| 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 | 51.6 | Low | 77.1 | Confident | 244 Ų | 244 | 145.9 Ų | 145.9 | 100% | 1.202 | 82% | 0.822 | S | S | * | * | 0 | 136.6 | 0 | -70.6 | 174.1 | 169.8 | 0 | 0 | 107.3 | |||||
| 2 | C | 50.7 | Low | 78.6 | Confident | 130 Ų | 130 | 150.9 Ų | 150.9 | 88% | 0.878 | 82% | 0.819 | S | S | * | * | P | Polyproline II helix | trans | -77.8 | 139.7 | 175.9 | -59.1 | 0 | 0 | 0 | 0 | 109.8 | ||
| 3 | S | 66.4 | Low | 79.9 | Confident | 109 Ų | 109 | 144.4 Ų | 144.4 | 76% | 0.762 | 78% | 0.783 | S | S | * | * | P | Polyproline II helix | trans | -65.4 | 139.4 | 172.2 | -167.8 | 0 | 0 | 0 | 0 | 109.8 | A5 | S3-A5 PolarHBondContact O-N 2.79Š|
| 4 | P | 70.4 | Confident | 80.9 | Confident | 118 Ų | 118 | 142.6 Ų | 142.6 | 77% | 0.766 | 78% | 0.782 | S | S | * | * | P | Polyproline II helix | trans | -61.7 | 121.5 | 171.3 | 26.7 | -33.6 | 0 | 0 | 0 | 109.2 | S6 | P4-S6 PolarHBondContact O-N 2.73Š|
| 5 | A | 75 | Confident | 81.8 | Confident | 98 Ų | 98 | 142.7 Ų | 142.7 | 81% | 0.81 | 77% | 0.767 | S | S | * | * | P | Polyproline II helix | trans | -65.2 | 119 | 178.1 | 0 | 0 | 0 | 0 | 0 | 109.7 | S3 | S3-A5 PolarHBondContact O-N 2.79Š|
| 6 | S | 79.9 | Confident | 82.6 | Confident | 91 Ų | 91 | 142.2 Ų | 142.2 | 64% | 0.636 | 76% | 0.755 | S | S | * | * | P | Polyproline II helix | trans | -59.2 | 139.7 | 171.2 | 52.3 | 0 | 0 | 0 | 0 | 110.1 | P4 K8 | P4-S6 PolarHBondContact O-N 2.73Å; S6-K8 PolarHBondContact O-N 3.43Å |
| 7 | P | 81.3 | Confident | 83.1 | Confident | 128 Ų | 128 | 141.1 Ų | 141.1 | 83% | 0.831 | 75% | 0.749 | S | S | * | * | P | Polyproline II helix | trans | -60.1 | 123.5 | 179.4 | 25.1 | -33.7 | 0 | 0 | 0 | 110.1 | ||
| 8 | K | 90.6 | Very high | 83.7 | Confident | 197 Ų | 197 | 140.5 Ų | 140.5 | 86% | 0.857 | 74% | 0.735 | S | S | * | * | P | Polyproline II helix | trans | -88.7 | 123.8 | 179.1 | -63.9 | -174.8 | 179.7 | -176.3 | 0 | 109.6 | S6 | S6-K8 PolarHBondContact O-N 3.43Š|
| 9 | I | 92.9 | Very high | 84.3 | Confident | 172 Ų | 172 | 138.6 Ų | 138.6 | 88% | 0.882 | 73% | 0.725 | S | S | * | * | P | Polyproline II helix | trans | -76.8 | 130.6 | 169 | -58.7 | 175.7 | 0 | 0 | 0 | 107.9 | ||
| 10 | L | 94.5 | Very high | 84.9 | Confident | 132 Ų | 132 | 133.6 Ų | 133.6 | 69% | 0.691 | 70% | 0.704 | S | S | * | * | trans | -116.4 | 122.3 | 176.4 | 178.1 | 65 | 0 | 0 | 0 | 109.6 | R12 | L10-R12 HydrophobicContact CD1-CG 4.5Å; L10-R12 HydrophobicContact CG-CG 4.44Å | ||
| 11 | Y | 94.6 | Very high | 85.4 | Confident | 186 Ų | 186 | 130 Ų | 130 | 73% | 0.729 | 68% | 0.683 | S | S | * | * | trans | -106.9 | 143.5 | 168.3 | 176.2 | -103.8 | 0 | 0 | 0 | 109.8 | N13 | Y11-N13 HydrophobicContact CE1-CB 3.98Š| ||
| 12 | R | 95.8 | Very high | 87.5 | Confident | 206 Ų | 206 | 123 Ų | 123 | 78% | 0.777 | 65% | 0.65 | S | S | * | * | trans | -141.9 | 129.4 | 172.4 | -73.5 | -175.3 | 171 | -176.8 | -3.2 | 109.2 | L10 | L10-R12 HydrophobicContact CD1-CG 4.5Å; L10-R12 HydrophobicContact CG-CG 4.44Å | ||
| 13 | N | 95.1 | Very high | 89.8 | Confident | 66 Ų | 66 | 121.8 Ų | 121.8 | 35% | 0.353 | 63% | 0.631 | S | S | . | * | trans | -109.8 | 107.4 | 168.7 | -179.3 | -15.1 | 0 | 0 | 0 | 108.5 | Y11 R15 F16 | Y11-N13 HydrophobicContact CE1-CB 3.98Å; N13-R15 VanDerWaalsContact C-N 3.27Å; N13-R15 PolarHBondContact O-N 3.43Å; N13-R15 PolarHBondContact OD1-N 2.73Å; N13-F16 HydrophobicContact CB-CB 4.05Å; N13-F16 PolarHBondContact O-N 3.29Å; N13-F16 PolarHBondContact OD1-N 3.17Å | ||
| 14 | P | 93.9 | Very high | 91.3 | Very high | 120 Ų | 120 | 118.7 Ų | 118.7 | 78% | 0.779 | 61% | 0.606 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -69.1 | -23.8 | -176.9 | 27.8 | -34 | 0 | 0 | 0 | 113.1 | ||
| 15 | R | 94.3 | Very high | 92.6 | Very high | 144 Ų | 144 | 114.2 Ų | 114.2 | 54% | 0.543 | 58% | 0.575 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -88.9 | -12.8 | -176.7 | -59.5 | -176 | -171.6 | 154.4 | 0.7 | 113.5 | N13 L17 R18 L19 E495 | N13-R15 VanDerWaalsContact C-N 3.27Å; N13-R15 PolarHBondContact O-N 3.43Å; N13-R15 PolarHBondContact OD1-N 2.73Å; R15-L17 VanDerWaalsContact C-N 3.31Å; R15-L17 PolarHBondContact O-N 3.05Å; R15-R18 PolarHBondContact O-N 3.23Å; R15-L19 WeakPolarHBondContact O-CG 3.08Å; R15-L19 PolarHBondContact O-N 3.01Å; R15-E495 IonicContact CZ-OE1 3.65Å; R15-E495 IonicContact NE-OE1 2.7Å; R15-E495 IonicContact NH2-OE1 3.2Å; R15-E495 PolarHBondContact NH2-OE1 3.25Å |
| 16 | F | 93.9 | Very high | 93.7 | Very high | 134 Ų | 134 | 115 Ų | 115 | 59% | 0.588 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -58.2 | -39.9 | -175.5 | -174 | -105 | 0 | 0 | 0 | 113.1 | N13 L19 A20 | N13-F16 HydrophobicContact CB-CB 4.05Å; N13-F16 PolarHBondContact O-N 3.29Å; N13-F16 PolarHBondContact OD1-N 3.17Å; F16-L19 PolarHBondContact O-N 2.73Å; F16-A20 WeakPolarHBondContact O-CB 3.49Å; F16-A20 PolarHBondContact O-N 2.97Å |
| 17 | L | 92.6 | Very high | 94.6 | Very high | 123 Ų | 123 | 112.6 Ų | 112.6 | 64% | 0.644 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -69.4 | -40.8 | 178.4 | -61.8 | 178.9 | 0 | 0 | 0 | 112.4 | R15 L19 A20 F21 | R15-L17 VanDerWaalsContact C-N 3.31Å; R15-L17 PolarHBondContact O-N 3.05Å; L17-L19 VanDerWaalsContact C-N 3.35Å; L17-L19 PolarHBondContact O-N 3.05Å; L17-A20 PolarHBondContact O-N 2.69Å; L17-F21 WeakPolarHBondContact O-CD2 3.2Å; L17-F21 PolarHBondContact O-N 3.4Å |
| 18 | R | 93.3 | Very high | 95.3 | Very high | 131 Ų | 131 | 107 Ų | 107 | 49% | 0.494 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -60.6 | -44.6 | 175 | -168.9 | -176.1 | -172.1 | -159.9 | 9 | 110.9 | R15 A20 F21 L22 D499 | R15-R18 PolarHBondContact O-N 3.23Å; R18-A20 PolarHBondContact O-N 2.78Å; R18-F21 PolarHBondContact O-N 2.65Å; R18-L22 HydrophobicContact CG-CD1 4.36Å; R18-L22 WeakPolarHBondContact O-CG 3.31Å; R18-L22 PolarHBondContact O-N 2.86Å; R18-D499 IonicContact CZ-OD2 3.65Å; R18-D499 VanDerWaalsContact NH1-CG 3.3Å; R18-D499 IonicContact NH1-OD1 2.64Å; R18-D499 PolarHBondContact NH1-OD1 3.35Å; R18-D499 IonicContact NH1-OD2 3.87Å; R18-D499 PolarHBondContact NH1-OD2 2.92Å; R18-D499 IonicContact NH2-OD2 2.76Å; R18-D499 PolarHBondContact NH2-OD2 3.22Å |
| 19 | L | 95.3 | Very high | 95.7 | Very high | 105 Ų | 105 | 103.8 Ų | 103.8 | 55% | 0.55 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -63.6 | -39.2 | 176.8 | -66.7 | 171.3 | 0 | 0 | 0 | 112.4 | R15 F16 L17 Q23 | R15-L19 WeakPolarHBondContact O-CG 3.08Å; R15-L19 PolarHBondContact O-N 3.01Å; F16-L19 PolarHBondContact O-N 2.73Å; L17-L19 VanDerWaalsContact C-N 3.35Å; L17-L19 PolarHBondContact O-N 3.05Å; L19-Q23 PolarHBondContact O-N 2.88Å; L19-Q23 VanDerWaalsContact O-N 3.1Å |
| 20 | A | 95.9 | Very high | 95.9 | Very high | 37 Ų | 37 | 98.2 Ų | 98.2 | 31% | 0.306 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -64.4 | -43.4 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | F16 L17 R18 Q23 L24 | F16-A20 WeakPolarHBondContact O-CB 3.49Å; F16-A20 PolarHBondContact O-N 2.97Å; L17-A20 PolarHBondContact O-N 2.69Å; R18-A20 PolarHBondContact O-N 2.78Å; A20-Q23 PolarHBondContact O-N 2.79Å; A20-L24 WeakPolarHBondContact O-CG 3.31Å; A20-L24 PolarHBondContact O-N 3.16Å |
| 21 | F | 95.9 | Very high | 96 | Very high | 59 Ų | 59 | 95.3 Ų | 95.3 | 26% | 0.259 | 45% | 0.452 | S | S | . | . | H | α-helix | trans | -65.8 | -39.9 | 176.8 | -93.7 | -100.8 | 0 | 0 | 0 | 112.9 | L17 R18 Q23 L24 H25 I51 Y55 | L17-F21 WeakPolarHBondContact O-CD2 3.2Å; L17-F21 PolarHBondContact O-N 3.4Å; R18-F21 PolarHBondContact O-N 2.65Å; F21-Q23 VanDerWaalsContact C-N 3.3Å; F21-Q23 PolarHBondContact O-N 2.71Å; F21-L24 PolarHBondContact O-N 3.31Å; F21-H25 PolarHBondContact O-N 2.57Å; F21-I51 HydrophobicContact CE1-CD1 4.07Å; F21-I51 HydrophobicContact CZ-CD1 4.08Å; F21-Y55 HydrophobicContact CE1-CE2 4.08Å; F21-Y55 HydrophobicContact CZ-CE2 4.3Å |
| 22 | L | 96.1 | Very high | 96.1 | Very high | 98 Ų | 98 | 89.4 Ų | 89.4 | 51% | 0.513 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -59.2 | -41 | 172 | -71.6 | 168.3 | 0 | 0 | 0 | 111.9 | R18 H25 H26 | R18-L22 HydrophobicContact CG-CD1 4.36Å; R18-L22 WeakPolarHBondContact O-CG 3.31Å; R18-L22 PolarHBondContact O-N 2.86Å; L22-H25 WeakPolarHBondContact O-CB 3.26Å; L22-H25 PolarHBondContact O-N 3.24Å; L22-H26 PolarHBondContact O-N 3.46Å; L22-H26 VanDerWaalsContact O-N 3.11Å |
| 23 | Q | 97.8 | Very high | 96 | Very high | 103 Ų | 103 | 87 Ų | 87 | 48% | 0.481 | 43% | 0.431 | S | S | . | . | H | α-helix | trans | -68.8 | -36 | 176.9 | -172.9 | 58.4 | 75.8 | 0 | 0 | 112.8 | L19 A20 F21 Q27 | L19-Q23 PolarHBondContact O-N 2.88Å; L19-Q23 VanDerWaalsContact O-N 3.1Å; A20-Q23 PolarHBondContact O-N 2.79Å; F21-Q23 VanDerWaalsContact C-N 3.3Å; F21-Q23 PolarHBondContact O-N 2.71Å; Q23-Q27 WeakPolarHBondContact O-CG 3.43Å; Q23-Q27 PolarHBondContact O-N 3.12Å |
| 24 | L | 97.9 | Very high | 96.1 | Very high | 44 Ų | 44 | 84.1 Ų | 84.1 | 23% | 0.23 | 42% | 0.416 | C | S | . | . | H | α-helix | trans | -68.3 | -35.5 | 174 | -73.2 | 162.3 | 0 | 0 | 0 | 112 | A20 F21 Q27 Q28 I51 Y94 | A20-L24 WeakPolarHBondContact O-CG 3.31Å; A20-L24 PolarHBondContact O-N 3.16Å; F21-L24 PolarHBondContact O-N 3.31Å; L24-Q27 PolarHBondContact O-N 2.71Å; L24-Q28 WeakPolarHBondContact O-CB 3.41Å; L24-Q28 PolarHBondContact O-N 2.83Å; L24-I51 HydrophobicContact CD1-CD1 4.25Å; L24-Y94 HydrophobicContact CB-CD1 4.13Å; L24-Y94 HydrophobicContact CB-CE1 4.16Å |
| 25 | H | 97.7 | Very high | 96.1 | Very high | 24 Ų | 24 | 81.7 Ų | 81.7 | 11% | 0.111 | 40% | 0.396 | C | S | . | . | H | α-helix | trans | -62.7 | -48.8 | 172.8 | -165.7 | -175.1 | 0 | 0 | 0 | 110.9 | F21 L22 Q27 Q28 Q29 Y94 T95 | F21-H25 PolarHBondContact O-N 2.57Å; L22-H25 WeakPolarHBondContact O-CB 3.26Å; L22-H25 PolarHBondContact O-N 3.24Å; H25-Q27 VanDerWaalsContact C-N 3.3Å; H25-Q27 PolarHBondContact O-N 3.29Å; H25-Q28 WeakPolarHBondContact O-CB 3.23Å; H25-Q28 PolarHBondContact O-N 2.85Å; H25-Q28 VanDerWaalsContact O-N 3.09Å; H25-Q29 PolarHBondContact CD2-NE2 3.11Å; H25-Q29 PolarHBondContact CE1-NE2 3.47Å; H25-Q29 VanDerWaalsContact CE1-NE2 3.34Å; H25-Q29 PolarHBondContact NE2-NE2 2.9Å; H25-Q29 WeakPolarHBondContact O-CG 3.22Å; H25-Q29 PolarHBondContact O-N 3.48Å; H25-Y94 HydrophobicContact CB-CD1 4.39Å; H25-Y94 HydrophobicContact CB-CG 4.29Å; H25-T95 VanDerWaalsContact CE1-CG2 3.4Å; H25-T95 WeakPolarHBondContact CE1-CG2 3.35Å |
| 26 | H | 97.9 | Very high | 96.2 | Very high | 115 Ų | 115 | 74.9 Ų | 74.9 | 53% | 0.532 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -59.2 | -40.3 | 175.3 | 177.8 | -71.5 | 0 | 0 | 0 | 112.1 | L22 Q28 Q29 S30 | L22-H26 PolarHBondContact O-N 3.46Å; L22-H26 VanDerWaalsContact O-N 3.11Å; H26-Q28 VanDerWaalsContact C-N 3.34Å; H26-Q29 PolarHBondContact O-N 3.07Å; H26-S30 PolarHBondContact O-N 3.34Å; H26-S30 VanDerWaalsContact O-N 3.14Å; H26-S30 PolarHBondContact O-OG 2.91Å |
| 27 | Q | 98.2 | Very high | 96.4 | Very high | 41 Ų | 41 | 70.7 Ų | 70.7 | 19% | 0.192 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -61.9 | -42.1 | 174.5 | -76.2 | 170.4 | -1.1 | 0 | 0 | 111.5 | Q23 L24 H25 S30 D31 V32 F33 | Q23-Q27 WeakPolarHBondContact O-CG 3.43Å; Q23-Q27 PolarHBondContact O-N 3.12Å; L24-Q27 PolarHBondContact O-N 2.71Å; H25-Q27 VanDerWaalsContact C-N 3.3Å; H25-Q27 PolarHBondContact O-N 3.29Å; Q27-S30 PolarHBondContact O-N 2.81Å; Q27-S30 PolarHBondContact O-OG 3.11Å; Q27-D31 PolarHBondContact O-N 3.25Å; Q27-D31 VanDerWaalsContact O-N 3.16Å; Q27-V32 HydrophobicContact CG-CG1 4.48Å; Q27-V32 PolarHBondContact O-N 3.08Å; Q27-F33 HydrophobicContact CG-CD2 4.36Å |
| 28 | Q | 97.9 | Very high | 96.6 | Very high | 9 Ų | 9 | 64.8 Ų | 64.8 | 4% | 0.042 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -63.7 | -46.9 | 175.8 | -179.3 | -85.1 | -16.7 | 0 | 0 | 112.7 | L24 H25 H26 S30 D31 P46 Y94 | L24-Q28 WeakPolarHBondContact O-CB 3.41Å; L24-Q28 PolarHBondContact O-N 2.83Å; H25-Q28 WeakPolarHBondContact O-CB 3.23Å; H25-Q28 PolarHBondContact O-N 2.85Å; H25-Q28 VanDerWaalsContact O-N 3.09Å; H26-Q28 VanDerWaalsContact C-N 3.34Å; Q28-S30 PolarHBondContact O-N 3.45Å; Q28-D31 PolarHBondContact O-N 2.69Å; Q28-D31 VanDerWaalsContact O-N 3.1Å; Q28-P46 WeakPolarHBondContact CG-O 3.27Å; Q28-P46 PolarHBondContact NE2-O 3.15Å; Q28-P46 WeakPolarHBondContact O-CG 3.21Å; Q28-Y94 HydrophobicContact CB-CE1 4.11Å; Q28-Y94 HydrophobicContact CB-CE2 4.04Å; Q28-Y94 HydrophobicContact CG-CD2 4.39Å; Q28-Y94 HydrophobicContact CG-CE2 3.69Å |
| 29 | Q | 97.4 | Very high | 96.8 | Very high | 130 Ų | 130 | 61.7 Ų | 61.7 | 61% | 0.607 | 32% | 0.315 | S | S | * | . | H | α-helix | trans | -62.4 | -26.9 | 178.4 | -70.3 | 179.7 | -5.7 | 0 | 0 | 113.1 | H25 H26 | H25-Q29 PolarHBondContact CD2-NE2 3.11Å; H25-Q29 PolarHBondContact CE1-NE2 3.47Å; H25-Q29 VanDerWaalsContact CE1-NE2 3.34Å; H25-Q29 PolarHBondContact NE2-NE2 2.9Å; H25-Q29 WeakPolarHBondContact O-CG 3.22Å; H25-Q29 PolarHBondContact O-N 3.48Å; H26-Q29 PolarHBondContact O-N 3.07Å |
| 30 | S | 97.4 | Very high | 96.9 | Very high | 56 Ų | 56 | 56.9 Ų | 56.9 | 39% | 0.392 | 29% | 0.29 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -96.5 | 5 | 178 | 52.8 | 0 | 0 | 0 | 0 | 114.4 | H26 Q27 Q28 V32 | H26-S30 PolarHBondContact O-N 3.34Å; H26-S30 VanDerWaalsContact O-N 3.14Å; H26-S30 PolarHBondContact O-OG 2.91Å; Q27-S30 PolarHBondContact O-N 2.81Å; Q27-S30 PolarHBondContact O-OG 3.11Å; Q28-S30 PolarHBondContact O-N 3.45Å; S30-V32 PolarHBondContact O-N 3.47Å; S30-V32 VanDerWaalsContact O-N 3.15Å; S30-V32 WeakPolarHBondContact OG-CG2 3.48Å |
| 31 | D | 96.8 | Very high | 96.8 | Very high | 70 Ų | 70 | 61.5 Ų | 61.5 | 37% | 0.374 | 31% | 0.305 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 54.8 | 22.3 | -173.8 | -166 | 33.8 | 0 | 0 | 0 | 114.6 | Q27 Q28 C34 P46 K73 | Q27-D31 PolarHBondContact O-N 3.25Å; Q27-D31 VanDerWaalsContact O-N 3.16Å; Q28-D31 PolarHBondContact O-N 2.69Å; Q28-D31 VanDerWaalsContact O-N 3.1Å; D31-C34 WeakPolarHBondContact OD1-CB 3.46Å; D31-P46 HydrophobicContact CB-CB 4.19Å; D31-P46 HydrophobicContact CB-CG 4.18Å; D31-P46 WeakPolarHBondContact OD1-CB 3.48Å; D31-K73 PolarHBondContact O-NZ 2.85Å; D31-K73 IonicContact OD1-NZ 3.18Å; D31-K73 PolarHBondContact OD1-NZ 3.2Å; D31-K73 IonicContact OD2-NZ 3.18Å; D31-K73 PolarHBondContact OD2-NZ 2.88Å |
| 32 | V | 96.3 | Very high | 96.7 | Very high | 62 Ų | 62 | 61.4 Ų | 61.4 | 38% | 0.376 | 32% | 0.321 | S | S | . | . | trans | -85.2 | 132.7 | 179.5 | 176.1 | 0 | 0 | 0 | 0 | 109.4 | Q27 S30 C34 H48 | Q27-V32 HydrophobicContact CG-CG1 4.48Å; Q27-V32 PolarHBondContact O-N 3.08Å; S30-V32 PolarHBondContact O-N 3.47Å; S30-V32 VanDerWaalsContact O-N 3.15Å; S30-V32 WeakPolarHBondContact OG-CG2 3.48Å; V32-C34 PolarHBondContact O-N 3.17Å; V32-H48 PolarHBondContact O-NE2 2.88Å | ||
| 33 | F | 95.4 | Very high | 96.7 | Very high | 157 Ų | 157 | 61 Ų | 61 | 69% | 0.689 | 32% | 0.317 | S | S | * | . | S | Bend | trans | 56.6 | -0.9 | -176.1 | -52.2 | -50.1 | 0 | 0 | 0 | 117 | Q27 D35 H48 | Q27-F33 HydrophobicContact CG-CD2 4.36Å; F33-D35 PolarHBondContact O-N 2.92Å; F33-H48 PolarHBondContact O-CD2 3.02Å |
| 34 | C | 96.1 | Very high | 96.6 | Very high | 5 Ų | 5 | 58.5 Ų | 58.5 | 3% | 0.034 | 31% | 0.314 | C | S | . | . | trans | -61.3 | 125.4 | 172.8 | -71.7 | 0 | 0 | 0 | 0 | 111.2 | D31 V32 P46 A47 K73 | D31-C34 WeakPolarHBondContact OD1-CB 3.46Å; V32-C34 PolarHBondContact O-N 3.17Å; C34-P46 HydrophobicContact CB-CB 4.01Å; C34-A47 WeakPolarHBondContact CA-O 3.47Å; C34-A47 VanDerWaalsContact CB-O 3.29Å; C34-A47 WeakPolarHBondContact CB-O 3.45Å; C34-K73 VanDerWaalsContact O-CD 3.27Å; C34-K73 WeakPolarHBondContact O-CD 3.38Å; C34-K73 WeakPolarHBondContact O-CE 3.47Å; C34-K73 PolarHBondContact O-NZ 2.9Å | ||
| 35 | D | 94.9 | Very high | 96.6 | Very high | 69 Ų | 69 | 56.7 Ų | 56.7 | 37% | 0.369 | 30% | 0.304 | S | S | . | . | trans | -107.4 | -4.4 | -176.3 | 57.3 | 2.4 | 0 | 0 | 0 | 112.5 | F33 A47 H48 C49 K73 V74 | F33-D35 PolarHBondContact O-N 2.92Å; D35-A47 PolarHBondContact N-O 2.92Å; D35-H48 WeakPolarHBondContact OD1-CA 3.45Å; D35-C49 PolarHBondContact OD1-N 2.9Å; D35-C49 PolarHBondContact OD1-SG 3.09Å; D35-C49 WeakPolarHBondContact OD2-CB 3.46Å; D35-K73 CarbonylContact O-C 3.54Å; D35-K73 WeakPolarHBondContact O-CA 3.21Å; D35-V74 PolarHBondContact O-N 3.08Å | ||
| 36 | V | 96.3 | Very high | 96.6 | Very high | 0 Ų | 0 | 56.8 Ų | 56.8 | 0% | 0 | 31% | 0.307 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -135.4 | 145.3 | 175.7 | 55.4 | 0 | 0 | 0 | 0 | 112.4 | L38 A47 L52 L63 V74 L76 | V36-L38 HydrophobicContact CG2-CD2 3.91Å; V36-A47 HydrophobicContact CG1-CB 4.1Å; V36-A47 VanDerWaalsContact CG1-O 3.24Å; V36-A47 WeakPolarHBondContact CG1-O 3.33Å; V36-A47 PolarHBondContact N-O 3.16Å; V36-A47 PolarHBondContact O-N 3.21Å; V36-L52 HydrophobicContact CG1-CD1 3.77Å; V36-L63 HydrophobicContact CB-CD2 4.49Å; V36-L63 HydrophobicContact CG2-CD2 4.21Å; V36-V74 CarbonylContact C-O 3.54Å; V36-V74 WeakPolarHBondContact CA-O 3.46Å; V36-V74 HydrophobicContact CB-CB 4.31Å; V36-V74 HydrophobicContact CG2-CB 4.24Å; V36-L76 HydrophobicContact CG2-CD1 3.98Å; V36-L76 HydrophobicContact CG2-CG 3.83Å |
| 37 | L | 96.6 | Very high | 96.6 | Very high | 46 Ų | 46 | 51.3 Ų | 51.3 | 24% | 0.241 | 28% | 0.282 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -115.5 | 122.2 | 170.1 | -60 | 177.3 | 0 | 0 | 0 | 109 | P46 K73 V74 V75 L76 | L37-P46 HydrophobicContact CD2-CB 4Å; L37-K73 HydrophobicContact CD1-CB 4.49Å; L37-K73 HydrophobicContact CD1-CD 4.43Å; L37-K73 HydrophobicContact CD2-CD 4.03Å; L37-K73 HydrophobicContact CG-CB 4.18Å; L37-K73 HydrophobicContact CG-CD 4.06Å; L37-V74 PolarHBondContact N-O 3.49Å; L37-V75 WeakPolarHBondContact O-CA 3.49Å; L37-L76 PolarHBondContact O-N 3.33Å |
| 38 | L | 97.6 | Very high | 96.6 | Very high | 0 Ų | 0 | 49.8 Ų | 49.8 | 0% | 0 | 28% | 0.275 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -94 | 116.8 | 174.7 | -55.8 | -174.4 | 0 | 0 | 0 | 109.2 | V36 A44 V45 L52 F59 L76 L78 L86 V90 | V36-L38 HydrophobicContact CG2-CD2 3.91Å; L38-A44 CarbonylContact O-C 3.49Å; L38-A44 WeakPolarHBondContact O-CA 3.39Å; L38-V45 PolarHBondContact N-O 2.81Å; L38-V45 PolarHBondContact O-N 2.89Å; L38-L52 HydrophobicContact CD1-CD1 3.91Å; L38-L52 HydrophobicContact CD1-CD2 4.18Å; L38-L52 HydrophobicContact CD2-CD1 3.75Å; L38-L52 HydrophobicContact CG-CD1 4.14Å; L38-F59 HydrophobicContact CD1-CE1 4.22Å; L38-F59 HydrophobicContact CD1-CZ 3.85Å; L38-F59 HydrophobicContact CD2-CD1 4.41Å; L38-F59 HydrophobicContact CD2-CE1 3.74Å; L38-F59 HydrophobicContact CD2-CZ 4.23Å; L38-L76 HydrophobicContact CD2-CB 3.77Å; L38-L76 HydrophobicContact CD2-CD1 3.72Å; L38-L76 HydrophobicContact CD2-CG 4.09Å; L38-L78 HydrophobicContact CB-CD1 4.11Å; L38-L78 HydrophobicContact CD1-CD1 4.42Å; L38-L78 HydrophobicContact CD2-CD1 4.39Å; L38-L86 HydrophobicContact CB-CD1 4.4Å; L38-L86 HydrophobicContact CB-CD2 3.93Å; L38-L86 HydrophobicContact CD1-CD1 4.06Å; L38-V90 HydrophobicContact CD1-CG2 3.82Å |
| 39 | Q | 97 | Very high | 96.5 | Very high | 66 Ų | 66 | 50.5 Ų | 50.5 | 31% | 0.308 | 28% | 0.28 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -104.7 | 127.6 | -174.8 | -163.3 | 177.4 | 16.2 | 0 | 0 | 111.8 | G42 E43 L76 L78 | Q39-G42 PolarHBondContact NE2-O 2.61Å; Q39-E43 CarbonylContact C-O 3.58Å; Q39-E43 VanDerWaalsContact CA-O 3.31Å; Q39-E43 WeakPolarHBondContact CA-O 3.32Å; Q39-E43 VanDerWaalsContact CG-O 3.26Å; Q39-E43 WeakPolarHBondContact CG-O 3.49Å; Q39-L76 PolarHBondContact N-O 3.29Å; Q39-L78 PolarHBondContact O-N 3.36Å |
| 40 | A | 96.9 | Very high | 96.4 | Very high | 4 Ų | 4 | 48.4 Ų | 48.4 | 3% | 0.033 | 28% | 0.279 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -146 | 140.5 | 175.6 | 0 | 0 | 0 | 0 | 0 | 110.3 | G42 E43 I83 L86 | A40-G42 PolarHBondContact O-N 2.95Å; A40-E43 PolarHBondContact N-O 2.67Å; A40-E43 PolarHBondContact O-N 2.83Å; A40-E43 VanDerWaalsContact O-O 3.06Å; A40-I83 HydrophobicContact CB-CD1 4.38Å; A40-L86 HydrophobicContact CB-CB 4.45Å; A40-L86 HydrophobicContact CB-CD2 3.63Å |
| 41 | E | 95.3 | Very high | 96.4 | Very high | 133 Ų | 133 | 46.4 Ų | 46.4 | 62% | 0.621 | 26% | 0.264 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 52 | 21.7 | -176.9 | -65 | 178.9 | 139.2 | 0 | 0 | 115 | E43 K82 I83 | E41-E43 VanDerWaalsContact C-N 3.33Å; E41-K82 VanDerWaalsContact OE2-CA 3.23Å; E41-K82 WeakPolarHBondContact OE2-CA 3.35Å; E41-I83 PolarHBondContact OE2-N 3.38Å |
| 42 | G | 92.6 | Very high | 96.4 | Very high | 58 Ų | 58 | 43 Ų | 43 | 60% | 0.598 | 25% | 0.246 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 92.4 | -24.6 | -177 | 0 | 0 | 0 | 0 | 0 | 114.2 | Q39 A40 | Q39-G42 PolarHBondContact NE2-O 2.61Å; A40-G42 PolarHBondContact O-N 2.95Å |
| 43 | E | 96.9 | Very high | 96.4 | Very high | 90 Ų | 90 | 42 Ų | 42 | 42% | 0.421 | 24% | 0.241 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -77 | 158 | 172.8 | -73.4 | -173.4 | -123.4 | 0 | 0 | 112 | Q39 A40 E41 I83 R87 | Q39-E43 CarbonylContact C-O 3.58Å; Q39-E43 VanDerWaalsContact CA-O 3.31Å; Q39-E43 WeakPolarHBondContact CA-O 3.32Å; Q39-E43 VanDerWaalsContact CG-O 3.26Å; Q39-E43 WeakPolarHBondContact CG-O 3.49Å; A40-E43 PolarHBondContact N-O 2.67Å; A40-E43 PolarHBondContact O-N 2.83Å; A40-E43 VanDerWaalsContact O-O 3.06Å; E41-E43 VanDerWaalsContact C-N 3.33Å; E43-I83 HydrophobicContact CB-CB 4.41Å; E43-I83 HydrophobicContact CB-CD1 3.67Å; E43-I83 HydrophobicContact CB-CG1 3.68Å; E43-I83 HydrophobicContact CG-CG1 4.38Å; E43-R87 IonicContact OE2-CZ 2.7Å; E43-R87 IonicContact OE2-NH1 2.61Å; E43-R87 PolarHBondContact OE2-NH1 3.25Å; E43-R87 IonicContact OE2-NH2 2.73Å; E43-R87 PolarHBondContact OE2-NH2 3.47Å |
| 44 | A | 96.3 | Very high | 96.4 | Very high | 50 Ų | 50 | 38 Ų | 38 | 41% | 0.413 | 24% | 0.237 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -124 | 142.4 | 178.3 | 0 | 0 | 0 | 0 | 0 | 111.9 | L38 | L38-A44 CarbonylContact O-C 3.49Å; L38-A44 WeakPolarHBondContact O-CA 3.39Å |
| 45 | V | 97.9 | Very high | 96.4 | Very high | 5 Ų | 5 | 41.8 Ų | 41.8 | 3% | 0.03 | 25% | 0.251 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -115.8 | 122.3 | 173.9 | -172.9 | 0 | 0 | 0 | 0 | 108.6 | L38 I83 L86 R87 V90 | L38-V45 PolarHBondContact N-O 2.81Å; L38-V45 PolarHBondContact O-N 2.89Å; V45-I83 HydrophobicContact CG2-CD1 3.61Å; V45-L86 HydrophobicContact CG2-CD2 4.04Å; V45-L86 HydrophobicContact CG2-CG 4.18Å; V45-R87 HydrophobicContact CG2-CG 3.85Å; V45-V90 HydrophobicContact CG1-CB 4.22Å; V45-V90 HydrophobicContact CG1-CG1 4.03Å; V45-V90 HydrophobicContact CG1-CG2 4.09Å |
| 46 | P | 97.6 | Very high | 96.5 | Very high | 27 Ų | 27 | 38.6 Ų | 38.6 | 18% | 0.175 | 23% | 0.234 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -73.8 | 149.7 | 175.6 | 32.7 | -36.3 | 0 | 0 | 0 | 111.6 | Q28 D31 C34 L37 | Q28-P46 WeakPolarHBondContact CG-O 3.27Å; Q28-P46 PolarHBondContact NE2-O 3.15Å; Q28-P46 WeakPolarHBondContact O-CG 3.21Å; D31-P46 HydrophobicContact CB-CB 4.19Å; D31-P46 HydrophobicContact CB-CG 4.18Å; D31-P46 WeakPolarHBondContact OD1-CB 3.48Å; C34-P46 HydrophobicContact CB-CB 4.01Å; L37-P46 HydrophobicContact CD2-CB 4Å |
