| 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 | 38.7 | Very low | 49.6 | Very low | 247 Ų | 247 | 132.5 Ų | 132.5 | 100% | 1.217 | 76% | 0.762 | S | S | * | * | 0 | 111.3 | 0 | -70.5 | 174.4 | -162.4 | 0 | 0 | 108.4 | |||||
| 2 | A | 42.8 | Very low | 50.5 | Low | 107 Ų | 107 | 130.4 Ų | 130.4 | 88% | 0.884 | 74% | 0.738 | S | S | * | * | P | Polyproline II helix | trans | -90 | 123.9 | 176.7 | 0 | 0 | 0 | 0 | 0 | 109.5 | ||
| 3 | K | 44.8 | Very low | 51.4 | Low | 199 Ų | 199 | 130.2 Ų | 130.2 | 87% | 0.865 | 73% | 0.727 | S | S | * | * | P | Polyproline II helix | trans | -84.2 | 135 | 172.2 | -78.9 | 171.2 | 173.3 | 171.6 | 0 | 108.8 | ||
| 4 | P | 46.9 | Very low | 52.2 | Low | 118 Ų | 118 | 127.1 Ų | 127.1 | 77% | 0.766 | 70% | 0.702 | S | S | * | * | P | Polyproline II helix | trans | -74.1 | 137 | -171.2 | 28.5 | -32.1 | 0 | 0 | 0 | 112.1 | ||
| 5 | T | 52.2 | Low | 53 | Low | 138 Ų | 138 | 120.6 Ų | 120.6 | 85% | 0.847 | 66% | 0.664 | S | S | * | * | P | Polyproline II helix | trans | -68.3 | 120.2 | 166.1 | 48.4 | 0 | 0 | 0 | 0 | 110.4 | ||
| 6 | S | 45.8 | Very low | 53.5 | Low | 109 Ų | 109 | 120.8 Ų | 120.8 | 76% | 0.762 | 66% | 0.656 | S | S | * | * | trans | -125.4 | 94.3 | 171.1 | -82.1 | 0 | 0 | 0 | 0 | 112.2 | D8 | S6-D8 PolarHBondContact O-N 3.42Š| ||
| 7 | K | 52.5 | Low | 54.2 | Low | 213 Ų | 213 | 120.9 Ų | 120.9 | 93% | 0.926 | 65% | 0.654 | S | S | * | * | 25.6 | 74 | 126.8 | -98.9 | 164.9 | 174.3 | 170.1 | 0 | 117.4 | |||||
| 8 | D | 52.5 | Low | 54.8 | Low | 112 Ų | 112 | 121.3 Ų | 121.3 | 60% | 0.599 | 66% | 0.655 | S | S | * | * | trans | -102.1 | 3.2 | 162.6 | -178.5 | -101.3 | 0 | 0 | 0 | 112.3 | S6 K12 | S6-D8 PolarHBondContact O-N 3.42Å; D8-K12 WeakPolarHBondContact O-CG 3.43Å; D8-K12 PolarHBondContact O-NZ 3.34Å; D8-K12 IonicContact OD1-NZ 2.85Å; D8-K12 PolarHBondContact OD1-NZ 2.78Å | ||
| 9 | S | 51.4 | Low | 55.1 | Low | 66 Ų | 66 | 117.8 Ų | 117.8 | 46% | 0.462 | 64% | 0.636 | S | S | . | * | H | α-helix | trans | -89.5 | -26.8 | -170.8 | -64.9 | 0 | 0 | 0 | 0 | 116.2 | L11 K12 E13 | S9-L11 PolarHBondContact O-N 3.06Å; S9-K12 VanDerWaalsContact O-CG 3.27Å; S9-K12 WeakPolarHBondContact O-CG 3.29Å; S9-K12 VanDerWaalsContact OG-CE 3.29Å; S9-K12 WeakPolarHBondContact OG-CE 3.28Å; S9-K12 PolarHBondContact OG-NZ 3.45Å; S9-K12 VanDerWaalsContact OG-NZ 3.11Å; S9-E13 WeakPolarHBondContact O-CB 3.46Å; S9-E13 PolarHBondContact O-N 3.33Å |
| 10 | G | 54.3 | Low | 55.3 | Low | 55 Ų | 55 | 114.9 Ų | 114.9 | 57% | 0.567 | 63% | 0.634 | S | S | * | * | H | α-helix | trans | -74 | -25.6 | -175.1 | 0 | 0 | 0 | 0 | 0 | 114.9 | K14 | G10-K14 WeakPolarHBondContact O-CG 3.35Å; G10-K14 PolarHBondContact O-N 3.48Å |
| 11 | L | 63.7 | Low | 55.6 | Low | 94 Ų | 94 | 115.4 Ų | 115.4 | 49% | 0.492 | 64% | 0.636 | S | S | . | * | H | α-helix | trans | -80.9 | -46.8 | 180 | -139.8 | 113.2 | 0 | 0 | 0 | 111.4 | S9 E13 K14 F15 | S9-L11 PolarHBondContact O-N 3.06Å; L11-E13 VanDerWaalsContact C-N 3.28Å; L11-E13 PolarHBondContact O-N 3.43Å; L11-K14 WeakPolarHBondContact O-CG 3.27Å; L11-K14 PolarHBondContact O-N 3.37Å; L11-F15 HydrophobicContact CD2-CD2 4.06Å; L11-F15 HydrophobicContact CD2-CE2 3.87Å; L11-F15 HydrophobicContact CG-CD2 4.35Å; L11-F15 HydrophobicContact CG-CE2 4.35Å; L11-F15 WeakPolarHBondContact O-CD2 3.14Å; L11-F15 PolarHBondContact O-N 3.39Å |
| 12 | K | 59.9 | Low | 56 | Low | 107 Ų | 107 | 105.8 Ų | 105.8 | 47% | 0.465 | 60% | 0.599 | S | S | . | * | H | α-helix | trans | -61.9 | -35.3 | 177.6 | 57.7 | 177.3 | 172.6 | -99.5 | 0 | 113.2 | D8 S9 K16 | D8-K12 WeakPolarHBondContact O-CG 3.43Å; D8-K12 PolarHBondContact O-NZ 3.34Å; D8-K12 IonicContact OD1-NZ 2.85Å; D8-K12 PolarHBondContact OD1-NZ 2.78Å; S9-K12 VanDerWaalsContact O-CG 3.27Å; S9-K12 WeakPolarHBondContact O-CG 3.29Å; S9-K12 VanDerWaalsContact OG-CE 3.29Å; S9-K12 WeakPolarHBondContact OG-CE 3.28Å; S9-K12 PolarHBondContact OG-NZ 3.45Å; S9-K12 VanDerWaalsContact OG-NZ 3.11Å; K12-K16 WeakPolarHBondContact O-CB 3.32Å; K12-K16 PolarHBondContact O-N 3.46Å |
| 13 | E | 62.3 | Low | 56.2 | Low | 128 Ų | 128 | 107.3 Ų | 107.3 | 60% | 0.598 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -74.6 | -42.7 | -178 | -156.1 | 159.4 | 96.7 | 0 | 0 | 111.7 | S9 L11 F15 K16 I17 | S9-E13 WeakPolarHBondContact O-CB 3.46Å; S9-E13 PolarHBondContact O-N 3.33Å; L11-E13 VanDerWaalsContact C-N 3.28Å; L11-E13 PolarHBondContact O-N 3.43Å; E13-F15 VanDerWaalsContact C-N 3.32Å; E13-F15 PolarHBondContact O-N 3.18Å; E13-K16 PolarHBondContact O-N 2.89Å; E13-I17 WeakPolarHBondContact O-CD1 3.31Å; E13-I17 VanDerWaalsContact O-CG1 3.28Å; E13-I17 WeakPolarHBondContact O-CG1 3.39Å; E13-I17 PolarHBondContact O-N 3.41Å; E13-I17 VanDerWaalsContact O-N 3.13Å |
| 14 | K | 62.6 | Low | 56.2 | Low | 87 Ų | 87 | 103.7 Ų | 103.7 | 38% | 0.378 | 60% | 0.595 | S | S | . | * | H | α-helix | trans | -64.2 | -36.5 | 173.2 | 68.7 | 170.3 | 177.7 | -99.3 | 0 | 112.7 | G10 L11 K16 I17 L18 | G10-K14 WeakPolarHBondContact O-CG 3.35Å; G10-K14 PolarHBondContact O-N 3.48Å; L11-K14 WeakPolarHBondContact O-CG 3.27Å; L11-K14 PolarHBondContact O-N 3.37Å; K14-K16 VanDerWaalsContact C-N 3.35Å; K14-I17 PolarHBondContact O-N 3.33Å; K14-L18 WeakPolarHBondContact O-CB 3.24Å; K14-L18 PolarHBondContact O-N 3.31Å |
| 15 | F | 64.4 | Low | 56.3 | Low | 29 Ų | 29 | 109.2 Ų | 109.2 | 13% | 0.127 | 60% | 0.6 | C | S | . | * | H | α-helix | trans | -69.7 | -33.2 | 176.6 | -93.6 | -85.7 | 0 | 0 | 0 | 111.8 | L11 E13 I17 L18 L19 | L11-F15 HydrophobicContact CD2-CD2 4.06Å; L11-F15 HydrophobicContact CD2-CE2 3.87Å; L11-F15 HydrophobicContact CG-CD2 4.35Å; L11-F15 HydrophobicContact CG-CE2 4.35Å; L11-F15 WeakPolarHBondContact O-CD2 3.14Å; L11-F15 PolarHBondContact O-N 3.39Å; E13-F15 VanDerWaalsContact C-N 3.32Å; E13-F15 PolarHBondContact O-N 3.18Å; F15-I17 VanDerWaalsContact C-N 3.31Å; F15-I17 PolarHBondContact O-N 2.82Å; F15-L18 PolarHBondContact O-N 3.13Å; F15-L19 HydrophobicContact CD1-CD1 3.9Å; F15-L19 VanDerWaalsContact O-CB 3.24Å; F15-L19 WeakPolarHBondContact O-CB 3.48Å; F15-L19 VanDerWaalsContact O-CD1 3.31Å; F15-L19 WeakPolarHBondContact O-CD1 3.36Å; F15-L19 PolarHBondContact O-N 3.03Å |
| 16 | K | 61.3 | Low | 56.1 | Low | 124 Ų | 124 | 108.4 Ų | 108.4 | 54% | 0.539 | 60% | 0.598 | S | S | . | * | H | α-helix | trans | -67.6 | -33.4 | 174.7 | -160.6 | 172.2 | 173 | -174.5 | 0 | 112.3 | K12 E13 K14 L21 | K12-K16 WeakPolarHBondContact O-CB 3.32Å; K12-K16 PolarHBondContact O-N 3.46Å; E13-K16 PolarHBondContact O-N 2.89Å; K14-K16 VanDerWaalsContact C-N 3.35Å; K16-L21 HydrophobicContact CG-CB 4.02Å; K16-L21 PolarHBondContact O-N 3.11Å |
| 17 | I | 65 | Low | 55.7 | Low | 123 Ų | 123 | 110.4 Ų | 110.4 | 63% | 0.631 | 60% | 0.6 | S | S | * | * | H | α-helix | trans | -72.6 | -44.5 | 174 | -63 | 163.6 | 0 | 0 | 0 | 110.6 | E13 K14 F15 G20 | E13-I17 WeakPolarHBondContact O-CD1 3.31Å; E13-I17 VanDerWaalsContact O-CG1 3.28Å; E13-I17 WeakPolarHBondContact O-CG1 3.39Å; E13-I17 PolarHBondContact O-N 3.41Å; E13-I17 VanDerWaalsContact O-N 3.13Å; K14-I17 PolarHBondContact O-N 3.33Å; F15-I17 VanDerWaalsContact C-N 3.31Å; F15-I17 PolarHBondContact O-N 2.82Å; I17-G20 PolarHBondContact O-N 2.85Å |
| 18 | L | 64.6 | Low | 55.9 | Low | 128 Ų | 128 | 104.8 Ų | 104.8 | 67% | 0.67 | 59% | 0.585 | S | S | * | * | H | α-helix | trans | -69.9 | -32.5 | 176.6 | -87.5 | 153.1 | 0 | 0 | 0 | 113.6 | K14 F15 G20 | K14-L18 WeakPolarHBondContact O-CB 3.24Å; K14-L18 PolarHBondContact O-N 3.31Å; F15-L18 PolarHBondContact O-N 3.13Å; L18-G20 PolarHBondContact O-N 3.23Å |
| 19 | L | 61.9 | Low | 55.8 | Low | 55 Ų | 55 | 110.5 Ų | 110.5 | 29% | 0.288 | 60% | 0.598 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -79.5 | 0.7 | 175.5 | -97.6 | 88.4 | 0 | 0 | 0 | 114.3 | F15 F38 V67 K71 | F15-L19 HydrophobicContact CD1-CD1 3.9Å; F15-L19 VanDerWaalsContact O-CB 3.24Å; F15-L19 WeakPolarHBondContact O-CB 3.48Å; F15-L19 VanDerWaalsContact O-CD1 3.31Å; F15-L19 WeakPolarHBondContact O-CD1 3.36Å; F15-L19 PolarHBondContact O-N 3.03Å; L19-F38 HydrophobicContact CG-CE2 4.43Å; L19-V67 HydrophobicContact CD2-CG2 3.55Å; L19-K71 PolarHBondContact O-NZ 3.49Å |
| 20 | G | 58.9 | Low | 55.2 | Low | 58 Ų | 58 | 113 Ų | 113 | 60% | 0.598 | 62% | 0.615 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 73.1 | 28.8 | 175.2 | 0 | 0 | 0 | 0 | 0 | 114.5 | I17 L18 | I17-G20 PolarHBondContact O-N 2.85Å; L18-G20 PolarHBondContact O-N 3.23Å |
| 21 | L | 60.3 | Low | 54.4 | Low | 127 Ų | 127 | 114.6 Ų | 114.6 | 67% | 0.665 | 62% | 0.623 | S | S | * | * | trans | -103.4 | 22 | 173.2 | -110 | 81.5 | 0 | 0 | 0 | 112.7 | K16 | K16-L21 HydrophobicContact CG-CB 4.02Å; K16-L21 PolarHBondContact O-N 3.11Å | ||
| 22 | G | 47.9 | Very low | 53.4 | Low | 44 Ų | 44 | 119.5 Ų | 119.5 | 45% | 0.454 | 64% | 0.644 | S | S | . | * | S | Bend | trans | -111.5 | 123.6 | 167.5 | 0 | 0 | 0 | 0 | 0 | 109.2 | ||
| 23 | T | 46.3 | Very low | 52.4 | Low | 139 Ų | 139 | 118.2 Ų | 118.2 | 85% | 0.853 | 66% | 0.66 | S | S | * | * | trans | -37.8 | 117.5 | -176.9 | 45.7 | 0 | 0 | 0 | 0 | 114.2 | R25 | T23-R25 PolarHBondContact O-N 3.05Š| ||
| 24 | P | 45.9 | Very low | 51.6 | Low | 123 Ų | 123 | 121.5 Ų | 121.5 | 80% | 0.799 | 67% | 0.672 | S | S | * | * | P | Polyproline II helix | trans | -77 | 120.8 | 165.6 | 30.2 | -28.1 | 0 | 0 | 0 | 108.6 | ||
| 25 | R | 47.8 | Very low | 50.9 | Low | 234 Ų | 234 | 124.5 Ų | 124.5 | 88% | 0.883 | 69% | 0.688 | S | S | * | * | P | Polyproline II helix | trans | -51.2 | 138.2 | 160.6 | -175.5 | -177.6 | -176.7 | 152.2 | 0.8 | 108.6 | T23 N27 | T23-R25 PolarHBondContact O-N 3.05Å; R25-N27 PolarHBondContact O-N 2.92Å |
| 26 | P | 48.5 | Very low | 50.5 | Low | 122 Ų | 122 | 128.3 Ų | 128.3 | 79% | 0.792 | 71% | 0.714 | S | S | * | * | P | Polyproline II helix | trans | -73.4 | 124.1 | -172.6 | 29 | -32.1 | 0 | 0 | 0 | 110.1 | ||
| 27 | N | 36.9 | Very low | 50.8 | Low | 151 Ų | 151 | 126.7 Ų | 126.7 | 81% | 0.807 | 71% | 0.708 | S | S | * | * | trans | -128.1 | 119.3 | 153.6 | -169.4 | 13.9 | 0 | 0 | 0 | 108 | R25 | R25-N27 PolarHBondContact O-N 2.92Š| ||
