| 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 | 48.4 | Very low | 51.9 | Low | 245 Ų | 245 | 170.2 Ų | 170.2 | 100% | 1.207 | 79% | 0.785 | S | S | * | * | 0 | 72.3 | 0 | -78.7 | -177.2 | 167.3 | 0 | 0 | 112.3 | |||||
| 2 | K | 52.2 | Low | 52.2 | Low | 223 Ų | 223 | 165.4 Ų | 165.4 | 97% | 0.97 | 77% | 0.77 | S | S | * | * | trans | -118.5 | 26 | 178.4 | -83.9 | -178.5 | 176.1 | 174.9 | 0 | 113.8 | ||||
| 3 | G | 50.7 | Low | 52.4 | Low | 59 Ų | 59 | 161.8 Ų | 161.8 | 61% | 0.608 | 75% | 0.753 | S | S | * | * | S | Bend | trans | -106.3 | -17.3 | -172.1 | 0 | 0 | 0 | 0 | 0 | 117.7 | ||
| 4 | Y | 49.5 | Very low | 52.7 | Low | 226 Ų | 226 | 163.6 Ų | 163.6 | 89% | 0.886 | 75% | 0.75 | S | S | * | * | S | Bend | trans | -98.7 | -3 | -164 | -79.1 | -85.8 | 0 | 0 | 0 | 116.2 | ||
| 5 | R | 50.8 | Low | 53.1 | Low | 236 Ų | 236 | 162.2 Ų | 162.2 | 89% | 0.891 | 74% | 0.744 | S | S | * | * | S | Bend | trans | -91.1 | -14.8 | -176.6 | -125.3 | 178.1 | -174 | -161 | 0.8 | 114.8 | ||
| 6 | N | 49.7 | Very low | 53.3 | Low | 118 Ų | 118 | 163.5 Ų | 163.5 | 63% | 0.631 | 74% | 0.741 | S | S | * | * | S | Bend | trans | -93.5 | -18.3 | -173.9 | -111.1 | -0.2 | 0 | 0 | 0 | 115.2 | K8 | N6-K8 PolarHBondContact O-N 3.49Š|
| 7 | K | 53.7 | Low | 53.5 | Low | 189 Ų | 189 | 163.4 Ų | 163.4 | 82% | 0.822 | 73% | 0.733 | S | S | * | * | H | α-helix | trans | -73.1 | -28 | -178 | -122.7 | 170 | -178.3 | 173.9 | 0 | 113.2 | ||
| 8 | K | 54.5 | Low | 53.8 | Low | 186 Ų | 186 | 160.6 Ų | 160.6 | 81% | 0.809 | 72% | 0.722 | S | S | * | * | H | α-helix | trans | -82.1 | -25.5 | -177.5 | -151.3 | 170.5 | -172.9 | 173.2 | 0 | 113.8 | N6 | N6-K8 PolarHBondContact O-N 3.49Å |
| 9 | K | 53.4 | Low | 54 | Low | 160 Ų | 160 | 153.9 Ų | 153.9 | 70% | 0.696 | 70% | 0.702 | S | S | * | * | H | α-helix | trans | -72.8 | -41.9 | 173.3 | -96.1 | -171.3 | 171.6 | -170.9 | 0 | 111.9 | G11 N12 E13 | K9-G11 PolarHBondContact O-N 3.38Å; K9-N12 PolarHBondContact O-N 3.4Å; K9-E13 PolarHBondContact O-N 3.48Å |
| 10 | R | 54.6 | Low | 54.4 | Low | 192 Ų | 192 | 151.3 Ų | 151.3 | 73% | 0.725 | 69% | 0.691 | S | S | * | * | H | α-helix | trans | -66.9 | -29.3 | -179.5 | -73.6 | -173.4 | 165.9 | -173.7 | -4 | 114.6 | R14 | R10-R14 PolarHBondContact O-N 3.43Å |
| 11 | G | 53.8 | Low | 54.8 | Low | 38 Ų | 38 | 150.3 Ų | 150.3 | 39% | 0.392 | 69% | 0.685 | S | S | . | * | H | α-helix | trans | -68.1 | -41 | 176.1 | 0 | 0 | 0 | 0 | 0 | 113.1 | K9 E13 R14 E15 | K9-G11 PolarHBondContact O-N 3.38Å; G11-E13 PolarHBondContact O-N 3.41Å; G11-R14 PolarHBondContact O-N 2.99Å; G11-E15 PolarHBondContact O-N 3.33Å |
| 12 | N | 55.1 | Low | 55.3 | Low | 113 Ų | 113 | 143.6 Ų | 143.6 | 60% | 0.604 | 65% | 0.654 | S | S | * | * | H | α-helix | trans | -71.5 | -32.2 | -176.5 | -157.8 | 4.1 | 0 | 0 | 0 | 112.4 | K9 R16 | K9-N12 PolarHBondContact O-N 3.4Å; N12-R16 WeakPolarHBondContact O-CB 3.43Å; N12-R16 PolarHBondContact O-N 3.17Å; N12-R16 VanDerWaalsContact O-N 3.08Å |
| 13 | E | 55.2 | Low | 55.7 | Low | 118 Ų | 118 | 140.4 Ų | 140.4 | 55% | 0.551 | 64% | 0.64 | S | S | * | * | H | α-helix | trans | -67 | -39.6 | 173.5 | -116.7 | 167.8 | 168.4 | 0 | 0 | 112.1 | K9 G11 R16 W17 | K9-E13 PolarHBondContact O-N 3.48Å; G11-E13 PolarHBondContact O-N 3.41Å; E13-R16 PolarHBondContact O-N 3.36Å; E13-W17 VanDerWaalsContact O-CD1 3.25Å; E13-W17 PolarHBondContact O-N 3.24Å |
| 14 | R | 56.6 | Low | 56.1 | Low | 187 Ų | 187 | 142.1 Ų | 142.1 | 71% | 0.706 | 63% | 0.634 | S | S | * | * | H | α-helix | trans | -69 | -36.2 | -179.9 | -152.4 | 179.7 | -163.6 | -139.8 | 4.3 | 112.4 | R10 G11 Q18 | R10-R14 PolarHBondContact O-N 3.43Å; G11-R14 PolarHBondContact O-N 2.99Å; R14-Q18 WeakPolarHBondContact O-CG 3.32Å; R14-Q18 PolarHBondContact O-N 3.31Å |
| 15 | E | 58.5 | Low | 56.8 | Low | 143 Ų | 143 | 135 Ų | 135 | 67% | 0.668 | 61% | 0.614 | S | S | * | * | H | α-helix | trans | -70.2 | -37.2 | 173.8 | -72 | -178.9 | 144.7 | 0 | 0 | 111.9 | G11 Q18 G19 | G11-E15 PolarHBondContact O-N 3.33Å; E15-Q18 PolarHBondContact O-N 3.5Å; E15-G19 PolarHBondContact O-N 3.09Å |
| 16 | R | 56.7 | Low | 57.2 | Low | 183 Ų | 183 | 128.9 Ų | 128.9 | 69% | 0.691 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -62.4 | -46.7 | 174.3 | -169.2 | 175.7 | -172 | 165.1 | 3.3 | 111.8 | N12 E13 Q18 G19 E20 | N12-R16 WeakPolarHBondContact O-CB 3.43Å; N12-R16 PolarHBondContact O-N 3.17Å; N12-R16 VanDerWaalsContact O-N 3.08Å; E13-R16 PolarHBondContact O-N 3.36Å; R16-Q18 VanDerWaalsContact C-N 3.33Å; R16-Q18 PolarHBondContact O-N 3.08Å; R16-G19 PolarHBondContact O-N 3.04Å; R16-E20 WeakPolarHBondContact O-CB 3.38Å; R16-E20 PolarHBondContact O-N 3.11Å |
| 17 | W | 56.9 | Low | 57.6 | Low | 161 Ų | 161 | 126.1 Ų | 126.1 | 61% | 0.61 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -63.9 | -33.8 | 176.9 | -88.5 | 90.2 | 0 | 0 | 0 | 113.4 | E13 K21 | E13-W17 VanDerWaalsContact O-CD1 3.25Å; E13-W17 PolarHBondContact O-N 3.24Å; W17-K21 VanDerWaalsContact O-CG 3.32Å; W17-K21 WeakPolarHBondContact O-CG 3.39Å; W17-K21 PolarHBondContact O-N 3.15Å; W17-K21 VanDerWaalsContact O-N 3.13Å |
| 18 | Q | 58.7 | Low | 57.9 | Low | 114 Ų | 114 | 122.3 Ų | 122.3 | 53% | 0.533 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -73.2 | -39.5 | 174.2 | -73.5 | -175.2 | 40.3 | 0 | 0 | 112.3 | R14 E15 R16 E20 K21 N22 | R14-Q18 WeakPolarHBondContact O-CG 3.32Å; R14-Q18 PolarHBondContact O-N 3.31Å; E15-Q18 PolarHBondContact O-N 3.5Å; R16-Q18 VanDerWaalsContact C-N 3.33Å; R16-Q18 PolarHBondContact O-N 3.08Å; Q18-E20 VanDerWaalsContact C-N 3.28Å; Q18-E20 PolarHBondContact O-N 3.47Å; Q18-K21 PolarHBondContact O-N 3.4Å; Q18-N22 PolarHBondContact O-N 3.38Å |
| 19 | G | 57.6 | Low | 57.9 | Low | 33 Ų | 33 | 122.5 Ų | 122.5 | 34% | 0.34 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -63.6 | -33.6 | 174.1 | 0 | 0 | 0 | 0 | 0 | 113 | E15 R16 K23 | E15-G19 PolarHBondContact O-N 3.09Å; R16-G19 PolarHBondContact O-N 3.04Å; G19-K23 VanDerWaalsContact O-CG 3.26Å; G19-K23 WeakPolarHBondContact O-CG 3.25Å; G19-K23 PolarHBondContact O-N 3.28Å; G19-K23 VanDerWaalsContact O-N 3.15Å |
| 20 | E | 61.9 | Low | 58 | Low | 102 Ų | 102 | 121.9 Ų | 121.9 | 48% | 0.477 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -75.4 | -40.3 | 178.8 | -156.3 | 149.1 | -152.7 | 0 | 0 | 112 | R16 Q18 N22 K23 I24 | R16-E20 WeakPolarHBondContact O-CB 3.38Å; R16-E20 PolarHBondContact O-N 3.11Å; Q18-E20 VanDerWaalsContact C-N 3.28Å; Q18-E20 PolarHBondContact O-N 3.47Å; E20-N22 PolarHBondContact O-N 3.3Å; E20-K23 PolarHBondContact O-N 3.41Å; E20-I24 WeakPolarHBondContact O-CG1 3.43Å; E20-I24 PolarHBondContact O-N 3.37Å; E20-I24 VanDerWaalsContact O-N 3.07Å |
| 21 | K | 61.7 | Low | 58.2 | Low | 130 Ų | 130 | 120.6 Ų | 120.6 | 57% | 0.565 | 57% | 0.572 | S | S | * | * | H | α-helix | trans | -61.7 | -42.2 | 171.5 | -72.8 | 179.5 | -178.3 | -169.1 | 0 | 112.7 | W17 Q18 K23 I24 T25 | W17-K21 VanDerWaalsContact O-CG 3.32Å; W17-K21 WeakPolarHBondContact O-CG 3.39Å; W17-K21 PolarHBondContact O-N 3.15Å; W17-K21 VanDerWaalsContact O-N 3.13Å; Q18-K21 PolarHBondContact O-N 3.4Å; K21-K23 VanDerWaalsContact C-N 3.33Å; K21-K23 PolarHBondContact O-N 3.23Å; K21-I24 PolarHBondContact O-N 3Å; K21-T25 PolarHBondContact O-N 3.01Å; K21-T25 VanDerWaalsContact O-N 3.12Å; K21-T25 PolarHBondContact O-OG1 3.32Å |
| 22 | N | 59 | Low | 58.2 | Low | 105 Ų | 105 | 129.2 Ų | 129.2 | 56% | 0.561 | 59% | 0.593 | S | S | * | * | H | α-helix | trans | -66.6 | -33.5 | 176.9 | -83.1 | -8 | 0 | 0 | 0 | 112.7 | Q18 E20 T25 I26 | Q18-N22 PolarHBondContact O-N 3.38Å; E20-N22 PolarHBondContact O-N 3.3Å; N22-T25 WeakPolarHBondContact CA-OG1 3.36Å; N22-T25 PolarHBondContact O-OG1 3.06Å; N22-I26 WeakPolarHBondContact O-CD1 3.35Å; N22-I26 VanDerWaalsContact O-CG1 3.26Å; N22-I26 WeakPolarHBondContact O-CG1 3.37Å; N22-I26 PolarHBondContact O-N 3.48Å |
| 23 | K | 60.7 | Low | 57.9 | Low | 155 Ų | 155 | 131.6 Ų | 131.6 | 67% | 0.674 | 60% | 0.601 | S | S | * | * | H | α-helix | trans | -67.2 | -43.1 | 174.8 | -76.6 | 172.3 | -176.7 | -176 | 0 | 112 | G19 E20 K21 T25 I26 S27 | G19-K23 VanDerWaalsContact O-CG 3.26Å; G19-K23 WeakPolarHBondContact O-CG 3.25Å; G19-K23 PolarHBondContact O-N 3.28Å; G19-K23 VanDerWaalsContact O-N 3.15Å; E20-K23 PolarHBondContact O-N 3.41Å; K21-K23 VanDerWaalsContact C-N 3.33Å; K21-K23 PolarHBondContact O-N 3.23Å; K23-T25 PolarHBondContact O-N 3.45Å; K23-I26 PolarHBondContact O-N 3.27Å; K23-S27 PolarHBondContact O-N 3.46Å; K23-S27 PolarHBondContact O-OG 3.47Å; K23-S27 VanDerWaalsContact O-OG 3.07Å |
| 24 | I | 60 | Low | 57.2 | Low | 95 Ų | 95 | 128.4 Ų | 128.4 | 49% | 0.487 | 60% | 0.6 | S | S | . | * | H | α-helix | trans | -60.7 | -44.9 | 177.3 | -65.8 | 163.1 | 0 | 0 | 0 | 110.5 | E20 K21 I26 S27 E28 | E20-I24 WeakPolarHBondContact O-CG1 3.43Å; E20-I24 PolarHBondContact O-N 3.37Å; E20-I24 VanDerWaalsContact O-N 3.07Å; K21-I24 PolarHBondContact O-N 3Å; I24-I26 VanDerWaalsContact C-N 3.3Å; I24-I26 PolarHBondContact O-N 3.36Å; I24-S27 WeakPolarHBondContact CA-OG 3.36Å; I24-S27 PolarHBondContact O-N 3.42Å; I24-S27 PolarHBondContact O-OG 3.15Å; I24-E28 VanDerWaalsContact O-CB 3.25Å; I24-E28 WeakPolarHBondContact O-CB 3.43Å; I24-E28 PolarHBondContact O-N 3.37Å |
| 25 | T | 64.2 | Low | 56.8 | Low | 77 Ų | 77 | 125 Ų | 125 | 47% | 0.472 | 60% | 0.602 | S | S | . | * | H | α-helix | trans | -64.7 | -30.1 | 177.6 | 50 | 0 | 0 | 0 | 0 | 114.1 | K21 N22 K23 R29 | K21-T25 PolarHBondContact O-N 3.01Å; K21-T25 VanDerWaalsContact O-N 3.12Å; K21-T25 PolarHBondContact O-OG1 3.32Å; N22-T25 WeakPolarHBondContact CA-OG1 3.36Å; N22-T25 PolarHBondContact O-OG1 3.06Å; K23-T25 PolarHBondContact O-N 3.45Å; T25-R29 WeakPolarHBondContact O-CB 3.33Å; T25-R29 PolarHBondContact O-N 3.05Å; T25-R29 VanDerWaalsContact O-N 3.15Å |
| 26 | I | 58.1 | Low | 56.1 | Low | 108 Ų | 108 | 127 Ų | 127 | 55% | 0.554 | 61% | 0.611 | S | S | * | * | H | α-helix | trans | -78.3 | -42.3 | 178.4 | -68.8 | 167.1 | 0 | 0 | 0 | 110.5 | N22 K23 I24 E28 R29 M30 | N22-I26 WeakPolarHBondContact O-CD1 3.35Å; N22-I26 VanDerWaalsContact O-CG1 3.26Å; N22-I26 WeakPolarHBondContact O-CG1 3.37Å; N22-I26 PolarHBondContact O-N 3.48Å; K23-I26 PolarHBondContact O-N 3.27Å; I24-I26 VanDerWaalsContact C-N 3.3Å; I24-I26 PolarHBondContact O-N 3.36Å; I26-E28 VanDerWaalsContact C-N 3.34Å; I26-R29 PolarHBondContact O-N 3.13Å; I26-M30 PolarHBondContact O-N 3.07Å |
| 27 | S | 58.6 | Low | 55.5 | Low | 59 Ų | 59 | 125 Ų | 125 | 41% | 0.413 | 61% | 0.614 | S | S | . | * | H | α-helix | trans | -64.8 | -38 | 174.9 | 49.8 | 0 | 0 | 0 | 0 | 112.3 | K23 I24 M30 Q31 | K23-S27 PolarHBondContact O-N 3.46Å; K23-S27 PolarHBondContact O-OG 3.47Å; K23-S27 VanDerWaalsContact O-OG 3.07Å; I24-S27 WeakPolarHBondContact CA-OG 3.36Å; I24-S27 PolarHBondContact O-N 3.42Å; I24-S27 PolarHBondContact O-OG 3.15Å; S27-M30 PolarHBondContact O-N 3.27Å; S27-Q31 PolarHBondContact O-N 3.27Å |
| 28 | E | 59.4 | Low | 54.5 | Low | 109 Ų | 109 | 123.3 Ų | 123.3 | 51% | 0.509 | 62% | 0.621 | S | S | . | * | H | α-helix | trans | -69.9 | -33.7 | 178 | -161.6 | 177.8 | 173.7 | 0 | 0 | 111.9 | I24 I26 R32 | I24-E28 VanDerWaalsContact O-CB 3.25Å; I24-E28 WeakPolarHBondContact O-CB 3.43Å; I24-E28 PolarHBondContact O-N 3.37Å; I26-E28 VanDerWaalsContact C-N 3.34Å; E28-R32 PolarHBondContact O-N 2.94Å |
| 29 | R | 56.2 | Low | 53.5 | Low | 190 Ų | 190 | 130.4 Ų | 130.4 | 72% | 0.717 | 64% | 0.643 | S | S | * | * | H | α-helix | trans | -68.4 | -33.5 | 170.6 | -176 | 179.5 | -78.8 | -168.8 | -4.4 | 112.5 | T25 I26 | T25-R29 WeakPolarHBondContact O-CB 3.33Å; T25-R29 PolarHBondContact O-N 3.05Å; T25-R29 VanDerWaalsContact O-N 3.15Å; I26-R29 PolarHBondContact O-N 3.13Å |
| 30 | M | 54.3 | Low | 52.3 | Low | 147 Ų | 147 | 131.6 Ų | 131.6 | 72% | 0.724 | 66% | 0.656 | S | S | * | * | H | α-helix | trans | -74 | -32 | 176.6 | -110.5 | 165.3 | 139.8 | 0 | 0 | 112.8 | I26 S27 Q33 | I26-M30 PolarHBondContact O-N 3.07Å; S27-M30 PolarHBondContact O-N 3.27Å; M30-Q33 PolarHBondContact O-N 3.42Å |
| 31 | Q | 58.8 | Low | 51 | Low | 165 Ų | 165 | 136.4 Ų | 136.4 | 77% | 0.771 | 68% | 0.675 | S | S | * | * | H | α-helix | trans | -77.6 | -17.5 | 176.7 | -93.8 | 162.2 | -6.2 | 0 | 0 | 114.5 | S27 Q33 | S27-Q31 PolarHBondContact O-N 3.27Å; Q31-Q33 VanDerWaalsContact C-N 3.3Å |
| 32 | R | 53.4 | Low | 49.9 | Very low | 219 Ų | 219 | 136.8 Ų | 136.8 | 83% | 0.826 | 69% | 0.688 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81.1 | -5.5 | 171.1 | -75.8 | -174.4 | 171.2 | -126.3 | 0.8 | 114.3 | E28 | E28-R32 PolarHBondContact O-N 2.94Š|
| 33 | Q | 49.8 | Very low | 48.9 | Very low | 164 Ų | 164 | 138 Ų | 138 | 77% | 0.766 | 70% | 0.699 | S | S | * | * | trans | -114.5 | 71.6 | 171.9 | -68.8 | -177.2 | 46.1 | 0 | 0 | 109 | M30 Q31 | M30-Q33 PolarHBondContact O-N 3.42Å; Q31-Q33 VanDerWaalsContact C-N 3.3Å | ||
| 34 | G | 40.8 | Very low | 48 | Very low | 51 Ų | 51 | 135 Ų | 135 | 53% | 0.526 | 70% | 0.704 | S | S | . | * | trans | -73.9 | 159.5 | 166.5 | 0 | 0 | 0 | 0 | 0 | 111.2 | E36 | G34-E36 PolarHBondContact O-N 2.94Š| ||
| 35 | P | 47.5 | Very low | 46.7 | Very low | 115 Ų | 115 | 142 Ų | 142 | 75% | 0.747 | 72% | 0.724 | S | S | * | * | trans | -70.6 | 116.7 | 176.8 | 29.8 | -31.4 | 0 | 0 | 0 | 109.1 | N37 | P35-N37 VanDerWaalsContact C-N 3.25Å; P35-N37 PolarHBondContact O-N 3.43Å | ||
| 36 | E | 43.7 | Very low | 45.4 | Very low | 185 Ų | 185 | 149.1 Ų | 149.1 | 86% | 0.864 | 74% | 0.742 | S | S | * | * | trans | -69.9 | 89.4 | 168.1 | -66.1 | -163.5 | 160.3 | 0 | 0 | 109.1 | G34 | G34-E36 PolarHBondContact O-N 2.94Š| ||
| 37 | N | 44 | Very low | 44.2 | Very low | 142 Ų | 142 | 155.7 Ų | 155.7 | 76% | 0.759 | 76% | 0.76 | S | S | * | * | trans | -78.3 | 108.5 | 158.8 | -65.7 | -20.9 | 0 | 0 | 0 | 107.4 | P35 | P35-N37 VanDerWaalsContact C-N 3.25Å; P35-N37 PolarHBondContact O-N 3.43Å | ||
| 38 | V | 36.8 | Very low | 43.2 | Very low | 125 Ų | 125 | 157.5 Ų | 157.5 | 76% | 0.758 | 77% | 0.772 | S | S | * | * | trans | -120 | 85.9 | 164.2 | -174.5 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 39 | W | 36.1 | Very low | 42.6 | Very low | 263 Ų | 263 | 157.3 Ų | 157.3 | 100% | 0.996 | 78% | 0.781 | S | S | * | * | trans | -90.5 | 127 | 150.7 | -95.1 | 61.3 | 0 | 0 | 0 | 108.3 | ||||
| 40 | G | 34.3 | Very low | 42 | Very low | 58 Ų | 58 | 154.6 Ų | 154.6 | 60% | 0.598 | 79% | 0.787 | S | S | * | * | trans | 114.7 | 109.5 | 154.6 | 0 | 0 | 0 | 0 | 0 | 115.9 | ||||
| 41 | K | 32.7 | Very low | 41 | Very low | 202 Ų | 202 | 153.5 Ų | 153.5 | 88% | 0.878 | 79% | 0.789 | S | S | * | * | -174.8 | 110.1 | 107.2 | -95 | 164.4 | -174.7 | -177.5 | 0 | 111.4 | T43 | K41-T43 PolarHBondContact O-N 3.46Š| |||
| 42 | V | 40.3 | Very low | 39.9 | Very low | 139 Ų | 139 | 156.3 Ų | 156.3 | 84% | 0.842 | 79% | 0.793 | S | S | * | * | trans | -52.8 | 120 | 153.9 | 172.2 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 43 | T | 36.5 | Very low | 38.9 | Very low | 130 Ų | 130 | 151.8 Ų | 151.8 | 80% | 0.798 | 80% | 0.795 | S | S | * | * | trans | -136.8 | 112.1 | 149.4 | 49.5 | 0 | 0 | 0 | 0 | 108.9 | K41 R45 | K41-T43 PolarHBondContact O-N 3.46Å; T43-R45 PolarHBondContact O-N 3.29Å | ||
| 44 | A | 42.3 | Very low | 38.3 | Very low | 93 Ų | 93 | 148.2 Ų | 148.2 | 77% | 0.769 | 79% | 0.788 | S | S | * | * | trans | -64.9 | 123.7 | 168.4 | 0 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 45 | R | 33.2 | Very low | 39 | Very low | 241 Ų | 241 | 151.3 Ų | 151.3 | 91% | 0.909 | 80% | 0.799 | S | S | * | * | trans | -132.4 | 103.8 | 153.2 | -96.9 | -175.3 | 174.2 | -122.7 | 0 | 109.4 | T43 R47 | T43-R45 PolarHBondContact O-N 3.29Å; R45-R47 PolarHBondContact O-N 2.99Å | ||
| 46 | R | 37.1 | Very low | 38.9 | Very low | 226 Ų | 226 | 151.9 Ų | 151.9 | 85% | 0.853 | 80% | 0.802 | S | S | * | * | trans | -41.3 | 125.6 | 160.1 | -75 | 170.6 | 164.5 | -114 | 0.9 | 110.4 | ||||
| 47 | R | 33.4 | Very low | 38.3 | Very low | 247 Ų | 247 | 146.8 Ų | 146.8 | 93% | 0.932 | 80% | 0.8 | S | S | * | * | trans | -131.1 | 107.9 | 142.1 | -81 | -171.6 | -178.1 | -116.4 | 2.4 | 107.4 | R45 | R45-R47 PolarHBondContact O-N 2.99Š| ||
