| 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 | 30.5 | Very low | 43.4 | Very low | 230 Ų | 230 | 134.7 Ų | 134.7 | 100% | 1.133 | 79% | 0.785 | S | S | * | * | 0 | 144.8 | 0 | -83.2 | -88.7 | 85.4 | 0 | 0 | 107.9 | |||||
| 2 | P | 47.8 | Very low | 43.1 | Very low | 121 Ų | 121 | 134.9 Ų | 134.9 | 79% | 0.786 | 77% | 0.773 | S | S | * | * | -112.4 | 176.1 | -105.3 | 39.4 | -34.4 | 0 | 0 | 0 | 114.2 | |||||
| 3 | G | 41.7 | Very low | 42.7 | Very low | 59 Ų | 59 | 132.7 Ų | 132.7 | 61% | 0.608 | 76% | 0.757 | S | S | * | * | trans | 156.5 | 90.4 | 155.1 | 0 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 4 | I | 48.9 | Very low | 42.5 | Very low | 162 Ų | 162 | 139.6 Ų | 139.6 | 83% | 0.831 | 77% | 0.765 | S | S | * | * | 74.6 | 110 | 105.5 | 64.1 | 160.3 | 0 | 0 | 0 | 114 | |||||
| 5 | S | 43 | Very low | 42.6 | Very low | 120 Ų | 120 | 140.7 Ų | 140.7 | 84% | 0.839 | 76% | 0.763 | S | S | * | * | 64.6 | 144.2 | 93.8 | -69.7 | 0 | 0 | 0 | 0 | 112.6 | |||||
| 6 | S | 45.1 | Very low | 42.3 | Very low | 113 Ų | 113 | 142.3 Ų | 142.3 | 79% | 0.79 | 77% | 0.766 | S | S | * | * | cis | 178.1 | 173.9 | 0.3 | -179.2 | 0 | 0 | 0 | 0 | 104.5 | ||||
| 7 | A | 40.6 | Very low | 42.4 | Very low | 90 Ų | 90 | 140.9 Ų | 140.9 | 74% | 0.744 | 76% | 0.759 | S | S | * | * | trans | 86.8 | 111.2 | 153.4 | 0 | 0 | 0 | 0 | 0 | 119.4 | ||||
| 8 | A | 39.3 | Very low | 42.7 | Very low | 89 Ų | 89 | 142.9 Ų | 142.9 | 74% | 0.736 | 76% | 0.762 | S | S | * | * | trans | -62.1 | -165.5 | 145.3 | 0 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 9 | P | 60.1 | Low | 43 | Very low | 97 Ų | 97 | 145.7 Ų | 145.7 | 63% | 0.63 | 76% | 0.762 | S | S | * | * | cis | -144.5 | -163.2 | -2.8 | 25.8 | 2.4 | 0 | 0 | 0 | 114 | ||||
| 10 | R | 43.3 | Very low | 43.2 | Very low | 222 Ų | 222 | 145.4 Ų | 145.4 | 84% | 0.838 | 76% | 0.757 | S | S | * | * | trans | 82.4 | 143 | 150 | -69.7 | -157.9 | -159.7 | 113.3 | -0.6 | 117.5 | ||||
| 11 | Y | 36.6 | Very low | 43.2 | Very low | 179 Ų | 179 | 147.1 Ų | 147.1 | 70% | 0.702 | 76% | 0.761 | S | S | * | * | cis | -178.2 | 147 | -2.5 | -165.2 | -121.5 | 0 | 0 | 0 | 107.4 | ||||
| 12 | E | 40.7 | Very low | 43.9 | Very low | 137 Ų | 137 | 145 Ų | 145 | 64% | 0.64 | 74% | 0.742 | S | S | * | * | trans | 53.5 | 146.2 | 152.2 | -79 | 176.6 | -176.4 | 0 | 0 | 126.7 | ||||
| 13 | N | 37.7 | Very low | 43.5 | Very low | 106 Ų | 106 | 148.7 Ų | 148.7 | 57% | 0.567 | 75% | 0.745 | S | S | * | * | trans | 79.9 | 128.6 | 151.8 | -117.3 | -0.7 | 0 | 0 | 0 | 116.9 | ||||
| 14 | W | 39.5 | Very low | 43.9 | Very low | 229 Ų | 229 | 154.8 Ų | 154.8 | 87% | 0.867 | 75% | 0.751 | S | S | * | * | -152 | 139.6 | 58.6 | -69.6 | 88.6 | 0 | 0 | 0 | 114.2 | |||||
| 15 | E | 44.4 | Very low | 43.7 | Very low | 156 Ų | 156 | 153 Ų | 153 | 73% | 0.729 | 74% | 0.743 | S | S | * | * | trans | -48.9 | 142.8 | 154.4 | -84.4 | 166.5 | 149.5 | 0 | 0 | 112.6 | ||||
| 16 | M | 37.4 | Very low | 44.2 | Very low | 167 Ų | 167 | 154.3 Ų | 154.3 | 82% | 0.823 | 74% | 0.741 | S | S | * | * | trans | -150.7 | 108.5 | 147.6 | -158.9 | 76.3 | -158 | 0 | 0 | 110.7 | ||||
| 17 | D | 43.5 | Very low | 44.4 | Very low | 119 Ų | 119 | 156.3 Ų | 156.3 | 64% | 0.636 | 74% | 0.738 | S | S | * | * | trans | -54.4 | 137 | 175.1 | -64.5 | -60.4 | 0 | 0 | 0 | 114.5 | ||||
| 18 | H | 48.1 | Very low | 45.1 | Very low | 176 Ų | 176 | 156.2 Ų | 156.2 | 82% | 0.815 | 73% | 0.725 | S | S | * | * | trans | -144.1 | 92.2 | 142.7 | -72.2 | 85.8 | 0 | 0 | 0 | 110.4 | ||||
| 19 | Y | 48.3 | Very low | 45.9 | Very low | 197 Ų | 197 | 156.9 Ų | 156.9 | 77% | 0.773 | 72% | 0.722 | S | S | * | * | trans | -14.5 | 137.5 | 136.1 | -104 | -116.9 | 0 | 0 | 0 | 113 | ||||
| 20 | Q | 46.9 | Very low | 45.4 | Very low | 139 Ų | 139 | 158.3 Ų | 158.3 | 65% | 0.65 | 72% | 0.724 | S | S | * | * | cis | 174 | 135.8 | 34.6 | -166.3 | 161.8 | 19.9 | 0 | 0 | 108.1 | ||||
| 21 | H | 44.7 | Very low | 45.9 | Very low | 182 Ų | 182 | 153.8 Ų | 153.8 | 84% | 0.843 | 71% | 0.712 | S | S | * | * | 178.3 | 126.2 | 127.2 | -116.4 | -86.7 | 0 | 0 | 0 | 112.6 | |||||
| 22 | Y | 45.1 | Very low | 46.5 | Very low | 186 Ų | 186 | 151.4 Ų | 151.4 | 73% | 0.729 | 71% | 0.712 | S | S | * | * | trans | -62 | 129.4 | 175.6 | -84.6 | -111.6 | 0 | 0 | 0 | 112.7 | Y24 | Y22-Y24 HydrophobicContact CD1-CD2 4.43Š| ||
| 23 | F | 39.2 | Very low | 46.9 | Very low | 197 Ų | 197 | 152.7 Ų | 152.7 | 86% | 0.864 | 72% | 0.716 | S | S | * | * | -139.9 | 114.2 | 127.1 | -113.8 | -89.1 | 0 | 0 | 0 | 107.2 | D25 | F23-D25 PolarHBondContact O-N 3.31Š| |||
| 24 | Y | 49 | Very low | 47.5 | Very low | 187 Ų | 187 | 155.3 Ų | 155.3 | 73% | 0.733 | 72% | 0.722 | S | S | * | * | trans | -70.9 | 114.4 | 153.6 | -98.7 | -98.1 | 0 | 0 | 0 | 105.3 | Y22 | Y22-Y24 HydrophobicContact CD1-CD2 4.43Š| ||
| 25 | D | 44.4 | Very low | 48.1 | Very low | 124 Ų | 124 | 151 Ų | 151 | 66% | 0.663 | 71% | 0.713 | S | S | * | * | trans | -133.2 | 104.9 | 140.2 | -110.7 | -22.1 | 0 | 0 | 0 | 105.8 | F23 H27 | F23-D25 PolarHBondContact O-N 3.31Å; D25-H27 PolarHBondContact O-N 2.98Å | ||
| 26 | D | 54.9 | Low | 48.4 | Very low | 148 Ų | 148 | 148.7 Ų | 148.7 | 79% | 0.791 | 72% | 0.715 | S | S | * | * | trans | -71.5 | 76.4 | 176.4 | -146 | 1.3 | 0 | 0 | 0 | 106.6 | D28 | D26-D28 PolarHBondContact O-N 3.34Š| ||
| 27 | H | 49.2 | Very low | 49 | Very low | 155 Ų | 155 | 146.1 Ų | 146.1 | 72% | 0.718 | 71% | 0.708 | S | S | * | * | trans | -90.9 | 94.2 | 169.6 | -85.6 | -62.8 | 0 | 0 | 0 | 108.4 | D25 P29 | D25-H27 PolarHBondContact O-N 2.98Å; H27-P29 WeakPolarHBondContact O-CD 3.36Å | ||
| 28 | D | 55 | Low | 49.5 | Very low | 89 Ų | 89 | 143.9 Ų | 143.9 | 48% | 0.476 | 71% | 0.706 | S | S | . | * | trans | -49 | 115.5 | 164.3 | -166.5 | -9 | 0 | 0 | 0 | 110 | D26 D30 | D26-D28 PolarHBondContact O-N 3.34Å; D28-D30 PolarHBondContact O-N 3.27Å; D28-D30 WeakPolarHBondContact OD1-CB 3.46Å; D28-D30 PolarHBondContact OD1-N 3.36Å | ||
| 29 | P | 54.9 | Low | 49.4 | Very low | 103 Ų | 103 | 140.4 Ų | 140.4 | 67% | 0.669 | 70% | 0.7 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72.3 | -3.8 | 179.4 | 29.8 | -34.1 | 0 | 0 | 0 | 113.1 | H27 | H27-P29 WeakPolarHBondContact O-CD 3.36Š|
| 30 | D | 50.4 | Low | 49.8 | Very low | 127 Ų | 127 | 134.6 Ų | 134.6 | 68% | 0.679 | 69% | 0.688 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87.7 | -10.8 | -175.1 | -70.4 | -21.1 | 0 | 0 | 0 | 114.1 | D28 | D28-D30 PolarHBondContact O-N 3.27Å; D28-D30 WeakPolarHBondContact OD1-CB 3.46Å; D28-D30 PolarHBondContact OD1-N 3.36Å |
| 31 | E | 53.3 | Low | 50.3 | Low | 126 Ų | 126 | 135.6 Ų | 135.6 | 59% | 0.589 | 69% | 0.692 | S | S | * | * | S | Bend | trans | -89.3 | -26.2 | 179.6 | -68.8 | -69.7 | 157.5 | 0 | 0 | 113.7 | ||
| 32 | D | 50.2 | Low | 50.9 | Low | 129 Ų | 129 | 131.8 Ų | 131.8 | 69% | 0.69 | 68% | 0.678 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80.1 | -21 | -177.4 | -78.6 | -17.5 | 0 | 0 | 0 | 113.5 | ||
| 33 | F | 49.5 | Very low | 51.8 | Low | 165 Ų | 165 | 126.9 Ų | 126.9 | 72% | 0.724 | 66% | 0.664 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74.8 | -27.7 | 176.7 | -164.1 | -99.4 | 0 | 0 | 0 | 112.2 | T37 | F33-T37 PolarHBondContact O-OG1 3.16Š|
| 34 | F | 49.4 | Very low | 52.7 | Low | 160 Ų | 160 | 126.4 Ų | 126.4 | 70% | 0.702 | 66% | 0.656 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86 | -14.3 | -176.4 | -153.7 | -101.8 | 0 | 0 | 0 | 114 | ||
| 35 | M | 53.2 | Low | 53.2 | Low | 138 Ų | 138 | 124 Ų | 124 | 68% | 0.68 | 65% | 0.649 | S | S | * | * | S | Bend | trans | -94.9 | -6.6 | -178.8 | -72.5 | -63.6 | 121 | 0 | 0 | 115.3 | ||
| 36 | S | 50.4 | Low | 53.9 | Low | 109 Ų | 109 | 126.4 Ų | 126.4 | 76% | 0.762 | 65% | 0.654 | S | S | * | * | S | Bend | trans | -109.7 | 0.5 | -175.2 | -64.9 | 0 | 0 | 0 | 0 | 115.6 | ||
| 37 | T | 48.6 | Very low | 53.9 | Low | 112 Ų | 112 | 126.6 Ų | 126.6 | 69% | 0.687 | 65% | 0.648 | S | S | * | * | S | Bend | trans | -118.7 | -5.2 | -176.2 | -3.3 | 0 | 0 | 0 | 0 | 116 | F33 | F33-T37 PolarHBondContact O-OG1 3.16Š|
| 38 | A | 54.4 | Low | 54.5 | Low | 72 Ų | 72 | 126.8 Ų | 126.8 | 60% | 0.595 | 65% | 0.649 | S | S | * | * | S | Bend | trans | -91.2 | 127.7 | 167.8 | 0 | 0 | 0 | 0 | 0 | 108.8 | S40 | A38-S40 PolarHBondContact O-N 3.41Š|
| 39 | P | 45.8 | Very low | 54.5 | Low | 104 Ų | 104 | 129.8 Ų | 129.8 | 68% | 0.675 | 67% | 0.665 | S | S | * | * | trans | -57.1 | 111.3 | 173 | -13.5 | 24.9 | 0 | 0 | 0 | 108.1 | I43 | P39-I43 HydrophobicContact CB-CD1 3.27Š| ||
| 40 | S | 57.2 | Low | 54.8 | Low | 75 Ų | 75 | 129.9 Ų | 129.9 | 52% | 0.524 | 66% | 0.663 | S | S | . | * | trans | -60.3 | 149.5 | -176.9 | 57.5 | 0 | 0 | 0 | 0 | 110.6 | A38 D42 I43 | A38-S40 PolarHBondContact O-N 3.41Å; S40-D42 PolarHBondContact O-N 3.03Å; S40-I43 PolarHBondContact O-N 2.89Å; S40-I43 VanDerWaalsContact O-N 3.09Å | ||
| 41 | E | 56.8 | Low | 55 | Low | 160 Ų | 160 | 129 Ų | 129 | 75% | 0.748 | 67% | 0.665 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -45.7 | -19.2 | 179.8 | -160.3 | 72.5 | -174.3 | 0 | 0 | 114.1 | I43 W44 K45 | E41-I43 PolarHBondContact O-N 3.47Å; E41-W44 PolarHBondContact O-N 3.31Å; E41-K45 PolarHBondContact O-N 3.32Å |
| 42 | D | 57.2 | Low | 55.1 | Low | 101 Ų | 101 | 129.1 Ų | 129.1 | 54% | 0.54 | 67% | 0.674 | S | S | . | * | H | α-helix | trans | -62 | -23.2 | 176.6 | -96.1 | -11.4 | 0 | 0 | 0 | 114.9 | S40 W44 K45 K46 | S40-D42 PolarHBondContact O-N 3.03Å; D42-W44 VanDerWaalsContact C-N 3.3Å; D42-W44 PolarHBondContact O-N 3.01Å; D42-K45 PolarHBondContact O-N 3.38Å; D42-K46 PolarHBondContact O-N 3.3Å |
| 43 | I | 64.1 | Low | 55.2 | Low | 83 Ų | 83 | 127.8 Ų | 127.8 | 43% | 0.426 | 67% | 0.672 | S | S | . | * | H | α-helix | trans | -67.1 | -37.1 | 179.1 | -65 | 163.2 | 0 | 0 | 0 | 110.5 | P39 S40 E41 F47 | P39-I43 HydrophobicContact CB-CD1 3.27Å; S40-I43 PolarHBondContact O-N 2.89Å; S40-I43 VanDerWaalsContact O-N 3.09Å; E41-I43 PolarHBondContact O-N 3.47Å; I43-F47 HydrophobicContact CG2-CE2 4.46Å; I43-F47 WeakPolarHBondContact O-CD2 3.41Å; I43-F47 WeakPolarHBondContact O-CE2 3.28Å |
| 44 | W | 58.2 | Low | 55.5 | Low | 188 Ų | 188 | 125.8 Ų | 125.8 | 71% | 0.712 | 68% | 0.676 | S | S | * | * | H | α-helix | trans | -79 | -31 | 178.7 | -60.9 | 94.1 | 0 | 0 | 0 | 111.9 | E41 D42 K46 F47 E48 | E41-W44 PolarHBondContact O-N 3.31Å; D42-W44 VanDerWaalsContact C-N 3.3Å; D42-W44 PolarHBondContact O-N 3.01Å; W44-K46 VanDerWaalsContact C-N 3.26Å; W44-K46 PolarHBondContact O-N 3.06Å; W44-F47 PolarHBondContact O-N 3.41Å; W44-E48 PolarHBondContact O-N 3.29Å |
| 45 | K | 60.5 | Low | 55.4 | Low | 135 Ų | 135 | 126.9 Ų | 126.9 | 59% | 0.587 | 69% | 0.685 | S | S | * | * | H | α-helix | trans | -65.4 | -26 | 174.6 | -157.1 | 171.6 | -174.8 | 175.8 | 0 | 113.4 | E41 D42 F47 | E41-K45 PolarHBondContact O-N 3.32Å; D42-K45 PolarHBondContact O-N 3.38Å; K45-F47 VanDerWaalsContact C-N 3.26Å; K45-F47 PolarHBondContact O-N 3.48Å |
| 46 | K | 58.1 | Low | 55.3 | Low | 176 Ų | 176 | 125.3 Ų | 125.3 | 77% | 0.765 | 69% | 0.688 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -69.9 | -17.7 | 171.5 | -77.4 | -166.5 | 80.1 | -151.4 | 0 | 114.1 | D42 W44 | D42-K46 PolarHBondContact O-N 3.3Å; W44-K46 VanDerWaalsContact C-N 3.26Å; W44-K46 PolarHBondContact O-N 3.06Å |
| 47 | F | 56.6 | Low | 55.1 | Low | 151 Ų | 151 | 126 Ų | 126 | 66% | 0.662 | 69% | 0.69 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -96.9 | -15.6 | 177.9 | -66.9 | -81.9 | 0 | 0 | 0 | 113.6 | I43 W44 K45 L49 | I43-F47 HydrophobicContact CG2-CE2 4.46Å; I43-F47 WeakPolarHBondContact O-CD2 3.41Å; I43-F47 WeakPolarHBondContact O-CE2 3.28Å; W44-F47 PolarHBondContact O-N 3.41Å; K45-F47 VanDerWaalsContact C-N 3.26Å; K45-F47 PolarHBondContact O-N 3.48Å; F47-L49 VanDerWaalsContact C-N 3.28Å; F47-L49 PolarHBondContact O-N 3.19Å |
| 48 | E | 60.3 | Low | 54.8 | Low | 159 Ų | 159 | 128 Ų | 128 | 74% | 0.743 | 69% | 0.694 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74.5 | -13.6 | 176.3 | -80.1 | -174.9 | 147.1 | 0 | 0 | 114.2 | W44 | W44-E48 PolarHBondContact O-N 3.29Š|
| 49 | L | 56.4 | Low | 54.3 | Low | 153 Ų | 153 | 136.5 Ų | 136.5 | 80% | 0.801 | 71% | 0.71 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -107.6 | 24.5 | -176.9 | -119.1 | 82.6 | 0 | 0 | 0 | 114.7 | F47 P51 | F47-L49 VanDerWaalsContact C-N 3.28Å; F47-L49 PolarHBondContact O-N 3.19Å; L49-P51 VanDerWaalsContact O-CD 3.24Å; L49-P51 WeakPolarHBondContact O-CD 3.42Å |
| 50 | V | 60.9 | Low | 54.4 | Low | 104 Ų | 104 | 137.8 Ų | 137.8 | 63% | 0.63 | 71% | 0.711 | S | S | * | * | S | Bend | trans | -86.4 | 108.1 | 163 | -167.9 | 0 | 0 | 0 | 0 | 106.7 | T52 | V50-T52 PolarHBondContact O-N 3.44Š|
| 51 | P | 54.9 | Low | 53.7 | Low | 110 Ų | 110 | 140.4 Ų | 140.4 | 71% | 0.714 | 73% | 0.726 | S | S | * | * | trans | -55 | 132.2 | 172.1 | 23 | -30.6 | 0 | 0 | 0 | 107.5 | L49 | L49-P51 VanDerWaalsContact O-CD 3.24Å; L49-P51 WeakPolarHBondContact O-CD 3.42Å | ||
| 52 | T | 54.7 | Low | 53.2 | Low | 128 Ų | 128 | 137.1 Ų | 137.1 | 79% | 0.785 | 73% | 0.726 | S | S | * | * | trans | -42.2 | 120.6 | 176.1 | -45.5 | 0 | 0 | 0 | 0 | 108.3 | V50 | V50-T52 PolarHBondContact O-N 3.44Š| ||
| 53 | P | 51.8 | Low | 52.5 | Low | 100 Ų | 100 | 142 Ų | 142 | 65% | 0.649 | 75% | 0.746 | S | S | * | * | P | Polyproline II helix | trans | -53.8 | 130.7 | 178.4 | 16.7 | -27.3 | 0 | 0 | 0 | 108 | M55 | P53-M55 PolarHBondContact O-N 3.03Š|
| 54 | P | 56.6 | Low | 51 | Low | 124 Ų | 124 | 141.8 Ų | 141.8 | 81% | 0.805 | 76% | 0.764 | S | S | * | * | P | Polyproline II helix | trans | -55.4 | 136.2 | -174.2 | 22.1 | -32.7 | 0 | 0 | 0 | 109.4 | S56 | P54-S56 PolarHBondContact O-N 3.46Š|
| 55 | M | 47.7 | Very low | 50.3 | Low | 182 Ų | 182 | 139 Ų | 139 | 90% | 0.897 | 77% | 0.774 | S | S | * | * | P | Polyproline II helix | trans | -52.3 | 138.8 | 175.8 | -67 | -157.5 | 73.9 | 0 | 0 | 109.8 | P53 | P53-M55 PolarHBondContact O-N 3.03Š|
| 56 | S | 49.3 | Very low | 49.1 | Very low | 106 Ų | 106 | 136.1 Ų | 136.1 | 74% | 0.741 | 78% | 0.782 | S | S | * | * | P | Polyproline II helix | trans | -52.8 | 143.1 | 177.7 | -53.9 | 0 | 0 | 0 | 0 | 111 | P54 M58 | P54-S56 PolarHBondContact O-N 3.46Å; S56-M58 PolarHBondContact O-N 3.01Å; S56-M58 VanDerWaalsContact O-N 3.16Å |
| 57 | P | 46.4 | Very low | 48.5 | Very low | 124 Ų | 124 | 136.9 Ų | 136.9 | 81% | 0.805 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -56.1 | 122.2 | -178.3 | -21.9 | 30.9 | 0 | 0 | 0 | 111.1 | R59 | P57-R59 PolarHBondContact O-N 3.3Š|
| 58 | M | 42.6 | Very low | 47.6 | Very low | 154 Ų | 154 | 136.2 Ų | 136.2 | 76% | 0.759 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -62 | 123.1 | 164.9 | -78.6 | 176.3 | 41.3 | 0 | 0 | 108.3 | S56 L60 | S56-M58 PolarHBondContact O-N 3.01Å; S56-M58 VanDerWaalsContact O-N 3.16Å; M58-L60 HydrophobicContact CE-CD1 4.01Å; M58-L60 HydrophobicContact CE-CG 4.36Å; M58-L60 PolarHBondContact O-N 2.99Å |
| 59 | R | 43.7 | Very low | 46.5 | Very low | 249 Ų | 249 | 131.7 Ų | 131.7 | 94% | 0.94 | 79% | 0.792 | S | S | * | * | trans | -70.3 | 81.2 | 168 | -62.6 | -169 | -161.5 | 152.9 | 3.3 | 109 | P57 | P57-R59 PolarHBondContact O-N 3.3Š| ||
| 60 | L | 48.7 | Very low | 46.1 | Very low | 132 Ų | 132 | 133.2 Ų | 133.2 | 69% | 0.691 | 80% | 0.8 | S | S | * | * | trans | -85.7 | 122.8 | 156.4 | -86.6 | 157.8 | 0 | 0 | 0 | 107 | M58 A62 | M58-L60 HydrophobicContact CE-CD1 4.01Å; M58-L60 HydrophobicContact CE-CG 4.36Å; M58-L60 PolarHBondContact O-N 2.99Å; L60-A62 PolarHBondContact O-N 2.92Å | ||
| 61 | P | 42.1 | Very low | 45.4 | Very low | 129 Ų | 129 | 136 Ų | 136 | 84% | 0.838 | 81% | 0.81 | S | S | * | * | trans | -71.3 | 113.5 | 169.9 | 25.1 | -23 | 0 | 0 | 0 | 108 | ||||
| 62 | A | 46 | Very low | 45.2 | Very low | 92 Ų | 92 | 135.8 Ų | 135.8 | 76% | 0.76 | 81% | 0.811 | S | S | * | * | trans | -105.7 | 111.2 | 167.8 | 0 | 0 | 0 | 0 | 0 | 108.5 | L60 | L60-A62 PolarHBondContact O-N 2.92Š| ||
| 63 | E | 41.9 | Very low | 45 | Very low | 203 Ų | 203 | 133.1 Ų | 133.1 | 95% | 0.949 | 80% | 0.795 | S | S | * | * | -175.1 | 137 | 126.2 | -110.9 | -175.6 | 143 | 0 | 0 | 110.7 | |||||
| 64 | G | 34.5 | Very low | 45.5 | Very low | 79 Ų | 79 | 131.9 Ų | 131.9 | 81% | 0.814 | 79% | 0.789 | S | S | * | * | trans | 129.2 | 87.5 | 164.3 | 0 | 0 | 0 | 0 | 0 | 115 | ||||
| 65 | S | 42.6 | Very low | 45.6 | Very low | 130 Ų | 130 | 132.2 Ų | 132.2 | 91% | 0.909 | 78% | 0.783 | S | S | * | * | trans | -45.7 | 134.1 | 170.6 | 54.4 | 0 | 0 | 0 | 0 | 115.2 | ||||
| 66 | G | 36.4 | Very low | 46.5 | Very low | 74 Ų | 74 | 125.5 Ų | 125.5 | 76% | 0.763 | 76% | 0.761 | S | S | * | * | trans | 153.9 | 100.7 | 163.6 | 0 | 0 | 0 | 0 | 0 | 113.4 | V68 | G66-V68 PolarHBondContact O-N 3.26Š| ||
| 67 | Q | 44.8 | Very low | 47.4 | Very low | 192 Ų | 192 | 123.6 Ų | 123.6 | 90% | 0.897 | 74% | 0.742 | S | S | * | * | trans | -36.5 | 128.1 | 165.1 | -173.2 | 178.2 | 9.2 | 0 | 0 | 113.2 | ||||
| 68 | V | 37.9 | Very low | 48.3 | Very low | 137 Ų | 137 | 122.9 Ų | 122.9 | 83% | 0.83 | 73% | 0.726 | S | S | * | * | trans | 155.5 | 123.2 | 138.5 | 165.2 | 0 | 0 | 0 | 0 | 110.7 | G66 | G66-V68 PolarHBondContact O-N 3.26Š| ||
| 69 | G | 37.3 | Very low | 49.3 | Very low | 63 Ų | 63 | 120.7 Ų | 120.7 | 65% | 0.649 | 72% | 0.718 | S | S | * | * | trans | 89.5 | 109.1 | 139.3 | 0 | 0 | 0 | 0 | 0 | 118.6 | L71 | G69-L71 PolarHBondContact O-N 3.32Å; G69-L71 VanDerWaalsContact O-N 3.09Å | ||
| 70 | L | 47.9 | Very low | 50.1 | Low | 185 Ų | 185 | 115 Ų | 115 | 97% | 0.969 | 70% | 0.701 | S | S | * | * | trans | -49.7 | 107.9 | 156 | -73.2 | 155.5 | 0 | 0 | 0 | 110.8 | ||||
| 71 | L | 46.3 | Very low | 50.5 | Low | 162 Ų | 162 | 117.4 Ų | 117.4 | 85% | 0.848 | 70% | 0.701 | S | S | * | * | trans | -126.9 | 116.6 | 157.5 | -75.4 | 169.7 | 0 | 0 | 0 | 108 | G69 | G69-L71 PolarHBondContact O-N 3.32Å; G69-L71 VanDerWaalsContact O-N 3.09Å | ||
| 72 | C | 49.3 | Very low | 51.4 | Low | 107 Ų | 107 | 115 Ų | 115 | 72% | 0.723 | 69% | 0.685 | S | S | * | * | P | Polyproline II helix | trans | -55.5 | 130.3 | 172 | -164.2 | 0 | 0 | 0 | 0 | 108.5 | S74 | C72-S74 PolarHBondContact O-N 3.5Š|
| 73 | P | 50.4 | Low | 52.3 | Low | 71 Ų | 71 | 114.8 Ų | 114.8 | 46% | 0.461 | 68% | 0.677 | S | S | . | * | P | Polyproline II helix | trans | -58.7 | 129.8 | 173.8 | 21.9 | -29.7 | 0 | 0 | 0 | 108.4 | D77 | P73-D77 HydrophobicContact CB-CB 4.2Š|
| 74 | S | 62.5 | Low | 53.2 | Low | 75 Ų | 75 | 110.4 Ų | 110.4 | 52% | 0.524 | 66% | 0.657 | S | S | . | * | P | Polyproline II helix | trans | -60 | 153.5 | -178.7 | 176.9 | 0 | 0 | 0 | 0 | 109.4 | C72 G76 D77 K78 | C72-S74 PolarHBondContact O-N 3.5Å; S74-G76 PolarHBondContact O-N 3.3Å; S74-D77 PolarHBondContact N-OD2 2.96Å; S74-D77 PolarHBondContact O-N 2.83Å; S74-K78 PolarHBondContact O-N 2.98Å |
| 75 | L | 59.3 | Low | 54.1 | Low | 130 Ų | 130 | 113.5 Ų | 113.5 | 68% | 0.681 | 65% | 0.648 | S | S | * | * | H | α-helix | trans | -53.7 | -27.8 | 176.5 | -174.5 | 65.6 | 0 | 0 | 0 | 112 | L79 | L75-L79 HydrophobicContact CG-CD1 4.34Å; L75-L79 WeakPolarHBondContact O-CD1 3.37Å; L75-L79 VanDerWaalsContact O-CG 3.32Å; L75-L79 WeakPolarHBondContact O-CG 3.34Å; L75-L79 PolarHBondContact O-N 3.34Å; L75-L79 VanDerWaalsContact O-N 3.11Å |
