| 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 | 38.9 | Very low | 42.8 | Very low | 232 Ų | 232 | 161.4 Ų | 161.4 | 100% | 1.143 | 88% | 0.881 | S | S | * | * | 0 | 132.7 | 0 | -82.1 | -63.3 | -170.3 | 0 | 0 | 108.5 | |||||
| 2 | L | 37.9 | Very low | 43.2 | Very low | 167 Ų | 167 | 163.3 Ų | 163.3 | 87% | 0.874 | 88% | 0.88 | S | S | * | * | trans | 33.1 | 109.8 | 162.9 | -56.1 | 177.4 | 0 | 0 | 0 | 118.9 | ||||
| 3 | L | 39.6 | Very low | 43.8 | Very low | 178 Ų | 178 | 162.7 Ų | 162.7 | 93% | 0.932 | 87% | 0.867 | S | S | * | * | trans | -85.2 | 149.4 | 164 | -83.4 | 165.6 | 0 | 0 | 0 | 111.5 | ||||
| 4 | F | 43.3 | Very low | 44.5 | Very low | 199 Ų | 199 | 167.6 Ų | 167.6 | 87% | 0.873 | 87% | 0.868 | S | S | * | * | trans | -69.2 | 148.5 | 170.2 | -71 | -106.3 | 0 | 0 | 0 | 111.8 | ||||
| 5 | S | 32.8 | Very low | 44.7 | Very low | 124 Ų | 124 | 162.3 Ų | 162.3 | 87% | 0.867 | 86% | 0.859 | S | S | * | * | -171.3 | 152.5 | 115.7 | -84.3 | 0 | 0 | 0 | 0 | 113.2 | |||||
| 6 | S | 41.9 | Very low | 45.1 | Very low | 115 Ų | 115 | 157 Ų | 157 | 80% | 0.804 | 84% | 0.839 | S | S | * | * | trans | -98.2 | 177.7 | 179.6 | -127.2 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 7 | P | 55.8 | Low | 45.4 | Very low | 118 Ų | 118 | 153.9 Ų | 153.9 | 77% | 0.766 | 82% | 0.82 | S | S | * | * | trans | -80.4 | 161.7 | -152.8 | 32.4 | -38.5 | 0 | 0 | 0 | 115.4 | ||||
| 8 | R | 40.9 | Very low | 45.7 | Very low | 247 Ų | 247 | 150.3 Ų | 150.3 | 93% | 0.932 | 81% | 0.806 | S | S | * | * | trans | -126.1 | 112.1 | 158 | -75.9 | -172.7 | 171.6 | -174.2 | -2 | 110.3 | ||||
| 9 | C | 47.8 | Very low | 46 | Very low | 141 Ų | 141 | 149.6 Ų | 149.6 | 95% | 0.953 | 80% | 0.802 | S | S | * | * | trans | -70 | 130.4 | 163.9 | -169.3 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 10 | G | 40.1 | Very low | 46.2 | Very low | 66 Ų | 66 | 147.9 Ų | 147.9 | 68% | 0.68 | 79% | 0.792 | S | S | * | * | trans | -131.5 | 108.7 | -167.4 | 0 | 0 | 0 | 0 | 0 | 112.9 | Q12 | G10-Q12 PolarHBondContact O-N 3Š| ||
| 11 | H | 51.8 | Low | 46.5 | Very low | 188 Ų | 188 | 146.5 Ų | 146.5 | 87% | 0.87 | 78% | 0.784 | S | S | * | * | trans | -72 | 106.7 | -172 | -143.5 | -91.3 | 0 | 0 | 0 | 112.6 | ||||
| 12 | Q | 48.2 | Very low | 47.3 | Very low | 184 Ų | 184 | 138 Ų | 138 | 86% | 0.86 | 75% | 0.75 | S | S | * | * | trans | -133.4 | 26.7 | 170.3 | -75.4 | -150.9 | 7.3 | 0 | 0 | 115.5 | G10 R14 | G10-Q12 PolarHBondContact O-N 3Å; Q12-R14 PolarHBondContact O-N 3.14Å; Q12-R14 VanDerWaalsContact O-N 3.13Å | ||
| 13 | H | 50.8 | Low | 48.2 | Very low | 156 Ų | 156 | 133.2 Ų | 133.2 | 72% | 0.722 | 74% | 0.735 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.1 | 82.3 | 169.3 | -115.9 | -92.6 | 0 | 0 | 0 | 111.6 | ||
| 14 | R | 53.4 | Low | 49 | Very low | 232 Ų | 232 | 127.5 Ų | 127.5 | 88% | 0.875 | 71% | 0.713 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -160.6 | -23.2 | 162.2 | -120.9 | 167.9 | -171.7 | 172.3 | 2.8 | 118.7 | Q12 | Q12-R14 PolarHBondContact O-N 3.14Å; Q12-R14 VanDerWaalsContact O-N 3.13Å |
| 15 | A | 47.8 | Very low | 49.9 | Very low | 88 Ų | 88 | 120.6 Ų | 120.6 | 73% | 0.727 | 69% | 0.693 | S | S | * | * | S | Bend | trans | -82.3 | -33.3 | -172.9 | 0 | 0 | 0 | 0 | 0 | 115.1 | ||
| 16 | S | 51.2 | Low | 51.4 | Low | 77 Ų | 77 | 120.3 Ų | 120.3 | 54% | 0.538 | 68% | 0.681 | S | S | . | * | S | Bend | trans | -84.6 | -14.8 | -167.1 | -39.1 | 0 | 0 | 0 | 0 | 115.4 | L19 L20 | S16-L19 PolarHBondContact O-N 3.26Å; S16-L20 WeakPolarHBondContact O-CD1 3.46Å; S16-L20 PolarHBondContact O-N 2.74Å |
| 17 | M | 50.2 | Low | 52.5 | Low | 105 Ų | 105 | 118.5 Ų | 118.5 | 52% | 0.517 | 67% | 0.666 | S | S | . | * | H | α-helix | trans | -60.7 | -46.9 | -172.9 | -80.9 | -67.1 | 172.3 | 0 | 0 | 115.8 | L19 L20 L21 | M17-L19 PolarHBondContact O-N 3.45Å; M17-L20 PolarHBondContact O-N 3.4Å; M17-L21 WeakPolarHBondContact O-CB 3.26Å; M17-L21 WeakPolarHBondContact O-CG 3.49Å; M17-L21 PolarHBondContact O-N 3.48Å |
| 18 | P | 50.8 | Low | 53 | Low | 89 Ų | 89 | 117.9 Ų | 117.9 | 58% | 0.578 | 66% | 0.656 | S | S | * | * | H | α-helix | trans | -65.6 | -29.2 | -178.6 | 25.8 | -34.5 | 0 | 0 | 0 | 112.6 | A22 | P18-A22 WeakPolarHBondContact O-CB 3.28Å; P18-A22 PolarHBondContact O-N 2.88Å |
| 19 | L | 50.2 | Low | 54.3 | Low | 137 Ų | 137 | 111.1 Ų | 111.1 | 72% | 0.717 | 64% | 0.638 | S | S | * | * | H | α-helix | trans | -78 | -39.4 | 179.9 | -161.9 | 68.8 | 0 | 0 | 0 | 112 | S16 M17 A22 A23 | S16-L19 PolarHBondContact O-N 3.26Å; M17-L19 PolarHBondContact O-N 3.45Å; L19-A22 PolarHBondContact O-N 2.98Å; L19-A23 VanDerWaalsContact O-CB 3.28Å; L19-A23 WeakPolarHBondContact O-CB 3.2Å; L19-A23 PolarHBondContact O-N 2.98Å |
| 20 | L | 50.9 | Low | 55.2 | Low | 115 Ų | 115 | 109.6 Ų | 109.6 | 60% | 0.602 | 62% | 0.618 | S | S | * | * | H | α-helix | trans | -64.9 | -39.6 | 170.1 | -92.1 | 87.7 | 0 | 0 | 0 | 111.8 | S16 M17 A23 A24 | S16-L20 WeakPolarHBondContact O-CD1 3.46Å; S16-L20 PolarHBondContact O-N 2.74Å; M17-L20 PolarHBondContact O-N 3.4Å; L20-A23 PolarHBondContact O-N 3.07Å; L20-A24 WeakPolarHBondContact O-CB 3.32Å; L20-A24 PolarHBondContact O-N 3.13Å |
| 21 | L | 52.2 | Low | 56.3 | Low | 119 Ų | 119 | 111.7 Ų | 111.7 | 62% | 0.623 | 61% | 0.613 | S | S | * | * | H | α-helix | trans | -61 | -44.4 | 175.6 | -83.8 | 161.9 | 0 | 0 | 0 | 111.7 | M17 A24 A25 | M17-L21 WeakPolarHBondContact O-CB 3.26Å; M17-L21 WeakPolarHBondContact O-CG 3.49Å; M17-L21 PolarHBondContact O-N 3.48Å; L21-A24 PolarHBondContact O-N 3.36Å; L21-A25 WeakPolarHBondContact O-CB 3.24Å; L21-A25 PolarHBondContact O-N 3.21Å |
| 22 | A | 55.3 | Low | 56.8 | Low | 52 Ų | 52 | 108 Ų | 108 | 43% | 0.43 | 60% | 0.599 | S | S | . | * | H | α-helix | trans | -64.7 | -43.3 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.7 | P18 L19 A24 A25 L26 | P18-A22 WeakPolarHBondContact O-CB 3.28Å; P18-A22 PolarHBondContact O-N 2.88Å; L19-A22 PolarHBondContact O-N 2.98Å; A22-A24 VanDerWaalsContact C-N 3.29Å; A22-A24 PolarHBondContact O-N 2.97Å; A22-A25 PolarHBondContact O-N 2.75Å; A22-L26 PolarHBondContact O-N 3.05Å; A22-L26 VanDerWaalsContact O-N 3.17Å |
| 23 | A | 57.5 | Low | 57.2 | Low | 68 Ų | 68 | 103.9 Ų | 103.9 | 56% | 0.562 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -68.8 | -24 | 179.6 | 0 | 0 | 0 | 0 | 0 | 113.8 | L19 L20 P27 | L19-A23 VanDerWaalsContact O-CB 3.28Å; L19-A23 WeakPolarHBondContact O-CB 3.2Å; L19-A23 PolarHBondContact O-N 2.98Å; L20-A23 PolarHBondContact O-N 3.07Å; A23-P27 WeakPolarHBondContact O-CD 3.45Å; A23-P27 VanDerWaalsContact O-CG 3.27Å; A23-P27 WeakPolarHBondContact O-CG 3.28Å |
| 24 | A | 56.8 | Low | 57.7 | Low | 57 Ų | 57 | 101.8 Ų | 101.8 | 47% | 0.471 | 58% | 0.576 | S | S | . | * | H | α-helix | trans | -89.5 | -33 | 171.7 | 0 | 0 | 0 | 0 | 0 | 112.7 | L20 L21 A22 P27 L28 | L20-A24 WeakPolarHBondContact O-CB 3.32Å; L20-A24 PolarHBondContact O-N 3.13Å; L21-A24 PolarHBondContact O-N 3.36Å; A22-A24 VanDerWaalsContact C-N 3.29Å; A22-A24 PolarHBondContact O-N 2.97Å; A24-P27 WeakPolarHBondContact O-CD 3.43Å; A24-P27 WeakPolarHBondContact O-CG 3.3Å; A24-L28 WeakPolarHBondContact O-CB 3.36Å; A24-L28 PolarHBondContact O-N 3.13Å |
| 25 | A | 60.9 | Low | 57.6 | Low | 54 Ų | 54 | 94.9 Ų | 94.9 | 45% | 0.446 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -66.5 | -37 | 178.9 | 0 | 0 | 0 | 0 | 0 | 112.6 | L21 A22 L28 L29 | L21-A25 WeakPolarHBondContact O-CB 3.24Å; L21-A25 PolarHBondContact O-N 3.21Å; A22-A25 PolarHBondContact O-N 2.75Å; A25-L28 PolarHBondContact O-N 3.38Å; A25-L29 WeakPolarHBondContact O-CB 3.26Å; A25-L29 PolarHBondContact O-N 2.83Å |
| 26 | L | 65.2 | Low | 57.8 | Low | 119 Ų | 119 | 95.3 Ų | 95.3 | 62% | 0.623 | 55% | 0.554 | S | S | * | * | H | α-helix | trans | -60.2 | -55.8 | 175.8 | -85.8 | 163.5 | 0 | 0 | 0 | 113.5 | A22 L28 L29 M30 | A22-L26 PolarHBondContact O-N 3.05Å; A22-L26 VanDerWaalsContact O-N 3.17Å; L26-L28 VanDerWaalsContact C-N 3.32Å; L26-L28 PolarHBondContact O-N 3.31Å; L26-L29 PolarHBondContact O-N 3.49Å; L26-M30 WeakPolarHBondContact O-CB 3.4Å; L26-M30 WeakPolarHBondContact O-CG 3.49Å; L26-M30 PolarHBondContact O-N 3.39Å |
| 27 | P | 65.1 | Low | 57.5 | Low | 77 Ų | 77 | 97.2 Ų | 97.2 | 50% | 0.5 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -66.8 | -31.3 | 176 | 25.3 | -33.1 | 0 | 0 | 0 | 112.6 | A23 A24 L31 | A23-P27 WeakPolarHBondContact O-CD 3.45Å; A23-P27 VanDerWaalsContact O-CG 3.27Å; A23-P27 WeakPolarHBondContact O-CG 3.28Å; A24-P27 WeakPolarHBondContact O-CD 3.43Å; A24-P27 WeakPolarHBondContact O-CG 3.3Å; P27-L31 VanDerWaalsContact O-CB 3.25Å; P27-L31 WeakPolarHBondContact O-CB 3.42Å; P27-L31 PolarHBondContact O-N 3.26Å |
| 28 | L | 66.4 | Low | 57.5 | Low | 104 Ų | 104 | 97 Ų | 97 | 55% | 0.545 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -67.4 | -40.4 | 174.5 | -173.9 | 67.4 | 0 | 0 | 0 | 112.2 | A24 A25 L26 L31 L32 | A24-L28 WeakPolarHBondContact O-CB 3.36Å; A24-L28 PolarHBondContact O-N 3.13Å; A25-L28 PolarHBondContact O-N 3.38Å; L26-L28 VanDerWaalsContact C-N 3.32Å; L26-L28 PolarHBondContact O-N 3.31Å; L28-L31 PolarHBondContact O-N 2.96Å; L28-L32 HydrophobicContact CG-CD1 4.33Å; L28-L32 WeakPolarHBondContact O-CB 3.41Å; L28-L32 VanDerWaalsContact O-CG 3.31Å; L28-L32 WeakPolarHBondContact O-CG 3.43Å; L28-L32 PolarHBondContact O-N 3.48Å |
| 29 | L | 67.4 | Low | 57 | Low | 105 Ų | 105 | 96 Ų | 96 | 55% | 0.55 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -66.4 | -44.5 | 174.6 | -176.5 | 67.2 | 0 | 0 | 0 | 110.8 | A25 L26 L31 L32 C33 | A25-L29 WeakPolarHBondContact O-CB 3.26Å; A25-L29 PolarHBondContact O-N 2.83Å; L26-L29 PolarHBondContact O-N 3.49Å; L29-L31 VanDerWaalsContact C-N 3.29Å; L29-L31 PolarHBondContact O-N 2.86Å; L29-L32 PolarHBondContact O-N 3.2Å; L29-C33 PolarHBondContact O-N 3.03Å; L29-C33 PolarHBondContact O-SG 2.93Å; L29-C33 VanDerWaalsContact O-SG 3.38Å |
| 30 | M | 66.7 | Low | 57 | Low | 110 Ų | 110 | 94.9 Ų | 94.9 | 54% | 0.542 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -60.9 | -38.8 | 173.3 | -71.5 | -61.5 | -64.4 | 0 | 0 | 111.7 | L26 C33 Y34 | L26-M30 WeakPolarHBondContact O-CB 3.4Å; L26-M30 WeakPolarHBondContact O-CG 3.49Å; L26-M30 PolarHBondContact O-N 3.39Å; M30-C33 CarbonylContact O-C 3.43Å; M30-C33 PolarHBondContact O-N 3.48Å; M30-Y34 WeakPolarHBondContact O-CB 3.44Å; M30-Y34 PolarHBondContact O-N 3.38Å |
| 31 | L | 63.8 | Low | 56.6 | Low | 109 Ų | 109 | 96.8 Ų | 96.8 | 57% | 0.571 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -66.6 | -39.9 | 174.8 | -164.5 | 76.2 | 0 | 0 | 0 | 111.8 | P27 L28 L29 C33 Y34 V35 | P27-L31 VanDerWaalsContact O-CB 3.25Å; P27-L31 WeakPolarHBondContact O-CB 3.42Å; P27-L31 PolarHBondContact O-N 3.26Å; L28-L31 PolarHBondContact O-N 2.96Å; L29-L31 VanDerWaalsContact C-N 3.29Å; L29-L31 PolarHBondContact O-N 2.86Å; L31-C33 VanDerWaalsContact C-N 3.25Å; L31-C33 PolarHBondContact O-N 3.26Å; L31-Y34 PolarHBondContact O-N 3.33Å; L31-Y34 VanDerWaalsContact O-N 3.08Å; L31-V35 WeakPolarHBondContact O-CG2 3.49Å; L31-V35 PolarHBondContact O-N 2.95Å |
| 32 | L | 61.2 | Low | 56.4 | Low | 112 Ų | 112 | 96.8 Ų | 96.8 | 59% | 0.586 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -65 | -27.3 | 172.8 | -75.7 | 163.5 | 0 | 0 | 0 | 112.8 | L28 L29 | L28-L32 HydrophobicContact CG-CD1 4.33Å; L28-L32 WeakPolarHBondContact O-CB 3.41Å; L28-L32 VanDerWaalsContact O-CG 3.31Å; L28-L32 WeakPolarHBondContact O-CG 3.43Å; L28-L32 PolarHBondContact O-N 3.48Å; L29-L32 PolarHBondContact O-N 3.2Å |
| 33 | C | 57.4 | Low | 56.1 | Low | 96 Ų | 96 | 98.7 Ų | 98.7 | 65% | 0.649 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -83 | -21 | 169.8 | -66.9 | 0 | 0 | 0 | 0 | 113.7 | L29 M30 L31 | L29-C33 PolarHBondContact O-N 3.03Å; L29-C33 PolarHBondContact O-SG 2.93Å; L29-C33 VanDerWaalsContact O-SG 3.38Å; M30-C33 CarbonylContact O-C 3.43Å; M30-C33 PolarHBondContact O-N 3.48Å; L31-C33 VanDerWaalsContact C-N 3.25Å; L31-C33 PolarHBondContact O-N 3.26Å |
| 34 | Y | 61.1 | Low | 55.8 | Low | 113 Ų | 113 | 103.7 Ų | 103.7 | 44% | 0.443 | 62% | 0.619 | S | S | . | * | H | α-helix | trans | -94.7 | -23.9 | -179.5 | -122 | -85.9 | 0 | 0 | 0 | 114.3 | M30 L31 P36 V214 T218 | M30-Y34 WeakPolarHBondContact O-CB 3.44Å; M30-Y34 PolarHBondContact O-N 3.38Å; L31-Y34 PolarHBondContact O-N 3.33Å; L31-Y34 VanDerWaalsContact O-N 3.08Å; Y34-P36 VanDerWaalsContact O-CD 3.23Å; Y34-P36 WeakPolarHBondContact O-CD 3.33Å; Y34-V214 HydrophobicContact CE1-CB 4.45Å; Y34-V214 HydrophobicContact CE1-CG1 3.68Å; Y34-V214 HydrophobicContact CE1-CG2 4.03Å; Y34-V214 WeakPolarHBondContact OH-CG1 3.49Å; Y34-T218 HydrophobicContact CE2-CG2 4.28Å |
| 35 | V | 52.3 | Low | 56 | Low | 86 Ų | 86 | 111.1 Ų | 111.1 | 52% | 0.521 | 64% | 0.635 | S | S | . | * | S | Bend | trans | -64.4 | 113.4 | 160.2 | 171.6 | 0 | 0 | 0 | 0 | 106.1 | L31 V37 | L31-V35 WeakPolarHBondContact O-CG2 3.49Å; L31-V35 PolarHBondContact O-N 2.95Å; V35-V37 PolarHBondContact O-N 3.38Å; V35-V37 VanDerWaalsContact O-N 3.17Å |
| 36 | P | 50.8 | Low | 56.7 | Low | 97 Ų | 97 | 116.5 Ų | 116.5 | 63% | 0.63 | 65% | 0.648 | S | S | * | * | trans | -60.7 | 126.8 | 173.2 | 26.7 | -32.9 | 0 | 0 | 0 | 107.2 | Y34 S38 | Y34-P36 VanDerWaalsContact O-CD 3.23Å; Y34-P36 WeakPolarHBondContact O-CD 3.33Å; P36-S38 PolarHBondContact O-N 3.42Å | ||
| 37 | V | 45.1 | Very low | 57.5 | Low | 117 Ų | 117 | 113.4 Ų | 113.4 | 71% | 0.709 | 64% | 0.635 | S | S | * | * | trans | -75.1 | 69.9 | 177.5 | -176.4 | 0 | 0 | 0 | 0 | 108.6 | V35 A39 | V35-V37 PolarHBondContact O-N 3.38Å; V35-V37 VanDerWaalsContact O-N 3.17Å; V37-A39 HydrophobicContact CG1-CB 3.81Å; V37-A39 PolarHBondContact O-N 3.31Å | ||
| 38 | S | 50 | Low | 58.4 | Low | 102 Ų | 102 | 111.6 Ų | 111.6 | 71% | 0.713 | 62% | 0.624 | S | S | * | * | trans | -74.1 | 28.2 | 164.3 | -56.4 | 0 | 0 | 0 | 0 | 111.4 | P36 S40 | P36-S38 PolarHBondContact O-N 3.42Å; S38-S40 PolarHBondContact O-N 2.94Å | ||
| 39 | A | 40.8 | Very low | 59.3 | Low | 67 Ų | 67 | 112 Ų | 112 | 55% | 0.554 | 62% | 0.623 | S | S | * | * | trans | -71.7 | 87.2 | 157.6 | 0 | 0 | 0 | 0 | 0 | 106.8 | V37 L41 | V37-A39 HydrophobicContact CG1-CB 3.81Å; V37-A39 PolarHBondContact O-N 3.31Å; A39-L41 PolarHBondContact O-N 2.9Å | ||
| 40 | S | 50.3 | Low | 60.1 | Low | 114 Ų | 114 | 110 Ų | 110 | 80% | 0.797 | 62% | 0.616 | S | S | * | * | trans | -54.2 | 104.4 | 168.2 | -57.9 | 0 | 0 | 0 | 0 | 108.2 | S38 | S38-S40 PolarHBondContact O-N 2.94Š| ||
| 41 | L | 43.5 | Very low | 61.1 | Low | 154 Ų | 154 | 110.1 Ų | 110.1 | 81% | 0.806 | 62% | 0.617 | S | S | * | * | trans | -56.3 | 134.2 | 179.1 | -87.8 | 79.8 | 0 | 0 | 0 | 108.4 | A39 A43 | A39-L41 PolarHBondContact O-N 2.9Å; L41-A43 PolarHBondContact O-N 3.44Å | ||
| 42 | P | 46.3 | Very low | 62.3 | Low | 119 Ų | 119 | 108.4 Ų | 108.4 | 77% | 0.773 | 61% | 0.609 | S | S | * | * | trans | -59.9 | 116.4 | 172.4 | 25.8 | -32.9 | 0 | 0 | 0 | 107.7 | H44 | P42-H44 PolarHBondContact O-N 3.37Š| ||
| 43 | A | 49.8 | Very low | 63.6 | Low | 92 Ų | 92 | 103 Ų | 103 | 76% | 0.76 | 58% | 0.581 | S | S | * | * | trans | -57.6 | 113.2 | -173.1 | 0 | 0 | 0 | 0 | 0 | 110 | L41 R45 | L41-A43 PolarHBondContact O-N 3.44Å; A43-R45 PolarHBondContact O-N 3.11Å; A43-R45 VanDerWaalsContact O-N 3.15Å | ||
| 44 | H | 51 | Low | 65.1 | Low | 173 Ų | 173 | 100.7 Ų | 100.7 | 80% | 0.801 | 57% | 0.568 | S | S | * | * | trans | -53.2 | 124.4 | 168.9 | -106.9 | -78.1 | 0 | 0 | 0 | 107.5 | P42 K46 | P42-H44 PolarHBondContact O-N 3.37Å; H44-K46 PolarHBondContact O-N 3.42Å | ||
| 45 | R | 61 | Low | 66.4 | Low | 214 Ų | 214 | 105.6 Ų | 105.6 | 81% | 0.808 | 59% | 0.586 | S | S | * | * | S | Bend | trans | -69.8 | 73.9 | -173.6 | -66.4 | -169.1 | -175 | -99.9 | 7.1 | 111.9 | A43 | A43-R45 PolarHBondContact O-N 3.11Å; A43-R45 VanDerWaalsContact O-N 3.15Å |
| 46 | K | 75.8 | Confident | 68.2 | Low | 166 Ų | 166 | 106.3 Ų | 106.3 | 72% | 0.722 | 58% | 0.584 | S | S | * | * | trans | -121.4 | 140 | 169.2 | -68.4 | -175.6 | 176.7 | -178 | 0 | 107.1 | H44 | H44-K46 PolarHBondContact O-N 3.42Š| ||
| 47 | C | 82.3 | Confident | 70.1 | Confident | 54 Ų | 54 | 107.8 Ų | 107.8 | 37% | 0.365 | 58% | 0.577 | S | S | . | * | P | Polyproline II helix | trans | -58.9 | 125.3 | 173.8 | -167.5 | 0 | 0 | 0 | 0 | 109.2 | C61 | C47-C61 WeakPolarHBondContact CA-SG 2.98Å; C47-C61 HydrophobicContact CB-CB 4.31Å; C47-C61 WeakPolarHBondContact CB-SG 3.34Å; C47-C61 WeakPolarHBondContact SG-CB 3.09Å; C47-C61 PolarHBondContact SG-O 3.18Å; C47-C61 VanDerWaalsContact SG-O 3.35Å; C47-C61 CovalentContact SG-SG 2.03Å; C47-C61 PolarHBondContact SG-SG 2.98Å |
| 48 | P | 83.4 | Confident | 72.3 | Confident | 40 Ų | 40 | 103.7 Ų | 103.7 | 26% | 0.26 | 55% | 0.549 | S | S | . | . | P | Polyproline II helix | trans | -61 | 158.3 | 176.1 | 25.1 | -34.7 | 0 | 0 | 0 | 111.1 | D52 C61 | P48-D52 HydrophobicContact CB-CB 4.39Å; P48-C61 HydrophobicContact CG-CB 4.21Å |
| 49 | H | 85.8 | Confident | 74.2 | Confident | 113 Ų | 113 | 103.2 Ų | 103.2 | 52% | 0.523 | 54% | 0.535 | S | S | . | . | P | Polyproline II helix | trans | -64.2 | 144.5 | -175.2 | -164.7 | -113.5 | 0 | 0 | 0 | 109.9 | I51 D52 C53 | H49-I51 PolarHBondContact O-N 3.46Å; H49-D52 VanDerWaalsContact CB-OD2 3.26Å; H49-D52 WeakPolarHBondContact CB-OD2 3.41Å; H49-D52 PolarHBondContact N-OD2 3.5Å; H49-D52 VanDerWaalsContact N-OD2 3.13Å; H49-D52 WeakPolarHBondContact O-CB 3.5Å; H49-D52 PolarHBondContact O-N 3.31Å; H49-C53 PolarHBondContact O-N 3.38Å |
