| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 40.4 | Very low | 44.6 | Very low | 231 Ų | 231 | 150.7 Ų | 150.7 | 100% | 1.138 | 84% | 0.841 | S | S | * | * | 0 | 96.7 | 0 | -151 | 173.8 | -165.4 | 0 | 0 | 105.9 | |||||
| 2 | F | 45.3 | Very low | 44.1 | Very low | 203 Ų | 203 | 144.1 Ų | 144.1 | 89% | 0.89 | 83% | 0.832 | S | S | * | * | trans | -110.3 | 119.9 | -175.8 | -70.4 | -82.4 | 0 | 0 | 0 | 107.8 | ||||
| 3 | M | 43.6 | Very low | 43.8 | Very low | 183 Ų | 183 | 141.8 Ų | 141.8 | 90% | 0.901 | 83% | 0.83 | S | S | * | * | trans | -97.3 | 106.6 | 173.2 | -62.9 | -156.7 | 93.6 | 0 | 0 | 108.4 | R5 | M3-R5 PolarHBondContact O-N 3.39Š| ||
| 4 | S | 53.4 | Low | 43.4 | Very low | 121 Ų | 121 | 144.4 Ų | 144.4 | 85% | 0.846 | 83% | 0.833 | S | S | * | * | trans | -82.7 | 106.8 | 170.7 | -58.6 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 5 | R | 38.9 | Very low | 43.5 | Very low | 213 Ų | 213 | 142.1 Ų | 142.1 | 80% | 0.804 | 83% | 0.825 | S | S | * | * | trans | -98.2 | 106.7 | 175.5 | -163.3 | 173.6 | -178.4 | 150.9 | 5.1 | 108.3 | M3 D7 | M3-R5 PolarHBondContact O-N 3.39Å; R5-D7 WeakPolarHBondContact CG-OD2 3.36Å; R5-D7 IonicContact CZ-OD2 3.82Å; R5-D7 IonicContact NE-OD2 2.88Å; R5-D7 PolarHBondContact NE-OD2 2.99Å; R5-D7 IonicContact NH2-OD2 3.97Å | ||
| 6 | A | 43.3 | Very low | 43.7 | Very low | 97 Ų | 97 | 140 Ų | 140 | 80% | 0.802 | 82% | 0.817 | S | S | * | * | trans | -101.5 | 98.5 | 172.3 | 0 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 7 | D | 46.8 | Very low | 43.8 | Very low | 127 Ų | 127 | 138.6 Ų | 138.6 | 68% | 0.679 | 82% | 0.817 | S | S | * | * | trans | -103.2 | 101.2 | 176.2 | -76.3 | -33.9 | 0 | 0 | 0 | 109.5 | R5 | R5-D7 WeakPolarHBondContact CG-OD2 3.36Å; R5-D7 IonicContact CZ-OD2 3.82Å; R5-D7 IonicContact NE-OD2 2.88Å; R5-D7 PolarHBondContact NE-OD2 2.99Å; R5-D7 IonicContact NH2-OD2 3.97Å | ||
| 8 | G | 42.7 | Very low | 43.7 | Very low | 71 Ų | 71 | 139.1 Ų | 139.1 | 73% | 0.732 | 82% | 0.815 | S | S | * | * | trans | 47.7 | 97.4 | 134.4 | 0 | 0 | 0 | 0 | 0 | 119.4 | S10 | G8-S10 PolarHBondContact O-N 2.92Å; G8-S10 VanDerWaalsContact O-N 3.14Å | ||
| 9 | I | 42.1 | Very low | 43.6 | Very low | 169 Ų | 169 | 142.3 Ų | 142.3 | 87% | 0.867 | 82% | 0.822 | S | S | * | * | trans | -66.3 | 101.5 | 153 | 42.9 | 165.5 | 0 | 0 | 0 | 109.3 | T11 | I9-T11 PolarHBondContact O-N 2.72Š| ||
| 10 | S | 47.6 | Very low | 43.5 | Very low | 115 Ų | 115 | 140.8 Ų | 140.8 | 80% | 0.804 | 82% | 0.82 | S | S | * | * | trans | -70.2 | 106.8 | 176.1 | -178.6 | 0 | 0 | 0 | 0 | 110.1 | G8 G12 | G8-S10 PolarHBondContact O-N 2.92Å; G8-S10 VanDerWaalsContact O-N 3.14Å; S10-G12 PolarHBondContact O-N 3.07Å | ||
| 11 | T | 46.7 | Very low | 43.1 | Very low | 128 Ų | 128 | 137.1 Ų | 137.1 | 79% | 0.785 | 81% | 0.812 | S | S | * | * | trans | -65.5 | 97.1 | 168.8 | 49.3 | 0 | 0 | 0 | 0 | 109.1 | I9 S13 | I9-T11 PolarHBondContact O-N 2.72Å; T11-S13 PolarHBondContact O-N 3.26Å | ||
| 12 | G | 39 | Very low | 42.9 | Very low | 71 Ų | 71 | 133.1 Ų | 133.1 | 73% | 0.732 | 80% | 0.795 | S | S | * | * | trans | -66.8 | 108.9 | 172.3 | 0 | 0 | 0 | 0 | 0 | 110.1 | S10 M14 | S10-G12 PolarHBondContact O-N 3.07Å; G12-M14 PolarHBondContact O-N 3.47Å | ||
| 13 | S | 40.2 | Very low | 42.6 | Very low | 115 Ų | 115 | 127.5 Ų | 127.5 | 80% | 0.804 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -52.5 | 127.9 | 173 | -65.9 | 0 | 0 | 0 | 0 | 111.7 | T11 | T11-S13 PolarHBondContact O-N 3.26Š|
| 14 | M | 38.3 | Very low | 42.5 | Very low | 178 Ų | 178 | 129.5 Ų | 129.5 | 88% | 0.877 | 78% | 0.784 | S | S | * | * | P | Polyproline II helix | trans | -55 | 133.9 | 167 | -83.6 | 159.8 | 66.7 | 0 | 0 | 110.4 | G12 | G12-M14 PolarHBondContact O-N 3.47Š|
| 15 | P | 43.7 | Very low | 41.7 | Very low | 110 Ų | 110 | 130.6 Ų | 130.6 | 71% | 0.714 | 78% | 0.78 | S | S | * | * | P | Polyproline II helix | trans | -70.8 | 146.1 | 172.5 | 28.9 | -32.3 | 0 | 0 | 0 | 110.7 | ||
| 16 | P | 46.9 | Very low | 41.9 | Very low | 108 Ų | 108 | 125.8 Ų | 125.8 | 70% | 0.701 | 78% | 0.776 | S | S | * | * | P | Polyproline II helix | trans | -66.9 | 136.7 | -177.2 | 26.6 | -32.7 | 0 | 0 | 0 | 111.6 | D18 | P16-D18 PolarHBondContact O-N 3.13Å; P16-D18 VanDerWaalsContact O-N 3.11Å |
| 17 | S | 46 | Very low | 42 | Very low | 117 Ų | 117 | 127.7 Ų | 127.7 | 82% | 0.818 | 78% | 0.777 | S | S | * | * | trans | -73.8 | 92.7 | 173.6 | -53.9 | 0 | 0 | 0 | 0 | 109.4 | E19 | S17-E19 VanDerWaalsContact C-N 3.33Å; S17-E19 PolarHBondContact O-N 3.22Å | ||
| 18 | D | 41.5 | Very low | 41.7 | Very low | 146 Ų | 146 | 126.9 Ų | 126.9 | 78% | 0.781 | 78% | 0.777 | S | S | * | * | trans | -74.2 | 93.1 | 167.9 | -73.7 | -32.6 | 0 | 0 | 0 | 109 | P16 S20 | P16-D18 PolarHBondContact O-N 3.13Å; P16-D18 VanDerWaalsContact O-N 3.11Å; D18-S20 VanDerWaalsContact C-N 3.26Å; D18-S20 PolarHBondContact O-N 3.2Å | ||
| 19 | E | 41.5 | Very low | 42 | Very low | 200 Ų | 200 | 128.8 Ų | 128.8 | 94% | 0.935 | 78% | 0.777 | S | S | * | * | trans | -63.1 | 83.8 | 164.2 | -165.1 | -174.5 | 145.6 | 0 | 0 | 108.6 | S17 | S17-E19 VanDerWaalsContact C-N 3.33Å; S17-E19 PolarHBondContact O-N 3.22Å | ||
| 20 | S | 42.6 | Very low | 42.1 | Very low | 113 Ų | 113 | 126.3 Ų | 126.3 | 79% | 0.79 | 77% | 0.765 | S | S | * | * | trans | -110.5 | 99.9 | 174.5 | -173.1 | 0 | 0 | 0 | 0 | 110.1 | D18 | D18-S20 VanDerWaalsContact C-N 3.26Å; D18-S20 PolarHBondContact O-N 3.2Å | ||
| 21 | G | 34.1 | Very low | 42.3 | Very low | 64 Ų | 64 | 128.8 Ų | 128.8 | 66% | 0.66 | 76% | 0.764 | S | S | * | * | trans | 63.5 | 80.6 | 130.1 | 0 | 0 | 0 | 0 | 0 | 115.9 | A23 | G21-A23 PolarHBondContact O-N 3.34Š| ||
| 22 | D | 36.8 | Very low | 42.3 | Very low | 146 Ų | 146 | 127.7 Ų | 127.7 | 78% | 0.781 | 75% | 0.753 | S | S | * | * | trans | -45.5 | 100.1 | 156.6 | -153.4 | -5.8 | 0 | 0 | 0 | 111.2 | ||||
| 23 | A | 38.5 | Very low | 42.7 | Very low | 85 Ų | 85 | 128 Ų | 128 | 70% | 0.702 | 74% | 0.744 | S | S | * | * | trans | -128.1 | 55.9 | 162.9 | 0 | 0 | 0 | 0 | 0 | 108.2 | G21 L25 | G21-A23 PolarHBondContact O-N 3.34Å; A23-L25 PolarHBondContact O-N 2.79Å | ||
| 24 | R | 40.9 | Very low | 43 | Very low | 226 Ų | 226 | 126.6 Ų | 126.6 | 85% | 0.853 | 73% | 0.731 | S | S | * | * | trans | -63.6 | 87.1 | 160.7 | -72.3 | -177.9 | 172.3 | -168 | -0.4 | 107.8 | ||||
| 25 | L | 38 | Very low | 43.4 | Very low | 144 Ų | 144 | 122.9 Ų | 122.9 | 75% | 0.754 | 71% | 0.714 | S | S | * | * | trans | -53.7 | 127.6 | 167.6 | -71.9 | 169.2 | 0 | 0 | 0 | 107.6 | A23 V27 | A23-L25 PolarHBondContact O-N 2.79Å; L25-V27 PolarHBondContact O-N 3.06Å | ||
| 26 | P | 42.1 | Very low | 43.7 | Very low | 112 Ų | 112 | 123.6 Ų | 123.6 | 73% | 0.727 | 71% | 0.712 | S | S | * | * | trans | -63.1 | 109.6 | 174.5 | 24.6 | -30.7 | 0 | 0 | 0 | 107.5 | T28 | P26-T28 PolarHBondContact O-N 2.97Š| ||
| 27 | V | 45.4 | Very low | 43.6 | Very low | 136 Ų | 136 | 126.1 Ų | 126.1 | 82% | 0.824 | 71% | 0.709 | S | S | * | * | trans | -68.4 | 90.6 | 167.4 | -179.5 | 0 | 0 | 0 | 0 | 105.6 | L25 | L25-V27 PolarHBondContact O-N 3.06Š| ||
| 28 | T | 41.7 | Very low | 43.8 | Very low | 111 Ų | 111 | 125.9 Ų | 125.9 | 68% | 0.681 | 70% | 0.698 | S | S | * | * | trans | -60.5 | 126.7 | 164.6 | 43.9 | 0 | 0 | 0 | 0 | 106.7 | P26 N30 | P26-T28 PolarHBondContact O-N 2.97Å; T28-N30 VanDerWaalsContact C-N 3.3Å; T28-N30 PolarHBondContact O-N 2.88Å | ||
| 29 | P | 48.3 | Very low | 44.1 | Very low | 111 Ų | 111 | 125.5 Ų | 125.5 | 72% | 0.721 | 70% | 0.695 | S | S | * | * | trans | -62.7 | 99 | 177.4 | 24 | -31 | 0 | 0 | 0 | 107.4 | E31 | P29-E31 PolarHBondContact O-N 3.15Š| ||
| 30 | N | 43.9 | Very low | 44.6 | Very low | 116 Ų | 116 | 121.2 Ų | 121.2 | 62% | 0.62 | 69% | 0.687 | S | S | * | * | trans | -62.3 | 122.7 | 175.3 | -158.4 | 7.8 | 0 | 0 | 0 | 106.2 | T28 N32 S33 | T28-N30 VanDerWaalsContact C-N 3.3Å; T28-N30 PolarHBondContact O-N 2.88Å; N30-N32 PolarHBondContact O-N 2.98Å; N30-S33 PolarHBondContact O-N 3.1Å; N30-S33 PolarHBondContact O-OG 3.02Å; N30-S33 VanDerWaalsContact O-OG 3.1Å | ||
| 31 | E | 51.2 | Low | 44.8 | Very low | 168 Ų | 168 | 121 Ų | 121 | 79% | 0.785 | 68% | 0.682 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -55.8 | -12.1 | -172.4 | -61.3 | -175.1 | 147.8 | 0 | 0 | 113.2 | P29 S33 T34 | P29-E31 PolarHBondContact O-N 3.15Å; E31-S33 PolarHBondContact O-N 3.13Å; E31-T34 PolarHBondContact O-OG1 3.24Å |
| 32 | N | 48.3 | Very low | 45.2 | Very low | 105 Ų | 105 | 121.3 Ų | 121.3 | 56% | 0.561 | 68% | 0.677 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.8 | -12.4 | 175.6 | -70.4 | 11.1 | 0 | 0 | 0 | 115.4 | N30 T34 D35 | N30-N32 PolarHBondContact O-N 2.98Å; N32-T34 VanDerWaalsContact C-N 3.33Å; N32-D35 PolarHBondContact O-N 3.07Å |
| 33 | S | 46.6 | Very low | 45.8 | Very low | 76 Ų | 76 | 118.6 Ų | 118.6 | 53% | 0.531 | 68% | 0.675 | S | S | . | * | H | α-helix | trans | -70.9 | -32 | 178.8 | 53.5 | 0 | 0 | 0 | 0 | 112.4 | N30 E31 D35 L36 Y37 | N30-S33 PolarHBondContact O-N 3.1Å; N30-S33 PolarHBondContact O-OG 3.02Å; N30-S33 VanDerWaalsContact O-OG 3.1Å; E31-S33 PolarHBondContact O-N 3.13Å; S33-D35 VanDerWaalsContact C-N 3.31Å; S33-D35 PolarHBondContact O-N 2.95Å; S33-L36 PolarHBondContact O-N 3.46Å; S33-Y37 PolarHBondContact O-N 2.9Å |
| 34 | T | 45.9 | Very low | 45.9 | Very low | 87 Ų | 87 | 125.5 Ų | 125.5 | 53% | 0.534 | 68% | 0.683 | S | S | . | * | H | α-helix | trans | -64.2 | -34.3 | 174.3 | 1.3 | 0 | 0 | 0 | 0 | 112.7 | E31 N32 Y37 N38 | E31-T34 PolarHBondContact O-OG1 3.24Å; N32-T34 VanDerWaalsContact C-N 3.33Å; T34-Y37 PolarHBondContact O-N 3.2Å; T34-N38 PolarHBondContact O-N 3.17Å; T34-N38 VanDerWaalsContact O-N 3.11Å |
| 35 | D | 48.3 | Very low | 46.1 | Very low | 99 Ų | 99 | 122 Ų | 122 | 53% | 0.529 | 68% | 0.68 | S | S | . | * | H | α-helix | trans | -71.2 | -38 | 179.2 | -78.2 | -12.8 | 0 | 0 | 0 | 112.1 | N32 S33 N38 L39 | N32-D35 PolarHBondContact O-N 3.07Å; S33-D35 VanDerWaalsContact C-N 3.31Å; S33-D35 PolarHBondContact O-N 2.95Å; D35-N38 PolarHBondContact O-N 2.84Å; D35-L39 WeakPolarHBondContact O-CB 3.4Å; D35-L39 WeakPolarHBondContact O-CD1 3.39Å; D35-L39 PolarHBondContact O-N 2.9Å |
| 36 | L | 48.5 | Very low | 46.5 | Very low | 126 Ų | 126 | 120.2 Ų | 120.2 | 66% | 0.66 | 68% | 0.679 | S | S | * | * | H | α-helix | trans | -69.7 | -35.6 | 176.1 | -81 | 165.8 | 0 | 0 | 0 | 112.3 | S33 N38 L39 S40 | S33-L36 PolarHBondContact O-N 3.46Å; L36-N38 VanDerWaalsContact C-N 3.35Å; L36-L39 PolarHBondContact O-N 2.89Å; L36-S40 PolarHBondContact O-N 3.31Å |
| 37 | Y | 45.3 | Very low | 46.6 | Very low | 161 Ų | 161 | 125 Ų | 125 | 63% | 0.631 | 68% | 0.683 | S | S | * | * | H | α-helix | trans | -64.7 | -41.2 | 175.2 | -151.9 | -92.7 | 0 | 0 | 0 | 111.2 | S33 T34 L39 | S33-Y37 PolarHBondContact O-N 2.9Å; T34-Y37 PolarHBondContact O-N 3.2Å; Y37-L39 PolarHBondContact O-N 3.38Å |