| 48 | S | 36.2 | Very low | 37.7 | Very low | 97 Ų | 97 | 143.1 Ų | 143.1 | 68% | 0.678 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -69.4 | 158.1 | 167.7 | -64.5 | 0 | 0 | 0 | 0 | 110.3 | ||
| 49 | P | 46.6 | Very low | 37.6 | Very low | 105 Ų | 105 | 150 Ų | 150 | 68% | 0.682 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -88.2 | 157.8 | -170.4 | 36.5 | -33.3 | 0 | 0 | 0 | 111.5 | ||
| 50 | P | 43.9 | Very low | 37.6 | Very low | 132 Ų | 132 | 142 Ų | 142 | 86% | 0.857 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -82 | 125.5 | 163.6 | 30.4 | -28 | 0 | 0 | 0 | 110.8 | ||
| 51 | T | 34.3 | Very low | 37.8 | Very low | 125 Ų | 125 | 150.7 Ų | 150.7 | 77% | 0.767 | 81% | 0.812 | S | S | * | * | P | Polyproline II helix | trans | -80.8 | 134.9 | 170 | 49 | 0 | 0 | 0 | 0 | 111.2 | ||
| 52 | R | 34.2 | Very low | 38.1 | Very low | 224 Ų | 224 | 148.7 Ų | 148.7 | 85% | 0.845 | 81% | 0.811 | S | S | * | * | trans | 62 | 112.7 | 130.9 | -131.4 | 172.6 | -169.4 | -97.4 | 0.9 | 119.5 | ||||
| 53 | S | 33.9 | Very low | 38.6 | Very low | 123 Ų | 123 | 147.3 Ų | 147.3 | 86% | 0.86 | 81% | 0.805 | S | S | * | * | trans | -144.1 | 117.7 | 139.9 | 54.6 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 54 | S | 37 | Very low | 38.8 | Very low | 89 Ų | 89 | 149.2 Ų | 149.2 | 62% | 0.622 | 81% | 0.805 | S | S | * | * | trans | -103.1 | -175.7 | 172.9 | -52.8 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 55 | P | 54 | Low | 39 | Very low | 116 Ų | 116 | 149.5 Ų | 149.5 | 75% | 0.753 | 80% | 0.799 | S | S | * | * | -117.1 | -168.9 | -99.9 | 34.2 | -13.9 | 0 | 0 | 0 | 112.4 | |||||
| 56 | P | 46.5 | Very low | 39.3 | Very low | 127 Ų | 127 | 145.9 Ų | 145.9 | 83% | 0.825 | 80% | 0.797 | S | S | * | * | -143.7 | 154.7 | 122.2 | 36.4 | -21.7 | 0 | 0 | 0 | 115.7 | |||||
| 57 | G | 31.5 | Very low | 39.1 | Very low | 79 Ų | 79 | 140.7 Ų | 140.7 | 81% | 0.814 | 79% | 0.791 | S | S | * | * | trans | 77.5 | 111.3 | 159.3 | 0 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 58 | G | 30.2 | Very low | 39.4 | Very low | 64 Ų | 64 | 140.6 Ų | 140.6 | 66% | 0.66 | 79% | 0.79 | S | S | * | * | cis | 104.2 | 100.4 | 37.8 | 0 | 0 | 0 | 0 | 0 | 107.6 | ||||
| 59 | W | 35.4 | Very low | 39.2 | Very low | 269 Ų | 269 | 139 Ų | 139 | 100% | 1.019 | 79% | 0.79 | S | S | * | * | trans | -162.6 | 117.7 | 132.9 | -76.5 | -21.5 | 0 | 0 | 0 | 108.3 | ||||
| 60 | A | 35.5 | Very low | 39.4 | Very low | 95 Ų | 95 | 140.2 Ų | 140.2 | 79% | 0.785 | 80% | 0.797 | S | S | * | * | trans | -77.5 | 140.2 | 171.1 | 0 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 61 | R | 37.9 | Very low | 39 | Very low | 241 Ų | 241 | 140.5 Ų | 140.5 | 91% | 0.909 | 80% | 0.797 | S | S | * | * | trans | -175.7 | 101.4 | 144 | -107.2 | 166.2 | 164.5 | -117.5 | -3.4 | 110.2 | ||||
| 62 | D | 41.1 | Very low | 39.1 | Very low | 161 Ų | 161 | 146.7 Ų | 146.7 | 86% | 0.861 | 81% | 0.806 | S | S | * | * | trans | -135.6 | 139 | 138.8 | -84.7 | -45.6 | 0 | 0 | 0 | 103.8 | ||||
| 63 | P | 49.5 | Very low | 39 | Very low | 110 Ų | 110 | 140.1 Ų | 140.1 | 71% | 0.714 | 81% | 0.809 | S | S | * | * | -151.4 | 157.9 | 78 | 36.5 | -16.3 | 0 | 0 | 0 | 115.7 | |||||
| 64 | E | 40.1 | Very low | 39 | Very low | 170 Ų | 170 | 138 Ų | 138 | 79% | 0.794 | 81% | 0.805 | S | S | * | * | 158.6 | 138.2 | 118.3 | -86.3 | -86.2 | 120.8 | 0 | 0 | 111.8 | |||||
| 65 | P | 47.6 | Very low | 38.8 | Very low | 99 Ų | 99 | 137 Ų | 137 | 64% | 0.643 | 81% | 0.81 | S | S | * | * | trans | -91.1 | 124.1 | 176.6 | 34.3 | -29.5 | 0 | 0 | 0 | 111.6 | T67 | P65-T67 PolarHBondContact O-N 3.45Š| ||
| 66 | L | 38.6 | Very low | 37.8 | Very low | 164 Ų | 164 | 138.9 Ų | 138.9 | 86% | 0.859 | 81% | 0.814 | S | S | * | * | trans | -84.3 | 104.7 | 171.5 | -83.1 | 161.9 | 0 | 0 | 0 | 111.1 | ||||
| 67 | T | 34.5 | Very low | 37.3 | Very low | 118 Ų | 118 | 144 Ų | 144 | 72% | 0.724 | 82% | 0.816 | S | S | * | * | trans | -63.6 | 135.9 | 163.2 | 50.4 | 0 | 0 | 0 | 0 | 110.9 | P65 | P65-T67 PolarHBondContact O-N 3.45Š| ||
| 68 | W | 38.7 | Very low | 37.8 | Very low | 244 Ų | 244 | 147 Ų | 147 | 92% | 0.924 | 82% | 0.819 | S | S | * | * | trans | -132.6 | 115.5 | 155.5 | -74.5 | 74.5 | 0 | 0 | 0 | 108.1 | ||||
| 69 | G | 33 | Very low | 38 | Very low | 65 Ų | 65 | 147.9 Ų | 147.9 | 67% | 0.67 | 82% | 0.82 | S | S | * | * | trans | -130.3 | -170.6 | 158.2 | 0 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 70 | P | 49.6 | Very low | 37.9 | Very low | 129 Ų | 129 | 143.8 Ų | 143.8 | 84% | 0.838 | 81% | 0.812 | S | S | * | * | -122.7 | 162.9 | -80.6 | 37.5 | -28.5 | 0 | 0 | 0 | 113.3 | |||||
| 71 | T | 36 | Very low | 37.8 | Very low | 138 Ų | 138 | 143.2 Ų | 143.2 | 85% | 0.847 | 81% | 0.807 | S | S | * | * | trans | -143.1 | 104.2 | 159.8 | 44.4 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 72 | R | 36.3 | Very low | 37.7 | Very low | 255 Ų | 255 | 140.6 Ų | 140.6 | 96% | 0.962 | 81% | 0.806 | S | S | * | * | 73.5 | 117.9 | 92.3 | -97.7 | -170.1 | -170.1 | -143.5 | 2.4 | 115.7 | |||||
| 73 | G | 32.3 | Very low | 37.4 | Very low | 87 Ų | 87 | 140.1 Ų | 140.1 | 90% | 0.897 | 81% | 0.809 | S | S | * | * | trans | 101.9 | 120.6 | 154.4 | 0 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 74 | G | 33 | Very low | 36.8 | Very low | 77 Ų | 77 | 140.4 Ų | 140.4 | 79% | 0.794 | 81% | 0.813 | S | S | * | * | cis | 156.5 | 142.2 | 3.4 | 0 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 75 | G | 32.8 | Very low | 36.5 | Very low | 70 Ų | 70 | 135.9 Ų | 135.9 | 72% | 0.722 | 81% | 0.812 | S | S | * | * | trans | 54.4 | 145 | 164.9 | 0 | 0 | 0 | 0 | 0 | 118.8 | ||||
| 76 | D | 34.1 | Very low | 37 | Very low | 154 Ų | 154 | 137.2 Ų | 137.2 | 82% | 0.824 | 82% | 0.821 | S | S | * | * | cis | -156.2 | 127 | 13.2 | -80.7 | -65.3 | 0 | 0 | 0 | 106.1 | ||||
| 77 | R | 36.4 | Very low | 37.6 | Very low | 234 Ų | 234 | 135.6 Ų | 135.6 | 88% | 0.883 | 82% | 0.82 | S | S | * | * | 48.3 | 106.9 | 88.6 | -87.1 | -169 | 162.2 | -153.3 | -4.6 | 116.7 | |||||
| 78 | V | 40.3 | Very low | 37.5 | Very low | 142 Ų | 142 | 133.9 Ų | 133.9 | 86% | 0.861 | 83% | 0.826 | S | S | * | * | -171.1 | 110.3 | 125.8 | -90 | 0 | 0 | 0 | 0 | 106.4 | |||||
| 79 | A | 35.6 | Very low | 37.1 | Very low | 83 Ų | 83 | 125.8 Ų | 125.8 | 69% | 0.686 | 82% | 0.818 | S | S | * | * | 59.4 | 101 | 65.1 | 0 | 0 | 0 | 0 | 0 | 110.8 | |||||
| 80 | E | 32.9 | Very low | 37.1 | Very low | 184 Ų | 184 | 127.7 Ų | 127.7 | 86% | 0.86 | 83% | 0.828 | S | S | * | * | 147.5 | 157 | 93.3 | -76 | -74.9 | 116.4 | 0 | 0 | 103.7 | |||||
| 81 | A | 34 | Very low | 36.4 | Very low | 83 Ų | 83 | 126.8 Ų | 126.8 | 69% | 0.686 | 83% | 0.831 | S | S | * | * | cis | -164.9 | 154.1 | -7 | 0 | 0 | 0 | 0 | 0 | 106.2 | ||||
| 82 | E | 34.8 | Very low | 36.2 | Very low | 186 Ų | 186 | 123.8 Ų | 123.8 | 87% | 0.869 | 83% | 0.827 | S | S | * | * | trans | -66.8 | 152.5 | 168.9 | -56.9 | -174.5 | 102.8 | 0 | 0 | 111.1 | ||||
| 83 | T | 35.8 | Very low | 36.1 | Very low | 151 Ų | 151 | 116.4 Ų | 116.4 | 93% | 0.926 | 82% | 0.821 | S | S | * | * | trans | -166 | 143.2 | 135.4 | 32.5 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 84 | S | 37.6 | Very low | 36.1 | Very low | 115 Ų | 115 | 118.8 Ų | 118.8 | 80% | 0.804 | 81% | 0.813 | S | S | * | * | trans | -89.8 | 143 | -170.3 | 49.5 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 85 | G | 33.3 | Very low | 36.3 | Very low | 75 Ų | 75 | 121.6 Ų | 121.6 | 77% | 0.773 | 81% | 0.807 | S | S | * | * | 92.1 | 145.5 | 129.3 | 0 | 0 | 0 | 0 | 0 | 121 | |||||
| 86 | P | 57.3 | Low | 36.9 | Very low | 127 Ų | 127 | 123.5 Ų | 123.5 | 83% | 0.825 | 81% | 0.81 | S | S | * | * | trans | -95.7 | -168.2 | -171.1 | 44.4 | -36.2 | 0 | 0 | 0 | 112 | ||||
| 87 | P | 51.6 | Low | 37 | Very low | 130 Ų | 130 | 121.6 Ų | 121.6 | 84% | 0.844 | 81% | 0.808 | S | S | * | * | cis | -155.6 | -170.9 | 29.4 | 42.1 | -17 | 0 | 0 | 0 | 119.5 | ||||
| 88 | G | 31.5 | Very low | 37.5 | Very low | 83 Ų | 83 | 122.2 Ų | 122.2 | 86% | 0.856 | 81% | 0.811 | S | S | * | * | trans | 103.2 | 142.3 | 156.7 | 0 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 89 | G | 30.4 | Very low | 37.7 | Very low | 74 Ų | 74 | 121.4 Ų | 121.4 | 76% | 0.763 | 81% | 0.808 | S | S | * | * | cis | 146.3 | 142.8 | 10.3 | 0 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 90 | A | 34.2 | Very low | 37.6 | Very low | 105 Ų | 105 | 119.9 Ų | 119.9 | 87% | 0.868 | 80% | 0.801 | S | S | * | * | trans | 79.9 | 121.5 | 176.9 | 0 | 0 | 0 | 0 | 0 | 116.7 | ||||
| 91 | A | 34.3 | Very low | 38.2 | Very low | 110 Ų | 110 | 122.5 Ų | 122.5 | 91% | 0.909 | 80% | 0.803 | S | S | * | * | cis | 97.3 | 131.8 | 47.4 | 0 | 0 | 0 | 0 | 0 | 113 | ||||
| 92 | G | 31.8 | Very low | 38.3 | Very low | 74 Ų | 74 | 126.6 Ų | 126.6 | 76% | 0.763 | 81% | 0.808 | S | S | * | * | trans | 118.9 | 93.1 | 171.8 | 0 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 93 | A | 34 | Very low | 38.7 | Very low | 101 Ų | 101 | 124.7 Ų | 124.7 | 84% | 0.835 | 80% | 0.803 | S | S | * | * | 73.6 | 110.4 | 82.3 | 0 | 0 | 0 | 0 | 0 | 114.5 | |||||
| 94 | D | 31.8 | Very low | 38.9 | Very low | 136 Ų | 136 | 123.8 Ų | 123.8 | 73% | 0.727 | 80% | 0.798 | S | S | * | * | 90.5 | 140.6 | 128.2 | -138.9 | -140.6 | 0 | 0 | 0 | 122 | |||||
| 95 | M | 37.6 | Very low | 39.3 | Very low | 136 Ų | 136 | 122 Ų | 122 | 67% | 0.67 | 80% | 0.798 | S | S | * | * | trans | 80.2 | 102.3 | 159.5 | -62.1 | -64 | 113.6 | 0 | 0 | 121.2 | S97 | M95-S97 PolarHBondContact O-N 3Š| ||
| 96 | S | 46.6 | Very low | 39.5 | Very low | 111 Ų | 111 | 123.1 Ų | 123.1 | 78% | 0.776 | 80% | 0.799 | S | S | * | * | -0.6 | 114 | 126 | -62.2 | 0 | 0 | 0 | 0 | 115.8 | |||||
| 97 | S | 36.2 | Very low | 38.7 | Very low | 113 Ų | 113 | 122 Ų | 122 | 79% | 0.79 | 80% | 0.8 | S | S | * | * | trans | -156.1 | 116.2 | 144.4 | -81.4 | 0 | 0 | 0 | 0 | 108.8 | M95 P99 | M95-S97 PolarHBondContact O-N 3Å; S97-P99 WeakPolarHBondContact O-CD 3.26Å | ||
| 98 | R | 47.2 | Very low | 38.3 | Very low | 248 Ų | 248 | 119 Ų | 119 | 94% | 0.936 | 79% | 0.793 | S | S | * | * | trans | -62.2 | 124 | 160.5 | -69.2 | 172.3 | 166.3 | -156.1 | -3.9 | 107.3 | ||||
| 99 | P | 44.3 | Very low | 38.9 | Very low | 125 Ų | 125 | 119.5 Ų | 119.5 | 81% | 0.812 | 79% | 0.79 | S | S | * | * | trans | -84.9 | 114.3 | 150.6 | 24.9 | -10.1 | 0 | 0 | 0 | 105.5 | S97 | S97-P99 WeakPolarHBondContact O-CD 3.26Š| ||
| 100 | G | 32.1 | Very low | 40 | Very low | 51 Ų | 51 | 127.4 Ų | 127.4 | 53% | 0.526 | 80% | 0.796 | S | S | . | * | 84 | 84 | 67.9 | 0 | 0 | 0 | 0 | 0 | 105.9 | E102 | G100-E102 VanDerWaalsContact C-N 3.32Å; G100-E102 PolarHBondContact O-N 3.12Å | |||
| 101 | R | 47 | Very low | 41.1 | Very low | 239 Ų | 239 | 133.3 Ų | 133.3 | 90% | 0.902 | 80% | 0.796 | S | S | * | * | trans | -70.2 | 94.9 | 171.6 | 178.3 | 179.4 | 173.3 | -96.9 | -1.1 | 106.4 | ||||
| 102 | E | 35.1 | Very low | 42.3 | Very low | 169 Ų | 169 | 133.6 Ų | 133.6 | 79% | 0.79 | 79% | 0.789 | S | S | * | * | trans | -120.3 | 104.5 | 172.4 | -52.5 | -162.6 | -176.2 | 0 | 0 | 107.3 | G100 V104 | G100-E102 VanDerWaalsContact C-N 3.32Å; G100-E102 PolarHBondContact O-N 3.12Å; E102-V104 PolarHBondContact O-N 3.45Å | ||
| 103 | D | 44.2 | Very low | 43.6 | Very low | 145 Ų | 145 | 141.8 Ų | 141.8 | 78% | 0.775 | 80% | 0.797 | S | S | * | * | trans | -75.5 | 104.3 | 176.9 | -166.7 | -80.4 | 0 | 0 | 0 | 107.8 | ||||
| 104 | V | 38.8 | Very low | 44.8 | Very low | 133 Ų | 133 | 140.6 Ų | 140.6 | 81% | 0.806 | 77% | 0.774 | S | S | * | * | trans | -140 | 108.8 | 161.2 | -148.4 | 0 | 0 | 0 | 0 | 109 | E102 A106 | E102-V104 PolarHBondContact O-N 3.45Å; V104-A106 PolarHBondContact O-N 3.14Å | ||
| 105 | G | 46.6 | Very low | 46.7 | Very low | 78 Ų | 78 | 137.3 Ų | 137.3 | 80% | 0.804 | 76% | 0.76 | S | S | * | * | trans | -18.1 | 106 | 175.7 | 0 | 0 | 0 | 0 | 0 | 117.7 | ||||
| 106 | A | 38.1 | Very low | 48.2 | Very low | 98 Ų | 98 | 135.3 Ų | 135.3 | 81% | 0.81 | 76% | 0.757 | S | S | * | * | trans | -108.9 | 109.3 | 146.2 | 0 | 0 | 0 | 0 | 0 | 106.7 | V104 G108 | V104-A106 PolarHBondContact O-N 3.14Å; A106-G108 PolarHBondContact O-N 3.16Å | ||
| 107 | A | 40.3 | Very low | 49.3 | Very low | 102 Ų | 102 | 137.4 Ų | 137.4 | 84% | 0.843 | 75% | 0.754 | S | S | * | * | trans | -43.5 | 105.2 | 180 | 0 | 0 | 0 | 0 | 0 | 111.3 | A109 | A107-A109 VanDerWaalsContact C-N 3.26Å; A107-A109 PolarHBondContact O-N 3.47Å | ||
| 108 | G | 42 | Very low | 51.1 | Low | 68 Ų | 68 | 135.9 Ų | 135.9 | 70% | 0.701 | 74% | 0.735 | S | S | * | * | trans | -60.7 | 98.7 | 160.4 | 0 | 0 | 0 | 0 | 0 | 106.5 | A106 R110 | A106-G108 PolarHBondContact O-N 3.16Å; G108-R110 PolarHBondContact O-N 3.05Å | ||
| 109 | A | 45.6 | Very low | 52.6 | Low | 94 Ų | 94 | 130.3 Ų | 130.3 | 78% | 0.777 | 72% | 0.72 | S | S | * | * | trans | -55.9 | 93.6 | 168.1 | 0 | 0 | 0 | 0 | 0 | 106.5 | A107 R111 | A107-A109 VanDerWaalsContact C-N 3.26Å; A107-A109 PolarHBondContact O-N 3.47Å; A109-R111 PolarHBondContact O-N 3.34Å | ||
| 110 | R | 52.7 | Low | 54.4 | Low | 240 Ų | 240 | 128.9 Ų | 128.9 | 91% | 0.906 | 70% | 0.704 | S | S | * | * | trans | -58.8 | 108.4 | 170.1 | -69.5 | -168.5 | -170.2 | -133.2 | 5 | 104.2 | G108 | G108-R110 PolarHBondContact O-N 3.05Š| ||
| 111 | R | 58 | Low | 56.9 | Low | 228 Ų | 228 | 132.4 Ų | 132.4 | 86% | 0.86 | 71% | 0.707 | S | S | * | * | trans | -48 | 135.7 | 169.8 | -77 | -172.9 | 173.8 | -149.6 | -1.3 | 107.1 | A109 R113 | A109-R111 PolarHBondContact O-N 3.34Å; R111-R113 PolarHBondContact O-N 3.5Å | ||
| 112 | P | 59 | Low | 58.5 | Low | 116 Ų | 116 | 128.4 Ų | 128.4 | 75% | 0.753 | 69% | 0.692 | S | S | * | * | trans | -47 | 129.2 | 173.7 | -25.6 | 33.3 | 0 | 0 | 0 | 108.5 | E114 | P112-E114 VanDerWaalsContact C-N 3.34Å; P112-E114 PolarHBondContact O-N 3.49Å | ||
| 113 | R | 58.9 | Low | 60.8 | Low | 246 Ų | 246 | 127.4 Ų | 127.4 | 93% | 0.928 | 68% | 0.681 | S | S | * | * | trans | -62.6 | 101.9 | 175.8 | -177.8 | 170.1 | 178.4 | 156.2 | -2 | 106.3 | R111 | R111-R113 PolarHBondContact O-N 3.5Š| ||
| 114 | E | 59.1 | Low | 62.9 | Low | 77 Ų | 77 | 128.7 Ų | 128.7 | 36% | 0.36 | 68% | 0.675 | S | S | . | * | trans | -57.8 | 141.6 | 179.3 | -65.7 | -122.1 | 130.8 | 0 | 0 | 108.4 | P112 Q118 R122 | P112-E114 VanDerWaalsContact C-N 3.34Å; P112-E114 PolarHBondContact O-N 3.49Å; E114-Q118 HydrophobicContact CB-CB 4.41Å; E114-Q118 PolarHBondContact OE2-OE1 3.03Å; E114-R122 IonicContact OE1-NH2 2.85Å; E114-R122 IonicContact OE2-CZ 3.69Å; E114-R122 IonicContact OE2-NE 3.67Å; E114-R122 PolarHBondContact OE2-NE 2.9Å; E114-R122 IonicContact OE2-NH2 3.89Å; E114-R122 PolarHBondContact OE2-NH2 2.76Å | ||
| 115 | P | 70.7 | Confident | 65.3 | Low | 66 Ų | 66 | 125.5 Ų | 125.5 | 43% | 0.429 | 65% | 0.652 | S | S | . | * | trans | -49.4 | 139.7 | 176.4 | -26.6 | 33.3 | 0 | 0 | 0 | 110.6 | E117 Q118 E119 | P115-E117 PolarHBondContact O-N 3.16Å; P115-Q118 PolarHBondContact O-N 3.34Å; P115-E119 PolarHBondContact O-N 3.48Å | ||
| 116 | P | 70.3 | Confident | 67.2 | Low | 95 Ų | 95 | 126.8 Ų | 126.8 | 62% | 0.617 | 64% | 0.637 | S | S | * | * | H | α-helix | trans | -55.3 | -25.1 | -175.4 | 21.2 | -32.7 | 0 | 0 | 0 | 113.1 | L120 | P116-L120 VanDerWaalsContact O-CG 3.31Å; P116-L120 WeakPolarHBondContact O-CG 3.26Å; P116-L120 PolarHBondContact O-N 3.01Å; P116-L120 VanDerWaalsContact O-N 3.12Å |
| 117 | E | 68.8 | Low | 69.7 | Low | 154 Ų | 154 | 127.9 Ų | 127.9 | 72% | 0.72 | 62% | 0.623 | S | S | * | * | H | α-helix | trans | -68.8 | -39 | 175.1 | -58.7 | -169.1 | 157.1 | 0 | 0 | 113.4 | P115 L120 Q121 | P115-E117 PolarHBondContact O-N 3.16Å; E117-L120 PolarHBondContact O-N 3.2Å; E117-Q121 WeakPolarHBondContact O-CB 3.44Å; E117-Q121 PolarHBondContact O-N 3.4Å |
| 118 | Q | 75.1 | Confident | 72 | Confident | 82 Ų | 82 | 129.3 Ų | 129.3 | 38% | 0.383 | 61% | 0.607 | S | S | . | * | H | α-helix | trans | -70.9 | -35.4 | 177.5 | -70.4 | 179.6 | 5 | 0 | 0 | 111.5 | E114 P115 Q121 R122 | E114-Q118 HydrophobicContact CB-CB 4.41Å; E114-Q118 PolarHBondContact OE2-OE1 3.03Å; P115-Q118 PolarHBondContact O-N 3.34Å; Q118-Q121 PolarHBondContact O-N 3.13Å; Q118-R122 WeakPolarHBondContact O-CG 3.31Å; Q118-R122 PolarHBondContact O-N 3.06Å |
