| 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 | 37.6 | Very low | 45.3 | Very low | 225 Ų | 225 | 141.9 Ų | 141.9 | 100% | 1.108 | 71% | 0.714 | S | S | * | * | 0 | 101.6 | 0 | -104.4 | -164 | 159.5 | 0 | 0 | 106.6 | |||||
| 2 | D | 33.1 | Very low | 45.7 | Very low | 157 Ų | 157 | 139.8 Ų | 139.8 | 84% | 0.84 | 71% | 0.706 | S | S | * | * | trans | -127.9 | 115.1 | -137.5 | -45.5 | -68 | 0 | 0 | 0 | 110.4 | ||||
| 3 | S | 40.9 | Very low | 45.8 | Very low | 107 Ų | 107 | 133.3 Ų | 133.3 | 75% | 0.748 | 69% | 0.687 | S | S | * | * | trans | -157.5 | 2.1 | -177.7 | 48.5 | 0 | 0 | 0 | 0 | 116.8 | ||||
| 4 | D | 46 | Very low | 45.9 | Very low | 163 Ų | 163 | 134.7 Ų | 134.7 | 87% | 0.872 | 68% | 0.679 | S | S | * | * | trans | -96.9 | 0.8 | -169.4 | -97.3 | -28 | 0 | 0 | 0 | 116.7 | L6 | D4-L6 PolarHBondContact O-N 3.48Š| ||
| 5 | S | 44.6 | Very low | 45.8 | Very low | 118 Ų | 118 | 137.7 Ų | 137.7 | 83% | 0.825 | 68% | 0.68 | S | S | * | * | trans | -91.1 | 19.2 | -172.3 | 61 | 0 | 0 | 0 | 0 | 116 | S7 | S5-S7 PolarHBondContact O-N 2.96Š| ||
| 6 | L | 50.2 | Low | 45.8 | Very low | 74 Ų | 74 | 139.6 Ų | 139.6 | 39% | 0.387 | 68% | 0.678 | S | S | . | * | trans | -66.3 | 99 | 169.7 | -90.7 | 172.2 | 0 | 0 | 0 | 110.2 | D4 Q10 | D4-L6 PolarHBondContact O-N 3.48Å; L6-Q10 HydrophobicContact CD2-CB 4.15Å | ||
| 7 | S | 54.8 | Low | 46.2 | Very low | 55 Ų | 55 | 135.8 Ų | 135.8 | 39% | 0.385 | 67% | 0.665 | S | S | . | * | trans | -48.8 | 145.4 | -173.8 | 67.8 | 0 | 0 | 0 | 0 | 112.8 | S5 R9 Q10 R11 | S5-S7 PolarHBondContact O-N 2.96Å; S7-R9 PolarHBondContact O-N 3.34Å; S7-Q10 PolarHBondContact O-N 3.03Å; S7-Q10 PolarHBondContact OG-N 3.33Å; S7-Q10 PolarHBondContact OG-OE1 3.09Å; S7-R11 PolarHBondContact O-N 2.95Å | ||
| 8 | K | 46 | Very low | 46.1 | Very low | 184 Ų | 184 | 133.8 Ų | 133.8 | 80% | 0.8 | 66% | 0.658 | S | S | * | * | H | α-helix | trans | -48.6 | -34.2 | -180 | -135.6 | 171.5 | -175.5 | 176.4 | 0 | 112.1 | L12 | K8-L12 WeakPolarHBondContact O-CB 3.49Å; K8-L12 WeakPolarHBondContact O-CG 2.97Å; K8-L12 PolarHBondContact O-N 2.89Å |
| 9 | R | 44.2 | Very low | 45.9 | Very low | 217 Ų | 217 | 130.2 Ų | 130.2 | 82% | 0.819 | 65% | 0.647 | S | S | * | * | H | α-helix | trans | -64.8 | -43.5 | 173.3 | -73.4 | -175 | 174.1 | -172.5 | -1.3 | 114 | S7 L12 A13 | S7-R9 PolarHBondContact O-N 3.34Å; R9-L12 PolarHBondContact O-N 3.38Å; R9-A13 WeakPolarHBondContact O-CB 3.42Å; R9-A13 PolarHBondContact O-N 3.31Å |
| 10 | Q | 49.8 | Very low | 46 | Very low | 99 Ų | 99 | 126.4 Ų | 126.4 | 46% | 0.463 | 63% | 0.631 | S | S | . | * | H | α-helix | trans | -69.8 | -35.3 | 177.7 | -75.6 | 164.5 | -44.5 | 0 | 0 | 112.4 | L6 S7 A13 R14 | L6-Q10 HydrophobicContact CD2-CB 4.15Å; S7-Q10 PolarHBondContact O-N 3.03Å; S7-Q10 PolarHBondContact OG-N 3.33Å; S7-Q10 PolarHBondContact OG-OE1 3.09Å; Q10-A13 PolarHBondContact O-N 3.48Å; Q10-R14 PolarHBondContact O-N 3.49Å |
| 11 | R | 50.7 | Low | 45.9 | Very low | 162 Ų | 162 | 126.9 Ų | 126.9 | 61% | 0.611 | 63% | 0.63 | S | S | * | * | H | α-helix | trans | -63.4 | -48.5 | 171.1 | -64.8 | -177.2 | 95 | 175.5 | 6.2 | 110.5 | S7 A13 R14 Y15 | S7-R11 PolarHBondContact O-N 2.95Å; R11-A13 PolarHBondContact O-N 3.03Å; R11-R14 PolarHBondContact O-N 2.77Å; R11-Y15 VanDerWaalsContact O-CD2 3.32Å; R11-Y15 WeakPolarHBondContact O-CD2 3.44Å; R11-Y15 PolarHBondContact O-N 3.43Å |
| 12 | L | 50.1 | Low | 46.2 | Very low | 117 Ų | 117 | 123.6 Ų | 123.6 | 61% | 0.613 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -59.1 | -41.7 | 175.2 | -77.4 | 165.1 | 0 | 0 | 0 | 112.8 | K8 R9 Y15 W16 | K8-L12 WeakPolarHBondContact O-CB 3.49Å; K8-L12 WeakPolarHBondContact O-CG 2.97Å; K8-L12 PolarHBondContact O-N 2.89Å; R9-L12 PolarHBondContact O-N 3.38Å; L12-Y15 PolarHBondContact O-N 3.44Å; L12-W16 WeakPolarHBondContact O-CB 3.34Å; L12-W16 PolarHBondContact O-N 3.43Å |
| 13 | A | 46.6 | Very low | 47 | Very low | 55 Ų | 55 | 121.4 Ų | 121.4 | 46% | 0.455 | 59% | 0.589 | S | S | . | * | H | α-helix | trans | -61.6 | -43.6 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | R9 Q10 R11 W16 T17 | R9-A13 WeakPolarHBondContact O-CB 3.42Å; R9-A13 PolarHBondContact O-N 3.31Å; Q10-A13 PolarHBondContact O-N 3.48Å; R11-A13 PolarHBondContact O-N 3.03Å; A13-W16 PolarHBondContact O-N 3.4Å; A13-T17 PolarHBondContact O-N 2.97Å; A13-T17 PolarHBondContact O-OG1 3.4Å |
| 14 | R | 47.5 | Very low | 47.8 | Very low | 153 Ų | 153 | 119.8 Ų | 119.8 | 58% | 0.577 | 57% | 0.572 | S | S | * | * | H | α-helix | trans | -64.2 | -40.4 | 175 | -74.7 | -175.3 | -176 | 172 | 3.1 | 112.8 | Q10 R11 W16 T17 N18 | Q10-R14 PolarHBondContact O-N 3.49Å; R11-R14 PolarHBondContact O-N 2.77Å; R14-W16 VanDerWaalsContact C-N 3.31Å; R14-T17 WeakPolarHBondContact CA-OG1 3.38Å; R14-T17 PolarHBondContact O-OG1 3.45Å; R14-T17 VanDerWaalsContact O-OG1 3.11Å; R14-N18 WeakPolarHBondContact O-CB 3.19Å; R14-N18 PolarHBondContact O-N 3Å |
| 15 | Y | 44.6 | Very low | 48.5 | Very low | 179 Ų | 179 | 116.5 Ų | 116.5 | 70% | 0.702 | 55% | 0.552 | S | S | * | * | H | α-helix | trans | -62 | -40.8 | 172.7 | -88 | -73.8 | 0 | 0 | 0 | 111.5 | R11 L12 S19 | R11-Y15 VanDerWaalsContact O-CD2 3.32Å; R11-Y15 WeakPolarHBondContact O-CD2 3.44Å; R11-Y15 PolarHBondContact O-N 3.43Å; L12-Y15 PolarHBondContact O-N 3.44Å; Y15-S19 VanDerWaalsContact O-CB 3.29Å; Y15-S19 WeakPolarHBondContact O-CB 3.37Å; Y15-S19 PolarHBondContact O-N 3.5Å; Y15-S19 PolarHBondContact O-OG 3.38Å |
| 16 | W | 46.2 | Very low | 49.1 | Very low | 168 Ų | 168 | 116.4 Ų | 116.4 | 64% | 0.636 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -65 | -51 | 178.7 | -150.2 | 62 | 0 | 0 | 0 | 111.6 | L12 A13 R14 N18 S19 T20 | L12-W16 WeakPolarHBondContact O-CB 3.34Å; L12-W16 PolarHBondContact O-N 3.43Å; A13-W16 PolarHBondContact O-N 3.4Å; R14-W16 VanDerWaalsContact C-N 3.31Å; W16-N18 PolarHBondContact O-N 2.83Å; W16-S19 PolarHBondContact O-N 3.47Å; W16-S19 PolarHBondContact O-OG 2.99Å; W16-T20 PolarHBondContact O-N 3.37Å; W16-T20 PolarHBondContact O-OG1 3.25Å; W16-T20 VanDerWaalsContact O-OG1 3.11Å |
| 17 | T | 52.5 | Low | 49.7 | Very low | 76 Ų | 76 | 117.8 Ų | 117.8 | 47% | 0.466 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -60.7 | -42.2 | 179.2 | 51.5 | 0 | 0 | 0 | 0 | 112.7 | A13 R14 T20 F21 | A13-T17 PolarHBondContact O-N 2.97Å; A13-T17 PolarHBondContact O-OG1 3.4Å; R14-T17 WeakPolarHBondContact CA-OG1 3.38Å; R14-T17 PolarHBondContact O-OG1 3.45Å; R14-T17 VanDerWaalsContact O-OG1 3.11Å; T17-T20 WeakPolarHBondContact CA-OG1 3.5Å; T17-T20 PolarHBondContact O-N 3.12Å; T17-T20 PolarHBondContact O-OG1 3.46Å; T17-F21 WeakPolarHBondContact O-CB 3.15Å; T17-F21 PolarHBondContact O-N 3.03Å |
| 18 | N | 44.2 | Very low | 49.7 | Very low | 99 Ų | 99 | 123.4 Ų | 123.4 | 53% | 0.529 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -65.3 | -44.1 | 175.8 | -75.5 | 1.6 | 0 | 0 | 0 | 111.2 | R14 W16 T20 F21 Y22 | R14-N18 WeakPolarHBondContact O-CB 3.19Å; R14-N18 PolarHBondContact O-N 3Å; W16-N18 PolarHBondContact O-N 2.83Å; N18-T20 VanDerWaalsContact C-N 3.31Å; N18-T20 PolarHBondContact O-N 2.92Å; N18-F21 PolarHBondContact O-N 3.21Å; N18-Y22 WeakPolarHBondContact O-CD2 3.43Å; N18-Y22 PolarHBondContact O-N 3.06Å; N18-Y22 VanDerWaalsContact O-N 3.1Å |
| 19 | S | 42.8 | Very low | 50.1 | Low | 66 Ų | 66 | 123.5 Ų | 123.5 | 46% | 0.462 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -60.8 | -38.7 | 177.9 | 75.6 | 0 | 0 | 0 | 0 | 112.5 | Y15 W16 F23 | Y15-S19 VanDerWaalsContact O-CB 3.29Å; Y15-S19 WeakPolarHBondContact O-CB 3.37Å; Y15-S19 PolarHBondContact O-N 3.5Å; Y15-S19 PolarHBondContact O-OG 3.38Å; W16-S19 PolarHBondContact O-N 3.47Å; W16-S19 PolarHBondContact O-OG 2.99Å; S19-F23 WeakPolarHBondContact O-CB 3.07Å; S19-F23 PolarHBondContact O-N 3.04Å; S19-F23 VanDerWaalsContact O-N 3.16Å |
| 20 | T | 48.2 | Very low | 50.8 | Low | 53 Ų | 53 | 119.1 Ų | 119.1 | 33% | 0.325 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -69.9 | -37.1 | 175.6 | 45.6 | 0 | 0 | 0 | 0 | 112.8 | W16 T17 N18 F23 D24 | W16-T20 PolarHBondContact O-N 3.37Å; W16-T20 PolarHBondContact O-OG1 3.25Å; W16-T20 VanDerWaalsContact O-OG1 3.11Å; T17-T20 WeakPolarHBondContact CA-OG1 3.5Å; T17-T20 PolarHBondContact O-N 3.12Å; T17-T20 PolarHBondContact O-OG1 3.46Å; N18-T20 VanDerWaalsContact C-N 3.31Å; N18-T20 PolarHBondContact O-N 2.92Å; T20-F23 PolarHBondContact O-N 3.42Å; T20-D24 WeakPolarHBondContact O-CB 3.49Å; T20-D24 PolarHBondContact O-N 3.27Å |
| 21 | F | 43 | Very low | 51.1 | Low | 137 Ų | 137 | 118.6 Ų | 118.6 | 60% | 0.601 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -65 | -47.8 | 178.9 | -175.9 | -95.2 | 0 | 0 | 0 | 112 | T17 N18 F23 D24 Q25 | T17-F21 WeakPolarHBondContact O-CB 3.15Å; T17-F21 PolarHBondContact O-N 3.03Å; N18-F21 PolarHBondContact O-N 3.21Å; F21-F23 VanDerWaalsContact C-N 3.32Å; F21-F23 PolarHBondContact O-N 2.81Å; F21-D24 PolarHBondContact O-N 2.74Å; F21-Q25 WeakPolarHBondContact O-CB 3.38Å; F21-Q25 PolarHBondContact O-N 3.38Å |
| 22 | Y | 43.7 | Very low | 51.2 | Low | 157 Ų | 157 | 114.2 Ų | 114.2 | 62% | 0.616 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -64.1 | -35.5 | 175.6 | -80.3 | -73.7 | 0 | 0 | 0 | 112.7 | N18 Q26 | N18-Y22 WeakPolarHBondContact O-CD2 3.43Å; N18-Y22 PolarHBondContact O-N 3.06Å; N18-Y22 VanDerWaalsContact O-N 3.1Å; Y22-Q26 PolarHBondContact O-N 3.37Å |
| 23 | F | 51 | Low | 51.1 | Low | 110 Ų | 110 | 115.9 Ų | 115.9 | 48% | 0.482 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -68.5 | -44.1 | 178.4 | -154.6 | -84.4 | 0 | 0 | 0 | 111.9 | S19 T20 F21 Q25 Q26 Q27 | S19-F23 WeakPolarHBondContact O-CB 3.07Å; S19-F23 PolarHBondContact O-N 3.04Å; S19-F23 VanDerWaalsContact O-N 3.16Å; T20-F23 PolarHBondContact O-N 3.42Å; F21-F23 VanDerWaalsContact C-N 3.32Å; F21-F23 PolarHBondContact O-N 2.81Å; F23-Q25 VanDerWaalsContact C-N 3.33Å; F23-Q25 PolarHBondContact O-N 3.45Å; F23-Q26 PolarHBondContact O-N 2.81Å; F23-Q27 WeakPolarHBondContact O-CB 3.43Å; F23-Q27 PolarHBondContact O-N 3.4Å |
| 24 | D | 56 | Low | 51.3 | Low | 73 Ų | 73 | 123.6 Ų | 123.6 | 39% | 0.39 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -64.9 | -38 | 177 | -159.6 | 62.8 | 0 | 0 | 0 | 111.3 | T20 F21 Q27 R28 | T20-D24 WeakPolarHBondContact O-CB 3.49Å; T20-D24 PolarHBondContact O-N 3.27Å; F21-D24 PolarHBondContact O-N 2.74Å; D24-Q27 PolarHBondContact O-N 3.37Å; D24-R28 VanDerWaalsContact O-CG 3.3Å; D24-R28 WeakPolarHBondContact O-CG 3.47Å; D24-R28 PolarHBondContact O-N 3.41Å; D24-R28 IonicContact OD2-CZ 3.2Å; D24-R28 IonicContact OD2-NE 2.86Å; D24-R28 PolarHBondContact OD2-NE 3.47Å; D24-R28 IonicContact OD2-NH2 2.69Å; D24-R28 PolarHBondContact OD2-NH2 2.76Å |
| 25 | Q | 61 | Low | 51.3 | Low | 94 Ų | 94 | 124.6 Ų | 124.6 | 44% | 0.439 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -66 | -41 | 174.3 | -159.7 | -172.9 | 46.6 | 0 | 0 | 112.6 | F21 F23 R29 | F21-Q25 WeakPolarHBondContact O-CB 3.38Å; F21-Q25 PolarHBondContact O-N 3.38Å; F23-Q25 VanDerWaalsContact C-N 3.33Å; F23-Q25 PolarHBondContact O-N 3.45Å; Q25-R29 PolarHBondContact O-N 2.86Å |
| 26 | Q | 58.5 | Low | 50.9 | Low | 116 Ų | 116 | 124.2 Ų | 124.2 | 54% | 0.542 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -65.4 | -40.2 | 172.8 | -93.1 | -148.4 | 10.8 | 0 | 0 | 112.5 | Y22 F23 R29 K30 | Y22-Q26 PolarHBondContact O-N 3.37Å; F23-Q26 PolarHBondContact O-N 2.81Å; Q26-R29 PolarHBondContact O-N 3.46Å; Q26-K30 PolarHBondContact O-N 2.63Å |
| 27 | Q | 61.5 | Low | 50.2 | Low | 104 Ų | 104 | 120.7 Ų | 120.7 | 49% | 0.486 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -66.3 | -44.3 | -179.6 | -168.6 | 165 | -39.3 | 0 | 0 | 110.5 | F23 D24 R29 K30 E31 | F23-Q27 WeakPolarHBondContact O-CB 3.43Å; F23-Q27 PolarHBondContact O-N 3.4Å; D24-Q27 PolarHBondContact O-N 3.37Å; Q27-R29 VanDerWaalsContact C-N 3.33Å; Q27-R29 PolarHBondContact O-N 2.85Å; Q27-K30 PolarHBondContact O-N 3.33Å; Q27-E31 WeakPolarHBondContact O-CB 3.45Å; Q27-E31 PolarHBondContact O-N 2.86Å |
| 28 | R | 55.5 | Low | 49.3 | Very low | 172 Ų | 172 | 125 Ų | 125 | 65% | 0.649 | 58% | 0.576 | S | S | * | * | H | α-helix | trans | -59.1 | -38.8 | 171.2 | -68.8 | 178.2 | -158.4 | -144.2 | 7.6 | 112.9 | D24 E31 S32 | D24-R28 VanDerWaalsContact O-CG 3.3Å; D24-R28 WeakPolarHBondContact O-CG 3.47Å; D24-R28 PolarHBondContact O-N 3.41Å; D24-R28 IonicContact OD2-CZ 3.2Å; D24-R28 IonicContact OD2-NE 2.86Å; D24-R28 PolarHBondContact OD2-NE 3.47Å; D24-R28 IonicContact OD2-NH2 2.69Å; D24-R28 PolarHBondContact OD2-NH2 2.76Å; R28-E31 PolarHBondContact O-N 3.41Å; R28-S32 WeakPolarHBondContact O-CB 3.41Å; R28-S32 PolarHBondContact O-N 3.13Å |
| 29 | R | 54.7 | Low | 48.7 | Very low | 186 Ų | 186 | 126 Ų | 126 | 70% | 0.702 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -62.5 | -49.4 | 173.5 | -84.2 | -172.8 | 170.8 | -169.1 | -2 | 112.1 | Q25 Q26 Q27 E31 S32 Q33 | Q25-R29 PolarHBondContact O-N 2.86Å; Q26-R29 PolarHBondContact O-N 3.46Å; Q27-R29 VanDerWaalsContact C-N 3.33Å; Q27-R29 PolarHBondContact O-N 2.85Å; R29-E31 VanDerWaalsContact C-N 3.27Å; R29-E31 PolarHBondContact O-N 3.46Å; R29-S32 PolarHBondContact O-N 2.94Å; R29-Q33 WeakPolarHBondContact O-CB 3.2Å; R29-Q33 PolarHBondContact O-N 3.17Å |
| 30 | K | 58.6 | Low | 48.3 | Very low | 126 Ų | 126 | 127.8 Ų | 127.8 | 55% | 0.548 | 60% | 0.603 | S | S | . | * | H | α-helix | trans | -63.3 | -32.7 | 177.8 | -74.5 | 177.9 | 177.2 | 170.3 | 0 | 112.6 | Q26 Q27 R34 | Q26-K30 PolarHBondContact O-N 2.63Å; Q27-K30 PolarHBondContact O-N 3.33Å; K30-R34 WeakPolarHBondContact O-CG 3.35Å; K30-R34 PolarHBondContact O-N 2.88Å; K30-R34 VanDerWaalsContact O-N 3.09Å |
| 31 | E | 56.3 | Low | 47.5 | Very low | 87 Ų | 87 | 132.6 Ų | 132.6 | 41% | 0.407 | 63% | 0.631 | S | S | . | * | H | α-helix | trans | -78.9 | -33.8 | 179.2 | -155.6 | 174.8 | 136.2 | 0 | 0 | 112.9 | Q27 R28 R29 R34 R35 | Q27-E31 WeakPolarHBondContact O-CB 3.45Å; Q27-E31 PolarHBondContact O-N 2.86Å; R28-E31 PolarHBondContact O-N 3.41Å; R29-E31 VanDerWaalsContact C-N 3.27Å; R29-E31 PolarHBondContact O-N 3.46Å; E31-R34 PolarHBondContact O-N 3.48Å; E31-R35 PolarHBondContact O-N 3.32Å; E31-R35 VanDerWaalsContact O-N 3.12Å; E31-R35 IonicContact OE1-CZ 2.75Å; E31-R35 IonicContact OE1-NE 3.76Å; E31-R35 IonicContact OE1-NH2 3.82Å; E31-R35 PolarHBondContact OE1-NH2 3.13Å |
| 32 | S | 52.2 | Low | 46.9 | Very low | 70 Ų | 70 | 130.9 Ų | 130.9 | 49% | 0.49 | 64% | 0.637 | S | S | . | * | H | α-helix | trans | -60.1 | -46.4 | 166.6 | -173.2 | 0 | 0 | 0 | 0 | 111.2 | R28 R29 R34 R35 F36 | R28-S32 WeakPolarHBondContact O-CB 3.41Å; R28-S32 PolarHBondContact O-N 3.13Å; R29-S32 PolarHBondContact O-N 2.94Å; S32-R34 VanDerWaalsContact C-N 3.26Å; S32-R34 PolarHBondContact O-N 2.97Å; S32-R35 PolarHBondContact O-N 2.97Å; S32-F36 PolarHBondContact O-N 2.9Å |
| 33 | Q | 49.5 | Very low | 46.2 | Very low | 153 Ų | 153 | 128 Ų | 128 | 72% | 0.715 | 65% | 0.646 | S | S | * | * | H | α-helix | trans | -67.4 | -22.2 | 179.4 | -156 | 170.4 | 18.7 | 0 | 0 | 113.6 | R29 | R29-Q33 WeakPolarHBondContact O-CB 3.2Å; R29-Q33 PolarHBondContact O-N 3.17Å |
| 34 | R | 49.9 | Very low | 45.2 | Very low | 217 Ų | 217 | 128.2 Ų | 128.2 | 82% | 0.819 | 66% | 0.656 | S | S | * | * | H | α-helix | trans | -83 | -24.2 | 169.6 | -77.1 | -175.9 | -177.4 | -165.1 | -0.2 | 114 | K30 E31 S32 | K30-R34 WeakPolarHBondContact O-CG 3.35Å; K30-R34 PolarHBondContact O-N 2.88Å; K30-R34 VanDerWaalsContact O-N 3.09Å; E31-R34 PolarHBondContact O-N 3.48Å; S32-R34 VanDerWaalsContact C-N 3.26Å; S32-R34 PolarHBondContact O-N 2.97Å |
| 35 | R | 46.5 | Very low | 44 | Very low | 174 Ų | 174 | 133 Ų | 133 | 66% | 0.657 | 68% | 0.676 | S | S | * | * | H | α-helix | trans | -84.4 | -16 | 177.8 | -78.3 | -172.7 | -129.2 | 174.4 | -1.4 | 113.7 | E31 S32 | E31-R35 PolarHBondContact O-N 3.32Å; E31-R35 VanDerWaalsContact O-N 3.12Å; E31-R35 IonicContact OE1-CZ 2.75Å; E31-R35 IonicContact OE1-NE 3.76Å; E31-R35 IonicContact OE1-NH2 3.82Å; E31-R35 PolarHBondContact OE1-NH2 3.13Å; S32-R35 PolarHBondContact O-N 2.97Å |
| 36 | F | 37.5 | Very low | 42.6 | Very low | 171 Ų | 171 | 133.9 Ų | 133.9 | 75% | 0.75 | 69% | 0.692 | S | S | * | * | trans | -126.8 | 76.4 | 173.4 | -71 | -83.5 | 0 | 0 | 0 | 111.7 | S32 | S32-F36 PolarHBondContact O-N 2.9Š| ||
| 37 | P | 31.7 | Very low | 41.2 | Very low | 93 Ų | 93 | 133.7 Ų | 133.7 | 60% | 0.604 | 70% | 0.703 | S | S | * | * | trans | -70.9 | 151.8 | 156.1 | 33.6 | -32.3 | 0 | 0 | 0 | 109.4 | ||||
| 38 | L | 32.3 | Very low | 39.7 | Very low | 168 Ų | 168 | 137.5 Ų | 137.5 | 88% | 0.88 | 72% | 0.721 | S | S | * | * | trans | 77.5 | 95.5 | 172.4 | -54.4 | 155 | 0 | 0 | 0 | 117 | ||||
| 39 | S | 32.8 | Very low | 38.6 | Very low | 120 Ų | 120 | 136.2 Ų | 136.2 | 84% | 0.839 | 73% | 0.732 | S | S | * | * | trans | -137.7 | 97.2 | 134.2 | -75.9 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 40 | S | 33.2 | Very low | 37.4 | Very low | 102 Ų | 102 | 132.7 Ų | 132.7 | 71% | 0.713 | 74% | 0.736 | S | S | * | * | trans | 32.5 | 101.1 | 157.9 | 56.8 | 0 | 0 | 0 | 0 | 119.4 | S42 | S40-S42 VanDerWaalsContact C-N 3.28Å; S40-S42 PolarHBondContact O-N 3.16Å; S40-S42 VanDerWaalsContact O-N 3.13Å | ||
| 41 | V | 32.3 | Very low | 36.3 | Very low | 154 Ų | 154 | 132.3 Ų | 132.3 | 93% | 0.933 | 75% | 0.747 | S | S | * | * | S | Bend | trans | -74.8 | 84.6 | 146.7 | 179.4 | 0 | 0 | 0 | 0 | 107.6 | ||
| 42 | S | 30 | Very low | 35.2 | Very low | 102 Ų | 102 | 134.8 Ų | 134.8 | 71% | 0.713 | 77% | 0.767 | S | S | * | * | trans | -172.1 | 78.3 | 169.4 | -95.3 | 0 | 0 | 0 | 0 | 112.2 | S40 | S40-S42 VanDerWaalsContact C-N 3.28Å; S40-S42 PolarHBondContact O-N 3.16Å; S40-S42 VanDerWaalsContact O-N 3.13Å | ||
| 43 | A | 30.3 | Very low | 34 | Very low | 97 Ų | 97 | 142.2 Ų | 142.2 | 80% | 0.802 | 79% | 0.786 | S | S | * | * | trans | -169.5 | 81.8 | 162.1 | 0 | 0 | 0 | 0 | 0 | 106 | ||||
| 44 | V | 29.9 | Very low | 33.1 | Very low | 114 Ų | 114 | 139.9 Ų | 139.9 | 69% | 0.691 | 79% | 0.793 | S | S | * | * | 57 | 89.9 | 63.2 | -170.3 | 0 | 0 | 0 | 0 | 112.2 | |||||
| 45 | Q | 29.1 | Very low | 32.2 | Very low | 174 Ų | 174 | 136.1 Ų | 136.1 | 81% | 0.813 | 79% | 0.794 | S | S | * | * | trans | 64.9 | 154.7 | 148.2 | -68.4 | 169.6 | -50.2 | 0 | 0 | 120.7 | ||||
| 46 | S | 32.3 | Very low | 31.8 | Very low | 112 Ų | 112 | 132.5 Ų | 132.5 | 78% | 0.783 | 79% | 0.793 | S | S | * | * | trans | 61.5 | 110.5 | -174.7 | 61.4 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 47 | S | 29.7 | Very low | 31.4 | Very low | 111 Ų | 111 | 132 Ų | 132 | 78% | 0.776 | 80% | 0.798 | S | S | * | * | 71 | 119.6 | 52.8 | -63.1 | 0 | 0 | 0 | 0 | 114.6 | |||||
| 48 | Q | 29.9 | Very low | 31.4 | Very low | 184 Ų | 184 | 131.2 Ų | 131.2 | 86% | 0.86 | 81% | 0.807 | S | S | * | * | trans | 89.5 | 138.3 | 154.4 | -64.2 | -178.7 | -10.5 | 0 | 0 | 121.1 | ||||
| 49 | V | 33.1 | Very low | 31.3 | Very low | 146 Ų | 146 | 128 Ų | 128 | 89% | 0.885 | 80% | 0.804 | S | S | * | * | trans | 86.5 | 137.4 | 161.8 | -156.5 | 0 | 0 | 0 | 0 | 118.3 | ||||
| 50 | S | 29.6 | Very low | 31.2 | Very low | 111 Ų | 111 | 130 Ų | 130 | 78% | 0.776 | 80% | 0.8 | S | S | * | * | trans | -96.4 | 173.3 | -162.4 | -109.6 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 51 | P | 34.6 | Very low | 31.2 | Very low | 119 Ų | 119 | 133.6 Ų | 133.6 | 77% | 0.773 | 80% | 0.803 | S | S | * | * | trans | -92.5 | 155.6 | -162.2 | 36.6 | -36.7 | 0 | 0 | 0 | 115.1 | ||||
| 52 | V | 32.7 | Very low | 31.2 | Very low | 139 Ų | 139 | 131.2 Ų | 131.2 | 84% | 0.842 | 79% | 0.791 | S | S | * | * | trans | -138.2 | 143.5 | 166.3 | -177.6 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 53 | Y | 27.4 | Very low | 31.3 | Very low | 226 Ų | 226 | 137.5 Ų | 137.5 | 89% | 0.886 | 80% | 0.799 | S | S | * | * | trans | -55.1 | 144.4 | 179.1 | -68.4 | -110.9 | 0 | 0 | 0 | 115.5 | ||||
| 54 | A | 31 | Very low | 31.4 | Very low | 103 Ų | 103 | 141.4 Ų | 141.4 | 85% | 0.851 | 81% | 0.805 | S | S | * | * | -176.9 | 149.8 | 127.6 | 0 | 0 | 0 | 0 | 0 | 113.4 | |||||
| 55 | V | 31.3 | Very low | 31.4 | Very low | 138 Ų | 138 | 146 Ų | 146 | 84% | 0.836 | 82% | 0.816 | S | S | * | * | trans | -137.7 | 159.5 | 177.8 | 164.7 | 0 | 0 | 0 | 0 | 105 | ||||
| 56 | P | 37.1 | Very low | 31.6 | Very low | 98 Ų | 98 | 147.4 Ų | 147.4 | 64% | 0.636 | 82% | 0.819 | S | S | * | * | cis | -132.3 | -161.2 | 3.3 | 28.3 | -2.6 | 0 | 0 | 0 | 115 | ||||
| 57 | N | 30 | Very low | 31.7 | Very low | 162 Ų | 162 | 151.4 Ų | 151.4 | 87% | 0.866 | 82% | 0.822 | S | S | * | * | trans | 84.2 | 124.4 | 152.6 | -67.7 | -17.5 | 0 | 0 | 0 | 119.1 | ||||
| 58 | G | 30 | Very low | 31.8 | Very low | 76 Ų | 76 | 151.7 Ų | 151.7 | 78% | 0.784 | 82% | 0.82 | S | S | * | * | trans | 171 | 32.1 | 175.9 | 0 | 0 | 0 | 0 | 0 | 120 | ||||
| 59 | A | 31.4 | Very low | 31.7 | Very low | 99 Ų | 99 | 148.4 Ų | 148.4 | 82% | 0.818 | 82% | 0.817 | S | S | * | * | trans | 60.2 | 167.5 | 158.2 | 0 | 0 | 0 | 0 | 0 | 121.6 | ||||
| 60 | E | 30.5 | Very low | 31.6 | Very low | 162 Ų | 162 | 150.4 Ų | 150.4 | 76% | 0.757 | 82% | 0.817 | S | S | * | * | trans | 66.4 | 87.6 | 160.9 | -56.7 | -146.8 | 146.9 | 0 | 0 | 121.6 | ||||