| 38 | N | 49.6 | Very low | 46.6 | Very low | 111 Ų | 111 | 124.9 Ų | 124.9 | 59% | 0.594 | 68% | 0.683 | S | S | * | * | H | α-helix | trans | -70.4 | -28.2 | 175.5 | -84.7 | -21.2 | 0 | 0 | 0 | 113.6 | T34 D35 L36 A42 | T34-N38 PolarHBondContact O-N 3.17Å; T34-N38 VanDerWaalsContact O-N 3.11Å; D35-N38 PolarHBondContact O-N 2.84Å; L36-N38 VanDerWaalsContact C-N 3.35Å; N38-A42 VanDerWaalsContact O-CB 3.23Å; N38-A42 WeakPolarHBondContact O-CB 3.49Å; N38-A42 PolarHBondContact O-N 3.18Å |
| 39 | L | 48 | Very low | 46.8 | Very low | 138 Ų | 138 | 125.2 Ų | 125.2 | 72% | 0.723 | 69% | 0.687 | S | S | * | * | H | α-helix | trans | -75.7 | -27.4 | 178.1 | -98.3 | 143.7 | 0 | 0 | 0 | 113.7 | D35 L36 Y37 | D35-L39 WeakPolarHBondContact O-CB 3.4Å; D35-L39 WeakPolarHBondContact O-CD1 3.39Å; D35-L39 PolarHBondContact O-N 2.9Å; L36-L39 PolarHBondContact O-N 2.89Å; Y37-L39 PolarHBondContact O-N 3.38Å |
| 40 | S | 51.9 | Low | 46.7 | Very low | 110 Ų | 110 | 125 Ų | 125 | 77% | 0.769 | 69% | 0.688 | S | S | * | * | H | α-helix | trans | -83.7 | -28 | -174.3 | -147.1 | 0 | 0 | 0 | 0 | 113.7 | L36 | L36-S40 PolarHBondContact O-N 3.31Å |
| 41 | T | 47.9 | Very low | 47 | Very low | 110 Ų | 110 | 128.1 Ų | 128.1 | 68% | 0.675 | 70% | 0.704 | S | S | * | * | H | α-helix | trans | -111.5 | -15.7 | -174.6 | -25.7 | 0 | 0 | 0 | 0 | 114.1 | A43 | T41-A43 VanDerWaalsContact C-N 3.29Å; T41-A43 PolarHBondContact O-N 3.14Å |
| 42 | A | 43 | Very low | 46.7 | Very low | 69 Ų | 69 | 122.1 Ų | 122.1 | 57% | 0.57 | 69% | 0.686 | S | S | * | * | trans | -81.9 | 78 | 173.6 | 0 | 0 | 0 | 0 | 0 | 110.1 | N38 R44 | N38-A42 VanDerWaalsContact O-CB 3.23Å; N38-A42 WeakPolarHBondContact O-CB 3.49Å; N38-A42 PolarHBondContact O-N 3.18Å; A42-R44 PolarHBondContact O-N 3.1Å | ||
| 43 | A | 47.9 | Very low | 46.8 | Very low | 89 Ų | 89 | 122.8 Ų | 122.8 | 74% | 0.736 | 70% | 0.7 | S | S | * | * | trans | -54.1 | 98.2 | 157.3 | 0 | 0 | 0 | 0 | 0 | 107.2 | T41 I45 | T41-A43 VanDerWaalsContact C-N 3.29Å; T41-A43 PolarHBondContact O-N 3.14Å; A43-I45 VanDerWaalsContact C-N 3.32Å; A43-I45 PolarHBondContact O-N 3.04Å | ||
| 44 | R | 41.1 | Very low | 47 | Very low | 231 Ų | 231 | 126.1 Ų | 126.1 | 87% | 0.872 | 71% | 0.711 | S | S | * | * | trans | -67.7 | 93.1 | -176.8 | -151.6 | 173.9 | -177.9 | 170 | 1.3 | 106.6 | A42 S46 | A42-R44 PolarHBondContact O-N 3.1Å; R44-S46 PolarHBondContact O-N 2.96Å | ||
| 45 | I | 45.8 | Very low | 47.1 | Very low | 152 Ų | 152 | 126.7 Ų | 126.7 | 78% | 0.779 | 73% | 0.725 | S | S | * | * | trans | -69.6 | 77.4 | 172.4 | -54 | 175.1 | 0 | 0 | 0 | 106.5 | A43 R47 | A43-I45 VanDerWaalsContact C-N 3.32Å; A43-I45 PolarHBondContact O-N 3.04Å; I45-R47 PolarHBondContact O-N 3.4Å | ||
| 46 | S | 45.4 | Very low | 47.4 | Very low | 106 Ų | 106 | 128.5 Ų | 128.5 | 74% | 0.741 | 73% | 0.733 | S | S | * | * | trans | -80.9 | 59.6 | 171.8 | 68.8 | 0 | 0 | 0 | 0 | 108.9 | R44 | R44-S46 PolarHBondContact O-N 2.96Š| ||
| 47 | R | 44.5 | Very low | 47.5 | Very low | 213 Ų | 213 | 127.3 Ų | 127.3 | 80% | 0.804 | 73% | 0.728 | S | S | * | * | trans | -135 | 91.5 | 164.3 | -68.7 | -170.9 | -177.1 | -175.1 | 2.3 | 105 | I45 P49 | I45-R47 PolarHBondContact O-N 3.4Å; R47-P49 VanDerWaalsContact O-CD 3.28Å; R47-P49 WeakPolarHBondContact O-CD 3.32Å; R47-P49 VanDerWaalsContact O-N 3.09Å | ||
| 48 | T | 44.9 | Very low | 48 | Very low | 134 Ų | 134 | 126.2 Ų | 126.2 | 82% | 0.822 | 73% | 0.732 | S | S | * | * | trans | -47.9 | 117.4 | 157.1 | 31.8 | 0 | 0 | 0 | 0 | 106.3 | S50 | T48-S50 VanDerWaalsContact C-N 3.29Å; T48-S50 PolarHBondContact O-N 3.29Å | ||
| 49 | P | 45.9 | Very low | 48.2 | Very low | 117 Ų | 117 | 128.9 Ų | 128.9 | 76% | 0.76 | 74% | 0.738 | S | S | * | * | trans | -65.1 | 98.8 | 178.8 | 24.3 | -30.3 | 0 | 0 | 0 | 106.9 | R47 L51 | R47-P49 VanDerWaalsContact O-CD 3.28Å; R47-P49 WeakPolarHBondContact O-CD 3.32Å; R47-P49 VanDerWaalsContact O-N 3.09Å; P49-L51 PolarHBondContact O-N 2.87Å; P49-L51 VanDerWaalsContact O-N 3.16Å | ||
| 50 | S | 47.4 | Very low | 48.4 | Very low | 106 Ų | 106 | 126.4 Ų | 126.4 | 74% | 0.741 | 73% | 0.732 | S | S | * | * | trans | -52 | 118.4 | 161.1 | 148.6 | 0 | 0 | 0 | 0 | 105.8 | T48 G52 | T48-S50 VanDerWaalsContact C-N 3.29Å; T48-S50 PolarHBondContact O-N 3.29Å; S50-G52 PolarHBondContact O-N 3.34Å | ||
| 51 | L | 50.6 | Low | 48.5 | Very low | 183 Ų | 183 | 128.9 Ų | 128.9 | 96% | 0.958 | 73% | 0.729 | S | S | * | * | trans | -65.9 | 36.9 | 177.6 | -73.7 | 161.9 | 0 | 0 | 0 | 112.5 | P49 S53 | P49-L51 PolarHBondContact O-N 2.87Å; P49-L51 VanDerWaalsContact O-N 3.16Å; L51-S53 PolarHBondContact O-N 2.88Å | ||
| 52 | G | 43.9 | Very low | 48.2 | Very low | 41 Ų | 41 | 126.4 Ų | 126.4 | 42% | 0.423 | 73% | 0.726 | S | S | . | * | trans | -81.6 | 98.7 | 168.5 | 0 | 0 | 0 | 0 | 0 | 107.9 | S50 D54 | S50-G52 PolarHBondContact O-N 3.34Å; G52-D54 PolarHBondContact O-N 3.49Å | ||
| 53 | S | 49.9 | Very low | 48.2 | Very low | 120 Ų | 120 | 128 Ų | 128 | 84% | 0.839 | 73% | 0.733 | S | S | * | * | S | Bend | trans | 25.6 | 3 | 149.6 | 54.5 | 0 | 0 | 0 | 0 | 123.7 | L51 A55 | L51-S53 PolarHBondContact O-N 2.88Å; S53-A55 PolarHBondContact O-N 3.4Å |
| 54 | D | 50.8 | Low | 48 | Very low | 145 Ų | 145 | 129.3 Ų | 129.3 | 78% | 0.775 | 73% | 0.732 | S | S | * | * | trans | -96.5 | 83.8 | 176.7 | -67.9 | -7.9 | 0 | 0 | 0 | 107.3 | G52 I56 | G52-D54 PolarHBondContact O-N 3.49Å; D54-I56 PolarHBondContact O-N 3.14Å; D54-I56 VanDerWaalsContact O-N 3.08Å | ||
| 55 | A | 49.4 | Very low | 47.9 | Very low | 99 Ų | 99 | 129.6 Ų | 129.6 | 82% | 0.818 | 73% | 0.733 | S | S | * | * | trans | -54 | 115.9 | 169.9 | 0 | 0 | 0 | 0 | 0 | 108.6 | S53 D57 | S53-A55 PolarHBondContact O-N 3.4Å; A55-D57 PolarHBondContact O-N 2.87Å | ||
| 56 | I | 52.8 | Low | 47.8 | Very low | 138 Ų | 138 | 127 Ų | 127 | 71% | 0.708 | 73% | 0.729 | S | S | * | * | trans | -65 | 107.8 | 176.2 | -60.9 | 169.5 | 0 | 0 | 0 | 106.8 | D54 L58 | D54-I56 PolarHBondContact O-N 3.14Å; D54-I56 VanDerWaalsContact O-N 3.08Å; I56-L58 PolarHBondContact O-N 2.86Å | ||
| 57 | D | 51.2 | Low | 47.5 | Very low | 101 Ų | 101 | 130.9 Ų | 130.9 | 54% | 0.54 | 74% | 0.735 | S | S | . | * | trans | -71.1 | 97.1 | 174.7 | -172.2 | 3.5 | 0 | 0 | 0 | 109.4 | A55 K59 S60 | A55-D57 PolarHBondContact O-N 2.87Å; D57-K59 PolarHBondContact O-N 2.93Å; D57-K59 VanDerWaalsContact O-N 3.08Å; D57-K59 VanDerWaalsContact OD1-CB 3.24Å; D57-K59 WeakPolarHBondContact OD1-CB 3.4Å; D57-K59 WeakPolarHBondContact OD1-CG 3.35Å; D57-K59 PolarHBondContact OD1-N 3.35Å; D57-S60 PolarHBondContact O-N 3.48Å; D57-S60 PolarHBondContact O-OG 2.85Å; D57-S60 VanDerWaalsContact O-OG 3.13Å | ||
| 58 | L | 56.6 | Low | 47.5 | Very low | 137 Ų | 137 | 124.8 Ų | 124.8 | 72% | 0.717 | 73% | 0.725 | S | S | * | * | G | 310 helix | trans | -61.8 | -10.1 | 177.4 | -70.7 | 167.8 | 0 | 0 | 0 | 112.8 | I56 S60 F61 | I56-L58 PolarHBondContact O-N 2.86Å; L58-S60 PolarHBondContact O-N 3.25Å; L58-F61 PolarHBondContact O-N 2.91Å |
| 59 | K | 52.5 | Low | 47.5 | Very low | 168 Ų | 168 | 127.5 Ų | 127.5 | 73% | 0.73 | 73% | 0.729 | S | S | * | * | G | 310 helix | trans | -67.3 | -22.5 | 173.7 | -66.8 | -174.2 | 176.5 | -175.9 | 0 | 113.4 | D57 F61 G62 | D57-K59 PolarHBondContact O-N 2.93Å; D57-K59 VanDerWaalsContact O-N 3.08Å; D57-K59 VanDerWaalsContact OD1-CB 3.24Å; D57-K59 WeakPolarHBondContact OD1-CB 3.4Å; D57-K59 WeakPolarHBondContact OD1-CG 3.35Å; D57-K59 PolarHBondContact OD1-N 3.35Å; K59-F61 VanDerWaalsContact C-N 3.27Å; K59-F61 PolarHBondContact O-N 3.16Å; K59-G62 PolarHBondContact O-N 2.88Å |
| 60 | S | 53.9 | Low | 47.3 | Very low | 86 Ų | 86 | 130.5 Ų | 130.5 | 60% | 0.601 | 73% | 0.733 | S | S | * | * | G | 310 helix | trans | -70.6 | -20.7 | -179.4 | 65.4 | 0 | 0 | 0 | 0 | 114.1 | D57 L58 G62 | D57-S60 PolarHBondContact O-N 3.48Å; D57-S60 PolarHBondContact O-OG 2.85Å; D57-S60 VanDerWaalsContact O-OG 3.13Å; L58-S60 PolarHBondContact O-N 3.25Å; S60-G62 VanDerWaalsContact C-N 3.34Å |
| 61 | F | 53.7 | Low | 47.1 | Very low | 161 Ų | 161 | 130 Ų | 130 | 71% | 0.706 | 73% | 0.729 | S | S | * | * | G | 310 helix | trans | -83 | -8.5 | 177.6 | -75.1 | -83.9 | 0 | 0 | 0 | 113.8 | L58 K59 | L58-F61 PolarHBondContact O-N 2.91Å; K59-F61 VanDerWaalsContact C-N 3.27Å; K59-F61 PolarHBondContact O-N 3.16Å |
| 62 | G | 40 | Very low | 46.7 | Very low | 58 Ų | 58 | 131 Ų | 131 | 60% | 0.598 | 72% | 0.722 | S | S | * | * | G | 310 helix | trans | -86.6 | -8.4 | -176.6 | 0 | 0 | 0 | 0 | 0 | 115.9 | K59 S60 T64 | K59-G62 PolarHBondContact O-N 2.88Å; S60-G62 VanDerWaalsContact C-N 3.34Å; G62-T64 PolarHBondContact O-N 3.39Å |
| 63 | S | 44.7 | Very low | 47.2 | Very low | 103 Ų | 103 | 137 Ų | 137 | 72% | 0.72 | 74% | 0.74 | S | S | * | * | S | Bend | trans | -93.1 | 12.6 | -166.7 | -57.2 | 0 | 0 | 0 | 0 | 116 | ||
| 64 | T | 43.7 | Very low | 47.3 | Very low | 117 Ų | 117 | 137.8 Ų | 137.8 | 72% | 0.718 | 74% | 0.735 | S | S | * | * | trans | -129.5 | 51.8 | 176.2 | 61.8 | 0 | 0 | 0 | 0 | 112.1 | G62 | G62-T64 PolarHBondContact O-N 3.39Š| ||
| 65 | W | 38.5 | Very low | 47.8 | Very low | 236 Ų | 236 | 138.2 Ų | 138.2 | 89% | 0.894 | 74% | 0.735 | S | S | * | * | trans | -118.7 | 84 | 152 | -75.5 | 88.6 | 0 | 0 | 0 | 106.5 | E67 | W65-E67 PolarHBondContact O-N 2.86Å; W65-E67 VanDerWaalsContact O-N 3.09Å | ||
| 66 | S | 43.3 | Very low | 47.9 | Very low | 99 Ų | 99 | 138.1 Ų | 138.1 | 69% | 0.692 | 73% | 0.725 | S | S | * | * | trans | -68.2 | 102.1 | 172.7 | -36 | 0 | 0 | 0 | 0 | 107.5 | S68 | S66-S68 PolarHBondContact O-N 3.39Š| ||
| 67 | E | 39.9 | Very low | 48 | Very low | 186 Ų | 186 | 140.2 Ų | 140.2 | 87% | 0.869 | 73% | 0.732 | S | S | * | * | trans | -67.5 | 74 | 165.4 | -71.8 | 177.5 | 127.2 | 0 | 0 | 109.2 | W65 | W65-E67 PolarHBondContact O-N 2.86Å; W65-E67 VanDerWaalsContact O-N 3.09Å | ||
| 68 | S | 43.3 | Very low | 47.6 | Very low | 86 Ų | 86 | 141.8 Ų | 141.8 | 60% | 0.601 | 74% | 0.741 | S | S | * | * | trans | -134.3 | 88.8 | 173 | 47.1 | 0 | 0 | 0 | 0 | 106.7 | S66 | S66-S68 PolarHBondContact O-N 3.39Š| ||
| 69 | E | 44.6 | Very low | 47.2 | Very low | 191 Ų | 191 | 140.4 Ų | 140.4 | 89% | 0.893 | 74% | 0.743 | S | S | * | * | trans | 157.9 | 32.6 | 159 | -86.1 | 171.2 | -176.7 | 0 | 0 | 112.4 | S71 | E69-S71 PolarHBondContact O-N 2.94Š| ||
| 70 | Q | 41.6 | Very low | 47 | Very low | 180 Ų | 180 | 137.1 Ų | 137.1 | 84% | 0.841 | 74% | 0.741 | S | S | * | * | trans | -81.6 | 67.7 | 154.5 | -70.5 | -173.6 | 17.5 | 0 | 0 | 108.5 | Y72 | Q70-Y72 VanDerWaalsContact C-N 3.28Å; Q70-Y72 PolarHBondContact O-N 2.94Å | ||
| 71 | S | 44.3 | Very low | 46.4 | Very low | 96 Ų | 96 | 142.9 Ų | 142.9 | 67% | 0.671 | 76% | 0.755 | S | S | * | * | trans | -67.8 | 93.2 | 166.2 | 171.8 | 0 | 0 | 0 | 0 | 107.8 | E69 M73 | E69-S71 PolarHBondContact O-N 2.94Å; S71-M73 PolarHBondContact O-N 3.36Å | ||