| 28 | P | 57.3 | Low | 51.4 | Low | 94 Ų | 94 | 121.9 Ų | 121.9 | 61% | 0.61 | 68% | 0.682 | S | S | * | * | trans | -79.9 | 159.1 | -177.6 | 33 | -35.4 | 0 | 0 | 0 | 111.2 | ||||
| 29 | R | 51.2 | Low | 52.3 | Low | 233 Ų | 233 | 120.5 Ų | 120.5 | 88% | 0.879 | 68% | 0.675 | S | S | * | * | trans | 97.1 | 85.5 | 167.8 | -52.2 | 174.7 | -172.3 | -169.9 | 2.3 | 115.4 | ||||
| 30 | S | 38.1 | Very low | 53.4 | Low | 118 Ų | 118 | 118.6 Ų | 118.6 | 83% | 0.825 | 67% | 0.665 | S | S | * | * | 177.5 | 129.3 | 111.6 | -82.1 | 0 | 0 | 0 | 0 | 112.5 | |||||
| 31 | A | 37.3 | Very low | 54.8 | Low | 88 Ų | 88 | 118.9 Ų | 118.9 | 73% | 0.727 | 66% | 0.655 | S | S | * | * | trans | 61.8 | 98 | 148.2 | 0 | 0 | 0 | 0 | 0 | 119 | ||||
| 32 | E | 42.3 | Very low | 56 | Low | 198 Ų | 198 | 116.1 Ų | 116.1 | 93% | 0.925 | 65% | 0.65 | S | S | * | * | S | Bend | 28.5 | 109.7 | 119.6 | -160.9 | 164 | 98.5 | 0 | 0 | 117.1 | |||
| 33 | G | 40.2 | Very low | 57.9 | Low | 79 Ų | 79 | 117.4 Ų | 117.4 | 81% | 0.814 | 65% | 0.645 | S | S | * | * | trans | 100.2 | 5 | 142.3 | 0 | 0 | 0 | 0 | 0 | 120.5 | Q35 | G33-Q35 PolarHBondContact O-N 2.83Š| ||
| 34 | K | 44.2 | Very low | 60 | Low | 197 Ų | 197 | 111.3 Ų | 111.3 | 86% | 0.857 | 61% | 0.607 | S | S | * | * | trans | -95.7 | 98.7 | 177.7 | -75.5 | 169.6 | -179.8 | -179.3 | 0 | 111.6 | T36 | K34-T36 PolarHBondContact O-N 3.31Š| ||
| 35 | Q | 47.9 | Very low | 62.1 | Low | 151 Ų | 151 | 108.1 Ų | 108.1 | 71% | 0.706 | 58% | 0.583 | S | S | * | * | trans | -51 | 130.5 | 161.1 | -73.1 | 178.7 | -3.6 | 0 | 0 | 108.1 | G33 E37 | G33-Q35 PolarHBondContact O-N 2.83Å; Q35-E37 VanDerWaalsContact C-N 3.33Å; Q35-E37 PolarHBondContact O-N 3.48Å | ||
| 36 | T | 56 | Low | 64.2 | Low | 108 Ų | 108 | 104.1 Ų | 104.1 | 66% | 0.663 | 57% | 0.568 | S | S | * | * | trans | -68.7 | 91.4 | -177.4 | -42.1 | 0 | 0 | 0 | 0 | 108.9 | K34 | K34-T36 PolarHBondContact O-N 3.31Š| ||
| 37 | E | 69.2 | Low | 66.3 | Low | 90 Ų | 90 | 101.2 Ų | 101.2 | 42% | 0.421 | 54% | 0.543 | S | S | . | . | P | Polyproline II helix | trans | -66.4 | 137.8 | 177.6 | -68.9 | 178.9 | 123.4 | 0 | 0 | 109.9 | Q35 K72 | Q35-E37 VanDerWaalsContact C-N 3.33Å; Q35-E37 PolarHBondContact O-N 3.48Å; E37-K72 CarbonylContact C-O 3.5Å; E37-K72 VanDerWaalsContact CA-O 3.29Å; E37-K72 WeakPolarHBondContact CA-O 3.4Å; E37-K72 IonicContact OE1-NZ 3.38Å; E37-K72 PolarHBondContact OE1-NZ 2.96Å |
| 38 | F | 77.3 | Confident | 69 | Low | 22 Ų | 22 | 94 Ų | 94 | 10% | 0.096 | 51% | 0.505 | C | S | . | . | B | Isolated β-bridge | trans | -85.8 | 119.1 | 176.5 | -177.6 | -107.7 | 0 | 0 | 0 | 109.8 | L19 I40 I44 V67 K71 K72 F73 E74 | L19-F38 HydrophobicContact CG-CE2 4.43Å; F38-I40 HydrophobicContact CD1-CD1 3.79Å; F38-I40 HydrophobicContact CE1-CD1 3.4Å; F38-I40 VanDerWaalsContact CE1-CD1 3.4Å; F38-I40 HydrophobicContact CZ-CD1 4.45Å; F38-I44 HydrophobicContact CE1-CD1 4.28Å; F38-I44 HydrophobicContact CZ-CD1 3.78Å; F38-V67 HydrophobicContact CB-CG1 4.01Å; F38-V67 HydrophobicContact CD1-CG1 3.89Å; F38-V67 HydrophobicContact CD2-CG1 3.49Å; F38-V67 VanDerWaalsContact CD2-CG1 3.49Å; F38-V67 HydrophobicContact CE1-CG1 4.13Å; F38-V67 HydrophobicContact CE2-CG1 3.8Å; F38-V67 HydrophobicContact CE2-CG2 4.35Å; F38-V67 HydrophobicContact CG-CG1 3.52Å; F38-V67 HydrophobicContact CZ-CG1 4.09Å; F38-V67 HydrophobicContact CZ-CG2 4.39Å; F38-K71 HydrophobicContact CB-CB 4.08Å; F38-K71 HydrophobicContact CB-CD 4.44Å; F38-K72 PolarHBondContact N-O 2.95Å; F38-F73 HydrophobicContact CB-CD1 4.38Å; F38-F73 AromaticContact CD1-CD1 3.6Å; F38-F73 HydrophobicContact CD1-CD1 3.6Å; F38-F73 AromaticContact CD1-CE1 3.39Å; F38-F73 HydrophobicContact CD1-CE1 3.39Å; F38-F73 HydrophobicContact CE1-CD1 4.42Å; F38-F73 AromaticContact CE1-CE1 3.86Å; F38-F73 HydrophobicContact CE1-CE1 3.86Å; F38-F73 HydrophobicContact CG-CD1 4.48Å; F38-F73 HydrophobicContact CG-CE1 4.46Å; F38-E74 PolarHBondContact O-N 2.79Å |
| 39 | I | 83.5 | Confident | 70.6 | Confident | 100 Ų | 100 | 90.8 Ų | 90.8 | 51% | 0.513 | 48% | 0.484 | S | S | . | . | P | Polyproline II helix | trans | -90.1 | 131.7 | -178.6 | -60.9 | 173.5 | 0 | 0 | 0 | 109.4 | T41 E74 | I39-T41 HydrophobicContact CG2-CG2 4.48Å; I39-T41 PolarHBondContact O-N 3.42Å; I39-E74 WeakPolarHBondContact CG2-OE1 3.32Å |
| 40 | I | 85 | Confident | 72.4 | Confident | 14 Ų | 14 | 86.2 Ų | 86.2 | 7% | 0.072 | 48% | 0.475 | C | S | . | . | trans | -88.3 | 95.2 | 175.4 | -61.9 | -62.7 | 0 | 0 | 0 | 108.8 | F38 I44 L45 F73 E74 A77 L81 | F38-I40 HydrophobicContact CD1-CD1 3.79Å; F38-I40 HydrophobicContact CE1-CD1 3.4Å; F38-I40 VanDerWaalsContact CE1-CD1 3.4Å; F38-I40 HydrophobicContact CZ-CD1 4.45Å; I40-I44 HydrophobicContact CG2-CG2 4.34Å; I40-L45 HydrophobicContact CG2-CD1 4.36Å; I40-L45 HydrophobicContact CG2-CD2 3.64Å; I40-L45 HydrophobicContact CG2-CG 3.78Å; I40-F73 HydrophobicContact CD1-CD1 4.15Å; I40-F73 HydrophobicContact CD1-CE1 3.96Å; I40-F73 HydrophobicContact CG1-CD1 4.35Å; I40-E74 PolarHBondContact N-OE1 3.13Å; I40-A77 HydrophobicContact CB-CB 4.1Å; I40-A77 HydrophobicContact CG1-CB 3.37Å; I40-L81 HydrophobicContact CD1-CD1 3.77Å; I40-L81 HydrophobicContact CD1-CD2 3.99Å; I40-L81 HydrophobicContact CD1-CG 3.95Å; I40-L81 HydrophobicContact CG1-CD1 4.09Å; I40-L81 HydrophobicContact CG1-CD2 4.49Å; I40-L81 HydrophobicContact CG1-CG 4.05Å; I40-L81 HydrophobicContact CG2-CD2 4.3Å; I40-L81 HydrophobicContact CG2-CG 4.39Å | ||
| 41 | T | 87.8 | Confident | 74.9 | Confident | 64 Ų | 64 | 88.9 Ų | 88.9 | 39% | 0.393 | 47% | 0.474 | S | S | . | . | trans | -69.3 | 156.4 | -179.8 | 67.7 | 0 | 0 | 0 | 0 | 111.8 | I39 E43 I44 L45 | I39-T41 HydrophobicContact CG2-CG2 4.48Å; I39-T41 PolarHBondContact O-N 3.42Å; T41-E43 PolarHBondContact O-N 3.16Å; T41-E43 VanDerWaalsContact O-N 3.16Å; T41-I44 WeakPolarHBondContact O-CB 3.49Å; T41-I44 PolarHBondContact O-N 3.03Å; T41-I44 PolarHBondContact OG1-N 2.78Å; T41-L45 PolarHBondContact O-N 3.46Å | ||
| 42 | A | 85.8 | Confident | 77.5 | Confident | 69 Ų | 69 | 86.6 Ų | 86.6 | 57% | 0.57 | 45% | 0.452 | S | S | * | . | H | α-helix | trans | -59.5 | -24.4 | 174 | 0 | 0 | 0 | 0 | 0 | 113.1 | R46 | A42-R46 WeakPolarHBondContact O-CB 2.83Å; A42-R46 PolarHBondContact O-N 3.06Å |
| 43 | E | 87.8 | Confident | 79.9 | Confident | 71 Ų | 71 | 79.3 Ų | 79.3 | 33% | 0.332 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -66.7 | -46 | 173.1 | -178.2 | 175.6 | 88.5 | 0 | 0 | 111.4 | T41 L45 R46 E47 | T41-E43 PolarHBondContact O-N 3.16Å; T41-E43 VanDerWaalsContact O-N 3.16Å; E43-L45 VanDerWaalsContact C-N 3.32Å; E43-L45 PolarHBondContact O-N 3.17Å; E43-R46 WeakPolarHBondContact O-CB 3.29Å; E43-R46 PolarHBondContact O-N 3.28Å; E43-R46 VanDerWaalsContact O-N 3.13Å; E43-E47 PolarHBondContact O-N 2.95Å |
| 44 | I | 90.5 | Very high | 82.5 | Confident | 11 Ų | 11 | 77.8 Ų | 77.8 | 6% | 0.056 | 40% | 0.404 | C | S | . | . | H | α-helix | trans | -60 | -45.2 | 176.1 | -65.9 | 169.6 | 0 | 0 | 0 | 110.1 | F38 I40 T41 R46 E47 L48 M60 I64 | F38-I44 HydrophobicContact CE1-CD1 4.28Å; F38-I44 HydrophobicContact CZ-CD1 3.78Å; I40-I44 HydrophobicContact CG2-CG2 4.34Å; T41-I44 WeakPolarHBondContact O-CB 3.49Å; T41-I44 PolarHBondContact O-N 3.03Å; T41-I44 PolarHBondContact OG1-N 2.78Å; I44-R46 VanDerWaalsContact C-N 3.3Å; I44-R46 PolarHBondContact O-N 2.82Å; I44-E47 PolarHBondContact O-N 3.45Å; I44-L48 HydrophobicContact CG2-CD1 4.12Å; I44-L48 WeakPolarHBondContact O-CG 3.48Å; I44-L48 PolarHBondContact O-N 3.18Å; I44-M60 HydrophobicContact CG2-SD 4.49Å; I44-I64 HydrophobicContact CG2-CD1 3.73Å; I44-I64 HydrophobicContact CG2-CG1 4.44Å |
| 45 | L | 90.3 | Very high | 84.9 | Confident | 56 Ų | 56 | 74.4 Ų | 74.4 | 29% | 0.293 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -63.2 | -36.5 | 177.1 | -64.9 | 177.8 | 0 | 0 | 0 | 112.3 | I40 T41 E43 L48 S49 A80 A84 | I40-L45 HydrophobicContact CG2-CD1 4.36Å; I40-L45 HydrophobicContact CG2-CD2 3.64Å; I40-L45 HydrophobicContact CG2-CG 3.78Å; T41-L45 PolarHBondContact O-N 3.46Å; E43-L45 VanDerWaalsContact C-N 3.32Å; E43-L45 PolarHBondContact O-N 3.17Å; L45-L48 CarbonylContact O-C 3.51Å; L45-L48 PolarHBondContact O-N 3.21Å; L45-S49 PolarHBondContact O-N 2.97Å; L45-A80 HydrophobicContact CD1-CB 4.4Å; L45-A80 HydrophobicContact CD2-CB 4.25Å; L45-A84 HydrophobicContact CD2-CB 4.06Å |
| 46 | R | 91.1 | Very high | 87.1 | Confident | 151 Ų | 151 | 71.8 Ų | 71.8 | 57% | 0.57 | 39% | 0.386 | S | S | * | . | H | α-helix | trans | -65.5 | -40.9 | 175.6 | -165.9 | -173.6 | -54.2 | 119.1 | 2.3 | 111.8 | A42 E43 I44 L48 S49 C52 | A42-R46 WeakPolarHBondContact O-CB 2.83Å; A42-R46 PolarHBondContact O-N 3.06Å; E43-R46 WeakPolarHBondContact O-CB 3.29Å; E43-R46 PolarHBondContact O-N 3.28Å; E43-R46 VanDerWaalsContact O-N 3.13Å; I44-R46 VanDerWaalsContact C-N 3.3Å; I44-R46 PolarHBondContact O-N 2.82Å; R46-L48 VanDerWaalsContact C-N 3.27Å; R46-L48 PolarHBondContact O-N 3.28Å; R46-S49 WeakPolarHBondContact O-CB 3.46Å; R46-S49 PolarHBondContact O-N 3.07Å; R46-S49 VanDerWaalsContact O-N 3.15Å; R46-C52 PolarHBondContact O-SG 2.95Å; R46-C52 VanDerWaalsContact O-SG 3.37Å |
| 47 | E | 91.8 | Very high | 89 | Confident | 60 Ų | 60 | 66.9 Ų | 66.9 | 28% | 0.28 | 36% | 0.355 | S | S | . | . | H | α-helix | trans | -69.7 | -25.4 | 175.8 | -69.6 | -166.5 | -144.9 | 0 | 0 | 113 | E43 I44 C52 M60 | E43-E47 PolarHBondContact O-N 2.95Å; I44-E47 PolarHBondContact O-N 3.45Å; E47-C52 WeakPolarHBondContact O-CB 3.13Å; E47-M60 HydrophobicContact CB-CE 3.9Å; E47-M60 HydrophobicContact CB-CG 4.45Å; E47-M60 VanDerWaalsContact CD-CE 3.46Å; E47-M60 HydrophobicContact CG-CE 4.26Å; E47-M60 WeakPolarHBondContact OE2-CE 3.48Å |