| 47 | A | 98 | Very high | 96.5 | Very high | 0 Ų | 0 | 41.2 Ų | 41.2 | 0% | 0 | 25% | 0.251 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -158.7 | 175 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | C34 D35 V36 L52 | C34-A47 WeakPolarHBondContact CA-O 3.47Å; C34-A47 VanDerWaalsContact CB-O 3.29Å; C34-A47 WeakPolarHBondContact CB-O 3.45Å; D35-A47 PolarHBondContact N-O 2.92Å; V36-A47 HydrophobicContact CG1-CB 4.1Å; V36-A47 VanDerWaalsContact CG1-O 3.24Å; V36-A47 WeakPolarHBondContact CG1-O 3.33Å; V36-A47 PolarHBondContact N-O 3.16Å; V36-A47 PolarHBondContact O-N 3.21Å; A47-L52 HydrophobicContact CB-CD1 4.08Å; A47-L52 HydrophobicContact CB-CD2 4.09Å; A47-L52 HydrophobicContact CB-CG 4.12Å |
| 48 | H | 97.3 | Very high | 96.5 | Very high | 9 Ų | 9 | 41.4 Ų | 41.4 | 4% | 0.042 | 25% | 0.25 | C | S | . | . | trans | -104.5 | 127.6 | 173.7 | -54.2 | 94.7 | 0 | 0 | 0 | 110.7 | V32 F33 D35 C50 I51 L52 Y94 | V32-H48 PolarHBondContact O-NE2 2.88Å; F33-H48 PolarHBondContact O-CD2 3.02Å; D35-H48 WeakPolarHBondContact OD1-CA 3.45Å; H48-C50 VanDerWaalsContact C-N 3.25Å; H48-C50 PolarHBondContact O-N 3.09Å; H48-I51 HydrophobicContact CB-CB 4.48Å; H48-I51 HydrophobicContact CB-CG1 4.13Å; H48-I51 PolarHBondContact O-N 3.1Å; H48-I51 VanDerWaalsContact O-N 3.09Å; H48-L52 PolarHBondContact O-N 3.35Å; H48-L52 VanDerWaalsContact O-N 3.14Å; H48-Y94 PolarHBondContact N-OH 2.88Å; H48-Y94 VanDerWaalsContact N-OH 3.11Å; H48-Y94 AromaticContact ND1-CE1 3.73Å; H48-Y94 AromaticContact ND1-CZ 3.74Å; H48-Y94 PolarHBondContact ND1-OH 3.1Å | ||
| 49 | C | 95.9 | Very high | 96.5 | Very high | 24 Ų | 24 | 41.6 Ų | 41.6 | 16% | 0.162 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -54.6 | -40.7 | -179.4 | -72.3 | 0 | 0 | 0 | 0 | 112.3 | D35 I51 L52 S53 L63 | D35-C49 PolarHBondContact OD1-N 2.9Å; D35-C49 PolarHBondContact OD1-SG 3.09Å; D35-C49 WeakPolarHBondContact OD2-CB 3.46Å; C49-I51 VanDerWaalsContact C-N 3.33Å; C49-I51 PolarHBondContact O-N 3.22Å; C49-L52 PolarHBondContact O-N 3.14Å; C49-S53 WeakPolarHBondContact O-CB 2.99Å; C49-S53 PolarHBondContact O-N 3.48Å; C49-S53 PolarHBondContact O-OG 2.89Å; C49-S53 VanDerWaalsContact O-OG 3.12Å; C49-L63 HydrophobicContact CB-CD1 3.84Å; C49-L63 VanDerWaalsContact SG-CD2 3.6Å |
| 50 | C | 96 | Very high | 96.4 | Very high | 86 Ų | 86 | 40.3 Ų | 40.3 | 58% | 0.581 | 25% | 0.248 | S | C | * | . | H | α-helix | trans | -63.2 | -35.4 | 179.9 | 57.7 | 0 | 0 | 0 | 0 | 113.3 | H48 A54 | H48-C50 VanDerWaalsContact C-N 3.25Å; H48-C50 PolarHBondContact O-N 3.09Å; C50-A54 VanDerWaalsContact O-CB 3.29Å; C50-A54 WeakPolarHBondContact O-CB 3.43Å; C50-A54 PolarHBondContact O-N 2.92Å |
| 51 | I | 97.1 | Very high | 96.3 | Very high | 13 Ų | 13 | 44.2 Ų | 44.2 | 7% | 0.067 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -74.5 | -46.6 | 176.6 | -60.2 | -59.6 | 0 | 0 | 0 | 109.9 | F21 L24 H48 C49 S53 A54 Y55 L93 Y94 | F21-I51 HydrophobicContact CE1-CD1 4.07Å; F21-I51 HydrophobicContact CZ-CD1 4.08Å; L24-I51 HydrophobicContact CD1-CD1 4.25Å; H48-I51 HydrophobicContact CB-CB 4.48Å; H48-I51 HydrophobicContact CB-CG1 4.13Å; H48-I51 PolarHBondContact O-N 3.1Å; H48-I51 VanDerWaalsContact O-N 3.09Å; C49-I51 VanDerWaalsContact C-N 3.33Å; C49-I51 PolarHBondContact O-N 3.22Å; I51-S53 PolarHBondContact O-N 3.35Å; I51-A54 PolarHBondContact O-N 2.82Å; I51-Y55 HydrophobicContact CG2-CD2 4.24Å; I51-Y55 HydrophobicContact CG2-CE2 4.32Å; I51-Y55 WeakPolarHBondContact O-CD2 3.29Å; I51-Y55 PolarHBondContact O-N 2.9Å; I51-L93 HydrophobicContact CG2-CB 4.2Å; I51-Y94 HydrophobicContact CB-CE1 4.3Å; I51-Y94 HydrophobicContact CG1-CE1 3.91Å; I51-Y94 HydrophobicContact CG2-CD1 4.46Å; I51-Y94 HydrophobicContact CG2-CE1 4.06Å; I51-Y94 HydrophobicContact CG2-CE2 4.4Å |
| 52 | L | 97 | Very high | 96.3 | Very high | 0 Ų | 0 | 40.6 Ų | 40.6 | 0% | 0 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -58.2 | -49.2 | 178.5 | -62.9 | -171.2 | 0 | 0 | 0 | 112.1 | V36 L38 A47 H48 C49 A54 Y55 S56 F59 L63 L93 | V36-L52 HydrophobicContact CG1-CD1 3.77Å; L38-L52 HydrophobicContact CD1-CD1 3.91Å; L38-L52 HydrophobicContact CD1-CD2 4.18Å; L38-L52 HydrophobicContact CD2-CD1 3.75Å; L38-L52 HydrophobicContact CG-CD1 4.14Å; A47-L52 HydrophobicContact CB-CD1 4.08Å; A47-L52 HydrophobicContact CB-CD2 4.09Å; A47-L52 HydrophobicContact CB-CG 4.12Å; H48-L52 PolarHBondContact O-N 3.35Å; H48-L52 VanDerWaalsContact O-N 3.14Å; C49-L52 PolarHBondContact O-N 3.14Å; L52-A54 VanDerWaalsContact C-N 3.3Å; L52-A54 PolarHBondContact O-N 2.93Å; L52-Y55 PolarHBondContact O-N 3.16Å; L52-S56 WeakPolarHBondContact O-CB 3.45Å; L52-S56 PolarHBondContact O-N 2.84Å; L52-F59 HydrophobicContact CB-CB 3.72Å; L52-F59 HydrophobicContact CB-CD2 3.74Å; L52-F59 HydrophobicContact CB-CG 3.81Å; L52-F59 HydrophobicContact CD1-CD1 4.19Å; L52-F59 HydrophobicContact CD1-CD2 4.26Å; L52-F59 HydrophobicContact CD1-CE1 4.41Å; L52-F59 HydrophobicContact CD1-CE2 4.49Å; L52-F59 HydrophobicContact CD1-CG 4.13Å; L52-F59 HydrophobicContact CD2-CD2 4.1Å; L52-F59 HydrophobicContact CD2-CE2 4.1Å; L52-F59 HydrophobicContact CG-CD2 4.25Å; L52-F59 HydrophobicContact CG-CG 4.46Å; L52-L63 HydrophobicContact CB-CD1 4.48Å; L52-L93 HydrophobicContact CD2-CD1 3.68Å |
| 53 | S | 96.3 | Very high | 96.3 | Very high | 40 Ų | 40 | 39 Ų | 39 | 28% | 0.28 | 22% | 0.223 | S | C | . | . | H | α-helix | trans | -67.4 | -25.7 | 179.5 | -62.1 | 0 | 0 | 0 | 0 | 113.9 | C49 I51 T60 | C49-S53 WeakPolarHBondContact O-CB 2.99Å; C49-S53 PolarHBondContact O-N 3.48Å; C49-S53 PolarHBondContact O-OG 2.89Å; C49-S53 VanDerWaalsContact O-OG 3.12Å; I51-S53 PolarHBondContact O-N 3.35Å; S53-T60 VanDerWaalsContact CA-OG1 3.3Å; S53-T60 WeakPolarHBondContact CA-OG1 3.44Å; S53-T60 VanDerWaalsContact CB-OG1 3.27Å; S53-T60 WeakPolarHBondContact CB-OG1 2.99Å; S53-T60 PolarHBondContact O-OG1 3.29Å; S53-T60 VanDerWaalsContact O-OG1 3.12Å |
| 54 | A | 95.9 | Very high | 96 | Very high | 72 Ų | 72 | 41.9 Ų | 41.9 | 60% | 0.595 | 24% | 0.237 | S | C | * | . | H | α-helix | trans | -71 | -29.6 | 177.4 | 0 | 0 | 0 | 0 | 0 | 113.1 | C50 I51 L52 | C50-A54 VanDerWaalsContact O-CB 3.29Å; C50-A54 WeakPolarHBondContact O-CB 3.43Å; C50-A54 PolarHBondContact O-N 2.92Å; I51-A54 PolarHBondContact O-N 2.82Å; L52-A54 VanDerWaalsContact C-N 3.3Å; L52-A54 PolarHBondContact O-N 2.93Å |
| 55 | Y | 95.7 | Very high | 95.7 | Very high | 86 Ų | 86 | 48 Ų | 48 | 34% | 0.337 | 25% | 0.249 | S | C | . | . | H | α-helix | trans | -109.6 | -12 | -176.7 | -66.6 | -76.1 | 0 | 0 | 0 | 114.4 | F21 I51 L52 L93 S118 | F21-Y55 HydrophobicContact CE1-CE2 4.08Å; F21-Y55 HydrophobicContact CZ-CE2 4.3Å; I51-Y55 HydrophobicContact CG2-CD2 4.24Å; I51-Y55 HydrophobicContact CG2-CE2 4.32Å; I51-Y55 WeakPolarHBondContact O-CD2 3.29Å; I51-Y55 PolarHBondContact O-N 2.9Å; L52-Y55 PolarHBondContact O-N 3.16Å; Y55-L93 VanDerWaalsContact CB-CD2 3.45Å; Y55-L93 HydrophobicContact CD2-CD2 4.07Å; Y55-L93 HydrophobicContact CG-CD2 3.79Å; Y55-S118 PolarHBondContact O-N 3.31Å; Y55-S118 PolarHBondContact O-OG 3.32Å; Y55-S118 VanDerWaalsContact O-OG 3.05Å |
| 56 | S | 97.2 | Very high | 95.1 | Very high | 1 Ų | 1 | 51 Ų | 51 | 1% | 0.007 | 26% | 0.263 | C | S | . | . | trans | -139.4 | 113.8 | -176.7 | 170.7 | 0 | 0 | 0 | 0 | 113 | L52 F58 F59 T60 L115 | L52-S56 WeakPolarHBondContact O-CB 3.45Å; L52-S56 PolarHBondContact O-N 2.84Å; S56-F58 PolarHBondContact O-N 3.33Å; S56-F58 WeakPolarHBondContact OG-CB 3.21Å; S56-F58 PolarHBondContact OG-N 3.38Å; S56-F59 PolarHBondContact O-N 3.27Å; S56-F59 PolarHBondContact OG-N 2.96Å; S56-T60 PolarHBondContact O-N 3.32Å; S56-T60 PolarHBondContact O-OG1 2.96Å; S56-L115 WeakPolarHBondContact CB-O 3.44Å; S56-L115 PolarHBondContact OG-O 3.24Å | ||
| 57 | P | 96.4 | Very high | 93.6 | Very high | 56 Ų | 56 | 60.6 Ų | 60.6 | 36% | 0.364 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -61.1 | -25.1 | 167.8 | -23.7 | 35.3 | 0 | 0 | 0 | 113.5 | E61 R116 | P57-E61 WeakPolarHBondContact O-CG 3.49Å; P57-E61 PolarHBondContact O-N 3.34Å; P57-R116 VanDerWaalsContact CD-O 3.28Å; P57-R116 WeakPolarHBondContact CD-O 3.44Å |
| 58 | F | 96.6 | Very high | 92.3 | Very high | 50 Ų | 50 | 64.4 Ų | 64.4 | 22% | 0.219 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -65.2 | -45.4 | 173.8 | 168.8 | -87.9 | 0 | 0 | 0 | 111.4 | S56 R62 L78 L115 R116 | S56-F58 PolarHBondContact O-N 3.33Å; S56-F58 WeakPolarHBondContact OG-CB 3.21Å; S56-F58 PolarHBondContact OG-N 3.38Å; F58-R62 PolarHBondContact O-N 3.48Å; F58-R62 VanDerWaalsContact O-N 3.11Å; F58-L78 HydrophobicContact CE1-CD2 3.83Å; F58-L78 HydrophobicContact CZ-CD2 4.1Å; F58-L115 WeakPolarHBondContact CB-O 3.44Å; F58-L115 HydrophobicContact CD1-CD2 3.65Å; F58-L115 HydrophobicContact CE1-CD2 3.44Å; F58-L115 VanDerWaalsContact CE1-CD2 3.44Å; F58-L115 HydrophobicContact CG-CD2 4.47Å; F58-L115 HydrophobicContact CZ-CD2 4.09Å; F58-R116 HydrophobicContact CB-CB 4.27Å |
| 59 | F | 96.3 | Very high | 91.2 | Very high | 4 Ų | 4 | 66.8 Ų | 66.8 | 2% | 0.018 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -67.2 | -39.8 | 177.2 | -72.4 | -52.3 | 0 | 0 | 0 | 111.4 | L38 L52 S56 E61 R62 L63 L76 L78 L115 | L38-F59 HydrophobicContact CD1-CE1 4.22Å; L38-F59 HydrophobicContact CD1-CZ 3.85Å; L38-F59 HydrophobicContact CD2-CD1 4.41Å; L38-F59 HydrophobicContact CD2-CE1 3.74Å; L38-F59 HydrophobicContact CD2-CZ 4.23Å; L52-F59 HydrophobicContact CB-CB 3.72Å; L52-F59 HydrophobicContact CB-CD2 3.74Å; L52-F59 HydrophobicContact CB-CG 3.81Å; L52-F59 HydrophobicContact CD1-CD1 4.19Å; L52-F59 HydrophobicContact CD1-CD2 4.26Å; L52-F59 HydrophobicContact CD1-CE1 4.41Å; L52-F59 HydrophobicContact CD1-CE2 4.49Å; L52-F59 HydrophobicContact CD1-CG 4.13Å; L52-F59 HydrophobicContact CD2-CD2 4.1Å; L52-F59 HydrophobicContact CD2-CE2 4.1Å; L52-F59 HydrophobicContact CG-CD2 4.25Å; L52-F59 HydrophobicContact CG-CG 4.46Å; S56-F59 PolarHBondContact O-N 3.27Å; S56-F59 PolarHBondContact OG-N 2.96Å; F59-E61 PolarHBondContact O-N 3.45Å; F59-R62 PolarHBondContact O-N 3.15Å; F59-L63 HydrophobicContact CB-CD1 4.28Å; F59-L63 VanDerWaalsContact O-CB 3.24Å; F59-L63 WeakPolarHBondContact O-CB 3.47Å; F59-L63 WeakPolarHBondContact O-CD1 3.44Å; F59-L63 WeakPolarHBondContact O-CG 3.5Å; F59-L63 PolarHBondContact O-N 3.25Å; F59-L76 HydrophobicContact CD1-CD1 3.72Å; F59-L76 HydrophobicContact CE1-CD1 4.07Å; F59-L78 HydrophobicContact CE1-CD1 4.08Å; F59-L78 HydrophobicContact CE1-CD2 4.15Å; F59-L78 HydrophobicContact CZ-CD1 4.05Å; F59-L115 HydrophobicContact CE1-CD2 4.34Å; F59-L115 HydrophobicContact CE2-CD1 4.33Å; F59-L115 HydrophobicContact CZ-CD1 3.99Å; F59-L115 HydrophobicContact CZ-CD2 3.99Å; F59-L115 HydrophobicContact CZ-CG 4.46Å |
| 60 | T | 95.6 | Very high | 90.2 | Very high | 39 Ų | 39 | 75.3 Ų | 75.3 | 24% | 0.239 | 38% | 0.379 | C | S | . | . | H | α-helix | trans | -53.1 | -56.5 | 172.1 | -49.8 | 0 | 0 | 0 | 0 | 111.9 | S53 S56 R62 L63 E64 | S53-T60 VanDerWaalsContact CA-OG1 3.3Å; S53-T60 WeakPolarHBondContact CA-OG1 3.44Å; S53-T60 VanDerWaalsContact CB-OG1 3.27Å; S53-T60 WeakPolarHBondContact CB-OG1 2.99Å; S53-T60 PolarHBondContact O-OG1 3.29Å; S53-T60 VanDerWaalsContact O-OG1 3.12Å; S56-T60 PolarHBondContact O-N 3.32Å; S56-T60 PolarHBondContact O-OG1 2.96Å; T60-R62 VanDerWaalsContact C-N 3.28Å; T60-R62 PolarHBondContact O-N 2.95Å; T60-L63 PolarHBondContact O-N 3.48Å; T60-E64 HydrophobicContact CG2-CG 4.46Å; T60-E64 WeakPolarHBondContact O-CB 3.37Å; T60-E64 WeakPolarHBondContact O-CG 3.4Å; T60-E64 PolarHBondContact O-N 3.06Å |
| 61 | E | 95.4 | Very high | 89.2 | Confident | 86 Ų | 86 | 75.3 Ų | 75.3 | 40% | 0.402 | 39% | 0.394 | S | S | . | . | H | α-helix | trans | -63.1 | -27.5 | -178.7 | -72.8 | 169.7 | -150.7 | 0 | 0 | 114.4 | P57 F59 R116 | P57-E61 WeakPolarHBondContact O-CG 3.49Å; P57-E61 PolarHBondContact O-N 3.34Å; F59-E61 PolarHBondContact O-N 3.45Å; E61-R116 IonicContact OE1-CZ 2.65Å; E61-R116 IonicContact OE1-NH1 2.61Å; E61-R116 PolarHBondContact OE1-NH1 3.12Å; E61-R116 IonicContact OE1-NH2 2.71Å; E61-R116 PolarHBondContact OE1-NH2 3.18Å; E61-R116 IonicContact OE2-CZ 2.78Å; E61-R116 IonicContact OE2-NH1 2.71Å; E61-R116 IonicContact OE2-NH2 2.86Å; E61-R116 PolarHBondContact OE2-NH2 3.49Å |
| 62 | R | 94.4 | Very high | 88.5 | Confident | 57 Ų | 57 | 83.8 Ų | 83.8 | 22% | 0.215 | 43% | 0.425 | C | S | . | . | H | α-helix | trans | -80.9 | -43.5 | 176.5 | -132.7 | -61.2 | -151.6 | 151.5 | 16.3 | 110.8 | F58 F59 T60 R65 E66 L76 | F58-R62 PolarHBondContact O-N 3.48Å; F58-R62 VanDerWaalsContact O-N 3.11Å; F59-R62 PolarHBondContact O-N 3.15Å; T60-R62 VanDerWaalsContact C-N 3.28Å; T60-R62 PolarHBondContact O-N 2.95Å; R62-R65 WeakPolarHBondContact O-CB 3.41Å; R62-R65 PolarHBondContact O-N 2.91Å; R62-E66 IonicContact CZ-OE1 3.25Å; R62-E66 VanDerWaalsContact NH1-CG 3.27Å; R62-E66 IonicContact NH1-OE1 3.65Å; R62-E66 PolarHBondContact NH1-OE1 3.14Å; R62-E66 IonicContact NH1-OE2 2.71Å; R62-E66 WeakPolarHBondContact O-CG 3.42Å; R62-E66 PolarHBondContact O-N 2.89Å; R62-L76 HydrophobicContact CB-CD2 4.39Å; R62-L76 HydrophobicContact CG-CD2 4.21Å |
| 63 | L | 93 | Very high | 88.2 | Confident | 23 Ų | 23 | 87.1 Ų | 87.1 | 12% | 0.12 | 44% | 0.439 | C | S | . | . | H | α-helix | trans | -70.5 | -34.1 | -178.9 | -69.3 | 169.6 | 0 | 0 | 0 | 112.2 | V36 C49 L52 F59 T60 R65 E66 V74 L76 | V36-L63 HydrophobicContact CB-CD2 4.49Å; V36-L63 HydrophobicContact CG2-CD2 4.21Å; C49-L63 HydrophobicContact CB-CD1 3.84Å; C49-L63 VanDerWaalsContact SG-CD2 3.6Å; L52-L63 HydrophobicContact CB-CD1 4.48Å; F59-L63 HydrophobicContact CB-CD1 4.28Å; F59-L63 VanDerWaalsContact O-CB 3.24Å; F59-L63 WeakPolarHBondContact O-CB 3.47Å; F59-L63 WeakPolarHBondContact O-CD1 3.44Å; F59-L63 WeakPolarHBondContact O-CG 3.5Å; F59-L63 PolarHBondContact O-N 3.25Å; T60-L63 PolarHBondContact O-N 3.48Å; L63-R65 PolarHBondContact O-N 3.5Å; L63-E66 PolarHBondContact O-N 2.93Å; L63-E66 VanDerWaalsContact O-O 3.1Å; L63-V74 HydrophobicContact CD2-CB 4.28Å; L63-V74 HydrophobicContact CD2-CG1 3.95Å; L63-V74 HydrophobicContact CD2-CG2 4.47Å; L63-L76 HydrophobicContact CD2-CD1 3.87Å; L63-L76 HydrophobicContact CD2-CD2 4.34Å; L63-L76 HydrophobicContact CD2-CG 4.36Å; L63-L76 HydrophobicContact CG-CD1 4.16Å |
| 64 | E | 91.4 | Very high | 88.1 | Confident | 151 Ų | 151 | 85.8 Ų | 85.8 | 71% | 0.706 | 43% | 0.429 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63.1 | -27.6 | 170.8 | -75.2 | 176.8 | 172 | 0 | 0 | 113.1 | T60 | T60-E64 HydrophobicContact CG2-CG 4.46Å; T60-E64 WeakPolarHBondContact O-CB 3.37Å; T60-E64 WeakPolarHBondContact O-CG 3.4Å; T60-E64 PolarHBondContact O-N 3.06Å |
| 65 | R | 89.9 | Confident | 88 | Confident | 178 Ų | 178 | 85.8 Ų | 85.8 | 67% | 0.672 | 42% | 0.422 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -83.2 | -37.4 | 178.2 | -168.7 | 177.4 | -56.1 | 151.1 | 14.5 | 112.4 | R62 L63 R67 | R62-R65 WeakPolarHBondContact O-CB 3.41Å; R62-R65 PolarHBondContact O-N 2.91Å; L63-R65 PolarHBondContact O-N 3.5Å; R65-R67 PolarHBondContact O-N 3.38Å |
| 66 | E | 84.9 | Confident | 88 | Confident | 68 Ų | 68 | 81.7 Ų | 81.7 | 32% | 0.318 | 41% | 0.406 | S | S | . | . | trans | -80.2 | 100.9 | 176.3 | -62.6 | -47.5 | 140.2 | 0 | 0 | 111.2 | R62 L63 P68 V74 L76 | R62-E66 IonicContact CZ-OE1 3.25Å; R62-E66 VanDerWaalsContact NH1-CG 3.27Å; R62-E66 IonicContact NH1-OE1 3.65Å; R62-E66 PolarHBondContact NH1-OE1 3.14Å; R62-E66 IonicContact NH1-OE2 2.71Å; R62-E66 WeakPolarHBondContact O-CG 3.42Å; R62-E66 PolarHBondContact O-N 2.89Å; L63-E66 PolarHBondContact O-N 2.93Å; L63-E66 VanDerWaalsContact O-O 3.1Å; E66-P68 WeakPolarHBondContact O-CD 3.43Å; E66-V74 HydrophobicContact CB-CG1 3.59Å; E66-V74 HydrophobicContact CB-CG2 4.46Å; E66-V74 HydrophobicContact CG-CG1 3.81Å; E66-L76 HydrophobicContact CG-CD2 3.99Å | ||
| 67 | R | 66.4 | Low | 87.9 | Confident | 230 Ų | 230 | 88.3 Ų | 88.3 | 87% | 0.868 | 44% | 0.437 | S | S | * | . | trans | -73.5 | 113.4 | 161.1 | -70.1 | -164.9 | 178.4 | 108.4 | 0.7 | 108.8 | R65 A69 | R65-R67 PolarHBondContact O-N 3.38Å; R67-A69 PolarHBondContact O-N 3.15Å | ||
| 68 | P | 70 | Confident | 87.9 | Confident | 79 Ų | 79 | 86 Ų | 86 | 51% | 0.513 | 42% | 0.421 | S | S | . | . | P | Polyproline II helix | trans | -58.3 | 130.1 | 171.8 | 22.2 | -31.4 | 0 | 0 | 0 | 109.7 | E66 Q70 R72 V74 | E66-P68 WeakPolarHBondContact O-CD 3.43Å; P68-Q70 PolarHBondContact O-N 2.87Å; P68-R72 WeakPolarHBondContact CB-O 3.44Å; P68-V74 HydrophobicContact CB-CG2 3.8Å; P68-V74 HydrophobicContact CG-CG2 4.17Å |
| 69 | A | 73.3 | Confident | 87.7 | Confident | 60 Ų | 60 | 86.1 Ų | 86.1 | 50% | 0.496 | 44% | 0.437 | S | S | . | . | P | Polyproline II helix | trans | -59.1 | 133 | 165.5 | 0 | 0 | 0 | 0 | 0 | 108.3 | R67 G71 R72 | R67-A69 PolarHBondContact O-N 3.15Å; A69-G71 PolarHBondContact O-N 3.28Å; A69-G71 VanDerWaalsContact O-N 3.15Å; A69-R72 HydrophobicContact CB-CG 4.47Å; A69-R72 WeakPolarHBondContact O-CB 3.4Å; A69-R72 PolarHBondContact O-N 2.7Å |
| 70 | Q | 76.4 | Confident | 87.4 | Confident | 202 Ų | 202 | 89.9 Ų | 89.9 | 94% | 0.944 | 48% | 0.477 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -52.9 | 119.9 | -164.4 | -163.3 | 169.9 | 8.4 | 0 | 0 | 112.3 | P68 | P68-Q70 PolarHBondContact O-N 2.87Š|
| 71 | G | 73.1 | Confident | 87.4 | Confident | 86 Ų | 86 | 88.5 Ų | 88.5 | 89% | 0.887 | 47% | 0.468 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 82.2 | 13.1 | -176.8 | 0 | 0 | 0 | 0 | 0 | 116.1 | A69 | A69-G71 PolarHBondContact O-N 3.28Å; A69-G71 VanDerWaalsContact O-N 3.15Å |
| 72 | R | 84.3 | Confident | 87.4 | Confident | 192 Ų | 192 | 88.9 Ų | 88.9 | 73% | 0.725 | 47% | 0.468 | S | S | * | . | trans | -117.1 | 146.3 | 175.1 | -57 | -169.8 | -178.1 | -172.8 | -1.2 | 112 | P68 A69 | P68-R72 WeakPolarHBondContact CB-O 3.44Å; A69-R72 HydrophobicContact CB-CG 4.47Å; A69-R72 WeakPolarHBondContact O-CB 3.4Å; A69-R72 PolarHBondContact O-N 2.7Å | ||
| 73 | K | 90.4 | Very high | 87.5 | Confident | 69 Ų | 69 | 86.9 Ų | 86.9 | 30% | 0.3 | 46% | 0.462 | S | S | . | . | trans | -65.5 | 142.4 | 170.3 | -56.3 | -174 | -177.1 | -169.2 | 0 | 109.9 | D31 C34 D35 L37 | D31-K73 PolarHBondContact O-NZ 2.85Å; D31-K73 IonicContact OD1-NZ 3.18Å; D31-K73 PolarHBondContact OD1-NZ 3.2Å; D31-K73 IonicContact OD2-NZ 3.18Å; D31-K73 PolarHBondContact OD2-NZ 2.88Å; C34-K73 VanDerWaalsContact O-CD 3.27Å; C34-K73 WeakPolarHBondContact O-CD 3.38Å; C34-K73 WeakPolarHBondContact O-CE 3.47Å; C34-K73 PolarHBondContact O-NZ 2.9Å; D35-K73 CarbonylContact O-C 3.54Å; D35-K73 WeakPolarHBondContact O-CA 3.21Å; L37-K73 HydrophobicContact CD1-CB 4.49Å; L37-K73 HydrophobicContact CD1-CD 4.43Å; L37-K73 HydrophobicContact CD2-CD 4.03Å; L37-K73 HydrophobicContact CG-CB 4.18Å; L37-K73 HydrophobicContact CG-CD 4.06Å | ||
| 74 | V | 93.5 | Very high | 87.7 | Confident | 12 Ų | 12 | 88.3 Ų | 88.3 | 7% | 0.073 | 47% | 0.474 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -67.4 | 141.6 | 169.7 | 179.6 | 0 | 0 | 0 | 0 | 108.9 | D35 V36 L37 L63 E66 P68 L76 | D35-V74 PolarHBondContact O-N 3.08Å; V36-V74 CarbonylContact C-O 3.54Å; V36-V74 WeakPolarHBondContact CA-O 3.46Å; V36-V74 HydrophobicContact CB-CB 4.31Å; V36-V74 HydrophobicContact CG2-CB 4.24Å; L37-V74 PolarHBondContact N-O 3.49Å; L63-V74 HydrophobicContact CD2-CB 4.28Å; L63-V74 HydrophobicContact CD2-CG1 3.95Å; L63-V74 HydrophobicContact CD2-CG2 4.47Å; E66-V74 HydrophobicContact CB-CG1 3.59Å; E66-V74 HydrophobicContact CB-CG2 4.46Å; E66-V74 HydrophobicContact CG-CG1 3.81Å; P68-V74 HydrophobicContact CB-CG2 3.8Å; P68-V74 HydrophobicContact CG-CG2 4.17Å; V74-L76 HydrophobicContact CG1-CD2 3.69Å; V74-L76 HydrophobicContact CG1-CG 4.18Å |
| 75 | V | 94.1 | Very high | 87.9 | Confident | 73 Ų | 73 | 81.5 Ų | 81.5 | 44% | 0.442 | 44% | 0.442 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -114.8 | 117.3 | 174.6 | -174.4 | 0 | 0 | 0 | 0 | 109.7 | L37 | L37-V75 WeakPolarHBondContact O-CA 3.49Å |
| 76 | L | 95.1 | Very high | 88.3 | Confident | 0 Ų | 0 | 73 Ų | 73 | 0% | 0 | 41% | 0.41 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -108.5 | 99 | 178.7 | -57.4 | -170.7 | 0 | 0 | 0 | 109.8 | V36 L37 L38 Q39 F59 R62 L63 E66 V74 L78 | V36-L76 HydrophobicContact CG2-CD1 3.98Å; V36-L76 HydrophobicContact CG2-CG 3.83Å; L37-L76 PolarHBondContact O-N 3.33Å; L38-L76 HydrophobicContact CD2-CB 3.77Å; L38-L76 HydrophobicContact CD2-CD1 3.72Å; L38-L76 HydrophobicContact CD2-CG 4.09Å; Q39-L76 PolarHBondContact N-O 3.29Å; F59-L76 HydrophobicContact CD1-CD1 3.72Å; F59-L76 HydrophobicContact CE1-CD1 4.07Å; R62-L76 HydrophobicContact CB-CD2 4.39Å; R62-L76 HydrophobicContact CG-CD2 4.21Å; L63-L76 HydrophobicContact CD2-CD1 3.87Å; L63-L76 HydrophobicContact CD2-CD2 4.34Å; L63-L76 HydrophobicContact CD2-CG 4.36Å; L63-L76 HydrophobicContact CG-CD1 4.16Å; E66-L76 HydrophobicContact CG-CD2 3.99Å; V74-L76 HydrophobicContact CG1-CD2 3.69Å; V74-L76 HydrophobicContact CG1-CG 4.18Å; L76-L78 HydrophobicContact CB-CD2 4.45Å; L76-L78 PolarHBondContact O-N 3.26Å |
| 77 | E | 95.2 | Very high | 88.8 | Confident | 140 Ų | 140 | 74.5 Ų | 74.5 | 65% | 0.654 | 41% | 0.413 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -71.1 | 124 | 169.6 | -168.9 | -179.1 | -177 | 0 | 0 | 110.4 | ||
| 78 | L | 95.7 | Very high | 90.3 | Very high | 6 Ų | 6 | 65.9 Ų | 65.9 | 3% | 0.031 | 38% | 0.382 | C | S | . | . | trans | -115.1 | 71.7 | -175.1 | -58.2 | -177.5 | 0 | 0 | 0 | 110.5 | L38 Q39 F58 F59 L76 L81 L86 L115 | L38-L78 HydrophobicContact CB-CD1 4.11Å; L38-L78 HydrophobicContact CD1-CD1 4.42Å; L38-L78 HydrophobicContact CD2-CD1 4.39Å; Q39-L78 PolarHBondContact O-N 3.36Å; F58-L78 HydrophobicContact CE1-CD2 3.83Å; F58-L78 HydrophobicContact CZ-CD2 4.1Å; F59-L78 HydrophobicContact CE1-CD1 4.08Å; F59-L78 HydrophobicContact CE1-CD2 4.15Å; F59-L78 HydrophobicContact CZ-CD1 4.05Å; L76-L78 HydrophobicContact CB-CD2 4.45Å; L76-L78 PolarHBondContact O-N 3.26Å; L78-L81 HydrophobicContact CB-CD1 4.08Å; L78-L81 HydrophobicContact CD1-CD1 4.37Å; L78-L81 PolarHBondContact O-N 3.27Å; L78-L86 HydrophobicContact CD1-CD1 3.66Å; L78-L86 HydrophobicContact CD1-CD2 4.18Å; L78-L115 HydrophobicContact CD1-CD1 4.46Å; L78-L115 HydrophobicContact CD1-CD2 4.21Å; L78-L115 HydrophobicContact CD2-CD2 4.08Å | ||
| 79 | G | 92.6 | Very high | 91.6 | Very high | 53 Ų | 53 | 62.4 Ų | 62.4 | 55% | 0.546 | 36% | 0.359 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -55.8 | 139.7 | -178.8 | 0 | 0 | 0 | 0 | 0 | 113.8 | L81 Q114 | G79-L81 VanDerWaalsContact C-N 3.34Å; G79-Q114 PolarHBondContact O-NE2 2.73Å |
| 80 | G | 91.3 | Very high | 92.7 | Very high | 84 Ų | 84 | 59.7 Ų | 59.7 | 87% | 0.866 | 34% | 0.336 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 84.7 | -3.4 | 177.8 | 0 | 0 | 0 | 0 | 0 | 115.7 | ||