| 61 | K | 33.5 | Very low | 31.6 | Very low | 179 Ų | 179 | 150 Ų | 150 | 78% | 0.778 | 82% | 0.821 | S | S | * | * | -173.7 | 150.3 | 86.1 | -97.7 | 149.5 | -169.5 | 169 | 0 | 112.8 | |||||
| 62 | P | 31 | Very low | 31.3 | Very low | 104 Ų | 104 | 148.9 Ų | 148.9 | 68% | 0.675 | 82% | 0.821 | S | S | * | * | trans | -84.7 | -152 | -179.1 | 34.6 | -32.1 | 0 | 0 | 0 | 111.3 | ||||
| 63 | W | 32.3 | Very low | 31.3 | Very low | 234 Ų | 234 | 151.3 Ų | 151.3 | 89% | 0.886 | 83% | 0.826 | S | S | * | * | trans | 78.3 | 60 | 176.8 | -43.2 | 96.6 | 0 | 0 | 0 | 117.6 | ||||
| 64 | L | 32.7 | Very low | 31.4 | Very low | 179 Ų | 179 | 146.2 Ų | 146.2 | 94% | 0.937 | 82% | 0.823 | S | S | * | * | trans | -174.2 | 88.1 | 140.6 | -103 | 155.8 | 0 | 0 | 0 | 111.9 | ||||
| 65 | K | 30.5 | Very low | 31.5 | Very low | 211 Ų | 211 | 147.4 Ų | 147.4 | 92% | 0.917 | 82% | 0.822 | S | S | * | * | trans | -151.6 | 100.2 | 172.8 | -130.5 | -173.6 | -171.2 | -179.5 | 0 | 111.9 | ||||
| 66 | K | 32.3 | Very low | 31.4 | Very low | 202 Ų | 202 | 145.6 Ų | 145.6 | 88% | 0.878 | 82% | 0.815 | S | S | * | * | trans | -175.3 | 152 | 140.6 | -115.3 | 174 | 177.8 | 174.8 | 0 | 113.6 | ||||
| 67 | K | 35.4 | Very low | 31.1 | Very low | 196 Ų | 196 | 147.3 Ų | 147.3 | 85% | 0.852 | 83% | 0.827 | S | S | * | * | trans | 69.6 | 68.8 | 179.5 | -61.4 | -171.4 | 175.6 | -175.6 | 0 | 112.4 | ||||
| 68 | T | 32 | Very low | 31 | Very low | 118 Ų | 118 | 143.8 Ų | 143.8 | 72% | 0.724 | 82% | 0.82 | S | S | * | * | 73.6 | 99.8 | 53.5 | -44.9 | 0 | 0 | 0 | 0 | 112.7 | |||||
| 69 | S | 28.3 | Very low | 31.1 | Very low | 114 Ų | 114 | 144.5 Ų | 144.5 | 80% | 0.797 | 82% | 0.818 | S | S | * | * | trans | -39 | 129.3 | 156.4 | 47.6 | 0 | 0 | 0 | 0 | 115 | ||||
| 70 | Q | 30.7 | Very low | 31.1 | Very low | 189 Ų | 189 | 147.9 Ų | 147.9 | 88% | 0.883 | 82% | 0.822 | S | S | * | * | trans | -144.9 | 157.1 | 157.3 | -102.7 | -178.2 | -12 | 0 | 0 | 109.4 | ||||
| 71 | A | 29.9 | Very low | 31.1 | Very low | 103 Ų | 103 | 148.5 Ų | 148.5 | 85% | 0.851 | 83% | 0.829 | S | S | * | * | trans | 63.4 | 70.6 | 175 | 0 | 0 | 0 | 0 | 0 | 116.8 | ||||
| 72 | A | 26.9 | Very low | 31.1 | Very low | 95 Ų | 95 | 145.8 Ų | 145.8 | 79% | 0.785 | 83% | 0.828 | S | S | * | * | trans | -73.5 | 124.3 | 141 | 0 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 73 | M | 33.1 | Very low | 31 | Very low | 190 Ų | 190 | 146.7 Ų | 146.7 | 94% | 0.936 | 83% | 0.834 | S | S | * | * | trans | -168.3 | 127.8 | 160.1 | -104 | 165.6 | -145 | 0 | 0 | 108.9 | ||||
| 74 | S | 29.2 | Very low | 31.1 | Very low | 119 Ų | 119 | 144 Ų | 144 | 83% | 0.832 | 84% | 0.836 | S | S | * | * | trans | -77.3 | 161.3 | 177.4 | -60.3 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 75 | P | 32.5 | Very low | 31 | Very low | 128 Ų | 128 | 144.5 Ų | 144.5 | 83% | 0.831 | 83% | 0.833 | S | S | * | * | -126.5 | 156.9 | 122.3 | 12.3 | 7.1 | 0 | 0 | 0 | 113.7 | |||||
| 76 | S | 29.1 | Very low | 31.1 | Very low | 99 Ų | 99 | 137.5 Ų | 137.5 | 69% | 0.692 | 82% | 0.821 | S | S | * | * | trans | -77.4 | 144.4 | -171.8 | -173.3 | 0 | 0 | 0 | 0 | 113.9 | A78 | S76-A78 PolarHBondContact O-N 3.28Å; S76-A78 VanDerWaalsContact O-N 3.15Å | ||
| 77 | P | 30.7 | Very low | 30.9 | Very low | 135 Ų | 135 | 136.9 Ų | 136.9 | 88% | 0.877 | 82% | 0.821 | S | S | * | * | trans | -84.4 | 80.9 | 173.3 | 34.9 | -33.4 | 0 | 0 | 0 | 111.2 | ||||
| 78 | A | 29.5 | Very low | 30.6 | Very low | 88 Ų | 88 | 138.6 Ų | 138.6 | 73% | 0.727 | 82% | 0.822 | S | S | * | * | trans | -139.3 | 35.1 | -176.4 | 0 | 0 | 0 | 0 | 0 | 114.8 | S76 | S76-A78 PolarHBondContact O-N 3.28Å; S76-A78 VanDerWaalsContact O-N 3.15Å | ||
| 79 | A | 31.6 | Very low | 30.7 | Very low | 91 Ų | 91 | 138.6 Ų | 138.6 | 75% | 0.752 | 82% | 0.822 | S | S | * | * | trans | -158.3 | 100.5 | 169 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 80 | L | 32.3 | Very low | 30.9 | Very low | 169 Ų | 169 | 139.1 Ų | 139.1 | 89% | 0.885 | 82% | 0.821 | S | S | * | * | trans | 174.4 | 67.8 | 145.5 | -95.8 | 157.1 | 0 | 0 | 0 | 109.7 | ||||
| 81 | L | 28.7 | Very low | 31.1 | Very low | 176 Ų | 176 | 138.8 Ų | 138.8 | 92% | 0.921 | 82% | 0.821 | S | S | * | * | trans | -78.5 | 107.6 | 160.7 | -80.7 | 162 | 0 | 0 | 0 | 108.3 | ||||
| 82 | T | 33.4 | Very low | 31.4 | Very low | 121 Ų | 121 | 138.7 Ų | 138.7 | 74% | 0.742 | 81% | 0.812 | S | S | * | * | trans | -162 | 123.3 | 152.7 | -5.8 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 83 | P | 30.1 | Very low | 31.8 | Very low | 124 Ų | 124 | 139.7 Ų | 139.7 | 81% | 0.805 | 81% | 0.811 | S | S | * | * | trans | -92.9 | 130 | -176.8 | 33.9 | -31.3 | 0 | 0 | 0 | 112 | ||||
| 84 | L | 34.7 | Very low | 31.8 | Very low | 176 Ų | 176 | 139 Ų | 139 | 92% | 0.921 | 81% | 0.805 | S | S | * | * | trans | -114.2 | 83.1 | 171.2 | -102.9 | 161.4 | 0 | 0 | 0 | 112 | ||||
| 85 | H | 30.2 | Very low | 32.1 | Very low | 190 Ų | 190 | 141 Ų | 141 | 88% | 0.88 | 81% | 0.806 | S | S | * | * | trans | 8.3 | 136.1 | 139.9 | -144.4 | 79.6 | 0 | 0 | 0 | 120.2 | ||||
| 86 | G | 31.8 | Very low | 32.1 | Very low | 65 Ų | 65 | 144.9 Ų | 144.9 | 67% | 0.67 | 81% | 0.805 | S | S | * | * | trans | 99.8 | 131.8 | 166.5 | 0 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 87 | Q | 29.3 | Very low | 32.3 | Very low | 188 Ų | 188 | 146.5 Ų | 146.5 | 88% | 0.879 | 81% | 0.806 | S | S | * | * | cis | -169.5 | 138.1 | -1.8 | -158.9 | 168.3 | 17.3 | 0 | 0 | 106.4 | ||||
| 88 | R | 29.4 | Very low | 32.4 | Very low | 233 Ų | 233 | 148.4 Ų | 148.4 | 88% | 0.879 | 81% | 0.809 | S | S | * | * | trans | 2.4 | 142.7 | 145.3 | -90.9 | 177.7 | -177.5 | 169.5 | 2 | 117.3 | ||||
| 89 | T | 33.4 | Very low | 32.5 | Very low | 118 Ų | 118 | 148.7 Ų | 148.7 | 72% | 0.724 | 81% | 0.811 | S | S | * | * | cis | -154.1 | -179.2 | 23.1 | 43.5 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 90 | T | 32.2 | Very low | 32.5 | Very low | 125 Ų | 125 | 150 Ų | 150 | 77% | 0.767 | 81% | 0.813 | S | S | * | * | cis | -160 | 146.4 | -0 | -0.2 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 91 | M | 35.8 | Very low | 32.5 | Very low | 181 Ų | 181 | 149.3 Ų | 149.3 | 89% | 0.892 | 81% | 0.81 | S | S | * | * | trans | -172.8 | 143.4 | 146.9 | -90.2 | -112.7 | -162.1 | 0 | 0 | 107.9 | ||||
| 92 | P | 36.1 | Very low | 32.6 | Very low | 102 Ų | 102 | 145.5 Ų | 145.5 | 66% | 0.662 | 80% | 0.804 | S | S | * | * | trans | -83.2 | 140.3 | -168.5 | 32.4 | -34.9 | 0 | 0 | 0 | 113.3 | E94 | P92-E94 PolarHBondContact O-N 3.07Š| ||
| 93 | P | 34.2 | Very low | 32.6 | Very low | 116 Ų | 116 | 145.8 Ų | 145.8 | 75% | 0.753 | 81% | 0.808 | S | S | * | * | trans | -94.2 | 62.7 | 171.7 | 37.9 | -33.1 | 0 | 0 | 0 | 111.6 | ||||
| 94 | E | 33.6 | Very low | 32.6 | Very low | 175 Ų | 175 | 151.6 Ų | 151.6 | 82% | 0.818 | 81% | 0.814 | S | S | * | * | trans | -105 | 62.3 | 173.9 | -71.3 | -168.1 | 155.3 | 0 | 0 | 111.6 | P92 | P92-E94 PolarHBondContact O-N 3.07Š| ||
| 95 | L | 35.3 | Very low | 32.4 | Very low | 161 Ų | 161 | 155 Ų | 155 | 84% | 0.843 | 81% | 0.814 | S | S | * | * | S | Bend | trans | -167.5 | 32.4 | 160.8 | -141.5 | 79 | 0 | 0 | 0 | 115.4 | ||
| 96 | Y | 33.5 | Very low | 32.4 | Very low | 210 Ų | 210 | 151 Ų | 151 | 82% | 0.824 | 81% | 0.808 | S | S | * | * | trans | -143 | 19.2 | -170.9 | -102.6 | -69.7 | 0 | 0 | 0 | 118.5 | ||||
| 97 | D | 32.4 | Very low | 32.4 | Very low | 133 Ų | 133 | 153.5 Ų | 153.5 | 71% | 0.711 | 82% | 0.815 | S | S | * | * | S | Bend | trans | -109.1 | -12.5 | -178.9 | -78.6 | -47.6 | 0 | 0 | 0 | 116.7 | A99 | D97-A99 PolarHBondContact O-N 3.48Š|
| 98 | D | 32.3 | Very low | 32.8 | Very low | 175 Ų | 175 | 148.8 Ų | 148.8 | 94% | 0.936 | 81% | 0.809 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -83.8 | -3.5 | -176.9 | -79.4 | -35.4 | 0 | 0 | 0 | 116 | ||
| 99 | A | 32.9 | Very low | 33 | Very low | 94 Ų | 94 | 143.5 Ų | 143.5 | 78% | 0.777 | 80% | 0.804 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -106.9 | -1.1 | -171 | 0 | 0 | 0 | 0 | 0 | 115.7 | D97 | D97-A99 PolarHBondContact O-N 3.48Š|
| 100 | C | 31.6 | Very low | 33.2 | Very low | 117 Ų | 117 | 145.9 Ų | 145.9 | 79% | 0.791 | 81% | 0.812 | S | S | * | * | S | Bend | trans | -125.6 | 7.1 | -172.3 | -79.3 | 0 | 0 | 0 | 0 | 115.2 | ||
| 101 | L | 31.8 | Very low | 33.7 | Very low | 155 Ų | 155 | 146 Ų | 146 | 81% | 0.812 | 81% | 0.814 | S | S | * | * | trans | -130.5 | 60.5 | -176.4 | -67.7 | 175.2 | 0 | 0 | 0 | 112.8 | ||||
| 102 | A | 31.4 | Very low | 33.9 | Very low | 97 Ų | 97 | 141.5 Ų | 141.5 | 80% | 0.802 | 81% | 0.806 | S | S | * | * | trans | -131.6 | 111.3 | 168.4 | 0 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 103 | P | 32.1 | Very low | 34.1 | Very low | 127 Ų | 127 | 143.9 Ų | 143.9 | 83% | 0.825 | 82% | 0.819 | S | S | * | * | trans | -81 | 154.7 | -176.6 | 31.5 | -34.4 | 0 | 0 | 0 | 113.5 | R105 | P103-R105 PolarHBondContact O-N 2.91Š| ||
| 104 | R | 30.2 | Very low | 34.3 | Very low | 245 Ų | 245 | 141.4 Ų | 141.4 | 93% | 0.925 | 81% | 0.814 | S | S | * | * | trans | -33.3 | 125.4 | 175 | -73.2 | 173.6 | 164.6 | 170.9 | -5.6 | 115.1 | ||||
| 105 | R | 31 | Very low | 34.8 | Very low | 247 Ų | 247 | 138.4 Ų | 138.4 | 93% | 0.932 | 81% | 0.813 | S | S | * | * | trans | -167.4 | 162.3 | 134.7 | -113.3 | 170.2 | -179.2 | 178.5 | -0.1 | 112.8 | P103 | P103-R105 PolarHBondContact O-N 2.91Š| ||
| 106 | S | 31.3 | Very low | 35.2 | Very low | 107 Ų | 107 | 138.2 Ų | 138.2 | 75% | 0.748 | 80% | 0.802 | S | S | * | * | trans | 73.3 | 92 | 172 | -157.2 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 107 | S | 30.2 | Very low | 36.1 | Very low | 117 Ų | 117 | 131.6 Ų | 131.6 | 82% | 0.818 | 79% | 0.785 | S | S | * | * | trans | -10.2 | 122.2 | 141.8 | 46.2 | 0 | 0 | 0 | 0 | 117.8 | ||||
| 108 | A | 37.5 | Very low | 37.2 | Very low | 90 Ų | 90 | 131.2 Ų | 131.2 | 74% | 0.744 | 78% | 0.783 | S | S | * | * | trans | -140.5 | 151 | 154.1 | 0 | 0 | 0 | 0 | 0 | 109 | ||||
| 109 | P | 35.1 | Very low | 38.4 | Very low | 122 Ų | 122 | 129.3 Ų | 129.3 | 79% | 0.792 | 77% | 0.772 | S | S | * | * | P | Polyproline II helix | trans | -72.2 | 160.1 | -169.9 | -15.4 | 31 | 0 | 0 | 0 | 113.3 | ||
| 110 | L | 36.6 | Very low | 39.5 | Very low | 168 Ų | 168 | 129.1 Ų | 129.1 | 88% | 0.88 | 76% | 0.757 | S | S | * | * | P | Polyproline II helix | trans | -58.9 | 130.2 | 169.5 | -69 | 95.5 | 0 | 0 | 0 | 109.7 | A112 | L110-A112 PolarHBondContact O-N 3.28Š|
| 111 | P | 43.1 | Very low | 40.9 | Very low | 126 Ų | 126 | 128.1 Ų | 128.1 | 82% | 0.818 | 74% | 0.743 | S | S | * | * | P | Polyproline II helix | trans | -67.1 | 127.1 | 168.8 | 28.2 | -31.9 | 0 | 0 | 0 | 108.7 | ||
| 112 | A | 39.9 | Very low | 42.6 | Very low | 87 Ų | 87 | 125.9 Ų | 125.9 | 72% | 0.719 | 73% | 0.732 | S | S | * | * | P | Polyproline II helix | trans | -60.4 | 158.2 | 174.4 | 0 | 0 | 0 | 0 | 0 | 111.3 | L110 G114 | L110-A112 PolarHBondContact O-N 3.28Å; A112-G114 PolarHBondContact O-N 3.03Å |
| 113 | T | 39.2 | Very low | 44.5 | Very low | 153 Ų | 153 | 126.1 Ų | 126.1 | 94% | 0.939 | 72% | 0.716 | S | S | * | * | S | Bend | trans | -50.7 | 102.3 | 169.1 | 44.3 | 0 | 0 | 0 | 0 | 111.1 | ||
| 114 | G | 40.4 | Very low | 46.3 | Very low | 63 Ų | 63 | 123.1 Ų | 123.1 | 65% | 0.649 | 69% | 0.693 | S | S | * | * | trans | -155.5 | 129.4 | -178.4 | 0 | 0 | 0 | 0 | 0 | 110.5 | A112 Y116 | A112-G114 PolarHBondContact O-N 3.03Å; G114-Y116 PolarHBondContact O-N 3.47Å | ||
| 115 | S | 42.4 | Very low | 48.5 | Very low | 113 Ų | 113 | 115.4 Ų | 115.4 | 79% | 0.79 | 67% | 0.673 | S | S | * | * | trans | -11.7 | 116.6 | 178 | 53.4 | 0 | 0 | 0 | 0 | 116.7 | P117 | S115-P117 WeakPolarHBondContact O-CD 3.33Å; S115-P117 VanDerWaalsContact O-N 3.17Å | ||
| 116 | Y | 44 | Very low | 50.5 | Low | 157 Ų | 157 | 109.1 Ų | 109.1 | 62% | 0.616 | 65% | 0.654 | S | S | * | * | trans | -57.3 | 118.6 | 158.2 | -145.3 | -93.4 | 0 | 0 | 0 | 106.9 | G114 D118 M120 L121 | G114-Y116 PolarHBondContact O-N 3.47Å; Y116-D118 PolarHBondContact O-N 3.18Å; Y116-M120 HydrophobicContact CE1-CB 4.18Å; Y116-L121 HydrophobicContact CD1-CB 4.38Å | ||
| 117 | P | 52 | Low | 52.5 | Low | 70 Ų | 70 | 110.4 Ų | 110.4 | 46% | 0.455 | 64% | 0.643 | S | S | . | * | trans | -66 | 126.2 | -175.3 | 25 | -32.7 | 0 | 0 | 0 | 109.1 | S115 N119 M120 L121 | S115-P117 WeakPolarHBondContact O-CD 3.33Å; S115-P117 VanDerWaalsContact O-N 3.17Å; P117-N119 PolarHBondContact O-N 3.3Å; P117-M120 HydrophobicContact CG-CB 4.2Å; P117-M120 HydrophobicContact CG-CG 3.97Å; P117-M120 PolarHBondContact O-N 3.01Å; P117-L121 PolarHBondContact O-N 2.87Å | ||
| 118 | D | 55.6 | Low | 54.7 | Low | 126 Ų | 126 | 109.7 Ų | 109.7 | 67% | 0.674 | 63% | 0.629 | S | S | * | * | H | α-helix | trans | -53.4 | -29.7 | -175.8 | -70.9 | -52.7 | 0 | 0 | 0 | 112.6 | Y116 M120 L121 N122 | Y116-D118 PolarHBondContact O-N 3.18Å; D118-M120 PolarHBondContact O-N 2.87Å; D118-L121 PolarHBondContact O-N 3.05Å; D118-N122 VanDerWaalsContact O-CB 3.3Å; D118-N122 WeakPolarHBondContact O-CB 3.36Å; D118-N122 PolarHBondContact O-N 3.4Å |
| 119 | N | 58.1 | Low | 56.4 | Low | 134 Ų | 134 | 107.9 Ų | 107.9 | 72% | 0.717 | 61% | 0.614 | S | S | * | * | H | α-helix | trans | -59.6 | -38.8 | 173.9 | -70.2 | -14.8 | 0 | 0 | 0 | 113.4 | P117 Q123 | P117-N119 PolarHBondContact O-N 3.3Å; N119-Q123 VanDerWaalsContact O-CB 3.32Å; N119-Q123 WeakPolarHBondContact O-CB 3.14Å; N119-Q123 PolarHBondContact O-N 3.5Å |
| 120 | M | 55.8 | Low | 58.4 | Low | 90 Ų | 90 | 107.2 Ų | 107.2 | 44% | 0.443 | 60% | 0.601 | S | S | . | * | H | α-helix | trans | -75.4 | -38.2 | 176.1 | -71.2 | -153.2 | 79.8 | 0 | 0 | 112 | Y116 P117 D118 N122 Q123 D124 | Y116-M120 HydrophobicContact CE1-CB 4.18Å; P117-M120 HydrophobicContact CG-CB 4.2Å; P117-M120 HydrophobicContact CG-CG 3.97Å; P117-M120 PolarHBondContact O-N 3.01Å; D118-M120 PolarHBondContact O-N 2.87Å; M120-N122 VanDerWaalsContact C-N 3.32Å; M120-N122 PolarHBondContact O-N 3.42Å; M120-Q123 PolarHBondContact O-N 2.75Å; M120-D124 PolarHBondContact O-N 3.38Å |
| 121 | L | 61.2 | Low | 60.2 | Low | 96 Ų | 96 | 104 Ų | 104 | 50% | 0.503 | 58% | 0.583 | S | S | . | * | H | α-helix | trans | -61 | -44.1 | 174.1 | -171 | 71.9 | 0 | 0 | 0 | 110.9 | Y116 P117 D118 D124 V125 | Y116-L121 HydrophobicContact CD1-CB 4.38Å; P117-L121 PolarHBondContact O-N 2.87Å; D118-L121 PolarHBondContact O-N 3.05Å; L121-D124 PolarHBondContact O-N 3.01Å; L121-V125 WeakPolarHBondContact O-CB 3.34Å; L121-V125 VanDerWaalsContact O-CG2 3.25Å; L121-V125 WeakPolarHBondContact O-CG2 3.28Å; L121-V125 PolarHBondContact O-N 2.7Å |
| 122 | N | 67.6 | Low | 61.8 | Low | 108 Ų | 108 | 102 Ų | 102 | 58% | 0.578 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -64.2 | -41.6 | 176.8 | -163.9 | 14.7 | 0 | 0 | 0 | 111.5 | D118 M120 V125 H126 | D118-N122 VanDerWaalsContact O-CB 3.3Å; D118-N122 WeakPolarHBondContact O-CB 3.36Å; D118-N122 PolarHBondContact O-N 3.4Å; M120-N122 VanDerWaalsContact C-N 3.32Å; M120-N122 PolarHBondContact O-N 3.42Å; N122-V125 PolarHBondContact O-N 2.89Å; N122-H126 WeakPolarHBondContact O-CB 3.34Å; N122-H126 PolarHBondContact O-N 3.4Å |
| 123 | Q | 71 | Confident | 63.4 | Low | 103 Ų | 103 | 100 Ų | 100 | 48% | 0.481 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -66.2 | -39.2 | 177.6 | -165.7 | 170.3 | 28.4 | 0 | 0 | 112.8 | N119 M120 H126 R127 | N119-Q123 VanDerWaalsContact O-CB 3.32Å; N119-Q123 WeakPolarHBondContact O-CB 3.14Å; N119-Q123 PolarHBondContact O-N 3.5Å; M120-Q123 PolarHBondContact O-N 2.75Å; Q123-H126 PolarHBondContact O-N 3.29Å; Q123-R127 WeakPolarHBondContact O-CB 3.04Å; Q123-R127 WeakPolarHBondContact O-CG 3.48Å; Q123-R127 PolarHBondContact O-N 2.74Å |
| 124 | D | 71.1 | Confident | 64.9 | Low | 63 Ų | 63 | 97.5 Ų | 97.5 | 34% | 0.337 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -73.1 | -35 | 175.7 | -79.4 | -19 | 0 | 0 | 0 | 112.6 | M120 L121 H126 R127 L128 | M120-D124 PolarHBondContact O-N 3.38Å; L121-D124 PolarHBondContact O-N 3.01Å; D124-H126 VanDerWaalsContact C-N 3.33Å; D124-R127 PolarHBondContact O-N 3.45Å; D124-R127 IonicContact OD1-NH1 2.81Å; D124-L128 VanDerWaalsContact O-CB 3.26Å; D124-L128 WeakPolarHBondContact O-CB 3.42Å; D124-L128 PolarHBondContact O-N 2.66Å |
| 125 | V | 74.5 | Confident | 66.6 | Low | 84 Ų | 84 | 98.8 Ų | 98.8 | 51% | 0.509 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -62.5 | -41.4 | 169 | 168.5 | 0 | 0 | 0 | 0 | 110.7 | L121 N122 L128 A129 | L121-V125 WeakPolarHBondContact O-CB 3.34Å; L121-V125 VanDerWaalsContact O-CG2 3.25Å; L121-V125 WeakPolarHBondContact O-CG2 3.28Å; L121-V125 PolarHBondContact O-N 2.7Å; N122-V125 PolarHBondContact O-N 2.89Å; V125-L128 PolarHBondContact O-N 2.95Å; V125-A129 WeakPolarHBondContact O-CB 3Å; V125-A129 PolarHBondContact O-N 2.81Å |
| 126 | H | 74.1 | Confident | 68 | Low | 114 Ų | 114 | 101.9 Ų | 101.9 | 53% | 0.528 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -68.5 | -38.9 | 178.5 | -154.8 | -42.9 | 0 | 0 | 0 | 112.4 | N122 Q123 D124 A129 Q130 | N122-H126 WeakPolarHBondContact O-CB 3.34Å; N122-H126 PolarHBondContact O-N 3.4Å; Q123-H126 PolarHBondContact O-N 3.29Å; D124-H126 VanDerWaalsContact C-N 3.33Å; H126-A129 PolarHBondContact O-N 2.79Å; H126-Q130 WeakPolarHBondContact O-CG 3.32Å; H126-Q130 PolarHBondContact O-N 3.32Å |
| 127 | R | 72.8 | Confident | 69.2 | Low | 135 Ų | 135 | 98.3 Ų | 98.3 | 51% | 0.509 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -64.5 | -42.7 | 170.8 | -78 | 173.2 | 167.4 | 174.3 | -3.5 | 112 | Q123 D124 A129 Q130 L131 | Q123-R127 WeakPolarHBondContact O-CB 3.04Å; Q123-R127 WeakPolarHBondContact O-CG 3.48Å; Q123-R127 PolarHBondContact O-N 2.74Å; D124-R127 PolarHBondContact O-N 3.45Å; D124-R127 IonicContact OD1-NH1 2.81Å; R127-A129 VanDerWaalsContact C-N 3.34Å; R127-A129 PolarHBondContact O-N 2.9Å; R127-Q130 PolarHBondContact O-N 3.2Å; R127-L131 WeakPolarHBondContact O-CB 3.49Å; R127-L131 WeakPolarHBondContact O-CG 3.43Å; R127-L131 PolarHBondContact O-N 3.37Å |
| 128 | L | 77 | Confident | 70.1 | Confident | 101 Ų | 101 | 102.5 Ų | 102.5 | 53% | 0.529 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -63.6 | -40.6 | 176.1 | -177.9 | 61.9 | 0 | 0 | 0 | 111.1 | D124 V125 L131 I132 | D124-L128 VanDerWaalsContact O-CB 3.26Å; D124-L128 WeakPolarHBondContact O-CB 3.42Å; D124-L128 PolarHBondContact O-N 2.66Å; V125-L128 PolarHBondContact O-N 2.95Å; L128-L131 PolarHBondContact O-N 3.08Å; L128-I132 HydrophobicContact CD1-CD1 4.19Å; L128-I132 HydrophobicContact CD1-CG1 4.39Å; L128-I132 HydrophobicContact CG-CD1 3.92Å; L128-I132 WeakPolarHBondContact O-CB 3.16Å; L128-I132 VanDerWaalsContact O-CG1 3.22Å; L128-I132 WeakPolarHBondContact O-CG1 3.24Å; L128-I132 PolarHBondContact O-N 3.28Å |
| 129 | A | 73.5 | Confident | 70.9 | Confident | 52 Ų | 52 | 101.3 Ų | 101.3 | 43% | 0.43 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -61.5 | -44.4 | 174.3 | 0 | 0 | 0 | 0 | 0 | 112 | V125 H126 R127 I132 A133 | V125-A129 WeakPolarHBondContact O-CB 3Å; V125-A129 PolarHBondContact O-N 2.81Å; H126-A129 PolarHBondContact O-N 2.79Å; R127-A129 VanDerWaalsContact C-N 3.34Å; R127-A129 PolarHBondContact O-N 2.9Å; A129-I132 PolarHBondContact O-N 2.83Å; A129-A133 WeakPolarHBondContact O-CB 3.39Å; A129-A133 PolarHBondContact O-N 3.46Å |
| 130 | Q | 75.4 | Confident | 71.4 | Confident | 109 Ų | 109 | 98.9 Ų | 98.9 | 51% | 0.509 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -61.1 | -46.1 | 173.1 | -75.5 | 173 | -23.9 | 0 | 0 | 112 | H126 R127 I132 A133 L134 | H126-Q130 WeakPolarHBondContact O-CG 3.32Å; H126-Q130 PolarHBondContact O-N 3.32Å; R127-Q130 PolarHBondContact O-N 3.2Å; Q130-I132 VanDerWaalsContact C-N 3.33Å; Q130-I132 PolarHBondContact O-N 3.41Å; Q130-A133 WeakPolarHBondContact O-CB 3.37Å; Q130-A133 PolarHBondContact O-N 3.06Å; Q130-A133 VanDerWaalsContact O-N 3.17Å; Q130-L134 WeakPolarHBondContact O-CB 3.47Å; Q130-L134 WeakPolarHBondContact O-CG 3.42Å; Q130-L134 PolarHBondContact O-N 3.1Å |
| 131 | L | 75.9 | Confident | 72 | Confident | 99 Ų | 99 | 99.6 Ų | 99.6 | 52% | 0.518 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -65.1 | -33.4 | 177.6 | -72.2 | 170.8 | 0 | 0 | 0 | 112.9 | R127 L128 N135 | R127-L131 WeakPolarHBondContact O-CB 3.49Å; R127-L131 WeakPolarHBondContact O-CG 3.43Å; R127-L131 PolarHBondContact O-N 3.37Å; L128-L131 PolarHBondContact O-N 3.08Å; L131-N135 VanDerWaalsContact O-CB 3.31Å; L131-N135 WeakPolarHBondContact O-CB 3.36Å; L131-N135 PolarHBondContact O-N 3.35Å; L131-N135 PolarHBondContact O-ND2 3.42Å |
| 132 | I | 75.8 | Confident | 72.5 | Confident | 84 Ų | 84 | 99.3 Ų | 99.3 | 43% | 0.431 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -69 | -42.3 | 172.1 | -71.3 | 166 | 0 | 0 | 0 | 110.3 | L128 A129 Q130 N135 R136 | L128-I132 HydrophobicContact CD1-CD1 4.19Å; L128-I132 HydrophobicContact CD1-CG1 4.39Å; L128-I132 HydrophobicContact CG-CD1 3.92Å; L128-I132 WeakPolarHBondContact O-CB 3.16Å; L128-I132 VanDerWaalsContact O-CG1 3.22Å; L128-I132 WeakPolarHBondContact O-CG1 3.24Å; L128-I132 PolarHBondContact O-N 3.28Å; A129-I132 PolarHBondContact O-N 2.83Å; Q130-I132 VanDerWaalsContact C-N 3.33Å; Q130-I132 PolarHBondContact O-N 3.41Å; I132-N135 PolarHBondContact O-N 2.87Å; I132-R136 VanDerWaalsContact O-CB 3.3Å; I132-R136 WeakPolarHBondContact O-CB 3.47Å; I132-R136 PolarHBondContact O-N 3.22Å |
