| 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 | 57.6 | Low | 51.8 | Low | 228 Ų | 228 | 159.2 Ų | 159.2 | 100% | 1.123 | 73% | 0.728 | S | S | * | * | 0 | 6.8 | 0 | -127.9 | 179.8 | 178.1 | 0 | 0 | 115 | |||||
| 2 | L | 47.1 | Very low | 52.5 | Low | 143 Ų | 143 | 156.3 Ų | 156.3 | 75% | 0.749 | 72% | 0.716 | S | S | * | * | trans | -95.9 | -15.1 | -177.4 | -98.1 | 82.8 | 0 | 0 | 0 | 115.6 | F4 | L2-F4 PolarHBondContact O-N 3.46Š| ||
| 3 | R | 52 | Low | 53.2 | Low | 229 Ų | 229 | 152.5 Ų | 152.5 | 86% | 0.864 | 70% | 0.704 | S | S | * | * | H | α-helix | trans | -76.3 | -18.9 | -174.5 | -116.5 | 172.8 | 163.6 | 152.7 | -5.3 | 114.6 | ||
| 4 | F | 42.8 | Very low | 54.5 | Low | 190 Ų | 190 | 150.1 Ų | 150.1 | 83% | 0.833 | 69% | 0.693 | S | S | * | * | H | α-helix | trans | -84.2 | -24.1 | 177.7 | -89.1 | -84.7 | 0 | 0 | 0 | 113.9 | L2 | L2-F4 PolarHBondContact O-N 3.46Å |
| 5 | R | 50.4 | Low | 55.7 | Low | 213 Ų | 213 | 143.1 Ų | 143.1 | 80% | 0.804 | 67% | 0.671 | S | S | * | * | H | α-helix | trans | -76.6 | -29.4 | -178.2 | -98.5 | 179.7 | 151.5 | 159.2 | -6 | 113.5 | F9 | R5-F9 PolarHBondContact O-N 3.34Å |
| 6 | I | 51.6 | Low | 57 | Low | 112 Ų | 112 | 142.4 Ų | 142.4 | 57% | 0.574 | 67% | 0.665 | S | S | * | * | H | α-helix | trans | -73.9 | -40 | -177.3 | -59.5 | 167.4 | 0 | 0 | 0 | 111.2 | L8 F9 D10 | I6-L8 VanDerWaalsContact C-N 3.31Å; I6-L8 PolarHBondContact O-N 3.4Å; I6-F9 PolarHBondContact O-N 3.45Å; I6-D10 PolarHBondContact O-N 3.24Å |
| 7 | C | 50.2 | Low | 58.2 | Low | 81 Ų | 81 | 142.5 Ų | 142.5 | 55% | 0.547 | 66% | 0.663 | S | S | . | * | H | α-helix | trans | -68.5 | -24.5 | 176.3 | -84.2 | 0 | 0 | 0 | 0 | 114.3 | ||
| 8 | L | 52.4 | Low | 59.3 | Low | 121 Ų | 121 | 140.3 Ų | 140.3 | 63% | 0.634 | 66% | 0.656 | S | S | * | * | H | α-helix | trans | -78.8 | -30.2 | 175.6 | -157.1 | 74.1 | 0 | 0 | 0 | 111.3 | I6 H12 | I6-L8 VanDerWaalsContact C-N 3.31Å; I6-L8 PolarHBondContact O-N 3.4Å; L8-H12 PolarHBondContact O-N 3.34Å |
| 9 | F | 51.1 | Low | 60.5 | Low | 158 Ų | 158 | 138.7 Ų | 138.7 | 69% | 0.693 | 65% | 0.651 | S | S | * | * | H | α-helix | trans | -72.5 | -39.2 | 176.6 | -154.7 | -99.1 | 0 | 0 | 0 | 111.9 | R5 I6 H12 L13 | R5-F9 PolarHBondContact O-N 3.34Å; I6-F9 PolarHBondContact O-N 3.45Å; F9-H12 PolarHBondContact O-N 3.36Å; F9-L13 PolarHBondContact O-N 3.33Å |
| 10 | D | 56.7 | Low | 61.4 | Low | 92 Ų | 92 | 136.4 Ų | 136.4 | 49% | 0.492 | 64% | 0.642 | S | S | . | * | H | α-helix | trans | -67 | -40.8 | 179.9 | -122 | -50.4 | 0 | 0 | 0 | 113.1 | I6 H12 L13 H14 | I6-D10 PolarHBondContact O-N 3.24Å; D10-H12 VanDerWaalsContact C-N 3.33Å; D10-H12 PolarHBondContact O-N 2.99Å; D10-L13 PolarHBondContact O-N 3.44Å; D10-H14 PolarHBondContact O-N 3.43Å |
| 11 | R | 57.8 | Low | 62.2 | Low | 184 Ų | 184 | 134.8 Ų | 134.8 | 69% | 0.694 | 64% | 0.636 | S | S | * | * | H | α-helix | trans | -66.6 | -34.1 | 175.5 | -83.7 | -169.1 | -76.8 | -161 | -2.1 | 112.8 | A15 | R11-A15 WeakPolarHBondContact O-CB 3.45Å; R11-A15 PolarHBondContact O-N 3.44Å |
| 12 | H | 60.3 | Low | 63.2 | Low | 125 Ų | 125 | 129.6 Ų | 129.6 | 58% | 0.579 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -71.5 | -36.5 | 177.2 | -154.7 | -86.4 | 0 | 0 | 0 | 111.5 | L8 F9 D10 A15 F16 | L8-H12 PolarHBondContact O-N 3.34Å; F9-H12 PolarHBondContact O-N 3.36Å; D10-H12 VanDerWaalsContact C-N 3.33Å; D10-H12 PolarHBondContact O-N 2.99Å; H12-A15 PolarHBondContact O-N 3.03Å; H12-F16 WeakPolarHBondContact O-CB 3.4Å; H12-F16 PolarHBondContact O-N 3.06Å |
| 13 | L | 61.5 | Low | 64.7 | Low | 107 Ų | 107 | 129.5 Ų | 129.5 | 56% | 0.56 | 60% | 0.603 | S | S | * | * | H | α-helix | trans | -68.6 | -39.1 | 176.3 | -166 | 65.8 | 0 | 0 | 0 | 112 | F9 D10 F16 K17 | F9-L13 PolarHBondContact O-N 3.33Å; D10-L13 PolarHBondContact O-N 3.44Å; L13-F16 PolarHBondContact O-N 3.34Å; L13-K17 WeakPolarHBondContact O-CB 3.28Å; L13-K17 PolarHBondContact O-N 3.49Å |
| 14 | H | 71.5 | Confident | 65.8 | Low | 119 Ų | 119 | 122.5 Ų | 122.5 | 55% | 0.551 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -65.1 | -42.8 | 172.8 | -95.5 | -97.6 | 0 | 0 | 0 | 112.6 | D10 F16 K17 I18 | D10-H14 PolarHBondContact O-N 3.43Å; H14-F16 PolarHBondContact O-N 3.18Å; H14-K17 PolarHBondContact O-N 2.94Å; H14-I18 WeakPolarHBondContact O-CG1 3.43Å; H14-I18 PolarHBondContact O-N 3.39Å |
| 15 | A | 72.5 | Confident | 67.2 | Low | 45 Ų | 45 | 117.2 Ų | 117.2 | 37% | 0.372 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -62.2 | -42.1 | 175.2 | 0 | 0 | 0 | 0 | 0 | 111.8 | R11 H12 K17 I18 I19 | R11-A15 WeakPolarHBondContact O-CB 3.45Å; R11-A15 PolarHBondContact O-N 3.44Å; H12-A15 PolarHBondContact O-N 3.03Å; A15-K17 VanDerWaalsContact C-N 3.33Å; A15-K17 PolarHBondContact O-N 3.28Å; A15-I18 PolarHBondContact O-N 3.03Å; A15-I19 VanDerWaalsContact O-CG1 3.28Å; A15-I19 WeakPolarHBondContact O-CG1 3.41Å; A15-I19 PolarHBondContact O-N 2.99Å |
| 16 | F | 76.5 | Confident | 68.2 | Low | 131 Ų | 131 | 112.6 Ų | 112.6 | 58% | 0.575 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -63.1 | -39.1 | 175.8 | -124.5 | -95.9 | 0 | 0 | 0 | 112.3 | H12 L13 H14 I19 L20 | H12-F16 WeakPolarHBondContact O-CB 3.4Å; H12-F16 PolarHBondContact O-N 3.06Å; L13-F16 PolarHBondContact O-N 3.34Å; H14-F16 PolarHBondContact O-N 3.18Å; F16-I19 PolarHBondContact O-N 2.95Å; F16-L20 VanDerWaalsContact O-CB 3.22Å; F16-L20 WeakPolarHBondContact O-CB 3.16Å; F16-L20 PolarHBondContact O-N 2.94Å |
| 17 | K | 77.3 | Confident | 69.2 | Low | 145 Ų | 145 | 111.2 Ų | 111.2 | 63% | 0.63 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -66.8 | -39.1 | 177.8 | -159.4 | 169.5 | -177.3 | 176.5 | 0 | 111.8 | L13 H14 A15 M21 | L13-K17 WeakPolarHBondContact O-CB 3.28Å; L13-K17 PolarHBondContact O-N 3.49Å; H14-K17 PolarHBondContact O-N 2.94Å; A15-K17 VanDerWaalsContact C-N 3.33Å; A15-K17 PolarHBondContact O-N 3.28Å; K17-M21 WeakPolarHBondContact O-CB 3.43Å; K17-M21 WeakPolarHBondContact O-CG 3.35Å; K17-M21 PolarHBondContact O-N 3.4Å |
| 18 | I | 78.9 | Confident | 70 | Confident | 103 Ų | 103 | 114.5 Ų | 114.5 | 53% | 0.528 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -67.2 | -45.1 | 175.5 | -67.1 | 167.5 | 0 | 0 | 0 | 111.1 | H14 A15 L20 M21 L22 | H14-I18 WeakPolarHBondContact O-CG1 3.43Å; H14-I18 PolarHBondContact O-N 3.39Å; A15-I18 PolarHBondContact O-N 3.03Å; I18-L20 VanDerWaalsContact C-N 3.35Å; I18-L20 PolarHBondContact O-N 3.44Å; I18-M21 PolarHBondContact O-N 2.95Å; I18-L22 HydrophobicContact CG2-CD1 4.06Å; I18-L22 WeakPolarHBondContact O-CG 3.38Å; I18-L22 PolarHBondContact O-N 3.31Å |