| 119 | E | 78.7 | Confident | 74.2 | Confident | 131 Ų | 131 | 133.7 Ų | 133.7 | 61% | 0.612 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -65.9 | -43 | 174.1 | -171.6 | 174.8 | -173.7 | 0 | 0 | 111.7 | P115 Q121 R122 R123 | P115-E119 PolarHBondContact O-N 3.48Å; E119-Q121 VanDerWaalsContact C-N 3.33Å; E119-Q121 PolarHBondContact O-N 3.04Å; E119-R122 PolarHBondContact O-N 3.47Å; E119-R123 WeakPolarHBondContact O-CB 3.47Å; E119-R123 PolarHBondContact O-N 3.32Å |
| 120 | L | 82.1 | Confident | 76.3 | Confident | 94 Ų | 94 | 136.6 Ų | 136.6 | 49% | 0.492 | 59% | 0.593 | S | S | . | * | H | α-helix | trans | -62.3 | -39.7 | 173.1 | -74.7 | 170.2 | 0 | 0 | 0 | 112 | P116 E117 R123 R124 | P116-L120 VanDerWaalsContact O-CG 3.31Å; P116-L120 WeakPolarHBondContact O-CG 3.26Å; P116-L120 PolarHBondContact O-N 3.01Å; P116-L120 VanDerWaalsContact O-N 3.12Å; E117-L120 PolarHBondContact O-N 3.2Å; L120-R123 PolarHBondContact O-N 3.21Å; L120-R124 VanDerWaalsContact O-CG 3.31Å; L120-R124 WeakPolarHBondContact O-CG 3.49Å; L120-R124 PolarHBondContact O-N 3.2Å |
| 121 | Q | 83.4 | Confident | 78 | Confident | 126 Ų | 126 | 129.9 Ų | 129.9 | 59% | 0.589 | 57% | 0.572 | S | S | * | * | H | α-helix | trans | -64.5 | -45 | 176.5 | -169.9 | 171.8 | -1.9 | 0 | 0 | 111.7 | E117 Q118 E119 R123 R124 E125 | E117-Q121 WeakPolarHBondContact O-CB 3.44Å; E117-Q121 PolarHBondContact O-N 3.4Å; Q118-Q121 PolarHBondContact O-N 3.13Å; E119-Q121 VanDerWaalsContact C-N 3.33Å; E119-Q121 PolarHBondContact O-N 3.04Å; Q121-R123 VanDerWaalsContact C-N 3.34Å; Q121-R123 PolarHBondContact O-N 3.23Å; Q121-R124 PolarHBondContact O-N 3.05Å; Q121-E125 WeakPolarHBondContact O-CB 3.38Å; Q121-E125 PolarHBondContact O-N 3.48Å |
| 122 | R | 81.9 | Confident | 79.5 | Confident | 155 Ų | 155 | 122.7 Ų | 122.7 | 59% | 0.585 | 55% | 0.55 | S | S | * | * | H | α-helix | trans | -60.9 | -40.6 | 173.2 | -72.6 | 177.6 | -170.5 | -90.8 | 4.8 | 111.9 | E114 Q118 E119 E125 Q126 | E114-R122 IonicContact OE1-NH2 2.85Å; E114-R122 IonicContact OE2-CZ 3.69Å; E114-R122 IonicContact OE2-NE 3.67Å; E114-R122 PolarHBondContact OE2-NE 2.9Å; E114-R122 IonicContact OE2-NH2 3.89Å; E114-R122 PolarHBondContact OE2-NH2 2.76Å; Q118-R122 WeakPolarHBondContact O-CG 3.31Å; Q118-R122 PolarHBondContact O-N 3.06Å; E119-R122 PolarHBondContact O-N 3.47Å; R122-E125 PolarHBondContact O-N 3.12Å; R122-Q126 WeakPolarHBondContact O-CB 3.28Å; R122-Q126 PolarHBondContact O-N 3.07Å |
| 123 | R | 83.1 | Confident | 80.8 | Confident | 148 Ų | 148 | 119.8 Ų | 119.8 | 56% | 0.558 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -66.1 | -39.7 | 177.1 | -173 | 173.3 | -178.1 | -100.3 | 5.6 | 112.2 | E119 L120 Q121 K127 | E119-R123 WeakPolarHBondContact O-CB 3.47Å; E119-R123 PolarHBondContact O-N 3.32Å; L120-R123 PolarHBondContact O-N 3.21Å; Q121-R123 VanDerWaalsContact C-N 3.34Å; Q121-R123 PolarHBondContact O-N 3.23Å; R123-K127 WeakPolarHBondContact O-CG 3.48Å; R123-K127 PolarHBondContact O-N 2.82Å |
| 124 | R | 87.8 | Confident | 82.2 | Confident | 171 Ų | 171 | 113.6 Ų | 113.6 | 65% | 0.645 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -65.2 | -42.8 | 173.9 | -73.5 | 171.9 | 178.5 | -175.5 | 0.4 | 111 | L120 Q121 K127 R128 | L120-R124 VanDerWaalsContact O-CG 3.31Å; L120-R124 WeakPolarHBondContact O-CG 3.49Å; L120-R124 PolarHBondContact O-N 3.2Å; Q121-R124 PolarHBondContact O-N 3.05Å; R124-K127 PolarHBondContact O-N 3.15Å; R124-R128 WeakPolarHBondContact O-CG 3.39Å; R124-R128 PolarHBondContact O-N 3.15Å |
| 125 | E | 88.4 | Confident | 83.5 | Confident | 67 Ų | 67 | 114.4 Ų | 114.4 | 31% | 0.313 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -64.9 | -42 | 176.2 | -171.1 | 177.6 | 168.9 | 0 | 0 | 112.4 | Q121 R122 K127 R128 R129 | Q121-E125 WeakPolarHBondContact O-CB 3.38Å; Q121-E125 PolarHBondContact O-N 3.48Å; R122-E125 PolarHBondContact O-N 3.12Å; E125-K127 VanDerWaalsContact C-N 3.29Å; E125-K127 PolarHBondContact O-N 2.92Å; E125-R128 WeakPolarHBondContact O-CB 3.38Å; E125-R128 PolarHBondContact O-N 2.73Å; E125-R128 VanDerWaalsContact O-N 3.17Å; E125-R129 WeakPolarHBondContact O-CG 3.44Å; E125-R129 PolarHBondContact O-N 3.28Å; E125-R129 IonicContact OE1-CZ 3.04Å; E125-R129 IonicContact OE1-NE 3.78Å; E125-R129 PolarHBondContact OE1-NE 3.38Å; E125-R129 IonicContact OE1-NH2 2.78Å; E125-R129 PolarHBondContact OE1-NH2 2.9Å |
| 126 | Q | 88.1 | Confident | 84.2 | Confident | 105 Ų | 105 | 116.8 Ų | 116.8 | 49% | 0.491 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -63.3 | -36.3 | 175.5 | -166.9 | 179.3 | 38.1 | 0 | 0 | 111.8 | R122 R130 | R122-Q126 WeakPolarHBondContact O-CB 3.28Å; R122-Q126 PolarHBondContact O-N 3.07Å; Q126-R130 VanDerWaalsContact O-CG 3.29Å; Q126-R130 WeakPolarHBondContact O-CG 3.39Å; Q126-R130 PolarHBondContact O-N 3.23Å |
| 127 | K | 90.8 | Very high | 85 | Confident | 121 Ų | 121 | 119.2 Ų | 119.2 | 53% | 0.526 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -64.7 | -43.2 | 172.3 | -77.8 | -176.7 | 176 | -167.9 | 0 | 112.1 | R123 R124 E125 R130 H131 | R123-K127 WeakPolarHBondContact O-CG 3.48Å; R123-K127 PolarHBondContact O-N 2.82Å; R124-K127 PolarHBondContact O-N 3.15Å; E125-K127 VanDerWaalsContact C-N 3.29Å; E125-K127 PolarHBondContact O-N 2.92Å; K127-R130 PolarHBondContact O-N 3.38Å; K127-H131 PolarHBondContact O-N 3.35Å; K127-H131 VanDerWaalsContact O-N 3.07Å |
| 128 | R | 87.7 | Confident | 85.7 | Confident | 132 Ų | 132 | 118 Ų | 118 | 50% | 0.498 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -59.5 | -51.2 | 173.9 | -68.9 | -169.3 | -55.9 | -90.1 | 3 | 111 | R124 E125 R130 H131 D132 | R124-R128 WeakPolarHBondContact O-CG 3.39Å; R124-R128 PolarHBondContact O-N 3.15Å; E125-R128 WeakPolarHBondContact O-CB 3.38Å; E125-R128 PolarHBondContact O-N 2.73Å; E125-R128 VanDerWaalsContact O-N 3.17Å; R128-R130 VanDerWaalsContact C-N 3.26Å; R128-R130 PolarHBondContact O-N 3.28Å; R128-H131 CarbonylContact O-C 3.59Å; R128-H131 WeakPolarHBondContact O-CA 3.48Å; R128-H131 WeakPolarHBondContact O-CB 3.29Å; R128-H131 PolarHBondContact O-N 3.47Å; R128-D132 PolarHBondContact O-N 2.88Å |
| 129 | R | 88.6 | Confident | 86.1 | Confident | 159 Ų | 159 | 119.1 Ų | 119.1 | 60% | 0.6 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -56.4 | -36.8 | 177.6 | -69.4 | 177.1 | -176.6 | -138.7 | 4.5 | 113.3 | E125 A133 | E125-R129 WeakPolarHBondContact O-CG 3.44Å; E125-R129 PolarHBondContact O-N 3.28Å; E125-R129 IonicContact OE1-CZ 3.04Å; E125-R129 IonicContact OE1-NE 3.78Å; E125-R129 PolarHBondContact OE1-NE 3.38Å; E125-R129 IonicContact OE1-NH2 2.78Å; E125-R129 PolarHBondContact OE1-NH2 2.9Å; R129-A133 VanDerWaalsContact O-CB 3.26Å; R129-A133 WeakPolarHBondContact O-CB 3.44Å; R129-A133 PolarHBondContact O-N 2.81Å |
| 130 | R | 88.4 | Confident | 86.2 | Confident | 156 Ų | 156 | 119.6 Ų | 119.6 | 59% | 0.589 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -67.4 | -42.2 | 174.8 | -74.7 | 175.6 | -173.3 | -163.3 | 3.6 | 112 | Q126 K127 R128 Q134 | Q126-R130 VanDerWaalsContact O-CG 3.29Å; Q126-R130 WeakPolarHBondContact O-CG 3.39Å; Q126-R130 PolarHBondContact O-N 3.23Å; K127-R130 PolarHBondContact O-N 3.38Å; R128-R130 VanDerWaalsContact C-N 3.26Å; R128-R130 PolarHBondContact O-N 3.28Å; R130-Q134 WeakPolarHBondContact O-CG 3.46Å; R130-Q134 PolarHBondContact O-N 3.49Å; R130-Q134 VanDerWaalsContact O-N 3.07Å |
| 131 | H | 89.3 | Confident | 86.2 | Confident | 99 Ų | 99 | 121.1 Ų | 121.1 | 46% | 0.458 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -65.5 | -44.8 | 176.7 | -176.1 | -91.3 | 0 | 0 | 0 | 111.2 | K127 R128 A133 Q134 Q135 | K127-H131 PolarHBondContact O-N 3.35Å; K127-H131 VanDerWaalsContact O-N 3.07Å; R128-H131 CarbonylContact O-C 3.59Å; R128-H131 WeakPolarHBondContact O-CA 3.48Å; R128-H131 WeakPolarHBondContact O-CB 3.29Å; R128-H131 PolarHBondContact O-N 3.47Å; H131-A133 VanDerWaalsContact C-N 3.35Å; H131-A133 PolarHBondContact O-N 3.48Å; H131-Q134 WeakPolarHBondContact O-CB 3.36Å; H131-Q134 PolarHBondContact O-N 2.85Å; H131-Q134 VanDerWaalsContact O-N 3.15Å; H131-Q135 PolarHBondContact CE1-NE2 2.95Å; H131-Q135 PolarHBondContact O-N 3.04Å |
| 132 | D | 88.4 | Confident | 86 | Confident | 77 Ų | 77 | 119.5 Ų | 119.5 | 41% | 0.412 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -63.4 | -40.8 | 177.7 | -56.6 | -20.4 | 0 | 0 | 0 | 111.2 | R128 Q134 Q135 L136 | R128-D132 PolarHBondContact O-N 2.88Å; D132-Q134 VanDerWaalsContact C-N 3.33Å; D132-Q134 PolarHBondContact O-N 3.25Å; D132-Q135 PolarHBondContact O-N 3.37Å; D132-L136 WeakPolarHBondContact O-CB 3.5Å; D132-L136 WeakPolarHBondContact O-CG 3.39Å; D132-L136 PolarHBondContact O-N 2.99Å |
| 133 | A | 88.1 | Confident | 85.7 | Confident | 55 Ų | 55 | 117.4 Ų | 117.4 | 46% | 0.455 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -63.6 | -37.2 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | R129 H131 Q137 | R129-A133 VanDerWaalsContact O-CB 3.26Å; R129-A133 WeakPolarHBondContact O-CB 3.44Å; R129-A133 PolarHBondContact O-N 2.81Å; H131-A133 VanDerWaalsContact C-N 3.35Å; H131-A133 PolarHBondContact O-N 3.48Å; A133-Q137 WeakPolarHBondContact O-CB 3.34Å; A133-Q137 PolarHBondContact O-N 3.46Å |
| 134 | Q | 88.5 | Confident | 85.2 | Confident | 116 Ų | 116 | 112.6 Ų | 112.6 | 54% | 0.542 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -66.9 | -41.3 | 174.1 | -74.1 | 174.2 | 4.5 | 0 | 0 | 111.6 | R130 H131 D132 Q137 Q138 | R130-Q134 WeakPolarHBondContact O-CG 3.46Å; R130-Q134 PolarHBondContact O-N 3.49Å; R130-Q134 VanDerWaalsContact O-N 3.07Å; H131-Q134 WeakPolarHBondContact O-CB 3.36Å; H131-Q134 PolarHBondContact O-N 2.85Å; H131-Q134 VanDerWaalsContact O-N 3.15Å; D132-Q134 VanDerWaalsContact C-N 3.33Å; D132-Q134 PolarHBondContact O-N 3.25Å; Q134-Q137 PolarHBondContact O-N 3.17Å; Q134-Q138 WeakPolarHBondContact O-CG 3.25Å; Q134-Q138 PolarHBondContact O-N 3.09Å |
| 135 | Q | 85.8 | Confident | 84.4 | Confident | 93 Ų | 93 | 110.7 Ų | 110.7 | 44% | 0.435 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -63.9 | -43.2 | 174.9 | -73.7 | -170.9 | -33.7 | 0 | 0 | 112.1 | H131 D132 Q137 Q138 L139 | H131-Q135 PolarHBondContact CE1-NE2 2.95Å; H131-Q135 PolarHBondContact O-N 3.04Å; D132-Q135 PolarHBondContact O-N 3.37Å; Q135-Q137 VanDerWaalsContact C-N 3.31Å; Q135-Q137 PolarHBondContact O-N 3.02Å; Q135-Q138 PolarHBondContact O-N 3.45Å; Q135-L139 WeakPolarHBondContact O-CG 3.44Å; Q135-L139 PolarHBondContact O-N 2.92Å |
| 136 | L | 85.9 | Confident | 83.3 | Confident | 117 Ų | 117 | 115.9 Ų | 115.9 | 61% | 0.613 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -63 | -37.6 | 174.7 | -72.8 | 171.5 | 0 | 0 | 0 | 112 | D132 L139 K140 | D132-L136 WeakPolarHBondContact O-CB 3.5Å; D132-L136 WeakPolarHBondContact O-CG 3.39Å; D132-L136 PolarHBondContact O-N 2.99Å; L136-L139 PolarHBondContact O-N 3.34Å; L136-K140 VanDerWaalsContact O-CB 3.23Å; L136-K140 WeakPolarHBondContact O-CB 3.34Å; L136-K140 PolarHBondContact O-N 3.41Å |
| 137 | Q | 85.4 | Confident | 82.3 | Confident | 146 Ų | 146 | 117.5 Ų | 117.5 | 68% | 0.682 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -65.4 | -39 | 175.1 | -173.1 | 179.4 | -5.3 | 0 | 0 | 111.9 | A133 Q134 Q135 H141 | A133-Q137 WeakPolarHBondContact O-CB 3.34Å; A133-Q137 PolarHBondContact O-N 3.46Å; Q134-Q137 PolarHBondContact O-N 3.17Å; Q135-Q137 VanDerWaalsContact C-N 3.31Å; Q135-Q137 PolarHBondContact O-N 3.02Å; Q137-H141 WeakPolarHBondContact O-CB 3.32Å; Q137-H141 PolarHBondContact O-N 3.4Å |
| 138 | Q | 84.7 | Confident | 81.3 | Confident | 129 Ų | 129 | 118.6 Ų | 118.6 | 60% | 0.603 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -67.4 | -44.4 | 174.9 | -72.1 | 174.9 | -7.6 | 0 | 0 | 111.8 | Q134 Q135 H141 L142 | Q134-Q138 WeakPolarHBondContact O-CG 3.25Å; Q134-Q138 PolarHBondContact O-N 3.09Å; Q135-Q138 PolarHBondContact O-N 3.45Å; Q138-H141 WeakPolarHBondContact O-CB 3.49Å; Q138-H141 PolarHBondContact O-N 3.13Å; Q138-L142 WeakPolarHBondContact O-CG 3.23Å; Q138-L142 PolarHBondContact O-N 2.99Å |
| 139 | L | 83.8 | Confident | 80.1 | Confident | 105 Ų | 105 | 115.4 Ų | 115.4 | 55% | 0.55 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -61.7 | -45.9 | 175.3 | -76 | 164.7 | 0 | 0 | 0 | 111.5 | Q135 L136 H141 L142 E143 | Q135-L139 WeakPolarHBondContact O-CG 3.44Å; Q135-L139 PolarHBondContact O-N 2.92Å; L136-L139 PolarHBondContact O-N 3.34Å; L139-H141 PolarHBondContact O-N 3.36Å; L139-L142 PolarHBondContact O-N 3.22Å; L139-L142 VanDerWaalsContact O-N 3.1Å; L139-E143 WeakPolarHBondContact O-CB 3.49Å; L139-E143 PolarHBondContact O-N 3.37Å |
| 140 | K | 80.9 | Confident | 78.9 | Confident | 140 Ų | 140 | 111.9 Ų | 111.9 | 61% | 0.609 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -59.9 | -34.6 | 175.4 | -173.7 | 177.9 | -177.9 | 177.4 | 0 | 112.2 | L136 S144 | L136-K140 VanDerWaalsContact O-CB 3.23Å; L136-K140 WeakPolarHBondContact O-CB 3.34Å; L136-K140 PolarHBondContact O-N 3.41Å; K140-S144 WeakPolarHBondContact O-CB 3.35Å; K140-S144 PolarHBondContact O-N 3.43Å; K140-S144 PolarHBondContact O-OG 3.07Å |
| 141 | H | 80.2 | Confident | 77.4 | Confident | 126 Ų | 126 | 111.1 Ų | 111.1 | 58% | 0.583 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -67.5 | -43 | 175 | 177.6 | 68.6 | 0 | 0 | 0 | 111.7 | Q137 Q138 L139 F145 | Q137-H141 WeakPolarHBondContact O-CB 3.32Å; Q137-H141 PolarHBondContact O-N 3.4Å; Q138-H141 WeakPolarHBondContact O-CB 3.49Å; Q138-H141 PolarHBondContact O-N 3.13Å; L139-H141 PolarHBondContact O-N 3.36Å; H141-F145 WeakPolarHBondContact O-CB 3.4Å; H141-F145 PolarHBondContact O-N 3.17Å |
| 142 | L | 79.2 | Confident | 76 | Confident | 93 Ų | 93 | 110.1 Ų | 110.1 | 49% | 0.487 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -66.9 | -46.3 | 176.6 | -66.1 | 174.4 | 0 | 0 | 0 | 111.8 | Q138 L139 F145 Y146 | Q138-L142 WeakPolarHBondContact O-CG 3.23Å; Q138-L142 PolarHBondContact O-N 2.99Å; L139-L142 PolarHBondContact O-N 3.22Å; L139-L142 VanDerWaalsContact O-N 3.1Å; L142-F145 PolarHBondContact O-N 3.02Å; L142-Y146 HydrophobicContact CD2-CE2 4.28Å; L142-Y146 VanDerWaalsContact O-CD2 3.3Å; L142-Y146 WeakPolarHBondContact O-CD2 3.49Å; L142-Y146 PolarHBondContact O-N 3.05Å |
| 143 | E | 76.6 | Confident | 74.5 | Confident | 111 Ų | 111 | 113 Ų | 113 | 52% | 0.519 | 59% | 0.588 | S | S | . | * | H | α-helix | trans | -59.9 | -48.7 | 175.3 | -172.3 | 173.7 | -139.8 | 0 | 0 | 110.3 | L139 F145 Y146 E147 | L139-E143 WeakPolarHBondContact O-CB 3.49Å; L139-E143 PolarHBondContact O-N 3.37Å; E143-F145 PolarHBondContact O-N 2.98Å; E143-F145 VanDerWaalsContact O-N 3.14Å; E143-Y146 PolarHBondContact O-N 3.31Å; E143-E147 HydrophobicContact CG-CB 4.34Å; E143-E147 WeakPolarHBondContact CG-OE2 3.34Å; E143-E147 WeakPolarHBondContact O-CA 3.45Å; E143-E147 WeakPolarHBondContact O-CB 3.37Å; E143-E147 PolarHBondContact O-N 3.23Å |
| 144 | S | 73.1 | Confident | 72.9 | Confident | 47 Ų | 47 | 115.8 Ų | 115.8 | 33% | 0.329 | 59% | 0.594 | S | S | . | * | H | α-helix | trans | -61 | -28.5 | 176.2 | -63.8 | 0 | 0 | 0 | 0 | 114.2 | K140 K148 | K140-S144 WeakPolarHBondContact O-CB 3.35Å; K140-S144 PolarHBondContact O-N 3.43Å; K140-S144 PolarHBondContact O-OG 3.07Å; S144-K148 WeakPolarHBondContact O-CD 3.46Å |
| 145 | F | 69.9 | Low | 71.5 | Confident | 131 Ų | 131 | 119.6 Ų | 119.6 | 58% | 0.575 | 61% | 0.609 | S | S | * | * | H | α-helix | trans | -85.9 | -31.4 | -176.8 | -175 | -94.2 | 0 | 0 | 0 | 112.7 | H141 L142 E143 | H141-F145 WeakPolarHBondContact O-CB 3.4Å; H141-F145 PolarHBondContact O-N 3.17Å; L142-F145 PolarHBondContact O-N 3.02Å; E143-F145 PolarHBondContact O-N 2.98Å; E143-F145 VanDerWaalsContact O-N 3.14Å |
| 146 | Y | 65.7 | Low | 70.2 | Confident | 175 Ų | 175 | 123 Ų | 123 | 69% | 0.686 | 63% | 0.625 | S | S | * | * | H | α-helix | trans | -108.3 | -20 | -176.9 | -69.4 | -71.2 | 0 | 0 | 0 | 114.6 | L142 E143 | L142-Y146 HydrophobicContact CD2-CE2 4.28Å; L142-Y146 VanDerWaalsContact O-CD2 3.3Å; L142-Y146 WeakPolarHBondContact O-CD2 3.49Å; L142-Y146 PolarHBondContact O-N 3.05Å; E143-Y146 PolarHBondContact O-N 3.31Å |
| 147 | E | 67.1 | Low | 68.7 | Low | 139 Ų | 139 | 124.5 Ų | 124.5 | 65% | 0.65 | 63% | 0.633 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84.6 | -28.3 | 177.6 | -161.8 | -176.9 | -155 | 0 | 0 | 111.6 | E143 P149 | E143-E147 HydrophobicContact CG-CB 4.34Å; E143-E147 WeakPolarHBondContact CG-OE2 3.34Å; E143-E147 WeakPolarHBondContact O-CA 3.45Å; E143-E147 WeakPolarHBondContact O-CB 3.37Å; E143-E147 PolarHBondContact O-N 3.23Å; E147-P149 WeakPolarHBondContact O-CD 3.19Å |