| 50 | P | 84.7 | Confident | 76.6 | Confident | 61 Ų | 61 | 105.6 Ų | 105.6 | 40% | 0.396 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -51.2 | -35.6 | -178.4 | -32.1 | 38.1 | 0 | 0 | 0 | 113.9 | D52 C53 A54 H60 | P50-D52 VanDerWaalsContact C-N 3.33Å; P50-D52 PolarHBondContact O-N 2.95Å; P50-C53 PolarHBondContact O-N 2.91Å; P50-A54 WeakPolarHBondContact O-CB 3.45Å; P50-A54 PolarHBondContact O-N 3.18Å; P50-H60 PolarHBondContact O-CD2 3.31Å |
| 51 | I | 86.1 | Confident | 78.5 | Confident | 113 Ų | 113 | 101 Ų | 101 | 58% | 0.579 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -63 | -35.3 | 176.6 | -57.8 | 177 | 0 | 0 | 0 | 112.2 | H49 A54 R55 | H49-I51 PolarHBondContact O-N 3.46Å; I51-A54 PolarHBondContact O-N 3.46Å; I51-R55 WeakPolarHBondContact O-CB 3.29Å; I51-R55 PolarHBondContact O-N 3.33Å |
| 52 | D | 89.5 | Confident | 80.4 | Confident | 73 Ų | 73 | 100.6 Ų | 100.6 | 39% | 0.39 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -68.3 | -40 | 179.6 | -58.8 | -43 | 0 | 0 | 0 | 111.2 | P48 H49 P50 Q56 | P48-D52 HydrophobicContact CB-CB 4.39Å; H49-D52 VanDerWaalsContact CB-OD2 3.26Å; H49-D52 WeakPolarHBondContact CB-OD2 3.41Å; H49-D52 PolarHBondContact N-OD2 3.5Å; H49-D52 VanDerWaalsContact N-OD2 3.13Å; H49-D52 WeakPolarHBondContact O-CB 3.5Å; H49-D52 PolarHBondContact O-N 3.31Å; P50-D52 VanDerWaalsContact C-N 3.33Å; P50-D52 PolarHBondContact O-N 2.95Å; D52-Q56 WeakPolarHBondContact O-CG 3.35Å; D52-Q56 PolarHBondContact O-N 2.89Å; D52-Q56 PolarHBondContact O-NE2 3.33Å |
| 53 | C | 89.4 | Confident | 82.1 | Confident | 0 Ų | 0 | 99.3 Ų | 99.3 | 0% | 0 | 49% | 0.487 | C | S | . | . | H | α-helix | trans | -67.6 | -44.1 | 172.9 | -59.6 | 0 | 0 | 0 | 0 | 111.4 | H49 P50 R55 Q56 R57 R58 C68 | H49-C53 PolarHBondContact O-N 3.38Å; P50-C53 PolarHBondContact O-N 2.91Å; C53-R55 VanDerWaalsContact C-N 3.31Å; C53-R55 PolarHBondContact O-N 3.34Å; C53-Q56 CarbonylContact O-C 3.44Å; C53-Q56 WeakPolarHBondContact O-CA 3.34Å; C53-Q56 WeakPolarHBondContact O-CB 3.32Å; C53-Q56 PolarHBondContact O-N 3.29Å; C53-R57 PolarHBondContact O-N 3.36Å; C53-R57 VanDerWaalsContact O-N 3.14Å; C53-R58 CarbonylContact C-O 3.48Å; C53-R58 HydrophobicContact CB-CB 4.36Å; C53-R58 PolarHBondContact O-N 3Å; C53-C68 WeakPolarHBondContact CA-SG 2.82Å; C53-C68 HydrophobicContact CB-CB 3.72Å; C53-C68 WeakPolarHBondContact CB-SG 3.21Å; C53-C68 VanDerWaalsContact SG-CA 3.56Å; C53-C68 WeakPolarHBondContact SG-CB 3.28Å; C53-C68 CovalentContact SG-SG 2.04Å; C53-C68 PolarHBondContact SG-SG 3.33Å |
| 54 | A | 88.1 | Confident | 83.3 | Confident | 46 Ų | 46 | 101.7 Ų | 101.7 | 38% | 0.38 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -60.5 | -39.7 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112 | P50 I51 Q56 R57 | P50-A54 WeakPolarHBondContact O-CB 3.45Å; P50-A54 PolarHBondContact O-N 3.18Å; I51-A54 PolarHBondContact O-N 3.46Å; A54-Q56 VanDerWaalsContact C-N 3.28Å; A54-Q56 PolarHBondContact O-N 3.02Å; A54-R57 WeakPolarHBondContact O-CA 3.46Å; A54-R57 PolarHBondContact O-N 3.35Å |
| 55 | R | 89.3 | Confident | 84.3 | Confident | 216 Ų | 216 | 95.8 Ų | 95.8 | 82% | 0.815 | 47% | 0.473 | S | S | * | . | H | α-helix | trans | -61.8 | -34.3 | 173.7 | -173.2 | 178.8 | -177.3 | -174.1 | 1.6 | 112.5 | I51 C53 R57 | I51-R55 WeakPolarHBondContact O-CB 3.29Å; I51-R55 PolarHBondContact O-N 3.33Å; C53-R55 VanDerWaalsContact C-N 3.31Å; C53-R55 PolarHBondContact O-N 3.34Å; R55-R57 PolarHBondContact O-N 3.03Å |
| 56 | Q | 89.1 | Confident | 85.2 | Confident | 102 Ų | 102 | 87.3 Ų | 87.3 | 48% | 0.477 | 45% | 0.447 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -80.2 | 1.6 | 172.7 | -66 | 166.6 | 55.4 | 0 | 0 | 113.3 | D52 C53 A54 R58 C83 | D52-Q56 WeakPolarHBondContact O-CG 3.35Å; D52-Q56 PolarHBondContact O-N 2.89Å; D52-Q56 PolarHBondContact O-NE2 3.33Å; C53-Q56 CarbonylContact O-C 3.44Å; C53-Q56 WeakPolarHBondContact O-CA 3.34Å; C53-Q56 WeakPolarHBondContact O-CB 3.32Å; C53-Q56 PolarHBondContact O-N 3.29Å; A54-Q56 VanDerWaalsContact C-N 3.28Å; A54-Q56 PolarHBondContact O-N 3.02Å; Q56-R58 HydrophobicContact CB-CB 4.49Å; Q56-R58 HydrophobicContact CB-CG 4.2Å; Q56-R58 PolarHBondContact O-N 2.98Å; Q56-C83 WeakPolarHBondContact O-CB 3.34Å |
| 57 | R | 90.2 | Very high | 85.7 | Confident | 127 Ų | 127 | 86.3 Ų | 86.3 | 48% | 0.479 | 45% | 0.445 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 59.1 | 31.9 | -174.1 | -45.6 | 178.8 | -172.7 | -146.9 | -0.7 | 113 | C53 A54 R55 C71 L72 F75 C83 | C53-R57 PolarHBondContact O-N 3.36Å; C53-R57 VanDerWaalsContact O-N 3.14Å; A54-R57 WeakPolarHBondContact O-CA 3.46Å; A54-R57 PolarHBondContact O-N 3.35Å; R55-R57 PolarHBondContact O-N 3.03Å; R57-C71 WeakPolarHBondContact O-CA 3.49Å; R57-L72 PolarHBondContact O-N 3.39Å; R57-F75 HydrophobicContact CB-CD2 3.92Å; R57-F75 HydrophobicContact CB-CE2 4.36Å; R57-F75 HydrophobicContact CB-CG 4.24Å; R57-F75 HydrophobicContact CG-CD2 4.49Å; R57-F75 VanDerWaalsContact NH1-CZ 3.3Å; R57-C83 HydrophobicContact CB-CB 3.86Å |
| 58 | R | 91 | Very high | 86 | Confident | 32 Ų | 32 | 84.9 Ų | 84.9 | 12% | 0.121 | 44% | 0.435 | C | S | . | . | B | Isolated β-bridge | trans | -107.1 | 151.5 | 179.7 | -72.4 | -177.6 | 170.2 | -74.9 | -3.8 | 111.6 | C53 Q56 C68 G69 S70 E77 G81 C83 | C53-R58 CarbonylContact C-O 3.48Å; C53-R58 HydrophobicContact CB-CB 4.36Å; C53-R58 PolarHBondContact O-N 3Å; Q56-R58 HydrophobicContact CB-CB 4.49Å; Q56-R58 HydrophobicContact CB-CG 4.2Å; Q56-R58 PolarHBondContact O-N 2.98Å; R58-C68 HydrophobicContact CB-CB 3.88Å; R58-C68 HydrophobicContact CG-CB 4.43Å; R58-G69 WeakPolarHBondContact CB-O 3.49Å; R58-G69 WeakPolarHBondContact CD-O 3.24Å; R58-G69 WeakPolarHBondContact CG-O 3.35Å; R58-G69 PolarHBondContact NH1-O 3.4Å; R58-S70 CarbonylContact C-O 3.6Å; R58-S70 WeakPolarHBondContact CA-O 3.13Å; R58-E77 IonicContact CZ-OE1 3.21Å; R58-E77 IonicContact NH1-OE1 2.73Å; R58-E77 PolarHBondContact NH1-OE1 3.43Å; R58-E77 IonicContact NH2-OE1 2.67Å; R58-E77 PolarHBondContact NH2-OE1 3.2Å; R58-G81 PolarHBondContact NH2-O 3.22Å; R58-C83 VanDerWaalsContact CG-SG 3.52Å |
| 59 | H | 91.2 | Very high | 86.3 | Confident | 91 Ų | 91 | 84.2 Ų | 84.2 | 42% | 0.421 | 44% | 0.435 | S | S | . | . | P | Polyproline II helix | trans | -57.6 | 146.7 | 166.7 | -78 | -85.3 | 0 | 0 | 0 | 110.4 | C61 G69 S70 | H59-C61 PolarHBondContact O-N 3.09Å; H59-G69 PolarHBondContact O-N 3.17Å; H59-S70 PolarHBondContact CD2-O 2.95Å; H59-S70 PolarHBondContact N-O 3.41Å |
| 60 | H | 91.3 | Very high | 86.5 | Confident | 118 Ų | 118 | 82.3 Ų | 82.3 | 55% | 0.546 | 44% | 0.435 | S | S | . | . | P | Polyproline II helix | trans | -55.8 | 138.6 | 176.5 | -52.6 | 135.1 | 0 | 0 | 0 | 110.7 | P50 | P50-H60 PolarHBondContact O-CD2 3.31Š|
| 61 | C | 90.3 | Very high | 86.9 | Confident | 16 Ų | 16 | 80.3 Ų | 80.3 | 11% | 0.108 | 42% | 0.422 | C | S | . | . | P | Polyproline II helix | trans | -59.8 | 146.2 | 172.7 | 152.5 | 0 | 0 | 0 | 0 | 110.4 | C47 P48 H59 S65 E67 | C47-C61 WeakPolarHBondContact CA-SG 2.98Å; C47-C61 HydrophobicContact CB-CB 4.31Å; C47-C61 WeakPolarHBondContact CB-SG 3.34Å; C47-C61 WeakPolarHBondContact SG-CB 3.09Å; C47-C61 PolarHBondContact SG-O 3.18Å; C47-C61 VanDerWaalsContact SG-O 3.35Å; C47-C61 CovalentContact SG-SG 2.03Å; C47-C61 PolarHBondContact SG-SG 2.98Å; P48-C61 HydrophobicContact CG-CB 4.21Å; H59-C61 PolarHBondContact O-N 3.09Å; C61-S65 PolarHBondContact SG-O 3.36Å; C61-S65 VanDerWaalsContact SG-O 3.34Å; C61-S65 PolarHBondContact SG-OG 2.98Å; C61-E67 VanDerWaalsContact CB-O 3.31Å; C61-E67 WeakPolarHBondContact CB-O 3.38Å |
| 62 | H | 83.8 | Confident | 87.1 | Confident | 146 Ų | 146 | 77.7 Ų | 77.7 | 68% | 0.676 | 41% | 0.409 | S | S | * | . | trans | -133.6 | 123.6 | -179 | -169.1 | -67.2 | 0 | 0 | 0 | 109.6 | S65 | H62-S65 PolarHBondContact N-OG 2.99Å; H62-S65 WeakPolarHBondContact O-CB 3.27Å; H62-S65 PolarHBondContact O-N 2.99Å; H62-S65 PolarHBondContact O-OG 2.96Å; H62-S65 VanDerWaalsContact O-OG 3.11Å | ||
| 63 | P | 82 | Confident | 86.9 | Confident | 93 Ų | 93 | 79.6 Ų | 79.6 | 60% | 0.604 | 43% | 0.427 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -52 | 133.8 | 175.4 | -26.3 | 35 | 0 | 0 | 0 | 111.1 | ||
| 64 | P | 73.4 | Confident | 86.7 | Confident | 141 Ų | 141 | 82.9 Ų | 82.9 | 92% | 0.916 | 45% | 0.449 | S | S | * | . | T | Hydrogen-bonded Turn | cis | -91.7 | 12.4 | 14.5 | 37.3 | -37.7 | 0 | 0 | 0 | 116.2 | ||
| 65 | S | 72.9 | Confident | 86.6 | Confident | 50 Ų | 50 | 82.8 Ų | 82.8 | 35% | 0.35 | 44% | 0.44 | S | S | . | . | trans | -66.5 | 143.9 | 177.2 | 81.9 | 0 | 0 | 0 | 0 | 111.7 | C61 H62 E67 | C61-S65 PolarHBondContact SG-O 3.36Å; C61-S65 VanDerWaalsContact SG-O 3.34Å; C61-S65 PolarHBondContact SG-OG 2.98Å; H62-S65 PolarHBondContact N-OG 2.99Å; H62-S65 WeakPolarHBondContact O-CB 3.27Å; H62-S65 PolarHBondContact O-N 2.99Å; H62-S65 PolarHBondContact O-OG 2.96Å; H62-S65 VanDerWaalsContact O-OG 3.11Å; S65-E67 PolarHBondContact OG-O 2.88Å | ||
| 66 | S | 80.6 | Confident | 86.5 | Confident | 36 Ų | 36 | 80.9 Ų | 80.9 | 25% | 0.252 | 43% | 0.433 | S | S | . | . | S | Bend | trans | -98.3 | 5.5 | 167.8 | 50.7 | 0 | 0 | 0 | 0 | 112.7 | ||
| 67 | E | 85.4 | Confident | 86.6 | Confident | 145 Ų | 145 | 80.7 Ų | 80.7 | 68% | 0.678 | 43% | 0.432 | S | S | * | . | S | Bend | trans | -131.3 | 151.8 | -171.6 | -71.2 | 166.9 | -154.2 | 0 | 0 | 109.9 | C61 S65 | C61-E67 VanDerWaalsContact CB-O 3.31Å; C61-E67 WeakPolarHBondContact CB-O 3.38Å; S65-E67 PolarHBondContact OG-O 2.88Å |
| 68 | C | 88.9 | Confident | 86.3 | Confident | 23 Ų | 23 | 76.2 Ų | 76.2 | 16% | 0.155 | 42% | 0.418 | C | S | . | . | trans | -61.3 | 152.8 | 174.1 | -65.2 | 0 | 0 | 0 | 0 | 111.6 | C53 R58 | C53-C68 WeakPolarHBondContact CA-SG 2.82Å; C53-C68 HydrophobicContact CB-CB 3.72Å; C53-C68 WeakPolarHBondContact CB-SG 3.21Å; C53-C68 VanDerWaalsContact SG-CA 3.56Å; C53-C68 WeakPolarHBondContact SG-CB 3.28Å; C53-C68 CovalentContact SG-SG 2.04Å; C53-C68 PolarHBondContact SG-SG 3.33Å; R58-C68 HydrophobicContact CB-CB 3.88Å; R58-C68 HydrophobicContact CG-CB 4.43Å | ||
| 69 | G | 88.8 | Confident | 86 | Confident | 26 Ų | 26 | 78.5 Ų | 78.5 | 27% | 0.268 | 45% | 0.451 | S | S | . | . | trans | -70 | -172.3 | 179.5 | 0 | 0 | 0 | 0 | 0 | 113.8 | R58 H59 | R58-G69 WeakPolarHBondContact CB-O 3.49Å; R58-G69 WeakPolarHBondContact CD-O 3.24Å; R58-G69 WeakPolarHBondContact CG-O 3.35Å; R58-G69 PolarHBondContact NH1-O 3.4Å; H59-G69 PolarHBondContact O-N 3.17Å | ||
| 70 | S | 90.8 | Very high | 85.5 | Confident | 74 Ų | 74 | 80.3 Ų | 80.3 | 52% | 0.517 | 46% | 0.46 | S | S | . | . | S | Bend | trans | -56.6 | 165.3 | 171.7 | 51.6 | 0 | 0 | 0 | 0 | 112.6 | R58 H59 | R58-S70 CarbonylContact C-O 3.6Å; R58-S70 WeakPolarHBondContact CA-O 3.13Å; H59-S70 PolarHBondContact CD2-O 2.95Å; H59-S70 PolarHBondContact N-O 3.41Å |
| 71 | C | 92.6 | Very high | 85.1 | Confident | 18 Ų | 18 | 76.6 Ų | 76.6 | 12% | 0.122 | 45% | 0.453 | C | S | . | . | B | Isolated β-bridge | trans | -58.9 | 138.8 | 172.6 | -60.1 | 0 | 0 | 0 | 0 | 112.5 | R57 F75 E77 C83 | R57-C71 WeakPolarHBondContact O-CA 3.49Å; C71-F75 HydrophobicContact CB-CB 4.08Å; C71-E77 WeakPolarHBondContact SG-CG 3.47Å; C71-C83 WeakPolarHBondContact CA-SG 3.17Å; C71-C83 HydrophobicContact CB-CB 3.77Å; C71-C83 WeakPolarHBondContact CB-SG 3.16Å; C71-C83 WeakPolarHBondContact SG-CA 3.29Å; C71-C83 WeakPolarHBondContact SG-CB 3.38Å; C71-C83 CovalentContact SG-SG 2.03Å; C71-C83 PolarHBondContact SG-SG 3.46Å |
| 72 | L | 90.4 | Very high | 85 | Confident | 59 Ų | 59 | 82.7 Ų | 82.7 | 31% | 0.309 | 47% | 0.474 | S | S | . | . | P | Polyproline II helix | trans | -62.8 | 140.2 | 167.1 | -64.1 | 166.4 | 0 | 0 | 0 | 109.1 | R57 F75 | R57-L72 PolarHBondContact O-N 3.39Å; L72-F75 WeakPolarHBondContact O-CA 3.44Å; L72-F75 VanDerWaalsContact O-CB 3.3Å; L72-F75 WeakPolarHBondContact O-CB 3.43Å; L72-F75 WeakPolarHBondContact O-CD2 3.12Å; L72-F75 PolarHBondContact O-N 3.3Å |
| 73 | S | 85.1 | Confident | 85.3 | Confident | 112 Ų | 112 | 76.4 Ų | 76.4 | 78% | 0.783 | 45% | 0.446 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -61 | 137.7 | 165.7 | -173.2 | 0 | 0 | 0 | 0 | 109.6 | ||
| 74 | P | 85.3 | Confident | 85.6 | Confident | 69 Ų | 69 | 75.1 Ų | 75.1 | 45% | 0.448 | 44% | 0.436 | S | S | . | . | T | Hydrogen-bonded Turn | cis | -95.5 | 24.8 | 8.7 | 38.2 | -37.7 | 0 | 0 | 0 | 115.3 | L85 K86 | P74-L85 HydrophobicContact CB-CD1 4.14Å; P74-L85 HydrophobicContact CG-CD1 3.61Å; P74-K86 WeakPolarHBondContact O-CB 3.5Å; P74-K86 PolarHBondContact O-N 2.96Å; P74-K86 VanDerWaalsContact O-N 3.12Å |
| 75 | F | 86.9 | Confident | 86.3 | Confident | 45 Ų | 45 | 71.5 Ų | 71.5 | 20% | 0.197 | 41% | 0.409 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -87.3 | 155.6 | -179 | -52.4 | -75.4 | 0 | 0 | 0 | 112.6 | R57 C71 L72 C83 V84 L85 | R57-F75 HydrophobicContact CB-CD2 3.92Å; R57-F75 HydrophobicContact CB-CE2 4.36Å; R57-F75 HydrophobicContact CB-CG 4.24Å; R57-F75 HydrophobicContact CG-CD2 4.49Å; R57-F75 VanDerWaalsContact NH1-CZ 3.3Å; C71-F75 HydrophobicContact CB-CB 4.08Å; L72-F75 WeakPolarHBondContact O-CA 3.44Å; L72-F75 VanDerWaalsContact O-CB 3.3Å; L72-F75 WeakPolarHBondContact O-CB 3.43Å; L72-F75 WeakPolarHBondContact O-CD2 3.12Å; L72-F75 PolarHBondContact O-N 3.3Å; F75-C83 HydrophobicContact CB-CB 3.93Å; F75-V84 CarbonylContact C-O 3.53Å; F75-V84 WeakPolarHBondContact CA-O 2.97Å; F75-V84 WeakPolarHBondContact CB-O 3.25Å; F75-L85 HydrophobicContact CD1-CB 4.07Å; F75-L85 HydrophobicContact CD1-CD1 4.07Å; F75-L85 HydrophobicContact CE1-CB 3.98Å; F75-L85 HydrophobicContact CE1-CD1 3.72Å; F75-L85 HydrophobicContact CE1-CG 4.32Å; F75-L85 HydrophobicContact CZ-CD1 4.38Å |
| 76 | R | 87 | Confident | 86.4 | Confident | 176 Ų | 176 | 73.7 Ų | 73.7 | 66% | 0.664 | 41% | 0.412 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -134.9 | 150.2 | 175.7 | -175.9 | 179.1 | -179.9 | 167.1 | 4.6 | 108.9 | C83 V84 | R76-C83 CarbonylContact O-C 3.53Å; R76-V84 PolarHBondContact N-O 3.48Å; R76-V84 WeakPolarHBondContact O-CG2 3.35Å; R76-V84 PolarHBondContact O-N 3.39Å |
| 77 | E | 90.3 | Very high | 85.7 | Confident | 98 Ų | 98 | 75 Ų | 75 | 46% | 0.458 | 42% | 0.418 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -67.4 | 130.4 | 173.1 | -60.9 | 178.4 | 149.5 | 0 | 0 | 110.8 | R58 C71 R82 | R58-E77 IonicContact CZ-OE1 3.21Å; R58-E77 IonicContact NH1-OE1 2.73Å; R58-E77 PolarHBondContact NH1-OE1 3.43Å; R58-E77 IonicContact NH2-OE1 2.67Å; R58-E77 PolarHBondContact NH2-OE1 3.2Å; C71-E77 WeakPolarHBondContact SG-CG 3.47Å; E77-R82 CarbonylContact C-O 3.57Å; E77-R82 WeakPolarHBondContact CA-O 3.48Å |
| 78 | D | 84.8 | Confident | 84.4 | Confident | 33 Ų | 33 | 72.7 Ų | 72.7 | 18% | 0.176 | 41% | 0.408 | C | S | . | . | trans | -80.2 | -179.3 | 164.6 | 63.6 | 12.9 | 0 | 0 | 0 | 111.5 | E80 G81 R82 V84 | D78-E80 WeakPolarHBondContact CB-OE2 3.3Å; D78-E80 PolarHBondContact O-N 3.12Å; D78-E80 VanDerWaalsContact O-N 3.17Å; D78-E80 VanDerWaalsContact OD1-C 3.28Å; D78-E80 WeakPolarHBondContact OD1-CA 3.4Å; D78-E80 PolarHBondContact OD1-N 3.2Å; D78-E80 VanDerWaalsContact OD1-N 3.08Å; D78-G81 PolarHBondContact O-N 3.03Å; D78-G81 PolarHBondContact OD1-N 2.72Å; D78-R82 PolarHBondContact N-O 2.89Å; D78-R82 PolarHBondContact OD1-N 2.88Å; D78-R82 IonicContact OD1-NE 2.95Å; D78-R82 IonicContact OD2-CZ 3.73Å; D78-R82 IonicContact OD2-NE 2.75Å; D78-R82 PolarHBondContact OD2-NE 3.06Å; D78-R82 IonicContact OD2-NH2 3.03Å; D78-R82 PolarHBondContact OD2-NH2 3.13Å; D78-V84 HydrophobicContact CB-CG1 4.08Å; D78-V84 HydrophobicContact CB-CG2 3.93Å; D78-V84 WeakPolarHBondContact OD2-CG1 3.26Å | ||
| 79 | G | 83.8 | Confident | 82.5 | Confident | 80 Ų | 80 | 78 Ų | 78 | 83% | 0.825 | 43% | 0.43 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -65.5 | -14.2 | 178.3 | 0 | 0 | 0 | 0 | 0 | 113.5 | ||
| 80 | E | 81.4 | Confident | 80.5 | Confident | 129 Ų | 129 | 84.8 Ų | 84.8 | 60% | 0.603 | 45% | 0.452 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -101.9 | 5.8 | -178.3 | -55.5 | 72.4 | -146.6 | 0 | 0 | 112.3 | D78 R82 | D78-E80 WeakPolarHBondContact CB-OE2 3.3Å; D78-E80 PolarHBondContact O-N 3.12Å; D78-E80 VanDerWaalsContact O-N 3.17Å; D78-E80 VanDerWaalsContact OD1-C 3.28Å; D78-E80 WeakPolarHBondContact OD1-CA 3.4Å; D78-E80 PolarHBondContact OD1-N 3.2Å; D78-E80 VanDerWaalsContact OD1-N 3.08Å; E80-R82 IonicContact OE2-CZ 2.78Å; E80-R82 IonicContact OE2-NH2 3.21Å; E80-R82 PolarHBondContact OE2-NH2 2.91Å |
| 81 | G | 83.3 | Confident | 78.3 | Confident | 39 Ų | 39 | 89.4 Ų | 89.4 | 40% | 0.402 | 47% | 0.471 | S | S | . | . | S | Bend | trans | 77.8 | 15.9 | 176.4 | 0 | 0 | 0 | 0 | 0 | 115.3 | R58 D78 | R58-G81 PolarHBondContact NH2-O 3.22Å; D78-G81 PolarHBondContact O-N 3.03Å; D78-G81 PolarHBondContact OD1-N 2.72Å |
| 82 | R | 87.6 | Confident | 76.4 | Confident | 145 Ų | 145 | 92.6 Ų | 92.6 | 55% | 0.547 | 51% | 0.507 | S | S | . | . | trans | -100.1 | 146.2 | -179.9 | -51.2 | 171.1 | -63.5 | -142.9 | -7.8 | 111 | E77 D78 E80 V84 | E77-R82 CarbonylContact C-O 3.57Å; E77-R82 WeakPolarHBondContact CA-O 3.48Å; D78-R82 PolarHBondContact N-O 2.89Å; D78-R82 PolarHBondContact OD1-N 2.88Å; D78-R82 IonicContact OD1-NE 2.95Å; D78-R82 IonicContact OD2-CZ 3.73Å; D78-R82 IonicContact OD2-NE 2.75Å; D78-R82 PolarHBondContact OD2-NE 3.06Å; D78-R82 IonicContact OD2-NH2 3.03Å; D78-R82 PolarHBondContact OD2-NH2 3.13Å; E80-R82 IonicContact OE2-CZ 2.78Å; E80-R82 IonicContact OE2-NH2 3.21Å; E80-R82 PolarHBondContact OE2-NH2 2.91Å; R82-V84 PolarHBondContact O-N 3.08Å; R82-V84 VanDerWaalsContact O-N 3.11Å | ||