| 48 | L | 93.7 | Very high | 90.2 | Very high | 0 Ų | 0 | 64.4 Ų | 64.4 | 0% | 0 | 34% | 0.344 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -85.6 | -6.6 | 171.4 | -68.1 | 175.5 | 0 | 0 | 0 | 113.9 | I44 L45 R46 R57 M60 I61 I64 L81 A84 V85 | I44-L48 HydrophobicContact CG2-CD1 4.12Å; I44-L48 WeakPolarHBondContact O-CG 3.48Å; I44-L48 PolarHBondContact O-N 3.18Å; L45-L48 CarbonylContact O-C 3.51Å; L45-L48 PolarHBondContact O-N 3.21Å; R46-L48 VanDerWaalsContact C-N 3.27Å; R46-L48 PolarHBondContact O-N 3.28Å; L48-R57 VanDerWaalsContact O-CZ 3.31Å; L48-R57 PolarHBondContact O-NE 3.04Å; L48-R57 PolarHBondContact O-NH2 3.24Å; L48-R57 VanDerWaalsContact O-NH2 3.13Å; L48-M60 HydrophobicContact CD2-CB 3.85Å; L48-M60 HydrophobicContact CD2-CG 3.65Å; L48-M60 HydrophobicContact CG-CG 3.9Å; L48-I61 HydrophobicContact CD2-CD1 4.48Å; L48-I61 HydrophobicContact CD2-CG1 3.74Å; L48-I64 HydrophobicContact CD1-CD1 3.79Å; L48-I64 HydrophobicContact CD2-CD1 4.49Å; L48-I64 HydrophobicContact CG-CD1 4.47Å; L48-L81 HydrophobicContact CD1-CD2 3.51Å; L48-A84 HydrophobicContact CB-CB 4.02Å; L48-A84 HydrophobicContact CD1-CB 4.42Å; L48-V85 HydrophobicContact CB-CG1 4.39Å; L48-V85 HydrophobicContact CD1-CG1 4.07Å; L48-V85 HydrophobicContact CD2-CG1 3.99Å; L48-V85 HydrophobicContact CG-CG1 4.4Å |
| 49 | S | 91.9 | Very high | 91 | Very high | 26 Ų | 26 | 71.7 Ų | 71.7 | 18% | 0.182 | 37% | 0.371 | C | S | . | . | S | Bend | trans | -57.1 | 149.6 | 179.5 | -179 | 0 | 0 | 0 | 0 | 111.4 | L45 R46 E51 C52 R57 | L45-S49 PolarHBondContact O-N 2.97Å; R46-S49 WeakPolarHBondContact O-CB 3.46Å; R46-S49 PolarHBondContact O-N 3.07Å; R46-S49 VanDerWaalsContact O-N 3.15Å; S49-E51 PolarHBondContact O-N 3.43Å; S49-E51 PolarHBondContact OG-N 3.43Å; S49-E51 PolarHBondContact OG-OE2 3.4Å; S49-C52 WeakPolarHBondContact O-CB 3.37Å; S49-C52 PolarHBondContact O-N 2.92Å; S49-R57 VanDerWaalsContact O-CD 3.23Å; S49-R57 WeakPolarHBondContact O-CD 3.46Å; S49-R57 PolarHBondContact O-NE 3.26Å |
| 50 | M | 89.8 | Confident | 91.5 | Very high | 138 Ų | 138 | 67.2 Ų | 67.2 | 68% | 0.68 | 35% | 0.348 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63.2 | -17.3 | 172.5 | 58.7 | 169.9 | 43.7 | 0 | 0 | 113.7 | C52 | M50-C52 PolarHBondContact O-N 2.74Š|
| 51 | E | 90.3 | Very high | 91.9 | Very high | 174 Ų | 174 | 66.6 Ų | 66.6 | 81% | 0.813 | 35% | 0.345 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -70.8 | -21.6 | 172.7 | -61.4 | 167.6 | 111.6 | 0 | 0 | 111.9 | S49 | S49-E51 PolarHBondContact O-N 3.43Å; S49-E51 PolarHBondContact OG-N 3.43Å; S49-E51 PolarHBondContact OG-OE2 3.4Å |
| 52 | C | 90.9 | Very high | 92.1 | Very high | 39 Ų | 39 | 65.2 Ų | 65.2 | 26% | 0.264 | 34% | 0.343 | S | S | . | . | S | Bend | trans | -81.5 | 144.1 | 172.2 | -74.8 | 0 | 0 | 0 | 0 | 111.1 | R46 E47 S49 M50 R57 | R46-C52 PolarHBondContact O-SG 2.95Å; R46-C52 VanDerWaalsContact O-SG 3.37Å; E47-C52 WeakPolarHBondContact O-CB 3.13Å; S49-C52 WeakPolarHBondContact O-CB 3.37Å; S49-C52 PolarHBondContact O-N 2.92Å; M50-C52 PolarHBondContact O-N 2.74Å; C52-R57 HydrophobicContact CB-CG 4.06Å; C52-R57 WeakPolarHBondContact O-CD 3.45Å |
| 53 | G | 93.6 | Very high | 92.3 | Very high | 45 Ų | 45 | 66.3 Ų | 66.3 | 46% | 0.464 | 34% | 0.336 | S | S | . | . | trans | -57.4 | 141.7 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | N55 N56 R57 | G53-N55 VanDerWaalsContact C-N 3.26Å; G53-N55 PolarHBondContact O-N 3.37Å; G53-N55 VanDerWaalsContact O-N 3.14Å; G53-N56 WeakPolarHBondContact O-CB 3.43Å; G53-N56 PolarHBondContact O-N 2.98Å; G53-R57 PolarHBondContact O-N 3.01Å | ||
| 54 | L | 93.8 | Very high | 92.4 | Very high | 48 Ų | 48 | 63.1 Ų | 63.1 | 25% | 0.251 | 32% | 0.321 | S | S | . | . | H | α-helix | trans | -51.7 | -41.1 | -175.2 | -178.7 | 148.7 | 0 | 0 | 0 | 113.5 | N56 R57 I58 L88 P94 A97 | L54-N56 VanDerWaalsContact C-N 3.3Å; L54-N56 PolarHBondContact O-N 3.15Å; L54-R57 PolarHBondContact O-N 3.26Å; L54-I58 HydrophobicContact CD2-CD1 3.42Å; L54-I58 VanDerWaalsContact CD2-CD1 3.42Å; L54-I58 HydrophobicContact CD2-CG1 4.15Å; L54-I58 HydrophobicContact CG-CD1 4.37Å; L54-I58 WeakPolarHBondContact O-CG1 3.38Å; L54-I58 PolarHBondContact O-N 3.49Å; L54-L88 HydrophobicContact CD1-CD2 4.49Å; L54-P94 HydrophobicContact CD1-CG 3.56Å; L54-P94 HydrophobicContact CD2-CG 3.77Å; L54-P94 HydrophobicContact CG-CG 4.33Å; L54-A97 HydrophobicContact CD1-CB 4.32Å; L54-A97 HydrophobicContact CD2-CB 4.4Å; L54-A97 HydrophobicContact CG-CB 4.45Å |
| 55 | N | 94.6 | Very high | 92.2 | Very high | 125 Ų | 125 | 63.4 Ų | 63.4 | 67% | 0.668 | 33% | 0.325 | S | S | * | . | H | α-helix | trans | -63 | -34.7 | 178.1 | -70.4 | -34.2 | 0 | 0 | 0 | 113.2 | G53 R59 | G53-N55 VanDerWaalsContact C-N 3.26Å; G53-N55 PolarHBondContact O-N 3.37Å; G53-N55 VanDerWaalsContact O-N 3.14Å; N55-R59 WeakPolarHBondContact O-CB 3.24Å; N55-R59 PolarHBondContact O-N 3.25Å; N55-R59 VanDerWaalsContact O-N 3.11Å |
| 56 | N | 94.5 | Very high | 92 | Very high | 97 Ų | 97 | 66 Ų | 66 | 52% | 0.519 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -69.2 | -43.3 | 176.9 | -65.8 | -8.7 | 0 | 0 | 0 | 110.1 | G53 L54 I58 R59 M60 | G53-N56 WeakPolarHBondContact O-CB 3.43Å; G53-N56 PolarHBondContact O-N 2.98Å; L54-N56 VanDerWaalsContact C-N 3.3Å; L54-N56 PolarHBondContact O-N 3.15Å; N56-I58 PolarHBondContact O-N 3.01Å; N56-R59 PolarHBondContact O-N 3.45Å; N56-M60 WeakPolarHBondContact O-CB 3.48Å; N56-M60 PolarHBondContact O-N 3.29Å |
| 57 | R | 95.1 | Very high | 91.6 | Very high | 5 Ų | 5 | 59.4 Ų | 59.4 | 2% | 0.019 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -60.8 | -45.8 | 177.2 | -57.9 | 175.7 | 72.2 | -161 | -2.6 | 111.5 | L48 S49 C52 G53 L54 R59 M60 I61 A84 D87 L88 | L48-R57 VanDerWaalsContact O-CZ 3.31Å; L48-R57 PolarHBondContact O-NE 3.04Å; L48-R57 PolarHBondContact O-NH2 3.24Å; L48-R57 VanDerWaalsContact O-NH2 3.13Å; S49-R57 VanDerWaalsContact O-CD 3.23Å; S49-R57 WeakPolarHBondContact O-CD 3.46Å; S49-R57 PolarHBondContact O-NE 3.26Å; C52-R57 HydrophobicContact CB-CG 4.06Å; C52-R57 WeakPolarHBondContact O-CD 3.45Å; G53-R57 PolarHBondContact O-N 3.01Å; L54-R57 PolarHBondContact O-N 3.26Å; R57-R59 PolarHBondContact O-N 3.41Å; R57-M60 PolarHBondContact O-N 3Å; R57-I61 WeakPolarHBondContact O-CD1 3.47Å; R57-I61 VanDerWaalsContact O-CG1 3.24Å; R57-I61 WeakPolarHBondContact O-CG1 3.38Å; R57-I61 PolarHBondContact O-N 3.36Å; R57-A84 PolarHBondContact NH2-O 2.97Å; R57-D87 IonicContact CZ-OD1 3.87Å; R57-D87 IonicContact CZ-OD2 2.74Å; R57-D87 IonicContact NH1-OD1 3.67Å; R57-D87 PolarHBondContact NH1-OD1 2.98Å; R57-D87 IonicContact NH1-OD2 3.47Å; R57-D87 PolarHBondContact NH1-OD2 3.23Å; R57-D87 IonicContact NH2-OD1 3.7Å; R57-D87 PolarHBondContact NH2-OD1 3.49Å; R57-D87 IonicContact NH2-OD2 2.64Å; R57-L88 HydrophobicContact CB-CD1 4.22Å; R57-L88 VanDerWaalsContact NH1-CD2 3.34Å |
| 58 | I | 94.6 | Very high | 91.1 | Very high | 37 Ų | 37 | 57.9 Ų | 57.9 | 19% | 0.19 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -57.7 | -47.5 | 175 | -69.9 | 178.5 | 0 | 0 | 0 | 111.6 | L54 N56 M60 I61 G62 E96 A97 A100 | L54-I58 HydrophobicContact CD2-CD1 3.42Å; L54-I58 VanDerWaalsContact CD2-CD1 3.42Å; L54-I58 HydrophobicContact CD2-CG1 4.15Å; L54-I58 HydrophobicContact CG-CD1 4.37Å; L54-I58 WeakPolarHBondContact O-CG1 3.38Å; L54-I58 PolarHBondContact O-N 3.49Å; N56-I58 PolarHBondContact O-N 3.01Å; I58-M60 PolarHBondContact O-N 2.94Å; I58-I61 PolarHBondContact O-N 3.38Å; I58-G62 PolarHBondContact O-N 3.33Å; I58-E96 HydrophobicContact CD1-CB 4.01Å; I58-A97 HydrophobicContact CD1-CB 3.89Å; I58-A97 HydrophobicContact CG1-CB 4.14Å; I58-A100 HydrophobicContact CG2-CB 4.1Å |
| 59 | R | 94.8 | Very high | 90.5 | Very high | 175 Ų | 175 | 63.4 Ų | 63.4 | 66% | 0.66 | 33% | 0.333 | S | S | * | . | H | α-helix | trans | -60.6 | -46.7 | 179.7 | -176.3 | -171.1 | -61.2 | -107.6 | -0.6 | 111.1 | N55 N56 R57 I61 G62 Q63 | N55-R59 WeakPolarHBondContact O-CB 3.24Å; N55-R59 PolarHBondContact O-N 3.25Å; N55-R59 VanDerWaalsContact O-N 3.11Å; N56-R59 PolarHBondContact O-N 3.45Å; R57-R59 PolarHBondContact O-N 3.41Å; R59-I61 PolarHBondContact O-N 3.14Å; R59-G62 PolarHBondContact O-N 3.45Å; R59-G62 VanDerWaalsContact O-N 3.16Å; R59-Q63 WeakPolarHBondContact O-CG 3.34Å; R59-Q63 PolarHBondContact O-N 3.11Å |
| 60 | M | 93.9 | Very high | 89.7 | Confident | 7 Ų | 7 | 67.6 Ų | 67.6 | 3% | 0.034 | 36% | 0.358 | C | S | . | . | H | α-helix | trans | -62.2 | -43 | 179.6 | -178.6 | 53.9 | 74.3 | 0 | 0 | 111.6 | I44 E47 L48 N56 R57 I58 G62 Q63 I64 | I44-M60 HydrophobicContact CG2-SD 4.49Å; E47-M60 HydrophobicContact CB-CE 3.9Å; E47-M60 HydrophobicContact CB-CG 4.45Å; E47-M60 VanDerWaalsContact CD-CE 3.46Å; E47-M60 HydrophobicContact CG-CE 4.26Å; E47-M60 WeakPolarHBondContact OE2-CE 3.48Å; L48-M60 HydrophobicContact CD2-CB 3.85Å; L48-M60 HydrophobicContact CD2-CG 3.65Å; L48-M60 HydrophobicContact CG-CG 3.9Å; N56-M60 WeakPolarHBondContact O-CB 3.48Å; N56-M60 PolarHBondContact O-N 3.29Å; R57-M60 PolarHBondContact O-N 3Å; I58-M60 PolarHBondContact O-N 2.94Å; M60-G62 VanDerWaalsContact C-N 3.3Å; M60-G62 PolarHBondContact O-N 3.46Å; M60-Q63 WeakPolarHBondContact O-CB 3.48Å; M60-Q63 PolarHBondContact O-N 3.1Å; M60-Q63 VanDerWaalsContact O-N 3.1Å; M60-I64 HydrophobicContact CG-CD1 3.94Å; M60-I64 WeakPolarHBondContact O-CG1 3.36Å; M60-I64 PolarHBondContact O-N 2.92Å; M60-I64 HydrophobicContact SD-CD1 4.2Å; M60-I64 HydrophobicContact SD-CG1 4.3Å |
| 61 | I | 93.2 | Very high | 89.2 | Confident | 1 Ų | 1 | 63.5 Ų | 63.5 | 1% | 0.005 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -56.7 | -45.8 | 173.5 | -68.3 | 162.5 | 0 | 0 | 0 | 110.8 | L48 R57 I58 R59 Q63 I64 C65 V85 L88 A100 V101 L104 | L48-I61 HydrophobicContact CD2-CD1 4.48Å; L48-I61 HydrophobicContact CD2-CG1 3.74Å; R57-I61 WeakPolarHBondContact O-CD1 3.47Å; R57-I61 VanDerWaalsContact O-CG1 3.24Å; R57-I61 WeakPolarHBondContact O-CG1 3.38Å; R57-I61 PolarHBondContact O-N 3.36Å; I58-I61 PolarHBondContact O-N 3.38Å; R59-I61 PolarHBondContact O-N 3.14Å; I61-Q63 VanDerWaalsContact C-N 3.3Å; I61-Q63 PolarHBondContact O-N 3.05Å; I61-I64 PolarHBondContact O-N 3.05Å; I61-C65 PolarHBondContact O-N 3.49Å; I61-C65 PolarHBondContact O-SG 2.96Å; I61-V85 HydrophobicContact CD1-CB 4.24Å; I61-V85 HydrophobicContact CD1-CG1 3.96Å; I61-V85 HydrophobicContact CG1-CG1 4.07Å; I61-L88 HydrophobicContact CD1-CD1 3.55Å; I61-A100 HydrophobicContact CB-CB 4.31Å; I61-A100 HydrophobicContact CD1-CB 4.44Å; I61-A100 HydrophobicContact CG2-CB 3.95Å; I61-A100 WeakPolarHBondContact CG2-O 3.23Å; I61-V101 HydrophobicContact CD1-CG2 3.91Å; I61-L104 HydrophobicContact CG2-CB 4.14Å; I61-L104 HydrophobicContact CG2-CD1 4.14Å |
