| 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 | 56.4 | Low | 54.7 | Low | 247 Ų | 247 | 156.7 Ų | 156.7 | 100% | 1.217 | 83% | 0.829 | S | S | * | * | 0 | 112.6 | 0 | -78.2 | 171.7 | -175.2 | 0 | 0 | 107.8 | |||||
| 2 | I | 49.2 | Very low | 55 | Low | 176 Ų | 176 | 159.4 Ų | 159.4 | 90% | 0.903 | 82% | 0.822 | S | S | * | * | trans | -90.9 | 121.2 | -178.9 | 18.3 | 172.7 | 0 | 0 | 0 | 107.9 | S4 | I2-S4 PolarHBondContact O-N 3.25Š| ||
| 3 | M | 54 | Low | 55.8 | Low | 187 Ų | 187 | 158.5 Ų | 158.5 | 92% | 0.921 | 82% | 0.817 | S | S | * | * | trans | -76.6 | 109.6 | 175.7 | -68 | 174.5 | 70.7 | 0 | 0 | 108.4 | S5 | M3-S5 PolarHBondContact O-N 3.49Š| ||
| 4 | S | 46.5 | Very low | 56.4 | Low | 83 Ų | 83 | 158.2 Ų | 158.2 | 58% | 0.58 | 81% | 0.81 | S | S | * | * | trans | -63.2 | 126 | -179.9 | -175.5 | 0 | 0 | 0 | 0 | 111.6 | I2 Y6 | I2-S4 PolarHBondContact O-N 3.25Å; S4-Y6 PolarHBondContact O-N 3.04Å; S4-Y6 WeakPolarHBondContact OG-CE2 3.49Å | ||
| 5 | S | 51.2 | Low | 56.6 | Low | 106 Ų | 106 | 152.7 Ų | 152.7 | 74% | 0.741 | 79% | 0.789 | S | S | * | * | trans | -87 | 87.1 | -179.5 | 46.5 | 0 | 0 | 0 | 0 | 111.8 | M3 L7 | M3-S5 PolarHBondContact O-N 3.49Å; S5-L7 PolarHBondContact O-N 3.47Å; S5-L7 VanDerWaalsContact O-N 3.16Å | ||
| 6 | Y | 55.9 | Low | 57.6 | Low | 203 Ų | 203 | 150 Ų | 150 | 80% | 0.796 | 79% | 0.787 | S | S | * | * | trans | -86.1 | 72.5 | 173 | -67.3 | -82.3 | 0 | 0 | 0 | 112 | S4 | S4-Y6 PolarHBondContact O-N 3.04Å; S4-Y6 WeakPolarHBondContact OG-CE2 3.49Å | ||
| 7 | L | 66.3 | Low | 57.8 | Low | 155 Ų | 155 | 151 Ų | 151 | 81% | 0.812 | 78% | 0.784 | S | S | * | * | trans | -148 | 22.5 | 165.5 | -87.3 | -176.8 | 0 | 0 | 0 | 114 | S5 | S5-L7 PolarHBondContact O-N 3.47Å; S5-L7 VanDerWaalsContact O-N 3.16Å | ||
| 8 | I | 61.6 | Low | 58.5 | Low | 154 Ų | 154 | 146.7 Ų | 146.7 | 79% | 0.79 | 77% | 0.767 | S | S | * | * | S | Bend | trans | -92.7 | -12.8 | -178.3 | -120.8 | 76.9 | 0 | 0 | 0 | 115 | ||
| 9 | N | 51.2 | Low | 58.6 | Low | 154 Ų | 154 | 143.4 Ų | 143.4 | 82% | 0.824 | 76% | 0.755 | S | S | * | * | trans | -128.2 | 55.9 | -173.6 | -73.8 | 0.8 | 0 | 0 | 0 | 114.1 | ||||
| 10 | S | 52.5 | Low | 58.5 | Low | 94 Ų | 94 | 141.3 Ų | 141.3 | 66% | 0.657 | 75% | 0.752 | S | S | * | * | trans | -111.5 | 121.5 | 157.6 | -70.9 | 0 | 0 | 0 | 0 | 107.9 | Y12 | S10-Y12 PolarHBondContact O-N 2.7Š| ||
| 11 | N | 57.2 | Low | 58.5 | Low | 165 Ų | 165 | 140.1 Ų | 140.1 | 88% | 0.882 | 75% | 0.746 | S | S | * | * | trans | -64 | 79.6 | 160.9 | -79 | -61.1 | 0 | 0 | 0 | 107.2 | I13 | N11-I13 VanDerWaalsContact C-N 3.3Å; N11-I13 PolarHBondContact O-N 3.16Å | ||
| 12 | Y | 57.6 | Low | 58.6 | Low | 189 Ų | 189 | 134 Ų | 134 | 74% | 0.741 | 71% | 0.714 | S | S | * | * | trans | -75.6 | 90.4 | 174.2 | -165.8 | -93 | 0 | 0 | 0 | 106.3 | S10 E14 | S10-Y12 PolarHBondContact O-N 2.7Å; Y12-E14 VanDerWaalsContact C-N 3.3Å; Y12-E14 PolarHBondContact O-N 3.33Å | ||
| 13 | I | 65.4 | Low | 58.9 | Low | 147 Ų | 147 | 132.1 Ų | 132.1 | 75% | 0.754 | 70% | 0.697 | S | S | * | * | trans | -66.1 | 102 | 161.4 | -70.6 | 114.4 | 0 | 0 | 0 | 105.4 | N11 P15 | N11-I13 VanDerWaalsContact C-N 3.3Å; N11-I13 PolarHBondContact O-N 3.16Å; I13-P15 WeakPolarHBondContact O-CD 3.3Å | ||
| 14 | E | 64.5 | Low | 59 | Low | 155 Ų | 155 | 130.7 Ų | 130.7 | 72% | 0.724 | 69% | 0.688 | S | S | * | * | trans | -51.9 | 122 | 164.5 | -176.8 | 175.2 | -143.3 | 0 | 0 | 107 | Y12 S16 | Y12-E14 VanDerWaalsContact C-N 3.3Å; Y12-E14 PolarHBondContact O-N 3.33Å; E14-S16 PolarHBondContact O-N 3.42Å | ||
| 15 | P | 59.9 | Low | 59.5 | Low | 76 Ų | 76 | 134.2 Ų | 134.2 | 49% | 0.494 | 70% | 0.695 | S | S | . | * | trans | -60 | 106.4 | 174.7 | 23.8 | -30.8 | 0 | 0 | 0 | 107 | I13 F17 | I13-P15 WeakPolarHBondContact O-CD 3.3Å; P15-F17 VanDerWaalsContact C-N 3.26Å; P15-F17 HydrophobicContact CB-CE2 4.25Å; P15-F17 HydrophobicContact CG-CE2 3.97Å; P15-F17 VanDerWaalsContact O-CD2 3.29Å; P15-F17 WeakPolarHBondContact O-CD2 3.44Å; P15-F17 PolarHBondContact O-N 3.38Å | ||
| 16 | S | 72.7 | Confident | 59.3 | Low | 109 Ų | 109 | 135.1 Ų | 135.1 | 76% | 0.762 | 69% | 0.692 | S | S | * | * | trans | -64.3 | 96 | 171.4 | -179.8 | 0 | 0 | 0 | 0 | 106.4 | E14 | E14-S16 PolarHBondContact O-N 3.42Š| ||
| 17 | F | 61.1 | Low | 59.2 | Low | 167 Ų | 167 | 128.4 Ų | 128.4 | 73% | 0.732 | 68% | 0.684 | S | S | * | * | P | Polyproline II helix | trans | -64.7 | 125.9 | 163.9 | -75.1 | -84.9 | 0 | 0 | 0 | 106.1 | P15 | P15-F17 VanDerWaalsContact C-N 3.26Å; P15-F17 HydrophobicContact CB-CE2 4.25Å; P15-F17 HydrophobicContact CG-CE2 3.97Å; P15-F17 VanDerWaalsContact O-CD2 3.29Å; P15-F17 WeakPolarHBondContact O-CD2 3.44Å; P15-F17 PolarHBondContact O-N 3.38Å |
| 18 | P | 69.4 | Low | 58.7 | Low | 74 Ų | 74 | 130.4 Ų | 130.4 | 48% | 0.481 | 68% | 0.682 | S | S | . | * | P | Polyproline II helix | trans | -50.9 | 133.2 | 176.8 | -22.1 | 30 | 0 | 0 | 0 | 108.8 | C20 | P18-C20 PolarHBondContact O-N 3.12Š|
| 19 | P | 61.1 | Low | 58.5 | Low | 83 Ų | 83 | 128.2 Ų | 128.2 | 54% | 0.539 | 67% | 0.671 | S | S | . | * | P | Polyproline II helix | trans | -48.7 | 133.7 | 170.7 | -23.5 | 32.1 | 0 | 0 | 0 | 108.9 | D21 E22 | P19-D21 PolarHBondContact O-N 2.83Å; P19-E22 PolarHBondContact O-N 3.31Å; P19-E22 VanDerWaalsContact O-N 3.09Å |
| 20 | C | 56.1 | Low | 58.6 | Low | 102 Ų | 102 | 125.6 Ų | 125.6 | 69% | 0.689 | 66% | 0.662 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -56 | -20.6 | -173.2 | -149.8 | 0 | 0 | 0 | 0 | 113 | P18 E22 Y23 | P18-C20 PolarHBondContact O-N 3.12Å; C20-E22 PolarHBondContact O-N 3.16Å; C20-Y23 PolarHBondContact O-N 3.14Å |
| 21 | D | 59.5 | Low | 58.8 | Low | 117 Ų | 117 | 123.8 Ų | 123.8 | 63% | 0.626 | 65% | 0.653 | S | S | * | * | H | α-helix | trans | -63 | -34.5 | 178.5 | -67.7 | -50.5 | 0 | 0 | 0 | 113.5 | P19 Y23 Q24 | P19-D21 PolarHBondContact O-N 2.83Å; D21-Y23 PolarHBondContact O-N 3.21Å; D21-Q24 PolarHBondContact O-N 3.43Å |
| 22 | E | 57.3 | Low | 58.7 | Low | 119 Ų | 119 | 121.3 Ų | 121.3 | 56% | 0.556 | 65% | 0.646 | S | S | * | * | H | α-helix | trans | -69.3 | -23.4 | 178.1 | -90.1 | -171 | 143.4 | 0 | 0 | 112.8 | P19 C20 Q24 Q25 | P19-E22 PolarHBondContact O-N 3.31Å; P19-E22 VanDerWaalsContact O-N 3.09Å; C20-E22 PolarHBondContact O-N 3.16Å; E22-Q24 VanDerWaalsContact C-N 3.28Å; E22-Q24 PolarHBondContact O-N 3.24Å; E22-Q25 PolarHBondContact O-N 3.43Å |
| 23 | Y | 56.7 | Low | 58.2 | Low | 135 Ų | 135 | 117.2 Ų | 117.2 | 53% | 0.529 | 64% | 0.641 | S | S | . | * | H | α-helix | trans | -72.4 | -23 | 178.6 | -114.6 | -89.3 | 0 | 0 | 0 | 113 | C20 D21 I29 | C20-Y23 PolarHBondContact O-N 3.14Å; D21-Y23 PolarHBondContact O-N 3.21Å; Y23-I29 HydrophobicContact CD1-CD1 3.89Å; Y23-I29 HydrophobicContact CD1-CG1 4.15Å |
| 24 | Q | 55.6 | Low | 57.4 | Low | 157 Ų | 157 | 117.3 Ų | 117.3 | 73% | 0.734 | 64% | 0.638 | S | S | * | * | H | α-helix | trans | -83.3 | -24.4 | 175.9 | -64.5 | -174.4 | 37.3 | 0 | 0 | 112.2 | D21 E22 | D21-Q24 PolarHBondContact O-N 3.43Å; E22-Q24 VanDerWaalsContact C-N 3.28Å; E22-Q24 PolarHBondContact O-N 3.24Å |
| 25 | Q | 56 | Low | 56.6 | Low | 157 Ų | 157 | 120 Ų | 120 | 73% | 0.734 | 64% | 0.643 | S | S | * | * | H | α-helix | trans | -84.1 | -23.4 | -170.8 | -141.6 | 148 | 8.9 | 0 | 0 | 113.2 | E22 | E22-Q25 PolarHBondContact O-N 3.43Å |
| 26 | N | 47.1 | Very low | 56.1 | Low | 125 Ų | 125 | 126.2 Ų | 126.2 | 67% | 0.668 | 66% | 0.658 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -95.9 | 12.3 | -177.2 | -73.6 | 4.1 | 0 | 0 | 0 | 114.8 | Y28 | N26-Y28 PolarHBondContact O-N 3.02Š|
| 27 | G | 54.8 | Low | 55 | Low | 62 Ų | 62 | 129 Ų | 129 | 64% | 0.639 | 66% | 0.659 | S | S | * | * | trans | 58.9 | 13.2 | 174 | 0 | 0 | 0 | 0 | 0 | 115.3 | I29 | G27-I29 PolarHBondContact O-N 3.42Š| ||
| 28 | Y | 54.6 | Low | 54.4 | Low | 197 Ų | 197 | 131.9 Ų | 131.9 | 77% | 0.773 | 67% | 0.665 | S | S | * | * | trans | -78 | -11.5 | -175.3 | -121.2 | -88.9 | 0 | 0 | 0 | 112.9 | N26 | N26-Y28 PolarHBondContact O-N 3.02Š| ||
| 29 | I | 58.4 | Low | 53.2 | Low | 108 Ų | 108 | 133.6 Ų | 133.6 | 55% | 0.554 | 68% | 0.677 | S | S | * | * | S | Bend | trans | -110.1 | 103.6 | 170.5 | -55.2 | 178.3 | 0 | 0 | 0 | 106.5 | Y23 G27 A31 | Y23-I29 HydrophobicContact CD1-CD1 3.89Å; Y23-I29 HydrophobicContact CD1-CG1 4.15Å; G27-I29 PolarHBondContact O-N 3.42Å; I29-A31 PolarHBondContact O-N 3.04Å |
| 30 | P | 53.6 | Low | 52.9 | Low | 99 Ų | 99 | 139.7 Ų | 139.7 | 64% | 0.643 | 69% | 0.694 | S | S | * | * | trans | -61.1 | 136.1 | 170.4 | 24.5 | -28.5 | 0 | 0 | 0 | 108.1 | ||||
| 31 | A | 55.5 | Low | 52 | Low | 56 Ų | 56 | 141.2 Ų | 141.2 | 46% | 0.463 | 70% | 0.696 | S | S | . | * | trans | -50.7 | 138.9 | 178.6 | 0 | 0 | 0 | 0 | 0 | 109.9 | I29 T33 E34 | I29-A31 PolarHBondContact O-N 3.04Å; A31-T33 PolarHBondContact O-N 3.2Å; A31-E34 PolarHBondContact O-N 3.13Å | ||
| 32 | P | 55.4 | Low | 51.7 | Low | 114 Ų | 114 | 140.8 Ų | 140.8 | 74% | 0.74 | 70% | 0.702 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -65 | -3.3 | -176.5 | 26.8 | -34.3 | 0 | 0 | 0 | 113.5 | ||
| 33 | T | 47.6 | Very low | 51.2 | Low | 102 Ų | 102 | 138.3 Ų | 138.3 | 63% | 0.626 | 71% | 0.708 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.4 | -29.8 | 179 | 66.5 | 0 | 0 | 0 | 0 | 112.4 | A31 | A31-T33 PolarHBondContact O-N 3.2Š|
| 34 | E | 47.8 | Very low | 50.3 | Low | 150 Ų | 150 | 141.6 Ų | 141.6 | 70% | 0.701 | 73% | 0.726 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84.7 | -14 | -174.6 | -65.6 | -153.4 | 175 | 0 | 0 | 114 | A31 Y36 | A31-E34 PolarHBondContact O-N 3.13Å; E34-Y36 VanDerWaalsContact C-N 3.26Å; E34-Y36 PolarHBondContact O-N 2.7Å |
| 35 | Y | 48.6 | Very low | 49.9 | Very low | 210 Ų | 210 | 139.9 Ų | 139.9 | 82% | 0.824 | 73% | 0.728 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.1 | -19.3 | 178.9 | -163.8 | -96.4 | 0 | 0 | 0 | 113.1 | ||
| 36 | Y | 48 | Very low | 49.2 | Very low | 208 Ų | 208 | 140.8 Ų | 140.8 | 82% | 0.816 | 73% | 0.732 | S | S | * | * | S | Bend | trans | -102 | -10.9 | 179.4 | -84.7 | -77.5 | 0 | 0 | 0 | 114.9 | E34 R38 | E34-Y36 VanDerWaalsContact C-N 3.26Å; E34-Y36 PolarHBondContact O-N 2.7Å; Y36-R38 PolarHBondContact O-N 2.78Å |
| 37 | E | 50.4 | Low | 49 | Very low | 166 Ų | 166 | 143.8 Ų | 143.8 | 78% | 0.776 | 74% | 0.742 | S | S | * | * | trans | -92.3 | 92.9 | 171 | -78.3 | -141.8 | 128.3 | 0 | 0 | 110.3 | P39 | E37-P39 VanDerWaalsContact O-CD 3.27Å; E37-P39 WeakPolarHBondContact O-CD 3.44Å | ||
| 38 | R | 48.6 | Very low | 48.3 | Very low | 229 Ų | 229 | 147.9 Ų | 147.9 | 86% | 0.864 | 75% | 0.749 | S | S | * | * | trans | -67.5 | 117.9 | 165.4 | -171 | 175.7 | -163.7 | 168.8 | 3.7 | 108.6 | Y36 K40 | Y36-R38 PolarHBondContact O-N 2.78Å; R38-K40 PolarHBondContact O-N 2.9Å | ||
| 39 | P | 43.6 | Very low | 47.8 | Very low | 110 Ų | 110 | 146.2 Ų | 146.2 | 71% | 0.714 | 75% | 0.748 | S | S | * | * | trans | -64.1 | 120.7 | 170 | -16.6 | 31 | 0 | 0 | 0 | 108.4 | E37 D41 | E37-P39 VanDerWaalsContact O-CD 3.27Å; E37-P39 WeakPolarHBondContact O-CD 3.44Å; P39-D41 PolarHBondContact O-N 3.28Å; P39-D41 VanDerWaalsContact O-N 3.08Å | ||
| 40 | K | 54.8 | Low | 47 | Very low | 210 Ų | 210 | 144.3 Ų | 144.3 | 91% | 0.913 | 75% | 0.749 | S | S | * | * | trans | -76.3 | 84.6 | 163.3 | -65.5 | -171.2 | -176.5 | -179.6 | 0 | 106.7 | R38 | R38-K40 PolarHBondContact O-N 2.9Š| ||
| 41 | D | 37.6 | Very low | 46.6 | Very low | 135 Ų | 135 | 144 Ų | 144 | 72% | 0.722 | 75% | 0.749 | S | S | * | * | trans | -117.3 | 106.6 | 167.2 | -136.8 | -41.4 | 0 | 0 | 0 | 110.9 | P39 | P39-D41 PolarHBondContact O-N 3.28Å; P39-D41 VanDerWaalsContact O-N 3.08Å | ||
