| 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 | S | 39.8 | Very low | 45.4 | Very low | 168 Ų | 168 | 145.6 Ų | 145.6 | 100% | 1.175 | 81% | 0.81 | S | S | * | * | 0 | 146.4 | 0 | -56.6 | 0 | 0 | 0 | 0 | 110.5 | |||||
| 2 | V | 42.8 | Very low | 45.3 | Very low | 143 Ų | 143 | 152.5 Ų | 152.5 | 87% | 0.867 | 82% | 0.815 | S | S | * | * | trans | 63.7 | 128 | 151.6 | 176.3 | 0 | 0 | 0 | 0 | 118.1 | ||||
| 3 | M | 43.9 | Very low | 45.4 | Very low | 136 Ų | 136 | 150.3 Ų | 150.3 | 67% | 0.67 | 81% | 0.814 | S | S | * | * | trans | -78.2 | 179.3 | 168.8 | -56.9 | -176 | 77 | 0 | 0 | 111.4 | Q5 | M3-Q5 HydrophobicContact CE-CG 3.92Å; M3-Q5 HydrophobicContact SD-CG 3.95Å | ||
| 4 | P | 56.5 | Low | 45.7 | Very low | 127 Ų | 127 | 145.1 Ų | 145.1 | 83% | 0.825 | 81% | 0.813 | S | S | * | * | -123.9 | 137.6 | 116.9 | 34.2 | -31.7 | 0 | 0 | 0 | 113.1 | |||||
| 5 | Q | 43.9 | Very low | 45.3 | Very low | 146 Ų | 146 | 140.7 Ų | 140.7 | 68% | 0.682 | 81% | 0.813 | S | S | * | * | trans | -85.8 | 137.7 | 166.6 | -66.7 | -173.6 | -1.6 | 0 | 0 | 109.9 | M3 S7 | M3-Q5 HydrophobicContact CE-CG 3.92Å; M3-Q5 HydrophobicContact SD-CG 3.95Å; Q5-S7 PolarHBondContact O-N 3.2Å | ||
| 6 | S | 44.1 | Very low | 45.3 | Very low | 112 Ų | 112 | 143.8 Ų | 143.8 | 78% | 0.783 | 82% | 0.818 | S | S | * | * | trans | -92.2 | 81.4 | 176.8 | -164.1 | 0 | 0 | 0 | 0 | 111.1 | K8 | S6-K8 PolarHBondContact O-N 3.43Š| ||
| 7 | S | 44.8 | Very low | 45.7 | Very low | 101 Ų | 101 | 140.2 Ų | 140.2 | 71% | 0.706 | 82% | 0.819 | S | S | * | * | trans | -73.1 | 93 | 178.6 | -63.1 | 0 | 0 | 0 | 0 | 111.7 | Q5 N9 | Q5-S7 PolarHBondContact O-N 3.2Å; S7-N9 PolarHBondContact O-N 3.29Å | ||
| 8 | K | 49.5 | Very low | 45.9 | Very low | 193 Ų | 193 | 138.6 Ų | 138.6 | 84% | 0.839 | 81% | 0.812 | S | S | * | * | trans | -73.6 | 92.8 | 171.1 | -74.5 | -172.4 | 176.8 | -179.7 | 0 | 110.8 | S6 M10 | S6-K8 PolarHBondContact O-N 3.43Å; K8-M10 PolarHBondContact O-N 3Å | ||
| 9 | N | 43.8 | Very low | 46 | Very low | 147 Ų | 147 | 136.2 Ų | 136.2 | 79% | 0.786 | 81% | 0.81 | S | S | * | * | trans | -65 | 121.2 | 175.1 | -163.2 | 13.6 | 0 | 0 | 0 | 110.2 | S7 | S7-N9 PolarHBondContact O-N 3.29Š| ||
| 10 | M | 46.3 | Very low | 46 | Very low | 172 Ų | 172 | 138.5 Ų | 138.5 | 85% | 0.847 | 81% | 0.809 | S | S | * | * | trans | -125.5 | 89.7 | -177.9 | -156.8 | 172.9 | 82.5 | 0 | 0 | 110.9 | K8 R12 | K8-M10 PolarHBondContact O-N 3Å; M10-R12 PolarHBondContact O-N 3.32Å | ||
| 11 | Q | 44.5 | Very low | 46 | Very low | 157 Ų | 157 | 136.5 Ų | 136.5 | 73% | 0.734 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -59.6 | 124.7 | -178 | -160.4 | 73.9 | 17.5 | 0 | 0 | 111.1 | ||
| 12 | R | 44.1 | Very low | 46.6 | Very low | 228 Ų | 228 | 135.5 Ų | 135.5 | 86% | 0.86 | 78% | 0.783 | S | S | * | * | P | Polyproline II helix | trans | -86.6 | 121.6 | 167.2 | -69.4 | -172.6 | 179.5 | -142.3 | 1.8 | 109.6 | M10 | M10-R12 PolarHBondContact O-N 3.32Š|
| 13 | P | 46.3 | Very low | 46.9 | Very low | 124 Ų | 124 | 135.8 Ų | 135.8 | 81% | 0.805 | 78% | 0.779 | S | S | * | * | P | Polyproline II helix | trans | -70.8 | 135.2 | 167 | 29.5 | -32.6 | 0 | 0 | 0 | 109.9 | G15 | P13-G15 PolarHBondContact O-N 3.19Š|
| 14 | G | 49.3 | Very low | 47.2 | Very low | 78 Ų | 78 | 134.9 Ų | 134.9 | 80% | 0.804 | 79% | 0.787 | S | S | * | * | trans | -81.6 | 106.2 | 178.9 | 0 | 0 | 0 | 0 | 0 | 112 | Q16 | G14-Q16 PolarHBondContact O-N 3.09Š| ||
| 15 | G | 40.5 | Very low | 46.9 | Very low | 79 Ų | 79 | 136.5 Ų | 136.5 | 81% | 0.814 | 79% | 0.787 | S | S | * | * | trans | -78.9 | 113.9 | 167.9 | 0 | 0 | 0 | 0 | 0 | 110.9 | P13 | P13-G15 PolarHBondContact O-N 3.19Š| ||
| 16 | Q | 44.6 | Very low | 47.1 | Very low | 190 Ų | 190 | 136.5 Ų | 136.5 | 89% | 0.888 | 79% | 0.791 | S | S | * | * | trans | -72 | 133.5 | 172.7 | -63.4 | -176.4 | 7.1 | 0 | 0 | 110 | G14 T18 | G14-Q16 PolarHBondContact O-N 3.09Å; Q16-T18 PolarHBondContact O-N 3.39Å | ||
| 17 | G | 51.5 | Low | 47.2 | Very low | 82 Ų | 82 | 134.3 Ų | 134.3 | 85% | 0.845 | 79% | 0.786 | S | S | * | * | trans | -81 | 99.1 | -177.3 | 0 | 0 | 0 | 0 | 0 | 112.8 | A19 | G17-A19 PolarHBondContact O-N 3.4Š| ||
| 18 | T | 49.2 | Very low | 47.9 | Very low | 111 Ų | 111 | 135.9 Ų | 135.9 | 68% | 0.681 | 79% | 0.792 | S | S | * | * | trans | -80.4 | 100.7 | 167.2 | 43.8 | 0 | 0 | 0 | 0 | 110.3 | Q16 F20 | Q16-T18 PolarHBondContact O-N 3.39Å; T18-F20 WeakPolarHBondContact O-CD2 3.44Å; T18-F20 PolarHBondContact O-N 3.2Å; T18-F20 VanDerWaalsContact O-N 3.11Å | ||
| 19 | A | 48.2 | Very low | 48 | Very low | 93 Ų | 93 | 132.6 Ų | 132.6 | 77% | 0.769 | 79% | 0.79 | S | S | * | * | trans | -72.6 | 100.9 | 174.9 | 0 | 0 | 0 | 0 | 0 | 110.5 | G17 S21 | G17-A19 PolarHBondContact O-N 3.4Å; A19-S21 PolarHBondContact O-N 3.13Å | ||
| 20 | F | 46.5 | Very low | 48.4 | Very low | 182 Ų | 182 | 133.5 Ų | 133.5 | 80% | 0.798 | 79% | 0.79 | S | S | * | * | trans | -72.5 | 93.8 | 172 | -78 | -88.4 | 0 | 0 | 0 | 110.6 | T18 I22 | T18-F20 WeakPolarHBondContact O-CD2 3.44Å; T18-F20 PolarHBondContact O-N 3.2Å; T18-F20 VanDerWaalsContact O-N 3.11Å; F20-I22 PolarHBondContact O-N 3.33Å | ||
| 21 | S | 45.3 | Very low | 48.6 | Very low | 98 Ų | 98 | 130.9 Ų | 130.9 | 69% | 0.685 | 79% | 0.785 | S | S | * | * | trans | -62.5 | 125.1 | 169.8 | -66.8 | 0 | 0 | 0 | 0 | 110.8 | A19 D23 | A19-S21 PolarHBondContact O-N 3.13Å; S21-D23 VanDerWaalsContact C-N 3.27Å; S21-D23 PolarHBondContact O-N 2.79Å | ||
| 22 | I | 52.5 | Low | 48.4 | Very low | 146 Ų | 146 | 134.7 Ų | 134.7 | 75% | 0.749 | 79% | 0.793 | S | S | * | * | G | 310 helix | trans | -78.6 | -14.2 | -175.6 | -38.1 | -179.5 | 0 | 0 | 0 | 111.8 | F20 S24 L25 | F20-I22 PolarHBondContact O-N 3.33Å; I22-S24 PolarHBondContact O-N 2.98Å; I22-S24 VanDerWaalsContact O-N 3.15Å; I22-L25 PolarHBondContact O-N 3.22Å |
| 23 | D | 48.7 | Very low | 48.8 | Very low | 149 Ų | 149 | 130.1 Ų | 130.1 | 80% | 0.797 | 79% | 0.793 | S | S | * | * | G | 310 helix | trans | -61.8 | -21.4 | -174.2 | -104.9 | -121.6 | 0 | 0 | 0 | 115.2 | S21 L25 | S21-D23 VanDerWaalsContact C-N 3.27Å; S21-D23 PolarHBondContact O-N 2.79Å; D23-L25 VanDerWaalsContact C-N 3.26Å; D23-L25 PolarHBondContact O-N 3.34Å |
| 24 | S | 50.6 | Low | 49.2 | Very low | 117 Ų | 117 | 127.5 Ų | 127.5 | 82% | 0.818 | 79% | 0.788 | S | S | * | * | G | 310 helix | trans | -78.9 | -1 | -179.4 | -55.4 | 0 | 0 | 0 | 0 | 114.7 | I22 | I22-S24 PolarHBondContact O-N 2.98Å; I22-S24 VanDerWaalsContact O-N 3.15Å |
| 25 | L | 51.6 | Low | 49 | Very low | 161 Ų | 161 | 132.4 Ų | 132.4 | 84% | 0.843 | 79% | 0.79 | S | S | * | * | G | 310 helix | trans | -102.8 | -2.1 | -177.1 | -142.6 | 78.6 | 0 | 0 | 0 | 114.7 | I22 D23 | I22-L25 PolarHBondContact O-N 3.22Å; D23-L25 VanDerWaalsContact C-N 3.26Å; D23-L25 PolarHBondContact O-N 3.34Å |
| 26 | I | 47.8 | Very low | 49.7 | Very low | 146 Ų | 146 | 137.1 Ų | 137.1 | 75% | 0.749 | 80% | 0.795 | S | S | * | * | S | Bend | trans | -109.6 | 87.4 | 178.7 | -55 | 180 | 0 | 0 | 0 | 108.8 | T28 | I26-T28 PolarHBondContact O-N 3.46Š|
| 27 | G | 46.3 | Very low | 49.9 | Very low | 67 Ų | 67 | 135.1 Ų | 135.1 | 69% | 0.691 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -58.8 | 134.1 | 175.1 | 0 | 0 | 0 | 0 | 0 | 111.7 | P29 | G27-P29 WeakPolarHBondContact O-CD 3.27Š|
| 28 | T | 58.8 | Low | 50 | Low | 134 Ų | 134 | 140.9 Ų | 140.9 | 82% | 0.822 | 79% | 0.787 | S | S | * | * | P | Polyproline II helix | trans | -64.9 | 120.1 | -179.7 | 37.8 | 0 | 0 | 0 | 0 | 111.1 | I26 Q30 | I26-T28 PolarHBondContact O-N 3.46Å; T28-Q30 PolarHBondContact O-N 2.96Å |
| 29 | P | 52.2 | Low | 50.1 | Low | 124 Ų | 124 | 141.3 Ų | 141.3 | 81% | 0.805 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -73.6 | 122.4 | -179.4 | 28.4 | -33.1 | 0 | 0 | 0 | 110.9 | G27 | G27-P29 WeakPolarHBondContact O-CD 3.27Š|
| 30 | Q | 51.5 | Low | 49.8 | Very low | 166 Ų | 166 | 138.6 Ų | 138.6 | 78% | 0.776 | 77% | 0.771 | S | S | * | * | P | Polyproline II helix | trans | -57.4 | 135.3 | 171.2 | -77.7 | -80 | 14.7 | 0 | 0 | 111.1 | T28 R32 | T28-Q30 PolarHBondContact O-N 2.96Å; Q30-R32 PolarHBondContact O-N 3.1Å |
| 31 | P | 51.3 | Low | 50.2 | Low | 117 Ų | 117 | 140 Ų | 140 | 76% | 0.76 | 77% | 0.773 | S | S | * | * | P | Polyproline II helix | trans | -70.1 | 128.1 | 172.6 | 29.5 | -33.2 | 0 | 0 | 0 | 110.3 | ||
| 32 | R | 40.5 | Very low | 50.8 | Low | 236 Ų | 236 | 139.8 Ų | 139.8 | 89% | 0.891 | 77% | 0.769 | S | S | * | * | trans | -113.5 | 139.4 | 162.5 | -70.8 | -168.9 | -175.4 | 172.8 | 3.3 | 109.7 | Q30 | Q30-R32 PolarHBondContact O-N 3.1Š| ||
| 33 | P | 52.5 | Low | 51 | Low | 133 Ų | 133 | 141.1 Ų | 141.1 | 86% | 0.864 | 77% | 0.774 | S | S | * | * | trans | -79.2 | 153.4 | -174.5 | 32.5 | -35.9 | 0 | 0 | 0 | 112.5 | ||||
| 34 | G | 53.6 | Low | 51.2 | Low | 68 Ų | 68 | 142.8 Ų | 142.8 | 70% | 0.701 | 77% | 0.774 | S | S | * | * | trans | 95.1 | 69.7 | 153 | 0 | 0 | 0 | 0 | 0 | 117.7 | ||||
| 35 | H | 44.7 | Very low | 51.7 | Low | 182 Ų | 182 | 144.3 Ų | 144.3 | 84% | 0.843 | 77% | 0.771 | S | S | * | * | trans | -152.4 | 104.6 | 133.2 | -115.3 | 60.9 | 0 | 0 | 0 | 111.6 | ||||
| 36 | L | 55.6 | Low | 52.1 | Low | 178 Ų | 178 | 142 Ų | 142 | 93% | 0.932 | 77% | 0.765 | S | S | * | * | trans | -91.6 | 95 | 171.6 | -80 | 169.1 | 0 | 0 | 0 | 109.5 | ||||
| 37 | L | 49.7 | Very low | 52.3 | Low | 147 Ų | 147 | 146 Ų | 146 | 77% | 0.77 | 77% | 0.773 | S | S | * | * | trans | -129.4 | 99.8 | 156.3 | -80.2 | -179.3 | 0 | 0 | 0 | 110.1 | T39 | L37-T39 PolarHBondContact O-N 2.93Š| ||
| 38 | Y | 52.5 | Low | 52.7 | Low | 203 Ų | 203 | 154.1 Ų | 154.1 | 80% | 0.796 | 78% | 0.782 | S | S | * | * | trans | -65.9 | 106.3 | 174.3 | 172.1 | -90.7 | 0 | 0 | 0 | 109.8 | G40 | Y38-G40 VanDerWaalsContact C-N 3.29Å; Y38-G40 WeakPolarHBondContact CE1-O 3Å | ||
| 39 | T | 51.2 | Low | 52.5 | Low | 121 Ų | 121 | 152.8 Ų | 152.8 | 74% | 0.742 | 78% | 0.776 | S | S | * | * | trans | -97.9 | 32.4 | 170.6 | 54.5 | 0 | 0 | 0 | 0 | 111.9 | L37 Y41 | L37-T39 PolarHBondContact O-N 2.93Å; T39-Y41 PolarHBondContact O-N 2.93Å | ||
| 40 | G | 43.4 | Very low | 52.4 | Low | 35 Ų | 35 | 155 Ų | 155 | 36% | 0.361 | 78% | 0.78 | S | S | . | * | trans | -71.3 | 90.2 | 172.5 | 0 | 0 | 0 | 0 | 0 | 111.1 | Y38 P42 | Y38-G40 VanDerWaalsContact C-N 3.29Å; Y38-G40 WeakPolarHBondContact CE1-O 3Å; G40-P42 VanDerWaalsContact C-CD 3.48Å; G40-P42 WeakPolarHBondContact O-CD 3.34Å | ||
| 41 | Y | 53.5 | Low | 52.5 | Low | 212 Ų | 212 | 153.3 Ų | 153.3 | 83% | 0.831 | 78% | 0.781 | S | S | * | * | trans | -94.4 | 91.2 | 166.2 | -83.7 | -79.3 | 0 | 0 | 0 | 110.2 | T39 | T39-Y41 PolarHBondContact O-N 2.93Š| ||
| 42 | P | 59.6 | Low | 52.7 | Low | 93 Ų | 93 | 154.7 Ų | 154.7 | 60% | 0.604 | 78% | 0.78 | S | S | * | * | trans | -64.4 | 134.5 | 162 | 29.4 | -33.5 | 0 | 0 | 0 | 108.8 | G40 F44 | G40-P42 VanDerWaalsContact C-CD 3.48Å; G40-P42 WeakPolarHBondContact O-CD 3.34Å; P42-F44 PolarHBondContact O-N 3.43Å | ||
| 43 | M | 55.9 | Low | 53.1 | Low | 175 Ų | 175 | 149.1 Ų | 149.1 | 86% | 0.862 | 77% | 0.774 | S | S | * | * | trans | -74.4 | 59.7 | 178.3 | -75 | -75.5 | -71.3 | 0 | 0 | 112 | ||||
| 44 | F | 53.7 | Low | 52.5 | Low | 183 Ų | 183 | 151.5 Ų | 151.5 | 80% | 0.803 | 77% | 0.774 | S | S | * | * | trans | -90.8 | 100.9 | 167.8 | -106.8 | -97 | 0 | 0 | 0 | 109.1 | P42 P46 | P42-F44 PolarHBondContact O-N 3.43Å; F44-P46 WeakPolarHBondContact O-CD 3.46Å | ||
| 45 | M | 61 | Low | 52.1 | Low | 150 Ų | 150 | 153.1 Ų | 153.1 | 74% | 0.739 | 78% | 0.781 | S | S | * | * | trans | -79.3 | 109.5 | 165 | -71 | -90.3 | 94.1 | 0 | 0 | 108.2 | Y47 | M45-Y47 PolarHBondContact O-N 2.72Š| ||
| 46 | P | 59.4 | Low | 51.7 | Low | 113 Ų | 113 | 152 Ų | 152 | 73% | 0.734 | 78% | 0.78 | S | S | * | * | trans | -68.1 | 123.6 | 167.4 | 28.9 | -32.7 | 0 | 0 | 0 | 108.5 | F44 R48 | F44-P46 WeakPolarHBondContact O-CD 3.46Å; P46-R48 PolarHBondContact O-N 3.3Å; P46-R48 VanDerWaalsContact O-N 3.13Å | ||
| 47 | Y | 50.8 | Low | 50.8 | Low | 229 Ų | 229 | 147.5 Ų | 147.5 | 90% | 0.898 | 76% | 0.764 | S | S | * | * | trans | -59.3 | 117.7 | 174.9 | -72.4 | -91.2 | 0 | 0 | 0 | 109.6 | M45 P49 | M45-Y47 PolarHBondContact O-N 2.72Å; Y47-P49 VanDerWaalsContact O-CD 3.27Å; Y47-P49 WeakPolarHBondContact O-CD 3.19Å | ||
| 48 | R | 55.5 | Low | 50.3 | Low | 238 Ų | 238 | 149.4 Ų | 149.4 | 90% | 0.898 | 77% | 0.769 | S | S | * | * | trans | -80.2 | 112.2 | 175 | -154.6 | -174.9 | -159.1 | -142.8 | 6.8 | 108 | P46 L50 | P46-R48 PolarHBondContact O-N 3.3Å; P46-R48 VanDerWaalsContact O-N 3.13Å; R48-L50 PolarHBondContact O-N 3.31Å | ||
| 49 | P | 54 | Low | 49.5 | Very low | 106 Ų | 106 | 145.6 Ų | 145.6 | 69% | 0.688 | 77% | 0.771 | S | S | * | * | trans | -65.7 | 131.2 | 174.9 | 27.6 | -33.4 | 0 | 0 | 0 | 109.3 | Y47 V51 | Y47-P49 VanDerWaalsContact O-CD 3.27Å; Y47-P49 WeakPolarHBondContact O-CD 3.19Å; P49-V51 PolarHBondContact O-N 3.15Å; P49-V51 VanDerWaalsContact O-N 3.09Å | ||
| 50 | L | 50.6 | Low | 49.5 | Very low | 171 Ų | 171 | 145 Ų | 145 | 90% | 0.895 | 77% | 0.769 | S | S | * | * | trans | -75.1 | 96.1 | 172.3 | -78.1 | 167.5 | 0 | 0 | 0 | 108.8 | R48 I52 | R48-L50 PolarHBondContact O-N 3.31Å; L50-I52 PolarHBondContact O-N 3.44Å | ||
| 51 | V | 52.8 | Low | 49.1 | Very low | 129 Ų | 129 | 151.3 Ų | 151.3 | 78% | 0.782 | 79% | 0.794 | S | S | * | * | trans | -70.4 | 108.4 | 168.9 | 178.7 | 0 | 0 | 0 | 0 | 108.1 | P49 P53 | P49-V51 PolarHBondContact O-N 3.15Å; P49-V51 VanDerWaalsContact O-N 3.09Å; V51-P53 WeakPolarHBondContact O-CD 3.42Å | ||
| 52 | I | 55.4 | Low | 48.3 | Very low | 146 Ų | 146 | 146.1 Ų | 146.1 | 75% | 0.749 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -73.4 | 123.5 | 170.8 | -58.5 | 171.1 | 0 | 0 | 0 | 107.6 | L50 Q54 | L50-I52 PolarHBondContact O-N 3.44Å; I52-Q54 PolarHBondContact O-N 3.26Å |