| 81 | L | 95.3 | Very high | 93.6 | Very high | 9 Ų | 9 | 52.8 Ų | 52.8 | 5% | 0.047 | 31% | 0.306 | C | S | . | . | trans | -96.6 | 143.9 | 174.9 | -58.7 | -171.1 | 0 | 0 | 0 | 111.8 | L78 G79 A111 L115 | L78-L81 HydrophobicContact CB-CD1 4.08Å; L78-L81 HydrophobicContact CD1-CD1 4.37Å; L78-L81 PolarHBondContact O-N 3.27Å; G79-L81 VanDerWaalsContact C-N 3.34Å; L81-A111 HydrophobicContact CD1-CB 4.42Å; L81-A111 HydrophobicContact CD2-CB 3.58Å; L81-L115 HydrophobicContact CD1-CD1 3.67Å; L81-L115 HydrophobicContact CD1-CD2 4.11Å; L81-L115 HydrophobicContact CD1-CG 3.95Å | ||
| 82 | K | 95.8 | Very high | 94.7 | Very high | 95 Ų | 95 | 50.1 Ų | 50.1 | 41% | 0.413 | 27% | 0.27 | S | S | . | . | trans | -76.7 | 144.8 | 168.9 | -62.5 | 174.1 | -179.4 | 172.3 | 0 | 110.8 | E41 S84 T85 L86 D107 | E41-K82 VanDerWaalsContact OE2-CA 3.23Å; E41-K82 WeakPolarHBondContact OE2-CA 3.35Å; K82-S84 VanDerWaalsContact C-N 3.31Å; K82-S84 PolarHBondContact O-N 2.98Å; K82-T85 WeakPolarHBondContact O-CB 3.35Å; K82-T85 PolarHBondContact O-N 3.11Å; K82-L86 PolarHBondContact O-N 3.09Å; K82-D107 IonicContact NZ-OD2 2.69Å; K82-D107 PolarHBondContact NZ-OD2 3.13Å | ||
| 83 | I | 96.6 | Very high | 95.3 | Very high | 15 Ų | 15 | 41.4 Ų | 41.4 | 8% | 0.077 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -64 | -35.7 | 178 | -172.5 | 64.3 | 0 | 0 | 0 | 112.4 | A40 E41 E43 V45 L86 R87 | A40-I83 HydrophobicContact CB-CD1 4.38Å; E41-I83 PolarHBondContact OE2-N 3.38Å; E43-I83 HydrophobicContact CB-CB 4.41Å; E43-I83 HydrophobicContact CB-CD1 3.67Å; E43-I83 HydrophobicContact CB-CG1 3.68Å; E43-I83 HydrophobicContact CG-CG1 4.38Å; V45-I83 HydrophobicContact CG2-CD1 3.61Å; I83-L86 HydrophobicContact CD1-CD2 4.31Å; I83-L86 PolarHBondContact O-N 2.98Å; I83-R87 WeakPolarHBondContact O-CG 3.49Å; I83-R87 PolarHBondContact O-N 3.29Å |
| 84 | S | 96 | Very high | 95.6 | Very high | 53 Ų | 53 | 38.4 Ų | 38.4 | 37% | 0.371 | 22% | 0.224 | S | C | . | . | H | α-helix | trans | -64.3 | -42.8 | 175 | 54.7 | 0 | 0 | 0 | 0 | 112.2 | K82 R87 K88 | K82-S84 VanDerWaalsContact C-N 3.31Å; K82-S84 PolarHBondContact O-N 2.98Å; S84-R87 PolarHBondContact O-N 2.59Å; S84-K88 WeakPolarHBondContact O-CG 3.24Å; S84-K88 PolarHBondContact O-N 2.95Å; S84-K88 VanDerWaalsContact O-N 3.11Å |
| 85 | T | 96.7 | Very high | 95.7 | Very high | 7 Ų | 7 | 39.9 Ų | 39.9 | 4% | 0.043 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -64 | -41.5 | 174 | -57.2 | 0 | 0 | 0 | 0 | 111.6 | K82 L89 V108 A111 | K82-T85 WeakPolarHBondContact O-CB 3.35Å; K82-T85 PolarHBondContact O-N 3.11Å; T85-L89 WeakPolarHBondContact O-CG 3.34Å; T85-L89 PolarHBondContact O-N 3.14Å; T85-L89 VanDerWaalsContact O-N 3.11Å; T85-V108 HydrophobicContact CG2-CB 4.48Å; T85-V108 HydrophobicContact CG2-CG2 3.93Å; T85-A111 HydrophobicContact CG2-CB 3.47Å; T85-A111 VanDerWaalsContact CG2-CB 3.47Å |
| 86 | L | 97.1 | Very high | 95.6 | Very high | 1 Ų | 1 | 40.9 Ų | 40.9 | 1% | 0.005 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -64.3 | -45.3 | 176.7 | 178.8 | 60 | 0 | 0 | 0 | 111.7 | L38 A40 V45 L78 K82 I83 L89 V90 | L38-L86 HydrophobicContact CB-CD1 4.4Å; L38-L86 HydrophobicContact CB-CD2 3.93Å; L38-L86 HydrophobicContact CD1-CD1 4.06Å; A40-L86 HydrophobicContact CB-CB 4.45Å; A40-L86 HydrophobicContact CB-CD2 3.63Å; V45-L86 HydrophobicContact CG2-CD2 4.04Å; V45-L86 HydrophobicContact CG2-CG 4.18Å; L78-L86 HydrophobicContact CD1-CD1 3.66Å; L78-L86 HydrophobicContact CD1-CD2 4.18Å; K82-L86 PolarHBondContact O-N 3.09Å; I83-L86 HydrophobicContact CD1-CD2 4.31Å; I83-L86 PolarHBondContact O-N 2.98Å; L86-L89 PolarHBondContact O-N 3.22Å; L86-V90 HydrophobicContact CD1-CG2 4.2Å; L86-V90 WeakPolarHBondContact O-CG2 3.28Å; L86-V90 PolarHBondContact O-N 3.04Å |
| 87 | R | 96.8 | Very high | 95.5 | Very high | 98 Ų | 98 | 47.3 Ų | 47.3 | 37% | 0.37 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -56 | -56.1 | 175.4 | -77.4 | 178.1 | 171.3 | 123 | 8.9 | 111 | E43 V45 I83 S84 L89 V90 D91 | E43-R87 IonicContact OE2-CZ 2.7Å; E43-R87 IonicContact OE2-NH1 2.61Å; E43-R87 PolarHBondContact OE2-NH1 3.25Å; E43-R87 IonicContact OE2-NH2 2.73Å; E43-R87 PolarHBondContact OE2-NH2 3.47Å; V45-R87 HydrophobicContact CG2-CG 3.85Å; I83-R87 WeakPolarHBondContact O-CG 3.49Å; I83-R87 PolarHBondContact O-N 3.29Å; S84-R87 PolarHBondContact O-N 2.59Å; R87-L89 VanDerWaalsContact C-N 3.25Å; R87-L89 PolarHBondContact O-N 3.16Å; R87-L89 VanDerWaalsContact O-N 3.16Å; R87-V90 CarbonylContact O-C 3.58Å; R87-V90 WeakPolarHBondContact O-CA 3.3Å; R87-V90 WeakPolarHBondContact O-CB 3.43Å; R87-V90 PolarHBondContact O-N 2.85Å; R87-D91 VanDerWaalsContact C-OD2 3.29Å; R87-D91 PolarHBondContact O-N 2.87Å; R87-D91 VanDerWaalsContact O-OD2 3.08Å |
| 88 | K | 96.4 | Very high | 95.4 | Very high | 50 Ų | 50 | 43 Ų | 43 | 22% | 0.217 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -55.8 | -36.7 | 179.2 | -71.5 | -176.1 | 173.9 | -167.7 | 0 | 113.7 | S84 F92 M98 E99 V100 E104 | S84-K88 WeakPolarHBondContact O-CG 3.24Å; S84-K88 PolarHBondContact O-N 2.95Å; S84-K88 VanDerWaalsContact O-N 3.11Å; K88-F92 WeakPolarHBondContact O-CB 3.45Å; K88-F92 PolarHBondContact O-N 2.97Å; K88-F92 VanDerWaalsContact O-N 3.15Å; K88-M98 HydrophobicContact CB-CG 4.34Å; K88-M98 HydrophobicContact CB-SD 4.19Å; K88-E99 WeakPolarHBondContact CE-O 3.37Å; K88-E99 PolarHBondContact NZ-O 3.32Å; K88-E99 VanDerWaalsContact NZ-O 3.08Å; K88-V100 HydrophobicContact CD-CG1 4.2Å; K88-E104 IonicContact NZ-OE1 3.06Å; K88-E104 PolarHBondContact NZ-OE1 3.27Å; K88-E104 IonicContact NZ-OE2 2.72Å; K88-E104 PolarHBondContact NZ-OE2 2.86Å |
| 89 | L | 97 | Very high | 95.2 | Very high | 6 Ų | 6 | 50.9 Ų | 50.9 | 3% | 0.031 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -69.9 | -40 | 173.3 | -74.4 | 179.3 | 0 | 0 | 0 | 112.9 | T85 L86 R87 L93 M98 V108 A111 A112 L115 L120 | T85-L89 WeakPolarHBondContact O-CG 3.34Å; T85-L89 PolarHBondContact O-N 3.14Å; T85-L89 VanDerWaalsContact O-N 3.11Å; L86-L89 PolarHBondContact O-N 3.22Å; R87-L89 VanDerWaalsContact C-N 3.25Å; R87-L89 PolarHBondContact O-N 3.16Å; R87-L89 VanDerWaalsContact O-N 3.16Å; L89-L93 WeakPolarHBondContact O-CG 3.47Å; L89-L93 PolarHBondContact O-N 3.37Å; L89-M98 HydrophobicContact CD2-SD 4.45Å; L89-V108 HydrophobicContact CD2-CG1 3.96Å; L89-A111 HydrophobicContact CD1-CB 3.56Å; L89-A112 HydrophobicContact CD2-CB 4.21Å; L89-L115 HydrophobicContact CD1-CD1 4.06Å; L89-L120 HydrophobicContact CD2-CD1 3.41Å; L89-L120 VanDerWaalsContact CD2-CD1 3.41Å |
| 90 | V | 97.1 | Very high | 95.2 | Very high | 2 Ų | 2 | 50 Ų | 50 | 1% | 0.012 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -65.5 | -46.5 | 175.4 | 172.4 | 0 | 0 | 0 | 0 | 110.5 | L38 V45 L86 R87 F92 L93 Y94 | L38-V90 HydrophobicContact CD1-CG2 3.82Å; V45-V90 HydrophobicContact CG1-CB 4.22Å; V45-V90 HydrophobicContact CG1-CG1 4.03Å; V45-V90 HydrophobicContact CG1-CG2 4.09Å; L86-V90 HydrophobicContact CD1-CG2 4.2Å; L86-V90 WeakPolarHBondContact O-CG2 3.28Å; L86-V90 PolarHBondContact O-N 3.04Å; R87-V90 CarbonylContact O-C 3.58Å; R87-V90 WeakPolarHBondContact O-CA 3.3Å; R87-V90 WeakPolarHBondContact O-CB 3.43Å; R87-V90 PolarHBondContact O-N 2.85Å; V90-F92 VanDerWaalsContact C-N 3.31Å; V90-F92 PolarHBondContact O-N 3.11Å; V90-L93 WeakPolarHBondContact O-CB 3.26Å; V90-L93 PolarHBondContact O-N 3.38Å; V90-Y94 HydrophobicContact CG1-CD2 4.27Å; V90-Y94 HydrophobicContact CG1-CE2 3.93Å; V90-Y94 VanDerWaalsContact O-CD2 3.3Å; V90-Y94 WeakPolarHBondContact O-CD2 3.34Å |
| 91 | D | 96.1 | Very high | 95.3 | Very high | 57 Ų | 57 | 48.1 Ų | 48.1 | 31% | 0.305 | 25% | 0.248 | S | C | . | . | H | α-helix | trans | -53.9 | -49.4 | 177.6 | -55.4 | -32.8 | 0 | 0 | 0 | 110.3 | R87 L93 Y94 T95 | R87-D91 VanDerWaalsContact C-OD2 3.29Å; R87-D91 PolarHBondContact O-N 2.87Å; R87-D91 VanDerWaalsContact O-OD2 3.08Å; D91-L93 VanDerWaalsContact C-N 3.26Å; D91-L93 PolarHBondContact O-N 3.23Å; D91-Y94 PolarHBondContact O-N 2.99Å; D91-T95 PolarHBondContact O-N 3.41Å; D91-T95 PolarHBondContact O-OG1 2.88Å |
| 92 | F | 96.4 | Very high | 95 | Very high | 31 Ų | 31 | 53.9 Ų | 53.9 | 14% | 0.136 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -54.7 | -35.4 | 175.2 | 176.4 | -98 | 0 | 0 | 0 | 113.9 | K88 V90 Y94 S96 M98 V117 E119 L120 | K88-F92 WeakPolarHBondContact O-CB 3.45Å; K88-F92 PolarHBondContact O-N 2.97Å; K88-F92 VanDerWaalsContact O-N 3.15Å; V90-F92 VanDerWaalsContact C-N 3.31Å; V90-F92 PolarHBondContact O-N 3.11Å; F92-Y94 PolarHBondContact O-N 3.36Å; F92-S96 WeakPolarHBondContact CE2-O 3.5Å; F92-S96 VanDerWaalsContact O-CA 3.26Å; F92-S96 WeakPolarHBondContact O-CA 3.42Å; F92-S96 PolarHBondContact O-N 2.79Å; F92-M98 HydrophobicContact CB-CB 4.15Å; F92-M98 HydrophobicContact CB-SD 4.25Å; F92-M98 HydrophobicContact CD2-CB 3.93Å; F92-M98 HydrophobicContact CG-CB 4.42Å; F92-V117 HydrophobicContact CE1-CG1 4.49Å; F92-E119 HydrophobicContact CZ-CB 4.43Å; F92-L120 HydrophobicContact CD1-CD1 3.55Å; F92-L120 HydrophobicContact CD1-CD2 4.37Å; F92-L120 HydrophobicContact CD1-CG 3.97Å; F92-L120 HydrophobicContact CE1-CD1 3.72Å; F92-L120 HydrophobicContact CE1-CD2 3.87Å; F92-L120 HydrophobicContact CE1-CG 3.56Å; F92-L120 HydrophobicContact CE2-CD2 4.02Å; F92-L120 HydrophobicContact CG-CD1 4.06Å; F92-L120 HydrophobicContact CZ-CD1 4.34Å; F92-L120 HydrophobicContact CZ-CD2 3.67Å; F92-L120 HydrophobicContact CZ-CG 3.91Å |
| 93 | L | 96.4 | Very high | 94.7 | Very high | 8 Ų | 8 | 56 Ų | 56 | 4% | 0.042 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -69.7 | -16.9 | 178.2 | -65.4 | -174.3 | 0 | 0 | 0 | 113.6 | I51 L52 Y55 L89 V90 D91 V117 | I51-L93 HydrophobicContact CG2-CB 4.2Å; L52-L93 HydrophobicContact CD2-CD1 3.68Å; Y55-L93 VanDerWaalsContact CB-CD2 3.45Å; Y55-L93 HydrophobicContact CD2-CD2 4.07Å; Y55-L93 HydrophobicContact CG-CD2 3.79Å; L89-L93 WeakPolarHBondContact O-CG 3.47Å; L89-L93 PolarHBondContact O-N 3.37Å; V90-L93 WeakPolarHBondContact O-CB 3.26Å; V90-L93 PolarHBondContact O-N 3.38Å; D91-L93 VanDerWaalsContact C-N 3.26Å; D91-L93 PolarHBondContact O-N 3.23Å; L93-V117 HydrophobicContact CD2-CG1 4.01Å |
| 94 | Y | 96.7 | Very high | 94.5 | Very high | 7 Ų | 7 | 57.9 Ų | 57.9 | 3% | 0.027 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -104.9 | -32 | 175.1 | -67.6 | -85.7 | 0 | 0 | 0 | 113.5 | L24 H25 Q28 H48 I51 V90 D91 F92 | L24-Y94 HydrophobicContact CB-CD1 4.13Å; L24-Y94 HydrophobicContact CB-CE1 4.16Å; H25-Y94 HydrophobicContact CB-CD1 4.39Å; H25-Y94 HydrophobicContact CB-CG 4.29Å; Q28-Y94 HydrophobicContact CB-CE1 4.11Å; Q28-Y94 HydrophobicContact CB-CE2 4.04Å; Q28-Y94 HydrophobicContact CG-CD2 4.39Å; Q28-Y94 HydrophobicContact CG-CE2 3.69Å; H48-Y94 PolarHBondContact N-OH 2.88Å; H48-Y94 VanDerWaalsContact N-OH 3.11Å; H48-Y94 AromaticContact ND1-CE1 3.73Å; H48-Y94 AromaticContact ND1-CZ 3.74Å; H48-Y94 PolarHBondContact ND1-OH 3.1Å; I51-Y94 HydrophobicContact CB-CE1 4.3Å; I51-Y94 HydrophobicContact CG1-CE1 3.91Å; I51-Y94 HydrophobicContact CG2-CD1 4.46Å; I51-Y94 HydrophobicContact CG2-CE1 4.06Å; I51-Y94 HydrophobicContact CG2-CE2 4.4Å; V90-Y94 HydrophobicContact CG1-CD2 4.27Å; V90-Y94 HydrophobicContact CG1-CE2 3.93Å; V90-Y94 VanDerWaalsContact O-CD2 3.3Å; V90-Y94 WeakPolarHBondContact O-CD2 3.34Å; D91-Y94 PolarHBondContact O-N 2.99Å; F92-Y94 PolarHBondContact O-N 3.36Å |
| 95 | T | 94.8 | Very high | 94.3 | Very high | 43 Ų | 43 | 55.5 Ų | 55.5 | 26% | 0.264 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -94.7 | -26.5 | -177.9 | 59.1 | 0 | 0 | 0 | 0 | 114 | H25 D91 E97 | H25-T95 VanDerWaalsContact CE1-CG2 3.4Å; H25-T95 WeakPolarHBondContact CE1-CG2 3.35Å; D91-T95 PolarHBondContact O-N 3.41Å; D91-T95 PolarHBondContact O-OG1 2.88Å; T95-E97 PolarHBondContact O-N 2.94Å; T95-E97 PolarHBondContact OG1-N 2.99Å; T95-E97 PolarHBondContact OG1-O 2.97Å |
| 96 | S | 93.4 | Very high | 94.2 | Very high | 94 Ų | 94 | 60.2 Ų | 60.2 | 66% | 0.657 | 30% | 0.3 | S | S | * | . | S | Bend | trans | 59.5 | 13 | -159.4 | 68.1 | 0 | 0 | 0 | 0 | 115.6 | F92 | F92-S96 WeakPolarHBondContact CE2-O 3.5Å; F92-S96 VanDerWaalsContact O-CA 3.26Å; F92-S96 WeakPolarHBondContact O-CA 3.42Å; F92-S96 PolarHBondContact O-N 2.79Å |
| 97 | E | 92.7 | Very high | 94.1 | Very high | 134 Ų | 134 | 62.8 Ų | 62.8 | 63% | 0.626 | 31% | 0.313 | S | S | * | . | trans | -128.3 | 143.3 | -176.2 | -66.3 | 175 | -162.2 | 0 | 0 | 110.3 | T95 | T95-E97 PolarHBondContact O-N 2.94Å; T95-E97 PolarHBondContact OG1-N 2.99Å; T95-E97 PolarHBondContact OG1-O 2.97Å | ||
| 98 | M | 92.5 | Very high | 94 | Very high | 49 Ų | 49 | 58.2 Ų | 58.2 | 24% | 0.241 | 30% | 0.296 | C | S | . | . | trans | -155.6 | 128.5 | -176 | -176.3 | 174.6 | 53.1 | 0 | 0 | 112.1 | K88 L89 F92 V100 V108 L120 | K88-M98 HydrophobicContact CB-CG 4.34Å; K88-M98 HydrophobicContact CB-SD 4.19Å; L89-M98 HydrophobicContact CD2-SD 4.45Å; F92-M98 HydrophobicContact CB-CB 4.15Å; F92-M98 HydrophobicContact CB-SD 4.25Å; F92-M98 HydrophobicContact CD2-CB 3.93Å; F92-M98 HydrophobicContact CG-CB 4.42Å; M98-V100 HydrophobicContact CG-CG1 4.12Å; M98-V100 HydrophobicContact SD-CG1 4.31Å; M98-V108 HydrophobicContact CE-CG1 3.59Å; M98-V108 HydrophobicContact SD-CG1 3.64Å; M98-L120 HydrophobicContact CE-CD1 3.83Å; M98-L120 HydrophobicContact CE-CD2 3.97Å | ||
| 99 | E | 91.6 | Very high | 93.9 | Very high | 172 Ų | 172 | 56 Ų | 56 | 80% | 0.804 | 29% | 0.287 | S | S | * | . | trans | -103.8 | 128.2 | 174.7 | -169.4 | 175 | -173.3 | 0 | 0 | 111.4 | K88 | K88-E99 WeakPolarHBondContact CE-O 3.37Å; K88-E99 PolarHBondContact NZ-O 3.32Å; K88-E99 VanDerWaalsContact NZ-O 3.08Å | ||
| 100 | V | 92.7 | Very high | 93.8 | Very high | 36 Ų | 36 | 58.2 Ų | 58.2 | 22% | 0.218 | 30% | 0.303 | C | S | . | . | trans | -139.1 | 139.6 | -177.4 | -71.8 | 0 | 0 | 0 | 0 | 110.6 | K88 M98 E104 A105 V108 L130 | K88-V100 HydrophobicContact CD-CG1 4.2Å; M98-V100 HydrophobicContact CG-CG1 4.12Å; M98-V100 HydrophobicContact SD-CG1 4.31Å; V100-E104 HydrophobicContact CB-CB 4.37Å; V100-A105 HydrophobicContact CB-CB 4.4Å; V100-A105 HydrophobicContact CG2-CB 3.96Å; V100-V108 HydrophobicContact CG1-CB 4.3Å; V100-V108 HydrophobicContact CG1-CG1 4.34Å; V100-V108 HydrophobicContact CG1-CG2 3.81Å; V100-L130 HydrophobicContact CG2-CD1 4.32Å | ||
| 101 | S | 92.3 | Very high | 93.8 | Very high | 44 Ų | 44 | 58.1 Ų | 58.1 | 31% | 0.308 | 30% | 0.303 | S | S | . | . | trans | -69.1 | 164.9 | 166 | 95.9 | 0 | 0 | 0 | 0 | 110.8 | E103 E104 A105 | S101-E103 WeakPolarHBondContact CB-OE2 3.47Å; S101-E103 PolarHBondContact O-N 3.22Å; S101-E103 PolarHBondContact OG-N 2.98Å; S101-E103 PolarHBondContact OG-OE2 3.44Å; S101-E104 PolarHBondContact N-OE2 2.99Å; S101-E104 PolarHBondContact O-N 3.03Å; S101-E104 PolarHBondContact OG-N 3.11Å; S101-E104 VanDerWaalsContact OG-N 3.16Å; S101-A105 WeakPolarHBondContact O-CB 3.45Å; S101-A105 PolarHBondContact O-N 3.14Å | ||
| 102 | Q | 89.2 | Confident | 93.8 | Very high | 130 Ų | 130 | 55.4 Ų | 55.4 | 61% | 0.607 | 29% | 0.288 | S | S | * | . | H | α-helix | trans | -63.4 | -29.7 | 177.8 | -174 | 175 | -32.2 | 0 | 0 | 112 | L125 | Q102-L125 HydrophobicContact CG-CD2 4.21Å |
| 103 | E | 89.4 | Confident | 93.8 | Very high | 140 Ų | 140 | 58.7 Ų | 58.7 | 65% | 0.654 | 30% | 0.3 | S | S | * | . | H | α-helix | trans | -74 | -46.3 | 176.7 | -54.8 | 68.2 | -147.1 | 0 | 0 | 111 | S101 | S101-E103 WeakPolarHBondContact CB-OE2 3.47Å; S101-E103 PolarHBondContact O-N 3.22Å; S101-E103 PolarHBondContact OG-N 2.98Å; S101-E103 PolarHBondContact OG-OE2 3.44Å |
| 104 | E | 92.6 | Very high | 93.8 | Very high | 54 Ų | 54 | 62.4 Ų | 62.4 | 25% | 0.252 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -69.3 | -31.5 | 178.4 | -66.1 | 178.4 | 118.4 | 0 | 0 | 113.2 | K88 V100 S101 Q106 D107 V108 | K88-E104 IonicContact NZ-OE1 3.06Å; K88-E104 PolarHBondContact NZ-OE1 3.27Å; K88-E104 IonicContact NZ-OE2 2.72Å; K88-E104 PolarHBondContact NZ-OE2 2.86Å; V100-E104 HydrophobicContact CB-CB 4.37Å; S101-E104 PolarHBondContact N-OE2 2.99Å; S101-E104 PolarHBondContact O-N 3.03Å; S101-E104 PolarHBondContact OG-N 3.11Å; S101-E104 VanDerWaalsContact OG-N 3.16Å; E104-Q106 PolarHBondContact O-N 3.35Å; E104-D107 WeakPolarHBondContact O-CB 3.47Å; E104-D107 PolarHBondContact O-N 2.85Å; E104-V108 PolarHBondContact O-N 2.92Å |
| 105 | A | 93.4 | Very high | 93.8 | Very high | 3 Ų | 3 | 62.2 Ų | 62.2 | 3% | 0.025 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -55.5 | -37.1 | -175.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | V100 S101 L109 L125 L130 | V100-A105 HydrophobicContact CB-CB 4.4Å; V100-A105 HydrophobicContact CG2-CB 3.96Å; S101-A105 WeakPolarHBondContact O-CB 3.45Å; S101-A105 PolarHBondContact O-N 3.14Å; A105-L109 WeakPolarHBondContact O-CB 3.37Å; A105-L109 WeakPolarHBondContact O-CG 3.39Å; A105-L109 PolarHBondContact O-N 3.43Å; A105-L125 HydrophobicContact CB-CD1 4.18Å; A105-L125 HydrophobicContact CB-CD2 4.16Å; A105-L130 HydrophobicContact CB-CD2 4.4Å |
| 106 | Q | 93.4 | Very high | 93.9 | Very high | 106 Ų | 106 | 63.9 Ų | 63.9 | 50% | 0.495 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -70.9 | -37.4 | 177.8 | -176.5 | 63 | 5.1 | 0 | 0 | 112.6 | E104 S110 | E104-Q106 PolarHBondContact O-N 3.35Å; Q106-S110 WeakPolarHBondContact O-CB 3.14Å; Q106-S110 PolarHBondContact O-N 3.02Å |
| 107 | D | 94.3 | Very high | 94 | Very high | 54 Ų | 54 | 59.6 Ų | 59.6 | 29% | 0.289 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -64.6 | -47.7 | 174.1 | -72.5 | -20.4 | 0 | 0 | 0 | 110.3 | K82 E104 L109 S110 A111 | K82-D107 IonicContact NZ-OD2 2.69Å; K82-D107 PolarHBondContact NZ-OD2 3.13Å; E104-D107 WeakPolarHBondContact O-CB 3.47Å; E104-D107 PolarHBondContact O-N 2.85Å; D107-L109 PolarHBondContact O-N 3.33Å; D107-S110 WeakPolarHBondContact O-CB 3.3Å; D107-S110 PolarHBondContact O-N 3.34Å; D107-S110 VanDerWaalsContact O-N 3.08Å; D107-S110 PolarHBondContact O-OG 3.06Å; D107-A111 WeakPolarHBondContact O-CB 3.37Å; D107-A111 PolarHBondContact O-N 3.11Å |
| 108 | V | 95.7 | Very high | 94 | Very high | 2 Ų | 2 | 55.9 Ų | 55.9 | 1% | 0.012 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -60.1 | -44.3 | 177.4 | 169.9 | 0 | 0 | 0 | 0 | 111.9 | T85 L89 M98 V100 E104 S110 A111 A112 | T85-V108 HydrophobicContact CG2-CB 4.48Å; T85-V108 HydrophobicContact CG2-CG2 3.93Å; L89-V108 HydrophobicContact CD2-CG1 3.96Å; M98-V108 HydrophobicContact CE-CG1 3.59Å; M98-V108 HydrophobicContact SD-CG1 3.64Å; V100-V108 HydrophobicContact CG1-CB 4.3Å; V100-V108 HydrophobicContact CG1-CG1 4.34Å; V100-V108 HydrophobicContact CG1-CG2 3.81Å; E104-V108 PolarHBondContact O-N 2.92Å; V108-S110 VanDerWaalsContact C-N 3.32Å; V108-S110 PolarHBondContact O-N 3.3Å; V108-A111 PolarHBondContact O-N 3.33Å; V108-A112 VanDerWaalsContact O-CB 3.28Å; V108-A112 WeakPolarHBondContact O-CB 3.43Å; V108-A112 PolarHBondContact O-N 3.27Å |
| 109 | L | 95.1 | Very high | 93.9 | Very high | 3 Ų | 3 | 58.4 Ų | 58.4 | 2% | 0.016 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -67.3 | -30.8 | 174.3 | -69.5 | 178.7 | 0 | 0 | 0 | 112.7 | A105 D107 R113 L123 L125 L130 | A105-L109 WeakPolarHBondContact O-CB 3.37Å; A105-L109 WeakPolarHBondContact O-CG 3.39Å; A105-L109 PolarHBondContact O-N 3.43Å; D107-L109 PolarHBondContact O-N 3.33Å; L109-R113 WeakPolarHBondContact O-CG 3.16Å; L109-R113 PolarHBondContact O-N 2.93Å; L109-R113 PolarHBondContact O-NE 3.43Å; L109-R113 PolarHBondContact O-NH2 3.1Å; L109-L123 HydrophobicContact CD2-CB 3.61Å; L109-L125 HydrophobicContact CD1-CB 4.23Å; L109-L130 HydrophobicContact CD1-CD2 3.83Å; L109-L130 HydrophobicContact CD2-CD2 4.22Å; L109-L130 HydrophobicContact CG-CD2 4.17Å |
| 110 | S | 95.1 | Very high | 93.9 | Very high | 53 Ų | 53 | 50.5 Ų | 50.5 | 37% | 0.371 | 25% | 0.251 | S | S | . | . | H | α-helix | trans | -68.4 | -45.4 | 173.7 | 81.7 | 0 | 0 | 0 | 0 | 111.5 | Q106 D107 V108 R113 Q114 | Q106-S110 WeakPolarHBondContact O-CB 3.14Å; Q106-S110 PolarHBondContact O-N 3.02Å; D107-S110 WeakPolarHBondContact O-CB 3.3Å; D107-S110 PolarHBondContact O-N 3.34Å; D107-S110 VanDerWaalsContact O-N 3.08Å; D107-S110 PolarHBondContact O-OG 3.06Å; V108-S110 VanDerWaalsContact C-N 3.32Å; V108-S110 PolarHBondContact O-N 3.3Å; S110-R113 PolarHBondContact O-N 3.42Å; S110-Q114 PolarHBondContact O-N 2.85Å |
| 111 | A | 96.4 | Very high | 93.9 | Very high | 1 Ų | 1 | 52.7 Ų | 52.7 | 1% | 0.008 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -66.4 | -41.5 | 178.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | L81 T85 L89 D107 V108 R113 Q114 L115 | L81-A111 HydrophobicContact CD1-CB 4.42Å; L81-A111 HydrophobicContact CD2-CB 3.58Å; T85-A111 HydrophobicContact CG2-CB 3.47Å; T85-A111 VanDerWaalsContact CG2-CB 3.47Å; L89-A111 HydrophobicContact CD1-CB 3.56Å; D107-A111 WeakPolarHBondContact O-CB 3.37Å; D107-A111 PolarHBondContact O-N 3.11Å; V108-A111 PolarHBondContact O-N 3.33Å; A111-R113 VanDerWaalsContact C-N 3.27Å; A111-R113 PolarHBondContact O-N 2.91Å; A111-Q114 PolarHBondContact O-N 3.24Å; A111-L115 WeakPolarHBondContact O-CB 3.33Å; A111-L115 WeakPolarHBondContact O-CG 3.5Å; A111-L115 PolarHBondContact O-N 3.11Å |
| 112 | A | 96.6 | Very high | 93.8 | Very high | 0 Ų | 0 | 51.6 Ų | 51.6 | 0% | 0 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -57.5 | -38.9 | 173.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | L89 V108 L115 R116 V117 L120 | L89-A112 HydrophobicContact CD2-CB 4.21Å; V108-A112 VanDerWaalsContact O-CB 3.28Å; V108-A112 WeakPolarHBondContact O-CB 3.43Å; V108-A112 PolarHBondContact O-N 3.27Å; A112-L115 CarbonylContact O-C 3.55Å; A112-R116 WeakPolarHBondContact O-CA 3.37Å; A112-R116 PolarHBondContact O-N 3.41Å; A112-V117 HydrophobicContact CB-CB 4.4Å; A112-V117 PolarHBondContact O-N 3.04Å; A112-L120 HydrophobicContact CB-CB 3.55Å; A112-L120 HydrophobicContact CB-CD1 4.34Å |
| 113 | R | 95.9 | Very high | 94 | Very high | 99 Ų | 99 | 46.7 Ų | 46.7 | 37% | 0.374 | 23% | 0.229 | S | C | . | . | H | α-helix | trans | -74.7 | -38.9 | 175.7 | -72.8 | 177.6 | -71.7 | -121.5 | 1.4 | 112.5 | L109 S110 A111 L115 R116 E121 L123 | L109-R113 WeakPolarHBondContact O-CG 3.16Å; L109-R113 PolarHBondContact O-N 2.93Å; L109-R113 PolarHBondContact O-NE 3.43Å; L109-R113 PolarHBondContact O-NH2 3.1Å; S110-R113 PolarHBondContact O-N 3.42Å; A111-R113 VanDerWaalsContact C-N 3.27Å; A111-R113 PolarHBondContact O-N 2.91Å; R113-L115 VanDerWaalsContact C-N 3.31Å; R113-L115 PolarHBondContact O-N 3.27Å; R113-R116 PolarHBondContact O-N 2.94Å; R113-E121 HydrophobicContact CG-CB 3.94Å; R113-E121 WeakPolarHBondContact CG-O 3.24Å; R113-L123 PolarHBondContact NH1-O 2.99Å |
| 114 | Q | 95.6 | Very high | 94.1 | Very high | 87 Ų | 87 | 45.1 Ų | 45.1 | 41% | 0.407 | 22% | 0.221 | S | C | . | . | H | α-helix | trans | -60.5 | -41.5 | 173 | 176 | 173.2 | -22.5 | 0 | 0 | 111.7 | G79 S110 A111 | G79-Q114 PolarHBondContact O-NE2 2.73Å; S110-Q114 PolarHBondContact O-N 2.85Å; A111-Q114 PolarHBondContact O-N 3.24Å |