| 62 | G | 91.4 | Very high | 88.7 | Confident | 34 Ų | 34 | 61 Ų | 61 | 35% | 0.351 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -58 | -40.8 | 176 | 0 | 0 | 0 | 0 | 0 | 113.1 | I58 R59 M60 C65 E66 | I58-G62 PolarHBondContact O-N 3.33Å; R59-G62 PolarHBondContact O-N 3.45Å; R59-G62 VanDerWaalsContact O-N 3.16Å; M60-G62 VanDerWaalsContact C-N 3.3Å; M60-G62 PolarHBondContact O-N 3.46Å; G62-C65 WeakPolarHBondContact O-CB 3.49Å; G62-C65 PolarHBondContact O-N 2.95Å; G62-E66 PolarHBondContact O-N 3.42Å |
| 63 | Q | 90.1 | Very high | 88.2 | Confident | 93 Ų | 93 | 60.9 Ų | 60.9 | 44% | 0.435 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -65.2 | -42.5 | 177 | -66.5 | 174 | -79.8 | 0 | 0 | 111.9 | R59 M60 I61 C65 E66 V67 | R59-Q63 WeakPolarHBondContact O-CG 3.34Å; R59-Q63 PolarHBondContact O-N 3.11Å; M60-Q63 WeakPolarHBondContact O-CB 3.48Å; M60-Q63 PolarHBondContact O-N 3.1Å; M60-Q63 VanDerWaalsContact O-N 3.1Å; I61-Q63 VanDerWaalsContact C-N 3.3Å; I61-Q63 PolarHBondContact O-N 3.05Å; Q63-C65 VanDerWaalsContact C-N 3.31Å; Q63-C65 PolarHBondContact O-N 3.37Å; Q63-E66 PolarHBondContact O-N 3.37Å; Q63-V67 PolarHBondContact O-N 3.16Å |
| 64 | I | 89.8 | Confident | 87.7 | Confident | 3 Ų | 3 | 61.6 Ų | 61.6 | 2% | 0.015 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -64.6 | -37.6 | 178 | -64.7 | 161.8 | 0 | 0 | 0 | 110.8 | I44 L48 M60 I61 E66 V67 A68 F73 L81 L104 | I44-I64 HydrophobicContact CG2-CD1 3.73Å; I44-I64 HydrophobicContact CG2-CG1 4.44Å; L48-I64 HydrophobicContact CD1-CD1 3.79Å; L48-I64 HydrophobicContact CD2-CD1 4.49Å; L48-I64 HydrophobicContact CG-CD1 4.47Å; M60-I64 HydrophobicContact CG-CD1 3.94Å; M60-I64 WeakPolarHBondContact O-CG1 3.36Å; M60-I64 PolarHBondContact O-N 2.92Å; M60-I64 HydrophobicContact SD-CD1 4.2Å; M60-I64 HydrophobicContact SD-CG1 4.3Å; I61-I64 PolarHBondContact O-N 3.05Å; I64-E66 VanDerWaalsContact C-N 3.33Å; I64-E66 PolarHBondContact O-N 3.49Å; I64-V67 PolarHBondContact O-N 3.38Å; I64-A68 WeakPolarHBondContact O-CB 3.46Å; I64-A68 PolarHBondContact O-N 2.99Å; I64-F73 HydrophobicContact CG2-CE1 3.92Å; I64-F73 HydrophobicContact CG2-CZ 3.69Å; I64-L81 HydrophobicContact CD1-CD2 3.77Å; I64-L81 HydrophobicContact CG2-CD1 3.92Å; I64-L81 HydrophobicContact CG2-CD2 4.45Å; I64-L104 HydrophobicContact CB-CD1 4.13Å; I64-L104 HydrophobicContact CG2-CD1 3.67Å |
| 65 | C | 86.9 | Confident | 87 | Confident | 18 Ų | 18 | 66.8 Ų | 66.8 | 12% | 0.122 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -59 | -40.3 | 173 | -70 | 0 | 0 | 0 | 0 | 112.7 | I61 G62 Q63 V67 A68 K69 L104 | I61-C65 PolarHBondContact O-N 3.49Å; I61-C65 PolarHBondContact O-SG 2.96Å; G62-C65 WeakPolarHBondContact O-CB 3.49Å; G62-C65 PolarHBondContact O-N 2.95Å; Q63-C65 VanDerWaalsContact C-N 3.31Å; Q63-C65 PolarHBondContact O-N 3.37Å; C65-V67 VanDerWaalsContact C-N 3.33Å; C65-A68 PolarHBondContact O-N 3.27Å; C65-K69 WeakPolarHBondContact O-CG 3.48Å; C65-K69 PolarHBondContact O-N 2.64Å; C65-L104 WeakPolarHBondContact SG-CA 3.47Å; C65-L104 PolarHBondContact SG-N 3.37Å; C65-L104 VanDerWaalsContact SG-N 3.44Å |
| 66 | E | 86 | Confident | 86.3 | Confident | 109 Ų | 109 | 66.4 Ų | 66.4 | 51% | 0.509 | 33% | 0.326 | S | S | . | . | H | α-helix | trans | -66 | -37 | 176.5 | -65.4 | -51.9 | 130.1 | 0 | 0 | 112.1 | G62 Q63 I64 K69 | G62-E66 PolarHBondContact O-N 3.42Å; Q63-E66 PolarHBondContact O-N 3.37Å; I64-E66 VanDerWaalsContact C-N 3.33Å; I64-E66 PolarHBondContact O-N 3.49Å; E66-K69 PolarHBondContact O-N 3.24Å; E66-K69 WeakPolarHBondContact OE1-CE 3.43Å; E66-K69 IonicContact OE1-NZ 2.96Å; E66-K69 PolarHBondContact OE1-NZ 3.2Å; E66-K69 IonicContact OE2-NZ 3.96Å; E66-K69 PolarHBondContact OE2-NZ 2.91Å |
| 67 | V | 82.1 | Confident | 85.8 | Confident | 14 Ų | 14 | 61.9 Ų | 61.9 | 9% | 0.085 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -66.9 | -43 | 175.5 | 179.4 | 0 | 0 | 0 | 0 | 111.2 | L19 F38 Q63 I64 C65 K69 T70 K71 | L19-V67 HydrophobicContact CD2-CG2 3.55Å; F38-V67 HydrophobicContact CB-CG1 4.01Å; F38-V67 HydrophobicContact CD1-CG1 3.89Å; F38-V67 HydrophobicContact CD2-CG1 3.49Å; F38-V67 VanDerWaalsContact CD2-CG1 3.49Å; F38-V67 HydrophobicContact CE1-CG1 4.13Å; F38-V67 HydrophobicContact CE2-CG1 3.8Å; F38-V67 HydrophobicContact CE2-CG2 4.35Å; F38-V67 HydrophobicContact CG-CG1 3.52Å; F38-V67 HydrophobicContact CZ-CG1 4.09Å; F38-V67 HydrophobicContact CZ-CG2 4.39Å; Q63-V67 PolarHBondContact O-N 3.16Å; I64-V67 PolarHBondContact O-N 3.38Å; C65-V67 VanDerWaalsContact C-N 3.33Å; V67-K69 PolarHBondContact O-N 3.44Å; V67-T70 PolarHBondContact O-N 3.19Å; V67-T70 PolarHBondContact O-OG1 3.28Å; V67-K71 HydrophobicContact CG1-CB 4.14Å; V67-K71 HydrophobicContact CG1-CD 4.27Å; V67-K71 HydrophobicContact CG1-CG 4.44Å; V67-K71 PolarHBondContact O-N 3.21Å |
| 68 | A | 82.9 | Confident | 85.2 | Confident | 28 Ų | 28 | 64.4 Ų | 64.4 | 23% | 0.231 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -58.1 | -22.6 | 179.3 | 0 | 0 | 0 | 0 | 0 | 113.8 | I64 C65 T70 F73 | I64-A68 WeakPolarHBondContact O-CB 3.46Å; I64-A68 PolarHBondContact O-N 2.99Å; C65-A68 PolarHBondContact O-N 3.27Å; A68-T70 VanDerWaalsContact C-N 3.32Å; A68-F73 HydrophobicContact CB-CE2 3.47Å; A68-F73 VanDerWaalsContact CB-CE2 3.47Å; A68-F73 HydrophobicContact CB-CZ 3.66Å |
| 69 | K | 80.9 | Confident | 84.6 | Confident | 115 Ų | 115 | 66.6 Ų | 66.6 | 50% | 0.5 | 33% | 0.327 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -71.3 | -26.7 | 176.1 | -66.9 | 172.9 | -169.5 | 173.7 | 0 | 113.3 | C65 E66 V67 P108 | C65-K69 WeakPolarHBondContact O-CG 3.48Å; C65-K69 PolarHBondContact O-N 2.64Å; E66-K69 PolarHBondContact O-N 3.24Å; E66-K69 WeakPolarHBondContact OE1-CE 3.43Å; E66-K69 IonicContact OE1-NZ 2.96Å; E66-K69 PolarHBondContact OE1-NZ 3.2Å; E66-K69 IonicContact OE2-NZ 3.96Å; E66-K69 PolarHBondContact OE2-NZ 2.91Å; V67-K69 PolarHBondContact O-N 3.44Å; K69-P108 HydrophobicContact CB-CB 4.46Å; K69-P108 HydrophobicContact CG-CB 4Å |
| 70 | T | 75.3 | Confident | 84.3 | Confident | 115 Ų | 115 | 59.7 Ų | 59.7 | 71% | 0.706 | 31% | 0.308 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -121.9 | -20.2 | -168.5 | 59.4 | 0 | 0 | 0 | 0 | 113.5 | V67 A68 | V67-T70 PolarHBondContact O-N 3.19Å; V67-T70 PolarHBondContact O-OG1 3.28Å; A68-T70 VanDerWaalsContact C-N 3.32Å |
| 71 | K | 78.9 | Confident | 84.1 | Confident | 51 Ų | 51 | 59.4 Ų | 59.4 | 22% | 0.222 | 31% | 0.306 | C | S | . | . | S | Bend | trans | -127.7 | 140.4 | -179.8 | -61.3 | -170 | -178.5 | -179.3 | 0 | 110.5 | L19 F38 V67 | L19-K71 PolarHBondContact O-NZ 3.49Å; F38-K71 HydrophobicContact CB-CB 4.08Å; F38-K71 HydrophobicContact CB-CD 4.44Å; V67-K71 HydrophobicContact CG1-CB 4.14Å; V67-K71 HydrophobicContact CG1-CD 4.27Å; V67-K71 HydrophobicContact CG1-CG 4.44Å; V67-K71 PolarHBondContact O-N 3.21Å |
| 72 | K | 78.8 | Confident | 83.8 | Confident | 121 Ų | 121 | 61.2 Ų | 61.2 | 53% | 0.526 | 31% | 0.313 | S | S | . | . | P | Polyproline II helix | trans | -74.7 | 140.1 | 169.4 | -170.1 | -165.4 | 162.8 | -142.8 | 0 | 108.6 | E37 F38 | E37-K72 CarbonylContact C-O 3.5Å; E37-K72 VanDerWaalsContact CA-O 3.29Å; E37-K72 WeakPolarHBondContact CA-O 3.4Å; E37-K72 IonicContact OE1-NZ 3.38Å; E37-K72 PolarHBondContact OE1-NZ 2.96Å; F38-K72 PolarHBondContact N-O 2.95Å |
| 73 | F | 81.6 | Confident | 83.6 | Confident | 37 Ų | 37 | 67.7 Ų | 67.7 | 16% | 0.162 | 33% | 0.332 | C | S | . | . | B | Isolated β-bridge | trans | -72.6 | 150.2 | 171 | -69.9 | -73.9 | 0 | 0 | 0 | 111.2 | F38 I40 I64 A68 A77 V78 L81 | F38-F73 HydrophobicContact CB-CD1 4.38Å; F38-F73 AromaticContact CD1-CD1 3.6Å; F38-F73 HydrophobicContact CD1-CD1 3.6Å; F38-F73 AromaticContact CD1-CE1 3.39Å; F38-F73 HydrophobicContact CD1-CE1 3.39Å; F38-F73 HydrophobicContact CE1-CD1 4.42Å; F38-F73 AromaticContact CE1-CE1 3.86Å; F38-F73 HydrophobicContact CE1-CE1 3.86Å; F38-F73 HydrophobicContact CG-CD1 4.48Å; F38-F73 HydrophobicContact CG-CE1 4.46Å; I40-F73 HydrophobicContact CD1-CD1 4.15Å; I40-F73 HydrophobicContact CD1-CE1 3.96Å; I40-F73 HydrophobicContact CG1-CD1 4.35Å; I64-F73 HydrophobicContact CG2-CE1 3.92Å; I64-F73 HydrophobicContact CG2-CZ 3.69Å; A68-F73 HydrophobicContact CB-CE2 3.47Å; A68-F73 VanDerWaalsContact CB-CE2 3.47Å; A68-F73 HydrophobicContact CB-CZ 3.66Å; F73-A77 HydrophobicContact CB-CB 3.93Å; F73-A77 HydrophobicContact CD1-CB 4.22Å; F73-A77 HydrophobicContact CG-CB 4.43Å; F73-V78 HydrophobicContact CB-CG2 4.19Å; F73-V78 HydrophobicContact CD2-CG2 4.05Å; F73-V78 HydrophobicContact CG-CG2 4.27Å; F73-L81 HydrophobicContact CD1-CD1 4.45Å; F73-L81 HydrophobicContact CE1-CD1 3.96Å; F73-L81 HydrophobicContact CZ-CD1 4.2Å |
| 74 | E | 83.4 | Confident | 83.7 | Confident | 61 Ų | 61 | 64.3 Ų | 64.3 | 29% | 0.285 | 32% | 0.319 | S | S | . | . | P | Polyproline II helix | trans | -61 | 168 | 167.5 | 65.7 | 175.1 | 164.6 | 0 | 0 | 112.3 | F38 I39 I40 A77 | F38-E74 PolarHBondContact O-N 2.79Å; I39-E74 WeakPolarHBondContact CG2-OE1 3.32Å; I40-E74 PolarHBondContact N-OE1 3.13Å; E74-A77 HydrophobicContact CG-CB 3.4Å; E74-A77 PolarHBondContact O-N 3.38Å |
| 75 | E | 77.7 | Confident | 83.8 | Confident | 157 Ų | 157 | 64.2 Ų | 64.2 | 73% | 0.734 | 32% | 0.319 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -58.3 | 139 | 171 | -162.2 | 174.2 | 63.9 | 0 | 0 | 110.3 | A77 | E75-A77 PolarHBondContact O-N 3.32Š|
| 76 | H | 79.8 | Confident | 84 | Confident | 117 Ų | 117 | 64.9 Ų | 64.9 | 54% | 0.542 | 33% | 0.326 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 64.6 | -9.6 | -176.4 | -52.9 | -69.6 | 0 | 0 | 0 | 117.9 | V78 E79 A80 | H76-V78 VanDerWaalsContact C-N 3.29Å; H76-V78 PolarHBondContact O-N 3.13Å; H76-E79 IonicContact CE1-OE2 3.73Å; H76-E79 IonicContact CG-OE2 2.82Å; H76-E79 IonicContact ND1-OE2 2.87Å; H76-E79 PolarHBondContact ND1-OE2 3.12Å; H76-E79 WeakPolarHBondContact O-CB 3.41Å; H76-E79 PolarHBondContact O-N 2.68Å; H76-A80 PolarHBondContact O-N 2.82Å |