| 53 | P | 49.5 | Very low | 47.4 | Very low | 119 Ų | 119 | 147 Ų | 147 | 77% | 0.773 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -65.2 | 123.6 | 172.9 | -20.1 | 33.3 | 0 | 0 | 0 | 110.5 | V51 | V51-P53 WeakPolarHBondContact O-CD 3.42Š|
| 54 | Q | 39.4 | Very low | 46.5 | Very low | 183 Ų | 183 | 142.3 Ų | 142.3 | 86% | 0.855 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -72.9 | 152.9 | 171 | -76.9 | -169.3 | -48 | 0 | 0 | 111.5 | I52 | I52-Q54 PolarHBondContact O-N 3.26Š|
| 55 | A | 47.1 | Very low | 45.9 | Very low | 102 Ų | 102 | 141.4 Ų | 141.4 | 84% | 0.843 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -79.7 | 128.8 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||
| 56 | L | 35.5 | Very low | 45.9 | Very low | 158 Ų | 158 | 139.3 Ų | 139.3 | 83% | 0.827 | 79% | 0.794 | S | S | * | * | trans | -149.6 | 147.7 | 168.2 | -78.3 | 168.6 | 0 | 0 | 0 | 106.9 | ||||
| 57 | S | 36.9 | Very low | 45.9 | Very low | 85 Ų | 85 | 139.4 Ų | 139.4 | 59% | 0.594 | 79% | 0.794 | S | S | * | * | cis | -177.4 | 124.3 | -24.4 | 45.4 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 58 | H | 38.6 | Very low | 45.3 | Very low | 187 Ų | 187 | 136 Ų | 136 | 87% | 0.866 | 79% | 0.791 | S | S | * | * | trans | 45.9 | 120.3 | 157.5 | -62.7 | -92.7 | 0 | 0 | 0 | 121.7 | ||||
| 59 | S | 36.8 | Very low | 44.7 | Very low | 122 Ų | 122 | 128.7 Ų | 128.7 | 85% | 0.853 | 78% | 0.781 | S | S | * | * | trans | -157.7 | 156.4 | 135.9 | -87.8 | 0 | 0 | 0 | 0 | 111 | ||||
| 60 | P | 50.7 | Low | 44.6 | Very low | 108 Ų | 108 | 129 Ų | 129 | 70% | 0.701 | 78% | 0.783 | S | S | * | * | trans | -132.5 | -175 | -138.1 | 37.1 | -18.2 | 0 | 0 | 0 | 117.3 | ||||
| 61 | L | 34.3 | Very low | 44.1 | Very low | 169 Ų | 169 | 128.6 Ų | 128.6 | 89% | 0.885 | 78% | 0.781 | S | S | * | * | trans | 79.1 | 138.6 | 171.6 | -44.5 | 179.2 | 0 | 0 | 0 | 114.1 | ||||
| 62 | S | 37.5 | Very low | 43.6 | Very low | 103 Ų | 103 | 127.3 Ų | 127.3 | 72% | 0.72 | 78% | 0.784 | S | S | * | * | cis | -151 | 152.4 | 35 | -177.1 | 0 | 0 | 0 | 0 | 115.5 | ||||
| 63 | S | 39.5 | Very low | 43.2 | Very low | 110 Ų | 110 | 126.1 Ų | 126.1 | 77% | 0.769 | 79% | 0.788 | S | S | * | * | trans | 49.1 | 119.2 | 147.4 | 57.8 | 0 | 0 | 0 | 0 | 122.6 | ||||
| 64 | G | 37.5 | Very low | 42.7 | Very low | 78 Ų | 78 | 129.9 Ų | 129.9 | 80% | 0.804 | 79% | 0.793 | S | S | * | * | trans | 159.4 | 73.4 | 157.6 | 0 | 0 | 0 | 0 | 0 | 118.5 | ||||
| 65 | I | 41.5 | Very low | 42.8 | Very low | 164 Ų | 164 | 125.8 Ų | 125.8 | 84% | 0.841 | 79% | 0.79 | S | S | * | * | trans | -153.6 | 158 | 176.2 | -48.6 | 176.8 | 0 | 0 | 0 | 106.5 | ||||
| 66 | P | 59.9 | Low | 42.4 | Very low | 106 Ų | 106 | 123.7 Ų | 123.7 | 69% | 0.688 | 78% | 0.778 | S | S | * | * | cis | -116.1 | -155.1 | 0.9 | 9 | 19.9 | 0 | 0 | 0 | 112.1 | ||||
| 67 | P | 59.5 | Low | 42.8 | Very low | 115 Ų | 115 | 127.5 Ų | 127.5 | 75% | 0.747 | 78% | 0.782 | S | S | * | * | cis | -119.7 | 158.8 | -3.9 | 36.9 | -18.6 | 0 | 0 | 0 | 114 | ||||
| 68 | L | 39.6 | Very low | 43.4 | Very low | 158 Ų | 158 | 131.5 Ų | 131.5 | 83% | 0.827 | 80% | 0.796 | S | S | * | * | 56.6 | 129.7 | 63.1 | -68.5 | 165 | 0 | 0 | 0 | 113.4 | |||||
| 69 | A | 42.8 | Very low | 43.8 | Very low | 84 Ų | 84 | 128.4 Ų | 128.4 | 69% | 0.694 | 79% | 0.79 | S | S | * | * | cis | -167.2 | -154.3 | -10.1 | 0 | 0 | 0 | 0 | 0 | 107.3 | ||||
| 70 | P | 50.6 | Low | 43.9 | Very low | 111 Ų | 111 | 130.5 Ų | 130.5 | 72% | 0.721 | 79% | 0.792 | S | S | * | * | -123.9 | -168.3 | -54.9 | 39.5 | -24.4 | 0 | 0 | 0 | 113.3 | |||||
| 71 | L | 39.8 | Very low | 43.8 | Very low | 163 Ų | 163 | 131.8 Ų | 131.8 | 85% | 0.853 | 80% | 0.798 | S | S | * | * | trans | 69.4 | 109.2 | 157.2 | -68.7 | 170.5 | 0 | 0 | 0 | 120.9 | ||||
| 72 | A | 42.2 | Very low | 44 | Very low | 103 Ų | 103 | 132.3 Ų | 132.3 | 85% | 0.851 | 79% | 0.793 | S | S | * | * | -158.9 | 137.6 | 120.3 | 0 | 0 | 0 | 0 | 0 | 110.3 | |||||
| 73 | S | 47.6 | Very low | 44.2 | Very low | 120 Ų | 120 | 133.1 Ų | 133.1 | 84% | 0.839 | 80% | 0.797 | S | S | * | * | trans | -82.5 | 132.1 | 170.8 | -60.9 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 74 | F | 40.2 | Very low | 44.2 | Very low | 199 Ų | 199 | 131.6 Ų | 131.6 | 87% | 0.873 | 79% | 0.792 | S | S | * | * | trans | -142.4 | 126.8 | 156.7 | -155 | -99.7 | 0 | 0 | 0 | 111.6 | ||||
| 75 | A | 41.3 | Very low | 44 | Very low | 96 Ų | 96 | 133.1 Ų | 133.1 | 79% | 0.793 | 79% | 0.79 | S | S | * | * | trans | -110.2 | 130.8 | 176 | 0 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 76 | G | 38.2 | Very low | 44.3 | Very low | 58 Ų | 58 | 132.1 Ų | 132.1 | 60% | 0.598 | 79% | 0.786 | S | S | * | * | trans | 131.1 | 135.1 | 156.2 | 0 | 0 | 0 | 0 | 0 | 117.2 | ||||
| 77 | R | 44.4 | Very low | 43.2 | Very low | 239 Ų | 239 | 130.7 Ų | 130.7 | 90% | 0.902 | 79% | 0.79 | S | S | * | * | trans | 65.1 | 98.7 | 147 | -58.7 | -179.7 | -177.4 | -89.3 | -2.6 | 117.2 | ||||
| 78 | L | 48.3 | Very low | 42.2 | Very low | 168 Ų | 168 | 134.1 Ų | 134.1 | 88% | 0.88 | 80% | 0.796 | S | S | * | * | trans | -73 | 122.4 | 157.9 | -62.5 | 170.7 | 0 | 0 | 0 | 110 | ||||
| 79 | T | 47.7 | Very low | 42.1 | Very low | 122 Ų | 122 | 130.1 Ų | 130.1 | 75% | 0.748 | 79% | 0.793 | S | S | * | * | trans | -141.1 | 107.3 | 161.5 | 50.8 | 0 | 0 | 0 | 0 | 108.4 | T81 | T79-T81 PolarHBondContact O-N 3.14Š| ||
| 80 | N | 39.5 | Very low | 42.5 | Very low | 167 Ų | 167 | 132.7 Ų | 132.7 | 89% | 0.893 | 80% | 0.8 | S | S | * | * | trans | -77.5 | 115 | -178.5 | -74.6 | -52.9 | 0 | 0 | 0 | 111.3 | ||||
| 81 | T | 47 | Very low | 42.7 | Very low | 134 Ų | 134 | 133.4 Ų | 133.4 | 82% | 0.822 | 80% | 0.804 | S | S | * | * | trans | -90.1 | 118.2 | 160.5 | 35.2 | 0 | 0 | 0 | 0 | 108.2 | T79 | T79-T81 PolarHBondContact O-N 3.14Š| ||
| 82 | F | 38.7 | Very low | 42.9 | Very low | 180 Ų | 180 | 131.6 Ų | 131.6 | 79% | 0.789 | 81% | 0.805 | S | S | * | * | 89.7 | 117.2 | 80.8 | -177.8 | -92.2 | 0 | 0 | 0 | 112.5 | A84 | F82-A84 HydrophobicContact CE1-CB 4.28Š| |||
| 83 | C | 42.3 | Very low | 43.2 | Very low | 120 Ų | 120 | 135.1 Ų | 135.1 | 81% | 0.811 | 81% | 0.806 | S | S | * | * | trans | -87.8 | 120.7 | 169 | -65.6 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 84 | A | 38.8 | Very low | 43.2 | Very low | 79 Ų | 79 | 136.7 Ų | 136.7 | 65% | 0.653 | 81% | 0.81 | S | S | * | * | trans | -76.6 | 163.1 | 154 | 0 | 0 | 0 | 0 | 0 | 109.2 | F82 | F82-A84 HydrophobicContact CE1-CB 4.28Š| ||
| 85 | S | 34.6 | Very low | 43.2 | Very low | 110 Ų | 110 | 131.4 Ų | 131.4 | 77% | 0.769 | 80% | 0.803 | S | S | * | * | cis | -159.1 | -179.3 | 4.1 | -145.7 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 86 | L | 46.5 | Very low | 43.4 | Very low | 143 Ų | 143 | 134.9 Ų | 134.9 | 75% | 0.749 | 81% | 0.808 | S | S | * | * | cis | -159.1 | 147.1 | 5.7 | -157 | 176.4 | 0 | 0 | 0 | 107.1 | Q88 | L86-Q88 HydrophobicContact CD2-CG 4.17Š| ||
| 87 | G | 37.3 | Very low | 43.7 | Very low | 75 Ų | 75 | 138.7 Ų | 138.7 | 77% | 0.773 | 82% | 0.82 | S | S | * | * | trans | -169.4 | 109.2 | 171.1 | 0 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 88 | Q | 39.3 | Very low | 43.5 | Very low | 188 Ų | 188 | 133.1 Ų | 133.1 | 88% | 0.879 | 81% | 0.812 | S | S | * | * | trans | -71.1 | 151.8 | -164.9 | -60.2 | 162.7 | -19 | 0 | 0 | 117.2 | L86 | L86-Q88 HydrophobicContact CD2-CG 4.17Š| ||
| 89 | G | 36.4 | Very low | 43.3 | Very low | 74 Ų | 74 | 131.4 Ų | 131.4 | 76% | 0.763 | 81% | 0.809 | S | S | * | * | trans | 88.7 | 146.8 | 154.1 | 0 | 0 | 0 | 0 | 0 | 117 | ||||
| 90 | V | 51.4 | Low | 43.4 | Very low | 138 Ų | 138 | 133.3 Ų | 133.3 | 84% | 0.836 | 81% | 0.811 | S | S | * | * | cis | -145.6 | 155.9 | -6.6 | -71.8 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 91 | P | 55 | Low | 44.2 | Very low | 126 Ų | 126 | 131.5 Ų | 131.5 | 82% | 0.818 | 81% | 0.809 | S | S | * | * | trans | -86.9 | 148.6 | -176.1 | 34.3 | -34.9 | 0 | 0 | 0 | 113.7 | ||||
| 92 | S | 44.9 | Very low | 43.6 | Very low | 125 Ų | 125 | 130.2 Ų | 130.2 | 87% | 0.874 | 81% | 0.805 | S | S | * | * | trans | -142.8 | 139.6 | 157.2 | -170.3 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 93 | M | 47.4 | Very low | 43.5 | Very low | 177 Ų | 177 | 130.9 Ų | 130.9 | 87% | 0.872 | 81% | 0.808 | S | S | * | * | trans | -114.2 | 126.2 | -170.4 | -67.9 | -100.5 | -90.8 | 0 | 0 | 110.8 | ||||
| 94 | V | 47.4 | Very low | 43.4 | Very low | 152 Ų | 152 | 129.2 Ų | 129.2 | 92% | 0.921 | 80% | 0.798 | S | S | * | * | trans | -146.2 | 146.7 | 147.1 | -82 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 95 | A | 40.3 | Very low | 43.4 | Very low | 88 Ų | 88 | 133.3 Ų | 133.3 | 73% | 0.727 | 81% | 0.809 | S | S | * | * | trans | -148.8 | 155.8 | -172.3 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 96 | L | 45.9 | Very low | 44.9 | Very low | 169 Ų | 169 | 133.5 Ų | 133.5 | 89% | 0.885 | 81% | 0.808 | S | S | * | * | trans | 69.2 | 157.6 | 175 | -46.6 | -179.9 | 0 | 0 | 0 | 112.6 | ||||
| 97 | T | 45.4 | Very low | 45.3 | Very low | 138 Ų | 138 | 132.8 Ų | 132.8 | 85% | 0.847 | 81% | 0.812 | S | S | * | * | cis | -128.2 | 168.7 | 21 | 52.9 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 98 | T | 39.5 | Very low | 45.2 | Very low | 122 Ų | 122 | 136.5 Ų | 136.5 | 75% | 0.748 | 81% | 0.814 | S | S | * | * | trans | -103.2 | 149.2 | 171.4 | -169.9 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 99 | T | 44.1 | Very low | 45 | Very low | 133 Ų | 133 | 132.5 Ų | 132.5 | 82% | 0.816 | 81% | 0.807 | S | S | * | * | trans | -163.1 | 123.4 | 158 | -79.1 | 0 | 0 | 0 | 0 | 109 | ||||
| 100 | M | 50.6 | Low | 45 | Very low | 161 Ų | 161 | 138.8 Ų | 138.8 | 79% | 0.793 | 81% | 0.813 | S | S | * | * | trans | -89.7 | 166.4 | 164.5 | -71.5 | -75.1 | 179.8 | 0 | 0 | 109.3 | ||||
| 101 | P | 55.6 | Low | 44.3 | Very low | 129 Ų | 129 | 142.2 Ų | 142.2 | 84% | 0.838 | 81% | 0.813 | S | S | * | * | -133.7 | 157.8 | 107.4 | 37.1 | -29.3 | 0 | 0 | 0 | 114.1 | |||||
| 102 | S | 34.8 | Very low | 44.5 | Very low | 107 Ų | 107 | 141.2 Ų | 141.2 | 75% | 0.748 | 81% | 0.806 | S | S | * | * | trans | -110.4 | 143.1 | 174.1 | 166 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 103 | F | 36.8 | Very low | 45.4 | Very low | 194 Ų | 194 | 140.4 Ų | 140.4 | 85% | 0.851 | 80% | 0.798 | S | S | * | * | trans | -158.6 | 112.5 | 147 | -139.5 | -103.5 | 0 | 0 | 0 | 114.4 | ||||
| 104 | S | 38.8 | Very low | 44.8 | Very low | 86 Ų | 86 | 139.8 Ų | 139.8 | 60% | 0.601 | 79% | 0.793 | S | S | * | * | trans | 42.9 | 139.5 | 134.3 | -41.2 | 0 | 0 | 0 | 0 | 123.3 | ||||
| 105 | D | 39.3 | Very low | 44 | Very low | 165 Ų | 165 | 138.6 Ų | 138.6 | 88% | 0.882 | 78% | 0.777 | S | S | * | * | trans | -82.8 | 154.1 | -176.3 | -82.4 | -66.6 | 0 | 0 | 0 | 117.1 | ||||
| 106 | P | 66.3 | Low | 44 | Very low | 114 Ų | 114 | 141.3 Ų | 141.3 | 74% | 0.74 | 78% | 0.779 | S | S | * | * | trans | -110.7 | 161 | 178.9 | 40.8 | -33.3 | 0 | 0 | 0 | 116 | ||||
| 107 | P | 55.7 | Low | 44.3 | Very low | 128 Ų | 128 | 139 Ų | 139 | 83% | 0.831 | 77% | 0.774 | S | S | * | * | trans | -109.4 | 169.3 | -176.1 | 40.4 | -35.9 | 0 | 0 | 0 | 117.9 | ||||
| 108 | D | 35 | Very low | 43.8 | Very low | 153 Ų | 153 | 136.1 Ų | 136.1 | 82% | 0.818 | 77% | 0.772 | S | S | * | * | trans | -63 | 154 | 174.5 | -74.8 | -84.1 | 0 | 0 | 0 | 119.3 | ||||
| 109 | S | 34.4 | Very low | 43.8 | Very low | 104 Ų | 104 | 134.7 Ų | 134.7 | 73% | 0.727 | 77% | 0.772 | S | S | * | * | 179.4 | 131 | 117.6 | -82.4 | 0 | 0 | 0 | 0 | 117.5 | |||||
| 110 | F | 35.4 | Very low | 43.4 | Very low | 206 Ų | 206 | 139.7 Ų | 139.7 | 90% | 0.904 | 78% | 0.776 | S | S | * | * | trans | 69.8 | 153.9 | 142.5 | -86.3 | -101.6 | 0 | 0 | 0 | 125 | ||||
| 111 | Y | 37.5 | Very low | 42.8 | Very low | 210 Ų | 210 | 139 Ų | 139 | 82% | 0.824 | 78% | 0.775 | S | S | * | * | trans | -142.4 | 174.6 | -177.3 | -131 | -131.2 | 0 | 0 | 0 | 105.8 | ||||
| 112 | P | 58.4 | Low | 42 | Very low | 105 Ų | 105 | 138.1 Ų | 138.1 | 68% | 0.682 | 77% | 0.772 | S | S | * | * | cis | -126.6 | -114.1 | -22.9 | 23.8 | 2.8 | 0 | 0 | 0 | 115.6 | ||||
| 113 | P | 64.9 | Low | 42 | Very low | 108 Ų | 108 | 137.4 Ų | 137.4 | 70% | 0.701 | 77% | 0.773 | S | S | * | * | -128.1 | -172.3 | -110.8 | 41.6 | -23.5 | 0 | 0 | 0 | 117.9 | |||||
| 114 | Q | 34.1 | Very low | 41.9 | Very low | 163 Ų | 163 | 133.1 Ų | 133.1 | 76% | 0.762 | 77% | 0.773 | S | S | * | * | trans | 137.8 | 148.2 | 131.9 | -109.4 | -159.1 | -47.2 | 0 | 0 | 121.1 | ||||
| 115 | E | 31.7 | Very low | 41.7 | Very low | 127 Ų | 127 | 136.1 Ų | 136.1 | 59% | 0.593 | 78% | 0.782 | S | S | * | * | trans | 60.7 | 114 | 153.4 | -58.3 | -42.3 | 92.4 | 0 | 0 | 128.1 | ||||
| 116 | L | 39.2 | Very low | 42.3 | Very low | 146 Ų | 146 | 133.7 Ų | 133.7 | 76% | 0.764 | 78% | 0.776 | S | S | * | * | 52.8 | 178.9 | 117.6 | -71.4 | -170.7 | 0 | 0 | 0 | 123.7 | |||||
| 117 | P | 52 | Low | 40.7 | Very low | 119 Ų | 119 | 131.4 Ų | 131.4 | 77% | 0.773 | 77% | 0.772 | S | S | * | * | cis | -135.9 | 169.1 | -19.3 | 22.9 | 0.8 | 0 | 0 | 0 | 118.1 | ||||
| 118 | G | 36.6 | Very low | 39.6 | Very low | 78 Ų | 78 | 131.1 Ų | 131.1 | 80% | 0.804 | 77% | 0.773 | S | S | * | * | trans | 109 | 155.1 | 139.6 | 0 | 0 | 0 | 0 | 0 | 120 | ||||
| 119 | A | 38 | Very low | 39.4 | Very low | 93 Ų | 93 | 133.9 Ų | 133.9 | 77% | 0.769 | 77% | 0.772 | S | S | * | * | cis | -168.1 | 138.2 | -11 | 0 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 120 | R | 37.1 | Very low | 39.2 | Very low | 238 Ų | 238 | 138.1 Ų | 138.1 | 90% | 0.898 | 77% | 0.772 | S | S | * | * | trans | 60 | 163.4 | 152.4 | -61.6 | -176.2 | 171.8 | -154.4 | -4.2 | 118.8 | ||||