| 19 | I | 80.6 | Confident | 70.5 | Confident | 109 Ų | 109 | 113.1 Ų | 113.1 | 56% | 0.559 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -63.1 | -42.1 | 177.8 | -68.1 | 166 | 0 | 0 | 0 | 110.7 | A15 F16 L22 Y23 | A15-I19 VanDerWaalsContact O-CG1 3.28Å; A15-I19 WeakPolarHBondContact O-CG1 3.41Å; A15-I19 PolarHBondContact O-N 2.99Å; F16-I19 PolarHBondContact O-N 2.95Å; I19-L22 PolarHBondContact O-N 2.97Å; I19-Y23 WeakPolarHBondContact O-CB 3.38Å; I19-Y23 PolarHBondContact O-N 3.48Å |
| 20 | L | 79.1 | Confident | 70.8 | Confident | 93 Ų | 93 | 110.2 Ų | 110.2 | 49% | 0.487 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -66.5 | -38.8 | 177.3 | -169.3 | 67.3 | 0 | 0 | 0 | 112.2 | F16 I18 Y23 I24 | F16-L20 VanDerWaalsContact O-CB 3.22Å; F16-L20 WeakPolarHBondContact O-CB 3.16Å; F16-L20 PolarHBondContact O-N 2.94Å; I18-L20 VanDerWaalsContact C-N 3.35Å; I18-L20 PolarHBondContact O-N 3.44Å; L20-Y23 PolarHBondContact O-N 3.03Å; L20-I24 HydrophobicContact CD1-CD1 4.49Å; L20-I24 HydrophobicContact CG-CD1 4.03Å; L20-I24 WeakPolarHBondContact O-CB 3.22Å; L20-I24 VanDerWaalsContact O-CG1 3.28Å; L20-I24 WeakPolarHBondContact O-CG1 3.46Å; L20-I24 PolarHBondContact O-N 3.43Å |
| 21 | M | 77.6 | Confident | 71 | Confident | 102 Ų | 102 | 113.6 Ų | 113.6 | 50% | 0.502 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -66.6 | -39.3 | 175.1 | -73.7 | -69.5 | 100.1 | 0 | 0 | 112.6 | K17 I18 I24 T25 | K17-M21 WeakPolarHBondContact O-CB 3.43Å; K17-M21 WeakPolarHBondContact O-CG 3.35Å; K17-M21 PolarHBondContact O-N 3.4Å; I18-M21 PolarHBondContact O-N 2.95Å; M21-I24 HydrophobicContact CE-CD1 3.8Å; M21-T25 WeakPolarHBondContact O-CB 3.46Å; M21-T25 PolarHBondContact O-N 3.48Å; M21-T25 PolarHBondContact O-OG1 3.43Å |
| 22 | L | 78.7 | Confident | 70.8 | Confident | 119 Ų | 119 | 107.6 Ų | 107.6 | 62% | 0.623 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -65 | -42.3 | 173.3 | -74.6 | 167.7 | 0 | 0 | 0 | 111.3 | I18 I19 T25 L26 | I18-L22 HydrophobicContact CG2-CD1 4.06Å; I18-L22 WeakPolarHBondContact O-CG 3.38Å; I18-L22 PolarHBondContact O-N 3.31Å; I19-L22 PolarHBondContact O-N 2.97Å; L22-T25 PolarHBondContact O-N 2.9Å; L22-L26 WeakPolarHBondContact O-CB 3.39Å; L22-L26 PolarHBondContact O-N 3.48Å |
| 23 | Y | 78.6 | Confident | 70.6 | Confident | 142 Ų | 142 | 107.2 Ų | 107.2 | 56% | 0.557 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -65.4 | -43.1 | 178.2 | -171 | -106.8 | 0 | 0 | 0 | 112.8 | I19 L20 L26 L27 | I19-Y23 WeakPolarHBondContact O-CB 3.38Å; I19-Y23 PolarHBondContact O-N 3.48Å; L20-Y23 PolarHBondContact O-N 3.03Å; Y23-L26 PolarHBondContact O-N 2.99Å; Y23-L27 HydrophobicContact CD1-CD1 3.75Å; Y23-L27 HydrophobicContact CE1-CD1 3.36Å; Y23-L27 HydrophobicContact CE1-CG 4.26Å; Y23-L27 WeakPolarHBondContact O-CG 3.28Å; Y23-L27 PolarHBondContact O-N 3.4Å |
| 24 | I | 76.3 | Confident | 70.3 | Confident | 81 Ų | 81 | 106.9 Ų | 106.9 | 42% | 0.415 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -64.9 | -42.4 | 176.8 | -70.3 | 167.3 | 0 | 0 | 0 | 111 | L20 M21 L27 F28 | L20-I24 HydrophobicContact CD1-CD1 4.49Å; L20-I24 HydrophobicContact CG-CD1 4.03Å; L20-I24 WeakPolarHBondContact O-CB 3.22Å; L20-I24 VanDerWaalsContact O-CG1 3.28Å; L20-I24 WeakPolarHBondContact O-CG1 3.46Å; L20-I24 PolarHBondContact O-N 3.43Å; M21-I24 HydrophobicContact CE-CD1 3.8Å; I24-L27 PolarHBondContact O-N 2.73Å; I24-F28 PolarHBondContact O-N 3.34Å |
| 25 | T | 71.5 | Confident | 69.3 | Low | 80 Ų | 80 | 108.4 Ų | 108.4 | 49% | 0.491 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -67 | -38.1 | 178.4 | -50.9 | 0 | 0 | 0 | 0 | 111.6 | M21 L22 F28 N29 | M21-T25 WeakPolarHBondContact O-CB 3.46Å; M21-T25 PolarHBondContact O-N 3.48Å; M21-T25 PolarHBondContact O-OG1 3.43Å; L22-T25 PolarHBondContact O-N 2.9Å; T25-F28 PolarHBondContact O-N 2.83Å; T25-N29 PolarHBondContact O-N 3.11Å; T25-N29 VanDerWaalsContact O-N 3.11Å; T25-N29 PolarHBondContact O-ND2 3.05Å |
| 26 | L | 71.8 | Confident | 68.1 | Low | 115 Ų | 115 | 114.2 Ų | 114.2 | 60% | 0.602 | 55% | 0.554 | S | S | * | * | H | α-helix | trans | -64.6 | -43.6 | 175 | -162.3 | 84.3 | 0 | 0 | 0 | 111.6 | L22 Y23 F28 N29 L30 | L22-L26 WeakPolarHBondContact O-CB 3.39Å; L22-L26 PolarHBondContact O-N 3.48Å; Y23-L26 PolarHBondContact O-N 2.99Å; L26-F28 PolarHBondContact O-N 3Å; L26-N29 PolarHBondContact O-N 3.39Å; L26-L30 PolarHBondContact O-N 3Å |
| 27 | L | 72.2 | Confident | 66.5 | Low | 84 Ų | 84 | 118.1 Ų | 118.1 | 44% | 0.44 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -64.5 | -36.9 | 176.4 | -79.4 | 172.8 | 0 | 0 | 0 | 112.8 | Y23 I24 L30 K31 | Y23-L27 HydrophobicContact CD1-CD1 3.75Å; Y23-L27 HydrophobicContact CE1-CD1 3.36Å; Y23-L27 HydrophobicContact CE1-CG 4.26Å; Y23-L27 WeakPolarHBondContact O-CG 3.28Å; Y23-L27 PolarHBondContact O-N 3.4Å; I24-L27 PolarHBondContact O-N 2.73Å; L27-L30 PolarHBondContact O-N 2.94Å; L27-K31 PolarHBondContact O-N 3.22Å |
| 28 | F | 67.8 | Low | 65 | Low | 150 Ų | 150 | 117.5 Ų | 117.5 | 66% | 0.658 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -67.7 | -39.7 | 176.9 | -139.1 | -94.2 | 0 | 0 | 0 | 111.7 | I24 T25 L26 K31 T32 | I24-F28 PolarHBondContact O-N 3.34Å; T25-F28 PolarHBondContact O-N 2.83Å; L26-F28 PolarHBondContact O-N 3Å; F28-K31 PolarHBondContact O-N 3.32Å; F28-T32 WeakPolarHBondContact O-CG2 3.49Å; F28-T32 PolarHBondContact O-N 3.47Å; F28-T32 VanDerWaalsContact O-N 3.11Å; F28-T32 PolarHBondContact O-OG1 2.87Å |
| 29 | N | 62.2 | Low | 63.5 | Low | 91 Ų | 91 | 116.8 Ų | 116.8 | 49% | 0.487 | 57% | 0.568 | S | S | . | * | H | α-helix | trans | -67.8 | -34.5 | 174.6 | -77.6 | -62.2 | 0 | 0 | 0 | 113 | T25 L26 T32 I33 | T25-N29 PolarHBondContact O-N 3.11Å; T25-N29 VanDerWaalsContact O-N 3.11Å; T25-N29 PolarHBondContact O-ND2 3.05Å; L26-N29 PolarHBondContact O-N 3.39Å; N29-T32 WeakPolarHBondContact CA-OG1 3.31Å; N29-T32 PolarHBondContact O-OG1 3.28Å; N29-I33 WeakPolarHBondContact O-CD1 3.43Å; N29-I33 VanDerWaalsContact O-CG1 3.31Å; N29-I33 WeakPolarHBondContact O-CG1 3.18Å; N29-I33 PolarHBondContact O-N 3.11Å |
| 30 | L | 58.4 | Low | 61.6 | Low | 98 Ų | 98 | 116.3 Ų | 116.3 | 51% | 0.513 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -70 | -40.3 | 175 | -131.1 | 78.9 | 0 | 0 | 0 | 112 | L26 L27 T32 I33 I34 | L26-L30 PolarHBondContact O-N 3Å; L27-L30 PolarHBondContact O-N 2.94Å; L30-T32 VanDerWaalsContact C-N 3.34Å; L30-T32 PolarHBondContact O-N 3.09Å; L30-I33 PolarHBondContact O-N 3.46Å; L30-I34 WeakPolarHBondContact O-CG1 3.47Å; L30-I34 PolarHBondContact O-N 3.05Å; L30-I34 VanDerWaalsContact O-N 3.09Å |
| 31 | K | 59.3 | Low | 59.8 | Low | 162 Ų | 162 | 119.1 Ų | 119.1 | 70% | 0.704 | 58% | 0.582 | S | S | * | * | H | α-helix | trans | -63.3 | -36.7 | 174.9 | -100.7 | 178.1 | 175.4 | 178 | 0 | 112.4 | L27 F28 K35 | L27-K31 PolarHBondContact O-N 3.22Å; F28-K31 PolarHBondContact O-N 3.32Å; K31-K35 WeakPolarHBondContact O-CB 3.36Å; K31-K35 PolarHBondContact O-N 3.2Å |