| 42 | S | 53.5 | Low | 45.9 | Very low | 108 Ų | 108 | 151.1 Ų | 151.1 | 76% | 0.755 | 77% | 0.765 | S | S | * | * | trans | -13.2 | 121.5 | 145.8 | 19.8 | 0 | 0 | 0 | 0 | 115.5 | ||||
| 43 | G | 46.7 | Very low | 45.5 | Very low | 67 Ų | 67 | 151.6 Ų | 151.6 | 69% | 0.691 | 77% | 0.768 | S | S | * | * | trans | 165 | 9.9 | 163.8 | 0 | 0 | 0 | 0 | 0 | 120.7 | ||||
| 44 | F | 37.7 | Very low | 45.4 | Very low | 203 Ų | 203 | 157.3 Ų | 157.3 | 89% | 0.89 | 78% | 0.778 | S | S | * | * | trans | -119.9 | 124.9 | 170.5 | -93.4 | -87.5 | 0 | 0 | 0 | 110.9 | H46 | F44-H46 PolarHBondContact O-N 3.16Å; F44-H46 VanDerWaalsContact O-N 3.16Å | ||
| 45 | P | 46.4 | Very low | 45 | Very low | 122 Ų | 122 | 155.6 Ų | 155.6 | 79% | 0.792 | 78% | 0.783 | S | S | * | * | trans | -65.3 | 118.1 | 176.9 | 4.2 | 5.5 | 0 | 0 | 0 | 108.7 | H47 | P45-H47 PolarHBondContact O-N 3Š| ||
| 46 | H | 42 | Very low | 45.1 | Very low | 176 Ų | 176 | 152.2 Ų | 152.2 | 82% | 0.815 | 78% | 0.779 | S | S | * | * | trans | -61.8 | 119.2 | 163.9 | -114.7 | -88.4 | 0 | 0 | 0 | 107.1 | F44 D48 | F44-H46 PolarHBondContact O-N 3.16Å; F44-H46 VanDerWaalsContact O-N 3.16Å; H46-D48 PolarHBondContact O-N 3.09Å; H46-D48 VanDerWaalsContact O-N 3.16Å | ||
| 47 | H | 43.1 | Very low | 44.9 | Very low | 188 Ų | 188 | 152.8 Ų | 152.8 | 87% | 0.87 | 78% | 0.782 | S | S | * | * | trans | -66.1 | 115.2 | 170.2 | -137.3 | -80.2 | 0 | 0 | 0 | 107.2 | P45 | P45-H47 PolarHBondContact O-N 3Š| ||
| 48 | D | 41.1 | Very low | 45.2 | Very low | 147 Ų | 147 | 150.9 Ų | 150.9 | 79% | 0.786 | 78% | 0.782 | S | S | * | * | trans | -58.5 | 145.9 | 179 | -75.8 | -70.7 | 0 | 0 | 0 | 112.1 | H46 A50 | H46-D48 PolarHBondContact O-N 3.09Å; H46-D48 VanDerWaalsContact O-N 3.16Å; D48-A50 PolarHBondContact O-N 2.97Å | ||
| 49 | E | 43.3 | Very low | 44.9 | Very low | 162 Ų | 162 | 147.5 Ų | 147.5 | 76% | 0.757 | 78% | 0.775 | S | S | * | * | trans | -40.7 | 115.9 | 172.6 | -167.8 | -160.7 | 149.3 | 0 | 0 | 113.4 | S51 | E49-S51 PolarHBondContact OE1-OG 3.01Š| ||
| 50 | A | 41 | Very low | 45 | Very low | 68 Ų | 68 | 147 Ų | 147 | 56% | 0.562 | 77% | 0.772 | S | S | * | * | trans | -101.8 | 102.3 | 152.3 | 0 | 0 | 0 | 0 | 0 | 107.3 | D48 Y52 | D48-A50 PolarHBondContact O-N 2.97Å; A50-Y52 HydrophobicContact CB-CE2 4.27Å; A50-Y52 VanDerWaalsContact O-CD2 3.3Å; A50-Y52 WeakPolarHBondContact O-CD2 3.29Å; A50-Y52 PolarHBondContact O-N 2.68Å | ||
| 51 | S | 46.2 | Very low | 44.5 | Very low | 93 Ų | 93 | 142.3 Ų | 142.3 | 65% | 0.65 | 77% | 0.766 | S | S | * | * | trans | -61.4 | 101.5 | 174.8 | -31.4 | 0 | 0 | 0 | 0 | 109.4 | E49 | E49-S51 PolarHBondContact OE1-OG 3.01Š| ||
| 52 | Y | 41.2 | Very low | 44.5 | Very low | 206 Ų | 206 | 145.1 Ų | 145.1 | 81% | 0.808 | 77% | 0.768 | S | S | * | * | trans | -83.1 | 130.7 | 166.1 | -66.9 | -82.2 | 0 | 0 | 0 | 109.3 | A50 R54 | A50-Y52 HydrophobicContact CB-CE2 4.27Å; A50-Y52 VanDerWaalsContact O-CD2 3.3Å; A50-Y52 WeakPolarHBondContact O-CD2 3.29Å; A50-Y52 PolarHBondContact O-N 2.68Å; Y52-R54 PolarHBondContact O-N 2.87Å | ||
| 53 | P | 47.2 | Very low | 44.2 | Very low | 124 Ų | 124 | 146.9 Ų | 146.9 | 81% | 0.805 | 77% | 0.769 | S | S | * | * | trans | -72 | 132.6 | 177.5 | 11.4 | -2.3 | 0 | 0 | 0 | 111.4 | ||||
| 54 | R | 45.5 | Very low | 44.2 | Very low | 221 Ų | 221 | 154.4 Ų | 154.4 | 83% | 0.834 | 78% | 0.778 | S | S | * | * | trans | -25.2 | 146.8 | 168.5 | -147.7 | 178.3 | -166.2 | -168.8 | 3.2 | 116.7 | Y52 | Y52-R54 PolarHBondContact O-N 2.87Š| ||
| 55 | S | 39.2 | Very low | 44.3 | Very low | 115 Ų | 115 | 147.2 Ų | 147.2 | 80% | 0.804 | 76% | 0.761 | S | S | * | * | trans | -124.6 | 134.1 | 151.9 | -72.8 | 0 | 0 | 0 | 0 | 110.1 | Y57 | S55-Y57 PolarHBondContact O-N 3.14Š| ||
| 56 | N | 50.8 | Low | 44.2 | Very low | 139 Ų | 139 | 149 Ų | 149 | 74% | 0.743 | 76% | 0.764 | S | S | * | * | trans | -64.7 | 105.6 | -164.9 | -61.9 | -39.5 | 0 | 0 | 0 | 113.1 | ||||
| 57 | Y | 43.8 | Very low | 43.9 | Very low | 220 Ų | 220 | 147.5 Ų | 147.5 | 86% | 0.863 | 77% | 0.767 | S | S | * | * | trans | -109.8 | 107 | 160.8 | -129.4 | -92.7 | 0 | 0 | 0 | 109.1 | S55 E59 | S55-Y57 PolarHBondContact O-N 3.14Å; Y57-E59 PolarHBondContact O-N 3.09Å | ||
| 58 | T | 55.2 | Low | 44.1 | Very low | 126 Ų | 126 | 143.8 Ų | 143.8 | 77% | 0.773 | 76% | 0.76 | S | S | * | * | trans | -83.4 | 103.4 | 169.6 | -36.2 | 0 | 0 | 0 | 0 | 106.8 | P60 | T58-P60 WeakPolarHBondContact O-CD 3.46Š| ||
| 59 | E | 42.5 | Very low | 44 | Very low | 157 Ų | 157 | 141.5 Ų | 141.5 | 73% | 0.734 | 76% | 0.755 | S | S | * | * | trans | -69.7 | 121.9 | 170.2 | -114.5 | -89.4 | 130.6 | 0 | 0 | 108.6 | Y57 | Y57-E59 PolarHBondContact O-N 3.09Š| ||
| 60 | P | 47.2 | Very low | 43.8 | Very low | 99 Ų | 99 | 141.1 Ų | 141.1 | 64% | 0.643 | 76% | 0.758 | S | S | * | * | trans | -83 | 119 | 170.6 | 18.3 | -5.4 | 0 | 0 | 0 | 109.5 | T58 Y62 | T58-P60 WeakPolarHBondContact O-CD 3.46Å; P60-Y62 PolarHBondContact O-N 3.41Å; P60-Y62 VanDerWaalsContact O-N 3.16Å | ||
| 61 | S | 44.4 | Very low | 43.5 | Very low | 112 Ų | 112 | 141.2 Ų | 141.2 | 78% | 0.783 | 77% | 0.766 | S | S | * | * | trans | -64 | 112.7 | 170.3 | 64.9 | 0 | 0 | 0 | 0 | 109.6 | D63 | S61-D63 PolarHBondContact O-N 3.37Š| ||
| 62 | Y | 37.5 | Very low | 43.4 | Very low | 195 Ų | 195 | 144.3 Ų | 144.3 | 77% | 0.765 | 78% | 0.775 | S | S | * | * | trans | -85.1 | 100.8 | 167.5 | 56 | -91 | 0 | 0 | 0 | 109.1 | P60 Y64 | P60-Y62 PolarHBondContact O-N 3.41Å; P60-Y62 VanDerWaalsContact O-N 3.16Å; Y62-Y64 HydrophobicContact CD2-CD2 4.19Å | ||
| 63 | D | 46.6 | Very low | 43.5 | Very low | 145 Ų | 145 | 140.8 Ų | 140.8 | 78% | 0.775 | 77% | 0.77 | S | S | * | * | trans | -75.5 | 118.6 | 168.1 | -169.9 | 62.5 | 0 | 0 | 0 | 108.5 | S61 G65 | S61-D63 PolarHBondContact O-N 3.37Å; D63-G65 PolarHBondContact O-N 3.47Å | ||
| 64 | Y | 47.4 | Very low | 42.8 | Very low | 224 Ų | 224 | 141 Ų | 141 | 88% | 0.878 | 76% | 0.764 | S | S | * | * | trans | -93.3 | 89 | 177.5 | -119 | -86.9 | 0 | 0 | 0 | 108.5 | Y62 | Y62-Y64 HydrophobicContact CD2-CD2 4.19Š| ||
| 65 | G | 39.4 | Very low | 42.4 | Very low | 53 Ų | 53 | 139.7 Ų | 139.7 | 55% | 0.546 | 77% | 0.765 | S | S | . | * | trans | -160.8 | 92.1 | -177 | 0 | 0 | 0 | 0 | 0 | 115.1 | D63 | D63-G65 PolarHBondContact O-N 3.47Š| ||
| 66 | N | 42.9 | Very low | 42.4 | Very low | 160 Ų | 160 | 139.7 Ų | 139.7 | 86% | 0.856 | 76% | 0.76 | S | S | * | * | trans | 65.1 | 110.8 | 140.6 | -144.7 | 25 | 0 | 0 | 0 | 120.3 | ||||
| 67 | V | 36.4 | Very low | 41.8 | Very low | 144 Ų | 144 | 139.9 Ų | 139.9 | 87% | 0.873 | 76% | 0.761 | S | S | * | * | trans | -147.8 | 136.1 | 148.3 | -123 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 68 | P | 48.2 | Very low | 41.4 | Very low | 110 Ų | 110 | 138.8 Ų | 138.8 | 71% | 0.714 | 76% | 0.755 | S | S | * | * | trans | -98.3 | 168.2 | 178.7 | 37.7 | -32.4 | 0 | 0 | 0 | 113.7 | ||||
| 69 | S | 38.8 | Very low | 40.8 | Very low | 99 Ų | 99 | 141.1 Ų | 141.1 | 69% | 0.692 | 76% | 0.757 | S | S | * | * | trans | 88.1 | 124.3 | 149.9 | -123.4 | 0 | 0 | 0 | 0 | 121 | ||||
| 70 | N | 38.5 | Very low | 40.8 | Very low | 153 Ų | 153 | 140.7 Ų | 140.7 | 82% | 0.818 | 76% | 0.755 | S | S | * | * | trans | 83.7 | 114.2 | 138 | -64.5 | -4.1 | 0 | 0 | 0 | 121.4 | ||||
| 71 | G | 34.2 | Very low | 40.2 | Very low | 71 Ų | 71 | 140.7 Ų | 140.7 | 73% | 0.732 | 76% | 0.764 | S | S | * | * | 101.4 | 101.8 | 126.9 | 0 | 0 | 0 | 0 | 0 | 116.7 | |||||
| 72 | L | 44.5 | Very low | 39.9 | Very low | 158 Ų | 158 | 142.2 Ų | 142.2 | 83% | 0.827 | 76% | 0.758 | S | S | * | * | -167.5 | 102.4 | 124.5 | -146.7 | 73.3 | 0 | 0 | 0 | 111.3 | |||||
| 73 | D | 42.2 | Very low | 40.1 | Very low | 132 Ų | 132 | 138.9 Ų | 138.9 | 71% | 0.706 | 76% | 0.76 | S | S | * | * | trans | -4 | 147.6 | 140.9 | 24.3 | -68.9 | 0 | 0 | 0 | 121.4 | ||||
| 74 | D | 33.2 | Very low | 39.6 | Very low | 128 Ų | 128 | 138.1 Ų | 138.1 | 68% | 0.684 | 75% | 0.752 | S | S | * | * | trans | 87.1 | 100.5 | 145.6 | -139.3 | 62.5 | 0 | 0 | 0 | 119.5 | ||||
| 75 | F | 36.8 | Very low | 39.2 | Very low | 194 Ų | 194 | 133 Ų | 133 | 85% | 0.851 | 75% | 0.746 | S | S | * | * | -169 | 118 | 116.6 | -114.2 | -83.8 | 0 | 0 | 0 | 109.9 | |||||
| 76 | T | 40.2 | Very low | 39.1 | Very low | 115 Ų | 115 | 138 Ų | 138 | 71% | 0.706 | 76% | 0.759 | S | S | * | * | trans | -66 | 136.2 | 167.1 | 35.5 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 77 | D | 38 | Very low | 38.7 | Very low | 143 Ų | 143 | 134.5 Ų | 134.5 | 77% | 0.765 | 75% | 0.752 | S | S | * | * | -174.6 | 148.4 | 116.8 | -147.1 | -83.9 | 0 | 0 | 0 | 111.1 | H79 | D77-H79 IonicContact OD1-CD2 3.89Å; D77-H79 IonicContact OD1-NE2 3.94Å | |||
| 78 | R | 34.5 | Very low | 38.7 | Very low | 197 Ų | 197 | 136.1 Ų | 136.1 | 74% | 0.743 | 75% | 0.751 | S | S | * | * | trans | -139.5 | 110.9 | -149.6 | -171.9 | -147.5 | 178.3 | -168.1 | -1.8 | 109.6 | ||||
| 79 | H | 43.9 | Very low | 37.9 | Very low | 174 Ų | 174 | 137.4 Ų | 137.4 | 81% | 0.806 | 75% | 0.751 | S | S | * | * | trans | -143.8 | 101 | 156.1 | -67.3 | -70.7 | 0 | 0 | 0 | 108.5 | D77 | D77-H79 IonicContact OD1-CD2 3.89Å; D77-H79 IonicContact OD1-NE2 3.94Å | ||
| 80 | Q | 41.7 | Very low | 37.7 | Very low | 149 Ų | 149 | 140.7 Ų | 140.7 | 70% | 0.696 | 76% | 0.755 | S | S | * | * | 73.3 | 92.9 | 86.4 | -164.4 | 77.3 | 14.6 | 0 | 0 | 113.7 | |||||
| 81 | A | 33.9 | Very low | 37.5 | Very low | 99 Ų | 99 | 137.1 Ų | 137.1 | 82% | 0.818 | 76% | 0.755 | S | S | * | * | trans | -172.8 | 112.5 | 139.7 | 0 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 82 | Q | 38.4 | Very low | 38 | Very low | 143 Ų | 143 | 140 Ų | 140 | 67% | 0.668 | 76% | 0.76 | S | S | * | * | trans | -86.1 | 140.8 | 169.2 | -173.6 | -164.5 | 28.7 | 0 | 0 | 109.1 | Q84 | Q82-Q84 VanDerWaalsContact CD-NE2 3.34Š| ||
| 83 | P | 41.5 | Very low | 37.6 | Very low | 125 Ų | 125 | 141.3 Ų | 141.3 | 81% | 0.812 | 75% | 0.754 | S | S | * | * | trans | -101.9 | 114.9 | 154.7 | 8.3 | 10.4 | 0 | 0 | 0 | 109.9 | ||||
| 84 | Q | 36.1 | Very low | 37.3 | Very low | 129 Ų | 129 | 142.9 Ų | 142.9 | 60% | 0.603 | 76% | 0.762 | S | S | * | * | P | Polyproline II helix | trans | -70.6 | 148.1 | 166.7 | -71.6 | -81.3 | -7.7 | 0 | 0 | 110.6 | Q82 | Q82-Q84 VanDerWaalsContact CD-NE2 3.34Š|
| 85 | P | 40 | Very low | 37.6 | Very low | 116 Ų | 116 | 141.6 Ų | 141.6 | 75% | 0.753 | 76% | 0.755 | S | S | * | * | P | Polyproline II helix | trans | -82.9 | 125.1 | 170.7 | 32.1 | -29.2 | 0 | 0 | 0 | 110.4 | ||
| 86 | I | 36 | Very low | 37.7 | Very low | 159 Ų | 159 | 138.4 Ų | 138.4 | 82% | 0.815 | 75% | 0.753 | S | S | * | * | P | Polyproline II helix | trans | -88.3 | 121.8 | 168.8 | -75 | 165.9 | 0 | 0 | 0 | 109 | ||
| 87 | A | 35.4 | Very low | 37.5 | Very low | 87 Ų | 87 | 138.8 Ų | 138.8 | 72% | 0.719 | 76% | 0.755 | S | S | * | * | P | Polyproline II helix | trans | -94.6 | 140.2 | 163.7 | 0 | 0 | 0 | 0 | 0 | 109.6 | ||
| 88 | Q | 35.9 | Very low | 38.1 | Very low | 178 Ų | 178 | 137.6 Ų | 137.6 | 83% | 0.832 | 76% | 0.755 | S | S | * | * | trans | -167.6 | 101.6 | 155.4 | -104 | 164.3 | 28.7 | 0 | 0 | 108 | ||||
| 89 | N | 32.7 | Very low | 38 | Very low | 136 Ų | 136 | 135.7 Ų | 135.7 | 73% | 0.727 | 76% | 0.76 | S | S | * | * | 80.3 | 102 | 87.9 | -114.2 | -88.8 | 0 | 0 | 0 | 115.5 | |||||
| 90 | H | 33.6 | Very low | 37.8 | Very low | 169 Ų | 169 | 132.8 Ų | 132.8 | 78% | 0.782 | 76% | 0.759 | S | S | * | * | trans | 18.5 | 119.3 | 139.2 | -34.8 | -49 | 0 | 0 | 0 | 122.4 | ||||
| 91 | G | 33.8 | Very low | 37.5 | Very low | 78 Ų | 78 | 129 Ų | 129 | 80% | 0.804 | 76% | 0.76 | S | S | * | * | trans | 77 | 168 | 131.5 | 0 | 0 | 0 | 0 | 0 | 120.5 | ||||