| 121 | L | 37.5 | Very low | 38.9 | Very low | 146 Ų | 146 | 134.1 Ų | 134.1 | 76% | 0.764 | 76% | 0.756 | S | S | * | * | cis | -132.4 | 147.2 | 14 | -73.8 | 164.2 | 0 | 0 | 0 | 109.4 | ||||
| 122 | S | 37.6 | Very low | 38.5 | Very low | 111 Ų | 111 | 131.9 Ų | 131.9 | 78% | 0.776 | 75% | 0.753 | S | S | * | * | 69.7 | 130.6 | 62 | -168.5 | 0 | 0 | 0 | 0 | 114.5 | |||||
| 123 | A | 35.7 | Very low | 37.3 | Very low | 92 Ų | 92 | 131.9 Ų | 131.9 | 76% | 0.76 | 76% | 0.756 | S | S | * | * | cis | -171.4 | -174.6 | -13.3 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 124 | A | 34.4 | Very low | 36.6 | Very low | 103 Ų | 103 | 131.9 Ų | 131.9 | 85% | 0.851 | 76% | 0.756 | S | S | * | * | trans | 111.6 | 113.8 | 156.2 | 0 | 0 | 0 | 0 | 0 | 120.3 | ||||
| 125 | D | 35.5 | Very low | 36.4 | Very low | 149 Ų | 149 | 132.3 Ų | 132.3 | 80% | 0.797 | 76% | 0.758 | S | S | * | * | trans | -84.4 | 179.3 | 149.9 | -152.9 | -129.9 | 0 | 0 | 0 | 107.7 | ||||
| 126 | P | 51.6 | Low | 36.4 | Very low | 115 Ų | 115 | 130.5 Ų | 130.5 | 75% | 0.747 | 76% | 0.759 | S | S | * | * | cis | -145.7 | 178 | 15 | 45.4 | -26.1 | 0 | 0 | 0 | 118.8 | ||||
| 127 | G | 31.9 | Very low | 36 | Very low | 65 Ų | 65 | 130.2 Ų | 130.2 | 67% | 0.67 | 76% | 0.758 | S | S | * | * | trans | 141.7 | 108.1 | 137.2 | 0 | 0 | 0 | 0 | 0 | 121.5 | ||||
| 128 | S | 33 | Very low | 35.1 | Very low | 122 Ų | 122 | 131.5 Ų | 131.5 | 85% | 0.853 | 75% | 0.754 | S | S | * | * | 60 | 121.4 | 128.7 | -79.1 | 0 | 0 | 0 | 0 | 124.5 | |||||
| 129 | R | 30.9 | Very low | 35 | Very low | 212 Ų | 212 | 134 Ų | 134 | 80% | 0.8 | 75% | 0.749 | S | S | * | * | 93 | 102.5 | 114.8 | -167.2 | 172.4 | -158.9 | -99.6 | 7.8 | 121.9 | |||||
| 130 | R | 31.2 | Very low | 34.9 | Very low | 193 Ų | 193 | 137.5 Ų | 137.5 | 73% | 0.728 | 75% | 0.749 | S | S | * | * | trans | 79.1 | 122.7 | 135.6 | -97.2 | -166.2 | 172.2 | -153.8 | 6.4 | 123 | ||||
| 131 | Q | 28.7 | Very low | 34.6 | Very low | 121 Ų | 121 | 131 Ų | 131 | 57% | 0.565 | 74% | 0.74 | S | S | * | * | 87.4 | 153.4 | 116.6 | -147.8 | -170.6 | -40.5 | 0 | 0 | 121.2 | |||||
| 132 | E | 28.9 | Very low | 34.4 | Very low | 163 Ų | 163 | 134.3 Ų | 134.3 | 76% | 0.762 | 74% | 0.742 | S | S | * | * | trans | 86.5 | 125 | 165.2 | -49.5 | -83.5 | 74 | 0 | 0 | 117.4 | ||||
| 133 | S | 33.5 | Very low | 34.2 | Very low | 105 Ų | 105 | 133.5 Ų | 133.5 | 73% | 0.734 | 73% | 0.729 | S | S | * | * | trans | -107.7 | 167.3 | 154.5 | 175.1 | 0 | 0 | 0 | 0 | 106.6 | ||||
| 134 | P | 49.3 | Very low | 34.1 | Very low | 108 Ų | 108 | 138.6 Ų | 138.6 | 70% | 0.701 | 73% | 0.734 | S | S | * | * | -153 | 163.4 | 111.7 | 37.5 | -21.3 | 0 | 0 | 0 | 116.8 | |||||
| 135 | H | 30.8 | Very low | 33.9 | Very low | 172 Ų | 172 | 136.8 Ų | 136.8 | 80% | 0.796 | 73% | 0.725 | S | S | * | * | trans | 62.9 | 140.6 | 151.7 | -94 | -91 | 0 | 0 | 0 | 119.1 | ||||
| 136 | S | 31.2 | Very low | 33.9 | Very low | 90 Ų | 90 | 135.3 Ų | 135.3 | 63% | 0.629 | 73% | 0.727 | S | S | * | * | cis | -146.4 | -159.3 | -3.6 | -42.2 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 137 | D | 30.9 | Very low | 33 | Very low | 139 Ų | 139 | 137.4 Ų | 137.4 | 74% | 0.743 | 73% | 0.727 | S | S | * | * | cis | -163.4 | 177.3 | -14.4 | -120.3 | -40.9 | 0 | 0 | 0 | 105.9 | ||||
| 138 | E | 32.9 | Very low | 33.3 | Very low | 146 Ų | 146 | 141.1 Ų | 141.1 | 68% | 0.682 | 73% | 0.73 | S | S | * | * | cis | -141.8 | 169.2 | -5.9 | 170.6 | 176.6 | -6.9 | 0 | 0 | 108 | H140 | E138-H140 IonicContact OE2-CE1 2.68Š| ||
| 139 | L | 34.9 | Very low | 33.4 | Very low | 132 Ų | 132 | 143 Ų | 143 | 69% | 0.691 | 73% | 0.73 | S | S | * | * | trans | -40.4 | 147 | 159.3 | -58 | 168.6 | 0 | 0 | 0 | 114.5 | ||||
| 140 | H | 34.4 | Very low | 33.8 | Very low | 166 Ų | 166 | 139.9 Ų | 139.9 | 77% | 0.769 | 73% | 0.729 | S | S | * | * | -159.7 | 178.5 | 68 | -91.3 | 88.7 | 0 | 0 | 0 | 113.9 | E138 | E138-H140 IonicContact OE2-CE1 2.68Š| |||
| 141 | S | 32.2 | Very low | 33.6 | Very low | 102 Ų | 102 | 139.7 Ų | 139.7 | 71% | 0.713 | 73% | 0.734 | S | S | * | * | trans | -143.6 | 148.5 | -165.9 | -146.3 | 0 | 0 | 0 | 0 | 114 | ||||
| 142 | R | 33.7 | Very low | 33.9 | Very low | 214 Ų | 214 | 137.6 Ų | 137.6 | 81% | 0.808 | 73% | 0.732 | S | S | * | * | trans | 73.1 | 163.5 | 162 | -56.4 | 163.5 | 60.4 | 163.6 | 1.3 | 115.9 | ||||
| 143 | D | 32 | Very low | 34 | Very low | 95 Ų | 95 | 136.4 Ų | 136.4 | 51% | 0.508 | 73% | 0.727 | S | S | . | * | cis | -156.4 | 149.8 | 9.7 | -141.7 | -67.7 | 0 | 0 | 0 | 110.6 | ||||
| 144 | K | 35.1 | Very low | 33.9 | Very low | 198 Ų | 198 | 137.7 Ų | 137.7 | 86% | 0.861 | 73% | 0.73 | S | S | * | * | trans | 76.4 | 150.6 | 158.8 | -46.5 | -176.4 | -173.9 | 167.8 | 0 | 123.5 | ||||
| 145 | G | 29 | Very low | 32.9 | Very low | 65 Ų | 65 | 141.2 Ų | 141.2 | 67% | 0.67 | 74% | 0.735 | S | S | * | * | trans | 124.8 | 111.8 | 166.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 146 | S | 35.2 | Very low | 33 | Very low | 118 Ų | 118 | 141.6 Ų | 141.6 | 83% | 0.825 | 74% | 0.737 | S | S | * | * | 51.8 | 130.6 | 62.8 | 75.7 | 0 | 0 | 0 | 0 | 114.3 | |||||
| 147 | E | 32.8 | Very low | 32.8 | Very low | 160 Ų | 160 | 143.4 Ų | 143.4 | 75% | 0.748 | 75% | 0.745 | S | S | * | * | cis | -165.8 | 151.9 | -11.1 | -118.7 | -142 | 134 | 0 | 0 | 108.1 | ||||
| 148 | L | 38.1 | Very low | 32.9 | Very low | 143 Ų | 143 | 145 Ų | 145 | 75% | 0.749 | 75% | 0.751 | S | S | * | * | trans | 61.8 | 179.7 | 161.3 | -60.5 | 173.7 | 0 | 0 | 0 | 118.8 | ||||
| 149 | L | 36.4 | Very low | 32.9 | Very low | 160 Ų | 160 | 143.3 Ų | 143.3 | 84% | 0.838 | 76% | 0.756 | S | S | * | * | trans | 69 | 113.8 | -174.8 | -47 | -175.5 | 0 | 0 | 0 | 113.9 | ||||
| 150 | N | 38.9 | Very low | 32.8 | Very low | 148 Ų | 148 | 141.9 Ų | 141.9 | 79% | 0.791 | 76% | 0.763 | S | S | * | * | cis | 68.1 | 90.8 | 41.5 | -166 | 83.4 | 0 | 0 | 0 | 113.7 | ||||
| 151 | F | 26.2 | Very low | 32.7 | Very low | 188 Ų | 188 | 137.8 Ų | 137.8 | 83% | 0.825 | 77% | 0.766 | S | S | * | * | trans | -138.8 | 122 | 162 | -157.2 | -101.2 | 0 | 0 | 0 | 110.7 | ||||
| 152 | S | 35 | Very low | 33 | Very low | 77 Ų | 77 | 142.1 Ų | 142.1 | 54% | 0.538 | 78% | 0.775 | S | S | . | * | trans | -104.5 | 167.4 | 166.5 | 179.4 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 153 | E | 32.2 | Very low | 32.9 | Very low | 138 Ų | 138 | 139.3 Ų | 139.3 | 65% | 0.645 | 78% | 0.781 | S | S | * | * | trans | 62.4 | 91.2 | 167.5 | -74.4 | 151.1 | 95 | 0 | 0 | 117.4 | F155 | E153-F155 HydrophobicContact CB-CD2 4.38Å; E153-F155 HydrophobicContact CG-CD2 4.28Å; E153-F155 PolarHBondContact O-N 3.1Å | ||
| 154 | T | 30.4 | Very low | 33.2 | Very low | 132 Ų | 132 | 143.5 Ų | 143.5 | 81% | 0.81 | 80% | 0.795 | S | S | * | * | trans | -78.8 | 89.7 | 149.1 | -51.7 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 155 | F | 29.1 | Very low | 33.1 | Very low | 182 Ų | 182 | 141.1 Ų | 141.1 | 80% | 0.798 | 79% | 0.791 | S | S | * | * | trans | -102.5 | 127 | 158.5 | -93.5 | -74.9 | 0 | 0 | 0 | 109 | E153 | E153-F155 HydrophobicContact CB-CD2 4.38Å; E153-F155 HydrophobicContact CG-CD2 4.28Å; E153-F155 PolarHBondContact O-N 3.1Å | ||
| 156 | Q | 33.2 | Very low | 33.1 | Very low | 180 Ų | 180 | 148.8 Ų | 148.8 | 84% | 0.841 | 80% | 0.802 | S | S | * | * | trans | -110.6 | 116 | -171.7 | -154.2 | 161.9 | 34.2 | 0 | 0 | 111 | ||||
| 157 | T | 26 | Very low | 32.9 | Very low | 128 Ų | 128 | 146.7 Ų | 146.7 | 79% | 0.785 | 79% | 0.787 | S | S | * | * | trans | -75.4 | 137.4 | -171.9 | -35.9 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 158 | I | 32.3 | Very low | 33 | Very low | 172 Ų | 172 | 143.7 Ų | 143.7 | 88% | 0.882 | 78% | 0.784 | S | S | * | * | trans | -127.7 | 139.3 | 155.2 | -55.9 | -178.8 | 0 | 0 | 0 | 107.1 | ||||
| 159 | S | 33.4 | Very low | 32.9 | Very low | 111 Ų | 111 | 142.9 Ų | 142.9 | 78% | 0.776 | 78% | 0.78 | S | S | * | * | trans | -124.5 | 133.4 | -170.5 | 176.4 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 160 | A | 34.2 | Very low | 33.4 | Very low | 102 Ų | 102 | 144 Ų | 144 | 84% | 0.843 | 78% | 0.781 | S | S | * | * | trans | -171.4 | 145.6 | 153.1 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 161 | G | 31.7 | Very low | 33.6 | Very low | 80 Ų | 80 | 145.6 Ų | 145.6 | 83% | 0.825 | 78% | 0.784 | S | S | * | * | trans | 96.5 | 98.7 | 153.2 | 0 | 0 | 0 | 0 | 0 | 117.9 | ||||
| 162 | E | 37.2 | Very low | 34.4 | Very low | 193 Ų | 193 | 144.5 Ų | 144.5 | 90% | 0.902 | 78% | 0.779 | S | S | * | * | trans | -80.7 | 143.1 | 159.9 | -63.1 | 175.5 | 93.8 | 0 | 0 | 110.9 | ||||
| 163 | T | 33.5 | Very low | 34.7 | Very low | 155 Ų | 155 | 147.3 Ų | 147.3 | 95% | 0.951 | 79% | 0.787 | S | S | * | * | trans | -163.4 | 172 | 152.8 | 1.3 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 164 | K | 37 | Very low | 35 | Very low | 183 Ų | 183 | 146.5 Ų | 146.5 | 80% | 0.796 | 79% | 0.787 | S | S | * | * | trans | -106.7 | 144.9 | -164.1 | -95.4 | 179.7 | 173.2 | 178 | 0 | 114.6 | ||||
| 165 | L | 34.3 | Very low | 35.9 | Very low | 148 Ų | 148 | 147.3 Ų | 147.3 | 78% | 0.775 | 79% | 0.785 | S | S | * | * | trans | 65.1 | 145.1 | 141.4 | -66.7 | 166.8 | 0 | 0 | 0 | 120.8 | ||||
| 166 | Y | 28.3 | Very low | 36.4 | Very low | 227 Ų | 227 | 146.9 Ų | 146.9 | 89% | 0.89 | 78% | 0.783 | S | S | * | * | trans | 72.1 | 148.4 | 156 | -135.1 | -109.1 | 0 | 0 | 0 | 116 | ||||
| 167 | S | 31.6 | Very low | 36.8 | Very low | 74 Ų | 74 | 142 Ų | 142 | 52% | 0.517 | 77% | 0.769 | S | S | . | * | cis | -165.2 | 162.6 | -30.2 | -176.3 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 168 | S | 35 | Very low | 37.7 | Very low | 97 Ų | 97 | 140.9 Ų | 140.9 | 68% | 0.678 | 77% | 0.773 | S | S | * | * | trans | 68.7 | 134.1 | 152.4 | -86.9 | 0 | 0 | 0 | 0 | 122.5 | ||||
| 169 | D | 34.7 | Very low | 37.8 | Very low | 125 Ų | 125 | 139 Ų | 139 | 67% | 0.668 | 77% | 0.765 | S | S | * | * | trans | 59.9 | 98.6 | 135 | -60.3 | -111.3 | 0 | 0 | 0 | 121.2 | ||||
| 170 | E | 46.7 | Very low | 38.4 | Very low | 185 Ų | 185 | 138.4 Ų | 138.4 | 86% | 0.864 | 77% | 0.766 | S | S | * | * | trans | 11 | 113.4 | 142.3 | 57 | -165.9 | 77 | 0 | 0 | 122 | ||||
| 171 | E | 44 | Very low | 38.7 | Very low | 181 Ų | 181 | 139.4 Ų | 139.4 | 85% | 0.846 | 76% | 0.762 | S | S | * | * | trans | -121.4 | 102.4 | 161.9 | -70.1 | -159 | -151.9 | 0 | 0 | 113.6 | ||||
| 172 | K | 43.5 | Very low | 39.3 | Very low | 165 Ų | 165 | 141.4 Ų | 141.4 | 72% | 0.717 | 76% | 0.762 | S | S | * | * | 19.9 | 139.8 | 123.7 | 148.1 | 176.3 | 174.2 | -62.6 | 0 | 120.1 | |||||
| 173 | L | 40.8 | Very low | 39.7 | Very low | 135 Ų | 135 | 136.6 Ų | 136.6 | 71% | 0.707 | 75% | 0.749 | S | S | * | * | trans | 87.4 | 157.3 | 173.4 | -57.4 | -170.4 | 0 | 0 | 0 | 116.8 | ||||
| 174 | D | 38.1 | Very low | 40 | Very low | 122 Ų | 122 | 136.8 Ų | 136.8 | 65% | 0.652 | 75% | 0.745 | S | S | * | * | cis | -168 | 155.6 | -41.8 | -147.9 | -40.9 | 0 | 0 | 0 | 109.5 | ||||
| 175 | L | 50.2 | Low | 40.9 | Very low | 148 Ų | 148 | 139.1 Ų | 139.1 | 78% | 0.775 | 75% | 0.748 | S | S | * | * | trans | 61.6 | 165 | 172.9 | -47 | 175.9 | 0 | 0 | 0 | 115.6 | ||||
| 176 | K | 38.3 | Very low | 41.2 | Very low | 173 Ų | 173 | 139.4 Ų | 139.4 | 75% | 0.752 | 75% | 0.751 | S | S | * | * | cis | -156.7 | 150.4 | 17.8 | -175.4 | 59.8 | 178.5 | 174.9 | 0 | 112.5 | ||||
| 177 | S | 42.2 | Very low | 41.9 | Very low | 78 Ų | 78 | 136.4 Ų | 136.4 | 55% | 0.545 | 75% | 0.75 | S | S | . | * | trans | 2.1 | 134 | 166.9 | -75.6 | 0 | 0 | 0 | 0 | 122.1 | D179 | S177-D179 VanDerWaalsContact CB-OD2 3.24Å; S177-D179 WeakPolarHBondContact CB-OD2 3.44Å; S177-D179 PolarHBondContact OG-OD2 3.25Å | ||
| 178 | A | 45.3 | Very low | 42.7 | Very low | 105 Ų | 105 | 138.2 Ų | 138.2 | 87% | 0.868 | 76% | 0.763 | S | S | * | * | trans | -140.7 | 96.7 | 136.3 | 0 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 179 | D | 35 | Very low | 43.3 | Very low | 133 Ų | 133 | 139 Ų | 139 | 71% | 0.711 | 77% | 0.768 | S | S | * | * | trans | -78.5 | 129.9 | -170.5 | -66.4 | -98.1 | 0 | 0 | 0 | 112.9 | S177 | S177-D179 VanDerWaalsContact CB-OD2 3.24Å; S177-D179 WeakPolarHBondContact CB-OD2 3.44Å; S177-D179 PolarHBondContact OG-OD2 3.25Å | ||
| 180 | A | 44.6 | Very low | 44 | Very low | 98 Ų | 98 | 137.6 Ų | 137.6 | 81% | 0.81 | 77% | 0.774 | S | S | * | * | trans | -135.2 | 60.7 | 176.7 | 0 | 0 | 0 | 0 | 0 | 110.9 | C182 | A180-C182 PolarHBondContact O-N 2.7Å; A180-C182 VanDerWaalsContact O-N 3.07Å | ||
| 181 | V | 41.8 | Very low | 43.5 | Very low | 123 Ų | 123 | 136.1 Ų | 136.1 | 75% | 0.745 | 77% | 0.772 | S | S | * | * | trans | -67.3 | 105.1 | 176.6 | 176.7 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 182 | C | 44.1 | Very low | 43.7 | Very low | 122 Ų | 122 | 132.5 Ų | 132.5 | 82% | 0.824 | 77% | 0.767 | S | S | * | * | trans | -89.1 | 110.6 | 159.5 | -168.3 | 0 | 0 | 0 | 0 | 107.2 | A180 D184 | A180-C182 PolarHBondContact O-N 2.7Å; A180-C182 VanDerWaalsContact O-N 3.07Å; C182-D184 PolarHBondContact O-N 2.98Å | ||
| 183 | S | 45.4 | Very low | 44.1 | Very low | 92 Ų | 92 | 133.2 Ų | 133.2 | 64% | 0.643 | 77% | 0.772 | S | S | * | * | trans | -67.8 | 116.2 | -177.9 | -53.2 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 184 | D | 40.4 | Very low | 44.1 | Very low | 159 Ų | 159 | 133.2 Ų | 133.2 | 85% | 0.85 | 77% | 0.773 | S | S | * | * | trans | -53.5 | 145.4 | 152 | -83.4 | -70.2 | 0 | 0 | 0 | 109.7 | C182 | C182-D184 PolarHBondContact O-N 2.98Š| ||
| 185 | R | 55.6 | Low | 44.7 | Very low | 231 Ų | 231 | 133.6 Ų | 133.6 | 87% | 0.872 | 77% | 0.771 | S | S | * | * | trans | -137.2 | 123.6 | 167.7 | -77.1 | -169.5 | 171.9 | -163 | -2.9 | 107.7 | ||||