| 72 | Y | 42.9 | Very low | 46.1 | Very low | 204 Ų | 204 | 140.6 Ų | 140.6 | 80% | 0.8 | 76% | 0.759 | S | S | * | * | trans | -24.8 | 98.9 | 164.2 | -139.6 | -103.2 | 0 | 0 | 0 | 112.2 | Q70 D74 | Q70-Y72 VanDerWaalsContact C-N 3.28Å; Q70-Y72 PolarHBondContact O-N 2.94Å; Y72-D74 VanDerWaalsContact C-N 3.32Å; Y72-D74 HydrophobicContact CD1-CB 4.46Å; Y72-D74 PolarHBondContact O-N 2.7Å | ||
| 73 | M | 54 | Low | 46 | Very low | 165 Ų | 165 | 144.5 Ų | 144.5 | 81% | 0.813 | 77% | 0.766 | S | S | * | * | trans | -81.4 | 92.8 | 161.8 | -72.3 | -68 | 175.3 | 0 | 0 | 106.1 | S71 M75 | S71-M73 PolarHBondContact O-N 3.36Å; M73-M75 VanDerWaalsContact C-N 3.3Å; M73-M75 PolarHBondContact O-N 2.95Å | ||
| 74 | D | 51.2 | Low | 45.8 | Very low | 138 Ų | 138 | 148.4 Ų | 148.4 | 74% | 0.738 | 78% | 0.775 | S | S | * | * | trans | -57.9 | 92.6 | 167.2 | -161.6 | 22.6 | 0 | 0 | 0 | 107.7 | Y72 P76 | Y72-D74 VanDerWaalsContact C-N 3.32Å; Y72-D74 HydrophobicContact CD1-CB 4.46Å; Y72-D74 PolarHBondContact O-N 2.7Å; D74-P76 VanDerWaalsContact O-CD 3.29Å; D74-P76 WeakPolarHBondContact O-CD 3.4Å | ||
| 75 | M | 60.8 | Low | 45.8 | Very low | 154 Ų | 154 | 148.7 Ų | 148.7 | 76% | 0.759 | 78% | 0.777 | S | S | * | * | trans | -77.9 | 113.2 | 176.8 | -87 | -82.6 | -57.9 | 0 | 0 | 107.9 | M73 E77 | M73-M75 VanDerWaalsContact C-N 3.3Å; M73-M75 PolarHBondContact O-N 2.95Å; M75-E77 PolarHBondContact O-N 3.29Å | ||
| 76 | P | 53 | Low | 46 | Very low | 96 Ų | 96 | 142.9 Ų | 142.9 | 62% | 0.623 | 77% | 0.768 | S | S | * | * | trans | -66.8 | 122.6 | 176.1 | 25.5 | -31.3 | 0 | 0 | 0 | 109.9 | D74 D78 | D74-P76 VanDerWaalsContact O-CD 3.29Å; D74-P76 WeakPolarHBondContact O-CD 3.4Å; P76-D78 PolarHBondContact O-N 3.29Å | ||
| 77 | E | 53.7 | Low | 45.8 | Very low | 183 Ų | 183 | 143.5 Ų | 143.5 | 86% | 0.855 | 77% | 0.772 | S | S | * | * | trans | -70.9 | 67.2 | 172.8 | -63 | -179.1 | 146.5 | 0 | 0 | 110.5 | M75 S79 | M75-E77 PolarHBondContact O-N 3.29Å; E77-S79 PolarHBondContact O-N 3.15Å; E77-S79 PolarHBondContact O-OG 3.27Å | ||
| 78 | D | 42.8 | Very low | 45.9 | Very low | 134 Ų | 134 | 142.5 Ų | 142.5 | 72% | 0.717 | 77% | 0.771 | S | S | * | * | trans | -75.2 | 82.9 | 170.4 | -76.5 | -25.2 | 0 | 0 | 0 | 109.4 | P76 S80 | P76-D78 PolarHBondContact O-N 3.29Å; D78-S80 PolarHBondContact O-N 3.11Å | ||
| 79 | S | 48.3 | Very low | 45.7 | Very low | 108 Ų | 108 | 143.8 Ų | 143.8 | 76% | 0.755 | 78% | 0.78 | S | S | * | * | trans | -61.6 | 78.4 | 165.4 | 34.2 | 0 | 0 | 0 | 0 | 110 | E77 | E77-S79 PolarHBondContact O-N 3.15Å; E77-S79 PolarHBondContact O-OG 3.27Å | ||
| 80 | S | 49.7 | Very low | 45.2 | Very low | 99 Ų | 99 | 137.9 Ų | 137.9 | 69% | 0.692 | 77% | 0.77 | S | S | * | * | trans | -140.4 | 27.1 | 177.4 | -82.4 | 0 | 0 | 0 | 0 | 114.8 | D78 | D78-S80 PolarHBondContact O-N 3.11Š| ||
| 81 | F | 41.1 | Very low | 45 | Very low | 207 Ų | 207 | 134.6 Ų | 134.6 | 91% | 0.908 | 76% | 0.763 | S | S | * | * | trans | -119.8 | 31.6 | 168.6 | -71.8 | -77 | 0 | 0 | 0 | 113.6 | ||||
| 82 | S | 46.6 | Very low | 44.6 | Very low | 112 Ų | 112 | 139.2 Ų | 139.2 | 78% | 0.783 | 77% | 0.774 | S | S | * | * | S | Bend | trans | -110.6 | 47.3 | 175.8 | -53.1 | 0 | 0 | 0 | 0 | 112.4 | ||
| 83 | N | 38.6 | Very low | 44.6 | Very low | 140 Ų | 140 | 139.9 Ų | 139.9 | 75% | 0.749 | 78% | 0.775 | S | S | * | * | trans | -169.8 | 76.9 | 157.6 | -123.2 | -18.2 | 0 | 0 | 0 | 113.9 | ||||
| 84 | M | 40.3 | Very low | 43.8 | Very low | 185 Ų | 185 | 139.3 Ų | 139.3 | 91% | 0.911 | 78% | 0.775 | S | S | * | * | trans | -136.6 | 64.7 | 151.8 | -81.8 | -165.8 | -179.4 | 0 | 0 | 109 | T86 | M84-T86 VanDerWaalsContact C-N 3.27Å; M84-T86 PolarHBondContact O-N 2.98Å; M84-T86 VanDerWaalsContact O-N 3.14Å | ||
| 85 | T | 42.9 | Very low | 43.2 | Very low | 123 Ų | 123 | 138.1 Ų | 138.1 | 76% | 0.755 | 78% | 0.777 | S | S | * | * | trans | -75.3 | 83.9 | 157.8 | 40.6 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 86 | T | 43 | Very low | 42.2 | Very low | 115 Ų | 115 | 139.5 Ų | 139.5 | 71% | 0.706 | 78% | 0.784 | S | S | * | * | trans | -97.6 | 109.5 | 164.2 | -46.1 | 0 | 0 | 0 | 0 | 107.8 | M84 I88 | M84-T86 VanDerWaalsContact C-N 3.27Å; M84-T86 PolarHBondContact O-N 2.98Å; M84-T86 VanDerWaalsContact O-N 3.14Å; T86-I88 PolarHBondContact O-N 3.21Å; T86-I88 VanDerWaalsContact O-N 3.14Å | ||
| 87 | S | 40.4 | Very low | 41.5 | Very low | 111 Ų | 111 | 144 Ų | 144 | 78% | 0.776 | 79% | 0.794 | S | S | * | * | trans | -56.2 | 109.4 | 176.4 | -48 | 0 | 0 | 0 | 0 | 111 | ||||
| 88 | I | 40.3 | Very low | 40.7 | Very low | 166 Ų | 166 | 142.5 Ų | 142.5 | 85% | 0.851 | 79% | 0.792 | S | S | * | * | trans | -105.5 | 89.3 | 155.4 | -62.7 | 177.8 | 0 | 0 | 0 | 105.7 | T86 | T86-I88 PolarHBondContact O-N 3.21Å; T86-I88 VanDerWaalsContact O-N 3.14Å | ||
| 89 | S | 40.1 | Very low | 40.8 | Very low | 112 Ų | 112 | 142 Ų | 142 | 78% | 0.783 | 80% | 0.795 | S | S | * | * | trans | -67.4 | 129.7 | 167.3 | 56.1 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 90 | G | 34.3 | Very low | 40.4 | Very low | 67 Ų | 67 | 139.4 Ų | 139.4 | 69% | 0.691 | 79% | 0.786 | S | S | * | * | trans | 106.7 | 69.5 | 156.3 | 0 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 91 | V | 37.2 | Very low | 40 | Very low | 112 Ų | 112 | 142.5 Ų | 142.5 | 68% | 0.679 | 79% | 0.794 | S | S | * | * | -143.3 | 100.9 | 129.7 | -172 | 0 | 0 | 0 | 0 | 107.4 | R93 | V91-R93 HydrophobicContact CG1-CG 4.09Å; V91-R93 PolarHBondContact O-N 3.01Å | |||
| 92 | E | 36.5 | Very low | 40.1 | Very low | 193 Ų | 193 | 141.2 Ų | 141.2 | 90% | 0.902 | 79% | 0.789 | S | S | * | * | trans | -59.6 | 106.1 | 164.2 | -168.8 | 175.2 | 175.6 | 0 | 0 | 107.8 | ||||
| 93 | R | 41.8 | Very low | 39.7 | Very low | 218 Ų | 218 | 142.5 Ų | 142.5 | 82% | 0.823 | 79% | 0.787 | S | S | * | * | trans | -130.6 | 126.2 | 166 | -87.9 | -172.3 | -179 | 122.8 | 1.6 | 109.2 | V91 | V91-R93 HydrophobicContact CG1-CG 4.09Å; V91-R93 PolarHBondContact O-N 3.01Å | ||
| 94 | D | 36.5 | Very low | 39.9 | Very low | 153 Ų | 153 | 146.1 Ų | 146.1 | 82% | 0.818 | 79% | 0.79 | S | S | * | * | trans | -51.9 | 138 | -166.9 | -70.1 | -60.5 | 0 | 0 | 0 | 114.7 | M96 | D94-M96 PolarHBondContact O-N 2.95Š| ||
| 95 | S | 40.4 | Very low | 39.6 | Very low | 113 Ų | 113 | 143.6 Ų | 143.6 | 79% | 0.79 | 79% | 0.785 | S | S | * | * | trans | -45.7 | 99.7 | 168.8 | 153.5 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 96 | M | 37.8 | Very low | 39.4 | Very low | 182 Ų | 182 | 142.2 Ų | 142.2 | 90% | 0.897 | 78% | 0.78 | S | S | * | * | trans | -95.6 | 104.2 | 147.9 | -85.7 | -161.4 | 159.8 | 0 | 0 | 109.1 | D94 N98 | D94-M96 PolarHBondContact O-N 2.95Å; M96-N98 PolarHBondContact O-N 3.06Å; M96-N98 VanDerWaalsContact O-N 3.1Å | ||
| 97 | K | 38.6 | Very low | 38.9 | Very low | 192 Ų | 192 | 146 Ų | 146 | 84% | 0.835 | 79% | 0.79 | S | S | * | * | trans | -56.5 | 99.5 | 177.7 | -172.8 | 175.7 | -176.4 | -179.8 | 0 | 110.3 | P99 | K97-P99 WeakPolarHBondContact O-CD 3.3Š| ||
| 98 | N | 36.8 | Very low | 38.8 | Very low | 150 Ų | 150 | 145.9 Ų | 145.9 | 80% | 0.802 | 79% | 0.789 | S | S | * | * | trans | -62.4 | 119.6 | 166.6 | -81.1 | -24.5 | 0 | 0 | 0 | 108.8 | M96 G100 | M96-N98 PolarHBondContact O-N 3.06Å; M96-N98 VanDerWaalsContact O-N 3.1Å; N98-G100 PolarHBondContact O-N 3.09Å; N98-G100 VanDerWaalsContact O-N 3.15Å | ||
| 99 | P | 45.7 | Very low | 38.5 | Very low | 123 Ų | 123 | 146.9 Ų | 146.9 | 80% | 0.799 | 79% | 0.79 | S | S | * | * | trans | -67.5 | 115.3 | 172.8 | 25.4 | -28.4 | 0 | 0 | 0 | 108.5 | K97 | K97-P99 WeakPolarHBondContact O-CD 3.3Š| ||
| 100 | G | 39.2 | Very low | 38.7 | Very low | 55 Ų | 55 | 146.6 Ų | 146.6 | 57% | 0.567 | 79% | 0.788 | S | S | * | * | trans | -56 | 134.9 | 179.4 | 0 | 0 | 0 | 0 | 0 | 112 | N98 F102 | N98-G100 PolarHBondContact O-N 3.09Å; N98-G100 VanDerWaalsContact O-N 3.15Å; G100-F102 WeakPolarHBondContact O-CD2 3.4Å; G100-F102 PolarHBondContact O-N 3.46Å | ||
| 101 | L | 42.2 | Very low | 38.7 | Very low | 163 Ų | 163 | 155.6 Ų | 155.6 | 85% | 0.853 | 80% | 0.801 | S | S | * | * | trans | -52.7 | 92.2 | 168.1 | -158.4 | 142.1 | 0 | 0 | 0 | 108.8 | D103 | L101-D103 PolarHBondContact O-N 3Å; L101-D103 VanDerWaalsContact O-N 3.13Å | ||
| 102 | F | 43.6 | Very low | 39.1 | Very low | 180 Ų | 180 | 155.2 Ų | 155.2 | 79% | 0.789 | 80% | 0.799 | S | S | * | * | trans | -76.9 | 97.1 | 174.6 | -91.3 | -82.8 | 0 | 0 | 0 | 108.8 | G100 R104 | G100-F102 WeakPolarHBondContact O-CD2 3.4Å; G100-F102 PolarHBondContact O-N 3.46Å; F102-R104 PolarHBondContact O-N 3.33Å | ||
| 103 | D | 38.5 | Very low | 39.3 | Very low | 139 Ų | 139 | 155.1 Ų | 155.1 | 74% | 0.743 | 80% | 0.798 | S | S | * | * | trans | -51.2 | 104.2 | 152.3 | -102.8 | -35.4 | 0 | 0 | 0 | 108.5 | L101 | L101-D103 PolarHBondContact O-N 3Å; L101-D103 VanDerWaalsContact O-N 3.13Å | ||
| 104 | R | 40.9 | Very low | 39.4 | Very low | 217 Ų | 217 | 152 Ų | 152 | 82% | 0.819 | 80% | 0.797 | S | S | * | * | trans | -118.1 | 71.5 | 170.5 | -93.9 | -173.2 | 160.8 | -172 | -4.2 | 109.8 | F102 S106 | F102-R104 PolarHBondContact O-N 3.33Å; R104-S106 PolarHBondContact O-N 3.35Å; R104-S106 VanDerWaalsContact O-N 3.17Å | ||
| 105 | T | 35.2 | Very low | 39.8 | Very low | 132 Ų | 132 | 153.4 Ų | 153.4 | 81% | 0.81 | 80% | 0.796 | S | S | * | * | trans | -60.2 | 101.6 | 150.1 | -36.3 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 106 | S | 38.5 | Very low | 40.3 | Very low | 94 Ų | 94 | 154.5 Ų | 154.5 | 66% | 0.657 | 79% | 0.792 | S | S | * | * | trans | -159.2 | 99.5 | 169.9 | -67.3 | 0 | 0 | 0 | 0 | 112.2 | R104 | R104-S106 PolarHBondContact O-N 3.35Å; R104-S106 VanDerWaalsContact O-N 3.17Å | ||
| 107 | H | 32.9 | Very low | 41 | Very low | 194 Ų | 194 | 152.4 Ų | 152.4 | 90% | 0.898 | 79% | 0.785 | S | S | * | * | trans | 38.1 | 91.3 | 140.2 | -66 | -61.1 | 0 | 0 | 0 | 118.6 | ||||
| 108 | S | 37.3 | Very low | 41.9 | Very low | 108 Ų | 108 | 151.4 Ų | 151.4 | 76% | 0.755 | 79% | 0.789 | S | S | * | * | trans | -57.2 | 124.6 | 143.8 | 46.5 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 109 | E | 35.1 | Very low | 42.7 | Very low | 188 Ų | 188 | 149.2 Ų | 149.2 | 88% | 0.879 | 79% | 0.785 | S | S | * | * | trans | 158.1 | 96.7 | 140.7 | -89.1 | 173.8 | -175.7 | 0 | 0 | 111.4 | ||||
| 110 | S | 44.1 | Very low | 43.2 | Very low | 105 Ų | 105 | 148 Ų | 148 | 73% | 0.734 | 77% | 0.771 | S | S | * | * | trans | -167.5 | 92.4 | 140.7 | 53.6 | 0 | 0 | 0 | 0 | 109.1 | T112 | S110-T112 VanDerWaalsContact C-N 3.28Å; S110-T112 PolarHBondContact O-N 3.49Å | ||
| 111 | R | 33.7 | Very low | 44.3 | Very low | 257 Ų | 257 | 151 Ų | 151 | 97% | 0.97 | 77% | 0.774 | S | S | * | * | trans | -74.5 | 81.1 | 168.3 | -178.3 | -178.1 | 179.3 | 175.9 | 0.1 | 108.1 | ||||
| 112 | T | 45.2 | Very low | 45.6 | Very low | 103 Ų | 103 | 147.4 Ų | 147.4 | 63% | 0.632 | 76% | 0.763 | S | S | * | * | trans | -99.8 | 121.9 | 166.9 | 47.9 | 0 | 0 | 0 | 0 | 108.8 | S110 L114 | S110-T112 VanDerWaalsContact C-N 3.28Å; S110-T112 PolarHBondContact O-N 3.49Å; T112-L114 PolarHBondContact O-N 3.36Å | ||