| 77 | A | 84.2 | Confident | 84.2 | Confident | 1 Ų | 1 | 61.2 Ų | 61.2 | 1% | 0.008 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -57.6 | -40.7 | 179.3 | 0 | 0 | 0 | 0 | 0 | 113.2 | I40 F73 E74 E75 E79 A80 L81 | I40-A77 HydrophobicContact CB-CB 4.1Å; I40-A77 HydrophobicContact CG1-CB 3.37Å; F73-A77 HydrophobicContact CB-CB 3.93Å; F73-A77 HydrophobicContact CD1-CB 4.22Å; F73-A77 HydrophobicContact CG-CB 4.43Å; E74-A77 HydrophobicContact CG-CB 3.4Å; E74-A77 PolarHBondContact O-N 3.38Å; E75-A77 PolarHBondContact O-N 3.32Å; A77-E79 VanDerWaalsContact C-N 3.32Å; A77-E79 PolarHBondContact O-N 2.78Å; A77-A80 PolarHBondContact O-N 3.24Å; A77-L81 WeakPolarHBondContact O-CB 3.23Å; A77-L81 WeakPolarHBondContact O-CG 3.4Å; A77-L81 PolarHBondContact O-N 3.13Å |
| 78 | V | 82.8 | Confident | 84.6 | Confident | 58 Ų | 58 | 60.6 Ų | 60.6 | 35% | 0.352 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -64.4 | -38.1 | 177.2 | 179.2 | 0 | 0 | 0 | 0 | 111.3 | F73 H76 W82 L119 | F73-V78 HydrophobicContact CB-CG2 4.19Å; F73-V78 HydrophobicContact CD2-CG2 4.05Å; F73-V78 HydrophobicContact CG-CG2 4.27Å; H76-V78 VanDerWaalsContact C-N 3.29Å; H76-V78 PolarHBondContact O-N 3.13Å; V78-W82 WeakPolarHBondContact O-CB 3.5Å; V78-W82 PolarHBondContact O-N 3.38Å; V78-L119 HydrophobicContact CG1-CD2 4.25Å |
| 79 | E | 82.3 | Confident | 84.9 | Confident | 83 Ų | 83 | 60.7 Ų | 60.7 | 39% | 0.388 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -67.4 | -41.2 | 177.4 | -59.6 | -176.3 | 155 | 0 | 0 | 111.5 | H76 A77 W82 K83 I122 | H76-E79 IonicContact CE1-OE2 3.73Å; H76-E79 IonicContact CG-OE2 2.82Å; H76-E79 IonicContact ND1-OE2 2.87Å; H76-E79 PolarHBondContact ND1-OE2 3.12Å; H76-E79 WeakPolarHBondContact O-CB 3.41Å; H76-E79 PolarHBondContact O-N 2.68Å; A77-E79 VanDerWaalsContact C-N 3.32Å; A77-E79 PolarHBondContact O-N 2.78Å; E79-W82 PolarHBondContact O-N 3.17Å; E79-K83 WeakPolarHBondContact O-CG 3.38Å; E79-K83 PolarHBondContact O-N 3.43Å; E79-K83 VanDerWaalsContact O-N 3.08Å; E79-I122 HydrophobicContact CG-CD1 4.36Å |
| 80 | A | 88.3 | Confident | 85.2 | Confident | 30 Ų | 30 | 60.1 Ų | 60.1 | 25% | 0.248 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -64.4 | -45 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.7 | L45 H76 A77 W82 K83 A84 | L45-A80 HydrophobicContact CD1-CB 4.4Å; L45-A80 HydrophobicContact CD2-CB 4.25Å; H76-A80 PolarHBondContact O-N 2.82Å; A77-A80 PolarHBondContact O-N 3.24Å; A80-W82 PolarHBondContact O-N 3.08Å; A80-K83 PolarHBondContact O-N 2.94Å; A80-A84 PolarHBondContact O-N 3.35Å; A80-A84 VanDerWaalsContact O-N 3.13Å |
| 81 | L | 89.1 | Confident | 85.6 | Confident | 1 Ų | 1 | 58.5 Ų | 58.5 | 1% | 0.005 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -59.2 | -47.3 | 174.6 | -77 | 171.7 | 0 | 0 | 0 | 111.6 | I40 L48 I64 F73 A77 K83 A84 V85 L104 | I40-L81 HydrophobicContact CD1-CD1 3.77Å; I40-L81 HydrophobicContact CD1-CD2 3.99Å; I40-L81 HydrophobicContact CD1-CG 3.95Å; I40-L81 HydrophobicContact CG1-CD1 4.09Å; I40-L81 HydrophobicContact CG1-CD2 4.49Å; I40-L81 HydrophobicContact CG1-CG 4.05Å; I40-L81 HydrophobicContact CG2-CD2 4.3Å; I40-L81 HydrophobicContact CG2-CG 4.39Å; L48-L81 HydrophobicContact CD1-CD2 3.51Å; I64-L81 HydrophobicContact CD1-CD2 3.77Å; I64-L81 HydrophobicContact CG2-CD1 3.92Å; I64-L81 HydrophobicContact CG2-CD2 4.45Å; F73-L81 HydrophobicContact CD1-CD1 4.45Å; F73-L81 HydrophobicContact CE1-CD1 3.96Å; F73-L81 HydrophobicContact CZ-CD1 4.2Å; A77-L81 WeakPolarHBondContact O-CB 3.23Å; A77-L81 WeakPolarHBondContact O-CG 3.4Å; A77-L81 PolarHBondContact O-N 3.13Å; L81-K83 PolarHBondContact O-N 3.5Å; L81-A84 WeakPolarHBondContact O-CB 3.36Å; L81-A84 PolarHBondContact O-N 3.44Å; L81-A84 VanDerWaalsContact O-N 3.08Å; L81-V85 WeakPolarHBondContact O-CG2 3.4Å; L81-V85 PolarHBondContact O-N 2.95Å; L81-V85 VanDerWaalsContact O-N 3.12Å; L81-L104 HydrophobicContact CD1-CD1 4.49Å |
| 82 | W | 87.3 | Confident | 86.2 | Confident | 40 Ų | 40 | 63.4 Ų | 63.4 | 15% | 0.152 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -57 | -48.6 | 178.6 | 175.9 | -108.7 | 0 | 0 | 0 | 111.9 | V78 E79 A80 A84 V85 A86 L89 V101 L105 I122 | V78-W82 WeakPolarHBondContact O-CB 3.5Å; V78-W82 PolarHBondContact O-N 3.38Å; E79-W82 PolarHBondContact O-N 3.17Å; A80-W82 PolarHBondContact O-N 3.08Å; W82-A84 PolarHBondContact O-N 2.96Å; W82-V85 PolarHBondContact O-N 3.41Å; W82-V85 VanDerWaalsContact O-N 3.17Å; W82-A86 HydrophobicContact CD2-CB 4.35Å; W82-A86 HydrophobicContact CZ2-CB 4.23Å; W82-A86 VanDerWaalsContact O-CB 3.3Å; W82-A86 WeakPolarHBondContact O-CB 3.48Å; W82-A86 PolarHBondContact O-N 3.08Å; W82-L89 HydrophobicContact CH2-CD1 3.35Å; W82-L89 HydrophobicContact CZ3-CD1 3.5Å; W82-L89 VanDerWaalsContact CZ3-CD1 3.5Å; W82-V101 HydrophobicContact CZ3-CG1 4.29Å; W82-L105 HydrophobicContact CE3-CD2 4.39Å; W82-L105 HydrophobicContact CZ3-CD1 3.91Å; W82-I122 HydrophobicContact CB-CG2 4.43Å; W82-I122 HydrophobicContact CD2-CG2 3.98Å; W82-I122 HydrophobicContact CG-CG2 3.64Å; W82-I122 VanDerWaalsContact NE1-CG2 3.3Å |
| 83 | K | 88.4 | Confident | 86.7 | Confident | 170 Ų | 170 | 61.9 Ų | 61.9 | 74% | 0.739 | 31% | 0.308 | S | S | * | . | H | α-helix | trans | -57.3 | -36 | 176.8 | -72.9 | 172.8 | -177.4 | 172.1 | 0 | 112.2 | E79 A80 L81 | E79-K83 WeakPolarHBondContact O-CG 3.38Å; E79-K83 PolarHBondContact O-N 3.43Å; E79-K83 VanDerWaalsContact O-N 3.08Å; A80-K83 PolarHBondContact O-N 2.94Å; L81-K83 PolarHBondContact O-N 3.5Å |
| 84 | A | 91.1 | Very high | 87.2 | Confident | 21 Ų | 21 | 62.6 Ų | 62.6 | 17% | 0.174 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -76.9 | -22.2 | -178.7 | 0 | 0 | 0 | 0 | 0 | 114.3 | L45 L48 R57 A80 L81 W82 | L45-A84 HydrophobicContact CD2-CB 4.06Å; L48-A84 HydrophobicContact CB-CB 4.02Å; L48-A84 HydrophobicContact CD1-CB 4.42Å; R57-A84 PolarHBondContact NH2-O 2.97Å; A80-A84 PolarHBondContact O-N 3.35Å; A80-A84 VanDerWaalsContact O-N 3.13Å; L81-A84 WeakPolarHBondContact O-CB 3.36Å; L81-A84 PolarHBondContact O-N 3.44Å; L81-A84 VanDerWaalsContact O-N 3.08Å; W82-A84 PolarHBondContact O-N 2.96Å |
| 85 | V | 92.4 | Very high | 87.6 | Confident | 2 Ų | 2 | 63.9 Ų | 63.9 | 1% | 0.012 | 32% | 0.324 | C | S | . | . | H | α-helix | trans | -123.1 | -4.4 | -171.8 | -51.4 | 0 | 0 | 0 | 0 | 114.8 | L48 I61 L81 W82 D87 L88 V101 | L48-V85 HydrophobicContact CB-CG1 4.39Å; L48-V85 HydrophobicContact CD1-CG1 4.07Å; L48-V85 HydrophobicContact CD2-CG1 3.99Å; L48-V85 HydrophobicContact CG-CG1 4.4Å; I61-V85 HydrophobicContact CD1-CB 4.24Å; I61-V85 HydrophobicContact CD1-CG1 3.96Å; I61-V85 HydrophobicContact CG1-CG1 4.07Å; L81-V85 WeakPolarHBondContact O-CG2 3.4Å; L81-V85 PolarHBondContact O-N 2.95Å; L81-V85 VanDerWaalsContact O-N 3.12Å; W82-V85 PolarHBondContact O-N 3.41Å; W82-V85 VanDerWaalsContact O-N 3.17Å; V85-D87 PolarHBondContact O-N 3.25Å; V85-D87 VanDerWaalsContact O-N 3.16Å; V85-L88 HydrophobicContact CB-CD1 4.39Å; V85-L88 WeakPolarHBondContact O-CB 3.19Å; V85-L88 PolarHBondContact O-N 3.49Å; V85-V101 HydrophobicContact CB-CG2 4.03Å; V85-V101 HydrophobicContact CG2-CG1 3.91Å; V85-V101 HydrophobicContact CG2-CG2 3.99Å |
| 86 | A | 89.9 | Confident | 88.3 | Confident | 32 Ų | 32 | 62.1 Ų | 62.1 | 26% | 0.264 | 32% | 0.316 | S | S | . | . | G | 310 helix | trans | -58.1 | -30 | -177.7 | 0 | 0 | 0 | 0 | 0 | 113.6 | W82 L88 L89 | W82-A86 HydrophobicContact CD2-CB 4.35Å; W82-A86 HydrophobicContact CZ2-CB 4.23Å; W82-A86 VanDerWaalsContact O-CB 3.3Å; W82-A86 WeakPolarHBondContact O-CB 3.48Å; W82-A86 PolarHBondContact O-N 3.08Å; A86-L88 PolarHBondContact O-N 3Å; A86-L89 PolarHBondContact O-N 3.15Å |
| 87 | D | 91.1 | Very high | 88.8 | Confident | 31 Ų | 31 | 56.6 Ų | 56.6 | 17% | 0.166 | 29% | 0.29 | C | S | . | . | G | 310 helix | trans | -68.8 | -17.2 | 177.2 | 75.1 | -67.2 | 0 | 0 | 0 | 113.7 | R57 V85 L89 Q90 R93 | R57-D87 IonicContact CZ-OD1 3.87Å; R57-D87 IonicContact CZ-OD2 2.74Å; R57-D87 IonicContact NH1-OD1 3.67Å; R57-D87 PolarHBondContact NH1-OD1 2.98Å; R57-D87 IonicContact NH1-OD2 3.47Å; R57-D87 PolarHBondContact NH1-OD2 3.23Å; R57-D87 IonicContact NH2-OD1 3.7Å; R57-D87 PolarHBondContact NH2-OD1 3.49Å; R57-D87 IonicContact NH2-OD2 2.64Å; V85-D87 PolarHBondContact O-N 3.25Å; V85-D87 VanDerWaalsContact O-N 3.16Å; D87-L89 PolarHBondContact O-N 3.37Å; D87-Q90 VanDerWaalsContact O-CG 3.29Å; D87-Q90 WeakPolarHBondContact O-CG 3.39Å; D87-R93 WeakPolarHBondContact O-CG 3.39Å; D87-R93 PolarHBondContact O-NE 3.25Å; D87-R93 IonicContact OD2-CZ 2.68Å; D87-R93 IonicContact OD2-NE 3.9Å; D87-R93 IonicContact OD2-NH2 2.82Å; D87-R93 PolarHBondContact OD2-NH2 3.3Å |
| 88 | L | 90.8 | Very high | 89.1 | Confident | 1 Ų | 1 | 60.1 Ų | 60.1 | 1% | 0.005 | 30% | 0.304 | C | S | . | . | G | 310 helix | trans | -77.4 | -11 | 176.3 | -63.6 | 179.2 | 0 | 0 | 0 | 112.7 | L54 R57 I61 V85 A86 Q90 R93 A97 R98 V101 | L54-L88 HydrophobicContact CD1-CD2 4.49Å; R57-L88 HydrophobicContact CB-CD1 4.22Å; R57-L88 VanDerWaalsContact NH1-CD2 3.34Å; I61-L88 HydrophobicContact CD1-CD1 3.55Å; V85-L88 HydrophobicContact CB-CD1 4.39Å; V85-L88 WeakPolarHBondContact O-CB 3.19Å; V85-L88 PolarHBondContact O-N 3.49Å; A86-L88 PolarHBondContact O-N 3Å; L88-Q90 VanDerWaalsContact C-N 3.35Å; L88-R93 WeakPolarHBondContact O-CB 3.42Å; L88-A97 HydrophobicContact CB-CB 4.33Å; L88-A97 HydrophobicContact CD2-CB 4.32Å; L88-R98 VanDerWaalsContact O-CG 3.23Å; L88-R98 WeakPolarHBondContact O-CG 3.46Å; L88-V101 HydrophobicContact CB-CG2 3.76Å; L88-V101 HydrophobicContact CD1-CG2 4.12Å |
| 89 | L | 89.4 | Confident | 89.5 | Confident | 30 Ų | 30 | 62.4 Ų | 62.4 | 16% | 0.157 | 31% | 0.31 | C | S | . | . | G | 310 helix | trans | -85.1 | -5.5 | 176 | -70.7 | 173.8 | 0 | 0 | 0 | 114 | W82 A86 D87 V101 L102 L126 | W82-L89 HydrophobicContact CH2-CD1 3.35Å; W82-L89 HydrophobicContact CZ3-CD1 3.5Å; W82-L89 VanDerWaalsContact CZ3-CD1 3.5Å; A86-L89 PolarHBondContact O-N 3.15Å; D87-L89 PolarHBondContact O-N 3.37Å; L89-V101 HydrophobicContact CD1-CG1 3.83Å; L89-V101 HydrophobicContact CD2-CB 3.89Å; L89-V101 HydrophobicContact CD2-CG1 3.86Å; L89-V101 HydrophobicContact CG-CB 4.15Å; L89-V101 HydrophobicContact CG-CG1 3.76Å; L89-L102 HydrophobicContact CD2-CD2 4.23Å; L89-L102 HydrophobicContact CD2-CG 4.12Å; L89-L126 HydrophobicContact CD1-CD1 4.27Å |