| 186 | D | 39.8 | Very low | 44.4 | Very low | 155 Ų | 155 | 131.5 Ų | 131.5 | 83% | 0.829 | 77% | 0.769 | S | S | * | * | trans | -62.2 | 133.6 | -170 | -55 | -100.4 | 0 | 0 | 0 | 112.7 | S188 | D186-S188 PolarHBondContact O-N 3.37Š| ||
| 187 | D | 42.9 | Very low | 44.4 | Very low | 164 Ų | 164 | 131.7 Ų | 131.7 | 88% | 0.877 | 77% | 0.77 | S | S | * | * | trans | -81.1 | 97.7 | 171 | -179.1 | 37.4 | 0 | 0 | 0 | 109.1 | ||||
| 188 | S | 47.9 | Very low | 44.5 | Very low | 112 Ų | 112 | 133.3 Ų | 133.3 | 78% | 0.783 | 78% | 0.781 | S | S | * | * | trans | -159.6 | 82.4 | 177.8 | -71.1 | 0 | 0 | 0 | 0 | 112.2 | D186 | D186-S188 PolarHBondContact O-N 3.37Š| ||
| 189 | S | 48.2 | Very low | 44.2 | Very low | 113 Ų | 113 | 136 Ų | 136 | 79% | 0.79 | 78% | 0.781 | S | S | * | * | trans | -145.1 | 111.4 | 152.5 | -164 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 190 | A | 48.5 | Very low | 44.5 | Very low | 96 Ų | 96 | 133 Ų | 133 | 79% | 0.793 | 78% | 0.782 | S | S | * | * | trans | -78.2 | 139.3 | 164.3 | 0 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 191 | D | 37.1 | Very low | 44.5 | Very low | 154 Ų | 154 | 136.1 Ų | 136.1 | 82% | 0.824 | 79% | 0.785 | S | S | * | * | trans | -140.8 | 160 | 154.8 | -141.9 | -40.1 | 0 | 0 | 0 | 109 | ||||
| 192 | S | 47.2 | Very low | 44.5 | Very low | 104 Ų | 104 | 136.9 Ų | 136.9 | 73% | 0.727 | 79% | 0.785 | S | S | * | * | trans | -149.5 | 96.2 | -171.5 | -72.2 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 193 | E | 52.3 | Low | 44.2 | Very low | 180 Ų | 180 | 136.9 Ų | 136.9 | 84% | 0.841 | 79% | 0.785 | S | S | * | * | trans | -103 | 137.3 | 169.8 | 58.1 | -170.7 | 130.8 | 0 | 0 | 110.7 | ||||
| 194 | N | 42 | Very low | 43.5 | Very low | 135 Ų | 135 | 135.5 Ų | 135.5 | 72% | 0.722 | 79% | 0.785 | S | S | * | * | trans | -121.5 | 54.1 | -156.9 | 52.5 | -115.3 | 0 | 0 | 0 | 113.3 | S196 | N194-S196 PolarHBondContact O-N 3.34Å; N194-S196 VanDerWaalsContact O-N 3.1Å | ||
| 195 | E | 49.2 | Very low | 43.1 | Very low | 131 Ų | 131 | 131.7 Ų | 131.7 | 61% | 0.612 | 78% | 0.783 | S | S | * | * | trans | -81.2 | 95.9 | -169.5 | -67.3 | -50 | 116.8 | 0 | 0 | 114.6 | F197 | E195-F197 HydrophobicContact CB-CD2 4.14Å; E195-F197 HydrophobicContact CB-CE2 3.97Å; E195-F197 PolarHBondContact O-N 3.09Å | ||
| 196 | S | 44.8 | Very low | 42.2 | Very low | 104 Ų | 104 | 128.5 Ų | 128.5 | 73% | 0.727 | 78% | 0.782 | S | S | * | * | trans | -82.7 | 81.3 | 179.2 | 169.3 | 0 | 0 | 0 | 0 | 112.5 | N194 S198 | N194-S196 PolarHBondContact O-N 3.34Å; N194-S196 VanDerWaalsContact O-N 3.1Å; S196-S198 PolarHBondContact O-N 3.4Å | ||
| 197 | F | 38 | Very low | 42.1 | Very low | 177 Ų | 177 | 126.6 Ų | 126.6 | 78% | 0.776 | 78% | 0.782 | S | S | * | * | trans | -89.1 | 98 | 169.9 | -74.3 | -78.5 | 0 | 0 | 0 | 112.4 | E195 | E195-F197 HydrophobicContact CB-CD2 4.14Å; E195-F197 HydrophobicContact CB-CE2 3.97Å; E195-F197 PolarHBondContact O-N 3.09Å | ||
| 198 | S | 44 | Very low | 42 | Very low | 112 Ų | 112 | 127.7 Ų | 127.7 | 78% | 0.783 | 78% | 0.781 | S | S | * | * | trans | -78.3 | 113.4 | 156.9 | -69.2 | 0 | 0 | 0 | 0 | 108.8 | S196 | S196-S198 PolarHBondContact O-N 3.4Š| ||
| 199 | D | 40 | Very low | 41.6 | Very low | 162 Ų | 162 | 132.2 Ų | 132.2 | 87% | 0.866 | 79% | 0.787 | S | S | * | * | trans | -150.5 | 130.2 | 152.1 | -133.5 | -27.7 | 0 | 0 | 0 | 111.1 | ||||
| 200 | G | 39.8 | Very low | 41.1 | Very low | 70 Ų | 70 | 130.8 Ų | 130.8 | 72% | 0.722 | 79% | 0.79 | S | S | * | * | trans | -120.6 | 121.9 | 176.8 | 0 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 201 | N | 45 | Very low | 40.6 | Very low | 163 Ų | 163 | 135 Ų | 135 | 87% | 0.872 | 79% | 0.79 | S | S | * | * | trans | -129.3 | 136.4 | 166.7 | -154 | -2.4 | 0 | 0 | 0 | 113 | ||||
| 202 | N | 43.2 | Very low | 40.7 | Very low | 139 Ų | 139 | 135.9 Ų | 135.9 | 74% | 0.743 | 80% | 0.795 | S | S | * | * | trans | -89.1 | 133.3 | -179.7 | 163.6 | 27.1 | 0 | 0 | 0 | 109.2 | G204 | N202-G204 PolarHBondContact OD1-N 3.04Š| ||
| 203 | C | 36.4 | Very low | 40.3 | Very low | 122 Ų | 122 | 141 Ų | 141 | 82% | 0.824 | 80% | 0.804 | S | S | * | * | trans | -135.7 | 99.2 | 155.9 | 57.4 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 204 | G | 32.1 | Very low | 39.2 | Very low | 63 Ų | 63 | 136.4 Ų | 136.4 | 65% | 0.649 | 80% | 0.804 | S | S | * | * | trans | -53 | 146.4 | 141.2 | 0 | 0 | 0 | 0 | 0 | 109 | N202 | N202-G204 PolarHBondContact OD1-N 3.04Š| ||
| 205 | G | 31 | Very low | 38.7 | Very low | 79 Ų | 79 | 133.7 Ų | 133.7 | 81% | 0.814 | 81% | 0.808 | S | S | * | * | cis | 95.9 | 89.4 | 33.6 | 0 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 206 | L | 36.8 | Very low | 38.1 | Very low | 163 Ų | 163 | 133.2 Ų | 133.2 | 85% | 0.853 | 82% | 0.82 | S | S | * | * | trans | -146.2 | 125.6 | 175.3 | -110.7 | 170.7 | 0 | 0 | 0 | 109.7 | ||||
| 207 | S | 36.8 | Very low | 37.8 | Very low | 116 Ų | 116 | 137.9 Ų | 137.9 | 81% | 0.811 | 83% | 0.83 | S | S | * | * | trans | -87.2 | 136.6 | 167.3 | -65.8 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 208 | Q | 42 | Very low | 37.6 | Very low | 187 Ų | 187 | 138.2 Ų | 138.2 | 87% | 0.874 | 83% | 0.834 | S | S | * | * | trans | -124.1 | 126.4 | 162.1 | -76.6 | -160.6 | 0.4 | 0 | 0 | 112 | ||||
| 209 | K | 40 | Very low | 37.5 | Very low | 206 Ų | 206 | 136.7 Ų | 136.7 | 90% | 0.896 | 83% | 0.828 | S | S | * | * | trans | -109.8 | 85.4 | -177.4 | 175 | -170.9 | 172.7 | -175.5 | 0 | 108 | ||||
| 210 | G | 36.1 | Very low | 37.5 | Very low | 84 Ų | 84 | 134.6 Ų | 134.6 | 87% | 0.866 | 83% | 0.826 | S | S | * | * | trans | -82.4 | 128.1 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 211 | K | 38.8 | Very low | 37.6 | Very low | 183 Ų | 183 | 139.3 Ų | 139.3 | 80% | 0.796 | 83% | 0.834 | S | S | * | * | trans | -153.7 | 108.8 | -175.1 | 173.5 | 63.5 | 175.4 | -178.4 | 0 | 111.9 | ||||
| 212 | L | 39.1 | Very low | 37.3 | Very low | 174 Ų | 174 | 137.6 Ų | 137.6 | 91% | 0.911 | 83% | 0.832 | S | S | * | * | trans | -125.5 | -163.6 | 174.6 | -74.8 | 171.6 | 0 | 0 | 0 | 112 | ||||
| 213 | K | 38.2 | Very low | 37.1 | Very low | 212 Ų | 212 | 136.6 Ų | 136.6 | 92% | 0.922 | 84% | 0.836 | S | S | * | * | trans | -147.1 | 116.8 | -164.4 | 171.4 | -167.9 | 173.7 | -172.5 | 0 | 111.5 | ||||
| 214 | G | 29.2 | Very low | 37.6 | Very low | 82 Ų | 82 | 134.9 Ų | 134.9 | 85% | 0.845 | 84% | 0.838 | S | S | * | * | trans | 137.1 | 139.6 | 167.2 | 0 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 215 | G | 31.6 | Very low | 38 | Very low | 79 Ų | 79 | 135 Ų | 135 | 81% | 0.814 | 84% | 0.839 | S | S | * | * | cis | -153.1 | 176 | -2.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 216 | S | 36.5 | Very low | 38.6 | Very low | 121 Ų | 121 | 136.5 Ų | 136.5 | 85% | 0.846 | 84% | 0.838 | S | S | * | * | trans | -77.1 | 145.9 | -166 | -46.9 | 0 | 0 | 0 | 0 | 115.7 | ||||
| 217 | Q | 38.8 | Very low | 39.1 | Very low | 201 Ų | 201 | 133.5 Ų | 133.5 | 94% | 0.939 | 84% | 0.836 | S | S | * | * | trans | -158.4 | -176.4 | 138.7 | -112.8 | 163 | 56.3 | 0 | 0 | 111 | ||||
| 218 | E | 33.4 | Very low | 39.9 | Very low | 184 Ų | 184 | 130.8 Ų | 130.8 | 86% | 0.86 | 83% | 0.826 | S | S | * | * | trans | -88.7 | 162.1 | -143.4 | -136.5 | -173.6 | 107.9 | 0 | 0 | 118.1 | ||||
| 219 | A | 43.4 | Very low | 40.7 | Very low | 80 Ų | 80 | 131.1 Ų | 131.1 | 66% | 0.661 | 83% | 0.825 | S | S | * | * | trans | 39.9 | 96.1 | 148.3 | 0 | 0 | 0 | 0 | 0 | 120.7 | ||||
| 220 | S | 39.3 | Very low | 41.7 | Very low | 119 Ų | 119 | 127.1 Ų | 127.1 | 83% | 0.832 | 82% | 0.823 | S | S | * | * | trans | -164.4 | 150.3 | 130.1 | 39.4 | 0 | 0 | 0 | 0 | 112 | P222 | S220-P222 WeakPolarHBondContact O-CD 3.37Š| ||
| 221 | L | 41.6 | Very low | 43.5 | Very low | 169 Ų | 169 | 133.1 Ų | 133.1 | 89% | 0.885 | 82% | 0.819 | S | S | * | * | trans | -81.7 | 120.8 | -173.8 | -67.3 | 165.8 | 0 | 0 | 0 | 111.9 | S223 | L221-S223 PolarHBondContact O-N 3.31Š| ||
| 222 | P | 39.8 | Very low | 45.4 | Very low | 127 Ų | 127 | 135.9 Ų | 135.9 | 83% | 0.825 | 83% | 0.825 | S | S | * | * | trans | -78.5 | 85.4 | 171.7 | 32 | -33.3 | 0 | 0 | 0 | 110.3 | S220 G224 | S220-P222 WeakPolarHBondContact O-CD 3.37Å; P222-G224 PolarHBondContact O-N 3.11Å | ||
| 223 | S | 38.3 | Very low | 47.5 | Very low | 118 Ų | 118 | 138.8 Ų | 138.8 | 83% | 0.825 | 82% | 0.824 | S | S | * | * | trans | -59.4 | 124.9 | 173.8 | -172 | 0 | 0 | 0 | 0 | 110.9 | L221 G225 | L221-S223 PolarHBondContact O-N 3.31Å; S223-G225 PolarHBondContact O-N 3.04Å | ||
| 224 | G | 46.8 | Very low | 49.9 | Very low | 85 Ų | 85 | 139.4 Ų | 139.4 | 88% | 0.876 | 82% | 0.82 | S | S | * | * | trans | -71.6 | 90.7 | -172.2 | 0 | 0 | 0 | 0 | 0 | 113.2 | P222 | P222-G224 PolarHBondContact O-N 3.11Š| ||
| 225 | G | 40.2 | Very low | 52.7 | Low | 65 Ų | 65 | 140.2 Ų | 140.2 | 67% | 0.67 | 81% | 0.809 | S | S | * | * | trans | -125.4 | 74.2 | -178.1 | 0 | 0 | 0 | 0 | 0 | 113.4 | S223 | S223-G225 PolarHBondContact O-N 3.04Š| ||
| 226 | S | 43.9 | Very low | 55.7 | Low | 112 Ų | 112 | 141 Ų | 141 | 78% | 0.783 | 81% | 0.808 | S | S | * | * | trans | 24.2 | 112.2 | 169.2 | 64.4 | 0 | 0 | 0 | 0 | 118 | G228 | S226-G228 PolarHBondContact O-N 2.86Š| ||
| 227 | A | 48.5 | Very low | 58.6 | Low | 100 Ų | 100 | 137.8 Ų | 137.8 | 83% | 0.826 | 78% | 0.778 | S | S | * | * | trans | -69.8 | 64.7 | 163.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | K229 | A227-K229 PolarHBondContact O-N 3.24Š| ||
| 228 | G | 52.5 | Low | 61.5 | Low | 58 Ų | 58 | 131.6 Ų | 131.6 | 60% | 0.598 | 75% | 0.754 | S | S | * | * | trans | -59.8 | 128.5 | 169.2 | 0 | 0 | 0 | 0 | 0 | 109.1 | S226 S230 | S226-G228 PolarHBondContact O-N 2.86Å; G228-S230 PolarHBondContact O-N 3.08Å | ||
| 229 | K | 59.7 | Low | 64.5 | Low | 195 Ų | 195 | 127.1 Ų | 127.1 | 85% | 0.848 | 74% | 0.744 | S | S | * | * | trans | -59.3 | 108.6 | -172.5 | -77.9 | 63.3 | 173.4 | 174.3 | 0 | 108.7 | A227 R231 | A227-K229 PolarHBondContact O-N 3.24Å; K229-R231 PolarHBondContact O-N 3.42Å | ||
| 230 | S | 60.6 | Low | 67.1 | Low | 122 Ų | 122 | 130.5 Ų | 130.5 | 85% | 0.853 | 75% | 0.746 | S | S | * | * | trans | -58 | 107.7 | -170.7 | -175.1 | 0 | 0 | 0 | 0 | 110.4 | G228 R232 | G228-S230 PolarHBondContact O-N 3.08Å; S230-R232 PolarHBondContact O-N 2.94Å | ||
| 231 | R | 74.4 | Confident | 69.9 | Low | 210 Ų | 210 | 126.3 Ų | 126.3 | 79% | 0.792 | 71% | 0.713 | S | S | * | * | trans | -71.5 | 102.5 | -173.9 | -170.5 | 179.5 | -166.4 | 169.4 | 8 | 108.3 | K229 R233 | K229-R231 PolarHBondContact O-N 3.42Å; R231-R233 PolarHBondContact O-N 3.42Å; R231-R233 VanDerWaalsContact O-N 3.09Å | ||
| 232 | R | 78.4 | Confident | 72.6 | Confident | 241 Ų | 241 | 121.5 Ų | 121.5 | 91% | 0.909 | 69% | 0.688 | S | S | * | * | trans | -37.4 | 115.2 | -178.1 | -155.6 | 176.6 | -162.2 | 171.7 | 5.8 | 110.3 | S230 R234 | S230-R232 PolarHBondContact O-N 2.94Å; R232-R234 PolarHBondContact O-N 3.15Å | ||
| 233 | R | 82.1 | Confident | 75.4 | Confident | 234 Ų | 234 | 121.2 Ų | 121.2 | 88% | 0.883 | 68% | 0.679 | S | S | * | * | P | Polyproline II helix | trans | -55.1 | 132.3 | -172.4 | -64.4 | -176 | 79.1 | -130.2 | 6.4 | 109.4 | R231 T235 | R231-R233 PolarHBondContact O-N 3.42Å; R231-R233 VanDerWaalsContact O-N 3.09Å; R233-T235 PolarHBondContact O-N 2.82Å |
| 234 | R | 89.8 | Confident | 78.2 | Confident | 225 Ų | 225 | 118.8 Ų | 118.8 | 85% | 0.849 | 65% | 0.654 | S | S | * | * | P | Polyproline II helix | trans | -70.5 | 121.9 | 176 | -72.8 | 177.8 | 170.2 | 169.9 | -5.6 | 109 | R232 | R232-R234 PolarHBondContact O-N 3.15Š|
| 235 | T | 88.4 | Confident | 80.7 | Confident | 100 Ų | 100 | 114.7 Ų | 114.7 | 61% | 0.613 | 61% | 0.613 | S | S | * | * | P | Polyproline II helix | trans | -76.7 | 130.7 | 165.2 | 52.3 | 0 | 0 | 0 | 0 | 109.1 | R233 | R233-T235 PolarHBondContact O-N 2.82Š|
| 236 | A | 94.3 | Very high | 83.5 | Confident | 95 Ų | 95 | 114.8 Ų | 114.8 | 79% | 0.785 | 60% | 0.595 | S | S | * | * | P | Polyproline II helix | trans | -83.4 | 158.1 | 165 | 0 | 0 | 0 | 0 | 0 | 110.1 | ||
| 237 | F | 97.3 | Very high | 86 | Confident | 53 Ų | 53 | 114.7 Ų | 114.7 | 23% | 0.232 | 58% | 0.581 | C | S | . | * | P | Polyproline II helix | trans | -96.8 | 153.8 | 167 | -58.1 | -60.7 | 0 | 0 | 0 | 109.1 | Q241 L242 L269 Q273 W277 | F237-Q241 HydrophobicContact CB-CB 4.21Å; F237-L242 HydrophobicContact CB-CD2 4.04Å; F237-L242 HydrophobicContact CB-CG 4.07Å; F237-L242 HydrophobicContact CD2-CD2 4.19Å; F237-L269 HydrophobicContact CD1-CD1 3.87Å; F237-L269 HydrophobicContact CD1-CD2 3.76Å; F237-L269 HydrophobicContact CD1-CG 4.5Å; F237-L269 HydrophobicContact CE1-CD1 3.86Å; F237-L269 HydrophobicContact CE1-CD2 3.78Å; F237-L269 HydrophobicContact CE1-CG 4.46Å; F237-Q273 HydrophobicContact CE1-CB 4.02Å; F237-Q273 HydrophobicContact CE1-CG 4.21Å; F237-Q273 HydrophobicContact CZ-CB 4Å; F237-Q273 HydrophobicContact CZ-CG 4.27Å; F237-W277 AromaticContact CD2-CD1 3.89Å; F237-W277 AromaticContact CE2-CD1 3.76Å |
| 238 | T | 98.1 | Very high | 88.4 | Confident | 71 Ų | 71 | 112.5 Ų | 112.5 | 44% | 0.436 | 55% | 0.554 | S | S | . | * | P | Polyproline II helix | trans | -71.9 | 164.2 | 174.8 | 71.5 | 0 | 0 | 0 | 0 | 111.1 | E240 Q241 L242 | T238-E240 VanDerWaalsContact C-N 3.32Å; T238-E240 PolarHBondContact O-N 3.36Å; T238-Q241 PolarHBondContact O-N 3.45Å; T238-Q241 WeakPolarHBondContact OG1-CB 3.45Å; T238-Q241 VanDerWaalsContact OG1-CG 3.28Å; T238-Q241 WeakPolarHBondContact OG1-CG 3.45Å; T238-Q241 PolarHBondContact OG1-N 2.97Å; T238-Q241 VanDerWaalsContact OG1-N 3.13Å; T238-L242 WeakPolarHBondContact O-CG 3.35Å; T238-L242 PolarHBondContact O-N 2.91Å |