| 113 | E | 41.9 | Very low | 47.1 | Very low | 191 Ų | 191 | 142 Ų | 142 | 89% | 0.893 | 75% | 0.748 | S | S | * | * | trans | -53 | 96.5 | 168.6 | -73.9 | 178.3 | 141.4 | 0 | 0 | 109.5 | K115 | E113-K115 VanDerWaalsContact C-N 3.31Å; E113-K115 PolarHBondContact O-N 3.05Å | ||
| 114 | L | 44.1 | Very low | 48.8 | Very low | 152 Ų | 152 | 138 Ų | 138 | 80% | 0.796 | 73% | 0.73 | S | S | * | * | trans | -73.9 | 91.4 | 170.9 | -73.2 | 169.8 | 0 | 0 | 0 | 107.5 | T112 L116 | T112-L114 PolarHBondContact O-N 3.36Å; L114-L116 PolarHBondContact O-N 3.22Å; L114-L116 VanDerWaalsContact O-N 3.1Å | ||
| 115 | K | 43.4 | Very low | 50.5 | Low | 184 Ų | 184 | 131.1 Ų | 131.1 | 80% | 0.8 | 71% | 0.712 | S | S | * | * | trans | -59.7 | 108.2 | 154.8 | -80.6 | -179.1 | 176 | 177.1 | 0 | 106.7 | E113 D117 | E113-K115 VanDerWaalsContact C-N 3.31Å; E113-K115 PolarHBondContact O-N 3.05Å; K115-D117 PolarHBondContact O-N 3.08Å | ||
| 116 | L | 51.8 | Low | 52.9 | Low | 136 Ų | 136 | 129 Ų | 129 | 71% | 0.712 | 70% | 0.696 | S | S | * | * | trans | -68.2 | 83.7 | 171.8 | -75.6 | 155.9 | 0 | 0 | 0 | 107.8 | L114 L120 | L114-L116 PolarHBondContact O-N 3.22Å; L114-L116 VanDerWaalsContact O-N 3.1Å; L116-L120 HydrophobicContact CD2-CD1 4.34Å | ||
| 117 | D | 52.3 | Low | 54.9 | Low | 137 Ų | 137 | 128.4 Ų | 128.4 | 73% | 0.733 | 69% | 0.691 | S | S | * | * | trans | -67.4 | 131.9 | 160.9 | -93.3 | -53.1 | 0 | 0 | 0 | 107.8 | K115 S119 | K115-D117 PolarHBondContact O-N 3.08Å; D117-S119 PolarHBondContact O-N 2.99Å | ||
| 118 | D | 57.6 | Low | 57.4 | Low | 172 Ų | 172 | 123.3 Ų | 123.3 | 92% | 0.92 | 67% | 0.673 | S | S | * | * | S | Bend | trans | -61.6 | 19.4 | -170.2 | -74.6 | -42.9 | 0 | 0 | 0 | 116 | ||
| 119 | S | 54.1 | Low | 59.9 | Low | 104 Ų | 104 | 121.9 Ų | 121.9 | 73% | 0.727 | 66% | 0.657 | S | S | * | * | trans | -100.7 | 50.1 | 174.4 | 174.8 | 0 | 0 | 0 | 0 | 110.9 | D117 N121 | D117-S119 PolarHBondContact O-N 2.99Å; S119-N121 VanDerWaalsContact C-N 3.32Å; S119-N121 PolarHBondContact O-N 3.13Å | ||
| 120 | L | 55.7 | Low | 62.5 | Low | 97 Ų | 97 | 117.5 Ų | 117.5 | 51% | 0.508 | 64% | 0.639 | S | S | . | * | trans | -72 | 97.2 | 162.9 | -68.5 | 178.2 | 0 | 0 | 0 | 107.5 | L116 S122 V125 | L116-L120 HydrophobicContact CD2-CD1 4.34Å; L120-S122 PolarHBondContact O-N 3.04Å; L120-V125 HydrophobicContact CB-CG2 3.89Å; L120-V125 HydrophobicContact CD1-CG2 4.29Å | ||
| 121 | N | 63 | Low | 64.6 | Low | 117 Ų | 117 | 116 Ų | 116 | 63% | 0.626 | 63% | 0.628 | S | S | * | * | trans | -51.2 | 134.8 | 169.2 | -149 | 5.3 | 0 | 0 | 0 | 107.7 | S119 S123 S124 | S119-N121 VanDerWaalsContact C-N 3.32Å; S119-N121 PolarHBondContact O-N 3.13Å; N121-S123 PolarHBondContact O-N 3.08Å; N121-S124 WeakPolarHBondContact O-CB 3.38Å; N121-S124 PolarHBondContact O-N 3.29Å | ||
| 122 | S | 69.6 | Low | 67.3 | Low | 88 Ų | 88 | 108 Ų | 108 | 62% | 0.615 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -50.3 | -34.5 | -170.7 | 44.5 | 0 | 0 | 0 | 0 | 113.3 | L120 S124 V125 D126 | L120-S122 PolarHBondContact O-N 3.04Å; S122-S124 VanDerWaalsContact C-N 3.32Å; S122-S124 PolarHBondContact O-N 2.66Å; S122-V125 PolarHBondContact O-N 3.29Å; S122-D126 PolarHBondContact O-N 3.07Å; S122-D126 VanDerWaalsContact O-N 3.13Å |
| 123 | S | 73.8 | Confident | 69.6 | Low | 68 Ų | 68 | 110.5 Ų | 110.5 | 48% | 0.476 | 61% | 0.606 | S | S | . | * | H | α-helix | trans | -60.9 | -32.7 | 175.1 | 60.9 | 0 | 0 | 0 | 0 | 114.7 | N121 D126 C127 | N121-S123 PolarHBondContact O-N 3.08Å; S123-D126 PolarHBondContact O-N 3.04Å; S123-C127 PolarHBondContact O-N 3.46Å; S123-C127 VanDerWaalsContact O-N 3.07Å; S123-C127 PolarHBondContact O-SG 3.36Å |
| 124 | S | 74.6 | Confident | 72 | Confident | 53 Ų | 53 | 106.4 Ų | 106.4 | 37% | 0.371 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -71.4 | -34.8 | 177.4 | -173 | 0 | 0 | 0 | 0 | 111.7 | N121 S122 V128 | N121-S124 WeakPolarHBondContact O-CB 3.38Å; N121-S124 PolarHBondContact O-N 3.29Å; S122-S124 VanDerWaalsContact C-N 3.32Å; S122-S124 PolarHBondContact O-N 2.66Å; S124-V128 WeakPolarHBondContact O-CG2 3.4Å; S124-V128 PolarHBondContact O-N 3.29Å |
| 125 | V | 77.5 | Confident | 74.2 | Confident | 73 Ų | 73 | 102.8 Ų | 102.8 | 44% | 0.442 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -68.8 | -40.4 | 175.6 | -178.5 | 0 | 0 | 0 | 0 | 109.8 | L120 S122 V128 L129 | L120-V125 HydrophobicContact CB-CG2 3.89Å; L120-V125 HydrophobicContact CD1-CG2 4.29Å; S122-V125 PolarHBondContact O-N 3.29Å; V125-V128 PolarHBondContact O-N 3.22Å; V125-L129 WeakPolarHBondContact O-CB 3.27Å; V125-L129 PolarHBondContact O-N 2.84Å |
| 126 | D | 84 | Confident | 76.5 | Confident | 88 Ų | 88 | 96.4 Ų | 96.4 | 47% | 0.471 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -61.8 | -44.7 | 176.2 | -66.6 | -31.1 | 0 | 0 | 0 | 111.8 | S122 S123 V128 L129 D130 | S122-D126 PolarHBondContact O-N 3.07Å; S122-D126 VanDerWaalsContact O-N 3.13Å; S123-D126 PolarHBondContact O-N 3.04Å; D126-V128 VanDerWaalsContact C-N 3.34Å; D126-V128 PolarHBondContact O-N 2.71Å; D126-L129 PolarHBondContact O-N 3.23Å; D126-D130 PolarHBondContact O-N 3.13Å |
| 127 | C | 81.2 | Confident | 78.4 | Confident | 81 Ų | 81 | 92.4 Ų | 92.4 | 55% | 0.547 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -62 | -38.5 | 176.6 | -67.5 | 0 | 0 | 0 | 0 | 113.3 | S123 S131 | S123-C127 PolarHBondContact O-N 3.46Å; S123-C127 VanDerWaalsContact O-N 3.07Å; S123-C127 PolarHBondContact O-SG 3.36Å; C127-S131 WeakPolarHBondContact O-CB 3.48Å; C127-S131 PolarHBondContact O-N 2.96Å; C127-S131 VanDerWaalsContact O-N 3.07Å; C127-S131 PolarHBondContact O-OG 3.46Å |
| 128 | V | 85 | Confident | 80.1 | Confident | 87 Ų | 87 | 91.2 Ų | 91.2 | 53% | 0.527 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -68.4 | -42.2 | 175.7 | 172.9 | 0 | 0 | 0 | 0 | 110.3 | S124 V125 D126 D130 S131 V132 | S124-V128 WeakPolarHBondContact O-CG2 3.4Å; S124-V128 PolarHBondContact O-N 3.29Å; V125-V128 PolarHBondContact O-N 3.22Å; D126-V128 VanDerWaalsContact C-N 3.34Å; D126-V128 PolarHBondContact O-N 2.71Å; V128-D130 VanDerWaalsContact C-N 3.34Å; V128-D130 PolarHBondContact O-N 2.73Å; V128-S131 PolarHBondContact O-N 3.33Å; V128-V132 HydrophobicContact CG1-CG2 4.35Å; V128-V132 WeakPolarHBondContact O-CG2 3.17Å; V128-V132 PolarHBondContact O-N 2.93Å |
| 129 | L | 90.4 | Very high | 81.7 | Confident | 79 Ų | 79 | 87.8 Ų | 87.8 | 41% | 0.414 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -61.9 | -42.3 | 178.3 | -166.6 | 77.3 | 0 | 0 | 0 | 111.6 | V125 D126 V132 R133 | V125-L129 WeakPolarHBondContact O-CB 3.27Å; V125-L129 PolarHBondContact O-N 2.84Å; D126-L129 PolarHBondContact O-N 3.23Å; L129-V132 PolarHBondContact O-N 3.26Å; L129-R133 WeakPolarHBondContact O-CB 3.35Å; L129-R133 VanDerWaalsContact O-CG 3.3Å; L129-R133 WeakPolarHBondContact O-CG 3.45Å; L129-R133 PolarHBondContact O-N 3.38Å |
| 130 | D | 89 | Confident | 83.4 | Confident | 96 Ų | 96 | 90.2 Ų | 90.2 | 51% | 0.513 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -65.4 | -40.2 | 176.2 | -75.6 | -17.3 | 0 | 0 | 0 | 111.7 | D126 V128 R133 N134 | D126-D130 PolarHBondContact O-N 3.13Å; V128-D130 VanDerWaalsContact C-N 3.34Å; V128-D130 PolarHBondContact O-N 2.73Å; D130-R133 PolarHBondContact O-N 3.35Å; D130-N134 WeakPolarHBondContact O-CB 3.29Å; D130-N134 PolarHBondContact O-N 3.25Å |
| 131 | S | 89.3 | Confident | 85.1 | Confident | 72 Ų | 72 | 90 Ų | 90 | 50% | 0.503 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -63.2 | -45 | 175 | -58.5 | 0 | 0 | 0 | 0 | 111.7 | C127 V128 R133 N134 V135 | C127-S131 WeakPolarHBondContact O-CB 3.48Å; C127-S131 PolarHBondContact O-N 2.96Å; C127-S131 VanDerWaalsContact O-N 3.07Å; C127-S131 PolarHBondContact O-OG 3.46Å; V128-S131 PolarHBondContact O-N 3.33Å; S131-R133 VanDerWaalsContact C-N 3.34Å; S131-R133 PolarHBondContact O-N 2.97Å; S131-N134 PolarHBondContact O-N 3.47Å; S131-V135 WeakPolarHBondContact O-CG2 3.33Å; S131-V135 PolarHBondContact O-N 2.97Å |
| 132 | V | 89.9 | Confident | 86.3 | Confident | 90 Ų | 90 | 88.4 Ų | 88.4 | 55% | 0.545 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -63.7 | -40.3 | 176.4 | 171.2 | 0 | 0 | 0 | 0 | 111.1 | V128 L129 S136 | V128-V132 HydrophobicContact CG1-CG2 4.35Å; V128-V132 WeakPolarHBondContact O-CG2 3.17Å; V128-V132 PolarHBondContact O-N 2.93Å; L129-V132 PolarHBondContact O-N 3.26Å; V132-S136 WeakPolarHBondContact O-CB 3.16Å; V132-S136 PolarHBondContact O-N 3.05Å |
| 133 | R | 92.4 | Very high | 87.3 | Confident | 156 Ų | 156 | 88.7 Ų | 88.7 | 59% | 0.589 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -64.1 | -41.8 | 175 | -78.9 | 175 | 175.6 | 170.7 | -0.5 | 112 | L129 D130 S131 S136 A137 | L129-R133 WeakPolarHBondContact O-CB 3.35Å; L129-R133 VanDerWaalsContact O-CG 3.3Å; L129-R133 WeakPolarHBondContact O-CG 3.45Å; L129-R133 PolarHBondContact O-N 3.38Å; D130-R133 PolarHBondContact O-N 3.35Å; S131-R133 VanDerWaalsContact C-N 3.34Å; S131-R133 PolarHBondContact O-N 2.97Å; R133-S136 PolarHBondContact O-N 3.06Å; R133-A137 WeakPolarHBondContact O-CB 3.49Å; R133-A137 PolarHBondContact O-N 3.02Å |
| 134 | N | 93 | Very high | 88.2 | Confident | 105 Ų | 105 | 88.7 Ų | 88.7 | 56% | 0.561 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -63.9 | -49.7 | 177.8 | -172.6 | 66.2 | 0 | 0 | 0 | 111.5 | D130 S131 S136 A137 E138 | D130-N134 WeakPolarHBondContact O-CB 3.29Å; D130-N134 PolarHBondContact O-N 3.25Å; S131-N134 PolarHBondContact O-N 3.47Å; N134-S136 VanDerWaalsContact C-N 3.3Å; N134-S136 PolarHBondContact O-N 3.34Å; N134-A137 PolarHBondContact O-N 3.22Å; N134-A137 VanDerWaalsContact O-N 3.16Å; N134-E138 PolarHBondContact O-N 3.16Å |
| 135 | V | 90.5 | Very high | 89 | Confident | 75 Ų | 75 | 90.4 Ų | 90.4 | 46% | 0.455 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -61.4 | -39.9 | 176 | 173.3 | 0 | 0 | 0 | 0 | 111 | S131 A137 E138 I139 | S131-V135 WeakPolarHBondContact O-CG2 3.33Å; S131-V135 PolarHBondContact O-N 2.97Å; V135-A137 VanDerWaalsContact C-N 3.35Å; V135-A137 PolarHBondContact O-N 2.79Å; V135-E138 PolarHBondContact O-N 2.97Å; V135-I139 HydrophobicContact CG1-CD1 3.75Å; V135-I139 HydrophobicContact CG1-CG1 4.35Å; V135-I139 WeakPolarHBondContact O-CB 3.44Å; V135-I139 VanDerWaalsContact O-CG1 3.27Å; V135-I139 WeakPolarHBondContact O-CG1 3.5Å; V135-I139 PolarHBondContact O-N 3.09Å |
| 136 | S | 92.5 | Very high | 89.5 | Confident | 51 Ų | 51 | 88.9 Ų | 88.9 | 36% | 0.357 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -63.9 | -39.2 | 176 | -176.6 | 0 | 0 | 0 | 0 | 112.5 | V132 R133 N134 K140 | V132-S136 WeakPolarHBondContact O-CB 3.16Å; V132-S136 PolarHBondContact O-N 3.05Å; R133-S136 PolarHBondContact O-N 3.06Å; N134-S136 VanDerWaalsContact C-N 3.3Å; N134-S136 PolarHBondContact O-N 3.34Å; S136-K140 WeakPolarHBondContact O-CG 3.5Å; S136-K140 PolarHBondContact O-N 3.01Å; S136-K140 VanDerWaalsContact O-N 3.11Å |