| 83 | C | 90.3 | Very high | 74 | Confident | 13 Ų | 13 | 97 Ų | 97 | 9% | 0.088 | 52% | 0.524 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -82.6 | 87.8 | -179.7 | -65.7 | 0 | 0 | 0 | 0 | 112.4 | Q56 R57 R58 C71 F75 R76 | Q56-C83 WeakPolarHBondContact O-CB 3.34Å; R57-C83 HydrophobicContact CB-CB 3.86Å; R58-C83 VanDerWaalsContact CG-SG 3.52Å; C71-C83 WeakPolarHBondContact CA-SG 3.17Å; C71-C83 HydrophobicContact CB-CB 3.77Å; C71-C83 WeakPolarHBondContact CB-SG 3.16Å; C71-C83 WeakPolarHBondContact SG-CA 3.29Å; C71-C83 WeakPolarHBondContact SG-CB 3.38Å; C71-C83 CovalentContact SG-SG 2.03Å; C71-C83 PolarHBondContact SG-SG 3.46Å; F75-C83 HydrophobicContact CB-CB 3.93Å; R76-C83 CarbonylContact O-C 3.53Å |
| 84 | V | 89.3 | Confident | 72.1 | Confident | 66 Ų | 66 | 95.8 Ų | 95.8 | 40% | 0.4 | 51% | 0.511 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -88.1 | 157 | 176.9 | -61 | 0 | 0 | 0 | 0 | 111.9 | F75 R76 D78 R82 | F75-V84 CarbonylContact C-O 3.53Å; F75-V84 WeakPolarHBondContact CA-O 2.97Å; F75-V84 WeakPolarHBondContact CB-O 3.25Å; R76-V84 PolarHBondContact N-O 3.48Å; R76-V84 WeakPolarHBondContact O-CG2 3.35Å; R76-V84 PolarHBondContact O-N 3.39Å; D78-V84 HydrophobicContact CB-CG1 4.08Å; D78-V84 HydrophobicContact CB-CG2 3.93Å; D78-V84 WeakPolarHBondContact OD2-CG1 3.26Å; R82-V84 PolarHBondContact O-N 3.08Å; R82-V84 VanDerWaalsContact O-N 3.11Å |
| 85 | L | 86.3 | Confident | 70.3 | Confident | 65 Ų | 65 | 98.6 Ų | 98.6 | 34% | 0.34 | 51% | 0.513 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -73.2 | 129.6 | -175.9 | -174 | 49.9 | 0 | 0 | 0 | 111.1 | P74 F75 T87 F97 | P74-L85 HydrophobicContact CB-CD1 4.14Å; P74-L85 HydrophobicContact CG-CD1 3.61Å; F75-L85 HydrophobicContact CD1-CB 4.07Å; F75-L85 HydrophobicContact CD1-CD1 4.07Å; F75-L85 HydrophobicContact CE1-CB 3.98Å; F75-L85 HydrophobicContact CE1-CD1 3.72Å; F75-L85 HydrophobicContact CE1-CG 4.32Å; F75-L85 HydrophobicContact CZ-CD1 4.38Å; L85-T87 PolarHBondContact O-N 3.39Å; L85-F97 HydrophobicContact CD2-CB 3.74Å |
| 86 | K | 75.5 | Confident | 68.5 | Low | 96 Ų | 96 | 101.6 Ų | 101.6 | 42% | 0.417 | 53% | 0.53 | S | S | . | . | trans | -73.7 | 93.7 | -175.1 | -174.4 | -173.6 | 175.9 | -160.4 | 0 | 111.7 | P74 H88 | P74-K86 WeakPolarHBondContact O-CB 3.5Å; P74-K86 PolarHBondContact O-N 2.96Å; P74-K86 VanDerWaalsContact O-N 3.12Å; K86-H88 WeakPolarHBondContact CD-NE2 3.31Å; K86-H88 WeakPolarHBondContact CE-NE2 3.15Å; K86-H88 PolarHBondContact NZ-NE2 2.86Å; K86-H88 PolarHBondContact O-CD2 3.12Å; K86-H88 PolarHBondContact O-N 3.45Å | ||
| 87 | T | 65.3 | Low | 66.7 | Low | 63 Ų | 63 | 99.6 Ų | 99.6 | 39% | 0.387 | 53% | 0.526 | S | S | . | . | trans | -60.4 | 106 | 174.2 | -24 | 0 | 0 | 0 | 0 | 110.6 | L85 H89 V94 | L85-T87 PolarHBondContact O-N 3.39Å; T87-H89 PolarHBondContact O-N 3.34Å; T87-H89 VanDerWaalsContact O-N 3.08Å; T87-V94 HydrophobicContact CG2-CG1 3.71Å | ||
| 88 | H | 58 | Low | 64.7 | Low | 98 Ų | 98 | 100.8 Ų | 100.8 | 45% | 0.454 | 54% | 0.54 | S | S | . | . | trans | -83.4 | 85.4 | -177.9 | -100.3 | -91.2 | 0 | 0 | 0 | 110.7 | K86 K90 | K86-H88 WeakPolarHBondContact CD-NE2 3.31Å; K86-H88 WeakPolarHBondContact CE-NE2 3.15Å; K86-H88 PolarHBondContact NZ-NE2 2.86Å; K86-H88 PolarHBondContact O-CD2 3.12Å; K86-H88 PolarHBondContact O-N 3.45Å; H88-K90 PolarHBondContact O-N 2.84Å | ||
| 89 | H | 49.9 | Very low | 62.7 | Low | 135 Ų | 135 | 102.6 Ų | 102.6 | 63% | 0.625 | 55% | 0.55 | S | S | * | . | trans | -64.7 | 91.5 | 171.4 | -66.2 | -85.1 | 0 | 0 | 0 | 111.2 | T87 | T87-H89 PolarHBondContact O-N 3.34Å; T87-H89 VanDerWaalsContact O-N 3.08Å | ||
| 90 | K | 47.5 | Very low | 61.3 | Low | 168 Ų | 168 | 105 Ų | 105 | 73% | 0.73 | 54% | 0.543 | S | S | * | . | B | Isolated β-bridge | trans | -99.5 | 118.7 | 160.1 | -77 | -175.5 | 173.8 | -179.6 | 0 | 108.5 | H88 G92 | H88-K90 PolarHBondContact O-N 2.84Å; K90-G92 PolarHBondContact O-N 3.46Å |
| 91 | N | 44.9 | Very low | 59.8 | Low | 171 Ų | 171 | 104.4 Ų | 104.4 | 91% | 0.914 | 54% | 0.544 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 39.7 | 65.1 | 167 | -61.6 | 24.6 | 0 | 0 | 0 | 115.7 | K93 | N91-K93 PolarHBondContact O-N 3.4Š|
| 92 | G | 50.9 | Low | 58.6 | Low | 85 Ų | 85 | 105.6 Ų | 105.6 | 88% | 0.876 | 54% | 0.539 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 85.1 | -12 | 159.9 | 0 | 0 | 0 | 0 | 0 | 117.9 | K90 | K90-G92 PolarHBondContact O-N 3.46Š|
| 93 | K | 41.6 | Very low | 57.3 | Low | 152 Ų | 152 | 103.7 Ų | 103.7 | 66% | 0.661 | 54% | 0.536 | S | S | * | . | B | Isolated β-bridge | trans | -106 | 121.9 | 172.5 | -153.9 | 178.4 | -174.8 | -170.2 | 0 | 110.7 | N91 R95 | N91-K93 PolarHBondContact O-N 3.4Å; K93-R95 PolarHBondContact O-N 3.17Å; K93-R95 VanDerWaalsContact O-N 3.15Å |
| 94 | V | 45.3 | Very low | 56 | Low | 85 Ų | 85 | 107 Ų | 107 | 52% | 0.515 | 55% | 0.553 | S | S | . | * | trans | -81.5 | 91.1 | 177.1 | -170 | 0 | 0 | 0 | 0 | 109 | T87 I96 | T87-V94 HydrophobicContact CG2-CG1 3.71Å; V94-I96 HydrophobicContact CG1-CG1 4.12Å; V94-I96 PolarHBondContact O-N 3.04Å; V94-I96 VanDerWaalsContact O-N 3.1Å | ||
| 95 | R | 47.3 | Very low | 54.5 | Low | 128 Ų | 128 | 109.9 Ų | 109.9 | 48% | 0.483 | 57% | 0.565 | S | S | . | * | trans | -76.4 | 92.9 | 165 | -76.4 | -167.4 | 176.5 | 172.3 | 6.6 | 109.3 | K93 E102 | K93-R95 PolarHBondContact O-N 3.17Å; K93-R95 VanDerWaalsContact O-N 3.15Å; R95-E102 VanDerWaalsContact CD-OE2 3.27Å; R95-E102 WeakPolarHBondContact CD-OE2 3.45Å; R95-E102 IonicContact CZ-OE1 2.89Å; R95-E102 IonicContact CZ-OE2 2.79Å; R95-E102 IonicContact NE-OE1 2.99Å; R95-E102 PolarHBondContact NE-OE1 3.4Å; R95-E102 IonicContact NE-OE2 2.91Å; R95-E102 PolarHBondContact NE-OE2 2.81Å; R95-E102 IonicContact NH1-OE1 3.65Å; R95-E102 IonicContact NH1-OE2 2.82Å; R95-E102 PolarHBondContact NH1-OE2 3.38Å; R95-E102 VanDerWaalsContact NH2-CD 3.27Å; R95-E102 IonicContact NH2-OE1 2.64Å; R95-E102 PolarHBondContact NH2-OE1 2.89Å; R95-E102 IonicContact NH2-OE2 3.34Å; R95-E102 PolarHBondContact NH2-OE2 3.47Å | ||
| 96 | I | 47.3 | Very low | 53.7 | Low | 108 Ų | 108 | 113 Ų | 113 | 55% | 0.554 | 58% | 0.577 | S | S | * | * | trans | -67.6 | 129.9 | 152.8 | -54.6 | 179.5 | 0 | 0 | 0 | 105.7 | V94 T98 | V94-I96 HydrophobicContact CG1-CG1 4.12Å; V94-I96 PolarHBondContact O-N 3.04Å; V94-I96 VanDerWaalsContact O-N 3.1Å; I96-T98 HydrophobicContact CG2-CG2 3.91Å; I96-T98 PolarHBondContact O-N 3.21Å | ||
| 97 | F | 50.3 | Low | 53.4 | Low | 135 Ų | 135 | 112.5 Ų | 112.5 | 59% | 0.592 | 58% | 0.578 | S | S | * | * | S | Bend | trans | -75.4 | 76.1 | 173.3 | -89.9 | -91.4 | 0 | 0 | 0 | 109.6 | L85 | L85-F97 HydrophobicContact CD2-CB 3.74Š|
| 98 | T | 48.4 | Very low | 53.3 | Low | 122 Ų | 122 | 115.3 Ų | 115.3 | 75% | 0.748 | 59% | 0.586 | S | S | * | * | trans | -138.1 | 47.1 | 170.1 | 50.6 | 0 | 0 | 0 | 0 | 108.2 | I96 | I96-T98 HydrophobicContact CG2-CG2 3.91Å; I96-T98 PolarHBondContact O-N 3.21Å | ||
| 99 | D | 43.3 | Very low | 53.9 | Low | 72 Ų | 72 | 113 Ų | 113 | 39% | 0.385 | 58% | 0.581 | S | S | . | * | trans | -143.7 | 95.2 | -178.4 | -164.4 | -20 | 0 | 0 | 0 | 107 | D101 | D99-D101 PolarHBondContact OD1-N 2.92Š| ||
| 100 | L | 54.6 | Low | 54.9 | Low | 129 Ų | 129 | 110.3 Ų | 110.3 | 68% | 0.675 | 57% | 0.571 | S | S | * | * | S | Bend | trans | -75.8 | -19.3 | -179.4 | -75.8 | 163.2 | 0 | 0 | 0 | 111.2 | E103 I104 | L100-E103 PolarHBondContact O-N 3.23Å; L100-I104 WeakPolarHBondContact O-CG1 3.43Å; L100-I104 PolarHBondContact O-N 3.35Å; L100-I104 VanDerWaalsContact O-N 3.08Å |
| 101 | D | 49 | Very low | 55.9 | Low | 117 Ų | 117 | 106.6 Ų | 106.6 | 63% | 0.626 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -75 | -35 | -176.6 | -57.5 | -28.1 | 0 | 0 | 0 | 110.7 | D99 E103 I104 D105 | D99-D101 PolarHBondContact OD1-N 2.92Å; D101-E103 VanDerWaalsContact C-N 3.27Å; D101-E103 PolarHBondContact O-N 2.87Å; D101-I104 PolarHBondContact O-N 3.48Å; D101-D105 PolarHBondContact O-N 2.93Å |
| 102 | E | 57.9 | Low | 56.9 | Low | 65 Ų | 65 | 104.7 Ų | 104.7 | 30% | 0.304 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -66.7 | -23.7 | 170.3 | -70.2 | -168.4 | 167.4 | 0 | 0 | 113.6 | R95 F106 | R95-E102 VanDerWaalsContact CD-OE2 3.27Å; R95-E102 WeakPolarHBondContact CD-OE2 3.45Å; R95-E102 IonicContact CZ-OE1 2.89Å; R95-E102 IonicContact CZ-OE2 2.79Å; R95-E102 IonicContact NE-OE1 2.99Å; R95-E102 PolarHBondContact NE-OE1 3.4Å; R95-E102 IonicContact NE-OE2 2.91Å; R95-E102 PolarHBondContact NE-OE2 2.81Å; R95-E102 IonicContact NH1-OE1 3.65Å; R95-E102 IonicContact NH1-OE2 2.82Å; R95-E102 PolarHBondContact NH1-OE2 3.38Å; R95-E102 VanDerWaalsContact NH2-CD 3.27Å; R95-E102 IonicContact NH2-OE1 2.64Å; R95-E102 PolarHBondContact NH2-OE1 2.89Å; R95-E102 IonicContact NH2-OE2 3.34Å; R95-E102 PolarHBondContact NH2-OE2 3.47Å; E102-F106 PolarHBondContact O-N 3.27Å |
| 103 | E | 60.9 | Low | 57.4 | Low | 104 Ų | 104 | 107.5 Ų | 107.5 | 49% | 0.486 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -82.4 | -33.1 | 174.6 | -171.1 | 163.1 | -164.3 | 0 | 0 | 111.8 | L100 D101 F106 L107 | L100-E103 PolarHBondContact O-N 3.23Å; D101-E103 VanDerWaalsContact C-N 3.27Å; D101-E103 PolarHBondContact O-N 2.87Å; E103-F106 PolarHBondContact O-N 2.86Å; E103-L107 HydrophobicContact CG-CD1 4.21Å; E103-L107 WeakPolarHBondContact O-CB 3.42Å; E103-L107 VanDerWaalsContact O-CG 3.31Å; E103-L107 WeakPolarHBondContact O-CG 3.39Å; E103-L107 PolarHBondContact O-N 2.85Å |
| 104 | I | 62.4 | Low | 58.1 | Low | 84 Ų | 84 | 105.6 Ų | 105.6 | 43% | 0.431 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -61 | -48.2 | 172.5 | -69.9 | 165.6 | 0 | 0 | 0 | 110.8 | L100 D101 F106 L107 H108 | L100-I104 WeakPolarHBondContact O-CG1 3.43Å; L100-I104 PolarHBondContact O-N 3.35Å; L100-I104 VanDerWaalsContact O-N 3.08Å; D101-I104 PolarHBondContact O-N 3.48Å; I104-F106 VanDerWaalsContact C-N 3.29Å; I104-F106 PolarHBondContact O-N 2.89Å; I104-L107 PolarHBondContact O-N 3.43Å; I104-H108 WeakPolarHBondContact O-CB 3.25Å; I104-H108 PolarHBondContact O-CD2 3.43Å; I104-H108 PolarHBondContact O-N 3.27Å |
| 105 | D | 58.5 | Low | 58.6 | Low | 125 Ų | 125 | 107 Ų | 107 | 67% | 0.668 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -61.2 | -36.6 | 176.4 | -101.8 | 4.6 | 0 | 0 | 0 | 112.4 | D101 S109 | D101-D105 PolarHBondContact O-N 2.93Å; D105-S109 WeakPolarHBondContact O-CB 3.46Å; D105-S109 PolarHBondContact O-N 3.01Å |
| 106 | F | 69.1 | Low | 59 | Low | 131 Ų | 131 | 104.2 Ų | 104.2 | 58% | 0.575 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -68.6 | -41.1 | 176.1 | -178.4 | -112.9 | 0 | 0 | 0 | 112.3 | E102 E103 I104 S109 I110 | E102-F106 PolarHBondContact O-N 3.27Å; E103-F106 PolarHBondContact O-N 2.86Å; I104-F106 VanDerWaalsContact C-N 3.29Å; I104-F106 PolarHBondContact O-N 2.89Å; F106-S109 PolarHBondContact O-N 3.02Å; F106-I110 HydrophobicContact CD1-CD1 3.96Å; F106-I110 HydrophobicContact CE1-CD1 3.49Å; F106-I110 VanDerWaalsContact CE1-CD1 3.49Å; F106-I110 HydrophobicContact CE2-CD1 4.16Å; F106-I110 HydrophobicContact CG-CD1 4.48Å; F106-I110 HydrophobicContact CZ-CD1 3.62Å; F106-I110 WeakPolarHBondContact O-CG1 3.32Å; F106-I110 PolarHBondContact O-N 3.27Å |
| 107 | L | 69.3 | Low | 59.2 | Low | 86 Ų | 86 | 101.9 Ų | 101.9 | 45% | 0.45 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -65.2 | -44.7 | 174.6 | -73 | 166.4 | 0 | 0 | 0 | 111.3 | E103 I104 S109 I110 I111 | E103-L107 HydrophobicContact CG-CD1 4.21Å; E103-L107 WeakPolarHBondContact O-CB 3.42Å; E103-L107 VanDerWaalsContact O-CG 3.31Å; E103-L107 WeakPolarHBondContact O-CG 3.39Å; E103-L107 PolarHBondContact O-N 2.85Å; I104-L107 PolarHBondContact O-N 3.43Å; L107-S109 PolarHBondContact O-N 2.98Å; L107-I110 PolarHBondContact O-N 3.19Å; L107-I110 VanDerWaalsContact O-N 3.16Å; L107-I111 VanDerWaalsContact O-CG1 3.28Å; L107-I111 WeakPolarHBondContact O-CG1 3.5Å; L107-I111 PolarHBondContact O-N 2.85Å |
| 108 | H | 63.4 | Low | 59.2 | Low | 121 Ų | 121 | 101.5 Ų | 101.5 | 56% | 0.56 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -59.2 | -44.5 | 173.2 | -88.7 | -105.1 | 0 | 0 | 0 | 111.8 | I104 I110 I111 E112 | I104-H108 WeakPolarHBondContact O-CB 3.25Å; I104-H108 PolarHBondContact O-CD2 3.43Å; I104-H108 PolarHBondContact O-N 3.27Å; H108-I110 VanDerWaalsContact C-N 3.28Å; H108-I110 PolarHBondContact O-N 2.83Å; H108-I111 PolarHBondContact O-N 2.85Å; H108-E112 WeakPolarHBondContact O-CB 3.26Å; H108-E112 PolarHBondContact O-N 3.34Å |
| 109 | S | 70.9 | Confident | 59.3 | Low | 50 Ų | 50 | 101.6 Ų | 101.6 | 35% | 0.35 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -63.9 | -29.9 | 176.1 | -168.8 | 0 | 0 | 0 | 0 | 113.4 | D105 F106 L107 K113 | D105-S109 WeakPolarHBondContact O-CB 3.46Å; D105-S109 PolarHBondContact O-N 3.01Å; F106-S109 PolarHBondContact O-N 3.02Å; L107-S109 PolarHBondContact O-N 2.98Å; S109-K113 VanDerWaalsContact O-CB 3.3Å; S109-K113 WeakPolarHBondContact O-CB 3.41Å; S109-K113 WeakPolarHBondContact O-CG 3.34Å; S109-K113 PolarHBondContact O-N 2.87Å; S109-K113 VanDerWaalsContact O-N 3.13Å |
| 110 | I | 69.9 | Low | 59.3 | Low | 79 Ų | 79 | 105.5 Ų | 105.5 | 41% | 0.405 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -73.8 | -43 | 172.7 | -74.8 | 172.3 | 0 | 0 | 0 | 111.4 | F106 L107 H108 K113 Q114 | F106-I110 HydrophobicContact CD1-CD1 3.96Å; F106-I110 HydrophobicContact CE1-CD1 3.49Å; F106-I110 VanDerWaalsContact CE1-CD1 3.49Å; F106-I110 HydrophobicContact CE2-CD1 4.16Å; F106-I110 HydrophobicContact CG-CD1 4.48Å; F106-I110 HydrophobicContact CZ-CD1 3.62Å; F106-I110 WeakPolarHBondContact O-CG1 3.32Å; F106-I110 PolarHBondContact O-N 3.27Å; L107-I110 PolarHBondContact O-N 3.19Å; L107-I110 VanDerWaalsContact O-N 3.16Å; H108-I110 VanDerWaalsContact C-N 3.28Å; H108-I110 PolarHBondContact O-N 2.83Å; I110-K113 PolarHBondContact O-N 2.93Å; I110-Q114 WeakPolarHBondContact O-CB 3.38Å; I110-Q114 PolarHBondContact O-N 2.67Å |
| 111 | I | 68.2 | Low | 58.6 | Low | 90 Ų | 90 | 104.8 Ų | 104.8 | 46% | 0.462 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -61.8 | -51.1 | 177.5 | -68.3 | 162.3 | 0 | 0 | 0 | 109.8 | L107 H108 K113 Q114 E115 | L107-I111 VanDerWaalsContact O-CG1 3.28Å; L107-I111 WeakPolarHBondContact O-CG1 3.5Å; L107-I111 PolarHBondContact O-N 2.85Å; H108-I111 PolarHBondContact O-N 2.85Å; I111-K113 VanDerWaalsContact C-N 3.33Å; I111-K113 PolarHBondContact O-N 3.36Å; I111-Q114 WeakPolarHBondContact O-CA 3.28Å; I111-Q114 WeakPolarHBondContact O-CB 3.28Å; I111-Q114 PolarHBondContact O-N 3.17Å; I111-E115 PolarHBondContact O-N 3.41Å |
| 112 | E | 65.8 | Low | 58.1 | Low | 130 Ų | 130 | 105.1 Ų | 105.1 | 61% | 0.607 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -58.6 | -42 | 176.7 | -171.5 | -176 | -150 | 0 | 0 | 111.6 | H108 Q114 E115 V116 | H108-E112 WeakPolarHBondContact O-CB 3.26Å; H108-E112 PolarHBondContact O-N 3.34Å; E112-Q114 VanDerWaalsContact C-N 3.32Å; E112-Q114 PolarHBondContact O-N 3.05Å; E112-E115 PolarHBondContact O-N 3.45Å; E112-V116 WeakPolarHBondContact O-CB 3.23Å; E112-V116 VanDerWaalsContact O-CG2 3.31Å; E112-V116 WeakPolarHBondContact O-CG2 3.4Å; E112-V116 PolarHBondContact O-N 3.46Å |
| 113 | K | 62.2 | Low | 57.1 | Low | 145 Ų | 145 | 110.6 Ų | 110.6 | 63% | 0.63 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -63 | -34.7 | 171.6 | -91.4 | 177.4 | 174.3 | 166.2 | 0 | 113.6 | S109 I110 I111 S117 | S109-K113 VanDerWaalsContact O-CB 3.3Å; S109-K113 WeakPolarHBondContact O-CB 3.41Å; S109-K113 WeakPolarHBondContact O-CG 3.34Å; S109-K113 PolarHBondContact O-N 2.87Å; S109-K113 VanDerWaalsContact O-N 3.13Å; I110-K113 PolarHBondContact O-N 2.93Å; I111-K113 VanDerWaalsContact C-N 3.33Å; I111-K113 PolarHBondContact O-N 3.36Å; K113-S117 WeakPolarHBondContact O-CB 3.44Å; K113-S117 PolarHBondContact O-N 3.33Å; K113-S117 PolarHBondContact O-OG 2.95Å |
| 114 | Q | 56.9 | Low | 56 | Low | 111 Ų | 111 | 112.7 Ų | 112.7 | 52% | 0.519 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -73.5 | -32.9 | 179 | -160.1 | -175.9 | 69 | 0 | 0 | 111.4 | I110 I111 E112 S117 K118 | I110-Q114 WeakPolarHBondContact O-CB 3.38Å; I110-Q114 PolarHBondContact O-N 2.67Å; I111-Q114 WeakPolarHBondContact O-CA 3.28Å; I111-Q114 WeakPolarHBondContact O-CB 3.28Å; I111-Q114 PolarHBondContact O-N 3.17Å; E112-Q114 VanDerWaalsContact C-N 3.32Å; E112-Q114 PolarHBondContact O-N 3.05Å; Q114-S117 PolarHBondContact O-OG 2.8Å; Q114-K118 WeakPolarHBondContact O-CG 3.46Å; Q114-K118 PolarHBondContact O-N 2.86Å |
| 115 | E | 55.8 | Low | 54.5 | Low | 115 Ų | 115 | 117.6 Ų | 117.6 | 54% | 0.537 | 59% | 0.589 | S | S | . | * | H | α-helix | trans | -70.6 | -46.9 | 171.3 | -66.7 | -172.2 | 169 | 0 | 0 | 111.6 | I111 E112 S117 K118 I119 | I111-E115 PolarHBondContact O-N 3.41Å; E112-E115 PolarHBondContact O-N 3.45Å; E115-S117 PolarHBondContact O-N 3.18Å; E115-K118 PolarHBondContact O-N 3.47Å; E115-K118 VanDerWaalsContact O-N 3.17Å; E115-I119 WeakPolarHBondContact O-CB 3.41Å; E115-I119 WeakPolarHBondContact O-CD1 3.21Å; E115-I119 VanDerWaalsContact O-CG1 3.26Å; E115-I119 WeakPolarHBondContact O-CG1 3.41Å; E115-I119 PolarHBondContact O-N 2.97Å |