| 239 | S | 97.6 | Very high | 90.6 | Very high | 91 Ų | 91 | 109.9 Ų | 109.9 | 64% | 0.636 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -59.3 | -45.2 | 176.3 | -163.7 | 0 | 0 | 0 | 0 | 111.5 | L242 L243 | S239-L242 WeakPolarHBondContact O-CB 3.4Å; S239-L242 PolarHBondContact O-N 3.27Å; S239-L242 VanDerWaalsContact O-N 3.15Å; S239-L243 WeakPolarHBondContact O-CG 3.44Å; S239-L243 PolarHBondContact O-N 3.35Å |
| 240 | E | 97.8 | Very high | 92.4 | Very high | 151 Ų | 151 | 106.1 Ų | 106.1 | 71% | 0.706 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -56.4 | -49.7 | 174.6 | -178.9 | -174.2 | -167.8 | 0 | 0 | 112.6 | T238 L242 L243 E244 | T238-E240 VanDerWaalsContact C-N 3.32Å; T238-E240 PolarHBondContact O-N 3.36Å; E240-L242 VanDerWaalsContact C-N 3.26Å; E240-L242 PolarHBondContact O-N 3.41Å; E240-L243 PolarHBondContact O-N 3.46Å; E240-L243 VanDerWaalsContact O-N 3.15Å; E240-E244 PolarHBondContact O-N 2.89Å; E240-E244 VanDerWaalsContact O-N 3.09Å |
| 241 | Q | 98.3 | Very high | 94.1 | Very high | 31 Ų | 31 | 104.9 Ų | 104.9 | 15% | 0.145 | 50% | 0.501 | C | S | . | . | H | α-helix | trans | -58.9 | -37.7 | 175.6 | -74.4 | 173.1 | -21.6 | 0 | 0 | 112 | F237 T238 L245 L267 | F237-Q241 HydrophobicContact CB-CB 4.21Å; T238-Q241 PolarHBondContact O-N 3.45Å; T238-Q241 WeakPolarHBondContact OG1-CB 3.45Å; T238-Q241 VanDerWaalsContact OG1-CG 3.28Å; T238-Q241 WeakPolarHBondContact OG1-CG 3.45Å; T238-Q241 PolarHBondContact OG1-N 2.97Å; T238-Q241 VanDerWaalsContact OG1-N 3.13Å; Q241-L245 VanDerWaalsContact O-CB 3.3Å; Q241-L245 WeakPolarHBondContact O-CB 3.46Å; Q241-L245 VanDerWaalsContact O-CD1 3.31Å; Q241-L245 WeakPolarHBondContact O-CD1 3.48Å; Q241-L245 WeakPolarHBondContact O-CG 3.44Å; Q241-L245 PolarHBondContact O-N 2.97Å; Q241-L245 VanDerWaalsContact O-N 3.16Å; Q241-L267 HydrophobicContact CG-CB 4.33Å; Q241-L267 PolarHBondContact NE2-O 3.23Å |
| 242 | L | 98.2 | Very high | 95.2 | Very high | 67 Ų | 67 | 98.8 Ų | 98.8 | 35% | 0.351 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -70.5 | -38.5 | 176.7 | -69 | 173.1 | 0 | 0 | 0 | 112.3 | F237 T238 S239 E240 E246 W277 | F237-L242 HydrophobicContact CB-CD2 4.04Å; F237-L242 HydrophobicContact CB-CG 4.07Å; F237-L242 HydrophobicContact CD2-CD2 4.19Å; T238-L242 WeakPolarHBondContact O-CG 3.35Å; T238-L242 PolarHBondContact O-N 2.91Å; S239-L242 WeakPolarHBondContact O-CB 3.4Å; S239-L242 PolarHBondContact O-N 3.27Å; S239-L242 VanDerWaalsContact O-N 3.15Å; E240-L242 VanDerWaalsContact C-N 3.26Å; E240-L242 PolarHBondContact O-N 3.41Å; L242-E246 WeakPolarHBondContact O-CB 3.39Å; L242-E246 WeakPolarHBondContact O-CG 3.22Å; L242-E246 PolarHBondContact O-N 3.11Å; L242-W277 VanDerWaalsContact CD2-NE1 3.35Å |
| 243 | L | 98.1 | Very high | 96.2 | Very high | 121 Ų | 121 | 90.4 Ų | 90.4 | 63% | 0.634 | 45% | 0.45 | S | S | * | . | H | α-helix | trans | -63 | -48.5 | 178.3 | -73.5 | 169.4 | 0 | 0 | 0 | 111.7 | S239 E240 E246 K247 | S239-L243 WeakPolarHBondContact O-CG 3.44Å; S239-L243 PolarHBondContact O-N 3.35Å; E240-L243 PolarHBondContact O-N 3.46Å; E240-L243 VanDerWaalsContact O-N 3.15Å; L243-E246 PolarHBondContact O-N 2.85Å; L243-K247 WeakPolarHBondContact O-CB 3.23Å; L243-K247 PolarHBondContact O-N 3.03Å |
| 244 | E | 98.2 | Very high | 96.9 | Very high | 67 Ų | 67 | 86.5 Ų | 86.5 | 31% | 0.313 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -69.4 | -38.2 | -179.6 | -165.7 | 64.8 | -160.7 | 0 | 0 | 111.7 | E240 E246 K247 E248 L267 | E240-E244 PolarHBondContact O-N 2.89Å; E240-E244 VanDerWaalsContact O-N 3.09Å; E244-E246 VanDerWaalsContact C-N 3.32Å; E244-E246 PolarHBondContact O-N 2.95Å; E244-K247 VanDerWaalsContact CD-NZ 3.27Å; E244-K247 PolarHBondContact O-N 3.2Å; E244-K247 WeakPolarHBondContact OE1-CE 3.38Å; E244-K247 IonicContact OE1-NZ 3.95Å; E244-K247 PolarHBondContact OE1-NZ 3.45Å; E244-K247 VanDerWaalsContact OE2-CD 3.26Å; E244-K247 WeakPolarHBondContact OE2-CD 3.16Å; E244-K247 IonicContact OE2-NZ 2.66Å; E244-K247 PolarHBondContact OE2-NZ 3.35Å; E244-K247 VanDerWaalsContact OE2-NZ 3.07Å; E244-E248 PolarHBondContact O-N 2.82Å; E244-L267 HydrophobicContact CB-CD1 4.2Å; E244-L267 HydrophobicContact CB-CD2 3.85Å; E244-L267 HydrophobicContact CG-CD1 4.44Å; E244-L267 HydrophobicContact CG-CD2 4.01Å |
| 245 | L | 98.4 | Very high | 97.3 | Very high | 0 Ų | 0 | 77.2 Ų | 77.2 | 0% | 0 | 40% | 0.404 | C | S | . | . | H | α-helix | trans | -62.9 | -36.1 | 171.1 | -73 | 169.8 | 0 | 0 | 0 | 112.4 | Q241 F249 I263 L267 L269 V274 W277 F278 | Q241-L245 VanDerWaalsContact O-CB 3.3Å; Q241-L245 WeakPolarHBondContact O-CB 3.46Å; Q241-L245 VanDerWaalsContact O-CD1 3.31Å; Q241-L245 WeakPolarHBondContact O-CD1 3.48Å; Q241-L245 WeakPolarHBondContact O-CG 3.44Å; Q241-L245 PolarHBondContact O-N 2.97Å; Q241-L245 VanDerWaalsContact O-N 3.16Å; L245-F249 VanDerWaalsContact O-CB 3.3Å; L245-F249 WeakPolarHBondContact O-CB 3.36Å; L245-F249 PolarHBondContact O-N 3.24Å; L245-I263 HydrophobicContact CD2-CG2 3.86Å; L245-L267 HydrophobicContact CD1-CD1 4.41Å; L245-L267 HydrophobicContact CD2-CD1 3.95Å; L245-L267 HydrophobicContact CG-CD1 3.68Å; L245-L269 HydrophobicContact CD1-CD1 4.14Å; L245-V274 HydrophobicContact CD2-CG1 4.15Å; L245-W277 VanDerWaalsContact C-CH2 3.43Å; L245-W277 HydrophobicContact CB-CD2 3.98Å; L245-W277 HydrophobicContact CB-CE3 3.99Å; L245-W277 HydrophobicContact CB-CH2 3.78Å; L245-W277 HydrophobicContact CB-CZ2 3.72Å; L245-W277 HydrophobicContact CB-CZ3 3.9Å; L245-W277 HydrophobicContact CD1-CB 4.47Å; L245-W277 HydrophobicContact CD1-CD2 3.96Å; L245-W277 HydrophobicContact CD1-CG 3.87Å; L245-W277 HydrophobicContact CD2-CE3 4.38Å; L245-W277 HydrophobicContact CG-CD2 4.39Å; L245-W277 WeakPolarHBondContact O-CH2 3.47Å; L245-W277 VanDerWaalsContact O-CZ3 3.3Å; L245-W277 WeakPolarHBondContact O-CZ3 3.37Å; L245-F278 HydrophobicContact CD2-CD2 4.43Å; L245-F278 HydrophobicContact CD2-CE2 3.89Å |
| 246 | E | 98.3 | Very high | 97.8 | Very high | 66 Ų | 66 | 75 Ų | 75 | 31% | 0.308 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -71.7 | -41.7 | 173.6 | -73.1 | -150.2 | -169.7 | 0 | 0 | 112.3 | L242 L243 E244 F249 H250 W277 R281 | L242-E246 WeakPolarHBondContact O-CB 3.39Å; L242-E246 WeakPolarHBondContact O-CG 3.22Å; L242-E246 PolarHBondContact O-N 3.11Å; L243-E246 PolarHBondContact O-N 2.85Å; E244-E246 VanDerWaalsContact C-N 3.32Å; E244-E246 PolarHBondContact O-N 2.95Å; E246-F249 CarbonylContact O-C 3.59Å; E246-F249 PolarHBondContact O-N 3.5Å; E246-H250 PolarHBondContact O-N 3.37Å; E246-H250 PolarHBondContact O-ND1 2.8Å; E246-W277 HydrophobicContact CB-CH2 4.5Å; E246-W277 HydrophobicContact CG-CH2 3.8Å; E246-W277 HydrophobicContact CG-CZ2 3.69Å; E246-R281 VanDerWaalsContact CD-CZ 3.4Å; E246-R281 IonicContact OE1-CZ 2.64Å; E246-R281 IonicContact OE1-NH1 3.53Å; E246-R281 PolarHBondContact OE1-NH1 3.16Å; E246-R281 IonicContact OE1-NH2 2.66Å; E246-R281 IonicContact OE2-CZ 3.29Å; E246-R281 IonicContact OE2-NH1 3.08Å; E246-R281 PolarHBondContact OE2-NH1 3.34Å; E246-R281 IonicContact OE2-NH2 3.07Å; E246-R281 PolarHBondContact OE2-NH2 3.07Å |
| 247 | K | 98.2 | Very high | 98 | Very high | 111 Ų | 111 | 75.8 Ų | 75.8 | 48% | 0.483 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -54.9 | -54.2 | 172.9 | 172.6 | -170.4 | 166.4 | -158.2 | 0 | 111.1 | L243 E244 F249 H250 C251 | L243-K247 WeakPolarHBondContact O-CB 3.23Å; L243-K247 PolarHBondContact O-N 3.03Å; E244-K247 VanDerWaalsContact CD-NZ 3.27Å; E244-K247 PolarHBondContact O-N 3.2Å; E244-K247 WeakPolarHBondContact OE1-CE 3.38Å; E244-K247 IonicContact OE1-NZ 3.95Å; E244-K247 PolarHBondContact OE1-NZ 3.45Å; E244-K247 VanDerWaalsContact OE2-CD 3.26Å; E244-K247 WeakPolarHBondContact OE2-CD 3.16Å; E244-K247 IonicContact OE2-NZ 2.66Å; E244-K247 PolarHBondContact OE2-NZ 3.35Å; E244-K247 VanDerWaalsContact OE2-NZ 3.07Å; K247-F249 VanDerWaalsContact C-N 3.28Å; K247-F249 PolarHBondContact O-N 3.39Å; K247-H250 WeakPolarHBondContact O-CA 3.42Å; K247-H250 WeakPolarHBondContact O-CB 3.33Å; K247-H250 PolarHBondContact O-N 3.25Å; K247-C251 PolarHBondContact O-N 3.29Å; K247-C251 PolarHBondContact O-SG 3.05Å |
| 248 | E | 98.1 | Very high | 98 | Very high | 54 Ų | 54 | 77.7 Ų | 77.7 | 25% | 0.252 | 40% | 0.399 | S | S | . | . | H | α-helix | trans | -62.1 | -34.9 | 178.1 | -75.7 | -79.1 | 46.4 | 0 | 0 | 112.6 | E244 H250 C251 K252 I263 F278 | E244-E248 PolarHBondContact O-N 2.82Å; E248-H250 VanDerWaalsContact C-N 3.32Å; E248-H250 PolarHBondContact O-N 3.36Å; E248-C251 PolarHBondContact O-N 2.86Å; E248-K252 PolarHBondContact O-N 2.64Å; E248-I263 HydrophobicContact CB-CD1 4.1Å; E248-I263 HydrophobicContact CG-CD1 3.87Å; E248-I263 HydrophobicContact CG-CG1 4.2Å; E248-I263 WeakPolarHBondContact OE2-CD1 3.39Å; E248-I263 WeakPolarHBondContact OE2-CG1 3.13Å; E248-F278 HydrophobicContact CB-CZ 4.16Å |
| 249 | F | 98.4 | Very high | 98 | Very high | 3 Ų | 3 | 76.8 Ų | 76.8 | 1% | 0.013 | 39% | 0.39 | C | S | . | . | H | α-helix | trans | -68.1 | -28.3 | 171.6 | -175.2 | -95 | 0 | 0 | 0 | 113.6 | L245 E246 K247 K253 W277 F278 R281 R282 W285 | L245-F249 VanDerWaalsContact O-CB 3.3Å; L245-F249 WeakPolarHBondContact O-CB 3.36Å; L245-F249 PolarHBondContact O-N 3.24Å; E246-F249 CarbonylContact O-C 3.59Å; E246-F249 PolarHBondContact O-N 3.5Å; K247-F249 VanDerWaalsContact C-N 3.28Å; K247-F249 PolarHBondContact O-N 3.39Å; F249-K253 HydrophobicContact CD1-CD 4.5Å; F249-K253 HydrophobicContact CE1-CD 4Å; F249-K253 HydrophobicContact CE2-CB 4.14Å; F249-K253 HydrophobicContact CE2-CD 4.19Å; F249-K253 HydrophobicContact CZ-CB 4.42Å; F249-K253 HydrophobicContact CZ-CD 3.83Å; F249-K253 WeakPolarHBondContact O-CD 3.49Å; F249-K253 PolarHBondContact O-NZ 3.41Å; F249-W277 HydrophobicContact CB-CH2 4.13Å; F249-W277 HydrophobicContact CB-CZ3 3.97Å; F249-W277 HydrophobicContact CG-CZ3 4.42Å; F249-F278 HydrophobicContact CB-CE1 4.07Å; F249-F278 HydrophobicContact CB-CZ 4.19Å; F249-F278 AromaticContact CD2-CD1 3.89Å; F249-F278 HydrophobicContact CD2-CD1 3.89Å; F249-F278 AromaticContact CD2-CE1 3.83Å; F249-F278 HydrophobicContact CD2-CE1 3.83Å; F249-F278 HydrophobicContact CG-CE1 4.47Å; F249-R281 HydrophobicContact CB-CG 4.23Å; F249-R281 HydrophobicContact CD1-CG 3.52Å; F249-R281 HydrophobicContact CD2-CB 4.17Å; F249-R281 HydrophobicContact CD2-CG 3.48Å; F249-R281 VanDerWaalsContact CD2-CG 3.48Å; F249-R281 HydrophobicContact CE1-CG 3.66Å; F249-R281 HydrophobicContact CE2-CB 4.22Å; F249-R281 HydrophobicContact CE2-CG 3.63Å; F249-R281 HydrophobicContact CG-CG 3.43Å; F249-R281 VanDerWaalsContact CG-CG 3.43Å; F249-R281 HydrophobicContact CZ-CG 3.72Å; F249-R282 HydrophobicContact CE2-CG 3.76Å; F249-R282 HydrophobicContact CZ-CG 4.3Å; F249-W285 HydrophobicContact CE1-CB 4.37Å; F249-W285 HydrophobicContact CE1-CG 4.42Å; F249-W285 HydrophobicContact CZ-CB 4.12Å; F249-W285 HydrophobicContact CZ-CG 4.28Å |
| 250 | H | 97.7 | Very high | 98 | Very high | 116 Ų | 116 | 74.7 Ų | 74.7 | 54% | 0.537 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -70.2 | -43.3 | 172.3 | -70.3 | 104.3 | 0 | 0 | 0 | 110.5 | E246 K247 E248 K253 | E246-H250 PolarHBondContact O-N 3.37Å; E246-H250 PolarHBondContact O-ND1 2.8Å; K247-H250 WeakPolarHBondContact O-CA 3.42Å; K247-H250 WeakPolarHBondContact O-CB 3.33Å; K247-H250 PolarHBondContact O-N 3.25Å; E248-H250 VanDerWaalsContact C-N 3.32Å; E248-H250 PolarHBondContact O-N 3.36Å; H250-K253 PolarHBondContact O-NZ 3.45Å |
| 251 | C | 97.4 | Very high | 98.1 | Very high | 95 Ų | 95 | 69.1 Ų | 69.1 | 64% | 0.642 | 35% | 0.345 | S | S | * | . | H | α-helix | trans | -59.2 | -53.4 | 172.1 | -57.7 | 0 | 0 | 0 | 0 | 112.3 | K247 E248 | K247-C251 PolarHBondContact O-N 3.29Å; K247-C251 PolarHBondContact O-SG 3.05Å; E248-C251 PolarHBondContact O-N 2.86Å |
| 252 | K | 97.3 | Very high | 98.1 | Very high | 82 Ų | 82 | 73.5 Ų | 73.5 | 36% | 0.357 | 37% | 0.366 | S | S | . | . | trans | -145 | 130.3 | -175.1 | -156.4 | 172.8 | 46.6 | -94.4 | 0 | 113.3 | E248 Y254 E259 | E248-K252 PolarHBondContact O-N 2.64Å; K252-Y254 VanDerWaalsContact C-N 3.34Å; K252-Y254 WeakPolarHBondContact CD-O 3.26Å; K252-Y254 WeakPolarHBondContact CE-O 3.39Å; K252-Y254 VanDerWaalsContact CG-O 3.24Å; K252-Y254 WeakPolarHBondContact CG-O 3.49Å; K252-Y254 PolarHBondContact O-N 3.49Å; K252-E259 WeakPolarHBondContact CE-OE1 3.5Å; K252-E259 WeakPolarHBondContact CE-OE2 3.3Å; K252-E259 IonicContact NZ-OE1 2.87Å; K252-E259 PolarHBondContact NZ-OE1 3.02Å; K252-E259 IonicContact NZ-OE2 3.91Å; K252-E259 PolarHBondContact NZ-OE2 3.32Å | ||
| 253 | K | 97.5 | Very high | 98.1 | Very high | 65 Ų | 65 | 70.7 Ų | 70.7 | 28% | 0.283 | 35% | 0.351 | S | S | . | . | S | Bend | trans | -77.5 | -18.7 | -174.3 | -43.3 | -54.8 | 155.3 | -156.4 | 0 | 113.7 | F249 H250 R282 | F249-K253 HydrophobicContact CD1-CD 4.5Å; F249-K253 HydrophobicContact CE1-CD 4Å; F249-K253 HydrophobicContact CE2-CB 4.14Å; F249-K253 HydrophobicContact CE2-CD 4.19Å; F249-K253 HydrophobicContact CZ-CB 4.42Å; F249-K253 HydrophobicContact CZ-CD 3.83Å; F249-K253 WeakPolarHBondContact O-CD 3.49Å; F249-K253 PolarHBondContact O-NZ 3.41Å; H250-K253 PolarHBondContact O-NZ 3.45Å; K253-R282 VanDerWaalsContact O-CD 3.27Å; K253-R282 WeakPolarHBondContact O-CD 3.47Å; K253-R282 WeakPolarHBondContact O-CG 3.49Å; K253-R282 PolarHBondContact O-NH1 3.02Å |
| 254 | Y | 98.1 | Very high | 98.1 | Very high | 153 Ų | 153 | 65.2 Ų | 65.2 | 60% | 0.6 | 32% | 0.323 | S | S | * | . | S | Bend | trans | -131.3 | 147 | 179.5 | -61.7 | -95.2 | 0 | 0 | 0 | 108.5 | K252 R282 | K252-Y254 VanDerWaalsContact C-N 3.34Å; K252-Y254 WeakPolarHBondContact CD-O 3.26Å; K252-Y254 WeakPolarHBondContact CE-O 3.39Å; K252-Y254 VanDerWaalsContact CG-O 3.24Å; K252-Y254 WeakPolarHBondContact CG-O 3.49Å; K252-Y254 PolarHBondContact O-N 3.49Å; Y254-R282 VanDerWaalsContact CD1-CZ 3.45Å |