| 76 | G | 66.8 | Low | 54.6 | Low | 41 Ų | 41 | 112.8 Ų | 112.8 | 42% | 0.423 | 63% | 0.633 | S | S | . | * | H | α-helix | trans | -63.6 | -44.9 | 173.2 | 0 | 0 | 0 | 0 | 0 | 113.3 | S74 K78 L79 E80 | S74-G76 PolarHBondContact O-N 3.3Å; G76-K78 VanDerWaalsContact C-N 3.34Å; G76-K78 PolarHBondContact O-N 3.27Å; G76-L79 PolarHBondContact O-N 3.4Å; G76-E80 PolarHBondContact O-N 3.29Å |
| 77 | D | 69.1 | Low | 55.3 | Low | 67 Ų | 67 | 110.6 Ų | 110.6 | 36% | 0.358 | 61% | 0.611 | S | S | . | * | H | α-helix | trans | -66.6 | -41.7 | 179 | -48.5 | -32.2 | 0 | 0 | 0 | 109.6 | P73 S74 L79 E80 W81 | P73-D77 HydrophobicContact CB-CB 4.2Å; S74-D77 PolarHBondContact N-OD2 2.96Å; S74-D77 PolarHBondContact O-N 2.83Å; D77-L79 VanDerWaalsContact C-N 3.26Å; D77-L79 PolarHBondContact O-N 3.24Å; D77-E80 PolarHBondContact O-N 2.83Å; D77-E80 VanDerWaalsContact O-N 3.15Å; D77-W81 PolarHBondContact O-N 3.34Å |
| 78 | K | 63.4 | Low | 55.5 | Low | 108 Ų | 108 | 107.2 Ų | 107.2 | 47% | 0.47 | 60% | 0.595 | S | S | . | * | H | α-helix | trans | -59.4 | -36.3 | 175.2 | -68.3 | -175.2 | -179.4 | -178.4 | 0 | 112.5 | S74 G76 V82 | S74-K78 PolarHBondContact O-N 2.98Å; G76-K78 VanDerWaalsContact C-N 3.34Å; G76-K78 PolarHBondContact O-N 3.27Å; K78-V82 WeakPolarHBondContact O-CB 3.49Å; K78-V82 WeakPolarHBondContact O-CG2 3.38Å; K78-V82 PolarHBondContact O-N 2.93Å; K78-V82 VanDerWaalsContact O-N 3.16Å |
| 79 | L | 64.3 | Low | 55.9 | Low | 109 Ų | 109 | 106 Ų | 106 | 57% | 0.571 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -74.6 | -34.5 | 176.7 | -73.8 | 164.8 | 0 | 0 | 0 | 112.2 | L75 G76 D77 V82 S83 | L75-L79 HydrophobicContact CG-CD1 4.34Å; L75-L79 WeakPolarHBondContact O-CD1 3.37Å; L75-L79 VanDerWaalsContact O-CG 3.32Å; L75-L79 WeakPolarHBondContact O-CG 3.34Å; L75-L79 PolarHBondContact O-N 3.34Å; L75-L79 VanDerWaalsContact O-N 3.11Å; G76-L79 PolarHBondContact O-N 3.4Å; D77-L79 VanDerWaalsContact C-N 3.26Å; D77-L79 PolarHBondContact O-N 3.24Å; L79-V82 PolarHBondContact O-N 2.93Å; L79-S83 VanDerWaalsContact O-CB 3.28Å; L79-S83 WeakPolarHBondContact O-CB 3.38Å; L79-S83 PolarHBondContact O-N 3.46Å |
| 80 | E | 61.6 | Low | 56.6 | Low | 129 Ų | 129 | 105.6 Ų | 105.6 | 60% | 0.603 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -63.8 | -47.2 | 173.7 | -173.5 | 170.9 | -158.6 | 0 | 0 | 111.3 | G76 D77 V82 S83 Q84 | G76-E80 PolarHBondContact O-N 3.29Å; D77-E80 PolarHBondContact O-N 2.83Å; D77-E80 VanDerWaalsContact O-N 3.15Å; E80-V82 VanDerWaalsContact C-N 3.35Å; E80-V82 PolarHBondContact O-N 3.09Å; E80-S83 PolarHBondContact O-N 3.49Å; E80-Q84 WeakPolarHBondContact O-CB 3.35Å; E80-Q84 PolarHBondContact O-N 2.96Å |
| 81 | W | 55.6 | Low | 56.8 | Low | 182 Ų | 182 | 103.3 Ų | 103.3 | 69% | 0.689 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -60.5 | -40.5 | 175.1 | -76.2 | 106.4 | 0 | 0 | 0 | 112.8 | D77 F85 | D77-W81 PolarHBondContact O-N 3.34Å; W81-F85 WeakPolarHBondContact O-CB 3.47Å; W81-F85 PolarHBondContact O-N 2.93Å; W81-F85 VanDerWaalsContact O-N 3.1Å |
| 82 | V | 61.7 | Low | 56.8 | Low | 80 Ų | 80 | 102.1 Ų | 102.1 | 49% | 0.485 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -69.3 | -37 | 176.6 | 170.4 | 0 | 0 | 0 | 0 | 111.5 | K78 L79 E80 L86 | K78-V82 WeakPolarHBondContact O-CB 3.49Å; K78-V82 WeakPolarHBondContact O-CG2 3.38Å; K78-V82 PolarHBondContact O-N 2.93Å; K78-V82 VanDerWaalsContact O-N 3.16Å; L79-V82 PolarHBondContact O-N 2.93Å; E80-V82 VanDerWaalsContact C-N 3.35Å; E80-V82 PolarHBondContact O-N 3.09Å; V82-L86 HydrophobicContact CG1-CD1 3.67Å; V82-L86 HydrophobicContact CG1-CG 4.44Å; V82-L86 WeakPolarHBondContact O-CB 3.45Å; V82-L86 WeakPolarHBondContact O-CG 3.36Å; V82-L86 PolarHBondContact O-N 3.35Å |
| 83 | S | 64.4 | Low | 56.7 | Low | 87 Ų | 87 | 101.4 Ų | 101.4 | 61% | 0.608 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -72.3 | -31.4 | 178.3 | -158.7 | 0 | 0 | 0 | 0 | 112.7 | L79 E80 G87 | L79-S83 VanDerWaalsContact O-CB 3.28Å; L79-S83 WeakPolarHBondContact O-CB 3.38Å; L79-S83 PolarHBondContact O-N 3.46Å; E80-S83 PolarHBondContact O-N 3.49Å; S83-G87 PolarHBondContact O-N 3.19Å; S83-G87 VanDerWaalsContact O-N 3.16Å |
| 84 | Q | 60.6 | Low | 57.1 | Low | 110 Ų | 110 | 101.8 Ų | 101.8 | 51% | 0.514 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -75 | -38.6 | 175.7 | -168.4 | 158.6 | 29.4 | 0 | 0 | 112.1 | E80 Q88 | E80-Q84 WeakPolarHBondContact O-CB 3.35Å; E80-Q84 PolarHBondContact O-N 2.96Å; Q84-Q88 PolarHBondContact O-N 3Å |
| 85 | F | 53.5 | Low | 57 | Low | 144 Ų | 144 | 104.2 Ų | 104.2 | 63% | 0.632 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -70.5 | -42.9 | 177.2 | -166.3 | -101.5 | 0 | 0 | 0 | 112.4 | W81 G87 | W81-F85 WeakPolarHBondContact O-CB 3.47Å; W81-F85 PolarHBondContact O-N 2.93Å; W81-F85 VanDerWaalsContact O-N 3.1Å; F85-G87 VanDerWaalsContact C-N 3.3Å; F85-G87 PolarHBondContact O-N 3.47Å |
| 86 | L | 53.4 | Low | 57 | Low | 115 Ų | 115 | 104.1 Ų | 104.1 | 60% | 0.602 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -77.1 | -13.7 | 176.8 | -67.1 | 170.9 | 0 | 0 | 0 | 113.8 | V82 | V82-L86 HydrophobicContact CG1-CD1 3.67Å; V82-L86 HydrophobicContact CG1-CG 4.44Å; V82-L86 WeakPolarHBondContact O-CB 3.45Å; V82-L86 WeakPolarHBondContact O-CG 3.36Å; V82-L86 PolarHBondContact O-N 3.35Å |
| 87 | G | 51.6 | Low | 56.7 | Low | 29 Ų | 29 | 107.9 Ų | 107.9 | 30% | 0.299 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -87.5 | -34.4 | 179.2 | 0 | 0 | 0 | 0 | 0 | 113.9 | S83 F85 | S83-G87 PolarHBondContact O-N 3.19Å; S83-G87 VanDerWaalsContact O-N 3.16Å; F85-G87 VanDerWaalsContact C-N 3.3Å; F85-G87 PolarHBondContact O-N 3.47Å |
| 88 | Q | 48.7 | Very low | 56.2 | Low | 121 Ų | 121 | 110.7 Ų | 110.7 | 57% | 0.565 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -73.2 | -35.1 | -172.2 | -92.7 | 179.4 | -11.4 | 0 | 0 | 114.4 | Q84 D90 E91 H92 | Q84-Q88 PolarHBondContact O-N 3Å; Q88-D90 VanDerWaalsContact C-N 3.31Å; Q88-D90 PolarHBondContact O-N 3.35Å; Q88-E91 PolarHBondContact O-N 3.3Å; Q88-H92 PolarHBondContact O-N 2.97Å |
| 89 | D | 45.5 | Very low | 56 | Low | 110 Ų | 110 | 112 Ų | 112 | 59% | 0.588 | 55% | 0.55 | S | S | * | * | H | α-helix | trans | -69.3 | -28.6 | -175.4 | -68.7 | -39.6 | 0 | 0 | 0 | 112.9 | ||
| 90 | D | 52.4 | Low | 55.6 | Low | 56 Ų | 56 | 114.6 Ų | 114.6 | 30% | 0.299 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -84.6 | -25.1 | -178.6 | -84.9 | -35.3 | 0 | 0 | 0 | 113.4 | Q88 Q94 K456 | Q88-D90 VanDerWaalsContact C-N 3.31Å; Q88-D90 PolarHBondContact O-N 3.35Å; D90-Q94 WeakPolarHBondContact O-CB 3.49Å; D90-Q94 WeakPolarHBondContact O-CG 3.39Å; D90-Q94 PolarHBondContact O-N 2.93Å; D90-Q94 VanDerWaalsContact O-N 3.08Å; D90-Q94 PolarHBondContact O-NE2 2.9Å; D90-K456 IonicContact OD2-NZ 3.92Å |
| 91 | E | 53.2 | Low | 55.3 | Low | 136 Ų | 136 | 115.2 Ų | 115.2 | 64% | 0.636 | 56% | 0.563 | S | S | * | * | H | α-helix | trans | -77 | -39.7 | 177.8 | -69.8 | -167.1 | 103.3 | 0 | 0 | 111.5 | Q88 N93 Q94 Q95 | Q88-E91 PolarHBondContact O-N 3.3Å; E91-N93 VanDerWaalsContact C-N 3.31Å; E91-N93 PolarHBondContact O-N 3.38Å; E91-Q94 PolarHBondContact O-N 3.1Å; E91-Q95 WeakPolarHBondContact O-CB 3.38Å; E91-Q95 PolarHBondContact O-N 3.48Å |
| 92 | H | 44.6 | Very low | 54.9 | Low | 137 Ų | 137 | 113.3 Ų | 113.3 | 63% | 0.634 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -63 | -39.8 | 175.7 | -154.8 | 75.5 | 0 | 0 | 0 | 111.4 | Q88 Q96 | Q88-H92 PolarHBondContact O-N 2.97Å; H92-Q96 WeakPolarHBondContact O-CB 3.49Å; H92-Q96 PolarHBondContact O-N 2.89Å; H92-Q96 VanDerWaalsContact O-N 3.1Å |
| 93 | N | 49 | Very low | 53.8 | Low | 93 Ų | 93 | 117.5 Ų | 117.5 | 50% | 0.497 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -73.7 | -36.2 | 178.3 | -155 | -8.8 | 0 | 0 | 0 | 112.4 | E91 Q97 | E91-N93 VanDerWaalsContact C-N 3.31Å; E91-N93 PolarHBondContact O-N 3.38Å; N93-Q97 WeakPolarHBondContact O-CB 3.48Å; N93-Q97 PolarHBondContact O-N 3.44Å |
| 94 | Q | 57.9 | Low | 52.9 | Low | 79 Ų | 79 | 117.5 Ų | 117.5 | 37% | 0.369 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -68.3 | -39 | 172.3 | -87.1 | -177.2 | 102.5 | 0 | 0 | 113.1 | D90 E91 Q96 Q97 Q98 | D90-Q94 WeakPolarHBondContact O-CB 3.49Å; D90-Q94 WeakPolarHBondContact O-CG 3.39Å; D90-Q94 PolarHBondContact O-N 2.93Å; D90-Q94 VanDerWaalsContact O-N 3.08Å; D90-Q94 PolarHBondContact O-NE2 2.9Å; E91-Q94 PolarHBondContact O-N 3.1Å; Q94-Q96 VanDerWaalsContact C-N 3.34Å; Q94-Q97 PolarHBondContact O-N 2.88Å; Q94-Q98 VanDerWaalsContact O-CB 3.3Å; Q94-Q98 WeakPolarHBondContact O-CB 3.48Å; Q94-Q98 PolarHBondContact O-N 3.46Å |
| 95 | Q | 60 | Low | 51.8 | Low | 126 Ų | 126 | 120.7 Ų | 120.7 | 59% | 0.589 | 60% | 0.595 | S | S | * | * | H | α-helix | trans | -68.3 | -36 | 178.6 | -165.3 | 161 | 45 | 0 | 0 | 111.5 | E91 Q98 Q99 | E91-Q95 WeakPolarHBondContact O-CB 3.38Å; E91-Q95 PolarHBondContact O-N 3.48Å; Q95-Q98 PolarHBondContact O-N 3.41Å; Q95-Q99 PolarHBondContact O-N 2.97Å; Q95-Q99 VanDerWaalsContact O-N 3.15Å |
| 96 | Q | 60.6 | Low | 51.2 | Low | 128 Ų | 128 | 121.9 Ų | 121.9 | 60% | 0.598 | 60% | 0.603 | S | S | * | * | H | α-helix | trans | -67.7 | -40 | 173.7 | -164.6 | 169.8 | 64.5 | 0 | 0 | 112.2 | H92 Q94 Q100 | H92-Q96 WeakPolarHBondContact O-CB 3.49Å; H92-Q96 PolarHBondContact O-N 2.89Å; H92-Q96 VanDerWaalsContact O-N 3.1Å; Q94-Q96 VanDerWaalsContact C-N 3.34Å; Q96-Q100 PolarHBondContact O-N 3.09Å |
| 97 | Q | 59.2 | Low | 50 | Low | 120 Ų | 120 | 124.3 Ų | 124.3 | 56% | 0.561 | 62% | 0.616 | S | S | * | * | H | α-helix | trans | -72.2 | -27.8 | 177.4 | -165.4 | 168.5 | 89.3 | 0 | 0 | 113.2 | N93 Q94 | N93-Q97 WeakPolarHBondContact O-CB 3.48Å; N93-Q97 PolarHBondContact O-N 3.44Å; Q94-Q97 PolarHBondContact O-N 2.88Å |
| 98 | Q | 59.4 | Low | 49.7 | Very low | 126 Ų | 126 | 127.5 Ų | 127.5 | 59% | 0.589 | 63% | 0.631 | S | S | * | * | H | α-helix | trans | -81.3 | -28.7 | 178.9 | -154.7 | 170.6 | 90.4 | 0 | 0 | 112.8 | Q94 Q95 | Q94-Q98 VanDerWaalsContact O-CB 3.3Å; Q94-Q98 WeakPolarHBondContact O-CB 3.48Å; Q94-Q98 PolarHBondContact O-N 3.46Å; Q95-Q98 PolarHBondContact O-N 3.41Å |
| 99 | Q | 58.3 | Low | 49 | Very low | 134 Ų | 134 | 131.3 Ų | 131.3 | 63% | 0.626 | 64% | 0.642 | S | S | * | * | H | α-helix | trans | -69.4 | -33.8 | 171.5 | -78.2 | 179.7 | 47.7 | 0 | 0 | 112.5 | Q95 Q101 Q102 | Q95-Q99 PolarHBondContact O-N 2.97Å; Q95-Q99 VanDerWaalsContact O-N 3.15Å; Q99-Q101 VanDerWaalsContact C-N 3.3Å; Q99-Q101 PolarHBondContact O-N 2.81Å; Q99-Q102 PolarHBondContact O-N 2.89Å |
| 100 | Q | 56.4 | Low | 48.3 | Very low | 165 Ų | 165 | 136 Ų | 136 | 77% | 0.771 | 66% | 0.657 | S | S | * | * | H | α-helix | trans | -71.1 | -24.2 | -180 | -159.9 | 165.7 | 87.5 | 0 | 0 | 113.3 | Q96 | Q96-Q100 PolarHBondContact O-N 3.09Å |
| 101 | Q | 54.5 | Low | 47.4 | Very low | 142 Ų | 142 | 141.5 Ų | 141.5 | 66% | 0.664 | 69% | 0.685 | S | S | * | * | H | α-helix | trans | -82.6 | -25.3 | 175.9 | -88.1 | 169.5 | 64.8 | 0 | 0 | 113.9 | Q99 | Q99-Q101 VanDerWaalsContact C-N 3.3Å; Q99-Q101 PolarHBondContact O-N 2.81Å |
| 102 | Q | 47.9 | Very low | 46.2 | Very low | 141 Ų | 141 | 138.7 Ų | 138.7 | 66% | 0.659 | 69% | 0.686 | S | S | * | * | H | α-helix | trans | -79.2 | -23.8 | -178.9 | -69.3 | -178 | 50.3 | 0 | 0 | 113.2 | Q99 A104 | Q99-Q102 PolarHBondContact O-N 2.89Å; Q102-A104 VanDerWaalsContact C-N 3.27Å; Q102-A104 PolarHBondContact O-N 3.46Å |
| 103 | H | 39.2 | Very low | 45.6 | Very low | 168 Ų | 168 | 138.9 Ų | 138.9 | 78% | 0.778 | 70% | 0.697 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77.7 | -8.7 | -178.6 | -157.3 | 44.3 | 0 | 0 | 0 | 114.3 | ||
| 104 | A | 44 | Very low | 44.7 | Very low | 87 Ų | 87 | 139.8 Ų | 139.8 | 72% | 0.719 | 71% | 0.71 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89.8 | -4.3 | -176.8 | 0 | 0 | 0 | 0 | 0 | 114.8 | Q102 | Q102-A104 VanDerWaalsContact C-N 3.27Å; Q102-A104 PolarHBondContact O-N 3.46Å |
| 105 | Q | 39.2 | Very low | 44.2 | Very low | 177 Ų | 177 | 139.3 Ų | 139.3 | 83% | 0.827 | 73% | 0.726 | S | S | * | * | S | Bend | trans | -115.4 | -6.3 | -171.5 | -80.2 | -172.8 | -2 | 0 | 0 | 116.8 | ||
| 106 | E | 39.1 | Very low | 43.5 | Very low | 169 Ų | 169 | 141.1 Ų | 141.1 | 79% | 0.79 | 74% | 0.74 | S | S | * | * | trans | -124.9 | 101.3 | 171 | -70 | -146 | 151.1 | 0 | 0 | 111.3 | ||||
| 107 | L | 29.3 | Very low | 42.6 | Very low | 167 Ų | 167 | 140.8 Ų | 140.8 | 87% | 0.874 | 75% | 0.752 | S | S | * | * | 175.2 | 132.9 | 121.5 | -89.6 | 175.5 | 0 | 0 | 0 | 111.8 | |||||
| 108 | P | 44.9 | Very low | 41.8 | Very low | 95 Ų | 95 | 144.9 Ų | 144.9 | 62% | 0.617 | 77% | 0.768 | S | S | * | * | trans | -94.3 | 135 | 171.3 | 34.4 | -27.4 | 0 | 0 | 0 | 112.6 | ||||
| 109 | Y | 33.3 | Very low | 41.2 | Very low | 202 Ų | 202 | 142.5 Ų | 142.5 | 79% | 0.792 | 78% | 0.777 | S | S | * | * | trans | 14.7 | 124.3 | 160.3 | 61.8 | -91.2 | 0 | 0 | 0 | 121 | ||||
| 110 | K | 31.6 | Very low | 40.9 | Very low | 208 Ų | 208 | 141.2 Ų | 141.2 | 90% | 0.904 | 78% | 0.775 | S | S | * | * | -171.5 | 150.9 | 119.5 | -98.7 | -151.9 | -178.2 | -170.4 | 0 | 112.6 | |||||
| 111 | L | 33.2 | Very low | 40.8 | Very low | 171 Ų | 171 | 138.8 Ų | 138.8 | 90% | 0.895 | 77% | 0.766 | S | S | * | * | trans | -90 | 139.2 | -164.1 | -176.3 | 69.8 | 0 | 0 | 0 | 113.4 | ||||
| 112 | A | 29 | Very low | 40.4 | Very low | 78 Ų | 78 | 136.9 Ų | 136.9 | 65% | 0.645 | 77% | 0.768 | S | S | * | * | trans | 126.3 | 119.9 | 136 | 0 | 0 | 0 | 0 | 0 | 117.8 | ||||
| 113 | T | 31 | Very low | 40.4 | Very low | 141 Ų | 141 | 133.6 Ų | 133.6 | 87% | 0.865 | 76% | 0.761 | S | S | * | * | trans | 65 | 123.5 | 150.7 | -2 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 114 | S | 31.4 | Very low | 41.3 | Very low | 111 Ų | 111 | 131.4 Ų | 131.4 | 78% | 0.776 | 75% | 0.754 | S | S | * | * | cis | -160 | 140.6 | 35.7 | 44 | 0 | 0 | 0 | 0 | 107.6 | ||||
| 115 | G | 46.2 | Very low | 42 | Very low | 69 Ų | 69 | 133.4 Ų | 133.4 | 71% | 0.711 | 75% | 0.751 | S | S | * | * | 81.3 | 119.9 | 104.9 | 0 | 0 | 0 | 0 | 0 | 112.9 | |||||
| 116 | D | 45 | Very low | 42.8 | Very low | 165 Ų | 165 | 131.6 Ų | 131.6 | 88% | 0.882 | 75% | 0.746 | S | S | * | * | trans | 84.2 | 83.6 | 169 | -56.9 | -20.2 | 0 | 0 | 0 | 119.2 | ||||
| 117 | S | 43.2 | Very low | 43.4 | Very low | 120 Ų | 120 | 131.2 Ų | 131.2 | 84% | 0.839 | 74% | 0.744 | S | S | * | * | S | Bend | trans | -168.1 | -1.6 | 142.3 | -93 | 0 | 0 | 0 | 0 | 115.5 | G119 | S117-G119 VanDerWaalsContact C-N 3.29Å; S117-G119 PolarHBondContact O-N 2.9Å |
| 118 | F | 41.4 | Very low | 44.5 | Very low | 207 Ų | 207 | 130.3 Ų | 130.3 | 91% | 0.908 | 74% | 0.74 | S | S | * | * | S | Bend | trans | -91.5 | 30.8 | 175.3 | -82.3 | -81.6 | 0 | 0 | 0 | 114.1 | ||
| 119 | G | 46.3 | Very low | 44.6 | Very low | 75 Ų | 75 | 131.8 Ų | 131.8 | 77% | 0.773 | 75% | 0.751 | S | S | * | * | S | Bend | trans | -99.1 | -2 | -173.7 | 0 | 0 | 0 | 0 | 0 | 116.9 | S117 | S117-G119 VanDerWaalsContact C-N 3.29Å; S117-G119 PolarHBondContact O-N 2.9Å |
| 120 | N | 52.9 | Low | 45.7 | Very low | 108 Ų | 108 | 129.7 Ų | 129.7 | 58% | 0.578 | 75% | 0.751 | S | S | * | * | S | Bend | trans | -142.5 | 44.8 | -169.9 | -154.3 | -12.4 | 0 | 0 | 0 | 115.7 | S123 | N120-S123 PolarHBondContact OD1-OG 3.2Š|
| 121 | L | 53.6 | Low | 46.7 | Very low | 113 Ų | 113 | 131 Ų | 131 | 59% | 0.592 | 75% | 0.75 | S | S | * | * | S | Bend | trans | -112.7 | -10.1 | 164.4 | -74.8 | 153.4 | 0 | 0 | 0 | 112.3 | I125 | L121-I125 WeakPolarHBondContact O-CG1 3.42Š|
| 122 | S | 47.3 | Very low | 47.5 | Very low | 102 Ų | 102 | 128.9 Ų | 128.9 | 71% | 0.713 | 75% | 0.749 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80.3 | -14 | 175.4 | -53.4 | 0 | 0 | 0 | 0 | 113.7 | ||
| 123 | S | 47.8 | Very low | 47.8 | Very low | 73 Ų | 73 | 130.9 Ų | 130.9 | 51% | 0.51 | 76% | 0.757 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -86 | -23 | 175.4 | 82.9 | 0 | 0 | 0 | 0 | 113.2 | N120 | N120-S123 PolarHBondContact OD1-OG 3.2Š|
| 124 | I | 57.5 | Low | 48.3 | Very low | 121 Ų | 121 | 134.1 Ų | 134.1 | 62% | 0.621 | 76% | 0.76 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89.1 | -19.6 | -177.1 | -65.8 | 166.9 | 0 | 0 | 0 | 111.9 | ||
| 125 | I | 58.9 | Low | 48.9 | Very low | 129 Ų | 129 | 134.7 Ų | 134.7 | 66% | 0.662 | 76% | 0.764 | S | S | * | * | S | Bend | trans | -95.2 | 3.3 | -172.4 | -61.8 | 175.4 | 0 | 0 | 0 | 113.2 | L121 | L121-I125 WeakPolarHBondContact O-CG1 3.42Š|
| 126 | I | 55 | Low | 48.8 | Very low | 139 Ų | 139 | 136.9 Ų | 136.9 | 71% | 0.713 | 78% | 0.775 | S | S | * | * | S | Bend | trans | -130.5 | 39 | 180 | -38.4 | -178.3 | 0 | 0 | 0 | 113.1 | ||
| 127 | Q | 53.7 | Low | 48.8 | Very low | 162 Ų | 162 | 132.7 Ų | 132.7 | 76% | 0.757 | 77% | 0.771 | S | S | * | * | S | Bend | trans | -130.6 | 0.6 | 174.9 | -156.3 | 141.4 | 1 | 0 | 0 | 117.8 | ||
| 128 | D | 50.6 | Low | 48.8 | Very low | 147 Ų | 147 | 135.9 Ų | 135.9 | 79% | 0.786 | 77% | 0.772 | S | S | * | * | S | Bend | trans | -130.2 | -2.5 | 179 | -66.5 | -47 | 0 | 0 | 0 | 115.8 | ||
| 129 | C | 48.7 | Very low | 48.7 | Very low | 127 Ų | 127 | 135 Ų | 135 | 86% | 0.858 | 77% | 0.771 | S | S | * | * | S | Bend | trans | -98.8 | 9.8 | -173.3 | -80.5 | 0 | 0 | 0 | 0 | 116.1 | ||
| 130 | M | 54.5 | Low | 48.5 | Very low | 157 Ų | 157 | 139.9 Ų | 139.9 | 77% | 0.773 | 78% | 0.778 | S | S | * | * | S | Bend | trans | -114.9 | 1.6 | -175.7 | -78.4 | -169.7 | 59.7 | 0 | 0 | 117.1 | ||
| 131 | W | 54.3 | Low | 48.2 | Very low | 237 Ų | 237 | 143.2 Ų | 143.2 | 90% | 0.898 | 79% | 0.79 | S | S | * | * | trans | -138.4 | 28.1 | -172.3 | -74.4 | 76.5 | 0 | 0 | 0 | 117 | ||||
| 132 | S | 48.4 | Very low | 47.9 | Very low | 125 Ų | 125 | 149.4 Ų | 149.4 | 87% | 0.874 | 81% | 0.806 | S | S | * | * | trans | -108.6 | 69.9 | 168.9 | -69.4 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 133 | C | 35.7 | Very low | 47.6 | Very low | 120 Ų | 120 | 151.6 Ų | 151.6 | 81% | 0.811 | 82% | 0.815 | S | S | * | * | S | Bend | trans | -146.8 | 49.2 | 166.3 | -156.7 | 0 | 0 | 0 | 0 | 111.9 | ||
| 134 | F | 41 | Very low | 47.3 | Very low | 210 Ų | 210 | 155.4 Ų | 155.4 | 92% | 0.921 | 83% | 0.834 | S | S | * | * | S | Bend | trans | -170.4 | 61.7 | 158.6 | -130.8 | -91.1 | 0 | 0 | 0 | 112.1 | ||
| 135 | S | 45.3 | Very low | 46.5 | Very low | 123 Ų | 123 | 153 Ų | 153 | 86% | 0.86 | 84% | 0.84 | S | S | * | * | S | Bend | trans | -155.5 | 13.6 | 166.8 | -129.2 | 0 | 0 | 0 | 0 | 116.3 | ||
| 136 | A | 43.4 | Very low | 45.1 | Very low | 114 Ų | 114 | 156.1 Ų | 156.1 | 94% | 0.942 | 85% | 0.852 | S | S | * | * | S | Bend | trans | -98.6 | 24.4 | 176 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||
| 137 | G | 44.4 | Very low | 44.4 | Very low | 77 Ų | 77 | 159.4 Ų | 159.4 | 79% | 0.794 | 86% | 0.855 | S | S | * | * | S | Bend | trans | -128 | 10.6 | -171.3 | 0 | 0 | 0 | 0 | 0 | 116.6 | ||
| 138 | Q | 43.2 | Very low | 43.5 | Very low | 187 Ų | 187 | 157.4 Ų | 157.4 | 87% | 0.874 | 86% | 0.856 | S | S | * | * | S | Bend | trans | -129.5 | 12.5 | -171.4 | -136.2 | 177.3 | 84.1 | 0 | 0 | 115.9 | ||
| 139 | Q | 39.9 | Very low | 42.9 | Very low | 189 Ų | 189 | 160.7 Ų | 160.7 | 88% | 0.883 | 86% | 0.858 | S | S | * | * | S | Bend | trans | -125.3 | 49.9 | 179.2 | -81.8 | -93 | 27.9 | 0 | 0 | 112.7 | ||
| 140 | L | 42.6 | Very low | 42 | Very low | 177 Ų | 177 | 163.5 Ų | 163.5 | 93% | 0.927 | 86% | 0.863 | S | S | * | * | S | Bend | trans | -140.7 | 38.2 | 164 | -163.4 | 61.5 | 0 | 0 | 0 | 112.9 | ||