| 116 | V | 54.9 | Low | 53.2 | Low | 70 Ų | 70 | 117.6 Ų | 117.6 | 42% | 0.424 | 60% | 0.595 | S | S | . | * | H | α-helix | trans | -61.1 | -29.4 | 174.2 | 171.6 | 0 | 0 | 0 | 0 | 112.1 | E112 K120 | E112-V116 WeakPolarHBondContact O-CB 3.23Å; E112-V116 VanDerWaalsContact O-CG2 3.31Å; E112-V116 WeakPolarHBondContact O-CG2 3.4Å; E112-V116 PolarHBondContact O-N 3.46Å; V116-K120 HydrophobicContact CG1-CD 4.39Å; V116-K120 WeakPolarHBondContact O-CB 3.31Å; V116-K120 WeakPolarHBondContact O-CG 3.36Å; V116-K120 PolarHBondContact O-N 2.95Å |
| 117 | S | 51.8 | Low | 51.4 | Low | 59 Ų | 59 | 120.5 Ų | 120.5 | 41% | 0.413 | 61% | 0.611 | S | S | . | * | H | α-helix | trans | -73.6 | -48 | 172.4 | 78 | 0 | 0 | 0 | 0 | 111.8 | K113 Q114 E115 I119 K120 T121 | K113-S117 WeakPolarHBondContact O-CB 3.44Å; K113-S117 PolarHBondContact O-N 3.33Å; K113-S117 PolarHBondContact O-OG 2.95Å; Q114-S117 PolarHBondContact O-OG 2.8Å; E115-S117 PolarHBondContact O-N 3.18Å; S117-I119 VanDerWaalsContact C-N 3.33Å; S117-I119 PolarHBondContact O-N 2.93Å; S117-K120 PolarHBondContact O-N 3.48Å; S117-K120 VanDerWaalsContact O-N 3.1Å; S117-T121 PolarHBondContact O-N 3.35Å; S117-T121 VanDerWaalsContact O-N 3.08Å; S117-T121 PolarHBondContact O-OG1 3.45Å |
| 118 | K | 48.8 | Very low | 49.3 | Very low | 126 Ų | 126 | 125.1 Ų | 125.1 | 55% | 0.548 | 63% | 0.627 | S | S | . | * | H | α-helix | trans | -54 | -47.7 | 174.2 | -76.9 | 171.7 | 179.5 | 170.1 | 0 | 111.7 | Q114 E115 K120 T121 T122 | Q114-K118 WeakPolarHBondContact O-CG 3.46Å; Q114-K118 PolarHBondContact O-N 2.86Å; E115-K118 PolarHBondContact O-N 3.47Å; E115-K118 VanDerWaalsContact O-N 3.17Å; K118-K120 VanDerWaalsContact C-N 3.29Å; K118-K120 PolarHBondContact O-N 2.95Å; K118-T121 PolarHBondContact O-N 3.3Å; K118-T122 PolarHBondContact O-OG1 3.33Å |
| 119 | I | 52 | Low | 47.5 | Very low | 124 Ų | 124 | 124.3 Ų | 124.3 | 64% | 0.636 | 63% | 0.631 | S | S | * | * | H | α-helix | trans | -64.5 | -30.5 | 179.8 | -66.7 | 164 | 0 | 0 | 0 | 112.1 | E115 S117 | E115-I119 WeakPolarHBondContact O-CB 3.41Å; E115-I119 WeakPolarHBondContact O-CD1 3.21Å; E115-I119 VanDerWaalsContact O-CG1 3.26Å; E115-I119 WeakPolarHBondContact O-CG1 3.41Å; E115-I119 PolarHBondContact O-N 2.97Å; S117-I119 VanDerWaalsContact C-N 3.33Å; S117-I119 PolarHBondContact O-N 2.93Å |
| 120 | K | 43.4 | Very low | 45.4 | Very low | 155 Ų | 155 | 128.5 Ų | 128.5 | 67% | 0.674 | 65% | 0.65 | S | S | * | * | H | α-helix | trans | -76.9 | -33 | 175.8 | -81.4 | 177.9 | 176.6 | 176.8 | 0 | 113.4 | V116 S117 K118 T122 | V116-K120 HydrophobicContact CG1-CD 4.39Å; V116-K120 WeakPolarHBondContact O-CB 3.31Å; V116-K120 WeakPolarHBondContact O-CG 3.36Å; V116-K120 PolarHBondContact O-N 2.95Å; S117-K120 PolarHBondContact O-N 3.48Å; S117-K120 VanDerWaalsContact O-N 3.1Å; K118-K120 VanDerWaalsContact C-N 3.29Å; K118-K120 PolarHBondContact O-N 2.95Å; K120-T122 VanDerWaalsContact C-N 3.33Å; K120-T122 PolarHBondContact O-N 3.46Å |
| 121 | T | 39 | Very low | 43.5 | Very low | 114 Ų | 114 | 129 Ų | 129 | 70% | 0.699 | 66% | 0.66 | S | S | * | * | H | α-helix | trans | -68 | -32.4 | -179.9 | -43.7 | 0 | 0 | 0 | 0 | 112.2 | S117 K118 K123 | S117-T121 PolarHBondContact O-N 3.35Å; S117-T121 VanDerWaalsContact O-N 3.08Å; S117-T121 PolarHBondContact O-OG1 3.45Å; K118-T121 PolarHBondContact O-N 3.3Å; T121-K123 PolarHBondContact O-N 3.37Å |
| 122 | T | 38.1 | Very low | 41.8 | Very low | 123 Ų | 123 | 132.4 Ų | 132.4 | 76% | 0.755 | 68% | 0.678 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.2 | -3.6 | -175 | -18.4 | 0 | 0 | 0 | 0 | 115.4 | K118 K120 | K118-T122 PolarHBondContact O-OG1 3.33Å; K120-T122 VanDerWaalsContact C-N 3.33Å; K120-T122 PolarHBondContact O-N 3.46Å |
| 123 | K | 37 | Very low | 39.9 | Very low | 180 Ų | 180 | 131.5 Ų | 131.5 | 78% | 0.783 | 69% | 0.686 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -97.1 | 1.6 | -170.8 | -150.8 | 170.5 | -178.3 | 175.6 | 0 | 115.7 | T121 | T121-K123 PolarHBondContact O-N 3.37Š|
| 124 | N | 39.2 | Very low | 38.3 | Very low | 148 Ų | 148 | 129.6 Ų | 129.6 | 79% | 0.791 | 69% | 0.691 | S | S | * | * | S | Bend | trans | -139.6 | 68.3 | -172.6 | -75.4 | -45.6 | 0 | 0 | 0 | 115.5 | ||
| 125 | Q | 29.4 | Very low | 37.6 | Very low | 188 Ų | 188 | 129.9 Ų | 129.9 | 88% | 0.879 | 70% | 0.702 | S | S | * | * | trans | -156.3 | 148.9 | 141.2 | -151.1 | 157.9 | 19.5 | 0 | 0 | 112.4 | ||||
| 126 | P | 31.8 | Very low | 36.2 | Very low | 124 Ų | 124 | 128.2 Ų | 128.2 | 81% | 0.805 | 71% | 0.708 | S | S | * | * | trans | -78.8 | 171.9 | -176.7 | -18.9 | 34.9 | 0 | 0 | 0 | 117.1 | ||||
| 127 | Q | 31.9 | Very low | 34.9 | Very low | 193 Ų | 193 | 131.7 Ų | 131.7 | 90% | 0.902 | 72% | 0.724 | S | S | * | * | trans | -60.5 | 157.6 | -178.6 | -55.6 | 162.9 | -20.6 | 0 | 0 | 115.5 | ||||
| 128 | K | 25 | Very low | 33.9 | Very low | 183 Ų | 183 | 135.8 Ų | 135.8 | 80% | 0.796 | 74% | 0.741 | S | S | * | * | -174.1 | 115.3 | 129.1 | 175 | 152.9 | -175.2 | -179 | 0 | 114.2 | |||||
| 129 | T | 25 | Very low | 33.1 | Very low | 103 Ų | 103 | 137.6 Ų | 137.6 | 63% | 0.632 | 75% | 0.751 | S | S | * | * | trans | 52.4 | 146.6 | 153.6 | 54.6 | 0 | 0 | 0 | 0 | 120.8 | ||||
| 130 | D | 26.9 | Very low | 32 | Very low | 139 Ų | 139 | 136.1 Ų | 136.1 | 74% | 0.743 | 74% | 0.744 | S | S | * | * | cis | -159.3 | 156.2 | 4.7 | -114.6 | -30.9 | 0 | 0 | 0 | 113.9 | ||||
| 131 | S | 31.3 | Very low | 31.2 | Very low | 90 Ų | 90 | 134.6 Ų | 134.6 | 63% | 0.629 | 75% | 0.753 | S | S | * | * | trans | 63.9 | 121.6 | 145.1 | -68.5 | 0 | 0 | 0 | 0 | 125.5 | ||||
| 132 | I | 32 | Very low | 30.9 | Very low | 161 Ų | 161 | 138.8 Ų | 138.8 | 83% | 0.826 | 76% | 0.756 | S | S | * | * | trans | 73.5 | 134.8 | 133.9 | -59.3 | 169.5 | 0 | 0 | 0 | 117.6 | ||||
| 133 | S | 26.4 | Very low | 30.4 | Very low | 111 Ų | 111 | 139.3 Ų | 139.3 | 78% | 0.776 | 76% | 0.759 | S | S | * | * | cis | -144.3 | 166.4 | 3.7 | 51.8 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 134 | S | 27.2 | Very low | 29.9 | Very low | 105 Ų | 105 | 134.1 Ų | 134.1 | 73% | 0.734 | 76% | 0.757 | S | S | * | * | trans | -88.4 | -168.6 | 171.2 | 58.1 | 0 | 0 | 0 | 0 | 112 | ||||
| 135 | P | 42.3 | Very low | 29.3 | Very low | 116 Ų | 116 | 132.2 Ų | 132.2 | 75% | 0.753 | 76% | 0.762 | S | S | * | * | cis | -143.5 | -165.1 | 6.9 | 45.8 | -25.7 | 0 | 0 | 0 | 117.7 | ||||
| 136 | A | 27.3 | Very low | 29.3 | Very low | 81 Ų | 81 | 128.1 Ų | 128.1 | 67% | 0.669 | 75% | 0.754 | S | S | * | * | trans | 78 | 126.6 | 161.7 | 0 | 0 | 0 | 0 | 0 | 118.3 | ||||
| 137 | D | 26.2 | Very low | 29.1 | Very low | 142 Ų | 142 | 130.3 Ų | 130.3 | 76% | 0.759 | 75% | 0.754 | S | S | * | * | cis | 94 | 134.4 | 40.4 | -77.5 | -48.5 | 0 | 0 | 0 | 112.5 | ||||
| 138 | L | 32.1 | Very low | 28.8 | Very low | 146 Ų | 146 | 131 Ų | 131 | 76% | 0.764 | 76% | 0.757 | S | S | * | * | cis | -149.3 | 158.3 | 9.9 | -88.2 | 124.9 | 0 | 0 | 0 | 112.4 | ||||
| 139 | E | 31.9 | Very low | 28.9 | Very low | 164 Ų | 164 | 130.9 Ų | 130.9 | 77% | 0.766 | 76% | 0.757 | S | S | * | * | trans | 42.2 | 159.5 | 135.6 | -61.4 | -69.8 | 79 | 0 | 0 | 123.2 | ||||
| 140 | D | 27.8 | Very low | 29 | Very low | 92 Ų | 92 | 131.4 Ų | 131.4 | 49% | 0.492 | 76% | 0.764 | S | S | . | * | cis | -161.2 | 146.8 | -18.8 | 164 | 36.2 | 0 | 0 | 0 | 106.8 | R142 | D140-R142 PolarHBondContact OD1-N 3.31Š| ||
| 141 | S | 27.2 | Very low | 29.2 | Very low | 124 Ų | 124 | 131.8 Ų | 131.8 | 87% | 0.867 | 76% | 0.761 | S | S | * | * | trans | -154.7 | 70.9 | 150.8 | -42 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 142 | R | 33.1 | Very low | 29.1 | Very low | 202 Ų | 202 | 133.8 Ų | 133.8 | 76% | 0.762 | 77% | 0.765 | S | S | * | * | trans | -30 | 140.1 | 160.8 | -178.6 | -168.2 | -51.3 | -155.3 | -1.4 | 116.4 | D140 | D140-R142 PolarHBondContact OD1-N 3.31Š| ||
| 143 | T | 27.8 | Very low | 29.1 | Very low | 133 Ų | 133 | 134.4 Ų | 134.4 | 82% | 0.816 | 76% | 0.762 | S | S | * | * | trans | 150.6 | 138.3 | 134 | -64.5 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 144 | G | 26.3 | Very low | 29.3 | Very low | 72 Ų | 72 | 135.3 Ų | 135.3 | 74% | 0.742 | 76% | 0.758 | S | S | * | * | cis | 153.4 | 134.3 | -2.7 | 0 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 145 | A | 27.5 | Very low | 29.2 | Very low | 108 Ų | 108 | 139.7 Ų | 139.7 | 89% | 0.893 | 76% | 0.759 | S | S | * | * | trans | -145.5 | 131.5 | -168.7 | 0 | 0 | 0 | 0 | 0 | 115.2 | ||||
| 146 | S | 27.9 | Very low | 28.4 | Very low | 102 Ų | 102 | 140.8 Ų | 140.8 | 71% | 0.713 | 76% | 0.757 | S | S | * | * | trans | -169.8 | 150.2 | 160.2 | -111.7 | 0 | 0 | 0 | 0 | 103.7 | ||||
| 147 | E | 28.3 | Very low | 28.3 | Very low | 169 Ų | 169 | 142 Ų | 142 | 79% | 0.79 | 76% | 0.761 | S | S | * | * | cis | 171.6 | 148 | 0.4 | -116.1 | 178.7 | 111.2 | 0 | 0 | 103.6 | ||||
| 148 | Q | 25.9 | Very low | 28.4 | Very low | 207 Ų | 207 | 139 Ų | 139 | 97% | 0.967 | 76% | 0.763 | S | S | * | * | trans | -166 | 170.6 | 142.8 | -113.2 | 173.5 | 24.2 | 0 | 0 | 112.9 | ||||
| 149 | K | 26.3 | Very low | 28.1 | Very low | 182 Ų | 182 | 141.4 Ų | 141.4 | 79% | 0.791 | 77% | 0.77 | S | S | * | * | trans | -146.3 | 124.2 | -147.5 | 161.2 | -165.4 | 167.9 | -172.3 | 0 | 112.7 | ||||
| 150 | S | 28.2 | Very low | 28.2 | Very low | 113 Ų | 113 | 139.8 Ų | 139.8 | 79% | 0.79 | 77% | 0.766 | S | S | * | * | trans | -174.2 | 147.6 | 154.6 | -167.7 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 151 | Q | 30.9 | Very low | 28.5 | Very low | 147 Ų | 147 | 141.4 Ų | 141.4 | 69% | 0.687 | 78% | 0.781 | S | S | * | * | cis | 120.7 | 136.3 | -7.2 | -163 | 166.4 | -11.5 | 0 | 0 | 115.6 | ||||
| 152 | N | 28.3 | Very low | 28.5 | Very low | 133 Ų | 133 | 146 Ų | 146 | 71% | 0.711 | 78% | 0.78 | S | S | * | * | trans | 72.7 | 139.6 | -172.9 | -75.3 | -28.8 | 0 | 0 | 0 | 117.1 | ||||
| 153 | K | 32.8 | Very low | 28.2 | Very low | 173 Ų | 173 | 141.7 Ų | 141.7 | 75% | 0.752 | 78% | 0.781 | S | S | * | * | cis | 85.2 | 129.9 | 27.4 | -173.3 | -173.7 | 174.8 | -174.5 | 0 | 111.8 | ||||
| 154 | N | 29.8 | Very low | 28.1 | Very low | 131 Ų | 131 | 141.3 Ų | 141.3 | 70% | 0.701 | 78% | 0.778 | S | S | * | * | cis | -145.6 | -172.7 | 27.6 | -117.3 | -1.2 | 0 | 0 | 0 | 108.3 | ||||
| 155 | R | 26.3 | Very low | 28.2 | Very low | 197 Ų | 197 | 144.3 Ų | 144.3 | 74% | 0.743 | 78% | 0.782 | S | S | * | * | cis | -179.6 | 168.2 | -29.5 | 173.3 | 170.9 | -176.8 | -83.4 | -2.2 | 108.1 | ||||
| 156 | L | 25.8 | Very low | 28.2 | Very low | 139 Ų | 139 | 144 Ų | 144 | 73% | 0.728 | 78% | 0.78 | S | S | * | * | trans | 90.2 | 114.6 | 165.4 | -146.9 | 74.2 | 0 | 0 | 0 | 113.8 | ||||
| 157 | S | 25.3 | Very low | 28.3 | Very low | 107 Ų | 107 | 143.8 Ų | 143.8 | 75% | 0.748 | 78% | 0.784 | S | S | * | * | cis | 94.4 | 110.6 | 37.8 | -166 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 158 | G | 27 | Very low | 28.9 | Very low | 77 Ų | 77 | 141.7 Ų | 141.7 | 79% | 0.794 | 79% | 0.785 | S | S | * | * | trans | -94.8 | 172.4 | 176.9 | 0 | 0 | 0 | 0 | 0 | 114 | ||||
| 159 | E | 26.5 | Very low | 29.3 | Very low | 197 Ų | 197 | 139.2 Ų | 139.2 | 92% | 0.921 | 78% | 0.777 | S | S | * | * | trans | -110.1 | 168.9 | -159.5 | -154.1 | 163.1 | 107.6 | 0 | 0 | 114.7 | ||||
| 160 | I | 33.3 | Very low | 30.4 | Very low | 131 Ų | 131 | 136 Ų | 136 | 67% | 0.672 | 77% | 0.774 | S | S | * | * | trans | -106.2 | 142.4 | -179 | -57.7 | 163.4 | 0 | 0 | 0 | 109.4 | ||||
| 161 | P | 34.1 | Very low | 30.3 | Very low | 126 Ų | 126 | 136.7 Ų | 136.7 | 82% | 0.818 | 77% | 0.774 | S | S | * | * | trans | -121.4 | 159.5 | 135.2 | -3.8 | 24.6 | 0 | 0 | 0 | 113.7 | ||||
| 162 | R | 28.3 | Very low | 30.3 | Very low | 220 Ų | 220 | 133.1 Ų | 133.1 | 83% | 0.83 | 78% | 0.777 | S | S | * | * | trans | -140.9 | 168.6 | 173.5 | -112.3 | -167.6 | -179.6 | 107.8 | -3.2 | 110.2 | ||||
| 163 | S | 25.9 | Very low | 30.4 | Very low | 112 Ų | 112 | 132.1 Ų | 132.1 | 78% | 0.783 | 79% | 0.787 | S | S | * | * | trans | 78.9 | 149.1 | 178.1 | -49.1 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 164 | T | 26.6 | Very low | 30.4 | Very low | 125 Ų | 125 | 128.3 Ų | 128.3 | 77% | 0.767 | 79% | 0.787 | S | S | * | * | cis | -143.4 | 133.2 | 26.6 | -57.8 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 165 | T | 26.9 | Very low | 30.7 | Very low | 135 Ų | 135 | 128.8 Ų | 128.8 | 83% | 0.828 | 80% | 0.795 | S | S | * | * | trans | 30.8 | 122.3 | 148.4 | -48.9 | 0 | 0 | 0 | 0 | 123.1 | ||||
| 166 | A | 27.1 | Very low | 31.8 | Very low | 101 Ų | 101 | 124.1 Ų | 124.1 | 84% | 0.835 | 79% | 0.79 | S | S | * | * | -165 | 150.2 | 126.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | |||||
| 167 | A | 30.9 | Very low | 32.1 | Very low | 97 Ų | 97 | 125 Ų | 125 | 80% | 0.802 | 80% | 0.796 | S | S | * | * | trans | -157.7 | 166.4 | 177.4 | 0 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 168 | P | 41.8 | Very low | 32.3 | Very low | 125 Ų | 125 | 125.3 Ų | 125.3 | 81% | 0.812 | 79% | 0.793 | S | S | * | * | cis | -141.5 | -156.9 | 31.9 | 42.5 | -20.1 | 0 | 0 | 0 | 116.1 | ||||
| 169 | I | 32.6 | Very low | 32.9 | Very low | 155 Ų | 155 | 127.6 Ų | 127.6 | 80% | 0.795 | 79% | 0.794 | S | S | * | * | trans | -145.7 | 157.6 | -167.8 | -77.5 | 159.1 | 0 | 0 | 0 | 107.7 | ||||
| 170 | P | 49.2 | Very low | 33.4 | Very low | 115 Ų | 115 | 123.7 Ų | 123.7 | 75% | 0.747 | 78% | 0.784 | S | S | * | * | cis | -106.1 | -140.9 | 4.6 | 18.3 | 7.5 | 0 | 0 | 0 | 111.5 | ||||
| 171 | T | 27.7 | Very low | 33.6 | Very low | 128 Ų | 128 | 123.2 Ų | 123.2 | 79% | 0.785 | 79% | 0.789 | S | S | * | * | cis | -162.8 | 157.1 | 14.8 | -49.7 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 172 | G | 30.8 | Very low | 33.8 | Very low | 72 Ų | 72 | 124.3 Ų | 124.3 | 74% | 0.742 | 78% | 0.783 | S | S | * | * | cis | 145.1 | 102.3 | -5.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 173 | A | 30.1 | Very low | 34.1 | Very low | 112 Ų | 112 | 119.5 Ų | 119.5 | 93% | 0.926 | 78% | 0.78 | S | S | * | * | trans | -158.3 | 174.6 | -179.9 | 0 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 174 | A | 31.5 | Very low | 34.7 | Very low | 92 Ų | 92 | 123.9 Ų | 123.9 | 76% | 0.76 | 78% | 0.78 | S | S | * | * | trans | -143.2 | 159.4 | -167.9 | 0 | 0 | 0 | 0 | 0 | 117.2 | ||||
| 175 | V | 36.8 | Very low | 34.8 | Very low | 141 Ų | 141 | 127.2 Ų | 127.2 | 86% | 0.855 | 78% | 0.784 | S | S | * | * | trans | 68.3 | 171.2 | 167.7 | -122.6 | 0 | 0 | 0 | 0 | 115.9 | ||||
| 176 | P | 50.1 | Low | 35.2 | Very low | 100 Ų | 100 | 126.8 Ų | 126.8 | 65% | 0.649 | 78% | 0.781 | S | S | * | * | -121 | 179.4 | -111.4 | 43.1 | -28.4 | 0 | 0 | 0 | 115.1 | |||||
| 177 | N | 30.8 | Very low | 35.9 | Very low | 158 Ų | 158 | 127.1 Ų | 127.1 | 85% | 0.845 | 78% | 0.784 | S | S | * | * | -176.7 | 162 | 129.8 | -94.6 | -37.9 | 0 | 0 | 0 | 114.1 | |||||
| 178 | T | 31.5 | Very low | 36.4 | Very low | 112 Ų | 112 | 127.1 Ų | 127.1 | 69% | 0.687 | 78% | 0.784 | S | S | * | * | trans | -70.9 | 159.7 | -179.9 | -21.4 | 0 | 0 | 0 | 0 | 113 | ||||
| 179 | P | 38.7 | Very low | 36.5 | Very low | 125 Ų | 125 | 129.4 Ų | 129.4 | 81% | 0.812 | 79% | 0.79 | S | S | * | * | -143.5 | 151.8 | 96.7 | 37.6 | -23.5 | 0 | 0 | 0 | 115.7 | |||||
| 180 | T | 36.7 | Very low | 36.6 | Very low | 115 Ų | 115 | 125.5 Ų | 125.5 | 71% | 0.706 | 79% | 0.788 | S | S | * | * | trans | -105.1 | 133.1 | 178 | -50.1 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 181 | P | 37.5 | Very low | 36.4 | Very low | 121 Ų | 121 | 132.1 Ų | 132.1 | 79% | 0.786 | 80% | 0.798 | S | S | * | * | trans | -98.6 | 115.9 | 163.6 | 13.1 | 5.7 | 0 | 0 | 0 | 111.2 | ||||
| 182 | H | 38.5 | Very low | 36.9 | Very low | 149 Ų | 149 | 130.8 Ų | 130.8 | 69% | 0.69 | 80% | 0.8 | S | S | * | * | trans | -89.9 | 156.3 | 166.6 | -116.4 | -54 | 0 | 0 | 0 | 110.3 | ||||
| 183 | P | 35.2 | Very low | 37.7 | Very low | 119 Ų | 119 | 130.1 Ų | 130.1 | 77% | 0.773 | 79% | 0.793 | S | S | * | * | trans | -120.8 | 147.7 | 133.6 | 34.4 | -30.3 | 0 | 0 | 0 | 112.2 | ||||
| 184 | R | 36.8 | Very low | 38.5 | Very low | 205 Ų | 205 | 130.8 Ų | 130.8 | 77% | 0.774 | 79% | 0.788 | S | S | * | * | trans | -140.7 | 122 | 166.6 | -78 | -178.2 | 177 | 168.5 | -2.1 | 108.1 | ||||
| 185 | F | 30 | Very low | 39 | Very low | 194 Ų | 194 | 134.2 Ų | 134.2 | 85% | 0.851 | 79% | 0.792 | S | S | * | * | trans | -148.8 | 103.5 | 158.8 | -84.2 | -69.2 | 0 | 0 | 0 | 106.5 | ||||
| 186 | T | 34.4 | Very low | 39.7 | Very low | 126 Ų | 126 | 134.1 Ų | 134.1 | 77% | 0.773 | 79% | 0.792 | S | S | * | * | 68.4 | 122.3 | 98.1 | 57.2 | 0 | 0 | 0 | 0 | 114 | |||||
| 187 | A | 41.8 | Very low | 39.9 | Very low | 109 Ų | 109 | 134.6 Ų | 134.6 | 90% | 0.901 | 79% | 0.792 | S | S | * | * | trans | -81.8 | 139.7 | 174.5 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 188 | A | 43 | Very low | 41.2 | Very low | 97 Ų | 97 | 132.9 Ų | 132.9 | 80% | 0.802 | 79% | 0.79 | S | S | * | * | trans | -160.9 | 154.9 | 164.3 | 0 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 189 | D | 43.3 | Very low | 42.2 | Very low | 173 Ų | 173 | 132.6 Ų | 132.6 | 93% | 0.925 | 78% | 0.781 | S | S | * | * | trans | -66.1 | 146.3 | -179.3 | -62.1 | -88.1 | 0 | 0 | 0 | 113.8 | ||||
