-N 3.36Å |
| 261 | T | 78.8 | Confident | 76.7 | Confident | 0 Ų | 0 | 27.4 Ų | 27.4 | 0% | 0 | 13% | 0.131 | C | C | . | . | H | α-helix | trans | -58.5 | -45.9 | 178.2 | -58 | 0 | 0 | 0 | 0 | 111.6 | Y206 I235 A257 L258 H263 L264 V265 L324 I328 V362 | Y206-T261 PolarHBondContact OH-N 3Å; I235-T261 VanDerWaalsContact CD1-OG1 3.31Å; I235-T261 WeakPolarHBondContact CD1-OG1 3.44Å; A257-T261 PolarHBondContact O-N 3.42Å; A257-T261 PolarHBondContact O-OG1 3.32Å; A257-T261 VanDerWaalsContact O-OG1 3.05Å; L258-T261 WeakPolarHBondContact O-CB 3.47Å; L258-T261 PolarHBondContact O-N 3.38Å; T261-H263 VanDerWaalsContact C-N 3.29Å; T261-H263 PolarHBondContact O-N 3.37Å; T261-L264 WeakPolarHBondContact O-CB 3.37Å; T261-L264 PolarHBondContact O-N 3.17Å; T261-L264 VanDerWaalsContact O-N 3.16Å; T261-V265 WeakPolarHBondContact O-CG2 3.35Å; T261-V265 PolarHBondContact O-N 2.88Å; T261-L324 HydrophobicContact CG2-CD2 4.2Å; T261-I328 HydrophobicContact CG2-CD1 4.29Å; T261-V362 HydrophobicContact CG2-CG2 3.76Å |
| 262 | A | 82.6 | Confident | 76.3 | Confident | 0 Ų | 0 | 26.6 Ų | 26.6 | 0% | 0 | 13% | 0.127 | C | C | . | . | H | α-helix | trans | -56.6 | -42.2 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | L258 H260 S266 V280 L282 L307 L324 | L258-A262 VanDerWaalsContact O-CB 3.31Å; L258-A262 WeakPolarHBondContact O-CB 3.36Å; L258-A262 PolarHBondContact O-N 3.34Å; H260-A262 VanDerWaalsContact C-N 3.34Å; H260-A262 PolarHBondContact O-N 3.1Å; A262-S266 WeakPolarHBondContact O-CB 3.43Å; A262-S266 PolarHBondContact O-N 3.04Å; A262-V280 HydrophobicContact CB-CG1 3.75Å; A262-L282 HydrophobicContact CB-CD2 4.17Å; A262-L307 HydrophobicContact CB-CD1 3.78Å; A262-L324 HydrophobicContact CB-CD1 4.35Å |
| 263 | H | 79.9 | Confident | 76.1 | Confident | 52 Ų | 52 | 27.4 Ų | 27.4 | 24% | 0.241 | 13% | 0.133 | C | C | . | . | H | α-helix | trans | -63.5 | -45.4 | 175.1 | -171.8 | -84.7 | 0 | 0 | 0 | 111.9 | Q202 G259 H260 T261 V265 S266 V267 L282 | Q202-H263 PolarHBondContact OE1-CE1 2.9Å; G259-H263 PolarHBondContact O-N 3.18Å; H260-H263 WeakPolarHBondContact O-CB 3.43Å; H260-H263 PolarHBondContact O-N 3.24Å; H260-H263 VanDerWaalsContact O-N 3.14Å; T261-H263 VanDerWaalsContact C-N 3.29Å; T261-H263 PolarHBondContact O-N 3.37Å; H263-V265 PolarHBondContact O-N 3.47Å; H263-S266 WeakPolarHBondContact O-CB 3.26Å; H263-S266 PolarHBondContact O-N 2.86Å; H263-V267 WeakPolarHBondContact O-CG2 3.43Å; H263-V267 PolarHBondContact O-N 2.82Å; H263-L282 HydrophobicContact CB-CD2 4.15Å |
| 264 | L | 77 | Confident | 76.1 | Confident | 2 Ų | 2 | 25.7 Ų | 25.7 | 1% | 0.01 | 13% | 0.126 | C | C | . | . | H | α-helix | trans | -59.4 | -48.2 | 177.1 | 176.6 | 63.6 | 0 | 0 | 0 | 111.7 | L203 Y206 H260 T261 S266 V267 L268 V362 L366 | L203-L264 HydrophobicContact CD1-CD1 3.48Å; L203-L264 VanDerWaalsContact CD1-CD1 3.48Å; Y206-L264 HydrophobicContact CD1-CB 4.37Å; Y206-L264 HydrophobicContact CD1-CD1 3.89Å; Y206-L264 HydrophobicContact CD1-CD2 4.09Å; Y206-L264 HydrophobicContact CD1-CG 4.34Å; Y206-L264 HydrophobicContact CE1-CB 3.88Å; Y206-L264 HydrophobicContact CE1-CD1 4.19Å; Y206-L264 HydrophobicContact CE1-CD2 3.71Å; Y206-L264 HydrophobicContact CE1-CG 4.14Å; Y206-L264 HydrophobicContact CE2-CB 4.26Å; Y206-L264 HydrophobicContact CG-CD1 4.24Å; H260-L264 PolarHBondContact O-N 3.36Å; T261-L264 WeakPolarHBondContact O-CB 3.37Å; T261-L264 PolarHBondContact O-N 3.17Å; T261-L264 VanDerWaalsContact O-N 3.16Å; L264-S266 VanDerWaalsContact C-N 3.29Å; L264-S266 PolarHBondContact O-N 3.43Å; L264-V267 PolarHBondContact O-N 3.28Å; L264-V267 VanDerWaalsContact O-N 3.14Å; L264-L268 HydrophobicContact CD1-CD1 4.23Å; L264-L268 HydrophobicContact CD1-CG 4.22Å; L264-L268 HydrophobicContact CG-CD1 4.06Å; L264-L268 HydrophobicContact CG-CG 4.45Å; L264-L268 WeakPolarHBondContact O-CG 3.33Å; L264-L268 PolarHBondContact O-N 2.97Å; L264-V362 HydrophobicContact CD2-CG1 3.43Å; L264-V362 VanDerWaalsContact CD2-CG1 3.43Å; L264-L366 HydrophobicContact CD1-CD2 4.42Å; L264-L366 HydrophobicContact CD2-CD1 4Å; L264-L366 HydrophobicContact CD2-CD2 4.26Å; L264-L366 HydrophobicContact CD2-CG 4.33Å |
| 265 | V | 79.7 | Confident | 76.2 | Confident | 1 Ų | 1 | 30.1 Ų | 30.1 | 1% | 0.006 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -60.3 | -40.8 | 177.9 | 174.2 | 0 | 0 | 0 | 0 | 111.1 | T261 H263 L268 S269 L276 L324 N327 I328 | T261-V265 WeakPolarHBondContact O-CG2 3.35Å; T261-V265 PolarHBondContact O-N 2.88Å; H263-V265 PolarHBondContact O-N 3.47Å; V265-L268 PolarHBondContact O-N 3.48Å; V265-S269 WeakPolarHBondContact O-CB 3.15Å; V265-S269 PolarHBondContact O-N 2.93Å; V265-S269 PolarHBondContact O-OG 2.91Å; V265-L276 HydrophobicContact CG1-CD1 4.36Å; V265-L276 HydrophobicContact CG1-CD2 4.14Å; V265-L324 HydrophobicContact CG2-CD1 4.36Å; V265-N327 HydrophobicContact CG1-CB 4.17Å; V265-I328 HydrophobicContact CG2-CD1 4.13Å; V265-I328 HydrophobicContact CG2-CG1 3.49Å; V265-I328 VanDerWaalsContact CG2-CG1 3.49Å |
| 266 | S | 80.1 | Confident | 76.4 | Confident | 7 Ų | 7 | 31.2 Ų | 31.2 | 5% | 0.049 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -62.1 | -45 | 174.8 | -171 | 0 | 0 | 0 | 0 | 111.7 | A262 H263 L264 S269 R270 | A262-S266 WeakPolarHBondContact O-CB 3.43Å; A262-S266 PolarHBondContact O-N 3.04Å; H263-S266 WeakPolarHBondContact O-CB 3.26Å; H263-S266 PolarHBondContact O-N 2.86Å; L264-S266 VanDerWaalsContact C-N 3.29Å; L264-S266 PolarHBondContact O-N 3.43Å; S266-S269 PolarHBondContact O-N 3.48Å; S266-S269 PolarHBondContact O-OG 3.25Å; S266-R270 WeakPolarHBondContact O-CG 3.42Å; S266-R270 PolarHBondContact O-N 2.71Å; S266-R270 VanDerWaalsContact O-N 3.11Å |
| 267 | V | 75.1 | Confident | 76.9 | Confident | 3 Ų | 3 | 35.8 Ų | 35.8 | 2% | 0.018 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -60.4 | -48.5 | 176.8 | 169.8 | 0 | 0 | 0 | 0 | 111 | L199 Q202 L203 H263 L264 S269 R270 I271 | L199-V267 HydrophobicContact CB-CG1 4.12Å; L199-V267 HydrophobicContact CD2-CB 4.28Å; L199-V267 HydrophobicContact CD2-CG1 4.1Å; L199-V267 HydrophobicContact CD2-CG2 4.04Å; L199-V267 VanDerWaalsContact O-CG1 3.31Å; L199-V267 WeakPolarHBondContact O-CG1 3.21Å; Q202-V267 HydrophobicContact CB-CG2 4.41Å; L203-V267 HydrophobicContact CB-CG1 4.15Å; H263-V267 WeakPolarHBondContact O-CG2 3.43Å; H263-V267 PolarHBondContact O-N 2.82Å; L264-V267 PolarHBondContact O-N 3.28Å; L264-V267 VanDerWaalsContact O-N 3.14Å; V267-S269 PolarHBondContact O-N 3.46Å; V267-R270 PolarHBondContact O-N 3.27Å; V267-I271 HydrophobicContact CG1-CD1 3.7Å; V267-I271 HydrophobicContact CG1-CG1 4.36Å; V267-I271 WeakPolarHBondContact O-CG1 3.4Å; V267-I271 PolarHBondContact O-N 3.45Å |
| 268 | L | 72.3 | Confident | 77.6 | Confident | 0 Ų | 0 | 36.2 Ų | 36.2 | 0% | 0 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -60.4 | -46 | 178.2 | -69.2 | 174.3 | 0 | 0 | 0 | 111.9 | L203 L264 V265 R270 I271 F272 V331 L365 L369 | L203-L268 HydrophobicContact CD1-CD2 3.74Å; L203-L268 HydrophobicContact CD1-CG 4.39Å; L203-L268 HydrophobicContact CD2-CD2 4.02Å; L264-L268 HydrophobicContact CD1-CD1 4.23Å; L264-L268 HydrophobicContact CD1-CG 4.22Å; L264-L268 HydrophobicContact CG-CD1 4.06Å; L264-L268 HydrophobicContact CG-CG 4.45Å; L264-L268 WeakPolarHBondContact O-CG 3.33Å; L264-L268 PolarHBondContact O-N 2.97Å; V265-L268 PolarHBondContact O-N 3.48Å; L268-R270 PolarHBondContact O-N 3.35Å; L268-I271 PolarHBondContact O-N 3.44Å; L268-F272 HydrophobicContact CD2-CE2 4.15Å; L268-F272 VanDerWaalsContact O-CD2 3.26Å; L268-F272 WeakPolarHBondContact O-CD2 3.06Å; L268-F272 PolarHBondContact O-N 3.25Å; L268-V331 HydrophobicContact CB-CG1 4.39Å; L268-L365 HydrophobicContact CD1-CD2 3.48Å; L268-L365 VanDerWaalsContact CD1-CD2 3.48Å; L268-L365 HydrophobicContact CD1-CG 4.21Å; L268-L369 HydrophobicContact CD1-CD1 4.38Å; L268-L369 HydrophobicContact CD2-CD1 3.65Å |
| 269 | S | 74.7 | Confident | 78 | Confident | 9 Ų | 9 | 38.5 Ų | 38.5 | 6% | 0.063 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -57.1 | -38.9 | 177.7 | 75 | 0 | 0 | 0 | 0 | 112 | V265 S266 V267 N273 L274 | V265-S269 WeakPolarHBondContact O-CB 3.15Å; V265-S269 PolarHBondContact O-N 2.93Å; V265-S269 PolarHBondContact O-OG 2.91Å; S266-S269 PolarHBondContact O-N 3.48Å; S266-S269 PolarHBondContact O-OG 3.25Å; V267-S269 PolarHBondContact O-N 3.46Å; S269-N273 CarbonylContact O-C 3.54Å; S269-N273 PolarHBondContact O-N 3.12Å; S269-N273 VanDerWaalsContact O-N 3.12Å; S269-L274 WeakPolarHBondContact CB-O 3.23Å; S269-L274 PolarHBondContact O-N 3.3Å |
| 270 | R | 72.6 | Confident | 78.4 | Confident | 107 Ų | 107 | 39.5 Ų | 39.5 | 40% | 0.404 | 20% | 0.195 | S | C | . | . | H | α-helix | trans | -75.8 | -37.5 | 178.4 | -66.3 | 171.2 | -179.7 | 169 | -0.9 | 112.7 | L199 S266 V267 L268 F272 N273 | L199-R270 HydrophobicContact CD1-CB 3.3Å; L199-R270 HydrophobicContact CD1-CG 4.36Å; L199-R270 HydrophobicContact CD2-CB 4.16Å; L199-R270 HydrophobicContact CG-CB 4.37Å; S266-R270 WeakPolarHBondContact O-CG 3.42Å; S266-R270 PolarHBondContact O-N 2.71Å; S266-R270 VanDerWaalsContact O-N 3.11Å; V267-R270 PolarHBondContact O-N 3.27Å; L268-R270 PolarHBondContact O-N 3.35Å; R270-F272 VanDerWaalsContact C-N 3.32Å; R270-F272 PolarHBondContact O-N 3.44Å; R270-N273 PolarHBondContact O-N 3.05Å |
| 271 | I | 68.5 | Low | 78.9 | Confident | 26 Ų | 26 | 42.2 Ų | 42.2 | 13% | 0.133 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -60.3 | -45.1 | 176.2 | -70.3 | 169.2 | 0 | 0 | 0 | 110.5 | L199 L203 V267 L268 N273 | L199-I271 HydrophobicContact CB-CD1 4.08Å; L199-I271 HydrophobicContact CB-CG1 3.59Å; L199-I271 HydrophobicContact CD1-CG1 4.38Å; L203-I271 HydrophobicContact CB-CD1 3.97Å; L203-I271 HydrophobicContact CD2-CD1 3.71Å; L203-I271 HydrophobicContact CG-CD1 4.39Å; V267-I271 HydrophobicContact CG1-CD1 3.7Å; V267-I271 HydrophobicContact CG1-CG1 4.36Å; V267-I271 WeakPolarHBondContact O-CG1 3.4Å; V267-I271 PolarHBondContact O-N 3.45Å; L268-I271 PolarHBondContact O-N 3.44Å; I271-N273 VanDerWaalsContact C-N 3.29Å; I271-N273 PolarHBondContact O-N 3.2Å |
| 272 | F | 69.7 | Low | 79 | Confident | 67 Ų | 67 | 44.7 Ų | 44.7 | 29% | 0.294 | 22% | 0.215 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -87.5 | 6.7 | -179.3 | -66.6 | -70.1 | 0 | 0 | 0 | 113.6 | L268 R270 L274 I335 L369 | L268-F272 HydrophobicContact CD2-CE2 4.15Å; L268-F272 VanDerWaalsContact O-CD2 3.26Å; L268-F272 WeakPolarHBondContact O-CD2 3.06Å; L268-F272 PolarHBondContact O-N 3.25Å; R270-F272 VanDerWaalsContact C-N 3.32Å; R270-F272 PolarHBondContact O-N 3.44Å; F272-L274 HydrophobicContact CB-CD1 3.74Å; F272-L274 HydrophobicContact CB-CD2 4.41Å; F272-L274 HydrophobicContact CB-CG 3.63Å; F272-L274 PolarHBondContact O-N 3.36Å; F272-I335 HydrophobicContact CD1-CG1 4.17Å; F272-I335 HydrophobicContact CD2-CD1 3.66Å; F272-I335 HydrophobicContact CD2-CG1 3.88Å; F272-I335 HydrophobicContact CE1-CG1 4.35Å; F272-I335 HydrophobicContact CE1-CG2 4.41Å; F272-I335 HydrophobicContact CE2-CD1 3.6Å; F272-I335 HydrophobicContact CE2-CG1 4.09Å; F272-I335 HydrophobicContact CG-CD1 4.26Å; F272-I335 HydrophobicContact CG-CG1 3.95Å; F272-I335 HydrophobicContact CZ-CD1 4.15Å; F272-I335 HydrophobicContact CZ-CG1 4.34Å; F272-I335 HydrophobicContact CZ-CG2 4.49Å; F272-L369 HydrophobicContact CE1-CD2 4.44Å; F272-L369 HydrophobicContact CE2-CD1 4.12Å; F272-L369 HydrophobicContact CE2-CD2 3.86Å; F272-L369 HydrophobicContact CZ-CD1 4.48Å; F272-L369 HydrophobicContact CZ-CD2 3.43Å; F272-L369 VanDerWaalsContact CZ-CD2 3.43Å |
| 273 | N | 73.5 | Confident | 78.9 | Confident | 136 Ų | 136 | 48.1 Ų | 48.1 | 73% | 0.727 | 23% | 0.23 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 50.2 | 38.7 | -175.5 | -65.1 | -53.2 | 0 | 0 | 0 | 113.6 | S269 R270 I271 | S269-N273 CarbonylContact O-C 3.54Å; S269-N273 PolarHBondContact O-N 3.12Å; S269-N273 VanDerWaalsContact O-N 3.12Å; R270-N273 PolarHBondContact O-N 3.05Å; I271-N273 VanDerWaalsContact C-N 3.29Å; I271-N273 PolarHBondContact O-N 3.2Å |
| 274 | L | 74.7 | Confident | 78.8 | Confident | 18 Ų | 18 | 47.6 Ų | 47.6 | 9% | 0.094 | 24% | 0.239 | C | C | . | . | P | Polyproline II helix | trans | -94.4 | 117.4 | 179.9 | -56.8 | 179 | 0 | 0 | 0 | 110.3 | S269 F272 L276 V331 R334 I335 | S269-L274 WeakPolarHBondContact CB-O 3.23Å; S269-L274 PolarHBondContact O-N 3.3Å; F272-L274 HydrophobicContact CB-CD1 3.74Å; F272-L274 HydrophobicContact CB-CD2 4.41Å; F272-L274 HydrophobicContact CB-CG 3.63Å; F272-L274 PolarHBondContact O-N 3.36Å; L274-L276 PolarHBondContact O-N 2.69Å; L274-V331 HydrophobicContact CD1-CB 4.5Å; L274-V331 HydrophobicContact CD1-CG1 4.34Å; L274-V331 HydrophobicContact CD1-CG2 4.34Å; L274-R334 HydrophobicContact CD1-CB 3.57Å; L274-R334 HydrophobicContact CD1-CG 4.22Å; L274-R334 HydrophobicContact CD2-CB 3.52Å; L274-R334 HydrophobicContact CD2-CG 3.85Å; L274-R334 HydrophobicContact CG-CB 4.17Å; L274-I335 HydrophobicContact CD1-CG1 4.35Å |
| 275 | P | 81.3 | Confident | 78.7 | Confident | 93 Ų | 93 | 49.3 Ų | 49.3 | 60% | 0.604 | 25% | 0.251 | S | S | * | . | P | Polyproline II helix | trans | -69.4 | 118.4 | 168.8 | 28.1 | -32 | 0 | 0 | 0 | 109.3 | R277 Q330 | P275-R277 PolarHBondContact O-N 2.94Å; P275-Q330 PolarHBondContact O-NE2 3.07Å |
| 276 | L | 82.7 | Confident | 78.7 | Confident | 29 Ų | 29 | 55.5 Ų | 55.5 | 15% | 0.152 | 28% | 0.275 | C | S | . | . | P | Polyproline II helix | trans | -65.5 | 130.4 | 174.2 | -67.5 | 177.9 | 0 | 0 | 0 | 110 | V265 L274 Y278 V280 N327 V331 | V265-L276 HydrophobicContact CG1-CD1 4.36Å; V265-L276 HydrophobicContact CG1-CD2 4.14Å; L274-L276 PolarHBondContact O-N 2.69Å; L276-Y278 VanDerWaalsContact C-N 3.26Å; L276-Y278 PolarHBondContact O-N 2.92Å; L276-V280 HydrophobicContact CD1-CG2 4.06Å; L276-N327 HydrophobicContact CD2-CB 4.08Å; L276-V331 HydrophobicContact CD2-CG2 4Å |
