| 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 | 32.2 | Very low | 32.4 | Very low | 231 Ų | 231 | 137.9 Ų | 137.9 | 100% | 1.138 | 83% | 0.828 | S | S | * | * | 0 | 115.2 | 0 | -117.7 | 155.8 | 170.4 | 0 | 0 | 105.9 | |||||
| 2 | E | 32.7 | Very low | 32.4 | Very low | 182 Ų | 182 | 140.3 Ų | 140.3 | 85% | 0.85 | 83% | 0.833 | S | S | * | * | trans | 58.3 | 141 | 169 | -73.4 | 166.6 | 96.8 | 0 | 0 | 118.7 | ||||
| 3 | S | 29.1 | Very low | 32.3 | Very low | 106 Ų | 106 | 138.6 Ų | 138.6 | 74% | 0.741 | 83% | 0.833 | S | S | * | * | cis | -170.1 | 147.3 | -10.1 | 45.5 | 0 | 0 | 0 | 0 | 107 | ||||
| 4 | S | 31.1 | Very low | 32.4 | Very low | 113 Ų | 113 | 136.1 Ų | 136.1 | 79% | 0.79 | 83% | 0.825 | S | S | * | * | trans | -70.5 | 157.8 | 177 | -45.1 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 5 | S | 33.4 | Very low | 32.6 | Very low | 111 Ų | 111 | 135.7 Ų | 135.7 | 78% | 0.776 | 82% | 0.823 | S | S | * | * | 146 | 130.9 | 118 | 59.9 | 0 | 0 | 0 | 0 | 114.6 | |||||
| 6 | I | 32.9 | Very low | 32.8 | Very low | 166 Ų | 166 | 138.2 Ų | 138.2 | 85% | 0.851 | 83% | 0.829 | S | S | * | * | trans | -133.8 | 124.2 | 154.6 | -59.9 | 177.9 | 0 | 0 | 0 | 106.3 | ||||
| 7 | P | 41.7 | Very low | 32.7 | Very low | 113 Ų | 113 | 134.6 Ų | 134.6 | 73% | 0.734 | 83% | 0.827 | S | S | * | * | trans | -116.2 | 145.1 | 159.1 | 34.4 | -22.5 | 0 | 0 | 0 | 111.1 | ||||
| 8 | Q | 32.8 | Very low | 33 | Very low | 199 Ų | 199 | 140.5 Ų | 140.5 | 93% | 0.93 | 83% | 0.831 | S | S | * | * | trans | -129.1 | 142.4 | 159.9 | -85.5 | -167.8 | -12.6 | 0 | 0 | 110.2 | ||||
| 9 | S | 29.9 | Very low | 33.1 | Very low | 109 Ų | 109 | 137.9 Ų | 137.9 | 76% | 0.762 | 83% | 0.827 | S | S | * | * | trans | -111.1 | 176.1 | -167.3 | 81.6 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 10 | S | 31.3 | Very low | 33.4 | Very low | 120 Ų | 120 | 138.8 Ų | 138.8 | 84% | 0.839 | 83% | 0.827 | S | S | * | * | trans | 94.3 | 132.8 | 161.5 | 79.8 | 0 | 0 | 0 | 0 | 116.6 | ||||
| 11 | G | 29.1 | Very low | 33.5 | Very low | 67 Ų | 67 | 141.2 Ų | 141.2 | 69% | 0.691 | 83% | 0.83 | S | S | * | * | cis | -174.7 | 159.5 | -2.7 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 12 | N | 32.3 | Very low | 33.6 | Very low | 166 Ų | 166 | 136 Ų | 136 | 89% | 0.888 | 81% | 0.811 | S | S | * | * | trans | 50.9 | 119.1 | 144.9 | -63 | -8.3 | 0 | 0 | 0 | 123.6 | ||||
| 13 | S | 31.5 | Very low | 33.9 | Very low | 119 Ų | 119 | 133.7 Ų | 133.7 | 83% | 0.832 | 81% | 0.812 | S | S | * | * | -167.3 | 135.4 | 107.9 | 44.3 | 0 | 0 | 0 | 0 | 113.4 | |||||
| 14 | S | 34.6 | Very low | 34 | Very low | 104 Ų | 104 | 131.6 Ų | 131.6 | 73% | 0.727 | 81% | 0.807 | S | S | * | * | trans | -44.4 | 159.4 | 175 | 49.6 | 0 | 0 | 0 | 0 | 116.2 | ||||
| 15 | T | 34.8 | Very low | 34.6 | Very low | 129 Ų | 129 | 132.5 Ų | 132.5 | 79% | 0.791 | 81% | 0.81 | S | S | * | * | cis | -173.7 | 141.5 | 47.8 | -28.7 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 16 | L | 35.3 | Very low | 34.6 | Very low | 176 Ų | 176 | 132.9 Ų | 132.9 | 92% | 0.921 | 81% | 0.813 | S | S | * | * | trans | 2.1 | 130.5 | 153 | -133.9 | 82.1 | 0 | 0 | 0 | 121.5 | ||||
| 17 | G | 30.9 | Very low | 35.2 | Very low | 77 Ų | 77 | 131.8 Ų | 131.8 | 79% | 0.794 | 81% | 0.814 | S | S | * | * | trans | -177.1 | 75.7 | 162.5 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 18 | R | 38.8 | Very low | 35.1 | Very low | 241 Ų | 241 | 130.6 Ų | 130.6 | 91% | 0.909 | 81% | 0.813 | S | S | * | * | trans | -82.7 | 111.1 | 173.8 | -173.7 | 177.2 | -178 | 140.9 | -1.5 | 109.1 | ||||
| 19 | A | 35.1 | Very low | 35.6 | Very low | 91 Ų | 91 | 127.1 Ų | 127.1 | 75% | 0.752 | 81% | 0.811 | S | S | * | * | trans | -125.1 | 115.3 | 166.6 | 0 | 0 | 0 | 0 | 0 | 110 | ||||
| 20 | L | 38.5 | Very low | 35.9 | Very low | 156 Ų | 156 | 125.5 Ų | 125.5 | 82% | 0.817 | 81% | 0.811 | S | S | * | * | trans | -60.6 | 122.4 | 169.6 | -138.7 | 76 | 0 | 0 | 0 | 108.6 | ||||
| 21 | Q | 34.8 | Very low | 36.6 | Very low | 190 Ų | 190 | 125 Ų | 125 | 89% | 0.888 | 80% | 0.804 | S | S | * | * | trans | -107.4 | 116.7 | 165.2 | -80.2 | -176.8 | 6.2 | 0 | 0 | 109.7 | ||||
| 22 | T | 34.4 | Very low | 37.5 | Very low | 122 Ų | 122 | 127 Ų | 127 | 75% | 0.748 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -65.3 | 151.5 | 165.1 | 43.7 | 0 | 0 | 0 | 0 | 111.4 | G24 | T22-G24 PolarHBondContact O-N 2.93Š|
| 23 | P | 39.8 | Very low | 38.3 | Very low | 133 Ų | 133 | 126.2 Ų | 126.2 | 86% | 0.864 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -77.6 | 124.1 | 179.8 | 31.3 | -31 | 0 | 0 | 0 | 111 | ||
| 24 | G | 31.1 | Very low | 39.3 | Very low | 62 Ų | 62 | 127.6 Ų | 127.6 | 64% | 0.639 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -93.7 | 154.3 | 166.3 | 0 | 0 | 0 | 0 | 0 | 111.3 | T22 S26 | T22-G24 PolarHBondContact O-N 2.93Å; G24-S26 PolarHBondContact O-N 3.45Å |
| 25 | P | 42.8 | Very low | 40.4 | Very low | 131 Ų | 131 | 124.6 Ų | 124.6 | 85% | 0.851 | 78% | 0.778 | S | S | * | * | P | Polyproline II helix | trans | -79.9 | 117.2 | -172.2 | 31.7 | -30.8 | 0 | 0 | 0 | 110.8 | T27 | P25-T27 PolarHBondContact O-N 2.81Š|
| 26 | S | 35.4 | Very low | 41.6 | Very low | 120 Ų | 120 | 124.9 Ų | 124.9 | 84% | 0.839 | 77% | 0.774 | S | S | * | * | trans | -87.6 | 98 | 170 | 47.4 | 0 | 0 | 0 | 0 | 110.3 | G24 | G24-S26 PolarHBondContact O-N 3.45Š| ||
| 27 | T | 44 | Very low | 42.9 | Very low | 142 Ų | 142 | 123.3 Ų | 123.3 | 87% | 0.871 | 76% | 0.762 | S | S | * | * | trans | -81.5 | 106.6 | 152.3 | 17.9 | 0 | 0 | 0 | 0 | 108.5 | P25 | P25-T27 PolarHBondContact O-N 2.81Š| ||
| 28 | A | 39.5 | Very low | 44.7 | Very low | 88 Ų | 88 | 124.4 Ų | 124.4 | 73% | 0.727 | 75% | 0.749 | S | S | * | * | trans | -157.3 | 101.5 | 156.7 | 0 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 29 | S | 43.6 | Very low | 46.5 | Very low | 127 Ų | 127 | 117 Ų | 117 | 89% | 0.888 | 73% | 0.731 | S | S | * | * | trans | -19.2 | 124.1 | 152.7 | 47.4 | 0 | 0 | 0 | 0 | 116.7 | ||||
| 30 | G | 36 | Very low | 48.6 | Very low | 74 Ų | 74 | 115.3 Ų | 115.3 | 76% | 0.763 | 72% | 0.716 | S | S | * | * | trans | -156 | 89.9 | 156.6 | 0 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 31 | V | 45.7 | Very low | 50.5 | Low | 111 Ų | 111 | 111.2 Ų | 111.2 | 67% | 0.673 | 70% | 0.701 | S | S | * | * | trans | -63.2 | 149.1 | 179.1 | 171.9 | 0 | 0 | 0 | 0 | 110.1 | E33 | V31-E33 HydrophobicContact CG1-CG 4.36Å; V31-E33 PolarHBondContact O-N 3.37Å | ||
| 32 | P | 49.8 | Very low | 52.8 | Low | 107 Ų | 107 | 106.9 Ų | 106.9 | 70% | 0.695 | 68% | 0.681 | S | S | * | * | trans | -69.5 | 73.7 | 166.5 | 30.8 | -35.5 | 0 | 0 | 0 | 110.9 | L34 | P32-L34 VanDerWaalsContact C-N 3.31Š| ||
| 33 | E | 48.3 | Very low | 55.2 | Low | 151 Ų | 151 | 104.3 Ų | 104.3 | 71% | 0.706 | 67% | 0.668 | S | S | * | * | H | α-helix | trans | -70.1 | -27.4 | 175 | -87 | -169.8 | 114 | 0 | 0 | 112.6 | V31 Q37 | V31-E33 HydrophobicContact CG1-CG 4.36Å; V31-E33 PolarHBondContact O-N 3.37Å; E33-Q37 PolarHBondContact O-N 3.21Å |
| 34 | L | 52.4 | Low | 57.6 | Low | 147 Ų | 147 | 101.8 Ų | 101.8 | 77% | 0.77 | 65% | 0.649 | S | S | * | * | H | α-helix | trans | -68 | -38.1 | -177.6 | -135.6 | 87.5 | 0 | 0 | 0 | 112.9 | P32 D38 | P32-L34 VanDerWaalsContact C-N 3.31Å; L34-D38 PolarHBondContact O-N 2.94Å |
| 35 | G | 56.6 | Low | 60.3 | Low | 41 Ų | 41 | 100.7 Ų | 100.7 | 42% | 0.423 | 63% | 0.634 | S | S | . | * | H | α-helix | trans | -78 | -27.8 | -178.9 | 0 | 0 | 0 | 0 | 0 | 114 | V39 | G35-V39 WeakPolarHBondContact O-CG2 3.28Å; G35-V39 PolarHBondContact O-N 3.24Å |
| 36 | L | 60.7 | Low | 62.5 | Low | 135 Ų | 135 | 97.1 Ų | 97.1 | 71% | 0.707 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -76.5 | -36 | 179.5 | -162.2 | 74.4 | 0 | 0 | 0 | 111.7 | A40 | L36-A40 VanDerWaalsContact O-CB 3.32Å; L36-A40 WeakPolarHBondContact O-CB 3.45Å; L36-A40 PolarHBondContact O-N 2.98Å |
| 37 | Q | 61.9 | Low | 65.2 | Low | 144 Ų | 144 | 97.8 Ų | 97.8 | 67% | 0.673 | 60% | 0.596 | S | S | * | * | H | α-helix | trans | -66.9 | -42 | 176.5 | -167.2 | 106.9 | 25.2 | 0 | 0 | 111.6 | E33 A40 S41 | E33-Q37 PolarHBondContact O-N 3.21Å; Q37-A40 PolarHBondContact O-N 3.4Å; Q37-S41 WeakPolarHBondContact O-CB 3.19Å; Q37-S41 PolarHBondContact O-N 2.84Å; Q37-S41 PolarHBondContact O-OG 3.39Å |
| 38 | D | 70.3 | Confident | 67.4 | Low | 99 Ų | 99 | 96.4 Ų | 96.4 | 53% | 0.529 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -65.2 | -47.2 | 177.9 | -80.2 | -18.9 | 0 | 0 | 0 | 111.4 | L34 A40 S41 E42 | L34-D38 PolarHBondContact O-N 2.94Å; D38-A40 VanDerWaalsContact C-N 3.33Å; D38-A40 PolarHBondContact O-N 3.09Å; D38-S41 PolarHBondContact O-N 3.16Å; D38-S41 PolarHBondContact O-OG 2.91Å; D38-E42 WeakPolarHBondContact O-CB 3.3Å; D38-E42 PolarHBondContact O-N 3.41Å |
| 39 | V | 75.8 | Confident | 70 | Confident | 87 Ų | 87 | 92.9 Ų | 92.9 | 53% | 0.527 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -62.5 | -39.4 | 177.5 | 173.8 | 0 | 0 | 0 | 0 | 111.9 | G35 S43 | G35-V39 WeakPolarHBondContact O-CG2 3.28Å; G35-V39 PolarHBondContact O-N 3.24Å; V39-S43 WeakPolarHBondContact O-CB 3.4Å; V39-S43 PolarHBondContact O-N 3.28Å; V39-S43 PolarHBondContact O-OG 2.85Å |
| 40 | A | 78.4 | Confident | 72.5 | Confident | 54 Ų | 54 | 90.7 Ų | 90.7 | 45% | 0.446 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -65.8 | -42.6 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.8 | L36 Q37 D38 S43 V44 | L36-A40 VanDerWaalsContact O-CB 3.32Å; L36-A40 WeakPolarHBondContact O-CB 3.45Å; L36-A40 PolarHBondContact O-N 2.98Å; Q37-A40 PolarHBondContact O-N 3.4Å; D38-A40 VanDerWaalsContact C-N 3.33Å; D38-A40 PolarHBondContact O-N 3.09Å; A40-S43 PolarHBondContact O-N 2.91Å; A40-V44 VanDerWaalsContact O-CG2 3.23Å; A40-V44 WeakPolarHBondContact O-CG2 3.4Å; A40-V44 PolarHBondContact O-N 3.28Å |
| 41 | S | 80.3 | Confident | 75.3 | Confident | 70 Ų | 70 | 91.2 Ų | 91.2 | 49% | 0.49 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -65.7 | -40.2 | 178.8 | 76 | 0 | 0 | 0 | 0 | 112.6 | Q37 D38 V44 A45 | Q37-S41 WeakPolarHBondContact O-CB 3.19Å; Q37-S41 PolarHBondContact O-N 2.84Å; Q37-S41 PolarHBondContact O-OG 3.39Å; D38-S41 PolarHBondContact O-N 3.16Å; D38-S41 PolarHBondContact O-OG 2.91Å; S41-V44 PolarHBondContact O-N 2.84Å; S41-A45 PolarHBondContact O-N 3.22Å |
| 42 | E | 82.4 | Confident | 77.7 | Confident | 99 Ų | 99 | 88.2 Ų | 88.2 | 46% | 0.463 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -67 | -42.8 | 177 | -170.4 | 179.2 | 172.4 | 0 | 0 | 111.4 | D38 V44 A45 L46 | D38-E42 WeakPolarHBondContact O-CB 3.3Å; D38-E42 PolarHBondContact O-N 3.41Å; E42-V44 VanDerWaalsContact C-N 3.32Å; E42-V44 PolarHBondContact O-N 2.75Å; E42-A45 PolarHBondContact O-N 3.34Å; E42-L46 HydrophobicContact CG-CD1 4.21Å; E42-L46 WeakPolarHBondContact O-CB 3.43Å; E42-L46 WeakPolarHBondContact O-CG 3.32Å; E42-L46 PolarHBondContact O-N 3.27Å |
| 43 | S | 84.9 | Confident | 79.9 | Confident | 68 Ų | 68 | 83.8 Ų | 83.8 | 48% | 0.476 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -61.3 | -41.1 | 175.8 | -60.3 | 0 | 0 | 0 | 0 | 112.1 | V39 A40 F47 | V39-S43 WeakPolarHBondContact O-CB 3.4Å; V39-S43 PolarHBondContact O-N 3.28Å; V39-S43 PolarHBondContact O-OG 2.85Å; A40-S43 PolarHBondContact O-N 2.91Å; S43-F47 WeakPolarHBondContact O-CB 3.4Å; S43-F47 PolarHBondContact O-N 2.76Å |
| 44 | V | 89 | Confident | 82.2 | Confident | 80 Ų | 80 | 81.4 Ų | 81.4 | 49% | 0.485 | 45% | 0.451 | S | S | . | . | H | α-helix | trans | -65.9 | -43.7 | 176.3 | 170.5 | 0 | 0 | 0 | 0 | 110.9 | A40 S41 E42 F47 F48 | A40-V44 VanDerWaalsContact O-CG2 3.23Å; A40-V44 WeakPolarHBondContact O-CG2 3.4Å; A40-V44 PolarHBondContact O-N 3.28Å; S41-V44 PolarHBondContact O-N 2.84Å; E42-V44 VanDerWaalsContact C-N 3.32Å; E42-V44 PolarHBondContact O-N 2.75Å; V44-F47 PolarHBondContact O-N 2.93Å; V44-F48 HydrophobicContact CG1-CD2 3.81Å; V44-F48 HydrophobicContact CG1-CE2 3.52Å; V44-F48 WeakPolarHBondContact O-CD2 3.45Å; V44-F48 PolarHBondContact O-N 3.34Å; V44-F48 VanDerWaalsContact O-N 3.15Å |
| 45 | A | 87.6 | Confident | 84.2 | Confident | 39 Ų | 39 | 77.7 Ų | 77.7 | 32% | 0.322 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -60.5 | -47.9 | 176 | 0 | 0 | 0 | 0 | 0 | 111.5 | S41 E42 F47 F48 M49 | S41-A45 PolarHBondContact O-N 3.22Å; E42-A45 PolarHBondContact O-N 3.34Å; A45-F47 VanDerWaalsContact C-N 3.31Å; A45-F47 PolarHBondContact O-N 3.43Å; A45-F48 PolarHBondContact O-N 3.03Å; A45-M49 HydrophobicContact CB-CE 4.44Å; A45-M49 WeakPolarHBondContact O-CB 3.45Å; A45-M49 VanDerWaalsContact O-CG 3.24Å; A45-M49 WeakPolarHBondContact O-CG 3.35Å; A45-M49 PolarHBondContact O-N 2.89Å |
| 46 | L | 89.5 | Confident | 86.2 | Confident | 57 Ų | 57 | 75.8 Ų | 75.8 | 30% | 0.298 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -58.7 | -40.8 | 177.2 | -74.3 | 165 | 0 | 0 | 0 | 112.4 | E42 M49 L50 M98 | E42-L46 HydrophobicContact CG-CD1 4.21Å; E42-L46 WeakPolarHBondContact O-CB 3.43Å; E42-L46 WeakPolarHBondContact O-CG 3.32Å; E42-L46 PolarHBondContact O-N 3.27Å; L46-M49 HydrophobicContact CB-CE 4.33Å; L46-M49 HydrophobicContact CD2-CE 3.54Å; L46-M49 HydrophobicContact CG-CE 3.92Å; L46-M49 PolarHBondContact O-N 2.96Å; L46-L50 WeakPolarHBondContact O-CB 3.36Å; L46-L50 PolarHBondContact O-N 3.45Å; L46-M98 HydrophobicContact CD2-CE 4.2Å |
| 47 | F | 91.8 | Very high | 87.9 | Confident | 133 Ų | 133 | 71.3 Ų | 71.3 | 58% | 0.583 | 39% | 0.393 | S | S | * | . | H | α-helix | trans | -60 | -46.6 | 175.5 | 175.6 | -98.7 | 0 | 0 | 0 | 112.2 | S43 V44 A45 L50 L51 | S43-F47 WeakPolarHBondContact O-CB 3.4Å; S43-F47 PolarHBondContact O-N 2.76Å; V44-F47 PolarHBondContact O-N 2.93Å; A45-F47 VanDerWaalsContact C-N 3.31Å; A45-F47 PolarHBondContact O-N 3.43Å; F47-L50 PolarHBondContact O-N 2.85Å; F47-L51 WeakPolarHBondContact O-CB 3.5Å; F47-L51 PolarHBondContact O-N 2.7Å |
| 48 | F | 92.1 | Very high | 89.5 | Confident | 114 Ų | 114 | 67.4 Ų | 67.4 | 50% | 0.5 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -68.1 | -39.3 | 177.7 | -75.3 | -63.6 | 0 | 0 | 0 | 112.8 | V44 A45 L51 L52 | V44-F48 HydrophobicContact CG1-CD2 3.81Å; V44-F48 HydrophobicContact CG1-CE2 3.52Å; V44-F48 WeakPolarHBondContact O-CD2 3.45Å; V44-F48 PolarHBondContact O-N 3.34Å; V44-F48 VanDerWaalsContact O-N 3.15Å; A45-F48 PolarHBondContact O-N 3.03Å; F48-L51 PolarHBondContact O-N 3.25Å; F48-L52 WeakPolarHBondContact O-CB 3.32Å; F48-L52 WeakPolarHBondContact O-CG 3.45Å; F48-L52 PolarHBondContact O-N 3.48Å |
| 49 | M | 93.4 | Very high | 90.7 | Very high | 14 Ų | 14 | 63.8 Ų | 63.8 | 7% | 0.069 | 37% | 0.372 | C | S | . | . | H | α-helix | trans | -60.7 | -44.6 | 175.2 | -71.4 | -174.2 | -54.4 | 0 | 0 | 111.3 | A45 L46 L52 D53 M98 W328 | A45-M49 HydrophobicContact CB-CE 4.44Å; A45-M49 WeakPolarHBondContact O-CB 3.45Å; A45-M49 VanDerWaalsContact O-CG 3.24Å; A45-M49 WeakPolarHBondContact O-CG 3.35Å; A45-M49 PolarHBondContact O-N 2.89Å; L46-M49 HydrophobicContact CB-CE 4.33Å; L46-M49 HydrophobicContact CD2-CE 3.54Å; L46-M49 HydrophobicContact CG-CE 3.92Å; L46-M49 PolarHBondContact O-N 2.96Å; M49-L52 PolarHBondContact O-N 3.46Å; M49-D53 WeakPolarHBondContact O-CB 3.05Å; M49-D53 PolarHBondContact O-N 3.41Å; M49-M98 HydrophobicContact CB-CE 4.16Å; M49-M98 HydrophobicContact CB-CG 4.18Å; M49-M98 HydrophobicContact CB-SD 4.23Å; M49-W328 HydrophobicContact CB-CD2 4.32Å; M49-W328 HydrophobicContact CB-CE3 4.06Å; M49-W328 HydrophobicContact CB-CH2 3.52Å; M49-W328 HydrophobicContact CB-CZ2 3.8Å; M49-W328 HydrophobicContact CB-CZ3 3.64Å; M49-W328 HydrophobicContact CG-CD2 3.59Å; M49-W328 HydrophobicContact CG-CE3 3.73Å; M49-W328 HydrophobicContact CG-CG 4.2Å; M49-W328 HydrophobicContact CG-CH2 3.87Å; M49-W328 HydrophobicContact CG-CZ2 3.73Å; M49-W328 HydrophobicContact CG-CZ3 3.85Å; M49-W328 HydrophobicContact SD-CD2 3.72Å; M49-W328 HydrophobicContact SD-CE3 4.43Å; M49-W328 HydrophobicContact SD-CG 4.06Å; M49-W328 HydrophobicContact SD-CH2 4.23Å; M49-W328 HydrophobicContact SD-CZ2 3.47Å; M49-W328 WeakPolarHBondContact SD-CZ2 3.43Å; M49-W328 PolarHBondContact SD-NE1 3.47Å |
| 50 | L | 94.9 | Very high | 91.7 | Very high | 81 Ų | 81 | 59.6 Ų | 59.6 | 42% | 0.424 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -63.1 | -44.1 | 174.8 | -177.9 | 63.4 | 0 | 0 | 0 | 112 | L46 F47 L52 D53 L54 M98 | L46-L50 WeakPolarHBondContact O-CB 3.36Å; L46-L50 PolarHBondContact O-N 3.45Å; F47-L50 PolarHBondContact O-N 2.85Å; L50-L52 VanDerWaalsContact C-N 3.31Å; L50-L52 PolarHBondContact O-N 3Å; L50-D53 PolarHBondContact O-N 3.33Å; L50-L54 HydrophobicContact CD1-CD1 4.42Å; L50-L54 HydrophobicContact CD1-CG 4.3Å; L50-L54 HydrophobicContact CG-CD1 4.14Å; L50-L54 HydrophobicContact CG-CG 4.42Å; L50-L54 WeakPolarHBondContact O-CG 3.26Å; L50-L54 PolarHBondContact O-N 3.46Å; L50-M98 HydrophobicContact CB-CE 3.98Å |
| 51 | L | 95.5 | Very high | 92.5 | Very high | 84 Ų | 84 | 58.8 Ų | 58.8 | 44% | 0.44 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -62 | -41.3 | 178.2 | -178 | 64.3 | 0 | 0 | 0 | 111.5 | F47 F48 T55 | F47-L51 WeakPolarHBondContact O-CB 3.5Å; F47-L51 PolarHBondContact O-N 2.7Å; F48-L51 PolarHBondContact O-N 3.25Å; L51-T55 WeakPolarHBondContact O-CB 3.4Å; L51-T55 PolarHBondContact O-N 2.7Å; L51-T55 PolarHBondContact O-OG1 2.86Å |
| 52 | L | 95.2 | Very high | 93.1 | Very high | 48 Ų | 48 | 56.8 Ų | 56.8 | 25% | 0.251 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -61.8 | -43.1 | 175.3 | -79.3 | 173.8 | 0 | 0 | 0 | 112 | F48 M49 L50 T55 A56 M94 W328 F332 T335 | F48-L52 WeakPolarHBondContact O-CB 3.32Å; F48-L52 WeakPolarHBondContact O-CG 3.45Å; F48-L52 PolarHBondContact O-N 3.48Å; M49-L52 PolarHBondContact O-N 3.46Å; L50-L52 VanDerWaalsContact C-N 3.31Å; L50-L52 PolarHBondContact O-N 3Å; L52-T55 PolarHBondContact O-N 3.07Å; L52-A56 WeakPolarHBondContact O-CB 3.49Å; L52-A56 PolarHBondContact O-N 3.15Å; L52-M94 HydrophobicContact CB-CE 4.41Å; L52-W328 HydrophobicContact CD1-CE3 4.33Å; L52-F332 HydrophobicContact CD2-CD2 3.74Å; L52-F332 HydrophobicContact CD2-CE2 4.2Å; L52-T335 HydrophobicContact CD2-CG2 4.31Å; L52-T335 PolarHBondContact O-OG1 2.89Å |
| 53 | D | 96.4 | Very high | 93.6 | Very high | 15 Ų | 15 | 52.2 Ų | 52.2 | 8% | 0.08 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -64.9 | -50.5 | 178.2 | -172.8 | 49.3 | 0 | 0 | 0 | 112.1 | M49 L50 T55 A56 V57 A90 M94 | M49-D53 WeakPolarHBondContact O-CB 3.05Å; M49-D53 PolarHBondContact O-N 3.41Å; L50-D53 PolarHBondContact O-N 3.33Å; D53-T55 VanDerWaalsContact C-N 3.26Å; D53-T55 PolarHBondContact O-N 2.96Å; D53-A56 WeakPolarHBondContact O-CA 3.36Å; D53-A56 WeakPolarHBondContact O-CB 3.3Å; D53-A56 PolarHBondContact O-N 3.39Å; D53-V57 WeakPolarHBondContact O-CG2 3.5Å; D53-V57 PolarHBondContact O-N 3.04Å; D53-A90 WeakPolarHBondContact OD1-CA 3.23Å; D53-M94 HydrophobicContact CB-CE 3.97Å; D53-M94 WeakPolarHBondContact OD1-CB 3.45Å |
| 54 | L | 96.9 | Very high | 94.1 | Very high | 100 Ų | 100 | 50.8 Ų | 50.8 | 52% | 0.524 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -58.4 | -39.6 | 176.4 | -69.4 | 176.4 | 0 | 0 | 0 | 112 | L50 V57 A58 | L50-L54 HydrophobicContact CD1-CD1 4.42Å; L50-L54 HydrophobicContact CD1-CG 4.3Å; L50-L54 HydrophobicContact CG-CD1 4.14Å; L50-L54 HydrophobicContact CG-CG 4.42Å; L50-L54 WeakPolarHBondContact O-CG 3.26Å; L50-L54 PolarHBondContact O-N 3.46Å; L54-V57 PolarHBondContact O-N 2.74Å; L54-A58 VanDerWaalsContact O-CB 3.32Å; L54-A58 WeakPolarHBondContact O-CB 3.31Å; L54-A58 PolarHBondContact O-N 3Å |
| 55 | T | 95.6 | Very high | 94.2 | Very high | 70 Ų | 70 | 48.8 Ų | 48.8 | 43% | 0.429 | 28% | 0.284 | S | S | . | . | H | α-helix | trans | -66.9 | -38.6 | 176.1 | -55.3 | 0 | 0 | 0 | 0 | 111.2 | L51 L52 D53 G59 T335 | L51-T55 WeakPolarHBondContact O-CB 3.4Å; L51-T55 PolarHBondContact O-N 2.7Å; L51-T55 PolarHBondContact O-OG1 2.86Å; L52-T55 PolarHBondContact O-N 3.07Å; D53-T55 VanDerWaalsContact C-N 3.26Å; D53-T55 PolarHBondContact O-N 2.96Å; T55-G59 PolarHBondContact O-N 3.46Å; T55-T335 HydrophobicContact CG2-CG2 3.64Å |
| 56 | A | 96.8 | Very high | 94.4 | Very high | 0 Ų | 0 | 46.9 Ų | 46.9 | 0% | 0 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -63.9 | -46.8 | 175.5 | 0 | 0 | 0 | 0 | 0 | 111.4 | L52 D53 N60 A90 M94 T335 | L52-A56 WeakPolarHBondContact O-CB 3.49Å; L52-A56 PolarHBondContact O-N 3.15Å; D53-A56 WeakPolarHBondContact O-CA 3.36Å; D53-A56 WeakPolarHBondContact O-CB 3.3Å; D53-A56 PolarHBondContact O-N 3.39Å; A56-N60 VanDerWaalsContact O-CB 3.28Å; A56-N60 WeakPolarHBondContact O-CB 3.3Å; A56-N60 PolarHBondContact O-N 2.81Å; A56-N60 PolarHBondContact O-ND2 3.36Å; A56-A90 HydrophobicContact CB-CB 3.81Å; A56-M94 HydrophobicContact CB-SD 4.37Å; A56-T335 HydrophobicContact CB-CG2 4.45Å |
| 57 | V | 97.7 | Very high | 94.4 | Very high | 41 Ų | 41 | 44.4 Ų | 44.4 | 25% | 0.248 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -59.5 | -53.4 | 176.9 | 174.2 | 0 | 0 | 0 | 0 | 110.6 | D53 L54 A61 L87 A90 L91 | D53-V57 WeakPolarHBondContact O-CG2 3.5Å; D53-V57 PolarHBondContact O-N 3.04Å; L54-V57 PolarHBondContact O-N 2.74Å; V57-A61 WeakPolarHBondContact O-CB 3.47Å; V57-A61 PolarHBondContact O-N 3.48Å; V57-L87 HydrophobicContact CB-CD1 4.33Å; V57-L87 HydrophobicContact CG1-CD1 3.98Å; V57-L87 HydrophobicContact CG2-CD1 4.48Å; V57-A90 HydrophobicContact CG2-CB 3.71Å; V57-L91 HydrophobicContact CG1-CD2 4.41Å; V57-L91 HydrophobicContact CG2-CD2 4.09Å |
| 58 | A | 95.8 | Very high | 94.4 | Very high | 63 Ų | 63 | 40.6 Ų | 40.6 | 52% | 0.521 | 25% | 0.248 | S | C | . | . | H | α-helix | trans | -63.7 | -46.3 | -177.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | L54 A62 | L54-A58 VanDerWaalsContact O-CB 3.32Å; L54-A58 WeakPolarHBondContact O-CB 3.31Å; L54-A58 PolarHBondContact O-N 3Å; A58-A62 VanDerWaalsContact O-CB 3.22Å; A58-A62 WeakPolarHBondContact O-CB 3.4Å; A58-A62 PolarHBondContact O-N 2.9Å |
| 59 | G | 94.4 | Very high | 94.3 | Very high | 22 Ų | 22 | 41.5 Ų | 41.5 | 23% | 0.227 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -64.8 | -48.1 | -178 | 0 | 0 | 0 | 0 | 0 | 112.8 | T55 A62 V63 | T55-G59 PolarHBondContact O-N 3.46Å; G59-A62 PolarHBondContact O-N 3.07Å; G59-V63 WeakPolarHBondContact O-CG2 3.41Å; G59-V63 PolarHBondContact O-N 3.02Å; G59-V63 VanDerWaalsContact O-N 3.11Å |
| 60 | N | 96.4 | Very high | 94 | Very high | 0 Ų | 0 | 41.9 Ų | 41.9 | 0% | 0 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -68.4 | -41.8 | -180 | -74.5 | -65.5 | 0 | 0 | 0 | 111.8 | A56 A62 V63 M64 C83 D86 L87 F334 P338 | A56-N60 VanDerWaalsContact O-CB 3.28Å; A56-N60 WeakPolarHBondContact O-CB 3.3Å; A56-N60 PolarHBondContact O-N 2.81Å; A56-N60 PolarHBondContact O-ND2 3.36Å; N60-A62 PolarHBondContact O-N 3.21Å; N60-V63 PolarHBondContact O-N 3.39Å; N60-M64 WeakPolarHBondContact O-CB 3.32Å; N60-M64 PolarHBondContact O-N 3.19Å; N60-C83 HydrophobicContact CB-CB 4.35Å; N60-D86 WeakPolarHBondContact ND2-CB 3.47Å; N60-D86 WeakPolarHBondContact OD1-CB 3.47Å; N60-L87 HydrophobicContact CB-CB 4.11Å; N60-F334 PolarHBondContact ND2-O 3.37Å; N60-P338 HydrophobicContact CB-CG 4.29Å; N60-P338 VanDerWaalsContact CG-CG 3.49Å; N60-P338 WeakPolarHBondContact OD1-CD 3.28Å; N60-P338 WeakPolarHBondContact OD1-CG 3.38Å |
| 61 | A | 95.6 | Very high | 93.6 | Very high | 36 Ų | 36 | 42.2 Ų | 42.2 | 30% | 0.298 | 26% | 0.262 | S | S | . | . | H | α-helix | trans | -62.3 | -42 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | V57 M64 A65 | V57-A61 WeakPolarHBondContact O-CB 3.47Å; V57-A61 PolarHBondContact O-N 3.48Å; A61-M64 PolarHBondContact O-N 2.99Å; A61-A65 VanDerWaalsContact O-CB 3.28Å; A61-A65 WeakPolarHBondContact O-CB 3.47Å; A61-A65 PolarHBondContact O-N 3.41Å |
| 62 | A | 92.9 | Very high | 93 | Very high | 28 Ų | 28 | 41.6 Ų | 41.6 | 23% | 0.231 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -63 | -48.2 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | A58 G59 N60 M64 A65 V66 L352 | A58-A62 VanDerWaalsContact O-CB 3.22Å; A58-A62 WeakPolarHBondContact O-CB 3.4Å; A58-A62 PolarHBondContact O-N 2.9Å; G59-A62 PolarHBondContact O-N 3.07Å; N60-A62 PolarHBondContact O-N 3.21Å; A62-M64 VanDerWaalsContact C-N 3.35Å; A62-M64 PolarHBondContact O-N 2.98Å; A62-A65 PolarHBondContact O-N 2.95Å; A62-V66 WeakPolarHBondContact O-CG2 3.47Å; A62-V66 PolarHBondContact O-N 2.84Å; A62-L352 HydrophobicContact CB-CD1 4.39Å |
| 63 | V | 93.3 | Very high | 92.5 | Very high | 3 Ų | 3 | 39.5 Ų | 39.5 | 2% | 0.018 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -63.3 | -43.4 | 177.8 | 173.5 | 0 | 0 | 0 | 0 | 110.9 | G59 N60 A65 V66 I67 P338 I348 | G59-V63 WeakPolarHBondContact O-CG2 3.41Å; G59-V63 PolarHBondContact O-N 3.02Å; G59-V63 VanDerWaalsContact O-N 3.11Å; N60-V63 PolarHBondContact O-N 3.39Å; V63-A65 PolarHBondContact O-N 3.25Å; V63-V66 PolarHBondContact O-N 3.36Å; V63-I67 HydrophobicContact CG1-CD1 3.8Å; V63-I67 WeakPolarHBondContact O-CG1 3.48Å; V63-I67 PolarHBondContact O-N 3.48Å; V63-P338 HydrophobicContact CG2-CB 3.86Å; V63-I348 HydrophobicContact CG1-CG2 4.46Å |
| 64 | M | 94.1 | Very high | 91.8 | Very high | 38 Ų | 38 | 46.2 Ų | 46.2 | 19% | 0.187 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -60.8 | -44 | 177.4 | -169.9 | 174.7 | 59.5 | 0 | 0 | 111.9 | N60 A61 A62 I67 A68 F80 C83 L84 L87 | N60-M64 WeakPolarHBondContact O-CB 3.32Å; N60-M64 PolarHBondContact O-N 3.19Å; A61-M64 PolarHBondContact O-N 2.99Å; A62-M64 VanDerWaalsContact C-N 3.35Å; A62-M64 PolarHBondContact O-N 2.98Å; M64-I67 PolarHBondContact O-N 3.4Å; M64-A68 WeakPolarHBondContact O-CB 3.3Å; M64-A68 PolarHBondContact O-N 3.33Å; M64-F80 HydrophobicContact CB-CE2 4.43Å; M64-F80 HydrophobicContact CG-CD2 3.75Å; M64-F80 HydrophobicContact CG-CE1 4.47Å; M64-F80 HydrophobicContact CG-CE2 3.24Å; M64-F80 HydrophobicContact CG-CZ 3.66Å; M64-F80 HydrophobicContact SD-CE2 4.21Å; M64-F80 HydrophobicContact SD-CZ 3.99Å; M64-C83 HydrophobicContact CB-CB 4.27Å; M64-L84 HydrophobicContact SD-CB 4.34Å; M64-L84 HydrophobicContact SD-CD1 4.34Å; M64-L87 HydrophobicContact CE-CD2 3.52Å |
| 65 | A | 92 | Very high | 91.2 | Very high | 38 Ų | 38 | 47.4 Ų | 47.4 | 31% | 0.314 | 28% | 0.284 | S | S | . | . | H | α-helix | trans | -64.2 | -40.5 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | A61 A62 V63 A68 K69 | A61-A65 VanDerWaalsContact O-CB 3.28Å; A61-A65 WeakPolarHBondContact O-CB 3.47Å; A61-A65 PolarHBondContact O-N 3.41Å; A62-A65 PolarHBondContact O-N 2.95Å; V63-A65 PolarHBondContact O-N 3.25Å; A65-A68 PolarHBondContact O-N 2.88Å; A65-K69 WeakPolarHBondContact O-CB 3.45Å; A65-K69 WeakPolarHBondContact O-CG 3.01Å; A65-K69 PolarHBondContact O-N 2.94Å |
| 66 | V | 91.1 | Very high | 90.9 | Very high | 0 Ų | 0 | 44.9 Ų | 44.9 | 0% | 0 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -62.5 | -45.7 | 175.4 | 168.5 | 0 | 0 | 0 | 0 | 111.1 | A62 V63 A68 K69 T70 L73 I348 E351 L352 Q355 | A62-V66 WeakPolarHBondContact O-CG2 3.47Å; A62-V66 PolarHBondContact O-N 2.84Å; V63-V66 PolarHBondContact O-N 3.36Å; V66-A68 VanDerWaalsContact C-N 3.34Å; V66-A68 PolarHBondContact O-N 3.45Å; V66-K69 PolarHBondContact O-N 3.08Å; V66-T70 WeakPolarHBondContact O-CB 3.25Å; V66-T70 PolarHBondContact O-N 3.43Å; V66-T70 VanDerWaalsContact O-N 3.08Å; V66-T70 PolarHBondContact O-OG1 3.01Å; V66-L73 HydrophobicContact CG1-CD1 3.68Å; V66-I348 HydrophobicContact CG1-CG2 4.43Å; V66-E351 HydrophobicContact CG1-CB 3.68Å; V66-L352 HydrophobicContact CG2-CB 4.42Å; V66-L352 HydrophobicContact CG2-CD1 3.63Å; V66-Q355 HydrophobicContact CG2-CG 4.48Å |
| 67 | I | 90.9 | Very high | 90.6 | Very high | 5 Ų | 5 | 47.1 Ų | 47.1 | 3% | 0.026 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -64.7 | -40.8 | 179.1 | -65.8 | 166.3 | 0 | 0 | 0 | 110.9 | V63 M64 L73 V79 F80 I348 | V63-I67 HydrophobicContact CG1-CD1 3.8Å; V63-I67 WeakPolarHBondContact O-CG1 3.48Å; V63-I67 PolarHBondContact O-N 3.48Å; M64-I67 PolarHBondContact O-N 3.4Å; I67-L73 HydrophobicContact CG1-CB 4.46Å; I67-L73 HydrophobicContact CG2-CB 4.42Å; I67-V79 HydrophobicContact CD1-CB 4.41Å; I67-V79 HydrophobicContact CD1-CG1 4.02Å; I67-F80 HydrophobicContact CB-CD2 4.16Å; I67-F80 HydrophobicContact CD1-CB 4.47Å; I67-F80 HydrophobicContact CG2-CB 4.19Å; I67-F80 HydrophobicContact CG2-CD2 3.9Å; I67-F80 HydrophobicContact CG2-CG 4.5Å; I67-I348 HydrophobicContact CD1-CD1 4.37Å |
| 68 | A | 90.8 | Very high | 90.4 | Very high | 52 Ų | 52 | 45.7 Ų | 45.7 | 43% | 0.43 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -65.5 | -43.5 | 179.4 | 0 | 0 | 0 | 0 | 0 | 112.6 | M64 A65 V66 F80 | M64-A68 WeakPolarHBondContact O-CB 3.3Å; M64-A68 PolarHBondContact O-N 3.33Å; A65-A68 PolarHBondContact O-N 2.88Å; V66-A68 VanDerWaalsContact C-N 3.34Å; V66-A68 PolarHBondContact O-N 3.45Å; A68-F80 HydrophobicContact CB-CE2 4.34Å |
| 69 | K | 90 | Very high | 90.3 | Very high | 133 Ų | 133 | 42.7 Ų | 42.7 | 58% | 0.578 | 25% | 0.246 | S | C | * | . | H | α-helix | trans | -74.4 | -27.8 | -177.4 | -74 | 179 | 177.3 | 173.6 | 0 | 113.4 | A65 V66 P71 | A65-K69 WeakPolarHBondContact O-CB 3.45Å; A65-K69 WeakPolarHBondContact O-CG 3.01Å; A65-K69 PolarHBondContact O-N 2.94Å; V66-K69 PolarHBondContact O-N 3.08Å; K69-P71 WeakPolarHBondContact O-CD 3.47Å |
| 70 | T | 87.6 | Confident | 90.3 | Very high | 22 Ų | 22 | 44.9 Ų | 44.9 | 14% | 0.135 | 25% | 0.25 | C | C | . | . | trans | -102.9 | 108 | -175.8 | -57.1 | 0 | 0 | 0 | 0 | 111.7 | V66 A72 L73 E351 | V66-T70 WeakPolarHBondContact O-CB 3.25Å; V66-T70 PolarHBondContact O-N 3.43Å; V66-T70 VanDerWaalsContact O-N 3.08Å; V66-T70 PolarHBondContact O-OG1 3.01Å; T70-A72 HydrophobicContact CG2-CB 4.17Å; T70-A72 PolarHBondContact O-N 3.48Å; T70-A72 VanDerWaalsContact O-N 3.14Å; T70-L73 HydrophobicContact CG2-CD1 4.18Å; T70-L73 HydrophobicContact CG2-CG 3.89Å; T70-L73 PolarHBondContact O-N 3.17Å; T70-E351 HydrophobicContact CG2-CG 4.11Å | ||
| 71 | P | 86.5 | Confident | 90.3 | Very high | 88 Ų | 88 | 45.4 Ų | 45.4 | 57% | 0.571 | 25% | 0.252 | S | S | * | . | G | 310 helix | trans | -56.1 | -35.6 | -178.5 | -26.1 | 35.1 | 0 | 0 | 0 | 113.9 | K69 L73 R74 | K69-P71 WeakPolarHBondContact O-CD 3.47Å; P71-L73 PolarHBondContact O-N 3.43Å; P71-R74 WeakPolarHBondContact O-CB 3.49Å; P71-R74 WeakPolarHBondContact O-CG 3.3Å; P71-R74 PolarHBondContact O-N 3.48Å; P71-R74 VanDerWaalsContact O-N 3.16Å |
| 72 | A | 83.3 | Confident | 90.3 | Very high | 72 Ų | 72 | 43.7 Ų | 43.7 | 60% | 0.595 | 24% | 0.238 | S | C | * | . | G | 310 helix | trans | -64 | -20 | 178.6 | 0 | 0 | 0 | 0 | 0 | 114.1 | T70 | T70-A72 HydrophobicContact CG2-CB 4.17Å; T70-A72 PolarHBondContact O-N 3.48Å; T70-A72 VanDerWaalsContact O-N 3.14Å |