| 90 | Q | 87.4 | Confident | 89.9 | Confident | 103 Ų | 103 | 59.1 Ų | 59.1 | 48% | 0.481 | 30% | 0.297 | S | S | . | . | S | Bend | trans | -59.9 | 141.7 | 178.7 | -61.5 | -63.9 | -19 | 0 | 0 | 110.7 | D87 L88 E92 R93 | D87-Q90 VanDerWaalsContact O-CG 3.29Å; D87-Q90 WeakPolarHBondContact O-CG 3.39Å; L88-Q90 VanDerWaalsContact C-N 3.35Å; Q90-E92 PolarHBondContact O-N 3.24Å; Q90-E92 VanDerWaalsContact O-N 3.16Å; Q90-R93 HydrophobicContact CB-CG 3.94Å; Q90-R93 VanDerWaalsContact O-CB 3.26Å; Q90-R93 WeakPolarHBondContact O-CB 3.31Å; Q90-R93 PolarHBondContact O-N 3.5Å |
| 91 | P | 82.8 | Confident | 89.9 | Confident | 82 Ų | 82 | 57.7 Ų | 57.7 | 53% | 0.532 | 29% | 0.285 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -62.6 | -24.3 | -173.9 | 21.8 | -29.6 | 0 | 0 | 0 | 114 | R93 R98 | P91-R93 VanDerWaalsContact C-N 3.26Å; P91-R93 PolarHBondContact O-N 3.22Å; P91-R98 PolarHBondContact O-NH1 2.99Å |
| 92 | E | 91.8 | Very high | 89.8 | Confident | 154 Ų | 154 | 60.9 Ų | 60.9 | 72% | 0.72 | 30% | 0.302 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -74.3 | -17.1 | 175.8 | -58.2 | 71.5 | -155.4 | 0 | 0 | 112.5 | Q90 | Q90-E92 PolarHBondContact O-N 3.24Å; Q90-E92 VanDerWaalsContact O-N 3.16Å |
| 93 | R | 89.3 | Confident | 89.7 | Confident | 88 Ų | 88 | 61.6 Ų | 61.6 | 33% | 0.332 | 32% | 0.316 | S | S | . | . | S | Bend | trans | -73.1 | 146 | 178.5 | -62.1 | -69.8 | -164.9 | -165.8 | 7.5 | 110 | D87 L88 Q90 P91 A97 R98 | D87-R93 WeakPolarHBondContact O-CG 3.39Å; D87-R93 PolarHBondContact O-NE 3.25Å; D87-R93 IonicContact OD2-CZ 2.68Å; D87-R93 IonicContact OD2-NE 3.9Å; D87-R93 IonicContact OD2-NH2 2.82Å; D87-R93 PolarHBondContact OD2-NH2 3.3Å; L88-R93 WeakPolarHBondContact O-CB 3.42Å; Q90-R93 HydrophobicContact CB-CG 3.94Å; Q90-R93 VanDerWaalsContact O-CB 3.26Å; Q90-R93 WeakPolarHBondContact O-CB 3.31Å; Q90-R93 PolarHBondContact O-N 3.5Å; P91-R93 VanDerWaalsContact C-N 3.26Å; P91-R93 PolarHBondContact O-N 3.22Å; R93-A97 HydrophobicContact CB-CB 4.45Å; R93-R98 HydrophobicContact CB-CG 4.32Å; R93-R98 VanDerWaalsContact O-CZ 3.29Å; R93-R98 PolarHBondContact O-NE 3.3Å; R93-R98 PolarHBondContact O-NH2 3.12Å |
| 94 | P | 92.5 | Very high | 89.3 | Confident | 53 Ų | 53 | 55 Ų | 55 | 34% | 0.344 | 29% | 0.289 | S | S | . | . | trans | -55.5 | 150.2 | 176 | 23.5 | -33.6 | 0 | 0 | 0 | 111.2 | L54 E96 A97 R98 | L54-P94 HydrophobicContact CD1-CG 3.56Å; L54-P94 HydrophobicContact CD2-CG 3.77Å; L54-P94 HydrophobicContact CG-CG 4.33Å; P94-E96 WeakPolarHBondContact CB-OE2 3.48Å; P94-E96 PolarHBondContact O-N 3.49Å; P94-A97 HydrophobicContact CG-CB 4.06Å; P94-A97 PolarHBondContact O-N 2.77Å; P94-A97 VanDerWaalsContact O-N 3.12Å; P94-R98 PolarHBondContact O-N 3.23Å | ||
| 95 | L | 90.4 | Very high | 88.4 | Confident | 87 Ų | 87 | 56.2 Ų | 56.2 | 46% | 0.455 | 29% | 0.293 | S | S | . | . | H | α-helix | trans | -58.2 | -37.5 | -175.3 | -177.1 | 64.8 | 0 | 0 | 0 | 111.5 | A97 R98 H99 | L95-A97 VanDerWaalsContact C-N 3.32Å; L95-A97 PolarHBondContact O-N 2.87Å; L95-R98 PolarHBondContact O-N 3.18Å; L95-H99 VanDerWaalsContact CD1-NE2 3.33Å; L95-H99 WeakPolarHBondContact CD1-NE2 3.26Å; L95-H99 WeakPolarHBondContact CG-CE1 3.3Å; L95-H99 WeakPolarHBondContact O-CB 3.27Å; L95-H99 VanDerWaalsContact O-CG 3.29Å; L95-H99 PolarHBondContact O-N 2.89Å |
| 96 | E | 92.4 | Very high | 87.4 | Confident | 121 Ų | 121 | 63.2 Ų | 63.2 | 57% | 0.565 | 32% | 0.323 | S | S | * | . | H | α-helix | trans | -58.6 | -42.6 | 178.4 | -61 | 76.8 | -170.5 | 0 | 0 | 111.6 | I58 P94 H99 A100 | I58-E96 HydrophobicContact CD1-CB 4.01Å; P94-E96 WeakPolarHBondContact CB-OE2 3.48Å; P94-E96 PolarHBondContact O-N 3.49Å; E96-H99 PolarHBondContact O-N 3.09Å; E96-A100 WeakPolarHBondContact O-CB 3.41Å; E96-A100 PolarHBondContact O-N 3.12Å |
| 97 | A | 90.9 | Very high | 85.8 | Confident | 0 Ų | 0 | 64.8 Ų | 64.8 | 0% | 0 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -65.8 | -46.3 | 178.5 | 0 | 0 | 0 | 0 | 0 | 111.6 | L54 I58 L88 R93 P94 L95 H99 A100 V101 | L54-A97 HydrophobicContact CD1-CB 4.32Å; L54-A97 HydrophobicContact CD2-CB 4.4Å; L54-A97 HydrophobicContact CG-CB 4.45Å; I58-A97 HydrophobicContact CD1-CB 3.89Å; I58-A97 HydrophobicContact CG1-CB 4.14Å; L88-A97 HydrophobicContact CB-CB 4.33Å; L88-A97 HydrophobicContact CD2-CB 4.32Å; R93-A97 HydrophobicContact CB-CB 4.45Å; P94-A97 HydrophobicContact CG-CB 4.06Å; P94-A97 PolarHBondContact O-N 2.77Å; P94-A97 VanDerWaalsContact O-N 3.12Å; L95-A97 VanDerWaalsContact C-N 3.32Å; L95-A97 PolarHBondContact O-N 2.87Å; A97-H99 VanDerWaalsContact C-N 3.35Å; A97-H99 PolarHBondContact O-N 3.16Å; A97-A100 PolarHBondContact O-N 2.92Å; A97-V101 PolarHBondContact O-N 3.5Å |
| 98 | R | 91.6 | Very high | 84 | Confident | 75 Ų | 75 | 67.1 Ų | 67.1 | 28% | 0.283 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -61.7 | -44.3 | 178.1 | -66.2 | -178.5 | -76.9 | -178.6 | -5.8 | 111.1 | L88 P91 R93 P94 L95 A100 V101 L102 | L88-R98 VanDerWaalsContact O-CG 3.23Å; L88-R98 WeakPolarHBondContact O-CG 3.46Å; P91-R98 PolarHBondContact O-NH1 2.99Å; R93-R98 HydrophobicContact CB-CG 4.32Å; R93-R98 VanDerWaalsContact O-CZ 3.29Å; R93-R98 PolarHBondContact O-NE 3.3Å; R93-R98 PolarHBondContact O-NH2 3.12Å; P94-R98 PolarHBondContact O-N 3.23Å; L95-R98 PolarHBondContact O-N 3.18Å; R98-A100 PolarHBondContact O-N 3.47Å; R98-V101 PolarHBondContact O-N 3.04Å; R98-L102 VanDerWaalsContact O-CG 3.29Å; R98-L102 WeakPolarHBondContact O-CG 3.49Å; R98-L102 PolarHBondContact O-N 3.23Å |
| 99 | H | 90.6 | Very high | 81.8 | Confident | 106 Ų | 106 | 71.5 Ų | 71.5 | 49% | 0.491 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -63.7 | -39.2 | 177.4 | -74.1 | 175.7 | 0 | 0 | 0 | 113.1 | L95 E96 A97 L102 A103 | L95-H99 VanDerWaalsContact CD1-NE2 3.33Å; L95-H99 WeakPolarHBondContact CD1-NE2 3.26Å; L95-H99 WeakPolarHBondContact CG-CE1 3.3Å; L95-H99 WeakPolarHBondContact O-CB 3.27Å; L95-H99 VanDerWaalsContact O-CG 3.29Å; L95-H99 PolarHBondContact O-N 2.89Å; E96-H99 PolarHBondContact O-N 3.09Å; A97-H99 VanDerWaalsContact C-N 3.35Å; A97-H99 PolarHBondContact O-N 3.16Å; H99-L102 PolarHBondContact O-N 3.34Å; H99-A103 WeakPolarHBondContact O-CB 3.29Å; H99-A103 PolarHBondContact O-N 3.18Å |
| 100 | A | 90.4 | Very high | 79.7 | Confident | 14 Ų | 14 | 75.9 Ų | 75.9 | 12% | 0.116 | 40% | 0.404 | C | S | . | . | H | α-helix | trans | -60.3 | -47 | 177 | 0 | 0 | 0 | 0 | 0 | 111.5 | I58 I61 E96 A97 R98 L102 A103 L104 | I58-A100 HydrophobicContact CG2-CB 4.1Å; I61-A100 HydrophobicContact CB-CB 4.31Å; I61-A100 HydrophobicContact CD1-CB 4.44Å; I61-A100 HydrophobicContact CG2-CB 3.95Å; I61-A100 WeakPolarHBondContact CG2-O 3.23Å; E96-A100 WeakPolarHBondContact O-CB 3.41Å; E96-A100 PolarHBondContact O-N 3.12Å; A97-A100 PolarHBondContact O-N 2.92Å; R98-A100 PolarHBondContact O-N 3.47Å; A100-L102 PolarHBondContact O-N 3.41Å; A100-A103 WeakPolarHBondContact O-CB 3.36Å; A100-A103 PolarHBondContact O-N 3.25Å; A100-L104 PolarHBondContact O-N 3.33Å |
| 101 | V | 89.1 | Confident | 77.6 | Confident | 0 Ų | 0 | 73.4 Ų | 73.4 | 0% | 0 | 40% | 0.396 | C | S | . | . | H | α-helix | trans | -63.6 | -42.9 | 177 | 178.3 | 0 | 0 | 0 | 0 | 111.5 | I61 W82 V85 L88 L89 A97 R98 A103 L104 L105 | I61-V101 HydrophobicContact CD1-CG2 3.91Å; W82-V101 HydrophobicContact CZ3-CG1 4.29Å; V85-V101 HydrophobicContact CB-CG2 4.03Å; V85-V101 HydrophobicContact CG2-CG1 3.91Å; V85-V101 HydrophobicContact CG2-CG2 3.99Å; L88-V101 HydrophobicContact CB-CG2 3.76Å; L88-V101 HydrophobicContact CD1-CG2 4.12Å; L89-V101 HydrophobicContact CD1-CG1 3.83Å; L89-V101 HydrophobicContact CD2-CB 3.89Å; L89-V101 HydrophobicContact CD2-CG1 3.86Å; L89-V101 HydrophobicContact CG-CB 4.15Å; L89-V101 HydrophobicContact CG-CG1 3.76Å; A97-V101 PolarHBondContact O-N 3.5Å; R98-V101 PolarHBondContact O-N 3.04Å; V101-A103 VanDerWaalsContact C-N 3.27Å; V101-A103 PolarHBondContact O-N 3.29Å; V101-L104 WeakPolarHBondContact O-CB 3.21Å; V101-L104 PolarHBondContact O-N 3.48Å; V101-L104 VanDerWaalsContact O-N 3.15Å; V101-L105 PolarHBondContact O-N 3.32Å |
| 102 | L | 86.3 | Confident | 75.6 | Confident | 69 Ų | 69 | 73 Ų | 73 | 36% | 0.361 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -64.5 | -32.1 | 177.5 | -68.9 | 172.5 | 0 | 0 | 0 | 112.5 | L89 R98 H99 A100 L104 L105 K106 L126 | L89-L102 HydrophobicContact CD2-CD2 4.23Å; L89-L102 HydrophobicContact CD2-CG 4.12Å; R98-L102 VanDerWaalsContact O-CG 3.29Å; R98-L102 WeakPolarHBondContact O-CG 3.49Å; R98-L102 PolarHBondContact O-N 3.23Å; H99-L102 PolarHBondContact O-N 3.34Å; A100-L102 PolarHBondContact O-N 3.41Å; L102-L104 VanDerWaalsContact C-N 3.33Å; L102-L105 PolarHBondContact O-N 3.22Å; L102-K106 PolarHBondContact O-N 2.95Å; L102-K106 VanDerWaalsContact O-N 3.09Å; L102-L126 HydrophobicContact CD2-CD2 4.46Å |
| 103 | A | 84.2 | Confident | 73.5 | Confident | 54 Ų | 54 | 69 Ų | 69 | 45% | 0.446 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -66.4 | -34.9 | 174.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | H99 A100 V101 L105 K106 | H99-A103 WeakPolarHBondContact O-CB 3.29Å; H99-A103 PolarHBondContact O-N 3.18Å; A100-A103 WeakPolarHBondContact O-CB 3.36Å; A100-A103 PolarHBondContact O-N 3.25Å; V101-A103 VanDerWaalsContact C-N 3.27Å; V101-A103 PolarHBondContact O-N 3.29Å; A103-L105 VanDerWaalsContact C-N 3.3Å; A103-L105 PolarHBondContact O-N 3.42Å; A103-K106 PolarHBondContact O-N 3.43Å |
| 104 | L | 80.4 | Confident | 71.2 | Confident | 32 Ų | 32 | 71.9 Ų | 71.9 | 17% | 0.168 | 40% | 0.399 | C | S | . | . | H | α-helix | trans | -66.2 | -33.4 | 174.2 | -173.1 | 126.2 | 0 | 0 | 0 | 112.3 | I61 I64 C65 L81 A100 V101 L102 K106 | I61-L104 HydrophobicContact CG2-CB 4.14Å; I61-L104 HydrophobicContact CG2-CD1 4.14Å; I64-L104 HydrophobicContact CB-CD1 4.13Å; I64-L104 HydrophobicContact CG2-CD1 3.67Å; C65-L104 WeakPolarHBondContact SG-CA 3.47Å; C65-L104 PolarHBondContact SG-N 3.37Å; C65-L104 VanDerWaalsContact SG-N 3.44Å; L81-L104 HydrophobicContact CD1-CD1 4.49Å; A100-L104 PolarHBondContact O-N 3.33Å; V101-L104 WeakPolarHBondContact O-CB 3.21Å; V101-L104 PolarHBondContact O-N 3.48Å; V101-L104 VanDerWaalsContact O-N 3.15Å; L102-L104 VanDerWaalsContact C-N 3.33Å; L104-K106 VanDerWaalsContact C-N 3.33Å |
