| 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 | 27.8 | Very low | 29.8 | Very low | 216 Ų | 216 | 141.8 Ų | 141.8 | 100% | 1.064 | 73% | 0.729 | S | S | * | * | 0 | 96.3 | 0 | -73.7 | 138.3 | 173.8 | 0 | 0 | 105.6 | |||||
| 2 | E | 27.3 | Very low | 29.6 | Very low | 176 Ų | 176 | 143.5 Ų | 143.5 | 82% | 0.822 | 73% | 0.732 | S | S | * | * | 106.6 | 132.1 | 78.2 | -91.1 | 162.8 | 178.9 | 0 | 0 | 106.4 | |||||
| 3 | T | 28 | Very low | 29.8 | Very low | 130 Ų | 130 | 141.5 Ų | 141.5 | 80% | 0.798 | 72% | 0.723 | S | S | * | * | cis | -129.9 | 151.4 | 12 | 23.8 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 4 | I | 34.5 | Very low | 30.1 | Very low | 174 Ų | 174 | 139.7 Ų | 139.7 | 89% | 0.892 | 72% | 0.716 | S | S | * | * | trans | -107.1 | 114.3 | 169 | -65.1 | 166.4 | 0 | 0 | 0 | 107.2 | ||||
| 5 | S | 27.2 | Very low | 30.3 | Very low | 93 Ų | 93 | 138.7 Ų | 138.7 | 65% | 0.65 | 71% | 0.707 | S | S | * | * | trans | -175.2 | 148.5 | 160.4 | 54.2 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 6 | N | 27.7 | Very low | 30.3 | Very low | 101 Ų | 101 | 135.4 Ų | 135.4 | 54% | 0.54 | 70% | 0.7 | S | S | . | * | trans | 109.5 | 37.1 | 166.8 | -65.1 | 47.7 | 0 | 0 | 0 | 119.8 | D9 | N6-D9 PolarHBondContact ND2-OD2 3.42Š| ||
| 7 | E | 31.8 | Very low | 30.3 | Very low | 178 Ų | 178 | 139.1 Ų | 139.1 | 83% | 0.832 | 70% | 0.703 | S | S | * | * | S | Bend | trans | -104.2 | -7.5 | 148.1 | -79.7 | -169.5 | 118.8 | 0 | 0 | 113.2 | ||
| 8 | S | 29.5 | Very low | 30.3 | Very low | 80 Ų | 80 | 140.4 Ų | 140.4 | 56% | 0.559 | 70% | 0.698 | S | S | * | * | S | Bend | trans | -74.4 | -26.7 | -179.8 | 44.8 | 0 | 0 | 0 | 0 | 114.8 | I10 | S8-I10 VanDerWaalsContact C-N 3.34Å; S8-I10 PolarHBondContact O-N 3.07Å |
| 9 | D | 30.8 | Very low | 30.3 | Very low | 83 Ų | 83 | 140.1 Ų | 140.1 | 44% | 0.444 | 70% | 0.699 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -80 | -17.7 | -167.3 | -61 | -7.3 | 0 | 0 | 0 | 113.2 | N6 W11 | N6-D9 PolarHBondContact ND2-OD2 3.42Å; D9-W11 VanDerWaalsContact C-N 3.26Å; D9-W11 PolarHBondContact O-N 3Å |
| 10 | I | 32.9 | Very low | 30.4 | Very low | 131 Ų | 131 | 137.2 Ų | 137.2 | 67% | 0.672 | 69% | 0.693 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -69 | -26.1 | -179.9 | -61.3 | 177.4 | 0 | 0 | 0 | 111.4 | S8 | S8-I10 VanDerWaalsContact C-N 3.34Å; S8-I10 PolarHBondContact O-N 3.07Å |
| 11 | W | 30 | Very low | 30.6 | Very low | 198 Ų | 198 | 135.3 Ų | 135.3 | 75% | 0.75 | 69% | 0.692 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89.1 | -18.6 | -178 | -80.9 | 97.3 | 0 | 0 | 0 | 114.9 | D9 | D9-W11 VanDerWaalsContact C-N 3.26Å; D9-W11 PolarHBondContact O-N 3Å |
| 12 | Q | 27.9 | Very low | 31.2 | Very low | 162 Ų | 162 | 132 Ų | 132 | 76% | 0.757 | 68% | 0.679 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80.3 | -22 | 177.5 | -72.5 | -152.6 | -9.4 | 0 | 0 | 114.2 | N14 E15 | Q12-N14 PolarHBondContact O-N 3.38Å; Q12-N14 VanDerWaalsContact O-N 3.15Å; Q12-E15 PolarHBondContact O-N 3.41Å |
| 13 | L | 31.7 | Very low | 31.5 | Very low | 117 Ų | 117 | 130.8 Ų | 130.8 | 61% | 0.613 | 68% | 0.677 | S | S | * | * | H | α-helix | trans | -61.7 | -20.9 | 173.1 | -96 | 99.8 | 0 | 0 | 0 | 113 | W17 | L13-W17 VanDerWaalsContact O-CD1 3.3Å |
| 14 | N | 33.8 | Very low | 31.6 | Very low | 117 Ų | 117 | 131.8 Ų | 131.8 | 63% | 0.626 | 68% | 0.677 | S | S | * | * | H | α-helix | trans | -79 | -14.9 | -177 | -111.7 | -6.8 | 0 | 0 | 0 | 115.1 | Q12 | Q12-N14 PolarHBondContact O-N 3.38Å; Q12-N14 VanDerWaalsContact O-N 3.15Å |
| 15 | E | 33.4 | Very low | 31.9 | Very low | 125 Ų | 125 | 127.1 Ų | 127.1 | 58% | 0.584 | 67% | 0.672 | S | S | * | * | H | α-helix | trans | -95.4 | -30.9 | 178.4 | -69.3 | -133.6 | 110.2 | 0 | 0 | 113.6 | Q12 W17 R18 | Q12-E15 PolarHBondContact O-N 3.41Å; E15-W17 VanDerWaalsContact C-N 3.3Å; E15-W17 PolarHBondContact O-N 3.04Å; E15-R18 PolarHBondContact O-N 3.22Å; E15-R18 IonicContact OE1-CZ 3.86Å; E15-R18 IonicContact OE1-NH1 3.44Å; E15-R18 PolarHBondContact OE1-NH1 2.92Å |
| 16 | S | 30.1 | Very low | 32.5 | Very low | 86 Ų | 86 | 129.8 Ų | 129.8 | 60% | 0.601 | 69% | 0.685 | S | S | * | * | H | α-helix | trans | -62 | -36 | 178.5 | -174.2 | 0 | 0 | 0 | 0 | 113.1 | R18 S20 | S16-R18 VanDerWaalsContact C-N 3.29Å; S16-R18 PolarHBondContact O-N 2.77Å; S16-S20 PolarHBondContact O-OG 3.31Å; S16-S20 VanDerWaalsContact O-OG 3.06Å |
| 17 | W | 30.6 | Very low | 32.6 | Very low | 197 Ų | 197 | 128.8 Ų | 128.8 | 75% | 0.746 | 70% | 0.698 | S | S | * | * | H | α-helix | trans | -75.1 | -10.9 | 179.3 | -75.6 | 86.4 | 0 | 0 | 0 | 114.5 | L13 E15 | L13-W17 VanDerWaalsContact O-CD1 3.3Å; E15-W17 VanDerWaalsContact C-N 3.3Å; E15-W17 PolarHBondContact O-N 3.04Å |
| 18 | R | 30.5 | Very low | 33.1 | Very low | 163 Ų | 163 | 124.2 Ų | 124.2 | 62% | 0.615 | 70% | 0.699 | S | S | * | * | H | α-helix | trans | -86.8 | -24.3 | -179.5 | -146.5 | 169.3 | 83.9 | -124.3 | 3.9 | 113.3 | E15 S16 S21 | E15-R18 PolarHBondContact O-N 3.22Å; E15-R18 IonicContact OE1-CZ 3.86Å; E15-R18 IonicContact OE1-NH1 3.44Å; E15-R18 PolarHBondContact OE1-NH1 2.92Å; S16-R18 VanDerWaalsContact C-N 3.29Å; S16-R18 PolarHBondContact O-N 2.77Å; R18-S21 PolarHBondContact O-OG 3.17Å |
| 19 | N | 31 | Very low | 33.4 | Very low | 134 Ų | 134 | 128.2 Ų | 128.2 | 72% | 0.717 | 71% | 0.713 | S | S | * | * | H | α-helix | trans | -95.7 | -12.4 | -178.5 | -70.9 | -14.9 | 0 | 0 | 0 | 113.9 | S21 | N19-S21 VanDerWaalsContact C-N 3.34Å |
| 20 | S | 31 | Very low | 33.8 | Very low | 83 Ų | 83 | 132.2 Ų | 132.2 | 58% | 0.58 | 73% | 0.734 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84.5 | -4.4 | 179.5 | 28.6 | 0 | 0 | 0 | 0 | 113.8 | S16 L22 | S16-S20 PolarHBondContact O-OG 3.31Å; S16-S20 VanDerWaalsContact O-OG 3.06Å; S20-L22 VanDerWaalsContact C-N 3.27Å; S20-L22 PolarHBondContact O-N 3.47Å |
| 21 | S | 34.3 | Very low | 33.9 | Very low | 97 Ų | 97 | 134.1 Ų | 134.1 | 68% | 0.678 | 74% | 0.74 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -83.6 | 9.4 | 177.8 | 62.5 | 0 | 0 | 0 | 0 | 114.8 | R18 N19 | R18-S21 PolarHBondContact O-OG 3.17Å; N19-S21 VanDerWaalsContact C-N 3.34Å |
| 22 | L | 40.8 | Very low | 34.5 | Very low | 148 Ų | 148 | 130.8 Ų | 130.8 | 78% | 0.775 | 74% | 0.742 | S | S | * | * | S | Bend | trans | -130.5 | 43.1 | -171.4 | -102.7 | 170.4 | 0 | 0 | 0 | 113.7 | S20 | S20-L22 VanDerWaalsContact C-N 3.27Å; S20-L22 PolarHBondContact O-N 3.47Å |
| 23 | L | 33.1 | Very low | 34.9 | Very low | 150 Ų | 150 | 129.2 Ų | 129.2 | 79% | 0.785 | 74% | 0.739 | S | S | * | * | S | Bend | trans | -156.4 | 122.8 | 162.1 | -109.8 | 142.5 | 0 | 0 | 0 | 114 | ||
| 24 | N | 31 | Very low | 35.3 | Very low | 150 Ų | 150 | 130 Ų | 130 | 80% | 0.802 | 75% | 0.751 | S | S | * | * | trans | 46.2 | 105.2 | 160.8 | -65.8 | -5.1 | 0 | 0 | 0 | 119.6 | ||||
| 25 | G | 41.7 | Very low | 35.8 | Very low | 77 Ų | 77 | 132.3 Ų | 132.3 | 79% | 0.794 | 76% | 0.763 | S | S | * | * | trans | -82 | 133.7 | 157.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 26 | T | 38.9 | Very low | 36.3 | Very low | 149 Ų | 149 | 132.9 Ų | 132.9 | 91% | 0.914 | 76% | 0.763 | S | S | * | * | trans | -171.2 | 120.3 | 143.4 | 32.6 | 0 | 0 | 0 | 0 | 107.4 | ||||
| 27 | G | 30.8 | Very low | 37.4 | Very low | 79 Ų | 79 | 133.7 Ų | 133.7 | 81% | 0.814 | 75% | 0.753 | S | S | * | * | trans | 145 | 104.9 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 28 | G | 42 | Very low | 39.1 | Very low | 82 Ų | 82 | 129.4 Ų | 129.4 | 85% | 0.845 | 75% | 0.745 | S | S | * | * | trans | -76.1 | 124.1 | 178.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 29 | L | 35.4 | Very low | 41.1 | Very low | 165 Ų | 165 | 126 Ų | 126 | 86% | 0.864 | 74% | 0.736 | S | S | * | * | trans | -140.5 | 132.9 | 159.2 | -102.9 | 134.7 | 0 | 0 | 0 | 107.8 | Q31 | L29-Q31 VanDerWaalsContact C-N 3.26Å; L29-Q31 PolarHBondContact O-N 3.44Å | ||
| 30 | N | 38.5 | Very low | 43.2 | Very low | 166 Ų | 166 | 125.4 Ų | 125.4 | 89% | 0.888 | 73% | 0.729 | S | S | * | * | trans | -68.2 | 84 | 178.1 | -80.5 | -26.2 | 0 | 0 | 0 | 110 | T32 | N30-T32 PolarHBondContact O-N 3.49Š| ||
| 31 | Q | 35.9 | Very low | 45.3 | Very low | 171 Ų | 171 | 122.8 Ų | 122.8 | 80% | 0.799 | 71% | 0.709 | S | S | * | * | trans | -77.5 | 92.8 | 176.1 | -156.4 | 168.6 | 31 | 0 | 0 | 108.8 | L29 N33 | L29-Q31 VanDerWaalsContact C-N 3.26Å; L29-Q31 PolarHBondContact O-N 3.44Å; Q31-N33 PolarHBondContact O-N 2.83Å | ||
| 32 | T | 41.8 | Very low | 47.2 | Very low | 128 Ų | 128 | 118.9 Ų | 118.9 | 79% | 0.785 | 68% | 0.683 | S | S | * | * | trans | -58.7 | 105.5 | 170.3 | 41.5 | 0 | 0 | 0 | 0 | 109.4 | N30 P34 | N30-T32 PolarHBondContact O-N 3.49Å; T32-P34 WeakPolarHBondContact O-CD 3.48Å | ||
| 33 | N | 35.8 | Very low | 49.2 | Very low | 129 Ų | 129 | 116.2 Ų | 116.2 | 69% | 0.69 | 67% | 0.665 | S | S | * | * | trans | -55 | 116.7 | -179.8 | -76.4 | -69.1 | 0 | 0 | 0 | 111.1 | Q31 L35 K36 | Q31-N33 PolarHBondContact O-N 2.83Å; N33-L35 PolarHBondContact O-N 2.99Å; N33-K36 PolarHBondContact O-N 3.26Å | ||
| 34 | P | 41.8 | Very low | 51.6 | Low | 134 Ų | 134 | 113.4 Ų | 113.4 | 87% | 0.87 | 65% | 0.654 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72.3 | -0.1 | -175.8 | 29.5 | -35.6 | 0 | 0 | 0 | 114.2 | T32 | T32-P34 WeakPolarHBondContact O-CD 3.48Š|
| 35 | L | 42.4 | Very low | 54 | Low | 166 Ų | 166 | 106.6 Ų | 106.6 | 87% | 0.869 | 62% | 0.617 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -102.7 | -1.6 | -179.5 | -85.5 | 163.5 | 0 | 0 | 0 | 114.6 | N33 R37 | N33-L35 PolarHBondContact O-N 2.99Å; L35-R37 PolarHBondContact O-N 3.45Å |
| 36 | K | 44.6 | Very low | 56.1 | Low | 136 Ų | 136 | 104.5 Ų | 104.5 | 59% | 0.591 | 59% | 0.589 | S | S | * | * | trans | -81.4 | 86.3 | 173.4 | -162.7 | 175.8 | -175.6 | -172.5 | 0 | 109.7 | N33 N38 E39 | N33-K36 PolarHBondContact O-N 3.26Å; K36-N38 PolarHBondContact O-N 2.79Å; K36-N38 VanDerWaalsContact O-N 3.08Å; K36-E39 VanDerWaalsContact CE-OE2 3.26Å; K36-E39 WeakPolarHBondContact CE-OE2 3.37Å; K36-E39 IonicContact NZ-OE2 3Å; K36-E39 PolarHBondContact NZ-OE2 2.96Å | ||
| 37 | R | 54.3 | Low | 58.5 | Low | 104 Ų | 104 | 102 Ų | 102 | 39% | 0.392 | 57% | 0.573 | S | S | . | * | trans | -43 | 119.8 | 165.3 | 177.4 | 163 | 82.8 | 146.3 | -1.2 | 107.7 | L35 E39 | L35-R37 PolarHBondContact O-N 3.45Å; R37-E39 PolarHBondContact O-N 3.26Å | ||
| 38 | N | 65 | Low | 61.2 | Low | 107 Ų | 107 | 100.6 Ų | 100.6 | 57% | 0.572 | 55% | 0.549 | S | S | * | . | trans | -52.2 | 111.1 | -168 | -75.7 | -32.1 | 0 | 0 | 0 | 110.4 | K36 E40 V41 A42 | K36-N38 PolarHBondContact O-N 2.79Å; K36-N38 VanDerWaalsContact O-N 3.08Å; N38-E40 PolarHBondContact O-N 3.3Å; N38-V41 HydrophobicContact CB-CB 4.01Å; N38-V41 HydrophobicContact CB-CG2 3.49Å; N38-V41 VanDerWaalsContact CB-CG2 3.49Å; N38-V41 WeakPolarHBondContact O-CA 3.26Å; N38-V41 WeakPolarHBondContact O-CB 3.15Å; N38-V41 PolarHBondContact O-N 2.91Å; N38-A42 PolarHBondContact O-N 3.48Å | ||
| 39 | E | 72.9 | Confident | 63.4 | Low | 92 Ų | 92 | 96.7 Ų | 96.7 | 43% | 0.43 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -60.3 | -36.5 | -168.9 | -158.7 | -171.8 | 120.2 | 0 | 0 | 111.7 | K36 R37 V41 A42 K43 | K36-E39 VanDerWaalsContact CE-OE2 3.26Å; K36-E39 WeakPolarHBondContact CE-OE2 3.37Å; K36-E39 IonicContact NZ-OE2 3Å; K36-E39 PolarHBondContact NZ-OE2 2.96Å; R37-E39 PolarHBondContact O-N 3.26Å; E39-V41 VanDerWaalsContact C-N 3.33Å; E39-V41 PolarHBondContact O-N 2.92Å; E39-A42 PolarHBondContact O-N 3.41Å; E39-K43 VanDerWaalsContact O-CG 3.32Å; E39-K43 WeakPolarHBondContact O-CG 3.36Å; E39-K43 PolarHBondContact O-N 3.37Å; E39-K43 WeakPolarHBondContact OE1-CE 3.23Å; E39-K43 IonicContact OE1-NZ 3.61Å; E39-K43 PolarHBondContact OE1-NZ 3.28Å |
| 40 | E | 75.7 | Confident | 66.1 | Low | 121 Ų | 121 | 90.8 Ų | 90.8 | 57% | 0.565 | 48% | 0.484 | S | S | * | . | H | α-helix | trans | -64.5 | -33.5 | 174 | -57.5 | -50.2 | 111.6 | 0 | 0 | 113 | N38 K43 V44 | N38-E40 PolarHBondContact O-N 3.3Å; E40-K43 PolarHBondContact O-N 3.11Å; E40-K43 IonicContact OE1-NZ 2.6Å; E40-K43 PolarHBondContact OE1-NZ 3.29Å; E40-V44 VanDerWaalsContact O-CG2 3.28Å; E40-V44 WeakPolarHBondContact O-CG2 3.43Å; E40-V44 PolarHBondContact O-N 3.49Å |
| 41 | V | 73.7 | Confident | 68.6 | Low | 28 Ų | 28 | 87.7 Ų | 87.7 | 17% | 0.17 | 47% | 0.467 | C | S | . | . | H | α-helix | trans | -71.2 | -43.3 | 177.9 | -178.5 | 0 | 0 | 0 | 0 | 110.3 | N38 E39 K43 V44 E45 M308 I311 | N38-V41 HydrophobicContact CB-CB 4.01Å; N38-V41 HydrophobicContact CB-CG2 3.49Å; N38-V41 VanDerWaalsContact CB-CG2 3.49Å; N38-V41 WeakPolarHBondContact O-CA 3.26Å; N38-V41 WeakPolarHBondContact O-CB 3.15Å; N38-V41 PolarHBondContact O-N 2.91Å; E39-V41 VanDerWaalsContact C-N 3.33Å; E39-V41 PolarHBondContact O-N 2.92Å; V41-K43 PolarHBondContact O-N 2.94Å; V41-V44 PolarHBondContact O-N 2.81Å; V41-E45 WeakPolarHBondContact O-CB 3.47Å; V41-E45 PolarHBondContact O-N 2.87Å; V41-M308 HydrophobicContact CB-SD 4.48Å; V41-M308 HydrophobicContact CG1-CE 4.5Å; V41-M308 HydrophobicContact CG1-SD 3.79Å; V41-M308 HydrophobicContact CG2-CE 3.36Å; V41-M308 HydrophobicContact CG2-SD 3.77Å; V41-I311 HydrophobicContact CG1-CD1 3.66Å |
| 42 | A | 74.2 | Confident | 71.2 | Confident | 15 Ų | 15 | 79.8 Ų | 79.8 | 12% | 0.124 | 43% | 0.43 | C | S | . | . | H | α-helix | trans | -63 | -40.7 | 174.7 | 0 | 0 | 0 | 0 | 0 | 111.7 | N38 E39 V44 E45 V46 | N38-A42 PolarHBondContact O-N 3.48Å; E39-A42 PolarHBondContact O-N 3.41Å; A42-V44 PolarHBondContact O-N 3.48Å; A42-E45 PolarHBondContact O-N 3.25Å; A42-V46 WeakPolarHBondContact O-CB 3.22Å; A42-V46 VanDerWaalsContact O-CG2 3.32Å; A42-V46 WeakPolarHBondContact O-CG2 3.22Å; A42-V46 PolarHBondContact O-N 3.36Å |
| 43 | K | 83.2 | Confident | 73.6 | Confident | 92 Ų | 92 | 74.6 Ų | 74.6 | 40% | 0.4 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -59.5 | -45.1 | 173.1 | -72.1 | 167.1 | -169.3 | 161.7 | 0 | 111.9 | E39 E40 V41 T47 | E39-K43 VanDerWaalsContact O-CG 3.32Å; E39-K43 WeakPolarHBondContact O-CG 3.36Å; E39-K43 PolarHBondContact O-N 3.37Å; E39-K43 WeakPolarHBondContact OE1-CE 3.23Å; E39-K43 IonicContact OE1-NZ 3.61Å; E39-K43 PolarHBondContact OE1-NZ 3.28Å; E40-K43 PolarHBondContact O-N 3.11Å; E40-K43 IonicContact OE1-NZ 2.6Å; E40-K43 PolarHBondContact OE1-NZ 3.29Å; V41-K43 PolarHBondContact O-N 2.94Å; K43-T47 VanDerWaalsContact O-CB 3.32Å; K43-T47 WeakPolarHBondContact O-CB 3.35Å; K43-T47 PolarHBondContact O-N 2.89Å; K43-T47 PolarHBondContact O-OG1 2.7Å |
| 44 | V | 83.6 | Confident | 76.4 | Confident | 90 Ų | 90 | 74.9 Ų | 74.9 | 55% | 0.545 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -65.4 | -46.5 | 177.6 | 169.6 | 0 | 0 | 0 | 0 | 111.2 | E40 V41 A42 T47 V48 | E40-V44 VanDerWaalsContact O-CG2 3.28Å; E40-V44 WeakPolarHBondContact O-CG2 3.43Å; E40-V44 PolarHBondContact O-N 3.49Å; V41-V44 PolarHBondContact O-N 2.81Å; A42-V44 PolarHBondContact O-N 3.48Å; V44-T47 PolarHBondContact O-N 2.93Å; V44-V48 HydrophobicContact CG1-CG2 4.29Å; V44-V48 VanDerWaalsContact O-CG2 3.3Å; V44-V48 WeakPolarHBondContact O-CG2 3.39Å; V44-V48 PolarHBondContact O-N 3.43Å |
| 45 | E | 81.4 | Confident | 78.9 | Confident | 7 Ų | 7 | 70.9 Ų | 70.9 | 3% | 0.033 | 36% | 0.364 | C | S | . | . | H | α-helix | trans | -57 | -53 | 177.8 | 177 | 167.1 | -141.5 | 0 | 0 | 112 | V41 A42 T47 V48 L49 I311 | V41-E45 WeakPolarHBondContact O-CB 3.47Å; V41-E45 PolarHBondContact O-N 2.87Å; A42-E45 PolarHBondContact O-N 3.25Å; E45-T47 VanDerWaalsContact C-N 3.32Å; E45-T47 PolarHBondContact O-N 3.33Å; E45-V48 PolarHBondContact O-N 3.32Å; E45-L49 HydrophobicContact CG-CD1 3.92Å; E45-L49 WeakPolarHBondContact O-CB 3.43Å; E45-L49 WeakPolarHBondContact O-CG 3.31Å; E45-L49 PolarHBondContact O-N 2.89Å; E45-I311 HydrophobicContact CB-CG2 4.19Å; E45-I311 HydrophobicContact CG-CG2 4.07Å; E45-I311 WeakPolarHBondContact OE1-CG2 3.31Å |
| 46 | V | 86.8 | Confident | 81.2 | Confident | 33 Ų | 33 | 63 Ų | 63 | 20% | 0.2 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -58.7 | -42.6 | 176.7 | 168.3 | 0 | 0 | 0 | 0 | 111.4 | A42 L49 A50 L100 D103 I104 | A42-V46 WeakPolarHBondContact O-CB 3.22Å; A42-V46 VanDerWaalsContact O-CG2 3.32Å; A42-V46 WeakPolarHBondContact O-CG2 3.22Å; A42-V46 PolarHBondContact O-N 3.36Å; V46-L49 PolarHBondContact O-N 3.44Å; V46-A50 VanDerWaalsContact O-CB 3.3Å; V46-A50 WeakPolarHBondContact O-CB 3.45Å; V46-A50 PolarHBondContact O-N 3.25Å; V46-L100 HydrophobicContact CB-CD1 4.42Å; V46-L100 HydrophobicContact CG1-CD1 3.89Å; V46-L100 WeakPolarHBondContact O-CD1 3.4Å; V46-D103 HydrophobicContact CG2-CB 3.9Å; V46-I104 HydrophobicContact CG1-CD1 4.03Å; V46-I104 HydrophobicContact CG1-CG1 3.68Å; V46-I104 HydrophobicContact CG2-CG1 4Å |
| 47 | T | 88.8 | Confident | 83.6 | Confident | 96 Ų | 96 | 59.4 Ų | 59.4 | 59% | 0.589 | 31% | 0.31 | S | S | * | . | H | α-helix | trans | -64.9 | -43.7 | 179.1 | -57.9 | 0 | 0 | 0 | 0 | 111.7 | K43 V44 E45 L51 | K43-T47 VanDerWaalsContact O-CB 3.32Å; K43-T47 WeakPolarHBondContact O-CB 3.35Å; K43-T47 PolarHBondContact O-N 2.89Å; K43-T47 PolarHBondContact O-OG1 2.7Å; V44-T47 PolarHBondContact O-N 2.93Å; E45-T47 VanDerWaalsContact C-N 3.32Å; E45-T47 PolarHBondContact O-N 3.33Å; T47-L51 WeakPolarHBondContact O-CB 3.36Å; T47-L51 PolarHBondContact O-N 3.06Å |
| 48 | V | 87.9 | Confident | 85.5 | Confident | 50 Ų | 50 | 56.5 Ų | 56.5 | 30% | 0.303 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -67.7 | -44.2 | 178.1 | 175.5 | 0 | 0 | 0 | 0 | 110.7 | V44 E45 A50 L51 V52 L315 | V44-V48 HydrophobicContact CG1-CG2 4.29Å; V44-V48 VanDerWaalsContact O-CG2 3.3Å; V44-V48 WeakPolarHBondContact O-CG2 3.39Å; V44-V48 PolarHBondContact O-N 3.43Å; E45-V48 PolarHBondContact O-N 3.32Å; V48-A50 PolarHBondContact O-N 2.93Å; V48-L51 PolarHBondContact O-N 3.16Å; V48-V52 HydrophobicContact CG1-CG2 4.22Å; V48-V52 WeakPolarHBondContact O-CB 3.33Å; V48-V52 VanDerWaalsContact O-CG2 3.29Å; V48-V52 WeakPolarHBondContact O-CG2 3.25Å; V48-V52 PolarHBondContact O-N 2.86Å; V48-L315 HydrophobicContact CB-CD2 4.25Å; V48-L315 HydrophobicContact CG1-CD1 4.32Å; V48-L315 HydrophobicContact CG1-CD2 3.93Å |
| 49 | L | 87.4 | Confident | 86.8 | Confident | 0 Ų | 0 | 52.1 Ų | 52.1 | 0% | 0 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -61.6 | -42.3 | 176.6 | -75.9 | 168.5 | 0 | 0 | 0 | 112.3 | E45 V46 L51 V52 L53 V96 Q99 L100 D103 L315 | E45-L49 HydrophobicContact CG-CD1 3.92Å; E45-L49 WeakPolarHBondContact O-CB 3.43Å; E45-L49 WeakPolarHBondContact O-CG 3.31Å; E45-L49 PolarHBondContact O-N 2.89Å; V46-L49 PolarHBondContact O-N 3.44Å; L49-L51 PolarHBondContact O-N 2.99Å; L49-V52 PolarHBondContact O-N 3.39Å; L49-L53 VanDerWaalsContact O-CB 3.25Å; L49-L53 WeakPolarHBondContact O-CB 3.48Å; L49-L53 PolarHBondContact O-N 3.33Å; L49-V96 HydrophobicContact CD2-CG1 4.21Å; L49-Q99 HydrophobicContact CD1-CG 4.06Å; L49-L100 HydrophobicContact CB-CB 4.4Å; L49-L100 HydrophobicContact CB-CD1 3.9Å; L49-D103 WeakPolarHBondContact CD1-OD2 3.26Å; L49-L315 HydrophobicContact CD1-CD2 4.42Å; L49-L315 HydrophobicContact CD2-CD2 3.76Å; L49-L315 HydrophobicContact CG-CD2 3.64Å |
| 50 | A | 91.9 | Very high | 87.8 | Confident | 42 Ų | 42 | 47.8 Ų | 47.8 | 35% | 0.347 | 27% | 0.268 | S | S | . | . | H | α-helix | trans | -61.9 | -42.1 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | V46 V48 F54 L100 | V46-A50 VanDerWaalsContact O-CB 3.3Å; V46-A50 WeakPolarHBondContact O-CB 3.45Å; V46-A50 PolarHBondContact O-N 3.25Å; V48-A50 PolarHBondContact O-N 2.93Å; A50-F54 WeakPolarHBondContact O-CB 3.27Å; A50-F54 PolarHBondContact O-N 3.37Å; A50-L100 HydrophobicContact CB-CD1 4.24Å; A50-L100 HydrophobicContact CB-CD2 4.09Å |
| 51 | L | 91.9 | Very high | 88.6 | Confident | 100 Ų | 100 | 46.3 Ų | 46.3 | 52% | 0.524 | 26% | 0.264 | S | S | . | . | H | α-helix | trans | -65.3 | -45.6 | 175.1 | -179.5 | 62.6 | 0 | 0 | 0 | 111.9 | T47 V48 L49 L53 F54 L55 | T47-L51 WeakPolarHBondContact O-CB 3.36Å; T47-L51 PolarHBondContact O-N 3.06Å; V48-L51 PolarHBondContact O-N 3.16Å; L49-L51 PolarHBondContact O-N 2.99Å; L51-L53 VanDerWaalsContact C-N 3.35Å; L51-L53 PolarHBondContact O-N 3.42Å; L51-F54 PolarHBondContact O-N 2.75Å; L51-L55 HydrophobicContact CD1-CD1 4.09Å; L51-L55 HydrophobicContact CD1-CG 4.16Å; L51-L55 HydrophobicContact CG-CD1 3.99Å; L51-L55 HydrophobicContact CG-CG 4.44Å; L51-L55 WeakPolarHBondContact O-CB 3.39Å; L51-L55 VanDerWaalsContact O-CG 3.26Å; L51-L55 WeakPolarHBondContact O-CG 3.34Å; L51-L55 PolarHBondContact O-N 2.97Å |
| 52 | V | 90.6 | Very high | 89.4 | Confident | 6 Ų | 6 | 47.1 Ų | 47.1 | 4% | 0.036 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -62.4 | -42.4 | 177.7 | 171 | 0 | 0 | 0 | 0 | 111 | V48 L49 L55 A56 L319 C322 | V48-V52 HydrophobicContact CG1-CG2 4.22Å; V48-V52 WeakPolarHBondContact O-CB 3.33Å; V48-V52 VanDerWaalsContact O-CG2 3.29Å; V48-V52 WeakPolarHBondContact O-CG2 3.25Å; V48-V52 PolarHBondContact O-N 2.86Å; L49-V52 PolarHBondContact O-N 3.39Å; V52-L55 PolarHBondContact O-N 3.02Å; V52-A56 WeakPolarHBondContact O-CB 3.16Å; V52-A56 PolarHBondContact O-N 3.46Å; V52-L319 HydrophobicContact CG2-CD2 3.61Å; V52-L319 HydrophobicContact CG2-CG 4.46Å; V52-C322 HydrophobicContact CG1-CB 4.47Å |
| 53 | L | 92.8 | Very high | 90.2 | Very high | 18 Ų | 18 | 46.4 Ų | 46.4 | 9% | 0.094 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -59.1 | -51.1 | 174.5 | 178.4 | 62.1 | 0 | 0 | 0 | 111.2 | L49 L51 L55 A56 L57 A92 V96 L97 L100 | L49-L53 VanDerWaalsContact O-CB 3.25Å; L49-L53 WeakPolarHBondContact O-CB 3.48Å; L49-L53 PolarHBondContact O-N 3.33Å; L51-L53 VanDerWaalsContact C-N 3.35Å; L51-L53 PolarHBondContact O-N 3.42Å; L53-L55 PolarHBondContact O-N 2.88Å; L53-A56 PolarHBondContact O-N 3.03Å; L53-L57 HydrophobicContact CD1-CD1 3.76Å; L53-L57 HydrophobicContact CD1-CG 4.02Å; L53-L57 HydrophobicContact CG-CD1 3.96Å; L53-L57 WeakPolarHBondContact O-CB 3.46Å; L53-L57 VanDerWaalsContact O-CG 3.28Å; L53-L57 WeakPolarHBondContact O-CG 3.32Å; L53-L57 PolarHBondContact O-N 3.28Å; L53-A92 HydrophobicContact CD1-CB 4.19Å; L53-A92 WeakPolarHBondContact CD1-O 3.29Å; L53-V96 HydrophobicContact CB-CG1 3.93Å; L53-V96 HydrophobicContact CD1-CB 4.28Å; L53-V96 HydrophobicContact CD1-CG1 4.36Å; L53-L97 HydrophobicContact CD1-CB 4.05Å; L53-L97 HydrophobicContact CD2-CB 4.05Å; L53-L97 HydrophobicContact CD2-CD1 3.93Å; L53-L100 HydrophobicContact CD2-CD2 3.74Å |
| 54 | F | 94.4 | Very high | 90.6 | Very high | 135 Ų | 135 | 43 Ų | 43 | 59% | 0.592 | 25% | 0.25 | S | S | * | . | H | α-helix | trans | -58.2 | -48.3 | 178 | 175 | -100.6 | 0 | 0 | 0 | 111.8 | A50 L51 L57 A58 | A50-F54 WeakPolarHBondContact O-CB 3.27Å; A50-F54 PolarHBondContact O-N 3.37Å; L51-F54 PolarHBondContact O-N 2.75Å; F54-L57 PolarHBondContact O-N 2.94Å; F54-A58 WeakPolarHBondContact O-CB 3.46Å; F54-A58 PolarHBondContact O-N 3.29Å |
| 55 | L | 92.8 | Very high | 90.9 | Very high | 51 Ų | 51 | 42.7 Ų | 42.7 | 27% | 0.267 | 25% | 0.245 | S | C | . | . | H | α-helix | trans | -65.2 | -40.2 | 179.5 | -69.7 | 177.3 | 0 | 0 | 0 | 112.7 | L51 V52 L53 G59 C322 W326 | L51-L55 HydrophobicContact CD1-CD1 4.09Å; L51-L55 HydrophobicContact CD1-CG 4.16Å; L51-L55 HydrophobicContact CG-CD1 3.99Å; L51-L55 HydrophobicContact CG-CG 4.44Å; L51-L55 WeakPolarHBondContact O-CB 3.39Å; L51-L55 VanDerWaalsContact O-CG 3.26Å; L51-L55 WeakPolarHBondContact O-CG 3.34Å; L51-L55 PolarHBondContact O-N 2.97Å; V52-L55 PolarHBondContact O-N 3.02Å; L53-L55 PolarHBondContact O-N 2.88Å; L55-G59 WeakPolarHBondContact O-CA 3.34Å; L55-G59 PolarHBondContact O-N 2.87Å; L55-C322 HydrophobicContact CB-CB 4.27Å; L55-W326 HydrophobicContact CD2-CZ2 4.11Å |
| 56 | A | 92.1 | Very high | 91.1 | Very high | 1 Ų | 1 | 42.3 Ų | 42.3 | 1% | 0.008 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -66.7 | -44.5 | 177.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | V52 L53 N60 A92 C322 | V52-A56 WeakPolarHBondContact O-CB 3.16Å; V52-A56 PolarHBondContact O-N 3.46Å; L53-A56 PolarHBondContact O-N 3.03Å; A56-N60 VanDerWaalsContact O-CB 3.3Å; A56-N60 WeakPolarHBondContact O-CB 3.31Å; A56-N60 PolarHBondContact O-N 3.47Å; A56-N60 VanDerWaalsContact O-N 3.11Å; A56-N60 PolarHBondContact O-ND2 2.77Å; A56-A92 HydrophobicContact CB-CB 3.97Å; A56-C322 HydrophobicContact CB-CB 4.1Å |
| 57 | L | 94.9 | Very high | 91.1 | Very high | 59 Ų | 59 | 41.3 Ų | 41.3 | 31% | 0.309 | 24% | 0.236 | S | C | . | . | H | α-helix | trans | -65.8 | -56.4 | 176.9 | -69.7 | 175.1 | 0 | 0 | 0 | 111.5 | L53 F54 G59 L61 L89 A92 I93 | L53-L57 HydrophobicContact CD1-CD1 3.76Å; L53-L57 HydrophobicContact CD1-CG 4.02Å; L53-L57 HydrophobicContact CG-CD1 3.96Å; L53-L57 WeakPolarHBondContact O-CB 3.46Å; L53-L57 VanDerWaalsContact O-CG 3.28Å; L53-L57 WeakPolarHBondContact O-CG 3.32Å; L53-L57 PolarHBondContact O-N 3.28Å; F54-L57 PolarHBondContact O-N 2.94Å; L57-G59 PolarHBondContact O-N 3.44Å; L57-L61 WeakPolarHBondContact O-CB 3.32Å; L57-L61 PolarHBondContact O-N 2.86Å; L57-L89 HydrophobicContact CD2-CD2 3.87Å; L57-A92 HydrophobicContact CD2-CB 3.71Å; L57-A92 HydrophobicContact CG-CB 4.07Å; L57-I93 HydrophobicContact CD2-CD1 4.36Å; L57-I93 HydrophobicContact CD2-CG1 3.83Å |
| 58 | A | 93.9 | Very high | 90.9 | Very high | 44 Ų | 44 | 42.7 Ų | 42.7 | 36% | 0.364 | 24% | 0.236 | S | C | . | . | H | α-helix | trans | -63.6 | -43.2 | -177 | 0 | 0 | 0 | 0 | 0 | 111.8 | F54 C62 | F54-A58 WeakPolarHBondContact O-CB 3.46Å; F54-A58 PolarHBondContact O-N 3.29Å; A58-C62 WeakPolarHBondContact O-CB 3.24Å; A58-C62 PolarHBondContact O-N 3.49Å |
| 59 | G | 92.1 | Very high | 90.6 | Very high | 15 Ų | 15 | 43.3 Ų | 43.3 | 16% | 0.155 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -63.8 | -52.2 | 179.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | L55 L57 C62 V63 | L55-G59 WeakPolarHBondContact O-CA 3.34Å; L55-G59 PolarHBondContact O-N 2.87Å; L57-G59 PolarHBondContact O-N 3.44Å; G59-C62 WeakPolarHBondContact O-CB 3.24Å; G59-C62 PolarHBondContact O-N 2.85Å; G59-V63 WeakPolarHBondContact O-CG2 3.31Å; G59-V63 PolarHBondContact O-N 3Å |
| 60 | N | 93.7 | Very high | 90 | Very high | 0 Ų | 0 | 43.6 Ų | 43.6 | 0% | 0 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -71.1 | -33.9 | -178.1 | -74.5 | -68.9 | 0 | 0 | 0 | 112.5 | A56 V63 L64 S85 L89 S321 P325 | A56-N60 VanDerWaalsContact O-CB 3.3Å; A56-N60 WeakPolarHBondContact O-CB 3.31Å; A56-N60 PolarHBondContact O-N 3.47Å; A56-N60 VanDerWaalsContact O-N 3.11Å; A56-N60 PolarHBondContact O-ND2 2.77Å; N60-V63 PolarHBondContact O-N 3.3Å; N60-L64 WeakPolarHBondContact O-CG 3.44Å; N60-L64 PolarHBondContact O-N 3.35Å; N60-S85 WeakPolarHBondContact OD1-CA 3.09Å; N60-S85 WeakPolarHBondContact OD1-CB 3.3Å; N60-S85 PolarHBondContact OD1-OG 3.22Å; N60-L89 HydrophobicContact CB-CD1 4.43Å; N60-L89 HydrophobicContact CB-CD2 3.93Å; N60-L89 HydrophobicContact CB-CG 3.81Å; N60-S321 PolarHBondContact ND2-O 3.48Å; N60-S321 VanDerWaalsContact ND2-O 3.1Å; N60-P325 HydrophobicContact CB-CG 4.4Å |
| 61 | L | 93.5 | Very high | 88.7 | Confident | 91 Ų | 91 | 51.3 Ų | 51.3 | 48% | 0.476 | 27% | 0.267 | S | S | . | . | H | α-helix | trans | -63.9 | -42.4 | 171.1 | -176.2 | 60.6 | 0 | 0 | 0 | 111.4 | L57 V63 L64 L65 | L57-L61 WeakPolarHBondContact O-CB 3.32Å; L57-L61 PolarHBondContact O-N 2.86Å; L61-V63 PolarHBondContact O-N 2.86Å; L61-L64 PolarHBondContact O-N 3.41Å; L61-L65 HydrophobicContact CD1-CG 4.45Å; L61-L65 HydrophobicContact CG-CD1 4.15Å; L61-L65 HydrophobicContact CG-CG 4.48Å; L61-L65 VanDerWaalsContact O-CG 3.32Å; L61-L65 WeakPolarHBondContact O-CG 3.39Å; L61-L65 PolarHBondContact O-N 3.32Å |
| 62 | C | 90.6 | Very high | 87.2 | Confident | 44 Ų | 44 | 53.6 Ų | 53.6 | 30% | 0.297 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -60.6 | -43.7 | 175.3 | -173.7 | 0 | 0 | 0 | 0 | 111.9 | A58 G59 L64 L65 A66 | A58-C62 WeakPolarHBondContact O-CB 3.24Å; A58-C62 PolarHBondContact O-N 3.49Å; G59-C62 WeakPolarHBondContact O-CB 3.24Å; G59-C62 PolarHBondContact O-N 2.85Å; C62-L64 PolarHBondContact O-N 3.02Å; C62-L65 PolarHBondContact O-N 2.76Å; C62-A66 WeakPolarHBondContact O-CB 3.32Å; C62-A66 PolarHBondContact O-N 3.3Å |
| 63 | V | 90.3 | Very high | 85.7 | Confident | 0 Ų | 0 | 54.9 Ų | 54.9 | 0% | 0 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -58.2 | -46.3 | 173.9 | 172.1 | 0 | 0 | 0 | 0 | 111.3 | G59 N60 L61 A66 I67 S85 P325 Y328 F336 | G59-V63 WeakPolarHBondContact O-CG2 3.31Å; G59-V63 PolarHBondContact O-N 3Å; N60-V63 PolarHBondContact O-N 3.3Å; L61-V63 PolarHBondContact O-N 2.86Å; V63-A66 PolarHBondContact O-N 3.44Å; V63-I67 HydrophobicContact CG1-CD1 3.81Å; V63-I67 VanDerWaalsContact O-CG1 3.31Å; V63-I67 WeakPolarHBondContact O-CG1 3.3Å; V63-I67 PolarHBondContact O-N 3.48Å; V63-S85 WeakPolarHBondContact CG1-OG 3.44Å; V63-P325 HydrophobicContact CG2-CB 3.82Å; V63-P325 HydrophobicContact CG2-CG 4.17Å; V63-Y328 HydrophobicContact CG1-CD2 3.83Å; V63-Y328 HydrophobicContact CG1-CE2 4.19Å; V63-Y328 HydrophobicContact CG2-CD2 3.83Å; V63-F336 HydrophobicContact CG2-CZ 4.01Å |
| 64 | L | 91.1 | Very high | 84.2 | Confident | 22 Ų | 22 | 60.2 Ų | 60.2 | 12% | 0.115 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -62.1 | -47.2 | 177.2 | -70.3 | 176.7 | 0 | 0 | 0 | 111.6 | N60 L61 C62 A66 I67 H68 K82 I86 L89 | N60-L64 WeakPolarHBondContact O-CG 3.44Å; N60-L64 PolarHBondContact O-N 3.35Å; L61-L64 PolarHBondContact O-N 3.41Å; C62-L64 PolarHBondContact O-N 3.02Å; L64-A66 VanDerWaalsContact C-N 3.31Å; L64-A66 PolarHBondContact O-N 3.29Å; L64-I67 PolarHBondContact O-N 3.41Å; L64-H68 WeakPolarHBondContact O-CB 3.45Å; L64-H68 PolarHBondContact O-CD2 3.24Å; L64-H68 VanDerWaalsContact O-CD2 3.24Å; L64-H68 PolarHBondContact O-N 2.93Å; L64-K82 HydrophobicContact CD2-CB 4.27Å; L64-K82 HydrophobicContact CD2-CG 3.79Å; L64-I86 HydrophobicContact CD1-CG1 4.33Å; L64-I86 HydrophobicContact CD2-CG1 4.32Å; L64-L89 HydrophobicContact CD1-CD1 3.59Å |
| 65 | L | 89.3 | Confident | 83.2 | Confident | 82 Ų | 82 | 56.7 Ų | 56.7 | 43% | 0.429 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -60.4 | -40 | 177.1 | -70 | 171.8 | 0 | 0 | 0 | 111.9 | L61 C62 H68 T69 L339 | L61-L65 HydrophobicContact CD1-CG 4.45Å; L61-L65 HydrophobicContact CG-CD1 4.15Å; L61-L65 HydrophobicContact CG-CG 4.48Å; L61-L65 VanDerWaalsContact O-CG 3.32Å; L61-L65 WeakPolarHBondContact O-CG 3.39Å; L61-L65 PolarHBondContact O-N 3.32Å; C62-L65 PolarHBondContact O-N 2.76Å; L65-H68 PolarHBondContact O-N 3.31Å; L65-T69 WeakPolarHBondContact O-CB 3.08Å; L65-T69 WeakPolarHBondContact O-CG2 3.16Å; L65-T69 PolarHBondContact O-N 2.96Å; L65-T69 PolarHBondContact O-OG1 2.89Å; L65-L339 HydrophobicContact CB-CD1 4.01Å |
