| 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 | 46.8 | Very low | 43.7 | Very low | 247 Ų | 247 | 193.3 Ų | 193.3 | 100% | 1.217 | 89% | 0.887 | S | S | * | * | 0 | 100.1 | 0 | -82.6 | 171.8 | 128.5 | 0 | 0 | 109.5 | |||||
| 2 | M | 40.9 | Very low | 43.3 | Very low | 195 Ų | 195 | 186.7 Ų | 186.7 | 96% | 0.961 | 88% | 0.877 | S | S | * | * | trans | -149.9 | 116.6 | 161.1 | -81.3 | -157.2 | -172.6 | 0 | 0 | 108.9 | ||||
| 3 | K | 43.5 | Very low | 43.3 | Very low | 199 Ų | 199 | 181.7 Ų | 181.7 | 87% | 0.865 | 87% | 0.867 | S | S | * | * | trans | -69.1 | 122.2 | 177.6 | -81.4 | 173.7 | 172.2 | 176.3 | 0 | 109.7 | ||||
| 4 | R | 45 | Very low | 43.2 | Very low | 252 Ų | 252 | 178.6 Ų | 178.6 | 95% | 0.951 | 85% | 0.852 | S | S | * | * | trans | -88.5 | 109.6 | 168.1 | -153.7 | 177.1 | -130.6 | -166.8 | 2.3 | 107.9 | ||||
| 5 | Q | 44 | Very low | 43.1 | Very low | 167 Ų | 167 | 175.4 Ų | 175.4 | 78% | 0.78 | 85% | 0.848 | S | S | * | * | trans | -72.9 | 121.8 | 178.6 | -73.8 | -80.6 | -21.7 | 0 | 0 | 110 | ||||
| 6 | E | 46.8 | Very low | 43.1 | Very low | 183 Ų | 183 | 177.2 Ų | 177.2 | 86% | 0.855 | 84% | 0.843 | S | S | * | * | trans | -84.4 | 107.4 | 175.7 | -155 | 177.9 | 134.5 | 0 | 0 | 108.4 | A8 | E6-A8 PolarHBondContact O-N 3.39Š| ||
| 7 | K | 43.3 | Very low | 43.4 | Very low | 206 Ų | 206 | 175 Ų | 175 | 90% | 0.896 | 84% | 0.837 | S | S | * | * | trans | -82.4 | 96.4 | 171.6 | -86.6 | -171.9 | 177.1 | -172.9 | 0 | 108.9 | H9 | K7-H9 PolarHBondContact O-N 3.32Š| ||
| 8 | A | 44.3 | Very low | 43.4 | Very low | 90 Ų | 90 | 171.5 Ų | 171.5 | 74% | 0.744 | 83% | 0.831 | S | S | * | * | trans | -62.5 | 114 | 167 | 0 | 0 | 0 | 0 | 0 | 109.9 | E6 F10 | E6-A8 PolarHBondContact O-N 3.39Å; A8-F10 PolarHBondContact O-N 3.29Å; A8-F10 VanDerWaalsContact O-N 3.15Å | ||
| 9 | H | 41.2 | Very low | 43.6 | Very low | 178 Ų | 178 | 167.7 Ų | 167.7 | 82% | 0.824 | 82% | 0.819 | S | S | * | * | trans | -82.2 | 88.3 | 176.9 | -142.4 | -60.2 | 0 | 0 | 0 | 108.5 | K7 R11 | K7-H9 PolarHBondContact O-N 3.32Å; H9-R11 PolarHBondContact O-N 3.47Å | ||
| 10 | F | 41.4 | Very low | 44 | Very low | 199 Ų | 199 | 162.3 Ų | 162.3 | 87% | 0.873 | 80% | 0.799 | S | S | * | * | trans | -70.9 | 96.3 | 174.9 | -142.1 | -97.6 | 0 | 0 | 0 | 108.8 | A8 C12 | A8-F10 PolarHBondContact O-N 3.29Å; A8-F10 VanDerWaalsContact O-N 3.15Å; F10-C12 PolarHBondContact O-N 3.14Å | ||
| 11 | R | 42.9 | Very low | 44.2 | Very low | 210 Ų | 210 | 161.9 Ų | 161.9 | 79% | 0.792 | 80% | 0.795 | S | S | * | * | trans | -82.6 | 99.9 | 174.1 | -169.9 | 179.2 | -67 | -129.1 | 0.7 | 107.5 | H9 T13 | H9-R11 PolarHBondContact O-N 3.47Å; R11-T13 PolarHBondContact O-N 3.21Å | ||
| 12 | C | 39.7 | Very low | 44.2 | Very low | 114 Ų | 114 | 158.9 Ų | 158.9 | 77% | 0.77 | 78% | 0.775 | S | S | * | * | trans | -60.3 | 107 | 172.6 | -160.8 | 0 | 0 | 0 | 0 | 109 | F10 E14 | F10-C12 PolarHBondContact O-N 3.14Å; C12-E14 PolarHBondContact O-N 3.44Å; C12-E14 VanDerWaalsContact O-N 3.15Å | ||
| 13 | T | 42.7 | Very low | 44.4 | Very low | 122 Ų | 122 | 156.5 Ų | 156.5 | 75% | 0.748 | 76% | 0.762 | S | S | * | * | trans | -75.7 | 93.2 | 171.5 | 21.1 | 0 | 0 | 0 | 0 | 108.4 | R11 T15 | R11-T13 PolarHBondContact O-N 3.21Å; T13-T15 PolarHBondContact O-N 3.5Å | ||
| 14 | E | 42.7 | Very low | 44.7 | Very low | 139 Ų | 139 | 154.6 Ų | 154.6 | 65% | 0.65 | 75% | 0.749 | S | S | * | * | trans | -69.3 | 95.3 | 171.5 | -162.2 | 175.4 | 120.4 | 0 | 0 | 109.1 | C12 R16 | C12-E14 PolarHBondContact O-N 3.44Å; C12-E14 VanDerWaalsContact O-N 3.15Å; E14-R16 VanDerWaalsContact C-N 3.26Å; E14-R16 PolarHBondContact O-N 3.43Å; E14-R16 IonicContact OE1-CZ 3.53Å; E14-R16 IonicContact OE1-NE 3.44Å; E14-R16 PolarHBondContact OE1-NE 3.39Å; E14-R16 IonicContact OE1-NH2 2.84Å; E14-R16 PolarHBondContact OE1-NH2 3.2Å | ||
| 15 | T | 40.6 | Very low | 44.8 | Very low | 130 Ų | 130 | 145.4 Ų | 145.4 | 80% | 0.798 | 73% | 0.727 | S | S | * | * | trans | -69.8 | 84.6 | 169.9 | 36.7 | 0 | 0 | 0 | 0 | 109.2 | T13 L17 | T13-T15 PolarHBondContact O-N 3.5Å; T15-L17 PolarHBondContact O-N 3.03Å; T15-L17 VanDerWaalsContact O-N 3.07Å | ||
| 16 | R | 43 | Very low | 44.9 | Very low | 204 Ų | 204 | 139.4 Ų | 139.4 | 77% | 0.77 | 71% | 0.706 | S | S | * | * | trans | -73.2 | 97.2 | 175.8 | -153.5 | 176.1 | -71.8 | -157.2 | -4.1 | 109.6 | E14 | E14-R16 VanDerWaalsContact C-N 3.26Å; E14-R16 PolarHBondContact O-N 3.43Å; E14-R16 IonicContact OE1-CZ 3.53Å; E14-R16 IonicContact OE1-NE 3.44Å; E14-R16 PolarHBondContact OE1-NE 3.39Å; E14-R16 IonicContact OE1-NH2 2.84Å; E14-R16 PolarHBondContact OE1-NH2 3.2Å | ||
| 17 | L | 49.6 | Very low | 44.8 | Very low | 140 Ų | 140 | 136.6 Ų | 136.6 | 73% | 0.733 | 69% | 0.691 | S | S | * | * | trans | -55.2 | 142.6 | 169.7 | -87.4 | 142.3 | 0 | 0 | 0 | 111.1 | T15 T19 | T15-L17 PolarHBondContact O-N 3.03Å; T15-L17 VanDerWaalsContact O-N 3.07Å; L17-T19 PolarHBondContact O-N 3.24Å | ||
| 18 | P | 43.4 | Very low | 44.8 | Very low | 112 Ų | 112 | 132.3 Ų | 132.3 | 73% | 0.727 | 67% | 0.669 | S | S | * | * | trans | -80.9 | 80.4 | -174.7 | 33.7 | -32.9 | 0 | 0 | 0 | 110.6 | S20 | P18-S20 PolarHBondContact O-N 3.41Š| ||
| 19 | T | 46.8 | Very low | 45 | Very low | 99 Ų | 99 | 134.5 Ų | 134.5 | 61% | 0.607 | 66% | 0.664 | S | S | * | * | trans | -82.3 | 8.8 | 176 | 52.7 | 0 | 0 | 0 | 0 | 113.6 | L17 H21 | L17-T19 PolarHBondContact O-N 3.24Å; T19-H21 PolarHBondContact O-N 3.36Å | ||
| 20 | S | 51.4 | Low | 45.5 | Very low | 60 Ų | 60 | 131 Ų | 131 | 42% | 0.42 | 65% | 0.65 | S | S | . | * | H | α-helix | trans | -76.3 | -23.2 | -168.4 | 62.5 | 0 | 0 | 0 | 0 | 115.2 | P18 R24 | P18-S20 PolarHBondContact O-N 3.41Å; S20-R24 WeakPolarHBondContact O-CB 3.32Å; S20-R24 VanDerWaalsContact O-CG 3.27Å; S20-R24 WeakPolarHBondContact O-CG 3.38Å; S20-R24 PolarHBondContact O-N 2.9Å |
| 21 | H | 48.9 | Very low | 46 | Very low | 153 Ų | 153 | 127 Ų | 127 | 71% | 0.708 | 64% | 0.635 | S | S | * | * | H | α-helix | trans | -80.8 | -39.5 | -178.8 | -83.8 | -85.5 | 0 | 0 | 0 | 112.8 | T19 R24 A25 | T19-H21 PolarHBondContact O-N 3.36Å; H21-R24 PolarHBondContact O-N 2.85Å; H21-A25 PolarHBondContact O-N 3.45Å |
| 22 | F | 45.4 | Very low | 46.6 | Very low | 185 Ų | 185 | 124.1 Ų | 124.1 | 81% | 0.811 | 63% | 0.628 | S | S | * | * | H | α-helix | trans | -72.2 | -40.6 | 179.5 | -106.6 | -88.4 | 0 | 0 | 0 | 112.5 | R24 A25 A26 | F22-R24 VanDerWaalsContact C-N 3.3Å; F22-R24 PolarHBondContact O-N 3.34Å; F22-A25 PolarHBondContact O-N 3.28Å; F22-A26 PolarHBondContact O-N 3.45Å |
| 23 | H | 46.2 | Very low | 46.8 | Very low | 145 Ų | 145 | 124 Ų | 124 | 67% | 0.671 | 62% | 0.618 | S | S | * | * | H | α-helix | trans | -66.2 | -32 | 174.8 | -95.2 | -62.7 | 0 | 0 | 0 | 112.8 | F27 | H23-F27 WeakPolarHBondContact O-CB 3.31Å; H23-F27 PolarHBondContact O-N 3.37Å |
| 24 | R | 49.3 | Very low | 47 | Very low | 158 Ų | 158 | 121.3 Ų | 121.3 | 60% | 0.596 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -69.3 | -42.4 | 175.3 | -81 | 178.6 | -167.4 | -121.3 | 3.2 | 112.1 | S20 H21 F22 F27 W28 | S20-R24 WeakPolarHBondContact O-CB 3.32Å; S20-R24 VanDerWaalsContact O-CG 3.27Å; S20-R24 WeakPolarHBondContact O-CG 3.38Å; S20-R24 PolarHBondContact O-N 2.9Å; H21-R24 PolarHBondContact O-N 2.85Å; F22-R24 VanDerWaalsContact C-N 3.3Å; F22-R24 PolarHBondContact O-N 3.34Å; R24-F27 PolarHBondContact O-N 2.94Å; R24-W28 WeakPolarHBondContact O-CB 3.5Å; R24-W28 PolarHBondContact O-N 3Å |
| 25 | A | 46.7 | Very low | 47.1 | Very low | 59 Ų | 59 | 116.3 Ų | 116.3 | 49% | 0.488 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -60.1 | -48.2 | 178 | 0 | 0 | 0 | 0 | 0 | 111.8 | H21 F22 F27 W28 E29 | H21-A25 PolarHBondContact O-N 3.45Å; F22-A25 PolarHBondContact O-N 3.28Å; A25-F27 VanDerWaalsContact C-N 3.34Å; A25-F27 PolarHBondContact O-N 2.9Å; A25-W28 PolarHBondContact O-N 3.49Å; A25-E29 PolarHBondContact O-N 3.04Å |
| 26 | A | 45.4 | Very low | 47.4 | Very low | 41 Ų | 41 | 114.4 Ų | 114.4 | 34% | 0.339 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -64.7 | -36.5 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | F22 W28 E29 I30 | F22-A26 PolarHBondContact O-N 3.45Å; A26-W28 VanDerWaalsContact C-N 3.34Å; A26-E29 PolarHBondContact O-N 3.34Å; A26-I30 WeakPolarHBondContact O-CB 3.47Å; A26-I30 WeakPolarHBondContact O-CD1 3.38Å; A26-I30 WeakPolarHBondContact O-CG1 3.1Å; A26-I30 PolarHBondContact O-N 2.84Å |
| 27 | F | 45.8 | Very low | 47.4 | Very low | 124 Ų | 124 | 106.7 Ų | 106.7 | 54% | 0.544 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -67.1 | -34.2 | 175.3 | -166.6 | -96.6 | 0 | 0 | 0 | 112.3 | H23 R24 A25 Q31 | H23-F27 WeakPolarHBondContact O-CB 3.31Å; H23-F27 PolarHBondContact O-N 3.37Å; R24-F27 PolarHBondContact O-N 2.94Å; A25-F27 VanDerWaalsContact C-N 3.34Å; A25-F27 PolarHBondContact O-N 2.9Å; F27-Q31 WeakPolarHBondContact O-CB 3.44Å; F27-Q31 PolarHBondContact O-N 2.86Å |
| 28 | W | 44 | Very low | 47.1 | Very low | 116 Ų | 116 | 108.8 Ų | 108.8 | 44% | 0.439 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -69.7 | -41 | 173.4 | -89 | 97 | 0 | 0 | 0 | 112.4 | R24 A25 A26 Q31 F32 E124 | R24-W28 WeakPolarHBondContact O-CB 3.5Å; R24-W28 PolarHBondContact O-N 3Å; A25-W28 PolarHBondContact O-N 3.49Å; A26-W28 VanDerWaalsContact C-N 3.34Å; W28-Q31 PolarHBondContact O-N 2.86Å; W28-F32 WeakPolarHBondContact O-CB 3.06Å; W28-F32 PolarHBondContact O-N 2.83Å; W28-E124 HydrophobicContact CZ2-CB 4.49Å; W28-E124 VanDerWaalsContact CZ2-CD 3.49Å; W28-E124 HydrophobicContact CZ2-CG 3.76Å |
| 29 | E | 47.8 | Very low | 47 | Very low | 136 Ų | 136 | 108.9 Ų | 108.9 | 64% | 0.636 | 55% | 0.554 | S | S | * | * | H | α-helix | trans | -62.3 | -46.5 | 171.9 | -73 | -172 | 146.1 | 0 | 0 | 111 | A25 A26 Q31 F32 I33 | A25-E29 PolarHBondContact O-N 3.04Å; A26-E29 PolarHBondContact O-N 3.34Å; E29-Q31 VanDerWaalsContact C-N 3.32Å; E29-Q31 PolarHBondContact O-N 3.38Å; E29-F32 PolarHBondContact O-N 3.37Å; E29-I33 WeakPolarHBondContact O-CB 3.47Å; E29-I33 WeakPolarHBondContact O-CD1 3.45Å; E29-I33 WeakPolarHBondContact O-CG1 3.25Å; E29-I33 PolarHBondContact O-N 2.91Å |
| 30 | I | 52.2 | Low | 46.6 | Very low | 104 Ų | 104 | 108.2 Ų | 108.2 | 53% | 0.533 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -66.2 | -33.9 | 178.8 | -66.5 | 164.7 | 0 | 0 | 0 | 111.6 | A26 S34 | A26-I30 WeakPolarHBondContact O-CB 3.47Å; A26-I30 WeakPolarHBondContact O-CD1 3.38Å; A26-I30 WeakPolarHBondContact O-CG1 3.1Å; A26-I30 PolarHBondContact O-N 2.84Å; I30-S34 WeakPolarHBondContact O-CA 3.47Å; I30-S34 WeakPolarHBondContact O-CB 3.28Å; I30-S34 PolarHBondContact O-N 3.43Å; I30-S34 PolarHBondContact O-OG 3.33Å |
| 31 | Q | 52.1 | Low | 45.9 | Very low | 117 Ų | 117 | 108.8 Ų | 108.8 | 55% | 0.547 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -84 | -26.6 | 179.4 | -164.1 | 155.5 | -57.7 | 0 | 0 | 113.1 | F27 W28 E29 G35 | F27-Q31 WeakPolarHBondContact O-CB 3.44Å; F27-Q31 PolarHBondContact O-N 2.86Å; W28-Q31 PolarHBondContact O-N 2.86Å; E29-Q31 VanDerWaalsContact C-N 3.32Å; E29-Q31 PolarHBondContact O-N 3.38Å; Q31-G35 WeakPolarHBondContact O-CA 3.35Å; Q31-G35 PolarHBondContact O-N 3.33Å |
| 32 | F | 54.3 | Low | 45.7 | Very low | 149 Ų | 149 | 106.3 Ų | 106.3 | 65% | 0.654 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -71.9 | -43.5 | 167.6 | -167.6 | -95.6 | 0 | 0 | 0 | 110.5 | W28 E29 G35 L36 | W28-F32 WeakPolarHBondContact O-CB 3.06Å; W28-F32 PolarHBondContact O-N 2.83Å; E29-F32 PolarHBondContact O-N 3.37Å; F32-G35 PolarHBondContact O-N 2.81Å; F32-L36 HydrophobicContact CD1-CD1 3.77Å; F32-L36 HydrophobicContact CE1-CD1 3.74Å; F32-L36 WeakPolarHBondContact O-CB 3.3Å; F32-L36 PolarHBondContact O-N 3.43Å |
| 33 | I | 44.8 | Very low | 45.6 | Very low | 111 Ų | 111 | 105.9 Ų | 105.9 | 57% | 0.569 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -68.3 | -36.5 | 173.9 | -64.9 | 167.2 | 0 | 0 | 0 | 111.3 | E29 L36 G37 | E29-I33 WeakPolarHBondContact O-CB 3.47Å; E29-I33 WeakPolarHBondContact O-CD1 3.45Å; E29-I33 WeakPolarHBondContact O-CG1 3.25Å; E29-I33 PolarHBondContact O-N 2.91Å; I33-L36 CarbonylContact O-C 3.48Å; I33-L36 VanDerWaalsContact O-CB 3.28Å; I33-L36 WeakPolarHBondContact O-CB 3.31Å; I33-L36 PolarHBondContact O-N 3.39Å; I33-G37 PolarHBondContact O-N 3.33Å |
| 34 | S | 46.3 | Very low | 45.5 | Very low | 66 Ų | 66 | 104 Ų | 104 | 46% | 0.462 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -75.8 | -27 | 172 | -70.2 | 0 | 0 | 0 | 0 | 112.8 | I30 G37 K38 | I30-S34 WeakPolarHBondContact O-CA 3.47Å; I30-S34 WeakPolarHBondContact O-CB 3.28Å; I30-S34 PolarHBondContact O-N 3.43Å; I30-S34 PolarHBondContact O-OG 3.33Å; S34-G37 CarbonylContact O-C 3.59Å; S34-G37 PolarHBondContact O-N 3.02Å; S34-K38 PolarHBondContact O-N 2.89Å |
| 35 | G | 45.9 | Very low | 45.2 | Very low | 33 Ų | 33 | 99.1 Ų | 99.1 | 34% | 0.34 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -66.7 | -40.2 | 167.5 | 0 | 0 | 0 | 0 | 0 | 111.3 | Q31 F32 K38 M39 | Q31-G35 WeakPolarHBondContact O-CA 3.35Å; Q31-G35 PolarHBondContact O-N 3.33Å; F32-G35 PolarHBondContact O-N 2.81Å; G35-K38 PolarHBondContact O-N 3.05Å; G35-M39 PolarHBondContact O-N 2.99Å |
| 36 | L | 46.4 | Very low | 45.1 | Very low | 90 Ų | 90 | 102 Ų | 102 | 47% | 0.471 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -61.6 | -39.9 | 165.1 | -91.1 | 147 | 0 | 0 | 0 | 111.9 | F32 I33 M39 A40 | F32-L36 HydrophobicContact CD1-CD1 3.77Å; F32-L36 HydrophobicContact CE1-CD1 3.74Å; F32-L36 WeakPolarHBondContact O-CB 3.3Å; F32-L36 PolarHBondContact O-N 3.43Å; I33-L36 CarbonylContact O-C 3.48Å; I33-L36 VanDerWaalsContact O-CB 3.28Å; I33-L36 WeakPolarHBondContact O-CB 3.31Å; I33-L36 PolarHBondContact O-N 3.39Å; L36-M39 HydrophobicContact CB-CE 4.43Å; L36-M39 HydrophobicContact CD2-CE 3.94Å; L36-M39 HydrophobicContact CG-CE 3.95Å; L36-M39 CarbonylContact O-C 3.6Å; L36-M39 WeakPolarHBondContact O-CA 3.44Å; L36-M39 WeakPolarHBondContact O-CB 3.37Å; L36-M39 PolarHBondContact O-N 3.05Å; L36-M39 VanDerWaalsContact O-N 3.11Å; L36-A40 PolarHBondContact O-N 2.82Å |
| 37 | G | 43.2 | Very low | 44.9 | Very low | 42 Ų | 42 | 106.9 Ų | 106.9 | 43% | 0.433 | 59% | 0.593 | S | S | . | * | H | α-helix | trans | -68.7 | -30.2 | 174.9 | 0 | 0 | 0 | 0 | 0 | 114 | I33 S34 M39 A40 | I33-G37 PolarHBondContact O-N 3.33Å; S34-G37 CarbonylContact O-C 3.59Å; S34-G37 PolarHBondContact O-N 3.02Å; G37-M39 VanDerWaalsContact C-N 3.26Å; G37-M39 PolarHBondContact O-N 3.2Å; G37-A40 WeakPolarHBondContact O-CA 3.45Å; G37-A40 WeakPolarHBondContact O-CB 3.26Å; G37-A40 PolarHBondContact O-N 3.39Å |