| 190 | G | 34.4 | Very low | 43.8 | Very low | 73 Ų | 73 | 129.4 Ų | 129.4 | 75% | 0.753 | 76% | 0.76 | S | S | * | * | trans | -168.4 | 36.5 | -168.4 | 0 | 0 | 0 | 0 | 0 | 119.8 | A192 | G190-A192 PolarHBondContact O-N 2.86Å; G190-A192 VanDerWaalsContact O-N 3.17Å | ||
| 191 | R | 45.9 | Very low | 45.7 | Very low | 254 Ų | 254 | 132.1 Ų | 132.1 | 96% | 0.958 | 76% | 0.762 | S | S | * | * | trans | 37.7 | 64.1 | 153.3 | -159.3 | -170.5 | -163.2 | -160.1 | 5.8 | 117.4 | ||||
| 192 | A | 37.7 | Very low | 47.8 | Very low | 100 Ų | 100 | 130.3 Ų | 130.3 | 83% | 0.826 | 75% | 0.745 | S | S | * | * | P | Polyproline II helix | trans | -75.4 | 138.8 | 167 | 0 | 0 | 0 | 0 | 0 | 111.4 | G190 | G190-A192 PolarHBondContact O-N 2.86Å; G190-A192 VanDerWaalsContact O-N 3.17Å |
| 193 | G | 46.7 | Very low | 50.1 | Low | 58 Ų | 58 | 126.1 Ų | 126.1 | 60% | 0.598 | 73% | 0.728 | S | S | * | * | P | Polyproline II helix | trans | -76.4 | 173 | 177.7 | 0 | 0 | 0 | 0 | 0 | 113.8 | L195 | G193-L195 PolarHBondContact O-N 3.29Š|
| 194 | P | 46.6 | Very low | 52.5 | Low | 126 Ų | 126 | 123.4 Ų | 123.4 | 82% | 0.818 | 71% | 0.709 | S | S | * | * | P | Polyproline II helix | trans | -61.8 | 124.5 | 179.6 | 26.1 | -34 | 0 | 0 | 0 | 111.1 | V196 | P194-V196 PolarHBondContact O-N 2.95Å; P194-V196 VanDerWaalsContact O-N 3.16Å |
| 195 | L | 43.6 | Very low | 55.1 | Low | 164 Ų | 164 | 118.3 Ų | 118.3 | 86% | 0.859 | 70% | 0.696 | S | S | * | * | trans | -64.9 | 112.1 | 174.6 | -73.8 | 162.4 | 0 | 0 | 0 | 109.5 | G193 V197 | G193-L195 PolarHBondContact O-N 3.29Å; L195-V197 VanDerWaalsContact C-N 3.32Å; L195-V197 PolarHBondContact O-N 2.96Å | ||
| 196 | V | 50.4 | Low | 57.9 | Low | 139 Ų | 139 | 113.2 Ų | 113.2 | 84% | 0.842 | 68% | 0.677 | S | S | * | * | trans | -73 | 90.6 | 171.7 | -179.2 | 0 | 0 | 0 | 0 | 108.2 | P194 | P194-V196 PolarHBondContact O-N 2.95Å; P194-V196 VanDerWaalsContact O-N 3.16Å | ||
| 197 | V | 53.9 | Low | 60.6 | Low | 109 Ų | 109 | 111.3 Ų | 111.3 | 66% | 0.661 | 67% | 0.666 | S | S | * | * | trans | -61.4 | 131.4 | 173.3 | 177 | 0 | 0 | 0 | 0 | 109 | L195 H199 | L195-V197 VanDerWaalsContact C-N 3.32Å; L195-V197 PolarHBondContact O-N 2.96Å; V197-H199 PolarHBondContact O-N 2.93Å | ||
| 198 | P | 58.1 | Low | 63.1 | Low | 122 Ų | 122 | 111.1 Ų | 111.1 | 79% | 0.792 | 65% | 0.648 | S | S | * | * | trans | -62.4 | 97.4 | 171.7 | -23.9 | 35.5 | 0 | 0 | 0 | 111 | ||||
| 199 | H | 52.8 | Low | 65.5 | Low | 107 Ų | 107 | 111 Ų | 111 | 50% | 0.495 | 63% | 0.633 | S | S | . | * | trans | -62.3 | 123.8 | -176.4 | -153.4 | 75.4 | 0 | 0 | 0 | 110.1 | V197 K201 D203 T204 | V197-H199 PolarHBondContact O-N 2.93Å; H199-K201 PolarHBondContact O-N 2.94Å; H199-D203 VanDerWaalsContact NE2-C 3.32Å; H199-D203 WeakPolarHBondContact NE2-CB 3.4Å; H199-T204 PolarHBondContact CD2-N 3.27Å; H199-T204 PolarHBondContact CD2-OG1 2.82Å | ||
| 200 | P | 72.3 | Confident | 67.9 | Low | 58 Ų | 58 | 107.6 Ų | 107.6 | 38% | 0.377 | 61% | 0.614 | S | S | . | * | trans | -69.8 | 136.9 | -178.9 | 30.9 | -35.1 | 0 | 0 | 0 | 109.4 | N202 D203 | P200-N202 PolarHBondContact O-N 2.85Å; P200-D203 HydrophobicContact CG-CB 4.14Å; P200-D203 WeakPolarHBondContact CG-OD2 3.33Å; P200-D203 PolarHBondContact O-N 3.32Å | ||
| 201 | K | 77.4 | Confident | 70.8 | Confident | 172 Ų | 172 | 107.4 Ų | 107.4 | 75% | 0.748 | 60% | 0.601 | S | S | * | * | H | α-helix | trans | -49.5 | -33.3 | -170 | 61.5 | -173.7 | 177.8 | -179.6 | 0 | 115.5 | H199 T204 I205 | H199-K201 PolarHBondContact O-N 2.94Å; K201-T204 PolarHBondContact O-N 2.88Å; K201-I205 WeakPolarHBondContact O-CG1 3.44Å; K201-I205 PolarHBondContact O-N 2.91Å |
| 202 | N | 80.6 | Confident | 73.3 | Confident | 82 Ų | 82 | 100.6 Ų | 100.6 | 44% | 0.439 | 58% | 0.583 | S | S | . | * | H | α-helix | trans | -60.3 | -41.7 | 173.7 | 39.5 | -81.7 | 0 | 0 | 0 | 112.9 | P200 T204 I205 I206 | P200-N202 PolarHBondContact O-N 2.85Å; N202-T204 VanDerWaalsContact C-N 3.32Å; N202-T204 PolarHBondContact O-N 2.71Å; N202-I205 PolarHBondContact O-N 3.08Å; N202-I205 VanDerWaalsContact O-N 3.16Å; N202-I206 WeakPolarHBondContact O-CG1 3.44Å; N202-I206 PolarHBondContact O-N 3.4Å |
| 203 | D | 86.3 | Confident | 76 | Confident | 61 Ų | 61 | 99.8 Ų | 99.8 | 33% | 0.326 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -74.9 | -26.3 | -176.1 | -63.3 | -7.9 | 0 | 0 | 0 | 111 | H199 P200 V207 | H199-D203 VanDerWaalsContact NE2-C 3.32Å; H199-D203 WeakPolarHBondContact NE2-CB 3.4Å; P200-D203 HydrophobicContact CG-CB 4.14Å; P200-D203 WeakPolarHBondContact CG-OD2 3.33Å; P200-D203 PolarHBondContact O-N 3.32Å; D203-V207 WeakPolarHBondContact O-CB 3.23Å; D203-V207 VanDerWaalsContact O-CG2 3.23Å; D203-V207 WeakPolarHBondContact O-CG2 3.31Å; D203-V207 PolarHBondContact O-N 2.92Å |
| 204 | T | 86.6 | Confident | 78.3 | Confident | 62 Ų | 62 | 99.4 Ų | 99.4 | 38% | 0.38 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -64 | -45.6 | 167.3 | -46 | 0 | 0 | 0 | 0 | 110.8 | H199 K201 N202 V207 I208 | H199-T204 PolarHBondContact CD2-N 3.27Å; H199-T204 PolarHBondContact CD2-OG1 2.82Å; K201-T204 PolarHBondContact O-N 2.88Å; N202-T204 VanDerWaalsContact C-N 3.32Å; N202-T204 PolarHBondContact O-N 2.71Å; T204-V207 PolarHBondContact O-N 3.17Å; T204-I208 HydrophobicContact CG2-CD1 4.03Å; T204-I208 VanDerWaalsContact O-CG1 3.28Å; T204-I208 WeakPolarHBondContact O-CG1 3.19Å; T204-I208 PolarHBondContact O-N 3.24Å |
| 205 | I | 90.6 | Very high | 80.7 | Confident | 98 Ų | 98 | 97.2 Ų | 97.2 | 50% | 0.503 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -64.9 | -43.2 | -179.8 | -65.9 | 164.1 | 0 | 0 | 0 | 110.6 | K201 N202 I208 I209 | K201-I205 WeakPolarHBondContact O-CG1 3.44Å; K201-I205 PolarHBondContact O-N 2.91Å; N202-I205 PolarHBondContact O-N 3.08Å; N202-I205 VanDerWaalsContact O-N 3.16Å; I205-I208 PolarHBondContact O-N 3.21Å; I205-I209 HydrophobicContact CG2-CD1 3.87Å; I205-I209 WeakPolarHBondContact O-CG1 3.23Å; I205-I209 PolarHBondContact O-N 2.88Å |
| 206 | I | 89.3 | Confident | 83.3 | Confident | 87 Ų | 87 | 93.3 Ų | 93.3 | 45% | 0.446 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -61.5 | -44.9 | 176.3 | -68.8 | 163.2 | 0 | 0 | 0 | 110.8 | N202 I208 I209 I210 | N202-I206 WeakPolarHBondContact O-CG1 3.44Å; N202-I206 PolarHBondContact O-N 3.4Å; I206-I208 PolarHBondContact O-N 3.38Å; I206-I209 PolarHBondContact O-N 2.85Å; I206-I210 HydrophobicContact CG2-CD1 3.72Å; I206-I210 HydrophobicContact CG2-CG1 4.46Å; I206-I210 VanDerWaalsContact O-CG1 3.31Å; I206-I210 WeakPolarHBondContact O-CG1 3.37Å; I206-I210 PolarHBondContact O-N 2.95Å |
| 207 | V | 91.2 | Very high | 85.4 | Confident | 87 Ų | 87 | 88.2 Ų | 88.2 | 53% | 0.527 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -62.9 | -39.7 | 176 | 167.8 | 0 | 0 | 0 | 0 | 112 | D203 T204 S211 | D203-V207 WeakPolarHBondContact O-CB 3.23Å; D203-V207 VanDerWaalsContact O-CG2 3.23Å; D203-V207 WeakPolarHBondContact O-CG2 3.31Å; D203-V207 PolarHBondContact O-N 2.92Å; T204-V207 PolarHBondContact O-N 3.17Å; V207-S211 WeakPolarHBondContact O-CB 3.33Å; V207-S211 PolarHBondContact O-N 3.47Å |
| 208 | I | 93.6 | Very high | 87.4 | Confident | 105 Ų | 105 | 85.6 Ų | 85.6 | 54% | 0.538 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -62.8 | -45.2 | 175.2 | -71.2 | 164.5 | 0 | 0 | 0 | 111.2 | T204 I205 I206 S211 L212 | T204-I208 HydrophobicContact CG2-CD1 4.03Å; T204-I208 VanDerWaalsContact O-CG1 3.28Å; T204-I208 WeakPolarHBondContact O-CG1 3.19Å; T204-I208 PolarHBondContact O-N 3.24Å; I205-I208 PolarHBondContact O-N 3.21Å; I206-I208 PolarHBondContact O-N 3.38Å; I208-S211 PolarHBondContact O-N 3.06Å; I208-L212 WeakPolarHBondContact O-CB 3.32Å; I208-L212 PolarHBondContact O-N 3.48Å |
| 209 | I | 94.3 | Very high | 89.2 | Confident | 94 Ų | 94 | 83.4 Ų | 83.4 | 48% | 0.482 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -62.8 | -48.1 | 178.4 | -68.1 | 165.2 | 0 | 0 | 0 | 110.5 | I205 I206 S211 L212 C213 | I205-I209 HydrophobicContact CG2-CD1 3.87Å; I205-I209 WeakPolarHBondContact O-CG1 3.23Å; I205-I209 PolarHBondContact O-N 2.88Å; I206-I209 PolarHBondContact O-N 2.85Å; I209-S211 VanDerWaalsContact C-N 3.33Å; I209-S211 PolarHBondContact O-N 3.27Å; I209-L212 PolarHBondContact O-N 3.37Å; I209-C213 PolarHBondContact O-N 3.24Å; I209-C213 PolarHBondContact O-SG 3.04Å; I209-C213 VanDerWaalsContact O-SG 3.34Å |
| 210 | I | 94.2 | Very high | 91.2 | Very high | 102 Ų | 102 | 81.8 Ų | 81.8 | 52% | 0.523 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -60.5 | -44 | 177.7 | -67.7 | 168.6 | 0 | 0 | 0 | 110.5 | I206 L212 C213 V214 | I206-I210 HydrophobicContact CG2-CD1 3.72Å; I206-I210 HydrophobicContact CG2-CG1 4.46Å; I206-I210 VanDerWaalsContact O-CG1 3.31Å; I206-I210 WeakPolarHBondContact O-CG1 3.37Å; I206-I210 PolarHBondContact O-N 2.95Å; I210-L212 PolarHBondContact O-N 2.94Å; I210-C213 PolarHBondContact O-N 3.39Å; I210-V214 HydrophobicContact CG2-CG2 4.46Å; I210-V214 WeakPolarHBondContact O-CB 3.41Å; I210-V214 VanDerWaalsContact O-CG2 3.31Å; I210-V214 WeakPolarHBondContact O-CG2 3.35Å; I210-V214 PolarHBondContact O-N 2.84Å |
| 211 | S | 95.4 | Very high | 92.4 | Very high | 68 Ų | 68 | 83.1 Ų | 83.1 | 48% | 0.476 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -61.7 | -41.6 | 177.4 | -177.2 | 0 | 0 | 0 | 0 | 112.5 | V207 I208 I209 V214 V215 | V207-S211 WeakPolarHBondContact O-CB 3.33Å; V207-S211 PolarHBondContact O-N 3.47Å; I208-S211 PolarHBondContact O-N 3.06Å; I209-S211 VanDerWaalsContact C-N 3.33Å; I209-S211 PolarHBondContact O-N 3.27Å; S211-V214 WeakPolarHBondContact O-CB 3.19Å; S211-V214 PolarHBondContact O-N 2.92Å; S211-V215 WeakPolarHBondContact O-CG2 3.37Å; S211-V215 PolarHBondContact O-N 3.26Å |
| 212 | L | 96.9 | Very high | 93.2 | Very high | 111 Ų | 111 | 80 Ų | 80 | 58% | 0.581 | 46% | 0.464 | S | S | * | . | H | α-helix | trans | -65.8 | -45.5 | 175.9 | -176.4 | 63.6 | 0 | 0 | 0 | 111.7 | I208 I209 I210 V214 V215 V216 | I208-L212 WeakPolarHBondContact O-CB 3.32Å; I208-L212 PolarHBondContact O-N 3.48Å; I209-L212 PolarHBondContact O-N 3.37Å; I210-L212 PolarHBondContact O-N 2.94Å; L212-V214 VanDerWaalsContact C-N 3.29Å; L212-V214 PolarHBondContact O-N 3.35Å; L212-V215 PolarHBondContact O-N 3.4Å; L212-V216 HydrophobicContact CD1-CG2 4.32Å; L212-V216 WeakPolarHBondContact O-CG2 3.46Å; L212-V216 PolarHBondContact O-N 2.88Å |
| 213 | C | 94.4 | Very high | 93.9 | Very high | 83 Ų | 83 | 81.1 Ų | 81.1 | 56% | 0.561 | 47% | 0.47 | S | S | * | . | H | α-helix | trans | -61.6 | -36.2 | 175.8 | -69.5 | 0 | 0 | 0 | 0 | 112.4 | I209 I210 G217 | I209-C213 PolarHBondContact O-N 3.24Å; I209-C213 PolarHBondContact O-SG 3.04Å; I209-C213 VanDerWaalsContact O-SG 3.34Å; I210-C213 PolarHBondContact O-N 3.39Å; C213-G217 WeakPolarHBondContact O-CA 3.46Å; C213-G217 PolarHBondContact O-N 2.74Å |
| 214 | V | 96.8 | Very high | 94.3 | Very high | 50 Ų | 50 | 81.1 Ų | 81.1 | 30% | 0.303 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -60.8 | -50.1 | 172.2 | 151.4 | 0 | 0 | 0 | 0 | 111.5 | Y34 I210 S211 L212 G217 T218 | Y34-V214 HydrophobicContact CE1-CB 4.45Å; Y34-V214 HydrophobicContact CE1-CG1 3.68Å; Y34-V214 HydrophobicContact CE1-CG2 4.03Å; Y34-V214 WeakPolarHBondContact OH-CG1 3.49Å; I210-V214 HydrophobicContact CG2-CG2 4.46Å; I210-V214 WeakPolarHBondContact O-CB 3.41Å; I210-V214 VanDerWaalsContact O-CG2 3.31Å; I210-V214 WeakPolarHBondContact O-CG2 3.35Å; I210-V214 PolarHBondContact O-N 2.84Å; S211-V214 WeakPolarHBondContact O-CB 3.19Å; S211-V214 PolarHBondContact O-N 2.92Å; L212-V214 VanDerWaalsContact C-N 3.29Å; L212-V214 PolarHBondContact O-N 3.35Å; V214-G217 PolarHBondContact O-N 3.05Å; V214-T218 WeakPolarHBondContact O-CG2 3.2Å; V214-T218 PolarHBondContact O-N 3.01Å; V214-T218 PolarHBondContact O-OG1 2.91Å |
| 215 | V | 96.8 | Very high | 94.7 | Very high | 81 Ų | 81 | 81.1 Ų | 81.1 | 49% | 0.491 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -65.8 | -47.6 | -179.3 | 172.8 | 0 | 0 | 0 | 0 | 111.2 | S211 L212 T218 V219 | S211-V215 WeakPolarHBondContact O-CG2 3.37Å; S211-V215 PolarHBondContact O-N 3.26Å; L212-V215 PolarHBondContact O-N 3.4Å; V215-T218 PolarHBondContact O-N 3.49Å; V215-T218 PolarHBondContact O-OG1 2.88Å; V215-V219 WeakPolarHBondContact O-CG2 3.33Å; V215-V219 PolarHBondContact O-N 2.96Å |
| 216 | V | 96.7 | Very high | 94.9 | Very high | 82 Ų | 82 | 80.9 Ų | 80.9 | 50% | 0.497 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -63.8 | -43.9 | 177.6 | 175.7 | 0 | 0 | 0 | 0 | 111 | L212 T218 V219 C220 | L212-V216 HydrophobicContact CD1-CG2 4.32Å; L212-V216 WeakPolarHBondContact O-CG2 3.46Å; L212-V216 PolarHBondContact O-N 2.88Å; V216-T218 PolarHBondContact O-N 2.88Å; V216-V219 PolarHBondContact O-N 2.89Å; V216-C220 PolarHBondContact O-N 2.95Å; V216-C220 PolarHBondContact O-SG 3.16Å; V216-C220 VanDerWaalsContact O-SG 3.33Å |
| 217 | G | 95.8 | Very high | 95 | Very high | 32 Ų | 32 | 80.1 Ų | 80.1 | 33% | 0.33 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -60.8 | -44.1 | 179 | 0 | 0 | 0 | 0 | 0 | 113 | C213 V214 C220 V221 | C213-G217 WeakPolarHBondContact O-CA 3.46Å; C213-G217 PolarHBondContact O-N 2.74Å; V214-G217 PolarHBondContact O-N 3.05Å; G217-C220 PolarHBondContact O-N 3.22Å; G217-V221 WeakPolarHBondContact O-CG2 3Å; G217-V221 PolarHBondContact O-N 3.48Å |
| 218 | T | 94.4 | Very high | 95.2 | Very high | 53 Ų | 53 | 83.3 Ų | 83.3 | 33% | 0.325 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -64.9 | -41.1 | 176.9 | 49.1 | 0 | 0 | 0 | 0 | 112.5 | Y34 V214 V215 V216 V221 I222 | Y34-T218 HydrophobicContact CE2-CG2 4.28Å; V214-T218 WeakPolarHBondContact O-CG2 3.2Å; V214-T218 PolarHBondContact O-N 3.01Å; V214-T218 PolarHBondContact O-OG1 2.91Å; V215-T218 PolarHBondContact O-N 3.49Å; V215-T218 PolarHBondContact O-OG1 2.88Å; V216-T218 PolarHBondContact O-N 2.88Å; T218-V221 PolarHBondContact O-N 3.3Å; T218-I222 WeakPolarHBondContact O-CD1 3.44Å; T218-I222 VanDerWaalsContact O-CG1 3.26Å; T218-I222 WeakPolarHBondContact O-CG1 3.37Å; T218-I222 PolarHBondContact O-N 2.95Å |
| 219 | V | 96.4 | Very high | 95.2 | Very high | 77 Ų | 77 | 82.6 Ų | 82.6 | 47% | 0.467 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -61 | -45.8 | 173.9 | 173.2 | 0 | 0 | 0 | 0 | 111.3 | V215 V216 V221 I222 L223 | V215-V219 WeakPolarHBondContact O-CG2 3.33Å; V215-V219 PolarHBondContact O-N 2.96Å; V216-V219 PolarHBondContact O-N 2.89Å; V219-V221 PolarHBondContact O-N 2.95Å; V219-I222 PolarHBondContact O-N 2.87Å; V219-L223 HydrophobicContact CG1-CD1 4.01Å; V219-L223 HydrophobicContact CG1-CG 4.48Å; V219-L223 WeakPolarHBondContact O-CG 3.32Å; V219-L223 PolarHBondContact O-N 3.37Å |
| 220 | C | 95.9 | Very high | 95.1 | Very high | 72 Ų | 72 | 84.4 Ų | 84.4 | 49% | 0.486 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -60.7 | -41.9 | 176.4 | -70.8 | 0 | 0 | 0 | 0 | 112.6 | V216 G217 L223 A224 | V216-C220 PolarHBondContact O-N 2.95Å; V216-C220 PolarHBondContact O-SG 3.16Å; V216-C220 VanDerWaalsContact O-SG 3.33Å; G217-C220 PolarHBondContact O-N 3.22Å; C220-L223 PolarHBondContact O-N 3.31Å; C220-A224 VanDerWaalsContact O-CB 3.28Å; C220-A224 WeakPolarHBondContact O-CB 3.44Å; C220-A224 PolarHBondContact O-N 3.44Å |
| 221 | V | 96.2 | Very high | 94.9 | Very high | 87 Ų | 87 | 85.3 Ų | 85.3 | 53% | 0.527 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -67.2 | -38.8 | 177.1 | 169.7 | 0 | 0 | 0 | 0 | 111.9 | G217 T218 V219 S225 | G217-V221 WeakPolarHBondContact O-CG2 3Å; G217-V221 PolarHBondContact O-N 3.48Å; T218-V221 PolarHBondContact O-N 3.3Å; V219-V221 PolarHBondContact O-N 2.95Å; V221-S225 VanDerWaalsContact O-CB 3.3Å; V221-S225 WeakPolarHBondContact O-CB 3.39Å; V221-S225 PolarHBondContact O-N 2.94Å; V221-S225 PolarHBondContact O-OG 2.9Å |
| 222 | I | 95.6 | Very high | 94.6 | Very high | 106 Ų | 106 | 88.5 Ų | 88.5 | 54% | 0.544 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -63.2 | -48.7 | 175 | -69.8 | 162.6 | 0 | 0 | 0 | 110.2 | T218 V219 S225 V226 | T218-I222 WeakPolarHBondContact O-CD1 3.44Å; T218-I222 VanDerWaalsContact O-CG1 3.26Å; T218-I222 WeakPolarHBondContact O-CG1 3.37Å; T218-I222 PolarHBondContact O-N 2.95Å; V219-I222 PolarHBondContact O-N 2.87Å; I222-S225 PolarHBondContact O-N 3.16Å; I222-V226 WeakPolarHBondContact O-CG2 3.41Å; I222-V226 PolarHBondContact O-N 2.98Å |
| 223 | L | 95.1 | Very high | 94.1 | Very high | 106 Ų | 106 | 86.3 Ų | 86.3 | 56% | 0.555 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -61.2 | -46.7 | 177.6 | -70.6 | 172.3 | 0 | 0 | 0 | 111.6 | V219 C220 S225 V226 C227 | V219-L223 HydrophobicContact CG1-CD1 4.01Å; V219-L223 HydrophobicContact CG1-CG 4.48Å; V219-L223 WeakPolarHBondContact O-CG 3.32Å; V219-L223 PolarHBondContact O-N 3.37Å; C220-L223 PolarHBondContact O-N 3.31Å; L223-S225 VanDerWaalsContact C-N 3.3Å; L223-S225 PolarHBondContact O-N 3.34Å; L223-V226 PolarHBondContact O-N 3.43Å; L223-C227 WeakPolarHBondContact O-CB 3.34Å; L223-C227 PolarHBondContact O-N 3.4Å; L223-C227 PolarHBondContact O-SG 2.81Å |
| 224 | A | 94.5 | Very high | 93.6 | Very high | 60 Ų | 60 | 86.7 Ų | 86.7 | 50% | 0.496 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -59.6 | -39.6 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | C220 Y228 | C220-A224 VanDerWaalsContact O-CB 3.28Å; C220-A224 WeakPolarHBondContact O-CB 3.44Å; C220-A224 PolarHBondContact O-N 3.44Å; A224-Y228 VanDerWaalsContact O-CB 3.26Å; A224-Y228 WeakPolarHBondContact O-CB 3.03Å; A224-Y228 PolarHBondContact O-N 3.04Å |