| 32 | T | 53.7 | Low | 57.7 | Low | 59 Ų | 59 | 119 Ų | 119 | 36% | 0.362 | 59% | 0.592 | S | S | . | * | H | α-helix | trans | -70.4 | -34.3 | 176.8 | 51.2 | 0 | 0 | 0 | 0 | 112.4 | F28 N29 L30 K36 | F28-T32 WeakPolarHBondContact O-CG2 3.49Å; F28-T32 PolarHBondContact O-N 3.47Å; F28-T32 VanDerWaalsContact O-N 3.11Å; F28-T32 PolarHBondContact O-OG1 2.87Å; N29-T32 WeakPolarHBondContact CA-OG1 3.31Å; N29-T32 PolarHBondContact O-OG1 3.28Å; L30-T32 VanDerWaalsContact C-N 3.34Å; L30-T32 PolarHBondContact O-N 3.09Å; T32-K36 WeakPolarHBondContact O-CB 3.48Å; T32-K36 VanDerWaalsContact O-CG 3.31Å; T32-K36 WeakPolarHBondContact O-CG 3.31Å; T32-K36 PolarHBondContact O-N 3.16Å; T32-K36 VanDerWaalsContact O-N 3.16Å |
| 33 | I | 56.4 | Low | 55.8 | Low | 116 Ų | 116 | 122.2 Ų | 122.2 | 60% | 0.595 | 60% | 0.604 | S | S | * | * | H | α-helix | trans | -67.6 | -44.9 | 175.3 | -68.5 | 165.6 | 0 | 0 | 0 | 111.4 | N29 L30 | N29-I33 WeakPolarHBondContact O-CD1 3.43Å; N29-I33 VanDerWaalsContact O-CG1 3.31Å; N29-I33 WeakPolarHBondContact O-CG1 3.18Å; N29-I33 PolarHBondContact O-N 3.11Å; L30-I33 PolarHBondContact O-N 3.46Å |
| 34 | I | 56.3 | Low | 53.5 | Low | 101 Ų | 101 | 119.3 Ų | 119.3 | 52% | 0.518 | 60% | 0.603 | S | S | . | * | H | α-helix | trans | -72.9 | -36.1 | -178.5 | -58 | 165 | 0 | 0 | 0 | 111.1 | L30 R37 L38 | L30-I34 WeakPolarHBondContact O-CG1 3.47Å; L30-I34 PolarHBondContact O-N 3.05Å; L30-I34 VanDerWaalsContact O-N 3.09Å; I34-R37 PolarHBondContact O-N 3.3Å; I34-L38 HydrophobicContact CG2-CD1 4.28Å |
| 35 | K | 49 | Very low | 51.6 | Low | 150 Ų | 150 | 118.9 Ų | 118.9 | 65% | 0.652 | 62% | 0.619 | S | S | * | * | H | α-helix | trans | -71.2 | -32.8 | 179.3 | -154.6 | 165.7 | -172.5 | 177.3 | 0 | 112.8 | K31 R37 L38 T39 | K31-K35 WeakPolarHBondContact O-CB 3.36Å; K31-K35 PolarHBondContact O-N 3.2Å; K35-R37 PolarHBondContact O-N 3.23Å; K35-L38 PolarHBondContact O-N 3Å; K35-T39 HydrophobicContact CG-CG2 4.18Å; K35-T39 PolarHBondContact O-N 3.2Å; K35-T39 PolarHBondContact O-OG1 3.17Å |
| 36 | K | 48 | Very low | 49.9 | Very low | 168 Ų | 168 | 119 Ų | 119 | 73% | 0.73 | 61% | 0.611 | S | S | * | * | H | α-helix | trans | -61.4 | -21.9 | 170.7 | -79.4 | 178.7 | -179.5 | -179 | 0 | 113.3 | T32 | T32-K36 WeakPolarHBondContact O-CB 3.48Å; T32-K36 VanDerWaalsContact O-CG 3.31Å; T32-K36 WeakPolarHBondContact O-CG 3.31Å; T32-K36 PolarHBondContact O-N 3.16Å; T32-K36 VanDerWaalsContact O-N 3.16Å |
| 37 | R | 43.9 | Very low | 48.2 | Very low | 213 Ų | 213 | 122.5 Ų | 122.5 | 80% | 0.804 | 63% | 0.627 | S | S | * | * | H | α-helix | trans | -87.9 | -17.7 | 178.3 | -144.3 | 175.5 | -151.7 | -169.6 | 6.1 | 114 | I34 K35 | I34-R37 PolarHBondContact O-N 3.3Å; K35-R37 PolarHBondContact O-N 3.23Å |
| 38 | L | 45.9 | Very low | 46.5 | Very low | 131 Ų | 131 | 128.1 Ų | 128.1 | 69% | 0.686 | 64% | 0.642 | S | S | * | * | H | α-helix | trans | -107.4 | -14.5 | -178.6 | -84.3 | 102.2 | 0 | 0 | 0 | 115.3 | I34 K35 | I34-L38 HydrophobicContact CG2-CD1 4.28Å; K35-L38 PolarHBondContact O-N 3Å |
| 39 | T | 46.7 | Very low | 45.2 | Very low | 89 Ų | 89 | 125.5 Ų | 125.5 | 55% | 0.546 | 64% | 0.642 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -98.3 | 8.8 | -179.1 | 63.4 | 0 | 0 | 0 | 0 | 115.3 | K35 K41 | K35-T39 HydrophobicContact CG-CG2 4.18Å; K35-T39 PolarHBondContact O-N 3.2Å; K35-T39 PolarHBondContact O-OG1 3.17Å; T39-K41 VanDerWaalsContact C-N 3.34Å |
| 40 | S | 39.8 | Very low | 43.9 | Very low | 98 Ų | 98 | 126.4 Ų | 126.4 | 69% | 0.685 | 66% | 0.656 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -90.8 | 3.3 | 167.6 | 63.6 | 0 | 0 | 0 | 0 | 113.6 | ||
| 41 | K | 40.9 | Very low | 43 | Very low | 152 Ų | 152 | 130.4 Ų | 130.4 | 66% | 0.661 | 67% | 0.671 | S | S | * | * | trans | -111.7 | 36.4 | 174.5 | -68.9 | -176.6 | -178.3 | 173.4 | 0 | 112.4 | T39 Q43 | T39-K41 VanDerWaalsContact C-N 3.34Å; K41-Q43 PolarHBondContact O-N 2.82Å | ||
| 42 | S | 35.5 | Very low | 41.6 | Very low | 100 Ų | 100 | 130.4 Ų | 130.4 | 70% | 0.699 | 67% | 0.674 | S | S | * | * | trans | -88.4 | 83.7 | 162.3 | 49.4 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 43 | Q | 36.9 | Very low | 41.1 | Very low | 186 Ų | 186 | 134.4 Ų | 134.4 | 87% | 0.869 | 70% | 0.698 | S | S | * | * | trans | 36.9 | 90.2 | 138.9 | -64.4 | 178 | -11.2 | 0 | 0 | 117 | K41 | K41-Q43 PolarHBondContact O-N 2.82Š| ||
| 44 | C | 32.1 | Very low | 40.1 | Very low | 81 Ų | 81 | 133.2 Ų | 133.2 | 55% | 0.547 | 70% | 0.696 | S | S | . | * | -112.7 | 116.1 | 119.6 | -171.4 | 0 | 0 | 0 | 0 | 104.6 | Y46 | C44-Y46 PolarHBondContact O-N 3.08Š| |||
| 45 | G | 36.2 | Very low | 39.5 | Very low | 73 Ų | 73 | 133.6 Ų | 133.6 | 75% | 0.753 | 71% | 0.708 | S | S | * | * | trans | -57.9 | 108.8 | -166.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 46 | Y | 35.4 | Very low | 39.1 | Very low | 82 Ų | 82 | 135.1 Ų | 135.1 | 32% | 0.322 | 72% | 0.715 | S | S | . | * | trans | -99.3 | 114.5 | 152.2 | -106.7 | -95.4 | 0 | 0 | 0 | 106.6 | C44 R48 V108 V112 D116 V117 L118 | C44-Y46 PolarHBondContact O-N 3.08Å; Y46-R48 PolarHBondContact O-N 2.89Å; Y46-V108 HydrophobicContact CE2-CG1 3.92Å; Y46-V112 HydrophobicContact CE2-CG2 4.26Å; Y46-D116 HydrophobicContact CE1-CB 4.15Å; Y46-V117 WeakPolarHBondContact CE1-O 3.21Å; Y46-L118 HydrophobicContact CE1-CD2 3.86Å; Y46-L118 HydrophobicContact CE1-CG 4.42Å; Y46-L118 HydrophobicContact CE2-CD2 4.18Å; Y46-L118 WeakPolarHBondContact OH-CD2 2.96Å; Y46-L118 VanDerWaalsContact OH-CG 3.32Å; Y46-L118 WeakPolarHBondContact OH-CG 3.42Å | ||
| 47 | M | 35.3 | Very low | 38.9 | Very low | 188 Ų | 188 | 134 Ų | 134 | 93% | 0.926 | 72% | 0.716 | S | S | * | * | trans | -56.1 | 110.4 | 175.4 | -70.1 | 176.1 | 73 | 0 | 0 | 108.6 | S49 | M47-S49 PolarHBondContact O-N 3.39Š| ||
| 48 | R | 36.7 | Very low | 39 | Very low | 203 Ų | 203 | 129.9 Ų | 129.9 | 77% | 0.766 | 71% | 0.714 | S | S | * | * | trans | -83.8 | 108.6 | 173.2 | -162.7 | 177.3 | -71 | -142.1 | -9 | 106.8 | Y46 S50 | Y46-R48 PolarHBondContact O-N 2.89Å; R48-S50 PolarHBondContact O-N 2.99Å; R48-S50 VanDerWaalsContact O-N 3.08Å | ||
| 49 | S | 39.8 | Very low | 38.9 | Very low | 95 Ų | 95 | 131.3 Ų | 131.3 | 66% | 0.664 | 71% | 0.714 | S | S | * | * | trans | -53.5 | 106.9 | 172 | 166.6 | 0 | 0 | 0 | 0 | 110.4 | M47 | M47-S49 PolarHBondContact O-N 3.39Š| ||
| 50 | S | 36.7 | Very low | 39.1 | Very low | 110 Ų | 110 | 132.3 Ų | 132.3 | 77% | 0.769 | 72% | 0.722 | S | S | * | * | trans | -102.3 | 123.1 | 150.9 | -76 | 0 | 0 | 0 | 0 | 106.3 | R48 H52 | R48-S50 PolarHBondContact O-N 2.99Å; R48-S50 VanDerWaalsContact O-N 3.08Å; S50-H52 VanDerWaalsContact C-N 3.3Å; S50-H52 PolarHBondContact O-N 2.81Å | ||
| 51 | H | 39.7 | Very low | 39.8 | Very low | 181 Ų | 181 | 134.7 Ų | 134.7 | 84% | 0.838 | 73% | 0.727 | S | S | * | * | trans | -56.6 | 93 | 171.9 | -64.6 | -90.3 | 0 | 0 | 0 | 109.6 | ||||
