| 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 | 59.8 | Low | 56.8 | Low | 223 Ų | 223 | 125.9 Ų | 125.9 | 100% | 1.099 | 66% | 0.661 | S | S | * | * | 0 | -21.9 | 0 | -64.2 | -169.1 | -150.3 | 0 | 0 | 114.6 | A3 | M1-A3 VanDerWaalsContact C-N 3.31Å; M1-A3 PolarHBondContact O-N 3.44Å | |||
| 2 | A | 58.4 | Low | 56.4 | Low | 87 Ų | 87 | 125.3 Ų | 125.3 | 72% | 0.719 | 67% | 0.666 | S | S | * | * | H | α-helix | trans | -62.6 | -25.2 | -175.7 | 0 | 0 | 0 | 0 | 0 | 116.4 | ||
| 3 | A | 58 | Low | 55.7 | Low | 84 Ų | 84 | 126.5 Ų | 126.5 | 69% | 0.694 | 67% | 0.673 | S | S | * | * | H | α-helix | trans | -70.5 | -34.5 | -176.9 | 0 | 0 | 0 | 0 | 0 | 114.2 | M1 F5 | M1-A3 VanDerWaalsContact C-N 3.31Å; M1-A3 PolarHBondContact O-N 3.44Å; A3-F5 PolarHBondContact O-N 2.68Å |
| 4 | L | 57.9 | Low | 55.6 | Low | 126 Ų | 126 | 127.6 Ų | 127.6 | 66% | 0.66 | 67% | 0.672 | S | S | * | * | H | α-helix | trans | -75.8 | -25.7 | -172.3 | -66.7 | 172.6 | 0 | 0 | 0 | 113.4 | N6 E7 | L4-N6 VanDerWaalsContact C-N 3.33Å; L4-N6 PolarHBondContact O-N 3.24Å; L4-E7 PolarHBondContact O-N 3.25Å |
| 5 | F | 55.6 | Low | 55.5 | Low | 145 Ų | 145 | 130.3 Ų | 130.3 | 64% | 0.636 | 68% | 0.68 | S | S | * | * | H | α-helix | trans | -67.8 | -32.3 | -180 | -169.3 | -103.3 | 0 | 0 | 0 | 112.7 | A3 E7 L9 | A3-F5 PolarHBondContact O-N 2.68Å; F5-E7 VanDerWaalsContact C-N 3.33Å; F5-E7 PolarHBondContact O-N 3.04Å; F5-L9 HydrophobicContact CD1-CD1 4.47Å; F5-L9 HydrophobicContact CE1-CD1 4.1Å |
| 6 | N | 55.9 | Low | 54.8 | Low | 115 Ų | 115 | 132.9 Ų | 132.9 | 62% | 0.615 | 69% | 0.688 | S | S | * | * | H | α-helix | trans | -73.5 | -22.7 | 177.3 | -82.1 | -77.1 | 0 | 0 | 0 | 113.2 | L4 | L4-N6 VanDerWaalsContact C-N 3.33Å; L4-N6 PolarHBondContact O-N 3.24Å |
| 7 | E | 58.1 | Low | 54.2 | Low | 100 Ų | 100 | 131.5 Ų | 131.5 | 47% | 0.467 | 69% | 0.688 | S | S | . | * | H | α-helix | trans | -76.6 | -35.2 | 178.1 | -155.1 | -174.8 | 136 | 0 | 0 | 111.8 | L4 F5 R10 K11 | L4-E7 PolarHBondContact O-N 3.25Å; F5-E7 VanDerWaalsContact C-N 3.33Å; F5-E7 PolarHBondContact O-N 3.04Å; E7-R10 PolarHBondContact O-N 3.09Å; E7-K11 PolarHBondContact O-N 3.48Å; E7-K11 WeakPolarHBondContact OE1-CE 3.37Å; E7-K11 IonicContact OE1-NZ 2.62Å; E7-K11 PolarHBondContact OE1-NZ 2.92Å |
| 8 | S | 55.6 | Low | 53.9 | Low | 77 Ų | 77 | 130.9 Ų | 130.9 | 54% | 0.538 | 69% | 0.694 | S | S | . | * | H | α-helix | trans | -63.6 | -39.5 | 174.8 | -64.5 | 0 | 0 | 0 | 0 | 113 | R10 K11 | S8-R10 VanDerWaalsContact C-N 3.27Å; S8-R10 PolarHBondContact O-N 3.21Å; S8-K11 PolarHBondContact O-N 3.32Å |
| 9 | L | 52.9 | Low | 53.2 | Low | 110 Ų | 110 | 130.6 Ų | 130.6 | 58% | 0.576 | 70% | 0.698 | S | S | * | * | H | α-helix | trans | -68 | -26.4 | 178.6 | -67.3 | 179.2 | 0 | 0 | 0 | 112.9 | F5 | F5-L9 HydrophobicContact CD1-CD1 4.47Å; F5-L9 HydrophobicContact CE1-CD1 4.1Å |
| 10 | R | 56.8 | Low | 52.5 | Low | 198 Ų | 198 | 131.7 Ų | 131.7 | 75% | 0.747 | 70% | 0.702 | S | S | * | * | H | α-helix | trans | -72.1 | -39.3 | 177.2 | -145.4 | 171.5 | -165.8 | 153.4 | 4.3 | 112.2 | E7 S8 V12 N13 | E7-R10 PolarHBondContact O-N 3.09Å; S8-R10 VanDerWaalsContact C-N 3.27Å; S8-R10 PolarHBondContact O-N 3.21Å; R10-V12 PolarHBondContact O-N 3.36Å; R10-N13 PolarHBondContact O-N 3.07Å |
| 11 | K | 55.9 | Low | 52.1 | Low | 120 Ų | 120 | 132 Ų | 132 | 52% | 0.522 | 70% | 0.702 | S | S | . | * | H | α-helix | trans | -78.2 | -13.5 | -175.4 | -67.5 | 177.4 | -173.3 | 173 | 0 | 114.9 | E7 S8 | E7-K11 PolarHBondContact O-N 3.48Å; E7-K11 WeakPolarHBondContact OE1-CE 3.37Å; E7-K11 IonicContact OE1-NZ 2.62Å; E7-K11 PolarHBondContact OE1-NZ 2.92Å; S8-K11 PolarHBondContact O-N 3.32Å |
| 12 | V | 51.7 | Low | 51.3 | Low | 119 Ų | 119 | 129.8 Ų | 129.8 | 72% | 0.721 | 69% | 0.689 | S | S | * | * | H | α-helix | trans | -81.2 | -28.9 | 172.2 | 178.3 | 0 | 0 | 0 | 0 | 111.6 | R10 E14 | R10-V12 PolarHBondContact O-N 3.36Å; V12-E14 PolarHBondContact O-N 3.08Å |
| 13 | N | 48 | Very low | 50.5 | Low | 141 Ų | 141 | 133.9 Ų | 133.9 | 75% | 0.754 | 69% | 0.694 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.4 | 5.1 | 179.1 | -157 | 96.3 | 0 | 0 | 0 | 113.4 | R10 | R10-N13 PolarHBondContact O-N 3.07Š|
| 14 | E | 54.3 | Low | 49.4 | Very low | 142 Ų | 142 | 136.3 Ų | 136.3 | 66% | 0.664 | 70% | 0.695 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -108.6 | 8.2 | -175.3 | -125.4 | 165.1 | -162.4 | 0 | 0 | 112.7 | V12 | V12-E14 PolarHBondContact O-N 3.08Š|
| 15 | Q | 54.3 | Low | 48.6 | Very low | 168 Ų | 168 | 138.1 Ų | 138.1 | 79% | 0.785 | 70% | 0.7 | S | S | * | * | trans | -122.4 | 20.4 | -172.6 | -143.9 | 89.6 | 105.3 | 0 | 0 | 114.6 | ||||
| 16 | Q | 43.8 | Very low | 47.8 | Very low | 172 Ų | 172 | 135.7 Ų | 135.7 | 80% | 0.804 | 70% | 0.697 | S | S | * | * | S | Bend | trans | -89.9 | 135.8 | 162.8 | -80.9 | -177.3 | -31.3 | 0 | 0 | 110 | ||
| 17 | P | 45 | Very low | 47.1 | Very low | 108 Ų | 108 | 135.8 Ų | 135.8 | 70% | 0.701 | 70% | 0.704 | S | S | * | * | P | Polyproline II helix | trans | -66.3 | 149.8 | 175.5 | 29.6 | -34.9 | 0 | 0 | 0 | 110.3 | T19 | P17-T19 PolarHBondContact O-N 3.06Å; P17-T19 VanDerWaalsContact O-N 3.12Å |
| 18 | P | 47.8 | Very low | 46.7 | Very low | 122 Ų | 122 | 140.7 Ų | 140.7 | 79% | 0.792 | 72% | 0.723 | S | S | * | * | P | Polyproline II helix | trans | -62.7 | 117.9 | -179.9 | 25.9 | -33.9 | 0 | 0 | 0 | 110.3 | I20 | P18-I20 PolarHBondContact O-N 2.99Š|
| 19 | T | 41.1 | Very low | 45.9 | Very low | 124 Ų | 124 | 148.7 Ų | 148.7 | 76% | 0.761 | 74% | 0.742 | S | S | * | * | P | Polyproline II helix | trans | -61.1 | 119 | 164 | 45.5 | 0 | 0 | 0 | 0 | 108.3 | P17 I21 | P17-T19 PolarHBondContact O-N 3.06Å; P17-T19 VanDerWaalsContact O-N 3.12Å; T19-I21 PolarHBondContact O-N 3.32Å |
| 20 | I | 38.8 | Very low | 45.6 | Very low | 153 Ų | 153 | 146.9 Ų | 146.9 | 79% | 0.785 | 74% | 0.743 | S | S | * | * | trans | -65 | 101.1 | 172.3 | -60 | 170.5 | 0 | 0 | 0 | 107.1 | P18 E22 | P18-I20 PolarHBondContact O-N 2.99Å; I20-E22 HydrophobicContact CG2-CG 4.19Å; I20-E22 PolarHBondContact O-N 3.22Å | ||
| 21 | I | 44.6 | Very low | 45.3 | Very low | 138 Ų | 138 | 145 Ų | 145 | 71% | 0.708 | 75% | 0.748 | S | S | * | * | trans | -77.6 | 111.1 | 158.5 | -60.2 | 176 | 0 | 0 | 0 | 104.5 | T19 E23 | T19-I21 PolarHBondContact O-N 3.32Å; I21-E23 VanDerWaalsContact C-N 3.35Å; I21-E23 PolarHBondContact O-N 3.01Å | ||
| 22 | E | 42 | Very low | 44.7 | Very low | 176 Ų | 176 | 149.8 Ų | 149.8 | 82% | 0.822 | 76% | 0.763 | S | S | * | * | trans | -68.2 | 98.9 | 165.7 | -68.1 | -172.6 | 147.7 | 0 | 0 | 107.3 | I20 D24 | I20-E22 HydrophobicContact CG2-CG 4.19Å; I20-E22 PolarHBondContact O-N 3.22Å; E22-D24 PolarHBondContact O-N 3.47Å | ||
| 23 | E | 42.1 | Very low | 44.6 | Very low | 174 Ų | 174 | 148.9 Ų | 148.9 | 81% | 0.813 | 76% | 0.759 | S | S | * | * | trans | -67.4 | 101.5 | 164.8 | -68.2 | -164.3 | 145.6 | 0 | 0 | 107.7 | I21 E25 | I21-E23 VanDerWaalsContact C-N 3.35Å; I21-E23 PolarHBondContact O-N 3.01Å; E23-E25 VanDerWaalsContact C-N 3.3Å; E23-E25 PolarHBondContact O-N 3.03Å | ||
| 24 | D | 35.6 | Very low | 44.9 | Very low | 134 Ų | 134 | 147.3 Ų | 147.3 | 72% | 0.717 | 76% | 0.757 | S | S | * | * | trans | -64.7 | 91.3 | 173.2 | -176.6 | 16.7 | 0 | 0 | 0 | 109.2 | E22 T26 | E22-D24 PolarHBondContact O-N 3.47Å; D24-T26 PolarHBondContact O-N 3.47Å; D24-T26 PolarHBondContact O-OG1 3.5Å | ||
| 25 | E | 41 | Very low | 44.7 | Very low | 165 Ų | 165 | 147.8 Ų | 147.8 | 77% | 0.771 | 76% | 0.764 | S | S | * | * | trans | -65.2 | 61.9 | 175.8 | -111.3 | -83.9 | 117.1 | 0 | 0 | 110.5 | E23 P27 | E23-E25 VanDerWaalsContact C-N 3.3Å; E23-E25 PolarHBondContact O-N 3.03Å; E25-P27 VanDerWaalsContact O-CD 3.27Å; E25-P27 WeakPolarHBondContact O-CD 3.25Å; E25-P27 VanDerWaalsContact O-N 3.15Å | ||
| 26 | T | 39.3 | Very low | 44.5 | Very low | 94 Ų | 94 | 146.1 Ų | 146.1 | 58% | 0.577 | 76% | 0.76 | S | S | * | * | trans | -61.2 | 111.5 | 172.3 | 37.2 | 0 | 0 | 0 | 0 | 108.4 | D24 K28 | D24-T26 PolarHBondContact O-N 3.47Å; D24-T26 PolarHBondContact O-OG1 3.5Å; T26-K28 PolarHBondContact O-N 3.21Å; T26-K28 VanDerWaalsContact O-N 3.08Å | ||
| 27 | P | 41.3 | Very low | 44.8 | Very low | 116 Ų | 116 | 146.2 Ų | 146.2 | 75% | 0.753 | 76% | 0.76 | S | S | * | * | trans | -65.5 | 119.5 | -169.9 | 24.3 | -33.5 | 0 | 0 | 0 | 109.7 | E25 R29 | E25-P27 VanDerWaalsContact O-CD 3.27Å; E25-P27 WeakPolarHBondContact O-CD 3.25Å; E25-P27 VanDerWaalsContact O-N 3.15Å; P27-R29 VanDerWaalsContact C-N 3.33Å; P27-R29 PolarHBondContact O-N 3.28Å | ||
| 28 | K | 48.5 | Very low | 44.6 | Very low | 203 Ų | 203 | 144.3 Ų | 144.3 | 88% | 0.883 | 76% | 0.76 | S | S | * | * | trans | -56.1 | 90.1 | 180 | -74.3 | 169.8 | 180 | 154.3 | 0 | 111 | T26 A30 | T26-K28 PolarHBondContact O-N 3.21Å; T26-K28 VanDerWaalsContact O-N 3.08Å; K28-A30 VanDerWaalsContact C-N 3.28Å; K28-A30 PolarHBondContact O-N 3.45Å | ||
| 29 | R | 38.6 | Very low | 44.1 | Very low | 245 Ų | 245 | 147.3 Ų | 147.3 | 93% | 0.925 | 76% | 0.761 | S | S | * | * | trans | -74.2 | 83.5 | 178.3 | -168.4 | 174.5 | -173.1 | 166.6 | 4.3 | 110.2 | P27 | P27-R29 VanDerWaalsContact C-N 3.33Å; P27-R29 PolarHBondContact O-N 3.28Å | ||
| 30 | A | 47.4 | Very low | 44.1 | Very low | 73 Ų | 73 | 146.8 Ų | 146.8 | 60% | 0.603 | 76% | 0.762 | S | S | * | * | trans | -54 | 150.7 | 171.7 | 0 | 0 | 0 | 0 | 0 | 111.7 | K28 | K28-A30 VanDerWaalsContact C-N 3.28Å; K28-A30 PolarHBondContact O-N 3.45Å | ||
| 31 | N | 51 | Low | 44.3 | Very low | 159 Ų | 159 | 146.9 Ų | 146.9 | 85% | 0.85 | 76% | 0.763 | S | S | * | * | trans | 60.9 | 73.1 | 166.9 | -55.2 | -27.6 | 0 | 0 | 0 | 116.2 | ||||
| 32 | R | 41.5 | Very low | 44.2 | Very low | 219 Ų | 219 | 146.8 Ų | 146.8 | 83% | 0.826 | 76% | 0.763 | S | S | * | * | trans | -84.5 | 123.5 | 149.4 | 179 | -178.1 | -105.3 | 173 | -6.4 | 108.1 | ||||
| 33 | P | 50.5 | Low | 44.2 | Very low | 100 Ų | 100 | 146.1 Ų | 146.1 | 65% | 0.649 | 77% | 0.765 | S | S | * | * | trans | -67.1 | 153.5 | 174.3 | 28.7 | -34.2 | 0 | 0 | 0 | 111.1 | D35 | P33-D35 VanDerWaalsContact C-N 3.29Å; P33-D35 PolarHBondContact O-N 3.14Å; P33-D35 VanDerWaalsContact O-N 3.14Å | ||
| 34 | P | 54 | Low | 43.8 | Very low | 109 Ų | 109 | 144.5 Ų | 144.5 | 71% | 0.708 | 76% | 0.757 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.3 | -8.1 | -161.4 | 27 | -35.8 | 0 | 0 | 0 | 116.7 | L36 | P34-L36 PolarHBondContact O-N 2.77Š|
| 35 | D | 49.9 | Very low | 43.7 | Very low | 152 Ų | 152 | 146.9 Ų | 146.9 | 81% | 0.813 | 76% | 0.761 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89.4 | 14.5 | -160.8 | -156.1 | 30.4 | 0 | 0 | 0 | 115.8 | P33 | P33-D35 VanDerWaalsContact C-N 3.29Å; P33-D35 PolarHBondContact O-N 3.14Å; P33-D35 VanDerWaalsContact O-N 3.14Å |
| 36 | L | 51.2 | Low | 43.3 | Very low | 133 Ų | 133 | 149.9 Ų | 149.9 | 70% | 0.696 | 77% | 0.766 | S | S | * | * | trans | -136.4 | 54 | 179.9 | -74.4 | 177.1 | 0 | 0 | 0 | 112.8 | P34 G38 | P34-L36 PolarHBondContact O-N 2.77Å; L36-G38 VanDerWaalsContact C-N 3.34Å | ||
| 37 | Q | 49 | Very low | 43.2 | Very low | 174 Ų | 174 | 155.1 Ų | 155.1 | 81% | 0.813 | 78% | 0.775 | S | S | * | * | trans | -87.5 | 0.5 | 170 | -60 | -170.5 | 32.9 | 0 | 0 | 113.5 | ||||
| 38 | G | 41.4 | Very low | 42.8 | Very low | 67 Ų | 67 | 155 Ų | 155 | 69% | 0.691 | 78% | 0.776 | S | S | * | * | S | Bend | trans | -85.8 | -13.8 | -172.4 | 0 | 0 | 0 | 0 | 0 | 117 | L36 | L36-G38 VanDerWaalsContact C-N 3.34Š|
| 39 | F | 37.7 | Very low | 42 | Very low | 186 Ų | 186 | 149.7 Ų | 149.7 | 82% | 0.816 | 77% | 0.765 | S | S | * | * | trans | -125.4 | 84.7 | -175.2 | -70.7 | -78 | 0 | 0 | 0 | 111.9 | I41 | F39-I41 PolarHBondContact O-N 3.49Š| ||
| 40 | S | 40.2 | Very low | 41.5 | Very low | 112 Ų | 112 | 144 Ų | 144 | 78% | 0.783 | 76% | 0.761 | S | S | * | * | trans | -72.6 | 106.8 | 160.1 | -64.1 | 0 | 0 | 0 | 0 | 108.4 | L42 | S40-L42 PolarHBondContact O-N 2.91Š| ||
| 41 | I | 43.7 | Very low | 40.9 | Very low | 156 Ų | 156 | 145.2 Ų | 145.2 | 80% | 0.8 | 77% | 0.766 | S | S | * | * | trans | -61.6 | 131.7 | 159.1 | -68.6 | 174.4 | 0 | 0 | 0 | 106.3 | F39 D43 | F39-I41 PolarHBondContact O-N 3.49Å; I41-D43 PolarHBondContact O-N 3.25Å | ||
| 42 | L | 42.2 | Very low | 40.4 | Very low | 135 Ų | 135 | 144.7 Ų | 144.7 | 71% | 0.707 | 76% | 0.763 | S | S | * | * | trans | -71 | 114.4 | -177.5 | -142.3 | 72.2 | 0 | 0 | 0 | 108.8 | S40 E44 | S40-L42 PolarHBondContact O-N 2.91Å; L42-E44 HydrophobicContact CB-CG 4.28Å; L42-E44 HydrophobicContact CD2-CG 4.1Å; L42-E44 HydrophobicContact CG-CG 4.46Å; L42-E44 PolarHBondContact O-N 3.31Å | ||
| 43 | D | 42.4 | Very low | 40.1 | Very low | 163 Ų | 163 | 141.4 Ų | 141.4 | 87% | 0.872 | 76% | 0.762 | S | S | * | * | trans | -68.6 | 82.2 | 165.7 | -86.4 | -56.2 | 0 | 0 | 0 | 108.6 | I41 K45 | I41-D43 PolarHBondContact O-N 3.25Å; D43-K45 PolarHBondContact O-N 3.17Å | ||
| 44 | E | 33.9 | Very low | 39.7 | Very low | 139 Ų | 139 | 141.4 Ų | 141.4 | 65% | 0.65 | 76% | 0.764 | S | S | * | * | trans | -68.3 | 84.8 | 175.3 | -72.2 | -158.4 | 138.6 | 0 | 0 | 110.1 | L42 W46 | L42-E44 HydrophobicContact CB-CG 4.28Å; L42-E44 HydrophobicContact CD2-CG 4.1Å; L42-E44 HydrophobicContact CG-CG 4.46Å; L42-E44 PolarHBondContact O-N 3.31Å; E44-W46 VanDerWaalsContact C-N 3.32Å; E44-W46 PolarHBondContact O-N 2.89Å | ||
| 45 | K | 33.8 | Very low | 38.8 | Very low | 184 Ų | 184 | 144.3 Ų | 144.3 | 80% | 0.8 | 77% | 0.774 | S | S | * | * | trans | -59.3 | 89.7 | 172.5 | -176 | 174.6 | -175.5 | 168.8 | 0 | 110 | D43 R47 | D43-K45 PolarHBondContact O-N 3.17Å; K45-R47 VanDerWaalsContact C-N 3.3Å; K45-R47 PolarHBondContact O-N 3.06Å | ||
| 46 | W | 32 | Very low | 38.4 | Very low | 229 Ų | 229 | 143.6 Ų | 143.6 | 87% | 0.867 | 77% | 0.77 | S | S | * | * | trans | -57.8 | 88.3 | 173.5 | -80.1 | 86.9 | 0 | 0 | 0 | 111.1 | E44 S48 | E44-W46 VanDerWaalsContact C-N 3.32Å; E44-W46 PolarHBondContact O-N 2.89Å; W46-S48 PolarHBondContact O-N 3.44Å; W46-S48 VanDerWaalsContact O-N 3.1Å | ||