| 277 | R | 85.5 | Confident | 78.9 | Confident | 135 Ų | 135 | 55.2 Ų | 55.2 | 51% | 0.509 | 27% | 0.273 | S | S | . | . | S | Bend | trans | -63.1 | -35.6 | 177.4 | -178.9 | 174 | -180 | 170.4 | 2.8 | 111.8 | P275 Y293 | P275-R277 PolarHBondContact O-N 2.94Å; R277-Y293 HydrophobicContact CG-CE2 3.63Å |
| 278 | Y | 89.7 | Confident | 79.4 | Confident | 10 Ų | 10 | 55.5 Ų | 55.5 | 4% | 0.039 | 28% | 0.275 | C | S | . | . | S | Bend | trans | -116.5 | 98.2 | 175.1 | -50 | -77.4 | 0 | 0 | 0 | 108.4 | L276 W290 D291 Y293 L323 K326 N327 | L276-Y278 VanDerWaalsContact C-N 3.26Å; L276-Y278 PolarHBondContact O-N 2.92Å; Y278-W290 CarbonylContact C-O 3.55Å; Y278-W290 WeakPolarHBondContact CA-O 3.26Å; Y278-D291 HydrophobicContact CD1-CB 4.42Å; Y278-Y293 HydrophobicContact CD1-CD2 4.46Å; Y278-Y293 AromaticContact CE1-CD2 3.96Å; Y278-Y293 HydrophobicContact CE1-CD2 3.96Å; Y278-Y293 HydrophobicContact CE1-CE2 4.4Å; Y278-L323 HydrophobicContact CD1-CD1 4.48Å; Y278-L323 HydrophobicContact CD1-CD2 3.78Å; Y278-L323 HydrophobicContact CD2-CD2 4.35Å; Y278-L323 HydrophobicContact CE1-CD2 3.7Å; Y278-L323 HydrophobicContact CE2-CD2 4.32Å; Y278-L323 HydrophobicContact CG-CB 4.3Å; Y278-L323 HydrophobicContact CG-CD2 4.09Å; Y278-K326 HydrophobicContact CD2-CB 4.03Å; Y278-K326 HydrophobicContact CE2-CB 3.6Å; Y278-K326 HydrophobicContact CE2-CD 3.65Å; Y278-K326 HydrophobicContact CE2-CG 4.29Å; Y278-K326 WeakPolarHBondContact OH-CD 3.41Å; Y278-N327 WeakPolarHBondContact CD2-OD1 3.45Å; Y278-N327 PolarHBondContact N-OD1 3.45Å; Y278-N327 VanDerWaalsContact N-OD1 3.07Å; Y278-N327 PolarHBondContact O-ND2 3.12Å; Y278-N327 PolarHBondContact O-OD1 2.82Å |
| 279 | P | 87.6 | Confident | 80.2 | Confident | 48 Ų | 48 | 55.5 Ų | 55.5 | 31% | 0.312 | 28% | 0.275 | S | S | . | . | trans | -59 | 143.5 | -175.5 | -26.8 | 37.2 | 0 | 0 | 0 | 112.4 | W290 | P279-W290 HydrophobicContact CB-CE3 3.95Å; P279-W290 WeakPolarHBondContact CD-O 3.09Å; P279-W290 HydrophobicContact CG-CE3 3.65Å; P279-W290 HydrophobicContact CG-CZ3 4.11Å; P279-W290 PolarHBondContact O-N 3.36Å | ||
| 280 | V | 86.3 | Confident | 80.9 | Confident | 23 Ų | 23 | 60.6 Ų | 60.6 | 14% | 0.139 | 29% | 0.293 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -109.3 | 126.4 | -176.2 | -178.4 | 0 | 0 | 0 | 0 | 109.6 | A262 L276 L282 V289 | A262-V280 HydrophobicContact CB-CG1 3.75Å; L276-V280 HydrophobicContact CD1-CG2 4.06Å; V280-L282 HydrophobicContact CG1-CD2 3.85Å; V280-V289 HydrophobicContact CG2-CG2 4.4Å |
| 281 | R | 84.1 | Confident | 81.6 | Confident | 121 Ų | 121 | 55.8 Ų | 55.8 | 46% | 0.457 | 28% | 0.276 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -94.8 | 115 | 172.5 | -165.8 | -179.7 | -68.2 | 174 | -8.5 | 109.7 | F283 S287 A288 | R281-F283 HydrophobicContact CG-CD2 3.87Å; R281-F283 HydrophobicContact CG-CE2 3.54Å; R281-F283 HydrophobicContact CG-CZ 4.14Å; R281-S287 WeakPolarHBondContact O-CA 3.45Å; R281-S287 WeakPolarHBondContact O-CB 3.41Å; R281-A288 PolarHBondContact N-O 2.87Å; R281-A288 PolarHBondContact O-N 3.13Å |
| 282 | L | 81.2 | Confident | 82.3 | Confident | 51 Ų | 51 | 57 Ų | 57 | 27% | 0.267 | 29% | 0.285 | S | S | . | . | trans | -89.7 | 115.6 | -173.8 | -60.1 | 172.6 | 0 | 0 | 0 | 110.8 | A262 H263 V280 | A262-L282 HydrophobicContact CB-CD2 4.17Å; H263-L282 HydrophobicContact CB-CD2 4.15Å; V280-L282 HydrophobicContact CG1-CD2 3.85Å | ||
| 283 | F | 81.7 | Confident | 83 | Confident | 72 Ų | 72 | 60.4 Ų | 60.4 | 32% | 0.316 | 30% | 0.297 | S | S | . | . | trans | -139.2 | 38.6 | 174.9 | -71.4 | -57.9 | 0 | 0 | 0 | 111.7 | R281 S285 R286 S287 | R281-F283 HydrophobicContact CG-CD2 3.87Å; R281-F283 HydrophobicContact CG-CE2 3.54Å; R281-F283 HydrophobicContact CG-CZ 4.14Å; F283-S285 PolarHBondContact O-N 3.39Å; F283-R286 HydrophobicContact CB-CB 4.08Å; F283-R286 PolarHBondContact O-N 2.9Å; F283-S287 PolarHBondContact N-OG 3.49Å | ||
| 284 | G | 76.6 | Confident | 83.1 | Confident | 41 Ų | 41 | 57.6 Ų | 57.6 | 42% | 0.423 | 28% | 0.28 | S | S | . | . | G | 310 helix | trans | 58.9 | -126.1 | -176.1 | 0 | 0 | 0 | 0 | 0 | 110.9 | G259 R286 S287 | G259-G284 VanDerWaalsContact CA-O 3.24Å; G259-G284 WeakPolarHBondContact CA-O 3.31Å; G284-R286 PolarHBondContact O-N 3.46Å; G284-R286 VanDerWaalsContact O-N 3.09Å; G284-S287 PolarHBondContact N-OG 3.01Å; G284-S287 WeakPolarHBondContact O-CB 3.5Å; G284-S287 PolarHBondContact O-N 2.98Å; G284-S287 PolarHBondContact O-OG 3.09Å |
| 285 | S | 75 | Confident | 82.7 | Confident | 39 Ų | 39 | 68.6 Ų | 68.6 | 27% | 0.273 | 32% | 0.32 | S | S | . | . | G | 310 helix | trans | -63.7 | -10.6 | 176.5 | 60.7 | 0 | 0 | 0 | 0 | 114.5 | S255 T256 F283 F308 | S255-S285 WeakPolarHBondContact CB-O 3.24Å; T256-S285 WeakPolarHBondContact OG1-CB 3.42Å; F283-S285 PolarHBondContact O-N 3.39Å; S285-F308 WeakPolarHBondContact O-CB 3.45Å |
| 286 | R | 80.9 | Confident | 81.7 | Confident | 131 Ų | 131 | 66.2 Ų | 66.2 | 49% | 0.494 | 31% | 0.306 | S | S | . | . | G | 310 helix | trans | -107.6 | 22.3 | 177.4 | -57.4 | -173.3 | -59.5 | 168.6 | 3.9 | 113.4 | F283 G284 F308 | F283-R286 HydrophobicContact CB-CB 4.08Å; F283-R286 PolarHBondContact O-N 2.9Å; G284-R286 PolarHBondContact O-N 3.46Å; G284-R286 VanDerWaalsContact O-N 3.09Å; R286-F308 HydrophobicContact CB-CD1 4.21Å; R286-F308 HydrophobicContact CB-CE1 4.09Å; R286-F308 WeakPolarHBondContact O-CE1 3.34Å |
| 287 | S | 83.8 | Confident | 80.7 | Confident | 1 Ų | 1 | 74.6 Ų | 74.6 | 1% | 0.007 | 34% | 0.344 | C | S | . | . | trans | -62.9 | 153.6 | -179.4 | -61.2 | 0 | 0 | 0 | 0 | 111.8 | R281 F283 G284 L307 | R281-S287 WeakPolarHBondContact O-CA 3.45Å; R281-S287 WeakPolarHBondContact O-CB 3.41Å; F283-S287 PolarHBondContact N-OG 3.49Å; G284-S287 PolarHBondContact N-OG 3.01Å; G284-S287 WeakPolarHBondContact O-CB 3.5Å; G284-S287 PolarHBondContact O-N 2.98Å; G284-S287 PolarHBondContact O-OG 3.09Å; S287-L307 WeakPolarHBondContact O-CB 3.5Å; S287-L307 PolarHBondContact O-N 3.46Å | ||
| 288 | A | 85.5 | Confident | 79.4 | Confident | 8 Ų | 8 | 71.4 Ų | 71.4 | 7% | 0.066 | 34% | 0.343 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -144.6 | 154.6 | -177.6 | 0 | 0 | 0 | 0 | 0 | 111.3 | R281 I304 F305 | R281-A288 PolarHBondContact N-O 2.87Å; R281-A288 PolarHBondContact O-N 3.13Å; A288-I304 HydrophobicContact CB-CG2 3.67Å; A288-F305 CarbonylContact C-O 3.57Å; A288-F305 VanDerWaalsContact CA-O 3.26Å; A288-F305 WeakPolarHBondContact CA-O 3.26Å; A288-F305 WeakPolarHBondContact CB-O 3.45Å |
| 289 | V | 88.9 | Confident | 78 | Confident | 1 Ų | 1 | 73.1 Ų | 73.1 | 1% | 0.006 | 36% | 0.363 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -111.1 | 138.9 | 177.9 | -173.8 | 0 | 0 | 0 | 0 | 109.4 | V280 F305 L307 L323 L324 | V280-V289 HydrophobicContact CG2-CG2 4.4Å; V289-F305 PolarHBondContact N-O 3.22Å; V289-F305 PolarHBondContact O-N 3.44Å; V289-L307 HydrophobicContact CG2-CD1 3.92Å; V289-L307 HydrophobicContact CG2-CD2 3.92Å; V289-L307 HydrophobicContact CG2-CG 4.02Å; V289-L323 HydrophobicContact CB-CB 4.37Å; V289-L323 HydrophobicContact CG1-CB 3.72Å; V289-L323 HydrophobicContact CG1-CD1 4.11Å; V289-L324 HydrophobicContact CG2-CB 4.26Å |
| 290 | W | 88.7 | Confident | 76.6 | Confident | 115 Ų | 115 | 76.2 Ų | 76.2 | 44% | 0.436 | 38% | 0.383 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -103 | 129 | 178.7 | -180 | 42.3 | 0 | 0 | 0 | 110.8 | Y278 P279 P292 H303 | Y278-W290 CarbonylContact C-O 3.55Å; Y278-W290 WeakPolarHBondContact CA-O 3.26Å; P279-W290 HydrophobicContact CB-CE3 3.95Å; P279-W290 WeakPolarHBondContact CD-O 3.09Å; P279-W290 HydrophobicContact CG-CE3 3.65Å; P279-W290 HydrophobicContact CG-CZ3 4.11Å; P279-W290 PolarHBondContact O-N 3.36Å; W290-P292 HydrophobicContact CH2-CB 4.11Å; W290-P292 HydrophobicContact CZ2-CB 3.97Å; W290-P292 WeakPolarHBondContact O-CD 3.37Å; W290-H303 CarbonylContact C-O 3.54Å; W290-H303 WeakPolarHBondContact CA-O 3.49Å; W290-H303 AromaticContact NE1-CG 3.98Å |
| 291 | D | 88.9 | Confident | 75.2 | Confident | 7 Ų | 7 | 82 Ų | 82 | 4% | 0.037 | 40% | 0.402 | C | S | . | . | trans | -102.6 | 99.7 | 170.5 | -171.9 | 5.2 | 0 | 0 | 0 | 112 | Y278 Y293 M294 H303 F305 Y319 L323 | Y278-D291 HydrophobicContact CD1-CB 4.42Å; D291-Y293 PolarHBondContact O-N 3.22Å; D291-Y293 WeakPolarHBondContact OD1-CB 3.31Å; D291-Y293 PolarHBondContact OD1-N 3.5Å; D291-M294 HydrophobicContact CB-CB 4.39Å; D291-H303 PolarHBondContact N-O 3.01Å; D291-H303 WeakPolarHBondContact O-CB 3.29Å; D291-H303 PolarHBondContact O-ND1 3.02Å; D291-F305 HydrophobicContact CB-CD2 4.31Å; D291-F305 HydrophobicContact CB-CE2 3.78Å; D291-Y319 PolarHBondContact OD2-OH 3.13Å; D291-Y319 VanDerWaalsContact OD2-OH 3.06Å; D291-L323 HydrophobicContact CB-CD1 3.86Å | ||
| 292 | P | 83.2 | Confident | 74.3 | Confident | 50 Ų | 50 | 77.6 Ų | 77.6 | 33% | 0.325 | 39% | 0.393 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -71.9 | -9.4 | 176.9 | 30.8 | -34.7 | 0 | 0 | 0 | 113.5 | W290 | W290-P292 HydrophobicContact CH2-CB 4.11Å; W290-P292 HydrophobicContact CZ2-CB 3.97Å; W290-P292 WeakPolarHBondContact O-CD 3.37Å |
| 293 | Y | 82.6 | Confident | 74.4 | Confident | 140 Ų | 140 | 76.6 Ų | 76.6 | 55% | 0.549 | 39% | 0.386 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -101.3 | -8 | -174.9 | -54.3 | -74 | 0 | 0 | 0 | 114.1 | R277 Y278 D291 R295 | R277-Y293 HydrophobicContact CG-CE2 3.63Å; Y278-Y293 HydrophobicContact CD1-CD2 4.46Å; Y278-Y293 AromaticContact CE1-CD2 3.96Å; Y278-Y293 HydrophobicContact CE1-CD2 3.96Å; Y278-Y293 HydrophobicContact CE1-CE2 4.4Å; D291-Y293 PolarHBondContact O-N 3.22Å; D291-Y293 WeakPolarHBondContact OD1-CB 3.31Å; D291-Y293 PolarHBondContact OD1-N 3.5Å; Y293-R295 PolarHBondContact O-N 2.99Å |
| 294 | M | 77.2 | Confident | 74.5 | Confident | 76 Ų | 76 | 75.3 Ų | 75.3 | 37% | 0.374 | 38% | 0.382 | S | S | . | . | trans | -63.4 | 126.1 | 177.5 | -161.9 | -177.4 | -163.2 | 0 | 0 | 109.8 | D291 S296 H303 F305 | D291-M294 HydrophobicContact CB-CB 4.39Å; M294-S296 PolarHBondContact O-N 3.01Å; M294-H303 PolarHBondContact O-CE1 2.83Å; M294-F305 HydrophobicContact CE-CZ 4.27Å; M294-F305 HydrophobicContact SD-CE2 4.34Å; M294-F305 HydrophobicContact SD-CZ 3.61Å | ||
| 295 | R | 64.9 | Low | 75.1 | Confident | 250 Ų | 250 | 73.9 Ų | 73.9 | 94% | 0.943 | 36% | 0.364 | S | S | * | . | trans | -86.4 | 80.8 | 173 | -64.5 | -177.6 | -178.6 | -151 | 0.5 | 108.4 | Y293 | Y293-R295 PolarHBondContact O-N 2.99Š| ||
| 296 | S | 61.9 | Low | 75.7 | Confident | 42 Ų | 42 | 72.9 Ų | 72.9 | 29% | 0.294 | 36% | 0.357 | S | S | . | . | trans | -117.6 | 132.5 | 172 | -168.2 | 0 | 0 | 0 | 0 | 109.5 | M294 S298 | M294-S296 PolarHBondContact O-N 3.01Å; S296-S298 VanDerWaalsContact C-N 3.27Å; S296-S298 PolarHBondContact OG-OG 2.85Å | ||
| 297 | E | 61.4 | Low | 76 | Confident | 205 Ų | 205 | 66.7 Ų | 66.7 | 96% | 0.958 | 33% | 0.334 | S | S | * | . | S | Bend | trans | -77.3 | -17.2 | 174.4 | -68.3 | 177.6 | 173.2 | 0 | 0 | 112.1 | ||
| 298 | S | 56.8 | Low | 75.9 | Confident | 69 Ų | 69 | 68.1 Ų | 68.1 | 48% | 0.483 | 34% | 0.34 | S | S | . | . | S | Bend | trans | -73.1 | 127.4 | 169.7 | 57.5 | 0 | 0 | 0 | 0 | 108.8 | S296 A302 | S296-S298 VanDerWaalsContact C-N 3.27Å; S296-S298 PolarHBondContact OG-OG 2.85Å; S298-A302 WeakPolarHBondContact O-CB 3.21Å; S298-A302 WeakPolarHBondContact OG-CB 3.29Å |
| 299 | G | 60.3 | Low | 75.5 | Confident | 46 Ų | 46 | 69 Ų | 69 | 47% | 0.474 | 35% | 0.345 | S | S | . | . | trans | -56.7 | -165.6 | -162.5 | 0 | 0 | 0 | 0 | 0 | 118.3 | R301 A302 | G299-R301 PolarHBondContact O-N 3.14Å; G299-A302 WeakPolarHBondContact O-CB 3.42Å; G299-A302 PolarHBondContact O-N 3.21Å | ||
| 300 | P | 58.9 | Low | 74.7 | Confident | 112 Ų | 112 | 75.2 Ų | 75.2 | 73% | 0.727 | 37% | 0.369 | S | S | * | . | G | 310 helix | trans | -57.7 | -19.5 | -162 | 20 | -32.5 | 0 | 0 | 0 | 116.2 | ||
| 301 | R | 57.3 | Low | 73.3 | Confident | 144 Ų | 144 | 78.8 Ų | 78.8 | 54% | 0.543 | 39% | 0.39 | S | S | . | . | G | 310 helix | trans | -72.9 | -26.9 | 174.1 | -75 | -174.8 | 173 | 139.9 | 10.7 | 114.1 | G299 H303 I304 E453 | G299-R301 PolarHBondContact O-N 3.14Å; R301-H303 PolarHBondContact O-N 2.69Å; R301-I304 PolarHBondContact O-N 3.07Å; R301-I304 VanDerWaalsContact O-N 3.08Å; R301-E453 IonicContact CZ-OE2 3.24Å; R301-E453 PolarHBondContact NH1-O 2.84Å; R301-E453 VanDerWaalsContact NH2-CB 3.33Å; R301-E453 IonicContact NH2-OE2 3.34Å; R301-E453 PolarHBondContact NH2-OE2 3.14Å |
| 302 | A | 65.6 | Low | 71.8 | Confident | 30 Ų | 30 | 87.1 Ų | 87.1 | 25% | 0.248 | 43% | 0.428 | C | S | . | . | G | 310 helix | trans | -64.6 | -11.2 | -179.6 | 0 | 0 | 0 | 0 | 0 | 113.4 | S298 G299 | S298-A302 WeakPolarHBondContact O-CB 3.21Å; S298-A302 WeakPolarHBondContact OG-CB 3.29Å; G299-A302 WeakPolarHBondContact O-CB 3.42Å; G299-A302 PolarHBondContact O-N 3.21Å |
| 303 | H | 81.8 | Confident | 71.4 | Confident | 30 Ų | 30 | 87.5 Ų | 87.5 | 14% | 0.139 | 43% | 0.428 | C | S | . | . | G | 310 helix | trans | -95.5 | -5.4 | -180 | -59.5 | -93.9 | 0 | 0 | 0 | 113.3 | W290 D291 M294 R301 F305 | W290-H303 CarbonylContact C-O 3.54Å; W290-H303 WeakPolarHBondContact CA-O 3.49Å; W290-H303 AromaticContact NE1-CG 3.98Å; D291-H303 PolarHBondContact N-O 3.01Å; D291-H303 WeakPolarHBondContact O-CB 3.29Å; D291-H303 PolarHBondContact O-ND1 3.02Å; M294-H303 PolarHBondContact O-CE1 2.83Å; R301-H303 PolarHBondContact O-N 2.69Å; H303-F305 VanDerWaalsContact O-CD2 3.32Å; H303-F305 WeakPolarHBondContact O-CD2 3.31Å; H303-F305 VanDerWaalsContact O-CE2 3.31Å; H303-F305 WeakPolarHBondContact O-CE2 3.34Å |
| 304 | I | 85.4 | Confident | 71.3 | Confident | 44 Ų | 44 | 86.1 Ų | 86.1 | 23% | 0.226 | 43% | 0.425 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -100.4 | 118.9 | -175.2 | -57.9 | 174.9 | 0 | 0 | 0 | 109.6 | A288 R301 | A288-I304 HydrophobicContact CB-CG2 3.67Å; R301-I304 PolarHBondContact O-N 3.07Å; R301-I304 VanDerWaalsContact O-N 3.08Å |