| 137 | A | 90.1 | Very high | 89.8 | Confident | 52 Ų | 52 | 90.2 Ų | 90.2 | 43% | 0.43 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -66.3 | -43.5 | 175.5 | 0 | 0 | 0 | 0 | 0 | 111.2 | R133 N134 V135 K140 T141 | R133-A137 WeakPolarHBondContact O-CB 3.49Å; R133-A137 PolarHBondContact O-N 3.02Å; N134-A137 PolarHBondContact O-N 3.22Å; N134-A137 VanDerWaalsContact O-N 3.16Å; V135-A137 VanDerWaalsContact C-N 3.35Å; V135-A137 PolarHBondContact O-N 2.79Å; A137-K140 WeakPolarHBondContact O-CB 3.26Å; A137-K140 PolarHBondContact O-N 2.94Å; A137-T141 WeakPolarHBondContact O-CG2 3.49Å; A137-T141 PolarHBondContact O-N 2.78Å; A137-T141 VanDerWaalsContact O-N 3.15Å |
| 138 | E | 89.5 | Confident | 90.2 | Very high | 111 Ų | 111 | 89.2 Ų | 89.2 | 52% | 0.519 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -61.4 | -48.5 | 177.1 | -171.2 | 175.4 | 178.2 | 0 | 0 | 111.7 | N134 V135 K140 T141 V142 | N134-E138 PolarHBondContact O-N 3.16Å; V135-E138 PolarHBondContact O-N 2.97Å; E138-K140 VanDerWaalsContact C-N 3.28Å; E138-K140 PolarHBondContact O-N 3.25Å; E138-T141 WeakPolarHBondContact O-CA 3.32Å; E138-T141 PolarHBondContact O-N 3.35Å; E138-T141 PolarHBondContact O-OG1 3.28Å; E138-V142 HydrophobicContact CG-CG2 4.38Å; E138-V142 WeakPolarHBondContact O-CG2 3.48Å; E138-V142 PolarHBondContact O-N 3.38Å |
| 139 | I | 89.9 | Confident | 90.3 | Very high | 100 Ų | 100 | 90.7 Ų | 90.7 | 51% | 0.513 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -57.3 | -42 | 176.1 | -70.1 | 168.2 | 0 | 0 | 0 | 111.1 | V135 T141 V142 L143 | V135-I139 HydrophobicContact CG1-CD1 3.75Å; V135-I139 HydrophobicContact CG1-CG1 4.35Å; V135-I139 WeakPolarHBondContact O-CB 3.44Å; V135-I139 VanDerWaalsContact O-CG1 3.27Å; V135-I139 WeakPolarHBondContact O-CG1 3.5Å; V135-I139 PolarHBondContact O-N 3.09Å; I139-T141 PolarHBondContact O-N 3.23Å; I139-V142 PolarHBondContact O-N 2.77Å; I139-L143 VanDerWaalsContact O-CB 3.26Å; I139-L143 WeakPolarHBondContact O-CB 3.49Å; I139-L143 PolarHBondContact O-N 3.27Å |
| 140 | K | 89.9 | Confident | 90.1 | Very high | 156 Ų | 156 | 92.1 Ų | 92.1 | 68% | 0.678 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -63.7 | -26.4 | 176.9 | -78.8 | 176.4 | -179.3 | 178 | 0 | 113.3 | S136 A137 E138 P144 | S136-K140 WeakPolarHBondContact O-CG 3.5Å; S136-K140 PolarHBondContact O-N 3.01Å; S136-K140 VanDerWaalsContact O-N 3.11Å; A137-K140 WeakPolarHBondContact O-CB 3.26Å; A137-K140 PolarHBondContact O-N 2.94Å; E138-K140 VanDerWaalsContact C-N 3.28Å; E138-K140 PolarHBondContact O-N 3.25Å; K140-P144 WeakPolarHBondContact O-CD 3.37Å; K140-P144 WeakPolarHBondContact O-CG 3.24Å |
| 141 | T | 91.3 | Very high | 89.9 | Confident | 92 Ų | 92 | 90.1 Ų | 90.1 | 56% | 0.564 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -86.3 | -34.4 | 176.8 | 59.1 | 0 | 0 | 0 | 0 | 113.2 | A137 E138 I139 | A137-T141 WeakPolarHBondContact O-CG2 3.49Å; A137-T141 PolarHBondContact O-N 2.78Å; A137-T141 VanDerWaalsContact O-N 3.15Å; E138-T141 WeakPolarHBondContact O-CA 3.32Å; E138-T141 PolarHBondContact O-N 3.35Å; E138-T141 PolarHBondContact O-OG1 3.28Å; I139-T141 PolarHBondContact O-N 3.23Å |
| 142 | V | 89.5 | Confident | 89.6 | Confident | 83 Ų | 83 | 93.6 Ų | 93.6 | 50% | 0.503 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -82.5 | -37.2 | -176.5 | 176.8 | 0 | 0 | 0 | 0 | 112.2 | E138 I139 V145 A146 | E138-V142 HydrophobicContact CG-CG2 4.38Å; E138-V142 WeakPolarHBondContact O-CG2 3.48Å; E138-V142 PolarHBondContact O-N 3.38Å; I139-V142 PolarHBondContact O-N 2.77Å; V142-V145 PolarHBondContact O-N 3.46Å; V142-A146 PolarHBondContact O-N 3.3Å |
| 143 | L | 90.5 | Very high | 89.2 | Confident | 94 Ų | 94 | 94.6 Ų | 94.6 | 49% | 0.492 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -54.7 | -50.2 | -178.9 | -172.4 | 69.3 | 0 | 0 | 0 | 114 | I139 V145 A146 E147 | I139-L143 VanDerWaalsContact O-CB 3.26Å; I139-L143 WeakPolarHBondContact O-CB 3.49Å; I139-L143 PolarHBondContact O-N 3.27Å; L143-V145 VanDerWaalsContact C-N 3.3Å; L143-V145 PolarHBondContact O-N 3.42Å; L143-A146 PolarHBondContact O-N 2.91Å; L143-E147 HydrophobicContact CG-CG 4.5Å; L143-E147 WeakPolarHBondContact O-CG 3.43Å; L143-E147 PolarHBondContact O-N 2.97Å |
| 144 | P | 91.3 | Very high | 88.7 | Confident | 68 Ų | 68 | 90.1 Ų | 90.1 | 44% | 0.442 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -66.8 | -30.2 | -179.4 | 26.1 | -35.5 | 0 | 0 | 0 | 113.1 | K140 S148 | K140-P144 WeakPolarHBondContact O-CD 3.37Å; K140-P144 WeakPolarHBondContact O-CG 3.24Å; P144-S148 WeakPolarHBondContact O-CB 3.28Å; P144-S148 PolarHBondContact O-N 3.05Å; P144-S148 PolarHBondContact O-OG 3.04Å |
| 145 | V | 91.5 | Very high | 88.1 | Confident | 90 Ų | 90 | 89.5 Ų | 89.5 | 55% | 0.545 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -65.8 | -48.4 | 175.5 | 178.3 | 0 | 0 | 0 | 0 | 109.6 | V142 L143 E147 S148 E149 | V142-V145 PolarHBondContact O-N 3.46Å; L143-V145 VanDerWaalsContact C-N 3.3Å; L143-V145 PolarHBondContact O-N 3.42Å; V145-E147 PolarHBondContact O-N 2.8Å; V145-S148 PolarHBondContact O-N 2.95Å; V145-S148 PolarHBondContact O-OG 3.48Å; V145-E149 PolarHBondContact O-N 3.13Å |
| 146 | A | 88.2 | Confident | 87.2 | Confident | 41 Ų | 41 | 92.3 Ų | 92.3 | 34% | 0.339 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -62.5 | -41.3 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.4 | V142 L143 S148 E149 I150 | V142-A146 PolarHBondContact O-N 3.3Å; L143-A146 PolarHBondContact O-N 2.91Å; A146-S148 VanDerWaalsContact C-N 3.33Å; A146-S148 PolarHBondContact O-N 3.26Å; A146-E149 PolarHBondContact O-N 2.98Å; A146-I150 VanDerWaalsContact O-CG1 3.28Å; A146-I150 WeakPolarHBondContact O-CG1 3.35Å; A146-I150 PolarHBondContact O-N 2.89Å |
| 147 | E | 90.6 | Very high | 86.4 | Confident | 116 Ų | 116 | 97.8 Ų | 97.8 | 54% | 0.542 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -62.1 | -39.8 | 175.6 | -73.8 | 177 | 171.8 | 0 | 0 | 112 | L143 V145 A151 | L143-E147 HydrophobicContact CG-CG 4.5Å; L143-E147 WeakPolarHBondContact O-CG 3.43Å; L143-E147 PolarHBondContact O-N 2.97Å; V145-E147 PolarHBondContact O-N 2.8Å; E147-A151 WeakPolarHBondContact O-CB 3.47Å; E147-A151 PolarHBondContact O-N 3.36Å |
| 148 | S | 90.2 | Very high | 85.4 | Confident | 60 Ų | 60 | 101.9 Ų | 101.9 | 42% | 0.42 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -66.8 | -40.3 | 176.7 | 69.5 | 0 | 0 | 0 | 0 | 112.9 | P144 V145 A146 A151 E152 | P144-S148 WeakPolarHBondContact O-CB 3.28Å; P144-S148 PolarHBondContact O-N 3.05Å; P144-S148 PolarHBondContact O-OG 3.04Å; V145-S148 PolarHBondContact O-N 2.95Å; V145-S148 PolarHBondContact O-OG 3.48Å; A146-S148 VanDerWaalsContact C-N 3.33Å; A146-S148 PolarHBondContact O-N 3.26Å; S148-A151 WeakPolarHBondContact O-CB 3.28Å; S148-A151 PolarHBondContact O-N 2.96Å; S148-E152 WeakPolarHBondContact O-CG 3.43Å; S148-E152 PolarHBondContact O-N 3.43Å |
| 149 | E | 87.2 | Confident | 84.3 | Confident | 117 Ų | 117 | 100 Ų | 100 | 55% | 0.547 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -64.9 | -41.8 | 177.3 | -172 | 178.6 | 179.9 | 0 | 0 | 111.4 | V145 A146 A151 E152 L153 | V145-E149 PolarHBondContact O-N 3.13Å; A146-E149 PolarHBondContact O-N 2.98Å; E149-A151 VanDerWaalsContact C-N 3.32Å; E149-A151 PolarHBondContact O-N 2.78Å; E149-E152 PolarHBondContact O-N 2.84Å; E149-L153 HydrophobicContact CG-CD1 4.42Å; E149-L153 WeakPolarHBondContact O-CB 3.47Å; E149-L153 WeakPolarHBondContact O-CG 3.44Å; E149-L153 PolarHBondContact O-N 3.5Å |
| 150 | I | 85.6 | Confident | 83 | Confident | 109 Ų | 109 | 97.6 Ų | 97.6 | 56% | 0.559 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -63.7 | -39.6 | 175.4 | -67.3 | 165.9 | 0 | 0 | 0 | 111.1 | A146 S154 | A146-I150 VanDerWaalsContact O-CG1 3.28Å; A146-I150 WeakPolarHBondContact O-CG1 3.35Å; A146-I150 PolarHBondContact O-N 2.89Å; I150-S154 WeakPolarHBondContact O-CB 3.41Å; I150-S154 PolarHBondContact O-N 3.11Å; I150-S154 PolarHBondContact O-OG 3.48Å |
| 151 | A | 85.7 | Confident | 81.7 | Confident | 55 Ų | 55 | 96.6 Ų | 96.6 | 46% | 0.455 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -64.1 | -44 | 176.6 | 0 | 0 | 0 | 0 | 0 | 111.5 | E147 S148 E149 S154 V155 | E147-A151 WeakPolarHBondContact O-CB 3.47Å; E147-A151 PolarHBondContact O-N 3.36Å; S148-A151 WeakPolarHBondContact O-CB 3.28Å; S148-A151 PolarHBondContact O-N 2.96Å; E149-A151 VanDerWaalsContact C-N 3.32Å; E149-A151 PolarHBondContact O-N 2.78Å; A151-S154 WeakPolarHBondContact O-CB 3.44Å; A151-S154 PolarHBondContact O-N 3.16Å; A151-V155 WeakPolarHBondContact O-CG2 3.44Å; A151-V155 PolarHBondContact O-N 3.41Å; A151-V155 VanDerWaalsContact O-N 3.09Å |
| 152 | E | 83.4 | Confident | 80.4 | Confident | 145 Ų | 145 | 97.3 Ų | 97.3 | 68% | 0.678 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -63.7 | -44.6 | 176.9 | -73.9 | -173.4 | 174.3 | 0 | 0 | 112.5 | S148 E149 S154 V155 H156 | S148-E152 WeakPolarHBondContact O-CG 3.43Å; S148-E152 PolarHBondContact O-N 3.43Å; E149-E152 PolarHBondContact O-N 2.84Å; E152-S154 VanDerWaalsContact C-N 3.25Å; E152-S154 PolarHBondContact O-N 3.33Å; E152-V155 PolarHBondContact O-N 3.49Å; E152-H156 PolarHBondContact O-N 3.45Å |
| 153 | L | 81 | Confident | 78.8 | Confident | 111 Ų | 111 | 103.3 Ų | 103.3 | 58% | 0.581 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -62.1 | -35 | 175.9 | -71.3 | 175.3 | 0 | 0 | 0 | 112.1 | E149 H156 R157 | E149-L153 HydrophobicContact CG-CD1 4.42Å; E149-L153 WeakPolarHBondContact O-CB 3.47Å; E149-L153 WeakPolarHBondContact O-CG 3.44Å; E149-L153 PolarHBondContact O-N 3.5Å; L153-H156 PolarHBondContact O-N 3.21Å; L153-R157 WeakPolarHBondContact O-CB 3.23Å; L153-R157 PolarHBondContact O-N 3.42Å |
| 154 | S | 81.1 | Confident | 77.2 | Confident | 62 Ų | 62 | 107.4 Ų | 107.4 | 43% | 0.434 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -66 | -44.3 | 176.5 | -60.7 | 0 | 0 | 0 | 0 | 111.4 | I150 A151 E152 H156 R157 E158 | I150-S154 WeakPolarHBondContact O-CB 3.41Å; I150-S154 PolarHBondContact O-N 3.11Å; I150-S154 PolarHBondContact O-OG 3.48Å; A151-S154 WeakPolarHBondContact O-CB 3.44Å; A151-S154 PolarHBondContact O-N 3.16Å; E152-S154 VanDerWaalsContact C-N 3.25Å; E152-S154 PolarHBondContact O-N 3.33Å; S154-H156 VanDerWaalsContact C-N 3.34Å; S154-H156 PolarHBondContact O-N 3.3Å; S154-R157 PolarHBondContact O-N 2.96Å; S154-E158 PolarHBondContact O-N 2.77Å |
| 155 | V | 80.7 | Confident | 75.4 | Confident | 92 Ų | 92 | 109.3 Ų | 109.3 | 56% | 0.558 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -62.6 | -40.9 | 175.1 | 174.8 | 0 | 0 | 0 | 0 | 111.3 | A151 E152 E158 S159 | A151-V155 WeakPolarHBondContact O-CG2 3.44Å; A151-V155 PolarHBondContact O-N 3.41Å; A151-V155 VanDerWaalsContact O-N 3.09Å; E152-V155 PolarHBondContact O-N 3.49Å; V155-E158 PolarHBondContact O-N 3.19Å; V155-S159 WeakPolarHBondContact O-CB 3.34Å; V155-S159 PolarHBondContact O-N 3.47Å; V155-S159 PolarHBondContact O-OG 2.94Å |