| 73 | L | 83.6 | Confident | 90.5 | Very high | 4 Ų | 4 | 42.4 Ų | 42.4 | 2% | 0.021 | 23% | 0.227 | C | C | . | . | G | 310 helix | trans | -95.5 | -7.5 | 179.2 | -60.9 | -178.6 | 0 | 0 | 0 | 113.1 | V66 I67 T70 P71 K75 F76 Q347 I348 E351 | V66-L73 HydrophobicContact CG1-CD1 3.68Å; I67-L73 HydrophobicContact CG1-CB 4.46Å; I67-L73 HydrophobicContact CG2-CB 4.42Å; T70-L73 HydrophobicContact CG2-CD1 4.18Å; T70-L73 HydrophobicContact CG2-CG 3.89Å; T70-L73 PolarHBondContact O-N 3.17Å; P71-L73 PolarHBondContact O-N 3.43Å; L73-K75 PolarHBondContact O-N 3.26Å; L73-F76 HydrophobicContact CB-CD2 4.2Å; L73-F76 HydrophobicContact CD2-CD2 3.95Å; L73-F76 HydrophobicContact CD2-CE2 3.71Å; L73-F76 WeakPolarHBondContact O-CB 3.28Å; L73-F76 WeakPolarHBondContact O-CD2 3.4Å; L73-F76 PolarHBondContact O-N 3.02Å; L73-Q347 HydrophobicContact CD2-CB 3.94Å; L73-I348 HydrophobicContact CD1-CG1 4.24Å; L73-I348 HydrophobicContact CD2-CG1 4.08Å; L73-E351 HydrophobicContact CD1-CB 4.13Å; L73-E351 HydrophobicContact CD1-CG 4.07Å |
| 74 | R | 83.1 | Confident | 90.7 | Very high | 155 Ų | 155 | 45.1 Ų | 45.1 | 59% | 0.585 | 24% | 0.241 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -61.6 | -17.4 | -178.5 | -68.1 | 180 | -178.2 | 175.8 | 0.6 | 114.2 | P71 F76 V77 | P71-R74 WeakPolarHBondContact O-CB 3.49Å; P71-R74 WeakPolarHBondContact O-CG 3.3Å; P71-R74 PolarHBondContact O-N 3.48Å; P71-R74 VanDerWaalsContact O-N 3.16Å; R74-F76 PolarHBondContact O-N 3.21Å; R74-V77 VanDerWaalsContact O-CG2 3.24Å; R74-V77 WeakPolarHBondContact O-CG2 3.45Å |
| 75 | K | 83.6 | Confident | 90.9 | Very high | 125 Ų | 125 | 43.3 Ų | 43.3 | 54% | 0.543 | 23% | 0.232 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -66.3 | -19.8 | 171.2 | 64.8 | -176.8 | 176.9 | -176.6 | 0 | 113.7 | L73 V77 | L73-K75 PolarHBondContact O-N 3.26Å; K75-V77 PolarHBondContact O-N 3.32Å; K75-V77 VanDerWaalsContact O-N 3.09Å |
| 76 | F | 88.4 | Confident | 91.2 | Very high | 17 Ų | 17 | 41.5 Ų | 41.5 | 8% | 0.075 | 22% | 0.217 | C | C | . | . | trans | -85.4 | 50.9 | 179 | -62.7 | -69.8 | 0 | 0 | 0 | 112.2 | L73 R74 F78 V79 F80 Q347 I348 | L73-F76 HydrophobicContact CB-CD2 4.2Å; L73-F76 HydrophobicContact CD2-CD2 3.95Å; L73-F76 HydrophobicContact CD2-CE2 3.71Å; L73-F76 WeakPolarHBondContact O-CB 3.28Å; L73-F76 WeakPolarHBondContact O-CD2 3.4Å; L73-F76 PolarHBondContact O-N 3.02Å; R74-F76 PolarHBondContact O-N 3.21Å; F76-F78 PolarHBondContact O-N 2.87Å; F76-V79 HydrophobicContact CB-CB 4.21Å; F76-V79 HydrophobicContact CB-CG2 4.28Å; F76-V79 PolarHBondContact O-N 3.45Å; F76-F80 PolarHBondContact O-N 2.9Å; F76-Q347 HydrophobicContact CE2-CB 4.41Å; F76-Q347 VanDerWaalsContact CZ-OE1 3.3Å; F76-I348 HydrophobicContact CD2-CD1 4.38Å; F76-I348 HydrophobicContact CD2-CG1 4.41Å; F76-I348 HydrophobicContact CG-CD1 4.49Å | ||
| 77 | V | 92.1 | Very high | 91.5 | Very high | 47 Ų | 47 | 42.5 Ų | 42.5 | 29% | 0.285 | 22% | 0.223 | S | C | . | . | H | α-helix | trans | -62.2 | -40.2 | -173.8 | -177.8 | 0 | 0 | 0 | 0 | 112.1 | R74 K75 V79 F80 H81 V159 L163 | R74-V77 VanDerWaalsContact O-CG2 3.24Å; R74-V77 WeakPolarHBondContact O-CG2 3.45Å; K75-V77 PolarHBondContact O-N 3.32Å; K75-V77 VanDerWaalsContact O-N 3.09Å; V77-V79 VanDerWaalsContact C-N 3.32Å; V77-V79 PolarHBondContact O-N 3.06Å; V77-F80 WeakPolarHBondContact O-CB 3.38Å; V77-F80 PolarHBondContact O-N 3.31Å; V77-H81 PolarHBondContact O-N 3.31Å; V77-V159 HydrophobicContact CB-CG1 4.04Å; V77-V159 HydrophobicContact CG1-CG1 3.82Å; V77-L163 HydrophobicContact CG1-CD1 4.08Å |
| 78 | F | 93.8 | Very high | 91.8 | Very high | 11 Ų | 11 | 45.2 Ų | 45.2 | 5% | 0.048 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -65.5 | -35.2 | 177.5 | -66.6 | -57.6 | 0 | 0 | 0 | 113 | F76 H81 L82 A135 I136 E139 M154 V159 V162 L163 | F76-F78 PolarHBondContact O-N 2.87Å; F78-H81 PolarHBondContact O-N 3.48Å; F78-L82 WeakPolarHBondContact O-CB 3.39Å; F78-L82 PolarHBondContact O-N 2.93Å; F78-A135 HydrophobicContact CD1-CB 4.06Å; F78-A135 HydrophobicContact CE1-CB 4.06Å; F78-A135 HydrophobicContact CZ-CB 4.46Å; F78-I136 HydrophobicContact CB-CD1 4.48Å; F78-I136 HydrophobicContact CB-CG1 3.62Å; F78-E139 HydrophobicContact CD2-CB 4.09Å; F78-E139 HydrophobicContact CD2-CG 4.24Å; F78-E139 HydrophobicContact CE2-CB 4.09Å; F78-E139 HydrophobicContact CE2-CG 4.32Å; F78-M154 HydrophobicContact CD2-CE 4.25Å; F78-M154 HydrophobicContact CE2-CE 3.44Å; F78-M154 VanDerWaalsContact CE2-CE 3.44Å; F78-M154 HydrophobicContact CZ-CE 4.13Å; F78-V159 HydrophobicContact CE1-CG1 4.1Å; F78-V159 HydrophobicContact CZ-CG1 4.16Å; F78-V159 HydrophobicContact CZ-CG2 4.42Å; F78-V162 HydrophobicContact CE1-CB 4.21Å; F78-V162 HydrophobicContact CE1-CG1 3.79Å; F78-V162 HydrophobicContact CZ-CB 4.36Å; F78-V162 HydrophobicContact CZ-CG1 4.11Å; F78-L163 HydrophobicContact CD1-CD2 3.77Å; F78-L163 HydrophobicContact CE1-CD2 3.97Å; F78-L163 HydrophobicContact CE1-CG 4.36Å |
| 79 | V | 93.3 | Very high | 92.1 | Very high | 1 Ų | 1 | 42.7 Ų | 42.7 | 1% | 0.006 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -69 | -40.4 | 175.6 | -178.8 | 0 | 0 | 0 | 0 | 110.3 | I67 F76 V77 L82 C83 I136 I348 | I67-V79 HydrophobicContact CD1-CB 4.41Å; I67-V79 HydrophobicContact CD1-CG1 4.02Å; F76-V79 HydrophobicContact CB-CB 4.21Å; F76-V79 HydrophobicContact CB-CG2 4.28Å; F76-V79 PolarHBondContact O-N 3.45Å; V77-V79 VanDerWaalsContact C-N 3.32Å; V77-V79 PolarHBondContact O-N 3.06Å; V79-L82 PolarHBondContact O-N 3.36Å; V79-C83 PolarHBondContact O-N 3.32Å; V79-C83 PolarHBondContact O-SG 3.33Å; V79-I136 HydrophobicContact CG2-CD1 4.31Å; V79-I348 HydrophobicContact CG1-CD1 4.37Å |
| 80 | F | 94.6 | Very high | 92.5 | Very high | 68 Ų | 68 | 36.4 Ų | 36.4 | 30% | 0.298 | 19% | 0.189 | S | C | . | . | H | α-helix | trans | -60.6 | -45.7 | 173.7 | -177.4 | -84.6 | 0 | 0 | 0 | 111.8 | M64 I67 A68 F76 V77 C83 L84 | M64-F80 HydrophobicContact CB-CE2 4.43Å; M64-F80 HydrophobicContact CG-CD2 3.75Å; M64-F80 HydrophobicContact CG-CE1 4.47Å; M64-F80 HydrophobicContact CG-CE2 3.24Å; M64-F80 HydrophobicContact CG-CZ 3.66Å; M64-F80 HydrophobicContact SD-CE2 4.21Å; M64-F80 HydrophobicContact SD-CZ 3.99Å; I67-F80 HydrophobicContact CB-CD2 4.16Å; I67-F80 HydrophobicContact CD1-CB 4.47Å; I67-F80 HydrophobicContact CG2-CB 4.19Å; I67-F80 HydrophobicContact CG2-CD2 3.9Å; I67-F80 HydrophobicContact CG2-CG 4.5Å; A68-F80 HydrophobicContact CB-CE2 4.34Å; F76-F80 PolarHBondContact O-N 2.9Å; V77-F80 WeakPolarHBondContact O-CB 3.38Å; V77-F80 PolarHBondContact O-N 3.31Å; F80-C83 PolarHBondContact O-N 2.88Å; F80-L84 PolarHBondContact O-N 2.97Å |
| 81 | H | 96.1 | Very high | 92.9 | Very high | 10 Ų | 10 | 40 Ų | 40 | 5% | 0.046 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -63.1 | -41.1 | 176.7 | 173.8 | -103.1 | 0 | 0 | 0 | 112.2 | V77 F78 L84 V85 S132 L163 W167 | V77-H81 PolarHBondContact O-N 3.31Å; F78-H81 PolarHBondContact O-N 3.48Å; H81-L84 WeakPolarHBondContact O-CB 3.15Å; H81-L84 PolarHBondContact O-N 3.47Å; H81-V85 WeakPolarHBondContact O-CG2 3.45Å; H81-V85 PolarHBondContact O-N 2.96Å; H81-S132 PolarHBondContact CE1-OG 3.09Å; H81-S132 PolarHBondContact ND1-OG 3.4Å; H81-S132 VanDerWaalsContact ND1-OG 3.14Å; H81-L163 HydrophobicContact CB-CD1 4.48Å; H81-L163 HydrophobicContact CB-CD2 3.92Å; H81-W167 AromaticContact CD2-NE1 3.91Å; H81-W167 AromaticContact NE2-CD1 4Å; H81-W167 AromaticContact NE2-CE2 3.8Å; H81-W167 AromaticContact NE2-NE1 3.17Å; H81-W167 PolarHBondContact NE2-NE1 3.45Å; H81-W167 VanDerWaalsContact NE2-NE1 3.17Å |
| 82 | L | 95.8 | Very high | 93.3 | Very high | 0 Ų | 0 | 38.5 Ų | 38.5 | 0% | 0 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -57.7 | -50.1 | 173.4 | -180 | 64.3 | 0 | 0 | 0 | 111.3 | F78 V79 L84 V85 D86 V133 I136 N337 Y341 | F78-L82 WeakPolarHBondContact O-CB 3.39Å; F78-L82 PolarHBondContact O-N 2.93Å; V79-L82 PolarHBondContact O-N 3.36Å; L82-L84 VanDerWaalsContact C-N 3.27Å; L82-L84 PolarHBondContact O-N 3.32Å; L82-V85 PolarHBondContact O-N 2.95Å; L82-D86 WeakPolarHBondContact O-CB 3.25Å; L82-D86 PolarHBondContact O-N 3.15Å; L82-V133 HydrophobicContact CD1-CG2 4.08Å; L82-V133 HydrophobicContact CD2-CG2 4.16Å; L82-I136 HydrophobicContact CB-CD1 4.18Å; L82-I136 HydrophobicContact CD2-CD1 3.67Å; L82-N337 HydrophobicContact CD2-CB 4.09Å; L82-N337 HydrophobicContact CG-CB 4.46Å; L82-Y341 HydrophobicContact CD2-CD2 3.59Å; L82-Y341 HydrophobicContact CD2-CE2 3.83Å; L82-Y341 HydrophobicContact CD2-CG 4.16Å |
| 83 | C | 96.9 | Very high | 93.9 | Very high | 2 Ų | 2 | 35 Ų | 35 | 1% | 0.014 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -62.3 | -33.9 | 177.6 | -69.2 | 0 | 0 | 0 | 0 | 113 | N60 M64 V79 F80 L87 | N60-C83 HydrophobicContact CB-CB 4.35Å; M64-C83 HydrophobicContact CB-CB 4.27Å; V79-C83 PolarHBondContact O-N 3.32Å; V79-C83 PolarHBondContact O-SG 3.33Å; F80-C83 PolarHBondContact O-N 2.88Å; C83-L87 WeakPolarHBondContact O-CB 3.46Å; C83-L87 PolarHBondContact O-N 2.9Å |
| 84 | L | 97.4 | Very high | 94.4 | Very high | 59 Ų | 59 | 34.9 Ų | 34.9 | 31% | 0.309 | 17% | 0.167 | S | C | . | . | H | α-helix | trans | -65.1 | -47.2 | 174.2 | 175.9 | 64.6 | 0 | 0 | 0 | 111.2 | M64 F80 H81 L82 L87 L88 | M64-L84 HydrophobicContact SD-CB 4.34Å; M64-L84 HydrophobicContact SD-CD1 4.34Å; F80-L84 PolarHBondContact O-N 2.97Å; H81-L84 WeakPolarHBondContact O-CB 3.15Å; H81-L84 PolarHBondContact O-N 3.47Å; L82-L84 VanDerWaalsContact C-N 3.27Å; L82-L84 PolarHBondContact O-N 3.32Å; L84-L87 PolarHBondContact O-N 2.88Å; L84-L88 HydrophobicContact CD1-CD1 4.27Å; L84-L88 HydrophobicContact CD1-CG 4.37Å; L84-L88 HydrophobicContact CG-CD1 4.23Å; L84-L88 WeakPolarHBondContact O-CB 3.23Å; L84-L88 VanDerWaalsContact O-CG 3.26Å; L84-L88 WeakPolarHBondContact O-CG 3.41Å; L84-L88 PolarHBondContact O-N 3.37Å |
| 85 | V | 97.9 | Very high | 94.9 | Very high | 0 Ų | 0 | 29.4 Ų | 29.4 | 0% | 0 | 15% | 0.151 | C | C | . | . | H | α-helix | trans | -61.4 | -47.7 | 177.9 | 169.2 | 0 | 0 | 0 | 0 | 110.7 | H81 L82 L87 L88 A89 F125 L128 A129 W167 | H81-V85 WeakPolarHBondContact O-CG2 3.45Å; H81-V85 PolarHBondContact O-N 2.96Å; L82-V85 PolarHBondContact O-N 2.95Å; V85-L87 VanDerWaalsContact C-N 3.35Å; V85-L87 PolarHBondContact O-N 2.78Å; V85-L88 PolarHBondContact O-N 2.67Å; V85-A89 WeakPolarHBondContact O-CB 3.14Å; V85-A89 PolarHBondContact O-N 3.24Å; V85-F125 HydrophobicContact CG1-CD1 4.13Å; V85-L128 HydrophobicContact CB-CB 4.46Å; V85-L128 HydrophobicContact CG1-CB 3.48Å; V85-L128 VanDerWaalsContact CG1-CB 3.48Å; V85-L128 HydrophobicContact CG1-CD1 4.33Å; V85-L128 HydrophobicContact CG2-CB 4.08Å; V85-L128 HydrophobicContact CG2-CD1 4.42Å; V85-A129 HydrophobicContact CG1-CB 4.34Å; V85-W167 HydrophobicContact CG2-CZ2 4.45Å |
| 86 | D | 97.5 | Very high | 95.1 | Very high | 0 Ų | 0 | 24.7 Ų | 24.7 | 0% | 0 | 13% | 0.132 | C | C | . | . | H | α-helix | trans | -65.1 | -38.5 | -179.4 | -65.5 | -17.4 | 0 | 0 | 0 | 111.6 | N60 L82 A89 A90 F334 N337 | N60-D86 WeakPolarHBondContact ND2-CB 3.47Å; N60-D86 WeakPolarHBondContact OD1-CB 3.47Å; L82-D86 WeakPolarHBondContact O-CB 3.25Å; L82-D86 PolarHBondContact O-N 3.15Å; D86-A89 PolarHBondContact O-N 3.34Å; D86-A90 WeakPolarHBondContact O-CB 3.47Å; D86-A90 PolarHBondContact O-N 3.34Å; D86-F334 HydrophobicContact CB-CB 4.17Å; D86-F334 VanDerWaalsContact OD1-CD1 3.31Å; D86-F334 WeakPolarHBondContact OD1-CD1 3.22Å; D86-N337 PolarHBondContact OD1-ND2 2.88Å; D86-N337 WeakPolarHBondContact OD2-CB 3.32Å; D86-N337 PolarHBondContact OD2-ND2 3.35Å |
| 87 | L | 97.8 | Very high | 95.2 | Very high | 22 Ų | 22 | 23.9 Ų | 23.9 | 12% | 0.115 | 13% | 0.129 | C | C | . | . | H | α-helix | trans | -64.8 | -43.4 | 174.1 | 179.4 | 63.6 | 0 | 0 | 0 | 111.5 | V57 N60 M64 C83 L84 V85 A89 A90 L91 | V57-L87 HydrophobicContact CB-CD1 4.33Å; V57-L87 HydrophobicContact CG1-CD1 3.98Å; V57-L87 HydrophobicContact CG2-CD1 4.48Å; N60-L87 HydrophobicContact CB-CB 4.11Å; M64-L87 HydrophobicContact CE-CD2 3.52Å; C83-L87 WeakPolarHBondContact O-CB 3.46Å; C83-L87 PolarHBondContact O-N 2.9Å; L84-L87 PolarHBondContact O-N 2.88Å; V85-L87 VanDerWaalsContact C-N 3.35Å; V85-L87 PolarHBondContact O-N 2.78Å; L87-A89 VanDerWaalsContact C-N 3.31Å; L87-A89 PolarHBondContact O-N 3.17Å; L87-A90 PolarHBondContact O-N 2.99Å; L87-L91 HydrophobicContact CD1-CD1 4.11Å; L87-L91 HydrophobicContact CD1-CG 4.2Å; L87-L91 HydrophobicContact CG-CD1 3.99Å; L87-L91 HydrophobicContact CG-CG 4.45Å; L87-L91 WeakPolarHBondContact O-CB 3.01Å; L87-L91 VanDerWaalsContact O-CG 3.25Å; L87-L91 WeakPolarHBondContact O-CG 3.44Å; L87-L91 PolarHBondContact O-N 3.06Å |
| 88 | L | 97.8 | Very high | 95 | Very high | 61 Ų | 61 | 23.1 Ų | 23.1 | 32% | 0.319 | 12% | 0.122 | S | C | . | . | H | α-helix | trans | -63.4 | -39.2 | 176 | -71.2 | 172.1 | 0 | 0 | 0 | 111.4 | L84 V85 L91 T92 F125 | L84-L88 HydrophobicContact CD1-CD1 4.27Å; L84-L88 HydrophobicContact CD1-CG 4.37Å; L84-L88 HydrophobicContact CG-CD1 4.23Å; L84-L88 WeakPolarHBondContact O-CB 3.23Å; L84-L88 VanDerWaalsContact O-CG 3.26Å; L84-L88 WeakPolarHBondContact O-CG 3.41Å; L84-L88 PolarHBondContact O-N 3.37Å; V85-L88 PolarHBondContact O-N 2.67Å; L88-L91 PolarHBondContact O-N 3.49Å; L88-T92 WeakPolarHBondContact O-CB 3.42Å; L88-T92 PolarHBondContact O-N 3.45Å; L88-T92 VanDerWaalsContact O-N 3.09Å; L88-T92 PolarHBondContact O-OG1 3.03Å; L88-F125 HydrophobicContact CB-CE1 3.52Å; L88-F125 HydrophobicContact CB-CZ 3.72Å; L88-F125 HydrophobicContact CD1-CE1 4.4Å |
| 89 | A | 97.6 | Very high | 94.5 | Very high | 0 Ų | 0 | 26.2 Ų | 26.2 | 0% | 0 | 14% | 0.139 | C | C | . | . | H | α-helix | trans | -64.3 | -44.2 | 174.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | V85 D86 L87 L91 T92 L93 M94 F125 F334 | V85-A89 WeakPolarHBondContact O-CB 3.14Å; V85-A89 PolarHBondContact O-N 3.24Å; D86-A89 PolarHBondContact O-N 3.34Å; L87-A89 VanDerWaalsContact C-N 3.31Å; L87-A89 PolarHBondContact O-N 3.17Å; A89-L91 VanDerWaalsContact C-N 3.34Å; A89-L91 PolarHBondContact O-N 3.11Å; A89-T92 PolarHBondContact O-N 3.33Å; A89-L93 HydrophobicContact CB-CB 4.43Å; A89-L93 WeakPolarHBondContact O-CA 3.3Å; A89-L93 WeakPolarHBondContact O-CB 3.45Å; A89-L93 PolarHBondContact O-N 3.33Å; A89-M94 PolarHBondContact O-N 2.96Å; A89-F125 HydrophobicContact CB-CB 3.93Å; A89-F125 HydrophobicContact CB-CD1 4.09Å; A89-F125 HydrophobicContact CB-CD2 4.3Å; A89-F125 HydrophobicContact CB-CG 3.87Å; A89-F334 HydrophobicContact CB-CD2 4.07Å; A89-F334 HydrophobicContact CB-CE1 4.46Å; A89-F334 HydrophobicContact CB-CE2 3.98Å; A89-F334 HydrophobicContact CB-CG 4.35Å; A89-F334 HydrophobicContact CB-CZ 4.19Å |
| 90 | A | 97.1 | Very high | 93.8 | Very high | 0 Ų | 0 | 28 Ų | 28 | 0% | 0 | 15% | 0.151 | C | C | . | . | H | α-helix | trans | -64.2 | -37.1 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | D53 A56 V57 D86 L87 T92 M94 P95 | D53-A90 WeakPolarHBondContact OD1-CA 3.23Å; A56-A90 HydrophobicContact CB-CB 3.81Å; V57-A90 HydrophobicContact CG2-CB 3.71Å; D86-A90 WeakPolarHBondContact O-CB 3.47Å; D86-A90 PolarHBondContact O-N 3.34Å; L87-A90 PolarHBondContact O-N 2.99Å; A90-T92 VanDerWaalsContact C-N 3.34Å; A90-T92 PolarHBondContact O-N 2.88Å; A90-M94 HydrophobicContact CB-SD 4.17Å; A90-P95 WeakPolarHBondContact O-CD 3.46Å; A90-P95 WeakPolarHBondContact O-CG 3.42Å |
| 91 | L | 96.7 | Very high | 92.7 | Very high | 99 Ų | 99 | 27.7 Ų | 27.7 | 52% | 0.518 | 16% | 0.157 | S | C | . | . | H | α-helix | trans | -76 | -19.8 | 178.9 | -69.1 | 173.8 | 0 | 0 | 0 | 114.3 | V57 L87 L88 A89 | V57-L91 HydrophobicContact CG1-CD2 4.41Å; V57-L91 HydrophobicContact CG2-CD2 4.09Å; L87-L91 HydrophobicContact CD1-CD1 4.11Å; L87-L91 HydrophobicContact CD1-CG 4.2Å; L87-L91 HydrophobicContact CG-CD1 3.99Å; L87-L91 HydrophobicContact CG-CG 4.45Å; L87-L91 WeakPolarHBondContact O-CB 3.01Å; L87-L91 VanDerWaalsContact O-CG 3.25Å; L87-L91 WeakPolarHBondContact O-CG 3.44Å; L87-L91 PolarHBondContact O-N 3.06Å; L88-L91 PolarHBondContact O-N 3.49Å; A89-L91 VanDerWaalsContact C-N 3.34Å; A89-L91 PolarHBondContact O-N 3.11Å |
| 92 | T | 95.4 | Very high | 91.6 | Very high | 55 Ų | 55 | 28.9 Ų | 28.9 | 34% | 0.337 | 17% | 0.167 | S | C | . | . | H | α-helix | trans | -127.5 | -59.7 | -170.9 | 62 | 0 | 0 | 0 | 0 | 113.1 | L88 A89 A90 L96 F125 | L88-T92 WeakPolarHBondContact O-CB 3.42Å; L88-T92 PolarHBondContact O-N 3.45Å; L88-T92 VanDerWaalsContact O-N 3.09Å; L88-T92 PolarHBondContact O-OG1 3.03Å; A89-T92 PolarHBondContact O-N 3.33Å; A90-T92 VanDerWaalsContact C-N 3.34Å; A90-T92 PolarHBondContact O-N 2.88Å; T92-L96 WeakPolarHBondContact O-CB 3.48Å; T92-L96 PolarHBondContact O-N 2.95Å; T92-F125 VanDerWaalsContact OG1-CE2 3.31Å; T92-F125 WeakPolarHBondContact OG1-CE2 3.31Å |
| 93 | L | 94.8 | Very high | 90 | Very high | 0 Ų | 0 | 32.4 Ų | 32.4 | 0% | 0 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -68.5 | -48.5 | -174.4 | 174.6 | 61.1 | 0 | 0 | 0 | 112.6 | A89 L96 A97 Y118 L121 F125 Y331 F334 | A89-L93 HydrophobicContact CB-CB 4.43Å; A89-L93 WeakPolarHBondContact O-CA 3.3Å; A89-L93 WeakPolarHBondContact O-CB 3.45Å; A89-L93 PolarHBondContact O-N 3.33Å; L93-L96 PolarHBondContact O-N 3.34Å; L93-A97 WeakPolarHBondContact O-CB 3.27Å; L93-A97 PolarHBondContact O-N 3.39Å; L93-Y118 HydrophobicContact CD1-CD2 3.84Å; L93-Y118 HydrophobicContact CD1-CE2 3.71Å; L93-L121 HydrophobicContact CD1-CB 4.19Å; L93-F125 HydrophobicContact CB-CD2 4.07Å; L93-F125 HydrophobicContact CD2-CB 3.98Å; L93-F125 HydrophobicContact CD2-CD2 4.39Å; L93-Y331 HydrophobicContact CD2-CE1 3.8Å; L93-Y331 HydrophobicContact CG-CE1 4.36Å; L93-Y331 HydrophobicContact CG-CE2 4.31Å; L93-F334 HydrophobicContact CD2-CE2 4.13Å; L93-F334 HydrophobicContact CD2-CZ 4.43Å |
| 94 | M | 94.4 | Very high | 88.2 | Confident | 1 Ų | 1 | 37 Ų | 37 | 1% | 0.005 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -64.6 | -45.8 | -176.6 | -67.3 | 177.8 | 68.3 | 0 | 0 | 112.1 | L52 D53 A56 A89 A90 L96 A97 M98 W328 Y331 F334 | L52-M94 HydrophobicContact CB-CE 4.41Å; D53-M94 HydrophobicContact CB-CE 3.97Å; D53-M94 WeakPolarHBondContact OD1-CB 3.45Å; A56-M94 HydrophobicContact CB-SD 4.37Å; A89-M94 PolarHBondContact O-N 2.96Å; A90-M94 HydrophobicContact CB-SD 4.17Å; M94-L96 VanDerWaalsContact C-N 3.33Å; M94-L96 PolarHBondContact O-N 3.33Å; M94-A97 WeakPolarHBondContact O-CB 3.36Å; M94-A97 PolarHBondContact O-N 3.43Å; M94-M98 WeakPolarHBondContact O-CG 3.43Å; M94-M98 PolarHBondContact O-N 2.94Å; M94-W328 HydrophobicContact CB-CH2 4.34Å; M94-W328 HydrophobicContact CE-CE3 4.28Å; M94-W328 HydrophobicContact CE-CH2 4.26Å; M94-W328 HydrophobicContact CE-CZ3 3.54Å; M94-Y331 HydrophobicContact CG-CD2 4.11Å; M94-Y331 HydrophobicContact CG-CG 4.43Å; M94-F334 HydrophobicContact SD-CD2 4.16Å |
| 95 | P | 93 | Very high | 86.7 | Confident | 40 Ų | 40 | 35.4 Ų | 35.4 | 26% | 0.26 | 21% | 0.21 | S | C | . | . | H | α-helix | trans | -60.3 | -40.8 | 172.4 | -26.8 | 34 | 0 | 0 | 0 | 112.7 | A90 A97 M98 L99 | A90-P95 WeakPolarHBondContact O-CD 3.46Å; A90-P95 WeakPolarHBondContact O-CG 3.42Å; P95-A97 VanDerWaalsContact C-N 3.3Å; P95-A97 PolarHBondContact O-N 2.88Å; P95-M98 PolarHBondContact O-N 3.29Å; P95-L99 VanDerWaalsContact O-CG 3.28Å; P95-L99 WeakPolarHBondContact O-CG 3.39Å; P95-L99 PolarHBondContact O-N 3.41Å |
| 96 | L | 89.6 | Confident | 84.9 | Confident | 25 Ų | 25 | 41.2 Ų | 41.2 | 13% | 0.131 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -66 | -34.8 | 177.8 | -169.1 | 61.6 | 0 | 0 | 0 | 111.8 | T92 L93 M94 L99 S100 F105 A114 L117 Y118 L121 | T92-L96 WeakPolarHBondContact O-CB 3.48Å; T92-L96 PolarHBondContact O-N 2.95Å; L93-L96 PolarHBondContact O-N 3.34Å; M94-L96 VanDerWaalsContact C-N 3.33Å; M94-L96 PolarHBondContact O-N 3.33Å; L96-L99 PolarHBondContact O-N 3.33Å; L96-S100 PolarHBondContact O-N 2.97Å; L96-F105 HydrophobicContact CD1-CE2 4.25Å; L96-F105 HydrophobicContact CD1-CZ 3.72Å; L96-F105 HydrophobicContact CG-CZ 4.4Å; L96-A114 HydrophobicContact CD1-CB 4.47Å; L96-L117 HydrophobicContact CD2-CB 4.46Å; L96-L117 HydrophobicContact CD2-CD2 4.35Å; L96-L117 HydrophobicContact CD2-CG 4.14Å; L96-Y118 HydrophobicContact CB-CD2 4.42Å; L96-Y118 VanDerWaalsContact CD2-CA 3.48Å; L96-Y118 HydrophobicContact CD2-CD2 4.32Å; L96-Y118 HydrophobicContact CG-CD2 4.13Å; L96-Y118 HydrophobicContact CG-CG 4.46Å; L96-L121 HydrophobicContact CD2-CD1 4.15Å |
| 97 | A | 88.9 | Confident | 83.2 | Confident | 1 Ų | 1 | 47.1 Ų | 47.1 | 1% | 0.008 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -65.3 | -43.3 | 172.6 | 0 | 0 | 0 | 0 | 0 | 112 | L93 M94 P95 L99 S100 Y118 W328 Y331 | L93-A97 WeakPolarHBondContact O-CB 3.27Å; L93-A97 PolarHBondContact O-N 3.39Å; M94-A97 WeakPolarHBondContact O-CB 3.36Å; M94-A97 PolarHBondContact O-N 3.43Å; P95-A97 VanDerWaalsContact C-N 3.3Å; P95-A97 PolarHBondContact O-N 2.88Å; A97-L99 VanDerWaalsContact C-N 3.3Å; A97-L99 PolarHBondContact O-N 3.22Å; A97-S100 WeakPolarHBondContact O-CB 3.35Å; A97-S100 PolarHBondContact O-N 2.93Å; A97-S100 PolarHBondContact O-OG 3.28Å; A97-Y118 HydrophobicContact CB-CE2 3.65Å; A97-W328 HydrophobicContact CB-CZ2 4.17Å; A97-Y331 HydrophobicContact CB-CE2 3.74Å |
| 98 | M | 88.1 | Confident | 81.5 | Confident | 31 Ų | 31 | 50.1 Ų | 50.1 | 15% | 0.153 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -62.4 | -38.4 | 175 | -66 | 176.4 | 67.9 | 0 | 0 | 112 | L46 M49 L50 M94 P95 S100 S101 W328 | L46-M98 HydrophobicContact CD2-CE 4.2Å; M49-M98 HydrophobicContact CB-CE 4.16Å; M49-M98 HydrophobicContact CB-CG 4.18Å; M49-M98 HydrophobicContact CB-SD 4.23Å; L50-M98 HydrophobicContact CB-CE 3.98Å; M94-M98 WeakPolarHBondContact O-CG 3.43Å; M94-M98 PolarHBondContact O-N 2.94Å; P95-M98 PolarHBondContact O-N 3.29Å; M98-S100 VanDerWaalsContact C-N 3.31Å; M98-S101 PolarHBondContact O-OG 2.88Å; M98-W328 HydrophobicContact CB-CZ2 4.5Å; M98-W328 HydrophobicContact CG-CH2 3.46Å; M98-W328 VanDerWaalsContact CG-CH2 3.46Å; M98-W328 HydrophobicContact CG-CZ2 3.4Å; M98-W328 HydrophobicContact SD-CH2 4.02Å |
| 99 | L | 84.4 | Confident | 79.8 | Confident | 76 Ų | 76 | 54.6 Ų | 54.6 | 40% | 0.398 | 32% | 0.321 | S | S | . | . | H | α-helix | trans | -73 | -25.4 | 178.4 | -68.8 | 165.8 | 0 | 0 | 0 | 112.1 | P95 L96 A97 S101 S102 L104 F105 | P95-L99 VanDerWaalsContact O-CG 3.28Å; P95-L99 WeakPolarHBondContact O-CG 3.39Å; P95-L99 PolarHBondContact O-N 3.41Å; L96-L99 PolarHBondContact O-N 3.33Å; A97-L99 VanDerWaalsContact C-N 3.3Å; A97-L99 PolarHBondContact O-N 3.22Å; L99-S101 PolarHBondContact O-N 3.45Å; L99-S102 WeakPolarHBondContact O-CB 3.34Å; L99-S102 PolarHBondContact O-N 3.4Å; L99-S102 PolarHBondContact O-OG 2.95Å; L99-L104 HydrophobicContact CD2-CD1 4.06Å; L99-F105 VanDerWaalsContact C-CE2 3.44Å; L99-F105 HydrophobicContact CB-CD2 4.28Å; L99-F105 HydrophobicContact CB-CE2 3.66Å; L99-F105 WeakPolarHBondContact O-CD2 3.2Å; L99-F105 WeakPolarHBondContact O-CE2 3.35Å |
| 100 | S | 78.3 | Confident | 78.4 | Confident | 37 Ų | 37 | 60.9 Ų | 60.9 | 26% | 0.259 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -62.6 | -24.2 | -178.1 | 76.2 | 0 | 0 | 0 | 0 | 114.2 | L96 A97 M98 | L96-S100 PolarHBondContact O-N 2.97Å; A97-S100 WeakPolarHBondContact O-CB 3.35Å; A97-S100 PolarHBondContact O-N 2.93Å; A97-S100 PolarHBondContact O-OG 3.28Å; M98-S100 VanDerWaalsContact C-N 3.31Å |
| 101 | S | 71.6 | Confident | 77.3 | Confident | 62 Ų | 62 | 61.2 Ų | 61.2 | 43% | 0.434 | 35% | 0.351 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -89.4 | -6 | 173.8 | 60.3 | 0 | 0 | 0 | 0 | 113.4 | M98 L99 | M98-S101 PolarHBondContact O-OG 2.88Å; L99-S101 PolarHBondContact O-N 3.45Å |
| 102 | S | 71.8 | Confident | 76.4 | Confident | 36 Ų | 36 | 59.1 Ų | 59.1 | 25% | 0.252 | 34% | 0.339 | S | S | . | . | S | Bend | trans | -90.7 | 153.6 | -177.1 | 76.7 | 0 | 0 | 0 | 0 | 112.5 | L99 L104 F105 | L99-S102 WeakPolarHBondContact O-CB 3.34Å; L99-S102 PolarHBondContact O-N 3.4Å; L99-S102 PolarHBondContact O-OG 2.95Å; S102-L104 PolarHBondContact O-N 3.16Å; S102-F105 PolarHBondContact O-N 3.48Å; S102-F105 VanDerWaalsContact O-N 3.1Å |
| 103 | A | 62.4 | Low | 75.7 | Confident | 73 Ų | 73 | 61.2 Ų | 61.2 | 60% | 0.603 | 35% | 0.351 | S | S | * | . | G | 310 helix | trans | -59.3 | -9 | 177.2 | 0 | 0 | 0 | 0 | 0 | 114.7 | F105 D106 | A103-F105 PolarHBondContact O-N 3.47Å; A103-D106 WeakPolarHBondContact CA-OD2 3.27Å; A103-D106 WeakPolarHBondContact O-CB 3.35Å; A103-D106 PolarHBondContact O-N 3.06Å |
| 104 | L | 59.9 | Low | 75.1 | Confident | 99 Ų | 99 | 61.6 Ų | 61.6 | 52% | 0.518 | 35% | 0.354 | S | S | . | . | G | 310 helix | trans | -68.5 | -24.6 | 174.7 | -66.3 | 174.4 | 0 | 0 | 0 | 112.6 | L99 S102 D106 | L99-L104 HydrophobicContact CD2-CD1 4.06Å; S102-L104 PolarHBondContact O-N 3.16Å; L104-D106 VanDerWaalsContact C-N 3.28Å |
| 105 | F | 64.9 | Low | 74.5 | Confident | 25 Ų | 25 | 61.8 Ų | 61.8 | 11% | 0.11 | 36% | 0.356 | C | S | . | . | G | 310 helix | trans | -78.7 | -8.6 | 173.8 | -89.6 | -111.1 | 0 | 0 | 0 | 113.1 | L96 L99 S102 A103 H107 G111 A114 | L96-F105 HydrophobicContact CD1-CE2 4.25Å; L96-F105 HydrophobicContact CD1-CZ 3.72Å; L96-F105 HydrophobicContact CG-CZ 4.4Å; L99-F105 VanDerWaalsContact C-CE2 3.44Å; L99-F105 HydrophobicContact CB-CD2 4.28Å; L99-F105 HydrophobicContact CB-CE2 3.66Å; L99-F105 WeakPolarHBondContact O-CD2 3.2Å; L99-F105 WeakPolarHBondContact O-CE2 3.35Å; S102-F105 PolarHBondContact O-N 3.48Å; S102-F105 VanDerWaalsContact O-N 3.1Å; A103-F105 PolarHBondContact O-N 3.47Å; F105-H107 PolarHBondContact O-N 2.89Å; F105-G111 WeakPolarHBondContact O-CA 3.49Å; F105-A114 HydrophobicContact CD1-CB 4.15Å; F105-A114 HydrophobicContact CE1-CB 3.44Å; F105-A114 VanDerWaalsContact CE1-CB 3.44Å; F105-A114 HydrophobicContact CE2-CB 4.21Å; F105-A114 HydrophobicContact CZ-CB 3.5Å; F105-A114 VanDerWaalsContact CZ-CB 3.5Å |
| 106 | D | 60.1 | Low | 74 | Confident | 123 Ų | 123 | 63.5 Ų | 63.5 | 66% | 0.658 | 36% | 0.357 | S | S | * | . | G | 310 helix | trans | -75.9 | -8.3 | 178.8 | -69.8 | -32.4 | 0 | 0 | 0 | 113.6 | A103 L104 A108 | A103-D106 WeakPolarHBondContact CA-OD2 3.27Å; A103-D106 WeakPolarHBondContact O-CB 3.35Å; A103-D106 PolarHBondContact O-N 3.06Å; L104-D106 VanDerWaalsContact C-N 3.28Å; D106-A108 PolarHBondContact O-N 3.1Å |
| 107 | H | 62.2 | Low | 73.9 | Confident | 123 Ų | 123 | 66.5 Ų | 66.5 | 57% | 0.569 | 37% | 0.372 | S | S | * | . | S | Bend | trans | -74.7 | 112.7 | 172.7 | -71.4 | -49.6 | 0 | 0 | 0 | 111 | F105 L109 F110 G111 | F105-H107 PolarHBondContact O-N 2.89Å; H107-L109 VanDerWaalsContact C-N 3.32Å; H107-L109 PolarHBondContact O-N 3.42Å; H107-F110 HydrophobicContact CB-CB 4.18Å; H107-F110 PolarHBondContact O-N 3.27Å; H107-F110 VanDerWaalsContact O-N 3.13Å; H107-G111 PolarHBondContact O-N 3.35Å |
| 108 | A | 62 | Low | 73.9 | Confident | 85 Ų | 85 | 67.3 Ų | 67.3 | 70% | 0.702 | 38% | 0.375 | S | S | * | . | H | α-helix | trans | -49 | -38.8 | -168.9 | 0 | 0 | 0 | 0 | 0 | 116.6 | D106 | D106-A108 PolarHBondContact O-N 3.1Å |
| 109 | L | 62.3 | Low | 73.9 | Confident | 156 Ų | 156 | 66.2 Ų | 66.2 | 82% | 0.817 | 37% | 0.37 | S | S | * | . | H | α-helix | trans | -87.5 | -39 | 179.6 | -66.7 | 177.3 | 0 | 0 | 0 | 113.4 | H107 | H107-L109 VanDerWaalsContact C-N 3.32Å; H107-L109 PolarHBondContact O-N 3.42Å |
| 110 | F | 69.4 | Low | 74.3 | Confident | 132 Ų | 132 | 65.5 Ų | 65.5 | 58% | 0.579 | 36% | 0.364 | S | S | * | . | H | α-helix | trans | -74.4 | -40.1 | -179.1 | -179.5 | -102.1 | 0 | 0 | 0 | 111.3 | H107 E112 V113 A114 | H107-F110 HydrophobicContact CB-CB 4.18Å; H107-F110 PolarHBondContact O-N 3.27Å; H107-F110 VanDerWaalsContact O-N 3.13Å; F110-E112 PolarHBondContact O-N 3.48Å; F110-V113 PolarHBondContact O-N 3.32Å; F110-A114 WeakPolarHBondContact O-CB 3.13Å; F110-A114 PolarHBondContact O-N 3.47Å |
| 111 | G | 73.7 | Confident | 75.1 | Confident | 6 Ų | 6 | 65 Ų | 65 | 6% | 0.062 | 36% | 0.359 | C | S | . | . | H | α-helix | trans | -58 | -46.8 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | F105 H107 A114 C115 | F105-G111 WeakPolarHBondContact O-CA 3.49Å; H107-G111 PolarHBondContact O-N 3.35Å; G111-A114 PolarHBondContact O-N 3.16Å; G111-C115 WeakPolarHBondContact O-CB 3.24Å; G111-C115 PolarHBondContact O-N 3.38Å |
| 112 | E | 77.4 | Confident | 76.1 | Confident | 55 Ų | 55 | 62.3 Ų | 62.3 | 26% | 0.257 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -66.2 | -43.9 | -178 | -177.7 | 56.4 | -156.5 | 0 | 0 | 112.6 | F110 C115 R116 | F110-E112 PolarHBondContact O-N 3.48Å; E112-C115 WeakPolarHBondContact O-CB 3.47Å; E112-C115 PolarHBondContact O-N 3.39Å; E112-R116 WeakPolarHBondContact O-CG 3.15Å; E112-R116 PolarHBondContact O-N 3.01Å; E112-R116 IonicContact OE1-CZ 3.96Å; E112-R116 IonicContact OE1-NE 2.7Å; E112-R116 PolarHBondContact OE1-NE 2.87Å; E112-R116 IonicContact OE1-NH2 2.77Å; E112-R116 PolarHBondContact OE1-NH2 3.11Å |
| 113 | V | 80.6 | Confident | 77.1 | Confident | 100 Ų | 100 | 60.6 Ų | 60.6 | 61% | 0.606 | 33% | 0.328 | S | S | * | . | H | α-helix | trans | -65.5 | -44.3 | 176.9 | 177.2 | 0 | 0 | 0 | 0 | 110.8 | F110 C115 R116 L117 | F110-V113 PolarHBondContact O-N 3.32Å; V113-C115 VanDerWaalsContact C-N 3.29Å; V113-C115 PolarHBondContact O-N 2.91Å; V113-R116 PolarHBondContact O-N 3.23Å; V113-L117 WeakPolarHBondContact O-CB 3.4Å; V113-L117 PolarHBondContact O-N 3.28Å |
| 114 | A | 81.5 | Confident | 78.8 | Confident | 7 Ų | 7 | 57.4 Ų | 57.4 | 6% | 0.058 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -63.7 | -35.9 | 177.3 | 0 | 0 | 0 | 0 | 0 | 111.7 | L96 F105 F110 G111 Y118 | L96-A114 HydrophobicContact CD1-CB 4.47Å; F105-A114 HydrophobicContact CD1-CB 4.15Å; F105-A114 HydrophobicContact CE1-CB 3.44Å; F105-A114 VanDerWaalsContact CE1-CB 3.44Å; F105-A114 HydrophobicContact CE2-CB 4.21Å; F105-A114 HydrophobicContact CZ-CB 3.5Å; F105-A114 VanDerWaalsContact CZ-CB 3.5Å; F110-A114 WeakPolarHBondContact O-CB 3.13Å; F110-A114 PolarHBondContact O-N 3.47Å; G111-A114 PolarHBondContact O-N 3.16Å; A114-Y118 WeakPolarHBondContact O-CB 3.18Å; A114-Y118 PolarHBondContact O-N 2.97Å |
| 115 | C | 81.6 | Confident | 80.6 | Confident | 5 Ų | 5 | 53.5 Ų | 53.5 | 3% | 0.034 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -63.5 | -49.5 | 174.7 | -156.7 | 0 | 0 | 0 | 0 | 112.3 | G111 E112 V113 L117 Y118 L119 C195 | G111-C115 WeakPolarHBondContact O-CB 3.24Å; G111-C115 PolarHBondContact O-N 3.38Å; E112-C115 WeakPolarHBondContact O-CB 3.47Å; E112-C115 PolarHBondContact O-N 3.39Å; V113-C115 VanDerWaalsContact C-N 3.29Å; V113-C115 PolarHBondContact O-N 2.91Å; C115-L117 VanDerWaalsContact C-N 3.32Å; C115-L117 PolarHBondContact O-N 3.42Å; C115-Y118 WeakPolarHBondContact O-CB 3.13Å; C115-Y118 PolarHBondContact O-N 3.47Å; C115-L119 WeakPolarHBondContact O-CG 3.31Å; C115-L119 PolarHBondContact O-N 2.82Å; C115-C195 WeakPolarHBondContact CA-SG 3.17Å; C115-C195 HydrophobicContact CB-CB 4.19Å; C115-C195 WeakPolarHBondContact CB-SG 3.45Å; C115-C195 WeakPolarHBondContact SG-CA 3.46Å; C115-C195 WeakPolarHBondContact SG-CB 3.41Å; C115-C195 CovalentContact SG-SG 2.03Å; C115-C195 PolarHBondContact SG-SG 3.38Å |