| 47 | R | 36.9 | Very low | 37.9 | Very low | 204 Ų | 204 | 142.2 Ų | 142.2 | 77% | 0.77 | 77% | 0.772 | S | S | * | * | trans | -73.9 | 96.2 | 169.9 | -73.8 | -172.2 | 65.8 | -168 | -1.7 | 108.8 | K45 S49 | K45-R47 VanDerWaalsContact C-N 3.3Å; K45-R47 PolarHBondContact O-N 3.06Å; R47-S49 PolarHBondContact O-N 3.3Å | ||
| 48 | S | 32.5 | Very low | 37.5 | Very low | 112 Ų | 112 | 141.8 Ų | 141.8 | 78% | 0.783 | 77% | 0.774 | S | S | * | * | trans | -61.2 | 99 | 159.9 | -63.8 | 0 | 0 | 0 | 0 | 109.3 | W46 C50 | W46-S48 PolarHBondContact O-N 3.44Å; W46-S48 VanDerWaalsContact O-N 3.1Å; S48-C50 PolarHBondContact O-N 3.5Å | ||
| 49 | S | 31.2 | Very low | 37.8 | Very low | 93 Ų | 93 | 144.4 Ų | 144.4 | 65% | 0.65 | 78% | 0.779 | S | S | * | * | trans | -87.2 | 85.4 | 167.4 | -66.6 | 0 | 0 | 0 | 0 | 109.2 | R47 S51 | R47-S49 PolarHBondContact O-N 3.3Å; S49-S51 PolarHBondContact O-N 3.38Å | ||
| 50 | C | 29 | Very low | 37.8 | Very low | 124 Ų | 124 | 142.6 Ų | 142.6 | 84% | 0.838 | 78% | 0.782 | S | S | * | * | trans | -77.8 | 101.7 | 156.4 | -61.3 | 0 | 0 | 0 | 0 | 106.8 | S48 | S48-C50 PolarHBondContact O-N 3.5Š| ||
| 51 | S | 35.3 | Very low | 37.4 | Very low | 100 Ų | 100 | 140.9 Ų | 140.9 | 70% | 0.699 | 78% | 0.782 | S | S | * | * | trans | -72.5 | 131 | 164.3 | -70.5 | 0 | 0 | 0 | 0 | 108.7 | S49 | S49-S51 PolarHBondContact O-N 3.38Š| ||
| 52 | D | 40.3 | Very low | 37.1 | Very low | 147 Ų | 147 | 137.8 Ų | 137.8 | 79% | 0.786 | 78% | 0.775 | S | S | * | * | trans | -93 | 115.1 | 170.7 | -164.8 | -2.7 | 0 | 0 | 0 | 106.9 | ||||
| 53 | D | 35.3 | Very low | 36.7 | Very low | 151 Ų | 151 | 142.1 Ų | 142.1 | 81% | 0.807 | 78% | 0.784 | S | S | * | * | trans | -125.5 | 91.2 | -179.2 | -90.1 | -59 | 0 | 0 | 0 | 108.3 | ||||
| 54 | S | 41 | Very low | 36.5 | Very low | 100 Ų | 100 | 142 Ų | 142 | 70% | 0.699 | 78% | 0.781 | S | S | * | * | trans | -121.2 | 98.3 | 172.3 | -65.3 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 55 | D | 35.9 | Very low | 36.4 | Very low | 169 Ų | 169 | 140.2 Ų | 140.2 | 90% | 0.904 | 78% | 0.784 | S | S | * | * | trans | -159 | 169 | 145.2 | -128 | -34.4 | 0 | 0 | 0 | 114.3 | ||||
| 56 | D | 42.3 | Very low | 36.6 | Very low | 137 Ų | 137 | 138 Ų | 138 | 73% | 0.733 | 79% | 0.786 | S | S | * | * | trans | -84.2 | 172.2 | -153 | -149.9 | -68.3 | 0 | 0 | 0 | 117.2 | ||||
| 57 | S | 39.2 | Very low | 36.6 | Very low | 105 Ų | 105 | 131.7 Ų | 131.7 | 73% | 0.734 | 78% | 0.783 | S | S | * | * | trans | 81.8 | 121.7 | 148.6 | -76.1 | 0 | 0 | 0 | 0 | 121.8 | ||||
| 58 | L | 40.4 | Very low | 36.6 | Very low | 164 Ų | 164 | 131.5 Ų | 131.5 | 86% | 0.859 | 79% | 0.791 | S | S | * | * | trans | -84.4 | 165.2 | 165.2 | -56.1 | 172.1 | 0 | 0 | 0 | 110.5 | ||||
| 59 | P | 48.9 | Very low | 36.8 | Very low | 122 Ų | 122 | 134.9 Ų | 134.9 | 79% | 0.792 | 79% | 0.791 | S | S | * | * | -146.7 | 145.3 | 92.5 | 36.4 | -20.3 | 0 | 0 | 0 | 116.9 | |||||
| 60 | V | 37.9 | Very low | 37.2 | Very low | 148 Ų | 148 | 136.5 Ų | 136.5 | 90% | 0.897 | 80% | 0.8 | S | S | * | * | trans | 22.7 | 112.8 | 142.3 | -170.5 | 0 | 0 | 0 | 0 | 118.6 | ||||
| 61 | G | 32.1 | Very low | 37.5 | Very low | 76 Ų | 76 | 138.1 Ų | 138.1 | 78% | 0.784 | 80% | 0.799 | S | S | * | * | trans | -174.9 | 122.9 | 163.6 | 0 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 62 | S | 35.9 | Very low | 37.5 | Very low | 92 Ų | 92 | 144.5 Ų | 144.5 | 64% | 0.643 | 81% | 0.808 | S | S | * | * | trans | -70.5 | 143.9 | 176.5 | 51.7 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 63 | Y | 35.2 | Very low | 37.1 | Very low | 226 Ų | 226 | 146.1 Ų | 146.1 | 89% | 0.886 | 81% | 0.808 | S | S | * | * | 179.6 | 162.8 | 109.3 | -95.7 | -66.5 | 0 | 0 | 0 | 111.9 | |||||
| 64 | I | 36.8 | Very low | 36.9 | Very low | 160 Ų | 160 | 144.5 Ų | 144.5 | 82% | 0.821 | 81% | 0.807 | S | S | * | * | trans | -103.4 | 124.6 | -176.7 | -60.9 | 168.7 | 0 | 0 | 0 | 110.1 | ||||
| 65 | S | 32.1 | Very low | 36.7 | Very low | 102 Ų | 102 | 148 Ų | 148 | 71% | 0.713 | 81% | 0.81 | S | S | * | * | trans | -176.8 | 133.4 | 140.4 | -88.3 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 66 | T | 37.8 | Very low | 36.5 | Very low | 136 Ų | 136 | 145.2 Ų | 145.2 | 83% | 0.834 | 80% | 0.804 | S | S | * | * | trans | 42.1 | 102.9 | 143 | 63.4 | 0 | 0 | 0 | 0 | 121.1 | ||||
| 67 | A | 33.2 | Very low | 36.2 | Very low | 98 Ų | 98 | 144.2 Ų | 144.2 | 81% | 0.81 | 80% | 0.802 | S | S | * | * | -164.8 | 126.6 | 129.2 | 0 | 0 | 0 | 0 | 0 | 110.4 | |||||
| 68 | E | 36.9 | Very low | 35.9 | Very low | 199 Ų | 199 | 145.4 Ų | 145.4 | 93% | 0.93 | 80% | 0.8 | S | S | * | * | trans | -81.6 | 126.9 | 178.9 | -63.1 | -179.6 | 135 | 0 | 0 | 111.7 | ||||
| 69 | K | 37 | Very low | 35.4 | Very low | 184 Ų | 184 | 146.6 Ų | 146.6 | 80% | 0.8 | 80% | 0.799 | S | S | * | * | trans | -139 | 138.8 | 161.1 | -70.2 | -175.2 | -179.5 | 172.7 | 0 | 108.8 | ||||
| 70 | P | 38.7 | Very low | 34.9 | Very low | 127 Ų | 127 | 151.1 Ų | 151.1 | 83% | 0.825 | 80% | 0.8 | S | S | * | * | trans | -72.3 | 134.4 | -167.2 | 27.4 | -34.9 | 0 | 0 | 0 | 112.8 | R72 | P70-R72 PolarHBondContact O-N 3.32Š| ||
| 71 | L | 35 | Very low | 34.8 | Very low | 157 Ų | 157 | 149.9 Ų | 149.9 | 82% | 0.822 | 80% | 0.795 | S | S | * | * | trans | -60.6 | 124 | 171.1 | -90.8 | 62.8 | 0 | 0 | 0 | 110.3 | F73 | L71-F73 PolarHBondContact O-N 2.85Š| ||
| 72 | R | 35.5 | Very low | 34.7 | Very low | 235 Ų | 235 | 154.8 Ų | 154.8 | 89% | 0.887 | 80% | 0.803 | S | S | * | * | trans | -75.3 | 113.1 | 164.5 | -73.9 | -168.4 | 177.5 | -164.6 | 1.6 | 109.3 | P70 C74 | P70-R72 PolarHBondContact O-N 3.32Å; R72-C74 PolarHBondContact O-N 2.74Å | ||
| 73 | F | 32.4 | Very low | 34.5 | Very low | 180 Ų | 180 | 160.5 Ų | 160.5 | 79% | 0.789 | 81% | 0.81 | S | S | * | * | trans | -73.6 | 102.3 | 167.5 | -109.6 | -90.3 | 0 | 0 | 0 | 110 | L71 K75 | L71-F73 PolarHBondContact O-N 2.85Å; F73-K75 PolarHBondContact O-N 2.79Å | ||
| 74 | C | 31.3 | Very low | 34.4 | Very low | 117 Ų | 117 | 161.1 Ų | 161.1 | 79% | 0.791 | 81% | 0.811 | S | S | * | * | trans | -81.9 | 107.2 | 170.2 | -66.4 | 0 | 0 | 0 | 0 | 110 | R72 | R72-C74 PolarHBondContact O-N 2.74Š| ||
| 75 | K | 35.7 | Very low | 34.1 | Very low | 175 Ų | 175 | 160.3 Ų | 160.3 | 76% | 0.761 | 80% | 0.803 | S | S | * | * | trans | -138.3 | 113.3 | 162 | -75.3 | -168.7 | 175.6 | -177.9 | 0 | 109.6 | F73 | F73-K75 PolarHBondContact O-N 2.79Š| ||
| 76 | S | 32.8 | Very low | 34.2 | Very low | 110 Ų | 110 | 159.1 Ų | 159.1 | 77% | 0.769 | 80% | 0.8 | S | S | * | * | trans | -65.2 | 142.3 | 173.7 | -51.2 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 77 | V | 35.6 | Very low | 34.5 | Very low | 116 Ų | 116 | 158.7 Ų | 158.7 | 70% | 0.703 | 80% | 0.8 | S | S | * | * | trans | -116.6 | 91.2 | 166.7 | -179.3 | 0 | 0 | 0 | 0 | 107.1 | F79 | V77-F79 HydrophobicContact CG1-CD2 4.07Å; V77-F79 HydrophobicContact CG1-CE2 3.92Å; V77-F79 PolarHBondContact O-N 2.84Å | ||
| 78 | D | 33.7 | Very low | 34.4 | Very low | 129 Ų | 129 | 161.8 Ų | 161.8 | 69% | 0.69 | 80% | 0.802 | S | S | * | * | trans | -70.7 | 92.3 | -177.8 | -74.7 | -4.4 | 0 | 0 | 0 | 111.1 | R80 | D78-R80 VanDerWaalsContact C-N 3.26Å; D78-R80 PolarHBondContact O-N 3.23Å | ||
| 79 | F | 29 | Very low | 34.7 | Very low | 190 Ų | 190 | 160.6 Ų | 160.6 | 83% | 0.833 | 80% | 0.801 | S | S | * | * | trans | -70.2 | 83 | 164.7 | -88.5 | -87.5 | 0 | 0 | 0 | 110.3 | V77 P81 | V77-F79 HydrophobicContact CG1-CD2 4.07Å; V77-F79 HydrophobicContact CG1-CE2 3.92Å; V77-F79 PolarHBondContact O-N 2.84Å; F79-P81 VanDerWaalsContact O-CD 3.32Å; F79-P81 WeakPolarHBondContact O-CD 3.36Å | ||
| 80 | R | 39.3 | Very low | 34.7 | Very low | 216 Ų | 216 | 158.4 Ų | 158.4 | 82% | 0.815 | 80% | 0.804 | S | S | * | * | trans | -72.3 | 120 | 164.6 | -70.6 | -172.5 | 178.8 | -127.1 | -1.1 | 109.6 | D78 L82 | D78-R80 VanDerWaalsContact C-N 3.26Å; D78-R80 PolarHBondContact O-N 3.23Å; R80-L82 PolarHBondContact O-N 2.84Å | ||
| 81 | P | 34.4 | Very low | 34.5 | Very low | 123 Ų | 123 | 155.9 Ų | 155.9 | 80% | 0.799 | 80% | 0.8 | S | S | * | * | trans | -65.7 | 132.4 | 167.5 | -17.4 | 32.4 | 0 | 0 | 0 | 109.6 | F79 R83 | F79-P81 VanDerWaalsContact O-CD 3.32Å; F79-P81 WeakPolarHBondContact O-CD 3.36Å; P81-R83 PolarHBondContact O-N 2.83Å | ||
| 82 | L | 31.2 | Very low | 34.2 | Very low | 178 Ų | 178 | 156.7 Ų | 156.7 | 93% | 0.932 | 81% | 0.806 | S | S | * | * | trans | -65.3 | 106.6 | 171.6 | -90.1 | 160.5 | 0 | 0 | 0 | 109.4 | R80 R84 | R80-L82 PolarHBondContact O-N 2.84Å; L82-R84 PolarHBondContact O-N 3.31Å | ||
| 83 | R | 31.4 | Very low | 34 | Very low | 213 Ų | 213 | 151 Ų | 151 | 80% | 0.804 | 80% | 0.802 | S | S | * | * | trans | -65.1 | 128.1 | 173.9 | -162.9 | 174.2 | -176.3 | 111.9 | -0.7 | 108.8 | P81 E85 | P81-R83 PolarHBondContact O-N 2.83Å; R83-E85 WeakPolarHBondContact CD-OE1 3.48Å; R83-E85 VanDerWaalsContact CG-OE1 3.26Å; R83-E85 WeakPolarHBondContact CG-OE1 3.43Å; R83-E85 IonicContact NE-OE1 3.93Å; R83-E85 PolarHBondContact O-N 3.43Å; R83-E85 VanDerWaalsContact O-N 3.12Å | ||
| 84 | R | 33.3 | Very low | 33.7 | Very low | 239 Ų | 239 | 148.6 Ų | 148.6 | 90% | 0.902 | 81% | 0.806 | S | S | * | * | trans | -83 | 86.1 | -178.2 | -174.2 | -172.6 | -62 | 139.8 | 1.6 | 109.2 | L82 | L82-R84 PolarHBondContact O-N 3.31Š| ||
| 85 | E | 30.3 | Very low | 33.7 | Very low | 142 Ų | 142 | 148.3 Ų | 148.3 | 66% | 0.664 | 81% | 0.806 | S | S | * | * | trans | -64.6 | 134 | 174.8 | -62.2 | -50.2 | 132.7 | 0 | 0 | 111.1 | R83 | R83-E85 WeakPolarHBondContact CD-OE1 3.48Å; R83-E85 VanDerWaalsContact CG-OE1 3.26Å; R83-E85 WeakPolarHBondContact CG-OE1 3.43Å; R83-E85 IonicContact NE-OE1 3.93Å; R83-E85 PolarHBondContact O-N 3.43Å; R83-E85 VanDerWaalsContact O-N 3.12Å | ||
| 86 | A | 34.5 | Very low | 33.4 | Very low | 77 Ų | 77 | 146.5 Ų | 146.5 | 64% | 0.636 | 81% | 0.809 | S | S | * | * | trans | -109.7 | 144.1 | 175.6 | 0 | 0 | 0 | 0 | 0 | 109.3 | N88 | A86-N88 PolarHBondContact O-N 3.42Š| ||
| 87 | P | 43.3 | Very low | 33.5 | Very low | 128 Ų | 128 | 148.9 Ų | 148.9 | 83% | 0.831 | 81% | 0.813 | S | S | * | * | trans | -74.8 | 115.2 | -173 | 29.5 | -34 | 0 | 0 | 0 | 111.3 | ||||
| 88 | N | 32.1 | Very low | 34.1 | Very low | 162 Ų | 162 | 148.5 Ų | 148.5 | 87% | 0.866 | 81% | 0.812 | S | S | * | * | trans | -96 | 131.5 | 164.9 | -96 | -52.4 | 0 | 0 | 0 | 110.6 | A86 | A86-N88 PolarHBondContact O-N 3.42Š| ||
| 89 | L | 42 | Very low | 33.8 | Very low | 174 Ų | 174 | 148.2 Ų | 148.2 | 91% | 0.911 | 82% | 0.82 | S | S | * | * | trans | -94 | 101.8 | -180 | -72.3 | 166.1 | 0 | 0 | 0 | 110.6 | ||||
| 90 | T | 36.8 | Very low | 34.2 | Very low | 139 Ų | 139 | 145.3 Ų | 145.3 | 85% | 0.853 | 82% | 0.819 | S | S | * | * | trans | -146 | 119.2 | 155.4 | 38.4 | 0 | 0 | 0 | 0 | 107.6 | ||||
| 91 | G | 34.3 | Very low | 34.5 | Very low | 73 Ų | 73 | 141.1 Ų | 141.1 | 75% | 0.753 | 82% | 0.819 | S | S | * | * | trans | -100 | 160.7 | 168.6 | 0 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 92 | D | 29.5 | Very low | 34.5 | Very low | 175 Ų | 175 | 140.3 Ų | 140.3 | 94% | 0.936 | 81% | 0.812 | S | S | * | * | trans | -145.1 | 152.1 | 151.7 | -114.5 | -37.3 | 0 | 0 | 0 | 109.4 | ||||
| 93 | S | 31.3 | Very low | 34.6 | Very low | 114 Ų | 114 | 140.3 Ų | 140.3 | 80% | 0.797 | 81% | 0.806 | S | S | * | * | trans | -110.2 | 137.8 | -170.1 | -64.7 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 94 | C | 27.1 | Very low | 34.7 | Very low | 130 Ų | 130 | 139.5 Ų | 139.5 | 88% | 0.878 | 81% | 0.809 | S | S | * | * | trans | -148.4 | 135.9 | 148.2 | -151 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 95 | S | 30.7 | Very low | 34.7 | Very low | 112 Ų | 112 | 137.6 Ų | 137.6 | 78% | 0.783 | 81% | 0.807 | S | S | * | * | trans | -116.3 | 135.1 | -176.2 | -59.1 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 96 | T | 29.7 | Very low | 35.1 | Very low | 137 Ų | 137 | 138 Ų | 138 | 84% | 0.84 | 81% | 0.814 | S | S | * | * | trans | -146.8 | 131.7 | 160 | -61.1 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 97 | L | 33.3 | Very low | 36 | Very low | 160 Ų | 160 | 140.2 Ų | 140.2 | 84% | 0.838 | 82% | 0.822 | S | S | * | * | trans | -151.4 | 172.7 | 176.4 | -82.1 | -178.7 | 0 | 0 | 0 | 106.1 | ||||
| 98 | P | 48 | Very low | 36.8 | Very low | 108 Ų | 108 | 139.2 Ų | 139.2 | 70% | 0.701 | 82% | 0.815 | S | S | * | * | cis | -129.2 | -166.2 | -24.8 | 34.2 | -15.3 | 0 | 0 | 0 | 111.2 | ||||
| 99 | S | 29 | Very low | 37 | Very low | 122 Ų | 122 | 139.2 Ų | 139.2 | 85% | 0.853 | 81% | 0.814 | S | S | * | * | trans | -161.3 | 134.4 | 148.2 | -84 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 100 | T | 36.3 | Very low | 37.6 | Very low | 130 Ų | 130 | 135.7 Ų | 135.7 | 80% | 0.798 | 80% | 0.802 | S | S | * | * | trans | -147.6 | 152.3 | 175 | 56.7 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 101 | P | 46.1 | Very low | 37.7 | Very low | 127 Ų | 127 | 134.3 Ų | 134.3 | 83% | 0.825 | 79% | 0.794 | S | S | * | * | trans | -147.5 | 179.3 | 140.8 | 35.5 | -17.8 | 0 | 0 | 0 | 114.5 | ||||
| 102 | V | 34.3 | Very low | 37.7 | Very low | 106 Ų | 106 | 138.8 Ų | 138.8 | 64% | 0.642 | 80% | 0.797 | S | S | * | * | -167.8 | 151.8 | -61.9 | 125.9 | 0 | 0 | 0 | 0 | 111.1 | |||||
| 103 | H | 33.6 | Very low | 38 | Very low | 178 Ų | 178 | 135.8 Ų | 135.8 | 82% | 0.824 | 79% | 0.789 | S | S | * | * | trans | 72.1 | 150.6 | 177.4 | -54.6 | -39.5 | 0 | 0 | 0 | 117.3 | ||||
| 104 | K | 33 | Very low | 38.3 | Very low | 197 Ų | 197 | 135.6 Ų | 135.6 | 86% | 0.857 | 79% | 0.788 | S | S | * | * | cis | -133.2 | 151.3 | 14.3 | -75.8 | 169.6 | 177.2 | 166.1 | 0 | 109.3 | ||||