| 305 | F | 88.8 | Confident | 71.6 | Confident | 11 Ų | 11 | 89 Ų | 89 | 5% | 0.048 | 44% | 0.441 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -110.4 | 116 | -176.7 | -62 | -78.5 | 0 | 0 | 0 | 110.8 | A288 V289 D291 M294 H303 M316 Y319 L323 | A288-F305 CarbonylContact C-O 3.57Å; A288-F305 VanDerWaalsContact CA-O 3.26Å; A288-F305 WeakPolarHBondContact CA-O 3.26Å; A288-F305 WeakPolarHBondContact CB-O 3.45Å; V289-F305 PolarHBondContact N-O 3.22Å; V289-F305 PolarHBondContact O-N 3.44Å; D291-F305 HydrophobicContact CB-CD2 4.31Å; D291-F305 HydrophobicContact CB-CE2 3.78Å; M294-F305 HydrophobicContact CE-CZ 4.27Å; M294-F305 HydrophobicContact SD-CE2 4.34Å; M294-F305 HydrophobicContact SD-CZ 3.61Å; H303-F305 VanDerWaalsContact O-CD2 3.32Å; H303-F305 WeakPolarHBondContact O-CD2 3.31Å; H303-F305 VanDerWaalsContact O-CE2 3.31Å; H303-F305 WeakPolarHBondContact O-CE2 3.34Å; F305-M316 HydrophobicContact CD1-CB 4.09Å; F305-M316 HydrophobicContact CD1-CG 4.45Å; F305-Y319 AromaticContact CD1-CD1 3.52Å; F305-Y319 HydrophobicContact CD1-CD1 3.52Å; F305-Y319 HydrophobicContact CD1-CE1 4.34Å; F305-Y319 HydrophobicContact CD1-CG 4.4Å; F305-Y319 AromaticContact CD2-CD1 3.79Å; F305-Y319 HydrophobicContact CD2-CD1 3.79Å; F305-Y319 AromaticContact CD2-CE1 3.95Å; F305-Y319 HydrophobicContact CD2-CE1 3.95Å; F305-Y319 AromaticContact CE1-CD1 3.42Å; F305-Y319 HydrophobicContact CE1-CD1 3.42Å; F305-Y319 VanDerWaalsContact CE1-CD1 3.42Å; F305-Y319 AromaticContact CE1-CE1 3.94Å; F305-Y319 HydrophobicContact CE1-CE1 3.94Å; F305-Y319 HydrophobicContact CE1-CG 4.37Å; F305-Y319 AromaticContact CE2-CD1 3.71Å; F305-Y319 HydrophobicContact CE2-CD1 3.71Å; F305-Y319 AromaticContact CE2-CE1 3.53Å; F305-Y319 HydrophobicContact CE2-CE1 3.53Å; F305-Y319 AromaticContact CG-CD1 3.69Å; F305-Y319 HydrophobicContact CG-CD1 3.69Å; F305-Y319 HydrophobicContact CG-CE1 4.33Å; F305-Y319 AromaticContact CZ-CD1 3.51Å; F305-Y319 HydrophobicContact CZ-CD1 3.51Å; F305-Y319 AromaticContact CZ-CE1 3.52Å; F305-Y319 HydrophobicContact CZ-CE1 3.52Å; F305-L323 HydrophobicContact CD2-CD1 3.71Å; F305-L323 HydrophobicContact CE2-CD1 4.24Å; F305-L323 HydrophobicContact CG-CD1 4.39Å |
| 306 | P | 87.7 | Confident | 72.6 | Confident | 18 Ų | 18 | 81.4 Ų | 81.4 | 12% | 0.117 | 42% | 0.417 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -69.7 | 139.4 | -177.8 | 28.9 | -34 | 0 | 0 | 0 | 111.5 | F308 F317 | P306-F308 HydrophobicContact CB-CD1 3.69Å; P306-F308 HydrophobicContact CB-CD2 4.32Å; P306-F308 HydrophobicContact CB-CE1 3.39Å; P306-F308 HydrophobicContact CB-CE2 4.04Å; P306-F308 HydrophobicContact CB-CG 4.16Å; P306-F308 HydrophobicContact CB-CZ 3.59Å; P306-F308 PolarHBondContact O-N 3.3Å; P306-F317 WeakPolarHBondContact O-CA 3.35Å |
| 307 | L | 85.6 | Confident | 73.7 | Confident | 1 Ų | 1 | 79.9 Ų | 79.9 | 1% | 0.005 | 41% | 0.405 | C | S | . | . | S | Bend | trans | -90.6 | 19.1 | 169.9 | -61.8 | 175.1 | 0 | 0 | 0 | 112.2 | L258 A262 S287 V289 F317 G320 V321 L324 | L258-L307 HydrophobicContact CB-CB 4.26Å; L258-L307 WeakPolarHBondContact CD1-O 3.36Å; A262-L307 HydrophobicContact CB-CD1 3.78Å; S287-L307 WeakPolarHBondContact O-CB 3.5Å; S287-L307 PolarHBondContact O-N 3.46Å; V289-L307 HydrophobicContact CG2-CD1 3.92Å; V289-L307 HydrophobicContact CG2-CD2 3.92Å; V289-L307 HydrophobicContact CG2-CG 4.02Å; L307-F317 WeakPolarHBondContact O-CE2 3.24Å; L307-G320 VanDerWaalsContact CD2-C 3.48Å; L307-G320 WeakPolarHBondContact CD2-O 3.26Å; L307-V321 HydrophobicContact CD2-CG2 4.27Å; L307-L324 HydrophobicContact CD1-CD2 4.04Å; L307-L324 HydrophobicContact CD2-CB 4.35Å; L307-L324 HydrophobicContact CD2-CD2 4.32Å |
| 308 | F | 83.5 | Confident | 74.8 | Confident | 32 Ų | 32 | 74.3 Ų | 74.3 | 14% | 0.14 | 38% | 0.379 | C | S | . | . | S | Bend | trans | -127.5 | 140.5 | 176.3 | 58.5 | -87.7 | 0 | 0 | 0 | 109.3 | S255 S285 R286 P306 R310 | S255-F308 VanDerWaalsContact OG-CA 3.25Å; S255-F308 WeakPolarHBondContact OG-CA 3.33Å; S255-F308 VanDerWaalsContact OG-CB 3.31Å; S255-F308 WeakPolarHBondContact OG-CB 3.44Å; S285-F308 WeakPolarHBondContact O-CB 3.45Å; R286-F308 HydrophobicContact CB-CD1 4.21Å; R286-F308 HydrophobicContact CB-CE1 4.09Å; R286-F308 WeakPolarHBondContact O-CE1 3.34Å; P306-F308 HydrophobicContact CB-CD1 3.69Å; P306-F308 HydrophobicContact CB-CD2 4.32Å; P306-F308 HydrophobicContact CB-CE1 3.39Å; P306-F308 HydrophobicContact CB-CE2 4.04Å; P306-F308 HydrophobicContact CB-CG 4.16Å; P306-F308 HydrophobicContact CB-CZ 3.59Å; P306-F308 PolarHBondContact O-N 3.3Å; F308-R310 HydrophobicContact CD2-CG 4.14Å; F308-R310 HydrophobicContact CE2-CG 3.94Å; F308-R310 PolarHBondContact O-N 3.04Å |
| 309 | S | 75.3 | Confident | 76.3 | Confident | 25 Ų | 25 | 74.7 Ų | 74.7 | 18% | 0.175 | 37% | 0.371 | C | S | . | . | trans | -82.7 | 116.1 | -179.9 | 22.9 | 0 | 0 | 0 | 0 | 109.7 | H251 | H251-S309 WeakPolarHBondContact CB-OG 3.35Å; H251-S309 WeakPolarHBondContact ND1-CB 3.45Å; H251-S309 PolarHBondContact ND1-OG 2.98Å | ||
| 310 | R | 72.1 | Confident | 77.6 | Confident | 133 Ų | 133 | 72.5 Ų | 72.5 | 50% | 0.502 | 35% | 0.348 | S | S | . | . | trans | -96.3 | 152.9 | 156.7 | -77.2 | -176 | 176.4 | 138.9 | -3.8 | 108.7 | F308 Q312 D313 | F308-R310 HydrophobicContact CD2-CG 4.14Å; F308-R310 HydrophobicContact CE2-CG 3.94Å; F308-R310 PolarHBondContact O-N 3.04Å; R310-Q312 PolarHBondContact O-N 3.44Å; R310-D313 PolarHBondContact O-N 3.34Å | ||
| 311 | H | 60.1 | Low | 78.9 | Confident | 189 Ų | 189 | 67.3 Ų | 67.3 | 88% | 0.875 | 32% | 0.315 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -59.1 | -22.8 | -175.5 | -65.7 | 36.9 | 0 | 0 | 0 | 112.8 | ||
| 312 | Q | 58 | Low | 80.3 | Confident | 182 Ų | 182 | 64.1 Ų | 64.1 | 85% | 0.85 | 31% | 0.305 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -98.2 | -15.6 | -174.7 | -69.8 | 176.8 | 3.1 | 0 | 0 | 115.1 | R310 | R310-Q312 PolarHBondContact O-N 3.44Š|
| 313 | D | 74.3 | Confident | 81.4 | Confident | 59 Ų | 59 | 62.7 Ų | 62.7 | 32% | 0.316 | 29% | 0.293 | S | S | . | . | trans | -124.2 | 44 | -167.3 | -63.1 | -38.6 | 0 | 0 | 0 | 114.3 | R310 L315 M316 F317 | R310-D313 PolarHBondContact O-N 3.34Å; D313-L315 VanDerWaalsContact C-N 3.32Å; D313-L315 PolarHBondContact O-N 2.89Å; D313-M316 HydrophobicContact CB-CB 4.22Å; D313-M316 HydrophobicContact CB-CG 4.42Å; D313-M316 HydrophobicContact CB-SD 4.42Å; D313-M316 PolarHBondContact O-N 3.13Å; D313-F317 PolarHBondContact O-N 3.1Å | ||
| 314 | K | 81.1 | Confident | 81.6 | Confident | 110 Ų | 110 | 61.2 Ų | 61.2 | 48% | 0.478 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -56.2 | -43.2 | -178.4 | -174.8 | -178.7 | 169.4 | -167.2 | 0 | 112.9 | F317 E318 | K314-F317 WeakPolarHBondContact O-CB 3.46Å; K314-F317 PolarHBondContact O-N 2.99Å; K314-E318 WeakPolarHBondContact CE-OE1 3.48Å; K314-E318 IonicContact NZ-OE1 2.88Å; K314-E318 WeakPolarHBondContact O-CG 3.37Å; K314-E318 PolarHBondContact O-N 3.04Å |
| 315 | L | 82.7 | Confident | 81.6 | Confident | 138 Ų | 138 | 59.2 Ų | 59.2 | 72% | 0.723 | 28% | 0.276 | S | S | * | . | H | α-helix | trans | -66 | -40.1 | -179.5 | -68.1 | 173.7 | 0 | 0 | 0 | 112.5 | D313 F317 E318 Y319 | D313-L315 VanDerWaalsContact C-N 3.32Å; D313-L315 PolarHBondContact O-N 2.89Å; L315-F317 VanDerWaalsContact C-N 3.32Å; L315-E318 PolarHBondContact O-N 3.23Å; L315-Y319 WeakPolarHBondContact O-CB 3.44Å; L315-Y319 PolarHBondContact O-N 3.32Å |
| 316 | M | 85.2 | Confident | 81.4 | Confident | 90 Ų | 90 | 62 Ų | 62 | 44% | 0.443 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -67.2 | -37.5 | 176.8 | -63.5 | -169.1 | 179.6 | 0 | 0 | 111.4 | F305 D313 G320 | F305-M316 HydrophobicContact CD1-CB 4.09Å; F305-M316 HydrophobicContact CD1-CG 4.45Å; D313-M316 HydrophobicContact CB-CB 4.22Å; D313-M316 HydrophobicContact CB-CG 4.42Å; D313-M316 HydrophobicContact CB-SD 4.42Å; D313-M316 PolarHBondContact O-N 3.13Å; M316-G320 PolarHBondContact O-N 2.91Å |
| 317 | F | 86.1 | Confident | 81.3 | Confident | 10 Ų | 10 | 61.2 Ų | 61.2 | 4% | 0.044 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -63 | -50 | 174.2 | 167.9 | -103.5 | 0 | 0 | 0 | 112 | Y246 V254 L258 P306 L307 D313 K314 L315 Y319 G320 V321 | Y246-F317 AromaticContact CD2-CE1 3.65Å; Y246-F317 HydrophobicContact CD2-CE1 3.65Å; Y246-F317 AromaticContact CD2-CZ 3.66Å; Y246-F317 HydrophobicContact CD2-CZ 3.66Å; Y246-F317 HydrophobicContact CE2-CE1 4.39Å; Y246-F317 HydrophobicContact CE2-CZ 4.1Å; Y246-F317 HydrophobicContact CG-CE1 4.4Å; Y246-F317 HydrophobicContact CG-CZ 4.37Å; V254-F317 HydrophobicContact CG1-CZ 4.17Å; L258-F317 HydrophobicContact CD1-CE2 3.61Å; L258-F317 HydrophobicContact CD1-CZ 3.79Å; P306-F317 WeakPolarHBondContact O-CA 3.35Å; L307-F317 WeakPolarHBondContact O-CE2 3.24Å; D313-F317 PolarHBondContact O-N 3.1Å; K314-F317 WeakPolarHBondContact O-CB 3.46Å; K314-F317 PolarHBondContact O-N 2.99Å; L315-F317 VanDerWaalsContact C-N 3.32Å; F317-Y319 VanDerWaalsContact C-N 3.29Å; F317-Y319 PolarHBondContact O-N 3.29Å; F317-G320 PolarHBondContact O-N 3.21Å; F317-G320 VanDerWaalsContact O-N 3.16Å; F317-V321 HydrophobicContact CD2-CG2 4.41Å; F317-V321 HydrophobicContact CE1-CG2 4.43Å; F317-V321 HydrophobicContact CE2-CG2 3.98Å; F317-V321 HydrophobicContact CZ-CG2 3.99Å; F317-V321 WeakPolarHBondContact O-CG2 3.38Å; F317-V321 PolarHBondContact O-N 2.98Å |
| 318 | E | 84.7 | Confident | 81.2 | Confident | 87 Ų | 87 | 61.2 Ų | 61.2 | 41% | 0.407 | 28% | 0.282 | S | S | . | . | H | α-helix | trans | -59.5 | -40.9 | 177.1 | -74 | 176.4 | 174.4 | 0 | 0 | 111.7 | K314 L315 V321 F322 | K314-E318 WeakPolarHBondContact CE-OE1 3.48Å; K314-E318 IonicContact NZ-OE1 2.88Å; K314-E318 WeakPolarHBondContact O-CG 3.37Å; K314-E318 PolarHBondContact O-N 3.04Å; L315-E318 PolarHBondContact O-N 3.23Å; E318-V321 PolarHBondContact O-N 3.3Å; E318-F322 PolarHBondContact O-N 3.47Å |
| 319 | Y | 86.8 | Confident | 81 | Confident | 77 Ų | 77 | 60.9 Ų | 60.9 | 30% | 0.302 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -65.8 | -41.7 | 174.7 | -169.7 | -108.4 | 0 | 0 | 0 | 112.5 | D291 F305 L315 F317 V321 F322 L323 | D291-Y319 PolarHBondContact OD2-OH 3.13Å; D291-Y319 VanDerWaalsContact OD2-OH 3.06Å; F305-Y319 AromaticContact CD1-CD1 3.52Å; F305-Y319 HydrophobicContact CD1-CD1 3.52Å; F305-Y319 HydrophobicContact CD1-CE1 4.34Å; F305-Y319 HydrophobicContact CD1-CG 4.4Å; F305-Y319 AromaticContact CD2-CD1 3.79Å; F305-Y319 HydrophobicContact CD2-CD1 3.79Å; F305-Y319 AromaticContact CD2-CE1 3.95Å; F305-Y319 HydrophobicContact CD2-CE1 3.95Å; F305-Y319 AromaticContact CE1-CD1 3.42Å; F305-Y319 HydrophobicContact CE1-CD1 3.42Å; F305-Y319 VanDerWaalsContact CE1-CD1 3.42Å; F305-Y319 AromaticContact CE1-CE1 3.94Å; F305-Y319 HydrophobicContact CE1-CE1 3.94Å; F305-Y319 HydrophobicContact CE1-CG 4.37Å; F305-Y319 AromaticContact CE2-CD1 3.71Å; F305-Y319 HydrophobicContact CE2-CD1 3.71Å; F305-Y319 AromaticContact CE2-CE1 3.53Å; F305-Y319 HydrophobicContact CE2-CE1 3.53Å; F305-Y319 AromaticContact CG-CD1 3.69Å; F305-Y319 HydrophobicContact CG-CD1 3.69Å; F305-Y319 HydrophobicContact CG-CE1 4.33Å; F305-Y319 AromaticContact CZ-CD1 3.51Å; F305-Y319 HydrophobicContact CZ-CD1 3.51Å; F305-Y319 AromaticContact CZ-CE1 3.52Å; F305-Y319 HydrophobicContact CZ-CE1 3.52Å; L315-Y319 WeakPolarHBondContact O-CB 3.44Å; L315-Y319 PolarHBondContact O-N 3.32Å; F317-Y319 VanDerWaalsContact C-N 3.29Å; F317-Y319 PolarHBondContact O-N 3.29Å; Y319-V321 VanDerWaalsContact C-N 3.33Å; Y319-V321 PolarHBondContact O-N 3.34Å; Y319-F322 HydrophobicContact CD2-CD1 4.17Å; Y319-F322 HydrophobicContact CE2-CD1 4.09Å; Y319-F322 HydrophobicContact CE2-CE1 4.36Å; Y319-F322 WeakPolarHBondContact O-CB 3.46Å; Y319-F322 PolarHBondContact O-N 3.07Å; Y319-F322 VanDerWaalsContact O-N 3.15Å; Y319-L323 HydrophobicContact CD1-CD1 3.93Å; Y319-L323 HydrophobicContact CD1-CG 4.17Å; Y319-L323 HydrophobicContact CE1-CD1 3.61Å; Y319-L323 HydrophobicContact CE1-CD2 4.08Å; Y319-L323 HydrophobicContact CE1-CG 3.91Å; Y319-L323 HydrophobicContact CE2-CD2 4.49Å; Y319-L323 WeakPolarHBondContact O-CG 3.33Å; Y319-L323 PolarHBondContact O-N 3.44Å |
| 320 | G | 88.7 | Confident | 81.3 | Confident | 0 Ų | 0 | 61.4 Ų | 61.4 | 0% | 0 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -59 | -43 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | L307 M316 F317 L323 L324 | L307-G320 VanDerWaalsContact CD2-C 3.48Å; L307-G320 WeakPolarHBondContact CD2-O 3.26Å; M316-G320 PolarHBondContact O-N 2.91Å; F317-G320 PolarHBondContact O-N 3.21Å; F317-G320 VanDerWaalsContact O-N 3.16Å; G320-L323 PolarHBondContact O-N 3.16Å; G320-L324 PolarHBondContact O-N 3.27Å |
| 321 | V | 86.6 | Confident | 81.4 | Confident | 4 Ų | 4 | 55.1 Ų | 55.1 | 2% | 0.024 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -63 | -42.8 | 174.3 | 174.3 | 0 | 0 | 0 | 0 | 111.1 | A243 Y246 L258 L307 F317 E318 Y319 L323 L324 N325 T358 | A243-V321 HydrophobicContact CB-CG1 4.29Å; Y246-V321 HydrophobicContact CE2-CG1 4.15Å; Y246-V321 HydrophobicContact CE2-CG2 4.11Å; L258-V321 HydrophobicContact CD1-CG2 3.81Å; L258-V321 HydrophobicContact CD2-CG2 4.38Å; L307-V321 HydrophobicContact CD2-CG2 4.27Å; F317-V321 HydrophobicContact CD2-CG2 4.41Å; F317-V321 HydrophobicContact CE1-CG2 4.43Å; F317-V321 HydrophobicContact CE2-CG2 3.98Å; F317-V321 HydrophobicContact CZ-CG2 3.99Å; F317-V321 WeakPolarHBondContact O-CG2 3.38Å; F317-V321 PolarHBondContact O-N 2.98Å; E318-V321 PolarHBondContact O-N 3.3Å; Y319-V321 VanDerWaalsContact C-N 3.33Å; Y319-V321 PolarHBondContact O-N 3.34Å; V321-L323 PolarHBondContact O-N 3.01Å; V321-L324 WeakPolarHBondContact O-CB 3.42Å; V321-L324 PolarHBondContact O-N 2.99Å; V321-N325 PolarHBondContact O-N 3.42Å; V321-N325 PolarHBondContact O-ND2 3.47Å; V321-T358 HydrophobicContact CG1-CG2 3.53Å |