| 52 | H | 29.2 | Very low | 40.9 | Very low | 163 Ų | 163 | 134.7 Ų | 134.7 | 76% | 0.755 | 74% | 0.735 | S | S | * | * | trans | -146.4 | 115.9 | 152.8 | -136.1 | -86.6 | 0 | 0 | 0 | 107.4 | S50 T54 | S50-H52 VanDerWaalsContact C-N 3.3Å; S50-H52 PolarHBondContact O-N 2.81Å; H52-T54 PolarHBondContact O-N 3.44Å | ||
| 53 | V | 43.8 | Very low | 41.9 | Very low | 143 Ų | 143 | 138.4 Ų | 138.4 | 87% | 0.867 | 74% | 0.743 | S | S | * | * | trans | -59.5 | 99.8 | 171.4 | 177.8 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 54 | T | 35.7 | Very low | 42.8 | Very low | 91 Ų | 91 | 136.2 Ų | 136.2 | 56% | 0.558 | 74% | 0.738 | S | S | * | * | trans | -141.9 | 111.3 | 151.5 | 48.5 | 0 | 0 | 0 | 0 | 107.2 | H52 F56 | H52-T54 PolarHBondContact O-N 3.44Å; T54-F56 PolarHBondContact O-N 2.82Å | ||
| 55 | S | 42.1 | Very low | 44.1 | Very low | 109 Ų | 109 | 137.1 Ų | 137.1 | 76% | 0.762 | 75% | 0.751 | S | S | * | * | trans | -39.9 | 81.4 | 155.7 | 51.2 | 0 | 0 | 0 | 0 | 112.1 | L57 | S55-L57 PolarHBondContact O-N 3.41Š| ||
| 56 | F | 41.9 | Very low | 45.3 | Very low | 182 Ų | 182 | 138.6 Ų | 138.6 | 80% | 0.798 | 75% | 0.749 | S | S | * | * | trans | -85.4 | 75.8 | 153.9 | -91.7 | -91.1 | 0 | 0 | 0 | 106.6 | T54 V58 | T54-F56 PolarHBondContact O-N 2.82Å; F56-V58 PolarHBondContact O-N 3.39Å | ||
| 57 | L | 43.5 | Very low | 46.6 | Very low | 145 Ų | 145 | 145.4 Ų | 145.4 | 76% | 0.759 | 77% | 0.774 | S | S | * | * | trans | -53.5 | 99.5 | 144.8 | -95.7 | 151.8 | 0 | 0 | 0 | 105 | S55 K59 | S55-L57 PolarHBondContact O-N 3.41Å; L57-K59 PolarHBondContact O-N 2.71Å | ||
| 58 | V | 46 | Very low | 47.9 | Very low | 125 Ų | 125 | 142 Ų | 142 | 76% | 0.758 | 76% | 0.764 | S | S | * | * | trans | -55.9 | 98.9 | 154.2 | 175.6 | 0 | 0 | 0 | 0 | 103.7 | F56 P60 | F56-V58 PolarHBondContact O-N 3.39Å; V58-P60 WeakPolarHBondContact O-CD 3.47Å | ||
| 59 | K | 42.7 | Very low | 49.3 | Very low | 161 Ų | 161 | 136.8 Ų | 136.8 | 70% | 0.7 | 75% | 0.749 | S | S | * | * | trans | -59 | 121.8 | 168.9 | -76.1 | 178.3 | 177.2 | 170.4 | 0 | 105.1 | L57 D61 | L57-K59 PolarHBondContact O-N 2.71Å; K59-D61 PolarHBondContact O-N 2.97Å | ||
| 60 | P | 50.8 | Low | 51.1 | Low | 110 Ų | 110 | 136.8 Ų | 136.8 | 71% | 0.714 | 75% | 0.746 | S | S | * | * | trans | -70.6 | 94 | 170.7 | 29.1 | -29.3 | 0 | 0 | 0 | 105.4 | V58 N62 | V58-P60 WeakPolarHBondContact O-CD 3.47Å; P60-N62 PolarHBondContact O-N 3.41Å | ||
| 61 | D | 54.8 | Low | 53.3 | Low | 148 Ų | 148 | 136.4 Ų | 136.4 | 79% | 0.791 | 73% | 0.734 | S | S | * | * | trans | -68 | 92.4 | 163.7 | -68.1 | -27.9 | 0 | 0 | 0 | 105.6 | K59 | K59-D61 PolarHBondContact O-N 2.97Š| ||
| 62 | N | 64.4 | Low | 55.4 | Low | 152 Ų | 152 | 130.2 Ų | 130.2 | 81% | 0.813 | 71% | 0.705 | S | S | * | * | S | Bend | trans | 78.8 | 78.5 | 157.1 | -149.7 | 23.8 | 0 | 0 | 0 | 116.9 | P60 | P60-N62 PolarHBondContact O-N 3.41Š|
| 63 | M | 56.3 | Low | 58.1 | Low | 179 Ų | 179 | 126.2 Ų | 126.2 | 88% | 0.882 | 69% | 0.689 | S | S | * | * | trans | -150.8 | 138.1 | 154.6 | -66.3 | -162 | -176 | 0 | 0 | 112.1 | A65 | M63-A65 PolarHBondContact O-N 3.02Š| ||
| 64 | D | 56.8 | Low | 60.4 | Low | 140 Ų | 140 | 119.4 Ų | 119.4 | 75% | 0.749 | 65% | 0.648 | S | S | * | * | trans | -41.3 | 118.8 | -177.3 | -66.3 | -50 | 0 | 0 | 0 | 114.9 | S66 | D64-S66 PolarHBondContact O-N 3.03Š| ||
| 65 | A | 58.9 | Low | 63 | Low | 99 Ų | 99 | 121.6 Ų | 121.6 | 82% | 0.818 | 65% | 0.646 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -69.3 | 0.7 | -175.6 | 0 | 0 | 0 | 0 | 0 | 115.5 | M63 | M63-A65 PolarHBondContact O-N 3.02Š|
| 66 | S | 61.7 | Low | 65.4 | Low | 104 Ų | 104 | 116.5 Ų | 116.5 | 73% | 0.727 | 61% | 0.61 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -90.3 | -2.6 | -172.7 | 60.5 | 0 | 0 | 0 | 0 | 115.1 | D64 | D64-S66 PolarHBondContact O-N 3.03Š|
| 67 | R | 61.7 | Low | 67.8 | Low | 225 Ų | 225 | 110.2 Ų | 110.2 | 85% | 0.849 | 59% | 0.587 | S | S | * | * | S | Bend | trans | -130.6 | 12.3 | -177.3 | -63.2 | -174.2 | -174.3 | 147.7 | 1.9 | 116.4 | Q69 | R67-Q69 PolarHBondContact O-N 3.29Š|
| 68 | V | 62.2 | Low | 70.1 | Confident | 116 Ų | 116 | 107.9 Ų | 107.9 | 70% | 0.703 | 57% | 0.57 | S | S | * | * | trans | -81.5 | 104.7 | -177.9 | -174.3 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 69 | Q | 67.6 | Low | 72.2 | Confident | 95 Ų | 95 | 104.7 Ų | 104.7 | 44% | 0.444 | 55% | 0.551 | S | S | . | * | P | Polyproline II helix | trans | -65.5 | 144.9 | 169.4 | -68.8 | -160.9 | 11.1 | 0 | 0 | 110.2 | R67 I71 | R67-Q69 PolarHBondContact O-N 3.29Å; Q69-I71 PolarHBondContact O-N 3.44Å |
| 70 | P | 77 | Confident | 74.4 | Confident | 94 Ų | 94 | 100.7 Ų | 100.7 | 61% | 0.61 | 54% | 0.537 | S | S | * | . | P | Polyproline II helix | trans | -62.1 | 126 | 178.1 | 25.1 | -33.1 | 0 | 0 | 0 | 110.1 | K72 | P70-K72 PolarHBondContact O-N 2.71Š|
| 71 | I | 82.2 | Confident | 76.2 | Confident | 102 Ų | 102 | 96.9 Ų | 96.9 | 52% | 0.523 | 52% | 0.517 | S | S | . | . | P | Polyproline II helix | trans | -71.1 | 124.2 | 175.7 | -59.5 | 178.5 | 0 | 0 | 0 | 108.2 | Q69 T119 L121 | Q69-I71 PolarHBondContact O-N 3.44Å; I71-T119 HydrophobicContact CG2-CG2 3.14Å; I71-L121 HydrophobicContact CD1-CD2 3.9Å; I71-L121 HydrophobicContact CG1-CD2 3.84Å; I71-L121 HydrophobicContact CG2-CD2 4.33Å |
| 72 | K | 84.6 | Confident | 77.7 | Confident | 51 Ų | 51 | 97.9 Ų | 97.9 | 22% | 0.222 | 51% | 0.51 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -110.7 | 142.7 | 178.3 | -64.1 | -166.3 | -179.1 | -177.8 | 0 | 111.5 | P70 F96 L120 | P70-K72 PolarHBondContact O-N 2.71Å; K72-F96 HydrophobicContact CB-CD1 4.12Å; K72-F96 HydrophobicContact CB-CE1 4.14Å; K72-F96 HydrophobicContact CD-CD1 4.14Å; K72-F96 HydrophobicContact CD-CE1 4.04Å; K72-L120 PolarHBondContact N-O 3.03Å; K72-L120 PolarHBondContact O-N 3.25Å |
| 73 | L | 86.6 | Confident | 78.4 | Confident | 80 Ų | 80 | 91.8 Ų | 91.8 | 42% | 0.419 | 48% | 0.478 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -94.3 | 139.6 | 173.7 | -60.7 | 177.4 | 0 | 0 | 0 | 110.1 | M97 L118 T119 | L73-M97 HydrophobicContact CB-CG 4.33Å; L73-M97 HydrophobicContact CB-SD 3.77Å; L73-M97 PolarHBondContact O-N 2.79Å; L73-L118 WeakPolarHBondContact CA-O 3.21Å; L73-T119 HydrophobicContact CD2-CG2 4.17Å |
| 74 | A | 90.5 | Very high | 79.5 | Confident | 0 Ų | 0 | 85.1 Ų | 85.1 | 0% | 0 | 46% | 0.455 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -138.1 | 145.7 | -178.8 | 0 | 0 | 0 | 0 | 0 | 110.8 | V94 E95 F96 V117 L118 L120 | A74-V94 HydrophobicContact CB-CB 4.05Å; A74-V94 HydrophobicContact CB-CG2 4.06Å; A74-E95 CarbonylContact C-O 3.42Å; A74-E95 WeakPolarHBondContact CA-O 3.46Å; A74-E95 WeakPolarHBondContact CB-O 3.45Å; A74-F96 HydrophobicContact CB-CD1 4.45Å; A74-V117 CarbonylContact O-C 3.56Å; A74-V117 WeakPolarHBondContact O-CA 3.06Å; A74-L118 PolarHBondContact N-O 3.01Å; A74-L118 PolarHBondContact O-N 3.44Å; A74-L120 HydrophobicContact CB-CD1 3.66Å; A74-L120 HydrophobicContact CB-CG 4.14Å |