| 105 | K | 34.2 | Very low | 38.4 | Very low | 198 Ų | 198 | 132.8 Ų | 132.8 | 86% | 0.861 | 78% | 0.781 | S | S | * | * | cis | 101 | 103.2 | 40.7 | -159.8 | 177.8 | -173.7 | 178.9 | 0 | 112.8 | ||||
| 106 | N | 38 | Very low | 38.4 | Very low | 151 Ų | 151 | 131.3 Ų | 131.3 | 81% | 0.807 | 78% | 0.783 | S | S | * | * | trans | -79 | 177.9 | 179.2 | -51.7 | -25.2 | 0 | 0 | 0 | 112.4 | ||||
| 107 | P | 54.6 | Low | 38.6 | Very low | 124 Ų | 124 | 129.6 Ų | 129.6 | 81% | 0.805 | 78% | 0.777 | S | S | * | * | -154.1 | -148.6 | 75.7 | 51.9 | -29.7 | 0 | 0 | 0 | 113.8 | |||||
| 108 | P | 60.1 | Low | 38.7 | Very low | 107 Ų | 107 | 132.4 Ų | 132.4 | 70% | 0.695 | 78% | 0.776 | S | S | * | * | trans | -141.9 | 177.1 | -131.9 | 38.4 | -12.5 | 0 | 0 | 0 | 121.3 | ||||
| 109 | L | 35.7 | Very low | 37.9 | Very low | 161 Ų | 161 | 136.7 Ų | 136.7 | 84% | 0.843 | 78% | 0.784 | S | S | * | * | trans | 64.7 | 176.8 | 157 | -101.8 | 89 | 0 | 0 | 0 | 118.3 | ||||
| 110 | P | 54.3 | Low | 38.2 | Very low | 101 Ų | 101 | 139.6 Ų | 139.6 | 66% | 0.656 | 78% | 0.782 | S | S | * | * | cis | -138.5 | 173.6 | 4.8 | 39.1 | -18.4 | 0 | 0 | 0 | 119.8 | ||||
| 111 | T | 38.2 | Very low | 38.1 | Very low | 110 Ų | 110 | 142.7 Ų | 142.7 | 68% | 0.675 | 79% | 0.787 | S | S | * | * | trans | 67 | 127.6 | 140.4 | 45.7 | 0 | 0 | 0 | 0 | 126.9 | ||||
| 112 | M | 34.5 | Very low | 37.5 | Very low | 167 Ų | 167 | 141.4 Ų | 141.4 | 82% | 0.823 | 78% | 0.781 | S | S | * | * | trans | 64.3 | 155.2 | 141 | -54.9 | -67.8 | 94.5 | 0 | 0 | 118.1 | ||||
| 113 | S | 36.5 | Very low | 37.5 | Very low | 111 Ų | 111 | 145.7 Ų | 145.7 | 78% | 0.776 | 80% | 0.795 | S | S | * | * | cis | -153.9 | -174.1 | 6.1 | -145.6 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 114 | S | 36.9 | Very low | 37.7 | Very low | 111 Ų | 111 | 142.2 Ų | 142.2 | 78% | 0.776 | 79% | 0.79 | S | S | * | * | cis | -152.2 | -131.6 | 4.6 | 61.4 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 115 | G | 30.1 | Very low | 38.1 | Very low | 71 Ų | 71 | 138.4 Ų | 138.4 | 73% | 0.732 | 79% | 0.785 | S | S | * | * | trans | -122.4 | -178.9 | 169.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 116 | G | 30.3 | Very low | 38.4 | Very low | 80 Ų | 80 | 136.1 Ų | 136.1 | 83% | 0.825 | 78% | 0.781 | S | S | * | * | cis | 136.2 | 130.2 | -1.6 | 0 | 0 | 0 | 0 | 0 | 113 | ||||
| 117 | S | 33.4 | Very low | 38.3 | Very low | 101 Ų | 101 | 135.9 Ų | 135.9 | 71% | 0.706 | 78% | 0.78 | S | S | * | * | trans | -173.9 | 129.1 | 154.8 | -177.3 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 118 | R | 35.5 | Very low | 37.4 | Very low | 219 Ų | 219 | 137.7 Ų | 137.7 | 83% | 0.826 | 78% | 0.779 | S | S | * | * | trans | 4.4 | 130.5 | 149.6 | -63.5 | 170.4 | -80.1 | -156.6 | -6.3 | 118.9 | ||||
| 119 | F | 30.6 | Very low | 36.4 | Very low | 198 Ų | 198 | 140 Ų | 140 | 87% | 0.868 | 79% | 0.785 | S | S | * | * | -151.9 | 173.6 | 96.8 | -128.9 | -100.7 | 0 | 0 | 0 | 112.6 | |||||
| 120 | K | 36.1 | Very low | 36.6 | Very low | 183 Ų | 183 | 139.1 Ų | 139.1 | 80% | 0.796 | 78% | 0.78 | S | S | * | * | trans | -89.7 | 145.3 | -172.6 | -53 | 174.3 | 179.8 | 178.3 | 0 | 112.1 | ||||
| 121 | Q | 34.2 | Very low | 35.8 | Very low | 195 Ų | 195 | 140.1 Ų | 140.1 | 91% | 0.911 | 78% | 0.784 | S | S | * | * | -159.5 | 170.3 | 104.7 | -125 | 166.2 | -47.2 | 0 | 0 | 112.2 | |||||
| 122 | S | 32.8 | Very low | 35.8 | Very low | 101 Ų | 101 | 143.4 Ų | 143.4 | 71% | 0.706 | 79% | 0.792 | S | S | * | * | trans | -98.1 | 137.9 | -171.4 | 50 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 123 | E | 34.3 | Very low | 35.9 | Very low | 196 Ų | 196 | 146.5 Ų | 146.5 | 92% | 0.916 | 79% | 0.794 | S | S | * | * | -162.7 | 145 | 127.9 | -110.7 | 162.9 | -152.1 | 0 | 0 | 110 | |||||
| 124 | S | 38.3 | Very low | 36 | Very low | 105 Ų | 105 | 149.3 Ų | 149.3 | 73% | 0.734 | 80% | 0.795 | S | S | * | * | trans | -126.7 | 114.2 | -170.7 | 56.4 | 0 | 0 | 0 | 0 | 111 | ||||
| 125 | P | 41.8 | Very low | 35.9 | Very low | 116 Ų | 116 | 152.3 Ų | 152.3 | 75% | 0.753 | 80% | 0.799 | S | S | * | * | trans | -69.6 | 132.5 | 172.3 | 28.8 | -32.8 | 0 | 0 | 0 | 110.1 | N127 | P125-N127 PolarHBondContact O-N 2.84Š| ||
| 126 | I | 39.9 | Very low | 36.1 | Very low | 151 Ų | 151 | 156.9 Ų | 156.9 | 77% | 0.774 | 80% | 0.799 | S | S | * | * | trans | -75.7 | 106.5 | 177 | -62.7 | 172.3 | 0 | 0 | 0 | 108.6 | M128 | I126-M128 HydrophobicContact CG2-CG 4.33Å; I126-M128 PolarHBondContact O-N 2.87Å | ||
| 127 | N | 35.7 | Very low | 36.1 | Very low | 146 Ų | 146 | 158.2 Ų | 158.2 | 78% | 0.781 | 79% | 0.794 | S | S | * | * | trans | -68 | 93.7 | 167 | -82.6 | -13.7 | 0 | 0 | 0 | 109.6 | P125 L129 | P125-N127 PolarHBondContact O-N 2.84Å; N127-L129 PolarHBondContact O-N 3.21Å | ||
| 128 | M | 36.2 | Very low | 36.1 | Very low | 161 Ų | 161 | 159.3 Ų | 159.3 | 79% | 0.793 | 79% | 0.792 | S | S | * | * | trans | -68.3 | 96.4 | 164 | -71.2 | -149.7 | -57.8 | 0 | 0 | 109.3 | I126 I130 | I126-M128 HydrophobicContact CG2-CG 4.33Å; I126-M128 PolarHBondContact O-N 2.87Å; M128-I130 PolarHBondContact O-N 2.97Å | ||
| 129 | L | 39.1 | Very low | 36.3 | Very low | 155 Ų | 155 | 157.1 Ų | 157.1 | 81% | 0.812 | 79% | 0.793 | S | S | * | * | trans | -61 | 97 | 165.2 | -82.5 | 161.7 | 0 | 0 | 0 | 109 | N127 T131 | N127-L129 PolarHBondContact O-N 3.21Å; L129-T131 VanDerWaalsContact C-N 3.31Å; L129-T131 PolarHBondContact O-N 2.79Å | ||
| 130 | I | 39.3 | Very low | 36.6 | Very low | 144 Ų | 144 | 156.7 Ų | 156.7 | 74% | 0.738 | 79% | 0.791 | S | S | * | * | trans | -67.2 | 96.7 | 165.7 | -60.3 | 178.1 | 0 | 0 | 0 | 106.6 | M128 H132 | M128-I130 PolarHBondContact O-N 2.97Å; I130-H132 PolarHBondContact O-N 2.88Å | ||
| 131 | T | 37.5 | Very low | 36.7 | Very low | 121 Ų | 121 | 153.3 Ų | 153.3 | 74% | 0.742 | 79% | 0.791 | S | S | * | * | trans | -66.2 | 113.9 | 172.4 | 42 | 0 | 0 | 0 | 0 | 108.5 | L129 R133 | L129-T131 VanDerWaalsContact C-N 3.31Å; L129-T131 PolarHBondContact O-N 2.79Å; T131-R133 VanDerWaalsContact C-N 3.33Å; T131-R133 PolarHBondContact O-N 3.17Å | ||
| 132 | H | 38.2 | Very low | 37 | Very low | 180 Ų | 180 | 152.7 Ų | 152.7 | 83% | 0.833 | 79% | 0.787 | S | S | * | * | trans | -61.6 | 99.2 | 168 | -92.6 | -104.7 | 0 | 0 | 0 | 108.4 | I130 E134 | I130-H132 PolarHBondContact O-N 2.88Å; H132-E134 PolarHBondContact O-N 2.95Å | ||
| 133 | R | 36.6 | Very low | 37.5 | Very low | 231 Ų | 231 | 153.6 Ų | 153.6 | 87% | 0.872 | 79% | 0.791 | S | S | * | * | trans | -74 | 92.6 | 175.1 | -171.6 | 178.6 | -169.9 | 169.3 | 3.9 | 108.1 | T131 M135 | T131-R133 VanDerWaalsContact C-N 3.33Å; T131-R133 PolarHBondContact O-N 3.17Å; R133-M135 PolarHBondContact O-N 3.28Å | ||
| 134 | E | 38.8 | Very low | 37.5 | Very low | 170 Ų | 170 | 149.7 Ų | 149.7 | 79% | 0.794 | 79% | 0.786 | S | S | * | * | trans | -51.3 | 112.2 | 172.7 | -67.6 | -170.1 | 134.5 | 0 | 0 | 109.8 | H132 K136 | H132-E134 PolarHBondContact O-N 2.95Å; E134-K136 PolarHBondContact O-N 2.9Å | ||
| 135 | M | 35.3 | Very low | 37.2 | Very low | 175 Ų | 175 | 153 Ų | 153 | 86% | 0.862 | 79% | 0.794 | S | S | * | * | trans | -76 | 77.9 | 166 | -80.2 | -170.1 | 164.5 | 0 | 0 | 108.4 | R133 C137 | R133-M135 PolarHBondContact O-N 3.28Å; M135-C137 PolarHBondContact O-N 2.62Å | ||
| 136 | K | 34 | Very low | 37 | Very low | 167 Ų | 167 | 156.4 Ų | 156.4 | 73% | 0.726 | 80% | 0.797 | S | S | * | * | trans | -68.3 | 101.4 | 174 | -168.5 | 167.6 | -175.1 | 170.2 | 0 | 109 | E134 D138 | E134-K136 PolarHBondContact O-N 2.9Å; K136-D138 PolarHBondContact O-N 3.4Å | ||
| 137 | C | 31.3 | Very low | 36.9 | Very low | 108 Ų | 108 | 156 Ų | 156 | 73% | 0.73 | 80% | 0.801 | S | S | * | * | trans | -70 | 90.3 | 174.3 | -64.3 | 0 | 0 | 0 | 0 | 109.9 | M135 M139 | M135-C137 PolarHBondContact O-N 2.62Å; C137-M139 PolarHBondContact O-N 3.47Å | ||
| 138 | D | 32.7 | Very low | 36.9 | Very low | 124 Ų | 124 | 154.5 Ų | 154.5 | 66% | 0.663 | 80% | 0.797 | S | S | * | * | trans | -64.2 | 96.6 | 168.5 | -84.2 | -32.2 | 0 | 0 | 0 | 109.8 | K136 K140 | K136-D138 PolarHBondContact O-N 3.4Å; D138-K140 PolarHBondContact O-N 3.44Å | ||
| 139 | M | 39.9 | Very low | 37.2 | Very low | 172 Ų | 172 | 152.4 Ų | 152.4 | 85% | 0.847 | 80% | 0.795 | S | S | * | * | trans | -65.3 | 81.7 | 163.8 | -79.5 | -74.8 | 114.1 | 0 | 0 | 109.3 | C137 S141 | C137-M139 PolarHBondContact O-N 3.47Å; M139-S141 PolarHBondContact O-N 3.41Å | ||
| 140 | K | 35.7 | Very low | 36.9 | Very low | 189 Ų | 189 | 151.5 Ų | 151.5 | 82% | 0.822 | 80% | 0.796 | S | S | * | * | trans | -68.4 | 113 | 165.4 | -76.4 | -174.6 | 176.1 | 178.4 | 0 | 108.5 | D138 | D138-K140 PolarHBondContact O-N 3.44Š| ||
| 141 | S | 39.5 | Very low | 36.7 | Very low | 113 Ų | 113 | 151.4 Ų | 151.4 | 79% | 0.79 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -59.8 | 139 | 173.4 | 38.5 | 0 | 0 | 0 | 0 | 111.4 | M139 | M139-S141 PolarHBondContact O-N 3.41Š|
| 142 | E | 40 | Very low | 37.1 | Very low | 181 Ų | 181 | 152.3 Ų | 152.3 | 85% | 0.846 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -67.6 | 139.2 | 169.3 | -67.9 | -168.8 | 116 | 0 | 0 | 110.9 | S144 | E142-S144 PolarHBondContact O-N 3.33Š|
| 143 | P | 43.2 | Very low | 37.2 | Very low | 121 Ų | 121 | 152.8 Ų | 152.8 | 79% | 0.786 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -73.6 | 121.8 | 163.9 | 30.7 | -31.2 | 0 | 0 | 0 | 109.3 | L145 | P143-L145 PolarHBondContact O-N 3.34Å; P143-L145 VanDerWaalsContact O-N 3.13Å |
| 144 | S | 34.4 | Very low | 37.3 | Very low | 114 Ų | 114 | 148.4 Ų | 148.4 | 80% | 0.797 | 79% | 0.786 | S | S | * | * | trans | -60.1 | 115.6 | -174.1 | -45.7 | 0 | 0 | 0 | 0 | 112.7 | E142 K146 | E142-S144 PolarHBondContact O-N 3.33Å; S144-K146 PolarHBondContact O-N 3.31Å; S144-K146 VanDerWaalsContact O-N 3.1Å | ||
| 145 | L | 33.2 | Very low | 37.6 | Very low | 174 Ų | 174 | 145.9 Ų | 145.9 | 91% | 0.911 | 79% | 0.785 | S | S | * | * | trans | -65 | 108.5 | 171.4 | -90.3 | 167.2 | 0 | 0 | 0 | 110.2 | P143 V147 | P143-L145 PolarHBondContact O-N 3.34Å; P143-L145 VanDerWaalsContact O-N 3.13Å; L145-V147 PolarHBondContact O-N 3.08Å | ||
| 146 | K | 37.3 | Very low | 37.8 | Very low | 187 Ų | 187 | 147.9 Ų | 147.9 | 81% | 0.813 | 78% | 0.784 | S | S | * | * | trans | -71.4 | 126.4 | 170.8 | -67.1 | -177.8 | 178.7 | -179.8 | 0 | 109.3 | S144 V148 | S144-K146 PolarHBondContact O-N 3.31Å; S144-K146 VanDerWaalsContact O-N 3.1Å; K146-V148 PolarHBondContact O-N 2.72Å | ||
| 147 | V | 37.5 | Very low | 37.9 | Very low | 144 Ų | 144 | 149 Ų | 149 | 87% | 0.873 | 79% | 0.789 | S | S | * | * | trans | -64.4 | 121.8 | 172.3 | 179 | 0 | 0 | 0 | 0 | 109 | L145 | L145-V147 PolarHBondContact O-N 3.08Š| ||
| 148 | V | 35.8 | Very low | 38.5 | Very low | 114 Ų | 114 | 149.3 Ų | 149.3 | 69% | 0.691 | 79% | 0.793 | S | S | * | * | trans | -117.8 | 127.7 | 169.4 | -179.9 | 0 | 0 | 0 | 0 | 107.2 | K146 V150 | K146-V148 PolarHBondContact O-N 2.72Å; V148-V150 PolarHBondContact O-N 3.1Å | ||
| 149 | P | 41.3 | Very low | 39.3 | Very low | 116 Ų | 116 | 148.4 Ų | 148.4 | 75% | 0.753 | 79% | 0.794 | S | S | * | * | trans | -62.6 | 133 | 177.5 | -22.2 | 33.7 | 0 | 0 | 0 | 111.5 | E151 | P149-E151 PolarHBondContact O-N 2.96Š| ||
| 150 | V | 34.2 | Very low | 39.2 | Very low | 137 Ų | 137 | 148 Ų | 148 | 83% | 0.83 | 80% | 0.795 | S | S | * | * | trans | -80.5 | 105 | 173.4 | 176.7 | 0 | 0 | 0 | 0 | 108.7 | V148 | V148-V150 PolarHBondContact O-N 3.1Š| ||
| 151 | E | 35.2 | Very low | 39.4 | Very low | 141 Ų | 141 | 142.4 Ų | 142.4 | 66% | 0.659 | 79% | 0.791 | S | S | * | * | trans | -73.6 | 124.7 | 165.7 | -126.5 | -162.8 | 168.7 | 0 | 0 | 109.4 | P149 R153 | P149-E151 PolarHBondContact O-N 2.96Å; E151-R153 PolarHBondContact O-N 2.77Å; E151-R153 IonicContact OE1-NH1 2.63Å; E151-R153 PolarHBondContact OE1-NH1 2.84Å; E151-R153 VanDerWaalsContact OE1-NH1 3.07Å; E151-R153 IonicContact OE2-CZ 2.64Å; E151-R153 IonicContact OE2-NH1 3.07Å; E151-R153 PolarHBondContact OE2-NH1 3.27Å | ||
| 152 | T | 45.8 | Very low | 39.5 | Very low | 140 Ų | 140 | 146.1 Ų | 146.1 | 86% | 0.859 | 79% | 0.793 | S | S | * | * | trans | -77.6 | 111.7 | 177.7 | -30.9 | 0 | 0 | 0 | 0 | 110 | ||||
| 153 | R | 38.9 | Very low | 39.5 | Very low | 191 Ų | 191 | 146.3 Ų | 146.3 | 72% | 0.721 | 79% | 0.794 | S | S | * | * | trans | -131.1 | 117.2 | 173.1 | -83.8 | -177.5 | 144.3 | 102.8 | 4.7 | 111.5 | E151 | E151-R153 PolarHBondContact O-N 2.77Å; E151-R153 IonicContact OE1-NH1 2.63Å; E151-R153 PolarHBondContact OE1-NH1 2.84Å; E151-R153 VanDerWaalsContact OE1-NH1 3.07Å; E151-R153 IonicContact OE2-CZ 2.64Å; E151-R153 IonicContact OE2-NH1 3.07Å; E151-R153 PolarHBondContact OE2-NH1 3.27Å | ||
| 154 | D | 38.8 | Very low | 39.1 | Very low | 138 Ų | 138 | 144.7 Ų | 144.7 | 74% | 0.738 | 79% | 0.791 | S | S | * | * | trans | -66.6 | 142.4 | 173.3 | -103 | -56.7 | 0 | 0 | 0 | 111.7 | Y156 | D154-Y156 PolarHBondContact O-N 2.78Š| ||
| 155 | P | 45.1 | Very low | 39.1 | Very low | 118 Ų | 118 | 147.4 Ų | 147.4 | 77% | 0.766 | 79% | 0.794 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67.9 | -3.8 | 177.7 | -20.6 | 33.2 | 0 | 0 | 0 | 115.5 | ||
| 156 | Y | 40.8 | Very low | 39.2 | Very low | 216 Ų | 216 | 143.2 Ų | 143.2 | 85% | 0.847 | 79% | 0.785 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -127.2 | 32.3 | -164.4 | -93.9 | -79.5 | 0 | 0 | 0 | 115.5 | D154 | D154-Y156 PolarHBondContact O-N 2.78Š|
| 157 | F | 36.3 | Very low | 39.6 | Very low | 190 Ų | 190 | 144.1 Ų | 144.1 | 83% | 0.833 | 79% | 0.789 | S | S | * | * | trans | -143.4 | 125.5 | 162 | -125.8 | -90.4 | 0 | 0 | 0 | 112.3 | ||||
| 158 | S | 42.9 | Very low | 39.9 | Very low | 115 Ų | 115 | 143.2 Ų | 143.2 | 80% | 0.804 | 79% | 0.786 | S | S | * | * | trans | -131.7 | 103.9 | 175.8 | -169.8 | 0 | 0 | 0 | 0 | 110.3 | N160 | S158-N160 PolarHBondContact O-N 3.39Š| ||