| 92 | P | 45.4 | Very low | 37.9 | Very low | 130 Ų | 130 | 130.9 Ų | 130.9 | 84% | 0.844 | 76% | 0.762 | S | S | * | * | cis | -124.2 | 172 | -1.4 | 39 | -22.3 | 0 | 0 | 0 | 115.3 | ||||
| 93 | R | 36.6 | Very low | 38 | Very low | 186 Ų | 186 | 130.5 Ų | 130.5 | 70% | 0.702 | 77% | 0.769 | S | S | * | * | trans | -75.2 | 133.9 | 179.3 | -168.2 | -112.4 | -165.9 | -161.4 | 0.8 | 111.7 | N95 | R93-N95 PolarHBondContact NH1-ND2 3.11Å; R93-N95 PolarHBondContact NH2-ND2 3.11Å; R93-N95 PolarHBondContact NH2-OD1 3.34Å | ||
| 94 | L | 36.5 | Very low | 37.8 | Very low | 165 Ų | 165 | 133.8 Ų | 133.8 | 86% | 0.864 | 77% | 0.773 | S | S | * | * | trans | -135.1 | 116.8 | 159.9 | -69.1 | 177.4 | 0 | 0 | 0 | 109.7 | ||||
| 95 | N | 39.5 | Very low | 37.8 | Very low | 102 Ų | 102 | 134 Ų | 134 | 55% | 0.545 | 78% | 0.779 | S | S | . | * | trans | -77.8 | 149 | 160.8 | -82.9 | 13.2 | 0 | 0 | 0 | 108.5 | R93 | R93-N95 PolarHBondContact NH1-ND2 3.11Å; R93-N95 PolarHBondContact NH2-ND2 3.11Å; R93-N95 PolarHBondContact NH2-OD1 3.34Å | ||
| 96 | P | 39.1 | Very low | 37.9 | Very low | 126 Ų | 126 | 134.2 Ų | 134.2 | 82% | 0.818 | 78% | 0.777 | S | S | * | * | -136.3 | 152.9 | 120.5 | 20.6 | -0.2 | 0 | 0 | 0 | 113.3 | |||||
| 97 | V | 35.1 | Very low | 38.1 | Very low | 123 Ų | 123 | 130.6 Ų | 130.6 | 75% | 0.745 | 77% | 0.766 | S | S | * | * | trans | -127.2 | 159.9 | 168 | 171.8 | 0 | 0 | 0 | 0 | 104.8 | ||||
| 98 | P | 50.2 | Low | 38.7 | Very low | 118 Ų | 118 | 135.3 Ų | 135.3 | 77% | 0.766 | 77% | 0.77 | S | S | * | * | cis | -122.3 | 163 | -13.4 | 23.8 | -3.7 | 0 | 0 | 0 | 112.7 | ||||
| 99 | D | 31.8 | Very low | 38.5 | Very low | 158 Ų | 158 | 133.4 Ų | 133.4 | 85% | 0.845 | 77% | 0.766 | S | S | * | * | trans | -146.2 | 147.2 | 141.7 | -161.1 | 13.9 | 0 | 0 | 0 | 110.8 | ||||
| 100 | S | 41.6 | Very low | 39 | Very low | 112 Ų | 112 | 133.3 Ų | 133.3 | 78% | 0.783 | 77% | 0.774 | S | S | * | * | trans | -69.7 | 143.2 | -165.5 | -56.4 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 101 | G | 34.1 | Very low | 39.4 | Very low | 70 Ų | 70 | 130.1 Ų | 130.1 | 72% | 0.722 | 77% | 0.771 | S | S | * | * | trans | 174.9 | 78.8 | 173.8 | 0 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 102 | V | 42.1 | Very low | 39.7 | Very low | 139 Ų | 139 | 134.5 Ų | 134.5 | 84% | 0.842 | 78% | 0.775 | S | S | * | * | trans | -11.9 | 117.8 | 157.4 | -162.9 | 0 | 0 | 0 | 0 | 115.9 | ||||
| 103 | V | 41.7 | Very low | 39.3 | Very low | 135 Ų | 135 | 131.6 Ų | 131.6 | 82% | 0.818 | 76% | 0.762 | S | S | * | * | trans | -162 | 115.5 | 134.4 | -84.6 | 0 | 0 | 0 | 0 | 108.6 | D105 | V103-D105 PolarHBondContact O-N 3.45Š| ||
| 104 | E | 36.4 | Very low | 39.7 | Very low | 194 Ų | 194 | 129.3 Ų | 129.3 | 91% | 0.907 | 77% | 0.769 | S | S | * | * | trans | -69 | 110.1 | 171 | -71.3 | -170.8 | 130 | 0 | 0 | 109.5 | ||||
| 105 | D | 35.6 | Very low | 39.9 | Very low | 134 Ų | 134 | 128.9 Ų | 128.9 | 72% | 0.717 | 76% | 0.762 | S | S | * | * | trans | -87.9 | 104.6 | 169.3 | -177.3 | 42.9 | 0 | 0 | 0 | 109 | V103 S107 | V103-D105 PolarHBondContact O-N 3.45Å; D105-S107 PolarHBondContact O-N 3.02Å; D105-S107 PolarHBondContact OD2-OG 3.4Å | ||
| 106 | V | 42.3 | Very low | 39.9 | Very low | 120 Ų | 120 | 129.5 Ų | 129.5 | 73% | 0.727 | 77% | 0.773 | S | S | * | * | trans | -74.6 | 85 | 168.2 | 171.6 | 0 | 0 | 0 | 0 | 107.8 | K108 | V106-K108 HydrophobicContact CG1-CG 4.5Å; V106-K108 PolarHBondContact O-N 3.39Å; V106-K108 VanDerWaalsContact O-N 3.1Å | ||
| 107 | S | 40.1 | Very low | 39.8 | Very low | 82 Ų | 82 | 133.5 Ų | 133.5 | 57% | 0.573 | 77% | 0.774 | S | S | * | * | trans | -62.3 | 104.4 | 164.2 | -81.1 | 0 | 0 | 0 | 0 | 109.4 | D105 D109 | D105-S107 PolarHBondContact O-N 3.02Å; D105-S107 PolarHBondContact OD2-OG 3.4Å; S107-D109 VanDerWaalsContact C-N 3.3Å; S107-D109 PolarHBondContact O-N 3Å; S107-D109 VanDerWaalsContact O-N 3.09Å | ||
| 108 | K | 47.8 | Very low | 40.4 | Very low | 187 Ų | 187 | 133.8 Ų | 133.8 | 81% | 0.813 | 78% | 0.778 | S | S | * | * | trans | -77 | 82 | 167 | -82.8 | 171.1 | 177.7 | 158.1 | 0 | 109.1 | V106 C110 | V106-K108 HydrophobicContact CG1-CG 4.5Å; V106-K108 PolarHBondContact O-N 3.39Å; V106-K108 VanDerWaalsContact O-N 3.1Å; K108-C110 PolarHBondContact O-N 3.1Å; K108-C110 VanDerWaalsContact O-N 3.16Å | ||
| 109 | D | 33.4 | Very low | 40.2 | Very low | 138 Ų | 138 | 131.7 Ų | 131.7 | 74% | 0.738 | 78% | 0.778 | S | S | * | * | trans | -70.9 | 102.1 | 160.4 | -78 | -32.7 | 0 | 0 | 0 | 108.7 | S107 S111 | S107-D109 VanDerWaalsContact C-N 3.3Å; S107-D109 PolarHBondContact O-N 3Å; S107-D109 VanDerWaalsContact O-N 3.09Å; D109-S111 PolarHBondContact O-N 3Å | ||
| 110 | C | 42.5 | Very low | 40.5 | Very low | 133 Ų | 133 | 128.3 Ų | 128.3 | 90% | 0.899 | 77% | 0.772 | S | S | * | * | trans | -72.6 | 61.9 | 161.7 | -84.5 | 0 | 0 | 0 | 0 | 109.9 | K108 L112 | K108-C110 PolarHBondContact O-N 3.1Å; K108-C110 VanDerWaalsContact O-N 3.16Å; C110-L112 PolarHBondContact O-N 3.28Å | ||
| 111 | S | 41.6 | Very low | 41 | Very low | 102 Ų | 102 | 132.6 Ų | 132.6 | 71% | 0.713 | 78% | 0.779 | S | S | * | * | trans | -87.7 | 94.2 | 158.3 | -68 | 0 | 0 | 0 | 0 | 106 | D109 A113 | D109-S111 PolarHBondContact O-N 3Å; S111-A113 VanDerWaalsContact C-N 3.32Å; S111-A113 PolarHBondContact O-N 3.34Å | ||
| 112 | L | 41.2 | Very low | 41.6 | Very low | 171 Ų | 171 | 138.7 Ų | 138.7 | 90% | 0.895 | 79% | 0.786 | S | S | * | * | trans | -62 | 101.1 | 171.4 | -158.9 | 88.4 | 0 | 0 | 0 | 106.7 | C110 T114 | C110-L112 PolarHBondContact O-N 3.28Å; L112-T114 PolarHBondContact O-N 2.88Å | ||
| 113 | A | 36.9 | Very low | 42.3 | Very low | 69 Ų | 69 | 136.1 Ų | 136.1 | 57% | 0.57 | 79% | 0.788 | S | S | * | * | trans | -53.5 | 122.8 | 168.7 | 0 | 0 | 0 | 0 | 0 | 107.8 | S111 E115 | S111-A113 VanDerWaalsContact C-N 3.32Å; S111-A113 PolarHBondContact O-N 3.34Å; A113-E115 PolarHBondContact O-N 3.43Å | ||
| 114 | T | 45.1 | Very low | 42.7 | Very low | 137 Ų | 137 | 138.8 Ų | 138.8 | 84% | 0.84 | 79% | 0.788 | S | S | * | * | trans | -64.6 | 84 | 163.1 | -61.8 | 0 | 0 | 0 | 0 | 107 | L112 C116 | L112-T114 PolarHBondContact O-N 2.88Å; T114-C116 PolarHBondContact O-N 2.84Å; T114-C116 VanDerWaalsContact O-N 3.15Å | ||
| 115 | E | 39.8 | Very low | 43.9 | Very low | 156 Ų | 156 | 137.2 Ų | 137.2 | 73% | 0.729 | 78% | 0.781 | S | S | * | * | trans | -65 | 108.5 | 167.2 | -75.3 | -70.9 | 118.3 | 0 | 0 | 107.7 | A113 Y117 | A113-E115 PolarHBondContact O-N 3.43Å; E115-Y117 PolarHBondContact O-N 3.09Å | ||
| 116 | C | 40.3 | Very low | 45.6 | Very low | 115 Ų | 115 | 135.4 Ų | 135.4 | 78% | 0.777 | 78% | 0.776 | S | S | * | * | trans | -77.9 | 107.4 | 178.2 | -165.5 | 0 | 0 | 0 | 0 | 108.9 | T114 P118 | T114-C116 PolarHBondContact O-N 2.84Å; T114-C116 VanDerWaalsContact O-N 3.15Å; C116-P118 WeakPolarHBondContact O-CD 3.48Å | ||
| 117 | Y | 35.4 | Very low | 47.4 | Very low | 211 Ų | 211 | 135.2 Ų | 135.2 | 83% | 0.827 | 78% | 0.778 | S | S | * | * | trans | -79.8 | 120.7 | 167.2 | -90.8 | -93.2 | 0 | 0 | 0 | 110 | E115 G119 | E115-Y117 PolarHBondContact O-N 3.09Å; Y117-G119 PolarHBondContact O-N 3.4Å | ||
| 118 | P | 47.9 | Very low | 49.5 | Very low | 128 Ų | 128 | 135.7 Ų | 135.7 | 83% | 0.831 | 78% | 0.777 | S | S | * | * | trans | -89.5 | 104.7 | 169.4 | 33.2 | -24.6 | 0 | 0 | 0 | 108.5 | C116 | C116-P118 WeakPolarHBondContact O-CD 3.48Š| ||
| 119 | G | 46.2 | Very low | 51.5 | Low | 75 Ų | 75 | 130.8 Ų | 130.8 | 77% | 0.773 | 76% | 0.762 | S | S | * | * | trans | 150 | 82.8 | 167.9 | 0 | 0 | 0 | 0 | 0 | 114.8 | Y117 | Y117-G119 PolarHBondContact O-N 3.4Š| ||
| 120 | A | 39.2 | Very low | 54.2 | Low | 86 Ų | 86 | 130.4 Ų | 130.4 | 71% | 0.711 | 75% | 0.752 | S | S | * | * | trans | 177.8 | 97.3 | 145.2 | 0 | 0 | 0 | 0 | 0 | 108.9 | K122 | A120-K122 PolarHBondContact O-N 3.27Š| ||
| 121 | Q | 50.8 | Low | 56.4 | Low | 202 Ų | 202 | 128.9 Ų | 128.9 | 94% | 0.944 | 74% | 0.74 | S | S | * | * | trans | -83.2 | 101.4 | 161.5 | -65.5 | -129.2 | -15.5 | 0 | 0 | 108.2 | ||||
| 122 | K | 48.1 | Very low | 58.7 | Low | 198 Ų | 198 | 133.8 Ų | 133.8 | 86% | 0.861 | 74% | 0.743 | S | S | * | * | S | Bend | trans | -157.2 | 119.5 | 157.8 | -140.4 | 179.8 | -177.7 | -176 | 0 | 109.5 | A120 | A120-K122 PolarHBondContact O-N 3.27Š|
| 123 | G | 55.8 | Low | 60.9 | Low | 85 Ų | 85 | 130.1 Ų | 130.1 | 88% | 0.876 | 72% | 0.723 | S | S | * | * | trans | 20.8 | 94.5 | 171.2 | 0 | 0 | 0 | 0 | 0 | 118.2 | E125 | G123-E125 PolarHBondContact O-N 3.08Š| ||
| 124 | K | 50.8 | Low | 63.2 | Low | 192 Ų | 192 | 133 Ų | 133 | 84% | 0.835 | 72% | 0.722 | S | S | * | * | trans | -91.6 | 81.3 | 174.2 | -62.4 | -177.5 | -177.9 | -177.1 | 0 | 110.2 | ||||
| 125 | E | 62.1 | Low | 64.9 | Low | 160 Ų | 160 | 133.7 Ų | 133.7 | 75% | 0.748 | 71% | 0.713 | S | S | * | * | P | Polyproline II helix | trans | -60.6 | 129 | 156.8 | -102.6 | -91 | 139.3 | 0 | 0 | 107.5 | G123 | G123-E125 PolarHBondContact O-N 3.08Š|
| 126 | P | 70.7 | Confident | 66.6 | Low | 96 Ų | 96 | 132.1 Ų | 132.1 | 62% | 0.623 | 71% | 0.714 | S | S | * | * | P | Polyproline II helix | trans | -61.4 | 139.4 | 175.8 | 26.2 | -32.1 | 0 | 0 | 0 | 108.9 | V128 | P126-V128 PolarHBondContact O-N 3.47Š|
| 127 | P | 79.1 | Confident | 67.8 | Low | 116 Ų | 116 | 134 Ų | 134 | 75% | 0.753 | 71% | 0.711 | S | S | * | * | P | Polyproline II helix | trans | -54.4 | 126.5 | -177.9 | 18.6 | -29.8 | 0 | 0 | 0 | 110.9 | V129 | P127-V129 PolarHBondContact O-N 3.26Š|
| 128 | V | 85.7 | Confident | 68.9 | Low | 92 Ų | 92 | 127.1 Ų | 127.1 | 56% | 0.558 | 69% | 0.691 | S | S | * | * | trans | -62.6 | 107.2 | -179 | 179.6 | 0 | 0 | 0 | 0 | 109.6 | P126 Y130 | P126-V128 PolarHBondContact O-N 3.47Å; V128-Y130 HydrophobicContact CG1-CE1 4.16Å; V128-Y130 HydrophobicContact CG1-CE2 4.4Å; V128-Y130 PolarHBondContact O-N 3Å | ||
| 129 | V | 88.6 | Confident | 69.2 | Low | 84 Ų | 84 | 127 Ų | 127 | 51% | 0.509 | 69% | 0.688 | S | S | . | * | trans | -86.5 | 103.7 | 176.2 | -177.7 | 0 | 0 | 0 | 0 | 109.5 | P127 M133 K134 | P127-V129 PolarHBondContact O-N 3.26Å; V129-M133 HydrophobicContact CG1-CB 3.91Å; V129-K134 HydrophobicContact CG1-CG 4.01Å | ||
| 130 | Y | 89.9 | Confident | 69.2 | Low | 130 Ų | 130 | 129.7 Ų | 129.7 | 51% | 0.51 | 69% | 0.685 | S | S | . | * | trans | -66 | 151.7 | 177.2 | -64.7 | -79.4 | 0 | 0 | 0 | 112.2 | V128 W132 M133 | V128-Y130 HydrophobicContact CG1-CE1 4.16Å; V128-Y130 HydrophobicContact CG1-CE2 4.4Å; V128-Y130 PolarHBondContact O-N 3Å; Y130-W132 VanDerWaalsContact CB-NE1 3.3Å; Y130-W132 AromaticContact CG-NE1 3.89Å; Y130-W132 PolarHBondContact O-N 3.41Å; Y130-W132 VanDerWaalsContact O-N 3.09Å; Y130-M133 HydrophobicContact CD2-SD 3.72Å; Y130-M133 HydrophobicContact CG-SD 4.37Å; Y130-M133 VanDerWaalsContact O-CB 3.32Å; Y130-M133 WeakPolarHBondContact O-CB 3.45Å; Y130-M133 PolarHBondContact O-N 3.23Å | ||
| 131 | P | 89.1 | Confident | 69.9 | Low | 101 Ų | 101 | 129.9 Ų | 129.9 | 66% | 0.656 | 69% | 0.686 | S | S | * | * | G | 310 helix | trans | -53.9 | -34.3 | -176.6 | -29.1 | 35.9 | 0 | 0 | 0 | 115.1 | M133 K134 | P131-M133 VanDerWaalsContact C-N 3.31Å; P131-M133 PolarHBondContact O-N 3.43Å; P131-K134 WeakPolarHBondContact O-CB 3.44Å; P131-K134 PolarHBondContact O-N 2.93Å |
| 132 | W | 89.5 | Confident | 69.9 | Low | 205 Ų | 205 | 124.2 Ų | 124.2 | 78% | 0.777 | 67% | 0.669 | S | S | * | * | G | 310 helix | trans | -71.8 | -23.2 | 177.6 | 66 | -94.8 | 0 | 0 | 0 | 113.7 | Y130 K134 | Y130-W132 VanDerWaalsContact CB-NE1 3.3Å; Y130-W132 AromaticContact CG-NE1 3.89Å; Y130-W132 PolarHBondContact O-N 3.41Å; Y130-W132 VanDerWaalsContact O-N 3.09Å; W132-K134 VanDerWaalsContact C-N 3.25Å |