| 148 | K | 69.9 | Low | 67.3 | Low | 144 Ų | 144 | 126.5 Ų | 126.5 | 63% | 0.626 | 64% | 0.643 | S | S | * | * | S | Bend | trans | -76.7 | 112.1 | 166.8 | -69.6 | 177.7 | -171.5 | 171 | 0 | 107.6 | S144 | S144-K148 WeakPolarHBondContact O-CD 3.46Š|
| 149 | P | 63.5 | Low | 66 | Low | 65 Ų | 65 | 125.4 Ų | 125.4 | 42% | 0.422 | 65% | 0.645 | S | S | . | * | trans | -57.8 | 142.9 | 176.7 | 22.2 | -30.1 | 0 | 0 | 0 | 109.3 | E147 I154 | E147-P149 WeakPolarHBondContact O-CD 3.19Å; P149-I154 HydrophobicContact CB-CD1 4.4Å; P149-I154 HydrophobicContact CB-CG1 4.47Å; P149-I154 HydrophobicContact CG-CD1 3.42Å; P149-I154 VanDerWaalsContact CG-CD1 3.42Å; P149-I154 HydrophobicContact CG-CG1 3.97Å | ||
| 150 | P | 62.9 | Low | 65.3 | Low | 85 Ų | 85 | 126.4 Ų | 126.4 | 55% | 0.552 | 65% | 0.645 | S | S | * | * | trans | -54.7 | 135.5 | -178.3 | 18.9 | -29.8 | 0 | 0 | 0 | 110 | G152 L153 | P150-G152 PolarHBondContact O-N 3.25Å; P150-L153 HydrophobicContact CG-CB 4.41Å; P150-L153 HydrophobicContact CG-CD2 4.46Å; P150-L153 PolarHBondContact O-N 2.95Å | ||
| 151 | P | 56.2 | Low | 64.4 | Low | 141 Ų | 141 | 122.7 Ų | 122.7 | 92% | 0.916 | 64% | 0.635 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -58.6 | 111.9 | -177.3 | 22.4 | -31.4 | 0 | 0 | 0 | 109 | ||
| 152 | G | 60.3 | Low | 63.9 | Low | 78 Ų | 78 | 118 Ų | 118 | 80% | 0.804 | 61% | 0.613 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 124.4 | -6.4 | -177.7 | 0 | 0 | 0 | 0 | 0 | 116.5 | P150 | P150-G152 PolarHBondContact O-N 3.25Š|
| 153 | L | 56.2 | Low | 63.4 | Low | 137 Ų | 137 | 119 Ų | 119 | 72% | 0.717 | 62% | 0.619 | S | S | * | * | S | Bend | trans | -98.5 | -16.8 | -179.6 | -154.1 | 65.1 | 0 | 0 | 0 | 114.8 | P150 | P150-L153 HydrophobicContact CG-CB 4.41Å; P150-L153 HydrophobicContact CG-CD2 4.46Å; P150-L153 PolarHBondContact O-N 2.95Å |
| 154 | I | 55.4 | Low | 63.2 | Low | 113 Ų | 113 | 117.3 Ų | 117.3 | 58% | 0.579 | 62% | 0.619 | S | S | * | * | S | Bend | trans | -87.9 | 111.6 | 165.2 | -56.8 | 163.1 | 0 | 0 | 0 | 105.4 | P149 E156 | P149-I154 HydrophobicContact CB-CD1 4.4Å; P149-I154 HydrophobicContact CB-CG1 4.47Å; P149-I154 HydrophobicContact CG-CD1 3.42Å; P149-I154 VanDerWaalsContact CG-CD1 3.42Å; P149-I154 HydrophobicContact CG-CG1 3.97Å; I154-E156 PolarHBondContact O-N 3.1Å |
| 155 | K | 59.8 | Low | 63.3 | Low | 196 Ų | 196 | 115.4 Ų | 115.4 | 85% | 0.852 | 61% | 0.605 | S | S | * | * | trans | -63.3 | 92 | 156.6 | -69.3 | 174.7 | -176.8 | 175.4 | 0 | 104.7 | D157 | K155-D157 PolarHBondContact O-N 3.46Š| ||
| 156 | E | 57.9 | Low | 63.6 | Low | 166 Ų | 166 | 112.4 Ų | 112.4 | 78% | 0.776 | 60% | 0.599 | S | S | * | * | trans | -50.8 | 116.8 | 157.6 | -70.9 | 175.9 | 159.6 | 0 | 0 | 103.8 | I154 E158 | I154-E156 PolarHBondContact O-N 3.1Å; E156-E158 PolarHBondContact O-N 3.45Å | ||
| 157 | D | 54.5 | Low | 64 | Low | 147 Ų | 147 | 110.7 Ų | 110.7 | 79% | 0.786 | 60% | 0.601 | S | S | * | * | trans | -43.4 | 117.5 | 172.5 | -74.9 | -47.3 | 0 | 0 | 0 | 105.7 | K155 T159 | K155-D157 PolarHBondContact O-N 3.46Å; D157-T159 WeakPolarHBondContact O-CA 3.44Å; D157-T159 WeakPolarHBondContact O-CG2 3.05Å; D157-T159 PolarHBondContact O-N 2.94Å | ||
| 158 | E | 55.7 | Low | 64.4 | Low | 188 Ų | 188 | 107.8 Ų | 107.8 | 88% | 0.879 | 59% | 0.593 | S | S | * | * | trans | -52.1 | 96.3 | -175.7 | -71.2 | 176.6 | 170.5 | 0 | 0 | 106.8 | E156 K160 | E156-E158 PolarHBondContact O-N 3.45Å; E158-K160 PolarHBondContact O-N 3.36Å | ||
| 159 | T | 58.2 | Low | 64.3 | Low | 107 Ų | 107 | 106.4 Ų | 106.4 | 66% | 0.656 | 60% | 0.599 | S | S | * | * | trans | -63.6 | 111.7 | -170.8 | 49.4 | 0 | 0 | 0 | 0 | 104.4 | D157 | D157-T159 WeakPolarHBondContact O-CA 3.44Å; D157-T159 WeakPolarHBondContact O-CG2 3.05Å; D157-T159 PolarHBondContact O-N 2.94Å | ||
| 160 | K | 67.8 | Low | 64.7 | Low | 126 Ų | 126 | 105.6 Ų | 105.6 | 55% | 0.548 | 60% | 0.602 | S | S | . | * | trans | -64.1 | 142.7 | -166.4 | -53.7 | 179.5 | -175.7 | 168 | 0 | 107.2 | E158 E162 D163 | E158-K160 PolarHBondContact O-N 3.36Å; K160-E162 HydrophobicContact CB-CG 3.84Å; K160-E162 WeakPolarHBondContact CB-OE1 3.49Å; K160-E162 WeakPolarHBondContact CB-OE2 3.35Å; K160-E162 WeakPolarHBondContact CD-OE1 3.32Å; K160-E162 PolarHBondContact O-N 3.39Å; K160-D163 PolarHBondContact N-OD2 3.41Å; K160-D163 WeakPolarHBondContact O-CB 3.37Å; K160-D163 PolarHBondContact O-N 2.87Å | ||
| 161 | P | 63.3 | Low | 65.3 | Low | 61 Ų | 61 | 102 Ų | 102 | 40% | 0.396 | 58% | 0.579 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -57.3 | -19.9 | -171.4 | 21.7 | -33.1 | 0 | 0 | 0 | 114 | L178 | P161-L178 HydrophobicContact CB-CD1 4.48Š|
| 162 | E | 68.8 | Low | 66.4 | Low | 27 Ų | 27 | 100.9 Ų | 100.9 | 13% | 0.126 | 56% | 0.561 | C | S | . | * | T | Hydrogen-bonded Turn | trans | -66 | -30.2 | 170.9 | 56.7 | -94.9 | -143.1 | 0 | 0 | 115.3 | K160 C164 I165 R175 L178 | K160-E162 HydrophobicContact CB-CG 3.84Å; K160-E162 WeakPolarHBondContact CB-OE1 3.49Å; K160-E162 WeakPolarHBondContact CB-OE2 3.35Å; K160-E162 WeakPolarHBondContact CD-OE1 3.32Å; K160-E162 PolarHBondContact O-N 3.39Å; E162-C164 VanDerWaalsContact C-N 3.26Å; E162-C164 PolarHBondContact O-N 3.35Å; E162-I165 PolarHBondContact O-N 2.95Å; E162-I165 VanDerWaalsContact O-N 3.17Å; E162-R175 HydrophobicContact CB-CG 3.7Å; E162-L178 HydrophobicContact CB-CB 4.49Å |
| 163 | D | 68.4 | Low | 67.1 | Low | 114 Ų | 114 | 102.8 Ų | 102.8 | 61% | 0.61 | 55% | 0.549 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -76.4 | -15.8 | -173.2 | -64.1 | -35.1 | 0 | 0 | 0 | 112.2 | K160 I165 | K160-D163 PolarHBondContact N-OD2 3.41Å; K160-D163 WeakPolarHBondContact O-CB 3.37Å; K160-D163 PolarHBondContact O-N 2.87Å; D163-I165 PolarHBondContact O-N 3.43Å |
| 164 | C | 73.7 | Confident | 68 | Low | 77 Ų | 77 | 96.6 Ų | 96.6 | 52% | 0.52 | 52% | 0.518 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -73.1 | -8 | 171.2 | -61.4 | 0 | 0 | 0 | 0 | 113.2 | E162 | E162-C164 VanDerWaalsContact C-N 3.26Å; E162-C164 PolarHBondContact O-N 3.35Å |
| 165 | I | 74.7 | Confident | 69.2 | Low | 7 Ų | 7 | 94 Ų | 94 | 4% | 0.036 | 50% | 0.5 | C | S | . | . | S | Bend | trans | -107.7 | 112 | -175.2 | -55.8 | -177.1 | 0 | 0 | 0 | 110.6 | E162 D163 N171 A174 R175 L178 Y205 | E162-I165 PolarHBondContact O-N 2.95Å; E162-I165 VanDerWaalsContact O-N 3.17Å; D163-I165 PolarHBondContact O-N 3.43Å; I165-N171 HydrophobicContact CG2-CB 3.59Å; I165-A174 HydrophobicContact CD1-CB 3.79Å; I165-R175 PolarHBondContact O-NH2 3.26Å; I165-L178 HydrophobicContact CD1-CD1 3.82Å; I165-Y205 HydrophobicContact CG1-CG 4.45Å; I165-Y205 HydrophobicContact CG2-CD2 4.13Å |
| 166 | P | 76.6 | Confident | 70 | Confident | 67 Ų | 67 | 90.3 Ų | 90.3 | 44% | 0.435 | 49% | 0.486 | S | S | . | . | trans | -61.5 | 147.1 | -179.2 | -25.2 | 34.7 | 0 | 0 | 0 | 115.2 | V168 R175 | P166-V168 HydrophobicContact CB-CG2 4.06Å; P166-V168 PolarHBondContact O-N 2.86Å; P166-R175 PolarHBondContact O-NH2 2.87Å; P166-R175 VanDerWaalsContact O-NH2 3.15Å | ||
| 167 | D | 73.8 | Confident | 70.8 | Confident | 139 Ų | 139 | 85.3 Ų | 85.3 | 74% | 0.743 | 46% | 0.462 | S | S | * | . | S | Bend | trans | -68 | 65.2 | 176.9 | -74.3 | -35.4 | 0 | 0 | 0 | 113.8 | R175 | D167-R175 VanDerWaalsContact CA-NH2 3.26Å; D167-R175 VanDerWaalsContact N-NH2 3.17Å; D167-R175 IonicContact OD1-CZ 3.86Å; D167-R175 IonicContact OD1-NE 2.68Å; D167-R175 IonicContact OD1-NH1 2.64Å; D167-R175 PolarHBondContact OD1-NH1 2.86Å; D167-R175 IonicContact OD1-NH2 2.86Å; D167-R175 PolarHBondContact OD1-NH2 3.18Å |
| 168 | V | 74.1 | Confident | 71.8 | Confident | 78 Ų | 78 | 79.6 Ų | 79.6 | 47% | 0.473 | 43% | 0.431 | S | S | . | . | trans | -120.2 | 137.2 | 179.5 | -167.7 | 0 | 0 | 0 | 0 | 109.2 | P166 G170 N171 | P166-V168 HydrophobicContact CB-CG2 4.06Å; P166-V168 PolarHBondContact O-N 2.86Å; V168-G170 PolarHBondContact O-N 3.3Å; V168-G170 VanDerWaalsContact O-N 3.15Å; V168-N171 PolarHBondContact O-N 2.83Å; V168-N171 VanDerWaalsContact O-N 3.11Å | ||
| 169 | P | 67.9 | Low | 72.9 | Confident | 115 Ų | 115 | 73.2 Ų | 73.2 | 75% | 0.747 | 41% | 0.411 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -56 | 122.5 | 179 | 21.4 | -33.9 | 0 | 0 | 0 | 110.6 | ||
| 170 | G | 71.8 | Confident | 73.7 | Confident | 48 Ų | 48 | 75 Ų | 75 | 50% | 0.495 | 41% | 0.412 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 109.4 | -10.2 | -177.1 | 0 | 0 | 0 | 0 | 0 | 115.9 | V168 | V168-G170 PolarHBondContact O-N 3.3Å; V168-G170 VanDerWaalsContact O-N 3.15Å |
| 171 | N | 76.8 | Confident | 73.6 | Confident | 11 Ų | 11 | 70.3 Ų | 70.3 | 6% | 0.059 | 40% | 0.396 | C | S | . | . | S | Bend | trans | -99.8 | -9.9 | 169.9 | -76 | -12.9 | 0 | 0 | 0 | 113.2 | I165 V168 H173 A174 R175 Y205 | I165-N171 HydrophobicContact CG2-CB 3.59Å; V168-N171 PolarHBondContact O-N 2.83Å; V168-N171 VanDerWaalsContact O-N 3.11Å; N171-H173 PolarHBondContact O-N 3.37Å; N171-A174 PolarHBondContact O-N 2.98Å; N171-A174 VanDerWaalsContact O-N 3.07Å; N171-R175 PolarHBondContact O-N 3.32Å; N171-Y205 PolarHBondContact OD1-N 3.45Å |
| 172 | E | 78.8 | Confident | 73.9 | Confident | 117 Ų | 117 | 70.7 Ų | 70.7 | 55% | 0.547 | 40% | 0.399 | S | S | . | . | H | α-helix | trans | -50.5 | -43.3 | 180 | -67.5 | 165.9 | -162.6 | 0 | 0 | 112.3 | A174 R175 E176 | E172-A174 VanDerWaalsContact C-N 3.34Å; E172-A174 PolarHBondContact O-N 3.49Å; E172-R175 PolarHBondContact O-N 2.89Å; E172-E176 WeakPolarHBondContact O-CB 3.26Å; E172-E176 PolarHBondContact O-N 3.48Å |
| 173 | H | 74.9 | Confident | 73.5 | Confident | 117 Ų | 117 | 75.9 Ų | 75.9 | 54% | 0.542 | 43% | 0.432 | S | S | . | . | H | α-helix | trans | -64.2 | -36.1 | -178.6 | -169.6 | 51 | 0 | 0 | 0 | 113.4 | N171 F177 | N171-H173 PolarHBondContact O-N 3.37Å; H173-F177 VanDerWaalsContact O-CB 3.31Å; H173-F177 WeakPolarHBondContact O-CB 3.48Å; H173-F177 PolarHBondContact O-N 3.45Å; H173-F177 VanDerWaalsContact O-N 3.14Å |
| 174 | A | 75.6 | Confident | 72.7 | Confident | 8 Ų | 8 | 80.1 Ų | 80.1 | 7% | 0.066 | 45% | 0.445 | C | S | . | . | H | α-helix | trans | -72.4 | -34.6 | 178.3 | 0 | 0 | 0 | 0 | 0 | 111.1 | I165 N171 E172 L178 V194 | I165-A174 HydrophobicContact CD1-CB 3.79Å; N171-A174 PolarHBondContact O-N 2.98Å; N171-A174 VanDerWaalsContact O-N 3.07Å; E172-A174 VanDerWaalsContact C-N 3.34Å; E172-A174 PolarHBondContact O-N 3.49Å; A174-L178 WeakPolarHBondContact O-CG 3.49Å; A174-L178 PolarHBondContact O-N 2.86Å; A174-L178 VanDerWaalsContact O-N 3.17Å; A174-V194 HydrophobicContact CB-CG1 3.85Å |
| 175 | R | 80.1 | Confident | 71.6 | Confident | 57 Ų | 57 | 79.3 Ų | 79.3 | 22% | 0.215 | 45% | 0.449 | C | S | . | . | H | α-helix | trans | -69.2 | -50 | 175.9 | -165.9 | -174.3 | -61.2 | 137.1 | -1.4 | 112.1 | E162 I165 P166 D167 N171 E172 F177 L178 A179 | E162-R175 HydrophobicContact CB-CG 3.7Å; I165-R175 PolarHBondContact O-NH2 3.26Å; P166-R175 PolarHBondContact O-NH2 2.87Å; P166-R175 VanDerWaalsContact O-NH2 3.15Å; D167-R175 VanDerWaalsContact CA-NH2 3.26Å; D167-R175 VanDerWaalsContact N-NH2 3.17Å; D167-R175 IonicContact OD1-CZ 3.86Å; D167-R175 IonicContact OD1-NE 2.68Å; D167-R175 IonicContact OD1-NH1 2.64Å; D167-R175 PolarHBondContact OD1-NH1 2.86Å; D167-R175 IonicContact OD1-NH2 2.86Å; D167-R175 PolarHBondContact OD1-NH2 3.18Å; N171-R175 PolarHBondContact O-N 3.32Å; E172-R175 PolarHBondContact O-N 2.89Å; R175-F177 PolarHBondContact O-N 3.45Å; R175-L178 PolarHBondContact O-N 3.29Å; R175-A179 VanDerWaalsContact O-CB 3.32Å; R175-A179 WeakPolarHBondContact O-CB 3.23Å; R175-A179 PolarHBondContact O-N 3.31Å |
| 176 | E | 76.9 | Confident | 70.8 | Confident | 119 Ų | 119 | 87.6 Ų | 87.6 | 56% | 0.556 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -60.4 | -36.8 | 179.8 | -169.2 | 176 | -157.9 | 0 | 0 | 110.9 | E172 H180 | E172-E176 WeakPolarHBondContact O-CB 3.26Å; E172-E176 PolarHBondContact O-N 3.48Å; E176-H180 PolarHBondContact O-N 2.9Å; E176-H180 PolarHBondContact O-ND1 3Å |
| 177 | F | 74.3 | Confident | 69.4 | Low | 61 Ų | 61 | 90.8 Ų | 90.8 | 27% | 0.268 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -66.5 | -44.5 | 174.9 | -175.7 | -95.6 | 0 | 0 | 0 | 113.1 | H173 R175 A181 V194 | H173-F177 VanDerWaalsContact O-CB 3.31Å; H173-F177 WeakPolarHBondContact O-CB 3.48Å; H173-F177 PolarHBondContact O-N 3.45Å; H173-F177 VanDerWaalsContact O-N 3.14Å; R175-F177 PolarHBondContact O-N 3.45Å; F177-A181 WeakPolarHBondContact O-CB 3.27Å; F177-A181 PolarHBondContact O-N 3.31Å; F177-A181 VanDerWaalsContact O-N 3.12Å; F177-V194 HydrophobicContact CB-CG2 4.22Å; F177-V194 HydrophobicContact CD1-CB 3.77Å; F177-V194 HydrophobicContact CD1-CG2 3.43Å; F177-V194 VanDerWaalsContact CD1-CG2 3.43Å; F177-V194 HydrophobicContact CD2-CG2 4.39Å; F177-V194 HydrophobicContact CE1-CB 4.05Å; F177-V194 HydrophobicContact CE1-CG2 3.8Å; F177-V194 HydrophobicContact CG-CG2 3.75Å; F177-V194 HydrophobicContact CZ-CG2 4.42Å |
| 178 | L | 75.8 | Confident | 68.5 | Low | 27 Ų | 27 | 88.7 Ų | 88.7 | 14% | 0.141 | 48% | 0.483 | C | S | . | . | H | α-helix | trans | -71.3 | -36.7 | 179.4 | -70.9 | 171.8 | 0 | 0 | 0 | 112.4 | P161 E162 I165 A174 R175 H180 A181 V196 | P161-L178 HydrophobicContact CB-CD1 4.48Å; E162-L178 HydrophobicContact CB-CB 4.49Å; I165-L178 HydrophobicContact CD1-CD1 3.82Å; A174-L178 WeakPolarHBondContact O-CG 3.49Å; A174-L178 PolarHBondContact O-N 2.86Å; A174-L178 VanDerWaalsContact O-N 3.17Å; R175-L178 PolarHBondContact O-N 3.29Å; L178-H180 VanDerWaalsContact C-N 3.27Å; L178-H180 PolarHBondContact O-N 3.49Å; L178-A181 PolarHBondContact O-N 2.84Å; L178-V196 HydrophobicContact CD1-CG2 4.39Å |
| 179 | A | 77.8 | Confident | 67.1 | Low | 54 Ų | 54 | 87.9 Ų | 87.9 | 45% | 0.446 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -64.4 | -30 | 178.1 | 0 | 0 | 0 | 0 | 0 | 113.2 | R175 | R175-A179 VanDerWaalsContact O-CB 3.32Å; R175-A179 WeakPolarHBondContact O-CB 3.23Å; R175-A179 PolarHBondContact O-N 3.31Å |
| 180 | H | 75.6 | Confident | 66.3 | Low | 146 Ų | 146 | 89.5 Ų | 89.5 | 68% | 0.676 | 48% | 0.481 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -100.3 | -1.9 | 178 | -62.6 | 86.5 | 0 | 0 | 0 | 113.1 | E176 L178 | E176-H180 PolarHBondContact O-N 2.9Å; E176-H180 PolarHBondContact O-ND1 3Å; L178-H180 VanDerWaalsContact C-N 3.27Å; L178-H180 PolarHBondContact O-N 3.49Å |
| 181 | A | 66.8 | Low | 65.5 | Low | 26 Ų | 26 | 90.6 Ų | 90.6 | 22% | 0.215 | 49% | 0.492 | C | S | . | . | S | Bend | trans | -74.2 | 130.8 | 179.5 | 0 | 0 | 0 | 0 | 0 | 109.9 | F177 L178 T183 | F177-A181 WeakPolarHBondContact O-CB 3.27Å; F177-A181 PolarHBondContact O-N 3.31Å; F177-A181 VanDerWaalsContact O-N 3.12Å; L178-A181 PolarHBondContact O-N 2.84Å; A181-T183 PolarHBondContact O-N 3.18Å; A181-T183 VanDerWaalsContact O-N 3.16Å |
| 182 | P | 68.7 | Low | 64.6 | Low | 70 Ų | 70 | 96.6 Ų | 96.6 | 46% | 0.455 | 52% | 0.518 | S | S | . | . | trans | -53.2 | 123 | 169.4 | -24.2 | 34.6 | 0 | 0 | 0 | 110.1 | K184 W187 | P182-K184 PolarHBondContact O-N 3.03Å; P182-W187 HydrophobicContact CG-CD2 4.07Å; P182-W187 HydrophobicContact CG-CE3 3.85Å; P182-W187 HydrophobicContact CG-CH2 4.33Å; P182-W187 HydrophobicContact CG-CZ3 3.97Å | ||
| 183 | T | 59.7 | Low | 63.8 | Low | 136 Ų | 136 | 96.5 Ų | 96.5 | 83% | 0.834 | 52% | 0.517 | S | S | * | . | S | Bend | trans | -68.5 | -7.5 | -169 | 8.3 | 0 | 0 | 0 | 0 | 114.7 | A181 | A181-T183 PolarHBondContact O-N 3.18Å; A181-T183 VanDerWaalsContact O-N 3.16Å |
| 184 | K | 51.7 | Low | 63.2 | Low | 203 Ų | 203 | 92.5 Ų | 92.5 | 88% | 0.883 | 50% | 0.501 | S | S | * | . | S | Bend | trans | -122.5 | 90.7 | -176.4 | -65.6 | -175.1 | -178.2 | 175.7 | 0 | 110.8 | P182 | P182-K184 PolarHBondContact O-N 3.03Š|
| 185 | G | 52 | Low | 62.9 | Low | 59 Ų | 59 | 95.1 Ų | 95.1 | 61% | 0.608 | 51% | 0.511 | S | S | * | . | S | Bend | trans | 127.6 | 141.8 | 170.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | W187 | G185-W187 PolarHBondContact O-N 3.04Š|
| 186 | L | 56.6 | Low | 62.2 | Low | 181 Ų | 181 | 96.4 Ų | 96.4 | 95% | 0.948 | 53% | 0.525 | S | S | * | . | trans | -61 | 80 | 169.2 | -176.1 | 66.9 | 0 | 0 | 0 | 108.8 | M188 | L186-M188 PolarHBondContact O-N 3.17Å; L186-M188 VanDerWaalsContact O-N 3.14Å | ||