| 159 | P | 50.5 | Low | 39.8 | Very low | 105 Ų | 105 | 144.3 Ų | 144.3 | 68% | 0.682 | 79% | 0.793 | S | S | * | * | trans | -88.8 | 91.7 | -173.8 | 33.5 | -32.8 | 0 | 0 | 0 | 111.5 | ||||
| 160 | N | 36.7 | Very low | 39.6 | Very low | 163 Ų | 163 | 142.9 Ų | 142.9 | 87% | 0.872 | 79% | 0.791 | S | S | * | * | trans | 176.6 | 124.3 | 138.2 | -91.4 | -28.1 | 0 | 0 | 0 | 110.3 | S158 | S158-N160 PolarHBondContact O-N 3.39Š| ||
| 161 | G | 39.6 | Very low | 39.6 | Very low | 72 Ų | 72 | 140.7 Ų | 140.7 | 74% | 0.742 | 79% | 0.787 | S | S | * | * | trans | -100.6 | 138.3 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 162 | K | 42.5 | Very low | 39.6 | Very low | 191 Ų | 191 | 141.3 Ų | 141.3 | 83% | 0.83 | 79% | 0.794 | S | S | * | * | trans | -178.4 | 164.8 | 135.7 | -99.5 | 160 | -172.2 | 179.7 | 0 | 111.6 | ||||
| 163 | H | 39.5 | Very low | 39.1 | Very low | 186 Ų | 186 | 144.7 Ų | 144.7 | 86% | 0.861 | 80% | 0.796 | S | S | * | * | trans | 74.3 | 155.2 | 179.2 | -50.6 | -74.2 | 0 | 0 | 0 | 115.6 | ||||
| 164 | A | 34.5 | Very low | 39 | Very low | 87 Ų | 87 | 143.1 Ų | 143.1 | 72% | 0.719 | 80% | 0.795 | S | S | * | * | trans | -155.4 | 174.7 | -162.1 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 165 | I | 35.5 | Very low | 38.9 | Very low | 171 Ų | 171 | 142.9 Ų | 142.9 | 88% | 0.877 | 79% | 0.789 | S | S | * | * | trans | 74 | 135.3 | 174.2 | -52.9 | 164.3 | 0 | 0 | 0 | 111.8 | ||||
| 166 | A | 35.5 | Very low | 38.2 | Very low | 86 Ų | 86 | 146.6 Ų | 146.6 | 71% | 0.711 | 80% | 0.796 | S | S | * | * | cis | -141.2 | 174.8 | -0.8 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 167 | K | 45.7 | Very low | 37.9 | Very low | 205 Ų | 205 | 142.5 Ų | 142.5 | 89% | 0.891 | 79% | 0.788 | S | S | * | * | trans | -75.4 | 146.1 | 154.7 | -68.1 | 179.3 | 177.3 | 178.3 | 0 | 110.7 | ||||
| 168 | P | 42.3 | Very low | 37.8 | Very low | 126 Ų | 126 | 139.6 Ų | 139.6 | 82% | 0.818 | 79% | 0.785 | S | S | * | * | trans | -103.9 | 170.4 | 144.8 | 35 | -28.8 | 0 | 0 | 0 | 111.6 | ||||
| 169 | T | 34.2 | Very low | 37.1 | Very low | 136 Ų | 136 | 141.4 Ų | 141.4 | 83% | 0.834 | 79% | 0.786 | S | S | * | * | trans | -138.1 | 159.8 | -178.3 | -168.6 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 170 | A | 36.2 | Very low | 36.4 | Very low | 86 Ų | 86 | 147.4 Ų | 147.4 | 71% | 0.711 | 80% | 0.795 | S | S | * | * | trans | 51.8 | 120.3 | 159.6 | 0 | 0 | 0 | 0 | 0 | 121.2 | ||||
| 171 | A | 34.1 | Very low | 36.5 | Very low | 92 Ų | 92 | 145.7 Ų | 145.7 | 76% | 0.76 | 80% | 0.796 | S | S | * | * | trans | 175.6 | 106.9 | 136.4 | 0 | 0 | 0 | 0 | 0 | 107.3 | ||||
| 172 | I | 36 | Very low | 36.3 | Very low | 154 Ų | 154 | 146.8 Ų | 146.8 | 79% | 0.79 | 79% | 0.792 | S | S | * | * | 52.3 | 101.4 | 66.1 | -52 | -178.9 | 0 | 0 | 0 | 112.8 | |||||
| 173 | K | 36.2 | Very low | 36.1 | Very low | 211 Ų | 211 | 149.7 Ų | 149.7 | 92% | 0.917 | 80% | 0.798 | S | S | * | * | trans | -144.6 | 125.1 | 145.5 | -113.2 | -179.9 | -178.8 | -178.4 | 0 | 111.5 | ||||
| 174 | K | 36.4 | Very low | 35.9 | Very low | 158 Ų | 158 | 145.7 Ų | 145.7 | 69% | 0.687 | 79% | 0.79 | S | S | * | * | trans | -68.9 | 170.5 | 159.2 | -72.9 | 165.9 | 154.1 | -83.4 | 0 | 109.5 | ||||
| 175 | E | 36.2 | Very low | 36 | Very low | 132 Ų | 132 | 149.2 Ų | 149.2 | 62% | 0.617 | 80% | 0.796 | S | S | * | * | cis | -167.1 | 149.5 | -14.8 | -108.3 | 157.6 | -173.4 | 0 | 0 | 105.1 | ||||
| 176 | E | 30.2 | Very low | 36.1 | Very low | 197 Ų | 197 | 146 Ų | 146 | 92% | 0.921 | 79% | 0.789 | S | S | * | * | trans | -145.8 | 142.5 | 149.7 | -156 | 167.8 | 136.8 | 0 | 0 | 109.9 | ||||
| 177 | I | 35.9 | Very low | 36 | Very low | 130 Ų | 130 | 148.8 Ų | 148.8 | 67% | 0.667 | 79% | 0.792 | S | S | * | * | trans | -141 | 161.4 | -169.5 | -60.4 | 176.4 | 0 | 0 | 0 | 107 | ||||
| 178 | V | 32.9 | Very low | 35.7 | Very low | 129 Ų | 129 | 146.5 Ų | 146.5 | 78% | 0.782 | 79% | 0.788 | S | S | * | * | trans | 93.5 | 131.4 | -178.4 | -175.2 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 179 | N | 29.1 | Very low | 35.8 | Very low | 152 Ų | 152 | 148.9 Ų | 148.9 | 81% | 0.813 | 79% | 0.788 | S | S | * | * | cis | -127.1 | 160 | 22.7 | -146.2 | -14.1 | 0 | 0 | 0 | 116 | ||||
| 180 | R | 35 | Very low | 36.3 | Very low | 232 Ų | 232 | 148 Ų | 148 | 88% | 0.875 | 78% | 0.784 | S | S | * | * | trans | -88.3 | 150.8 | 173.4 | -77.7 | 174.4 | 162.6 | 143.6 | -8 | 111.5 | ||||
| 181 | S | 39 | Very low | 36.2 | Very low | 127 Ų | 127 | 149.2 Ų | 149.2 | 89% | 0.888 | 79% | 0.787 | S | S | * | * | trans | -139.7 | 155.9 | 133.9 | -166.2 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 182 | S | 35.6 | Very low | 36.3 | Very low | 94 Ų | 94 | 150 Ų | 150 | 66% | 0.657 | 79% | 0.787 | S | S | * | * | trans | -132.9 | 148.3 | -164.8 | 57.3 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 183 | R | 38.3 | Very low | 36.3 | Very low | 253 Ų | 253 | 148 Ų | 148 | 96% | 0.955 | 79% | 0.788 | S | S | * | * | trans | -171.6 | 170.4 | 142.6 | -97 | 141.9 | -158.9 | -130.4 | 0.9 | 109.9 | ||||
| 184 | S | 35.1 | Very low | 37.1 | Very low | 101 Ų | 101 | 143.6 Ų | 143.6 | 71% | 0.706 | 78% | 0.78 | S | S | * | * | trans | -152.6 | 144.1 | -150.9 | -173.4 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 185 | L | 37 | Very low | 37.1 | Very low | 161 Ų | 161 | 141.9 Ų | 141.9 | 84% | 0.843 | 79% | 0.788 | S | S | * | * | trans | 68.7 | 169.5 | 157.4 | -76.1 | 166.4 | 0 | 0 | 0 | 119.9 | ||||
| 186 | S | 37.3 | Very low | 37.1 | Very low | 104 Ų | 104 | 141.3 Ų | 141.3 | 73% | 0.727 | 79% | 0.794 | S | S | * | * | trans | 64.4 | 136.1 | -171.1 | 19.9 | 0 | 0 | 0 | 0 | 116.7 | ||||
| 187 | D | 34.2 | Very low | 37.3 | Very low | 144 Ų | 144 | 138.5 Ų | 138.5 | 77% | 0.77 | 79% | 0.79 | S | S | * | * | cis | -158.8 | 166.4 | 3.1 | -130.1 | -33 | 0 | 0 | 0 | 116.6 | ||||
| 188 | I | 38.1 | Very low | 37.4 | Very low | 158 Ų | 158 | 140.7 Ų | 140.7 | 81% | 0.81 | 80% | 0.797 | S | S | * | * | trans | 79.1 | 150.9 | 158.1 | -66.9 | 162.2 | 0 | 0 | 0 | 119.7 | ||||
| 189 | H | 43.7 | Very low | 38.3 | Very low | 176 Ų | 176 | 139.5 Ų | 139.5 | 82% | 0.815 | 79% | 0.792 | S | S | * | * | trans | -114.5 | 163.6 | -156.5 | -120.6 | -115.1 | 0 | 0 | 0 | 114.2 | ||||
| 190 | P | 45.8 | Very low | 38.4 | Very low | 116 Ų | 116 | 138.5 Ų | 138.5 | 75% | 0.753 | 79% | 0.791 | S | S | * | * | trans | -80.8 | 159.9 | 166.8 | 34.2 | -36.3 | 0 | 0 | 0 | 113.9 | ||||
| 191 | S | 34.4 | Very low | 38.4 | Very low | 112 Ų | 112 | 133.2 Ų | 133.2 | 78% | 0.783 | 79% | 0.79 | S | S | * | * | trans | -142.5 | 150.8 | 173.2 | -164.4 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 192 | S | 35.8 | Very low | 38.1 | Very low | 108 Ų | 108 | 131 Ų | 131 | 76% | 0.755 | 79% | 0.787 | S | S | * | * | cis | -141.1 | 161.1 | 18.5 | -53.5 | 0 | 0 | 0 | 0 | 113 | ||||
| 193 | S | 36.7 | Very low | 38.1 | Very low | 114 Ų | 114 | 134.5 Ų | 134.5 | 80% | 0.797 | 80% | 0.797 | S | S | * | * | trans | -101.2 | -162.6 | -179.8 | -25.1 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 194 | P | 51.9 | Low | 38.6 | Very low | 118 Ų | 118 | 127.8 Ų | 127.8 | 77% | 0.766 | 79% | 0.786 | S | S | * | * | cis | -129.7 | -166.4 | -34.6 | 35.7 | -17.2 | 0 | 0 | 0 | 112.3 | ||||
| 195 | S | 36.4 | Very low | 38.5 | Very low | 122 Ų | 122 | 129.4 Ų | 129.4 | 85% | 0.853 | 79% | 0.791 | S | S | * | * | trans | -128.9 | 143.3 | 164.1 | 177.9 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 196 | V | 37.1 | Very low | 38.3 | Very low | 120 Ų | 120 | 131.1 Ų | 131.1 | 73% | 0.727 | 80% | 0.795 | S | S | * | * | trans | -142.6 | 118.9 | -176.4 | -178.1 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 197 | V | 35 | Very low | 38.3 | Very low | 138 Ų | 138 | 134.7 Ų | 134.7 | 84% | 0.836 | 80% | 0.8 | S | S | * | * | trans | 18.2 | 144.1 | 147.6 | -160.3 | 0 | 0 | 0 | 0 | 123 | ||||
| 198 | Q | 36.3 | Very low | 38.4 | Very low | 175 Ų | 175 | 138.9 Ų | 138.9 | 82% | 0.818 | 81% | 0.805 | S | S | * | * | trans | -64.5 | -170.9 | 169.8 | -63.6 | -178.2 | -22.8 | 0 | 0 | 114.5 | ||||
| 199 | P | 51.9 | Low | 38.7 | Very low | 105 Ų | 105 | 137.2 Ų | 137.2 | 68% | 0.682 | 81% | 0.805 | S | S | * | * | cis | -143.6 | 178.4 | 8.2 | 41.2 | -20.3 | 0 | 0 | 0 | 118.5 | ||||
| 200 | T | 31.3 | Very low | 38.2 | Very low | 130 Ų | 130 | 133.9 Ų | 133.9 | 80% | 0.798 | 81% | 0.808 | S | S | * | * | 170.6 | 144.6 | 119.7 | 33.9 | 0 | 0 | 0 | 0 | 115.5 | |||||
| 201 | S | 35.3 | Very low | 37.6 | Very low | 121 Ų | 121 | 132.4 Ų | 132.4 | 85% | 0.846 | 80% | 0.8 | S | S | * | * | trans | 34 | 130 | 152.6 | 60.2 | 0 | 0 | 0 | 0 | 123.9 | ||||
| 202 | G | 33.7 | Very low | 37.8 | Very low | 81 Ų | 81 | 135.1 Ų | 135.1 | 84% | 0.835 | 80% | 0.8 | S | S | * | * | trans | 148.5 | 103.7 | 150 | 0 | 0 | 0 | 0 | 0 | 117.2 | ||||
| 203 | I | 35.1 | Very low | 37.7 | Very low | 168 Ų | 168 | 137.9 Ų | 137.9 | 86% | 0.862 | 81% | 0.806 | S | S | * | * | trans | -121 | 158.5 | 164.7 | 11.1 | 175.8 | 0 | 0 | 0 | 107.5 | ||||
| 204 | P | 47.8 | Very low | 37.8 | Very low | 112 Ų | 112 | 140.4 Ų | 140.4 | 73% | 0.727 | 81% | 0.809 | S | S | * | * | cis | -145.5 | 161.7 | 38.4 | 41.5 | -21.4 | 0 | 0 | 0 | 119.5 | ||||
| 205 | V | 32.8 | Very low | 37 | Very low | 134 Ų | 134 | 139 Ų | 139 | 81% | 0.812 | 81% | 0.807 | S | S | * | * | trans | 49.8 | 118.5 | 137 | 177.6 | 0 | 0 | 0 | 0 | 120.7 | ||||
| 206 | Q | 34 | Very low | 37.3 | Very low | 197 Ų | 197 | 138.9 Ų | 138.9 | 92% | 0.921 | 80% | 0.803 | S | S | * | * | -152.8 | 151.5 | 111.7 | -158.9 | 155.9 | 34.7 | 0 | 0 | 112.5 | |||||
| 207 | Q | 37.8 | Very low | 37.4 | Very low | 179 Ų | 179 | 140.3 Ų | 140.3 | 84% | 0.836 | 81% | 0.807 | S | S | * | * | trans | -137.1 | 123.3 | -174 | -178.7 | -172.7 | 15.3 | 0 | 0 | 111 | ||||
| 208 | R | 35.5 | Very low | 37.8 | Very low | 232 Ų | 232 | 138.9 Ų | 138.9 | 88% | 0.875 | 80% | 0.8 | S | S | * | * | trans | -161 | 135.7 | 158.8 | -169.9 | 168 | -71.5 | -158.1 | -1.6 | 110.2 | ||||
| 209 | P | 45.5 | Very low | 38.2 | Very low | 123 Ų | 123 | 139.5 Ų | 139.5 | 80% | 0.799 | 80% | 0.8 | S | S | * | * | trans | -80.1 | 149.7 | 175 | 32.6 | -34.9 | 0 | 0 | 0 | 112 | ||||
| 210 | A | 33 | Very low | 37.7 | Very low | 107 Ų | 107 | 139.6 Ų | 139.6 | 88% | 0.884 | 80% | 0.801 | S | S | * | * | trans | -138.9 | 148.4 | 160.7 | 0 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 211 | S | 33.2 | Very low | 37.9 | Very low | 85 Ų | 85 | 139.3 Ų | 139.3 | 59% | 0.594 | 80% | 0.799 | S | S | * | * | trans | -116.8 | 165.1 | -166.5 | 46.8 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 212 | H | 37.3 | Very low | 38 | Very low | 169 Ų | 169 | 143.6 Ų | 143.6 | 78% | 0.782 | 80% | 0.798 | S | S | * | * | trans | 70.4 | 150.7 | 178.7 | -30.4 | -67.7 | 0 | 0 | 0 | 112.3 | ||||
| 213 | L | 34.5 | Very low | 38.4 | Very low | 166 Ų | 166 | 145.4 Ų | 145.4 | 87% | 0.869 | 79% | 0.793 | S | S | * | * | cis | -127.7 | 158.1 | 18.3 | -71.1 | 156.4 | 0 | 0 | 0 | 112.4 | A215 | L213-A215 PolarHBondContact O-N 3.18Š| ||
| 214 | I | 37.8 | Very low | 38.6 | Very low | 167 Ų | 167 | 143.6 Ų | 143.6 | 86% | 0.856 | 79% | 0.789 | S | S | * | * | trans | -80.7 | 111.3 | 167.9 | -64 | 168.9 | 0 | 0 | 0 | 108.1 | ||||
| 215 | A | 36.4 | Very low | 38.1 | Very low | 88 Ų | 88 | 143.5 Ų | 143.5 | 73% | 0.727 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -79.9 | 129.9 | 168 | 0 | 0 | 0 | 0 | 0 | 109.8 | L213 N217 | L213-A215 PolarHBondContact O-N 3.18Å; A215-N217 PolarHBondContact O-N 2.89Å |
| 216 | P | 42.7 | Very low | 38.3 | Very low | 120 Ų | 120 | 146.9 Ų | 146.9 | 78% | 0.779 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -70.1 | 130.7 | 177.1 | 28 | -33.3 | 0 | 0 | 0 | 110.8 | ||
| 217 | N | 37.5 | Very low | 38.5 | Very low | 149 Ų | 149 | 143.7 Ų | 143.7 | 80% | 0.797 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -59.4 | 126.3 | 177.5 | -173.6 | 17.4 | 0 | 0 | 0 | 110.9 | A215 K219 | A215-N217 PolarHBondContact O-N 2.89Å; N217-K219 PolarHBondContact O-N 3.12Å |
| 218 | P | 44.3 | Very low | 38.5 | Very low | 108 Ų | 108 | 138.6 Ų | 138.6 | 70% | 0.701 | 78% | 0.775 | S | S | * | * | P | Polyproline II helix | trans | -61.2 | 136.8 | 175.7 | 24.7 | -34.4 | 0 | 0 | 0 | 111.2 | ||
| 219 | K | 43.8 | Very low | 38.7 | Very low | 188 Ų | 188 | 133.7 Ų | 133.7 | 82% | 0.817 | 77% | 0.773 | S | S | * | * | P | Polyproline II helix | trans | -60.4 | 140.5 | 178.7 | -61.8 | 177 | -178.6 | 178.4 | 0 | 110.2 | N217 V221 | N217-K219 PolarHBondContact O-N 3.12Å; K219-V221 PolarHBondContact O-N 3.06Å |
| 220 | P | 42.4 | Very low | 38.6 | Very low | 107 Ų | 107 | 134.4 Ų | 134.4 | 70% | 0.695 | 78% | 0.775 | S | S | * | * | trans | -63.9 | 112.6 | 174.9 | 26.4 | -33.4 | 0 | 0 | 0 | 110 | Y222 | P220-Y222 PolarHBondContact O-N 2.83Š| ||
| 221 | V | 36.4 | Very low | 38.9 | Very low | 125 Ų | 125 | 133.6 Ų | 133.6 | 76% | 0.758 | 77% | 0.769 | S | S | * | * | trans | -75.7 | 109.1 | 170.7 | 177.6 | 0 | 0 | 0 | 0 | 107.6 | K219 T223 | K219-V221 PolarHBondContact O-N 3.06Å; V221-T223 VanDerWaalsContact C-N 3.32Å; V221-T223 HydrophobicContact CG1-CG2 4.34Å; V221-T223 PolarHBondContact O-N 3.15Å | ||
| 222 | Y | 36 | Very low | 39 | Very low | 210 Ų | 210 | 137.2 Ų | 137.2 | 82% | 0.824 | 78% | 0.776 | S | S | * | * | trans | -69.6 | 88.8 | 172.3 | -76.9 | -88.3 | 0 | 0 | 0 | 110.1 | P220 V224 | P220-Y222 PolarHBondContact O-N 2.83Å; Y222-V224 PolarHBondContact O-N 2.96Å | ||
| 223 | T | 42.8 | Very low | 38.8 | Very low | 120 Ų | 120 | 135.8 Ų | 135.8 | 74% | 0.736 | 78% | 0.779 | S | S | * | * | trans | -69.8 | 106.1 | 167.8 | 49 | 0 | 0 | 0 | 0 | 109.3 | V221 P225 | V221-T223 VanDerWaalsContact C-N 3.32Å; V221-T223 HydrophobicContact CG1-CG2 4.34Å; V221-T223 PolarHBondContact O-N 3.15Å; T223-P225 WeakPolarHBondContact O-CD 3.46Å | ||