| 133 | M | 87.9 | Confident | 69.6 | Low | 95 Ų | 95 | 124.7 Ų | 124.7 | 47% | 0.468 | 67% | 0.667 | S | S | . | * | G | 310 helix | trans | -77.2 | -16.3 | 176.1 | -59.5 | 173.5 | 71 | 0 | 0 | 111.5 | V129 Y130 P131 | V129-M133 HydrophobicContact CG1-CB 3.91Å; Y130-M133 HydrophobicContact CD2-SD 3.72Å; Y130-M133 HydrophobicContact CG-SD 4.37Å; Y130-M133 VanDerWaalsContact O-CB 3.32Å; Y130-M133 WeakPolarHBondContact O-CB 3.45Å; Y130-M133 PolarHBondContact O-N 3.23Å; P131-M133 VanDerWaalsContact C-N 3.31Å; P131-M133 PolarHBondContact O-N 3.43Å |
| 134 | K | 84.3 | Confident | 69.3 | Low | 130 Ų | 130 | 126.1 Ų | 126.1 | 57% | 0.565 | 66% | 0.663 | S | S | * | * | S | Bend | trans | -74.6 | 130 | 175.4 | -57.2 | -177.8 | -179.5 | -179.2 | 0 | 108.9 | V129 P131 W132 V136 | V129-K134 HydrophobicContact CG1-CG 4.01Å; P131-K134 WeakPolarHBondContact O-CB 3.44Å; P131-K134 PolarHBondContact O-N 2.93Å; W132-K134 VanDerWaalsContact C-N 3.25Å; K134-V136 PolarHBondContact O-N 3Å |
| 135 | K | 82.3 | Confident | 69.2 | Low | 150 Ų | 150 | 120.4 Ų | 120.4 | 65% | 0.652 | 66% | 0.659 | S | S | * | * | trans | -67.1 | 105.4 | 176.6 | -82.7 | 179.4 | 175.9 | 178 | 0 | 109.8 | H137 V138 | K135-H137 VanDerWaalsContact C-N 3.28Å; K135-H137 PolarHBondContact O-N 3.21Å; K135-V138 HydrophobicContact CB-CG2 4.19Å; K135-V138 WeakPolarHBondContact O-CG2 3.36Å | ||
| 136 | V | 74 | Confident | 68.9 | Low | 123 Ų | 123 | 116.5 Ų | 116.5 | 75% | 0.745 | 66% | 0.661 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -70.5 | -19.9 | -179.3 | -178.3 | 0 | 0 | 0 | 0 | 113.5 | K134 V138 | K134-V136 PolarHBondContact O-N 3Å; V136-V138 VanDerWaalsContact C-N 3.33Å; V136-V138 PolarHBondContact O-N 3.46Å |
| 137 | H | 65.9 | Low | 68.2 | Low | 154 Ų | 154 | 116.6 Ų | 116.6 | 71% | 0.713 | 66% | 0.66 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -85.2 | 5.5 | -173.3 | -65.6 | 100.9 | 0 | 0 | 0 | 115.6 | K135 V139 R150 | K135-H137 VanDerWaalsContact C-N 3.28Å; K135-H137 PolarHBondContact O-N 3.21Å; H137-V139 PolarHBondContact O-N 3.02Å; H137-R150 PolarHBondContact O-NH2 3.49Å |
| 138 | V | 60 | Low | 67.3 | Low | 68 Ų | 68 | 116.4 Ų | 116.4 | 41% | 0.412 | 66% | 0.659 | S | S | . | * | trans | -84.4 | 88.8 | 171 | -101.7 | 0 | 0 | 0 | 0 | 108.9 | K135 V136 | K135-V138 HydrophobicContact CB-CG2 4.19Å; K135-V138 WeakPolarHBondContact O-CG2 3.36Å; V136-V138 VanDerWaalsContact C-N 3.33Å; V136-V138 PolarHBondContact O-N 3.46Å | ||
| 139 | V | 53.3 | Low | 66.8 | Low | 124 Ų | 124 | 120.4 Ų | 120.4 | 75% | 0.752 | 67% | 0.669 | S | S | * | * | S | Bend | trans | -78.6 | 115.9 | 159.4 | -171.7 | 0 | 0 | 0 | 0 | 104.7 | H137 | H137-V139 PolarHBondContact O-N 3.02Š|
| 140 | N | 47 | Very low | 66.3 | Low | 133 Ų | 133 | 125.5 Ų | 125.5 | 71% | 0.711 | 68% | 0.679 | S | S | * | * | trans | 72.4 | 86.1 | -166.9 | -76.5 | 3.5 | 0 | 0 | 0 | 116.3 | S142 | N140-S142 VanDerWaalsContact C-N 3.27Š| ||
| 141 | A | 53.8 | Low | 66.1 | Low | 89 Ų | 89 | 124.7 Ų | 124.7 | 74% | 0.736 | 69% | 0.692 | S | S | * | * | trans | -87.9 | 16.2 | 164.7 | 0 | 0 | 0 | 0 | 0 | 113.1 | Y143 | A141-Y143 PolarHBondContact O-N 3.33Š| ||
| 142 | S | 49.4 | Very low | 66.1 | Low | 83 Ų | 83 | 131.1 Ų | 131.1 | 58% | 0.58 | 70% | 0.703 | S | S | * | * | trans | -95.4 | 71.8 | 171.4 | 56.2 | 0 | 0 | 0 | 0 | 109 | N140 | N140-S142 VanDerWaalsContact C-N 3.27Š| ||
| 143 | Y | 43.1 | Very low | 66.3 | Low | 209 Ų | 209 | 127 Ų | 127 | 82% | 0.82 | 70% | 0.701 | S | S | * | * | S | Bend | trans | 177 | 119.1 | 148.3 | -106.8 | -84.4 | 0 | 0 | 0 | 106.8 | A141 | A141-Y143 PolarHBondContact O-N 3.33Š|
| 144 | S | 48 | Very low | 66.7 | Low | 115 Ų | 115 | 126.6 Ų | 126.6 | 80% | 0.804 | 71% | 0.713 | S | S | * | * | trans | -43.7 | 137.5 | 167.8 | 46.5 | 0 | 0 | 0 | 0 | 113 | ||||
| 145 | G | 48.9 | Very low | 67.4 | Low | 72 Ų | 72 | 124.2 Ų | 124.2 | 74% | 0.742 | 70% | 0.701 | S | S | * | * | S | Bend | trans | 105.9 | 100.4 | 162.1 | 0 | 0 | 0 | 0 | 0 | 115.1 | V147 | G145-V147 PolarHBondContact O-N 3.17Š|
| 146 | G | 56.8 | Low | 68.1 | Low | 78 Ų | 78 | 120.7 Ų | 120.7 | 80% | 0.804 | 69% | 0.692 | S | S | * | * | trans | 65.7 | 30.6 | 145.8 | 0 | 0 | 0 | 0 | 0 | 118.9 | P148 | G146-P148 VanDerWaalsContact O-CD 3.26Å; G146-P148 WeakPolarHBondContact O-CD 3.23Å; G146-P148 VanDerWaalsContact O-N 3.11Å | ||
| 147 | V | 55.6 | Low | 69.3 | Low | 97 Ų | 97 | 124.4 Ų | 124.4 | 59% | 0.588 | 69% | 0.693 | S | S | * | * | P | Polyproline II helix | trans | -57.7 | 118.6 | -178.7 | -165.5 | 0 | 0 | 0 | 0 | 111 | G145 K149 | G145-V147 PolarHBondContact O-N 3.17Å; V147-K149 PolarHBondContact O-N 3.04Å |
| 148 | P | 61 | Low | 70.8 | Confident | 112 Ų | 112 | 123.6 Ų | 123.6 | 73% | 0.727 | 69% | 0.689 | S | S | * | * | P | Polyproline II helix | trans | -60.7 | 132.4 | -178.8 | -21.9 | 32.1 | 0 | 0 | 0 | 110.6 | G146 R150 | G146-P148 VanDerWaalsContact O-CD 3.26Å; G146-P148 WeakPolarHBondContact O-CD 3.23Å; G146-P148 VanDerWaalsContact O-N 3.11Å; P148-R150 PolarHBondContact O-N 2.98Å; P148-R150 VanDerWaalsContact O-N 3.14Å |
| 149 | K | 73.9 | Confident | 72.6 | Confident | 177 Ų | 177 | 121.7 Ų | 121.7 | 77% | 0.77 | 68% | 0.675 | S | S | * | * | P | Polyproline II helix | trans | -49.8 | 125.1 | 164.2 | -88.3 | 153.1 | 172.2 | 170 | 0 | 107.2 | V147 S151 | V147-K149 PolarHBondContact O-N 3.04Å; K149-S151 PolarHBondContact O-N 3.45Å |
| 150 | R | 77.9 | Confident | 74.8 | Confident | 190 Ų | 190 | 117.3 Ų | 117.3 | 72% | 0.717 | 65% | 0.652 | S | S | * | * | trans | -46 | 108.8 | 176 | -118.6 | -178 | -83.6 | 179.6 | -5.3 | 108.4 | H137 P148 | H137-R150 PolarHBondContact O-NH2 3.49Å; P148-R150 PolarHBondContact O-N 2.98Å; P148-R150 VanDerWaalsContact O-N 3.14Å | ||
| 151 | S | 85.5 | Confident | 77.2 | Confident | 113 Ų | 113 | 114.8 Ų | 114.8 | 79% | 0.79 | 64% | 0.638 | S | S | * | * | P | Polyproline II helix | trans | -65.7 | 136.5 | -176 | -175.6 | 0 | 0 | 0 | 0 | 109.3 | K149 | K149-S151 PolarHBondContact O-N 3.45Š|
| 152 | R | 90.8 | Very high | 79.3 | Confident | 236 Ų | 236 | 113.8 Ų | 113.8 | 89% | 0.891 | 62% | 0.619 | S | S | * | * | P | Polyproline II helix | trans | -87.6 | 117.3 | 177.9 | -72.1 | -179.8 | 177.1 | -97.7 | 1.9 | 108.6 | ||
| 153 | T | 93.8 | Very high | 81.7 | Confident | 119 Ų | 119 | 109.9 Ų | 109.9 | 73% | 0.73 | 59% | 0.591 | S | S | * | * | P | Polyproline II helix | trans | -77.6 | 128 | 169 | -44.4 | 0 | 0 | 0 | 0 | 109.7 | ||
| 154 | A | 95.7 | Very high | 84.3 | Confident | 87 Ų | 87 | 103.6 Ų | 103.6 | 72% | 0.719 | 57% | 0.569 | S | S | * | * | P | Polyproline II helix | trans | -82.9 | 146.5 | 172.3 | 0 | 0 | 0 | 0 | 0 | 110.5 | ||
| 155 | Y | 98 | Very high | 86.7 | Confident | 79 Ų | 79 | 104 Ų | 104 | 31% | 0.31 | 56% | 0.557 | S | S | . | * | P | Polyproline II helix | trans | -78.1 | 147.2 | 171.2 | -60.3 | -51.3 | 0 | 0 | 0 | 110.4 | L187 W195 | Y155-L187 HydrophobicContact CD1-CD1 4.08Å; Y155-L187 HydrophobicContact CD1-CD2 3.85Å; Y155-L187 HydrophobicContact CE1-CD1 3.92Å; Y155-L187 HydrophobicContact CE1-CD2 3.67Å; Y155-L187 HydrophobicContact CE1-CG 4.47Å; Y155-W195 AromaticContact CD2-CD1 3.85Å; Y155-W195 AromaticContact CE2-CD1 3.55Å |
| 156 | T | 98.4 | Very high | 89.1 | Confident | 76 Ų | 76 | 101.5 Ų | 101.5 | 47% | 0.466 | 53% | 0.526 | S | S | . | . | P | Polyproline II helix | trans | -68 | 160.9 | 172.9 | 74 | 0 | 0 | 0 | 0 | 110.4 | Q158 Q159 A160 | T156-Q158 VanDerWaalsContact C-N 3.28Å; T156-Q158 PolarHBondContact O-N 3.33Å; T156-Q159 PolarHBondContact O-N 3.48Å; T156-Q159 VanDerWaalsContact OG1-CG 3.32Å; T156-Q159 WeakPolarHBondContact OG1-CG 3.14Å; T156-Q159 PolarHBondContact OG1-N 2.85Å; T156-A160 PolarHBondContact O-N 3.38Å |
| 157 | R | 98 | Very high | 91 | Very high | 202 Ų | 202 | 98 Ų | 98 | 76% | 0.762 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -57.5 | -42.9 | 176.6 | -175.4 | 173.7 | -179.3 | -85.8 | -0.7 | 111.9 | A160 L161 | R157-A160 PolarHBondContact O-N 2.84Å; R157-L161 HydrophobicContact CG-CD1 4.14Å; R157-L161 WeakPolarHBondContact O-CG 3.25Å; R157-L161 PolarHBondContact O-N 2.89Å |
| 158 | Q | 98.1 | Very high | 93.1 | Very high | 137 Ų | 137 | 99.1 Ų | 99.1 | 64% | 0.64 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -61.7 | -44 | 177.4 | -177.4 | -177.3 | -15.2 | 0 | 0 | 111.6 | T156 A160 L161 E162 M185 | T156-Q158 VanDerWaalsContact C-N 3.28Å; T156-Q158 PolarHBondContact O-N 3.33Å; Q158-A160 VanDerWaalsContact C-N 3.34Å; Q158-A160 PolarHBondContact O-N 3.29Å; Q158-L161 PolarHBondContact O-N 3.43Å; Q158-E162 PolarHBondContact O-N 2.96Å; Q158-E162 VanDerWaalsContact O-N 3.13Å; Q158-M185 HydrophobicContact CG-CE 4.5Å |
| 159 | Q | 98.4 | Very high | 94.8 | Very high | 27 Ų | 27 | 101.7 Ų | 101.7 | 13% | 0.126 | 49% | 0.487 | C | S | . | . | H | α-helix | trans | -59.6 | -45.3 | 176.8 | -75 | 171.1 | -21.6 | 0 | 0 | 111.9 | T156 L161 L163 M185 | T156-Q159 PolarHBondContact O-N 3.48Å; T156-Q159 VanDerWaalsContact OG1-CG 3.32Å; T156-Q159 WeakPolarHBondContact OG1-CG 3.14Å; T156-Q159 PolarHBondContact OG1-N 2.85Å; Q159-L161 PolarHBondContact O-N 3.34Å; Q159-L163 WeakPolarHBondContact O-CB 3.36Å; Q159-L163 WeakPolarHBondContact O-CD1 3.44Å; Q159-L163 WeakPolarHBondContact O-CG 3.26Å; Q159-L163 PolarHBondContact O-N 2.78Å; Q159-L163 VanDerWaalsContact O-N 3.11Å; Q159-M185 VanDerWaalsContact CA-SD 3.59Å; Q159-M185 HydrophobicContact CB-SD 4.25Å; Q159-M185 HydrophobicContact CG-CB 4.5Å; Q159-M185 HydrophobicContact CG-CE 4.26Å; Q159-M185 HydrophobicContact CG-SD 4.32Å; Q159-M185 PolarHBondContact NE2-O 3.14Å |
| 160 | A | 98.2 | Very high | 95.9 | Very high | 32 Ų | 32 | 96.8 Ų | 96.8 | 26% | 0.264 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -62.2 | -44 | 178.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | T156 R157 Q158 L163 E164 | T156-A160 PolarHBondContact O-N 3.38Å; R157-A160 PolarHBondContact O-N 2.84Å; Q158-A160 VanDerWaalsContact C-N 3.34Å; Q158-A160 PolarHBondContact O-N 3.29Å; A160-L163 PolarHBondContact O-N 3.11Å; A160-E164 WeakPolarHBondContact O-CB 3.49Å; A160-E164 WeakPolarHBondContact O-CG 3.39Å; A160-E164 PolarHBondContact O-N 3.02Å |
| 161 | L | 98.3 | Very high | 96.9 | Very high | 80 Ų | 80 | 92.4 Ų | 92.4 | 42% | 0.419 | 45% | 0.452 | S | S | . | . | H | α-helix | trans | -65 | -46.2 | -178 | -71.5 | 172.5 | 0 | 0 | 0 | 112.8 | R157 Q158 Q159 E164 K165 | R157-L161 HydrophobicContact CG-CD1 4.14Å; R157-L161 WeakPolarHBondContact O-CG 3.25Å; R157-L161 PolarHBondContact O-N 2.89Å; Q158-L161 PolarHBondContact O-N 3.43Å; Q159-L161 PolarHBondContact O-N 3.34Å; L161-E164 PolarHBondContact O-N 3.1Å; L161-K165 WeakPolarHBondContact O-CB 3.4Å; L161-K165 PolarHBondContact O-N 3.13Å |
| 162 | E | 98.3 | Very high | 97.5 | Very high | 69 Ų | 69 | 93.9 Ų | 93.9 | 32% | 0.322 | 44% | 0.442 | S | S | . | . | H | α-helix | trans | -66.9 | -38.3 | 178.2 | -72.5 | -64.3 | 153.4 | 0 | 0 | 111.5 | Q158 E164 K165 E166 M185 | Q158-E162 PolarHBondContact O-N 2.96Å; Q158-E162 VanDerWaalsContact O-N 3.13Å; E162-E164 VanDerWaalsContact C-N 3.33Å; E162-E164 PolarHBondContact O-N 3.22Å; E162-K165 WeakPolarHBondContact O-CB 3.45Å; E162-K165 PolarHBondContact O-N 2.85Å; E162-K165 IonicContact OE1-NZ 3.81Å; E162-K165 WeakPolarHBondContact OE2-CD 3.4Å; E162-K165 IonicContact OE2-NZ 3.71Å; E162-K165 PolarHBondContact OE2-NZ 3.27Å; E162-E166 WeakPolarHBondContact O-CG 3.42Å; E162-E166 PolarHBondContact O-N 3.28Å; E162-M185 HydrophobicContact CB-CE 3.5Å; E162-M185 HydrophobicContact CB-SD 3.42Å; E162-M185 WeakPolarHBondContact CB-SD 3.3Å; E162-M185 HydrophobicContact CG-CE 3.61Å; E162-M185 HydrophobicContact CG-SD 4.23Å |