| 116 | R | 84.4 | Confident | 82 | Confident | 77 Ų | 77 | 52.4 Ų | 52.4 | 29% | 0.291 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -60.7 | -44.6 | 177.5 | -71.1 | 176.5 | -170.1 | -164.5 | -0.5 | 110.9 | E112 V113 F120 E185 | E112-R116 WeakPolarHBondContact O-CG 3.15Å; E112-R116 PolarHBondContact O-N 3.01Å; E112-R116 IonicContact OE1-CZ 3.96Å; E112-R116 IonicContact OE1-NE 2.7Å; E112-R116 PolarHBondContact OE1-NE 2.87Å; E112-R116 IonicContact OE1-NH2 2.77Å; E112-R116 PolarHBondContact OE1-NH2 3.11Å; V113-R116 PolarHBondContact O-N 3.23Å; R116-F120 WeakPolarHBondContact O-CB 3.33Å; R116-F120 PolarHBondContact O-N 3.24Å; R116-E185 IonicContact CZ-OE2 2.82Å; R116-E185 IonicContact NH2-OE1 3.2Å; R116-E185 IonicContact NH2-OE2 3.77Å; R116-E185 PolarHBondContact NH2-OE2 2.92Å |
| 117 | L | 87.5 | Confident | 83.8 | Confident | 87 Ų | 87 | 46.5 Ų | 46.5 | 46% | 0.455 | 24% | 0.243 | S | C | . | . | H | α-helix | trans | -62.9 | -44.5 | 176 | -176.8 | 62.3 | 0 | 0 | 0 | 111.1 | L96 V113 C115 F120 L121 | L96-L117 HydrophobicContact CD2-CB 4.46Å; L96-L117 HydrophobicContact CD2-CD2 4.35Å; L96-L117 HydrophobicContact CD2-CG 4.14Å; V113-L117 WeakPolarHBondContact O-CB 3.4Å; V113-L117 PolarHBondContact O-N 3.28Å; C115-L117 VanDerWaalsContact C-N 3.32Å; C115-L117 PolarHBondContact O-N 3.42Å; L117-F120 PolarHBondContact O-N 3.29Å; L117-L121 HydrophobicContact CD1-CD1 3.91Å; L117-L121 HydrophobicContact CD1-CD2 4.33Å; L117-L121 HydrophobicContact CD1-CG 3.9Å; L117-L121 HydrophobicContact CD2-CD1 4.47Å; L117-L121 HydrophobicContact CG-CD1 3.83Å; L117-L121 HydrophobicContact CG-CG 4.19Å; L117-L121 WeakPolarHBondContact O-CB 3.47Å; L117-L121 VanDerWaalsContact O-CG 3.24Å; L117-L121 WeakPolarHBondContact O-CG 3.33Å; L117-L121 PolarHBondContact O-N 3.35Å |
| 118 | Y | 88.8 | Confident | 85.5 | Confident | 18 Ų | 18 | 40.7 Ų | 40.7 | 7% | 0.071 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -58.1 | -51.1 | 178.1 | 172.4 | -115.8 | 0 | 0 | 0 | 112.1 | L93 L96 A97 A114 C115 F120 L121 S122 C195 Y331 | L93-Y118 HydrophobicContact CD1-CD2 3.84Å; L93-Y118 HydrophobicContact CD1-CE2 3.71Å; L96-Y118 HydrophobicContact CB-CD2 4.42Å; L96-Y118 VanDerWaalsContact CD2-CA 3.48Å; L96-Y118 HydrophobicContact CD2-CD2 4.32Å; L96-Y118 HydrophobicContact CG-CD2 4.13Å; L96-Y118 HydrophobicContact CG-CG 4.46Å; A97-Y118 HydrophobicContact CB-CE2 3.65Å; A114-Y118 WeakPolarHBondContact O-CB 3.18Å; A114-Y118 PolarHBondContact O-N 2.97Å; C115-Y118 WeakPolarHBondContact O-CB 3.13Å; C115-Y118 PolarHBondContact O-N 3.47Å; Y118-F120 PolarHBondContact O-N 2.73Å; Y118-L121 PolarHBondContact O-N 3.09Å; Y118-S122 WeakPolarHBondContact O-CB 3.5Å; Y118-S122 PolarHBondContact O-N 3.17Å; Y118-C195 HydrophobicContact CD1-CB 4.33Å; Y118-Y331 PolarHBondContact OH-OH 3.46Å |
| 119 | L | 87.9 | Confident | 87.1 | Confident | 8 Ų | 8 | 36.7 Ų | 36.7 | 4% | 0.042 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -63.7 | -41.6 | 179.7 | -66.1 | 174.1 | 0 | 0 | 0 | 111.8 | C115 S122 V123 L197 | C115-L119 WeakPolarHBondContact O-CG 3.31Å; C115-L119 PolarHBondContact O-N 2.82Å; L119-S122 PolarHBondContact O-N 3.04Å; L119-V123 WeakPolarHBondContact O-CG2 3.47Å; L119-V123 PolarHBondContact O-N 2.93Å; L119-L197 HydrophobicContact CD2-CD1 4.28Å |
| 120 | F | 92.3 | Very high | 88.7 | Confident | 61 Ų | 61 | 29.2 Ų | 29.2 | 27% | 0.268 | 14% | 0.144 | S | C | . | . | H | α-helix | trans | -60.7 | -51.7 | 175.7 | 179 | -94.8 | 0 | 0 | 0 | 111.6 | R116 L117 Y118 S122 C124 L171 A174 V178 | R116-F120 WeakPolarHBondContact O-CB 3.33Å; R116-F120 PolarHBondContact O-N 3.24Å; L117-F120 PolarHBondContact O-N 3.29Å; Y118-F120 PolarHBondContact O-N 2.73Å; F120-S122 VanDerWaalsContact C-N 3.32Å; F120-S122 PolarHBondContact O-N 3Å; F120-C124 WeakPolarHBondContact O-CB 3.34Å; F120-C124 PolarHBondContact O-N 3.43Å; F120-L171 HydrophobicContact CZ-CD2 3.89Å; F120-A174 HydrophobicContact CD2-CB 3.78Å; F120-A174 WeakPolarHBondContact CD2-O 3.46Å; F120-A174 HydrophobicContact CE2-CB 3.68Å; F120-A174 HydrophobicContact CG-CB 4.4Å; F120-A174 HydrophobicContact CZ-CB 4.22Å; F120-V178 HydrophobicContact CB-CG2 3.85Å; F120-V178 HydrophobicContact CD2-CG2 4Å; F120-V178 HydrophobicContact CG-CG2 4.4Å |
| 121 | L | 93.9 | Very high | 90 | Very high | 28 Ų | 28 | 24.3 Ų | 24.3 | 15% | 0.147 | 12% | 0.124 | C | C | . | . | H | α-helix | trans | -64.7 | -38.3 | -179.9 | -67.5 | -178.9 | 0 | 0 | 0 | 111.4 | L93 L96 L117 Y118 C124 F125 | L93-L121 HydrophobicContact CD1-CB 4.19Å; L96-L121 HydrophobicContact CD2-CD1 4.15Å; L117-L121 HydrophobicContact CD1-CD1 3.91Å; L117-L121 HydrophobicContact CD1-CD2 4.33Å; L117-L121 HydrophobicContact CD1-CG 3.9Å; L117-L121 HydrophobicContact CD2-CD1 4.47Å; L117-L121 HydrophobicContact CG-CD1 3.83Å; L117-L121 HydrophobicContact CG-CG 4.19Å; L117-L121 WeakPolarHBondContact O-CB 3.47Å; L117-L121 VanDerWaalsContact O-CG 3.24Å; L117-L121 WeakPolarHBondContact O-CG 3.33Å; L117-L121 PolarHBondContact O-N 3.35Å; Y118-L121 PolarHBondContact O-N 3.09Å; L121-C124 PolarHBondContact O-N 3.32Å; L121-F125 HydrophobicContact CB-CD2 4.09Å; L121-F125 HydrophobicContact CB-CE2 4.26Å; L121-F125 HydrophobicContact CD2-CD2 4.39Å; L121-F125 HydrophobicContact CD2-CE2 3.82Å; L121-F125 HydrophobicContact CG-CE2 4.46Å; L121-F125 WeakPolarHBondContact O-CB 3.32Å; L121-F125 VanDerWaalsContact O-CD2 3.29Å; L121-F125 WeakPolarHBondContact O-CD2 3.44Å; L121-F125 PolarHBondContact O-N 2.9Å |
| 122 | S | 93.2 | Very high | 91 | Very high | 4 Ų | 4 | 24.1 Ų | 24.1 | 3% | 0.028 | 12% | 0.121 | C | C | . | . | H | α-helix | trans | -59.7 | -55.9 | 177.8 | -173.7 | 0 | 0 | 0 | 0 | 110.6 | Y118 L119 F120 C124 V126 Y331 | Y118-S122 WeakPolarHBondContact O-CB 3.5Å; Y118-S122 PolarHBondContact O-N 3.17Å; L119-S122 PolarHBondContact O-N 3.04Å; F120-S122 VanDerWaalsContact C-N 3.32Å; F120-S122 PolarHBondContact O-N 3Å; S122-C124 VanDerWaalsContact C-N 3.32Å; S122-C124 PolarHBondContact O-N 3.17Å; S122-V126 WeakPolarHBondContact O-CB 3.41Å; S122-V126 WeakPolarHBondContact O-CG2 3.39Å; S122-V126 PolarHBondContact O-N 3.37Å; S122-Y331 PolarHBondContact OG-OH 2.97Å |
| 123 | V | 94 | Very high | 91.8 | Very high | 1 Ų | 1 | 21.7 Ų | 21.7 | 1% | 0.006 | 11% | 0.11 | C | C | . | . | H | α-helix | trans | -63.5 | -39.2 | 178.7 | 177 | 0 | 0 | 0 | 0 | 111.3 | L119 S127 M173 A174 P177 L197 F208 F212 | L119-V123 WeakPolarHBondContact O-CG2 3.47Å; L119-V123 PolarHBondContact O-N 2.93Å; V123-S127 WeakPolarHBondContact O-CB 3.49Å; V123-S127 PolarHBondContact O-N 3.45Å; V123-S127 PolarHBondContact O-OG 2.91Å; V123-M173 HydrophobicContact CG1-CB 4.43Å; V123-A174 HydrophobicContact CB-CB 4.28Å; V123-A174 HydrophobicContact CG1-CB 4.2Å; V123-P177 HydrophobicContact CG2-CG 4.19Å; V123-L197 HydrophobicContact CG2-CD1 4.03Å; V123-F208 HydrophobicContact CG1-CZ 4.26Å; V123-F208 HydrophobicContact CG2-CZ 4.42Å; V123-F212 HydrophobicContact CG1-CD2 4.45Å; V123-F212 HydrophobicContact CG1-CE2 3.84Å; V123-F212 HydrophobicContact CG1-CZ 4.32Å |
| 124 | C | 96.8 | Very high | 92.4 | Very high | 5 Ų | 5 | 17.5 Ų | 17.5 | 3% | 0.034 | 9% | 0.086 | C | C | . | . | H | α-helix | trans | -64.7 | -55.9 | -179.6 | -170.9 | 0 | 0 | 0 | 0 | 112.2 | F120 L121 S122 S127 L128 A174 | F120-C124 WeakPolarHBondContact O-CB 3.34Å; F120-C124 PolarHBondContact O-N 3.43Å; L121-C124 PolarHBondContact O-N 3.32Å; S122-C124 VanDerWaalsContact C-N 3.32Å; S122-C124 PolarHBondContact O-N 3.17Å; C124-S127 WeakPolarHBondContact O-CB 3.33Å; C124-S127 PolarHBondContact O-N 3Å; C124-L128 VanDerWaalsContact O-CG 3.3Å; C124-L128 WeakPolarHBondContact O-CG 3.4Å; C124-L128 PolarHBondContact O-N 3.43Å; C124-A174 HydrophobicContact CB-CB 3.67Å |
| 125 | F | 97.4 | Very high | 93 | Very high | 18 Ų | 18 | 17.8 Ų | 17.8 | 8% | 0.079 | 9% | 0.088 | C | C | . | . | H | α-helix | trans | -70.7 | -37.1 | -175.7 | -75.7 | -62.4 | 0 | 0 | 0 | 112.8 | V85 L88 A89 T92 L93 L121 S127 L128 A129 | V85-F125 HydrophobicContact CG1-CD1 4.13Å; L88-F125 HydrophobicContact CB-CE1 3.52Å; L88-F125 HydrophobicContact CB-CZ 3.72Å; L88-F125 HydrophobicContact CD1-CE1 4.4Å; A89-F125 HydrophobicContact CB-CB 3.93Å; A89-F125 HydrophobicContact CB-CD1 4.09Å; A89-F125 HydrophobicContact CB-CD2 4.3Å; A89-F125 HydrophobicContact CB-CG 3.87Å; T92-F125 VanDerWaalsContact OG1-CE2 3.31Å; T92-F125 WeakPolarHBondContact OG1-CE2 3.31Å; L93-F125 HydrophobicContact CB-CD2 4.07Å; L93-F125 HydrophobicContact CD2-CB 3.98Å; L93-F125 HydrophobicContact CD2-CD2 4.39Å; L121-F125 HydrophobicContact CB-CD2 4.09Å; L121-F125 HydrophobicContact CB-CE2 4.26Å; L121-F125 HydrophobicContact CD2-CD2 4.39Å; L121-F125 HydrophobicContact CD2-CE2 3.82Å; L121-F125 HydrophobicContact CG-CE2 4.46Å; L121-F125 WeakPolarHBondContact O-CB 3.32Å; L121-F125 VanDerWaalsContact O-CD2 3.29Å; L121-F125 WeakPolarHBondContact O-CD2 3.44Å; L121-F125 PolarHBondContact O-N 2.9Å; F125-S127 VanDerWaalsContact C-N 3.3Å; F125-S127 PolarHBondContact O-N 2.91Å; F125-L128 HydrophobicContact CD1-CD1 4Å; F125-L128 HydrophobicContact CE1-CD1 4.34Å; F125-L128 PolarHBondContact O-N 2.8Å; F125-A129 WeakPolarHBondContact O-CB 3.49Å; F125-A129 PolarHBondContact O-N 2.87Å |
| 126 | V | 95.6 | Very high | 93.4 | Very high | 1 Ų | 1 | 17.6 Ų | 17.6 | 1% | 0.006 | 9% | 0.087 | C | C | . | . | H | α-helix | trans | -58.8 | -46 | 170.9 | 169.5 | 0 | 0 | 0 | 0 | 110.1 | S122 A129 I130 F212 W300 Y331 F334 | S122-V126 WeakPolarHBondContact O-CB 3.41Å; S122-V126 WeakPolarHBondContact O-CG2 3.39Å; S122-V126 PolarHBondContact O-N 3.37Å; V126-A129 PolarHBondContact O-N 3.44Å; V126-I130 HydrophobicContact CG1-CD1 3.64Å; V126-I130 WeakPolarHBondContact O-CB 3.09Å; V126-I130 VanDerWaalsContact O-CG1 3.29Å; V126-I130 WeakPolarHBondContact O-CG1 3.4Å; V126-I130 PolarHBondContact O-N 2.94Å; V126-F212 HydrophobicContact CG1-CZ 4.06Å; V126-W300 HydrophobicContact CB-CH2 4.2Å; V126-W300 HydrophobicContact CB-CZ3 4.33Å; V126-W300 HydrophobicContact CG1-CE3 4.34Å; V126-W300 HydrophobicContact CG1-CH2 3.69Å; V126-W300 HydrophobicContact CG1-CZ3 3.5Å; V126-W300 VanDerWaalsContact CG1-CZ3 3.5Å; V126-W300 HydrophobicContact CG2-CH2 3.92Å; V126-W300 HydrophobicContact CG2-CZ3 4Å; V126-Y331 HydrophobicContact CG2-CE1 4.28Å; V126-F334 HydrophobicContact CG2-CZ 4.31Å |
| 127 | S | 96.7 | Very high | 93.7 | Very high | 0 Ų | 0 | 14 Ų | 14 | 0% | 0 | 7% | 0.073 | C | C | . | . | H | α-helix | trans | -61.1 | -47.4 | 176.6 | -64.5 | 0 | 0 | 0 | 0 | 112.4 | V123 C124 F125 L131 F212 Y216 | V123-S127 WeakPolarHBondContact O-CB 3.49Å; V123-S127 PolarHBondContact O-N 3.45Å; V123-S127 PolarHBondContact O-OG 2.91Å; C124-S127 WeakPolarHBondContact O-CB 3.33Å; C124-S127 PolarHBondContact O-N 3Å; F125-S127 VanDerWaalsContact C-N 3.3Å; F125-S127 PolarHBondContact O-N 2.91Å; S127-L131 VanDerWaalsContact O-CB 3.3Å; S127-L131 WeakPolarHBondContact O-CB 3.46Å; S127-L131 VanDerWaalsContact O-CG 3.22Å; S127-L131 WeakPolarHBondContact O-CG 3.29Å; S127-L131 PolarHBondContact O-N 3.41Å; S127-F212 WeakPolarHBondContact OG-CE2 3.4Å; S127-Y216 VanDerWaalsContact CB-CE1 3.42Å; S127-Y216 WeakPolarHBondContact OG-CE1 3.39Å |
| 128 | L | 97.8 | Very high | 93.7 | Very high | 0 Ų | 0 | 12.5 Ų | 12.5 | 0% | 0 | 7% | 0.068 | C | C | . | . | H | α-helix | trans | -60.1 | -47 | 179.5 | -74.3 | 169.9 | 0 | 0 | 0 | 111.1 | V85 C124 F125 S132 V166 W167 A170 | V85-L128 HydrophobicContact CB-CB 4.46Å; V85-L128 HydrophobicContact CG1-CB 3.48Å; V85-L128 VanDerWaalsContact CG1-CB 3.48Å; V85-L128 HydrophobicContact CG1-CD1 4.33Å; V85-L128 HydrophobicContact CG2-CB 4.08Å; V85-L128 HydrophobicContact CG2-CD1 4.42Å; C124-L128 VanDerWaalsContact O-CG 3.3Å; C124-L128 WeakPolarHBondContact O-CG 3.4Å; C124-L128 PolarHBondContact O-N 3.43Å; F125-L128 HydrophobicContact CD1-CD1 4Å; F125-L128 HydrophobicContact CE1-CD1 4.34Å; F125-L128 PolarHBondContact O-N 2.8Å; L128-S132 VanDerWaalsContact O-CB 3.25Å; L128-S132 WeakPolarHBondContact O-CB 3.45Å; L128-S132 PolarHBondContact O-N 2.87Å; L128-S132 PolarHBondContact O-OG 2.65Å; L128-V166 HydrophobicContact CD2-CG1 3.82Å; L128-W167 HydrophobicContact CD1-CD2 4.39Å; L128-W167 HydrophobicContact CD1-CE3 3.84Å; L128-W167 HydrophobicContact CD1-CH2 3.71Å; L128-W167 HydrophobicContact CD1-CZ2 4.27Å; L128-W167 HydrophobicContact CD1-CZ3 3.48Å; L128-W167 VanDerWaalsContact CD1-CZ3 3.48Å; L128-W167 HydrophobicContact CD2-CD2 3.69Å; L128-W167 HydrophobicContact CD2-CE3 3.8Å; L128-W167 HydrophobicContact CD2-CG 4.04Å; L128-W167 HydrophobicContact CD2-CZ3 4.28Å; L128-W167 HydrophobicContact CG-CE3 4.45Å; L128-A170 HydrophobicContact CD2-CB 3.59Å; L128-A170 HydrophobicContact CG-CB 3.6Å |
| 129 | A | 96.3 | Very high | 93.6 | Very high | 1 Ų | 1 | 12.2 Ų | 12.2 | 1% | 0.008 | 7% | 0.067 | C | C | . | . | H | α-helix | trans | -64.7 | -47.7 | -178.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | V85 F125 V126 L131 S132 V133 F334 | V85-A129 HydrophobicContact CG1-CB 4.34Å; F125-A129 WeakPolarHBondContact O-CB 3.49Å; F125-A129 PolarHBondContact O-N 2.87Å; V126-A129 PolarHBondContact O-N 3.44Å; A129-L131 PolarHBondContact O-N 3.31Å; A129-S132 PolarHBondContact O-N 3.32Å; A129-V133 WeakPolarHBondContact O-CB 3.27Å; A129-V133 WeakPolarHBondContact O-CG2 3.48Å; A129-V133 PolarHBondContact O-N 2.94Å; A129-F334 HydrophobicContact CB-CD1 4.11Å; A129-F334 HydrophobicContact CB-CE1 3.57Å |
| 130 | I | 96.1 | Very high | 93.4 | Very high | 0 Ų | 0 | 15 Ų | 15 | 0% | 0 | 8% | 0.077 | C | C | . | . | H | α-helix | trans | -62.7 | -43.8 | 179.5 | -70.6 | 171.7 | 0 | 0 | 0 | 111.6 | V126 S132 V133 S134 Y216 P220 F296 W300 F304 | V126-I130 HydrophobicContact CG1-CD1 3.64Å; V126-I130 WeakPolarHBondContact O-CB 3.09Å; V126-I130 VanDerWaalsContact O-CG1 3.29Å; V126-I130 WeakPolarHBondContact O-CG1 3.4Å; V126-I130 PolarHBondContact O-N 2.94Å; I130-S132 VanDerWaalsContact C-N 3.33Å; I130-V133 PolarHBondContact O-N 3.21Å; I130-S134 WeakPolarHBondContact O-CB 3.33Å; I130-S134 PolarHBondContact O-N 2.85Å; I130-S134 PolarHBondContact O-OG 2.97Å; I130-Y216 HydrophobicContact CB-CD1 4.28Å; I130-Y216 HydrophobicContact CG2-CD1 4.03Å; I130-Y216 WeakPolarHBondContact CG2-O 3.34Å; I130-P220 HydrophobicContact CG2-CB 4.29Å; I130-P220 HydrophobicContact CG2-CG 3.7Å; I130-F296 HydrophobicContact CG1-CE2 4.25Å; I130-F296 HydrophobicContact CG2-CE2 4.19Å; I130-F296 HydrophobicContact CG2-CZ 4.5Å; I130-W300 HydrophobicContact CD1-CD2 3.99Å; I130-W300 HydrophobicContact CD1-CE3 4.1Å; I130-W300 HydrophobicContact CD1-CH2 4.33Å; I130-W300 HydrophobicContact CD1-CZ2 4.19Å; I130-W300 HydrophobicContact CD1-CZ3 4.28Å; I130-W300 HydrophobicContact CG1-CD2 4.3Å; I130-W300 HydrophobicContact CG1-CH2 4.47Å; I130-W300 HydrophobicContact CG1-CZ2 3.93Å; I130-F304 HydrophobicContact CD1-CE2 3.91Å; I130-F304 HydrophobicContact CD1-CZ 3.82Å |
| 131 | L | 96.1 | Very high | 92.9 | Very high | 29 Ų | 29 | 15.1 Ų | 15.1 | 15% | 0.152 | 8% | 0.076 | C | C | . | . | H | α-helix | trans | -67.4 | -35.9 | 177.8 | -71.8 | 173.6 | 0 | 0 | 0 | 111.8 | S127 A129 S134 A135 V166 K169 Y216 | S127-L131 VanDerWaalsContact O-CB 3.3Å; S127-L131 WeakPolarHBondContact O-CB 3.46Å; S127-L131 VanDerWaalsContact O-CG 3.22Å; S127-L131 WeakPolarHBondContact O-CG 3.29Å; S127-L131 PolarHBondContact O-N 3.41Å; A129-L131 PolarHBondContact O-N 3.31Å; L131-S134 WeakPolarHBondContact O-CB 3.35Å; L131-S134 PolarHBondContact O-N 3.46Å; L131-A135 WeakPolarHBondContact O-CB 3.24Å; L131-A135 PolarHBondContact O-N 3.28Å; L131-V166 HydrophobicContact CB-CB 4.41Å; L131-V166 HydrophobicContact CB-CG1 3.76Å; L131-V166 HydrophobicContact CB-CG2 4.01Å; L131-V166 HydrophobicContact CD1-CG1 4.24Å; L131-K169 HydrophobicContact CD1-CB 3.98Å; L131-Y216 HydrophobicContact CD1-CE1 3.74Å; L131-Y216 HydrophobicContact CD2-CE1 4.13Å; L131-Y216 HydrophobicContact CG-CD1 4.25Å; L131-Y216 HydrophobicContact CG-CE1 3.69Å |
| 132 | S | 95.6 | Very high | 92.3 | Very high | 1 Ų | 1 | 18.4 Ų | 18.4 | 1% | 0.007 | 9% | 0.087 | C | C | . | . | H | α-helix | trans | -66.3 | -44.8 | 175.3 | -57.2 | 0 | 0 | 0 | 0 | 111.2 | H81 L128 A129 I130 S134 A135 I136 | H81-S132 PolarHBondContact CE1-OG 3.09Å; H81-S132 PolarHBondContact ND1-OG 3.4Å; H81-S132 VanDerWaalsContact ND1-OG 3.14Å; L128-S132 VanDerWaalsContact O-CB 3.25Å; L128-S132 WeakPolarHBondContact O-CB 3.45Å; L128-S132 PolarHBondContact O-N 2.87Å; L128-S132 PolarHBondContact O-OG 2.65Å; A129-S132 PolarHBondContact O-N 3.32Å; I130-S132 VanDerWaalsContact C-N 3.33Å; S132-S134 VanDerWaalsContact C-N 3.29Å; S132-S134 PolarHBondContact O-N 3.48Å; S132-A135 WeakPolarHBondContact O-CB 3.38Å; S132-A135 PolarHBondContact O-N 3.42Å; S132-I136 WeakPolarHBondContact O-CG1 3.33Å; S132-I136 PolarHBondContact O-N 3.04Å |
| 133 | V | 93.3 | Very high | 91.6 | Very high | 4 Ų | 4 | 24.3 Ų | 24.3 | 2% | 0.024 | 11% | 0.11 | C | C | . | . | H | α-helix | trans | -58.3 | -42.7 | 171.5 | 164 | 0 | 0 | 0 | 0 | 111.2 | L82 A129 I130 I136 N137 F296 Y341 | L82-V133 HydrophobicContact CD1-CG2 4.08Å; L82-V133 HydrophobicContact CD2-CG2 4.16Å; A129-V133 WeakPolarHBondContact O-CB 3.27Å; A129-V133 WeakPolarHBondContact O-CG2 3.48Å; A129-V133 PolarHBondContact O-N 2.94Å; I130-V133 PolarHBondContact O-N 3.21Å; V133-I136 PolarHBondContact O-N 3.19Å; V133-N137 PolarHBondContact O-N 3.05Å; V133-N137 PolarHBondContact O-ND2 3.19Å; V133-F296 HydrophobicContact CG1-CD2 4.3Å; V133-Y341 WeakPolarHBondContact CG1-OH 3.19Å; V133-Y341 HydrophobicContact CG2-CE2 4.2Å |
| 134 | S | 93.8 | Very high | 90.6 | Very high | 13 Ų | 13 | 26.3 Ų | 26.3 | 9% | 0.091 | 12% | 0.121 | C | C | . | . | H | α-helix | trans | -63.5 | -43 | 176.8 | -59.6 | 0 | 0 | 0 | 0 | 111.5 | I130 L131 S132 I136 N137 V138 | I130-S134 WeakPolarHBondContact O-CB 3.33Å; I130-S134 PolarHBondContact O-N 2.85Å; I130-S134 PolarHBondContact O-OG 2.97Å; L131-S134 WeakPolarHBondContact O-CB 3.35Å; L131-S134 PolarHBondContact O-N 3.46Å; S132-S134 VanDerWaalsContact C-N 3.29Å; S132-S134 PolarHBondContact O-N 3.48Å; S134-I136 VanDerWaalsContact C-N 3.35Å; S134-I136 PolarHBondContact O-N 2.94Å; S134-N137 PolarHBondContact O-N 2.92Å; S134-N137 VanDerWaalsContact O-N 3.16Å; S134-V138 WeakPolarHBondContact O-CG2 3.34Å; S134-V138 PolarHBondContact O-N 3.27Å |
| 135 | A | 93.4 | Very high | 89.3 | Confident | 13 Ų | 13 | 27.9 Ų | 27.9 | 11% | 0.107 | 13% | 0.131 | C | C | . | . | H | α-helix | trans | -61.4 | -41.8 | 175.5 | 0 | 0 | 0 | 0 | 0 | 111.9 | F78 L131 S132 N137 V138 E139 V162 | F78-A135 HydrophobicContact CD1-CB 4.06Å; F78-A135 HydrophobicContact CE1-CB 4.06Å; F78-A135 HydrophobicContact CZ-CB 4.46Å; L131-A135 WeakPolarHBondContact O-CB 3.24Å; L131-A135 PolarHBondContact O-N 3.28Å; S132-A135 WeakPolarHBondContact O-CB 3.38Å; S132-A135 PolarHBondContact O-N 3.42Å; A135-N137 VanDerWaalsContact C-N 3.34Å; A135-N137 PolarHBondContact O-N 3.03Å; A135-V138 PolarHBondContact O-N 3.04Å; A135-E139 WeakPolarHBondContact O-CB 3.29Å; A135-E139 PolarHBondContact O-N 3.22Å; A135-V162 HydrophobicContact CB-CG1 4.2Å |
| 136 | I | 91.3 | Very high | 88.1 | Confident | 1 Ų | 1 | 30.1 Ų | 30.1 | 1% | 0.005 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -60.7 | -44.2 | 173.3 | -65 | 164.8 | 0 | 0 | 0 | 110.3 | F78 V79 L82 S132 V133 S134 V138 E139 R140 Y341 | F78-I136 HydrophobicContact CB-CD1 4.48Å; F78-I136 HydrophobicContact CB-CG1 3.62Å; V79-I136 HydrophobicContact CG2-CD1 4.31Å; L82-I136 HydrophobicContact CB-CD1 4.18Å; L82-I136 HydrophobicContact CD2-CD1 3.67Å; S132-I136 WeakPolarHBondContact O-CG1 3.33Å; S132-I136 PolarHBondContact O-N 3.04Å; V133-I136 PolarHBondContact O-N 3.19Å; S134-I136 VanDerWaalsContact C-N 3.35Å; S134-I136 PolarHBondContact O-N 2.94Å; I136-V138 VanDerWaalsContact C-N 3.34Å; I136-V138 PolarHBondContact O-N 3.04Å; I136-E139 WeakPolarHBondContact O-CB 3.33Å; I136-E139 PolarHBondContact O-N 2.73Å; I136-R140 HydrophobicContact CG2-CG 4.31Å; I136-R140 WeakPolarHBondContact O-CB 3.23Å; I136-R140 WeakPolarHBondContact O-CG 3.31Å; I136-R140 PolarHBondContact O-N 2.86Å; I136-Y341 HydrophobicContact CB-CE1 4.43Å; I136-Y341 HydrophobicContact CD1-CD1 4.2Å; I136-Y341 HydrophobicContact CD1-CE1 4.23Å; I136-Y341 HydrophobicContact CG2-CD1 3.97Å; I136-Y341 HydrophobicContact CG2-CE1 3.72Å |
| 137 | N | 89 | Confident | 86.8 | Confident | 2 Ų | 2 | 33.5 Ų | 33.5 | 1% | 0.011 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -63.9 | -38.1 | 178 | -77.2 | -62.7 | 0 | 0 | 0 | 112.5 | V133 S134 A135 R140 Y141 L223 | V133-N137 PolarHBondContact O-N 3.05Å; V133-N137 PolarHBondContact O-ND2 3.19Å; S134-N137 PolarHBondContact O-N 2.92Å; S134-N137 VanDerWaalsContact O-N 3.16Å; A135-N137 VanDerWaalsContact C-N 3.34Å; A135-N137 PolarHBondContact O-N 3.03Å; N137-R140 PolarHBondContact O-N 3.16Å; N137-Y141 WeakPolarHBondContact O-CB 3.44Å; N137-Y141 PolarHBondContact O-N 3.24Å; N137-L223 HydrophobicContact CB-CD2 3.38Å |
| 138 | V | 89.2 | Confident | 85.2 | Confident | 55 Ų | 55 | 40.9 Ų | 40.9 | 33% | 0.333 | 20% | 0.2 | S | C | . | . | H | α-helix | trans | -65 | -45.1 | 173.3 | 174.6 | 0 | 0 | 0 | 0 | 111.3 | S134 A135 I136 R140 Y141 Y142 L223 | S134-V138 WeakPolarHBondContact O-CG2 3.34Å; S134-V138 PolarHBondContact O-N 3.27Å; A135-V138 PolarHBondContact O-N 3.04Å; I136-V138 VanDerWaalsContact C-N 3.34Å; I136-V138 PolarHBondContact O-N 3.04Å; V138-R140 VanDerWaalsContact C-N 3.29Å; V138-R140 PolarHBondContact O-N 3.19Å; V138-Y141 WeakPolarHBondContact O-CB 3.31Å; V138-Y141 PolarHBondContact O-N 2.82Å; V138-Y142 HydrophobicContact CG1-CD2 3.77Å; V138-Y142 HydrophobicContact CG1-CE2 3.63Å; V138-Y142 VanDerWaalsContact O-CD2 3.28Å; V138-Y142 WeakPolarHBondContact O-CD2 3.27Å; V138-Y142 PolarHBondContact O-N 3.27Å; V138-L223 HydrophobicContact CG2-CD1 3.65Å; V138-L223 HydrophobicContact CG2-CD2 4.3Å; V138-L223 HydrophobicContact CG2-CG 4.39Å |
| 139 | E | 86.8 | Confident | 83.6 | Confident | 12 Ų | 12 | 48.1 Ų | 48.1 | 6% | 0.056 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -56.1 | -47.2 | 175 | -176.8 | -171 | -137.2 | 0 | 0 | 110.5 | F78 A135 I136 Y141 Y142 Y143 Y150 M154 | F78-E139 HydrophobicContact CD2-CB 4.09Å; F78-E139 HydrophobicContact CD2-CG 4.24Å; F78-E139 HydrophobicContact CE2-CB 4.09Å; F78-E139 HydrophobicContact CE2-CG 4.32Å; A135-E139 WeakPolarHBondContact O-CB 3.29Å; A135-E139 PolarHBondContact O-N 3.22Å; I136-E139 WeakPolarHBondContact O-CB 3.33Å; I136-E139 PolarHBondContact O-N 2.73Å; E139-Y141 PolarHBondContact O-N 3.04Å; E139-Y142 PolarHBondContact O-N 3.16Å; E139-Y143 WeakPolarHBondContact O-CB 3.49Å; E139-Y143 PolarHBondContact O-N 2.93Å; E139-Y150 HydrophobicContact CG-CE2 3.8Å; E139-Y150 WeakPolarHBondContact CG-OH 3.38Å; E139-Y150 PolarHBondContact OE1-OH 3.28Å; E139-Y150 VanDerWaalsContact OE1-OH 3.06Å; E139-M154 HydrophobicContact CG-CE 4.22Å |
| 140 | R | 81.9 | Confident | 82.3 | Confident | 65 Ų | 65 | 50.3 Ų | 50.3 | 25% | 0.245 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -63.2 | -39.8 | 177.6 | -68.5 | -63.3 | -179.8 | -176.3 | 0.9 | 112.7 | I136 N137 V138 Y143 V144 | I136-R140 HydrophobicContact CG2-CG 4.31Å; I136-R140 WeakPolarHBondContact O-CB 3.23Å; I136-R140 WeakPolarHBondContact O-CG 3.31Å; I136-R140 PolarHBondContact O-N 2.86Å; N137-R140 PolarHBondContact O-N 3.16Å; V138-R140 VanDerWaalsContact C-N 3.29Å; V138-R140 PolarHBondContact O-N 3.19Å; R140-Y143 PolarHBondContact O-N 3.25Å; R140-V144 WeakPolarHBondContact O-CB 3.38Å; R140-V144 VanDerWaalsContact O-CG2 3.32Å; R140-V144 WeakPolarHBondContact O-CG2 3.35Å; R140-V144 PolarHBondContact O-N 2.85Å |
| 141 | Y | 82.6 | Confident | 81 | Confident | 64 Ų | 64 | 58 Ų | 58 | 25% | 0.251 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -57.2 | -51.4 | 174.3 | 174.3 | -98.8 | 0 | 0 | 0 | 111.6 | N137 V138 E139 Y143 V144 V145 V227 | N137-Y141 WeakPolarHBondContact O-CB 3.44Å; N137-Y141 PolarHBondContact O-N 3.24Å; V138-Y141 WeakPolarHBondContact O-CB 3.31Å; V138-Y141 PolarHBondContact O-N 2.82Å; E139-Y141 PolarHBondContact O-N 3.04Å; Y141-Y143 VanDerWaalsContact C-N 3.34Å; Y141-Y143 PolarHBondContact O-N 2.94Å; Y141-V144 PolarHBondContact O-N 2.96Å; Y141-V145 HydrophobicContact CD2-CG2 3.76Å; Y141-V145 HydrophobicContact CE2-CB 4.24Å; Y141-V145 HydrophobicContact CE2-CG1 4.47Å; Y141-V145 HydrophobicContact CE2-CG2 3.6Å; Y141-V145 HydrophobicContact CG-CG2 4.44Å; Y141-V145 WeakPolarHBondContact O-CB 3.2Å; Y141-V145 WeakPolarHBondContact O-CG2 3.41Å; Y141-V145 PolarHBondContact O-N 3.14Å; Y141-V227 HydrophobicContact CD2-CG2 4.01Å; Y141-V227 HydrophobicContact CG-CG2 4.18Å |
| 142 | Y | 82.1 | Confident | 79.4 | Confident | 98 Ų | 98 | 62.3 Ų | 62.3 | 38% | 0.384 | 30% | 0.299 | S | S | . | . | H | α-helix | trans | -64.4 | -39.5 | 179.6 | -79.8 | -70.3 | 0 | 0 | 0 | 112.2 | V138 E139 V144 H146 | V138-Y142 HydrophobicContact CG1-CD2 3.77Å; V138-Y142 HydrophobicContact CG1-CE2 3.63Å; V138-Y142 VanDerWaalsContact O-CD2 3.28Å; V138-Y142 WeakPolarHBondContact O-CD2 3.27Å; V138-Y142 PolarHBondContact O-N 3.27Å; E139-Y142 PolarHBondContact O-N 3.16Å; Y142-V144 PolarHBondContact O-N 2.92Å; Y142-H146 CarbonylContact O-C 3.12Å; Y142-H146 WeakPolarHBondContact O-CA 3.21Å; Y142-H146 PolarHBondContact O-N 3.14Å |
| 143 | Y | 78.6 | Confident | 78 | Confident | 128 Ų | 128 | 69.7 Ų | 69.7 | 50% | 0.502 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -60.9 | -42.7 | 176.2 | -179.1 | -98 | 0 | 0 | 0 | 112.8 | E139 R140 Y141 P147 Y150 | E139-Y143 WeakPolarHBondContact O-CB 3.49Å; E139-Y143 PolarHBondContact O-N 2.93Å; R140-Y143 PolarHBondContact O-N 3.25Å; Y141-Y143 VanDerWaalsContact C-N 3.34Å; Y141-Y143 PolarHBondContact O-N 2.94Å; Y143-P147 WeakPolarHBondContact O-CA 3.48Å; Y143-Y150 AromaticContact CD2-CD1 3.88Å; Y143-Y150 HydrophobicContact CD2-CD1 3.88Å; Y143-Y150 HydrophobicContact CD2-CE1 4.01Å; Y143-Y150 HydrophobicContact CD2-CG 4.38Å |
| 144 | V | 71.3 | Confident | 77.1 | Confident | 42 Ų | 42 | 72.3 Ų | 72.3 | 26% | 0.255 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -81.3 | -47.3 | -176 | 171.5 | 0 | 0 | 0 | 0 | 112.3 | R140 Y141 Y142 M231 | R140-V144 WeakPolarHBondContact O-CB 3.38Å; R140-V144 VanDerWaalsContact O-CG2 3.32Å; R140-V144 WeakPolarHBondContact O-CG2 3.35Å; R140-V144 PolarHBondContact O-N 2.85Å; Y141-V144 PolarHBondContact O-N 2.96Å; Y142-V144 PolarHBondContact O-N 2.92Å; V144-M231 HydrophobicContact CG1-CB 4.12Å; V144-M231 HydrophobicContact CG1-CG 3.86Å |
| 145 | V | 70.6 | Confident | 76.8 | Confident | 38 Ų | 38 | 75.1 Ų | 75.1 | 23% | 0.23 | 36% | 0.356 | C | S | . | . | H | α-helix | trans | -82.5 | -32.5 | -172.4 | -179.3 | 0 | 0 | 0 | 0 | 111.4 | Y141 | Y141-V145 HydrophobicContact CD2-CG2 3.76Å; Y141-V145 HydrophobicContact CE2-CB 4.24Å; Y141-V145 HydrophobicContact CE2-CG1 4.47Å; Y141-V145 HydrophobicContact CE2-CG2 3.6Å; Y141-V145 HydrophobicContact CG-CG2 4.44Å; Y141-V145 WeakPolarHBondContact O-CB 3.2Å; Y141-V145 WeakPolarHBondContact O-CG2 3.41Å; Y141-V145 PolarHBondContact O-N 3.14Å |
| 146 | H | 71.7 | Confident | 76.4 | Confident | 66 Ų | 66 | 81.5 Ų | 81.5 | 31% | 0.306 | 39% | 0.387 | S | S | . | . | trans | -134.2 | 60.6 | -176.2 | -61.6 | -48.8 | 0 | 0 | 0 | 112.4 | Y142 M148 R149 Y150 | Y142-H146 CarbonylContact O-C 3.12Å; Y142-H146 WeakPolarHBondContact O-CA 3.21Å; Y142-H146 PolarHBondContact O-N 3.14Å; H146-M148 VanDerWaalsContact C-N 3.32Å; H146-M148 PolarHBondContact O-N 3.36Å; H146-R149 HydrophobicContact CB-CB 4.18Å; H146-R149 PolarHBondContact O-N 3.4Å; H146-Y150 PolarHBondContact O-N 3.09Å; H146-Y150 VanDerWaalsContact O-N 3.07Å | ||
| 147 | P | 69.1 | Low | 76.3 | Confident | 72 Ų | 72 | 91.9 Ų | 91.9 | 47% | 0.468 | 43% | 0.426 | S | S | . | . | H | α-helix | trans | -55.3 | -43.3 | -173 | 21.2 | -33.1 | 0 | 0 | 0 | 113 | Y143 R149 Y150 | Y143-P147 WeakPolarHBondContact O-CA 3.48Å; P147-R149 VanDerWaalsContact C-N 3.34Å; P147-R149 PolarHBondContact O-N 2.87Å; P147-Y150 WeakPolarHBondContact O-CB 3.3Å; P147-Y150 PolarHBondContact O-N 3.31Å |
| 148 | M | 62.1 | Low | 76.3 | Confident | 154 Ų | 154 | 95.7 Ų | 95.7 | 76% | 0.759 | 45% | 0.447 | S | S | * | . | H | α-helix | trans | -69.8 | -25.6 | -179.5 | -63.7 | -61.4 | -66.7 | 0 | 0 | 113.9 | H146 | H146-M148 VanDerWaalsContact C-N 3.32Å; H146-M148 PolarHBondContact O-N 3.36Å |
| 149 | R | 65.2 | Low | 76.4 | Confident | 153 Ų | 153 | 93.6 Ų | 93.6 | 58% | 0.577 | 43% | 0.434 | S | S | * | . | H | α-helix | trans | -87.5 | -22.6 | 177.3 | -66.2 | -174.2 | 177.7 | 163.7 | -1.4 | 112.1 | H146 P147 R153 | H146-R149 HydrophobicContact CB-CB 4.18Å; H146-R149 PolarHBondContact O-N 3.4Å; P147-R149 VanDerWaalsContact C-N 3.34Å; P147-R149 PolarHBondContact O-N 2.87Å; R149-R153 VanDerWaalsContact O-CB 3.3Å; R149-R153 WeakPolarHBondContact O-CB 3.22Å; R149-R153 WeakPolarHBondContact O-CG 3.36Å; R149-R153 PolarHBondContact O-N 3.33Å |
| 150 | Y | 68.9 | Low | 76.7 | Confident | 46 Ų | 46 | 95.5 Ų | 95.5 | 18% | 0.18 | 45% | 0.451 | C | S | . | . | H | α-helix | trans | -63 | -48.1 | 178.7 | 178.8 | -97.9 | 0 | 0 | 0 | 111.6 | E139 Y143 H146 P147 V152 R153 M154 | E139-Y150 HydrophobicContact CG-CE2 3.8Å; E139-Y150 WeakPolarHBondContact CG-OH 3.38Å; E139-Y150 PolarHBondContact OE1-OH 3.28Å; E139-Y150 VanDerWaalsContact OE1-OH 3.06Å; Y143-Y150 AromaticContact CD2-CD1 3.88Å; Y143-Y150 HydrophobicContact CD2-CD1 3.88Å; Y143-Y150 HydrophobicContact CD2-CE1 4.01Å; Y143-Y150 HydrophobicContact CD2-CG 4.38Å; H146-Y150 PolarHBondContact O-N 3.09Å; H146-Y150 VanDerWaalsContact O-N 3.07Å; P147-Y150 WeakPolarHBondContact O-CB 3.3Å; P147-Y150 PolarHBondContact O-N 3.31Å; Y150-V152 VanDerWaalsContact C-N 3.25Å; Y150-V152 PolarHBondContact O-N 2.83Å; Y150-R153 PolarHBondContact O-N 3.17Å; Y150-M154 HydrophobicContact CE2-CB 4.24Å; Y150-M154 HydrophobicContact CE2-CG 4.09Å; Y150-M154 HydrophobicContact CE2-SD 4.25Å; Y150-M154 VanDerWaalsContact O-CB 3.25Å; Y150-M154 WeakPolarHBondContact O-CB 3.41Å; Y150-M154 PolarHBondContact O-N 2.88Å |
| 151 | E | 68.8 | Low | 77.3 | Confident | 162 Ų | 162 | 96.2 Ų | 96.2 | 76% | 0.757 | 47% | 0.466 | S | S | * | . | H | α-helix | trans | -62.4 | -31.4 | -179 | -66.3 | -174.1 | 168.6 | 0 | 0 | 113.2 | ||
| 152 | V | 62.6 | Low | 78 | Confident | 120 Ų | 120 | 95.6 Ų | 95.6 | 73% | 0.727 | 47% | 0.469 | S | S | * | . | H | α-helix | trans | -89.2 | -27.4 | -178.4 | -172.1 | 0 | 0 | 0 | 0 | 112.6 | Y150 | Y150-V152 VanDerWaalsContact C-N 3.25Å; Y150-V152 PolarHBondContact O-N 2.83Å |