| 38 | K | 42.1 | Very low | 45.4 | Very low | 185 Ų | 185 | 107 Ų | 107 | 80% | 0.804 | 59% | 0.59 | S | S | * | * | H | α-helix | trans | -72.7 | -19.7 | 169.6 | -86 | -174.6 | 174 | 178.2 | 0 | 112.7 | S34 G35 A40 | S34-K38 PolarHBondContact O-N 2.89Å; G35-K38 PolarHBondContact O-N 3.05Å; K38-A40 VanDerWaalsContact C-N 3.31Å |
| 39 | M | 42.5 | Very low | 45.6 | Very low | 113 Ų | 113 | 107.3 Ų | 107.3 | 56% | 0.557 | 60% | 0.6 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81.5 | -8 | 164.3 | -62.8 | -173.6 | -73.6 | 0 | 0 | 112.5 | G35 L36 G37 G41 V42 | G35-M39 PolarHBondContact O-N 2.99Å; L36-M39 HydrophobicContact CB-CE 4.43Å; L36-M39 HydrophobicContact CD2-CE 3.94Å; L36-M39 HydrophobicContact CG-CE 3.95Å; L36-M39 CarbonylContact O-C 3.6Å; L36-M39 WeakPolarHBondContact O-CA 3.44Å; L36-M39 WeakPolarHBondContact O-CB 3.37Å; L36-M39 PolarHBondContact O-N 3.05Å; L36-M39 VanDerWaalsContact O-N 3.11Å; G37-M39 VanDerWaalsContact C-N 3.26Å; G37-M39 PolarHBondContact O-N 3.2Å; M39-G41 PolarHBondContact O-N 3.48Å; M39-V42 PolarHBondContact O-N 2.88Å; M39-V42 VanDerWaalsContact O-O 3.14Å |
| 40 | A | 38.3 | Very low | 45.7 | Very low | 85 Ų | 85 | 104.6 Ų | 104.6 | 70% | 0.702 | 59% | 0.589 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.8 | -1.7 | 177.9 | 0 | 0 | 0 | 0 | 0 | 114 | L36 G37 K38 | L36-A40 PolarHBondContact O-N 2.82Å; G37-A40 WeakPolarHBondContact O-CA 3.45Å; G37-A40 WeakPolarHBondContact O-CB 3.26Å; G37-A40 PolarHBondContact O-N 3.39Å; K38-A40 VanDerWaalsContact C-N 3.31Å |
| 41 | G | 36.3 | Very low | 45.7 | Very low | 73 Ų | 73 | 104.5 Ų | 104.5 | 75% | 0.753 | 59% | 0.59 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -95.5 | -7.2 | 164.6 | 0 | 0 | 0 | 0 | 0 | 113.7 | M39 | M39-G41 PolarHBondContact O-N 3.48Š|
| 42 | V | 44.3 | Very low | 45.9 | Very low | 100 Ų | 100 | 101.8 Ų | 101.8 | 61% | 0.606 | 58% | 0.579 | S | S | * | * | S | Bend | trans | -97.7 | 97 | 170.5 | -178.3 | 0 | 0 | 0 | 0 | 105.4 | M39 P44 | M39-V42 PolarHBondContact O-N 2.88Å; M39-V42 VanDerWaalsContact O-O 3.14Å; V42-P44 VanDerWaalsContact O-CD 3.27Å; V42-P44 WeakPolarHBondContact O-CD 3.44Å |
| 43 | Q | 43 | Very low | 46 | Very low | 176 Ų | 176 | 95.7 Ų | 95.7 | 82% | 0.822 | 55% | 0.552 | S | S | * | * | P | Polyproline II helix | trans | -50.1 | 117.6 | 169.2 | -71.2 | -170 | 68.7 | 0 | 0 | 107.4 | P45 | Q43-P45 WeakPolarHBondContact O-CD 3.47Å; Q43-P45 VanDerWaalsContact O-N 3.09Å |
| 44 | P | 44.7 | Very low | 46.4 | Very low | 106 Ų | 106 | 96.5 Ų | 96.5 | 69% | 0.688 | 56% | 0.557 | S | S | * | * | P | Polyproline II helix | trans | -56.6 | 124.4 | 171.4 | 22.5 | -30.1 | 0 | 0 | 0 | 105.7 | V42 P46 | V42-P44 VanDerWaalsContact O-CD 3.27Å; V42-P44 WeakPolarHBondContact O-CD 3.44Å; P44-P46 VanDerWaalsContact O-N 3.15Å |
| 45 | P | 43 | Very low | 46.5 | Very low | 56 Ų | 56 | 99.9 Ų | 99.9 | 36% | 0.364 | 57% | 0.567 | S | S | . | * | P | Polyproline II helix | trans | -53.4 | 129.3 | 179.9 | 18 | -28.1 | 0 | 0 | 0 | 107.2 | Q43 L47 | Q43-P45 WeakPolarHBondContact O-CD 3.47Å; Q43-P45 VanDerWaalsContact O-N 3.09Å; P45-L47 PolarHBondContact O-N 3.34Å |
| 46 | P | 44.3 | Very low | 46.4 | Very low | 118 Ų | 118 | 101.8 Ų | 101.8 | 77% | 0.766 | 58% | 0.576 | S | S | * | * | P | Polyproline II helix | trans | -52.9 | 134.4 | -172 | 19.8 | -32 | 0 | 0 | 0 | 109.3 | P44 R48 | P44-P46 VanDerWaalsContact O-N 3.15Å; P46-R48 PolarHBondContact O-N 3.29Å |
| 47 | L | 41.3 | Very low | 46.1 | Very low | 145 Ų | 145 | 101.6 Ų | 101.6 | 76% | 0.759 | 58% | 0.582 | S | S | * | * | trans | -53.9 | 112.9 | 174.7 | -70.5 | 172.2 | 0 | 0 | 0 | 107.6 | P45 | P45-L47 PolarHBondContact O-N 3.34Š| ||
| 48 | R | 56.7 | Low | 46.1 | Very low | 127 Ų | 127 | 104 Ų | 104 | 48% | 0.479 | 60% | 0.598 | S | S | . | * | trans | -93.7 | 135.2 | -177.1 | -166.7 | 159.6 | 176.6 | 107.2 | 3.2 | 108.2 | P46 L50 D52 N85 | P46-R48 PolarHBondContact O-N 3.29Å; R48-L50 PolarHBondContact O-N 3.37Å; R48-D52 IonicContact NE-OD2 2.72Å; R48-D52 IonicContact NH2-OD2 3.88Å; R48-N85 PolarHBondContact O-OD1 3.21Å | ||
| 49 | N | 47.3 | Very low | 46.5 | Very low | 122 Ų | 122 | 102.3 Ų | 102.3 | 65% | 0.652 | 59% | 0.586 | S | S | * | * | trans | -43.5 | 130.1 | -174 | -76.2 | -10.1 | 0 | 0 | 0 | 112.9 | D51 D52 F53 | N49-D51 PolarHBondContact O-N 3.43Å; N49-D52 WeakPolarHBondContact O-CB 3.17Å; N49-D52 PolarHBondContact O-N 3Å; N49-F53 PolarHBondContact O-N 3.4Å | ||
| 50 | L | 51.2 | Low | 46.7 | Very low | 78 Ų | 78 | 103.2 Ų | 103.2 | 41% | 0.408 | 59% | 0.587 | S | S | . | * | H | α-helix | trans | -65 | -27.5 | -179.6 | -69.8 | 166.7 | 0 | 0 | 0 | 112.5 | R48 D52 F53 L54 L88 | R48-L50 PolarHBondContact O-N 3.37Å; L50-D52 PolarHBondContact O-N 3.44Å; L50-F53 WeakPolarHBondContact O-CB 3.37Å; L50-F53 PolarHBondContact O-N 2.95Å; L50-L54 WeakPolarHBondContact O-CB 3.4Å; L50-L54 PolarHBondContact O-N 3.4Å; L50-L88 HydrophobicContact CD1-CD2 3.83Å; L50-L88 HydrophobicContact CD2-CD2 3.69Å; L50-L88 HydrophobicContact CG-CD2 4.26Å |
| 51 | D | 51.4 | Low | 47.3 | Very low | 102 Ų | 102 | 100.9 Ų | 100.9 | 55% | 0.545 | 57% | 0.568 | S | S | . | * | H | α-helix | trans | -62 | -32.3 | 173.2 | -59.5 | -38 | 0 | 0 | 0 | 111.5 | N49 F53 M55 S56 | N49-D51 PolarHBondContact O-N 3.43Å; D51-F53 VanDerWaalsContact C-N 3.31Å; D51-M55 CarbonylContact O-C 3.56Å; D51-M55 VanDerWaalsContact O-CA 3.24Å; D51-M55 WeakPolarHBondContact O-CA 3.3Å; D51-M55 VanDerWaalsContact O-CB 3.26Å; D51-M55 WeakPolarHBondContact O-CB 3.39Å; D51-M55 PolarHBondContact O-N 2.92Å; D51-M55 WeakPolarHBondContact OD1-CE 3.36Å; D51-S56 PolarHBondContact O-N 2.91Å; D51-S56 VanDerWaalsContact O-N 3.09Å |
| 52 | D | 56.2 | Low | 48 | Very low | 61 Ų | 61 | 103.8 Ų | 103.8 | 33% | 0.326 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -77.4 | -21.6 | 177.2 | -134.3 | 18.5 | 0 | 0 | 0 | 111.8 | R48 N49 L50 S56 | R48-D52 IonicContact NE-OD2 2.72Å; R48-D52 IonicContact NH2-OD2 3.88Å; N49-D52 WeakPolarHBondContact O-CB 3.17Å; N49-D52 PolarHBondContact O-N 3Å; L50-D52 PolarHBondContact O-N 3.44Å; D52-S56 WeakPolarHBondContact O-CB 3.35Å; D52-S56 WeakPolarHBondContact OD1-CB 3.38Å; D52-S56 PolarHBondContact OD1-OG 3.41Å |
| 53 | F | 57 | Low | 48.5 | Very low | 20 Ų | 20 | 101 Ų | 101 | 9% | 0.088 | 56% | 0.555 | C | S | . | * | H | α-helix | trans | -89 | -36.7 | 178.5 | 179.6 | -108.7 | 0 | 0 | 0 | 112.7 | N49 L50 D51 Y82 N85 Y86 H175 | N49-F53 PolarHBondContact O-N 3.4Å; L50-F53 WeakPolarHBondContact O-CB 3.37Å; L50-F53 PolarHBondContact O-N 2.95Å; D51-F53 VanDerWaalsContact C-N 3.31Å; F53-Y82 AromaticContact CD2-CD1 3.79Å; F53-Y82 HydrophobicContact CD2-CD1 3.79Å; F53-Y82 HydrophobicContact CD2-CE1 4.31Å; F53-Y82 HydrophobicContact CE2-CD1 4.31Å; F53-N85 HydrophobicContact CD1-CB 4.26Å; F53-N85 HydrophobicContact CD2-CB 3.66Å; F53-N85 HydrophobicContact CE1-CB 4.34Å; F53-N85 HydrophobicContact CE2-CB 3.73Å; F53-N85 HydrophobicContact CG-CB 3.94Å; F53-N85 HydrophobicContact CZ-CB 4.08Å; F53-Y86 HydrophobicContact CE2-CD1 4.36Å; F53-Y86 HydrophobicContact CE2-CE1 4.17Å; F53-Y86 HydrophobicContact CZ-CD1 4.23Å; F53-Y86 HydrophobicContact CZ-CE1 4.33Å; F53-H175 AromaticContact CD2-NE2 3.7Å; F53-H175 AromaticContact CE2-CD2 3.76Å; F53-H175 AromaticContact CE2-CE1 3.67Å; F53-H175 AromaticContact CE2-NE2 3.24Å; F53-H175 WeakPolarHBondContact CE2-NE2 3.34Å; F53-H175 AromaticContact CZ-CE1 3.89Å; F53-H175 AromaticContact CZ-NE2 3.84Å |
| 54 | L | 54.2 | Low | 49 | Very low | 128 Ų | 128 | 97.5 Ų | 97.5 | 67% | 0.67 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -100 | -35.6 | -177.1 | -63.6 | 175.8 | 0 | 0 | 0 | 113.5 | L50 | L50-L54 WeakPolarHBondContact O-CB 3.4Å; L50-L54 PolarHBondContact O-N 3.4Å |
| 55 | M | 47 | Very low | 49.6 | Very low | 138 Ų | 138 | 98 Ų | 98 | 68% | 0.68 | 54% | 0.542 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -115.6 | -10 | -170.1 | -82.4 | -180 | -94.5 | 0 | 0 | 115.1 | D51 S57 | D51-M55 CarbonylContact O-C 3.56Å; D51-M55 VanDerWaalsContact O-CA 3.24Å; D51-M55 WeakPolarHBondContact O-CA 3.3Å; D51-M55 VanDerWaalsContact O-CB 3.26Å; D51-M55 WeakPolarHBondContact O-CB 3.39Å; D51-M55 PolarHBondContact O-N 2.92Å; D51-M55 WeakPolarHBondContact OD1-CE 3.36Å; M55-S57 PolarHBondContact O-N 3Å |
| 56 | S | 44.9 | Very low | 50.5 | Low | 73 Ų | 73 | 105.5 Ų | 105.5 | 51% | 0.51 | 56% | 0.564 | S | S | . | * | S | Bend | trans | -75 | 81.4 | 172.9 | -158.7 | 0 | 0 | 0 | 0 | 111.6 | D51 D52 | D51-S56 PolarHBondContact O-N 2.91Å; D51-S56 VanDerWaalsContact O-N 3.09Å; D52-S56 WeakPolarHBondContact O-CB 3.35Å; D52-S56 WeakPolarHBondContact OD1-CB 3.38Å; D52-S56 PolarHBondContact OD1-OG 3.41Å |
| 57 | S | 39.8 | Very low | 51.5 | Low | 86 Ų | 86 | 103.4 Ų | 103.4 | 60% | 0.601 | 55% | 0.546 | S | S | * | . | trans | 57.8 | 84.2 | 149.6 | -62.1 | 0 | 0 | 0 | 0 | 116.6 | M55 R59 | M55-S57 PolarHBondContact O-N 3Å; S57-R59 VanDerWaalsContact C-N 3.27Å; S57-R59 PolarHBondContact O-N 2.89Å | ||
| 58 | A | 42.6 | Very low | 52.8 | Low | 93 Ų | 93 | 102 Ų | 102 | 77% | 0.769 | 54% | 0.538 | S | S | * | . | 23.2 | 60.3 | 122.3 | 0 | 0 | 0 | 0 | 0 | 116.7 | |||||
| 59 | R | 50.8 | Low | 53.5 | Low | 149 Ų | 149 | 102.4 Ų | 102.4 | 56% | 0.562 | 55% | 0.55 | S | S | * | * | trans | -135.9 | 50.2 | 169.9 | -77.4 | -172.8 | 175 | -173 | -1.4 | 109.6 | S57 K184 | S57-R59 VanDerWaalsContact C-N 3.27Å; S57-R59 PolarHBondContact O-N 2.89Å; R59-K184 VanDerWaalsContact NH1-CG 3.25Å | ||
| 60 | F | 45.8 | Very low | 54.5 | Low | 131 Ų | 131 | 103 Ų | 103 | 58% | 0.575 | 54% | 0.543 | S | S | * | . | trans | -75.3 | 117.9 | 167.3 | -54.5 | -57 | 0 | 0 | 0 | 107.7 | M178 | F60-M178 HydrophobicContact CB-CB 4.4Å; F60-M178 HydrophobicContact CB-CE 4.03Å; F60-M178 HydrophobicContact CD1-CB 3.61Å; F60-M178 HydrophobicContact CD1-CE 3.21Å; F60-M178 HydrophobicContact CD2-CE 4Å; F60-M178 HydrophobicContact CE1-CB 4.28Å; F60-M178 HydrophobicContact CE1-CE 3.42Å; F60-M178 VanDerWaalsContact CE1-CE 3.42Å; F60-M178 HydrophobicContact CE2-CE 4.22Å; F60-M178 HydrophobicContact CG-CB 4.38Å; F60-M178 HydrophobicContact CG-CE 3.48Å; F60-M178 VanDerWaalsContact CG-CE 3.48Å; F60-M178 HydrophobicContact CZ-CE 3.94Å | ||
| 61 | A | 51.8 | Low | 55.1 | Low | 36 Ų | 36 | 103.5 Ų | 103.5 | 30% | 0.298 | 54% | 0.54 | S | S | . | . | trans | -123.3 | 141.8 | 168 | 0 | 0 | 0 | 0 | 0 | 108.8 | L180 L183 | A61-L180 HydrophobicContact CB-CD1 4.44Å; A61-L180 HydrophobicContact CB-CD2 3.37Å; A61-L180 HydrophobicContact CB-CG 4.5Å; A61-L183 HydrophobicContact CB-CD1 4.18Å | ||
| 62 | V | 51.5 | Low | 56 | Low | 135 Ų | 135 | 102.1 Ų | 102.1 | 82% | 0.818 | 53% | 0.532 | S | S | * | . | trans | -61.6 | 129.6 | 178.5 | -179.9 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 63 | P | 53.7 | Low | 56.7 | Low | 41 Ų | 41 | 104 Ų | 104 | 27% | 0.266 | 54% | 0.542 | S | S | . | . | trans | -62 | 139.4 | -178.2 | 22.4 | -31 | 0 | 0 | 0 | 111.6 | V65 | P63-V65 PolarHBondContact O-N 2.89Š| ||
| 64 | D | 54.1 | Low | 57.2 | Low | 103 Ų | 103 | 105.8 Ų | 105.8 | 55% | 0.551 | 55% | 0.549 | S | S | * | . | trans | -76.9 | 103.1 | 171.9 | -169.3 | 0.8 | 0 | 0 | 0 | 108.5 | R66 | D64-R66 PolarHBondContact O-N 2.9Å; D64-R66 VanDerWaalsContact O-N 3.13Å | ||
| 65 | V | 57.8 | Low | 57.7 | Low | 116 Ų | 116 | 101 Ų | 101 | 70% | 0.703 | 52% | 0.523 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -68.3 | -4.1 | -175.2 | -66.1 | 0 | 0 | 0 | 0 | 113.9 | P63 | P63-V65 PolarHBondContact O-N 2.89Š|
| 66 | R | 60.7 | Low | 58.8 | Low | 214 Ų | 214 | 97.8 Ų | 97.8 | 81% | 0.808 | 51% | 0.508 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -74.5 | -28.3 | -177.3 | -76 | 172.4 | 61.4 | 166.8 | -1.1 | 114.5 | D64 | D64-R66 PolarHBondContact O-N 2.9Å; D64-R66 VanDerWaalsContact O-N 3.13Å |
| 67 | D | 65.8 | Low | 59.9 | Low | 73 Ų | 73 | 99.3 Ų | 99.3 | 39% | 0.39 | 51% | 0.51 | S | S | . | . | trans | -122.8 | 80.4 | -177.7 | -70.2 | -19.9 | 0 | 0 | 0 | 111.6 | D69 R70 W71 | D67-D69 PolarHBondContact O-N 3.01Å; D67-R70 HydrophobicContact CB-CB 4.15Å; D67-R70 PolarHBondContact O-N 3.42Å; D67-R70 IonicContact OD2-CZ 3.45Å; D67-R70 IonicContact OD2-NH1 3.68Å; D67-R70 PolarHBondContact OD2-NH1 3.43Å; D67-R70 IonicContact OD2-NH2 3.9Å; D67-W71 PolarHBondContact O-N 3.02Å; D67-W71 VanDerWaalsContact O-N 3.14Å | ||
| 68 | L | 68.6 | Low | 61.4 | Low | 116 Ų | 116 | 95.8 Ų | 95.8 | 61% | 0.607 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -61.2 | -40.2 | -175.2 | -67.8 | 168.7 | 0 | 0 | 0 | 113.8 | R70 W71 N72 | L68-R70 VanDerWaalsContact C-N 3.35Å; L68-R70 PolarHBondContact O-N 2.84Å; L68-W71 PolarHBondContact O-N 3.36Å; L68-N72 PolarHBondContact O-N 3.07Å |
| 69 | D | 70.9 | Confident | 62.6 | Low | 135 Ų | 135 | 94 Ų | 94 | 72% | 0.722 | 46% | 0.462 | S | S | * | . | H | α-helix | trans | -65.6 | -39 | -178.7 | -67.1 | -46.9 | 0 | 0 | 0 | 112.4 | D67 W71 N72 N73 | D67-D69 PolarHBondContact O-N 3.01Å; D69-W71 VanDerWaalsContact C-N 3.34Å; D69-N72 PolarHBondContact O-N 2.93Å; D69-N73 PolarHBondContact O-N 3.1Å |
| 70 | R | 68.1 | Low | 63.4 | Low | 135 Ų | 135 | 92.1 Ų | 92.1 | 51% | 0.509 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -68.3 | -37.9 | 175.7 | -173.2 | -176.3 | -70.6 | 148.2 | -0.8 | 110.6 | D67 L68 R74 | D67-R70 HydrophobicContact CB-CB 4.15Å; D67-R70 PolarHBondContact O-N 3.42Å; D67-R70 IonicContact OD2-CZ 3.45Å; D67-R70 IonicContact OD2-NH1 3.68Å; D67-R70 PolarHBondContact OD2-NH1 3.43Å; D67-R70 IonicContact OD2-NH2 3.9Å; L68-R70 VanDerWaalsContact C-N 3.35Å; L68-R70 PolarHBondContact O-N 2.84Å; R70-R74 WeakPolarHBondContact O-CD 3.03Å; R70-R74 WeakPolarHBondContact O-CG 3.25Å; R70-R74 PolarHBondContact O-N 3.29Å |
| 71 | W | 64.8 | Low | 64.3 | Low | 89 Ų | 89 | 91 Ų | 91 | 34% | 0.337 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -65.9 | -43.9 | 176.1 | 178.2 | 68.9 | 0 | 0 | 0 | 111.8 | D67 L68 D69 R74 M75 | D67-W71 PolarHBondContact O-N 3.02Å; D67-W71 VanDerWaalsContact O-N 3.14Å; L68-W71 PolarHBondContact O-N 3.36Å; D69-W71 VanDerWaalsContact C-N 3.34Å; W71-R74 WeakPolarHBondContact O-CB 3.36Å; W71-R74 PolarHBondContact O-N 2.87Å; W71-R74 VanDerWaalsContact O-N 3.15Å; W71-M75 HydrophobicContact CD2-CE 4.43Å; W71-M75 HydrophobicContact CE3-CE 4.24Å; W71-M75 HydrophobicContact CH2-CE 3.36Å; W71-M75 HydrophobicContact CZ2-CE 3.57Å; W71-M75 HydrophobicContact CZ3-CE 3.72Å; W71-M75 PolarHBondContact O-N 3.33Å |