| 225 | S | 94.1 | Very high | 92.6 | Very high | 63 Ų | 63 | 87.3 Ų | 87.3 | 44% | 0.441 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -67.2 | -44.3 | 177.4 | -58.9 | 0 | 0 | 0 | 0 | 112.3 | V221 I222 L223 Y228 V229 | V221-S225 VanDerWaalsContact O-CB 3.3Å; V221-S225 WeakPolarHBondContact O-CB 3.39Å; V221-S225 PolarHBondContact O-N 2.94Å; V221-S225 PolarHBondContact O-OG 2.9Å; I222-S225 PolarHBondContact O-N 3.16Å; L223-S225 VanDerWaalsContact C-N 3.3Å; L223-S225 PolarHBondContact O-N 3.34Å; S225-Y228 PolarHBondContact O-N 3.02Å; S225-V229 WeakPolarHBondContact O-CB 3.46Å; S225-V229 WeakPolarHBondContact O-CG2 3.39Å; S225-V229 PolarHBondContact O-N 3.38Å |
| 226 | V | 94.8 | Very high | 91.4 | Very high | 92 Ų | 92 | 88.2 Ų | 88.2 | 56% | 0.558 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -65.7 | -43.8 | 176.8 | 171.9 | 0 | 0 | 0 | 0 | 110.8 | I222 L223 V229 K230 | I222-V226 WeakPolarHBondContact O-CG2 3.41Å; I222-V226 PolarHBondContact O-N 2.98Å; L223-V226 PolarHBondContact O-N 3.43Å; V226-V229 PolarHBondContact O-N 3Å; V226-K230 WeakPolarHBondContact O-CB 3.33Å; V226-K230 PolarHBondContact O-N 2.79Å |
| 227 | C | 92.1 | Very high | 89.9 | Confident | 72 Ų | 72 | 89.1 Ų | 89.1 | 49% | 0.486 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -60.8 | -44.1 | 174.1 | -72.1 | 0 | 0 | 0 | 0 | 111.7 | L223 K230 L231 | L223-C227 WeakPolarHBondContact O-CB 3.34Å; L223-C227 PolarHBondContact O-N 3.4Å; L223-C227 PolarHBondContact O-SG 2.81Å; C227-K230 PolarHBondContact O-N 2.96Å; C227-L231 VanDerWaalsContact O-CB 3.29Å; C227-L231 WeakPolarHBondContact O-CB 3.41Å; C227-L231 WeakPolarHBondContact O-CD1 3.04Å; C227-L231 VanDerWaalsContact O-CG 3.25Å; C227-L231 WeakPolarHBondContact O-CG 3.04Å; C227-L231 PolarHBondContact O-N 2.6Å |
| 228 | Y | 95.6 | Very high | 88.2 | Confident | 153 Ų | 153 | 90.6 Ų | 90.6 | 60% | 0.6 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -64.2 | -44.4 | 176.9 | -176.3 | -94.7 | 0 | 0 | 0 | 112.3 | A224 S225 K230 R232 | A224-Y228 VanDerWaalsContact O-CB 3.26Å; A224-Y228 WeakPolarHBondContact O-CB 3.03Å; A224-Y228 PolarHBondContact O-N 3.04Å; S225-Y228 PolarHBondContact O-N 3.02Å; Y228-K230 VanDerWaalsContact C-N 3.34Å; Y228-K230 PolarHBondContact O-N 3.5Å; Y228-R232 WeakPolarHBondContact O-CB 3.33Å; Y228-R232 PolarHBondContact O-N 3.17Å |
| 229 | V | 92.8 | Very high | 86.6 | Confident | 90 Ų | 90 | 92.7 Ų | 92.7 | 55% | 0.545 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -63.7 | -39.7 | 175.9 | 170.2 | 0 | 0 | 0 | 0 | 111.1 | S225 V226 T233 | S225-V229 WeakPolarHBondContact O-CB 3.46Å; S225-V229 WeakPolarHBondContact O-CG2 3.39Å; S225-V229 PolarHBondContact O-N 3.38Å; V226-V229 PolarHBondContact O-N 3Å; V229-T233 WeakPolarHBondContact O-CB 3.49Å; V229-T233 PolarHBondContact O-N 2.82Å; V229-T233 PolarHBondContact O-OG1 3.21Å |
| 230 | K | 92.9 | Very high | 84.5 | Confident | 132 Ų | 132 | 95.9 Ų | 95.9 | 57% | 0.574 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -66.3 | -54.5 | 175.2 | -173.5 | 169.6 | -177.6 | 177.8 | 0 | 111.3 | V226 C227 Y228 R232 T233 E234 | V226-K230 WeakPolarHBondContact O-CB 3.33Å; V226-K230 PolarHBondContact O-N 2.79Å; C227-K230 PolarHBondContact O-N 2.96Å; Y228-K230 VanDerWaalsContact C-N 3.34Å; Y228-K230 PolarHBondContact O-N 3.5Å; K230-R232 VanDerWaalsContact C-N 3.28Å; K230-R232 PolarHBondContact O-N 3.15Å; K230-T233 CarbonylContact O-C 3.58Å; K230-T233 WeakPolarHBondContact O-CA 3.31Å; K230-T233 VanDerWaalsContact O-CB 3.29Å; K230-T233 WeakPolarHBondContact O-CB 3.02Å; K230-T233 PolarHBondContact O-N 2.78Å; K230-E234 WeakPolarHBondContact CE-OE1 3.3Å; K230-E234 HydrophobicContact CG-CG 4.28Å; K230-E234 WeakPolarHBondContact CG-OE1 3.06Å; K230-E234 IonicContact NZ-OE1 2.6Å; K230-E234 WeakPolarHBondContact O-CG 2.92Å; K230-E234 PolarHBondContact O-N 3.47Å |
| 231 | L | 90.5 | Very high | 82.6 | Confident | 122 Ų | 122 | 98.3 Ų | 98.3 | 64% | 0.639 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -54.1 | -43.4 | 177.8 | -74.6 | 165.2 | 0 | 0 | 0 | 112.1 | C227 T233 E234 S235 | C227-L231 VanDerWaalsContact O-CB 3.29Å; C227-L231 WeakPolarHBondContact O-CB 3.41Å; C227-L231 WeakPolarHBondContact O-CD1 3.04Å; C227-L231 VanDerWaalsContact O-CG 3.25Å; C227-L231 WeakPolarHBondContact O-CG 3.04Å; C227-L231 PolarHBondContact O-N 2.6Å; L231-T233 VanDerWaalsContact C-N 3.31Å; L231-T233 PolarHBondContact O-N 2.78Å; L231-E234 PolarHBondContact O-N 2.85Å; L231-S235 WeakPolarHBondContact O-CB 3.37Å; L231-S235 PolarHBondContact O-N 3.08Å |
| 232 | R | 89 | Confident | 80.4 | Confident | 134 Ų | 134 | 100.2 Ų | 100.2 | 51% | 0.506 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -68.6 | -27.9 | 174.7 | -165.4 | -173.4 | -169.4 | -107.6 | 3.7 | 112.6 | Y228 K230 S235 R236 | Y228-R232 WeakPolarHBondContact O-CB 3.33Å; Y228-R232 PolarHBondContact O-N 3.17Å; K230-R232 VanDerWaalsContact C-N 3.28Å; K230-R232 PolarHBondContact O-N 3.15Å; R232-S235 PolarHBondContact O-OG 2.77Å; R232-R236 HydrophobicContact CG-CG 4.41Å; R232-R236 WeakPolarHBondContact O-CB 3.33Å; R232-R236 WeakPolarHBondContact O-CG 3.26Å; R232-R236 PolarHBondContact O-N 2.68Å |
| 233 | T | 85.9 | Confident | 77.6 | Confident | 65 Ų | 65 | 104.9 Ų | 104.9 | 40% | 0.399 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -71.3 | -49.9 | 172.3 | -61.4 | 0 | 0 | 0 | 0 | 110.4 | V229 K230 L231 S235 R236 L237 | V229-T233 WeakPolarHBondContact O-CB 3.49Å; V229-T233 PolarHBondContact O-N 2.82Å; V229-T233 PolarHBondContact O-OG1 3.21Å; K230-T233 CarbonylContact O-C 3.58Å; K230-T233 WeakPolarHBondContact O-CA 3.31Å; K230-T233 VanDerWaalsContact O-CB 3.29Å; K230-T233 WeakPolarHBondContact O-CB 3.02Å; K230-T233 PolarHBondContact O-N 2.78Å; L231-T233 VanDerWaalsContact C-N 3.31Å; L231-T233 PolarHBondContact O-N 2.78Å; T233-S235 VanDerWaalsContact C-N 3.31Å; T233-S235 PolarHBondContact O-N 2.77Å; T233-R236 CarbonylContact O-C 3.5Å; T233-R236 WeakPolarHBondContact O-CA 3.37Å; T233-R236 PolarHBondContact O-N 3.01Å; T233-R236 VanDerWaalsContact O-N 3.08Å; T233-L237 HydrophobicContact CG2-CD1 4.07Å; T233-L237 WeakPolarHBondContact O-CD1 3.48Å; T233-L237 PolarHBondContact O-N 3.11Å |
| 234 | E | 83.6 | Confident | 75.4 | Confident | 92 Ų | 92 | 105.3 Ų | 105.3 | 43% | 0.43 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -59.5 | -43.7 | 176.7 | -48.9 | -51.2 | 168.3 | 0 | 0 | 110.8 | K230 L231 R236 L237 A238 | K230-E234 WeakPolarHBondContact CE-OE1 3.3Å; K230-E234 HydrophobicContact CG-CG 4.28Å; K230-E234 WeakPolarHBondContact CG-OE1 3.06Å; K230-E234 IonicContact NZ-OE1 2.6Å; K230-E234 WeakPolarHBondContact O-CG 2.92Å; K230-E234 PolarHBondContact O-N 3.47Å; L231-E234 PolarHBondContact O-N 2.85Å; E234-R236 VanDerWaalsContact C-N 3.33Å; E234-R236 PolarHBondContact O-N 2.96Å; E234-L237 WeakPolarHBondContact O-CB 3.36Å; E234-L237 PolarHBondContact O-N 2.87Å; E234-L237 VanDerWaalsContact O-N 3.13Å; E234-A238 PolarHBondContact O-N 2.73Å |
| 235 | S | 75.6 | Confident | 73.1 | Confident | 62 Ų | 62 | 106.8 Ų | 106.8 | 43% | 0.434 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -65.6 | -34.8 | 176.1 | 86 | 0 | 0 | 0 | 0 | 112.4 | L231 R232 T233 L237 A238 E239 | L231-S235 WeakPolarHBondContact O-CB 3.37Å; L231-S235 PolarHBondContact O-N 3.08Å; R232-S235 PolarHBondContact O-OG 2.77Å; T233-S235 VanDerWaalsContact C-N 3.31Å; T233-S235 PolarHBondContact O-N 2.77Å; S235-L237 VanDerWaalsContact C-N 3.3Å; S235-A238 PolarHBondContact O-N 2.03Å; S235-E239 WeakPolarHBondContact O-CB 3.41Å; S235-E239 PolarHBondContact O-N 2.75Å |
| 236 | R | 71.7 | Confident | 70.9 | Confident | 100 Ų | 100 | 113.1 Ų | 113.1 | 38% | 0.377 | 58% | 0.584 | S | S | . | * | H | α-helix | trans | -73.5 | -18.1 | 173.9 | -79.2 | -84.2 | 162.4 | -154.5 | -25.4 | 113.7 | R232 T233 E234 E239 K240 | R232-R236 HydrophobicContact CG-CG 4.41Å; R232-R236 WeakPolarHBondContact O-CB 3.33Å; R232-R236 WeakPolarHBondContact O-CG 3.26Å; R232-R236 PolarHBondContact O-N 2.68Å; T233-R236 CarbonylContact O-C 3.5Å; T233-R236 WeakPolarHBondContact O-CA 3.37Å; T233-R236 PolarHBondContact O-N 3.01Å; T233-R236 VanDerWaalsContact O-N 3.08Å; E234-R236 VanDerWaalsContact C-N 3.33Å; E234-R236 PolarHBondContact O-N 2.96Å; R236-E239 IonicContact CZ-OE1 3.88Å; R236-E239 IonicContact CZ-OE2 3.38Å; R236-E239 IonicContact NE-OE2 2.78Å; R236-E239 PolarHBondContact NE-OE2 3.06Å; R236-E239 VanDerWaalsContact NH1-CD 3.29Å; R236-E239 IonicContact NH1-OE1 2.87Å; R236-E239 PolarHBondContact NH1-OE1 3.19Å; R236-E239 IonicContact NH1-OE2 3.85Å; R236-E239 PolarHBondContact NH1-OE2 3.22Å; R236-E239 VanDerWaalsContact NH2-CD 3.34Å; R236-E239 IonicContact NH2-OE1 2.88Å; R236-E239 PolarHBondContact NH2-OE1 2.81Å; R236-E239 IonicContact NH2-OE2 2.85Å; R236-E239 PolarHBondContact NH2-OE2 3.38Å; R236-K240 WeakPolarHBondContact O-CD 3.47Å; R236-K240 VanDerWaalsContact O-CG 3.24Å; R236-K240 WeakPolarHBondContact O-CG 3.38Å |
| 237 | L | 64.9 | Low | 68.4 | Low | 102 Ų | 102 | 120.6 Ų | 120.6 | 53% | 0.534 | 60% | 0.602 | S | S | . | * | H | α-helix | trans | -80.8 | -47.1 | 170.2 | -96.9 | 59.6 | 0 | 0 | 0 | 109.4 | T233 E234 S235 K240 V241 | T233-L237 HydrophobicContact CG2-CD1 4.07Å; T233-L237 WeakPolarHBondContact O-CD1 3.48Å; T233-L237 PolarHBondContact O-N 3.11Å; E234-L237 WeakPolarHBondContact O-CB 3.36Å; E234-L237 PolarHBondContact O-N 2.87Å; E234-L237 VanDerWaalsContact O-N 3.13Å; S235-L237 VanDerWaalsContact C-N 3.3Å; L237-K240 PolarHBondContact O-N 3.39Å; L237-K240 VanDerWaalsContact O-N 3.12Å; L237-V241 PolarHBondContact O-N 3.44Å |
| 238 | A | 61 | Low | 65.7 | Low | 62 Ų | 62 | 121 Ų | 121 | 51% | 0.512 | 61% | 0.61 | S | S | . | * | H | α-helix | trans | -58.4 | -49.3 | 173 | 0 | 0 | 0 | 0 | 0 | 112.4 | E234 S235 K240 V241 | E234-A238 PolarHBondContact O-N 2.73Å; S235-A238 PolarHBondContact O-N 2.03Å; A238-K240 PolarHBondContact O-N 2.82Å; A238-V241 PolarHBondContact O-N 3.01Å |
| 239 | E | 61.1 | Low | 63.4 | Low | 97 Ų | 97 | 120.1 Ų | 120.1 | 45% | 0.453 | 62% | 0.623 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -57.2 | -18.7 | 175.8 | -171.8 | -169.4 | 151 | 0 | 0 | 113.3 | S235 R236 | S235-E239 WeakPolarHBondContact O-CB 3.41Å; S235-E239 PolarHBondContact O-N 2.75Å; R236-E239 IonicContact CZ-OE1 3.88Å; R236-E239 IonicContact CZ-OE2 3.38Å; R236-E239 IonicContact NE-OE2 2.78Å; R236-E239 PolarHBondContact NE-OE2 3.06Å; R236-E239 VanDerWaalsContact NH1-CD 3.29Å; R236-E239 IonicContact NH1-OE1 2.87Å; R236-E239 PolarHBondContact NH1-OE1 3.19Å; R236-E239 IonicContact NH1-OE2 3.85Å; R236-E239 PolarHBondContact NH1-OE2 3.22Å; R236-E239 VanDerWaalsContact NH2-CD 3.34Å; R236-E239 IonicContact NH2-OE1 2.88Å; R236-E239 PolarHBondContact NH2-OE1 2.81Å; R236-E239 IonicContact NH2-OE2 2.85Å; R236-E239 PolarHBondContact NH2-OE2 3.38Å |
| 240 | K | 52.8 | Low | 61.4 | Low | 145 Ų | 145 | 121 Ų | 121 | 63% | 0.63 | 63% | 0.634 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -98.3 | -7.2 | 178.9 | -79.1 | 179.4 | 179.7 | -179.5 | 0 | 114.7 | R236 L237 A238 D242 | R236-K240 WeakPolarHBondContact O-CD 3.47Å; R236-K240 VanDerWaalsContact O-CG 3.24Å; R236-K240 WeakPolarHBondContact O-CG 3.38Å; L237-K240 PolarHBondContact O-N 3.39Å; L237-K240 VanDerWaalsContact O-N 3.12Å; A238-K240 PolarHBondContact O-N 2.82Å; K240-D242 VanDerWaalsContact C-N 3.34Å |
| 241 | V | 54.8 | Low | 58.7 | Low | 122 Ų | 122 | 121 Ų | 121 | 74% | 0.739 | 64% | 0.644 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.4 | -34.6 | 169.3 | 178.2 | 0 | 0 | 0 | 0 | 109.6 | L237 A238 Y243 | L237-V241 PolarHBondContact O-N 3.44Å; A238-V241 PolarHBondContact O-N 3.01Å; V241-Y243 PolarHBondContact O-N 3.39Å |
| 242 | D | 49.7 | Very low | 56.5 | Low | 127 Ų | 127 | 120.3 Ų | 120.3 | 68% | 0.679 | 65% | 0.647 | S | S | * | * | S | Bend | trans | -87.4 | 100.3 | 169.9 | -77.9 | -61.9 | 0 | 0 | 0 | 112.3 | K240 | K240-D242 VanDerWaalsContact C-N 3.34Š|
| 243 | Y | 36.8 | Very low | 54.4 | Low | 205 Ų | 205 | 120.1 Ų | 120.1 | 80% | 0.804 | 66% | 0.663 | S | S | * | * | trans | 57.4 | 88 | 165.2 | -78.7 | -91.2 | 0 | 0 | 0 | 118.2 | V241 A245 | V241-Y243 PolarHBondContact O-N 3.39Å; Y243-A245 VanDerWaalsContact C-N 3.32Å; Y243-A245 PolarHBondContact O-N 3.36Å | ||
| 244 | P | 48.5 | Very low | 52.3 | Low | 115 Ų | 115 | 122.9 Ų | 122.9 | 75% | 0.747 | 68% | 0.68 | S | S | * | * | trans | -68.2 | 85.2 | 159.8 | 29.6 | -34.9 | 0 | 0 | 0 | 111.6 | F246 | P244-F246 PolarHBondContact O-N 2.88Š| ||
| 245 | A | 46.4 | Very low | 50.4 | Low | 90 Ų | 90 | 123.9 Ų | 123.9 | 74% | 0.744 | 70% | 0.695 | S | S | * | * | trans | -67.8 | 97.3 | -177.4 | 0 | 0 | 0 | 0 | 0 | 113.7 | Y243 R247 | Y243-A245 VanDerWaalsContact C-N 3.32Å; Y243-A245 PolarHBondContact O-N 3.36Å; A245-R247 PolarHBondContact O-N 3.47Å | ||
| 246 | F | 48.1 | Very low | 49.2 | Very low | 197 Ų | 197 | 125.3 Ų | 125.3 | 86% | 0.864 | 71% | 0.71 | S | S | * | * | trans | 23.1 | 90.6 | 152 | -166.1 | -95.1 | 0 | 0 | 0 | 117.5 | P244 | P244-F246 PolarHBondContact O-N 2.88Š| ||
| 247 | R | 43.1 | Very low | 48.1 | Very low | 249 Ų | 249 | 126.2 Ų | 126.2 | 94% | 0.94 | 72% | 0.722 | S | S | * | * | trans | -156.6 | 98.7 | 152.9 | -119.7 | 177.1 | -167.8 | -179.1 | 5.7 | 113.4 | A245 | A245-R247 PolarHBondContact O-N 3.47Š| ||
| 248 | A | 35.3 | Very low | 47.5 | Very low | 81 Ų | 81 | 124 Ų | 124 | 67% | 0.669 | 73% | 0.725 | S | S | * | * | trans | -133.7 | 144.4 | 157.3 | 0 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 249 | P | 47.5 | Very low | 47.2 | Very low | 133 Ų | 133 | 125.1 Ų | 125.1 | 86% | 0.864 | 73% | 0.729 | S | S | * | * | trans | -63.6 | 156 | 176.6 | -21.9 | 34.6 | 0 | 0 | 0 | 112.8 | ||||
| 250 | S | 50 | Low | 46.9 | Very low | 110 Ų | 110 | 123.1 Ų | 123.1 | 77% | 0.769 | 73% | 0.725 | S | S | * | * | trans | -61.4 | 163.4 | -175.5 | 45.3 | 0 | 0 | 0 | 0 | 115.8 | ||||
| 251 | V | 36.7 | Very low | 47.1 | Very low | 132 Ų | 132 | 119.8 Ų | 119.8 | 80% | 0.8 | 72% | 0.717 | S | S | * | * | trans | 87.7 | 132.2 | 167.1 | -173.7 | 0 | 0 | 0 | 0 | 116.1 | ||||
| 252 | P | 43.8 | Very low | 47.1 | Very low | 107 Ų | 107 | 119.6 Ų | 119.6 | 70% | 0.695 | 71% | 0.712 | S | S | * | * | cis | -120.5 | -177.4 | -36.7 | 34.7 | -14.9 | 0 | 0 | 0 | 110.9 | ||||
| 253 | P | 44.3 | Very low | 47.7 | Very low | 130 Ų | 130 | 118.4 Ų | 118.4 | 84% | 0.844 | 71% | 0.705 | S | S | * | * | trans | -79.6 | 134.5 | -170.2 | 30.6 | -34.7 | 0 | 0 | 0 | 114.9 | ||||
| 254 | T | 42.8 | Very low | 49.4 | Very low | 122 Ų | 122 | 114.6 Ų | 114.6 | 75% | 0.748 | 69% | 0.693 | S | S | * | * | trans | -136.9 | 136.1 | 163 | -57.9 | 0 | 0 | 0 | 0 | 106.8 | A256 | T254-A256 PolarHBondContact O-N 2.84Å; T254-A256 VanDerWaalsContact O-N 3.14Å | ||
| 255 | P | 43.8 | Very low | 50.7 | Low | 114 Ų | 114 | 112.3 Ų | 112.3 | 74% | 0.74 | 68% | 0.677 | S | S | * | * | trans | -65.8 | 114 | -164 | 22.7 | -33.9 | 0 | 0 | 0 | 113.7 | N257 | P255-N257 VanDerWaalsContact C-N 3.31Å; P255-N257 PolarHBondContact O-N 3.43Å | ||
| 256 | A | 49.5 | Very low | 52.2 | Low | 92 Ų | 92 | 114.1 Ų | 114.1 | 76% | 0.76 | 67% | 0.673 | S | S | * | * | trans | -82.1 | 63 | -175.9 | 0 | 0 | 0 | 0 | 0 | 113.2 | T254 G258 | T254-A256 PolarHBondContact O-N 2.84Å; T254-A256 VanDerWaalsContact O-N 3.14Å; A256-G258 VanDerWaalsContact C-N 3.28Å; A256-G258 PolarHBondContact O-N 2.91Å | ||
| 257 | N | 48.4 | Very low | 53.6 | Low | 118 Ų | 118 | 107.3 Ų | 107.3 | 63% | 0.631 | 65% | 0.653 | S | S | * | * | trans | -73.3 | -15 | 179 | -80.1 | -1.6 | 0 | 0 | 0 | 114.4 | P255 S259 T261 | P255-N257 VanDerWaalsContact C-N 3.31Å; P255-N257 PolarHBondContact O-N 3.43Å; N257-S259 PolarHBondContact O-N 3.13Å; N257-T261 PolarHBondContact O-OG1 3.42Å | ||
| 258 | G | 52.3 | Low | 55.5 | Low | 57 Ų | 57 | 101 Ų | 101 | 59% | 0.588 | 63% | 0.634 | S | S | * | * | H | α-helix | trans | -71.2 | -30.4 | -161 | 0 | 0 | 0 | 0 | 0 | 118.3 | A256 T261 | A256-G258 VanDerWaalsContact C-N 3.28Å; A256-G258 PolarHBondContact O-N 2.91Å; G258-T261 PolarHBondContact O-OG1 2.04Å; G258-T261 VanDerWaalsContact O-OG1 3.05Å |
| 259 | S | 55 | Low | 57.8 | Low | 85 Ų | 85 | 101.6 Ų | 101.6 | 59% | 0.594 | 63% | 0.626 | S | S | * | * | H | α-helix | trans | -80.9 | -47 | 178.5 | 64.6 | 0 | 0 | 0 | 0 | 111.6 | N257 T261 L262 D263 | N257-S259 PolarHBondContact O-N 3.13Å; S259-T261 PolarHBondContact O-N 3.39Å; S259-L262 WeakPolarHBondContact O-CB 3.17Å; S259-L262 PolarHBondContact O-N 2.03Å; S259-D263 PolarHBondContact O-N 3.35Å |
| 260 | S | 54.7 | Low | 59.7 | Low | 55 Ų | 55 | 97.6 Ų | 97.6 | 39% | 0.385 | 60% | 0.604 | S | S | . | * | H | α-helix | trans | -63.8 | -13.2 | -176.6 | 87.6 | 0 | 0 | 0 | 0 | 114 | K264 | S260-K264 VanDerWaalsContact O-CD 3.28Å; S260-K264 WeakPolarHBondContact O-CD 3.39Å; S260-K264 WeakPolarHBondContact O-CE 3.27Å; S260-K264 WeakPolarHBondContact O-CG 3.45Å; S260-K264 PolarHBondContact O-NZ 3.03Å; S260-K264 PolarHBondContact OG-NZ 2.85Å |
| 261 | T | 57.2 | Low | 61.3 | Low | 75 Ų | 75 | 99.3 Ų | 99.3 | 46% | 0.46 | 60% | 0.6 | S | S | . | * | H | α-helix | trans | -84.6 | -34.8 | 170.3 | 46.5 | 0 | 0 | 0 | 0 | 112.7 | N257 G258 S259 K264 T265 | N257-T261 PolarHBondContact O-OG1 3.42Å; G258-T261 PolarHBondContact O-OG1 2.04Å; G258-T261 VanDerWaalsContact O-OG1 3.05Å; S259-T261 PolarHBondContact O-N 3.39Å; T261-K264 PolarHBondContact O-N 3.11Å; T261-T265 WeakPolarHBondContact O-CG2 3.31Å; T261-T265 PolarHBondContact O-N 2.9Å; T261-T265 PolarHBondContact O-OG1 3.08Å |