| 156 | H | 72.4 | Confident | 73.6 | Confident | 133 Ų | 133 | 111.1 Ų | 111.1 | 62% | 0.616 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -66.3 | -39 | 177.4 | -168.6 | -53.3 | 0 | 0 | 0 | 111.7 | E152 L153 S154 S159 A160 | E152-H156 PolarHBondContact O-N 3.45Å; L153-H156 PolarHBondContact O-N 3.21Å; S154-H156 VanDerWaalsContact C-N 3.34Å; S154-H156 PolarHBondContact O-N 3.3Å; H156-S159 PolarHBondContact O-N 2.98Å; H156-A160 WeakPolarHBondContact O-CB 3.46Å; H156-A160 PolarHBondContact O-N 2.91Å |
| 157 | R | 74.1 | Confident | 71.8 | Confident | 166 Ų | 166 | 115.9 Ų | 115.9 | 63% | 0.626 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -63.8 | -45.4 | 177.4 | -175.6 | -179.9 | 177.6 | -170.8 | -0.7 | 111.5 | L153 S154 S159 A160 L161 | L153-R157 WeakPolarHBondContact O-CB 3.23Å; L153-R157 PolarHBondContact O-N 3.42Å; S154-R157 PolarHBondContact O-N 2.96Å; R157-S159 VanDerWaalsContact C-N 3.34Å; R157-A160 PolarHBondContact O-N 3.41Å; R157-L161 HydrophobicContact CG-CD1 4.46Å; R157-L161 WeakPolarHBondContact O-CG 3.49Å; R157-L161 PolarHBondContact O-N 3.17Å; R157-L161 VanDerWaalsContact O-N 3.13Å |
| 158 | E | 70.2 | Confident | 70.1 | Confident | 139 Ų | 139 | 116.4 Ų | 116.4 | 65% | 0.65 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -62.9 | -42.5 | 175.4 | -71.3 | -170.7 | 168.2 | 0 | 0 | 111.3 | S154 V155 A160 L161 C162 | S154-E158 PolarHBondContact O-N 2.77Å; V155-E158 PolarHBondContact O-N 3.19Å; E158-A160 VanDerWaalsContact C-N 3.29Å; E158-A160 PolarHBondContact O-N 3.35Å; E158-L161 PolarHBondContact O-N 3.02Å; E158-L161 VanDerWaalsContact O-N 3.16Å; E158-C162 WeakPolarHBondContact O-CB 3.42Å; E158-C162 PolarHBondContact O-N 2.83Å; E158-C162 PolarHBondContact O-SG 2.75Å |
| 159 | S | 66.9 | Low | 68.5 | Low | 70 Ų | 70 | 116.8 Ų | 116.8 | 49% | 0.49 | 61% | 0.61 | S | S | . | * | H | α-helix | trans | -61.3 | -36.1 | 176.3 | -60.3 | 0 | 0 | 0 | 0 | 112.9 | V155 H156 R157 C162 R163 | V155-S159 WeakPolarHBondContact O-CB 3.34Å; V155-S159 PolarHBondContact O-N 3.47Å; V155-S159 PolarHBondContact O-OG 2.94Å; H156-S159 PolarHBondContact O-N 2.98Å; R157-S159 VanDerWaalsContact C-N 3.34Å; S159-C162 PolarHBondContact O-N 3.22Å; S159-R163 PolarHBondContact O-N 3.25Å |
| 160 | A | 62.4 | Low | 66.9 | Low | 50 Ų | 50 | 118.2 Ų | 118.2 | 41% | 0.413 | 62% | 0.616 | S | S | . | * | H | α-helix | trans | -69.6 | -36.9 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | H156 R157 E158 R163 | H156-A160 WeakPolarHBondContact O-CB 3.46Å; H156-A160 PolarHBondContact O-N 2.91Å; R157-A160 PolarHBondContact O-N 3.41Å; E158-A160 VanDerWaalsContact C-N 3.29Å; E158-A160 PolarHBondContact O-N 3.35Å; A160-R163 PolarHBondContact O-N 3.1Å |
| 161 | L | 61.8 | Low | 65.4 | Low | 135 Ų | 135 | 116.4 Ų | 116.4 | 71% | 0.707 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -75.4 | -27.9 | 176.4 | -67.5 | 172.4 | 0 | 0 | 0 | 112.5 | R157 E158 R163 | R157-L161 HydrophobicContact CG-CD1 4.46Å; R157-L161 WeakPolarHBondContact O-CG 3.49Å; R157-L161 PolarHBondContact O-N 3.17Å; R157-L161 VanDerWaalsContact O-N 3.13Å; E158-L161 PolarHBondContact O-N 3.02Å; E158-L161 VanDerWaalsContact O-N 3.16Å; L161-R163 PolarHBondContact O-N 3.42Å |
| 162 | C | 64.3 | Low | 63.8 | Low | 107 Ų | 107 | 119.2 Ų | 119.2 | 72% | 0.723 | 62% | 0.615 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77.9 | 2.9 | 173 | -72.1 | 0 | 0 | 0 | 0 | 113.9 | E158 S159 K164 | E158-C162 WeakPolarHBondContact O-CB 3.42Å; E158-C162 PolarHBondContact O-N 2.83Å; E158-C162 PolarHBondContact O-SG 2.75Å; S159-C162 PolarHBondContact O-N 3.22Å; C162-K164 PolarHBondContact O-N 3.43Å |
| 163 | R | 56 | Low | 62.5 | Low | 210 Ų | 210 | 119.8 Ų | 119.8 | 79% | 0.792 | 62% | 0.615 | S | S | * | * | S | Bend | trans | -65.8 | 91 | 163.4 | -71.3 | -169.9 | -179.2 | -179 | 2.3 | 107.9 | S159 A160 L161 S165 | S159-R163 PolarHBondContact O-N 3.25Å; A160-R163 PolarHBondContact O-N 3.1Å; L161-R163 PolarHBondContact O-N 3.42Å; R163-S165 PolarHBondContact O-N 3.45Å |
| 164 | K | 56.4 | Low | 61.3 | Low | 179 Ų | 179 | 118.6 Ų | 118.6 | 78% | 0.778 | 61% | 0.613 | S | S | * | * | trans | 2.3 | 103.9 | 163.6 | -169.9 | 172.5 | -174.1 | 177.3 | 0 | 110.8 | C162 L166 | C162-K164 PolarHBondContact O-N 3.43Å; K164-L166 VanDerWaalsContact C-N 3.34Å; K164-L166 PolarHBondContact O-N 3.48Å | ||
| 165 | S | 54.7 | Low | 60 | Low | 108 Ų | 108 | 119 Ų | 119 | 76% | 0.755 | 61% | 0.612 | S | S | * | * | trans | -36.5 | 104.5 | 168.2 | -53.3 | 0 | 0 | 0 | 0 | 107.4 | R163 E167 | R163-S165 PolarHBondContact O-N 3.45Å; S165-E167 PolarHBondContact O-N 3.02Å | ||
| 166 | L | 51.8 | Low | 58.7 | Low | 129 Ų | 129 | 119.6 Ų | 119.6 | 68% | 0.675 | 61% | 0.609 | S | S | * | * | trans | -55.2 | 113.6 | 178.6 | -164.9 | 95.4 | 0 | 0 | 0 | 103.7 | K164 L168 V171 | K164-L166 VanDerWaalsContact C-N 3.34Å; K164-L166 PolarHBondContact O-N 3.48Å; L166-L168 VanDerWaalsContact C-N 3.33Å; L166-L168 PolarHBondContact O-N 3Å; L166-V171 HydrophobicContact CD2-CG2 4.08Å | ||
| 167 | E | 51.9 | Low | 57.8 | Low | 140 Ų | 140 | 116.7 Ų | 116.7 | 65% | 0.654 | 61% | 0.608 | S | S | * | * | trans | -58.8 | 105.2 | -173.7 | -68.4 | -168.1 | 172.4 | 0 | 0 | 106.9 | S165 P169 E170 | S165-E167 PolarHBondContact O-N 3.02Å; E167-P169 HydrophobicContact CB-CG 3.63Å; E167-P169 VanDerWaalsContact O-CD 3.26Å; E167-P169 WeakPolarHBondContact O-CD 3.26Å; E167-E170 PolarHBondContact O-N 3.31Å | ||
| 168 | L | 55.1 | Low | 56.9 | Low | 127 Ų | 127 | 113 Ų | 113 | 67% | 0.665 | 60% | 0.604 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -43.6 | -22.9 | 173.2 | -84.5 | 152.1 | 0 | 0 | 0 | 115.4 | L166 E170 V171 M172 | L166-L168 VanDerWaalsContact C-N 3.33Å; L166-L168 PolarHBondContact O-N 3Å; L168-E170 PolarHBondContact O-N 3.46Å; L168-V171 PolarHBondContact O-N 3.22Å; L168-M172 PolarHBondContact O-N 3.46Å; L168-M172 VanDerWaalsContact O-N 3.16Å |
| 169 | P | 56.1 | Low | 56.1 | Low | 69 Ų | 69 | 111.4 Ų | 111.4 | 45% | 0.448 | 60% | 0.596 | S | S | . | * | H | α-helix | trans | -54 | -29.9 | 169.4 | 15.8 | -34.6 | 0 | 0 | 0 | 115.7 | E167 K173 | E167-P169 HydrophobicContact CB-CG 3.63Å; E167-P169 VanDerWaalsContact O-CD 3.26Å; E167-P169 WeakPolarHBondContact O-CD 3.26Å; P169-K173 WeakPolarHBondContact O-CG 3.17Å; P169-K173 PolarHBondContact O-N 3.35Å |
| 170 | E | 53.5 | Low | 55.4 | Low | 147 Ų | 147 | 114.3 Ų | 114.3 | 69% | 0.687 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -77.7 | -39.4 | -177.1 | -151.4 | 168.5 | -150.4 | 0 | 0 | 111.9 | E167 L168 K173 T174 | E167-E170 PolarHBondContact O-N 3.31Å; L168-E170 PolarHBondContact O-N 3.46Å; E170-K173 PolarHBondContact O-N 3.43Å; E170-T174 PolarHBondContact O-N 3.37Å |
| 171 | V | 53.2 | Low | 55.1 | Low | 70 Ų | 70 | 121.7 Ų | 121.7 | 42% | 0.424 | 62% | 0.624 | S | S | . | * | H | α-helix | trans | -67.9 | -42.8 | 176.9 | -177 | 0 | 0 | 0 | 0 | 110.9 | L166 L168 K173 T174 V175 | L166-V171 HydrophobicContact CD2-CG2 4.08Å; L168-V171 PolarHBondContact O-N 3.22Å; V171-K173 VanDerWaalsContact C-N 3.3Å; V171-K173 PolarHBondContact O-N 2.95Å; V171-T174 PolarHBondContact O-N 3.42Å; V171-T174 PolarHBondContact O-OG1 2.78Å; V171-V175 PolarHBondContact O-N 3.37Å |
| 172 | M | 53.2 | Low | 54.8 | Low | 115 Ų | 115 | 120.4 Ų | 120.4 | 57% | 0.567 | 62% | 0.621 | S | S | * | * | H | α-helix | trans | -64.1 | -33 | 179.3 | -75.2 | -163.2 | 84.1 | 0 | 0 | 113.2 | L168 T174 V175 H176 | L168-M172 PolarHBondContact O-N 3.46Å; L168-M172 VanDerWaalsContact O-N 3.16Å; M172-T174 VanDerWaalsContact C-N 3.33Å; M172-T174 PolarHBondContact O-N 3.05Å; M172-V175 PolarHBondContact O-N 3.32Å; M172-H176 PolarHBondContact O-CD2 2.75Å; M172-H176 VanDerWaalsContact O-CD2 3.27Å; M172-H176 PolarHBondContact O-N 3.46Å |
| 173 | K | 55.2 | Low | 54.4 | Low | 157 Ų | 157 | 125.2 Ų | 125.2 | 68% | 0.683 | 63% | 0.625 | S | S | * | * | H | α-helix | trans | -65.2 | -36.5 | 175.9 | -75.6 | 175 | -176.4 | 177.6 | 0 | 112.4 | P169 E170 V171 A177 | P169-K173 WeakPolarHBondContact O-CG 3.17Å; P169-K173 PolarHBondContact O-N 3.35Å; E170-K173 PolarHBondContact O-N 3.43Å; V171-K173 VanDerWaalsContact C-N 3.3Å; V171-K173 PolarHBondContact O-N 2.95Å; K173-A177 PolarHBondContact O-N 3.16Å |
| 174 | T | 56.2 | Low | 54.3 | Low | 86 Ų | 86 | 122.3 Ų | 122.3 | 53% | 0.528 | 63% | 0.625 | S | S | . | * | H | α-helix | trans | -69.3 | -33.5 | 178 | 58.8 | 0 | 0 | 0 | 0 | 112.9 | E170 V171 M172 T178 | E170-T174 PolarHBondContact O-N 3.37Å; V171-T174 PolarHBondContact O-N 3.42Å; V171-T174 PolarHBondContact O-OG1 2.78Å; M172-T174 VanDerWaalsContact C-N 3.33Å; M172-T174 PolarHBondContact O-N 3.05Å; T174-T178 PolarHBondContact O-N 2.89Å |
| 175 | V | 54.9 | Low | 53.9 | Low | 69 Ų | 69 | 117.1 Ų | 117.1 | 42% | 0.418 | 61% | 0.612 | S | S | . | * | H | α-helix | trans | -65.4 | -47.5 | 177.2 | 178 | 0 | 0 | 0 | 0 | 110.7 | V171 M172 A177 T178 E179 | V171-V175 PolarHBondContact O-N 3.37Å; M172-V175 PolarHBondContact O-N 3.32Å; V175-A177 VanDerWaalsContact C-N 3.33Å; V175-A177 PolarHBondContact O-N 3.33Å; V175-T178 PolarHBondContact O-N 3.18Å; V175-T178 VanDerWaalsContact O-N 3.1Å; V175-T178 PolarHBondContact O-OG1 3.43Å; V175-E179 PolarHBondContact O-N 2.74Å |
| 176 | H | 51.4 | Low | 53.6 | Low | 106 Ų | 106 | 116.4 Ų | 116.4 | 49% | 0.491 | 61% | 0.607 | S | S | . | * | H | α-helix | trans | -66.2 | -32.4 | -179.4 | -68.5 | -49.5 | 0 | 0 | 0 | 113.7 | M172 T178 E179 | M172-H176 PolarHBondContact O-CD2 2.75Å; M172-H176 VanDerWaalsContact O-CD2 3.27Å; M172-H176 PolarHBondContact O-N 3.46Å; H176-T178 PolarHBondContact O-N 3.05Å; H176-E179 IonicContact ND1-OE2 3.31Å; H176-E179 PolarHBondContact ND1-OE2 3.42Å; H176-E179 PolarHBondContact O-N 3.23Å |
| 177 | A | 54.9 | Low | 53.5 | Low | 71 Ų | 71 | 117.3 Ų | 117.3 | 59% | 0.587 | 61% | 0.611 | S | S | * | * | H | α-helix | trans | -67.4 | -24.5 | 175.1 | 0 | 0 | 0 | 0 | 0 | 113.2 | K173 V175 | K173-A177 PolarHBondContact O-N 3.16Å; V175-A177 VanDerWaalsContact C-N 3.33Å; V175-A177 PolarHBondContact O-N 3.33Å |
| 178 | T | 54.1 | Low | 53.4 | Low | 89 Ų | 89 | 116.7 Ų | 116.7 | 55% | 0.546 | 61% | 0.612 | S | S | . | * | H | α-helix | trans | -85.7 | -29 | 176.3 | 56.6 | 0 | 0 | 0 | 0 | 113.5 | T174 V175 H176 R181 | T174-T178 PolarHBondContact O-N 2.89Å; V175-T178 PolarHBondContact O-N 3.18Å; V175-T178 VanDerWaalsContact O-N 3.1Å; V175-T178 PolarHBondContact O-OG1 3.43Å; H176-T178 PolarHBondContact O-N 3.05Å; T178-R181 PolarHBondContact O-N 2.8Å |
| 179 | E | 53.8 | Low | 53.1 | Low | 106 Ų | 106 | 116.3 Ų | 116.3 | 50% | 0.495 | 62% | 0.617 | S | S | . | * | H | α-helix | trans | -67.2 | -42.1 | 178.8 | -75.6 | 178.5 | 150.6 | 0 | 0 | 112.4 | V175 H176 R181 V182 Y183 | V175-E179 PolarHBondContact O-N 2.74Å; H176-E179 IonicContact ND1-OE2 3.31Å; H176-E179 PolarHBondContact ND1-OE2 3.42Å; H176-E179 PolarHBondContact O-N 3.23Å; E179-R181 PolarHBondContact O-N 2.71Å; E179-V182 PolarHBondContact O-N 3.39Å; E179-Y183 PolarHBondContact O-N 2.75Å |