| 224 | V | 39.6 | Very low | 38.8 | Very low | 130 Ų | 130 | 135.5 Ų | 135.5 | 79% | 0.788 | 77% | 0.771 | S | S | * | * | trans | -59.1 | 126.8 | 172.7 | -179.8 | 0 | 0 | 0 | 0 | 109.1 | Y222 K226 | Y222-V224 PolarHBondContact O-N 2.96Å; V224-K226 PolarHBondContact O-N 2.91Å | ||
| 225 | P | 36.5 | Very low | 38.5 | Very low | 110 Ų | 110 | 131.8 Ų | 131.8 | 71% | 0.714 | 77% | 0.765 | S | S | * | * | trans | -60.6 | 110.9 | 175.1 | -24.7 | 35.3 | 0 | 0 | 0 | 110.9 | T223 V227 | T223-P225 WeakPolarHBondContact O-CD 3.46Å; P225-V227 VanDerWaalsContact C-N 3.35Å; P225-V227 PolarHBondContact O-N 3.5Å | ||
| 226 | K | 37.3 | Very low | 38.4 | Very low | 204 Ų | 204 | 132.4 Ų | 132.4 | 89% | 0.887 | 76% | 0.764 | S | S | * | * | trans | -73 | 89 | 175.5 | -175 | 175.1 | -179.6 | 175.2 | 0 | 109.4 | V224 A228 | V224-K226 PolarHBondContact O-N 2.91Å; K226-A228 PolarHBondContact O-N 3.17Å | ||
| 227 | V | 39.1 | Very low | 38.2 | Very low | 130 Ų | 130 | 132.5 Ų | 132.5 | 79% | 0.788 | 76% | 0.763 | S | S | * | * | trans | -58.1 | 124.2 | 175.5 | -178.2 | 0 | 0 | 0 | 0 | 109.5 | P225 | P225-V227 VanDerWaalsContact C-N 3.35Å; P225-V227 PolarHBondContact O-N 3.5Å | ||
| 228 | A | 37.1 | Very low | 38.2 | Very low | 73 Ų | 73 | 131.8 Ų | 131.8 | 60% | 0.603 | 76% | 0.757 | S | S | * | * | trans | -83.7 | 127.2 | 176.4 | 0 | 0 | 0 | 0 | 0 | 110.2 | K226 T230 | K226-A228 PolarHBondContact O-N 3.17Å; A228-T230 PolarHBondContact O-N 3.12Å | ||
| 229 | P | 39 | Very low | 38 | Very low | 129 Ų | 129 | 134 Ų | 134 | 84% | 0.838 | 76% | 0.761 | S | S | * | * | trans | -79.7 | 88.3 | 179 | 31.3 | -34.3 | 0 | 0 | 0 | 111.6 | A231 | P229-A231 PolarHBondContact O-N 3.22Š| ||
| 230 | T | 44.6 | Very low | 37.6 | Very low | 137 Ų | 137 | 132 Ų | 132 | 84% | 0.84 | 76% | 0.755 | S | S | * | * | trans | -92.1 | 73.1 | 177.4 | -52.3 | 0 | 0 | 0 | 0 | 111.8 | A228 | A228-T230 PolarHBondContact O-N 3.12Š| ||
| 231 | A | 38.1 | Very low | 37.2 | Very low | 90 Ų | 90 | 133 Ų | 133 | 74% | 0.744 | 76% | 0.761 | S | S | * | * | trans | -158.8 | 81.4 | 166.8 | 0 | 0 | 0 | 0 | 0 | 111.7 | P229 V233 | P229-A231 PolarHBondContact O-N 3.22Å; A231-V233 PolarHBondContact O-N 2.93Å | ||
| 232 | Q | 35.8 | Very low | 37.4 | Very low | 162 Ų | 162 | 133 Ų | 133 | 76% | 0.757 | 76% | 0.762 | S | S | * | * | trans | -81.5 | 92.1 | 173.8 | -74.4 | -164.6 | -0.8 | 0 | 0 | 112 | K234 | Q232-K234 HydrophobicContact CB-CG 4.47Å; Q232-K234 PolarHBondContact O-N 3.46Å | ||
| 233 | V | 32.6 | Very low | 37.8 | Very low | 139 Ų | 139 | 128.7 Ų | 128.7 | 84% | 0.842 | 76% | 0.757 | S | S | * | * | trans | -81.3 | 100.8 | 157.5 | -179.3 | 0 | 0 | 0 | 0 | 107.9 | A231 A235 | A231-V233 PolarHBondContact O-N 2.93Å; V233-A235 PolarHBondContact O-N 3.01Å; V233-A235 VanDerWaalsContact O-N 3.13Å | ||
| 234 | K | 35.6 | Very low | 37.6 | Very low | 160 Ų | 160 | 130.1 Ų | 130.1 | 70% | 0.696 | 76% | 0.76 | S | S | * | * | trans | -78.7 | 92.5 | -178.1 | -70.4 | -177 | 178.6 | 177.2 | 0 | 111.9 | Q232 | Q232-K234 HydrophobicContact CB-CG 4.47Å; Q232-K234 PolarHBondContact O-N 3.46Å | ||
| 235 | A | 31 | Very low | 37.9 | Very low | 88 Ų | 88 | 127.9 Ų | 127.9 | 73% | 0.727 | 76% | 0.763 | S | S | * | * | trans | -94.6 | 78.4 | 163.5 | 0 | 0 | 0 | 0 | 0 | 110.3 | V233 T237 | V233-A235 PolarHBondContact O-N 3.01Å; V233-A235 VanDerWaalsContact O-N 3.13Å; A235-T237 PolarHBondContact O-N 3.05Å | ||
| 236 | S | 35.4 | Very low | 38 | Very low | 101 Ų | 101 | 131.8 Ų | 131.8 | 71% | 0.706 | 77% | 0.772 | S | S | * | * | trans | -79 | 75.4 | -178.6 | -63.9 | 0 | 0 | 0 | 0 | 112.7 | I238 | S236-I238 PolarHBondContact O-N 2.86Å; S236-I238 VanDerWaalsContact O-N 3.13Å | ||
| 237 | T | 37.3 | Very low | 37.9 | Very low | 123 Ų | 123 | 128.5 Ų | 128.5 | 76% | 0.755 | 77% | 0.769 | S | S | * | * | trans | -78.8 | 91.8 | 168.1 | -58.5 | 0 | 0 | 0 | 0 | 110 | A235 I239 | A235-T237 PolarHBondContact O-N 3.05Å; T237-I239 HydrophobicContact CG2-CG1 4.38Å; T237-I239 PolarHBondContact O-N 3.36Å | ||
| 238 | I | 38.4 | Very low | 37.7 | Very low | 134 Ų | 134 | 131.1 Ų | 131.1 | 69% | 0.687 | 77% | 0.769 | S | S | * | * | trans | -73.7 | 110.9 | 172 | -59.4 | 175.6 | 0 | 0 | 0 | 108.5 | S236 Q240 | S236-I238 PolarHBondContact O-N 2.86Å; S236-I238 VanDerWaalsContact O-N 3.13Å; I238-Q240 HydrophobicContact CG2-CG 4Å; I238-Q240 PolarHBondContact O-N 3.07Å | ||
| 239 | I | 39 | Very low | 37.5 | Very low | 153 Ų | 153 | 133 Ų | 133 | 79% | 0.785 | 77% | 0.773 | S | S | * | * | trans | -86.3 | 101.1 | 168.8 | -55.9 | -178.5 | 0 | 0 | 0 | 108.4 | T237 | T237-I239 HydrophobicContact CG2-CG1 4.38Å; T237-I239 PolarHBondContact O-N 3.36Å | ||
| 240 | Q | 34.9 | Very low | 37.4 | Very low | 148 Ų | 148 | 131.4 Ų | 131.4 | 69% | 0.692 | 77% | 0.765 | S | S | * | * | trans | -90.7 | 140.6 | 161.5 | -70.8 | -179.2 | 18.1 | 0 | 0 | 109.6 | I238 T242 | I238-Q240 HydrophobicContact CG2-CG 4Å; I238-Q240 PolarHBondContact O-N 3.07Å; Q240-T242 PolarHBondContact O-N 3.34Å | ||
| 241 | P | 35.6 | Very low | 37.2 | Very low | 126 Ų | 126 | 129.4 Ų | 129.4 | 82% | 0.818 | 76% | 0.757 | S | S | * | * | trans | -79.8 | 86.6 | 177.8 | 32.3 | -34 | 0 | 0 | 0 | 111 | ||||
| 242 | T | 40.4 | Very low | 37 | Very low | 127 Ų | 127 | 133.6 Ų | 133.6 | 78% | 0.779 | 76% | 0.761 | S | S | * | * | trans | -77.4 | 123.8 | 172.9 | -53.2 | 0 | 0 | 0 | 0 | 110.5 | Q240 | Q240-T242 PolarHBondContact O-N 3.34Š| ||
| 243 | V | 44.3 | Very low | 37 | Very low | 118 Ų | 118 | 131.6 Ų | 131.6 | 72% | 0.715 | 76% | 0.76 | S | S | * | * | S | Bend | trans | -72.3 | 153.2 | 176.5 | -159.4 | 0 | 0 | 0 | 0 | 110.3 | ||
| 244 | N | 37.7 | Very low | 37.2 | Very low | 151 Ų | 151 | 133.5 Ų | 133.5 | 81% | 0.807 | 76% | 0.76 | S | S | * | * | S | Bend | trans | 78.4 | 100.8 | -178.4 | -49.9 | -27 | 0 | 0 | 0 | 114 | ||
| 245 | G | 46.2 | Very low | 37.3 | Very low | 82 Ų | 82 | 132.5 Ų | 132.5 | 85% | 0.845 | 76% | 0.761 | S | S | * | * | trans | -81.6 | 118.9 | -175.4 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 246 | Q | 37.7 | Very low | 37.4 | Very low | 192 Ų | 192 | 134 Ų | 134 | 90% | 0.897 | 77% | 0.765 | S | S | * | * | trans | -147.3 | 96.5 | 159.5 | -139.9 | 178.8 | 19.3 | 0 | 0 | 110.3 | K248 | Q246-K248 PolarHBondContact O-N 2.64Š| ||
| 247 | V | 37 | Very low | 37.4 | Very low | 136 Ų | 136 | 134.8 Ų | 134.8 | 82% | 0.824 | 77% | 0.767 | S | S | * | * | trans | -93 | 94.9 | -176.9 | 177.3 | 0 | 0 | 0 | 0 | 109.9 | V249 | V247-V249 HydrophobicContact CG1-CG2 3.9Å; V247-V249 PolarHBondContact O-N 3.33Å | ||
| 248 | K | 34.6 | Very low | 37.4 | Very low | 184 Ų | 184 | 132.7 Ų | 132.7 | 80% | 0.8 | 77% | 0.769 | S | S | * | * | trans | -92.3 | 89.7 | 170.6 | -174.2 | -173.6 | 176.1 | -174.9 | 0 | 110 | Q246 S250 | Q246-K248 PolarHBondContact O-N 2.64Å; K248-S250 PolarHBondContact O-N 3.06Å | ||
| 249 | V | 32.3 | Very low | 37.2 | Very low | 112 Ų | 112 | 132.3 Ų | 132.3 | 68% | 0.679 | 77% | 0.773 | S | S | * | * | trans | -79.2 | 118.4 | 167.4 | 176.3 | 0 | 0 | 0 | 0 | 108.9 | V247 | V247-V249 HydrophobicContact CG1-CG2 3.9Å; V247-V249 PolarHBondContact O-N 3.33Å | ||
| 250 | S | 36.7 | Very low | 37 | Very low | 97 Ų | 97 | 134.3 Ų | 134.3 | 68% | 0.678 | 78% | 0.781 | S | S | * | * | trans | -120.2 | 104 | 164.4 | -63.7 | 0 | 0 | 0 | 0 | 107.8 | K248 | K248-S250 PolarHBondContact O-N 3.06Š| ||
| 251 | S | 40.6 | Very low | 37 | Very low | 94 Ų | 94 | 133 Ų | 133 | 66% | 0.657 | 78% | 0.783 | S | S | * | * | trans | -145.6 | 94 | 174.2 | 56.9 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 252 | E | 34.8 | Very low | 37.2 | Very low | 178 Ų | 178 | 132 Ų | 132 | 83% | 0.832 | 79% | 0.786 | S | S | * | * | trans | -69.5 | 136.7 | 173.3 | -64.3 | 177.3 | 108.9 | 0 | 0 | 109.6 | ||||
| 253 | T | 35 | Very low | 36.9 | Very low | 120 Ų | 120 | 135.1 Ų | 135.1 | 74% | 0.736 | 79% | 0.791 | S | S | * | * | trans | -147.4 | 95.4 | 165.5 | -62.9 | 0 | 0 | 0 | 0 | 106.9 | I255 | T253-I255 HydrophobicContact CG2-CG1 4.38Å; T253-I255 PolarHBondContact O-N 3.37Å | ||
| 254 | Q | 37.5 | Very low | 36.5 | Very low | 179 Ų | 179 | 133.7 Ų | 133.7 | 84% | 0.836 | 79% | 0.792 | S | S | * | * | trans | -77.4 | 111.4 | 178.6 | -63.3 | -170.4 | 15.1 | 0 | 0 | 109.4 | ||||
| 255 | I | 37.1 | Very low | 36.7 | Very low | 140 Ų | 140 | 134.3 Ų | 134.3 | 72% | 0.718 | 80% | 0.795 | S | S | * | * | trans | -102.5 | 104.1 | 164.4 | -61 | 179.2 | 0 | 0 | 0 | 106.5 | T253 T257 | T253-I255 HydrophobicContact CG2-CG1 4.38Å; T253-I255 PolarHBondContact O-N 3.37Å; I255-T257 HydrophobicContact CG2-CG2 4.48Å; I255-T257 PolarHBondContact O-N 3.11Å | ||
| 256 | S | 33.3 | Very low | 36.4 | Very low | 118 Ų | 118 | 139.5 Ų | 139.5 | 83% | 0.825 | 80% | 0.797 | S | S | * | * | trans | -83.7 | 107.1 | 178.9 | -173.5 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 257 | T | 35.5 | Very low | 36.8 | Very low | 119 Ų | 119 | 135.5 Ų | 135.5 | 73% | 0.73 | 79% | 0.791 | S | S | * | * | trans | -126.1 | 92.9 | 169 | 40 | 0 | 0 | 0 | 0 | 109.4 | I255 V259 | I255-T257 HydrophobicContact CG2-CG2 4.48Å; I255-T257 PolarHBondContact O-N 3.11Å; T257-V259 PolarHBondContact O-N 2.86Å | ||
| 258 | G | 37.6 | Very low | 37.2 | Very low | 79 Ų | 79 | 139.9 Ų | 139.9 | 81% | 0.814 | 79% | 0.792 | S | S | * | * | trans | -72.6 | 112.2 | 178.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 259 | V | 33.1 | Very low | 37.8 | Very low | 125 Ų | 125 | 142.8 Ų | 142.8 | 76% | 0.758 | 80% | 0.798 | S | S | * | * | trans | -121.4 | 116.2 | 164.7 | -177.8 | 0 | 0 | 0 | 0 | 107.9 | T257 V261 | T257-V259 PolarHBondContact O-N 2.86Å; V259-V261 HydrophobicContact CG1-CG2 4.36Å; V259-V261 PolarHBondContact O-N 3.35Å | ||
| 260 | M | 34.9 | Very low | 38 | Very low | 195 Ų | 195 | 143.2 Ų | 143.2 | 96% | 0.961 | 80% | 0.801 | S | S | * | * | trans | -82.6 | 108.1 | 179.4 | -70.9 | -87.1 | -76.6 | 0 | 0 | 109.8 | ||||
| 261 | V | 35.4 | Very low | 38.7 | Very low | 121 Ų | 121 | 148.4 Ų | 148.4 | 73% | 0.733 | 81% | 0.812 | S | S | * | * | trans | -120 | 119.7 | 162.5 | -177 | 0 | 0 | 0 | 0 | 107.6 | V259 | V259-V261 HydrophobicContact CG1-CG2 4.36Å; V259-V261 PolarHBondContact O-N 3.35Å | ||
| 262 | A | 38.7 | Very low | 38.7 | Very low | 106 Ų | 106 | 149.1 Ų | 149.1 | 88% | 0.876 | 82% | 0.817 | S | S | * | * | trans | -88.9 | 124.5 | 172.9 | 0 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 263 | E | 34.8 | Very low | 39.7 | Very low | 192 Ų | 192 | 147.9 Ų | 147.9 | 90% | 0.897 | 82% | 0.821 | S | S | * | * | trans | -128.3 | 151.5 | 172.1 | -165.1 | 160.6 | -172.2 | 0 | 0 | 110.9 | ||||
| 264 | A | 36.8 | Very low | 40.2 | Very low | 87 Ų | 87 | 146.4 Ų | 146.4 | 72% | 0.719 | 82% | 0.821 | S | S | * | * | trans | -96.6 | 165.6 | -154.4 | 0 | 0 | 0 | 0 | 0 | 114.8 | Q266 | A264-Q266 PolarHBondContact O-N 3.46Š| ||
| 265 | N | 41.3 | Very low | 41 | Very low | 165 Ų | 165 | 143.2 Ų | 143.2 | 88% | 0.882 | 83% | 0.825 | S | S | * | * | trans | -27.2 | 127.4 | 170.2 | -72.5 | -52.7 | 0 | 0 | 0 | 115.3 | ||||
| 266 | Q | 39.5 | Very low | 41.6 | Very low | 191 Ų | 191 | 141.7 Ų | 141.7 | 89% | 0.893 | 83% | 0.827 | S | S | * | * | trans | -137 | 101.9 | 149.3 | -133.6 | 169.2 | 105.6 | 0 | 0 | 112.4 | A264 | A264-Q266 PolarHBondContact O-N 3.46Š| ||
| 267 | S | 46.7 | Very low | 42.9 | Very low | 108 Ų | 108 | 141.2 Ų | 141.2 | 76% | 0.755 | 82% | 0.821 | S | S | * | * | trans | -77.6 | 123.3 | 169.4 | 175.2 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 268 | R | 44.8 | Very low | 43.8 | Very low | 228 Ų | 228 | 139.5 Ų | 139.5 | 86% | 0.86 | 81% | 0.812 | S | S | * | * | trans | -154.4 | 102.9 | 152.4 | -112.2 | 165.8 | -148.6 | -151.8 | 5.1 | 112.5 | ||||
| 269 | R | 46.4 | Very low | 44.8 | Very low | 244 Ų | 244 | 139.1 Ų | 139.1 | 92% | 0.921 | 80% | 0.801 | S | S | * | * | trans | -86.5 | 101.9 | 167.4 | 173.6 | -170.8 | 172.5 | -170.2 | -1.1 | 109.1 | ||||
| 270 | T | 37.7 | Very low | 46.1 | Very low | 122 Ų | 122 | 139.5 Ų | 139.5 | 75% | 0.748 | 80% | 0.795 | S | S | * | * | trans | -129.5 | 125.1 | 165 | 43.9 | 0 | 0 | 0 | 0 | 110 | ||||
| 271 | K | 51.8 | Low | 47.4 | Very low | 205 Ų | 205 | 134.8 Ų | 134.8 | 89% | 0.891 | 77% | 0.773 | S | S | * | * | trans | -111 | 106.2 | -175.1 | 180 | -174.5 | 179.8 | -176.2 | 0 | 108.8 | ||||
| 272 | S | 39.5 | Very low | 48.8 | Very low | 109 Ų | 109 | 133.1 Ų | 133.1 | 76% | 0.762 | 76% | 0.763 | S | S | * | * | trans | -141.1 | 120.5 | 176.4 | 49.3 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 273 | V | 56 | Low | 50.4 | Low | 152 Ų | 152 | 133.4 Ų | 133.4 | 92% | 0.921 | 75% | 0.749 | S | S | * | * | trans | -88.3 | 112.7 | 173.6 | 175.1 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 274 | A | 44.8 | Very low | 52.7 | Low | 90 Ų | 90 | 127.7 Ų | 127.7 | 74% | 0.744 | 73% | 0.725 | S | S | * | * | trans | -150.9 | 136.6 | 166 | 0 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 275 | A | 55.6 | Low | 55.3 | Low | 111 Ų | 111 | 128 Ų | 128 | 92% | 0.917 | 71% | 0.714 | S | S | * | * | trans | -76 | 132.2 | 178 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 276 | S | 48.8 | Very low | 57.8 | Low | 108 Ų | 108 | 124 Ų | 124 | 76% | 0.755 | 69% | 0.692 | S | S | * | * | trans | -138.9 | 139.6 | 170.6 | -168.2 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 277 | P | 60.3 | Low | 60.4 | Low | 109 Ų | 109 | 119 Ų | 119 | 71% | 0.708 | 67% | 0.671 | S | S | * | * | trans | -62.2 | 162.3 | 179.6 | -23.3 | 35 | 0 | 0 | 0 | 113.6 | A279 | P277-A279 PolarHBondContact O-N 2.89Š| ||
| 278 | P | 54.8 | Low | 62.7 | Low | 82 Ų | 82 | 120.3 Ų | 120.3 | 53% | 0.532 | 66% | 0.664 | S | S | . | * | trans | -76.5 | 85.2 | -165.7 | 31.2 | -36.9 | 0 | 0 | 0 | 113.6 | H280 N281 | P278-H280 PolarHBondContact O-N 3.48Å; P278-H280 VanDerWaalsContact O-N 3.12Å; P278-N281 WeakPolarHBondContact CG-ND2 3.05Å; P278-N281 WeakPolarHBondContact O-CB 3.44Å; P278-N281 PolarHBondContact O-N 2.93Å | ||