| 153 | R | 66.5 | Low | 78.6 | Confident | 156 Ų | 156 | 92.4 Ų | 92.4 | 59% | 0.589 | 46% | 0.459 | S | S | * | . | H | α-helix | trans | -93.2 | -26 | -177.6 | -78.4 | -164 | 173.7 | 176.2 | -2.1 | 114.8 | R149 Y150 T155 | R149-R153 VanDerWaalsContact O-CB 3.3Å; R149-R153 WeakPolarHBondContact O-CB 3.22Å; R149-R153 WeakPolarHBondContact O-CG 3.36Å; R149-R153 PolarHBondContact O-N 3.33Å; Y150-R153 PolarHBondContact O-N 3.17Å; R153-T155 VanDerWaalsContact C-N 3.3Å; R153-T155 PolarHBondContact O-N 2.98Å |
| 154 | M | 74.2 | Confident | 79.5 | Confident | 58 Ų | 58 | 90.4 Ų | 90.4 | 29% | 0.286 | 46% | 0.46 | S | S | . | . | trans | -78.5 | 80.1 | -172.2 | -164 | 63 | 168.4 | 0 | 0 | 111.1 | F78 E139 Y150 V159 | F78-M154 HydrophobicContact CD2-CE 4.25Å; F78-M154 HydrophobicContact CE2-CE 3.44Å; F78-M154 VanDerWaalsContact CE2-CE 3.44Å; F78-M154 HydrophobicContact CZ-CE 4.13Å; E139-M154 HydrophobicContact CG-CE 4.22Å; Y150-M154 HydrophobicContact CE2-CB 4.24Å; Y150-M154 HydrophobicContact CE2-CG 4.09Å; Y150-M154 HydrophobicContact CE2-SD 4.25Å; Y150-M154 VanDerWaalsContact O-CB 3.25Å; Y150-M154 WeakPolarHBondContact O-CB 3.41Å; Y150-M154 PolarHBondContact O-N 2.88Å; M154-V159 HydrophobicContact CE-CG2 3.32Å; M154-V159 HydrophobicContact CG-CG2 4.47Å; M154-V159 HydrophobicContact SD-CG2 3.95Å | ||
| 155 | T | 86.1 | Confident | 80.7 | Confident | 72 Ų | 72 | 89.8 Ų | 89.8 | 44% | 0.442 | 46% | 0.461 | S | S | . | . | trans | -90 | 149.3 | 176.8 | 65.3 | 0 | 0 | 0 | 0 | 111.3 | R153 R157 L158 V159 | R153-T155 VanDerWaalsContact C-N 3.3Å; R153-T155 PolarHBondContact O-N 2.98Å; T155-R157 PolarHBondContact O-N 3.26Å; T155-L158 PolarHBondContact O-N 3.12Å; T155-L158 VanDerWaalsContact O-N 3.09Å; T155-L158 PolarHBondContact OG1-N 3.32Å; T155-V159 PolarHBondContact O-N 3.42Å | ||
| 156 | L | 85.6 | Confident | 82 | Confident | 148 Ų | 148 | 88.4 Ų | 88.4 | 78% | 0.775 | 45% | 0.453 | S | S | * | . | H | α-helix | trans | -55.7 | -33.4 | 175.1 | -69.6 | 171.2 | 0 | 0 | 0 | 112.6 | V159 A160 | L156-V159 PolarHBondContact O-N 3.15Å; L156-A160 WeakPolarHBondContact O-CB 3.38Å; L156-A160 PolarHBondContact O-N 3.28Å |
| 157 | R | 89.1 | Confident | 83.3 | Confident | 218 Ų | 218 | 89.3 Ų | 89.3 | 82% | 0.823 | 45% | 0.454 | S | S | * | . | H | α-helix | trans | -65.9 | -41.7 | 177.8 | -61 | -176.5 | -161.9 | 169.6 | 5.1 | 112.1 | T155 S161 | T155-R157 PolarHBondContact O-N 3.26Å; R157-S161 VanDerWaalsContact O-CB 3.29Å; R157-S161 WeakPolarHBondContact O-CB 3.1Å; R157-S161 PolarHBondContact O-N 3.49Å |
| 158 | L | 90.6 | Very high | 84.6 | Confident | 83 Ų | 83 | 91 Ų | 91 | 44% | 0.435 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -63.7 | -46.1 | 176 | 178.2 | 62.7 | 0 | 0 | 0 | 110.7 | T155 S161 V162 | T155-L158 PolarHBondContact O-N 3.12Å; T155-L158 VanDerWaalsContact O-N 3.09Å; T155-L158 PolarHBondContact OG1-N 3.32Å; L158-S161 PolarHBondContact O-N 3.21Å; L158-V162 HydrophobicContact CD1-CG2 4.36Å; L158-V162 WeakPolarHBondContact O-CG2 3.25Å; L158-V162 PolarHBondContact O-N 2.93Å |
| 159 | V | 90.9 | Very high | 86.2 | Confident | 11 Ų | 11 | 89.9 Ų | 89.9 | 7% | 0.067 | 45% | 0.449 | C | S | . | . | H | α-helix | trans | -59 | -50.5 | 177.6 | 179 | 0 | 0 | 0 | 0 | 110.9 | V77 F78 M154 T155 L156 S161 V162 L163 | V77-V159 HydrophobicContact CB-CG1 4.04Å; V77-V159 HydrophobicContact CG1-CG1 3.82Å; F78-V159 HydrophobicContact CE1-CG1 4.1Å; F78-V159 HydrophobicContact CZ-CG1 4.16Å; F78-V159 HydrophobicContact CZ-CG2 4.42Å; M154-V159 HydrophobicContact CE-CG2 3.32Å; M154-V159 HydrophobicContact CG-CG2 4.47Å; M154-V159 HydrophobicContact SD-CG2 3.95Å; T155-V159 PolarHBondContact O-N 3.42Å; L156-V159 PolarHBondContact O-N 3.15Å; V159-S161 VanDerWaalsContact C-N 3.31Å; V159-S161 PolarHBondContact O-N 2.91Å; V159-V162 PolarHBondContact O-N 3.31Å; V159-L163 HydrophobicContact CG1-CD1 4.31Å; V159-L163 HydrophobicContact CG1-CG 4.47Å; V159-L163 WeakPolarHBondContact O-CG 3.29Å; V159-L163 PolarHBondContact O-N 3.39Å |
| 160 | A | 93.1 | Very high | 87.8 | Confident | 51 Ų | 51 | 82.6 Ų | 82.6 | 42% | 0.421 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -58.5 | -43.4 | 177.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | L156 V162 L163 V164 | L156-A160 WeakPolarHBondContact O-CB 3.38Å; L156-A160 PolarHBondContact O-N 3.28Å; A160-V162 PolarHBondContact O-N 3.26Å; A160-L163 PolarHBondContact O-N 2.89Å; A160-V164 WeakPolarHBondContact O-CG2 3.36Å; A160-V164 PolarHBondContact O-N 3.42Å |
| 161 | S | 94.6 | Very high | 89.1 | Confident | 80 Ų | 80 | 84.1 Ų | 84.1 | 56% | 0.559 | 43% | 0.432 | S | S | * | . | H | α-helix | trans | -61.6 | -42.6 | 176.7 | 178.4 | 0 | 0 | 0 | 0 | 112.5 | R157 L158 V159 G165 | R157-S161 VanDerWaalsContact O-CB 3.29Å; R157-S161 WeakPolarHBondContact O-CB 3.1Å; R157-S161 PolarHBondContact O-N 3.49Å; L158-S161 PolarHBondContact O-N 3.21Å; V159-S161 VanDerWaalsContact C-N 3.31Å; V159-S161 PolarHBondContact O-N 2.91Å; S161-G165 PolarHBondContact O-N 2.95Å |
| 162 | V | 95.6 | Very high | 90.3 | Very high | 52 Ų | 52 | 79 Ų | 79 | 32% | 0.315 | 42% | 0.417 | S | S | . | . | H | α-helix | trans | -61.8 | -48.1 | 175.3 | 172 | 0 | 0 | 0 | 0 | 110.4 | F78 A135 L158 V159 A160 V164 G165 V166 | F78-V162 HydrophobicContact CE1-CB 4.21Å; F78-V162 HydrophobicContact CE1-CG1 3.79Å; F78-V162 HydrophobicContact CZ-CB 4.36Å; F78-V162 HydrophobicContact CZ-CG1 4.11Å; A135-V162 HydrophobicContact CB-CG1 4.2Å; L158-V162 HydrophobicContact CD1-CG2 4.36Å; L158-V162 WeakPolarHBondContact O-CG2 3.25Å; L158-V162 PolarHBondContact O-N 2.93Å; V159-V162 PolarHBondContact O-N 3.31Å; A160-V162 PolarHBondContact O-N 3.26Å; V162-V164 PolarHBondContact O-N 2.92Å; V162-G165 PolarHBondContact O-N 3.3Å; V162-G165 VanDerWaalsContact O-N 3.17Å; V162-V166 HydrophobicContact CG1-CG2 4.47Å; V162-V166 WeakPolarHBondContact O-CG2 3.49Å; V162-V166 PolarHBondContact O-N 3.43Å |
| 163 | L | 96.1 | Very high | 91.8 | Very high | 31 Ų | 31 | 74.6 Ų | 74.6 | 16% | 0.162 | 39% | 0.389 | C | S | . | . | H | α-helix | trans | -60.7 | -45.6 | 179.6 | -67.1 | -177.5 | 0 | 0 | 0 | 112.2 | V77 F78 H81 V159 A160 G165 V166 W167 | V77-L163 HydrophobicContact CG1-CD1 4.08Å; F78-L163 HydrophobicContact CD1-CD2 3.77Å; F78-L163 HydrophobicContact CE1-CD2 3.97Å; F78-L163 HydrophobicContact CE1-CG 4.36Å; H81-L163 HydrophobicContact CB-CD1 4.48Å; H81-L163 HydrophobicContact CB-CD2 3.92Å; V159-L163 HydrophobicContact CG1-CD1 4.31Å; V159-L163 HydrophobicContact CG1-CG 4.47Å; V159-L163 WeakPolarHBondContact O-CG 3.29Å; V159-L163 PolarHBondContact O-N 3.39Å; A160-L163 PolarHBondContact O-N 2.89Å; L163-G165 VanDerWaalsContact C-N 3.3Å; L163-G165 PolarHBondContact O-N 3.31Å; L163-V166 WeakPolarHBondContact O-CB 3.43Å; L163-V166 PolarHBondContact O-N 2.97Å; L163-V166 VanDerWaalsContact O-N 3.15Å; L163-W167 VanDerWaalsContact O-CD1 3.25Å; L163-W167 PolarHBondContact O-N 3.41Å; L163-W167 VanDerWaalsContact O-N 3.13Å |
| 164 | V | 97.1 | Very high | 93 | Very high | 86 Ų | 86 | 67.2 Ų | 67.2 | 52% | 0.521 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -59.4 | -43.9 | 175 | 170 | 0 | 0 | 0 | 0 | 110.7 | A160 V162 V166 W167 I168 | A160-V164 WeakPolarHBondContact O-CG2 3.36Å; A160-V164 PolarHBondContact O-N 3.42Å; V162-V164 PolarHBondContact O-N 2.92Å; V164-V166 VanDerWaalsContact C-N 3.31Å; V164-V166 PolarHBondContact O-N 3.48Å; V164-W167 PolarHBondContact O-N 2.78Å; V164-I168 HydrophobicContact CG1-CD1 3.69Å; V164-I168 HydrophobicContact CG1-CG1 4.36Å; V164-I168 WeakPolarHBondContact O-CG1 3.24Å; V164-I168 PolarHBondContact O-N 3.34Å |
| 165 | G | 97.3 | Very high | 93.8 | Very high | 28 Ų | 28 | 66.4 Ų | 66.4 | 29% | 0.289 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -60.9 | -36.8 | 175.4 | 0 | 0 | 0 | 0 | 0 | 113.5 | S161 V162 L163 K169 | S161-G165 PolarHBondContact O-N 2.95Å; V162-G165 PolarHBondContact O-N 3.3Å; V162-G165 VanDerWaalsContact O-N 3.17Å; L163-G165 VanDerWaalsContact C-N 3.3Å; L163-G165 PolarHBondContact O-N 3.31Å; G165-K169 WeakPolarHBondContact O-CB 3.47Å; G165-K169 WeakPolarHBondContact O-CG 3.25Å; G165-K169 PolarHBondContact O-N 3.15Å |
| 166 | V | 97.5 | Very high | 93.9 | Very high | 10 Ų | 10 | 64.5 Ų | 64.5 | 6% | 0.061 | 35% | 0.35 | C | S | . | . | H | α-helix | trans | -61.9 | -47.8 | 175.4 | 167.4 | 0 | 0 | 0 | 0 | 110.9 | L128 L131 V162 L163 V164 K169 A170 | L128-V166 HydrophobicContact CD2-CG1 3.82Å; L131-V166 HydrophobicContact CB-CB 4.41Å; L131-V166 HydrophobicContact CB-CG1 3.76Å; L131-V166 HydrophobicContact CB-CG2 4.01Å; L131-V166 HydrophobicContact CD1-CG1 4.24Å; V162-V166 HydrophobicContact CG1-CG2 4.47Å; V162-V166 WeakPolarHBondContact O-CG2 3.49Å; V162-V166 PolarHBondContact O-N 3.43Å; L163-V166 WeakPolarHBondContact O-CB 3.43Å; L163-V166 PolarHBondContact O-N 2.97Å; L163-V166 VanDerWaalsContact O-N 3.15Å; V164-V166 VanDerWaalsContact C-N 3.31Å; V164-V166 PolarHBondContact O-N 3.48Å; V166-K169 PolarHBondContact O-N 2.89Å; V166-A170 WeakPolarHBondContact O-CB 3.31Å; V166-A170 PolarHBondContact O-N 3.47Å |
| 167 | W | 97.8 | Very high | 93.6 | Very high | 85 Ų | 85 | 58.4 Ų | 58.4 | 32% | 0.322 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -63.2 | -47 | 177.3 | -78.4 | 99 | 0 | 0 | 0 | 112.8 | H81 V85 L128 L163 V164 K169 A170 L171 | H81-W167 AromaticContact CD2-NE1 3.91Å; H81-W167 AromaticContact NE2-CD1 4Å; H81-W167 AromaticContact NE2-CE2 3.8Å; H81-W167 AromaticContact NE2-NE1 3.17Å; H81-W167 PolarHBondContact NE2-NE1 3.45Å; H81-W167 VanDerWaalsContact NE2-NE1 3.17Å; V85-W167 HydrophobicContact CG2-CZ2 4.45Å; L128-W167 HydrophobicContact CD1-CD2 4.39Å; L128-W167 HydrophobicContact CD1-CE3 3.84Å; L128-W167 HydrophobicContact CD1-CH2 3.71Å; L128-W167 HydrophobicContact CD1-CZ2 4.27Å; L128-W167 HydrophobicContact CD1-CZ3 3.48Å; L128-W167 VanDerWaalsContact CD1-CZ3 3.48Å; L128-W167 HydrophobicContact CD2-CD2 3.69Å; L128-W167 HydrophobicContact CD2-CE3 3.8Å; L128-W167 HydrophobicContact CD2-CG 4.04Å; L128-W167 HydrophobicContact CD2-CZ3 4.28Å; L128-W167 HydrophobicContact CG-CE3 4.45Å; L163-W167 VanDerWaalsContact O-CD1 3.25Å; L163-W167 PolarHBondContact O-N 3.41Å; L163-W167 VanDerWaalsContact O-N 3.13Å; V164-W167 PolarHBondContact O-N 2.78Å; W167-K169 VanDerWaalsContact C-N 3.32Å; W167-K169 PolarHBondContact O-N 2.97Å; W167-A170 PolarHBondContact O-N 2.94Å; W167-L171 WeakPolarHBondContact O-CB 3.37Å; W167-L171 WeakPolarHBondContact O-CG 3.25Å; W167-L171 PolarHBondContact O-N 2.87Å |
| 168 | I | 97.8 | Very high | 93.2 | Very high | 108 Ų | 108 | 50 Ų | 50 | 55% | 0.554 | 29% | 0.291 | S | S | * | . | H | α-helix | trans | -58.1 | -47.3 | 179.4 | -69.1 | 169.9 | 0 | 0 | 0 | 110.4 | V164 A172 | V164-I168 HydrophobicContact CG1-CD1 3.69Å; V164-I168 HydrophobicContact CG1-CG1 4.36Å; V164-I168 WeakPolarHBondContact O-CG1 3.24Å; V164-I168 PolarHBondContact O-N 3.34Å; I168-A172 WeakPolarHBondContact O-CB 3.37Å; I168-A172 PolarHBondContact O-N 2.79Å |
| 169 | K | 95.5 | Very high | 92.6 | Very high | 130 Ų | 130 | 51.7 Ų | 51.7 | 57% | 0.565 | 30% | 0.3 | S | S | * | . | H | α-helix | trans | -63.5 | -44.1 | 178.8 | -74.4 | -178.8 | 178.3 | -171.4 | 0 | 112.3 | L131 G165 V166 W167 A172 M173 | L131-K169 HydrophobicContact CD1-CB 3.98Å; G165-K169 WeakPolarHBondContact O-CB 3.47Å; G165-K169 WeakPolarHBondContact O-CG 3.25Å; G165-K169 PolarHBondContact O-N 3.15Å; V166-K169 PolarHBondContact O-N 2.89Å; W167-K169 VanDerWaalsContact C-N 3.32Å; W167-K169 PolarHBondContact O-N 2.97Å; K169-A172 PolarHBondContact O-N 2.8Å; K169-M173 WeakPolarHBondContact O-CG 3.31Å; K169-M173 PolarHBondContact O-N 2.81Å |
| 170 | A | 97.3 | Very high | 91.5 | Very high | 0 Ų | 0 | 51.3 Ų | 51.3 | 0% | 0 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -63.7 | -46 | 179.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | L128 V166 W167 M173 A174 | L128-A170 HydrophobicContact CD2-CB 3.59Å; L128-A170 HydrophobicContact CG-CB 3.6Å; V166-A170 WeakPolarHBondContact O-CB 3.31Å; V166-A170 PolarHBondContact O-N 3.47Å; W167-A170 PolarHBondContact O-N 2.94Å; A170-M173 PolarHBondContact O-N 3.45Å; A170-A174 VanDerWaalsContact O-CB 3.3Å; A170-A174 WeakPolarHBondContact O-CB 3.3Å; A170-A174 PolarHBondContact O-N 2.71Å |
| 171 | L | 96.4 | Very high | 90.1 | Very high | 78 Ų | 78 | 50 Ų | 50 | 41% | 0.408 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -64.9 | -40.1 | 177.4 | -69.6 | 171 | 0 | 0 | 0 | 112 | F120 W167 M173 A174 S175 | F120-L171 HydrophobicContact CZ-CD2 3.89Å; W167-L171 WeakPolarHBondContact O-CB 3.37Å; W167-L171 WeakPolarHBondContact O-CG 3.25Å; W167-L171 PolarHBondContact O-N 2.87Å; L171-M173 VanDerWaalsContact C-N 3.32Å; L171-M173 PolarHBondContact O-N 3.39Å; L171-A174 PolarHBondContact O-N 3Å; L171-S175 PolarHBondContact O-N 3.38Å; L171-S175 VanDerWaalsContact O-N 3.1Å |
| 172 | A | 94.9 | Very high | 88.2 | Confident | 53 Ų | 53 | 49.9 Ų | 49.9 | 44% | 0.438 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -62.9 | -38 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | I168 K169 S175 | I168-A172 WeakPolarHBondContact O-CB 3.37Å; I168-A172 PolarHBondContact O-N 2.79Å; K169-A172 PolarHBondContact O-N 2.8Å; A172-S175 PolarHBondContact O-OG 3.44Å |
| 173 | M | 93.1 | Very high | 86.1 | Confident | 29 Ų | 29 | 51 Ų | 51 | 14% | 0.143 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -76.7 | -34.9 | 176.7 | -69.2 | -57.4 | -60.7 | 0 | 0 | 112.6 | V123 K169 A170 L171 S175 V176 P177 F208 V211 F212 Y216 | V123-M173 HydrophobicContact CG1-CB 4.43Å; K169-M173 WeakPolarHBondContact O-CG 3.31Å; K169-M173 PolarHBondContact O-N 2.81Å; A170-M173 PolarHBondContact O-N 3.45Å; L171-M173 VanDerWaalsContact C-N 3.32Å; L171-M173 PolarHBondContact O-N 3.39Å; M173-S175 VanDerWaalsContact C-N 3.32Å; M173-S175 PolarHBondContact O-N 3.28Å; M173-V176 PolarHBondContact O-N 2.95Å; M173-P177 WeakPolarHBondContact O-CD 3.44Å; M173-F208 HydrophobicContact CE-CD2 4.19Å; M173-F208 HydrophobicContact CE-CE2 3.81Å; M173-V211 HydrophobicContact CE-CG1 4.39Å; M173-F212 HydrophobicContact CE-CD2 4.23Å; M173-Y216 HydrophobicContact CB-CE2 4.41Å; M173-Y216 HydrophobicContact CE-CE2 4.4Å; M173-Y216 HydrophobicContact CG-CE2 3.89Å; M173-Y216 WeakPolarHBondContact CG-OH 3.37Å |
| 174 | A | 93.4 | Very high | 83.8 | Confident | 0 Ų | 0 | 56.6 Ų | 56.6 | 0% | 0 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -69.2 | -26.5 | 178.6 | 0 | 0 | 0 | 0 | 0 | 113.7 | F120 V123 C124 A170 L171 V176 P177 | F120-A174 HydrophobicContact CD2-CB 3.78Å; F120-A174 WeakPolarHBondContact CD2-O 3.46Å; F120-A174 HydrophobicContact CE2-CB 3.68Å; F120-A174 HydrophobicContact CG-CB 4.4Å; F120-A174 HydrophobicContact CZ-CB 4.22Å; V123-A174 HydrophobicContact CB-CB 4.28Å; V123-A174 HydrophobicContact CG1-CB 4.2Å; C124-A174 HydrophobicContact CB-CB 3.67Å; A170-A174 VanDerWaalsContact O-CB 3.3Å; A170-A174 WeakPolarHBondContact O-CB 3.3Å; A170-A174 PolarHBondContact O-N 2.71Å; L171-A174 PolarHBondContact O-N 3Å; A174-V176 VanDerWaalsContact C-N 3.31Å; A174-P177 WeakPolarHBondContact O-CD 3.3Å |
| 175 | S | 90.3 | Very high | 81.6 | Confident | 41 Ų | 41 | 58 Ų | 58 | 29% | 0.287 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -72.4 | -24.6 | 176.6 | 66 | 0 | 0 | 0 | 0 | 113.1 | L171 A172 M173 V178 L179 | L171-S175 PolarHBondContact O-N 3.38Å; L171-S175 VanDerWaalsContact O-N 3.1Å; A172-S175 PolarHBondContact O-OG 3.44Å; M173-S175 VanDerWaalsContact C-N 3.32Å; M173-S175 PolarHBondContact O-N 3.28Å; S175-V178 PolarHBondContact O-N 2.92Å; S175-L179 WeakPolarHBondContact O-CG 3.4Å; S175-L179 PolarHBondContact O-N 2.92Å |
| 176 | V | 87.6 | Confident | 79.4 | Confident | 33 Ų | 33 | 65.3 Ų | 65.3 | 20% | 0.2 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -60.1 | -50.9 | -174.3 | 173 | 0 | 0 | 0 | 0 | 112.9 | M173 A174 V178 G180 Y204 F208 | M173-V176 PolarHBondContact O-N 2.95Å; A174-V176 VanDerWaalsContact C-N 3.31Å; V176-V178 VanDerWaalsContact C-N 3.31Å; V176-V178 PolarHBondContact O-N 3.3Å; V176-G180 PolarHBondContact O-N 2.86Å; V176-Y204 HydrophobicContact CG1-CE1 4.16Å; V176-Y204 WeakPolarHBondContact CG1-OH 3.43Å; V176-F208 HydrophobicContact CB-CD2 3.91Å; V176-F208 HydrophobicContact CB-CE2 3.82Å; V176-F208 HydrophobicContact CG1-CB 4.44Å; V176-F208 HydrophobicContact CG1-CD2 3.34Å; V176-F208 HydrophobicContact CG1-CE2 3.78Å; V176-F208 HydrophobicContact CG1-CG 4.06Å |
| 177 | P | 79.8 | Confident | 76.9 | Confident | 19 Ų | 19 | 68.3 Ų | 68.3 | 12% | 0.123 | 37% | 0.368 | C | S | . | . | H | α-helix | trans | -65.1 | -33.1 | 178 | -22.5 | 34.6 | 0 | 0 | 0 | 113.7 | V123 M173 A174 R181 F208 | V123-P177 HydrophobicContact CG2-CG 4.19Å; M173-P177 WeakPolarHBondContact O-CD 3.44Å; A174-P177 WeakPolarHBondContact O-CD 3.3Å; P177-R181 PolarHBondContact O-N 3.24Å; P177-R181 VanDerWaalsContact O-N 3.1Å; P177-F208 HydrophobicContact CG-CE1 3.74Å; P177-F208 HydrophobicContact CG-CE2 4.07Å; P177-F208 HydrophobicContact CG-CZ 3.47Å; P177-F208 VanDerWaalsContact CG-CZ 3.47Å |
| 178 | V | 79.8 | Confident | 74.4 | Confident | 41 Ų | 41 | 67.8 Ų | 67.8 | 25% | 0.248 | 38% | 0.382 | C | S | . | . | H | α-helix | trans | -71 | -46.3 | -178.6 | -177.9 | 0 | 0 | 0 | 0 | 110.6 | F120 S175 V176 R181 | F120-V178 HydrophobicContact CB-CG2 3.85Å; F120-V178 HydrophobicContact CD2-CG2 4Å; F120-V178 HydrophobicContact CG-CG2 4.4Å; S175-V178 PolarHBondContact O-N 2.92Å; V176-V178 VanDerWaalsContact C-N 3.31Å; V176-V178 PolarHBondContact O-N 3.3Å; V178-R181 PolarHBondContact O-N 3.46Å |
| 179 | L | 78.6 | Confident | 71.8 | Confident | 119 Ų | 119 | 68.4 Ų | 68.4 | 62% | 0.623 | 39% | 0.393 | S | S | * | . | H | α-helix | trans | -69.9 | -36 | 176.9 | -65.2 | 175 | 0 | 0 | 0 | 111.9 | S175 R181 V182 | S175-L179 WeakPolarHBondContact O-CG 3.4Å; S175-L179 PolarHBondContact O-N 2.92Å; L179-R181 PolarHBondContact O-N 3.39Å; L179-V182 PolarHBondContact O-N 3.46Å |
| 180 | G | 68.4 | Low | 69.5 | Low | 3 Ų | 3 | 67.7 Ų | 67.7 | 3% | 0.031 | 40% | 0.404 | C | S | . | . | H | α-helix | trans | -57.1 | -48.1 | 173.9 | 0 | 0 | 0 | 0 | 0 | 111.7 | V176 V182 S183 W199 | V176-G180 PolarHBondContact O-N 2.86Å; G180-V182 VanDerWaalsContact C-N 3.35Å; G180-V182 PolarHBondContact O-N 2.99Å; G180-S183 PolarHBondContact O-N 3.06Å; G180-S183 PolarHBondContact O-OG 2.62Å; G180-W199 VanDerWaalsContact C-CZ3 3.4Å; G180-W199 WeakPolarHBondContact O-CH2 3.47Å; G180-W199 WeakPolarHBondContact O-CZ3 3.09Å |
| 181 | R | 64.1 | Low | 67.1 | Low | 23 Ų | 23 | 73.4 Ų | 73.4 | 9% | 0.087 | 44% | 0.439 | C | S | . | . | H | α-helix | trans | -55.8 | -42.8 | -179.8 | -91.9 | -173.9 | -168.6 | -117.4 | 8.5 | 114.2 | P177 V178 L179 S183 W184 S196 W199 | P177-R181 PolarHBondContact O-N 3.24Å; P177-R181 VanDerWaalsContact O-N 3.1Å; V178-R181 PolarHBondContact O-N 3.46Å; L179-R181 PolarHBondContact O-N 3.39Å; R181-S183 PolarHBondContact O-N 2.9Å; R181-W184 PolarHBondContact O-N 3.13Å; R181-S196 PolarHBondContact NH2-O 3.39Å; R181-W199 VanDerWaalsContact CA-CZ2 3.42Å; R181-W199 HydrophobicContact CB-CD2 4.44Å; R181-W199 HydrophobicContact CB-CH2 4.42Å; R181-W199 HydrophobicContact CB-CZ2 4.2Å; R181-W199 HydrophobicContact CG-CD2 3.33Å; R181-W199 HydrophobicContact CG-CE3 3.76Å; R181-W199 HydrophobicContact CG-CG 3.71Å; R181-W199 HydrophobicContact CG-CH2 4.24Å; R181-W199 HydrophobicContact CG-CZ2 3.85Å; R181-W199 HydrophobicContact CG-CZ3 4.19Å; R181-W199 VanDerWaalsContact CZ-CG 3.47Å; R181-W199 VanDerWaalsContact NH1-CD1 3.27Å |
| 182 | V | 54 | Low | 64.8 | Low | 78 Ų | 78 | 76.2 Ų | 76.2 | 47% | 0.473 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -61.6 | -32.6 | -178.6 | 177.7 | 0 | 0 | 0 | 0 | 112.2 | L179 G180 W184 | L179-V182 PolarHBondContact O-N 3.46Å; G180-V182 VanDerWaalsContact C-N 3.35Å; G180-V182 PolarHBondContact O-N 2.99Å; V182-W184 VanDerWaalsContact C-N 3.3Å; V182-W184 PolarHBondContact O-N 3.14Å |
| 183 | S | 51 | Low | 62.8 | Low | 75 Ų | 75 | 78.1 Ų | 78.1 | 52% | 0.524 | 46% | 0.462 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -74 | -10.7 | -175 | 65.9 | 0 | 0 | 0 | 0 | 116.1 | G180 R181 | G180-S183 PolarHBondContact O-N 3.06Å; G180-S183 PolarHBondContact O-OG 2.62Å; R181-S183 PolarHBondContact O-N 2.9Å |
| 184 | W | 48.4 | Very low | 61.2 | Low | 150 Ų | 150 | 79.7 Ų | 79.7 | 57% | 0.568 | 49% | 0.486 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -119.4 | -11.7 | -175 | -80.4 | 83.8 | 0 | 0 | 0 | 114 | R181 V182 E186 W199 | R181-W184 PolarHBondContact O-N 3.13Å; V182-W184 VanDerWaalsContact C-N 3.3Å; V182-W184 PolarHBondContact O-N 3.14Å; W184-E186 PolarHBondContact O-N 3.27Å; W184-W199 HydrophobicContact CB-CH2 3.71Å; W184-W199 HydrophobicContact CB-CZ2 3.55Å; W184-W199 AromaticContact CD1-CH2 3.47Å; W184-W199 VanDerWaalsContact CD1-CH2 3.47Å; W184-W199 AromaticContact CG-CH2 3.77Å; W184-W199 HydrophobicContact CG-CH2 3.77Å; W184-W199 HydrophobicContact CG-CZ2 4.06Å |
| 185 | E | 51.6 | Low | 60.2 | Low | 114 Ų | 114 | 81.2 Ų | 81.2 | 53% | 0.533 | 50% | 0.496 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -69.3 | -10.8 | 172 | -75.3 | -163 | 135.1 | 0 | 0 | 112.9 | R116 G187 | R116-E185 IonicContact CZ-OE2 2.82Å; R116-E185 IonicContact NH2-OE1 3.2Å; R116-E185 IonicContact NH2-OE2 3.77Å; R116-E185 PolarHBondContact NH2-OE2 2.92Å; E185-G187 PolarHBondContact O-N 2.9Å; E185-G187 VanDerWaalsContact O-N 3.12Å |
| 186 | E | 49.3 | Very low | 59.2 | Low | 183 Ų | 183 | 79.8 Ų | 79.8 | 86% | 0.855 | 49% | 0.486 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -71.9 | 5 | 176.1 | -101 | 154.5 | 171.8 | 0 | 0 | 114.7 | W184 | W184-E186 PolarHBondContact O-N 3.27Š|
| 187 | G | 45.2 | Very low | 58.1 | Low | 72 Ų | 72 | 79.3 Ų | 79.3 | 74% | 0.742 | 48% | 0.482 | S | S | * | . | S | Bend | trans | -152 | 5 | -174.3 | 0 | 0 | 0 | 0 | 0 | 120.5 | E185 | E185-G187 PolarHBondContact O-N 2.9Å; E185-G187 VanDerWaalsContact O-N 3.12Å |
| 188 | A | 45.3 | Very low | 57.3 | Low | 75 Ų | 75 | 81.7 Ų | 81.7 | 62% | 0.62 | 49% | 0.492 | S | S | * | . | S | Bend | trans | -138.9 | 140.9 | -178.2 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||
| 189 | P | 44 | Very low | 56.3 | Low | 120 Ų | 120 | 82.5 Ų | 82.5 | 78% | 0.779 | 49% | 0.49 | S | S | * | . | trans | -67.5 | 135.7 | 177.5 | 26.4 | -31 | 0 | 0 | 0 | 111.5 | V191 | P189-V191 PolarHBondContact O-N 3.44Š| ||
| 190 | S | 47.8 | Very low | 55.4 | Low | 115 Ų | 115 | 79.1 Ų | 79.1 | 80% | 0.804 | 48% | 0.476 | S | S | * | . | trans | -62.2 | 90.3 | -179 | 55.5 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 191 | V | 46.2 | Very low | 55.2 | Low | 121 Ų | 121 | 84 Ų | 84 | 73% | 0.733 | 50% | 0.499 | S | S | * | . | trans | -98.6 | 105.3 | 160 | 178.4 | 0 | 0 | 0 | 0 | 105.9 | P189 P193 | P189-V191 PolarHBondContact O-N 3.44Å; V191-P193 WeakPolarHBondContact O-CD 3.38Å; V191-P193 WeakPolarHBondContact O-CG 3.41Å | ||
| 192 | N | 48.5 | Very low | 55.6 | Low | 137 Ų | 137 | 83.8 Ų | 83.8 | 73% | 0.733 | 50% | 0.5 | S | S | * | . | trans | -50.9 | 100.7 | -176.3 | -72.4 | -23 | 0 | 0 | 0 | 111.7 | ||||
| 193 | P | 52.5 | Low | 56.9 | Low | 93 Ų | 93 | 83.6 Ų | 83.6 | 60% | 0.604 | 51% | 0.507 | S | S | * | . | trans | -81.6 | 138.7 | 162.1 | 6.7 | 16.9 | 0 | 0 | 0 | 105.4 | V191 | V191-P193 WeakPolarHBondContact O-CD 3.38Å; V191-P193 WeakPolarHBondContact O-CG 3.41Å | ||
| 194 | G | 59.7 | Low | 58.4 | Low | 61 Ų | 61 | 85.5 Ų | 85.5 | 63% | 0.629 | 50% | 0.503 | S | S | * | . | trans | -50.8 | 163.4 | 175.8 | 0 | 0 | 0 | 0 | 0 | 113.2 | S196 | G194-S196 PolarHBondContact O-N 3.12Š| ||
| 195 | C | 72.3 | Confident | 59.8 | Low | 32 Ų | 32 | 79.2 Ų | 79.2 | 22% | 0.216 | 48% | 0.482 | C | S | . | . | S | Bend | trans | -70.1 | 73.1 | 179.9 | -72.4 | 0 | 0 | 0 | 0 | 113.1 | C115 Y118 | C115-C195 WeakPolarHBondContact CA-SG 3.17Å; C115-C195 HydrophobicContact CB-CB 4.19Å; C115-C195 WeakPolarHBondContact CB-SG 3.45Å; C115-C195 WeakPolarHBondContact SG-CA 3.46Å; C115-C195 WeakPolarHBondContact SG-CB 3.41Å; C115-C195 CovalentContact SG-SG 2.03Å; C115-C195 PolarHBondContact SG-SG 3.38Å; Y118-C195 HydrophobicContact CD1-CB 4.33Å |
| 196 | S | 69.2 | Low | 61.4 | Low | 12 Ų | 12 | 76.8 Ų | 76.8 | 8% | 0.084 | 47% | 0.471 | C | S | . | . | trans | -108.7 | 153.7 | -178.1 | 178.2 | 0 | 0 | 0 | 0 | 111.5 | R181 G194 Q198 E323 | R181-S196 PolarHBondContact NH2-O 3.39Å; G194-S196 PolarHBondContact O-N 3.12Å; S196-Q198 PolarHBondContact O-N 2.99Å; S196-Q198 VanDerWaalsContact OG-CB 3.24Å; S196-Q198 WeakPolarHBondContact OG-CB 3.42Å; S196-Q198 PolarHBondContact OG-N 3.24Å; S196-E323 VanDerWaalsContact CB-OE2 3.3Å; S196-E323 WeakPolarHBondContact CB-OE2 3.43Å; S196-E323 PolarHBondContact OG-OE1 3.01Å; S196-E323 PolarHBondContact OG-OE2 3.34Å | ||
| 197 | L | 63.6 | Low | 63.2 | Low | 22 Ų | 22 | 73.3 Ų | 73.3 | 12% | 0.115 | 46% | 0.458 | C | S | . | . | S | Bend | trans | -64.6 | -15.4 | 166.1 | -148.6 | 81.2 | 0 | 0 | 0 | 111.1 | L119 V123 W199 E323 | L119-L197 HydrophobicContact CD2-CD1 4.28Å; V123-L197 HydrophobicContact CG2-CD1 4.03Å; L197-W199 PolarHBondContact O-N 2.88Å; L197-W199 VanDerWaalsContact O-N 3.13Å; L197-E323 PolarHBondContact N-OE1 2.83Å |
| 198 | Q | 62.8 | Low | 65.4 | Low | 69 Ų | 69 | 70.8 Ų | 70.8 | 32% | 0.322 | 43% | 0.426 | S | S | . | . | trans | -78.3 | 76.5 | 170.5 | -67.3 | 172.5 | -20.5 | 0 | 0 | 111.4 | S196 V310 T319 | S196-Q198 PolarHBondContact O-N 2.99Å; S196-Q198 VanDerWaalsContact OG-CB 3.24Å; S196-Q198 WeakPolarHBondContact OG-CB 3.42Å; S196-Q198 PolarHBondContact OG-N 3.24Å; Q198-V310 HydrophobicContact CG-CG1 3.4Å; Q198-V310 VanDerWaalsContact NE2-CG2 3.26Å; Q198-T319 PolarHBondContact NE2-OG1 3.43Å | ||
| 199 | W | 59.4 | Low | 67.5 | Low | 59 Ų | 59 | 67.7 Ų | 67.7 | 22% | 0.223 | 40% | 0.4 | C | S | . | . | trans | -93.3 | -28.2 | -179 | 173.2 | 51.3 | 0 | 0 | 0 | 113.7 | G180 R181 W184 L197 | G180-W199 VanDerWaalsContact C-CZ3 3.4Å; G180-W199 WeakPolarHBondContact O-CH2 3.47Å; G180-W199 WeakPolarHBondContact O-CZ3 3.09Å; R181-W199 VanDerWaalsContact CA-CZ2 3.42Å; R181-W199 HydrophobicContact CB-CD2 4.44Å; R181-W199 HydrophobicContact CB-CH2 4.42Å; R181-W199 HydrophobicContact CB-CZ2 4.2Å; R181-W199 HydrophobicContact CG-CD2 3.33Å; R181-W199 HydrophobicContact CG-CE3 3.76Å; R181-W199 HydrophobicContact CG-CG 3.71Å; R181-W199 HydrophobicContact CG-CH2 4.24Å; R181-W199 HydrophobicContact CG-CZ2 3.85Å; R181-W199 HydrophobicContact CG-CZ3 4.19Å; R181-W199 VanDerWaalsContact CZ-CG 3.47Å; R181-W199 VanDerWaalsContact NH1-CD1 3.27Å; W184-W199 HydrophobicContact CB-CH2 3.71Å; W184-W199 HydrophobicContact CB-CZ2 3.55Å; W184-W199 AromaticContact CD1-CH2 3.47Å; W184-W199 VanDerWaalsContact CD1-CH2 3.47Å; W184-W199 AromaticContact CG-CH2 3.77Å; W184-W199 HydrophobicContact CG-CH2 3.77Å; W184-W199 HydrophobicContact CG-CZ2 4.06Å; L197-W199 PolarHBondContact O-N 2.88Å; L197-W199 VanDerWaalsContact O-N 3.13Å | ||
| 200 | S | 59.2 | Low | 69.8 | Low | 47 Ų | 47 | 64.5 Ų | 64.5 | 33% | 0.329 | 38% | 0.378 | S | S | . | . | trans | -169.2 | 148.9 | 178.7 | 178.4 | 0 | 0 | 0 | 0 | 112.6 | S202 C205 | S200-S202 PolarHBondContact O-N 3.18Å; S200-S202 PolarHBondContact OG-N 3.32Å; S200-C205 VanDerWaalsContact O-CB 3.29Å; S200-C205 WeakPolarHBondContact O-CB 3.37Å | ||
| 201 | H | 64.3 | Low | 71.9 | Confident | 107 Ų | 107 | 61.8 Ų | 61.8 | 50% | 0.495 | 36% | 0.356 | S | S | . | . | trans | -73.6 | 21.4 | 170.4 | -75 | -73.6 | 0 | 0 | 0 | 113.7 | ||||
| 202 | S | 73.8 | Confident | 74.2 | Confident | 17 Ų | 17 | 56.2 Ų | 56.2 | 12% | 0.119 | 32% | 0.322 | C | S | . | . | trans | -69.9 | 146.9 | 179.5 | 72.6 | 0 | 0 | 0 | 0 | 111.8 | S200 Y204 C205 Q206 | S200-S202 PolarHBondContact O-N 3.18Å; S200-S202 PolarHBondContact OG-N 3.32Å; S202-Y204 PolarHBondContact O-N 3.37Å; S202-Y204 VanDerWaalsContact O-N 3.12Å; S202-C205 PolarHBondContact O-N 2.91Å; S202-C205 PolarHBondContact OG-N 3.44Å; S202-Q206 PolarHBondContact O-N 3.01Å; S202-Q206 VanDerWaalsContact O-N 3.1Å | ||
| 203 | A | 80.8 | Confident | 76.4 | Confident | 75 Ų | 75 | 50.1 Ų | 50.1 | 62% | 0.62 | 29% | 0.291 | S | S | * | . | H | α-helix | trans | -56.5 | -29.3 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | L207 | A203-L207 VanDerWaalsContact O-CB 3.29Å; A203-L207 WeakPolarHBondContact O-CB 3.18Å; A203-L207 PolarHBondContact O-N 3.34Å |
| 204 | Y | 81.7 | Confident | 78.5 | Confident | 114 Ų | 114 | 48.5 Ų | 48.5 | 45% | 0.447 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -65.9 | -46 | 174.6 | -178.3 | -95.3 | 0 | 0 | 0 | 112.5 | V176 S202 L207 F208 | V176-Y204 HydrophobicContact CG1-CE1 4.16Å; V176-Y204 WeakPolarHBondContact CG1-OH 3.43Å; S202-Y204 PolarHBondContact O-N 3.37Å; S202-Y204 VanDerWaalsContact O-N 3.12Å; Y204-L207 PolarHBondContact O-N 3.44Å; Y204-F208 WeakPolarHBondContact O-CB 3.34Å; Y204-F208 PolarHBondContact O-N 3.06Å |
| 205 | C | 79.2 | Confident | 80.2 | Confident | 19 Ų | 19 | 49 Ų | 49 | 13% | 0.128 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -63.9 | -43.8 | 177.3 | -175.5 | 0 | 0 | 0 | 0 | 111 | S200 S202 L207 F208 V209 | S200-C205 VanDerWaalsContact O-CB 3.29Å; S200-C205 WeakPolarHBondContact O-CB 3.37Å; S202-C205 PolarHBondContact O-N 2.91Å; S202-C205 PolarHBondContact OG-N 3.44Å; C205-L207 PolarHBondContact O-N 2.93Å; C205-F208 PolarHBondContact O-N 3.49Å; C205-V209 WeakPolarHBondContact O-CG2 3.47Å; C205-V209 PolarHBondContact O-N 2.91Å |
| 206 | Q | 84.2 | Confident | 81.3 | Confident | 62 Ų | 62 | 47.8 Ų | 47.8 | 29% | 0.29 | 26% | 0.258 | S | S | . | . | H | α-helix | trans | -58.9 | -48 | 175.1 | -65.7 | -177.4 | -33.4 | 0 | 0 | 112 | S202 F208 V209 V210 A311 | S202-Q206 PolarHBondContact O-N 3.01Å; S202-Q206 VanDerWaalsContact O-N 3.1Å; Q206-F208 VanDerWaalsContact C-N 3.34Å; Q206-F208 PolarHBondContact O-N 3.3Å; Q206-V209 PolarHBondContact O-N 3.46Å; Q206-V210 WeakPolarHBondContact O-CB 3.39Å; Q206-V210 VanDerWaalsContact O-CG2 3.27Å; Q206-V210 WeakPolarHBondContact O-CG2 3.22Å; Q206-V210 PolarHBondContact O-N 3Å; Q206-A311 VanDerWaalsContact CG-O 3.31Å; Q206-A311 WeakPolarHBondContact CG-O 3.43Å; Q206-A311 PolarHBondContact NE2-O 2.91Å |
| 207 | L | 88.3 | Confident | 82.5 | Confident | 111 Ų | 111 | 48.5 Ų | 48.5 | 58% | 0.581 | 26% | 0.26 | S | S | * | . | H | α-helix | trans | -59.9 | -45.1 | 177.6 | -178.5 | 66.3 | 0 | 0 | 0 | 111.2 | A203 Y204 C205 V210 V211 | A203-L207 VanDerWaalsContact O-CB 3.29Å; A203-L207 WeakPolarHBondContact O-CB 3.18Å; A203-L207 PolarHBondContact O-N 3.34Å; Y204-L207 PolarHBondContact O-N 3.44Å; C205-L207 PolarHBondContact O-N 2.93Å; L207-V210 PolarHBondContact O-N 3.44Å; L207-V211 HydrophobicContact CD1-CG2 4.16Å; L207-V211 HydrophobicContact CG-CG2 4.37Å; L207-V211 WeakPolarHBondContact O-CB 3.27Å; L207-V211 VanDerWaalsContact O-CG2 3.24Å; L207-V211 WeakPolarHBondContact O-CG2 3.48Å; L207-V211 PolarHBondContact O-N 3Å |