| 163 | L | 98.5 | Very high | 97.8 | Very high | 0 Ų | 0 | 84 Ų | 84 | 0% | 0 | 41% | 0.407 | C | S | . | . | H | α-helix | trans | -63 | -39.2 | 173.1 | -71.4 | 168.8 | 0 | 0 | 0 | 112.1 | Q159 A160 F167 I181 M185 L187 V192 W195 F196 | Q159-L163 WeakPolarHBondContact O-CB 3.36Å; Q159-L163 WeakPolarHBondContact O-CD1 3.44Å; Q159-L163 WeakPolarHBondContact O-CG 3.26Å; Q159-L163 PolarHBondContact O-N 2.78Å; Q159-L163 VanDerWaalsContact O-N 3.11Å; A160-L163 PolarHBondContact O-N 3.11Å; L163-F167 WeakPolarHBondContact O-CB 3.28Å; L163-F167 PolarHBondContact O-N 2.93Å; L163-I181 HydrophobicContact CD2-CG2 3.93Å; L163-M185 HydrophobicContact CG-SD 4.25Å; L163-L187 HydrophobicContact CD1-CD1 4.12Å; L163-V192 HydrophobicContact CD2-CG1 4.33Å; L163-W195 VanDerWaalsContact C-CH2 3.47Å; L163-W195 HydrophobicContact CB-CD2 3.94Å; L163-W195 HydrophobicContact CB-CE3 3.94Å; L163-W195 HydrophobicContact CB-CH2 3.66Å; L163-W195 HydrophobicContact CB-CZ2 3.64Å; L163-W195 HydrophobicContact CB-CZ3 3.81Å; L163-W195 HydrophobicContact CD1-CD2 3.89Å; L163-W195 HydrophobicContact CD1-CG 3.84Å; L163-W195 HydrophobicContact CD2-CD2 4.48Å; L163-W195 HydrophobicContact CD2-CE3 4.4Å; L163-W195 HydrophobicContact CG-CD2 4.33Å; L163-W195 WeakPolarHBondContact O-CH2 3.48Å; L163-W195 WeakPolarHBondContact O-CZ3 3.4Å; L163-F196 HydrophobicContact CD2-CE2 4.09Å |
| 164 | E | 98.4 | Very high | 98.1 | Very high | 78 Ų | 78 | 82.4 Ų | 82.4 | 36% | 0.364 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -65.8 | -45.4 | 173.7 | -76.8 | -170.2 | 179.2 | 0 | 0 | 111.9 | A160 L161 E162 E166 F167 H168 W195 | A160-E164 WeakPolarHBondContact O-CB 3.49Å; A160-E164 WeakPolarHBondContact O-CG 3.39Å; A160-E164 PolarHBondContact O-N 3.02Å; L161-E164 PolarHBondContact O-N 3.1Å; E162-E164 VanDerWaalsContact C-N 3.33Å; E162-E164 PolarHBondContact O-N 3.22Å; E164-E166 VanDerWaalsContact C-N 3.34Å; E164-E166 PolarHBondContact O-N 3.45Å; E164-F167 WeakPolarHBondContact O-CB 3.41Å; E164-F167 PolarHBondContact O-N 2.71Å; E164-F167 VanDerWaalsContact O-N 3.13Å; E164-H168 PolarHBondContact O-N 3.11Å; E164-H168 PolarHBondContact O-ND1 3.07Å; E164-W195 HydrophobicContact CG-CH2 3.92Å; E164-W195 HydrophobicContact CG-CZ2 4.01Å |
| 165 | K | 98.4 | Very high | 98.2 | Very high | 124 Ų | 124 | 85 Ų | 85 | 54% | 0.539 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -55.2 | -49.1 | 175.6 | 176.9 | -173.5 | 167 | -164.7 | 0 | 111.4 | L161 E162 F167 H168 F169 | L161-K165 WeakPolarHBondContact O-CB 3.4Å; L161-K165 PolarHBondContact O-N 3.13Å; E162-K165 WeakPolarHBondContact O-CB 3.45Å; E162-K165 PolarHBondContact O-N 2.85Å; E162-K165 IonicContact OE1-NZ 3.81Å; E162-K165 WeakPolarHBondContact OE2-CD 3.4Å; E162-K165 IonicContact OE2-NZ 3.71Å; E162-K165 PolarHBondContact OE2-NZ 3.27Å; K165-F167 VanDerWaalsContact C-N 3.32Å; K165-F167 PolarHBondContact O-N 3.31Å; K165-H168 PolarHBondContact O-N 3.13Å; K165-F169 PolarHBondContact O-N 3.34Å; K165-F169 VanDerWaalsContact O-N 3.08Å |
| 166 | E | 98.3 | Very high | 98.2 | Very high | 19 Ų | 19 | 90.3 Ų | 90.3 | 9% | 0.089 | 41% | 0.407 | C | S | . | . | H | α-helix | trans | -62.6 | -37.9 | 176.5 | -72.5 | -64.2 | 134.2 | 0 | 0 | 112.4 | E162 E164 H168 F169 N170 R177 I181 F196 | E162-E166 WeakPolarHBondContact O-CG 3.42Å; E162-E166 PolarHBondContact O-N 3.28Å; E164-E166 VanDerWaalsContact C-N 3.34Å; E164-E166 PolarHBondContact O-N 3.45Å; E166-H168 VanDerWaalsContact C-N 3.34Å; E166-H168 PolarHBondContact O-N 3.49Å; E166-F169 PolarHBondContact O-N 3.34Å; E166-N170 PolarHBondContact O-N 3.04Å; E166-N170 VanDerWaalsContact O-O 3.14Å; E166-R177 IonicContact OE1-CZ 2.7Å; E166-R177 IonicContact OE1-NE 3.83Å; E166-R177 IonicContact OE1-NH2 3.36Å; E166-R177 PolarHBondContact OE1-NH2 2.78Å; E166-R177 IonicContact OE2-CZ 3.13Å; E166-R177 IonicContact OE2-NE 3.23Å; E166-R177 PolarHBondContact OE2-NE 2.8Å; E166-R177 IonicContact OE2-NH2 2.9Å; E166-R177 PolarHBondContact OE2-NH2 2.92Å; E166-I181 HydrophobicContact CB-CD1 4.01Å; E166-I181 HydrophobicContact CG-CD1 3.68Å; E166-I181 HydrophobicContact CG-CG1 4.03Å; E166-F196 HydrophobicContact CB-CZ 4Å |
| 167 | F | 98.5 | Very high | 98.2 | Very high | 3 Ų | 3 | 90.8 Ų | 90.8 | 1% | 0.013 | 40% | 0.401 | C | S | . | . | H | α-helix | trans | -65.1 | -36.6 | 177.5 | -177.4 | -99.1 | 0 | 0 | 0 | 113.1 | L163 E164 K165 N170 R171 W195 F196 R199 R200 W203 | L163-F167 WeakPolarHBondContact O-CB 3.28Å; L163-F167 PolarHBondContact O-N 2.93Å; E164-F167 WeakPolarHBondContact O-CB 3.41Å; E164-F167 PolarHBondContact O-N 2.71Å; E164-F167 VanDerWaalsContact O-N 3.13Å; K165-F167 VanDerWaalsContact C-N 3.32Å; K165-F167 PolarHBondContact O-N 3.31Å; F167-N170 CarbonylContact O-C 3.3Å; F167-N170 VanDerWaalsContact O-C 3.3Å; F167-R171 HydrophobicContact CE1-CG 4.23Å; F167-R171 HydrophobicContact CE2-CB 4.03Å; F167-R171 HydrophobicContact CE2-CG 4.1Å; F167-R171 HydrophobicContact CZ-CB 4.27Å; F167-R171 HydrophobicContact CZ-CG 3.88Å; F167-R171 PolarHBondContact O-N 3.44Å; F167-W195 HydrophobicContact CB-CH2 4.39Å; F167-W195 HydrophobicContact CB-CZ3 4.08Å; F167-F196 HydrophobicContact CB-CE1 4.2Å; F167-F196 HydrophobicContact CB-CZ 4.32Å; F167-F196 AromaticContact CD2-CD1 4Å; F167-F196 HydrophobicContact CD2-CD1 4Å; F167-F196 AromaticContact CD2-CE1 3.95Å; F167-F196 HydrophobicContact CD2-CE1 3.95Å; F167-R199 HydrophobicContact CB-CG 4.32Å; F167-R199 HydrophobicContact CD1-CG 3.69Å; F167-R199 HydrophobicContact CD2-CB 4.18Å; F167-R199 HydrophobicContact CD2-CG 3.53Å; F167-R199 HydrophobicContact CE1-CG 3.8Å; F167-R199 HydrophobicContact CE2-CB 4.21Å; F167-R199 HydrophobicContact CE2-CG 3.66Å; F167-R199 HydrophobicContact CG-CG 3.55Å; F167-R199 HydrophobicContact CZ-CG 3.78Å; F167-R200 HydrophobicContact CE2-CG 3.74Å; F167-R200 HydrophobicContact CZ-CG 4.31Å; F167-W203 HydrophobicContact CE1-CB 4.12Å; F167-W203 HydrophobicContact CE1-CG 4.11Å; F167-W203 HydrophobicContact CZ-CB 3.86Å; F167-W203 HydrophobicContact CZ-CG 4.04Å |
| 168 | H | 97.9 | Very high | 98.2 | Very high | 121 Ų | 121 | 83.8 Ų | 83.8 | 56% | 0.56 | 37% | 0.374 | S | S | * | . | H | α-helix | trans | -68.7 | -39.5 | 174.4 | -69.7 | 92.5 | 0 | 0 | 0 | 111.2 | E164 K165 E166 | E164-H168 PolarHBondContact O-N 3.11Å; E164-H168 PolarHBondContact O-ND1 3.07Å; K165-H168 PolarHBondContact O-N 3.13Å; E166-H168 VanDerWaalsContact C-N 3.34Å; E166-H168 PolarHBondContact O-N 3.49Å |
| 169 | F | 98.2 | Very high | 98.2 | Very high | 167 Ų | 167 | 79.2 Ų | 79.2 | 73% | 0.732 | 36% | 0.355 | S | S | * | . | H | α-helix | trans | -62.9 | -50.3 | 174.9 | 179.5 | -104.2 | 0 | 0 | 0 | 111.7 | K165 E166 | K165-F169 PolarHBondContact O-N 3.34Å; K165-F169 VanDerWaalsContact O-N 3.08Å; E166-F169 PolarHBondContact O-N 3.34Å |
| 170 | N | 97.2 | Very high | 98.2 | Very high | 73 Ų | 73 | 81.1 Ų | 81.1 | 39% | 0.39 | 36% | 0.364 | S | S | . | . | trans | -146.9 | 122.2 | 174.8 | -169.5 | -8.8 | 0 | 0 | 0 | 111.4 | E166 F167 Y172 | E166-N170 PolarHBondContact O-N 3.04Å; E166-N170 VanDerWaalsContact O-O 3.14Å; F167-N170 CarbonylContact O-C 3.3Å; F167-N170 VanDerWaalsContact O-C 3.3Å; N170-Y172 PolarHBondContact ND2-O 3.45Å; N170-Y172 PolarHBondContact O-N 3.47Å; N170-Y172 VanDerWaalsContact O-N 3.14Å; N170-Y172 PolarHBondContact OD1-N 3.19Å; N170-Y172 VanDerWaalsContact OD1-N 3.09Å; N170-Y172 PolarHBondContact OD1-O 3.21Å | ||
| 171 | R | 97.6 | Very high | 98.2 | Very high | 99 Ų | 99 | 80 Ų | 80 | 37% | 0.374 | 35% | 0.354 | S | S | . | . | S | Bend | trans | -67.3 | -15.3 | -179.2 | -69.2 | 171.3 | 170.6 | 70.9 | -1 | 113.2 | F167 R200 | F167-R171 HydrophobicContact CE1-CG 4.23Å; F167-R171 HydrophobicContact CE2-CB 4.03Å; F167-R171 HydrophobicContact CE2-CG 4.1Å; F167-R171 HydrophobicContact CZ-CB 4.27Å; F167-R171 HydrophobicContact CZ-CG 3.88Å; F167-R171 PolarHBondContact O-N 3.44Å; R171-R200 WeakPolarHBondContact O-CD 3.42Å |
| 172 | Y | 98.3 | Very high | 98.2 | Very high | 144 Ų | 144 | 76.3 Ų | 76.3 | 57% | 0.565 | 34% | 0.335 | S | S | * | . | S | Bend | trans | -132.1 | 133.2 | -178.3 | -63.6 | -106.3 | 0 | 0 | 0 | 109.9 | N170 | N170-Y172 PolarHBondContact ND2-O 3.45Å; N170-Y172 PolarHBondContact O-N 3.47Å; N170-Y172 VanDerWaalsContact O-N 3.14Å; N170-Y172 PolarHBondContact OD1-N 3.19Å; N170-Y172 VanDerWaalsContact OD1-N 3.09Å; N170-Y172 PolarHBondContact OD1-O 3.21Å |
| 173 | L | 98.2 | Very high | 98.2 | Very high | 29 Ų | 29 | 79.7 Ų | 79.7 | 15% | 0.152 | 35% | 0.35 | C | S | . | . | trans | -96.9 | 139.4 | 179.2 | -62.3 | -179.6 | 0 | 0 | 0 | 112 | R177 I181 V192 F196 | L173-R177 HydrophobicContact CD2-CG 3.94Å; L173-I181 HydrophobicContact CD1-CD1 3.8Å; L173-I181 HydrophobicContact CD2-CD1 3.71Å; L173-I181 HydrophobicContact CG-CD1 4.42Å; L173-V192 HydrophobicContact CD1-CG1 3.63Å; L173-F196 HydrophobicContact CD1-CD1 4.09Å; L173-F196 HydrophobicContact CD1-CD2 3.59Å; L173-F196 HydrophobicContact CD1-CE1 3.94Å; L173-F196 HydrophobicContact CD1-CE2 3.46Å; L173-F196 VanDerWaalsContact CD1-CE2 3.46Å; L173-F196 HydrophobicContact CD1-CG 3.92Å; L173-F196 HydrophobicContact CD1-CZ 3.64Å; L173-F196 HydrophobicContact CD2-CD1 4.4Å; L173-F196 HydrophobicContact CD2-CE1 3.69Å; L173-F196 HydrophobicContact CD2-CE2 4.36Å; L173-F196 HydrophobicContact CD2-CZ 3.67Å; L173-F196 HydrophobicContact CG-CD1 3.74Å; L173-F196 HydrophobicContact CG-CD2 4.18Å; L173-F196 HydrophobicContact CG-CE1 3.51Å; L173-F196 HydrophobicContact CG-CE2 4.01Å; L173-F196 HydrophobicContact CG-CG 4.07Å; L173-F196 HydrophobicContact CG-CZ 3.67Å | ||
| 174 | T | 98.5 | Very high | 98.2 | Very high | 85 Ų | 85 | 84.9 Ų | 84.9 | 52% | 0.521 | 38% | 0.382 | S | S | . | . | trans | -73.1 | 167.4 | 162.9 | 66.6 | 0 | 0 | 0 | 0 | 110.8 | R177 R178 | T174-R177 WeakPolarHBondContact OG1-CB 3.28Å; T174-R177 PolarHBondContact OG1-N 3.49Å; T174-R178 WeakPolarHBondContact O-CB 3.43Å; T174-R178 PolarHBondContact O-N 3.24Å; T174-R178 VanDerWaalsContact O-N 3.14Å | ||
| 175 | R | 98.3 | Very high | 98.1 | Very high | 140 Ų | 140 | 81.6 Ų | 81.6 | 53% | 0.528 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -60.5 | -47 | 177.8 | -179.3 | 65 | 179.2 | 88.6 | -11.9 | 112 | R178 V179 E189 | R175-R178 WeakPolarHBondContact O-CB 3.47Å; R175-R178 PolarHBondContact O-N 2.89Å; R175-V179 PolarHBondContact O-N 3.19Å; R175-E189 VanDerWaalsContact CZ-CD 3.49Å; R175-E189 IonicContact CZ-OE1 3.24Å; R175-E189 VanDerWaalsContact CZ-OE1 3.24Å; R175-E189 IonicContact CZ-OE2 2.95Å; R175-E189 IonicContact NE-OE2 3.74Å; R175-E189 IonicContact NH1-OE1 4Å; R175-E189 PolarHBondContact NH1-OE1 3.22Å; R175-E189 IonicContact NH1-OE2 2.68Å; R175-E189 PolarHBondContact NH1-OE2 3.36Å; R175-E189 VanDerWaalsContact NH2-CD 3.34Å; R175-E189 IonicContact NH2-OE1 2.87Å; R175-E189 PolarHBondContact NH2-OE1 3.35Å; R175-E189 IonicContact NH2-OE2 3.01Å; R175-E189 PolarHBondContact NH2-OE2 2.84Å; R175-E189 VanDerWaalsContact NH2-OE2 3.13Å |
| 176 | R | 98.2 | Very high | 98 | Very high | 192 Ų | 192 | 81.1 Ų | 81.1 | 73% | 0.725 | 38% | 0.378 | S | S | * | . | H | α-helix | trans | -62.2 | -50.4 | 179.4 | 178.6 | 178 | 169.3 | 164.8 | 2.5 | 111.5 | R178 V179 E180 | R176-R178 PolarHBondContact O-N 3.48Å; R176-V179 WeakPolarHBondContact O-CB 3.41Å; R176-V179 PolarHBondContact O-N 3.43Å; R176-E180 WeakPolarHBondContact CG-OE1 3.28Å; R176-E180 IonicContact NE-OE1 3.12Å; R176-E180 PolarHBondContact NE-OE1 3.05Å; R176-E180 VanDerWaalsContact NE-OE1 3.12Å; R176-E180 PolarHBondContact O-N 3.08Å |