| 105 | L | 73.6 | Confident | 69.1 | Low | 47 Ų | 47 | 73.2 Ų | 73.2 | 25% | 0.246 | 40% | 0.403 | C | S | . | . | H | α-helix | trans | -81.4 | -12.8 | 176 | -61.5 | 178.7 | 0 | 0 | 0 | 113.4 | W82 V101 L102 A103 P107 | W82-L105 HydrophobicContact CE3-CD2 4.39Å; W82-L105 HydrophobicContact CZ3-CD1 3.91Å; V101-L105 PolarHBondContact O-N 3.32Å; L102-L105 PolarHBondContact O-N 3.22Å; A103-L105 VanDerWaalsContact C-N 3.3Å; A103-L105 PolarHBondContact O-N 3.42Å; L105-P107 VanDerWaalsContact O-CD 3.31Å; L105-P107 WeakPolarHBondContact O-CD 3.38Å |
| 106 | K | 69.9 | Low | 67 | Low | 149 Ų | 149 | 75 Ų | 75 | 65% | 0.648 | 40% | 0.404 | S | S | * | . | S | Bend | trans | -81.8 | 114.3 | -179.9 | -171.1 | 173.7 | -178.8 | 174.5 | 0 | 108.6 | L102 A103 L104 | L102-K106 PolarHBondContact O-N 2.95Å; L102-K106 VanDerWaalsContact O-N 3.09Å; A103-K106 PolarHBondContact O-N 3.43Å; L104-K106 VanDerWaalsContact C-N 3.33Å |
| 107 | P | 56.8 | Low | 64.6 | Low | 64 Ų | 64 | 72.9 Ų | 72.9 | 42% | 0.416 | 40% | 0.401 | S | S | . | . | trans | -62.1 | 142.1 | 178.8 | 25.3 | -32.8 | 0 | 0 | 0 | 110.2 | L105 T109 T111 | L105-P107 VanDerWaalsContact O-CD 3.31Å; L105-P107 WeakPolarHBondContact O-CD 3.38Å; P107-T109 PolarHBondContact O-N 3.29Å; P107-T109 VanDerWaalsContact O-N 3.12Å; P107-T111 HydrophobicContact CB-CG2 4.46Å; P107-T111 WeakPolarHBondContact CB-OG1 3.29Å | ||
| 108 | P | 53.8 | Low | 62.4 | Low | 81 Ų | 81 | 77.2 Ų | 77.2 | 53% | 0.526 | 43% | 0.428 | S | S | . | . | S | Bend | trans | -69.9 | -3.2 | -176.5 | 25.3 | -32.9 | 0 | 0 | 0 | 114.8 | K69 | K69-P108 HydrophobicContact CB-CB 4.46Å; K69-P108 HydrophobicContact CG-CB 4Å |
| 109 | T | 44.9 | Very low | 60.3 | Low | 92 Ų | 92 | 76 Ų | 76 | 56% | 0.564 | 43% | 0.427 | S | S | * | . | S | Bend | trans | -151.8 | 165.5 | 179.1 | 54.3 | 0 | 0 | 0 | 0 | 109.7 | P107 T111 | P107-T109 PolarHBondContact O-N 3.29Å; P107-T109 VanDerWaalsContact O-N 3.12Å; T109-T111 PolarHBondContact O-N 3.47Å |
| 110 | P | 44.7 | Very low | 58.2 | Low | 123 Ų | 123 | 77.5 Ų | 77.5 | 80% | 0.799 | 43% | 0.428 | S | S | * | . | trans | -68.4 | 84.6 | 174 | 28.7 | -33.9 | 0 | 0 | 0 | 109.9 | ||||
| 111 | T | 43.4 | Very low | 56.2 | Low | 51 Ų | 51 | 80.6 Ų | 80.6 | 31% | 0.313 | 45% | 0.447 | S | S | . | . | trans | -75 | 138 | 168.8 | 46.8 | 0 | 0 | 0 | 0 | 109.5 | P107 T109 L115 | P107-T111 HydrophobicContact CB-CG2 4.46Å; P107-T111 WeakPolarHBondContact CB-OG1 3.29Å; T109-T111 PolarHBondContact O-N 3.47Å; T111-L115 HydrophobicContact CG2-CD1 4.04Å | ||
| 112 | P | 41 | Very low | 54.3 | Low | 72 Ų | 72 | 83.1 Ų | 83.1 | 47% | 0.468 | 46% | 0.46 | S | S | . | . | trans | -62.6 | 155.1 | 177.9 | -10.5 | 23.1 | 0 | 0 | 0 | 111.4 | Y114 L115 | P112-Y114 HydrophobicContact CB-CD1 3.66Å; P112-Y114 HydrophobicContact CB-CE1 3.3Å; P112-Y114 VanDerWaalsContact CD-CZ 3.5Å; P112-Y114 VanDerWaalsContact CD-OH 3.27Å; P112-Y114 WeakPolarHBondContact CD-OH 3.42Å; P112-Y114 HydrophobicContact CG-CD1 4.19Å; P112-Y114 HydrophobicContact CG-CE1 3.31Å; P112-Y114 WeakPolarHBondContact CG-OH 3.38Å; P112-Y114 PolarHBondContact O-N 3.36Å; P112-L115 PolarHBondContact O-N 3.27Å | ||
| 113 | A | 47.3 | Very low | 52.3 | Low | 72 Ų | 72 | 81.6 Ų | 81.6 | 60% | 0.595 | 46% | 0.457 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -51.8 | -10.3 | -167.7 | 0 | 0 | 0 | 0 | 0 | 117.1 | L115 W116 C117 | A113-L115 PolarHBondContact O-N 3.44Å; A113-W116 WeakPolarHBondContact O-CB 3.33Å; A113-W116 PolarHBondContact O-N 3.5Å; A113-C117 PolarHBondContact O-N 2.95Å |
| 114 | Y | 41.5 | Very low | 50.4 | Low | 148 Ų | 148 | 86.4 Ų | 86.4 | 58% | 0.58 | 47% | 0.468 | S | S | * | . | H | α-helix | trans | -66.4 | -30.5 | -178.9 | 50 | -109.5 | 0 | 0 | 0 | 114.4 | P112 C117 T118 | P112-Y114 HydrophobicContact CB-CD1 3.66Å; P112-Y114 HydrophobicContact CB-CE1 3.3Å; P112-Y114 VanDerWaalsContact CD-CZ 3.5Å; P112-Y114 VanDerWaalsContact CD-OH 3.27Å; P112-Y114 WeakPolarHBondContact CD-OH 3.42Å; P112-Y114 HydrophobicContact CG-CD1 4.19Å; P112-Y114 HydrophobicContact CG-CE1 3.31Å; P112-Y114 WeakPolarHBondContact CG-OH 3.38Å; P112-Y114 PolarHBondContact O-N 3.36Å; Y114-C117 PolarHBondContact O-N 2.89Å; Y114-T118 PolarHBondContact O-N 3.16Å; Y114-T118 PolarHBondContact O-OG1 2.95Å |
| 115 | L | 47.2 | Very low | 48.6 | Very low | 81 Ų | 81 | 90.1 Ų | 90.1 | 42% | 0.424 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -74.8 | -30.3 | 175.1 | -97.2 | 150.8 | 0 | 0 | 0 | 112.2 | T111 P112 A113 C117 T118 L119 | T111-L115 HydrophobicContact CG2-CD1 4.04Å; P112-L115 PolarHBondContact O-N 3.27Å; A113-L115 PolarHBondContact O-N 3.44Å; L115-C117 VanDerWaalsContact C-N 3.32Å; L115-T118 WeakPolarHBondContact CA-OG1 3.43Å; L115-T118 PolarHBondContact O-N 3.45Å; L115-T118 PolarHBondContact O-OG1 2.75Å; L115-L119 PolarHBondContact O-N 3Å |
| 116 | W | 47.5 | Very low | 47.2 | Very low | 125 Ų | 125 | 91 Ų | 91 | 47% | 0.473 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -66.4 | -36.7 | 170 | -170 | -101.6 | 0 | 0 | 0 | 111.3 | A113 T118 L119 R120 Q130 | A113-W116 WeakPolarHBondContact O-CB 3.33Å; A113-W116 PolarHBondContact O-N 3.5Å; W116-T118 VanDerWaalsContact C-N 3.34Å; W116-T118 PolarHBondContact O-N 3.19Å; W116-L119 PolarHBondContact O-N 3.07Å; W116-R120 WeakPolarHBondContact O-CB 3.35Å; W116-R120 PolarHBondContact O-N 3.23Å; W116-Q130 HydrophobicContact CZ2-CG 4.15Å |
| 117 | C | 42.2 | Very low | 45.8 | Very low | 76 Ų | 76 | 92.4 Ų | 92.4 | 51% | 0.514 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -67.8 | -29.6 | 176.8 | -71.2 | 0 | 0 | 0 | 0 | 113.5 | A113 Y114 L115 R120 | A113-C117 PolarHBondContact O-N 2.95Å; Y114-C117 PolarHBondContact O-N 2.89Å; L115-C117 VanDerWaalsContact C-N 3.32Å; C117-R120 WeakPolarHBondContact O-CB 3.44Å |
| 118 | T | 44.4 | Very low | 45.1 | Very low | 91 Ų | 91 | 100.8 Ų | 100.8 | 56% | 0.558 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -81.3 | -27.8 | 176.1 | 15.7 | 0 | 0 | 0 | 0 | 113 | Y114 L115 W116 P121 | Y114-T118 PolarHBondContact O-N 3.16Å; Y114-T118 PolarHBondContact O-OG1 2.95Å; L115-T118 WeakPolarHBondContact CA-OG1 3.43Å; L115-T118 PolarHBondContact O-N 3.45Å; L115-T118 PolarHBondContact O-OG1 2.75Å; W116-T118 VanDerWaalsContact C-N 3.34Å; W116-T118 PolarHBondContact O-N 3.19Å; T118-P121 WeakPolarHBondContact O-CD 3.39Å |
| 119 | L | 46.8 | Very low | 44.5 | Very low | 49 Ų | 49 | 103.4 Ų | 103.4 | 26% | 0.257 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -83.2 | -15.8 | 171.9 | -72.7 | 164.9 | 0 | 0 | 0 | 113.3 | V78 L115 W116 P121 I122 A123 | V78-L119 HydrophobicContact CG1-CD2 4.25Å; L115-L119 PolarHBondContact O-N 3Å; W116-L119 PolarHBondContact O-N 3.07Å; L119-P121 VanDerWaalsContact C-CD 3.44Å; L119-I122 PolarHBondContact O-N 3.27Å; L119-I122 VanDerWaalsContact O-N 3.07Å; L119-A123 PolarHBondContact O-N 3.04Å |
| 120 | R | 46.6 | Very low | 44.5 | Very low | 138 Ų | 138 | 103.9 Ų | 103.9 | 52% | 0.521 | 54% | 0.535 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -57.3 | -35.7 | 179.2 | -170.3 | 179.9 | -99.2 | -148.7 | -5.5 | 115.1 | W116 C117 I122 | W116-R120 WeakPolarHBondContact O-CB 3.35Å; W116-R120 PolarHBondContact O-N 3.23Å; C117-R120 WeakPolarHBondContact O-CB 3.44Å; R120-I122 VanDerWaalsContact C-N 3.3Å |
| 121 | P | 48.5 | Very low | 44.5 | Very low | 78 Ų | 78 | 102 Ų | 102 | 51% | 0.506 | 52% | 0.523 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -70.9 | -25.4 | 174.7 | -16.2 | 31 | 0 | 0 | 0 | 113.5 | T118 L119 K124 | T118-P121 WeakPolarHBondContact O-CD 3.39Å; L119-P121 VanDerWaalsContact C-CD 3.44Å; P121-K124 WeakPolarHBondContact O-CD 3.4Å; P121-K124 WeakPolarHBondContact O-CG 3.46Å |
| 122 | I | 50 | Low | 44.5 | Very low | 53 Ų | 53 | 102.3 Ų | 102.3 | 27% | 0.272 | 53% | 0.527 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -90.9 | -32.5 | -173.9 | -60.9 | 173.4 | 0 | 0 | 0 | 111 | E79 W82 L119 R120 K124 | E79-I122 HydrophobicContact CG-CD1 4.36Å; W82-I122 HydrophobicContact CB-CG2 4.43Å; W82-I122 HydrophobicContact CD2-CG2 3.98Å; W82-I122 HydrophobicContact CG-CG2 3.64Å; W82-I122 VanDerWaalsContact NE1-CG2 3.3Å; L119-I122 PolarHBondContact O-N 3.27Å; L119-I122 VanDerWaalsContact O-N 3.07Å; R120-I122 VanDerWaalsContact C-N 3.3Å; I122-K124 PolarHBondContact O-N 3.18Å |
| 123 | A | 44.5 | Very low | 45 | Very low | 38 Ų | 38 | 103.3 Ų | 103.3 | 31% | 0.314 | 53% | 0.534 | S | S | . | . | trans | -80.2 | 16.9 | 177.7 | 0 | 0 | 0 | 0 | 0 | 114.8 | L119 P125 L126 | L119-A123 PolarHBondContact O-N 3.04Å; A123-P125 VanDerWaalsContact C-N 3.31Å; A123-P125 WeakPolarHBondContact O-CD 3.44Å; A123-P125 VanDerWaalsContact O-N 3.12Å; A123-L126 PolarHBondContact O-N 2.99Å | ||
| 124 | K | 44.2 | Very low | 45.2 | Very low | 155 Ų | 155 | 105.7 Ų | 105.7 | 67% | 0.674 | 53% | 0.532 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63 | -8.7 | -173.9 | -79.8 | -179.2 | 175.6 | 174.9 | 0 | 117.8 | P121 I122 | P121-K124 WeakPolarHBondContact O-CD 3.4Å; P121-K124 WeakPolarHBondContact O-CG 3.46Å; I122-K124 PolarHBondContact O-N 3.18Å |
| 125 | P | 41.2 | Very low | 45.7 | Very low | 109 Ų | 109 | 102.6 Ų | 102.6 | 71% | 0.708 | 53% | 0.525 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -87.4 | -10.9 | 165.8 | 2.8 | 15.5 | 0 | 0 | 0 | 113.7 | A123 H127 | A123-P125 VanDerWaalsContact C-N 3.31Å; A123-P125 WeakPolarHBondContact O-CD 3.44Å; A123-P125 VanDerWaalsContact O-N 3.12Å; P125-H127 VanDerWaalsContact C-N 3.27Å; P125-H127 PolarHBondContact O-N 3.48Å; P125-H127 VanDerWaalsContact O-N 3.12Å |
| 126 | L | 44.3 | Very low | 45.8 | Very low | 66 Ų | 66 | 101.5 Ų | 101.5 | 35% | 0.346 | 53% | 0.528 | S | S | . | . | trans | -89.5 | 42.7 | -173.8 | -127.8 | 85.8 | 0 | 0 | 0 | 113.1 | L89 L102 A123 R128 | L89-L126 HydrophobicContact CD1-CD1 4.27Å; L102-L126 HydrophobicContact CD2-CD2 4.46Å; A123-L126 PolarHBondContact O-N 2.99Å; L126-R128 PolarHBondContact O-N 3.21Å | ||