| 72 | N | 70.3 | Confident | 64.8 | Low | 72 Ų | 72 | 89.9 Ų | 89.9 | 39% | 0.385 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -61.7 | -48.6 | 177.5 | -170.8 | 27.1 | 0 | 0 | 0 | 112 | L68 D69 R74 M75 I76 | L68-N72 PolarHBondContact O-N 3.07Å; D69-N72 PolarHBondContact O-N 2.93Å; N72-R74 PolarHBondContact O-N 3.39Å; N72-M75 WeakPolarHBondContact O-CB 3.49Å; N72-M75 PolarHBondContact O-N 2.78Å; N72-M75 VanDerWaalsContact O-N 3.09Å; N72-I76 WeakPolarHBondContact O-CG1 3.42Å; N72-I76 PolarHBondContact O-N 3.4Å; N72-I76 WeakPolarHBondContact OD1-CD1 3.3Å |
| 73 | N | 70.3 | Confident | 65.5 | Low | 101 Ų | 101 | 89 Ų | 89 | 54% | 0.54 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -60.3 | -29.4 | 176 | -83.9 | -15.6 | 0 | 0 | 0 | 112.9 | D69 N77 | D69-N73 PolarHBondContact O-N 3.1Å; N73-N77 WeakPolarHBondContact O-CB 3.09Å; N73-N77 PolarHBondContact O-N 2.91Å; N73-N77 PolarHBondContact O-ND2 2.94Å |
| 74 | R | 67.1 | Low | 66.3 | Low | 58 Ų | 58 | 88.6 Ų | 88.6 | 22% | 0.219 | 43% | 0.428 | C | S | . | . | H | α-helix | trans | -74.7 | -42.2 | 174.3 | -72.3 | 172.2 | 67.1 | 175.8 | 0.5 | 112 | R70 W71 N72 N78 | R70-R74 WeakPolarHBondContact O-CD 3.03Å; R70-R74 WeakPolarHBondContact O-CG 3.25Å; R70-R74 PolarHBondContact O-N 3.29Å; W71-R74 WeakPolarHBondContact O-CB 3.36Å; W71-R74 PolarHBondContact O-N 2.87Å; W71-R74 VanDerWaalsContact O-N 3.15Å; N72-R74 PolarHBondContact O-N 3.39Å; R74-N78 WeakPolarHBondContact O-CB 3.33Å; R74-N78 VanDerWaalsContact O-CG 3.31Å; R74-N78 PolarHBondContact O-N 2.9Å |
| 75 | M | 64.8 | Low | 67.3 | Low | 27 Ų | 27 | 84.1 Ų | 84.1 | 13% | 0.133 | 40% | 0.404 | C | S | . | . | H | α-helix | trans | -60.8 | -49 | 176.9 | -169.3 | -154.1 | -63.7 | 0 | 0 | 110.7 | W71 N72 N77 N78 L79 L173 A176 | W71-M75 HydrophobicContact CD2-CE 4.43Å; W71-M75 HydrophobicContact CE3-CE 4.24Å; W71-M75 HydrophobicContact CH2-CE 3.36Å; W71-M75 HydrophobicContact CZ2-CE 3.57Å; W71-M75 HydrophobicContact CZ3-CE 3.72Å; W71-M75 PolarHBondContact O-N 3.33Å; N72-M75 WeakPolarHBondContact O-CB 3.49Å; N72-M75 PolarHBondContact O-N 2.78Å; N72-M75 VanDerWaalsContact O-N 3.09Å; M75-N77 PolarHBondContact O-N 3.42Å; M75-N78 PolarHBondContact O-N 2.73Å; M75-L79 HydrophobicContact CG-CD1 3.84Å; M75-L79 WeakPolarHBondContact O-CB 3.04Å; M75-L79 WeakPolarHBondContact O-CD1 3.34Å; M75-L79 WeakPolarHBondContact O-CG 3.26Å; M75-L79 PolarHBondContact O-N 3.35Å; M75-L79 HydrophobicContact SD-CD1 4.06Å; M75-L173 HydrophobicContact SD-CD2 4.01Å; M75-A176 HydrophobicContact CG-CB 4.18Å |
| 76 | I | 70.8 | Confident | 68.4 | Low | 71 Ų | 71 | 79.1 Ų | 79.1 | 36% | 0.364 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -61.2 | -45.2 | -179.4 | -66.5 | 168.6 | 0 | 0 | 0 | 111.3 | N72 N78 L79 L80 | N72-I76 WeakPolarHBondContact O-CG1 3.42Å; N72-I76 PolarHBondContact O-N 3.4Å; N72-I76 WeakPolarHBondContact OD1-CD1 3.3Å; I76-N78 VanDerWaalsContact C-N 3.35Å; I76-N78 PolarHBondContact O-N 3.3Å; I76-L79 WeakPolarHBondContact O-CB 3.18Å; I76-L79 PolarHBondContact O-N 3.36Å; I76-L80 HydrophobicContact CG2-CD1 3.83Å; I76-L80 PolarHBondContact O-N 3.44Å |
| 77 | N | 68.9 | Low | 69.2 | Low | 105 Ų | 105 | 76 Ų | 76 | 56% | 0.561 | 37% | 0.365 | S | S | * | . | H | α-helix | trans | -65.2 | -37.1 | 177.2 | -78.9 | -42.1 | 0 | 0 | 0 | 112.7 | N73 M75 Y81 | N73-N77 WeakPolarHBondContact O-CB 3.09Å; N73-N77 PolarHBondContact O-N 2.91Å; N73-N77 PolarHBondContact O-ND2 2.94Å; M75-N77 PolarHBondContact O-N 3.42Å; N77-Y81 WeakPolarHBondContact O-CB 3.38Å; N77-Y81 PolarHBondContact O-N 3.25Å |
| 78 | N | 69.9 | Low | 69.8 | Low | 12 Ų | 12 | 75.5 Ų | 75.5 | 6% | 0.064 | 36% | 0.363 | C | S | . | . | H | α-helix | trans | -66 | -41.2 | 173.9 | -78.1 | -17.7 | 0 | 0 | 0 | 111.7 | R74 M75 I76 Y81 Y82 Y86 A176 R179 | R74-N78 WeakPolarHBondContact O-CB 3.33Å; R74-N78 VanDerWaalsContact O-CG 3.31Å; R74-N78 PolarHBondContact O-N 2.9Å; M75-N78 PolarHBondContact O-N 2.73Å; I76-N78 VanDerWaalsContact C-N 3.35Å; I76-N78 PolarHBondContact O-N 3.3Å; N78-Y81 PolarHBondContact O-N 3Å; N78-Y82 PolarHBondContact O-N 2.88Å; N78-Y82 VanDerWaalsContact O-N 3.14Å; N78-Y86 WeakPolarHBondContact O-CE2 3.41Å; N78-A176 PolarHBondContact ND2-O 3.14Å; N78-R179 PolarHBondContact ND2-O 3.21Å |
| 79 | L | 69.1 | Low | 70.3 | Confident | 56 Ų | 56 | 70.9 Ų | 70.9 | 29% | 0.293 | 34% | 0.34 | S | S | . | . | H | α-helix | trans | -59.9 | -49.2 | 176.3 | -83.4 | 155.2 | 0 | 0 | 0 | 111.4 | M75 I76 Y81 Q83 Y86 V172 A176 | M75-L79 HydrophobicContact CG-CD1 3.84Å; M75-L79 WeakPolarHBondContact O-CB 3.04Å; M75-L79 WeakPolarHBondContact O-CD1 3.34Å; M75-L79 WeakPolarHBondContact O-CG 3.26Å; M75-L79 PolarHBondContact O-N 3.35Å; M75-L79 HydrophobicContact SD-CD1 4.06Å; I76-L79 WeakPolarHBondContact O-CB 3.18Å; I76-L79 PolarHBondContact O-N 3.36Å; L79-Y81 PolarHBondContact O-N 3.48Å; L79-Q83 PolarHBondContact O-N 2.86Å; L79-Y86 HydrophobicContact CD2-CD2 4.35Å; L79-Y86 HydrophobicContact CD2-CE2 4.36Å; L79-V172 HydrophobicContact CD2-CG1 3.72Å; L79-A176 HydrophobicContact CG-CB 4.29Å |
| 80 | L | 67.2 | Low | 70.7 | Confident | 108 Ų | 108 | 65.7 Ų | 65.7 | 57% | 0.565 | 32% | 0.316 | S | S | * | . | H | α-helix | trans | -63 | -40.2 | 177.6 | -78.6 | 159 | 0 | 0 | 0 | 112.3 | I76 | I76-L80 HydrophobicContact CG2-CD1 3.83Å; I76-L80 PolarHBondContact O-N 3.44Å |
| 81 | Y | 63.3 | Low | 71.4 | Confident | 108 Ų | 108 | 62.6 Ų | 62.6 | 42% | 0.424 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -78.1 | -21.3 | -174.8 | -173.6 | -105.8 | 0 | 0 | 0 | 113.7 | N77 N78 L79 | N77-Y81 WeakPolarHBondContact O-CB 3.38Å; N77-Y81 PolarHBondContact O-N 3.25Å; N78-Y81 PolarHBondContact O-N 3Å; L79-Y81 PolarHBondContact O-N 3.48Å |
| 82 | Y | 62.2 | Low | 72.2 | Confident | 13 Ų | 13 | 61.5 Ų | 61.5 | 5% | 0.051 | 32% | 0.315 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -117.1 | 20.7 | 178.7 | -78.3 | -84.6 | 0 | 0 | 0 | 114.2 | F53 N78 S84 N85 Y86 R179 | F53-Y82 AromaticContact CD2-CD1 3.79Å; F53-Y82 HydrophobicContact CD2-CD1 3.79Å; F53-Y82 HydrophobicContact CD2-CE1 4.31Å; F53-Y82 HydrophobicContact CE2-CD1 4.31Å; N78-Y82 PolarHBondContact O-N 2.88Å; N78-Y82 VanDerWaalsContact O-N 3.14Å; Y82-S84 VanDerWaalsContact C-N 3.35Å; Y82-S84 PolarHBondContact O-N 3.46Å; Y82-S84 VanDerWaalsContact O-N 3.16Å; Y82-N85 HydrophobicContact CD1-CB 4.12Å; Y82-N85 WeakPolarHBondContact CD1-ND2 3.33Å; Y82-N85 WeakPolarHBondContact O-CA 3.23Å; Y82-N85 WeakPolarHBondContact O-CB 3.38Å; Y82-N85 PolarHBondContact O-N 3.4Å; Y82-Y86 WeakPolarHBondContact O-CD2 3.33Å; Y82-Y86 PolarHBondContact O-N 2.9Å; Y82-R179 VanDerWaalsContact CD2-CZ 3.5Å; Y82-R179 VanDerWaalsContact CD2-NH1 3.29Å; Y82-R179 PolarHBondContact OH-NH2 2.87Å |
| 83 | Q | 67.7 | Low | 72.7 | Confident | 117 Ų | 117 | 61.1 Ų | 61.1 | 55% | 0.547 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -46.2 | -50.5 | -173.3 | -173.9 | 177.3 | -24.1 | 0 | 0 | 114.1 | L79 N85 Y86 F87 | L79-Q83 PolarHBondContact O-N 2.86Å; Q83-N85 PolarHBondContact O-N 3.22Å; Q83-Y86 PolarHBondContact O-N 2.9Å; Q83-F87 PolarHBondContact O-N 3.45Å |
| 84 | S | 69.7 | Low | 73.3 | Confident | 31 Ų | 31 | 59.2 Ų | 59.2 | 22% | 0.217 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -67.2 | -34.2 | 179.9 | -50.5 | 0 | 0 | 0 | 0 | 113.1 | Y82 F87 L88 | Y82-S84 VanDerWaalsContact C-N 3.35Å; Y82-S84 PolarHBondContact O-N 3.46Å; Y82-S84 VanDerWaalsContact O-N 3.16Å; S84-F87 PolarHBondContact O-N 3.34Å; S84-L88 WeakPolarHBondContact O-CB 3.49Å; S84-L88 PolarHBondContact O-N 3.46Å |
| 85 | N | 76.3 | Confident | 74 | Confident | 10 Ų | 10 | 62 Ų | 62 | 5% | 0.053 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -72 | -38.8 | 177 | -77.2 | -54.9 | 0 | 0 | 0 | 111.8 | R48 F53 Y82 Q83 L88 S89 | R48-N85 PolarHBondContact O-OD1 3.21Å; F53-N85 HydrophobicContact CD1-CB 4.26Å; F53-N85 HydrophobicContact CD2-CB 3.66Å; F53-N85 HydrophobicContact CE1-CB 4.34Å; F53-N85 HydrophobicContact CE2-CB 3.73Å; F53-N85 HydrophobicContact CG-CB 3.94Å; F53-N85 HydrophobicContact CZ-CB 4.08Å; Y82-N85 HydrophobicContact CD1-CB 4.12Å; Y82-N85 WeakPolarHBondContact CD1-ND2 3.33Å; Y82-N85 WeakPolarHBondContact O-CA 3.23Å; Y82-N85 WeakPolarHBondContact O-CB 3.38Å; Y82-N85 PolarHBondContact O-N 3.4Å; Q83-N85 PolarHBondContact O-N 3.22Å; N85-L88 PolarHBondContact O-N 2.92Å; N85-S89 WeakPolarHBondContact O-CB 3.45Å; N85-S89 PolarHBondContact O-N 2.85Å; N85-S89 PolarHBondContact O-OG 3.17Å |
| 86 | Y | 78.9 | Confident | 74.9 | Confident | 11 Ų | 11 | 64.8 Ų | 64.8 | 4% | 0.043 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -64.6 | -41.6 | 172.5 | -67.5 | -56.9 | 0 | 0 | 0 | 111.6 | F53 N78 L79 Y82 Q83 L88 S89 A90 V172 H175 | F53-Y86 HydrophobicContact CE2-CD1 4.36Å; F53-Y86 HydrophobicContact CE2-CE1 4.17Å; F53-Y86 HydrophobicContact CZ-CD1 4.23Å; F53-Y86 HydrophobicContact CZ-CE1 4.33Å; N78-Y86 WeakPolarHBondContact O-CE2 3.41Å; L79-Y86 HydrophobicContact CD2-CD2 4.35Å; L79-Y86 HydrophobicContact CD2-CE2 4.36Å; Y82-Y86 WeakPolarHBondContact O-CD2 3.33Å; Y82-Y86 PolarHBondContact O-N 2.9Å; Q83-Y86 PolarHBondContact O-N 2.9Å; Y86-L88 PolarHBondContact O-N 2.83Å; Y86-S89 WeakPolarHBondContact CA-OG 3.22Å; Y86-S89 PolarHBondContact O-N 3.27Å; Y86-S89 PolarHBondContact O-OG 2.99Å; Y86-A90 WeakPolarHBondContact O-CB 3.27Å; Y86-A90 PolarHBondContact O-N 3.26Å; Y86-V172 HydrophobicContact CD1-CB 4.18Å; Y86-V172 HydrophobicContact CD1-CG1 3.75Å; Y86-V172 HydrophobicContact CD1-CG2 3.91Å; Y86-V172 HydrophobicContact CE1-CG1 4.21Å; Y86-V172 HydrophobicContact CG-CG1 3.98Å; Y86-V172 HydrophobicContact CG-CG2 4.33Å; Y86-H175 HydrophobicContact CE1-CB 4.23Å; Y86-H175 AromaticContact CE1-CD2 3.54Å; Y86-H175 AromaticContact CZ-CD2 3.97Å |
| 87 | F | 78.1 | Confident | 75.4 | Confident | 148 Ų | 148 | 62.7 Ų | 62.7 | 65% | 0.649 | 32% | 0.324 | S | S | * | . | H | α-helix | trans | -59.3 | -46.9 | 174.6 | -178.3 | -100.8 | 0 | 0 | 0 | 111.7 | Q83 S84 A90 L91 | Q83-F87 PolarHBondContact O-N 3.45Å; S84-F87 PolarHBondContact O-N 3.34Å; F87-A90 PolarHBondContact O-N 3.49Å; F87-L91 WeakPolarHBondContact O-CB 3.33Å; F87-L91 PolarHBondContact O-N 3.24Å |
| 88 | L | 79.1 | Confident | 76 | Confident | 63 Ų | 63 | 58.5 Ų | 58.5 | 33% | 0.33 | 31% | 0.305 | S | S | . | . | H | α-helix | trans | -65.1 | -41.8 | 178.2 | -171.3 | 61.2 | 0 | 0 | 0 | 112 | L50 S84 N85 Y86 A90 L91 S92 | L50-L88 HydrophobicContact CD1-CD2 3.83Å; L50-L88 HydrophobicContact CD2-CD2 3.69Å; L50-L88 HydrophobicContact CG-CD2 4.26Å; S84-L88 WeakPolarHBondContact O-CB 3.49Å; S84-L88 PolarHBondContact O-N 3.46Å; N85-L88 PolarHBondContact O-N 2.92Å; Y86-L88 PolarHBondContact O-N 2.83Å; L88-A90 VanDerWaalsContact C-N 3.35Å; L88-A90 PolarHBondContact O-N 3.12Å; L88-L91 PolarHBondContact O-N 3Å; L88-S92 PolarHBondContact O-N 3.2Å; L88-S92 PolarHBondContact O-OG 3.38Å; L88-S92 VanDerWaalsContact O-OG 3.12Å |
| 89 | S | 77.8 | Confident | 76.6 | Confident | 18 Ų | 18 | 67 Ų | 67 | 13% | 0.126 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -61.3 | -43.9 | 175.1 | 72.7 | 0 | 0 | 0 | 0 | 111.6 | N85 Y86 L91 S92 F93 | N85-S89 WeakPolarHBondContact O-CB 3.45Å; N85-S89 PolarHBondContact O-N 2.85Å; N85-S89 PolarHBondContact O-OG 3.17Å; Y86-S89 WeakPolarHBondContact CA-OG 3.22Å; Y86-S89 PolarHBondContact O-N 3.27Å; Y86-S89 PolarHBondContact O-OG 2.99Å; S89-L91 VanDerWaalsContact C-N 3.33Å; S89-L91 PolarHBondContact O-N 2.79Å; S89-S92 PolarHBondContact O-N 3.44Å; S89-F93 VanDerWaalsContact O-CD2 3.27Å; S89-F93 WeakPolarHBondContact O-CD2 3.2Å; S89-F93 PolarHBondContact O-N 3.19Å |
| 90 | A | 79.9 | Confident | 77.2 | Confident | 27 Ų | 27 | 71.1 Ų | 71.1 | 22% | 0.223 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -62.9 | -41.1 | 177.5 | 0 | 0 | 0 | 0 | 0 | 111.4 | Y86 F87 L88 F93 L94 P168 | Y86-A90 WeakPolarHBondContact O-CB 3.27Å; Y86-A90 PolarHBondContact O-N 3.26Å; F87-A90 PolarHBondContact O-N 3.49Å; L88-A90 VanDerWaalsContact C-N 3.35Å; L88-A90 PolarHBondContact O-N 3.12Å; A90-F93 PolarHBondContact O-N 3.42Å; A90-L94 WeakPolarHBondContact O-CB 3.44Å; A90-L94 PolarHBondContact O-N 3.48Å; A90-P168 HydrophobicContact CB-CB 3.93Å |
| 91 | L | 82.5 | Confident | 77.9 | Confident | 69 Ų | 69 | 70.2 Ų | 70.2 | 36% | 0.361 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -62.1 | -44.4 | 174.4 | -177.9 | 61.6 | 0 | 0 | 0 | 111.7 | F87 L88 S89 F93 L94 L95 | F87-L91 WeakPolarHBondContact O-CB 3.33Å; F87-L91 PolarHBondContact O-N 3.24Å; L88-L91 PolarHBondContact O-N 3Å; S89-L91 VanDerWaalsContact C-N 3.33Å; S89-L91 PolarHBondContact O-N 2.79Å; L91-F93 PolarHBondContact O-N 3.45Å; L91-L94 WeakPolarHBondContact O-CB 3.44Å; L91-L94 PolarHBondContact O-N 2.94Å; L91-L95 HydrophobicContact CD1-CG 4.41Å; L91-L95 HydrophobicContact CG-CD1 4.28Å; L91-L95 WeakPolarHBondContact O-CG 3.47Å; L91-L95 PolarHBondContact O-N 2.92Å |
| 92 | S | 82.2 | Confident | 78.8 | Confident | 66 Ų | 66 | 68 Ų | 68 | 46% | 0.462 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -60.7 | -43.5 | 176.8 | -61.9 | 0 | 0 | 0 | 0 | 112.3 | L88 S89 L95 L96 | L88-S92 PolarHBondContact O-N 3.2Å; L88-S92 PolarHBondContact O-OG 3.38Å; L88-S92 VanDerWaalsContact O-OG 3.12Å; S89-S92 PolarHBondContact O-N 3.44Å; S92-L95 PolarHBondContact O-N 3.15Å; S92-L96 WeakPolarHBondContact O-CB 3.32Å; S92-L96 PolarHBondContact O-N 3.07Å |
| 93 | F | 81.6 | Confident | 79.8 | Confident | 64 Ų | 64 | 73.8 Ų | 73.8 | 28% | 0.281 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -66 | -37.9 | 175.1 | -85.5 | -80.2 | 0 | 0 | 0 | 112.3 | S89 A90 L91 L96 V97 P168 M171 | S89-F93 VanDerWaalsContact O-CD2 3.27Å; S89-F93 WeakPolarHBondContact O-CD2 3.2Å; S89-F93 PolarHBondContact O-N 3.19Å; A90-F93 PolarHBondContact O-N 3.42Å; L91-F93 PolarHBondContact O-N 3.45Å; F93-L96 PolarHBondContact O-N 3.42Å; F93-V97 WeakPolarHBondContact O-CG2 3.27Å; F93-V97 PolarHBondContact O-N 3.15Å; F93-P168 HydrophobicContact CB-CG 4.11Å; F93-M171 HydrophobicContact CD2-CG 4.31Å; F93-M171 HydrophobicContact CE2-CB 4.22Å; F93-M171 HydrophobicContact CE2-CG 3.67Å; F93-M171 HydrophobicContact CZ-CB 4.48Å; F93-M171 HydrophobicContact CZ-CG 4.17Å |
| 94 | L | 81.4 | Confident | 80.4 | Confident | 62 Ų | 62 | 71.9 Ų | 71.9 | 33% | 0.325 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -61.6 | -44.8 | 175.8 | -165.8 | 71.8 | 0 | 0 | 0 | 111.5 | A90 L91 G98 M105 | A90-L94 WeakPolarHBondContact O-CB 3.44Å; A90-L94 PolarHBondContact O-N 3.48Å; L91-L94 WeakPolarHBondContact O-CB 3.44Å; L91-L94 PolarHBondContact O-N 2.94Å; L94-G98 PolarHBondContact O-N 3.26Å; L94-M105 HydrophobicContact CD1-CE 3.2Å; L94-M105 HydrophobicContact CD2-CE 4.25Å; L94-M105 HydrophobicContact CG-CE 3.6Å |