| 177 | R | 98.3 | Very high | 98 | Very high | 86 Ų | 86 | 81.1 Ų | 81.1 | 33% | 0.325 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -60.7 | -34.1 | -179.1 | -172.7 | 56.2 | 175.6 | 179.1 | -1.4 | 112.6 | E166 L173 T174 V179 E180 I181 | E166-R177 IonicContact OE1-CZ 2.7Å; E166-R177 IonicContact OE1-NE 3.83Å; E166-R177 IonicContact OE1-NH2 3.36Å; E166-R177 PolarHBondContact OE1-NH2 2.78Å; E166-R177 IonicContact OE2-CZ 3.13Å; E166-R177 IonicContact OE2-NE 3.23Å; E166-R177 PolarHBondContact OE2-NE 2.8Å; E166-R177 IonicContact OE2-NH2 2.9Å; E166-R177 PolarHBondContact OE2-NH2 2.92Å; L173-R177 HydrophobicContact CD2-CG 3.94Å; T174-R177 WeakPolarHBondContact OG1-CB 3.28Å; T174-R177 PolarHBondContact OG1-N 3.49Å; R177-V179 VanDerWaalsContact C-N 3.34Å; R177-V179 PolarHBondContact O-N 3.39Å; R177-E180 VanDerWaalsContact CD-OE2 3.29Å; R177-E180 WeakPolarHBondContact CD-OE2 3.36Å; R177-E180 IonicContact CZ-OE2 2.78Å; R177-E180 IonicContact NH1-OE2 2.83Å; R177-E180 PolarHBondContact NH1-OE2 3.46Å; R177-E180 PolarHBondContact O-N 3.37Å; R177-I181 HydrophobicContact CG-CD1 3.92Å; R177-I181 HydrophobicContact CG-CG1 4.47Å; R177-I181 WeakPolarHBondContact O-CG1 3.38Å; R177-I181 PolarHBondContact O-N 3.29Å; R177-I181 VanDerWaalsContact O-N 3.09Å |
| 178 | R | 98.4 | Very high | 98 | Very high | 55 Ų | 55 | 83.6 Ų | 83.6 | 21% | 0.208 | 40% | 0.396 | C | S | . | . | H | α-helix | trans | -61.2 | -40.3 | 175 | -171.2 | -172.3 | -54.3 | 173.2 | 7.6 | 112.8 | T174 R175 R176 A182 E189 V192 | T174-R178 WeakPolarHBondContact O-CB 3.43Å; T174-R178 PolarHBondContact O-N 3.24Å; T174-R178 VanDerWaalsContact O-N 3.14Å; R175-R178 WeakPolarHBondContact O-CB 3.47Å; R175-R178 PolarHBondContact O-N 2.89Å; R176-R178 PolarHBondContact O-N 3.48Å; R178-A182 VanDerWaalsContact O-CB 3.23Å; R178-A182 WeakPolarHBondContact O-CB 3.17Å; R178-A182 PolarHBondContact O-N 2.88Å; R178-E189 HydrophobicContact CG-CB 4.3Å; R178-E189 HydrophobicContact CG-CG 4.49Å; R178-V192 HydrophobicContact CG-CB 4.26Å; R178-V192 HydrophobicContact CG-CG1 4.14Å |
| 179 | V | 98.6 | Very high | 98 | Very high | 40 Ų | 40 | 80.6 Ų | 80.6 | 24% | 0.242 | 38% | 0.382 | C | S | . | . | H | α-helix | trans | -64 | -47.8 | 177.2 | -178.6 | 0 | 0 | 0 | 0 | 110.1 | R175 R176 R177 I181 A182 H183 | R175-V179 PolarHBondContact O-N 3.19Å; R176-V179 WeakPolarHBondContact O-CB 3.41Å; R176-V179 PolarHBondContact O-N 3.43Å; R177-V179 VanDerWaalsContact C-N 3.34Å; R177-V179 PolarHBondContact O-N 3.39Å; V179-I181 PolarHBondContact O-N 2.89Å; V179-A182 WeakPolarHBondContact O-CB 3.45Å; V179-A182 PolarHBondContact O-N 3.26Å; V179-H183 PolarHBondContact O-CD2 3.02Å; V179-H183 PolarHBondContact O-N 3.36Å |
| 180 | E | 98.3 | Very high | 98 | Very high | 67 Ų | 67 | 81.2 Ų | 81.2 | 31% | 0.313 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -56.2 | -50.9 | -179.6 | -65.2 | 169.3 | -172 | 0 | 0 | 111 | R176 R177 A182 H183 T184 | R176-E180 WeakPolarHBondContact CG-OE1 3.28Å; R176-E180 IonicContact NE-OE1 3.12Å; R176-E180 PolarHBondContact NE-OE1 3.05Å; R176-E180 VanDerWaalsContact NE-OE1 3.12Å; R176-E180 PolarHBondContact O-N 3.08Å; R177-E180 VanDerWaalsContact CD-OE2 3.29Å; R177-E180 WeakPolarHBondContact CD-OE2 3.36Å; R177-E180 IonicContact CZ-OE2 2.78Å; R177-E180 IonicContact NH1-OE2 2.83Å; R177-E180 PolarHBondContact NH1-OE2 3.46Å; R177-E180 PolarHBondContact O-N 3.37Å; E180-A182 PolarHBondContact O-N 3.19Å; E180-H183 PolarHBondContact O-N 3.42Å; E180-T184 PolarHBondContact O-N 3.47Å; E180-T184 VanDerWaalsContact O-N 3.11Å; E180-T184 PolarHBondContact O-OG1 3.34Å; E180-T184 VanDerWaalsContact O-OG1 3.11Å |
| 181 | I | 98.1 | Very high | 98.1 | Very high | 9 Ų | 9 | 80.7 Ų | 80.7 | 5% | 0.046 | 38% | 0.375 | C | S | . | . | H | α-helix | trans | -63.2 | -42.4 | 178.9 | -64.5 | 166.8 | 0 | 0 | 0 | 111.5 | L163 E166 L173 R177 V179 H183 T184 M185 V192 | L163-I181 HydrophobicContact CD2-CG2 3.93Å; E166-I181 HydrophobicContact CB-CD1 4.01Å; E166-I181 HydrophobicContact CG-CD1 3.68Å; E166-I181 HydrophobicContact CG-CG1 4.03Å; L173-I181 HydrophobicContact CD1-CD1 3.8Å; L173-I181 HydrophobicContact CD2-CD1 3.71Å; L173-I181 HydrophobicContact CG-CD1 4.42Å; R177-I181 HydrophobicContact CG-CD1 3.92Å; R177-I181 HydrophobicContact CG-CG1 4.47Å; R177-I181 WeakPolarHBondContact O-CG1 3.38Å; R177-I181 PolarHBondContact O-N 3.29Å; R177-I181 VanDerWaalsContact O-N 3.09Å; V179-I181 PolarHBondContact O-N 2.89Å; I181-H183 VanDerWaalsContact C-N 3.3Å; I181-H183 PolarHBondContact O-N 2.83Å; I181-T184 PolarHBondContact O-N 2.86Å; I181-M185 HydrophobicContact CG2-CG 3.96Å; I181-M185 VanDerWaalsContact O-CB 3.25Å; I181-M185 WeakPolarHBondContact O-CB 3.39Å; I181-M185 WeakPolarHBondContact O-CG 3.5Å; I181-M185 PolarHBondContact O-N 3.31Å; I181-V192 HydrophobicContact CG2-CG1 4.1Å; I181-V192 HydrophobicContact CG2-CG2 4.29Å |
| 182 | A | 98.3 | Very high | 98.1 | Very high | 3 Ų | 3 | 76 Ų | 76 | 3% | 0.025 | 36% | 0.357 | C | S | . | . | H | α-helix | trans | -57.4 | -44.7 | 179.4 | 0 | 0 | 0 | 0 | 0 | 111.5 | R178 V179 E180 C186 L187 E189 V192 | R178-A182 VanDerWaalsContact O-CB 3.23Å; R178-A182 WeakPolarHBondContact O-CB 3.17Å; R178-A182 PolarHBondContact O-N 2.88Å; V179-A182 WeakPolarHBondContact O-CB 3.45Å; V179-A182 PolarHBondContact O-N 3.26Å; E180-A182 PolarHBondContact O-N 3.19Å; A182-C186 PolarHBondContact O-N 3.33Å; A182-C186 VanDerWaalsContact O-N 3.1Å; A182-L187 CarbonylContact C-O 3.49Å; A182-L187 WeakPolarHBondContact CA-O 3.37Å; A182-L187 VanDerWaalsContact CB-O 3.26Å; A182-L187 WeakPolarHBondContact CB-O 3.14Å; A182-L187 PolarHBondContact O-N 3.47Å; A182-L187 VanDerWaalsContact O-O 3.1Å; A182-E189 HydrophobicContact CB-CG 4.23Å; A182-V192 HydrophobicContact CB-CG2 4.14Å |
| 183 | H | 98.3 | Very high | 98.1 | Very high | 139 Ų | 139 | 74.4 Ų | 74.4 | 64% | 0.644 | 35% | 0.354 | S | S | * | . | H | α-helix | trans | -67.5 | -48.1 | 179.2 | -67 | -173.6 | 0 | 0 | 0 | 111.8 | V179 E180 I181 M185 C186 | V179-H183 PolarHBondContact O-CD2 3.02Å; V179-H183 PolarHBondContact O-N 3.36Å; E180-H183 PolarHBondContact O-N 3.42Å; I181-H183 VanDerWaalsContact C-N 3.3Å; I181-H183 PolarHBondContact O-N 2.83Å; H183-M185 PolarHBondContact O-N 2.92Å; H183-C186 PolarHBondContact O-N 3.36Å |
| 184 | T | 97.4 | Very high | 98.1 | Very high | 109 Ų | 109 | 75.6 Ų | 75.6 | 67% | 0.669 | 36% | 0.359 | S | S | * | . | H | α-helix | trans | -63.6 | -30.4 | -179.7 | -52.7 | 0 | 0 | 0 | 0 | 112.8 | E180 I181 | E180-T184 PolarHBondContact O-N 3.47Å; E180-T184 VanDerWaalsContact O-N 3.11Å; E180-T184 PolarHBondContact O-OG1 3.34Å; E180-T184 VanDerWaalsContact O-OG1 3.11Å; I181-T184 PolarHBondContact O-N 2.86Å |
| 185 | M | 96.4 | Very high | 98.1 | Very high | 9 Ų | 9 | 73.2 Ų | 73.2 | 4% | 0.044 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -96.3 | -4.1 | -176.2 | -61.9 | -96.4 | 78.2 | 0 | 0 | 114.1 | Q158 Q159 E162 L163 I181 H183 L187 | Q158-M185 HydrophobicContact CG-CE 4.5Å; Q159-M185 VanDerWaalsContact CA-SD 3.59Å; Q159-M185 HydrophobicContact CB-SD 4.25Å; Q159-M185 HydrophobicContact CG-CB 4.5Å; Q159-M185 HydrophobicContact CG-CE 4.26Å; Q159-M185 HydrophobicContact CG-SD 4.32Å; Q159-M185 PolarHBondContact NE2-O 3.14Å; E162-M185 HydrophobicContact CB-CE 3.5Å; E162-M185 HydrophobicContact CB-SD 3.42Å; E162-M185 WeakPolarHBondContact CB-SD 3.3Å; E162-M185 HydrophobicContact CG-CE 3.61Å; E162-M185 HydrophobicContact CG-SD 4.23Å; L163-M185 HydrophobicContact CG-SD 4.25Å; I181-M185 HydrophobicContact CG2-CG 3.96Å; I181-M185 VanDerWaalsContact O-CB 3.25Å; I181-M185 WeakPolarHBondContact O-CB 3.39Å; I181-M185 WeakPolarHBondContact O-CG 3.5Å; I181-M185 PolarHBondContact O-N 3.31Å; H183-M185 PolarHBondContact O-N 2.92Å; M185-L187 VanDerWaalsContact C-N 3.26Å; M185-L187 HydrophobicContact CB-CB 4.45Å; M185-L187 HydrophobicContact CB-CD1 4.15Å; M185-L187 HydrophobicContact CB-CG 4.07Å; M185-L187 PolarHBondContact O-N 3.28Å |
| 186 | C | 97.9 | Very high | 98.1 | Very high | 115 Ų | 115 | 66.9 Ų | 66.9 | 78% | 0.777 | 32% | 0.317 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 52.5 | 43.5 | -170.4 | -58.3 | 0 | 0 | 0 | 0 | 112.7 | A182 H183 | A182-C186 PolarHBondContact O-N 3.33Å; A182-C186 VanDerWaalsContact O-N 3.1Å; H183-C186 PolarHBondContact O-N 3.36Å |
| 187 | L | 97.5 | Very high | 98.2 | Very high | 19 Ų | 19 | 62.5 Ų | 62.5 | 10% | 0.099 | 31% | 0.305 | C | S | . | . | trans | -118.6 | 154 | 176.6 | -65.7 | -179.9 | 0 | 0 | 0 | 109.9 | Y155 L163 A182 M185 Q191 V192 | Y155-L187 HydrophobicContact CD1-CD1 4.08Å; Y155-L187 HydrophobicContact CD1-CD2 3.85Å; Y155-L187 HydrophobicContact CE1-CD1 3.92Å; Y155-L187 HydrophobicContact CE1-CD2 3.67Å; Y155-L187 HydrophobicContact CE1-CG 4.47Å; L163-L187 HydrophobicContact CD1-CD1 4.12Å; A182-L187 CarbonylContact C-O 3.49Å; A182-L187 WeakPolarHBondContact CA-O 3.37Å; A182-L187 VanDerWaalsContact CB-O 3.26Å; A182-L187 WeakPolarHBondContact CB-O 3.14Å; A182-L187 PolarHBondContact O-N 3.47Å; A182-L187 VanDerWaalsContact O-O 3.1Å; M185-L187 VanDerWaalsContact C-N 3.26Å; M185-L187 HydrophobicContact CB-CB 4.45Å; M185-L187 HydrophobicContact CB-CD1 4.15Å; M185-L187 HydrophobicContact CB-CG 4.07Å; M185-L187 PolarHBondContact O-N 3.28Å; L187-Q191 HydrophobicContact CB-CB 4.35Å; L187-V192 HydrophobicContact CB-CG2 4.19Å | ||
| 188 | S | 98.4 | Very high | 98.1 | Very high | 55 Ų | 55 | 63.3 Ų | 63.3 | 39% | 0.385 | 32% | 0.316 | S | S | . | . | trans | -70 | 150 | 169.1 | 64.7 | 0 | 0 | 0 | 0 | 111.1 | R190 Q191 V192 | S188-R190 PolarHBondContact O-N 3.15Å; S188-R190 VanDerWaalsContact O-N 3.09Å; S188-Q191 WeakPolarHBondContact O-CB 3.34Å; S188-Q191 PolarHBondContact O-N 3.38Å; S188-Q191 VanDerWaalsContact OG-CG 3.28Å; S188-Q191 WeakPolarHBondContact OG-CG 3.32Å; S188-Q191 PolarHBondContact OG-N 2.9Å; S188-Q191 PolarHBondContact OG-OE1 3.09Å; S188-V192 PolarHBondContact O-N 3.39Å; S188-V192 VanDerWaalsContact O-N 3.1Å | ||
| 189 | E | 98.4 | Very high | 98.1 | Very high | 57 Ų | 57 | 62.5 Ų | 62.5 | 27% | 0.266 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -53.1 | -34.9 | 173 | -68.8 | -166 | -140.3 | 0 | 0 | 113.2 | R175 R178 A182 V192 K193 | R175-E189 VanDerWaalsContact CZ-CD 3.49Å; R175-E189 IonicContact CZ-OE1 3.24Å; R175-E189 VanDerWaalsContact CZ-OE1 3.24Å; R175-E189 IonicContact CZ-OE2 2.95Å; R175-E189 IonicContact NE-OE2 3.74Å; R175-E189 IonicContact NH1-OE1 4Å; R175-E189 PolarHBondContact NH1-OE1 3.22Å; R175-E189 IonicContact NH1-OE2 2.68Å; R175-E189 PolarHBondContact NH1-OE2 3.36Å; R175-E189 VanDerWaalsContact NH2-CD 3.34Å; R175-E189 IonicContact NH2-OE1 2.87Å; R175-E189 PolarHBondContact NH2-OE1 3.35Å; R175-E189 IonicContact NH2-OE2 3.01Å; R175-E189 PolarHBondContact NH2-OE2 2.84Å; R175-E189 VanDerWaalsContact NH2-OE2 3.13Å; R178-E189 HydrophobicContact CG-CB 4.3Å; R178-E189 HydrophobicContact CG-CG 4.49Å; A182-E189 HydrophobicContact CB-CG 4.23Å; E189-V192 PolarHBondContact O-N 3.47Å; E189-K193 WeakPolarHBondContact O-CB 3.34Å; E189-K193 PolarHBondContact O-N 3.02Å |
| 190 | R | 97.9 | Very high | 98.1 | Very high | 181 Ų | 181 | 64.1 Ų | 64.1 | 68% | 0.683 | 31% | 0.314 | S | S | * | . | H | α-helix | trans | -64.4 | -43.1 | 177.3 | -176.2 | 177.6 | -176.8 | -85.1 | -1.7 | 111.1 | S188 K193 I194 | S188-R190 PolarHBondContact O-N 3.15Å; S188-R190 VanDerWaalsContact O-N 3.09Å; R190-K193 PolarHBondContact O-N 3.4Å; R190-I194 HydrophobicContact CG-CD1 3.88Å; R190-I194 WeakPolarHBondContact O-CB 3.33Å; R190-I194 VanDerWaalsContact O-CG1 3.28Å; R190-I194 WeakPolarHBondContact O-CG1 3.36Å; R190-I194 PolarHBondContact O-N 2.88Å |