| 66 | A | 86.3 | Confident | 82.6 | Confident | 0 Ų | 0 | 57.9 Ų | 57.9 | 0% | 0 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -67.5 | -43.6 | 178.7 | 0 | 0 | 0 | 0 | 0 | 111.6 | C62 V63 L64 H68 T69 T70 L335 L339 | C62-A66 WeakPolarHBondContact O-CB 3.32Å; C62-A66 PolarHBondContact O-N 3.3Å; V63-A66 PolarHBondContact O-N 3.44Å; L64-A66 VanDerWaalsContact C-N 3.31Å; L64-A66 PolarHBondContact O-N 3.29Å; A66-H68 VanDerWaalsContact C-N 3.31Å; A66-H68 PolarHBondContact O-N 2.87Å; A66-T69 PolarHBondContact O-N 2.91Å; A66-T69 PolarHBondContact O-OG1 3.49Å; A66-T70 PolarHBondContact O-N 2.91Å; A66-L335 HydrophobicContact CB-CD1 4.13Å; A66-L335 HydrophobicContact CB-CD2 4.06Å; A66-L335 HydrophobicContact CB-CG 3.68Å; A66-L335 WeakPolarHBondContact O-CD1 3.45Å; A66-L339 HydrophobicContact CB-CB 4.17Å; A66-L339 HydrophobicContact CB-CD1 3.77Å |
| 67 | I | 87.1 | Confident | 82 | Confident | 11 Ų | 11 | 58.4 Ų | 58.4 | 6% | 0.056 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -62.5 | -38.3 | 173.5 | -67.9 | 169.2 | 0 | 0 | 0 | 111.2 | V63 L64 S73 Y78 M81 K82 L335 | V63-I67 HydrophobicContact CG1-CD1 3.81Å; V63-I67 VanDerWaalsContact O-CG1 3.31Å; V63-I67 WeakPolarHBondContact O-CG1 3.3Å; V63-I67 PolarHBondContact O-N 3.48Å; L64-I67 PolarHBondContact O-N 3.41Å; I67-S73 WeakPolarHBondContact O-CB 3.16Å; I67-Y78 HydrophobicContact CG1-CD1 4.32Å; I67-M81 HydrophobicContact CD1-CB 3.78Å; I67-K82 HydrophobicContact CD1-CB 4.48Å; I67-L335 HydrophobicContact CG1-CD2 4.07Å |
| 68 | H | 84.4 | Confident | 81.5 | Confident | 126 Ų | 126 | 56.8 Ų | 56.8 | 58% | 0.583 | 29% | 0.294 | S | S | * | . | H | α-helix | trans | -73.3 | -27.5 | 178.9 | -89.7 | -84.7 | 0 | 0 | 0 | 113.9 | L64 L65 A66 K82 | L64-H68 WeakPolarHBondContact O-CB 3.45Å; L64-H68 PolarHBondContact O-CD2 3.24Å; L64-H68 VanDerWaalsContact O-CD2 3.24Å; L64-H68 PolarHBondContact O-N 2.93Å; L65-H68 PolarHBondContact O-N 3.31Å; A66-H68 VanDerWaalsContact C-N 3.31Å; A66-H68 PolarHBondContact O-N 2.87Å; H68-K82 PolarHBondContact CE1-NZ 2.89Å; H68-K82 PolarHBondContact NE2-NZ 3.33Å |
| 69 | T | 81.4 | Confident | 81.2 | Confident | 62 Ų | 62 | 58.1 Ų | 58.1 | 38% | 0.38 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -93.5 | -25 | -178 | 49.7 | 0 | 0 | 0 | 0 | 114.4 | L65 A66 | L65-T69 WeakPolarHBondContact O-CB 3.08Å; L65-T69 WeakPolarHBondContact O-CG2 3.16Å; L65-T69 PolarHBondContact O-N 2.96Å; L65-T69 PolarHBondContact O-OG1 2.89Å; A66-T69 PolarHBondContact O-N 2.91Å; A66-T69 PolarHBondContact O-OG1 3.49Å |
| 70 | T | 76 | Confident | 81 | Confident | 6 Ų | 6 | 57.6 Ų | 57.6 | 4% | 0.037 | 28% | 0.284 | C | S | . | . | trans | -75.4 | 133.4 | 176.3 | -172.5 | 0 | 0 | 0 | 0 | 112.6 | A66 H72 S73 L335 D338 | A66-T70 PolarHBondContact O-N 2.91Å; T70-H72 PolarHBondContact O-N 3.01Å; T70-H72 PolarHBondContact OG1-N 3.4Å; T70-S73 WeakPolarHBondContact O-CB 3.16Å; T70-S73 PolarHBondContact O-N 3.24Å; T70-S73 PolarHBondContact O-OG 3.28Å; T70-L335 HydrophobicContact CG2-CD1 3.36Å; T70-D338 WeakPolarHBondContact CB-OD2 3.28Å; T70-D338 PolarHBondContact OG1-OD2 3.2Å | ||
| 71 | K | 64.4 | Low | 80.8 | Confident | 205 Ų | 205 | 57.8 Ų | 57.8 | 89% | 0.891 | 29% | 0.285 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -67.1 | -19.4 | 170.8 | -78.2 | -175.9 | 174.6 | 179.6 | 0 | 112.8 | S73 | K71-S73 VanDerWaalsContact C-N 3.27Å; K71-S73 PolarHBondContact O-N 3.29Å |
| 72 | H | 58.9 | Low | 80.7 | Confident | 147 Ų | 147 | 56.6 Ų | 56.6 | 68% | 0.681 | 28% | 0.276 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -84 | 6.2 | 178.6 | -86.4 | -74 | 0 | 0 | 0 | 114.4 | T70 Q74 Y78 | T70-H72 PolarHBondContact O-N 3.01Å; T70-H72 PolarHBondContact OG1-N 3.4Å; H72-Q74 PolarHBondContact O-N 3.03Å; H72-Y78 VanDerWaalsContact O-CE2 3.25Å; H72-Y78 WeakPolarHBondContact O-CE2 3.49Å |
| 73 | S | 59.6 | Low | 80.8 | Confident | 34 Ų | 34 | 56.2 Ų | 56.2 | 24% | 0.238 | 27% | 0.27 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -60.5 | -7.4 | -175.5 | 54.2 | 0 | 0 | 0 | 0 | 116.2 | I67 T70 K71 S75 | I67-S73 WeakPolarHBondContact O-CB 3.16Å; T70-S73 WeakPolarHBondContact O-CB 3.16Å; T70-S73 PolarHBondContact O-N 3.24Å; T70-S73 PolarHBondContact O-OG 3.28Å; K71-S73 VanDerWaalsContact C-N 3.27Å; K71-S73 PolarHBondContact O-N 3.29Å; S73-S75 PolarHBondContact O-N 3.14Å; S73-S75 VanDerWaalsContact O-N 3.16Å |
| 74 | Q | 61.3 | Low | 80.9 | Confident | 130 Ų | 130 | 56.3 Ų | 56.3 | 61% | 0.607 | 27% | 0.27 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -73.1 | -1.7 | -177.3 | -65 | -59.1 | -32.2 | 0 | 0 | 115.7 | H72 R153 | H72-Q74 PolarHBondContact O-N 3.03Å; Q74-R153 PolarHBondContact O-NH1 3.26Å |
| 75 | S | 74.3 | Confident | 81 | Confident | 60 Ų | 60 | 55.2 Ų | 55.2 | 42% | 0.42 | 26% | 0.264 | S | S | . | . | S | Bend | trans | -69.5 | 138.5 | 174 | -177.3 | 0 | 0 | 0 | 0 | 112.2 | S73 M77 Y78 | S73-S75 PolarHBondContact O-N 3.14Å; S73-S75 VanDerWaalsContact O-N 3.16Å; S75-M77 PolarHBondContact O-N 3.39Å; S75-M77 PolarHBondContact OG-N 3.32Å; S75-Y78 PolarHBondContact O-N 2.98Å |
| 76 | R | 79 | Confident | 81.3 | Confident | 76 Ų | 76 | 54 Ų | 54 | 29% | 0.287 | 26% | 0.258 | S | S | . | . | H | α-helix | trans | -54.3 | -23.7 | 173.4 | -168.2 | 174.2 | -178 | -126.4 | -5.8 | 113.1 | F80 D139 D156 | R76-F80 HydrophobicContact CG-CE2 4.08Å; R76-F80 VanDerWaalsContact O-CD2 3.24Å; R76-F80 WeakPolarHBondContact O-CD2 3.38Å; R76-D139 IonicContact CZ-OD1 3.67Å; R76-D139 IonicContact CZ-OD2 3.81Å; R76-D139 IonicContact NE-OD1 3.29Å; R76-D139 IonicContact NH1-OD1 2.67Å; R76-D139 PolarHBondContact NH1-OD1 2.96Å; R76-D139 IonicContact NH1-OD2 2.74Å; R76-D139 IonicContact NH2-OD1 3.64Å; R76-D139 PolarHBondContact NH2-OD1 2.95Å; R76-D156 WeakPolarHBondContact CD-OD2 3.26Å; R76-D156 IonicContact CZ-OD1 3.29Å; R76-D156 VanDerWaalsContact CZ-OD1 3.29Å; R76-D156 IonicContact CZ-OD2 3.71Å; R76-D156 IonicContact NE-OD1 2.9Å; R76-D156 PolarHBondContact NE-OD1 2.91Å; R76-D156 VanDerWaalsContact NE-OD1 3.12Å; R76-D156 IonicContact NE-OD2 3.27Å; R76-D156 PolarHBondContact NE-OD2 3.04Å; R76-D156 IonicContact NH2-OD1 3.5Å; R76-D156 PolarHBondContact NH2-OD1 3.09Å; R76-D156 IonicContact NH2-OD2 2.71Å |
| 77 | M | 79.8 | Confident | 81.7 | Confident | 12 Ų | 12 | 54 Ų | 54 | 6% | 0.059 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -67.1 | -46.6 | 174.1 | -173.3 | 70.8 | -90.8 | 0 | 0 | 112.6 | S75 Y79 F80 M81 M136 R140 T272 M275 | S75-M77 PolarHBondContact O-N 3.39Å; S75-M77 PolarHBondContact OG-N 3.32Å; M77-Y79 PolarHBondContact O-N 2.93Å; M77-F80 HydrophobicContact CE-CB 3.91Å; M77-F80 PolarHBondContact O-N 3.43Å; M77-F80 VanDerWaalsContact O-N 3.14Å; M77-M81 HydrophobicContact CE-CG 4.18Å; M77-M81 HydrophobicContact CG-CE 3.68Å; M77-M81 HydrophobicContact CG-CG 4.35Å; M77-M81 HydrophobicContact CG-SD 3.91Å; M77-M81 WeakPolarHBondContact O-CG 3.3Å; M77-M81 PolarHBondContact O-N 2.74Å; M77-M81 HydrophobicContact SD-CE 4.42Å; M77-M136 HydrophobicContact CE-CG 3.86Å; M77-M136 HydrophobicContact CE-SD 3.62Å; M77-R140 PolarHBondContact SD-NH1 3.44Å; M77-T272 HydrophobicContact CG-CG2 4Å; M77-T272 HydrophobicContact SD-CG2 3.22Å; M77-T272 WeakPolarHBondContact SD-CG2 3.43Å; M77-M275 HydrophobicContact SD-CE 4.16Å |
| 78 | Y | 84.4 | Confident | 82 | Confident | 26 Ų | 26 | 53.5 Ų | 53.5 | 10% | 0.102 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -66.6 | -26.4 | -177.3 | -56.5 | -56.2 | 0 | 0 | 0 | 112.1 | I67 H72 S75 M81 K82 H334 L335 | I67-Y78 HydrophobicContact CG1-CD1 4.32Å; H72-Y78 VanDerWaalsContact O-CE2 3.25Å; H72-Y78 WeakPolarHBondContact O-CE2 3.49Å; S75-Y78 PolarHBondContact O-N 2.98Å; Y78-M81 HydrophobicContact CD1-SD 3.63Å; Y78-M81 HydrophobicContact CE1-SD 4.2Å; Y78-K82 VanDerWaalsContact O-CB 3.3Å; Y78-K82 WeakPolarHBondContact O-CB 3.25Å; Y78-K82 PolarHBondContact O-N 3.45Å; Y78-H334 PolarHBondContact OH-NE2 3.18Å; Y78-L335 HydrophobicContact CE1-CD1 4.49Å; Y78-L335 HydrophobicContact CE1-CD2 4.42Å |
| 79 | Y | 87.7 | Confident | 82.5 | Confident | 71 Ų | 71 | 48.9 Ų | 48.9 | 28% | 0.278 | 24% | 0.235 | S | C | . | . | H | α-helix | trans | -61.5 | -47.8 | 171 | -178.6 | -111.2 | 0 | 0 | 0 | 112.4 | M77 K82 H83 D156 V160 | M77-Y79 PolarHBondContact O-N 2.93Å; Y79-K82 PolarHBondContact O-N 2.87Å; Y79-H83 AromaticContact CE2-CD2 3.59Å; Y79-H83 AromaticContact CE2-NE2 3.32Å; Y79-H83 VanDerWaalsContact CE2-NE2 3.32Å; Y79-H83 WeakPolarHBondContact CE2-NE2 3.48Å; Y79-H83 AromaticContact CZ-CD2 3.62Å; Y79-H83 AromaticContact CZ-NE2 3.43Å; Y79-H83 PolarHBondContact O-CD2 3.19Å; Y79-H83 PolarHBondContact O-N 3.29Å; Y79-H83 PolarHBondContact OH-NE2 3.47Å; Y79-D156 HydrophobicContact CD1-CB 4.5Å; Y79-D156 HydrophobicContact CE1-CB 4.26Å; Y79-V160 HydrophobicContact CE1-CB 4.4Å; Y79-V160 HydrophobicContact CE1-CG2 3.7Å |
| 80 | F | 88.3 | Confident | 83.1 | Confident | 4 Ų | 4 | 47.3 Ų | 47.3 | 2% | 0.018 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -69.6 | -41.2 | 176.2 | -67.4 | -63 | 0 | 0 | 0 | 112.4 | R76 M77 K82 H83 L84 L135 D139 D156 V160 | R76-F80 HydrophobicContact CG-CE2 4.08Å; R76-F80 VanDerWaalsContact O-CD2 3.24Å; R76-F80 WeakPolarHBondContact O-CD2 3.38Å; M77-F80 HydrophobicContact CE-CB 3.91Å; M77-F80 PolarHBondContact O-N 3.43Å; M77-F80 VanDerWaalsContact O-N 3.14Å; F80-K82 VanDerWaalsContact C-N 3.29Å; F80-K82 PolarHBondContact O-N 3.21Å; F80-H83 PolarHBondContact O-N 3.37Å; F80-L84 WeakPolarHBondContact O-CB 3.43Å; F80-L84 PolarHBondContact O-N 2.84Å; F80-L135 HydrophobicContact CD1-CD2 4.46Å; F80-L135 HydrophobicContact CD1-CG 4.41Å; F80-L135 HydrophobicContact CE1-CD2 3.85Å; F80-L135 HydrophobicContact CE1-CG 3.78Å; F80-L135 HydrophobicContact CZ-CG 4.49Å; F80-D139 HydrophobicContact CE2-CB 4Å; F80-D139 WeakPolarHBondContact CE2-OD2 3.3Å; F80-D139 HydrophobicContact CZ-CB 4.22Å; F80-D156 HydrophobicContact CZ-CB 4.33Å; F80-V160 HydrophobicContact CD1-CG2 4.18Å; F80-V160 HydrophobicContact CE1-CG2 3.89Å |
| 81 | M | 88.9 | Confident | 83.9 | Confident | 4 Ų | 4 | 47.1 Ų | 47.1 | 2% | 0.02 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -56.1 | -43.8 | 173.6 | -69.8 | 166.7 | 161.2 | 0 | 0 | 111.5 | I67 M77 Y78 H83 L84 S85 M275 Y328 | I67-M81 HydrophobicContact CD1-CB 3.78Å; M77-M81 HydrophobicContact CE-CG 4.18Å; M77-M81 HydrophobicContact CG-CE 3.68Å; M77-M81 HydrophobicContact CG-CG 4.35Å; M77-M81 HydrophobicContact CG-SD 3.91Å; M77-M81 WeakPolarHBondContact O-CG 3.3Å; M77-M81 PolarHBondContact O-N 2.74Å; M77-M81 HydrophobicContact SD-CE 4.42Å; Y78-M81 HydrophobicContact CD1-SD 3.63Å; Y78-M81 HydrophobicContact CE1-SD 4.2Å; M81-H83 PolarHBondContact O-N 2.67Å; M81-L84 PolarHBondContact O-N 3.12Å; M81-S85 PolarHBondContact O-N 2.6Å; M81-S85 PolarHBondContact O-OG 3.02Å; M81-M275 HydrophobicContact CE-CE 3.59Å; M81-M275 HydrophobicContact CE-SD 3.45Å; M81-M275 WeakPolarHBondContact CE-SD 3.47Å; M81-Y328 HydrophobicContact CB-CE2 4.38Å; M81-Y328 HydrophobicContact CE-CD1 3.78Å; M81-Y328 HydrophobicContact CE-CE1 4.08Å; M81-Y328 HydrophobicContact CE-CG 4.34Å; M81-Y328 HydrophobicContact CG-CD1 4.41Å; M81-Y328 HydrophobicContact CG-CE1 3.97Å; M81-Y328 HydrophobicContact CG-CE2 4.33Å |
| 82 | K | 91.3 | Very high | 85.2 | Confident | 66 Ų | 66 | 37.4 Ų | 37.4 | 29% | 0.287 | 18% | 0.181 | S | C | . | . | H | α-helix | trans | -59.1 | -48 | 176.6 | 173.2 | 167.5 | 179.9 | 165.4 | 0 | 112.2 | L64 I67 H68 Y78 Y79 F80 I86 | L64-K82 HydrophobicContact CD2-CB 4.27Å; L64-K82 HydrophobicContact CD2-CG 3.79Å; I67-K82 HydrophobicContact CD1-CB 4.48Å; H68-K82 PolarHBondContact CE1-NZ 2.89Å; H68-K82 PolarHBondContact NE2-NZ 3.33Å; Y78-K82 VanDerWaalsContact O-CB 3.3Å; Y78-K82 WeakPolarHBondContact O-CB 3.25Å; Y78-K82 PolarHBondContact O-N 3.45Å; Y79-K82 PolarHBondContact O-N 2.87Å; F80-K82 VanDerWaalsContact C-N 3.29Å; F80-K82 PolarHBondContact O-N 3.21Å; K82-I86 HydrophobicContact CG-CD1 3.93Å; K82-I86 WeakPolarHBondContact O-CD1 3.41Å; K82-I86 VanDerWaalsContact O-CG1 3.25Å; K82-I86 WeakPolarHBondContact O-CG1 3.22Å; K82-I86 PolarHBondContact O-N 3.44Å |
| 83 | H | 93.5 | Very high | 86.8 | Confident | 37 Ų | 37 | 33.9 Ų | 33.9 | 17% | 0.171 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -69.9 | -32.8 | 179.9 | -80.5 | -76.3 | 0 | 0 | 0 | 113.1 | Y79 F80 M81 I86 A87 M132 V160 W164 | Y79-H83 AromaticContact CE2-CD2 3.59Å; Y79-H83 AromaticContact CE2-NE2 3.32Å; Y79-H83 VanDerWaalsContact CE2-NE2 3.32Å; Y79-H83 WeakPolarHBondContact CE2-NE2 3.48Å; Y79-H83 AromaticContact CZ-CD2 3.62Å; Y79-H83 AromaticContact CZ-NE2 3.43Å; Y79-H83 PolarHBondContact O-CD2 3.19Å; Y79-H83 PolarHBondContact O-N 3.29Å; Y79-H83 PolarHBondContact OH-NE2 3.47Å; F80-H83 PolarHBondContact O-N 3.37Å; M81-H83 PolarHBondContact O-N 2.67Å; H83-I86 PolarHBondContact O-N 2.96Å; H83-A87 PolarHBondContact O-N 2.96Å; H83-M132 HydrophobicContact CB-CG 4.37Å; H83-M132 HydrophobicContact CB-SD 3.64Å; H83-V160 HydrophobicContact CB-CG1 4.44Å; H83-W164 AromaticContact ND1-NE1 3.64Å |
| 84 | L | 91.8 | Very high | 88.3 | Confident | 1 Ų | 1 | 35.6 Ų | 35.6 | 1% | 0.005 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -67.9 | -47 | 174 | -176.1 | 43.6 | 0 | 0 | 0 | 111.2 | F80 M81 I86 A87 D88 S129 M132 M136 Y328 | F80-L84 WeakPolarHBondContact O-CB 3.43Å; F80-L84 PolarHBondContact O-N 2.84Å; M81-L84 PolarHBondContact O-N 3.12Å; L84-I86 VanDerWaalsContact C-N 3.29Å; L84-I86 PolarHBondContact O-N 3.19Å; L84-A87 WeakPolarHBondContact O-CB 3.45Å; L84-A87 PolarHBondContact O-N 2.76Å; L84-D88 PolarHBondContact O-N 3.48Å; L84-S129 WeakPolarHBondContact CD1-OG 3.42Å; L84-M132 HydrophobicContact CB-CB 4.26Å; L84-M132 HydrophobicContact CD1-CB 4.1Å; L84-M136 HydrophobicContact CD2-CE 3.93Å; L84-M136 HydrophobicContact CD2-SD 4.4Å; L84-Y328 VanDerWaalsContact CD2-OH 3.25Å; L84-Y328 WeakPolarHBondContact CD2-OH 3.47Å |
| 85 | S | 93.9 | Very high | 89.6 | Confident | 0 Ų | 0 | 29.7 Ų | 29.7 | 0% | 0 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -63.2 | -30.2 | 173.6 | -71.6 | 0 | 0 | 0 | 0 | 113.8 | N60 V63 M81 L89 | N60-S85 WeakPolarHBondContact OD1-CA 3.09Å; N60-S85 WeakPolarHBondContact OD1-CB 3.3Å; N60-S85 PolarHBondContact OD1-OG 3.22Å; V63-S85 WeakPolarHBondContact CG1-OG 3.44Å; M81-S85 PolarHBondContact O-N 2.6Å; M81-S85 PolarHBondContact O-OG 3.02Å; S85-L89 WeakPolarHBondContact O-CB 2.78Å; S85-L89 VanDerWaalsContact O-CG 3.26Å; S85-L89 WeakPolarHBondContact O-CG 3.5Å; S85-L89 PolarHBondContact O-N 3.45Å |
| 86 | I | 94.9 | Very high | 90.4 | Very high | 56 Ų | 56 | 27 Ų | 27 | 29% | 0.287 | 12% | 0.123 | S | C | . | . | H | α-helix | trans | -66.6 | -44 | 170.4 | -70.2 | 163.9 | 0 | 0 | 0 | 110.7 | L64 K82 H83 L84 L89 V90 W164 | L64-I86 HydrophobicContact CD1-CG1 4.33Å; L64-I86 HydrophobicContact CD2-CG1 4.32Å; K82-I86 HydrophobicContact CG-CD1 3.93Å; K82-I86 WeakPolarHBondContact O-CD1 3.41Å; K82-I86 VanDerWaalsContact O-CG1 3.25Å; K82-I86 WeakPolarHBondContact O-CG1 3.22Å; K82-I86 PolarHBondContact O-N 3.44Å; H83-I86 PolarHBondContact O-N 2.96Å; L84-I86 VanDerWaalsContact C-N 3.29Å; L84-I86 PolarHBondContact O-N 3.19Å; I86-L89 PolarHBondContact O-N 3.29Å; I86-V90 WeakPolarHBondContact O-CG2 3.3Å; I86-V90 PolarHBondContact O-N 3.14Å; I86-W164 HydrophobicContact CG2-CH2 4.02Å; I86-W164 HydrophobicContact CG2-CZ2 4.09Å |
| 87 | A | 94.6 | Very high | 90.9 | Very high | 0 Ų | 0 | 26.4 Ų | 26.4 | 0% | 0 | 13% | 0.125 | C | C | . | . | H | α-helix | trans | -65.3 | -39.4 | 177 | 0 | 0 | 0 | 0 | 0 | 112.5 | H83 L84 L89 V90 V91 A128 W164 | H83-A87 PolarHBondContact O-N 2.96Å; L84-A87 WeakPolarHBondContact O-CB 3.45Å; L84-A87 PolarHBondContact O-N 2.76Å; A87-L89 VanDerWaalsContact C-N 3.33Å; A87-L89 PolarHBondContact O-N 2.93Å; A87-V90 WeakPolarHBondContact O-CB 3.2Å; A87-V90 PolarHBondContact O-N 3.12Å; A87-V90 VanDerWaalsContact O-N 3.15Å; A87-V91 PolarHBondContact O-N 3.05Å; A87-A128 HydrophobicContact CB-CB 3.82Å; A87-W164 HydrophobicContact CB-CH2 4.13Å; A87-W164 HydrophobicContact CB-CZ2 4.13Å |
| 88 | D | 94.2 | Very high | 91.4 | Very high | 0 Ų | 0 | 27.1 Ų | 27.1 | 0% | 0 | 13% | 0.131 | C | C | . | . | H | α-helix | trans | -68.7 | -29.6 | 176.1 | -70.6 | -29.2 | 0 | 0 | 0 | 112.6 | L84 V91 A92 S129 S321 N324 | L84-D88 PolarHBondContact O-N 3.48Å; D88-V91 PolarHBondContact O-N 2.98Å; D88-A92 WeakPolarHBondContact O-CB 3.24Å; D88-A92 PolarHBondContact O-N 2.78Å; D88-S129 WeakPolarHBondContact OD1-CB 3.46Å; D88-S129 PolarHBondContact OD1-OG 2.98Å; D88-S321 WeakPolarHBondContact OD1-CB 3.34Å; D88-S321 PolarHBondContact OD1-OG 3.49Å; D88-N324 PolarHBondContact OD2-ND2 3.41Å |
| 89 | L | 94.8 | Very high | 91.4 | Very high | 30 Ų | 30 | 26.6 Ų | 26.6 | 16% | 0.157 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -69.7 | -36.4 | 168.1 | -74.3 | 171.9 | 0 | 0 | 0 | 112.4 | L57 N60 L64 S85 I86 A87 V91 A92 I93 | L57-L89 HydrophobicContact CD2-CD2 3.87Å; N60-L89 HydrophobicContact CB-CD1 4.43Å; N60-L89 HydrophobicContact CB-CD2 3.93Å; N60-L89 HydrophobicContact CB-CG 3.81Å; L64-L89 HydrophobicContact CD1-CD1 3.59Å; S85-L89 WeakPolarHBondContact O-CB 2.78Å; S85-L89 VanDerWaalsContact O-CG 3.26Å; S85-L89 WeakPolarHBondContact O-CG 3.5Å; S85-L89 PolarHBondContact O-N 3.45Å; I86-L89 PolarHBondContact O-N 3.29Å; A87-L89 VanDerWaalsContact C-N 3.33Å; A87-L89 PolarHBondContact O-N 2.93Å; L89-V91 VanDerWaalsContact C-N 3.33Å; L89-A92 PolarHBondContact O-N 3.24Å; L89-I93 WeakPolarHBondContact O-CB 3.37Å; L89-I93 VanDerWaalsContact O-CG1 3.31Å; L89-I93 WeakPolarHBondContact O-CG1 3.33Å; L89-I93 PolarHBondContact O-N 3.31Å |
| 90 | V | 93.5 | Very high | 91.4 | Very high | 28 Ų | 28 | 24 Ų | 24 | 17% | 0.17 | 12% | 0.12 | C | C | . | . | H | α-helix | trans | -62.3 | -42.2 | 171.7 | 171.7 | 0 | 0 | 0 | 0 | 110.1 | I86 A87 I93 F94 | I86-V90 WeakPolarHBondContact O-CG2 3.3Å; I86-V90 PolarHBondContact O-N 3.14Å; A87-V90 WeakPolarHBondContact O-CB 3.2Å; A87-V90 PolarHBondContact O-N 3.12Å; A87-V90 VanDerWaalsContact O-N 3.15Å; V90-I93 PolarHBondContact O-N 3.02Å; V90-F94 HydrophobicContact CB-CD2 4.41Å; V90-F94 HydrophobicContact CG1-CD2 3.88Å; V90-F94 WeakPolarHBondContact O-CB 3.33Å; V90-F94 WeakPolarHBondContact O-CD2 3.27Å; V90-F94 PolarHBondContact O-N 3.46Å |
| 91 | V | 92.7 | Very high | 91.4 | Very high | 3 Ų | 3 | 27.9 Ų | 27.9 | 2% | 0.018 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -60 | -49.6 | 171.5 | 170.8 | 0 | 0 | 0 | 0 | 111.2 | A87 D88 L89 I93 Q95 V96 G125 | A87-V91 PolarHBondContact O-N 3.05Å; D88-V91 PolarHBondContact O-N 2.98Å; L89-V91 VanDerWaalsContact C-N 3.33Å; V91-I93 PolarHBondContact O-N 3.37Å; V91-Q95 HydrophobicContact CG1-CB 4.23Å; V91-Q95 WeakPolarHBondContact O-CA 3.38Å; V91-Q95 VanDerWaalsContact O-CB 3.22Å; V91-Q95 WeakPolarHBondContact O-CB 3.33Å; V91-Q95 PolarHBondContact O-N 3.47Å; V91-V96 HydrophobicContact CG1-CG2 4.28Å; V91-V96 PolarHBondContact O-N 3.02Å; V91-G125 WeakPolarHBondContact CG2-O 3.47Å |
| 92 | A | 92.7 | Very high | 91.2 | Very high | 0 Ų | 0 | 30.7 Ų | 30.7 | 0% | 0 | 15% | 0.151 | C | C | . | . | I | π-helix | trans | -57.9 | -45.8 | 179.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | L53 A56 L57 D88 L89 L97 | L53-A92 HydrophobicContact CD1-CB 4.19Å; L53-A92 WeakPolarHBondContact CD1-O 3.29Å; A56-A92 HydrophobicContact CB-CB 3.97Å; L57-A92 HydrophobicContact CD2-CB 3.71Å; L57-A92 HydrophobicContact CG-CB 4.07Å; D88-A92 WeakPolarHBondContact O-CB 3.24Å; D88-A92 PolarHBondContact O-N 2.78Å; L89-A92 PolarHBondContact O-N 3.24Å; A92-L97 PolarHBondContact O-N 3.47Å |
| 93 | I | 92.7 | Very high | 90.7 | Very high | 73 Ų | 73 | 28.4 Ų | 28.4 | 37% | 0.374 | 14% | 0.142 | S | C | . | . | I | π-helix | trans | -80.6 | -35 | -173.8 | -64.2 | 169.9 | 0 | 0 | 0 | 113.2 | L57 L89 V90 V91 P98 | L57-I93 HydrophobicContact CD2-CD1 4.36Å; L57-I93 HydrophobicContact CD2-CG1 3.83Å; L89-I93 WeakPolarHBondContact O-CB 3.37Å; L89-I93 VanDerWaalsContact O-CG1 3.31Å; L89-I93 WeakPolarHBondContact O-CG1 3.33Å; L89-I93 PolarHBondContact O-N 3.31Å; V90-I93 PolarHBondContact O-N 3.02Å; V91-I93 PolarHBondContact O-N 3.37Å; I93-P98 WeakPolarHBondContact O-CD 3.48Å |
| 94 | F | 90.6 | Very high | 90.3 | Very high | 70 Ų | 70 | 31 Ų | 31 | 31% | 0.307 | 16% | 0.156 | S | C | . | . | I | π-helix | trans | -112.1 | -13.9 | -172.2 | -60.8 | -73.7 | 0 | 0 | 0 | 114.9 | V90 P98 L121 Q122 | V90-F94 HydrophobicContact CB-CD2 4.41Å; V90-F94 HydrophobicContact CG1-CD2 3.88Å; V90-F94 WeakPolarHBondContact O-CB 3.33Å; V90-F94 WeakPolarHBondContact O-CD2 3.27Å; V90-F94 PolarHBondContact O-N 3.46Å; F94-P98 WeakPolarHBondContact O-CG 3.37Å; F94-L121 HydrophobicContact CB-CB 3.69Å; F94-L121 HydrophobicContact CD1-CB 3.89Å; F94-L121 HydrophobicContact CD1-CD1 3.54Å; F94-L121 HydrophobicContact CD1-CG 4.37Å; F94-L121 HydrophobicContact CD2-CB 4.33Å; F94-L121 HydrophobicContact CD2-CD1 4.46Å; F94-L121 HydrophobicContact CE1-CD1 3.48Å; F94-L121 VanDerWaalsContact CE1-CD1 3.48Å; F94-L121 HydrophobicContact CE2-CD1 4.41Å; F94-L121 HydrophobicContact CG-CB 3.71Å; F94-L121 HydrophobicContact CG-CD1 4.05Å; F94-L121 HydrophobicContact CZ-CD1 3.94Å; F94-Q122 WeakPolarHBondContact O-CB 3.43Å |
| 95 | Q | 88.8 | Confident | 90 | Very high | 7 Ų | 7 | 33.2 Ų | 33.2 | 3% | 0.033 | 17% | 0.17 | C | C | . | . | I | π-helix | trans | -105.4 | -59.9 | 170.2 | 172.3 | -178.5 | -23.8 | 0 | 0 | 110.9 | V91 Q99 Q122 M126 | V91-Q95 HydrophobicContact CG1-CB 4.23Å; V91-Q95 WeakPolarHBondContact O-CA 3.38Å; V91-Q95 VanDerWaalsContact O-CB 3.22Å; V91-Q95 WeakPolarHBondContact O-CB 3.33Å; V91-Q95 PolarHBondContact O-N 3.47Å; Q95-Q99 VanDerWaalsContact O-CB 3.26Å; Q95-Q99 WeakPolarHBondContact O-CB 3.37Å; Q95-Q99 PolarHBondContact O-N 3.26Å; Q95-Q122 HydrophobicContact CB-CB 4.39Å; Q95-Q122 HydrophobicContact CB-CG 3.87Å; Q95-Q122 HydrophobicContact CG-CG 4Å; Q95-M126 VanDerWaalsContact CD-CE 3.48Å; Q95-M126 HydrophobicContact CG-CE 4.16Å; Q95-M126 VanDerWaalsContact OE1-CE 3.24Å |
| 96 | V | 89.9 | Confident | 89.4 | Confident | 2 Ų | 2 | 39 Ų | 39 | 1% | 0.012 | 20% | 0.195 | C | C | . | . | I | π-helix | trans | -73.6 | -44.2 | -169 | -172.6 | 0 | 0 | 0 | 0 | 112 | L49 L53 V91 Q99 L100 | L49-V96 HydrophobicContact CD2-CG1 4.21Å; L53-V96 HydrophobicContact CB-CG1 3.93Å; L53-V96 HydrophobicContact CD1-CB 4.28Å; L53-V96 HydrophobicContact CD1-CG1 4.36Å; V91-V96 HydrophobicContact CG1-CG2 4.28Å; V91-V96 PolarHBondContact O-N 3.02Å; V96-Q99 PolarHBondContact O-N 3.31Å; V96-L100 WeakPolarHBondContact O-CB 3.21Å; V96-L100 PolarHBondContact O-N 2.88Å |
| 97 | L | 90.9 | Very high | 88.7 | Confident | 64 Ų | 64 | 41 Ų | 41 | 34% | 0.335 | 20% | 0.199 | S | C | . | . | H | α-helix | trans | -63.7 | -47.6 | 178.1 | 169.7 | 67.6 | 0 | 0 | 0 | 113.2 | L53 A92 Q99 L100 I101 | L53-L97 HydrophobicContact CD1-CB 4.05Å; L53-L97 HydrophobicContact CD2-CB 4.05Å; L53-L97 HydrophobicContact CD2-CD1 3.93Å; A92-L97 PolarHBondContact O-N 3.47Å; L97-Q99 VanDerWaalsContact C-N 3.31Å; L97-Q99 PolarHBondContact O-N 2.92Å; L97-L100 PolarHBondContact O-N 3.35Å; L97-I101 HydrophobicContact CD1-CD1 3.89Å; L97-I101 HydrophobicContact CD1-CG1 4.17Å; L97-I101 HydrophobicContact CG-CD1 4.03Å; L97-I101 WeakPolarHBondContact O-CG1 3.33Å; L97-I101 PolarHBondContact O-N 3.49Å |
| 98 | P | 88.5 | Confident | 88.3 | Confident | 28 Ų | 28 | 42.5 Ų | 42.5 | 18% | 0.182 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -67.6 | -30.9 | 177.8 | -24.7 | 38.1 | 0 | 0 | 0 | 113.1 | I93 F94 W102 V118 | I93-P98 WeakPolarHBondContact O-CD 3.48Å; F94-P98 WeakPolarHBondContact O-CG 3.37Å; P98-W102 WeakPolarHBondContact O-CB 3.42Å; P98-W102 PolarHBondContact O-N 3.2Å; P98-V118 HydrophobicContact CB-CG1 3.6Å; P98-V118 HydrophobicContact CG-CG1 3.95Å |
| 99 | Q | 86.3 | Confident | 87.8 | Confident | 14 Ų | 14 | 50.7 Ų | 50.7 | 7% | 0.065 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -63.1 | -51.8 | 169.9 | 178.7 | -178.6 | -14.4 | 0 | 0 | 111 | L49 Q95 V96 L97 I101 W102 D103 M314 | L49-Q99 HydrophobicContact CD1-CG 4.06Å; Q95-Q99 VanDerWaalsContact O-CB 3.26Å; Q95-Q99 WeakPolarHBondContact O-CB 3.37Å; Q95-Q99 PolarHBondContact O-N 3.26Å; V96-Q99 PolarHBondContact O-N 3.31Å; L97-Q99 VanDerWaalsContact C-N 3.31Å; L97-Q99 PolarHBondContact O-N 2.92Å; Q99-I101 VanDerWaalsContact C-N 3.29Å; Q99-I101 PolarHBondContact O-N 2.91Å; Q99-W102 WeakPolarHBondContact O-CA 3.38Å; Q99-W102 VanDerWaalsContact O-CB 3.3Å; Q99-W102 WeakPolarHBondContact O-CB 3.31Å; Q99-W102 PolarHBondContact O-N 2.92Å; Q99-D103 WeakPolarHBondContact CG-OD2 3.48Å; Q99-D103 PolarHBondContact O-N 3.22Å; Q99-M314 VanDerWaalsContact CD-CE 3.46Å; Q99-M314 HydrophobicContact CG-CE 4.08Å; Q99-M314 PolarHBondContact NE2-SD 3.48Å |
| 100 | L | 87.7 | Confident | 87.4 | Confident | 17 Ų | 17 | 50.7 Ų | 50.7 | 9% | 0.089 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -56.2 | -42.4 | 177.5 | 175.9 | 64.5 | 0 | 0 | 0 | 112.3 | V46 L49 A50 L53 V96 L97 D103 I104 | V46-L100 HydrophobicContact CB-CD1 4.42Å; V46-L100 HydrophobicContact CG1-CD1 3.89Å; V46-L100 WeakPolarHBondContact O-CD1 3.4Å; L49-L100 HydrophobicContact CB-CB 4.4Å; L49-L100 HydrophobicContact CB-CD1 3.9Å; A50-L100 HydrophobicContact CB-CD1 4.24Å; A50-L100 HydrophobicContact CB-CD2 4.09Å; L53-L100 HydrophobicContact CD2-CD2 3.74Å; V96-L100 WeakPolarHBondContact O-CB 3.21Å; V96-L100 PolarHBondContact O-N 2.88Å; L97-L100 PolarHBondContact O-N 3.35Å; L100-D103 PolarHBondContact O-N 3.16Å; L100-I104 HydrophobicContact CD1-CD1 3.93Å; L100-I104 HydrophobicContact CD1-CG1 4.43Å; L100-I104 HydrophobicContact CG-CD1 4Å; L100-I104 WeakPolarHBondContact O-CD1 3.49Å; L100-I104 VanDerWaalsContact O-CG1 3.26Å; L100-I104 WeakPolarHBondContact O-CG1 3.3Å; L100-I104 PolarHBondContact O-N 2.99Å; L100-I104 VanDerWaalsContact O-N 3.15Å |
| 101 | I | 88.1 | Confident | 87.3 | Confident | 86 Ų | 86 | 53.3 Ų | 53.3 | 44% | 0.441 | 26% | 0.263 | S | S | . | . | H | α-helix | trans | -60.1 | -48.4 | 174.3 | -68.6 | 165.8 | 0 | 0 | 0 | 109.7 | L97 Q99 D103 I104 T105 | L97-I101 HydrophobicContact CD1-CD1 3.89Å; L97-I101 HydrophobicContact CD1-CG1 4.17Å; L97-I101 HydrophobicContact CG-CD1 4.03Å; L97-I101 WeakPolarHBondContact O-CG1 3.33Å; L97-I101 PolarHBondContact O-N 3.49Å; Q99-I101 VanDerWaalsContact C-N 3.29Å; Q99-I101 PolarHBondContact O-N 2.91Å; I101-D103 VanDerWaalsContact C-N 3.35Å; I101-D103 PolarHBondContact O-N 3.12Å; I101-I104 PolarHBondContact O-N 3.1Å; I101-T105 HydrophobicContact CG2-CG2 4.15Å; I101-T105 WeakPolarHBondContact O-CB 3.45Å; I101-T105 WeakPolarHBondContact O-CG2 3.42Å; I101-T105 PolarHBondContact O-N 3.01Å; I101-T105 PolarHBondContact O-OG1 3.38Å |
| 102 | W | 83.9 | Confident | 87.3 | Confident | 63 Ų | 63 | 55.5 Ų | 55.5 | 24% | 0.239 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -59 | -42.6 | 178.9 | -161.9 | -65.7 | 0 | 0 | 0 | 113.2 | P98 Q99 I104 T105 F106 F108 D189 C190 | P98-W102 WeakPolarHBondContact O-CB 3.42Å; P98-W102 PolarHBondContact O-N 3.2Å; Q99-W102 WeakPolarHBondContact O-CA 3.38Å; Q99-W102 VanDerWaalsContact O-CB 3.3Å; Q99-W102 WeakPolarHBondContact O-CB 3.31Å; Q99-W102 PolarHBondContact O-N 2.92Å; W102-I104 VanDerWaalsContact C-N 3.29Å; W102-I104 PolarHBondContact O-N 3.18Å; W102-T105 PolarHBondContact O-N 3.21Å; W102-F106 VanDerWaalsContact O-CA 3.25Å; W102-F106 WeakPolarHBondContact O-CA 3.36Å; W102-F106 PolarHBondContact O-N 3.44Å; W102-F108 HydrophobicContact CE3-CB 4.25Å; W102-F108 HydrophobicContact CE3-CD2 4.18Å; W102-F108 HydrophobicContact CH2-CB 3.84Å; W102-F108 HydrophobicContact CZ3-CB 3.62Å; W102-F108 AromaticContact CZ3-CD2 3.77Å; W102-F108 HydrophobicContact CZ3-CD2 3.77Å; W102-F108 HydrophobicContact CZ3-CG 4.09Å; W102-D189 WeakPolarHBondContact CH2-OD1 3.42Å; W102-D189 WeakPolarHBondContact CZ2-OD1 3.5Å; W102-C190 HydrophobicContact CH2-CB 3.69Å; W102-C190 HydrophobicContact CZ3-CB 3.74Å |
| 103 | D | 81.3 | Confident | 87.3 | Confident | 18 Ų | 18 | 62 Ų | 62 | 10% | 0.096 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -69.8 | -28.8 | -178.6 | -67.4 | -38.5 | 0 | 0 | 0 | 112.3 | V46 L49 Q99 L100 I101 | V46-D103 HydrophobicContact CG2-CB 3.9Å; L49-D103 WeakPolarHBondContact CD1-OD2 3.26Å; Q99-D103 WeakPolarHBondContact CG-OD2 3.48Å; Q99-D103 PolarHBondContact O-N 3.22Å; L100-D103 PolarHBondContact O-N 3.16Å; I101-D103 VanDerWaalsContact C-N 3.35Å; I101-D103 PolarHBondContact O-N 3.12Å |
| 104 | I | 84.9 | Confident | 87.3 | Confident | 92 Ų | 92 | 62 Ų | 62 | 47% | 0.472 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -77 | -44.7 | 172.1 | -67.4 | 166.5 | 0 | 0 | 0 | 111.7 | V46 L100 I101 W102 F106 | V46-I104 HydrophobicContact CG1-CD1 4.03Å; V46-I104 HydrophobicContact CG1-CG1 3.68Å; V46-I104 HydrophobicContact CG2-CG1 4Å; L100-I104 HydrophobicContact CD1-CD1 3.93Å; L100-I104 HydrophobicContact CD1-CG1 4.43Å; L100-I104 HydrophobicContact CG-CD1 4Å; L100-I104 WeakPolarHBondContact O-CD1 3.49Å; L100-I104 VanDerWaalsContact O-CG1 3.26Å; L100-I104 WeakPolarHBondContact O-CG1 3.3Å; L100-I104 PolarHBondContact O-N 2.99Å; L100-I104 VanDerWaalsContact O-N 3.15Å; I101-I104 PolarHBondContact O-N 3.1Å; W102-I104 VanDerWaalsContact C-N 3.29Å; W102-I104 PolarHBondContact O-N 3.18Å; I104-F106 VanDerWaalsContact O-CD2 3.3Å; I104-F106 WeakPolarHBondContact O-CD2 3.34Å; I104-F106 WeakPolarHBondContact O-CE2 3.43Å |
| 105 | T | 84.9 | Confident | 87.3 | Confident | 47 Ų | 47 | 58.7 Ų | 58.7 | 29% | 0.288 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -94.1 | -8.1 | -170.2 | 65.6 | 0 | 0 | 0 | 0 | 113.8 | I101 W102 R107 Y109 | I101-T105 HydrophobicContact CG2-CG2 4.15Å; I101-T105 WeakPolarHBondContact O-CB 3.45Å; I101-T105 WeakPolarHBondContact O-CG2 3.42Å; I101-T105 PolarHBondContact O-N 3.01Å; I101-T105 PolarHBondContact O-OG1 3.38Å; W102-T105 PolarHBondContact O-N 3.21Å; T105-R107 PolarHBondContact O-N 2.91Å; T105-R107 PolarHBondContact OG1-O 2.98Å; T105-Y109 HydrophobicContact CG2-CD2 4.49Å |