| 75 | R | 90.9 | Very high | 80.5 | Confident | 137 Ų | 137 | 84.8 Ų | 84.8 | 52% | 0.517 | 46% | 0.464 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -102.5 | 139.2 | 177 | -173.8 | 175.7 | 63.8 | 171.1 | -0.6 | 110.3 | T77 V94 E95 | R75-T77 PolarHBondContact O-N 2.88Å; R75-V94 CarbonylContact O-C 3.54Å; R75-V94 VanDerWaalsContact O-CA 3.22Å; R75-V94 WeakPolarHBondContact O-CA 3.45Å; R75-V94 WeakPolarHBondContact O-CB 3.49Å; R75-E95 PolarHBondContact N-O 2.88Å; R75-E95 PolarHBondContact O-N 3.2Å |
| 76 | V | 91.6 | Very high | 81.5 | Confident | 2 Ų | 2 | 87.6 Ų | 87.6 | 1% | 0.012 | 46% | 0.46 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -74.6 | 117.6 | 174.6 | 178 | 0 | 0 | 0 | 0 | 109.9 | V92 V94 V112 G115 D116 L118 | V76-V92 HydrophobicContact CG1-CB 4.38Å; V76-V92 HydrophobicContact CG1-CG1 3.44Å; V76-V92 VanDerWaalsContact CG1-CG1 3.44Å; V76-V92 HydrophobicContact CG2-CG1 4.45Å; V76-V94 HydrophobicContact CB-CG1 4.43Å; V76-V94 HydrophobicContact CG2-CG1 3.82Å; V76-V112 HydrophobicContact CG1-CG1 4.36Å; V76-V112 HydrophobicContact CG2-CG1 4Å; V76-G115 PolarHBondContact O-N 3.21Å; V76-D116 HydrophobicContact CB-CB 4.47Å; V76-D116 HydrophobicContact CG2-CB 4.12Å; V76-D116 WeakPolarHBondContact CG2-O 3.49Å; V76-D116 PolarHBondContact N-O 2.78Å; V76-L118 HydrophobicContact CG2-CD1 3.97Å; V76-L118 HydrophobicContact CG2-CG 4.34Å |
| 77 | T | 92.4 | Very high | 82.4 | Confident | 50 Ų | 50 | 83.5 Ų | 83.5 | 31% | 0.307 | 44% | 0.435 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -86 | -51.2 | 175.4 | -46.4 | 0 | 0 | 0 | 0 | 111 | R75 R93 E95 | R75-T77 PolarHBondContact O-N 2.88Å; T77-R93 PolarHBondContact N-O 2.89Å; T77-E95 WeakPolarHBondContact CB-OE1 3.42Å; T77-E95 WeakPolarHBondContact CG2-OE1 3.38Å; T77-E95 WeakPolarHBondContact OG1-CG 3.48Å; T77-E95 PolarHBondContact OG1-OE1 2.86Å; T77-E95 PolarHBondContact OG1-OE2 2.99Å |
| 78 | K | 91.9 | Very high | 83.4 | Confident | 96 Ų | 96 | 78 Ų | 78 | 42% | 0.417 | 42% | 0.419 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -149.2 | 144.1 | -175.9 | 63.5 | 178 | 179.6 | -175.5 | 0 | 113 | L80 R93 | K78-L80 HydrophobicContact CD-CD2 4.39Å; K78-L80 HydrophobicContact CG-CD2 4.46Å; K78-R93 HydrophobicContact CG-CB 3.77Å; K78-R93 HydrophobicContact CG-CG 4.5Å; K78-R93 PolarHBondContact N-O 2.88Å; K78-R93 PolarHBondContact O-N 3.02Å |
| 79 | V | 90.9 | Very high | 84.6 | Confident | 58 Ų | 58 | 74.7 Ų | 74.7 | 35% | 0.352 | 40% | 0.401 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -88.3 | 121.5 | 172.1 | -174.7 | 0 | 0 | 0 | 0 | 108.7 | T90 V92 | V79-T90 HydrophobicContact CG1-CG2 3.46Å; V79-T90 VanDerWaalsContact CG1-CG2 3.46Å; V79-V92 HydrophobicContact CB-CG1 4.24Å; V79-V92 HydrophobicContact CG1-CG1 4.45Å; V79-V92 HydrophobicContact CG2-CG1 3.81Å |
| 80 | L | 88.6 | Confident | 85.6 | Confident | 76 Ų | 76 | 70.8 Ų | 70.8 | 40% | 0.398 | 38% | 0.383 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -82.2 | -41.3 | -178.9 | -62.7 | 172.4 | 0 | 0 | 0 | 111.6 | K78 Q91 I105 | K78-L80 HydrophobicContact CD-CD2 4.39Å; K78-L80 HydrophobicContact CG-CD2 4.46Å; L80-Q91 HydrophobicContact CB-CB 4.13Å; L80-Q91 WeakPolarHBondContact CB-O 3.47Å; L80-Q91 HydrophobicContact CD1-CB 4.33Å; L80-Q91 PolarHBondContact N-O 2.87Å; L80-I105 HydrophobicContact CD1-CD1 3.95Å; L80-I105 HydrophobicContact CD1-CG1 4.11Å; L80-I105 HydrophobicContact CD1-CG2 3.85Å |
| 81 | G | 88.3 | Confident | 86.2 | Confident | 30 Ų | 30 | 67.6 Ų | 67.6 | 31% | 0.309 | 36% | 0.36 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | 158 | 178.1 | -178.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | T90 Q91 | G81-T90 CarbonylContact O-C 3.58Å; G81-T90 WeakPolarHBondContact O-CA 3.48Å; G81-T90 WeakPolarHBondContact O-CG2 3.49Å; G81-Q91 PolarHBondContact N-O 2.7Å; G81-Q91 PolarHBondContact O-N 3.23Å |
| 82 | R | 86.6 | Confident | 86.6 | Confident | 169 Ų | 169 | 62.7 Ų | 62.7 | 64% | 0.638 | 34% | 0.335 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -86.7 | 138 | 173.9 | -62.3 | -175 | 76.2 | 170 | 3.1 | 109.8 | G87 C89 | R82-G87 PolarHBondContact NE-O 2.87Å; R82-G87 PolarHBondContact NH2-O 3.46Å; R82-C89 CarbonylContact C-O 3.55Å; R82-C89 WeakPolarHBondContact CA-O 3.33Å |
| 83 | T | 79.7 | Confident | 87 | Confident | 24 Ų | 24 | 63.4 Ų | 63.4 | 15% | 0.147 | 34% | 0.336 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -132.7 | 149.9 | -177 | -48.9 | 0 | 0 | 0 | 0 | 110.9 | C89 Q91 L130 | T83-C89 PolarHBondContact N-O 2.86Å; T83-C89 WeakPolarHBondContact O-CB 3.18Å; T83-C89 VanDerWaalsContact O-O 3.12Å; T83-Q91 WeakPolarHBondContact OG1-CG 3.22Å; T83-Q91 PolarHBondContact OG1-NE2 2.76Å; T83-L130 HydrophobicContact CG2-CB 4.09Å; T83-L130 HydrophobicContact CG2-CD1 4.08Å; T83-L130 HydrophobicContact CG2-CG 4.42Å |
| 84 | G | 78.7 | Confident | 87.2 | Confident | 39 Ų | 39 | 59.6 Ų | 59.6 | 40% | 0.402 | 32% | 0.316 | S | S | . | . | S | Bend | trans | 102.4 | 151.3 | -177.3 | 0 | 0 | 0 | 0 | 0 | 112 | Q86 G87 | G84-Q86 PolarHBondContact O-N 2.76Å; G84-Q86 VanDerWaalsContact O-N 3.13Å; G84-G87 PolarHBondContact O-N 2.89Å |
| 85 | S | 78.9 | Confident | 87.3 | Confident | 134 Ų | 134 | 61.8 Ų | 61.8 | 94% | 0.937 | 33% | 0.327 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -57 | -29.2 | -176 | 53.5 | 0 | 0 | 0 | 0 | 114.1 | ||
| 86 | Q | 79.7 | Confident | 87.2 | Confident | 157 Ų | 157 | 55.8 Ų | 55.8 | 73% | 0.734 | 30% | 0.304 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -98.7 | 0.6 | 178.3 | -62.9 | -178.6 | -28.9 | 0 | 0 | 113.7 | G84 Q88 | G84-Q86 PolarHBondContact O-N 2.76Å; G84-Q86 VanDerWaalsContact O-N 3.13Å; Q86-Q88 HydrophobicContact CB-CG 4Å; Q86-Q88 PolarHBondContact O-N 2.79Å; Q86-Q88 PolarHBondContact O-NE2 2.85Å |
| 87 | G | 79 | Confident | 87 | Confident | 19 Ų | 19 | 61.1 Ų | 61.1 | 20% | 0.196 | 33% | 0.331 | C | S | . | . | trans | 62.8 | 5.9 | -178 | 0 | 0 | 0 | 0 | 0 | 115.7 | R82 G84 C89 | R82-G87 PolarHBondContact NE-O 2.87Å; R82-G87 PolarHBondContact NH2-O 3.46Å; G84-G87 PolarHBondContact O-N 2.89Å; G87-C89 PolarHBondContact O-N 2.81Å | ||
| 88 | Q | 83.3 | Confident | 86.6 | Confident | 108 Ų | 108 | 64 Ų | 64 | 51% | 0.505 | 34% | 0.344 | S | S | . | . | trans | -70.5 | -16.5 | -173.1 | -61.2 | -57.6 | -41.3 | 0 | 0 | 114.3 | Q86 | Q86-Q88 HydrophobicContact CB-CG 4Å; Q86-Q88 PolarHBondContact O-N 2.79Å; Q86-Q88 PolarHBondContact O-NE2 2.85Å | ||
| 89 | C | 87.1 | Confident | 86 | Confident | 48 Ų | 48 | 63.9 Ų | 63.9 | 32% | 0.324 | 35% | 0.348 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -103.9 | 144.6 | 178.7 | -59.2 | 0 | 0 | 0 | 0 | 110.4 | R82 T83 G87 V108 | R82-C89 CarbonylContact C-O 3.55Å; R82-C89 WeakPolarHBondContact CA-O 3.33Å; T83-C89 PolarHBondContact N-O 2.86Å; T83-C89 WeakPolarHBondContact O-CB 3.18Å; T83-C89 VanDerWaalsContact O-O 3.12Å; G87-C89 PolarHBondContact O-N 2.81Å; C89-V108 WeakPolarHBondContact CA-O 3.19Å |