| 95 | L | 83.2 | Confident | 81 | Confident | 115 Ų | 115 | 71.6 Ų | 71.6 | 60% | 0.602 | 36% | 0.362 | S | S | * | . | H | α-helix | trans | -65.9 | -38.9 | 176 | -69 | 174.9 | 0 | 0 | 0 | 111.6 | L91 S92 G98 Y99 | L91-L95 HydrophobicContact CD1-CG 4.41Å; L91-L95 HydrophobicContact CG-CD1 4.28Å; L91-L95 WeakPolarHBondContact O-CG 3.47Å; L91-L95 PolarHBondContact O-N 2.92Å; S92-L95 PolarHBondContact O-N 3.15Å; L95-G98 CarbonylContact O-C 3.41Å; L95-G98 PolarHBondContact O-N 3.36Å; L95-Y99 WeakPolarHBondContact O-CB 3.23Å; L95-Y99 PolarHBondContact O-N 3.48Å |
| 96 | L | 83.4 | Confident | 81.4 | Confident | 87 Ų | 87 | 77.5 Ų | 77.5 | 46% | 0.455 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -63.8 | -48.3 | 176.5 | -176 | 66 | 0 | 0 | 0 | 111.7 | S92 F93 G98 Y99 F100 | S92-L96 WeakPolarHBondContact O-CB 3.32Å; S92-L96 PolarHBondContact O-N 3.07Å; F93-L96 PolarHBondContact O-N 3.42Å; L96-G98 VanDerWaalsContact C-N 3.32Å; L96-G98 PolarHBondContact O-N 3.01Å; L96-Y99 WeakPolarHBondContact O-CB 3.32Å; L96-Y99 PolarHBondContact O-N 3.31Å; L96-F100 HydrophobicContact CD1-CE2 3.91Å; L96-F100 HydrophobicContact CG-CE2 4.04Å; L96-F100 WeakPolarHBondContact O-CD2 3.47Å; L96-F100 PolarHBondContact O-N 3.49Å |
| 97 | V | 80.8 | Confident | 81.6 | Confident | 27 Ų | 27 | 79.9 Ų | 79.9 | 16% | 0.164 | 40% | 0.403 | C | S | . | . | H | α-helix | trans | -63.4 | -41.3 | 175.6 | 174.4 | 0 | 0 | 0 | 0 | 110.7 | F93 Y99 F100 Q101 V160 | F93-V97 WeakPolarHBondContact O-CG2 3.27Å; F93-V97 PolarHBondContact O-N 3.15Å; V97-Y99 PolarHBondContact O-N 3.24Å; V97-F100 PolarHBondContact O-N 3.47Å; V97-Q101 PolarHBondContact O-N 3.01Å; V97-V160 HydrophobicContact CG1-CG1 4.44Å |
| 98 | G | 81.4 | Confident | 81.9 | Confident | 17 Ų | 17 | 73.2 Ų | 73.2 | 18% | 0.175 | 38% | 0.376 | C | S | . | . | H | α-helix | trans | -62.5 | -29 | 175.2 | 0 | 0 | 0 | 0 | 0 | 113.6 | L94 L95 L96 P102 | L94-G98 PolarHBondContact O-N 3.26Å; L95-G98 CarbonylContact O-C 3.41Å; L95-G98 PolarHBondContact O-N 3.36Å; L96-G98 VanDerWaalsContact C-N 3.32Å; L96-G98 PolarHBondContact O-N 3.01Å; G98-P102 WeakPolarHBondContact O-CA 3.4Å; G98-P102 WeakPolarHBondContact O-CB 3.33Å; G98-P102 VanDerWaalsContact O-N 3.16Å |
| 99 | Y | 83.7 | Confident | 82 | Confident | 191 Ų | 191 | 73.9 Ų | 73.9 | 75% | 0.749 | 38% | 0.378 | S | S | * | . | H | α-helix | trans | -68.4 | -39.4 | 174.4 | -179.1 | -98.3 | 0 | 0 | 0 | 112.2 | L95 L96 V97 | L95-Y99 WeakPolarHBondContact O-CB 3.23Å; L95-Y99 PolarHBondContact O-N 3.48Å; L96-Y99 WeakPolarHBondContact O-CB 3.32Å; L96-Y99 PolarHBondContact O-N 3.31Å; V97-Y99 PolarHBondContact O-N 3.24Å |
| 100 | F | 81.3 | Confident | 82.4 | Confident | 142 Ų | 142 | 77.1 Ų | 77.1 | 62% | 0.623 | 40% | 0.398 | S | S | * | . | H | α-helix | trans | -73.5 | -35.6 | -179.7 | -73.8 | -71.7 | 0 | 0 | 0 | 113.6 | L96 V97 | L96-F100 HydrophobicContact CD1-CE2 3.91Å; L96-F100 HydrophobicContact CG-CE2 4.04Å; L96-F100 WeakPolarHBondContact O-CD2 3.47Å; L96-F100 PolarHBondContact O-N 3.49Å; V97-F100 PolarHBondContact O-N 3.47Å |
| 101 | Q | 81.9 | Confident | 82.6 | Confident | 89 Ų | 89 | 76.5 Ų | 76.5 | 42% | 0.416 | 39% | 0.391 | S | S | . | . | S | Bend | trans | -138.2 | 67 | -176.7 | -70.5 | -65.5 | -36.9 | 0 | 0 | 111.3 | V97 I103 Q104 M105 V160 | V97-Q101 PolarHBondContact O-N 3.01Å; Q101-I103 PolarHBondContact O-N 3.43Å; Q101-Q104 HydrophobicContact CB-CB 4.42Å; Q101-Q104 PolarHBondContact O-N 3.5Å; Q101-M105 WeakPolarHBondContact O-CB 3.29Å; Q101-M105 PolarHBondContact O-N 2.8Å; Q101-V160 HydrophobicContact CB-CG1 4.09Å; Q101-V160 HydrophobicContact CB-CG2 4.04Å; Q101-V160 HydrophobicContact CG-CG2 3.96Å |
| 102 | P | 82.2 | Confident | 82.7 | Confident | 61 Ų | 61 | 75.4 Ų | 75.4 | 40% | 0.396 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -63.1 | -42.7 | -170 | 22.8 | -33.2 | 0 | 0 | 0 | 112.8 | G98 Q104 M105 F106 | G98-P102 WeakPolarHBondContact O-CA 3.4Å; G98-P102 WeakPolarHBondContact O-CB 3.33Å; G98-P102 VanDerWaalsContact O-N 3.16Å; P102-Q104 PolarHBondContact O-N 3.39Å; P102-M105 WeakPolarHBondContact O-CB 3.24Å; P102-M105 PolarHBondContact O-N 3.25Å; P102-F106 HydrophobicContact CB-CE2 4.49Å; P102-F106 WeakPolarHBondContact O-CD2 3.47Å; P102-F106 PolarHBondContact O-N 2.89Å |
| 103 | I | 82.5 | Confident | 82.8 | Confident | 135 Ų | 135 | 76 Ų | 76 | 69% | 0.692 | 39% | 0.388 | S | S | * | . | H | α-helix | trans | -63 | -47.1 | -177.6 | -61.3 | 172.7 | 0 | 0 | 0 | 110.8 | Q101 M105 F106 V107 | Q101-I103 PolarHBondContact O-N 3.43Å; I103-M105 VanDerWaalsContact C-N 3.3Å; I103-M105 PolarHBondContact O-N 3.43Å; I103-F106 PolarHBondContact O-N 2.94Å; I103-V107 VanDerWaalsContact O-CG2 3.32Å; I103-V107 WeakPolarHBondContact O-CG2 3.27Å; I103-V107 PolarHBondContact O-N 3.34Å |
| 104 | Q | 80.6 | Confident | 83 | Confident | 77 Ų | 77 | 77.1 Ų | 77.1 | 36% | 0.36 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -67.1 | -35 | 179.6 | -60.1 | -170.8 | 11.5 | 0 | 0 | 111.5 | Q101 P102 G108 V160 | Q101-Q104 HydrophobicContact CB-CB 4.42Å; Q101-Q104 PolarHBondContact O-N 3.5Å; P102-Q104 PolarHBondContact O-N 3.39Å; Q104-G108 PolarHBondContact O-N 2.95Å; Q104-V160 HydrophobicContact CB-CB 4.28Å; Q104-V160 HydrophobicContact CB-CG1 4.1Å; Q104-V160 HydrophobicContact CB-CG2 4.47Å |
| 105 | M | 81.7 | Confident | 83.2 | Confident | 24 Ų | 24 | 76.5 Ų | 76.5 | 12% | 0.118 | 40% | 0.397 | C | S | . | . | H | α-helix | trans | -65.3 | -45.3 | 175.3 | -170.6 | 62.7 | -170.7 | 0 | 0 | 112 | L94 Q101 P102 I103 G108 M109 | L94-M105 HydrophobicContact CD1-CE 3.2Å; L94-M105 HydrophobicContact CD2-CE 4.25Å; L94-M105 HydrophobicContact CG-CE 3.6Å; Q101-M105 WeakPolarHBondContact O-CB 3.29Å; Q101-M105 PolarHBondContact O-N 2.8Å; P102-M105 WeakPolarHBondContact O-CB 3.24Å; P102-M105 PolarHBondContact O-N 3.25Å; I103-M105 VanDerWaalsContact C-N 3.3Å; I103-M105 PolarHBondContact O-N 3.43Å; M105-G108 PolarHBondContact O-N 3.18Å; M105-M109 HydrophobicContact CE-CG 3.98Å; M105-M109 HydrophobicContact CE-SD 4.09Å; M105-M109 HydrophobicContact CG-CE 4.27Å; M105-M109 WeakPolarHBondContact O-CB 3.29Å; M105-M109 VanDerWaalsContact O-CG 3.31Å; M105-M109 WeakPolarHBondContact O-CG 3.33Å; M105-M109 PolarHBondContact O-N 3.42Å |
| 106 | F | 84.4 | Confident | 83.1 | Confident | 134 Ų | 134 | 76.2 Ų | 76.2 | 59% | 0.588 | 39% | 0.391 | S | S | * | . | H | α-helix | trans | -61.2 | -46.6 | 175.5 | -81.4 | -66 | 0 | 0 | 0 | 111.8 | P102 I103 G108 M109 T110 | P102-F106 HydrophobicContact CB-CE2 4.49Å; P102-F106 WeakPolarHBondContact O-CD2 3.47Å; P102-F106 PolarHBondContact O-N 2.89Å; I103-F106 PolarHBondContact O-N 2.94Å; F106-G108 VanDerWaalsContact C-N 3.35Å; F106-G108 PolarHBondContact O-N 2.87Å; F106-M109 HydrophobicContact CD1-CE 3.6Å; F106-M109 HydrophobicContact CE1-CE 3.88Å; F106-M109 HydrophobicContact CG-CE 4.25Å; F106-M109 PolarHBondContact O-N 3.28Å; F106-T110 WeakPolarHBondContact O-CB 3.49Å; F106-T110 PolarHBondContact O-N 3.1Å; F106-T110 PolarHBondContact O-OG1 3.23Å |
| 107 | V | 84.8 | Confident | 83.1 | Confident | 62 Ų | 62 | 77 Ų | 77 | 38% | 0.376 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -59.5 | -46.2 | 176.5 | 172.3 | 0 | 0 | 0 | 0 | 110.9 | I103 T110 V111 L155 | I103-V107 VanDerWaalsContact O-CG2 3.32Å; I103-V107 WeakPolarHBondContact O-CG2 3.27Å; I103-V107 PolarHBondContact O-N 3.34Å; V107-T110 PolarHBondContact O-N 3.04Å; V107-V111 HydrophobicContact CG1-CG2 4.46Å; V107-V111 WeakPolarHBondContact O-CB 3.17Å; V107-V111 VanDerWaalsContact O-CG2 3.25Å; V107-V111 WeakPolarHBondContact O-CG2 3.47Å; V107-V111 PolarHBondContact O-N 3.44Å; V107-L155 HydrophobicContact CG1-CD1 3.75Å |
| 108 | G | 82.9 | Confident | 83.3 | Confident | 8 Ų | 8 | 77.4 Ų | 77.4 | 8% | 0.082 | 41% | 0.405 | C | S | . | . | H | α-helix | trans | -60.5 | -45.4 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.8 | Q104 M105 F106 V111 V112 | Q104-G108 PolarHBondContact O-N 2.95Å; M105-G108 PolarHBondContact O-N 3.18Å; F106-G108 VanDerWaalsContact C-N 3.35Å; F106-G108 PolarHBondContact O-N 2.87Å; G108-V111 PolarHBondContact O-N 3.35Å; G108-V112 WeakPolarHBondContact O-CG2 3.11Å; G108-V112 PolarHBondContact O-N 2.92Å |
| 109 | M | 82.7 | Confident | 83.2 | Confident | 76 Ų | 76 | 78.5 Ų | 78.5 | 37% | 0.374 | 41% | 0.405 | S | S | . | . | H | α-helix | trans | -61.1 | -47.7 | 175.9 | -74.3 | -168.9 | -62 | 0 | 0 | 111.5 | M105 F106 V111 V112 T113 | M105-M109 HydrophobicContact CE-CG 3.98Å; M105-M109 HydrophobicContact CE-SD 4.09Å; M105-M109 HydrophobicContact CG-CE 4.27Å; M105-M109 WeakPolarHBondContact O-CB 3.29Å; M105-M109 VanDerWaalsContact O-CG 3.31Å; M105-M109 WeakPolarHBondContact O-CG 3.33Å; M105-M109 PolarHBondContact O-N 3.42Å; F106-M109 HydrophobicContact CD1-CE 3.6Å; F106-M109 HydrophobicContact CE1-CE 3.88Å; F106-M109 HydrophobicContact CG-CE 4.25Å; F106-M109 PolarHBondContact O-N 3.28Å; M109-V111 PolarHBondContact O-N 2.8Å; M109-V112 PolarHBondContact O-N 3.46Å; M109-T113 WeakPolarHBondContact O-CB 3.43Å; M109-T113 PolarHBondContact O-N 3.32Å; M109-T113 PolarHBondContact O-OG1 2.86Å |
| 110 | T | 85.4 | Confident | 83.1 | Confident | 86 Ų | 86 | 71.8 Ų | 71.8 | 53% | 0.528 | 38% | 0.382 | S | S | . | . | H | α-helix | trans | -58.8 | -46.7 | 177.8 | -59.4 | 0 | 0 | 0 | 0 | 111.3 | F106 V107 T113 T114 | F106-T110 WeakPolarHBondContact O-CB 3.49Å; F106-T110 PolarHBondContact O-N 3.1Å; F106-T110 PolarHBondContact O-OG1 3.23Å; V107-T110 PolarHBondContact O-N 3.04Å; T110-T113 PolarHBondContact O-N 2.98Å; T110-T114 WeakPolarHBondContact O-CB 3.21Å; T110-T114 PolarHBondContact O-N 3.4Å; T110-T114 PolarHBondContact O-OG1 3.47Å |
| 111 | V | 85.1 | Confident | 83.2 | Confident | 14 Ų | 14 | 73.2 Ų | 73.2 | 9% | 0.085 | 38% | 0.383 | C | S | . | . | H | α-helix | trans | -60.6 | -49.1 | 179.1 | 168.8 | 0 | 0 | 0 | 0 | 111.4 | V107 G108 M109 T114 L115 F151 I152 L155 | V107-V111 HydrophobicContact CG1-CG2 4.46Å; V107-V111 WeakPolarHBondContact O-CB 3.17Å; V107-V111 VanDerWaalsContact O-CG2 3.25Å; V107-V111 WeakPolarHBondContact O-CG2 3.47Å; V107-V111 PolarHBondContact O-N 3.44Å; G108-V111 PolarHBondContact O-N 3.35Å; M109-V111 PolarHBondContact O-N 2.8Å; V111-T114 PolarHBondContact O-N 2.98Å; V111-L115 HydrophobicContact CG1-CD1 3.87Å; V111-L115 HydrophobicContact CG1-CG 4.49Å; V111-L115 WeakPolarHBondContact O-CB 3.12Å; V111-L115 VanDerWaalsContact O-CG 3.3Å; V111-L115 WeakPolarHBondContact O-CG 3.38Å; V111-L115 PolarHBondContact O-N 2.92Å; V111-F151 HydrophobicContact CB-CD1 4.38Å; V111-F151 HydrophobicContact CG1-CB 3.87Å; V111-F151 HydrophobicContact CG1-CD1 3.62Å; V111-F151 HydrophobicContact CG1-CG 4.01Å; V111-F151 HydrophobicContact CG2-CD1 3.78Å; V111-F151 HydrophobicContact CG2-CE1 4.12Å; V111-I152 HydrophobicContact CG1-CD1 4.49Å; V111-I152 HydrophobicContact CG1-CG1 4.06Å; V111-L155 HydrophobicContact CG2-CD1 3.78Å |
| 112 | V | 83.1 | Confident | 83 | Confident | 47 Ų | 47 | 70 Ų | 70 | 29% | 0.285 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -63.7 | -45.1 | 179.6 | 172 | 0 | 0 | 0 | 0 | 111.3 | G108 M109 L115 F116 F161 | G108-V112 WeakPolarHBondContact O-CG2 3.11Å; G108-V112 PolarHBondContact O-N 2.92Å; M109-V112 PolarHBondContact O-N 3.46Å; V112-L115 PolarHBondContact O-N 2.81Å; V112-F116 VanDerWaalsContact O-CB 3.26Å; V112-F116 WeakPolarHBondContact O-CB 3.17Å; V112-F116 PolarHBondContact O-N 3.4Å; V112-F161 HydrophobicContact CG2-CE2 3.44Å; V112-F161 VanDerWaalsContact CG2-CE2 3.44Å; V112-F161 HydrophobicContact CG2-CZ 3.59Å |
| 113 | T | 84.2 | Confident | 82.6 | Confident | 77 Ų | 77 | 67 Ų | 67 | 47% | 0.472 | 35% | 0.353 | S | S | . | . | H | α-helix | trans | -62 | -45.9 | 178.7 | -62.3 | 0 | 0 | 0 | 0 | 111.1 | M109 T110 F116 L117 | M109-T113 WeakPolarHBondContact O-CB 3.43Å; M109-T113 PolarHBondContact O-N 3.32Å; M109-T113 PolarHBondContact O-OG1 2.86Å; T110-T113 PolarHBondContact O-N 2.98Å; T113-F116 PolarHBondContact O-N 3.41Å; T113-L117 HydrophobicContact CG2-CD1 3.84Å; T113-L117 HydrophobicContact CG2-CG 4.3Å; T113-L117 WeakPolarHBondContact O-CB 3.39Å; T113-L117 VanDerWaalsContact O-CG 3.25Å; T113-L117 WeakPolarHBondContact O-CG 3.12Å; T113-L117 PolarHBondContact O-N 2.81Å |
| 114 | T | 85.9 | Confident | 82.2 | Confident | 89 Ų | 89 | 64.2 Ų | 64.2 | 55% | 0.546 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -63.9 | -43.2 | 178.4 | -62.7 | 0 | 0 | 0 | 0 | 111.9 | T110 V111 G118 | T110-T114 WeakPolarHBondContact O-CB 3.21Å; T110-T114 PolarHBondContact O-N 3.4Å; T110-T114 PolarHBondContact O-OG1 3.47Å; V111-T114 PolarHBondContact O-N 2.98Å; T114-G118 PolarHBondContact O-N 3.41Å |
| 115 | L | 85.4 | Confident | 81.9 | Confident | 49 Ų | 49 | 65.2 Ų | 65.2 | 26% | 0.257 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -64.9 | -40.8 | 176.8 | -74 | 173.9 | 0 | 0 | 0 | 112.1 | V111 V112 G118 F119 S148 F151 | V111-L115 HydrophobicContact CG1-CD1 3.87Å; V111-L115 HydrophobicContact CG1-CG 4.49Å; V111-L115 WeakPolarHBondContact O-CB 3.12Å; V111-L115 VanDerWaalsContact O-CG 3.3Å; V111-L115 WeakPolarHBondContact O-CG 3.38Å; V111-L115 PolarHBondContact O-N 2.92Å; V112-L115 PolarHBondContact O-N 2.81Å; L115-G118 PolarHBondContact O-N 2.92Å; L115-F119 WeakPolarHBondContact O-CB 3.33Å; L115-F119 PolarHBondContact O-N 3.39Å; L115-S148 WeakPolarHBondContact CD1-OG 3.35Å; L115-F151 HydrophobicContact CD1-CB 4.44Å |
| 116 | F | 81.6 | Confident | 81.7 | Confident | 108 Ų | 108 | 70 Ų | 70 | 47% | 0.474 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -66.4 | -46.4 | 178 | -176.4 | -110.6 | 0 | 0 | 0 | 111.9 | V112 T113 F119 I120 | V112-F116 VanDerWaalsContact O-CB 3.26Å; V112-F116 WeakPolarHBondContact O-CB 3.17Å; V112-F116 PolarHBondContact O-N 3.4Å; T113-F116 PolarHBondContact O-N 3.41Å; F116-F119 PolarHBondContact O-N 2.84Å; F116-I120 HydrophobicContact CD1-CD1 3.76Å; F116-I120 HydrophobicContact CE1-CD1 3.3Å; F116-I120 HydrophobicContact CE1-CG1 4.33Å; F116-I120 HydrophobicContact CE2-CD1 4.32Å; F116-I120 HydrophobicContact CG-CD1 4.45Å; F116-I120 HydrophobicContact CZ-CD1 3.63Å; F116-I120 HydrophobicContact CZ-CG1 4.33Å; F116-I120 WeakPolarHBondContact O-CG1 3.48Å; F116-I120 PolarHBondContact O-N 2.85Å |
| 117 | L | 84.5 | Confident | 81.1 | Confident | 103 Ų | 103 | 67.3 Ų | 67.3 | 54% | 0.539 | 37% | 0.366 | S | S | . | . | H | α-helix | trans | -63.6 | -42.3 | 175.5 | -69.9 | 175.7 | 0 | 0 | 0 | 111.5 | T113 F119 I120 W121 | T113-L117 HydrophobicContact CG2-CD1 3.84Å; T113-L117 HydrophobicContact CG2-CG 4.3Å; T113-L117 WeakPolarHBondContact O-CB 3.39Å; T113-L117 VanDerWaalsContact O-CG 3.25Å; T113-L117 WeakPolarHBondContact O-CG 3.12Å; T113-L117 PolarHBondContact O-N 2.81Å; L117-F119 VanDerWaalsContact C-N 3.31Å; L117-F119 PolarHBondContact O-N 3.25Å; L117-I120 PolarHBondContact O-N 2.96Å; L117-W121 WeakPolarHBondContact O-CB 3.12Å; L117-W121 PolarHBondContact O-N 3.44Å |