| 115 | L | 96.7 | Very high | 94 | Very high | 2 Ų | 2 | 45.3 Ų | 45.3 | 1% | 0.01 | 22% | 0.224 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -91.6 | 7.8 | 179.4 | -60.1 | 178.7 | 0 | 0 | 0 | 113.6 | S56 F58 F59 L78 L81 L89 A111 A112 R113 V117 | S56-L115 WeakPolarHBondContact CB-O 3.44Å; S56-L115 PolarHBondContact OG-O 3.24Å; F58-L115 WeakPolarHBondContact CB-O 3.44Å; F58-L115 HydrophobicContact CD1-CD2 3.65Å; F58-L115 HydrophobicContact CE1-CD2 3.44Å; F58-L115 VanDerWaalsContact CE1-CD2 3.44Å; F58-L115 HydrophobicContact CG-CD2 4.47Å; F58-L115 HydrophobicContact CZ-CD2 4.09Å; F59-L115 HydrophobicContact CE1-CD2 4.34Å; F59-L115 HydrophobicContact CE2-CD1 4.33Å; F59-L115 HydrophobicContact CZ-CD1 3.99Å; F59-L115 HydrophobicContact CZ-CD2 3.99Å; F59-L115 HydrophobicContact CZ-CG 4.46Å; L78-L115 HydrophobicContact CD1-CD1 4.46Å; L78-L115 HydrophobicContact CD1-CD2 4.21Å; L78-L115 HydrophobicContact CD2-CD2 4.08Å; L81-L115 HydrophobicContact CD1-CD1 3.67Å; L81-L115 HydrophobicContact CD1-CD2 4.11Å; L81-L115 HydrophobicContact CD1-CG 3.95Å; L89-L115 HydrophobicContact CD1-CD1 4.06Å; A111-L115 WeakPolarHBondContact O-CB 3.33Å; A111-L115 WeakPolarHBondContact O-CG 3.5Å; A111-L115 PolarHBondContact O-N 3.11Å; A112-L115 CarbonylContact O-C 3.55Å; R113-L115 VanDerWaalsContact C-N 3.31Å; R113-L115 PolarHBondContact O-N 3.27Å; L115-V117 VanDerWaalsContact C-N 3.27Å; L115-V117 HydrophobicContact CB-CG2 4.02Å; L115-V117 PolarHBondContact O-N 3.38Å; L115-V117 VanDerWaalsContact O-N 3.16Å |
| 116 | R | 96.7 | Very high | 93.8 | Very high | 79 Ų | 79 | 51.4 Ų | 51.4 | 30% | 0.298 | 25% | 0.252 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 43.9 | 47.5 | -179.8 | -68.3 | -179.3 | -80.1 | 164.2 | -7.9 | 114 | P57 F58 E61 A112 R113 S118 E121 | P57-R116 VanDerWaalsContact CD-O 3.28Å; P57-R116 WeakPolarHBondContact CD-O 3.44Å; F58-R116 HydrophobicContact CB-CB 4.27Å; E61-R116 IonicContact OE1-CZ 2.65Å; E61-R116 IonicContact OE1-NH1 2.61Å; E61-R116 PolarHBondContact OE1-NH1 3.12Å; E61-R116 IonicContact OE1-NH2 2.71Å; E61-R116 PolarHBondContact OE1-NH2 3.18Å; E61-R116 IonicContact OE2-CZ 2.78Å; E61-R116 IonicContact OE2-NH1 2.71Å; E61-R116 IonicContact OE2-NH2 2.86Å; E61-R116 PolarHBondContact OE2-NH2 3.49Å; A112-R116 WeakPolarHBondContact O-CA 3.37Å; A112-R116 PolarHBondContact O-N 3.41Å; R113-R116 PolarHBondContact O-N 2.94Å; R116-S118 PolarHBondContact O-N 3.22Å; R116-E121 WeakPolarHBondContact CA-OE2 3.18Å |
| 117 | V | 96.6 | Very high | 93.4 | Very high | 4 Ų | 4 | 50.5 Ų | 50.5 | 2% | 0.024 | 27% | 0.27 | C | S | . | . | trans | -77.5 | 105.1 | 179.6 | 179.3 | 0 | 0 | 0 | 0 | 108.6 | F92 L93 A112 L115 E119 L120 E121 | F92-V117 HydrophobicContact CE1-CG1 4.49Å; L93-V117 HydrophobicContact CD2-CG1 4.01Å; A112-V117 HydrophobicContact CB-CB 4.4Å; A112-V117 PolarHBondContact O-N 3.04Å; L115-V117 VanDerWaalsContact C-N 3.27Å; L115-V117 HydrophobicContact CB-CG2 4.02Å; L115-V117 PolarHBondContact O-N 3.38Å; L115-V117 VanDerWaalsContact O-N 3.16Å; V117-E119 VanDerWaalsContact C-N 3.31Å; V117-E119 PolarHBondContact O-N 3.06Å; V117-E119 VanDerWaalsContact O-N 3.08Å; V117-L120 HydrophobicContact CB-CB 4.35Å; V117-L120 HydrophobicContact CG1-CB 4.16Å; V117-L120 HydrophobicContact CG1-CD1 4.05Å; V117-L120 HydrophobicContact CG1-CG 4.09Å; V117-L120 PolarHBondContact O-N 3.2Å; V117-E121 PolarHBondContact O-N 2.73Å | ||
| 118 | S | 91.4 | Very high | 93 | Very high | 56 Ų | 56 | 50.1 Ų | 50.1 | 39% | 0.392 | 28% | 0.279 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -54.6 | -36.8 | -158.4 | -52.4 | 0 | 0 | 0 | 0 | 115.6 | Y55 R116 | Y55-S118 PolarHBondContact O-N 3.31Å; Y55-S118 PolarHBondContact O-OG 3.32Å; Y55-S118 VanDerWaalsContact O-OG 3.05Å; R116-S118 PolarHBondContact O-N 3.22Å |
| 119 | E | 90.9 | Very high | 92.5 | Very high | 102 Ų | 102 | 57.4 Ų | 57.4 | 48% | 0.477 | 31% | 0.311 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -80.2 | -34.8 | 177.7 | -79.1 | -59.3 | 130.7 | 0 | 0 | 113 | F92 V117 S122 K132 | F92-E119 HydrophobicContact CZ-CB 4.43Å; V117-E119 VanDerWaalsContact C-N 3.31Å; V117-E119 PolarHBondContact O-N 3.06Å; V117-E119 VanDerWaalsContact O-N 3.08Å; E119-S122 PolarHBondContact O-OG 2.7Å; E119-K132 VanDerWaalsContact CD-NZ 3.29Å; E119-K132 IonicContact OE1-NZ 3.84Å; E119-K132 PolarHBondContact OE1-NZ 3.43Å; E119-K132 IonicContact OE2-NZ 3.88Å; E119-K132 PolarHBondContact OE2-NZ 3.23Å |
| 120 | L | 92.6 | Very high | 92.2 | Very high | 5 Ų | 5 | 60.4 Ų | 60.4 | 3% | 0.026 | 33% | 0.327 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -88.7 | -30.3 | -173.2 | -63.3 | -177.2 | 0 | 0 | 0 | 113.7 | L89 F92 M98 A112 V117 S122 L123 | L89-L120 HydrophobicContact CD2-CD1 3.41Å; L89-L120 VanDerWaalsContact CD2-CD1 3.41Å; F92-L120 HydrophobicContact CD1-CD1 3.55Å; F92-L120 HydrophobicContact CD1-CD2 4.37Å; F92-L120 HydrophobicContact CD1-CG 3.97Å; F92-L120 HydrophobicContact CE1-CD1 3.72Å; F92-L120 HydrophobicContact CE1-CD2 3.87Å; F92-L120 HydrophobicContact CE1-CG 3.56Å; F92-L120 HydrophobicContact CE2-CD2 4.02Å; F92-L120 HydrophobicContact CG-CD1 4.06Å; F92-L120 HydrophobicContact CZ-CD1 4.34Å; F92-L120 HydrophobicContact CZ-CD2 3.67Å; F92-L120 HydrophobicContact CZ-CG 3.91Å; M98-L120 HydrophobicContact CE-CD1 3.83Å; M98-L120 HydrophobicContact CE-CD2 3.97Å; A112-L120 HydrophobicContact CB-CB 3.55Å; A112-L120 HydrophobicContact CB-CD1 4.34Å; V117-L120 HydrophobicContact CB-CB 4.35Å; V117-L120 HydrophobicContact CG1-CB 4.16Å; V117-L120 HydrophobicContact CG1-CD1 4.05Å; V117-L120 HydrophobicContact CG1-CG 4.09Å; V117-L120 PolarHBondContact O-N 3.2Å; L120-S122 PolarHBondContact O-N 3.43Å; L120-S122 VanDerWaalsContact O-N 3.11Å; L120-L123 HydrophobicContact CD2-CD1 3.61Å; L120-L123 WeakPolarHBondContact O-CB 3.27Å; L120-L123 PolarHBondContact O-N 3.27Å |
| 121 | E | 91.8 | Very high | 92 | Very high | 83 Ų | 83 | 60.7 Ų | 60.7 | 39% | 0.388 | 33% | 0.326 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -61 | -25.2 | -176.5 | 64.9 | 167.1 | -147.6 | 0 | 0 | 113.5 | R113 R116 V117 | R113-E121 HydrophobicContact CG-CB 3.94Å; R113-E121 WeakPolarHBondContact CG-O 3.24Å; R116-E121 WeakPolarHBondContact CA-OE2 3.18Å; V117-E121 PolarHBondContact O-N 2.73Å |
| 122 | S | 90.6 | Very high | 91.6 | Very high | 20 Ų | 20 | 65.4 Ų | 65.4 | 14% | 0.14 | 35% | 0.346 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -91.9 | -1 | 179.7 | 67.7 | 0 | 0 | 0 | 0 | 114.2 | E119 L120 K132 A133 | E119-S122 PolarHBondContact O-OG 2.7Å; L120-S122 PolarHBondContact O-N 3.43Å; L120-S122 VanDerWaalsContact O-N 3.11Å; S122-K132 WeakPolarHBondContact OG-CE 3.33Å; S122-A133 WeakPolarHBondContact O-CB 3.36Å; S122-A133 PolarHBondContact O-N 3.23Å |
| 123 | L | 92.8 | Very high | 90.8 | Very high | 27 Ų | 27 | 66.5 Ų | 66.5 | 14% | 0.141 | 36% | 0.356 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -84.2 | 151.3 | 177.5 | -57 | -175.9 | 0 | 0 | 0 | 112 | L109 R113 L120 L130 V131 K132 | L109-L123 HydrophobicContact CD2-CB 3.61Å; R113-L123 PolarHBondContact NH1-O 2.99Å; L120-L123 HydrophobicContact CD2-CD1 3.61Å; L120-L123 WeakPolarHBondContact O-CB 3.27Å; L120-L123 PolarHBondContact O-N 3.27Å; L123-L130 HydrophobicContact CD1-CB 4.34Å; L123-L130 HydrophobicContact CD1-CD1 4.43Å; L123-V131 WeakPolarHBondContact CA-O 3.44Å; L123-K132 HydrophobicContact CD2-CB 3.72Å; L123-K132 HydrophobicContact CD2-CD 4.38Å; L123-K132 HydrophobicContact CD2-CG 3.94Å |
| 124 | Q | 91.4 | Very high | 89.7 | Confident | 108 Ų | 108 | 67.3 Ų | 67.3 | 51% | 0.505 | 37% | 0.374 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -133.1 | 151.4 | 174 | -59.8 | -172.3 | 28.5 | 0 | 0 | 109.9 | L130 V131 A133 | Q124-L130 WeakPolarHBondContact O-CA 3.29Å; Q124-V131 PolarHBondContact N-O 3.02Å; Q124-V131 PolarHBondContact O-N 3.38Å; Q124-A133 HydrophobicContact CG-CB 4.17Å; Q124-A133 VanDerWaalsContact NE2-CB 3.3Å |
| 125 | L | 90.8 | Very high | 88.2 | Confident | 57 Ų | 57 | 70.8 Ų | 70.8 | 30% | 0.298 | 39% | 0.39 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -89.4 | 105.7 | 175.6 | -177.7 | 65.5 | 0 | 0 | 0 | 109.3 | Q102 A105 L109 K129 L130 | Q102-L125 HydrophobicContact CG-CD2 4.21Å; A105-L125 HydrophobicContact CB-CD1 4.18Å; A105-L125 HydrophobicContact CB-CD2 4.16Å; L109-L125 HydrophobicContact CD1-CB 4.23Å; L125-K129 WeakPolarHBondContact CA-O 3.4Å; L125-L130 HydrophobicContact CD1-CD2 4.27Å |
| 126 | E | 89.9 | Confident | 86.4 | Confident | 132 Ų | 132 | 74 Ų | 74 | 62% | 0.617 | 42% | 0.423 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -125.4 | 124.6 | 179.8 | -173.9 | 171.9 | -161.7 | 0 | 0 | 109.9 | G128 K129 V131 | E126-G128 PolarHBondContact O-N 3.34Å; E126-G128 VanDerWaalsContact O-N 3.14Å; E126-K129 PolarHBondContact N-O 3.27Å; E126-K129 PolarHBondContact O-N 3.21Å; E126-V131 HydrophobicContact CB-CG2 4.13Å |
| 127 | G | 84.9 | Confident | 84.7 | Confident | 86 Ų | 86 | 81.1 Ų | 81.1 | 89% | 0.887 | 45% | 0.45 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 58.8 | 27 | 178.7 | 0 | 0 | 0 | 0 | 0 | 115.1 | K129 | G127-K129 VanDerWaalsContact C-N 3.34Š|
| 128 | G | 84.9 | Confident | 82.9 | Confident | 46 Ų | 46 | 92.3 Ų | 92.3 | 47% | 0.474 | 49% | 0.492 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 79.9 | 10.4 | -174.7 | 0 | 0 | 0 | 0 | 0 | 114.6 | E126 | E126-G128 PolarHBondContact O-N 3.34Å; E126-G128 VanDerWaalsContact O-N 3.14Å |
| 129 | K | 86.8 | Confident | 81.5 | Confident | 156 Ų | 156 | 96 Ų | 96 | 68% | 0.678 | 51% | 0.507 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -120.9 | 149.7 | 177 | -61.7 | -171.5 | 178.1 | -171.5 | 0 | 111.2 | L125 E126 G127 V131 | L125-K129 WeakPolarHBondContact CA-O 3.4Å; E126-K129 PolarHBondContact N-O 3.27Å; E126-K129 PolarHBondContact O-N 3.21Å; G127-K129 VanDerWaalsContact C-N 3.34Å; K129-V131 HydrophobicContact CB-CG2 4.39Å; K129-V131 PolarHBondContact O-N 3.05Å |
| 130 | L | 88.7 | Confident | 80.2 | Confident | 66 Ų | 66 | 94.6 Ų | 94.6 | 35% | 0.346 | 50% | 0.502 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -80.4 | 116.2 | 168.5 | -63.4 | -178.5 | 0 | 0 | 0 | 109.1 | V100 A105 L109 L123 Q124 L125 | V100-L130 HydrophobicContact CG2-CD1 4.32Å; A105-L130 HydrophobicContact CB-CD2 4.4Å; L109-L130 HydrophobicContact CD1-CD2 3.83Å; L109-L130 HydrophobicContact CD2-CD2 4.22Å; L109-L130 HydrophobicContact CG-CD2 4.17Å; L123-L130 HydrophobicContact CD1-CB 4.34Å; L123-L130 HydrophobicContact CD1-CD1 4.43Å; Q124-L130 WeakPolarHBondContact O-CA 3.29Å; L125-L130 HydrophobicContact CD1-CD2 4.27Å |
| 131 | V | 89.6 | Confident | 78.8 | Confident | 58 Ų | 58 | 103.8 Ų | 103.8 | 35% | 0.352 | 54% | 0.537 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -119.2 | 131.3 | -178.4 | -176.4 | 0 | 0 | 0 | 0 | 108.6 | L123 Q124 E126 K129 A133 | L123-V131 WeakPolarHBondContact CA-O 3.44Å; Q124-V131 PolarHBondContact N-O 3.02Å; Q124-V131 PolarHBondContact O-N 3.38Å; E126-V131 HydrophobicContact CB-CG2 4.13Å; K129-V131 HydrophobicContact CB-CG2 4.39Å; K129-V131 PolarHBondContact O-N 3.05Å; V131-A133 PolarHBondContact O-N 3.24Å |
| 132 | K | 88.4 | Confident | 77.4 | Confident | 100 Ų | 100 | 106.6 Ų | 106.6 | 44% | 0.435 | 55% | 0.55 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -67.8 | 121.5 | 174.9 | -158.7 | 156.9 | -168.7 | 170.9 | 0 | 108.3 | E119 S122 L123 | E119-K132 VanDerWaalsContact CD-NZ 3.29Å; E119-K132 IonicContact OE1-NZ 3.84Å; E119-K132 PolarHBondContact OE1-NZ 3.43Å; E119-K132 IonicContact OE2-NZ 3.88Å; E119-K132 PolarHBondContact OE2-NZ 3.23Å; S122-K132 WeakPolarHBondContact OG-CE 3.33Å; L123-K132 HydrophobicContact CD2-CB 3.72Å; L123-K132 HydrophobicContact CD2-CD 4.38Å; L123-K132 HydrophobicContact CD2-CG 3.94Å |
| 133 | A | 79.4 | Confident | 75.9 | Confident | 24 Ų | 24 | 110.7 Ų | 110.7 | 20% | 0.198 | 58% | 0.577 | C | S | . | * | trans | -51.2 | 135.8 | -174.1 | 0 | 0 | 0 | 0 | 0 | 109.9 | S122 Q124 V131 Q135 | S122-A133 WeakPolarHBondContact O-CB 3.36Å; S122-A133 PolarHBondContact O-N 3.23Å; Q124-A133 HydrophobicContact CG-CB 4.17Å; Q124-A133 VanDerWaalsContact NE2-CB 3.3Å; V131-A133 PolarHBondContact O-N 3.24Å; A133-Q135 VanDerWaalsContact C-N 3.27Å; A133-Q135 PolarHBondContact O-N 2.93Å | ||
| 134 | P | 73 | Confident | 74.2 | Confident | 116 Ų | 116 | 115.8 Ų | 115.8 | 75% | 0.753 | 60% | 0.604 | S | S | * | * | trans | -64.7 | 94.4 | 173.9 | 26.5 | -33 | 0 | 0 | 0 | 108.1 | G136 | P134-G136 PolarHBondContact O-N 3.08Š| ||
| 135 | Q | 63.5 | Low | 72.6 | Confident | 160 Ų | 160 | 116.8 Ų | 116.8 | 75% | 0.748 | 61% | 0.609 | S | S | * | * | trans | -62.5 | 91.7 | 171.4 | -72.5 | -166.8 | 4.2 | 0 | 0 | 106.9 | A133 R137 | A133-Q135 VanDerWaalsContact C-N 3.27Å; A133-Q135 PolarHBondContact O-N 2.93Å; Q135-R137 PolarHBondContact O-N 2.88Å | ||
| 136 | G | 59.1 | Low | 70.8 | Confident | 69 Ų | 69 | 119.8 Ų | 119.8 | 71% | 0.711 | 63% | 0.632 | S | S | * | * | trans | -59.7 | 101.5 | -175 | 0 | 0 | 0 | 0 | 0 | 108.6 | P134 R138 | P134-G136 PolarHBondContact O-N 3.08Å; G136-R138 PolarHBondContact O-N 2.96Å | ||
| 137 | R | 60.8 | Low | 68.7 | Low | 228 Ų | 228 | 120.1 Ų | 120.1 | 86% | 0.86 | 64% | 0.643 | S | S | * | * | trans | -57.5 | 93 | 164.8 | -75.5 | -170.1 | 177.4 | -157.1 | 0.5 | 106 | Q135 L139 | Q135-R137 PolarHBondContact O-N 2.88Å; R137-L139 PolarHBondContact O-N 3.33Å | ||
| 138 | R | 59.1 | Low | 67.1 | Low | 239 Ų | 239 | 121.4 Ų | 121.4 | 90% | 0.902 | 64% | 0.638 | S | S | * | * | trans | -73.8 | 72.1 | 177.9 | -163.7 | 179.5 | -164.6 | -112.5 | 12 | 106.8 | G136 N140 | G136-R138 PolarHBondContact O-N 2.96Å; R138-N140 PolarHBondContact O-N 2.97Å; R138-N140 VanDerWaalsContact O-N 3.1Å | ||
| 139 | L | 62.1 | Low | 65.6 | Low | 134 Ų | 134 | 123.9 Ų | 123.9 | 70% | 0.702 | 65% | 0.654 | S | S | * | * | trans | -43 | 120.4 | 175.3 | -63.4 | -179.7 | 0 | 0 | 0 | 106.5 | R137 R141 | R137-L139 PolarHBondContact O-N 3.33Å; L139-R141 PolarHBondContact O-N 2.83Å | ||
| 140 | N | 63.8 | Low | 63.9 | Low | 73 Ų | 73 | 120.2 Ų | 120.2 | 39% | 0.39 | 65% | 0.653 | S | S | . | * | trans | -61 | 121.3 | -166.6 | -169.4 | -16.9 | 0 | 0 | 0 | 108.4 | R138 E142 C143 | R138-N140 PolarHBondContact O-N 2.97Å; R138-N140 VanDerWaalsContact O-N 3.1Å; N140-E142 PolarHBondContact ND2-OE1 3Å; N140-E142 PolarHBondContact ND2-OE2 3.43Å; N140-E142 PolarHBondContact O-N 3.49Å; N140-E142 VanDerWaalsContact O-N 3.12Å; N140-E142 WeakPolarHBondContact OD1-CB 3.28Å; N140-E142 VanDerWaalsContact OD1-CD 3.29Å; N140-E142 VanDerWaalsContact OD1-CG 3.29Å; N140-E142 WeakPolarHBondContact OD1-CG 3.33Å; N140-E142 PolarHBondContact OD1-N 3.05Å; N140-E142 VanDerWaalsContact OD1-N 3.1Å; N140-E142 PolarHBondContact OD1-OE1 2.61Å; N140-E142 VanDerWaalsContact OD1-OE1 3.08Å; N140-C143 VanDerWaalsContact O-CB 3.28Å; N140-C143 WeakPolarHBondContact O-CB 3.33Å; N140-C143 PolarHBondContact O-N 3.26Å | ||
| 141 | R | 64 | Low | 61.9 | Low | 198 Ų | 198 | 123 Ų | 123 | 75% | 0.747 | 68% | 0.675 | S | S | * | * | G | 310 helix | trans | -62 | -21.9 | -176.2 | -174.6 | 173.6 | 172.6 | -175.9 | -3.4 | 111.6 | L139 C143 L144 Q145 | L139-R141 PolarHBondContact O-N 2.83Å; R141-C143 VanDerWaalsContact C-N 3.25Å; R141-C143 PolarHBondContact O-N 2.73Å; R141-L144 PolarHBondContact O-N 3.06Å; R141-L144 VanDerWaalsContact O-N 3.14Å; R141-Q145 WeakPolarHBondContact O-CG 3.33Å; R141-Q145 PolarHBondContact O-N 2.72Å |
| 142 | E | 61.5 | Low | 59.9 | Low | 141 Ų | 141 | 128 Ų | 128 | 66% | 0.659 | 70% | 0.698 | S | S | * | * | G | 310 helix | trans | -52.4 | -41.2 | 166.8 | -66.4 | 160.4 | -132.2 | 0 | 0 | 112.2 | N140 L144 Q145 | N140-E142 PolarHBondContact ND2-OE1 3Å; N140-E142 PolarHBondContact ND2-OE2 3.43Å; N140-E142 PolarHBondContact O-N 3.49Å; N140-E142 VanDerWaalsContact O-N 3.12Å; N140-E142 WeakPolarHBondContact OD1-CB 3.28Å; N140-E142 VanDerWaalsContact OD1-CD 3.29Å; N140-E142 VanDerWaalsContact OD1-CG 3.29Å; N140-E142 WeakPolarHBondContact OD1-CG 3.33Å; N140-E142 PolarHBondContact OD1-N 3.05Å; N140-E142 VanDerWaalsContact OD1-N 3.1Å; N140-E142 PolarHBondContact OD1-OE1 2.61Å; N140-E142 VanDerWaalsContact OD1-OE1 3.08Å; E142-L144 PolarHBondContact O-N 2.71Å; E142-Q145 PolarHBondContact O-N 3.23Å |
| 143 | C | 59.8 | Low | 57.9 | Low | 107 Ų | 107 | 127.8 Ų | 127.8 | 72% | 0.723 | 71% | 0.709 | S | S | * | * | G | 310 helix | trans | -71.1 | -10.7 | 179.7 | -54.2 | 0 | 0 | 0 | 0 | 114.2 | N140 R141 | N140-C143 VanDerWaalsContact O-CB 3.28Å; N140-C143 WeakPolarHBondContact O-CB 3.33Å; N140-C143 PolarHBondContact O-N 3.26Å; R141-C143 VanDerWaalsContact C-N 3.25Å; R141-C143 PolarHBondContact O-N 2.73Å |
| 144 | L | 56.2 | Low | 56.5 | Low | 134 Ų | 134 | 131 Ų | 131 | 70% | 0.702 | 74% | 0.736 | S | S | * | * | G | 310 helix | trans | -114.7 | 3.9 | 179.4 | -65.1 | 178.3 | 0 | 0 | 0 | 113 | R141 E142 | R141-L144 PolarHBondContact O-N 3.06Å; R141-L144 VanDerWaalsContact O-N 3.14Å; E142-L144 PolarHBondContact O-N 2.71Å |
| 145 | Q | 59.4 | Low | 55.2 | Low | 129 Ų | 129 | 136 Ų | 136 | 60% | 0.603 | 74% | 0.74 | S | S | * | * | S | Bend | trans | -79 | 125.5 | 168.1 | -60.8 | -152.6 | 33.8 | 0 | 0 | 109.3 | R141 E142 T147 | R141-Q145 WeakPolarHBondContact O-CG 3.33Å; R141-Q145 PolarHBondContact O-N 2.72Å; E142-Q145 PolarHBondContact O-N 3.23Å; Q145-T147 PolarHBondContact O-N 3.05Å; Q145-T147 VanDerWaalsContact O-N 3.08Å |
| 146 | P | 51.4 | Low | 54.4 | Low | 120 Ų | 120 | 134.8 Ų | 134.8 | 78% | 0.779 | 74% | 0.743 | S | S | * | * | trans | -66.3 | 112.3 | 169.8 | 27.6 | -32.1 | 0 | 0 | 0 | 108.4 | S148 | P146-S148 PolarHBondContact O-N 3.39Š| ||
| 147 | T | 46.2 | Very low | 53.6 | Low | 139 Ų | 139 | 137.9 Ų | 137.9 | 85% | 0.853 | 75% | 0.748 | S | S | * | * | trans | -49.4 | 125.1 | 176.2 | -52.8 | 0 | 0 | 0 | 0 | 109.7 | Q145 A149 | Q145-T147 PolarHBondContact O-N 3.05Å; Q145-T147 VanDerWaalsContact O-N 3.08Å; T147-A149 PolarHBondContact O-N 3.07Å | ||
| 148 | S | 51.3 | Low | 52.3 | Low | 112 Ų | 112 | 132.4 Ų | 132.4 | 78% | 0.783 | 74% | 0.74 | S | S | * | * | trans | -48.1 | 130 | -173.1 | -174.1 | 0 | 0 | 0 | 0 | 111.7 | P146 A150 | P146-S148 PolarHBondContact O-N 3.39Å; S148-A150 VanDerWaalsContact C-N 3.33Å; S148-A150 PolarHBondContact O-N 3.26Å | ||
| 149 | A | 54.3 | Low | 51.9 | Low | 99 Ų | 99 | 126.9 Ų | 126.9 | 82% | 0.818 | 74% | 0.735 | S | S | * | * | trans | -71.4 | 80.3 | -166.2 | 0 | 0 | 0 | 0 | 0 | 113.1 | T147 | T147-A149 PolarHBondContact O-N 3.07Š| ||
| 150 | A | 50.8 | Low | 50.5 | Low | 78 Ų | 78 | 126 Ų | 126 | 65% | 0.645 | 74% | 0.74 | S | S | * | * | trans | -73.8 | 124.7 | 159 | 0 | 0 | 0 | 0 | 0 | 108.9 | S148 I152 | S148-A150 VanDerWaalsContact C-N 3.33Å; S148-A150 PolarHBondContact O-N 3.26Å; A150-I152 PolarHBondContact O-N 2.95Å | ||
| 151 | P | 46.9 | Very low | 49.2 | Very low | 126 Ų | 126 | 130.7 Ų | 130.7 | 82% | 0.818 | 76% | 0.759 | S | S | * | * | trans | -71 | 106.6 | 179.8 | 27.8 | -33.4 | 0 | 0 | 0 | 110.1 | S153 | P151-S153 VanDerWaalsContact C-N 3.35Å; P151-S153 PolarHBondContact O-N 3.4Å | ||
| 152 | I | 45.9 | Very low | 47.9 | Very low | 162 Ų | 162 | 129 Ų | 129 | 83% | 0.831 | 76% | 0.759 | S | S | * | * | trans | -67.5 | 94.2 | 174.5 | -57.7 | 178.8 | 0 | 0 | 0 | 108.6 | A150 A154 | A150-I152 PolarHBondContact O-N 2.95Å; I152-A154 PolarHBondContact O-N 3.12Å | ||
| 153 | S | 47.8 | Very low | 47.4 | Very low | 96 Ų | 96 | 126.9 Ų | 126.9 | 67% | 0.671 | 76% | 0.758 | S | S | * | * | trans | -68.2 | 103.4 | 170.1 | -171.6 | 0 | 0 | 0 | 0 | 108.6 | P151 R155 | P151-S153 VanDerWaalsContact C-N 3.35Å; P151-S153 PolarHBondContact O-N 3.4Å; S153-R155 PolarHBondContact O-N 3.18Å | ||
| 154 | A | 49 | Very low | 46.1 | Very low | 92 Ų | 92 | 130.2 Ų | 130.2 | 76% | 0.76 | 76% | 0.762 | S | S | * | * | trans | -64.3 | 94.9 | -179.6 | 0 | 0 | 0 | 0 | 0 | 111.1 | I152 | I152-A154 PolarHBondContact O-N 3.12Š| ||
| 155 | R | 45.8 | Very low | 45 | Very low | 221 Ų | 221 | 129.9 Ų | 129.9 | 83% | 0.834 | 77% | 0.766 | S | S | * | * | trans | -104.6 | 100.4 | 169.8 | -72.8 | -167.5 | 173.4 | -159.9 | -2.5 | 109.9 | S153 V157 | S153-R155 PolarHBondContact O-N 3.18Å; R155-V157 PolarHBondContact O-N 3.47Å | ||
| 156 | V | 47.5 | Very low | 44.3 | Very low | 134 Ų | 134 | 129.6 Ų | 129.6 | 81% | 0.812 | 78% | 0.775 | S | S | * | * | trans | -63.8 | 123.9 | 170.8 | 177 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 157 | V | 41.1 | Very low | 43.4 | Very low | 133 Ų | 133 | 131.4 Ų | 131.4 | 81% | 0.806 | 78% | 0.778 | S | S | * | * | trans | -136.7 | 133.8 | 157.8 | -175.6 | 0 | 0 | 0 | 0 | 107.7 | R155 | R155-V157 PolarHBondContact O-N 3.47Š| ||
| 158 | T | 34.9 | Very low | 43.5 | Very low | 114 Ų | 114 | 130.3 Ų | 130.3 | 70% | 0.699 | 77% | 0.773 | S | S | * | * | trans | -87.5 | 161.2 | -177.1 | 36.3 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 159 | P | 49.6 | Very low | 42.5 | Very low | 123 Ų | 123 | 129 Ų | 129 | 80% | 0.799 | 77% | 0.769 | S | S | * | * | trans | -79.9 | 158.3 | -171.5 | 32.9 | -37.2 | 0 | 0 | 0 | 113.7 | ||||
| 160 | S | 33.8 | Very low | 41.3 | Very low | 116 Ų | 116 | 130.4 Ų | 130.4 | 81% | 0.811 | 77% | 0.768 | S | S | * | * | trans | -147.8 | 156.9 | 166.7 | 47.8 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 161 | H | 36.6 | Very low | 40.3 | Very low | 170 Ų | 170 | 137.8 Ų | 137.8 | 79% | 0.787 | 78% | 0.779 | S | S | * | * | trans | -96.4 | 165.7 | -159.4 | -65.7 | -92.5 | 0 | 0 | 0 | 115 | ||||
| 162 | H | 36 | Very low | 39.6 | Very low | 163 Ų | 163 | 137.3 Ų | 137.3 | 76% | 0.755 | 77% | 0.774 | S | S | * | * | trans | -56.7 | -178.2 | 161.3 | -7 | -83.4 | 0 | 0 | 0 | 112.5 | ||||
| 163 | P | 51.7 | Low | 39.1 | Very low | 96 Ų | 96 | 135.7 Ų | 135.7 | 62% | 0.623 | 77% | 0.774 | S | S | * | * | cis | -136.5 | -177.2 | 2.1 | 21.5 | 5.1 | 0 | 0 | 0 | 115.5 | ||||
| 164 | H | 31.8 | Very low | 38.4 | Very low | 177 Ų | 177 | 136.1 Ų | 136.1 | 82% | 0.819 | 78% | 0.776 | S | S | * | * | trans | 142.9 | 125.3 | 130.4 | -76.7 | -67.4 | 0 | 0 | 0 | 116.4 | ||||
| 165 | T | 33.5 | Very low | 38.7 | Very low | 127 Ų | 127 | 137.1 Ų | 137.1 | 78% | 0.779 | 77% | 0.774 | S | S | * | * | trans | -73.5 | 168.3 | 156.9 | 14.4 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 166 | P | 43.9 | Very low | 38 | Very low | 123 Ų | 123 | 134.8 Ų | 134.8 | 80% | 0.799 | 78% | 0.778 | S | S | * | * | cis | -146.5 | -173.1 | 42.1 | 42 | -20 | 0 | 0 | 0 | 118.7 | ||||
| 167 | L | 32.5 | Very low | 36.9 | Very low | 158 Ų | 158 | 132.5 Ų | 132.5 | 83% | 0.827 | 78% | 0.781 | S | S | * | * | trans | -77.1 | -171.6 | 167.1 | -59 | 173.9 | 0 | 0 | 0 | 110.3 | ||||
| 168 | P | 48.3 | Very low | 36.7 | Very low | 116 Ų | 116 | 130.7 Ų | 130.7 | 75% | 0.753 | 78% | 0.78 | S | S | * | * | cis | -145.6 | 171.6 | 8.7 | 44.2 | -24.2 | 0 | 0 | 0 | 119.7 | ||||
| 169 | A | 31 | Very low | 36.5 | Very low | 86 Ų | 86 | 132.8 Ų | 132.8 | 71% | 0.711 | 79% | 0.785 | S | S | * | * | trans | 25.6 | 142.9 | 142.9 | 0 | 0 | 0 | 0 | 0 | 123.6 | ||||