| 141 | E | 45.8 | Very low | 40.7 | Very low | 178 Ų | 178 | 159.2 Ų | 159.2 | 83% | 0.832 | 86% | 0.859 | S | S | * | * | S | Bend | trans | -146.3 | 64.6 | 172.7 | -159.1 | -175.4 | -179.2 | 0 | 0 | 109.9 | ||
| 142 | R | 47.7 | Very low | 39.6 | Very low | 244 Ų | 244 | 153.5 Ų | 153.5 | 92% | 0.921 | 86% | 0.862 | S | S | * | * | S | Bend | trans | -170.9 | 46.2 | 167.1 | -111.1 | 176.5 | -94.4 | -169.1 | -3.2 | 115.2 | ||
| 143 | V | 42 | Very low | 38.6 | Very low | 147 Ų | 147 | 151.4 Ų | 151.4 | 89% | 0.891 | 86% | 0.861 | S | S | * | * | S | Bend | trans | -144.7 | 63.1 | 156.9 | -167.5 | 0 | 0 | 0 | 0 | 110.6 | ||
| 144 | V | 40 | Very low | 38.3 | Very low | 153 Ų | 153 | 149.5 Ų | 149.5 | 93% | 0.927 | 86% | 0.861 | S | S | * | * | S | Bend | trans | -144.2 | 109.5 | 151.4 | 169.9 | 0 | 0 | 0 | 0 | 106.2 | ||
| 145 | G | 41.1 | Very low | 37.9 | Very low | 71 Ų | 71 | 147.1 Ų | 147.1 | 73% | 0.732 | 86% | 0.858 | S | S | * | * | trans | 138.8 | 80.3 | 175 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 146 | E | 29.6 | Very low | 37.2 | Very low | 195 Ų | 195 | 147.4 Ų | 147.4 | 91% | 0.911 | 85% | 0.854 | S | S | * | * | 178.9 | 133 | 118.5 | -95.3 | -168.9 | 157.9 | 0 | 0 | 110.7 | |||||
| 147 | R | 41.5 | Very low | 36.7 | Very low | 208 Ų | 208 | 149.3 Ų | 149.3 | 79% | 0.785 | 85% | 0.848 | S | S | * | * | trans | -121.5 | 140.4 | 163.7 | 179.7 | 157.9 | -179.1 | 93.1 | -4.7 | 106.7 | ||||
| 148 | P | 33.1 | Very low | 36.3 | Very low | 120 Ų | 120 | 151.1 Ų | 151.1 | 78% | 0.779 | 85% | 0.848 | S | S | * | * | trans | -122.9 | 147.2 | 139.5 | 0.8 | 20.6 | 0 | 0 | 0 | 112.8 | ||||
| 149 | R | 38 | Very low | 36.1 | Very low | 216 Ų | 216 | 147.8 Ų | 147.8 | 82% | 0.815 | 84% | 0.843 | S | S | * | * | trans | -88.1 | 154.5 | 177.7 | -61.9 | 178.4 | 169.4 | -171.4 | -4 | 110.5 | ||||
| 150 | L | 30.3 | Very low | 35.4 | Very low | 186 Ų | 186 | 148.5 Ų | 148.5 | 97% | 0.974 | 84% | 0.838 | S | S | * | * | trans | -178.6 | 133.5 | 145.9 | -90.5 | 158.3 | 0 | 0 | 0 | 104.3 | ||||
| 151 | G | 27.8 | Very low | 34.6 | Very low | 66 Ų | 66 | 147.4 Ų | 147.4 | 68% | 0.68 | 83% | 0.825 | S | S | * | * | cis | 157.7 | 138.9 | 4.4 | 0 | 0 | 0 | 0 | 0 | 107.3 | ||||
| 152 | A | 29.8 | Very low | 33.8 | Very low | 117 Ų | 117 | 142.6 Ų | 142.6 | 97% | 0.967 | 82% | 0.816 | S | S | * | * | trans | 66.5 | 139.9 | 172.5 | 0 | 0 | 0 | 0 | 0 | 116.9 | ||||
| 153 | G | 28.9 | Very low | 32.9 | Very low | 82 Ų | 82 | 140.2 Ų | 140.2 | 85% | 0.845 | 82% | 0.815 | S | S | * | * | cis | 155.2 | 133.4 | 9.3 | 0 | 0 | 0 | 0 | 0 | 106 | ||||
| 154 | G | 28.6 | Very low | 32 | Very low | 80 Ų | 80 | 136.4 Ų | 136.4 | 83% | 0.825 | 81% | 0.805 | S | S | * | * | trans | 153.4 | 97.1 | 175.6 | 0 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 155 | N | 32.2 | Very low | 31.4 | Very low | 160 Ų | 160 | 133.9 Ų | 133.9 | 86% | 0.856 | 80% | 0.801 | S | S | * | * | trans | -53.8 | 151.9 | 159 | -78.8 | -6.9 | 0 | 0 | 0 | 110.4 | ||||
| 156 | V | 31.5 | Very low | 30.8 | Very low | 128 Ų | 128 | 138.2 Ų | 138.2 | 78% | 0.776 | 81% | 0.806 | S | S | * | * | trans | 174 | 117.8 | 131 | 151 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 157 | L | 31.8 | Very low | 30.8 | Very low | 155 Ų | 155 | 132.3 Ų | 132.3 | 81% | 0.812 | 79% | 0.791 | S | S | * | * | trans | 43.6 | 123.1 | 140.4 | -60.9 | 156.7 | 0 | 0 | 0 | 121.3 | ||||
| 158 | S | 37 | Very low | 30 | Very low | 115 Ų | 115 | 130.7 Ų | 130.7 | 80% | 0.804 | 80% | 0.798 | S | S | * | * | trans | -67.7 | 152.9 | 147.5 | -49.8 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 159 | P | 38.6 | Very low | 30 | Very low | 117 Ų | 117 | 130.3 Ų | 130.3 | 76% | 0.76 | 79% | 0.794 | S | S | * | * | -137.5 | 128.9 | 123 | 17.9 | 3.2 | 0 | 0 | 0 | 111.8 | |||||
| 160 | W | 25.1 | Very low | 29.7 | Very low | 204 Ų | 204 | 130.4 Ų | 130.4 | 77% | 0.773 | 79% | 0.794 | S | S | * | * | 60.4 | 104.4 | 96.9 | 178.7 | -96.2 | 0 | 0 | 0 | 116.4 | |||||
| 161 | K | 26.7 | Very low | 29.8 | Very low | 154 Ų | 154 | 130.1 Ų | 130.1 | 67% | 0.67 | 79% | 0.785 | S | S | * | * | 61.8 | 126.5 | 127.4 | -154.7 | -177.9 | -172.4 | -176 | 0 | 120 | |||||
| 162 | A | 28.3 | Very low | 29.9 | Very low | 76 Ų | 76 | 131.6 Ų | 131.6 | 63% | 0.628 | 79% | 0.791 | S | S | * | * | 170.6 | 142.1 | 114.6 | 0 | 0 | 0 | 0 | 0 | 113.2 | |||||
| 163 | Q | 29.3 | Very low | 29.8 | Very low | 194 Ų | 194 | 130.1 Ų | 130.1 | 91% | 0.907 | 79% | 0.787 | S | S | * | * | trans | 53.6 | 135.8 | 154.2 | -99.2 | 95.3 | 33.3 | 0 | 0 | 119.4 | ||||
| 164 | G | 23.5 | Very low | 29.8 | Very low | 67 Ų | 67 | 129.5 Ų | 129.5 | 69% | 0.691 | 78% | 0.781 | S | S | * | * | cis | 133.1 | 124.8 | 11.4 | 0 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 165 | A | 27.7 | Very low | 30.4 | Very low | 101 Ų | 101 | 134.2 Ų | 134.2 | 84% | 0.835 | 79% | 0.787 | S | S | * | * | trans | 69.4 | 157.3 | 161.8 | 0 | 0 | 0 | 0 | 0 | 116.7 | ||||
| 166 | L | 28.2 | Very low | 30.5 | Very low | 161 Ų | 161 | 131.4 Ų | 131.4 | 84% | 0.843 | 79% | 0.786 | S | S | * | * | cis | -166.5 | 142.9 | 16.5 | -167.7 | 131.2 | 0 | 0 | 0 | 110 | ||||
| 167 | A | 29.7 | Very low | 31 | Very low | 71 Ų | 71 | 129.8 Ų | 129.8 | 59% | 0.587 | 79% | 0.785 | S | S | * | * | trans | 46.4 | 123.9 | 151.1 | 0 | 0 | 0 | 0 | 0 | 123.7 | ||||
| 168 | D | 25 | Very low | 31.3 | Very low | 174 Ų | 174 | 130.1 Ų | 130.1 | 93% | 0.93 | 79% | 0.788 | S | S | * | * | trans | -98.8 | 136 | 140.4 | -84.2 | -37.5 | 0 | 0 | 0 | 109.8 | ||||
| 169 | T | 32.3 | Very low | 32 | Very low | 113 Ų | 113 | 130.8 Ų | 130.8 | 69% | 0.693 | 79% | 0.791 | S | S | * | * | trans | -127.7 | 127.8 | 173.8 | -49.3 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 170 | W | 32.1 | Very low | 32.7 | Very low | 218 Ų | 218 | 131.3 Ų | 131.3 | 83% | 0.826 | 79% | 0.792 | S | S | * | * | trans | 86.2 | 112.5 | 147.1 | -92.2 | 6.3 | 0 | 0 | 0 | 124.9 | ||||
| 171 | F | 30.9 | Very low | 34.2 | Very low | 179 Ų | 179 | 126.5 Ų | 126.5 | 79% | 0.785 | 78% | 0.782 | S | S | * | * | 68.4 | 120.9 | 126.2 | -85.2 | -120.1 | 0 | 0 | 0 | 121 | |||||
| 172 | A | 30.1 | Very low | 35.4 | Very low | 97 Ų | 97 | 124.5 Ų | 124.5 | 80% | 0.802 | 78% | 0.784 | S | S | * | * | 176.7 | 134.5 | 103 | 0 | 0 | 0 | 0 | 0 | 114 | |||||
| 173 | G | 29 | Very low | 36.6 | Very low | 86 Ų | 86 | 124.2 Ų | 124.2 | 89% | 0.887 | 78% | 0.782 | S | S | * | * | trans | 70.1 | 138.2 | 149.3 | 0 | 0 | 0 | 0 | 0 | 118.1 | ||||
| 174 | G | 29.3 | Very low | 37.8 | Very low | 70 Ų | 70 | 118.8 Ų | 118.8 | 72% | 0.722 | 77% | 0.77 | S | S | * | * | cis | 157.4 | 131.5 | 9.7 | 0 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 175 | L | 41.3 | Very low | 39 | Very low | 179 Ų | 179 | 121 Ų | 121 | 94% | 0.937 | 77% | 0.77 | S | S | * | * | trans | 69.7 | 104.6 | 155.2 | -61.6 | 167.1 | 0 | 0 | 0 | 119.6 | ||||
| 176 | A | 32.8 | Very low | 39.8 | Very low | 101 Ų | 101 | 122.9 Ų | 122.9 | 84% | 0.835 | 77% | 0.765 | S | S | * | * | P | Polyproline II helix | trans | -63 | 136.7 | 158 | 0 | 0 | 0 | 0 | 0 | 111 | ||
| 177 | A | 41.5 | Very low | 40.4 | Very low | 93 Ų | 93 | 121.2 Ų | 121.2 | 77% | 0.769 | 76% | 0.762 | S | S | * | * | P | Polyproline II helix | trans | -84.8 | 125 | 163.6 | 0 | 0 | 0 | 0 | 0 | 108.6 | C179 | A177-C179 PolarHBondContact O-N 3.12Š|
| 178 | D | 39.8 | Very low | 40.9 | Very low | 162 Ų | 162 | 126.5 Ų | 126.5 | 87% | 0.866 | 77% | 0.772 | S | S | * | * | P | Polyproline II helix | trans | -58.5 | 122.1 | 173.3 | -90 | -41.5 | 0 | 0 | 0 | 111.2 | ||
| 179 | C | 50.2 | Low | 41.7 | Very low | 129 Ų | 129 | 124 Ų | 124 | 87% | 0.872 | 77% | 0.765 | S | S | * | * | P | Polyproline II helix | trans | -82.1 | 116.9 | 169.1 | -63.8 | 0 | 0 | 0 | 0 | 109.2 | A177 | A177-C179 PolarHBondContact O-N 3.12Š|
| 180 | V | 53.4 | Low | 41.8 | Very low | 128 Ų | 128 | 126.5 Ų | 126.5 | 78% | 0.776 | 77% | 0.773 | S | S | * | * | P | Polyproline II helix | trans | -83.3 | 129.2 | 170.7 | 176.8 | 0 | 0 | 0 | 0 | 109.2 | ||
| 181 | D | 56.3 | Low | 42.6 | Very low | 104 Ų | 104 | 122.2 Ų | 122.2 | 56% | 0.556 | 77% | 0.774 | S | S | * | * | P | Polyproline II helix | trans | -71.8 | 120.2 | 175 | 178.6 | 7.8 | 0 | 0 | 0 | 110.9 | A183 A184 | D181-A183 PolarHBondContact O-N 3.25Å; D181-A183 VanDerWaalsContact O-N 3.16Å; D181-A183 WeakPolarHBondContact OD1-CB 3.49Å; D181-A183 PolarHBondContact OD1-N 3.05Å; D181-A184 PolarHBondContact O-N 3.38Å |
| 182 | P | 52.4 | Low | 42.8 | Very low | 111 Ų | 111 | 117.5 Ų | 117.5 | 72% | 0.721 | 78% | 0.776 | S | S | * | * | G | 310 helix | trans | -66.5 | -10.6 | 178.8 | 26.6 | -33.5 | 0 | 0 | 0 | 114.1 | A184 | P182-A184 PolarHBondContact O-N 2.96Š|
| 183 | A | 53.3 | Low | 43 | Very low | 71 Ų | 71 | 116.3 Ų | 116.3 | 59% | 0.587 | 77% | 0.773 | S | S | * | * | G | 310 helix | trans | -71.9 | -13.1 | 174.7 | 0 | 0 | 0 | 0 | 0 | 113.8 | D181 V185 | D181-A183 PolarHBondContact O-N 3.25Å; D181-A183 VanDerWaalsContact O-N 3.16Å; D181-A183 WeakPolarHBondContact OD1-CB 3.49Å; D181-A183 PolarHBondContact OD1-N 3.05Å; A183-V185 VanDerWaalsContact C-N 3.26Å; A183-V185 PolarHBondContact O-N 3.38Å |
| 184 | A | 54.3 | Low | 43.2 | Very low | 79 Ų | 79 | 118.9 Ų | 118.9 | 65% | 0.653 | 78% | 0.776 | S | S | * | * | G | 310 helix | trans | -78.5 | -1.5 | 179 | 0 | 0 | 0 | 0 | 0 | 114.6 | D181 P182 | D181-A184 PolarHBondContact O-N 3.38Å; P182-A184 PolarHBondContact O-N 2.96Å |
| 185 | V | 48.9 | Very low | 43.8 | Very low | 114 Ų | 114 | 124.8 Ų | 124.8 | 69% | 0.691 | 78% | 0.782 | S | S | * | * | G | 310 helix | trans | -99 | -2.7 | -176 | -175.4 | 0 | 0 | 0 | 0 | 113.1 | A183 | A183-V185 VanDerWaalsContact C-N 3.26Å; A183-V185 PolarHBondContact O-N 3.38Å |
| 186 | L | 44.7 | Very low | 43.6 | Very low | 140 Ų | 140 | 128.1 Ų | 128.1 | 73% | 0.733 | 78% | 0.782 | S | S | * | * | trans | -111.1 | 71.7 | 179.9 | -61.5 | 179.1 | 0 | 0 | 0 | 112 | ||||
| 187 | T | 40.2 | Very low | 44 | Very low | 127 Ų | 127 | 132.7 Ų | 132.7 | 78% | 0.779 | 78% | 0.783 | S | S | * | * | trans | -88.4 | 103.2 | 161.5 | 42.1 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 188 | F | 40.9 | Very low | 43.5 | Very low | 182 Ų | 182 | 135.2 Ų | 135.2 | 80% | 0.798 | 79% | 0.788 | S | S | * | * | trans | -117.5 | 123.7 | 154.4 | -75.9 | -77.7 | 0 | 0 | 0 | 108.7 | ||||
| 189 | P | 41.5 | Very low | 43.4 | Very low | 121 Ų | 121 | 132.4 Ų | 132.4 | 79% | 0.786 | 78% | 0.782 | S | S | * | * | trans | -87.8 | 130.1 | 178.6 | 30.8 | -27.6 | 0 | 0 | 0 | 111.3 | ||||
| 190 | L | 35.8 | Very low | 42.7 | Very low | 165 Ų | 165 | 132 Ų | 132 | 86% | 0.864 | 78% | 0.78 | S | S | * | * | trans | -123.4 | 135.9 | 155.6 | -83.9 | 102.7 | 0 | 0 | 0 | 110.1 | ||||
| 191 | P | 47.5 | Very low | 41.8 | Very low | 128 Ų | 128 | 129.5 Ų | 129.5 | 83% | 0.831 | 78% | 0.78 | S | S | * | * | trans | -95.8 | 150.5 | -169.8 | 36.6 | -32.9 | 0 | 0 | 0 | 114 | ||||
| 192 | G | 34.6 | Very low | 40.9 | Very low | 81 Ų | 81 | 129.2 Ų | 129.2 | 84% | 0.835 | 79% | 0.787 | S | S | * | * | trans | 90.3 | 121.7 | 162.6 | 0 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 193 | G | 34.3 | Very low | 40.6 | Very low | 72 Ų | 72 | 131.5 Ų | 131.5 | 74% | 0.742 | 79% | 0.788 | S | S | * | * | cis | 115.3 | 111.2 | 26.5 | 0 | 0 | 0 | 0 | 0 | 108 | ||||
| 194 | C | 33 | Very low | 39.8 | Very low | 140 Ų | 140 | 134.1 Ų | 134.1 | 95% | 0.946 | 80% | 0.801 | S | S | * | * | trans | 167.3 | 149.9 | 138.8 | -86.7 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 195 | K | 43.5 | Very low | 39.4 | Very low | 194 Ų | 194 | 138.7 Ų | 138.7 | 84% | 0.843 | 81% | 0.809 | S | S | * | * | trans | -79.8 | 146.5 | -166.9 | -52.3 | 179.4 | 176.5 | 178.5 | 0 | 112.6 | ||||
| 196 | R | 37.3 | Very low | 39.2 | Very low | 248 Ų | 248 | 139.6 Ų | 139.6 | 94% | 0.936 | 82% | 0.815 | S | S | * | * | 178.9 | 142.5 | 123.5 | -104.9 | 174 | -68.3 | 146.1 | -1.5 | 113 | |||||
| 197 | K | 40.6 | Very low | 39.6 | Very low | 198 Ų | 198 | 140 Ų | 140 | 86% | 0.861 | 82% | 0.818 | S | S | * | * | trans | -85.2 | 146.1 | 161.1 | -66 | 178.5 | 174.6 | -176.2 | 0 | 108.9 | ||||
| 198 | V | 30.8 | Very low | 39.8 | Very low | 145 Ų | 145 | 139.5 Ų | 139.5 | 88% | 0.879 | 82% | 0.82 | S | S | * | * | trans | 165.8 | 144.2 | 131 | 152.2 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 199 | S | 37.5 | Very low | 40.2 | Very low | 104 Ų | 104 | 135.6 Ų | 135.6 | 73% | 0.727 | 82% | 0.815 | S | S | * | * | trans | -70.6 | 170.6 | -173.9 | -50.9 | 0 | 0 | 0 | 0 | 117.6 | ||||
| 200 | S | 34.9 | Very low | 40.9 | Very low | 119 Ų | 119 | 136.7 Ų | 136.7 | 83% | 0.832 | 81% | 0.814 | S | S | * | * | trans | 96.1 | 125 | 136 | -77.7 | 0 | 0 | 0 | 0 | 120.6 | ||||
| 201 | G | 34.3 | Very low | 41.6 | Very low | 76 Ų | 76 | 135.3 Ų | 135.3 | 78% | 0.784 | 81% | 0.807 | S | S | * | * | trans | 64.9 | 141 | 142.2 | 0 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 202 | S | 37.6 | Very low | 42.4 | Very low | 99 Ų | 99 | 137.6 Ų | 137.6 | 69% | 0.692 | 81% | 0.807 | S | S | * | * | cis | -172.1 | 169.1 | 21.8 | -117.7 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 203 | E | 46.5 | Very low | 43.3 | Very low | 159 Ų | 159 | 141.4 Ų | 141.4 | 74% | 0.743 | 81% | 0.808 | S | S | * | * | trans | -8.4 | 145.6 | 161.4 | 66.4 | -135.2 | 95.6 | 0 | 0 | 121.8 | ||||
| 204 | S | 36.4 | Very low | 44.4 | Very low | 125 Ų | 125 | 147.5 Ų | 147.5 | 87% | 0.874 | 82% | 0.817 | S | S | * | * | 174.3 | 154.9 | 114.3 | -82.9 | 0 | 0 | 0 | 0 | 112.8 | |||||
| 205 | H | 45.8 | Very low | 45.1 | Very low | 176 Ų | 176 | 147 Ų | 147 | 82% | 0.815 | 81% | 0.805 | S | S | * | * | trans | -113.4 | 146.5 | -162.2 | -152.2 | -83 | 0 | 0 | 0 | 109.7 | ||||
| 206 | T | 44.4 | Very low | 45.5 | Very low | 133 Ų | 133 | 144.3 Ų | 144.3 | 82% | 0.816 | 80% | 0.8 | S | S | * | * | trans | 172.1 | 110 | 156.3 | 39.3 | 0 | 0 | 0 | 0 | 106.3 | ||||
| 207 | D | 54.3 | Low | 46.3 | Very low | 148 Ų | 148 | 139.3 Ų | 139.3 | 79% | 0.791 | 79% | 0.792 | S | S | * | * | 43.1 | 105.9 | 75.5 | -164 | 35.2 | 0 | 0 | 0 | 114.5 | |||||
| 208 | S | 44.6 | Very low | 46.9 | Very low | 117 Ų | 117 | 136.7 Ų | 136.7 | 82% | 0.818 | 79% | 0.787 | S | S | * | * | trans | -165 | 110.1 | 155.6 | -162.8 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 209 | S | 49.2 | Very low | 47.8 | Very low | 99 Ų | 99 | 139 Ų | 139 | 69% | 0.692 | 79% | 0.789 | S | S | * | * | trans | -77.7 | 140.4 | 160.6 | -170.2 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 210 | D | 56.1 | Low | 48.4 | Very low | 145 Ų | 145 | 143.6 Ų | 143.6 | 78% | 0.775 | 80% | 0.799 | S | S | * | * | trans | -153.3 | 115.2 | 159.8 | -152.4 | 23 | 0 | 0 | 0 | 109.2 | ||||
| 211 | D | 50 | Low | 49.5 | Very low | 135 Ų | 135 | 147 Ų | 147 | 72% | 0.722 | 80% | 0.802 | S | S | * | * | trans | -96.8 | 126.1 | 170.5 | -78.4 | -63.5 | 0 | 0 | 0 | 106.5 | ||||
| 212 | E | 64 | Low | 50.6 | Low | 176 Ų | 176 | 150.8 Ų | 150.8 | 82% | 0.822 | 80% | 0.802 | S | S | * | * | trans | -144 | 114.7 | 155.3 | -71.3 | -61.2 | 173 | 0 | 0 | 108.9 | ||||
| 213 | D | 53.7 | Low | 51.7 | Low | 162 Ų | 162 | 152.8 Ų | 152.8 | 87% | 0.866 | 81% | 0.805 | S | S | * | * | trans | -76 | 124 | 163.8 | -75.3 | -58.7 | 0 | 0 | 0 | 108.4 | ||||
| 214 | E | 57.5 | Low | 51.6 | Low | 199 Ų | 199 | 150.9 Ų | 150.9 | 93% | 0.93 | 80% | 0.804 | S | S | * | * | trans | -134.9 | 121.7 | 158.6 | -117.5 | 177.8 | -172.4 | 0 | 0 | 111.2 | ||||
| 215 | N | 48.9 | Very low | 52 | Low | 129 Ų | 129 | 150 Ų | 150 | 69% | 0.69 | 79% | 0.793 | S | S | * | * | trans | -73.1 | 132 | 174.1 | 169 | 94.7 | 0 | 0 | 0 | 110 | ||||
| 216 | D | 51.9 | Low | 52.3 | Low | 139 Ų | 139 | 147 Ų | 147 | 74% | 0.743 | 79% | 0.788 | S | S | * | * | trans | -152.9 | 131.5 | 137.6 | -120.7 | -14.7 | 0 | 0 | 0 | 113.4 | ||||
| 217 | D | 54.1 | Low | 52.3 | Low | 142 Ų | 142 | 146.2 Ų | 146.2 | 76% | 0.759 | 78% | 0.782 | S | S | * | * | trans | -81.3 | 112.2 | 170.2 | -93 | -61.7 | 0 | 0 | 0 | 107.7 | ||||
| 218 | D | 52.9 | Low | 51.6 | Low | 143 Ų | 143 | 146.7 Ų | 146.7 | 77% | 0.765 | 79% | 0.785 | S | S | * | * | trans | -118.6 | 113.8 | 169.6 | -54.9 | -21.6 | 0 | 0 | 0 | 110.7 | ||||
| 219 | E | 48.6 | Very low | 51.8 | Low | 195 Ų | 195 | 149.7 Ų | 149.7 | 91% | 0.911 | 79% | 0.785 | S | S | * | * | trans | -67.8 | 118.1 | 172.6 | -57.7 | 173.8 | 130 | 0 | 0 | 110.7 | E221 | E219-E221 PolarHBondContact O-N 3.09Å; E219-E221 VanDerWaalsContact O-N 3.17Å | ||
| 220 | E | 50.8 | Low | 51.1 | Low | 199 Ų | 199 | 151.5 Ų | 151.5 | 93% | 0.93 | 79% | 0.788 | S | S | * | * | trans | -76.5 | 101.1 | 166.9 | -93.4 | -176.6 | 161 | 0 | 0 | 110.4 | ||||
| 221 | E | 58 | Low | 50.1 | Low | 191 Ų | 191 | 152 Ų | 152 | 89% | 0.893 | 79% | 0.785 | S | S | * | * | trans | -67.8 | 126.5 | 168.7 | -171.9 | 176.4 | -174.3 | 0 | 0 | 110.8 | E219 D223 | E219-E221 PolarHBondContact O-N 3.09Å; E219-E221 VanDerWaalsContact O-N 3.17Å; E221-D223 PolarHBondContact O-N 3.42Å | ||
| 222 | I | 57.2 | Low | 49.4 | Very low | 155 Ų | 155 | 152.7 Ų | 152.7 | 80% | 0.795 | 78% | 0.784 | S | S | * | * | trans | -80.2 | 116.9 | 178.8 | -17.4 | 172.6 | 0 | 0 | 0 | 108.9 | V224 | I222-V224 PolarHBondContact O-N 3.07Å; I222-V224 VanDerWaalsContact O-N 3.1Å | ||
| 223 | D | 61 | Low | 48.1 | Very low | 141 Ų | 141 | 150.9 Ų | 150.9 | 75% | 0.754 | 78% | 0.775 | S | S | * | * | trans | -64.9 | 106.1 | 177.7 | -172.4 | 14.3 | 0 | 0 | 0 | 111.4 | E221 V225 | E221-D223 PolarHBondContact O-N 3.42Å; D223-V225 PolarHBondContact O-N 3.38Å; D223-V225 VanDerWaalsContact O-N 3.08Å | ||
| 224 | V | 44 | Very low | 47.3 | Very low | 119 Ų | 119 | 150.1 Ų | 150.1 | 72% | 0.721 | 77% | 0.767 | S | S | * | * | trans | -79 | 87.5 | 174.5 | -175.2 | 0 | 0 | 0 | 0 | 108.3 | I222 T226 | I222-V224 PolarHBondContact O-N 3.07Å; I222-V224 VanDerWaalsContact O-N 3.1Å; V224-T226 PolarHBondContact O-N 2.83Å | ||
| 225 | V | 45.4 | Very low | 46.2 | Very low | 106 Ų | 106 | 148.6 Ų | 148.6 | 64% | 0.642 | 76% | 0.76 | S | S | * | * | trans | -63.8 | 102.1 | 168.4 | -176.5 | 0 | 0 | 0 | 0 | 108.9 | D223 V227 | D223-V225 PolarHBondContact O-N 3.38Å; D223-V225 VanDerWaalsContact O-N 3.08Å; V225-V227 HydrophobicContact CG1-CG1 4.27Å; V225-V227 PolarHBondContact O-N 3.34Å | ||
| 226 | T | 51.4 | Low | 45.9 | Very low | 115 Ų | 115 | 151.4 Ų | 151.4 | 71% | 0.706 | 77% | 0.768 | S | S | * | * | trans | -73.7 | 107.6 | 171.1 | -57.4 | 0 | 0 | 0 | 0 | 108.1 | V224 | V224-T226 PolarHBondContact O-N 2.83Š| ||
| 227 | V | 44.8 | Very low | 45.2 | Very low | 115 Ų | 115 | 154.3 Ų | 154.3 | 70% | 0.697 | 77% | 0.774 | S | S | * | * | trans | -96.3 | 111.2 | 169.1 | -79.5 | 0 | 0 | 0 | 0 | 110.3 | V225 H229 | V225-V227 HydrophobicContact CG1-CG1 4.27Å; V225-V227 PolarHBondContact O-N 3.34Å; V227-H229 PolarHBondContact O-ND1 2.81Å | ||
| 228 | D | 40.4 | Very low | 44.6 | Very low | 159 Ų | 159 | 153.6 Ų | 153.6 | 85% | 0.85 | 78% | 0.778 | S | S | * | * | trans | -63 | 136.9 | 172.6 | -88.4 | -39.5 | 0 | 0 | 0 | 111.8 | ||||
| 229 | H | 48.3 | Very low | 44 | Very low | 179 Ų | 179 | 158.8 Ų | 158.8 | 83% | 0.829 | 79% | 0.786 | S | S | * | * | trans | -86.2 | 131.7 | -178.8 | -71.7 | 51.2 | 0 | 0 | 0 | 111.1 | V227 | V227-H229 PolarHBondContact O-ND1 2.81Š| ||