| 118 | G | 84.4 | Confident | 80.3 | Confident | 36 Ų | 36 | 68.9 Ų | 68.9 | 37% | 0.371 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -59.8 | -40.9 | 174 | 0 | 0 | 0 | 0 | 0 | 112 | T114 L115 W121 A122 | T114-G118 PolarHBondContact O-N 3.41Å; L115-G118 PolarHBondContact O-N 2.92Å; G118-W121 PolarHBondContact O-N 2.79Å; G118-A122 VanDerWaalsContact O-CB 3.23Å; G118-A122 WeakPolarHBondContact O-CB 3.21Å; G118-A122 PolarHBondContact O-N 3.34Å |
| 119 | F | 79.6 | Confident | 79.5 | Confident | 40 Ų | 40 | 70.9 Ų | 70.9 | 18% | 0.175 | 39% | 0.387 | C | S | . | . | H | α-helix | trans | -66.9 | -42.5 | 175.3 | -176.8 | -94.8 | 0 | 0 | 0 | 112.5 | L115 F116 L117 W121 A122 A123 I129 A140 I144 | L115-F119 WeakPolarHBondContact O-CB 3.33Å; L115-F119 PolarHBondContact O-N 3.39Å; F116-F119 PolarHBondContact O-N 2.84Å; L117-F119 VanDerWaalsContact C-N 3.31Å; L117-F119 PolarHBondContact O-N 3.25Å; F119-W121 VanDerWaalsContact C-N 3.35Å; F119-A122 PolarHBondContact O-N 3.31Å; F119-A123 VanDerWaalsContact O-CB 3.24Å; F119-A123 WeakPolarHBondContact O-CB 3.46Å; F119-A123 PolarHBondContact O-N 3.46Å; F119-I129 HydrophobicContact CE2-CG2 4.13Å; F119-I129 HydrophobicContact CZ-CG2 4.33Å; F119-A140 HydrophobicContact CZ-CB 3.97Å; F119-I144 HydrophobicContact CB-CD1 4.24Å; F119-I144 HydrophobicContact CB-CG1 4.32Å; F119-I144 HydrophobicContact CD1-CD1 3.53Å; F119-I144 HydrophobicContact CD1-CG1 4.28Å; F119-I144 HydrophobicContact CD2-CD1 4.11Å; F119-I144 HydrophobicContact CD2-CG1 3.96Å; F119-I144 HydrophobicContact CE1-CD1 3.83Å; F119-I144 HydrophobicContact CE2-CD1 4.37Å; F119-I144 HydrophobicContact CE2-CG1 4.35Å; F119-I144 HydrophobicContact CG-CD1 3.68Å; F119-I144 HydrophobicContact CG-CG1 3.92Å; F119-I144 HydrophobicContact CZ-CD1 4.24Å |
| 120 | I | 80.5 | Confident | 78.8 | Confident | 50 Ų | 50 | 74.1 Ų | 74.1 | 26% | 0.256 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -60.7 | -47.7 | 174.7 | -71.6 | 172.7 | 0 | 0 | 0 | 110.1 | F116 L117 A122 A123 E124 | F116-I120 HydrophobicContact CD1-CD1 3.76Å; F116-I120 HydrophobicContact CE1-CD1 3.3Å; F116-I120 HydrophobicContact CE1-CG1 4.33Å; F116-I120 HydrophobicContact CE2-CD1 4.32Å; F116-I120 HydrophobicContact CG-CD1 4.45Å; F116-I120 HydrophobicContact CZ-CD1 3.63Å; F116-I120 HydrophobicContact CZ-CG1 4.33Å; F116-I120 WeakPolarHBondContact O-CG1 3.48Å; F116-I120 PolarHBondContact O-N 2.85Å; L117-I120 PolarHBondContact O-N 2.96Å; I120-A122 VanDerWaalsContact C-N 3.33Å; I120-A122 PolarHBondContact O-N 2.9Å; I120-A123 PolarHBondContact O-N 3.26Å; I120-E124 PolarHBondContact O-N 2.84Å |
| 121 | W | 83.4 | Confident | 78.1 | Confident | 172 Ų | 172 | 78.6 Ų | 78.6 | 65% | 0.652 | 40% | 0.402 | S | S | * | . | H | α-helix | trans | -60 | -44.5 | 177.5 | 179.5 | 88.4 | 0 | 0 | 0 | 111.3 | L117 G118 F119 A123 E124 N125 | L117-W121 WeakPolarHBondContact O-CB 3.12Å; L117-W121 PolarHBondContact O-N 3.44Å; G118-W121 PolarHBondContact O-N 2.79Å; F119-W121 VanDerWaalsContact C-N 3.35Å; W121-A123 PolarHBondContact O-N 3.28Å; W121-E124 PolarHBondContact O-N 3.35Å; W121-N125 PolarHBondContact NE1-ND2 3.39Å; W121-N125 VanDerWaalsContact NE1-ND2 3.17Å; W121-N125 WeakPolarHBondContact O-CB 3.42Å; W121-N125 PolarHBondContact O-N 2.89Å; W121-N125 PolarHBondContact O-ND2 3.07Å |
| 122 | A | 77.6 | Confident | 77.4 | Confident | 21 Ų | 21 | 82.1 Ų | 82.1 | 17% | 0.174 | 42% | 0.416 | C | S | . | . | H | α-helix | trans | -65.1 | -39.5 | 177 | 0 | 0 | 0 | 0 | 0 | 111.9 | G118 F119 I120 E124 N125 K126 I129 | G118-A122 VanDerWaalsContact O-CB 3.23Å; G118-A122 WeakPolarHBondContact O-CB 3.21Å; G118-A122 PolarHBondContact O-N 3.34Å; F119-A122 PolarHBondContact O-N 3.31Å; I120-A122 VanDerWaalsContact C-N 3.33Å; I120-A122 PolarHBondContact O-N 2.9Å; A122-E124 VanDerWaalsContact C-N 3.26Å; A122-E124 PolarHBondContact O-N 3.42Å; A122-N125 PolarHBondContact O-N 3.09Å; A122-K126 VanDerWaalsContact O-CB 3.29Å; A122-K126 WeakPolarHBondContact O-CB 3.4Å; A122-K126 PolarHBondContact O-N 3.14Å; A122-I129 HydrophobicContact CB-CD1 3.69Å |
| 123 | A | 74.5 | Confident | 76.7 | Confident | 0 Ų | 0 | 84.2 Ų | 84.2 | 0% | 0 | 42% | 0.419 | C | S | . | . | H | α-helix | trans | -65.6 | -29 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.9 | F119 I120 W121 I129 R130 | F119-A123 VanDerWaalsContact O-CB 3.24Å; F119-A123 WeakPolarHBondContact O-CB 3.46Å; F119-A123 PolarHBondContact O-N 3.46Å; I120-A123 PolarHBondContact O-N 3.26Å; W121-A123 PolarHBondContact O-N 3.28Å; A123-I129 HydrophobicContact CB-CG2 3.85Å; A123-R130 VanDerWaalsContact O-CB 3.29Å; A123-R130 WeakPolarHBondContact O-CB 3.26Å |
| 124 | E | 73.3 | Confident | 76 | Confident | 75 Ų | 75 | 90.9 Ų | 90.9 | 35% | 0.35 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -81.5 | -41.6 | 176.6 | -164.4 | 61.1 | -158.3 | 0 | 0 | 112.2 | W28 I120 W121 A122 | W28-E124 HydrophobicContact CZ2-CB 4.49Å; W28-E124 VanDerWaalsContact CZ2-CD 3.49Å; W28-E124 HydrophobicContact CZ2-CG 3.76Å; I120-E124 PolarHBondContact O-N 2.84Å; W121-E124 PolarHBondContact O-N 3.35Å; A122-E124 VanDerWaalsContact C-N 3.26Å; A122-E124 PolarHBondContact O-N 3.42Å |
| 125 | N | 74.8 | Confident | 75.5 | Confident | 98 Ų | 98 | 91.3 Ų | 91.3 | 52% | 0.524 | 43% | 0.434 | S | S | . | . | H | α-helix | trans | -82.6 | -20.9 | -175.9 | -72.3 | -78.8 | 0 | 0 | 0 | 113.7 | W121 A122 | W121-N125 PolarHBondContact NE1-ND2 3.39Å; W121-N125 VanDerWaalsContact NE1-ND2 3.17Å; W121-N125 WeakPolarHBondContact O-CB 3.42Å; W121-N125 PolarHBondContact O-N 2.89Å; W121-N125 PolarHBondContact O-ND2 3.07Å; A122-N125 PolarHBondContact O-N 3.09Å |
| 126 | K | 78.6 | Confident | 75 | Confident | 126 Ų | 126 | 93.8 Ų | 93.8 | 55% | 0.548 | 44% | 0.444 | S | S | . | . | trans | -120.1 | 110.2 | -178 | -57.2 | -81.5 | -173.8 | 174.6 | 0 | 110.4 | A122 P128 I129 R130 | A122-K126 VanDerWaalsContact O-CB 3.29Å; A122-K126 WeakPolarHBondContact O-CB 3.4Å; A122-K126 PolarHBondContact O-N 3.14Å; K126-P128 VanDerWaalsContact C-N 3.31Å; K126-P128 HydrophobicContact CB-CG 4.26Å; K126-I129 HydrophobicContact CB-CB 4.19Å; K126-I129 HydrophobicContact CB-CD1 3.8Å; K126-I129 HydrophobicContact CB-CG1 3.85Å; K126-I129 HydrophobicContact CG-CD1 3.99Å; K126-I129 PolarHBondContact O-N 2.97Å; K126-R130 PolarHBondContact O-N 3.36Å; K126-R130 VanDerWaalsContact O-N 3.1Å | ||
| 127 | A | 70.3 | Confident | 74.7 | Confident | 76 Ų | 76 | 92.6 Ų | 92.6 | 63% | 0.628 | 45% | 0.447 | S | S | * | . | H | α-helix | trans | -47.8 | -39.4 | 171.2 | 0 | 0 | 0 | 0 | 0 | 115.5 | R130 R131 | A127-R130 PolarHBondContact O-N 3.05Å; A127-R131 PolarHBondContact O-N 3.43Å |
| 128 | P | 68.1 | Low | 74.3 | Confident | 95 Ų | 95 | 93.8 Ų | 93.8 | 62% | 0.617 | 45% | 0.453 | S | S | * | . | H | α-helix | trans | -66.5 | -36.5 | 176.6 | 22.4 | -32.9 | 0 | 0 | 0 | 113.3 | K126 R131 F132 | K126-P128 VanDerWaalsContact C-N 3.31Å; K126-P128 HydrophobicContact CB-CG 4.26Å; P128-R131 PolarHBondContact O-N 2.9Å; P128-F132 WeakPolarHBondContact O-CB 3.24Å; P128-F132 PolarHBondContact O-N 3.32Å |
| 129 | I | 66.5 | Low | 74 | Confident | 51 Ų | 51 | 95.9 Ų | 95.9 | 26% | 0.262 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -71 | -37.9 | 178.6 | -57.8 | -179.9 | 0 | 0 | 0 | 110 | F119 A122 A123 K126 R131 F132 R133 | F119-I129 HydrophobicContact CE2-CG2 4.13Å; F119-I129 HydrophobicContact CZ-CG2 4.33Å; A122-I129 HydrophobicContact CB-CD1 3.69Å; A123-I129 HydrophobicContact CB-CG2 3.85Å; K126-I129 HydrophobicContact CB-CB 4.19Å; K126-I129 HydrophobicContact CB-CD1 3.8Å; K126-I129 HydrophobicContact CB-CG1 3.85Å; K126-I129 HydrophobicContact CG-CD1 3.99Å; K126-I129 PolarHBondContact O-N 2.97Å; I129-R131 VanDerWaalsContact C-N 3.32Å; I129-R131 PolarHBondContact O-N 3.28Å; I129-F132 PolarHBondContact O-N 2.77Å; I129-R133 PolarHBondContact O-N 2.82Å |
| 130 | R | 67.6 | Low | 73.9 | Confident | 144 Ų | 144 | 94.2 Ų | 94.2 | 54% | 0.543 | 45% | 0.449 | S | S | . | . | H | α-helix | trans | -59.9 | -41.9 | 172.4 | -153.3 | 174.3 | 93 | 172.7 | 4.3 | 112.5 | A123 K126 A127 R134 | A123-R130 VanDerWaalsContact O-CB 3.29Å; A123-R130 WeakPolarHBondContact O-CB 3.26Å; K126-R130 PolarHBondContact O-N 3.36Å; K126-R130 VanDerWaalsContact O-N 3.1Å; A127-R130 PolarHBondContact O-N 3.05Å; R130-R134 PolarHBondContact O-N 3.38Å |
| 131 | R | 71.5 | Confident | 73.8 | Confident | 180 Ų | 180 | 95.8 Ų | 95.8 | 68% | 0.679 | 46% | 0.461 | S | S | * | . | H | α-helix | trans | -71.8 | -39.6 | 179.4 | -167.2 | 177.2 | -69.8 | -166.2 | -1.5 | 111.5 | A127 P128 I129 R134 N135 | A127-R131 PolarHBondContact O-N 3.43Å; P128-R131 PolarHBondContact O-N 2.9Å; I129-R131 VanDerWaalsContact C-N 3.32Å; I129-R131 PolarHBondContact O-N 3.28Å; R131-R134 PolarHBondContact O-N 2.83Å; R131-N135 WeakPolarHBondContact O-CB 3.42Å; R131-N135 PolarHBondContact O-N 3.37Å; R131-N135 PolarHBondContact O-OD1 2.78Å |
| 132 | F | 70 | Confident | 73.8 | Confident | 87 Ų | 87 | 91.8 Ų | 91.8 | 38% | 0.382 | 45% | 0.452 | S | S | . | . | H | α-helix | trans | -60.1 | -47.9 | 175.6 | -176.4 | -105.1 | 0 | 0 | 0 | 112.3 | P128 I129 R134 N135 H136 L139 A140 | P128-F132 WeakPolarHBondContact O-CB 3.24Å; P128-F132 PolarHBondContact O-N 3.32Å; I129-F132 PolarHBondContact O-N 2.77Å; F132-R134 VanDerWaalsContact C-N 3.25Å; F132-R134 PolarHBondContact O-N 3.07Å; F132-N135 PolarHBondContact O-N 3.36Å; F132-H136 PolarHBondContact O-N 3.45Å; F132-L139 HydrophobicContact CE1-CB 4.34Å; F132-L139 HydrophobicContact CE2-CB 4.45Å; F132-L139 HydrophobicContact CE2-CD1 4.49Å; F132-L139 HydrophobicContact CZ-CB 3.77Å; F132-A140 HydrophobicContact CD1-CB 4.4Å; F132-A140 HydrophobicContact CE1-CB 4.31Å |
| 133 | R | 68.1 | Low | 74 | Confident | 91 Ų | 91 | 93 Ų | 93 | 34% | 0.343 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -58.6 | -36 | 175.7 | -177 | 179.4 | 64.4 | -171.2 | -2.7 | 113 | I129 P137 A140 | I129-R133 PolarHBondContact O-N 2.82Å; R133-P137 WeakPolarHBondContact O-CA 3.24Å; R133-A140 HydrophobicContact CB-CB 4.46Å; R133-A140 HydrophobicContact CG-CB 4.47Å |
| 134 | R | 69.2 | Low | 74.3 | Confident | 218 Ų | 218 | 94.4 Ų | 94.4 | 82% | 0.823 | 47% | 0.469 | S | S | * | . | H | α-helix | trans | -80.8 | -35.6 | -177.4 | -173.6 | 169.8 | 162.6 | 143 | -5.1 | 112.6 | R130 R131 F132 | R130-R134 PolarHBondContact O-N 3.38Å; R131-R134 PolarHBondContact O-N 2.83Å; F132-R134 VanDerWaalsContact C-N 3.25Å; F132-R134 PolarHBondContact O-N 3.07Å |
| 135 | N | 76.6 | Confident | 74.7 | Confident | 98 Ų | 98 | 95 Ų | 95 | 52% | 0.524 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -80 | -36.4 | -179.1 | -70.5 | 6.4 | 0 | 0 | 0 | 112 | R131 F132 | R131-N135 WeakPolarHBondContact O-CB 3.42Å; R131-N135 PolarHBondContact O-N 3.37Å; R131-N135 PolarHBondContact O-OD1 2.78Å; F132-N135 PolarHBondContact O-N 3.36Å |
| 136 | H | 74.6 | Confident | 75.3 | Confident | 101 Ų | 101 | 95.4 Ų | 95.4 | 47% | 0.468 | 48% | 0.476 | S | S | . | . | trans | -138.6 | 76.8 | -178.9 | -60.2 | -71.1 | 0 | 0 | 0 | 111.1 | F132 L138 L139 A140 | F132-H136 PolarHBondContact O-N 3.45Å; H136-L138 PolarHBondContact O-N 2.93Å; H136-L139 HydrophobicContact CB-CB 3.8Å; H136-L139 HydrophobicContact CB-CD1 3.61Å; H136-L139 HydrophobicContact CB-CG 3.81Å; H136-L139 PolarHBondContact O-N 3.48Å; H136-L139 VanDerWaalsContact O-N 3.14Å; H136-A140 PolarHBondContact O-N 2.99Å; H136-A140 VanDerWaalsContact O-N 3.07Å | ||
| 137 | P | 74.9 | Confident | 75.6 | Confident | 82 Ų | 82 | 91.3 Ų | 91.3 | 53% | 0.532 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -59.7 | -35 | -179.4 | 23.7 | -33.7 | 0 | 0 | 0 | 112.2 | R133 A140 V141 | R133-P137 WeakPolarHBondContact O-CA 3.24Å; P137-A140 PolarHBondContact O-N 3.49Å; P137-V141 WeakPolarHBondContact O-CG2 3.41Å; P137-V141 PolarHBondContact O-N 3.34Å; P137-V141 VanDerWaalsContact O-N 3.09Å |
| 138 | L | 76.4 | Confident | 76.1 | Confident | 128 Ų | 128 | 87.9 Ų | 87.9 | 67% | 0.67 | 44% | 0.437 | S | S | * | . | H | α-helix | trans | -63.1 | -46.1 | 175.6 | -171.6 | 74.4 | 0 | 0 | 0 | 111.9 | H136 A140 V141 L142 | H136-L138 PolarHBondContact O-N 2.93Å; L138-A140 VanDerWaalsContact C-N 3.3Å; L138-A140 PolarHBondContact O-N 3.4Å; L138-V141 PolarHBondContact O-N 3.39Å; L138-L142 HydrophobicContact CG-CD1 4.18Å; L138-L142 WeakPolarHBondContact O-CB 3.24Å; L138-L142 WeakPolarHBondContact O-CG 3.26Å; L138-L142 PolarHBondContact O-N 3.5Å |
| 139 | L | 77.6 | Confident | 76.9 | Confident | 81 Ų | 81 | 88.4 Ų | 88.4 | 42% | 0.424 | 43% | 0.428 | S | S | . | . | H | α-helix | trans | -65.2 | -35.3 | 178.9 | -66.6 | 179.3 | 0 | 0 | 0 | 111.7 | F132 H136 L142 A143 | F132-L139 HydrophobicContact CE1-CB 4.34Å; F132-L139 HydrophobicContact CE2-CB 4.45Å; F132-L139 HydrophobicContact CE2-CD1 4.49Å; F132-L139 HydrophobicContact CZ-CB 3.77Å; H136-L139 HydrophobicContact CB-CB 3.8Å; H136-L139 HydrophobicContact CB-CD1 3.61Å; H136-L139 HydrophobicContact CB-CG 3.81Å; H136-L139 PolarHBondContact O-N 3.48Å; H136-L139 VanDerWaalsContact O-N 3.14Å; L139-L142 HydrophobicContact CD2-CD1 4.44Å; L139-L142 PolarHBondContact O-N 3.04Å; L139-A143 WeakPolarHBondContact O-CB 3.48Å; L139-A143 PolarHBondContact O-N 3.47Å |
| 140 | A | 77.1 | Confident | 77.7 | Confident | 4 Ų | 4 | 90.7 Ų | 90.7 | 3% | 0.033 | 44% | 0.44 | C | S | . | . | H | α-helix | trans | -63.4 | -44.6 | 174.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | F119 F132 R133 H136 P137 L138 A143 I144 | F119-A140 HydrophobicContact CZ-CB 3.97Å; F132-A140 HydrophobicContact CD1-CB 4.4Å; F132-A140 HydrophobicContact CE1-CB 4.31Å; R133-A140 HydrophobicContact CB-CB 4.46Å; R133-A140 HydrophobicContact CG-CB 4.47Å; H136-A140 PolarHBondContact O-N 2.99Å; H136-A140 VanDerWaalsContact O-N 3.07Å; P137-A140 PolarHBondContact O-N 3.49Å; L138-A140 VanDerWaalsContact C-N 3.3Å; L138-A140 PolarHBondContact O-N 3.4Å; A140-A143 PolarHBondContact O-N 3.37Å; A140-I144 WeakPolarHBondContact O-CG1 3.47Å; A140-I144 PolarHBondContact O-N 2.78Å |
| 141 | V | 79 | Confident | 78.4 | Confident | 83 Ų | 83 | 89.3 Ų | 89.3 | 50% | 0.503 | 44% | 0.438 | S | S | . | . | H | α-helix | trans | -65.4 | -43.4 | 176.1 | 174.6 | 0 | 0 | 0 | 0 | 111.1 | P137 L138 A143 I144 L145 | P137-V141 WeakPolarHBondContact O-CG2 3.41Å; P137-V141 PolarHBondContact O-N 3.34Å; P137-V141 VanDerWaalsContact O-N 3.09Å; L138-V141 PolarHBondContact O-N 3.39Å; V141-A143 VanDerWaalsContact C-N 3.33Å; V141-A143 PolarHBondContact O-N 3.05Å; V141-I144 PolarHBondContact O-N 3.34Å; V141-L145 HydrophobicContact CG1-CD1 4.04Å; V141-L145 HydrophobicContact CG1-CG 4.43Å; V141-L145 WeakPolarHBondContact O-CG 3.34Å; V141-L145 PolarHBondContact O-N 3.27Å |