| 133 | A | 73 | Confident | 72.8 | Confident | 45 Ų | 45 | 99.1 Ų | 99.1 | 37% | 0.372 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -61.6 | -48.6 | 176 | 0 | 0 | 0 | 0 | 0 | 111.5 | A129 Q130 R136 Q137 | A129-A133 WeakPolarHBondContact O-CB 3.39Å; A129-A133 PolarHBondContact O-N 3.46Å; Q130-A133 WeakPolarHBondContact O-CB 3.37Å; Q130-A133 PolarHBondContact O-N 3.06Å; Q130-A133 VanDerWaalsContact O-N 3.17Å; A133-R136 WeakPolarHBondContact O-CB 3.47Å; A133-R136 PolarHBondContact O-N 3.38Å; A133-Q137 WeakPolarHBondContact O-CG 3.32Å; A133-Q137 PolarHBondContact O-N 2.95Å |
| 134 | L | 71.7 | Confident | 72.7 | Confident | 102 Ų | 102 | 97.2 Ų | 97.2 | 53% | 0.534 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -61.6 | -44.7 | 176.5 | -71.1 | 169.7 | 0 | 0 | 0 | 112.2 | Q130 R136 Q137 R138 | Q130-L134 WeakPolarHBondContact O-CB 3.47Å; Q130-L134 WeakPolarHBondContact O-CG 3.42Å; Q130-L134 PolarHBondContact O-N 3.1Å; L134-R136 VanDerWaalsContact C-N 3.31Å; L134-R136 PolarHBondContact O-N 2.84Å; L134-Q137 PolarHBondContact O-N 3.02Å; L134-R138 WeakPolarHBondContact O-CB 3.2Å; L134-R138 PolarHBondContact O-N 2.93Å |
| 135 | N | 75.6 | Confident | 72.7 | Confident | 89 Ų | 89 | 98.5 Ų | 98.5 | 48% | 0.476 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -63.8 | -36.1 | 175 | -88.4 | -54.9 | 0 | 0 | 0 | 112.6 | L131 I132 K139 | L131-N135 VanDerWaalsContact O-CB 3.31Å; L131-N135 WeakPolarHBondContact O-CB 3.36Å; L131-N135 PolarHBondContact O-N 3.35Å; L131-N135 PolarHBondContact O-ND2 3.42Å; I132-N135 PolarHBondContact O-N 2.87Å; N135-K139 WeakPolarHBondContact O-CG 3.29Å; N135-K139 PolarHBondContact O-N 3.5Å |
| 136 | R | 73.1 | Confident | 72.8 | Confident | 179 Ų | 179 | 100 Ų | 100 | 68% | 0.675 | 48% | 0.477 | S | S | * | . | H | α-helix | trans | -67.5 | -45.7 | 175.2 | -172.7 | 177.2 | -178.1 | -174.7 | -1.4 | 110.9 | I132 A133 L134 K139 M140 | I132-R136 VanDerWaalsContact O-CB 3.3Å; I132-R136 WeakPolarHBondContact O-CB 3.47Å; I132-R136 PolarHBondContact O-N 3.22Å; A133-R136 WeakPolarHBondContact O-CB 3.47Å; A133-R136 PolarHBondContact O-N 3.38Å; L134-R136 VanDerWaalsContact C-N 3.31Å; L134-R136 PolarHBondContact O-N 2.84Å; R136-K139 PolarHBondContact O-N 3.23Å; R136-M140 VanDerWaalsContact O-CG 3.26Å; R136-M140 WeakPolarHBondContact O-CG 3.44Å; R136-M140 PolarHBondContact O-N 3.36Å |
| 137 | Q | 67.9 | Low | 73 | Confident | 82 Ų | 82 | 100.8 Ų | 100.8 | 38% | 0.383 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -59.9 | -44.6 | 174.8 | -74.7 | 171.1 | -13.5 | 0 | 0 | 111.5 | A133 L134 M140 L141 | A133-Q137 WeakPolarHBondContact O-CG 3.32Å; A133-Q137 PolarHBondContact O-N 2.95Å; L134-Q137 PolarHBondContact O-N 3.02Å; Q137-M140 WeakPolarHBondContact O-CB 3.25Å; Q137-M140 PolarHBondContact O-N 3.27Å; Q137-L141 WeakPolarHBondContact O-CB 3.49Å; Q137-L141 PolarHBondContact O-N 3.42Å |
| 138 | R | 70.3 | Confident | 73.1 | Confident | 158 Ų | 158 | 95.6 Ų | 95.6 | 60% | 0.596 | 46% | 0.458 | S | S | * | . | H | α-helix | trans | -59.7 | -48 | 175.7 | -178.6 | 177.1 | 174 | 155.2 | 6.1 | 112.6 | L134 M140 L141 E142 | L134-R138 WeakPolarHBondContact O-CB 3.2Å; L134-R138 PolarHBondContact O-N 2.93Å; R138-M140 VanDerWaalsContact C-N 3.3Å; R138-M140 PolarHBondContact O-N 2.87Å; R138-L141 WeakPolarHBondContact O-CB 3.15Å; R138-L141 PolarHBondContact O-N 3.46Å; R138-L141 VanDerWaalsContact O-N 3.14Å; R138-E142 HydrophobicContact CG-CG 4.44Å; R138-E142 WeakPolarHBondContact CG-OE1 3.02Å; R138-E142 IonicContact CZ-OE1 2.86Å; R138-E142 IonicContact NE-OE1 3.6Å; R138-E142 PolarHBondContact NE-OE1 3.43Å; R138-E142 IonicContact NH2-OE1 3.97Å; R138-E142 PolarHBondContact NH2-OE1 2.72Å; R138-E142 WeakPolarHBondContact O-CG 3.16Å; R138-E142 PolarHBondContact O-N 3.45Å |
| 139 | K | 74.2 | Confident | 73.2 | Confident | 100 Ų | 100 | 94.3 Ų | 94.3 | 44% | 0.435 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -60.5 | -39.2 | 176 | -77.3 | -177.9 | 177.2 | -176.9 | 0 | 112.4 | N135 R136 Q143 | N135-K139 WeakPolarHBondContact O-CG 3.29Å; N135-K139 PolarHBondContact O-N 3.5Å; R136-K139 PolarHBondContact O-N 3.23Å; K139-Q143 WeakPolarHBondContact O-CG 3.3Å; K139-Q143 PolarHBondContact O-N 3.15Å; K139-Q143 VanDerWaalsContact O-N 3.12Å |
| 140 | M | 68.6 | Low | 73.7 | Confident | 83 Ų | 83 | 97.3 Ų | 97.3 | 41% | 0.409 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -63.8 | -46 | 173.5 | -67.5 | -65.6 | -61.6 | 0 | 0 | 110.8 | R136 Q137 R138 E142 Q143 F144 | R136-M140 VanDerWaalsContact O-CG 3.26Å; R136-M140 WeakPolarHBondContact O-CG 3.44Å; R136-M140 PolarHBondContact O-N 3.36Å; Q137-M140 WeakPolarHBondContact O-CB 3.25Å; Q137-M140 PolarHBondContact O-N 3.27Å; R138-M140 VanDerWaalsContact C-N 3.3Å; R138-M140 PolarHBondContact O-N 2.87Å; M140-E142 PolarHBondContact O-N 3.27Å; M140-Q143 PolarHBondContact O-N 3.05Å; M140-F144 VanDerWaalsContact C-CD2 3.49Å; M140-F144 HydrophobicContact CB-CD2 4.3Å; M140-F144 HydrophobicContact CB-CE2 3.9Å; M140-F144 HydrophobicContact CE-CE2 3.91Å; M140-F144 HydrophobicContact CE-CZ 3.63Å; M140-F144 WeakPolarHBondContact O-CD2 3.36Å; M140-F144 VanDerWaalsContact O-CG 3.29Å; M140-F144 WeakPolarHBondContact O-CG 3.16Å; M140-F144 PolarHBondContact O-N 2.93Å |
| 141 | L | 67.8 | Low | 73.9 | Confident | 105 Ų | 105 | 93.4 Ų | 93.4 | 55% | 0.55 | 44% | 0.44 | S | S | . | . | H | α-helix | trans | -60.6 | -43.1 | 178 | -161.1 | 82.8 | 0 | 0 | 0 | 112.4 | Q137 R138 F144 Y145 | Q137-L141 WeakPolarHBondContact O-CB 3.49Å; Q137-L141 PolarHBondContact O-N 3.42Å; R138-L141 WeakPolarHBondContact O-CB 3.15Å; R138-L141 PolarHBondContact O-N 3.46Å; R138-L141 VanDerWaalsContact O-N 3.14Å; L141-F144 PolarHBondContact O-N 2.95Å; L141-Y145 WeakPolarHBondContact O-CB 3.44Å; L141-Y145 PolarHBondContact O-N 2.94Å |
| 142 | E | 71.9 | Confident | 74.1 | Confident | 90 Ų | 90 | 88.7 Ų | 88.7 | 42% | 0.421 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -62.4 | -42.2 | 176 | -73.4 | 169.7 | -178.2 | 0 | 0 | 111.3 | R138 M140 L146 | R138-E142 HydrophobicContact CG-CG 4.44Å; R138-E142 WeakPolarHBondContact CG-OE1 3.02Å; R138-E142 IonicContact CZ-OE1 2.86Å; R138-E142 IonicContact NE-OE1 3.6Å; R138-E142 PolarHBondContact NE-OE1 3.43Å; R138-E142 IonicContact NH2-OE1 3.97Å; R138-E142 PolarHBondContact NH2-OE1 2.72Å; R138-E142 WeakPolarHBondContact O-CG 3.16Å; R138-E142 PolarHBondContact O-N 3.45Å; M140-E142 PolarHBondContact O-N 3.27Å; E142-L146 WeakPolarHBondContact O-CG 3.07Å; E142-L146 PolarHBondContact O-N 3.23Å; E142-L146 VanDerWaalsContact O-N 3.1Å |
| 143 | Q | 72.9 | Confident | 74.4 | Confident | 104 Ų | 104 | 90.5 Ų | 90.5 | 49% | 0.486 | 42% | 0.417 | S | S | . | . | H | α-helix | trans | -66.2 | -38.2 | 172.9 | -71.6 | -177.3 | 7.5 | 0 | 0 | 112.9 | K139 M140 R147 | K139-Q143 WeakPolarHBondContact O-CG 3.3Å; K139-Q143 PolarHBondContact O-N 3.15Å; K139-Q143 VanDerWaalsContact O-N 3.12Å; M140-Q143 PolarHBondContact O-N 3.05Å; Q143-R147 WeakPolarHBondContact O-CG 3.48Å; Q143-R147 PolarHBondContact O-N 2.94Å |
| 144 | F | 70 | Confident | 75 | Confident | 63 Ų | 63 | 90.3 Ų | 90.3 | 28% | 0.276 | 41% | 0.411 | S | S | . | . | H | α-helix | trans | -66.5 | -44.5 | 175.7 | -69 | -50.7 | 0 | 0 | 0 | 111.6 | M140 L141 L146 R147 I148 I318 | M140-F144 VanDerWaalsContact C-CD2 3.49Å; M140-F144 HydrophobicContact CB-CD2 4.3Å; M140-F144 HydrophobicContact CB-CE2 3.9Å; M140-F144 HydrophobicContact CE-CE2 3.91Å; M140-F144 HydrophobicContact CE-CZ 3.63Å; M140-F144 WeakPolarHBondContact O-CD2 3.36Å; M140-F144 VanDerWaalsContact O-CG 3.29Å; M140-F144 WeakPolarHBondContact O-CG 3.16Å; M140-F144 PolarHBondContact O-N 2.93Å; L141-F144 PolarHBondContact O-N 2.95Å; F144-L146 PolarHBondContact O-N 2.77Å; F144-R147 PolarHBondContact O-N 3.43Å; F144-R147 VanDerWaalsContact O-N 3.13Å; F144-I148 WeakPolarHBondContact O-CG1 3.34Å; F144-I148 PolarHBondContact O-N 2.85Å; F144-I318 HydrophobicContact CB-CD1 4.49Å |
| 145 | Y | 70.5 | Confident | 75.4 | Confident | 91 Ų | 91 | 85.4 Ų | 85.4 | 36% | 0.357 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -57.6 | -46.3 | 176 | 170.4 | -103.8 | 0 | 0 | 0 | 111.8 | L141 R147 I148 K149 A206 | L141-Y145 WeakPolarHBondContact O-CB 3.44Å; L141-Y145 PolarHBondContact O-N 2.94Å; Y145-R147 VanDerWaalsContact C-N 3.31Å; Y145-R147 PolarHBondContact O-N 3.31Å; Y145-I148 PolarHBondContact O-N 3.3Å; Y145-K149 HydrophobicContact CE1-CD 4.44Å; Y145-K149 VanDerWaalsContact O-CB 3.28Å; Y145-K149 WeakPolarHBondContact O-CB 3.22Å; Y145-K149 PolarHBondContact O-N 3.24Å; Y145-A206 HydrophobicContact CD2-CB 4.16Å; Y145-A206 VanDerWaalsContact CD2-O 3.27Å; Y145-A206 WeakPolarHBondContact CD2-O 3.27Å; Y145-A206 HydrophobicContact CE2-CB 3.89Å; Y145-A206 WeakPolarHBondContact CE2-O 3.46Å |
| 146 | L | 76.7 | Confident | 75.8 | Confident | 115 Ų | 115 | 84 Ų | 84 | 60% | 0.602 | 38% | 0.378 | S | S | * | . | H | α-helix | trans | -60.1 | -39.1 | 175.6 | -73.7 | 169.6 | 0 | 0 | 0 | 112.4 | E142 F144 L150 | E142-L146 WeakPolarHBondContact O-CG 3.07Å; E142-L146 PolarHBondContact O-N 3.23Å; E142-L146 VanDerWaalsContact O-N 3.1Å; F144-L146 PolarHBondContact O-N 2.77Å; L146-L150 WeakPolarHBondContact O-CB 3.2Å; L146-L150 PolarHBondContact O-N 2.94Å |
| 147 | R | 79.1 | Confident | 76.4 | Confident | 130 Ų | 130 | 80.4 Ų | 80.4 | 49% | 0.491 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -68.9 | -45.4 | 177.1 | -70.5 | 173.3 | -173 | -157.1 | 3.1 | 112.6 | Q143 F144 Y145 K149 L150 V151 | Q143-R147 WeakPolarHBondContact O-CG 3.48Å; Q143-R147 PolarHBondContact O-N 2.94Å; F144-R147 PolarHBondContact O-N 3.43Å; F144-R147 VanDerWaalsContact O-N 3.13Å; Y145-R147 VanDerWaalsContact C-N 3.31Å; Y145-R147 PolarHBondContact O-N 3.31Å; R147-K149 VanDerWaalsContact C-N 3.31Å; R147-K149 PolarHBondContact O-N 2.84Å; R147-L150 PolarHBondContact O-N 2.9Å; R147-V151 WeakPolarHBondContact O-CB 3.22Å; R147-V151 WeakPolarHBondContact O-CG2 3.1Å; R147-V151 PolarHBondContact O-N 3.4Å |
| 148 | I | 73.9 | Confident | 77.1 | Confident | 26 Ų | 26 | 76.8 Ų | 76.8 | 13% | 0.133 | 36% | 0.355 | C | S | . | . | H | α-helix | trans | -61.1 | -43.6 | 175.6 | -63.2 | 168.7 | 0 | 0 | 0 | 109.8 | F144 Y145 L150 V151 A152 A206 I318 | F144-I148 WeakPolarHBondContact O-CG1 3.34Å; F144-I148 PolarHBondContact O-N 2.85Å; Y145-I148 PolarHBondContact O-N 3.3Å; I148-L150 PolarHBondContact O-N 2.96Å; I148-V151 PolarHBondContact O-N 3.49Å; I148-A152 WeakPolarHBondContact O-CB 3.34Å; I148-A152 PolarHBondContact O-N 3.47Å; I148-A206 HydrophobicContact CG2-CB 4.04Å; I148-I318 HydrophobicContact CD1-CD1 3.73Å; I148-I318 HydrophobicContact CG1-CD1 4.4Å |
| 149 | K | 79.7 | Confident | 77.6 | Confident | 75 Ų | 75 | 69.3 Ų | 69.3 | 33% | 0.326 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -61.9 | -42.5 | 178.4 | -165.9 | -179.3 | -177 | -171.3 | 0 | 112 | Y145 R147 A152 Y153 | Y145-K149 HydrophobicContact CE1-CD 4.44Å; Y145-K149 VanDerWaalsContact O-CB 3.28Å; Y145-K149 WeakPolarHBondContact O-CB 3.22Å; Y145-K149 PolarHBondContact O-N 3.24Å; R147-K149 VanDerWaalsContact C-N 3.31Å; R147-K149 PolarHBondContact O-N 2.84Å; K149-A152 PolarHBondContact O-N 2.96Å; K149-Y153 HydrophobicContact CD-CE2 4.1Å; K149-Y153 WeakPolarHBondContact CE-OH 3.48Å; K149-Y153 HydrophobicContact CG-CD2 4.19Å; K149-Y153 HydrophobicContact CG-CE2 3.67Å; K149-Y153 WeakPolarHBondContact O-CD2 3.28Å; K149-Y153 PolarHBondContact O-N 3.48Å |
| 150 | L | 83 | Confident | 78 | Confident | 115 Ų | 115 | 71 Ų | 71 | 60% | 0.602 | 34% | 0.335 | S | S | * | . | H | α-helix | trans | -60.8 | -48.8 | 173.9 | -178.3 | 67.4 | 0 | 0 | 0 | 111.6 | L146 R147 I148 A152 Y153 V154 | L146-L150 WeakPolarHBondContact O-CB 3.2Å; L146-L150 PolarHBondContact O-N 2.94Å; R147-L150 PolarHBondContact O-N 2.9Å; I148-L150 PolarHBondContact O-N 2.96Å; L150-A152 VanDerWaalsContact C-N 3.33Å; L150-A152 PolarHBondContact O-N 3.02Å; L150-Y153 PolarHBondContact O-N 2.85Å; L150-V154 WeakPolarHBondContact O-CG2 3.21Å; L150-V154 PolarHBondContact O-N 2.93Å |
| 151 | V | 80 | Confident | 78.7 | Confident | 26 Ų | 26 | 71.2 Ų | 71.2 | 16% | 0.158 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -58.8 | -43.1 | 176.9 | 161.4 | 0 | 0 | 0 | 0 | 111.7 | R147 I148 Y153 V154 H155 T311 | R147-V151 WeakPolarHBondContact O-CB 3.22Å; R147-V151 WeakPolarHBondContact O-CG2 3.1Å; R147-V151 PolarHBondContact O-N 3.4Å; I148-V151 PolarHBondContact O-N 3.49Å; V151-Y153 VanDerWaalsContact C-N 3.34Å; V151-Y153 PolarHBondContact O-N 3.33Å; V151-V154 PolarHBondContact O-N 3.28Å; V151-V154 VanDerWaalsContact O-N 3.12Å; V151-H155 PolarHBondContact O-CD2 2.9Å; V151-H155 VanDerWaalsContact O-CD2 3.27Å; V151-H155 PolarHBondContact O-N 3.48Å; V151-T311 HydrophobicContact CG1-CG2 3.9Å; V151-T311 WeakPolarHBondContact CG1-OG1 3.3Å |
| 152 | A | 80 | Confident | 79.2 | Confident | 1 Ų | 1 | 66.4 Ų | 66.4 | 1% | 0.008 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -62.6 | -39.2 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | I148 K149 L150 H155 L156 S202 I203 | I148-A152 WeakPolarHBondContact O-CB 3.34Å; I148-A152 PolarHBondContact O-N 3.47Å; K149-A152 PolarHBondContact O-N 2.96Å; L150-A152 VanDerWaalsContact C-N 3.33Å; L150-A152 PolarHBondContact O-N 3.02Å; A152-H155 PolarHBondContact O-N 3.34Å; A152-L156 WeakPolarHBondContact O-CB 3.29Å; A152-L156 PolarHBondContact O-N 2.97Å; A152-S202 VanDerWaalsContact CB-CB 3.46Å; A152-I203 HydrophobicContact CB-CG1 3.76Å |
| 153 | Y | 82.8 | Confident | 79.7 | Confident | 121 Ų | 121 | 64.3 Ų | 64.3 | 48% | 0.475 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -66.4 | -35.7 | 171.9 | -72.1 | -53 | 0 | 0 | 0 | 112.9 | K149 L150 V151 L156 L157 | K149-Y153 HydrophobicContact CD-CE2 4.1Å; K149-Y153 WeakPolarHBondContact CE-OH 3.48Å; K149-Y153 HydrophobicContact CG-CD2 4.19Å; K149-Y153 HydrophobicContact CG-CE2 3.67Å; K149-Y153 WeakPolarHBondContact O-CD2 3.28Å; K149-Y153 PolarHBondContact O-N 3.48Å; L150-Y153 PolarHBondContact O-N 2.85Å; V151-Y153 VanDerWaalsContact C-N 3.34Å; V151-Y153 PolarHBondContact O-N 3.33Å; Y153-L156 PolarHBondContact O-N 2.86Å; Y153-L157 VanDerWaalsContact O-CB 3.3Å; Y153-L157 WeakPolarHBondContact O-CB 3.42Å; Y153-L157 PolarHBondContact O-N 3.35Å |
| 154 | V | 84.4 | Confident | 80 | Confident | 41 Ų | 41 | 62 Ų | 62 | 25% | 0.248 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -65 | -44.5 | 173.8 | 175.5 | 0 | 0 | 0 | 0 | 110.7 | L150 V151 L156 L157 V158 F303 V307 | L150-V154 WeakPolarHBondContact O-CG2 3.21Å; L150-V154 PolarHBondContact O-N 2.93Å; V151-V154 PolarHBondContact O-N 3.28Å; V151-V154 VanDerWaalsContact O-N 3.12Å; V154-L156 PolarHBondContact O-N 2.85Å; V154-L157 PolarHBondContact O-N 2.92Å; V154-V158 HydrophobicContact CG1-CG2 4.5Å; V154-V158 WeakPolarHBondContact O-CG2 3.47Å; V154-V158 PolarHBondContact O-N 2.85Å; V154-F303 HydrophobicContact CG1-CE1 3.98Å; V154-F303 HydrophobicContact CG1-CZ 4.33Å; V154-V307 HydrophobicContact CG1-CG1 4.04Å; V154-V307 HydrophobicContact CG1-CG2 4.09Å |
| 155 | H | 81.2 | Confident | 80.3 | Confident | 0 Ų | 0 | 60.3 Ų | 60.3 | 0% | 0 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -59.5 | -43.7 | 173 | -77.5 | -68 | 0 | 0 | 0 | 112.3 | V151 A152 V158 A159 H304 T308 T311 | V151-H155 PolarHBondContact O-CD2 2.9Å; V151-H155 VanDerWaalsContact O-CD2 3.27Å; V151-H155 PolarHBondContact O-N 3.48Å; A152-H155 PolarHBondContact O-N 3.34Å; H155-V158 PolarHBondContact O-N 3.07Å; H155-A159 WeakPolarHBondContact O-CB 3.47Å; H155-A159 PolarHBondContact O-N 3.49Å; H155-H304 AromaticContact CE1-NE2 3.51Å; H155-H304 AromaticContact ND1-CD2 3.58Å; H155-H304 AromaticContact ND1-CE1 3.82Å; H155-H304 AromaticContact ND1-NE2 2.85Å; H155-H304 PolarHBondContact ND1-NE2 3.39Å; H155-T308 PolarHBondContact CE1-OG1 2.89Å; H155-T311 PolarHBondContact NE2-OG1 2.91Å |
| 156 | L | 84.2 | Confident | 80.7 | Confident | 59 Ų | 59 | 56 Ų | 56 | 31% | 0.309 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -64.6 | -41.3 | 177.6 | -162.1 | 85.8 | 0 | 0 | 0 | 112.3 | A152 Y153 V154 A159 F160 L196 I203 | A152-L156 WeakPolarHBondContact O-CB 3.29Å; A152-L156 PolarHBondContact O-N 2.97Å; Y153-L156 PolarHBondContact O-N 2.86Å; V154-L156 PolarHBondContact O-N 2.85Å; L156-A159 WeakPolarHBondContact O-CB 3.22Å; L156-A159 PolarHBondContact O-N 2.84Å; L156-F160 WeakPolarHBondContact O-CB 3.5Å; L156-F160 PolarHBondContact O-N 3.5Å; L156-L196 HydrophobicContact CD1-CD1 3.93Å; L156-I203 HydrophobicContact CD1-CD1 4.38Å |
| 157 | L | 86.4 | Confident | 80.9 | Confident | 103 Ų | 103 | 54 Ų | 54 | 54% | 0.539 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -63.9 | -45.1 | 176.7 | 179.4 | 64 | 0 | 0 | 0 | 111.1 | Y153 V154 F160 L161 | Y153-L157 VanDerWaalsContact O-CB 3.3Å; Y153-L157 WeakPolarHBondContact O-CB 3.42Å; Y153-L157 PolarHBondContact O-N 3.35Å; V154-L157 PolarHBondContact O-N 2.92Å; L157-F160 PolarHBondContact O-N 3.32Å; L157-L161 HydrophobicContact CG-CD1 4.32Å; L157-L161 WeakPolarHBondContact O-CG 3.49Å; L157-L161 PolarHBondContact O-N 3.42Å |
| 158 | V | 81.7 | Confident | 80.7 | Confident | 7 Ų | 7 | 50.1 Ų | 50.1 | 4% | 0.042 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -64.5 | -42.6 | 175.7 | 172.3 | 0 | 0 | 0 | 0 | 111 | V154 H155 F160 L161 L162 V195 V300 F303 H304 | V154-V158 HydrophobicContact CG1-CG2 4.5Å; V154-V158 WeakPolarHBondContact O-CG2 3.47Å; V154-V158 PolarHBondContact O-N 2.85Å; H155-V158 PolarHBondContact O-N 3.07Å; V158-F160 VanDerWaalsContact C-N 3.3Å; V158-F160 PolarHBondContact O-N 3.31Å; V158-L161 PolarHBondContact O-N 3.47Å; V158-L162 HydrophobicContact CG1-CD1 3.77Å; V158-L162 HydrophobicContact CG1-CG 4.23Å; V158-L162 WeakPolarHBondContact O-CB 3.3Å; V158-L162 VanDerWaalsContact O-CG 3.27Å; V158-L162 WeakPolarHBondContact O-CG 3.01Å; V158-L162 PolarHBondContact O-N 3.48Å; V158-V195 HydrophobicContact CG1-CG1 4.46Å; V158-V300 HydrophobicContact CG1-CG1 3.81Å; V158-F303 HydrophobicContact CG2-CD1 4.19Å; V158-F303 HydrophobicContact CG2-CE1 4.18Å; V158-H304 HydrophobicContact CG1-CB 3.98Å |
| 159 | A | 80.8 | Confident | 80.6 | Confident | 1 Ų | 1 | 49.2 Ų | 49.2 | 1% | 0.008 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -56.3 | -44.9 | 174 | 0 | 0 | 0 | 0 | 0 | 112.1 | H155 L156 L162 L163 V195 L196 | H155-A159 WeakPolarHBondContact O-CB 3.47Å; H155-A159 PolarHBondContact O-N 3.49Å; L156-A159 WeakPolarHBondContact O-CB 3.22Å; L156-A159 PolarHBondContact O-N 2.84Å; A159-L162 PolarHBondContact O-N 3.39Å; A159-L163 VanDerWaalsContact O-CB 3.25Å; A159-L163 WeakPolarHBondContact O-CB 3.48Å; A159-L163 PolarHBondContact O-N 3.49Å; A159-V195 HydrophobicContact CB-CB 4.47Å; A159-V195 HydrophobicContact CB-CG1 3.91Å; A159-L196 HydrophobicContact CB-CB 3.88Å; A159-L196 HydrophobicContact CB-CD1 3.87Å |
| 160 | F | 83.4 | Confident | 80.5 | Confident | 135 Ų | 135 | 47.8 Ų | 47.8 | 59% | 0.592 | 26% | 0.257 | S | S | * | . | H | α-helix | trans | -65.1 | -43.7 | 178.5 | -179.4 | -96 | 0 | 0 | 0 | 112.1 | L156 L157 V158 L163 S164 | L156-F160 WeakPolarHBondContact O-CB 3.5Å; L156-F160 PolarHBondContact O-N 3.5Å; L157-F160 PolarHBondContact O-N 3.32Å; V158-F160 VanDerWaalsContact C-N 3.3Å; V158-F160 PolarHBondContact O-N 3.31Å; F160-L163 PolarHBondContact O-N 2.88Å; F160-S164 VanDerWaalsContact O-CB 3.31Å; F160-S164 WeakPolarHBondContact O-CB 3.29Å; F160-S164 PolarHBondContact O-N 2.85Å; F160-S164 PolarHBondContact O-OG 3.43Å |
| 161 | L | 81.6 | Confident | 80.2 | Confident | 88 Ų | 88 | 47.6 Ų | 47.6 | 46% | 0.461 | 26% | 0.26 | S | S | . | . | H | α-helix | trans | -63.2 | -43.4 | 176.2 | -69.8 | 171.7 | 0 | 0 | 0 | 112 | L157 V158 S164 S165 | L157-L161 HydrophobicContact CG-CD1 4.32Å; L157-L161 WeakPolarHBondContact O-CG 3.49Å; L157-L161 PolarHBondContact O-N 3.42Å; V158-L161 PolarHBondContact O-N 3.47Å; L161-S164 WeakPolarHBondContact CA-OG 3.18Å; L161-S164 PolarHBondContact O-OG 3.3Å; L161-S164 VanDerWaalsContact O-OG 3.04Å; L161-S165 WeakPolarHBondContact O-CB 3.47Å; L161-S165 PolarHBondContact O-N 2.89Å |
| 162 | L | 79.1 | Confident | 79.7 | Confident | 3 Ų | 3 | 51.4 Ų | 51.4 | 2% | 0.016 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -63.2 | -49.6 | 175.3 | -68.7 | 169.1 | 0 | 0 | 0 | 111.5 | V158 A159 S164 S165 D166 Y191 A192 V195 Y297 V300 | V158-L162 HydrophobicContact CG1-CD1 3.77Å; V158-L162 HydrophobicContact CG1-CG 4.23Å; V158-L162 WeakPolarHBondContact O-CB 3.3Å; V158-L162 VanDerWaalsContact O-CG 3.27Å; V158-L162 WeakPolarHBondContact O-CG 3.01Å; V158-L162 PolarHBondContact O-N 3.48Å; A159-L162 PolarHBondContact O-N 3.39Å; L162-S164 PolarHBondContact O-N 3.43Å; L162-S165 PolarHBondContact O-N 3.14Å; L162-D166 WeakPolarHBondContact O-CB 3.46Å; L162-D166 PolarHBondContact O-N 2.81Å; L162-Y191 HydrophobicContact CD1-CD1 4.45Å; L162-Y191 HydrophobicContact CD1-CE1 3.94Å; L162-A192 HydrophobicContact CB-CB 3.97Å; L162-V195 HydrophobicContact CD1-CB 4.34Å; L162-V195 HydrophobicContact CD1-CG1 4.18Å; L162-V195 HydrophobicContact CD1-CG2 4.17Å; L162-Y297 HydrophobicContact CD2-CD2 3.71Å; L162-Y297 HydrophobicContact CD2-CE2 3.43Å; L162-Y297 VanDerWaalsContact CD2-CE2 3.43Å; L162-Y297 HydrophobicContact CD2-CG 4.4Å; L162-V300 HydrophobicContact CD2-CG1 3.83Å; L162-V300 HydrophobicContact CG-CG1 4.09Å |