| 180 | D | 53.2 | Low | 52.6 | Low | 130 Ų | 130 | 116.7 Ų | 116.7 | 70% | 0.695 | 63% | 0.626 | S | S | * | * | H | α-helix | trans | -61.5 | -31.8 | 179 | -99.1 | -1.5 | 0 | 0 | 0 | 112.4 | V182 | D180-V182 VanDerWaalsContact C-N 3.32Å; D180-V182 PolarHBondContact O-N 2.83Å |
| 181 | R | 54.7 | Low | 52.3 | Low | 206 Ų | 206 | 118.5 Ų | 118.5 | 78% | 0.777 | 64% | 0.635 | S | S | * | * | H | α-helix | trans | -76 | -21.5 | -177.8 | -138.8 | 175.8 | 176.2 | -166.6 | -2.5 | 113.3 | T178 E179 S185 | T178-R181 PolarHBondContact O-N 2.8Å; E179-R181 PolarHBondContact O-N 2.71Å; R181-S185 PolarHBondContact O-OG 3.22Å; R181-S185 VanDerWaalsContact O-OG 3.05Å |
| 182 | V | 56.6 | Low | 51.9 | Low | 107 Ų | 107 | 120.5 Ų | 120.5 | 65% | 0.648 | 65% | 0.647 | S | S | * | * | H | α-helix | trans | -83.2 | -31.4 | 178.4 | -179.4 | 0 | 0 | 0 | 0 | 111 | E179 D180 S185 | E179-V182 PolarHBondContact O-N 3.39Å; D180-V182 VanDerWaalsContact C-N 3.32Å; D180-V182 PolarHBondContact O-N 2.83Å; V182-S185 PolarHBondContact O-N 2.87Å |
| 183 | Y | 54.5 | Low | 51.5 | Low | 208 Ų | 208 | 119 Ų | 119 | 82% | 0.816 | 65% | 0.653 | S | S | * | * | H | α-helix | trans | -72.4 | -31.2 | 179.6 | -95.2 | -82.1 | 0 | 0 | 0 | 114.2 | E179 S185 | E179-Y183 PolarHBondContact O-N 2.75Å; Y183-S185 VanDerWaalsContact C-N 3.31Å |
| 184 | D | 54.5 | Low | 51 | Low | 149 Ų | 149 | 119.8 Ų | 119.8 | 80% | 0.797 | 66% | 0.657 | S | S | * | * | S | Bend | trans | -81.8 | -11.8 | 175.9 | -90.7 | -10.5 | 0 | 0 | 0 | 113.8 | S186 | D184-S186 PolarHBondContact O-N 3.39Š|
| 185 | S | 49.4 | Very low | 50.5 | Low | 70 Ų | 70 | 120.8 Ų | 120.8 | 49% | 0.49 | 67% | 0.667 | S | S | . | * | trans | -77.7 | 77.4 | 170.7 | -58.5 | 0 | 0 | 0 | 0 | 108 | R181 V182 Y183 I187 | R181-S185 PolarHBondContact O-OG 3.22Å; R181-S185 VanDerWaalsContact O-OG 3.05Å; V182-S185 PolarHBondContact O-N 2.87Å; Y183-S185 VanDerWaalsContact C-N 3.31Å; S185-I187 PolarHBondContact O-N 3.1Å | ||
| 186 | S | 47.8 | Very low | 50.3 | Low | 93 Ų | 93 | 123.6 Ų | 123.6 | 65% | 0.65 | 68% | 0.684 | S | S | * | * | trans | -58.5 | 95 | 158.6 | 66.6 | 0 | 0 | 0 | 0 | 106.4 | D184 N188 | D184-S186 PolarHBondContact O-N 3.39Å; S186-N188 PolarHBondContact O-N 3.35Å | ||
| 187 | I | 49.7 | Very low | 49.7 | Very low | 148 Ų | 148 | 126.7 Ų | 126.7 | 76% | 0.759 | 70% | 0.699 | S | S | * | * | trans | -65.2 | 90.1 | 171.4 | -65.4 | 164.9 | 0 | 0 | 0 | 103.6 | S185 P189 | S185-I187 PolarHBondContact O-N 3.1Å; I187-P189 WeakPolarHBondContact O-CD 3.33Å; I187-P189 VanDerWaalsContact O-N 3.12Å | ||
| 188 | N | 49.1 | Very low | 49.3 | Very low | 128 Ų | 128 | 127.5 Ų | 127.5 | 68% | 0.684 | 71% | 0.706 | S | S | * | * | trans | -54.1 | 117.8 | 160.8 | -76 | -45.5 | 0 | 0 | 0 | 104.9 | S186 A190 | S186-N188 PolarHBondContact O-N 3.35Å; N188-A190 PolarHBondContact O-N 3.27Å | ||
| 189 | P | 49.9 | Very low | 48.4 | Very low | 119 Ų | 119 | 132.5 Ų | 132.5 | 77% | 0.773 | 72% | 0.723 | S | S | * | * | trans | -73.2 | 63.2 | 174.1 | 31.5 | -33.3 | 0 | 0 | 0 | 108.1 | I187 E191 | I187-P189 WeakPolarHBondContact O-CD 3.33Å; I187-P189 VanDerWaalsContact O-N 3.12Å; P189-E191 VanDerWaalsContact C-N 3.25Å; P189-E191 PolarHBondContact O-N 3.36Å | ||
| 190 | A | 45.5 | Very low | 47.9 | Very low | 77 Ų | 77 | 136 Ų | 136 | 64% | 0.636 | 74% | 0.736 | S | S | * | * | trans | -77.2 | 87.6 | 168.3 | 0 | 0 | 0 | 0 | 0 | 106.5 | N188 T192 | N188-A190 PolarHBondContact O-N 3.27Å; A190-T192 PolarHBondContact O-N 3.47Å | ||
| 191 | E | 46 | Very low | 47.8 | Very low | 185 Ų | 185 | 136.9 Ų | 136.9 | 86% | 0.864 | 74% | 0.741 | S | S | * | * | trans | 25.5 | 71.6 | 141.7 | -60.7 | -175.1 | 156.8 | 0 | 0 | 115.2 | P189 A193 | P189-E191 VanDerWaalsContact C-N 3.25Å; P189-E191 PolarHBondContact O-N 3.36Å; E191-A193 PolarHBondContact O-N 3.27Å | ||
| 192 | T | 45.6 | Very low | 47.8 | Very low | 111 Ų | 111 | 131.1 Ų | 131.1 | 68% | 0.681 | 75% | 0.746 | S | S | * | * | trans | -77.3 | 75.5 | 163 | 15.2 | 0 | 0 | 0 | 0 | 107.8 | A190 F194 | A190-T192 PolarHBondContact O-N 3.47Å; T192-F194 VanDerWaalsContact C-N 3.29Å; T192-F194 HydrophobicContact CG2-CE2 4Å; T192-F194 HydrophobicContact CG2-CZ 4.03Å; T192-F194 WeakPolarHBondContact O-CD2 3.42Å; T192-F194 PolarHBondContact O-N 3.33Å | ||
| 193 | A | 45.4 | Very low | 47.5 | Very low | 85 Ų | 85 | 134.9 Ų | 134.9 | 70% | 0.702 | 75% | 0.754 | S | S | * | * | trans | -72 | 86 | 169.8 | 0 | 0 | 0 | 0 | 0 | 108.8 | E191 S195 | E191-A193 PolarHBondContact O-N 3.27Å; A193-S195 PolarHBondContact O-N 3.44Å | ||
| 194 | F | 43 | Very low | 47.2 | Very low | 173 Ų | 173 | 134.3 Ų | 134.3 | 76% | 0.759 | 76% | 0.756 | S | S | * | * | trans | -68 | 102.8 | 170 | -67.7 | -81.4 | 0 | 0 | 0 | 109 | T192 V196 | T192-F194 VanDerWaalsContact C-N 3.29Å; T192-F194 HydrophobicContact CG2-CE2 4Å; T192-F194 HydrophobicContact CG2-CZ 4.03Å; T192-F194 WeakPolarHBondContact O-CD2 3.42Å; T192-F194 PolarHBondContact O-N 3.33Å; F194-V196 PolarHBondContact O-N 3.18Å | ||
| 195 | S | 46.8 | Very low | 46.8 | Very low | 106 Ų | 106 | 132.9 Ų | 132.9 | 74% | 0.741 | 75% | 0.752 | S | S | * | * | trans | -78.6 | 102.1 | 169.2 | -67.4 | 0 | 0 | 0 | 0 | 108.3 | A193 E197 | A193-S195 PolarHBondContact O-N 3.44Å; S195-E197 PolarHBondContact O-N 3.23Å | ||
| 196 | V | 50.6 | Low | 46.8 | Very low | 128 Ų | 128 | 135.3 Ų | 135.3 | 78% | 0.776 | 77% | 0.766 | S | S | * | * | trans | -80.2 | 98.4 | 172.6 | -178.8 | 0 | 0 | 0 | 0 | 107.7 | F194 A198 | F194-V196 PolarHBondContact O-N 3.18Å; V196-A198 VanDerWaalsContact C-N 3.33Å; V196-A198 PolarHBondContact O-N 3.45Å | ||
| 197 | E | 38.6 | Very low | 46.8 | Very low | 171 Ų | 171 | 140 Ų | 140 | 80% | 0.799 | 78% | 0.775 | S | S | * | * | trans | -73 | 87.5 | 170.4 | -63.7 | -162.2 | 166.1 | 0 | 0 | 109.1 | S195 E199 | S195-E197 PolarHBondContact O-N 3.23Å; E197-E199 PolarHBondContact O-N 3.41Å | ||
| 198 | A | 46 | Very low | 46.9 | Very low | 89 Ų | 89 | 142.2 Ų | 142.2 | 74% | 0.736 | 78% | 0.779 | S | S | * | * | trans | -82.4 | 101.3 | 168.6 | 0 | 0 | 0 | 0 | 0 | 109 | V196 K200 | V196-A198 VanDerWaalsContact C-N 3.33Å; V196-A198 PolarHBondContact O-N 3.45Å; A198-K200 PolarHBondContact O-N 3.31Å; A198-K200 VanDerWaalsContact O-N 3.13Å | ||
| 199 | E | 35.9 | Very low | 47 | Very low | 193 Ų | 193 | 141.1 Ų | 141.1 | 90% | 0.902 | 78% | 0.777 | S | S | * | * | trans | -62.7 | 107.7 | 168.8 | -72.7 | -168.7 | 141 | 0 | 0 | 109.9 | E197 | E197-E199 PolarHBondContact O-N 3.41Š| ||
| 200 | K | 44.1 | Very low | 46.7 | Very low | 179 Ų | 179 | 143.7 Ų | 143.7 | 78% | 0.778 | 78% | 0.778 | S | S | * | * | trans | -130.8 | 104.7 | 162.6 | -165.5 | 171.9 | -179 | 174.9 | 0 | 109.6 | A198 | A198-K200 PolarHBondContact O-N 3.31Å; A198-K200 VanDerWaalsContact O-N 3.13Å | ||
| 201 | N | 51.2 | Low | 46.7 | Very low | 149 Ų | 149 | 148.3 Ų | 148.3 | 80% | 0.797 | 78% | 0.784 | S | S | * | * | S | Bend | trans | 55.3 | 64.9 | 167.8 | -58.9 | -5.4 | 0 | 0 | 0 | 115.1 | K203 | N201-K203 VanDerWaalsContact C-N 3.32Å; N201-K203 PolarHBondContact O-N 2.77Å |
| 202 | G | 54.1 | Low | 46.6 | Very low | 85 Ų | 85 | 148.7 Ų | 148.7 | 88% | 0.876 | 78% | 0.783 | S | S | * | * | S | Bend | trans | 70.6 | 5.5 | 146.1 | 0 | 0 | 0 | 0 | 0 | 118.9 | ||
| 203 | K | 49 | Very low | 46.7 | Very low | 187 Ų | 187 | 150.9 Ų | 150.9 | 81% | 0.813 | 79% | 0.788 | S | S | * | * | trans | -132.2 | 105.8 | 171.5 | -75.3 | -177.1 | 179 | 177.6 | 0 | 111 | N201 V205 | N201-K203 VanDerWaalsContact C-N 3.32Å; N201-K203 PolarHBondContact O-N 2.77Å; K203-V205 PolarHBondContact O-N 2.86Å | ||
| 204 | K | 48.3 | Very low | 46.5 | Very low | 196 Ų | 196 | 152.1 Ų | 152.1 | 85% | 0.852 | 79% | 0.792 | S | S | * | * | trans | -66.5 | 109.8 | 178.3 | -62.8 | -174.1 | 177.9 | -166.8 | 0 | 110 | ||||
| 205 | V | 47.2 | Very low | 46.6 | Very low | 119 Ų | 119 | 152.2 Ų | 152.2 | 72% | 0.721 | 80% | 0.795 | S | S | * | * | trans | -128.5 | 111.9 | 163 | -174.6 | 0 | 0 | 0 | 0 | 108.1 | K203 K207 | K203-V205 PolarHBondContact O-N 2.86Å; V205-K207 PolarHBondContact O-N 3.4Å | ||
| 206 | P | 48.7 | Very low | 46.5 | Very low | 121 Ų | 121 | 152.9 Ų | 152.9 | 79% | 0.786 | 80% | 0.8 | S | S | * | * | trans | -69.9 | 114.6 | -177.3 | 26.2 | -31.7 | 0 | 0 | 0 | 110.2 | ||||
| 207 | K | 49.2 | Very low | 46 | Very low | 192 Ų | 192 | 151.7 Ų | 151.7 | 84% | 0.835 | 80% | 0.797 | S | S | * | * | trans | -92.9 | 108.2 | 168.2 | -79.9 | -175.4 | 176.8 | 178.1 | 0 | 108.9 | V205 V209 | V205-K207 PolarHBondContact O-N 3.4Å; K207-V209 PolarHBondContact O-N 3.46Å | ||
| 208 | K | 51.7 | Low | 46.1 | Very low | 194 Ų | 194 | 150.1 Ų | 150.1 | 84% | 0.843 | 80% | 0.799 | S | S | * | * | trans | -72.5 | 114.4 | 169.3 | -69.2 | -177.4 | 177.9 | -175.9 | 0 | 108.6 | ||||
| 209 | V | 51 | Low | 45.8 | Very low | 105 Ų | 105 | 153 Ų | 153 | 64% | 0.636 | 80% | 0.8 | S | S | * | * | trans | -97.7 | 113.4 | 172.2 | -176.1 | 0 | 0 | 0 | 0 | 107.7 | K207 F211 | K207-V209 PolarHBondContact O-N 3.46Å; V209-F211 HydrophobicContact CB-CE2 4.11Å; V209-F211 HydrophobicContact CG1-CD2 4.04Å; V209-F211 HydrophobicContact CG1-CE1 4.47Å; V209-F211 HydrophobicContact CG1-CE2 3.5Å; V209-F211 VanDerWaalsContact CG1-CE2 3.5Å; V209-F211 HydrophobicContact CG1-CZ 3.75Å | ||
| 210 | H | 43.7 | Very low | 45.9 | Very low | 173 Ų | 173 | 147.4 Ų | 147.4 | 80% | 0.801 | 79% | 0.787 | S | S | * | * | trans | -85 | 113.4 | 173.7 | -102.8 | -75.5 | 0 | 0 | 0 | 109.3 | ||||
| 211 | F | 44.7 | Very low | 45.6 | Very low | 173 Ų | 173 | 145 Ų | 145 | 76% | 0.759 | 79% | 0.79 | S | S | * | * | trans | -91.7 | 118.9 | 166.2 | -69.9 | -84.5 | 0 | 0 | 0 | 108.7 | V209 | V209-F211 HydrophobicContact CB-CE2 4.11Å; V209-F211 HydrophobicContact CG1-CD2 4.04Å; V209-F211 HydrophobicContact CG1-CE1 4.47Å; V209-F211 HydrophobicContact CG1-CE2 3.5Å; V209-F211 VanDerWaalsContact CG1-CE2 3.5Å; V209-F211 HydrophobicContact CG1-CZ 3.75Å | ||
| 212 | K | 43.3 | Very low | 45.1 | Very low | 193 Ų | 193 | 143.5 Ų | 143.5 | 84% | 0.839 | 79% | 0.791 | S | S | * | * | trans | -94.5 | 113.4 | 166.1 | -74.5 | -174.3 | 177.6 | -176.6 | 0 | 107.3 | S214 | K212-S214 PolarHBondContact O-N 3.22Š| ||
| 213 | I | 49.1 | Very low | 44.4 | Very low | 157 Ų | 157 | 143.8 Ų | 143.8 | 81% | 0.805 | 79% | 0.785 | S | S | * | * | trans | -80 | 111 | 171.8 | -57 | 170.8 | 0 | 0 | 0 | 106.1 | E215 | I213-E215 PolarHBondContact O-N 3.14Š| ||
| 214 | S | 41.1 | Very low | 43.9 | Very low | 112 Ų | 112 | 140.3 Ų | 140.3 | 78% | 0.783 | 78% | 0.782 | S | S | * | * | trans | -77.9 | 106.4 | 170.6 | -59.2 | 0 | 0 | 0 | 0 | 108.3 | K212 | K212-S214 PolarHBondContact O-N 3.22Š| ||
| 215 | E | 44.1 | Very low | 43.5 | Very low | 174 Ų | 174 | 137 Ų | 137 | 81% | 0.813 | 78% | 0.78 | S | S | * | * | trans | -61.7 | 145.6 | 168.5 | -66.3 | 177.2 | 167.8 | 0 | 0 | 109.8 | I213 | I213-E215 PolarHBondContact O-N 3.14Š| ||