| 187 | W | 48.2 | Very low | 61.7 | Low | 135 Ų | 135 | 94.5 Ų | 94.5 | 51% | 0.511 | 52% | 0.517 | S | S | . | . | trans | -81.8 | 97.7 | -174.2 | -172.3 | 45.8 | 0 | 0 | 0 | 109.6 | P182 G185 P189 | P182-W187 HydrophobicContact CG-CD2 4.07Å; P182-W187 HydrophobicContact CG-CE3 3.85Å; P182-W187 HydrophobicContact CG-CH2 4.33Å; P182-W187 HydrophobicContact CG-CZ3 3.97Å; G185-W187 PolarHBondContact O-N 3.04Å; W187-P189 VanDerWaalsContact C-CD 3.46Å; W187-P189 HydrophobicContact CD2-CB 4.42Å; W187-P189 HydrophobicContact CD2-CG 3.64Å; W187-P189 HydrophobicContact CE3-CG 4.18Å; W187-P189 HydrophobicContact CG-CG 4.09Å; W187-P189 HydrophobicContact CH2-CG 4.16Å; W187-P189 HydrophobicContact CZ2-CB 4.04Å; W187-P189 HydrophobicContact CZ2-CG 3.55Å; W187-P189 HydrophobicContact CZ3-CG 4.44Å; W187-P189 VanDerWaalsContact NE1-CB 3.31Å; W187-P189 WeakPolarHBondContact O-CD 3.38Å | ||
| 188 | M | 54.1 | Low | 61.9 | Low | 95 Ų | 95 | 95.9 Ų | 95.9 | 47% | 0.468 | 52% | 0.524 | S | S | . | . | trans | -104.6 | 94.4 | 159.8 | -98.7 | -106.1 | -76.7 | 0 | 0 | 108.5 | L186 E193 | L186-M188 PolarHBondContact O-N 3.17Å; L186-M188 VanDerWaalsContact O-N 3.14Å; M188-E193 HydrophobicContact CE-CG 3.62Å; M188-E193 WeakPolarHBondContact CE-OE1 3.31Å; M188-E193 HydrophobicContact CG-CG 3.92Å; M188-E193 HydrophobicContact SD-CB 4.35Å; M188-E193 HydrophobicContact SD-CG 3.19Å; M188-E193 WeakPolarHBondContact SD-CG 3.37Å | ||
| 189 | P | 46.1 | Very low | 62.2 | Low | 61 Ų | 61 | 94.6 Ų | 94.6 | 40% | 0.396 | 52% | 0.517 | S | S | . | . | S | Bend | trans | -100.9 | -14.8 | 169.7 | 39.3 | -39.1 | 0 | 0 | 0 | 113.9 | W187 | W187-P189 VanDerWaalsContact C-CD 3.46Å; W187-P189 HydrophobicContact CD2-CB 4.42Å; W187-P189 HydrophobicContact CD2-CG 3.64Å; W187-P189 HydrophobicContact CE3-CG 4.18Å; W187-P189 HydrophobicContact CG-CG 4.09Å; W187-P189 HydrophobicContact CH2-CG 4.16Å; W187-P189 HydrophobicContact CZ2-CB 4.04Å; W187-P189 HydrophobicContact CZ2-CG 3.55Å; W187-P189 HydrophobicContact CZ3-CG 4.44Å; W187-P189 VanDerWaalsContact NE1-CB 3.31Å; W187-P189 WeakPolarHBondContact O-CD 3.38Å |
| 190 | L | 49.3 | Very low | 62.2 | Low | 149 Ų | 149 | 101.4 Ų | 101.4 | 78% | 0.78 | 53% | 0.532 | S | S | * | . | S | Bend | trans | -137.7 | 20.5 | -165.6 | -70.5 | 172.4 | 0 | 0 | 0 | 114.5 | K192 | L190-K192 PolarHBondContact O-N 3.38Š|
| 191 | G | 55.1 | Low | 62.1 | Low | 70 Ų | 70 | 98.6 Ų | 98.6 | 72% | 0.722 | 52% | 0.515 | S | S | * | . | S | Bend | trans | 65.7 | 9 | 174.2 | 0 | 0 | 0 | 0 | 0 | 115.8 | ||
| 192 | K | 58.2 | Low | 62.6 | Low | 137 Ų | 137 | 98.3 Ų | 98.3 | 60% | 0.596 | 51% | 0.511 | S | S | * | . | trans | -102.9 | 96.4 | 171.6 | -67.9 | -174.6 | -179.4 | -179.3 | 0 | 109.1 | L190 V194 | L190-K192 PolarHBondContact O-N 3.38Å; K192-V194 PolarHBondContact O-N 3.04Å | ||
| 193 | E | 62.6 | Low | 63.1 | Low | 115 Ų | 115 | 99.3 Ų | 99.3 | 54% | 0.537 | 51% | 0.509 | S | S | . | . | trans | -81.5 | 106.5 | 171.8 | -66.9 | 179.9 | -176.9 | 0 | 0 | 109.5 | M188 K195 | M188-E193 HydrophobicContact CE-CG 3.62Å; M188-E193 WeakPolarHBondContact CE-OE1 3.31Å; M188-E193 HydrophobicContact CG-CG 3.92Å; M188-E193 HydrophobicContact SD-CB 4.35Å; M188-E193 HydrophobicContact SD-CG 3.19Å; M188-E193 WeakPolarHBondContact SD-CG 3.37Å; E193-K195 PolarHBondContact O-N 3.36Å | ||
| 194 | V | 62.4 | Low | 63.8 | Low | 34 Ų | 34 | 97 Ų | 97 | 21% | 0.206 | 49% | 0.485 | C | S | . | . | trans | -85.5 | 99 | 168.4 | -177 | 0 | 0 | 0 | 0 | 107.9 | A174 F177 K192 | A174-V194 HydrophobicContact CB-CG1 3.85Å; F177-V194 HydrophobicContact CB-CG2 4.22Å; F177-V194 HydrophobicContact CD1-CB 3.77Å; F177-V194 HydrophobicContact CD1-CG2 3.43Å; F177-V194 VanDerWaalsContact CD1-CG2 3.43Å; F177-V194 HydrophobicContact CD2-CG2 4.39Å; F177-V194 HydrophobicContact CE1-CB 4.05Å; F177-V194 HydrophobicContact CE1-CG2 3.8Å; F177-V194 HydrophobicContact CG-CG2 3.75Å; F177-V194 HydrophobicContact CZ-CG2 4.42Å; K192-V194 PolarHBondContact O-N 3.04Å | ||
| 195 | K | 68.3 | Low | 65 | Low | 63 Ų | 63 | 90 Ų | 90 | 27% | 0.274 | 45% | 0.453 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -73.8 | 126.6 | 174.6 | -66.9 | 170.8 | -172.6 | 158.8 | 0 | 109.1 | E193 M197 G206 R208 D211 | E193-K195 PolarHBondContact O-N 3.36Å; K195-M197 PolarHBondContact O-N 2.94Å; K195-G206 PolarHBondContact N-O 3.45Å; K195-G206 CarbonylContact O-C 3.55Å; K195-G206 WeakPolarHBondContact O-CA 3.14Å; K195-G206 PolarHBondContact O-N 3.39Å; K195-R208 HydrophobicContact CD-CG 4.21Å; K195-D211 IonicContact NZ-OD2 3.24Å; K195-D211 PolarHBondContact NZ-OD2 3.11Å |
| 196 | V | 66 | Low | 66.2 | Low | 83 Ų | 83 | 88 Ų | 88 | 50% | 0.503 | 43% | 0.433 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -74.9 | 47.8 | 171.4 | -164 | 0 | 0 | 0 | 0 | 110.5 | L178 | L178-V196 HydrophobicContact CD1-CG2 4.39Å |
| 197 | M | 67.1 | Low | 67.1 | Low | 79 Ų | 79 | 79.8 Ų | 79.8 | 39% | 0.389 | 39% | 0.389 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -126.1 | 140.7 | 173.4 | -61.2 | -166.2 | -15.9 | 0 | 0 | 108.9 | K195 G206 R208 | K195-M197 PolarHBondContact O-N 2.94Å; M197-G206 PolarHBondContact O-N 3.37Å; M197-R208 HydrophobicContact CE-CG 3.47Å; M197-R208 VanDerWaalsContact CE-CG 3.47Å |
| 198 | Q | 77.8 | Confident | 68.5 | Low | 90 Ų | 90 | 79.6 Ų | 79.6 | 42% | 0.421 | 39% | 0.389 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -82.5 | 127.2 | 175.8 | -161.6 | -179.2 | 40.8 | 0 | 0 | 110.1 | W200 K203 Y205 | Q198-W200 PolarHBondContact O-N 3.49Å; Q198-K203 WeakPolarHBondContact CG-O 3.23Å; Q198-K203 PolarHBondContact NE2-O 3.32Å; Q198-Y205 HydrophobicContact CB-CD1 4.02Å; Q198-Y205 HydrophobicContact CB-CE1 3.68Å; Q198-Y205 HydrophobicContact CB-CE2 4.39Å; Q198-Y205 HydrophobicContact CG-CD2 4.35Å; Q198-Y205 HydrophobicContact CG-CE1 4.26Å; Q198-Y205 HydrophobicContact CG-CE2 4.06Å |
| 199 | C | 82.1 | Confident | 69.4 | Low | 0 Ų | 0 | 78.3 Ų | 78.3 | 0% | 0 | 39% | 0.386 | C | S | . | . | trans | -66.8 | 127.9 | 170.6 | 177.1 | 0 | 0 | 0 | 0 | 110 | R201 K203 R204 H207 | C199-R201 VanDerWaalsContact C-N 3.3Å; C199-R201 PolarHBondContact O-N 3.11Å; C199-K203 WeakPolarHBondContact O-CA 3.36Å; C199-K203 PolarHBondContact O-N 2.88Å; C199-R204 WeakPolarHBondContact CB-O 3.42Å; C199-R204 PolarHBondContact N-O 2.63Å; C199-H207 VanDerWaalsContact CB-NE2 3.3Å; C199-H207 WeakPolarHBondContact CB-NE2 3.25Å; C199-H207 WeakPolarHBondContact CB-O 3.3Å; C199-H207 PolarHBondContact SG-NE2 3.14Å; C199-H207 VanDerWaalsContact SG-NE2 3.35Å | ||
| 200 | W | 78.9 | Confident | 70.5 | Confident | 198 Ų | 198 | 77.1 Ų | 77.1 | 75% | 0.75 | 39% | 0.385 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -67.2 | -32.2 | -179.7 | -171.5 | -108.5 | 0 | 0 | 0 | 112.6 | Q198 K203 T209 | Q198-W200 PolarHBondContact O-N 3.49Å; W200-K203 VanDerWaalsContact O-CE 3.23Å; W200-K203 WeakPolarHBondContact O-CE 3.46Å; W200-K203 PolarHBondContact O-NZ 2.95Å; W200-T209 PolarHBondContact N-OG1 3.26Å; W200-T209 VanDerWaalsContact N-OG1 3.14Å |
| 201 | R | 73 | Confident | 71.8 | Confident | 86 Ų | 86 | 72.2 Ų | 72.2 | 33% | 0.325 | 36% | 0.36 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -72.7 | -48.4 | -178.8 | -85.2 | -178.1 | 173.3 | -175.2 | -5.2 | 113.3 | C199 T209 F216 E225 | C199-R201 VanDerWaalsContact C-N 3.3Å; C199-R201 PolarHBondContact O-N 3.11Å; R201-T209 HydrophobicContact CB-CG2 4.3Å; R201-T209 HydrophobicContact CG-CG2 3.65Å; R201-F216 HydrophobicContact CB-CD2 4.19Å; R201-F216 WeakPolarHBondContact O-CE2 3.32Å; R201-E225 IonicContact CZ-OE2 2.63Å; R201-E225 IonicContact NH1-OE2 3.77Å; R201-E225 PolarHBondContact NH1-OE2 3.45Å; R201-E225 IonicContact NH2-OE2 3.42Å; R201-E225 PolarHBondContact NH2-OE2 2.86Å |
| 202 | C | 76.7 | Confident | 72.5 | Confident | 20 Ų | 20 | 76.1 Ų | 76.1 | 14% | 0.135 | 36% | 0.357 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -110.8 | -0.1 | -175.5 | 73.8 | 0 | 0 | 0 | 0 | 115 | R204 H207 P215 F216 | C202-R204 PolarHBondContact O-N 3.32Å; C202-H207 PolarHBondContact SG-CE1 2.72Å; C202-H207 PolarHBondContact SG-NE2 3.45Å; C202-P215 HydrophobicContact CB-CG 4.03Å; C202-F216 HydrophobicContact CB-CD2 3.51Å; C202-F216 HydrophobicContact CB-CE2 3.57Å |
| 203 | K | 78.7 | Confident | 73.2 | Confident | 91 Ų | 91 | 76.7 Ų | 76.7 | 40% | 0.396 | 36% | 0.362 | S | S | . | . | trans | 56.4 | 13.5 | 179.2 | -53 | -60.4 | -174.9 | 175.3 | 0 | 114.8 | Q198 C199 W200 | Q198-K203 WeakPolarHBondContact CG-O 3.23Å; Q198-K203 PolarHBondContact NE2-O 3.32Å; C199-K203 WeakPolarHBondContact O-CA 3.36Å; C199-K203 PolarHBondContact O-N 2.88Å; W200-K203 VanDerWaalsContact O-CE 3.23Å; W200-K203 WeakPolarHBondContact O-CE 3.46Å; W200-K203 PolarHBondContact O-NZ 2.95Å | ||
| 204 | R | 75.4 | Confident | 73.9 | Confident | 88 Ų | 88 | 71.2 Ų | 71.2 | 33% | 0.332 | 34% | 0.336 | S | S | . | . | trans | -89.3 | 143.8 | 173.9 | -65.3 | -166.2 | -97.5 | 137.5 | 101.1 | 110.3 | C199 C202 P215 | C199-R204 WeakPolarHBondContact CB-O 3.42Å; C199-R204 PolarHBondContact N-O 2.63Å; C202-R204 PolarHBondContact O-N 3.32Å; R204-P215 VanDerWaalsContact CZ-CD 3.45Å; R204-P215 VanDerWaalsContact CZ-CG 3.4Å | ||
| 205 | Y | 75.8 | Confident | 74.6 | Confident | 56 Ų | 56 | 71.6 Ų | 71.6 | 22% | 0.22 | 34% | 0.339 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -78.9 | 164 | 172 | -69.5 | -91.4 | 0 | 0 | 0 | 110.6 | I165 N171 Q198 | I165-Y205 HydrophobicContact CG1-CG 4.45Å; I165-Y205 HydrophobicContact CG2-CD2 4.13Å; N171-Y205 PolarHBondContact OD1-N 3.45Å; Q198-Y205 HydrophobicContact CB-CD1 4.02Å; Q198-Y205 HydrophobicContact CB-CE1 3.68Å; Q198-Y205 HydrophobicContact CB-CE2 4.39Å; Q198-Y205 HydrophobicContact CG-CD2 4.35Å; Q198-Y205 HydrophobicContact CG-CE1 4.26Å; Q198-Y205 HydrophobicContact CG-CE2 4.06Å |
| 206 | G | 77.1 | Confident | 74.7 | Confident | 18 Ų | 18 | 73.7 Ų | 73.7 | 19% | 0.186 | 35% | 0.349 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | 102.4 | -15.6 | 176 | 0 | 0 | 0 | 0 | 0 | 115.6 | K195 M197 | K195-G206 PolarHBondContact N-O 3.45Å; K195-G206 CarbonylContact O-C 3.55Å; K195-G206 WeakPolarHBondContact O-CA 3.14Å; K195-G206 PolarHBondContact O-N 3.39Å; M197-G206 PolarHBondContact O-N 3.37Å |
| 207 | H | 77.1 | Confident | 74.9 | Confident | 7 Ų | 7 | 74.1 Ų | 74.1 | 3% | 0.032 | 34% | 0.344 | C | S | . | . | S | Bend | trans | -152.5 | 162.6 | -177.2 | 70.2 | -80.7 | 0 | 0 | 0 | 113.1 | C199 C202 D211 E213 C214 | C199-H207 VanDerWaalsContact CB-NE2 3.3Å; C199-H207 WeakPolarHBondContact CB-NE2 3.25Å; C199-H207 WeakPolarHBondContact CB-O 3.3Å; C199-H207 PolarHBondContact SG-NE2 3.14Å; C199-H207 VanDerWaalsContact SG-NE2 3.35Å; C202-H207 PolarHBondContact SG-CE1 2.72Å; C202-H207 PolarHBondContact SG-NE2 3.45Å; H207-D211 HydrophobicContact CB-CB 3.93Å; H207-E213 HydrophobicContact CB-CB 4.15Å; H207-C214 WeakPolarHBondContact NE2-CA 3.21Å; H207-C214 WeakPolarHBondContact NE2-CB 3.34Å |
| 208 | R | 76.2 | Confident | 74.9 | Confident | 131 Ų | 131 | 77 Ų | 77 | 49% | 0.494 | 36% | 0.359 | S | S | . | . | trans | -92.7 | 159.1 | 177.2 | -66.5 | -172.8 | -178.3 | -150 | -3.8 | 112.3 | K195 M197 G210 D211 | K195-R208 HydrophobicContact CD-CG 4.21Å; M197-R208 HydrophobicContact CE-CG 3.47Å; M197-R208 VanDerWaalsContact CE-CG 3.47Å; R208-G210 PolarHBondContact O-N 2.86Å; R208-D211 PolarHBondContact N-OD2 2.67Å; R208-D211 PolarHBondContact O-N 3.03Å | ||
| 209 | T | 73.4 | Confident | 74.5 | Confident | 69 Ų | 69 | 81.9 Ų | 81.9 | 42% | 0.423 | 38% | 0.379 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -61.1 | 101.9 | 168.3 | -52.7 | 0 | 0 | 0 | 0 | 109.6 | W200 R201 | W200-T209 PolarHBondContact N-OG1 3.26Å; W200-T209 VanDerWaalsContact N-OG1 3.14Å; R201-T209 HydrophobicContact CB-CG2 4.3Å; R201-T209 HydrophobicContact CG-CG2 3.65Å |
| 210 | G | 69.3 | Low | 73.7 | Confident | 36 Ų | 36 | 82.9 Ų | 82.9 | 37% | 0.371 | 39% | 0.39 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 119.9 | -9 | -176.6 | 0 | 0 | 0 | 0 | 0 | 114.7 | R208 F217 | R208-G210 PolarHBondContact O-N 2.86Å; G210-F217 WeakPolarHBondContact O-CE2 3.36Å |
| 211 | D | 76.8 | Confident | 73.3 | Confident | 46 Ų | 46 | 77.8 Ų | 77.8 | 25% | 0.246 | 38% | 0.377 | C | S | . | . | trans | -69.3 | 146.9 | 172 | -71.5 | -12.8 | 0 | 0 | 0 | 110.3 | K195 H207 R208 E213 C214 F217 | K195-D211 IonicContact NZ-OD2 3.24Å; K195-D211 PolarHBondContact NZ-OD2 3.11Å; H207-D211 HydrophobicContact CB-CB 3.93Å; R208-D211 PolarHBondContact N-OD2 2.67Å; R208-D211 PolarHBondContact O-N 3.03Å; D211-E213 PolarHBondContact O-N 2.76Å; D211-E213 VanDerWaalsContact O-N 3.16Å; D211-C214 VanDerWaalsContact O-CB 3.23Å; D211-C214 WeakPolarHBondContact O-CB 3.45Å; D211-C214 PolarHBondContact O-N 3.16Å; D211-F217 WeakPolarHBondContact O-CB 3.15Å | ||
| 212 | K | 70.7 | Confident | 73.3 | Confident | 151 Ų | 151 | 80.4 Ų | 80.4 | 66% | 0.657 | 39% | 0.393 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -59.8 | -26.3 | 179.1 | -65.6 | 172.5 | -176.1 | -78 | 0 | 112.8 | C214 F217 I218 | K212-C214 PolarHBondContact O-N 3.42Å; K212-F217 HydrophobicContact CB-CD1 4.39Å; K212-F217 HydrophobicContact CB-CE1 4.39Å; K212-F217 HydrophobicContact CG-CD1 4.33Å; K212-F217 HydrophobicContact CG-CE1 3.85Å; K212-F217 HydrophobicContact CG-CZ 4.47Å; K212-I218 WeakPolarHBondContact O-CD1 3.05Å |
| 213 | E | 72.4 | Confident | 73.2 | Confident | 149 Ų | 149 | 86.4 Ų | 86.4 | 70% | 0.696 | 42% | 0.417 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -71 | -13.4 | 176.7 | -55.5 | -53.3 | 135.2 | 0 | 0 | 113.2 | H207 D211 P215 | H207-E213 HydrophobicContact CB-CB 4.15Å; D211-E213 PolarHBondContact O-N 2.76Å; D211-E213 VanDerWaalsContact O-N 3.16Å; E213-P215 WeakPolarHBondContact O-CD 3.33Å |
| 214 | C | 77.6 | Confident | 72.9 | Confident | 1 Ų | 1 | 87.4 Ų | 87.4 | 1% | 0.007 | 43% | 0.426 | C | S | . | . | trans | -71.7 | 122.9 | 175.4 | -174.4 | 0 | 0 | 0 | 0 | 109.8 | H207 D211 K212 F216 F217 | H207-C214 WeakPolarHBondContact NE2-CA 3.21Å; H207-C214 WeakPolarHBondContact NE2-CB 3.34Å; D211-C214 VanDerWaalsContact O-CB 3.23Å; D211-C214 WeakPolarHBondContact O-CB 3.45Å; D211-C214 PolarHBondContact O-N 3.16Å; K212-C214 PolarHBondContact O-N 3.42Å; C214-F216 PolarHBondContact O-N 3.22Å; C214-F216 VanDerWaalsContact O-N 3.15Å; C214-F217 HydrophobicContact CB-CB 3.93Å; C214-F217 WeakPolarHBondContact O-CA 3.41Å; C214-F217 WeakPolarHBondContact O-CB 3.18Å; C214-F217 PolarHBondContact O-N 3.12Å | ||
| 215 | P | 77.1 | Confident | 72.9 | Confident | 42 Ų | 42 | 85.9 Ų | 85.9 | 27% | 0.273 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -62.6 | -27.2 | 179.3 | 22.4 | -34.1 | 0 | 0 | 0 | 111.2 | C202 R204 E213 F217 K219 | C202-P215 HydrophobicContact CB-CG 4.03Å; R204-P215 VanDerWaalsContact CZ-CD 3.45Å; R204-P215 VanDerWaalsContact CZ-CG 3.4Å; E213-P215 WeakPolarHBondContact O-CD 3.33Å; P215-F217 VanDerWaalsContact C-N 3.27Å; P215-F217 PolarHBondContact O-N 3.34Å; P215-K219 WeakPolarHBondContact O-CA 3.11Å; P215-K219 WeakPolarHBondContact O-CB 3Å; P215-K219 PolarHBondContact O-N 3.34Å |
| 216 | F | 68.8 | Low | 73 | Confident | 107 Ų | 107 | 87.7 Ų | 87.7 | 47% | 0.469 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -80 | -3.7 | 172.7 | -62.9 | -60 | 0 | 0 | 0 | 114.2 | R201 C202 C214 G220 | R201-F216 HydrophobicContact CB-CD2 4.19Å; R201-F216 WeakPolarHBondContact O-CE2 3.32Å; C202-F216 HydrophobicContact CB-CD2 3.51Å; C202-F216 HydrophobicContact CB-CE2 3.57Å; C214-F216 PolarHBondContact O-N 3.22Å; C214-F216 VanDerWaalsContact O-N 3.15Å; F216-G220 VanDerWaalsContact O-CA 3.25Å; F216-G220 WeakPolarHBondContact O-CA 3.14Å; F216-G220 PolarHBondContact O-N 3.06Å |
| 217 | F | 71.4 | Confident | 72.9 | Confident | 91 Ų | 91 | 92.8 Ų | 92.8 | 40% | 0.399 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -83.6 | -43.6 | 170.9 | -174.8 | -94.1 | 0 | 0 | 0 | 111.4 | G210 D211 K212 C214 P215 | G210-F217 WeakPolarHBondContact O-CE2 3.36Å; D211-F217 WeakPolarHBondContact O-CB 3.15Å; K212-F217 HydrophobicContact CB-CD1 4.39Å; K212-F217 HydrophobicContact CB-CE1 4.39Å; K212-F217 HydrophobicContact CG-CD1 4.33Å; K212-F217 HydrophobicContact CG-CE1 3.85Å; K212-F217 HydrophobicContact CG-CZ 4.47Å; C214-F217 HydrophobicContact CB-CB 3.93Å; C214-F217 WeakPolarHBondContact O-CA 3.41Å; C214-F217 WeakPolarHBondContact O-CB 3.18Å; C214-F217 PolarHBondContact O-N 3.12Å; P215-F217 VanDerWaalsContact C-N 3.27Å; P215-F217 PolarHBondContact O-N 3.34Å |