| 230 | N | 34.8 | Very low | 43.7 | Very low | 138 Ų | 138 | 160.8 Ų | 160.8 | 74% | 0.738 | 79% | 0.785 | S | S | * | * | trans | -157.4 | 110.1 | 143.1 | -136.9 | -9.8 | 0 | 0 | 0 | 114.4 | ||||
| 231 | Q | 34.3 | Very low | 43.5 | Very low | 155 Ų | 155 | 158.9 Ų | 158.9 | 72% | 0.724 | 78% | 0.781 | S | S | * | * | 59.1 | 103.6 | 124.5 | -172.8 | 169.6 | 114.3 | 0 | 0 | 119.7 | |||||
| 232 | Q | 35.4 | Very low | 42.8 | Very low | 149 Ų | 149 | 156.2 Ų | 156.2 | 70% | 0.696 | 78% | 0.778 | S | S | * | * | 176.9 | 146.2 | 94.7 | -120.7 | 171.9 | 28 | 0 | 0 | 112.4 | |||||
| 233 | Q | 37 | Very low | 42.2 | Very low | 138 Ų | 138 | 153.8 Ų | 153.8 | 65% | 0.645 | 77% | 0.77 | S | S | * | * | trans | 79.9 | 106.2 | 145.5 | -80.1 | -179.9 | 66 | 0 | 0 | 119.9 | ||||
| 234 | Q | 35.5 | Very low | 41.7 | Very low | 146 Ų | 146 | 153.7 Ų | 153.7 | 68% | 0.682 | 78% | 0.775 | S | S | * | * | 118.2 | 106.4 | 121.2 | -75.2 | -176.3 | 66.8 | 0 | 0 | 118.2 | |||||
| 235 | Q | 35.8 | Very low | 42.4 | Very low | 168 Ų | 168 | 157.3 Ų | 157.3 | 79% | 0.785 | 78% | 0.775 | S | S | * | * | trans | 93 | 113.1 | 137.5 | -55.9 | -79.8 | -0.4 | 0 | 0 | 118.3 | ||||
| 236 | H | 41.5 | Very low | 43.1 | Very low | 188 Ų | 188 | 161.5 Ų | 161.5 | 87% | 0.87 | 79% | 0.785 | S | S | * | * | trans | -50.5 | 133.4 | 175.2 | -80.4 | -101.1 | 0 | 0 | 0 | 115 | ||||
| 237 | K | 37.8 | Very low | 43.5 | Very low | 199 Ų | 199 | 159.1 Ų | 159.1 | 87% | 0.865 | 77% | 0.772 | S | S | * | * | trans | -138.3 | 134.4 | 142 | -84.8 | -176.9 | -179.8 | 173.3 | 0 | 109.8 | ||||
| 238 | P | 41 | Very low | 44.7 | Very low | 128 Ų | 128 | 157.5 Ų | 157.5 | 83% | 0.831 | 76% | 0.762 | S | S | * | * | trans | -73.3 | 134 | -174.1 | 27.9 | -32.4 | 0 | 0 | 0 | 111.9 | R240 | P238-R240 PolarHBondContact O-N 3.46Š| ||
| 239 | R | 42 | Very low | 46.1 | Very low | 251 Ų | 251 | 152.7 Ų | 152.7 | 95% | 0.947 | 74% | 0.738 | S | S | * | * | trans | -57.8 | 116 | 170.6 | -144.4 | 174.7 | 175.7 | -175.8 | -1.6 | 108.2 | L241 | R239-L241 PolarHBondContact O-N 3.43Å; R239-L241 VanDerWaalsContact O-N 3.12Å | ||
| 240 | R | 41.7 | Very low | 47.1 | Very low | 237 Ų | 237 | 147.9 Ų | 147.9 | 89% | 0.894 | 72% | 0.718 | S | S | * | * | trans | -64.1 | 112.6 | -178.7 | -152.3 | 179.5 | -173.5 | -175.5 | 2.5 | 108.5 | P238 V242 | P238-R240 PolarHBondContact O-N 3.46Å; R240-V242 PolarHBondContact O-N 2.84Å; R240-V242 VanDerWaalsContact O-N 3.15Å | ||
| 241 | L | 45.7 | Very low | 48.6 | Very low | 159 Ų | 159 | 145 Ų | 145 | 83% | 0.832 | 71% | 0.706 | S | S | * | * | trans | -50.3 | 117.8 | 170.1 | -164.9 | 70.9 | 0 | 0 | 0 | 108 | R239 T243 | R239-L241 PolarHBondContact O-N 3.43Å; R239-L241 VanDerWaalsContact O-N 3.12Å; L241-T243 PolarHBondContact O-N 3.41Å | ||
| 242 | V | 44.5 | Very low | 50.1 | Low | 136 Ų | 136 | 141.6 Ų | 141.6 | 82% | 0.824 | 70% | 0.695 | S | S | * | * | trans | -59.8 | 115.4 | 177.7 | -161.6 | 0 | 0 | 0 | 0 | 106.2 | R240 T244 | R240-V242 PolarHBondContact O-N 2.84Å; R240-V242 VanDerWaalsContact O-N 3.15Å; V242-T244 PolarHBondContact O-N 2.9Å; V242-T244 VanDerWaalsContact O-N 3.08Å | ||
| 243 | T | 44.8 | Very low | 51.5 | Low | 103 Ų | 103 | 142.9 Ų | 142.9 | 63% | 0.632 | 69% | 0.693 | S | S | * | * | trans | -59.7 | 116.2 | -177.1 | 40.2 | 0 | 0 | 0 | 0 | 108.6 | L241 R245 | L241-T243 PolarHBondContact O-N 3.41Å; T243-R245 PolarHBondContact O-N 3.48Å | ||
| 244 | T | 48.6 | Very low | 52.6 | Low | 139 Ų | 139 | 141.7 Ų | 141.7 | 85% | 0.853 | 71% | 0.707 | S | S | * | * | trans | -56.2 | 105.3 | 162.3 | 41.3 | 0 | 0 | 0 | 0 | 106.7 | V242 | V242-T244 PolarHBondContact O-N 2.9Å; V242-T244 VanDerWaalsContact O-N 3.08Å | ||
| 245 | R | 59.5 | Low | 53.8 | Low | 196 Ų | 196 | 139.5 Ų | 139.5 | 74% | 0.74 | 70% | 0.7 | S | S | * | * | P | Polyproline II helix | trans | -76 | 131.9 | -174.7 | -73 | -172.8 | 170.6 | -168.9 | -1.9 | 109.2 | T243 | T243-R245 PolarHBondContact O-N 3.48Š|
| 246 | K | 59.7 | Low | 55 | Low | 193 Ų | 193 | 136 Ų | 136 | 84% | 0.839 | 69% | 0.692 | S | S | * | * | P | Polyproline II helix | trans | -65.5 | 126.9 | 178.5 | -66.3 | 177.4 | 177.5 | -179.5 | 0 | 109 | ||
| 247 | P | 60.8 | Low | 56 | Low | 66 Ų | 66 | 135.4 Ų | 135.4 | 43% | 0.429 | 69% | 0.689 | S | S | . | * | P | Polyproline II helix | trans | -62.1 | 141 | 175.6 | 26 | -33.2 | 0 | 0 | 0 | 110 | H265 | P247-H265 HydrophobicContact CB-CB 4.24Š|
| 248 | V | 69.2 | Low | 57.1 | Low | 81 Ų | 81 | 131.1 Ų | 131.1 | 49% | 0.491 | 68% | 0.676 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -79.6 | 125.9 | 177.1 | 178.3 | 0 | 0 | 0 | 0 | 107.6 | I250 I266 | V248-I250 HydrophobicContact CG1-CG1 4.44Å; V248-I266 PolarHBondContact N-O 3.42Å; V248-I266 VanDerWaalsContact N-O 3.17Å; V248-I266 PolarHBondContact O-N 2.89Å |
| 249 | T | 69.8 | Low | 58 | Low | 58 Ų | 58 | 131.1 Ų | 131.1 | 36% | 0.356 | 68% | 0.675 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -97.9 | 119.3 | -179.9 | -42.9 | 0 | 0 | 0 | 0 | 108.7 | R263 F264 H265 | T249-R263 HydrophobicContact CG2-CB 3.85Å; T249-R263 HydrophobicContact CG2-CG 4.14Å; T249-F264 CarbonylContact C-O 3.52Å; T249-F264 WeakPolarHBondContact CA-O 3.44Å; T249-H265 WeakPolarHBondContact CG2-CE1 3.31Å; T249-H265 WeakPolarHBondContact CG2-ND1 3.48Å; T249-H265 PolarHBondContact OG1-CE1 3.02Å; T249-H265 PolarHBondContact OG1-ND1 3.23Å |
| 250 | I | 69.4 | Low | 58.8 | Low | 77 Ų | 77 | 121.4 Ų | 121.4 | 40% | 0.395 | 65% | 0.653 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -104.1 | 125.7 | 173.5 | -51 | -169.9 | 0 | 0 | 0 | 107.9 | V248 V252 F264 I266 | V248-I250 HydrophobicContact CG1-CG1 4.44Å; I250-V252 HydrophobicContact CG2-CG2 4.1Å; I250-F264 PolarHBondContact N-O 3.26Å; I250-F264 PolarHBondContact O-N 3.42Å; I250-I266 HydrophobicContact CB-CD1 4.46Å; I250-I266 HydrophobicContact CD1-CD1 3.47Å; I250-I266 VanDerWaalsContact CD1-CD1 3.47Å; I250-I266 HydrophobicContact CD1-CG1 4.43Å; I250-I266 HydrophobicContact CG1-CD1 3.89Å; I250-I266 HydrophobicContact CG1-CG1 4.39Å |
| 251 | T | 66 | Low | 60 | Low | 79 Ų | 79 | 113.6 Ų | 113.6 | 49% | 0.485 | 63% | 0.632 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -99 | 116.4 | 176.8 | -23.4 | 0 | 0 | 0 | 0 | 107.8 | R263 | T251-R263 HydrophobicContact CG2-CG 3.44Å; T251-R263 VanDerWaalsContact CG2-CG 3.44Å |
| 252 | V | 67.1 | Low | 61.1 | Low | 82 Ų | 82 | 113.3 Ų | 113.3 | 50% | 0.497 | 62% | 0.624 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -110.4 | 133.9 | 178.7 | -175.3 | 0 | 0 | 0 | 0 | 108.5 | I250 K262 | I250-V252 HydrophobicContact CG2-CG2 4.1Å; V252-K262 PolarHBondContact N-O 3.14Å; V252-K262 VanDerWaalsContact N-O 3.14Å |
| 253 | R | 63.9 | Low | 62.2 | Low | 177 Ų | 177 | 114.3 Ų | 114.3 | 67% | 0.668 | 61% | 0.613 | S | S | * | * | trans | -122.8 | 122.8 | 177.7 | 36.8 | -164.8 | -82 | -122 | 1.2 | 107.2 | ||||
| 254 | A | 61.2 | Low | 63.4 | Low | 113 Ų | 113 | 114.9 Ų | 114.9 | 93% | 0.934 | 61% | 0.607 | S | S | * | * | S | Bend | trans | -84.5 | -22 | -175.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | ||
| 255 | D | 60.6 | Low | 64.6 | Low | 100 Ų | 100 | 114.1 Ų | 114.1 | 54% | 0.535 | 59% | 0.594 | S | S | . | * | trans | -151.2 | 143.2 | -176.7 | -159.5 | -6.8 | 0 | 0 | 0 | 110.7 | H257 | D255-H257 VanDerWaalsContact C-N 3.29Å; D255-H257 PolarHBondContact O-N 2.89Å | ||
| 256 | P | 61.3 | Low | 64.9 | Low | 95 Ų | 95 | 108.6 Ų | 108.6 | 62% | 0.617 | 58% | 0.578 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -68.7 | -12.2 | -178.8 | -25.5 | 37.6 | 0 | 0 | 0 | 116.9 | ||
| 257 | H | 60.8 | Low | 65 | Low | 174 Ų | 174 | 103.5 Ų | 103.5 | 81% | 0.806 | 57% | 0.567 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -113.1 | 3.8 | -173.2 | -64.2 | 86.4 | 0 | 0 | 0 | 115.6 | D255 | D255-H257 VanDerWaalsContact C-N 3.29Å; D255-H257 PolarHBondContact O-N 2.89Å |
| 258 | D | 61.2 | Low | 65 | Low | 110 Ų | 110 | 106 Ų | 106 | 59% | 0.588 | 58% | 0.575 | S | S | * | * | trans | -97.7 | 125.1 | 175.1 | -177.6 | 19.4 | 0 | 0 | 0 | 111 | G260 | D258-G260 PolarHBondContact O-N 3.49Å; D258-G260 PolarHBondContact OD1-N 3.38Å | ||
| 259 | P | 59.9 | Low | 64.7 | Low | 127 Ų | 127 | 110.5 Ų | 110.5 | 83% | 0.825 | 59% | 0.591 | S | S | * | * | trans | -70.8 | -6.2 | -179.8 | 24.9 | -32.3 | 0 | 0 | 0 | 114.7 | T261 | P259-T261 PolarHBondContact O-N 3.06Š| ||
| 260 | G | 59.7 | Low | 64.3 | Low | 47 Ų | 47 | 114.4 Ų | 114.4 | 49% | 0.485 | 61% | 0.605 | S | S | . | * | trans | -84.3 | 84.2 | -177 | 0 | 0 | 0 | 0 | 0 | 115.3 | D258 K262 | D258-G260 PolarHBondContact O-N 3.49Å; D258-G260 PolarHBondContact OD1-N 3.38Å; G260-K262 PolarHBondContact O-N 3.32Å | ||
| 261 | T | 66.4 | Low | 63.6 | Low | 74 Ų | 74 | 118.6 Ų | 118.6 | 45% | 0.454 | 62% | 0.623 | S | S | . | * | P | Polyproline II helix | trans | -77 | 120.8 | 171.6 | 58.9 | 0 | 0 | 0 | 0 | 112 | P259 | P259-T261 PolarHBondContact O-N 3.06Š|
| 262 | K | 68.7 | Low | 63.1 | Low | 152 Ų | 152 | 121.6 Ų | 121.6 | 66% | 0.661 | 63% | 0.631 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -93.8 | 123.3 | 173.4 | -69.9 | -173.9 | 179.8 | -179.3 | 0 | 110.2 | V252 G260 F264 | V252-K262 PolarHBondContact N-O 3.14Å; V252-K262 VanDerWaalsContact N-O 3.14Å; G260-K262 PolarHBondContact O-N 3.32Å; K262-F264 HydrophobicContact CB-CE2 3.86Å; K262-F264 HydrophobicContact CB-CZ 4.04Å |
| 263 | R | 66.8 | Low | 62.1 | Low | 158 Ų | 158 | 123.7 Ų | 123.7 | 60% | 0.596 | 64% | 0.636 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -101.5 | 129.8 | 178 | -76.6 | -169.8 | -61.4 | -89.6 | 3 | 110.2 | T249 T251 | T249-R263 HydrophobicContact CG2-CB 3.85Å; T249-R263 HydrophobicContact CG2-CG 4.14Å; T251-R263 HydrophobicContact CG2-CG 3.44Å; T251-R263 VanDerWaalsContact CG2-CG 3.44Å |
| 264 | F | 70.4 | Confident | 61.9 | Low | 114 Ų | 114 | 121.5 Ų | 121.5 | 50% | 0.5 | 64% | 0.637 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -116.4 | 128.9 | 176.5 | -59.8 | -84.4 | 0 | 0 | 0 | 109.4 | T249 I250 K262 | T249-F264 CarbonylContact C-O 3.52Å; T249-F264 WeakPolarHBondContact CA-O 3.44Å; I250-F264 PolarHBondContact N-O 3.26Å; I250-F264 PolarHBondContact O-N 3.42Å; K262-F264 HydrophobicContact CB-CE2 3.86Å; K262-F264 HydrophobicContact CB-CZ 4.04Å |
| 265 | H | 73.3 | Confident | 61.4 | Low | 123 Ų | 123 | 126.3 Ų | 126.3 | 57% | 0.569 | 63% | 0.633 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -96.5 | 117.5 | 175.6 | -64.2 | -75.9 | 0 | 0 | 0 | 108.6 | P247 T249 | P247-H265 HydrophobicContact CB-CB 4.24Å; T249-H265 WeakPolarHBondContact CG2-CE1 3.31Å; T249-H265 WeakPolarHBondContact CG2-ND1 3.48Å; T249-H265 PolarHBondContact OG1-CE1 3.02Å; T249-H265 PolarHBondContact OG1-ND1 3.23Å |
| 266 | I | 66.4 | Low | 61 | Low | 80 Ų | 80 | 125.6 Ų | 125.6 | 41% | 0.41 | 64% | 0.64 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -118 | 125.9 | -178.6 | -18.9 | 175.5 | 0 | 0 | 0 | 109.2 | V248 I250 I268 | V248-I266 PolarHBondContact N-O 3.42Å; V248-I266 VanDerWaalsContact N-O 3.17Å; V248-I266 PolarHBondContact O-N 2.89Å; I250-I266 HydrophobicContact CB-CD1 4.46Å; I250-I266 HydrophobicContact CD1-CD1 3.47Å; I250-I266 VanDerWaalsContact CD1-CD1 3.47Å; I250-I266 HydrophobicContact CD1-CG1 4.43Å; I250-I266 HydrophobicContact CG1-CD1 3.89Å; I250-I266 HydrophobicContact CG1-CG1 4.39Å; I266-I268 PolarHBondContact O-N 3.2Å |
| 267 | S | 62.3 | Low | 60.7 | Low | 87 Ų | 87 | 124.4 Ų | 124.4 | 61% | 0.608 | 64% | 0.639 | S | S | * | * | trans | -89 | 99.4 | 173.4 | -65.3 | 0 | 0 | 0 | 0 | 108.8 | H269 | S267-H269 PolarHBondContact O-N 3.43Š| ||
| 268 | I | 60.8 | Low | 60.3 | Low | 117 Ų | 117 | 122 Ų | 122 | 60% | 0.6 | 64% | 0.638 | S | S | * | * | trans | -81.9 | 107.5 | 178.6 | -54.6 | 179.3 | 0 | 0 | 0 | 108.9 | I266 Q270 | I266-I268 PolarHBondContact O-N 3.2Å; I268-Q270 PolarHBondContact O-N 3.08Å | ||
| 269 | H | 62.1 | Low | 59.3 | Low | 177 Ų | 177 | 121.7 Ų | 121.7 | 82% | 0.819 | 65% | 0.645 | S | S | * | * | trans | -77.7 | 93.6 | 167.5 | -77 | -87.2 | 0 | 0 | 0 | 109.2 | S267 Q271 | S267-H269 PolarHBondContact O-N 3.43Å; H269-Q271 PolarHBondContact O-N 2.96Å; H269-Q271 VanDerWaalsContact O-N 3.09Å | ||
| 270 | Q | 61.1 | Low | 58.9 | Low | 140 Ų | 140 | 121.7 Ų | 121.7 | 65% | 0.654 | 65% | 0.645 | S | S | * | * | trans | -71.3 | 99.4 | 162.5 | -86.5 | -179.3 | 21 | 0 | 0 | 108.3 | I268 Q272 | I268-Q270 PolarHBondContact O-N 3.08Å; Q270-Q272 VanDerWaalsContact C-N 3.27Å; Q270-Q272 HydrophobicContact CB-CG 4.39Å; Q270-Q272 PolarHBondContact O-N 3.45Å | ||
| 271 | Q | 55.4 | Low | 58.3 | Low | 164 Ų | 164 | 126.4 Ų | 126.4 | 77% | 0.766 | 66% | 0.659 | S | S | * | * | trans | -62.1 | 98.8 | 152.7 | -93.9 | 176.2 | -8.7 | 0 | 0 | 106.8 | H269 H273 | H269-Q271 PolarHBondContact O-N 2.96Å; H269-Q271 VanDerWaalsContact O-N 3.09Å; Q271-H273 VanDerWaalsContact C-N 3.32Å; Q271-H273 PolarHBondContact O-N 3.37Å | ||
| 272 | Q | 55.9 | Low | 57 | Low | 143 Ų | 143 | 129.3 Ų | 129.3 | 67% | 0.668 | 68% | 0.677 | S | S | * | * | trans | -71.9 | 92 | 172.2 | -64.8 | -170.6 | -31.3 | 0 | 0 | 107.8 | Q270 N274 | Q270-Q272 VanDerWaalsContact C-N 3.27Å; Q270-Q272 HydrophobicContact CB-CG 4.39Å; Q270-Q272 PolarHBondContact O-N 3.45Å; Q272-N274 PolarHBondContact O-N 2.95Å; Q272-N274 VanDerWaalsContact O-N 3.14Å | ||
| 273 | H | 46.4 | Very low | 55.7 | Low | 126 Ų | 126 | 129.9 Ų | 129.9 | 58% | 0.583 | 69% | 0.686 | S | S | * | * | trans | -70.3 | 106.9 | 159.2 | -71.2 | -72.2 | 0 | 0 | 0 | 107.6 | Q271 Y275 | Q271-H273 VanDerWaalsContact C-N 3.32Å; Q271-H273 PolarHBondContact O-N 3.37Å; H273-Y275 VanDerWaalsContact C-N 3.29Å; H273-Y275 HydrophobicContact CB-CD2 3.6Å; H273-Y275 HydrophobicContact CB-CE2 3.32Å; H273-Y275 WeakPolarHBondContact O-CD2 3.41Å; H273-Y275 PolarHBondContact O-N 3.49Å | ||
| 274 | N | 58.4 | Low | 54.5 | Low | 130 Ų | 130 | 128.4 Ų | 128.4 | 70% | 0.695 | 70% | 0.697 | S | S | * | * | trans | -78.9 | 77.9 | -178.7 | -153 | -19.3 | 0 | 0 | 0 | 109 | Q272 A276 | Q272-N274 PolarHBondContact O-N 2.95Å; Q272-N274 VanDerWaalsContact O-N 3.14Å; N274-A276 PolarHBondContact O-N 3.15Å; N274-A276 VanDerWaalsContact O-N 3.07Å | ||
| 275 | Y | 52.2 | Low | 53 | Low | 215 Ų | 215 | 127.7 Ų | 127.7 | 84% | 0.843 | 71% | 0.712 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.5 | 13.9 | -177.6 | -82.9 | -80.2 | 0 | 0 | 0 | 114.6 | H273 | H273-Y275 VanDerWaalsContact C-N 3.29Å; H273-Y275 HydrophobicContact CB-CD2 3.6Å; H273-Y275 HydrophobicContact CB-CE2 3.32Å; H273-Y275 WeakPolarHBondContact O-CD2 3.41Å; H273-Y275 PolarHBondContact O-N 3.49Å |
| 276 | A | 52.3 | Low | 51.2 | Low | 84 Ų | 84 | 129.5 Ų | 129.5 | 69% | 0.694 | 73% | 0.726 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -128.7 | 18.1 | -178.1 | 0 | 0 | 0 | 0 | 0 | 114.1 | N274 P278 | N274-A276 PolarHBondContact O-N 3.15Å; N274-A276 VanDerWaalsContact O-N 3.07Å; A276-P278 WeakPolarHBondContact O-CD 3.35Å |
| 277 | A | 55.2 | Low | 50.2 | Low | 71 Ų | 71 | 131.1 Ų | 131.1 | 59% | 0.587 | 74% | 0.742 | S | S | * | * | P | Polyproline II helix | trans | -77.1 | 125.3 | 170.8 | 0 | 0 | 0 | 0 | 0 | 110 | ||
| 278 | P | 51.6 | Low | 49 | Very low | 123 Ų | 123 | 135.6 Ų | 135.6 | 80% | 0.799 | 75% | 0.753 | S | S | * | * | P | Polyproline II helix | trans | -59.9 | 140.2 | 171.1 | -19.3 | 31.4 | 0 | 0 | 0 | 111 | A276 | A276-P278 WeakPolarHBondContact O-CD 3.35Š|
| 279 | S | 39.1 | Very low | 47.9 | Very low | 103 Ų | 103 | 135 Ų | 135 | 72% | 0.72 | 76% | 0.757 | S | S | * | * | P | Polyproline II helix | trans | -60.3 | 139.3 | 179.3 | -53.3 | 0 | 0 | 0 | 0 | 111.8 | D281 | S279-D281 VanDerWaalsContact C-N 3.27Å; S279-D281 PolarHBondContact O-N 3.39Å |
| 280 | P | 52.4 | Low | 46.5 | Very low | 127 Ų | 127 | 131.4 Ų | 131.4 | 83% | 0.825 | 76% | 0.758 | S | S | * | * | S | Bend | trans | -84.6 | 73.2 | 179.2 | 36.3 | -31.2 | 0 | 0 | 0 | 109.1 | ||
| 281 | D | 47 | Very low | 45.6 | Very low | 146 Ų | 146 | 136.6 Ų | 136.6 | 78% | 0.781 | 77% | 0.772 | S | S | * | * | trans | -140.6 | 84.1 | 168.2 | -93.3 | -35.7 | 0 | 0 | 0 | 109.4 | S279 | S279-D281 VanDerWaalsContact C-N 3.27Å; S279-D281 PolarHBondContact O-N 3.39Å | ||
| 282 | T | 39.9 | Very low | 44.9 | Very low | 136 Ų | 136 | 138 Ų | 138 | 83% | 0.834 | 78% | 0.775 | S | S | * | * | trans | -150.2 | 103.4 | 151.7 | -34.4 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 283 | L | 39.8 | Very low | 44 | Very low | 164 Ų | 164 | 140.5 Ų | 140.5 | 86% | 0.859 | 78% | 0.784 | S | S | * | * | P | Polyproline II helix | trans | -57.9 | 131.5 | 168.1 | -66.5 | 168.6 | 0 | 0 | 0 | 109 | A285 | L283-A285 PolarHBondContact O-N 3.4Š|
| 284 | P | 43 | Very low | 43.4 | Very low | 127 Ų | 127 | 140.8 Ų | 140.8 | 83% | 0.825 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -77.2 | 119.4 | 171.6 | 28.1 | -27.2 | 0 | 0 | 0 | 109.4 | ||
| 285 | A | 37.8 | Very low | 42.2 | Very low | 99 Ų | 99 | 144.1 Ų | 144.1 | 82% | 0.818 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -74.5 | 135.8 | 159.3 | 0 | 0 | 0 | 0 | 0 | 108.9 | L283 | L283-A285 PolarHBondContact O-N 3.4Š|
| 286 | D | 36 | Very low | 41.3 | Very low | 161 Ų | 161 | 141.5 Ų | 141.5 | 86% | 0.861 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -55.1 | 159.3 | 180 | -107.5 | -36.1 | 0 | 0 | 0 | 114.1 | ||
| 287 | P | 45.2 | Very low | 40.2 | Very low | 114 Ų | 114 | 141.2 Ų | 141.2 | 74% | 0.74 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -87.6 | 136.3 | -162.4 | 34.4 | -34.3 | 0 | 0 | 0 | 114.1 | ||
| 288 | E | 36.5 | Very low | 39.3 | Very low | 181 Ų | 181 | 144.4 Ų | 144.4 | 85% | 0.846 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -98.1 | 138.2 | 161.3 | -96.6 | -77.5 | 132.3 | 0 | 0 | 110.2 | ||
| 289 | P | 38.2 | Very low | 39.2 | Very low | 104 Ų | 104 | 144.1 Ų | 144.1 | 68% | 0.675 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -79.5 | 135.1 | -164.5 | 30.1 | -33.9 | 0 | 0 | 0 | 113.9 | R291 | P289-R291 PolarHBondContact O-N 3.35Š|
| 290 | A | 33.5 | Very low | 38.9 | Very low | 102 Ų | 102 | 143.5 Ų | 143.5 | 84% | 0.843 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -65.8 | 118.1 | 178 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||
| 291 | R | 40.7 | Very low | 38.8 | Very low | 249 Ų | 249 | 143.2 Ų | 143.2 | 94% | 0.94 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -79.8 | 145.4 | 161.1 | -77.7 | 176.8 | 150 | -131.9 | -1.3 | 110.9 | P289 | P289-R291 PolarHBondContact O-N 3.35Š|
| 292 | K | 41.1 | Very low | 38 | Very low | 192 Ų | 192 | 140.6 Ų | 140.6 | 84% | 0.835 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -70.6 | 140.3 | -165.8 | -66.1 | 165.7 | 177.3 | 170.8 | 0 | 114.4 | ||
| 293 | K | 37.4 | Very low | 37.8 | Very low | 196 Ų | 196 | 141.2 Ų | 141.2 | 85% | 0.852 | 81% | 0.809 | S | S | * | * | trans | 70.2 | 140.7 | 135.8 | -77.1 | 177.9 | 168 | 179.4 | 0 | 121 | ||||
| 294 | V | 33.4 | Very low | 37.5 | Very low | 132 Ų | 132 | 142.1 Ų | 142.1 | 80% | 0.8 | 81% | 0.809 | S | S | * | * | trans | 125.1 | 84 | 138.5 | -172.7 | 0 | 0 | 0 | 0 | 115 | ||||
| 295 | R | 33.3 | Very low | 37.8 | Very low | 200 Ų | 200 | 140.5 Ų | 140.5 | 76% | 0.755 | 80% | 0.798 | S | S | * | * | 38.3 | 124.7 | 116.6 | -160.7 | 171.5 | -171.5 | -168.2 | 1 | 121.7 | |||||
| 296 | Q | 34.1 | Very low | 37.6 | Very low | 161 Ų | 161 | 145.6 Ų | 145.6 | 75% | 0.752 | 81% | 0.805 | S | S | * | * | trans | 73.7 | 132.2 | 142.6 | -85.8 | 173.8 | -22.3 | 0 | 0 | 122.7 | ||||