| 163 | L | 81.7 | Confident | 79.3 | Confident | 47 Ų | 47 | 53.7 Ų | 53.7 | 25% | 0.246 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -64.6 | -42.2 | -178.1 | -173.9 | 65.7 | 0 | 0 | 0 | 112.1 | A159 F160 D166 V167 A192 M193 | A159-L163 VanDerWaalsContact O-CB 3.25Å; A159-L163 WeakPolarHBondContact O-CB 3.48Å; A159-L163 PolarHBondContact O-N 3.49Å; F160-L163 PolarHBondContact O-N 2.88Å; L163-D166 PolarHBondContact O-N 2.89Å; L163-V167 HydrophobicContact CD1-CG2 4.43Å; L163-V167 HydrophobicContact CG-CG2 4.47Å; L163-V167 WeakPolarHBondContact O-CB 3.3Å; L163-V167 VanDerWaalsContact O-CG2 3.23Å; L163-V167 WeakPolarHBondContact O-CG2 3.38Å; L163-V167 PolarHBondContact O-N 2.93Å; L163-A192 HydrophobicContact CB-CB 4.22Å; L163-A192 HydrophobicContact CD1-CB 4.26Å; L163-M193 HydrophobicContact CD1-SD 4.25Å; L163-M193 HydrophobicContact CD2-SD 4.47Å |
| 164 | S | 80.5 | Confident | 79.2 | Confident | 54 Ų | 54 | 53.3 Ų | 53.3 | 38% | 0.378 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -65.1 | -38 | 175.5 | 54.5 | 0 | 0 | 0 | 0 | 112.5 | F160 L161 L162 A168 | F160-S164 VanDerWaalsContact O-CB 3.31Å; F160-S164 WeakPolarHBondContact O-CB 3.29Å; F160-S164 PolarHBondContact O-N 2.85Å; F160-S164 PolarHBondContact O-OG 3.43Å; L161-S164 WeakPolarHBondContact CA-OG 3.18Å; L161-S164 PolarHBondContact O-OG 3.3Å; L161-S164 VanDerWaalsContact O-OG 3.04Å; L162-S164 PolarHBondContact O-N 3.43Å; S164-A168 WeakPolarHBondContact O-CB 3.43Å; S164-A168 PolarHBondContact O-N 3.48Å |
| 165 | S | 76 | Confident | 78.6 | Confident | 29 Ų | 29 | 56.4 Ų | 56.4 | 20% | 0.203 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -65.9 | -45 | 173 | -177.3 | 0 | 0 | 0 | 0 | 112.4 | L161 L162 A168 L169 | L161-S165 WeakPolarHBondContact O-CB 3.47Å; L161-S165 PolarHBondContact O-N 2.89Å; L162-S165 PolarHBondContact O-N 3.14Å; S165-A168 PolarHBondContact O-N 3.27Å; S165-L169 WeakPolarHBondContact O-CB 3.3Å; S165-L169 WeakPolarHBondContact O-CG 3.37Å; S165-L169 PolarHBondContact O-N 3.07Å |
| 166 | D | 79.4 | Confident | 78 | Confident | 0 Ų | 0 | 63.4 Ų | 63.4 | 0% | 0 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -70 | -36.5 | 179.8 | -74.4 | -28.9 | 0 | 0 | 0 | 111.6 | L162 L163 L169 I170 R188 | L162-D166 WeakPolarHBondContact O-CB 3.46Å; L162-D166 PolarHBondContact O-N 2.81Å; L163-D166 PolarHBondContact O-N 2.89Å; D166-L169 PolarHBondContact O-N 3.31Å; D166-I170 WeakPolarHBondContact O-CB 3.01Å; D166-I170 WeakPolarHBondContact O-CD1 3.33Å; D166-I170 WeakPolarHBondContact O-CG1 3.38Å; D166-I170 PolarHBondContact O-N 3.36Å; D166-R188 IonicContact OD1-CZ 3.91Å; D166-R188 VanDerWaalsContact OD1-CZ 3.29Å; D166-R188 IonicContact OD1-NE 3.29Å; D166-R188 PolarHBondContact OD1-NE 3.4Å; D166-R188 IonicContact OD1-NH2 2.84Å; D166-R188 PolarHBondContact OD1-NH2 2.7Å |
| 167 | V | 79.8 | Confident | 77.1 | Confident | 74 Ų | 74 | 61.3 Ų | 61.3 | 45% | 0.448 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -63.1 | -43.4 | 171.2 | 169 | 0 | 0 | 0 | 0 | 111.2 | L163 L169 I170 V171 | L163-V167 HydrophobicContact CD1-CG2 4.43Å; L163-V167 HydrophobicContact CG-CG2 4.47Å; L163-V167 WeakPolarHBondContact O-CB 3.3Å; L163-V167 VanDerWaalsContact O-CG2 3.23Å; L163-V167 WeakPolarHBondContact O-CG2 3.38Å; L163-V167 PolarHBondContact O-N 2.93Å; V167-L169 VanDerWaalsContact C-N 3.35Å; V167-L169 PolarHBondContact O-N 2.83Å; V167-I170 PolarHBondContact O-N 2.97Å; V167-V171 WeakPolarHBondContact O-CG2 3.47Å; V167-V171 PolarHBondContact O-N 3.12Å |
| 168 | A | 75.5 | Confident | 76.5 | Confident | 47 Ų | 47 | 58.6 Ų | 58.6 | 39% | 0.388 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -61.8 | -42.5 | 174.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | S164 S165 V171 I172 | S164-A168 WeakPolarHBondContact O-CB 3.43Å; S164-A168 PolarHBondContact O-N 3.48Å; S165-A168 PolarHBondContact O-N 3.27Å; A168-V171 PolarHBondContact O-N 3.34Å; A168-I172 WeakPolarHBondContact O-CD1 3.43Å; A168-I172 VanDerWaalsContact O-CG1 3.26Å; A168-I172 WeakPolarHBondContact O-CG1 3.27Å; A168-I172 PolarHBondContact O-N 2.84Å |
| 169 | L | 71.6 | Confident | 76 | Confident | 8 Ų | 8 | 63.1 Ų | 63.1 | 4% | 0.042 | 35% | 0.351 | C | S | . | . | H | α-helix | trans | -64.4 | -39 | 175 | -74.7 | 165.3 | 0 | 0 | 0 | 112.4 | S165 D166 V167 I172 L173 L185 L293 | S165-L169 WeakPolarHBondContact O-CB 3.3Å; S165-L169 WeakPolarHBondContact O-CG 3.37Å; S165-L169 PolarHBondContact O-N 3.07Å; D166-L169 PolarHBondContact O-N 3.31Å; V167-L169 VanDerWaalsContact C-N 3.35Å; V167-L169 PolarHBondContact O-N 2.83Å; L169-I172 PolarHBondContact O-N 2.8Å; L169-L173 HydrophobicContact CB-CD1 4.48Å; L169-L173 HydrophobicContact CD2-CD1 3.93Å; L169-L173 VanDerWaalsContact O-CB 3.24Å; L169-L173 WeakPolarHBondContact O-CB 3.23Å; L169-L173 WeakPolarHBondContact O-CG 3.25Å; L169-L173 PolarHBondContact O-N 3.46Å; L169-L185 HydrophobicContact CB-CD1 3.89Å; L169-L293 HydrophobicContact CD2-CD1 3.99Å |
| 170 | I | 77.5 | Confident | 75.4 | Confident | 45 Ų | 45 | 70.6 Ų | 70.6 | 23% | 0.231 | 39% | 0.386 | C | S | . | . | H | α-helix | trans | -59.1 | -54 | 172.1 | -70.2 | 160.9 | 0 | 0 | 0 | 110.1 | D166 V167 I172 L173 W174 L185 C189 | D166-I170 WeakPolarHBondContact O-CB 3.01Å; D166-I170 WeakPolarHBondContact O-CD1 3.33Å; D166-I170 WeakPolarHBondContact O-CG1 3.38Å; D166-I170 PolarHBondContact O-N 3.36Å; V167-I170 PolarHBondContact O-N 2.97Å; I170-I172 PolarHBondContact O-N 3.04Å; I170-L173 PolarHBondContact O-N 3.2Å; I170-W174 HydrophobicContact CG2-CB 4.31Å; I170-W174 HydrophobicContact CG2-CE3 4.27Å; I170-W174 WeakPolarHBondContact O-CB 3.35Å; I170-W174 PolarHBondContact O-N 3.41Å; I170-L185 HydrophobicContact CB-CD2 4.25Å; I170-L185 HydrophobicContact CG1-CD1 4.11Å; I170-L185 HydrophobicContact CG1-CD2 3.65Å; I170-L185 HydrophobicContact CG1-CG 3.55Å; I170-C189 HydrophobicContact CD1-CB 4.33Å |
| 171 | V | 76.9 | Confident | 74.5 | Confident | 110 Ų | 110 | 66.9 Ų | 66.9 | 67% | 0.667 | 37% | 0.371 | S | S | * | . | H | α-helix | trans | -58.6 | -37.2 | -178.2 | 172.4 | 0 | 0 | 0 | 0 | 112.2 | V167 A168 | V167-V171 WeakPolarHBondContact O-CG2 3.47Å; V167-V171 PolarHBondContact O-N 3.12Å; A168-V171 PolarHBondContact O-N 3.34Å |
| 172 | I | 70 | Confident | 74 | Confident | 107 Ų | 107 | 65.4 Ų | 65.4 | 55% | 0.549 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -79.5 | -44.5 | -178.7 | -65.8 | 165.7 | 0 | 0 | 0 | 112.6 | A168 L169 I170 | A168-I172 WeakPolarHBondContact O-CD1 3.43Å; A168-I172 VanDerWaalsContact O-CG1 3.26Å; A168-I172 WeakPolarHBondContact O-CG1 3.27Å; A168-I172 PolarHBondContact O-N 2.84Å; L169-I172 PolarHBondContact O-N 2.8Å; I170-I172 PolarHBondContact O-N 3.04Å |
| 173 | L | 71.3 | Confident | 73.7 | Confident | 48 Ų | 48 | 70.9 Ų | 70.9 | 25% | 0.251 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -96.5 | -29.8 | -168.3 | -63.1 | 172.2 | 0 | 0 | 0 | 113.7 | L169 I170 K176 S177 L185 F290 | L169-L173 HydrophobicContact CB-CD1 4.48Å; L169-L173 HydrophobicContact CD2-CD1 3.93Å; L169-L173 VanDerWaalsContact O-CB 3.24Å; L169-L173 WeakPolarHBondContact O-CB 3.23Å; L169-L173 WeakPolarHBondContact O-CG 3.25Å; L169-L173 PolarHBondContact O-N 3.46Å; I170-L173 PolarHBondContact O-N 3.2Å; L173-K176 CarbonylContact O-C 3.53Å; L173-K176 PolarHBondContact O-N 2.89Å; L173-S177 WeakPolarHBondContact O-CB 3.45Å; L173-S177 PolarHBondContact O-N 3.04Å; L173-S177 PolarHBondContact O-OG 3.49Å; L173-S177 VanDerWaalsContact O-OG 3.13Å; L173-L185 HydrophobicContact CB-CD2 4.4Å; L173-F290 HydrophobicContact CD1-CD2 4.41Å; L173-F290 HydrophobicContact CD1-CE2 4.46Å |
| 174 | W | 79.8 | Confident | 73.1 | Confident | 114 Ų | 114 | 74 Ų | 74 | 43% | 0.432 | 40% | 0.402 | S | S | . | . | G | 310 helix | trans | -46.8 | -53.8 | -174.9 | -171.3 | -90.6 | 0 | 0 | 0 | 114.1 | I170 K176 S177 Q182 I186 | I170-W174 HydrophobicContact CG2-CB 4.31Å; I170-W174 HydrophobicContact CG2-CE3 4.27Å; I170-W174 WeakPolarHBondContact O-CB 3.35Å; I170-W174 PolarHBondContact O-N 3.41Å; W174-K176 PolarHBondContact O-N 3.41Å; W174-K176 VanDerWaalsContact O-N 3.17Å; W174-S177 WeakPolarHBondContact CA-OG 3.26Å; W174-S177 PolarHBondContact O-N 3.46Å; W174-S177 PolarHBondContact O-OG 2.74Å; W174-Q182 HydrophobicContact CE3-CG 4.24Å; W174-Q182 HydrophobicContact CH2-CB 4.47Å; W174-Q182 HydrophobicContact CZ3-CB 4.12Å; W174-Q182 HydrophobicContact CZ3-CG 4.24Å; W174-I186 HydrophobicContact CH2-CD1 4.26Å; W174-I186 HydrophobicContact CZ3-CD1 4.31Å; W174-I186 HydrophobicContact CZ3-CG1 4.23Å |
| 175 | P | 72.3 | Confident | 72.6 | Confident | 105 Ų | 105 | 72 Ų | 72 | 68% | 0.682 | 39% | 0.386 | S | S | * | . | G | 310 helix | trans | -69.4 | -12.5 | -178.1 | 29.5 | -37.1 | 0 | 0 | 0 | 114.7 | ||
| 176 | K | 68.9 | Low | 72.6 | Confident | 148 Ų | 148 | 74.2 Ų | 74.2 | 64% | 0.643 | 40% | 0.396 | S | S | * | . | G | 310 helix | trans | -111.9 | 2.9 | -178.3 | -62.5 | -175.9 | 178.4 | -175.8 | 0 | 113.3 | L173 W174 | L173-K176 CarbonylContact O-C 3.53Å; L173-K176 PolarHBondContact O-N 2.89Å; W174-K176 PolarHBondContact O-N 3.41Å; W174-K176 VanDerWaalsContact O-N 3.17Å |
| 177 | S | 65.1 | Low | 72.1 | Confident | 15 Ų | 15 | 78.3 Ų | 78.3 | 11% | 0.105 | 42% | 0.417 | C | S | . | . | trans | -104.2 | 133.5 | -165.6 | 60.7 | 0 | 0 | 0 | 0 | 113 | L173 W174 Q182 | L173-S177 WeakPolarHBondContact O-CB 3.45Å; L173-S177 PolarHBondContact O-N 3.04Å; L173-S177 PolarHBondContact O-OG 3.49Å; L173-S177 VanDerWaalsContact O-OG 3.13Å; W174-S177 WeakPolarHBondContact CA-OG 3.26Å; W174-S177 PolarHBondContact O-N 3.46Å; W174-S177 PolarHBondContact O-OG 2.74Å; S177-Q182 PolarHBondContact O-NE2 3.27Å; S177-Q182 WeakPolarHBondContact OG-CG 3.36Å | ||
| 178 | A | 74 | Confident | 71.7 | Confident | 46 Ų | 46 | 75.8 Ų | 75.8 | 38% | 0.38 | 40% | 0.399 | S | S | . | . | trans | -63.5 | 155 | 171.1 | 0 | 0 | 0 | 0 | 0 | 110.8 | Q180 Q181 Q182 | A178-Q180 PolarHBondContact O-N 3.23Å; A178-Q181 WeakPolarHBondContact O-CA 3.38Å; A178-Q181 WeakPolarHBondContact O-CB 3.39Å; A178-Q181 PolarHBondContact O-N 3.11Å; A178-Q182 PolarHBondContact O-N 3.05Å | ||
| 179 | P | 71.5 | Confident | 71.8 | Confident | 101 Ų | 101 | 75.1 Ų | 75.1 | 66% | 0.656 | 39% | 0.391 | S | S | * | . | H | α-helix | trans | -56.7 | -30.9 | -177.1 | 20.4 | -33.4 | 0 | 0 | 0 | 113.9 | Q182 L183 | P179-Q182 PolarHBondContact O-N 3.36Å; P179-L183 PolarHBondContact O-N 3.47Å |
| 180 | Q | 67.3 | Low | 72 | Confident | 158 Ų | 158 | 79.8 Ų | 79.8 | 74% | 0.738 | 42% | 0.416 | S | S | * | . | H | α-helix | trans | -65.7 | -37.1 | 173.2 | -65.1 | -177.6 | -4.4 | 0 | 0 | 112.9 | A178 K184 | A178-Q180 PolarHBondContact O-N 3.23Å; Q180-K184 WeakPolarHBondContact O-CG 3.36Å; Q180-K184 PolarHBondContact O-N 2.94Å; Q180-K184 VanDerWaalsContact O-N 3.12Å |
| 181 | Q | 65 | Low | 71.9 | Confident | 58 Ų | 58 | 78.5 Ų | 78.5 | 27% | 0.271 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -73.3 | -39 | 176 | -68 | 172.9 | -11.3 | 0 | 0 | 110.9 | A178 L183 K184 L185 | A178-Q181 WeakPolarHBondContact O-CA 3.38Å; A178-Q181 WeakPolarHBondContact O-CB 3.39Å; A178-Q181 PolarHBondContact O-N 3.11Å; Q181-L183 VanDerWaalsContact C-N 3.33Å; Q181-L183 PolarHBondContact O-N 3.47Å; Q181-K184 PolarHBondContact O-N 2.91Å; Q181-L185 WeakPolarHBondContact O-CB 3.49Å; Q181-L185 PolarHBondContact O-N 3.39Å |
| 182 | Q | 71.8 | Confident | 71.7 | Confident | 56 Ų | 56 | 73.2 Ų | 73.2 | 26% | 0.262 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -57.9 | -44.9 | 171.5 | -66 | 178.1 | -4.6 | 0 | 0 | 111.2 | W174 S177 A178 P179 L185 I186 | W174-Q182 HydrophobicContact CE3-CG 4.24Å; W174-Q182 HydrophobicContact CH2-CB 4.47Å; W174-Q182 HydrophobicContact CZ3-CB 4.12Å; W174-Q182 HydrophobicContact CZ3-CG 4.24Å; S177-Q182 PolarHBondContact O-NE2 3.27Å; S177-Q182 WeakPolarHBondContact OG-CG 3.36Å; A178-Q182 PolarHBondContact O-N 3.05Å; P179-Q182 PolarHBondContact O-N 3.36Å; Q182-L185 WeakPolarHBondContact O-CB 3.41Å; Q182-L185 PolarHBondContact O-N 2.88Å; Q182-L185 VanDerWaalsContact O-N 3.13Å; Q182-I186 WeakPolarHBondContact O-CG1 3.5Å; Q182-I186 PolarHBondContact O-N 3.43Å |
| 183 | L | 71.7 | Confident | 72 | Confident | 118 Ų | 118 | 72 Ų | 72 | 62% | 0.618 | 37% | 0.369 | S | S | * | . | H | α-helix | trans | -61.6 | -44.9 | 176 | -177.4 | 63.5 | 0 | 0 | 0 | 112.4 | P179 Q181 L185 I186 L187 | P179-L183 PolarHBondContact O-N 3.47Å; Q181-L183 VanDerWaalsContact C-N 3.33Å; Q181-L183 PolarHBondContact O-N 3.47Å; L183-L185 PolarHBondContact O-N 3.05Å; L183-I186 PolarHBondContact O-N 3.13Å; L183-L187 WeakPolarHBondContact O-CB 3.25Å; L183-L187 PolarHBondContact O-N 3.42Å |
| 184 | K | 68.7 | Low | 72.2 | Confident | 113 Ų | 113 | 72 Ų | 72 | 49% | 0.491 | 37% | 0.366 | S | S | . | . | H | α-helix | trans | -57.4 | -38.2 | 173.6 | -73.9 | -174.6 | -179.1 | -169.4 | 0 | 111.5 | Q180 Q181 L187 R188 | Q180-K184 WeakPolarHBondContact O-CG 3.36Å; Q180-K184 PolarHBondContact O-N 2.94Å; Q180-K184 VanDerWaalsContact O-N 3.12Å; Q181-K184 PolarHBondContact O-N 2.91Å; K184-L187 PolarHBondContact O-N 3.05Å; K184-R188 WeakPolarHBondContact O-CG 3.42Å; K184-R188 PolarHBondContact O-N 3.28Å; K184-R188 VanDerWaalsContact O-N 3.16Å |
| 185 | L | 71.1 | Confident | 72 | Confident | 11 Ų | 11 | 66.6 Ų | 66.6 | 6% | 0.058 | 35% | 0.346 | C | S | . | . | H | α-helix | trans | -76 | -38.5 | -177.5 | -166.9 | 56.9 | 0 | 0 | 0 | 113 | L169 I170 L173 Q181 Q182 L183 L187 R188 C189 | L169-L185 HydrophobicContact CB-CD1 3.89Å; I170-L185 HydrophobicContact CB-CD2 4.25Å; I170-L185 HydrophobicContact CG1-CD1 4.11Å; I170-L185 HydrophobicContact CG1-CD2 3.65Å; I170-L185 HydrophobicContact CG1-CG 3.55Å; L173-L185 HydrophobicContact CB-CD2 4.4Å; Q181-L185 WeakPolarHBondContact O-CB 3.49Å; Q181-L185 PolarHBondContact O-N 3.39Å; Q182-L185 WeakPolarHBondContact O-CB 3.41Å; Q182-L185 PolarHBondContact O-N 2.88Å; Q182-L185 VanDerWaalsContact O-N 3.13Å; L183-L185 PolarHBondContact O-N 3.05Å; L185-L187 VanDerWaalsContact C-N 3.32Å; L185-R188 PolarHBondContact O-N 3.38Å; L185-C189 PolarHBondContact O-N 3.03Å; L185-C189 VanDerWaalsContact O-N 3.08Å |
| 186 | I | 74.8 | Confident | 72.4 | Confident | 77 Ų | 77 | 63.7 Ų | 63.7 | 40% | 0.395 | 32% | 0.324 | S | S | . | . | H | α-helix | trans | -59.9 | -44.3 | 168.9 | -68.4 | 163.9 | 0 | 0 | 0 | 110.1 | W174 Q182 L183 R188 C189 L190 | W174-I186 HydrophobicContact CH2-CD1 4.26Å; W174-I186 HydrophobicContact CZ3-CD1 4.31Å; W174-I186 HydrophobicContact CZ3-CG1 4.23Å; Q182-I186 WeakPolarHBondContact O-CG1 3.5Å; Q182-I186 PolarHBondContact O-N 3.43Å; L183-I186 PolarHBondContact O-N 3.13Å; I186-R188 VanDerWaalsContact C-N 3.3Å; I186-R188 PolarHBondContact O-N 2.92Å; I186-C189 WeakPolarHBondContact O-CB 3.35Å; I186-C189 PolarHBondContact O-N 3.39Å; I186-L190 HydrophobicContact CG2-CD1 4.18Å; I186-L190 HydrophobicContact CG2-CG 4.47Å; I186-L190 WeakPolarHBondContact O-CG 3.22Å; I186-L190 PolarHBondContact O-N 3.48Å |
| 187 | L | 69.3 | Low | 72.8 | Confident | 86 Ų | 86 | 60.4 Ų | 60.4 | 45% | 0.45 | 31% | 0.314 | S | S | . | . | H | α-helix | trans | -63.3 | -34.7 | 179.9 | -173.7 | 63.8 | 0 | 0 | 0 | 112.7 | L183 K184 L185 Y191 Q233 | L183-L187 WeakPolarHBondContact O-CB 3.25Å; L183-L187 PolarHBondContact O-N 3.42Å; K184-L187 PolarHBondContact O-N 3.05Å; L185-L187 VanDerWaalsContact C-N 3.32Å; L187-Y191 PolarHBondContact O-N 2.85Å; L187-Y191 VanDerWaalsContact O-N 3.1Å; L187-Q233 HydrophobicContact CD2-CG 4.44Å |
| 188 | R | 72.7 | Confident | 73.4 | Confident | 20 Ų | 20 | 59.7 Ų | 59.7 | 8% | 0.075 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -66.4 | -47 | 171.5 | -69.8 | 167.5 | 60.4 | 122.4 | 10 | 112.1 | D166 K184 L185 I186 L190 Y191 A192 Y297 | D166-R188 IonicContact OD1-CZ 3.91Å; D166-R188 VanDerWaalsContact OD1-CZ 3.29Å; D166-R188 IonicContact OD1-NE 3.29Å; D166-R188 PolarHBondContact OD1-NE 3.4Å; D166-R188 IonicContact OD1-NH2 2.84Å; D166-R188 PolarHBondContact OD1-NH2 2.7Å; K184-R188 WeakPolarHBondContact O-CG 3.42Å; K184-R188 PolarHBondContact O-N 3.28Å; K184-R188 VanDerWaalsContact O-N 3.16Å; L185-R188 PolarHBondContact O-N 3.38Å; I186-R188 VanDerWaalsContact C-N 3.3Å; I186-R188 PolarHBondContact O-N 2.92Å; R188-L190 VanDerWaalsContact C-N 3.27Å; R188-L190 PolarHBondContact O-N 3.25Å; R188-Y191 CarbonylContact O-C 3.59Å; R188-Y191 WeakPolarHBondContact O-CA 3.33Å; R188-Y191 WeakPolarHBondContact O-CB 3.4Å; R188-Y191 PolarHBondContact O-N 2.98Å; R188-A192 PolarHBondContact O-N 3.45Å; R188-Y297 VanDerWaalsContact NH2-CE2 3.34Å |
| 189 | C | 75.8 | Confident | 73.5 | Confident | 33 Ų | 33 | 57.5 Ų | 57.5 | 22% | 0.223 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -58 | -40.4 | 175.5 | -173.2 | 0 | 0 | 0 | 0 | 111.7 | I170 L185 I186 Y191 A192 M193 | I170-C189 HydrophobicContact CD1-CB 4.33Å; L185-C189 PolarHBondContact O-N 3.03Å; L185-C189 VanDerWaalsContact O-N 3.08Å; I186-C189 WeakPolarHBondContact O-CB 3.35Å; I186-C189 PolarHBondContact O-N 3.39Å; C189-Y191 PolarHBondContact O-N 2.85Å; C189-A192 PolarHBondContact O-N 3.17Å; C189-M193 WeakPolarHBondContact O-CB 3.36Å; C189-M193 WeakPolarHBondContact O-CG 3.37Å; C189-M193 PolarHBondContact O-N 3.27Å |
| 190 | L | 77.2 | Confident | 73.9 | Confident | 107 Ų | 107 | 56.2 Ų | 56.2 | 56% | 0.56 | 28% | 0.277 | S | S | * | . | H | α-helix | trans | -61.5 | -39.2 | 172.3 | -71.8 | 171.9 | 0 | 0 | 0 | 112.6 | I186 R188 M193 Y194 | I186-L190 HydrophobicContact CG2-CD1 4.18Å; I186-L190 HydrophobicContact CG2-CG 4.47Å; I186-L190 WeakPolarHBondContact O-CG 3.22Å; I186-L190 PolarHBondContact O-N 3.48Å; R188-L190 VanDerWaalsContact C-N 3.27Å; R188-L190 PolarHBondContact O-N 3.25Å; L190-M193 PolarHBondContact O-N 3.37Å; L190-Y194 WeakPolarHBondContact O-CB 3.24Å; L190-Y194 PolarHBondContact O-N 3.47Å |
| 191 | Y | 74.1 | Confident | 74.4 | Confident | 17 Ų | 17 | 49.9 Ų | 49.9 | 7% | 0.067 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -64.5 | -45.5 | 172.6 | 176.7 | -94.3 | 0 | 0 | 0 | 112 | L162 L187 R188 C189 M193 Y194 V195 Y297 | L162-Y191 HydrophobicContact CD1-CD1 4.45Å; L162-Y191 HydrophobicContact CD1-CE1 3.94Å; L187-Y191 PolarHBondContact O-N 2.85Å; L187-Y191 VanDerWaalsContact O-N 3.1Å; R188-Y191 CarbonylContact O-C 3.59Å; R188-Y191 WeakPolarHBondContact O-CA 3.33Å; R188-Y191 WeakPolarHBondContact O-CB 3.4Å; R188-Y191 PolarHBondContact O-N 2.98Å; C189-Y191 PolarHBondContact O-N 2.85Å; Y191-M193 VanDerWaalsContact C-N 3.33Å; Y191-M193 PolarHBondContact O-N 2.83Å; Y191-Y194 WeakPolarHBondContact O-CB 3.42Å; Y191-Y194 PolarHBondContact O-N 2.82Å; Y191-Y194 VanDerWaalsContact O-N 3.07Å; Y191-V195 HydrophobicContact CD1-CG2 4.18Å; Y191-V195 HydrophobicContact CE1-CG2 3.72Å; Y191-V195 HydrophobicContact CE2-CG2 4.21Å; Y191-V195 WeakPolarHBondContact O-CG2 3.28Å; Y191-V195 PolarHBondContact O-N 2.87Å; Y191-Y297 WeakPolarHBondContact CD1-OH 3.3Å |
| 192 | A | 73.8 | Confident | 74.9 | Confident | 0 Ų | 0 | 47.1 Ų | 47.1 | 0% | 0 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -59.6 | -42.4 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112 | L162 L163 R188 C189 Y194 V195 L196 | L162-A192 HydrophobicContact CB-CB 3.97Å; L163-A192 HydrophobicContact CB-CB 4.22Å; L163-A192 HydrophobicContact CD1-CB 4.26Å; R188-A192 PolarHBondContact O-N 3.45Å; C189-A192 PolarHBondContact O-N 3.17Å; A192-Y194 VanDerWaalsContact C-N 3.33Å; A192-Y194 PolarHBondContact O-N 3.5Å; A192-V195 PolarHBondContact O-N 2.77Å; A192-L196 PolarHBondContact O-N 3.37Å |
| 193 | M | 76.6 | Confident | 75.2 | Confident | 80 Ų | 80 | 47.2 Ų | 47.2 | 39% | 0.394 | 24% | 0.238 | S | C | . | . | H | α-helix | trans | -64.9 | -34.7 | 173.3 | -71.6 | -62.1 | -68.6 | 0 | 0 | 112.7 | L163 C189 L190 Y191 L196 N197 | L163-M193 HydrophobicContact CD1-SD 4.25Å; L163-M193 HydrophobicContact CD2-SD 4.47Å; C189-M193 WeakPolarHBondContact O-CB 3.36Å; C189-M193 WeakPolarHBondContact O-CG 3.37Å; C189-M193 PolarHBondContact O-N 3.27Å; L190-M193 PolarHBondContact O-N 3.37Å; Y191-M193 VanDerWaalsContact C-N 3.33Å; Y191-M193 PolarHBondContact O-N 2.83Å; M193-L196 HydrophobicContact CE-CD2 4.44Å; M193-L196 WeakPolarHBondContact O-CB 3.47Å; M193-L196 PolarHBondContact O-N 3.31Å; M193-L196 HydrophobicContact SD-CD2 4.12Å; M193-N197 PolarHBondContact O-N 2.86Å; M193-N197 PolarHBondContact O-ND2 3.17Å |
| 194 | Y | 75.2 | Confident | 75.5 | Confident | 50 Ų | 50 | 44.7 Ų | 44.7 | 20% | 0.196 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -67.5 | -42.6 | 175 | -171.7 | -106 | 0 | 0 | 0 | 112 | L190 Y191 A192 L196 N197 I198 L219 I222 L223 | L190-Y194 WeakPolarHBondContact O-CB 3.24Å; L190-Y194 PolarHBondContact O-N 3.47Å; Y191-Y194 WeakPolarHBondContact O-CB 3.42Å; Y191-Y194 PolarHBondContact O-N 2.82Å; Y191-Y194 VanDerWaalsContact O-N 3.07Å; A192-Y194 VanDerWaalsContact C-N 3.33Å; A192-Y194 PolarHBondContact O-N 3.5Å; Y194-L196 VanDerWaalsContact C-N 3.33Å; Y194-L196 PolarHBondContact O-N 2.92Å; Y194-N197 WeakPolarHBondContact O-CB 3.48Å; Y194-N197 PolarHBondContact O-N 3.47Å; Y194-I198 HydrophobicContact CD1-CD1 4.13Å; Y194-I198 HydrophobicContact CE1-CD1 3.72Å; Y194-I198 PolarHBondContact O-N 3.42Å; Y194-I198 VanDerWaalsContact O-N 3.11Å; Y194-L219 HydrophobicContact CE2-CD2 4.25Å; Y194-L219 PolarHBondContact OH-O 3.27Å; Y194-I222 WeakPolarHBondContact OH-CB 3.25Å; Y194-I222 VanDerWaalsContact OH-CG2 3.22Å; Y194-I222 WeakPolarHBondContact OH-CG2 3.36Å; Y194-L223 HydrophobicContact CD1-CD1 4.09Å; Y194-L223 HydrophobicContact CE1-CB 3.85Å; Y194-L223 HydrophobicContact CE1-CD1 4.06Å; Y194-L223 HydrophobicContact CE1-CG 4.27Å |