| 106 | F | 80.8 | Confident | 87.5 | Confident | 122 Ų | 122 | 61.4 Ų | 61.4 | 54% | 0.535 | 30% | 0.304 | S | S | . | . | S | Bend | trans | 57.8 | 1.7 | -178.4 | -59.7 | -103.7 | 0 | 0 | 0 | 115.7 | W102 I104 | W102-F106 VanDerWaalsContact O-CA 3.25Å; W102-F106 WeakPolarHBondContact O-CA 3.36Å; W102-F106 PolarHBondContact O-N 3.44Å; I104-F106 VanDerWaalsContact O-CD2 3.3Å; I104-F106 WeakPolarHBondContact O-CD2 3.34Å; I104-F106 WeakPolarHBondContact O-CE2 3.43Å |
| 107 | R | 80.9 | Confident | 87.7 | Confident | 98 Ų | 98 | 65.1 Ų | 65.1 | 37% | 0.37 | 32% | 0.323 | S | S | . | . | S | Bend | trans | -153.7 | 152 | -170.8 | -64.7 | -64 | -177.5 | -175 | -0.1 | 110.8 | T105 Y109 D189 | T105-R107 PolarHBondContact O-N 2.91Å; T105-R107 PolarHBondContact OG1-O 2.98Å; R107-Y109 HydrophobicContact CB-CD2 4.28Å; R107-Y109 HydrophobicContact CB-CE2 3.66Å; R107-Y109 VanDerWaalsContact O-CD2 3.32Å; R107-Y109 WeakPolarHBondContact O-CD2 3.4Å; R107-D189 IonicContact NH1-OD2 3.98Å; R107-D189 PolarHBondContact NH1-OD2 3.37Å |
| 108 | F | 86.1 | Confident | 87.7 | Confident | 31 Ų | 31 | 63.1 Ų | 63.1 | 14% | 0.136 | 31% | 0.313 | C | S | . | . | trans | -73.5 | 126.1 | 165 | -169.3 | -105.9 | 0 | 0 | 0 | 112.7 | W102 G110 L114 C115 L180 D189 C190 | W102-F108 HydrophobicContact CE3-CB 4.25Å; W102-F108 HydrophobicContact CE3-CD2 4.18Å; W102-F108 HydrophobicContact CH2-CB 3.84Å; W102-F108 HydrophobicContact CZ3-CB 3.62Å; W102-F108 AromaticContact CZ3-CD2 3.77Å; W102-F108 HydrophobicContact CZ3-CD2 3.77Å; W102-F108 HydrophobicContact CZ3-CG 4.09Å; F108-G110 WeakPolarHBondContact CE1-O 3.48Å; F108-L114 HydrophobicContact CZ-CB 4.11Å; F108-L114 HydrophobicContact CZ-CD2 4.22Å; F108-L114 HydrophobicContact CZ-CG 4.01Å; F108-C115 HydrophobicContact CD1-CB 4.21Å; F108-C115 HydrophobicContact CE1-CB 3.65Å; F108-C115 HydrophobicContact CE2-CB 4.44Å; F108-C115 VanDerWaalsContact CZ-CA 3.49Å; F108-C115 HydrophobicContact CZ-CB 3.8Å; F108-C115 VanDerWaalsContact CZ-N 3.34Å; F108-L180 HydrophobicContact CD1-CD1 3.97Å; F108-D189 WeakPolarHBondContact CB-OD1 3.43Å; F108-D189 PolarHBondContact N-OD1 3.5Å; F108-C190 HydrophobicContact CB-CB 3.81Å; F108-C190 HydrophobicContact CD1-CB 4.02Å; F108-C190 HydrophobicContact CD2-CB 4Å; F108-C190 HydrophobicContact CG-CB 3.65Å | ||
| 109 | Y | 83.6 | Confident | 87.8 | Confident | 171 Ų | 171 | 63.6 Ų | 63.6 | 67% | 0.671 | 31% | 0.313 | S | S | * | . | trans | -112.6 | 102 | 171.4 | -68.4 | -89.8 | 0 | 0 | 0 | 110 | T105 R107 | T105-Y109 HydrophobicContact CG2-CD2 4.49Å; R107-Y109 HydrophobicContact CB-CD2 4.28Å; R107-Y109 HydrophobicContact CB-CE2 3.66Å; R107-Y109 VanDerWaalsContact O-CD2 3.32Å; R107-Y109 WeakPolarHBondContact O-CD2 3.4Å | ||
| 110 | G | 87.3 | Confident | 88.2 | Confident | 31 Ų | 31 | 64.7 Ų | 64.7 | 32% | 0.32 | 32% | 0.316 | S | S | . | . | S | Bend | trans | 163.5 | 173.6 | 176.6 | 0 | 0 | 0 | 0 | 0 | 114.1 | F108 | F108-G110 WeakPolarHBondContact CE1-O 3.48Š|
| 111 | P | 91.5 | Very high | 88.5 | Confident | 83 Ų | 83 | 65.6 Ų | 65.6 | 54% | 0.539 | 32% | 0.321 | S | S | . | . | trans | -73.8 | 160.4 | 176.1 | 31.3 | -35.6 | 0 | 0 | 0 | 112.4 | I113 L114 C115 | P111-I113 VanDerWaalsContact C-N 3.26Å; P111-I113 PolarHBondContact O-N 3.26Å; P111-L114 HydrophobicContact CG-CB 3.94Å; P111-L114 WeakPolarHBondContact O-CA 3.24Å; P111-L114 WeakPolarHBondContact O-CB 3.38Å; P111-L114 PolarHBondContact O-N 3.2Å; P111-C115 PolarHBondContact O-N 3.38Å; P111-C115 VanDerWaalsContact O-N 3.16Å | ||
| 112 | D | 91.9 | Very high | 88.6 | Confident | 48 Ų | 48 | 62.8 Ų | 62.8 | 26% | 0.257 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -51.3 | -41.4 | 178 | 180 | 61.2 | 0 | 0 | 0 | 113.5 | L114 C115 R116 S179 L180 | D112-L114 VanDerWaalsContact C-N 3.27Å; D112-L114 PolarHBondContact O-N 2.91Å; D112-C115 WeakPolarHBondContact O-CB 3.22Å; D112-C115 PolarHBondContact O-N 3.34Å; D112-R116 WeakPolarHBondContact O-CG 3.25Å; D112-R116 PolarHBondContact O-N 3.01Å; D112-R116 IonicContact OD1-CZ 3.77Å; D112-R116 IonicContact OD1-NE 3.3Å; D112-R116 PolarHBondContact OD1-NE 3.43Å; D112-R116 IonicContact OD1-NH2 2.75Å; D112-R116 PolarHBondContact OD1-NH2 2.9Å; D112-R116 IonicContact OD2-CZ 2.74Å; D112-R116 VanDerWaalsContact OD2-CZ 3.29Å; D112-R116 IonicContact OD2-NE 2.74Å; D112-R116 PolarHBondContact OD2-NE 2.98Å; D112-R116 IonicContact OD2-NH2 2.71Å; D112-R116 PolarHBondContact OD2-NH2 2.71Å; D112-S179 WeakPolarHBondContact OD1-CA 3.47Å; D112-S179 WeakPolarHBondContact OD1-CB 3.3Å; D112-L180 HydrophobicContact CB-CB 3.92Å; D112-L180 PolarHBondContact OD1-N 3.29Å |
| 113 | I | 93.2 | Very high | 89 | Confident | 136 Ų | 136 | 60.1 Ų | 60.1 | 70% | 0.697 | 30% | 0.297 | S | S | * | . | H | α-helix | trans | -59.3 | -38.8 | 177.4 | -60.3 | 173.4 | 0 | 0 | 0 | 111.3 | P111 L117 | P111-I113 VanDerWaalsContact C-N 3.26Å; P111-I113 PolarHBondContact O-N 3.26Å; I113-L117 VanDerWaalsContact O-CB 3.26Å; I113-L117 WeakPolarHBondContact O-CB 3.2Å; I113-L117 PolarHBondContact O-N 3.41Å |
| 114 | L | 91.7 | Very high | 89.7 | Confident | 75 Ų | 75 | 59.4 Ų | 59.4 | 39% | 0.393 | 29% | 0.293 | S | S | . | . | H | α-helix | trans | -71.4 | -40.3 | 178.1 | -174.5 | 63.6 | 0 | 0 | 0 | 111.1 | F108 P111 D112 L117 V118 | F108-L114 HydrophobicContact CZ-CB 4.11Å; F108-L114 HydrophobicContact CZ-CD2 4.22Å; F108-L114 HydrophobicContact CZ-CG 4.01Å; P111-L114 HydrophobicContact CG-CB 3.94Å; P111-L114 WeakPolarHBondContact O-CA 3.24Å; P111-L114 WeakPolarHBondContact O-CB 3.38Å; P111-L114 PolarHBondContact O-N 3.2Å; D112-L114 VanDerWaalsContact C-N 3.27Å; D112-L114 PolarHBondContact O-N 2.91Å; L114-L117 PolarHBondContact O-N 3.31Å; L114-V118 HydrophobicContact CD1-CG2 4.19Å; L114-V118 HydrophobicContact CG-CG2 4.33Å; L114-V118 WeakPolarHBondContact O-CB 3.49Å; L114-V118 VanDerWaalsContact O-CG2 3.27Å; L114-V118 WeakPolarHBondContact O-CG2 3.5Å; L114-V118 PolarHBondContact O-N 3.3Å |
| 115 | C | 91.3 | Very high | 90 | Very high | 0 Ų | 0 | 55 Ų | 55 | 0% | 0 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -55.3 | -53 | 173.3 | 159.5 | 0 | 0 | 0 | 0 | 111.1 | F108 P111 D112 L117 V118 K119 C190 | F108-C115 HydrophobicContact CD1-CB 4.21Å; F108-C115 HydrophobicContact CE1-CB 3.65Å; F108-C115 HydrophobicContact CE2-CB 4.44Å; F108-C115 VanDerWaalsContact CZ-CA 3.49Å; F108-C115 HydrophobicContact CZ-CB 3.8Å; F108-C115 VanDerWaalsContact CZ-N 3.34Å; P111-C115 PolarHBondContact O-N 3.38Å; P111-C115 VanDerWaalsContact O-N 3.16Å; D112-C115 WeakPolarHBondContact O-CB 3.22Å; D112-C115 PolarHBondContact O-N 3.34Å; C115-L117 PolarHBondContact O-N 2.99Å; C115-V118 PolarHBondContact O-N 3.03Å; C115-K119 WeakPolarHBondContact O-CG 3.34Å; C115-K119 PolarHBondContact O-N 3.34Å; C115-C190 VanDerWaalsContact CA-SG 3.55Å; C115-C190 HydrophobicContact CB-CB 3.68Å; C115-C190 WeakPolarHBondContact CB-SG 3.44Å; C115-C190 VanDerWaalsContact SG-CA 3.56Å; C115-C190 WeakPolarHBondContact SG-CB 3.07Å; C115-C190 CovalentContact SG-SG 2.03Å; C115-C190 PolarHBondContact SG-SG 3.45Å |
| 116 | R | 94 | Very high | 90.4 | Very high | 63 Ų | 63 | 53.4 Ų | 53.4 | 24% | 0.238 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -58.8 | -47.9 | 177.7 | -67.8 | -178.5 | -162.1 | -85.7 | -7.4 | 112.1 | D112 V118 K119 Y120 M175 F178 S179 | D112-R116 WeakPolarHBondContact O-CG 3.25Å; D112-R116 PolarHBondContact O-N 3.01Å; D112-R116 IonicContact OD1-CZ 3.77Å; D112-R116 IonicContact OD1-NE 3.3Å; D112-R116 PolarHBondContact OD1-NE 3.43Å; D112-R116 IonicContact OD1-NH2 2.75Å; D112-R116 PolarHBondContact OD1-NH2 2.9Å; D112-R116 IonicContact OD2-CZ 2.74Å; D112-R116 VanDerWaalsContact OD2-CZ 3.29Å; D112-R116 IonicContact OD2-NE 2.74Å; D112-R116 PolarHBondContact OD2-NE 2.98Å; D112-R116 IonicContact OD2-NH2 2.71Å; D112-R116 PolarHBondContact OD2-NH2 2.71Å; R116-V118 PolarHBondContact O-N 3.32Å; R116-K119 PolarHBondContact O-N 3.37Å; R116-Y120 VanDerWaalsContact O-CB 3.28Å; R116-Y120 WeakPolarHBondContact O-CB 3.23Å; R116-Y120 PolarHBondContact O-N 3.11Å; R116-M175 HydrophobicContact CB-CE 3.82Å; R116-M175 HydrophobicContact CB-SD 3.89Å; R116-M175 PolarHBondContact NH1-O 3.47Å; R116-F178 WeakPolarHBondContact CG-O 3.28Å; R116-F178 PolarHBondContact NH1-O 2.99Å; R116-S179 VanDerWaalsContact NH2-CB 3.29Å |
| 117 | L | 93.3 | Very high | 91 | Very high | 80 Ų | 80 | 47.6 Ų | 47.6 | 42% | 0.419 | 23% | 0.234 | S | C | . | . | H | α-helix | trans | -63.8 | -41.8 | -178.2 | -175.9 | 63.3 | 0 | 0 | 0 | 112 | I113 L114 C115 Y120 L121 | I113-L117 VanDerWaalsContact O-CB 3.26Å; I113-L117 WeakPolarHBondContact O-CB 3.2Å; I113-L117 PolarHBondContact O-N 3.41Å; L114-L117 PolarHBondContact O-N 3.31Å; C115-L117 PolarHBondContact O-N 2.99Å; L117-Y120 PolarHBondContact O-N 2.99Å; L117-L121 HydrophobicContact CD1-CD1 3.77Å; L117-L121 HydrophobicContact CD1-CG 3.97Å; L117-L121 HydrophobicContact CG-CD1 3.83Å; L117-L121 HydrophobicContact CG-CG 4.35Å; L117-L121 WeakPolarHBondContact O-CB 3.46Å; L117-L121 VanDerWaalsContact O-CG 3.3Å; L117-L121 WeakPolarHBondContact O-CG 3.43Å; L117-L121 PolarHBondContact O-N 3.44Å |
| 118 | V | 91.1 | Very high | 91.7 | Very high | 22 Ų | 22 | 42.9 Ų | 42.9 | 13% | 0.133 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -61.8 | -52.2 | 175.8 | 166.3 | 0 | 0 | 0 | 0 | 110.6 | P98 L114 C115 R116 Y120 L121 Q122 | P98-V118 HydrophobicContact CB-CG1 3.6Å; P98-V118 HydrophobicContact CG-CG1 3.95Å; L114-V118 HydrophobicContact CD1-CG2 4.19Å; L114-V118 HydrophobicContact CG-CG2 4.33Å; L114-V118 WeakPolarHBondContact O-CB 3.49Å; L114-V118 VanDerWaalsContact O-CG2 3.27Å; L114-V118 WeakPolarHBondContact O-CG2 3.5Å; L114-V118 PolarHBondContact O-N 3.3Å; C115-V118 PolarHBondContact O-N 3.03Å; R116-V118 PolarHBondContact O-N 3.32Å; V118-Y120 VanDerWaalsContact C-N 3.31Å; V118-Y120 PolarHBondContact O-N 3.45Å; V118-L121 PolarHBondContact O-N 3.11Å; V118-Q122 WeakPolarHBondContact O-CB 3.33Å; V118-Q122 PolarHBondContact O-N 3.47Å |
| 119 | K | 90.6 | Very high | 92.1 | Very high | 39 Ų | 39 | 41.5 Ų | 41.5 | 17% | 0.17 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -62.9 | -37 | 180 | -63.5 | -67.2 | -177.3 | -173.8 | 0 | 112.2 | C115 R116 V123 F178 | C115-K119 WeakPolarHBondContact O-CG 3.34Å; C115-K119 PolarHBondContact O-N 3.34Å; R116-K119 PolarHBondContact O-N 3.37Å; K119-V123 PolarHBondContact O-N 3.02Å; K119-F178 HydrophobicContact CB-CB 4.02Å; K119-F178 HydrophobicContact CB-CD2 4.16Å; K119-F178 HydrophobicContact CB-CG 4.05Å; K119-F178 HydrophobicContact CD-CD1 4.14Å; K119-F178 HydrophobicContact CD-CE1 4.46Å; K119-F178 HydrophobicContact CD-CG 4.3Å; K119-F178 HydrophobicContact CG-CB 3.84Å; K119-F178 HydrophobicContact CG-CD1 4.07Å; K119-F178 HydrophobicContact CG-CD2 4.37Å; K119-F178 HydrophobicContact CG-CG 3.82Å |
| 120 | Y | 94.3 | Very high | 92.6 | Very high | 37 Ų | 37 | 33.4 Ų | 33.4 | 15% | 0.145 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -63.7 | -54.7 | 173.2 | 178.9 | -106.1 | 0 | 0 | 0 | 112.2 | R116 L117 V118 Q122 V123 V124 L168 S171 Q174 M175 | R116-Y120 VanDerWaalsContact O-CB 3.28Å; R116-Y120 WeakPolarHBondContact O-CB 3.23Å; R116-Y120 PolarHBondContact O-N 3.11Å; L117-Y120 PolarHBondContact O-N 2.99Å; V118-Y120 VanDerWaalsContact C-N 3.31Å; V118-Y120 PolarHBondContact O-N 3.45Å; Y120-Q122 VanDerWaalsContact C-N 3.34Å; Y120-Q122 PolarHBondContact O-N 2.92Å; Y120-V123 PolarHBondContact O-N 3.44Å; Y120-V123 VanDerWaalsContact O-N 3.15Å; Y120-V124 HydrophobicContact CD1-CG2 4.03Å; Y120-V124 HydrophobicContact CD2-CG2 4.34Å; Y120-V124 HydrophobicContact CE1-CG2 3.64Å; Y120-V124 HydrophobicContact CE2-CG2 3.98Å; Y120-V124 HydrophobicContact CG-CG2 4.36Å; Y120-V124 WeakPolarHBondContact O-CG2 3.43Å; Y120-V124 PolarHBondContact O-N 3.1Å; Y120-L168 HydrophobicContact CE1-CD2 4.39Å; Y120-L168 WeakPolarHBondContact OH-CA 3.34Å; Y120-L168 WeakPolarHBondContact OH-CD2 3.29Å; Y120-L168 PolarHBondContact OH-O 2.7Å; Y120-S171 VanDerWaalsContact CD2-O 3.31Å; Y120-S171 WeakPolarHBondContact CD2-O 3.34Å; Y120-Q174 HydrophobicContact CD2-CB 4.33Å; Y120-M175 VanDerWaalsContact CB-SD 3.59Å; Y120-M175 HydrophobicContact CD2-CG 3.82Å; Y120-M175 HydrophobicContact CD2-SD 4.37Å; Y120-M175 HydrophobicContact CG-CG 4.01Å; Y120-M175 HydrophobicContact CG-SD 3.94Å |
| 121 | L | 93.3 | Very high | 93 | Very high | 35 Ų | 35 | 33.1 Ų | 33.1 | 18% | 0.183 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -67 | -33 | -177 | -68.5 | 176.8 | 0 | 0 | 0 | 113 | F94 L117 V118 V123 V124 G125 | F94-L121 HydrophobicContact CB-CB 3.69Å; F94-L121 HydrophobicContact CD1-CB 3.89Å; F94-L121 HydrophobicContact CD1-CD1 3.54Å; F94-L121 HydrophobicContact CD1-CG 4.37Å; F94-L121 HydrophobicContact CD2-CB 4.33Å; F94-L121 HydrophobicContact CD2-CD1 4.46Å; F94-L121 HydrophobicContact CE1-CD1 3.48Å; F94-L121 VanDerWaalsContact CE1-CD1 3.48Å; F94-L121 HydrophobicContact CE2-CD1 4.41Å; F94-L121 HydrophobicContact CG-CB 3.71Å; F94-L121 HydrophobicContact CG-CD1 4.05Å; F94-L121 HydrophobicContact CZ-CD1 3.94Å; L117-L121 HydrophobicContact CD1-CD1 3.77Å; L117-L121 HydrophobicContact CD1-CG 3.97Å; L117-L121 HydrophobicContact CG-CD1 3.83Å; L117-L121 HydrophobicContact CG-CG 4.35Å; L117-L121 WeakPolarHBondContact O-CB 3.46Å; L117-L121 VanDerWaalsContact O-CG 3.3Å; L117-L121 WeakPolarHBondContact O-CG 3.43Å; L117-L121 PolarHBondContact O-N 3.44Å; V118-L121 PolarHBondContact O-N 3.11Å; L121-V123 VanDerWaalsContact C-N 3.31Å; L121-V123 PolarHBondContact O-N 3.36Å; L121-V124 PolarHBondContact O-N 2.91Å; L121-G125 PolarHBondContact O-N 2.82Å |
| 122 | Q | 91.3 | Very high | 93.1 | Very high | 28 Ų | 28 | 29.3 Ų | 29.3 | 13% | 0.131 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -50.6 | -51.1 | 169 | 171.9 | 166.5 | 19.8 | 0 | 0 | 110.9 | F94 Q95 V118 Y120 G125 M126 | F94-Q122 WeakPolarHBondContact O-CB 3.43Å; Q95-Q122 HydrophobicContact CB-CB 4.39Å; Q95-Q122 HydrophobicContact CB-CG 3.87Å; Q95-Q122 HydrophobicContact CG-CG 4Å; V118-Q122 WeakPolarHBondContact O-CB 3.33Å; V118-Q122 PolarHBondContact O-N 3.47Å; Y120-Q122 VanDerWaalsContact C-N 3.34Å; Y120-Q122 PolarHBondContact O-N 2.92Å; Q122-G125 PolarHBondContact O-N 3.17Å; Q122-M126 HydrophobicContact CG-CE 3.71Å; Q122-M126 WeakPolarHBondContact O-CG 3.39Å; Q122-M126 PolarHBondContact O-N 2.87Å |
| 123 | V | 91.9 | Very high | 93.2 | Very high | 6 Ų | 6 | 27 Ų | 27 | 4% | 0.036 | 13% | 0.132 | C | C | . | . | H | α-helix | trans | -78.9 | -32.7 | -177.5 | 175.1 | 0 | 0 | 0 | 0 | 112.6 | K119 Y120 L121 G125 M126 F127 Q174 I207 | K119-V123 PolarHBondContact O-N 3.02Å; Y120-V123 PolarHBondContact O-N 3.44Å; Y120-V123 VanDerWaalsContact O-N 3.15Å; L121-V123 VanDerWaalsContact C-N 3.31Å; L121-V123 PolarHBondContact O-N 3.36Å; V123-G125 VanDerWaalsContact C-N 3.27Å; V123-G125 PolarHBondContact O-N 3.19Å; V123-M126 PolarHBondContact O-N 2.8Å; V123-F127 HydrophobicContact CG1-CD2 3.59Å; V123-F127 HydrophobicContact CG1-CE2 3.48Å; V123-F127 VanDerWaalsContact CG1-CE2 3.48Å; V123-F127 WeakPolarHBondContact O-CD2 3.49Å; V123-F127 PolarHBondContact O-N 3.21Å; V123-Q174 HydrophobicContact CB-CG 3.84Å; V123-Q174 HydrophobicContact CG1-CG 4.26Å; V123-Q174 HydrophobicContact CG2-CG 3.89Å; V123-I207 HydrophobicContact CG1-CD1 4.32Å |
| 124 | V | 95.3 | Very high | 93.2 | Very high | 4 Ų | 4 | 21.4 Ų | 21.4 | 2% | 0.024 | 10% | 0.103 | C | C | . | . | H | α-helix | trans | -57 | -42.9 | 169.9 | 172.3 | 0 | 0 | 0 | 0 | 110.7 | Y120 L121 F127 A128 L168 S171 | Y120-V124 HydrophobicContact CD1-CG2 4.03Å; Y120-V124 HydrophobicContact CD2-CG2 4.34Å; Y120-V124 HydrophobicContact CE1-CG2 3.64Å; Y120-V124 HydrophobicContact CE2-CG2 3.98Å; Y120-V124 HydrophobicContact CG-CG2 4.36Å; Y120-V124 WeakPolarHBondContact O-CG2 3.43Å; Y120-V124 PolarHBondContact O-N 3.1Å; L121-V124 PolarHBondContact O-N 2.91Å; V124-F127 PolarHBondContact O-N 2.89Å; V124-A128 WeakPolarHBondContact O-CB 3.41Å; V124-A128 PolarHBondContact O-N 2.92Å; V124-L168 HydrophobicContact CG1-CD2 3.89Å; V124-L168 HydrophobicContact CG2-CD2 4.09Å; V124-S171 VanDerWaalsContact CA-OG 3.27Å; V124-S171 WeakPolarHBondContact CA-OG 3.4Å; V124-S171 VanDerWaalsContact CG2-CB 3.43Å; V124-S171 WeakPolarHBondContact CG2-OG 3.49Å; V124-S171 PolarHBondContact N-OG 3.05Å |
| 125 | G | 92.3 | Very high | 93.3 | Very high | 0 Ų | 0 | 18.8 Ų | 18.8 | 0% | 0 | 9% | 0.09 | C | C | . | . | H | α-helix | trans | -58.5 | -49.7 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.8 | V91 L121 Q122 V123 F127 A128 S129 | V91-G125 WeakPolarHBondContact CG2-O 3.47Å; L121-G125 PolarHBondContact O-N 2.82Å; Q122-G125 PolarHBondContact O-N 3.17Å; V123-G125 VanDerWaalsContact C-N 3.27Å; V123-G125 PolarHBondContact O-N 3.19Å; G125-F127 PolarHBondContact O-N 3.38Å; G125-A128 PolarHBondContact O-N 3.27Å; G125-S129 PolarHBondContact O-N 3.47Å |
| 126 | M | 92 | Very high | 93.3 | Very high | 12 Ų | 12 | 18.8 Ų | 18.8 | 6% | 0.059 | 9% | 0.09 | C | C | . | . | H | α-helix | trans | -58.4 | -49.8 | 178 | -58.2 | 176.5 | -168.8 | 0 | 0 | 111.8 | Q95 Q122 V123 A128 T130 I211 W287 | Q95-M126 VanDerWaalsContact CD-CE 3.48Å; Q95-M126 HydrophobicContact CG-CE 4.16Å; Q95-M126 VanDerWaalsContact OE1-CE 3.24Å; Q122-M126 HydrophobicContact CG-CE 3.71Å; Q122-M126 WeakPolarHBondContact O-CG 3.39Å; Q122-M126 PolarHBondContact O-N 2.87Å; V123-M126 PolarHBondContact O-N 2.8Å; M126-A128 PolarHBondContact O-N 3.09Å; M126-T130 VanDerWaalsContact O-CB 3.26Å; M126-T130 WeakPolarHBondContact O-CB 3.29Å; M126-T130 PolarHBondContact O-N 3.47Å; M126-T130 VanDerWaalsContact O-N 3.08Å; M126-T130 PolarHBondContact O-OG1 3.06Å; M126-I211 HydrophobicContact CB-CD1 3.82Å; M126-I211 HydrophobicContact SD-CD1 4.32Å; M126-W287 HydrophobicContact CB-CH2 4.18Å; M126-W287 HydrophobicContact CG-CH2 3.85Å; M126-W287 HydrophobicContact SD-CH2 4.01Å; M126-W287 HydrophobicContact SD-CZ3 4.47Å |
| 127 | F | 95 | Very high | 93.1 | Very high | 0 Ų | 0 | 15.8 Ų | 15.8 | 0% | 0 | 8% | 0.078 | C | C | . | . | H | α-helix | trans | -63.3 | -40.3 | 178 | -83.2 | -64.8 | 0 | 0 | 0 | 112.1 | V123 V124 G125 Y131 S167 F170 S171 I207 T210 I211 | V123-F127 HydrophobicContact CG1-CD2 3.59Å; V123-F127 HydrophobicContact CG1-CE2 3.48Å; V123-F127 VanDerWaalsContact CG1-CE2 3.48Å; V123-F127 WeakPolarHBondContact O-CD2 3.49Å; V123-F127 PolarHBondContact O-N 3.21Å; V124-F127 PolarHBondContact O-N 2.89Å; G125-F127 PolarHBondContact O-N 3.38Å; F127-Y131 HydrophobicContact CB-CE2 4.41Å; F127-Y131 HydrophobicContact CD1-CE1 4.26Å; F127-Y131 AromaticContact CD1-CE2 3.78Å; F127-Y131 HydrophobicContact CD1-CE2 3.78Å; F127-Y131 AromaticContact CD1-CZ 3.57Å; F127-Y131 WeakPolarHBondContact CD1-OH 3.44Å; F127-Y131 WeakPolarHBondContact CE1-OH 3.42Å; F127-Y131 HydrophobicContact CG-CE2 4.47Å; F127-Y131 WeakPolarHBondContact O-CB 3.42Å; F127-Y131 VanDerWaalsContact O-CG 3.28Å; F127-Y131 PolarHBondContact O-N 3.39Å; F127-S167 VanDerWaalsContact C-OG 3.25Å; F127-S167 PolarHBondContact O-OG 2.89Å; F127-F170 HydrophobicContact CD2-CB 4.41Å; F127-F170 HydrophobicContact CE1-CB 4.11Å; F127-F170 HydrophobicContact CE1-CD2 4.22Å; F127-F170 HydrophobicContact CE2-CB 3.99Å; F127-F170 HydrophobicContact CZ-CB 3.84Å; F127-S171 WeakPolarHBondContact CD2-OG 3.23Å; F127-I207 HydrophobicContact CE2-CD1 4.08Å; F127-I207 HydrophobicContact CZ-CD1 4.06Å; F127-T210 WeakPolarHBondContact CE1-OG1 3.22Å; F127-T210 WeakPolarHBondContact CZ-OG1 3.32Å; F127-I211 HydrophobicContact CD1-CD1 4.15Å; F127-I211 HydrophobicContact CD1-CG1 3.67Å; F127-I211 HydrophobicContact CD2-CD1 4.22Å; F127-I211 HydrophobicContact CE1-CD1 4.03Å; F127-I211 HydrophobicContact CE1-CG1 3.38Å; F127-I211 HydrophobicContact CE2-CD1 4.12Å; F127-I211 HydrophobicContact CE2-CG1 4.35Å; F127-I211 HydrophobicContact CG-CD1 4.24Å; F127-I211 HydrophobicContact CG-CG1 4.26Å; F127-I211 HydrophobicContact CZ-CD1 4.02Å; F127-I211 HydrophobicContact CZ-CG1 3.76Å |
| 128 | A | 95.3 | Very high | 93 | Very high | 0 Ų | 0 | 14.2 Ų | 14.2 | 0% | 0 | 7% | 0.072 | C | C | . | . | H | α-helix | trans | -65.5 | -48.2 | -179 | 0 | 0 | 0 | 0 | 0 | 111.4 | A87 V124 G125 M126 T130 Y131 M132 W164 S167 | A87-A128 HydrophobicContact CB-CB 3.82Å; V124-A128 WeakPolarHBondContact O-CB 3.41Å; V124-A128 PolarHBondContact O-N 2.92Å; G125-A128 PolarHBondContact O-N 3.27Å; M126-A128 PolarHBondContact O-N 3.09Å; A128-T130 PolarHBondContact O-N 2.93Å; A128-Y131 PolarHBondContact O-N 2.88Å; A128-M132 WeakPolarHBondContact O-CB 3.45Å; A128-M132 VanDerWaalsContact O-CG 3.24Å; A128-M132 WeakPolarHBondContact O-CG 3.28Å; A128-M132 PolarHBondContact O-N 2.97Å; A128-W164 HydrophobicContact CB-CE3 4.18Å; A128-W164 HydrophobicContact CB-CH2 3.98Å; A128-W164 HydrophobicContact CB-CZ2 4.38Å; A128-W164 HydrophobicContact CB-CZ3 3.87Å; A128-S167 WeakPolarHBondContact CA-OG 3.47Å; A128-S167 PolarHBondContact N-OG 3.29Å |
| 129 | S | 93.8 | Very high | 92.9 | Very high | 2 Ų | 2 | 13.4 Ų | 13.4 | 1% | 0.014 | 7% | 0.067 | C | C | . | . | H | α-helix | trans | -61.8 | -46.7 | 178.7 | -177.2 | 0 | 0 | 0 | 0 | 110.6 | L84 D88 G125 Y131 M132 L133 | L84-S129 WeakPolarHBondContact CD1-OG 3.42Å; D88-S129 WeakPolarHBondContact OD1-CB 3.46Å; D88-S129 PolarHBondContact OD1-OG 2.98Å; G125-S129 PolarHBondContact O-N 3.47Å; S129-Y131 PolarHBondContact O-N 2.89Å; S129-M132 PolarHBondContact O-N 3.34Å; S129-L133 WeakPolarHBondContact O-CB 3.3Å; S129-L133 PolarHBondContact O-N 2.98Å |
| 130 | T | 94.6 | Very high | 92.7 | Very high | 1 Ų | 1 | 12.9 Ų | 12.9 | 1% | 0.006 | 6% | 0.064 | C | C | . | . | H | α-helix | trans | -59 | -48.6 | 177.1 | -59.9 | 0 | 0 | 0 | 0 | 112.9 | M126 A128 L133 V134 I211 P215 Y283 | M126-T130 VanDerWaalsContact O-CB 3.26Å; M126-T130 WeakPolarHBondContact O-CB 3.29Å; M126-T130 PolarHBondContact O-N 3.47Å; M126-T130 VanDerWaalsContact O-N 3.08Å; M126-T130 PolarHBondContact O-OG1 3.06Å; A128-T130 PolarHBondContact O-N 2.93Å; T130-L133 WeakPolarHBondContact O-CB 3.41Å; T130-L133 PolarHBondContact O-N 2.9Å; T130-V134 WeakPolarHBondContact O-CG2 3.42Å; T130-V134 PolarHBondContact O-N 3.39Å; T130-I211 HydrophobicContact CG2-CG2 4.36Å; T130-I211 WeakPolarHBondContact CG2-O 3.48Å; T130-P215 HydrophobicContact CG2-CB 3.78Å; T130-P215 HydrophobicContact CG2-CG 3.53Å; T130-Y283 HydrophobicContact CG2-CE2 4.34Å; T130-Y283 VanDerWaalsContact CG2-OH 3.23Å; T130-Y283 WeakPolarHBondContact CG2-OH 3.42Å; T130-Y283 PolarHBondContact OG1-OH 3.11Å; T130-Y283 VanDerWaalsContact OG1-OH 3.12Å |
| 131 | Y | 95.5 | Very high | 92.4 | Very high | 25 Ų | 25 | 11.7 Ų | 11.7 | 10% | 0.098 | 6% | 0.061 | C | C | . | . | H | α-helix | trans | -73.9 | -29.3 | -178.6 | -65.3 | -15.1 | 0 | 0 | 0 | 112.8 | F127 A128 S129 L133 L135 L166 S167 F170 T210 P215 | F127-Y131 HydrophobicContact CB-CE2 4.41Å; F127-Y131 HydrophobicContact CD1-CE1 4.26Å; F127-Y131 AromaticContact CD1-CE2 3.78Å; F127-Y131 HydrophobicContact CD1-CE2 3.78Å; F127-Y131 AromaticContact CD1-CZ 3.57Å; F127-Y131 WeakPolarHBondContact CD1-OH 3.44Å; F127-Y131 WeakPolarHBondContact CE1-OH 3.42Å; F127-Y131 HydrophobicContact CG-CE2 4.47Å; F127-Y131 WeakPolarHBondContact O-CB 3.42Å; F127-Y131 VanDerWaalsContact O-CG 3.28Å; F127-Y131 PolarHBondContact O-N 3.39Å; A128-Y131 PolarHBondContact O-N 2.88Å; S129-Y131 PolarHBondContact O-N 2.89Å; Y131-L133 VanDerWaalsContact C-N 3.35Å; Y131-L135 WeakPolarHBondContact O-CB 3.49Å; Y131-L135 PolarHBondContact O-N 2.94Å; Y131-L166 HydrophobicContact CD2-CB 4.37Å; Y131-L166 HydrophobicContact CD2-CD2 4.11Å; Y131-L166 HydrophobicContact CD2-CG 4.36Å; Y131-L166 HydrophobicContact CE2-CB 4.29Å; Y131-L166 HydrophobicContact CE2-CD2 3.73Å; Y131-L166 HydrophobicContact CE2-CG 3.85Å; Y131-S167 WeakPolarHBondContact CD2-OG 3.46Å; Y131-F170 HydrophobicContact CE2-CD2 4.39Å; Y131-F170 VanDerWaalsContact OH-CD2 3.32Å; Y131-F170 WeakPolarHBondContact OH-CD2 3.36Å; Y131-T210 WeakPolarHBondContact CE1-O 3.4Å; Y131-T210 PolarHBondContact OH-O 3.1Å; Y131-P215 HydrophobicContact CE1-CG 4.37Å |
| 132 | M | 94.1 | Very high | 92.1 | Very high | 2 Ų | 2 | 13 Ų | 13 | 1% | 0.01 | 7% | 0.068 | C | C | . | . | H | α-helix | trans | -63.4 | -40.2 | 167.7 | -73.4 | -56.3 | 100.9 | 0 | 0 | 111.8 | H83 L84 A128 S129 L135 M136 V160 | H83-M132 HydrophobicContact CB-CG 4.37Å; H83-M132 HydrophobicContact CB-SD 3.64Å; L84-M132 HydrophobicContact CB-CB 4.26Å; L84-M132 HydrophobicContact CD1-CB 4.1Å; A128-M132 WeakPolarHBondContact O-CB 3.45Å; A128-M132 VanDerWaalsContact O-CG 3.24Å; A128-M132 WeakPolarHBondContact O-CG 3.28Å; A128-M132 PolarHBondContact O-N 2.97Å; S129-M132 PolarHBondContact O-N 3.34Å; M132-L135 HydrophobicContact CE-CD2 4.23Å; M132-L135 PolarHBondContact O-N 2.97Å; M132-M136 VanDerWaalsContact O-CB 3.22Å; M132-M136 WeakPolarHBondContact O-CB 3.41Å; M132-M136 PolarHBondContact O-N 3.48Å; M132-V160 HydrophobicContact CE-CG1 4.28Å; M132-V160 HydrophobicContact SD-CG1 4.25Å; M132-V160 HydrophobicContact SD-CG2 4.34Å |
| 133 | L | 92.4 | Very high | 91.7 | Very high | 1 Ų | 1 | 12.9 Ų | 12.9 | 1% | 0.005 | 7% | 0.071 | C | C | . | . | H | α-helix | trans | -68.3 | -42 | 178.4 | -172.5 | 166.9 | 0 | 0 | 0 | 112.3 | S129 T130 Y131 S137 L219 I279 V280 Y283 | S129-L133 WeakPolarHBondContact O-CB 3.3Å; S129-L133 PolarHBondContact O-N 2.98Å; T130-L133 WeakPolarHBondContact O-CB 3.41Å; T130-L133 PolarHBondContact O-N 2.9Å; Y131-L133 VanDerWaalsContact C-N 3.35Å; L133-S137 WeakPolarHBondContact O-CB 3.34Å; L133-S137 PolarHBondContact O-N 3.15Å; L133-S137 PolarHBondContact O-OG 3.28Å; L133-L219 HydrophobicContact CD2-CD1 3.57Å; L133-L219 HydrophobicContact CD2-CD2 3.59Å; L133-L219 HydrophobicContact CD2-CG 4.21Å; L133-I279 HydrophobicContact CD1-CG2 3.66Å; L133-I279 HydrophobicContact CG-CG2 3.93Å; L133-V280 HydrophobicContact CD2-CG2 3.88Å; L133-Y283 HydrophobicContact CD1-CD2 3.53Å; L133-Y283 HydrophobicContact CD1-CE2 4.36Å; L133-Y283 HydrophobicContact CD1-CG 3.8Å |
| 134 | V | 95.1 | Very high | 91.2 | Very high | 18 Ų | 18 | 13.4 Ų | 13.4 | 11% | 0.109 | 7% | 0.074 | C | C | . | . | H | α-helix | trans | -61.1 | -50.5 | 171.2 | 171.9 | 0 | 0 | 0 | 0 | 110.8 | T130 M136 S137 V138 P215 I218 L219 | T130-V134 WeakPolarHBondContact O-CG2 3.42Å; T130-V134 PolarHBondContact O-N 3.39Å; V134-M136 VanDerWaalsContact C-N 3.34Å; V134-M136 PolarHBondContact O-N 3.5Å; V134-S137 PolarHBondContact O-N 3.04Å; V134-S137 VanDerWaalsContact O-N 3.09Å; V134-V138 HydrophobicContact CG1-CG2 4.25Å; V134-V138 WeakPolarHBondContact O-CG2 3.2Å; V134-V138 PolarHBondContact O-N 3.25Å; V134-P215 HydrophobicContact CG2-CB 3.67Å; V134-P215 HydrophobicContact CG2-CG 4.23Å; V134-I218 HydrophobicContact CG1-CB 4.38Å; V134-I218 HydrophobicContact CG1-CD1 4.28Å; V134-I218 HydrophobicContact CG1-CG2 3.77Å; V134-L219 HydrophobicContact CG2-CD2 4.35Å; V134-L219 HydrophobicContact CG2-CG 4.43Å |
| 135 | L | 93.3 | Very high | 90.6 | Very high | 19 Ų | 19 | 15 Ų | 15 | 10% | 0.099 | 8% | 0.084 | C | C | . | . | H | α-helix | trans | -60.1 | -42.8 | 179.8 | 177.1 | 56 | 0 | 0 | 0 | 112 | F80 Y131 M132 S137 D139 Y159 V160 | F80-L135 HydrophobicContact CD1-CD2 4.46Å; F80-L135 HydrophobicContact CD1-CG 4.41Å; F80-L135 HydrophobicContact CE1-CD2 3.85Å; F80-L135 HydrophobicContact CE1-CG 3.78Å; F80-L135 HydrophobicContact CZ-CG 4.49Å; Y131-L135 WeakPolarHBondContact O-CB 3.49Å; Y131-L135 PolarHBondContact O-N 2.94Å; M132-L135 HydrophobicContact CE-CD2 4.23Å; M132-L135 PolarHBondContact O-N 2.97Å; L135-S137 VanDerWaalsContact C-N 3.32Å; L135-S137 PolarHBondContact O-N 3.44Å; L135-D139 VanDerWaalsContact O-CB 3.3Å; L135-D139 WeakPolarHBondContact O-CB 3.4Å; L135-D139 PolarHBondContact O-N 3.2Å; L135-Y159 HydrophobicContact CD1-CG 4.23Å; L135-V160 HydrophobicContact CD2-CB 4.41Å; L135-V160 HydrophobicContact CD2-CG2 3.67Å |
| 136 | M | 90.4 | Very high | 89.8 | Confident | 1 Ų | 1 | 19.1 Ų | 19.1 | 1% | 0.005 | 10% | 0.104 | C | C | . | . | H | α-helix | trans | -58.7 | -42.4 | 173.8 | 177.6 | 174.7 | 66.4 | 0 | 0 | 111.8 | M77 L84 M132 V134 D139 R140 T276 I279 | M77-M136 HydrophobicContact CE-CG 3.86Å; M77-M136 HydrophobicContact CE-SD 3.62Å; L84-M136 HydrophobicContact CD2-CE 3.93Å; L84-M136 HydrophobicContact CD2-SD 4.4Å; M132-M136 VanDerWaalsContact O-CB 3.22Å; M132-M136 WeakPolarHBondContact O-CB 3.41Å; M132-M136 PolarHBondContact O-N 3.48Å; V134-M136 VanDerWaalsContact C-N 3.34Å; V134-M136 PolarHBondContact O-N 3.5Å; M136-D139 WeakPolarHBondContact O-CB 3.46Å; M136-D139 PolarHBondContact O-N 3.08Å; M136-R140 WeakPolarHBondContact O-CG 3.22Å; M136-R140 PolarHBondContact O-N 3.04Å; M136-T276 HydrophobicContact CE-CG2 3.94Å; M136-T276 HydrophobicContact CG-CG2 3.91Å; M136-T276 HydrophobicContact SD-CG2 3.75Å; M136-I279 HydrophobicContact CE-CB 4.49Å; M136-I279 HydrophobicContact CE-CD1 3.85Å; M136-I279 HydrophobicContact CE-CG2 4.09Å |
| 137 | S | 91.1 | Very high | 88.6 | Confident | 0 Ų | 0 | 21 Ų | 21 | 0% | 0 | 12% | 0.117 | C | C | . | . | H | α-helix | trans | -73.8 | -41 | -178.5 | -63.3 | 0 | 0 | 0 | 0 | 113 | L133 V134 L135 D139 R140 C141 L219 Y223 | L133-S137 WeakPolarHBondContact O-CB 3.34Å; L133-S137 PolarHBondContact O-N 3.15Å; L133-S137 PolarHBondContact O-OG 3.28Å; V134-S137 PolarHBondContact O-N 3.04Å; V134-S137 VanDerWaalsContact O-N 3.09Å; L135-S137 VanDerWaalsContact C-N 3.32Å; L135-S137 PolarHBondContact O-N 3.44Å; S137-D139 VanDerWaalsContact C-N 3.27Å; S137-D139 PolarHBondContact O-N 3.3Å; S137-R140 PolarHBondContact O-N 3.05Å; S137-C141 WeakPolarHBondContact O-CB 3.5Å; S137-C141 PolarHBondContact O-N 3.42Å; S137-L219 VanDerWaalsContact OG-CD2 3.29Å; S137-L219 WeakPolarHBondContact OG-CD2 3.27Å; S137-Y223 WeakPolarHBondContact OG-CE2 3.37Å; S137-Y223 PolarHBondContact OG-OH 3.47Å |
| 138 | V | 91.5 | Very high | 86.9 | Confident | 47 Ų | 47 | 28.4 Ų | 28.4 | 29% | 0.285 | 16% | 0.156 | S | C | . | . | H | α-helix | trans | -58.6 | -42.6 | 169.9 | 170.6 | 0 | 0 | 0 | 0 | 110 | V134 C141 L142 I218 | V134-V138 HydrophobicContact CG1-CG2 4.25Å; V134-V138 WeakPolarHBondContact O-CG2 3.2Å; V134-V138 PolarHBondContact O-N 3.25Å; V138-C141 WeakPolarHBondContact O-CB 3.47Å; V138-C141 PolarHBondContact O-N 3.37Å; V138-L142 HydrophobicContact CG1-CD1 4.04Å; V138-L142 HydrophobicContact CG1-CG 4.41Å; V138-L142 WeakPolarHBondContact O-CG 3.46Å; V138-L142 PolarHBondContact O-N 3.48Å; V138-I218 HydrophobicContact CG2-CG2 3.96Å |