| 297 | G | 29.3 | Very low | 37.6 | Very low | 77 Ų | 77 | 148.1 Ų | 148.1 | 79% | 0.794 | 80% | 0.802 | S | S | * | * | trans | 144.6 | 98.1 | 133.2 | 0 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 298 | V | 35.2 | Very low | 37 | Very low | 138 Ų | 138 | 149.1 Ų | 149.1 | 84% | 0.836 | 80% | 0.801 | S | S | * | * | trans | -88.6 | 169.7 | 166 | 172.1 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 299 | P | 49.8 | Very low | 36.9 | Very low | 118 Ų | 118 | 145.1 Ų | 145.1 | 77% | 0.766 | 79% | 0.793 | S | S | * | * | cis | -128.6 | -177.4 | -15.8 | 25.7 | -2.3 | 0 | 0 | 0 | 115.8 | ||||
| 300 | A | 33.4 | Very low | 36.7 | Very low | 90 Ų | 90 | 147.2 Ų | 147.2 | 74% | 0.744 | 80% | 0.798 | S | S | * | * | trans | -37.1 | -178.2 | 164.5 | 0 | 0 | 0 | 0 | 0 | 118.4 | ||||
| 301 | P | 49.5 | Very low | 36.6 | Very low | 121 Ų | 121 | 149.7 Ų | 149.7 | 79% | 0.786 | 79% | 0.792 | S | S | * | * | cis | -149.2 | 175.9 | 16.2 | 41.5 | -18.6 | 0 | 0 | 0 | 119.9 | ||||
| 302 | A | 31.5 | Very low | 36.1 | Very low | 90 Ų | 90 | 144.6 Ų | 144.6 | 74% | 0.744 | 78% | 0.783 | S | S | * | * | trans | 57.2 | 120.7 | 142.2 | 0 | 0 | 0 | 0 | 0 | 123 | ||||
| 303 | T | 34.1 | Very low | 35.7 | Very low | 150 Ų | 150 | 143.5 Ų | 143.5 | 92% | 0.92 | 78% | 0.781 | S | S | * | * | trans | -162.3 | 135.8 | 130.8 | -6.7 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 304 | Q | 34.9 | Very low | 36.1 | Very low | 182 Ų | 182 | 139.8 Ų | 139.8 | 85% | 0.85 | 78% | 0.777 | S | S | * | * | trans | -90.9 | -157.7 | 171.9 | -66.8 | -163.9 | -17 | 0 | 0 | 111 | ||||
| 305 | P | 49.8 | Very low | 36 | Very low | 94 Ų | 94 | 144.4 Ų | 144.4 | 61% | 0.61 | 78% | 0.78 | S | S | * | * | -120.3 | 165.3 | -91.6 | 37 | -20.3 | 0 | 0 | 0 | 112.1 | |||||
| 306 | H | 33.5 | Very low | 37 | Very low | 206 Ų | 206 | 140.2 Ų | 140.2 | 95% | 0.954 | 78% | 0.779 | S | S | * | * | trans | -157.9 | 169.9 | 157.7 | -94.3 | -62.6 | 0 | 0 | 0 | 113.3 | ||||
| 307 | R | 35.5 | Very low | 36.7 | Very low | 214 Ų | 214 | 135.6 Ų | 135.6 | 81% | 0.808 | 77% | 0.774 | S | S | * | * | trans | -117.4 | 170.3 | -137.5 | -133.7 | -174.4 | 164.2 | -143.6 | -2.7 | 112.5 | ||||
| 308 | N | 32.1 | Very low | 36.9 | Very low | 134 Ų | 134 | 141.3 Ų | 141.3 | 72% | 0.717 | 78% | 0.78 | S | S | * | * | trans | 85.6 | 155.8 | 155.3 | -53.3 | -22.7 | 0 | 0 | 0 | 118.1 | ||||
| 309 | S | 34.2 | Very low | 36.8 | Very low | 97 Ų | 97 | 138.9 Ų | 138.9 | 68% | 0.678 | 78% | 0.775 | S | S | * | * | cis | 177.9 | 143.1 | -31.9 | -160 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 310 | L | 34.1 | Very low | 37 | Very low | 148 Ų | 148 | 138.6 Ų | 138.6 | 78% | 0.775 | 77% | 0.773 | S | S | * | * | trans | 80.6 | 138.7 | 149 | -71.3 | 154.6 | 0 | 0 | 0 | 125.2 | ||||
| 311 | H | 32.7 | Very low | 37 | Very low | 155 Ų | 155 | 142.6 Ų | 142.6 | 72% | 0.718 | 78% | 0.781 | S | S | * | * | trans | 90.2 | 109.7 | 142.8 | -97.9 | 46.6 | 0 | 0 | 0 | 121.2 | ||||
| 312 | N | 29.3 | Very low | 36.1 | Very low | 142 Ų | 142 | 143.1 Ų | 143.1 | 76% | 0.759 | 78% | 0.777 | S | S | * | * | 163.5 | 139.8 | 90.5 | -102.9 | -13.3 | 0 | 0 | 0 | 113.9 | |||||
| 313 | Q | 33.6 | Very low | 36.4 | Very low | 169 Ų | 169 | 147 Ų | 147 | 79% | 0.79 | 78% | 0.784 | S | S | * | * | trans | -86.6 | -179.3 | 157.4 | -80.3 | -84.6 | 37.3 | 0 | 0 | 109.1 | ||||
| 314 | P | 45.4 | Very low | 36.3 | Very low | 117 Ų | 117 | 146.8 Ų | 146.8 | 76% | 0.76 | 78% | 0.778 | S | S | * | * | cis | -145.1 | 175.6 | 16.3 | 36.3 | -11.9 | 0 | 0 | 0 | 119.1 | ||||
| 315 | R | 31.7 | Very low | 36.2 | Very low | 230 Ų | 230 | 150.2 Ų | 150.2 | 87% | 0.868 | 78% | 0.782 | S | S | * | * | trans | -10.4 | -177.2 | 148.4 | -111.4 | -176.8 | 155.8 | -177.5 | -4.5 | 121.3 | ||||
| 316 | P | 53.4 | Low | 35.4 | Very low | 112 Ų | 112 | 156.4 Ų | 156.4 | 73% | 0.727 | 79% | 0.794 | S | S | * | * | cis | -145.7 | -173.8 | -15.1 | 36.8 | -14.5 | 0 | 0 | 0 | 117.4 | ||||
| 317 | G | 27.9 | Very low | 35.2 | Very low | 64 Ų | 64 | 157 Ų | 157 | 66% | 0.66 | 79% | 0.787 | S | S | * | * | trans | 112.5 | 146.4 | 148.4 | 0 | 0 | 0 | 0 | 0 | 116.6 | ||||
| 318 | H | 33.3 | Very low | 35.1 | Very low | 196 Ų | 196 | 151.2 Ų | 151.2 | 91% | 0.907 | 78% | 0.78 | S | S | * | * | cis | -165.3 | 156.3 | 5 | -90.3 | -84.4 | 0 | 0 | 0 | 109.9 | ||||
| 319 | A | 32.8 | Very low | 35.1 | Very low | 88 Ų | 88 | 152.5 Ų | 152.5 | 73% | 0.727 | 78% | 0.782 | S | S | * | * | trans | -89.5 | -171.8 | 160.7 | 0 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 320 | P | 53.4 | Low | 34.8 | Very low | 112 Ų | 112 | 152.8 Ų | 152.8 | 73% | 0.727 | 78% | 0.784 | S | S | * | * | cis | -145.7 | -171.1 | 12.5 | 40.2 | -17.1 | 0 | 0 | 0 | 115.6 | ||||
| 321 | L | 33.7 | Very low | 34.7 | Very low | 174 Ų | 174 | 152.3 Ų | 152.3 | 91% | 0.911 | 79% | 0.787 | S | S | * | * | 176.4 | 153.9 | 121.9 | -88.1 | 177 | 0 | 0 | 0 | 112.7 | |||||
| 322 | N | 30.8 | Very low | 34.6 | Very low | 131 Ų | 131 | 149.2 Ų | 149.2 | 70% | 0.701 | 79% | 0.788 | S | S | * | * | trans | -114.7 | 154.1 | -161.4 | -156.2 | -33.4 | 0 | 0 | 0 | 110 | ||||
| 323 | L | 38 | Very low | 34.6 | Very low | 172 Ų | 172 | 147.8 Ų | 147.8 | 90% | 0.901 | 80% | 0.796 | S | S | * | * | trans | -153.6 | 121.2 | 157.3 | -133 | 98.7 | 0 | 0 | 0 | 111.9 | ||||
| 324 | D | 32.6 | Very low | 34.3 | Very low | 146 Ų | 146 | 143 Ų | 143 | 78% | 0.781 | 79% | 0.793 | S | S | * | * | trans | -65.8 | 146.9 | 170.8 | -74.5 | -74.9 | 0 | 0 | 0 | 113.7 | ||||
| 325 | R | 31.9 | Very low | 33.8 | Very low | 253 Ų | 253 | 144.1 Ų | 144.1 | 96% | 0.955 | 80% | 0.797 | S | S | * | * | trans | -152.3 | 122.8 | 138.8 | -150.1 | 172 | -175.3 | -152.5 | 2.5 | 114.6 | ||||
| 326 | R | 33.8 | Very low | 33.7 | Very low | 224 Ų | 224 | 143.5 Ų | 143.5 | 85% | 0.845 | 79% | 0.794 | S | S | * | * | trans | -68.2 | 138.6 | 172.5 | -170.9 | -164.6 | -60.8 | -118.3 | 3.8 | 112.8 | ||||
| 327 | R | 29.8 | Very low | 32.8 | Very low | 218 Ų | 218 | 143.3 Ų | 143.3 | 82% | 0.823 | 80% | 0.795 | S | S | * | * | trans | -166.3 | 113.9 | 139.8 | -174.5 | 165.9 | -97.6 | -116.3 | -5.2 | 112.2 | H329 | R327-H329 PolarHBondContact NH1-NE2 2.99Š| ||
| 328 | S | 32.2 | Very low | 32.9 | Very low | 94 Ų | 94 | 149 Ų | 149 | 66% | 0.657 | 81% | 0.805 | S | S | * | * | trans | -73.6 | 150.6 | 166.6 | -17.6 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 329 | H | 32.1 | Very low | 33.1 | Very low | 161 Ų | 161 | 144.8 Ų | 144.8 | 75% | 0.745 | 80% | 0.798 | S | S | * | * | trans | -160.2 | 147.4 | 141.2 | -71.1 | -53 | 0 | 0 | 0 | 110.4 | R327 | R327-H329 PolarHBondContact NH1-NE2 2.99Š| ||
| 330 | S | 29.4 | Very low | 33.9 | Very low | 103 Ų | 103 | 146.7 Ų | 146.7 | 72% | 0.72 | 80% | 0.803 | S | S | * | * | trans | -108.5 | 176.4 | -162.5 | 45.4 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 331 | T | 31.3 | Very low | 32.7 | Very low | 137 Ų | 137 | 148.4 Ų | 148.4 | 84% | 0.84 | 81% | 0.805 | S | S | * | * | trans | 91.4 | 150.9 | 162 | 74.6 | 0 | 0 | 0 | 0 | 117.6 | ||||
| 332 | A | 30.1 | Very low | 32.9 | Very low | 90 Ų | 90 | 148.6 Ų | 148.6 | 74% | 0.744 | 81% | 0.807 | S | S | * | * | cis | 178.7 | 145.8 | -32.5 | 0 | 0 | 0 | 0 | 0 | 107.3 | ||||
| 333 | A | 28.9 | Very low | 32.9 | Very low | 112 Ų | 112 | 148 Ų | 148 | 93% | 0.926 | 81% | 0.812 | S | S | * | * | trans | 75.4 | 139.7 | 149.2 | 0 | 0 | 0 | 0 | 0 | 123.8 | ||||
| 334 | G | 28.6 | Very low | 32.7 | Very low | 70 Ų | 70 | 144.1 Ų | 144.1 | 72% | 0.722 | 81% | 0.805 | S | S | * | * | trans | 122.3 | 86.6 | 156.1 | 0 | 0 | 0 | 0 | 0 | 114 | ||||
| 335 | V | 34.2 | Very low | 32.7 | Very low | 139 Ų | 139 | 142.9 Ų | 142.9 | 84% | 0.842 | 81% | 0.808 | S | S | * | * | 56.1 | 117.5 | 73.9 | -161.4 | 0 | 0 | 0 | 0 | 116.3 | |||||
| 336 | R | 30.2 | Very low | 33 | Very low | 218 Ų | 218 | 136.7 Ų | 136.7 | 82% | 0.823 | 80% | 0.803 | S | S | * | * | trans | 131.9 | 109.6 | 152.2 | -78.2 | 177.1 | 159.4 | -107.9 | -1.3 | 110.6 | ||||
| 337 | S | 34 | Very low | 33.7 | Very low | 107 Ų | 107 | 131.9 Ų | 131.9 | 75% | 0.748 | 80% | 0.801 | S | S | * | * | 64.5 | 104.9 | 70.4 | -62.9 | 0 | 0 | 0 | 0 | 113.9 | |||||
| 338 | E | 30.7 | Very low | 33.8 | Very low | 185 Ų | 185 | 127.9 Ų | 127.9 | 86% | 0.864 | 80% | 0.801 | S | S | * | * | 175.4 | 134.2 | 117.4 | -101.1 | -179.1 | 89.5 | 0 | 0 | 112 | |||||
| 339 | S | 36 | Very low | 33.9 | Very low | 107 Ų | 107 | 129 Ų | 129 | 75% | 0.748 | 81% | 0.809 | S | S | * | * | trans | -94.5 | 164.6 | 158.5 | -54.1 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 340 | P | 49.4 | Very low | 34 | Very low | 128 Ų | 128 | 127 Ų | 127 | 83% | 0.831 | 81% | 0.813 | S | S | * | * | -142.5 | 149.8 | 114 | 29.8 | -12.4 | 0 | 0 | 0 | 115.5 | |||||
| 341 | N | 30.1 | Very low | 34.2 | Very low | 147 Ų | 147 | 127.8 Ų | 127.8 | 79% | 0.786 | 82% | 0.819 | S | S | * | * | trans | -71.3 | 147.5 | 160.5 | -78.9 | -51.9 | 0 | 0 | 0 | 110.8 | ||||
| 342 | L | 36 | Very low | 34.4 | Very low | 179 Ų | 179 | 127 Ų | 127 | 94% | 0.937 | 82% | 0.819 | S | S | * | * | trans | -141.8 | 126.4 | 148.8 | -74.3 | 179.9 | 0 | 0 | 0 | 110.9 | ||||
| 343 | S | 32.7 | Very low | 35.2 | Very low | 117 Ų | 117 | 128.9 Ų | 128.9 | 82% | 0.818 | 82% | 0.824 | S | S | * | * | trans | -93.7 | 143.3 | 170.5 | -48.6 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 344 | A | 32 | Very low | 35.4 | Very low | 91 Ų | 91 | 129.1 Ų | 129.1 | 75% | 0.752 | 82% | 0.819 | S | S | * | * | trans | 176.1 | 110.7 | 148.5 | 0 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 345 | S | 33.7 | Very low | 36 | Very low | 121 Ų | 121 | 131.3 Ų | 131.3 | 85% | 0.846 | 82% | 0.823 | S | S | * | * | 68.7 | 102.7 | 84.7 | -58.6 | 0 | 0 | 0 | 0 | 114.1 | |||||
| 346 | S | 37 | Very low | 36.8 | Very low | 122 Ų | 122 | 130.4 Ų | 130.4 | 85% | 0.853 | 82% | 0.82 | S | S | * | * | trans | -66.3 | 161.7 | 167.1 | -45.3 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 347 | P | 48.8 | Very low | 37.7 | Very low | 123 Ų | 123 | 126 Ų | 126 | 80% | 0.799 | 82% | 0.82 | S | S | * | * | trans | -129 | 151.1 | 135 | 35.1 | -24.4 | 0 | 0 | 0 | 113.8 | ||||
| 348 | T | 32.1 | Very low | 37.6 | Very low | 134 Ų | 134 | 126.9 Ų | 126.9 | 82% | 0.822 | 83% | 0.825 | S | S | * | * | trans | -70.2 | 144.7 | 174.7 | 53.2 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 349 | S | 34.1 | Very low | 37.9 | Very low | 118 Ų | 118 | 123.9 Ų | 123.9 | 83% | 0.825 | 83% | 0.825 | S | S | * | * | trans | -169.3 | 121 | 138.2 | 50.7 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 350 | S | 35 | Very low | 37.8 | Very low | 119 Ų | 119 | 124.1 Ų | 124.1 | 83% | 0.832 | 83% | 0.827 | S | S | * | * | trans | -67.9 | 140.3 | 166.1 | 48.1 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 351 | S | 33.4 | Very low | 37.2 | Very low | 120 Ų | 120 | 123.5 Ų | 123.5 | 84% | 0.839 | 83% | 0.825 | S | S | * | * | trans | -152.1 | 123.8 | 154 | 47 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 352 | S | 36.5 | Very low | 37.3 | Very low | 120 Ų | 120 | 121.5 Ų | 121.5 | 84% | 0.839 | 82% | 0.823 | S | S | * | * | P | Polyproline II helix | trans | -95.9 | 144.4 | 168.5 | -55.4 | 0 | 0 | 0 | 0 | 108.8 | ||
| 353 | P | 46 | Very low | 37.3 | Very low | 130 Ų | 130 | 118 Ų | 118 | 84% | 0.844 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -94.9 | 140.2 | 171.1 | 33.3 | -28.9 | 0 | 0 | 0 | 112.7 | ||
| 354 | S | 33.4 | Very low | 37.5 | Very low | 117 Ų | 117 | 117.6 Ų | 117.6 | 82% | 0.818 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -84.7 | 145.8 | 174.6 | 46.2 | 0 | 0 | 0 | 0 | 112.9 | ||
| 355 | S | 41.8 | Very low | 37.7 | Very low | 115 Ų | 115 | 117.5 Ų | 117.5 | 80% | 0.804 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -66 | 157.4 | 173.9 | -49 | 0 | 0 | 0 | 0 | 114.2 | ||
| 356 | P | 50.7 | Low | 37.9 | Very low | 121 Ų | 121 | 120.1 Ų | 120.1 | 79% | 0.786 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -90.1 | 161.5 | 176.3 | 35.8 | -33.4 | 0 | 0 | 0 | 113.6 | ||
| 357 | P | 48.9 | Very low | 38 | Very low | 126 Ų | 126 | 122.8 Ų | 122.8 | 82% | 0.818 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -92.4 | 159.6 | -177.7 | 36.2 | -33.7 | 0 | 0 | 0 | 114.5 | ||
| 358 | S | 32.3 | Very low | 37.4 | Very low | 124 Ų | 124 | 122.2 Ų | 122.2 | 87% | 0.867 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -73.9 | 144.9 | 172.7 | 41.6 | 0 | 0 | 0 | 0 | 113.3 | ||
| 359 | S | 36.5 | Very low | 37.8 | Very low | 123 Ų | 123 | 123.6 Ų | 123.6 | 86% | 0.86 | 80% | 0.802 | S | S | * | * | trans | -132.6 | 135.4 | 165.9 | 54.6 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 360 | S | 33.9 | Very low | 38.6 | Very low | 112 Ų | 112 | 123.4 Ų | 123.4 | 78% | 0.783 | 80% | 0.798 | S | S | * | * | trans | -107.3 | 165 | -174.7 | 47.9 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 361 | S | 35.6 | Very low | 39 | Very low | 115 Ų | 115 | 122.7 Ų | 122.7 | 80% | 0.804 | 79% | 0.793 | S | S | * | * | trans | 81.2 | 139.4 | 166.3 | 78.8 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 362 | S | 33.8 | Very low | 39.8 | Very low | 105 Ų | 105 | 126.1 Ų | 126.1 | 73% | 0.734 | 79% | 0.793 | S | S | * | * | cis | -167.4 | 144.3 | 25.5 | 40.1 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 363 | S | 35.7 | Very low | 40.1 | Very low | 106 Ų | 106 | 126.6 Ų | 126.6 | 74% | 0.741 | 79% | 0.794 | S | S | * | * | trans | 42.5 | 140.7 | 140.8 | 62.3 | 0 | 0 | 0 | 0 | 127.5 | ||||
| 364 | S | 35.7 | Very low | 40.1 | Very low | 108 Ų | 108 | 131 Ų | 131 | 76% | 0.755 | 79% | 0.793 | S | S | * | * | trans | 93.2 | 140.7 | 143.4 | 74.1 | 0 | 0 | 0 | 0 | 119.1 | ||||
| 365 | S | 37.5 | Very low | 40.8 | Very low | 89 Ų | 89 | 129.8 Ų | 129.8 | 62% | 0.622 | 79% | 0.785 | S | S | * | * | cis | -169.6 | 157.1 | -17.5 | -74.1 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 366 | H | 38 | Very low | 41.2 | Very low | 175 Ų | 175 | 132.4 Ų | 132.4 | 81% | 0.81 | 78% | 0.784 | S | S | * | * | trans | 75.7 | 114.2 | 150.9 | -54.4 | -58.4 | 0 | 0 | 0 | 122.4 | ||||
| 367 | Q | 38.5 | Very low | 41.1 | Very low | 179 Ų | 179 | 133.6 Ų | 133.6 | 84% | 0.836 | 78% | 0.781 | S | S | * | * | 159.2 | 131.3 | 96.9 | -76.1 | -149.4 | 70.8 | 0 | 0 | 115.1 | |||||
| 368 | S | 35.5 | Very low | 41.2 | Very low | 111 Ų | 111 | 133 Ų | 133 | 78% | 0.776 | 78% | 0.779 | S | S | * | * | trans | 62.5 | 120.8 | 142.6 | 54.5 | 0 | 0 | 0 | 0 | 124.6 | ||||
| 369 | L | 40.3 | Very low | 42.3 | Very low | 162 Ų | 162 | 131 Ų | 131 | 85% | 0.848 | 77% | 0.766 | S | S | * | * | trans | -48.4 | 164.1 | 164.2 | -80.8 | 162.6 | 0 | 0 | 0 | 116.4 | ||||
| 370 | P | 52 | Low | 43.2 | Very low | 115 Ų | 115 | 130 Ų | 130 | 75% | 0.747 | 76% | 0.756 | S | S | * | * | -146.5 | 144.4 | 55.2 | 37.3 | -14.4 | 0 | 0 | 0 | 120.7 | |||||
| 371 | S | 42.9 | Very low | 44.3 | Very low | 104 Ų | 104 | 131.8 Ų | 131.8 | 73% | 0.727 | 76% | 0.756 | S | S | * | * | trans | 18.3 | 114 | 143.6 | 57.3 | 0 | 0 | 0 | 0 | 120.6 | ||||
| 372 | K | 49.3 | Very low | 45.4 | Very low | 191 Ų | 191 | 130.6 Ų | 130.6 | 83% | 0.83 | 75% | 0.748 | S | S | * | * | trans | -129.7 | 130.3 | 145.5 | -105.5 | 146.7 | 179.1 | 169.5 | 0 | 108.2 | R374 | K372-R374 PolarHBondContact O-N 3.11Š| ||
| 373 | P | 43.2 | Very low | 46.8 | Very low | 131 Ų | 131 | 129.8 Ų | 129.8 | 85% | 0.851 | 74% | 0.742 | S | S | * | * | trans | -73.3 | 100.3 | 176.2 | 30.3 | -28.9 | 0 | 0 | 0 | 107.2 | S375 | P373-S375 VanDerWaalsContact C-N 3.34Å; P373-S375 PolarHBondContact O-N 3.03Å; P373-S375 VanDerWaalsContact O-N 3.09Å | ||
| 374 | R | 46.2 | Very low | 48.2 | Very low | 222 Ų | 222 | 130.1 Ų | 130.1 | 84% | 0.838 | 74% | 0.736 | S | S | * | * | trans | -71.6 | 100.1 | 162.2 | -76.4 | -175.5 | 174.2 | -133.8 | 0.3 | 105.8 | K372 H376 | K372-R374 PolarHBondContact O-N 3.11Å; R374-H376 PolarHBondContact O-N 2.93Å | ||
| 375 | S | 48.1 | Very low | 49.9 | Very low | 91 Ų | 91 | 128 Ų | 128 | 64% | 0.636 | 72% | 0.72 | S | S | * | * | trans | -45.7 | 116.3 | 164.8 | 50.7 | 0 | 0 | 0 | 0 | 108.5 | P373 M377 | P373-S375 VanDerWaalsContact C-N 3.34Å; P373-S375 PolarHBondContact O-N 3.03Å; P373-S375 VanDerWaalsContact O-N 3.09Å; S375-M377 VanDerWaalsContact C-N 3.27Å; S375-M377 PolarHBondContact O-N 3.18Å | ||
| 376 | H | 50.6 | Low | 51.8 | Low | 170 Ų | 170 | 129.2 Ų | 129.2 | 79% | 0.787 | 72% | 0.716 | S | S | * | * | trans | -61.3 | 88.7 | 173.5 | -50.2 | -86.9 | 0 | 0 | 0 | 108.6 | R374 S378 | R374-H376 PolarHBondContact O-N 2.93Å; H376-S378 VanDerWaalsContact C-N 3.31Å; H376-S378 PolarHBondContact O-N 2.99Å | ||
| 377 | M | 49.3 | Very low | 54.2 | Low | 147 Ų | 147 | 124.2 Ų | 124.2 | 72% | 0.724 | 70% | 0.695 | S | S | * | * | trans | -87.6 | 85 | 157.8 | -65.1 | -62.4 | 114.7 | 0 | 0 | 105.7 | S375 S379 | S375-M377 VanDerWaalsContact C-N 3.27Å; S375-M377 PolarHBondContact O-N 3.18Å; M377-S379 PolarHBondContact O-N 3.23Å | ||
| 378 | S | 49.6 | Very low | 56.7 | Low | 113 Ų | 113 | 118 Ų | 118 | 79% | 0.79 | 67% | 0.67 | S | S | * | * | trans | -67.8 | 74.7 | 167.6 | -54.5 | 0 | 0 | 0 | 0 | 108.2 | H376 | H376-S378 VanDerWaalsContact C-N 3.31Å; H376-S378 PolarHBondContact O-N 2.99Å | ||
| 379 | S | 57.3 | Low | 59.5 | Low | 83 Ų | 83 | 116 Ų | 116 | 58% | 0.58 | 65% | 0.65 | S | S | * | * | trans | -68.3 | 130.1 | 167.7 | -68.2 | 0 | 0 | 0 | 0 | 107.9 | M377 L381 | M377-S379 PolarHBondContact O-N 3.23Å; S379-L381 VanDerWaalsContact C-N 3.34Å; S379-L381 PolarHBondContact O-N 3.15Å | ||
| 380 | P | 53.7 | Low | 62.2 | Low | 102 Ų | 102 | 115 Ų | 115 | 66% | 0.662 | 64% | 0.639 | S | S | * | * | trans | -75.2 | 86.4 | -176 | 30.5 | -32.7 | 0 | 0 | 0 | 109.8 | S382 S383 | P380-S382 PolarHBondContact O-N 3.31Å; P380-S382 VanDerWaalsContact O-N 3.11Å; P380-S383 PolarHBondContact O-N 3.36Å | ||
| 381 | L | 57.9 | Low | 64.3 | Low | 149 Ų | 149 | 116.7 Ų | 116.7 | 78% | 0.78 | 63% | 0.63 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -60 | -15.4 | 172.5 | -105.3 | 81.3 | 0 | 0 | 0 | 113 | S379 S383 | S379-L381 VanDerWaalsContact C-N 3.34Å; S379-L381 PolarHBondContact O-N 3.15Å; L381-S383 VanDerWaalsContact C-N 3.32Å; L381-S383 PolarHBondContact O-N 2.98Å |
| 382 | S | 58.9 | Low | 66.8 | Low | 90 Ų | 90 | 117.6 Ų | 117.6 | 63% | 0.629 | 62% | 0.621 | S | S | * | * | H | α-helix | trans | -74.7 | -21.2 | 179.5 | 89.7 | 0 | 0 | 0 | 0 | 113.3 | P380 D384 | P380-S382 PolarHBondContact O-N 3.31Å; P380-S382 VanDerWaalsContact O-N 3.11Å; S382-D384 VanDerWaalsContact C-N 3.32Å; S382-D384 PolarHBondContact O-N 2.89Å |
| 383 | S | 61.8 | Low | 69.1 | Low | 88 Ų | 88 | 111 Ų | 111 | 62% | 0.615 | 60% | 0.603 | S | S | * | * | H | α-helix | trans | -70.1 | -29.6 | -179.6 | -174.3 | 0 | 0 | 0 | 0 | 112.7 | P380 L381 | P380-S383 PolarHBondContact O-N 3.36Å; L381-S383 VanDerWaalsContact C-N 3.32Å; L381-S383 PolarHBondContact O-N 2.98Å |
| 384 | D | 65.4 | Low | 71.7 | Confident | 113 Ų | 113 | 110.6 Ų | 110.6 | 60% | 0.604 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -86.2 | -33.8 | -177.6 | -156.8 | 10.9 | 0 | 0 | 0 | 111.3 | S382 E386 D387 T388 | S382-D384 VanDerWaalsContact C-N 3.32Å; S382-D384 PolarHBondContact O-N 2.89Å; D384-E386 PolarHBondContact O-N 3.46Å; D384-D387 PolarHBondContact O-N 3.3Å; D384-T388 WeakPolarHBondContact O-CG2 3.46Å; D384-T388 PolarHBondContact O-N 3.12Å; D384-T388 VanDerWaalsContact O-N 3.14Å |