| 191 | Q | 98.3 | Very high | 98.1 | Very high | 62 Ų | 62 | 66.1 Ų | 66.1 | 29% | 0.29 | 33% | 0.325 | S | S | . | . | H | α-helix | trans | -62.2 | -46.2 | 176 | -77.6 | 163.2 | -51.9 | 0 | 0 | 110.8 | L187 S188 K193 I194 W195 | L187-Q191 HydrophobicContact CB-CB 4.35Å; S188-Q191 WeakPolarHBondContact O-CB 3.34Å; S188-Q191 PolarHBondContact O-N 3.38Å; S188-Q191 VanDerWaalsContact OG-CG 3.28Å; S188-Q191 WeakPolarHBondContact OG-CG 3.32Å; S188-Q191 PolarHBondContact OG-N 2.9Å; S188-Q191 PolarHBondContact OG-OE1 3.09Å; Q191-K193 VanDerWaalsContact C-N 3.34Å; Q191-K193 PolarHBondContact O-N 3.02Å; Q191-I194 PolarHBondContact O-N 3.18Å; Q191-W195 WeakPolarHBondContact O-CB 2.79Å; Q191-W195 PolarHBondContact O-N 3.4Å |
| 192 | V | 98.3 | Very high | 98 | Very high | 0 Ų | 0 | 71.4 Ų | 71.4 | 0% | 0 | 35% | 0.348 | C | S | . | . | H | α-helix | trans | -59.8 | -44.8 | 175.7 | -178.8 | 0 | 0 | 0 | 0 | 110.8 | L163 L173 R178 I181 A182 L187 S188 E189 I194 W195 F196 | L163-V192 HydrophobicContact CD2-CG1 4.33Å; L173-V192 HydrophobicContact CD1-CG1 3.63Å; R178-V192 HydrophobicContact CG-CB 4.26Å; R178-V192 HydrophobicContact CG-CG1 4.14Å; I181-V192 HydrophobicContact CG2-CG1 4.1Å; I181-V192 HydrophobicContact CG2-CG2 4.29Å; A182-V192 HydrophobicContact CB-CG2 4.14Å; L187-V192 HydrophobicContact CB-CG2 4.19Å; S188-V192 PolarHBondContact O-N 3.39Å; S188-V192 VanDerWaalsContact O-N 3.1Å; E189-V192 PolarHBondContact O-N 3.47Å; V192-I194 PolarHBondContact O-N 3.26Å; V192-W195 PolarHBondContact O-N 2.75Å; V192-F196 HydrophobicContact CG1-CD2 4.06Å; V192-F196 HydrophobicContact CG1-CE2 4.23Å; V192-F196 WeakPolarHBondContact O-CD2 3.4Å; V192-F196 PolarHBondContact O-N 2.89Å |
| 193 | K | 98.3 | Very high | 97.9 | Very high | 111 Ų | 111 | 75 Ų | 75 | 48% | 0.483 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -58.7 | -48.8 | 176.4 | -175.9 | -172.7 | 179.4 | -177.8 | 0 | 112 | E189 R190 Q191 W195 F196 Q197 | E189-K193 WeakPolarHBondContact O-CB 3.34Å; E189-K193 PolarHBondContact O-N 3.02Å; R190-K193 PolarHBondContact O-N 3.4Å; Q191-K193 VanDerWaalsContact C-N 3.34Å; Q191-K193 PolarHBondContact O-N 3.02Å; K193-W195 VanDerWaalsContact C-N 3.35Å; K193-F196 PolarHBondContact O-N 3.25Å; K193-Q197 PolarHBondContact O-N 3.33Å |
| 194 | I | 98.4 | Very high | 97.7 | Very high | 54 Ų | 54 | 72.9 Ų | 72.9 | 28% | 0.277 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -64.3 | -42.5 | 179.7 | -70.9 | 169.4 | 0 | 0 | 0 | 110.3 | R190 Q191 V192 F196 Q197 N198 | R190-I194 HydrophobicContact CG-CD1 3.88Å; R190-I194 WeakPolarHBondContact O-CB 3.33Å; R190-I194 VanDerWaalsContact O-CG1 3.28Å; R190-I194 WeakPolarHBondContact O-CG1 3.36Å; R190-I194 PolarHBondContact O-N 2.88Å; Q191-I194 PolarHBondContact O-N 3.18Å; V192-I194 PolarHBondContact O-N 3.26Å; I194-F196 PolarHBondContact O-N 3.08Å; I194-Q197 PolarHBondContact O-N 3.09Å; I194-N198 PolarHBondContact O-N 3.18Å; I194-N198 PolarHBondContact O-ND2 3.29Å |
| 195 | W | 98.5 | Very high | 97.5 | Very high | 35 Ų | 35 | 75.8 Ų | 75.8 | 13% | 0.133 | 35% | 0.353 | C | S | . | . | H | α-helix | trans | -59.5 | -48.6 | 177.9 | -169.1 | 101.3 | 0 | 0 | 0 | 111.2 | Y155 L163 E164 F167 Q191 V192 K193 Q197 N198 R199 | Y155-W195 AromaticContact CD2-CD1 3.85Å; Y155-W195 AromaticContact CE2-CD1 3.55Å; L163-W195 VanDerWaalsContact C-CH2 3.47Å; L163-W195 HydrophobicContact CB-CD2 3.94Å; L163-W195 HydrophobicContact CB-CE3 3.94Å; L163-W195 HydrophobicContact CB-CH2 3.66Å; L163-W195 HydrophobicContact CB-CZ2 3.64Å; L163-W195 HydrophobicContact CB-CZ3 3.81Å; L163-W195 HydrophobicContact CD1-CD2 3.89Å; L163-W195 HydrophobicContact CD1-CG 3.84Å; L163-W195 HydrophobicContact CD2-CD2 4.48Å; L163-W195 HydrophobicContact CD2-CE3 4.4Å; L163-W195 HydrophobicContact CG-CD2 4.33Å; L163-W195 WeakPolarHBondContact O-CH2 3.48Å; L163-W195 WeakPolarHBondContact O-CZ3 3.4Å; E164-W195 HydrophobicContact CG-CH2 3.92Å; E164-W195 HydrophobicContact CG-CZ2 4.01Å; F167-W195 HydrophobicContact CB-CH2 4.39Å; F167-W195 HydrophobicContact CB-CZ3 4.08Å; Q191-W195 WeakPolarHBondContact O-CB 2.79Å; Q191-W195 PolarHBondContact O-N 3.4Å; V192-W195 PolarHBondContact O-N 2.75Å; K193-W195 VanDerWaalsContact C-N 3.35Å; W195-Q197 VanDerWaalsContact C-N 3.28Å; W195-Q197 PolarHBondContact O-N 3.16Å; W195-N198 PolarHBondContact O-N 3.38Å; W195-R199 HydrophobicContact CD2-CB 4.47Å; W195-R199 HydrophobicContact CE3-CB 3.88Å; W195-R199 HydrophobicContact CE3-CG 4.41Å; W195-R199 HydrophobicContact CH2-CB 4.03Å; W195-R199 HydrophobicContact CH2-CG 3.73Å; W195-R199 HydrophobicContact CZ3-CB 3.64Å; W195-R199 HydrophobicContact CZ3-CG 3.66Å; W195-R199 VanDerWaalsContact O-CB 3.3Å; W195-R199 WeakPolarHBondContact O-CB 3.46Å; W195-R199 PolarHBondContact O-N 3.31Å |
| 196 | F | 98.7 | Very high | 97.2 | Very high | 7 Ų | 7 | 79.7 Ų | 79.7 | 3% | 0.031 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -63.9 | -31.6 | 176.6 | -91.9 | -103.5 | 0 | 0 | 0 | 113 | L163 E166 F167 L173 V192 K193 I194 R200 | L163-F196 HydrophobicContact CD2-CE2 4.09Å; E166-F196 HydrophobicContact CB-CZ 4Å; F167-F196 HydrophobicContact CB-CE1 4.2Å; F167-F196 HydrophobicContact CB-CZ 4.32Å; F167-F196 AromaticContact CD2-CD1 4Å; F167-F196 HydrophobicContact CD2-CD1 4Å; F167-F196 AromaticContact CD2-CE1 3.95Å; F167-F196 HydrophobicContact CD2-CE1 3.95Å; L173-F196 HydrophobicContact CD1-CD1 4.09Å; L173-F196 HydrophobicContact CD1-CD2 3.59Å; L173-F196 HydrophobicContact CD1-CE1 3.94Å; L173-F196 HydrophobicContact CD1-CE2 3.46Å; L173-F196 VanDerWaalsContact CD1-CE2 3.46Å; L173-F196 HydrophobicContact CD1-CG 3.92Å; L173-F196 HydrophobicContact CD1-CZ 3.64Å; L173-F196 HydrophobicContact CD2-CD1 4.4Å; L173-F196 HydrophobicContact CD2-CE1 3.69Å; L173-F196 HydrophobicContact CD2-CE2 4.36Å; L173-F196 HydrophobicContact CD2-CZ 3.67Å; L173-F196 HydrophobicContact CG-CD1 3.74Å; L173-F196 HydrophobicContact CG-CD2 4.18Å; L173-F196 HydrophobicContact CG-CE1 3.51Å; L173-F196 HydrophobicContact CG-CE2 4.01Å; L173-F196 HydrophobicContact CG-CG 4.07Å; L173-F196 HydrophobicContact CG-CZ 3.67Å; V192-F196 HydrophobicContact CG1-CD2 4.06Å; V192-F196 HydrophobicContact CG1-CE2 4.23Å; V192-F196 WeakPolarHBondContact O-CD2 3.4Å; V192-F196 PolarHBondContact O-N 2.89Å; K193-F196 PolarHBondContact O-N 3.25Å; I194-F196 PolarHBondContact O-N 3.08Å; F196-R200 WeakPolarHBondContact O-CB 3.22Å; F196-R200 VanDerWaalsContact O-CG 3.28Å; F196-R200 WeakPolarHBondContact O-CG 3.26Å; F196-R200 PolarHBondContact O-N 3.37Å; F196-R200 PolarHBondContact O-NE 2.88Å |
| 197 | Q | 98.6 | Very high | 96.6 | Very high | 100 Ų | 100 | 80 Ų | 80 | 47% | 0.467 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -68.3 | -48 | 173.9 | -167.6 | 157.3 | 37.1 | 0 | 0 | 111.4 | K193 I194 W195 R199 R200 M201 | K193-Q197 PolarHBondContact O-N 3.33Å; I194-Q197 PolarHBondContact O-N 3.09Å; W195-Q197 VanDerWaalsContact C-N 3.28Å; W195-Q197 PolarHBondContact O-N 3.16Å; Q197-R199 VanDerWaalsContact C-N 3.34Å; Q197-R199 PolarHBondContact O-N 3.27Å; Q197-R200 PolarHBondContact O-N 3.46Å; Q197-M201 WeakPolarHBondContact O-CG 3.45Å; Q197-M201 PolarHBondContact O-N 3.21Å |
| 198 | N | 98.2 | Very high | 95.1 | Very high | 103 Ų | 103 | 85.3 Ų | 85.3 | 55% | 0.551 | 39% | 0.386 | S | S | * | . | H | α-helix | trans | -61.5 | -42.8 | 175.5 | -68.6 | -19.5 | 0 | 0 | 0 | 111.5 | I194 W195 R200 M201 K202 | I194-N198 PolarHBondContact O-N 3.18Å; I194-N198 PolarHBondContact O-ND2 3.29Å; W195-N198 PolarHBondContact O-N 3.38Å; N198-R200 PolarHBondContact O-N 3.45Å; N198-M201 PolarHBondContact O-N 2.87Å; N198-K202 PolarHBondContact O-N 3.42Å |
| 199 | R | 98.3 | Very high | 93.3 | Very high | 38 Ų | 38 | 90 Ų | 90 | 14% | 0.143 | 41% | 0.406 | C | S | . | . | H | α-helix | trans | -63.6 | -42.2 | 179.9 | -175.3 | 64.9 | -171.5 | 105.6 | -7.8 | 111.9 | F167 W195 Q197 K202 W203 | F167-R199 HydrophobicContact CB-CG 4.32Å; F167-R199 HydrophobicContact CD1-CG 3.69Å; F167-R199 HydrophobicContact CD2-CB 4.18Å; F167-R199 HydrophobicContact CD2-CG 3.53Å; F167-R199 HydrophobicContact CE1-CG 3.8Å; F167-R199 HydrophobicContact CE2-CB 4.21Å; F167-R199 HydrophobicContact CE2-CG 3.66Å; F167-R199 HydrophobicContact CG-CG 3.55Å; F167-R199 HydrophobicContact CZ-CG 3.78Å; W195-R199 HydrophobicContact CD2-CB 4.47Å; W195-R199 HydrophobicContact CE3-CB 3.88Å; W195-R199 HydrophobicContact CE3-CG 4.41Å; W195-R199 HydrophobicContact CH2-CB 4.03Å; W195-R199 HydrophobicContact CH2-CG 3.73Å; W195-R199 HydrophobicContact CZ3-CB 3.64Å; W195-R199 HydrophobicContact CZ3-CG 3.66Å; W195-R199 VanDerWaalsContact O-CB 3.3Å; W195-R199 WeakPolarHBondContact O-CB 3.46Å; W195-R199 PolarHBondContact O-N 3.31Å; Q197-R199 VanDerWaalsContact C-N 3.34Å; Q197-R199 PolarHBondContact O-N 3.27Å; R199-K202 PolarHBondContact O-N 3.35Å; R199-W203 WeakPolarHBondContact O-CB 3.26Å; R199-W203 PolarHBondContact O-N 3.23Å |
| 200 | R | 97.8 | Very high | 91 | Very high | 74 Ų | 74 | 92.3 Ų | 92.3 | 28% | 0.279 | 43% | 0.426 | S | S | . | . | H | α-helix | trans | -63.1 | -40.1 | 172.7 | -75.8 | -178.8 | -67.2 | 164.3 | 3.5 | 112.2 | F167 R171 F196 Q197 N198 W203 K204 | F167-R200 HydrophobicContact CE2-CG 3.74Å; F167-R200 HydrophobicContact CZ-CG 4.31Å; R171-R200 WeakPolarHBondContact O-CD 3.42Å; F196-R200 WeakPolarHBondContact O-CB 3.22Å; F196-R200 VanDerWaalsContact O-CG 3.28Å; F196-R200 WeakPolarHBondContact O-CG 3.26Å; F196-R200 PolarHBondContact O-N 3.37Å; F196-R200 PolarHBondContact O-NE 2.88Å; Q197-R200 PolarHBondContact O-N 3.46Å; N198-R200 PolarHBondContact O-N 3.45Å; R200-W203 PolarHBondContact O-N 3.29Å; R200-K204 WeakPolarHBondContact O-CB 3.27Å; R200-K204 PolarHBondContact O-N 2.9Å |
| 201 | M | 97.7 | Very high | 88.4 | Confident | 109 Ų | 109 | 90.1 Ų | 90.1 | 54% | 0.537 | 43% | 0.428 | S | S | . | . | H | α-helix | trans | -64 | -42.1 | 176.2 | -68.3 | -63.3 | -102.7 | 0 | 0 | 111.9 | Q197 N198 K204 K205 | Q197-M201 WeakPolarHBondContact O-CG 3.45Å; Q197-M201 PolarHBondContact O-N 3.21Å; N198-M201 PolarHBondContact O-N 2.87Å; M201-K204 PolarHBondContact O-N 2.84Å; M201-K204 PolarHBondContact SD-NZ 3.15Å; M201-K205 PolarHBondContact O-N 3.46Å |
| 202 | K | 96.4 | Very high | 86.1 | Confident | 119 Ų | 119 | 93.4 Ų | 93.4 | 52% | 0.517 | 45% | 0.452 | S | S | . | . | H | α-helix | trans | -63.3 | -51.4 | 173.6 | -179.7 | 177 | 177.6 | -171.6 | 0 | 111.6 | N198 R199 K204 K205 D206 | N198-K202 PolarHBondContact O-N 3.42Å; R199-K202 PolarHBondContact O-N 3.35Å; K202-K204 VanDerWaalsContact C-N 3.25Å; K202-K204 PolarHBondContact O-N 3.35Å; K202-K205 WeakPolarHBondContact O-CA 3.39Å; K202-K205 WeakPolarHBondContact O-CB 2.94Å; K202-K205 PolarHBondContact O-N 2.84Å; K202-D206 WeakPolarHBondContact CE-OD2 3.49Å; K202-D206 VanDerWaalsContact CG-OD2 3.26Å; K202-D206 WeakPolarHBondContact CG-OD2 3.32Å; K202-D206 PolarHBondContact O-N 3.48Å |
| 203 | W | 95.4 | Very high | 84 | Confident | 80 Ų | 80 | 101.1 Ų | 101.1 | 30% | 0.303 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -55.1 | -44.4 | 175.9 | -178.4 | 82.9 | 0 | 0 | 0 | 111.4 | F167 R199 R200 K205 D206 H207 | F167-W203 HydrophobicContact CE1-CB 4.12Å; F167-W203 HydrophobicContact CE1-CG 4.11Å; F167-W203 HydrophobicContact CZ-CB 3.86Å; F167-W203 HydrophobicContact CZ-CG 4.04Å; R199-W203 WeakPolarHBondContact O-CB 3.26Å; R199-W203 PolarHBondContact O-N 3.23Å; R200-W203 PolarHBondContact O-N 3.29Å; W203-K205 VanDerWaalsContact C-N 3.27Å; W203-K205 PolarHBondContact O-N 3.1Å; W203-D206 PolarHBondContact O-N 3.02Å; W203-H207 AromaticContact CD1-CD2 3.13Å; W203-H207 AromaticContact CD1-NE2 3.31Å; W203-H207 VanDerWaalsContact CD1-NE2 3.31Å; W203-H207 AromaticContact CD2-CD2 3.98Å; W203-H207 AromaticContact CE2-CD2 3.61Å; W203-H207 AromaticContact CE2-CG 3.86Å; W203-H207 AromaticContact CG-CD2 3.7Å; W203-H207 HydrophobicContact CZ2-CB 4.29Å; W203-H207 AromaticContact NE1-CD2 3.02Å; W203-H207 PolarHBondContact NE1-CD2 2.96Å; W203-H207 AromaticContact NE1-CE1 3.81Å; W203-H207 AromaticContact NE1-CG 3.64Å; W203-H207 AromaticContact NE1-NE2 3.11Å; W203-H207 PolarHBondContact NE1-NE2 3.09Å; W203-H207 VanDerWaalsContact NE1-NE2 3.11Å; W203-H207 WeakPolarHBondContact O-CB 3.29Å; W203-H207 PolarHBondContact O-CD2 2.83Å; W203-H207 VanDerWaalsContact O-CD2 3.29Å; W203-H207 PolarHBondContact O-N 2.74Å |