| 218 | I | 66.6 | Low | 73 | Confident | 140 Ų | 140 | 97.9 Ų | 97.9 | 72% | 0.718 | 47% | 0.469 | S | S | * | . | H | α-helix | trans | -89.5 | -41.8 | -179.9 | -55 | 178.8 | 0 | 0 | 0 | 111.6 | K212 | K212-I218 WeakPolarHBondContact O-CD1 3.05Å |
| 219 | K | 68.6 | Low | 73.4 | Confident | 192 Ų | 192 | 94.4 Ų | 94.4 | 84% | 0.835 | 46% | 0.462 | S | S | * | . | S | Bend | trans | -103.5 | -5.6 | -173.9 | -157.5 | 169.4 | -177.7 | 176.7 | 0 | 113.2 | P215 | P215-K219 WeakPolarHBondContact O-CA 3.11Å; P215-K219 WeakPolarHBondContact O-CB 3Å; P215-K219 PolarHBondContact O-N 3.34Å |
| 220 | G | 66.5 | Low | 73.8 | Confident | 21 Ų | 21 | 92.5 Ų | 92.5 | 22% | 0.216 | 45% | 0.453 | C | S | . | . | S | Bend | trans | -81.8 | 159.3 | -179 | 0 | 0 | 0 | 0 | 0 | 113.7 | F216 Q222 | F216-G220 VanDerWaalsContact O-CA 3.25Å; F216-G220 WeakPolarHBondContact O-CA 3.14Å; F216-G220 PolarHBondContact O-N 3.06Å; G220-Q222 PolarHBondContact O-N 3.31Å |
| 221 | N | 69.9 | Low | 74.3 | Confident | 92 Ų | 92 | 98.4 Ų | 98.4 | 49% | 0.492 | 47% | 0.471 | S | S | . | . | trans | -52.3 | 93.2 | -172.2 | -172.9 | -6.9 | 0 | 0 | 0 | 112.7 | K223 L224 E225 | N221-K223 PolarHBondContact O-N 3.33Å; N221-K223 VanDerWaalsContact O-N 3.07Å; N221-K223 WeakPolarHBondContact OD1-CB 3.35Å; N221-K223 PolarHBondContact OD1-N 3.16Å; N221-L224 HydrophobicContact CB-CB 4.18Å; N221-L224 HydrophobicContact CB-CD1 4.07Å; N221-L224 HydrophobicContact CB-CG 4.34Å; N221-L224 VanDerWaalsContact ND2-CD1 3.28Å; N221-L224 WeakPolarHBondContact ND2-CD1 3.46Å; N221-L224 WeakPolarHBondContact ND2-CG 3.45Å; N221-L224 PolarHBondContact O-N 3.45Å; N221-L224 PolarHBondContact OD1-N 3.36Å; N221-E225 PolarHBondContact O-N 2.96Å; N221-E225 VanDerWaalsContact O-N 3.11Å | ||
| 222 | Q | 73 | Confident | 74.4 | Confident | 141 Ų | 141 | 101.3 Ų | 101.3 | 66% | 0.659 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -56.8 | -27.8 | -178.8 | -161.1 | 179.1 | 25 | 0 | 0 | 112.1 | G220 E225 Q226 | G220-Q222 PolarHBondContact O-N 3.31Å; Q222-E225 PolarHBondContact O-N 3.03Å; Q222-Q226 VanDerWaalsContact O-CB 3.3Å; Q222-Q226 WeakPolarHBondContact O-CB 3.48Å; Q222-Q226 WeakPolarHBondContact O-CG 3.38Å; Q222-Q226 PolarHBondContact O-N 3.31Å |
| 223 | K | 74.7 | Confident | 75.1 | Confident | 146 Ų | 146 | 96.9 Ų | 96.9 | 64% | 0.635 | 47% | 0.467 | S | S | * | . | H | α-helix | trans | -65.9 | -48 | 174.7 | -60.5 | -180 | 178.6 | 177.8 | 0 | 110.7 | N221 E225 Q226 F227 | N221-K223 PolarHBondContact O-N 3.33Å; N221-K223 VanDerWaalsContact O-N 3.07Å; N221-K223 WeakPolarHBondContact OD1-CB 3.35Å; N221-K223 PolarHBondContact OD1-N 3.16Å; K223-E225 VanDerWaalsContact C-N 3.29Å; K223-E225 PolarHBondContact O-N 3.22Å; K223-Q226 PolarHBondContact O-N 3.48Å; K223-F227 HydrophobicContact CB-CD2 4.46Å; K223-F227 HydrophobicContact CB-CE2 4.33Å; K223-F227 WeakPolarHBondContact O-CD2 3.18Å; K223-F227 PolarHBondContact O-N 2.74Å |
| 224 | L | 72.1 | Confident | 75.6 | Confident | 111 Ų | 111 | 95.6 Ų | 95.6 | 58% | 0.581 | 47% | 0.471 | S | S | * | . | H | α-helix | trans | -62.9 | -37.3 | 176.9 | -80 | 172.1 | 0 | 0 | 0 | 112.1 | N221 F227 R228 | N221-L224 HydrophobicContact CB-CB 4.18Å; N221-L224 HydrophobicContact CB-CD1 4.07Å; N221-L224 HydrophobicContact CB-CG 4.34Å; N221-L224 VanDerWaalsContact ND2-CD1 3.28Å; N221-L224 WeakPolarHBondContact ND2-CD1 3.46Å; N221-L224 WeakPolarHBondContact ND2-CG 3.45Å; N221-L224 PolarHBondContact O-N 3.45Å; N221-L224 PolarHBondContact OD1-N 3.36Å; L224-F227 PolarHBondContact O-N 2.85Å; L224-R228 PolarHBondContact O-N 3.11Å |
| 225 | E | 75.6 | Confident | 76 | Confident | 57 Ų | 57 | 100 Ų | 100 | 27% | 0.266 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -68 | -40.9 | 175.5 | -162.9 | 62.2 | -135.4 | 0 | 0 | 111.4 | R201 N221 Q222 K223 F227 R228 V229 | R201-E225 IonicContact CZ-OE2 2.63Å; R201-E225 IonicContact NH1-OE2 3.77Å; R201-E225 PolarHBondContact NH1-OE2 3.45Å; R201-E225 IonicContact NH2-OE2 3.42Å; R201-E225 PolarHBondContact NH2-OE2 2.86Å; N221-E225 PolarHBondContact O-N 2.96Å; N221-E225 VanDerWaalsContact O-N 3.11Å; Q222-E225 PolarHBondContact O-N 3.03Å; K223-E225 VanDerWaalsContact C-N 3.29Å; K223-E225 PolarHBondContact O-N 3.22Å; E225-F227 VanDerWaalsContact C-N 3.34Å; E225-F227 PolarHBondContact O-N 2.85Å; E225-R228 PolarHBondContact O-N 2.86Å; E225-R228 IonicContact OE1-NE 3.35Å; E225-V229 WeakPolarHBondContact O-CB 3.35Å; E225-V229 VanDerWaalsContact O-CG2 3.25Å; E225-V229 WeakPolarHBondContact O-CG2 2.97Å; E225-V229 PolarHBondContact O-N 3.17Å |
| 226 | Q | 77.2 | Confident | 76.4 | Confident | 93 Ų | 93 | 100.9 Ų | 100.9 | 44% | 0.435 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -63.3 | -38.7 | 173.4 | -75.2 | 168.8 | 12.9 | 0 | 0 | 112.2 | Q222 K223 A230 | Q222-Q226 VanDerWaalsContact O-CB 3.3Å; Q222-Q226 WeakPolarHBondContact O-CB 3.48Å; Q222-Q226 WeakPolarHBondContact O-CG 3.38Å; Q222-Q226 PolarHBondContact O-N 3.31Å; K223-Q226 PolarHBondContact O-N 3.48Å; Q226-A230 WeakPolarHBondContact O-CB 3.39Å; Q226-A230 PolarHBondContact O-N 3.17Å |
| 227 | F | 76.7 | Confident | 77.2 | Confident | 126 Ų | 126 | 100 Ų | 100 | 55% | 0.553 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -64 | -46.3 | 173.9 | -79.8 | -68 | 0 | 0 | 0 | 111.2 | K223 L224 E225 A230 H231 | K223-F227 HydrophobicContact CB-CD2 4.46Å; K223-F227 HydrophobicContact CB-CE2 4.33Å; K223-F227 WeakPolarHBondContact O-CD2 3.18Å; K223-F227 PolarHBondContact O-N 2.74Å; L224-F227 PolarHBondContact O-N 2.85Å; E225-F227 VanDerWaalsContact C-N 3.34Å; E225-F227 PolarHBondContact O-N 2.85Å; F227-A230 PolarHBondContact O-N 3.31Å; F227-H231 WeakPolarHBondContact O-CB 3.38Å; F227-H231 PolarHBondContact O-CD2 3.33Å; F227-H231 VanDerWaalsContact O-CD2 3.23Å; F227-H231 PolarHBondContact O-N 3.31Å |
| 228 | R | 79.4 | Confident | 78 | Confident | 114 Ų | 114 | 99.9 Ų | 99.9 | 43% | 0.43 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -57.2 | -53.5 | 174.4 | -108.3 | -172.3 | 53.6 | 93.5 | 9.6 | 111.4 | L224 E225 A230 H231 E232 | L224-R228 PolarHBondContact O-N 3.11Å; E225-R228 PolarHBondContact O-N 2.86Å; E225-R228 IonicContact OE1-NE 3.35Å; R228-A230 VanDerWaalsContact C-N 3.27Å; R228-A230 PolarHBondContact O-N 3.14Å; R228-H231 PolarHBondContact O-N 2.8Å; R228-E232 WeakPolarHBondContact CG-OE1 3.25Å; R228-E232 IonicContact CZ-OE1 3.45Å; R228-E232 IonicContact CZ-OE2 2.67Å; R228-E232 IonicContact NE-OE1 2.85Å; R228-E232 IonicContact NE-OE2 3.2Å; R228-E232 IonicContact NH1-OE1 2.77Å; R228-E232 PolarHBondContact NH1-OE1 3.21Å; R228-E232 IonicContact NH1-OE2 2.71Å; R228-E232 PolarHBondContact NH1-OE2 3.49Å; R228-E232 IonicContact NH2-OE1 3.21Å; R228-E232 IonicContact NH2-OE2 3.97Å; R228-E232 PolarHBondContact NH2-OE2 2.87Å; R228-E232 WeakPolarHBondContact O-CB 3.44Å; R228-E232 WeakPolarHBondContact O-CG 3.3Å; R228-E232 PolarHBondContact O-N 3.2Å |
| 229 | V | 83.6 | Confident | 79 | Confident | 57 Ų | 57 | 97.5 Ų | 97.5 | 35% | 0.345 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -60.5 | -39.4 | -179.2 | 174.7 | 0 | 0 | 0 | 0 | 110.7 | E225 H231 D233 Y236 | E225-V229 WeakPolarHBondContact O-CB 3.35Å; E225-V229 VanDerWaalsContact O-CG2 3.25Å; E225-V229 WeakPolarHBondContact O-CG2 2.97Å; E225-V229 PolarHBondContact O-N 3.17Å; V229-H231 PolarHBondContact O-N 2.87Å; V229-D233 VanDerWaalsContact O-CB 3.23Å; V229-D233 WeakPolarHBondContact O-CB 3.49Å; V229-D233 PolarHBondContact O-N 3.25Å; V229-D233 VanDerWaalsContact O-N 3.11Å; V229-Y236 HydrophobicContact CG1-CD2 3.57Å; V229-Y236 HydrophobicContact CG1-CE2 3.68Å; V229-Y236 HydrophobicContact CG1-CG 4.49Å |
| 230 | A | 81.9 | Confident | 80 | Confident | 29 Ų | 29 | 93 Ų | 93 | 24% | 0.24 | 46% | 0.459 | C | S | . | . | H | α-helix | trans | -68.8 | -32.8 | 178.9 | 0 | 0 | 0 | 0 | 0 | 114.4 | Q226 F227 R228 Y236 | Q226-A230 WeakPolarHBondContact O-CB 3.39Å; Q226-A230 PolarHBondContact O-N 3.17Å; F227-A230 PolarHBondContact O-N 3.31Å; R228-A230 VanDerWaalsContact C-N 3.27Å; R228-A230 PolarHBondContact O-N 3.14Å; A230-Y236 HydrophobicContact CB-CD1 3.54Å; A230-Y236 HydrophobicContact CB-CE1 3.43Å; A230-Y236 VanDerWaalsContact CB-CE1 3.43Å; A230-Y236 HydrophobicContact CB-CG 4.34Å |
| 231 | H | 80.2 | Confident | 81.1 | Confident | 161 Ų | 161 | 95.8 Ų | 95.8 | 75% | 0.745 | 47% | 0.469 | S | S | * | . | H | α-helix | trans | -94 | -26.3 | -177.9 | -78.6 | -80.6 | 0 | 0 | 0 | 113.6 | F227 R228 V229 | F227-H231 WeakPolarHBondContact O-CB 3.38Å; F227-H231 PolarHBondContact O-CD2 3.33Å; F227-H231 VanDerWaalsContact O-CD2 3.23Å; F227-H231 PolarHBondContact O-N 3.31Å; R228-H231 PolarHBondContact O-N 2.8Å; V229-H231 PolarHBondContact O-N 2.87Å |
| 232 | E | 79.4 | Confident | 82.2 | Confident | 107 Ų | 107 | 95.8 Ų | 95.8 | 50% | 0.5 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -97.9 | -23 | -176.8 | -64.4 | -178.6 | -172.2 | 0 | 0 | 113.8 | R228 P234 | R228-E232 WeakPolarHBondContact CG-OE1 3.25Å; R228-E232 IonicContact CZ-OE1 3.45Å; R228-E232 IonicContact CZ-OE2 2.67Å; R228-E232 IonicContact NE-OE1 2.85Å; R228-E232 IonicContact NE-OE2 3.2Å; R228-E232 IonicContact NH1-OE1 2.77Å; R228-E232 PolarHBondContact NH1-OE1 3.21Å; R228-E232 IonicContact NH1-OE2 2.71Å; R228-E232 PolarHBondContact NH1-OE2 3.49Å; R228-E232 IonicContact NH2-OE1 3.21Å; R228-E232 IonicContact NH2-OE2 3.97Å; R228-E232 PolarHBondContact NH2-OE2 2.87Å; R228-E232 WeakPolarHBondContact O-CB 3.44Å; R228-E232 WeakPolarHBondContact O-CG 3.3Å; R228-E232 PolarHBondContact O-N 3.2Å; E232-P234 WeakPolarHBondContact O-CD 3.45Å |
| 233 | D | 83.8 | Confident | 83.2 | Confident | 57 Ų | 57 | 95.6 Ų | 95.6 | 31% | 0.305 | 47% | 0.466 | S | S | . | . | trans | -95.9 | 108.1 | 176 | -179.4 | 6.5 | 0 | 0 | 0 | 110.6 | V229 M235 Y236 | V229-D233 VanDerWaalsContact O-CB 3.23Å; V229-D233 WeakPolarHBondContact O-CB 3.49Å; V229-D233 PolarHBondContact O-N 3.25Å; V229-D233 VanDerWaalsContact O-N 3.11Å; D233-M235 PolarHBondContact O-N 3.36Å; D233-M235 VanDerWaalsContact O-N 3.11Å; D233-M235 WeakPolarHBondContact OD1-CA 3.45Å; D233-M235 VanDerWaalsContact OD1-CB 3.32Å; D233-M235 WeakPolarHBondContact OD1-CB 3.38Å; D233-M235 PolarHBondContact OD1-N 3.07Å; D233-Y236 VanDerWaalsContact O-CB 3.27Å; D233-Y236 WeakPolarHBondContact O-CB 3.13Å; D233-Y236 PolarHBondContact O-N 3.21Å | ||
| 234 | P | 82.6 | Confident | 84 | Confident | 122 Ų | 122 | 94.4 Ų | 94.4 | 79% | 0.792 | 46% | 0.458 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -62.7 | -18.5 | 177.3 | -18.3 | 31.9 | 0 | 0 | 0 | 113.4 | E232 | E232-P234 WeakPolarHBondContact O-CD 3.45Š|
| 235 | M | 87.1 | Confident | 84.9 | Confident | 94 Ų | 94 | 94.9 Ų | 94.9 | 46% | 0.463 | 46% | 0.457 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -90.3 | -6.2 | 178.4 | -69.5 | -116.3 | 57.6 | 0 | 0 | 113 | D233 D237 I238 I239 | D233-M235 PolarHBondContact O-N 3.36Å; D233-M235 VanDerWaalsContact O-N 3.11Å; D233-M235 WeakPolarHBondContact OD1-CA 3.45Å; D233-M235 VanDerWaalsContact OD1-CB 3.32Å; D233-M235 WeakPolarHBondContact OD1-CB 3.38Å; D233-M235 PolarHBondContact OD1-N 3.07Å; M235-D237 VanDerWaalsContact C-N 3.32Å; M235-D237 PolarHBondContact O-N 3.46Å; M235-I238 HydrophobicContact CE-CB 3.67Å; M235-I238 HydrophobicContact CE-CD1 3.4Å; M235-I238 VanDerWaalsContact CE-CD1 3.4Å; M235-I238 HydrophobicContact CE-CG1 4.11Å; M235-I238 HydrophobicContact CE-CG2 3.64Å; M235-I238 PolarHBondContact O-N 2.81Å; M235-I238 VanDerWaalsContact O-N 3.11Å; M235-I239 HydrophobicContact CB-CD1 3.98Å; M235-I239 HydrophobicContact CB-CG1 4.45Å; M235-I239 WeakPolarHBondContact O-CG1 3.4Å; M235-I239 PolarHBondContact O-N 2.8Å |
| 236 | Y | 86 | Confident | 85.8 | Confident | 61 Ų | 61 | 98.7 Ų | 98.7 | 24% | 0.239 | 48% | 0.475 | C | S | . | . | H | α-helix | trans | -58.2 | -42.8 | -171.4 | -174.2 | -109.7 | 0 | 0 | 0 | 112.9 | V229 A230 D233 I238 I239 R240 | V229-Y236 HydrophobicContact CG1-CD2 3.57Å; V229-Y236 HydrophobicContact CG1-CE2 3.68Å; V229-Y236 HydrophobicContact CG1-CG 4.49Å; A230-Y236 HydrophobicContact CB-CD1 3.54Å; A230-Y236 HydrophobicContact CB-CE1 3.43Å; A230-Y236 VanDerWaalsContact CB-CE1 3.43Å; A230-Y236 HydrophobicContact CB-CG 4.34Å; D233-Y236 VanDerWaalsContact O-CB 3.27Å; D233-Y236 WeakPolarHBondContact O-CB 3.13Å; D233-Y236 PolarHBondContact O-N 3.21Å; Y236-I238 PolarHBondContact O-N 3.15Å; Y236-I239 PolarHBondContact O-N 2.95Å; Y236-R240 VanDerWaalsContact O-CB 3.26Å; Y236-R240 WeakPolarHBondContact O-CB 3.28Å; Y236-R240 PolarHBondContact O-N 2.92Å |
| 237 | D | 85.4 | Confident | 86.7 | Confident | 89 Ų | 89 | 100.5 Ų | 100.5 | 48% | 0.476 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -66 | -39.8 | 179.4 | -70.4 | -24.6 | 0 | 0 | 0 | 112.2 | M235 R240 D241 | M235-D237 VanDerWaalsContact C-N 3.32Å; M235-D237 PolarHBondContact O-N 3.46Å; D237-R240 WeakPolarHBondContact O-CB 3.39Å; D237-R240 PolarHBondContact O-N 2.95Å; D237-R240 IonicContact OD1-CZ 3.32Å; D237-R240 IonicContact OD1-NE 3.38Å; D237-R240 IonicContact OD1-NH2 2.71Å; D237-R240 PolarHBondContact OD1-NH2 2.86Å; D237-D241 WeakPolarHBondContact O-CB 3.23Å; D237-D241 VanDerWaalsContact O-CG 3.28Å; D237-D241 PolarHBondContact O-N 3.2Å |
| 238 | I | 87.5 | Confident | 87.5 | Confident | 87 Ų | 87 | 98.5 Ų | 98.5 | 45% | 0.446 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -66.7 | -41.4 | 177.8 | -66.5 | 163 | 0 | 0 | 0 | 110.8 | M235 Y236 D241 N242 | M235-I238 HydrophobicContact CE-CB 3.67Å; M235-I238 HydrophobicContact CE-CD1 3.4Å; M235-I238 VanDerWaalsContact CE-CD1 3.4Å; M235-I238 HydrophobicContact CE-CG1 4.11Å; M235-I238 HydrophobicContact CE-CG2 3.64Å; M235-I238 PolarHBondContact O-N 2.81Å; M235-I238 VanDerWaalsContact O-N 3.11Å; Y236-I238 PolarHBondContact O-N 3.15Å; I238-D241 PolarHBondContact O-N 3.35Å; I238-N242 WeakPolarHBondContact O-CB 3.2Å; I238-N242 VanDerWaalsContact O-CG 3.3Å; I238-N242 PolarHBondContact O-N 2.82Å; I238-N242 PolarHBondContact O-ND2 3.14Å |
| 239 | I | 87.4 | Confident | 88.3 | Confident | 90 Ų | 90 | 95.4 Ų | 95.4 | 46% | 0.462 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -66.8 | -41.5 | 177 | -64.8 | 165.6 | 0 | 0 | 0 | 110.3 | M235 Y236 N242 K243 | M235-I239 HydrophobicContact CB-CD1 3.98Å; M235-I239 HydrophobicContact CB-CG1 4.45Å; M235-I239 WeakPolarHBondContact O-CG1 3.4Å; M235-I239 PolarHBondContact O-N 2.8Å; Y236-I239 PolarHBondContact O-N 2.95Å; I239-N242 PolarHBondContact O-N 3.4Å; I239-K243 WeakPolarHBondContact O-CB 2.94Å; I239-K243 PolarHBondContact O-N 2.71Å |
| 240 | R | 90.1 | Very high | 88.8 | Confident | 97 Ų | 97 | 101.1 Ų | 101.1 | 37% | 0.366 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -61.7 | -43.9 | 176.6 | -164.1 | -164 | -46.6 | -173.1 | 15.5 | 111.3 | Y236 D237 K243 R244 | Y236-R240 VanDerWaalsContact O-CB 3.26Å; Y236-R240 WeakPolarHBondContact O-CB 3.28Å; Y236-R240 PolarHBondContact O-N 2.92Å; D237-R240 WeakPolarHBondContact O-CB 3.39Å; D237-R240 PolarHBondContact O-N 2.95Å; D237-R240 IonicContact OD1-CZ 3.32Å; D237-R240 IonicContact OD1-NE 3.38Å; D237-R240 IonicContact OD1-NH2 2.71Å; D237-R240 PolarHBondContact OD1-NH2 2.86Å; R240-K243 PolarHBondContact O-N 2.77Å; R240-R244 PolarHBondContact O-N 3.11Å |
| 241 | D | 90 | Very high | 89.4 | Confident | 80 Ų | 80 | 103.5 Ų | 103.5 | 43% | 0.428 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -66.1 | -44 | 177.8 | -76.9 | -20.2 | 0 | 0 | 0 | 112.5 | D237 I238 K243 R244 H245 | D237-D241 WeakPolarHBondContact O-CB 3.23Å; D237-D241 VanDerWaalsContact O-CG 3.28Å; D237-D241 PolarHBondContact O-N 3.2Å; I238-D241 PolarHBondContact O-N 3.35Å; D241-K243 VanDerWaalsContact C-N 3.28Å; D241-K243 PolarHBondContact O-N 3.4Å; D241-R244 WeakPolarHBondContact O-CB 3.43Å; D241-R244 PolarHBondContact O-N 2.95Å; D241-R244 VanDerWaalsContact O-N 3.17Å; D241-R244 IonicContact OD1-CZ 2.62Å; D241-R244 IonicContact OD1-NE 2.81Å; D241-R244 PolarHBondContact OD1-NE 2.84Å; D241-R244 IonicContact OD1-NH2 3.39Å; D241-R244 PolarHBondContact OD1-NH2 3.22Å; D241-H245 WeakPolarHBondContact O-CB 3.49Å; D241-H245 PolarHBondContact O-N 3.07Å |