| 142 | L | 83 | Confident | 78.9 | Confident | 89 Ų | 89 | 81 Ų | 81 | 47% | 0.466 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -60.9 | -40.7 | 176.4 | -73.8 | 173 | 0 | 0 | 0 | 112.3 | L138 L139 I144 L145 L146 | L138-L142 HydrophobicContact CG-CD1 4.18Å; L138-L142 WeakPolarHBondContact O-CB 3.24Å; L138-L142 WeakPolarHBondContact O-CG 3.26Å; L138-L142 PolarHBondContact O-N 3.5Å; L139-L142 HydrophobicContact CD2-CD1 4.44Å; L139-L142 PolarHBondContact O-N 3.04Å; L142-I144 VanDerWaalsContact C-N 3.35Å; L142-I144 PolarHBondContact O-N 3.41Å; L142-L145 PolarHBondContact O-N 2.93Å; L142-L146 VanDerWaalsContact O-CB 3.3Å; L142-L146 WeakPolarHBondContact O-CB 3.47Å; L142-L146 PolarHBondContact O-N 3.11Å |
| 143 | A | 82.1 | Confident | 79.4 | Confident | 47 Ų | 47 | 79.4 Ų | 79.4 | 39% | 0.388 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -62.6 | -41.1 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | L139 A140 V141 A147 | L139-A143 WeakPolarHBondContact O-CB 3.48Å; L139-A143 PolarHBondContact O-N 3.47Å; A140-A143 PolarHBondContact O-N 3.37Å; V141-A143 VanDerWaalsContact C-N 3.33Å; V141-A143 PolarHBondContact O-N 3.05Å; A143-A147 WeakPolarHBondContact O-CB 3.48Å; A143-A147 PolarHBondContact O-N 2.83Å |
| 144 | I | 81.9 | Confident | 80.1 | Confident | 28 Ų | 28 | 81.2 Ų | 81.2 | 14% | 0.144 | 43% | 0.427 | C | S | . | . | H | α-helix | trans | -67.3 | -43.2 | 176.9 | -64 | 164.3 | 0 | 0 | 0 | 110.8 | F119 A140 V141 L142 A147 S148 | F119-I144 HydrophobicContact CB-CD1 4.24Å; F119-I144 HydrophobicContact CB-CG1 4.32Å; F119-I144 HydrophobicContact CD1-CD1 3.53Å; F119-I144 HydrophobicContact CD1-CG1 4.28Å; F119-I144 HydrophobicContact CD2-CD1 4.11Å; F119-I144 HydrophobicContact CD2-CG1 3.96Å; F119-I144 HydrophobicContact CE1-CD1 3.83Å; F119-I144 HydrophobicContact CE2-CD1 4.37Å; F119-I144 HydrophobicContact CE2-CG1 4.35Å; F119-I144 HydrophobicContact CG-CD1 3.68Å; F119-I144 HydrophobicContact CG-CG1 3.92Å; F119-I144 HydrophobicContact CZ-CD1 4.24Å; A140-I144 WeakPolarHBondContact O-CG1 3.47Å; A140-I144 PolarHBondContact O-N 2.78Å; V141-I144 PolarHBondContact O-N 3.34Å; L142-I144 VanDerWaalsContact C-N 3.35Å; L142-I144 PolarHBondContact O-N 3.41Å; I144-A147 PolarHBondContact O-N 2.75Å; I144-S148 WeakPolarHBondContact O-CB 3.44Å; I144-S148 PolarHBondContact O-N 3.3Å; I144-S148 PolarHBondContact O-OG 2.73Å |
| 145 | L | 81.7 | Confident | 80.5 | Confident | 87 Ų | 87 | 75.1 Ų | 75.1 | 46% | 0.455 | 41% | 0.411 | S | S | . | . | H | α-helix | trans | -62.5 | -43.9 | 176.8 | -75.4 | 172.9 | 0 | 0 | 0 | 111.6 | V141 L142 S148 Y149 | V141-L145 HydrophobicContact CG1-CD1 4.04Å; V141-L145 HydrophobicContact CG1-CG 4.43Å; V141-L145 WeakPolarHBondContact O-CG 3.34Å; V141-L145 PolarHBondContact O-N 3.27Å; L142-L145 PolarHBondContact O-N 2.93Å; L145-S148 PolarHBondContact O-N 2.85Å; L145-Y149 WeakPolarHBondContact O-CB 3.28Å; L145-Y149 PolarHBondContact O-N 3.43Å |
| 146 | L | 86 | Confident | 80.5 | Confident | 107 Ų | 107 | 73.5 Ų | 73.5 | 56% | 0.56 | 42% | 0.417 | S | S | * | . | H | α-helix | trans | -63.7 | -45.9 | 177.1 | -177 | 63.7 | 0 | 0 | 0 | 111.4 | L142 S148 Y149 L150 | L142-L146 VanDerWaalsContact O-CB 3.3Å; L142-L146 WeakPolarHBondContact O-CB 3.47Å; L142-L146 PolarHBondContact O-N 3.11Å; L146-S148 VanDerWaalsContact C-N 3.32Å; L146-S148 PolarHBondContact O-N 3.24Å; L146-Y149 PolarHBondContact O-N 3.39Å; L146-L150 HydrophobicContact CG-CD1 4.45Å; L146-L150 WeakPolarHBondContact O-CG 3.44Å; L146-L150 PolarHBondContact O-N 2.77Å |
| 147 | A | 84.6 | Confident | 80.7 | Confident | 41 Ų | 41 | 69.3 Ų | 69.3 | 34% | 0.339 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -60.3 | -42.3 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | A143 I144 L150 F151 | A143-A147 WeakPolarHBondContact O-CB 3.48Å; A143-A147 PolarHBondContact O-N 2.83Å; I144-A147 PolarHBondContact O-N 2.75Å; A147-L150 PolarHBondContact O-N 3.1Å; A147-F151 PolarHBondContact O-N 3.28Å |
| 148 | S | 82.1 | Confident | 80.9 | Confident | 3 Ų | 3 | 66.8 Ų | 66.8 | 2% | 0.021 | 38% | 0.384 | C | S | . | . | H | α-helix | trans | -64.1 | -42.9 | 177.1 | -54.3 | 0 | 0 | 0 | 0 | 111.7 | L115 I144 L145 L146 F151 I152 | L115-S148 WeakPolarHBondContact CD1-OG 3.35Å; I144-S148 WeakPolarHBondContact O-CB 3.44Å; I144-S148 PolarHBondContact O-N 3.3Å; I144-S148 PolarHBondContact O-OG 2.73Å; L145-S148 PolarHBondContact O-N 2.85Å; L146-S148 VanDerWaalsContact C-N 3.32Å; L146-S148 PolarHBondContact O-N 3.24Å; S148-F151 PolarHBondContact O-N 2.8Å; S148-I152 WeakPolarHBondContact O-CB 3.05Å; S148-I152 VanDerWaalsContact O-CG1 3.26Å; S148-I152 WeakPolarHBondContact O-CG1 3.44Å; S148-I152 PolarHBondContact O-N 3.47Å |
| 149 | Y | 84.4 | Confident | 80.9 | Confident | 107 Ų | 107 | 63.7 Ų | 63.7 | 42% | 0.42 | 38% | 0.377 | S | S | . | . | H | α-helix | trans | -60.4 | -46.7 | 176 | 175 | -97 | 0 | 0 | 0 | 112.3 | L145 L146 F151 I152 S153 V158 | L145-Y149 WeakPolarHBondContact O-CB 3.28Å; L145-Y149 PolarHBondContact O-N 3.43Å; L146-Y149 PolarHBondContact O-N 3.39Å; Y149-F151 VanDerWaalsContact C-N 3.32Å; Y149-F151 PolarHBondContact O-N 3.41Å; Y149-I152 PolarHBondContact O-N 2.87Å; Y149-S153 WeakPolarHBondContact O-CB 3.23Å; Y149-S153 PolarHBondContact O-N 3.26Å; Y149-V158 HydrophobicContact CD2-CG1 4.18Å; Y149-V158 HydrophobicContact CE2-CG1 3.58Å |
| 150 | L | 84.1 | Confident | 80.8 | Confident | 98 Ų | 98 | 61 Ų | 61 | 51% | 0.513 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -63.9 | -36 | 178 | -68.4 | 175.6 | 0 | 0 | 0 | 112.5 | L146 A147 S153 V154 | L146-L150 HydrophobicContact CG-CD1 4.45Å; L146-L150 WeakPolarHBondContact O-CG 3.44Å; L146-L150 PolarHBondContact O-N 2.77Å; A147-L150 PolarHBondContact O-N 3.1Å; L150-S153 PolarHBondContact O-OG 2.83Å; L150-V154 PolarHBondContact O-N 2.96Å |
| 151 | F | 81.8 | Confident | 80.7 | Confident | 116 Ų | 116 | 62.5 Ų | 62.5 | 51% | 0.509 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -71.4 | -40.5 | 179.4 | -146.7 | -89.7 | 0 | 0 | 0 | 111.5 | V111 L115 A147 S148 Y149 S153 V154 L155 | V111-F151 HydrophobicContact CB-CD1 4.38Å; V111-F151 HydrophobicContact CG1-CB 3.87Å; V111-F151 HydrophobicContact CG1-CD1 3.62Å; V111-F151 HydrophobicContact CG1-CG 4.01Å; V111-F151 HydrophobicContact CG2-CD1 3.78Å; V111-F151 HydrophobicContact CG2-CE1 4.12Å; L115-F151 HydrophobicContact CD1-CB 4.44Å; A147-F151 PolarHBondContact O-N 3.28Å; S148-F151 PolarHBondContact O-N 2.8Å; Y149-F151 VanDerWaalsContact C-N 3.32Å; Y149-F151 PolarHBondContact O-N 3.41Å; F151-S153 VanDerWaalsContact C-N 3.33Å; F151-V154 PolarHBondContact O-N 2.92Å; F151-L155 HydrophobicContact CD1-CD1 4.03Å; F151-L155 HydrophobicContact CE1-CD1 4.35Å; F151-L155 WeakPolarHBondContact O-CG 3.29Å; F151-L155 PolarHBondContact O-N 3.24Å |
| 152 | I | 81.1 | Confident | 80.8 | Confident | 6 Ų | 6 | 62.7 Ų | 62.7 | 3% | 0.031 | 37% | 0.367 | C | S | . | . | H | α-helix | trans | -74.2 | -26.1 | 179.2 | -65.3 | 172.4 | 0 | 0 | 0 | 111.6 | V111 S148 Y149 V154 L155 G156 G157 V158 F161 | V111-I152 HydrophobicContact CG1-CD1 4.49Å; V111-I152 HydrophobicContact CG1-CG1 4.06Å; S148-I152 WeakPolarHBondContact O-CB 3.05Å; S148-I152 VanDerWaalsContact O-CG1 3.26Å; S148-I152 WeakPolarHBondContact O-CG1 3.44Å; S148-I152 PolarHBondContact O-N 3.47Å; Y149-I152 PolarHBondContact O-N 2.87Å; I152-V154 VanDerWaalsContact C-N 3.34Å; I152-L155 PolarHBondContact O-N 3.43Å; I152-G156 PolarHBondContact O-N 3.45Å; I152-G156 VanDerWaalsContact O-N 3.14Å; I152-G157 VanDerWaalsContact CG2-C 3.45Å; I152-G157 PolarHBondContact O-N 3.09Å; I152-V158 HydrophobicContact CG2-CG2 4.23Å; I152-F161 HydrophobicContact CD1-CB 4.01Å; I152-F161 HydrophobicContact CD1-CD1 3.57Å; I152-F161 HydrophobicContact CD1-CD2 3.34Å; I152-F161 HydrophobicContact CD1-CE1 3.75Å; I152-F161 HydrophobicContact CD1-CE2 3.53Å; I152-F161 HydrophobicContact CD1-CG 3.34Å; I152-F161 HydrophobicContact CD1-CZ 3.71Å; I152-F161 HydrophobicContact CG2-CB 3.92Å; I152-F161 HydrophobicContact CG2-CG 4.35Å |
| 153 | S | 81.7 | Confident | 80.5 | Confident | 53 Ų | 53 | 65.6 Ų | 65.6 | 37% | 0.371 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -65.4 | -35.6 | 173.1 | 73.1 | 0 | 0 | 0 | 0 | 113.1 | Y149 L150 F151 L155 G156 | Y149-S153 WeakPolarHBondContact O-CB 3.23Å; Y149-S153 PolarHBondContact O-N 3.26Å; L150-S153 PolarHBondContact O-OG 2.83Å; F151-S153 VanDerWaalsContact C-N 3.33Å; S153-L155 VanDerWaalsContact C-N 3.31Å; S153-G156 PolarHBondContact O-N 2.8Å |
| 154 | V | 82.1 | Confident | 80.4 | Confident | 128 Ų | 128 | 63.5 Ų | 63.5 | 78% | 0.776 | 36% | 0.36 | S | S | * | . | H | α-helix | trans | -68.5 | -32.3 | 173 | 178.6 | 0 | 0 | 0 | 0 | 111.7 | L150 F151 I152 | L150-V154 PolarHBondContact O-N 2.96Å; F151-V154 PolarHBondContact O-N 2.92Å; I152-V154 VanDerWaalsContact C-N 3.34Å |
| 155 | L | 78.3 | Confident | 80.2 | Confident | 91 Ų | 91 | 66.1 Ų | 66.1 | 48% | 0.476 | 37% | 0.373 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -85.5 | -3.9 | -178.7 | -63.6 | 170.5 | 0 | 0 | 0 | 113.9 | V107 V111 F151 I152 S153 G157 | V107-L155 HydrophobicContact CG1-CD1 3.75Å; V111-L155 HydrophobicContact CG2-CD1 3.78Å; F151-L155 HydrophobicContact CD1-CD1 4.03Å; F151-L155 HydrophobicContact CE1-CD1 4.35Å; F151-L155 WeakPolarHBondContact O-CG 3.29Å; F151-L155 PolarHBondContact O-N 3.24Å; I152-L155 PolarHBondContact O-N 3.43Å; S153-L155 VanDerWaalsContact C-N 3.31Å; L155-G157 PolarHBondContact O-N 3.48Å |
| 156 | G | 76.4 | Confident | 80.2 | Confident | 64 Ų | 64 | 64 Ų | 64 | 66% | 0.66 | 37% | 0.368 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 71.4 | 11.5 | 178.5 | 0 | 0 | 0 | 0 | 0 | 115.3 | I152 S153 | I152-G156 PolarHBondContact O-N 3.45Å; I152-G156 VanDerWaalsContact O-N 3.14Å; S153-G156 PolarHBondContact O-N 2.8Å |
| 157 | G | 78.5 | Confident | 79.8 | Confident | 12 Ų | 12 | 60.6 Ų | 60.6 | 12% | 0.124 | 35% | 0.353 | C | S | . | . | trans | -99.3 | 14.4 | -176.1 | 0 | 0 | 0 | 0 | 0 | 115 | I152 L155 A159 V160 F161 | I152-G157 VanDerWaalsContact CG2-C 3.45Å; I152-G157 PolarHBondContact O-N 3.09Å; L155-G157 PolarHBondContact O-N 3.48Å; G157-A159 VanDerWaalsContact C-N 3.33Å; G157-A159 PolarHBondContact O-N 3.16Å; G157-V160 PolarHBondContact O-N 3.39Å; G157-F161 PolarHBondContact O-N 3Å | ||
| 158 | V | 78.9 | Confident | 79.7 | Confident | 30 Ų | 30 | 59.3 Ų | 59.3 | 18% | 0.182 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -60.1 | -42.1 | -169.5 | -176.4 | 0 | 0 | 0 | 0 | 112.1 | Y149 I152 F161 L162 | Y149-V158 HydrophobicContact CD2-CG1 4.18Å; Y149-V158 HydrophobicContact CE2-CG1 3.58Å; I152-V158 HydrophobicContact CG2-CG2 4.23Å; V158-F161 PolarHBondContact O-N 3.18Å; V158-L162 HydrophobicContact CG1-CD1 3.62Å; V158-L162 HydrophobicContact CG1-CG 3.97Å; V158-L162 VanDerWaalsContact O-CB 3.31Å; V158-L162 WeakPolarHBondContact O-CB 3.1Å; V158-L162 VanDerWaalsContact O-CG 3.3Å; V158-L162 WeakPolarHBondContact O-CG 3.42Å; V158-L162 PolarHBondContact O-N 3.29Å |
| 159 | A | 76.9 | Confident | 79.5 | Confident | 63 Ų | 63 | 62.8 Ų | 62.8 | 52% | 0.521 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -62 | -50 | -179 | 0 | 0 | 0 | 0 | 0 | 111.2 | G157 F161 L162 F163 | G157-A159 VanDerWaalsContact C-N 3.33Å; G157-A159 PolarHBondContact O-N 3.16Å; A159-F161 VanDerWaalsContact C-N 3.3Å; A159-F161 PolarHBondContact O-N 2.95Å; A159-L162 PolarHBondContact O-N 3.29Å; A159-F163 WeakPolarHBondContact O-CB 3.1Å; A159-F163 VanDerWaalsContact O-CD2 3.28Å; A159-F163 WeakPolarHBondContact O-CD2 3.45Å; A159-F163 PolarHBondContact O-N 3.27Å |
| 160 | V | 75.9 | Confident | 79.2 | Confident | 24 Ų | 24 | 62.8 Ų | 62.8 | 15% | 0.145 | 37% | 0.369 | C | S | . | . | H | α-helix | trans | -64.2 | -36.8 | 179.7 | 173.8 | 0 | 0 | 0 | 0 | 111.5 | V97 Q101 Q104 G157 G164 | V97-V160 HydrophobicContact CG1-CG1 4.44Å; Q101-V160 HydrophobicContact CB-CG1 4.09Å; Q101-V160 HydrophobicContact CB-CG2 4.04Å; Q101-V160 HydrophobicContact CG-CG2 3.96Å; Q104-V160 HydrophobicContact CB-CB 4.28Å; Q104-V160 HydrophobicContact CB-CG1 4.1Å; Q104-V160 HydrophobicContact CB-CG2 4.47Å; G157-V160 PolarHBondContact O-N 3.39Å; V160-G164 WeakPolarHBondContact O-CA 3.18Å; V160-G164 PolarHBondContact O-N 2.98Å |
| 161 | F | 75 | Confident | 79.1 | Confident | 35 Ų | 35 | 61.4 Ų | 61.4 | 15% | 0.154 | 36% | 0.361 | C | S | . | . | H | α-helix | trans | -68 | -46.8 | 175.8 | -174.6 | -108.6 | 0 | 0 | 0 | 113.1 | V112 I152 G157 V158 A159 G164 I165 | V112-F161 HydrophobicContact CG2-CE2 3.44Å; V112-F161 VanDerWaalsContact CG2-CE2 3.44Å; V112-F161 HydrophobicContact CG2-CZ 3.59Å; I152-F161 HydrophobicContact CD1-CB 4.01Å; I152-F161 HydrophobicContact CD1-CD1 3.57Å; I152-F161 HydrophobicContact CD1-CD2 3.34Å; I152-F161 HydrophobicContact CD1-CE1 3.75Å; I152-F161 HydrophobicContact CD1-CE2 3.53Å; I152-F161 HydrophobicContact CD1-CG 3.34Å; I152-F161 HydrophobicContact CD1-CZ 3.71Å; I152-F161 HydrophobicContact CG2-CB 3.92Å; I152-F161 HydrophobicContact CG2-CG 4.35Å; G157-F161 PolarHBondContact O-N 3Å; V158-F161 PolarHBondContact O-N 3.18Å; A159-F161 VanDerWaalsContact C-N 3.3Å; A159-F161 PolarHBondContact O-N 2.95Å; F161-G164 PolarHBondContact O-N 2.77Å; F161-I165 HydrophobicContact CD1-CD1 4.28Å; F161-I165 HydrophobicContact CD2-CD1 4.31Å; F161-I165 HydrophobicContact CE1-CD1 3.65Å; F161-I165 HydrophobicContact CE2-CD1 3.69Å; F161-I165 HydrophobicContact CZ-CD1 3.33Å; F161-I165 PolarHBondContact O-N 3.47Å; F161-I165 VanDerWaalsContact O-N 3.1Å |
| 162 | L | 79.3 | Confident | 79 | Confident | 88 Ų | 88 | 56.9 Ų | 56.9 | 46% | 0.461 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -63.1 | -46.4 | 177.2 | -75 | 177.8 | 0 | 0 | 0 | 111 | V158 A159 G164 I165 A166 | V158-L162 HydrophobicContact CG1-CD1 3.62Å; V158-L162 HydrophobicContact CG1-CG 3.97Å; V158-L162 VanDerWaalsContact O-CB 3.31Å; V158-L162 WeakPolarHBondContact O-CB 3.1Å; V158-L162 VanDerWaalsContact O-CG 3.3Å; V158-L162 WeakPolarHBondContact O-CG 3.42Å; V158-L162 PolarHBondContact O-N 3.29Å; A159-L162 PolarHBondContact O-N 3.29Å; L162-G164 VanDerWaalsContact C-N 3.34Å; L162-I165 PolarHBondContact O-N 2.74Å; L162-A166 WeakPolarHBondContact O-CA 3.47Å; L162-A166 WeakPolarHBondContact O-CB 3.44Å; L162-A166 PolarHBondContact O-N 3.03Å |