| 279 | A | 58.9 | Low | 65.2 | Low | 72 Ų | 72 | 114.4 Ų | 114.4 | 60% | 0.595 | 65% | 0.648 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -54.9 | -25.8 | 168.4 | 0 | 0 | 0 | 0 | 0 | 113.1 | P277 N281 V282 | P277-A279 PolarHBondContact O-N 2.89Å; A279-N281 PolarHBondContact O-N 3.45Å; A279-V282 PolarHBondContact O-N 2.74Å |
| 280 | H | 61.2 | Low | 67.5 | Low | 133 Ų | 133 | 108 Ų | 108 | 62% | 0.616 | 63% | 0.628 | S | S | * | * | H | α-helix | trans | -55.7 | -27.3 | 171.9 | -164.5 | -30.8 | 0 | 0 | 0 | 113.1 | P278 N284 | P278-H280 PolarHBondContact O-N 3.48Å; P278-H280 VanDerWaalsContact O-N 3.12Å; H280-N284 PolarHBondContact CE1-OD1 3.44Å; H280-N284 PolarHBondContact ND1-OD1 3.46Å; H280-N284 VanDerWaalsContact ND1-OD1 3.13Å; H280-N284 WeakPolarHBondContact O-CB 3.42Å; H280-N284 VanDerWaalsContact O-CG 3.3Å; H280-N284 PolarHBondContact O-N 3.03Å; H280-N284 PolarHBondContact O-OD1 3.45Å |
| 281 | N | 61.9 | Low | 70.4 | Confident | 96 Ų | 96 | 108.3 Ų | 108.3 | 51% | 0.513 | 62% | 0.621 | S | S | . | * | H | α-helix | trans | -76.3 | -30.7 | -179.4 | -70.1 | -9.7 | 0 | 0 | 0 | 112.8 | P278 A279 N284 I285 | P278-N281 WeakPolarHBondContact CG-ND2 3.05Å; P278-N281 WeakPolarHBondContact O-CB 3.44Å; P278-N281 PolarHBondContact O-N 2.93Å; A279-N281 PolarHBondContact O-N 3.45Å; N281-N284 PolarHBondContact O-N 2.93Å; N281-I285 WeakPolarHBondContact O-CD1 3.45Å; N281-I285 VanDerWaalsContact O-CG1 3.29Å; N281-I285 WeakPolarHBondContact O-CG1 3.45Å; N281-I285 PolarHBondContact O-N 3.25Å; N281-I285 VanDerWaalsContact O-N 3.16Å |
| 282 | V | 65 | Low | 72.6 | Confident | 85 Ų | 85 | 101.2 Ų | 101.2 | 52% | 0.515 | 60% | 0.601 | S | S | . | * | H | α-helix | trans | -72.3 | -50.8 | -176.5 | -176.4 | 0 | 0 | 0 | 0 | 110.5 | A279 N284 I285 D286 | A279-V282 PolarHBondContact O-N 2.74Å; V282-N284 PolarHBondContact O-N 3.13Å; V282-N284 VanDerWaalsContact O-N 3.17Å; V282-I285 WeakPolarHBondContact O-CA 3.29Å; V282-I285 WeakPolarHBondContact O-CB 3.33Å; V282-I285 PolarHBondContact O-N 3.16Å; V282-D286 PolarHBondContact O-N 3.45Å |
| 283 | L | 70.7 | Confident | 75.3 | Confident | 112 Ų | 112 | 100.9 Ų | 100.9 | 59% | 0.586 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -57.8 | -33.2 | 175.5 | -57.7 | 176.1 | 0 | 0 | 0 | 112 | I285 N287 | L283-I285 VanDerWaalsContact C-N 3.33Å; L283-N287 WeakPolarHBondContact O-CB 3.34Å; L283-N287 PolarHBondContact O-N 2.96Å; L283-N287 PolarHBondContact O-ND2 2.95Å |
| 284 | N | 83.3 | Confident | 77.3 | Confident | 73 Ų | 73 | 96.8 Ų | 96.8 | 39% | 0.39 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -75.6 | -16.1 | 175.1 | -78.7 | 48.1 | 0 | 0 | 0 | 114 | H280 N281 V282 K288 | H280-N284 PolarHBondContact CE1-OD1 3.44Å; H280-N284 PolarHBondContact ND1-OD1 3.46Å; H280-N284 VanDerWaalsContact ND1-OD1 3.13Å; H280-N284 WeakPolarHBondContact O-CB 3.42Å; H280-N284 VanDerWaalsContact O-CG 3.3Å; H280-N284 PolarHBondContact O-N 3.03Å; H280-N284 PolarHBondContact O-OD1 3.45Å; N281-N284 PolarHBondContact O-N 2.93Å; V282-N284 PolarHBondContact O-N 3.13Å; V282-N284 VanDerWaalsContact O-N 3.17Å; N284-K288 VanDerWaalsContact O-CD 3.3Å; N284-K288 WeakPolarHBondContact O-CD 3.48Å; N284-K288 VanDerWaalsContact O-CG 3.24Å; N284-K288 WeakPolarHBondContact O-CG 3.43Å |
| 285 | I | 91.9 | Very high | 79.9 | Confident | 93 Ų | 93 | 98.2 Ų | 98.2 | 48% | 0.477 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -84.6 | -45.5 | 171.4 | -71.9 | 160.9 | 0 | 0 | 0 | 109.7 | N281 V282 L283 N287 K288 I289 | N281-I285 WeakPolarHBondContact O-CD1 3.45Å; N281-I285 VanDerWaalsContact O-CG1 3.29Å; N281-I285 WeakPolarHBondContact O-CG1 3.45Å; N281-I285 PolarHBondContact O-N 3.25Å; N281-I285 VanDerWaalsContact O-N 3.16Å; V282-I285 WeakPolarHBondContact O-CA 3.29Å; V282-I285 WeakPolarHBondContact O-CB 3.33Å; V282-I285 PolarHBondContact O-N 3.16Å; L283-I285 VanDerWaalsContact C-N 3.33Å; I285-N287 VanDerWaalsContact C-N 3.35Å; I285-N287 PolarHBondContact O-N 3.19Å; I285-K288 CarbonylContact O-C 3.57Å; I285-K288 WeakPolarHBondContact O-CA 3.21Å; I285-K288 WeakPolarHBondContact O-CB 3.37Å; I285-K288 PolarHBondContact O-N 3.3Å; I285-I289 HydrophobicContact CG2-CD1 3.82Å; I285-I289 HydrophobicContact CG2-CG1 4.36Å; I285-I289 WeakPolarHBondContact O-CG1 3.09Å; I285-I289 PolarHBondContact O-N 3.35Å |
| 286 | D | 94.9 | Very high | 81.9 | Confident | 82 Ų | 82 | 97.7 Ų | 97.7 | 44% | 0.439 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -58 | -47.9 | 178.8 | -59.4 | -36.5 | 0 | 0 | 0 | 110.9 | V282 K288 I289 E290 | V282-D286 PolarHBondContact O-N 3.45Å; D286-K288 PolarHBondContact O-N 3.48Å; D286-K288 VanDerWaalsContact O-N 3.16Å; D286-I289 PolarHBondContact O-N 3.08Å; D286-I289 VanDerWaalsContact O-N 3.09Å; D286-E290 PolarHBondContact O-N 3.35Å |
| 287 | N | 93.4 | Very high | 84.3 | Confident | 84 Ų | 84 | 97.4 Ų | 97.4 | 45% | 0.449 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -59.4 | -27.3 | 174 | -68.2 | -8.7 | 0 | 0 | 0 | 113.5 | L283 I285 Q291 | L283-N287 WeakPolarHBondContact O-CB 3.34Å; L283-N287 PolarHBondContact O-N 2.96Å; L283-N287 PolarHBondContact O-ND2 2.95Å; I285-N287 VanDerWaalsContact C-N 3.35Å; I285-N287 PolarHBondContact O-N 3.19Å; N287-Q291 VanDerWaalsContact O-CG 3.29Å; N287-Q291 WeakPolarHBondContact O-CG 3.03Å; N287-Q291 PolarHBondContact O-N 3.22Å; N287-Q291 VanDerWaalsContact O-N 3.17Å; N287-Q291 PolarHBondContact O-NE2 3.01Å |
| 288 | K | 95.3 | Very high | 86.1 | Confident | 137 Ų | 137 | 95.2 Ų | 95.2 | 60% | 0.596 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -80.8 | -34.8 | 175.9 | -79.1 | 174 | 177.8 | -64.6 | 0 | 112.3 | N284 I285 D286 A292 | N284-K288 VanDerWaalsContact O-CD 3.3Å; N284-K288 WeakPolarHBondContact O-CD 3.48Å; N284-K288 VanDerWaalsContact O-CG 3.24Å; N284-K288 WeakPolarHBondContact O-CG 3.43Å; I285-K288 CarbonylContact O-C 3.57Å; I285-K288 WeakPolarHBondContact O-CA 3.21Å; I285-K288 WeakPolarHBondContact O-CB 3.37Å; I285-K288 PolarHBondContact O-N 3.3Å; D286-K288 PolarHBondContact O-N 3.48Å; D286-K288 VanDerWaalsContact O-N 3.16Å; K288-A292 WeakPolarHBondContact O-CB 3.32Å; K288-A292 PolarHBondContact O-N 3.26Å |
| 289 | I | 95.9 | Very high | 88.2 | Confident | 104 Ų | 104 | 97.7 Ų | 97.7 | 53% | 0.533 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -65.5 | -43.1 | 172.7 | -66.3 | 167.4 | 0 | 0 | 0 | 109.3 | I285 D286 A292 M293 | I285-I289 HydrophobicContact CG2-CD1 3.82Å; I285-I289 HydrophobicContact CG2-CG1 4.36Å; I285-I289 WeakPolarHBondContact O-CG1 3.09Å; I285-I289 PolarHBondContact O-N 3.35Å; D286-I289 PolarHBondContact O-N 3.08Å; D286-I289 VanDerWaalsContact O-N 3.09Å; I289-A292 PolarHBondContact O-N 2.98Å; I289-M293 WeakPolarHBondContact O-CB 3.35Å; I289-M293 PolarHBondContact O-N 3.45Å |
| 290 | E | 96.3 | Very high | 90 | Very high | 108 Ų | 108 | 99.4 Ų | 99.4 | 51% | 0.505 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -61.5 | -48.3 | 175.3 | -171.6 | 169.1 | -136 | 0 | 0 | 111.9 | D286 A292 M293 D294 | D286-E290 PolarHBondContact O-N 3.35Å; E290-A292 VanDerWaalsContact C-N 3.33Å; E290-A292 PolarHBondContact O-N 3.46Å; E290-M293 HydrophobicContact CG-CE 4.48Å; E290-M293 PolarHBondContact O-N 2.97Å; E290-D294 PolarHBondContact O-N 2.87Å |
| 291 | Q | 97 | Very high | 91.8 | Very high | 129 Ų | 129 | 99 Ų | 99 | 60% | 0.603 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -57.1 | -42 | 173.6 | -79.5 | 164.6 | 67.5 | 0 | 0 | 113.1 | N287 L295 | N287-Q291 VanDerWaalsContact O-CG 3.29Å; N287-Q291 WeakPolarHBondContact O-CG 3.03Å; N287-Q291 PolarHBondContact O-N 3.22Å; N287-Q291 VanDerWaalsContact O-N 3.17Å; N287-Q291 PolarHBondContact O-NE2 3.01Å; Q291-L295 WeakPolarHBondContact O-CB 3.38Å; Q291-L295 PolarHBondContact O-N 2.93Å |
| 292 | A | 97.8 | Very high | 93.5 | Very high | 56 Ų | 56 | 100.8 Ų | 100.8 | 46% | 0.463 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -67.8 | -40.1 | 177.1 | 0 | 0 | 0 | 0 | 0 | 111.9 | K288 I289 E290 L295 V296 | K288-A292 WeakPolarHBondContact O-CB 3.32Å; K288-A292 PolarHBondContact O-N 3.26Å; I289-A292 PolarHBondContact O-N 2.98Å; E290-A292 VanDerWaalsContact C-N 3.33Å; E290-A292 PolarHBondContact O-N 3.46Å; A292-L295 PolarHBondContact O-N 2.97Å; A292-V296 WeakPolarHBondContact O-CG2 3.49Å; A292-V296 PolarHBondContact O-N 3.3Å |
| 293 | M | 98.3 | Very high | 95.1 | Very high | 102 Ų | 102 | 98.5 Ų | 98.5 | 50% | 0.502 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -64.7 | -41.8 | 175.9 | 179.2 | 176.9 | 58 | 0 | 0 | 111.8 | I289 E290 V296 K297 | I289-M293 WeakPolarHBondContact O-CB 3.35Å; I289-M293 PolarHBondContact O-N 3.45Å; E290-M293 HydrophobicContact CG-CE 4.48Å; E290-M293 PolarHBondContact O-N 2.97Å; M293-V296 PolarHBondContact O-N 3.47Å; M293-K297 VanDerWaalsContact O-CB 3.23Å; M293-K297 WeakPolarHBondContact O-CB 3.5Å; M293-K297 PolarHBondContact O-N 3.48Å |
| 294 | D | 97.9 | Very high | 96.4 | Very high | 67 Ų | 67 | 97 Ų | 97 | 36% | 0.358 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -70.9 | -33.4 | 177 | -85.2 | -10.8 | 0 | 0 | 0 | 112.8 | E290 K297 T298 | E290-D294 PolarHBondContact O-N 2.87Å; D294-K297 PolarHBondContact O-N 3.29Å; D294-K297 VanDerWaalsContact OD1-CE 3.3Å; D294-K297 WeakPolarHBondContact OD1-CE 3.44Å; D294-K297 IonicContact OD1-NZ 3.79Å; D294-K297 PolarHBondContact OD1-NZ 3.49Å; D294-T298 WeakPolarHBondContact O-CB 3.33Å; D294-T298 WeakPolarHBondContact O-CG2 3.48Å; D294-T298 PolarHBondContact O-N 2.7Å; D294-T298 PolarHBondContact O-OG1 2.91Å |
| 295 | L | 98.2 | Very high | 97.2 | Very high | 120 Ų | 120 | 101 Ų | 101 | 63% | 0.628 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -64.4 | -43.6 | 170.1 | -177.5 | 62.2 | 0 | 0 | 0 | 111.6 | Q291 A292 T298 H299 | Q291-L295 WeakPolarHBondContact O-CB 3.38Å; Q291-L295 PolarHBondContact O-N 2.93Å; A292-L295 PolarHBondContact O-N 2.97Å; L295-T298 PolarHBondContact O-OG1 3.26Å; L295-T298 VanDerWaalsContact O-OG1 3.11Å; L295-H299 VanDerWaalsContact O-CB 3.22Å; L295-H299 WeakPolarHBondContact O-CB 3.34Å; L295-H299 PolarHBondContact O-N 3.29Å |
| 296 | V | 98.3 | Very high | 97.5 | Very high | 99 Ų | 99 | 103.8 Ų | 103.8 | 60% | 0.6 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -64.4 | -43.6 | 174.7 | 169.2 | 0 | 0 | 0 | 0 | 111.2 | A292 M293 H299 L300 | A292-V296 WeakPolarHBondContact O-CG2 3.49Å; A292-V296 PolarHBondContact O-N 3.3Å; M293-V296 PolarHBondContact O-N 3.47Å; V296-H299 PolarHBondContact O-N 3.41Å; V296-L300 VanDerWaalsContact O-CB 3.29Å; V296-L300 WeakPolarHBondContact O-CB 3.39Å; V296-L300 PolarHBondContact O-N 2.96Å |
| 297 | K | 98.5 | Very high | 97.6 | Very high | 103 Ų | 103 | 106.2 Ų | 106.2 | 45% | 0.448 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -59.5 | -50 | 177.7 | -176.6 | -170 | -62.4 | 166.8 | 0 | 111.5 | M293 D294 M301 | M293-K297 VanDerWaalsContact O-CB 3.23Å; M293-K297 WeakPolarHBondContact O-CB 3.5Å; M293-K297 PolarHBondContact O-N 3.48Å; D294-K297 PolarHBondContact O-N 3.29Å; D294-K297 VanDerWaalsContact OD1-CE 3.3Å; D294-K297 WeakPolarHBondContact OD1-CE 3.44Å; D294-K297 IonicContact OD1-NZ 3.79Å; D294-K297 PolarHBondContact OD1-NZ 3.49Å; K297-M301 HydrophobicContact CG-SD 4.44Å; K297-M301 WeakPolarHBondContact O-CB 3.29Å; K297-M301 VanDerWaalsContact O-CG 3.28Å; K297-M301 WeakPolarHBondContact O-CG 3.44Å; K297-M301 PolarHBondContact O-N 3.48Å |
| 298 | T | 98.2 | Very high | 97.9 | Very high | 62 Ų | 62 | 105 Ų | 105 | 38% | 0.38 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -66.7 | -44 | 178.3 | 49.7 | 0 | 0 | 0 | 0 | 111.9 | D294 L295 L300 M301 F302 | D294-T298 WeakPolarHBondContact O-CB 3.33Å; D294-T298 WeakPolarHBondContact O-CG2 3.48Å; D294-T298 PolarHBondContact O-N 2.7Å; D294-T298 PolarHBondContact O-OG1 2.91Å; L295-T298 PolarHBondContact O-OG1 3.26Å; L295-T298 VanDerWaalsContact O-OG1 3.11Å; T298-L300 PolarHBondContact O-N 3.42Å; T298-M301 PolarHBondContact O-N 2.91Å; T298-F302 WeakPolarHBondContact O-CD2 3.43Å; T298-F302 PolarHBondContact O-N 3.45Å |
| 299 | H | 98.4 | Very high | 98 | Very high | 134 Ų | 134 | 102 Ų | 102 | 62% | 0.62 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -59.6 | -45 | 176.3 | -176.9 | 56.3 | 0 | 0 | 0 | 112.2 | L295 V296 F302 A303 | L295-H299 VanDerWaalsContact O-CB 3.22Å; L295-H299 WeakPolarHBondContact O-CB 3.34Å; L295-H299 PolarHBondContact O-N 3.29Å; V296-H299 PolarHBondContact O-N 3.41Å; H299-F302 PolarHBondContact O-N 3.28Å; H299-A303 WeakPolarHBondContact O-CB 3.26Å; H299-A303 PolarHBondContact O-N 3.16Å |
| 300 | L | 98.5 | Very high | 98.1 | Very high | 108 Ų | 108 | 99.3 Ų | 99.3 | 57% | 0.565 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -63.4 | -40.8 | 175.8 | -176.4 | 64.6 | 0 | 0 | 0 | 111.9 | V296 T298 F302 A303 V304 | V296-L300 VanDerWaalsContact O-CB 3.29Å; V296-L300 WeakPolarHBondContact O-CB 3.39Å; V296-L300 PolarHBondContact O-N 2.96Å; T298-L300 PolarHBondContact O-N 3.42Å; L300-F302 VanDerWaalsContact C-N 3.31Å; L300-F302 PolarHBondContact O-N 3.43Å; L300-A303 PolarHBondContact O-N 3.43Å; L300-V304 HydrophobicContact CD1-CG2 3.79Å; L300-V304 HydrophobicContact CG-CG2 4.16Å; L300-V304 VanDerWaalsContact O-CB 3.32Å; L300-V304 WeakPolarHBondContact O-CB 3.27Å; L300-V304 VanDerWaalsContact O-CG2 3.27Å; L300-V304 WeakPolarHBondContact O-CG2 3.46Å; L300-V304 PolarHBondContact O-N 2.87Å |
| 301 | M | 98.1 | Very high | 98.2 | Very high | 126 Ų | 126 | 99.1 Ų | 99.1 | 62% | 0.621 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -61.6 | -36.6 | 175.1 | -76.4 | 176.1 | 65 | 0 | 0 | 112.9 | K297 T298 R305 | K297-M301 HydrophobicContact CG-SD 4.44Å; K297-M301 WeakPolarHBondContact O-CB 3.29Å; K297-M301 VanDerWaalsContact O-CG 3.28Å; K297-M301 WeakPolarHBondContact O-CG 3.44Å; K297-M301 PolarHBondContact O-N 3.48Å; T298-M301 PolarHBondContact O-N 2.91Å; M301-R305 WeakPolarHBondContact O-CB 3.41Å; M301-R305 PolarHBondContact O-N 3.07Å |