| 242 | N | 92.4 | Very high | 90.1 | Very high | 93 Ų | 93 | 102 Ų | 102 | 50% | 0.497 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -59.1 | -41.9 | 174.6 | -76.8 | -32.3 | 0 | 0 | 0 | 111.6 | I238 I239 R244 H245 E246 | I238-N242 WeakPolarHBondContact O-CB 3.2Å; I238-N242 VanDerWaalsContact O-CG 3.3Å; I238-N242 PolarHBondContact O-N 2.82Å; I238-N242 PolarHBondContact O-ND2 3.14Å; I239-N242 PolarHBondContact O-N 3.4Å; N242-R244 VanDerWaalsContact C-N 3.33Å; N242-R244 PolarHBondContact O-N 3.41Å; N242-H245 PolarHBondContact O-N 3.45Å; N242-E246 WeakPolarHBondContact O-CB 3.3Å; N242-E246 WeakPolarHBondContact O-CG 3.22Å; N242-E246 PolarHBondContact O-N 3.22Å |
| 243 | K | 93.9 | Very high | 90.8 | Very high | 136 Ų | 136 | 102.7 Ų | 102.7 | 59% | 0.591 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -68.9 | -30.7 | 179.1 | -155 | 169.2 | -170.3 | 174 | 0 | 112.7 | I239 R240 D241 K247 | I239-K243 WeakPolarHBondContact O-CB 2.94Å; I239-K243 PolarHBondContact O-N 2.71Å; R240-K243 PolarHBondContact O-N 2.77Å; D241-K243 VanDerWaalsContact C-N 3.28Å; D241-K243 PolarHBondContact O-N 3.4Å; K243-K247 VanDerWaalsContact O-CG 3.32Å; K243-K247 WeakPolarHBondContact O-CG 3.23Å; K243-K247 PolarHBondContact O-N 3.47Å |
| 244 | R | 92.4 | Very high | 91.3 | Very high | 121 Ų | 121 | 104.3 Ų | 104.3 | 46% | 0.457 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -69 | -49.9 | 169.6 | -77.2 | -171.7 | -83 | -127.1 | 6.8 | 110.8 | R240 D241 N242 E246 K247 D248 | R240-R244 PolarHBondContact O-N 3.11Å; D241-R244 WeakPolarHBondContact O-CB 3.43Å; D241-R244 PolarHBondContact O-N 2.95Å; D241-R244 VanDerWaalsContact O-N 3.17Å; D241-R244 IonicContact OD1-CZ 2.62Å; D241-R244 IonicContact OD1-NE 2.81Å; D241-R244 PolarHBondContact OD1-NE 2.84Å; D241-R244 IonicContact OD1-NH2 3.39Å; D241-R244 PolarHBondContact OD1-NH2 3.22Å; N242-R244 VanDerWaalsContact C-N 3.33Å; N242-R244 PolarHBondContact O-N 3.41Å; R244-E246 VanDerWaalsContact C-N 3.31Å; R244-E246 PolarHBondContact O-N 2.68Å; R244-K247 WeakPolarHBondContact O-CA 3.14Å; R244-K247 WeakPolarHBondContact O-CB 3.35Å; R244-K247 PolarHBondContact O-N 2.86Å; R244-D248 PolarHBondContact O-N 2.98Å |
| 245 | H | 91.3 | Very high | 91.8 | Very high | 122 Ų | 122 | 104.2 Ų | 104.2 | 57% | 0.565 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -60.4 | -38.7 | -179.1 | -170.3 | -86.5 | 0 | 0 | 0 | 112.5 | D241 N242 K247 D248 V249 | D241-H245 WeakPolarHBondContact O-CB 3.49Å; D241-H245 PolarHBondContact O-N 3.07Å; N242-H245 PolarHBondContact O-N 3.45Å; H245-K247 PolarHBondContact O-N 2.64Å; H245-D248 PolarHBondContact O-N 3.4Å; H245-V249 WeakPolarHBondContact O-CB 3.38Å; H245-V249 VanDerWaalsContact O-CG2 3.25Å; H245-V249 WeakPolarHBondContact O-CG2 3.41Å; H245-V249 PolarHBondContact O-N 2.66Å |
| 246 | E | 94.4 | Very high | 91.9 | Very high | 137 Ų | 137 | 104.5 Ų | 104.5 | 64% | 0.64 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -61.3 | -41.3 | 172.6 | -79 | -180 | 174.5 | 0 | 0 | 112.7 | N242 R244 R250 | N242-E246 WeakPolarHBondContact O-CB 3.3Å; N242-E246 WeakPolarHBondContact O-CG 3.22Å; N242-E246 PolarHBondContact O-N 3.22Å; R244-E246 VanDerWaalsContact C-N 3.31Å; R244-E246 PolarHBondContact O-N 2.68Å; E246-R250 WeakPolarHBondContact O-CB 3.47Å; E246-R250 PolarHBondContact O-N 2.83Å |
| 247 | K | 95.6 | Very high | 92.1 | Very high | 130 Ų | 130 | 107 Ų | 107 | 57% | 0.565 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -64.7 | -44.4 | 175 | -69.2 | 172.5 | -177.9 | -174.9 | 0 | 110.7 | K243 R244 H245 V249 R250 I251 | K243-K247 VanDerWaalsContact O-CG 3.32Å; K243-K247 WeakPolarHBondContact O-CG 3.23Å; K243-K247 PolarHBondContact O-N 3.47Å; R244-K247 WeakPolarHBondContact O-CA 3.14Å; R244-K247 WeakPolarHBondContact O-CB 3.35Å; R244-K247 PolarHBondContact O-N 2.86Å; H245-K247 PolarHBondContact O-N 2.64Å; K247-V249 PolarHBondContact O-N 2.93Å; K247-R250 WeakPolarHBondContact O-CB 3.44Å; K247-R250 PolarHBondContact O-N 3.23Å; K247-I251 WeakPolarHBondContact O-CB 3.35Å; K247-I251 VanDerWaalsContact O-CG1 3.23Å; K247-I251 WeakPolarHBondContact O-CG1 3.44Å; K247-I251 PolarHBondContact O-N 3.11Å |
| 248 | D | 93.6 | Very high | 92.2 | Very high | 85 Ų | 85 | 108.3 Ų | 108.3 | 46% | 0.455 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -63.7 | -41.9 | -180 | -64.6 | -28.5 | 0 | 0 | 0 | 111.5 | R244 H245 R250 I251 Q252 | R244-D248 PolarHBondContact O-N 2.98Å; H245-D248 PolarHBondContact O-N 3.4Å; D248-R250 PolarHBondContact O-N 2.62Å; D248-I251 PolarHBondContact O-N 3.15Å; D248-Q252 WeakPolarHBondContact O-CG 3.44Å; D248-Q252 PolarHBondContact O-N 2.89Å |
| 249 | V | 95.2 | Very high | 92 | Very high | 48 Ų | 48 | 109.4 Ų | 109.4 | 29% | 0.291 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -62.4 | -42.5 | 173.6 | 169.5 | 0 | 0 | 0 | 0 | 111.1 | H245 K247 I251 Q252 Q253 | H245-V249 WeakPolarHBondContact O-CB 3.38Å; H245-V249 VanDerWaalsContact O-CG2 3.25Å; H245-V249 WeakPolarHBondContact O-CG2 3.41Å; H245-V249 PolarHBondContact O-N 2.66Å; K247-V249 PolarHBondContact O-N 2.93Å; V249-I251 VanDerWaalsContact C-N 3.35Å; V249-Q252 PolarHBondContact O-N 3.15Å; V249-Q253 VanDerWaalsContact O-CG 3.29Å; V249-Q253 WeakPolarHBondContact O-CG 3.33Å; V249-Q253 PolarHBondContact O-N 2.93Å |
| 250 | R | 94.8 | Very high | 91.2 | Very high | 177 Ų | 177 | 109.8 Ų | 109.8 | 67% | 0.668 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -64.7 | -39.9 | 176.5 | -174.7 | 172 | -177.1 | 162 | 0 | 111.8 | E246 K247 D248 Q253 L254 | E246-R250 WeakPolarHBondContact O-CB 3.47Å; E246-R250 PolarHBondContact O-N 2.83Å; K247-R250 WeakPolarHBondContact O-CB 3.44Å; K247-R250 PolarHBondContact O-N 3.23Å; D248-R250 PolarHBondContact O-N 2.62Å; R250-Q253 PolarHBondContact O-N 3.36Å; R250-L254 HydrophobicContact CG-CD1 4.11Å; R250-L254 WeakPolarHBondContact O-CD1 3.26Å; R250-L254 WeakPolarHBondContact O-CG 3.48Å; R250-L254 PolarHBondContact O-N 3.34Å |
| 251 | I | 94.7 | Very high | 90.1 | Very high | 80 Ų | 80 | 109.9 Ų | 109.9 | 41% | 0.41 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -63.9 | -44.1 | 175.2 | -69.6 | 163.4 | 0 | 0 | 0 | 110.1 | K247 D248 V249 Q253 L254 K255 | K247-I251 WeakPolarHBondContact O-CB 3.35Å; K247-I251 VanDerWaalsContact O-CG1 3.23Å; K247-I251 WeakPolarHBondContact O-CG1 3.44Å; K247-I251 PolarHBondContact O-N 3.11Å; D248-I251 PolarHBondContact O-N 3.15Å; V249-I251 VanDerWaalsContact C-N 3.35Å; I251-Q253 VanDerWaalsContact C-N 3.33Å; I251-Q253 PolarHBondContact O-N 2.86Å; I251-L254 PolarHBondContact O-N 3.36Å; I251-K255 HydrophobicContact CG2-CD 4.16Å; I251-K255 HydrophobicContact CG2-CG 4.4Å; I251-K255 WeakPolarHBondContact O-CB 3.39Å; I251-K255 WeakPolarHBondContact O-CG 3.32Å; I251-K255 PolarHBondContact O-N 2.63Å |
| 252 | Q | 94.3 | Very high | 88.5 | Confident | 130 Ų | 130 | 111.6 Ų | 111.6 | 61% | 0.607 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -61.1 | -41.2 | 175.6 | -75 | 175 | 0.4 | 0 | 0 | 112.1 | D248 V249 K255 Q256 | D248-Q252 WeakPolarHBondContact O-CG 3.44Å; D248-Q252 PolarHBondContact O-N 2.89Å; V249-Q252 PolarHBondContact O-N 3.15Å; Q252-K255 PolarHBondContact O-N 3.46Å; Q252-Q256 PolarHBondContact O-N 2.92Å |
| 253 | Q | 94.1 | Very high | 86.5 | Confident | 120 Ų | 120 | 111.6 Ų | 111.6 | 56% | 0.561 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -63 | -42.7 | 174.9 | -72.2 | 169.8 | -1.5 | 0 | 0 | 112.1 | V249 R250 I251 Q256 L257 | V249-Q253 VanDerWaalsContact O-CG 3.29Å; V249-Q253 WeakPolarHBondContact O-CG 3.33Å; V249-Q253 PolarHBondContact O-N 2.93Å; R250-Q253 PolarHBondContact O-N 3.36Å; I251-Q253 VanDerWaalsContact C-N 3.33Å; I251-Q253 PolarHBondContact O-N 2.86Å; Q253-Q256 PolarHBondContact O-N 2.92Å; Q253-L257 WeakPolarHBondContact O-CG 3.35Å; Q253-L257 PolarHBondContact O-N 3.17Å; Q253-L257 VanDerWaalsContact O-N 3.1Å |
| 254 | L | 94.9 | Very high | 84.3 | Confident | 92 Ų | 92 | 112 Ų | 112 | 48% | 0.482 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -64 | -42.4 | 175.9 | -76.5 | 158.3 | 0 | 0 | 0 | 111.7 | R250 I251 L257 L258 | R250-L254 HydrophobicContact CG-CD1 4.11Å; R250-L254 WeakPolarHBondContact O-CD1 3.26Å; R250-L254 WeakPolarHBondContact O-CG 3.48Å; R250-L254 PolarHBondContact O-N 3.34Å; I251-L254 PolarHBondContact O-N 3.36Å; L254-L257 PolarHBondContact O-N 2.88Å; L254-L258 WeakPolarHBondContact O-CD1 3.29Å; L254-L258 WeakPolarHBondContact O-CG 3.5Å; L254-L258 PolarHBondContact O-N 3.38Å |
| 255 | K | 91.9 | Very high | 82.1 | Confident | 120 Ų | 120 | 114.1 Ų | 114.1 | 52% | 0.522 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -61.1 | -45.9 | 175.6 | -75.2 | 179.5 | 176.2 | -172.6 | 0 | 111.9 | I251 Q252 L257 L258 E259 | I251-K255 HydrophobicContact CG2-CD 4.16Å; I251-K255 HydrophobicContact CG2-CG 4.4Å; I251-K255 WeakPolarHBondContact O-CB 3.39Å; I251-K255 WeakPolarHBondContact O-CG 3.32Å; I251-K255 PolarHBondContact O-N 2.63Å; Q252-K255 PolarHBondContact O-N 3.46Å; K255-L257 VanDerWaalsContact C-N 3.33Å; K255-L257 PolarHBondContact O-N 2.82Å; K255-L258 PolarHBondContact O-N 3.43Å; K255-E259 WeakPolarHBondContact O-CB 3.37Å; K255-E259 WeakPolarHBondContact O-CG 3.45Å; K255-E259 PolarHBondContact O-N 2.86Å |
| 256 | Q | 90.3 | Very high | 79.8 | Confident | 100 Ų | 100 | 115.9 Ų | 115.9 | 47% | 0.467 | 59% | 0.589 | S | S | . | * | H | α-helix | trans | -59.9 | -43 | 176.9 | -171.1 | 70.2 | 50.7 | 0 | 0 | 111.8 | Q252 Q253 L258 E259 D260 | Q252-Q256 PolarHBondContact O-N 2.92Å; Q253-Q256 PolarHBondContact O-N 2.92Å; Q256-L258 VanDerWaalsContact C-N 3.31Å; Q256-L258 PolarHBondContact O-N 3.49Å; Q256-E259 PolarHBondContact O-N 3.05Å; Q256-D260 PolarHBondContact NE2-OD1 3.18Å; Q256-D260 PolarHBondContact NE2-OD2 2.96Å; Q256-D260 VanDerWaalsContact O-CB 3.28Å; Q256-D260 WeakPolarHBondContact O-CB 3.43Å; Q256-D260 PolarHBondContact O-N 2.84Å |
| 257 | L | 90.1 | Very high | 77.6 | Confident | 112 Ų | 112 | 120.5 Ų | 120.5 | 59% | 0.586 | 60% | 0.6 | S | S | * | * | H | α-helix | trans | -64.3 | -35.9 | 177.5 | -74 | 167.9 | 0 | 0 | 0 | 112.7 | Q253 L254 K255 S261 | Q253-L257 WeakPolarHBondContact O-CG 3.35Å; Q253-L257 PolarHBondContact O-N 3.17Å; Q253-L257 VanDerWaalsContact O-N 3.1Å; L254-L257 PolarHBondContact O-N 2.88Å; K255-L257 VanDerWaalsContact C-N 3.33Å; K255-L257 PolarHBondContact O-N 2.82Å; L257-S261 WeakPolarHBondContact O-CB 3.35Å; L257-S261 PolarHBondContact O-N 2.79Å; L257-S261 PolarHBondContact O-OG 3.14Å |
| 258 | L | 86.8 | Confident | 75.2 | Confident | 118 Ų | 118 | 119.5 Ų | 119.5 | 62% | 0.618 | 61% | 0.609 | S | S | * | * | H | α-helix | trans | -70 | -46.2 | 175.7 | -74.8 | 159.8 | 0 | 0 | 0 | 111.1 | L254 K255 Q256 S261 T262 | L254-L258 WeakPolarHBondContact O-CD1 3.29Å; L254-L258 WeakPolarHBondContact O-CG 3.5Å; L254-L258 PolarHBondContact O-N 3.38Å; K255-L258 PolarHBondContact O-N 3.43Å; Q256-L258 VanDerWaalsContact C-N 3.31Å; Q256-L258 PolarHBondContact O-N 3.49Å; L258-S261 PolarHBondContact O-N 3.32Å; L258-T262 PolarHBondContact O-N 3.17Å; L258-T262 PolarHBondContact O-OG1 2.88Å |
| 259 | E | 83.2 | Confident | 72.6 | Confident | 110 Ų | 110 | 121 Ų | 121 | 51% | 0.514 | 63% | 0.626 | S | S | . | * | H | α-helix | trans | -63.8 | -41 | 178.3 | -75.5 | 165.2 | -170.6 | 0 | 0 | 112.1 | K255 Q256 S261 T262 S263 | K255-E259 WeakPolarHBondContact O-CB 3.37Å; K255-E259 WeakPolarHBondContact O-CG 3.45Å; K255-E259 PolarHBondContact O-N 2.86Å; Q256-E259 PolarHBondContact O-N 3.05Å; E259-S261 VanDerWaalsContact C-N 3.26Å; E259-S261 PolarHBondContact O-N 2.97Å; E259-T262 PolarHBondContact O-N 3.04Å; E259-T262 PolarHBondContact O-OG1 2.82Å; E259-S263 VanDerWaalsContact O-CB 3.31Å; E259-S263 WeakPolarHBondContact O-CB 3.47Å; E259-S263 PolarHBondContact O-N 3.1Å |
| 260 | D | 71.6 | Confident | 70.1 | Confident | 97 Ų | 97 | 124.3 Ų | 124.3 | 52% | 0.519 | 65% | 0.652 | S | S | . | * | H | α-helix | trans | -69.8 | -21.9 | 177.4 | -66.8 | -15.4 | 0 | 0 | 0 | 112.5 | Q256 | Q256-D260 PolarHBondContact NE2-OD1 3.18Å; Q256-D260 PolarHBondContact NE2-OD2 2.96Å; Q256-D260 VanDerWaalsContact O-CB 3.28Å; Q256-D260 WeakPolarHBondContact O-CB 3.43Å; Q256-D260 PolarHBondContact O-N 2.84Å |
| 261 | S | 66.5 | Low | 67.3 | Low | 100 Ų | 100 | 121.1 Ų | 121.1 | 70% | 0.699 | 66% | 0.657 | S | S | * | * | H | α-helix | trans | -87.9 | -15.9 | 177.4 | -57.2 | 0 | 0 | 0 | 0 | 113.5 | L257 L258 E259 | L257-S261 WeakPolarHBondContact O-CB 3.35Å; L257-S261 PolarHBondContact O-N 2.79Å; L257-S261 PolarHBondContact O-OG 3.14Å; L258-S261 PolarHBondContact O-N 3.32Å; E259-S261 VanDerWaalsContact C-N 3.26Å; E259-S261 PolarHBondContact O-N 2.97Å |
| 262 | T | 57.2 | Low | 65.2 | Low | 115 Ų | 115 | 123.3 Ų | 123.3 | 71% | 0.706 | 68% | 0.679 | S | S | * | * | H | α-helix | trans | -104.3 | -8.5 | 179.3 | 57.2 | 0 | 0 | 0 | 0 | 113.5 | L258 E259 D264 | L258-T262 PolarHBondContact O-N 3.17Å; L258-T262 PolarHBondContact O-OG1 2.88Å; E259-T262 PolarHBondContact O-N 3.04Å; E259-T262 PolarHBondContact O-OG1 2.82Å; T262-D264 PolarHBondContact O-N 3.03Å |
| 263 | S | 50.4 | Low | 62.9 | Low | 94 Ų | 94 | 121.9 Ų | 121.9 | 66% | 0.657 | 68% | 0.684 | S | S | * | * | trans | -97.4 | 43.7 | -173.3 | -175.1 | 0 | 0 | 0 | 0 | 113.7 | E259 | E259-S263 VanDerWaalsContact O-CB 3.31Å; E259-S263 WeakPolarHBondContact O-CB 3.47Å; E259-S263 PolarHBondContact O-N 3.1Å | ||
| 264 | D | 47.1 | Very low | 60.5 | Low | 145 Ų | 145 | 122.9 Ų | 122.9 | 78% | 0.775 | 69% | 0.688 | S | S | * | * | trans | -104.9 | 11.2 | 170.9 | -105.4 | -56.3 | 0 | 0 | 0 | 113.3 | T262 | T262-D264 PolarHBondContact O-N 3.03Š| ||
| 265 | E | 46.8 | Very low | 58 | Low | 164 Ų | 164 | 121.1 Ų | 121.1 | 77% | 0.766 | 69% | 0.693 | S | S | * | * | S | Bend | trans | -120.9 | 116 | 173.4 | -61 | -64 | 150.4 | 0 | 0 | 111.6 | ||
| 266 | D | 42.5 | Very low | 56.2 | Low | 160 Ų | 160 | 124.5 Ų | 124.5 | 86% | 0.856 | 71% | 0.707 | S | S | * | * | trans | 85.9 | 127.9 | 161 | -68.3 | -45.6 | 0 | 0 | 0 | 124 | ||||
| 267 | R | 48.4 | Very low | 54.5 | Low | 234 Ų | 234 | 127.5 Ų | 127.5 | 88% | 0.883 | 72% | 0.721 | S | S | * | * | trans | -69.9 | 143.5 | -176.1 | -84 | 168.9 | 153.4 | -168.2 | -3.1 | 114.6 | ||||
| 268 | S | 43.9 | Very low | 53.1 | Low | 108 Ų | 108 | 128.7 Ų | 128.7 | 76% | 0.755 | 72% | 0.721 | S | S | * | * | trans | 64.2 | 111.8 | 139 | -61.6 | 0 | 0 | 0 | 0 | 120.4 | ||||
| 269 | S | 40.3 | Very low | 51.8 | Low | 116 Ų | 116 | 129.1 Ų | 129.1 | 81% | 0.811 | 72% | 0.72 | S | S | * | * | 153.8 | 135.3 | 103.7 | 55.8 | 0 | 0 | 0 | 0 | 115.5 | |||||
| 270 | S | 42.6 | Very low | 51.1 | Low | 119 Ų | 119 | 131.8 Ų | 131.8 | 83% | 0.832 | 73% | 0.73 | S | S | * | * | trans | 66.6 | 110.6 | 158.1 | 73.8 | 0 | 0 | 0 | 0 | 121.7 | ||||
| 271 | S | 36.1 | Very low | 51.2 | Low | 110 Ų | 110 | 135 Ų | 135 | 77% | 0.769 | 74% | 0.739 | S | S | * | * | trans | -161.5 | 95.6 | 148 | 173.7 | 0 | 0 | 0 | 0 | 110.3 | S273 | S271-S273 PolarHBondContact O-N 3.28Š| ||
| 272 | S | 49.4 | Very low | 51.7 | Low | 126 Ų | 126 | 137.7 Ų | 137.7 | 88% | 0.881 | 74% | 0.739 | S | S | * | * | trans | -87.2 | 96 | 177.5 | 63.6 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 273 | S | 46 | Very low | 52.8 | Low | 100 Ų | 100 | 139.2 Ų | 139.2 | 70% | 0.699 | 74% | 0.735 | S | S | * | * | trans | -155.3 | 5 | 164.9 | 62.3 | 0 | 0 | 0 | 0 | 116.2 | S271 G275 | S271-S273 PolarHBondContact O-N 3.28Å; S273-G275 PolarHBondContact O-N 3.04Å | ||
| 274 | E | 44.4 | Very low | 54.3 | Low | 141 Ų | 141 | 142.8 Ų | 142.8 | 66% | 0.659 | 74% | 0.739 | S | S | * | * | trans | -93.5 | 15 | -178.7 | -68.6 | -126.9 | 127.6 | 0 | 0 | 115.4 | K278 | E274-K278 IonicContact OE2-NZ 2.76Å; E274-K278 PolarHBondContact OE2-NZ 3.2Å | ||
| 275 | G | 43.1 | Very low | 56 | Low | 55 Ų | 55 | 144 Ų | 144 | 57% | 0.567 | 74% | 0.737 | S | S | * | * | H | α-helix | trans | -85.2 | -32 | -172.7 | 0 | 0 | 0 | 0 | 0 | 115.2 | S273 H279 | S273-G275 PolarHBondContact O-N 3.04Å; G275-H279 WeakPolarHBondContact O-CB 3.43Å; G275-H279 PolarHBondContact O-N 2.71Å |