| 90 | T | 88.8 | Confident | 85.3 | Confident | 13 Ų | 13 | 65.1 Ų | 65.1 | 8% | 0.08 | 36% | 0.359 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -114.9 | 129.3 | 174.1 | -54.4 | 0 | 0 | 0 | 0 | 108.1 | V79 G81 N107 V108 G110 | V79-T90 HydrophobicContact CG1-CG2 3.46Å; V79-T90 VanDerWaalsContact CG1-CG2 3.46Å; G81-T90 CarbonylContact O-C 3.58Å; G81-T90 WeakPolarHBondContact O-CA 3.48Å; G81-T90 WeakPolarHBondContact O-CG2 3.49Å; T90-N107 WeakPolarHBondContact O-CA 3.33Å; T90-V108 PolarHBondContact N-O 3.46Å; T90-V108 PolarHBondContact O-N 2.83Å; T90-G110 PolarHBondContact OG1-O 3.16Å |
| 91 | Q | 89.4 | Confident | 85 | Confident | 26 Ų | 26 | 69.1 Ų | 69.1 | 12% | 0.121 | 38% | 0.381 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -82.1 | 125.2 | 169.5 | -85.4 | -177.4 | 5.3 | 0 | 0 | 109.7 | L80 G81 T83 I105 N107 | L80-Q91 HydrophobicContact CB-CB 4.13Å; L80-Q91 WeakPolarHBondContact CB-O 3.47Å; L80-Q91 HydrophobicContact CD1-CB 4.33Å; L80-Q91 PolarHBondContact N-O 2.87Å; G81-Q91 PolarHBondContact N-O 2.7Å; G81-Q91 PolarHBondContact O-N 3.23Å; T83-Q91 WeakPolarHBondContact OG1-CG 3.22Å; T83-Q91 PolarHBondContact OG1-NE2 2.76Å; Q91-I105 HydrophobicContact CG-CG2 4.48Å; Q91-N107 WeakPolarHBondContact CG-OD1 3.43Å |
| 92 | V | 91.6 | Very high | 84.9 | Confident | 0 Ų | 0 | 72.5 Ų | 72.5 | 0% | 0 | 38% | 0.384 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -130.1 | 139.8 | -177.1 | -119.7 | 0 | 0 | 0 | 0 | 109 | V76 V79 I105 R106 V108 V112 | V76-V92 HydrophobicContact CG1-CB 4.38Å; V76-V92 HydrophobicContact CG1-CG1 3.44Å; V76-V92 VanDerWaalsContact CG1-CG1 3.44Å; V76-V92 HydrophobicContact CG2-CG1 4.45Å; V79-V92 HydrophobicContact CB-CG1 4.24Å; V79-V92 HydrophobicContact CG1-CG1 4.45Å; V79-V92 HydrophobicContact CG2-CG1 3.81Å; V92-I105 WeakPolarHBondContact O-CA 3.4Å; V92-R106 PolarHBondContact N-O 3.23Å; V92-R106 PolarHBondContact O-N 3.22Å; V92-V108 HydrophobicContact CG2-CB 3.85Å; V92-V108 HydrophobicContact CG2-CG2 3.46Å; V92-V108 VanDerWaalsContact CG2-CG2 3.46Å; V92-V112 HydrophobicContact CG1-CG1 4.16Å |
| 93 | R | 92 | Very high | 85 | Confident | 65 Ų | 65 | 66.3 Ų | 66.3 | 25% | 0.245 | 37% | 0.367 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -92 | 129.1 | 168.5 | 180 | 173.9 | -63.8 | -93.9 | -3.7 | 108.5 | T77 K78 S103 | T77-R93 PolarHBondContact N-O 2.89Å; K78-R93 HydrophobicContact CG-CB 3.77Å; K78-R93 HydrophobicContact CG-CG 4.5Å; K78-R93 PolarHBondContact N-O 2.88Å; K78-R93 PolarHBondContact O-N 3.02Å; R93-S103 PolarHBondContact NH1-OG 2.94Å |
| 94 | V | 92.1 | Very high | 85.5 | Confident | 0 Ų | 0 | 65.2 Ų | 65.2 | 0% | 0 | 36% | 0.36 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -122.1 | 146.3 | 177.1 | -60.4 | 0 | 0 | 0 | 0 | 111.1 | A74 R75 V76 S103 I104 R106 L118 L120 | A74-V94 HydrophobicContact CB-CB 4.05Å; A74-V94 HydrophobicContact CB-CG2 4.06Å; R75-V94 CarbonylContact O-C 3.54Å; R75-V94 VanDerWaalsContact O-CA 3.22Å; R75-V94 WeakPolarHBondContact O-CA 3.45Å; R75-V94 WeakPolarHBondContact O-CB 3.49Å; V76-V94 HydrophobicContact CB-CG1 4.43Å; V76-V94 HydrophobicContact CG2-CG1 3.82Å; V94-S103 CarbonylContact O-C 3.51Å; V94-S103 WeakPolarHBondContact O-CA 2.91Å; V94-S103 WeakPolarHBondContact O-CB 3.47Å; V94-I104 WeakPolarHBondContact CG2-O 3.32Å; V94-I104 PolarHBondContact N-O 3.48Å; V94-I104 PolarHBondContact O-N 2.92Å; V94-R106 HydrophobicContact CG2-CG 4.24Å; V94-L118 HydrophobicContact CG1-CD1 3.85Å; V94-L120 HydrophobicContact CG2-CD1 4.36Å |
| 95 | E | 91.4 | Very high | 86.1 | Confident | 47 Ų | 47 | 64.9 Ų | 64.9 | 22% | 0.22 | 35% | 0.349 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -109.3 | 142.2 | 171.6 | -78.2 | 160.1 | -150.4 | 0 | 0 | 108.8 | A74 R75 T77 | A74-E95 CarbonylContact C-O 3.42Å; A74-E95 WeakPolarHBondContact CA-O 3.46Å; A74-E95 WeakPolarHBondContact CB-O 3.45Å; R75-E95 PolarHBondContact N-O 2.88Å; R75-E95 PolarHBondContact O-N 3.2Å; T77-E95 WeakPolarHBondContact CB-OE1 3.42Å; T77-E95 WeakPolarHBondContact CG2-OE1 3.38Å; T77-E95 WeakPolarHBondContact OG1-CG 3.48Å; T77-E95 PolarHBondContact OG1-OE1 2.86Å; T77-E95 PolarHBondContact OG1-OE2 2.99Å |
| 96 | F | 90.1 | Very high | 86.7 | Confident | 10 Ų | 10 | 60.2 Ų | 60.2 | 4% | 0.044 | 31% | 0.311 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -70.9 | 145.8 | 176.3 | -67.4 | -83 | 0 | 0 | 0 | 110.7 | K72 A74 D98 D99 R102 I104 L120 | K72-F96 HydrophobicContact CB-CD1 4.12Å; K72-F96 HydrophobicContact CB-CE1 4.14Å; K72-F96 HydrophobicContact CD-CD1 4.14Å; K72-F96 HydrophobicContact CD-CE1 4.04Å; A74-F96 HydrophobicContact CB-CD1 4.45Å; F96-D98 VanDerWaalsContact C-N 3.32Å; F96-D99 HydrophobicContact CB-CB 4.47Å; F96-D99 CarbonylContact O-C 3.57Å; F96-R102 HydrophobicContact CD2-CB 4.02Å; F96-R102 HydrophobicContact CD2-CG 4.03Å; F96-R102 WeakPolarHBondContact CD2-O 3.37Å; F96-R102 HydrophobicContact CE2-CB 4.36Å; F96-R102 HydrophobicContact CE2-CG 3.86Å; F96-I104 HydrophobicContact CE2-CD1 3.48Å; F96-I104 VanDerWaalsContact CE2-CD1 3.48Å; F96-I104 HydrophobicContact CE2-CG1 3.82Å; F96-I104 HydrophobicContact CZ-CD1 3.43Å; F96-I104 VanDerWaalsContact CZ-CD1 3.43Å; F96-I104 HydrophobicContact CZ-CG1 4.19Å; F96-L120 HydrophobicContact CD1-CD1 4.16Å; F96-L120 HydrophobicContact CE1-CD1 3.46Å; F96-L120 VanDerWaalsContact CE1-CD1 3.46Å; F96-L120 HydrophobicContact CZ-CD1 3.98Å |
| 97 | M | 86.5 | Confident | 87.1 | Confident | 115 Ų | 115 | 56 Ų | 56 | 57% | 0.567 | 29% | 0.293 | S | S | * | . | S | Bend | trans | -72.8 | -29.6 | 173.1 | -68.4 | -173.3 | 64.5 | 0 | 0 | 112 | L73 V117 | L73-M97 HydrophobicContact CB-CG 4.33Å; L73-M97 HydrophobicContact CB-SD 3.77Å; L73-M97 PolarHBondContact O-N 2.79Å; M97-V117 HydrophobicContact SD-CG1 4.14Å |
| 98 | D | 84.1 | Confident | 87.6 | Confident | 111 Ų | 111 | 55.8 Ų | 55.8 | 59% | 0.594 | 29% | 0.288 | S | S | * | . | S | Bend | trans | -77.4 | -38.8 | 179 | -51.2 | -38.4 | 0 | 0 | 0 | 111.7 | F96 | F96-D98 VanDerWaalsContact C-N 3.32Š|
| 99 | D | 79.1 | Confident | 87.8 | Confident | 93 Ų | 93 | 57.5 Ų | 57.5 | 50% | 0.497 | 29% | 0.294 | S | S | . | . | trans | -132.3 | 100.4 | -175.1 | -64.5 | -48.9 | 0 | 0 | 0 | 110.8 | F96 N101 R102 | F96-D99 HydrophobicContact CB-CB 4.47Å; F96-D99 CarbonylContact O-C 3.57Å; D99-N101 PolarHBondContact O-N 3.45Å; D99-R102 PolarHBondContact O-N 3.13Å | ||
| 100 | S | 75.9 | Confident | 87.8 | Confident | 84 Ų | 84 | 56.4 Ų | 56.4 | 59% | 0.587 | 29% | 0.291 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -66.9 | -18.8 | -177.4 | 57.6 | 0 | 0 | 0 | 0 | 114.5 | ||