| 322 | F | 85.5 | Confident | 81.9 | Confident | 76 Ų | 76 | 47 Ų | 47 | 33% | 0.333 | 22% | 0.224 | S | C | . | . | H | α-helix | trans | -59.8 | -42.9 | 175.9 | 169.9 | -104.2 | 0 | 0 | 0 | 112.8 | E318 Y319 N325 K326 L355 | E318-F322 PolarHBondContact O-N 3.47Å; Y319-F322 HydrophobicContact CD2-CD1 4.17Å; Y319-F322 HydrophobicContact CE2-CD1 4.09Å; Y319-F322 HydrophobicContact CE2-CE1 4.36Å; Y319-F322 WeakPolarHBondContact O-CB 3.46Å; Y319-F322 PolarHBondContact O-N 3.07Å; Y319-F322 VanDerWaalsContact O-N 3.15Å; F322-N325 PolarHBondContact O-N 3.42Å; F322-K326 HydrophobicContact CE1-CD 4.06Å; F322-K326 VanDerWaalsContact CE1-CE 3.43Å; F322-K326 HydrophobicContact CZ-CD 4.21Å; F322-K326 HydrophobicContact CZ-CG 4.5Å; F322-K326 PolarHBondContact O-N 2.88Å; F322-L355 HydrophobicContact CE2-CD1 4.15Å |
| 323 | L | 89.1 | Confident | 82.5 | Confident | 0 Ų | 0 | 44 Ų | 44 | 0% | 0 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -65.1 | -39.7 | 175.8 | -65.3 | -179.4 | 0 | 0 | 0 | 112.2 | Y278 V289 D291 F305 Y319 G320 V321 N325 K326 N327 | Y278-L323 HydrophobicContact CD1-CD1 4.48Å; Y278-L323 HydrophobicContact CD1-CD2 3.78Å; Y278-L323 HydrophobicContact CD2-CD2 4.35Å; Y278-L323 HydrophobicContact CE1-CD2 3.7Å; Y278-L323 HydrophobicContact CE2-CD2 4.32Å; Y278-L323 HydrophobicContact CG-CB 4.3Å; Y278-L323 HydrophobicContact CG-CD2 4.09Å; V289-L323 HydrophobicContact CB-CB 4.37Å; V289-L323 HydrophobicContact CG1-CB 3.72Å; V289-L323 HydrophobicContact CG1-CD1 4.11Å; D291-L323 HydrophobicContact CB-CD1 3.86Å; F305-L323 HydrophobicContact CD2-CD1 3.71Å; F305-L323 HydrophobicContact CE2-CD1 4.24Å; F305-L323 HydrophobicContact CG-CD1 4.39Å; Y319-L323 HydrophobicContact CD1-CD1 3.93Å; Y319-L323 HydrophobicContact CD1-CG 4.17Å; Y319-L323 HydrophobicContact CE1-CD1 3.61Å; Y319-L323 HydrophobicContact CE1-CD2 4.08Å; Y319-L323 HydrophobicContact CE1-CG 3.91Å; Y319-L323 HydrophobicContact CE2-CD2 4.49Å; Y319-L323 WeakPolarHBondContact O-CG 3.33Å; Y319-L323 PolarHBondContact O-N 3.44Å; G320-L323 PolarHBondContact O-N 3.16Å; V321-L323 PolarHBondContact O-N 3.01Å; L323-N325 VanDerWaalsContact C-N 3.29Å; L323-N325 PolarHBondContact O-N 3.49Å; L323-K326 WeakPolarHBondContact O-CB 3.45Å; L323-K326 PolarHBondContact O-N 3.2Å; L323-N327 PolarHBondContact O-N 3.41Å |
| 324 | L | 87.3 | Confident | 82.2 | Confident | 0 Ų | 0 | 47.1 Ų | 47.1 | 0% | 0 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -59.1 | -42.3 | 174.1 | -179.1 | 62.9 | 0 | 0 | 0 | 111.1 | L258 T261 A262 V265 V289 L307 G320 V321 N327 I328 | L258-L324 HydrophobicContact CD2-CD2 4.32Å; T261-L324 HydrophobicContact CG2-CD2 4.2Å; A262-L324 HydrophobicContact CB-CD1 4.35Å; V265-L324 HydrophobicContact CG2-CD1 4.36Å; V289-L324 HydrophobicContact CG2-CB 4.26Å; L307-L324 HydrophobicContact CD1-CD2 4.04Å; L307-L324 HydrophobicContact CD2-CB 4.35Å; L307-L324 HydrophobicContact CD2-CD2 4.32Å; G320-L324 PolarHBondContact O-N 3.27Å; V321-L324 WeakPolarHBondContact O-CB 3.42Å; V321-L324 PolarHBondContact O-N 2.99Å; L324-N327 WeakPolarHBondContact O-CB 3.41Å; L324-N327 PolarHBondContact O-N 2.96Å; L324-N327 VanDerWaalsContact O-N 3.16Å; L324-I328 HydrophobicContact CG-CD1 4.31Å; L324-I328 WeakPolarHBondContact O-CG1 3.42Å; L324-I328 PolarHBondContact O-N 3.34Å |
| 325 | N | 85 | Confident | 81.5 | Confident | 1 Ų | 1 | 41.9 Ų | 41.9 | 1% | 0.005 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -68.1 | -34 | 176.9 | -69.4 | -28.5 | 0 | 0 | 0 | 113.1 | V321 F322 L323 N327 I328 A329 L355 T358 | V321-N325 PolarHBondContact O-N 3.42Å; V321-N325 PolarHBondContact O-ND2 3.47Å; F322-N325 PolarHBondContact O-N 3.42Å; L323-N325 VanDerWaalsContact C-N 3.29Å; L323-N325 PolarHBondContact O-N 3.49Å; N325-N327 VanDerWaalsContact C-N 3.31Å; N325-N327 PolarHBondContact O-N 3.34Å; N325-I328 PolarHBondContact O-N 3.04Å; N325-I328 WeakPolarHBondContact OD1-CD1 3.43Å; N325-A329 PolarHBondContact O-N 2.94Å; N325-L355 HydrophobicContact CB-CD2 4Å; N325-L355 WeakPolarHBondContact CB-O 3.37Å; N325-L355 VanDerWaalsContact CG-O 3.25Å; N325-L355 PolarHBondContact ND2-O 3.46Å; N325-T358 WeakPolarHBondContact ND2-CG2 3.31Å; N325-T358 VanDerWaalsContact OD1-CA 3.26Å; N325-T358 WeakPolarHBondContact OD1-CA 3.45Å; N325-T358 WeakPolarHBondContact OD1-CB 3.49Å; N325-T358 WeakPolarHBondContact OD1-CG2 3.47Å |
| 326 | K | 84.8 | Confident | 80.2 | Confident | 71 Ų | 71 | 35.9 Ų | 35.9 | 31% | 0.309 | 17% | 0.17 | S | C | . | . | H | α-helix | trans | -62.1 | -38.2 | 169.7 | -76.2 | -168 | 169.6 | 173.1 | 0 | 112.7 | Y278 F322 L323 A329 Q330 L355 | Y278-K326 HydrophobicContact CD2-CB 4.03Å; Y278-K326 HydrophobicContact CE2-CB 3.6Å; Y278-K326 HydrophobicContact CE2-CD 3.65Å; Y278-K326 HydrophobicContact CE2-CG 4.29Å; Y278-K326 WeakPolarHBondContact OH-CD 3.41Å; F322-K326 HydrophobicContact CE1-CD 4.06Å; F322-K326 VanDerWaalsContact CE1-CE 3.43Å; F322-K326 HydrophobicContact CZ-CD 4.21Å; F322-K326 HydrophobicContact CZ-CG 4.5Å; F322-K326 PolarHBondContact O-N 2.88Å; L323-K326 WeakPolarHBondContact O-CB 3.45Å; L323-K326 PolarHBondContact O-N 3.2Å; K326-A329 PolarHBondContact O-N 2.9Å; K326-Q330 WeakPolarHBondContact O-CB 3.42Å; K326-Q330 PolarHBondContact O-N 3.2Å; K326-L355 HydrophobicContact CG-CD2 4.43Å |
| 327 | N | 85.4 | Confident | 78.8 | Confident | 0 Ų | 0 | 35.2 Ų | 35.2 | 0% | 0 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -65.2 | -41.5 | 173.6 | -76.5 | -28.5 | 0 | 0 | 0 | 111.8 | V265 L276 Y278 L323 L324 N325 Q330 V331 | V265-N327 HydrophobicContact CG1-CB 4.17Å; L276-N327 HydrophobicContact CD2-CB 4.08Å; Y278-N327 WeakPolarHBondContact CD2-OD1 3.45Å; Y278-N327 PolarHBondContact N-OD1 3.45Å; Y278-N327 VanDerWaalsContact N-OD1 3.07Å; Y278-N327 PolarHBondContact O-ND2 3.12Å; Y278-N327 PolarHBondContact O-OD1 2.82Å; L323-N327 PolarHBondContact O-N 3.41Å; L324-N327 WeakPolarHBondContact O-CB 3.41Å; L324-N327 PolarHBondContact O-N 2.96Å; L324-N327 VanDerWaalsContact O-N 3.16Å; N325-N327 VanDerWaalsContact C-N 3.31Å; N325-N327 PolarHBondContact O-N 3.34Å; N327-Q330 WeakPolarHBondContact O-CB 3.39Å; N327-Q330 PolarHBondContact O-N 2.99Å; N327-V331 WeakPolarHBondContact O-CG2 3.48Å; N327-V331 PolarHBondContact O-N 3.32Å |
| 328 | I | 82 | Confident | 77.1 | Confident | 1 Ų | 1 | 37.2 Ų | 37.2 | 1% | 0.005 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -59.5 | -48.4 | 176.2 | -67.1 | 160.5 | 0 | 0 | 0 | 110.1 | T261 V265 L324 N325 Q330 V331 Y332 N361 V362 | T261-I328 HydrophobicContact CG2-CD1 4.29Å; V265-I328 HydrophobicContact CG2-CD1 4.13Å; V265-I328 HydrophobicContact CG2-CG1 3.49Å; V265-I328 VanDerWaalsContact CG2-CG1 3.49Å; L324-I328 HydrophobicContact CG-CD1 4.31Å; L324-I328 WeakPolarHBondContact O-CG1 3.42Å; L324-I328 PolarHBondContact O-N 3.34Å; N325-I328 PolarHBondContact O-N 3.04Å; N325-I328 WeakPolarHBondContact OD1-CD1 3.43Å; I328-Q330 VanDerWaalsContact C-N 3.31Å; I328-Q330 PolarHBondContact O-N 3.49Å; I328-V331 PolarHBondContact O-N 3.44Å; I328-V331 VanDerWaalsContact O-N 3.16Å; I328-Y332 PolarHBondContact O-N 3.21Å; I328-N361 HydrophobicContact CG2-CB 3.84Å; I328-V362 HydrophobicContact CD1-CG2 3.74Å; I328-V362 HydrophobicContact CG1-CG2 4.3Å |
| 329 | A | 79.7 | Confident | 75.4 | Confident | 26 Ų | 26 | 40.8 Ų | 40.8 | 22% | 0.215 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -60.2 | -39.1 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | N325 K326 Y332 D333 T352 L355 | N325-A329 PolarHBondContact O-N 2.94Å; K326-A329 PolarHBondContact O-N 2.9Å; A329-Y332 WeakPolarHBondContact O-CB 3.44Å; A329-Y332 PolarHBondContact O-N 3.48Å; A329-D333 PolarHBondContact O-N 3.32Å; A329-T352 HydrophobicContact CB-CG2 4.08Å; A329-L355 HydrophobicContact CB-CD2 4.42Å |
| 330 | Q | 81.5 | Confident | 73.6 | Confident | 36 Ų | 36 | 46.2 Ų | 46.2 | 17% | 0.168 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -62.9 | -42.7 | 174.8 | -178 | -166 | -9.4 | 0 | 0 | 112.1 | P275 K326 N327 I328 Y332 D333 R334 | P275-Q330 PolarHBondContact O-NE2 3.07Å; K326-Q330 WeakPolarHBondContact O-CB 3.42Å; K326-Q330 PolarHBondContact O-N 3.2Å; N327-Q330 WeakPolarHBondContact O-CB 3.39Å; N327-Q330 PolarHBondContact O-N 2.99Å; I328-Q330 VanDerWaalsContact C-N 3.31Å; I328-Q330 PolarHBondContact O-N 3.49Å; Q330-Y332 VanDerWaalsContact C-N 3.32Å; Q330-D333 WeakPolarHBondContact O-CA 3.45Å; Q330-D333 PolarHBondContact O-N 2.86Å; Q330-R334 HydrophobicContact CG-CG 4.44Å; Q330-R334 VanDerWaalsContact O-CG 3.26Å; Q330-R334 WeakPolarHBondContact O-CG 3.45Å; Q330-R334 PolarHBondContact O-N 2.88Å |
| 331 | V | 75.2 | Confident | 71.3 | Confident | 1 Ų | 1 | 48 Ų | 48 | 1% | 0.006 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -63.4 | -43.6 | 178.8 | 169.5 | 0 | 0 | 0 | 0 | 109.9 | L268 L274 L276 N327 I328 R334 I335 L365 | L268-V331 HydrophobicContact CB-CG1 4.39Å; L274-V331 HydrophobicContact CD1-CB 4.5Å; L274-V331 HydrophobicContact CD1-CG1 4.34Å; L274-V331 HydrophobicContact CD1-CG2 4.34Å; L276-V331 HydrophobicContact CD2-CG2 4Å; N327-V331 WeakPolarHBondContact O-CG2 3.48Å; N327-V331 PolarHBondContact O-N 3.32Å; I328-V331 PolarHBondContact O-N 3.44Å; I328-V331 VanDerWaalsContact O-N 3.16Å; V331-R334 PolarHBondContact O-N 2.95Å; V331-I335 HydrophobicContact CG1-CD1 3.45Å; V331-I335 VanDerWaalsContact CG1-CD1 3.45Å; V331-I335 HydrophobicContact CG1-CG1 4.33Å; V331-I335 WeakPolarHBondContact O-CD1 3.36Å; V331-I335 WeakPolarHBondContact O-CG1 3.36Å; V331-I335 PolarHBondContact O-N 3.42Å; V331-L365 HydrophobicContact CG1-CD1 4.2Å; V331-L365 HydrophobicContact CG1-CD2 4.07Å |
| 332 | Y | 70 | Confident | 69.1 | Low | 17 Ų | 17 | 52.2 Ų | 52.2 | 7% | 0.067 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -58 | -51.9 | 174.4 | -157.9 | -123.1 | 0 | 0 | 0 | 111.7 | I328 A329 Q330 R334 I335 G336 L348 L365 | I328-Y332 PolarHBondContact O-N 3.21Å; A329-Y332 WeakPolarHBondContact O-CB 3.44Å; A329-Y332 PolarHBondContact O-N 3.48Å; Q330-Y332 VanDerWaalsContact C-N 3.32Å; Y332-R334 PolarHBondContact O-N 2.91Å; Y332-I335 PolarHBondContact O-N 2.95Å; Y332-G336 PolarHBondContact O-N 3.21Å; Y332-L348 HydrophobicContact CD1-CD2 3.18Å; Y332-L348 HydrophobicContact CD1-CG 3.62Å; Y332-L348 HydrophobicContact CD2-CD2 3.61Å; Y332-L348 HydrophobicContact CD2-CG 4.3Å; Y332-L348 HydrophobicContact CE1-CB 4.22Å; Y332-L348 HydrophobicContact CE1-CD1 3.84Å; Y332-L348 HydrophobicContact CE1-CD2 3.29Å; Y332-L348 HydrophobicContact CE1-CG 3.13Å; Y332-L348 HydrophobicContact CE2-CD1 3.75Å; Y332-L348 HydrophobicContact CE2-CD2 3.63Å; Y332-L348 HydrophobicContact CE2-CG 3.83Å; Y332-L348 HydrophobicContact CG-CD2 3.36Å; Y332-L348 HydrophobicContact CG-CG 4.19Å; Y332-L348 VanDerWaalsContact CZ-CD2 3.45Å; Y332-L348 WeakPolarHBondContact O-CD2 3.42Å; Y332-L348 WeakPolarHBondContact OH-CD1 3.32Å; Y332-L348 WeakPolarHBondContact OH-CG 3.5Å; Y332-L365 HydrophobicContact CD2-CB 4.38Å; Y332-L365 HydrophobicContact CD2-CD1 3.9Å |
| 333 | D | 70.4 | Confident | 67.4 | Low | 120 Ų | 120 | 53.3 Ų | 53.3 | 64% | 0.642 | 29% | 0.285 | S | S | * | . | H | α-helix | trans | -28.5 | -68.8 | 162.3 | 165.9 | 130.3 | 0 | 0 | 0 | 114.6 | A329 Q330 A337 | A329-D333 PolarHBondContact O-N 3.32Å; Q330-D333 WeakPolarHBondContact O-CA 3.45Å; Q330-D333 PolarHBondContact O-N 2.86Å; D333-A337 PolarHBondContact O-N 2.91Å |
| 334 | R | 69.3 | Low | 65.1 | Low | 124 Ų | 124 | 53.7 Ų | 53.7 | 47% | 0.468 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -73.3 | -37.6 | -169.3 | -70.3 | -88.8 | -173.7 | 166.9 | -4.6 | 113.1 | L274 Q330 V331 Y332 G336 A337 T338 | L274-R334 HydrophobicContact CD1-CB 3.57Å; L274-R334 HydrophobicContact CD1-CG 4.22Å; L274-R334 HydrophobicContact CD2-CB 3.52Å; L274-R334 HydrophobicContact CD2-CG 3.85Å; L274-R334 HydrophobicContact CG-CB 4.17Å; Q330-R334 HydrophobicContact CG-CG 4.44Å; Q330-R334 VanDerWaalsContact O-CG 3.26Å; Q330-R334 WeakPolarHBondContact O-CG 3.45Å; Q330-R334 PolarHBondContact O-N 2.88Å; V331-R334 PolarHBondContact O-N 2.95Å; Y332-R334 PolarHBondContact O-N 2.91Å; R334-G336 VanDerWaalsContact C-N 3.33Å; R334-A337 PolarHBondContact O-N 3.44Å; R334-T338 PolarHBondContact O-N 2.89Å |
| 335 | I | 65.4 | Low | 63 | Low | 1 Ų | 1 | 63.3 Ų | 63.3 | 1% | 0.005 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -67 | -40.3 | 179.8 | -63.1 | 163 | 0 | 0 | 0 | 109.3 | F272 L274 V331 Y332 A337 T338 L344 L365 L369 | F272-I335 HydrophobicContact CD1-CG1 4.17Å; F272-I335 HydrophobicContact CD2-CD1 3.66Å; F272-I335 HydrophobicContact CD2-CG1 3.88Å; F272-I335 HydrophobicContact CE1-CG1 4.35Å; F272-I335 HydrophobicContact CE1-CG2 4.41Å; F272-I335 HydrophobicContact CE2-CD1 3.6Å; F272-I335 HydrophobicContact CE2-CG1 4.09Å; F272-I335 HydrophobicContact CG-CD1 4.26Å; F272-I335 HydrophobicContact CG-CG1 3.95Å; F272-I335 HydrophobicContact CZ-CD1 4.15Å; F272-I335 HydrophobicContact CZ-CG1 4.34Å; F272-I335 HydrophobicContact CZ-CG2 4.49Å; L274-I335 HydrophobicContact CD1-CG1 4.35Å; V331-I335 HydrophobicContact CG1-CD1 3.45Å; V331-I335 VanDerWaalsContact CG1-CD1 3.45Å; V331-I335 HydrophobicContact CG1-CG1 4.33Å; V331-I335 WeakPolarHBondContact O-CD1 3.36Å; V331-I335 WeakPolarHBondContact O-CG1 3.36Å; V331-I335 PolarHBondContact O-N 3.42Å; Y332-I335 PolarHBondContact O-N 2.95Å; I335-A337 PolarHBondContact O-N 3.3Å; I335-T338 PolarHBondContact O-N 2.91Å; I335-T338 VanDerWaalsContact O-N 3.1Å; I335-T338 PolarHBondContact O-OG1 3.22Å; I335-L344 HydrophobicContact CB-CD2 4.03Å; I335-L344 HydrophobicContact CG2-CD2 3.46Å; I335-L344 VanDerWaalsContact CG2-CD2 3.46Å; I335-L365 HydrophobicContact CD1-CD1 3.85Å; I335-L369 HydrophobicContact CD1-CD1 4.48Å; I335-L369 HydrophobicContact CD1-CD2 4.19Å; I335-L369 HydrophobicContact CG2-CD2 4.04Å |
| 336 | G | 56.4 | Low | 61 | Low | 12 Ų | 12 | 72.1 Ų | 72.1 | 12% | 0.124 | 36% | 0.357 | C | S | . | . | H | α-helix | trans | -62.9 | -25.2 | 174.4 | 0 | 0 | 0 | 0 | 0 | 114.5 | Y332 R334 | Y332-G336 PolarHBondContact O-N 3.21Å; R334-G336 VanDerWaalsContact C-N 3.33Å |