| 302 | F | 98.2 | Very high | 98.3 | Very high | 132 Ų | 132 | 100.5 Ų | 100.5 | 58% | 0.579 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -71.8 | -50.1 | 174.9 | -71.3 | -61.2 | 0 | 0 | 0 | 111.8 | T298 H299 L300 V304 R305 E306 | T298-F302 WeakPolarHBondContact O-CD2 3.43Å; T298-F302 PolarHBondContact O-N 3.45Å; H299-F302 PolarHBondContact O-N 3.28Å; L300-F302 VanDerWaalsContact C-N 3.31Å; L300-F302 PolarHBondContact O-N 3.43Å; F302-V304 PolarHBondContact O-N 2.85Å; F302-R305 PolarHBondContact O-N 3.05Å; F302-R305 VanDerWaalsContact O-N 3.16Å; F302-E306 PolarHBondContact O-N 3.46Å |
| 303 | A | 98.3 | Very high | 98.4 | Very high | 38 Ų | 38 | 99.5 Ų | 99.5 | 31% | 0.314 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -60.1 | -44.8 | -179.9 | 0 | 0 | 0 | 0 | 0 | 112.4 | H299 L300 R305 E306 E307 | H299-A303 WeakPolarHBondContact O-CB 3.26Å; H299-A303 PolarHBondContact O-N 3.16Å; L300-A303 PolarHBondContact O-N 3.43Å; A303-R305 VanDerWaalsContact C-N 3.33Å; A303-R305 PolarHBondContact O-N 2.9Å; A303-E306 PolarHBondContact O-N 3.1Å; A303-E307 WeakPolarHBondContact O-CG 3.44Å; A303-E307 PolarHBondContact O-N 2.98Å |
| 304 | V | 98.6 | Very high | 98.4 | Very high | 80 Ų | 80 | 100.3 Ų | 100.3 | 49% | 0.485 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -65.9 | -34.5 | 177.2 | 172.6 | 0 | 0 | 0 | 0 | 111.7 | L300 F302 V308 | L300-V304 HydrophobicContact CD1-CG2 3.79Å; L300-V304 HydrophobicContact CG-CG2 4.16Å; L300-V304 VanDerWaalsContact O-CB 3.32Å; L300-V304 WeakPolarHBondContact O-CB 3.27Å; L300-V304 VanDerWaalsContact O-CG2 3.27Å; L300-V304 WeakPolarHBondContact O-CG2 3.46Å; L300-V304 PolarHBondContact O-N 2.87Å; F302-V304 PolarHBondContact O-N 2.85Å; V304-V308 HydrophobicContact CG1-CG2 4.43Å; V304-V308 VanDerWaalsContact O-CB 3.31Å; V304-V308 WeakPolarHBondContact O-CB 3.25Å; V304-V308 WeakPolarHBondContact O-CG2 3.34Å; V304-V308 PolarHBondContact O-N 2.84Å; V304-V308 VanDerWaalsContact O-N 3.08Å |
| 305 | R | 98.1 | Very high | 98.4 | Very high | 158 Ų | 158 | 101.6 Ų | 101.6 | 60% | 0.596 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -65.5 | -47.6 | 172.4 | 172.8 | 175.7 | -79 | 150.9 | -3.7 | 111.3 | M301 F302 A303 V308 D309 | M301-R305 WeakPolarHBondContact O-CB 3.41Å; M301-R305 PolarHBondContact O-N 3.07Å; F302-R305 PolarHBondContact O-N 3.05Å; F302-R305 VanDerWaalsContact O-N 3.16Å; A303-R305 VanDerWaalsContact C-N 3.33Å; A303-R305 PolarHBondContact O-N 2.9Å; R305-V308 PolarHBondContact O-N 3.18Å; R305-D309 WeakPolarHBondContact CG-OD2 3.19Å; R305-D309 WeakPolarHBondContact O-CB 3.43Å; R305-D309 PolarHBondContact O-N 3.45Å |
| 306 | E | 98.4 | Very high | 98.4 | Very high | 151 Ų | 151 | 101.7 Ų | 101.7 | 71% | 0.706 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -60.7 | -46.2 | -178.1 | -172.8 | 169.5 | -175.2 | 0 | 0 | 111.6 | F302 A303 D309 G310 | F302-E306 PolarHBondContact O-N 3.46Å; A303-E306 PolarHBondContact O-N 3.1Å; E306-D309 PolarHBondContact O-N 2.9Å; E306-G310 PolarHBondContact O-N 3.13Å |
| 307 | E | 98.3 | Very high | 98.4 | Very high | 133 Ų | 133 | 101.7 Ų | 101.7 | 62% | 0.621 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -62.5 | -43.7 | 174.2 | -70.5 | -65.7 | 155.9 | 0 | 0 | 112.3 | A303 G310 L311 | A303-E307 WeakPolarHBondContact O-CG 3.44Å; A303-E307 PolarHBondContact O-N 2.98Å; E307-G310 PolarHBondContact O-N 2.63Å; E307-L311 WeakPolarHBondContact O-CB 3.22Å; E307-L311 VanDerWaalsContact O-CG 3.23Å; E307-L311 WeakPolarHBondContact O-CG 3.49Å; E307-L311 PolarHBondContact O-N 3.37Å |
| 308 | V | 98.7 | Very high | 98.4 | Very high | 59 Ų | 59 | 101 Ų | 101 | 36% | 0.358 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -65 | -43.5 | 178.5 | 165.1 | 0 | 0 | 0 | 0 | 112.1 | V304 R305 L311 R312 | V304-V308 HydrophobicContact CG1-CG2 4.43Å; V304-V308 VanDerWaalsContact O-CB 3.31Å; V304-V308 WeakPolarHBondContact O-CB 3.25Å; V304-V308 WeakPolarHBondContact O-CG2 3.34Å; V304-V308 PolarHBondContact O-N 2.84Å; V304-V308 VanDerWaalsContact O-N 3.08Å; R305-V308 PolarHBondContact O-N 3.18Å; V308-L311 PolarHBondContact O-N 2.86Å; V308-R312 WeakPolarHBondContact O-CB 3.35Å; V308-R312 WeakPolarHBondContact O-CD 3.17Å; V308-R312 VanDerWaalsContact O-CG 3.22Å; V308-R312 WeakPolarHBondContact O-CG 3.47Å; V308-R312 PolarHBondContact O-N 2.88Å |
| 309 | D | 98.4 | Very high | 98.4 | Very high | 74 Ų | 74 | 102.8 Ų | 102.8 | 40% | 0.396 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -74.7 | -31.7 | 179.9 | -70.1 | -30.5 | 0 | 0 | 0 | 111.9 | R305 E306 R312 G313 | R305-D309 WeakPolarHBondContact CG-OD2 3.19Å; R305-D309 WeakPolarHBondContact O-CB 3.43Å; R305-D309 PolarHBondContact O-N 3.45Å; E306-D309 PolarHBondContact O-N 2.9Å; D309-R312 PolarHBondContact O-N 2.99Å; D309-R312 WeakPolarHBondContact OD1-CD 3.43Å; D309-R312 IonicContact OD1-CZ 2.7Å; D309-R312 IonicContact OD1-NE 3.68Å; D309-R312 IonicContact OD1-NH1 3.83Å; D309-R312 PolarHBondContact OD1-NH1 3Å; D309-G313 PolarHBondContact O-N 3.25Å |
| 310 | G | 98.5 | Very high | 98.4 | Very high | 46 Ų | 46 | 98.3 Ų | 98.3 | 47% | 0.474 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -63.7 | -45.4 | 168.4 | 0 | 0 | 0 | 0 | 0 | 113 | E306 E307 G313 K314 | E306-G310 PolarHBondContact O-N 3.13Å; E307-G310 PolarHBondContact O-N 2.63Å; G310-G313 PolarHBondContact O-N 2.98Å; G310-K314 WeakPolarHBondContact O-CB 3.29Å; G310-K314 PolarHBondContact O-N 3.46Å |
| 311 | L | 98.7 | Very high | 98.4 | Very high | 105 Ų | 105 | 97.7 Ų | 97.7 | 55% | 0.55 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -62.7 | -41.5 | 174.2 | -74.7 | 170.1 | 0 | 0 | 0 | 111.9 | E307 V308 K314 I315 | E307-L311 WeakPolarHBondContact O-CB 3.22Å; E307-L311 VanDerWaalsContact O-CG 3.23Å; E307-L311 WeakPolarHBondContact O-CG 3.49Å; E307-L311 PolarHBondContact O-N 3.37Å; V308-L311 PolarHBondContact O-N 2.86Å; L311-K314 PolarHBondContact O-N 3.22Å; L311-I315 VanDerWaalsContact O-CG1 3.29Å; L311-I315 WeakPolarHBondContact O-CG1 3.32Å; L311-I315 PolarHBondContact O-N 2.93Å |
| 312 | R | 98.4 | Very high | 98.4 | Very high | 158 Ų | 158 | 95.1 Ų | 95.1 | 60% | 0.596 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -59.4 | -47.1 | 174 | -76.1 | 162.1 | 168.5 | 175.4 | -3.6 | 112.1 | V308 D309 K314 I315 F316 | V308-R312 WeakPolarHBondContact O-CB 3.35Å; V308-R312 WeakPolarHBondContact O-CD 3.17Å; V308-R312 VanDerWaalsContact O-CG 3.22Å; V308-R312 WeakPolarHBondContact O-CG 3.47Å; V308-R312 PolarHBondContact O-N 2.88Å; D309-R312 PolarHBondContact O-N 2.99Å; D309-R312 WeakPolarHBondContact OD1-CD 3.43Å; D309-R312 IonicContact OD1-CZ 2.7Å; D309-R312 IonicContact OD1-NE 3.68Å; D309-R312 IonicContact OD1-NH1 3.83Å; D309-R312 PolarHBondContact OD1-NH1 3Å; R312-K314 VanDerWaalsContact C-N 3.31Å; R312-K314 PolarHBondContact O-N 3.45Å; R312-I315 PolarHBondContact O-N 2.93Å; R312-F316 PolarHBondContact O-N 3.47Å |
| 313 | G | 98.5 | Very high | 98.4 | Very high | 34 Ų | 34 | 95 Ų | 95 | 35% | 0.351 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -58.2 | -44.3 | 173.9 | 0 | 0 | 0 | 0 | 0 | 111.8 | D309 G310 I315 F316 D317 | D309-G313 PolarHBondContact O-N 3.25Å; G310-G313 PolarHBondContact O-N 2.98Å; G313-I315 PolarHBondContact O-N 3.2Å; G313-F316 PolarHBondContact O-N 3.03Å; G313-D317 PolarHBondContact O-N 2.93Å |
| 314 | K | 98.4 | Very high | 98.4 | Very high | 119 Ų | 119 | 100.4 Ų | 100.4 | 52% | 0.517 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -65.7 | -37.5 | 179.3 | -172.8 | 54.7 | 177.3 | 174.3 | 0 | 113.4 | G310 L311 R312 L318 | G310-K314 WeakPolarHBondContact O-CB 3.29Å; G310-K314 PolarHBondContact O-N 3.46Å; L311-K314 PolarHBondContact O-N 3.22Å; R312-K314 VanDerWaalsContact C-N 3.31Å; R312-K314 PolarHBondContact O-N 3.45Å; K314-L318 HydrophobicContact CD-CD1 4.41Å; K314-L318 HydrophobicContact CD-CG 4.44Å; K314-L318 HydrophobicContact CG-CD1 4.23Å; K314-L318 WeakPolarHBondContact O-CB 3.44Å; K314-L318 VanDerWaalsContact O-CG 3.25Å; K314-L318 WeakPolarHBondContact O-CG 3.23Å; K314-L318 PolarHBondContact O-N 2.91Å; K314-L318 VanDerWaalsContact O-N 3.13Å |
| 315 | I | 98.6 | Very high | 98.4 | Very high | 94 Ų | 94 | 100.3 Ų | 100.3 | 48% | 0.482 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -63 | -50.7 | 173.4 | -70.2 | 162.3 | 0 | 0 | 0 | 109.8 | L311 R312 G313 D317 L318 E319 | L311-I315 VanDerWaalsContact O-CG1 3.29Å; L311-I315 WeakPolarHBondContact O-CG1 3.32Å; L311-I315 PolarHBondContact O-N 2.93Å; R312-I315 PolarHBondContact O-N 2.93Å; G313-I315 PolarHBondContact O-N 3.2Å; I315-D317 PolarHBondContact O-N 3.29Å; I315-L318 PolarHBondContact O-N 3.12Å; I315-L318 VanDerWaalsContact O-N 3.11Å; I315-E319 HydrophobicContact CG2-CG 4.3Å; I315-E319 WeakPolarHBondContact O-CG 3.09Å; I315-E319 PolarHBondContact O-N 3.41Å |
| 316 | F | 98.5 | Very high | 98.3 | Very high | 122 Ų | 122 | 98.4 Ų | 98.4 | 54% | 0.535 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -57.2 | -44.9 | 179.2 | 178.9 | -108.4 | 0 | 0 | 0 | 112.6 | R312 G313 L318 E319 N320 | R312-F316 PolarHBondContact O-N 3.47Å; G313-F316 PolarHBondContact O-N 3.03Å; F316-L318 PolarHBondContact O-N 3.4Å; F316-E319 PolarHBondContact O-N 2.91Å; F316-N320 VanDerWaalsContact CD1-ND2 3.29Å; F316-N320 WeakPolarHBondContact CD1-ND2 3.41Å; F316-N320 WeakPolarHBondContact CE1-ND2 3.27Å; F316-N320 WeakPolarHBondContact CE2-ND2 3.32Å; F316-N320 WeakPolarHBondContact CZ-ND2 3.29Å; F316-N320 WeakPolarHBondContact O-CB 3.36Å; F316-N320 PolarHBondContact O-N 3.16Å; F316-N320 PolarHBondContact O-ND2 3.36Å |
| 317 | D | 98.5 | Very high | 98.2 | Very high | 99 Ų | 99 | 93.7 Ų | 93.7 | 53% | 0.529 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -61.5 | -41.6 | 175.5 | -80.1 | -15.7 | 0 | 0 | 0 | 112.7 | G313 I315 N320 H321 | G313-D317 PolarHBondContact O-N 2.93Å; I315-D317 PolarHBondContact O-N 3.29Å; D317-N320 PolarHBondContact O-N 2.85Å; D317-H321 WeakPolarHBondContact O-CB 3.31Å; D317-H321 PolarHBondContact O-N 2.78Å |
| 318 | L | 98.6 | Very high | 98.1 | Very high | 88 Ų | 88 | 91.9 Ų | 91.9 | 46% | 0.461 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -68.4 | -43.6 | 178 | -73 | 171.4 | 0 | 0 | 0 | 111.6 | K314 I315 F316 N320 H321 V322 | K314-L318 HydrophobicContact CD-CD1 4.41Å; K314-L318 HydrophobicContact CD-CG 4.44Å; K314-L318 HydrophobicContact CG-CD1 4.23Å; K314-L318 WeakPolarHBondContact O-CB 3.44Å; K314-L318 VanDerWaalsContact O-CG 3.25Å; K314-L318 WeakPolarHBondContact O-CG 3.23Å; K314-L318 PolarHBondContact O-N 2.91Å; K314-L318 VanDerWaalsContact O-N 3.13Å; I315-L318 PolarHBondContact O-N 3.12Å; I315-L318 VanDerWaalsContact O-N 3.11Å; F316-L318 PolarHBondContact O-N 3.4Å; L318-N320 VanDerWaalsContact C-N 3.33Å; L318-N320 PolarHBondContact O-N 3.17Å; L318-H321 PolarHBondContact O-N 3.11Å; L318-H321 VanDerWaalsContact O-N 3.16Å; L318-V322 WeakPolarHBondContact O-CB 3.45Å; L318-V322 WeakPolarHBondContact O-CG2 3.5Å; L318-V322 PolarHBondContact O-N 2.99Å |
| 319 | E | 98.4 | Very high | 97.8 | Very high | 100 Ų | 100 | 92.7 Ų | 92.7 | 47% | 0.467 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -59.7 | -42.9 | 173.5 | -72.3 | 179.9 | -178.8 | 0 | 0 | 111.9 | I315 F316 H321 V322 R323 | I315-E319 HydrophobicContact CG2-CG 4.3Å; I315-E319 WeakPolarHBondContact O-CG 3.09Å; I315-E319 PolarHBondContact O-N 3.41Å; F316-E319 PolarHBondContact O-N 2.91Å; E319-H321 VanDerWaalsContact C-N 3.29Å; E319-H321 PolarHBondContact O-N 3.3Å; E319-V322 PolarHBondContact O-N 3.09Å; E319-R323 VanDerWaalsContact O-CB 3.26Å; E319-R323 WeakPolarHBondContact O-CB 3.49Å; E319-R323 PolarHBondContact O-N 3.06Å |
| 320 | N | 98.2 | Very high | 97.6 | Very high | 41 Ų | 41 | 91.6 Ų | 91.6 | 22% | 0.219 | 46% | 0.462 | C | S | . | . | H | α-helix | trans | -67.8 | -28.4 | 176.5 | -70.4 | -33.6 | 0 | 0 | 0 | 112.8 | F316 D317 L318 R323 R324 | F316-N320 VanDerWaalsContact CD1-ND2 3.29Å; F316-N320 WeakPolarHBondContact CD1-ND2 3.41Å; F316-N320 WeakPolarHBondContact CE1-ND2 3.27Å; F316-N320 WeakPolarHBondContact CE2-ND2 3.32Å; F316-N320 WeakPolarHBondContact CZ-ND2 3.29Å; F316-N320 WeakPolarHBondContact O-CB 3.36Å; F316-N320 PolarHBondContact O-N 3.16Å; F316-N320 PolarHBondContact O-ND2 3.36Å; D317-N320 PolarHBondContact O-N 2.85Å; L318-N320 VanDerWaalsContact C-N 3.33Å; L318-N320 PolarHBondContact O-N 3.17Å; N320-R323 PolarHBondContact OD1-NH1 3Å; N320-R324 WeakPolarHBondContact O-CB 3.32Å |
| 321 | H | 98.4 | Very high | 97.3 | Very high | 95 Ų | 95 | 93.9 Ų | 93.9 | 44% | 0.44 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -76.2 | -47.1 | 173.2 | -173.6 | 41.8 | 0 | 0 | 0 | 111.4 | D317 L318 E319 R324 L325 | D317-H321 WeakPolarHBondContact O-CB 3.31Å; D317-H321 PolarHBondContact O-N 2.78Å; L318-H321 PolarHBondContact O-N 3.11Å; L318-H321 VanDerWaalsContact O-N 3.16Å; E319-H321 VanDerWaalsContact C-N 3.29Å; E319-H321 PolarHBondContact O-N 3.3Å; H321-R324 WeakPolarHBondContact O-CB 3.33Å; H321-R324 PolarHBondContact O-N 3.13Å; H321-L325 WeakPolarHBondContact O-CG 3.3Å; H321-L325 PolarHBondContact O-N 3.37Å |
| 322 | V | 98.3 | Very high | 96.9 | Very high | 71 Ų | 71 | 93.5 Ų | 93.5 | 43% | 0.43 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -57.6 | -52.6 | 175.9 | 169.3 | 0 | 0 | 0 | 0 | 110.6 | L318 E319 R324 L325 E326 | L318-V322 WeakPolarHBondContact O-CB 3.45Å; L318-V322 WeakPolarHBondContact O-CG2 3.5Å; L318-V322 PolarHBondContact O-N 2.99Å; E319-V322 PolarHBondContact O-N 3.09Å; V322-R324 PolarHBondContact O-N 3.44Å; V322-R324 VanDerWaalsContact O-N 3.12Å; V322-L325 CarbonylContact O-C 3.58Å; V322-L325 PolarHBondContact O-N 2.99Å; V322-E326 HydrophobicContact CG1-CG 4.11Å; V322-E326 WeakPolarHBondContact O-CB 3.28Å; V322-E326 WeakPolarHBondContact O-CG 3.23Å; V322-E326 PolarHBondContact O-N 3.41Å |