| 385 | C | 73.1 | Confident | 74.2 | Confident | 64 Ų | 64 | 103.5 Ų | 103.5 | 43% | 0.432 | 57% | 0.568 | S | S | . | * | H | α-helix | trans | -59.3 | -46.2 | 177.4 | -166.8 | 0 | 0 | 0 | 0 | 112.3 | D387 T388 D389 | C385-D387 VanDerWaalsContact C-N 3.28Å; C385-D387 PolarHBondContact O-N 3.19Å; C385-T388 PolarHBondContact O-N 2.85Å; C385-T388 VanDerWaalsContact O-N 3.14Å; C385-T388 PolarHBondContact O-OG1 3.06Å; C385-D389 PolarHBondContact O-N 3.16Å |
| 386 | E | 76.9 | Confident | 76.6 | Confident | 114 Ų | 114 | 105.2 Ų | 105.2 | 53% | 0.533 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -60.5 | -33.3 | 177.9 | -71.4 | -71.2 | 123.9 | 0 | 0 | 112.9 | D384 K390 | D384-E386 PolarHBondContact O-N 3.46Å; E386-K390 WeakPolarHBondContact O-CD 3.28Å; E386-K390 VanDerWaalsContact O-CG 3.24Å; E386-K390 WeakPolarHBondContact O-CG 3.43Å; E386-K390 PolarHBondContact O-N 3.13Å |
| 387 | D | 87.6 | Confident | 78.9 | Confident | 70 Ų | 70 | 102.2 Ų | 102.2 | 37% | 0.374 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -70.2 | -43.4 | 174.8 | -172.6 | 71.7 | 0 | 0 | 0 | 111.3 | D384 C385 D389 K390 R391 | D384-D387 PolarHBondContact O-N 3.3Å; C385-D387 VanDerWaalsContact C-N 3.28Å; C385-D387 PolarHBondContact O-N 3.19Å; D387-D389 VanDerWaalsContact C-N 3.31Å; D387-D389 PolarHBondContact O-N 3.49Å; D387-K390 PolarHBondContact O-N 2.96Å; D387-R391 WeakPolarHBondContact O-CB 3.49Å; D387-R391 PolarHBondContact O-N 3.37Å; D387-R391 IonicContact OD2-CZ 3.76Å; D387-R391 IonicContact OD2-NE 3.7Å; D387-R391 IonicContact OD2-NH2 3.99Å; D387-R391 PolarHBondContact OD2-NH2 3.05Å |
| 388 | T | 92 | Very high | 81.2 | Confident | 49 Ų | 49 | 98 Ų | 98 | 30% | 0.301 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -62.9 | -38.5 | 178.6 | 70.5 | 0 | 0 | 0 | 0 | 112.2 | D384 C385 R391 K392 | D384-T388 WeakPolarHBondContact O-CG2 3.46Å; D384-T388 PolarHBondContact O-N 3.12Å; D384-T388 VanDerWaalsContact O-N 3.14Å; C385-T388 PolarHBondContact O-N 2.85Å; C385-T388 VanDerWaalsContact O-N 3.14Å; C385-T388 PolarHBondContact O-OG1 3.06Å; T388-R391 WeakPolarHBondContact O-CB 3.33Å; T388-R391 PolarHBondContact O-N 2.98Å; T388-K392 VanDerWaalsContact O-CG 3.25Å; T388-K392 WeakPolarHBondContact O-CG 3.49Å; T388-K392 PolarHBondContact O-N 3.47Å |
| 389 | D | 94.4 | Very high | 83.6 | Confident | 69 Ų | 69 | 99.7 Ų | 99.7 | 37% | 0.369 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -73.5 | -37.6 | -179.2 | -69.9 | -26.4 | 0 | 0 | 0 | 112.2 | C385 D387 R391 K392 A393 | C385-D389 PolarHBondContact O-N 3.16Å; D387-D389 VanDerWaalsContact C-N 3.31Å; D387-D389 PolarHBondContact O-N 3.49Å; D389-R391 VanDerWaalsContact C-N 3.32Å; D389-R391 PolarHBondContact O-N 3.44Å; D389-K392 PolarHBondContact O-N 2.92Å; D389-K392 IonicContact OD1-NZ 2.8Å; D389-K392 PolarHBondContact OD1-NZ 3.41Å; D389-A393 WeakPolarHBondContact O-CB 3.49Å; D389-A393 PolarHBondContact O-N 3.3Å |
| 390 | K | 95.3 | Very high | 85.5 | Confident | 139 Ų | 139 | 102.5 Ų | 102.5 | 60% | 0.604 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -59.3 | -44.1 | 169 | -73 | 169.8 | -172.1 | 171.8 | 0 | 111.4 | E386 D387 A393 H394 | E386-K390 WeakPolarHBondContact O-CD 3.28Å; E386-K390 VanDerWaalsContact O-CG 3.24Å; E386-K390 WeakPolarHBondContact O-CG 3.43Å; E386-K390 PolarHBondContact O-N 3.13Å; D387-K390 PolarHBondContact O-N 2.96Å; K390-A393 PolarHBondContact O-N 3.44Å; K390-H394 WeakPolarHBondContact O-CB 3.32Å; K390-H394 PolarHBondContact O-N 3.4Å |
| 391 | R | 96.1 | Very high | 87.7 | Confident | 151 Ų | 151 | 104.4 Ų | 104.4 | 57% | 0.57 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -63.5 | -43.3 | 176.9 | -168 | -175.9 | -56.2 | -174.7 | 5.6 | 111.9 | D387 T388 D389 N395 | D387-R391 WeakPolarHBondContact O-CB 3.49Å; D387-R391 PolarHBondContact O-N 3.37Å; D387-R391 IonicContact OD2-CZ 3.76Å; D387-R391 IonicContact OD2-NE 3.7Å; D387-R391 IonicContact OD2-NH2 3.99Å; D387-R391 PolarHBondContact OD2-NH2 3.05Å; T388-R391 WeakPolarHBondContact O-CB 3.33Å; T388-R391 PolarHBondContact O-N 2.98Å; D389-R391 VanDerWaalsContact C-N 3.32Å; D389-R391 PolarHBondContact O-N 3.44Å; R391-N395 WeakPolarHBondContact O-CB 3.23Å; R391-N395 PolarHBondContact O-N 3.27Å; R391-N395 PolarHBondContact O-ND2 3.13Å |
| 392 | K | 97.1 | Very high | 89.6 | Confident | 123 Ų | 123 | 102 Ų | 102 | 54% | 0.535 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -61.8 | -47.6 | 175.2 | -72.1 | 169.9 | -157.1 | 156.3 | 0 | 111.4 | T388 D389 H394 N395 F396 | T388-K392 VanDerWaalsContact O-CG 3.25Å; T388-K392 WeakPolarHBondContact O-CG 3.49Å; T388-K392 PolarHBondContact O-N 3.47Å; D389-K392 PolarHBondContact O-N 2.92Å; D389-K392 IonicContact OD1-NZ 2.8Å; D389-K392 PolarHBondContact OD1-NZ 3.41Å; K392-H394 PolarHBondContact O-N 3.16Å; K392-N395 PolarHBondContact O-N 3.19Å; K392-F396 WeakPolarHBondContact O-CB 3.4Å; K392-F396 PolarHBondContact O-N 3.44Å |
| 393 | A | 97 | Very high | 91.5 | Very high | 53 Ų | 53 | 102.4 Ų | 102.4 | 44% | 0.438 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -60.7 | -45.7 | 178.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | D389 K390 N395 F396 L397 | D389-A393 WeakPolarHBondContact O-CB 3.49Å; D389-A393 PolarHBondContact O-N 3.3Å; K390-A393 PolarHBondContact O-N 3.44Å; A393-N395 PolarHBondContact O-N 3.5Å; A393-F396 WeakPolarHBondContact O-CB 3.31Å; A393-F396 PolarHBondContact O-N 3.47Å; A393-L397 WeakPolarHBondContact O-CG 3.25Å; A393-L397 PolarHBondContact O-N 2.96Å |
| 394 | H | 98.1 | Very high | 93.3 | Very high | 122 Ų | 122 | 101.8 Ų | 101.8 | 57% | 0.565 | 48% | 0.482 | S | S | * | . | H | α-helix | trans | -58.4 | -48.1 | 174.1 | 173.6 | -91.6 | 0 | 0 | 0 | 111.9 | K390 K392 F396 L397 E398 | K390-H394 WeakPolarHBondContact O-CB 3.32Å; K390-H394 PolarHBondContact O-N 3.4Å; K392-H394 PolarHBondContact O-N 3.16Å; H394-F396 VanDerWaalsContact C-N 3.3Å; H394-F396 PolarHBondContact O-N 3.46Å; H394-L397 PolarHBondContact O-N 2.99Å; H394-E398 PolarHBondContact O-N 3.27Å |
| 395 | N | 98.3 | Very high | 94.8 | Very high | 74 Ų | 74 | 99.5 Ų | 99.5 | 40% | 0.396 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -61.8 | -37.4 | 178 | -80.1 | -41 | 0 | 0 | 0 | 113 | R391 K392 A393 R399 | R391-N395 WeakPolarHBondContact O-CB 3.23Å; R391-N395 PolarHBondContact O-N 3.27Å; R391-N395 PolarHBondContact O-ND2 3.13Å; K392-N395 PolarHBondContact O-N 3.19Å; A393-N395 PolarHBondContact O-N 3.5Å; N395-R399 WeakPolarHBondContact O-CB 3.45Å; N395-R399 PolarHBondContact O-N 3.08Å |
| 396 | F | 98.5 | Very high | 96 | Very high | 126 Ų | 126 | 102.6 Ų | 102.6 | 55% | 0.553 | 47% | 0.472 | S | S | * | . | H | α-helix | trans | -62.5 | -50.6 | 174.7 | 175.2 | -96.6 | 0 | 0 | 0 | 111.1 | K392 A393 H394 E398 R399 K400 | K392-F396 WeakPolarHBondContact O-CB 3.4Å; K392-F396 PolarHBondContact O-N 3.44Å; A393-F396 WeakPolarHBondContact O-CB 3.31Å; A393-F396 PolarHBondContact O-N 3.47Å; H394-F396 VanDerWaalsContact C-N 3.3Å; H394-F396 PolarHBondContact O-N 3.46Å; F396-E398 PolarHBondContact O-N 3.18Å; F396-R399 PolarHBondContact O-N 3.46Å; F396-K400 PolarHBondContact O-N 2.84Å |
| 397 | L | 98.3 | Very high | 97 | Very high | 108 Ų | 108 | 99.5 Ų | 99.5 | 57% | 0.565 | 46% | 0.463 | S | S | * | . | H | α-helix | trans | -61.3 | -42.8 | 178.7 | -70 | 174.5 | 0 | 0 | 0 | 111.9 | A393 H394 R399 K400 R401 | A393-L397 WeakPolarHBondContact O-CG 3.25Å; A393-L397 PolarHBondContact O-N 2.96Å; H394-L397 PolarHBondContact O-N 2.99Å; L397-R399 VanDerWaalsContact C-N 3.35Å; L397-R399 PolarHBondContact O-N 2.86Å; L397-K400 PolarHBondContact O-N 3.06Å; L397-R401 WeakPolarHBondContact O-CB 3.48Å; L397-R401 PolarHBondContact O-N 2.89Å |
| 398 | E | 98.6 | Very high | 97.5 | Very high | 57 Ų | 57 | 103.6 Ų | 103.6 | 27% | 0.266 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -68.2 | -33.3 | 177.7 | 176.8 | 53 | -159.5 | 0 | 0 | 112.3 | H394 F396 R401 R402 | H394-E398 PolarHBondContact O-N 3.27Å; F396-E398 PolarHBondContact O-N 3.18Å; E398-R401 IonicContact OE1-NH1 3.1Å; E398-R401 PolarHBondContact OE1-NH1 3.38Å; E398-R401 WeakPolarHBondContact OE2-CD 3.47Å; E398-R401 IonicContact OE2-CZ 2.84Å; E398-R401 IonicContact OE2-NE 2.82Å; E398-R401 IonicContact OE2-NH1 2.83Å; E398-R401 PolarHBondContact OE2-NH1 3.48Å; E398-R402 WeakPolarHBondContact O-CB 3.41Å; E398-R402 VanDerWaalsContact O-CG 3.24Å; E398-R402 WeakPolarHBondContact O-CG 3.38Å; E398-R402 PolarHBondContact O-N 3.46Å; E398-R402 PolarHBondContact O-NE 3.36Å; E398-R402 WeakPolarHBondContact OE1-CD 3.32Å; E398-R402 VanDerWaalsContact OE1-CG 3.29Å; E398-R402 WeakPolarHBondContact OE1-CG 3.3Å; E398-R402 IonicContact OE1-NE 3.72Å |
| 399 | R | 98.8 | Very high | 97.8 | Very high | 150 Ų | 150 | 102.8 Ų | 102.8 | 57% | 0.566 | 47% | 0.466 | S | S | * | . | H | α-helix | trans | -66 | -44.4 | 171.5 | -172.9 | -179.3 | -69.4 | 104.5 | -5.1 | 111.2 | N395 F396 L397 R402 N403 | N395-R399 WeakPolarHBondContact O-CB 3.45Å; N395-R399 PolarHBondContact O-N 3.08Å; F396-R399 PolarHBondContact O-N 3.46Å; L397-R399 VanDerWaalsContact C-N 3.35Å; L397-R399 PolarHBondContact O-N 2.86Å; R399-R402 PolarHBondContact O-N 2.88Å; R399-N403 PolarHBondContact O-N 3.05Å |
| 400 | K | 98.7 | Very high | 98 | Very high | 141 Ų | 141 | 103.5 Ų | 103.5 | 61% | 0.613 | 47% | 0.469 | S | S | * | . | H | α-helix | trans | -59.9 | -47.7 | 176.1 | -173.5 | 178.8 | 179.7 | -178.4 | 0 | 111 | F396 L397 R402 N403 D404 | F396-K400 PolarHBondContact O-N 2.84Å; L397-K400 PolarHBondContact O-N 3.06Å; K400-R402 PolarHBondContact O-N 3.08Å; K400-N403 WeakPolarHBondContact O-CB 3.48Å; K400-N403 PolarHBondContact O-N 3.44Å; K400-N403 VanDerWaalsContact O-N 3.11Å; K400-D404 PolarHBondContact O-N 3.24Å |
| 401 | R | 98.8 | Very high | 98.1 | Very high | 142 Ų | 142 | 102.6 Ų | 102.6 | 54% | 0.536 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -56.7 | -46.6 | 174.4 | 179.1 | -178.2 | 154.6 | -83.9 | -5 | 111.9 | L397 E398 N403 D404 L405 | L397-R401 WeakPolarHBondContact O-CB 3.48Å; L397-R401 PolarHBondContact O-N 2.89Å; E398-R401 IonicContact OE1-NH1 3.1Å; E398-R401 PolarHBondContact OE1-NH1 3.38Å; E398-R401 WeakPolarHBondContact OE2-CD 3.47Å; E398-R401 IonicContact OE2-CZ 2.84Å; E398-R401 IonicContact OE2-NE 2.82Å; E398-R401 IonicContact OE2-NH1 2.83Å; E398-R401 PolarHBondContact OE2-NH1 3.48Å; R401-N403 VanDerWaalsContact C-N 3.3Å; R401-N403 PolarHBondContact O-N 3.1Å; R401-D404 PolarHBondContact O-N 3.31Å; R401-L405 WeakPolarHBondContact O-CB 3.17Å; R401-L405 PolarHBondContact O-N 3.01Å |
| 402 | R | 98.6 | Very high | 98.2 | Very high | 99 Ų | 99 | 98.5 Ų | 98.5 | 37% | 0.374 | 46% | 0.459 | S | S | . | . | H | α-helix | trans | -66 | -30.3 | 177.2 | -72.6 | -178.8 | -67.7 | 170.4 | -6.2 | 112.9 | E398 R399 K400 R406 | E398-R402 WeakPolarHBondContact O-CB 3.41Å; E398-R402 VanDerWaalsContact O-CG 3.24Å; E398-R402 WeakPolarHBondContact O-CG 3.38Å; E398-R402 PolarHBondContact O-N 3.46Å; E398-R402 PolarHBondContact O-NE 3.36Å; E398-R402 WeakPolarHBondContact OE1-CD 3.32Å; E398-R402 VanDerWaalsContact OE1-CG 3.29Å; E398-R402 WeakPolarHBondContact OE1-CG 3.3Å; E398-R402 IonicContact OE1-NE 3.72Å; R399-R402 PolarHBondContact O-N 2.88Å; K400-R402 PolarHBondContact O-N 3.08Å; R402-R406 VanDerWaalsContact O-CG 3.28Å; R402-R406 WeakPolarHBondContact O-CG 3.34Å; R402-R406 PolarHBondContact O-N 3.47Å; R402-R406 PolarHBondContact O-NH1 2.98Å; R402-R406 VanDerWaalsContact O-NH1 3.11Å |
| 403 | N | 98.6 | Very high | 98.2 | Very high | 99 Ų | 99 | 94 Ų | 94 | 53% | 0.529 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -71.7 | -49.1 | 174.7 | -176.1 | -88.4 | 0 | 0 | 0 | 110.9 | R399 K400 R401 L405 R406 S407 | R399-N403 PolarHBondContact O-N 3.05Å; K400-N403 WeakPolarHBondContact O-CB 3.48Å; K400-N403 PolarHBondContact O-N 3.44Å; K400-N403 VanDerWaalsContact O-N 3.11Å; R401-N403 VanDerWaalsContact C-N 3.3Å; R401-N403 PolarHBondContact O-N 3.1Å; N403-L405 VanDerWaalsContact C-N 3.3Å; N403-L405 PolarHBondContact O-N 3.46Å; N403-R406 WeakPolarHBondContact O-CA 3.46Å; N403-R406 WeakPolarHBondContact O-CB 3.07Å; N403-R406 PolarHBondContact O-N 3.45Å; N403-S407 PolarHBondContact O-N 2.97Å; N403-S407 PolarHBondContact O-OG 3.09Å |
| 404 | D | 98.6 | Very high | 98.3 | Very high | 75 Ų | 75 | 95 Ų | 95 | 40% | 0.401 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -55.7 | -45.5 | 175.3 | -175.5 | 58.6 | 0 | 0 | 0 | 111.7 | K400 R401 R406 S407 R408 | K400-D404 PolarHBondContact O-N 3.24Å; R401-D404 PolarHBondContact O-N 3.31Å; D404-R406 VanDerWaalsContact C-N 3.32Å; D404-R406 PolarHBondContact O-N 3.1Å; D404-S407 WeakPolarHBondContact O-CB 3.38Å; D404-S407 PolarHBondContact O-N 3.07Å; D404-R408 WeakPolarHBondContact O-CG 3.28Å; D404-R408 PolarHBondContact O-N 2.97Å; D404-R408 IonicContact OD1-NE 2.82Å; D404-R408 IonicContact OD2-CZ 3.84Å; D404-R408 IonicContact OD2-NE 3.42Å; D404-R408 PolarHBondContact OD2-NE 3.15Å; D404-R408 IonicContact OD2-NH2 3.7Å; D404-R408 PolarHBondContact OD2-NH2 3.18Å; D404-R408 VanDerWaalsContact OD2-NH2 3.1Å |
| 405 | L | 98.6 | Very high | 98.2 | Very high | 65 Ų | 65 | 96.2 Ų | 96.2 | 34% | 0.34 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -60.4 | -40.8 | 176.4 | -175.9 | 61.2 | 0 | 0 | 0 | 112.1 | R401 N403 R408 F409 | R401-L405 WeakPolarHBondContact O-CB 3.17Å; R401-L405 PolarHBondContact O-N 3.01Å; N403-L405 VanDerWaalsContact C-N 3.3Å; N403-L405 PolarHBondContact O-N 3.46Å; L405-R408 PolarHBondContact O-N 3.03Å; L405-F409 HydrophobicContact CD1-CD2 4.08Å; L405-F409 HydrophobicContact CD1-CE2 3.83Å; L405-F409 HydrophobicContact CD2-CE2 4.49Å; L405-F409 HydrophobicContact CG-CD2 4.05Å; L405-F409 HydrophobicContact CG-CE2 3.98Å; L405-F409 VanDerWaalsContact O-CD2 3.28Å; L405-F409 WeakPolarHBondContact O-CD2 3.36Å; L405-F409 PolarHBondContact O-N 2.97Å; L405-F409 VanDerWaalsContact O-N 3.09Å |
| 406 | R | 97.7 | Very high | 98.2 | Very high | 128 Ų | 128 | 93.1 Ų | 93.1 | 48% | 0.483 | 43% | 0.426 | S | S | . | . | H | α-helix | trans | -63.4 | -43.7 | 175.9 | -76.6 | 178.6 | -171.8 | 101 | -9.1 | 111.2 | R402 N403 D404 R408 F409 L410 | R402-R406 VanDerWaalsContact O-CG 3.28Å; R402-R406 WeakPolarHBondContact O-CG 3.34Å; R402-R406 PolarHBondContact O-N 3.47Å; R402-R406 PolarHBondContact O-NH1 2.98Å; R402-R406 VanDerWaalsContact O-NH1 3.11Å; N403-R406 WeakPolarHBondContact O-CA 3.46Å; N403-R406 WeakPolarHBondContact O-CB 3.07Å; N403-R406 PolarHBondContact O-N 3.45Å; D404-R406 VanDerWaalsContact C-N 3.32Å; D404-R406 PolarHBondContact O-N 3.1Å; R406-R408 VanDerWaalsContact C-N 3.34Å; R406-R408 PolarHBondContact O-N 3.35Å; R406-F409 WeakPolarHBondContact O-CB 3.44Å; R406-F409 PolarHBondContact O-N 3.1Å; R406-L410 WeakPolarHBondContact O-CG 3.31Å; R406-L410 PolarHBondContact O-N 3.36Å |
| 407 | S | 98.2 | Very high | 98.1 | Very high | 50 Ų | 50 | 91.2 Ų | 91.2 | 35% | 0.35 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -59.5 | -43.5 | 176.6 | -56.7 | 0 | 0 | 0 | 0 | 111.8 | N403 D404 F409 L410 L411 | N403-S407 PolarHBondContact O-N 2.97Å; N403-S407 PolarHBondContact O-OG 3.09Å; D404-S407 WeakPolarHBondContact O-CB 3.38Å; D404-S407 PolarHBondContact O-N 3.07Å; S407-F409 VanDerWaalsContact C-N 3.34Å; S407-F409 PolarHBondContact O-N 3.18Å; S407-L410 WeakPolarHBondContact O-CB 3.37Å; S407-L410 PolarHBondContact O-N 3.01Å; S407-L410 VanDerWaalsContact O-N 3.15Å; S407-L411 WeakPolarHBondContact O-CG 3.45Å; S407-L411 PolarHBondContact O-N 3.09Å |
| 408 | R | 98.4 | Very high | 97.9 | Very high | 155 Ų | 155 | 89.2 Ų | 89.2 | 59% | 0.585 | 43% | 0.432 | S | S | * | . | H | α-helix | trans | -61.9 | -38.3 | 174.9 | -67 | 175.8 | -170.3 | -112.6 | 0.3 | 113.2 | D404 L405 R406 L410 L412 | D404-R408 WeakPolarHBondContact O-CG 3.28Å; D404-R408 PolarHBondContact O-N 2.97Å; D404-R408 IonicContact OD1-NE 2.82Å; D404-R408 IonicContact OD2-CZ 3.84Å; D404-R408 IonicContact OD2-NE 3.42Å; D404-R408 PolarHBondContact OD2-NE 3.15Å; D404-R408 IonicContact OD2-NH2 3.7Å; D404-R408 PolarHBondContact OD2-NH2 3.18Å; D404-R408 VanDerWaalsContact OD2-NH2 3.1Å; L405-R408 PolarHBondContact O-N 3.03Å; R406-R408 VanDerWaalsContact C-N 3.34Å; R406-R408 PolarHBondContact O-N 3.35Å; R408-L410 VanDerWaalsContact C-N 3.33Å; R408-L412 WeakPolarHBondContact O-CB 3.29Å; R408-L412 PolarHBondContact O-N 3.41Å |
| 409 | F | 98.3 | Very high | 97.8 | Very high | 32 Ų | 32 | 87.4 Ų | 87.4 | 14% | 0.14 | 42% | 0.424 | C | S | . | . | H | α-helix | trans | -65.4 | -36.1 | 174.2 | -92.1 | -75.5 | 0 | 0 | 0 | 112.5 | L405 R406 S407 R413 K427 I430 L431 | L405-F409 HydrophobicContact CD1-CD2 4.08Å; L405-F409 HydrophobicContact CD1-CE2 3.83Å; L405-F409 HydrophobicContact CD2-CE2 4.49Å; L405-F409 HydrophobicContact CG-CD2 4.05Å; L405-F409 HydrophobicContact CG-CE2 3.98Å; L405-F409 VanDerWaalsContact O-CD2 3.28Å; L405-F409 WeakPolarHBondContact O-CD2 3.36Å; L405-F409 PolarHBondContact O-N 2.97Å; L405-F409 VanDerWaalsContact O-N 3.09Å; R406-F409 WeakPolarHBondContact O-CB 3.44Å; R406-F409 PolarHBondContact O-N 3.1Å; S407-F409 VanDerWaalsContact C-N 3.34Å; S407-F409 PolarHBondContact O-N 3.18Å; F409-R413 WeakPolarHBondContact O-CB 3.41Å; F409-R413 PolarHBondContact O-N 3.45Å; F409-K427 HydrophobicContact CD1-CB 4.22Å; F409-K427 HydrophobicContact CD1-CG 4.07Å; F409-K427 HydrophobicContact CD2-CD 4.15Å; F409-K427 HydrophobicContact CD2-CG 4.31Å; F409-K427 HydrophobicContact CE1-CB 3.8Å; F409-K427 HydrophobicContact CE1-CD 4.45Å; F409-K427 HydrophobicContact CE1-CG 4.04Å; F409-K427 HydrophobicContact CE2-CD 3.91Å; F409-K427 HydrophobicContact CE2-CG 4.31Å; F409-K427 HydrophobicContact CG-CG 4.22Å; F409-K427 HydrophobicContact CZ-CB 4.07Å; F409-K427 HydrophobicContact CZ-CD 4.08Å; F409-K427 HydrophobicContact CZ-CG 4.17Å; F409-I430 HydrophobicContact CB-CD1 4.41Å; F409-I430 HydrophobicContact CD1-CB 4.31Å; F409-I430 HydrophobicContact CD1-CD1 4.03Å; F409-I430 HydrophobicContact CD1-CG2 4.21Å; F409-L431 HydrophobicContact CE1-CD1 4.29Å; F409-L431 HydrophobicContact CE1-CD2 3.81Å; F409-L431 HydrophobicContact CE1-CG 3.89Å; F409-L431 HydrophobicContact CZ-CD1 4.33Å; F409-L431 HydrophobicContact CZ-CD2 4.25Å; F409-L431 HydrophobicContact CZ-CG 4.39Å |
| 410 | L | 97.3 | Very high | 97.6 | Very high | 85 Ų | 85 | 82.2 Ų | 82.2 | 45% | 0.445 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -67.2 | -48.3 | 175.5 | -67.3 | 172.6 | 0 | 0 | 0 | 110.9 | R406 S407 R408 L412 R413 D414 | R406-L410 WeakPolarHBondContact O-CG 3.31Å; R406-L410 PolarHBondContact O-N 3.36Å; S407-L410 WeakPolarHBondContact O-CB 3.37Å; S407-L410 PolarHBondContact O-N 3.01Å; S407-L410 VanDerWaalsContact O-N 3.15Å; R408-L410 VanDerWaalsContact C-N 3.33Å; L410-L412 VanDerWaalsContact C-N 3.31Å; L410-L412 PolarHBondContact O-N 3.21Å; L410-R413 WeakPolarHBondContact O-CB 3.49Å; L410-R413 PolarHBondContact O-N 3.42Å; L410-R413 VanDerWaalsContact O-N 3.1Å; L410-D414 PolarHBondContact O-N 3.14Å |
| 411 | L | 97.9 | Very high | 97.2 | Very high | 119 Ų | 119 | 83 Ų | 83 | 62% | 0.623 | 42% | 0.424 | S | S | * | . | H | α-helix | trans | -56 | -46 | 174.9 | -67.6 | 175 | 0 | 0 | 0 | 111.7 | S407 R413 D414 E415 | S407-L411 WeakPolarHBondContact O-CG 3.45Å; S407-L411 PolarHBondContact O-N 3.09Å; L411-R413 VanDerWaalsContact C-N 3.35Å; L411-R413 PolarHBondContact O-N 2.96Å; L411-D414 PolarHBondContact O-N 3.47Å; L411-E415 PolarHBondContact O-N 3.11Å |