| 163 | F | 78.3 | Confident | 78.6 | Confident | 149 Ų | 149 | 60 Ų | 60 | 65% | 0.654 | 36% | 0.359 | S | S | * | . | H | α-helix | trans | -65.4 | -37.9 | 176 | -87.4 | -78.9 | 0 | 0 | 0 | 112.1 | A159 I165 S167 | A159-F163 WeakPolarHBondContact O-CB 3.1Å; A159-F163 VanDerWaalsContact O-CD2 3.28Å; A159-F163 WeakPolarHBondContact O-CD2 3.45Å; A159-F163 PolarHBondContact O-N 3.27Å; F163-I165 VanDerWaalsContact C-N 3.31Å; F163-I165 PolarHBondContact O-N 3.25Å; F163-S167 WeakPolarHBondContact O-CB 3.42Å; F163-S167 PolarHBondContact O-N 3.48Å |
| 164 | G | 78.8 | Confident | 78.1 | Confident | 4 Ų | 4 | 60.6 Ų | 60.6 | 4% | 0.041 | 36% | 0.36 | C | S | . | . | H | α-helix | trans | -62.4 | -33.3 | 177.4 | 0 | 0 | 0 | 0 | 0 | 113.7 | V160 F161 L162 P168 | V160-G164 WeakPolarHBondContact O-CA 3.18Å; V160-G164 PolarHBondContact O-N 2.98Å; F161-G164 PolarHBondContact O-N 2.77Å; L162-G164 VanDerWaalsContact C-N 3.34Å; G164-P168 WeakPolarHBondContact O-CD 3.49Å; G164-P168 WeakPolarHBondContact O-CG 3.45Å |
| 165 | I | 79.3 | Confident | 77.6 | Confident | 82 Ų | 82 | 55.6 Ų | 55.6 | 42% | 0.421 | 33% | 0.329 | S | S | . | . | H | α-helix | trans | -91.6 | -42.6 | 176.3 | -63.8 | 176 | 0 | 0 | 0 | 111.7 | F161 L162 F163 P168 V169 | F161-I165 HydrophobicContact CD1-CD1 4.28Å; F161-I165 HydrophobicContact CD2-CD1 4.31Å; F161-I165 HydrophobicContact CE1-CD1 3.65Å; F161-I165 HydrophobicContact CE2-CD1 3.69Å; F161-I165 HydrophobicContact CZ-CD1 3.33Å; F161-I165 PolarHBondContact O-N 3.47Å; F161-I165 VanDerWaalsContact O-N 3.1Å; L162-I165 PolarHBondContact O-N 2.74Å; F163-I165 VanDerWaalsContact C-N 3.31Å; F163-I165 PolarHBondContact O-N 3.25Å; I165-P168 WeakPolarHBondContact O-CD 3.45Å; I165-V169 WeakPolarHBondContact O-CG2 3.44Å; I165-V169 PolarHBondContact O-N 2.89Å |
| 166 | A | 81.4 | Confident | 77.1 | Confident | 42 Ų | 42 | 51.3 Ų | 51.3 | 35% | 0.347 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -68.6 | -39.1 | -176.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | L162 V169 L170 | L162-A166 WeakPolarHBondContact O-CA 3.47Å; L162-A166 WeakPolarHBondContact O-CB 3.44Å; L162-A166 PolarHBondContact O-N 3.03Å; A166-V169 PolarHBondContact O-N 3.02Å; A166-L170 HydrophobicContact CB-CD1 4.5Å; A166-L170 VanDerWaalsContact O-CB 3.27Å; A166-L170 WeakPolarHBondContact O-CB 3.35Å; A166-L170 WeakPolarHBondContact O-CG 3.45Å; A166-L170 PolarHBondContact O-N 3.21Å |
| 167 | S | 77.8 | Confident | 76.4 | Confident | 37 Ų | 37 | 49.5 Ų | 49.5 | 26% | 0.259 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -62.9 | -50.6 | -177.1 | 178.4 | 0 | 0 | 0 | 0 | 112.9 | F163 V169 L170 M171 | F163-S167 WeakPolarHBondContact O-CB 3.42Å; F163-S167 PolarHBondContact O-N 3.48Å; S167-V169 VanDerWaalsContact C-N 3.33Å; S167-V169 PolarHBondContact O-N 3.46Å; S167-L170 PolarHBondContact O-N 2.74Å; S167-M171 WeakPolarHBondContact O-CB 3.2Å; S167-M171 PolarHBondContact O-N 3.05Å |
| 168 | P | 80.6 | Confident | 75.4 | Confident | 14 Ų | 14 | 51.7 Ų | 51.7 | 9% | 0.091 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -59.1 | -43 | 174 | -23.8 | 33 | 0 | 0 | 0 | 112.8 | A90 F93 G164 I165 M171 V172 | A90-P168 HydrophobicContact CB-CB 3.93Å; F93-P168 HydrophobicContact CB-CG 4.11Å; G164-P168 WeakPolarHBondContact O-CD 3.49Å; G164-P168 WeakPolarHBondContact O-CG 3.45Å; I165-P168 WeakPolarHBondContact O-CD 3.45Å; P168-M171 PolarHBondContact O-N 2.95Å; P168-V172 WeakPolarHBondContact O-CB 3.33Å; P168-V172 VanDerWaalsContact O-CG2 3.23Å; P168-V172 WeakPolarHBondContact O-CG2 3.22Å; P168-V172 PolarHBondContact O-N 3.29Å |
| 169 | V | 79.6 | Confident | 74.5 | Confident | 75 Ų | 75 | 52.9 Ų | 52.9 | 46% | 0.455 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -65.7 | -47.1 | -178.3 | 171.7 | 0 | 0 | 0 | 0 | 111 | I165 A166 S167 M171 V172 L173 | I165-V169 WeakPolarHBondContact O-CG2 3.44Å; I165-V169 PolarHBondContact O-N 2.89Å; A166-V169 PolarHBondContact O-N 3.02Å; S167-V169 VanDerWaalsContact C-N 3.33Å; S167-V169 PolarHBondContact O-N 3.46Å; V169-M171 PolarHBondContact O-N 3.27Å; V169-V172 PolarHBondContact O-N 2.88Å; V169-L173 HydrophobicContact CG1-CD1 3.85Å; V169-L173 HydrophobicContact CG1-CG 4.33Å; V169-L173 WeakPolarHBondContact O-CB 3.27Å; V169-L173 VanDerWaalsContact O-CG 3.26Å; V169-L173 WeakPolarHBondContact O-CG 3.08Å; V169-L173 PolarHBondContact O-N 3.14Å |
| 170 | L | 78.3 | Confident | 73.4 | Confident | 107 Ų | 107 | 51.1 Ų | 51.1 | 56% | 0.56 | 27% | 0.274 | S | S | * | . | H | α-helix | trans | -62.4 | -43.8 | 178 | -73.4 | 173.2 | 0 | 0 | 0 | 111.1 | A166 S167 L173 V174 | A166-L170 HydrophobicContact CB-CD1 4.5Å; A166-L170 VanDerWaalsContact O-CB 3.27Å; A166-L170 WeakPolarHBondContact O-CB 3.35Å; A166-L170 WeakPolarHBondContact O-CG 3.45Å; A166-L170 PolarHBondContact O-N 3.21Å; S167-L170 PolarHBondContact O-N 2.74Å; L170-L173 PolarHBondContact O-N 3.43Å; L170-V174 WeakPolarHBondContact O-CB 3.5Å; L170-V174 WeakPolarHBondContact O-CG2 3.42Å; L170-V174 PolarHBondContact O-N 3.24Å |
| 171 | M | 81.6 | Confident | 72.4 | Confident | 69 Ų | 69 | 57 Ų | 57 | 34% | 0.34 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -60.3 | -48.9 | 174.9 | 168.6 | 40.8 | 66.5 | 0 | 0 | 111.3 | F93 S167 P168 V169 L173 V174 H175 | F93-M171 HydrophobicContact CD2-CG 4.31Å; F93-M171 HydrophobicContact CE2-CB 4.22Å; F93-M171 HydrophobicContact CE2-CG 3.67Å; F93-M171 HydrophobicContact CZ-CB 4.48Å; F93-M171 HydrophobicContact CZ-CG 4.17Å; S167-M171 WeakPolarHBondContact O-CB 3.2Å; S167-M171 PolarHBondContact O-N 3.05Å; P168-M171 PolarHBondContact O-N 2.95Å; V169-M171 PolarHBondContact O-N 3.27Å; M171-L173 VanDerWaalsContact C-N 3.31Å; M171-L173 PolarHBondContact O-N 3.46Å; M171-V174 PolarHBondContact O-N 3.43Å; M171-H175 VanDerWaalsContact O-CB 3.24Å; M171-H175 WeakPolarHBondContact O-CB 3.21Å; M171-H175 PolarHBondContact O-N 2.88Å; M171-H175 HydrophobicContact SD-CB 3.9Å |
| 172 | V | 79.3 | Confident | 71.4 | Confident | 22 Ų | 22 | 59.8 Ų | 59.8 | 13% | 0.133 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -57.8 | -44.5 | 178 | 169.2 | 0 | 0 | 0 | 0 | 111.2 | L79 Y86 P168 V169 A176 | L79-V172 HydrophobicContact CD2-CG1 3.72Å; Y86-V172 HydrophobicContact CD1-CB 4.18Å; Y86-V172 HydrophobicContact CD1-CG1 3.75Å; Y86-V172 HydrophobicContact CD1-CG2 3.91Å; Y86-V172 HydrophobicContact CE1-CG1 4.21Å; Y86-V172 HydrophobicContact CG-CG1 3.98Å; Y86-V172 HydrophobicContact CG-CG2 4.33Å; P168-V172 WeakPolarHBondContact O-CB 3.33Å; P168-V172 VanDerWaalsContact O-CG2 3.23Å; P168-V172 WeakPolarHBondContact O-CG2 3.22Å; P168-V172 PolarHBondContact O-N 3.29Å; V169-V172 PolarHBondContact O-N 2.88Å; V172-A176 WeakPolarHBondContact O-CB 3.42Å; V172-A176 PolarHBondContact O-N 3.39Å |
| 173 | L | 72.2 | Confident | 70.1 | Confident | 71 Ų | 71 | 57.5 Ų | 57.5 | 37% | 0.372 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -67 | -44.8 | 178.5 | -70.7 | 175.6 | 0 | 0 | 0 | 112.2 | M75 V169 L170 M171 A176 S177 | M75-L173 HydrophobicContact SD-CD2 4.01Å; V169-L173 HydrophobicContact CG1-CD1 3.85Å; V169-L173 HydrophobicContact CG1-CG 4.33Å; V169-L173 WeakPolarHBondContact O-CB 3.27Å; V169-L173 VanDerWaalsContact O-CG 3.26Å; V169-L173 WeakPolarHBondContact O-CG 3.08Å; V169-L173 PolarHBondContact O-N 3.14Å; L170-L173 PolarHBondContact O-N 3.43Å; M171-L173 VanDerWaalsContact C-N 3.31Å; M171-L173 PolarHBondContact O-N 3.46Å; L173-A176 PolarHBondContact O-N 3.13Å; L173-S177 WeakPolarHBondContact O-CB 3.39Å; L173-S177 PolarHBondContact O-N 3.05Å; L173-S177 PolarHBondContact O-OG 3.09Å; L173-S177 VanDerWaalsContact O-OG 3.1Å |
| 174 | V | 71.5 | Confident | 68.7 | Low | 65 Ų | 65 | 55 Ų | 55 | 39% | 0.394 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -62.3 | -50 | 177.5 | 169.4 | 0 | 0 | 0 | 0 | 109.6 | L170 M171 A176 S177 M178 | L170-V174 WeakPolarHBondContact O-CB 3.5Å; L170-V174 WeakPolarHBondContact O-CG2 3.42Å; L170-V174 PolarHBondContact O-N 3.24Å; M171-V174 PolarHBondContact O-N 3.43Å; V174-A176 PolarHBondContact O-N 3.44Å; V174-S177 WeakPolarHBondContact CA-OG 3.49Å; V174-S177 PolarHBondContact O-N 3.18Å; V174-S177 PolarHBondContact O-OG 3.48Å; V174-M178 HydrophobicContact CG1-CE 4.45Å; V174-M178 HydrophobicContact CG1-CG 4.3Å; V174-M178 HydrophobicContact CG1-SD 3.33Å; V174-M178 WeakPolarHBondContact CG1-SD 3.47Å; V174-M178 VanDerWaalsContact O-CB 3.29Å; V174-M178 WeakPolarHBondContact O-CB 3.43Å; V174-M178 VanDerWaalsContact O-CG 3.23Å; V174-M178 WeakPolarHBondContact O-CG 3.14Å; V174-M178 PolarHBondContact O-N 3.15Å |
| 175 | H | 72.2 | Confident | 67.7 | Low | 24 Ų | 24 | 58.8 Ų | 58.8 | 11% | 0.111 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -60.2 | -47.5 | 176.1 | -171.5 | 99.2 | 0 | 0 | 0 | 111.9 | F53 Y86 M171 S177 M178 R179 | F53-H175 AromaticContact CD2-NE2 3.7Å; F53-H175 AromaticContact CE2-CD2 3.76Å; F53-H175 AromaticContact CE2-CE1 3.67Å; F53-H175 AromaticContact CE2-NE2 3.24Å; F53-H175 WeakPolarHBondContact CE2-NE2 3.34Å; F53-H175 AromaticContact CZ-CE1 3.89Å; F53-H175 AromaticContact CZ-NE2 3.84Å; Y86-H175 HydrophobicContact CE1-CB 4.23Å; Y86-H175 AromaticContact CE1-CD2 3.54Å; Y86-H175 AromaticContact CZ-CD2 3.97Å; M171-H175 VanDerWaalsContact O-CB 3.24Å; M171-H175 WeakPolarHBondContact O-CB 3.21Å; M171-H175 PolarHBondContact O-N 2.88Å; M171-H175 HydrophobicContact SD-CB 3.9Å; H175-S177 VanDerWaalsContact C-N 3.32Å; H175-S177 PolarHBondContact O-N 2.93Å; H175-M178 PolarHBondContact O-N 2.91Å; H175-R179 WeakPolarHBondContact O-CB 3.12Å; H175-R179 PolarHBondContact O-N 3.2Å |
| 176 | A | 67.1 | Low | 66.6 | Low | 1 Ų | 1 | 59.6 Ų | 59.6 | 1% | 0.008 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -64.6 | -35 | 178.9 | 0 | 0 | 0 | 0 | 0 | 112.8 | M75 N78 L79 V172 L173 V174 | M75-A176 HydrophobicContact CG-CB 4.18Å; N78-A176 PolarHBondContact ND2-O 3.14Å; L79-A176 HydrophobicContact CG-CB 4.29Å; V172-A176 WeakPolarHBondContact O-CB 3.42Å; V172-A176 PolarHBondContact O-N 3.39Å; L173-A176 PolarHBondContact O-N 3.13Å; V174-A176 PolarHBondContact O-N 3.44Å |
| 177 | S | 61.8 | Low | 65.5 | Low | 26 Ų | 26 | 63 Ų | 63 | 18% | 0.182 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -73.5 | -39.9 | 177.8 | 74.4 | 0 | 0 | 0 | 0 | 112.8 | L173 V174 H175 | L173-S177 WeakPolarHBondContact O-CB 3.39Å; L173-S177 PolarHBondContact O-N 3.05Å; L173-S177 PolarHBondContact O-OG 3.09Å; L173-S177 VanDerWaalsContact O-OG 3.1Å; V174-S177 WeakPolarHBondContact CA-OG 3.49Å; V174-S177 PolarHBondContact O-N 3.18Å; V174-S177 PolarHBondContact O-OG 3.48Å; H175-S177 VanDerWaalsContact C-N 3.32Å; H175-S177 PolarHBondContact O-N 2.93Å |
| 178 | M | 58.4 | Low | 64.5 | Low | 57 Ų | 57 | 65 Ų | 65 | 28% | 0.281 | 32% | 0.324 | S | S | . | . | H | α-helix | trans | -80.4 | -21 | -178.5 | -69.2 | 173 | 21.2 | 0 | 0 | 111.8 | F60 V174 H175 L180 | F60-M178 HydrophobicContact CB-CB 4.4Å; F60-M178 HydrophobicContact CB-CE 4.03Å; F60-M178 HydrophobicContact CD1-CB 3.61Å; F60-M178 HydrophobicContact CD1-CE 3.21Å; F60-M178 HydrophobicContact CD2-CE 4Å; F60-M178 HydrophobicContact CE1-CB 4.28Å; F60-M178 HydrophobicContact CE1-CE 3.42Å; F60-M178 VanDerWaalsContact CE1-CE 3.42Å; F60-M178 HydrophobicContact CE2-CE 4.22Å; F60-M178 HydrophobicContact CG-CB 4.38Å; F60-M178 HydrophobicContact CG-CE 3.48Å; F60-M178 VanDerWaalsContact CG-CE 3.48Å; F60-M178 HydrophobicContact CZ-CE 3.94Å; V174-M178 HydrophobicContact CG1-CE 4.45Å; V174-M178 HydrophobicContact CG1-CG 4.3Å; V174-M178 HydrophobicContact CG1-SD 3.33Å; V174-M178 WeakPolarHBondContact CG1-SD 3.47Å; V174-M178 VanDerWaalsContact O-CB 3.29Å; V174-M178 WeakPolarHBondContact O-CB 3.43Å; V174-M178 VanDerWaalsContact O-CG 3.23Å; V174-M178 WeakPolarHBondContact O-CG 3.14Å; V174-M178 PolarHBondContact O-N 3.15Å; H175-M178 PolarHBondContact O-N 2.91Å; M178-L180 PolarHBondContact O-N 3.18Å |
| 179 | R | 60.3 | Low | 63.7 | Low | 56 Ų | 56 | 69.2 Ų | 69.2 | 21% | 0.211 | 35% | 0.345 | C | S | . | . | trans | -73.5 | 123.1 | 177.7 | -168.7 | -159.9 | -176.4 | 89.7 | 25.9 | 112 | N78 Y82 H175 | N78-R179 PolarHBondContact ND2-O 3.21Å; Y82-R179 VanDerWaalsContact CD2-CZ 3.5Å; Y82-R179 VanDerWaalsContact CD2-NH1 3.29Å; Y82-R179 PolarHBondContact OH-NH2 2.87Å; H175-R179 WeakPolarHBondContact O-CB 3.12Å; H175-R179 PolarHBondContact O-N 3.2Å | ||
| 180 | L | 53 | Low | 62.8 | Low | 26 Ų | 26 | 71.2 Ų | 71.2 | 14% | 0.136 | 35% | 0.348 | C | S | . | . | trans | -127.1 | 62 | -156.9 | -147.9 | 77.9 | 0 | 0 | 0 | 113.4 | A61 M178 N182 L183 | A61-L180 HydrophobicContact CB-CD1 4.44Å; A61-L180 HydrophobicContact CB-CD2 3.37Å; A61-L180 HydrophobicContact CB-CG 4.5Å; M178-L180 PolarHBondContact O-N 3.18Å; L180-N182 VanDerWaalsContact C-N 3.27Å; L180-N182 PolarHBondContact O-N 2.72Å; L180-L183 HydrophobicContact CD1-CB 4.45Å; L180-L183 HydrophobicContact CD1-CD1 3.65Å; L180-L183 HydrophobicContact CD1-CG 3.84Å; L180-L183 HydrophobicContact CD2-CB 3.33Å; L180-L183 HydrophobicContact CD2-CD1 3.36Å; L180-L183 HydrophobicContact CD2-CG 3.58Å; L180-L183 HydrophobicContact CG-CB 3.53Å; L180-L183 HydrophobicContact CG-CD1 3.62Å; L180-L183 HydrophobicContact CG-CG 3.47Å; L180-L183 VanDerWaalsContact CG-CG 3.47Å | ||
| 181 | R | 55.9 | Low | 62 | Low | 148 Ų | 148 | 72 Ų | 72 | 56% | 0.558 | 35% | 0.352 | S | S | * | . | H | α-helix | trans | -61.9 | -27.2 | -176.5 | -170 | 171 | 174.2 | 169.7 | -2.6 | 114.5 | ||
| 182 | N | 53.1 | Low | 60.9 | Low | 93 Ų | 93 | 75 Ų | 75 | 50% | 0.497 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -103.4 | -10.7 | -177.3 | -88.2 | 8.9 | 0 | 0 | 0 | 116.1 | L180 K186 | L180-N182 VanDerWaalsContact C-N 3.27Å; L180-N182 PolarHBondContact O-N 2.72Å; N182-K186 WeakPolarHBondContact O-CB 2.89Å; N182-K186 PolarHBondContact O-N 3.26Å |
| 183 | L | 51.4 | Low | 59.8 | Low | 39 Ų | 39 | 77.5 Ų | 77.5 | 20% | 0.204 | 38% | 0.384 | C | S | . | . | H | α-helix | trans | -79.6 | -20.9 | 174.2 | -66.3 | -167.1 | 0 | 0 | 0 | 112 | A61 L180 K186 L187 | A61-L183 HydrophobicContact CB-CD1 4.18Å; L180-L183 HydrophobicContact CD1-CB 4.45Å; L180-L183 HydrophobicContact CD1-CD1 3.65Å; L180-L183 HydrophobicContact CD1-CG 3.84Å; L180-L183 HydrophobicContact CD2-CB 3.33Å; L180-L183 HydrophobicContact CD2-CD1 3.36Å; L180-L183 HydrophobicContact CD2-CG 3.58Å; L180-L183 HydrophobicContact CG-CB 3.53Å; L180-L183 HydrophobicContact CG-CD1 3.62Å; L180-L183 HydrophobicContact CG-CG 3.47Å; L180-L183 VanDerWaalsContact CG-CG 3.47Å; L183-K186 HydrophobicContact CD2-CB 4.21Å; L183-K186 HydrophobicContact CD2-CD 4.08Å; L183-K186 PolarHBondContact O-N 2.68Å; L183-L187 WeakPolarHBondContact O-CA 3.4Å; L183-L187 WeakPolarHBondContact O-CB 3.04Å; L183-L187 WeakPolarHBondContact O-CG 3.39Å; L183-L187 PolarHBondContact O-N 3.38Å |