| 208 | F | 89.7 | Confident | 84 | Confident | 19 Ų | 19 | 51.3 Ų | 51.3 | 8% | 0.083 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -58.9 | -50.6 | 176.8 | 169.8 | -100.8 | 0 | 0 | 0 | 111.8 | V123 M173 V176 P177 Y204 C205 Q206 V210 V211 F212 | V123-F208 HydrophobicContact CG1-CZ 4.26Å; V123-F208 HydrophobicContact CG2-CZ 4.42Å; M173-F208 HydrophobicContact CE-CD2 4.19Å; M173-F208 HydrophobicContact CE-CE2 3.81Å; V176-F208 HydrophobicContact CB-CD2 3.91Å; V176-F208 HydrophobicContact CB-CE2 3.82Å; V176-F208 HydrophobicContact CG1-CB 4.44Å; V176-F208 HydrophobicContact CG1-CD2 3.34Å; V176-F208 HydrophobicContact CG1-CE2 3.78Å; V176-F208 HydrophobicContact CG1-CG 4.06Å; P177-F208 HydrophobicContact CG-CE1 3.74Å; P177-F208 HydrophobicContact CG-CE2 4.07Å; P177-F208 HydrophobicContact CG-CZ 3.47Å; P177-F208 VanDerWaalsContact CG-CZ 3.47Å; Y204-F208 WeakPolarHBondContact O-CB 3.34Å; Y204-F208 PolarHBondContact O-N 3.06Å; C205-F208 PolarHBondContact O-N 3.49Å; Q206-F208 VanDerWaalsContact C-N 3.34Å; Q206-F208 PolarHBondContact O-N 3.3Å; F208-V210 VanDerWaalsContact C-N 3.33Å; F208-V210 PolarHBondContact O-N 2.94Å; F208-V211 PolarHBondContact O-N 3.35Å; F208-F212 HydrophobicContact CZ-CD2 4.4Å; F208-F212 HydrophobicContact CZ-CG 4.48Å; F208-F212 WeakPolarHBondContact O-CB 3.33Å; F208-F212 PolarHBondContact O-N 3.3Å |
| 209 | V | 89.6 | Confident | 85.5 | Confident | 10 Ų | 10 | 52.2 Ų | 52.2 | 6% | 0.061 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -61.8 | -41.5 | -179 | 173.6 | 0 | 0 | 0 | 0 | 111.2 | C205 Q206 F212 A213 H307 A311 | C205-V209 WeakPolarHBondContact O-CG2 3.47Å; C205-V209 PolarHBondContact O-N 2.91Å; Q206-V209 PolarHBondContact O-N 3.46Å; V209-F212 PolarHBondContact O-N 3.29Å; V209-A213 WeakPolarHBondContact O-CB 3.41Å; V209-A213 PolarHBondContact O-N 2.87Å; V209-H307 HydrophobicContact CG1-CB 4.25Å; V209-A311 HydrophobicContact CB-CB 3.94Å; V209-A311 HydrophobicContact CG1-CB 3.81Å; V209-A311 HydrophobicContact CG2-CB 4.27Å |
| 210 | V | 92.1 | Very high | 87.2 | Confident | 52 Ų | 52 | 49.6 Ų | 49.6 | 32% | 0.315 | 27% | 0.272 | S | S | . | . | H | α-helix | trans | -64.1 | -48.7 | 176.5 | 171.9 | 0 | 0 | 0 | 0 | 111 | Q206 L207 F208 F212 A213 V214 L308 L312 | Q206-V210 WeakPolarHBondContact O-CB 3.39Å; Q206-V210 VanDerWaalsContact O-CG2 3.27Å; Q206-V210 WeakPolarHBondContact O-CG2 3.22Å; Q206-V210 PolarHBondContact O-N 3Å; L207-V210 PolarHBondContact O-N 3.44Å; F208-V210 VanDerWaalsContact C-N 3.33Å; F208-V210 PolarHBondContact O-N 2.94Å; V210-F212 VanDerWaalsContact C-N 3.31Å; V210-F212 PolarHBondContact O-N 3.38Å; V210-A213 PolarHBondContact O-N 3.17Å; V210-V214 WeakPolarHBondContact O-CG2 3.22Å; V210-V214 PolarHBondContact O-N 2.92Å; V210-L308 HydrophobicContact CG2-CD1 3.81Å; V210-L312 HydrophobicContact CG2-CD2 4.4Å |
| 211 | V | 93.6 | Very high | 88.8 | Confident | 58 Ų | 58 | 49.5 Ų | 49.5 | 35% | 0.352 | 27% | 0.267 | S | S | . | . | H | α-helix | trans | -61.3 | -42.8 | 178.1 | 169.3 | 0 | 0 | 0 | 0 | 110.6 | M173 L207 F208 V214 L215 | M173-V211 HydrophobicContact CE-CG1 4.39Å; L207-V211 HydrophobicContact CD1-CG2 4.16Å; L207-V211 HydrophobicContact CG-CG2 4.37Å; L207-V211 WeakPolarHBondContact O-CB 3.27Å; L207-V211 VanDerWaalsContact O-CG2 3.24Å; L207-V211 WeakPolarHBondContact O-CG2 3.48Å; L207-V211 PolarHBondContact O-N 3Å; F208-V211 PolarHBondContact O-N 3.35Å; V211-V214 PolarHBondContact O-N 3.43Å; V211-L215 HydrophobicContact CG1-CD1 3.76Å; V211-L215 HydrophobicContact CG1-CG 4.26Å; V211-L215 WeakPolarHBondContact O-CB 3.47Å; V211-L215 VanDerWaalsContact O-CG 3.31Å; V211-L215 WeakPolarHBondContact O-CG 3.44Å; V211-L215 PolarHBondContact O-N 3.47Å |
| 212 | F | 94.3 | Very high | 90.1 | Very high | 4 Ų | 4 | 48.5 Ų | 48.5 | 2% | 0.018 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -61.6 | -47.3 | 177 | -171.1 | -108.3 | 0 | 0 | 0 | 111.3 | V123 V126 S127 M173 F208 V209 V210 V214 L215 Y216 F304 | V123-F212 HydrophobicContact CG1-CD2 4.45Å; V123-F212 HydrophobicContact CG1-CE2 3.84Å; V123-F212 HydrophobicContact CG1-CZ 4.32Å; V126-F212 HydrophobicContact CG1-CZ 4.06Å; S127-F212 WeakPolarHBondContact OG-CE2 3.4Å; M173-F212 HydrophobicContact CE-CD2 4.23Å; F208-F212 HydrophobicContact CZ-CD2 4.4Å; F208-F212 HydrophobicContact CZ-CG 4.48Å; F208-F212 WeakPolarHBondContact O-CB 3.33Å; F208-F212 PolarHBondContact O-N 3.3Å; V209-F212 PolarHBondContact O-N 3.29Å; V210-F212 VanDerWaalsContact C-N 3.31Å; V210-F212 PolarHBondContact O-N 3.38Å; F212-V214 PolarHBondContact O-N 3.49Å; F212-L215 PolarHBondContact O-N 3.34Å; F212-Y216 AromaticContact CD2-CD2 3.35Å; F212-Y216 HydrophobicContact CD2-CD2 3.35Å; F212-Y216 AromaticContact CD2-CE2 3.64Å; F212-Y216 HydrophobicContact CD2-CE2 3.64Å; F212-Y216 HydrophobicContact CD2-CG 4.24Å; F212-Y216 AromaticContact CE2-CD2 3.45Å; F212-Y216 HydrophobicContact CE2-CD2 3.45Å; F212-Y216 VanDerWaalsContact CE2-CD2 3.45Å; F212-Y216 AromaticContact CE2-CE2 3.74Å; F212-Y216 HydrophobicContact CE2-CE2 3.74Å; F212-Y216 AromaticContact CE2-CG 3.97Å; F212-Y216 HydrophobicContact CE2-CG 3.97Å; F212-Y216 HydrophobicContact CG-CD2 4.08Å; F212-Y216 HydrophobicContact CZ-CD2 4.27Å; F212-Y216 HydrophobicContact CZ-CG 4.41Å; F212-Y216 WeakPolarHBondContact O-CB 3Å; F212-Y216 WeakPolarHBondContact O-CD2 3.14Å; F212-Y216 PolarHBondContact O-N 3.04Å; F212-F304 HydrophobicContact CD1-CD1 4.39Å; F212-F304 AromaticContact CD1-CE1 3.57Å; F212-F304 HydrophobicContact CD1-CE1 3.57Å; F212-F304 HydrophobicContact CD1-CZ 4.41Å; F212-F304 AromaticContact CE1-CE1 3.53Å; F212-F304 HydrophobicContact CE1-CE1 3.53Å; F212-F304 AromaticContact CE1-CZ 3.95Å; F212-F304 HydrophobicContact CE1-CZ 3.95Å |
| 213 | A | 94.9 | Very high | 90.9 | Very high | 9 Ų | 9 | 50 Ų | 50 | 7% | 0.074 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -62 | -40.3 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | V209 V210 F217 L218 F304 | V209-A213 WeakPolarHBondContact O-CB 3.41Å; V209-A213 PolarHBondContact O-N 2.87Å; V210-A213 PolarHBondContact O-N 3.17Å; A213-F217 WeakPolarHBondContact O-CA 3.29Å; A213-F217 WeakPolarHBondContact O-CB 3.48Å; A213-F217 PolarHBondContact O-N 3.05Å; A213-L218 PolarHBondContact O-N 2.73Å; A213-F304 HydrophobicContact CB-CD1 3.99Å |
| 214 | V | 95.7 | Very high | 91.3 | Very high | 60 Ų | 60 | 46.6 Ų | 46.6 | 36% | 0.364 | 24% | 0.242 | S | C | . | . | I | π-helix | trans | -64.1 | -49.3 | 177.2 | 170.1 | 0 | 0 | 0 | 0 | 110.9 | V210 V211 F212 L218 L219 | V210-V214 WeakPolarHBondContact O-CG2 3.22Å; V210-V214 PolarHBondContact O-N 2.92Å; V211-V214 PolarHBondContact O-N 3.43Å; F212-V214 PolarHBondContact O-N 3.49Å; V214-L218 PolarHBondContact O-N 2.96Å; V214-L219 HydrophobicContact CG1-CG 4.46Å; V214-L219 WeakPolarHBondContact O-CG 3.41Å; V214-L219 PolarHBondContact O-N 3.48Å |
| 215 | L | 95.5 | Very high | 91.7 | Very high | 71 Ų | 71 | 47.4 Ų | 47.4 | 37% | 0.372 | 25% | 0.248 | S | C | . | . | I | π-helix | trans | -71.9 | -36.2 | -174.3 | -69.1 | 179.5 | 0 | 0 | 0 | 113.5 | V211 F212 L219 P220 | V211-L215 HydrophobicContact CG1-CD1 3.76Å; V211-L215 HydrophobicContact CG1-CG 4.26Å; V211-L215 WeakPolarHBondContact O-CB 3.47Å; V211-L215 VanDerWaalsContact O-CG 3.31Å; V211-L215 WeakPolarHBondContact O-CG 3.44Å; V211-L215 PolarHBondContact O-N 3.47Å; F212-L215 PolarHBondContact O-N 3.34Å; L215-L219 HydrophobicContact CD2-CD1 3.85Å; L215-P220 VanDerWaalsContact O-CD 3.27Å; L215-P220 WeakPolarHBondContact O-CD 3.33Å |
| 216 | Y | 95.5 | Very high | 92.1 | Very high | 6 Ų | 6 | 49.8 Ų | 49.8 | 2% | 0.024 | 26% | 0.262 | C | S | . | . | I | π-helix | trans | -110.4 | -10.6 | -170.5 | -63.8 | -84 | 0 | 0 | 0 | 113.8 | S127 I130 L131 M173 F212 | S127-Y216 VanDerWaalsContact CB-CE1 3.42Å; S127-Y216 WeakPolarHBondContact OG-CE1 3.39Å; I130-Y216 HydrophobicContact CB-CD1 4.28Å; I130-Y216 HydrophobicContact CG2-CD1 4.03Å; I130-Y216 WeakPolarHBondContact CG2-O 3.34Å; L131-Y216 HydrophobicContact CD1-CE1 3.74Å; L131-Y216 HydrophobicContact CD2-CE1 4.13Å; L131-Y216 HydrophobicContact CG-CD1 4.25Å; L131-Y216 HydrophobicContact CG-CE1 3.69Å; M173-Y216 HydrophobicContact CB-CE2 4.41Å; M173-Y216 HydrophobicContact CE-CE2 4.4Å; M173-Y216 HydrophobicContact CG-CE2 3.89Å; M173-Y216 WeakPolarHBondContact CG-OH 3.37Å; F212-Y216 AromaticContact CD2-CD2 3.35Å; F212-Y216 HydrophobicContact CD2-CD2 3.35Å; F212-Y216 AromaticContact CD2-CE2 3.64Å; F212-Y216 HydrophobicContact CD2-CE2 3.64Å; F212-Y216 HydrophobicContact CD2-CG 4.24Å; F212-Y216 AromaticContact CE2-CD2 3.45Å; F212-Y216 HydrophobicContact CE2-CD2 3.45Å; F212-Y216 VanDerWaalsContact CE2-CD2 3.45Å; F212-Y216 AromaticContact CE2-CE2 3.74Å; F212-Y216 HydrophobicContact CE2-CE2 3.74Å; F212-Y216 AromaticContact CE2-CG 3.97Å; F212-Y216 HydrophobicContact CE2-CG 3.97Å; F212-Y216 HydrophobicContact CG-CD2 4.08Å; F212-Y216 HydrophobicContact CZ-CD2 4.27Å; F212-Y216 HydrophobicContact CZ-CG 4.41Å; F212-Y216 WeakPolarHBondContact O-CB 3Å; F212-Y216 WeakPolarHBondContact O-CD2 3.14Å; F212-Y216 PolarHBondContact O-N 3.04Å |
| 217 | F | 94.7 | Very high | 92 | Very high | 28 Ų | 28 | 47.3 Ų | 47.3 | 12% | 0.123 | 25% | 0.251 | C | S | . | . | I | π-helix | trans | -117.5 | -59.6 | 173 | 177.6 | -111.1 | 0 | 0 | 0 | 112.2 | A213 L221 F296 L297 W300 L301 F304 | A213-F217 WeakPolarHBondContact O-CA 3.29Å; A213-F217 WeakPolarHBondContact O-CB 3.48Å; A213-F217 PolarHBondContact O-N 3.05Å; F217-L221 HydrophobicContact CE1-CD2 4.45Å; F217-L221 HydrophobicContact CZ-CD2 4.11Å; F217-L221 WeakPolarHBondContact O-CB 3.42Å; F217-L221 PolarHBondContact O-N 3.3Å; F217-F296 HydrophobicContact CD2-CE1 4.04Å; F217-F296 HydrophobicContact CD2-CZ 4.49Å; F217-F296 HydrophobicContact CE2-CE1 4.36Å; F217-L297 HydrophobicContact CE2-CD2 4.31Å; F217-L297 HydrophobicContact CZ-CD2 4.35Å; F217-W300 HydrophobicContact CD2-CB 4.15Å; F217-W300 HydrophobicContact CE2-CB 4.5Å; F217-L301 HydrophobicContact CE1-CD1 4.05Å; F217-L301 HydrophobicContact CE2-CB 4.11Å; F217-L301 HydrophobicContact CE2-CD1 4.32Å; F217-L301 HydrophobicContact CZ-CB 4.09Å; F217-L301 HydrophobicContact CZ-CD1 3.47Å; F217-L301 VanDerWaalsContact CZ-CD1 3.47Å; F217-L301 HydrophobicContact CZ-CG 4.39Å; F217-F304 HydrophobicContact CB-CB 4.14Å; F217-F304 HydrophobicContact CB-CD1 3.96Å; F217-F304 HydrophobicContact CB-CD2 3.53Å; F217-F304 HydrophobicContact CB-CE1 4.19Å; F217-F304 HydrophobicContact CB-CE2 3.82Å; F217-F304 HydrophobicContact CB-CG 3.61Å; F217-F304 HydrophobicContact CB-CZ 4.14Å; F217-F304 HydrophobicContact CD1-CB 4.29Å; F217-F304 HydrophobicContact CD2-CB 4.48Å; F217-F304 AromaticContact CD2-CD2 3.81Å; F217-F304 HydrophobicContact CD2-CD2 3.81Å; F217-F304 HydrophobicContact CD2-CE2 4.43Å; F217-F304 HydrophobicContact CD2-CG 4.38Å; F217-F304 HydrophobicContact CG-CB 4.05Å; F217-F304 AromaticContact CG-CD2 3.83Å; F217-F304 HydrophobicContact CG-CD2 3.83Å; F217-F304 HydrophobicContact CG-CE2 4.49Å; F217-F304 AromaticContact CG-CG 3.98Å; F217-F304 HydrophobicContact CG-CG 3.98Å |
| 218 | L | 95.3 | Very high | 91.7 | Very high | 80 Ų | 80 | 43.8 Ų | 43.8 | 42% | 0.419 | 23% | 0.23 | S | C | . | . | I | π-helix | trans | -66.8 | -48.3 | -172.6 | -175.5 | 62.4 | 0 | 0 | 0 | 112.8 | A213 V214 L221 I222 | A213-L218 PolarHBondContact O-N 2.73Å; V214-L218 PolarHBondContact O-N 2.96Å; L218-L221 PolarHBondContact O-N 3.48Å; L218-I222 HydrophobicContact CD1-CD1 4.12Å; L218-I222 HydrophobicContact CD1-CG1 4.42Å; L218-I222 HydrophobicContact CG-CD1 3.95Å; L218-I222 VanDerWaalsContact O-CG1 3.3Å; L218-I222 WeakPolarHBondContact O-CG1 3.15Å; L218-I222 PolarHBondContact O-N 2.99Å |
| 219 | L | 94.7 | Very high | 91.5 | Very high | 89 Ų | 89 | 45.8 Ų | 45.8 | 47% | 0.466 | 25% | 0.246 | S | C | . | . | H | α-helix | trans | -64.3 | -48.3 | 179.8 | -71.2 | -178 | 0 | 0 | 0 | 112.6 | V214 L215 L221 I222 L223 | V214-L219 HydrophobicContact CG1-CG 4.46Å; V214-L219 WeakPolarHBondContact O-CG 3.41Å; V214-L219 PolarHBondContact O-N 3.48Å; L215-L219 HydrophobicContact CD2-CD1 3.85Å; L219-L221 VanDerWaalsContact C-N 3.29Å; L219-L221 PolarHBondContact O-N 3.42Å; L219-I222 PolarHBondContact O-N 2.95Å; L219-L223 WeakPolarHBondContact O-CB 3.3Å; L219-L223 PolarHBondContact O-N 3.35Å |
| 220 | P | 93.4 | Very high | 91.1 | Very high | 4 Ų | 4 | 46.6 Ų | 46.6 | 3% | 0.026 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -58.7 | -38.2 | 172.7 | -29.6 | 38.8 | 0 | 0 | 0 | 113.2 | I130 L215 L223 I224 F296 | I130-P220 HydrophobicContact CG2-CB 4.29Å; I130-P220 HydrophobicContact CG2-CG 3.7Å; L215-P220 VanDerWaalsContact O-CD 3.27Å; L215-P220 WeakPolarHBondContact O-CD 3.33Å; P220-L223 WeakPolarHBondContact O-CB 3.14Å; P220-L223 PolarHBondContact O-N 3.22Å; P220-I224 WeakPolarHBondContact O-CB 3.38Å; P220-I224 VanDerWaalsContact O-CG1 3.23Å; P220-I224 WeakPolarHBondContact O-CG1 3.38Å; P220-I224 PolarHBondContact O-N 3.11Å; P220-F296 HydrophobicContact CB-CE1 4.22Å; P220-F296 HydrophobicContact CB-CE2 4.12Å; P220-F296 HydrophobicContact CB-CZ 3.63Å; P220-F296 HydrophobicContact CG-CZ 4.39Å |
| 221 | L | 92.9 | Very high | 90.4 | Very high | 45 Ų | 45 | 45.4 Ų | 45.4 | 24% | 0.236 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -63.3 | -47.5 | 176.9 | 178.5 | 59.9 | 0 | 0 | 0 | 112.1 | F217 L218 L219 L223 I224 F225 F296 L297 | F217-L221 HydrophobicContact CE1-CD2 4.45Å; F217-L221 HydrophobicContact CZ-CD2 4.11Å; F217-L221 WeakPolarHBondContact O-CB 3.42Å; F217-L221 PolarHBondContact O-N 3.3Å; L218-L221 PolarHBondContact O-N 3.48Å; L219-L221 VanDerWaalsContact C-N 3.29Å; L219-L221 PolarHBondContact O-N 3.42Å; L221-L223 VanDerWaalsContact C-N 3.28Å; L221-L223 PolarHBondContact O-N 3.45Å; L221-I224 PolarHBondContact O-N 3.08Å; L221-F225 WeakPolarHBondContact O-CB 3.47Å; L221-F225 PolarHBondContact O-N 2.98Å; L221-F296 HydrophobicContact CB-CE1 4.39Å; L221-L297 HydrophobicContact CD1-CD1 4.09Å; L221-L297 HydrophobicContact CD1-CD2 3.43Å; L221-L297 VanDerWaalsContact CD1-CD2 3.43Å; L221-L297 HydrophobicContact CD1-CG 3.8Å; L221-L297 HydrophobicContact CD2-CD2 3.98Å; L221-L297 HydrophobicContact CG-CD2 4.33Å |
| 222 | I | 92.5 | Very high | 89.6 | Confident | 86 Ų | 86 | 49.3 Ų | 49.3 | 44% | 0.441 | 26% | 0.256 | S | S | . | . | H | α-helix | trans | -60 | -43.2 | 175.9 | -68.6 | 165.8 | 0 | 0 | 0 | 110.1 | L218 L219 F225 V226 | L218-I222 HydrophobicContact CD1-CD1 4.12Å; L218-I222 HydrophobicContact CD1-CG1 4.42Å; L218-I222 HydrophobicContact CG-CD1 3.95Å; L218-I222 VanDerWaalsContact O-CG1 3.3Å; L218-I222 WeakPolarHBondContact O-CG1 3.15Å; L218-I222 PolarHBondContact O-N 2.99Å; L219-I222 PolarHBondContact O-N 2.95Å; I222-F225 PolarHBondContact O-N 2.93Å; I222-V226 HydrophobicContact CG2-CG2 4.36Å; I222-V226 VanDerWaalsContact O-CG2 3.32Å; I222-V226 WeakPolarHBondContact O-CG2 3.48Å; I222-V226 PolarHBondContact O-N 3.18Å |
| 223 | L | 91 | Very high | 89.1 | Confident | 48 Ų | 48 | 58.1 Ų | 58.1 | 25% | 0.251 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -58.9 | -53.6 | 177.6 | -175.4 | 152.1 | 0 | 0 | 0 | 110.9 | N137 V138 L219 P220 L221 F225 V226 V227 | N137-L223 HydrophobicContact CB-CD2 3.38Å; V138-L223 HydrophobicContact CG2-CD1 3.65Å; V138-L223 HydrophobicContact CG2-CD2 4.3Å; V138-L223 HydrophobicContact CG2-CG 4.39Å; L219-L223 WeakPolarHBondContact O-CB 3.3Å; L219-L223 PolarHBondContact O-N 3.35Å; P220-L223 WeakPolarHBondContact O-CB 3.14Å; P220-L223 PolarHBondContact O-N 3.22Å; L221-L223 VanDerWaalsContact C-N 3.28Å; L221-L223 PolarHBondContact O-N 3.45Å; L223-F225 VanDerWaalsContact C-N 3.27Å; L223-F225 PolarHBondContact O-N 3.03Å; L223-V226 PolarHBondContact O-N 3.47Å; L223-V226 VanDerWaalsContact O-N 3.15Å; L223-V227 HydrophobicContact CD2-CG2 4.16Å; L223-V227 VanDerWaalsContact O-CG2 3.3Å; L223-V227 WeakPolarHBondContact O-CG2 3.21Å; L223-V227 PolarHBondContact O-N 2.9Å |
| 224 | I | 88.8 | Confident | 88.2 | Confident | 4 Ų | 4 | 60.9 Ų | 60.9 | 2% | 0.021 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -54.3 | -46.2 | 177.5 | -73.7 | 168.4 | 0 | 0 | 0 | 110.7 | P220 L221 V227 Y228 F296 | P220-I224 WeakPolarHBondContact O-CB 3.38Å; P220-I224 VanDerWaalsContact O-CG1 3.23Å; P220-I224 WeakPolarHBondContact O-CG1 3.38Å; P220-I224 PolarHBondContact O-N 3.11Å; L221-I224 PolarHBondContact O-N 3.08Å; I224-V227 PolarHBondContact O-N 3.27Å; I224-Y228 HydrophobicContact CG2-CD2 3.81Å; I224-Y228 HydrophobicContact CG2-CE2 3.13Å; I224-Y228 WeakPolarHBondContact O-CD2 3.3Å; I224-Y228 PolarHBondContact O-N 2.82Å; I224-F296 HydrophobicContact CD1-CB 3.88Å; I224-F296 HydrophobicContact CD1-CD1 3.81Å; I224-F296 HydrophobicContact CD1-CD2 4.11Å; I224-F296 HydrophobicContact CD1-CE1 4.43Å; I224-F296 HydrophobicContact CD1-CG 3.64Å |
| 225 | F | 89.3 | Confident | 87.1 | Confident | 131 Ų | 131 | 59.6 Ų | 59.6 | 58% | 0.575 | 30% | 0.301 | S | S | * | . | H | α-helix | trans | -59.5 | -48.4 | 177.4 | 179.9 | -100.5 | 0 | 0 | 0 | 112.4 | L221 I222 L223 V227 Y228 C229 | L221-F225 WeakPolarHBondContact O-CB 3.47Å; L221-F225 PolarHBondContact O-N 2.98Å; I222-F225 PolarHBondContact O-N 2.93Å; L223-F225 VanDerWaalsContact C-N 3.27Å; L223-F225 PolarHBondContact O-N 3.03Å; F225-V227 VanDerWaalsContact C-N 3.33Å; F225-V227 PolarHBondContact O-N 2.92Å; F225-Y228 PolarHBondContact O-N 3.48Å; F225-C229 VanDerWaalsContact CE1-SG 3.59Å; F225-C229 WeakPolarHBondContact CZ-SG 3.17Å; F225-C229 PolarHBondContact O-N 3.07Å; F225-C229 PolarHBondContact O-SG 3.45Å; F225-C229 VanDerWaalsContact O-SG 3.36Å |
| 226 | V | 87.8 | Confident | 86.3 | Confident | 68 Ų | 68 | 63.8 Ų | 63.8 | 41% | 0.412 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -60.3 | -42.6 | 177.9 | 169.1 | 0 | 0 | 0 | 0 | 111.4 | I222 L223 Y228 C229 S230 | I222-V226 HydrophobicContact CG2-CG2 4.36Å; I222-V226 VanDerWaalsContact O-CG2 3.32Å; I222-V226 WeakPolarHBondContact O-CG2 3.48Å; I222-V226 PolarHBondContact O-N 3.18Å; L223-V226 PolarHBondContact O-N 3.47Å; L223-V226 VanDerWaalsContact O-N 3.15Å; V226-Y228 VanDerWaalsContact C-N 3.34Å; V226-Y228 PolarHBondContact O-N 3.18Å; V226-C229 PolarHBondContact O-N 3.24Å; V226-S230 VanDerWaalsContact O-CB 3.32Å; V226-S230 WeakPolarHBondContact O-CB 3.49Å; V226-S230 PolarHBondContact O-N 3.42Å; V226-S230 PolarHBondContact O-OG 3.04Å |
| 227 | V | 83.2 | Confident | 85.4 | Confident | 11 Ų | 11 | 67.1 Ų | 67.1 | 7% | 0.067 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -61.8 | -43 | 176.9 | 178.4 | 0 | 0 | 0 | 0 | 110.9 | Y141 L223 I224 F225 S230 M231 | Y141-V227 HydrophobicContact CD2-CG2 4.01Å; Y141-V227 HydrophobicContact CG-CG2 4.18Å; L223-V227 HydrophobicContact CD2-CG2 4.16Å; L223-V227 VanDerWaalsContact O-CG2 3.3Å; L223-V227 WeakPolarHBondContact O-CG2 3.21Å; L223-V227 PolarHBondContact O-N 2.9Å; I224-V227 PolarHBondContact O-N 3.27Å; F225-V227 VanDerWaalsContact C-N 3.33Å; F225-V227 PolarHBondContact O-N 2.92Å; V227-S230 PolarHBondContact O-N 3.1Å; V227-M231 PolarHBondContact O-N 3.25Å |
| 228 | Y | 82 | Confident | 84.3 | Confident | 36 Ų | 36 | 67 Ų | 67 | 14% | 0.141 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -67.3 | -45.2 | 177.4 | -67.2 | -27 | 0 | 0 | 0 | 113.9 | I224 F225 V226 S230 M231 F232 L289 G293 | I224-Y228 HydrophobicContact CG2-CD2 3.81Å; I224-Y228 HydrophobicContact CG2-CE2 3.13Å; I224-Y228 WeakPolarHBondContact O-CD2 3.3Å; I224-Y228 PolarHBondContact O-N 2.82Å; F225-Y228 PolarHBondContact O-N 3.48Å; V226-Y228 VanDerWaalsContact C-N 3.34Å; V226-Y228 PolarHBondContact O-N 3.18Å; Y228-S230 VanDerWaalsContact C-N 3.25Å; Y228-S230 PolarHBondContact O-N 2.82Å; Y228-M231 PolarHBondContact O-N 3.45Å; Y228-F232 WeakPolarHBondContact O-CB 3.49Å; Y228-F232 PolarHBondContact O-N 2.95Å; Y228-L289 HydrophobicContact CD1-CB 4.11Å; Y228-L289 HydrophobicContact CE1-CB 3.63Å; Y228-L289 HydrophobicContact CE1-CD2 4.16Å; Y228-L289 HydrophobicContact CE1-CG 4.46Å; Y228-L289 VanDerWaalsContact CE1-O 3.25Å; Y228-L289 WeakPolarHBondContact CE1-O 3.42Å; Y228-L289 PolarHBondContact OH-O 3.49Å; Y228-G293 WeakPolarHBondContact OH-CA 3.49Å; Y228-G293 PolarHBondContact OH-N 2.86Å |
| 229 | C | 83.9 | Confident | 83.2 | Confident | 61 Ų | 61 | 66.4 Ų | 66.4 | 41% | 0.412 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -57.7 | -44.1 | 175.7 | -69.6 | 0 | 0 | 0 | 0 | 110.8 | F225 V226 F232 R233 | F225-C229 VanDerWaalsContact CE1-SG 3.59Å; F225-C229 WeakPolarHBondContact CZ-SG 3.17Å; F225-C229 PolarHBondContact O-N 3.07Å; F225-C229 PolarHBondContact O-SG 3.45Å; F225-C229 VanDerWaalsContact O-SG 3.36Å; V226-C229 PolarHBondContact O-N 3.24Å; C229-F232 PolarHBondContact O-N 3.1Å; C229-R233 WeakPolarHBondContact O-CB 3.26Å; C229-R233 PolarHBondContact O-N 3.46Å |
| 230 | S | 81.9 | Confident | 82.1 | Confident | 28 Ų | 28 | 68.7 Ų | 68.7 | 20% | 0.196 | 35% | 0.353 | C | S | . | . | H | α-helix | trans | -62.7 | -45.2 | 178.7 | -58 | 0 | 0 | 0 | 0 | 111.5 | V226 V227 Y228 R233 V234 | V226-S230 VanDerWaalsContact O-CB 3.32Å; V226-S230 WeakPolarHBondContact O-CB 3.49Å; V226-S230 PolarHBondContact O-N 3.42Å; V226-S230 PolarHBondContact O-OG 3.04Å; V227-S230 PolarHBondContact O-N 3.1Å; Y228-S230 VanDerWaalsContact C-N 3.25Å; Y228-S230 PolarHBondContact O-N 2.82Å; S230-R233 PolarHBondContact O-N 3.1Å; S230-V234 WeakPolarHBondContact O-CG2 3.45Å; S230-V234 PolarHBondContact O-N 3.45Å; S230-V234 VanDerWaalsContact O-N 3.07Å |
| 231 | M | 76.8 | Confident | 80.8 | Confident | 26 Ų | 26 | 76.1 Ų | 76.1 | 13% | 0.128 | 39% | 0.387 | C | S | . | . | H | α-helix | trans | -67.4 | -44.2 | 178.2 | -175.5 | -179.6 | 79 | 0 | 0 | 112.5 | V144 V227 Y228 R233 V234 A235 A286 L289 | V144-M231 HydrophobicContact CG1-CB 4.12Å; V144-M231 HydrophobicContact CG1-CG 3.86Å; V227-M231 PolarHBondContact O-N 3.25Å; Y228-M231 PolarHBondContact O-N 3.45Å; M231-R233 PolarHBondContact O-N 2.93Å; M231-V234 PolarHBondContact O-N 3.38Å; M231-V234 VanDerWaalsContact O-N 3.15Å; M231-A235 WeakPolarHBondContact O-CB 3.49Å; M231-A235 PolarHBondContact O-N 3.12Å; M231-A286 VanDerWaalsContact CE-CA 3.48Å; M231-A286 HydrophobicContact CE-CB 3.8Å; M231-L289 HydrophobicContact CE-CB 3.98Å; M231-L289 HydrophobicContact CE-CD1 3.42Å; M231-L289 VanDerWaalsContact CE-CD1 3.42Å; M231-L289 HydrophobicContact CE-CG 4.33Å; M231-L289 HydrophobicContact SD-CD1 3.05Å; M231-L289 WeakPolarHBondContact SD-CD1 3.49Å; M231-L289 HydrophobicContact SD-CG 4.41Å |
| 232 | F | 78.2 | Confident | 78.9 | Confident | 141 Ų | 141 | 81.2 Ų | 81.2 | 62% | 0.618 | 41% | 0.41 | S | S | * | . | H | α-helix | trans | -58.8 | -40.2 | 177.9 | -178.8 | -99.4 | 0 | 0 | 0 | 110.8 | Y228 C229 A235 R236 | Y228-F232 WeakPolarHBondContact O-CB 3.49Å; Y228-F232 PolarHBondContact O-N 2.95Å; C229-F232 PolarHBondContact O-N 3.1Å; F232-A235 PolarHBondContact O-N 2.94Å; F232-R236 VanDerWaalsContact O-CB 3.28Å; F232-R236 WeakPolarHBondContact O-CB 3.41Å; F232-R236 PolarHBondContact O-N 3.3Å |
| 233 | R | 82.4 | Confident | 77 | Confident | 189 Ų | 189 | 79.1 Ų | 79.1 | 71% | 0.713 | 41% | 0.41 | S | S | * | . | H | α-helix | trans | -59.9 | -49.8 | 174 | -174.2 | -177.5 | 176.6 | -172.8 | -0.2 | 111.7 | C229 S230 M231 R236 V237 | C229-R233 WeakPolarHBondContact O-CB 3.26Å; C229-R233 PolarHBondContact O-N 3.46Å; S230-R233 PolarHBondContact O-N 3.1Å; M231-R233 PolarHBondContact O-N 2.93Å; R233-R236 PolarHBondContact O-N 3.28Å; R233-V237 VanDerWaalsContact O-CG2 3.3Å; R233-V237 WeakPolarHBondContact O-CG2 3.5Å; R233-V237 PolarHBondContact O-N 3.48Å |
| 234 | V | 77.8 | Confident | 75.1 | Confident | 66 Ų | 66 | 83.1 Ų | 83.1 | 40% | 0.4 | 44% | 0.438 | S | S | . | . | H | α-helix | trans | -61.6 | -45.5 | 179.3 | 173 | 0 | 0 | 0 | 0 | 111.2 | S230 M231 R236 V237 A238 | S230-V234 WeakPolarHBondContact O-CG2 3.45Å; S230-V234 PolarHBondContact O-N 3.45Å; S230-V234 VanDerWaalsContact O-N 3.07Å; M231-V234 PolarHBondContact O-N 3.38Å; M231-V234 VanDerWaalsContact O-N 3.15Å; V234-R236 PolarHBondContact O-N 3.48Å; V234-V237 PolarHBondContact O-N 3.04Å; V234-A238 WeakPolarHBondContact O-CB 3.25Å; V234-A238 PolarHBondContact O-N 3.46Å |
| 235 | A | 72.1 | Confident | 73.2 | Confident | 34 Ų | 34 | 89.3 Ų | 89.3 | 28% | 0.281 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -62.2 | -41.9 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | M231 F232 A238 A239 | M231-A235 WeakPolarHBondContact O-CB 3.49Å; M231-A235 PolarHBondContact O-N 3.12Å; F232-A235 PolarHBondContact O-N 2.94Å; A235-A238 PolarHBondContact O-N 3.39Å; A235-A239 WeakPolarHBondContact O-CB 3.16Å; A235-A239 PolarHBondContact O-N 3.42Å |
| 236 | R | 77.9 | Confident | 71.2 | Confident | 159 Ų | 159 | 87.4 Ų | 87.4 | 60% | 0.6 | 47% | 0.471 | S | S | * | . | H | α-helix | trans | -65.2 | -44.6 | 176.6 | -171.5 | -177.6 | -177 | -168.4 | 2.4 | 111.5 | F232 R233 V234 A238 A239 M240 | F232-R236 VanDerWaalsContact O-CB 3.28Å; F232-R236 WeakPolarHBondContact O-CB 3.41Å; F232-R236 PolarHBondContact O-N 3.3Å; R233-R236 PolarHBondContact O-N 3.28Å; V234-R236 PolarHBondContact O-N 3.48Å; R236-A238 VanDerWaalsContact C-N 3.34Å; R236-A238 PolarHBondContact O-N 3.02Å; R236-A239 PolarHBondContact O-N 3.39Å; R236-M240 HydrophobicContact CG-CG 4.36Å; R236-M240 WeakPolarHBondContact O-CG 3.2Å; R236-M240 PolarHBondContact O-N 2.94Å |
| 237 | V | 77.8 | Confident | 69.5 | Low | 76 Ų | 76 | 90.1 Ų | 90.1 | 46% | 0.461 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -61.4 | -44.2 | 177.4 | 171.8 | 0 | 0 | 0 | 0 | 110.8 | R233 V234 A239 M240 Q241 | R233-V237 VanDerWaalsContact O-CG2 3.3Å; R233-V237 WeakPolarHBondContact O-CG2 3.5Å; R233-V237 PolarHBondContact O-N 3.48Å; V234-V237 PolarHBondContact O-N 3.04Å; V237-A239 VanDerWaalsContact C-N 3.32Å; V237-A239 PolarHBondContact O-N 2.93Å; V237-M240 PolarHBondContact O-N 2.99Å; V237-Q241 WeakPolarHBondContact O-CG 3.28Å; V237-Q241 PolarHBondContact O-N 3.28Å |
| 238 | A | 70.6 | Confident | 68.1 | Low | 26 Ų | 26 | 100.8 Ų | 100.8 | 22% | 0.215 | 53% | 0.528 | C | S | . | . | H | α-helix | trans | -63.6 | -36 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.9 | V234 A235 R236 H242 | V234-A238 WeakPolarHBondContact O-CB 3.25Å; V234-A238 PolarHBondContact O-N 3.46Å; A235-A238 PolarHBondContact O-N 3.39Å; R236-A238 VanDerWaalsContact C-N 3.34Å; R236-A238 PolarHBondContact O-N 3.02Å; A238-H242 PolarHBondContact O-ND1 3.27Å |
| 239 | A | 71.4 | Confident | 66.2 | Low | 66 Ų | 66 | 106.4 Ų | 106.4 | 55% | 0.545 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -69.7 | -38.5 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112.4 | A235 R236 V237 Q241 H242 | A235-A239 WeakPolarHBondContact O-CB 3.16Å; A235-A239 PolarHBondContact O-N 3.42Å; R236-A239 PolarHBondContact O-N 3.39Å; V237-A239 VanDerWaalsContact C-N 3.32Å; V237-A239 PolarHBondContact O-N 2.93Å; A239-Q241 VanDerWaalsContact C-N 3.34Å; A239-H242 PolarHBondContact O-N 3.17Å |
| 240 | M | 72.8 | Confident | 64.2 | Low | 138 Ų | 138 | 111.9 Ų | 111.9 | 68% | 0.68 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -71.1 | -28.7 | 178 | -64.9 | -69.4 | -84.6 | 0 | 0 | 112.5 | R236 V237 H242 G243 | R236-M240 HydrophobicContact CG-CG 4.36Å; R236-M240 WeakPolarHBondContact O-CG 3.2Å; R236-M240 PolarHBondContact O-N 2.94Å; V237-M240 PolarHBondContact O-N 2.99Å; M240-H242 PolarHBondContact O-N 2.89Å; M240-G243 PolarHBondContact O-N 3.01Å |
| 241 | Q | 65 | Low | 62.4 | Low | 159 Ų | 159 | 115.7 Ų | 115.7 | 74% | 0.743 | 60% | 0.599 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -69.8 | -17.8 | 173.6 | -75.3 | -177.4 | -10.2 | 0 | 0 | 113.7 | V237 A239 G243 | V237-Q241 WeakPolarHBondContact O-CG 3.28Å; V237-Q241 PolarHBondContact O-N 3.28Å; A239-Q241 VanDerWaalsContact C-N 3.34Å; Q241-G243 VanDerWaalsContact C-N 3.34Å |
| 242 | H | 54.1 | Low | 60.8 | Low | 152 Ų | 152 | 120.2 Ų | 120.2 | 70% | 0.704 | 63% | 0.63 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -97.4 | 27.2 | 171.9 | -67.2 | 79.8 | 0 | 0 | 0 | 112.3 | A238 A239 M240 | A238-H242 PolarHBondContact O-ND1 3.27Å; A239-H242 PolarHBondContact O-N 3.17Å; M240-H242 PolarHBondContact O-N 2.89Å |
| 243 | G | 51.7 | Low | 59 | Low | 43 Ų | 43 | 124.8 Ų | 124.8 | 44% | 0.443 | 64% | 0.643 | S | S | . | * | trans | -54.1 | 156 | 170.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | M240 Q241 L245 | M240-G243 PolarHBondContact O-N 3.01Å; Q241-G243 VanDerWaalsContact C-N 3.34Å; G243-L245 PolarHBondContact O-N 2.91Å | ||
| 244 | P | 51.1 | Low | 57.1 | Low | 131 Ų | 131 | 124.7 Ų | 124.7 | 85% | 0.851 | 65% | 0.651 | S | S | * | * | trans | -54.6 | 130.8 | -172.8 | 22.4 | -31.1 | 0 | 0 | 0 | 110.4 | ||||
| 245 | L | 50.1 | Low | 55.4 | Low | 135 Ų | 135 | 131.7 Ų | 131.7 | 71% | 0.707 | 67% | 0.67 | S | S | * | * | trans | -45.2 | 128.8 | 178.9 | -159.5 | 83.7 | 0 | 0 | 0 | 109.5 | G243 T247 | G243-L245 PolarHBondContact O-N 2.91Å; L245-T247 PolarHBondContact O-N 3.13Å | ||
| 246 | P | 46.7 | Very low | 53.9 | Low | 90 Ų | 90 | 135.9 Ų | 135.9 | 58% | 0.584 | 70% | 0.697 | S | S | * | * | trans | -59.8 | 128.1 | 175.9 | 22.1 | -29.7 | 0 | 0 | 0 | 108.9 | W248 M249 | P246-W248 PolarHBondContact O-N 2.63Å; P246-M249 PolarHBondContact O-N 3.04Å | ||
| 247 | T | 51.2 | Low | 52 | Low | 126 Ų | 126 | 136 Ų | 136 | 77% | 0.773 | 71% | 0.705 | S | S | * | * | G | 310 helix | trans | -59.9 | 0.4 | -173.6 | -29.6 | 0 | 0 | 0 | 0 | 114.4 | L245 | L245-T247 PolarHBondContact O-N 3.13Š|
| 248 | W | 54.2 | Low | 50.3 | Low | 235 Ų | 235 | 137.5 Ų | 137.5 | 89% | 0.89 | 72% | 0.719 | S | S | * | * | G | 310 helix | trans | -94.7 | 1.9 | -176.8 | -60.6 | 103.2 | 0 | 0 | 0 | 114.2 | P246 E250 | P246-W248 PolarHBondContact O-N 2.63Å; W248-E250 VanDerWaalsContact C-N 3.33Å |
| 249 | M | 43.2 | Very low | 49.3 | Very low | 154 Ų | 154 | 145.1 Ų | 145.1 | 76% | 0.759 | 76% | 0.755 | S | S | * | * | G | 310 helix | trans | -93.9 | 15.3 | 174.8 | -135.2 | 172.2 | -136.8 | 0 | 0 | 113.6 | P246 T251 | P246-M249 PolarHBondContact O-N 3.04Å; M249-T251 VanDerWaalsContact C-N 3.32Å; M249-T251 PolarHBondContact O-N 3.37Å |
| 250 | E | 41.6 | Very low | 47.9 | Very low | 175 Ų | 175 | 147 Ų | 147 | 82% | 0.818 | 76% | 0.764 | S | S | * | * | trans | -91.2 | 59.9 | 166 | -78.8 | -93.6 | 169 | 0 | 0 | 109.5 | W248 | W248-E250 VanDerWaalsContact C-N 3.33Š| ||