| 195 | V | 76.1 | Confident | 75.6 | Confident | 0 Ų | 0 | 39.8 Ų | 39.8 | 0% | 0 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -62.2 | -39.6 | 173 | 174.8 | 0 | 0 | 0 | 0 | 111.4 | V158 A159 L162 Y191 A192 N197 I198 G199 L223 H304 | V158-V195 HydrophobicContact CG1-CG1 4.46Å; A159-V195 HydrophobicContact CB-CB 4.47Å; A159-V195 HydrophobicContact CB-CG1 3.91Å; L162-V195 HydrophobicContact CD1-CB 4.34Å; L162-V195 HydrophobicContact CD1-CG1 4.18Å; L162-V195 HydrophobicContact CD1-CG2 4.17Å; Y191-V195 HydrophobicContact CD1-CG2 4.18Å; Y191-V195 HydrophobicContact CE1-CG2 3.72Å; Y191-V195 HydrophobicContact CE2-CG2 4.21Å; Y191-V195 WeakPolarHBondContact O-CG2 3.28Å; Y191-V195 PolarHBondContact O-N 2.87Å; A192-V195 PolarHBondContact O-N 2.77Å; V195-N197 PolarHBondContact O-N 2.9Å; V195-I198 PolarHBondContact O-N 2.92Å; V195-G199 PolarHBondContact O-N 3.08Å; V195-L223 HydrophobicContact CG2-CD1 4.18Å; V195-H304 VanDerWaalsContact CG1-NE2 3.3Å; V195-H304 WeakPolarHBondContact CG1-NE2 3.22Å |
| 196 | L | 80.3 | Confident | 75.5 | Confident | 43 Ų | 43 | 39.5 Ų | 39.5 | 23% | 0.225 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -59.6 | -43.5 | 173 | -174.6 | 65.8 | 0 | 0 | 0 | 112.1 | L156 A159 A192 M193 Y194 I198 G199 I200 | L156-L196 HydrophobicContact CD1-CD1 3.93Å; A159-L196 HydrophobicContact CB-CB 3.88Å; A159-L196 HydrophobicContact CB-CD1 3.87Å; A192-L196 PolarHBondContact O-N 3.37Å; M193-L196 HydrophobicContact CE-CD2 4.44Å; M193-L196 WeakPolarHBondContact O-CB 3.47Å; M193-L196 PolarHBondContact O-N 3.31Å; M193-L196 HydrophobicContact SD-CD2 4.12Å; Y194-L196 VanDerWaalsContact C-N 3.33Å; Y194-L196 PolarHBondContact O-N 2.92Å; L196-I198 VanDerWaalsContact C-N 3.33Å; L196-I198 PolarHBondContact O-N 2.89Å; L196-G199 PolarHBondContact O-N 3.16Å; L196-G199 VanDerWaalsContact O-N 3.16Å; L196-I200 HydrophobicContact CG-CD1 4.12Å; L196-I200 WeakPolarHBondContact O-CG1 3.3Å; L196-I200 PolarHBondContact O-N 3.16Å |
| 197 | N | 77.6 | Confident | 75.3 | Confident | 79 Ų | 79 | 40.2 Ų | 40.2 | 42% | 0.422 | 21% | 0.213 | S | C | . | . | H | α-helix | trans | -62.1 | -38.3 | 176.4 | -83.6 | -80.6 | 0 | 0 | 0 | 112.4 | M193 Y194 V195 I200 V201 | M193-N197 PolarHBondContact O-N 2.86Å; M193-N197 PolarHBondContact O-ND2 3.17Å; Y194-N197 WeakPolarHBondContact O-CB 3.48Å; Y194-N197 PolarHBondContact O-N 3.47Å; V195-N197 PolarHBondContact O-N 2.9Å; N197-I200 PolarHBondContact O-N 3.44Å; N197-V201 WeakPolarHBondContact O-CG2 3.35Å; N197-V201 PolarHBondContact O-N 2.81Å |
| 198 | I | 77.2 | Confident | 75.1 | Confident | 0 Ų | 0 | 43.6 Ų | 43.6 | 0% | 0 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -64 | -40.9 | 173.3 | -70.2 | 169.3 | 0 | 0 | 0 | 111.1 | Y194 V195 L196 V201 S202 L216 L219 L223 | Y194-I198 HydrophobicContact CD1-CD1 4.13Å; Y194-I198 HydrophobicContact CE1-CD1 3.72Å; Y194-I198 PolarHBondContact O-N 3.42Å; Y194-I198 VanDerWaalsContact O-N 3.11Å; V195-I198 PolarHBondContact O-N 2.92Å; L196-I198 VanDerWaalsContact C-N 3.33Å; L196-I198 PolarHBondContact O-N 2.89Å; I198-V201 PolarHBondContact O-N 3.28Å; I198-S202 VanDerWaalsContact O-CB 3.26Å; I198-S202 WeakPolarHBondContact O-CB 3.47Å; I198-S202 PolarHBondContact O-N 3.04Å; I198-S202 PolarHBondContact O-OG 2.96Å; I198-L216 HydrophobicContact CG2-CD1 4.45Å; I198-L219 HydrophobicContact CG1-CB 4.2Å; I198-L223 HydrophobicContact CD1-CB 3.95Å; I198-L223 HydrophobicContact CD1-CD1 3.35Å; I198-L223 HydrophobicContact CD1-CG 4.28Å |
| 199 | G | 76.3 | Confident | 74.6 | Confident | 0 Ų | 0 | 50.9 Ų | 50.9 | 0% | 0 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -57.6 | -49.9 | 171.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | V195 L196 S202 I203 | V195-G199 PolarHBondContact O-N 3.08Å; L196-G199 PolarHBondContact O-N 3.16Å; L196-G199 VanDerWaalsContact O-N 3.16Å; G199-S202 WeakPolarHBondContact O-CB 3.47Å; G199-S202 PolarHBondContact O-N 3.08Å; G199-I203 WeakPolarHBondContact O-CG1 3.43Å; G199-I203 PolarHBondContact O-N 3.33Å |
| 200 | I | 78.9 | Confident | 74 | Confident | 74 Ų | 74 | 56.7 Ų | 56.7 | 38% | 0.379 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -60.7 | -48 | 178.2 | -66.4 | 165.3 | 0 | 0 | 0 | 111.3 | L196 N197 S202 I203 L204 | L196-I200 HydrophobicContact CG-CD1 4.12Å; L196-I200 WeakPolarHBondContact O-CG1 3.3Å; L196-I200 PolarHBondContact O-N 3.16Å; N197-I200 PolarHBondContact O-N 3.44Å; I200-S202 VanDerWaalsContact C-N 3.3Å; I200-S202 PolarHBondContact O-N 3.25Å; I200-I203 PolarHBondContact O-N 3.28Å; I200-L204 HydrophobicContact CG2-CD1 4.07Å; I200-L204 HydrophobicContact CG2-CG 4.49Å; I200-L204 WeakPolarHBondContact O-CG 3.3Å; I200-L204 PolarHBondContact O-N 3.3Å |
| 201 | V | 78.6 | Confident | 73.5 | Confident | 25 Ų | 25 | 62.1 Ų | 62.1 | 15% | 0.152 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -66.8 | -32.8 | 179.4 | 175.3 | 0 | 0 | 0 | 0 | 111.6 | N197 I198 L204 A205 A212 V215 L216 L219 | N197-V201 WeakPolarHBondContact O-CG2 3.35Å; N197-V201 PolarHBondContact O-N 2.81Å; I198-V201 PolarHBondContact O-N 3.28Å; V201-L204 PolarHBondContact O-N 2.87Å; V201-A205 WeakPolarHBondContact O-CB 3.49Å; V201-A205 PolarHBondContact O-N 3.45Å; V201-A212 HydrophobicContact CG1-CB 4.49Å; V201-V215 HydrophobicContact CG1-CG1 4.47Å; V201-L216 HydrophobicContact CG1-CB 4.35Å; V201-L219 HydrophobicContact CB-CD1 3.9Å; V201-L219 HydrophobicContact CG1-CD1 3.84Å; V201-L219 HydrophobicContact CG2-CD1 3.77Å |
| 202 | S | 75.4 | Confident | 72.9 | Confident | 1 Ų | 1 | 62 Ų | 62 | 1% | 0.007 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -65.2 | -38.8 | 172.4 | -59.3 | 0 | 0 | 0 | 0 | 112.2 | A152 I198 G199 I200 A206 L216 | A152-S202 VanDerWaalsContact CB-CB 3.46Å; I198-S202 VanDerWaalsContact O-CB 3.26Å; I198-S202 WeakPolarHBondContact O-CB 3.47Å; I198-S202 PolarHBondContact O-N 3.04Å; I198-S202 PolarHBondContact O-OG 2.96Å; G199-S202 WeakPolarHBondContact O-CB 3.47Å; G199-S202 PolarHBondContact O-N 3.08Å; I200-S202 VanDerWaalsContact C-N 3.3Å; I200-S202 PolarHBondContact O-N 3.25Å; S202-A206 PolarHBondContact O-N 2.99Å; S202-L216 WeakPolarHBondContact OG-CD1 3.25Å |
| 203 | I | 77.5 | Confident | 72.6 | Confident | 57 Ų | 57 | 63.6 Ų | 63.6 | 29% | 0.292 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -65.1 | -45.2 | 171.5 | -64.2 | 173.3 | 0 | 0 | 0 | 110.3 | A152 L156 G199 I200 A205 A206 V207 | A152-I203 HydrophobicContact CB-CG1 3.76Å; L156-I203 HydrophobicContact CD1-CD1 4.38Å; G199-I203 WeakPolarHBondContact O-CG1 3.43Å; G199-I203 PolarHBondContact O-N 3.33Å; I200-I203 PolarHBondContact O-N 3.28Å; I203-A205 VanDerWaalsContact C-N 3.32Å; I203-A205 PolarHBondContact O-N 3.42Å; I203-A206 WeakPolarHBondContact O-CB 3.31Å; I203-A206 PolarHBondContact O-N 2.71Å; I203-A206 VanDerWaalsContact O-N 3.1Å; I203-V207 HydrophobicContact CG2-CG2 4.43Å; I203-V207 WeakPolarHBondContact O-CG2 3.47Å; I203-V207 PolarHBondContact O-N 3.28Å |
| 204 | L | 77.4 | Confident | 72.3 | Confident | 65 Ų | 65 | 66.6 Ų | 66.6 | 34% | 0.34 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -63.4 | -35.3 | 178.1 | -69.4 | 171.7 | 0 | 0 | 0 | 113 | I200 V201 V207 A212 | I200-L204 HydrophobicContact CG2-CD1 4.07Å; I200-L204 HydrophobicContact CG2-CG 4.49Å; I200-L204 WeakPolarHBondContact O-CG 3.3Å; I200-L204 PolarHBondContact O-N 3.3Å; V201-L204 PolarHBondContact O-N 2.87Å; L204-V207 PolarHBondContact O-N 2.82Å; L204-A212 HydrophobicContact CB-CB 4.19Å |
| 205 | A | 71 | Confident | 72.1 | Confident | 11 Ų | 11 | 67.4 Ų | 67.4 | 9% | 0.091 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -68.4 | -34.8 | 172.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | V201 I203 A212 L216 | V201-A205 WeakPolarHBondContact O-CB 3.49Å; V201-A205 PolarHBondContact O-N 3.45Å; I203-A205 VanDerWaalsContact C-N 3.32Å; I203-A205 PolarHBondContact O-N 3.42Å; A205-A212 HydrophobicContact CB-CB 4.1Å; A205-L216 HydrophobicContact CB-CD2 4.23Å |
| 206 | A | 69.2 | Low | 72 | Confident | 5 Ų | 5 | 67.4 Ų | 67.4 | 4% | 0.041 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -63.9 | -45 | 170.1 | 0 | 0 | 0 | 0 | 0 | 111.2 | Y145 I148 S202 I203 Q208 | Y145-A206 HydrophobicContact CD2-CB 4.16Å; Y145-A206 VanDerWaalsContact CD2-O 3.27Å; Y145-A206 WeakPolarHBondContact CD2-O 3.27Å; Y145-A206 HydrophobicContact CE2-CB 3.89Å; Y145-A206 WeakPolarHBondContact CE2-O 3.46Å; I148-A206 HydrophobicContact CG2-CB 4.04Å; S202-A206 PolarHBondContact O-N 2.99Å; I203-A206 WeakPolarHBondContact O-CB 3.31Å; I203-A206 PolarHBondContact O-N 2.71Å; I203-A206 VanDerWaalsContact O-N 3.1Å; A206-Q208 PolarHBondContact O-N 3.39Å |
| 207 | V | 71.1 | Confident | 71.7 | Confident | 92 Ų | 92 | 66 Ų | 66 | 56% | 0.558 | 31% | 0.313 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -74.6 | 35.3 | -179.3 | -172 | 0 | 0 | 0 | 0 | 112.6 | I203 L204 R209 | I203-V207 HydrophobicContact CG2-CG2 4.43Å; I203-V207 WeakPolarHBondContact O-CG2 3.47Å; I203-V207 PolarHBondContact O-N 3.28Å; L204-V207 PolarHBondContact O-N 2.82Å; V207-R209 PolarHBondContact O-N 2.86Å |
| 208 | Q | 64.4 | Low | 71.7 | Confident | 156 Ų | 156 | 67.2 Ų | 67.2 | 73% | 0.729 | 32% | 0.319 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 57.6 | 19.2 | 166.7 | -61 | -175 | -22.5 | 0 | 0 | 116.8 | A206 E210 | A206-Q208 PolarHBondContact O-N 3.39Å; Q208-E210 PolarHBondContact O-N 2.86Å |
| 209 | R | 62.1 | Low | 71.6 | Confident | 173 Ų | 173 | 68.8 Ų | 68.8 | 65% | 0.653 | 33% | 0.327 | S | S | * | . | trans | -75.7 | 94.3 | 164 | -71.7 | -171.7 | 174.1 | -170.4 | -1.1 | 108.8 | V207 R211 A212 | V207-R209 PolarHBondContact O-N 2.86Å; R209-R211 PolarHBondContact O-N 3.35Å; R209-A212 HydrophobicContact CB-CB 4.2Å; R209-A212 WeakPolarHBondContact O-CB 3.5Å; R209-A212 PolarHBondContact O-N 3.47Å | ||
| 210 | E | 64.1 | Low | 71.6 | Confident | 156 Ų | 156 | 68.8 Ų | 68.8 | 73% | 0.729 | 33% | 0.327 | S | S | * | . | H | α-helix | trans | -47.1 | -39.9 | 179.5 | -61.9 | -171.3 | 157.4 | 0 | 0 | 112.8 | Q208 A212 L213 Y214 | Q208-E210 PolarHBondContact O-N 2.86Å; E210-A212 VanDerWaalsContact C-N 3.28Å; E210-A212 PolarHBondContact O-N 2.94Å; E210-L213 WeakPolarHBondContact O-CB 3.32Å; E210-L213 PolarHBondContact O-N 3.32Å; E210-L213 VanDerWaalsContact O-N 3.08Å; E210-Y214 VanDerWaalsContact O-CD2 3.25Å; E210-Y214 WeakPolarHBondContact O-CD2 3.24Å |
| 211 | R | 67 | Low | 71.5 | Confident | 221 Ų | 221 | 69.5 Ų | 69.5 | 83% | 0.834 | 33% | 0.33 | S | S | * | . | H | α-helix | trans | -56.3 | -38.1 | 176 | -61.6 | -174.7 | -176.9 | -172.9 | 0.8 | 113 | R209 L213 Y214 V215 | R209-R211 PolarHBondContact O-N 3.35Å; R211-L213 VanDerWaalsContact C-N 3.31Å; R211-L213 PolarHBondContact O-N 2.94Å; R211-Y214 PolarHBondContact O-N 3.37Å; R211-V215 WeakPolarHBondContact O-CG2 3.46Å; R211-V215 PolarHBondContact O-N 2.94Å |
| 212 | A | 61.8 | Low | 71.4 | Confident | 13 Ų | 13 | 71.5 Ų | 71.5 | 11% | 0.107 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -68.7 | -29.1 | 178.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | V201 L204 A205 R209 E210 Y214 V215 L216 | V201-A212 HydrophobicContact CG1-CB 4.49Å; L204-A212 HydrophobicContact CB-CB 4.19Å; A205-A212 HydrophobicContact CB-CB 4.1Å; R209-A212 HydrophobicContact CB-CB 4.2Å; R209-A212 WeakPolarHBondContact O-CB 3.5Å; R209-A212 PolarHBondContact O-N 3.47Å; E210-A212 VanDerWaalsContact C-N 3.28Å; E210-A212 PolarHBondContact O-N 2.94Å; A212-Y214 VanDerWaalsContact C-N 3.28Å; A212-Y214 PolarHBondContact O-N 3.43Å; A212-V215 PolarHBondContact O-N 3.21Å; A212-L216 WeakPolarHBondContact O-CB 3.46Å; A212-L216 PolarHBondContact O-N 2.97Å |
| 213 | L | 66.4 | Low | 71.2 | Confident | 34 Ų | 34 | 71.5 Ų | 71.5 | 18% | 0.178 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -67.6 | -27.7 | 175.5 | -167.4 | 70.7 | 0 | 0 | 0 | 112.5 | E210 R211 P217 V315 I318 | E210-L213 WeakPolarHBondContact O-CB 3.32Å; E210-L213 PolarHBondContact O-N 3.32Å; E210-L213 VanDerWaalsContact O-N 3.08Å; R211-L213 VanDerWaalsContact C-N 3.31Å; R211-L213 PolarHBondContact O-N 2.94Å; L213-P217 WeakPolarHBondContact O-CD 3.35Å; L213-V315 HydrophobicContact CD1-CG1 3.94Å; L213-V315 HydrophobicContact CD1-CG2 4.35Å; L213-V315 HydrophobicContact CG-CG1 4.27Å; L213-I318 HydrophobicContact CD2-CG2 4.07Å |
| 214 | Y | 70.2 | Confident | 71 | Confident | 143 Ų | 143 | 70.7 Ų | 70.7 | 56% | 0.561 | 34% | 0.336 | S | S | * | . | H | α-helix | trans | -81.4 | -30.8 | 172.9 | -65.1 | -74.5 | 0 | 0 | 0 | 113.1 | E210 R211 A212 P217 | E210-Y214 VanDerWaalsContact O-CD2 3.25Å; E210-Y214 WeakPolarHBondContact O-CD2 3.24Å; R211-Y214 PolarHBondContact O-N 3.37Å; A212-Y214 VanDerWaalsContact C-N 3.28Å; A212-Y214 PolarHBondContact O-N 3.43Å; Y214-P217 WeakPolarHBondContact O-CD 3.49Å |
| 215 | V | 72.1 | Confident | 70.7 | Confident | 67 Ų | 67 | 69.3 Ų | 69.3 | 41% | 0.406 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -75.8 | -33.2 | 177.7 | 175.2 | 0 | 0 | 0 | 0 | 112 | V201 R211 A212 L218 L219 | V201-V215 HydrophobicContact CG1-CG1 4.47Å; R211-V215 WeakPolarHBondContact O-CG2 3.46Å; R211-V215 PolarHBondContact O-N 2.94Å; A212-V215 PolarHBondContact O-N 3.21Å; V215-L218 WeakPolarHBondContact O-CB 3.46Å; V215-L218 PolarHBondContact O-N 3.23Å; V215-L218 VanDerWaalsContact O-N 3.13Å; V215-L219 HydrophobicContact CG1-CD1 3.82Å; V215-L219 HydrophobicContact CG1-CG 4.09Å; V215-L219 PolarHBondContact O-N 3.27Å |
| 216 | L | 72.9 | Confident | 70.5 | Confident | 1 Ų | 1 | 72.5 Ų | 72.5 | 1% | 0.005 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -58.4 | -44.6 | -178.7 | -179 | 61.2 | 0 | 0 | 0 | 113.3 | I198 V201 S202 A205 A212 L218 L219 C220 T311 M312 V315 | I198-L216 HydrophobicContact CG2-CD1 4.45Å; V201-L216 HydrophobicContact CG1-CB 4.35Å; S202-L216 WeakPolarHBondContact OG-CD1 3.25Å; A205-L216 HydrophobicContact CB-CD2 4.23Å; A212-L216 WeakPolarHBondContact O-CB 3.46Å; A212-L216 PolarHBondContact O-N 2.97Å; L216-L218 PolarHBondContact O-N 3.31Å; L216-L219 PolarHBondContact O-N 2.88Å; L216-C220 PolarHBondContact O-N 3.49Å; L216-C220 PolarHBondContact O-SG 3.27Å; L216-T311 HydrophobicContact CD2-CG2 4.28Å; L216-M312 HydrophobicContact CG-CE 4.39Å; L216-V315 HydrophobicContact CD2-CG2 3.82Å; L216-V315 HydrophobicContact CG-CG2 4.47Å |
| 217 | P | 73.9 | Confident | 70.4 | Confident | 12 Ų | 12 | 74.3 Ų | 74.3 | 8% | 0.078 | 36% | 0.356 | C | S | . | . | H | α-helix | trans | -53.3 | -46.6 | 169.6 | -30.9 | 36.8 | 0 | 0 | 0 | 114.7 | L213 Y214 C220 I221 M312 V315 F316 I319 | L213-P217 WeakPolarHBondContact O-CD 3.35Å; Y214-P217 WeakPolarHBondContact O-CD 3.49Å; P217-C220 PolarHBondContact O-N 2.94Å; P217-I221 WeakPolarHBondContact O-CB 3.4Å; P217-I221 WeakPolarHBondContact O-CD1 3.28Å; P217-I221 VanDerWaalsContact O-CG1 3.24Å; P217-I221 WeakPolarHBondContact O-CG1 3.4Å; P217-I221 PolarHBondContact O-N 2.86Å; P217-M312 VanDerWaalsContact CA-SD 3.58Å; P217-M312 HydrophobicContact CB-CE 4.4Å; P217-M312 HydrophobicContact CB-SD 4.23Å; P217-M312 HydrophobicContact CG-CE 4.44Å; P217-V315 HydrophobicContact CG-CG1 3.63Å; P217-F316 HydrophobicContact CB-CE1 4.46Å; P217-F316 HydrophobicContact CB-CZ 4.23Å; P217-I319 HydrophobicContact CG-CD1 4.14Å |
| 218 | L | 78.9 | Confident | 70.2 | Confident | 106 Ų | 106 | 76.1 Ų | 76.1 | 56% | 0.555 | 36% | 0.362 | S | S | * | . | H | α-helix | trans | -63.1 | -45.8 | -178.9 | -173.3 | 68.7 | 0 | 0 | 0 | 111.2 | V215 L216 C220 I221 I222 | V215-L218 WeakPolarHBondContact O-CB 3.46Å; V215-L218 PolarHBondContact O-N 3.23Å; V215-L218 VanDerWaalsContact O-N 3.13Å; L216-L218 PolarHBondContact O-N 3.31Å; L218-C220 PolarHBondContact O-N 2.92Å; L218-I221 PolarHBondContact O-N 3.44Å; L218-I222 HydrophobicContact CD1-CD1 4.47Å; L218-I222 HydrophobicContact CG-CD1 4Å; L218-I222 WeakPolarHBondContact O-CD1 3.31Å; L218-I222 VanDerWaalsContact O-CG1 3.25Å; L218-I222 WeakPolarHBondContact O-CG1 3.42Å; L218-I222 PolarHBondContact O-N 3.2Å |
| 219 | L | 75 | Confident | 70 | Confident | 32 Ų | 32 | 75.3 Ų | 75.3 | 17% | 0.168 | 36% | 0.362 | C | S | . | . | H | α-helix | trans | -62.1 | -43 | 177.5 | -72.7 | 170.5 | 0 | 0 | 0 | 112.6 | Y194 I198 V201 V215 L216 I222 L223 | Y194-L219 HydrophobicContact CE2-CD2 4.25Å; Y194-L219 PolarHBondContact OH-O 3.27Å; I198-L219 HydrophobicContact CG1-CB 4.2Å; V201-L219 HydrophobicContact CB-CD1 3.9Å; V201-L219 HydrophobicContact CG1-CD1 3.84Å; V201-L219 HydrophobicContact CG2-CD1 3.77Å; V215-L219 HydrophobicContact CG1-CD1 3.82Å; V215-L219 HydrophobicContact CG1-CG 4.09Å; V215-L219 PolarHBondContact O-N 3.27Å; L216-L219 PolarHBondContact O-N 2.88Å; L219-I222 PolarHBondContact O-N 2.88Å; L219-L223 PolarHBondContact O-N 3.38Å |
| 220 | C | 76.2 | Confident | 69.7 | Low | 0 Ų | 0 | 68.6 Ų | 68.6 | 0% | 0 | 34% | 0.343 | C | S | . | . | H | α-helix | trans | -71.8 | -33 | 178.7 | -66.9 | 0 | 0 | 0 | 0 | 112.6 | L216 P217 L218 L223 I224 T308 M312 | L216-C220 PolarHBondContact O-N 3.49Å; L216-C220 PolarHBondContact O-SG 3.27Å; P217-C220 PolarHBondContact O-N 2.94Å; L218-C220 PolarHBondContact O-N 2.92Å; C220-L223 PolarHBondContact O-N 2.95Å; C220-I224 WeakPolarHBondContact O-CD1 3.39Å; C220-I224 VanDerWaalsContact O-CG1 3.25Å; C220-I224 WeakPolarHBondContact O-CG1 3.25Å; C220-I224 PolarHBondContact O-N 2.92Å; C220-T308 HydrophobicContact CB-CG2 3.6Å; C220-M312 HydrophobicContact CB-CE 3.35Å; C220-M312 HydrophobicContact CB-CG 3.64Å; C220-M312 HydrophobicContact CB-SD 3.4Å; C220-M312 WeakPolarHBondContact CB-SD 3.45Å; C220-M312 VanDerWaalsContact SG-CE 3.54Å |
| 221 | I | 77.7 | Confident | 69 | Low | 89 Ų | 89 | 63.8 Ų | 63.8 | 46% | 0.456 | 33% | 0.325 | S | S | . | . | H | α-helix | trans | -63.4 | -43.7 | 170.3 | -70.4 | 164.8 | 0 | 0 | 0 | 110.2 | P217 L218 L223 I224 A225 | P217-I221 WeakPolarHBondContact O-CB 3.4Å; P217-I221 WeakPolarHBondContact O-CD1 3.28Å; P217-I221 VanDerWaalsContact O-CG1 3.24Å; P217-I221 WeakPolarHBondContact O-CG1 3.4Å; P217-I221 PolarHBondContact O-N 2.86Å; L218-I221 PolarHBondContact O-N 3.44Å; I221-L223 VanDerWaalsContact C-N 3.32Å; I221-L223 PolarHBondContact O-N 2.98Å; I221-I224 PolarHBondContact O-N 3.41Å; I221-A225 VanDerWaalsContact O-CB 3.27Å; I221-A225 WeakPolarHBondContact O-CB 3.45Å; I221-A225 PolarHBondContact O-N 3Å |
| 222 | I | 76.3 | Confident | 68 | Low | 67 Ų | 67 | 61.8 Ų | 61.8 | 34% | 0.344 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -63.3 | -37.7 | 174.7 | -66.9 | 163.1 | 0 | 0 | 0 | 110.9 | Y194 L218 L219 A225 N226 | Y194-I222 WeakPolarHBondContact OH-CB 3.25Å; Y194-I222 VanDerWaalsContact OH-CG2 3.22Å; Y194-I222 WeakPolarHBondContact OH-CG2 3.36Å; L218-I222 HydrophobicContact CD1-CD1 4.47Å; L218-I222 HydrophobicContact CG-CD1 4Å; L218-I222 WeakPolarHBondContact O-CD1 3.31Å; L218-I222 VanDerWaalsContact O-CG1 3.25Å; L218-I222 WeakPolarHBondContact O-CG1 3.42Å; L218-I222 PolarHBondContact O-N 3.2Å; L219-I222 PolarHBondContact O-N 2.88Å; I222-A225 PolarHBondContact O-N 2.71Å; I222-N226 VanDerWaalsContact O-CB 3.3Å; I222-N226 WeakPolarHBondContact O-CB 3.4Å; I222-N226 PolarHBondContact O-N 3.42Å; I222-N226 PolarHBondContact O-ND2 3.29Å |
| 223 | L | 71.3 | Confident | 67.5 | Low | 1 Ų | 1 | 63.3 Ų | 63.3 | 1% | 0.005 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -61.7 | -49.3 | 173.1 | -169.3 | 137.2 | 0 | 0 | 0 | 112 | Y194 V195 I198 L219 C220 I221 A225 N226 F227 L305 T308 | Y194-L223 HydrophobicContact CD1-CD1 4.09Å; Y194-L223 HydrophobicContact CE1-CB 3.85Å; Y194-L223 HydrophobicContact CE1-CD1 4.06Å; Y194-L223 HydrophobicContact CE1-CG 4.27Å; V195-L223 HydrophobicContact CG2-CD1 4.18Å; I198-L223 HydrophobicContact CD1-CB 3.95Å; I198-L223 HydrophobicContact CD1-CD1 3.35Å; I198-L223 HydrophobicContact CD1-CG 4.28Å; L219-L223 PolarHBondContact O-N 3.38Å; C220-L223 PolarHBondContact O-N 2.95Å; I221-L223 VanDerWaalsContact C-N 3.32Å; I221-L223 PolarHBondContact O-N 2.98Å; L223-A225 VanDerWaalsContact C-N 3.33Å; L223-N226 PolarHBondContact O-N 3.36Å; L223-F227 WeakPolarHBondContact O-CB 3.4Å; L223-F227 PolarHBondContact O-N 3.1Å; L223-L305 HydrophobicContact CD2-CD1 4.31Å; L223-T308 HydrophobicContact CD2-CG2 4.19Å |
| 224 | I | 71.5 | Confident | 66.8 | Low | 41 Ų | 41 | 63.2 Ų | 63.2 | 21% | 0.21 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -63.5 | -43.2 | -179.4 | -67.5 | 162.2 | 0 | 0 | 0 | 109.6 | C220 I221 F227 L228 L305 I309 M312 | C220-I224 WeakPolarHBondContact O-CD1 3.39Å; C220-I224 VanDerWaalsContact O-CG1 3.25Å; C220-I224 WeakPolarHBondContact O-CG1 3.25Å; C220-I224 PolarHBondContact O-N 2.92Å; I221-I224 PolarHBondContact O-N 3.41Å; I224-F227 PolarHBondContact O-N 2.96Å; I224-L228 HydrophobicContact CG2-CD1 3.83Å; I224-L228 HydrophobicContact CG2-CG 4.4Å; I224-L228 WeakPolarHBondContact O-CB 3.49Å; I224-L228 VanDerWaalsContact O-CG 3.24Å; I224-L228 WeakPolarHBondContact O-CG 3.48Å; I224-L228 PolarHBondContact O-N 3.03Å; I224-L305 HydrophobicContact CG1-CD1 3.99Å; I224-I309 HydrophobicContact CD1-CG1 4.1Å; I224-M312 HydrophobicContact CD1-CG 4.49Å |