| 139 | D | 88 | Confident | 85.3 | Confident | 5 Ų | 5 | 35.4 Ų | 35.4 | 3% | 0.027 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -62 | -46.7 | 176.4 | 179 | 50.8 | 0 | 0 | 0 | 112.9 | R76 F80 L135 M136 S137 C141 L142 A143 | R76-D139 IonicContact CZ-OD1 3.67Å; R76-D139 IonicContact CZ-OD2 3.81Å; R76-D139 IonicContact NE-OD1 3.29Å; R76-D139 IonicContact NH1-OD1 2.67Å; R76-D139 PolarHBondContact NH1-OD1 2.96Å; R76-D139 IonicContact NH1-OD2 2.74Å; R76-D139 IonicContact NH2-OD1 3.64Å; R76-D139 PolarHBondContact NH2-OD1 2.95Å; F80-D139 HydrophobicContact CE2-CB 4Å; F80-D139 WeakPolarHBondContact CE2-OD2 3.3Å; F80-D139 HydrophobicContact CZ-CB 4.22Å; L135-D139 VanDerWaalsContact O-CB 3.3Å; L135-D139 WeakPolarHBondContact O-CB 3.4Å; L135-D139 PolarHBondContact O-N 3.2Å; M136-D139 WeakPolarHBondContact O-CB 3.46Å; M136-D139 PolarHBondContact O-N 3.08Å; S137-D139 VanDerWaalsContact C-N 3.27Å; S137-D139 PolarHBondContact O-N 3.3Å; D139-C141 VanDerWaalsContact C-N 3.29Å; D139-C141 PolarHBondContact O-N 3.34Å; D139-L142 PolarHBondContact O-N 3.03Å; D139-A143 WeakPolarHBondContact O-CB 3.38Å; D139-A143 PolarHBondContact O-N 2.84Å |
| 140 | R | 87.4 | Confident | 83.4 | Confident | 28 Ų | 28 | 39.2 Ų | 39.2 | 11% | 0.106 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -58 | -44.1 | 174.4 | -68.4 | -49.5 | 93.6 | 151.4 | 10.6 | 111.2 | M77 M136 S137 A143 I144 I226 T272 T276 | M77-R140 PolarHBondContact SD-NH1 3.44Å; M136-R140 WeakPolarHBondContact O-CG 3.22Å; M136-R140 PolarHBondContact O-N 3.04Å; S137-R140 PolarHBondContact O-N 3.05Å; R140-A143 PolarHBondContact O-N 2.77Å; R140-I144 VanDerWaalsContact O-CD1 3.24Å; R140-I144 WeakPolarHBondContact O-CD1 3.46Å; R140-I144 VanDerWaalsContact O-CG1 3.29Å; R140-I144 WeakPolarHBondContact O-CG1 3.47Å; R140-I144 PolarHBondContact O-N 3Å; R140-I226 HydrophobicContact CB-CD1 4.31Å; R140-T272 VanDerWaalsContact NH1-CG2 3.31Å; R140-T276 HydrophobicContact CG-CG2 3.87Å |
| 141 | C | 87.9 | Confident | 81.5 | Confident | 11 Ų | 11 | 46.9 Ų | 46.9 | 7% | 0.074 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -57.7 | -52.4 | 176.5 | -175 | 0 | 0 | 0 | 0 | 111.1 | S137 V138 D139 A143 I144 C145 C222 I226 | S137-C141 WeakPolarHBondContact O-CB 3.5Å; S137-C141 PolarHBondContact O-N 3.42Å; V138-C141 WeakPolarHBondContact O-CB 3.47Å; V138-C141 PolarHBondContact O-N 3.37Å; D139-C141 VanDerWaalsContact C-N 3.29Å; D139-C141 PolarHBondContact O-N 3.34Å; C141-A143 PolarHBondContact O-N 2.78Å; C141-I144 PolarHBondContact O-N 3.33Å; C141-C145 VanDerWaalsContact O-CB 3.27Å; C141-C145 WeakPolarHBondContact O-CB 3.44Å; C141-C145 PolarHBondContact O-N 2.99Å; C141-C145 PolarHBondContact O-SG 2.98Å; C141-C145 VanDerWaalsContact SG-SG 3.68Å; C141-C222 HydrophobicContact CB-CB 4.03Å; C141-I226 HydrophobicContact CB-CD1 4.05Å; C141-I226 HydrophobicContact CB-CG1 4.09Å |
| 142 | L | 86.6 | Confident | 79.8 | Confident | 63 Ų | 63 | 50.8 Ų | 50.8 | 33% | 0.33 | 27% | 0.268 | S | S | . | . | H | α-helix | trans | -60.6 | -41.1 | 178 | -68.6 | 174.1 | 0 | 0 | 0 | 112.9 | V138 D139 I144 Q146 | V138-L142 HydrophobicContact CG1-CD1 4.04Å; V138-L142 HydrophobicContact CG1-CG 4.41Å; V138-L142 WeakPolarHBondContact O-CG 3.46Å; V138-L142 PolarHBondContact O-N 3.48Å; D139-L142 PolarHBondContact O-N 3.03Å; L142-I144 PolarHBondContact O-N 3.36Å; L142-I144 VanDerWaalsContact O-N 3.17Å; L142-Q146 CarbonylContact O-C 3.34Å; L142-Q146 WeakPolarHBondContact O-CA 3.37Å; L142-Q146 PolarHBondContact O-N 2.92Å |
| 143 | A | 82.8 | Confident | 78.2 | Confident | 25 Ų | 25 | 58 Ų | 58 | 21% | 0.207 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -67.4 | -12.8 | -179.9 | 0 | 0 | 0 | 0 | 0 | 114.8 | D139 R140 C141 K269 | D139-A143 WeakPolarHBondContact O-CB 3.38Å; D139-A143 PolarHBondContact O-N 2.84Å; R140-A143 PolarHBondContact O-N 2.77Å; C141-A143 PolarHBondContact O-N 2.78Å; A143-K269 PolarHBondContact O-NZ 3.38Å |
| 144 | I | 81.3 | Confident | 76.8 | Confident | 18 Ų | 18 | 69.1 Ų | 69.1 | 9% | 0.092 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -109.8 | -48.4 | -179.4 | -65.3 | 162.4 | 0 | 0 | 0 | 110.7 | R140 C141 L142 I226 K229 I265 V273 | R140-I144 VanDerWaalsContact O-CD1 3.24Å; R140-I144 WeakPolarHBondContact O-CD1 3.46Å; R140-I144 VanDerWaalsContact O-CG1 3.29Å; R140-I144 WeakPolarHBondContact O-CG1 3.47Å; R140-I144 PolarHBondContact O-N 3Å; C141-I144 PolarHBondContact O-N 3.33Å; L142-I144 PolarHBondContact O-N 3.36Å; L142-I144 VanDerWaalsContact O-N 3.17Å; I144-I226 HydrophobicContact CD1-CD1 4.38Å; I144-I226 HydrophobicContact CD1-CG1 4.14Å; I144-I226 HydrophobicContact CD1-CG2 3.99Å; I144-K229 HydrophobicContact CG2-CB 4.38Å; I144-I265 HydrophobicContact CG2-CD1 4.26Å; I144-V273 HydrophobicContact CD1-CG2 3.17Å; I144-V273 HydrophobicContact CG1-CG2 4.46Å |
| 145 | C | 81.8 | Confident | 76 | Confident | 36 Ų | 36 | 72.6 Ų | 72.6 | 24% | 0.243 | 35% | 0.351 | C | S | . | . | H | α-helix | trans | -72.9 | -29.9 | -179.6 | -60.1 | 0 | 0 | 0 | 0 | 112.6 | C141 K229 | C141-C145 VanDerWaalsContact O-CB 3.27Å; C141-C145 WeakPolarHBondContact O-CB 3.44Å; C141-C145 PolarHBondContact O-N 2.99Å; C141-C145 PolarHBondContact O-SG 2.98Å; C141-C145 VanDerWaalsContact SG-SG 3.68Å; C145-K229 HydrophobicContact CB-CG 4.42Å |
| 146 | Q | 76.4 | Confident | 75.4 | Confident | 88 Ų | 88 | 72 Ų | 72 | 41% | 0.411 | 35% | 0.348 | S | S | . | . | trans | -127.2 | 67 | -178.9 | -64.2 | -173.4 | -14.6 | 0 | 0 | 112 | L142 L148 R149 | L142-Q146 CarbonylContact O-C 3.34Å; L142-Q146 WeakPolarHBondContact O-CA 3.37Å; L142-Q146 PolarHBondContact O-N 2.92Å; Q146-L148 PolarHBondContact O-N 2.86Å; Q146-R149 HydrophobicContact CB-CB 4.27Å; Q146-R149 PolarHBondContact O-N 3.13Å; Q146-R149 VanDerWaalsContact OE1-CD 3.25Å | ||
| 147 | P | 65.6 | Low | 75.3 | Confident | 52 Ų | 52 | 80.2 Ų | 80.2 | 34% | 0.338 | 38% | 0.378 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -65.3 | -7.8 | -173.2 | 28.1 | -36.6 | 0 | 0 | 0 | 115.3 | R263 | P147-R263 PolarHBondContact O-NH1 3.15Š|
| 148 | L | 60.4 | Low | 75.2 | Confident | 155 Ų | 155 | 86.4 Ų | 86.4 | 81% | 0.812 | 41% | 0.406 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -88.9 | -13.9 | 175.4 | -64.1 | 174.2 | 0 | 0 | 0 | 113.4 | Q146 S150 | Q146-L148 PolarHBondContact O-N 2.86Å; L148-S150 VanDerWaalsContact C-N 3.35Å; L148-S150 PolarHBondContact O-N 2.83Å |
| 149 | R | 61.6 | Low | 75.2 | Confident | 146 Ų | 146 | 88.9 Ų | 88.9 | 55% | 0.551 | 41% | 0.41 | S | S | * | . | trans | -89.8 | 6.9 | -175 | -154.7 | 174.1 | -178.4 | -166.9 | -0.5 | 114.4 | Q146 L151 | Q146-R149 HydrophobicContact CB-CB 4.27Å; Q146-R149 PolarHBondContact O-N 3.13Å; Q146-R149 VanDerWaalsContact OE1-CD 3.25Å; R149-L151 PolarHBondContact O-N 2.99Å | ||
| 150 | S | 54.5 | Low | 75.4 | Confident | 82 Ų | 82 | 88.7 Ų | 88.7 | 57% | 0.573 | 41% | 0.41 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -67.9 | 11.3 | -162.7 | -167.3 | 0 | 0 | 0 | 0 | 117.7 | L148 | L148-S150 VanDerWaalsContact C-N 3.35Å; L148-S150 PolarHBondContact O-N 2.83Å |
| 151 | L | 54.8 | Low | 75.8 | Confident | 163 Ų | 163 | 91.2 Ų | 91.2 | 85% | 0.853 | 42% | 0.424 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -110.8 | 0.5 | -166.6 | -75.4 | 168 | 0 | 0 | 0 | 115.9 | R149 R153 | R149-L151 PolarHBondContact O-N 2.99Å; L151-R153 PolarHBondContact O-N 3.39Å |
| 152 | H | 59.7 | Low | 76.1 | Confident | 107 Ų | 107 | 95.9 Ų | 95.9 | 50% | 0.495 | 44% | 0.443 | S | S | . | . | trans | -100.3 | 55.8 | -167.3 | -111.5 | 90.2 | 0 | 0 | 0 | 116 | R154 K155 | H152-R154 PolarHBondContact O-N 3.3Å; H152-K155 HydrophobicContact CB-CD 4.29Å; H152-K155 PolarHBondContact O-N 2.95Å | ||
| 153 | R | 60 | Low | 76.5 | Confident | 154 Ų | 154 | 93.5 Ų | 93.5 | 58% | 0.581 | 43% | 0.432 | S | S | * | . | H | α-helix | trans | -49.2 | -31.1 | 175.9 | -85.2 | 174.1 | 79 | 124.9 | -8.7 | 114.4 | Q74 L151 K155 D156 | Q74-R153 PolarHBondContact O-NH1 3.26Å; L151-R153 PolarHBondContact O-N 3.39Å; R153-K155 VanDerWaalsContact C-N 3.29Å; R153-K155 PolarHBondContact O-N 3.33Å; R153-D156 PolarHBondContact O-N 3.49Å |
| 154 | R | 63.4 | Low | 77.2 | Confident | 233 Ų | 233 | 94.8 Ų | 94.8 | 88% | 0.879 | 43% | 0.432 | S | S | * | . | H | α-helix | trans | -64.7 | -27.4 | 178.4 | -75.2 | -172.8 | 178.2 | 178.2 | -0.1 | 113.7 | H152 | H152-R154 PolarHBondContact O-N 3.3Å |
| 155 | K | 77.8 | Confident | 78 | Confident | 92 Ų | 92 | 98.9 Ų | 98.9 | 40% | 0.4 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -78.9 | -26.6 | -179.4 | -72.9 | 176.7 | -178.9 | -178.5 | 0 | 112.6 | H152 R153 R157 F158 Y159 | H152-K155 HydrophobicContact CB-CD 4.29Å; H152-K155 PolarHBondContact O-N 2.95Å; R153-K155 VanDerWaalsContact C-N 3.29Å; R153-K155 PolarHBondContact O-N 3.33Å; K155-R157 PolarHBondContact O-N 3.4Å; K155-F158 WeakPolarHBondContact O-CB 3.36Å; K155-F158 PolarHBondContact O-N 2.86Å; K155-Y159 HydrophobicContact CB-CD2 4.32Å; K155-Y159 HydrophobicContact CB-CE2 3.83Å; K155-Y159 WeakPolarHBondContact O-CD2 3.41Å; K155-Y159 PolarHBondContact O-N 2.96Å |
| 156 | D | 81 | Confident | 78.6 | Confident | 7 Ų | 7 | 99 Ų | 99 | 4% | 0.037 | 45% | 0.452 | C | S | . | . | H | α-helix | trans | -60.9 | -45.1 | 178.7 | -56.8 | -32.2 | 0 | 0 | 0 | 112.3 | R76 Y79 F80 R153 F158 Y159 V160 | R76-D156 WeakPolarHBondContact CD-OD2 3.26Å; R76-D156 IonicContact CZ-OD1 3.29Å; R76-D156 VanDerWaalsContact CZ-OD1 3.29Å; R76-D156 IonicContact CZ-OD2 3.71Å; R76-D156 IonicContact NE-OD1 2.9Å; R76-D156 PolarHBondContact NE-OD1 2.91Å; R76-D156 VanDerWaalsContact NE-OD1 3.12Å; R76-D156 IonicContact NE-OD2 3.27Å; R76-D156 PolarHBondContact NE-OD2 3.04Å; R76-D156 IonicContact NH2-OD1 3.5Å; R76-D156 PolarHBondContact NH2-OD1 3.09Å; R76-D156 IonicContact NH2-OD2 2.71Å; Y79-D156 HydrophobicContact CD1-CB 4.5Å; Y79-D156 HydrophobicContact CE1-CB 4.26Å; F80-D156 HydrophobicContact CZ-CB 4.33Å; R153-D156 PolarHBondContact O-N 3.49Å; D156-F158 VanDerWaalsContact C-N 3.3Å; D156-F158 PolarHBondContact O-N 3.44Å; D156-Y159 PolarHBondContact O-N 2.92Å; D156-V160 WeakPolarHBondContact O-CG2 3.32Å; D156-V160 PolarHBondContact O-N 3.24Å |
| 157 | R | 87 | Confident | 79.6 | Confident | 172 Ų | 172 | 94.9 Ų | 94.9 | 65% | 0.649 | 43% | 0.432 | S | S | * | . | H | α-helix | trans | -62.5 | -39.1 | 177 | -174.1 | 177.8 | 179.3 | -173.6 | -0.3 | 111.5 | K155 I161 | K155-R157 PolarHBondContact O-N 3.4Å; R157-I161 HydrophobicContact CG-CD1 3.85Å; R157-I161 HydrophobicContact CG-CG1 4.49Å; R157-I161 WeakPolarHBondContact O-CB 3.46Å; R157-I161 VanDerWaalsContact O-CG1 3.24Å; R157-I161 WeakPolarHBondContact O-CG1 3.26Å; R157-I161 PolarHBondContact O-N 3.27Å |
| 158 | F | 89.8 | Confident | 81.1 | Confident | 131 Ų | 131 | 95.6 Ų | 95.6 | 58% | 0.575 | 43% | 0.433 | S | S | * | . | H | α-helix | trans | -63.5 | -48.4 | 175.1 | 176.6 | -92.8 | 0 | 0 | 0 | 111.3 | K155 D156 V160 I161 F162 | K155-F158 WeakPolarHBondContact O-CB 3.36Å; K155-F158 PolarHBondContact O-N 2.86Å; D156-F158 VanDerWaalsContact C-N 3.3Å; D156-F158 PolarHBondContact O-N 3.44Å; F158-V160 PolarHBondContact O-N 3.47Å; F158-I161 PolarHBondContact O-N 3.44Å; F158-F162 VanDerWaalsContact O-CB 3.3Å; F158-F162 WeakPolarHBondContact O-CB 3.28Å; F158-F162 PolarHBondContact O-N 2.86Å |
| 159 | Y | 91.2 | Very high | 82.7 | Confident | 98 Ų | 98 | 93.1 Ų | 93.1 | 38% | 0.384 | 42% | 0.42 | S | S | . | . | H | α-helix | trans | -62.7 | -40 | 178.4 | -64.9 | -53.9 | 0 | 0 | 0 | 112.6 | L135 K155 D156 F162 S163 | L135-Y159 HydrophobicContact CD1-CG 4.23Å; K155-Y159 HydrophobicContact CB-CD2 4.32Å; K155-Y159 HydrophobicContact CB-CE2 3.83Å; K155-Y159 WeakPolarHBondContact O-CD2 3.41Å; K155-Y159 PolarHBondContact O-N 2.96Å; D156-Y159 PolarHBondContact O-N 2.92Å; Y159-F162 PolarHBondContact O-N 3.42Å; Y159-S163 PolarHBondContact O-N 3.4Å; Y159-S163 PolarHBondContact O-OG 2.97Å |
| 160 | V | 93.3 | Very high | 84.3 | Confident | 2 Ų | 2 | 88.8 Ų | 88.8 | 1% | 0.012 | 41% | 0.405 | C | S | . | . | H | α-helix | trans | -62.3 | -50.9 | 174.7 | 169 | 0 | 0 | 0 | 0 | 110.8 | Y79 F80 H83 M132 L135 D156 F158 F162 S163 W164 | Y79-V160 HydrophobicContact CE1-CB 4.4Å; Y79-V160 HydrophobicContact CE1-CG2 3.7Å; F80-V160 HydrophobicContact CD1-CG2 4.18Å; F80-V160 HydrophobicContact CE1-CG2 3.89Å; H83-V160 HydrophobicContact CB-CG1 4.44Å; M132-V160 HydrophobicContact CE-CG1 4.28Å; M132-V160 HydrophobicContact SD-CG1 4.25Å; M132-V160 HydrophobicContact SD-CG2 4.34Å; L135-V160 HydrophobicContact CD2-CB 4.41Å; L135-V160 HydrophobicContact CD2-CG2 3.67Å; D156-V160 WeakPolarHBondContact O-CG2 3.32Å; D156-V160 PolarHBondContact O-N 3.24Å; F158-V160 PolarHBondContact O-N 3.47Å; V160-F162 VanDerWaalsContact C-N 3.3Å; V160-F162 PolarHBondContact O-N 3Å; V160-S163 PolarHBondContact O-N 2.93Å; V160-W164 VanDerWaalsContact O-CD1 3.25Å; V160-W164 PolarHBondContact O-N 3.48Å |
| 161 | I | 94.3 | Very high | 86.2 | Confident | 81 Ų | 81 | 84.9 Ų | 84.9 | 42% | 0.415 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -58.1 | -44.8 | 178 | -69.8 | 167.8 | 0 | 0 | 0 | 110.7 | R157 F158 S163 W164 L165 | R157-I161 HydrophobicContact CG-CD1 3.85Å; R157-I161 HydrophobicContact CG-CG1 4.49Å; R157-I161 WeakPolarHBondContact O-CB 3.46Å; R157-I161 VanDerWaalsContact O-CG1 3.24Å; R157-I161 WeakPolarHBondContact O-CG1 3.26Å; R157-I161 PolarHBondContact O-N 3.27Å; F158-I161 PolarHBondContact O-N 3.44Å; I161-S163 PolarHBondContact O-N 3.22Å; I161-W164 PolarHBondContact O-N 2.93Å; I161-L165 HydrophobicContact CG2-CD1 3.83Å; I161-L165 HydrophobicContact CG2-CG 4.25Å; I161-L165 WeakPolarHBondContact O-CG 3.37Å; I161-L165 PolarHBondContact O-N 2.99Å |
| 162 | F | 94.8 | Very high | 88.1 | Confident | 108 Ų | 108 | 79.8 Ų | 79.8 | 47% | 0.474 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -58.5 | -46.4 | 176.6 | 176.5 | -99.3 | 0 | 0 | 0 | 112 | F158 Y159 V160 W164 L165 L166 | F158-F162 VanDerWaalsContact O-CB 3.3Å; F158-F162 WeakPolarHBondContact O-CB 3.28Å; F158-F162 PolarHBondContact O-N 2.86Å; Y159-F162 PolarHBondContact O-N 3.42Å; V160-F162 VanDerWaalsContact C-N 3.3Å; V160-F162 PolarHBondContact O-N 3Å; F162-W164 PolarHBondContact O-N 3.35Å; F162-L165 PolarHBondContact O-N 3.23Å; F162-L166 HydrophobicContact CE1-CD2 4.24Å; F162-L166 WeakPolarHBondContact O-CB 3.4Å; F162-L166 PolarHBondContact O-N 2.92Å |
| 163 | S | 95.4 | Very high | 89.6 | Confident | 14 Ų | 14 | 76.8 Ų | 76.8 | 10% | 0.098 | 34% | 0.344 | C | S | . | . | H | α-helix | trans | -60.8 | -44 | 175.5 | -69.5 | 0 | 0 | 0 | 0 | 112.5 | Y159 V160 I161 L166 S167 | Y159-S163 PolarHBondContact O-N 3.4Å; Y159-S163 PolarHBondContact O-OG 2.97Å; V160-S163 PolarHBondContact O-N 2.93Å; I161-S163 PolarHBondContact O-N 3.22Å; S163-L166 PolarHBondContact O-N 3.43Å; S163-S167 PolarHBondContact O-N 2.92Å; S163-S167 PolarHBondContact O-OG 3.15Å |
| 164 | W | 97.1 | Very high | 91.1 | Very high | 51 Ų | 51 | 69.6 Ų | 69.6 | 19% | 0.193 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -63.4 | -43 | 176.4 | -82.3 | 93.2 | 0 | 0 | 0 | 112.4 | H83 I86 A87 A128 V160 I161 F162 L166 S167 L168 | H83-W164 AromaticContact ND1-NE1 3.64Å; I86-W164 HydrophobicContact CG2-CH2 4.02Å; I86-W164 HydrophobicContact CG2-CZ2 4.09Å; A87-W164 HydrophobicContact CB-CH2 4.13Å; A87-W164 HydrophobicContact CB-CZ2 4.13Å; A128-W164 HydrophobicContact CB-CE3 4.18Å; A128-W164 HydrophobicContact CB-CH2 3.98Å; A128-W164 HydrophobicContact CB-CZ2 4.38Å; A128-W164 HydrophobicContact CB-CZ3 3.87Å; V160-W164 VanDerWaalsContact O-CD1 3.25Å; V160-W164 PolarHBondContact O-N 3.48Å; I161-W164 PolarHBondContact O-N 2.93Å; F162-W164 PolarHBondContact O-N 3.35Å; W164-L166 VanDerWaalsContact C-N 3.33Å; W164-L166 PolarHBondContact O-N 3.05Å; W164-S167 PolarHBondContact O-N 3.22Å; W164-L168 WeakPolarHBondContact O-CG 3.31Å; W164-L168 PolarHBondContact O-N 2.95Å |
| 165 | L | 97.1 | Very high | 92.3 | Very high | 105 Ų | 105 | 61.8 Ų | 61.8 | 55% | 0.55 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -63.1 | -39.4 | 174.8 | -69.6 | 173.7 | 0 | 0 | 0 | 111.7 | I161 F162 L168 L169 | I161-L165 HydrophobicContact CG2-CD1 3.83Å; I161-L165 HydrophobicContact CG2-CG 4.25Å; I161-L165 WeakPolarHBondContact O-CG 3.37Å; I161-L165 PolarHBondContact O-N 2.99Å; F162-L165 PolarHBondContact O-N 3.23Å; L165-L168 PolarHBondContact O-N 3.49Å; L165-L169 VanDerWaalsContact O-CB 3.3Å; L165-L169 WeakPolarHBondContact O-CB 3.41Å; L165-L169 PolarHBondContact O-N 3.23Å |
| 166 | L | 96 | Very high | 92.9 | Very high | 39 Ų | 39 | 65.4 Ų | 65.4 | 20% | 0.204 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -65.6 | -40.9 | 176.3 | -167.1 | 66.7 | 0 | 0 | 0 | 111.6 | Y131 F162 S163 W164 L169 F170 | Y131-L166 HydrophobicContact CD2-CB 4.37Å; Y131-L166 HydrophobicContact CD2-CD2 4.11Å; Y131-L166 HydrophobicContact CD2-CG 4.36Å; Y131-L166 HydrophobicContact CE2-CB 4.29Å; Y131-L166 HydrophobicContact CE2-CD2 3.73Å; Y131-L166 HydrophobicContact CE2-CG 3.85Å; F162-L166 HydrophobicContact CE1-CD2 4.24Å; F162-L166 WeakPolarHBondContact O-CB 3.4Å; F162-L166 PolarHBondContact O-N 2.92Å; S163-L166 PolarHBondContact O-N 3.43Å; W164-L166 VanDerWaalsContact C-N 3.33Å; W164-L166 PolarHBondContact O-N 3.05Å; L166-L169 PolarHBondContact O-N 2.97Å; L166-F170 HydrophobicContact CD1-CD1 4.03Å; L166-F170 HydrophobicContact CD1-CD2 4.46Å; L166-F170 HydrophobicContact CD1-CE1 3.57Å; L166-F170 HydrophobicContact CD1-CE2 4.04Å; L166-F170 HydrophobicContact CD1-CG 4.47Å; L166-F170 HydrophobicContact CD1-CZ 3.58Å; L166-F170 HydrophobicContact CD2-CE2 4.45Å; L166-F170 HydrophobicContact CG-CD2 4.32Å; L166-F170 HydrophobicContact CG-CE1 4.4Å; L166-F170 HydrophobicContact CG-CE2 4.16Å; L166-F170 HydrophobicContact CG-CZ 4.21Å; L166-F170 WeakPolarHBondContact O-CB 3.49Å; L166-F170 PolarHBondContact O-N 3.36Å |
| 167 | S | 96.8 | Very high | 93.3 | Very high | 0 Ų | 0 | 66.4 Ų | 66.4 | 0% | 0 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -61.9 | -44 | 173.8 | -55.9 | 0 | 0 | 0 | 0 | 112.3 | F127 A128 Y131 S163 W164 S171 | F127-S167 VanDerWaalsContact C-OG 3.25Å; F127-S167 PolarHBondContact O-OG 2.89Å; A128-S167 WeakPolarHBondContact CA-OG 3.47Å; A128-S167 PolarHBondContact N-OG 3.29Å; Y131-S167 WeakPolarHBondContact CD2-OG 3.46Å; S163-S167 PolarHBondContact O-N 2.92Å; S163-S167 PolarHBondContact O-OG 3.15Å; W164-S167 PolarHBondContact O-N 3.22Å; S167-S171 WeakPolarHBondContact O-CB 3.37Å; S167-S171 PolarHBondContact O-N 2.92Å; S167-S171 PolarHBondContact O-OG 3.41Å |
| 168 | L | 96.1 | Very high | 93.5 | Very high | 67 Ų | 67 | 59.6 Ų | 59.6 | 35% | 0.351 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -63.1 | -42.5 | 175.7 | -71.4 | 166.2 | 0 | 0 | 0 | 111.9 | Y120 V124 W164 L165 | Y120-L168 HydrophobicContact CE1-CD2 4.39Å; Y120-L168 WeakPolarHBondContact OH-CA 3.34Å; Y120-L168 WeakPolarHBondContact OH-CD2 3.29Å; Y120-L168 PolarHBondContact OH-O 2.7Å; V124-L168 HydrophobicContact CG1-CD2 3.89Å; V124-L168 HydrophobicContact CG2-CD2 4.09Å; W164-L168 WeakPolarHBondContact O-CG 3.31Å; W164-L168 PolarHBondContact O-N 2.95Å; L165-L168 PolarHBondContact O-N 3.49Å |
| 169 | L | 96 | Very high | 93.6 | Very high | 104 Ų | 104 | 53.7 Ų | 53.7 | 55% | 0.545 | 26% | 0.262 | S | S | . | . | H | α-helix | trans | -67.2 | -49.7 | 179.8 | 180 | 62.7 | 0 | 0 | 0 | 112.2 | L165 L166 S171 T172 | L165-L169 VanDerWaalsContact O-CB 3.3Å; L165-L169 WeakPolarHBondContact O-CB 3.41Å; L165-L169 PolarHBondContact O-N 3.23Å; L166-L169 PolarHBondContact O-N 2.97Å; L169-S171 PolarHBondContact O-N 3.44Å; L169-T172 WeakPolarHBondContact O-CB 3.38Å; L169-T172 VanDerWaalsContact O-CG2 3.26Å; L169-T172 WeakPolarHBondContact O-CG2 3.16Å; L169-T172 PolarHBondContact O-N 2.88Å; L169-T172 VanDerWaalsContact O-N 3.11Å; L169-T172 PolarHBondContact O-OG1 3.07Å |
| 170 | F | 95.1 | Very high | 93.6 | Very high | 54 Ų | 54 | 51.4 Ų | 51.4 | 24% | 0.237 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -71.9 | -16.4 | -177 | -75.2 | 8.2 | 0 | 0 | 0 | 113.4 | F127 Y131 L166 P173 W206 T210 | F127-F170 HydrophobicContact CD2-CB 4.41Å; F127-F170 HydrophobicContact CE1-CB 4.11Å; F127-F170 HydrophobicContact CE1-CD2 4.22Å; F127-F170 HydrophobicContact CE2-CB 3.99Å; F127-F170 HydrophobicContact CZ-CB 3.84Å; Y131-F170 HydrophobicContact CE2-CD2 4.39Å; Y131-F170 VanDerWaalsContact OH-CD2 3.32Å; Y131-F170 WeakPolarHBondContact OH-CD2 3.36Å; L166-F170 HydrophobicContact CD1-CD1 4.03Å; L166-F170 HydrophobicContact CD1-CD2 4.46Å; L166-F170 HydrophobicContact CD1-CE1 3.57Å; L166-F170 HydrophobicContact CD1-CE2 4.04Å; L166-F170 HydrophobicContact CD1-CG 4.47Å; L166-F170 HydrophobicContact CD1-CZ 3.58Å; L166-F170 HydrophobicContact CD2-CE2 4.45Å; L166-F170 HydrophobicContact CG-CD2 4.32Å; L166-F170 HydrophobicContact CG-CE1 4.4Å; L166-F170 HydrophobicContact CG-CE2 4.16Å; L166-F170 HydrophobicContact CG-CZ 4.21Å; L166-F170 WeakPolarHBondContact O-CB 3.49Å; L166-F170 PolarHBondContact O-N 3.36Å; F170-P173 WeakPolarHBondContact O-CD 3.48Å; F170-W206 HydrophobicContact CD1-CZ2 4.26Å; F170-W206 HydrophobicContact CD2-CZ2 4.02Å; F170-W206 HydrophobicContact CE1-CZ2 4.43Å; F170-W206 HydrophobicContact CE2-CH2 4.29Å; F170-W206 HydrophobicContact CE2-CZ2 4.21Å; F170-W206 HydrophobicContact CG-CZ2 4.05Å; F170-W206 HydrophobicContact CZ-CH2 4.28Å; F170-W206 HydrophobicContact CZ-CZ2 4.4Å; F170-T210 HydrophobicContact CD2-CG2 4.48Å; F170-T210 HydrophobicContact CE2-CG2 4.43Å |
| 171 | S | 94.5 | Very high | 93.3 | Very high | 0 Ų | 0 | 56.9 Ų | 56.9 | 0% | 0 | 28% | 0.277 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -81.1 | -12.6 | 171.7 | -55 | 0 | 0 | 0 | 0 | 113.7 | Y120 V124 F127 S167 L169 P173 Q174 | Y120-S171 VanDerWaalsContact CD2-O 3.31Å; Y120-S171 WeakPolarHBondContact CD2-O 3.34Å; V124-S171 VanDerWaalsContact CA-OG 3.27Å; V124-S171 WeakPolarHBondContact CA-OG 3.4Å; V124-S171 VanDerWaalsContact CG2-CB 3.43Å; V124-S171 WeakPolarHBondContact CG2-OG 3.49Å; V124-S171 PolarHBondContact N-OG 3.05Å; F127-S171 WeakPolarHBondContact CD2-OG 3.23Å; S167-S171 WeakPolarHBondContact O-CB 3.37Å; S167-S171 PolarHBondContact O-N 2.92Å; S167-S171 PolarHBondContact O-OG 3.41Å; L169-S171 PolarHBondContact O-N 3.44Å; S171-P173 VanDerWaalsContact C-N 3.31Å; S171-P173 WeakPolarHBondContact O-CD 3.37Å; S171-P173 VanDerWaalsContact O-N 3.13Å; S171-Q174 WeakPolarHBondContact O-CB 3.27Å; S171-Q174 VanDerWaalsContact O-CG 3.29Å; S171-Q174 WeakPolarHBondContact O-CG 3.36Å; S171-Q174 PolarHBondContact O-N 2.88Å; S171-Q174 VanDerWaalsContact O-N 3.09Å |
| 172 | T | 93.2 | Very high | 93 | Very high | 57 Ų | 57 | 57.9 Ų | 57.9 | 35% | 0.35 | 28% | 0.28 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -53.1 | -32.1 | -175.8 | 53.6 | 0 | 0 | 0 | 0 | 115.9 | L169 Q174 M175 F176 | L169-T172 WeakPolarHBondContact O-CB 3.38Å; L169-T172 VanDerWaalsContact O-CG2 3.26Å; L169-T172 WeakPolarHBondContact O-CG2 3.16Å; L169-T172 PolarHBondContact O-N 2.88Å; L169-T172 VanDerWaalsContact O-N 3.11Å; L169-T172 PolarHBondContact O-OG1 3.07Å; T172-Q174 PolarHBondContact O-N 3.29Å; T172-Q174 VanDerWaalsContact O-N 3.11Å; T172-M175 PolarHBondContact O-N 3.37Å; T172-F176 WeakPolarHBondContact O-CD2 3.45Å |
| 173 | P | 91.7 | Very high | 92.4 | Very high | 44 Ų | 44 | 56.1 Ų | 56.1 | 29% | 0.286 | 28% | 0.277 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -57.9 | -26.8 | 177.1 | -26.6 | 37 | 0 | 0 | 0 | 114.3 | F170 S171 M175 F176 I177 | F170-P173 WeakPolarHBondContact O-CD 3.48Å; S171-P173 VanDerWaalsContact C-N 3.31Å; S171-P173 WeakPolarHBondContact O-CD 3.37Å; S171-P173 VanDerWaalsContact O-N 3.13Å; P173-M175 VanDerWaalsContact C-N 3.29Å; P173-M175 PolarHBondContact O-N 2.83Å; P173-F176 PolarHBondContact O-N 3.44Å; P173-F176 VanDerWaalsContact O-N 3.17Å; P173-I177 HydrophobicContact CB-CD1 3.85Å; P173-I177 WeakPolarHBondContact O-CG1 3.24Å; P173-I177 PolarHBondContact O-N 2.91Å |
| 174 | Q | 90.6 | Very high | 91.7 | Very high | 3 Ų | 3 | 57 Ų | 57 | 1% | 0.014 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -56.6 | -41.6 | 179.7 | -63.1 | -56.9 | -49.1 | 0 | 0 | 112.9 | Y120 V123 S171 T172 F176 I177 F178 Y203 | Y120-Q174 HydrophobicContact CD2-CB 4.33Å; V123-Q174 HydrophobicContact CB-CG 3.84Å; V123-Q174 HydrophobicContact CG1-CG 4.26Å; V123-Q174 HydrophobicContact CG2-CG 3.89Å; S171-Q174 WeakPolarHBondContact O-CB 3.27Å; S171-Q174 VanDerWaalsContact O-CG 3.29Å; S171-Q174 WeakPolarHBondContact O-CG 3.36Å; S171-Q174 PolarHBondContact O-N 2.88Å; S171-Q174 VanDerWaalsContact O-N 3.09Å; T172-Q174 PolarHBondContact O-N 3.29Å; T172-Q174 VanDerWaalsContact O-N 3.11Å; Q174-F176 PolarHBondContact O-N 2.9Å; Q174-I177 PolarHBondContact O-N 3.25Å; Q174-F178 PolarHBondContact O-N 3.49Å; Q174-F178 VanDerWaalsContact O-N 3.08Å; Q174-Y203 VanDerWaalsContact NE2-CE2 3.26Å; Q174-Y203 PolarHBondContact NE2-OH 2.94Å |
| 175 | M | 89.8 | Confident | 90.9 | Very high | 68 Ų | 68 | 60.3 Ų | 60.3 | 34% | 0.335 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -64.6 | -23.9 | -176.5 | -68.5 | -62.7 | -62.7 | 0 | 0 | 112.9 | R116 Y120 T172 P173 | R116-M175 HydrophobicContact CB-CE 3.82Å; R116-M175 HydrophobicContact CB-SD 3.89Å; R116-M175 PolarHBondContact NH1-O 3.47Å; Y120-M175 VanDerWaalsContact CB-SD 3.59Å; Y120-M175 HydrophobicContact CD2-CG 3.82Å; Y120-M175 HydrophobicContact CD2-SD 4.37Å; Y120-M175 HydrophobicContact CG-CG 4.01Å; Y120-M175 HydrophobicContact CG-SD 3.94Å; T172-M175 PolarHBondContact O-N 3.37Å; P173-M175 VanDerWaalsContact C-N 3.29Å; P173-M175 PolarHBondContact O-N 2.83Å |
| 176 | F | 90.4 | Very high | 90.1 | Very high | 169 Ų | 169 | 58.1 Ų | 58.1 | 74% | 0.741 | 32% | 0.323 | S | S | * | . | H | α-helix | trans | -99.7 | -33.8 | -178.3 | -56.5 | -74.3 | 0 | 0 | 0 | 112.7 | T172 P173 Q174 | T172-F176 WeakPolarHBondContact O-CD2 3.45Å; P173-F176 PolarHBondContact O-N 3.44Å; P173-F176 VanDerWaalsContact O-N 3.17Å; Q174-F176 PolarHBondContact O-N 2.9Å |
| 177 | I | 90.1 | Very high | 89.6 | Confident | 27 Ų | 27 | 58.6 Ų | 58.6 | 14% | 0.138 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -78.5 | -42.8 | -178.4 | -65.5 | 165.1 | 0 | 0 | 0 | 111.6 | P173 Q174 G192 D193 F194 Y203 | P173-I177 HydrophobicContact CB-CD1 3.85Å; P173-I177 WeakPolarHBondContact O-CG1 3.24Å; P173-I177 PolarHBondContact O-N 2.91Å; Q174-I177 PolarHBondContact O-N 3.25Å; I177-G192 WeakPolarHBondContact O-CA 3.46Å; I177-D193 PolarHBondContact O-N 3.33Å; I177-F194 HydrophobicContact CD1-CE1 4.12Å; I177-F194 HydrophobicContact CG1-CE1 4.33Å; I177-F194 HydrophobicContact CG2-CD1 4.33Å; I177-F194 HydrophobicContact CG2-CE1 3.72Å; I177-F194 HydrophobicContact CG2-CE2 4.25Å; I177-F194 HydrophobicContact CG2-CZ 3.67Å; I177-Y203 HydrophobicContact CD1-CD2 3.82Å; I177-Y203 HydrophobicContact CD1-CE2 4.31Å; I177-Y203 HydrophobicContact CD1-CG 4.26Å |
| 178 | F | 89.9 | Confident | 89.1 | Confident | 30 Ų | 30 | 64.5 Ų | 64.5 | 13% | 0.132 | 35% | 0.35 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -96.8 | 140.5 | -175 | -68.5 | -86.9 | 0 | 0 | 0 | 112 | R116 K119 Q174 W191 | R116-F178 WeakPolarHBondContact CG-O 3.28Å; R116-F178 PolarHBondContact NH1-O 2.99Å; K119-F178 HydrophobicContact CB-CB 4.02Å; K119-F178 HydrophobicContact CB-CD2 4.16Å; K119-F178 HydrophobicContact CB-CG 4.05Å; K119-F178 HydrophobicContact CD-CD1 4.14Å; K119-F178 HydrophobicContact CD-CE1 4.46Å; K119-F178 HydrophobicContact CD-CG 4.3Å; K119-F178 HydrophobicContact CG-CB 3.84Å; K119-F178 HydrophobicContact CG-CD1 4.07Å; K119-F178 HydrophobicContact CG-CD2 4.37Å; K119-F178 HydrophobicContact CG-CG 3.82Å; Q174-F178 PolarHBondContact O-N 3.49Å; Q174-F178 VanDerWaalsContact O-N 3.08Å; F178-W191 WeakPolarHBondContact CA-O 3.34Å |
| 179 | S | 92.1 | Very high | 88.6 | Confident | 7 Ų | 7 | 61.8 Ų | 61.8 | 5% | 0.049 | 34% | 0.336 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -159.3 | 160.3 | 177.9 | 52.3 | 0 | 0 | 0 | 0 | 111.3 | D112 R116 R181 C190 W191 | D112-S179 WeakPolarHBondContact OD1-CA 3.47Å; D112-S179 WeakPolarHBondContact OD1-CB 3.3Å; R116-S179 VanDerWaalsContact NH2-CB 3.29Å; S179-R181 PolarHBondContact O-N 3.36Å; S179-R181 WeakPolarHBondContact OG-CG 3.36Å; S179-R181 PolarHBondContact OG-NE 2.92Å; S179-C190 CarbonylContact O-C 3.52Å; S179-W191 PolarHBondContact N-O 3.38Å; S179-W191 PolarHBondContact O-N 2.89Å |
| 180 | L | 90.4 | Very high | 88.3 | Confident | 49 Ų | 49 | 57.1 Ų | 57.1 | 26% | 0.257 | 31% | 0.312 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -71.1 | 117.3 | 169 | -173.2 | 68.6 | 0 | 0 | 0 | 108.7 | F108 D112 D189 | F108-L180 HydrophobicContact CD1-CD1 3.97Å; D112-L180 HydrophobicContact CB-CB 3.92Å; D112-L180 PolarHBondContact OD1-N 3.29Å; L180-D189 WeakPolarHBondContact CA-O 3.38Å |
| 181 | R | 87.4 | Confident | 87.8 | Confident | 118 Ų | 118 | 61.8 Ų | 61.8 | 45% | 0.445 | 33% | 0.328 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -131.1 | 154.1 | -176.4 | -66.6 | -58.8 | -153.3 | 166.4 | 11.7 | 110.7 | S179 Y188 D189 W191 D193 | S179-R181 PolarHBondContact O-N 3.36Å; S179-R181 WeakPolarHBondContact OG-CG 3.36Å; S179-R181 PolarHBondContact OG-NE 2.92Å; R181-Y188 CarbonylContact O-C 3.56Å; R181-Y188 VanDerWaalsContact O-CA 3.31Å; R181-Y188 WeakPolarHBondContact O-CA 3.32Å; R181-D189 PolarHBondContact N-O 3.5Å; R181-D189 PolarHBondContact O-N 2.88Å; R181-W191 HydrophobicContact CB-CB 4.25Å; R181-D193 IonicContact CZ-OD2 3.12Å; R181-D193 IonicContact NE-OD2 3.9Å; R181-D193 IonicContact NH2-OD2 2.86Å; R181-D193 PolarHBondContact NH2-OD2 2.99Å |
| 182 | E | 87.5 | Confident | 87.4 | Confident | 102 Ų | 102 | 62.4 Ų | 62.4 | 48% | 0.477 | 33% | 0.334 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -79 | 119.1 | 169.7 | -166.8 | 166.8 | 163.5 | 0 | 0 | 108.9 | G184 G186 V187 Y188 | E182-G184 WeakPolarHBondContact CG-O 3.26Å; E182-G186 PolarHBondContact OE1-N 3.1Å; E182-V187 CarbonylContact C-O 3.53Å; E182-V187 WeakPolarHBondContact CA-O 3.34Å; E182-Y188 HydrophobicContact CB-CD1 4.07Å; E182-Y188 HydrophobicContact CB-CE1 3.72Å; E182-Y188 HydrophobicContact CG-CE1 4.21Å; E182-Y188 PolarHBondContact OE2-OH 3.11Å |