| 276 | K | 53.8 | Low | 57.8 | Low | 191 Ų | 191 | 142.9 Ų | 142.9 | 83% | 0.83 | 73% | 0.732 | S | S | * | * | H | α-helix | trans | -79.1 | -37 | -165.6 | -71.6 | -177.2 | 176.9 | 176.5 | 0 | 113.3 | K280 | K276-K280 PolarHBondContact O-N 2.88Å; K276-K280 VanDerWaalsContact O-N 3.09Å |
| 277 | E | 54.4 | Low | 59.9 | Low | 162 Ų | 162 | 143.3 Ų | 143.3 | 76% | 0.757 | 73% | 0.726 | S | S | * | * | H | α-helix | trans | -76.6 | -44.3 | -175.5 | -142.2 | -144.5 | 157 | 0 | 0 | 112.4 | H279 K280 K281 | E277-H279 VanDerWaalsContact C-N 3.27Å; E277-H279 PolarHBondContact O-N 2.86Å; E277-K280 PolarHBondContact O-N 3.47Å; E277-K281 PolarHBondContact O-N 3Å |
| 278 | K | 60.3 | Low | 61.8 | Low | 137 Ų | 137 | 138.4 Ų | 138.4 | 60% | 0.596 | 71% | 0.713 | S | S | * | * | H | α-helix | trans | -58 | -39.6 | 173.6 | -72.6 | 171.4 | -179.8 | 156 | 0 | 111 | E274 K282 | E274-K278 IonicContact OE2-NZ 2.76Å; E274-K278 PolarHBondContact OE2-NZ 3.2Å; K278-K282 WeakPolarHBondContact O-CB 3.34Å; K278-K282 PolarHBondContact O-N 2.96Å |
| 279 | H | 59.5 | Low | 64 | Low | 127 Ų | 127 | 141.1 Ų | 141.1 | 59% | 0.588 | 71% | 0.712 | S | S | * | * | H | α-helix | trans | -68.2 | -41.4 | 175.8 | -169 | -106.5 | 0 | 0 | 0 | 113 | G275 E277 K282 K283 | G275-H279 WeakPolarHBondContact O-CB 3.43Å; G275-H279 PolarHBondContact O-N 2.71Å; E277-H279 VanDerWaalsContact C-N 3.27Å; E277-H279 PolarHBondContact O-N 2.86Å; H279-K282 PolarHBondContact O-N 2.87Å; H279-K283 WeakPolarHBondContact O-CB 3.31Å; H279-K283 PolarHBondContact O-N 3.27Å |
| 280 | K | 69.6 | Low | 66.3 | Low | 166 Ų | 166 | 143.6 Ų | 143.6 | 72% | 0.722 | 71% | 0.707 | S | S | * | * | H | α-helix | trans | -64.9 | -40.7 | 177 | -161.9 | 174.3 | -178 | -179.5 | 0 | 111.8 | K276 E277 K283 K284 | K276-K280 PolarHBondContact O-N 2.88Å; K276-K280 VanDerWaalsContact O-N 3.09Å; E277-K280 PolarHBondContact O-N 3.47Å; K280-K283 PolarHBondContact O-N 3.22Å; K280-K284 WeakPolarHBondContact O-CB 3.45Å; K280-K284 PolarHBondContact O-N 3.44Å |
| 281 | K | 73.1 | Confident | 68.5 | Low | 165 Ų | 165 | 145.9 Ų | 145.9 | 72% | 0.717 | 70% | 0.698 | S | S | * | * | H | α-helix | trans | -66.1 | -41.5 | 175.5 | -164.9 | 171.8 | -175.7 | 172 | 0 | 111.9 | E277 K284 K285 | E277-K281 PolarHBondContact O-N 3Å; K281-K284 PolarHBondContact O-N 3.3Å; K281-K285 WeakPolarHBondContact O-CB 3.35Å; K281-K285 PolarHBondContact O-N 2.96Å |
| 282 | K | 76.8 | Confident | 71.1 | Confident | 157 Ų | 157 | 146.9 Ų | 146.9 | 68% | 0.683 | 69% | 0.689 | S | S | * | * | H | α-helix | trans | -63 | -46 | 174.6 | -168.1 | 175.5 | 178.7 | -176.9 | 0 | 111.6 | K278 H279 K284 K285 E286 | K278-K282 WeakPolarHBondContact O-CB 3.34Å; K278-K282 PolarHBondContact O-N 2.96Å; H279-K282 PolarHBondContact O-N 2.87Å; K282-K284 PolarHBondContact O-N 3.27Å; K282-K285 PolarHBondContact O-N 2.93Å; K282-E286 PolarHBondContact O-N 3.35Å |
| 283 | K | 79.4 | Confident | 72.9 | Confident | 146 Ų | 146 | 147.7 Ų | 147.7 | 64% | 0.635 | 68% | 0.676 | S | S | * | * | H | α-helix | trans | -62.6 | -39.5 | 177.2 | -165.9 | 171.2 | -177.7 | 175.6 | 0 | 112.5 | H279 K280 E286 K287 | H279-K283 WeakPolarHBondContact O-CB 3.31Å; H279-K283 PolarHBondContact O-N 3.27Å; K280-K283 PolarHBondContact O-N 3.22Å; K283-E286 PolarHBondContact O-N 3.45Å; K283-K287 WeakPolarHBondContact O-CB 3.4Å; K283-K287 PolarHBondContact O-N 3.15Å |
| 284 | K | 82.1 | Confident | 75 | Confident | 170 Ų | 170 | 147.5 Ų | 147.5 | 74% | 0.739 | 66% | 0.664 | S | S | * | * | H | α-helix | trans | -66.6 | -42.2 | 175.4 | -167.4 | 174.6 | -179.7 | 179.9 | 0 | 112.1 | K280 K281 K282 E286 K287 H288 | K280-K284 WeakPolarHBondContact O-CB 3.45Å; K280-K284 PolarHBondContact O-N 3.44Å; K281-K284 PolarHBondContact O-N 3.3Å; K282-K284 PolarHBondContact O-N 3.27Å; K284-E286 VanDerWaalsContact C-N 3.35Å; K284-E286 PolarHBondContact O-N 3.45Å; K284-K287 PolarHBondContact O-N 3.07Å; K284-H288 PolarHBondContact O-N 2.96Å; K284-H288 VanDerWaalsContact O-N 3.13Å |
| 285 | K | 83.9 | Confident | 77 | Confident | 170 Ų | 170 | 147 Ų | 147 | 74% | 0.739 | 66% | 0.66 | S | S | * | * | H | α-helix | trans | -64 | -39.1 | 176.9 | -168.5 | 173.4 | -176.8 | 175.7 | 0 | 111.9 | K281 K282 K289 | K281-K285 WeakPolarHBondContact O-CB 3.35Å; K281-K285 PolarHBondContact O-N 2.96Å; K282-K285 PolarHBondContact O-N 2.93Å; K285-K289 PolarHBondContact O-N 3.34Å; K285-K289 VanDerWaalsContact O-N 3.16Å |
| 286 | E | 84.1 | Confident | 79 | Confident | 141 Ų | 141 | 151.1 Ų | 151.1 | 66% | 0.659 | 66% | 0.662 | S | S | * | * | H | α-helix | trans | -68.7 | -44.5 | 177.9 | -148.7 | -166.3 | 172.8 | 0 | 0 | 112.4 | K282 K283 K284 H288 K289 K290 | K282-E286 PolarHBondContact O-N 3.35Å; K283-E286 PolarHBondContact O-N 3.45Å; K284-E286 VanDerWaalsContact C-N 3.35Å; K284-E286 PolarHBondContact O-N 3.45Å; E286-H288 VanDerWaalsContact C-N 3.3Å; E286-H288 PolarHBondContact O-N 2.82Å; E286-K289 PolarHBondContact O-N 3.03Å; E286-K289 VanDerWaalsContact O-N 3.14Å; E286-K290 PolarHBondContact O-N 3Å |
| 287 | K | 87.9 | Confident | 80.6 | Confident | 168 Ų | 168 | 148.2 Ų | 148.2 | 73% | 0.73 | 65% | 0.65 | S | S | * | * | H | α-helix | trans | -57.9 | -41.2 | 175.3 | -169.4 | 175.6 | -178.1 | 178 | 0 | 111.8 | K283 K284 K290 R291 | K283-K287 WeakPolarHBondContact O-CB 3.4Å; K283-K287 PolarHBondContact O-N 3.15Å; K284-K287 PolarHBondContact O-N 3.07Å; K287-K290 PolarHBondContact O-N 3.05Å; K287-R291 PolarHBondContact O-N 3.44Å; K287-R291 VanDerWaalsContact O-N 3.13Å |
| 288 | H | 87 | Confident | 81.9 | Confident | 132 Ų | 132 | 146.5 Ų | 146.5 | 61% | 0.611 | 64% | 0.639 | S | S | * | * | H | α-helix | trans | -65.5 | -41.2 | 176.7 | -173.1 | -104.4 | 0 | 0 | 0 | 112.5 | K284 E286 R291 K292 | K284-H288 PolarHBondContact O-N 2.96Å; K284-H288 VanDerWaalsContact O-N 3.13Å; E286-H288 VanDerWaalsContact C-N 3.3Å; E286-H288 PolarHBondContact O-N 2.82Å; H288-R291 PolarHBondContact O-N 3.07Å; H288-K292 PolarHBondContact O-N 3.18Å |
| 289 | K | 89.9 | Confident | 82.9 | Confident | 165 Ų | 165 | 146.8 Ų | 146.8 | 72% | 0.717 | 64% | 0.641 | S | S | * | * | H | α-helix | trans | -64.6 | -40.2 | 177.5 | -163.6 | 176.7 | -179.9 | -176.2 | 0 | 111.7 | K285 E286 K292 K293 | K285-K289 PolarHBondContact O-N 3.34Å; K285-K289 VanDerWaalsContact O-N 3.16Å; E286-K289 PolarHBondContact O-N 3.03Å; E286-K289 VanDerWaalsContact O-N 3.14Å; K289-K292 PolarHBondContact O-N 2.86Å; K289-K293 PolarHBondContact O-N 3.17Å; K289-K293 VanDerWaalsContact O-N 3.12Å |
| 290 | K | 89.8 | Confident | 83.7 | Confident | 167 Ų | 167 | 148.6 Ų | 148.6 | 73% | 0.726 | 65% | 0.647 | S | S | * | * | H | α-helix | trans | -62.1 | -47.1 | 175.5 | -167 | 174.1 | -179.3 | 178.1 | 0 | 111.6 | E286 K287 K292 K293 E294 | E286-K290 PolarHBondContact O-N 3Å; K287-K290 PolarHBondContact O-N 3.05Å; K290-K292 PolarHBondContact O-N 2.71Å; K290-K293 PolarHBondContact O-N 3.24Å; K290-E294 PolarHBondContact O-N 3.39Å |
| 291 | R | 88.5 | Confident | 83.9 | Confident | 168 Ų | 168 | 150.1 Ų | 150.1 | 63% | 0.634 | 65% | 0.648 | S | S | * | * | H | α-helix | trans | -62.7 | -37.8 | 178.6 | -159.2 | 176.3 | -178.6 | -155.3 | 2.1 | 112.6 | K287 H288 E294 K295 | K287-R291 PolarHBondContact O-N 3.44Å; K287-R291 VanDerWaalsContact O-N 3.13Å; H288-R291 PolarHBondContact O-N 3.07Å; R291-E294 PolarHBondContact O-N 2.88Å; R291-K295 PolarHBondContact O-N 3.3Å |
| 292 | K | 89.4 | Confident | 83.8 | Confident | 131 Ų | 131 | 149.8 Ų | 149.8 | 57% | 0.57 | 65% | 0.647 | S | S | * | * | H | α-helix | trans | -67 | -39.5 | 175.3 | -168.9 | 171.8 | -177.8 | 173.5 | 0 | 112.2 | H288 K289 K290 K296 | H288-K292 PolarHBondContact O-N 3.18Å; K289-K292 PolarHBondContact O-N 2.86Å; K290-K292 PolarHBondContact O-N 2.71Å; K292-K296 PolarHBondContact O-N 3.36Å; K292-K296 VanDerWaalsContact O-N 3.16Å |
| 293 | K | 88.8 | Confident | 83.1 | Confident | 143 Ų | 143 | 148.9 Ų | 148.9 | 62% | 0.622 | 64% | 0.644 | S | S | * | * | H | α-helix | trans | -66.4 | -39.7 | 176.3 | -168.1 | 174.7 | -178.5 | 179.3 | 0 | 111.5 | K289 K290 K296 K297 | K289-K293 PolarHBondContact O-N 3.17Å; K289-K293 VanDerWaalsContact O-N 3.12Å; K290-K293 PolarHBondContact O-N 3.24Å; K293-K296 PolarHBondContact O-N 2.81Å; K293-K297 PolarHBondContact O-N 3.04Å |
| 294 | E | 88.9 | Confident | 82.4 | Confident | 95 Ų | 95 | 150 Ų | 150 | 44% | 0.444 | 65% | 0.65 | S | S | . | * | H | α-helix | trans | -66.8 | -45.1 | 177 | -159.8 | -157.9 | 139.5 | 0 | 0 | 112.3 | K290 R291 K296 K297 K298 | K290-E294 PolarHBondContact O-N 3.39Å; R291-E294 PolarHBondContact O-N 2.88Å; E294-K296 VanDerWaalsContact C-N 3.29Å; E294-K296 PolarHBondContact O-N 2.91Å; E294-K297 PolarHBondContact O-N 3.37Å; E294-K297 VanDerWaalsContact O-N 3.11Å; E294-K298 PolarHBondContact O-N 2.91Å; E294-K298 WeakPolarHBondContact OE1-CE 3.31Å; E294-K298 IonicContact OE1-NZ 2.66Å; E294-K298 PolarHBondContact OE1-NZ 3.35Å |
| 295 | K | 87.2 | Confident | 81.2 | Confident | 131 Ų | 131 | 145.9 Ų | 145.9 | 57% | 0.57 | 64% | 0.642 | S | S | * | * | H | α-helix | trans | -56.9 | -41.4 | 173.5 | -78.2 | -172.8 | 175.7 | -172 | 0 | 112 | R291 K298 K299 | R291-K295 PolarHBondContact O-N 3.3Å; K295-K298 PolarHBondContact O-N 2.93Å; K295-K299 PolarHBondContact O-N 3.33Å |
| 296 | K | 85.6 | Confident | 79.9 | Confident | 141 Ų | 141 | 142 Ų | 142 | 61% | 0.613 | 64% | 0.636 | S | S | * | * | H | α-helix | trans | -64.3 | -41.4 | 174.8 | -77.9 | -170.3 | 174 | -167.5 | 0 | 112.5 | K292 K293 E294 K299 K300 | K292-K296 PolarHBondContact O-N 3.36Å; K292-K296 VanDerWaalsContact O-N 3.16Å; K293-K296 PolarHBondContact O-N 2.81Å; E294-K296 VanDerWaalsContact C-N 3.29Å; E294-K296 PolarHBondContact O-N 2.91Å; K296-K299 PolarHBondContact O-N 3.28Å; K296-K300 PolarHBondContact O-N 3.45Å; K296-K300 VanDerWaalsContact O-N 3.09Å |
| 297 | K | 85.6 | Confident | 78.5 | Confident | 131 Ų | 131 | 144.3 Ų | 144.3 | 57% | 0.57 | 64% | 0.644 | S | S | * | * | H | α-helix | trans | -64.1 | -43 | 175.6 | -76.7 | -174.1 | 168.8 | -170.1 | 0 | 112.1 | K293 E294 K300 R301 | K293-K297 PolarHBondContact O-N 3.04Å; E294-K297 PolarHBondContact O-N 3.37Å; E294-K297 VanDerWaalsContact O-N 3.11Å; K297-K300 PolarHBondContact O-N 3.44Å; K297-R301 PolarHBondContact O-N 3.03Å |
| 298 | K | 83.1 | Confident | 76.7 | Confident | 125 Ų | 125 | 140.8 Ų | 140.8 | 54% | 0.543 | 64% | 0.64 | S | S | . | * | H | α-helix | trans | -61.2 | -43.6 | 176 | -79.3 | 177.1 | 167.9 | 162 | 0 | 112.1 | E294 K295 R301 K302 | E294-K298 PolarHBondContact O-N 2.91Å; E294-K298 WeakPolarHBondContact OE1-CE 3.31Å; E294-K298 IonicContact OE1-NZ 2.66Å; E294-K298 PolarHBondContact OE1-NZ 3.35Å; K295-K298 PolarHBondContact O-N 2.93Å; K298-R301 PolarHBondContact O-N 2.78Å; K298-K302 PolarHBondContact O-N 3.47Å |
| 299 | K | 80.6 | Confident | 75.1 | Confident | 144 Ų | 144 | 142.1 Ų | 142.1 | 63% | 0.626 | 65% | 0.652 | S | S | * | * | H | α-helix | trans | -59.8 | -46.5 | 173.9 | -73.7 | -169.7 | 175 | -163.3 | 0 | 112.1 | K295 K296 R301 K302 H303 | K295-K299 PolarHBondContact O-N 3.33Å; K296-K299 PolarHBondContact O-N 3.28Å; K299-R301 VanDerWaalsContact C-N 3.33Å; K299-R301 PolarHBondContact O-N 3.31Å; K299-K302 PolarHBondContact O-N 2.95Å; K299-H303 PolarHBondContact O-CD2 2.86Å; K299-H303 PolarHBondContact O-N 3.35Å; K299-H303 VanDerWaalsContact O-N 3.15Å |
| 300 | K | 77.6 | Confident | 73.3 | Confident | 165 Ų | 165 | 144 Ų | 144 | 72% | 0.717 | 66% | 0.663 | S | S | * | * | H | α-helix | trans | -61.8 | -36.7 | 177.4 | -73.2 | -168.6 | 174.6 | -161.6 | 0 | 113.4 | K296 K297 K304 | K296-K300 PolarHBondContact O-N 3.45Å; K296-K300 VanDerWaalsContact O-N 3.09Å; K297-K300 PolarHBondContact O-N 3.44Å; K300-K304 PolarHBondContact O-N 3.12Å |
| 301 | R | 72.8 | Confident | 71.5 | Confident | 198 Ų | 198 | 139.5 Ų | 139.5 | 75% | 0.747 | 67% | 0.665 | S | S | * | * | H | α-helix | trans | -66.7 | -42.2 | 175 | -74.6 | -177 | 174.1 | -176.8 | -4.1 | 112 | K297 K298 K299 H303 K304 S305 | K297-R301 PolarHBondContact O-N 3.03Å; K298-R301 PolarHBondContact O-N 2.78Å; K299-R301 VanDerWaalsContact C-N 3.33Å; K299-R301 PolarHBondContact O-N 3.31Å; R301-H303 VanDerWaalsContact C-N 3.33Å; R301-H303 PolarHBondContact O-N 2.88Å; R301-K304 PolarHBondContact O-N 3.17Å; R301-S305 PolarHBondContact O-N 2.85Å; R301-S305 PolarHBondContact O-OG 2.91Å |
| 302 | K | 71.9 | Confident | 69.6 | Low | 157 Ų | 157 | 137.5 Ų | 137.5 | 68% | 0.683 | 68% | 0.677 | S | S | * | * | H | α-helix | trans | -59.1 | -40.8 | 175.9 | -73.7 | -170.7 | 172.8 | -161.7 | 0 | 112.9 | K298 K299 K304 S305 S306 | K298-K302 PolarHBondContact O-N 3.47Å; K299-K302 PolarHBondContact O-N 2.95Å; K302-K304 VanDerWaalsContact C-N 3.28Å; K302-K304 PolarHBondContact O-N 2.9Å; K302-S305 PolarHBondContact O-OG 3.27Å; K302-S306 PolarHBondContact O-N 3.34Å; K302-S306 PolarHBondContact O-OG 2.72Å |
| 303 | H | 61.2 | Low | 67.5 | Low | 138 Ų | 138 | 138.5 Ų | 138.5 | 64% | 0.639 | 69% | 0.688 | S | S | * | * | H | α-helix | trans | -76.3 | -12.6 | 176.6 | -65.3 | -66.5 | 0 | 0 | 0 | 114.1 | K299 R301 S306 | K299-H303 PolarHBondContact O-CD2 2.86Å; K299-H303 PolarHBondContact O-N 3.35Å; K299-H303 VanDerWaalsContact O-N 3.15Å; R301-H303 VanDerWaalsContact C-N 3.33Å; R301-H303 PolarHBondContact O-N 2.88Å; H303-S306 PolarHBondContact O-OG 2.94Å |
| 304 | K | 64.1 | Low | 65.5 | Low | 171 Ų | 171 | 137.4 Ų | 137.4 | 74% | 0.743 | 70% | 0.699 | S | S | * | * | H | α-helix | trans | -92.9 | -32.1 | 176.3 | -172.6 | 140.2 | -179.3 | 135.6 | 0 | 112.1 | K300 R301 K302 S306 | K300-K304 PolarHBondContact O-N 3.12Å; R301-K304 PolarHBondContact O-N 3.17Å; K302-K304 VanDerWaalsContact C-N 3.28Å; K302-K304 PolarHBondContact O-N 2.9Å; K304-S306 VanDerWaalsContact C-N 3.32Å |
| 305 | S | 57.8 | Low | 63.4 | Low | 82 Ų | 82 | 145.7 Ų | 145.7 | 57% | 0.573 | 74% | 0.737 | S | S | * | * | H | α-helix | trans | -75.2 | -19.9 | 173.5 | 58.3 | 0 | 0 | 0 | 0 | 113.5 | R301 K302 K307 | R301-S305 PolarHBondContact O-N 2.85Å; R301-S305 PolarHBondContact O-OG 2.91Å; K302-S305 PolarHBondContact O-OG 3.27Å; S305-K307 VanDerWaalsContact C-N 3.32Å |
| 306 | S | 56.9 | Low | 62.2 | Low | 88 Ų | 88 | 146.4 Ų | 146.4 | 62% | 0.615 | 75% | 0.745 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.4 | 5.8 | 177.2 | 62.3 | 0 | 0 | 0 | 0 | 114.1 | K302 H303 K304 | K302-S306 PolarHBondContact O-N 3.34Å; K302-S306 PolarHBondContact O-OG 2.72Å; H303-S306 PolarHBondContact O-OG 2.94Å; K304-S306 VanDerWaalsContact C-N 3.32Å |
| 307 | K | 54.6 | Low | 61 | Low | 190 Ų | 190 | 146.7 Ų | 146.7 | 83% | 0.826 | 75% | 0.752 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -122.1 | 14.6 | -178.5 | -161.9 | 159.4 | -179.2 | 64.8 | 0 | 113.5 | S305 | S305-K307 VanDerWaalsContact C-N 3.32Š|
| 308 | S | 50.3 | Low | 59.6 | Low | 94 Ų | 94 | 147.6 Ų | 147.6 | 66% | 0.657 | 76% | 0.763 | S | S | * | * | S | Bend | trans | -132.2 | 30.5 | -179.6 | 65 | 0 | 0 | 0 | 0 | 112.8 | ||
| 309 | N | 52.1 | Low | 58.2 | Low | 161 Ų | 161 | 148.9 Ų | 148.9 | 86% | 0.861 | 78% | 0.775 | S | S | * | * | S | Bend | trans | -130.1 | 43.1 | 177.5 | -138 | 22.4 | 0 | 0 | 0 | 111.4 | ||
| 310 | E | 52.2 | Low | 56.8 | Low | 203 Ų | 203 | 149.2 Ų | 149.2 | 95% | 0.949 | 79% | 0.785 | S | S | * | * | S | Bend | trans | -146.2 | 88 | 171.3 | -126.3 | -178.3 | 136.7 | 0 | 0 | 105.9 | ||
| 311 | G | 51.7 | Low | 55.4 | Low | 73 Ų | 73 | 148.1 Ų | 148.1 | 75% | 0.753 | 79% | 0.789 | S | S | * | * | trans | 169.1 | 104.6 | -177.1 | 0 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 312 | S | 48.7 | Very low | 54.2 | Low | 127 Ų | 127 | 144.6 Ų | 144.6 | 89% | 0.888 | 79% | 0.792 | S | S | * | * | trans | 91.9 | 93.4 | 167.8 | -52.4 | 0 | 0 | 0 | 0 | 117.2 | ||||
| 313 | D | 45.7 | Very low | 52.8 | Low | 152 Ų | 152 | 143.6 Ų | 143.6 | 81% | 0.813 | 80% | 0.801 | S | S | * | * | -159.7 | 100 | 129.4 | -152.1 | -81.3 | 0 | 0 | 0 | 108.8 | |||||
| 314 | S | 47.2 | Very low | 52.1 | Low | 120 Ų | 120 | 144.1 Ų | 144.1 | 84% | 0.839 | 81% | 0.814 | S | S | * | * | trans | -156.1 | 85.3 | 167.9 | -66.4 | 0 | 0 | 0 | 0 | 107 | ||||
| 315 | E | 44.4 | Very low | 51 | Low | 268 Ų | 268 | 141.6 Ų | 141.6 | 100% | 1.252 | 82% | 0.821 | S | S | * | * | trans | -145 | 0 | 139.3 | -76.2 | -164 | 108.2 | 0 | 0 | 108.3 |
Retrieved 315 of 315 residues in 45.9 ms
(Link to these results)