| 225 | A | 71.2 | Confident | 65.7 | Low | 36 Ų | 36 | 57.5 Ų | 57.5 | 30% | 0.298 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -60 | -47.8 | 174.5 | 0 | 0 | 0 | 0 | 0 | 111.5 | I221 I222 L223 F227 L228 L229 | I221-A225 VanDerWaalsContact O-CB 3.27Å; I221-A225 WeakPolarHBondContact O-CB 3.45Å; I221-A225 PolarHBondContact O-N 3Å; I222-A225 PolarHBondContact O-N 2.71Å; L223-A225 VanDerWaalsContact C-N 3.33Å; A225-F227 VanDerWaalsContact C-N 3.34Å; A225-F227 PolarHBondContact O-N 3.4Å; A225-L228 PolarHBondContact O-N 3.05Å; A225-L229 HydrophobicContact CB-CD1 4.3Å; A225-L229 WeakPolarHBondContact O-CB 3.37Å; A225-L229 WeakPolarHBondContact O-CD1 3.25Å; A225-L229 VanDerWaalsContact O-CG 3.25Å; A225-L229 WeakPolarHBondContact O-CG 3.42Å; A225-L229 PolarHBondContact O-N 3.45Å |
| 226 | N | 68.4 | Low | 64.3 | Low | 78 Ų | 78 | 55.6 Ų | 55.6 | 42% | 0.417 | 30% | 0.295 | S | S | . | . | H | α-helix | trans | -62.3 | -39.4 | 176.7 | -74 | -18.5 | 0 | 0 | 0 | 112.2 | I222 L223 L228 A230 | I222-N226 VanDerWaalsContact O-CB 3.3Å; I222-N226 WeakPolarHBondContact O-CB 3.4Å; I222-N226 PolarHBondContact O-N 3.42Å; I222-N226 PolarHBondContact O-ND2 3.29Å; L223-N226 PolarHBondContact O-N 3.36Å; N226-L228 VanDerWaalsContact C-N 3.34Å; N226-A230 WeakPolarHBondContact O-CA 3.41Å; N226-A230 VanDerWaalsContact O-CB 3.3Å; N226-A230 WeakPolarHBondContact O-CB 3.33Å; N226-A230 PolarHBondContact O-N 3.19Å |
| 227 | F | 66.8 | Low | 63 | Low | 43 Ų | 43 | 59.4 Ų | 59.4 | 19% | 0.189 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -65.6 | -36.8 | 176.4 | -167.9 | -84.7 | 0 | 0 | 0 | 112.1 | L223 I224 A225 L302 L305 | L223-F227 WeakPolarHBondContact O-CB 3.4Å; L223-F227 PolarHBondContact O-N 3.1Å; I224-F227 PolarHBondContact O-N 2.96Å; A225-F227 VanDerWaalsContact C-N 3.34Å; A225-F227 PolarHBondContact O-N 3.4Å; F227-L302 HydrophobicContact CZ-CD2 4.03Å; F227-L305 HydrophobicContact CB-CD1 4.43Å; F227-L305 HydrophobicContact CD1-CD1 4.29Å; F227-L305 HydrophobicContact CD1-CD2 3.83Å; F227-L305 HydrophobicContact CE1-CD2 3.67Å; F227-L305 HydrophobicContact CG-CD1 4.23Å; F227-L305 HydrophobicContact CG-CD2 4.46Å; F227-L305 HydrophobicContact CZ-CD2 4.16Å |
| 228 | L | 65.9 | Low | 61.9 | Low | 130 Ų | 130 | 63.5 Ų | 63.5 | 68% | 0.681 | 34% | 0.337 | S | S | * | . | H | α-helix | trans | -79.9 | -34.8 | 177.8 | -68.3 | 172.5 | 0 | 0 | 0 | 113.5 | I224 A225 N226 | I224-L228 HydrophobicContact CG2-CD1 3.83Å; I224-L228 HydrophobicContact CG2-CG 4.4Å; I224-L228 WeakPolarHBondContact O-CB 3.49Å; I224-L228 VanDerWaalsContact O-CG 3.24Å; I224-L228 WeakPolarHBondContact O-CG 3.48Å; I224-L228 PolarHBondContact O-N 3.03Å; A225-L228 PolarHBondContact O-N 3.05Å; N226-L228 VanDerWaalsContact C-N 3.34Å |
| 229 | L | 60.1 | Low | 60.5 | Low | 138 Ų | 138 | 59.2 Ų | 59.2 | 72% | 0.723 | 32% | 0.316 | S | S | * | . | H | α-helix | trans | -80 | -28.7 | 178.7 | -74.7 | 162.5 | 0 | 0 | 0 | 112.4 | A225 P231 | A225-L229 HydrophobicContact CB-CD1 4.3Å; A225-L229 WeakPolarHBondContact O-CB 3.37Å; A225-L229 WeakPolarHBondContact O-CD1 3.25Å; A225-L229 VanDerWaalsContact O-CG 3.25Å; A225-L229 WeakPolarHBondContact O-CG 3.42Å; A225-L229 PolarHBondContact O-N 3.45Å; L229-P231 VanDerWaalsContact O-CD 3.32Å; L229-P231 WeakPolarHBondContact O-CD 3.39Å |
| 230 | A | 55.7 | Low | 59.3 | Low | 32 Ų | 32 | 61.6 Ų | 61.6 | 26% | 0.264 | 33% | 0.328 | S | S | . | . | trans | -118.4 | 64.2 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | N226 F232 Q233 | N226-A230 WeakPolarHBondContact O-CA 3.41Å; N226-A230 VanDerWaalsContact O-CB 3.3Å; N226-A230 WeakPolarHBondContact O-CB 3.33Å; N226-A230 PolarHBondContact O-N 3.19Å; A230-F232 PolarHBondContact O-N 3.43Å; A230-Q233 HydrophobicContact CB-CG 4.27Å; A230-Q233 PolarHBondContact O-N 3.43Å | ||
| 231 | P | 50.7 | Low | 58.2 | Low | 55 Ų | 55 | 65.7 Ų | 65.7 | 36% | 0.357 | 35% | 0.353 | S | S | . | . | G | 310 helix | trans | -58.3 | -18.8 | 164.3 | 29.2 | -34.8 | 0 | 0 | 0 | 110.9 | L229 Q233 L234 | L229-P231 VanDerWaalsContact O-CD 3.32Å; L229-P231 WeakPolarHBondContact O-CD 3.39Å; P231-Q233 PolarHBondContact O-N 3.12Å; P231-L234 VanDerWaalsContact O-CB 3.3Å; P231-L234 WeakPolarHBondContact O-CB 3.43Å; P231-L234 PolarHBondContact O-N 3.28Å |
| 232 | F | 45.7 | Very low | 56.9 | Low | 180 Ų | 180 | 65.4 Ų | 65.4 | 79% | 0.789 | 35% | 0.349 | S | S | * | . | G | 310 helix | trans | -64.6 | -10.2 | 171.1 | -58.4 | -76.5 | 0 | 0 | 0 | 115.4 | A230 L234 | A230-F232 PolarHBondContact O-N 3.43Å; F232-L234 PolarHBondContact O-N 2.82Å |
| 233 | Q | 51.3 | Low | 55.6 | Low | 44 Ų | 44 | 64.4 Ų | 64.4 | 21% | 0.206 | 34% | 0.344 | C | S | . | . | G | 310 helix | trans | -79 | -0.4 | 164.4 | -74 | -164.6 | -7.5 | 0 | 0 | 113.5 | L187 A230 P231 P235 | L187-Q233 HydrophobicContact CD2-CG 4.44Å; A230-Q233 HydrophobicContact CB-CG 4.27Å; A230-Q233 PolarHBondContact O-N 3.43Å; P231-Q233 PolarHBondContact O-N 3.12Å; Q233-P235 WeakPolarHBondContact O-CD 3.46Å |
| 234 | L | 50.4 | Low | 54.8 | Low | 33 Ų | 33 | 68.4 Ų | 68.4 | 17% | 0.173 | 37% | 0.365 | C | S | . | . | trans | -96.6 | 92.3 | 159.5 | -67.4 | 161.2 | 0 | 0 | 0 | 109.1 | P231 F232 I236 V237 C298 | P231-L234 VanDerWaalsContact O-CB 3.3Å; P231-L234 WeakPolarHBondContact O-CB 3.43Å; P231-L234 PolarHBondContact O-N 3.28Å; F232-L234 PolarHBondContact O-N 2.82Å; L234-I236 HydrophobicContact CB-CB 4.29Å; L234-I236 PolarHBondContact O-N 2.96Å; L234-V237 HydrophobicContact CB-CG2 4.08Å; L234-V237 HydrophobicContact CD1-CG2 4.46Å; L234-V237 PolarHBondContact O-N 3.46Å; L234-C298 HydrophobicContact CD2-CB 3.58Å; L234-C298 WeakPolarHBondContact CD2-SG 3.48Å | ||
| 235 | P | 48.2 | Very low | 53.7 | Low | 22 Ų | 22 | 71.6 Ų | 71.6 | 14% | 0.143 | 38% | 0.382 | C | S | . | . | H | α-helix | trans | -54.5 | -9.8 | 157.1 | -23.7 | 30.5 | 0 | 0 | 0 | 112.9 | Q233 S239 Q294 | Q233-P235 WeakPolarHBondContact O-CD 3.46Å; P235-S239 WeakPolarHBondContact O-CA 3.26Å; P235-S239 WeakPolarHBondContact O-CB 3.34Å; P235-S239 PolarHBondContact O-N 3.39Å; P235-S239 PolarHBondContact O-OG 2.99Å; P235-Q294 HydrophobicContact CB-CG 3.89Å; P235-Q294 HydrophobicContact CG-CG 4.49Å |
| 236 | I | 41.8 | Very low | 52.7 | Low | 27 Ų | 27 | 73.4 Ų | 73.4 | 14% | 0.138 | 39% | 0.386 | C | S | . | . | H | α-helix | trans | -61.6 | -40 | 163.4 | -64 | -160.7 | 0 | 0 | 0 | 113 | L234 L240 Q294 V295 C298 | L234-I236 HydrophobicContact CB-CB 4.29Å; L234-I236 PolarHBondContact O-N 2.96Å; I236-L240 HydrophobicContact CG2-CD1 3.36Å; I236-L240 HydrophobicContact CG2-CG 3.68Å; I236-L240 WeakPolarHBondContact O-CA 3.34Å; I236-L240 WeakPolarHBondContact O-CB 2.96Å; I236-L240 VanDerWaalsContact O-CG 3.25Å; I236-L240 WeakPolarHBondContact O-CG 3.37Å; I236-L240 PolarHBondContact O-N 3.37Å; I236-Q294 WeakPolarHBondContact CD1-O 3.3Å; I236-Q294 HydrophobicContact CG1-CG 3.83Å; I236-V295 HydrophobicContact CD1-CB 4.48Å; I236-V295 HydrophobicContact CD1-CG2 4.22Å; I236-C298 HydrophobicContact CD1-CB 3.1Å; I236-C298 HydrophobicContact CG1-CB 4.03Å |
| 237 | V | 46.6 | Very low | 51.7 | Low | 81 Ų | 81 | 73.3 Ų | 73.3 | 49% | 0.491 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -70.1 | -41.3 | 179.5 | -177.7 | 0 | 0 | 0 | 0 | 109.6 | L234 V241 | L234-V237 HydrophobicContact CB-CG2 4.08Å; L234-V237 HydrophobicContact CD1-CG2 4.46Å; L234-V237 PolarHBondContact O-N 3.46Å; V237-V241 VanDerWaalsContact O-CB 3.28Å; V237-V241 WeakPolarHBondContact O-CB 3.4Å; V237-V241 WeakPolarHBondContact O-CG2 3.45Å; V237-V241 PolarHBondContact O-N 3.27Å |
| 238 | Q | 49.9 | Very low | 50.7 | Low | 99 Ų | 99 | 76.5 Ų | 76.5 | 46% | 0.463 | 40% | 0.404 | S | S | . | . | H | α-helix | trans | -69 | -48.9 | 178.2 | -161.6 | 161.8 | 29.3 | 0 | 0 | 111.6 | V241 E242 | Q238-V241 PolarHBondContact O-N 3Å; Q238-E242 WeakPolarHBondContact O-CG 3.41Å; Q238-E242 PolarHBondContact O-N 3.21Å |
| 239 | S | 50.3 | Low | 49.7 | Very low | 16 Ų | 16 | 74.7 Ų | 74.7 | 11% | 0.112 | 39% | 0.389 | C | S | . | . | H | α-helix | trans | -80.9 | -20.9 | 179.9 | -59.9 | 0 | 0 | 0 | 0 | 114.8 | P235 E242 I243 | P235-S239 WeakPolarHBondContact O-CA 3.26Å; P235-S239 WeakPolarHBondContact O-CB 3.34Å; P235-S239 PolarHBondContact O-N 3.39Å; P235-S239 PolarHBondContact O-OG 2.99Å; S239-E242 PolarHBondContact OG-OE2 3.45Å; S239-I243 WeakPolarHBondContact O-CB 3.37Å; S239-I243 WeakPolarHBondContact O-CD1 3.34Å; S239-I243 WeakPolarHBondContact O-CG1 3.44Å; S239-I243 PolarHBondContact O-N 2.91Å |
| 240 | L | 49.9 | Very low | 49 | Very low | 81 Ų | 81 | 75.6 Ų | 75.6 | 42% | 0.424 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -74 | -37.3 | 163.8 | -75.5 | 179.3 | 0 | 0 | 0 | 110.6 | I236 E242 I243 I244 | I236-L240 HydrophobicContact CG2-CD1 3.36Å; I236-L240 HydrophobicContact CG2-CG 3.68Å; I236-L240 WeakPolarHBondContact O-CA 3.34Å; I236-L240 WeakPolarHBondContact O-CB 2.96Å; I236-L240 VanDerWaalsContact O-CG 3.25Å; I236-L240 WeakPolarHBondContact O-CG 3.37Å; I236-L240 PolarHBondContact O-N 3.37Å; L240-E242 VanDerWaalsContact C-N 3.32Å; L240-I243 PolarHBondContact O-N 3.24Å; L240-I244 HydrophobicContact CB-CD1 4.26Å; L240-I244 WeakPolarHBondContact O-CA 3.34Å; L240-I244 WeakPolarHBondContact O-CB 3.13Å; L240-I244 WeakPolarHBondContact O-CD1 3.42Å; L240-I244 WeakPolarHBondContact O-CG1 3.45Å; L240-I244 PolarHBondContact O-N 3.1Å |
| 241 | V | 53 | Low | 48.6 | Very low | 86 Ų | 86 | 79.4 Ų | 79.4 | 52% | 0.521 | 41% | 0.409 | S | S | . | . | H | α-helix | trans | -61.4 | -45 | 171.5 | 168.2 | 0 | 0 | 0 | 0 | 109.6 | V237 Q238 I244 D245 | V237-V241 VanDerWaalsContact O-CB 3.28Å; V237-V241 WeakPolarHBondContact O-CB 3.4Å; V237-V241 WeakPolarHBondContact O-CG2 3.45Å; V237-V241 PolarHBondContact O-N 3.27Å; Q238-V241 PolarHBondContact O-N 3Å; V241-I244 PolarHBondContact O-N 3.49Å; V241-D245 WeakPolarHBondContact O-CB 3.37Å; V241-D245 PolarHBondContact O-N 3.49Å |
| 242 | E | 49.8 | Very low | 48.5 | Very low | 83 Ų | 83 | 80.2 Ų | 80.2 | 39% | 0.388 | 42% | 0.416 | S | S | . | . | H | α-helix | trans | -64 | -42.7 | 174.1 | -69.1 | 165.7 | 159 | 0 | 0 | 113.2 | Q238 S239 L240 D245 I246 | Q238-E242 WeakPolarHBondContact O-CG 3.41Å; Q238-E242 PolarHBondContact O-N 3.21Å; S239-E242 PolarHBondContact OG-OE2 3.45Å; L240-E242 VanDerWaalsContact C-N 3.32Å; E242-D245 PolarHBondContact O-N 3.46Å; E242-I246 WeakPolarHBondContact O-CB 3.41Å; E242-I246 WeakPolarHBondContact O-CD1 3.35Å; E242-I246 WeakPolarHBondContact O-CG1 3.37Å; E242-I246 PolarHBondContact O-N 2.85Å |
| 243 | I | 49.8 | Very low | 48.3 | Very low | 46 Ų | 46 | 74.7 Ų | 74.7 | 24% | 0.236 | 41% | 0.41 | C | S | . | . | H | α-helix | trans | -69.6 | -37 | 178.3 | -71.3 | 161.4 | 0 | 0 | 0 | 111 | S239 L240 I246 V247 I291 | S239-I243 WeakPolarHBondContact O-CB 3.37Å; S239-I243 WeakPolarHBondContact O-CD1 3.34Å; S239-I243 WeakPolarHBondContact O-CG1 3.44Å; S239-I243 PolarHBondContact O-N 2.91Å; L240-I243 PolarHBondContact O-N 3.24Å; I243-I246 PolarHBondContact O-N 3.09Å; I243-V247 HydrophobicContact CG2-CG2 4.24Å; I243-V247 VanDerWaalsContact O-CB 3.29Å; I243-V247 WeakPolarHBondContact O-CB 3.31Å; I243-V247 WeakPolarHBondContact O-CG2 3.47Å; I243-V247 PolarHBondContact O-N 3.48Å; I243-I291 HydrophobicContact CD1-CD1 3.68Å; I243-I291 HydrophobicContact CD1-CG1 4.13Å; I243-I291 HydrophobicContact CD1-CG2 4.28Å; I243-I291 HydrophobicContact CG1-CD1 4.48Å |
| 244 | I | 53 | Low | 47.8 | Very low | 86 Ų | 86 | 81.6 Ų | 81.6 | 44% | 0.441 | 43% | 0.434 | S | S | . | . | H | α-helix | trans | -69.2 | -40.9 | 174.8 | -68.9 | 165 | 0 | 0 | 0 | 109.5 | L240 V241 V247 Q248 | L240-I244 HydrophobicContact CB-CD1 4.26Å; L240-I244 WeakPolarHBondContact O-CA 3.34Å; L240-I244 WeakPolarHBondContact O-CB 3.13Å; L240-I244 WeakPolarHBondContact O-CD1 3.42Å; L240-I244 WeakPolarHBondContact O-CG1 3.45Å; L240-I244 PolarHBondContact O-N 3.1Å; V241-I244 PolarHBondContact O-N 3.49Å; I244-V247 PolarHBondContact O-N 2.86Å; I244-Q248 HydrophobicContact CG2-CG 4.25Å; I244-Q248 WeakPolarHBondContact O-CB 3.32Å; I244-Q248 VanDerWaalsContact O-CG 3.28Å; I244-Q248 WeakPolarHBondContact O-CG 3.3Å; I244-Q248 PolarHBondContact O-N 2.91Å |
| 245 | D | 49.2 | Very low | 47.2 | Very low | 107 Ų | 107 | 86.4 Ų | 86.4 | 57% | 0.572 | 46% | 0.464 | S | S | * | . | H | α-helix | trans | -60.3 | -45.4 | 170.9 | -109 | -8.4 | 0 | 0 | 0 | 110.9 | V241 E242 Q248 Y249 | V241-D245 WeakPolarHBondContact O-CB 3.37Å; V241-D245 PolarHBondContact O-N 3.49Å; E242-D245 PolarHBondContact O-N 3.46Å; D245-Q248 PolarHBondContact O-N 3.23Å; D245-Y249 WeakPolarHBondContact O-CA 3.42Å; D245-Y249 WeakPolarHBondContact O-CB 3.43Å; D245-Y249 PolarHBondContact O-N 2.95Å |
| 246 | I | 49.8 | Very low | 46.7 | Very low | 75 Ų | 75 | 90.3 Ų | 90.3 | 39% | 0.385 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -64.6 | -44.5 | 178.8 | -72.2 | 161.4 | 0 | 0 | 0 | 111.2 | E242 I243 Y249 E250 | E242-I246 WeakPolarHBondContact O-CB 3.41Å; E242-I246 WeakPolarHBondContact O-CD1 3.35Å; E242-I246 WeakPolarHBondContact O-CG1 3.37Å; E242-I246 PolarHBondContact O-N 2.85Å; I243-I246 PolarHBondContact O-N 3.09Å; I246-Y249 PolarHBondContact O-N 3.13Å; I246-E250 PolarHBondContact O-N 3.09Å |
| 247 | V | 47.5 | Very low | 46.6 | Very low | 75 Ų | 75 | 96.6 Ų | 96.6 | 46% | 0.455 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -70.8 | -38.2 | 178.8 | 170.4 | 0 | 0 | 0 | 0 | 111 | I243 I244 Y249 T251 | I243-V247 HydrophobicContact CG2-CG2 4.24Å; I243-V247 VanDerWaalsContact O-CB 3.29Å; I243-V247 WeakPolarHBondContact O-CB 3.31Å; I243-V247 WeakPolarHBondContact O-CG2 3.47Å; I243-V247 PolarHBondContact O-N 3.48Å; I244-V247 PolarHBondContact O-N 2.86Å; V247-Y249 VanDerWaalsContact C-N 3.32Å; V247-T251 HydrophobicContact CG1-CG2 4.49Å; V247-T251 WeakPolarHBondContact O-CB 3.01Å; V247-T251 VanDerWaalsContact O-CG2 3.3Å; V247-T251 WeakPolarHBondContact O-CG2 3.44Å; V247-T251 PolarHBondContact O-N 3.4Å; V247-T251 PolarHBondContact O-OG1 3.32Å |
| 248 | Q | 46.8 | Very low | 46.1 | Very low | 111 Ų | 111 | 94.7 Ų | 94.7 | 52% | 0.519 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -65.9 | -35.6 | 170.5 | -75.1 | -169.4 | -96.9 | 0 | 0 | 111.3 | I244 D245 T251 S252 | I244-Q248 HydrophobicContact CG2-CG 4.25Å; I244-Q248 WeakPolarHBondContact O-CB 3.32Å; I244-Q248 VanDerWaalsContact O-CG 3.28Å; I244-Q248 WeakPolarHBondContact O-CG 3.3Å; I244-Q248 PolarHBondContact O-N 2.91Å; D245-Q248 PolarHBondContact O-N 3.23Å; Q248-T251 WeakPolarHBondContact CA-OG1 3.2Å; Q248-T251 PolarHBondContact O-OG1 3.26Å; Q248-S252 WeakPolarHBondContact O-CB 3.38Å; Q248-S252 PolarHBondContact O-N 3.04Å; Q248-S252 PolarHBondContact O-OG 3.47Å |
| 249 | Y | 43.4 | Very low | 45.9 | Very low | 92 Ų | 92 | 94 Ų | 94 | 36% | 0.361 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -69.1 | -46.2 | 178.2 | -176.9 | -93 | 0 | 0 | 0 | 111.8 | D245 I246 V247 S252 R254 T256 A258 | D245-Y249 WeakPolarHBondContact O-CA 3.42Å; D245-Y249 WeakPolarHBondContact O-CB 3.43Å; D245-Y249 PolarHBondContact O-N 2.95Å; I246-Y249 PolarHBondContact O-N 3.13Å; V247-Y249 VanDerWaalsContact C-N 3.32Å; Y249-S252 PolarHBondContact O-N 3.05Å; Y249-R254 WeakPolarHBondContact CE2-O 3.5Å; Y249-T256 PolarHBondContact OH-N 2.82Å; Y249-T256 PolarHBondContact OH-O 3.41Å; Y249-A258 HydrophobicContact CE2-CB 4.27Å |
| 250 | E | 47.2 | Very low | 45.5 | Very low | 157 Ų | 157 | 102.8 Ų | 102.8 | 73% | 0.734 | 55% | 0.55 | S | S | * | . | H | α-helix | trans | -61.7 | -47.3 | 172 | -85.7 | -162.3 | 137.5 | 0 | 0 | 111.8 | I246 S252 G253 | I246-E250 PolarHBondContact O-N 3.09Å; E250-S252 VanDerWaalsContact C-N 3.31Å; E250-S252 PolarHBondContact O-N 2.89Å; E250-G253 PolarHBondContact O-N 3.37Å |
| 251 | T | 47.2 | Very low | 45 | Very low | 111 Ų | 111 | 101.1 Ų | 101.1 | 68% | 0.681 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -72.7 | -20.4 | -179 | 55.2 | 0 | 0 | 0 | 0 | 113.9 | V247 Q248 | V247-T251 HydrophobicContact CG1-CG2 4.49Å; V247-T251 WeakPolarHBondContact O-CB 3.01Å; V247-T251 VanDerWaalsContact O-CG2 3.3Å; V247-T251 WeakPolarHBondContact O-CG2 3.44Å; V247-T251 PolarHBondContact O-N 3.4Å; V247-T251 PolarHBondContact O-OG1 3.32Å; Q248-T251 WeakPolarHBondContact CA-OG1 3.2Å; Q248-T251 PolarHBondContact O-OG1 3.26Å |
| 252 | S | 47.6 | Very low | 44.5 | Very low | 73 Ų | 73 | 99 Ų | 99 | 51% | 0.51 | 54% | 0.537 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -81.9 | -10.4 | 176.3 | -65.1 | 0 | 0 | 0 | 0 | 113.9 | Q248 Y249 E250 R254 | Q248-S252 WeakPolarHBondContact O-CB 3.38Å; Q248-S252 PolarHBondContact O-N 3.04Å; Q248-S252 PolarHBondContact O-OG 3.47Å; Y249-S252 PolarHBondContact O-N 3.05Å; E250-S252 VanDerWaalsContact C-N 3.31Å; E250-S252 PolarHBondContact O-N 2.89Å; S252-R254 PolarHBondContact O-N 2.9Å |
| 253 | G | 40.7 | Very low | 44.1 | Very low | 63 Ų | 63 | 99.6 Ų | 99.6 | 65% | 0.649 | 55% | 0.546 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 61.4 | 11.5 | 176.4 | 0 | 0 | 0 | 0 | 0 | 115.7 | E250 V255 | E250-G253 PolarHBondContact O-N 3.37Å; G253-V255 PolarHBondContact O-N 3.38Å |
| 254 | R | 41.3 | Very low | 43.6 | Very low | 189 Ų | 189 | 103 Ų | 103 | 71% | 0.713 | 56% | 0.559 | S | S | * | * | trans | -98.5 | 89.4 | -176.2 | -74.7 | -176.9 | -178.4 | -174.6 | 1 | 110.8 | Y249 S252 T256 | Y249-R254 WeakPolarHBondContact CE2-O 3.5Å; S252-R254 PolarHBondContact O-N 2.9Å; R254-T256 VanDerWaalsContact C-N 3.26Å; R254-T256 PolarHBondContact O-N 3.13Å | ||
| 255 | V | 38.9 | Very low | 43.2 | Very low | 135 Ų | 135 | 103.7 Ų | 103.7 | 82% | 0.818 | 56% | 0.563 | S | S | * | * | trans | -72.3 | 79.5 | 173.6 | -173.5 | 0 | 0 | 0 | 0 | 110.1 | G253 | G253-V255 PolarHBondContact O-N 3.38Š| ||
| 256 | T | 37.2 | Very low | 42.8 | Very low | 104 Ų | 104 | 104.3 Ų | 104.3 | 64% | 0.638 | 56% | 0.562 | S | S | * | * | S | Bend | trans | -139.9 | 114.7 | 170.4 | 48.1 | 0 | 0 | 0 | 0 | 108.9 | Y249 R254 A258 | Y249-T256 PolarHBondContact OH-N 2.82Å; Y249-T256 PolarHBondContact OH-O 3.41Å; R254-T256 VanDerWaalsContact C-N 3.26Å; R254-T256 PolarHBondContact O-N 3.13Å; T256-A258 PolarHBondContact O-N 3.18Å; T256-A258 VanDerWaalsContact O-N 3.09Å |
| 257 | L | 38.4 | Very low | 42.4 | Very low | 159 Ų | 159 | 104.4 Ų | 104.4 | 83% | 0.832 | 57% | 0.569 | S | S | * | * | trans | -31.8 | 107.8 | -175.3 | -89.7 | 64.7 | 0 | 0 | 0 | 114 | P259 | L257-P259 WeakPolarHBondContact O-CD 3.01Š| ||
| 258 | A | 37.7 | Very low | 42.1 | Very low | 40 Ų | 40 | 104.9 Ų | 104.9 | 33% | 0.331 | 57% | 0.565 | S | S | . | * | trans | -74.3 | 114.7 | 161.2 | 0 | 0 | 0 | 0 | 0 | 108.6 | Y249 T256 Y260 A261 | Y249-A258 HydrophobicContact CE2-CB 4.27Å; T256-A258 PolarHBondContact O-N 3.18Å; T256-A258 VanDerWaalsContact O-N 3.09Å; A258-Y260 PolarHBondContact O-N 3.32Å; A258-A261 PolarHBondContact O-N 3.03Å | ||
| 259 | P | 45.4 | Very low | 41.9 | Very low | 84 Ų | 84 | 103.9 Ų | 103.9 | 55% | 0.545 | 56% | 0.563 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -73.4 | 7.2 | -168.8 | 29.7 | -36.1 | 0 | 0 | 0 | 114.9 | L257 S262 V263 | L257-P259 WeakPolarHBondContact O-CD 3.01Å; P259-S262 PolarHBondContact O-OG 3.44Å; P259-V263 WeakPolarHBondContact O-CG2 3.43Å |
| 260 | Y | 40.8 | Very low | 41.8 | Very low | 201 Ų | 201 | 106.2 Ų | 106.2 | 79% | 0.788 | 58% | 0.577 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -111 | -35.1 | 180 | -66.4 | -75.2 | 0 | 0 | 0 | 113 | A258 S262 V263 | A258-Y260 PolarHBondContact O-N 3.32Å; Y260-S262 VanDerWaalsContact C-N 3.28Å; Y260-S262 PolarHBondContact O-N 2.99Å; Y260-V263 PolarHBondContact O-N 3.18Å |
| 261 | A | 39.8 | Very low | 41.7 | Very low | 47 Ų | 47 | 106.5 Ų | 106.5 | 39% | 0.388 | 58% | 0.584 | S | S | . | * | H | α-helix | trans | -67.7 | -31.2 | 168.8 | 0 | 0 | 0 | 0 | 0 | 111.7 | A258 V263 I265 | A258-A261 PolarHBondContact O-N 3.03Å; A261-V263 PolarHBondContact O-N 3.02Å; A261-I265 WeakPolarHBondContact O-CB 3.15Å; A261-I265 WeakPolarHBondContact O-CG1 3.3Å; A261-I265 PolarHBondContact O-N 3.25Å |
| 262 | S | 42.8 | Very low | 41.4 | Very low | 42 Ų | 42 | 102.7 Ų | 102.7 | 29% | 0.294 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -65.3 | -34.9 | 175.4 | 61 | 0 | 0 | 0 | 0 | 112.9 | P259 Y260 F264 I265 H266 | P259-S262 PolarHBondContact O-OG 3.44Å; Y260-S262 VanDerWaalsContact C-N 3.28Å; Y260-S262 PolarHBondContact O-N 2.99Å; S262-F264 PolarHBondContact O-N 3.4Å; S262-I265 PolarHBondContact O-N 3.06Å; S262-H266 WeakPolarHBondContact O-CA 3.12Å; S262-H266 WeakPolarHBondContact O-CB 3.27Å; S262-H266 PolarHBondContact O-N 3.41Å |
| 263 | V | 41.6 | Very low | 41 | Very low | 94 Ų | 94 | 106.5 Ų | 106.5 | 57% | 0.57 | 58% | 0.576 | S | S | * | * | H | α-helix | trans | -62.8 | -46.3 | -175.2 | 177.4 | 0 | 0 | 0 | 0 | 111.4 | P259 Y260 A261 S267 | P259-V263 WeakPolarHBondContact O-CG2 3.43Å; Y260-V263 PolarHBondContact O-N 3.18Å; A261-V263 PolarHBondContact O-N 3.02Å; V263-S267 WeakPolarHBondContact O-CB 3.28Å; V263-S267 PolarHBondContact O-N 2.76Å; V263-S267 PolarHBondContact O-OG 3.46Å |