| 251 | T | 43.8 | Very low | 46.3 | Very low | 108 Ų | 108 | 146 Ų | 146 | 66% | 0.663 | 77% | 0.771 | S | S | * | * | trans | -115 | 112.9 | 160.3 | 52.7 | 0 | 0 | 0 | 0 | 107.3 | M249 R253 | M249-T251 VanDerWaalsContact C-N 3.32Å; M249-T251 PolarHBondContact O-N 3.37Å; T251-R253 PolarHBondContact O-N 3.05Å | ||
| 252 | P | 43.5 | Very low | 45.4 | Very low | 121 Ų | 121 | 150.2 Ų | 150.2 | 79% | 0.786 | 78% | 0.78 | S | S | * | * | trans | -65.8 | 110 | 177 | 26.1 | -29.5 | 0 | 0 | 0 | 107.5 | Q254 | P252-Q254 VanDerWaalsContact C-N 3.32Å; P252-Q254 PolarHBondContact O-N 2.84Å | ||
| 253 | R | 40.8 | Very low | 44.6 | Very low | 237 Ų | 237 | 148.1 Ų | 148.1 | 89% | 0.894 | 78% | 0.782 | S | S | * | * | trans | -62 | 101.3 | 161.1 | -82.3 | -179.9 | 171.4 | 160.5 | -2.6 | 106.3 | T251 R255 | T251-R253 PolarHBondContact O-N 3.05Å; R253-R255 VanDerWaalsContact C-N 3.25Å; R253-R255 PolarHBondContact O-N 3.32Å | ||
| 254 | Q | 42.6 | Very low | 43.9 | Very low | 187 Ų | 187 | 151.8 Ų | 151.8 | 87% | 0.874 | 80% | 0.796 | S | S | * | * | trans | -58.2 | 94.3 | 163.8 | -95.5 | -172.5 | -37.2 | 0 | 0 | 107.8 | P252 | P252-Q254 VanDerWaalsContact C-N 3.32Å; P252-Q254 PolarHBondContact O-N 2.84Å | ||
| 255 | R | 41.2 | Very low | 43.5 | Very low | 214 Ų | 214 | 154.5 Ų | 154.5 | 81% | 0.808 | 80% | 0.8 | S | S | * | * | trans | -84.9 | 112.7 | 161 | -167.3 | 176.8 | -174 | 120 | 0.3 | 105.3 | R253 E257 | R253-R255 VanDerWaalsContact C-N 3.25Å; R253-R255 PolarHBondContact O-N 3.32Å; R255-E257 PolarHBondContact O-N 3.24Å | ||
| 256 | S | 40.8 | Very low | 42.8 | Very low | 121 Ų | 121 | 154 Ų | 154 | 85% | 0.846 | 80% | 0.802 | S | S | * | * | trans | -60.1 | 99.6 | 178.1 | -45 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 257 | E | 38.8 | Very low | 42.8 | Very low | 162 Ų | 162 | 156.4 Ų | 156.4 | 76% | 0.757 | 82% | 0.815 | S | S | * | * | trans | -81.4 | 114.5 | 168.1 | -76.5 | -78.1 | 148.8 | 0 | 0 | 107.8 | R255 L259 | R255-E257 PolarHBondContact O-N 3.24Å; E257-L259 PolarHBondContact O-N 3.46Å | ||
| 258 | S | 41.9 | Very low | 42.2 | Very low | 108 Ų | 108 | 155.6 Ų | 155.6 | 76% | 0.755 | 82% | 0.815 | S | S | * | * | trans | -62.3 | 128.5 | 173.6 | 45.4 | 0 | 0 | 0 | 0 | 110.8 | S260 | S258-S260 PolarHBondContact O-N 2.84Å; S258-S260 VanDerWaalsContact O-N 3.09Å | ||
| 259 | L | 49.3 | Very low | 41.4 | Very low | 185 Ų | 185 | 150 Ų | 150 | 97% | 0.969 | 81% | 0.811 | S | S | * | * | trans | -61.2 | 102 | 176.5 | -70.6 | 159 | 0 | 0 | 0 | 111.5 | E257 | E257-L259 PolarHBondContact O-N 3.46Š| ||
| 260 | S | 41.1 | Very low | 41.5 | Very low | 105 Ų | 105 | 146.8 Ų | 146.8 | 73% | 0.734 | 82% | 0.817 | S | S | * | * | trans | -152.7 | 122 | 156.3 | 171.2 | 0 | 0 | 0 | 0 | 109.1 | S258 | S258-S260 PolarHBondContact O-N 2.84Å; S258-S260 VanDerWaalsContact O-N 3.09Å | ||
| 261 | S | 40.1 | Very low | 41 | Very low | 118 Ų | 118 | 142.8 Ų | 142.8 | 83% | 0.825 | 81% | 0.814 | S | S | * | * | trans | 84.6 | 72.1 | 167.2 | -47 | 0 | 0 | 0 | 0 | 116.5 | ||||
| 262 | R | 46.2 | Very low | 40.8 | Very low | 247 Ų | 247 | 146.2 Ų | 146.2 | 93% | 0.932 | 82% | 0.823 | S | S | * | * | trans | -89.5 | 104 | 159.3 | -167 | -175.6 | -172.8 | -174.8 | 1.9 | 108.7 | ||||
| 263 | S | 35.9 | Very low | 40.4 | Very low | 108 Ų | 108 | 149.1 Ų | 149.1 | 76% | 0.755 | 83% | 0.826 | S | S | * | * | trans | 177.4 | 110.7 | 153.5 | -165.2 | 0 | 0 | 0 | 0 | 106.5 | ||||
| 264 | T | 38.2 | Very low | 40.3 | Very low | 121 Ų | 121 | 143.5 Ų | 143.5 | 74% | 0.742 | 82% | 0.818 | S | S | * | * | -152.1 | 134.2 | 61.4 | 35.2 | 0 | 0 | 0 | 0 | 110 | V266 | T264-V266 PolarHBondContact O-N 3.17Š| |||
| 265 | M | 42.3 | Very low | 39.9 | Very low | 188 Ų | 188 | 140 Ų | 140 | 93% | 0.926 | 81% | 0.81 | S | S | * | * | trans | -70.8 | 119.4 | 161.6 | -77 | -176.6 | -74.1 | 0 | 0 | 108.3 | ||||
| 266 | V | 35.9 | Very low | 39.8 | Very low | 125 Ų | 125 | 135.3 Ų | 135.3 | 76% | 0.758 | 81% | 0.806 | S | S | * | * | trans | -125.3 | 113.3 | 147.9 | 179.7 | 0 | 0 | 0 | 0 | 106.5 | T264 S268 | T264-V266 PolarHBondContact O-N 3.17Å; V266-S268 PolarHBondContact O-N 2.89Å; V266-S268 VanDerWaalsContact O-N 3.16Å | ||
| 267 | T | 46.3 | Very low | 39.6 | Very low | 140 Ų | 140 | 137.3 Ų | 137.3 | 86% | 0.859 | 80% | 0.802 | S | S | * | * | trans | -50.4 | 109.5 | 163 | 36.2 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 268 | S | 37.9 | Very low | 39.6 | Very low | 109 Ų | 109 | 140.7 Ų | 140.7 | 76% | 0.762 | 81% | 0.808 | S | S | * | * | trans | -128.6 | 108.2 | 147 | 65.4 | 0 | 0 | 0 | 0 | 109 | V266 | V266-S268 PolarHBondContact O-N 2.89Å; V266-S268 VanDerWaalsContact O-N 3.16Å | ||
| 269 | S | 37.2 | Very low | 39.4 | Very low | 117 Ų | 117 | 140.9 Ų | 140.9 | 82% | 0.818 | 81% | 0.805 | S | S | * | * | trans | -7.9 | 137.7 | 155.2 | -47.3 | 0 | 0 | 0 | 0 | 116.6 | A271 | S269-A271 PolarHBondContact O-N 3.42Š| ||
| 270 | G | 45.3 | Very low | 39.1 | Very low | 86 Ų | 86 | 139.2 Ų | 139.2 | 89% | 0.887 | 79% | 0.79 | S | S | * | * | trans | -41.7 | 117.5 | -177.6 | 0 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 271 | A | 33 | Very low | 39.4 | Very low | 91 Ų | 91 | 136.6 Ų | 136.6 | 75% | 0.752 | 78% | 0.779 | S | S | * | * | trans | -103.4 | 97.6 | 146.7 | 0 | 0 | 0 | 0 | 0 | 105.7 | S269 Q273 | S269-A271 PolarHBondContact O-N 3.42Å; A271-Q273 PolarHBondContact O-N 2.99Å | ||
| 272 | H | 38.1 | Very low | 39.9 | Very low | 180 Ų | 180 | 132 Ų | 132 | 83% | 0.833 | 75% | 0.75 | S | S | * | * | trans | -51.2 | 103.5 | 149.7 | -82.6 | -42.1 | 0 | 0 | 0 | 105.7 | T274 | H272-T274 PolarHBondContact O-N 3.24Š| ||
| 273 | Q | 34.7 | Very low | 40.4 | Very low | 183 Ų | 183 | 122.6 Ų | 122.6 | 86% | 0.855 | 73% | 0.731 | S | S | * | * | trans | -65.8 | 80.7 | 160.4 | -117.3 | 172.2 | 54.2 | 0 | 0 | 105.1 | A271 T275 | A271-Q273 PolarHBondContact O-N 2.99Å; Q273-T275 PolarHBondContact O-N 2.91Å | ||
| 274 | T | 39.3 | Very low | 41.8 | Very low | 119 Ų | 119 | 125.6 Ų | 125.6 | 73% | 0.73 | 73% | 0.73 | S | S | * | * | trans | -58.3 | 96.3 | 154 | 51 | 0 | 0 | 0 | 0 | 104.1 | H272 | H272-T274 PolarHBondContact O-N 3.24Š| ||
| 275 | T | 34.4 | Very low | 42.9 | Very low | 114 Ų | 114 | 122.2 Ų | 122.2 | 70% | 0.699 | 72% | 0.715 | S | S | * | * | trans | -40.6 | 130.8 | 156.9 | 39.2 | 0 | 0 | 0 | 0 | 106.4 | Q273 H277 | Q273-T275 PolarHBondContact O-N 2.91Å; T275-H277 PolarHBondContact O-N 3.26Å | ||
| 276 | P | 38.3 | Very low | 44 | Very low | 114 Ų | 114 | 114.5 Ų | 114.5 | 74% | 0.74 | 68% | 0.681 | S | S | * | * | trans | -58.8 | 110.7 | -178.1 | 23.2 | -29.8 | 0 | 0 | 0 | 105.6 | R278 | P276-R278 PolarHBondContact O-N 3.48Š| ||
| 277 | H | 36.9 | Very low | 45.6 | Very low | 163 Ų | 163 | 113.1 Ų | 113.1 | 76% | 0.755 | 67% | 0.672 | S | S | * | * | trans | -56 | 94.3 | 172.4 | -159.7 | -65.8 | 0 | 0 | 0 | 104.3 | T275 T279 | T275-H277 PolarHBondContact O-N 3.26Å; H277-T279 PolarHBondContact O-N 2.94Å | ||
| 278 | R | 39.3 | Very low | 46.8 | Very low | 233 Ų | 233 | 108.4 Ų | 108.4 | 88% | 0.879 | 64% | 0.643 | S | S | * | * | trans | -66.5 | 80.6 | 167.1 | -86.5 | -177.2 | 174.7 | 161.1 | -0.7 | 103.9 | P276 F280 | P276-R278 PolarHBondContact O-N 3.48Å; R278-F280 VanDerWaalsContact C-N 3.28Å; R278-F280 PolarHBondContact O-N 2.96Å | ||
| 279 | T | 37.9 | Very low | 48.3 | Very low | 112 Ų | 112 | 104.5 Ų | 104.5 | 69% | 0.687 | 61% | 0.614 | S | S | * | * | trans | -49.6 | 106.1 | 160.5 | 35.7 | 0 | 0 | 0 | 0 | 104.8 | H277 G281 | H277-T279 PolarHBondContact O-N 2.94Å; T279-G281 PolarHBondContact O-N 3.45Å | ||
| 280 | F | 43.2 | Very low | 50.1 | Low | 150 Ų | 150 | 104.6 Ų | 104.6 | 66% | 0.658 | 60% | 0.604 | S | S | * | * | trans | -50.5 | 118.5 | -173.1 | -169.2 | -103.4 | 0 | 0 | 0 | 107.6 | R278 G282 | R278-F280 VanDerWaalsContact C-N 3.28Å; R278-F280 PolarHBondContact O-N 2.96Å; F280-G282 PolarHBondContact O-N 2.97Å | ||
| 281 | G | 47.6 | Very low | 51.8 | Low | 50 Ų | 50 | 102.1 Ų | 102.1 | 52% | 0.515 | 58% | 0.575 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -61.3 | 3.8 | -179.5 | 0 | 0 | 0 | 0 | 0 | 114.3 | T279 G283 K284 A285 | T279-G281 PolarHBondContact O-N 3.45Å; G281-G283 VanDerWaalsContact C-N 3.31Å; G281-G283 PolarHBondContact O-N 3.12Å; G281-K284 PolarHBondContact O-N 3.21Å; G281-A285 PolarHBondContact O-N 2.86Å |
| 282 | G | 50.8 | Low | 54.2 | Low | 21 Ų | 21 | 98.2 Ų | 98.2 | 22% | 0.216 | 54% | 0.542 | C | S | . | . | H | α-helix | trans | -59.9 | -33.1 | 177.6 | 0 | 0 | 0 | 0 | 0 | 114 | F280 K284 A285 A286 | F280-G282 PolarHBondContact O-N 2.97Å; G282-K284 PolarHBondContact O-N 2.92Å; G282-A285 PolarHBondContact O-N 3.5Å; G282-A286 VanDerWaalsContact O-CB 3.31Å; G282-A286 WeakPolarHBondContact O-CB 3.34Å; G282-A286 PolarHBondContact O-N 3.48Å |
| 283 | G | 56.9 | Low | 56.4 | Low | 50 Ų | 50 | 89.8 Ų | 89.8 | 52% | 0.515 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -64 | -40.2 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | G281 A286 V287 | G281-G283 VanDerWaalsContact C-N 3.31Å; G281-G283 PolarHBondContact O-N 3.12Å; G283-A286 PolarHBondContact O-N 2.71Å; G283-V287 VanDerWaalsContact O-CG2 3.26Å; G283-V287 WeakPolarHBondContact O-CG2 3.3Å; G283-V287 PolarHBondContact O-N 2.98Å |
| 284 | K | 63.6 | Low | 58.9 | Low | 172 Ų | 172 | 82.4 Ų | 82.4 | 75% | 0.748 | 48% | 0.477 | S | S | * | . | H | α-helix | trans | -71.3 | -40.1 | 179.3 | -63.7 | -178.9 | -179.5 | 178.6 | 0 | 111.7 | G281 G282 A286 V287 V288 | G281-K284 PolarHBondContact O-N 3.21Å; G282-K284 PolarHBondContact O-N 2.92Å; K284-A286 VanDerWaalsContact C-N 3.35Å; K284-V287 PolarHBondContact O-N 3.35Å; K284-V288 WeakPolarHBondContact O-CG2 3.42Å; K284-V288 PolarHBondContact O-N 3.5Å |
| 285 | A | 62.5 | Low | 61.4 | Low | 50 Ų | 50 | 77.6 Ų | 77.6 | 41% | 0.413 | 45% | 0.447 | S | S | . | . | H | α-helix | trans | -64.9 | -39.1 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112 | G281 G282 V288 L289 | G281-A285 PolarHBondContact O-N 2.86Å; G282-A285 PolarHBondContact O-N 3.5Å; A285-V288 PolarHBondContact O-N 3.47Å; A285-L289 WeakPolarHBondContact O-CB 3.46Å; A285-L289 WeakPolarHBondContact O-CG 3.15Å; A285-L289 PolarHBondContact O-N 3.04Å; A285-L289 VanDerWaalsContact O-N 3.08Å |
| 286 | A | 65.3 | Low | 64.1 | Low | 26 Ų | 26 | 72.5 Ų | 72.5 | 22% | 0.215 | 42% | 0.415 | C | S | . | . | H | α-helix | trans | -64.6 | -40.6 | 174.8 | 0 | 0 | 0 | 0 | 0 | 113.1 | M231 G282 G283 K284 L289 L290 | M231-A286 VanDerWaalsContact CE-CA 3.48Å; M231-A286 HydrophobicContact CE-CB 3.8Å; G282-A286 VanDerWaalsContact O-CB 3.31Å; G282-A286 WeakPolarHBondContact O-CB 3.34Å; G282-A286 PolarHBondContact O-N 3.48Å; G283-A286 PolarHBondContact O-N 2.71Å; K284-A286 VanDerWaalsContact C-N 3.35Å; A286-L289 PolarHBondContact O-N 2.92Å; A286-L290 WeakPolarHBondContact O-CG 3.28Å; A286-L290 PolarHBondContact O-N 3.3Å |
| 287 | V | 69.9 | Low | 66.7 | Low | 96 Ų | 96 | 70 Ų | 70 | 58% | 0.582 | 40% | 0.395 | S | S | * | . | H | α-helix | trans | -63.2 | -45.6 | 174.8 | 169.2 | 0 | 0 | 0 | 0 | 111.5 | G283 K284 L289 L290 A291 | G283-V287 VanDerWaalsContact O-CG2 3.26Å; G283-V287 WeakPolarHBondContact O-CG2 3.3Å; G283-V287 PolarHBondContact O-N 2.98Å; K284-V287 PolarHBondContact O-N 3.35Å; V287-L289 PolarHBondContact O-N 3.39Å; V287-L290 PolarHBondContact O-N 2.84Å; V287-A291 VanDerWaalsContact O-CB 3.28Å; V287-A291 WeakPolarHBondContact O-CB 3.36Å; V287-A291 PolarHBondContact O-N 2.87Å |
| 288 | V | 70.6 | Confident | 69.4 | Low | 41 Ų | 41 | 68.1 Ų | 68.1 | 25% | 0.248 | 39% | 0.39 | C | S | . | . | H | α-helix | trans | -59.2 | -40.4 | 177.2 | 169.6 | 0 | 0 | 0 | 0 | 111 | K284 A285 A291 V292 L344 | K284-V288 WeakPolarHBondContact O-CG2 3.42Å; K284-V288 PolarHBondContact O-N 3.5Å; A285-V288 PolarHBondContact O-N 3.47Å; V288-A291 WeakPolarHBondContact O-CB 3.46Å; V288-A291 PolarHBondContact O-N 3.36Å; V288-V292 VanDerWaalsContact O-CG2 3.3Å; V288-V292 WeakPolarHBondContact O-CG2 3.36Å; V288-V292 PolarHBondContact O-N 3.21Å; V288-L344 HydrophobicContact CB-CB 4.47Å; V288-L344 HydrophobicContact CB-CD1 4.44Å; V288-L344 HydrophobicContact CG1-CB 3.69Å; V288-L344 HydrophobicContact CG1-CD1 3.96Å; V288-L344 HydrophobicContact CG1-CG 4.46Å; V288-L344 HydrophobicContact CG2-CB 3.94Å; V288-L344 HydrophobicContact CG2-CD1 4.23Å; V288-L344 HydrophobicContact CG2-CD2 4.45Å; V288-L344 HydrophobicContact CG2-CG 4.44Å |
| 289 | L | 70.1 | Confident | 72 | Confident | 27 Ų | 27 | 57.1 Ų | 57.1 | 14% | 0.141 | 35% | 0.348 | C | S | . | . | H | α-helix | trans | -70.8 | -45.5 | 179.3 | -78.9 | 166.7 | 0 | 0 | 0 | 112 | Y228 M231 A285 A286 V287 A291 V292 G293 | Y228-L289 HydrophobicContact CD1-CB 4.11Å; Y228-L289 HydrophobicContact CE1-CB 3.63Å; Y228-L289 HydrophobicContact CE1-CD2 4.16Å; Y228-L289 HydrophobicContact CE1-CG 4.46Å; Y228-L289 VanDerWaalsContact CE1-O 3.25Å; Y228-L289 WeakPolarHBondContact CE1-O 3.42Å; Y228-L289 PolarHBondContact OH-O 3.49Å; M231-L289 HydrophobicContact CE-CB 3.98Å; M231-L289 HydrophobicContact CE-CD1 3.42Å; M231-L289 VanDerWaalsContact CE-CD1 3.42Å; M231-L289 HydrophobicContact CE-CG 4.33Å; M231-L289 HydrophobicContact SD-CD1 3.05Å; M231-L289 WeakPolarHBondContact SD-CD1 3.49Å; M231-L289 HydrophobicContact SD-CG 4.41Å; A285-L289 WeakPolarHBondContact O-CB 3.46Å; A285-L289 WeakPolarHBondContact O-CG 3.15Å; A285-L289 PolarHBondContact O-N 3.04Å; A285-L289 VanDerWaalsContact O-N 3.08Å; A286-L289 PolarHBondContact O-N 2.92Å; V287-L289 PolarHBondContact O-N 3.39Å; L289-A291 PolarHBondContact O-N 3.05Å; L289-V292 WeakPolarHBondContact O-CB 3.48Å; L289-V292 PolarHBondContact O-N 2.94Å; L289-V292 VanDerWaalsContact O-N 3.11Å; L289-G293 PolarHBondContact O-N 2.89Å; L289-G293 VanDerWaalsContact O-N 3.17Å |
| 290 | L | 75.3 | Confident | 74.7 | Confident | 118 Ų | 118 | 51.9 Ų | 51.9 | 62% | 0.618 | 32% | 0.316 | S | S | * | . | H | α-helix | trans | -54.5 | -39.6 | 170.4 | -79.8 | 164.7 | 0 | 0 | 0 | 111.9 | A286 V287 G293 G294 | A286-L290 WeakPolarHBondContact O-CG 3.28Å; A286-L290 PolarHBondContact O-N 3.3Å; V287-L290 PolarHBondContact O-N 2.84Å; L290-G293 PolarHBondContact O-N 3.48Å; L290-G294 PolarHBondContact O-N 3.49Å |
| 291 | A | 80.4 | Confident | 77.2 | Confident | 34 Ų | 34 | 48.5 Ų | 48.5 | 28% | 0.281 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -66.3 | -40.9 | 179 | 0 | 0 | 0 | 0 | 0 | 111.8 | V287 V288 L289 G293 Q295 F340 | V287-A291 VanDerWaalsContact O-CB 3.28Å; V287-A291 WeakPolarHBondContact O-CB 3.36Å; V287-A291 PolarHBondContact O-N 2.87Å; V288-A291 WeakPolarHBondContact O-CB 3.46Å; V288-A291 PolarHBondContact O-N 3.36Å; L289-A291 PolarHBondContact O-N 3.05Å; A291-G293 PolarHBondContact O-N 3.47Å; A291-Q295 WeakPolarHBondContact O-CB 3.34Å; A291-Q295 PolarHBondContact O-N 2.89Å; A291-F340 HydrophobicContact CB-CD1 4.16Å; A291-F340 HydrophobicContact CB-CE1 3.7Å; A291-F340 VanDerWaalsContact O-CE1 3.3Å; A291-F340 WeakPolarHBondContact O-CE1 3.35Å |
| 292 | V | 82.8 | Confident | 79.4 | Confident | 9 Ų | 9 | 48.3 Ų | 48.3 | 6% | 0.055 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -60.5 | -43.5 | 175.7 | 169.2 | 0 | 0 | 0 | 0 | 112.1 | V288 L289 Q295 F296 F340 Y341 | V288-V292 VanDerWaalsContact O-CG2 3.3Å; V288-V292 WeakPolarHBondContact O-CG2 3.36Å; V288-V292 PolarHBondContact O-N 3.21Å; L289-V292 WeakPolarHBondContact O-CB 3.48Å; L289-V292 PolarHBondContact O-N 2.94Å; L289-V292 VanDerWaalsContact O-N 3.11Å; V292-Q295 WeakPolarHBondContact O-CB 3.32Å; V292-Q295 PolarHBondContact O-N 3.47Å; V292-F296 PolarHBondContact O-N 3.02Å; V292-F296 VanDerWaalsContact O-N 3.16Å; V292-F340 HydrophobicContact CG2-CB 4.04Å; V292-F340 HydrophobicContact CG2-CD1 4.17Å; V292-F340 HydrophobicContact CG2-CG 4.49Å; V292-Y341 HydrophobicContact CG1-CE1 3.92Å; V292-Y341 WeakPolarHBondContact CG1-OH 3.44Å; V292-Y341 HydrophobicContact CG2-CE1 4.37Å |
| 293 | G | 84.5 | Confident | 81.4 | Confident | 4 Ų | 4 | 47.6 Ų | 47.6 | 4% | 0.041 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -79.6 | -33.8 | -177 | 0 | 0 | 0 | 0 | 0 | 112.6 | Y228 L289 L290 A291 Q295 F296 L297 | Y228-G293 WeakPolarHBondContact OH-CA 3.49Å; Y228-G293 PolarHBondContact OH-N 2.86Å; L289-G293 PolarHBondContact O-N 2.89Å; L289-G293 VanDerWaalsContact O-N 3.17Å; L290-G293 PolarHBondContact O-N 3.48Å; A291-G293 PolarHBondContact O-N 3.47Å; G293-Q295 VanDerWaalsContact C-N 3.26Å; G293-Q295 PolarHBondContact O-N 2.94Å; G293-F296 PolarHBondContact O-N 2.95Å; G293-L297 PolarHBondContact O-N 2.87Å; G293-L297 VanDerWaalsContact O-N 3.1Å |
| 294 | G | 87.3 | Confident | 83.2 | Confident | 28 Ų | 28 | 45.5 Ų | 45.5 | 29% | 0.289 | 26% | 0.262 | S | S | . | . | H | α-helix | trans | -57 | -43.6 | 166.5 | 0 | 0 | 0 | 0 | 0 | 111 | L290 F296 L297 L298 | L290-G294 PolarHBondContact O-N 3.49Å; G294-F296 PolarHBondContact O-N 3Å; G294-L297 PolarHBondContact O-N 3.26Å; G294-L298 WeakPolarHBondContact O-CB 3.21Å; G294-L298 VanDerWaalsContact O-CG 3.23Å; G294-L298 WeakPolarHBondContact O-CG 3.17Å; G294-L298 PolarHBondContact O-N 3.4Å |
| 295 | Q | 91 | Very high | 84.6 | Confident | 18 Ų | 18 | 40 Ų | 40 | 8% | 0.084 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -61.1 | -45.8 | 177.3 | -176.7 | 62.4 | 7.4 | 0 | 0 | 112.7 | A291 V292 G293 L297 L298 C299 F332 S336 F340 | A291-Q295 WeakPolarHBondContact O-CB 3.34Å; A291-Q295 PolarHBondContact O-N 2.89Å; V292-Q295 WeakPolarHBondContact O-CB 3.32Å; V292-Q295 PolarHBondContact O-N 3.47Å; G293-Q295 VanDerWaalsContact C-N 3.26Å; G293-Q295 PolarHBondContact O-N 2.94Å; Q295-L297 VanDerWaalsContact C-N 3.31Å; Q295-L297 PolarHBondContact O-N 2.96Å; Q295-L298 PolarHBondContact O-N 2.9Å; Q295-C299 VanDerWaalsContact CD-SG 3.58Å; Q295-C299 PolarHBondContact NE2-SG 2.72Å; Q295-C299 PolarHBondContact O-N 3.31Å; Q295-C299 PolarHBondContact O-SG 2.92Å; Q295-F332 VanDerWaalsContact NE2-CE1 3.3Å; Q295-S336 PolarHBondContact NE2-OG 3.07Å; Q295-F340 HydrophobicContact CB-CD2 4.08Å; Q295-F340 HydrophobicContact CB-CE1 4.11Å; Q295-F340 HydrophobicContact CB-CE2 3.64Å; Q295-F340 HydrophobicContact CB-CZ 3.65Å; Q295-F340 HydrophobicContact CG-CD2 3.75Å; Q295-F340 HydrophobicContact CG-CE2 3.35Å; Q295-F340 HydrophobicContact CG-CZ 3.9Å |
| 296 | F | 92.3 | Very high | 85.9 | Confident | 6 Ų | 6 | 38.6 Ų | 38.6 | 3% | 0.026 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -56.5 | -47.8 | 176.5 | -178.5 | -91.6 | 0 | 0 | 0 | 111.1 | I130 V133 F217 P220 L221 I224 V292 G293 G294 W300 | I130-F296 HydrophobicContact CG1-CE2 4.25Å; I130-F296 HydrophobicContact CG2-CE2 4.19Å; I130-F296 HydrophobicContact CG2-CZ 4.5Å; V133-F296 HydrophobicContact CG1-CD2 4.3Å; F217-F296 HydrophobicContact CD2-CE1 4.04Å; F217-F296 HydrophobicContact CD2-CZ 4.49Å; F217-F296 HydrophobicContact CE2-CE1 4.36Å; P220-F296 HydrophobicContact CB-CE1 4.22Å; P220-F296 HydrophobicContact CB-CE2 4.12Å; P220-F296 HydrophobicContact CB-CZ 3.63Å; P220-F296 HydrophobicContact CG-CZ 4.39Å; L221-F296 HydrophobicContact CB-CE1 4.39Å; I224-F296 HydrophobicContact CD1-CB 3.88Å; I224-F296 HydrophobicContact CD1-CD1 3.81Å; I224-F296 HydrophobicContact CD1-CD2 4.11Å; I224-F296 HydrophobicContact CD1-CE1 4.43Å; I224-F296 HydrophobicContact CD1-CG 3.64Å; V292-F296 PolarHBondContact O-N 3.02Å; V292-F296 VanDerWaalsContact O-N 3.16Å; G293-F296 PolarHBondContact O-N 2.95Å; G294-F296 PolarHBondContact O-N 3Å; F296-W300 AromaticContact CD2-CD1 3.39Å; F296-W300 HydrophobicContact CD2-CG 4.44Å; F296-W300 AromaticContact CD2-NE1 3.87Å; F296-W300 AromaticContact CE2-CD1 3.47Å; F296-W300 VanDerWaalsContact CE2-CD1 3.47Å; F296-W300 HydrophobicContact CE2-CG 4.22Å; F296-W300 AromaticContact CE2-NE1 3.96Å; F296-W300 AromaticContact CG-CD1 3.9Å; F296-W300 HydrophobicContact CZ-CG 4.44Å; F296-W300 VanDerWaalsContact O-CB 3.31Å; F296-W300 WeakPolarHBondContact O-CB 3.47Å; F296-W300 PolarHBondContact O-N 3.26Å |
| 297 | L | 92.9 | Very high | 86.9 | Confident | 63 Ų | 63 | 37.8 Ų | 37.8 | 33% | 0.33 | 22% | 0.221 | S | C | . | . | H | α-helix | trans | -62.6 | -47.7 | 177.7 | -80.4 | 171.7 | 0 | 0 | 0 | 112.4 | F217 L221 G293 G294 Q295 C299 L301 | F217-L297 HydrophobicContact CE2-CD2 4.31Å; F217-L297 HydrophobicContact CZ-CD2 4.35Å; L221-L297 HydrophobicContact CD1-CD1 4.09Å; L221-L297 HydrophobicContact CD1-CD2 3.43Å; L221-L297 VanDerWaalsContact CD1-CD2 3.43Å; L221-L297 HydrophobicContact CD1-CG 3.8Å; L221-L297 HydrophobicContact CD2-CD2 3.98Å; L221-L297 HydrophobicContact CG-CD2 4.33Å; G293-L297 PolarHBondContact O-N 2.87Å; G293-L297 VanDerWaalsContact O-N 3.1Å; G294-L297 PolarHBondContact O-N 3.26Å; Q295-L297 VanDerWaalsContact C-N 3.31Å; Q295-L297 PolarHBondContact O-N 2.96Å; L297-C299 VanDerWaalsContact C-N 3.33Å; L297-C299 PolarHBondContact O-N 3.01Å; L297-L301 WeakPolarHBondContact O-CB 3.38Å; L297-L301 PolarHBondContact O-N 3.01Å |
| 298 | L | 92.9 | Very high | 87.9 | Confident | 123 Ų | 123 | 35.9 Ų | 35.9 | 64% | 0.644 | 21% | 0.207 | S | C | * | . | H | α-helix | trans | -64.2 | -36.3 | -175.8 | -71.1 | 171.6 | 0 | 0 | 0 | 112.8 | G294 Q295 P302 | G294-L298 WeakPolarHBondContact O-CB 3.21Å; G294-L298 VanDerWaalsContact O-CG 3.23Å; G294-L298 WeakPolarHBondContact O-CG 3.17Å; G294-L298 PolarHBondContact O-N 3.4Å; Q295-L298 PolarHBondContact O-N 2.9Å; L298-P302 WeakPolarHBondContact O-CD 3.45Å |
| 299 | C | 93.8 | Very high | 88.7 | Confident | 1 Ų | 1 | 40.2 Ų | 40.2 | 1% | 0.007 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -80.3 | -44.2 | 179 | -58.8 | 0 | 0 | 0 | 0 | 112.3 | Q295 L297 G330 C333 | Q295-C299 VanDerWaalsContact CD-SG 3.58Å; Q295-C299 PolarHBondContact NE2-SG 2.72Å; Q295-C299 PolarHBondContact O-N 3.31Å; Q295-C299 PolarHBondContact O-SG 2.92Å; L297-C299 VanDerWaalsContact C-N 3.33Å; L297-C299 PolarHBondContact O-N 3.01Å; C299-G330 WeakPolarHBondContact O-CA 3.44Å; C299-C333 HydrophobicContact CB-CB 3.99Å |
| 300 | W | 95.1 | Very high | 89.3 | Confident | 3 Ų | 3 | 40 Ų | 40 | 1% | 0.011 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -94.5 | -31.4 | -167 | -63.5 | 114.1 | 0 | 0 | 0 | 113.5 | V126 I130 F217 F296 Y303 F304 C333 | V126-W300 HydrophobicContact CB-CH2 4.2Å; V126-W300 HydrophobicContact CB-CZ3 4.33Å; V126-W300 HydrophobicContact CG1-CE3 4.34Å; V126-W300 HydrophobicContact CG1-CH2 3.69Å; V126-W300 HydrophobicContact CG1-CZ3 3.5Å; V126-W300 VanDerWaalsContact CG1-CZ3 3.5Å; V126-W300 HydrophobicContact CG2-CH2 3.92Å; V126-W300 HydrophobicContact CG2-CZ3 4Å; I130-W300 HydrophobicContact CD1-CD2 3.99Å; I130-W300 HydrophobicContact CD1-CE3 4.1Å; I130-W300 HydrophobicContact CD1-CH2 4.33Å; I130-W300 HydrophobicContact CD1-CZ2 4.19Å; I130-W300 HydrophobicContact CD1-CZ3 4.28Å; I130-W300 HydrophobicContact CG1-CD2 4.3Å; I130-W300 HydrophobicContact CG1-CH2 4.47Å; I130-W300 HydrophobicContact CG1-CZ2 3.93Å; F217-W300 HydrophobicContact CD2-CB 4.15Å; F217-W300 HydrophobicContact CE2-CB 4.5Å; F296-W300 AromaticContact CD2-CD1 3.39Å; F296-W300 HydrophobicContact CD2-CG 4.44Å; F296-W300 AromaticContact CD2-NE1 3.87Å; F296-W300 AromaticContact CE2-CD1 3.47Å; F296-W300 VanDerWaalsContact CE2-CD1 3.47Å; F296-W300 HydrophobicContact CE2-CG 4.22Å; F296-W300 AromaticContact CE2-NE1 3.96Å; F296-W300 AromaticContact CG-CD1 3.9Å; F296-W300 HydrophobicContact CZ-CG 4.44Å; F296-W300 VanDerWaalsContact O-CB 3.31Å; F296-W300 WeakPolarHBondContact O-CB 3.47Å; F296-W300 PolarHBondContact O-N 3.26Å; W300-Y303 HydrophobicContact CE3-CD1 4.35Å; W300-Y303 PolarHBondContact O-N 3Å; W300-F304 HydrophobicContact CB-CD2 3.85Å; W300-F304 HydrophobicContact CB-CE2 3.9Å; W300-F304 HydrophobicContact CD2-CE2 4.19Å; W300-F304 HydrophobicContact CE3-CD2 4.44Å; W300-F304 AromaticContact CE3-CE2 3.79Å; W300-F304 HydrophobicContact CE3-CE2 3.79Å; W300-F304 HydrophobicContact CG-CE2 4.27Å; W300-F304 VanDerWaalsContact O-CD2 3.24Å; W300-F304 WeakPolarHBondContact O-CD2 3.4Å; W300-F304 PolarHBondContact O-N 3.44Å; W300-C333 HydrophobicContact CH2-CB 4.5Å; W300-C333 HydrophobicContact CZ2-CB 3.65Å; W300-C333 PolarHBondContact NE1-SG 3.36Å; W300-C333 VanDerWaalsContact NE1-SG 3.42Å |
| 301 | L | 95.1 | Very high | 89.7 | Confident | 79 Ų | 79 | 35 Ų | 35 | 41% | 0.414 | 20% | 0.195 | S | C | . | . | H | α-helix | trans | -56.4 | -47.3 | -179 | 176.8 | 70.1 | 0 | 0 | 0 | 112.4 | F217 L297 Y303 S305 | F217-L301 HydrophobicContact CE1-CD1 4.05Å; F217-L301 HydrophobicContact CE2-CB 4.11Å; F217-L301 HydrophobicContact CE2-CD1 4.32Å; F217-L301 HydrophobicContact CZ-CB 4.09Å; F217-L301 HydrophobicContact CZ-CD1 3.47Å; F217-L301 VanDerWaalsContact CZ-CD1 3.47Å; F217-L301 HydrophobicContact CZ-CG 4.39Å; L297-L301 WeakPolarHBondContact O-CB 3.38Å; L297-L301 PolarHBondContact O-N 3.01Å; L301-Y303 PolarHBondContact O-N 3.35Å; L301-S305 WeakPolarHBondContact CD1-OG 3.29Å; L301-S305 WeakPolarHBondContact O-CB 3.36Å; L301-S305 PolarHBondContact O-N 3.19Å; L301-S305 PolarHBondContact O-OG 3.39Å |
| 302 | P | 95.1 | Very high | 89.8 | Confident | 45 Ų | 45 | 38.5 Ų | 38.5 | 29% | 0.292 | 21% | 0.209 | S | C | . | . | H | α-helix | trans | -62.9 | -43.7 | -180 | -23 | 36.3 | 0 | 0 | 0 | 112.4 | L298 F306 V326 I329 | L298-P302 WeakPolarHBondContact O-CD 3.45Å; P302-F306 VanDerWaalsContact O-CB 3.3Å; P302-F306 WeakPolarHBondContact O-CB 3.48Å; P302-F306 PolarHBondContact O-N 3.36Å; P302-V326 HydrophobicContact CB-CG1 4.21Å; P302-I329 HydrophobicContact CB-CG2 4.47Å; P302-I329 HydrophobicContact CG-CG2 4.11Å |
| 303 | Y | 92.7 | Very high | 89.6 | Confident | 6 Ų | 6 | 39.4 Ų | 39.4 | 2% | 0.024 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -60.3 | -56.1 | 179.2 | 179 | -96.1 | 0 | 0 | 0 | 112.1 | W300 L301 S305 F306 H307 | W300-Y303 HydrophobicContact CE3-CD1 4.35Å; W300-Y303 PolarHBondContact O-N 3Å; L301-Y303 PolarHBondContact O-N 3.35Å; Y303-S305 PolarHBondContact O-N 2.92Å; Y303-F306 PolarHBondContact O-N 2.95Å; Y303-H307 AromaticContact CD2-CD2 3.79Å; Y303-H307 AromaticContact CD2-NE2 3.75Å; Y303-H307 AromaticContact CE1-CD2 3.77Å; Y303-H307 AromaticContact CE2-CD2 3.49Å; Y303-H307 VanDerWaalsContact CE2-CD2 3.49Å; Y303-H307 WeakPolarHBondContact CE2-CD2 3.29Å; Y303-H307 AromaticContact CE2-NE2 3.17Å; Y303-H307 WeakPolarHBondContact CE2-NE2 3.31Å; Y303-H307 AromaticContact CZ-CD2 3.47Å; Y303-H307 VanDerWaalsContact CZ-CD2 3.47Å; Y303-H307 AromaticContact CZ-NE2 3.46Å; Y303-H307 PolarHBondContact O-CD2 3.15Å; Y303-H307 VanDerWaalsContact O-CD2 3.24Å; Y303-H307 PolarHBondContact O-N 3.45Å; Y303-H307 VanDerWaalsContact O-N 3.12Å |
| 304 | F | 93.9 | Very high | 88.7 | Confident | 7 Ų | 7 | 42.7 Ų | 42.7 | 3% | 0.031 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -68 | -35.8 | -178.6 | -75.5 | -77.4 | 0 | 0 | 0 | 112.2 | I130 F212 A213 F217 W300 L308 | I130-F304 HydrophobicContact CD1-CE2 3.91Å; I130-F304 HydrophobicContact CD1-CZ 3.82Å; F212-F304 HydrophobicContact CD1-CD1 4.39Å; F212-F304 AromaticContact CD1-CE1 3.57Å; F212-F304 HydrophobicContact CD1-CE1 3.57Å; F212-F304 HydrophobicContact CD1-CZ 4.41Å; F212-F304 AromaticContact CE1-CE1 3.53Å; F212-F304 HydrophobicContact CE1-CE1 3.53Å; F212-F304 AromaticContact CE1-CZ 3.95Å; F212-F304 HydrophobicContact CE1-CZ 3.95Å; A213-F304 HydrophobicContact CB-CD1 3.99Å; F217-F304 HydrophobicContact CB-CB 4.14Å; F217-F304 HydrophobicContact CB-CD1 3.96Å; F217-F304 HydrophobicContact CB-CD2 3.53Å; F217-F304 HydrophobicContact CB-CE1 4.19Å; F217-F304 HydrophobicContact CB-CE2 3.82Å; F217-F304 HydrophobicContact CB-CG 3.61Å; F217-F304 HydrophobicContact CB-CZ 4.14Å; F217-F304 HydrophobicContact CD1-CB 4.29Å; F217-F304 HydrophobicContact CD2-CB 4.48Å; F217-F304 AromaticContact CD2-CD2 3.81Å; F217-F304 HydrophobicContact CD2-CD2 3.81Å; F217-F304 HydrophobicContact CD2-CE2 4.43Å; F217-F304 HydrophobicContact CD2-CG 4.38Å; F217-F304 HydrophobicContact CG-CB 4.05Å; F217-F304 AromaticContact CG-CD2 3.83Å; F217-F304 HydrophobicContact CG-CD2 3.83Å; F217-F304 HydrophobicContact CG-CE2 4.49Å; F217-F304 AromaticContact CG-CG 3.98Å; F217-F304 HydrophobicContact CG-CG 3.98Å; W300-F304 HydrophobicContact CB-CD2 3.85Å; W300-F304 HydrophobicContact CB-CE2 3.9Å; W300-F304 HydrophobicContact CD2-CE2 4.19Å; W300-F304 HydrophobicContact CE3-CD2 4.44Å; W300-F304 AromaticContact CE3-CE2 3.79Å; W300-F304 HydrophobicContact CE3-CE2 3.79Å; W300-F304 HydrophobicContact CG-CE2 4.27Å; W300-F304 VanDerWaalsContact O-CD2 3.24Å; W300-F304 WeakPolarHBondContact O-CD2 3.4Å; W300-F304 PolarHBondContact O-N 3.44Å; F304-L308 WeakPolarHBondContact O-CB 3.34Å; F304-L308 PolarHBondContact O-N 3.35Å |
| 305 | S | 92.6 | Very high | 87.3 | Confident | 55 Ų | 55 | 48 Ų | 48 | 39% | 0.385 | 26% | 0.259 | S | S | . | . | H | α-helix | trans | -64.7 | -43 | 177.3 | -59.2 | 0 | 0 | 0 | 0 | 111.5 | L301 Y303 Y309 | L301-S305 WeakPolarHBondContact CD1-OG 3.29Å; L301-S305 WeakPolarHBondContact O-CB 3.36Å; L301-S305 PolarHBondContact O-N 3.19Å; L301-S305 PolarHBondContact O-OG 3.39Å; Y303-S305 PolarHBondContact O-N 2.92Å; S305-Y309 WeakPolarHBondContact O-CB 3.24Å; S305-Y309 PolarHBondContact O-N 3.46Å |
| 306 | F | 90.4 | Very high | 85.6 | Confident | 21 Ų | 21 | 52.5 Ų | 52.5 | 9% | 0.092 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -61.9 | -53.1 | 177.2 | 173.6 | -97.7 | 0 | 0 | 0 | 111.6 | P302 Y303 L308 Y309 V310 T319 V322 E323 V326 | P302-F306 VanDerWaalsContact O-CB 3.3Å; P302-F306 WeakPolarHBondContact O-CB 3.48Å; P302-F306 PolarHBondContact O-N 3.36Å; Y303-F306 PolarHBondContact O-N 2.95Å; F306-L308 VanDerWaalsContact C-N 3.32Å; F306-L308 PolarHBondContact O-N 3.04Å; F306-Y309 PolarHBondContact O-N 3.1Å; F306-V310 HydrophobicContact CD2-CG2 4.34Å; F306-V310 HydrophobicContact CE1-CG2 4.17Å; F306-V310 HydrophobicContact CE2-CG2 3.99Å; F306-V310 HydrophobicContact CZ-CG2 3.9Å; F306-V310 VanDerWaalsContact O-CB 3.31Å; F306-V310 WeakPolarHBondContact O-CB 3.14Å; F306-V310 VanDerWaalsContact O-CG2 3.25Å; F306-V310 WeakPolarHBondContact O-CG2 3.3Å; F306-V310 PolarHBondContact O-N 3.13Å; F306-T319 HydrophobicContact CE2-CG2 3.94Å; F306-T319 HydrophobicContact CZ-CG2 4.23Å; F306-T319 WeakPolarHBondContact CZ-OG1 3.19Å; F306-V322 HydrophobicContact CD2-CG1 3.68Å; F306-V322 HydrophobicContact CE2-CB 3.99Å; F306-V322 HydrophobicContact CE2-CG1 3.61Å; F306-E323 HydrophobicContact CE1-CB 3.63Å; F306-E323 HydrophobicContact CE1-CG 3.89Å; F306-E323 HydrophobicContact CZ-CB 3.8Å; F306-V326 HydrophobicContact CB-CB 4.48Å; F306-V326 HydrophobicContact CB-CG1 4.23Å; F306-V326 HydrophobicContact CB-CG2 3.95Å; F306-V326 HydrophobicContact CD1-CG2 3.73Å; F306-V326 HydrophobicContact CE1-CG2 4.43Å; F306-V326 HydrophobicContact CG-CG2 3.86Å |