| 101 | N | 82.4 | Confident | 87.7 | Confident | 159 Ų | 159 | 61.7 Ų | 61.7 | 85% | 0.85 | 33% | 0.325 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -84.6 | -17.5 | -173.2 | -63.9 | -9.3 | 0 | 0 | 0 | 112.8 | D99 | D99-N101 PolarHBondContact O-N 3.45Š|
| 102 | R | 86.3 | Confident | 87.6 | Confident | 102 Ų | 102 | 61.3 Ų | 61.3 | 39% | 0.385 | 33% | 0.325 | S | S | . | . | trans | -100.5 | 120.6 | -179.5 | -173.4 | -179.6 | 176 | 179.9 | -1.2 | 109.6 | F96 D99 | F96-R102 HydrophobicContact CD2-CB 4.02Å; F96-R102 HydrophobicContact CD2-CG 4.03Å; F96-R102 WeakPolarHBondContact CD2-O 3.37Å; F96-R102 HydrophobicContact CE2-CB 4.36Å; F96-R102 HydrophobicContact CE2-CG 3.86Å; D99-R102 PolarHBondContact O-N 3.13Å | ||
| 103 | S | 88.5 | Confident | 87.6 | Confident | 39 Ų | 39 | 70.8 Ų | 70.8 | 27% | 0.273 | 36% | 0.36 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -118 | 138.7 | 172.9 | 65.5 | 0 | 0 | 0 | 0 | 111.5 | R93 V94 | R93-S103 PolarHBondContact NH1-OG 2.94Å; V94-S103 CarbonylContact O-C 3.51Å; V94-S103 WeakPolarHBondContact O-CA 2.91Å; V94-S103 WeakPolarHBondContact O-CB 3.47Å |
| 104 | I | 90.8 | Very high | 87.4 | Confident | 0 Ų | 0 | 74.1 Ų | 74.1 | 0% | 0 | 38% | 0.379 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -124.7 | 149.3 | -179.5 | -64.1 | -175.1 | 0 | 0 | 0 | 109.5 | V94 F96 R106 S123 E126 | V94-I104 WeakPolarHBondContact CG2-O 3.32Å; V94-I104 PolarHBondContact N-O 3.48Å; V94-I104 PolarHBondContact O-N 2.92Å; F96-I104 HydrophobicContact CE2-CD1 3.48Å; F96-I104 VanDerWaalsContact CE2-CD1 3.48Å; F96-I104 HydrophobicContact CE2-CG1 3.82Å; F96-I104 HydrophobicContact CZ-CD1 3.43Å; F96-I104 VanDerWaalsContact CZ-CD1 3.43Å; F96-I104 HydrophobicContact CZ-CG1 4.19Å; I104-R106 HydrophobicContact CG2-CG 4.37Å; I104-S123 WeakPolarHBondContact CD1-O 3.29Å; I104-E126 HydrophobicContact CG2-CB 4.22Å; I104-E126 HydrophobicContact CG2-CG 3.83Å |
| 105 | I | 91 | Very high | 87.2 | Confident | 32 Ų | 32 | 76.2 Ų | 76.2 | 16% | 0.164 | 40% | 0.401 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -94.6 | 130.4 | 172.6 | -56.4 | 173.1 | 0 | 0 | 0 | 109.7 | L80 Q91 V92 A127 | L80-I105 HydrophobicContact CD1-CD1 3.95Å; L80-I105 HydrophobicContact CD1-CG1 4.11Å; L80-I105 HydrophobicContact CD1-CG2 3.85Å; Q91-I105 HydrophobicContact CG-CG2 4.48Å; V92-I105 WeakPolarHBondContact O-CA 3.4Å; I105-A127 HydrophobicContact CG2-CB 4.41Å; I105-A127 WeakPolarHBondContact O-CB 3.44Å; I105-A127 PolarHBondContact O-N 2.84Å |
| 106 | R | 91.2 | Very high | 87.2 | Confident | 36 Ų | 36 | 76.4 Ų | 76.4 | 14% | 0.136 | 40% | 0.403 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -126.5 | 147.3 | 176.1 | -66.1 | -65.8 | 170.7 | 140 | 4.7 | 111.5 | V92 V94 I104 L120 E122 S123 R125 | V92-R106 PolarHBondContact N-O 3.23Å; V92-R106 PolarHBondContact O-N 3.22Å; V94-R106 HydrophobicContact CG2-CG 4.24Å; I104-R106 HydrophobicContact CG2-CG 4.37Å; R106-L120 HydrophobicContact CG-CD2 3.99Å; R106-E122 PolarHBondContact NH1-O 2.64Å; R106-E122 PolarHBondContact NH2-O 2.93Å; R106-S123 PolarHBondContact NH2-O 2.88Å; R106-R125 PolarHBondContact NE-O 2.77Å; R106-R125 VanDerWaalsContact NE-O 3.12Å; R106-R125 PolarHBondContact NH1-O 3.2Å; R106-R125 PolarHBondContact NH2-O 2.76Å |
| 107 | N | 89.2 | Confident | 87.1 | Confident | 68 Ų | 68 | 79.6 Ų | 79.6 | 36% | 0.364 | 42% | 0.423 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -88.6 | 121.7 | 166.5 | -64.3 | -29.9 | 0 | 0 | 0 | 107.4 | T90 Q91 | T90-N107 WeakPolarHBondContact O-CA 3.33Å; Q91-N107 WeakPolarHBondContact CG-OD1 3.43Å |
| 108 | V | 88.4 | Confident | 87.2 | Confident | 16 Ų | 16 | 75.2 Ų | 75.2 | 10% | 0.097 | 40% | 0.402 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -113.3 | 141.8 | 174.3 | -178.5 | 0 | 0 | 0 | 0 | 108.7 | Y46 C89 T90 V92 V112 L118 | Y46-V108 HydrophobicContact CE2-CG1 3.92Å; C89-V108 WeakPolarHBondContact CA-O 3.19Å; T90-V108 PolarHBondContact N-O 3.46Å; T90-V108 PolarHBondContact O-N 2.83Å; V92-V108 HydrophobicContact CG2-CB 3.85Å; V92-V108 HydrophobicContact CG2-CG2 3.46Å; V92-V108 VanDerWaalsContact CG2-CG2 3.46Å; V108-V112 HydrophobicContact CB-CG2 3.86Å; V108-V112 HydrophobicContact CG1-CG2 3.38Å; V108-L118 HydrophobicContact CG2-CD1 3.62Å; V108-L118 HydrophobicContact CG2-CD2 4.45Å |
| 109 | K | 87.9 | Confident | 87.4 | Confident | 143 Ų | 143 | 73.8 Ų | 73.8 | 62% | 0.622 | 40% | 0.397 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -88 | 127.6 | 175.4 | -169.9 | 178.8 | 179.9 | 178.4 | 0 | 109.3 | ||
| 110 | G | 86.8 | Confident | 87.7 | Confident | 25 Ų | 25 | 69.8 Ų | 69.8 | 26% | 0.258 | 38% | 0.376 | S | S | . | . | S | Bend | trans | 95.7 | -172.5 | 175.1 | 0 | 0 | 0 | 0 | 0 | 115 | T90 | T90-G110 PolarHBondContact OG1-O 3.16Š|
| 111 | P | 87.6 | Confident | 88.1 | Confident | 125 Ų | 125 | 71.3 Ų | 71.3 | 81% | 0.812 | 38% | 0.377 | S | S | * | . | trans | -76.1 | 126.5 | -178 | 30.8 | -32.7 | 0 | 0 | 0 | 110.5 | ||||
| 112 | V | 87.8 | Confident | 88 | Confident | 17 Ų | 17 | 67.5 Ų | 67.5 | 10% | 0.103 | 35% | 0.354 | C | S | . | . | trans | -128.6 | 147 | 179.2 | -178.1 | 0 | 0 | 0 | 0 | 108.7 | Y46 V76 V92 V108 D116 | Y46-V112 HydrophobicContact CE2-CG2 4.26Å; V76-V112 HydrophobicContact CG1-CG1 4.36Å; V76-V112 HydrophobicContact CG2-CG1 4Å; V92-V112 HydrophobicContact CG1-CG1 4.16Å; V108-V112 HydrophobicContact CB-CG2 3.86Å; V108-V112 HydrophobicContact CG1-CG2 3.38Å; V112-D116 HydrophobicContact CG1-CB 4.32Å | ||
| 113 | R | 89.9 | Confident | 87.4 | Confident | 199 Ų | 199 | 63 Ų | 63 | 75% | 0.751 | 34% | 0.338 | S | S | * | . | trans | -121.9 | 162.5 | 176.7 | -62.3 | -179.1 | -178.4 | -167.2 | -2.5 | 110.6 | D116 | R113-D116 PolarHBondContact N-OD2 2.84Å; R113-D116 WeakPolarHBondContact O-CB 3.45Å; R113-D116 PolarHBondContact O-N 3.12Å | ||
| 114 | E | 89.1 | Confident | 86.9 | Confident | 136 Ų | 136 | 67.6 Ų | 67.6 | 64% | 0.636 | 36% | 0.355 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -64.1 | 139.6 | 172.2 | -60.8 | -179.7 | 168.9 | 0 | 0 | 109.8 | D116 | E114-D116 VanDerWaalsContact C-N 3.35Š|
| 115 | G | 87.8 | Confident | 86.2 | Confident | 44 Ų | 44 | 75.3 Ų | 75.3 | 45% | 0.454 | 38% | 0.384 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 86.4 | -5.1 | -176.4 | 0 | 0 | 0 | 0 | 0 | 115.4 | V76 | V76-G115 PolarHBondContact O-N 3.21Š|
| 116 | D | 90.1 | Very high | 85.6 | Confident | 51 Ų | 51 | 79.5 Ų | 79.5 | 27% | 0.273 | 40% | 0.403 | S | S | . | . | trans | -65.1 | 146.6 | 173.3 | -72.3 | -19.9 | 0 | 0 | 0 | 111 | Y46 V76 V112 R113 E114 | Y46-D116 HydrophobicContact CE1-CB 4.15Å; V76-D116 HydrophobicContact CB-CB 4.47Å; V76-D116 HydrophobicContact CG2-CB 4.12Å; V76-D116 WeakPolarHBondContact CG2-O 3.49Å; V76-D116 PolarHBondContact N-O 2.78Å; V112-D116 HydrophobicContact CG1-CB 4.32Å; R113-D116 PolarHBondContact N-OD2 2.84Å; R113-D116 WeakPolarHBondContact O-CB 3.45Å; R113-D116 PolarHBondContact O-N 3.12Å; E114-D116 VanDerWaalsContact C-N 3.35Å | ||