| 337 | A | 54.5 | Low | 59.2 | Low | 75 Ų | 75 | 71.8 Ų | 71.8 | 62% | 0.62 | 36% | 0.363 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -85.1 | -10.4 | 176.1 | 0 | 0 | 0 | 0 | 0 | 114 | D333 R334 I335 | D333-A337 PolarHBondContact O-N 2.91Å; R334-A337 PolarHBondContact O-N 3.44Å; I335-A337 PolarHBondContact O-N 3.3Å |
| 338 | T | 50.8 | Low | 57.2 | Low | 52 Ų | 52 | 72.8 Ų | 72.8 | 32% | 0.319 | 37% | 0.368 | S | S | . | . | S | Bend | trans | -78.7 | 134 | 175.8 | 57.3 | 0 | 0 | 0 | 0 | 110.9 | R334 I335 F340 L341 | R334-T338 PolarHBondContact O-N 2.89Å; I335-T338 PolarHBondContact O-N 2.91Å; I335-T338 VanDerWaalsContact O-N 3.1Å; I335-T338 PolarHBondContact O-OG1 3.22Å; T338-F340 PolarHBondContact O-N 3.33Å; T338-L341 PolarHBondContact O-N 3.48Å |
| 339 | D | 49.1 | Very low | 55.3 | Low | 162 Ų | 162 | 76.1 Ų | 76.1 | 87% | 0.866 | 40% | 0.403 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -57.1 | -11.8 | 178.4 | -60.5 | -39.4 | 0 | 0 | 0 | 114 | L341 | D339-L341 VanDerWaalsContact C-N 3.33Å; D339-L341 PolarHBondContact O-N 3.49Å |
| 340 | F | 48 | Very low | 53.3 | Low | 191 Ų | 191 | 81.1 Ų | 81.1 | 84% | 0.838 | 43% | 0.425 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -72.5 | -18.9 | -179.8 | -80.8 | -85.4 | 0 | 0 | 0 | 114.2 | T338 | T338-F340 PolarHBondContact O-N 3.33Š|
| 341 | L | 41.4 | Very low | 51.4 | Low | 38 Ų | 38 | 84.5 Ų | 84.5 | 20% | 0.199 | 45% | 0.45 | C | S | . | . | trans | -143.5 | 74.7 | -175.8 | -100 | 147.1 | 0 | 0 | 0 | 111.7 | T338 D339 D343 L344 | T338-L341 PolarHBondContact O-N 3.48Å; D339-L341 VanDerWaalsContact C-N 3.33Å; D339-L341 PolarHBondContact O-N 3.49Å; L341-D343 VanDerWaalsContact C-N 3.3Å; L341-D343 PolarHBondContact O-N 3.4Å; L341-L344 HydrophobicContact CB-CB 4.13Å; L341-L344 VanDerWaalsContact O-CB 3.31Å; L341-L344 WeakPolarHBondContact O-CB 3.34Å; L341-L344 PolarHBondContact O-N 3.24Å | ||
| 342 | P | 40.7 | Very low | 50.2 | Low | 92 Ų | 92 | 85.3 Ų | 85.3 | 60% | 0.597 | 46% | 0.455 | S | S | * | . | H | α-helix | trans | -66.3 | -27.1 | -178 | 25.2 | -33.5 | 0 | 0 | 0 | 113.9 | L344 R345 | P342-L344 VanDerWaalsContact C-N 3.27Å; P342-L344 PolarHBondContact O-N 2.87Å; P342-R345 PolarHBondContact O-N 2.92Å |
| 343 | D | 48.5 | Very low | 49.3 | Very low | 100 Ų | 100 | 90.1 Ų | 90.1 | 54% | 0.535 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -69.8 | -25 | 177.3 | -75.5 | -45.4 | 0 | 0 | 0 | 113.1 | L341 R345 R346 | L341-D343 VanDerWaalsContact C-N 3.3Å; L341-D343 PolarHBondContact O-N 3.4Å; D343-R345 VanDerWaalsContact C-N 3.33Å; D343-R345 PolarHBondContact O-N 3.35Å; D343-R346 PolarHBondContact O-N 2.87Å; D343-R346 IonicContact OD1-CZ 3.62Å; D343-R346 VanDerWaalsContact OD1-CZ 3.28Å; D343-R346 IonicContact OD1-NH1 2.88Å; D343-R346 PolarHBondContact OD1-NH1 2.98Å; D343-R346 IonicContact OD1-NH2 3.69Å; D343-R346 PolarHBondContact OD1-NH2 3.39Å |
| 344 | L | 42 | Very low | 48.4 | Very low | 8 Ų | 8 | 87.1 Ų | 87.1 | 4% | 0.042 | 48% | 0.475 | C | S | . | . | H | α-helix | trans | -62.8 | -42 | 177.3 | -163.9 | 63.9 | 0 | 0 | 0 | 110.5 | I335 L341 P342 R346 S347 L348 H368 | I335-L344 HydrophobicContact CB-CD2 4.03Å; I335-L344 HydrophobicContact CG2-CD2 3.46Å; I335-L344 VanDerWaalsContact CG2-CD2 3.46Å; L341-L344 HydrophobicContact CB-CB 4.13Å; L341-L344 VanDerWaalsContact O-CB 3.31Å; L341-L344 WeakPolarHBondContact O-CB 3.34Å; L341-L344 PolarHBondContact O-N 3.24Å; P342-L344 VanDerWaalsContact C-N 3.27Å; P342-L344 PolarHBondContact O-N 2.87Å; L344-R346 PolarHBondContact O-N 2.91Å; L344-R346 VanDerWaalsContact O-N 3.12Å; L344-S347 PolarHBondContact O-N 3.39Å; L344-L348 HydrophobicContact CD1-CD1 3.34Å; L344-L348 HydrophobicContact CD1-CD2 4.46Å; L344-L348 HydrophobicContact CD1-CG 4.49Å; L344-L348 HydrophobicContact CG-CD1 3.61Å; L344-L348 HydrophobicContact CG-CD2 4.08Å; L344-L348 HydrophobicContact CG-CG 4.38Å; L344-L348 VanDerWaalsContact O-CB 3.29Å; L344-L348 WeakPolarHBondContact O-CB 3.47Å; L344-L348 WeakPolarHBondContact O-CD1 3.34Å; L344-L348 PolarHBondContact O-N 3.49Å; L344-H368 HydrophobicContact CD1-CB 3.49Å; L344-H368 VanDerWaalsContact CD1-CB 3.49Å; L344-H368 WeakPolarHBondContact CD1-CD2 3.31Å |
| 345 | R | 42 | Very low | 47.8 | Very low | 201 Ų | 201 | 84 Ų | 84 | 76% | 0.758 | 47% | 0.468 | S | S | * | . | H | α-helix | trans | -55.8 | -33.7 | -179.7 | -173.4 | 177.3 | 177.5 | 176.5 | 0.3 | 114 | P342 D343 | P342-R345 PolarHBondContact O-N 2.92Å; D343-R345 VanDerWaalsContact C-N 3.33Å; D343-R345 PolarHBondContact O-N 3.35Å |
| 346 | R | 42.9 | Very low | 47.3 | Very low | 187 Ų | 187 | 90.4 Ų | 90.4 | 71% | 0.706 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -76.3 | -36.3 | -177.6 | -113.8 | -175.1 | -75.2 | 97.5 | -0.6 | 112.8 | D343 L344 | D343-R346 PolarHBondContact O-N 2.87Å; D343-R346 IonicContact OD1-CZ 3.62Å; D343-R346 VanDerWaalsContact OD1-CZ 3.28Å; D343-R346 IonicContact OD1-NH1 2.88Å; D343-R346 PolarHBondContact OD1-NH1 2.98Å; D343-R346 IonicContact OD1-NH2 3.69Å; D343-R346 PolarHBondContact OD1-NH2 3.39Å; L344-R346 PolarHBondContact O-N 2.91Å; L344-R346 VanDerWaalsContact O-N 3.12Å |
| 347 | S | 48.1 | Very low | 47.4 | Very low | 63 Ų | 63 | 91.2 Ų | 91.2 | 44% | 0.441 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -74.8 | -32.5 | 175.8 | -178.6 | 0 | 0 | 0 | 0 | 111.5 | L344 H368 | L344-S347 PolarHBondContact O-N 3.39Å; S347-H368 PolarHBondContact OG-NE2 2.68Å |
| 348 | L | 44 | Very low | 47.5 | Very low | 22 Ų | 22 | 87.7 Ų | 87.7 | 12% | 0.115 | 47% | 0.466 | C | S | . | . | trans | -92.5 | -0.8 | -166.7 | -93.6 | 76.7 | 0 | 0 | 0 | 117.9 | Y332 L344 L350 | Y332-L348 HydrophobicContact CD1-CD2 3.18Å; Y332-L348 HydrophobicContact CD1-CG 3.62Å; Y332-L348 HydrophobicContact CD2-CD2 3.61Å; Y332-L348 HydrophobicContact CD2-CG 4.3Å; Y332-L348 HydrophobicContact CE1-CB 4.22Å; Y332-L348 HydrophobicContact CE1-CD1 3.84Å; Y332-L348 HydrophobicContact CE1-CD2 3.29Å; Y332-L348 HydrophobicContact CE1-CG 3.13Å; Y332-L348 HydrophobicContact CE2-CD1 3.75Å; Y332-L348 HydrophobicContact CE2-CD2 3.63Å; Y332-L348 HydrophobicContact CE2-CG 3.83Å; Y332-L348 HydrophobicContact CG-CD2 3.36Å; Y332-L348 HydrophobicContact CG-CG 4.19Å; Y332-L348 VanDerWaalsContact CZ-CD2 3.45Å; Y332-L348 WeakPolarHBondContact O-CD2 3.42Å; Y332-L348 WeakPolarHBondContact OH-CD1 3.32Å; Y332-L348 WeakPolarHBondContact OH-CG 3.5Å; L344-L348 HydrophobicContact CD1-CD1 3.34Å; L344-L348 HydrophobicContact CD1-CD2 4.46Å; L344-L348 HydrophobicContact CD1-CG 4.49Å; L344-L348 HydrophobicContact CG-CD1 3.61Å; L344-L348 HydrophobicContact CG-CD2 4.08Å; L344-L348 HydrophobicContact CG-CG 4.38Å; L344-L348 VanDerWaalsContact O-CB 3.29Å; L344-L348 WeakPolarHBondContact O-CB 3.47Å; L344-L348 WeakPolarHBondContact O-CD1 3.34Å; L344-L348 PolarHBondContact O-N 3.49Å; L348-L350 CarbonylContact O-C 3.58Å; L348-L350 PolarHBondContact O-N 3.42Å | ||
| 349 | G | 41.7 | Very low | 47.8 | Very low | 71 Ų | 71 | 85.9 Ų | 85.9 | 73% | 0.732 | 45% | 0.454 | S | S | * | . | S | Bend | trans | -58 | -5.2 | 176.5 | 0 | 0 | 0 | 0 | 0 | 114.4 | ||
| 350 | L | 37.7 | Very low | 48.2 | Very low | 131 Ų | 131 | 79 Ų | 79 | 69% | 0.686 | 42% | 0.42 | S | S | * | . | S | Bend | trans | -94.3 | 120.8 | 171.2 | -68 | 157.5 | 0 | 0 | 0 | 109.2 | L348 T352 | L348-L350 CarbonylContact O-C 3.58Å; L348-L350 PolarHBondContact O-N 3.42Å; L350-T352 PolarHBondContact O-N 3.3Å |
| 351 | P | 42.3 | Very low | 48.8 | Very low | 107 Ų | 107 | 70.1 Ų | 70.1 | 70% | 0.695 | 38% | 0.381 | S | S | * | . | trans | -51.4 | 146.1 | 164.2 | 25.2 | -33.1 | 0 | 0 | 0 | 107.9 | S353 | P351-S353 VanDerWaalsContact C-N 3.34Å; P351-S353 VanDerWaalsContact O-CA 3.29Å; P351-S353 WeakPolarHBondContact O-CA 3.38Å; P351-S353 PolarHBondContact O-N 2.91Å | ||
| 352 | T | 50 | Low | 49.7 | Very low | 17 Ų | 17 | 68.4 Ų | 68.4 | 10% | 0.104 | 37% | 0.372 | C | S | . | . | trans | -41.7 | 104.4 | 170.5 | 47.1 | 0 | 0 | 0 | 0 | 107.5 | A329 L350 D354 N361 | A329-T352 HydrophobicContact CB-CG2 4.08Å; L350-T352 PolarHBondContact O-N 3.3Å; T352-D354 PolarHBondContact O-N 2.85Å; T352-N361 HydrophobicContact CG2-CB 4.31Å | ||
| 353 | S | 49.8 | Very low | 50.4 | Low | 119 Ų | 119 | 64.9 Ų | 64.9 | 83% | 0.832 | 35% | 0.351 | S | S | * | . | S | Bend | trans | -61.7 | -27.7 | -160.6 | 46.9 | 0 | 0 | 0 | 0 | 110.8 | P351 | P351-S353 VanDerWaalsContact C-N 3.34Å; P351-S353 VanDerWaalsContact O-CA 3.29Å; P351-S353 WeakPolarHBondContact O-CA 3.38Å; P351-S353 PolarHBondContact O-N 2.91Å |
| 354 | D | 52.3 | Low | 50.9 | Low | 56 Ų | 56 | 63.3 Ų | 63.3 | 30% | 0.299 | 34% | 0.341 | S | S | . | . | trans | -130.6 | 112.2 | 168.6 | -156.5 | -14.3 | 0 | 0 | 0 | 111.8 | T352 R356 C357 N361 | T352-D354 PolarHBondContact O-N 2.85Å; D354-R356 PolarHBondContact O-N 3Å; D354-R356 VanDerWaalsContact O-N 3.12Å; D354-R356 WeakPolarHBondContact OD1-CB 3.39Å; D354-R356 VanDerWaalsContact OD1-CD 3.31Å; D354-R356 WeakPolarHBondContact OD1-CD 3.35Å; D354-R356 WeakPolarHBondContact OD1-CG 3.42Å; D354-R356 PolarHBondContact OD1-N 3.23Å; D354-R356 IonicContact OD1-NE 3.84Å; D354-C357 PolarHBondContact O-N 2.87Å; D354-N361 PolarHBondContact O-ND2 3.49Å | ||
| 355 | L | 56.4 | Low | 51.6 | Low | 59 Ų | 59 | 63.1 Ų | 63.1 | 31% | 0.309 | 34% | 0.34 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -66 | -2.5 | 169 | -77.9 | 158.6 | 0 | 0 | 0 | 112 | F322 N325 K326 A329 | F322-L355 HydrophobicContact CE2-CD1 4.15Å; N325-L355 HydrophobicContact CB-CD2 4Å; N325-L355 WeakPolarHBondContact CB-O 3.37Å; N325-L355 VanDerWaalsContact CG-O 3.25Å; N325-L355 PolarHBondContact ND2-O 3.46Å; K326-L355 HydrophobicContact CG-CD2 4.43Å; A329-L355 HydrophobicContact CB-CD2 4.42Å |
| 356 | R | 55.5 | Low | 52.4 | Low | 136 Ų | 136 | 54.5 Ų | 54.5 | 51% | 0.513 | 31% | 0.309 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -86.2 | -25.1 | 177 | -58.6 | 168.1 | -159.8 | -164.5 | 6.1 | 112.9 | A243 E244 D354 T358 | A243-R356 WeakPolarHBondContact CB-O 3.42Å; A243-R356 PolarHBondContact N-O 3.01Å; E244-R356 WeakPolarHBondContact OE1-CD 3.45Å; E244-R356 IonicContact OE1-CZ 3.07Å; E244-R356 IonicContact OE1-NE 3.21Å; E244-R356 IonicContact OE1-NH1 2.69Å; E244-R356 PolarHBondContact OE1-NH1 2.94Å; D354-R356 PolarHBondContact O-N 3Å; D354-R356 VanDerWaalsContact O-N 3.12Å; D354-R356 WeakPolarHBondContact OD1-CB 3.39Å; D354-R356 VanDerWaalsContact OD1-CD 3.31Å; D354-R356 WeakPolarHBondContact OD1-CD 3.35Å; D354-R356 WeakPolarHBondContact OD1-CG 3.42Å; D354-R356 PolarHBondContact OD1-N 3.23Å; D354-R356 IonicContact OD1-NE 3.84Å; R356-T358 PolarHBondContact O-N 3.26Å; R356-T358 VanDerWaalsContact O-N 3.07Å |
| 357 | C | 57.4 | Low | 53.1 | Low | 28 Ų | 28 | 48.5 Ų | 48.5 | 19% | 0.189 | 29% | 0.289 | C | S | . | . | trans | -87.8 | 67.5 | -175.1 | -57.4 | 0 | 0 | 0 | 0 | 111.9 | D354 L359 A360 N361 | D354-C357 PolarHBondContact O-N 2.87Å; C357-L359 VanDerWaalsContact C-N 3.33Å; C357-L359 PolarHBondContact O-N 2.95Å; C357-A360 HydrophobicContact CB-CB 3.7Å; C357-A360 PolarHBondContact O-N 3.4Å; C357-N361 VanDerWaalsContact O-CG 3.3Å; C357-N361 PolarHBondContact O-N 3.39Å; C357-N361 PolarHBondContact O-ND2 3.45Å | ||
| 358 | T | 57.3 | Low | 53.2 | Low | 1 Ų | 1 | 48 Ų | 48 | 1% | 0.006 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -44.7 | -52.5 | -175.3 | 52.9 | 0 | 0 | 0 | 0 | 113.2 | Y246 L258 V321 N325 R356 V362 | Y246-T358 PolarHBondContact OH-OG1 3.46Å; L258-T358 HydrophobicContact CD2-CG2 4.31Å; V321-T358 HydrophobicContact CG1-CG2 3.53Å; N325-T358 WeakPolarHBondContact ND2-CG2 3.31Å; N325-T358 VanDerWaalsContact OD1-CA 3.26Å; N325-T358 WeakPolarHBondContact OD1-CA 3.45Å; N325-T358 WeakPolarHBondContact OD1-CB 3.49Å; N325-T358 WeakPolarHBondContact OD1-CG2 3.47Å; R356-T358 PolarHBondContact O-N 3.26Å; R356-T358 VanDerWaalsContact O-N 3.07Å; T358-V362 VanDerWaalsContact O-CG2 3.26Å; T358-V362 WeakPolarHBondContact O-CG2 3.33Å; T358-V362 PolarHBondContact O-N 2.91Å |
| 359 | L | 56.2 | Low | 53.6 | Low | 14 Ų | 14 | 48.8 Ų | 48.8 | 7% | 0.073 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -82.8 | -32.9 | -175.7 | -149.7 | 161.4 | 0 | 0 | 0 | 112.7 | Y233 I235 L240 C357 N361 V362 A363 | Y233-L359 HydrophobicContact CD1-CD2 3.83Å; Y233-L359 HydrophobicContact CG-CB 4.32Å; Y233-L359 HydrophobicContact CG-CD2 3.88Å; I235-L359 HydrophobicContact CB-CD1 3.93Å; I235-L359 HydrophobicContact CG2-CD1 4.4Å; L240-L359 HydrophobicContact CB-CD1 3.78Å; L240-L359 HydrophobicContact CD2-CB 4.29Å; L240-L359 HydrophobicContact CD2-CD1 4.17Å; C357-L359 VanDerWaalsContact C-N 3.33Å; C357-L359 PolarHBondContact O-N 2.95Å; L359-N361 PolarHBondContact O-N 3.05Å; L359-V362 CarbonylContact O-C 3.58Å; L359-V362 WeakPolarHBondContact O-CA 3.49Å; L359-V362 WeakPolarHBondContact O-CB 3.35Å; L359-V362 PolarHBondContact O-N 2.89Å; L359-A363 HydrophobicContact CD2-CB 4.23Å; L359-A363 WeakPolarHBondContact O-CB 3.41Å; L359-A363 PolarHBondContact O-N 2.86Å |
| 360 | A | 57.7 | Low | 53.9 | Low | 17 Ų | 17 | 47.6 Ų | 47.6 | 14% | 0.14 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -58.5 | -41.9 | 172.7 | 0 | 0 | 0 | 0 | 0 | 110.6 | Y233 C357 V362 A363 M364 | Y233-A360 HydrophobicContact CD2-CB 4.45Å; Y233-A360 HydrophobicContact CE2-CB 3.75Å; C357-A360 HydrophobicContact CB-CB 3.7Å; C357-A360 PolarHBondContact O-N 3.4Å; A360-V362 VanDerWaalsContact C-N 3.31Å; A360-V362 PolarHBondContact O-N 3.39Å; A360-A363 PolarHBondContact O-N 3.39Å; A360-M364 WeakPolarHBondContact O-CB 3.43Å; A360-M364 WeakPolarHBondContact O-CG 3.36Å; A360-M364 PolarHBondContact O-N 2.86Å |