| 170 | T | 28.3 | Very low | 35.9 | Very low | 127 Ų | 127 | 136.8 Ų | 136.8 | 78% | 0.779 | 78% | 0.784 | S | S | * | * | -167 | 136.8 | 108.6 | 16.2 | 0 | 0 | 0 | 0 | 116 | |||||
| 171 | R | 30.6 | Very low | 35.8 | Very low | 234 Ų | 234 | 137.5 Ų | 137.5 | 88% | 0.883 | 78% | 0.778 | S | S | * | * | trans | 60.7 | 114.5 | 140.5 | -73.4 | 176.4 | 172.5 | -168.2 | -5.4 | 123.5 | ||||
| 172 | T | 30.8 | Very low | 35.9 | Very low | 116 Ų | 116 | 137.1 Ų | 137.1 | 71% | 0.712 | 77% | 0.774 | S | S | * | * | trans | -52.1 | 162.1 | 141.3 | 2.8 | 0 | 0 | 0 | 0 | 113 | ||||
| 173 | P | 37.4 | Very low | 36.1 | Very low | 127 Ų | 127 | 134.7 Ų | 134.7 | 83% | 0.825 | 78% | 0.776 | S | S | * | * | -136.1 | 164.3 | 60.2 | 33 | -12.7 | 0 | 0 | 0 | 117.8 | |||||
| 174 | C | 32.9 | Very low | 35.1 | Very low | 106 Ų | 106 | 138.4 Ų | 138.4 | 72% | 0.716 | 79% | 0.789 | S | S | * | * | trans | -91.7 | -173.5 | 173.1 | -53.4 | 0 | 0 | 0 | 0 | 110 | ||||
| 175 | P | 55.6 | Low | 35 | Very low | 112 Ų | 112 | 133.6 Ų | 133.6 | 73% | 0.727 | 79% | 0.787 | S | S | * | * | cis | -146.6 | -154.7 | 15.1 | 41.5 | -17.4 | 0 | 0 | 0 | 116.3 | ||||
| 176 | L | 29 | Very low | 35 | Very low | 173 Ų | 173 | 135.9 Ų | 135.9 | 91% | 0.906 | 79% | 0.786 | S | S | * | * | trans | 89.8 | 129.6 | 165.3 | -69.4 | 152.8 | 0 | 0 | 0 | 119.5 | ||||
| 177 | G | 26 | Very low | 34.5 | Very low | 85 Ų | 85 | 137.1 Ų | 137.1 | 88% | 0.876 | 78% | 0.782 | S | S | * | * | trans | 114.2 | 94.1 | 156 | 0 | 0 | 0 | 0 | 0 | 117.1 | ||||
| 178 | A | 36.1 | Very low | 34.3 | Very low | 95 Ų | 95 | 138.5 Ų | 138.5 | 79% | 0.785 | 78% | 0.784 | S | S | * | * | trans | -120 | 135.5 | 168 | 0 | 0 | 0 | 0 | 0 | 111 | ||||
| 179 | I | 31.9 | Very low | 33.1 | Very low | 158 Ų | 158 | 136.2 Ų | 136.2 | 81% | 0.81 | 78% | 0.782 | S | S | * | * | trans | -168.5 | 125.6 | 169.5 | -106 | 149 | 0 | 0 | 0 | 112.5 | ||||
| 180 | R | 36.4 | Very low | 33.5 | Very low | 208 Ų | 208 | 138.8 Ų | 138.8 | 79% | 0.785 | 79% | 0.791 | S | S | * | * | trans | 56.7 | 162.6 | 152.5 | -60.2 | 176.5 | 119.7 | 176 | 3.8 | 118.8 | ||||
| 181 | L | 31.4 | Very low | 33.8 | Very low | 130 Ų | 130 | 141.2 Ų | 141.2 | 68% | 0.681 | 79% | 0.793 | S | S | * | * | cis | -151.7 | 139.1 | 38.5 | -69.9 | 158.4 | 0 | 0 | 0 | 112.1 | ||||
| 182 | K | 38.9 | Very low | 33.6 | Very low | 163 Ų | 163 | 139.1 Ų | 139.1 | 71% | 0.709 | 79% | 0.794 | S | S | * | * | 67.5 | 156.1 | 109.4 | -54.6 | -175.6 | -178.8 | 177.6 | 0 | 116.7 | |||||
| 183 | S | 39 | Very low | 33.4 | Very low | 112 Ų | 112 | 139.4 Ų | 139.4 | 78% | 0.783 | 79% | 0.791 | S | S | * | * | cis | -162.3 | 177.3 | 28.9 | -49.8 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 184 | L | 31.3 | Very low | 32.9 | Very low | 174 Ų | 174 | 139.1 Ų | 139.1 | 91% | 0.911 | 78% | 0.782 | S | S | * | * | cis | 179.9 | 129.2 | -34.8 | 174.6 | 63.7 | 0 | 0 | 0 | 111.3 | ||||
| 185 | G | 29.7 | Very low | 32.6 | Very low | 75 Ų | 75 | 144.9 Ų | 144.9 | 77% | 0.773 | 79% | 0.789 | S | S | * | * | trans | 103.6 | 159.1 | 162.3 | 0 | 0 | 0 | 0 | 0 | 117.8 | ||||
| 186 | K | 34.3 | Very low | 31.2 | Very low | 176 Ų | 176 | 146.8 Ų | 146.8 | 77% | 0.765 | 79% | 0.788 | S | S | * | * | cis | -168.8 | 130.8 | -4.4 | -179.5 | 177.9 | -176.2 | -74.1 | 0 | 112.5 | ||||
| 187 | E | 32.4 | Very low | 31 | Very low | 149 Ų | 149 | 145.4 Ų | 145.4 | 70% | 0.696 | 78% | 0.782 | S | S | * | * | trans | 53.1 | 163.4 | 161.8 | -74.8 | 168.5 | 131.5 | 0 | 0 | 120.1 | ||||
| 188 | E | 29.5 | Very low | 31 | Very low | 186 Ų | 186 | 145.1 Ų | 145.1 | 87% | 0.869 | 77% | 0.771 | S | S | * | * | cis | -139 | -176.3 | 8.4 | -147.6 | 174.2 | 137.9 | 0 | 0 | 111.7 | ||||
| 189 | G | 22.7 | Very low | 30.5 | Very low | 69 Ų | 69 | 147 Ų | 147 | 71% | 0.711 | 77% | 0.768 | S | S | * | * | trans | -91.7 | -156.4 | -173 | 0 | 0 | 0 | 0 | 0 | 116.5 | ||||
| 190 | P | 38.8 | Very low | 30.3 | Very low | 140 Ų | 140 | 145.8 Ų | 145.8 | 91% | 0.909 | 76% | 0.763 | S | S | * | * | cis | -125.5 | -160.3 | 6.9 | 43.4 | -27.4 | 0 | 0 | 0 | 114.8 | ||||
| 191 | Q | 35.1 | Very low | 30.1 | Very low | 177 Ų | 177 | 143.2 Ų | 143.2 | 83% | 0.827 | 76% | 0.764 | S | S | * | * | trans | -100.9 | 149.1 | -167.8 | 177.5 | -176 | 7.4 | 0 | 0 | 114.1 | ||||
| 192 | E | 27.4 | Very low | 30.1 | Very low | 191 Ų | 191 | 142.1 Ų | 142.1 | 89% | 0.893 | 77% | 0.768 | S | S | * | * | trans | -128.7 | 166.7 | 164.9 | -156.5 | 167.1 | -128.8 | 0 | 0 | 112.3 | ||||
| 193 | N | 26.3 | Very low | 29.5 | Very low | 121 Ų | 121 | 138 Ų | 138 | 65% | 0.647 | 77% | 0.772 | S | S | * | * | trans | -161.3 | 141.8 | -155.7 | -178.1 | 19.1 | 0 | 0 | 0 | 111.8 | ||||
| 194 | N | 25.5 | Very low | 29.1 | Very low | 121 Ų | 121 | 138.9 Ų | 138.9 | 65% | 0.647 | 77% | 0.772 | S | S | * | * | trans | 51.9 | 118.3 | 155.1 | -106.6 | -80.7 | 0 | 0 | 0 | 120.2 | ||||
| 195 | R | 27.4 | Very low | 29 | Very low | 228 Ų | 228 | 138.3 Ų | 138.3 | 86% | 0.86 | 77% | 0.769 | S | S | * | * | 177.6 | 170.6 | 106.5 | -101.5 | 161.6 | 179 | -173.1 | -1.6 | 117.3 | |||||
| 196 | Q | 26.9 | Very low | 29.1 | Very low | 151 Ų | 151 | 142 Ų | 142 | 71% | 0.706 | 77% | 0.77 | S | S | * | * | trans | -86.5 | 175.7 | -172.4 | -52.2 | 145.3 | -76.6 | 0 | 0 | 113.9 | ||||
| 197 | N | 24.1 | Very low | 28.9 | Very low | 145 Ų | 145 | 141 Ų | 141 | 78% | 0.775 | 77% | 0.772 | S | S | * | * | trans | 102.3 | 120.9 | 143.7 | -71.2 | -8.6 | 0 | 0 | 0 | 121.3 | ||||
| 198 | A | 25.3 | Very low | 28.8 | Very low | 79 Ų | 79 | 142 Ų | 142 | 65% | 0.653 | 77% | 0.774 | S | S | * | * | 80.2 | 120.5 | 123.6 | 0 | 0 | 0 | 0 | 0 | 121.7 | |||||
| 199 | D | 26 | Very low | 28.7 | Very low | 135 Ų | 135 | 143.3 Ų | 143.3 | 72% | 0.722 | 77% | 0.771 | S | S | * | * | 71.1 | 123.6 | 121.7 | -67.7 | 10.5 | 0 | 0 | 0 | 122.9 | |||||
| 200 | N | 27.6 | Very low | 28.9 | Very low | 132 Ų | 132 | 148.5 Ų | 148.5 | 71% | 0.706 | 78% | 0.775 | S | S | * | * | 61.9 | 139.5 | 127.3 | -65.9 | -45.6 | 0 | 0 | 0 | 119.2 | |||||
| 201 | L | 32.6 | Very low | 28.3 | Very low | 154 Ų | 154 | 146.3 Ų | 146.3 | 81% | 0.806 | 77% | 0.768 | S | S | * | * | cis | -151 | -178.7 | 6.7 | -94 | 141.7 | 0 | 0 | 0 | 106.2 | ||||
| 202 | S | 30.6 | Very low | 27.8 | Very low | 107 Ų | 107 | 149.4 Ų | 149.4 | 75% | 0.748 | 77% | 0.772 | S | S | * | * | cis | -158.9 | 159.8 | 13.8 | -152.7 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 203 | G | 27.7 | Very low | 27.6 | Very low | 77 Ų | 77 | 144.7 Ų | 144.7 | 79% | 0.794 | 77% | 0.766 | S | S | * | * | trans | 160.8 | 97.9 | 172 | 0 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 204 | T | 30.4 | Very low | 27.6 | Very low | 129 Ų | 129 | 145.1 Ų | 145.1 | 79% | 0.791 | 78% | 0.777 | S | S | * | * | trans | -104.1 | 141.5 | -164.2 | -43.2 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 205 | L | 29.1 | Very low | 28.1 | Very low | 162 Ų | 162 | 145 Ų | 145 | 85% | 0.848 | 78% | 0.782 | S | S | * | * | trans | 177.2 | 165.6 | 132.6 | -95.5 | 165.1 | 0 | 0 | 0 | 113.9 | ||||
| 206 | L | 31.2 | Very low | 27.9 | Very low | 152 Ų | 152 | 140.7 Ų | 140.7 | 80% | 0.796 | 78% | 0.782 | S | S | * | * | trans | -144 | 171.9 | -175.2 | -67.8 | 177.1 | 0 | 0 | 0 | 109.4 | ||||
| 207 | L | 29.4 | Very low | 27.8 | Very low | 155 Ų | 155 | 141.2 Ų | 141.2 | 81% | 0.812 | 79% | 0.789 | S | S | * | * | cis | -114.4 | 167.7 | 12 | -88.4 | 79.2 | 0 | 0 | 0 | 111.4 | ||||
| 208 | K | 30.4 | Very low | 27.8 | Very low | 171 Ų | 171 | 142.8 Ų | 142.8 | 74% | 0.743 | 79% | 0.791 | S | S | * | * | cis | 92.7 | 97.1 | 29 | -160.7 | -168 | 179.1 | -177.6 | 0 | 116.6 | ||||
| 209 | R | 29.2 | Very low | 27.8 | Very low | 213 Ų | 213 | 146 Ų | 146 | 80% | 0.804 | 79% | 0.793 | S | S | * | * | trans | 74.1 | 113.7 | 150.2 | -85.7 | -164.5 | 174.3 | 174.7 | 0.6 | 123 | ||||
| 210 | K | 26.4 | Very low | 27.8 | Very low | 179 Ų | 179 | 147.5 Ų | 147.5 | 78% | 0.778 | 79% | 0.793 | S | S | * | * | 75.5 | 89.9 | 105.2 | -164.6 | 178.2 | 177.4 | 178.5 | 0 | 121 | |||||
| 211 | A | 25.5 | Very low | 27.7 | Very low | 93 Ų | 93 | 146.4 Ų | 146.4 | 77% | 0.769 | 80% | 0.796 | S | S | * | * | 70.1 | 145.9 | 115.5 | 0 | 0 | 0 | 0 | 0 | 124.3 | |||||
| 212 | R | 24.5 | Very low | 27.4 | Very low | 242 Ų | 242 | 144.7 Ų | 144.7 | 91% | 0.913 | 80% | 0.796 | S | S | * | * | trans | 90.4 | 116.2 | 155.4 | -171.3 | 177.1 | -74.5 | -112.4 | 2.3 | 118.6 | ||||
| 213 | A | 24.3 | Very low | 27.5 | Very low | 93 Ų | 93 | 144.9 Ų | 144.9 | 77% | 0.769 | 80% | 0.798 | S | S | * | * | trans | 59.9 | 129.7 | 152.3 | 0 | 0 | 0 | 0 | 0 | 120.6 | ||||
| 214 | C | 24.7 | Very low | 28.5 | Very low | 130 Ų | 130 | 147 Ų | 147 | 88% | 0.878 | 80% | 0.798 | S | S | * | * | trans | -140.4 | 159.2 | 151.3 | -89.2 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 215 | P | 37.4 | Very low | 28.3 | Very low | 117 Ų | 117 | 145.9 Ų | 145.9 | 76% | 0.76 | 80% | 0.795 | S | S | * | * | trans | -115.5 | -162.2 | -166.1 | 43.4 | -32.6 | 0 | 0 | 0 | 114.1 | ||||
| 216 | T | 22.4 | Very low | 28.3 | Very low | 139 Ų | 139 | 143 Ų | 143 | 85% | 0.853 | 79% | 0.789 | S | S | * | * | trans | -30.6 | 144.6 | 170.2 | -40.5 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 217 | L | 24.1 | Very low | 28.3 | Very low | 162 Ų | 162 | 144.5 Ų | 144.5 | 85% | 0.848 | 79% | 0.791 | S | S | * | * | trans | -123.7 | 132.2 | 176.2 | -166.4 | 152.6 | 0 | 0 | 0 | 110.6 | ||||
| 218 | Q | 24.7 | Very low | 28.2 | Very low | 177 Ų | 177 | 141.6 Ų | 141.6 | 83% | 0.827 | 78% | 0.784 | S | S | * | * | trans | -145.8 | -176.6 | 174 | -147.7 | -170.4 | 7.3 | 0 | 0 | 109.2 | ||||
| 219 | E | 26 | Very low | 28.2 | Very low | 146 Ų | 146 | 142.7 Ų | 142.7 | 68% | 0.682 | 79% | 0.792 | S | S | * | * | trans | 75.4 | 155.2 | -169.9 | -52.8 | -163 | 102.6 | 0 | 0 | 114.6 | ||||
| 220 | K | 24.7 | Very low | 27.9 | Very low | 168 Ų | 168 | 135.8 Ų | 135.8 | 73% | 0.73 | 79% | 0.786 | S | S | * | * | cis | -144.1 | 171.2 | 13.6 | -143.4 | 138 | -169.7 | 148 | 0 | 113.8 | ||||
| 221 | S | 26.8 | Very low | 28.8 | Very low | 109 Ų | 109 | 132.9 Ų | 132.9 | 76% | 0.762 | 79% | 0.786 | S | S | * | * | trans | -104.4 | 164.2 | -166.6 | 55.8 | 0 | 0 | 0 | 0 | 115.9 | ||||
| 222 | S | 25.9 | Very low | 29 | Very low | 117 Ų | 117 | 138.3 Ų | 138.3 | 82% | 0.818 | 79% | 0.787 | S | S | * | * | trans | -152.4 | 167.2 | 152.5 | 61.1 | 0 | 0 | 0 | 0 | 113 | ||||
| 223 | S | 32 | Very low | 29.2 | Very low | 112 Ų | 112 | 132.8 Ų | 132.8 | 78% | 0.783 | 77% | 0.771 | S | S | * | * | trans | -155.7 | -168.5 | -172.9 | -52.2 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 224 | P | 50.3 | Low | 29.4 | Very low | 121 Ų | 121 | 133.9 Ų | 133.9 | 79% | 0.786 | 76% | 0.764 | S | S | * | * | cis | -144.9 | -156.8 | 8.7 | 44.8 | -23.1 | 0 | 0 | 0 | 116.1 | ||||
| 225 | S | 25.7 | Very low | 29.8 | Very low | 105 Ų | 105 | 135.3 Ų | 135.3 | 73% | 0.734 | 76% | 0.755 | S | S | * | * | trans | 79.5 | 145.3 | 158.3 | 152.2 | 0 | 0 | 0 | 0 | 118.6 | ||||
| 226 | S | 29.8 | Very low | 29.5 | Very low | 103 Ų | 103 | 135.9 Ų | 135.9 | 72% | 0.72 | 75% | 0.752 | S | S | * | * | cis | -165.4 | 149.6 | -9.9 | -80.2 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 227 | H | 29.3 | Very low | 29.8 | Very low | 182 Ų | 182 | 135 Ų | 135 | 84% | 0.843 | 74% | 0.742 | S | S | * | * | trans | 37.5 | 127 | 147.5 | -102.6 | -74.3 | 0 | 0 | 0 | 125.6 | ||||
| 228 | S | 28.9 | Very low | 30.1 | Very low | 95 Ų | 95 | 133.3 Ų | 133.3 | 66% | 0.664 | 74% | 0.739 | S | S | * | * | 107.9 | 149.8 | 119.2 | 79.1 | 0 | 0 | 0 | 0 | 123.8 | |||||
| 229 | Q | 29.6 | Very low | 30.3 | Very low | 194 Ų | 194 | 128.5 Ų | 128.5 | 91% | 0.907 | 73% | 0.729 | S | S | * | * | trans | 81.8 | 142.5 | 161.7 | -56.7 | -169.2 | 7.1 | 0 | 0 | 121.7 | ||||
| 230 | G | 22.5 | Very low | 30.5 | Very low | 67 Ų | 67 | 129.4 Ų | 129.4 | 69% | 0.691 | 74% | 0.738 | S | S | * | * | trans | -133.5 | -144.8 | 159 | 0 | 0 | 0 | 0 | 0 | 107.4 | ||||
| 231 | P | 46.4 | Very low | 30.6 | Very low | 118 Ų | 118 | 128.6 Ų | 128.6 | 77% | 0.766 | 74% | 0.742 | S | S | * | * | cis | -132.8 | -145.2 | -12.9 | 37.2 | -14.6 | 0 | 0 | 0 | 111.6 | ||||
| 232 | R | 29.9 | Very low | 31.6 | Very low | 208 Ų | 208 | 127.8 Ų | 127.8 | 79% | 0.785 | 73% | 0.734 | S | S | * | * | trans | 83.8 | 152 | 167.5 | -57.8 | -170.6 | -176.4 | -107.8 | 2.4 | 116.6 | ||||
| 233 | E | 28.8 | Very low | 31.6 | Very low | 125 Ų | 125 | 128.1 Ų | 128.1 | 58% | 0.584 | 73% | 0.731 | S | S | * | * | cis | -165.1 | 153.4 | -6.7 | -121.9 | 177 | -142.2 | 0 | 0 | 112.3 | ||||
| 234 | N | 27.7 | Very low | 31.3 | Very low | 116 Ų | 116 | 128.4 Ų | 128.4 | 62% | 0.62 | 73% | 0.728 | S | S | * | * | trans | 65.1 | 155.8 | 145.9 | -73 | -32 | 0 | 0 | 0 | 119.6 | ||||
| 235 | K | 33.9 | Very low | 30.1 | Very low | 160 Ų | 160 | 130.6 Ų | 130.6 | 70% | 0.696 | 73% | 0.732 | S | S | * | * | cis | -166 | 151.2 | 0.7 | -116 | 170 | -177 | 174.9 | 0 | 111 | ||||
| 236 | N | 30.5 | Very low | 30.2 | Very low | 130 Ų | 130 | 130.7 Ų | 130.7 | 70% | 0.695 | 73% | 0.733 | S | S | * | * | trans | 62.1 | 155.3 | 146.8 | -64.1 | 28.7 | 0 | 0 | 0 | 119.8 | ||||
| 237 | D | 29 | Very low | 31 | Very low | 120 Ų | 120 | 131.5 Ų | 131.5 | 64% | 0.642 | 74% | 0.736 | S | S | * | * | cis | -165.6 | 148.7 | -16.7 | -115.1 | -56.4 | 0 | 0 | 0 | 111.6 | ||||
| 238 | T | 29.8 | Very low | 31.6 | Very low | 126 Ų | 126 | 128.8 Ų | 128.8 | 77% | 0.773 | 73% | 0.734 | S | S | * | * | 34.4 | 131.8 | 125.8 | -51.8 | 0 | 0 | 0 | 0 | 119.8 | |||||
| 239 | A | 28.7 | Very low | 31.6 | Very low | 77 Ų | 77 | 129.6 Ų | 129.6 | 64% | 0.636 | 74% | 0.74 | S | S | * | * | cis | -174.2 | 164.3 | 15.7 | 0 | 0 | 0 | 0 | 0 | 116.2 | ||||
| 240 | L | 31.2 | Very low | 31.5 | Very low | 164 Ų | 164 | 128.2 Ų | 128.2 | 86% | 0.859 | 74% | 0.738 | S | S | * | * | trans | 59.1 | 110.1 | 141 | -61.5 | 166.7 | 0 | 0 | 0 | 124.6 | ||||
| 241 | D | 25.8 | Very low | 31.7 | Very low | 151 Ų | 151 | 135.4 Ų | 135.4 | 81% | 0.807 | 75% | 0.746 | S | S | * | * | 18.8 | 166.6 | 114.7 | -123.8 | 8.6 | 0 | 0 | 0 | 122.5 | |||||
| 242 | P | 48.5 | Very low | 32 | Very low | 93 Ų | 93 | 135.2 Ų | 135.2 | 60% | 0.604 | 74% | 0.744 | S | S | * | * | cis | -148.5 | 177.9 | -1.2 | 48.1 | -29.7 | 0 | 0 | 0 | 120.1 | ||||
| 243 | T | 25.2 | Very low | 32 | Very low | 123 Ų | 123 | 130.2 Ų | 130.2 | 76% | 0.755 | 74% | 0.741 | S | S | * | * | trans | 68.9 | 145.8 | 148.6 | -36.3 | 0 | 0 | 0 | 0 | 123.9 | ||||
| 244 | V | 25.4 | Very low | 32.1 | Very low | 119 Ų | 119 | 130.4 Ų | 130.4 | 72% | 0.721 | 75% | 0.751 | S | S | * | * | trans | 143.4 | 112.2 | 130.5 | 172.1 | 0 | 0 | 0 | 0 | 118.9 | ||||
| 245 | L | 26.3 | Very low | 32.1 | Very low | 167 Ų | 167 | 130.5 Ų | 130.5 | 87% | 0.874 | 75% | 0.751 | S | S | * | * | trans | 71.5 | 157.1 | 145.6 | -70.5 | 172.6 | 0 | 0 | 0 | 127.3 | ||||
| 246 | S | 27.8 | Very low | 32 | Very low | 106 Ų | 106 | 130 Ų | 130 | 74% | 0.741 | 75% | 0.749 | S | S | * | * | trans | -94.3 | -166.5 | -179.3 | -30.9 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 247 | P | 45.8 | Very low | 32 | Very low | 121 Ų | 121 | 132 Ų | 132 | 79% | 0.786 | 75% | 0.754 | S | S | * | * | cis | -151.2 | -132 | 43.9 | 37.4 | -8.6 | 0 | 0 | 0 | 115.6 | ||||
| 248 | P | 42.7 | Very low | 32.6 | Very low | 125 Ų | 125 | 133.7 Ų | 133.7 | 81% | 0.812 | 76% | 0.762 | S | S | * | * | -119.3 | -157 | -78.4 | 34.2 | -13.4 | 0 | 0 | 0 | 116.7 | |||||
| 249 | S | 28.9 | Very low | 32.7 | Very low | 112 Ų | 112 | 135.3 Ų | 135.3 | 78% | 0.783 | 77% | 0.765 | S | S | * | * | trans | -121.2 | 179 | -165.1 | 59.4 | 0 | 0 | 0 | 0 | 116.9 | ||||
| 250 | L | 26.5 | Very low | 33.3 | Very low | 165 Ų | 165 | 137.2 Ų | 137.2 | 86% | 0.864 | 77% | 0.771 | S | S | * | * | trans | -178.1 | 165.9 | 148 | -101 | 165.6 | 0 | 0 | 0 | 115.4 | ||||
| 251 | Y | 25.9 | Very low | 33.5 | Very low | 218 Ų | 218 | 141.4 Ų | 141.4 | 86% | 0.855 | 78% | 0.775 | S | S | * | * | trans | -159.5 | -173.6 | -175.5 | -125.4 | -123.3 | 0 | 0 | 0 | 109.8 | ||||
| 252 | P | 54.2 | Low | 33.9 | Very low | 113 Ų | 113 | 144 Ų | 144 | 73% | 0.734 | 78% | 0.779 | S | S | * | * | cis | -142.1 | -150 | 2.5 | 46.4 | -25 | 0 | 0 | 0 | 115.9 | ||||
| 253 | S | 28.9 | Very low | 33.6 | Very low | 104 Ų | 104 | 147 Ų | 147 | 73% | 0.727 | 79% | 0.788 | S | S | * | * | trans | 85.8 | 124.8 | 164 | -154.2 | 0 | 0 | 0 | 0 | 118.7 | ||||
| 254 | V | 30.7 | Very low | 34.2 | Very low | 129 Ų | 129 | 151.3 Ų | 151.3 | 78% | 0.782 | 79% | 0.791 | S | S | * | * | cis | 84.8 | 129.6 | 35 | -179 | 0 | 0 | 0 | 0 | 112 | ||||
| 255 | D | 28.7 | Very low | 34.4 | Very low | 118 Ų | 118 | 153.3 Ų | 153.3 | 63% | 0.631 | 80% | 0.797 | S | S | * | * | cis | -158.4 | 163.7 | 42 | -158.9 | 15.2 | 0 | 0 | 0 | 118.3 | ||||
| 256 | K | 31.6 | Very low | 34.7 | Very low | 150 Ų | 150 | 150.3 Ų | 150.3 | 65% | 0.652 | 79% | 0.79 | S | S | * | * | trans | 48.5 | 141.4 | 149.5 | -91 | 171.6 | -151.1 | 74.4 | 0 | 129.7 | ||||
| 257 | H | 31 | Very low | 35 | Very low | 172 Ų | 172 | 157.5 Ų | 157.5 | 80% | 0.796 | 80% | 0.801 | S | S | * | * | trans | 80.8 | 164.1 | 147.1 | -76.4 | -58.8 | 0 | 0 | 0 | 123.6 | ||||
| 258 | L | 40.8 | Very low | 34.2 | Very low | 155 Ų | 155 | 157.5 Ų | 157.5 | 81% | 0.812 | 80% | 0.804 | S | S | * | * | trans | -128 | 163.5 | -150.7 | -69.5 | 169 | 0 | 0 | 0 | 116.1 | ||||
| 259 | L | 32 | Very low | 34 | Very low | 160 Ų | 160 | 161.3 Ų | 161.3 | 84% | 0.838 | 81% | 0.807 | S | S | * | * | trans | 72.5 | 160.4 | 167.5 | -49.7 | -176 | 0 | 0 | 0 | 117.3 | ||||
| 260 | P | 42.2 | Very low | 34.3 | Very low | 116 Ų | 116 | 162 Ų | 162 | 75% | 0.753 | 81% | 0.809 | S | S | * | * | -127.5 | 147.2 | -60 | 36.1 | -23.3 | 0 | 0 | 0 | 111.5 | |||||
| 261 | R | 34.8 | Very low | 34.4 | Very low | 252 Ų | 252 | 159.7 Ų | 159.7 | 95% | 0.951 | 81% | 0.807 | S | S | * | * | trans | -134.6 | 143.8 | -178.2 | -73 | -171.6 | 170.1 | 172.8 | -2 | 114.9 | ||||
| 262 | K | 33.7 | Very low | 35.1 | Very low | 206 Ų | 206 | 154.9 Ų | 154.9 | 90% | 0.896 | 80% | 0.802 | S | S | * | * | trans | -75.9 | 135.9 | -172.3 | -62 | 173.6 | 178.6 | 177.5 | 0 | 111.7 | ||||
| 263 | I | 43.3 | Very low | 34 | Very low | 155 Ų | 155 | 156.5 Ų | 156.5 | 80% | 0.795 | 81% | 0.805 | S | S | * | * | trans | -75.6 | 137 | 170.6 | -60.1 | 174.9 | 0 | 0 | 0 | 109.6 | L265 | I263-L265 HydrophobicContact CG2-CG 4.49Š| ||
| 264 | R | 36.1 | Very low | 34.1 | Very low | 215 Ų | 215 | 159.7 Ų | 159.7 | 81% | 0.811 | 81% | 0.812 | S | S | * | * | trans | -122 | 110 | 175.7 | -92.6 | -84.4 | -67.1 | 178.7 | 1.1 | 108.7 | ||||
| 265 | L | 30.5 | Very low | 34 | Very low | 161 Ų | 161 | 159.8 Ų | 159.8 | 84% | 0.843 | 82% | 0.817 | S | S | * | * | trans | -87.3 | 131.1 | 172.9 | -66.6 | 172.9 | 0 | 0 | 0 | 110.4 | I263 | I263-L265 HydrophobicContact CG2-CG 4.49Š| ||
| 266 | S | 33.3 | Very low | 34 | Very low | 104 Ų | 104 | 159.6 Ų | 159.6 | 73% | 0.727 | 82% | 0.82 | S | S | * | * | trans | -136.9 | 117.8 | 171.2 | 52.2 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 267 | R | 32.6 | Very low | 34 | Very low | 256 Ų | 256 | 158.1 Ų | 158.1 | 97% | 0.966 | 83% | 0.829 | S | S | * | * | P | Polyproline II helix | trans | -99 | 140.4 | 172.4 | -71.1 | -171.5 | 175.3 | -148.2 | 1.1 | 110.3 | ||
| 268 | S | 30.8 | Very low | 34.2 | Very low | 121 Ų | 121 | 159.2 Ų | 159.2 | 85% | 0.846 | 83% | 0.831 | S | S | * | * | P | Polyproline II helix | trans | -98.4 | 148.2 | 174.7 | -59.6 | 0 | 0 | 0 | 0 | 111 | ||
| 269 | K | 38.1 | Very low | 34.4 | Very low | 205 Ų | 205 | 157.5 Ų | 157.5 | 89% | 0.891 | 83% | 0.829 | S | S | * | * | P | Polyproline II helix | trans | -101.1 | 154.9 | 172.5 | -66.4 | -177.1 | 175.8 | -174.6 | 0 | 111.1 | ||
| 270 | P | 34.3 | Very low | 34.5 | Very low | 127 Ų | 127 | 155 Ų | 155 | 83% | 0.825 | 83% | 0.825 | S | S | * | * | trans | -124.5 | 155.1 | 152.7 | 37.4 | -26.7 | 0 | 0 | 0 | 113.9 | ||||
| 271 | S | 28.7 | Very low | 34.1 | Very low | 116 Ų | 116 | 154.6 Ų | 154.6 | 81% | 0.811 | 83% | 0.825 | S | S | * | * | trans | -172.5 | 165.8 | 162 | 61.7 | 0 | 0 | 0 | 0 | 108 | ||||
| 272 | P | 41 | Very low | 34 | Very low | 117 Ų | 117 | 149.9 Ų | 149.9 | 76% | 0.76 | 82% | 0.817 | S | S | * | * | cis | -122.9 | -154.9 | -5.7 | 42.5 | -26.1 | 0 | 0 | 0 | 112.7 | ||||
| 273 | D | 31.5 | Very low | 34.1 | Very low | 148 Ų | 148 | 147.6 Ų | 147.6 | 79% | 0.791 | 81% | 0.814 | S | S | * | * | trans | -65.5 | 161.2 | -170.1 | -46.8 | -99.6 | 0 | 0 | 0 | 118.3 | ||||
| 274 | I | 29.7 | Very low | 33.5 | Very low | 170 Ų | 170 | 146.6 Ų | 146.6 | 87% | 0.872 | 82% | 0.821 | S | S | * | * | -168.8 | 141.8 | 126.1 | -96 | 151.6 | 0 | 0 | 0 | 109.5 | |||||
| 275 | C | 28.6 | Very low | 33 | Very low | 131 Ų | 131 | 139.7 Ų | 139.7 | 89% | 0.885 | 82% | 0.817 | S | S | * | * | trans | -141.1 | 150.8 | 175.9 | -172.7 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 276 | T | 28.9 | Very low | 34.1 | Very low | 115 Ų | 115 | 138.1 Ų | 138.1 | 71% | 0.706 | 82% | 0.816 | S | S | * | * | trans | -120.4 | 124.3 | -162.6 | 52.4 | 0 | 0 | 0 | 0 | 115.5 | ||||
| 277 | S | 32.2 | Very low | 33.9 | Very low | 119 Ų | 119 | 138.4 Ų | 138.4 | 83% | 0.832 | 82% | 0.818 | S | S | * | * | trans | 43.3 | 130.9 | 148.1 | 55.3 | 0 | 0 | 0 | 0 | 122.9 | ||||
| 278 | K | 35 | Very low | 33.9 | Very low | 195 Ų | 195 | 131.1 Ų | 131.1 | 85% | 0.848 | 81% | 0.807 | S | S | * | * | trans | -75.4 | 172.7 | 173 | -53.1 | 174.1 | -179.7 | 177.5 | 0 | 114 | ||||
| 279 | P | 44.3 | Very low | 34.2 | Very low | 118 Ų | 118 | 132 Ų | 132 | 77% | 0.766 | 81% | 0.807 | S | S | * | * | -133.4 | 129.6 | 98.3 | 8.5 | 14 | 0 | 0 | 0 | 113.6 | |||||
| 280 | S | 34.7 | Very low | 34.6 | Very low | 108 Ų | 108 | 127.9 Ų | 127.9 | 76% | 0.755 | 80% | 0.801 | S | S | * | * | 65.9 | 133.2 | 87.5 | 76 | 0 | 0 | 0 | 0 | 116.7 | |||||
| 281 | S | 34.2 | Very low | 34.5 | Very low | 108 Ų | 108 | 126.2 Ų | 126.2 | 76% | 0.755 | 80% | 0.797 | S | S | * | * | cis | -135.5 | -130.3 | 0.8 | 56.9 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 282 | I | 33.4 | Very low | 34.9 | Very low | 152 Ų | 152 | 127 Ų | 127 | 78% | 0.779 | 80% | 0.797 | S | S | * | * | cis | -134.9 | -134.6 | 11 | -39.6 | 160.3 | 0 | 0 | 0 | 109.3 | ||||
| 283 | L | 35.9 | Very low | 35.7 | Very low | 158 Ų | 158 | 127.3 Ų | 127.3 | 83% | 0.827 | 80% | 0.8 | S | S | * | * | trans | -148.6 | 152.6 | -179.4 | -59.3 | 99 | 0 | 0 | 0 | 113.7 | ||||