| 264 | F | 39.8 | Very low | 41.4 | Very low | 117 Ų | 117 | 111.8 Ų | 111.8 | 51% | 0.513 | 59% | 0.589 | S | S | . | * | H | α-helix | trans | -73.8 | -33.4 | -177.9 | -151.9 | -85.9 | 0 | 0 | 0 | 112.9 | S262 F268 | S262-F264 PolarHBondContact O-N 3.4Å; F264-F268 HydrophobicContact CD1-CD2 4.34Å; F264-F268 HydrophobicContact CE1-CD2 4.29Å; F264-F268 HydrophobicContact CE1-CE2 4.21Å; F264-F268 HydrophobicContact CZ-CE2 4.3Å; F264-F268 WeakPolarHBondContact O-CD2 3.4Å |
| 265 | I | 44.8 | Very low | 41.6 | Very low | 102 Ų | 102 | 108.2 Ų | 108.2 | 52% | 0.523 | 58% | 0.584 | S | S | . | * | H | α-helix | trans | -75.5 | -47.6 | 178.4 | -69.5 | 178 | 0 | 0 | 0 | 110.1 | A261 S262 F268 L269 | A261-I265 WeakPolarHBondContact O-CB 3.15Å; A261-I265 WeakPolarHBondContact O-CG1 3.3Å; A261-I265 PolarHBondContact O-N 3.25Å; S262-I265 PolarHBondContact O-N 3.06Å; I265-F268 PolarHBondContact O-N 2.86Å; I265-L269 HydrophobicContact CG2-CD1 3.45Å; I265-L269 VanDerWaalsContact CG2-CD1 3.45Å; I265-L269 WeakPolarHBondContact O-CB 3.44Å; I265-L269 PolarHBondContact O-N 3.47Å |
| 266 | H | 39.3 | Very low | 41.9 | Very low | 120 Ų | 120 | 103.2 Ų | 103.2 | 56% | 0.556 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -76.1 | -25.7 | -175.1 | -152.1 | -60.6 | 0 | 0 | 0 | 112.8 | S262 F268 Q270 | S262-H266 WeakPolarHBondContact O-CA 3.12Å; S262-H266 WeakPolarHBondContact O-CB 3.27Å; S262-H266 PolarHBondContact O-N 3.41Å; H266-F268 VanDerWaalsContact C-N 3.33Å; H266-Q270 PolarHBondContact ND1-OE1 3.24Å; H266-Q270 WeakPolarHBondContact O-CB 3.12Å |
| 267 | S | 42.9 | Very low | 41.9 | Very low | 77 Ų | 77 | 108.9 Ų | 108.9 | 54% | 0.538 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -76.2 | -17 | 171.9 | 74.1 | 0 | 0 | 0 | 0 | 114 | V263 | V263-S267 WeakPolarHBondContact O-CB 3.28Å; V263-S267 PolarHBondContact O-N 2.76Å; V263-S267 PolarHBondContact O-OG 3.46Å |
| 268 | F | 41.1 | Very low | 41.8 | Very low | 85 Ų | 85 | 108 Ų | 108 | 37% | 0.373 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -107.7 | -24.5 | -179.9 | -89.5 | -82 | 0 | 0 | 0 | 113.8 | F264 I265 H266 | F264-F268 HydrophobicContact CD1-CD2 4.34Å; F264-F268 HydrophobicContact CE1-CD2 4.29Å; F264-F268 HydrophobicContact CE1-CE2 4.21Å; F264-F268 HydrophobicContact CZ-CE2 4.3Å; F264-F268 WeakPolarHBondContact O-CD2 3.4Å; I265-F268 PolarHBondContact O-N 2.86Å; H266-F268 VanDerWaalsContact C-N 3.33Å |
| 269 | L | 41.8 | Very low | 42.1 | Very low | 90 Ų | 90 | 107.7 Ų | 107.7 | 47% | 0.471 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -84.5 | -12.9 | 177.4 | -89.4 | 148.8 | 0 | 0 | 0 | 114.7 | I265 D271 | I265-L269 HydrophobicContact CG2-CD1 3.45Å; I265-L269 VanDerWaalsContact CG2-CD1 3.45Å; I265-L269 WeakPolarHBondContact O-CB 3.44Å; I265-L269 PolarHBondContact O-N 3.47Å; L269-D271 VanDerWaalsContact C-N 3.28Å; L269-D271 PolarHBondContact O-N 2.82Å |
| 270 | Q | 42.3 | Very low | 41.8 | Very low | 141 Ų | 141 | 107.5 Ų | 107.5 | 66% | 0.659 | 55% | 0.549 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -74.6 | -14.3 | -172.5 | -162.3 | 159.8 | -4.6 | 0 | 0 | 114.2 | H266 | H266-Q270 PolarHBondContact ND1-OE1 3.24Å; H266-Q270 WeakPolarHBondContact O-CB 3.12Å |
| 271 | D | 44.3 | Very low | 41.8 | Very low | 163 Ų | 163 | 102.8 Ų | 102.8 | 87% | 0.872 | 54% | 0.537 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -95.2 | -4.4 | -177.9 | -87 | -16.6 | 0 | 0 | 0 | 115.2 | L269 | L269-D271 VanDerWaalsContact C-N 3.28Å; L269-D271 PolarHBondContact O-N 2.82Å |
| 272 | S | 40.8 | Very low | 42 | Very low | 30 Ų | 30 | 105.9 Ų | 105.9 | 21% | 0.21 | 54% | 0.543 | C | S | . | . | trans | -118.2 | 59 | -172.5 | 72.3 | 0 | 0 | 0 | 0 | 115 | ||||
| 273 | N | 39.9 | Very low | 42.3 | Very low | 153 Ų | 153 | 108.1 Ų | 108.1 | 82% | 0.818 | 55% | 0.549 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -56.5 | 138.1 | 156.9 | -101 | -42.9 | 0 | 0 | 0 | 109.6 | N275 | N273-N275 PolarHBondContact O-N 3.14Š|
| 274 | L | 47.5 | Very low | 42.9 | Very low | 174 Ų | 174 | 106.6 Ų | 106.6 | 91% | 0.911 | 54% | 0.542 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 77.4 | -13.8 | 173.2 | -55.6 | 161.4 | 0 | 0 | 0 | 119.7 | ||
| 275 | N | 47.3 | Very low | 43.6 | Very low | 115 Ų | 115 | 105.1 Ų | 105.1 | 62% | 0.615 | 54% | 0.543 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -119.8 | 8.2 | -179 | -105.4 | -24.7 | 0 | 0 | 0 | 115.9 | N273 R277 K278 V279 | N273-N275 PolarHBondContact O-N 3.14Å; N275-R277 VanDerWaalsContact C-N 3.34Å; N275-R277 PolarHBondContact O-N 3.25Å; N275-K278 PolarHBondContact O-N 2.83Å; N275-V279 HydrophobicContact CB-CG2 4.05Å; N275-V279 WeakPolarHBondContact O-CG2 3.32Å; N275-V279 PolarHBondContact O-N 3.1Å |
| 276 | G | 44 | Very low | 44.1 | Very low | 29 Ų | 29 | 102.8 Ų | 102.8 | 30% | 0.299 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -50.5 | -37.2 | -163.4 | 0 | 0 | 0 | 0 | 0 | 117.1 | K278 V280 | G276-K278 PolarHBondContact O-N 3.12Å; G276-V280 WeakPolarHBondContact O-CB 3.35Å; G276-V280 WeakPolarHBondContact O-CG2 3.4Å; G276-V280 PolarHBondContact O-N 3.25Å |
| 277 | R | 38.1 | Very low | 45 | Very low | 224 Ų | 224 | 101.5 Ų | 101.5 | 85% | 0.845 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -70.1 | -33.8 | -175.1 | -156 | 177.6 | -163.6 | 172.2 | 5.9 | 113.8 | N275 I281 | N275-R277 VanDerWaalsContact C-N 3.34Å; N275-R277 PolarHBondContact O-N 3.25Å; R277-I281 WeakPolarHBondContact O-CD1 3.26Å; R277-I281 WeakPolarHBondContact O-CG1 3.49Å |
| 278 | K | 36.6 | Very low | 45.9 | Very low | 140 Ų | 140 | 101.8 Ų | 101.8 | 61% | 0.609 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -79.9 | -41.7 | 177.6 | -166 | -178.6 | -179.2 | -166.6 | 0 | 110.8 | N275 G276 V280 I281 E282 | N275-K278 PolarHBondContact O-N 2.83Å; G276-K278 PolarHBondContact O-N 3.12Å; K278-V280 PolarHBondContact O-N 2.81Å; K278-I281 PolarHBondContact O-N 2.85Å; K278-E282 VanDerWaalsContact CE-OE1 3.22Å; K278-E282 WeakPolarHBondContact CE-OE1 3.3Å; K278-E282 IonicContact NZ-OE1 3.48Å; K278-E282 PolarHBondContact O-N 2.84Å |
| 279 | V | 42.1 | Very low | 46.9 | Very low | 33 Ų | 33 | 101.1 Ų | 101.1 | 20% | 0.2 | 53% | 0.528 | C | S | . | . | H | α-helix | trans | -56 | -48.2 | 174.9 | 171.3 | 0 | 0 | 0 | 0 | 110.9 | N275 I281 E282 H283 | N275-V279 HydrophobicContact CB-CG2 4.05Å; N275-V279 WeakPolarHBondContact O-CG2 3.32Å; N275-V279 PolarHBondContact O-N 3.1Å; V279-I281 VanDerWaalsContact C-N 3.31Å; V279-I281 PolarHBondContact O-N 3.4Å; V279-E282 PolarHBondContact O-N 3.42Å; V279-H283 VanDerWaalsContact CG1-CD2 3.41Å; V279-H283 WeakPolarHBondContact CG1-CD2 3.29Å; V279-H283 WeakPolarHBondContact O-CB 3.44Å; V279-H283 PolarHBondContact O-CD2 3.39Å; V279-H283 PolarHBondContact O-N 3.34Å |
| 280 | V | 40.8 | Very low | 47.9 | Very low | 80 Ų | 80 | 99.6 Ų | 99.6 | 49% | 0.485 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -59.8 | -35.6 | 177.3 | 166.3 | 0 | 0 | 0 | 0 | 113.4 | G276 K278 S284 | G276-V280 WeakPolarHBondContact O-CB 3.35Å; G276-V280 WeakPolarHBondContact O-CG2 3.4Å; G276-V280 PolarHBondContact O-N 3.25Å; K278-V280 PolarHBondContact O-N 2.81Å; V280-S284 WeakPolarHBondContact O-CB 3.45Å; V280-S284 PolarHBondContact O-N 2.85Å; V280-S284 PolarHBondContact O-OG 3.48Å |
| 281 | I | 40.1 | Very low | 48.9 | Very low | 102 Ų | 102 | 95 Ų | 95 | 52% | 0.523 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -75.1 | -41.6 | 178.3 | -63.3 | 168.2 | 0 | 0 | 0 | 111.2 | R277 K278 V279 H283 S284 V285 | R277-I281 WeakPolarHBondContact O-CD1 3.26Å; R277-I281 WeakPolarHBondContact O-CG1 3.49Å; K278-I281 PolarHBondContact O-N 2.85Å; V279-I281 VanDerWaalsContact C-N 3.31Å; V279-I281 PolarHBondContact O-N 3.4Å; I281-H283 VanDerWaalsContact C-N 3.32Å; I281-H283 PolarHBondContact O-N 3.01Å; I281-S284 PolarHBondContact O-N 3.2Å; I281-S284 PolarHBondContact O-OG 2.85Å; I281-S284 VanDerWaalsContact O-OG 3.05Å; I281-V285 WeakPolarHBondContact O-CG2 3.48Å; I281-V285 PolarHBondContact O-N 3.01Å; I281-V285 VanDerWaalsContact O-N 3.15Å |
| 282 | E | 43.8 | Very low | 50 | Low | 113 Ų | 113 | 90.6 Ų | 90.6 | 53% | 0.528 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -64.9 | -37.6 | 175.9 | -70.6 | 177.6 | -163.9 | 0 | 0 | 111.4 | K278 V279 S286 | K278-E282 VanDerWaalsContact CE-OE1 3.22Å; K278-E282 WeakPolarHBondContact CE-OE1 3.3Å; K278-E282 IonicContact NZ-OE1 3.48Å; K278-E282 PolarHBondContact O-N 2.84Å; V279-E282 PolarHBondContact O-N 3.42Å; E282-S286 VanDerWaalsContact O-CB 3.29Å; E282-S286 WeakPolarHBondContact O-CB 2.99Å; E282-S286 PolarHBondContact O-N 2.87Å |
| 283 | H | 48.8 | Very low | 51.2 | Low | 89 Ų | 89 | 92.3 Ų | 92.3 | 41% | 0.412 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -71.3 | -36 | 175 | -75.5 | -65.8 | 0 | 0 | 0 | 113.8 | V279 I281 S286 Y287 | V279-H283 VanDerWaalsContact CG1-CD2 3.41Å; V279-H283 WeakPolarHBondContact CG1-CD2 3.29Å; V279-H283 WeakPolarHBondContact O-CB 3.44Å; V279-H283 PolarHBondContact O-CD2 3.39Å; V279-H283 PolarHBondContact O-N 3.34Å; I281-H283 VanDerWaalsContact C-N 3.32Å; I281-H283 PolarHBondContact O-N 3.01Å; H283-S286 PolarHBondContact O-N 3.33Å; H283-Y287 VanDerWaalsContact O-CB 3.29Å; H283-Y287 WeakPolarHBondContact O-CB 3.44Å; H283-Y287 PolarHBondContact O-N 3.38Å |
| 284 | S | 54.8 | Low | 52.5 | Low | 61 Ų | 61 | 85.3 Ų | 85.3 | 43% | 0.427 | 45% | 0.447 | S | S | . | . | H | α-helix | trans | -67.7 | -42.2 | 176.9 | 68.6 | 0 | 0 | 0 | 0 | 111.8 | V280 I281 Y287 V288 | V280-S284 WeakPolarHBondContact O-CB 3.45Å; V280-S284 PolarHBondContact O-N 2.85Å; V280-S284 PolarHBondContact O-OG 3.48Å; I281-S284 PolarHBondContact O-N 3.2Å; I281-S284 PolarHBondContact O-OG 2.85Å; I281-S284 VanDerWaalsContact O-OG 3.05Å; S284-Y287 PolarHBondContact O-N 3.01Å; S284-V288 WeakPolarHBondContact O-CG2 3.38Å; S284-V288 PolarHBondContact O-N 3.44Å |
| 285 | V | 54.4 | Low | 53.4 | Low | 87 Ų | 87 | 79.6 Ų | 79.6 | 53% | 0.527 | 42% | 0.419 | S | S | . | . | H | α-helix | trans | -64 | -42.6 | 173.8 | 176.5 | 0 | 0 | 0 | 0 | 111.1 | I281 Y287 T289 | I281-V285 WeakPolarHBondContact O-CG2 3.48Å; I281-V285 PolarHBondContact O-N 3.01Å; I281-V285 VanDerWaalsContact O-N 3.15Å; V285-Y287 VanDerWaalsContact C-N 3.34Å; V285-Y287 PolarHBondContact O-N 3.31Å; V285-T289 VanDerWaalsContact O-CB 3.3Å; V285-T289 WeakPolarHBondContact O-CB 3.4Å; V285-T289 PolarHBondContact O-N 2.92Å; V285-T289 PolarHBondContact O-OG1 3.04Å |
| 286 | S | 56 | Low | 54.5 | Low | 53 Ų | 53 | 78.2 Ų | 78.2 | 37% | 0.371 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -58.6 | -42.9 | 173.5 | -177.5 | 0 | 0 | 0 | 0 | 112.4 | E282 H283 F290 | E282-S286 VanDerWaalsContact O-CB 3.29Å; E282-S286 WeakPolarHBondContact O-CB 2.99Å; E282-S286 PolarHBondContact O-N 2.87Å; H283-S286 PolarHBondContact O-N 3.33Å; S286-F290 WeakPolarHBondContact O-CB 3.35Å; S286-F290 PolarHBondContact O-N 3.36Å |
| 287 | Y | 57.4 | Low | 55.7 | Low | 92 Ų | 92 | 77.5 Ų | 77.5 | 36% | 0.361 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -71.1 | -44.3 | -177.8 | -176.4 | -109.5 | 0 | 0 | 0 | 112.1 | H283 S284 V285 T289 F290 I291 | H283-Y287 VanDerWaalsContact O-CB 3.29Å; H283-Y287 WeakPolarHBondContact O-CB 3.44Å; H283-Y287 PolarHBondContact O-N 3.38Å; S284-Y287 PolarHBondContact O-N 3.01Å; V285-Y287 VanDerWaalsContact C-N 3.34Å; V285-Y287 PolarHBondContact O-N 3.31Å; Y287-T289 VanDerWaalsContact C-N 3.33Å; Y287-T289 PolarHBondContact O-N 3.49Å; Y287-F290 WeakPolarHBondContact O-CB 3.4Å; Y287-F290 PolarHBondContact O-N 2.86Å; Y287-I291 HydrophobicContact CD1-CD1 3.74Å; Y287-I291 HydrophobicContact CE1-CD1 3.34Å; Y287-I291 HydrophobicContact CE1-CG1 4.39Å; Y287-I291 HydrophobicContact CE2-CD1 4.36Å; Y287-I291 HydrophobicContact CG-CD1 4.41Å; Y287-I291 WeakPolarHBondContact O-CG1 3.36Å; Y287-I291 PolarHBondContact O-N 3.43Å |
| 288 | V | 61.3 | Low | 57.2 | Low | 84 Ų | 84 | 67.6 Ų | 67.6 | 51% | 0.509 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -60.8 | -44 | 173.2 | 173.1 | 0 | 0 | 0 | 0 | 110.7 | S284 F290 I291 C292 | S284-V288 WeakPolarHBondContact O-CG2 3.38Å; S284-V288 PolarHBondContact O-N 3.44Å; V288-F290 VanDerWaalsContact C-N 3.32Å; V288-F290 PolarHBondContact O-N 2.98Å; V288-I291 PolarHBondContact O-N 3.01Å; V288-C292 WeakPolarHBondContact O-CB 3.48Å; V288-C292 PolarHBondContact O-N 3.17Å; V288-C292 PolarHBondContact O-SG 2.91Å |
| 289 | T | 62.6 | Low | 59.1 | Low | 70 Ų | 70 | 67.7 Ų | 67.7 | 43% | 0.429 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -61.7 | -40.8 | 176.7 | -55.8 | 0 | 0 | 0 | 0 | 111.5 | V285 Y287 C292 L293 | V285-T289 VanDerWaalsContact O-CB 3.3Å; V285-T289 WeakPolarHBondContact O-CB 3.4Å; V285-T289 PolarHBondContact O-N 2.92Å; V285-T289 PolarHBondContact O-OG1 3.04Å; Y287-T289 VanDerWaalsContact C-N 3.33Å; Y287-T289 PolarHBondContact O-N 3.49Å; T289-C292 PolarHBondContact O-N 3.41Å; T289-L293 HydrophobicContact CG2-CD1 4.02Å; T289-L293 HydrophobicContact CG2-CG 4.39Å; T289-L293 WeakPolarHBondContact O-CB 3.48Å; T289-L293 VanDerWaalsContact O-CG 3.3Å; T289-L293 WeakPolarHBondContact O-CG 3.46Å; T289-L293 PolarHBondContact O-N 3.27Å |
| 290 | F | 62.1 | Low | 60.6 | Low | 59 Ų | 59 | 67.9 Ų | 67.9 | 26% | 0.259 | 37% | 0.37 | S | S | . | . | H | α-helix | trans | -62.1 | -47.3 | 174.9 | 178.2 | -96.5 | 0 | 0 | 0 | 112.1 | L173 S286 Y287 V288 C292 L293 Q294 | L173-F290 HydrophobicContact CD1-CD2 4.41Å; L173-F290 HydrophobicContact CD1-CE2 4.46Å; S286-F290 WeakPolarHBondContact O-CB 3.35Å; S286-F290 PolarHBondContact O-N 3.36Å; Y287-F290 WeakPolarHBondContact O-CB 3.4Å; Y287-F290 PolarHBondContact O-N 2.86Å; V288-F290 VanDerWaalsContact C-N 3.32Å; V288-F290 PolarHBondContact O-N 2.98Å; F290-C292 PolarHBondContact O-N 2.75Å; F290-L293 PolarHBondContact O-N 3.12Å; F290-Q294 WeakPolarHBondContact O-CB 3.45Å; F290-Q294 PolarHBondContact O-N 3.04Å |
| 291 | I | 63.6 | Low | 62.1 | Low | 43 Ų | 43 | 64.3 Ų | 64.3 | 22% | 0.221 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -59.9 | -47.9 | 175.5 | -67.6 | 164 | 0 | 0 | 0 | 110.5 | I243 Y287 V288 L293 Q294 V295 | I243-I291 HydrophobicContact CD1-CD1 3.68Å; I243-I291 HydrophobicContact CD1-CG1 4.13Å; I243-I291 HydrophobicContact CD1-CG2 4.28Å; I243-I291 HydrophobicContact CG1-CD1 4.48Å; Y287-I291 HydrophobicContact CD1-CD1 3.74Å; Y287-I291 HydrophobicContact CE1-CD1 3.34Å; Y287-I291 HydrophobicContact CE1-CG1 4.39Å; Y287-I291 HydrophobicContact CE2-CD1 4.36Å; Y287-I291 HydrophobicContact CG-CD1 4.41Å; Y287-I291 WeakPolarHBondContact O-CG1 3.36Å; Y287-I291 PolarHBondContact O-N 3.43Å; V288-I291 PolarHBondContact O-N 3.01Å; I291-L293 PolarHBondContact O-N 2.9Å; I291-Q294 WeakPolarHBondContact O-CB 3.26Å; I291-Q294 PolarHBondContact O-N 2.91Å; I291-Q294 VanDerWaalsContact O-N 3.14Å; I291-V295 HydrophobicContact CG2-CG2 4.24Å; I291-V295 WeakPolarHBondContact O-CB 3.39Å; I291-V295 VanDerWaalsContact O-CG2 3.3Å; I291-V295 WeakPolarHBondContact O-CG2 3.42Å; I291-V295 PolarHBondContact O-N 2.9Å |
| 292 | C | 67.9 | Low | 63.8 | Low | 72 Ų | 72 | 62.9 Ų | 62.9 | 49% | 0.486 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -60.6 | -47 | 179.4 | -69.7 | 0 | 0 | 0 | 0 | 112.2 | V288 T289 F290 Q294 V295 V296 | V288-C292 WeakPolarHBondContact O-CB 3.48Å; V288-C292 PolarHBondContact O-N 3.17Å; V288-C292 PolarHBondContact O-SG 2.91Å; T289-C292 PolarHBondContact O-N 3.41Å; F290-C292 PolarHBondContact O-N 2.75Å; C292-Q294 VanDerWaalsContact C-N 3.26Å; C292-Q294 PolarHBondContact O-N 3.42Å; C292-V295 PolarHBondContact O-N 3.44Å; C292-V296 WeakPolarHBondContact O-CG2 3.38Å; C292-V296 PolarHBondContact O-N 3.5Å |
| 293 | L | 66.5 | Low | 65.5 | Low | 65 Ų | 65 | 62.7 Ų | 62.7 | 34% | 0.34 | 34% | 0.34 | S | S | . | . | H | α-helix | trans | -60.3 | -38.4 | 174.4 | -75.2 | 172.2 | 0 | 0 | 0 | 111.6 | L169 T289 F290 I291 V296 Y297 | L169-L293 HydrophobicContact CD2-CD1 3.99Å; T289-L293 HydrophobicContact CG2-CD1 4.02Å; T289-L293 HydrophobicContact CG2-CG 4.39Å; T289-L293 WeakPolarHBondContact O-CB 3.48Å; T289-L293 VanDerWaalsContact O-CG 3.3Å; T289-L293 WeakPolarHBondContact O-CG 3.46Å; T289-L293 PolarHBondContact O-N 3.27Å; F290-L293 PolarHBondContact O-N 3.12Å; I291-L293 PolarHBondContact O-N 2.9Å; L293-V296 PolarHBondContact O-N 3.46Å; L293-Y297 VanDerWaalsContact O-CB 3.28Å; L293-Y297 WeakPolarHBondContact O-CB 3.42Å; L293-Y297 PolarHBondContact O-N 2.86Å |
| 294 | Q | 67.2 | Low | 67 | Low | 6 Ų | 6 | 58.5 Ų | 58.5 | 3% | 0.028 | 32% | 0.321 | C | S | . | . | H | α-helix | trans | -70.3 | -38.4 | 179.9 | -172.3 | 54.2 | 65 | 0 | 0 | 112.9 | P235 I236 F290 I291 C292 Y297 C298 | P235-Q294 HydrophobicContact CB-CG 3.89Å; P235-Q294 HydrophobicContact CG-CG 4.49Å; I236-Q294 WeakPolarHBondContact CD1-O 3.3Å; I236-Q294 HydrophobicContact CG1-CG 3.83Å; F290-Q294 WeakPolarHBondContact O-CB 3.45Å; F290-Q294 PolarHBondContact O-N 3.04Å; I291-Q294 WeakPolarHBondContact O-CB 3.26Å; I291-Q294 PolarHBondContact O-N 2.91Å; I291-Q294 VanDerWaalsContact O-N 3.14Å; C292-Q294 VanDerWaalsContact C-N 3.26Å; C292-Q294 PolarHBondContact O-N 3.42Å; Q294-Y297 PolarHBondContact O-N 2.83Å; Q294-C298 PolarHBondContact O-N 2.96Å; Q294-C298 VanDerWaalsContact O-N 3.07Å |
| 295 | V | 66.8 | Low | 68.1 | Low | 54 Ų | 54 | 57 Ų | 57 | 33% | 0.327 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -61 | -50.2 | 171.4 | 170.3 | 0 | 0 | 0 | 0 | 110.5 | I236 I291 C292 Y297 C298 F299 | I236-V295 HydrophobicContact CD1-CB 4.48Å; I236-V295 HydrophobicContact CD1-CG2 4.22Å; I291-V295 HydrophobicContact CG2-CG2 4.24Å; I291-V295 WeakPolarHBondContact O-CB 3.39Å; I291-V295 VanDerWaalsContact O-CG2 3.3Å; I291-V295 WeakPolarHBondContact O-CG2 3.42Å; I291-V295 PolarHBondContact O-N 2.9Å; C292-V295 PolarHBondContact O-N 3.44Å; V295-Y297 VanDerWaalsContact C-N 3.34Å; V295-Y297 PolarHBondContact O-N 3.35Å; V295-C298 PolarHBondContact O-N 3.3Å; V295-F299 HydrophobicContact CG1-CD2 3.85Å; V295-F299 HydrophobicContact CG1-CE2 3.5Å; V295-F299 VanDerWaalsContact O-CD2 3.22Å; V295-F299 WeakPolarHBondContact O-CD2 3.46Å; V295-F299 PolarHBondContact O-N 3.38Å; V295-F299 VanDerWaalsContact O-N 3.12Å |
| 296 | V | 70.8 | Confident | 69.4 | Low | 86 Ų | 86 | 58.4 Ų | 58.4 | 52% | 0.521 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -59.3 | -44.3 | 175.1 | 172.5 | 0 | 0 | 0 | 0 | 111.3 | C292 L293 C298 F299 V300 | C292-V296 WeakPolarHBondContact O-CG2 3.38Å; C292-V296 PolarHBondContact O-N 3.5Å; L293-V296 PolarHBondContact O-N 3.46Å; V296-C298 VanDerWaalsContact C-N 3.32Å; V296-C298 PolarHBondContact O-N 3.47Å; V296-F299 PolarHBondContact O-N 2.88Å; V296-F299 VanDerWaalsContact O-N 3.16Å; V296-V300 HydrophobicContact CG1-CG2 4.26Å; V296-V300 WeakPolarHBondContact O-CG2 3.37Å; V296-V300 PolarHBondContact O-N 2.95Å |
| 297 | Y | 68.3 | Low | 70.6 | Confident | 15 Ų | 15 | 57 Ų | 57 | 6% | 0.059 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -59.4 | -39.6 | 178.8 | -170.8 | -84.1 | 0 | 0 | 0 | 112.5 | L162 R188 Y191 L293 Q294 V295 V300 G301 | L162-Y297 HydrophobicContact CD2-CD2 3.71Å; L162-Y297 HydrophobicContact CD2-CE2 3.43Å; L162-Y297 VanDerWaalsContact CD2-CE2 3.43Å; L162-Y297 HydrophobicContact CD2-CG 4.4Å; R188-Y297 VanDerWaalsContact NH2-CE2 3.34Å; Y191-Y297 WeakPolarHBondContact CD1-OH 3.3Å; L293-Y297 VanDerWaalsContact O-CB 3.28Å; L293-Y297 WeakPolarHBondContact O-CB 3.42Å; L293-Y297 PolarHBondContact O-N 2.86Å; Q294-Y297 PolarHBondContact O-N 2.83Å; V295-Y297 VanDerWaalsContact C-N 3.34Å; V295-Y297 PolarHBondContact O-N 3.35Å; Y297-V300 PolarHBondContact O-N 2.87Å; Y297-G301 PolarHBondContact O-N 3.44Å |
| 298 | C | 69.6 | Low | 71.6 | Confident | 16 Ų | 16 | 52.6 Ų | 52.6 | 11% | 0.108 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -64.9 | -46.7 | 173 | 175.2 | 0 | 0 | 0 | 0 | 112.4 | L234 I236 Q294 V295 V296 V300 G301 L302 | L234-C298 HydrophobicContact CD2-CB 3.58Å; L234-C298 WeakPolarHBondContact CD2-SG 3.48Å; I236-C298 HydrophobicContact CD1-CB 3.1Å; I236-C298 HydrophobicContact CG1-CB 4.03Å; Q294-C298 PolarHBondContact O-N 2.96Å; Q294-C298 VanDerWaalsContact O-N 3.07Å; V295-C298 PolarHBondContact O-N 3.3Å; V296-C298 VanDerWaalsContact C-N 3.32Å; V296-C298 PolarHBondContact O-N 3.47Å; C298-V300 VanDerWaalsContact C-N 3.28Å; C298-V300 PolarHBondContact O-N 3.36Å; C298-G301 CarbonylContact O-C 3.57Å; C298-G301 PolarHBondContact O-N 3.26Å; C298-G301 VanDerWaalsContact O-N 3.08Å; C298-L302 WeakPolarHBondContact O-CB 3.31Å; C298-L302 WeakPolarHBondContact O-CG 3.44Å; C298-L302 PolarHBondContact O-N 2.95Å |
| 299 | F | 75.7 | Confident | 72.6 | Confident | 142 Ų | 142 | 52.2 Ų | 52.2 | 62% | 0.623 | 28% | 0.277 | S | S | * | . | H | α-helix | trans | -60.2 | -40.3 | 177.2 | -74.9 | -61.1 | 0 | 0 | 0 | 111.8 | V295 V296 F303 | V295-F299 HydrophobicContact CG1-CD2 3.85Å; V295-F299 HydrophobicContact CG1-CE2 3.5Å; V295-F299 VanDerWaalsContact O-CD2 3.22Å; V295-F299 WeakPolarHBondContact O-CD2 3.46Å; V295-F299 PolarHBondContact O-N 3.38Å; V295-F299 VanDerWaalsContact O-N 3.12Å; V296-F299 PolarHBondContact O-N 2.88Å; V296-F299 VanDerWaalsContact O-N 3.16Å; F299-F303 VanDerWaalsContact O-CB 3.25Å; F299-F303 WeakPolarHBondContact O-CB 3.39Å; F299-F303 PolarHBondContact O-N 3.36Å |