| 323 | R | 97.9 | Very high | 96.5 | Very high | 131 Ų | 131 | 91.5 Ų | 91.5 | 49% | 0.494 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -57.8 | -31.4 | -179.7 | -163.2 | -174.4 | -50.9 | 114 | 8.4 | 113.3 | E319 N320 A327 | E319-R323 VanDerWaalsContact O-CB 3.26Å; E319-R323 WeakPolarHBondContact O-CB 3.49Å; E319-R323 PolarHBondContact O-N 3.06Å; N320-R323 PolarHBondContact OD1-NH1 3Å; R323-A327 PolarHBondContact O-N 3.3Å |
| 324 | R | 98 | Very high | 95.9 | Very high | 151 Ų | 151 | 98.7 Ų | 98.7 | 57% | 0.57 | 47% | 0.473 | S | S | * | . | H | α-helix | trans | -73.4 | -49.3 | 175.2 | -167.8 | -161.2 | -45.4 | -148.5 | 0.5 | 111.3 | N320 H321 V322 E326 A327 E328 | N320-R324 WeakPolarHBondContact O-CB 3.32Å; H321-R324 WeakPolarHBondContact O-CB 3.33Å; H321-R324 PolarHBondContact O-N 3.13Å; V322-R324 PolarHBondContact O-N 3.44Å; V322-R324 VanDerWaalsContact O-N 3.12Å; R324-E326 VanDerWaalsContact C-N 3.27Å; R324-E326 PolarHBondContact O-N 3.13Å; R324-A327 WeakPolarHBondContact O-CB 3.34Å; R324-A327 PolarHBondContact O-N 3.25Å; R324-A327 VanDerWaalsContact O-N 3.15Å; R324-E328 WeakPolarHBondContact CD-OE1 3.36Å; R324-E328 WeakPolarHBondContact CG-OE1 3.38Å; R324-E328 WeakPolarHBondContact O-CG 3.04Å; R324-E328 PolarHBondContact O-N 3.23Å |
| 325 | L | 98.1 | Very high | 95.4 | Very high | 78 Ų | 78 | 98.2 Ų | 98.2 | 41% | 0.408 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -60.8 | -36.4 | 175.3 | -69.9 | 176.5 | 0 | 0 | 0 | 111.8 | H321 V322 E328 N329 | H321-L325 WeakPolarHBondContact O-CG 3.3Å; H321-L325 PolarHBondContact O-N 3.37Å; V322-L325 CarbonylContact O-C 3.58Å; V322-L325 PolarHBondContact O-N 2.99Å; L325-E328 PolarHBondContact O-N 2.85Å; L325-N329 WeakPolarHBondContact O-CB 3.22Å; L325-N329 PolarHBondContact O-N 2.84Å |
| 326 | E | 96.8 | Very high | 94.8 | Very high | 118 Ų | 118 | 96.4 Ų | 96.4 | 55% | 0.551 | 47% | 0.471 | S | S | * | . | H | α-helix | trans | -63.6 | -43.3 | 173.5 | -73.7 | 175.6 | 150.9 | 0 | 0 | 111.9 | V322 R324 S330 | V322-E326 HydrophobicContact CG1-CG 4.11Å; V322-E326 WeakPolarHBondContact O-CB 3.28Å; V322-E326 WeakPolarHBondContact O-CG 3.23Å; V322-E326 PolarHBondContact O-N 3.41Å; R324-E326 VanDerWaalsContact C-N 3.27Å; R324-E326 PolarHBondContact O-N 3.13Å; E326-S330 WeakPolarHBondContact O-CB 3.2Å; E326-S330 PolarHBondContact O-N 3.17Å |
| 327 | A | 95.9 | Very high | 94.1 | Very high | 52 Ų | 52 | 94.7 Ų | 94.7 | 43% | 0.43 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -64.2 | -47.4 | 175.2 | 0 | 0 | 0 | 0 | 0 | 111.7 | R323 R324 S330 I331 | R323-A327 PolarHBondContact O-N 3.3Å; R324-A327 WeakPolarHBondContact O-CB 3.34Å; R324-A327 PolarHBondContact O-N 3.25Å; R324-A327 VanDerWaalsContact O-N 3.15Å; A327-S330 PolarHBondContact O-N 3.2Å; A327-I331 WeakPolarHBondContact O-CG1 3.49Å; A327-I331 PolarHBondContact O-N 3.5Å |
| 328 | E | 95.8 | Very high | 93.2 | Very high | 94 Ų | 94 | 95.5 Ų | 95.5 | 44% | 0.439 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -59.4 | -48.3 | 175.4 | -70.6 | 169.2 | -158.5 | 0 | 0 | 111.5 | R324 L325 S330 I331 L332 | R324-E328 WeakPolarHBondContact CD-OE1 3.36Å; R324-E328 WeakPolarHBondContact CG-OE1 3.38Å; R324-E328 WeakPolarHBondContact O-CG 3.04Å; R324-E328 PolarHBondContact O-N 3.23Å; L325-E328 PolarHBondContact O-N 2.85Å; E328-S330 VanDerWaalsContact C-N 3.34Å; E328-S330 PolarHBondContact O-N 3.48Å; E328-I331 PolarHBondContact O-N 3.37Å; E328-L332 WeakPolarHBondContact O-CG 3.26Å; E328-L332 PolarHBondContact O-N 3.16Å |
| 329 | N | 93.9 | Very high | 92.3 | Very high | 76 Ų | 76 | 96 Ų | 96 | 41% | 0.406 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -63.6 | -37.6 | 177.7 | -167.9 | -79.6 | 0 | 0 | 0 | 111.9 | L325 L332 K333 | L325-N329 WeakPolarHBondContact O-CB 3.22Å; L325-N329 PolarHBondContact O-N 2.84Å; N329-L332 PolarHBondContact O-N 3.17Å; N329-K333 WeakPolarHBondContact O-CB 3.45Å; N329-K333 WeakPolarHBondContact O-CG 3.35Å; N329-K333 PolarHBondContact O-N 3.2Å; N329-K333 VanDerWaalsContact OD1-CD 3.29Å; N329-K333 WeakPolarHBondContact OD1-CD 3.41Å; N329-K333 WeakPolarHBondContact OD1-CE 3.39Å; N329-K333 PolarHBondContact OD1-NZ 2.88Å |
| 330 | S | 92.2 | Very high | 91.4 | Very high | 51 Ų | 51 | 94.6 Ų | 94.6 | 36% | 0.357 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -68.4 | -32.5 | 175.6 | -172.9 | 0 | 0 | 0 | 0 | 112.8 | E326 A327 E328 R334 | E326-S330 WeakPolarHBondContact O-CB 3.2Å; E326-S330 PolarHBondContact O-N 3.17Å; A327-S330 PolarHBondContact O-N 3.2Å; E328-S330 VanDerWaalsContact C-N 3.34Å; E328-S330 PolarHBondContact O-N 3.48Å; S330-R334 WeakPolarHBondContact O-CG 3.29Å; S330-R334 PolarHBondContact O-N 3.42Å; S330-R334 PolarHBondContact O-NE 3.12Å; S330-R334 PolarHBondContact OG-NH2 3.5Å |
| 331 | I | 92.6 | Very high | 90.5 | Very high | 95 Ų | 95 | 94 Ų | 94 | 49% | 0.487 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -70.4 | -51.6 | 170.5 | -67.8 | 163.1 | 0 | 0 | 0 | 109.6 | A327 E328 K333 R334 T335 | A327-I331 WeakPolarHBondContact O-CG1 3.49Å; A327-I331 PolarHBondContact O-N 3.5Å; E328-I331 PolarHBondContact O-N 3.37Å; I331-K333 VanDerWaalsContact C-N 3.33Å; I331-K333 PolarHBondContact O-N 2.95Å; I331-R334 CarbonylContact O-C 3.59Å; I331-R334 WeakPolarHBondContact O-CA 3.43Å; I331-R334 WeakPolarHBondContact O-CB 3.43Å; I331-R334 PolarHBondContact O-N 3.13Å; I331-T335 PolarHBondContact O-N 2.82Å; I331-T335 PolarHBondContact O-OG1 2.96Å |
| 332 | L | 91.8 | Very high | 89.6 | Confident | 97 Ų | 97 | 94.8 Ų | 94.8 | 51% | 0.508 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -55.9 | -44.3 | 179.5 | -70.8 | 168.7 | 0 | 0 | 0 | 112.3 | E328 N329 R334 T335 I336 | E328-L332 WeakPolarHBondContact O-CG 3.26Å; E328-L332 PolarHBondContact O-N 3.16Å; N329-L332 PolarHBondContact O-N 3.17Å; L332-R334 PolarHBondContact O-N 3Å; L332-T335 PolarHBondContact O-N 2.91Å; L332-I336 HydrophobicContact CB-CD1 4.19Å; L332-I336 WeakPolarHBondContact O-CB 3.39Å; L332-I336 WeakPolarHBondContact O-CD1 3.38Å; L332-I336 WeakPolarHBondContact O-CG1 3.38Å; L332-I336 PolarHBondContact O-N 3.04Å |
| 333 | K | 88.9 | Confident | 88.6 | Confident | 116 Ų | 116 | 97.1 Ų | 97.1 | 50% | 0.504 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -62.2 | -23.6 | 174.6 | -78.9 | 173.2 | 171 | 155.1 | 0 | 114.3 | N329 I331 L341 | N329-K333 WeakPolarHBondContact O-CB 3.45Å; N329-K333 WeakPolarHBondContact O-CG 3.35Å; N329-K333 PolarHBondContact O-N 3.2Å; N329-K333 VanDerWaalsContact OD1-CD 3.29Å; N329-K333 WeakPolarHBondContact OD1-CD 3.41Å; N329-K333 WeakPolarHBondContact OD1-CE 3.39Å; N329-K333 PolarHBondContact OD1-NZ 2.88Å; I331-K333 VanDerWaalsContact C-N 3.33Å; I331-K333 PolarHBondContact O-N 2.95Å; K333-L341 HydrophobicContact CB-CD1 4.34Å; K333-L341 HydrophobicContact CG-CD1 4.24Å |
| 334 | R | 86.8 | Confident | 87.7 | Confident | 185 Ų | 185 | 95.1 Ų | 95.1 | 70% | 0.698 | 48% | 0.482 | S | S | * | . | H | α-helix | trans | -89 | -27.2 | 174.7 | -77.4 | 178.5 | -89.1 | 172.5 | -10.7 | 112.9 | S330 I331 L332 | S330-R334 WeakPolarHBondContact O-CG 3.29Å; S330-R334 PolarHBondContact O-N 3.42Å; S330-R334 PolarHBondContact O-NE 3.12Å; S330-R334 PolarHBondContact OG-NH2 3.5Å; I331-R334 CarbonylContact O-C 3.59Å; I331-R334 WeakPolarHBondContact O-CA 3.43Å; I331-R334 WeakPolarHBondContact O-CB 3.43Å; I331-R334 PolarHBondContact O-N 3.13Å; L332-R334 PolarHBondContact O-N 3Å |
| 335 | T | 87.2 | Confident | 86.7 | Confident | 108 Ų | 108 | 93.6 Ų | 93.6 | 66% | 0.663 | 48% | 0.48 | S | S | * | . | H | α-helix | trans | -90.8 | -29.1 | -178.4 | -54.6 | 0 | 0 | 0 | 0 | 113.4 | I331 L332 | I331-T335 PolarHBondContact O-N 2.82Å; I331-T335 PolarHBondContact O-OG1 2.96Å; L332-T335 PolarHBondContact O-N 2.91Å |
| 336 | I | 86.8 | Confident | 85.8 | Confident | 56 Ų | 56 | 96.9 Ų | 96.9 | 29% | 0.287 | 50% | 0.498 | S | S | . | . | S | Bend | trans | -77.3 | 130.5 | -179.7 | -66.9 | 165.9 | 0 | 0 | 0 | 110.2 | L332 T340 L341 | L332-I336 HydrophobicContact CB-CD1 4.19Å; L332-I336 WeakPolarHBondContact O-CB 3.39Å; L332-I336 WeakPolarHBondContact O-CD1 3.38Å; L332-I336 WeakPolarHBondContact O-CG1 3.38Å; L332-I336 PolarHBondContact O-N 3.04Å; I336-T340 HydrophobicContact CG2-CG2 4.09Å; I336-L341 HydrophobicContact CG2-CB 4.13Å |
| 337 | P | 82.3 | Confident | 84.4 | Confident | 86 Ų | 86 | 99.2 Ų | 99.2 | 56% | 0.558 | 51% | 0.506 | S | S | * | . | trans | -56.9 | 138.4 | 174.8 | -26.6 | 35.3 | 0 | 0 | 0 | 112.8 | D339 T340 L341 | P337-D339 PolarHBondContact O-N 3Å; P337-D339 VanDerWaalsContact O-N 3.07Å; P337-T340 WeakPolarHBondContact O-CB 3.42Å; P337-T340 PolarHBondContact O-N 2.92Å; P337-L341 PolarHBondContact O-N 3.41Å | ||
| 338 | N | 80.4 | Confident | 82.5 | Confident | 117 Ų | 117 | 106.6 Ų | 106.6 | 63% | 0.626 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -52.2 | -36.3 | -174.5 | -81.2 | -73.5 | 0 | 0 | 0 | 114 | L341 K342 | N338-L341 PolarHBondContact O-N 3.4Å; N338-K342 VanDerWaalsContact O-CG 3.25Å; N338-K342 WeakPolarHBondContact O-CG 3.29Å; N338-K342 PolarHBondContact O-N 3.49Å |
| 339 | D | 78.9 | Confident | 81.8 | Confident | 99 Ų | 99 | 107.2 Ų | 107.2 | 53% | 0.529 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -75.7 | -33.1 | -178.4 | -58.1 | -48.8 | 0 | 0 | 0 | 112.9 | P337 L341 K342 Q343 | P337-D339 PolarHBondContact O-N 3Å; P337-D339 VanDerWaalsContact O-N 3.07Å; D339-L341 VanDerWaalsContact C-N 3.35Å; D339-K342 IonicContact OD1-NZ 2.68Å; D339-K342 PolarHBondContact OD1-NZ 3.28Å; D339-Q343 WeakPolarHBondContact O-CG 3.48Å; D339-Q343 PolarHBondContact O-N 3Å; D339-Q343 VanDerWaalsContact O-N 3.09Å |
| 340 | T | 80.5 | Confident | 81.2 | Confident | 69 Ų | 69 | 108.8 Ų | 108.8 | 42% | 0.423 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -65.4 | -41.3 | 168.3 | -49.6 | 0 | 0 | 0 | 0 | 110.6 | I336 P337 Q343 L344 | I336-T340 HydrophobicContact CG2-CG2 4.09Å; P337-T340 WeakPolarHBondContact O-CB 3.42Å; P337-T340 PolarHBondContact O-N 2.92Å; T340-Q343 PolarHBondContact O-N 2.86Å; T340-L344 WeakPolarHBondContact O-CG 3.41Å; T340-L344 PolarHBondContact O-N 2.94Å |
| 341 | L | 79.2 | Confident | 80.6 | Confident | 29 Ų | 29 | 112.1 Ų | 112.1 | 15% | 0.152 | 56% | 0.56 | C | S | . | * | H | α-helix | trans | -63.6 | -43.1 | 178.5 | -166 | 154.4 | 0 | 0 | 0 | 111.5 | K333 I336 P337 N338 D339 Q343 L344 H345 | K333-L341 HydrophobicContact CB-CD1 4.34Å; K333-L341 HydrophobicContact CG-CD1 4.24Å; I336-L341 HydrophobicContact CG2-CB 4.13Å; P337-L341 PolarHBondContact O-N 3.41Å; N338-L341 PolarHBondContact O-N 3.4Å; D339-L341 VanDerWaalsContact C-N 3.35Å; L341-Q343 PolarHBondContact O-N 3.17Å; L341-L344 PolarHBondContact O-N 3.31Å; L341-H345 VanDerWaalsContact CD2-CE1 3.46Å; L341-H345 WeakPolarHBondContact CD2-CE1 3.3Å; L341-H345 PolarHBondContact O-N 2.93Å |
| 342 | K | 79.7 | Confident | 79.9 | Confident | 112 Ų | 112 | 113.1 Ų | 113.1 | 49% | 0.487 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -58.1 | -44.8 | 170.7 | -68.6 | 164.9 | -158 | 166.4 | 0 | 112.1 | N338 D339 L344 H345 L346 | N338-K342 VanDerWaalsContact O-CG 3.25Å; N338-K342 WeakPolarHBondContact O-CG 3.29Å; N338-K342 PolarHBondContact O-N 3.49Å; D339-K342 IonicContact OD1-NZ 2.68Å; D339-K342 PolarHBondContact OD1-NZ 3.28Å; K342-L344 PolarHBondContact O-N 3.46Å; K342-H345 PolarHBondContact O-N 3.41Å; K342-L346 WeakPolarHBondContact O-CG 3.24Å; K342-L346 PolarHBondContact O-N 2.97Å |
| 343 | Q | 78.1 | Confident | 79.2 | Confident | 119 Ų | 119 | 114.1 Ų | 114.1 | 56% | 0.556 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -65.4 | -24.7 | 178.5 | -73.8 | -179.4 | 23.9 | 0 | 0 | 113.8 | D339 T340 L341 K347 | D339-Q343 WeakPolarHBondContact O-CG 3.48Å; D339-Q343 PolarHBondContact O-N 3Å; D339-Q343 VanDerWaalsContact O-N 3.09Å; T340-Q343 PolarHBondContact O-N 2.86Å; L341-Q343 PolarHBondContact O-N 3.17Å; Q343-K347 WeakPolarHBondContact O-CD 3.45Å; Q343-K347 WeakPolarHBondContact O-CG 3.41Å |
| 344 | L | 78.1 | Confident | 78.5 | Confident | 90 Ų | 90 | 113.9 Ų | 113.9 | 47% | 0.471 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -80 | -41.7 | 172.3 | -67.5 | 170.1 | 0 | 0 | 0 | 111.5 | T340 L341 K342 L346 K347 | T340-L344 WeakPolarHBondContact O-CG 3.41Å; T340-L344 PolarHBondContact O-N 2.94Å; L341-L344 PolarHBondContact O-N 3.31Å; K342-L344 PolarHBondContact O-N 3.46Å; L344-L346 PolarHBondContact O-N 3.2Å; L344-K347 PolarHBondContact O-N 2.96Å; L344-K347 VanDerWaalsContact O-N 3.08Å |
| 345 | H | 77.6 | Confident | 77.9 | Confident | 118 Ų | 118 | 108.9 Ų | 108.9 | 55% | 0.546 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -64.6 | -18.2 | 174.1 | -74.7 | -162.7 | 0 | 0 | 0 | 113.7 | L341 K342 K347 | L341-H345 VanDerWaalsContact CD2-CE1 3.46Å; L341-H345 WeakPolarHBondContact CD2-CE1 3.3Å; L341-H345 PolarHBondContact O-N 2.93Å; K342-H345 PolarHBondContact O-N 3.41Å; H345-K347 VanDerWaalsContact C-N 3.35Å |
| 346 | L | 77.8 | Confident | 77.2 | Confident | 148 Ų | 148 | 108.9 Ų | 108.9 | 78% | 0.775 | 56% | 0.555 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89.8 | 7.1 | 173.9 | -72.9 | 165.5 | 0 | 0 | 0 | 113.7 | K342 L344 | K342-L346 WeakPolarHBondContact O-CG 3.24Å; K342-L346 PolarHBondContact O-N 2.97Å; L344-L346 PolarHBondContact O-N 3.2Å |
| 347 | K | 68.3 | Low | 76.4 | Confident | 166 Ų | 166 | 113.3 Ų | 113.3 | 72% | 0.722 | 58% | 0.577 | S | S | * | * | trans | -131.3 | 7.8 | -175.9 | -70.5 | -179.2 | 179.3 | 176.6 | 0 | 114 | Q343 L344 H345 | Q343-K347 WeakPolarHBondContact O-CD 3.45Å; Q343-K347 WeakPolarHBondContact O-CG 3.41Å; L344-K347 PolarHBondContact O-N 2.96Å; L344-K347 VanDerWaalsContact O-N 3.08Å; H345-K347 VanDerWaalsContact C-N 3.35Å | ||
| 348 | L | 55.9 | Low | 75.9 | Confident | 207 Ų | 207 | 115.8 Ų | 115.8 | 100% | 1.084 | 58% | 0.579 | S | S | * | * | trans | -120 | 0 | 176.1 | -88.4 | 157.7 | 0 | 0 | 0 | 108.8 |
Retrieved 348 of 348 residues in 273.3 ms
(Link to these results)