| 284 | S | 30.1 | Very low | 35.7 | Very low | 134 Ų | 134 | 123.7 Ų | 123.7 | 94% | 0.937 | 80% | 0.798 | S | S | * | * | trans | -176.5 | 160.3 | 134.4 | -82.7 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 285 | G | 26.3 | Very low | 36.7 | Very low | 71 Ų | 71 | 125.5 Ų | 125.5 | 73% | 0.732 | 79% | 0.794 | S | S | * | * | trans | -170.3 | -160.1 | 172 | 0 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 286 | P | 52.7 | Low | 37.3 | Very low | 127 Ų | 127 | 130 Ų | 130 | 83% | 0.825 | 79% | 0.792 | S | S | * | * | cis | -137.7 | -171.8 | -12.9 | 43.2 | -26.1 | 0 | 0 | 0 | 114.6 | ||||
| 287 | S | 30 | Very low | 37.8 | Very low | 110 Ų | 110 | 129.5 Ų | 129.5 | 77% | 0.769 | 78% | 0.784 | S | S | * | * | trans | 72.2 | 160.2 | 158.1 | -146.7 | 0 | 0 | 0 | 0 | 117.3 | ||||
| 288 | S | 31.7 | Very low | 37.7 | Very low | 104 Ų | 104 | 135.7 Ų | 135.7 | 73% | 0.727 | 79% | 0.79 | S | S | * | * | cis | -150.4 | 168 | 8.3 | -39 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 289 | V | 37.3 | Very low | 37.8 | Very low | 139 Ų | 139 | 135.4 Ų | 135.4 | 84% | 0.842 | 78% | 0.783 | S | S | * | * | trans | -108 | 150 | -179.4 | -157.8 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 290 | P | 46.8 | Very low | 37.2 | Very low | 119 Ų | 119 | 135.8 Ų | 135.8 | 77% | 0.773 | 78% | 0.775 | S | S | * | * | trans | -135.9 | 165.9 | 131 | 18.7 | 2.9 | 0 | 0 | 0 | 112.3 | ||||
| 291 | A | 31.2 | Very low | 37 | Very low | 91 Ų | 91 | 141.1 Ų | 141.1 | 75% | 0.752 | 78% | 0.778 | S | S | * | * | cis | -164.7 | -177.8 | -14.6 | 0 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 292 | T | 38 | Very low | 37 | Very low | 132 Ų | 132 | 139.7 Ų | 139.7 | 81% | 0.81 | 77% | 0.769 | S | S | * | * | trans | -143.7 | 178.6 | 172.7 | 60.3 | 0 | 0 | 0 | 0 | 111 | ||||
| 293 | P | 58.1 | Low | 37 | Very low | 124 Ų | 124 | 138.4 Ų | 138.4 | 81% | 0.805 | 77% | 0.767 | S | S | * | * | -154.6 | 159 | 98 | 38.8 | -20.5 | 0 | 0 | 0 | 117.4 | |||||
| 294 | G | 30.9 | Very low | 36.6 | Very low | 73 Ų | 73 | 137.6 Ų | 137.6 | 75% | 0.753 | 76% | 0.764 | S | S | * | * | trans | -154.4 | -33.4 | -178.4 | 0 | 0 | 0 | 0 | 0 | 122.8 | ||||
| 295 | R | 49.3 | Very low | 36.7 | Very low | 208 Ų | 208 | 139 Ų | 139 | 79% | 0.785 | 75% | 0.753 | S | S | * | * | trans | 34.3 | 118.6 | 168.9 | -52.4 | 179.4 | -174.6 | -91.2 | 2.1 | 119.8 | ||||
| 296 | R | 42.8 | Very low | 36.7 | Very low | 224 Ų | 224 | 143 Ų | 143 | 85% | 0.845 | 75% | 0.753 | S | S | * | * | 175.2 | 168.9 | 86.4 | -106.7 | 160.3 | -80.3 | -130.5 | 0.7 | 111.9 | |||||
| 297 | L | 39.6 | Very low | 35.6 | Very low | 106 Ų | 106 | 141.1 Ų | 141.1 | 56% | 0.555 | 75% | 0.748 | S | S | * | * | cis | 175.9 | 125.7 | -43 | -159.6 | 170.7 | 0 | 0 | 0 | 109.1 | R299 | L297-R299 HydrophobicContact CD2-CG 3.98Š| ||
| 298 | W | 29.7 | Very low | 36.5 | Very low | 249 Ų | 249 | 140.9 Ų | 140.9 | 94% | 0.943 | 74% | 0.744 | S | S | * | * | trans | -155.7 | 170.7 | 148.7 | -93.9 | 111.9 | 0 | 0 | 0 | 110.9 | ||||
| 299 | R | 37.5 | Very low | 36.3 | Very low | 189 Ų | 189 | 144.7 Ų | 144.7 | 71% | 0.713 | 75% | 0.75 | S | S | * | * | trans | -148.2 | 178.2 | -169 | -42.4 | 170.5 | 167.8 | -105.5 | 4.1 | 109.2 | L297 | L297-R299 HydrophobicContact CD2-CG 3.98Š| ||
| 300 | Q | 30.2 | Very low | 35.9 | Very low | 126 Ų | 126 | 143.9 Ų | 143.9 | 59% | 0.589 | 74% | 0.741 | S | S | * | * | cis | -168.1 | 157.9 | -3.6 | -139.8 | 175.3 | -89.2 | 0 | 0 | 110.1 | ||||
| 301 | R | 31.5 | Very low | 35.2 | Very low | 219 Ų | 219 | 145.9 Ų | 145.9 | 83% | 0.826 | 74% | 0.737 | S | S | * | * | trans | 62.8 | 166.3 | 150.7 | -86.7 | -164.8 | 156.5 | 167.8 | -7.3 | 120.3 | ||||
| 302 | S | 33.7 | Very low | 35.2 | Very low | 79 Ų | 79 | 149.4 Ų | 149.4 | 55% | 0.552 | 74% | 0.743 | S | S | * | * | cis | 177.2 | 146.5 | -43.5 | 58.7 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 303 | V | 33.4 | Very low | 35 | Very low | 124 Ų | 124 | 152.1 Ų | 152.1 | 75% | 0.752 | 74% | 0.743 | S | S | * | * | trans | 68.6 | 148.7 | 157.7 | -125.3 | 0 | 0 | 0 | 0 | 122 | ||||
| 304 | N | 28.8 | Very low | 34.4 | Very low | 142 Ų | 142 | 152.6 Ų | 152.6 | 76% | 0.759 | 75% | 0.747 | S | S | * | * | trans | 82 | 105 | 154 | -67.8 | -23.2 | 0 | 0 | 0 | 121.6 | ||||
| 305 | K | 31.7 | Very low | 34.3 | Very low | 162 Ų | 162 | 152.7 Ų | 152.7 | 70% | 0.704 | 75% | 0.747 | S | S | * | * | 45 | 151.8 | 108 | -167.7 | 168.6 | 178 | -86.2 | 0 | 120.9 | |||||
| 306 | E | 26.7 | Very low | 33.4 | Very low | 157 Ų | 157 | 152.6 Ų | 152.6 | 73% | 0.734 | 75% | 0.747 | S | S | * | * | trans | 93.9 | 151.7 | 165.3 | -120.3 | 91.4 | -104.3 | 0 | 0 | 117.4 | ||||
| 307 | A | 28.8 | Very low | 33 | Very low | 86 Ų | 86 | 145 Ų | 145 | 71% | 0.711 | 73% | 0.731 | S | S | * | * | trans | -132.6 | -174.6 | 176.8 | 0 | 0 | 0 | 0 | 0 | 107 | ||||
| 308 | P | 48.2 | Very low | 32.7 | Very low | 106 Ų | 106 | 145.2 Ų | 145.2 | 69% | 0.688 | 74% | 0.742 | S | S | * | * | cis | -137.8 | -159.1 | 6.2 | 43.6 | -23.4 | 0 | 0 | 0 | 114.1 | ||||
| 309 | E | 28.6 | Very low | 33.8 | Very low | 183 Ų | 183 | 138.7 Ų | 138.7 | 86% | 0.855 | 73% | 0.732 | S | S | * | * | trans | 64.3 | 162.6 | 157.8 | -72 | 179.7 | -173 | 0 | 0 | 118.8 | ||||
| 310 | D | 28.3 | Very low | 33.6 | Very low | 122 Ų | 122 | 136.2 Ų | 136.2 | 65% | 0.652 | 73% | 0.732 | S | S | * | * | cis | -161.6 | 162.6 | -37.2 | -172.6 | 15.9 | 0 | 0 | 0 | 108.8 | ||||
| 311 | K | 32.8 | Very low | 33.7 | Very low | 161 Ų | 161 | 137.9 Ų | 137.9 | 70% | 0.7 | 74% | 0.74 | S | S | * | * | trans | 73.8 | 129.6 | 159.3 | -51.4 | -148 | 179.5 | -174.3 | 0 | 124 | ||||
| 312 | L | 29.7 | Very low | 33.4 | Very low | 165 Ų | 165 | 133.1 Ų | 133.1 | 86% | 0.864 | 74% | 0.736 | S | S | * | * | trans | 92 | 142 | 131.9 | -80.4 | 165.2 | 0 | 0 | 0 | 122.7 | ||||
| 313 | K | 34.7 | Very low | 33.4 | Very low | 189 Ų | 189 | 135.6 Ų | 135.6 | 82% | 0.822 | 75% | 0.747 | S | S | * | * | trans | -99.4 | 168.2 | 173.4 | -53.7 | 176.6 | -179.5 | 179.2 | 0 | 110.1 | ||||
| 314 | P | 46 | Very low | 33.8 | Very low | 135 Ų | 135 | 135.5 Ų | 135.5 | 88% | 0.877 | 75% | 0.749 | S | S | * | * | -144 | 145.9 | 96.2 | 34.9 | -19 | 0 | 0 | 0 | 114.5 | |||||
| 315 | G | 28.7 | Very low | 34.2 | Very low | 74 Ų | 74 | 134 Ų | 134 | 76% | 0.763 | 75% | 0.75 | S | S | * | * | 123.6 | -179.5 | 95 | 0 | 0 | 0 | 0 | 0 | 111.4 | |||||
| 316 | R | 29.7 | Very low | 34.9 | Very low | 207 Ų | 207 | 132.8 Ų | 132.8 | 78% | 0.781 | 76% | 0.758 | S | S | * | * | cis | -166.7 | 92.1 | -17.2 | 174 | -117.6 | 156.9 | -99.1 | 1.8 | 112.5 | ||||
| 317 | A | 34.4 | Very low | 35 | Very low | 63 Ų | 63 | 131.4 Ų | 131.4 | 52% | 0.521 | 77% | 0.766 | S | S | . | * | trans | 65.4 | 125.3 | 134.8 | 0 | 0 | 0 | 0 | 0 | 121.3 | ||||
| 318 | S | 34 | Very low | 35 | Very low | 111 Ų | 111 | 130.7 Ų | 130.7 | 78% | 0.776 | 77% | 0.767 | S | S | * | * | 84.2 | 176 | 89.1 | -61.9 | 0 | 0 | 0 | 0 | 114.6 | |||||
| 319 | P | 52.7 | Low | 34.2 | Very low | 113 Ų | 113 | 134.4 Ų | 134.4 | 73% | 0.734 | 78% | 0.78 | S | S | * | * | cis | -106.4 | -166.2 | -3.3 | 31.3 | -10.1 | 0 | 0 | 0 | 112.3 | ||||
| 320 | L | 32.2 | Very low | 34.1 | Very low | 137 Ų | 137 | 129.4 Ų | 129.4 | 72% | 0.717 | 78% | 0.778 | S | S | * | * | cis | -143.4 | 172.3 | 18.2 | -62.1 | 153.6 | 0 | 0 | 0 | 107.9 | ||||
| 321 | Q | 32.5 | Very low | 34.4 | Very low | 160 Ų | 160 | 133.2 Ų | 133.2 | 75% | 0.748 | 79% | 0.789 | S | S | * | * | cis | -159.7 | -158.6 | -21.5 | -104.8 | 178.5 | -22.8 | 0 | 0 | 105.2 | ||||
| 322 | T | 26.6 | Very low | 34.1 | Very low | 120 Ų | 120 | 132.3 Ų | 132.3 | 74% | 0.736 | 80% | 0.797 | S | S | * | * | cis | -153.9 | -160.6 | 10.7 | -28.5 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 323 | T | 32.8 | Very low | 34 | Very low | 131 Ų | 131 | 128.1 Ų | 128.1 | 80% | 0.804 | 79% | 0.794 | S | S | * | * | trans | -145.2 | 173.8 | -178.2 | 47 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 324 | P | 42 | Very low | 33.7 | Very low | 121 Ų | 121 | 123.2 Ų | 123.2 | 79% | 0.786 | 80% | 0.797 | S | S | * | * | cis | -131.6 | -174.4 | 8.2 | 42.1 | -24.3 | 0 | 0 | 0 | 116.6 | ||||
| 325 | S | 36.7 | Very low | 33.2 | Very low | 112 Ų | 112 | 122.7 Ų | 122.7 | 78% | 0.783 | 80% | 0.796 | S | S | * | * | trans | -109 | 168.6 | 177.8 | -37.4 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 326 | P | 46.3 | Very low | 33.4 | Very low | 135 Ų | 135 | 128.8 Ų | 128.8 | 88% | 0.877 | 80% | 0.802 | S | S | * | * | -151.4 | -154.5 | 91 | 42.2 | -22.8 | 0 | 0 | 0 | 115.2 | |||||
| 327 | S | 30.3 | Very low | 33.7 | Very low | 128 Ų | 128 | 128.8 Ų | 128.8 | 90% | 0.895 | 81% | 0.807 | S | S | * | * | trans | -113.3 | 164.1 | -163 | 53.5 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 328 | G | 27.6 | Very low | 33.4 | Very low | 71 Ų | 71 | 137.4 Ų | 137.4 | 73% | 0.732 | 83% | 0.826 | S | S | * | * | trans | 149.4 | 130.1 | 169 | 0 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 329 | L | 32.6 | Very low | 33.2 | Very low | 185 Ų | 185 | 137.1 Ų | 137.1 | 97% | 0.969 | 82% | 0.824 | S | S | * | * | cis | 69.7 | 91 | 41.9 | -166.1 | 75.7 | 0 | 0 | 0 | 113.8 | ||||
| 330 | G | 26.3 | Very low | 32.8 | Very low | 78 Ų | 78 | 137.7 Ų | 137.7 | 80% | 0.804 | 83% | 0.828 | S | S | * | * | trans | -177.6 | 116.7 | 175.9 | 0 | 0 | 0 | 0 | 0 | 116.1 | ||||
| 331 | K | 33.7 | Very low | 32.7 | Very low | 201 Ų | 201 | 137.7 Ų | 137.7 | 87% | 0.874 | 82% | 0.824 | S | S | * | * | trans | -67.3 | 172.2 | -176.8 | -54 | 165.5 | 178.2 | 175.8 | 0 | 115.9 | ||||
| 332 | T | 27.2 | Very low | 32.5 | Very low | 142 Ų | 142 | 136.9 Ų | 136.9 | 87% | 0.871 | 83% | 0.83 | S | S | * | * | trans | 93.2 | 135.4 | 142.9 | -12.3 | 0 | 0 | 0 | 0 | 120.2 | ||||
| 333 | G | 27.1 | Very low | 32.7 | Very low | 78 Ų | 78 | 140.3 Ų | 140.3 | 80% | 0.804 | 83% | 0.83 | S | S | * | * | trans | 86.8 | 121.9 | 161.8 | 0 | 0 | 0 | 0 | 0 | 115.2 | ||||
| 334 | G | 28.5 | Very low | 32.5 | Very low | 85 Ų | 85 | 138.3 Ų | 138.3 | 88% | 0.876 | 83% | 0.826 | S | S | * | * | cis | 108.6 | 84.4 | -2 | 0 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 335 | S | 35.5 | Very low | 32.4 | Very low | 124 Ų | 124 | 138.1 Ų | 138.1 | 87% | 0.867 | 83% | 0.825 | S | S | * | * | trans | -140.2 | 145.2 | 164.7 | 69.7 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 336 | K | 32.8 | Very low | 32.2 | Very low | 202 Ų | 202 | 140 Ų | 140 | 88% | 0.878 | 83% | 0.826 | S | S | * | * | trans | -91.9 | 149.8 | -171.4 | -59.6 | 170.3 | 178.8 | 175.7 | 0 | 111.5 | ||||
| 337 | K | 35.4 | Very low | 31.4 | Very low | 208 Ų | 208 | 139.4 Ų | 139.4 | 90% | 0.904 | 83% | 0.825 | S | S | * | * | trans | -157.9 | 104.9 | 143.6 | -109.8 | 157.3 | -171.9 | 179 | 0 | 113.1 | ||||
| 338 | R | 28.7 | Very low | 31.4 | Very low | 244 Ų | 244 | 142.3 Ų | 142.3 | 92% | 0.921 | 83% | 0.825 | S | S | * | * | trans | 34.5 | 119.4 | 151.7 | -90.8 | -178.4 | 173.9 | 160.2 | -2.5 | 120.7 | ||||
| 339 | S | 30.6 | Very low | 31.6 | Very low | 104 Ų | 104 | 144.5 Ų | 144.5 | 73% | 0.727 | 83% | 0.829 | S | S | * | * | trans | -61.2 | 169.5 | 140 | -33.1 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 340 | P | 42.8 | Very low | 31.5 | Very low | 126 Ų | 126 | 140.5 Ų | 140.5 | 82% | 0.818 | 82% | 0.822 | S | S | * | * | -121.5 | 153.8 | 81.4 | 36.9 | -33.6 | 0 | 0 | 0 | 114.4 | |||||
| 341 | E | 30.9 | Very low | 32.3 | Very low | 136 Ų | 136 | 146.6 Ų | 146.6 | 64% | 0.636 | 83% | 0.83 | S | S | * | * | trans | -91.8 | 135.4 | 169.5 | -177 | -174.7 | 139.6 | 0 | 0 | 108.5 | R343 | E341-R343 IonicContact OE1-CZ 2.73Å; E341-R343 IonicContact OE1-NE 3.22Å; E341-R343 PolarHBondContact OE1-NE 3.49Å; E341-R343 IonicContact OE1-NH2 2.71Å; E341-R343 PolarHBondContact OE1-NH2 3.29Å | ||
| 342 | V | 28.8 | Very low | 32.4 | Very low | 143 Ų | 143 | 146.1 Ų | 146.1 | 87% | 0.867 | 83% | 0.831 | S | S | * | * | trans | -119.5 | 126.9 | 163.8 | 176.7 | 0 | 0 | 0 | 0 | 107.1 | ||||
| 343 | R | 29.9 | Very low | 32.9 | Very low | 193 Ų | 193 | 142.4 Ų | 142.4 | 73% | 0.728 | 82% | 0.821 | S | S | * | * | P | Polyproline II helix | trans | -101.4 | 128.7 | -169 | -177.8 | 168.2 | -65.4 | -160.4 | -2.3 | 111 | E341 | E341-R343 IonicContact OE1-CZ 2.73Å; E341-R343 IonicContact OE1-NE 3.22Å; E341-R343 PolarHBondContact OE1-NE 3.49Å; E341-R343 IonicContact OE1-NH2 2.71Å; E341-R343 PolarHBondContact OE1-NH2 3.29Å |
| 344 | A | 29.4 | Very low | 33.5 | Very low | 89 Ų | 89 | 148.2 Ų | 148.2 | 74% | 0.736 | 83% | 0.827 | S | S | * | * | P | Polyproline II helix | trans | -92.6 | 130.2 | 159.5 | 0 | 0 | 0 | 0 | 0 | 108.8 | ||
| 345 | P | 39.3 | Very low | 34.3 | Very low | 117 Ų | 117 | 150.7 Ų | 150.7 | 76% | 0.76 | 83% | 0.825 | S | S | * | * | P | Polyproline II helix | trans | -86.3 | 161.2 | 173 | 35 | -33.7 | 0 | 0 | 0 | 112.2 | ||
| 346 | N | 31.8 | Very low | 35.2 | Very low | 151 Ų | 151 | 147.4 Ų | 147.4 | 81% | 0.807 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -70.9 | 160.9 | -174.3 | -38.3 | -20.1 | 0 | 0 | 0 | 113.2 | ||
| 347 | S | 30.1 | Very low | 36.4 | Very low | 122 Ų | 122 | 148.5 Ų | 148.5 | 85% | 0.853 | 81% | 0.809 | S | S | * | * | trans | -148.7 | 138.1 | 145.7 | -72 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 348 | E | 30.4 | Very low | 37.4 | Very low | 190 Ų | 190 | 142.3 Ų | 142.3 | 89% | 0.888 | 79% | 0.788 | S | S | * | * | trans | -87.9 | 179.7 | 168.5 | -49.5 | 156 | 122.3 | 0 | 0 | 107.6 | ||||
| 349 | S | 32.5 | Very low | 39.1 | Very low | 116 Ų | 116 | 137 Ų | 137 | 81% | 0.811 | 77% | 0.772 | S | S | * | * | cis | -157.2 | 156.3 | 4.3 | 53.9 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 350 | A | 30.5 | Very low | 40.7 | Very low | 101 Ų | 101 | 137.2 Ų | 137.2 | 84% | 0.835 | 76% | 0.764 | S | S | * | * | trans | -161.6 | 147.8 | 152.9 | 0 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 351 | E | 41.9 | Very low | 42.1 | Very low | 207 Ų | 207 | 137.5 Ų | 137.5 | 97% | 0.967 | 75% | 0.749 | S | S | * | * | trans | -88.6 | 127.9 | -173.1 | -59.3 | -175.1 | 140.3 | 0 | 0 | 112.2 | ||||
| 352 | E | 36.2 | Very low | 44.2 | Very low | 190 Ų | 190 | 137 Ų | 137 | 89% | 0.888 | 75% | 0.745 | S | S | * | * | trans | -125.8 | 137.4 | 163.4 | -170.1 | 166.6 | -151.9 | 0 | 0 | 109.4 | Q354 | E352-Q354 PolarHBondContact O-N 3.25Š| ||
| 353 | G | 38.2 | Very low | 46.1 | Very low | 65 Ų | 65 | 133.7 Ų | 133.7 | 67% | 0.67 | 72% | 0.722 | S | S | * | * | trans | -63.4 | 118.5 | -163.7 | 0 | 0 | 0 | 0 | 0 | 113.8 | V355 | G353-V355 PolarHBondContact O-N 3.2Š| ||
| 354 | Q | 40 | Very low | 47 | Very low | 199 Ų | 199 | 130.6 Ų | 130.6 | 93% | 0.93 | 72% | 0.724 | S | S | * | * | trans | -73.4 | 86.6 | -175.6 | -165 | 173.7 | 34.8 | 0 | 0 | 112.3 | E352 G356 | E352-Q354 PolarHBondContact O-N 3.25Å; Q354-G356 PolarHBondContact O-N 3.3Å | ||
| 355 | V | 45.3 | Very low | 48.1 | Very low | 137 Ų | 137 | 133.6 Ų | 133.6 | 83% | 0.83 | 73% | 0.728 | S | S | * | * | P | Polyproline II helix | trans | -62.3 | 118 | 179.1 | -174 | 0 | 0 | 0 | 0 | 110.7 | G353 | G353-V355 PolarHBondContact O-N 3.2Š|
| 356 | G | 53.3 | Low | 48.8 | Very low | 55 Ų | 55 | 129.9 Ų | 129.9 | 57% | 0.567 | 71% | 0.71 | S | S | * | * | P | Polyproline II helix | trans | -63.7 | 137.6 | -178.7 | 0 | 0 | 0 | 0 | 0 | 113 | Q354 V358 | Q354-G356 PolarHBondContact O-N 3.3Å; G356-V358 VanDerWaalsContact O-CG2 3.25Å; G356-V358 WeakPolarHBondContact O-CG2 3.49Å; G356-V358 PolarHBondContact O-N 3.5Å |
| 357 | R | 57.5 | Low | 49.4 | Very low | 226 Ų | 226 | 129.1 Ų | 129.1 | 85% | 0.853 | 71% | 0.711 | S | S | * | * | P | Polyproline II helix | trans | -68.7 | 124.7 | 174.9 | -65.3 | 178.1 | 72.1 | -131.5 | 7.8 | 109.7 | ||
| 358 | V | 58 | Low | 50.3 | Low | 77 Ų | 77 | 126.2 Ų | 126.2 | 47% | 0.467 | 69% | 0.69 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -113.3 | 143.9 | -175.9 | -147.2 | 0 | 0 | 0 | 0 | 110.5 | G356 V371 V372 Q373 | G356-V358 VanDerWaalsContact O-CG2 3.25Å; G356-V358 WeakPolarHBondContact O-CG2 3.49Å; G356-V358 PolarHBondContact O-N 3.5Å; V358-V371 HydrophobicContact CG1-CG1 3.36Å; V358-V372 WeakPolarHBondContact CG1-O 3.16Å; V358-Q373 HydrophobicContact CG1-CG 3.83Å |
| 359 | K | 64.6 | Low | 52.4 | Low | 133 Ų | 133 | 124.5 Ų | 124.5 | 58% | 0.578 | 68% | 0.676 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -123.6 | 120 | -174.5 | -158.8 | 172.1 | -173.7 | 175 | 0 | 110.7 | V372 E374 | K359-V372 PolarHBondContact N-O 3.3Å; K359-V372 PolarHBondContact O-N 2.86Å; K359-E374 IonicContact NZ-OE1 3.23Å |
| 360 | L | 63.8 | Low | 54.3 | Low | 108 Ų | 108 | 122.5 Ų | 122.5 | 57% | 0.565 | 65% | 0.654 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -81.3 | 124.8 | 176.5 | -65.7 | 172.5 | 0 | 0 | 0 | 109.9 | W369 E370 V371 | L360-W369 HydrophobicContact CB-CE3 3.94Å; L360-W369 HydrophobicContact CD2-CB 4.32Å; L360-E370 WeakPolarHBondContact CA-O 3.43Å; L360-V371 HydrophobicContact CD2-CG2 3.8Å |
| 361 | R | 72.4 | Confident | 56 | Low | 133 Ų | 133 | 122.2 Ų | 122.2 | 50% | 0.502 | 64% | 0.641 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -108.5 | 131.6 | 167.6 | 66.7 | -178.9 | -177.5 | -152.8 | -1.7 | 110.6 | I363 E370 V372 | R361-I363 PolarHBondContact O-N 3.01Å; R361-E370 HydrophobicContact CG-CB 3.86Å; R361-E370 IonicContact CZ-OE1 2.86Å; R361-E370 IonicContact CZ-OE2 3.66Å; R361-E370 PolarHBondContact N-O 3.07Å; R361-E370 IonicContact NE-OE1 3.78Å; R361-E370 IonicContact NE-OE2 3.4Å; R361-E370 PolarHBondContact NE-OE2 2.76Å; R361-E370 IonicContact NH2-OE1 2.72Å; R361-E370 PolarHBondContact NH2-OE1 2.87Å; R361-E370 IonicContact NH2-OE2 3.4Å; R361-E370 PolarHBondContact NH2-OE2 3.36Å; R361-E370 PolarHBondContact O-N 3Å; R361-V372 HydrophobicContact CG-CG2 4Å |
| 362 | K | 74.5 | Confident | 57.2 | Low | 126 Ų | 126 | 114.3 Ų | 114.3 | 55% | 0.548 | 61% | 0.607 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -75.2 | 118.7 | 174.7 | -168.2 | 166.8 | -177.1 | 169.7 | 0 | 108.5 | W369 | K362-W369 HydrophobicContact CB-CD2 4.34Å; K362-W369 HydrophobicContact CB-CE3 3.8Å; K362-W369 HydrophobicContact CB-CH2 4Å; K362-W369 HydrophobicContact CB-CZ2 4.5Å; K362-W369 HydrophobicContact CB-CZ3 3.62Å; K362-W369 HydrophobicContact CD-CH2 4.14Å; K362-W369 HydrophobicContact CD-CZ2 4.14Å; K362-W369 HydrophobicContact CG-CE3 4.49Å; K362-W369 HydrophobicContact CG-CH2 4.42Å; K362-W369 HydrophobicContact CG-CZ2 4.48Å; K362-W369 HydrophobicContact CG-CZ3 4.43Å |
| 363 | I | 68.1 | Low | 57.9 | Low | 73 Ų | 73 | 112.7 Ų | 112.7 | 37% | 0.374 | 60% | 0.6 | S | S | . | * | P | Polyproline II helix | trans | -71.8 | 141 | 173 | -60.2 | -178.3 | 0 | 0 | 0 | 108.2 | R361 G366 C368 E370 | R361-I363 PolarHBondContact O-N 3.01Å; I363-G366 PolarHBondContact O-N 2.81Å; I363-C368 PolarHBondContact N-O 2.64Å; I363-E370 HydrophobicContact CD1-CB 4.03Å; I363-E370 HydrophobicContact CG1-CB 4.1Å |
| 364 | V | 49.2 | Very low | 58.4 | Low | 128 Ų | 128 | 115 Ų | 115 | 78% | 0.776 | 59% | 0.593 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -58.9 | 140.9 | 177.6 | -173.9 | 0 | 0 | 0 | 0 | 109.4 | G366 | V364-G366 VanDerWaalsContact C-N 3.35Š|
| 365 | N | 51.9 | Low | 58.5 | Low | 152 Ų | 152 | 110.9 Ų | 110.9 | 81% | 0.813 | 58% | 0.584 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 77.5 | 6.4 | -164.7 | -53.3 | -14.6 | 0 | 0 | 0 | 116 | T367 | N365-T367 VanDerWaalsContact C-N 3.32Å; N365-T367 PolarHBondContact O-N 2.75Å |
| 366 | G | 54.1 | Low | 58.3 | Low | 38 Ų | 38 | 110.3 Ų | 110.3 | 39% | 0.392 | 58% | 0.583 | S | S | . | * | S | Bend | trans | 76.3 | -1.8 | 137 | 0 | 0 | 0 | 0 | 0 | 119.3 | I363 V364 | I363-G366 PolarHBondContact O-N 2.81Å; V364-G366 VanDerWaalsContact C-N 3.35Å |
| 367 | T | 45.9 | Very low | 57.6 | Low | 135 Ų | 135 | 115.4 Ų | 115.4 | 83% | 0.828 | 60% | 0.596 | S | S | * | * | S | Bend | trans | -95.9 | -0.3 | -179.8 | 49.7 | 0 | 0 | 0 | 0 | 114.7 | N365 | N365-T367 VanDerWaalsContact C-N 3.32Å; N365-T367 PolarHBondContact O-N 2.75Å |
| 368 | C | 47.9 | Very low | 56.5 | Low | 61 Ų | 61 | 114.4 Ų | 114.4 | 41% | 0.412 | 60% | 0.598 | S | S | . | * | trans | -151.5 | 154 | 177.7 | 50.1 | 0 | 0 | 0 | 0 | 113.2 | I363 | I363-C368 PolarHBondContact N-O 2.64Š| ||
| 369 | W | 74.8 | Confident | 55.3 | Low | 154 Ų | 154 | 118 Ų | 118 | 58% | 0.583 | 61% | 0.614 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -113.5 | 140.7 | 173.6 | -64.6 | 91.7 | 0 | 0 | 0 | 109.6 | L360 K362 | L360-W369 HydrophobicContact CB-CE3 3.94Å; L360-W369 HydrophobicContact CD2-CB 4.32Å; K362-W369 HydrophobicContact CB-CD2 4.34Å; K362-W369 HydrophobicContact CB-CE3 3.8Å; K362-W369 HydrophobicContact CB-CH2 4Å; K362-W369 HydrophobicContact CB-CZ2 4.5Å; K362-W369 HydrophobicContact CB-CZ3 3.62Å; K362-W369 HydrophobicContact CD-CH2 4.14Å; K362-W369 HydrophobicContact CD-CZ2 4.14Å; K362-W369 HydrophobicContact CG-CE3 4.49Å; K362-W369 HydrophobicContact CG-CH2 4.42Å; K362-W369 HydrophobicContact CG-CZ2 4.48Å; K362-W369 HydrophobicContact CG-CZ3 4.43Å |
| 370 | E | 72 | Confident | 54 | Low | 74 Ų | 74 | 117.2 Ų | 117.2 | 35% | 0.346 | 63% | 0.626 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -106.3 | 130.1 | 177.4 | -165.3 | -176.7 | 169 | 0 | 0 | 110.5 | L360 R361 I363 V372 | L360-E370 WeakPolarHBondContact CA-O 3.43Å; R361-E370 HydrophobicContact CG-CB 3.86Å; R361-E370 IonicContact CZ-OE1 2.86Å; R361-E370 IonicContact CZ-OE2 3.66Å; R361-E370 PolarHBondContact N-O 3.07Å; R361-E370 IonicContact NE-OE1 3.78Å; R361-E370 IonicContact NE-OE2 3.4Å; R361-E370 PolarHBondContact NE-OE2 2.76Å; R361-E370 IonicContact NH2-OE1 2.72Å; R361-E370 PolarHBondContact NH2-OE1 2.87Å; R361-E370 IonicContact NH2-OE2 3.4Å; R361-E370 PolarHBondContact NH2-OE2 3.36Å; R361-E370 PolarHBondContact O-N 3Å; I363-E370 HydrophobicContact CD1-CB 4.03Å; I363-E370 HydrophobicContact CG1-CB 4.1Å; E370-V372 PolarHBondContact O-N 2.72Å |
| 371 | V | 66.5 | Low | 52.6 | Low | 96 Ų | 96 | 121.3 Ų | 121.3 | 58% | 0.582 | 64% | 0.642 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -85.3 | 103.7 | -179.5 | -178.6 | 0 | 0 | 0 | 0 | 108.9 | V358 L360 | V358-V371 HydrophobicContact CG1-CG1 3.36Å; L360-V371 HydrophobicContact CD2-CG2 3.8Å |
| 372 | V | 67.9 | Low | 50.5 | Low | 41 Ų | 41 | 122.9 Ų | 122.9 | 25% | 0.248 | 66% | 0.66 | C | S | . | * | E | Extended strand (participates in β ladder) | trans | -101.3 | 115.2 | 175.8 | -174.8 | 0 | 0 | 0 | 0 | 109.5 | V358 K359 R361 E370 | V358-V372 WeakPolarHBondContact CG1-O 3.16Å; K359-V372 PolarHBondContact N-O 3.3Å; K359-V372 PolarHBondContact O-N 2.86Å; R361-V372 HydrophobicContact CG-CG2 4Å; E370-V372 PolarHBondContact O-N 2.72Å |
| 373 | Q | 50.1 | Low | 48.5 | Very low | 156 Ų | 156 | 121.6 Ų | 121.6 | 73% | 0.729 | 67% | 0.667 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -81.5 | 123.4 | 164.2 | -69.1 | 178.8 | 0.2 | 0 | 0 | 108.6 | V358 | V358-Q373 HydrophobicContact CG1-CG 3.83Å |