| 307 | H | 87.3 | Confident | 84 | Confident | 9 Ų | 9 | 56.3 Ų | 56.3 | 4% | 0.042 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -64.8 | -35.7 | -179.3 | -73.7 | -64.4 | 0 | 0 | 0 | 112.6 | V209 Y303 A311 E323 | V209-H307 HydrophobicContact CG1-CB 4.25Å; Y303-H307 AromaticContact CD2-CD2 3.79Å; Y303-H307 AromaticContact CD2-NE2 3.75Å; Y303-H307 AromaticContact CE1-CD2 3.77Å; Y303-H307 AromaticContact CE2-CD2 3.49Å; Y303-H307 VanDerWaalsContact CE2-CD2 3.49Å; Y303-H307 WeakPolarHBondContact CE2-CD2 3.29Å; Y303-H307 AromaticContact CE2-NE2 3.17Å; Y303-H307 WeakPolarHBondContact CE2-NE2 3.31Å; Y303-H307 AromaticContact CZ-CD2 3.47Å; Y303-H307 VanDerWaalsContact CZ-CD2 3.47Å; Y303-H307 AromaticContact CZ-NE2 3.46Å; Y303-H307 PolarHBondContact O-CD2 3.15Å; Y303-H307 VanDerWaalsContact O-CD2 3.24Å; Y303-H307 PolarHBondContact O-N 3.45Å; Y303-H307 VanDerWaalsContact O-N 3.12Å; H307-A311 VanDerWaalsContact O-CB 3.25Å; H307-A311 WeakPolarHBondContact O-CB 3.49Å; H307-A311 PolarHBondContact O-N 2.96Å; H307-E323 IonicContact CE1-OE1 3.56Å |
| 308 | L | 90 | Very high | 82.3 | Confident | 56 Ų | 56 | 59.5 Ų | 59.5 | 29% | 0.293 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -68.7 | -45.3 | 175.2 | -170.1 | 67.8 | 0 | 0 | 0 | 111.7 | V210 F304 F306 V310 A311 L312 | V210-L308 HydrophobicContact CG2-CD1 3.81Å; F304-L308 WeakPolarHBondContact O-CB 3.34Å; F304-L308 PolarHBondContact O-N 3.35Å; F306-L308 VanDerWaalsContact C-N 3.32Å; F306-L308 PolarHBondContact O-N 3.04Å; L308-V310 VanDerWaalsContact C-N 3.32Å; L308-V310 PolarHBondContact O-N 3.26Å; L308-A311 PolarHBondContact O-N 2.93Å; L308-L312 HydrophobicContact CD1-CD1 4.12Å; L308-L312 HydrophobicContact CD1-CG 4.41Å; L308-L312 HydrophobicContact CG-CD1 3.9Å; L308-L312 HydrophobicContact CG-CG 4.48Å; L308-L312 WeakPolarHBondContact O-CB 3.37Å; L308-L312 VanDerWaalsContact O-CG 3.23Å; L308-L312 WeakPolarHBondContact O-CG 3.38Å; L308-L312 PolarHBondContact O-N 3.38Å |
| 309 | Y | 88.4 | Confident | 81.1 | Confident | 132 Ų | 132 | 54.3 Ų | 54.3 | 52% | 0.518 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -57.7 | -48.1 | 177.2 | 172.5 | -99.2 | 0 | 0 | 0 | 110.9 | S305 F306 L312 S313 I317 | S305-Y309 WeakPolarHBondContact O-CB 3.24Å; S305-Y309 PolarHBondContact O-N 3.46Å; F306-Y309 PolarHBondContact O-N 3.1Å; Y309-L312 PolarHBondContact O-N 3.37Å; Y309-S313 WeakPolarHBondContact CE2-OG 3.42Å; Y309-S313 WeakPolarHBondContact O-CB 3.4Å; Y309-S313 PolarHBondContact O-N 3.37Å; Y309-S313 PolarHBondContact O-OG 2.64Å; Y309-I317 HydrophobicContact CE1-CD1 4.1Å |
| 310 | V | 82.3 | Confident | 80.1 | Confident | 24 Ų | 24 | 56.6 Ų | 56.6 | 15% | 0.145 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -61.2 | -46.1 | 176.9 | 157.9 | 0 | 0 | 0 | 0 | 112 | Q198 F306 L308 L312 S313 | Q198-V310 HydrophobicContact CG-CG1 3.4Å; Q198-V310 VanDerWaalsContact NE2-CG2 3.26Å; F306-V310 HydrophobicContact CD2-CG2 4.34Å; F306-V310 HydrophobicContact CE1-CG2 4.17Å; F306-V310 HydrophobicContact CE2-CG2 3.99Å; F306-V310 HydrophobicContact CZ-CG2 3.9Å; F306-V310 VanDerWaalsContact O-CB 3.31Å; F306-V310 WeakPolarHBondContact O-CB 3.14Å; F306-V310 VanDerWaalsContact O-CG2 3.25Å; F306-V310 WeakPolarHBondContact O-CG2 3.3Å; F306-V310 PolarHBondContact O-N 3.13Å; L308-V310 VanDerWaalsContact C-N 3.32Å; L308-V310 PolarHBondContact O-N 3.26Å; V310-L312 VanDerWaalsContact C-N 3.27Å; V310-L312 PolarHBondContact O-N 3.06Å; V310-S313 PolarHBondContact O-N 3.46Å; V310-S313 VanDerWaalsContact O-O 3.04Å |
| 311 | A | 82.1 | Confident | 79.3 | Confident | 12 Ų | 12 | 63.8 Ų | 63.8 | 10% | 0.099 | 37% | 0.368 | C | S | . | . | H | α-helix | trans | -62.7 | -38.7 | -179.2 | 0 | 0 | 0 | 0 | 0 | 111.2 | Q206 V209 H307 L308 | Q206-A311 VanDerWaalsContact CG-O 3.31Å; Q206-A311 WeakPolarHBondContact CG-O 3.43Å; Q206-A311 PolarHBondContact NE2-O 2.91Å; V209-A311 HydrophobicContact CB-CB 3.94Å; V209-A311 HydrophobicContact CG1-CB 3.81Å; V209-A311 HydrophobicContact CG2-CB 4.27Å; H307-A311 VanDerWaalsContact O-CB 3.25Å; H307-A311 WeakPolarHBondContact O-CB 3.49Å; H307-A311 PolarHBondContact O-N 2.96Å; L308-A311 PolarHBondContact O-N 2.93Å |
| 312 | L | 84.3 | Confident | 78.8 | Confident | 108 Ų | 108 | 63.7 Ų | 63.7 | 57% | 0.565 | 37% | 0.371 | S | S | * | . | H | α-helix | trans | -82.9 | -28.5 | -178.3 | -62.4 | 176 | 0 | 0 | 0 | 113.3 | V210 L308 Y309 V310 A314 | V210-L312 HydrophobicContact CG2-CD2 4.4Å; L308-L312 HydrophobicContact CD1-CD1 4.12Å; L308-L312 HydrophobicContact CD1-CG 4.41Å; L308-L312 HydrophobicContact CG-CD1 3.9Å; L308-L312 HydrophobicContact CG-CG 4.48Å; L308-L312 WeakPolarHBondContact O-CB 3.37Å; L308-L312 VanDerWaalsContact O-CG 3.23Å; L308-L312 WeakPolarHBondContact O-CG 3.38Å; L308-L312 PolarHBondContact O-N 3.38Å; Y309-L312 PolarHBondContact O-N 3.37Å; V310-L312 VanDerWaalsContact C-N 3.27Å; V310-L312 PolarHBondContact O-N 3.06Å; L312-A314 PolarHBondContact O-N 2.85Å |
| 313 | S | 78.1 | Confident | 78.3 | Confident | 28 Ų | 28 | 62.8 Ų | 62.8 | 20% | 0.196 | 36% | 0.363 | C | S | . | . | trans | -88.8 | 107.5 | -179.6 | -54.6 | 0 | 0 | 0 | 0 | 109.2 | Y309 V310 Q315 | Y309-S313 WeakPolarHBondContact CE2-OG 3.42Å; Y309-S313 WeakPolarHBondContact O-CB 3.4Å; Y309-S313 PolarHBondContact O-N 3.37Å; Y309-S313 PolarHBondContact O-OG 2.64Å; V310-S313 PolarHBondContact O-N 3.46Å; V310-S313 VanDerWaalsContact O-O 3.04Å; S313-Q315 PolarHBondContact O-N 3.47Å | ||
| 314 | A | 64.7 | Low | 78 | Confident | 73 Ų | 73 | 64.9 Ų | 64.9 | 60% | 0.603 | 37% | 0.374 | S | S | * | . | trans | -68.5 | 25.9 | 177 | 0 | 0 | 0 | 0 | 0 | 114.4 | L312 | L312-A314 PolarHBondContact O-N 2.85Š| ||
| 315 | Q | 58.8 | Low | 77.8 | Confident | 138 Ų | 138 | 68.4 Ų | 68.4 | 65% | 0.645 | 40% | 0.396 | S | S | * | . | trans | -108.9 | 126.5 | -175.2 | -66.7 | -63.9 | -29.5 | 0 | 0 | 110.6 | S313 I317 | S313-Q315 PolarHBondContact O-N 3.47Å; Q315-I317 PolarHBondContact O-N 3.4Å | ||
| 316 | P | 55.7 | Low | 77.7 | Confident | 113 Ų | 113 | 66.4 Ų | 66.4 | 73% | 0.734 | 38% | 0.382 | S | S | * | . | trans | -76.9 | 88.7 | 176.9 | 31.2 | -32.2 | 0 | 0 | 0 | 109.3 | ||||
| 317 | I | 57.5 | Low | 77.8 | Confident | 86 Ų | 86 | 65.8 Ų | 65.8 | 44% | 0.441 | 38% | 0.379 | S | S | . | . | trans | -88.7 | 128.3 | 169.9 | -54.1 | 174.2 | 0 | 0 | 0 | 107.1 | Y309 Q315 T319 | Y309-I317 HydrophobicContact CE1-CD1 4.1Å; Q315-I317 PolarHBondContact O-N 3.4Å; I317-T319 VanDerWaalsContact C-N 3.32Å; I317-T319 HydrophobicContact CB-CG2 3.64Å; I317-T319 HydrophobicContact CG2-CG2 3.41Å; I317-T319 VanDerWaalsContact CG2-CG2 3.41Å; I317-T319 PolarHBondContact O-N 2.75Å; I317-T319 PolarHBondContact O-OG1 2.75Å | ||
| 318 | S | 56.6 | Low | 78.1 | Confident | 130 Ų | 130 | 66.2 Ų | 66.2 | 91% | 0.909 | 38% | 0.381 | S | S | * | . | trans | -66.7 | 91.9 | 168.7 | -177.1 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 319 | T | 67.9 | Low | 78.3 | Confident | 15 Ų | 15 | 66.7 Ų | 66.7 | 9% | 0.092 | 38% | 0.383 | C | S | . | . | trans | -110.9 | 11.8 | -170.8 | 50 | 0 | 0 | 0 | 0 | 114.7 | Q198 F306 I317 Q321 V322 E323 | Q198-T319 PolarHBondContact NE2-OG1 3.43Å; F306-T319 HydrophobicContact CE2-CG2 3.94Å; F306-T319 HydrophobicContact CZ-CG2 4.23Å; F306-T319 WeakPolarHBondContact CZ-OG1 3.19Å; I317-T319 VanDerWaalsContact C-N 3.32Å; I317-T319 HydrophobicContact CB-CG2 3.64Å; I317-T319 HydrophobicContact CG2-CG2 3.41Å; I317-T319 VanDerWaalsContact CG2-CG2 3.41Å; I317-T319 PolarHBondContact O-N 2.75Å; I317-T319 PolarHBondContact O-OG1 2.75Å; T319-Q321 VanDerWaalsContact C-N 3.27Å; T319-Q321 PolarHBondContact O-N 3.16Å; T319-Q321 VanDerWaalsContact O-N 3.12Å; T319-V322 WeakPolarHBondContact O-CA 3.44Å; T319-V322 PolarHBondContact O-N 3.3Å; T319-E323 PolarHBondContact O-N 2.8Å | ||
| 320 | G | 73.3 | Confident | 78.5 | Confident | 48 Ų | 48 | 60.4 Ų | 60.4 | 50% | 0.495 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -52.4 | -41.1 | -171.9 | 0 | 0 | 0 | 0 | 0 | 114.3 | N324 | G320-N324 WeakPolarHBondContact O-CB 3.25Å; G320-N324 PolarHBondContact O-N 3.35Å |
| 321 | Q | 78.4 | Confident | 79.1 | Confident | 155 Ų | 155 | 59.3 Ų | 59.3 | 72% | 0.724 | 35% | 0.351 | S | S | * | . | H | α-helix | trans | -66.1 | -42.1 | 175.8 | -66.4 | -62.9 | -30.8 | 0 | 0 | 112.7 | T319 N324 V325 | T319-Q321 VanDerWaalsContact C-N 3.27Å; T319-Q321 PolarHBondContact O-N 3.16Å; T319-Q321 VanDerWaalsContact O-N 3.12Å; Q321-N324 PolarHBondContact O-N 3.47Å; Q321-V325 VanDerWaalsContact O-CG2 3.3Å; Q321-V325 WeakPolarHBondContact O-CG2 2.98Å; Q321-V325 PolarHBondContact O-N 2.9Å |
| 322 | V | 84.7 | Confident | 79.8 | Confident | 76 Ų | 76 | 62.8 Ų | 62.8 | 46% | 0.461 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -67.4 | -42.5 | 178.6 | -178.3 | 0 | 0 | 0 | 0 | 110.4 | F306 T319 N324 V325 V326 | F306-V322 HydrophobicContact CD2-CG1 3.68Å; F306-V322 HydrophobicContact CE2-CB 3.99Å; F306-V322 HydrophobicContact CE2-CG1 3.61Å; T319-V322 WeakPolarHBondContact O-CA 3.44Å; T319-V322 PolarHBondContact O-N 3.3Å; V322-N324 PolarHBondContact O-N 3.39Å; V322-V325 PolarHBondContact O-N 3.48Å; V322-V326 HydrophobicContact CG1-CG1 4.37Å; V322-V326 WeakPolarHBondContact O-CG1 3.35Å; V322-V326 WeakPolarHBondContact O-CG2 3.5Å; V322-V326 PolarHBondContact O-N 3.09Å |
| 323 | E | 84.3 | Confident | 80.2 | Confident | 27 Ų | 27 | 57.8 Ų | 57.8 | 13% | 0.126 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -58.9 | -47 | 176 | -177.5 | 172.5 | -168.7 | 0 | 0 | 111.4 | S196 L197 F306 H307 T319 V325 V326 T327 | S196-E323 VanDerWaalsContact CB-OE2 3.3Å; S196-E323 WeakPolarHBondContact CB-OE2 3.43Å; S196-E323 PolarHBondContact OG-OE1 3.01Å; S196-E323 PolarHBondContact OG-OE2 3.34Å; L197-E323 PolarHBondContact N-OE1 2.83Å; F306-E323 HydrophobicContact CE1-CB 3.63Å; F306-E323 HydrophobicContact CE1-CG 3.89Å; F306-E323 HydrophobicContact CZ-CB 3.8Å; H307-E323 IonicContact CE1-OE1 3.56Å; T319-E323 PolarHBondContact O-N 2.8Å; E323-V325 PolarHBondContact O-N 3.38Å; E323-V326 VanDerWaalsContact O-CG2 3.3Å; E323-V326 WeakPolarHBondContact O-CG2 3.24Å; E323-V326 PolarHBondContact O-N 3.14Å; E323-T327 VanDerWaalsContact O-CB 3.25Å; E323-T327 WeakPolarHBondContact O-CB 3.47Å; E323-T327 PolarHBondContact O-N 2.85Å; E323-T327 PolarHBondContact O-OG1 3.29Å |
| 324 | N | 85.9 | Confident | 81 | Confident | 49 Ų | 49 | 56.5 Ų | 56.5 | 26% | 0.262 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -59.2 | -49.4 | 177.3 | -170.4 | 40.9 | 0 | 0 | 0 | 110.6 | G320 Q321 V322 V326 T327 W328 | G320-N324 WeakPolarHBondContact O-CB 3.25Å; G320-N324 PolarHBondContact O-N 3.35Å; Q321-N324 PolarHBondContact O-N 3.47Å; V322-N324 PolarHBondContact O-N 3.39Å; N324-V326 PolarHBondContact O-N 3.15Å; N324-T327 WeakPolarHBondContact O-CB 3.49Å; N324-T327 PolarHBondContact O-N 3Å; N324-W328 VanDerWaalsContact O-CD1 3.22Å; N324-W328 PolarHBondContact O-N 3.18Å; N324-W328 PolarHBondContact OD1-NE1 2.91Å; N324-W328 VanDerWaalsContact OD1-NE1 3.14Å |
| 325 | V | 89.5 | Confident | 82.5 | Confident | 82 Ų | 82 | 53.7 Ų | 53.7 | 50% | 0.497 | 31% | 0.305 | S | S | . | . | H | α-helix | trans | -58.4 | -49.8 | 179.2 | 170.7 | 0 | 0 | 0 | 0 | 112 | Q321 V322 E323 T327 W328 I329 | Q321-V325 VanDerWaalsContact O-CG2 3.3Å; Q321-V325 WeakPolarHBondContact O-CG2 2.98Å; Q321-V325 PolarHBondContact O-N 2.9Å; V322-V325 PolarHBondContact O-N 3.48Å; E323-V325 PolarHBondContact O-N 3.38Å; V325-T327 VanDerWaalsContact C-N 3.28Å; V325-T327 PolarHBondContact O-N 2.9Å; V325-W328 PolarHBondContact O-N 2.9Å; V325-I329 HydrophobicContact CG1-CD1 3.82Å; V325-I329 VanDerWaalsContact O-CG1 3.27Å; V325-I329 WeakPolarHBondContact O-CG1 3.34Å; V325-I329 PolarHBondContact O-N 2.97Å |
| 326 | V | 91.9 | Very high | 84.1 | Confident | 13 Ų | 13 | 47.4 Ų | 47.4 | 8% | 0.079 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -67.8 | -30.2 | -179.6 | -59.3 | 0 | 0 | 0 | 0 | 112.4 | P302 F306 V322 E323 N324 G330 | P302-V326 HydrophobicContact CB-CG1 4.21Å; F306-V326 HydrophobicContact CB-CB 4.48Å; F306-V326 HydrophobicContact CB-CG1 4.23Å; F306-V326 HydrophobicContact CB-CG2 3.95Å; F306-V326 HydrophobicContact CD1-CG2 3.73Å; F306-V326 HydrophobicContact CE1-CG2 4.43Å; F306-V326 HydrophobicContact CG-CG2 3.86Å; V322-V326 HydrophobicContact CG1-CG1 4.37Å; V322-V326 WeakPolarHBondContact O-CG1 3.35Å; V322-V326 WeakPolarHBondContact O-CG2 3.5Å; V322-V326 PolarHBondContact O-N 3.09Å; E323-V326 VanDerWaalsContact O-CG2 3.3Å; E323-V326 WeakPolarHBondContact O-CG2 3.24Å; E323-V326 PolarHBondContact O-N 3.14Å; N324-V326 PolarHBondContact O-N 3.15Å; V326-G330 PolarHBondContact O-N 2.79Å |
| 327 | T | 90.9 | Very high | 85.8 | Confident | 7 Ų | 7 | 42.2 Ų | 42.2 | 4% | 0.043 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -65.6 | -46.9 | 175 | -61.2 | 0 | 0 | 0 | 0 | 111 | E323 N324 V325 I329 G330 Y331 | E323-T327 VanDerWaalsContact O-CB 3.25Å; E323-T327 WeakPolarHBondContact O-CB 3.47Å; E323-T327 PolarHBondContact O-N 2.85Å; E323-T327 PolarHBondContact O-OG1 3.29Å; N324-T327 WeakPolarHBondContact O-CB 3.49Å; N324-T327 PolarHBondContact O-N 3Å; V325-T327 VanDerWaalsContact C-N 3.28Å; V325-T327 PolarHBondContact O-N 2.9Å; T327-I329 PolarHBondContact O-N 3.37Å; T327-G330 CarbonylContact O-C 3.56Å; T327-G330 WeakPolarHBondContact O-CA 3.33Å; T327-G330 PolarHBondContact O-N 3.48Å; T327-Y331 HydrophobicContact CG2-CD2 4.15Å; T327-Y331 HydrophobicContact CG2-CE1 4.01Å; T327-Y331 HydrophobicContact CG2-CE2 3.58Å; T327-Y331 VanDerWaalsContact CG2-CZ 3.49Å; T327-Y331 PolarHBondContact O-N 3.21Å |
| 328 | W | 93.6 | Very high | 87.3 | Confident | 19 Ų | 19 | 38.5 Ų | 38.5 | 7% | 0.072 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -69.5 | -31.6 | 177.4 | -78.7 | 93.1 | 0 | 0 | 0 | 113.3 | M49 L52 M94 A97 M98 N324 V325 G330 Y331 F332 | M49-W328 HydrophobicContact CB-CD2 4.32Å; M49-W328 HydrophobicContact CB-CE3 4.06Å; M49-W328 HydrophobicContact CB-CH2 3.52Å; M49-W328 HydrophobicContact CB-CZ2 3.8Å; M49-W328 HydrophobicContact CB-CZ3 3.64Å; M49-W328 HydrophobicContact CG-CD2 3.59Å; M49-W328 HydrophobicContact CG-CE3 3.73Å; M49-W328 HydrophobicContact CG-CG 4.2Å; M49-W328 HydrophobicContact CG-CH2 3.87Å; M49-W328 HydrophobicContact CG-CZ2 3.73Å; M49-W328 HydrophobicContact CG-CZ3 3.85Å; M49-W328 HydrophobicContact SD-CD2 3.72Å; M49-W328 HydrophobicContact SD-CE3 4.43Å; M49-W328 HydrophobicContact SD-CG 4.06Å; M49-W328 HydrophobicContact SD-CH2 4.23Å; M49-W328 HydrophobicContact SD-CZ2 3.47Å; M49-W328 WeakPolarHBondContact SD-CZ2 3.43Å; M49-W328 PolarHBondContact SD-NE1 3.47Å; L52-W328 HydrophobicContact CD1-CE3 4.33Å; M94-W328 HydrophobicContact CB-CH2 4.34Å; M94-W328 HydrophobicContact CE-CE3 4.28Å; M94-W328 HydrophobicContact CE-CH2 4.26Å; M94-W328 HydrophobicContact CE-CZ3 3.54Å; A97-W328 HydrophobicContact CB-CZ2 4.17Å; M98-W328 HydrophobicContact CB-CZ2 4.5Å; M98-W328 HydrophobicContact CG-CH2 3.46Å; M98-W328 VanDerWaalsContact CG-CH2 3.46Å; M98-W328 HydrophobicContact CG-CZ2 3.4Å; M98-W328 HydrophobicContact SD-CH2 4.02Å; N324-W328 VanDerWaalsContact O-CD1 3.22Å; N324-W328 PolarHBondContact O-N 3.18Å; N324-W328 PolarHBondContact OD1-NE1 2.91Å; N324-W328 VanDerWaalsContact OD1-NE1 3.14Å; V325-W328 PolarHBondContact O-N 2.9Å; W328-G330 VanDerWaalsContact C-N 3.28Å; W328-G330 PolarHBondContact O-N 3.39Å; W328-Y331 HydrophobicContact CD2-CD2 4.45Å; W328-Y331 PolarHBondContact O-N 3.45Å; W328-F332 PolarHBondContact O-N 3.46Å |
| 329 | I | 94.8 | Very high | 88.8 | Confident | 65 Ų | 65 | 37.8 Ų | 37.8 | 33% | 0.333 | 21% | 0.205 | S | C | . | . | H | α-helix | trans | -61.6 | -38.8 | 167.8 | -68.6 | 166.9 | 0 | 0 | 0 | 110.7 | P302 V325 T327 F332 | P302-I329 HydrophobicContact CB-CG2 4.47Å; P302-I329 HydrophobicContact CG-CG2 4.11Å; V325-I329 HydrophobicContact CG1-CD1 3.82Å; V325-I329 VanDerWaalsContact O-CG1 3.27Å; V325-I329 WeakPolarHBondContact O-CG1 3.34Å; V325-I329 PolarHBondContact O-N 2.97Å; T327-I329 PolarHBondContact O-N 3.37Å; I329-F332 WeakPolarHBondContact O-CB 3.46Å |
| 330 | G | 93.9 | Very high | 89.7 | Confident | 0 Ų | 0 | 38.4 Ų | 38.4 | 0% | 0 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -63.1 | -48.1 | 171.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | C299 V326 T327 W328 F332 C333 | C299-G330 WeakPolarHBondContact O-CA 3.44Å; V326-G330 PolarHBondContact O-N 2.79Å; T327-G330 CarbonylContact O-C 3.56Å; T327-G330 WeakPolarHBondContact O-CA 3.33Å; T327-G330 PolarHBondContact O-N 3.48Å; W328-G330 VanDerWaalsContact C-N 3.28Å; W328-G330 PolarHBondContact O-N 3.39Å; G330-F332 VanDerWaalsContact C-N 3.25Å; G330-F332 PolarHBondContact O-N 3Å; G330-C333 WeakPolarHBondContact O-CB 3.46Å; G330-C333 PolarHBondContact O-N 2.96Å |
| 331 | Y | 95 | Very high | 90.2 | Very high | 1 Ų | 1 | 37.1 Ų | 37.1 | 0% | 0.004 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -67.2 | -23.2 | -179.2 | -65.8 | -9.9 | 0 | 0 | 0 | 113.6 | L93 M94 A97 Y118 S122 V126 T327 W328 C333 F334 | L93-Y331 HydrophobicContact CD2-CE1 3.8Å; L93-Y331 HydrophobicContact CG-CE1 4.36Å; L93-Y331 HydrophobicContact CG-CE2 4.31Å; M94-Y331 HydrophobicContact CG-CD2 4.11Å; M94-Y331 HydrophobicContact CG-CG 4.43Å; A97-Y331 HydrophobicContact CB-CE2 3.74Å; Y118-Y331 PolarHBondContact OH-OH 3.46Å; S122-Y331 PolarHBondContact OG-OH 2.97Å; V126-Y331 HydrophobicContact CG2-CE1 4.28Å; T327-Y331 HydrophobicContact CG2-CD2 4.15Å; T327-Y331 HydrophobicContact CG2-CE1 4.01Å; T327-Y331 HydrophobicContact CG2-CE2 3.58Å; T327-Y331 VanDerWaalsContact CG2-CZ 3.49Å; T327-Y331 PolarHBondContact O-N 3.21Å; W328-Y331 HydrophobicContact CD2-CD2 4.45Å; W328-Y331 PolarHBondContact O-N 3.45Å; Y331-C333 PolarHBondContact O-N 2.98Å; Y331-F334 HydrophobicContact CD1-CD2 4.19Å; Y331-F334 AromaticContact CD1-CE2 3.45Å; Y331-F334 HydrophobicContact CD1-CE2 3.45Å; Y331-F334 VanDerWaalsContact CD1-CE2 3.45Å; Y331-F334 HydrophobicContact CD1-CZ 4.22Å; Y331-F334 HydrophobicContact CE1-CE2 4.07Å; Y331-F334 HydrophobicContact CG-CD2 4.31Å; Y331-F334 AromaticContact CG-CE2 3.98Å; Y331-F334 HydrophobicContact CG-CE2 3.98Å; Y331-F334 WeakPolarHBondContact O-CB 3.42Å; Y331-F334 WeakPolarHBondContact O-CD2 3.23Å; Y331-F334 PolarHBondContact O-N 3.42Å |
| 332 | F | 95 | Very high | 90.3 | Very high | 85 Ų | 85 | 29.8 Ų | 29.8 | 37% | 0.373 | 15% | 0.152 | S | C | . | . | H | α-helix | trans | -54.7 | -24.4 | 168.8 | 179.8 | -113.4 | 0 | 0 | 0 | 112.5 | L52 Q295 W328 I329 G330 F334 T335 S336 | L52-F332 HydrophobicContact CD2-CD2 3.74Å; L52-F332 HydrophobicContact CD2-CE2 4.2Å; Q295-F332 VanDerWaalsContact NE2-CE1 3.3Å; W328-F332 PolarHBondContact O-N 3.46Å; I329-F332 WeakPolarHBondContact O-CB 3.46Å; G330-F332 VanDerWaalsContact C-N 3.25Å; G330-F332 PolarHBondContact O-N 3Å; F332-F334 VanDerWaalsContact C-N 3.3Å; F332-F334 PolarHBondContact O-N 3.02Å; F332-T335 PolarHBondContact O-N 3.05Å; F332-S336 VanDerWaalsContact O-CB 3.31Å; F332-S336 WeakPolarHBondContact O-CB 3.47Å; F332-S336 PolarHBondContact O-N 3.49Å; F332-S336 PolarHBondContact O-OG 2.87Å |
| 333 | C | 94.2 | Very high | 89.8 | Confident | 4 Ų | 4 | 27.9 Ų | 27.9 | 3% | 0.027 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -54.1 | -47.2 | 171.6 | -168 | 0 | 0 | 0 | 0 | 111.4 | C299 W300 G330 Y331 T335 S336 N337 | C299-C333 HydrophobicContact CB-CB 3.99Å; W300-C333 HydrophobicContact CH2-CB 4.5Å; W300-C333 HydrophobicContact CZ2-CB 3.65Å; W300-C333 PolarHBondContact NE1-SG 3.36Å; W300-C333 VanDerWaalsContact NE1-SG 3.42Å; G330-C333 WeakPolarHBondContact O-CB 3.46Å; G330-C333 PolarHBondContact O-N 2.96Å; Y331-C333 PolarHBondContact O-N 2.98Å; C333-T335 VanDerWaalsContact C-N 3.3Å; C333-T335 PolarHBondContact O-N 3.41Å; C333-S336 WeakPolarHBondContact CA-OG 3.33Å; C333-S336 PolarHBondContact O-N 3.03Å; C333-S336 VanDerWaalsContact O-N 3.17Å; C333-S336 PolarHBondContact O-OG 2.92Å; C333-N337 PolarHBondContact O-N 2.83Å; C333-N337 PolarHBondContact O-ND2 3.25Å; C333-N337 PolarHBondContact O-OD1 3.46Å |
| 334 | F | 95.3 | Very high | 89.3 | Confident | 0 Ų | 0 | 28.9 Ų | 28.9 | 0% | 0 | 15% | 0.148 | C | C | . | . | H | α-helix | trans | -62.1 | -37 | -179.3 | -51.5 | -43 | 0 | 0 | 0 | 112.2 | N60 D86 A89 L93 M94 V126 A129 Y331 F332 | N60-F334 PolarHBondContact ND2-O 3.37Å; D86-F334 HydrophobicContact CB-CB 4.17Å; D86-F334 VanDerWaalsContact OD1-CD1 3.31Å; D86-F334 WeakPolarHBondContact OD1-CD1 3.22Å; A89-F334 HydrophobicContact CB-CD2 4.07Å; A89-F334 HydrophobicContact CB-CE1 4.46Å; A89-F334 HydrophobicContact CB-CE2 3.98Å; A89-F334 HydrophobicContact CB-CG 4.35Å; A89-F334 HydrophobicContact CB-CZ 4.19Å; L93-F334 HydrophobicContact CD2-CE2 4.13Å; L93-F334 HydrophobicContact CD2-CZ 4.43Å; M94-F334 HydrophobicContact SD-CD2 4.16Å; V126-F334 HydrophobicContact CG2-CZ 4.31Å; A129-F334 HydrophobicContact CB-CD1 4.11Å; A129-F334 HydrophobicContact CB-CE1 3.57Å; Y331-F334 HydrophobicContact CD1-CD2 4.19Å; Y331-F334 AromaticContact CD1-CE2 3.45Å; Y331-F334 HydrophobicContact CD1-CE2 3.45Å; Y331-F334 VanDerWaalsContact CD1-CE2 3.45Å; Y331-F334 HydrophobicContact CD1-CZ 4.22Å; Y331-F334 HydrophobicContact CE1-CE2 4.07Å; Y331-F334 HydrophobicContact CG-CD2 4.31Å; Y331-F334 AromaticContact CG-CE2 3.98Å; Y331-F334 HydrophobicContact CG-CE2 3.98Å; Y331-F334 WeakPolarHBondContact O-CB 3.42Å; Y331-F334 WeakPolarHBondContact O-CD2 3.23Å; Y331-F334 PolarHBondContact O-N 3.42Å; F332-F334 VanDerWaalsContact C-N 3.3Å; F332-F334 PolarHBondContact O-N 3.02Å |
| 335 | T | 94.8 | Very high | 88.7 | Confident | 15 Ų | 15 | 27.7 Ų | 27.7 | 9% | 0.092 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -71.2 | -38.4 | 176.4 | -48.1 | 0 | 0 | 0 | 0 | 112.1 | L52 T55 A56 F332 C333 P338 | L52-T335 HydrophobicContact CD2-CG2 4.31Å; L52-T335 PolarHBondContact O-OG1 2.89Å; T55-T335 HydrophobicContact CG2-CG2 3.64Å; A56-T335 HydrophobicContact CB-CG2 4.45Å; F332-T335 PolarHBondContact O-N 3.05Å; C333-T335 VanDerWaalsContact C-N 3.3Å; C333-T335 PolarHBondContact O-N 3.41Å; T335-P338 WeakPolarHBondContact O-CD 3.44Å |
| 336 | S | 92.8 | Very high | 87.9 | Confident | 6 Ų | 6 | 33.6 Ų | 33.6 | 4% | 0.042 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -80.7 | -25.5 | -173 | 72.5 | 0 | 0 | 0 | 0 | 114.3 | Q295 F332 C333 F339 F340 | Q295-S336 PolarHBondContact NE2-OG 3.07Å; F332-S336 VanDerWaalsContact O-CB 3.31Å; F332-S336 WeakPolarHBondContact O-CB 3.47Å; F332-S336 PolarHBondContact O-N 3.49Å; F332-S336 PolarHBondContact O-OG 2.87Å; C333-S336 WeakPolarHBondContact CA-OG 3.33Å; C333-S336 PolarHBondContact O-N 3.03Å; C333-S336 VanDerWaalsContact O-N 3.17Å; C333-S336 PolarHBondContact O-OG 2.92Å; S336-F339 WeakPolarHBondContact O-CA 3.01Å; S336-F339 VanDerWaalsContact O-CB 3.27Å; S336-F339 WeakPolarHBondContact O-CB 3.35Å; S336-F339 PolarHBondContact O-N 3.5Å; S336-F340 WeakPolarHBondContact O-CD2 3.24Å; S336-F340 PolarHBondContact O-N 3.28Å |
| 337 | N | 91.2 | Very high | 87 | Confident | 4 Ų | 4 | 37.6 Ų | 37.6 | 2% | 0.021 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -55 | -43.6 | -174.5 | -76.6 | -18.6 | 0 | 0 | 0 | 113.6 | L82 D86 C333 F339 F340 Y341 | L82-N337 HydrophobicContact CD2-CB 4.09Å; L82-N337 HydrophobicContact CG-CB 4.46Å; D86-N337 PolarHBondContact OD1-ND2 2.88Å; D86-N337 WeakPolarHBondContact OD2-CB 3.32Å; D86-N337 PolarHBondContact OD2-ND2 3.35Å; C333-N337 PolarHBondContact O-N 2.83Å; C333-N337 PolarHBondContact O-ND2 3.25Å; C333-N337 PolarHBondContact O-OD1 3.46Å; N337-F339 PolarHBondContact O-N 2.7Å; N337-F340 PolarHBondContact O-N 3.19Å; N337-Y341 HydrophobicContact CB-CD2 4.17Å; N337-Y341 WeakPolarHBondContact O-CD2 3.41Å; N337-Y341 PolarHBondContact O-N 3.48Å |
| 338 | P | 90.2 | Very high | 86.1 | Confident | 8 Ų | 8 | 37.3 Ų | 37.3 | 5% | 0.052 | 17% | 0.171 | C | C | . | . | I | π-helix | trans | -53.2 | -37 | 171.2 | -31.7 | 37.2 | 0 | 0 | 0 | 114.7 | N60 V63 T335 G342 C343 | N60-P338 HydrophobicContact CB-CG 4.29Å; N60-P338 VanDerWaalsContact CG-CG 3.49Å; N60-P338 WeakPolarHBondContact OD1-CD 3.28Å; N60-P338 WeakPolarHBondContact OD1-CG 3.38Å; V63-P338 HydrophobicContact CG2-CB 3.86Å; T335-P338 WeakPolarHBondContact O-CD 3.44Å; P338-G342 CarbonylContact O-C 3.47Å; P338-G342 WeakPolarHBondContact O-CA 2.85Å; P338-G342 PolarHBondContact O-N 3.1Å; P338-C343 PolarHBondContact O-N 3.35Å |
| 339 | F | 86.6 | Confident | 85.5 | Confident | 115 Ų | 115 | 42.1 Ų | 42.1 | 50% | 0.504 | 19% | 0.189 | S | C | . | . | I | π-helix | trans | -67.8 | -50.7 | 178.8 | -179.6 | -100 | 0 | 0 | 0 | 110.8 | S336 N337 C343 L344 | S336-F339 WeakPolarHBondContact O-CA 3.01Å; S336-F339 VanDerWaalsContact O-CB 3.27Å; S336-F339 WeakPolarHBondContact O-CB 3.35Å; S336-F339 PolarHBondContact O-N 3.5Å; N337-F339 PolarHBondContact O-N 2.7Å; F339-C343 HydrophobicContact CD2-CB 4.2Å; F339-C343 WeakPolarHBondContact O-CA 3.38Å; F339-C343 WeakPolarHBondContact O-CB 3.33Å; F339-C343 PolarHBondContact O-N 2.97Å; F339-C343 VanDerWaalsContact O-N 3.16Å; F339-L344 HydrophobicContact CE1-CD1 4.29Å; F339-L344 HydrophobicContact CE1-CD2 4.35Å; F339-L344 HydrophobicContact CE1-CG 4.36Å; F339-L344 HydrophobicContact CZ-CD2 4.35Å; F339-L344 WeakPolarHBondContact O-CG 3.4Å; F339-L344 PolarHBondContact O-N 3.03Å |
| 340 | F | 86.7 | Confident | 84.7 | Confident | 28 Ų | 28 | 40.5 Ų | 40.5 | 12% | 0.123 | 19% | 0.188 | C | C | . | . | I | π-helix | trans | -73.2 | -45.1 | -176 | -71.3 | -79.3 | 0 | 0 | 0 | 113.5 | A291 V292 Q295 S336 N337 L344 | A291-F340 HydrophobicContact CB-CD1 4.16Å; A291-F340 HydrophobicContact CB-CE1 3.7Å; A291-F340 VanDerWaalsContact O-CE1 3.3Å; A291-F340 WeakPolarHBondContact O-CE1 3.35Å; V292-F340 HydrophobicContact CG2-CB 4.04Å; V292-F340 HydrophobicContact CG2-CD1 4.17Å; V292-F340 HydrophobicContact CG2-CG 4.49Å; Q295-F340 HydrophobicContact CB-CD2 4.08Å; Q295-F340 HydrophobicContact CB-CE1 4.11Å; Q295-F340 HydrophobicContact CB-CE2 3.64Å; Q295-F340 HydrophobicContact CB-CZ 3.65Å; Q295-F340 HydrophobicContact CG-CD2 3.75Å; Q295-F340 HydrophobicContact CG-CE2 3.35Å; Q295-F340 HydrophobicContact CG-CZ 3.9Å; S336-F340 WeakPolarHBondContact O-CD2 3.24Å; S336-F340 PolarHBondContact O-N 3.28Å; N337-F340 PolarHBondContact O-N 3.19Å; F340-L344 HydrophobicContact CD1-CD1 3.75Å; F340-L344 HydrophobicContact CE1-CD1 4.36Å; F340-L344 HydrophobicContact CG-CD1 4.49Å; F340-L344 WeakPolarHBondContact O-CB 3.36Å |
| 341 | Y | 84 | Confident | 84.1 | Confident | 21 Ų | 21 | 42.9 Ų | 42.9 | 8% | 0.082 | 20% | 0.199 | C | C | . | . | I | π-helix | trans | -93.2 | -24.1 | -174.6 | -61.6 | -75.2 | 0 | 0 | 0 | 113.2 | L82 V133 I136 V292 N337 N345 | L82-Y341 HydrophobicContact CD2-CD2 3.59Å; L82-Y341 HydrophobicContact CD2-CE2 3.83Å; L82-Y341 HydrophobicContact CD2-CG 4.16Å; V133-Y341 WeakPolarHBondContact CG1-OH 3.19Å; V133-Y341 HydrophobicContact CG2-CE2 4.2Å; I136-Y341 HydrophobicContact CB-CE1 4.43Å; I136-Y341 HydrophobicContact CD1-CD1 4.2Å; I136-Y341 HydrophobicContact CD1-CE1 4.23Å; I136-Y341 HydrophobicContact CG2-CD1 3.97Å; I136-Y341 HydrophobicContact CG2-CE1 3.72Å; V292-Y341 HydrophobicContact CG1-CE1 3.92Å; V292-Y341 WeakPolarHBondContact CG1-OH 3.44Å; V292-Y341 HydrophobicContact CG2-CE1 4.37Å; N337-Y341 HydrophobicContact CB-CD2 4.17Å; N337-Y341 WeakPolarHBondContact O-CD2 3.41Å; N337-Y341 PolarHBondContact O-N 3.48Å; Y341-N345 WeakPolarHBondContact O-CB 3.48Å |
| 342 | G | 81.4 | Confident | 83.4 | Confident | 0 Ų | 0 | 43.7 Ų | 43.7 | 0% | 0 | 20% | 0.204 | C | C | . | . | I | π-helix | trans | -96.1 | -69.5 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112.8 | P338 L344 N345 | P338-G342 CarbonylContact O-C 3.47Å; P338-G342 WeakPolarHBondContact O-CA 2.85Å; P338-G342 PolarHBondContact O-N 3.1Å; G342-L344 PolarHBondContact O-N 3.45Å; G342-N345 WeakPolarHBondContact O-CB 3.2Å; G342-N345 PolarHBondContact O-N 2.95Å; G342-N345 VanDerWaalsContact O-N 3.11Å |
| 343 | C | 73.9 | Confident | 82.6 | Confident | 37 Ų | 37 | 42.7 Ų | 42.7 | 25% | 0.25 | 21% | 0.207 | C | C | . | . | I | π-helix | trans | -67.2 | -34.4 | -170.7 | -63 | 0 | 0 | 0 | 0 | 114 | P338 F339 N345 R349 | P338-C343 PolarHBondContact O-N 3.35Å; F339-C343 HydrophobicContact CD2-CB 4.2Å; F339-C343 WeakPolarHBondContact O-CA 3.38Å; F339-C343 WeakPolarHBondContact O-CB 3.33Å; F339-C343 PolarHBondContact O-N 2.97Å; F339-C343 VanDerWaalsContact O-N 3.16Å; C343-N345 VanDerWaalsContact C-N 3.29Å; C343-R349 WeakPolarHBondContact O-CB 3.5Å; C343-R349 VanDerWaalsContact O-CD 3.27Å; C343-R349 WeakPolarHBondContact O-CD 2.97Å |
| 344 | L | 72.9 | Confident | 82 | Confident | 48 Ų | 48 | 48.3 Ų | 48.3 | 25% | 0.251 | 23% | 0.231 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -78.1 | -16.4 | 175.4 | -60.6 | 179.9 | 0 | 0 | 0 | 112.7 | V288 F339 F340 G342 R346 | V288-L344 HydrophobicContact CB-CB 4.47Å; V288-L344 HydrophobicContact CB-CD1 4.44Å; V288-L344 HydrophobicContact CG1-CB 3.69Å; V288-L344 HydrophobicContact CG1-CD1 3.96Å; V288-L344 HydrophobicContact CG1-CG 4.46Å; V288-L344 HydrophobicContact CG2-CB 3.94Å; V288-L344 HydrophobicContact CG2-CD1 4.23Å; V288-L344 HydrophobicContact CG2-CD2 4.45Å; V288-L344 HydrophobicContact CG2-CG 4.44Å; F339-L344 HydrophobicContact CE1-CD1 4.29Å; F339-L344 HydrophobicContact CE1-CD2 4.35Å; F339-L344 HydrophobicContact CE1-CG 4.36Å; F339-L344 HydrophobicContact CZ-CD2 4.35Å; F339-L344 WeakPolarHBondContact O-CG 3.4Å; F339-L344 PolarHBondContact O-N 3.03Å; F340-L344 HydrophobicContact CD1-CD1 3.75Å; F340-L344 HydrophobicContact CE1-CD1 4.36Å; F340-L344 HydrophobicContact CG-CD1 4.49Å; F340-L344 WeakPolarHBondContact O-CB 3.36Å; G342-L344 PolarHBondContact O-N 3.45Å; L344-R346 PolarHBondContact O-N 2.03Å |
| 345 | N | 74.2 | Confident | 81.2 | Confident | 24 Ų | 24 | 50 Ų | 50 | 13% | 0.128 | 24% | 0.239 | C | C | . | . | S | Bend | trans | -79.4 | 107.7 | 174.1 | -174.4 | -18.9 | 0 | 0 | 0 | 110 | Y341 G342 C343 Q347 I348 R349 | Y341-N345 WeakPolarHBondContact O-CB 3.48Å; G342-N345 WeakPolarHBondContact O-CB 3.2Å; G342-N345 PolarHBondContact O-N 2.95Å; G342-N345 VanDerWaalsContact O-N 3.11Å; C343-N345 VanDerWaalsContact C-N 3.29Å; N345-Q347 PolarHBondContact O-N 2.65Å; N345-Q347 PolarHBondContact OD1-N 3.23Å; N345-I348 HydrophobicContact CB-CB 4.22Å; N345-I348 HydrophobicContact CB-CD1 4.1Å; N345-I348 HydrophobicContact CB-CG1 4.24Å; N345-I348 WeakPolarHBondContact ND2-CD1 3.47Å; N345-I348 PolarHBondContact O-N 2.65Å; N345-R349 WeakPolarHBondContact O-CB 3.21Å; N345-R349 PolarHBondContact O-N 3.45Å |
| 346 | R | 73.4 | Confident | 80.2 | Confident | 206 Ų | 206 | 54 Ų | 54 | 78% | 0.777 | 26% | 0.255 | S | S | * | . | H | α-helix | trans | -52.6 | -33.5 | -175.7 | -173.4 | 177.6 | 175.9 | 175.8 | -0.4 | 113.7 | L344 G350 | L344-R346 PolarHBondContact O-N 2.03Å; R346-G350 PolarHBondContact O-N 2.8Å |