| 216 | S | 46 | Very low | 43.3 | Very low | 121 Ų | 121 | 141.2 Ų | 141.2 | 85% | 0.846 | 79% | 0.789 | S | S | * | * | trans | 90 | 78 | 173.2 | 78.4 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 217 | S | 40.1 | Very low | 43 | Very low | 103 Ų | 103 | 144.6 Ų | 144.6 | 72% | 0.72 | 79% | 0.794 | S | S | * | * | trans | -139.2 | 69.5 | 139.9 | -165.2 | 0 | 0 | 0 | 0 | 108.8 | I219 | S217-I219 VanDerWaalsContact C-N 3.34Å; S217-I219 PolarHBondContact O-N 3.02Å; S217-I219 VanDerWaalsContact O-N 3.17Å | ||
| 218 | V | 40.8 | Very low | 42.5 | Very low | 138 Ų | 138 | 145.7 Ų | 145.7 | 84% | 0.836 | 80% | 0.799 | S | S | * | * | trans | -78.2 | 92.8 | 165.6 | 179.4 | 0 | 0 | 0 | 0 | 105.9 | A220 | V218-A220 VanDerWaalsContact C-N 3.33Å; V218-A220 PolarHBondContact O-N 3.18Å | ||
| 219 | I | 38.3 | Very low | 42 | Very low | 148 Ų | 148 | 146.5 Ų | 146.5 | 76% | 0.759 | 80% | 0.802 | S | S | * | * | trans | -71.6 | 94.8 | 171.2 | -61.8 | 168.3 | 0 | 0 | 0 | 106.4 | S217 | S217-I219 VanDerWaalsContact C-N 3.34Å; S217-I219 PolarHBondContact O-N 3.02Å; S217-I219 VanDerWaalsContact O-N 3.17Å | ||
| 220 | A | 38.9 | Very low | 41 | Very low | 76 Ų | 76 | 144.6 Ų | 144.6 | 63% | 0.628 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -63.6 | 135.5 | 172.5 | 0 | 0 | 0 | 0 | 0 | 109.7 | V218 S222 | V218-A220 VanDerWaalsContact C-N 3.33Å; V218-A220 PolarHBondContact O-N 3.18Å; A220-S222 PolarHBondContact O-N 3.11Å |
| 221 | P | 38.4 | Very low | 40.5 | Very low | 128 Ų | 128 | 147 Ų | 147 | 83% | 0.831 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -64.3 | 127.9 | -174.7 | 23.4 | -31.3 | 0 | 0 | 0 | 111.3 | A223 | P221-A223 PolarHBondContact O-N 3.44Š|
| 222 | S | 39.9 | Very low | 39.9 | Very low | 119 Ų | 119 | 142.3 Ų | 142.3 | 83% | 0.832 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -58.3 | 127.3 | -175.6 | 55.3 | 0 | 0 | 0 | 0 | 112.8 | A220 | A220-S222 PolarHBondContact O-N 3.11Š|
| 223 | A | 38.3 | Very low | 39.5 | Very low | 91 Ų | 91 | 144.6 Ų | 144.6 | 75% | 0.752 | 82% | 0.816 | S | S | * | * | P | Polyproline II helix | trans | -59.8 | 150.5 | 175.4 | 0 | 0 | 0 | 0 | 0 | 113.4 | P221 | P221-A223 PolarHBondContact O-N 3.44Š|
| 224 | P | 38.7 | Very low | 39.1 | Very low | 113 Ų | 113 | 145 Ų | 145 | 73% | 0.734 | 82% | 0.82 | S | S | * | * | P | Polyproline II helix | trans | -70.1 | 152.3 | -171.1 | 25.3 | -32 | 0 | 0 | 0 | 114.2 | K226 | P224-K226 PolarHBondContact O-N 3.03Š|
| 225 | P | 40.6 | Very low | 39 | Very low | 127 Ų | 127 | 149.5 Ų | 149.5 | 83% | 0.825 | 83% | 0.826 | S | S | * | * | P | Polyproline II helix | trans | -69.7 | 122.4 | -164.5 | 26.3 | -33.5 | 0 | 0 | 0 | 112.9 | Q227 | P225-Q227 PolarHBondContact O-N 2.96Š|
| 226 | K | 43.3 | Very low | 38.5 | Very low | 208 Ų | 208 | 145.7 Ų | 145.7 | 90% | 0.904 | 82% | 0.824 | S | S | * | * | P | Polyproline II helix | trans | -68.6 | 124 | 176.5 | -70.4 | -177.5 | 177.2 | 177.9 | 0 | 111 | P224 | P224-K226 PolarHBondContact O-N 3.03Š|
| 227 | Q | 42.7 | Very low | 38.2 | Very low | 191 Ų | 191 | 146.9 Ų | 146.9 | 89% | 0.893 | 83% | 0.827 | S | S | * | * | P | Polyproline II helix | trans | -59.9 | 129.7 | 175 | -67.7 | 177 | -40.7 | 0 | 0 | 111.5 | P225 K229 | P225-Q227 PolarHBondContact O-N 2.96Å; Q227-K229 PolarHBondContact O-N 2.98Å |
| 228 | K | 38.4 | Very low | 37.8 | Very low | 215 Ų | 215 | 148.8 Ų | 148.8 | 94% | 0.935 | 83% | 0.834 | S | S | * | * | trans | -65.4 | 108.2 | 171.6 | -86.1 | 178.9 | 171.8 | 175 | 0 | 110 | ||||
| 229 | K | 40.3 | Very low | 37.3 | Very low | 211 Ų | 211 | 146 Ų | 146 | 92% | 0.917 | 83% | 0.832 | S | S | * | * | trans | -99.3 | 110.1 | 155.4 | -106.9 | -179.5 | 178.1 | 177.3 | 0 | 108.3 | Q227 | Q227-K229 PolarHBondContact O-N 2.98Š| ||
| 230 | G | 31.1 | Very low | 37 | Very low | 66 Ų | 66 | 142.7 Ų | 142.7 | 68% | 0.68 | 84% | 0.835 | S | S | * | * | trans | -83.1 | 160.7 | 173.4 | 0 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 231 | F | 32.2 | Very low | 36.6 | Very low | 224 Ų | 224 | 147 Ų | 147 | 98% | 0.982 | 85% | 0.847 | S | S | * | * | trans | 75.7 | 110.8 | 166 | -88.8 | -92.6 | 0 | 0 | 0 | 119.6 | ||||
| 232 | G | 33.5 | Very low | 36.5 | Very low | 74 Ų | 74 | 148.2 Ų | 148.2 | 76% | 0.763 | 84% | 0.842 | S | S | * | * | trans | 164.2 | 77.6 | 162.8 | 0 | 0 | 0 | 0 | 0 | 112 | N234 | G232-N234 PolarHBondContact O-N 2.88Š| ||
| 233 | R | 34.2 | Very low | 36.6 | Very low | 240 Ų | 240 | 150.5 Ų | 150.5 | 91% | 0.906 | 84% | 0.837 | S | S | * | * | trans | -53.8 | 129 | 161.9 | -84.4 | 177.7 | 178.3 | 166 | -0.1 | 107.8 | ||||
| 234 | N | 40.8 | Very low | 36.6 | Very low | 165 Ų | 165 | 155.5 Ų | 155.5 | 88% | 0.882 | 85% | 0.845 | S | S | * | * | trans | -158.4 | 145.8 | 143.5 | -86.9 | -26 | 0 | 0 | 0 | 110.5 | G232 | G232-N234 PolarHBondContact O-N 2.88Š| ||
| 235 | K | 38.5 | Very low | 36.7 | Very low | 208 Ų | 208 | 159.7 Ų | 159.7 | 90% | 0.904 | 85% | 0.851 | S | S | * | * | trans | -69.8 | 156.9 | -161.3 | -70.6 | 176.8 | 174.9 | 179.6 | 0 | 113.9 | ||||
| 236 | A | 34.1 | Very low | 36.8 | Very low | 94 Ų | 94 | 164.8 Ų | 164.8 | 78% | 0.777 | 86% | 0.856 | S | S | * | * | trans | -52 | 138.5 | 173.4 | 0 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 237 | T | 39.8 | Very low | 36.6 | Very low | 146 Ų | 146 | 158 Ų | 158 | 90% | 0.896 | 85% | 0.845 | S | S | * | * | trans | -144.5 | 128.9 | 138.5 | 21.4 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 238 | T | 31.9 | Very low | 36.7 | Very low | 143 Ų | 143 | 159 Ų | 159 | 88% | 0.877 | 85% | 0.846 | S | S | * | * | trans | -80.5 | 144.8 | -174.1 | -47.7 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 239 | G | 29.3 | Very low | 37.2 | Very low | 78 Ų | 78 | 155.9 Ų | 155.9 | 80% | 0.804 | 84% | 0.838 | S | S | * | * | trans | 103.3 | 118 | 146.5 | 0 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 240 | G | 31.9 | Very low | 37.1 | Very low | 79 Ų | 79 | 149.1 Ų | 149.1 | 81% | 0.814 | 83% | 0.829 | S | S | * | * | trans | 160.3 | 65.9 | 167 | 0 | 0 | 0 | 0 | 0 | 114 | E242 | G240-E242 PolarHBondContact O-N 3.39Š| ||
| 241 | N | 31.4 | Very low | 37.8 | Very low | 166 Ų | 166 | 152.1 Ų | 152.1 | 89% | 0.888 | 83% | 0.829 | S | S | * | * | trans | -56.8 | 122.8 | 162.2 | -89.8 | -25.2 | 0 | 0 | 0 | 109.5 | ||||
| 242 | E | 36.2 | Very low | 38.6 | Very low | 154 Ų | 154 | 146.6 Ų | 146.6 | 72% | 0.72 | 82% | 0.818 | S | S | * | * | trans | -164.6 | 114.5 | 140.3 | -113.7 | -176 | 146.3 | 0 | 0 | 113.9 | G240 | G240-E242 PolarHBondContact O-N 3.39Š| ||
| 243 | K | 41.2 | Very low | 39.1 | Very low | 168 Ų | 168 | 154 Ų | 154 | 73% | 0.73 | 82% | 0.823 | S | S | * | * | trans | 57 | 88.2 | 140.8 | -66.3 | 169.3 | -174.5 | 155 | 0 | 117.9 | K245 | K243-K245 PolarHBondContact O-N 3.2Š| ||
| 244 | H | 38.4 | Very low | 39.7 | Very low | 196 Ų | 196 | 154 Ų | 154 | 91% | 0.907 | 82% | 0.823 | S | S | * | * | trans | -65.9 | 102.7 | 154.1 | -78.4 | -56.3 | 0 | 0 | 0 | 110.5 | ||||
| 245 | K | 42 | Very low | 39.6 | Very low | 200 Ų | 200 | 153.6 Ų | 153.6 | 87% | 0.87 | 82% | 0.816 | S | S | * | * | trans | -64.6 | 129.1 | 164.4 | -96.6 | -179.5 | 174.8 | 177.4 | 0 | 109.7 | K243 G247 | K243-K245 PolarHBondContact O-N 3.2Å; K245-G247 PolarHBondContact O-N 3.21Å; K245-G247 VanDerWaalsContact O-N 3.1Å | ||
| 246 | Y | 41.9 | Very low | 39.7 | Very low | 234 Ų | 234 | 151.7 Ų | 151.7 | 92% | 0.918 | 81% | 0.811 | S | S | * | * | trans | -52.5 | 106.2 | 168.2 | -68.2 | -94.3 | 0 | 0 | 0 | 111.3 | ||||
| 247 | G | 39.5 | Very low | 40.1 | Very low | 66 Ų | 66 | 152 Ų | 152 | 68% | 0.68 | 81% | 0.807 | S | S | * | * | trans | -87.5 | 98.5 | 165.3 | 0 | 0 | 0 | 0 | 0 | 109.4 | K245 I249 | K245-G247 PolarHBondContact O-N 3.21Å; K245-G247 VanDerWaalsContact O-N 3.1Å; G247-I249 PolarHBondContact O-N 3.34Å | ||
| 248 | K | 44.9 | Very low | 40.4 | Very low | 211 Ų | 211 | 153 Ų | 153 | 92% | 0.917 | 81% | 0.807 | S | S | * | * | trans | -58.2 | 103.5 | 166 | -107.4 | 174.5 | 174.3 | 177.2 | 0 | 108.5 | G250 | K248-G250 PolarHBondContact O-N 3.38Š| ||
| 249 | I | 47.2 | Very low | 41.1 | Very low | 151 Ų | 151 | 157.9 Ų | 157.9 | 77% | 0.774 | 83% | 0.826 | S | S | * | * | trans | -82.7 | 95.6 | 166.6 | -62.1 | 167.5 | 0 | 0 | 0 | 106 | G247 N251 | G247-I249 PolarHBondContact O-N 3.34Å; I249-N251 PolarHBondContact O-N 3.08Å | ||
| 250 | G | 39.9 | Very low | 41.7 | Very low | 69 Ų | 69 | 161.9 Ų | 161.9 | 71% | 0.711 | 83% | 0.827 | S | S | * | * | trans | -74.9 | 109.1 | 171.1 | 0 | 0 | 0 | 0 | 0 | 109.5 | K248 S252 | K248-G250 PolarHBondContact O-N 3.38Å; G250-S252 PolarHBondContact O-N 3.25Å; G250-S252 VanDerWaalsContact O-N 3.08Å | ||
| 251 | N | 44.4 | Very low | 42.3 | Very low | 129 Ų | 129 | 166.3 Ų | 166.3 | 69% | 0.69 | 83% | 0.828 | S | S | * | * | trans | -75.5 | 90.4 | 170.3 | -71.3 | -12.3 | 0 | 0 | 0 | 109 | I249 W253 | I249-N251 PolarHBondContact O-N 3.08Å; N251-W253 PolarHBondContact O-N 3.06Å | ||
| 252 | S | 49.8 | Very low | 42.9 | Very low | 108 Ų | 108 | 166.3 Ų | 166.3 | 76% | 0.755 | 83% | 0.825 | S | S | * | * | trans | -85.2 | 88.2 | 170.1 | 162.1 | 0 | 0 | 0 | 0 | 109.4 | G250 R254 | G250-S252 PolarHBondContact O-N 3.25Å; G250-S252 VanDerWaalsContact O-N 3.08Å; S252-R254 PolarHBondContact O-N 3.1Å | ||
| 253 | W | 43.3 | Very low | 43.2 | Very low | 229 Ų | 229 | 167 Ų | 167 | 87% | 0.867 | 83% | 0.831 | S | S | * | * | trans | -77.8 | 97.2 | 164.7 | -74 | 88.1 | 0 | 0 | 0 | 108.7 | N251 Q255 | N251-W253 PolarHBondContact O-N 3.06Å; W253-Q255 PolarHBondContact O-N 3.07Å | ||
| 254 | R | 46.5 | Very low | 43.4 | Very low | 240 Ų | 240 | 166.9 Ų | 166.9 | 91% | 0.906 | 84% | 0.837 | S | S | * | * | trans | -79 | 93.4 | 170.8 | -162.8 | -176.3 | -127.9 | -148.9 | 1.5 | 107.7 | S252 | S252-R254 PolarHBondContact O-N 3.1Š| ||
| 255 | Q | 38.8 | Very low | 43.7 | Very low | 157 Ų | 157 | 165 Ų | 165 | 73% | 0.734 | 83% | 0.833 | S | S | * | * | trans | -83 | 163 | 162.3 | -78.5 | -171.6 | -17.6 | 0 | 0 | 110.3 | W253 | W253-Q255 PolarHBondContact O-N 3.07Š| ||
| 256 | Q | 40.8 | Very low | 43.8 | Very low | 168 Ų | 168 | 162.5 Ų | 162.5 | 79% | 0.785 | 83% | 0.83 | S | S | * | * | trans | 86.5 | 100.7 | 164.6 | -61.9 | -176.2 | -9.8 | 0 | 0 | 114 | ||||
| 257 | S | 43 | Very low | 44 | Very low | 100 Ų | 100 | 157 Ų | 157 | 70% | 0.699 | 82% | 0.823 | S | S | * | * | 106.2 | 94.4 | 62.2 | 57.8 | 0 | 0 | 0 | 0 | 107.2 | |||||
| 258 | N | 46.9 | Very low | 44.4 | Very low | 167 Ų | 167 | 164.6 Ų | 164.6 | 89% | 0.893 | 84% | 0.835 | S | S | * | * | trans | -104.4 | 109.9 | 164.4 | -76.7 | -14 | 0 | 0 | 0 | 107.1 | ||||
| 259 | L | 46.9 | Very low | 44.3 | Very low | 246 Ų | 246 | 160.4 Ų | 160.4 | 100% | 1.288 | 83% | 0.828 | S | S | * | * | trans | -46.8 | 0 | 145.9 | -75.3 | 149.1 | 0 | 0 | 0 | 110.7 |
Retrieved 259 of 259 residues in 121.8 ms
(Link to these results)