| 374 | E | 47.9 | Very low | 47.1 | Very low | 114 Ų | 114 | 124 Ų | 124 | 53% | 0.533 | 69% | 0.688 | S | S | . | * | P | Polyproline II helix | trans | -84.7 | 131.3 | 167.2 | -70.4 | 174.6 | -179.4 | 0 | 0 | 108 | K359 | K359-E374 IonicContact NZ-OE1 3.23Š|
| 375 | P | 42.6 | Very low | 46.1 | Very low | 112 Ų | 112 | 127.1 Ų | 127.1 | 73% | 0.727 | 69% | 0.694 | S | S | * | * | P | Polyproline II helix | trans | -65.6 | 147 | 175.8 | 28.3 | -34.3 | 0 | 0 | 0 | 110.3 | L377 | P375-L377 PolarHBondContact O-N 3.01Š|
| 376 | P | 42.3 | Very low | 45.2 | Very low | 125 Ų | 125 | 126.5 Ų | 126.5 | 81% | 0.812 | 69% | 0.689 | S | S | * | * | P | Polyproline II helix | trans | -61.8 | 132.5 | -174.1 | 24.1 | -33.7 | 0 | 0 | 0 | 112 | K378 | P376-K378 PolarHBondContact O-N 2.99Å; P376-K378 VanDerWaalsContact O-N 3.16Å |
| 377 | L | 38.1 | Very low | 44.5 | Very low | 162 Ų | 162 | 130.8 Ų | 130.8 | 85% | 0.848 | 71% | 0.71 | S | S | * | * | trans | -62.9 | 113.5 | 177.4 | -72.5 | 167.4 | 0 | 0 | 0 | 110.3 | P375 N379 | P375-L377 PolarHBondContact O-N 3.01Å; L377-N379 PolarHBondContact O-N 2.98Å | ||
| 378 | K | 34.8 | Very low | 43.8 | Very low | 204 Ų | 204 | 130.6 Ų | 130.6 | 89% | 0.887 | 70% | 0.704 | S | S | * | * | trans | -72.2 | 96.1 | 169.2 | -71.4 | -171.9 | 176 | -174.6 | 0 | 109.5 | P376 S380 | P376-K378 PolarHBondContact O-N 2.99Å; P376-K378 VanDerWaalsContact O-N 3.16Å; K378-S380 PolarHBondContact O-N 2.72Å | ||
| 379 | N | 31.7 | Very low | 43.7 | Very low | 153 Ų | 153 | 133.4 Ų | 133.4 | 82% | 0.818 | 72% | 0.721 | S | S | * | * | trans | -63.4 | 118.5 | 168.6 | -73.5 | -15.3 | 0 | 0 | 0 | 109.5 | L377 Q381 | L377-N379 PolarHBondContact O-N 2.98Å; N379-Q381 PolarHBondContact O-N 2.74Å | ||
| 380 | S | 37.1 | Very low | 41.4 | Very low | 117 Ų | 117 | 129.7 Ų | 129.7 | 82% | 0.818 | 73% | 0.731 | S | S | * | * | trans | -95.4 | 89.8 | -173.9 | 58.1 | 0 | 0 | 0 | 0 | 112 | K378 | K378-S380 PolarHBondContact O-N 2.72Š| ||
| 381 | Q | 34.8 | Very low | 39.2 | Very low | 193 Ų | 193 | 129.9 Ų | 129.9 | 90% | 0.902 | 75% | 0.752 | S | S | * | * | trans | -160.4 | 94.1 | 160.6 | -131.1 | 176.1 | -3.6 | 0 | 0 | 113.1 | N379 | N379-Q381 PolarHBondContact O-N 2.74Š| ||
| 382 | D | 28.7 | Very low | 37.4 | Very low | 167 Ų | 167 | 132 Ų | 132 | 89% | 0.893 | 76% | 0.76 | S | S | * | * | -159.1 | 165 | 121.3 | -146.3 | -17.9 | 0 | 0 | 0 | 110.5 | |||||
| 383 | S | 32.3 | Very low | 35.6 | Very low | 99 Ų | 99 | 138.7 Ų | 138.7 | 69% | 0.692 | 79% | 0.787 | S | S | * | * | trans | -161.2 | 124.5 | -179.8 | 180 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 384 | P | 37.7 | Very low | 34.6 | Very low | 123 Ų | 123 | 139.2 Ų | 139.2 | 80% | 0.799 | 79% | 0.789 | S | S | * | * | trans | -106.8 | 165.1 | 157.4 | 13.7 | 6.8 | 0 | 0 | 0 | 112.5 | ||||
| 385 | Q | 28.3 | Very low | 33.5 | Very low | 194 Ų | 194 | 142.1 Ų | 142.1 | 91% | 0.907 | 80% | 0.803 | S | S | * | * | trans | -93.8 | 169.9 | -167.6 | -64.3 | -174.5 | -9.6 | 0 | 0 | 115.1 | ||||
| 386 | I | 33.5 | Very low | 33.4 | Very low | 138 Ų | 138 | 141.4 Ų | 141.4 | 71% | 0.708 | 80% | 0.798 | S | S | * | * | trans | -66 | 164.2 | 175.9 | -15.3 | 179.4 | 0 | 0 | 0 | 111.9 | ||||
| 387 | P | 39.1 | Very low | 32.6 | Very low | 128 Ų | 128 | 140.6 Ų | 140.6 | 83% | 0.831 | 80% | 0.795 | S | S | * | * | -129.4 | 153.1 | 97.4 | 7.2 | 14.4 | 0 | 0 | 0 | 116.2 | |||||
| 388 | D | 31.2 | Very low | 31.9 | Very low | 132 Ų | 132 | 135.9 Ų | 135.9 | 71% | 0.706 | 79% | 0.786 | S | S | * | * | trans | -59.3 | 175 | 173.2 | -94.3 | -64.9 | 0 | 0 | 0 | 115.6 | ||||
| 389 | P | 46 | Very low | 31.6 | Very low | 120 Ų | 120 | 132.5 Ų | 132.5 | 78% | 0.779 | 78% | 0.782 | S | S | * | * | cis | -141 | 157.2 | 20.8 | 39.2 | -19.8 | 0 | 0 | 0 | 120.3 | ||||
| 390 | G | 26.1 | Very low | 31.4 | Very low | 76 Ų | 76 | 133.3 Ų | 133.3 | 78% | 0.784 | 78% | 0.781 | S | S | * | * | 89 | 134.9 | 128 | 0 | 0 | 0 | 0 | 0 | 119.4 | |||||
| 391 | G | 27.3 | Very low | 31.6 | Very low | 77 Ų | 77 | 132.2 Ų | 132.2 | 79% | 0.794 | 77% | 0.771 | S | S | * | * | trans | 164.7 | 36.7 | 176.6 | 0 | 0 | 0 | 0 | 0 | 118.5 | ||||
| 392 | D | 28.3 | Very low | 31.1 | Very low | 140 Ų | 140 | 132.1 Ų | 132.1 | 75% | 0.749 | 77% | 0.768 | S | S | * | * | trans | 25.9 | 117.7 | 156.1 | -72.4 | -17.4 | 0 | 0 | 0 | 122.3 | ||||
| 393 | F | 28.9 | Very low | 31 | Very low | 183 Ų | 183 | 128.7 Ų | 128.7 | 80% | 0.803 | 76% | 0.757 | S | S | * | * | trans | 69.2 | 115.1 | 134 | -77.1 | -78.6 | 0 | 0 | 0 | 122.9 | ||||
| 394 | Q | 30 | Very low | 30.6 | Very low | 166 Ų | 166 | 129.1 Ų | 129.1 | 78% | 0.776 | 76% | 0.76 | S | S | * | * | 106 | 91.1 | 116.6 | -159.4 | 161.6 | 14.8 | 0 | 0 | 120.6 | |||||
| 395 | E | 24.9 | Very low | 30.1 | Very low | 176 Ų | 176 | 129.3 Ų | 129.3 | 82% | 0.822 | 75% | 0.754 | S | S | * | * | trans | -49.3 | 136.9 | 139.7 | 167.9 | 174.4 | -154.3 | 0 | 0 | 110.5 | ||||
| 396 | P | 40.8 | Very low | 30.1 | Very low | 97 Ų | 97 | 128 Ų | 128 | 63% | 0.63 | 75% | 0.748 | S | S | * | * | -152.7 | 144.4 | 90.6 | 41.9 | -22.1 | 0 | 0 | 0 | 120 | |||||
| 397 | S | 24.9 | Very low | 29.8 | Very low | 108 Ų | 108 | 129.2 Ų | 129.2 | 76% | 0.755 | 75% | 0.751 | S | S | * | * | trans | 39.2 | 133 | 134.3 | 74.9 | 0 | 0 | 0 | 0 | 121.9 | ||||
| 398 | G | 23.8 | Very low | 29.3 | Very low | 63 Ų | 63 | 129.5 Ų | 129.5 | 65% | 0.649 | 74% | 0.741 | S | S | * | * | 127.1 | 121.9 | 108.9 | 0 | 0 | 0 | 0 | 0 | 118.1 | |||||
| 399 | T | 27.5 | Very low | 29 | Very low | 133 Ų | 133 | 130.8 Ų | 130.8 | 82% | 0.816 | 75% | 0.745 | S | S | * | * | trans | 62.6 | 98.2 | 136.5 | -45 | 0 | 0 | 0 | 0 | 118.4 | ||||
| 400 | Q | 28.3 | Very low | 28.1 | Very low | 169 Ų | 169 | 130.4 Ų | 130.4 | 79% | 0.79 | 75% | 0.745 | S | S | * | * | 37.1 | 151.7 | 108 | -61.2 | -74.7 | -9.9 | 0 | 0 | 119.1 | |||||
| 401 | P | 41.8 | Very low | 28.2 | Very low | 95 Ų | 95 | 131.8 Ų | 131.8 | 62% | 0.617 | 74% | 0.743 | S | S | * | * | cis | -144.2 | -172.1 | -1.9 | 26.5 | 0.8 | 0 | 0 | 0 | 116.1 | ||||
| 402 | F | 23 | Very low | 28.3 | Very low | 191 Ų | 191 | 133.5 Ų | 133.5 | 84% | 0.838 | 74% | 0.738 | S | S | * | * | trans | 79.3 | 134.5 | 147.5 | -84.8 | -63.2 | 0 | 0 | 0 | 124.7 | ||||
| 403 | S | 27.4 | Very low | 28.5 | Very low | 95 Ų | 95 | 135.6 Ų | 135.6 | 66% | 0.664 | 74% | 0.736 | S | S | * | * | trans | 64.3 | 104.9 | 141.8 | 65.7 | 0 | 0 | 0 | 0 | 123 | ||||
| 404 | S | 24.2 | Very low | 28.8 | Very low | 107 Ų | 107 | 133.5 Ų | 133.5 | 75% | 0.748 | 73% | 0.731 | S | S | * | * | 70.5 | 126.6 | 111.2 | -57.2 | 0 | 0 | 0 | 0 | 123.2 | |||||
| 405 | N | 26.8 | Very low | 28.9 | Very low | 127 Ų | 127 | 131 Ų | 131 | 68% | 0.679 | 72% | 0.72 | S | S | * | * | trans | 78 | 114.7 | 149.1 | -68.5 | 50.2 | 0 | 0 | 0 | 121.1 | ||||
| 406 | E | 29.1 | Very low | 29.2 | Very low | 166 Ų | 166 | 129.8 Ų | 129.8 | 78% | 0.776 | 72% | 0.718 | S | S | * | * | 56.6 | 115.5 | 125.6 | -58.3 | 171 | 133.6 | 0 | 0 | 120.2 | |||||
| 407 | Q | 26.4 | Very low | 28.7 | Very low | 165 Ų | 165 | 129.8 Ų | 129.8 | 77% | 0.771 | 72% | 0.719 | S | S | * | * | 161.7 | 129.9 | 93.8 | -172.1 | 155.5 | 12.3 | 0 | 0 | 113.9 | |||||
| 408 | E | 28.5 | Very low | 29.1 | Very low | 134 Ų | 134 | 131.4 Ų | 131.4 | 63% | 0.626 | 72% | 0.715 | S | S | * | * | trans | 29.7 | 129.9 | 151.9 | -68.4 | 176 | 116.4 | 0 | 0 | 125.7 | ||||
| 409 | M | 24.9 | Very low | 29.2 | Very low | 158 Ų | 158 | 134.8 Ų | 134.8 | 78% | 0.778 | 72% | 0.718 | S | S | * | * | 92.3 | 144 | 125.5 | -79.2 | -178.3 | -169.7 | 0 | 0 | 124.5 | |||||
| 410 | S | 26.8 | Very low | 29.5 | Very low | 112 Ų | 112 | 132.4 Ų | 132.4 | 78% | 0.783 | 71% | 0.707 | S | S | * | * | trans | 68.5 | 110.4 | 160.9 | 64.7 | 0 | 0 | 0 | 0 | 117.7 | ||||
| 411 | S | 28.3 | Very low | 30.3 | Very low | 106 Ų | 106 | 129.7 Ų | 129.7 | 74% | 0.741 | 70% | 0.704 | S | S | * | * | 94.1 | 147.8 | 81.4 | -139.9 | 0 | 0 | 0 | 0 | 110.8 | |||||
| 412 | T | 28.8 | Very low | 29.6 | Very low | 113 Ų | 113 | 131.4 Ų | 131.4 | 69% | 0.693 | 71% | 0.712 | S | S | * | * | cis | -163 | 151.4 | 32.2 | -17.8 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 413 | R | 34.2 | Very low | 29.7 | Very low | 184 Ų | 184 | 127.9 Ų | 127.9 | 69% | 0.694 | 71% | 0.71 | S | S | * | * | trans | 58.8 | 140.6 | 132.1 | -126.9 | -178.6 | 167.6 | -171.7 | -10.2 | 120 | E415 | R413-E415 WeakPolarHBondContact CD-OE1 3.41Å; R413-E415 WeakPolarHBondContact CG-OE1 3.16Å; R413-E415 IonicContact CZ-OE1 3.59Å; R413-E415 IonicContact CZ-OE2 3.37Å; R413-E415 VanDerWaalsContact NE-CD 3.29Å; R413-E415 IonicContact NE-OE1 3.17Å; R413-E415 PolarHBondContact NE-OE1 3.08Å; R413-E415 IonicContact NE-OE2 3.67Å; R413-E415 PolarHBondContact NE-OE2 2.83Å; R413-E415 IonicContact NH2-OE1 3.59Å; R413-E415 IonicContact NH2-OE2 2.73Å; R413-E415 PolarHBondContact NH2-OE2 3.43Å | ||
| 414 | I | 33.4 | Very low | 29.8 | Very low | 138 Ų | 138 | 129.1 Ų | 129.1 | 71% | 0.708 | 71% | 0.714 | S | S | * | * | -161.6 | 131.6 | 56.5 | -94.4 | 170.5 | 0 | 0 | 0 | 106.9 | |||||
| 415 | E | 31.9 | Very low | 30.1 | Very low | 115 Ų | 115 | 134.4 Ų | 134.4 | 54% | 0.537 | 72% | 0.717 | S | S | . | * | 63.9 | 146.6 | 73.4 | -76.1 | 162 | -126.1 | 0 | 0 | 112.6 | R413 | R413-E415 WeakPolarHBondContact CD-OE1 3.41Å; R413-E415 WeakPolarHBondContact CG-OE1 3.16Å; R413-E415 IonicContact CZ-OE1 3.59Å; R413-E415 IonicContact CZ-OE2 3.37Å; R413-E415 VanDerWaalsContact NE-CD 3.29Å; R413-E415 IonicContact NE-OE1 3.17Å; R413-E415 PolarHBondContact NE-OE1 3.08Å; R413-E415 IonicContact NE-OE2 3.67Å; R413-E415 PolarHBondContact NE-OE2 2.83Å; R413-E415 IonicContact NH2-OE1 3.59Å; R413-E415 IonicContact NH2-OE2 2.73Å; R413-E415 PolarHBondContact NH2-OE2 3.43Å | |||
| 416 | L | 32.3 | Very low | 30 | Very low | 150 Ų | 150 | 134.2 Ų | 134.2 | 79% | 0.785 | 72% | 0.715 | S | S | * | * | cis | -161.1 | 144.8 | 8.1 | -156.9 | 68.6 | 0 | 0 | 0 | 105.4 | ||||
| 417 | C | 29.7 | Very low | 30.3 | Very low | 97 Ų | 97 | 133.9 Ų | 133.9 | 66% | 0.655 | 71% | 0.714 | S | S | * | * | cis | -156.8 | -164.6 | -3.6 | -121.3 | 0 | 0 | 0 | 0 | 106.5 | ||||
| 418 | Q | 34.2 | Very low | 30.2 | Very low | 142 Ų | 142 | 133.3 Ų | 133.3 | 66% | 0.664 | 72% | 0.716 | S | S | * | * | cis | -141.3 | -137 | 3.6 | -134.9 | -36.2 | 76.7 | 0 | 0 | 106.7 | ||||
| 419 | D | 26.2 | Very low | 30.1 | Very low | 133 Ų | 133 | 134.1 Ų | 134.1 | 71% | 0.711 | 72% | 0.723 | S | S | * | * | cis | -162.9 | -163.1 | -9.6 | -119.9 | -22.8 | 0 | 0 | 0 | 106.5 | ||||
| 420 | S | 32.5 | Very low | 30.2 | Very low | 83 Ų | 83 | 134.2 Ų | 134.2 | 58% | 0.58 | 73% | 0.726 | S | S | * | * | -167.6 | 153.4 | -78.5 | 177.4 | 0 | 0 | 0 | 0 | 108.8 | |||||
| 421 | P | 45.8 | Very low | 30.2 | Very low | 113 Ų | 113 | 134.2 Ų | 134.2 | 73% | 0.734 | 72% | 0.721 | S | S | * | * | cis | -109 | 143.2 | 3.2 | 4.6 | 20.6 | 0 | 0 | 0 | 113.9 | ||||
| 422 | V | 26.4 | Very low | 30.1 | Very low | 130 Ų | 130 | 134.5 Ų | 134.5 | 79% | 0.788 | 72% | 0.723 | S | S | * | * | 70.4 | 125.9 | 85.3 | 177.2 | 0 | 0 | 0 | 0 | 113.4 | |||||
| 423 | C | 26.6 | Very low | 29.9 | Very low | 118 Ų | 118 | 133.7 Ų | 133.7 | 80% | 0.797 | 73% | 0.728 | S | S | * | * | cis | -142.2 | 176.1 | 12.4 | -149.6 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 424 | T | 29.2 | Very low | 29.4 | Very low | 120 Ų | 120 | 129.8 Ų | 129.8 | 74% | 0.736 | 73% | 0.729 | S | S | * | * | trans | -134.1 | 153.5 | -169.3 | 55.4 | 0 | 0 | 0 | 0 | 115.8 | ||||
| 425 | R | 29.3 | Very low | 29 | Very low | 219 Ų | 219 | 131.7 Ų | 131.7 | 83% | 0.826 | 74% | 0.735 | S | S | * | * | trans | 76.6 | 139.1 | 141.2 | -87.2 | -178.4 | 167.1 | -154.8 | -2.2 | 122.4 | ||||
| 426 | L | 26.3 | Very low | 28.8 | Very low | 122 Ų | 122 | 131.7 Ų | 131.7 | 64% | 0.639 | 75% | 0.747 | S | S | * | * | trans | 64.5 | 117.7 | 139 | -64.8 | 169.5 | 0 | 0 | 0 | 121.9 | ||||
| 427 | Q | 34.5 | Very low | 29.3 | Very low | 160 Ų | 160 | 129.7 Ų | 129.7 | 75% | 0.748 | 74% | 0.743 | S | S | * | * | trans | 18.4 | 127.3 | 130.9 | -57.6 | -178.2 | 99.8 | 0 | 0 | 119.6 | ||||
| 428 | D | 25.3 | Very low | 29.1 | Very low | 153 Ų | 153 | 132 Ų | 132 | 82% | 0.818 | 75% | 0.749 | S | S | * | * | -178.5 | 177.7 | 104.3 | -97.1 | -29.3 | 0 | 0 | 0 | 113 | |||||
| 429 | I | 26.1 | Very low | 28.8 | Very low | 150 Ų | 150 | 132.7 Ų | 132.7 | 77% | 0.769 | 75% | 0.752 | S | S | * | * | trans | 80.5 | 90 | 162 | -41.4 | -171.5 | 0 | 0 | 0 | 119.6 | ||||
| 430 | L | 26.2 | Very low | 29.6 | Very low | 160 Ų | 160 | 132.2 Ų | 132.2 | 84% | 0.838 | 76% | 0.756 | S | S | * | * | 48.1 | 149.1 | 107 | -143.7 | 78 | 0 | 0 | 0 | 123 | |||||
| 431 | V | 26.4 | Very low | 29.3 | Very low | 112 Ų | 112 | 133.8 Ų | 133.8 | 68% | 0.679 | 76% | 0.762 | S | S | * | * | trans | 102.8 | 95.5 | 155.4 | -170.5 | 0 | 0 | 0 | 0 | 119.4 | ||||
| 432 | S | 27.2 | Very low | 28.4 | Very low | 112 Ų | 112 | 135.5 Ų | 135.5 | 78% | 0.783 | 77% | 0.77 | S | S | * | * | 50.9 | 155.7 | 124.7 | -49.1 | 0 | 0 | 0 | 0 | 125.2 | |||||
| 433 | A | 24.3 | Very low | 28.4 | Very low | 96 Ų | 96 | 136.9 Ų | 136.9 | 79% | 0.793 | 77% | 0.765 | S | S | * | * | trans | 76.3 | 149.4 | 163.1 | 0 | 0 | 0 | 0 | 0 | 117.3 | ||||
| 434 | S | 23.7 | Very low | 28.4 | Very low | 103 Ų | 103 | 137.1 Ų | 137.1 | 72% | 0.72 | 77% | 0.768 | S | S | * | * | cis | -166.6 | 154.1 | -15.4 | 45.5 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 435 | H | 25 | Very low | 28.3 | Very low | 178 Ų | 178 | 137.2 Ų | 137.2 | 82% | 0.824 | 76% | 0.761 | S | S | * | * | trans | 4.2 | 133.9 | 159.3 | -55.1 | -84.6 | 0 | 0 | 0 | 123 | ||||
| 436 | S | 28 | Very low | 28.2 | Very low | 114 Ų | 114 | 136.7 Ų | 136.7 | 80% | 0.797 | 76% | 0.764 | S | S | * | * | trans | 66.8 | 173.4 | 139.1 | -89.9 | 0 | 0 | 0 | 0 | 119 | ||||
| 437 | P | 42.4 | Very low | 28.2 | Very low | 109 Ų | 109 | 134.1 Ų | 134.1 | 71% | 0.708 | 77% | 0.767 | S | S | * | * | cis | -113.4 | -161.7 | 1.2 | 45.4 | -33.3 | 0 | 0 | 0 | 112.3 | ||||
| 438 | D | 26.5 | Very low | 27.9 | Very low | 144 Ų | 144 | 132.5 Ų | 132.5 | 77% | 0.77 | 77% | 0.774 | S | S | * | * | cis | -155.5 | -176.6 | 2.8 | -143.3 | -36.1 | 0 | 0 | 0 | 111.7 | ||||
| 439 | H | 27.6 | Very low | 28 | Very low | 157 Ų | 157 | 130.5 Ų | 130.5 | 73% | 0.727 | 77% | 0.772 | S | S | * | * | trans | -111.6 | 162.8 | 167.7 | -73.2 | -77.7 | 0 | 0 | 0 | 112.3 | V441 | H439-V441 HydrophobicContact CB-CG2 4.35Š| ||
| 440 | P | 42.5 | Very low | 28.5 | Very low | 123 Ų | 123 | 128.7 Ų | 128.7 | 80% | 0.799 | 77% | 0.77 | S | S | * | * | -136 | 140.5 | 89.5 | 23.4 | -3.5 | 0 | 0 | 0 | 112.7 | |||||
| 441 | V | 25.8 | Very low | 28.3 | Very low | 116 Ų | 116 | 128.8 Ų | 128.8 | 70% | 0.703 | 77% | 0.766 | S | S | * | * | 69.6 | 99 | 62.6 | -179 | 0 | 0 | 0 | 0 | 114.7 | H439 | H439-V441 HydrophobicContact CB-CG2 4.35Š| |||
| 442 | V | 26.7 | Very low | 28.4 | Very low | 150 Ų | 150 | 129.9 Ų | 129.9 | 91% | 0.909 | 77% | 0.768 | S | S | * | * | trans | -139.6 | 146.9 | 137.8 | 179.1 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 443 | K | 27.4 | Very low | 28.3 | Very low | 159 Ų | 159 | 129.8 Ų | 129.8 | 69% | 0.691 | 76% | 0.762 | S | S | * | * | trans | -103.5 | 154.5 | -177.3 | -63.8 | 179.9 | 162.3 | -150.9 | 0 | 113.1 | E445 | K443-E445 IonicContact NZ-OE1 2.79Å; K443-E445 PolarHBondContact NZ-OE1 2.94Å | ||
| 444 | S | 26.2 | Very low | 28.3 | Very low | 123 Ų | 123 | 131.9 Ų | 131.9 | 86% | 0.86 | 76% | 0.755 | S | S | * | * | -148.7 | 151.2 | 129.2 | -168 | 0 | 0 | 0 | 0 | 109.6 | |||||
| 445 | E | 26.4 | Very low | 28.6 | Very low | 122 Ų | 122 | 134.8 Ų | 134.8 | 57% | 0.57 | 76% | 0.755 | S | S | * | * | trans | -113.5 | -173.3 | -172 | -67.4 | 164.3 | -177.9 | 0 | 0 | 111.1 | K443 | K443-E445 IonicContact NZ-OE1 2.79Å; K443-E445 PolarHBondContact NZ-OE1 2.94Å | ||
| 446 | F | 27 | Very low | 28.8 | Very low | 207 Ų | 207 | 133.7 Ų | 133.7 | 91% | 0.908 | 75% | 0.75 | S | S | * | * | trans | 75.8 | 127.1 | -179 | -51.9 | -83.5 | 0 | 0 | 0 | 116.8 | ||||
| 447 | G | 26.4 | Very low | 29.1 | Very low | 68 Ų | 68 | 134.2 Ų | 134.2 | 70% | 0.701 | 75% | 0.751 | S | S | * | * | cis | 168.2 | 164.3 | -9.7 | 0 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 448 | S | 28.6 | Very low | 28.2 | Very low | 126 Ų | 126 | 135.4 Ų | 135.4 | 88% | 0.881 | 75% | 0.748 | S | S | * | * | trans | 75.9 | 103 | 162.9 | -49.8 | 0 | 0 | 0 | 0 | 120.1 | ||||
| 449 | S | 27.8 | Very low | 28.4 | Very low | 112 Ų | 112 | 137.3 Ų | 137.3 | 78% | 0.783 | 76% | 0.758 | S | S | * | * | trans | -80.4 | 164.2 | 137.9 | -46.1 | 0 | 0 | 0 | 0 | 109 | ||||
| 450 | P | 36.4 | Very low | 28.4 | Very low | 112 Ų | 112 | 133.3 Ų | 133.3 | 73% | 0.727 | 75% | 0.752 | S | S | * | * | -124 | 168.6 | 62.7 | 38.5 | -24.6 | 0 | 0 | 0 | 112.9 | |||||
| 451 | E | 22.9 | Very low | 27.8 | Very low | 162 Ų | 162 | 135.7 Ų | 135.7 | 76% | 0.757 | 76% | 0.756 | S | S | * | * | 62.5 | 135.2 | 51.9 | -100.6 | -168.4 | 135.9 | 0 | 0 | 112.1 | |||||
| 452 | L | 27.1 | Very low | 28 | Very low | 135 Ų | 135 | 137.1 Ų | 137.1 | 71% | 0.707 | 76% | 0.759 | S | S | * | * | cis | -156.7 | 171.6 | 21.4 | -105.8 | 174.6 | 0 | 0 | 0 | 112 | ||||
| 453 | V | 26 | Very low | 28.1 | Very low | 109 Ų | 109 | 135.6 Ų | 135.6 | 66% | 0.661 | 75% | 0.754 | S | S | * | * | trans | 68.7 | 115.8 | 147.9 | 155.7 | 0 | 0 | 0 | 0 | 117.6 | ||||
| 454 | E | 24.3 | Very low | 28.2 | Very low | 141 Ų | 141 | 139.6 Ų | 139.6 | 66% | 0.659 | 77% | 0.765 | S | S | * | * | 64.9 | 143.4 | 74.6 | -73.5 | -163 | 137.7 | 0 | 0 | 114 | |||||
| 455 | K | 29.3 | Very low | 28.4 | Very low | 164 Ų | 164 | 142.5 Ų | 142.5 | 71% | 0.713 | 77% | 0.765 | S | S | * | * | cis | -158.5 | 171.7 | 25.3 | -138.2 | 167.3 | -176.3 | 78.7 | 0 | 112.6 | ||||
| 456 | E | 30.5 | Very low | 28.8 | Very low | 155 Ų | 155 | 142.3 Ų | 142.3 | 72% | 0.724 | 78% | 0.775 | S | S | * | * | trans | -69.3 | 175.6 | 171.8 | -150.2 | -170.4 | 121 | 0 | 0 | 113.2 | M458 | E456-M458 VanDerWaalsContact OE1-CA 3.31Å; E456-M458 WeakPolarHBondContact OE1-CA 3.44Å; E456-M458 PolarHBondContact OE1-N 3.44Å | ||
| 457 | P | 32.2 | Very low | 28.8 | Very low | 124 Ų | 124 | 142.6 Ų | 142.6 | 81% | 0.805 | 77% | 0.771 | S | S | * | * | -145.8 | 110.7 | 112.6 | 35.9 | -19.8 | 0 | 0 | 0 | 116.5 | |||||
| 458 | M | 24.6 | Very low | 29 | Very low | 134 Ų | 134 | 143.6 Ų | 143.6 | 66% | 0.66 | 77% | 0.773 | S | S | * | * | 54.9 | 100 | 109.4 | -165.7 | -178.6 | -170.4 | 0 | 0 | 117.8 | E456 A460 | E456-M458 VanDerWaalsContact OE1-CA 3.31Å; E456-M458 WeakPolarHBondContact OE1-CA 3.44Å; E456-M458 PolarHBondContact OE1-N 3.44Å; M458-A460 HydrophobicContact CE-CB 4.07Å; M458-A460 HydrophobicContact CG-CB 4.47Å | |||
| 459 | L | 30.5 | Very low | 29.2 | Very low | 185 Ų | 185 | 146.5 Ų | 146.5 | 97% | 0.969 | 77% | 0.77 | S | S | * | * | trans | -121.6 | 97 | 137.9 | -79.1 | -179.9 | 0 | 0 | 0 | 109 | ||||
| 460 | A | 28.1 | Very low | 29.2 | Very low | 72 Ų | 72 | 147.2 Ų | 147.2 | 60% | 0.595 | 77% | 0.765 | S | S | * | * | trans | -92.8 | 133.4 | 172.2 | 0 | 0 | 0 | 0 | 0 | 110.5 | M458 | M458-A460 HydrophobicContact CE-CB 4.07Å; M458-A460 HydrophobicContact CG-CB 4.47Å | ||
| 461 | I | 30.5 | Very low | 29.2 | Very low | 173 Ų | 173 | 148.3 Ų | 148.3 | 89% | 0.887 | 77% | 0.77 | S | S | * | * | trans | -149.1 | 128.4 | 146.8 | -96.1 | 147.6 | 0 | 0 | 0 | 105.8 | ||||
| 462 | D | 28.8 | Very low | 29.7 | Very low | 146 Ų | 146 | 144.3 Ų | 144.3 | 78% | 0.781 | 76% | 0.764 | S | S | * | * | trans | -99.3 | -156.6 | 178.6 | -165.8 | -7.8 | 0 | 0 | 0 | 109.1 | ||||
| 463 | C | 28.6 | Very low | 30.3 | Very low | 118 Ų | 118 | 146 Ų | 146 | 80% | 0.797 | 77% | 0.773 | S | S | * | * | trans | 89.5 | 68 | 173.3 | -57.3 | 0 | 0 | 0 | 0 | 116.3 | E465 | C463-E465 PolarHBondContact O-N 2.99Š| ||
| 464 | R | 30.7 | Very low | 30.7 | Very low | 243 Ų | 243 | 148.7 Ų | 148.7 | 92% | 0.917 | 78% | 0.783 | S | S | * | * | trans | -43.4 | 119 | 140.8 | 171.6 | -162.3 | -169.2 | -135.5 | 8.2 | 112.5 | ||||
| 465 | E | 29.2 | Very low | 31.1 | Very low | 184 Ų | 184 | 151.1 Ų | 151.1 | 86% | 0.86 | 79% | 0.794 | S | S | * | * | trans | -147.2 | 162.5 | 156.4 | -101 | -156.8 | 139.7 | 0 | 0 | 111.5 | C463 | C463-E465 PolarHBondContact O-N 2.99Š| ||
| 466 | P | 34.8 | Very low | 31 | Very low | 119 Ų | 119 | 152.2 Ų | 152.2 | 77% | 0.773 | 80% | 0.802 | S | S | * | * | trans | -89.6 | 146.3 | -157.6 | 34.1 | -36.2 | 0 | 0 | 0 | 115.1 | ||||
| 467 | Y | 27.9 | Very low | 31.1 | Very low | 212 Ų | 212 | 151 Ų | 151 | 83% | 0.831 | 81% | 0.807 | S | S | * | * | trans | -91.4 | 114.3 | 171.1 | -152.7 | -91.9 | 0 | 0 | 0 | 110.9 | ||||
| 468 | A | 29.5 | Very low | 30.9 | Very low | 89 Ų | 89 | 151.1 Ų | 151.1 | 74% | 0.736 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -87.3 | 134.2 | 172.5 | 0 | 0 | 0 | 0 | 0 | 110.4 | ||
| 469 | F | 32.6 | Very low | 31.3 | Very low | 187 Ų | 187 | 154 Ų | 154 | 82% | 0.82 | 82% | 0.822 | S | S | * | * | P | Polyproline II helix | trans | -79.9 | 124.8 | 172.2 | -112.8 | -92.9 | 0 | 0 | 0 | 110.2 | ||
| 470 | D | 28.2 | Very low | 31.6 | Very low | 127 Ų | 127 | 150.2 Ų | 150.2 | 68% | 0.679 | 82% | 0.817 | S | S | * | * | P | Polyproline II helix | trans | -85.6 | 119.4 | 176.9 | -170 | -12.5 | 0 | 0 | 0 | 110.4 | A472 | D470-A472 WeakPolarHBondContact OD1-CB 3.22Å; D470-A472 PolarHBondContact OD1-N 2.98Å |
| 471 | T | 36.3 | Very low | 31.8 | Very low | 136 Ų | 136 | 154.6 Ų | 154.6 | 83% | 0.834 | 83% | 0.825 | S | S | * | * | trans | -94.4 | 11.6 | -176.5 | 55.9 | 0 | 0 | 0 | 0 | 113.6 | L473 | T471-L473 PolarHBondContact O-N 3.01Š| ||
| 472 | A | 34.8 | Very low | 32.2 | Very low | 78 Ų | 78 | 154.7 Ų | 154.7 | 65% | 0.645 | 82% | 0.822 | S | S | * | * | trans | -86.1 | 5.3 | -169.7 | 0 | 0 | 0 | 0 | 0 | 116.9 | D470 | D470-A472 WeakPolarHBondContact OD1-CB 3.22Å; D470-A472 PolarHBondContact OD1-N 2.98Å | ||
| 473 | L | 38 | Very low | 32.4 | Very low | 169 Ų | 169 | 157.6 Ų | 157.6 | 89% | 0.885 | 82% | 0.823 | S | S | * | * | S | Bend | trans | -112.9 | 27.2 | -170.4 | -79.2 | 174.7 | 0 | 0 | 0 | 115.9 | T471 | T471-L473 PolarHBondContact O-N 3.01Š|
| 474 | L | 34.9 | Very low | 32.7 | Very low | 167 Ų | 167 | 162.3 Ų | 162.3 | 87% | 0.874 | 82% | 0.824 | S | S | * | * | trans | -143.3 | 49.2 | 179.2 | -128.8 | 162.9 | 0 | 0 | 0 | 115.1 | ||||
| 475 | E | 32.2 | Very low | 32.9 | Very low | 192 Ų | 192 | 157.7 Ų | 157.7 | 90% | 0.897 | 82% | 0.816 | S | S | * | * | trans | -117.5 | 100.5 | 162.2 | -75.1 | -161.1 | 145.6 | 0 | 0 | 112.1 | ||||
| 476 | Q | 28.2 | Very low | 33.5 | Very low | 187 Ų | 187 | 154.1 Ų | 154.1 | 87% | 0.874 | 81% | 0.807 | S | S | * | * | trans | -136.3 | 131.5 | 147.1 | -79 | -158.1 | -106.1 | 0 | 0 | 108.8 | ||||