| 183 | V | 83.4 | Confident | 86.9 | Confident | 70 Ų | 70 | 63 Ų | 63 | 42% | 0.424 | 34% | 0.336 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -103.9 | -11.7 | -176 | -173 | 0 | 0 | 0 | 0 | 111.4 | V187 D189 W191 | V183-V187 PolarHBondContact N-O 3.15Å; V183-D189 HydrophobicContact CG2-CB 3.71Å; V183-W191 HydrophobicContact CG2-CB 4.29Å; V183-W191 HydrophobicContact CG2-CE3 4.44Å; V183-W191 HydrophobicContact CG2-CG 4.49Å |
| 184 | G | 81.1 | Confident | 86.7 | Confident | 34 Ų | 34 | 64 Ų | 64 | 35% | 0.351 | 34% | 0.336 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -166.6 | 171.6 | 172.3 | 0 | 0 | 0 | 0 | 0 | 109.3 | E182 G186 V187 | E182-G184 WeakPolarHBondContact CG-O 3.26Å; G184-G186 PolarHBondContact O-N 3.48Å; G184-V187 WeakPolarHBondContact O-CB 3.35Å; G184-V187 PolarHBondContact O-N 3.3Å |
| 185 | S | 80.6 | Confident | 86.3 | Confident | 119 Ų | 119 | 70.1 Ų | 70.1 | 83% | 0.832 | 37% | 0.373 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -52.1 | 104.3 | -172.4 | 55.2 | 0 | 0 | 0 | 0 | 113.7 | V187 | S185-V187 VanDerWaalsContact C-N 3.33Š|
| 186 | G | 79.9 | Confident | 86.3 | Confident | 59 Ų | 59 | 72.3 Ų | 72.3 | 61% | 0.608 | 38% | 0.381 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 75.5 | 12 | -177.2 | 0 | 0 | 0 | 0 | 0 | 115.5 | E182 G184 | E182-G186 PolarHBondContact OE1-N 3.1Å; G184-G186 PolarHBondContact O-N 3.48Å |
| 187 | V | 84.7 | Confident | 86 | Confident | 49 Ų | 49 | 70.2 Ų | 70.2 | 30% | 0.297 | 38% | 0.384 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -114.2 | 106.8 | -170.7 | 178.6 | 0 | 0 | 0 | 0 | 110.6 | E182 V183 G184 S185 | E182-V187 CarbonylContact C-O 3.53Å; E182-V187 WeakPolarHBondContact CA-O 3.34Å; V183-V187 PolarHBondContact N-O 3.15Å; G184-V187 WeakPolarHBondContact O-CB 3.35Å; G184-V187 PolarHBondContact O-N 3.3Å; S185-V187 VanDerWaalsContact C-N 3.33Å |
| 188 | Y | 86.1 | Confident | 85.9 | Confident | 124 Ų | 124 | 77 Ų | 77 | 49% | 0.486 | 41% | 0.408 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -93.2 | 142.5 | -179.9 | -63.6 | -80.7 | 0 | 0 | 0 | 112.9 | R181 E182 | R181-Y188 CarbonylContact O-C 3.56Å; R181-Y188 VanDerWaalsContact O-CA 3.31Å; R181-Y188 WeakPolarHBondContact O-CA 3.32Å; E182-Y188 HydrophobicContact CB-CD1 4.07Å; E182-Y188 HydrophobicContact CB-CE1 3.72Å; E182-Y188 HydrophobicContact CG-CE1 4.21Å; E182-Y188 PolarHBondContact OE2-OH 3.11Å |
| 189 | D | 87.2 | Confident | 85.8 | Confident | 11 Ų | 11 | 76.1 Ų | 76.1 | 6% | 0.059 | 41% | 0.407 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -151.4 | 159.6 | 173.9 | -133.6 | -25.5 | 0 | 0 | 0 | 112.7 | W102 R107 F108 L180 R181 V183 W191 | W102-D189 WeakPolarHBondContact CH2-OD1 3.42Å; W102-D189 WeakPolarHBondContact CZ2-OD1 3.5Å; R107-D189 IonicContact NH1-OD2 3.98Å; R107-D189 PolarHBondContact NH1-OD2 3.37Å; F108-D189 WeakPolarHBondContact CB-OD1 3.43Å; F108-D189 PolarHBondContact N-OD1 3.5Å; L180-D189 WeakPolarHBondContact CA-O 3.38Å; R181-D189 PolarHBondContact N-O 3.5Å; R181-D189 PolarHBondContact O-N 2.88Å; V183-D189 HydrophobicContact CG2-CB 3.71Å; D189-W191 PolarHBondContact O-N 2.9Å; D189-W191 VanDerWaalsContact O-N 3.13Å |
| 190 | C | 88.6 | Confident | 85.6 | Confident | 5 Ų | 5 | 77.4 Ų | 77.4 | 3% | 0.034 | 42% | 0.418 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -83.5 | 88 | 179.3 | 178.9 | 0 | 0 | 0 | 0 | 110.9 | W102 F108 C115 S179 | W102-C190 HydrophobicContact CH2-CB 3.69Å; W102-C190 HydrophobicContact CZ3-CB 3.74Å; F108-C190 HydrophobicContact CB-CB 3.81Å; F108-C190 HydrophobicContact CD1-CB 4.02Å; F108-C190 HydrophobicContact CD2-CB 4Å; F108-C190 HydrophobicContact CG-CB 3.65Å; C115-C190 VanDerWaalsContact CA-SG 3.55Å; C115-C190 HydrophobicContact CB-CB 3.68Å; C115-C190 WeakPolarHBondContact CB-SG 3.44Å; C115-C190 VanDerWaalsContact SG-CA 3.56Å; C115-C190 WeakPolarHBondContact SG-CB 3.07Å; C115-C190 CovalentContact SG-SG 2.03Å; C115-C190 PolarHBondContact SG-SG 3.45Å; S179-C190 CarbonylContact O-C 3.52Å |
| 191 | W | 85.4 | Confident | 85.6 | Confident | 152 Ų | 152 | 78.7 Ų | 78.7 | 58% | 0.576 | 42% | 0.422 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -106.2 | 155.2 | -168.8 | -163.7 | -97.7 | 0 | 0 | 0 | 113.2 | F178 S179 R181 V183 D189 | F178-W191 WeakPolarHBondContact CA-O 3.34Å; S179-W191 PolarHBondContact N-O 3.38Å; S179-W191 PolarHBondContact O-N 2.89Å; R181-W191 HydrophobicContact CB-CB 4.25Å; V183-W191 HydrophobicContact CG2-CB 4.29Å; V183-W191 HydrophobicContact CG2-CE3 4.44Å; V183-W191 HydrophobicContact CG2-CG 4.49Å; D189-W191 PolarHBondContact O-N 2.9Å; D189-W191 VanDerWaalsContact O-N 3.13Å |
| 192 | G | 86 | Confident | 85.8 | Confident | 13 Ų | 13 | 75.3 Ų | 75.3 | 13% | 0.134 | 42% | 0.419 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -95.5 | 118.4 | 176.1 | 0 | 0 | 0 | 0 | 0 | 111.6 | I177 | I177-G192 WeakPolarHBondContact O-CA 3.46Å |
| 193 | D | 82.3 | Confident | 86 | Confident | 71 Ų | 71 | 72.6 Ų | 72.6 | 38% | 0.38 | 41% | 0.405 | S | S | . | . | trans | -105.2 | 123.7 | -178.2 | -173 | 4.9 | 0 | 0 | 0 | 110.5 | I177 R181 | I177-D193 PolarHBondContact O-N 3.33Å; R181-D193 IonicContact CZ-OD2 3.12Å; R181-D193 IonicContact NE-OD2 3.9Å; R181-D193 IonicContact NH2-OD2 2.86Å; R181-D193 PolarHBondContact NH2-OD2 2.99Å | ||
| 194 | F | 86.3 | Confident | 86.3 | Confident | 65 Ų | 65 | 70.4 Ų | 70.4 | 29% | 0.285 | 39% | 0.391 | S | S | . | . | trans | -117.6 | 101.1 | -176.9 | -68.6 | -77.8 | 0 | 0 | 0 | 110.5 | I177 K196 A200 Y203 | I177-F194 HydrophobicContact CD1-CE1 4.12Å; I177-F194 HydrophobicContact CG1-CE1 4.33Å; I177-F194 HydrophobicContact CG2-CD1 4.33Å; I177-F194 HydrophobicContact CG2-CE1 3.72Å; I177-F194 HydrophobicContact CG2-CE2 4.25Å; I177-F194 HydrophobicContact CG2-CZ 3.67Å; F194-K196 PolarHBondContact O-N 2.9Å; F194-A200 HydrophobicContact CD2-CB 3.94Å; F194-A200 HydrophobicContact CE2-CB 3.88Å; F194-A200 HydrophobicContact CG-CB 4.3Å; F194-A200 HydrophobicContact CZ-CB 4.19Å; F194-Y203 HydrophobicContact CE1-CD1 4.26Å; F194-Y203 HydrophobicContact CE1-CG 4.11Å; F194-Y203 AromaticContact CZ-CD1 3.81Å; F194-Y203 HydrophobicContact CZ-CD1 3.81Å; F194-Y203 HydrophobicContact CZ-CG 4.13Å | ||
| 195 | V | 83.6 | Confident | 86.9 | Confident | 130 Ų | 130 | 70.4 Ų | 70.4 | 79% | 0.788 | 38% | 0.384 | S | S | * | . | S | Bend | trans | -53.2 | -21.2 | 179.9 | -176.1 | 0 | 0 | 0 | 0 | 114.1 | ||
| 196 | K | 88.4 | Confident | 87.5 | Confident | 115 Ų | 115 | 69.8 Ų | 69.8 | 50% | 0.5 | 36% | 0.363 | S | S | . | . | S | Bend | trans | -128.3 | 143.7 | 177.9 | -62.2 | -62.9 | 176.7 | -168.1 | 0 | 110.6 | F194 W198 G199 | F194-K196 PolarHBondContact O-N 2.9Å; K196-W198 HydrophobicContact CB-CD2 4.04Å; K196-W198 HydrophobicContact CB-CG 4.32Å; K196-W198 HydrophobicContact CB-CZ2 4Å; K196-W198 HydrophobicContact CG-CZ2 3.92Å; K196-W198 PolarHBondContact O-N 3.02Å; K196-G199 WeakPolarHBondContact O-CA 3.47Å; K196-G199 PolarHBondContact O-N 3.46Å |
| 197 | P | 84.8 | Confident | 88.1 | Confident | 124 Ų | 124 | 67.6 Ų | 67.6 | 81% | 0.805 | 34% | 0.338 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -64.4 | -24 | -176.8 | 25.8 | -35.4 | 0 | 0 | 0 | 113.6 | G199 | P197-G199 VanDerWaalsContact C-N 3.32Š|
| 198 | W | 87.3 | Confident | 88.6 | Confident | 169 Ų | 169 | 65.4 Ų | 65.4 | 64% | 0.64 | 32% | 0.324 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -81.7 | -7.3 | 172.3 | 54.7 | -104.7 | 0 | 0 | 0 | 113.7 | K196 A200 K201 A202 | K196-W198 HydrophobicContact CB-CD2 4.04Å; K196-W198 HydrophobicContact CB-CG 4.32Å; K196-W198 HydrophobicContact CB-CZ2 4Å; K196-W198 HydrophobicContact CG-CZ2 3.92Å; K196-W198 PolarHBondContact O-N 3.02Å; W198-A200 PolarHBondContact O-N 3.09Å; W198-K201 PolarHBondContact O-N 3.42Å; W198-A202 HydrophobicContact CE3-CB 3.89Å; W198-A202 HydrophobicContact CZ3-CB 4.15Å; W198-A202 WeakPolarHBondContact O-CB 3.44Å; W198-A202 PolarHBondContact O-N 2.8Å |
| 199 | G | 89.1 | Confident | 89 | Confident | 12 Ų | 12 | 63 Ų | 63 | 12% | 0.124 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -60.1 | -47.2 | -173.2 | 0 | 0 | 0 | 0 | 0 | 113.2 | K196 P197 K201 A202 Y203 | K196-G199 WeakPolarHBondContact O-CA 3.47Å; K196-G199 PolarHBondContact O-N 3.46Å; P197-G199 VanDerWaalsContact C-N 3.32Å; G199-K201 VanDerWaalsContact C-N 3.35Å; G199-K201 PolarHBondContact O-N 3.36Å; G199-A202 PolarHBondContact O-N 2.68Å; G199-Y203 VanDerWaalsContact O-CB 3.27Å; G199-Y203 WeakPolarHBondContact O-CB 3.42Å; G199-Y203 PolarHBondContact O-N 3.33Å |
| 200 | A | 87.3 | Confident | 89.4 | Confident | 34 Ų | 34 | 62.8 Ų | 62.8 | 28% | 0.281 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -61.8 | -41.6 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | F194 W198 Y203 I204 | F194-A200 HydrophobicContact CD2-CB 3.94Å; F194-A200 HydrophobicContact CE2-CB 3.88Å; F194-A200 HydrophobicContact CG-CB 4.3Å; F194-A200 HydrophobicContact CZ-CB 4.19Å; W198-A200 PolarHBondContact O-N 3.09Å; A200-Y203 PolarHBondContact O-N 3.47Å; A200-I204 WeakPolarHBondContact O-CB 3.3Å; A200-I204 WeakPolarHBondContact O-CG1 3.49Å; A200-I204 PolarHBondContact O-N 3.44Å |
| 201 | K | 90.3 | Very high | 89.6 | Confident | 77 Ų | 77 | 62.5 Ų | 62.5 | 34% | 0.335 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -62.7 | -48.2 | 176.6 | -61.3 | -169.1 | 179.2 | -170.4 | 0 | 111.5 | W198 G199 T205 A298 W299 | W198-K201 PolarHBondContact O-N 3.42Å; G199-K201 VanDerWaalsContact C-N 3.35Å; G199-K201 PolarHBondContact O-N 3.36Å; K201-T205 WeakPolarHBondContact O-CB 3.29Å; K201-T205 PolarHBondContact O-N 3.01Å; K201-T205 PolarHBondContact O-OG1 2.91Å; K201-A298 WeakPolarHBondContact CE-O 3.3Å; K201-A298 WeakPolarHBondContact CG-O 3.41Å; K201-W299 HydrophobicContact CD-CE3 4.37Å |
| 202 | A | 92.5 | Very high | 90 | Very high | 47 Ų | 47 | 57 Ų | 57 | 39% | 0.388 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -62.7 | -44.1 | 177.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | W198 G199 W206 | W198-A202 HydrophobicContact CE3-CB 3.89Å; W198-A202 HydrophobicContact CZ3-CB 4.15Å; W198-A202 WeakPolarHBondContact O-CB 3.44Å; W198-A202 PolarHBondContact O-N 2.8Å; G199-A202 PolarHBondContact O-N 2.68Å; A202-W206 VanDerWaalsContact O-CB 3.27Å; A202-W206 WeakPolarHBondContact O-CB 3.25Å; A202-W206 PolarHBondContact O-N 3.31Å |
| 203 | Y | 91 | Very high | 90.5 | Very high | 44 Ų | 44 | 60.4 Ų | 60.4 | 17% | 0.173 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -61.7 | -53.1 | 177.8 | 168.2 | -109.7 | 0 | 0 | 0 | 112.5 | Q174 I177 F194 G199 A200 T205 W206 I207 | Q174-Y203 VanDerWaalsContact NE2-CE2 3.26Å; Q174-Y203 PolarHBondContact NE2-OH 2.94Å; I177-Y203 HydrophobicContact CD1-CD2 3.82Å; I177-Y203 HydrophobicContact CD1-CE2 4.31Å; I177-Y203 HydrophobicContact CD1-CG 4.26Å; F194-Y203 HydrophobicContact CE1-CD1 4.26Å; F194-Y203 HydrophobicContact CE1-CG 4.11Å; F194-Y203 AromaticContact CZ-CD1 3.81Å; F194-Y203 HydrophobicContact CZ-CD1 3.81Å; F194-Y203 HydrophobicContact CZ-CG 4.13Å; G199-Y203 VanDerWaalsContact O-CB 3.27Å; G199-Y203 WeakPolarHBondContact O-CB 3.42Å; G199-Y203 PolarHBondContact O-N 3.33Å; A200-Y203 PolarHBondContact O-N 3.47Å; Y203-T205 VanDerWaalsContact C-N 3.29Å; Y203-T205 PolarHBondContact O-N 3.25Å; Y203-W206 WeakPolarHBondContact O-CB 3.45Å; Y203-W206 PolarHBondContact O-N 2.99Å; Y203-I207 HydrophobicContact CD2-CG1 4Å; Y203-I207 HydrophobicContact CE2-CD1 3.85Å; Y203-I207 HydrophobicContact CE2-CG1 3.48Å; Y203-I207 VanDerWaalsContact CE2-CG1 3.48Å; Y203-I207 WeakPolarHBondContact O-CG1 3.19Å; Y203-I207 PolarHBondContact O-N 3.41Å |
| 204 | I | 90.5 | Very high | 91.2 | Very high | 25 Ų | 25 | 61.2 Ų | 61.2 | 13% | 0.128 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -64.1 | -38.1 | -179.3 | -68.2 | 168.3 | 0 | 0 | 0 | 110.9 | A200 S208 Q294 A298 | A200-I204 WeakPolarHBondContact O-CB 3.3Å; A200-I204 WeakPolarHBondContact O-CG1 3.49Å; A200-I204 PolarHBondContact O-N 3.44Å; I204-S208 VanDerWaalsContact O-CB 3.29Å; I204-S208 WeakPolarHBondContact O-CB 3.26Å; I204-S208 PolarHBondContact O-N 3.49Å; I204-S208 PolarHBondContact O-OG 3.42Å; I204-Q294 HydrophobicContact CG2-CB 3.97Å; I204-Q294 WeakPolarHBondContact CG2-O 3.49Å; I204-A298 HydrophobicContact CB-CB 3.96Å; I204-A298 HydrophobicContact CD1-CB 3.71Å; I204-A298 HydrophobicContact CG1-CB 4.43Å; I204-A298 HydrophobicContact CG2-CB 3.88Å |
| 205 | T | 93.3 | Very high | 91.7 | Very high | 33 Ų | 33 | 58.2 Ų | 58.2 | 20% | 0.202 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -64.6 | -44.3 | 175.2 | -55.3 | 0 | 0 | 0 | 0 | 111.2 | K201 Y203 S208 L209 W299 | K201-T205 WeakPolarHBondContact O-CB 3.29Å; K201-T205 PolarHBondContact O-N 3.01Å; K201-T205 PolarHBondContact O-OG1 2.91Å; Y203-T205 VanDerWaalsContact C-N 3.29Å; Y203-T205 PolarHBondContact O-N 3.25Å; T205-S208 PolarHBondContact O-N 3.47Å; T205-L209 HydrophobicContact CG2-CD1 3.95Å; T205-L209 HydrophobicContact CG2-CG 4.35Å; T205-L209 WeakPolarHBondContact O-CB 3.34Å; T205-L209 VanDerWaalsContact O-CG 3.26Å; T205-L209 WeakPolarHBondContact O-CG 3.38Å; T205-L209 PolarHBondContact O-N 2.89Å; T205-W299 PolarHBondContact OG1-NE1 3.47Å |
| 206 | W | 94.1 | Very high | 92.2 | Very high | 106 Ų | 106 | 53.1 Ų | 53.1 | 40% | 0.402 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -59.1 | -49.3 | 176.6 | 170 | -104.2 | 0 | 0 | 0 | 112.8 | F170 A202 Y203 L209 T210 | F170-W206 HydrophobicContact CD1-CZ2 4.26Å; F170-W206 HydrophobicContact CD2-CZ2 4.02Å; F170-W206 HydrophobicContact CE1-CZ2 4.43Å; F170-W206 HydrophobicContact CE2-CH2 4.29Å; F170-W206 HydrophobicContact CE2-CZ2 4.21Å; F170-W206 HydrophobicContact CG-CZ2 4.05Å; F170-W206 HydrophobicContact CZ-CH2 4.28Å; F170-W206 HydrophobicContact CZ-CZ2 4.4Å; A202-W206 VanDerWaalsContact O-CB 3.27Å; A202-W206 WeakPolarHBondContact O-CB 3.25Å; A202-W206 PolarHBondContact O-N 3.31Å; Y203-W206 WeakPolarHBondContact O-CB 3.45Å; Y203-W206 PolarHBondContact O-N 2.99Å; W206-L209 PolarHBondContact O-N 3.49Å; W206-T210 HydrophobicContact CD2-CG2 3.89Å; W206-T210 HydrophobicContact CE3-CG2 3.85Å; W206-T210 HydrophobicContact CH2-CG2 3.73Å; W206-T210 HydrophobicContact CZ2-CG2 3.76Å; W206-T210 HydrophobicContact CZ3-CG2 3.77Å; W206-T210 WeakPolarHBondContact O-CB 3.49Å; W206-T210 WeakPolarHBondContact O-CG2 3.29Å; W206-T210 PolarHBondContact O-N 3.42Å; W206-T210 PolarHBondContact O-OG1 3.37Å |
| 207 | I | 91.9 | Very high | 92.7 | Very high | 14 Ų | 14 | 49.9 Ų | 49.9 | 7% | 0.072 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -64.4 | -44.2 | 178.7 | -60.2 | -63.2 | 0 | 0 | 0 | 110.2 | V123 F127 Y203 L209 T210 I211 F291 | V123-I207 HydrophobicContact CG1-CD1 4.32Å; F127-I207 HydrophobicContact CE2-CD1 4.08Å; F127-I207 HydrophobicContact CZ-CD1 4.06Å; Y203-I207 HydrophobicContact CD2-CG1 4Å; Y203-I207 HydrophobicContact CE2-CD1 3.85Å; Y203-I207 HydrophobicContact CE2-CG1 3.48Å; Y203-I207 VanDerWaalsContact CE2-CG1 3.48Å; Y203-I207 WeakPolarHBondContact O-CG1 3.19Å; Y203-I207 PolarHBondContact O-N 3.41Å; I207-L209 VanDerWaalsContact C-N 3.34Å; I207-L209 PolarHBondContact O-N 2.89Å; I207-T210 PolarHBondContact O-N 3.33Å; I207-I211 HydrophobicContact CG2-CD1 3.63Å; I207-I211 HydrophobicContact CG2-CG1 4.11Å; I207-I211 WeakPolarHBondContact O-CB 3.27Å; I207-I211 PolarHBondContact O-N 3.48Å; I207-F291 HydrophobicContact CG2-CE1 3.94Å; I207-F291 HydrophobicContact CG2-CZ 4.35Å |
| 208 | S | 93.9 | Very high | 93.2 | Very high | 3 Ų | 3 | 46.8 Ų | 46.8 | 2% | 0.021 | 24% | 0.241 | C | C | . | . | I | π-helix | trans | -60.1 | -41.4 | 176.4 | -56.7 | 0 | 0 | 0 | 0 | 112.5 | I204 T205 Y212 I213 F291 M295 | I204-S208 VanDerWaalsContact O-CB 3.29Å; I204-S208 WeakPolarHBondContact O-CB 3.26Å; I204-S208 PolarHBondContact O-N 3.49Å; I204-S208 PolarHBondContact O-OG 3.42Å; T205-S208 PolarHBondContact O-N 3.47Å; S208-Y212 WeakPolarHBondContact O-CA 3.05Å; S208-Y212 VanDerWaalsContact O-CB 3.32Å; S208-Y212 WeakPolarHBondContact O-CB 3.38Å; S208-Y212 PolarHBondContact O-N 2.96Å; S208-I213 PolarHBondContact O-N 3.38Å; S208-F291 WeakPolarHBondContact OG-CD1 3.49Å; S208-M295 VanDerWaalsContact CB-CE 3.44Å; S208-M295 WeakPolarHBondContact OG-CE 3.41Å |
| 209 | L | 95.6 | Very high | 93.6 | Very high | 73 Ų | 73 | 38.8 Ų | 38.8 | 38% | 0.382 | 21% | 0.211 | S | C | . | . | I | π-helix | trans | -65.6 | -47.9 | 177.4 | -76.4 | 170.2 | 0 | 0 | 0 | 111.9 | T205 W206 I207 I213 I214 | T205-L209 HydrophobicContact CG2-CD1 3.95Å; T205-L209 HydrophobicContact CG2-CG 4.35Å; T205-L209 WeakPolarHBondContact O-CB 3.34Å; T205-L209 VanDerWaalsContact O-CG 3.26Å; T205-L209 WeakPolarHBondContact O-CG 3.38Å; T205-L209 PolarHBondContact O-N 2.89Å; W206-L209 PolarHBondContact O-N 3.49Å; I207-L209 VanDerWaalsContact C-N 3.34Å; I207-L209 PolarHBondContact O-N 2.89Å; L209-I213 HydrophobicContact CD2-CB 4.19Å; L209-I213 HydrophobicContact CD2-CG1 4.25Å; L209-I213 HydrophobicContact CD2-CG2 4.33Å; L209-I213 PolarHBondContact O-N 2.87Å; L209-I214 WeakPolarHBondContact O-CB 3.48Å; L209-I214 WeakPolarHBondContact O-CG1 3.43Å; L209-I214 PolarHBondContact O-N 3.42Å |
| 210 | T | 94.8 | Very high | 93.8 | Very high | 6 Ų | 6 | 41.6 Ų | 41.6 | 4% | 0.037 | 23% | 0.228 | C | C | . | . | I | π-helix | trans | -86.6 | -25.5 | -168 | 55.2 | 0 | 0 | 0 | 0 | 114.5 | F127 Y131 F170 W206 I207 P215 | F127-T210 WeakPolarHBondContact CE1-OG1 3.22Å; F127-T210 WeakPolarHBondContact CZ-OG1 3.32Å; Y131-T210 WeakPolarHBondContact CE1-O 3.4Å; Y131-T210 PolarHBondContact OH-O 3.1Å; F170-T210 HydrophobicContact CD2-CG2 4.48Å; F170-T210 HydrophobicContact CE2-CG2 4.43Å; W206-T210 HydrophobicContact CD2-CG2 3.89Å; W206-T210 HydrophobicContact CE3-CG2 3.85Å; W206-T210 HydrophobicContact CH2-CG2 3.73Å; W206-T210 HydrophobicContact CZ2-CG2 3.76Å; W206-T210 HydrophobicContact CZ3-CG2 3.77Å; W206-T210 WeakPolarHBondContact O-CB 3.49Å; W206-T210 WeakPolarHBondContact O-CG2 3.29Å; W206-T210 PolarHBondContact O-N 3.42Å; W206-T210 PolarHBondContact O-OG1 3.37Å; I207-T210 PolarHBondContact O-N 3.33Å; T210-P215 WeakPolarHBondContact O-CD 3.38Å; T210-P215 WeakPolarHBondContact O-CG 3.42Å |
| 211 | I | 93.6 | Very high | 94.1 | Very high | 0 Ų | 0 | 45 Ų | 45 | 0% | 0 | 24% | 0.241 | C | C | . | . | I | π-helix | trans | -94.2 | -40 | 173.3 | -57.5 | -169.8 | 0 | 0 | 0 | 111.1 | M126 F127 T130 I207 P215 Y283 F291 | M126-I211 HydrophobicContact CB-CD1 3.82Å; M126-I211 HydrophobicContact SD-CD1 4.32Å; F127-I211 HydrophobicContact CD1-CD1 4.15Å; F127-I211 HydrophobicContact CD1-CG1 3.67Å; F127-I211 HydrophobicContact CD2-CD1 4.22Å; F127-I211 HydrophobicContact CE1-CD1 4.03Å; F127-I211 HydrophobicContact CE1-CG1 3.38Å; F127-I211 HydrophobicContact CE2-CD1 4.12Å; F127-I211 HydrophobicContact CE2-CG1 4.35Å; F127-I211 HydrophobicContact CG-CD1 4.24Å; F127-I211 HydrophobicContact CG-CG1 4.26Å; F127-I211 HydrophobicContact CZ-CD1 4.02Å; F127-I211 HydrophobicContact CZ-CG1 3.76Å; T130-I211 HydrophobicContact CG2-CG2 4.36Å; T130-I211 WeakPolarHBondContact CG2-O 3.48Å; I207-I211 HydrophobicContact CG2-CD1 3.63Å; I207-I211 HydrophobicContact CG2-CG1 4.11Å; I207-I211 WeakPolarHBondContact O-CB 3.27Å; I207-I211 PolarHBondContact O-N 3.48Å; I211-P215 WeakPolarHBondContact O-CB 3.01Å; I211-P215 WeakPolarHBondContact O-CG 3.38Å; I211-Y283 PolarHBondContact O-OH 3.47Å; I211-F291 HydrophobicContact CB-CE2 4.27Å; I211-F291 HydrophobicContact CB-CZ 3.8Å; I211-F291 HydrophobicContact CG2-CE2 3.89Å; I211-F291 HydrophobicContact CG2-CZ 3.73Å |
| 212 | Y | 94.4 | Very high | 94.3 | Very high | 35 Ų | 35 | 41.9 Ų | 41.9 | 14% | 0.137 | 23% | 0.228 | C | C | . | . | I | π-helix | trans | -106.4 | -65.7 | -173.1 | -178.2 | -111.6 | 0 | 0 | 0 | 114.1 | S208 I214 P215 V216 Y283 W287 T288 F291 | S208-Y212 WeakPolarHBondContact O-CA 3.05Å; S208-Y212 VanDerWaalsContact O-CB 3.32Å; S208-Y212 WeakPolarHBondContact O-CB 3.38Å; S208-Y212 PolarHBondContact O-N 2.96Å; Y212-I214 PolarHBondContact O-N 3.39Å; Y212-P215 WeakPolarHBondContact O-CD 3.4Å; Y212-V216 HydrophobicContact CD2-CG2 3.77Å; Y212-V216 HydrophobicContact CE2-CG2 3.6Å; Y212-V216 HydrophobicContact CG-CG2 4.48Å; Y212-V216 WeakPolarHBondContact O-CB 3.2Å; Y212-V216 VanDerWaalsContact O-CG2 3.27Å; Y212-V216 WeakPolarHBondContact O-CG2 3.36Å; Y212-V216 PolarHBondContact O-N 3.38Å; Y212-Y283 HydrophobicContact CD2-CE1 4.5Å; Y212-W287 HydrophobicContact CD2-CB 3.93Å; Y212-W287 HydrophobicContact CE2-CB 4.3Å; Y212-T288 PolarHBondContact OH-OG1 3.14Å; Y212-F291 HydrophobicContact CD1-CB 4.11Å; Y212-F291 HydrophobicContact CD1-CD2 4.37Å; Y212-F291 HydrophobicContact CD1-CG 4.5Å; Y212-F291 HydrophobicContact CD2-CD2 4.05Å; Y212-F291 HydrophobicContact CG-CB 4.27Å; Y212-F291 AromaticContact CG-CD2 3.67Å; Y212-F291 HydrophobicContact CG-CD2 3.67Å; Y212-F291 HydrophobicContact CG-CE2 4.37Å; Y212-F291 HydrophobicContact CG-CG 4.2Å |
| 213 | I | 95.9 | Very high | 94.2 | Very high | 86 Ų | 86 | 40.3 Ų | 40.3 | 44% | 0.441 | 21% | 0.212 | S | C | . | . | I | π-helix | trans | -60.5 | -51.9 | -168.9 | -56.6 | -66.9 | 0 | 0 | 0 | 112.2 | S208 L209 V216 A217 | S208-I213 PolarHBondContact O-N 3.38Å; L209-I213 HydrophobicContact CD2-CB 4.19Å; L209-I213 HydrophobicContact CD2-CG1 4.25Å; L209-I213 HydrophobicContact CD2-CG2 4.33Å; L209-I213 PolarHBondContact O-N 2.87Å; I213-V216 PolarHBondContact O-N 3.48Å; I213-A217 WeakPolarHBondContact O-CB 3.32Å; I213-A217 PolarHBondContact O-N 3.08Å |
| 214 | I | 96.5 | Very high | 94.2 | Very high | 88 Ų | 88 | 40.2 Ų | 40.2 | 45% | 0.451 | 23% | 0.225 | S | C | . | . | H | α-helix | trans | -65.8 | -49 | -177.9 | -68.2 | 166.8 | 0 | 0 | 0 | 111 | L209 Y212 V216 A217 I218 | L209-I214 WeakPolarHBondContact O-CB 3.48Å; L209-I214 WeakPolarHBondContact O-CG1 3.43Å; L209-I214 PolarHBondContact O-N 3.42Å; Y212-I214 PolarHBondContact O-N 3.39Å; I214-V216 PolarHBondContact O-N 2.77Å; I214-A217 PolarHBondContact O-N 3.26Å; I214-I218 HydrophobicContact CG2-CD1 3.8Å; I214-I218 WeakPolarHBondContact O-CG1 3.47Å; I214-I218 PolarHBondContact O-N 3.49Å |
| 215 | P | 96.1 | Very high | 94.3 | Very high | 2 Ų | 2 | 43.1 Ų | 43.1 | 1% | 0.013 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -54.7 | -50.2 | 172 | -35.5 | 44.8 | 0 | 0 | 0 | 113.5 | T130 Y131 V134 T210 I211 Y212 A217 I218 L219 | T130-P215 HydrophobicContact CG2-CB 3.78Å; T130-P215 HydrophobicContact CG2-CG 3.53Å; Y131-P215 HydrophobicContact CE1-CG 4.37Å; V134-P215 HydrophobicContact CG2-CB 3.67Å; V134-P215 HydrophobicContact CG2-CG 4.23Å; T210-P215 WeakPolarHBondContact O-CD 3.38Å; T210-P215 WeakPolarHBondContact O-CG 3.42Å; I211-P215 WeakPolarHBondContact O-CB 3.01Å; I211-P215 WeakPolarHBondContact O-CG 3.38Å; Y212-P215 WeakPolarHBondContact O-CD 3.4Å; P215-A217 VanDerWaalsContact C-N 3.31Å; P215-A217 PolarHBondContact O-N 3.27Å; P215-I218 PolarHBondContact O-N 3.28Å; P215-I218 VanDerWaalsContact O-N 3.13Å; P215-L219 WeakPolarHBondContact O-CB 3.37Å; P215-L219 WeakPolarHBondContact O-CG 3.4Å; P215-L219 PolarHBondContact O-N 3.49Å |
| 216 | V | 96.1 | Very high | 94.1 | Very high | 23 Ų | 23 | 41.6 Ų | 41.6 | 14% | 0.139 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -61.2 | -37.6 | 179.8 | 172.1 | 0 | 0 | 0 | 0 | 112.2 | Y212 I213 I214 L219 S220 Y283 I284 | Y212-V216 HydrophobicContact CD2-CG2 3.77Å; Y212-V216 HydrophobicContact CE2-CG2 3.6Å; Y212-V216 HydrophobicContact CG-CG2 4.48Å; Y212-V216 WeakPolarHBondContact O-CB 3.2Å; Y212-V216 VanDerWaalsContact O-CG2 3.27Å; Y212-V216 WeakPolarHBondContact O-CG2 3.36Å; Y212-V216 PolarHBondContact O-N 3.38Å; I213-V216 PolarHBondContact O-N 3.48Å; I214-V216 PolarHBondContact O-N 2.77Å; V216-L219 PolarHBondContact O-N 3.48Å; V216-S220 VanDerWaalsContact O-CB 3.28Å; V216-S220 WeakPolarHBondContact O-CB 3.35Å; V216-S220 PolarHBondContact O-N 2.9Å; V216-S220 PolarHBondContact O-OG 3.03Å; V216-Y283 HydrophobicContact CG2-CD1 4.43Å; V216-Y283 HydrophobicContact CG2-CE1 4.21Å; V216-I284 HydrophobicContact CG1-CD1 4.25Å; V216-I284 HydrophobicContact CG1-CG1 4.33Å; V216-I284 HydrophobicContact CG2-CG1 3.92Å |
| 217 | A | 96.9 | Very high | 93.8 | Very high | 47 Ų | 47 | 39.9 Ų | 39.9 | 39% | 0.388 | 24% | 0.235 | S | C | . | . | H | α-helix | trans | -62.4 | -48.5 | 173 | 0 | 0 | 0 | 0 | 0 | 111.9 | I213 I214 P215 L219 S220 I221 | I213-A217 WeakPolarHBondContact O-CB 3.32Å; I213-A217 PolarHBondContact O-N 3.08Å; I214-A217 PolarHBondContact O-N 3.26Å; P215-A217 VanDerWaalsContact C-N 3.31Å; P215-A217 PolarHBondContact O-N 3.27Å; A217-L219 VanDerWaalsContact C-N 3.35Å; A217-L219 PolarHBondContact O-N 2.98Å; A217-S220 PolarHBondContact O-N 3.14Å; A217-I221 VanDerWaalsContact O-CG1 3.31Å; A217-I221 WeakPolarHBondContact O-CG1 3.46Å; A217-I221 PolarHBondContact O-N 2.95Å |
| 218 | I | 96.4 | Very high | 93.6 | Very high | 59 Ų | 59 | 44.7 Ų | 44.7 | 30% | 0.303 | 26% | 0.256 | S | S | . | . | H | α-helix | trans | -61.9 | -43 | 178.3 | -64.1 | 164.3 | 0 | 0 | 0 | 111 | V134 V138 I214 P215 I221 C222 | V134-I218 HydrophobicContact CG1-CB 4.38Å; V134-I218 HydrophobicContact CG1-CD1 4.28Å; V134-I218 HydrophobicContact CG1-CG2 3.77Å; V138-I218 HydrophobicContact CG2-CG2 3.96Å; I214-I218 HydrophobicContact CG2-CD1 3.8Å; I214-I218 WeakPolarHBondContact O-CG1 3.47Å; I214-I218 PolarHBondContact O-N 3.49Å; P215-I218 PolarHBondContact O-N 3.28Å; P215-I218 VanDerWaalsContact O-N 3.13Å; I218-I221 PolarHBondContact O-N 3.26Å; I218-C222 WeakPolarHBondContact O-CB 3.16Å; I218-C222 PolarHBondContact O-N 2.92Å; I218-C222 PolarHBondContact O-SG 3.2Å |
| 219 | L | 94.4 | Very high | 93.2 | Very high | 1 Ų | 1 | 47.8 Ų | 47.8 | 1% | 0.005 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -62.2 | -49.8 | 177.1 | -64.2 | 170.8 | 0 | 0 | 0 | 110.4 | L133 V134 S137 P215 V216 A217 I221 C222 Y223 V280 Y283 | L133-L219 HydrophobicContact CD2-CD1 3.57Å; L133-L219 HydrophobicContact CD2-CD2 3.59Å; L133-L219 HydrophobicContact CD2-CG 4.21Å; V134-L219 HydrophobicContact CG2-CD2 4.35Å; V134-L219 HydrophobicContact CG2-CG 4.43Å; S137-L219 VanDerWaalsContact OG-CD2 3.29Å; S137-L219 WeakPolarHBondContact OG-CD2 3.27Å; P215-L219 WeakPolarHBondContact O-CB 3.37Å; P215-L219 WeakPolarHBondContact O-CG 3.4Å; P215-L219 PolarHBondContact O-N 3.49Å; V216-L219 PolarHBondContact O-N 3.48Å; A217-L219 VanDerWaalsContact C-N 3.35Å; A217-L219 PolarHBondContact O-N 2.98Å; L219-I221 VanDerWaalsContact C-N 3.31Å; L219-I221 PolarHBondContact O-N 3.09Å; L219-C222 WeakPolarHBondContact O-CB 3.46Å; L219-C222 PolarHBondContact O-N 2.66Å; L219-Y223 HydrophobicContact CD2-CE2 4.44Å; L219-Y223 VanDerWaalsContact O-CD2 3.24Å; L219-Y223 WeakPolarHBondContact O-CD2 3.35Å; L219-Y223 PolarHBondContact O-N 3.36Å; L219-V280 HydrophobicContact CB-CG1 4.05Å; L219-V280 HydrophobicContact CB-CG2 4.38Å; L219-V280 HydrophobicContact CD1-CG1 4.11Å; L219-V280 HydrophobicContact CD1-CG2 4.02Å; L219-V280 HydrophobicContact CD2-CG2 3.79Å; L219-V280 HydrophobicContact CG-CG2 4.26Å; L219-Y283 HydrophobicContact CD1-CD1 4.34Å |
| 220 | S | 94 | Very high | 92.6 | Very high | 70 Ų | 70 | 47.1 Ų | 47.1 | 49% | 0.49 | 27% | 0.265 | S | S | . | . | H | α-helix | trans | -55.9 | -44.7 | 178.4 | -60.2 | 0 | 0 | 0 | 0 | 112.1 | V216 A217 G224 | V216-S220 VanDerWaalsContact O-CB 3.28Å; V216-S220 WeakPolarHBondContact O-CB 3.35Å; V216-S220 PolarHBondContact O-N 2.9Å; V216-S220 PolarHBondContact O-OG 3.03Å; A217-S220 PolarHBondContact O-N 3.14Å; S220-G224 PolarHBondContact O-N 3.02Å |
| 221 | I | 94.8 | Very high | 92.1 | Very high | 107 Ų | 107 | 53.8 Ų | 53.8 | 55% | 0.549 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -62 | -47.2 | 174.4 | -66.7 | 164.4 | 0 | 0 | 0 | 110.8 | A217 I218 L219 G224 L225 | A217-I221 VanDerWaalsContact O-CG1 3.31Å; A217-I221 WeakPolarHBondContact O-CG1 3.46Å; A217-I221 PolarHBondContact O-N 2.95Å; I218-I221 PolarHBondContact O-N 3.26Å; L219-I221 VanDerWaalsContact C-N 3.31Å; L219-I221 PolarHBondContact O-N 3.09Å; I221-G224 PolarHBondContact O-N 2.9Å; I221-L225 HydrophobicContact CG2-CD1 3.97Å; I221-L225 HydrophobicContact CG2-CG 4.46Å; I221-L225 WeakPolarHBondContact O-CB 3.32Å; I221-L225 VanDerWaalsContact O-CG 3.29Å; I221-L225 WeakPolarHBondContact O-CG 3.41Å; I221-L225 PolarHBondContact O-N 3.12Å |
| 222 | C | 93.4 | Very high | 91.6 | Very high | 10 Ų | 10 | 57.4 Ų | 57.4 | 7% | 0.068 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -60.2 | -49.2 | 179.8 | -71.1 | 0 | 0 | 0 | 0 | 112.4 | C141 I218 L219 L225 I226 | C141-C222 HydrophobicContact CB-CB 4.03Å; I218-C222 WeakPolarHBondContact O-CB 3.16Å; I218-C222 PolarHBondContact O-N 2.92Å; I218-C222 PolarHBondContact O-SG 3.2Å; L219-C222 WeakPolarHBondContact O-CB 3.46Å; L219-C222 PolarHBondContact O-N 2.66Å; C222-L225 PolarHBondContact O-N 2.9Å; C222-I226 WeakPolarHBondContact O-CD1 3.49Å; C222-I226 WeakPolarHBondContact O-CG1 3.39Å; C222-I226 PolarHBondContact O-N 2.72Å |
| 223 | Y | 91.1 | Very high | 90.8 | Very high | 14 Ų | 14 | 58 Ų | 58 | 6% | 0.055 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -73.5 | -29.3 | -179.7 | -72.1 | -82.3 | 0 | 0 | 0 | 112.9 | S137 L219 I226 S227 T276 F277 V280 | S137-Y223 WeakPolarHBondContact OG-CE2 3.37Å; S137-Y223 PolarHBondContact OG-OH 3.47Å; L219-Y223 HydrophobicContact CD2-CE2 4.44Å; L219-Y223 VanDerWaalsContact O-CD2 3.24Å; L219-Y223 WeakPolarHBondContact O-CD2 3.35Å; L219-Y223 PolarHBondContact O-N 3.36Å; Y223-I226 HydrophobicContact CD1-CD1 4.11Å; Y223-I226 HydrophobicContact CE1-CD1 4.19Å; Y223-S227 VanDerWaalsContact O-CB 3.28Å; Y223-S227 WeakPolarHBondContact O-CB 3.27Å; Y223-S227 PolarHBondContact O-N 3.22Å; Y223-S227 PolarHBondContact O-OG 2.87Å; Y223-T276 VanDerWaalsContact OH-C 3.25Å; Y223-T276 WeakPolarHBondContact OH-CB 3.32Å; Y223-T276 PolarHBondContact OH-O 2.89Å; Y223-T276 PolarHBondContact OH-OG1 2.87Å; Y223-F277 HydrophobicContact CD1-CB 4.06Å; Y223-F277 AromaticContact CD1-CD2 3.79Å; Y223-F277 HydrophobicContact CD1-CD2 3.79Å; Y223-F277 HydrophobicContact CD1-CG 4.43Å; Y223-F277 HydrophobicContact CE1-CB 3.81Å; Y223-F277 HydrophobicContact CE1-CD2 4.35Å; Y223-F277 HydrophobicContact CG-CD2 4.17Å; Y223-V280 HydrophobicContact CD2-CG1 4.45Å; Y223-V280 HydrophobicContact CD2-CG2 4.15Å; Y223-V280 HydrophobicContact CE2-CB 4.22Å; Y223-V280 HydrophobicContact CE2-CG2 3.42Å; Y223-V280 VanDerWaalsContact CE2-CG2 3.42Å |