| 361 | N | 60.3 | Low | 54.3 | Low | 6 Ų | 6 | 48.9 Ų | 48.9 | 3% | 0.032 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -63.4 | -36 | 174.6 | -67.1 | -31.3 | 0 | 0 | 0 | 112.2 | I328 T352 D354 C357 L359 L365 | I328-N361 HydrophobicContact CG2-CB 3.84Å; T352-N361 HydrophobicContact CG2-CB 4.31Å; D354-N361 PolarHBondContact O-ND2 3.49Å; C357-N361 VanDerWaalsContact O-CG 3.3Å; C357-N361 PolarHBondContact O-N 3.39Å; C357-N361 PolarHBondContact O-ND2 3.45Å; L359-N361 PolarHBondContact O-N 3.05Å; N361-L365 VanDerWaalsContact O-CB 3.3Å; N361-L365 WeakPolarHBondContact O-CB 3.35Å; N361-L365 PolarHBondContact O-N 3.27Å; N361-L365 VanDerWaalsContact O-N 3.08Å |
| 362 | V | 60.8 | Low | 54 | Low | 2 Ų | 2 | 47.5 Ų | 47.5 | 1% | 0.012 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -72.2 | -40.9 | 174.8 | 172.1 | 0 | 0 | 0 | 0 | 112 | T261 L264 I328 T358 L359 A360 L365 L366 | T261-V362 HydrophobicContact CG2-CG2 3.76Å; L264-V362 HydrophobicContact CD2-CG1 3.43Å; L264-V362 VanDerWaalsContact CD2-CG1 3.43Å; I328-V362 HydrophobicContact CD1-CG2 3.74Å; I328-V362 HydrophobicContact CG1-CG2 4.3Å; T358-V362 VanDerWaalsContact O-CG2 3.26Å; T358-V362 WeakPolarHBondContact O-CG2 3.33Å; T358-V362 PolarHBondContact O-N 2.91Å; L359-V362 CarbonylContact O-C 3.58Å; L359-V362 WeakPolarHBondContact O-CA 3.49Å; L359-V362 WeakPolarHBondContact O-CB 3.35Å; L359-V362 PolarHBondContact O-N 2.89Å; A360-V362 VanDerWaalsContact C-N 3.31Å; A360-V362 PolarHBondContact O-N 3.39Å; V362-L365 WeakPolarHBondContact O-CB 3.22Å; V362-L365 PolarHBondContact O-N 3.36Å; V362-L366 HydrophobicContact CG1-CD1 4.09Å; V362-L366 HydrophobicContact CG1-CG 4.32Å; V362-L366 WeakPolarHBondContact O-CB 3.32Å; V362-L366 WeakPolarHBondContact O-CG 3.46Å; V362-L366 PolarHBondContact O-N 2.89Å |
| 363 | A | 56.1 | Low | 53 | Low | 18 Ų | 18 | 50.9 Ų | 50.9 | 15% | 0.149 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -63.5 | -47.6 | 178.5 | 0 | 0 | 0 | 0 | 0 | 109.9 | Y233 L359 A360 L365 L366 E367 | Y233-A363 HydrophobicContact CD1-CB 4.22Å; Y233-A363 HydrophobicContact CE1-CB 3.94Å; L359-A363 HydrophobicContact CD2-CB 4.23Å; L359-A363 WeakPolarHBondContact O-CB 3.41Å; L359-A363 PolarHBondContact O-N 2.86Å; A360-A363 PolarHBondContact O-N 3.39Å; A363-L365 VanDerWaalsContact C-N 3.31Å; A363-L365 PolarHBondContact O-N 2.95Å; A363-L366 PolarHBondContact O-N 3.48Å; A363-E367 VanDerWaalsContact O-CB 3.3Å; A363-E367 WeakPolarHBondContact O-CB 3.35Å; A363-E367 PolarHBondContact O-N 2.94Å |
| 364 | M | 58.2 | Low | 52.4 | Low | 66 Ų | 66 | 49.1 Ų | 49.1 | 33% | 0.325 | 26% | 0.257 | S | S | . | . | H | α-helix | trans | -58.2 | -42.9 | 172.4 | -70.6 | -161.5 | -52 | 0 | 0 | 112 | A360 H368 | A360-M364 WeakPolarHBondContact O-CB 3.43Å; A360-M364 WeakPolarHBondContact O-CG 3.36Å; A360-M364 PolarHBondContact O-N 2.86Å; M364-H368 WeakPolarHBondContact O-CB 3.42Å; M364-H368 PolarHBondContact O-N 2.73Å; M364-H368 VanDerWaalsContact O-N 3.07Å; M364-H368 PolarHBondContact O-ND1 2.95Å |
| 365 | L | 56.9 | Low | 51.2 | Low | 4 Ų | 4 | 53.4 Ų | 53.4 | 2% | 0.021 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -61.2 | -44.1 | 176 | 176.6 | 66.8 | 0 | 0 | 0 | 111.7 | L268 V331 Y332 I335 N361 V362 A363 L369 | L268-L365 HydrophobicContact CD1-CD2 3.48Å; L268-L365 VanDerWaalsContact CD1-CD2 3.48Å; L268-L365 HydrophobicContact CD1-CG 4.21Å; V331-L365 HydrophobicContact CG1-CD1 4.2Å; V331-L365 HydrophobicContact CG1-CD2 4.07Å; Y332-L365 HydrophobicContact CD2-CB 4.38Å; Y332-L365 HydrophobicContact CD2-CD1 3.9Å; I335-L365 HydrophobicContact CD1-CD1 3.85Å; N361-L365 VanDerWaalsContact O-CB 3.3Å; N361-L365 WeakPolarHBondContact O-CB 3.35Å; N361-L365 PolarHBondContact O-N 3.27Å; N361-L365 VanDerWaalsContact O-N 3.08Å; V362-L365 WeakPolarHBondContact O-CB 3.22Å; V362-L365 PolarHBondContact O-N 3.36Å; A363-L365 VanDerWaalsContact C-N 3.31Å; A363-L365 PolarHBondContact O-N 2.95Å; L365-L369 HydrophobicContact CD1-CD1 4.13Å; L365-L369 HydrophobicContact CD1-CG 4.4Å; L365-L369 HydrophobicContact CG-CD1 4.11Å; L365-L369 VanDerWaalsContact O-CB 3.3Å; L365-L369 WeakPolarHBondContact O-CB 3.49Å; L365-L369 WeakPolarHBondContact O-CG 3.17Å; L365-L369 PolarHBondContact O-N 3.49Å |
| 366 | L | 59.4 | Low | 50 | Low | 21 Ų | 21 | 55.3 Ų | 55.3 | 11% | 0.11 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -70.8 | -39.8 | 179.6 | -73 | 178.8 | 0 | 0 | 0 | 112.8 | L203 V207 L264 V362 A363 L369 T370 | L203-L366 HydrophobicContact CD1-CD2 4.39Å; V207-L366 HydrophobicContact CG2-CD2 3.94Å; L264-L366 HydrophobicContact CD1-CD2 4.42Å; L264-L366 HydrophobicContact CD2-CD1 4Å; L264-L366 HydrophobicContact CD2-CD2 4.26Å; L264-L366 HydrophobicContact CD2-CG 4.33Å; V362-L366 HydrophobicContact CG1-CD1 4.09Å; V362-L366 HydrophobicContact CG1-CG 4.32Å; V362-L366 WeakPolarHBondContact O-CB 3.32Å; V362-L366 WeakPolarHBondContact O-CG 3.46Å; V362-L366 PolarHBondContact O-N 2.89Å; A363-L366 PolarHBondContact O-N 3.48Å; L366-L369 PolarHBondContact O-N 3.48Å; L366-T370 WeakPolarHBondContact O-CB 3.48Å; L366-T370 VanDerWaalsContact O-CG2 3.3Å; L366-T370 WeakPolarHBondContact O-CG2 3.46Å; L366-T370 PolarHBondContact O-N 2.85Å; L366-T370 VanDerWaalsContact O-N 3.16Å; L366-T370 PolarHBondContact O-OG1 2.92Å |
| 367 | E | 56 | Low | 48.6 | Very low | 61 Ų | 61 | 56 Ų | 56 | 29% | 0.285 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -59.8 | -50.5 | 176.6 | -175.3 | 171.8 | -159.1 | 0 | 0 | 110.4 | A363 L369 T370 E371 P373 L374 | A363-E367 VanDerWaalsContact O-CB 3.3Å; A363-E367 WeakPolarHBondContact O-CB 3.35Å; A363-E367 PolarHBondContact O-N 2.94Å; E367-L369 PolarHBondContact O-N 3.14Å; E367-T370 PolarHBondContact O-N 3.39Å; E367-T370 VanDerWaalsContact O-N 3.14Å; E367-T370 PolarHBondContact O-OG1 2.84Å; E367-E371 PolarHBondContact O-N 3.29Å; E367-P373 WeakPolarHBondContact OE1-CA 3.3Å; E367-L374 PolarHBondContact OE1-N 2.89Å |
| 368 | H | 51.6 | Low | 47.1 | Very low | 51 Ų | 51 | 59.8 Ų | 59.8 | 24% | 0.236 | 35% | 0.346 | C | S | . | . | H | α-helix | trans | -64.4 | -37.9 | 176.9 | -78.2 | 89.5 | 0 | 0 | 0 | 113.4 | L344 S347 M364 T370 | L344-H368 HydrophobicContact CD1-CB 3.49Å; L344-H368 VanDerWaalsContact CD1-CB 3.49Å; L344-H368 WeakPolarHBondContact CD1-CD2 3.31Å; S347-H368 PolarHBondContact OG-NE2 2.68Å; M364-H368 WeakPolarHBondContact O-CB 3.42Å; M364-H368 PolarHBondContact O-N 2.73Å; M364-H368 VanDerWaalsContact O-N 3.07Å; M364-H368 PolarHBondContact O-ND1 2.95Å; H368-T370 PolarHBondContact O-N 3.31Å |
| 369 | L | 52.5 | Low | 45.6 | Very low | 40 Ų | 40 | 65.2 Ų | 65.2 | 21% | 0.209 | 38% | 0.384 | C | S | . | . | H | α-helix | trans | -67.8 | -16.9 | 176.7 | -79.9 | 177.8 | 0 | 0 | 0 | 113.8 | L268 F272 I335 L365 L366 E367 | L268-L369 HydrophobicContact CD1-CD1 4.38Å; L268-L369 HydrophobicContact CD2-CD1 3.65Å; F272-L369 HydrophobicContact CE1-CD2 4.44Å; F272-L369 HydrophobicContact CE2-CD1 4.12Å; F272-L369 HydrophobicContact CE2-CD2 3.86Å; F272-L369 HydrophobicContact CZ-CD1 4.48Å; F272-L369 HydrophobicContact CZ-CD2 3.43Å; F272-L369 VanDerWaalsContact CZ-CD2 3.43Å; I335-L369 HydrophobicContact CD1-CD1 4.48Å; I335-L369 HydrophobicContact CD1-CD2 4.19Å; I335-L369 HydrophobicContact CG2-CD2 4.04Å; L365-L369 HydrophobicContact CD1-CD1 4.13Å; L365-L369 HydrophobicContact CD1-CG 4.4Å; L365-L369 HydrophobicContact CG-CD1 4.11Å; L365-L369 VanDerWaalsContact O-CB 3.3Å; L365-L369 WeakPolarHBondContact O-CB 3.49Å; L365-L369 WeakPolarHBondContact O-CG 3.17Å; L365-L369 PolarHBondContact O-N 3.49Å; L366-L369 PolarHBondContact O-N 3.48Å; E367-L369 PolarHBondContact O-N 3.14Å |
| 370 | T | 47.5 | Very low | 44.4 | Very low | 45 Ų | 45 | 69.7 Ų | 69.7 | 28% | 0.276 | 42% | 0.416 | S | S | . | . | H | α-helix | trans | -116.2 | 1.3 | -172.8 | 61.9 | 0 | 0 | 0 | 0 | 114.7 | V207 R211 L366 E367 H368 V372 | V207-T370 HydrophobicContact CG1-CG2 4.49Å; R211-T370 PolarHBondContact NH2-OG1 3.14Å; L366-T370 WeakPolarHBondContact O-CB 3.48Å; L366-T370 VanDerWaalsContact O-CG2 3.3Å; L366-T370 WeakPolarHBondContact O-CG2 3.46Å; L366-T370 PolarHBondContact O-N 2.85Å; L366-T370 VanDerWaalsContact O-N 3.16Å; L366-T370 PolarHBondContact O-OG1 2.92Å; E367-T370 PolarHBondContact O-N 3.39Å; E367-T370 VanDerWaalsContact O-N 3.14Å; E367-T370 PolarHBondContact O-OG1 2.84Å; H368-T370 PolarHBondContact O-N 3.31Å; T370-V372 WeakPolarHBondContact O-CG2 3.29Å; T370-V372 PolarHBondContact O-N 2.81Å |
| 371 | E | 45.5 | Very low | 42.8 | Very low | 159 Ų | 159 | 74.1 Ų | 74.1 | 74% | 0.743 | 45% | 0.446 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 49.3 | 23.5 | 177.4 | -64.7 | -178.6 | -177.8 | 0 | 0 | 114.9 | E367 | E367-E371 PolarHBondContact O-N 3.29Š|
| 372 | V | 37 | Very low | 41.1 | Very low | 78 Ų | 78 | 78.6 Ų | 78.6 | 47% | 0.473 | 48% | 0.478 | S | S | . | . | trans | -120.7 | 109.3 | 176.1 | 178.3 | 0 | 0 | 0 | 0 | 107.9 | T370 | T370-V372 WeakPolarHBondContact O-CG2 3.29Å; T370-V372 PolarHBondContact O-N 2.81Å | ||
| 373 | P | 28.6 | Very low | 39.3 | Very low | 87 Ų | 87 | 85.6 Ų | 85.6 | 57% | 0.565 | 51% | 0.514 | S | S | * | . | trans | -57.2 | 136 | 172.4 | -20.7 | 31.7 | 0 | 0 | 0 | 110.5 | E367 D375 | E367-P373 WeakPolarHBondContact OE1-CA 3.3Å; P373-D375 PolarHBondContact O-N 3.2Å | ||
| 374 | L | 36.6 | Very low | 37.7 | Very low | 83 Ų | 83 | 95.3 Ų | 95.3 | 44% | 0.435 | 55% | 0.547 | S | S | . | . | trans | -79.5 | 95.4 | 166.7 | -69.2 | 170.6 | 0 | 0 | 0 | 107.1 | V214 E367 S376 | V214-L374 HydrophobicContact CG1-CD1 4.49Å; V214-L374 HydrophobicContact CG1-CD2 4.34Å; E367-L374 PolarHBondContact OE1-N 2.89Å; L374-S376 PolarHBondContact O-N 3.19Å | ||
| 375 | D | 28.4 | Very low | 36.1 | Very low | 145 Ų | 145 | 98.3 Ų | 98.3 | 78% | 0.775 | 57% | 0.572 | S | S | * | * | trans | -48.3 | 113.9 | -176.9 | -74.7 | -36.6 | 0 | 0 | 0 | 112 | P373 | P373-D375 PolarHBondContact O-N 3.2Š| ||
| 376 | S | 30 | Very low | 34.6 | Very low | 100 Ų | 100 | 104 Ų | 104 | 70% | 0.699 | 61% | 0.609 | S | S | * | * | trans | -80.6 | 141.8 | 149.5 | -61.3 | 0 | 0 | 0 | 0 | 107.7 | L374 | L374-S376 PolarHBondContact O-N 3.19Š| ||
| 377 | D | 25.7 | Very low | 32.8 | Very low | 151 Ų | 151 | 111.7 Ų | 111.7 | 81% | 0.807 | 65% | 0.646 | S | S | * | * | trans | 91.1 | 73.8 | 167.5 | -49.6 | -29 | 0 | 0 | 0 | 117.9 | ||||
| 378 | A | 26.6 | Very low | 31.1 | Very low | 107 Ų | 107 | 114.3 Ų | 114.3 | 88% | 0.884 | 67% | 0.671 | S | S | * | * | trans | -114.4 | 53 | 141.8 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 379 | S | 26.3 | Very low | 29.9 | Very low | 115 Ų | 115 | 117.8 Ų | 117.8 | 80% | 0.804 | 70% | 0.699 | S | S | * | * | trans | -132.9 | 59.7 | 167.8 | -63.3 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 380 | S | 29.8 | Very low | 28.4 | Very low | 108 Ų | 108 | 120 Ų | 120 | 76% | 0.755 | 72% | 0.722 | S | S | * | * | trans | -145.5 | 98.1 | 144 | 51.7 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 381 | S | 24.2 | Very low | 27.2 | Very low | 110 Ų | 110 | 123.2 Ų | 123.2 | 77% | 0.769 | 75% | 0.747 | S | S | * | * | trans | -16 | 132.3 | 147.7 | 50.4 | 0 | 0 | 0 | 0 | 115 | ||||
| 382 | S | 24.5 | Very low | 26.3 | Very low | 100 Ų | 100 | 120.6 Ų | 120.6 | 70% | 0.699 | 75% | 0.746 | S | S | * | * | 46.5 | 111.8 | 128.9 | -167.2 | 0 | 0 | 0 | 0 | 116.4 | |||||
| 383 | L | 23 | Very low | 25.7 | Very low | 149 Ų | 149 | 126.6 Ų | 126.6 | 78% | 0.78 | 77% | 0.769 | S | S | * | * | 175.8 | 114.2 | 115.4 | -88.4 | 160.5 | 0 | 0 | 0 | 111.3 | |||||
| 384 | R | 22.5 | Very low | 25.4 | Very low | 221 Ų | 221 | 125.7 Ų | 125.7 | 83% | 0.834 | 78% | 0.775 | S | S | * | * | trans | 66.7 | 126.6 | 146.5 | -76.3 | 178.9 | 168.8 | -122.8 | -1.2 | 120.7 | ||||
| 385 | P | 26 | Very low | 24.6 | Very low | 130 Ų | 130 | 126.5 Ų | 126.5 | 84% | 0.844 | 79% | 0.788 | S | S | * | * | trans | -86.3 | 137.7 | 160.8 | 33.6 | -26.8 | 0 | 0 | 0 | 110.6 | ||||
| 386 | P | 24 | Very low | 24.3 | Very low | 124 Ų | 124 | 132.2 Ų | 132.2 | 81% | 0.805 | 80% | 0.799 | S | S | * | * | trans | -110.4 | 133.4 | 150.1 | 27.7 | -13.5 | 0 | 0 | 0 | 109.9 | ||||
| 387 | M | 22.2 | Very low | 23.9 | Very low | 182 Ų | 182 | 131.6 Ų | 131.6 | 90% | 0.897 | 80% | 0.795 | S | S | * | * | trans | -54.6 | 148.8 | 176 | -65.3 | 160.2 | 62 | 0 | 0 | 112.3 | ||||
| 388 | S | 21.3 | Very low | 23.6 | Very low | 115 Ų | 115 | 129.5 Ų | 129.5 | 80% | 0.804 | 79% | 0.788 | S | S | * | * | trans | -53.7 | 155.9 | 168.7 | -45.6 | 0 | 0 | 0 | 0 | 113 | ||||
| 389 | P | 25.3 | Very low | 23.4 | Very low | 125 Ų | 125 | 137.1 Ų | 137.1 | 81% | 0.812 | 79% | 0.794 | S | S | * | * | -132.9 | 137.4 | 114.9 | 33.2 | -20.9 | 0 | 0 | 0 | 113.8 | |||||
| 390 | A | 21.3 | Very low | 23.1 | Very low | 86 Ų | 86 | 137.1 Ų | 137.1 | 71% | 0.711 | 79% | 0.789 | S | S | * | * | trans | 15.3 | 133.6 | 144.4 | 0 | 0 | 0 | 0 | 0 | 122.1 | ||||
| 391 | S | 23.2 | Very low | 22.7 | Very low | 112 Ų | 112 | 136.5 Ų | 136.5 | 78% | 0.783 | 78% | 0.784 | S | S | * | * | 102.5 | 142 | 128.2 | 74.2 | 0 | 0 | 0 | 0 | 121 | |||||
| 392 | S | 25.9 | Very low | 22.5 | Very low | 105 Ų | 105 | 139.3 Ų | 139.3 | 73% | 0.734 | 79% | 0.786 | S | S | * | * | trans | 75.5 | 97.4 | 164.8 | 61.5 | 0 | 0 | 0 | 0 | 120.8 | ||||
| 393 | Q | 23.4 | Very low | 22.5 | Very low | 203 Ų | 203 | 141.7 Ų | 141.7 | 95% | 0.949 | 79% | 0.791 | S | S | * | * | 39.5 | 126.9 | 114.9 | -68.7 | -178 | -13.8 | 0 | 0 | 120.3 | |||||
| 394 | G | 23.1 | Very low | 22.4 | Very low | 68 Ų | 68 | 139.1 Ų | 139.1 | 70% | 0.701 | 79% | 0.785 | S | S | * | * | trans | 159 | 75.2 | 160.7 | 0 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 395 | S | 19.3 | Very low | 22.4 | Very low | 101 Ų | 101 | 139.7 Ų | 139.7 | 71% | 0.706 | 79% | 0.787 | S | S | * | * | 46.3 | 93.5 | 94.9 | -161.3 | 0 | 0 | 0 | 0 | 113.8 | |||||
| 396 | W | 22.5 | Very low | 22.2 | Very low | 264 Ų | 264 | 137 Ų | 137 | 100% | 1 | 78% | 0.783 | S | S | * | * | trans | -119.5 | 88.2 | 148.1 | -78 | -10.8 | 0 | 0 | 0 | 108.4 | ||||