| 262 | L | 55.7 | Low | 63.7 | Low | 118 Ų | 118 | 97.2 Ų | 97.2 | 62% | 0.618 | 58% | 0.583 | S | S | * | * | H | α-helix | trans | -63 | -50.9 | -179.4 | -167.9 | 78.5 | 0 | 0 | 0 | 110.7 | S259 K264 T265 L266 | S259-L262 WeakPolarHBondContact O-CB 3.17Å; S259-L262 PolarHBondContact O-N 2.03Å; L262-K264 VanDerWaalsContact C-N 3.29Å; L262-K264 PolarHBondContact O-N 3.34Å; L262-T265 PolarHBondContact O-N 3.32Å; L262-T265 VanDerWaalsContact O-N 3.13Å; L262-T265 PolarHBondContact O-OG1 3.02Å; L262-L266 PolarHBondContact O-N 2.99Å |
| 263 | D | 62.3 | Low | 65.9 | Low | 102 Ų | 102 | 99.1 Ų | 99.1 | 55% | 0.545 | 58% | 0.577 | S | S | . | * | H | α-helix | trans | -65.2 | -34.8 | -177.4 | -52.4 | -41.2 | 0 | 0 | 0 | 111.8 | S259 L266 A267 | S259-D263 PolarHBondContact O-N 3.35Å; D263-L266 PolarHBondContact O-N 3.47Å; D263-A267 PolarHBondContact O-N 2.8Å |
| 264 | K | 72.9 | Confident | 68 | Low | 125 Ų | 125 | 99.3 Ų | 99.3 | 54% | 0.543 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -61.3 | -49.8 | 171.6 | -71.6 | 179 | -169.4 | 102.5 | 0 | 111.1 | S260 T261 L262 L266 A267 E268 | S260-K264 VanDerWaalsContact O-CD 3.28Å; S260-K264 WeakPolarHBondContact O-CD 3.39Å; S260-K264 WeakPolarHBondContact O-CE 3.27Å; S260-K264 WeakPolarHBondContact O-CG 3.45Å; S260-K264 PolarHBondContact O-NZ 3.03Å; S260-K264 PolarHBondContact OG-NZ 2.85Å; T261-K264 PolarHBondContact O-N 3.11Å; L262-K264 VanDerWaalsContact C-N 3.29Å; L262-K264 PolarHBondContact O-N 3.34Å; K264-L266 VanDerWaalsContact C-N 3.27Å; K264-L266 PolarHBondContact O-N 3.12Å; K264-A267 PolarHBondContact O-N 2.91Å; K264-E268 VanDerWaalsContact O-CB 3.26Å; K264-E268 WeakPolarHBondContact O-CB 3.5Å; K264-E268 PolarHBondContact O-N 3.14Å |
| 265 | T | 75 | Confident | 70.4 | Confident | 67 Ų | 67 | 100.1 Ų | 100.1 | 41% | 0.411 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -63.4 | -31.4 | 178 | 56.8 | 0 | 0 | 0 | 0 | 112.9 | T261 L262 N269 | T261-T265 WeakPolarHBondContact O-CG2 3.31Å; T261-T265 PolarHBondContact O-N 2.9Å; T261-T265 PolarHBondContact O-OG1 3.08Å; L262-T265 PolarHBondContact O-N 3.32Å; L262-T265 VanDerWaalsContact O-N 3.13Å; L262-T265 PolarHBondContact O-OG1 3.02Å; T265-N269 VanDerWaalsContact O-CB 3.24Å; T265-N269 WeakPolarHBondContact O-CB 3.47Å; T265-N269 PolarHBondContact O-N 3.1Å; T265-N269 PolarHBondContact O-ND2 2.85Å |
| 266 | L | 77 | Confident | 72.6 | Confident | 127 Ų | 127 | 99.5 Ų | 99.5 | 67% | 0.665 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -70.6 | -44 | 176.3 | -169.9 | 65.1 | 0 | 0 | 0 | 111.8 | L262 D263 K264 A270 | L262-L266 PolarHBondContact O-N 2.99Å; D263-L266 PolarHBondContact O-N 3.47Å; K264-L266 VanDerWaalsContact C-N 3.27Å; K264-L266 PolarHBondContact O-N 3.12Å; L266-A270 WeakPolarHBondContact O-CB 3.33Å; L266-A270 PolarHBondContact O-N 3.35Å |
| 267 | A | 78.8 | Confident | 74.5 | Confident | 54 Ų | 54 | 99.8 Ų | 99.8 | 45% | 0.446 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -65.3 | -41.8 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | D263 K264 A270 Q271 | D263-A267 PolarHBondContact O-N 2.8Å; K264-A267 PolarHBondContact O-N 2.91Å; A267-A270 PolarHBondContact O-N 2.83Å; A267-Q271 WeakPolarHBondContact O-CG 3.28Å; A267-Q271 PolarHBondContact O-N 3.37Å |
| 268 | E | 82.7 | Confident | 76.4 | Confident | 116 Ų | 116 | 99.6 Ų | 99.6 | 54% | 0.542 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -63.1 | -44.7 | 176.4 | -173.4 | 177.1 | 175 | 0 | 0 | 111.7 | K264 A270 Q271 M272 | K264-E268 VanDerWaalsContact O-CB 3.26Å; K264-E268 WeakPolarHBondContact O-CB 3.5Å; K264-E268 PolarHBondContact O-N 3.14Å; E268-A270 PolarHBondContact O-N 2.85Å; E268-Q271 PolarHBondContact O-N 3.47Å; E268-M272 WeakPolarHBondContact O-CB 3.41Å; E268-M272 PolarHBondContact O-N 3.34Å |
| 269 | N | 83.9 | Confident | 78.2 | Confident | 94 Ų | 94 | 101.7 Ų | 101.7 | 50% | 0.503 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -62.9 | -39.2 | 174.6 | -76 | -31.2 | 0 | 0 | 0 | 112.5 | T265 M272 Y273 | T265-N269 VanDerWaalsContact O-CB 3.24Å; T265-N269 WeakPolarHBondContact O-CB 3.47Å; T265-N269 PolarHBondContact O-N 3.1Å; T265-N269 PolarHBondContact O-ND2 2.85Å; N269-M272 PolarHBondContact O-N 3.28Å; N269-Y273 PolarHBondContact O-N 2.87Å |
| 270 | A | 87.1 | Confident | 79.8 | Confident | 49 Ų | 49 | 104.2 Ų | 104.2 | 41% | 0.405 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -64.8 | -43.9 | 176.1 | 0 | 0 | 0 | 0 | 0 | 111.9 | L266 A267 E268 M272 Y273 H274 | L266-A270 WeakPolarHBondContact O-CB 3.33Å; L266-A270 PolarHBondContact O-N 3.35Å; A267-A270 PolarHBondContact O-N 2.83Å; E268-A270 PolarHBondContact O-N 2.85Å; A270-M272 PolarHBondContact O-N 3.15Å; A270-Y273 PolarHBondContact O-N 2.88Å; A270-H274 PolarHBondContact O-CD2 2.96Å; A270-H274 PolarHBondContact O-N 3.34Å |
| 271 | Q | 84.1 | Confident | 81.1 | Confident | 146 Ų | 146 | 106.7 Ų | 106.7 | 68% | 0.682 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -62 | -42.3 | 174.2 | -72.2 | 179.7 | -5.9 | 0 | 0 | 111.8 | A267 E268 Y273 H274 Y275 | A267-Q271 WeakPolarHBondContact O-CG 3.28Å; A267-Q271 PolarHBondContact O-N 3.37Å; E268-Q271 PolarHBondContact O-N 3.47Å; Q271-Y273 VanDerWaalsContact C-N 3.35Å; Q271-Y273 PolarHBondContact O-N 3.01Å; Q271-H274 PolarHBondContact O-N 2.82Å; Q271-Y275 PolarHBondContact O-N 2.91Å; Q271-Y275 VanDerWaalsContact O-N 3.11Å |
| 272 | M | 86.1 | Confident | 81.9 | Confident | 88 Ų | 88 | 108.5 Ų | 108.5 | 43% | 0.433 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -61.6 | -41.4 | 176.1 | -166.4 | -171.3 | -56.4 | 0 | 0 | 112 | E268 N269 A270 Y275 Q276 | E268-M272 WeakPolarHBondContact O-CB 3.41Å; E268-M272 PolarHBondContact O-N 3.34Å; N269-M272 PolarHBondContact O-N 3.28Å; A270-M272 PolarHBondContact O-N 3.15Å; M272-Y275 PolarHBondContact O-N 2.64Å; M272-Q276 HydrophobicContact CG-CG 4.4Å; M272-Q276 WeakPolarHBondContact O-CB 3.44Å; M272-Q276 VanDerWaalsContact O-CG 3.32Å; M272-Q276 WeakPolarHBondContact O-CG 3.3Å; M272-Q276 PolarHBondContact O-N 3.31Å; M272-Q276 PolarHBondContact SD-NE2 3.24Å; M272-Q276 VanDerWaalsContact SD-NE2 3.45Å |
| 273 | Y | 89.5 | Confident | 83 | Confident | 148 Ų | 148 | 108 Ų | 108 | 58% | 0.58 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -61 | -47.7 | 177.9 | -178.5 | -96.9 | 0 | 0 | 0 | 112.1 | N269 A270 Q271 Y275 Q276 H277 | N269-Y273 PolarHBondContact O-N 2.87Å; A270-Y273 PolarHBondContact O-N 2.88Å; Q271-Y273 VanDerWaalsContact C-N 3.35Å; Q271-Y273 PolarHBondContact O-N 3.01Å; Y273-Y275 PolarHBondContact O-N 2.99Å; Y273-Q276 PolarHBondContact O-N 3.08Å; Y273-H277 WeakPolarHBondContact O-CB 3.38Å; Y273-H277 PolarHBondContact O-N 3.2Å |
| 274 | H | 90 | Very high | 83.5 | Confident | 133 Ų | 133 | 107 Ų | 107 | 62% | 0.616 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -60.8 | -43.2 | 176.9 | -74.8 | -67.5 | 0 | 0 | 0 | 112.3 | A270 Q271 H277 Q278 | A270-H274 PolarHBondContact O-CD2 2.96Å; A270-H274 PolarHBondContact O-N 3.34Å; Q271-H274 PolarHBondContact O-N 2.82Å; H274-H277 PolarHBondContact O-N 3.38Å; H274-Q278 WeakPolarHBondContact O-CB 3.46Å; H274-Q278 PolarHBondContact O-N 3.33Å |
| 275 | Y | 92.2 | Very high | 83.2 | Confident | 139 Ų | 139 | 108 Ų | 108 | 55% | 0.545 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -64 | -42.8 | 176.6 | 179.2 | -99.6 | 0 | 0 | 0 | 112.6 | Q271 M272 Y273 K279 | Q271-Y275 PolarHBondContact O-N 2.91Å; Q271-Y275 VanDerWaalsContact O-N 3.11Å; M272-Y275 PolarHBondContact O-N 2.64Å; Y273-Y275 PolarHBondContact O-N 2.99Å; Y275-K279 HydrophobicContact CE1-CD 4.29Å; Y275-K279 VanDerWaalsContact O-CB 3.3Å; Y275-K279 WeakPolarHBondContact O-CB 3.46Å; Y275-K279 PolarHBondContact O-N 3.29Å |
| 276 | Q | 90.2 | Very high | 82.5 | Confident | 101 Ų | 101 | 107.8 Ų | 107.8 | 47% | 0.472 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -63 | -43.6 | 176.3 | -74.6 | -179.8 | 10 | 0 | 0 | 111.9 | M272 Y273 K279 Q280 | M272-Q276 HydrophobicContact CG-CG 4.4Å; M272-Q276 WeakPolarHBondContact O-CB 3.44Å; M272-Q276 VanDerWaalsContact O-CG 3.32Å; M272-Q276 WeakPolarHBondContact O-CG 3.3Å; M272-Q276 PolarHBondContact O-N 3.31Å; M272-Q276 PolarHBondContact SD-NE2 3.24Å; M272-Q276 VanDerWaalsContact SD-NE2 3.45Å; Y273-Q276 PolarHBondContact O-N 3.08Å; Q276-K279 PolarHBondContact O-N 3.47Å; Q276-Q280 PolarHBondContact O-N 3.35Å |
| 277 | H | 89.6 | Confident | 81.5 | Confident | 98 Ų | 98 | 106.3 Ų | 106.3 | 45% | 0.454 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -62.9 | -48.2 | 177.6 | -171.5 | -76.5 | 0 | 0 | 0 | 111.8 | Y273 H274 K279 Q280 Q281 | Y273-H277 WeakPolarHBondContact O-CB 3.38Å; Y273-H277 PolarHBondContact O-N 3.2Å; H274-H277 PolarHBondContact O-N 3.38Å; H277-K279 VanDerWaalsContact C-N 3.29Å; H277-K279 PolarHBondContact O-N 3.35Å; H277-Q280 PolarHBondContact O-N 3.16Å; H277-Q281 PolarHBondContact O-N 3.33Å |
| 278 | Q | 87.4 | Confident | 80.2 | Confident | 114 Ų | 114 | 112.2 Ų | 112.2 | 53% | 0.533 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -59.7 | -40.9 | 176.1 | -171 | -178.3 | 9.5 | 0 | 0 | 111.5 | H274 Q281 M282 | H274-Q278 WeakPolarHBondContact O-CB 3.46Å; H274-Q278 PolarHBondContact O-N 3.33Å; Q278-Q281 PolarHBondContact O-N 3.47Å; Q278-M282 HydrophobicContact CG-CE 4.38Å; Q278-M282 WeakPolarHBondContact O-CG 3.46Å; Q278-M282 PolarHBondContact O-N 3.4Å |
| 279 | K | 91.9 | Very high | 78.4 | Confident | 101 Ų | 101 | 114.9 Ų | 114.9 | 44% | 0.439 | 58% | 0.576 | S | S | . | * | H | α-helix | trans | -65.4 | -41.8 | 177 | -172.6 | 173.1 | -178.3 | 174.9 | 0 | 112.6 | Y275 Q276 H277 Q281 M282 L283 | Y275-K279 HydrophobicContact CE1-CD 4.29Å; Y275-K279 VanDerWaalsContact O-CB 3.3Å; Y275-K279 WeakPolarHBondContact O-CB 3.46Å; Y275-K279 PolarHBondContact O-N 3.29Å; Q276-K279 PolarHBondContact O-N 3.47Å; H277-K279 VanDerWaalsContact C-N 3.29Å; H277-K279 PolarHBondContact O-N 3.35Å; K279-Q281 VanDerWaalsContact C-N 3.35Å; K279-M282 PolarHBondContact O-N 2.91Å; K279-L283 HydrophobicContact CG-CD1 4.15Å; K279-L283 VanDerWaalsContact O-CG 3.28Å; K279-L283 WeakPolarHBondContact O-CG 3.31Å; K279-L283 PolarHBondContact O-N 2.91Å |
| 280 | Q | 86.7 | Confident | 76.7 | Confident | 138 Ų | 138 | 116 Ų | 116 | 65% | 0.645 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -62.7 | -41.9 | 174.3 | -76.3 | -176.2 | -10.8 | 0 | 0 | 111.8 | Q276 H277 M282 L283 S284 | Q276-Q280 PolarHBondContact O-N 3.35Å; H277-Q280 PolarHBondContact O-N 3.16Å; Q280-M282 PolarHBondContact O-N 3Å; Q280-L283 PolarHBondContact O-N 2.85Å; Q280-S284 PolarHBondContact O-N 2.9Å; Q280-S284 PolarHBondContact O-OG 3.22Å |
| 281 | Q | 82.9 | Confident | 74.6 | Confident | 107 Ų | 107 | 121.9 Ų | 121.9 | 50% | 0.5 | 61% | 0.608 | S | S | . | * | H | α-helix | trans | -64.2 | -37.2 | 177.2 | -169.7 | 174.9 | 4.2 | 0 | 0 | 112.7 | H277 Q278 K279 S284 M285 | H277-Q281 PolarHBondContact O-N 3.33Å; Q278-Q281 PolarHBondContact O-N 3.47Å; K279-Q281 VanDerWaalsContact C-N 3.35Å; Q281-S284 PolarHBondContact O-OG 3.13Å; Q281-S284 VanDerWaalsContact O-OG 3.09Å; Q281-M285 VanDerWaalsContact O-CG 3.26Å; Q281-M285 WeakPolarHBondContact O-CG 3.43Å; Q281-M285 PolarHBondContact O-N 3.36Å |
| 282 | M | 74.1 | Confident | 72.5 | Confident | 113 Ų | 113 | 123.4 Ų | 123.4 | 56% | 0.557 | 62% | 0.615 | S | S | * | * | H | α-helix | trans | -68.9 | -36.1 | 172.6 | -70.4 | -172.8 | -62.7 | 0 | 0 | 112.6 | Q278 K279 Q280 G286 | Q278-M282 HydrophobicContact CG-CE 4.38Å; Q278-M282 WeakPolarHBondContact O-CG 3.46Å; Q278-M282 PolarHBondContact O-N 3.4Å; K279-M282 PolarHBondContact O-N 2.91Å; Q280-M282 PolarHBondContact O-N 3Å; M282-G286 WeakPolarHBondContact O-CA 3.35Å; M282-G286 PolarHBondContact O-N 3.37Å |
| 283 | L | 78.2 | Confident | 70 | Confident | 109 Ų | 109 | 129.1 Ų | 129.1 | 57% | 0.571 | 64% | 0.638 | S | S | * | * | H | α-helix | trans | -71.4 | -37 | 178.7 | -71.7 | 167.6 | 0 | 0 | 0 | 112.8 | K279 Q280 S287 | K279-L283 HydrophobicContact CG-CD1 4.15Å; K279-L283 VanDerWaalsContact O-CG 3.28Å; K279-L283 WeakPolarHBondContact O-CG 3.31Å; K279-L283 PolarHBondContact O-N 2.91Å; Q280-L283 PolarHBondContact O-N 2.85Å; L283-S287 PolarHBondContact O-OG 3.21Å |
| 284 | S | 72.9 | Confident | 67.4 | Low | 79 Ų | 79 | 125.3 Ų | 125.3 | 55% | 0.552 | 64% | 0.644 | S | S | * | * | H | α-helix | trans | -69.1 | -39.8 | 175.1 | 58.8 | 0 | 0 | 0 | 0 | 112.3 | Q280 Q281 | Q280-S284 PolarHBondContact O-N 2.9Å; Q280-S284 PolarHBondContact O-OG 3.22Å; Q281-S284 PolarHBondContact O-OG 3.13Å; Q281-S284 VanDerWaalsContact O-OG 3.09Å |
| 285 | M | 66.2 | Low | 65 | Low | 146 Ų | 146 | 126.5 Ų | 126.5 | 72% | 0.719 | 65% | 0.654 | S | S | * | * | H | α-helix | trans | -74.8 | -34.3 | 176.7 | -64.1 | -63.2 | -176.7 | 0 | 0 | 113 | Q281 S287 | Q281-M285 VanDerWaalsContact O-CG 3.26Å; Q281-M285 WeakPolarHBondContact O-CG 3.43Å; Q281-M285 PolarHBondContact O-N 3.36Å; M285-S287 PolarHBondContact O-N 2.87Å |
| 286 | G | 62 | Low | 62.4 | Low | 64 Ų | 64 | 127 Ų | 127 | 66% | 0.66 | 67% | 0.666 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.6 | -2 | -177.4 | 0 | 0 | 0 | 0 | 0 | 115.7 | M282 H288 | M282-G286 WeakPolarHBondContact O-CA 3.35Å; M282-G286 PolarHBondContact O-N 3.37Å; G286-H288 VanDerWaalsContact C-N 3.35Å; G286-H288 PolarHBondContact O-N 2.95Å |
| 287 | S | 54.2 | Low | 59.9 | Low | 96 Ų | 96 | 127.4 Ų | 127.4 | 67% | 0.671 | 69% | 0.686 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.6 | 3.4 | -174.3 | -66.5 | 0 | 0 | 0 | 0 | 114.7 | L283 M285 K289 | L283-S287 PolarHBondContact O-OG 3.21Å; M285-S287 PolarHBondContact O-N 2.87Å; S287-K289 PolarHBondContact O-N 2.89Å |
| 288 | H | 51.9 | Low | 57.6 | Low | 178 Ų | 178 | 131.9 Ų | 131.9 | 82% | 0.824 | 71% | 0.707 | S | S | * | * | trans | -90.4 | 76.4 | 172.6 | -86.4 | -78.2 | 0 | 0 | 0 | 112.5 | G286 | G286-H288 VanDerWaalsContact C-N 3.35Å; G286-H288 PolarHBondContact O-N 2.95Å | ||
| 289 | K | 44.7 | Very low | 55.3 | Low | 171 Ų | 171 | 130 Ų | 130 | 74% | 0.743 | 71% | 0.711 | S | S | * | * | trans | -78.8 | 124.4 | 161.1 | -172.6 | -175.4 | 178.9 | -168.1 | 0 | 108.9 | S287 E291 | S287-K289 PolarHBondContact O-N 2.89Å; K289-E291 PolarHBondContact O-N 2.94Å | ||
| 290 | P | 48 | Very low | 52.6 | Low | 119 Ų | 119 | 131.3 Ų | 131.3 | 77% | 0.773 | 73% | 0.728 | S | S | * | * | trans | -74.4 | 119.4 | 175.6 | 29 | -32.9 | 0 | 0 | 0 | 110.6 | ||||
| 291 | E | 44.8 | Very low | 50.3 | Low | 172 Ų | 172 | 129.6 Ų | 129.6 | 80% | 0.804 | 73% | 0.731 | S | S | * | * | trans | -101.7 | 100.8 | 167.8 | -72.2 | -144.3 | 124.2 | 0 | 0 | 111.1 | K289 | K289-E291 PolarHBondContact O-N 2.94Š| ||
| 292 | Q | 39.8 | Very low | 48.2 | Very low | 178 Ų | 178 | 130.9 Ų | 130.9 | 83% | 0.832 | 74% | 0.741 | S | S | * | * | trans | -168.3 | 110.3 | 144.9 | -114.2 | 175.5 | 5.2 | 0 | 0 | 113.5 | ||||
| 293 | K | 32.5 | Very low | 46.9 | Very low | 208 Ų | 208 | 133.1 Ų | 133.1 | 90% | 0.904 | 75% | 0.75 | S | S | * | * | trans | 59.5 | 146 | 163.4 | -59.5 | 176.9 | 176.3 | 179.2 | 0 | 117.3 | ||||
| 294 | G | 36 | Very low | 45.6 | Very low | 68 Ų | 68 | 137.2 Ų | 137.2 | 70% | 0.701 | 77% | 0.766 | S | S | * | * | cis | 132.9 | 140 | -3.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 295 | L | 39.2 | Very low | 44.4 | Very low | 158 Ų | 158 | 142.6 Ų | 142.6 | 83% | 0.827 | 78% | 0.783 | S | S | * | * | trans | 85 | 98.6 | -178.2 | -50.5 | 176.4 | 0 | 0 | 0 | 116.7 | ||||
| 296 | D | 37.8 | Very low | 43.9 | Very low | 150 Ų | 150 | 142.9 Ų | 142.9 | 80% | 0.802 | 79% | 0.793 | S | S | * | * | 56.2 | 114 | 118.9 | -41.6 | -23.8 | 0 | 0 | 0 | 121.4 | |||||
| 297 | A | 37.5 | Very low | 43.2 | Very low | 108 Ų | 108 | 143 Ų | 143 | 89% | 0.893 | 79% | 0.794 | S | S | * | * | trans | -151.2 | 129.7 | 142.3 | 0 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 298 | E | 40.3 | Very low | 43.3 | Very low | 193 Ų | 193 | 142.7 Ų | 142.7 | 90% | 0.902 | 81% | 0.806 | S | S | * | * | trans | -116 | 159.7 | -179.5 | -171.1 | 173.3 | 94.6 | 0 | 0 | 110.6 | ||||
| 299 | A | 39.6 | Very low | 43.1 | Very low | 73 Ų | 73 | 137.1 Ų | 137.1 | 60% | 0.603 | 80% | 0.796 | S | S | * | * | trans | 92.9 | 133.6 | 153.1 | 0 | 0 | 0 | 0 | 0 | 121.5 | ||||
| 300 | T | 35 | Very low | 43.4 | Very low | 130 Ų | 130 | 138.1 Ų | 138.1 | 80% | 0.798 | 80% | 0.801 | S | S | * | * | trans | 74.3 | 136.9 | 147 | 56.7 | 0 | 0 | 0 | 0 | 123.2 | ||||
| 301 | S | 38.1 | Very low | 43.7 | Very low | 102 Ų | 102 | 138.8 Ų | 138.8 | 71% | 0.713 | 80% | 0.803 | S | S | * | * | trans | 65.5 | 160.3 | 139.6 | -78.5 | 0 | 0 | 0 | 0 | 120.3 | ||||
| 302 | D | 38.9 | Very low | 44.7 | Very low | 134 Ų | 134 | 135.2 Ų | 135.2 | 72% | 0.717 | 79% | 0.792 | S | S | * | * | cis | -157.6 | -171.9 | -19.8 | -121.2 | 34.2 | 0 | 0 | 0 | 109.2 | ||||
| 303 | E | 46.3 | Very low | 45.4 | Very low | 160 Ų | 160 | 135.8 Ų | 135.8 | 75% | 0.748 | 79% | 0.789 | S | S | * | * | trans | -29.8 | 143.2 | 174.8 | -27.1 | -67.2 | -145.2 | 0 | 0 | 119.5 | ||||
| 304 | E | 51.8 | Low | 46.9 | Very low | 194 Ų | 194 | 134.2 Ų | 134.2 | 91% | 0.907 | 78% | 0.784 | S | S | * | * | trans | 30.4 | 116.2 | 149.2 | -56.2 | -164.7 | 147.7 | 0 | 0 | 122.7 | ||||
| 305 | E | 48.6 | Very low | 47.9 | Very low | 192 Ų | 192 | 136.3 Ų | 136.3 | 90% | 0.897 | 79% | 0.787 | S | S | * | * | trans | -142.5 | 138.2 | 134.8 | -167.4 | 171.8 | 172.1 | 0 | 0 | 111.9 | G307 | E305-G307 PolarHBondContact O-N 2.89Š| ||