| 117 | V | 88.9 | Confident | 85 | Confident | 76 Ų | 76 | 78.8 Ų | 78.8 | 46% | 0.461 | 41% | 0.405 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -102.5 | 133.5 | 177.7 | -177.8 | 0 | 0 | 0 | 0 | 110 | Y46 A74 M97 | Y46-V117 WeakPolarHBondContact CE1-O 3.21Å; A74-V117 CarbonylContact O-C 3.56Å; A74-V117 WeakPolarHBondContact O-CA 3.06Å; M97-V117 HydrophobicContact SD-CG1 4.14Å |
| 118 | L | 88.8 | Confident | 84.3 | Confident | 23 Ų | 23 | 86.2 Ų | 86.2 | 12% | 0.12 | 43% | 0.428 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -119.4 | 144.2 | -178.6 | -81.7 | 177.2 | 0 | 0 | 0 | 111.3 | Y46 L73 A74 V76 V94 V108 | Y46-L118 HydrophobicContact CE1-CD2 3.86Å; Y46-L118 HydrophobicContact CE1-CG 4.42Å; Y46-L118 HydrophobicContact CE2-CD2 4.18Å; Y46-L118 WeakPolarHBondContact OH-CD2 2.96Å; Y46-L118 VanDerWaalsContact OH-CG 3.32Å; Y46-L118 WeakPolarHBondContact OH-CG 3.42Å; L73-L118 WeakPolarHBondContact CA-O 3.21Å; A74-L118 PolarHBondContact N-O 3.01Å; A74-L118 PolarHBondContact O-N 3.44Å; V76-L118 HydrophobicContact CG2-CD1 3.97Å; V76-L118 HydrophobicContact CG2-CG 4.34Å; V94-L118 HydrophobicContact CG1-CD1 3.85Å; V108-L118 HydrophobicContact CG2-CD1 3.62Å; V108-L118 HydrophobicContact CG2-CD2 4.45Å |
| 119 | T | 88.6 | Confident | 83.4 | Confident | 81 Ų | 81 | 95.6 Ų | 95.6 | 50% | 0.497 | 46% | 0.461 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -99.9 | 118 | 174 | -49.2 | 0 | 0 | 0 | 0 | 109 | I71 L73 | I71-T119 HydrophobicContact CG2-CG2 3.14Å; L73-T119 HydrophobicContact CD2-CG2 4.17Å |
| 120 | L | 84.1 | Confident | 82.3 | Confident | 10 Ų | 10 | 94 Ų | 94 | 5% | 0.052 | 46% | 0.459 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -101 | 112.5 | 179.7 | -60.5 | 177.6 | 0 | 0 | 0 | 109.5 | K72 A74 V94 F96 R106 | K72-L120 PolarHBondContact N-O 3.03Å; K72-L120 PolarHBondContact O-N 3.25Å; A74-L120 HydrophobicContact CB-CD1 3.66Å; A74-L120 HydrophobicContact CB-CG 4.14Å; V94-L120 HydrophobicContact CG2-CD1 4.36Å; F96-L120 HydrophobicContact CD1-CD1 4.16Å; F96-L120 HydrophobicContact CE1-CD1 3.46Å; F96-L120 VanDerWaalsContact CE1-CD1 3.46Å; F96-L120 HydrophobicContact CZ-CD1 3.98Å; R106-L120 HydrophobicContact CG-CD2 3.99Å |
| 121 | L | 84.1 | Confident | 81.2 | Confident | 116 Ų | 116 | 108 Ų | 108 | 61% | 0.607 | 51% | 0.505 | S | S | * | . | S | Bend | trans | -77.4 | -29.7 | 173.8 | -59.6 | 179.8 | 0 | 0 | 0 | 112.3 | I71 | I71-L121 HydrophobicContact CD1-CD2 3.9Å; I71-L121 HydrophobicContact CG1-CD2 3.84Å; I71-L121 HydrophobicContact CG2-CD2 4.33Å |
| 122 | E | 81.9 | Confident | 80.9 | Confident | 79 Ų | 79 | 107.2 Ų | 107.2 | 37% | 0.369 | 49% | 0.489 | S | S | . | . | S | Bend | trans | -125.2 | 93.8 | 179.7 | -63.1 | -177.2 | 159.1 | 0 | 0 | 108 | R106 E124 R125 | R106-E122 PolarHBondContact NH1-O 2.64Å; R106-E122 PolarHBondContact NH2-O 2.93Å; E122-E124 VanDerWaalsContact C-N 3.27Å; E122-E124 PolarHBondContact O-N 3.3Å; E122-R125 IonicContact OE1-CZ 3.67Å; E122-R125 IonicContact OE1-NH1 2.77Å; E122-R125 PolarHBondContact OE1-NH1 2.84Å; E122-R125 VanDerWaalsContact OE2-CD 3.29Å; E122-R125 WeakPolarHBondContact OE2-CD 3.34Å; E122-R125 IonicContact OE2-CZ 3.56Å; E122-R125 IonicContact OE2-NE 2.76Å; E122-R125 IonicContact OE2-NH1 3.73Å; E122-R125 PolarHBondContact OE2-NH1 3.13Å |
| 123 | S | 73.9 | Confident | 80.6 | Confident | 7 Ų | 7 | 111.9 Ų | 111.9 | 5% | 0.049 | 51% | 0.51 | C | S | . | . | S | Bend | trans | -72.4 | -15.2 | -171.7 | 65.7 | 0 | 0 | 0 | 0 | 114.6 | I104 R106 | I104-S123 WeakPolarHBondContact CD1-O 3.29Å; R106-S123 PolarHBondContact NH2-O 2.88Å |
| 124 | E | 76.7 | Confident | 80.1 | Confident | 136 Ų | 136 | 107.1 Ų | 107.1 | 64% | 0.636 | 50% | 0.496 | S | S | * | . | S | Bend | trans | -93.9 | -27.5 | -173.5 | -63.7 | -179.5 | 169.9 | 0 | 0 | 114.6 | E122 | E122-E124 VanDerWaalsContact C-N 3.27Å; E122-E124 PolarHBondContact O-N 3.3Å |
| 125 | R | 76.7 | Confident | 79.5 | Confident | 161 Ų | 161 | 105.4 Ų | 105.4 | 61% | 0.608 | 49% | 0.488 | S | S | * | . | trans | -78.5 | 126.2 | -174.1 | -68.1 | -160.3 | -178.8 | 137.8 | -4.9 | 112.5 | R106 E122 | R106-R125 PolarHBondContact NE-O 2.77Å; R106-R125 VanDerWaalsContact NE-O 3.12Å; R106-R125 PolarHBondContact NH1-O 3.2Å; R106-R125 PolarHBondContact NH2-O 2.76Å; E122-R125 IonicContact OE1-CZ 3.67Å; E122-R125 IonicContact OE1-NH1 2.77Å; E122-R125 PolarHBondContact OE1-NH1 2.84Å; E122-R125 VanDerWaalsContact OE2-CD 3.29Å; E122-R125 WeakPolarHBondContact OE2-CD 3.34Å; E122-R125 IonicContact OE2-CZ 3.56Å; E122-R125 IonicContact OE2-NE 2.76Å; E122-R125 IonicContact OE2-NH1 3.73Å; E122-R125 PolarHBondContact OE2-NH1 3.13Å | ||
| 126 | E | 78.2 | Confident | 79 | Confident | 121 Ų | 121 | 109.3 Ų | 109.3 | 57% | 0.565 | 49% | 0.49 | S | S | * | . | trans | -98.3 | 147.6 | 172.7 | -48.1 | -158.8 | 154.3 | 0 | 0 | 111.7 | I104 R128 | I104-E126 HydrophobicContact CG2-CB 4.22Å; I104-E126 HydrophobicContact CG2-CG 3.83Å; E126-R128 PolarHBondContact O-N 3.02Å; E126-R128 VanDerWaalsContact O-N 3.16Å | ||
| 127 | A | 77.8 | Confident | 78.3 | Confident | 21 Ų | 21 | 113.1 Ų | 113.1 | 17% | 0.174 | 51% | 0.505 | C | S | . | . | trans | -66.7 | 115.5 | 172.4 | 0 | 0 | 0 | 0 | 0 | 110 | I105 | I105-A127 HydrophobicContact CG2-CB 4.41Å; I105-A127 WeakPolarHBondContact O-CB 3.44Å; I105-A127 PolarHBondContact O-N 2.84Å | ||
| 128 | R | 75.2 | Confident | 77.5 | Confident | 224 Ų | 224 | 115.8 Ų | 115.8 | 85% | 0.845 | 51% | 0.508 | S | S | * | . | P | Polyproline II helix | trans | -65.6 | 140.3 | 171.8 | -170.3 | 177.7 | -92.9 | -171.7 | -5.8 | 109.2 | E126 L130 | E126-R128 PolarHBondContact O-N 3.02Å; E126-R128 VanDerWaalsContact O-N 3.16Å; R128-L130 PolarHBondContact O-N 3.34Å; R128-L130 VanDerWaalsContact O-N 3.13Å |
| 129 | R | 68.8 | Low | 76.6 | Confident | 212 Ų | 212 | 122.9 Ų | 122.9 | 80% | 0.8 | 54% | 0.537 | S | S | * | . | P | Polyproline II helix | trans | -59.5 | 118.3 | 170.8 | -71.1 | -175.5 | -176.4 | 171 | 1.4 | 108.6 | ||
| 130 | L | 64.9 | Low | 75.6 | Confident | 111 Ų | 111 | 126.4 Ų | 126.4 | 58% | 0.581 | 54% | 0.541 | S | S | * | . | P | Polyproline II helix | trans | -71.2 | 126.2 | 169.1 | -64.6 | 173.1 | 0 | 0 | 0 | 107 | T83 R128 | T83-L130 HydrophobicContact CG2-CB 4.09Å; T83-L130 HydrophobicContact CG2-CD1 4.08Å; T83-L130 HydrophobicContact CG2-CG 4.42Å; R128-L130 PolarHBondContact O-N 3.34Å; R128-L130 VanDerWaalsContact O-N 3.13Å |
| 131 | R | 65.5 | Low | 74.9 | Confident | 319 Ų | 319 | 137 Ų | 137 | 100% | 1.204 | 59% | 0.585 | S | S | * | * | trans | -84.3 | 0 | 170.2 | -72.7 | -171.9 | 178.7 | 110.7 | -2.7 | 109.7 |
Retrieved 131 of 131 residues in 290 ms
(Link to these results)