| 412 | L | 98.3 | Very high | 96.8 | Very high | 65 Ų | 65 | 79 Ų | 79 | 34% | 0.34 | 42% | 0.417 | S | S | . | . | H | α-helix | trans | -62.6 | -40.6 | 177.1 | 178.1 | 60.4 | 0 | 0 | 0 | 112.4 | R408 L410 D414 E415 I416 I430 L431 A434 | R408-L412 WeakPolarHBondContact O-CB 3.29Å; R408-L412 PolarHBondContact O-N 3.41Å; L410-L412 VanDerWaalsContact C-N 3.31Å; L410-L412 PolarHBondContact O-N 3.21Å; L412-D414 VanDerWaalsContact C-N 3.3Å; L412-D414 PolarHBondContact O-N 3.24Å; L412-E415 PolarHBondContact O-N 2.9Å; L412-I416 HydrophobicContact CD1-CD1 4.4Å; L412-I416 HydrophobicContact CG-CD1 4.2Å; L412-I416 VanDerWaalsContact O-CD1 3.31Å; L412-I416 WeakPolarHBondContact O-CD1 3.47Å; L412-I416 VanDerWaalsContact O-CG1 3.29Å; L412-I416 WeakPolarHBondContact O-CG1 3.41Å; L412-I430 HydrophobicContact CB-CG2 4.25Å; L412-I430 HydrophobicContact CD2-CG2 3.77Å; L412-I430 HydrophobicContact CG-CG2 3.78Å; L412-L431 HydrophobicContact CD2-CD2 4.25Å; L412-A434 HydrophobicContact CD1-CB 4.1Å; L412-A434 HydrophobicContact CD2-CB 4.27Å; L412-A434 HydrophobicContact CG-CB 4.41Å |
| 413 | R | 98 | Very high | 96.2 | Very high | 28 Ų | 28 | 78.3 Ų | 78.3 | 11% | 0.106 | 43% | 0.433 | C | S | . | . | H | α-helix | trans | -61.7 | -41 | 178.1 | -178.6 | -157.7 | 64.5 | 172.7 | -2.8 | 111.4 | F409 L410 L411 E415 I416 L419 C422 A423 I430 | F409-R413 WeakPolarHBondContact O-CB 3.41Å; F409-R413 PolarHBondContact O-N 3.45Å; L410-R413 WeakPolarHBondContact O-CB 3.49Å; L410-R413 PolarHBondContact O-N 3.42Å; L410-R413 VanDerWaalsContact O-N 3.1Å; L411-R413 VanDerWaalsContact C-N 3.35Å; L411-R413 PolarHBondContact O-N 2.96Å; R413-E415 VanDerWaalsContact C-N 3.26Å; R413-E415 PolarHBondContact O-N 3Å; R413-I416 PolarHBondContact O-N 3.34Å; R413-I416 VanDerWaalsContact O-N 3.13Å; R413-L419 WeakPolarHBondContact CD-O 3.35Å; R413-L419 HydrophobicContact CG-CB 3.78Å; R413-L419 WeakPolarHBondContact CG-O 3.42Å; R413-C422 PolarHBondContact NH1-O 3.28Å; R413-A423 VanDerWaalsContact NH1-CA 3.35Å; R413-I430 HydrophobicContact CB-CD1 3.97Å; R413-I430 HydrophobicContact CB-CG1 4.15Å; R413-I430 HydrophobicContact CB-CG2 4.32Å; R413-I430 HydrophobicContact CG-CD1 4.34Å; R413-I430 HydrophobicContact CG-CG1 4.28Å |
| 414 | D | 97.4 | Very high | 95.8 | Very high | 76 Ų | 76 | 83.3 Ų | 83.3 | 41% | 0.406 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -69.3 | -26.4 | -175 | -62.1 | -13.2 | 0 | 0 | 0 | 112.1 | L410 L411 L412 I416 | L410-D414 PolarHBondContact O-N 3.14Å; L411-D414 PolarHBondContact O-N 3.47Å; L412-D414 VanDerWaalsContact C-N 3.3Å; L412-D414 PolarHBondContact O-N 3.24Å; D414-I416 VanDerWaalsContact C-N 3.32Å |
| 415 | E | 97.5 | Very high | 95.7 | Very high | 147 Ų | 147 | 81 Ų | 81 | 69% | 0.687 | 44% | 0.438 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -77 | -12.7 | 173.1 | -66.3 | -62.4 | 152.3 | 0 | 0 | 114.1 | L411 L412 R413 P417 Y437 | L411-E415 PolarHBondContact O-N 3.11Å; L412-E415 PolarHBondContact O-N 2.9Å; R413-E415 VanDerWaalsContact C-N 3.26Å; R413-E415 PolarHBondContact O-N 3Å; E415-P417 WeakPolarHBondContact O-CD 3.4Å; E415-Y437 WeakPolarHBondContact O-CE1 3.2Å |
| 416 | I | 97.8 | Very high | 95.6 | Very high | 8 Ų | 8 | 81.7 Ų | 81.7 | 4% | 0.041 | 45% | 0.447 | C | S | . | . | S | Bend | trans | -96.4 | 119.2 | -175.7 | -60.2 | 159.9 | 0 | 0 | 0 | 109.7 | L412 R413 D414 G418 L419 I430 R433 A434 | L412-I416 HydrophobicContact CD1-CD1 4.4Å; L412-I416 HydrophobicContact CG-CD1 4.2Å; L412-I416 VanDerWaalsContact O-CD1 3.31Å; L412-I416 WeakPolarHBondContact O-CD1 3.47Å; L412-I416 VanDerWaalsContact O-CG1 3.29Å; L412-I416 WeakPolarHBondContact O-CG1 3.41Å; R413-I416 PolarHBondContact O-N 3.34Å; R413-I416 VanDerWaalsContact O-N 3.13Å; D414-I416 VanDerWaalsContact C-N 3.32Å; I416-G418 PolarHBondContact O-N 3.11Å; I416-L419 HydrophobicContact CB-CB 4.21Å; I416-L419 HydrophobicContact CB-CD1 4.06Å; I416-L419 HydrophobicContact CB-CG 4.3Å; I416-L419 HydrophobicContact CD1-CD1 4Å; I416-L419 HydrophobicContact CG2-CB 4.31Å; I416-L419 HydrophobicContact CG2-CD1 3.76Å; I416-L419 HydrophobicContact CG2-CG 3.9Å; I416-L419 PolarHBondContact O-N 3.42Å; I416-L419 VanDerWaalsContact O-N 3.07Å; I416-I430 HydrophobicContact CD1-CG2 3.95Å; I416-I430 WeakPolarHBondContact CD1-O 3.38Å; I416-R433 HydrophobicContact CG2-CB 3.91Å; I416-A434 HydrophobicContact CD1-CB 3.71Å; I416-A434 HydrophobicContact CG1-CB 4.37Å |
| 417 | P | 96.4 | Very high | 95.6 | Very high | 87 Ų | 87 | 80.5 Ų | 80.5 | 57% | 0.565 | 45% | 0.445 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -54.2 | 132.7 | 178.1 | -26.9 | 35 | 0 | 0 | 0 | 112.4 | E415 L419 Y437 | E415-P417 WeakPolarHBondContact O-CD 3.4Å; P417-L419 VanDerWaalsContact C-N 3.27Å; P417-L419 PolarHBondContact O-N 2.92Å; P417-Y437 VanDerWaalsContact CD-CZ 3.49Å; P417-Y437 HydrophobicContact CG-CD2 4.19Å; P417-Y437 HydrophobicContact CG-CE1 4.2Å; P417-Y437 HydrophobicContact CG-CE2 3.63Å |
| 418 | G | 94.1 | Very high | 95.6 | Very high | 65 Ų | 65 | 83 Ų | 83 | 67% | 0.67 | 46% | 0.458 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 79.4 | -3.3 | 179.9 | 0 | 0 | 0 | 0 | 0 | 115.5 | I416 | I416-G418 PolarHBondContact O-N 3.11Š|
| 419 | L | 96.1 | Very high | 95.6 | Very high | 20 Ų | 20 | 77 Ų | 77 | 11% | 0.105 | 44% | 0.442 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -105.4 | -20.3 | 175.6 | -67.2 | -167.8 | 0 | 0 | 0 | 114.7 | R413 I416 P417 D421 C422 T425 R433 | R413-L419 WeakPolarHBondContact CD-O 3.35Å; R413-L419 HydrophobicContact CG-CB 3.78Å; R413-L419 WeakPolarHBondContact CG-O 3.42Å; I416-L419 HydrophobicContact CB-CB 4.21Å; I416-L419 HydrophobicContact CB-CD1 4.06Å; I416-L419 HydrophobicContact CB-CG 4.3Å; I416-L419 HydrophobicContact CD1-CD1 4Å; I416-L419 HydrophobicContact CG2-CB 4.31Å; I416-L419 HydrophobicContact CG2-CD1 3.76Å; I416-L419 HydrophobicContact CG2-CG 3.9Å; I416-L419 PolarHBondContact O-N 3.42Å; I416-L419 VanDerWaalsContact O-N 3.07Å; P417-L419 VanDerWaalsContact C-N 3.27Å; P417-L419 PolarHBondContact O-N 2.92Å; L419-D421 VanDerWaalsContact C-N 3.29Å; L419-D421 PolarHBondContact O-N 3.33Å; L419-C422 WeakPolarHBondContact O-CB 3.48Å; L419-C422 PolarHBondContact O-N 3.27Å; L419-T425 HydrophobicContact CD1-CG2 4.25Å; L419-T425 HydrophobicContact CD2-CG2 4.09Å; L419-R433 HydrophobicContact CD1-CB 3.66Å; L419-R433 HydrophobicContact CD1-CG 3.87Å; L419-R433 HydrophobicContact CD2-CG 4.46Å; L419-R433 HydrophobicContact CG-CB 4.47Å; L419-R433 HydrophobicContact CG-CG 4.42Å |
| 420 | A | 93.7 | Very high | 95.6 | Very high | 41 Ų | 41 | 75.8 Ų | 75.8 | 34% | 0.339 | 44% | 0.436 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -56.1 | -41.2 | -178.6 | 0 | 0 | 0 | 0 | 0 | 112.8 | C422 | A420-C422 VanDerWaalsContact C-N 3.26Å; A420-C422 PolarHBondContact O-N 3.44Å |
| 421 | D | 91.3 | Very high | 95.7 | Very high | 156 Ų | 156 | 75.8 Ų | 75.8 | 83% | 0.834 | 44% | 0.436 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -77.9 | -11 | -178.6 | -55.6 | -38.1 | 0 | 0 | 0 | 113.2 | L419 A423 | L419-D421 VanDerWaalsContact C-N 3.29Å; L419-D421 PolarHBondContact O-N 3.33Å; D421-A423 PolarHBondContact O-N 3.2Å |
| 422 | C | 90.2 | Very high | 95.7 | Very high | 59 Ų | 59 | 73.3 Ų | 73.3 | 40% | 0.399 | 43% | 0.427 | S | S | . | . | trans | -88.8 | 90.9 | -178 | -68.4 | 0 | 0 | 0 | 0 | 110.7 | R413 L419 A420 K424 T425 | R413-C422 PolarHBondContact NH1-O 3.28Å; L419-C422 WeakPolarHBondContact O-CB 3.48Å; L419-C422 PolarHBondContact O-N 3.27Å; A420-C422 VanDerWaalsContact C-N 3.26Å; A420-C422 PolarHBondContact O-N 3.44Å; C422-K424 PolarHBondContact O-N 3.1Å; C422-K424 VanDerWaalsContact O-N 3.12Å; C422-T425 WeakPolarHBondContact CB-OG1 3.4Å; C422-T425 PolarHBondContact O-N 2.97Å; C422-T425 PolarHBondContact O-OG1 2.97Å | ||
| 423 | A | 85.8 | Confident | 95.7 | Very high | 84 Ų | 84 | 76.4 Ų | 76.4 | 69% | 0.694 | 43% | 0.434 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -54.9 | -31.7 | -178 | 0 | 0 | 0 | 0 | 0 | 114.5 | R413 D421 | R413-A423 VanDerWaalsContact NH1-CA 3.35Å; D421-A423 PolarHBondContact O-N 3.2Å |
| 424 | K | 91.2 | Very high | 95.7 | Very high | 204 Ų | 204 | 76.1 Ų | 76.1 | 89% | 0.887 | 44% | 0.437 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -118.1 | 41.8 | -173.7 | -64.8 | -178.1 | 179.4 | 176.1 | 0 | 113.3 | C422 | C422-K424 PolarHBondContact O-N 3.1Å; C422-K424 VanDerWaalsContact O-N 3.12Å |
| 425 | T | 95.9 | Very high | 95.8 | Very high | 27 Ų | 27 | 76.4 Ų | 76.4 | 17% | 0.166 | 44% | 0.442 | C | S | . | . | trans | -70 | 128.4 | 176.9 | -52.6 | 0 | 0 | 0 | 0 | 111.2 | L419 C422 A429 I430 | L419-T425 HydrophobicContact CD1-CG2 4.25Å; L419-T425 HydrophobicContact CD2-CG2 4.09Å; C422-T425 WeakPolarHBondContact CB-OG1 3.4Å; C422-T425 PolarHBondContact O-N 2.97Å; C422-T425 PolarHBondContact O-OG1 2.97Å; T425-A429 HydrophobicContact CG2-CB 4.01Å; T425-I430 HydrophobicContact CG2-CD1 4.48Å; T425-I430 HydrophobicContact CG2-CG1 3.68Å | ||
| 426 | P | 97.3 | Very high | 95.8 | Very high | 79 Ų | 79 | 72.7 Ų | 72.7 | 51% | 0.513 | 42% | 0.424 | S | S | . | . | trans | -68.2 | 145.3 | 177.6 | 26.5 | -31.3 | 0 | 0 | 0 | 110.9 | V428 A429 I430 | P426-V428 VanDerWaalsContact C-N 3.25Å; P426-V428 PolarHBondContact O-N 2.84Å; P426-A429 HydrophobicContact CG-CB 3.7Å; P426-A429 WeakPolarHBondContact O-CB 3.36Å; P426-A429 PolarHBondContact O-N 3.29Å; P426-I430 PolarHBondContact O-N 3.23Å; P426-I430 VanDerWaalsContact O-N 3.13Å | ||
| 427 | K | 97.7 | Very high | 95.9 | Very high | 103 Ų | 103 | 75.8 Ų | 75.8 | 45% | 0.448 | 44% | 0.436 | S | S | . | . | H | α-helix | trans | -53.3 | -41 | -177.3 | -68.8 | -178.8 | 179.3 | 179.6 | 0 | 113.2 | F409 A429 I430 L431 | F409-K427 HydrophobicContact CD1-CB 4.22Å; F409-K427 HydrophobicContact CD1-CG 4.07Å; F409-K427 HydrophobicContact CD2-CD 4.15Å; F409-K427 HydrophobicContact CD2-CG 4.31Å; F409-K427 HydrophobicContact CE1-CB 3.8Å; F409-K427 HydrophobicContact CE1-CD 4.45Å; F409-K427 HydrophobicContact CE1-CG 4.04Å; F409-K427 HydrophobicContact CE2-CD 3.91Å; F409-K427 HydrophobicContact CE2-CG 4.31Å; F409-K427 HydrophobicContact CG-CG 4.22Å; F409-K427 HydrophobicContact CZ-CB 4.07Å; F409-K427 HydrophobicContact CZ-CD 4.08Å; F409-K427 HydrophobicContact CZ-CG 4.17Å; K427-A429 VanDerWaalsContact C-N 3.32Å; K427-A429 PolarHBondContact O-N 2.99Å; K427-I430 PolarHBondContact O-N 2.84Å; K427-L431 WeakPolarHBondContact O-CG 3.43Å; K427-L431 PolarHBondContact O-N 2.83Å; K427-L431 VanDerWaalsContact O-N 3.08Å |
| 428 | V | 98.3 | Very high | 96 | Very high | 102 Ų | 102 | 76.3 Ų | 76.3 | 62% | 0.618 | 43% | 0.433 | S | S | * | . | H | α-helix | trans | -63 | -39.8 | 178.6 | 69.7 | 0 | 0 | 0 | 0 | 111.5 | P426 I430 L431 T432 | P426-V428 VanDerWaalsContact C-N 3.25Å; P426-V428 PolarHBondContact O-N 2.84Å; V428-I430 PolarHBondContact O-N 3.42Å; V428-L431 PolarHBondContact O-N 2.82Å; V428-T432 WeakPolarHBondContact O-CB 3.49Å; V428-T432 PolarHBondContact O-N 3.08Å; V428-T432 PolarHBondContact O-OG1 2.9Å |
| 429 | A | 97.9 | Very high | 96.2 | Very high | 30 Ų | 30 | 79.1 Ų | 79.1 | 25% | 0.248 | 43% | 0.429 | C | S | . | . | H | α-helix | trans | -67.5 | -37.5 | 177 | 0 | 0 | 0 | 0 | 0 | 111.9 | T425 P426 K427 L431 T432 R433 | T425-A429 HydrophobicContact CG2-CB 4.01Å; P426-A429 HydrophobicContact CG-CB 3.7Å; P426-A429 WeakPolarHBondContact O-CB 3.36Å; P426-A429 PolarHBondContact O-N 3.29Å; K427-A429 VanDerWaalsContact C-N 3.32Å; K427-A429 PolarHBondContact O-N 2.99Å; A429-L431 VanDerWaalsContact C-N 3.33Å; A429-L431 PolarHBondContact O-N 3.43Å; A429-T432 PolarHBondContact O-N 2.98Å; A429-R433 VanDerWaalsContact O-CB 3.32Å; A429-R433 WeakPolarHBondContact O-CB 3.42Å; A429-R433 VanDerWaalsContact O-CG 3.25Å; A429-R433 WeakPolarHBondContact O-CG 3.45Å; A429-R433 PolarHBondContact O-N 3.21Å |
| 430 | I | 98.3 | Very high | 96.3 | Very high | 6 Ų | 6 | 83.9 Ų | 83.9 | 3% | 0.031 | 45% | 0.451 | C | S | . | . | H | α-helix | trans | -58.1 | -48.1 | 173.2 | -60.5 | 169.2 | 0 | 0 | 0 | 109.8 | F409 L412 R413 I416 T425 P426 K427 V428 A434 | F409-I430 HydrophobicContact CB-CD1 4.41Å; F409-I430 HydrophobicContact CD1-CB 4.31Å; F409-I430 HydrophobicContact CD1-CD1 4.03Å; F409-I430 HydrophobicContact CD1-CG2 4.21Å; L412-I430 HydrophobicContact CB-CG2 4.25Å; L412-I430 HydrophobicContact CD2-CG2 3.77Å; L412-I430 HydrophobicContact CG-CG2 3.78Å; R413-I430 HydrophobicContact CB-CD1 3.97Å; R413-I430 HydrophobicContact CB-CG1 4.15Å; R413-I430 HydrophobicContact CB-CG2 4.32Å; R413-I430 HydrophobicContact CG-CD1 4.34Å; R413-I430 HydrophobicContact CG-CG1 4.28Å; I416-I430 HydrophobicContact CD1-CG2 3.95Å; I416-I430 WeakPolarHBondContact CD1-O 3.38Å; T425-I430 HydrophobicContact CG2-CD1 4.48Å; T425-I430 HydrophobicContact CG2-CG1 3.68Å; P426-I430 PolarHBondContact O-N 3.23Å; P426-I430 VanDerWaalsContact O-N 3.13Å; K427-I430 PolarHBondContact O-N 2.84Å; V428-I430 PolarHBondContact O-N 3.42Å; I430-A434 WeakPolarHBondContact O-CB 3.48Å; I430-A434 PolarHBondContact O-N 2.84Å |
| 431 | L | 98.6 | Very high | 96.6 | Very high | 85 Ų | 85 | 85.7 Ų | 85.7 | 45% | 0.445 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -66.1 | -43.6 | -179.6 | -63.1 | 176.7 | 0 | 0 | 0 | 112.7 | F409 L412 K427 V428 A429 A434 T435 | F409-L431 HydrophobicContact CE1-CD1 4.29Å; F409-L431 HydrophobicContact CE1-CD2 3.81Å; F409-L431 HydrophobicContact CE1-CG 3.89Å; F409-L431 HydrophobicContact CZ-CD1 4.33Å; F409-L431 HydrophobicContact CZ-CD2 4.25Å; F409-L431 HydrophobicContact CZ-CG 4.39Å; L412-L431 HydrophobicContact CD2-CD2 4.25Å; K427-L431 WeakPolarHBondContact O-CG 3.43Å; K427-L431 PolarHBondContact O-N 2.83Å; K427-L431 VanDerWaalsContact O-N 3.08Å; V428-L431 PolarHBondContact O-N 2.82Å; A429-L431 VanDerWaalsContact C-N 3.33Å; A429-L431 PolarHBondContact O-N 3.43Å; L431-A434 PolarHBondContact O-N 3.17Å; L431-T435 PolarHBondContact O-N 3.27Å; L431-T435 PolarHBondContact O-OG1 3.16Å |
| 432 | T | 98.4 | Very high | 96.9 | Very high | 68 Ų | 68 | 83.5 Ų | 83.5 | 42% | 0.417 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -61 | -50.8 | 178.1 | -60.3 | 0 | 0 | 0 | 0 | 110.4 | V428 A429 A434 T435 E436 | V428-T432 WeakPolarHBondContact O-CB 3.49Å; V428-T432 PolarHBondContact O-N 3.08Å; V428-T432 PolarHBondContact O-OG1 2.9Å; A429-T432 PolarHBondContact O-N 2.98Å; T432-A434 PolarHBondContact O-N 3.25Å; T432-T435 PolarHBondContact O-N 2.92Å; T432-E436 WeakPolarHBondContact O-CG 3.42Å; T432-E436 PolarHBondContact O-N 3.46Å |
| 433 | R | 98.3 | Very high | 97.3 | Very high | 130 Ų | 130 | 84.4 Ų | 84.4 | 49% | 0.491 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -67.3 | -36 | 179.7 | -66.5 | -58.1 | -162.4 | 178.4 | 5.5 | 112.9 | I416 L419 A429 T435 E436 Y437 | I416-R433 HydrophobicContact CG2-CB 3.91Å; L419-R433 HydrophobicContact CD1-CB 3.66Å; L419-R433 HydrophobicContact CD1-CG 3.87Å; L419-R433 HydrophobicContact CD2-CG 4.46Å; L419-R433 HydrophobicContact CG-CB 4.47Å; L419-R433 HydrophobicContact CG-CG 4.42Å; A429-R433 VanDerWaalsContact O-CB 3.32Å; A429-R433 WeakPolarHBondContact O-CB 3.42Å; A429-R433 VanDerWaalsContact O-CG 3.25Å; A429-R433 WeakPolarHBondContact O-CG 3.45Å; A429-R433 PolarHBondContact O-N 3.21Å; R433-T435 VanDerWaalsContact C-N 3.28Å; R433-T435 PolarHBondContact O-N 2.96Å; R433-E436 VanDerWaalsContact CD-OE2 3.28Å; R433-E436 WeakPolarHBondContact CD-OE2 3.5Å; R433-E436 IonicContact CZ-OE2 3.75Å; R433-E436 IonicContact NE-OE2 2.81Å; R433-E436 IonicContact NH1-OE2 3.82Å; R433-E436 PolarHBondContact NH1-OE2 3.09Å; R433-E436 PolarHBondContact O-N 3.44Å; R433-Y437 VanDerWaalsContact O-CB 3.23Å; R433-Y437 WeakPolarHBondContact O-CB 3.28Å; R433-Y437 PolarHBondContact O-N 2.92Å |
| 434 | A | 98.6 | Very high | 97.9 | Very high | 21 Ų | 21 | 82.2 Ų | 82.2 | 17% | 0.174 | 42% | 0.424 | C | S | . | . | H | α-helix | trans | -58.5 | -44.1 | 173.3 | 0 | 0 | 0 | 0 | 0 | 111.2 | L412 I416 I430 L431 T432 Y437 L438 | L412-A434 HydrophobicContact CD1-CB 4.1Å; L412-A434 HydrophobicContact CD2-CB 4.27Å; L412-A434 HydrophobicContact CG-CB 4.41Å; I416-A434 HydrophobicContact CD1-CB 3.71Å; I416-A434 HydrophobicContact CG1-CB 4.37Å; I430-A434 WeakPolarHBondContact O-CB 3.48Å; I430-A434 PolarHBondContact O-N 2.84Å; L431-A434 PolarHBondContact O-N 3.17Å; T432-A434 PolarHBondContact O-N 3.25Å; A434-Y437 PolarHBondContact O-N 3.2Å; A434-L438 WeakPolarHBondContact O-CB 3.46Å; A434-L438 PolarHBondContact O-N 3.02Å |
| 435 | T | 98.6 | Very high | 98.3 | Very high | 82 Ų | 82 | 78.5 Ų | 78.5 | 50% | 0.503 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -66.8 | -45.3 | -179.6 | -54.2 | 0 | 0 | 0 | 0 | 111.3 | L431 T432 R433 Y437 L438 Q439 | L431-T435 PolarHBondContact O-N 3.27Å; L431-T435 PolarHBondContact O-OG1 3.16Å; T432-T435 PolarHBondContact O-N 2.92Å; R433-T435 VanDerWaalsContact C-N 3.28Å; R433-T435 PolarHBondContact O-N 2.96Å; T435-Y437 VanDerWaalsContact C-N 3.33Å; T435-Y437 PolarHBondContact O-N 3.15Å; T435-L438 PolarHBondContact O-N 3.12Å; T435-Q439 WeakPolarHBondContact O-CG 3.28Å; T435-Q439 PolarHBondContact O-N 3.48Å; T435-Q439 VanDerWaalsContact O-N 3.14Å |
| 436 | E | 98.4 | Very high | 98.4 | Very high | 69 Ų | 69 | 84.7 Ų | 84.7 | 32% | 0.322 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -59.1 | -45.3 | 174.1 | -71 | 172.1 | -173.4 | 0 | 0 | 111.3 | T432 R433 Q439 Q440 | T432-E436 WeakPolarHBondContact O-CG 3.42Å; T432-E436 PolarHBondContact O-N 3.46Å; R433-E436 VanDerWaalsContact CD-OE2 3.28Å; R433-E436 WeakPolarHBondContact CD-OE2 3.5Å; R433-E436 IonicContact CZ-OE2 3.75Å; R433-E436 IonicContact NE-OE2 2.81Å; R433-E436 IonicContact NH1-OE2 3.82Å; R433-E436 PolarHBondContact NH1-OE2 3.09Å; R433-E436 PolarHBondContact O-N 3.44Å; E436-Q439 PolarHBondContact O-N 3.1Å; E436-Q440 WeakPolarHBondContact O-CG 3.49Å; E436-Q440 PolarHBondContact O-N 2.82Å |
| 437 | Y | 98.6 | Very high | 98.5 | Very high | 74 Ų | 74 | 86.8 Ų | 86.8 | 29% | 0.29 | 44% | 0.438 | S | S | . | . | H | α-helix | trans | -65.4 | -41.2 | -179.5 | -176.5 | -132.8 | 0 | 0 | 0 | 112 | E415 P417 R433 A434 T435 Q439 Q440 L441 | E415-Y437 WeakPolarHBondContact O-CE1 3.2Å; P417-Y437 VanDerWaalsContact CD-CZ 3.49Å; P417-Y437 HydrophobicContact CG-CD2 4.19Å; P417-Y437 HydrophobicContact CG-CE1 4.2Å; P417-Y437 HydrophobicContact CG-CE2 3.63Å; R433-Y437 VanDerWaalsContact O-CB 3.23Å; R433-Y437 WeakPolarHBondContact O-CB 3.28Å; R433-Y437 PolarHBondContact O-N 2.92Å; A434-Y437 PolarHBondContact O-N 3.2Å; T435-Y437 VanDerWaalsContact C-N 3.33Å; T435-Y437 PolarHBondContact O-N 3.15Å; Y437-Q439 VanDerWaalsContact C-N 3.35Å; Y437-Q439 PolarHBondContact O-N 3.38Å; Y437-Q440 WeakPolarHBondContact O-CB 3.5Å; Y437-Q440 PolarHBondContact O-N 3Å; Y437-L441 HydrophobicContact CD1-CD1 4.07Å; Y437-L441 HydrophobicContact CD2-CG 4.23Å; Y437-L441 HydrophobicContact CE1-CD1 3.71Å; Y437-L441 HydrophobicContact CE1-CG 4.33Å; Y437-L441 HydrophobicContact CE2-CD1 4.18Å; Y437-L441 HydrophobicContact CE2-CD2 3.94Å; Y437-L441 HydrophobicContact CE2-CG 3.88Å; Y437-L441 HydrophobicContact CG-CD1 4.46Å; Y437-L441 WeakPolarHBondContact O-CG 3.49Å; Y437-L441 PolarHBondContact O-N 3.33Å |
| 438 | L | 98.6 | Very high | 98.5 | Very high | 97 Ų | 97 | 88.9 Ų | 88.9 | 51% | 0.508 | 45% | 0.447 | S | S | . | . | H | α-helix | trans | -58.9 | -45.1 | 174.6 | -169 | 81.8 | 0 | 0 | 0 | 111.7 | A434 T435 Q440 L441 H442 | A434-L438 WeakPolarHBondContact O-CB 3.46Å; A434-L438 PolarHBondContact O-N 3.02Å; T435-L438 PolarHBondContact O-N 3.12Å; L438-Q440 VanDerWaalsContact C-N 3.31Å; L438-Q440 PolarHBondContact O-N 3.26Å; L438-L441 PolarHBondContact O-N 3.46Å; L438-H442 PolarHBondContact O-CD2 2.88Å; L438-H442 PolarHBondContact O-N 3.41Å |