| 204 | K | 94.4 | Very high | 81.9 | Confident | 94 Ų | 94 | 102.5 Ų | 102.5 | 41% | 0.409 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -60.6 | -35.2 | 175.8 | -175.6 | -173.8 | 73.6 | 177.5 | 0 | 111.7 | R200 M201 K202 K208 | R200-K204 WeakPolarHBondContact O-CB 3.27Å; R200-K204 PolarHBondContact O-N 2.9Å; M201-K204 PolarHBondContact O-N 2.84Å; M201-K204 PolarHBondContact SD-NZ 3.15Å; K202-K204 VanDerWaalsContact C-N 3.25Å; K202-K204 PolarHBondContact O-N 3.35Å; K204-K208 VanDerWaalsContact CG-NZ 3.27Å; K204-K208 WeakPolarHBondContact O-CE 3.47Å; K204-K208 WeakPolarHBondContact O-CG 3.47Å |
| 205 | K | 93.7 | Very high | 79.5 | Confident | 169 Ų | 169 | 110.7 Ų | 110.7 | 74% | 0.735 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -74 | -44.2 | 177.1 | -175.8 | -178.1 | 176.9 | -178.6 | 0 | 111.4 | M201 K202 W203 | M201-K205 PolarHBondContact O-N 3.46Å; K202-K205 WeakPolarHBondContact O-CA 3.39Å; K202-K205 WeakPolarHBondContact O-CB 2.94Å; K202-K205 PolarHBondContact O-N 2.84Å; W203-K205 VanDerWaalsContact C-N 3.27Å; W203-K205 PolarHBondContact O-N 3.1Å |
| 206 | D | 90.3 | Very high | 77.2 | Confident | 92 Ų | 92 | 115.5 Ų | 115.5 | 49% | 0.492 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -73.2 | -29.7 | -175.2 | -57.2 | -15 | 0 | 0 | 0 | 112.2 | K202 W203 | K202-D206 WeakPolarHBondContact CE-OD2 3.49Å; K202-D206 VanDerWaalsContact CG-OD2 3.26Å; K202-D206 WeakPolarHBondContact CG-OD2 3.32Å; K202-D206 PolarHBondContact O-N 3.48Å; W203-D206 PolarHBondContact O-N 3.02Å |
| 207 | H | 84.9 | Confident | 75.2 | Confident | 120 Ų | 120 | 119.2 Ų | 119.2 | 56% | 0.556 | 60% | 0.595 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -103.9 | 16.6 | -179.1 | -67.9 | -89.9 | 0 | 0 | 0 | 114.3 | W203 L209 | W203-H207 AromaticContact CD1-CD2 3.13Å; W203-H207 AromaticContact CD1-NE2 3.31Å; W203-H207 VanDerWaalsContact CD1-NE2 3.31Å; W203-H207 AromaticContact CD2-CD2 3.98Å; W203-H207 AromaticContact CE2-CD2 3.61Å; W203-H207 AromaticContact CE2-CG 3.86Å; W203-H207 AromaticContact CG-CD2 3.7Å; W203-H207 HydrophobicContact CZ2-CB 4.29Å; W203-H207 AromaticContact NE1-CD2 3.02Å; W203-H207 PolarHBondContact NE1-CD2 2.96Å; W203-H207 AromaticContact NE1-CE1 3.81Å; W203-H207 AromaticContact NE1-CG 3.64Å; W203-H207 AromaticContact NE1-NE2 3.11Å; W203-H207 PolarHBondContact NE1-NE2 3.09Å; W203-H207 VanDerWaalsContact NE1-NE2 3.11Å; W203-H207 WeakPolarHBondContact O-CB 3.29Å; W203-H207 PolarHBondContact O-CD2 2.83Å; W203-H207 VanDerWaalsContact O-CD2 3.29Å; W203-H207 PolarHBondContact O-N 2.74Å; H207-L209 PolarHBondContact O-N 3.02Å |
| 208 | K | 65.6 | Low | 72.7 | Confident | 132 Ų | 132 | 120.1 Ų | 120.1 | 57% | 0.574 | 61% | 0.613 | S | S | * | * | S | Bend | trans | -80.8 | 118.6 | 160.2 | -44.8 | -157.8 | 165.8 | -69.8 | 0 | 106.9 | K204 | K204-K208 VanDerWaalsContact CG-NZ 3.27Å; K204-K208 WeakPolarHBondContact O-CE 3.47Å; K204-K208 WeakPolarHBondContact O-CG 3.47Å |
| 209 | L | 61.7 | Low | 70.3 | Confident | 152 Ų | 152 | 121.4 Ų | 121.4 | 80% | 0.796 | 63% | 0.63 | S | S | * | * | trans | -32.4 | 151.2 | 160.2 | -71.6 | 124.9 | 0 | 0 | 0 | 112.2 | H207 N211 | H207-L209 PolarHBondContact O-N 3.02Å; L209-N211 PolarHBondContact O-N 3.32Å; L209-N211 VanDerWaalsContact O-N 3.15Å | ||
| 210 | P | 50 | Low | 67.8 | Low | 106 Ų | 106 | 124.6 Ų | 124.6 | 69% | 0.688 | 66% | 0.658 | S | S | * | * | trans | -44.2 | 127.4 | -177.6 | 20.3 | -34.2 | 0 | 0 | 0 | 109.5 | T212 | P210-T212 VanDerWaalsContact C-N 3.31Å; P210-T212 WeakPolarHBondContact O-CG2 3.09Å; P210-T212 PolarHBondContact O-N 3.16Å | ||
| 211 | N | 42.3 | Very low | 65 | Low | 135 Ų | 135 | 126.9 Ų | 126.9 | 72% | 0.722 | 69% | 0.685 | S | S | * | * | trans | -49.3 | 107.9 | 158.9 | 179.6 | 23.4 | 0 | 0 | 0 | 106 | L209 K213 | L209-N211 PolarHBondContact O-N 3.32Å; L209-N211 VanDerWaalsContact O-N 3.15Å; N211-K213 PolarHBondContact O-N 3.38Å | ||
| 212 | T | 51.3 | Low | 62 | Low | 132 Ų | 132 | 125.5 Ų | 125.5 | 81% | 0.81 | 70% | 0.699 | S | S | * | * | S | Bend | trans | -73.4 | 62.5 | 177.8 | 63.5 | 0 | 0 | 0 | 0 | 108.3 | P210 | P210-T212 VanDerWaalsContact C-N 3.31Å; P210-T212 WeakPolarHBondContact O-CG2 3.09Å; P210-T212 PolarHBondContact O-N 3.16Å |
| 213 | K | 54 | Low | 59.2 | Low | 162 Ų | 162 | 124.7 Ų | 124.7 | 70% | 0.704 | 72% | 0.715 | S | S | * | * | S | Bend | trans | -167 | 120.2 | 163 | -134.5 | 170.4 | 178.6 | -179.7 | 0 | 106.9 | N211 | N211-K213 PolarHBondContact O-N 3.38Š|
| 214 | I | 53.8 | Low | 56.6 | Low | 139 Ų | 139 | 130.1 Ų | 130.1 | 71% | 0.713 | 74% | 0.743 | S | S | * | * | S | Bend | trans | 90.4 | 70.1 | 167.1 | -40.6 | 151.5 | 0 | 0 | 0 | 115.2 | ||
| 215 | R | 48.6 | Very low | 54 | Low | 227 Ų | 227 | 134.2 Ų | 134.2 | 86% | 0.857 | 76% | 0.764 | S | S | * | * | 152 | 72.2 | 123.6 | -88.1 | 179.2 | -105.1 | -135.8 | -2.3 | 111.6 | A217 | R215-A217 VanDerWaalsContact C-N 3.34Å; R215-A217 PolarHBondContact O-N 3.44Å | |||
| 216 | S | 50 | Low | 51.3 | Low | 136 Ų | 136 | 134.2 Ų | 134.2 | 95% | 0.951 | 77% | 0.766 | S | S | * | * | trans | -83.3 | 85.2 | 148 | -51.3 | 0 | 0 | 0 | 0 | 107.1 | ||||
| 217 | A | 55.1 | Low | 49 | Very low | 84 Ų | 84 | 137.7 Ų | 137.7 | 69% | 0.694 | 78% | 0.78 | S | S | * | * | trans | -163.5 | 68.2 | 169.3 | 0 | 0 | 0 | 0 | 0 | 110.9 | R215 | R215-A217 VanDerWaalsContact C-N 3.34Å; R215-A217 PolarHBondContact O-N 3.44Å | ||
| 218 | S | 46.8 | Very low | 47 | Very low | 120 Ų | 120 | 138.7 Ų | 138.7 | 84% | 0.839 | 79% | 0.785 | S | S | * | * | S | Bend | trans | 172.6 | 71.1 | 144.7 | 53.2 | 0 | 0 | 0 | 0 | 111.3 | ||
| 219 | S | 48.8 | Very low | 46.1 | Very low | 129 Ų | 129 | 139.9 Ų | 139.9 | 90% | 0.902 | 80% | 0.796 | S | S | * | * | trans | -154.2 | 72.4 | 152.2 | 38.1 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 220 | S | 44.5 | Very low | 45.1 | Very low | 106 Ų | 106 | 140.8 Ų | 140.8 | 74% | 0.741 | 79% | 0.793 | S | S | * | * | trans | -122.8 | 122.4 | 153.1 | 57.4 | 0 | 0 | 0 | 0 | 103.9 | ||||
| 221 | S | 39.4 | Very low | 44.7 | Very low | 122 Ų | 122 | 142.4 Ų | 142.4 | 85% | 0.853 | 80% | 0.801 | S | S | * | * | cis | -170.4 | 155.8 | 40.1 | -55.1 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 222 | G | 34.4 | Very low | 44.5 | Very low | 80 Ų | 80 | 139.2 Ų | 139.2 | 83% | 0.825 | 80% | 0.8 | S | S | * | * | trans | 125 | 123.6 | 154.6 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 223 | A | 39.2 | Very low | 44.1 | Very low | 102 Ų | 102 | 139.8 Ų | 139.8 | 84% | 0.843 | 80% | 0.804 | S | S | * | * | cis | -159.5 | 147.1 | -2.8 | 0 | 0 | 0 | 0 | 0 | 106.8 | ||||
| 224 | Q | 40.9 | Very low | 43.6 | Very low | 194 Ų | 194 | 139.9 Ų | 139.9 | 91% | 0.907 | 81% | 0.806 | S | S | * | * | trans | -66.3 | 132.9 | 168.5 | -65.5 | 176.2 | -41.4 | 0 | 0 | 109.9 | ||||
| 225 | Q | 38.1 | Very low | 42.9 | Very low | 180 Ų | 180 | 141.5 Ų | 141.5 | 84% | 0.841 | 81% | 0.811 | S | S | * | * | trans | -141.6 | 112.2 | 144.9 | -147.2 | 169.4 | 54.3 | 0 | 0 | 110.3 | ||||
| 226 | Q | 38.3 | Very low | 42.9 | Very low | 168 Ų | 168 | 138.9 Ų | 138.9 | 79% | 0.785 | 81% | 0.808 | S | S | * | * | trans | -91.5 | 121.9 | 172.8 | -169.6 | 169.9 | 59.7 | 0 | 0 | 106.3 | ||||
| 227 | Q | 41.6 | Very low | 42.7 | Very low | 165 Ų | 165 | 140.1 Ų | 140.1 | 77% | 0.771 | 80% | 0.803 | S | S | * | * | trans | -126 | 110.2 | 157.1 | -80.1 | -172.8 | 18.8 | 0 | 0 | 108.7 | ||||
| 228 | Q | 41.6 | Very low | 42.7 | Very low | 141 Ų | 141 | 142 Ų | 142 | 66% | 0.659 | 81% | 0.806 | S | S | * | * | trans | -68.9 | 132.1 | 161.6 | -68.7 | 175 | 15.9 | 0 | 0 | 108.3 | ||||
| 229 | I | 47.3 | Very low | 43 | Very low | 157 Ų | 157 | 142.1 Ų | 142.1 | 81% | 0.805 | 80% | 0.804 | S | S | * | * | trans | -125.8 | 114.5 | 145 | -58.4 | -178.3 | 0 | 0 | 0 | 106.8 | ||||
| 230 | K | 41.8 | Very low | 43.5 | Very low | 172 Ų | 172 | 142.4 Ų | 142.4 | 75% | 0.748 | 80% | 0.8 | S | S | * | * | trans | -77.8 | 132.2 | 168.4 | -69.3 | 172.7 | 176 | 176.5 | 0 | 108.7 | ||||
| 231 | T | 40.7 | Very low | 44.3 | Very low | 140 Ų | 140 | 142.7 Ų | 142.7 | 86% | 0.859 | 80% | 0.8 | S | S | * | * | trans | -174.9 | 123.9 | 136.5 | 43.3 | 0 | 0 | 0 | 0 | 103.7 | ||||
| 232 | G | 39.3 | Very low | 44.7 | Very low | 67 Ų | 67 | 143.5 Ų | 143.5 | 69% | 0.691 | 80% | 0.804 | S | S | * | * | cis | 100 | 79.3 | 29.1 | 0 | 0 | 0 | 0 | 0 | 109 | ||||
| 233 | T | 42.6 | Very low | 45.4 | Very low | 145 Ų | 145 | 144.3 Ų | 144.3 | 89% | 0.89 | 80% | 0.803 | S | S | * | * | trans | -176.9 | 112.5 | 138.7 | 38.1 | 0 | 0 | 0 | 0 | 112 | ||||
| 234 | H | 42.8 | Very low | 45.8 | Very low | 163 Ų | 163 | 143.9 Ų | 143.9 | 76% | 0.755 | 80% | 0.799 | S | S | * | * | trans | -25.9 | 130.7 | 146.4 | -170.9 | -105.9 | 0 | 0 | 0 | 115.1 | ||||
| 235 | Q | 39.8 | Very low | 46.2 | Very low | 174 Ų | 174 | 141.5 Ų | 141.5 | 81% | 0.813 | 80% | 0.798 | S | S | * | * | -174.6 | 136 | 116.8 | -98.2 | -177.7 | 94.4 | 0 | 0 | 113.1 | |||||
| 236 | Q | 47.4 | Very low | 46.8 | Very low | 172 Ų | 172 | 144.3 Ų | 144.3 | 80% | 0.804 | 82% | 0.818 | S | S | * | * | trans | -93.6 | 123.4 | 179.6 | 170.8 | 179 | 26.5 | 0 | 0 | 108.8 | ||||
| 237 | L | 46.8 | Very low | 47.2 | Very low | 162 Ų | 162 | 143.2 Ų | 143.2 | 85% | 0.848 | 82% | 0.819 | S | S | * | * | trans | -142.1 | 127.4 | 160.1 | -78 | 173.8 | 0 | 0 | 0 | 110.9 | ||||
| 238 | V | 54.1 | Low | 47.5 | Very low | 124 Ų | 124 | 142 Ų | 142 | 75% | 0.752 | 82% | 0.822 | S | S | * | * | trans | -35.3 | 159.5 | 177.5 | -80.2 | 0 | 0 | 0 | 0 | 119.5 | ||||
| 239 | P | 54.3 | Low | 47.8 | Very low | 121 Ų | 121 | 142.1 Ų | 142.1 | 79% | 0.786 | 83% | 0.831 | S | S | * | * | P | Polyproline II helix | trans | -81.7 | 136.6 | 177.5 | 32.7 | -32.4 | 0 | 0 | 0 | 113 | ||
| 240 | T | 59.3 | Low | 47.9 | Very low | 136 Ų | 136 | 141.2 Ų | 141.2 | 83% | 0.834 | 83% | 0.832 | S | S | * | * | P | Polyproline II helix | trans | -88.3 | 133.1 | 171.1 | -47.6 | 0 | 0 | 0 | 0 | 110.5 | ||
| 241 | P | 59.8 | Low | 48.2 | Very low | 112 Ų | 112 | 139.3 Ų | 139.3 | 73% | 0.727 | 84% | 0.838 | S | S | * | * | P | Polyproline II helix | trans | -80.3 | 150.1 | 179.3 | 32 | -33.4 | 0 | 0 | 0 | 112.8 | ||
| 242 | C | 47.7 | Very low | 48.7 | Very low | 139 Ų | 139 | 139.2 Ų | 139.2 | 94% | 0.939 | 84% | 0.836 | S | S | * | * | P | Polyproline II helix | trans | -68 | 126.9 | 169.8 | -160 | 0 | 0 | 0 | 0 | 109.7 | ||
| 243 | A | 49.8 | Very low | 49.4 | Very low | 97 Ų | 97 | 144.4 Ų | 144.4 | 80% | 0.802 | 85% | 0.847 | S | S | * | * | trans | -129.8 | 130.6 | 167.2 | 0 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 244 | A | 48.3 | Very low | 49.9 | Very low | 93 Ų | 93 | 144.3 Ų | 144.3 | 77% | 0.769 | 84% | 0.843 | S | S | * | * | trans | -65.7 | 156.5 | 178 | 0 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 245 | T | 48.3 | Very low | 50.5 | Low | 144 Ų | 144 | 142.8 Ų | 142.8 | 88% | 0.883 | 85% | 0.851 | S | S | * | * | trans | -153.9 | 138.7 | 142 | -63 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 246 | L | 50.9 | Low | 51.5 | Low | 239 Ų | 239 | 139.9 Ų | 139.9 | 100% | 1.251 | 85% | 0.854 | S | S | * | * | trans | -69.3 | 0 | 170 | -77.8 | 161.5 | 0 | 0 | 0 | 111.7 |
Retrieved 246 of 246 residues in 46.6 ms
(Link to these results)