| 224 | G | 91.3 | Very high | 90 | Very high | 43 Ų | 43 | 60.2 Ų | 60.2 | 44% | 0.443 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -60.1 | -49.8 | 167.8 | 0 | 0 | 0 | 0 | 0 | 112 | S220 I221 I226 S227 F228 | S220-G224 PolarHBondContact O-N 3.02Å; I221-G224 PolarHBondContact O-N 2.9Å; G224-I226 PolarHBondContact O-N 3.11Å; G224-S227 PolarHBondContact O-N 3.11Å; G224-F228 WeakPolarHBondContact O-CB 3.49Å; G224-F228 PolarHBondContact O-N 3.29Å |
| 225 | L | 91.6 | Very high | 89.1 | Confident | 86 Ų | 86 | 60.8 Ų | 60.8 | 45% | 0.45 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -63.6 | -40.4 | 177.2 | -70.4 | 173.6 | 0 | 0 | 0 | 112.9 | I221 C222 K229 | I221-L225 HydrophobicContact CG2-CD1 3.97Å; I221-L225 HydrophobicContact CG2-CG 4.46Å; I221-L225 WeakPolarHBondContact O-CB 3.32Å; I221-L225 VanDerWaalsContact O-CG 3.29Å; I221-L225 WeakPolarHBondContact O-CG 3.41Å; I221-L225 PolarHBondContact O-N 3.12Å; C222-L225 PolarHBondContact O-N 2.9Å; L225-K229 WeakPolarHBondContact O-CB 3.44Å; L225-K229 WeakPolarHBondContact O-CG 3.42Å; L225-K229 PolarHBondContact O-N 3.24Å |
| 226 | I | 88.9 | Confident | 88.1 | Confident | 1 Ų | 1 | 65 Ų | 65 | 1% | 0.005 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -60.8 | -48.9 | 173.9 | -70.4 | 164.9 | 0 | 0 | 0 | 110.2 | R140 C141 I144 C222 Y223 G224 K229 I230 V273 | R140-I226 HydrophobicContact CB-CD1 4.31Å; C141-I226 HydrophobicContact CB-CD1 4.05Å; C141-I226 HydrophobicContact CB-CG1 4.09Å; I144-I226 HydrophobicContact CD1-CD1 4.38Å; I144-I226 HydrophobicContact CD1-CG1 4.14Å; I144-I226 HydrophobicContact CD1-CG2 3.99Å; C222-I226 WeakPolarHBondContact O-CD1 3.49Å; C222-I226 WeakPolarHBondContact O-CG1 3.39Å; C222-I226 PolarHBondContact O-N 2.72Å; Y223-I226 HydrophobicContact CD1-CD1 4.11Å; Y223-I226 HydrophobicContact CE1-CD1 4.19Å; G224-I226 PolarHBondContact O-N 3.11Å; I226-K229 PolarHBondContact O-N 3.05Å; I226-I230 HydrophobicContact CG2-CD1 3.65Å; I226-I230 HydrophobicContact CG2-CG1 4.4Å; I226-I230 WeakPolarHBondContact O-CG1 3.5Å; I226-I230 PolarHBondContact O-N 2.68Å; I226-V273 HydrophobicContact CG2-CG1 3.78Å; I226-V273 HydrophobicContact CG2-CG2 4.33Å |
| 227 | S | 87.8 | Confident | 87 | Confident | 70 Ų | 70 | 68.4 Ų | 68.4 | 49% | 0.49 | 35% | 0.353 | S | S | . | . | H | α-helix | trans | -62.3 | -45.6 | -179 | -58.8 | 0 | 0 | 0 | 0 | 111.5 | Y223 G224 K229 I230 W231 | Y223-S227 VanDerWaalsContact O-CB 3.28Å; Y223-S227 WeakPolarHBondContact O-CB 3.27Å; Y223-S227 PolarHBondContact O-N 3.22Å; Y223-S227 PolarHBondContact O-OG 2.87Å; G224-S227 PolarHBondContact O-N 3.11Å; S227-K229 PolarHBondContact O-N 2.94Å; S227-I230 PolarHBondContact O-N 3.33Å; S227-W231 WeakPolarHBondContact O-CB 3.35Å; S227-W231 PolarHBondContact O-N 3.44Å |
| 228 | F | 88 | Confident | 85.9 | Confident | 115 Ų | 115 | 68.4 Ų | 68.4 | 50% | 0.504 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -58.8 | -43.9 | 174.1 | 179 | -99.3 | 0 | 0 | 0 | 112.1 | G224 W231 Q232 | G224-F228 WeakPolarHBondContact O-CB 3.49Å; G224-F228 PolarHBondContact O-N 3.29Å; F228-W231 PolarHBondContact O-N 3.5Å; F228-Q232 WeakPolarHBondContact O-CB 3.33Å; F228-Q232 PolarHBondContact O-N 2.85Å |
| 229 | K | 85.8 | Confident | 84.6 | Confident | 68 Ų | 68 | 74 Ų | 74 | 30% | 0.296 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -68.9 | -36 | 178 | -76.9 | -69.3 | 172.3 | -165.6 | 0 | 113.2 | I144 C145 L225 I226 S227 N233 | I144-K229 HydrophobicContact CG2-CB 4.38Å; C145-K229 HydrophobicContact CB-CG 4.42Å; L225-K229 WeakPolarHBondContact O-CB 3.44Å; L225-K229 WeakPolarHBondContact O-CG 3.42Å; L225-K229 PolarHBondContact O-N 3.24Å; I226-K229 PolarHBondContact O-N 3.05Å; S227-K229 PolarHBondContact O-N 2.94Å; K229-N233 PolarHBondContact O-N 3.38Å; K229-N233 PolarHBondContact O-ND2 2.89Å |
| 230 | I | 83.5 | Confident | 83.3 | Confident | 59 Ų | 59 | 81.3 Ų | 81.3 | 30% | 0.303 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -64.7 | -46.3 | 173.5 | -69.7 | 168.4 | 0 | 0 | 0 | 110 | I226 S227 Q232 N233 F234 I265 V273 | I226-I230 HydrophobicContact CG2-CD1 3.65Å; I226-I230 HydrophobicContact CG2-CG1 4.4Å; I226-I230 WeakPolarHBondContact O-CG1 3.5Å; I226-I230 PolarHBondContact O-N 2.68Å; S227-I230 PolarHBondContact O-N 3.33Å; I230-Q232 PolarHBondContact O-N 3.46Å; I230-N233 PolarHBondContact O-N 3Å; I230-F234 PolarHBondContact O-N 2.88Å; I230-I265 HydrophobicContact CG1-CD1 3.95Å; I230-V273 HydrophobicContact CD1-CG1 4.48Å |
| 231 | W | 83.9 | Confident | 82 | Confident | 145 Ų | 145 | 82.8 Ų | 82.8 | 55% | 0.549 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -60.6 | -43.9 | 176 | -178.5 | 83.2 | 0 | 0 | 0 | 112.5 | S227 F228 N233 F234 K235 | S227-W231 WeakPolarHBondContact O-CB 3.35Å; S227-W231 PolarHBondContact O-N 3.44Å; F228-W231 PolarHBondContact O-N 3.5Å; W231-N233 VanDerWaalsContact C-N 3.33Å; W231-N233 PolarHBondContact O-N 2.95Å; W231-F234 PolarHBondContact O-N 3.29Å; W231-K235 HydrophobicContact CH2-CD 3.86Å; W231-K235 HydrophobicContact CZ2-CD 4.01Å; W231-K235 HydrophobicContact CZ3-CD 4.23Å; W231-K235 WeakPolarHBondContact O-CB 3.34Å; W231-K235 PolarHBondContact O-N 2.84Å |
| 232 | Q | 82.4 | Confident | 80.5 | Confident | 76 Ų | 76 | 82.9 Ų | 82.9 | 36% | 0.355 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -58.7 | -43.3 | 175.1 | -171.4 | -179.5 | 15.8 | 0 | 0 | 111.7 | F228 I230 L236 | F228-Q232 WeakPolarHBondContact O-CB 3.33Å; F228-Q232 PolarHBondContact O-N 2.85Å; I230-Q232 PolarHBondContact O-N 3.46Å; Q232-L236 PolarHBondContact O-N 3.25Å; Q232-L236 VanDerWaalsContact O-N 3.07Å |
| 233 | N | 78.8 | Confident | 79 | Confident | 48 Ų | 48 | 86.3 Ų | 86.3 | 26% | 0.257 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -66.2 | -40.6 | 176.8 | -84.7 | -91.7 | 0 | 0 | 0 | 112.2 | K229 I230 W231 L236 K237 I265 | K229-N233 PolarHBondContact O-N 3.38Å; K229-N233 PolarHBondContact O-ND2 2.89Å; I230-N233 PolarHBondContact O-N 3Å; W231-N233 VanDerWaalsContact C-N 3.33Å; W231-N233 PolarHBondContact O-N 2.95Å; N233-L236 PolarHBondContact O-N 3.41Å; N233-K237 PolarHBondContact O-N 2.9Å; N233-I265 HydrophobicContact CB-CD1 4.43Å |
| 234 | F | 78.5 | Confident | 77.7 | Confident | 133 Ų | 133 | 90.7 Ų | 90.7 | 58% | 0.583 | 44% | 0.437 | S | S | * | . | H | α-helix | trans | -64.2 | -47.4 | 177.1 | -169.8 | -94.8 | 0 | 0 | 0 | 111.5 | I230 W231 L236 K237 T238 | I230-F234 PolarHBondContact O-N 2.88Å; W231-F234 PolarHBondContact O-N 3.29Å; F234-L236 VanDerWaalsContact C-N 3.31Å; F234-L236 PolarHBondContact O-N 2.84Å; F234-K237 WeakPolarHBondContact O-CB 3.41Å; F234-K237 PolarHBondContact O-N 3.36Å; F234-T238 PolarHBondContact O-N 3.49Å; F234-T238 PolarHBondContact O-OG1 3.49Å |
| 235 | K | 78.3 | Confident | 76.3 | Confident | 100 Ų | 100 | 93.2 Ų | 93.2 | 44% | 0.435 | 45% | 0.447 | S | S | . | . | H | α-helix | trans | -60 | -38.1 | 176.8 | -171.8 | 173.4 | -178.1 | 175.4 | 0 | 112.7 | W231 R239 | W231-K235 HydrophobicContact CH2-CD 3.86Å; W231-K235 HydrophobicContact CZ2-CD 4.01Å; W231-K235 HydrophobicContact CZ3-CD 4.23Å; W231-K235 WeakPolarHBondContact O-CB 3.34Å; W231-K235 PolarHBondContact O-N 2.84Å; K235-R239 PolarHBondContact O-N 3.29Å |
| 236 | L | 75.3 | Confident | 74.7 | Confident | 91 Ų | 91 | 96.8 Ų | 96.8 | 48% | 0.476 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -65.4 | -41.9 | 172.7 | -115.5 | 81.7 | 0 | 0 | 0 | 112.2 | Q232 N233 F234 R239 R240 V262 | Q232-L236 PolarHBondContact O-N 3.25Å; Q232-L236 VanDerWaalsContact O-N 3.07Å; N233-L236 PolarHBondContact O-N 3.41Å; F234-L236 VanDerWaalsContact C-N 3.31Å; F234-L236 PolarHBondContact O-N 2.84Å; L236-R239 PolarHBondContact O-N 3.43Å; L236-R240 PolarHBondContact O-N 2.9Å; L236-R240 VanDerWaalsContact O-N 3.09Å; L236-V262 HydrophobicContact CD2-CG1 4.39Å; L236-V262 HydrophobicContact CD2-CG2 3.96Å |
| 237 | K | 72.6 | Confident | 73.1 | Confident | 93 Ų | 93 | 101 Ų | 101 | 40% | 0.404 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -60.4 | -51.6 | 178.3 | -174.5 | -171.3 | 164 | -170.6 | 0 | 111 | N233 F234 R239 R240 E241 | N233-K237 PolarHBondContact O-N 2.9Å; F234-K237 WeakPolarHBondContact O-CB 3.41Å; F234-K237 PolarHBondContact O-N 3.36Å; K237-R239 VanDerWaalsContact C-N 3.34Å; K237-R239 PolarHBondContact O-N 3.18Å; K237-R240 PolarHBondContact O-N 3.46Å; K237-R240 VanDerWaalsContact O-N 3.11Å; K237-E241 VanDerWaalsContact CE-CD 3.43Å; K237-E241 WeakPolarHBondContact CE-OE1 3.31Å; K237-E241 WeakPolarHBondContact CE-OE2 3.28Å; K237-E241 IonicContact NZ-OE1 2.75Å; K237-E241 PolarHBondContact NZ-OE1 3.46Å; K237-E241 PolarHBondContact O-N 3.01Å |
| 238 | T | 73.1 | Confident | 71.2 | Confident | 48 Ų | 48 | 103.2 Ų | 103.2 | 29% | 0.294 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -58.2 | -43.3 | 179.3 | -52.1 | 0 | 0 | 0 | 0 | 112.2 | F234 R240 E241 Q242 | F234-T238 PolarHBondContact O-N 3.49Å; F234-T238 PolarHBondContact O-OG1 3.49Å; T238-R240 VanDerWaalsContact C-N 3.34Å; T238-R240 PolarHBondContact O-N 2.95Å; T238-E241 PolarHBondContact O-N 3.36Å; T238-Q242 WeakPolarHBondContact O-CG 3.37Å; T238-Q242 PolarHBondContact O-N 3.18Å |
| 239 | R | 70.3 | Confident | 69.6 | Low | 176 Ų | 176 | 108 Ų | 108 | 66% | 0.664 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -65 | -34.6 | 176.9 | -76.9 | -166 | 174.8 | -121.8 | -1.2 | 113.3 | K235 L236 K237 C243 | K235-R239 PolarHBondContact O-N 3.29Å; L236-R239 PolarHBondContact O-N 3.43Å; K237-R239 VanDerWaalsContact C-N 3.34Å; K237-R239 PolarHBondContact O-N 3.18Å; R239-C243 WeakPolarHBondContact O-CB 3.44Å; R239-C243 PolarHBondContact O-N 3.16Å |
| 240 | R | 66.3 | Low | 67.8 | Low | 154 Ų | 154 | 110.7 Ų | 110.7 | 58% | 0.581 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -68.2 | -43 | 174.5 | -176.3 | 177.7 | 177.1 | 174.5 | 0.8 | 111.7 | L236 K237 T238 C243 I244 | L236-R240 PolarHBondContact O-N 2.9Å; L236-R240 VanDerWaalsContact O-N 3.09Å; K237-R240 PolarHBondContact O-N 3.46Å; K237-R240 VanDerWaalsContact O-N 3.11Å; T238-R240 VanDerWaalsContact C-N 3.34Å; T238-R240 PolarHBondContact O-N 2.95Å; R240-C243 PolarHBondContact O-N 3.32Å; R240-I244 HydrophobicContact CG-CD1 3.91Å; R240-I244 WeakPolarHBondContact O-CG1 3.43Å; R240-I244 PolarHBondContact O-N 3.19Å |
| 241 | E | 66.6 | Low | 65.7 | Low | 102 Ų | 102 | 113.9 Ų | 113.9 | 48% | 0.477 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -63.1 | -42.3 | 178 | -71.7 | 171.8 | 157.6 | 0 | 0 | 111.2 | K237 T238 I244 S245 | K237-E241 VanDerWaalsContact CE-CD 3.43Å; K237-E241 WeakPolarHBondContact CE-OE1 3.31Å; K237-E241 WeakPolarHBondContact CE-OE2 3.28Å; K237-E241 IonicContact NZ-OE1 2.75Å; K237-E241 PolarHBondContact NZ-OE1 3.46Å; K237-E241 PolarHBondContact O-N 3.01Å; T238-E241 PolarHBondContact O-N 3.36Å; E241-I244 PolarHBondContact O-N 3.14Å; E241-S245 PolarHBondContact O-N 3.24Å |
| 242 | Q | 64.1 | Low | 64.1 | Low | 109 Ų | 109 | 117.5 Ų | 117.5 | 51% | 0.509 | 59% | 0.591 | S | S | . | * | H | α-helix | trans | -60.6 | -47.4 | 172.6 | -74 | 175.2 | -34.2 | 0 | 0 | 112.6 | T238 I244 S245 M246 | T238-Q242 WeakPolarHBondContact O-CG 3.37Å; T238-Q242 PolarHBondContact O-N 3.18Å; Q242-I244 VanDerWaalsContact C-N 3.33Å; Q242-I244 PolarHBondContact O-N 2.92Å; Q242-S245 WeakPolarHBondContact CA-OG 3.32Å; Q242-S245 PolarHBondContact O-N 2.89Å; Q242-S245 VanDerWaalsContact O-N 3.11Å; Q242-S245 PolarHBondContact O-OG 3.37Å; Q242-M246 PolarHBondContact O-N 3.49Å; Q242-M246 VanDerWaalsContact O-N 3.1Å |
| 243 | C | 60.6 | Low | 62.2 | Low | 82 Ų | 82 | 117.4 Ų | 117.4 | 55% | 0.554 | 60% | 0.599 | S | S | * | * | H | α-helix | trans | -64.4 | -35.1 | -179.4 | -168.5 | 0 | 0 | 0 | 0 | 113 | R239 R240 M246 T247 | R239-C243 WeakPolarHBondContact O-CB 3.44Å; R239-C243 PolarHBondContact O-N 3.16Å; R240-C243 PolarHBondContact O-N 3.32Å; C243-M246 PolarHBondContact O-N 3.47Å; C243-T247 PolarHBondContact O-OG1 2.98Å; C243-T247 VanDerWaalsContact O-OG1 3.05Å |
| 244 | I | 64.9 | Low | 60.6 | Low | 105 Ų | 105 | 123 Ų | 123 | 54% | 0.538 | 63% | 0.629 | S | S | . | * | H | α-helix | trans | -68.5 | -38 | 172.3 | -67.5 | 168.2 | 0 | 0 | 0 | 111.2 | R240 E241 Q242 M246 T247 | R240-I244 HydrophobicContact CG-CD1 3.91Å; R240-I244 WeakPolarHBondContact O-CG1 3.43Å; R240-I244 PolarHBondContact O-N 3.19Å; E241-I244 PolarHBondContact O-N 3.14Å; Q242-I244 VanDerWaalsContact C-N 3.33Å; Q242-I244 PolarHBondContact O-N 2.92Å; I244-M246 VanDerWaalsContact C-N 3.26Å; I244-M246 PolarHBondContact O-N 3.2Å; I244-T247 PolarHBondContact O-N 3.37Å; I244-T247 PolarHBondContact O-OG1 3.1Å |
| 245 | S | 61.1 | Low | 59 | Low | 96 Ų | 96 | 121.9 Ų | 121.9 | 67% | 0.671 | 63% | 0.633 | S | S | * | * | H | α-helix | trans | -69.6 | -21.1 | 177.3 | 68.9 | 0 | 0 | 0 | 0 | 114.3 | E241 Q242 | E241-S245 PolarHBondContact O-N 3.24Å; Q242-S245 WeakPolarHBondContact CA-OG 3.32Å; Q242-S245 PolarHBondContact O-N 2.89Å; Q242-S245 VanDerWaalsContact O-N 3.11Å; Q242-S245 PolarHBondContact O-OG 3.37Å |
| 246 | M | 58.4 | Low | 57.4 | Low | 161 Ų | 161 | 123.9 Ų | 123.9 | 79% | 0.793 | 65% | 0.648 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -94.5 | -0.5 | -179.6 | -74.1 | 179.7 | 146.6 | 0 | 0 | 114.3 | Q242 C243 I244 | Q242-M246 PolarHBondContact O-N 3.49Å; Q242-M246 VanDerWaalsContact O-N 3.1Å; C243-M246 PolarHBondContact O-N 3.47Å; I244-M246 VanDerWaalsContact C-N 3.26Å; I244-M246 PolarHBondContact O-N 3.2Å |
| 247 | T | 55.3 | Low | 55.9 | Low | 91 Ų | 91 | 123.4 Ų | 123.4 | 56% | 0.558 | 66% | 0.656 | S | S | * | * | S | Bend | trans | -103.5 | 120.7 | 178.3 | 30.7 | 0 | 0 | 0 | 0 | 110.8 | C243 I244 | C243-T247 PolarHBondContact O-OG1 2.98Å; C243-T247 VanDerWaalsContact O-OG1 3.05Å; I244-T247 PolarHBondContact O-N 3.37Å; I244-T247 PolarHBondContact O-OG1 3.1Å |
| 248 | P | 48.3 | Very low | 54.5 | Low | 115 Ų | 115 | 129.4 Ų | 129.4 | 75% | 0.747 | 68% | 0.677 | S | S | * | * | trans | -60 | 155.8 | 176.2 | -23.9 | 34.3 | 0 | 0 | 0 | 112.4 | T250 | P248-T250 PolarHBondContact O-N 2.03Š| ||
| 249 | K | 52.7 | Low | 52.9 | Low | 217 Ų | 217 | 133.3 Ų | 133.3 | 94% | 0.943 | 70% | 0.7 | S | S | * | * | S | Bend | trans | -68.8 | 57.8 | -173.9 | -65.8 | 179.5 | 177.5 | 173.6 | 0 | 114.6 | ||
| 250 | T | 48.4 | Very low | 51.7 | Low | 123 Ų | 123 | 129.6 Ų | 129.6 | 76% | 0.755 | 70% | 0.701 | S | S | * | * | trans | -149.8 | 82.9 | 177.8 | -8.9 | 0 | 0 | 0 | 0 | 112.4 | P248 | P248-T250 PolarHBondContact O-N 2.03Š| ||
| 251 | C | 40.9 | Very low | 50.6 | Low | 127 Ų | 127 | 126.6 Ų | 126.6 | 86% | 0.858 | 70% | 0.704 | S | S | * | * | trans | -167.2 | 119.1 | 146 | -104.3 | 0 | 0 | 0 | 0 | 111.8 | S253 | C251-S253 PolarHBondContact O-N 3.18Å; C251-S253 VanDerWaalsContact O-N 3.11Å | ||
| 252 | K | 48.9 | Very low | 50 | Low | 221 Ų | 221 | 125.4 Ų | 125.4 | 96% | 0.961 | 70% | 0.703 | S | S | * | * | trans | -73.1 | 93.6 | 164.8 | -69.3 | 178.2 | 179.5 | 176 | 0 | 108.8 | ||||
| 253 | S | 43 | Very low | 49.7 | Very low | 73 Ų | 73 | 127.8 Ų | 127.8 | 51% | 0.51 | 71% | 0.708 | S | S | . | * | trans | -136.1 | 84.6 | 170.6 | -169.9 | 0 | 0 | 0 | 0 | 111.5 | C251 T255 | C251-S253 PolarHBondContact O-N 3.18Å; C251-S253 VanDerWaalsContact O-N 3.11Å; S253-T255 PolarHBondContact O-N 2.8Å | ||
| 254 | N | 45.9 | Very low | 49.7 | Very low | 167 Ų | 167 | 130.3 Ų | 130.3 | 89% | 0.893 | 72% | 0.715 | S | S | * | * | trans | -79.2 | 8.6 | 176.1 | -90.4 | -7.8 | 0 | 0 | 0 | 113.5 | ||||
| 255 | T | 44.3 | Very low | 49.7 | Very low | 109 Ų | 109 | 126.9 Ų | 126.9 | 67% | 0.669 | 70% | 0.697 | S | S | * | * | S | Bend | trans | -117.8 | -24.1 | -159.2 | -24.2 | 0 | 0 | 0 | 0 | 115.6 | S253 | S253-T255 PolarHBondContact O-N 2.8Š|
| 256 | L | 43.8 | Very low | 50.1 | Low | 142 Ų | 142 | 125 Ų | 125 | 74% | 0.743 | 68% | 0.684 | S | S | * | * | S | Bend | trans | -102.3 | -14.1 | -178.7 | -99.2 | 83.7 | 0 | 0 | 0 | 116.3 | R258 | L256-R258 PolarHBondContact O-N 3.27Š|
| 257 | A | 44.6 | Very low | 50.7 | Low | 80 Ų | 80 | 126.2 Ų | 126.2 | 66% | 0.661 | 69% | 0.685 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -70.1 | 4.6 | 179.8 | 0 | 0 | 0 | 0 | 0 | 114.8 | ||
| 258 | R | 43.9 | Very low | 51.3 | Low | 219 Ų | 219 | 125.1 Ų | 125.1 | 83% | 0.826 | 69% | 0.686 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -98.7 | -15.4 | -166.3 | -148.3 | 172.7 | -167 | 148.1 | 1.1 | 114.8 | L256 | L256-R258 PolarHBondContact O-N 3.27Š|
| 259 | V | 39.1 | Very low | 52.6 | Low | 131 Ų | 131 | 123.5 Ų | 123.5 | 79% | 0.794 | 67% | 0.667 | S | S | * | * | S | Bend | trans | -100.6 | -23.7 | -162.9 | -171.6 | 0 | 0 | 0 | 0 | 114.5 | ||
| 260 | S | 43.8 | Very low | 53.7 | Low | 98 Ų | 98 | 116.5 Ų | 116.5 | 69% | 0.685 | 64% | 0.639 | S | S | * | * | trans | -101.9 | 74.8 | 170 | 55.4 | 0 | 0 | 0 | 0 | 111.3 | V262 | S260-V262 PolarHBondContact O-N 3.5Š| ||
| 261 | S | 45 | Very low | 55.2 | Low | 90 Ų | 90 | 113.5 Ų | 113.5 | 63% | 0.629 | 62% | 0.621 | S | S | * | * | trans | -69.9 | 76.8 | 174.2 | 66.9 | 0 | 0 | 0 | 0 | 111.9 | R263 | S261-R263 PolarHBondContact O-N 3.06Š| ||
| 262 | V | 52.3 | Low | 57 | Low | 77 Ų | 77 | 108.9 Ų | 108.9 | 47% | 0.467 | 59% | 0.589 | S | S | . | * | trans | -63.8 | 83.7 | 157.8 | -176.6 | 0 | 0 | 0 | 0 | 106.1 | L236 S260 L264 | L236-V262 HydrophobicContact CD2-CG1 4.39Å; L236-V262 HydrophobicContact CD2-CG2 3.96Å; S260-V262 PolarHBondContact O-N 3.5Å; V262-L264 PolarHBondContact O-N 3.33Å | ||
| 263 | R | 57.8 | Low | 58.6 | Low | 160 Ų | 160 | 99.1 Ų | 99.1 | 60% | 0.604 | 55% | 0.547 | S | S | * | . | trans | -60 | 100.5 | -178.1 | -79.4 | -179.8 | 170.5 | 171.4 | -3.9 | 107.9 | P147 S261 I265 | P147-R263 PolarHBondContact O-NH1 3.15Å; S261-R263 PolarHBondContact O-N 3.06Å; R263-I265 PolarHBondContact O-N 3.42Å | ||
| 264 | L | 60.6 | Low | 60.6 | Low | 134 Ų | 134 | 101.5 Ų | 101.5 | 70% | 0.702 | 55% | 0.548 | S | S | * | . | trans | -47.4 | 126 | 177 | -149.8 | 88 | 0 | 0 | 0 | 108.7 | V262 S266 | V262-L264 PolarHBondContact O-N 3.33Å; L264-S266 PolarHBondContact O-N 2.98Å | ||
| 265 | I | 66.3 | Low | 62.5 | Low | 33 Ų | 33 | 93.8 Ų | 93.8 | 17% | 0.169 | 51% | 0.507 | C | S | . | . | trans | -64.1 | 110.8 | -179.6 | -56.1 | 176.8 | 0 | 0 | 0 | 107.1 | I144 I230 N233 R263 K269 I270 | I144-I265 HydrophobicContact CG2-CD1 4.26Å; I230-I265 HydrophobicContact CG1-CD1 3.95Å; N233-I265 HydrophobicContact CB-CD1 4.43Å; R263-I265 PolarHBondContact O-N 3.42Å; I265-K269 HydrophobicContact CG2-CB 3.82Å; I265-K269 HydrophobicContact CG2-CD 4.34Å; I265-I270 HydrophobicContact CG2-CD1 4.42Å; I265-I270 HydrophobicContact CG2-CG1 3.79Å | ||
| 266 | S | 69 | Low | 64.5 | Low | 58 Ų | 58 | 88.6 Ų | 88.6 | 41% | 0.406 | 48% | 0.475 | S | S | . | . | trans | -62 | 147.6 | -175.1 | 61.4 | 0 | 0 | 0 | 0 | 111.2 | L264 A268 K269 I270 | L264-S266 PolarHBondContact O-N 2.98Å; S266-A268 PolarHBondContact O-N 3.44Å; S266-A268 VanDerWaalsContact O-N 3.12Å; S266-K269 WeakPolarHBondContact O-CB 3.26Å; S266-K269 PolarHBondContact O-N 2.9Å; S266-I270 PolarHBondContact O-N 3.24Å | ||
| 267 | K | 70.4 | Confident | 66.7 | Low | 185 Ų | 185 | 86.7 Ų | 86.7 | 80% | 0.804 | 46% | 0.461 | S | S | * | . | H | α-helix | trans | -49.2 | -42.5 | 177.7 | -70.4 | -174.1 | 175.9 | -177.6 | 0 | 111.8 | K269 I270 T271 | K267-K269 PolarHBondContact O-N 3.48Å; K267-I270 PolarHBondContact O-N 2.95Å; K267-I270 VanDerWaalsContact O-N 3.1Å; K267-T271 PolarHBondContact O-N 2.88Å; K267-T271 PolarHBondContact O-OG1 3.26Å |
| 268 | A | 68.6 | Low | 68.9 | Low | 69 Ų | 69 | 85.5 Ų | 85.5 | 57% | 0.57 | 45% | 0.446 | S | S | * | . | H | α-helix | trans | -57 | -42.2 | 176.3 | 0 | 0 | 0 | 0 | 0 | 113.8 | S266 T271 T272 | S266-A268 PolarHBondContact O-N 3.44Å; S266-A268 VanDerWaalsContact O-N 3.12Å; A268-T271 PolarHBondContact O-N 3.35Å; A268-T272 PolarHBondContact O-N 3.08Å; A268-T272 PolarHBondContact O-OG1 2.98Å |
| 269 | K | 74.4 | Confident | 71 | Confident | 80 Ų | 80 | 75.1 Ų | 75.1 | 35% | 0.348 | 41% | 0.406 | S | S | . | . | H | α-helix | trans | -64 | -41.8 | 174.7 | -75.9 | -173.2 | 175.4 | -162 | 0 | 111.5 | A143 I265 S266 K267 T272 V273 | A143-K269 PolarHBondContact O-NZ 3.38Å; I265-K269 HydrophobicContact CG2-CB 3.82Å; I265-K269 HydrophobicContact CG2-CD 4.34Å; S266-K269 WeakPolarHBondContact O-CB 3.26Å; S266-K269 PolarHBondContact O-N 2.9Å; K267-K269 PolarHBondContact O-N 3.48Å; K269-T272 PolarHBondContact O-N 3.46Å; K269-V273 WeakPolarHBondContact O-CG2 3.44Å; K269-V273 PolarHBondContact O-N 2.75Å |
| 270 | I | 77.3 | Confident | 73.5 | Confident | 70 Ų | 70 | 69.2 Ų | 69.2 | 36% | 0.359 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -64.1 | -44.4 | 178.6 | -60.3 | 175.2 | 0 | 0 | 0 | 110.8 | I265 S266 K267 T272 V273 K274 | I265-I270 HydrophobicContact CG2-CD1 4.42Å; I265-I270 HydrophobicContact CG2-CG1 3.79Å; S266-I270 PolarHBondContact O-N 3.24Å; K267-I270 PolarHBondContact O-N 2.95Å; K267-I270 VanDerWaalsContact O-N 3.1Å; I270-T272 VanDerWaalsContact C-N 3.25Å; I270-T272 PolarHBondContact O-N 3.21Å; I270-V273 PolarHBondContact O-N 2.87Å; I270-V273 VanDerWaalsContact O-N 3.13Å; I270-K274 HydrophobicContact CG2-CD 4.4Å; I270-K274 HydrophobicContact CG2-CG 4.44Å; I270-K274 WeakPolarHBondContact O-CG 3.47Å; I270-K274 PolarHBondContact O-N 3.04Å |
| 271 | T | 79.3 | Confident | 75.7 | Confident | 61 Ų | 61 | 67.7 Ų | 67.7 | 37% | 0.374 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -54.9 | -43.8 | 174.6 | -55.4 | 0 | 0 | 0 | 0 | 111.1 | K267 A268 K274 M275 F331 | K267-T271 PolarHBondContact O-N 2.88Å; K267-T271 PolarHBondContact O-OG1 3.26Å; A268-T271 PolarHBondContact O-N 3.35Å; T271-K274 PolarHBondContact O-N 3.3Å; T271-M275 PolarHBondContact O-N 2.9Å; T271-F331 HydrophobicContact CG2-CD1 4.11Å |
| 272 | T | 78.6 | Confident | 78 | Confident | 30 Ų | 30 | 64.3 Ų | 64.3 | 18% | 0.184 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -69.4 | -34.9 | 178.8 | -32.7 | 0 | 0 | 0 | 0 | 113.2 | M77 R140 A268 K269 I270 M275 T276 | M77-T272 HydrophobicContact CG-CG2 4Å; M77-T272 HydrophobicContact SD-CG2 3.22Å; M77-T272 WeakPolarHBondContact SD-CG2 3.43Å; R140-T272 VanDerWaalsContact NH1-CG2 3.31Å; A268-T272 PolarHBondContact O-N 3.08Å; A268-T272 PolarHBondContact O-OG1 2.98Å; K269-T272 PolarHBondContact O-N 3.46Å; I270-T272 VanDerWaalsContact C-N 3.25Å; I270-T272 PolarHBondContact O-N 3.21Å; T272-M275 PolarHBondContact O-N 2.73Å; T272-T276 WeakPolarHBondContact O-CG2 3.3Å; T272-T276 PolarHBondContact O-N 3.35Å; T272-T276 PolarHBondContact O-OG1 3.48Å |
| 273 | V | 83 | Confident | 79.8 | Confident | 15 Ų | 15 | 60.6 Ų | 60.6 | 9% | 0.091 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -63.2 | -45.6 | 172.5 | 172.1 | 0 | 0 | 0 | 0 | 111.3 | I144 I226 I230 K269 I270 M275 T276 F277 | I144-V273 HydrophobicContact CD1-CG2 3.17Å; I144-V273 HydrophobicContact CG1-CG2 4.46Å; I226-V273 HydrophobicContact CG2-CG1 3.78Å; I226-V273 HydrophobicContact CG2-CG2 4.33Å; I230-V273 HydrophobicContact CD1-CG1 4.48Å; K269-V273 WeakPolarHBondContact O-CG2 3.44Å; K269-V273 PolarHBondContact O-N 2.75Å; I270-V273 PolarHBondContact O-N 2.87Å; I270-V273 VanDerWaalsContact O-N 3.13Å; V273-M275 VanDerWaalsContact C-N 3.3Å; V273-M275 PolarHBondContact O-N 3.34Å; V273-T276 PolarHBondContact O-N 3.44Å; V273-T276 PolarHBondContact O-OG1 3.13Å; V273-F277 VanDerWaalsContact O-CB 3.23Å; V273-F277 WeakPolarHBondContact O-CB 3.4Å; V273-F277 PolarHBondContact O-N 2.62Å |
| 274 | K | 85.4 | Confident | 81.5 | Confident | 124 Ų | 124 | 55.3 Ų | 55.3 | 54% | 0.539 | 30% | 0.295 | S | S | . | . | H | α-helix | trans | -59.6 | -44.1 | 177.3 | -69.6 | -176.1 | 68 | 177.7 | 0 | 110.7 | I270 T271 F277 V278 F331 | I270-K274 HydrophobicContact CG2-CD 4.4Å; I270-K274 HydrophobicContact CG2-CG 4.44Å; I270-K274 WeakPolarHBondContact O-CG 3.47Å; I270-K274 PolarHBondContact O-N 3.04Å; T271-K274 PolarHBondContact O-N 3.3Å; K274-F277 PolarHBondContact O-N 3.01Å; K274-V278 WeakPolarHBondContact O-CG2 3.26Å; K274-V278 PolarHBondContact O-N 3.17Å; K274-F331 HydrophobicContact CB-CD1 4.34Å; K274-F331 HydrophobicContact CB-CE1 3.58Å; K274-F331 HydrophobicContact CB-CZ 4.18Å |
| 275 | M | 85.5 | Confident | 82.9 | Confident | 4 Ų | 4 | 53.2 Ų | 53.2 | 2% | 0.02 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -58.7 | -52.9 | 175.8 | -171 | -163 | 86.4 | 0 | 0 | 112.1 | M77 M81 T271 T272 V273 F277 V278 I279 I327 Y328 F331 | M77-M275 HydrophobicContact SD-CE 4.16Å; M81-M275 HydrophobicContact CE-CE 3.59Å; M81-M275 HydrophobicContact CE-SD 3.45Å; M81-M275 WeakPolarHBondContact CE-SD 3.47Å; T271-M275 PolarHBondContact O-N 2.9Å; T272-M275 PolarHBondContact O-N 2.73Å; V273-M275 VanDerWaalsContact C-N 3.3Å; V273-M275 PolarHBondContact O-N 3.34Å; M275-F277 VanDerWaalsContact C-N 3.33Å; M275-F277 PolarHBondContact O-N 2.98Å; M275-V278 PolarHBondContact O-N 3.4Å; M275-I279 HydrophobicContact CE-CD1 3.98Å; M275-I279 HydrophobicContact CG-CD1 4.41Å; M275-I279 WeakPolarHBondContact O-CG1 3.11Å; M275-I279 PolarHBondContact O-N 3.49Å; M275-I279 VanDerWaalsContact O-N 3.09Å; M275-I327 HydrophobicContact CG-CG2 3.83Å; M275-Y328 HydrophobicContact CE-CD1 3.92Å; M275-Y328 HydrophobicContact CE-CE1 3.72Å; M275-Y328 HydrophobicContact CG-CD1 4.48Å; M275-Y328 HydrophobicContact SD-CD1 3.7Å; M275-Y328 HydrophobicContact SD-CE1 4.15Å; M275-F331 HydrophobicContact CB-CB 3.67Å; M275-F331 HydrophobicContact CB-CD1 4Å; M275-F331 HydrophobicContact CB-CD2 3.96Å; M275-F331 HydrophobicContact CB-CG 3.61Å; M275-F331 HydrophobicContact CG-CB 3.58Å; M275-F331 HydrophobicContact CG-CD2 3.91Å; M275-F331 HydrophobicContact CG-CG 3.82Å; M275-F331 HydrophobicContact SD-CB 4.11Å |
| 276 | T | 85.8 | Confident | 84.1 | Confident | 0 Ų | 0 | 52 Ų | 52 | 0% | 0 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -70.9 | -29.4 | -177.1 | 63.7 | 0 | 0 | 0 | 0 | 112.5 | M136 R140 Y223 T272 V273 I279 V280 | M136-T276 HydrophobicContact CE-CG2 3.94Å; M136-T276 HydrophobicContact CG-CG2 3.91Å; M136-T276 HydrophobicContact SD-CG2 3.75Å; R140-T276 HydrophobicContact CG-CG2 3.87Å; Y223-T276 VanDerWaalsContact OH-C 3.25Å; Y223-T276 WeakPolarHBondContact OH-CB 3.32Å; Y223-T276 PolarHBondContact OH-O 2.89Å; Y223-T276 PolarHBondContact OH-OG1 2.87Å; T272-T276 WeakPolarHBondContact O-CG2 3.3Å; T272-T276 PolarHBondContact O-N 3.35Å; T272-T276 PolarHBondContact O-OG1 3.48Å; V273-T276 PolarHBondContact O-N 3.44Å; V273-T276 PolarHBondContact O-OG1 3.13Å; T276-I279 PolarHBondContact O-N 3.46Å; T276-V280 WeakPolarHBondContact O-CG2 3.43Å; T276-V280 PolarHBondContact O-N 2.88Å |
| 277 | F | 89.3 | Confident | 85.1 | Confident | 102 Ų | 102 | 49.5 Ų | 49.5 | 45% | 0.447 | 26% | 0.264 | S | S | . | . | H | α-helix | trans | -62.6 | -44.8 | 170 | 177.9 | -97.9 | 0 | 0 | 0 | 111.9 | Y223 V273 K274 M275 I279 V280 V281 | Y223-F277 HydrophobicContact CD1-CB 4.06Å; Y223-F277 AromaticContact CD1-CD2 3.79Å; Y223-F277 HydrophobicContact CD1-CD2 3.79Å; Y223-F277 HydrophobicContact CD1-CG 4.43Å; Y223-F277 HydrophobicContact CE1-CB 3.81Å; Y223-F277 HydrophobicContact CE1-CD2 4.35Å; Y223-F277 HydrophobicContact CG-CD2 4.17Å; V273-F277 VanDerWaalsContact O-CB 3.23Å; V273-F277 WeakPolarHBondContact O-CB 3.4Å; V273-F277 PolarHBondContact O-N 2.62Å; K274-F277 PolarHBondContact O-N 3.01Å; M275-F277 VanDerWaalsContact C-N 3.33Å; M275-F277 PolarHBondContact O-N 2.98Å; F277-I279 VanDerWaalsContact C-N 3.3Å; F277-I279 PolarHBondContact O-N 2.72Å; F277-V280 PolarHBondContact O-N 3.06Å; F277-V280 VanDerWaalsContact O-N 3.14Å; F277-V281 HydrophobicContact CD1-CG2 4.25Å; F277-V281 HydrophobicContact CE1-CG2 3.8Å; F277-V281 HydrophobicContact CE2-CG2 4.33Å; F277-V281 HydrophobicContact CZ-CG2 3.85Å; F277-V281 WeakPolarHBondContact O-CG2 3.38Å; F277-V281 PolarHBondContact O-N 3.01Å |
| 278 | V | 90.6 | Very high | 86.1 | Confident | 56 Ų | 56 | 42.7 Ų | 42.7 | 34% | 0.339 | 24% | 0.238 | S | C | . | . | H | α-helix | trans | -61.6 | -39.1 | 175.4 | 171.8 | 0 | 0 | 0 | 0 | 111.3 | K274 M275 V280 V281 A282 I327 F331 | K274-V278 WeakPolarHBondContact O-CG2 3.26Å; K274-V278 PolarHBondContact O-N 3.17Å; M275-V278 PolarHBondContact O-N 3.4Å; V278-V280 VanDerWaalsContact C-N 3.34Å; V278-V280 PolarHBondContact O-N 3.32Å; V278-V281 PolarHBondContact O-N 3.32Å; V278-A282 WeakPolarHBondContact O-CB 3.14Å; V278-A282 PolarHBondContact O-N 2.97Å; V278-I327 HydrophobicContact CB-CG2 4.3Å; V278-I327 HydrophobicContact CG1-CD1 3.97Å; V278-I327 HydrophobicContact CG1-CG1 3.95Å; V278-I327 HydrophobicContact CG1-CG2 4.04Å; V278-F331 HydrophobicContact CB-CE2 4.33Å; V278-F331 HydrophobicContact CG2-CE2 4.05Å; V278-F331 HydrophobicContact CG2-CZ 4.03Å |
| 279 | I | 89.5 | Confident | 87.1 | Confident | 0 Ų | 0 | 41 Ų | 41 | 0% | 0 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -61.6 | -40.6 | 173.9 | -65.7 | 169.1 | 0 | 0 | 0 | 111.5 | L133 M136 M275 T276 F277 A282 Y283 I327 Y328 | L133-I279 HydrophobicContact CD1-CG2 3.66Å; L133-I279 HydrophobicContact CG-CG2 3.93Å; M136-I279 HydrophobicContact CE-CB 4.49Å; M136-I279 HydrophobicContact CE-CD1 3.85Å; M136-I279 HydrophobicContact CE-CG2 4.09Å; M275-I279 HydrophobicContact CE-CD1 3.98Å; M275-I279 HydrophobicContact CG-CD1 4.41Å; M275-I279 WeakPolarHBondContact O-CG1 3.11Å; M275-I279 PolarHBondContact O-N 3.49Å; M275-I279 VanDerWaalsContact O-N 3.09Å; T276-I279 PolarHBondContact O-N 3.46Å; F277-I279 VanDerWaalsContact C-N 3.3Å; F277-I279 PolarHBondContact O-N 2.72Å; I279-A282 PolarHBondContact O-N 3.4Å; I279-Y283 WeakPolarHBondContact O-CB 3.35Å; I279-Y283 PolarHBondContact O-N 3.33Å; I279-I327 HydrophobicContact CD1-CG2 4.31Å; I279-I327 HydrophobicContact CG1-CB 4.29Å; I279-I327 HydrophobicContact CG1-CD1 3.77Å; I279-I327 HydrophobicContact CG1-CG2 3.84Å; I279-Y328 HydrophobicContact CD1-CD1 4.32Å; I279-Y328 HydrophobicContact CD1-CE1 3.55Å |
| 280 | V | 90.3 | Very high | 87.7 | Confident | 8 Ų | 8 | 38.6 Ų | 38.6 | 5% | 0.048 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -66.8 | -40.9 | 175.9 | 168.3 | 0 | 0 | 0 | 0 | 112.8 | L133 L219 Y223 T276 F277 V278 Y283 I284 | L133-V280 HydrophobicContact CD2-CG2 3.88Å; L219-V280 HydrophobicContact CB-CG1 4.05Å; L219-V280 HydrophobicContact CB-CG2 4.38Å; L219-V280 HydrophobicContact CD1-CG1 4.11Å; L219-V280 HydrophobicContact CD1-CG2 4.02Å; L219-V280 HydrophobicContact CD2-CG2 3.79Å; L219-V280 HydrophobicContact CG-CG2 4.26Å; Y223-V280 HydrophobicContact CD2-CG1 4.45Å; Y223-V280 HydrophobicContact CD2-CG2 4.15Å; Y223-V280 HydrophobicContact CE2-CB 4.22Å; Y223-V280 HydrophobicContact CE2-CG2 3.42Å; Y223-V280 VanDerWaalsContact CE2-CG2 3.42Å; T276-V280 WeakPolarHBondContact O-CG2 3.43Å; T276-V280 PolarHBondContact O-N 2.88Å; F277-V280 PolarHBondContact O-N 3.06Å; F277-V280 VanDerWaalsContact O-N 3.14Å; V278-V280 VanDerWaalsContact C-N 3.34Å; V278-V280 PolarHBondContact O-N 3.32Å; V280-Y283 WeakPolarHBondContact O-CB 3.2Å; V280-Y283 PolarHBondContact O-N 3.15Å; V280-I284 HydrophobicContact CG1-CD1 3.88Å; V280-I284 WeakPolarHBondContact O-CG1 3.21Å; V280-I284 PolarHBondContact O-N 3.38Å |