| 439 | Q | 98.6 | Very high | 98.5 | Very high | 125 Ų | 125 | 86.2 Ų | 86.2 | 58% | 0.584 | 43% | 0.431 | S | S | * | . | H | α-helix | trans | -62 | -39.6 | 177.2 | -70.8 | 175.9 | -3.9 | 0 | 0 | 112.2 | T435 E436 Y437 T443 | T435-Q439 WeakPolarHBondContact O-CG 3.28Å; T435-Q439 PolarHBondContact O-N 3.48Å; T435-Q439 VanDerWaalsContact O-N 3.14Å; E436-Q439 PolarHBondContact O-N 3.1Å; Y437-Q439 VanDerWaalsContact C-N 3.35Å; Y437-Q439 PolarHBondContact O-N 3.38Å; Q439-T443 PolarHBondContact O-N 3.28Å; Q439-T443 VanDerWaalsContact O-N 3.12Å; Q439-T443 PolarHBondContact O-OG1 3.42Å |
| 440 | Q | 98.6 | Very high | 98.6 | Very high | 119 Ų | 119 | 89.8 Ų | 89.8 | 56% | 0.556 | 44% | 0.443 | S | S | * | . | H | α-helix | trans | -64.2 | -46 | 175.1 | -69.4 | 170.2 | 20.9 | 0 | 0 | 111.3 | E436 Y437 L438 H442 T443 A444 | E436-Q440 WeakPolarHBondContact O-CG 3.49Å; E436-Q440 PolarHBondContact O-N 2.82Å; Y437-Q440 WeakPolarHBondContact O-CB 3.5Å; Y437-Q440 PolarHBondContact O-N 3Å; L438-Q440 VanDerWaalsContact C-N 3.31Å; L438-Q440 PolarHBondContact O-N 3.26Å; Q440-H442 PolarHBondContact O-N 3.49Å; Q440-T443 PolarHBondContact O-N 3.05Å; Q440-A444 WeakPolarHBondContact O-CB 3.43Å; Q440-A444 PolarHBondContact O-N 2.97Å |
| 441 | L | 98.6 | Very high | 98.6 | Very high | 79 Ų | 79 | 94.8 Ų | 94.8 | 41% | 0.414 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -59.4 | -45.3 | 177.4 | -73.3 | 176.7 | 0 | 0 | 0 | 111.9 | Y437 L438 T443 A444 E445 | Y437-L441 HydrophobicContact CD1-CD1 4.07Å; Y437-L441 HydrophobicContact CD2-CG 4.23Å; Y437-L441 HydrophobicContact CE1-CD1 3.71Å; Y437-L441 HydrophobicContact CE1-CG 4.33Å; Y437-L441 HydrophobicContact CE2-CD1 4.18Å; Y437-L441 HydrophobicContact CE2-CD2 3.94Å; Y437-L441 HydrophobicContact CE2-CG 3.88Å; Y437-L441 HydrophobicContact CG-CD1 4.46Å; Y437-L441 WeakPolarHBondContact O-CG 3.49Å; Y437-L441 PolarHBondContact O-N 3.33Å; L438-L441 PolarHBondContact O-N 3.46Å; L441-T443 VanDerWaalsContact C-N 3.3Å; L441-T443 PolarHBondContact O-N 3.08Å; L441-A444 PolarHBondContact O-N 2.86Å; L441-E445 WeakPolarHBondContact O-CB 3.29Å; L441-E445 PolarHBondContact O-N 2.87Å |
| 442 | H | 98.7 | Very high | 98.6 | Very high | 110 Ų | 110 | 96.4 Ų | 96.4 | 51% | 0.509 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -60.4 | -40.9 | 176.8 | -76.4 | -145.2 | 0 | 0 | 0 | 111.9 | L438 Q440 K446 | L438-H442 PolarHBondContact O-CD2 2.88Å; L438-H442 PolarHBondContact O-N 3.41Å; Q440-H442 PolarHBondContact O-N 3.49Å; H442-K446 PolarHBondContact O-N 3.45Å; H442-K446 VanDerWaalsContact O-N 3.09Å |
| 443 | T | 98.7 | Very high | 98.6 | Very high | 79 Ų | 79 | 97.3 Ų | 97.3 | 49% | 0.485 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -66.2 | -44.6 | 178 | -56.2 | 0 | 0 | 0 | 0 | 110.9 | Q439 Q440 L441 K446 Q447 | Q439-T443 PolarHBondContact O-N 3.28Å; Q439-T443 VanDerWaalsContact O-N 3.12Å; Q439-T443 PolarHBondContact O-OG1 3.42Å; Q440-T443 PolarHBondContact O-N 3.05Å; L441-T443 VanDerWaalsContact C-N 3.3Å; L441-T443 PolarHBondContact O-N 3.08Å; T443-K446 PolarHBondContact O-N 2.93Å; T443-Q447 WeakPolarHBondContact O-CG 3.36Å; T443-Q447 PolarHBondContact O-N 3.32Å |
| 444 | A | 98.6 | Very high | 98.6 | Very high | 37 Ų | 37 | 96.6 Ų | 96.6 | 31% | 0.306 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -64.7 | -40.5 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | Q440 L441 Q447 K448 | Q440-A444 WeakPolarHBondContact O-CB 3.43Å; Q440-A444 PolarHBondContact O-N 2.97Å; L441-A444 PolarHBondContact O-N 2.86Å; A444-Q447 PolarHBondContact O-N 3.26Å; A444-K448 WeakPolarHBondContact O-CB 3.38Å; A444-K448 WeakPolarHBondContact O-CG 3.24Å; A444-K448 PolarHBondContact O-N 3.5Å |
| 445 | E | 98.6 | Very high | 98.6 | Very high | 127 Ų | 127 | 100.1 Ų | 100.1 | 59% | 0.593 | 48% | 0.482 | S | S | * | . | H | α-helix | trans | -60.4 | -46.2 | 175.2 | -178.2 | -178.5 | -152.7 | 0 | 0 | 111.5 | L441 Q447 K448 T449 | L441-E445 WeakPolarHBondContact O-CB 3.29Å; L441-E445 PolarHBondContact O-N 2.87Å; E445-Q447 PolarHBondContact O-N 3.34Å; E445-K448 PolarHBondContact O-N 3.39Å; E445-T449 VanDerWaalsContact O-CB 3.31Å; E445-T449 WeakPolarHBondContact O-CB 3.39Å; E445-T449 PolarHBondContact O-N 2.8Å; E445-T449 PolarHBondContact O-OG1 3.3Å |
| 446 | K | 98.6 | Very high | 98.6 | Very high | 156 Ų | 156 | 100.9 Ų | 100.9 | 68% | 0.678 | 48% | 0.478 | S | S | * | . | H | α-helix | trans | -60.7 | -44.1 | 176.7 | -175 | 178.2 | 178.9 | 179.2 | 0 | 111.8 | H442 T443 T449 Q450 | H442-K446 PolarHBondContact O-N 3.45Å; H442-K446 VanDerWaalsContact O-N 3.09Å; T443-K446 PolarHBondContact O-N 2.93Å; K446-T449 PolarHBondContact O-N 3.17Å; K446-Q450 WeakPolarHBondContact O-CB 3.41Å; K446-Q450 PolarHBondContact O-N 2.95Å |
| 447 | Q | 98.6 | Very high | 98.6 | Very high | 123 Ų | 123 | 100.5 Ų | 100.5 | 58% | 0.575 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -62.4 | -51.1 | 177.7 | -73.6 | 176.9 | 1.7 | 0 | 0 | 111.7 | T443 A444 E445 T449 Q450 E451 | T443-Q447 WeakPolarHBondContact O-CG 3.36Å; T443-Q447 PolarHBondContact O-N 3.32Å; A444-Q447 PolarHBondContact O-N 3.26Å; E445-Q447 PolarHBondContact O-N 3.34Å; Q447-T449 PolarHBondContact O-N 2.87Å; Q447-Q450 WeakPolarHBondContact O-CB 3.43Å; Q447-Q450 PolarHBondContact O-N 2.92Å; Q447-Q450 VanDerWaalsContact O-N 3.1Å; Q447-E451 PolarHBondContact O-N 3.41Å |
| 448 | K | 98.6 | Very high | 98.6 | Very high | 148 Ų | 148 | 104.9 Ų | 104.9 | 64% | 0.643 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -59.1 | -38.2 | 177.1 | -74.6 | -178.2 | 178.1 | 178.9 | 0 | 111.9 | A444 E445 E451 R452 | A444-K448 WeakPolarHBondContact O-CB 3.38Å; A444-K448 WeakPolarHBondContact O-CG 3.24Å; A444-K448 PolarHBondContact O-N 3.5Å; E445-K448 PolarHBondContact O-N 3.39Å; K448-E451 PolarHBondContact O-N 3.23Å; K448-R452 VanDerWaalsContact O-CB 3.31Å; K448-R452 WeakPolarHBondContact O-CB 3.47Å; K448-R452 PolarHBondContact O-N 3.14Å |
| 449 | T | 98.4 | Very high | 98.6 | Very high | 46 Ų | 46 | 105.9 Ų | 105.9 | 28% | 0.282 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -64.7 | -43.1 | 176.1 | -62.3 | 0 | 0 | 0 | 0 | 111.7 | E445 K446 Q447 R452 K453 | E445-T449 VanDerWaalsContact O-CB 3.31Å; E445-T449 WeakPolarHBondContact O-CB 3.39Å; E445-T449 PolarHBondContact O-N 2.8Å; E445-T449 PolarHBondContact O-OG1 3.3Å; K446-T449 PolarHBondContact O-N 3.17Å; Q447-T449 PolarHBondContact O-N 2.87Å; T449-R452 PolarHBondContact O-N 3.31Å; T449-K453 WeakPolarHBondContact O-CG 3.42Å; T449-K453 PolarHBondContact O-N 2.97Å; T449-K453 VanDerWaalsContact O-N 3.09Å |
| 450 | Q | 98.7 | Very high | 98.6 | Very high | 105 Ų | 105 | 105.8 Ų | 105.8 | 49% | 0.491 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -64.8 | -44.9 | 176.4 | -179.5 | 175.4 | -7.1 | 0 | 0 | 111.7 | K446 Q447 R452 K453 Q454 | K446-Q450 WeakPolarHBondContact O-CB 3.41Å; K446-Q450 PolarHBondContact O-N 2.95Å; Q447-Q450 WeakPolarHBondContact O-CB 3.43Å; Q447-Q450 PolarHBondContact O-N 2.92Å; Q447-Q450 VanDerWaalsContact O-N 3.1Å; Q450-R452 PolarHBondContact O-N 2.76Å; Q450-K453 WeakPolarHBondContact O-CB 3.49Å; Q450-K453 PolarHBondContact O-N 2.81Å; Q450-Q454 WeakPolarHBondContact O-CG 3.46Å; Q450-Q454 PolarHBondContact O-N 2.9Å |
| 451 | E | 98.6 | Very high | 98.6 | Very high | 110 Ų | 110 | 106.6 Ų | 106.6 | 51% | 0.514 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -59.6 | -46.4 | 175.9 | -175.8 | -178.8 | -175.4 | 0 | 0 | 111 | Q447 K448 K453 Q454 L455 | Q447-E451 PolarHBondContact O-N 3.41Å; K448-E451 PolarHBondContact O-N 3.23Å; E451-K453 VanDerWaalsContact C-N 3.28Å; E451-K453 PolarHBondContact O-N 2.82Å; E451-Q454 WeakPolarHBondContact O-CB 3.39Å; E451-Q454 PolarHBondContact O-N 2.78Å; E451-Q454 VanDerWaalsContact O-N 3.09Å; E451-L455 HydrophobicContact CG-CD1 3.95Å; E451-L455 HydrophobicContact CG-CG 4.27Å; E451-L455 WeakPolarHBondContact O-CB 3.44Å; E451-L455 WeakPolarHBondContact O-CG 3.25Å; E451-L455 PolarHBondContact O-N 3.14Å |
| 452 | R | 98.6 | Very high | 98.6 | Very high | 119 Ų | 119 | 107 Ų | 107 | 45% | 0.449 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -55.3 | -43.2 | 175.1 | -176.4 | 176.2 | 66.7 | 166.3 | 4.6 | 111.8 | K448 T449 Q450 K456 | K448-R452 VanDerWaalsContact O-CB 3.31Å; K448-R452 WeakPolarHBondContact O-CB 3.47Å; K448-R452 PolarHBondContact O-N 3.14Å; T449-R452 PolarHBondContact O-N 3.31Å; Q450-R452 PolarHBondContact O-N 2.76Å; R452-K456 WeakPolarHBondContact O-CB 3.35Å; R452-K456 WeakPolarHBondContact O-CG 3.49Å; R452-K456 PolarHBondContact O-N 3.3Å |
| 453 | K | 98.6 | Very high | 98.6 | Very high | 88 Ų | 88 | 106.2 Ų | 106.2 | 38% | 0.383 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -63.6 | -44.9 | 176 | -70.9 | -178.4 | -174.8 | -169.1 | 0 | 111.8 | T449 Q450 E451 K456 A457 | T449-K453 WeakPolarHBondContact O-CG 3.42Å; T449-K453 PolarHBondContact O-N 2.97Å; T449-K453 VanDerWaalsContact O-N 3.09Å; Q450-K453 WeakPolarHBondContact O-CB 3.49Å; Q450-K453 PolarHBondContact O-N 2.81Å; E451-K453 VanDerWaalsContact C-N 3.28Å; E451-K453 PolarHBondContact O-N 2.82Å; K453-K456 PolarHBondContact O-N 3.47Å; K453-A457 WeakPolarHBondContact O-CB 3.39Å; K453-A457 PolarHBondContact O-N 3.42Å |
| 454 | Q | 98.7 | Very high | 98.6 | Very high | 114 Ų | 114 | 108.2 Ų | 108.2 | 53% | 0.533 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -62.7 | -43.8 | 178.2 | -70.4 | 174.7 | 4 | 0 | 0 | 112 | Q450 E451 A457 R458 | Q450-Q454 WeakPolarHBondContact O-CG 3.46Å; Q450-Q454 PolarHBondContact O-N 2.9Å; E451-Q454 WeakPolarHBondContact O-CB 3.39Å; E451-Q454 PolarHBondContact O-N 2.78Å; E451-Q454 VanDerWaalsContact O-N 3.09Å; Q454-A457 PolarHBondContact O-N 3.04Å; Q454-R458 WeakPolarHBondContact O-CB 3.32Å; Q454-R458 PolarHBondContact O-N 3.41Å |
| 455 | L | 98.8 | Very high | 98.5 | Very high | 96 Ų | 96 | 114.3 Ų | 114.3 | 50% | 0.503 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -65.7 | -42.4 | 178.1 | -69.2 | 176.2 | 0 | 0 | 0 | 111.7 | E451 A457 R458 Q459 | E451-L455 HydrophobicContact CG-CD1 3.95Å; E451-L455 HydrophobicContact CG-CG 4.27Å; E451-L455 WeakPolarHBondContact O-CB 3.44Å; E451-L455 WeakPolarHBondContact O-CG 3.25Å; E451-L455 PolarHBondContact O-N 3.14Å; L455-A457 PolarHBondContact O-N 3.18Å; L455-R458 PolarHBondContact O-N 3.21Å; L455-Q459 WeakPolarHBondContact O-CB 3.37Å; L455-Q459 PolarHBondContact O-N 3.14Å |
| 456 | K | 98.5 | Very high | 98.5 | Very high | 98 Ų | 98 | 113 Ų | 113 | 43% | 0.426 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -59.6 | -45.2 | 173.3 | -77.9 | -176.3 | 176.6 | -172.8 | 0 | 111.6 | D90 R452 K453 R458 Q459 L460 | D90-K456 IonicContact OD2-NZ 3.92Å; R452-K456 WeakPolarHBondContact O-CB 3.35Å; R452-K456 WeakPolarHBondContact O-CG 3.49Å; R452-K456 PolarHBondContact O-N 3.3Å; K453-K456 PolarHBondContact O-N 3.47Å; K456-R458 PolarHBondContact O-N 3.5Å; K456-Q459 WeakPolarHBondContact O-CB 3.29Å; K456-Q459 PolarHBondContact O-N 3.47Å; K456-L460 PolarHBondContact O-N 3.23Å |
| 457 | A | 98.6 | Very high | 98.5 | Very high | 61 Ų | 61 | 107.5 Ų | 107.5 | 50% | 0.504 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -61.9 | -43.8 | 177.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | K453 Q454 L455 L460 Q461 | K453-A457 WeakPolarHBondContact O-CB 3.39Å; K453-A457 PolarHBondContact O-N 3.42Å; Q454-A457 PolarHBondContact O-N 3.04Å; L455-A457 PolarHBondContact O-N 3.18Å; A457-L460 PolarHBondContact O-N 3.21Å; A457-Q461 PolarHBondContact O-N 3.41Å |
| 458 | R | 98.6 | Very high | 98.4 | Very high | 165 Ų | 165 | 107.2 Ų | 107.2 | 62% | 0.623 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -64 | -41.6 | 176.1 | -174.1 | 176.3 | -178.5 | -179.6 | 0.3 | 111.9 | Q454 L455 K456 L460 Q461 L462 | Q454-R458 WeakPolarHBondContact O-CB 3.32Å; Q454-R458 PolarHBondContact O-N 3.41Å; L455-R458 PolarHBondContact O-N 3.21Å; K456-R458 PolarHBondContact O-N 3.5Å; R458-L460 VanDerWaalsContact C-N 3.34Å; R458-Q461 PolarHBondContact O-N 3.11Å; R458-L462 HydrophobicContact CG-CD1 4.18Å; R458-L462 VanDerWaalsContact O-CG 3.28Å; R458-L462 WeakPolarHBondContact O-CG 3.46Å; R458-L462 PolarHBondContact O-N 3.26Å |
| 459 | Q | 98.5 | Very high | 98.3 | Very high | 119 Ų | 119 | 105.1 Ų | 105.1 | 56% | 0.556 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -58.7 | -47.5 | 175.7 | -177.6 | -175 | 12.3 | 0 | 0 | 110.7 | L455 K456 Q461 L462 L463 | L455-Q459 WeakPolarHBondContact O-CB 3.37Å; L455-Q459 PolarHBondContact O-N 3.14Å; K456-Q459 WeakPolarHBondContact O-CB 3.29Å; K456-Q459 PolarHBondContact O-N 3.47Å; Q459-Q461 PolarHBondContact O-N 3.46Å; Q459-L462 PolarHBondContact O-N 3.31Å; Q459-L463 HydrophobicContact CG-CD1 4.24Å; Q459-L463 WeakPolarHBondContact O-CG 3.46Å; Q459-L463 PolarHBondContact O-N 3.23Å |
| 460 | L | 98.6 | Very high | 98.2 | Very high | 123 Ų | 123 | 111.6 Ų | 111.6 | 64% | 0.644 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -60.4 | -45.1 | 177.7 | -176.2 | 64.9 | 0 | 0 | 0 | 111.8 | K456 A457 R458 L462 L463 Q464 | K456-L460 PolarHBondContact O-N 3.23Å; A457-L460 PolarHBondContact O-N 3.21Å; R458-L460 VanDerWaalsContact C-N 3.34Å; L460-L462 VanDerWaalsContact C-N 3.32Å; L460-L462 PolarHBondContact O-N 3.27Å; L460-L463 PolarHBondContact O-N 3.41Å; L460-Q464 PolarHBondContact O-N 3.33Å |
| 461 | Q | 98.6 | Very high | 97.8 | Very high | 135 Ų | 135 | 117.1 Ų | 117.1 | 63% | 0.631 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -59.3 | -42.9 | 176.6 | -176 | -173.1 | -16 | 0 | 0 | 112 | A457 R458 Q459 Q464 R465 | A457-Q461 PolarHBondContact O-N 3.41Å; R458-Q461 PolarHBondContact O-N 3.11Å; Q459-Q461 PolarHBondContact O-N 3.46Å; Q461-Q464 PolarHBondContact O-N 3.04Å; Q461-R465 PolarHBondContact O-N 3.46Å |
| 462 | L | 98.6 | Very high | 96.9 | Very high | 87 Ų | 87 | 118.4 Ų | 118.4 | 46% | 0.455 | 57% | 0.568 | S | S | . | * | H | α-helix | trans | -67.3 | -40.6 | 178.3 | -70.4 | 172.5 | 0 | 0 | 0 | 111.8 | R458 Q459 L460 R465 L466 | R458-L462 HydrophobicContact CG-CD1 4.18Å; R458-L462 VanDerWaalsContact O-CG 3.28Å; R458-L462 WeakPolarHBondContact O-CG 3.46Å; R458-L462 PolarHBondContact O-N 3.26Å; Q459-L462 PolarHBondContact O-N 3.31Å; L460-L462 VanDerWaalsContact C-N 3.32Å; L460-L462 PolarHBondContact O-N 3.27Å; L462-R465 PolarHBondContact O-N 3.09Å; L462-L466 WeakPolarHBondContact O-CG 3.24Å; L462-L466 PolarHBondContact O-N 2.8Å |
| 463 | L | 98.3 | Very high | 96.8 | Very high | 95 Ų | 95 | 118.4 Ų | 118.4 | 50% | 0.497 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -62 | -43.1 | 174.9 | -72.7 | 173 | 0 | 0 | 0 | 111.7 | Q459 L460 R465 L466 A467 | Q459-L463 HydrophobicContact CG-CD1 4.24Å; Q459-L463 WeakPolarHBondContact O-CG 3.46Å; Q459-L463 PolarHBondContact O-N 3.23Å; L460-L463 PolarHBondContact O-N 3.41Å; L463-R465 VanDerWaalsContact C-N 3.34Å; L463-R465 PolarHBondContact O-N 2.82Å; L463-L466 PolarHBondContact O-N 2.84Å; L463-A467 WeakPolarHBondContact O-CB 3.44Å; L463-A467 PolarHBondContact O-N 3.42Å |
| 464 | Q | 98 | Very high | 96.7 | Very high | 120 Ų | 120 | 120 Ų | 120 | 56% | 0.561 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -61 | -43.5 | 175.3 | -172.5 | -178.8 | 7.7 | 0 | 0 | 111.5 | L460 Q461 A467 Q468 | L460-Q464 PolarHBondContact O-N 3.33Å; Q461-Q464 PolarHBondContact O-N 3.04Å; Q464-A467 PolarHBondContact O-N 3.09Å; Q464-Q468 WeakPolarHBondContact O-CG 3.42Å; Q464-Q468 PolarHBondContact O-N 3.43Å |
| 465 | R | 98.2 | Very high | 96.6 | Very high | 166 Ų | 166 | 120.3 Ų | 120.3 | 63% | 0.626 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -63.4 | -42.9 | 176.6 | -173.1 | 175.6 | -179.1 | 172.8 | 0.5 | 112 | Q461 L462 L463 A467 Q468 L469 | Q461-R465 PolarHBondContact O-N 3.46Å; L462-R465 PolarHBondContact O-N 3.09Å; L463-R465 VanDerWaalsContact C-N 3.34Å; L463-R465 PolarHBondContact O-N 2.82Å; R465-A467 VanDerWaalsContact C-N 3.31Å; R465-A467 PolarHBondContact O-N 2.87Å; R465-Q468 PolarHBondContact O-N 3.44Å; R465-L469 HydrophobicContact CG-CD1 4.25Å; R465-L469 WeakPolarHBondContact O-CG 3.24Å; R465-L469 PolarHBondContact O-N 2.94Å |
| 466 | L | 98.3 | Very high | 96.5 | Very high | 99 Ų | 99 | 121.8 Ų | 121.8 | 52% | 0.518 | 59% | 0.591 | S | S | . | * | H | α-helix | trans | -61.5 | -40.7 | 174.7 | -75.7 | 173.9 | 0 | 0 | 0 | 111.6 | L462 L463 L469 K470 | L462-L466 WeakPolarHBondContact O-CG 3.24Å; L462-L466 PolarHBondContact O-N 2.8Å; L463-L466 PolarHBondContact O-N 2.84Å; L466-L469 PolarHBondContact O-N 3.39Å; L466-K470 WeakPolarHBondContact O-CG 3.47Å; L466-K470 PolarHBondContact O-N 2.98Å |
| 467 | A | 97.5 | Very high | 96.3 | Very high | 41 Ų | 41 | 123.3 Ų | 123.3 | 34% | 0.339 | 60% | 0.602 | S | S | . | * | H | α-helix | trans | -64.5 | -38.9 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | L463 Q464 R465 K470 R471 | L463-A467 WeakPolarHBondContact O-CB 3.44Å; L463-A467 PolarHBondContact O-N 3.42Å; Q464-A467 PolarHBondContact O-N 3.09Å; R465-A467 VanDerWaalsContact C-N 3.31Å; R465-A467 PolarHBondContact O-N 2.87Å; A467-K470 PolarHBondContact O-N 3.22Å; A467-R471 WeakPolarHBondContact O-CG 3.15Å; A467-R471 PolarHBondContact O-N 3.42Å |
| 468 | Q | 97.2 | Very high | 96.2 | Very high | 116 Ų | 116 | 127.4 Ų | 127.4 | 54% | 0.542 | 61% | 0.608 | S | S | . | * | H | α-helix | trans | -64 | -46.7 | 174.4 | -71.4 | 172.4 | -3.7 | 0 | 0 | 111.6 | Q464 R465 K470 R471 S472 | Q464-Q468 WeakPolarHBondContact O-CG 3.42Å; Q464-Q468 PolarHBondContact O-N 3.43Å; R465-Q468 PolarHBondContact O-N 3.44Å; Q468-K470 VanDerWaalsContact C-N 3.25Å; Q468-K470 PolarHBondContact O-N 3.22Å; Q468-R471 PolarHBondContact O-N 2.92Å; Q468-S472 PolarHBondContact O-N 3.05Å |
| 469 | L | 97.3 | Very high | 96 | Very high | 104 Ų | 104 | 124.7 Ų | 124.7 | 55% | 0.545 | 61% | 0.607 | S | S | . | * | H | α-helix | trans | -67.2 | -22.9 | 179.8 | -69.8 | 173.8 | 0 | 0 | 0 | 113.9 | R465 L466 S472 | R465-L469 HydrophobicContact CG-CD1 4.25Å; R465-L469 WeakPolarHBondContact O-CG 3.24Å; R465-L469 PolarHBondContact O-N 2.94Å; L466-L469 PolarHBondContact O-N 3.39Å; L469-S472 WeakPolarHBondContact CA-OG 3.43Å; L469-S472 PolarHBondContact O-OG 3.46Å |
| 470 | K | 95.3 | Very high | 95.8 | Very high | 182 Ų | 182 | 125.2 Ų | 125.2 | 79% | 0.791 | 61% | 0.611 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79.9 | -17.6 | 172.7 | -76.5 | -178.7 | 175.8 | -174.9 | 0 | 113.4 | L466 A467 Q468 | L466-K470 WeakPolarHBondContact O-CG 3.47Å; L466-K470 PolarHBondContact O-N 2.98Å; A467-K470 PolarHBondContact O-N 3.22Å; Q468-K470 VanDerWaalsContact C-N 3.25Å; Q468-K470 PolarHBondContact O-N 3.22Å |
| 471 | R | 90.8 | Very high | 95.6 | Very high | 222 Ų | 222 | 125.3 Ų | 125.3 | 84% | 0.838 | 61% | 0.608 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -94.3 | -24.6 | -179.6 | -70.5 | 174.1 | -175.9 | -173.8 | 1.6 | 112.6 | A467 Q468 | A467-R471 WeakPolarHBondContact O-CG 3.15Å; A467-R471 PolarHBondContact O-N 3.42Å; Q468-R471 PolarHBondContact O-N 2.92Å |
| 472 | S | 79.2 | Confident | 95.3 | Very high | 137 Ų | 137 | 124.5 Ų | 124.5 | 96% | 0.958 | 61% | 0.606 | S | S | * | * | trans | -76.3 | 0 | 164.9 | 58.3 | 0 | 0 | 0 | 0 | 110.4 | Q468 L469 | Q468-S472 PolarHBondContact O-N 3.05Å; L469-S472 WeakPolarHBondContact CA-OG 3.43Å; L469-S472 PolarHBondContact O-OG 3.46Å |
Retrieved 472 of 472 residues in 101.8 ms
(Link to these results)