| 255 | L | 98 | Very high | 98.1 | Very high | 30 Ų | 30 | 68.3 Ų | 68.3 | 16% | 0.157 | 34% | 0.338 | C | S | . | . | trans | -116.3 | 143.4 | 178.3 | -62.1 | 175.8 | 0 | 0 | 0 | 109.5 | E259 R260 I263 V274 F278 | L255-E259 WeakPolarHBondContact CA-OE2 3Å; L255-E259 HydrophobicContact CB-CB 4.45Å; L255-E259 HydrophobicContact CD2-CB 4.25Å; L255-R260 HydrophobicContact CB-CB 4.38Å; L255-R260 HydrophobicContact CD1-CB 4.35Å; L255-R260 HydrophobicContact CD1-CG 4.5Å; L255-I263 HydrophobicContact CD1-CD1 3.65Å; L255-I263 HydrophobicContact CD2-CD1 3.78Å; L255-I263 HydrophobicContact CG-CD1 4.37Å; L255-V274 HydrophobicContact CD1-CG1 3.86Å; L255-F278 HydrophobicContact CD1-CD1 4.15Å; L255-F278 HydrophobicContact CD1-CD2 3.75Å; L255-F278 HydrophobicContact CD1-CE1 3.94Å; L255-F278 HydrophobicContact CD1-CE2 3.55Å; L255-F278 HydrophobicContact CD1-CG 4.07Å; L255-F278 HydrophobicContact CD1-CZ 3.65Å; L255-F278 HydrophobicContact CD2-CE1 4.03Å; L255-F278 HydrophobicContact CD2-CZ 4.06Å; L255-F278 HydrophobicContact CG-CD1 3.98Å; L255-F278 HydrophobicContact CG-CD2 4.48Å; L255-F278 HydrophobicContact CG-CE1 3.72Å; L255-F278 HydrophobicContact CG-CE2 4.27Å; L255-F278 HydrophobicContact CG-CG 4.36Å; L255-F278 HydrophobicContact CG-CZ 3.89Å | ||
| 256 | S | 98.3 | Very high | 98.1 | Very high | 54 Ų | 54 | 71.6 Ų | 71.6 | 38% | 0.378 | 37% | 0.365 | S | S | . | . | trans | -66.6 | -169.1 | 167.8 | 79.8 | 0 | 0 | 0 | 0 | 111.3 | T258 E259 R260 | S256-T258 PolarHBondContact OG-N 2.94Å; S256-E259 PolarHBondContact N-OE2 2.76Å; S256-E259 VanDerWaalsContact OG-CG 3.26Å; S256-E259 WeakPolarHBondContact OG-CG 3.29Å; S256-E259 PolarHBondContact OG-N 2.92Å; S256-E259 PolarHBondContact OG-OE2 3.18Å; S256-R260 WeakPolarHBondContact O-CB 3.07Å; S256-R260 PolarHBondContact O-NH2 3.17Å | ||
| 257 | L | 98.1 | Very high | 98 | Very high | 111 Ų | 111 | 69.5 Ų | 69.5 | 58% | 0.581 | 36% | 0.355 | S | S | * | . | H | α-helix | trans | -74 | -53.4 | 169.5 | -177.1 | 59 | 0 | 0 | 0 | 110.6 | E259 R260 S261 | L257-E259 PolarHBondContact O-N 2.98Å; L257-R260 WeakPolarHBondContact O-CB 3.48Å; L257-R260 PolarHBondContact O-N 3.23Å; L257-S261 PolarHBondContact O-N 2.8Å; L257-S261 VanDerWaalsContact O-N 3.08Å |
| 258 | T | 98.2 | Very high | 98 | Very high | 92 Ų | 92 | 72.5 Ų | 72.5 | 56% | 0.564 | 37% | 0.369 | S | S | * | . | H | α-helix | trans | -57.7 | -48 | -175.9 | -41.2 | 0 | 0 | 0 | 0 | 112.6 | S256 R260 S261 Q262 | S256-T258 PolarHBondContact OG-N 2.94Å; T258-R260 VanDerWaalsContact C-N 3.34Å; T258-R260 PolarHBondContact O-N 2.82Å; T258-S261 WeakPolarHBondContact O-CB 3.39Å; T258-S261 PolarHBondContact O-N 2.91Å; T258-S261 VanDerWaalsContact O-N 3.15Å; T258-Q262 WeakPolarHBondContact O-CG 3.36Å; T258-Q262 PolarHBondContact O-N 3.26Å |
| 259 | E | 98.1 | Very high | 98 | Very high | 53 Ų | 53 | 71 Ų | 71 | 25% | 0.248 | 36% | 0.362 | C | S | . | . | H | α-helix | trans | -63.8 | -39.4 | -179.3 | -62.1 | 167.5 | 149.4 | 0 | 0 | 112 | K252 L255 S256 L257 S261 Q262 I263 | K252-E259 WeakPolarHBondContact CE-OE1 3.5Å; K252-E259 WeakPolarHBondContact CE-OE2 3.3Å; K252-E259 IonicContact NZ-OE1 2.87Å; K252-E259 PolarHBondContact NZ-OE1 3.02Å; K252-E259 IonicContact NZ-OE2 3.91Å; K252-E259 PolarHBondContact NZ-OE2 3.32Å; L255-E259 WeakPolarHBondContact CA-OE2 3Å; L255-E259 HydrophobicContact CB-CB 4.45Å; L255-E259 HydrophobicContact CD2-CB 4.25Å; S256-E259 PolarHBondContact N-OE2 2.76Å; S256-E259 VanDerWaalsContact OG-CG 3.26Å; S256-E259 WeakPolarHBondContact OG-CG 3.29Å; S256-E259 PolarHBondContact OG-N 2.92Å; S256-E259 PolarHBondContact OG-OE2 3.18Å; L257-E259 PolarHBondContact O-N 2.98Å; E259-S261 VanDerWaalsContact C-N 3.29Å; E259-S261 PolarHBondContact O-N 3.11Å; E259-Q262 PolarHBondContact O-N 3.08Å; E259-I263 WeakPolarHBondContact O-CB 3.31Å; E259-I263 WeakPolarHBondContact O-CD1 3.24Å; E259-I263 VanDerWaalsContact O-CG1 3.3Å; E259-I263 WeakPolarHBondContact O-CG1 3.46Å; E259-I263 PolarHBondContact O-N 3.48Å |
| 260 | R | 98.5 | Very high | 98 | Very high | 47 Ų | 47 | 73.5 Ų | 73.5 | 18% | 0.177 | 38% | 0.38 | C | S | . | . | H | α-helix | trans | -64.7 | -37.8 | 176.6 | -168.4 | -160.2 | -45.8 | 129.2 | 13.1 | 111.2 | L255 S256 L257 T258 A264 E271 V274 | L255-R260 HydrophobicContact CB-CB 4.38Å; L255-R260 HydrophobicContact CD1-CB 4.35Å; L255-R260 HydrophobicContact CD1-CG 4.5Å; S256-R260 WeakPolarHBondContact O-CB 3.07Å; S256-R260 PolarHBondContact O-NH2 3.17Å; L257-R260 WeakPolarHBondContact O-CB 3.48Å; L257-R260 PolarHBondContact O-N 3.23Å; T258-R260 VanDerWaalsContact C-N 3.34Å; T258-R260 PolarHBondContact O-N 2.82Å; R260-A264 WeakPolarHBondContact O-CB 3.47Å; R260-A264 PolarHBondContact O-N 2.97Å; R260-E271 WeakPolarHBondContact CD-O 3.47Å; R260-E271 WeakPolarHBondContact CD-OE2 3.46Å; R260-E271 HydrophobicContact CG-CB 4.36Å; R260-E271 HydrophobicContact CG-CG 4.16Å; R260-E271 IonicContact CZ-OE2 3.76Å; R260-E271 IonicContact NH1-OE2 2.86Å; R260-E271 PolarHBondContact NH1-OE2 3.26Å; R260-V274 HydrophobicContact CG-CB 4.03Å; R260-V274 HydrophobicContact CG-CG1 3.86Å |
| 261 | S | 98.6 | Very high | 98 | Very high | 33 Ų | 33 | 70.8 Ų | 70.8 | 23% | 0.231 | 37% | 0.368 | C | S | . | . | H | α-helix | trans | -65.8 | -47.5 | 175.3 | -153 | 0 | 0 | 0 | 0 | 110.8 | L257 T258 E259 I263 A264 H265 E271 | L257-S261 PolarHBondContact O-N 2.8Å; L257-S261 VanDerWaalsContact O-N 3.08Å; T258-S261 WeakPolarHBondContact O-CB 3.39Å; T258-S261 PolarHBondContact O-N 2.91Å; T258-S261 VanDerWaalsContact O-N 3.15Å; E259-S261 VanDerWaalsContact C-N 3.29Å; E259-S261 PolarHBondContact O-N 3.11Å; S261-I263 PolarHBondContact O-N 3.18Å; S261-A264 WeakPolarHBondContact O-CB 3.49Å; S261-A264 PolarHBondContact O-N 3.17Å; S261-H265 PolarHBondContact O-CD2 3.36Å; S261-H265 PolarHBondContact O-N 3.22Å; S261-E271 PolarHBondContact OG-OE1 3.38Å |
| 262 | Q | 98.4 | Very high | 98 | Very high | 123 Ų | 123 | 70.7 Ų | 70.7 | 58% | 0.575 | 36% | 0.363 | S | S | * | . | H | α-helix | trans | -55.4 | -51.7 | 175 | -70.3 | 166.3 | -13.9 | 0 | 0 | 112.2 | T258 E259 A264 H265 A266 | T258-Q262 WeakPolarHBondContact O-CG 3.36Å; T258-Q262 PolarHBondContact O-N 3.26Å; E259-Q262 PolarHBondContact O-N 3.08Å; Q262-A264 VanDerWaalsContact C-N 3.33Å; Q262-A264 PolarHBondContact O-N 3.46Å; Q262-H265 PolarHBondContact O-N 3.39Å; Q262-A266 WeakPolarHBondContact O-CB 3.45Å; Q262-A266 PolarHBondContact O-N 3.29Å |
| 263 | I | 98.1 | Very high | 98.1 | Very high | 8 Ų | 8 | 69.4 Ų | 69.4 | 4% | 0.041 | 36% | 0.359 | C | S | . | . | H | α-helix | trans | -62.5 | -38.8 | 178.2 | -66.8 | 163.3 | 0 | 0 | 0 | 111.4 | L245 E248 L255 E259 S261 L267 V274 | L245-I263 HydrophobicContact CD2-CG2 3.86Å; E248-I263 HydrophobicContact CB-CD1 4.1Å; E248-I263 HydrophobicContact CG-CD1 3.87Å; E248-I263 HydrophobicContact CG-CG1 4.2Å; E248-I263 WeakPolarHBondContact OE2-CD1 3.39Å; E248-I263 WeakPolarHBondContact OE2-CG1 3.13Å; L255-I263 HydrophobicContact CD1-CD1 3.65Å; L255-I263 HydrophobicContact CD2-CD1 3.78Å; L255-I263 HydrophobicContact CG-CD1 4.37Å; E259-I263 WeakPolarHBondContact O-CB 3.31Å; E259-I263 WeakPolarHBondContact O-CD1 3.24Å; E259-I263 VanDerWaalsContact O-CG1 3.3Å; E259-I263 WeakPolarHBondContact O-CG1 3.46Å; E259-I263 PolarHBondContact O-N 3.48Å; S261-I263 PolarHBondContact O-N 3.18Å; I263-L267 HydrophobicContact CG2-CD1 3.91Å; I263-L267 HydrophobicContact CG2-CG 4.49Å; I263-L267 WeakPolarHBondContact O-CB 3.27Å; I263-L267 WeakPolarHBondContact O-CG 3.15Å; I263-L267 PolarHBondContact O-N 3.26Å; I263-V274 HydrophobicContact CG2-CG1 4.04Å; I263-V274 HydrophobicContact CG2-CG2 4.28Å |
| 264 | A | 98.4 | Very high | 98.1 | Very high | 6 Ų | 6 | 66.3 Ų | 66.3 | 5% | 0.05 | 35% | 0.345 | C | S | . | . | H | α-helix | trans | -62.9 | -46.5 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112 | R260 S261 Q262 K268 L269 E271 V274 | R260-A264 WeakPolarHBondContact O-CB 3.47Å; R260-A264 PolarHBondContact O-N 2.97Å; S261-A264 WeakPolarHBondContact O-CB 3.49Å; S261-A264 PolarHBondContact O-N 3.17Å; Q262-A264 VanDerWaalsContact C-N 3.33Å; Q262-A264 PolarHBondContact O-N 3.46Å; A264-K268 WeakPolarHBondContact O-CA 3.48Å; A264-K268 PolarHBondContact O-N 3.36Å; A264-L269 CarbonylContact C-O 3.53Å; A264-L269 WeakPolarHBondContact CB-O 3.41Å; A264-L269 PolarHBondContact O-N 3.42Å; A264-E271 HydrophobicContact CB-CG 4.08Å; A264-V274 HydrophobicContact CB-CG2 4.1Å |
| 265 | H | 98.3 | Very high | 98.1 | Very high | 133 Ų | 133 | 64.2 Ų | 64.2 | 62% | 0.616 | 34% | 0.34 | S | S | * | . | H | α-helix | trans | -66.9 | -36 | 177.5 | -79.5 | -68.2 | 0 | 0 | 0 | 113.5 | S261 Q262 K268 | S261-H265 PolarHBondContact O-CD2 3.36Å; S261-H265 PolarHBondContact O-N 3.22Å; Q262-H265 PolarHBondContact O-N 3.39Å; H265-K268 WeakPolarHBondContact O-CD 3.28Å; H265-K268 PolarHBondContact O-NZ 3.17Å |
| 266 | A | 97.9 | Very high | 98.1 | Very high | 69 Ų | 69 | 66.7 Ų | 66.7 | 57% | 0.57 | 35% | 0.352 | S | S | * | . | H | α-helix | trans | -64.4 | -55.5 | 173.9 | 0 | 0 | 0 | 0 | 0 | 110.9 | Q262 K268 | Q262-A266 WeakPolarHBondContact O-CB 3.45Å; Q262-A266 PolarHBondContact O-N 3.29Å; A266-K268 VanDerWaalsContact C-N 3.3Å; A266-K268 PolarHBondContact O-N 3.25Å |
| 267 | L | 97.5 | Very high | 98.1 | Very high | 21 Ų | 21 | 65.4 Ų | 65.4 | 11% | 0.11 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -83.4 | 1.3 | -171.7 | -61.9 | -177 | 0 | 0 | 0 | 115.2 | Q241 E244 L245 I263 L269 | Q241-L267 HydrophobicContact CG-CB 4.33Å; Q241-L267 PolarHBondContact NE2-O 3.23Å; E244-L267 HydrophobicContact CB-CD1 4.2Å; E244-L267 HydrophobicContact CB-CD2 3.85Å; E244-L267 HydrophobicContact CG-CD1 4.44Å; E244-L267 HydrophobicContact CG-CD2 4.01Å; L245-L267 HydrophobicContact CD1-CD1 4.41Å; L245-L267 HydrophobicContact CD2-CD1 3.95Å; L245-L267 HydrophobicContact CG-CD1 3.68Å; I263-L267 HydrophobicContact CG2-CD1 3.91Å; I263-L267 HydrophobicContact CG2-CG 4.49Å; I263-L267 WeakPolarHBondContact O-CB 3.27Å; I263-L267 WeakPolarHBondContact O-CG 3.15Å; I263-L267 PolarHBondContact O-N 3.26Å; L267-L269 HydrophobicContact CB-CD1 4.23Å; L267-L269 HydrophobicContact CB-CG 4.13Å; L267-L269 PolarHBondContact O-N 3.21Å |
| 268 | K | 98.1 | Very high | 98.1 | Very high | 175 Ų | 175 | 60.3 Ų | 60.3 | 76% | 0.761 | 31% | 0.312 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 54.6 | 40.6 | -174.8 | -46.1 | -54.4 | 170.2 | -160.4 | 0 | 112.5 | A264 H265 A266 | A264-K268 WeakPolarHBondContact O-CA 3.48Å; A264-K268 PolarHBondContact O-N 3.36Å; H265-K268 WeakPolarHBondContact O-CD 3.28Å; H265-K268 PolarHBondContact O-NZ 3.17Å; A266-K268 VanDerWaalsContact C-N 3.3Å; A266-K268 PolarHBondContact O-N 3.25Å |
| 269 | L | 97.3 | Very high | 98.1 | Very high | 23 Ų | 23 | 60.5 Ų | 60.5 | 12% | 0.12 | 31% | 0.306 | C | S | . | . | trans | -110.5 | 161.3 | 175.5 | -64.5 | -177.6 | 0 | 0 | 0 | 110.3 | F237 L245 A264 L267 Q273 V274 | F237-L269 HydrophobicContact CD1-CD1 3.87Å; F237-L269 HydrophobicContact CD1-CD2 3.76Å; F237-L269 HydrophobicContact CD1-CG 4.5Å; F237-L269 HydrophobicContact CE1-CD1 3.86Å; F237-L269 HydrophobicContact CE1-CD2 3.78Å; F237-L269 HydrophobicContact CE1-CG 4.46Å; L245-L269 HydrophobicContact CD1-CD1 4.14Å; A264-L269 CarbonylContact C-O 3.53Å; A264-L269 WeakPolarHBondContact CB-O 3.41Å; A264-L269 PolarHBondContact O-N 3.42Å; L267-L269 HydrophobicContact CB-CD1 4.23Å; L267-L269 HydrophobicContact CB-CG 4.13Å; L267-L269 PolarHBondContact O-N 3.21Å; L269-Q273 HydrophobicContact CB-CB 4.49Å; L269-V274 HydrophobicContact CB-CG2 4.22Å | ||
| 270 | S | 98.2 | Very high | 98.1 | Very high | 54 Ų | 54 | 62.8 Ų | 62.8 | 38% | 0.378 | 32% | 0.32 | S | S | . | . | trans | -77.4 | 148 | 165.9 | 63.6 | 0 | 0 | 0 | 0 | 111.1 | V272 Q273 V274 | S270-V272 PolarHBondContact O-N 3.44Å; S270-V272 VanDerWaalsContact O-N 3.1Å; S270-Q273 WeakPolarHBondContact O-CB 3.24Å; S270-Q273 PolarHBondContact O-N 2.77Å; S270-Q273 WeakPolarHBondContact OG-CG 3.47Å; S270-Q273 PolarHBondContact OG-N 3.4Å; S270-Q273 PolarHBondContact OG-OE1 3.22Å; S270-V274 PolarHBondContact O-N 3.3Å; S270-V274 VanDerWaalsContact O-N 3.11Å | ||
| 271 | E | 98.2 | Very high | 98.1 | Very high | 60 Ų | 60 | 62.2 Ų | 62.2 | 28% | 0.28 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -50.5 | -34.9 | 170.1 | -85.3 | -164.6 | -134.3 | 0 | 0 | 112.9 | R260 S261 A264 V274 K275 | R260-E271 WeakPolarHBondContact CD-O 3.47Å; R260-E271 WeakPolarHBondContact CD-OE2 3.46Å; R260-E271 HydrophobicContact CG-CB 4.36Å; R260-E271 HydrophobicContact CG-CG 4.16Å; R260-E271 IonicContact CZ-OE2 3.76Å; R260-E271 IonicContact NH1-OE2 2.86Å; R260-E271 PolarHBondContact NH1-OE2 3.26Å; S261-E271 PolarHBondContact OG-OE1 3.38Å; A264-E271 HydrophobicContact CB-CG 4.08Å; E271-V274 PolarHBondContact O-N 3.37Å; E271-K275 VanDerWaalsContact O-CB 3.23Å; E271-K275 WeakPolarHBondContact O-CB 3.3Å; E271-K275 PolarHBondContact O-N 2.99Å |
| 272 | V | 97.9 | Very high | 98 | Very high | 92 Ų | 92 | 63.3 Ų | 63.3 | 56% | 0.558 | 32% | 0.317 | S | S | * | . | H | α-helix | trans | -65.7 | -39.8 | 178.2 | -179 | 0 | 0 | 0 | 0 | 111.1 | S270 I276 | S270-V272 PolarHBondContact O-N 3.44Å; S270-V272 VanDerWaalsContact O-N 3.1Å; V272-I276 HydrophobicContact CG1-CD1 3.83Å; V272-I276 WeakPolarHBondContact O-CB 3.21Å; V272-I276 WeakPolarHBondContact O-CD1 3.39Å; V272-I276 WeakPolarHBondContact O-CG1 3.3Å; V272-I276 PolarHBondContact O-N 2.95Å |
| 273 | Q | 97.8 | Very high | 98 | Very high | 55 Ų | 55 | 59.2 Ų | 59.2 | 26% | 0.257 | 31% | 0.305 | S | S | . | . | H | α-helix | trans | -65.3 | -45 | 173.3 | -76.4 | 160.3 | -59.8 | 0 | 0 | 111.5 | F237 L269 S270 I276 W277 | F237-Q273 HydrophobicContact CE1-CB 4.02Å; F237-Q273 HydrophobicContact CE1-CG 4.21Å; F237-Q273 HydrophobicContact CZ-CB 4Å; F237-Q273 HydrophobicContact CZ-CG 4.27Å; L269-Q273 HydrophobicContact CB-CB 4.49Å; S270-Q273 WeakPolarHBondContact O-CB 3.24Å; S270-Q273 PolarHBondContact O-N 2.77Å; S270-Q273 WeakPolarHBondContact OG-CG 3.47Å; S270-Q273 PolarHBondContact OG-N 3.4Å; S270-Q273 PolarHBondContact OG-OE1 3.22Å; Q273-I276 PolarHBondContact O-N 3.47Å; Q273-W277 WeakPolarHBondContact O-CB 3.3Å; Q273-W277 PolarHBondContact O-N 3.44Å |