| 281 | V | 91.5 | Very high | 88.3 | Confident | 65 Ų | 65 | 35.6 Ų | 35.6 | 39% | 0.394 | 20% | 0.195 | S | C | . | . | H | α-helix | trans | -64.4 | -44.9 | 176.1 | 174.1 | 0 | 0 | 0 | 0 | 110.2 | F277 V278 Y283 I284 V285 | F277-V281 HydrophobicContact CD1-CG2 4.25Å; F277-V281 HydrophobicContact CE1-CG2 3.8Å; F277-V281 HydrophobicContact CE2-CG2 4.33Å; F277-V281 HydrophobicContact CZ-CG2 3.85Å; F277-V281 WeakPolarHBondContact O-CG2 3.38Å; F277-V281 PolarHBondContact O-N 3.01Å; V278-V281 PolarHBondContact O-N 3.32Å; V281-Y283 VanDerWaalsContact C-N 3.33Å; V281-Y283 PolarHBondContact O-N 3.44Å; V281-I284 PolarHBondContact O-N 3.27Å; V281-V285 HydrophobicContact CG1-CG2 4.35Å; V281-V285 WeakPolarHBondContact O-CB 3.5Å; V281-V285 VanDerWaalsContact O-CG2 3.31Å; V281-V285 WeakPolarHBondContact O-CG2 3.31Å; V281-V285 PolarHBondContact O-N 2.84Å |
| 282 | A | 91.6 | Very high | 88.8 | Confident | 19 Ų | 19 | 36 Ų | 36 | 16% | 0.157 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -57.7 | -46 | 174.3 | 0 | 0 | 0 | 0 | 0 | 111.4 | V278 I279 I284 V285 C286 I327 | V278-A282 WeakPolarHBondContact O-CB 3.14Å; V278-A282 PolarHBondContact O-N 2.97Å; I279-A282 PolarHBondContact O-N 3.4Å; A282-I284 PolarHBondContact O-N 2.91Å; A282-V285 PolarHBondContact O-N 3.4Å; A282-C286 VanDerWaalsContact O-CB 3.27Å; A282-C286 WeakPolarHBondContact O-CB 3.43Å; A282-C286 PolarHBondContact O-N 3.24Å; A282-C286 PolarHBondContact O-SG 3.27Å; A282-I327 HydrophobicContact CB-CD1 4.27Å |
| 283 | Y | 91.9 | Very high | 89.1 | Confident | 0 Ų | 0 | 35.4 Ų | 35.4 | 0% | 0 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -56.1 | -52 | 175.9 | -176.6 | -92.9 | 0 | 0 | 0 | 112.6 | T130 L133 I211 Y212 V216 L219 I279 V280 V281 V285 C286 W287 N320 | T130-Y283 HydrophobicContact CG2-CE2 4.34Å; T130-Y283 VanDerWaalsContact CG2-OH 3.23Å; T130-Y283 WeakPolarHBondContact CG2-OH 3.42Å; T130-Y283 PolarHBondContact OG1-OH 3.11Å; T130-Y283 VanDerWaalsContact OG1-OH 3.12Å; L133-Y283 HydrophobicContact CD1-CD2 3.53Å; L133-Y283 HydrophobicContact CD1-CE2 4.36Å; L133-Y283 HydrophobicContact CD1-CG 3.8Å; I211-Y283 PolarHBondContact O-OH 3.47Å; Y212-Y283 HydrophobicContact CD2-CE1 4.5Å; V216-Y283 HydrophobicContact CG2-CD1 4.43Å; V216-Y283 HydrophobicContact CG2-CE1 4.21Å; L219-Y283 HydrophobicContact CD1-CD1 4.34Å; I279-Y283 WeakPolarHBondContact O-CB 3.35Å; I279-Y283 PolarHBondContact O-N 3.33Å; V280-Y283 WeakPolarHBondContact O-CB 3.2Å; V280-Y283 PolarHBondContact O-N 3.15Å; V281-Y283 VanDerWaalsContact C-N 3.33Å; V281-Y283 PolarHBondContact O-N 3.44Å; Y283-V285 PolarHBondContact O-N 3.44Å; Y283-C286 PolarHBondContact O-N 3.49Å; Y283-W287 AromaticContact CD2-CD1 3.33Å; Y283-W287 HydrophobicContact CD2-CG 4.47Å; Y283-W287 AromaticContact CD2-NE1 3.53Å; Y283-W287 AromaticContact CE2-CD1 3.2Å; Y283-W287 HydrophobicContact CE2-CG 4.1Å; Y283-W287 AromaticContact CE2-NE1 3.2Å; Y283-W287 AromaticContact CG-CD1 3.83Å; Y283-W287 AromaticContact CZ-CD1 3.58Å; Y283-W287 AromaticContact CZ-NE1 3.91Å; Y283-W287 WeakPolarHBondContact O-CB 3.48Å; Y283-W287 VanDerWaalsContact O-CD1 3.27Å; Y283-W287 PolarHBondContact O-N 2.93Å; Y283-N320 WeakPolarHBondContact CA-OD1 3.43Å; Y283-N320 WeakPolarHBondContact CD2-OD1 3.46Å |
| 284 | I | 92.4 | Very high | 89.2 | Confident | 48 Ų | 48 | 37.4 Ų | 37.4 | 25% | 0.246 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -60.8 | -48.7 | -179.9 | -67.3 | 165.7 | 0 | 0 | 0 | 110.1 | V216 V280 V281 A282 C286 W287 T288 | V216-I284 HydrophobicContact CG1-CD1 4.25Å; V216-I284 HydrophobicContact CG1-CG1 4.33Å; V216-I284 HydrophobicContact CG2-CG1 3.92Å; V280-I284 HydrophobicContact CG1-CD1 3.88Å; V280-I284 WeakPolarHBondContact O-CG1 3.21Å; V280-I284 PolarHBondContact O-N 3.38Å; V281-I284 PolarHBondContact O-N 3.27Å; A282-I284 PolarHBondContact O-N 2.91Å; I284-C286 PolarHBondContact O-N 2.87Å; I284-W287 PolarHBondContact O-N 2.89Å; I284-T288 VanDerWaalsContact O-CB 3.31Å; I284-T288 WeakPolarHBondContact O-CB 3.31Å; I284-T288 PolarHBondContact O-N 2.88Å; I284-T288 PolarHBondContact O-OG1 3.47Å |
| 285 | V | 91.2 | Very high | 89.4 | Confident | 90 Ų | 90 | 34.1 Ų | 34.1 | 55% | 0.545 | 19% | 0.192 | S | C | . | . | H | α-helix | trans | -62.8 | -39.3 | -178.7 | 172.4 | 0 | 0 | 0 | 0 | 112.3 | V281 A282 Y283 P289 | V281-V285 HydrophobicContact CG1-CG2 4.35Å; V281-V285 WeakPolarHBondContact O-CB 3.5Å; V281-V285 VanDerWaalsContact O-CG2 3.31Å; V281-V285 WeakPolarHBondContact O-CG2 3.31Å; V281-V285 PolarHBondContact O-N 2.84Å; A282-V285 PolarHBondContact O-N 3.4Å; Y283-V285 PolarHBondContact O-N 3.44Å; V285-P289 WeakPolarHBondContact O-CD 3.33Å |
| 286 | C | 90.1 | Very high | 89.5 | Confident | 8 Ų | 8 | 41 Ų | 41 | 5% | 0.054 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -72.3 | -40.6 | 179.1 | -68.1 | 0 | 0 | 0 | 0 | 112.7 | A282 Y283 I284 L316 A317 N320 | A282-C286 VanDerWaalsContact O-CB 3.27Å; A282-C286 WeakPolarHBondContact O-CB 3.43Å; A282-C286 PolarHBondContact O-N 3.24Å; A282-C286 PolarHBondContact O-SG 3.27Å; Y283-C286 PolarHBondContact O-N 3.49Å; I284-C286 PolarHBondContact O-N 2.87Å; C286-L316 WeakPolarHBondContact CB-O 3.36Å; C286-L316 CarbonylContact O-C 3.53Å; C286-A317 PolarHBondContact O-N 3.42Å; C286-N320 HydrophobicContact CB-CB 3.82Å |
| 287 | W | 90.7 | Very high | 89.4 | Confident | 5 Ų | 5 | 42.2 Ų | 42.2 | 2% | 0.019 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -92.4 | -24.9 | -172.3 | -74.8 | 104.5 | 0 | 0 | 0 | 115.2 | M126 Y212 Y283 I284 F290 F291 A317 N320 | M126-W287 HydrophobicContact CB-CH2 4.18Å; M126-W287 HydrophobicContact CG-CH2 3.85Å; M126-W287 HydrophobicContact SD-CH2 4.01Å; M126-W287 HydrophobicContact SD-CZ3 4.47Å; Y212-W287 HydrophobicContact CD2-CB 3.93Å; Y212-W287 HydrophobicContact CE2-CB 4.3Å; Y283-W287 AromaticContact CD2-CD1 3.33Å; Y283-W287 HydrophobicContact CD2-CG 4.47Å; Y283-W287 AromaticContact CD2-NE1 3.53Å; Y283-W287 AromaticContact CE2-CD1 3.2Å; Y283-W287 HydrophobicContact CE2-CG 4.1Å; Y283-W287 AromaticContact CE2-NE1 3.2Å; Y283-W287 AromaticContact CG-CD1 3.83Å; Y283-W287 AromaticContact CZ-CD1 3.58Å; Y283-W287 AromaticContact CZ-NE1 3.91Å; Y283-W287 WeakPolarHBondContact O-CB 3.48Å; Y283-W287 VanDerWaalsContact O-CD1 3.27Å; Y283-W287 PolarHBondContact O-N 2.93Å; I284-W287 PolarHBondContact O-N 2.89Å; W287-F290 HydrophobicContact CE3-CB 4.42Å; W287-F290 AromaticContact CE3-CD1 3.82Å; W287-F290 HydrophobicContact CE3-CD1 3.82Å; W287-F290 HydrophobicContact CE3-CG 4.35Å; W287-F290 AromaticContact CZ3-CD1 3.77Å; W287-F290 HydrophobicContact CZ3-CD1 3.77Å; W287-F290 HydrophobicContact CZ3-CE1 4.02Å; W287-F290 HydrophobicContact CZ3-CG 4.44Å; W287-F290 PolarHBondContact O-N 2.93Å; W287-F291 HydrophobicContact CB-CD2 4.09Å; W287-F291 HydrophobicContact CB-CE2 4.2Å; W287-F291 AromaticContact CD2-CE2 3.88Å; W287-F291 HydrophobicContact CD2-CE2 3.88Å; W287-F291 AromaticContact CE3-CD2 3.88Å; W287-F291 HydrophobicContact CE3-CD2 3.88Å; W287-F291 AromaticContact CE3-CE2 3.16Å; W287-F291 HydrophobicContact CE3-CE2 3.16Å; W287-F291 AromaticContact CE3-CZ 3.79Å; W287-F291 HydrophobicContact CE3-CZ 3.79Å; W287-F291 HydrophobicContact CG-CE2 4.35Å; W287-F291 AromaticContact CZ3-CE2 3.72Å; W287-F291 HydrophobicContact CZ3-CE2 3.72Å; W287-F291 AromaticContact CZ3-CZ 3.83Å; W287-F291 HydrophobicContact CZ3-CZ 3.83Å; W287-F291 WeakPolarHBondContact O-CD2 3.46Å; W287-F291 PolarHBondContact O-N 2.87Å; W287-A317 HydrophobicContact CD2-CB 4.35Å; W287-A317 HydrophobicContact CE3-CB 3.83Å; W287-A317 HydrophobicContact CH2-CB 4.23Å; W287-A317 HydrophobicContact CZ3-CB 3.78Å; W287-N320 PolarHBondContact NE1-ND2 2.96Å |
| 288 | T | 91.2 | Very high | 89.2 | Confident | 43 Ų | 43 | 38 Ų | 38 | 26% | 0.264 | 21% | 0.21 | S | C | . | . | H | α-helix | trans | -50.9 | -56.8 | 175.3 | -57.1 | 0 | 0 | 0 | 0 | 112.8 | Y212 I284 F290 F291 S292 | Y212-T288 PolarHBondContact OH-OG1 3.14Å; I284-T288 VanDerWaalsContact O-CB 3.31Å; I284-T288 WeakPolarHBondContact O-CB 3.31Å; I284-T288 PolarHBondContact O-N 2.88Å; I284-T288 PolarHBondContact O-OG1 3.47Å; T288-F290 VanDerWaalsContact C-N 3.34Å; T288-F290 PolarHBondContact O-N 3.35Å; T288-F291 PolarHBondContact O-N 2.99Å; T288-S292 WeakPolarHBondContact O-CB 3.4Å; T288-S292 PolarHBondContact O-N 3.3Å; T288-S292 PolarHBondContact O-OG 3.35Å |
| 289 | P | 90.2 | Very high | 89 | Confident | 34 Ų | 34 | 42.1 Ų | 42.1 | 22% | 0.221 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -61.1 | -42.8 | -175.2 | 24.2 | -34.8 | 0 | 0 | 0 | 111.9 | V285 S292 V293 S313 L316 | V285-P289 WeakPolarHBondContact O-CD 3.33Å; P289-S292 PolarHBondContact O-N 3.18Å; P289-V293 WeakPolarHBondContact O-CB 3.46Å; P289-V293 WeakPolarHBondContact O-CG2 3.39Å; P289-V293 PolarHBondContact O-N 3.45Å; P289-S313 PolarHBondContact O-OG 3.38Å; P289-L316 HydrophobicContact CB-CD1 4.14Å; P289-L316 HydrophobicContact CG-CB 3.79Å; P289-L316 HydrophobicContact CG-CD1 3.68Å; P289-L316 HydrophobicContact CG-CG 4.24Å |
| 290 | F | 87.4 | Confident | 88.8 | Confident | 28 Ų | 28 | 44.8 Ų | 44.8 | 12% | 0.123 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -54.8 | -55.9 | 174.9 | -176.4 | -102 | 0 | 0 | 0 | 112.3 | W287 T288 S292 V293 Q294 A317 | W287-F290 HydrophobicContact CE3-CB 4.42Å; W287-F290 AromaticContact CE3-CD1 3.82Å; W287-F290 HydrophobicContact CE3-CD1 3.82Å; W287-F290 HydrophobicContact CE3-CG 4.35Å; W287-F290 AromaticContact CZ3-CD1 3.77Å; W287-F290 HydrophobicContact CZ3-CD1 3.77Å; W287-F290 HydrophobicContact CZ3-CE1 4.02Å; W287-F290 HydrophobicContact CZ3-CG 4.44Å; W287-F290 PolarHBondContact O-N 2.93Å; T288-F290 VanDerWaalsContact C-N 3.34Å; T288-F290 PolarHBondContact O-N 3.35Å; F290-S292 PolarHBondContact O-N 2.95Å; F290-V293 PolarHBondContact O-N 3.5Å; F290-Q294 HydrophobicContact CD1-CG 4.3Å; F290-Q294 HydrophobicContact CD2-CG 4.37Å; F290-Q294 HydrophobicContact CE1-CG 4.01Å; F290-Q294 HydrophobicContact CE2-CG 4.07Å; F290-Q294 HydrophobicContact CG-CG 4.48Å; F290-Q294 HydrophobicContact CZ-CG 3.89Å; F290-Q294 WeakPolarHBondContact O-CB 3.32Å; F290-Q294 WeakPolarHBondContact O-CG 3.27Å; F290-Q294 PolarHBondContact O-N 3.37Å; F290-A317 HydrophobicContact CB-CB 3.99Å; F290-A317 HydrophobicContact CD2-CB 4.08Å; F290-A317 HydrophobicContact CG-CB 3.94Å |
| 291 | F | 89.6 | Confident | 88.1 | Confident | 8 Ų | 8 | 49.5 Ų | 49.5 | 4% | 0.035 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -72.9 | -29.9 | -176.8 | -72.7 | -62.7 | 0 | 0 | 0 | 113.6 | I207 S208 I211 Y212 W287 T288 M295 | I207-F291 HydrophobicContact CG2-CE1 3.94Å; I207-F291 HydrophobicContact CG2-CZ 4.35Å; S208-F291 WeakPolarHBondContact OG-CD1 3.49Å; I211-F291 HydrophobicContact CB-CE2 4.27Å; I211-F291 HydrophobicContact CB-CZ 3.8Å; I211-F291 HydrophobicContact CG2-CE2 3.89Å; I211-F291 HydrophobicContact CG2-CZ 3.73Å; Y212-F291 HydrophobicContact CD1-CB 4.11Å; Y212-F291 HydrophobicContact CD1-CD2 4.37Å; Y212-F291 HydrophobicContact CD1-CG 4.5Å; Y212-F291 HydrophobicContact CD2-CD2 4.05Å; Y212-F291 HydrophobicContact CG-CB 4.27Å; Y212-F291 AromaticContact CG-CD2 3.67Å; Y212-F291 HydrophobicContact CG-CD2 3.67Å; Y212-F291 HydrophobicContact CG-CE2 4.37Å; Y212-F291 HydrophobicContact CG-CG 4.2Å; W287-F291 HydrophobicContact CB-CD2 4.09Å; W287-F291 HydrophobicContact CB-CE2 4.2Å; W287-F291 AromaticContact CD2-CE2 3.88Å; W287-F291 HydrophobicContact CD2-CE2 3.88Å; W287-F291 AromaticContact CE3-CD2 3.88Å; W287-F291 HydrophobicContact CE3-CD2 3.88Å; W287-F291 AromaticContact CE3-CE2 3.16Å; W287-F291 HydrophobicContact CE3-CE2 3.16Å; W287-F291 AromaticContact CE3-CZ 3.79Å; W287-F291 HydrophobicContact CE3-CZ 3.79Å; W287-F291 HydrophobicContact CG-CE2 4.35Å; W287-F291 AromaticContact CZ3-CE2 3.72Å; W287-F291 HydrophobicContact CZ3-CE2 3.72Å; W287-F291 AromaticContact CZ3-CZ 3.83Å; W287-F291 HydrophobicContact CZ3-CZ 3.83Å; W287-F291 WeakPolarHBondContact O-CD2 3.46Å; W287-F291 PolarHBondContact O-N 2.87Å; T288-F291 PolarHBondContact O-N 2.99Å; F291-M295 WeakPolarHBondContact O-CB 3.42Å; F291-M295 PolarHBondContact O-N 3.49Å |
| 292 | S | 89.3 | Confident | 87.3 | Confident | 68 Ų | 68 | 50.4 Ų | 50.4 | 48% | 0.476 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -62.3 | -48.6 | 170.9 | -71.3 | 0 | 0 | 0 | 0 | 111.9 | T288 P289 F290 M295 W296 | T288-S292 WeakPolarHBondContact O-CB 3.4Å; T288-S292 PolarHBondContact O-N 3.3Å; T288-S292 PolarHBondContact O-OG 3.35Å; P289-S292 PolarHBondContact O-N 3.18Å; F290-S292 PolarHBondContact O-N 2.95Å; S292-M295 PolarHBondContact O-N 3.42Å; S292-W296 WeakPolarHBondContact O-CB 3.26Å; S292-W296 PolarHBondContact O-N 3.34Å |
| 293 | V | 85.6 | Confident | 86.4 | Confident | 18 Ų | 18 | 49.7 Ų | 49.7 | 11% | 0.109 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -68.3 | -42.5 | 179.5 | 170.3 | 0 | 0 | 0 | 0 | 111.6 | P289 F290 M295 W296 S297 F310 S313 | P289-V293 WeakPolarHBondContact O-CB 3.46Å; P289-V293 WeakPolarHBondContact O-CG2 3.39Å; P289-V293 PolarHBondContact O-N 3.45Å; F290-V293 PolarHBondContact O-N 3.5Å; V293-M295 PolarHBondContact O-N 3.39Å; V293-W296 PolarHBondContact O-N 3.13Å; V293-S297 WeakPolarHBondContact O-CB 3.27Å; V293-S297 PolarHBondContact O-N 3.43Å; V293-F310 HydrophobicContact CG1-CB 4.46Å; V293-F310 HydrophobicContact CG1-CD1 3.46Å; V293-F310 VanDerWaalsContact CG1-CD1 3.46Å; V293-F310 HydrophobicContact CG1-CD2 3.66Å; V293-F310 HydrophobicContact CG1-CE1 3.44Å; V293-F310 VanDerWaalsContact CG1-CE1 3.44Å; V293-F310 HydrophobicContact CG1-CE2 3.62Å; V293-F310 HydrophobicContact CG1-CG 3.59Å; V293-F310 HydrophobicContact CG1-CZ 3.52Å; V293-S313 WeakPolarHBondContact CG2-OG 3.39Å |
| 294 | Q | 85.3 | Confident | 85.2 | Confident | 57 Ų | 57 | 53.2 Ų | 53.2 | 27% | 0.266 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -60.6 | -44.2 | 175.4 | -70.6 | -69.3 | 90.9 | 0 | 0 | 111.6 | I204 F290 S297 A298 | I204-Q294 HydrophobicContact CG2-CB 3.97Å; I204-Q294 WeakPolarHBondContact CG2-O 3.49Å; F290-Q294 HydrophobicContact CD1-CG 4.3Å; F290-Q294 HydrophobicContact CD2-CG 4.37Å; F290-Q294 HydrophobicContact CE1-CG 4.01Å; F290-Q294 HydrophobicContact CE2-CG 4.07Å; F290-Q294 HydrophobicContact CG-CG 4.48Å; F290-Q294 HydrophobicContact CZ-CG 3.89Å; F290-Q294 WeakPolarHBondContact O-CB 3.32Å; F290-Q294 WeakPolarHBondContact O-CG 3.27Å; F290-Q294 PolarHBondContact O-N 3.37Å; Q294-S297 PolarHBondContact O-N 3.25Å; Q294-A298 WeakPolarHBondContact O-CB 3.29Å; Q294-A298 PolarHBondContact O-N 2.97Å |
| 295 | M | 89 | Confident | 83.6 | Confident | 56 Ų | 56 | 58.4 Ų | 58.4 | 28% | 0.276 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -64.3 | -43.8 | 177 | -166.9 | 67.8 | 68.3 | 0 | 0 | 111.5 | S208 F291 S292 V293 A298 W299 | S208-M295 VanDerWaalsContact CB-CE 3.44Å; S208-M295 WeakPolarHBondContact OG-CE 3.41Å; F291-M295 WeakPolarHBondContact O-CB 3.42Å; F291-M295 PolarHBondContact O-N 3.49Å; S292-M295 PolarHBondContact O-N 3.42Å; V293-M295 PolarHBondContact O-N 3.39Å; M295-A298 PolarHBondContact O-N 3.05Å; M295-W299 PolarHBondContact O-N 2.6Å; M295-W299 VanDerWaalsContact O-N 3.13Å; M295-W299 PolarHBondContact SD-NE1 2.87Å |
| 296 | W | 87.8 | Confident | 81.9 | Confident | 148 Ų | 148 | 62.7 Ų | 62.7 | 56% | 0.561 | 33% | 0.327 | S | S | * | . | H | α-helix | trans | -59.1 | -49.5 | 176.1 | -170.7 | 4.5 | 0 | 0 | 0 | 110.7 | S292 V293 A298 W299 D300 A303 | S292-W296 WeakPolarHBondContact O-CB 3.26Å; S292-W296 PolarHBondContact O-N 3.34Å; V293-W296 PolarHBondContact O-N 3.13Å; W296-A298 PolarHBondContact O-N 3.42Å; W296-W299 PolarHBondContact O-N 2.91Å; W296-D300 VanDerWaalsContact CD1-CB 3.47Å; W296-D300 PolarHBondContact NE1-OD2 3.25Å; W296-D300 WeakPolarHBondContact O-CB 3.38Å; W296-D300 PolarHBondContact O-N 2.92Å; W296-A303 HydrophobicContact CG-CB 4.25Å |
| 297 | S | 82.8 | Confident | 80.3 | Confident | 25 Ų | 25 | 63.6 Ų | 63.6 | 18% | 0.175 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -59.1 | -28.8 | 177.1 | -166.3 | 0 | 0 | 0 | 0 | 114.6 | V293 Q294 | V293-S297 WeakPolarHBondContact O-CB 3.27Å; V293-S297 PolarHBondContact O-N 3.43Å; Q294-S297 PolarHBondContact O-N 3.25Å |
| 298 | A | 85.1 | Confident | 78.8 | Confident | 13 Ų | 13 | 67.8 Ų | 67.8 | 11% | 0.107 | 36% | 0.356 | C | S | . | . | H | α-helix | trans | -79.8 | -40 | -179.5 | 0 | 0 | 0 | 0 | 0 | 112 | K201 I204 Q294 M295 W296 | K201-A298 WeakPolarHBondContact CE-O 3.3Å; K201-A298 WeakPolarHBondContact CG-O 3.41Å; I204-A298 HydrophobicContact CB-CB 3.96Å; I204-A298 HydrophobicContact CD1-CB 3.71Å; I204-A298 HydrophobicContact CG1-CB 4.43Å; I204-A298 HydrophobicContact CG2-CB 3.88Å; Q294-A298 WeakPolarHBondContact O-CB 3.29Å; Q294-A298 PolarHBondContact O-N 2.97Å; M295-A298 PolarHBondContact O-N 3.05Å; W296-A298 PolarHBondContact O-N 3.42Å |
| 299 | W | 87.3 | Confident | 77.2 | Confident | 144 Ų | 144 | 68.8 Ų | 68.8 | 55% | 0.545 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -96.6 | -28.6 | -169.9 | -73.4 | 91.3 | 0 | 0 | 0 | 114 | K201 T205 M295 W296 | K201-W299 HydrophobicContact CD-CE3 4.37Å; T205-W299 PolarHBondContact OG1-NE1 3.47Å; M295-W299 PolarHBondContact O-N 2.6Å; M295-W299 VanDerWaalsContact O-N 3.13Å; M295-W299 PolarHBondContact SD-NE1 2.87Å; W296-W299 PolarHBondContact O-N 2.91Å |
| 300 | D | 84.4 | Confident | 76 | Confident | 56 Ų | 56 | 69.3 Ų | 69.3 | 30% | 0.299 | 36% | 0.362 | S | S | . | . | trans | -106.7 | 114.5 | -179.6 | -174.8 | -0.7 | 0 | 0 | 0 | 111.6 | W296 A302 A303 | W296-D300 VanDerWaalsContact CD1-CB 3.47Å; W296-D300 PolarHBondContact NE1-OD2 3.25Å; W296-D300 WeakPolarHBondContact O-CB 3.38Å; W296-D300 PolarHBondContact O-N 2.92Å; D300-A302 PolarHBondContact O-N 2.91Å; D300-A302 WeakPolarHBondContact OD1-CB 3.4Å; D300-A302 PolarHBondContact OD1-N 3Å; D300-A303 HydrophobicContact CB-CB 4.27Å; D300-A303 WeakPolarHBondContact O-CB 3.32Å; D300-A303 PolarHBondContact O-N 2.87Å | ||
| 301 | P | 75.2 | Confident | 74.9 | Confident | 107 Ų | 107 | 69.7 Ų | 69.7 | 70% | 0.695 | 37% | 0.365 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -61.8 | -25.8 | 173.8 | -22.4 | 34.6 | 0 | 0 | 0 | 114.1 | ||
| 302 | A | 76 | Confident | 73.8 | Confident | 83 Ų | 83 | 73.6 Ų | 73.6 | 69% | 0.686 | 39% | 0.385 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -88.7 | 0.3 | -178.1 | 0 | 0 | 0 | 0 | 0 | 113.7 | D300 | D300-A302 PolarHBondContact O-N 2.91Å; D300-A302 WeakPolarHBondContact OD1-CB 3.4Å; D300-A302 PolarHBondContact OD1-N 3Å |
| 303 | A | 71.9 | Confident | 72.9 | Confident | 5 Ų | 5 | 70.7 Ų | 70.7 | 4% | 0.041 | 37% | 0.365 | C | S | . | . | S | Bend | trans | -59.6 | 127.6 | 176.9 | 0 | 0 | 0 | 0 | 0 | 111.2 | W296 D300 R305 | W296-A303 HydrophobicContact CG-CB 4.25Å; D300-A303 HydrophobicContact CB-CB 4.27Å; D300-A303 WeakPolarHBondContact O-CB 3.32Å; D300-A303 PolarHBondContact O-N 2.87Å; A303-R305 WeakPolarHBondContact O-CG 3.35Å; A303-R305 PolarHBondContact O-N 2.75Å |
| 304 | P | 66.1 | Low | 72.1 | Confident | 73 Ų | 73 | 73.1 Ų | 73.1 | 47% | 0.474 | 38% | 0.376 | S | S | . | . | trans | -74.8 | 95.7 | -175.1 | 28.9 | -35 | 0 | 0 | 0 | 111.9 | E306 A307 F310 | P304-E306 VanDerWaalsContact C-N 3.31Å; P304-E306 PolarHBondContact O-N 3Å; P304-A307 HydrophobicContact CB-CB 4.21Å; P304-A307 HydrophobicContact CG-CB 4.43Å; P304-F310 WeakPolarHBondContact O-CD2 3.25Å; P304-F310 WeakPolarHBondContact O-CE2 3.41Å | ||
| 305 | R | 59.2 | Low | 71.4 | Confident | 157 Ų | 157 | 71.5 Ų | 71.5 | 59% | 0.592 | 37% | 0.369 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -68.9 | -21.3 | -172.7 | -57.3 | -178.2 | -172.8 | 162.2 | 4.3 | 115.2 | A303 | A303-R305 WeakPolarHBondContact O-CG 3.35Å; A303-R305 PolarHBondContact O-N 2.75Å |
| 306 | E | 55.1 | Low | 70.7 | Confident | 180 Ų | 180 | 71 Ų | 71 | 84% | 0.841 | 37% | 0.367 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -99.5 | 15.4 | -175.1 | -67.5 | -69.8 | 149.1 | 0 | 0 | 113.2 | P304 | P304-E306 VanDerWaalsContact C-N 3.31Å; P304-E306 PolarHBondContact O-N 3Å |
| 307 | A | 57.6 | Low | 70.2 | Confident | 27 Ų | 27 | 64.1 Ų | 64.1 | 22% | 0.223 | 34% | 0.342 | C | S | . | . | S | Bend | trans | -99.3 | 145.1 | -170.1 | 0 | 0 | 0 | 0 | 0 | 113.6 | P304 P309 F310 | P304-A307 HydrophobicContact CB-CB 4.21Å; P304-A307 HydrophobicContact CG-CB 4.43Å; A307-P309 VanDerWaalsContact C-N 3.26Å; A307-P309 HydrophobicContact CB-CG 3.83Å; A307-P309 WeakPolarHBondContact O-CD 3.3Å; A307-F310 PolarHBondContact O-N 3.21Å |
| 308 | M | 57.9 | Low | 69.9 | Low | 94 Ų | 94 | 63 Ų | 63 | 46% | 0.463 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -32.4 | -45.4 | 170.4 | -61.5 | -76.6 | -165.7 | 0 | 0 | 116 | V41 F310 I311 I312 | V41-M308 HydrophobicContact CB-SD 4.48Å; V41-M308 HydrophobicContact CG1-CE 4.5Å; V41-M308 HydrophobicContact CG1-SD 3.79Å; V41-M308 HydrophobicContact CG2-CE 3.36Å; V41-M308 HydrophobicContact CG2-SD 3.77Å; M308-F310 VanDerWaalsContact C-N 3.27Å; M308-F310 PolarHBondContact O-N 2.86Å; M308-I311 PolarHBondContact O-N 3.38Å; M308-I312 HydrophobicContact CB-CD1 4.26Å; M308-I312 WeakPolarHBondContact O-CG1 3.32Å; M308-I312 PolarHBondContact O-N 3.45Å |
| 309 | P | 58.6 | Low | 69.7 | Low | 64 Ų | 64 | 65.1 Ų | 65.1 | 42% | 0.416 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -54.3 | -31.2 | 175.6 | 16.3 | -33 | 0 | 0 | 0 | 115.8 | A307 S313 | A307-P309 VanDerWaalsContact C-N 3.26Å; A307-P309 HydrophobicContact CB-CG 3.83Å; A307-P309 WeakPolarHBondContact O-CD 3.3Å; P309-S313 WeakPolarHBondContact O-CB 3.31Å; P309-S313 PolarHBondContact O-N 2.87Å; P309-S313 PolarHBondContact O-OG 2.97Å |
| 310 | F | 65.3 | Low | 69.6 | Low | 44 Ų | 44 | 58.2 Ų | 58.2 | 19% | 0.193 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -66.8 | -49.6 | 175.3 | -84.7 | -101.6 | 0 | 0 | 0 | 111.4 | V293 P304 A307 M308 S313 M314 | V293-F310 HydrophobicContact CG1-CB 4.46Å; V293-F310 HydrophobicContact CG1-CD1 3.46Å; V293-F310 VanDerWaalsContact CG1-CD1 3.46Å; V293-F310 HydrophobicContact CG1-CD2 3.66Å; V293-F310 HydrophobicContact CG1-CE1 3.44Å; V293-F310 VanDerWaalsContact CG1-CE1 3.44Å; V293-F310 HydrophobicContact CG1-CE2 3.62Å; V293-F310 HydrophobicContact CG1-CG 3.59Å; V293-F310 HydrophobicContact CG1-CZ 3.52Å; P304-F310 WeakPolarHBondContact O-CD2 3.25Å; P304-F310 WeakPolarHBondContact O-CE2 3.41Å; A307-F310 PolarHBondContact O-N 3.21Å; M308-F310 VanDerWaalsContact C-N 3.27Å; M308-F310 PolarHBondContact O-N 2.86Å; F310-S313 PolarHBondContact O-N 2.87Å; F310-M314 PolarHBondContact O-N 2.97Å |
| 311 | I | 64.1 | Low | 69.4 | Low | 37 Ų | 37 | 55.8 Ų | 55.8 | 19% | 0.19 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -57.8 | -53.1 | 176.7 | -66.7 | 170.7 | 0 | 0 | 0 | 110.1 | V41 E45 M308 S313 M314 L315 | V41-I311 HydrophobicContact CG1-CD1 3.66Å; E45-I311 HydrophobicContact CB-CG2 4.19Å; E45-I311 HydrophobicContact CG-CG2 4.07Å; E45-I311 WeakPolarHBondContact OE1-CG2 3.31Å; M308-I311 PolarHBondContact O-N 3.38Å; I311-S313 PolarHBondContact O-N 2.7Å; I311-M314 PolarHBondContact O-N 2.69Å; I311-M314 VanDerWaalsContact O-N 3.1Å; I311-L315 HydrophobicContact CG2-CD1 3.96Å; I311-L315 HydrophobicContact CG2-CG 4.43Å; I311-L315 VanDerWaalsContact O-CG 3.32Å; I311-L315 WeakPolarHBondContact O-CG 3.02Å; I311-L315 PolarHBondContact O-N 2.99Å |
| 312 | I | 65.4 | Low | 69.7 | Low | 90 Ų | 90 | 51 Ų | 51 | 46% | 0.462 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -57 | -39.6 | 179 | -68.1 | 166.8 | 0 | 0 | 0 | 111.4 | M308 L315 L316 | M308-I312 HydrophobicContact CB-CD1 4.26Å; M308-I312 WeakPolarHBondContact O-CG1 3.32Å; M308-I312 PolarHBondContact O-N 3.45Å; I312-L315 PolarHBondContact O-N 3.26Å; I312-L316 HydrophobicContact CG2-CD1 3.69Å; I312-L316 WeakPolarHBondContact O-CB 3.16Å; I312-L316 WeakPolarHBondContact O-CD1 3.39Å; I312-L316 WeakPolarHBondContact O-CG 3.35Å; I312-L316 PolarHBondContact O-N 2.93Å |
| 313 | S | 70.8 | Confident | 70.2 | Confident | 7 Ų | 7 | 49 Ų | 49 | 5% | 0.049 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -70.5 | -34.7 | 179.3 | -61.9 | 0 | 0 | 0 | 0 | 113.1 | P289 V293 P309 F310 I311 L316 A317 | P289-S313 PolarHBondContact O-OG 3.38Å; V293-S313 WeakPolarHBondContact CG2-OG 3.39Å; P309-S313 WeakPolarHBondContact O-CB 3.31Å; P309-S313 PolarHBondContact O-N 2.87Å; P309-S313 PolarHBondContact O-OG 2.97Å; F310-S313 PolarHBondContact O-N 2.87Å; I311-S313 PolarHBondContact O-N 2.7Å; S313-L316 PolarHBondContact O-N 2.97Å; S313-A317 PolarHBondContact O-N 2.84Å |
| 314 | M | 69.4 | Low | 70.8 | Confident | 68 Ų | 68 | 48.7 Ų | 48.7 | 34% | 0.335 | 25% | 0.251 | S | S | . | . | H | α-helix | trans | -71.6 | -37.5 | 175.3 | -159.2 | 173.6 | -173.5 | 0 | 0 | 112.1 | Q99 F310 I311 S318 | Q99-M314 VanDerWaalsContact CD-CE 3.46Å; Q99-M314 HydrophobicContact CG-CE 4.08Å; Q99-M314 PolarHBondContact NE2-SD 3.48Å; F310-M314 PolarHBondContact O-N 2.97Å; I311-M314 PolarHBondContact O-N 2.69Å; I311-M314 VanDerWaalsContact O-N 3.1Å; M314-S318 PolarHBondContact O-N 2.78Å; M314-S318 PolarHBondContact O-OG 3.3Å |
| 315 | L | 70.6 | Confident | 71.7 | Confident | 23 Ų | 23 | 45.6 Ų | 45.6 | 12% | 0.12 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -63 | -43.7 | 171.3 | -66.2 | 173.5 | 0 | 0 | 0 | 111.4 | V48 L49 I311 I312 A317 S318 L319 | V48-L315 HydrophobicContact CB-CD2 4.25Å; V48-L315 HydrophobicContact CG1-CD1 4.32Å; V48-L315 HydrophobicContact CG1-CD2 3.93Å; L49-L315 HydrophobicContact CD1-CD2 4.42Å; L49-L315 HydrophobicContact CD2-CD2 3.76Å; L49-L315 HydrophobicContact CG-CD2 3.64Å; I311-L315 HydrophobicContact CG2-CD1 3.96Å; I311-L315 HydrophobicContact CG2-CG 4.43Å; I311-L315 VanDerWaalsContact O-CG 3.32Å; I311-L315 WeakPolarHBondContact O-CG 3.02Å; I311-L315 PolarHBondContact O-N 2.99Å; I312-L315 PolarHBondContact O-N 3.26Å; L315-A317 PolarHBondContact O-N 3.49Å; L315-S318 WeakPolarHBondContact O-CB 3.18Å; L315-S318 PolarHBondContact O-N 3.04Å; L315-S318 VanDerWaalsContact O-N 3.14Å; L315-L319 PolarHBondContact O-N 2.83Å |
| 316 | L | 74 | Confident | 72.9 | Confident | 47 Ų | 47 | 44.4 Ų | 44.4 | 25% | 0.246 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -62 | -41.1 | 179.7 | -82.5 | 156.5 | 0 | 0 | 0 | 113 | C286 P289 I312 S313 S318 L319 | C286-L316 WeakPolarHBondContact CB-O 3.36Å; C286-L316 CarbonylContact O-C 3.53Å; P289-L316 HydrophobicContact CB-CD1 4.14Å; P289-L316 HydrophobicContact CG-CB 3.79Å; P289-L316 HydrophobicContact CG-CD1 3.68Å; P289-L316 HydrophobicContact CG-CG 4.24Å; I312-L316 HydrophobicContact CG2-CD1 3.69Å; I312-L316 WeakPolarHBondContact O-CB 3.16Å; I312-L316 WeakPolarHBondContact O-CD1 3.39Å; I312-L316 WeakPolarHBondContact O-CG 3.35Å; I312-L316 PolarHBondContact O-N 2.93Å; S313-L316 PolarHBondContact O-N 2.97Å; L316-S318 VanDerWaalsContact C-N 3.27Å; L316-S318 PolarHBondContact O-N 2.82Å; L316-L319 HydrophobicContact CD2-CD1 4.18Å; L316-L319 PolarHBondContact O-N 3.1Å |
| 317 | A | 77.9 | Confident | 74.3 | Confident | 3 Ų | 3 | 36.6 Ų | 36.6 | 3% | 0.025 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -59.5 | -39.1 | 173.9 | 0 | 0 | 0 | 0 | 0 | 112.4 | C286 W287 F290 S313 L315 L319 N320 | C286-A317 PolarHBondContact O-N 3.42Å; W287-A317 HydrophobicContact CD2-CB 4.35Å; W287-A317 HydrophobicContact CE3-CB 3.83Å; W287-A317 HydrophobicContact CH2-CB 4.23Å; W287-A317 HydrophobicContact CZ3-CB 3.78Å; F290-A317 HydrophobicContact CB-CB 3.99Å; F290-A317 HydrophobicContact CD2-CB 4.08Å; F290-A317 HydrophobicContact CG-CB 3.94Å; S313-A317 PolarHBondContact O-N 2.84Å; L315-A317 PolarHBondContact O-N 3.49Å; A317-L319 VanDerWaalsContact C-N 3.33Å; A317-L319 PolarHBondContact O-N 2.98Å; A317-N320 WeakPolarHBondContact O-CB 3.37Å; A317-N320 PolarHBondContact O-N 2.99Å |
| 318 | S | 76.6 | Confident | 75.5 | Confident | 1 Ų | 1 | 35.3 Ų | 35.3 | 1% | 0.007 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -70.2 | -27.5 | -179.4 | -57.7 | 0 | 0 | 0 | 0 | 113.1 | M314 L315 L316 N320 | M314-S318 PolarHBondContact O-N 2.78Å; M314-S318 PolarHBondContact O-OG 3.3Å; L315-S318 WeakPolarHBondContact O-CB 3.18Å; L315-S318 PolarHBondContact O-N 3.04Å; L315-S318 VanDerWaalsContact O-N 3.14Å; L316-S318 VanDerWaalsContact C-N 3.27Å; L316-S318 PolarHBondContact O-N 2.82Å; S318-N320 PolarHBondContact O-N 2.81Å |
| 319 | L | 80.7 | Confident | 76.5 | Confident | 57 Ų | 57 | 34.6 Ų | 34.6 | 30% | 0.298 | 18% | 0.176 | S | C | . | . | H | α-helix | trans | -66.2 | -22.4 | 176.3 | -71.2 | 171.9 | 0 | 0 | 0 | 113.7 | V52 L315 L316 A317 S321 C322 C323 | V52-L319 HydrophobicContact CG2-CD2 3.61Å; V52-L319 HydrophobicContact CG2-CG 4.46Å; L315-L319 PolarHBondContact O-N 2.83Å; L316-L319 HydrophobicContact CD2-CD1 4.18Å; L316-L319 PolarHBondContact O-N 3.1Å; A317-L319 VanDerWaalsContact C-N 3.33Å; A317-L319 PolarHBondContact O-N 2.98Å; L319-S321 VanDerWaalsContact C-N 3.33Å; L319-S321 PolarHBondContact O-N 3.24Å; L319-C322 PolarHBondContact O-N 2.63Å; L319-C322 PolarHBondContact O-SG 2.96Å; L319-C323 PolarHBondContact O-N 3.41Å; L319-C323 VanDerWaalsContact O-N 3.1Å; L319-C323 PolarHBondContact O-SG 3.22Å |
| 320 | N | 83.8 | Confident | 77.5 | Confident | 0 Ų | 0 | 36.4 Ų | 36.4 | 0% | 0 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -56.1 | -46.4 | 178.2 | 176.9 | 65 | 0 | 0 | 0 | 112 | Y283 C286 W287 A317 S318 C323 | Y283-N320 WeakPolarHBondContact CA-OD1 3.43Å; Y283-N320 WeakPolarHBondContact CD2-OD1 3.46Å; C286-N320 HydrophobicContact CB-CB 3.82Å; W287-N320 PolarHBondContact NE1-ND2 2.96Å; A317-N320 WeakPolarHBondContact O-CB 3.37Å; A317-N320 PolarHBondContact O-N 2.99Å; S318-N320 PolarHBondContact O-N 2.81Å; N320-C323 PolarHBondContact O-N 2.93Å |