| 397 | S | 21.4 | Very low | 22.3 | Very low | 88 Ų | 88 | 139.4 Ų | 139.4 | 62% | 0.615 | 79% | 0.787 | S | S | * | * | trans | -69 | 137 | 163.9 | 48 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 398 | T | 19.8 | Very low | 22.2 | Very low | 106 Ų | 106 | 141.6 Ų | 141.6 | 65% | 0.65 | 79% | 0.785 | S | S | * | * | trans | 67 | 96.7 | 137 | -44.1 | 0 | 0 | 0 | 0 | 118.2 | T400 | T398-T400 HydrophobicContact CG2-CG2 3.93Å; T398-T400 VanDerWaalsContact CG2-OG1 3.26Å; T398-T400 WeakPolarHBondContact CG2-OG1 3.46Å | ||
| 399 | W | 21.5 | Very low | 22.3 | Very low | 268 Ų | 268 | 141.3 Ų | 141.3 | 100% | 1.015 | 78% | 0.784 | S | S | * | * | trans | -99.8 | 99.1 | 146.3 | -71.8 | 76 | 0 | 0 | 0 | 107.9 | ||||
| 400 | T | 20.8 | Very low | 22.2 | Very low | 114 Ų | 114 | 141.9 Ų | 141.9 | 70% | 0.699 | 78% | 0.784 | S | S | * | * | trans | -128 | 147.6 | 165.9 | 51.6 | 0 | 0 | 0 | 0 | 109.5 | T398 | T398-T400 HydrophobicContact CG2-CG2 3.93Å; T398-T400 VanDerWaalsContact CG2-OG1 3.26Å; T398-T400 WeakPolarHBondContact CG2-OG1 3.46Å | ||
| 401 | S | 20.9 | Very low | 22.1 | Very low | 95 Ų | 95 | 141.2 Ų | 141.2 | 66% | 0.664 | 79% | 0.786 | S | S | * | * | trans | 76.8 | 110.1 | 168.3 | -96.2 | 0 | 0 | 0 | 0 | 119.1 | ||||
| 402 | E | 20.2 | Very low | 22.3 | Very low | 170 Ų | 170 | 140.7 Ų | 140.7 | 79% | 0.794 | 79% | 0.788 | S | S | * | * | 56.1 | 109.1 | 122.3 | -71.9 | 164 | 133.4 | 0 | 0 | 118.2 | |||||
| 403 | N | 25.2 | Very low | 22.1 | Very low | 150 Ų | 150 | 141.6 Ų | 141.6 | 80% | 0.802 | 80% | 0.795 | S | S | * | * | -149.2 | 123.1 | 116.8 | -132.6 | -0.1 | 0 | 0 | 0 | 113 | |||||
| 404 | S | 20.7 | Very low | 22.3 | Very low | 95 Ų | 95 | 137.2 Ų | 137.2 | 66% | 0.664 | 79% | 0.786 | S | S | * | * | trans | -50.2 | 139.8 | 160.4 | -62 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 405 | R | 22.2 | Very low | 22.3 | Very low | 233 Ų | 233 | 138.9 Ų | 138.9 | 88% | 0.879 | 79% | 0.787 | S | S | * | * | 162.1 | 109.3 | 124.2 | -85.7 | 163.4 | -164.9 | 161.8 | 5.9 | 111.9 | |||||
| 406 | G | 21.5 | Very low | 22.7 | Very low | 73 Ų | 73 | 142.3 Ų | 142.3 | 75% | 0.753 | 79% | 0.792 | S | S | * | * | 63.4 | 101.8 | 127.2 | 0 | 0 | 0 | 0 | 0 | 119.7 | |||||
| 407 | I | 27 | Very low | 22.6 | Very low | 174 Ų | 174 | 140.5 Ų | 140.5 | 89% | 0.892 | 79% | 0.785 | S | S | * | * | trans | -129.5 | 118.2 | 134.7 | -61.4 | -177.9 | 0 | 0 | 0 | 108 | ||||
| 408 | R | 19.5 | Very low | 22.6 | Very low | 228 Ų | 228 | 143 Ų | 143 | 86% | 0.86 | 79% | 0.791 | S | S | * | * | trans | -89.1 | 150 | 172.2 | -75.1 | 178.6 | 178.5 | -142.2 | -1.1 | 110 | ||||
| 409 | S | 22.6 | Very low | 22.7 | Very low | 110 Ų | 110 | 145.7 Ų | 145.7 | 77% | 0.769 | 80% | 0.797 | S | S | * | * | trans | 65.3 | 138.8 | 157.3 | 70.9 | 0 | 0 | 0 | 0 | 116.1 | ||||
| 410 | V | 23.4 | Very low | 22.7 | Very low | 136 Ų | 136 | 140.6 Ų | 140.6 | 82% | 0.824 | 79% | 0.785 | S | S | * | * | cis | -149.4 | 148.5 | 48.7 | 168.3 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 411 | G | 20.5 | Very low | 22.8 | Very low | 73 Ų | 73 | 140.9 Ų | 140.9 | 75% | 0.753 | 79% | 0.789 | S | S | * | * | trans | -69.2 | 153.7 | -174.2 | 0 | 0 | 0 | 0 | 0 | 115.7 | ||||
| 412 | A | 27 | Very low | 23 | Very low | 100 Ų | 100 | 143.5 Ų | 143.5 | 83% | 0.826 | 79% | 0.794 | S | S | * | * | trans | -129.6 | 115.5 | 149.2 | 0 | 0 | 0 | 0 | 0 | 106.8 | S414 | A412-S414 PolarHBondContact O-N 2.85Š| ||
| 413 | S | 21.9 | Very low | 23 | Very low | 124 Ų | 124 | 141.3 Ų | 141.3 | 87% | 0.867 | 80% | 0.798 | S | S | * | * | trans | -61.5 | 115.5 | 173.7 | -177.4 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 414 | S | 27 | Very low | 23.2 | Very low | 111 Ų | 111 | 139.2 Ų | 139.2 | 78% | 0.776 | 79% | 0.79 | S | S | * | * | trans | -149 | 94.1 | 158.1 | -154.8 | 0 | 0 | 0 | 0 | 108.9 | A412 Q416 | A412-S414 PolarHBondContact O-N 2.85Å; S414-Q416 PolarHBondContact O-N 2.88Å | ||
| 415 | S | 24.2 | Very low | 23.4 | Very low | 103 Ų | 103 | 142 Ų | 142 | 72% | 0.72 | 80% | 0.797 | S | S | * | * | trans | 2.4 | 86.1 | 161.6 | -55.4 | 0 | 0 | 0 | 0 | 115.8 | W417 | S415-W417 PolarHBondContact O-N 3.29Š| ||
| 416 | Q | 26.1 | Very low | 23.8 | Very low | 174 Ų | 174 | 141 Ų | 141 | 81% | 0.813 | 79% | 0.793 | S | S | * | * | trans | -73.3 | 110.9 | 164.7 | -139.9 | 168.3 | 10.3 | 0 | 0 | 107.2 | S414 I418 | S414-Q416 PolarHBondContact O-N 2.88Å; Q416-I418 PolarHBondContact O-N 2.9Å | ||
| 417 | W | 21.3 | Very low | 24.3 | Very low | 225 Ų | 225 | 142.5 Ų | 142.5 | 85% | 0.852 | 79% | 0.792 | S | S | * | * | trans | -63.2 | 89.4 | 169.6 | -69.5 | 82.9 | 0 | 0 | 0 | 108.5 | S415 M419 | S415-W417 PolarHBondContact O-N 3.29Å; W417-M419 PolarHBondContact O-N 3.46Å | ||
| 418 | I | 22.2 | Very low | 24.5 | Very low | 142 Ų | 142 | 139 Ų | 139 | 73% | 0.728 | 78% | 0.783 | S | S | * | * | trans | -68.4 | 100.3 | 169.3 | -63.1 | 173.9 | 0 | 0 | 0 | 106.2 | Q416 Q420 | Q416-I418 PolarHBondContact O-N 2.9Å; I418-Q420 PolarHBondContact O-N 2.8Å | ||
| 419 | M | 22 | Very low | 25.2 | Very low | 161 Ų | 161 | 131.5 Ų | 131.5 | 79% | 0.793 | 77% | 0.766 | S | S | * | * | trans | -64.8 | 99.3 | 171.2 | -77.6 | -77.4 | 148.4 | 0 | 0 | 108.6 | W417 | W417-M419 PolarHBondContact O-N 3.46Š| ||
| 420 | Q | 20.6 | Very low | 25.7 | Very low | 161 Ų | 161 | 131.2 Ų | 131.2 | 75% | 0.752 | 76% | 0.755 | S | S | * | * | trans | -72.7 | 128.9 | 164 | -74.2 | -174.7 | -18.2 | 0 | 0 | 108.8 | I418 I422 | I418-Q420 PolarHBondContact O-N 2.8Å; Q420-I422 PolarHBondContact O-N 2.99Å; Q420-I422 VanDerWaalsContact O-N 3.13Å | ||
| 421 | P | 23.6 | Very low | 26.3 | Very low | 121 Ų | 121 | 129 Ų | 129 | 79% | 0.786 | 74% | 0.744 | S | S | * | * | trans | -69.2 | 110.6 | 176 | 26.8 | -30.7 | 0 | 0 | 0 | 109.1 | S423 | P421-S423 PolarHBondContact O-N 3.18Å; P421-S423 VanDerWaalsContact O-N 3.09Å | ||
| 422 | I | 23.6 | Very low | 26.9 | Very low | 150 Ų | 150 | 131 Ų | 131 | 77% | 0.769 | 74% | 0.737 | S | S | * | * | trans | -68.4 | 106.5 | 170.7 | -60.1 | 169.9 | 0 | 0 | 0 | 107 | Q420 V424 | Q420-I422 PolarHBondContact O-N 2.99Å; Q420-I422 VanDerWaalsContact O-N 3.13Å; I422-V424 HydrophobicContact CG2-CG2 3.7Å; I422-V424 PolarHBondContact O-N 3.28Å | ||
| 423 | S | 21.6 | Very low | 27.2 | Very low | 124 Ų | 124 | 131.3 Ų | 131.3 | 87% | 0.867 | 72% | 0.724 | S | S | * | * | trans | -62 | 98.5 | 164.9 | -69.5 | 0 | 0 | 0 | 0 | 108.8 | P421 | P421-S423 PolarHBondContact O-N 3.18Å; P421-S423 VanDerWaalsContact O-N 3.09Å | ||
| 424 | V | 28.8 | Very low | 28 | Very low | 105 Ų | 105 | 133.6 Ų | 133.6 | 64% | 0.636 | 72% | 0.715 | S | S | * | * | trans | -102.8 | 115.7 | 163.4 | -174.7 | 0 | 0 | 0 | 0 | 106.6 | I422 R426 | I422-V424 HydrophobicContact CG2-CG2 3.7Å; I422-V424 PolarHBondContact O-N 3.28Å; V424-R426 PolarHBondContact O-N 2.88Å | ||
| 425 | D | 24.1 | Very low | 28.5 | Very low | 153 Ų | 153 | 134.7 Ų | 134.7 | 82% | 0.818 | 71% | 0.708 | S | S | * | * | trans | -50.9 | 102.2 | 173.8 | -106.8 | -34.1 | 0 | 0 | 0 | 110.2 | S427 | D425-S427 PolarHBondContact O-N 3.26Š| ||
| 426 | R | 30.5 | Very low | 29.1 | Very low | 212 Ų | 212 | 139.2 Ų | 139.2 | 80% | 0.8 | 71% | 0.709 | S | S | * | * | trans | -95.8 | 82 | 177.2 | -79.5 | -175.9 | 177 | 178.6 | 0.3 | 108.9 | V424 L430 | V424-R426 PolarHBondContact O-N 2.88Å; R426-L430 HydrophobicContact CB-CD1 4.46Å; R426-L430 HydrophobicContact CG-CD1 4.31Å | ||
| 427 | S | 33.3 | Very low | 29.6 | Very low | 105 Ų | 105 | 134.6 Ų | 134.6 | 73% | 0.734 | 69% | 0.692 | S | S | * | * | S | Bend | trans | -143.7 | -14.4 | 165.8 | 62.1 | 0 | 0 | 0 | 0 | 116.7 | D425 | D425-S427 PolarHBondContact O-N 3.26Š|
| 428 | S | 31.5 | Very low | 30.5 | Very low | 100 Ų | 100 | 126.8 Ų | 126.8 | 70% | 0.699 | 67% | 0.67 | S | S | * | * | S | Bend | trans | -123.5 | -12.3 | -172.9 | 59.2 | 0 | 0 | 0 | 0 | 118.3 | ||
| 429 | S | 32.6 | Very low | 31.1 | Very low | 72 Ų | 72 | 122.8 Ų | 122.8 | 50% | 0.503 | 66% | 0.657 | S | S | . | * | S | Bend | trans | -114.3 | -9.6 | -174.2 | 62.7 | 0 | 0 | 0 | 0 | 116.7 | L432 L433 | S429-L432 PolarHBondContact O-N 3.36Å; S429-L433 PolarHBondContact O-N 2.87Å |
| 430 | L | 34.3 | Very low | 31.7 | Very low | 103 Ų | 103 | 117.9 Ų | 117.9 | 54% | 0.539 | 64% | 0.642 | S | S | . | * | H | α-helix | trans | -65.9 | -38.4 | -179.8 | -90.8 | 156.2 | 0 | 0 | 0 | 114.8 | R426 L432 L433 Y434 | R426-L430 HydrophobicContact CB-CD1 4.46Å; R426-L430 HydrophobicContact CG-CD1 4.31Å; L430-L432 VanDerWaalsContact C-N 3.32Å; L430-L432 PolarHBondContact O-N 2.95Å; L430-L433 PolarHBondContact O-N 2.88Å; L430-Y434 WeakPolarHBondContact O-CB 3.41Å; L430-Y434 PolarHBondContact O-N 2.85Å |
| 431 | P | 36.3 | Very low | 32.3 | Very low | 90 Ų | 90 | 115.7 Ų | 115.7 | 58% | 0.584 | 63% | 0.632 | S | S | * | * | H | α-helix | trans | -63.4 | -37.2 | 177.3 | -23.8 | 34.6 | 0 | 0 | 0 | 112.9 | Y434 Q435 | P431-Y434 PolarHBondContact O-N 3.46Å; P431-Q435 WeakPolarHBondContact O-CB 3.4Å; P431-Q435 PolarHBondContact O-N 2.94Å |
| 432 | L | 33.2 | Very low | 32.8 | Very low | 116 Ų | 116 | 112.8 Ų | 112.8 | 61% | 0.607 | 62% | 0.618 | S | S | * | * | H | α-helix | trans | -73.6 | -35.7 | -179.2 | -72.4 | 170.8 | 0 | 0 | 0 | 112.6 | S429 L430 R436 | S429-L432 PolarHBondContact O-N 3.36Å; L430-L432 VanDerWaalsContact C-N 3.32Å; L430-L432 PolarHBondContact O-N 2.95Å; L432-R436 WeakPolarHBondContact O-CB 3.45Å; L432-R436 WeakPolarHBondContact O-CG 3.28Å; L432-R436 PolarHBondContact O-N 3.34Å |
| 433 | L | 33.1 | Very low | 33.2 | Very low | 106 Ų | 106 | 108.1 Ų | 108.1 | 56% | 0.555 | 60% | 0.603 | S | S | * | * | H | α-helix | trans | -67.5 | -41.9 | 172.4 | -88.6 | 165.7 | 0 | 0 | 0 | 111.5 | S429 L430 R436 V437 | S429-L433 PolarHBondContact O-N 2.87Å; L430-L433 PolarHBondContact O-N 2.88Å; L433-R436 PolarHBondContact O-N 3.37Å; L433-V437 VanDerWaalsContact O-CG2 3.3Å; L433-V437 WeakPolarHBondContact O-CG2 3.4Å; L433-V437 PolarHBondContact O-N 3.34Å |
| 434 | Y | 37.6 | Very low | 33.9 | Very low | 171 Ų | 171 | 105.1 Ų | 105.1 | 67% | 0.671 | 59% | 0.585 | S | S | * | * | H | α-helix | trans | -63.4 | -44.8 | 176.3 | -173.2 | -103.4 | 0 | 0 | 0 | 111.6 | L430 P431 R436 V437 V438 | L430-Y434 WeakPolarHBondContact O-CB 3.41Å; L430-Y434 PolarHBondContact O-N 2.85Å; P431-Y434 PolarHBondContact O-N 3.46Å; Y434-R436 VanDerWaalsContact C-N 3.31Å; Y434-R436 PolarHBondContact O-N 2.89Å; Y434-V437 PolarHBondContact O-N 2.9Å; Y434-V438 HydrophobicContact CD1-CG2 4.02Å; Y434-V438 HydrophobicContact CE1-CG2 3.69Å; Y434-V438 HydrophobicContact CE2-CG2 4.24Å; Y434-V438 HydrophobicContact CG-CG2 4.43Å; Y434-V438 WeakPolarHBondContact O-CB 3.33Å; Y434-V438 VanDerWaalsContact O-CG2 3.25Å; Y434-V438 WeakPolarHBondContact O-CG2 3.28Å; Y434-V438 PolarHBondContact O-N 3.43Å |
| 435 | Q | 39 | Very low | 34.1 | Very low | 135 Ų | 135 | 105.3 Ų | 105.3 | 63% | 0.631 | 59% | 0.59 | S | S | * | * | H | α-helix | trans | -65.7 | -34.3 | 177.8 | -163.4 | 169.7 | 10.1 | 0 | 0 | 112.3 | P431 A439 | P431-Q435 WeakPolarHBondContact O-CB 3.4Å; P431-Q435 PolarHBondContact O-N 2.94Å; Q435-A439 WeakPolarHBondContact O-CB 3.44Å; Q435-A439 PolarHBondContact O-N 3.44Å |
| 436 | R | 35.7 | Very low | 34.4 | Very low | 197 Ų | 197 | 103.9 Ų | 103.9 | 74% | 0.743 | 58% | 0.582 | S | S | * | * | H | α-helix | trans | -67.1 | -39.9 | 171.7 | -85.1 | -178.1 | 150.6 | 179 | -5.4 | 113 | L432 L433 Y434 A440 | L432-R436 WeakPolarHBondContact O-CB 3.45Å; L432-R436 WeakPolarHBondContact O-CG 3.28Å; L432-R436 PolarHBondContact O-N 3.34Å; L433-R436 PolarHBondContact O-N 3.37Å; Y434-R436 VanDerWaalsContact C-N 3.31Å; Y434-R436 PolarHBondContact O-N 2.89Å; R436-A440 VanDerWaalsContact O-CB 3.23Å; R436-A440 WeakPolarHBondContact O-CB 3.29Å; R436-A440 PolarHBondContact O-N 3.49Å |
| 437 | V | 37.5 | Very low | 34.4 | Very low | 77 Ų | 77 | 96.5 Ų | 96.5 | 47% | 0.467 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -67.7 | -44.6 | 177 | 172.5 | 0 | 0 | 0 | 0 | 110.6 | L433 Y434 A440 E441 | L433-V437 VanDerWaalsContact O-CG2 3.3Å; L433-V437 WeakPolarHBondContact O-CG2 3.4Å; L433-V437 PolarHBondContact O-N 3.34Å; Y434-V437 PolarHBondContact O-N 2.9Å; V437-A440 PolarHBondContact O-N 2.91Å; V437-E441 WeakPolarHBondContact O-CG 3.17Å; V437-E441 PolarHBondContact O-N 3.47Å |
| 438 | V | 39.2 | Very low | 34.3 | Very low | 62 Ų | 62 | 95.6 Ų | 95.6 | 38% | 0.376 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -65.1 | -41.3 | 177.2 | 174.7 | 0 | 0 | 0 | 0 | 111.2 | Y434 A440 E441 A442 | Y434-V438 HydrophobicContact CD1-CG2 4.02Å; Y434-V438 HydrophobicContact CE1-CG2 3.69Å; Y434-V438 HydrophobicContact CE2-CG2 4.24Å; Y434-V438 HydrophobicContact CG-CG2 4.43Å; Y434-V438 WeakPolarHBondContact O-CB 3.33Å; Y434-V438 VanDerWaalsContact O-CG2 3.25Å; Y434-V438 WeakPolarHBondContact O-CG2 3.28Å; Y434-V438 PolarHBondContact O-N 3.43Å; V438-A440 VanDerWaalsContact C-N 3.34Å; V438-E441 PolarHBondContact O-N 2.83Å; V438-A442 WeakPolarHBondContact O-CB 3.45Å; V438-A442 PolarHBondContact O-N 2.98Å |
| 439 | A | 34.8 | Very low | 34.1 | Very low | 57 Ų | 57 | 95.8 Ų | 95.8 | 47% | 0.471 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -65.8 | -37.1 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112 | Q435 A442 A443 | Q435-A439 WeakPolarHBondContact O-CB 3.44Å; Q435-A439 PolarHBondContact O-N 3.44Å; A439-A442 PolarHBondContact O-N 2.87Å; A439-A443 VanDerWaalsContact O-CB 3.26Å; A439-A443 WeakPolarHBondContact O-CB 3.48Å; A439-A443 PolarHBondContact O-N 2.94Å |
| 440 | A | 35.4 | Very low | 34.2 | Very low | 58 Ų | 58 | 97.1 Ų | 97.1 | 48% | 0.479 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -67.9 | -36.8 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | R436 V437 V438 A444 | R436-A440 VanDerWaalsContact O-CB 3.23Å; R436-A440 WeakPolarHBondContact O-CB 3.29Å; R436-A440 PolarHBondContact O-N 3.49Å; V437-A440 PolarHBondContact O-N 2.91Å; V438-A440 VanDerWaalsContact C-N 3.34Å; A440-A444 VanDerWaalsContact O-CB 3.25Å; A440-A444 WeakPolarHBondContact O-CB 3.4Å; A440-A444 PolarHBondContact O-N 2.84Å |