| 274 | V | 98.2 | Very high | 97.8 | Very high | 0 Ų | 0 | 64 Ų | 64 | 0% | 0 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -61 | -46.4 | 176.5 | -178.8 | 0 | 0 | 0 | 0 | 110.7 | L245 L255 R260 I263 A264 L269 S270 E271 I276 W277 F278 | L245-V274 HydrophobicContact CD2-CG1 4.15Å; L255-V274 HydrophobicContact CD1-CG1 3.86Å; R260-V274 HydrophobicContact CG-CB 4.03Å; R260-V274 HydrophobicContact CG-CG1 3.86Å; I263-V274 HydrophobicContact CG2-CG1 4.04Å; I263-V274 HydrophobicContact CG2-CG2 4.28Å; A264-V274 HydrophobicContact CB-CG2 4.1Å; L269-V274 HydrophobicContact CB-CG2 4.22Å; S270-V274 PolarHBondContact O-N 3.3Å; S270-V274 VanDerWaalsContact O-N 3.11Å; E271-V274 PolarHBondContact O-N 3.37Å; V274-I276 PolarHBondContact O-N 3.47Å; V274-W277 PolarHBondContact O-N 3.31Å; V274-F278 HydrophobicContact CG1-CD2 3.96Å; V274-F278 HydrophobicContact CG1-CE2 4.18Å; V274-F278 WeakPolarHBondContact O-CD2 3.31Å; V274-F278 PolarHBondContact O-N 3.06Å |
| 275 | K | 98.1 | Very high | 97.7 | Very high | 110 Ų | 110 | 69.6 Ų | 69.6 | 48% | 0.478 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -56.4 | -48.6 | 175.4 | -179.1 | 175.6 | 178.9 | 176.1 | 0 | 112.1 | E271 F278 Q279 | E271-K275 VanDerWaalsContact O-CB 3.23Å; E271-K275 WeakPolarHBondContact O-CB 3.3Å; E271-K275 PolarHBondContact O-N 2.99Å; K275-F278 PolarHBondContact O-N 3.45Å; K275-Q279 VanDerWaalsContact O-CG 3.29Å; K275-Q279 WeakPolarHBondContact O-CG 3.39Å; K275-Q279 PolarHBondContact O-N 3.47Å |
| 276 | I | 98.1 | Very high | 97.5 | Very high | 82 Ų | 82 | 70.4 Ų | 70.4 | 42% | 0.421 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -66.3 | -40.7 | 178.7 | -71.7 | 168.6 | 0 | 0 | 0 | 111 | V272 Q273 V274 Q279 N280 | V272-I276 HydrophobicContact CG1-CD1 3.83Å; V272-I276 WeakPolarHBondContact O-CB 3.21Å; V272-I276 WeakPolarHBondContact O-CD1 3.39Å; V272-I276 WeakPolarHBondContact O-CG1 3.3Å; V272-I276 PolarHBondContact O-N 2.95Å; Q273-I276 PolarHBondContact O-N 3.47Å; V274-I276 PolarHBondContact O-N 3.47Å; I276-Q279 PolarHBondContact O-N 2.93Å; I276-N280 WeakPolarHBondContact CG2-ND2 3.26Å; I276-N280 WeakPolarHBondContact O-CB 3.42Å; I276-N280 PolarHBondContact O-N 3.44Å; I276-N280 PolarHBondContact O-ND2 2.89Å |
| 277 | W | 98.2 | Very high | 97.3 | Very high | 26 Ų | 26 | 74 Ų | 74 | 10% | 0.098 | 35% | 0.346 | C | S | . | . | H | α-helix | trans | -62.6 | -47.9 | 176.9 | -172.4 | 105.5 | 0 | 0 | 0 | 110.9 | F237 L242 L245 E246 F249 Q273 V274 Q279 N280 R281 | F237-W277 AromaticContact CD2-CD1 3.89Å; F237-W277 AromaticContact CE2-CD1 3.76Å; L242-W277 VanDerWaalsContact CD2-NE1 3.35Å; L245-W277 VanDerWaalsContact C-CH2 3.43Å; L245-W277 HydrophobicContact CB-CD2 3.98Å; L245-W277 HydrophobicContact CB-CE3 3.99Å; L245-W277 HydrophobicContact CB-CH2 3.78Å; L245-W277 HydrophobicContact CB-CZ2 3.72Å; L245-W277 HydrophobicContact CB-CZ3 3.9Å; L245-W277 HydrophobicContact CD1-CB 4.47Å; L245-W277 HydrophobicContact CD1-CD2 3.96Å; L245-W277 HydrophobicContact CD1-CG 3.87Å; L245-W277 HydrophobicContact CD2-CE3 4.38Å; L245-W277 HydrophobicContact CG-CD2 4.39Å; L245-W277 WeakPolarHBondContact O-CH2 3.47Å; L245-W277 VanDerWaalsContact O-CZ3 3.3Å; L245-W277 WeakPolarHBondContact O-CZ3 3.37Å; E246-W277 HydrophobicContact CB-CH2 4.5Å; E246-W277 HydrophobicContact CG-CH2 3.8Å; E246-W277 HydrophobicContact CG-CZ2 3.69Å; F249-W277 HydrophobicContact CB-CH2 4.13Å; F249-W277 HydrophobicContact CB-CZ3 3.97Å; F249-W277 HydrophobicContact CG-CZ3 4.42Å; Q273-W277 WeakPolarHBondContact O-CB 3.3Å; Q273-W277 PolarHBondContact O-N 3.44Å; V274-W277 PolarHBondContact O-N 3.31Å; W277-Q279 PolarHBondContact O-N 3.27Å; W277-N280 PolarHBondContact O-N 3.22Å; W277-R281 HydrophobicContact CD2-CB 4.49Å; W277-R281 HydrophobicContact CE3-CB 3.94Å; W277-R281 HydrophobicContact CE3-CG 4.47Å; W277-R281 HydrophobicContact CH2-CB 3.94Å; W277-R281 HydrophobicContact CH2-CG 3.64Å; W277-R281 HydrophobicContact CZ2-CG 4.43Å; W277-R281 HydrophobicContact CZ3-CB 3.64Å; W277-R281 HydrophobicContact CZ3-CG 3.68Å; W277-R281 WeakPolarHBondContact O-CB 3.36Å; W277-R281 PolarHBondContact O-N 3.24Å |
| 278 | F | 98.6 | Very high | 97 | Very high | 4 Ų | 4 | 75.8 Ų | 75.8 | 2% | 0.018 | 36% | 0.355 | C | S | . | . | H | α-helix | trans | -63.6 | -37.4 | 178.3 | -94.2 | -101.2 | 0 | 0 | 0 | 112.8 | L245 E248 F249 L255 V274 K275 R281 R282 | L245-F278 HydrophobicContact CD2-CD2 4.43Å; L245-F278 HydrophobicContact CD2-CE2 3.89Å; E248-F278 HydrophobicContact CB-CZ 4.16Å; F249-F278 HydrophobicContact CB-CE1 4.07Å; F249-F278 HydrophobicContact CB-CZ 4.19Å; F249-F278 AromaticContact CD2-CD1 3.89Å; F249-F278 HydrophobicContact CD2-CD1 3.89Å; F249-F278 AromaticContact CD2-CE1 3.83Å; F249-F278 HydrophobicContact CD2-CE1 3.83Å; F249-F278 HydrophobicContact CG-CE1 4.47Å; L255-F278 HydrophobicContact CD1-CD1 4.15Å; L255-F278 HydrophobicContact CD1-CD2 3.75Å; L255-F278 HydrophobicContact CD1-CE1 3.94Å; L255-F278 HydrophobicContact CD1-CE2 3.55Å; L255-F278 HydrophobicContact CD1-CG 4.07Å; L255-F278 HydrophobicContact CD1-CZ 3.65Å; L255-F278 HydrophobicContact CD2-CE1 4.03Å; L255-F278 HydrophobicContact CD2-CZ 4.06Å; L255-F278 HydrophobicContact CG-CD1 3.98Å; L255-F278 HydrophobicContact CG-CD2 4.48Å; L255-F278 HydrophobicContact CG-CE1 3.72Å; L255-F278 HydrophobicContact CG-CE2 4.27Å; L255-F278 HydrophobicContact CG-CG 4.36Å; L255-F278 HydrophobicContact CG-CZ 3.89Å; V274-F278 HydrophobicContact CG1-CD2 3.96Å; V274-F278 HydrophobicContact CG1-CE2 4.18Å; V274-F278 WeakPolarHBondContact O-CD2 3.31Å; V274-F278 PolarHBondContact O-N 3.06Å; K275-F278 PolarHBondContact O-N 3.45Å; F278-R281 PolarHBondContact O-N 3.35Å; F278-R282 WeakPolarHBondContact O-CG 3.43Å; F278-R282 PolarHBondContact O-N 2.66Å |
| 279 | Q | 98.4 | Very high | 96.5 | Very high | 96 Ų | 96 | 75.5 Ų | 75.5 | 45% | 0.449 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -61.2 | -48.6 | 171.5 | -75.3 | 173.5 | -11.9 | 0 | 0 | 111.8 | K275 I276 W277 R281 R282 A283 | K275-Q279 VanDerWaalsContact O-CG 3.29Å; K275-Q279 WeakPolarHBondContact O-CG 3.39Å; K275-Q279 PolarHBondContact O-N 3.47Å; I276-Q279 PolarHBondContact O-N 2.93Å; W277-Q279 PolarHBondContact O-N 3.27Å; Q279-R281 PolarHBondContact O-N 2.9Å; Q279-R282 PolarHBondContact O-N 2.91Å; Q279-A283 WeakPolarHBondContact O-CB 3.5Å; Q279-A283 PolarHBondContact O-N 3.15Å |
| 280 | N | 97.8 | Very high | 96 | Very high | 101 Ų | 101 | 78 Ų | 78 | 54% | 0.54 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -63.2 | -39.6 | 177.4 | -76.3 | -49.4 | 0 | 0 | 0 | 112.3 | I276 W277 A283 K284 | I276-N280 WeakPolarHBondContact CG2-ND2 3.26Å; I276-N280 WeakPolarHBondContact O-CB 3.42Å; I276-N280 PolarHBondContact O-N 3.44Å; I276-N280 PolarHBondContact O-ND2 2.89Å; W277-N280 PolarHBondContact O-N 3.22Å; N280-A283 PolarHBondContact O-N 3.05Å; N280-K284 PolarHBondContact O-N 3.09Å |
| 281 | R | 97.9 | Very high | 95 | Very high | 35 Ų | 35 | 78.2 Ų | 78.2 | 13% | 0.132 | 39% | 0.388 | C | S | . | . | H | α-helix | trans | -65.3 | -46.1 | 177.7 | -176.5 | 64.6 | -178.5 | -163.7 | -5.3 | 111.6 | E246 F249 W277 F278 Q279 A283 K284 W285 | E246-R281 VanDerWaalsContact CD-CZ 3.4Å; E246-R281 IonicContact OE1-CZ 2.64Å; E246-R281 IonicContact OE1-NH1 3.53Å; E246-R281 PolarHBondContact OE1-NH1 3.16Å; E246-R281 IonicContact OE1-NH2 2.66Å; E246-R281 IonicContact OE2-CZ 3.29Å; E246-R281 IonicContact OE2-NH1 3.08Å; E246-R281 PolarHBondContact OE2-NH1 3.34Å; E246-R281 IonicContact OE2-NH2 3.07Å; E246-R281 PolarHBondContact OE2-NH2 3.07Å; F249-R281 HydrophobicContact CB-CG 4.23Å; F249-R281 HydrophobicContact CD1-CG 3.52Å; F249-R281 HydrophobicContact CD2-CB 4.17Å; F249-R281 HydrophobicContact CD2-CG 3.48Å; F249-R281 VanDerWaalsContact CD2-CG 3.48Å; F249-R281 HydrophobicContact CE1-CG 3.66Å; F249-R281 HydrophobicContact CE2-CB 4.22Å; F249-R281 HydrophobicContact CE2-CG 3.63Å; F249-R281 HydrophobicContact CG-CG 3.43Å; F249-R281 VanDerWaalsContact CG-CG 3.43Å; F249-R281 HydrophobicContact CZ-CG 3.72Å; W277-R281 HydrophobicContact CD2-CB 4.49Å; W277-R281 HydrophobicContact CE3-CB 3.94Å; W277-R281 HydrophobicContact CE3-CG 4.47Å; W277-R281 HydrophobicContact CH2-CB 3.94Å; W277-R281 HydrophobicContact CH2-CG 3.64Å; W277-R281 HydrophobicContact CZ2-CG 4.43Å; W277-R281 HydrophobicContact CZ3-CB 3.64Å; W277-R281 HydrophobicContact CZ3-CG 3.68Å; W277-R281 WeakPolarHBondContact O-CB 3.36Å; W277-R281 PolarHBondContact O-N 3.24Å; F278-R281 PolarHBondContact O-N 3.35Å; Q279-R281 PolarHBondContact O-N 2.9Å; R281-A283 VanDerWaalsContact C-N 3.33Å; R281-A283 PolarHBondContact O-N 3.31Å; R281-K284 PolarHBondContact O-N 3.13Å; R281-W285 WeakPolarHBondContact O-CB 3.36Å; R281-W285 PolarHBondContact O-N 2.91Å |
| 282 | R | 97.8 | Very high | 93.5 | Very high | 56 Ų | 56 | 80.8 Ų | 80.8 | 21% | 0.211 | 40% | 0.404 | C | S | . | . | H | α-helix | trans | -58.9 | -41.6 | 171.2 | -76.2 | -166.3 | -67.1 | -84.8 | 6 | 112.3 | F249 K253 Y254 F278 Q279 W285 K286 | F249-R282 HydrophobicContact CE2-CG 3.76Å; F249-R282 HydrophobicContact CZ-CG 4.3Å; K253-R282 VanDerWaalsContact O-CD 3.27Å; K253-R282 WeakPolarHBondContact O-CD 3.47Å; K253-R282 WeakPolarHBondContact O-CG 3.49Å; K253-R282 PolarHBondContact O-NH1 3.02Å; Y254-R282 VanDerWaalsContact CD1-CZ 3.45Å; F278-R282 WeakPolarHBondContact O-CG 3.43Å; F278-R282 PolarHBondContact O-N 2.66Å; Q279-R282 PolarHBondContact O-N 2.91Å; R282-W285 PolarHBondContact O-N 3.15Å; R282-K286 WeakPolarHBondContact O-CB 3.41Å; R282-K286 PolarHBondContact O-N 3.21Å |
| 283 | A | 97.1 | Very high | 91.6 | Very high | 38 Ų | 38 | 79.8 Ų | 79.8 | 31% | 0.314 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -65.7 | -37.7 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.9 | Q279 N280 R281 R287 | Q279-A283 WeakPolarHBondContact O-CB 3.5Å; Q279-A283 PolarHBondContact O-N 3.15Å; N280-A283 PolarHBondContact O-N 3.05Å; R281-A283 VanDerWaalsContact C-N 3.33Å; R281-A283 PolarHBondContact O-N 3.31Å; A283-R287 PolarHBondContact O-N 2.7Å; A283-R287 PolarHBondContact O-NE 3.31Å |
| 284 | K | 95.1 | Very high | 89.8 | Confident | 107 Ų | 107 | 83.5 Ų | 83.5 | 47% | 0.465 | 42% | 0.42 | S | S | . | . | H | α-helix | trans | -65.4 | -47.5 | 171.7 | -174.3 | -176.9 | 178.2 | -174 | 0 | 110.9 | N280 R281 R287 I288 | N280-K284 PolarHBondContact O-N 3.09Å; R281-K284 PolarHBondContact O-N 3.13Å; K284-R287 PolarHBondContact O-N 2.84Å; K284-I288 HydrophobicContact CG-CD1 3.95Å; K284-I288 WeakPolarHBondContact O-CG1 3.36Å; K284-I288 PolarHBondContact O-N 3.35Å |
| 285 | W | 94.9 | Very high | 87.5 | Confident | 124 Ų | 124 | 89.5 Ų | 89.5 | 47% | 0.47 | 45% | 0.452 | S | S | . | . | H | α-helix | trans | -59.4 | -46.5 | 178.5 | 176.8 | 77.9 | 0 | 0 | 0 | 112.4 | F249 R281 R282 R287 I288 K289 | F249-W285 HydrophobicContact CE1-CB 4.37Å; F249-W285 HydrophobicContact CE1-CG 4.42Å; F249-W285 HydrophobicContact CZ-CB 4.12Å; F249-W285 HydrophobicContact CZ-CG 4.28Å; R281-W285 WeakPolarHBondContact O-CB 3.36Å; R281-W285 PolarHBondContact O-N 2.91Å; R282-W285 PolarHBondContact O-N 3.15Å; W285-R287 PolarHBondContact O-N 3.44Å; W285-I288 PolarHBondContact O-N 2.91Å; W285-I288 VanDerWaalsContact O-N 3.16Å; W285-K289 PolarHBondContact O-N 3.46Å |
| 286 | K | 95.3 | Very high | 85.5 | Confident | 151 Ų | 151 | 93.4 Ų | 93.4 | 66% | 0.657 | 46% | 0.463 | S | S | * | . | H | α-helix | trans | -60.5 | -43.8 | 176.5 | -171.4 | 170.3 | 74.3 | 166.9 | 0 | 112.2 | R282 I288 K289 A290 | R282-K286 WeakPolarHBondContact O-CB 3.41Å; R282-K286 PolarHBondContact O-N 3.21Å; K286-I288 VanDerWaalsContact C-N 3.29Å; K286-I288 PolarHBondContact O-N 3.38Å; K286-K289 PolarHBondContact O-N 3.29Å; K286-A290 VanDerWaalsContact O-CB 3.31Å; K286-A290 WeakPolarHBondContact O-CB 3.46Å; K286-A290 PolarHBondContact O-N 2.77Å |
| 287 | R | 93.3 | Very high | 82.9 | Confident | 144 Ų | 144 | 93.9 Ų | 93.9 | 54% | 0.543 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -62.3 | -34.7 | 175.6 | -85.4 | -179.6 | -88.7 | 111.2 | -4.8 | 113 | A283 K284 W285 N292 | A283-R287 PolarHBondContact O-N 2.7Å; A283-R287 PolarHBondContact O-NE 3.31Å; K284-R287 PolarHBondContact O-N 2.84Å; W285-R287 PolarHBondContact O-N 3.44Å; R287-N292 PolarHBondContact O-N 2.88Å |
| 288 | I | 90.4 | Very high | 80.5 | Confident | 58 Ų | 58 | 96.9 Ų | 96.9 | 30% | 0.297 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -72.1 | -44.3 | 175.4 | -69.1 | 166.7 | 0 | 0 | 0 | 111.5 | K284 W285 K286 A290 G291 V293 | K284-I288 HydrophobicContact CG-CD1 3.95Å; K284-I288 WeakPolarHBondContact O-CG1 3.36Å; K284-I288 PolarHBondContact O-N 3.35Å; W285-I288 PolarHBondContact O-N 2.91Å; W285-I288 VanDerWaalsContact O-N 3.16Å; K286-I288 VanDerWaalsContact C-N 3.29Å; K286-I288 PolarHBondContact O-N 3.38Å; I288-A290 VanDerWaalsContact C-N 3.3Å; I288-A290 PolarHBondContact O-N 3.25Å; I288-G291 PolarHBondContact O-N 3.41Å; I288-V293 HydrophobicContact CB-CG1 4.42Å; I288-V293 HydrophobicContact CG2-CG1 4.22Å; I288-V293 WeakPolarHBondContact O-CG1 3.4Å |
| 289 | K | 88.3 | Confident | 77.5 | Confident | 170 Ų | 170 | 101 Ų | 101 | 74% | 0.739 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -68.2 | -28.7 | -179.5 | -173.2 | 62.6 | 172.9 | 178 | 0 | 112.5 | W285 K286 G291 | W285-K289 PolarHBondContact O-N 3.46Å; K286-K289 PolarHBondContact O-N 3.29Å; K289-G291 VanDerWaalsContact C-N 3.25Å; K289-G291 PolarHBondContact O-N 2.99Å |