| 321 | S | 81.6 | Confident | 77.9 | Confident | 4 Ų | 4 | 37.2 Ų | 37.2 | 3% | 0.028 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -77 | -21.6 | -176.7 | -69.2 | 0 | 0 | 0 | 0 | 114 | N60 D88 L319 | N60-S321 PolarHBondContact ND2-O 3.48Å; N60-S321 VanDerWaalsContact ND2-O 3.1Å; D88-S321 WeakPolarHBondContact OD1-CB 3.34Å; D88-S321 PolarHBondContact OD1-OG 3.49Å; L319-S321 VanDerWaalsContact C-N 3.33Å; L319-S321 PolarHBondContact O-N 3.24Å |
| 322 | C | 81.9 | Confident | 78.2 | Confident | 7 Ų | 7 | 35.8 Ų | 35.8 | 5% | 0.047 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -84.9 | -24.5 | 173.5 | 75.7 | 0 | 0 | 0 | 0 | 113.1 | V52 L55 A56 L319 P325 | V52-C322 HydrophobicContact CG1-CB 4.47Å; L55-C322 HydrophobicContact CB-CB 4.27Å; A56-C322 HydrophobicContact CB-CB 4.1Å; L319-C322 PolarHBondContact O-N 2.63Å; L319-C322 PolarHBondContact O-SG 2.96Å; C322-P325 WeakPolarHBondContact O-CD 3.44Å |
| 323 | C | 85.1 | Confident | 78.4 | Confident | 40 Ų | 40 | 33.1 Ų | 33.1 | 27% | 0.27 | 18% | 0.181 | S | C | . | . | H | α-helix | trans | -67.1 | -34.4 | 178.5 | -72.5 | 0 | 0 | 0 | 0 | 113.6 | L319 N320 W326 I327 | L319-C323 PolarHBondContact O-N 3.41Å; L319-C323 VanDerWaalsContact O-N 3.1Å; L319-C323 PolarHBondContact O-SG 3.22Å; N320-C323 PolarHBondContact O-N 2.93Å; C323-W326 PolarHBondContact O-N 3.3Å; C323-W326 VanDerWaalsContact O-N 3.15Å; C323-I327 HydrophobicContact CB-CD1 4.23Å; C323-I327 WeakPolarHBondContact O-CG1 3.39Å; C323-I327 PolarHBondContact O-N 3.5Å; C323-I327 VanDerWaalsContact O-N 3.11Å |
| 324 | N | 85.8 | Confident | 78.6 | Confident | 0 Ų | 0 | 37.5 Ų | 37.5 | 0% | 0 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -56.6 | -48.1 | -171.3 | -70 | -29.1 | 0 | 0 | 0 | 114.1 | D88 W326 I327 Y328 | D88-N324 PolarHBondContact OD2-ND2 3.41Å; N324-W326 PolarHBondContact O-N 3.36Å; N324-I327 PolarHBondContact O-N 3.44Å; N324-Y328 HydrophobicContact CB-CE2 4.3Å; N324-Y328 WeakPolarHBondContact O-CD2 3.2Å; N324-Y328 VanDerWaalsContact O-CG 3.28Å; N324-Y328 PolarHBondContact O-N 2.96Å |
| 325 | P | 84.3 | Confident | 78.5 | Confident | 7 Ų | 7 | 34.3 Ų | 34.3 | 5% | 0.045 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -55.2 | -42.6 | 173.2 | -29.8 | 36.1 | 0 | 0 | 0 | 115.2 | N60 V63 C322 Y328 M329 | N60-P325 HydrophobicContact CB-CG 4.4Å; V63-P325 HydrophobicContact CG2-CB 3.82Å; V63-P325 HydrophobicContact CG2-CG 4.17Å; C322-P325 WeakPolarHBondContact O-CD 3.44Å; P325-Y328 PolarHBondContact O-N 3.14Å; P325-M329 PolarHBondContact O-N 2.88Å |
| 326 | W | 83.4 | Confident | 78.5 | Confident | 133 Ų | 133 | 34.6 Ų | 34.6 | 50% | 0.504 | 19% | 0.186 | S | C | . | . | H | α-helix | trans | -66 | -40.4 | 178.8 | -62.4 | 98.9 | 0 | 0 | 0 | 111.4 | L55 C323 N324 Y328 M329 C330 | L55-W326 HydrophobicContact CD2-CZ2 4.11Å; C323-W326 PolarHBondContact O-N 3.3Å; C323-W326 VanDerWaalsContact O-N 3.15Å; N324-W326 PolarHBondContact O-N 3.36Å; W326-Y328 VanDerWaalsContact C-N 3.34Å; W326-Y328 PolarHBondContact O-N 3.45Å; W326-M329 HydrophobicContact CD2-CE 4.42Å; W326-M329 HydrophobicContact CE3-CE 3.37Å; W326-M329 HydrophobicContact CZ3-CE 3.52Å; W326-M329 PolarHBondContact O-N 3.43Å; W326-C330 PolarHBondContact O-N 2.92Å; W326-C330 PolarHBondContact O-SG 3.22Å; W326-C330 VanDerWaalsContact O-SG 3.38Å |
| 327 | I | 85 | Confident | 78.4 | Confident | 16 Ų | 16 | 37.9 Ų | 37.9 | 8% | 0.082 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -63.4 | -42.8 | 175.1 | -59.2 | 162.6 | 0 | 0 | 0 | 110.1 | M275 V278 I279 A282 C323 N324 M329 C330 F331 | M275-I327 HydrophobicContact CG-CG2 3.83Å; V278-I327 HydrophobicContact CB-CG2 4.3Å; V278-I327 HydrophobicContact CG1-CD1 3.97Å; V278-I327 HydrophobicContact CG1-CG1 3.95Å; V278-I327 HydrophobicContact CG1-CG2 4.04Å; I279-I327 HydrophobicContact CD1-CG2 4.31Å; I279-I327 HydrophobicContact CG1-CB 4.29Å; I279-I327 HydrophobicContact CG1-CD1 3.77Å; I279-I327 HydrophobicContact CG1-CG2 3.84Å; A282-I327 HydrophobicContact CB-CD1 4.27Å; C323-I327 HydrophobicContact CB-CD1 4.23Å; C323-I327 WeakPolarHBondContact O-CG1 3.39Å; C323-I327 PolarHBondContact O-N 3.5Å; C323-I327 VanDerWaalsContact O-N 3.11Å; N324-I327 PolarHBondContact O-N 3.44Å; I327-M329 VanDerWaalsContact C-N 3.33Å; I327-M329 PolarHBondContact O-N 3.05Å; I327-C330 PolarHBondContact O-N 3.45Å; I327-F331 HydrophobicContact CG2-CD2 3.82Å; I327-F331 HydrophobicContact CG2-CE2 4.14Å; I327-F331 WeakPolarHBondContact O-CD2 3.47Å; I327-F331 PolarHBondContact O-N 2.94Å; I327-F331 VanDerWaalsContact O-N 3.08Å |
| 328 | Y | 83.5 | Confident | 78.1 | Confident | 0 Ų | 0 | 40.1 Ų | 40.1 | 0% | 0 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -62.6 | -38.1 | 174 | -58.8 | -29.3 | 0 | 0 | 0 | 112.6 | V63 M81 L84 M275 I279 N324 P325 W326 F331 A332 | V63-Y328 HydrophobicContact CG1-CD2 3.83Å; V63-Y328 HydrophobicContact CG1-CE2 4.19Å; V63-Y328 HydrophobicContact CG2-CD2 3.83Å; M81-Y328 HydrophobicContact CB-CE2 4.38Å; M81-Y328 HydrophobicContact CE-CD1 3.78Å; M81-Y328 HydrophobicContact CE-CE1 4.08Å; M81-Y328 HydrophobicContact CE-CG 4.34Å; M81-Y328 HydrophobicContact CG-CD1 4.41Å; M81-Y328 HydrophobicContact CG-CE1 3.97Å; M81-Y328 HydrophobicContact CG-CE2 4.33Å; L84-Y328 VanDerWaalsContact CD2-OH 3.25Å; L84-Y328 WeakPolarHBondContact CD2-OH 3.47Å; M275-Y328 HydrophobicContact CE-CD1 3.92Å; M275-Y328 HydrophobicContact CE-CE1 3.72Å; M275-Y328 HydrophobicContact CG-CD1 4.48Å; M275-Y328 HydrophobicContact SD-CD1 3.7Å; M275-Y328 HydrophobicContact SD-CE1 4.15Å; I279-Y328 HydrophobicContact CD1-CD1 4.32Å; I279-Y328 HydrophobicContact CD1-CE1 3.55Å; N324-Y328 HydrophobicContact CB-CE2 4.3Å; N324-Y328 WeakPolarHBondContact O-CD2 3.2Å; N324-Y328 VanDerWaalsContact O-CG 3.28Å; N324-Y328 PolarHBondContact O-N 2.96Å; P325-Y328 PolarHBondContact O-N 3.14Å; W326-Y328 VanDerWaalsContact C-N 3.34Å; W326-Y328 PolarHBondContact O-N 3.45Å; Y328-F331 PolarHBondContact O-N 3.46Å; Y328-A332 CarbonylContact O-C 3.59Å; Y328-A332 VanDerWaalsContact O-CA 3.3Å; Y328-A332 WeakPolarHBondContact O-CA 3.46Å; Y328-A332 VanDerWaalsContact O-CB 3.3Å; Y328-A332 WeakPolarHBondContact O-CB 3.5Å; Y328-A332 PolarHBondContact O-N 3.46Å |
| 329 | M | 79.4 | Confident | 77.8 | Confident | 78 Ų | 78 | 41.1 Ų | 41.1 | 38% | 0.384 | 22% | 0.216 | S | C | . | . | H | α-helix | trans | -64.7 | -41.9 | 176.3 | -171.7 | 167.5 | 60.1 | 0 | 0 | 112.2 | P325 W326 I327 G333 F336 | P325-M329 PolarHBondContact O-N 2.88Å; W326-M329 HydrophobicContact CD2-CE 4.42Å; W326-M329 HydrophobicContact CE3-CE 3.37Å; W326-M329 HydrophobicContact CZ3-CE 3.52Å; W326-M329 PolarHBondContact O-N 3.43Å; I327-M329 VanDerWaalsContact C-N 3.33Å; I327-M329 PolarHBondContact O-N 3.05Å; M329-G333 WeakPolarHBondContact O-CA 3.21Å; M329-G333 PolarHBondContact O-N 3.37Å; M329-G333 VanDerWaalsContact O-N 3.12Å; M329-F336 VanDerWaalsContact CA-CE2 3.46Å; M329-F336 HydrophobicContact CB-CD2 4.09Å; M329-F336 HydrophobicContact CB-CE2 3.85Å; M329-F336 HydrophobicContact CB-CZ 4.21Å; M329-F336 HydrophobicContact CG-CD2 4.03Å; M329-F336 HydrophobicContact CG-CE2 4.3Å; M329-F336 HydrophobicContact CG-CG 4.25Å |
| 330 | C | 78.4 | Confident | 77.5 | Confident | 103 Ų | 103 | 46.6 Ų | 46.6 | 70% | 0.696 | 23% | 0.233 | S | C | * | . | H | α-helix | trans | -67.2 | -35.4 | 177.7 | -69.5 | 0 | 0 | 0 | 0 | 113.9 | W326 I327 | W326-C330 PolarHBondContact O-N 2.92Å; W326-C330 PolarHBondContact O-SG 3.22Å; W326-C330 VanDerWaalsContact O-SG 3.38Å; I327-C330 PolarHBondContact O-N 3.45Å |
| 331 | F | 74.3 | Confident | 76.9 | Confident | 60 Ų | 60 | 51.6 Ų | 51.6 | 26% | 0.263 | 26% | 0.256 | S | S | . | . | H | α-helix | trans | -104.3 | -16.2 | -174 | -74.4 | -83.4 | 0 | 0 | 0 | 115.1 | T271 K274 M275 V278 I327 Y328 | T271-F331 HydrophobicContact CG2-CD1 4.11Å; K274-F331 HydrophobicContact CB-CD1 4.34Å; K274-F331 HydrophobicContact CB-CE1 3.58Å; K274-F331 HydrophobicContact CB-CZ 4.18Å; M275-F331 HydrophobicContact CB-CB 3.67Å; M275-F331 HydrophobicContact CB-CD1 4Å; M275-F331 HydrophobicContact CB-CD2 3.96Å; M275-F331 HydrophobicContact CB-CG 3.61Å; M275-F331 HydrophobicContact CG-CB 3.58Å; M275-F331 HydrophobicContact CG-CD2 3.91Å; M275-F331 HydrophobicContact CG-CG 3.82Å; M275-F331 HydrophobicContact SD-CB 4.11Å; V278-F331 HydrophobicContact CB-CE2 4.33Å; V278-F331 HydrophobicContact CG2-CE2 4.05Å; V278-F331 HydrophobicContact CG2-CZ 4.03Å; I327-F331 HydrophobicContact CG2-CD2 3.82Å; I327-F331 HydrophobicContact CG2-CE2 4.14Å; I327-F331 WeakPolarHBondContact O-CD2 3.47Å; I327-F331 PolarHBondContact O-N 2.94Å; I327-F331 VanDerWaalsContact O-N 3.08Å; Y328-F331 PolarHBondContact O-N 3.46Å |
| 332 | A | 71.1 | Confident | 76.3 | Confident | 7 Ų | 7 | 54.9 Ų | 54.9 | 6% | 0.058 | 27% | 0.273 | C | S | . | . | S | Bend | trans | -131.2 | 32.7 | 178.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | Y328 H334 L335 | Y328-A332 CarbonylContact O-C 3.59Å; Y328-A332 VanDerWaalsContact O-CA 3.3Å; Y328-A332 WeakPolarHBondContact O-CA 3.46Å; Y328-A332 VanDerWaalsContact O-CB 3.3Å; Y328-A332 WeakPolarHBondContact O-CB 3.5Å; Y328-A332 PolarHBondContact O-N 3.46Å; A332-H334 PolarHBondContact O-N 2.99Å; A332-H334 PolarHBondContact O-ND1 3.32Å; A332-L335 WeakPolarHBondContact O-CB 3.32Å; A332-L335 PolarHBondContact O-N 2.84Å |
| 333 | G | 69.4 | Low | 75.7 | Confident | 34 Ų | 34 | 60.5 Ų | 60.5 | 35% | 0.351 | 30% | 0.297 | S | S | . | . | H | α-helix | trans | -53.9 | -21.9 | -176.1 | 0 | 0 | 0 | 0 | 0 | 116.1 | M329 L335 F336 H337 | M329-G333 WeakPolarHBondContact O-CA 3.21Å; M329-G333 PolarHBondContact O-N 3.37Å; M329-G333 VanDerWaalsContact O-N 3.12Å; G333-L335 PolarHBondContact O-N 2.91Å; G333-F336 PolarHBondContact O-N 2.68Å; G333-F336 VanDerWaalsContact O-N 3.14Å; G333-H337 PolarHBondContact O-N 3.29Å |
| 334 | H | 73.5 | Confident | 74.9 | Confident | 99 Ų | 99 | 63.5 Ų | 63.5 | 46% | 0.458 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -58.6 | -32.3 | 170.9 | 65.8 | -81.5 | 0 | 0 | 0 | 112.5 | Y78 A332 F336 H337 D338 | Y78-H334 PolarHBondContact OH-NE2 3.18Å; A332-H334 PolarHBondContact O-N 2.99Å; A332-H334 PolarHBondContact O-ND1 3.32Å; H334-F336 VanDerWaalsContact C-N 3.33Å; H334-F336 PolarHBondContact O-N 2.94Å; H334-H337 WeakPolarHBondContact O-CB 3.32Å; H334-H337 PolarHBondContact O-N 2.74Å; H334-D338 PolarHBondContact O-N 2.71Å |
| 335 | L | 67.4 | Low | 73.7 | Confident | 1 Ų | 1 | 66 Ų | 66 | 1% | 0.005 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -62.4 | -40.5 | 176 | -177.6 | 65.7 | 0 | 0 | 0 | 111.8 | A66 I67 T70 Y78 A332 G333 L339 | A66-L335 HydrophobicContact CB-CD1 4.13Å; A66-L335 HydrophobicContact CB-CD2 4.06Å; A66-L335 HydrophobicContact CB-CG 3.68Å; A66-L335 WeakPolarHBondContact O-CD1 3.45Å; I67-L335 HydrophobicContact CG1-CD2 4.07Å; T70-L335 HydrophobicContact CG2-CD1 3.36Å; Y78-L335 HydrophobicContact CE1-CD1 4.49Å; Y78-L335 HydrophobicContact CE1-CD2 4.42Å; A332-L335 WeakPolarHBondContact O-CB 3.32Å; A332-L335 PolarHBondContact O-N 2.84Å; G333-L335 PolarHBondContact O-N 2.91Å; L335-L339 PolarHBondContact O-N 3.01Å |
| 336 | F | 71.2 | Confident | 72.4 | Confident | 30 Ų | 30 | 69.4 Ų | 69.4 | 13% | 0.132 | 35% | 0.35 | C | S | . | . | H | α-helix | trans | -80.6 | -25.4 | 178.9 | -63.4 | -88.2 | 0 | 0 | 0 | 111.8 | V63 M329 G333 H334 L339 R340 | V63-F336 HydrophobicContact CG2-CZ 4.01Å; M329-F336 VanDerWaalsContact CA-CE2 3.46Å; M329-F336 HydrophobicContact CB-CD2 4.09Å; M329-F336 HydrophobicContact CB-CE2 3.85Å; M329-F336 HydrophobicContact CB-CZ 4.21Å; M329-F336 HydrophobicContact CG-CD2 4.03Å; M329-F336 HydrophobicContact CG-CE2 4.3Å; M329-F336 HydrophobicContact CG-CG 4.25Å; G333-F336 PolarHBondContact O-N 2.68Å; G333-F336 VanDerWaalsContact O-N 3.14Å; H334-F336 VanDerWaalsContact C-N 3.33Å; H334-F336 PolarHBondContact O-N 2.94Å; F336-L339 PolarHBondContact O-N 3.41Å; F336-R340 VanDerWaalsContact O-CB 3.31Å; F336-R340 WeakPolarHBondContact O-CB 3.34Å; F336-R340 PolarHBondContact O-N 3.19Å |
| 337 | H | 72.5 | Confident | 71 | Confident | 116 Ų | 116 | 66.1 Ų | 66.1 | 54% | 0.537 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -64.6 | -47.8 | 168.6 | -171.6 | -81.2 | 0 | 0 | 0 | 111.4 | G333 H334 L339 R340 Q341 | G333-H337 PolarHBondContact O-N 3.29Å; H334-H337 WeakPolarHBondContact O-CB 3.32Å; H334-H337 PolarHBondContact O-N 2.74Å; H337-L339 VanDerWaalsContact C-N 3.32Å; H337-L339 PolarHBondContact O-N 3.47Å; H337-R340 PolarHBondContact O-N 2.87Å; H337-Q341 WeakPolarHBondContact O-CB 3.46Å; H337-Q341 PolarHBondContact O-N 2.81Å |
| 338 | D | 70.3 | Confident | 69.5 | Low | 49 Ų | 49 | 68.2 Ų | 68.2 | 26% | 0.262 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -55.6 | -46.2 | 173.1 | -75.7 | -3.5 | 0 | 0 | 0 | 111.3 | T70 H334 Q341 N342 | T70-D338 WeakPolarHBondContact CB-OD2 3.28Å; T70-D338 PolarHBondContact OG1-OD2 3.2Å; H334-D338 PolarHBondContact O-N 2.71Å; D338-Q341 PolarHBondContact O-N 3.49Å; D338-N342 WeakPolarHBondContact O-CB 3.35Å; D338-N342 PolarHBondContact O-N 3.23Å; D338-N342 PolarHBondContact O-ND2 2.88Å |
| 339 | L | 71.4 | Confident | 67.9 | Low | 23 Ų | 23 | 77 Ų | 77 | 12% | 0.12 | 40% | 0.4 | C | S | . | . | H | α-helix | trans | -63.7 | -46.2 | 178.2 | 179.3 | 131.8 | 0 | 0 | 0 | 111.8 | L65 A66 L335 F336 H337 Q341 N342 F343 | L65-L339 HydrophobicContact CB-CD1 4.01Å; A66-L339 HydrophobicContact CB-CB 4.17Å; A66-L339 HydrophobicContact CB-CD1 3.77Å; L335-L339 PolarHBondContact O-N 3.01Å; F336-L339 PolarHBondContact O-N 3.41Å; H337-L339 VanDerWaalsContact C-N 3.32Å; H337-L339 PolarHBondContact O-N 3.47Å; L339-Q341 PolarHBondContact O-N 3.5Å; L339-N342 PolarHBondContact O-N 3.23Å; L339-F343 HydrophobicContact CD1-CE2 4.46Å; L339-F343 HydrophobicContact CD2-CD2 4.19Å; L339-F343 HydrophobicContact CG-CD2 4.05Å; L339-F343 HydrophobicContact CG-CE2 4.36Å; L339-F343 WeakPolarHBondContact O-CB 3.47Å; L339-F343 PolarHBondContact O-N 3.22Å |
| 340 | R | 74.3 | Confident | 66.5 | Low | 172 Ų | 172 | 82.2 Ų | 82.2 | 65% | 0.649 | 42% | 0.417 | S | S | * | . | H | α-helix | trans | -61.2 | -43.6 | 176.5 | 179.5 | 176.9 | 176.6 | 179.1 | -0.3 | 111.4 | F336 H337 F343 L344 | F336-R340 VanDerWaalsContact O-CB 3.31Å; F336-R340 WeakPolarHBondContact O-CB 3.34Å; F336-R340 PolarHBondContact O-N 3.19Å; H337-R340 PolarHBondContact O-N 2.87Å; R340-F343 PolarHBondContact O-N 3.19Å; R340-L344 HydrophobicContact CG-CD1 3.8Å; R340-L344 HydrophobicContact CG-CG 4.4Å; R340-L344 WeakPolarHBondContact O-CB 3.14Å; R340-L344 VanDerWaalsContact O-CG 3.27Å; R340-L344 WeakPolarHBondContact O-CG 3.44Å; R340-L344 PolarHBondContact O-N 3.25Å |
| 341 | Q | 71.6 | Confident | 65.2 | Low | 105 Ų | 105 | 82.8 Ų | 82.8 | 49% | 0.491 | 41% | 0.412 | S | S | . | . | H | α-helix | trans | -65.5 | -43.1 | 178.7 | -171.3 | 170.3 | 3.5 | 0 | 0 | 111.1 | H337 D338 L339 C345 | H337-Q341 WeakPolarHBondContact O-CB 3.46Å; H337-Q341 PolarHBondContact O-N 2.81Å; D338-Q341 PolarHBondContact O-N 3.49Å; L339-Q341 PolarHBondContact O-N 3.5Å; Q341-C345 VanDerWaalsContact O-CB 3.22Å; Q341-C345 WeakPolarHBondContact O-CB 3.15Å; Q341-C345 PolarHBondContact O-N 3.3Å; Q341-C345 PolarHBondContact O-SG 2.95Å |
| 342 | N | 68.3 | Low | 63.9 | Low | 72 Ų | 72 | 86.9 Ų | 86.9 | 39% | 0.385 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -64.7 | -42.9 | 175 | -76.1 | -27.9 | 0 | 0 | 0 | 112.4 | D338 L339 C345 C346 | D338-N342 WeakPolarHBondContact O-CB 3.35Å; D338-N342 PolarHBondContact O-N 3.23Å; D338-N342 PolarHBondContact O-ND2 2.88Å; L339-N342 PolarHBondContact O-N 3.23Å; N342-C345 PolarHBondContact O-N 2.95Å; N342-C346 VanDerWaalsContact O-CB 3.22Å; N342-C346 WeakPolarHBondContact O-CB 3.44Å; N342-C346 PolarHBondContact O-N 3.13Å; N342-C346 PolarHBondContact O-SG 2.74Å |
| 343 | F | 69.4 | Low | 62.8 | Low | 125 Ų | 125 | 90.1 Ų | 90.1 | 55% | 0.548 | 45% | 0.452 | S | S | . | . | H | α-helix | trans | -62.2 | -48.2 | 175.8 | -102.9 | -92.2 | 0 | 0 | 0 | 112 | L339 R340 C345 C346 S347 | L339-F343 HydrophobicContact CD1-CE2 4.46Å; L339-F343 HydrophobicContact CD2-CD2 4.19Å; L339-F343 HydrophobicContact CG-CD2 4.05Å; L339-F343 HydrophobicContact CG-CE2 4.36Å; L339-F343 WeakPolarHBondContact O-CB 3.47Å; L339-F343 PolarHBondContact O-N 3.22Å; R340-F343 PolarHBondContact O-N 3.19Å; F343-C345 PolarHBondContact O-N 2.87Å; F343-C346 PolarHBondContact O-N 2.95Å; F343-S347 PolarHBondContact O-N 2.94Å; F343-S347 PolarHBondContact O-OG 3.06Å |
| 344 | L | 68.1 | Low | 61.7 | Low | 104 Ų | 104 | 91.6 Ų | 91.6 | 55% | 0.545 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -64.6 | -40.5 | 178.6 | -68.7 | 172.1 | 0 | 0 | 0 | 111.9 | R340 A348 | R340-L344 HydrophobicContact CG-CD1 3.8Å; R340-L344 HydrophobicContact CG-CG 4.4Å; R340-L344 WeakPolarHBondContact O-CB 3.14Å; R340-L344 VanDerWaalsContact O-CG 3.27Å; R340-L344 WeakPolarHBondContact O-CG 3.44Å; R340-L344 PolarHBondContact O-N 3.25Å; L344-A348 VanDerWaalsContact O-CB 3.31Å; L344-A348 WeakPolarHBondContact O-CB 3.4Å; L344-A348 PolarHBondContact O-N 3.08Å |
| 345 | C | 59.8 | Low | 60.2 | Low | 53 Ų | 53 | 93.5 Ų | 93.5 | 36% | 0.358 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -69.6 | -34 | 175.1 | -71.7 | 0 | 0 | 0 | 0 | 113 | Q341 N342 F343 R349 | Q341-C345 VanDerWaalsContact O-CB 3.22Å; Q341-C345 WeakPolarHBondContact O-CB 3.15Å; Q341-C345 PolarHBondContact O-N 3.3Å; Q341-C345 PolarHBondContact O-SG 2.95Å; N342-C345 PolarHBondContact O-N 2.95Å; F343-C345 PolarHBondContact O-N 2.87Å; C345-R349 WeakPolarHBondContact O-CB 3.44Å; C345-R349 VanDerWaalsContact O-CG 3.23Å; C345-R349 WeakPolarHBondContact O-CG 3.41Å; C345-R349 PolarHBondContact O-N 3Å |
| 346 | C | 56.9 | Low | 58.9 | Low | 78 Ų | 78 | 97.7 Ų | 97.7 | 53% | 0.527 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -69.7 | -43.8 | 174.1 | -77.3 | 0 | 0 | 0 | 0 | 111.4 | N342 F343 A348 R349 Y350 | N342-C346 VanDerWaalsContact O-CB 3.22Å; N342-C346 WeakPolarHBondContact O-CB 3.44Å; N342-C346 PolarHBondContact O-N 3.13Å; N342-C346 PolarHBondContact O-SG 2.74Å; F343-C346 PolarHBondContact O-N 2.95Å; C346-A348 PolarHBondContact O-N 3.34Å; C346-R349 PolarHBondContact O-N 3.33Å; C346-Y350 VanDerWaalsContact O-CB 3.31Å; C346-Y350 WeakPolarHBondContact O-CB 3.18Å; C346-Y350 PolarHBondContact O-N 2.84Å |
| 347 | S | 55.8 | Low | 57.1 | Low | 63 Ų | 63 | 105.8 Ų | 105.8 | 44% | 0.441 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -60.5 | -43.9 | 172.6 | -64.7 | 0 | 0 | 0 | 0 | 111.7 | F343 R349 Y350 L351 | F343-S347 PolarHBondContact O-N 2.94Å; F343-S347 PolarHBondContact O-OG 3.06Å; S347-R349 PolarHBondContact O-N 3.31Å; S347-Y350 PolarHBondContact O-N 3.39Å; S347-L351 WeakPolarHBondContact O-CB 3.26Å; S347-L351 PolarHBondContact O-N 2.98Å |
| 348 | A | 52.6 | Low | 55.4 | Low | 60 Ų | 60 | 105.9 Ų | 105.9 | 50% | 0.496 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -63.6 | -37.5 | 175.9 | 0 | 0 | 0 | 0 | 0 | 113 | L344 C346 K352 | L344-A348 VanDerWaalsContact O-CB 3.31Å; L344-A348 WeakPolarHBondContact O-CB 3.4Å; L344-A348 PolarHBondContact O-N 3.08Å; C346-A348 PolarHBondContact O-N 3.34Å; A348-K352 VanDerWaalsContact O-CB 3.26Å; A348-K352 WeakPolarHBondContact O-CB 3.42Å; A348-K352 PolarHBondContact O-N 3.05Å |
| 349 | R | 50.1 | Low | 53.8 | Low | 184 Ų | 184 | 111.8 Ų | 111.8 | 69% | 0.694 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -72.4 | -34 | 174 | -74 | 175.1 | -168 | -173.9 | 5.2 | 112.7 | C345 C346 S347 K352 S353 | C345-R349 WeakPolarHBondContact O-CB 3.44Å; C345-R349 VanDerWaalsContact O-CG 3.23Å; C345-R349 WeakPolarHBondContact O-CG 3.41Å; C345-R349 PolarHBondContact O-N 3Å; C346-R349 PolarHBondContact O-N 3.33Å; S347-R349 PolarHBondContact O-N 3.31Å; R349-K352 PolarHBondContact O-N 3Å; R349-S353 WeakPolarHBondContact O-CB 3.44Å; R349-S353 PolarHBondContact O-N 3.15Å |
| 350 | Y | 49.7 | Very low | 52.2 | Low | 189 Ų | 189 | 118.6 Ų | 118.6 | 74% | 0.741 | 59% | 0.594 | S | S | * | * | H | α-helix | trans | -68.6 | -46.9 | 177 | -162.1 | -96 | 0 | 0 | 0 | 110.5 | C346 S347 K352 S353 S354 | C346-Y350 VanDerWaalsContact O-CB 3.31Å; C346-Y350 WeakPolarHBondContact O-CB 3.18Å; C346-Y350 PolarHBondContact O-N 2.84Å; S347-Y350 PolarHBondContact O-N 3.39Å; Y350-K352 PolarHBondContact O-N 3.05Å; Y350-S353 WeakPolarHBondContact O-CB 3.36Å; Y350-S353 PolarHBondContact O-N 2.86Å; Y350-S353 VanDerWaalsContact O-N 3.17Å; Y350-S354 PolarHBondContact O-N 3.43Å; Y350-S354 PolarHBondContact O-OG 3.33Å |
| 351 | L | 51.1 | Low | 50.4 | Low | 114 Ų | 114 | 117.4 Ų | 117.4 | 60% | 0.597 | 60% | 0.6 | S | S | * | * | H | α-helix | trans | -58.6 | -44.3 | 171.1 | -94 | 131.6 | 0 | 0 | 0 | 112.4 | S347 S353 S354 Q355 | S347-L351 WeakPolarHBondContact O-CB 3.26Å; S347-L351 PolarHBondContact O-N 2.98Å; L351-S353 VanDerWaalsContact C-N 3.31Å; L351-S353 PolarHBondContact O-N 3.37Å; L351-S354 WeakPolarHBondContact CA-OG 3.41Å; L351-S354 PolarHBondContact O-N 2.8Å; L351-S354 PolarHBondContact O-OG 3.37Å; L351-Q355 PolarHBondContact O-N 3.18Å |
| 352 | K | 47.1 | Very low | 48.7 | Very low | 147 Ų | 147 | 122.1 Ų | 122.1 | 64% | 0.639 | 62% | 0.619 | S | S | * | * | H | α-helix | trans | -66.8 | -32.6 | 176.3 | -164.7 | 166.2 | -174.4 | 172.9 | 0 | 112.6 | A348 R349 Y350 Q355 C356 | A348-K352 VanDerWaalsContact O-CB 3.26Å; A348-K352 WeakPolarHBondContact O-CB 3.42Å; A348-K352 PolarHBondContact O-N 3.05Å; R349-K352 PolarHBondContact O-N 3Å; Y350-K352 PolarHBondContact O-N 3.05Å; K352-Q355 PolarHBondContact O-N 3.35Å; K352-C356 WeakPolarHBondContact O-CB 3.39Å; K352-C356 PolarHBondContact O-N 3.39Å; K352-C356 PolarHBondContact O-SG 2.85Å; K352-C356 VanDerWaalsContact O-SG 3.38Å |
| 353 | S | 47.2 | Very low | 47.2 | Very low | 74 Ų | 74 | 126.3 Ų | 126.3 | 52% | 0.517 | 64% | 0.642 | S | S | . | * | H | α-helix | trans | -71.4 | -32.2 | 174.7 | -176.7 | 0 | 0 | 0 | 0 | 113.1 | R349 Y350 L351 | R349-S353 WeakPolarHBondContact O-CB 3.44Å; R349-S353 PolarHBondContact O-N 3.15Å; Y350-S353 WeakPolarHBondContact O-CB 3.36Å; Y350-S353 PolarHBondContact O-N 2.86Å; Y350-S353 VanDerWaalsContact O-N 3.17Å; L351-S353 VanDerWaalsContact C-N 3.31Å; L351-S353 PolarHBondContact O-N 3.37Å |
| 354 | S | 46.3 | Very low | 45.7 | Very low | 65 Ų | 65 | 125.9 Ų | 125.9 | 46% | 0.455 | 65% | 0.654 | S | S | . | * | H | α-helix | trans | -72.4 | -35.2 | 170.3 | 44.3 | 0 | 0 | 0 | 0 | 112.3 | Y350 L351 | Y350-S354 PolarHBondContact O-N 3.43Å; Y350-S354 PolarHBondContact O-OG 3.33Å; L351-S354 WeakPolarHBondContact CA-OG 3.41Å; L351-S354 PolarHBondContact O-N 2.8Å; L351-S354 PolarHBondContact O-OG 3.37Å |
| 355 | Q | 43 | Very low | 44.2 | Very low | 139 Ų | 139 | 125.2 Ų | 125.2 | 65% | 0.65 | 66% | 0.658 | S | S | * | * | H | α-helix | trans | -75.3 | -40.9 | -178.4 | -156.2 | 158.4 | 4.9 | 0 | 0 | 112.1 | L351 K352 R357 C358 | L351-Q355 PolarHBondContact O-N 3.18Å; K352-Q355 PolarHBondContact O-N 3.35Å; Q355-R357 PolarHBondContact O-N 3.37Å; Q355-R357 VanDerWaalsContact O-N 3.07Å; Q355-C358 PolarHBondContact O-N 3.06Å |
| 356 | C | 40.1 | Very low | 43 | Very low | 89 Ų | 89 | 130.3 Ų | 130.3 | 60% | 0.601 | 68% | 0.676 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71.7 | 5.9 | 174.9 | -64.7 | 0 | 0 | 0 | 0 | 115.2 | K352 | K352-C356 WeakPolarHBondContact O-CB 3.39Å; K352-C356 PolarHBondContact O-N 3.39Å; K352-C356 PolarHBondContact O-SG 2.85Å; K352-C356 VanDerWaalsContact O-SG 3.38Å |
| 357 | R | 34.1 | Very low | 41.9 | Very low | 201 Ų | 201 | 135.3 Ų | 135.3 | 76% | 0.758 | 69% | 0.689 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -102.6 | -12.7 | 176.3 | -170.1 | 171 | -77.2 | -120.5 | 0.3 | 113.5 | Q355 | Q355-R357 PolarHBondContact O-N 3.37Å; Q355-R357 VanDerWaalsContact O-N 3.07Å |
| 358 | C | 36.3 | Very low | 40.8 | Very low | 117 Ų | 117 | 137.6 Ų | 137.6 | 79% | 0.791 | 71% | 0.705 | S | S | * | * | S | Bend | trans | -98.5 | -2.9 | -179.8 | -62.9 | 0 | 0 | 0 | 0 | 114.3 | Q355 | Q355-C358 PolarHBondContact O-N 3.06Š|
| 359 | E | 36.7 | Very low | 39.9 | Very low | 173 Ų | 173 | 142.7 Ų | 142.7 | 81% | 0.808 | 72% | 0.724 | S | S | * | * | S | Bend | trans | -113.2 | 14.5 | -169.4 | -139 | 166.6 | 126.2 | 0 | 0 | 113.3 | ||
| 360 | H | 36.9 | Very low | 39.1 | Very low | 167 Ų | 167 | 139.5 Ų | 139.5 | 77% | 0.773 | 73% | 0.73 | S | S | * | * | S | Bend | trans | -123.2 | 5.3 | -174.3 | -146.5 | -57.1 | 0 | 0 | 0 | 115 | ||
| 361 | D | 37.2 | Very low | 38.3 | Very low | 147 Ų | 147 | 135.9 Ų | 135.9 | 79% | 0.786 | 73% | 0.732 | S | S | * | * | S | Bend | trans | -102.6 | 10.3 | 178.2 | -87.3 | -23 | 0 | 0 | 0 | 113.8 | ||
| 362 | F | 36.8 | Very low | 37.5 | Very low | 204 Ų | 204 | 137 Ų | 137 | 90% | 0.895 | 74% | 0.744 | S | S | * | * | S | Bend | trans | -132.1 | 48.3 | 179.4 | -106 | -81.6 | 0 | 0 | 0 | 113.7 | ||
| 363 | D | 35.3 | Very low | 37 | Very low | 160 Ų | 160 | 139.5 Ų | 139.5 | 86% | 0.856 | 76% | 0.755 | S | S | * | * | trans | -154 | 90.2 | 148 | -129.1 | -18.7 | 0 | 0 | 0 | 112.2 | ||||
| 364 | S | 37.6 | Very low | 36.2 | Very low | 115 Ų | 115 | 140.8 Ų | 140.8 | 80% | 0.804 | 77% | 0.771 | S | S | * | * | trans | -130.7 | 56 | -179.5 | 60.6 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 365 | S | 37.3 | Very low | 35.6 | Very low | 91 Ų | 91 | 145.3 Ų | 145.3 | 64% | 0.636 | 79% | 0.788 | S | S | * | * | trans | -166.2 | 122.3 | 137.5 | 57.4 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 366 | H | 34.5 | Very low | 35.2 | Very low | 160 Ų | 160 | 147.6 Ų | 147.6 | 74% | 0.741 | 80% | 0.796 | S | S | * | * | 171.1 | 129 | 121 | -103 | -113.1 | 0 | 0 | 0 | 111.4 | |||||
| 367 | K | 35.1 | Very low | 34.7 | Very low | 183 Ų | 183 | 148.9 Ų | 148.9 | 80% | 0.796 | 81% | 0.806 | S | S | * | * | trans | 26.8 | 131.9 | 135.6 | -72.8 | 176.6 | -179.2 | 176.7 | 0 | 118.4 | ||||
| 368 | S | 31.7 | Very low | 34.8 | Very low | 111 Ų | 111 | 145.4 Ų | 145.4 | 78% | 0.776 | 81% | 0.807 | S | S | * | * | cis | -167.3 | 170 | 26.4 | -93.9 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 369 | N | 34.2 | Very low | 34.5 | Very low | 166 Ų | 166 | 145.1 Ų | 145.1 | 89% | 0.888 | 81% | 0.806 | S | S | * | * | trans | -51.2 | 143.1 | 171.9 | -57.9 | -27.3 | 0 | 0 | 0 | 114.4 | ||||
| 370 | S | 32.4 | Very low | 34.4 | Very low | 118 Ų | 118 | 142.1 Ų | 142.1 | 83% | 0.825 | 80% | 0.804 | S | S | * | * | trans | -154.4 | 138.7 | 131.8 | -155.9 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 371 | S | 34 | Very low | 34.2 | Very low | 112 Ų | 112 | 141.2 Ų | 141.2 | 78% | 0.783 | 80% | 0.8 | S | S | * | * | trans | -109.8 | 128.9 | -174 | 53.7 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 372 | T | 33.2 | Very low | 33.9 | Very low | 138 Ų | 138 | 145 Ų | 145 | 85% | 0.847 | 80% | 0.804 | S | S | * | * | trans | -128.8 | 118.8 | 172.2 | -47.8 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 373 | F | 36.1 | Very low | 33.7 | Very low | 199 Ų | 199 | 139.8 Ų | 139.8 | 87% | 0.873 | 79% | 0.793 | S | S | * | * | trans | -70 | 143.2 | 173.1 | -105.6 | -110 | 0 | 0 | 0 | 111.5 | ||||
| 374 | A | 31.2 | Very low | 33.6 | Very low | 102 Ų | 102 | 140.4 Ų | 140.4 | 84% | 0.843 | 79% | 0.794 | S | S | * | * | trans | -144.1 | 116.5 | 161.2 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 375 | I | 33.6 | Very low | 33.5 | Very low | 160 Ų | 160 | 140.1 Ų | 140.1 | 82% | 0.821 | 79% | 0.788 | S | S | * | * | trans | -57.3 | 147.5 | -167.1 | -69.2 | 157.2 | 0 | 0 | 0 | 115.3 | ||||
| 376 | K | 33.9 | Very low | 33.3 | Very low | 187 Ų | 187 | 144.4 Ų | 144.4 | 81% | 0.813 | 80% | 0.798 | S | S | * | * | trans | -95.7 | 132.3 | 172.4 | -171.8 | -177.1 | -170.9 | 180 | 0 | 109.8 | ||||
| 377 | S | 30.5 | Very low | 33.3 | Very low | 115 Ų | 115 | 142.1 Ų | 142.1 | 80% | 0.804 | 80% | 0.795 | S | S | * | * | trans | -126.5 | 122.7 | 170.8 | 56.5 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 378 | T | 35.9 | Very low | 33.1 | Very low | 129 Ų | 129 | 137.8 Ų | 137.8 | 79% | 0.791 | 79% | 0.788 | S | S | * | * | trans | -135 | 127.2 | 175.4 | 18.5 | 0 | 0 | 0 | 0 | 109 | ||||
| 379 | S | 31.1 | Very low | 33.2 | Very low | 110 Ų | 110 | 138.8 Ų | 138.8 | 77% | 0.769 | 79% | 0.789 | S | S | * | * | trans | -147.5 | 122.1 | 171.8 | 51.8 | 0 | 0 | 0 | 0 | 106.6 | ||||
| 380 | S | 32.9 | Very low | 33.5 | Very low | 110 Ų | 110 | 141.3 Ų | 141.3 | 77% | 0.769 | 81% | 0.811 | S | S | * | * | cis | 62.9 | 134.2 | 48.8 | -154.4 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 381 | Q | 33.2 | Very low | 33.5 | Very low | 148 Ų | 148 | 142.5 Ų | 142.5 | 69% | 0.692 | 81% | 0.81 | S | S | * | * | cis | -110 | -147.8 | 1.6 | -61.5 | 177.4 | 3.2 | 0 | 0 | 109.4 | ||||
| 382 | R | 31.6 | Very low | 33.5 | Very low | 227 Ų | 227 | 144.1 Ų | 144.1 | 86% | 0.857 | 81% | 0.812 | S | S | * | * | cis | -157.2 | 166.9 | -1.2 | -150.2 | 165.5 | -171.4 | 160.4 | 5.1 | 110.7 | ||||
| 383 | S | 32.2 | Very low | 33.5 | Very low | 95 Ų | 95 | 144.4 Ų | 144.4 | 66% | 0.664 | 81% | 0.81 | S | S | * | * | trans | -112.7 | 154.1 | 175.8 | 55.2 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 384 | I | 33.2 | Very low | 33.4 | Very low | 172 Ų | 172 | 141.2 Ų | 141.2 | 88% | 0.882 | 81% | 0.806 | S | S | * | * | trans | -137.1 | 141.8 | 150.7 | -63.1 | -174 | 0 | 0 | 0 | 109.1 | ||||
| 385 | T | 35.2 | Very low | 33.5 | Very low | 109 Ų | 109 | 143.6 Ų | 143.6 | 67% | 0.669 | 80% | 0.804 | S | S | * | * | trans | -123.5 | 140.2 | -173.9 | -55.8 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 386 | Q | 33.4 | Very low | 33.5 | Very low | 181 Ų | 181 | 142.5 Ų | 142.5 | 85% | 0.846 | 80% | 0.803 | S | S | * | * | trans | -175.6 | 128.6 | 148.5 | -103.4 | 159 | 10.8 | 0 | 0 | 107.7 | ||||
| 387 | T | 34.7 | Very low | 33.5 | Very low | 112 Ų | 112 | 139.4 Ų | 139.4 | 69% | 0.687 | 80% | 0.802 | S | S | * | * | 52 | 125.3 | 51.3 | 59.7 | 0 | 0 | 0 | 0 | 113.6 | |||||
| 388 | S | 31.5 | Very low | 33.7 | Very low | 93 Ų | 93 | 141.2 Ų | 141.2 | 65% | 0.65 | 80% | 0.802 | S | S | * | * | cis | -164.6 | 167.7 | 3.3 | -83.7 | 0 | 0 | 0 | 0 | 111 | ||||
| 389 | T | 33.3 | Very low | 33.5 | Very low | 131 Ų | 131 | 142.3 Ų | 142.3 | 80% | 0.804 | 80% | 0.803 | S | S | * | * | trans | 45.3 | 116 | 147.8 | 51.9 | 0 | 0 | 0 | 0 | 121.3 | ||||
| 390 | T | 40.1 | Very low | 33.8 | Very low | 219 Ų | 219 | 145.2 Ų | 145.2 | 100% | 1.344 | 81% | 0.806 | S | S | * | * | -140.9 | 0 | 106.5 | 43.3 | 0 | 0 | 0 | 0 | 108.8 |
Retrieved 390 of 390 residues in 72.3 ms
(Link to these results)