| 127 | H | 41.5 | Very low | 45.8 | Very low | 178 Ų | 178 | 102.5 Ų | 102.5 | 82% | 0.824 | 54% | 0.54 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -77 | 23 | -172.2 | -131.7 | -95 | 0 | 0 | 0 | 115.2 | P125 | P125-H127 VanDerWaalsContact C-N 3.27Å; P125-H127 PolarHBondContact O-N 3.48Å; P125-H127 VanDerWaalsContact O-N 3.12Å |
| 128 | R | 42 | Very low | 46.1 | Very low | 241 Ų | 241 | 106 Ų | 106 | 91% | 0.909 | 54% | 0.542 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -128.1 | 4.9 | 179.6 | -114.7 | -172.5 | -163.1 | -156.7 | 5.6 | 115.8 | L126 | L126-R128 PolarHBondContact O-N 3.21Š|
| 129 | L | 40.2 | Very low | 46.2 | Very low | 135 Ų | 135 | 107.7 Ų | 107.7 | 71% | 0.707 | 54% | 0.538 | S | S | * | . | trans | -138.1 | 65.4 | 179.5 | -67.8 | 170.3 | 0 | 0 | 0 | 111 | ||||
| 130 | Q | 45.3 | Very low | 46.2 | Very low | 103 Ų | 103 | 109.2 Ų | 109.2 | 48% | 0.481 | 56% | 0.558 | S | S | . | * | trans | -131.8 | 132 | 162.6 | -91.1 | -99.5 | -96.2 | 0 | 0 | 109.8 | W116 | W116-Q130 HydrophobicContact CZ2-CG 4.15Š| ||
| 131 | P | 45.5 | Very low | 46.5 | Very low | 84 Ų | 84 | 106.3 Ų | 106.3 | 55% | 0.545 | 56% | 0.559 | S | S | . | * | trans | -67.2 | 147.9 | 161.2 | 29.3 | -31.1 | 0 | 0 | 0 | 109.5 | ||||
| 132 | S | 43.4 | Very low | 46.4 | Very low | 56 Ų | 56 | 105.9 Ų | 105.9 | 39% | 0.392 | 57% | 0.568 | S | S | . | * | trans | -53 | 143.1 | -174.8 | -64.7 | 0 | 0 | 0 | 0 | 113.2 | H134 L135 A136 | S132-H134 WeakPolarHBondContact CB-CE1 3.34Å; S132-H134 WeakPolarHBondContact CB-ND1 3.38Å; S132-H134 PolarHBondContact O-N 3.4Å; S132-L135 WeakPolarHBondContact O-CB 3.42Å; S132-L135 PolarHBondContact O-N 2.97Å; S132-A136 PolarHBondContact O-N 3.43Å | ||
| 133 | P | 50.5 | Low | 46.4 | Very low | 94 Ų | 94 | 107 Ų | 107 | 61% | 0.61 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -57.7 | -26.9 | -175.7 | 19.2 | -30.9 | 0 | 0 | 0 | 113.9 | L135 A136 M137 | P133-L135 VanDerWaalsContact C-N 3.35Å; P133-A136 PolarHBondContact O-N 3.26Å; P133-M137 PolarHBondContact O-N 3.46Å |
| 134 | H | 51.5 | Low | 46.6 | Very low | 122 Ų | 122 | 107.1 Ų | 107.1 | 57% | 0.565 | 58% | 0.582 | S | S | * | * | H | α-helix | trans | -66.8 | -32.9 | 174.1 | 65.7 | -102.5 | 0 | 0 | 0 | 113.2 | S132 R138 | S132-H134 WeakPolarHBondContact CB-CE1 3.34Å; S132-H134 WeakPolarHBondContact CB-ND1 3.38Å; S132-H134 PolarHBondContact O-N 3.4Å; H134-R138 WeakPolarHBondContact O-CB 3.05Å; H134-R138 PolarHBondContact O-N 3.08Å |
| 135 | L | 52.2 | Low | 46.9 | Very low | 82 Ų | 82 | 105.4 Ų | 105.4 | 43% | 0.429 | 59% | 0.589 | S | S | . | * | H | α-helix | trans | -73.7 | -35.7 | 177.4 | -88.3 | 152.2 | 0 | 0 | 0 | 111.4 | S132 P133 R138 W139 | S132-L135 WeakPolarHBondContact O-CB 3.42Å; S132-L135 PolarHBondContact O-N 2.97Å; P133-L135 VanDerWaalsContact C-N 3.35Å; L135-R138 PolarHBondContact O-N 2.87Å; L135-W139 PolarHBondContact O-N 3.26Å; L135-W139 VanDerWaalsContact O-N 3.08Å |
| 136 | A | 50.6 | Low | 46.9 | Very low | 58 Ų | 58 | 104.5 Ų | 104.5 | 48% | 0.479 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -64.7 | -43.7 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112 | S132 P133 R138 W139 A140 | S132-A136 PolarHBondContact O-N 3.43Å; P133-A136 PolarHBondContact O-N 3.26Å; A136-R138 VanDerWaalsContact C-N 3.34Å; A136-R138 PolarHBondContact O-N 3.25Å; A136-W139 PolarHBondContact O-N 3.36Å; A136-A140 PolarHBondContact O-N 3.02Å |
| 137 | M | 47.3 | Very low | 46.8 | Very low | 147 Ų | 147 | 105.1 Ų | 105.1 | 72% | 0.724 | 59% | 0.594 | S | S | * | * | H | α-helix | trans | -63.7 | -39.8 | 176.2 | -71.7 | -71.8 | -85.4 | 0 | 0 | 112.1 | P133 W139 A140 S141 | P133-M137 PolarHBondContact O-N 3.46Å; M137-W139 VanDerWaalsContact C-N 3.32Å; M137-W139 PolarHBondContact O-N 3.12Å; M137-A140 PolarHBondContact O-N 3.43Å; M137-S141 PolarHBondContact O-N 3.04Å |
| 138 | R | 48.8 | Very low | 46.9 | Very low | 150 Ų | 150 | 107.9 Ų | 107.9 | 57% | 0.566 | 60% | 0.597 | S | S | * | * | H | α-helix | trans | -74.8 | -20.5 | -178.2 | -162 | 170.7 | 162.6 | -142.8 | -4.8 | 113.8 | H134 L135 A136 S141 S143 | H134-R138 WeakPolarHBondContact O-CB 3.05Å; H134-R138 PolarHBondContact O-N 3.08Å; L135-R138 PolarHBondContact O-N 2.87Å; A136-R138 VanDerWaalsContact C-N 3.34Å; A136-R138 PolarHBondContact O-N 3.25Å; R138-S141 PolarHBondContact O-OG 3.42Å; R138-S143 PolarHBondContact O-N 3.15Å |
| 139 | W | 46.1 | Very low | 46.8 | Very low | 126 Ų | 126 | 106.9 Ų | 106.9 | 48% | 0.477 | 59% | 0.593 | S | S | . | * | H | α-helix | trans | -78.3 | -41.5 | 170.4 | -160.7 | 64.2 | 0 | 0 | 0 | 111.5 | L135 A136 M137 S141 G142 A144 | L135-W139 PolarHBondContact O-N 3.26Å; L135-W139 VanDerWaalsContact O-N 3.08Å; A136-W139 PolarHBondContact O-N 3.36Å; M137-W139 VanDerWaalsContact C-N 3.32Å; M137-W139 PolarHBondContact O-N 3.12Å; W139-S141 PolarHBondContact O-N 2.87Å; W139-G142 PolarHBondContact O-N 2.94Å; W139-A144 PolarHBondContact NE1-O 3.1Å |
| 140 | A | 45.7 | Very low | 46.6 | Very low | 81 Ų | 81 | 111 Ų | 111 | 67% | 0.669 | 60% | 0.6 | S | S | * | * | H | α-helix | trans | -62.3 | -26.9 | 176.2 | 0 | 0 | 0 | 0 | 0 | 113.2 | A136 M137 G142 | A136-A140 PolarHBondContact O-N 3.02Å; M137-A140 PolarHBondContact O-N 3.43Å; A140-G142 VanDerWaalsContact C-N 3.26Å; A140-G142 PolarHBondContact O-N 3.44Å |
| 141 | S | 52.8 | Low | 46.5 | Very low | 76 Ų | 76 | 112.1 Ų | 112.1 | 53% | 0.531 | 61% | 0.613 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -82.6 | 7.3 | 174.4 | 63.5 | 0 | 0 | 0 | 0 | 114.4 | M137 R138 W139 S143 | M137-S141 PolarHBondContact O-N 3.04Å; R138-S141 PolarHBondContact O-OG 3.42Å; W139-S141 PolarHBondContact O-N 2.87Å; S141-S143 PolarHBondContact O-N 2.79Å; S141-S143 VanDerWaalsContact O-N 3.15Å; S141-S143 PolarHBondContact O-OG 3.23Å; S141-S143 PolarHBondContact OG-OG 3.05Å; S141-S143 VanDerWaalsContact OG-OG 3.08Å |
| 142 | G | 46.2 | Very low | 45.8 | Very low | 69 Ų | 69 | 113.2 Ų | 113.2 | 71% | 0.711 | 62% | 0.623 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 68.3 | 10.1 | 179.5 | 0 | 0 | 0 | 0 | 0 | 114.5 | W139 A140 | W139-G142 PolarHBondContact O-N 2.94Å; A140-G142 VanDerWaalsContact C-N 3.26Å; A140-G142 PolarHBondContact O-N 3.44Å |
| 143 | S | 50.6 | Low | 45.6 | Very low | 78 Ų | 78 | 116 Ų | 116 | 55% | 0.545 | 64% | 0.64 | S | S | . | * | trans | -92 | 5.6 | -172.8 | -44.1 | 0 | 0 | 0 | 0 | 113.9 | R138 S141 | R138-S143 PolarHBondContact O-N 3.15Å; S141-S143 PolarHBondContact O-N 2.79Å; S141-S143 VanDerWaalsContact O-N 3.15Å; S141-S143 PolarHBondContact O-OG 3.23Å; S141-S143 PolarHBondContact OG-OG 3.05Å; S141-S143 VanDerWaalsContact OG-OG 3.08Å | ||
| 144 | A | 49.5 | Very low | 45.3 | Very low | 39 Ų | 39 | 116.7 Ų | 116.7 | 32% | 0.322 | 65% | 0.647 | S | S | . | * | S | Bend | trans | -143.1 | 132.8 | 179.8 | 0 | 0 | 0 | 0 | 0 | 111.7 | W139 | W139-A144 PolarHBondContact NE1-O 3.1Š|
| 145 | S | 49.8 | Very low | 44.6 | Very low | 119 Ų | 119 | 122.6 Ų | 122.6 | 83% | 0.832 | 68% | 0.681 | S | S | * | * | trans | -63 | 146 | 170.6 | -57.7 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 146 | S | 41.2 | Very low | 44.3 | Very low | 91 Ų | 91 | 124.7 Ų | 124.7 | 64% | 0.636 | 69% | 0.694 | S | S | * | * | trans | -33.7 | 126.6 | 179.6 | -166.6 | 0 | 0 | 0 | 0 | 112.8 | R148 | S146-R148 PolarHBondContact O-N 3.41Š| ||
| 147 | P | 43.3 | Very low | 43.9 | Very low | 79 Ų | 79 | 128.2 Ų | 128.2 | 51% | 0.513 | 71% | 0.705 | S | S | . | * | trans | -61.8 | 106.9 | -179.2 | 24.3 | -31.9 | 0 | 0 | 0 | 108.8 | W149 | P147-W149 PolarHBondContact O-N 3.39Š| ||
| 148 | R | 42.6 | Very low | 43.8 | Very low | 235 Ų | 235 | 127.1 Ų | 127.1 | 89% | 0.887 | 70% | 0.704 | S | S | * | * | trans | -57.5 | 108.6 | 166.1 | -177.8 | -179.8 | -70.8 | -118.7 | 1.4 | 106.1 | S146 R150 | S146-R148 PolarHBondContact O-N 3.41Å; R148-R150 VanDerWaalsContact C-N 3.31Å; R148-R150 PolarHBondContact O-N 3.04Å | ||
| 149 | W | 40.4 | Very low | 43.5 | Very low | 221 Ų | 221 | 125.8 Ų | 125.8 | 84% | 0.837 | 71% | 0.712 | S | S | * | * | trans | -51.5 | 98.2 | 171.1 | -58.9 | 90.8 | 0 | 0 | 0 | 107.8 | P147 T151 | P147-W149 PolarHBondContact O-N 3.39Å; W149-T151 VanDerWaalsContact C-N 3.31Å; W149-T151 PolarHBondContact O-N 3.2Å | ||
| 150 | R | 36.4 | Very low | 43.3 | Very low | 222 Ų | 222 | 125.8 Ų | 125.8 | 84% | 0.838 | 73% | 0.727 | S | S | * | * | trans | -76.8 | 95.2 | 171.6 | -169.1 | -176.6 | -67 | -103.7 | 4.2 | 104.7 | R148 S152 | R148-R150 VanDerWaalsContact C-N 3.31Å; R148-R150 PolarHBondContact O-N 3.04Å; R150-S152 PolarHBondContact O-N 3.08Å; R150-S152 VanDerWaalsContact O-N 3.1Å | ||
| 151 | T | 41.9 | Very low | 43.1 | Very low | 125 Ų | 125 | 128.7 Ų | 128.7 | 77% | 0.767 | 73% | 0.731 | S | S | * | * | trans | -54.5 | 113.7 | 154.4 | 43.3 | 0 | 0 | 0 | 0 | 105.8 | W149 P153 | W149-T151 VanDerWaalsContact C-N 3.31Å; W149-T151 PolarHBondContact O-N 3.2Å; T151-P153 WeakPolarHBondContact O-CD 3.22Å | ||
| 152 | S | 32.1 | Very low | 42.4 | Very low | 107 Ų | 107 | 132.5 Ų | 132.5 | 75% | 0.748 | 75% | 0.745 | S | S | * | * | P | Polyproline II helix | trans | -52.4 | 124.5 | 171.8 | -67.6 | 0 | 0 | 0 | 0 | 108.2 | R150 S154 | R150-S152 PolarHBondContact O-N 3.08Å; R150-S152 VanDerWaalsContact O-N 3.1Å; S152-S154 PolarHBondContact O-N 3.35Å |
| 153 | P | 39.3 | Very low | 42.2 | Very low | 114 Ų | 114 | 137.4 Ų | 137.4 | 74% | 0.74 | 75% | 0.748 | S | S | * | * | P | Polyproline II helix | trans | -71.3 | 120.1 | 156 | 20.6 | -9.2 | 0 | 0 | 0 | 106.1 | T151 L155 | T151-P153 WeakPolarHBondContact O-CD 3.22Å; P153-L155 PolarHBondContact O-N 3.34Å |
| 154 | S | 42.6 | Very low | 41.4 | Very low | 109 Ų | 109 | 142.3 Ų | 142.3 | 76% | 0.762 | 77% | 0.765 | S | S | * | * | P | Polyproline II helix | trans | -53.8 | 120.8 | 158.1 | 35.9 | 0 | 0 | 0 | 0 | 109.5 | S152 | S152-S154 PolarHBondContact O-N 3.35Š|
| 155 | L | 38.5 | Very low | 40.7 | Very low | 247 Ų | 247 | 151.7 Ų | 151.7 | 100% | 1.293 | 81% | 0.805 | S | S | * | * | trans | -177.1 | 0 | 131.6 | -92.7 | 164.3 | 0 | 0 | 0 | 108.7 | P153 | P153-L155 PolarHBondContact O-N 3.34Š|
Retrieved 155 of 155 residues in 71 ms
(Link to these results)