| 290 | A | 86.2 | Confident | 75 | Confident | 76 Ų | 76 | 101.4 Ų | 101.4 | 63% | 0.628 | 54% | 0.543 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -84.3 | 23.4 | 176.4 | 0 | 0 | 0 | 0 | 0 | 114.5 | K286 I288 N292 | K286-A290 VanDerWaalsContact O-CB 3.31Å; K286-A290 WeakPolarHBondContact O-CB 3.46Å; K286-A290 PolarHBondContact O-N 2.77Å; I288-A290 VanDerWaalsContact C-N 3.3Å; I288-A290 PolarHBondContact O-N 3.25Å; A290-N292 PolarHBondContact O-N 3.34Å |
| 291 | G | 77.3 | Confident | 72.7 | Confident | 58 Ų | 58 | 101 Ų | 101 | 60% | 0.598 | 54% | 0.544 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 70.4 | -6.3 | 173 | 0 | 0 | 0 | 0 | 0 | 116.9 | I288 K289 V293 | I288-G291 PolarHBondContact O-N 3.41Å; K289-G291 VanDerWaalsContact C-N 3.25Å; K289-G291 PolarHBondContact O-N 2.99Å; G291-V293 PolarHBondContact O-N 3.16Å |
| 292 | N | 66.3 | Low | 70.6 | Confident | 114 Ų | 114 | 109 Ų | 109 | 61% | 0.61 | 57% | 0.574 | S | S | * | * | trans | -82.1 | 52.4 | -172.8 | -156.7 | 109.5 | 0 | 0 | 0 | 112.6 | R287 A290 N294 | R287-N292 PolarHBondContact O-N 2.88Å; A290-N292 PolarHBondContact O-N 3.34Å; N292-N294 PolarHBondContact O-N 2.89Å | ||
| 293 | V | 59.4 | Low | 68.4 | Low | 71 Ų | 71 | 113 Ų | 113 | 43% | 0.43 | 60% | 0.6 | S | S | . | * | trans | -96.1 | 39.1 | -160.3 | -66.8 | 0 | 0 | 0 | 0 | 115.9 | I288 G291 N295 | I288-V293 HydrophobicContact CB-CG1 4.42Å; I288-V293 HydrophobicContact CG2-CG1 4.22Å; I288-V293 WeakPolarHBondContact O-CG1 3.4Å; G291-V293 PolarHBondContact O-N 3.16Å; V293-N295 PolarHBondContact O-N 3.35Å | ||
| 294 | N | 58.4 | Low | 66.4 | Low | 133 Ų | 133 | 116.2 Ų | 116.2 | 71% | 0.711 | 62% | 0.617 | S | S | * | * | trans | -63.1 | -8.8 | -175.3 | -72.5 | 84.7 | 0 | 0 | 0 | 117.2 | N292 | N292-N294 PolarHBondContact O-N 2.89Š| ||
| 295 | N | 50.7 | Low | 64.5 | Low | 126 Ų | 126 | 120.1 Ų | 120.1 | 67% | 0.674 | 63% | 0.634 | S | S | * | * | trans | -139.4 | 88.1 | -178.8 | -60.6 | 99.4 | 0 | 0 | 0 | 111.7 | V293 | V293-N295 PolarHBondContact O-N 3.35Š| ||
| 296 | R | 56.5 | Low | 63 | Low | 192 Ų | 192 | 121 Ų | 121 | 73% | 0.725 | 65% | 0.647 | S | S | * | * | S | Bend | trans | -127 | -1.5 | 162.9 | -133.5 | -163.6 | -65.2 | -137.1 | 11.1 | 114.8 | ||
| 297 | S | 43.6 | Very low | 61.3 | Low | 91 Ų | 91 | 119.7 Ų | 119.7 | 64% | 0.636 | 65% | 0.651 | S | S | * | * | S | Bend | trans | -101.7 | 151.6 | 163.8 | 50.3 | 0 | 0 | 0 | 0 | 110.3 | E299 | S297-E299 PolarHBondContact O-N 3.05Š|
| 298 | G | 47.2 | Very low | 59.2 | Low | 90 Ų | 90 | 117.7 Ų | 117.7 | 93% | 0.928 | 66% | 0.655 | S | S | * | * | trans | -82.5 | 30.6 | -177.7 | 0 | 0 | 0 | 0 | 0 | 115.3 | ||||
| 299 | E | 35.7 | Very low | 57.5 | Low | 90 Ų | 90 | 120.1 Ų | 120.1 | 42% | 0.421 | 68% | 0.675 | S | S | . | * | trans | -85.2 | 130.5 | 176.5 | -148.9 | -74 | 152.7 | 0 | 0 | 109.7 | S297 V301 | S297-E299 PolarHBondContact O-N 3.05Å; E299-V301 HydrophobicContact CB-CG2 4.5Å; E299-V301 PolarHBondContact O-N 2.92Å; E299-V301 WeakPolarHBondContact OE2-CA 3.47Å; E299-V301 PolarHBondContact OE2-N 2.9Å | ||
| 300 | P | 46.8 | Very low | 55.8 | Low | 105 Ų | 105 | 118.8 Ų | 118.8 | 68% | 0.682 | 67% | 0.674 | S | S | * | * | trans | -76.7 | 68.3 | 178 | 33.1 | -36.4 | 0 | 0 | 0 | 111.4 | R302 | P300-R302 PolarHBondContact O-N 3.42Å; P300-R302 VanDerWaalsContact O-N 3.07Å | ||
| 301 | V | 48.6 | Very low | 54.3 | Low | 91 Ų | 91 | 120.9 Ų | 120.9 | 55% | 0.552 | 68% | 0.681 | S | S | * | * | trans | -50.2 | 116.1 | -172.4 | 179 | 0 | 0 | 0 | 0 | 110.8 | E299 N303 | E299-V301 HydrophobicContact CB-CG2 4.5Å; E299-V301 PolarHBondContact O-N 2.92Å; E299-V301 WeakPolarHBondContact OE2-CA 3.47Å; E299-V301 PolarHBondContact OE2-N 2.9Å; V301-N303 PolarHBondContact O-N 3.33Å; V301-N303 VanDerWaalsContact O-N 3.1Å | ||
| 302 | R | 53.6 | Low | 53.3 | Low | 204 Ų | 204 | 124 Ų | 124 | 77% | 0.77 | 69% | 0.689 | S | S | * | * | trans | -73.3 | 105.9 | -157 | -54.7 | 178.8 | -164.4 | -161 | 2.7 | 111.3 | P300 | P300-R302 PolarHBondContact O-N 3.42Å; P300-R302 VanDerWaalsContact O-N 3.07Å | ||
| 303 | N | 51.3 | Low | 53.1 | Low | 139 Ų | 139 | 126.4 Ų | 126.4 | 74% | 0.743 | 70% | 0.695 | S | S | * | * | trans | 51.4 | 82.2 | 168.9 | -61.7 | -67.4 | 0 | 0 | 0 | 114.7 | V301 K305 | V301-N303 PolarHBondContact O-N 3.33Å; V301-N303 VanDerWaalsContact O-N 3.1Å; N303-K305 PolarHBondContact O-N 3.03Å | ||
| 304 | P | 56.3 | Low | 52.9 | Low | 106 Ų | 106 | 128.8 Ų | 128.8 | 69% | 0.688 | 71% | 0.71 | S | S | * | * | trans | -59.6 | 101.6 | 160.8 | 27.1 | -33.4 | 0 | 0 | 0 | 108.7 | I306 | P304-I306 VanDerWaalsContact C-N 3.28Å; P304-I306 PolarHBondContact O-N 2.87Å | ||
| 305 | K | 53.9 | Low | 52.6 | Low | 189 Ų | 189 | 127.6 Ų | 127.6 | 82% | 0.822 | 70% | 0.704 | S | S | * | * | trans | -69.9 | 88.9 | 174 | -88.9 | 178.7 | 175.6 | 171.7 | 0 | 108.5 | N303 V307 | N303-K305 PolarHBondContact O-N 3.03Å; K305-V307 PolarHBondContact O-N 2.68Å | ||
| 306 | I | 64.8 | Low | 52.8 | Low | 144 Ų | 144 | 130.5 Ų | 130.5 | 74% | 0.738 | 71% | 0.705 | S | S | * | * | trans | -66.7 | 86.1 | 167.9 | -56 | 175.4 | 0 | 0 | 0 | 107 | P304 V308 | P304-I306 VanDerWaalsContact C-N 3.28Å; P304-I306 PolarHBondContact O-N 2.87Å; I306-V308 HydrophobicContact CG2-CG2 3.99Å; I306-V308 PolarHBondContact O-N 2.87Å | ||
| 307 | V | 58.4 | Low | 52.4 | Low | 123 Ų | 123 | 129.7 Ų | 129.7 | 75% | 0.745 | 71% | 0.707 | S | S | * | * | trans | -71.9 | 84.9 | 168.8 | -179.9 | 0 | 0 | 0 | 0 | 106.9 | K305 P309 | K305-V307 PolarHBondContact O-N 2.68Å; V307-P309 WeakPolarHBondContact O-CD 3.22Å | ||
| 308 | V | 49.9 | Very low | 53.1 | Low | 102 Ų | 102 | 128.2 Ų | 128.2 | 62% | 0.618 | 70% | 0.701 | S | S | * | * | trans | -62 | 124.2 | 158.2 | -172.3 | 0 | 0 | 0 | 0 | 105.9 | I306 I310 | I306-V308 HydrophobicContact CG2-CG2 3.99Å; I306-V308 PolarHBondContact O-N 2.87Å; V308-I310 PolarHBondContact O-N 2.66Å | ||
| 309 | P | 54.9 | Low | 53.4 | Low | 109 Ų | 109 | 128.9 Ų | 128.9 | 71% | 0.708 | 69% | 0.686 | S | S | * | * | trans | -61.5 | 105.9 | 174.6 | -22.2 | 34.1 | 0 | 0 | 0 | 108.8 | V307 P311 | V307-P309 WeakPolarHBondContact O-CD 3.22Å; P309-P311 VanDerWaalsContact O-CD 3.24Å; P309-P311 WeakPolarHBondContact O-CD 3.24Å | ||
| 310 | I | 52 | Low | 54.3 | Low | 142 Ų | 142 | 133.4 Ų | 133.4 | 73% | 0.728 | 70% | 0.7 | S | S | * | * | trans | -64.3 | 119.4 | 174.1 | -61 | 174.5 | 0 | 0 | 0 | 106.2 | V308 V312 | V308-I310 PolarHBondContact O-N 2.66Å; I310-V312 PolarHBondContact O-N 2.72Å | ||
| 311 | P | 55.3 | Low | 54.8 | Low | 120 Ų | 120 | 131.4 Ų | 131.4 | 78% | 0.779 | 69% | 0.688 | S | S | * | * | trans | -61 | 111.6 | 174.4 | -21.2 | 34.2 | 0 | 0 | 0 | 108.1 | P309 H313 | P309-P311 VanDerWaalsContact O-CD 3.24Å; P309-P311 WeakPolarHBondContact O-CD 3.24Å; P311-H313 PolarHBondContact O-N 2.83Å | ||
| 312 | V | 56.3 | Low | 55.2 | Low | 124 Ų | 124 | 133.3 Ų | 133.3 | 75% | 0.752 | 69% | 0.691 | S | S | * | * | trans | -74.5 | 80.1 | -177.2 | -77.6 | 0 | 0 | 0 | 0 | 109.9 | I310 V314 | I310-V312 PolarHBondContact O-N 2.72Å; V312-V314 PolarHBondContact O-N 2.83Å | ||
| 313 | H | 60.8 | Low | 55.4 | Low | 163 Ų | 163 | 129.6 Ų | 129.6 | 76% | 0.755 | 68% | 0.682 | S | S | * | * | trans | -52.4 | 128.2 | 170.7 | -164.2 | -31.1 | 0 | 0 | 0 | 108.6 | P311 N315 | P311-H313 PolarHBondContact O-N 2.83Å; H313-N315 PolarHBondContact O-N 2.86Å | ||
| 314 | V | 56 | Low | 55.7 | Low | 121 Ų | 121 | 129.4 Ų | 129.4 | 73% | 0.733 | 68% | 0.677 | S | S | * | * | G | 310 helix | trans | -57.2 | -1.9 | -154.7 | -67.4 | 0 | 0 | 0 | 0 | 118.7 | V312 | V312-V314 PolarHBondContact O-N 2.83Š|
| 315 | N | 51.2 | Low | 55.8 | Low | 109 Ų | 109 | 130.5 Ų | 130.5 | 58% | 0.583 | 67% | 0.673 | S | S | * | * | G | 310 helix | trans | -89.7 | -1.2 | -175.4 | -80.1 | 17.3 | 0 | 0 | 0 | 116 | H313 F317 A318 | H313-N315 PolarHBondContact O-N 2.86Å; N315-F317 PolarHBondContact O-N 2.85Å; N315-F317 VanDerWaalsContact O-N 3.17Å; N315-A318 PolarHBondContact O-N 3.1Å |
| 316 | R | 55.2 | Low | 56 | Low | 187 Ų | 187 | 126.7 Ų | 126.7 | 71% | 0.706 | 66% | 0.66 | S | S | * | * | G | 310 helix | trans | -62.1 | -25.7 | -177.2 | -172.1 | 59.9 | -176.7 | -92.4 | 7.4 | 113.9 | ||
| 317 | F | 49.4 | Very low | 55.6 | Low | 175 Ų | 175 | 126 Ų | 126 | 77% | 0.768 | 65% | 0.654 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81.7 | -38.5 | 177.1 | -73.6 | -82.1 | 0 | 0 | 0 | 113.3 | N315 V319 R320 S321 | N315-F317 PolarHBondContact O-N 2.85Å; N315-F317 VanDerWaalsContact O-N 3.17Å; F317-V319 PolarHBondContact O-N 3.39Å; F317-R320 PolarHBondContact O-N 3.32Å; F317-R320 VanDerWaalsContact O-N 3.08Å; F317-S321 PolarHBondContact O-N 2.97Å; F317-S321 VanDerWaalsContact O-N 3.17Å |
| 318 | A | 56.7 | Low | 55.6 | Low | 60 Ų | 60 | 127.5 Ų | 127.5 | 50% | 0.496 | 65% | 0.653 | S | S | . | * | H | α-helix | trans | -58.1 | -46.4 | -178.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | N315 R320 S321 Q322 | N315-A318 PolarHBondContact O-N 3.1Å; A318-R320 PolarHBondContact O-N 3.38Å; A318-S321 PolarHBondContact O-N 3.44Å; A318-Q322 PolarHBondContact O-N 3.43Å; A318-Q322 VanDerWaalsContact O-N 3.11Å |
| 319 | V | 54.4 | Low | 55.9 | Low | 103 Ų | 103 | 125.9 Ų | 125.9 | 62% | 0.624 | 66% | 0.657 | S | S | * | * | H | α-helix | trans | -59.1 | -33.2 | 178.1 | -178.3 | 0 | 0 | 0 | 0 | 112 | F317 H323 | F317-V319 PolarHBondContact O-N 3.39Å; V319-H323 PolarHBondContact O-N 3.02Å |
| 320 | R | 54.7 | Low | 56 | Low | 186 Ų | 186 | 126 Ų | 126 | 70% | 0.702 | 66% | 0.655 | S | S | * | * | H | α-helix | trans | -77.3 | -33.2 | -179.4 | -128.8 | 174.2 | -175.6 | 163.1 | -1.1 | 112.6 | F317 A318 | F317-R320 PolarHBondContact O-N 3.32Å; F317-R320 VanDerWaalsContact O-N 3.08Å; A318-R320 PolarHBondContact O-N 3.38Å |
| 321 | S | 56.3 | Low | 56.1 | Low | 63 Ų | 63 | 129.5 Ų | 129.5 | 44% | 0.441 | 66% | 0.659 | S | S | . | * | H | α-helix | trans | -68.9 | -44.2 | 174.5 | -179.4 | 0 | 0 | 0 | 0 | 111.9 | F317 A318 H323 Q324 Q325 | F317-S321 PolarHBondContact O-N 2.97Å; F317-S321 VanDerWaalsContact O-N 3.17Å; A318-S321 PolarHBondContact O-N 3.44Å; S321-H323 VanDerWaalsContact C-N 3.33Å; S321-H323 PolarHBondContact O-N 2.87Å; S321-Q324 PolarHBondContact O-N 3.37Å; S321-Q325 PolarHBondContact O-N 3.19Å |
| 322 | Q | 57 | Low | 56.3 | Low | 130 Ų | 130 | 133.5 Ų | 133.5 | 61% | 0.607 | 69% | 0.685 | S | S | * | * | H | α-helix | trans | -63.2 | -37 | -178.4 | -163.4 | 175.6 | 32.2 | 0 | 0 | 112.7 | A318 Q324 Q325 | A318-Q322 PolarHBondContact O-N 3.43Å; A318-Q322 VanDerWaalsContact O-N 3.11Å; Q322-Q324 VanDerWaalsContact C-N 3.33Å; Q322-Q324 PolarHBondContact O-N 3.01Å; Q322-Q325 PolarHBondContact O-N 3.07Å |
| 323 | H | 58 | Low | 56.3 | Low | 127 Ų | 127 | 134 Ų | 134 | 59% | 0.588 | 68% | 0.682 | S | S | * | * | H | α-helix | trans | -62.6 | -37.2 | 176.4 | -171.4 | 44.8 | 0 | 0 | 0 | 112.7 | V319 S321 Q325 I326 | V319-H323 PolarHBondContact O-N 3.02Å; S321-H323 VanDerWaalsContact C-N 3.33Å; S321-H323 PolarHBondContact O-N 2.87Å; H323-Q325 VanDerWaalsContact C-N 3.27Å; H323-Q325 PolarHBondContact O-N 3.04Å; H323-I326 PolarHBondContact O-N 3.05Å |
| 324 | Q | 58.7 | Low | 56.1 | Low | 134 Ų | 134 | 132.4 Ų | 132.4 | 63% | 0.626 | 68% | 0.678 | S | S | * | * | H | α-helix | trans | -72.6 | -16.7 | -179.8 | -166.2 | 173.7 | 20.2 | 0 | 0 | 113.9 | S321 Q322 Q328 | S321-Q324 PolarHBondContact O-N 3.37Å; Q322-Q324 VanDerWaalsContact C-N 3.33Å; Q322-Q324 PolarHBondContact O-N 3.01Å; Q324-Q328 PolarHBondContact O-NE2 3.07Å |
| 325 | Q | 57.3 | Low | 56.1 | Low | 130 Ų | 130 | 133.1 Ų | 133.1 | 61% | 0.607 | 68% | 0.675 | S | S | * | * | H | α-helix | trans | -83.4 | -35.3 | 175.3 | -67.4 | 176.4 | -10.7 | 0 | 0 | 111.7 | S321 Q322 H323 Q328 G329 | S321-Q325 PolarHBondContact O-N 3.19Å; Q322-Q325 PolarHBondContact O-N 3.07Å; H323-Q325 VanDerWaalsContact C-N 3.27Å; H323-Q325 PolarHBondContact O-N 3.04Å; Q325-Q328 PolarHBondContact O-N 2.87Å; Q325-G329 PolarHBondContact O-N 2.93Å |
| 326 | I | 57.9 | Low | 56.3 | Low | 108 Ų | 108 | 134.5 Ų | 134.5 | 55% | 0.554 | 68% | 0.68 | S | S | * | * | H | α-helix | trans | -65.4 | -40.1 | 178.4 | -63.7 | 168.1 | 0 | 0 | 0 | 111.1 | H323 Q328 G329 T330 | H323-I326 PolarHBondContact O-N 3.05Å; I326-Q328 PolarHBondContact O-N 3.3Å; I326-G329 PolarHBondContact O-N 3.27Å; I326-T330 PolarHBondContact O-OG1 3.22Å |
| 327 | E | 56.2 | Low | 56.4 | Low | 131 Ų | 131 | 131.2 Ų | 131.2 | 61% | 0.612 | 68% | 0.679 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62.2 | -21.2 | 175.7 | -72.1 | -89.2 | 109.5 | 0 | 0 | 114 | ||
| 328 | Q | 59.1 | Low | 56.9 | Low | 154 Ų | 154 | 128.3 Ų | 128.3 | 72% | 0.72 | 67% | 0.673 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -98 | -17.7 | 178.4 | -74.1 | -179.3 | 82.9 | 0 | 0 | 113.6 | Q324 Q325 I326 T330 | Q324-Q328 PolarHBondContact O-NE2 3.07Å; Q325-Q328 PolarHBondContact O-N 2.87Å; I326-Q328 PolarHBondContact O-N 3.3Å; Q328-T330 VanDerWaalsContact C-N 3.31Å |
| 329 | G | 56.6 | Low | 56.9 | Low | 68 Ų | 68 | 133.1 Ų | 133.1 | 70% | 0.701 | 69% | 0.686 | S | S | * | * | S | Bend | trans | -81.6 | -3.8 | 176.2 | 0 | 0 | 0 | 0 | 0 | 115 | Q325 I326 | Q325-G329 PolarHBondContact O-N 2.93Å; I326-G329 PolarHBondContact O-N 3.27Å |
| 330 | T | 57.5 | Low | 57.1 | Low | 111 Ų | 111 | 135.5 Ų | 135.5 | 68% | 0.681 | 69% | 0.69 | S | S | * | * | trans | -131.8 | 60.6 | -166.7 | -35.5 | 0 | 0 | 0 | 0 | 112.8 | I326 Q328 | I326-T330 PolarHBondContact O-OG1 3.22Å; Q328-T330 VanDerWaalsContact C-N 3.31Å | ||
| 331 | R | 53.3 | Low | 57.3 | Low | 215 Ų | 215 | 131.3 Ų | 131.3 | 81% | 0.811 | 69% | 0.689 | S | S | * | * | trans | -134 | 129.7 | 163 | -66.4 | -172.3 | 179.8 | -133.8 | -4 | 109.4 | ||||
| 332 | P | 59.8 | Low | 57.4 | Low | 204 Ų | 204 | 137.5 Ų | 137.5 | 100% | 1.325 | 71% | 0.712 | S | S | * | * | trans | -76.4 | 0 | 172.5 | 35.1 | -35.6 | 0 | 0 | 0 | 112 |
Retrieved 332 of 332 residues in 208.2 ms
(Link to these results)