| 184 | K | 50.3 | Low | 59.1 | Low | 97 Ų | 97 | 79.2 Ų | 79.2 | 42% | 0.422 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -60.7 | -50.1 | 166.5 | -177.6 | 177.4 | 180 | -179.3 | 0 | 110.4 | R59 K186 L187 E188 | R59-K184 VanDerWaalsContact NH1-CG 3.25Å; K184-K186 VanDerWaalsContact C-N 3.32Å; K184-K186 PolarHBondContact O-N 2.88Å; K184-L187 CarbonylContact O-C 3.46Å; K184-L187 PolarHBondContact O-N 3.4Å; K184-E188 WeakPolarHBondContact CE-OE1 2.79Å; K184-E188 HydrophobicContact CG-CG 4.35Å; K184-E188 WeakPolarHBondContact CG-OE1 3.42Å; K184-E188 IonicContact NZ-OE1 3.51Å; K184-E188 VanDerWaalsContact O-CB 3.26Å; K184-E188 WeakPolarHBondContact O-CB 3.33Å; K184-E188 WeakPolarHBondContact O-CG 3.26Å; K184-E188 PolarHBondContact O-N 2.88Å |
| 185 | N | 57.8 | Low | 58.1 | Low | 83 Ų | 83 | 77.2 Ų | 77.2 | 44% | 0.444 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -65.4 | -35.1 | 176.7 | -58.4 | 4.6 | 0 | 0 | 0 | 112 | N189 | N185-N189 WeakPolarHBondContact O-CB 3.42Å; N185-N189 PolarHBondContact O-N 2.66Å; N185-N189 PolarHBondContact O-ND2 3.37Å; N185-N189 VanDerWaalsContact O-ND2 3.1Å |
| 186 | K | 55.4 | Low | 56.8 | Low | 100 Ų | 100 | 83.8 Ų | 83.8 | 44% | 0.435 | 42% | 0.42 | S | S | . | . | H | α-helix | trans | -74.9 | -32.5 | 176.8 | -157.5 | 175.6 | -177 | -175.6 | 0 | 112.4 | N182 L183 K184 K190 | N182-K186 WeakPolarHBondContact O-CB 2.89Å; N182-K186 PolarHBondContact O-N 3.26Å; L183-K186 HydrophobicContact CD2-CB 4.21Å; L183-K186 HydrophobicContact CD2-CD 4.08Å; L183-K186 PolarHBondContact O-N 2.68Å; K184-K186 VanDerWaalsContact C-N 3.32Å; K184-K186 PolarHBondContact O-N 2.88Å; K186-K190 WeakPolarHBondContact O-CB 3.36Å; K186-K190 WeakPolarHBondContact O-CG 3.03Å; K186-K190 PolarHBondContact O-N 2.71Å |
| 187 | L | 58.7 | Low | 55.7 | Low | 112 Ų | 112 | 92.5 Ų | 92.5 | 59% | 0.586 | 46% | 0.457 | S | S | * | . | H | α-helix | trans | -77.1 | -38.9 | 174.6 | -77.6 | 169.6 | 0 | 0 | 0 | 110.9 | L183 K184 K190 L191 | L183-L187 WeakPolarHBondContact O-CA 3.4Å; L183-L187 WeakPolarHBondContact O-CB 3.04Å; L183-L187 WeakPolarHBondContact O-CG 3.39Å; L183-L187 PolarHBondContact O-N 3.38Å; K184-L187 CarbonylContact O-C 3.46Å; K184-L187 PolarHBondContact O-N 3.4Å; L187-K190 CarbonylContact O-C 3.55Å; L187-K190 PolarHBondContact O-N 2.99Å; L187-L191 WeakPolarHBondContact O-CA 3.12Å; L187-L191 WeakPolarHBondContact O-CB 3.42Å; L187-L191 PolarHBondContact O-N 3.1Å |
| 188 | E | 57 | Low | 55.4 | Low | 80 Ų | 80 | 99.4 Ų | 99.4 | 37% | 0.374 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -64.5 | -48.4 | 171.3 | -76.6 | 169.2 | 176.2 | 0 | 0 | 109.3 | K184 K190 L191 E192 | K184-E188 WeakPolarHBondContact CE-OE1 2.79Å; K184-E188 HydrophobicContact CG-CG 4.35Å; K184-E188 WeakPolarHBondContact CG-OE1 3.42Å; K184-E188 IonicContact NZ-OE1 3.51Å; K184-E188 VanDerWaalsContact O-CB 3.26Å; K184-E188 WeakPolarHBondContact O-CB 3.33Å; K184-E188 WeakPolarHBondContact O-CG 3.26Å; K184-E188 PolarHBondContact O-N 2.88Å; E188-K190 VanDerWaalsContact C-N 3.33Å; E188-K190 PolarHBondContact O-N 3.46Å; E188-L191 CarbonylContact O-C 3.46Å; E188-L191 PolarHBondContact O-N 3.49Å; E188-E192 WeakPolarHBondContact O-CB 3.12Å; E188-E192 VanDerWaalsContact O-CG 3.28Å; E188-E192 WeakPolarHBondContact O-CG 3.18Å; E188-E192 PolarHBondContact O-N 2.9Å |
| 189 | N | 63.8 | Low | 55.2 | Low | 102 Ų | 102 | 100.4 Ų | 100.4 | 55% | 0.545 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -62 | -36.8 | 173.1 | -70.5 | -19.9 | 0 | 0 | 0 | 113.1 | N185 S193 | N185-N189 WeakPolarHBondContact O-CB 3.42Å; N185-N189 PolarHBondContact O-N 2.66Å; N185-N189 PolarHBondContact O-ND2 3.37Å; N185-N189 VanDerWaalsContact O-ND2 3.1Å; N189-S193 WeakPolarHBondContact O-CB 3.17Å; N189-S193 PolarHBondContact O-N 2.98Å |
| 190 | K | 60.2 | Low | 54.9 | Low | 118 Ų | 118 | 102.8 Ų | 102.8 | 51% | 0.513 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -73.2 | -35.4 | 175.8 | -78.4 | -76.9 | -179.7 | -165.3 | 0 | 111.7 | K186 L187 E188 S193 I194 | K186-K190 WeakPolarHBondContact O-CB 3.36Å; K186-K190 WeakPolarHBondContact O-CG 3.03Å; K186-K190 PolarHBondContact O-N 2.71Å; L187-K190 CarbonylContact O-C 3.55Å; L187-K190 PolarHBondContact O-N 2.99Å; E188-K190 VanDerWaalsContact C-N 3.33Å; E188-K190 PolarHBondContact O-N 3.46Å; K190-S193 WeakPolarHBondContact CA-OG 3.27Å; K190-S193 CarbonylContact O-C 3.49Å; K190-S193 PolarHBondContact O-N 3.28Å; K190-S193 PolarHBondContact O-OG 2.97Å; K190-I194 WeakPolarHBondContact O-CB 2.96Å; K190-I194 WeakPolarHBondContact O-CD1 3.4Å; K190-I194 WeakPolarHBondContact O-CG1 3.2Å; K190-I194 PolarHBondContact O-N 3.09Å |
| 191 | L | 60.9 | Low | 54.6 | Low | 122 Ų | 122 | 108.2 Ų | 108.2 | 64% | 0.639 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -81.6 | -20 | 179 | -172.9 | 136.4 | 0 | 0 | 0 | 111.5 | L187 E188 G195 | L187-L191 WeakPolarHBondContact O-CA 3.12Å; L187-L191 WeakPolarHBondContact O-CB 3.42Å; L187-L191 PolarHBondContact O-N 3.1Å; E188-L191 CarbonylContact O-C 3.46Å; E188-L191 PolarHBondContact O-N 3.49Å; L191-G195 WeakPolarHBondContact O-CA 3.38Å; L191-G195 PolarHBondContact O-N 3.48Å |
| 192 | E | 58.1 | Low | 54.4 | Low | 132 Ų | 132 | 102.7 Ų | 102.7 | 62% | 0.617 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -72.7 | -44.3 | 160.3 | -74.8 | 172.3 | -176.9 | 0 | 0 | 109 | E188 I194 L196 | E188-E192 WeakPolarHBondContact O-CB 3.12Å; E188-E192 VanDerWaalsContact O-CG 3.28Å; E188-E192 WeakPolarHBondContact O-CG 3.18Å; E188-E192 PolarHBondContact O-N 2.9Å; E192-I194 VanDerWaalsContact C-N 3.28Å; E192-I194 PolarHBondContact O-N 3.3Å; E192-L196 PolarHBondContact O-N 3.33Å; E192-L196 VanDerWaalsContact O-N 3.16Å |
| 193 | S | 56.8 | Low | 54.6 | Low | 75 Ų | 75 | 102.1 Ų | 102.1 | 52% | 0.524 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -68.4 | -24.2 | 177.2 | 82.9 | 0 | 0 | 0 | 0 | 114.3 | N189 K190 | N189-S193 WeakPolarHBondContact O-CB 3.17Å; N189-S193 PolarHBondContact O-N 2.98Å; K190-S193 WeakPolarHBondContact CA-OG 3.27Å; K190-S193 CarbonylContact O-C 3.49Å; K190-S193 PolarHBondContact O-N 3.28Å; K190-S193 PolarHBondContact O-OG 2.97Å |
| 194 | I | 58.2 | Low | 54.7 | Low | 108 Ų | 108 | 105.5 Ų | 105.5 | 55% | 0.554 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -103.3 | -33 | 179.7 | -66.3 | 165.5 | 0 | 0 | 0 | 110.8 | K190 E192 L196 K197 | K190-I194 WeakPolarHBondContact O-CB 2.96Å; K190-I194 WeakPolarHBondContact O-CD1 3.4Å; K190-I194 WeakPolarHBondContact O-CG1 3.2Å; K190-I194 PolarHBondContact O-N 3.09Å; E192-I194 VanDerWaalsContact C-N 3.28Å; E192-I194 PolarHBondContact O-N 3.3Å; I194-L196 VanDerWaalsContact C-N 3.32Å; I194-L196 PolarHBondContact O-N 2.65Å; I194-K197 PolarHBondContact O-N 3.05Å |
| 195 | G | 49.1 | Very low | 54.9 | Low | 23 Ų | 23 | 105 Ų | 105 | 24% | 0.237 | 54% | 0.543 | C | S | . | . | H | α-helix | trans | -78.4 | -10.5 | 179.7 | 0 | 0 | 0 | 0 | 0 | 114.1 | L191 K197 | L191-G195 WeakPolarHBondContact O-CA 3.38Å; L191-G195 PolarHBondContact O-N 3.48Å; G195-K197 PolarHBondContact O-N 2.75Å |
| 196 | L | 45.1 | Very low | 54.9 | Low | 161 Ų | 161 | 108.6 Ų | 108.6 | 84% | 0.843 | 56% | 0.557 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67.2 | -11.2 | 160.6 | -157 | 69.1 | 0 | 0 | 0 | 112.5 | E192 I194 | E192-L196 PolarHBondContact O-N 3.33Å; E192-L196 VanDerWaalsContact O-N 3.16Å; I194-L196 VanDerWaalsContact C-N 3.32Å; I194-L196 PolarHBondContact O-N 2.65Å |
| 197 | K | 45.5 | Very low | 55 | Low | 184 Ų | 184 | 108 Ų | 108 | 80% | 0.8 | 57% | 0.571 | S | S | * | * | S | Bend | trans | -112.8 | -6.7 | 177.2 | -78.6 | -167.2 | 172.6 | -169.7 | 0 | 115.9 | I194 G195 | I194-K197 PolarHBondContact O-N 3.05Å; G195-K197 PolarHBondContact O-N 2.75Å |
| 198 | R | 55.1 | Low | 55.1 | Low | 172 Ų | 172 | 108.4 Ų | 108.4 | 65% | 0.649 | 57% | 0.573 | S | S | * | * | trans | -150.8 | 58.6 | -176.4 | -63.7 | -67.9 | -177.4 | 177.6 | 1.1 | 112.4 | ||||
| 199 | T | 54.1 | Low | 54.9 | Low | 77 Ų | 77 | 107.4 Ų | 107.4 | 47% | 0.472 | 58% | 0.584 | S | S | . | * | trans | -76.2 | 137.6 | 157.8 | 56.1 | 0 | 0 | 0 | 0 | 108.4 | M201 G202 L203 | T199-M201 PolarHBondContact O-N 2.74Å; T199-M201 VanDerWaalsContact O-N 3.09Å; T199-G202 PolarHBondContact O-N 3.26Å; T199-G202 PolarHBondContact OG1-N 2.98Å; T199-L203 PolarHBondContact O-N 3.18Å | ||
| 200 | P | 53 | Low | 54 | Low | 107 Ų | 107 | 109 Ų | 109 | 70% | 0.695 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -58.9 | -23.6 | 178 | 22.3 | -31.7 | 0 | 0 | 0 | 111.9 | L204 | P200-L204 VanDerWaalsContact O-CB 3.27Å; P200-L204 WeakPolarHBondContact O-CB 3.28Å; P200-L204 PolarHBondContact O-N 3.45Å |
| 201 | M | 47 | Very low | 53.9 | Low | 140 Ų | 140 | 112.3 Ų | 112.3 | 69% | 0.69 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -71 | -33.6 | 174.3 | -164.8 | 165.4 | -175.1 | 0 | 0 | 113.3 | T199 L204 L205 | T199-M201 PolarHBondContact O-N 2.74Å; T199-M201 VanDerWaalsContact O-N 3.09Å; M201-L204 PolarHBondContact O-N 2.68Å; M201-L205 HydrophobicContact CG-CD1 4.42Å; M201-L205 WeakPolarHBondContact O-CB 3.26Å; M201-L205 WeakPolarHBondContact O-CD1 3.18Å; M201-L205 WeakPolarHBondContact O-CG 3.21Å; M201-L205 PolarHBondContact O-N 3.31Å |
| 202 | G | 51.3 | Low | 52.9 | Low | 31 Ų | 31 | 113.9 Ų | 113.9 | 32% | 0.32 | 61% | 0.61 | S | S | . | * | H | α-helix | trans | -71.8 | -40 | 173.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | T199 L204 L205 E206 | T199-G202 PolarHBondContact O-N 3.26Å; T199-G202 PolarHBondContact OG1-N 2.98Å; G202-L204 VanDerWaalsContact C-N 3.31Å; G202-L204 PolarHBondContact O-N 3.29Å; G202-L205 PolarHBondContact O-N 3.33Å; G202-E206 VanDerWaalsContact O-CB 3.26Å; G202-E206 WeakPolarHBondContact O-CB 3.38Å; G202-E206 PolarHBondContact O-N 2.87Å |
| 203 | L | 58.3 | Low | 52.5 | Low | 82 Ų | 82 | 116.6 Ų | 116.6 | 43% | 0.429 | 62% | 0.622 | S | S | . | * | H | α-helix | trans | -67 | -31.6 | 171.6 | -91.7 | 156.6 | 0 | 0 | 0 | 112.6 | T199 A207 | T199-L203 PolarHBondContact O-N 3.18Å; L203-A207 WeakPolarHBondContact O-CB 3.48Å; L203-A207 PolarHBondContact O-N 3.33Å |
| 204 | L | 53.8 | Low | 51.5 | Low | 109 Ų | 109 | 118.1 Ų | 118.1 | 57% | 0.571 | 64% | 0.639 | S | S | * | * | H | α-helix | trans | -71.6 | -40.3 | 174.5 | -154.1 | 101.5 | 0 | 0 | 0 | 111.4 | P200 M201 G202 A207 L208 | P200-L204 VanDerWaalsContact O-CB 3.27Å; P200-L204 WeakPolarHBondContact O-CB 3.28Å; P200-L204 PolarHBondContact O-N 3.45Å; M201-L204 PolarHBondContact O-N 2.68Å; G202-L204 VanDerWaalsContact C-N 3.31Å; G202-L204 PolarHBondContact O-N 3.29Å; L204-A207 PolarHBondContact O-N 3.49Å; L204-L208 HydrophobicContact CD2-CD1 3.77Å; L204-L208 HydrophobicContact CG-CD1 4.04Å; L204-L208 WeakPolarHBondContact O-CB 3.33Å; L204-L208 WeakPolarHBondContact O-CD1 3.34Å; L204-L208 WeakPolarHBondContact O-CG 3.42Å; L204-L208 PolarHBondContact O-N 2.89Å |
| 205 | L | 54.7 | Low | 50.8 | Low | 88 Ų | 88 | 116.5 Ų | 116.5 | 46% | 0.461 | 65% | 0.649 | S | S | . | * | H | α-helix | trans | -69.5 | -37.7 | 176.1 | -78 | 162.9 | 0 | 0 | 0 | 112.3 | M201 G202 L208 G209 | M201-L205 HydrophobicContact CG-CD1 4.42Å; M201-L205 WeakPolarHBondContact O-CB 3.26Å; M201-L205 WeakPolarHBondContact O-CD1 3.18Å; M201-L205 WeakPolarHBondContact O-CG 3.21Å; M201-L205 PolarHBondContact O-N 3.31Å; G202-L205 PolarHBondContact O-N 3.33Å; L205-L208 PolarHBondContact O-N 2.96Å; L205-G209 PolarHBondContact O-N 3.16Å |
| 206 | E | 57.4 | Low | 50.2 | Low | 157 Ų | 157 | 124.7 Ų | 124.7 | 73% | 0.734 | 70% | 0.703 | S | S | * | * | H | α-helix | trans | -71.3 | -32.7 | 175.2 | -167.8 | 166.8 | -177.4 | 0 | 0 | 111.9 | G202 | G202-E206 VanDerWaalsContact O-CB 3.26Å; G202-E206 WeakPolarHBondContact O-CB 3.38Å; G202-E206 PolarHBondContact O-N 2.87Å |
| 207 | A | 57.5 | Low | 50.4 | Low | 89 Ų | 89 | 122.9 Ų | 122.9 | 74% | 0.736 | 70% | 0.696 | S | S | * | * | H | α-helix | trans | -78 | -23.8 | 170.9 | 0 | 0 | 0 | 0 | 0 | 113.7 | L203 L204 G209 | L203-A207 WeakPolarHBondContact O-CB 3.48Å; L203-A207 PolarHBondContact O-N 3.33Å; L204-A207 PolarHBondContact O-N 3.49Å; A207-G209 VanDerWaalsContact C-N 3.32Å |
| 208 | L | 60.6 | Low | 50.7 | Low | 119 Ų | 119 | 119.7 Ų | 119.7 | 62% | 0.623 | 69% | 0.691 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -85.4 | -0 | 176.6 | -81.6 | 163.9 | 0 | 0 | 0 | 113.6 | L204 L205 Q210 | L204-L208 HydrophobicContact CD2-CD1 3.77Å; L204-L208 HydrophobicContact CG-CD1 4.04Å; L204-L208 WeakPolarHBondContact O-CB 3.33Å; L204-L208 WeakPolarHBondContact O-CD1 3.34Å; L204-L208 WeakPolarHBondContact O-CG 3.42Å; L204-L208 PolarHBondContact O-N 2.89Å; L205-L208 PolarHBondContact O-N 2.96Å; L208-Q210 PolarHBondContact O-N 3.38Å |
| 209 | G | 52.4 | Low | 50.4 | Low | 60 Ų | 60 | 116.8 Ų | 116.8 | 62% | 0.619 | 69% | 0.693 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 66.5 | 28.9 | 164.8 | 0 | 0 | 0 | 0 | 0 | 115.5 | L205 A207 E211 | L205-G209 PolarHBondContact O-N 3.16Å; A207-G209 VanDerWaalsContact C-N 3.32Å; G209-E211 PolarHBondContact O-N 3.35Å |
| 210 | Q | 45.6 | Very low | 50.2 | Low | 136 Ų | 136 | 119.1 Ų | 119.1 | 64% | 0.636 | 71% | 0.706 | S | S | * | * | trans | -86.4 | 67.7 | 165.2 | -69 | -156.1 | -80.9 | 0 | 0 | 110.5 | L208 Q212 | L208-Q210 PolarHBondContact O-N 3.38Å; Q210-Q212 PolarHBondContact O-N 3.19Å | ||
| 211 | E | 56.7 | Low | 50.1 | Low | 186 Ų | 186 | 119.9 Ų | 119.9 | 87% | 0.869 | 71% | 0.707 | S | S | * | * | trans | -69.6 | 105.9 | 143 | -91.5 | -104 | 138.7 | 0 | 0 | 105.7 | G209 | G209-E211 PolarHBondContact O-N 3.35Š| ||
| 212 | Q | 41 | Very low | 50.3 | Low | 155 Ų | 155 | 118.5 Ų | 118.5 | 72% | 0.724 | 71% | 0.708 | S | S | * | * | trans | -135.9 | 94.1 | 164.3 | -120.1 | 172.4 | -41.1 | 0 | 0 | 109.2 | Q210 | Q210-Q212 PolarHBondContact O-N 3.19Š| ||
| 213 | E | 48.9 | Very low | 50.2 | Low | 190 Ų | 190 | 124.8 Ų | 124.8 | 89% | 0.888 | 74% | 0.736 | S | S | * | * | trans | 22.6 | 100.7 | 133.8 | -62.1 | -170.6 | 162.4 | 0 | 0 | 116.5 | ||||
| 214 | A | 36.6 | Very low | 49.6 | Very low | 106 Ų | 106 | 128.1 Ų | 128.1 | 88% | 0.876 | 76% | 0.759 | S | S | * | * | trans | -161.2 | 94.2 | 138.7 | 0 | 0 | 0 | 0 | 0 | 104.5 | ||||
| 215 | G | 42.3 | Very low | 49.2 | Very low | 74 Ų | 74 | 129.7 Ų | 129.7 | 76% | 0.763 | 78% | 0.775 | S | S | * | * | cis | 127.9 | 136 | 49.2 | 0 | 0 | 0 | 0 | 0 | 104.6 | ||||
| 216 | S | 36.8 | Very low | 48.7 | Very low | 196 Ų | 196 | 133.5 Ų | 133.5 | 100% | 1.371 | 80% | 0.803 | S | S | * | * | trans | -5.5 | 0 | 171.1 | -171.2 | 0 | 0 | 0 | 0 | 119.1 |
Retrieved 216 of 216 residues in 247.6 ms
(Link to these results)