| 300 | V | 73.3 | Confident | 73.5 | Confident | 37 Ų | 37 | 50.8 Ų | 50.8 | 22% | 0.224 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -64.3 | -41.5 | 172.9 | 174.7 | 0 | 0 | 0 | 0 | 111.3 | V158 L162 V296 Y297 C298 F303 H304 | V158-V300 HydrophobicContact CG1-CG1 3.81Å; L162-V300 HydrophobicContact CD2-CG1 3.83Å; L162-V300 HydrophobicContact CG-CG1 4.09Å; V296-V300 HydrophobicContact CG1-CG2 4.26Å; V296-V300 WeakPolarHBondContact O-CG2 3.37Å; V296-V300 PolarHBondContact O-N 2.95Å; Y297-V300 PolarHBondContact O-N 2.87Å; C298-V300 VanDerWaalsContact C-N 3.28Å; C298-V300 PolarHBondContact O-N 3.36Å; V300-F303 PolarHBondContact O-N 2.92Å; V300-H304 VanDerWaalsContact O-CB 3.28Å; V300-H304 WeakPolarHBondContact O-CB 3.32Å; V300-H304 PolarHBondContact O-N 3.37Å |
| 301 | G | 72.2 | Confident | 74.2 | Confident | 5 Ų | 5 | 48.3 Ų | 48.3 | 5% | 0.052 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -65.9 | -42.1 | 176.6 | 0 | 0 | 0 | 0 | 0 | 113.9 | Y297 C298 H304 L305 | Y297-G301 PolarHBondContact O-N 3.44Å; C298-G301 CarbonylContact O-C 3.57Å; C298-G301 PolarHBondContact O-N 3.26Å; C298-G301 VanDerWaalsContact O-N 3.08Å; G301-H304 WeakPolarHBondContact O-CB 3.47Å; G301-H304 PolarHBondContact O-N 3.45Å; G301-L305 WeakPolarHBondContact O-CB 3.34Å; G301-L305 PolarHBondContact O-N 3.29Å |
| 302 | L | 77.2 | Confident | 75 | Confident | 72 Ų | 72 | 46.7 Ų | 46.7 | 38% | 0.377 | 25% | 0.254 | S | S | . | . | H | α-helix | trans | -66.2 | -43.6 | 174.2 | -72.2 | 172.3 | 0 | 0 | 0 | 111.2 | F227 C298 H304 L305 L306 | F227-L302 HydrophobicContact CZ-CD2 4.03Å; C298-L302 WeakPolarHBondContact O-CB 3.31Å; C298-L302 WeakPolarHBondContact O-CG 3.44Å; C298-L302 PolarHBondContact O-N 2.95Å; L302-H304 VanDerWaalsContact C-N 3.31Å; L302-H304 PolarHBondContact O-N 2.89Å; L302-L305 WeakPolarHBondContact O-CB 3.26Å; L302-L305 PolarHBondContact O-N 3.36Å; L302-L306 WeakPolarHBondContact O-CG 3.32Å; L302-L306 PolarHBondContact O-N 3.42Å |
| 303 | F | 80 | Confident | 75.6 | Confident | 109 Ų | 109 | 46.5 Ų | 46.5 | 48% | 0.478 | 25% | 0.251 | S | S | . | . | H | α-helix | trans | -59.6 | -44.1 | 172 | 177.5 | -100.1 | 0 | 0 | 0 | 111.2 | V154 V158 F299 V300 L305 L306 V307 | V154-F303 HydrophobicContact CG1-CE1 3.98Å; V154-F303 HydrophobicContact CG1-CZ 4.33Å; V158-F303 HydrophobicContact CG2-CD1 4.19Å; V158-F303 HydrophobicContact CG2-CE1 4.18Å; F299-F303 VanDerWaalsContact O-CB 3.25Å; F299-F303 WeakPolarHBondContact O-CB 3.39Å; F299-F303 PolarHBondContact O-N 3.36Å; V300-F303 PolarHBondContact O-N 2.92Å; F303-L305 VanDerWaalsContact C-N 3.35Å; F303-L305 PolarHBondContact O-N 3.2Å; F303-L306 PolarHBondContact O-N 2.96Å; F303-V307 HydrophobicContact CD1-CG2 4.26Å; F303-V307 HydrophobicContact CE1-CG2 3.83Å; F303-V307 HydrophobicContact CE2-CG2 4.21Å; F303-V307 HydrophobicContact CZ-CG2 3.8Å; F303-V307 WeakPolarHBondContact O-CG2 3.4Å; F303-V307 PolarHBondContact O-N 3Å |
| 304 | H | 78.7 | Confident | 76.1 | Confident | 1 Ų | 1 | 47 Ų | 47 | 1% | 0.005 | 25% | 0.25 | C | S | . | . | H | α-helix | trans | -60.2 | -42.6 | 175.6 | -171 | -103.4 | 0 | 0 | 0 | 112.5 | H155 V158 V195 V300 G301 L302 V307 T308 | H155-H304 AromaticContact CE1-NE2 3.51Å; H155-H304 AromaticContact ND1-CD2 3.58Å; H155-H304 AromaticContact ND1-CE1 3.82Å; H155-H304 AromaticContact ND1-NE2 2.85Å; H155-H304 PolarHBondContact ND1-NE2 3.39Å; V158-H304 HydrophobicContact CG1-CB 3.98Å; V195-H304 VanDerWaalsContact CG1-NE2 3.3Å; V195-H304 WeakPolarHBondContact CG1-NE2 3.22Å; V300-H304 VanDerWaalsContact O-CB 3.28Å; V300-H304 WeakPolarHBondContact O-CB 3.32Å; V300-H304 PolarHBondContact O-N 3.37Å; G301-H304 WeakPolarHBondContact O-CB 3.47Å; G301-H304 PolarHBondContact O-N 3.45Å; L302-H304 VanDerWaalsContact C-N 3.31Å; L302-H304 PolarHBondContact O-N 2.89Å; H304-V307 PolarHBondContact O-N 3.09Å; H304-T308 PolarHBondContact CE1-OG1 3Å; H304-T308 WeakPolarHBondContact O-CB 3.4Å; H304-T308 PolarHBondContact O-N 3.25Å; H304-T308 PolarHBondContact O-OG1 3.42Å |
| 305 | L | 78.3 | Confident | 76.5 | Confident | 28 Ų | 28 | 46.8 Ų | 46.8 | 15% | 0.147 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -60.7 | -46.2 | 175.4 | -176.9 | 70.8 | 0 | 0 | 0 | 111.1 | L223 I224 F227 G301 L302 F303 V307 T308 I309 | L223-L305 HydrophobicContact CD2-CD1 4.31Å; I224-L305 HydrophobicContact CG1-CD1 3.99Å; F227-L305 HydrophobicContact CB-CD1 4.43Å; F227-L305 HydrophobicContact CD1-CD1 4.29Å; F227-L305 HydrophobicContact CD1-CD2 3.83Å; F227-L305 HydrophobicContact CE1-CD2 3.67Å; F227-L305 HydrophobicContact CG-CD1 4.23Å; F227-L305 HydrophobicContact CG-CD2 4.46Å; F227-L305 HydrophobicContact CZ-CD2 4.16Å; G301-L305 WeakPolarHBondContact O-CB 3.34Å; G301-L305 PolarHBondContact O-N 3.29Å; L302-L305 WeakPolarHBondContact O-CB 3.26Å; L302-L305 PolarHBondContact O-N 3.36Å; F303-L305 VanDerWaalsContact C-N 3.35Å; F303-L305 PolarHBondContact O-N 3.2Å; L305-V307 PolarHBondContact O-N 3.05Å; L305-T308 WeakPolarHBondContact O-CB 3.45Å; L305-T308 PolarHBondContact O-N 2.81Å; L305-I309 HydrophobicContact CD1-CD1 4.35Å; L305-I309 HydrophobicContact CG-CD1 3.94Å; L305-I309 VanDerWaalsContact O-CG1 3.31Å; L305-I309 WeakPolarHBondContact O-CG1 3.22Å; L305-I309 PolarHBondContact O-N 2.85Å |
| 306 | L | 82.3 | Confident | 77.1 | Confident | 118 Ų | 118 | 49.4 Ų | 49.4 | 62% | 0.618 | 26% | 0.257 | S | S | * | . | H | α-helix | trans | -61.2 | -43.5 | 176.8 | -69.5 | 172.9 | 0 | 0 | 0 | 112.2 | L302 F303 T308 I309 A310 | L302-L306 WeakPolarHBondContact O-CG 3.32Å; L302-L306 PolarHBondContact O-N 3.42Å; F303-L306 PolarHBondContact O-N 2.96Å; L306-T308 VanDerWaalsContact C-N 3.34Å; L306-I309 PolarHBondContact O-N 3.04Å; L306-A310 WeakPolarHBondContact O-CB 3.3Å; L306-A310 PolarHBondContact O-N 3.47Å |
| 307 | V | 80.7 | Confident | 77.5 | Confident | 23 Ų | 23 | 53.5 Ų | 53.5 | 14% | 0.139 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -64.3 | -39.4 | 174.3 | 176.7 | 0 | 0 | 0 | 0 | 110.9 | V154 F303 H304 L305 A310 T311 | V154-V307 HydrophobicContact CG1-CG1 4.04Å; V154-V307 HydrophobicContact CG1-CG2 4.09Å; F303-V307 HydrophobicContact CD1-CG2 4.26Å; F303-V307 HydrophobicContact CE1-CG2 3.83Å; F303-V307 HydrophobicContact CE2-CG2 4.21Å; F303-V307 HydrophobicContact CZ-CG2 3.8Å; F303-V307 WeakPolarHBondContact O-CG2 3.4Å; F303-V307 PolarHBondContact O-N 3Å; H304-V307 PolarHBondContact O-N 3.09Å; L305-V307 PolarHBondContact O-N 3.05Å; V307-A310 PolarHBondContact O-N 3.25Å; V307-T311 WeakPolarHBondContact O-CB 3.3Å; V307-T311 PolarHBondContact O-N 3.33Å; V307-T311 PolarHBondContact O-OG1 2.93Å |
| 308 | T | 78.7 | Confident | 77.6 | Confident | 0 Ų | 0 | 54.4 Ų | 54.4 | 0% | 0 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -63.1 | -45.4 | 176.3 | -55.5 | 0 | 0 | 0 | 0 | 111.5 | H155 C220 L223 H304 L305 L306 T311 M312 | H155-T308 PolarHBondContact CE1-OG1 2.89Å; C220-T308 HydrophobicContact CB-CG2 3.6Å; L223-T308 HydrophobicContact CD2-CG2 4.19Å; H304-T308 PolarHBondContact CE1-OG1 3Å; H304-T308 WeakPolarHBondContact O-CB 3.4Å; H304-T308 PolarHBondContact O-N 3.25Å; H304-T308 PolarHBondContact O-OG1 3.42Å; L305-T308 WeakPolarHBondContact O-CB 3.45Å; L305-T308 PolarHBondContact O-N 2.81Å; L306-T308 VanDerWaalsContact C-N 3.34Å; T308-T311 WeakPolarHBondContact O-CB 3.44Å; T308-T311 PolarHBondContact O-N 3.32Å; T308-M312 WeakPolarHBondContact O-CG 3.37Å; T308-M312 PolarHBondContact O-N 3.11Å |
| 309 | I | 81 | Confident | 77.7 | Confident | 75 Ų | 75 | 54.9 Ų | 54.9 | 39% | 0.385 | 27% | 0.269 | S | S | . | . | H | α-helix | trans | -64 | -44 | 176.4 | -68.1 | 165.3 | 0 | 0 | 0 | 110.6 | I224 L305 L306 T311 M312 V313 | I224-I309 HydrophobicContact CD1-CG1 4.1Å; L305-I309 HydrophobicContact CD1-CD1 4.35Å; L305-I309 HydrophobicContact CG-CD1 3.94Å; L305-I309 VanDerWaalsContact O-CG1 3.31Å; L305-I309 WeakPolarHBondContact O-CG1 3.22Å; L305-I309 PolarHBondContact O-N 2.85Å; L306-I309 PolarHBondContact O-N 3.04Å; I309-T311 VanDerWaalsContact C-N 3.31Å; I309-T311 PolarHBondContact O-N 2.93Å; I309-M312 WeakPolarHBondContact O-CB 3.43Å; I309-M312 PolarHBondContact O-N 2.96Å; I309-V313 WeakPolarHBondContact O-CG2 3.47Å; I309-V313 PolarHBondContact O-N 3.21Å |
| 310 | A | 81.6 | Confident | 77.5 | Confident | 40 Ų | 40 | 49.8 Ų | 49.8 | 33% | 0.331 | 26% | 0.257 | S | S | . | . | H | α-helix | trans | -59.1 | -44 | 174.6 | 0 | 0 | 0 | 0 | 0 | 111.2 | L306 V307 M312 V313 F314 | L306-A310 WeakPolarHBondContact O-CB 3.3Å; L306-A310 PolarHBondContact O-N 3.47Å; V307-A310 PolarHBondContact O-N 3.25Å; A310-M312 VanDerWaalsContact C-N 3.34Å; A310-M312 PolarHBondContact O-N 3.18Å; A310-V313 PolarHBondContact O-N 2.9Å; A310-F314 HydrophobicContact CB-CE2 4.3Å; A310-F314 WeakPolarHBondContact O-CD2 3.32Å; A310-F314 PolarHBondContact O-N 3.4Å |
| 311 | T | 77.7 | Confident | 77.2 | Confident | 7 Ų | 7 | 51 Ų | 51 | 4% | 0.043 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -58.4 | -44.3 | 175.3 | -55.6 | 0 | 0 | 0 | 0 | 111.6 | V151 H155 L216 V307 T308 I309 F314 V315 | V151-T311 HydrophobicContact CG1-CG2 3.9Å; V151-T311 WeakPolarHBondContact CG1-OG1 3.3Å; H155-T311 PolarHBondContact NE2-OG1 2.91Å; L216-T311 HydrophobicContact CD2-CG2 4.28Å; V307-T311 WeakPolarHBondContact O-CB 3.3Å; V307-T311 PolarHBondContact O-N 3.33Å; V307-T311 PolarHBondContact O-OG1 2.93Å; T308-T311 WeakPolarHBondContact O-CB 3.44Å; T308-T311 PolarHBondContact O-N 3.32Å; I309-T311 VanDerWaalsContact C-N 3.31Å; I309-T311 PolarHBondContact O-N 2.93Å; T311-F314 PolarHBondContact O-N 3.4Å; T311-V315 HydrophobicContact CG2-CG2 4.35Å; T311-V315 VanDerWaalsContact O-CG2 3.31Å; T311-V315 WeakPolarHBondContact O-CG2 3.47Å; T311-V315 PolarHBondContact O-N 3.06Å |
| 312 | M | 79.9 | Confident | 76.9 | Confident | 10 Ų | 10 | 52.9 Ų | 52.9 | 5% | 0.049 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -57.8 | -51 | 173.3 | -73.9 | -62.2 | 90.4 | 0 | 0 | 112.5 | L216 P217 C220 I224 T308 I309 A310 F314 V315 F316 | L216-M312 HydrophobicContact CG-CE 4.39Å; P217-M312 VanDerWaalsContact CA-SD 3.58Å; P217-M312 HydrophobicContact CB-CE 4.4Å; P217-M312 HydrophobicContact CB-SD 4.23Å; P217-M312 HydrophobicContact CG-CE 4.44Å; C220-M312 HydrophobicContact CB-CE 3.35Å; C220-M312 HydrophobicContact CB-CG 3.64Å; C220-M312 HydrophobicContact CB-SD 3.4Å; C220-M312 WeakPolarHBondContact CB-SD 3.45Å; C220-M312 VanDerWaalsContact SG-CE 3.54Å; I224-M312 HydrophobicContact CD1-CG 4.49Å; T308-M312 WeakPolarHBondContact O-CG 3.37Å; T308-M312 PolarHBondContact O-N 3.11Å; I309-M312 WeakPolarHBondContact O-CB 3.43Å; I309-M312 PolarHBondContact O-N 2.96Å; A310-M312 VanDerWaalsContact C-N 3.34Å; A310-M312 PolarHBondContact O-N 3.18Å; M312-F314 VanDerWaalsContact C-N 3.27Å; M312-F314 PolarHBondContact O-N 2.74Å; M312-V315 PolarHBondContact O-N 3.22Å; M312-F316 HydrophobicContact CB-CD2 4.26Å; M312-F316 HydrophobicContact CB-CE2 4.21Å; M312-F316 WeakPolarHBondContact O-CB 3.38Å; M312-F316 WeakPolarHBondContact O-CD2 3.36Å; M312-F316 PolarHBondContact O-N 3.43Å; M312-F316 HydrophobicContact SD-CE2 4.04Å |
| 313 | V | 81.4 | Confident | 76.1 | Confident | 68 Ų | 68 | 56.3 Ų | 56.3 | 41% | 0.412 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -59.7 | -38.2 | 178.2 | 174.1 | 0 | 0 | 0 | 0 | 111.5 | I309 A310 R317 | I309-V313 WeakPolarHBondContact O-CG2 3.47Å; I309-V313 PolarHBondContact O-N 3.21Å; A310-V313 PolarHBondContact O-N 2.9Å; V313-R317 WeakPolarHBondContact O-CB 3.29Å; V313-R317 VanDerWaalsContact O-CG 3.3Å; V313-R317 WeakPolarHBondContact O-CG 3.4Å; V313-R317 PolarHBondContact O-N 3.46Å; V313-R317 VanDerWaalsContact O-N 3.13Å |
| 314 | F | 76.6 | Confident | 74.6 | Confident | 75 Ų | 75 | 55.1 Ų | 55.1 | 33% | 0.329 | 29% | 0.293 | S | S | . | . | H | α-helix | trans | -67.7 | -46.2 | 175.3 | -73.2 | -58 | 0 | 0 | 0 | 112.8 | A310 T311 M312 R317 I318 | A310-F314 HydrophobicContact CB-CE2 4.3Å; A310-F314 WeakPolarHBondContact O-CD2 3.32Å; A310-F314 PolarHBondContact O-N 3.4Å; T311-F314 PolarHBondContact O-N 3.4Å; M312-F314 VanDerWaalsContact C-N 3.27Å; M312-F314 PolarHBondContact O-N 2.74Å; F314-R317 PolarHBondContact O-N 3.31Å; F314-I318 WeakPolarHBondContact O-CG1 3.36Å; F314-I318 PolarHBondContact O-N 3.2Å; F314-I318 VanDerWaalsContact O-N 3.09Å |
| 315 | V | 75.8 | Confident | 73 | Confident | 2 Ų | 2 | 57.9 Ų | 57.9 | 1% | 0.012 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -66.4 | -42.8 | 179.9 | 175.8 | 0 | 0 | 0 | 0 | 111.3 | L213 L216 P217 T311 M312 R317 I318 I319 | L213-V315 HydrophobicContact CD1-CG1 3.94Å; L213-V315 HydrophobicContact CD1-CG2 4.35Å; L213-V315 HydrophobicContact CG-CG1 4.27Å; L216-V315 HydrophobicContact CD2-CG2 3.82Å; L216-V315 HydrophobicContact CG-CG2 4.47Å; P217-V315 HydrophobicContact CG-CG1 3.63Å; T311-V315 HydrophobicContact CG2-CG2 4.35Å; T311-V315 VanDerWaalsContact O-CG2 3.31Å; T311-V315 WeakPolarHBondContact O-CG2 3.47Å; T311-V315 PolarHBondContact O-N 3.06Å; M312-V315 PolarHBondContact O-N 3.22Å; V315-R317 VanDerWaalsContact C-N 3.32Å; V315-R317 PolarHBondContact O-N 2.84Å; V315-I318 WeakPolarHBondContact O-CB 3.49Å; V315-I318 PolarHBondContact O-N 3.03Å; V315-I318 VanDerWaalsContact O-N 3.09Å; V315-I319 HydrophobicContact CG1-CD1 3.79Å; V315-I319 HydrophobicContact CG1-CG1 4.35Å; V315-I319 WeakPolarHBondContact O-CG1 3.36Å; V315-I319 PolarHBondContact O-N 3.16Å |
| 316 | F | 78.7 | Confident | 71.8 | Confident | 109 Ų | 109 | 64.1 Ų | 64.1 | 48% | 0.478 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -62.7 | -36.8 | 175.2 | -75.9 | -57.7 | 0 | 0 | 0 | 112.6 | P217 M312 I318 I319 G320 | P217-F316 HydrophobicContact CB-CE1 4.46Å; P217-F316 HydrophobicContact CB-CZ 4.23Å; M312-F316 HydrophobicContact CB-CD2 4.26Å; M312-F316 HydrophobicContact CB-CE2 4.21Å; M312-F316 WeakPolarHBondContact O-CB 3.38Å; M312-F316 WeakPolarHBondContact O-CD2 3.36Å; M312-F316 PolarHBondContact O-N 3.43Å; M312-F316 HydrophobicContact SD-CE2 4.04Å; F316-I318 VanDerWaalsContact C-N 3.33Å; F316-I318 PolarHBondContact O-N 2.85Å; F316-I319 PolarHBondContact O-N 3.1Å; F316-G320 PolarHBondContact O-N 3.43Å |
| 317 | R | 78.9 | Confident | 69.8 | Low | 172 Ų | 172 | 66.5 Ų | 66.5 | 65% | 0.649 | 34% | 0.344 | S | S | * | . | H | α-helix | trans | -63.4 | -36.6 | 172 | -79.8 | 176.4 | 174 | 169.4 | -0.2 | 112.6 | V313 F314 V315 S321 | V313-R317 WeakPolarHBondContact O-CB 3.29Å; V313-R317 VanDerWaalsContact O-CG 3.3Å; V313-R317 WeakPolarHBondContact O-CG 3.4Å; V313-R317 PolarHBondContact O-N 3.46Å; V313-R317 VanDerWaalsContact O-N 3.13Å; F314-R317 PolarHBondContact O-N 3.31Å; V315-R317 VanDerWaalsContact C-N 3.32Å; V315-R317 PolarHBondContact O-N 2.84Å; R317-S321 VanDerWaalsContact O-CB 3.26Å; R317-S321 WeakPolarHBondContact O-CB 3.34Å; R317-S321 PolarHBondContact O-N 2.86Å |
| 318 | I | 70.8 | Confident | 67.9 | Low | 34 Ų | 34 | 72.7 Ų | 72.7 | 17% | 0.174 | 38% | 0.375 | C | S | . | . | H | α-helix | trans | -69.2 | -46.6 | 176.2 | -67 | 165.5 | 0 | 0 | 0 | 110.8 | F144 I148 L213 F314 V315 F316 G320 S321 S322 | F144-I318 HydrophobicContact CB-CD1 4.49Å; I148-I318 HydrophobicContact CD1-CD1 3.73Å; I148-I318 HydrophobicContact CG1-CD1 4.4Å; L213-I318 HydrophobicContact CD2-CG2 4.07Å; F314-I318 WeakPolarHBondContact O-CG1 3.36Å; F314-I318 PolarHBondContact O-N 3.2Å; F314-I318 VanDerWaalsContact O-N 3.09Å; V315-I318 WeakPolarHBondContact O-CB 3.49Å; V315-I318 PolarHBondContact O-N 3.03Å; V315-I318 VanDerWaalsContact O-N 3.09Å; F316-I318 VanDerWaalsContact C-N 3.33Å; F316-I318 PolarHBondContact O-N 2.85Å; I318-G320 VanDerWaalsContact C-N 3.33Å; I318-G320 PolarHBondContact O-N 3.38Å; I318-S321 PolarHBondContact O-N 3.37Å; I318-S322 PolarHBondContact O-N 3.43Å; I318-S322 PolarHBondContact O-OG 2.99Å |
| 319 | I | 71.5 | Confident | 66.2 | Low | 25 Ų | 25 | 82.6 Ų | 82.6 | 13% | 0.128 | 42% | 0.421 | C | S | . | . | H | α-helix | trans | -63.4 | -39.3 | 177.5 | -64.7 | 169.7 | 0 | 0 | 0 | 111 | P217 V315 F316 S322 K323 | P217-I319 HydrophobicContact CG-CD1 4.14Å; V315-I319 HydrophobicContact CG1-CD1 3.79Å; V315-I319 HydrophobicContact CG1-CG1 4.35Å; V315-I319 WeakPolarHBondContact O-CG1 3.36Å; V315-I319 PolarHBondContact O-N 3.16Å; F316-I319 PolarHBondContact O-N 3.1Å; I319-S322 PolarHBondContact O-N 2.86Å; I319-S322 PolarHBondContact O-OG 3.5Å; I319-K323 WeakPolarHBondContact O-CG 3.44Å; I319-K323 PolarHBondContact O-N 2.91Å; I319-K323 VanDerWaalsContact O-N 3.1Å |
| 320 | G | 71.6 | Confident | 65.5 | Low | 36 Ų | 36 | 83 Ų | 83 | 37% | 0.371 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -61.6 | -48.5 | 172.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | F316 I318 S322 K323 T324 | F316-G320 PolarHBondContact O-N 3.43Å; I318-G320 VanDerWaalsContact C-N 3.33Å; I318-G320 PolarHBondContact O-N 3.38Å; G320-S322 VanDerWaalsContact C-N 3.33Å; G320-S322 PolarHBondContact O-N 3.13Å; G320-K323 PolarHBondContact O-N 3.15Å; G320-T324 PolarHBondContact O-N 2.96Å; G320-T324 PolarHBondContact O-OG1 3.03Å |
| 321 | S | 67.3 | Low | 64.7 | Low | 61 Ų | 61 | 85.3 Ų | 85.3 | 43% | 0.427 | 43% | 0.428 | S | S | . | . | H | α-helix | trans | -61.8 | -37.2 | 178 | -169 | 0 | 0 | 0 | 0 | 112.8 | R317 I318 T324 L325 | R317-S321 VanDerWaalsContact O-CB 3.26Å; R317-S321 WeakPolarHBondContact O-CB 3.34Å; R317-S321 PolarHBondContact O-N 2.86Å; I318-S321 PolarHBondContact O-N 3.37Å; S321-T324 VanDerWaalsContact C-OG1 3.32Å; S321-T324 VanDerWaalsContact CA-OG1 3.3Å; S321-T324 WeakPolarHBondContact CA-OG1 3.49Å; S321-T324 PolarHBondContact O-N 2.69Å; S321-T324 PolarHBondContact O-OG1 3.07Å; S321-L325 WeakPolarHBondContact O-CB 3.39Å; S321-L325 PolarHBondContact O-N 3.25Å |
| 322 | S | 65.1 | Low | 63.9 | Low | 45 Ų | 45 | 89.6 Ų | 89.6 | 32% | 0.315 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -71.4 | -35.5 | 177.5 | 71.1 | 0 | 0 | 0 | 0 | 112.6 | I318 I319 G320 L325 K326 | I318-S322 PolarHBondContact O-N 3.43Å; I318-S322 PolarHBondContact O-OG 2.99Å; I319-S322 PolarHBondContact O-N 2.86Å; I319-S322 PolarHBondContact O-OG 3.5Å; G320-S322 VanDerWaalsContact C-N 3.33Å; G320-S322 PolarHBondContact O-N 3.13Å; S322-L325 WeakPolarHBondContact O-CB 3.37Å; S322-L325 PolarHBondContact O-N 3.45Å; S322-K326 PolarHBondContact O-N 3.34Å |
| 323 | K | 60.8 | Low | 63 | Low | 144 Ų | 144 | 94.3 Ų | 94.3 | 63% | 0.626 | 47% | 0.473 | S | S | * | . | H | α-helix | trans | -65.5 | -41.4 | 171.7 | -73.1 | -175.8 | -179.9 | -171.5 | 0 | 112.2 | I319 G320 L325 K326 M327 | I319-K323 WeakPolarHBondContact O-CG 3.44Å; I319-K323 PolarHBondContact O-N 2.91Å; I319-K323 VanDerWaalsContact O-N 3.1Å; G320-K323 PolarHBondContact O-N 3.15Å; K323-L325 PolarHBondContact O-N 3.17Å; K323-K326 PolarHBondContact O-N 3.11Å; K323-M327 WeakPolarHBondContact O-CG 3.25Å; K323-M327 PolarHBondContact O-N 2.98Å |
| 324 | T | 49.6 | Very low | 61.8 | Low | 85 Ų | 85 | 95.9 Ų | 95.9 | 52% | 0.521 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -65.1 | -28 | 173.6 | 46.6 | 0 | 0 | 0 | 0 | 112.6 | G320 S321 | G320-T324 PolarHBondContact O-N 2.96Å; G320-T324 PolarHBondContact O-OG1 3.03Å; S321-T324 VanDerWaalsContact C-OG1 3.32Å; S321-T324 VanDerWaalsContact CA-OG1 3.3Å; S321-T324 WeakPolarHBondContact CA-OG1 3.49Å; S321-T324 PolarHBondContact O-N 2.69Å; S321-T324 PolarHBondContact O-OG1 3.07Å |
| 325 | L | 45.6 | Very low | 60.9 | Low | 59 Ų | 59 | 97.3 Ų | 97.3 | 31% | 0.309 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -71.2 | -46.4 | 175.6 | -124.4 | 153.9 | 0 | 0 | 0 | 111.5 | S321 S322 K323 M327 L328 E329 | S321-L325 WeakPolarHBondContact O-CB 3.39Å; S321-L325 PolarHBondContact O-N 3.25Å; S322-L325 WeakPolarHBondContact O-CB 3.37Å; S322-L325 PolarHBondContact O-N 3.45Å; K323-L325 PolarHBondContact O-N 3.17Å; L325-M327 PolarHBondContact O-N 2.92Å; L325-L328 PolarHBondContact O-N 3.38Å; L325-E329 PolarHBondContact O-N 3.48Å |
| 326 | K | 52.1 | Low | 59.8 | Low | 159 Ų | 159 | 104.1 Ų | 104.1 | 69% | 0.691 | 52% | 0.521 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -69.8 | -4.1 | 174.3 | -68.3 | -168.2 | 175.5 | -167.1 | 0 | 115.1 | S322 K323 | S322-K326 PolarHBondContact O-N 3.34Å; K323-K326 PolarHBondContact O-N 3.11Å |
| 327 | M | 41.3 | Very low | 58.3 | Low | 168 Ų | 168 | 103.8 Ų | 103.8 | 83% | 0.828 | 52% | 0.524 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -100.6 | -0 | 171.7 | -69.2 | -85 | -130 | 0 | 0 | 112 | K323 L325 | K323-M327 WeakPolarHBondContact O-CG 3.25Å; K323-M327 PolarHBondContact O-N 2.98Å; L325-M327 PolarHBondContact O-N 2.92Å |
| 328 | L | 40.6 | Very low | 56.6 | Low | 153 Ų | 153 | 98.1 Ų | 98.1 | 80% | 0.801 | 51% | 0.514 | S | S | * | . | trans | -121 | -1.5 | -175.7 | -104.6 | 156.2 | 0 | 0 | 0 | 112.7 | L325 | L325-L328 PolarHBondContact O-N 3.38Š| ||
| 329 | E | 43.3 | Very low | 55.3 | Low | 208 Ų | 208 | 103.9 Ų | 103.9 | 97% | 0.972 | 54% | 0.544 | S | S | * | . | trans | -99 | 0 | 166.4 | -68.4 | 178.5 | 156.1 | 0 | 0 | 109.3 | L325 | L325-E329 PolarHBondContact O-N 3.48Š|
Retrieved 329 of 329 residues in 177.9 ms
(Link to these results)