| 347 | Q | 73.3 | Confident | 79.3 | Confident | 97 Ų | 97 | 58 Ų | 58 | 45% | 0.453 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -72.2 | -43.8 | 178.9 | -67.6 | -177.9 | -3.1 | 0 | 0 | 111.4 | L73 F76 N345 | L73-Q347 HydrophobicContact CD2-CB 3.94Å; F76-Q347 HydrophobicContact CE2-CB 4.41Å; F76-Q347 VanDerWaalsContact CZ-OE1 3.3Å; N345-Q347 PolarHBondContact O-N 2.65Å; N345-Q347 PolarHBondContact OD1-N 3.23Å |
| 348 | I | 71.8 | Confident | 78 | Confident | 0 Ų | 0 | 62 Ų | 62 | 0% | 0 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -72.8 | -45.1 | 179.5 | -60.7 | 174.6 | 0 | 0 | 0 | 110.2 | V63 V66 I67 L73 F76 V79 N345 G350 E351 L352 | V63-I348 HydrophobicContact CG1-CG2 4.46Å; V66-I348 HydrophobicContact CG1-CG2 4.43Å; I67-I348 HydrophobicContact CD1-CD1 4.37Å; L73-I348 HydrophobicContact CD1-CG1 4.24Å; L73-I348 HydrophobicContact CD2-CG1 4.08Å; F76-I348 HydrophobicContact CD2-CD1 4.38Å; F76-I348 HydrophobicContact CD2-CG1 4.41Å; F76-I348 HydrophobicContact CG-CD1 4.49Å; V79-I348 HydrophobicContact CG1-CD1 4.37Å; N345-I348 HydrophobicContact CB-CB 4.22Å; N345-I348 HydrophobicContact CB-CD1 4.1Å; N345-I348 HydrophobicContact CB-CG1 4.24Å; N345-I348 WeakPolarHBondContact ND2-CD1 3.47Å; N345-I348 PolarHBondContact O-N 2.65Å; I348-G350 VanDerWaalsContact C-N 3.29Å; I348-G350 PolarHBondContact O-N 3.19Å; I348-E351 PolarHBondContact O-N 3.22Å; I348-E351 VanDerWaalsContact O-N 3.14Å; I348-L352 WeakPolarHBondContact O-CB 3.45Å; I348-L352 PolarHBondContact O-N 3.01Å |
| 349 | R | 81 | Confident | 76.7 | Confident | 121 Ų | 121 | 68.5 Ų | 68.5 | 46% | 0.457 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -55.4 | -42.5 | 177 | -173.5 | -178.3 | 60.8 | -165.7 | 4.6 | 112.7 | C343 N345 E351 L352 S353 | C343-R349 WeakPolarHBondContact O-CB 3.5Å; C343-R349 VanDerWaalsContact O-CD 3.27Å; C343-R349 WeakPolarHBondContact O-CD 2.97Å; N345-R349 WeakPolarHBondContact O-CB 3.21Å; N345-R349 PolarHBondContact O-N 3.45Å; R349-E351 VanDerWaalsContact C-N 3.29Å; R349-E351 PolarHBondContact O-N 3.41Å; R349-L352 PolarHBondContact O-N 3.18Å; R349-S353 WeakPolarHBondContact O-CB 3.28Å; R349-S353 PolarHBondContact O-N 3.16Å; R349-S353 PolarHBondContact O-OG 3.44Å; R349-S353 VanDerWaalsContact O-OG 3.09Å |
| 350 | G | 76.6 | Confident | 75.4 | Confident | 31 Ų | 31 | 71 Ų | 71 | 32% | 0.32 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -60 | -40.2 | 179.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | R346 I348 K354 | R346-G350 PolarHBondContact O-N 2.8Å; I348-G350 VanDerWaalsContact C-N 3.29Å; I348-G350 PolarHBondContact O-N 3.19Å; G350-K354 WeakPolarHBondContact O-CG 3.37Å; G350-K354 PolarHBondContact O-N 2.97Å |
| 351 | E | 82.4 | Confident | 73.8 | Confident | 49 Ų | 49 | 77.7 Ų | 77.7 | 23% | 0.229 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -78.8 | -35.9 | 178 | -61.4 | -55.7 | 134.6 | 0 | 0 | 112.5 | V66 T70 L73 I348 R349 K354 Q355 | V66-E351 HydrophobicContact CG1-CB 3.68Å; T70-E351 HydrophobicContact CG2-CG 4.11Å; L73-E351 HydrophobicContact CD1-CB 4.13Å; L73-E351 HydrophobicContact CD1-CG 4.07Å; I348-E351 PolarHBondContact O-N 3.22Å; I348-E351 VanDerWaalsContact O-N 3.14Å; R349-E351 VanDerWaalsContact C-N 3.29Å; R349-E351 PolarHBondContact O-N 3.41Å; E351-K354 PolarHBondContact O-N 3.26Å; E351-K354 IonicContact OE1-NZ 2.73Å; E351-K354 PolarHBondContact OE1-NZ 3.4Å; E351-K354 IonicContact OE2-NZ 3.7Å; E351-Q355 PolarHBondContact O-N 3.42Å |
| 352 | L | 78.8 | Confident | 72 | Confident | 19 Ų | 19 | 80.5 Ų | 80.5 | 10% | 0.099 | 40% | 0.402 | C | S | . | . | H | α-helix | trans | -57.4 | -52 | 171.7 | -166.2 | 72.1 | 0 | 0 | 0 | 110 | A62 V66 I348 R349 K354 Q355 F356 | A62-L352 HydrophobicContact CB-CD1 4.39Å; V66-L352 HydrophobicContact CG2-CB 4.42Å; V66-L352 HydrophobicContact CG2-CD1 3.63Å; I348-L352 WeakPolarHBondContact O-CB 3.45Å; I348-L352 PolarHBondContact O-N 3.01Å; R349-L352 PolarHBondContact O-N 3.18Å; L352-K354 VanDerWaalsContact C-N 3.32Å; L352-K354 PolarHBondContact O-N 3.27Å; L352-Q355 PolarHBondContact O-N 3.44Å; L352-F356 HydrophobicContact CD1-CD2 3.9Å; L352-F356 HydrophobicContact CD1-CE2 3.52Å; L352-F356 HydrophobicContact CD2-CE2 4.28Å; L352-F356 HydrophobicContact CG-CD2 3.68Å; L352-F356 HydrophobicContact CG-CE2 3.65Å; L352-F356 WeakPolarHBondContact O-CB 3.2Å; L352-F356 VanDerWaalsContact O-CD2 3.29Å; L352-F356 WeakPolarHBondContact O-CD2 3.35Å; L352-F356 PolarHBondContact O-N 2.92Å |
| 353 | S | 79.4 | Confident | 70.4 | Confident | 63 Ų | 63 | 84.6 Ų | 84.6 | 44% | 0.441 | 44% | 0.436 | S | S | . | . | H | α-helix | trans | -60 | -38.7 | 178.2 | -62.2 | 0 | 0 | 0 | 0 | 113 | R349 V357 | R349-S353 WeakPolarHBondContact O-CB 3.28Å; R349-S353 PolarHBondContact O-N 3.16Å; R349-S353 PolarHBondContact O-OG 3.44Å; R349-S353 VanDerWaalsContact O-OG 3.09Å; S353-V357 WeakPolarHBondContact O-CB 2.86Å; S353-V357 WeakPolarHBondContact O-CG2 3.19Å; S353-V357 PolarHBondContact O-N 3.2Å |
| 354 | K | 82.1 | Confident | 68.8 | Low | 122 Ų | 122 | 88.2 Ų | 88.2 | 53% | 0.53 | 46% | 0.459 | S | S | . | . | H | α-helix | trans | -63.2 | -46.3 | 175 | -72.4 | 170.4 | -173 | 173 | 0 | 111.7 | G350 E351 L352 V357 C358 | G350-K354 WeakPolarHBondContact O-CG 3.37Å; G350-K354 PolarHBondContact O-N 2.97Å; E351-K354 PolarHBondContact O-N 3.26Å; E351-K354 IonicContact OE1-NZ 2.73Å; E351-K354 PolarHBondContact OE1-NZ 3.4Å; E351-K354 IonicContact OE2-NZ 3.7Å; L352-K354 VanDerWaalsContact C-N 3.32Å; L352-K354 PolarHBondContact O-N 3.27Å; K354-V357 PolarHBondContact O-N 2.74Å; K354-C358 WeakPolarHBondContact O-CB 3.37Å; K354-C358 PolarHBondContact O-N 2.86Å; K354-C358 PolarHBondContact O-SG 3.28Å |
| 355 | Q | 76.8 | Confident | 67.1 | Low | 37 Ų | 37 | 94.8 Ų | 94.8 | 17% | 0.173 | 49% | 0.488 | C | S | . | . | H | α-helix | trans | -65 | -45.8 | 177.8 | -72.4 | -168.2 | 16.1 | 0 | 0 | 111.4 | V66 E351 L352 V357 C358 F359 | V66-Q355 HydrophobicContact CG2-CG 4.48Å; E351-Q355 PolarHBondContact O-N 3.42Å; L352-Q355 PolarHBondContact O-N 3.44Å; Q355-V357 PolarHBondContact O-N 3.29Å; Q355-C358 PolarHBondContact O-N 2.77Å; Q355-F359 WeakPolarHBondContact O-CD2 3.45Å; Q355-F359 PolarHBondContact O-N 2.98Å |
| 356 | F | 75.5 | Confident | 65.5 | Low | 98 Ų | 98 | 103.1 Ų | 103.1 | 43% | 0.43 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -59.3 | -44.8 | 176.1 | -91.1 | -89.6 | 0 | 0 | 0 | 112 | L352 C358 F359 F360 | L352-F356 HydrophobicContact CD1-CD2 3.9Å; L352-F356 HydrophobicContact CD1-CE2 3.52Å; L352-F356 HydrophobicContact CD2-CE2 4.28Å; L352-F356 HydrophobicContact CG-CD2 3.68Å; L352-F356 HydrophobicContact CG-CE2 3.65Å; L352-F356 WeakPolarHBondContact O-CB 3.2Å; L352-F356 VanDerWaalsContact O-CD2 3.29Å; L352-F356 WeakPolarHBondContact O-CD2 3.35Å; L352-F356 PolarHBondContact O-N 2.92Å; F356-C358 PolarHBondContact O-N 2.82Å; F356-F359 PolarHBondContact O-N 3.37Å; F356-F360 HydrophobicContact CD1-CD2 4.35Å; F356-F360 AromaticContact CD1-CE2 3.99Å; F356-F360 HydrophobicContact CD1-CE2 3.99Å; F356-F360 WeakPolarHBondContact O-CD2 3.05Å; F356-F360 PolarHBondContact O-N 3.33Å |
| 357 | V | 73.4 | Confident | 63.6 | Low | 90 Ų | 90 | 99.8 Ų | 99.8 | 55% | 0.545 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -64.3 | -39.6 | 175.6 | 171.3 | 0 | 0 | 0 | 0 | 111.3 | S353 K354 Q355 K361 | S353-V357 WeakPolarHBondContact O-CB 2.86Å; S353-V357 WeakPolarHBondContact O-CG2 3.19Å; S353-V357 PolarHBondContact O-N 3.2Å; K354-V357 PolarHBondContact O-N 2.74Å; Q355-V357 PolarHBondContact O-N 3.29Å; V357-K361 WeakPolarHBondContact O-CB 3.19Å; V357-K361 PolarHBondContact O-N 3.27Å |
| 358 | C | 63 | Low | 62.1 | Low | 87 Ų | 87 | 102.5 Ų | 102.5 | 59% | 0.588 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -65.2 | -39.8 | 173.6 | -75.3 | 0 | 0 | 0 | 0 | 112.6 | K354 Q355 F356 K361 A362 | K354-C358 WeakPolarHBondContact O-CB 3.37Å; K354-C358 PolarHBondContact O-N 2.86Å; K354-C358 PolarHBondContact O-SG 3.28Å; Q355-C358 PolarHBondContact O-N 2.77Å; F356-C358 PolarHBondContact O-N 2.82Å; C358-K361 PolarHBondContact O-N 2.98Å; C358-A362 WeakPolarHBondContact O-CB 3.36Å; C358-A362 PolarHBondContact O-N 2.7Å |
| 359 | F | 64.3 | Low | 60.2 | Low | 146 Ų | 146 | 112 Ų | 112 | 64% | 0.64 | 57% | 0.572 | S | S | * | * | H | α-helix | trans | -65 | -43.1 | 176.2 | -89.9 | -74.9 | 0 | 0 | 0 | 112.2 | Q355 F356 | Q355-F359 WeakPolarHBondContact O-CD2 3.45Å; Q355-F359 PolarHBondContact O-N 2.98Å; F356-F359 PolarHBondContact O-N 3.37Å |
| 360 | F | 59.5 | Low | 57.9 | Low | 168 Ų | 168 | 112.9 Ų | 112.9 | 74% | 0.737 | 59% | 0.585 | S | S | * | * | H | α-helix | trans | -79.1 | -21.7 | 178.1 | -82.7 | -80.1 | 0 | 0 | 0 | 113.7 | F356 | F356-F360 HydrophobicContact CD1-CD2 4.35Å; F356-F360 AromaticContact CD1-CE2 3.99Å; F356-F360 HydrophobicContact CD1-CE2 3.99Å; F356-F360 WeakPolarHBondContact O-CD2 3.05Å; F356-F360 PolarHBondContact O-N 3.33Å |
| 361 | K | 52.4 | Low | 55.9 | Low | 168 Ų | 168 | 117.6 Ų | 117.6 | 73% | 0.73 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -88.9 | -11.6 | 174 | -163.7 | 170.6 | -178.1 | 175.3 | 0 | 112.6 | V357 C358 A363 P364 | V357-K361 WeakPolarHBondContact O-CB 3.19Å; V357-K361 PolarHBondContact O-N 3.27Å; C358-K361 PolarHBondContact O-N 2.98Å; K361-A363 PolarHBondContact O-N 2.95Å; K361-P364 WeakPolarHBondContact O-CD 3.5Å |
| 362 | A | 46.5 | Very low | 53.6 | Low | 79 Ų | 79 | 119.7 Ų | 119.7 | 65% | 0.653 | 63% | 0.63 | S | S | * | * | S | Bend | trans | -84.1 | 36.5 | 173.2 | 0 | 0 | 0 | 0 | 0 | 113.2 | C358 | C358-A362 WeakPolarHBondContact O-CB 3.36Å; C358-A362 PolarHBondContact O-N 2.7Å |
| 363 | A | 47.3 | Very low | 51.9 | Low | 87 Ų | 87 | 129.8 Ų | 129.8 | 72% | 0.719 | 67% | 0.667 | S | S | * | * | trans | -132.3 | 87.6 | 157.3 | 0 | 0 | 0 | 0 | 0 | 108.2 | K361 | K361-A363 PolarHBondContact O-N 2.95Š| ||
| 364 | P | 39.8 | Very low | 50.1 | Low | 112 Ų | 112 | 134 Ų | 134 | 73% | 0.727 | 68% | 0.68 | S | S | * | * | S | Bend | -127.4 | 144.4 | 129.3 | 26.3 | -11 | 0 | 0 | 0 | 110.8 | K361 | K361-P364 WeakPolarHBondContact O-CD 3.5Š| |
| 365 | E | 37.9 | Very low | 48.1 | Very low | 186 Ų | 186 | 130.5 Ų | 130.5 | 87% | 0.869 | 68% | 0.678 | S | S | * | * | trans | 6.3 | 128.7 | 168.7 | -72.5 | 177.9 | 136.1 | 0 | 0 | 119.5 | E367 | E365-E367 VanDerWaalsContact C-N 3.3Å; E365-E367 PolarHBondContact O-N 3.46Å | ||
| 366 | E | 41.1 | Very low | 46.5 | Very low | 200 Ų | 200 | 132.9 Ų | 132.9 | 94% | 0.935 | 70% | 0.699 | S | S | * | * | trans | -51 | 86.7 | 154.1 | -168.9 | 179.6 | -178.3 | 0 | 0 | 111 | ||||
| 367 | E | 33.9 | Very low | 45 | Very low | 136 Ų | 136 | 134.5 Ų | 134.5 | 64% | 0.636 | 71% | 0.711 | S | S | * | * | trans | -108.7 | 98.7 | 153.9 | -153.5 | -178.4 | 161.1 | 0 | 0 | 108.1 | E365 R369 | E365-E367 VanDerWaalsContact C-N 3.3Å; E365-E367 PolarHBondContact O-N 3.46Å; E367-R369 PolarHBondContact O-N 2.8Å; E367-R369 IonicContact OE1-CZ 3.61Å; E367-R369 IonicContact OE1-NE 3.67Å; E367-R369 IonicContact OE1-NH2 2.83Å; E367-R369 PolarHBondContact OE1-NH2 3.43Å; E367-R369 IonicContact OE2-NH2 3.71Å | ||
| 368 | L | 41.5 | Very low | 43.5 | Very low | 153 Ų | 153 | 137 Ų | 137 | 80% | 0.801 | 72% | 0.716 | S | S | * | * | trans | -55.5 | 94.2 | 171.1 | -174.8 | 76.6 | 0 | 0 | 0 | 110 | ||||
| 369 | R | 30.3 | Very low | 42.8 | Very low | 201 Ų | 201 | 140 Ų | 140 | 76% | 0.758 | 72% | 0.722 | S | S | * | * | trans | -108.6 | 104 | 162.2 | -71 | -157.9 | -177 | 140.9 | 15.4 | 110.9 | E367 | E367-R369 PolarHBondContact O-N 2.8Å; E367-R369 IonicContact OE1-CZ 3.61Å; E367-R369 IonicContact OE1-NE 3.67Å; E367-R369 IonicContact OE1-NH2 2.83Å; E367-R369 PolarHBondContact OE1-NH2 3.43Å; E367-R369 IonicContact OE2-NH2 3.71Å | ||
| 370 | L | 33.6 | Very low | 41.9 | Very low | 139 Ų | 139 | 137.9 Ų | 137.9 | 73% | 0.728 | 72% | 0.717 | S | S | * | * | trans | -45.1 | 153.8 | 160.8 | -73.7 | 155.1 | 0 | 0 | 0 | 111.6 | S372 | L370-S372 VanDerWaalsContact C-N 3.33Å; L370-S372 PolarHBondContact O-N 3.39Å | ||
| 371 | P | 35.2 | Very low | 41.1 | Very low | 129 Ų | 129 | 136 Ų | 136 | 84% | 0.838 | 71% | 0.708 | S | S | * | * | trans | -72.9 | 89.4 | 173.4 | 31 | -30.5 | 0 | 0 | 0 | 108.9 | R373 | P371-R373 PolarHBondContact O-N 3.34Š| ||
| 372 | S | 33.7 | Very low | 40.7 | Very low | 93 Ų | 93 | 132.8 Ų | 132.8 | 65% | 0.65 | 70% | 0.699 | S | S | * | * | trans | -87.4 | 110.4 | 171.4 | -180 | 0 | 0 | 0 | 0 | 109.5 | L370 E374 | L370-S372 VanDerWaalsContact C-N 3.33Å; L370-S372 PolarHBondContact O-N 3.39Å; S372-E374 PolarHBondContact O-N 2.94Å; S372-E374 VanDerWaalsContact O-N 3.07Å | ||
| 373 | R | 42 | Very low | 41 | Very low | 231 Ų | 231 | 135.9 Ų | 135.9 | 87% | 0.872 | 70% | 0.7 | S | S | * | * | trans | -77.8 | 50.1 | 173.7 | -173.6 | -174.5 | 164.5 | 172.8 | -4.3 | 109.7 | P371 | P371-R373 PolarHBondContact O-N 3.34Š| ||
| 374 | E | 41.9 | Very low | 40.9 | Very low | 152 Ų | 152 | 139.2 Ų | 139.2 | 71% | 0.71 | 70% | 0.699 | S | S | * | * | trans | -134.6 | 30.3 | -173 | -111.7 | 76 | -149 | 0 | 0 | 113.9 | S372 | S372-E374 PolarHBondContact O-N 2.94Å; S372-E374 VanDerWaalsContact O-N 3.07Å | ||
| 375 | G | 40.9 | Very low | 41.2 | Very low | 48 Ų | 48 | 138.9 Ų | 138.9 | 50% | 0.495 | 69% | 0.69 | S | S | . | * | S | Bend | trans | -111.4 | -14.2 | 174.8 | 0 | 0 | 0 | 0 | 0 | 115.7 | ||
| 376 | S | 42.8 | Very low | 41.6 | Very low | 87 Ų | 87 | 138.3 Ų | 138.3 | 61% | 0.608 | 69% | 0.687 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -91.4 | -10.5 | -168.9 | -176.4 | 0 | 0 | 0 | 0 | 114.6 | N380 | S376-N380 PolarHBondContact O-ND2 2.92Š|
| 377 | I | 44.4 | Very low | 41.5 | Very low | 133 Ų | 133 | 131.7 Ų | 131.7 | 68% | 0.682 | 67% | 0.673 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -98.9 | -32.2 | -173.5 | -61.2 | 176.1 | 0 | 0 | 0 | 111.4 | N380 F381 | I377-N380 PolarHBondContact O-N 3.43Å; I377-F381 PolarHBondContact O-N 2.66Å; I377-F381 VanDerWaalsContact O-N 3.1Å |
| 378 | E | 41.9 | Very low | 41.6 | Very low | 143 Ų | 143 | 131.3 Ų | 131.3 | 67% | 0.668 | 68% | 0.68 | S | S | * | * | H | α-helix | trans | -77.7 | -33.5 | -176.9 | -158.1 | 156.5 | -179.4 | 0 | 0 | 112.8 | N380 F381 L382 | E378-N380 VanDerWaalsContact C-N 3.32Å; E378-N380 PolarHBondContact O-N 3.1Å; E378-F381 PolarHBondContact O-N 3.44Å; E378-L382 PolarHBondContact O-N 3.12Å; E378-L382 VanDerWaalsContact O-N 3.07Å |
| 379 | E | 47.6 | Very low | 41.1 | Very low | 149 Ų | 149 | 129.2 Ų | 129.2 | 70% | 0.696 | 68% | 0.679 | S | S | * | * | H | α-helix | trans | -65.7 | -34.4 | 171.9 | -68.4 | -175.2 | 161.6 | 0 | 0 | 112.1 | Q383 | E379-Q383 WeakPolarHBondContact O-CB 3.37Å; E379-Q383 PolarHBondContact O-N 3.49Å |
| 380 | N | 46.1 | Very low | 41.1 | Very low | 102 Ų | 102 | 127.6 Ų | 127.6 | 55% | 0.545 | 68% | 0.679 | S | S | . | * | H | α-helix | trans | -74.2 | -30.3 | 174.2 | -82.2 | -61.1 | 0 | 0 | 0 | 112.7 | S376 I377 E378 F384 | S376-N380 PolarHBondContact O-ND2 2.92Å; I377-N380 PolarHBondContact O-N 3.43Å; E378-N380 VanDerWaalsContact C-N 3.32Å; E378-N380 PolarHBondContact O-N 3.1Å; N380-F384 WeakPolarHBondContact O-CB 3.37Å; N380-F384 PolarHBondContact O-N 2.78Å; N380-F384 VanDerWaalsContact O-N 3.12Å |
| 381 | F | 41.7 | Very low | 40.8 | Very low | 127 Ų | 127 | 127.2 Ų | 127.2 | 56% | 0.557 | 68% | 0.678 | S | S | * | * | H | α-helix | trans | -75.5 | -37 | 179.7 | -161.6 | -102 | 0 | 0 | 0 | 112.3 | I377 E378 F384 L385 | I377-F381 PolarHBondContact O-N 2.66Å; I377-F381 VanDerWaalsContact O-N 3.1Å; E378-F381 PolarHBondContact O-N 3.44Å; F381-F384 PolarHBondContact O-N 3.13Å; F381-L385 HydrophobicContact CD1-CD1 3.94Å; F381-L385 HydrophobicContact CE1-CD1 3.86Å; F381-L385 WeakPolarHBondContact O-CG 3.37Å; F381-L385 PolarHBondContact O-N 3.2Å; F381-L385 VanDerWaalsContact O-N 3.1Å |
| 382 | L | 45.3 | Very low | 40.4 | Very low | 101 Ų | 101 | 132 Ų | 132 | 53% | 0.529 | 68% | 0.68 | S | S | . | * | H | α-helix | trans | -74.2 | -31.9 | 175.5 | -71.4 | 170.5 | 0 | 0 | 0 | 112.6 | E378 F384 L385 Q386 | E378-L382 PolarHBondContact O-N 3.12Å; E378-L382 VanDerWaalsContact O-N 3.07Å; L382-F384 VanDerWaalsContact C-N 3.32Å; L382-L385 HydrophobicContact CD2-CD1 4.46Å; L382-L385 PolarHBondContact O-N 3.31Å; L382-Q386 PolarHBondContact O-N 3.49Å; L382-Q386 VanDerWaalsContact O-N 3.15Å |
| 383 | Q | 52.1 | Low | 40.2 | Very low | 144 Ų | 144 | 133 Ų | 133 | 67% | 0.673 | 68% | 0.682 | S | S | * | * | H | α-helix | trans | -72.4 | -26.6 | 173.3 | -156.9 | 163.2 | 21.4 | 0 | 0 | 112.4 | E379 | E379-Q383 WeakPolarHBondContact O-CB 3.37Å; E379-Q383 PolarHBondContact O-N 3.49Å |
| 384 | F | 44.9 | Very low | 39.6 | Very low | 158 Ų | 158 | 127.1 Ų | 127.1 | 69% | 0.693 | 68% | 0.676 | S | S | * | * | H | α-helix | trans | -72.7 | -35.8 | 169.2 | -176.5 | -100.5 | 0 | 0 | 0 | 112.6 | N380 F381 L382 | N380-F384 WeakPolarHBondContact O-CB 3.37Å; N380-F384 PolarHBondContact O-N 2.78Å; N380-F384 VanDerWaalsContact O-N 3.12Å; F381-F384 PolarHBondContact O-N 3.13Å; L382-F384 VanDerWaalsContact C-N 3.32Å |
| 385 | L | 45.5 | Very low | 38.9 | Very low | 105 Ų | 105 | 131.2 Ų | 131.2 | 55% | 0.55 | 69% | 0.685 | S | S | . | * | H | α-helix | trans | -76.3 | -20.9 | 178.1 | -72.6 | 171.4 | 0 | 0 | 0 | 114.1 | F381 L382 | F381-L385 HydrophobicContact CD1-CD1 3.94Å; F381-L385 HydrophobicContact CE1-CD1 3.86Å; F381-L385 WeakPolarHBondContact O-CG 3.37Å; F381-L385 PolarHBondContact O-N 3.2Å; F381-L385 VanDerWaalsContact O-N 3.1Å; L382-L385 HydrophobicContact CD2-CD1 4.46Å; L382-L385 PolarHBondContact O-N 3.31Å |
| 386 | Q | 46.3 | Very low | 38.5 | Very low | 173 Ų | 173 | 134.4 Ų | 134.4 | 81% | 0.808 | 70% | 0.697 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92.9 | -3 | 177 | -78.8 | 178.2 | -24.8 | 0 | 0 | 114.3 | L382 | L382-Q386 PolarHBondContact O-N 3.49Å; L382-Q386 VanDerWaalsContact O-N 3.15Å |
| 387 | G | 40.7 | Very low | 38.1 | Very low | 62 Ų | 62 | 137.7 Ų | 137.7 | 64% | 0.639 | 71% | 0.706 | S | S | * | * | S | Bend | trans | -85.7 | -0.1 | -178.5 | 0 | 0 | 0 | 0 | 0 | 116.1 | ||
| 388 | T | 36 | Very low | 37.6 | Very low | 127 Ų | 127 | 137 Ų | 137 | 78% | 0.779 | 71% | 0.711 | S | S | * | * | trans | -138.1 | 78.7 | -174.9 | 30.8 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 389 | S | 30.3 | Very low | 37 | Very low | 110 Ų | 110 | 135.1 Ų | 135.1 | 77% | 0.769 | 71% | 0.713 | S | S | * | * | trans | -139.6 | 117.8 | 152.1 | -166.4 | 0 | 0 | 0 | 0 | 110 | ||||
| 390 | E | 29.9 | Very low | 36.8 | Very low | 166 Ų | 166 | 133.3 Ų | 133.3 | 78% | 0.776 | 72% | 0.715 | S | S | * | * | S | Bend | trans | 92.2 | 98.5 | 163.6 | -53.1 | -160.9 | 150.5 | 0 | 0 | 120.3 | ||
| 391 | N | 28.1 | Very low | 35.9 | Very low | 132 Ų | 132 | 137.2 Ų | 137.2 | 71% | 0.706 | 73% | 0.727 | S | S | * | * | trans | 70.1 | 105.9 | 136.4 | -60.2 | -23.2 | 0 | 0 | 0 | 119 | ||||
| 392 | W | 27 | Very low | 35.3 | Very low | 229 Ų | 229 | 138.7 Ų | 138.7 | 87% | 0.867 | 74% | 0.735 | S | S | * | * | -178.3 | 114.6 | 89.4 | -93.1 | 91.1 | 0 | 0 | 0 | 110.3 | |||||
| 393 | V | 28.3 | Very low | 34.5 | Very low | 114 Ų | 114 | 141.7 Ų | 141.7 | 69% | 0.691 | 75% | 0.747 | S | S | * | * | 52.8 | 121.1 | 126.5 | 178 | 0 | 0 | 0 | 0 | 120.1 | |||||
| 394 | S | 29.1 | Very low | 33.7 | Very low | 107 Ų | 107 | 140.2 Ų | 140.2 | 75% | 0.748 | 75% | 0.75 | S | S | * | * | trans | 99.9 | 96.9 | 151.7 | -57.5 | 0 | 0 | 0 | 0 | 120.3 | ||||
| 395 | R | 28.9 | Very low | 33.4 | Very low | 239 Ų | 239 | 138.3 Ų | 138.3 | 90% | 0.902 | 75% | 0.753 | S | S | * | * | trans | 3.4 | 167.4 | 133.7 | -70.1 | -173.9 | -159.2 | -171.8 | 5.8 | 119.8 | ||||
| 396 | P | 31.5 | Very low | 33.4 | Very low | 114 Ų | 114 | 139 Ų | 139 | 74% | 0.74 | 76% | 0.764 | S | S | * | * | cis | -133.9 | 160.7 | -32 | 33.7 | -15.8 | 0 | 0 | 0 | 113.5 | ||||
| 397 | L | 34.3 | Very low | 32.5 | Very low | 156 Ų | 156 | 135.1 Ų | 135.1 | 82% | 0.817 | 76% | 0.762 | S | S | * | * | trans | -75.6 | 157.9 | 161.4 | -169.2 | 71.2 | 0 | 0 | 0 | 110.6 | ||||
| 398 | P | 34.5 | Very low | 32.1 | Very low | 119 Ų | 119 | 138.2 Ų | 138.2 | 77% | 0.773 | 77% | 0.767 | S | S | * | * | trans | -127 | 115.1 | 136 | 30.1 | -16.4 | 0 | 0 | 0 | 113.5 | ||||
| 399 | S | 28.1 | Very low | 31.7 | Very low | 103 Ų | 103 | 138.9 Ų | 138.9 | 72% | 0.72 | 77% | 0.766 | S | S | * | * | trans | 42.9 | 137.3 | 130.2 | -134.5 | 0 | 0 | 0 | 0 | 123.4 | ||||
| 400 | P | 43.4 | Very low | 31.6 | Very low | 112 Ų | 112 | 143.4 Ų | 143.4 | 73% | 0.727 | 77% | 0.773 | S | S | * | * | trans | -98.1 | 161 | 178 | 40.3 | -33.9 | 0 | 0 | 0 | 113.3 | ||||
| 401 | K | 27.9 | Very low | 31.7 | Very low | 183 Ų | 183 | 146.3 Ų | 146.3 | 80% | 0.796 | 78% | 0.776 | S | S | * | * | trans | -150.9 | 116.9 | 160.1 | -74.9 | -162.7 | 176.3 | -178.4 | 0 | 110.3 | ||||
| 402 | Q | 28.4 | Very low | 32 | Very low | 158 Ų | 158 | 147.9 Ų | 147.9 | 74% | 0.738 | 78% | 0.783 | S | S | * | * | 73 | 135.7 | 109.2 | -77.7 | 175.9 | -48.2 | 0 | 0 | 113.7 | |||||
| 403 | E | 29.3 | Very low | 32.2 | Very low | 165 Ų | 165 | 142.9 Ų | 142.9 | 77% | 0.771 | 78% | 0.78 | S | S | * | * | cis | -172.1 | -161.5 | -3.8 | -151.1 | 175.7 | -177.5 | 0 | 0 | 105.9 | ||||
| 404 | P | 35.2 | Very low | 32.4 | Very low | 113 Ų | 113 | 141.5 Ų | 141.5 | 73% | 0.734 | 79% | 0.789 | S | S | * | * | -104.5 | -173.1 | -118.5 | 44 | -26.7 | 0 | 0 | 0 | 116.6 | |||||
| 405 | P | 39.1 | Very low | 32.4 | Very low | 117 Ų | 117 | 145.1 Ų | 145.1 | 76% | 0.76 | 79% | 0.794 | S | S | * | * | trans | -102 | -162.9 | -154.4 | 44.5 | -38.2 | 0 | 0 | 0 | 114.1 | ||||
| 406 | P | 45.7 | Very low | 32.5 | Very low | 120 Ų | 120 | 141 Ų | 141 | 78% | 0.779 | 79% | 0.789 | S | S | * | * | cis | -122.9 | 168 | -36 | 26.6 | -6.9 | 0 | 0 | 0 | 113 | ||||
| 407 | A | 27.6 | Very low | 32.5 | Very low | 92 Ų | 92 | 139.8 Ų | 139.8 | 76% | 0.76 | 79% | 0.788 | S | S | * | * | 154.2 | 144.2 | 130 | 0 | 0 | 0 | 0 | 0 | 113.9 | |||||
| 408 | V | 32 | Very low | 32.6 | Very low | 126 Ų | 126 | 141.4 Ų | 141.4 | 76% | 0.764 | 79% | 0.791 | S | S | * | * | trans | 91.8 | 105.1 | 157.2 | -162.1 | 0 | 0 | 0 | 0 | 119.1 | ||||
| 409 | D | 27.5 | Very low | 32.5 | Very low | 141 Ų | 141 | 144.3 Ų | 144.3 | 75% | 0.754 | 80% | 0.795 | S | S | * | * | trans | 51.1 | 118.6 | 145.3 | -62.6 | -20.5 | 0 | 0 | 0 | 122.7 | ||||
| 410 | F | 28.1 | Very low | 32.9 | Very low | 206 Ų | 206 | 145 Ų | 145 | 90% | 0.904 | 80% | 0.795 | S | S | * | * | -154.8 | 146.8 | 129.4 | -114.7 | -83.1 | 0 | 0 | 0 | 112.7 | |||||
| 411 | R | 31.4 | Very low | 32.7 | Very low | 226 Ų | 226 | 145.6 Ų | 145.6 | 85% | 0.853 | 80% | 0.802 | S | S | * | * | trans | -57.6 | 152.1 | -162.5 | -66.8 | 174.5 | -174.6 | -166.7 | 1 | 118.7 | ||||
| 412 | I | 33.8 | Very low | 33.4 | Very low | 165 Ų | 165 | 144.6 Ų | 144.6 | 85% | 0.846 | 80% | 0.8 | S | S | * | * | trans | -120.1 | 130.9 | 149.5 | -57.7 | 175.3 | 0 | 0 | 0 | 108.2 | ||||
| 413 | P | 32.3 | Very low | 33.7 | Very low | 124 Ų | 124 | 144.9 Ų | 144.9 | 81% | 0.805 | 80% | 0.799 | S | S | * | * | trans | -87.5 | 139.5 | 176 | -0.6 | 19.3 | 0 | 0 | 0 | 112.8 | ||||
| 414 | G | 31.9 | Very low | 34.3 | Very low | 86 Ų | 86 | 144.3 Ų | 144.3 | 89% | 0.887 | 80% | 0.8 | S | S | * | * | trans | 121.7 | 72.6 | 154.7 | 0 | 0 | 0 | 0 | 0 | 116.8 | ||||
| 415 | Q | 28.9 | Very low | 34.6 | Very low | 183 Ų | 183 | 146.9 Ų | 146.9 | 86% | 0.855 | 80% | 0.803 | S | S | * | * | trans | -134.2 | 137.9 | 160.9 | -146.8 | 177.8 | 10 | 0 | 0 | 103.5 | ||||
| 416 | I | 32.4 | Very low | 34.6 | Very low | 152 Ų | 152 | 148.6 Ų | 148.6 | 78% | 0.779 | 80% | 0.801 | S | S | * | * | -177.5 | 153.2 | 72.3 | -70.7 | 164.3 | 0 | 0 | 0 | 109.1 | |||||
| 417 | A | 31.7 | Very low | 34.3 | Very low | 88 Ų | 88 | 148.7 Ų | 148.7 | 73% | 0.727 | 79% | 0.791 | S | S | * | * | trans | 76.3 | 121.6 | 147.3 | 0 | 0 | 0 | 0 | 0 | 123.1 | ||||
| 418 | E | 35 | Very low | 34.9 | Very low | 190 Ų | 190 | 150.6 Ų | 150.6 | 89% | 0.888 | 79% | 0.787 | S | S | * | * | trans | -54.2 | 135.7 | 142 | -72.6 | 171.4 | 125.2 | 0 | 0 | 111.3 | ||||
| 419 | E | 33 | Very low | 35.5 | Very low | 180 Ų | 180 | 149.1 Ų | 149.1 | 84% | 0.841 | 78% | 0.779 | S | S | * | * | -176.2 | 145.8 | 123.8 | -104.7 | 178.9 | 176.4 | 0 | 0 | 112.2 | |||||
| 420 | T | 36.3 | Very low | 36.2 | Very low | 118 Ų | 118 | 145.5 Ų | 145.5 | 72% | 0.724 | 76% | 0.764 | S | S | * | * | trans | 79.1 | 85.1 | 158.9 | 53.6 | 0 | 0 | 0 | 0 | 120 | E422 | T420-E422 PolarHBondContact O-N 3.4Š| ||
| 421 | S | 39.9 | Very low | 36.8 | Very low | 124 Ų | 124 | 141.9 Ų | 141.9 | 87% | 0.867 | 75% | 0.754 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77.1 | 30.4 | 162.8 | 50.9 | 0 | 0 | 0 | 0 | 114.8 | ||
| 422 | E | 41.7 | Very low | 37.4 | Very low | 163 Ų | 163 | 137.9 Ų | 137.9 | 76% | 0.762 | 75% | 0.748 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -112.2 | -1.1 | -179.1 | -79 | -168.3 | 145.4 | 0 | 0 | 114.9 | T420 | T420-E422 PolarHBondContact O-N 3.4Š|
| 423 | F | 35.9 | Very low | 38 | Very low | 163 Ų | 163 | 137.1 Ų | 137.1 | 72% | 0.715 | 74% | 0.743 | S | S | * | * | S | Bend | trans | -100.6 | -5.1 | -178.2 | -134.2 | -94.4 | 0 | 0 | 0 | 114.7 | ||
| 424 | L | 40 | Very low | 38.4 | Very low | 153 Ų | 153 | 136 Ų | 136 | 80% | 0.801 | 74% | 0.738 | S | S | * | * | S | Bend | trans | -97.8 | -14.6 | -175.9 | -143.2 | 86.2 | 0 | 0 | 0 | 114.5 | ||
| 425 | E | 42.7 | Very low | 38.7 | Very low | 168 Ų | 168 | 139.7 Ų | 139.7 | 79% | 0.785 | 74% | 0.737 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89.7 | -22.4 | 179.8 | -120.5 | -170.5 | 141.6 | 0 | 0 | 113.6 | T429 | E425-T429 PolarHBondContact O-OG1 3.03Š|
| 426 | Q | 38.7 | Very low | 39.3 | Very low | 153 Ų | 153 | 135 Ų | 135 | 72% | 0.715 | 73% | 0.725 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84.4 | -18.8 | 176.6 | -83.4 | 179 | -14.3 | 0 | 0 | 113.9 | ||
| 427 | Q | 38.7 | Very low | 39.6 | Very low | 122 Ų | 122 | 137.6 Ų | 137.6 | 57% | 0.57 | 73% | 0.727 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87.3 | -23.3 | 178.6 | -146 | 121.6 | -16.6 | 0 | 0 | 112.5 | ||
| 428 | L | 40 | Very low | 39.8 | Very low | 131 Ų | 131 | 141.9 Ų | 141.9 | 69% | 0.686 | 74% | 0.736 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84.7 | -14.2 | 179.8 | -146.3 | 82.6 | 0 | 0 | 0 | 113.4 | ||
| 429 | T | 45.3 | Very low | 39.8 | Very low | 96 Ų | 96 | 144.5 Ų | 144.5 | 59% | 0.589 | 74% | 0.738 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -96.5 | -13.9 | 179.9 | 31.4 | 0 | 0 | 0 | 0 | 114.2 | E425 | E425-T429 PolarHBondContact O-OG1 3.03Š|
| 430 | S | 42.7 | Very low | 40 | Very low | 65 Ų | 65 | 141.6 Ų | 141.6 | 46% | 0.455 | 74% | 0.735 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -89 | -26.3 | 174.6 | 72.4 | 0 | 0 | 0 | 0 | 113.8 | S434 | S430-S434 PolarHBondContact O-OG 3.48Š|
| 431 | D | 40.4 | Very low | 40.3 | Very low | 129 Ų | 129 | 140.8 Ų | 140.8 | 69% | 0.69 | 74% | 0.74 | S | S | * | * | S | Bend | trans | -80 | -14.5 | -179.4 | -82.8 | -15.5 | 0 | 0 | 0 | 113.9 | ||
| 432 | I | 44.5 | Very low | 40.3 | Very low | 142 Ų | 142 | 140.5 Ų | 140.5 | 73% | 0.728 | 74% | 0.735 | S | S | * | * | S | Bend | trans | -90.8 | -15.4 | 177.2 | -61.3 | 178.6 | 0 | 0 | 0 | 112.2 | ||
| 433 | M | 45.1 | Very low | 39.8 | Very low | 150 Ų | 150 | 138 Ų | 138 | 74% | 0.739 | 74% | 0.735 | S | S | * | * | S | Bend | trans | -97.5 | -5.4 | -177.1 | -135.8 | -172.9 | -67.7 | 0 | 0 | 114.7 | ||
| 434 | S | 41.2 | Very low | 39.7 | Very low | 99 Ų | 99 | 139.8 Ų | 139.8 | 69% | 0.692 | 75% | 0.746 | S | S | * | * | S | Bend | trans | -98.2 | -2.6 | -173.7 | -62.5 | 0 | 0 | 0 | 0 | 115.6 | S430 | S430-S434 PolarHBondContact O-OG 3.48Š|
| 435 | D | 39.1 | Very low | 39.7 | Very low | 164 Ų | 164 | 143.4 Ų | 143.4 | 88% | 0.877 | 75% | 0.749 | S | S | * | * | S | Bend | trans | -104.9 | 15.5 | -174.3 | -127.1 | 5 | 0 | 0 | 0 | 114.4 | ||
| 436 | S | 41.1 | Very low | 39.6 | Very low | 86 Ų | 86 | 143 Ų | 143 | 60% | 0.601 | 75% | 0.752 | S | S | * | * | S | Bend | trans | -112.9 | 7.1 | -176.3 | 51.7 | 0 | 0 | 0 | 0 | 115.8 | ||
| 437 | Y | 38 | Very low | 39.7 | Very low | 206 Ų | 206 | 145 Ų | 145 | 81% | 0.808 | 76% | 0.761 | S | S | * | * | S | Bend | trans | -131.9 | 96.6 | 172.8 | -74.9 | -87.5 | 0 | 0 | 0 | 110.1 | ||
| 438 | L | 35.8 | Very low | 39.8 | Very low | 177 Ų | 177 | 148.6 Ų | 148.6 | 93% | 0.927 | 80% | 0.8 | S | S | * | * | trans | 167.2 | 90.2 | 144.2 | -89 | 154.7 | 0 | 0 | 0 | 110.3 | ||||
| 439 | R | 35.3 | Very low | 39.8 | Very low | 246 Ų | 246 | 149.5 Ų | 149.5 | 93% | 0.928 | 81% | 0.805 | S | S | * | * | trans | -159.6 | 142.1 | 142.3 | -112.6 | -177.9 | -136 | -171.2 | 6.4 | 112.3 | ||||
| 440 | P | 37.9 | Very low | 39.5 | Very low | 118 Ų | 118 | 152.3 Ų | 152.3 | 77% | 0.766 | 82% | 0.817 | S | S | * | * | trans | -88.8 | 153.4 | -165.1 | 35.4 | -33 | 0 | 0 | 0 | 113.6 | ||||
| 441 | A | 41.7 | Very low | 39.3 | Very low | 101 Ų | 101 | 157.2 Ų | 157.2 | 84% | 0.835 | 84% | 0.837 | S | S | * | * | trans | -73.8 | 148.9 | 177.6 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 442 | P | 39.7 | Very low | 39.2 | Very low | 119 Ų | 119 | 158.8 Ų | 158.8 | 77% | 0.773 | 85% | 0.845 | S | S | * | * | trans | -114.2 | 121.2 | 153 | 32.3 | -19.1 | 0 | 0 | 0 | 112.2 | ||||
| 443 | S | 32 | Very low | 38.9 | Very low | 109 Ų | 109 | 159.9 Ų | 159.9 | 76% | 0.762 | 85% | 0.853 | S | S | * | * | trans | 14.4 | 111.5 | 139 | 161 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 444 | Q | 35 | Very low | 38.5 | Very low | 201 Ų | 201 | 160.5 Ų | 160.5 | 94% | 0.939 | 86% | 0.86 | S | S | * | * | trans | -95.5 | 122.5 | 151.6 | -80.8 | -172 | -18.2 | 0 | 0 | 110 | ||||
| 445 | R | 38.6 | Very low | 38.3 | Very low | 230 Ų | 230 | 164.9 Ų | 164.9 | 87% | 0.868 | 87% | 0.872 | S | S | * | * | trans | -106.7 | 137 | 166.5 | -173.9 | -177.8 | -85.7 | -165.3 | -4.6 | 107.1 | ||||
| 446 | L | 42 | Very low | 38.3 | Very low | 160 Ų | 160 | 165 Ų | 165 | 84% | 0.838 | 87% | 0.872 | S | S | * | * | trans | -28.1 | 143.2 | 173.8 | -93.8 | 72 | 0 | 0 | 0 | 116.1 | ||||
| 447 | E | 39.9 | Very low | 38 | Very low | 194 Ų | 194 | 171.6 Ų | 171.6 | 91% | 0.907 | 90% | 0.895 | S | S | * | * | -164.5 | 145.9 | 119 | -103.9 | 177.4 | 156.9 | 0 | 0 | 111.9 | |||||
| 448 | S | 40.5 | Very low | 38 | Very low | 198 Ų | 198 | 168.5 Ų | 168.5 | 100% | 1.385 | 90% | 0.902 | S | S | * | * | trans | 67.6 | 0 | -178.1 | 77.6 | 0 | 0 | 0 | 0 | 119.4 |
Retrieved 448 of 448 residues in 71.7 ms
(Link to these results)