| 441 | E | 33.7 | Very low | 33.9 | Very low | 115 Ų | 115 | 98 Ų | 98 | 54% | 0.537 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -67.5 | -43.7 | 173.4 | -75.5 | -176.6 | 160 | 0 | 0 | 111.5 | V437 V438 A443 A444 C445 | V437-E441 WeakPolarHBondContact O-CG 3.17Å; V437-E441 PolarHBondContact O-N 3.47Å; V438-E441 PolarHBondContact O-N 2.83Å; E441-A443 VanDerWaalsContact C-N 3.34Å; E441-A443 PolarHBondContact O-N 3.32Å; E441-A444 PolarHBondContact O-N 3.06Å; E441-C445 PolarHBondContact O-N 3.47Å; E441-C445 PolarHBondContact O-SG 3.44Å; E441-C445 VanDerWaalsContact O-SG 3.35Å |
| 442 | A | 33.6 | Very low | 33.6 | Very low | 60 Ų | 60 | 103.6 Ų | 103.6 | 50% | 0.496 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -63.8 | -38.3 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | V438 A439 C445 | V438-A442 WeakPolarHBondContact O-CB 3.45Å; V438-A442 PolarHBondContact O-N 2.98Å; A439-A442 PolarHBondContact O-N 2.87Å; A442-C445 PolarHBondContact O-N 2.93Å |
| 443 | A | 32.6 | Very low | 33.5 | Very low | 53 Ų | 53 | 102.6 Ų | 102.6 | 44% | 0.438 | 57% | 0.568 | S | S | . | * | H | α-helix | trans | -69 | -36.2 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112.2 | A439 E441 C445 N446 | A439-A443 VanDerWaalsContact O-CB 3.26Å; A439-A443 WeakPolarHBondContact O-CB 3.48Å; A439-A443 PolarHBondContact O-N 2.94Å; E441-A443 VanDerWaalsContact C-N 3.34Å; E441-A443 PolarHBondContact O-N 3.32Å; A443-C445 VanDerWaalsContact C-N 3.3Å; A443-C445 PolarHBondContact O-N 2.92Å; A443-N446 PolarHBondContact O-N 2.89Å |
| 444 | A | 35.3 | Very low | 33.6 | Very low | 61 Ų | 61 | 102.3 Ų | 102.3 | 50% | 0.504 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -69.7 | -25.6 | 176.9 | 0 | 0 | 0 | 0 | 0 | 113.2 | A440 E441 N446 | A440-A444 VanDerWaalsContact O-CB 3.25Å; A440-A444 WeakPolarHBondContact O-CB 3.4Å; A440-A444 PolarHBondContact O-N 2.84Å; E441-A444 PolarHBondContact O-N 3.06Å; A444-N446 VanDerWaalsContact C-N 3.29Å |
| 445 | C | 33.1 | Very low | 33.1 | Very low | 108 Ų | 108 | 100.3 Ų | 100.3 | 73% | 0.73 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -73.2 | -18.2 | 173.4 | -70.6 | 0 | 0 | 0 | 0 | 113.6 | E441 A442 A443 G447 | E441-C445 PolarHBondContact O-N 3.47Å; E441-C445 PolarHBondContact O-SG 3.44Å; E441-C445 VanDerWaalsContact O-SG 3.35Å; A442-C445 PolarHBondContact O-N 2.93Å; A443-C445 VanDerWaalsContact C-N 3.3Å; A443-C445 PolarHBondContact O-N 2.92Å; C445-G447 PolarHBondContact O-N 3.23Å |
| 446 | N | 30.2 | Very low | 32.5 | Very low | 123 Ų | 123 | 100.7 Ų | 100.7 | 66% | 0.658 | 57% | 0.573 | S | S | * | * | S | Bend | trans | -86.1 | 91 | 169.6 | -75.9 | -23 | 0 | 0 | 0 | 109 | A443 A444 A448 | A443-N446 PolarHBondContact O-N 2.89Å; A444-N446 VanDerWaalsContact C-N 3.29Å; N446-A448 PolarHBondContact O-N 2.67Å |
| 447 | G | 31.3 | Very low | 32.1 | Very low | 57 Ų | 57 | 97.6 Ų | 97.6 | 59% | 0.588 | 57% | 0.572 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -60.7 | 17.8 | -174.3 | 0 | 0 | 0 | 0 | 0 | 117.9 | C445 | C445-G447 PolarHBondContact O-N 3.23Š|
| 448 | A | 30.4 | Very low | 31.8 | Very low | 87 Ų | 87 | 100.5 Ų | 100.5 | 72% | 0.719 | 59% | 0.592 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87.2 | -21.4 | 178.3 | 0 | 0 | 0 | 0 | 0 | 113.9 | N446 | N446-A448 PolarHBondContact O-N 2.67Š|
| 449 | L | 28.6 | Very low | 31.2 | Very low | 103 Ų | 103 | 102.6 Ų | 102.6 | 54% | 0.539 | 61% | 0.609 | S | S | . | * | S | Bend | trans | -85.8 | -16.6 | -177.9 | -112.6 | 158.6 | 0 | 0 | 0 | 113.8 | ||
| 450 | F | 33.8 | Very low | 30.8 | Very low | 100 Ų | 100 | 105.1 Ų | 105.1 | 44% | 0.439 | 62% | 0.623 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -79.2 | -33.9 | -173.6 | -153.7 | -93.1 | 0 | 0 | 0 | 113.6 | L454 | F450-L454 HydrophobicContact CD1-CD1 4.32Å; F450-L454 HydrophobicContact CE1-CD1 3.86Å; F450-L454 HydrophobicContact CZ-CD1 4.24Å |
| 451 | D | 27.7 | Very low | 30.2 | Very low | 122 Ų | 122 | 108.9 Ų | 108.9 | 65% | 0.652 | 64% | 0.641 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80.6 | -21.5 | -179.1 | -72.3 | -22.9 | 0 | 0 | 0 | 112.9 | ||
| 452 | R | 30.7 | Very low | 29.9 | Very low | 208 Ų | 208 | 109 Ų | 109 | 79% | 0.785 | 65% | 0.652 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87.1 | -23.1 | -175.6 | -147.1 | 174.5 | 91.7 | 135.6 | 2.7 | 114.5 | ||
| 453 | E | 29.6 | Very low | 29.5 | Very low | 95 Ų | 95 | 112.2 Ų | 112.2 | 44% | 0.444 | 67% | 0.667 | S | S | . | * | S | Bend | trans | -104.2 | -1.6 | -170.7 | -94.4 | 171.9 | 178.6 | 0 | 0 | 115.3 | R301 | R301-E453 IonicContact CZ-OE2 3.24Å; R301-E453 PolarHBondContact NH1-O 2.84Å; R301-E453 VanDerWaalsContact NH2-CB 3.33Å; R301-E453 IonicContact NH2-OE2 3.34Å; R301-E453 PolarHBondContact NH2-OE2 3.14Å |
| 454 | L | 35.8 | Very low | 29 | Very low | 100 Ų | 100 | 114.5 Ų | 114.5 | 52% | 0.524 | 68% | 0.68 | S | S | . | * | S | Bend | trans | -102.2 | -16.5 | 171.1 | -82.9 | 160.2 | 0 | 0 | 0 | 113.3 | F450 | F450-L454 HydrophobicContact CD1-CD1 4.32Å; F450-L454 HydrophobicContact CE1-CD1 3.86Å; F450-L454 HydrophobicContact CZ-CD1 4.24Å |
| 455 | N | 27.8 | Very low | 28.4 | Very low | 128 Ų | 128 | 116.6 Ų | 116.6 | 68% | 0.684 | 69% | 0.691 | S | S | * | * | trans | -102 | 35.3 | -176.2 | -73.1 | -12.6 | 0 | 0 | 0 | 113.8 | D457 | N455-D457 PolarHBondContact O-N 3.3Š| ||
| 456 | N | 26.3 | Very low | 28.1 | Very low | 143 Ų | 143 | 118 Ų | 118 | 77% | 0.765 | 70% | 0.696 | S | S | * | * | trans | -91.5 | 84.7 | 166.2 | -83.8 | -12 | 0 | 0 | 0 | 109 | ||||
| 457 | D | 27 | Very low | 27.7 | Very low | 133 Ų | 133 | 118.7 Ų | 118.7 | 71% | 0.711 | 70% | 0.7 | S | S | * | * | trans | -70.8 | 131.6 | 163.5 | -86.2 | -37.7 | 0 | 0 | 0 | 109.4 | N455 S459 | N455-D457 PolarHBondContact O-N 3.3Å; D457-S459 PolarHBondContact O-N 3.15Å | ||
| 458 | P | 32.2 | Very low | 27.3 | Very low | 138 Ų | 138 | 122.4 Ų | 122.4 | 90% | 0.896 | 71% | 0.706 | S | S | * | * | S | Bend | trans | -72.4 | 13.7 | -176.1 | -14.4 | 28.7 | 0 | 0 | 0 | 115.8 | ||
| 459 | S | 25.4 | Very low | 26.9 | Very low | 105 Ų | 105 | 122.9 Ų | 122.9 | 73% | 0.734 | 70% | 0.704 | S | S | * | * | trans | -122.8 | 68.7 | -177.7 | 65 | 0 | 0 | 0 | 0 | 111.8 | D457 | D457-S459 PolarHBondContact O-N 3.15Š| ||
| 460 | S | 26.2 | Very low | 26.7 | Very low | 110 Ų | 110 | 125.3 Ų | 125.3 | 77% | 0.769 | 72% | 0.723 | S | S | * | * | trans | -152.2 | 111.1 | 153.6 | 52.6 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 461 | T | 24.2 | Very low | 26.2 | Very low | 137 Ų | 137 | 124 Ų | 124 | 84% | 0.84 | 74% | 0.737 | S | S | * | * | P | Polyproline II helix | trans | -63.2 | 147.2 | 167.9 | 22.6 | 0 | 0 | 0 | 0 | 110.6 | ||
| 462 | P | 25.8 | Very low | 25.9 | Very low | 118 Ų | 118 | 126.5 Ų | 126.5 | 77% | 0.766 | 75% | 0.745 | S | S | * | * | P | Polyproline II helix | trans | -79.3 | 137.2 | -167.9 | 31.4 | -33.3 | 0 | 0 | 0 | 111.5 | S464 | P462-S464 PolarHBondContact O-N 3.26Š|
| 463 | P | 26.6 | Very low | 25.6 | Very low | 127 Ų | 127 | 125.9 Ų | 125.9 | 83% | 0.825 | 75% | 0.751 | S | S | * | * | P | Polyproline II helix | trans | -79.6 | 123.2 | 172.1 | 30 | -28.1 | 0 | 0 | 0 | 110.3 | ||
| 464 | S | 21.9 | Very low | 25.2 | Very low | 101 Ų | 101 | 128.6 Ų | 128.6 | 71% | 0.706 | 76% | 0.764 | S | S | * | * | P | Polyproline II helix | trans | -59.5 | 139.8 | 165.5 | 48.1 | 0 | 0 | 0 | 0 | 113.1 | P462 | P462-S464 PolarHBondContact O-N 3.26Š|
| 465 | S | 21.7 | Very low | 24.8 | Very low | 106 Ų | 106 | 129.7 Ų | 129.7 | 74% | 0.741 | 78% | 0.78 | S | S | * | * | trans | 15 | 112.6 | 142.6 | 58.3 | 0 | 0 | 0 | 0 | 118.7 | ||||
| 466 | V | 27.7 | Very low | 24.5 | Very low | 136 Ų | 136 | 132.3 Ų | 132.3 | 82% | 0.824 | 79% | 0.788 | S | S | * | * | trans | -149.7 | 106.8 | 135.6 | -176.8 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 467 | D | 21.9 | Very low | 24.3 | Very low | 138 Ų | 138 | 128.9 Ų | 128.9 | 74% | 0.738 | 79% | 0.786 | S | S | * | * | trans | 30.2 | 132 | 134.2 | -62.2 | -30.4 | 0 | 0 | 0 | 123.9 | ||||
| 468 | D | 22.8 | Very low | 24.2 | Very low | 136 Ų | 136 | 132.1 Ų | 132.1 | 73% | 0.727 | 79% | 0.794 | S | S | * | * | 88.1 | 107.2 | 126.5 | -82 | -37.3 | 0 | 0 | 0 | 122.5 | |||||
| 469 | S | 22.2 | Very low | 23.7 | Very low | 97 Ų | 97 | 132.6 Ų | 132.6 | 68% | 0.678 | 79% | 0.788 | S | S | * | * | 65.6 | 108 | 115.5 | -62.3 | 0 | 0 | 0 | 0 | 118.8 | |||||
| 470 | V | 23.7 | Very low | 23.8 | Very low | 153 Ų | 153 | 136.2 Ų | 136.2 | 93% | 0.927 | 80% | 0.798 | S | S | * | * | 163.2 | 127.4 | 115.7 | 164.9 | 0 | 0 | 0 | 0 | 108.9 | |||||
| 471 | G | 22.9 | Very low | 23.6 | Very low | 72 Ų | 72 | 136.1 Ų | 136.1 | 74% | 0.742 | 80% | 0.797 | S | S | * | * | trans | 147.4 | 56.1 | 161.3 | 0 | 0 | 0 | 0 | 0 | 117.1 | Q473 | G471-Q473 PolarHBondContact O-N 3.47Š| ||
| 472 | Q | 21.3 | Very low | 23.6 | Very low | 175 Ų | 175 | 132.7 Ų | 132.7 | 82% | 0.818 | 79% | 0.79 | S | S | * | * | trans | -56.7 | 124.1 | 156.6 | -88.5 | 173.8 | -37 | 0 | 0 | 110.1 | ||||
| 473 | Q | 24.9 | Very low | 23.6 | Very low | 196 Ų | 196 | 136.2 Ų | 136.2 | 92% | 0.916 | 80% | 0.796 | S | S | * | * | trans | -137.4 | 111.1 | 144.1 | -79 | -165.2 | -18.3 | 0 | 0 | 109.9 | G471 | G471-Q473 PolarHBondContact O-N 3.47Š| ||
| 474 | H | 21 | Very low | 23.4 | Very low | 152 Ų | 152 | 141 Ų | 141 | 70% | 0.704 | 80% | 0.797 | S | S | * | * | trans | -65.6 | 136.2 | 164.7 | -92.3 | -101.4 | 0 | 0 | 0 | 110.8 | ||||
| 475 | S | 27.4 | Very low | 23.8 | Very low | 123 Ų | 123 | 142 Ų | 142 | 86% | 0.86 | 80% | 0.801 | S | S | * | * | trans | -161.1 | 94.5 | 137.6 | 56.5 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 476 | E | 20.6 | Very low | 24 | Very low | 182 Ų | 182 | 144.1 Ų | 144.1 | 85% | 0.85 | 80% | 0.804 | S | S | * | * | trans | -71.2 | 150.5 | 158.7 | -65.9 | 176.6 | 134.2 | 0 | 0 | 110.1 | ||||
| 477 | G | 23.2 | Very low | 23.8 | Very low | 71 Ų | 71 | 144 Ų | 144 | 73% | 0.732 | 80% | 0.803 | S | S | * | * | trans | 154.5 | 106 | 153.9 | 0 | 0 | 0 | 0 | 0 | 118.6 | ||||
| 478 | K | 24.7 | Very low | 24.1 | Very low | 202 Ų | 202 | 145.2 Ų | 145.2 | 88% | 0.878 | 81% | 0.809 | S | S | * | * | trans | 84.2 | 106.7 | 146.3 | -67.5 | 172.7 | 174.5 | 174.5 | 0 | 118.6 | ||||
| 479 | L | 21.2 | Very low | 24.5 | Very low | 148 Ų | 148 | 143.6 Ų | 143.6 | 78% | 0.775 | 81% | 0.806 | S | S | * | * | 56.3 | 95.2 | 76.8 | -89 | 150.6 | 0 | 0 | 0 | 114.2 | |||||
| 480 | L | 27.3 | Very low | 24.8 | Very low | 181 Ų | 181 | 146.6 Ų | 146.6 | 95% | 0.948 | 81% | 0.813 | S | S | * | * | trans | -140 | 82.8 | 143.7 | -78.7 | 178.4 | 0 | 0 | 0 | 109 | ||||
| 481 | S | 22.2 | Very low | 24.9 | Very low | 107 Ų | 107 | 151 Ų | 151 | 75% | 0.748 | 81% | 0.813 | S | S | * | * | trans | -72.3 | 118 | 153.2 | 50.4 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 482 | G | 25 | Very low | 24.8 | Very low | 66 Ų | 66 | 151.6 Ų | 151.6 | 68% | 0.68 | 81% | 0.811 | S | S | * | * | trans | -145.5 | 100.4 | -179.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 483 | H | 25.5 | Very low | 24.9 | Very low | 192 Ų | 192 | 150.6 Ų | 150.6 | 89% | 0.889 | 81% | 0.811 | S | S | * | * | trans | 60.5 | 94.6 | 155.2 | -73.1 | -61.4 | 0 | 0 | 0 | 120.6 | ||||
| 484 | R | 22.5 | Very low | 25.4 | Very low | 227 Ų | 227 | 153 Ų | 153 | 86% | 0.857 | 83% | 0.83 | S | S | * | * | P | Polyproline II helix | trans | -73.9 | 131.6 | 141.2 | -139.6 | -179 | -170.4 | -175.2 | 1.4 | 108 | ||
| 485 | P | 30.3 | Very low | 25.6 | Very low | 121 Ų | 121 | 153.1 Ų | 153.1 | 79% | 0.786 | 84% | 0.837 | S | S | * | * | P | Polyproline II helix | trans | -79 | 126 | 165.5 | 25.7 | -20.7 | 0 | 0 | 0 | 109 | ||
| 486 | D | 26.7 | Very low | 25.5 | Very low | 151 Ų | 151 | 154.6 Ų | 154.6 | 81% | 0.807 | 84% | 0.835 | S | S | * | * | P | Polyproline II helix | trans | -61.2 | 144.6 | 177.3 | -75.5 | -47.8 | 0 | 0 | 0 | 112.5 | ||
| 487 | V | 23.6 | Very low | 25.7 | Very low | 133 Ų | 133 | 153.1 Ų | 153.1 | 81% | 0.806 | 83% | 0.834 | S | S | * | * | P | Polyproline II helix | trans | -61.2 | 128 | 163.9 | 173.2 | 0 | 0 | 0 | 0 | 108.7 | ||
| 488 | L | 26.2 | Very low | 25.9 | Very low | 165 Ų | 165 | 157.9 Ų | 157.9 | 86% | 0.864 | 84% | 0.84 | S | S | * | * | trans | -115.8 | 127.3 | 159 | -86.2 | 168.9 | 0 | 0 | 0 | 109.4 | ||||
| 489 | P | 31.2 | Very low | 26 | Very low | 102 Ų | 102 | 155.2 Ų | 155.2 | 66% | 0.662 | 84% | 0.838 | S | S | * | * | trans | -96 | 142 | -178.6 | 36.3 | -29.8 | 0 | 0 | 0 | 111.1 | ||||
| 490 | I | 29.6 | Very low | 26.3 | Very low | 160 Ų | 160 | 155.7 Ų | 155.7 | 82% | 0.821 | 84% | 0.842 | S | S | * | * | trans | -131 | 98.2 | 170.4 | -60 | 177.8 | 0 | 0 | 0 | 109 | ||||
| 491 | W | 25.9 | Very low | 26.2 | Very low | 245 Ų | 245 | 153.9 Ų | 153.9 | 93% | 0.928 | 84% | 0.835 | S | S | * | * | trans | 44.3 | 116.4 | 146 | -62.8 | -6.5 | 0 | 0 | 0 | 121.9 | ||||
| 492 | A | 21.6 | Very low | 26.5 | Very low | 84 Ų | 84 | 157.5 Ų | 157.5 | 69% | 0.694 | 84% | 0.841 | S | S | * | * | trans | -80.7 | 161.6 | 141.9 | 0 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 493 | D | 22.4 | Very low | 26.6 | Very low | 155 Ų | 155 | 165.1 Ų | 165.1 | 83% | 0.829 | 86% | 0.855 | S | S | * | * | trans | 84.4 | 92.3 | 167.8 | -55.3 | -22.1 | 0 | 0 | 0 | 117.4 | ||||
| 494 | D | 34.4 | Very low | 26.8 | Very low | 246 Ų | 246 | 162.6 Ų | 162.6 | 100% | 1.316 | 85% | 0.852 | S | S | * | * | -153 | 0 | 118 | -95.2 | -24 | 0 | 0 | 0 | 110.3 |
Retrieved 494 of 494 residues in 166.2 ms
(Link to these results)