| 306 | V | 54.5 | Low | 49.1 | Very low | 153 Ų | 153 | 134.2 Ų | 134.2 | 93% | 0.927 | 78% | 0.783 | S | S | * | * | trans | -85.9 | 86.1 | -180 | 179 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 307 | G | 48.4 | Very low | 49.8 | Very low | 66 Ų | 66 | 130.4 Ų | 130.4 | 68% | 0.68 | 78% | 0.779 | S | S | * | * | trans | -104.8 | 118.7 | 174.3 | 0 | 0 | 0 | 0 | 0 | 113.1 | E305 G309 | E305-G307 PolarHBondContact O-N 2.89Å; G307-G309 PolarHBondContact O-N 3.35Å | ||
| 308 | G | 55.9 | Low | 50.6 | Low | 90 Ų | 90 | 133.7 Ų | 133.7 | 93% | 0.928 | 78% | 0.781 | S | S | * | * | trans | -73.4 | 94.3 | -177.3 | 0 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 309 | G | 48.2 | Very low | 51.3 | Low | 60 Ų | 60 | 128.2 Ų | 128.2 | 62% | 0.619 | 77% | 0.769 | S | S | * | * | trans | -104.9 | 91 | 173.5 | 0 | 0 | 0 | 0 | 0 | 113.3 | G307 T311 | G307-G309 PolarHBondContact O-N 3.35Å; G309-T311 PolarHBondContact O-N 3.42Å | ||
| 310 | F | 50.3 | Low | 52.1 | Low | 193 Ų | 193 | 130.9 Ų | 130.9 | 85% | 0.846 | 78% | 0.78 | S | S | * | * | trans | -74.5 | 74.3 | 174 | 177.7 | -105.6 | 0 | 0 | 0 | 110.7 | V312 | F310-V312 HydrophobicContact CD1-CB 4.5Å; F310-V312 HydrophobicContact CD1-CG2 4.08Å; F310-V312 HydrophobicContact CE1-CB 4.08Å; F310-V312 HydrophobicContact CE1-CG2 3.39Å; F310-V312 HydrophobicContact CE2-CG2 3.88Å; F310-V312 HydrophobicContact CZ-CB 4.42Å; F310-V312 HydrophobicContact CZ-CG2 3.29Å; F310-V312 PolarHBondContact O-N 2.91Å | ||
| 311 | T | 53.7 | Low | 53.2 | Low | 133 Ų | 133 | 131.9 Ų | 131.9 | 82% | 0.816 | 79% | 0.786 | S | S | * | * | trans | -78.5 | 68.3 | 177.7 | 56.8 | 0 | 0 | 0 | 0 | 111.3 | G309 Y313 | G309-T311 PolarHBondContact O-N 3.42Å; T311-Y313 PolarHBondContact O-N 3.24Å | ||
| 312 | V | 67.3 | Low | 54.5 | Low | 96 Ų | 96 | 129.6 Ų | 129.6 | 58% | 0.582 | 78% | 0.778 | S | S | * | * | trans | -59.1 | 118.3 | 154.3 | 161.6 | 0 | 0 | 0 | 0 | 106.9 | F310 E314 | F310-V312 HydrophobicContact CD1-CB 4.5Å; F310-V312 HydrophobicContact CD1-CG2 4.08Å; F310-V312 HydrophobicContact CE1-CB 4.08Å; F310-V312 HydrophobicContact CE1-CG2 3.39Å; F310-V312 HydrophobicContact CE2-CG2 3.88Å; F310-V312 HydrophobicContact CZ-CB 4.42Å; F310-V312 HydrophobicContact CZ-CG2 3.29Å; F310-V312 PolarHBondContact O-N 2.91Å; V312-E314 PolarHBondContact O-N 3.01Å; V312-E314 VanDerWaalsContact O-N 3.12Å | ||
| 313 | Y | 52.6 | Low | 55.9 | Low | 191 Ų | 191 | 131.8 Ų | 131.8 | 75% | 0.749 | 78% | 0.784 | S | S | * | * | trans | -63.6 | 113.2 | 171.1 | -177.8 | -91.2 | 0 | 0 | 0 | 108.1 | T311 C315 | T311-Y313 PolarHBondContact O-N 3.24Å; Y313-C315 PolarHBondContact O-N 3.48Å | ||
| 314 | E | 64 | Low | 56.7 | Low | 174 Ų | 174 | 132.1 Ų | 132.1 | 81% | 0.813 | 79% | 0.788 | S | S | * | * | trans | -68.4 | 104.3 | -173.1 | -149.7 | 175.4 | -168.6 | 0 | 0 | 109.4 | V312 P316 | V312-E314 PolarHBondContact O-N 3.01Å; V312-E314 VanDerWaalsContact O-N 3.12Å; E314-P316 WeakPolarHBondContact O-CD 3.34Å; E314-P316 VanDerWaalsContact O-N 3.12Å | ||
| 315 | C | 58.8 | Low | 57.6 | Low | 113 Ų | 113 | 129.6 Ų | 129.6 | 76% | 0.764 | 78% | 0.776 | S | S | * | * | trans | -59.9 | 112.8 | 179.6 | -74.3 | 0 | 0 | 0 | 0 | 110 | Y313 G317 | Y313-C315 PolarHBondContact O-N 3.48Å; C315-G317 PolarHBondContact O-N 2.92Å | ||
| 316 | P | 62.8 | Low | 58.7 | Low | 113 Ų | 113 | 126.2 Ų | 126.2 | 73% | 0.734 | 77% | 0.768 | S | S | * | * | trans | -69.8 | 120.4 | -172 | -20.5 | 34 | 0 | 0 | 0 | 111.6 | E314 | E314-P316 WeakPolarHBondContact O-CD 3.34Å; E314-P316 VanDerWaalsContact O-N 3.12Å | ||
| 317 | G | 54.3 | Low | 59.4 | Low | 71 Ų | 71 | 125.4 Ų | 125.4 | 73% | 0.732 | 75% | 0.752 | S | S | * | * | trans | 69.2 | 94.2 | 166.7 | 0 | 0 | 0 | 0 | 0 | 115.3 | C315 | C315-G317 PolarHBondContact O-N 2.92Š| ||
| 318 | L | 53 | Low | 60.2 | Low | 176 Ų | 176 | 126 Ų | 126 | 92% | 0.921 | 74% | 0.74 | S | S | * | * | P | Polyproline II helix | trans | -54.1 | 147.5 | 147 | -72.1 | 170.5 | 0 | 0 | 0 | 109.1 | ||
| 319 | A | 55.7 | Low | 60.9 | Low | 79 Ų | 79 | 127.3 Ų | 127.3 | 65% | 0.653 | 73% | 0.732 | S | S | * | * | P | Polyproline II helix | trans | -54.4 | 146.4 | -172.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | T321 | A319-T321 PolarHBondContact O-N 3.1Š|
| 320 | P | 55.4 | Low | 61.4 | Low | 129 Ų | 129 | 131.2 Ų | 131.2 | 84% | 0.838 | 74% | 0.738 | S | S | * | * | P | Polyproline II helix | trans | -55 | 117.4 | 177.6 | -24.3 | 33.6 | 0 | 0 | 0 | 111 | G322 | P320-G322 PolarHBondContact O-N 3.25Š|
| 321 | T | 58.8 | Low | 61.9 | Low | 151 Ų | 151 | 129.4 Ų | 129.4 | 93% | 0.926 | 73% | 0.73 | S | S | * | * | trans | -77 | 59.2 | 172.3 | 53.6 | 0 | 0 | 0 | 0 | 110.2 | A319 | A319-T321 PolarHBondContact O-N 3.1Š| ||
| 322 | G | 66.3 | Low | 62.2 | Low | 53 Ų | 53 | 129.4 Ų | 129.4 | 55% | 0.546 | 73% | 0.725 | S | S | . | * | trans | -80.7 | 143.2 | 162.7 | 0 | 0 | 0 | 0 | 0 | 109.6 | P320 M324 | P320-G322 PolarHBondContact O-N 3.25Å; G322-M324 PolarHBondContact O-N 3.36Å | ||
| 323 | E | 67.8 | Low | 61.7 | Low | 181 Ų | 181 | 132.5 Ų | 132.5 | 85% | 0.846 | 74% | 0.738 | S | S | * | * | trans | -67.5 | 95.8 | 179.2 | 59 | -127.9 | 132.6 | 0 | 0 | 111.6 | E325 | E323-E325 VanDerWaalsContact C-N 3.27Å; E323-E325 PolarHBondContact O-N 3.37Å | ||
| 324 | M | 63.7 | Low | 62 | Low | 167 Ų | 167 | 128.5 Ų | 128.5 | 82% | 0.823 | 74% | 0.738 | S | S | * | * | trans | -77.9 | 78.3 | 179.3 | -169.9 | 167 | 64.2 | 0 | 0 | 110.7 | G322 V326 | G322-M324 PolarHBondContact O-N 3.36Å; M324-V326 HydrophobicContact CG-CG2 4.35Å; M324-V326 PolarHBondContact O-N 2.86Å | ||
| 325 | E | 69.7 | Low | 61.5 | Low | 140 Ų | 140 | 126.4 Ų | 126.4 | 65% | 0.654 | 74% | 0.738 | S | S | * | * | trans | -63.2 | 94.9 | 171.4 | -69.2 | -166.3 | 128.6 | 0 | 0 | 111.1 | E323 K327 | E323-E325 VanDerWaalsContact C-N 3.27Å; E323-E325 PolarHBondContact O-N 3.37Å; E325-K327 HydrophobicContact CB-CD 4.3Å; E325-K327 VanDerWaalsContact CD-NZ 3.26Å; E325-K327 PolarHBondContact O-N 3.01Å; E325-K327 IonicContact OE1-NZ 3.19Å; E325-K327 PolarHBondContact OE1-NZ 3.08Å; E325-K327 IonicContact OE2-NZ 3.27Å; E325-K327 PolarHBondContact OE2-NZ 3.26Å | ||
| 326 | V | 71.3 | Confident | 61 | Low | 121 Ų | 121 | 126.4 Ų | 126.4 | 73% | 0.733 | 74% | 0.736 | S | S | * | * | trans | -74.5 | 79.8 | 171.7 | -173.1 | 0 | 0 | 0 | 0 | 109.4 | M324 N328 | M324-V326 HydrophobicContact CG-CG2 4.35Å; M324-V326 PolarHBondContact O-N 2.86Å; V326-N328 PolarHBondContact O-N 3.17Å | ||
| 327 | K | 70.1 | Confident | 60 | Low | 137 Ų | 137 | 128.7 Ų | 128.7 | 60% | 0.596 | 74% | 0.742 | S | S | * | * | trans | -55.8 | 119.4 | 165 | -101.6 | 73.4 | 171.5 | 174.2 | 0 | 108.6 | E325 P329 | E325-K327 HydrophobicContact CB-CD 4.3Å; E325-K327 VanDerWaalsContact CD-NZ 3.26Å; E325-K327 PolarHBondContact O-N 3.01Å; E325-K327 IonicContact OE1-NZ 3.19Å; E325-K327 PolarHBondContact OE1-NZ 3.08Å; E325-K327 IonicContact OE2-NZ 3.27Å; E325-K327 PolarHBondContact OE2-NZ 3.26Å; K327-P329 WeakPolarHBondContact O-CD 3.34Å | ||
| 328 | N | 65.5 | Low | 59.4 | Low | 79 Ų | 79 | 135.5 Ų | 135.5 | 42% | 0.422 | 75% | 0.747 | S | S | . | * | trans | -83.8 | 119.3 | 168.9 | 177.5 | 36.4 | 0 | 0 | 0 | 108.9 | V326 L330 F331 | V326-N328 PolarHBondContact O-N 3.17Å; N328-L330 WeakPolarHBondContact ND2-CB 3.46Å; N328-L330 PolarHBondContact O-N 2.99Å; N328-F331 HydrophobicContact CB-CD2 4.17Å; N328-F331 WeakPolarHBondContact ND2-CD2 3.26Å; N328-F331 VanDerWaalsContact ND2-CE2 3.33Å; N328-F331 WeakPolarHBondContact ND2-CE2 3.5Å; N328-F331 PolarHBondContact O-N 3.17Å | ||
| 329 | P | 69.4 | Low | 58.6 | Low | 116 Ų | 116 | 136.7 Ų | 136.7 | 75% | 0.753 | 75% | 0.748 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -65.2 | 10.4 | -178.8 | -22.1 | 34.7 | 0 | 0 | 0 | 116.2 | K327 | K327-P329 WeakPolarHBondContact O-CD 3.34Š|
| 330 | L | 59.6 | Low | 57.4 | Low | 143 Ų | 143 | 136.2 Ų | 136.2 | 75% | 0.749 | 75% | 0.751 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -104.8 | -5.2 | 173.2 | -127 | 75.2 | 0 | 0 | 0 | 113.2 | N328 | N328-L330 WeakPolarHBondContact ND2-CB 3.46Å; N328-L330 PolarHBondContact O-N 2.99Å |
| 331 | F | 60.3 | Low | 56.9 | Low | 154 Ų | 154 | 136.8 Ų | 136.8 | 68% | 0.675 | 75% | 0.745 | S | S | * | * | trans | -134.8 | 87.8 | -179 | -58.1 | -51.5 | 0 | 0 | 0 | 110.7 | N328 | N328-F331 HydrophobicContact CB-CD2 4.17Å; N328-F331 WeakPolarHBondContact ND2-CD2 3.26Å; N328-F331 VanDerWaalsContact ND2-CE2 3.33Å; N328-F331 WeakPolarHBondContact ND2-CE2 3.5Å; N328-F331 PolarHBondContact O-N 3.17Å | ||
| 332 | D | 61 | Low | 56.2 | Low | 134 Ų | 134 | 134.8 Ų | 134.8 | 72% | 0.717 | 74% | 0.735 | S | S | * | * | trans | -98.8 | 116.3 | 164.9 | -76.1 | -46.8 | 0 | 0 | 0 | 109.1 | S334 | D332-S334 PolarHBondContact O-N 3.47Š| ||
| 333 | D | 56.9 | Low | 54.9 | Low | 161 Ų | 161 | 138.3 Ų | 138.3 | 86% | 0.861 | 74% | 0.741 | S | S | * | * | trans | -74.9 | 39.8 | -178.3 | -68.2 | -49.6 | 0 | 0 | 0 | 113.7 | T335 | D333-T335 VanDerWaalsContact C-N 3.31Å; D333-T335 PolarHBondContact O-N 2.83Å | ||
| 334 | S | 58 | Low | 53.4 | Low | 106 Ų | 106 | 138.7 Ų | 138.7 | 74% | 0.741 | 74% | 0.743 | S | S | * | * | trans | -89.6 | 43.1 | -173.9 | -64.1 | 0 | 0 | 0 | 0 | 114 | D332 | D332-S334 PolarHBondContact O-N 3.47Š| ||
| 335 | T | 53.8 | Low | 52.1 | Low | 131 Ų | 131 | 133.9 Ų | 133.9 | 80% | 0.804 | 74% | 0.736 | S | S | * | * | trans | -144.2 | 104 | 167.3 | 55.6 | 0 | 0 | 0 | 0 | 110.8 | D333 | D333-T335 VanDerWaalsContact C-N 3.31Å; D333-T335 PolarHBondContact O-N 2.83Å | ||
| 336 | P | 48.8 | Very low | 50.5 | Low | 112 Ų | 112 | 136.5 Ų | 136.5 | 73% | 0.727 | 75% | 0.748 | S | S | * | * | -127.6 | 172.4 | 103.2 | 40.5 | -33.2 | 0 | 0 | 0 | 110.5 | |||||
| 337 | D | 40.9 | Very low | 48.9 | Very low | 161 Ų | 161 | 135.6 Ų | 135.6 | 86% | 0.861 | 75% | 0.753 | S | S | * | * | cis | -130.1 | 160 | 32.8 | -82.8 | -52.1 | 0 | 0 | 0 | 115.7 | ||||
| 338 | Y | 40.8 | Very low | 47.4 | Very low | 214 Ų | 214 | 133.9 Ų | 133.9 | 84% | 0.839 | 76% | 0.758 | S | S | * | * | trans | -126.6 | 117.4 | 175.9 | -154.6 | -76.4 | 0 | 0 | 0 | 108.9 | ||||
| 339 | Q | 37.1 | Very low | 46.4 | Very low | 201 Ų | 201 | 137.6 Ų | 137.6 | 94% | 0.939 | 78% | 0.775 | S | S | * | * | trans | -148.5 | 130.5 | 174.9 | -156.2 | 173.5 | 59.3 | 0 | 0 | 112.5 | ||||
| 340 | G | 31.6 | Very low | 44.9 | Very low | 69 Ų | 69 | 138.8 Ų | 138.8 | 71% | 0.711 | 78% | 0.775 | S | S | * | * | trans | 109.7 | 87.9 | 170.6 | 0 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 341 | I | 43.3 | Very low | 44.3 | Very low | 142 Ų | 142 | 142.9 Ų | 142.9 | 73% | 0.728 | 78% | 0.781 | S | S | * | * | trans | -103.9 | 137.2 | 157.5 | -59.7 | 176.6 | 0 | 0 | 0 | 107.6 | ||||
| 342 | P | 44.4 | Very low | 43.2 | Very low | 109 Ų | 109 | 141.4 Ų | 141.4 | 71% | 0.708 | 79% | 0.789 | S | S | * | * | trans | -135.6 | 117.1 | 134.7 | 32.7 | -19.2 | 0 | 0 | 0 | 113.6 | ||||
| 343 | N | 38.6 | Very low | 42.2 | Very low | 126 Ų | 126 | 139.3 Ų | 139.3 | 67% | 0.674 | 79% | 0.791 | S | S | * | * | trans | 40.5 | 121.4 | 143.9 | -47 | -44.1 | 0 | 0 | 0 | 120.9 | ||||
| 344 | H | 37.8 | Very low | 41.4 | Very low | 190 Ų | 190 | 137.1 Ų | 137.1 | 88% | 0.88 | 79% | 0.788 | S | S | * | * | 172.6 | 150.7 | 97.1 | -95.8 | -75.2 | 0 | 0 | 0 | 113.4 | |||||
| 345 | G | 35.3 | Very low | 40.6 | Very low | 66 Ų | 66 | 141 Ų | 141 | 68% | 0.68 | 80% | 0.797 | S | S | * | * | trans | 82.4 | 95.1 | 169.3 | 0 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 346 | E | 35.4 | Very low | 39.8 | Very low | 195 Ų | 195 | 140.3 Ų | 140.3 | 91% | 0.911 | 80% | 0.796 | S | S | * | * | 82 | 136.8 | 61.2 | -71.9 | -142.4 | 83.6 | 0 | 0 | 116.3 | |||||
| 347 | A | 39.5 | Very low | 39.5 | Very low | 102 Ų | 102 | 141 Ų | 141 | 84% | 0.843 | 80% | 0.798 | S | S | * | * | trans | 66.3 | 146.5 | 169.5 | 0 | 0 | 0 | 0 | 0 | 118.7 | ||||
| 348 | S | 37.7 | Very low | 39.5 | Very low | 100 Ų | 100 | 144.8 Ų | 144.8 | 70% | 0.699 | 80% | 0.8 | S | S | * | * | cis | -166 | 175.6 | -26.8 | -159.1 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 349 | M | 45.1 | Very low | 39.5 | Very low | 158 Ų | 158 | 142.7 Ų | 142.7 | 78% | 0.778 | 80% | 0.797 | S | S | * | * | trans | -17.4 | 153.8 | 161.2 | -84 | 75.3 | 161.5 | 0 | 0 | 119.1 | ||||
| 350 | D | 37.2 | Very low | 39.8 | Very low | 141 Ų | 141 | 139.5 Ų | 139.5 | 75% | 0.754 | 79% | 0.792 | S | S | * | * | cis | -157.7 | -171 | 5.1 | -138.4 | -51 | 0 | 0 | 0 | 113.2 | ||||
| 351 | R | 46.7 | Very low | 40.6 | Very low | 228 Ų | 228 | 140.9 Ų | 140.9 | 86% | 0.86 | 80% | 0.796 | S | S | * | * | trans | -86.8 | 162.6 | 179.8 | -63.4 | 167.3 | 154.8 | -177.4 | -6.3 | 115.3 | ||||
| 352 | S | 36.8 | Very low | 40.4 | Very low | 123 Ų | 123 | 142 Ų | 142 | 86% | 0.86 | 80% | 0.804 | S | S | * | * | trans | 106.6 | 167.3 | 130.9 | -149.4 | 0 | 0 | 0 | 0 | 119.9 | ||||
| 353 | A | 40 | Very low | 40 | Very low | 91 Ų | 91 | 139.9 Ų | 139.9 | 75% | 0.752 | 80% | 0.801 | S | S | * | * | trans | 75.4 | 92.3 | 166.1 | 0 | 0 | 0 | 0 | 0 | 119.7 | ||||
| 354 | S | 41.4 | Very low | 39.9 | Very low | 115 Ų | 115 | 137.8 Ų | 137.8 | 80% | 0.804 | 81% | 0.809 | S | S | * | * | trans | -53.3 | 142.7 | 155.1 | 131.8 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 355 | M | 40.9 | Very low | 40.1 | Very low | 188 Ų | 188 | 140.4 Ų | 140.4 | 93% | 0.926 | 81% | 0.811 | S | S | * | * | trans | -151.2 | 151.7 | 141.1 | -137.8 | 176.2 | -171.1 | 0 | 0 | 113.8 | ||||
| 356 | C | 37.4 | Very low | 40.2 | Very low | 115 Ų | 115 | 140.4 Ų | 140.4 | 78% | 0.777 | 81% | 0.811 | S | S | * | * | trans | -89.4 | 142.1 | -177.2 | -52.4 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 357 | V | 42.3 | Very low | 40.5 | Very low | 126 Ų | 126 | 139.6 Ų | 139.6 | 76% | 0.764 | 81% | 0.808 | S | S | * | * | trans | -140.5 | 129.2 | 143.5 | 176.6 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 358 | R | 40.6 | Very low | 40.7 | Very low | 242 Ų | 242 | 139.8 Ų | 139.8 | 91% | 0.913 | 80% | 0.803 | S | S | * | * | trans | -93.1 | 140.1 | 158.1 | -72.4 | 179.5 | 173.6 | 127.4 | -5.3 | 107.6 | ||||
| 359 | H | 40.6 | Very low | 41 | Very low | 169 Ų | 169 | 142.4 Ų | 142.4 | 78% | 0.782 | 81% | 0.809 | S | S | * | * | trans | -127.5 | 115.3 | 158.8 | -109.7 | -67.5 | 0 | 0 | 0 | 111.7 | ||||
| 360 | V | 43.3 | Very low | 41.1 | Very low | 135 Ų | 135 | 142.9 Ų | 142.9 | 82% | 0.818 | 81% | 0.807 | S | S | * | * | trans | -101.2 | 142.6 | 152.2 | 174.3 | 0 | 0 | 0 | 0 | 105.8 | ||||
| 361 | A | 47.7 | Very low | 42.2 | Very low | 97 Ų | 97 | 142.1 Ų | 142.1 | 80% | 0.802 | 81% | 0.81 | S | S | * | * | trans | -149.6 | 139.7 | 167.2 | 0 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 362 | D | 39.8 | Very low | 42.5 | Very low | 167 Ų | 167 | 135.6 Ų | 135.6 | 89% | 0.893 | 80% | 0.799 | S | S | * | * | trans | -143.3 | 160.5 | -173.6 | 178.4 | 27.3 | 0 | 0 | 0 | 108.9 | ||||
| 363 | G | 35.9 | Very low | 43.2 | Very low | 63 Ų | 63 | 140.3 Ų | 140.3 | 65% | 0.649 | 82% | 0.823 | S | S | * | * | trans | 108.1 | 51.2 | 147.5 | 0 | 0 | 0 | 0 | 0 | 122.1 | ||||
| 364 | G | 36.7 | Very low | 43.4 | Very low | 82 Ų | 82 | 142.8 Ų | 142.8 | 85% | 0.845 | 83% | 0.826 | S | S | * | * | trans | 64.3 | -163.8 | 148.6 | 0 | 0 | 0 | 0 | 0 | 118.8 | ||||
| 365 | R | 41.2 | Very low | 43.5 | Very low | 246 Ų | 246 | 144.2 Ų | 144.2 | 93% | 0.928 | 83% | 0.827 | S | S | * | * | cis | -161.9 | 141.7 | -11.5 | -179.3 | -172.6 | -65.2 | -123.8 | 1.1 | 110.6 | ||||
| 366 | G | 38.5 | Very low | 43.7 | Very low | 66 Ų | 66 | 141.8 Ų | 141.8 | 68% | 0.68 | 82% | 0.822 | S | S | * | * | trans | 84.9 | 165.3 | 161 | 0 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 367 | E | 41 | Very low | 44 | Very low | 178 Ų | 178 | 143.4 Ų | 143.4 | 83% | 0.832 | 83% | 0.825 | S | S | * | * | cis | -165.2 | 160.4 | -13.2 | -164.7 | 150.9 | 104.3 | 0 | 0 | 109.7 | ||||
| 368 | S | 43.1 | Very low | 44.1 | Very low | 106 Ų | 106 | 144.4 Ų | 144.4 | 74% | 0.741 | 83% | 0.828 | S | S | * | * | trans | 60.4 | 148.9 | 174.6 | 43.8 | 0 | 0 | 0 | 0 | 116.9 | ||||
| 369 | D | 45.7 | Very low | 44.4 | Very low | 154 Ų | 154 | 137.9 Ų | 137.9 | 82% | 0.824 | 82% | 0.823 | S | S | * | * | cis | -152.2 | 174.5 | 28.8 | -135.8 | -31.8 | 0 | 0 | 0 | 114.5 | ||||
| 370 | F | 46.7 | Very low | 44.6 | Very low | 168 Ų | 168 | 135.7 Ų | 135.7 | 74% | 0.737 | 83% | 0.826 | S | S | * | * | trans | -85.5 | 162.9 | 176 | -110.3 | -96 | 0 | 0 | 0 | 112.5 | S372 | F370-S372 WeakPolarHBondContact CE1-OG 3.44Š| ||
| 371 | P | 59.9 | Low | 44.7 | Very low | 126 Ų | 126 | 135.8 Ų | 135.8 | 82% | 0.818 | 83% | 0.826 | S | S | * | * | -144.4 | 160.8 | 98.7 | 38.6 | -24.6 | 0 | 0 | 0 | 115.1 | |||||
| 372 | S | 53.5 | Low | 44.5 | Very low | 90 Ų | 90 | 139 Ų | 139 | 63% | 0.629 | 83% | 0.828 | S | S | * | * | trans | -113.9 | 132.5 | 171 | -56.7 | 0 | 0 | 0 | 0 | 111 | F370 | F370-S372 WeakPolarHBondContact CE1-OG 3.44Š| ||
| 373 | T | 51.9 | Low | 44.9 | Very low | 222 Ų | 222 | 136.5 Ų | 136.5 | 100% | 1.362 | 82% | 0.822 | S | S | * | * | trans | -161.4 | 0 | 139 | 9.7 | 0 | 0 | 0 | 0 | 111 |
Retrieved 373 of 373 residues in 433 ms
(Link to these results)