| 477 | P | 32.4 | Very low | 34.2 | Very low | 129 Ų | 129 | 154 Ų | 154 | 84% | 0.838 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -81.3 | 129 | -176.5 | 31.2 | -33.7 | 0 | 0 | 0 | 111.9 | ||
| 478 | C | 28.5 | Very low | 35 | Very low | 127 Ų | 127 | 147.4 Ų | 147.4 | 86% | 0.858 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -84.5 | 153.6 | 158.3 | -71.9 | 0 | 0 | 0 | 0 | 110.4 | ||
| 479 | E | 33.1 | Very low | 35.8 | Very low | 195 Ų | 195 | 145.5 Ų | 145.5 | 91% | 0.911 | 78% | 0.783 | S | S | * | * | P | Polyproline II helix | trans | -71.4 | 146.3 | -175.4 | -60.4 | -175.6 | 129.7 | 0 | 0 | 111.9 | E481 | E479-E481 PolarHBondContact O-N 3.1Š|
| 480 | A | 35.4 | Very low | 36.6 | Very low | 105 Ų | 105 | 138.9 Ų | 138.9 | 87% | 0.868 | 76% | 0.763 | S | S | * | * | trans | -87.6 | 103.1 | -174.9 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 481 | E | 34 | Very low | 37.6 | Very low | 164 Ų | 164 | 137 Ų | 137 | 77% | 0.766 | 76% | 0.756 | S | S | * | * | trans | -85.7 | 134.9 | 166.3 | -72.1 | -169.2 | 114.3 | 0 | 0 | 111.5 | E479 Y483 | E479-E481 PolarHBondContact O-N 3.1Å; E481-Y483 WeakPolarHBondContact O-CD2 3.33Å; E481-Y483 PolarHBondContact O-N 3.42Å | ||
| 482 | E | 37.5 | Very low | 38.6 | Very low | 175 Ų | 175 | 133.6 Ų | 133.6 | 82% | 0.818 | 74% | 0.738 | S | S | * | * | trans | -81.5 | 81.9 | -167.3 | -170.2 | -178.1 | -138.4 | 0 | 0 | 111.8 | R484 | E482-R484 PolarHBondContact O-N 2.99Š| ||
| 483 | Y | 33.5 | Very low | 39.7 | Very low | 206 Ų | 206 | 135.4 Ų | 135.4 | 81% | 0.808 | 73% | 0.733 | S | S | * | * | trans | -63.1 | 103.8 | 177.5 | -82.9 | -86.7 | 0 | 0 | 0 | 112.4 | E481 I485 | E481-Y483 WeakPolarHBondContact O-CD2 3.33Å; E481-Y483 PolarHBondContact O-N 3.42Å; Y483-I485 PolarHBondContact O-N 3.18Å; Y483-I485 VanDerWaalsContact O-N 3.1Å | ||
| 484 | R | 35.5 | Very low | 40.6 | Very low | 218 Ų | 218 | 132.4 Ų | 132.4 | 82% | 0.823 | 72% | 0.717 | S | S | * | * | trans | -68.7 | 101.8 | 164.7 | -65.9 | -177.2 | -176.3 | 173.9 | 2.7 | 109.3 | E482 T486 | E482-R484 PolarHBondContact O-N 2.99Å; R484-T486 PolarHBondContact O-N 3.1Å | ||
| 485 | I | 35.4 | Very low | 41.9 | Very low | 146 Ų | 146 | 129 Ų | 129 | 75% | 0.749 | 70% | 0.697 | S | S | * | * | trans | -62.4 | 106.4 | 176.4 | -56.2 | 173.7 | 0 | 0 | 0 | 109.3 | Y483 | Y483-I485 PolarHBondContact O-N 3.18Å; Y483-I485 VanDerWaalsContact O-N 3.1Å | ||
| 486 | T | 40.3 | Very low | 43.3 | Very low | 108 Ų | 108 | 126.2 Ų | 126.2 | 66% | 0.663 | 68% | 0.684 | S | S | * | * | trans | -80.8 | 141.8 | 162.9 | 47.5 | 0 | 0 | 0 | 0 | 109.1 | R484 A488 A489 | R484-T486 PolarHBondContact O-N 3.1Å; T486-A488 PolarHBondContact O-N 3.08Å; T486-A489 PolarHBondContact O-N 3.25Å | ||
| 487 | S | 49.8 | Very low | 44.9 | Very low | 116 Ų | 116 | 121.6 Ų | 121.6 | 81% | 0.811 | 66% | 0.664 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -64.9 | 0.5 | -163.2 | -38.5 | 0 | 0 | 0 | 0 | 116.7 | ||
| 488 | A | 45.5 | Very low | 46.2 | Very low | 74 Ų | 74 | 119.8 Ų | 119.8 | 61% | 0.612 | 65% | 0.647 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -88.5 | -23.5 | -177.1 | 0 | 0 | 0 | 0 | 0 | 114 | T486 T491 | T486-A488 PolarHBondContact O-N 3.08Å; A488-T491 PolarHBondContact O-OG1 3Å; A488-T491 VanDerWaalsContact O-OG1 3.08Å |
| 489 | A | 44.9 | Very low | 47.8 | Very low | 49 Ų | 49 | 116.6 Ų | 116.6 | 41% | 0.405 | 62% | 0.621 | S | S | . | * | H | α-helix | trans | -66.8 | -38.9 | -179.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | T486 T491 S492 | T486-A489 PolarHBondContact O-N 3.25Å; A489-T491 PolarHBondContact O-N 2.82Å; A489-T491 VanDerWaalsContact O-N 3.07Å; A489-S492 WeakPolarHBondContact O-CB 3.39Å; A489-S492 PolarHBondContact O-N 2.86Å |
| 490 | A | 51.1 | Low | 48.9 | Very low | 48 Ų | 48 | 115.4 Ų | 115.4 | 40% | 0.397 | 61% | 0.613 | S | S | . | * | H | α-helix | trans | -65.9 | -12.3 | -173.3 | 0 | 0 | 0 | 0 | 0 | 115.2 | L494 | A490-L494 WeakPolarHBondContact O-CD1 3.47Å; A490-L494 WeakPolarHBondContact O-CG 3.49Å |
| 491 | T | 48.9 | Very low | 49.4 | Very low | 87 Ų | 87 | 116.3 Ų | 116.3 | 53% | 0.534 | 60% | 0.601 | S | S | . | * | H | α-helix | trans | -83.6 | -31.9 | 171.1 | 49 | 0 | 0 | 0 | 0 | 112.5 | A488 A489 L494 E495 | A488-T491 PolarHBondContact O-OG1 3Å; A488-T491 VanDerWaalsContact O-OG1 3.08Å; A489-T491 PolarHBondContact O-N 2.82Å; A489-T491 VanDerWaalsContact O-N 3.07Å; T491-L494 PolarHBondContact O-N 3.12Å; T491-E495 PolarHBondContact O-N 3.29Å |
| 492 | S | 57.2 | Low | 50.6 | Low | 66 Ų | 66 | 115.3 Ų | 115.3 | 46% | 0.462 | 60% | 0.6 | S | S | . | * | H | α-helix | trans | -66.4 | -49 | 178.3 | -159.9 | 0 | 0 | 0 | 0 | 110.8 | A489 L494 E495 E496 | A489-S492 WeakPolarHBondContact O-CB 3.39Å; A489-S492 PolarHBondContact O-N 2.86Å; S492-L494 PolarHBondContact O-N 3.1Å; S492-E495 PolarHBondContact O-N 3.14Å; S492-E496 PolarHBondContact O-N 2.88Å |
| 493 | E | 58 | Low | 51.3 | Low | 116 Ų | 116 | 112.4 Ų | 112.4 | 54% | 0.542 | 60% | 0.598 | S | S | . | * | H | α-helix | trans | -58.7 | -35.2 | 176.8 | -63.5 | 172 | -163.7 | 0 | 0 | 111.9 | I497 | E493-I497 WeakPolarHBondContact O-CB 3.43Å; E493-I497 WeakPolarHBondContact O-CD1 3.3Å; E493-I497 WeakPolarHBondContact O-CG1 3.48Å; E493-I497 PolarHBondContact O-N 3.38Å |
| 494 | L | 57.1 | Low | 51.7 | Low | 105 Ų | 105 | 105.4 Ų | 105.4 | 55% | 0.55 | 59% | 0.588 | S | S | . | * | H | α-helix | trans | -73.6 | -32.6 | 176 | -79.4 | 173.7 | 0 | 0 | 0 | 113.2 | A490 T491 S492 L498 | A490-L494 WeakPolarHBondContact O-CD1 3.47Å; A490-L494 WeakPolarHBondContact O-CG 3.49Å; T491-L494 PolarHBondContact O-N 3.12Å; S492-L494 PolarHBondContact O-N 3.1Å; L494-L498 WeakPolarHBondContact O-CB 3.35Å; L494-L498 WeakPolarHBondContact O-CD1 3.29Å; L494-L498 WeakPolarHBondContact O-CG 3.42Å; L494-L498 PolarHBondContact O-N 3.38Å; L494-L498 VanDerWaalsContact O-N 3.1Å |
| 495 | E | 61.2 | Low | 51.9 | Low | 97 Ų | 97 | 99.7 Ų | 99.7 | 45% | 0.453 | 58% | 0.582 | S | S | . | * | H | α-helix | trans | -72.7 | -39.2 | 173.9 | -71.6 | -171.5 | 118.9 | 0 | 0 | 111.4 | R15 T491 S492 L498 D499 | R15-E495 IonicContact CZ-OE1 3.65Å; R15-E495 IonicContact NE-OE1 2.7Å; R15-E495 IonicContact NH2-OE1 3.2Å; R15-E495 PolarHBondContact NH2-OE1 3.25Å; T491-E495 PolarHBondContact O-N 3.29Å; S492-E495 PolarHBondContact O-N 3.14Å; E495-L498 PolarHBondContact O-N 3.4Å; E495-D499 PolarHBondContact O-N 3.16Å |
| 496 | E | 62.6 | Low | 52.1 | Low | 132 Ų | 132 | 100.3 Ų | 100.3 | 62% | 0.617 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -62.1 | -43 | 172.1 | -70.9 | 177.6 | 163 | 0 | 0 | 112.4 | S492 L498 D499 F500 | S492-E496 PolarHBondContact O-N 2.88Å; E496-L498 VanDerWaalsContact C-N 3.3Å; E496-L498 PolarHBondContact O-N 3.22Å; E496-D499 PolarHBondContact O-N 3.45Å; E496-F500 WeakPolarHBondContact O-CB 3.42Å; E496-F500 PolarHBondContact O-N 3.08Å |
| 497 | I | 59.8 | Low | 52 | Low | 91 Ų | 91 | 103.3 Ų | 103.3 | 47% | 0.467 | 60% | 0.597 | S | S | . | * | H | α-helix | trans | -64.7 | -34 | 175.4 | -71.9 | 165.4 | 0 | 0 | 0 | 111.6 | E493 M501 | E493-I497 WeakPolarHBondContact O-CB 3.43Å; E493-I497 WeakPolarHBondContact O-CD1 3.3Å; E493-I497 WeakPolarHBondContact O-CG1 3.48Å; E493-I497 PolarHBondContact O-N 3.38Å; I497-M501 HydrophobicContact CG2-CE 4.24Å; I497-M501 WeakPolarHBondContact O-CG 3.28Å; I497-M501 PolarHBondContact O-N 3.45Å; I497-M501 VanDerWaalsContact O-N 3.11Å |
| 498 | L | 60.9 | Low | 51.2 | Low | 91 Ų | 91 | 106.8 Ų | 106.8 | 48% | 0.476 | 60% | 0.6 | S | S | . | * | H | α-helix | trans | -72.4 | -42.6 | 176.5 | -77 | 166.9 | 0 | 0 | 0 | 112.2 | L494 E495 E496 M501 L502 | L494-L498 WeakPolarHBondContact O-CB 3.35Å; L494-L498 WeakPolarHBondContact O-CD1 3.29Å; L494-L498 WeakPolarHBondContact O-CG 3.42Å; L494-L498 PolarHBondContact O-N 3.38Å; L494-L498 VanDerWaalsContact O-N 3.1Å; E495-L498 PolarHBondContact O-N 3.4Å; E496-L498 VanDerWaalsContact C-N 3.3Å; E496-L498 PolarHBondContact O-N 3.22Å; L498-M501 HydrophobicContact CD2-CE 3.86Å; L498-M501 PolarHBondContact O-N 3.05Å; L498-L502 VanDerWaalsContact O-CG 3.3Å; L498-L502 WeakPolarHBondContact O-CG 3.44Å; L498-L502 PolarHBondContact O-N 3.09Å; L498-L502 VanDerWaalsContact O-N 3.14Å |
| 499 | D | 62.8 | Low | 51 | Low | 59 Ų | 59 | 108.1 Ų | 108.1 | 32% | 0.316 | 60% | 0.603 | S | S | . | * | H | α-helix | trans | -60.9 | -45.3 | 172.5 | -99.5 | 25.7 | 0 | 0 | 0 | 110.9 | R18 E495 E496 M501 L502 C503 | R18-D499 IonicContact CZ-OD2 3.65Å; R18-D499 VanDerWaalsContact NH1-CG 3.3Å; R18-D499 IonicContact NH1-OD1 2.64Å; R18-D499 PolarHBondContact NH1-OD1 3.35Å; R18-D499 IonicContact NH1-OD2 3.87Å; R18-D499 PolarHBondContact NH1-OD2 2.92Å; R18-D499 IonicContact NH2-OD2 2.76Å; R18-D499 PolarHBondContact NH2-OD2 3.22Å; E495-D499 PolarHBondContact O-N 3.16Å; E496-D499 PolarHBondContact O-N 3.45Å; D499-M501 VanDerWaalsContact C-N 3.31Å; D499-M501 PolarHBondContact O-N 3.26Å; D499-L502 PolarHBondContact O-N 3.19Å; D499-C503 PolarHBondContact O-N 3.31Å; D499-C503 PolarHBondContact O-SG 3.41Å |
| 500 | F | 54.9 | Low | 50.8 | Low | 170 Ų | 170 | 111.8 Ų | 111.8 | 75% | 0.746 | 62% | 0.622 | S | S | * | * | H | α-helix | trans | -59.9 | -37.5 | 177.1 | -176.4 | -97.8 | 0 | 0 | 0 | 113 | E496 L502 | E496-F500 WeakPolarHBondContact O-CB 3.42Å; E496-F500 PolarHBondContact O-N 3.08Å; F500-L502 VanDerWaalsContact C-N 3.32Å |
| 501 | M | 46.9 | Very low | 49.8 | Very low | 125 Ų | 125 | 117.6 Ų | 117.6 | 62% | 0.616 | 65% | 0.645 | S | S | * | * | H | α-helix | trans | -74.1 | -18.5 | 174.5 | -73.1 | -168.8 | -55.4 | 0 | 0 | 113.9 | I497 L498 D499 | I497-M501 HydrophobicContact CG2-CE 4.24Å; I497-M501 WeakPolarHBondContact O-CG 3.28Å; I497-M501 PolarHBondContact O-N 3.45Å; I497-M501 VanDerWaalsContact O-N 3.11Å; L498-M501 HydrophobicContact CD2-CE 3.86Å; L498-M501 PolarHBondContact O-N 3.05Å; D499-M501 VanDerWaalsContact C-N 3.31Å; D499-M501 PolarHBondContact O-N 3.26Å |
| 502 | L | 59 | Low | 49 | Very low | 142 Ų | 142 | 116.9 Ų | 116.9 | 74% | 0.743 | 66% | 0.655 | S | S | * | * | H | α-helix | trans | -89.5 | -24.7 | 177.8 | -71.9 | 169.1 | 0 | 0 | 0 | 112.9 | L498 D499 F500 G504 | L498-L502 VanDerWaalsContact O-CG 3.3Å; L498-L502 WeakPolarHBondContact O-CG 3.44Å; L498-L502 PolarHBondContact O-N 3.09Å; L498-L502 VanDerWaalsContact O-N 3.14Å; D499-L502 PolarHBondContact O-N 3.19Å; F500-L502 VanDerWaalsContact C-N 3.32Å; L502-G504 PolarHBondContact O-N 3.06Å |
| 503 | C | 51.6 | Low | 47.6 | Very low | 115 Ų | 115 | 119.5 Ų | 119.5 | 78% | 0.777 | 67% | 0.673 | S | S | * | * | S | Bend | trans | -80.4 | 14.8 | 173 | -63.6 | 0 | 0 | 0 | 0 | 113.9 | D499 | D499-C503 PolarHBondContact O-N 3.31Å; D499-C503 PolarHBondContact O-SG 3.41Å |
| 504 | G | 42.3 | Very low | 46.5 | Very low | 58 Ų | 58 | 121.6 Ų | 121.6 | 60% | 0.598 | 69% | 0.687 | S | S | * | * | trans | -101.9 | 19.2 | -156 | 0 | 0 | 0 | 0 | 0 | 118.9 | L502 | L502-G504 PolarHBondContact O-N 3.06Š| ||
| 505 | S | 38.9 | Very low | 45.1 | Very low | 98 Ų | 98 | 125.9 Ų | 125.9 | 69% | 0.685 | 71% | 0.705 | S | S | * | * | trans | -162.9 | 122.3 | 172.2 | 54.6 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 506 | D | 39.9 | Very low | 43.8 | Very low | 159 Ų | 159 | 126.4 Ų | 126.4 | 85% | 0.85 | 72% | 0.719 | S | S | * | * | trans | 138.8 | 73.3 | 142.3 | -71.8 | -3.1 | 0 | 0 | 0 | 114.3 | ||||
| 507 | I | 37.9 | Very low | 42.8 | Very low | 172 Ų | 172 | 126.1 Ų | 126.1 | 88% | 0.882 | 73% | 0.728 | S | S | * | * | trans | -137.2 | 104.2 | 158.4 | -55.9 | 179.8 | 0 | 0 | 0 | 109.3 | ||||
| 508 | E | 33.7 | Very low | 41.2 | Very low | 189 Ų | 189 | 125.6 Ų | 125.6 | 88% | 0.883 | 75% | 0.746 | S | S | * | * | trans | -144.6 | 127.4 | 156.2 | -167.1 | 168.6 | -132.8 | 0 | 0 | 108.9 | ||||
| 509 | P | 41.6 | Very low | 40.1 | Very low | 102 Ų | 102 | 126.3 Ų | 126.3 | 66% | 0.662 | 77% | 0.765 | S | S | * | * | trans | -92.9 | 137.1 | -169.8 | 34 | -33.9 | 0 | 0 | 0 | 113.4 | I511 | P509-I511 PolarHBondContact O-N 3.47Š| ||
| 510 | P | 39.3 | Very low | 38.6 | Very low | 125 Ų | 125 | 133.1 Ų | 133.1 | 81% | 0.812 | 80% | 0.795 | S | S | * | * | trans | -76.8 | 110.5 | 170.7 | 30.3 | -32.4 | 0 | 0 | 0 | 111.2 | G512 | P510-G512 PolarHBondContact O-N 3.27Š| ||
| 511 | I | 31.5 | Very low | 37.4 | Very low | 171 Ų | 171 | 128.1 Ų | 128.1 | 88% | 0.877 | 79% | 0.791 | S | S | * | * | trans | -71.8 | 119.9 | 163.6 | -62.1 | 173.7 | 0 | 0 | 0 | 107.6 | P509 | P509-I511 PolarHBondContact O-N 3.47Š| ||
| 512 | G | 32.1 | Very low | 36.6 | Very low | 72 Ų | 72 | 128.7 Ų | 128.7 | 74% | 0.742 | 81% | 0.806 | S | S | * | * | trans | -97.2 | -176.7 | -165.6 | 0 | 0 | 0 | 0 | 0 | 116.6 | P510 | P510-G512 PolarHBondContact O-N 3.27Š| ||
| 513 | S | 27.2 | Very low | 35.2 | Very low | 121 Ų | 121 | 133.4 Ų | 133.4 | 85% | 0.846 | 81% | 0.814 | S | S | * | * | trans | -152.5 | 164.6 | 162.4 | -168.8 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 514 | L | 35.3 | Very low | 34.3 | Very low | 160 Ų | 160 | 133.6 Ų | 133.6 | 84% | 0.838 | 81% | 0.812 | S | S | * | * | trans | -71.3 | 143.7 | -179.2 | -66 | 82.8 | 0 | 0 | 0 | 112.3 | ||||
| 515 | E | 27.1 | Very low | 33.9 | Very low | 195 Ų | 195 | 135.3 Ų | 135.3 | 91% | 0.911 | 81% | 0.812 | S | S | * | * | -157.7 | 160.5 | 114.9 | -130.7 | 175.1 | 171.1 | 0 | 0 | 111.2 | |||||
| 516 | S | 34.2 | Very low | 33.4 | Very low | 108 Ų | 108 | 135.9 Ų | 135.9 | 76% | 0.755 | 81% | 0.812 | S | S | * | * | trans | -133.7 | 143.6 | 174.7 | 66.6 | 0 | 0 | 0 | 0 | 111 | ||||
| 517 | P | 41.4 | Very low | 33 | Very low | 125 Ų | 125 | 138.5 Ų | 138.5 | 81% | 0.812 | 81% | 0.811 | S | S | * | * | trans | -143.7 | 154.5 | 145.8 | 37.3 | -23.7 | 0 | 0 | 0 | 114.5 | ||||
| 518 | G | 27.3 | Very low | 32.6 | Very low | 81 Ų | 81 | 138 Ų | 138 | 84% | 0.835 | 81% | 0.805 | S | S | * | * | trans | 70.3 | 112.5 | 141.4 | 0 | 0 | 0 | 0 | 0 | 118.7 | ||||
| 519 | A | 37.1 | Very low | 32.6 | Very low | 106 Ų | 106 | 137.3 Ų | 137.3 | 88% | 0.876 | 81% | 0.807 | S | S | * | * | trans | -85.3 | 131.7 | 166.2 | 0 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 520 | E | 31 | Very low | 32.2 | Very low | 201 Ų | 201 | 138.8 Ų | 138.8 | 94% | 0.939 | 81% | 0.814 | S | S | * | * | trans | -150.7 | 117.3 | 168.9 | -136.9 | 166 | -140.6 | 0 | 0 | 114 | ||||
| 521 | G | 30.1 | Very low | 32 | Very low | 66 Ų | 66 | 141.7 Ų | 141.7 | 68% | 0.68 | 82% | 0.817 | S | S | * | * | trans | 58.2 | 80.4 | 149 | 0 | 0 | 0 | 0 | 0 | 121 | R523 | G521-R523 PolarHBondContact O-N 3.2Š| ||
| 522 | C | 30.2 | Very low | 32.1 | Very low | 137 Ų | 137 | 140.3 Ų | 140.3 | 93% | 0.926 | 82% | 0.816 | S | S | * | * | trans | -60.4 | 107.7 | 157.8 | -62.2 | 0 | 0 | 0 | 0 | 111 | ||||
| 523 | R | 30.4 | Very low | 31.9 | Very low | 240 Ų | 240 | 140 Ų | 140 | 91% | 0.906 | 81% | 0.813 | S | S | * | * | trans | -104 | 99.5 | 172.3 | -80.6 | -166.9 | 173.2 | -149.3 | 0.2 | 111.9 | G521 | G521-R523 PolarHBondContact O-N 3.2Š| ||
| 524 | T | 32.3 | Very low | 32.3 | Very low | 120 Ų | 120 | 143.6 Ų | 143.6 | 74% | 0.736 | 81% | 0.813 | S | S | * | * | trans | -65.6 | 133 | 167.3 | -39.2 | 0 | 0 | 0 | 0 | 110.3 | T526 | T524-T526 PolarHBondContact O-N 2.79Å; T524-T526 VanDerWaalsContact O-N 3.12Å | ||
| 525 | P | 33.4 | Very low | 32.5 | Very low | 93 Ų | 93 | 143 Ų | 143 | 60% | 0.604 | 81% | 0.811 | S | S | * | * | trans | -75.8 | 99.1 | 175.2 | 29.1 | -33.1 | 0 | 0 | 0 | 111.1 | Y527 | P525-Y527 HydrophobicContact CB-CE2 4.21Å; P525-Y527 HydrophobicContact CG-CE2 4.35Å; P525-Y527 WeakPolarHBondContact O-CD2 3.25Å; P525-Y527 PolarHBondContact O-N 3.06Å | ||
| 526 | T | 27.6 | Very low | 32.6 | Very low | 111 Ų | 111 | 145.6 Ų | 145.6 | 68% | 0.681 | 81% | 0.812 | S | S | * | * | trans | -75.9 | 100.6 | 173.5 | -49.3 | 0 | 0 | 0 | 0 | 110.6 | T524 H528 | T524-T526 PolarHBondContact O-N 2.79Å; T524-T526 VanDerWaalsContact O-N 3.12Å; T526-H528 PolarHBondContact O-N 3.21Å; T526-H528 VanDerWaalsContact O-N 3.09Å | ||
| 527 | Y | 32.5 | Very low | 32.6 | Very low | 213 Ų | 213 | 147.9 Ų | 147.9 | 84% | 0.835 | 81% | 0.813 | S | S | * | * | trans | -73.4 | 97.8 | 173.6 | -71.8 | -82.4 | 0 | 0 | 0 | 111.1 | P525 | P525-Y527 HydrophobicContact CB-CE2 4.21Å; P525-Y527 HydrophobicContact CG-CE2 4.35Å; P525-Y527 WeakPolarHBondContact O-CD2 3.25Å; P525-Y527 PolarHBondContact O-N 3.06Å | ||
| 528 | H | 30.2 | Very low | 32.4 | Very low | 162 Ų | 162 | 150.8 Ų | 150.8 | 75% | 0.75 | 82% | 0.816 | S | S | * | * | trans | -77.4 | 120.3 | 166.4 | -82.9 | -87.4 | 0 | 0 | 0 | 110.2 | T526 | T526-H528 PolarHBondContact O-N 3.21Å; T526-H528 VanDerWaalsContact O-N 3.09Å | ||
| 529 | L | 33.3 | Very low | 32.7 | Very low | 175 Ų | 175 | 150.4 Ų | 150.4 | 92% | 0.916 | 81% | 0.812 | S | S | * | * | trans | -83.8 | 118.5 | 172.5 | -155.1 | 77.7 | 0 | 0 | 0 | 109.2 | ||||
| 530 | T | 33.2 | Very low | 32.6 | Very low | 132 Ų | 132 | 154 Ų | 154 | 81% | 0.81 | 81% | 0.811 | S | S | * | * | trans | -113.4 | 113.3 | 169.9 | 52.1 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 531 | E | 34.4 | Very low | 32.7 | Very low | 187 Ų | 187 | 152.9 Ų | 152.9 | 87% | 0.874 | 81% | 0.806 | S | S | * | * | trans | -75.2 | 123.9 | -178.6 | 178.8 | -176.8 | -168 | 0 | 0 | 112.2 | ||||
| 532 | T | 34.1 | Very low | 32.8 | Very low | 142 Ų | 142 | 161.1 Ų | 161.1 | 87% | 0.871 | 82% | 0.816 | S | S | * | * | trans | 162.5 | 120.8 | 152.3 | -74.8 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 533 | G | 28.7 | Very low | 33 | Very low | 65 Ų | 65 | 159.2 Ų | 159.2 | 67% | 0.67 | 80% | 0.804 | S | S | * | * | cis | 161.5 | 169.8 | -7.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 534 | K | 34.8 | Very low | 33.2 | Very low | 197 Ų | 197 | 155.5 Ų | 155.5 | 86% | 0.857 | 80% | 0.801 | S | S | * | * | trans | 81.4 | 116.8 | 167.6 | -58.6 | 177.5 | -177.9 | 175.5 | 0 | 118.9 | ||||
| 535 | N | 39.1 | Very low | 33.4 | Very low | 146 Ų | 146 | 155.6 Ų | 155.6 | 78% | 0.781 | 80% | 0.803 | S | S | * | * | trans | 79 | 87.7 | 139.1 | -56 | 10.5 | 0 | 0 | 0 | 119.4 | ||||
| 536 | W | 30.4 | Very low | 33.3 | Very low | 250 Ų | 250 | 158.4 Ų | 158.4 | 95% | 0.947 | 81% | 0.813 | S | S | * | * | -127.5 | 139.1 | 124.3 | 44.4 | -77.2 | 0 | 0 | 0 | 107.6 | |||||
| 537 | M | 33.6 | Very low | 33.6 | Very low | 157 Ų | 157 | 161.3 Ų | 161.3 | 77% | 0.773 | 82% | 0.821 | S | S | * | * | trans | -106.9 | 142.6 | 178.7 | -58.2 | -163.8 | -41.5 | 0 | 0 | 109.7 | ||||
| 538 | E | 36.5 | Very low | 34 | Very low | 186 Ų | 186 | 159.7 Ų | 159.7 | 87% | 0.869 | 82% | 0.821 | S | S | * | * | trans | 57.4 | 101.1 | 133.7 | -163.4 | 163.4 | -133.8 | 0 | 0 | 117.6 | ||||
| 539 | G | 33.9 | Very low | 34 | Very low | 73 Ų | 73 | 158.3 Ų | 158.3 | 75% | 0.753 | 82% | 0.819 | S | S | * | * | trans | -178.4 | 97.7 | 173 | 0 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 540 | E | 35.7 | Very low | 34.1 | Very low | 182 Ų | 182 | 161 Ų | 161 | 85% | 0.85 | 82% | 0.817 | S | S | * | * | trans | 64.2 | 91.5 | 156.2 | -58.5 | -177.2 | -178.6 | 0 | 0 | 118.1 | ||||
| 541 | E | 32.9 | Very low | 34.2 | Very low | 177 Ų | 177 | 159.9 Ų | 159.9 | 83% | 0.827 | 81% | 0.812 | S | S | * | * | trans | -80.3 | 127.2 | 171.9 | -179.8 | 175.8 | -140.5 | 0 | 0 | 111.8 | ||||
| 542 | W | 30.8 | Very low | 34.1 | Very low | 238 Ų | 238 | 162.9 Ų | 162.9 | 90% | 0.902 | 82% | 0.815 | S | S | * | * | trans | -99.5 | 93.2 | 172.2 | -80.7 | 91.5 | 0 | 0 | 0 | 110.8 | L544 | W542-L544 PolarHBondContact O-N 3.49Š| ||
| 543 | C | 34.5 | Very low | 34.1 | Very low | 98 Ų | 98 | 164.9 Ų | 164.9 | 66% | 0.662 | 82% | 0.815 | S | S | * | * | P | Polyproline II helix | trans | -66.6 | 129.1 | 178.8 | -50.5 | 0 | 0 | 0 | 0 | 112 | ||
| 544 | L | 35.8 | Very low | 34.3 | Very low | 162 Ų | 162 | 169.3 Ų | 169.3 | 85% | 0.848 | 82% | 0.822 | S | S | * | * | P | Polyproline II helix | trans | -103.3 | 140.6 | 157.7 | -69.1 | 173.2 | 0 | 0 | 0 | 108.2 | W542 | W542-L544 PolarHBondContact O-N 3.49Š|
| 545 | P | 35.9 | Very low | 34 | Very low | 121 Ų | 121 | 167 Ų | 167 | 79% | 0.786 | 82% | 0.824 | S | S | * | * | P | Polyproline II helix | trans | -75.2 | 141.6 | -176.8 | 30.4 | -34.7 | 0 | 0 | 0 | 112.1 | ||
| 546 | D | 30.7 | Very low | 33.6 | Very low | 152 Ų | 152 | 168.2 Ų | 168.2 | 81% | 0.813 | 83% | 0.826 | S | S | * | * | P | Polyproline II helix | trans | -62.1 | 147.7 | 177.9 | -75.9 | -62.4 | 0 | 0 | 0 | 113.9 | ||
| 547 | M | 33.8 | Very low | 33.6 | Very low | 173 Ų | 173 | 163.2 Ų | 163.2 | 85% | 0.852 | 82% | 0.817 | S | S | * | * | trans | -124.5 | 79.4 | 165.9 | -94.7 | -174.6 | 56.1 | 0 | 0 | 110 | L549 | M547-L549 PolarHBondContact O-N 3.41Š| ||
| 548 | E | 40.9 | Very low | 33.4 | Very low | 178 Ų | 178 | 164 Ų | 164 | 83% | 0.832 | 82% | 0.819 | S | S | * | * | trans | -77.6 | 95.5 | 174.3 | -69.7 | -160.9 | 128.7 | 0 | 0 | 112.4 | ||||
| 549 | L | 30.5 | Very low | 33.2 | Very low | 134 Ų | 134 | 164.7 Ų | 164.7 | 70% | 0.702 | 82% | 0.819 | S | S | * | * | trans | -148 | 118.5 | 163.9 | -68.1 | 176.8 | 0 | 0 | 0 | 106.1 | M547 | M547-L549 PolarHBondContact O-N 3.41Š| ||
| 550 | W | 35.2 | Very low | 32.9 | Very low | 231 Ų | 231 | 169.9 Ų | 169.9 | 88% | 0.875 | 82% | 0.823 | S | S | * | * | cis | -142.6 | 173.3 | 30.4 | -80.7 | 76.8 | 0 | 0 | 0 | 112 | ||||
| 551 | P | 36.2 | Very low | 33.3 | Very low | 109 Ų | 109 | 166.3 Ų | 166.3 | 71% | 0.708 | 82% | 0.816 | S | S | * | * | P | Polyproline II helix | trans | -63.8 | 152.7 | -169.5 | -24.8 | 35.5 | 0 | 0 | 0 | 116.8 | ||
| 552 | R | 32.6 | Very low | 33.1 | Very low | 249 Ų | 249 | 163 Ų | 163 | 94% | 0.94 | 82% | 0.819 | S | S | * | * | P | Polyproline II helix | trans | -102.3 | 117.8 | 158.5 | -66.7 | -176.9 | -179.6 | -139.6 | 2 | 109.1 | ||
| 553 | E | 33.8 | Very low | 33.2 | Very low | 185 Ų | 185 | 155.3 Ų | 155.3 | 86% | 0.864 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -88.2 | 148.6 | 168.3 | -67.2 | -177.5 | 147.2 | 0 | 0 | 110.4 | ||
| 554 | L | 33.2 | Very low | 33.1 | Very low | 157 Ų | 157 | 158.8 Ų | 158.8 | 82% | 0.822 | 82% | 0.82 | S | S | * | * | P | Polyproline II helix | trans | -81.5 | 152.4 | -167.6 | -70.1 | 160.5 | 0 | 0 | 0 | 112.4 | ||
| 555 | T | 27.8 | Very low | 32.8 | Very low | 148 Ų | 148 | 156.6 Ų | 156.6 | 91% | 0.908 | 81% | 0.809 | S | S | * | * | trans | -127.8 | 81.8 | 165.6 | -50 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 556 | E | 31.3 | Very low | 32.7 | Very low | 173 Ų | 173 | 159.9 Ų | 159.9 | 81% | 0.808 | 81% | 0.811 | S | S | * | * | trans | -105.1 | 106.3 | 163.9 | -72.1 | -167.3 | 121.1 | 0 | 0 | 109.2 | ||||
| 557 | L | 29.8 | Very low | 32.7 | Very low | 145 Ų | 145 | 161.1 Ų | 161.1 | 76% | 0.759 | 81% | 0.812 | S | S | * | * | trans | -154.6 | 113.6 | 145.4 | -150.1 | 65.1 | 0 | 0 | 0 | 112.7 | ||||
| 558 | E | 28.8 | Very low | 33.4 | Very low | 174 Ų | 174 | 158 Ų | 158 | 81% | 0.813 | 81% | 0.805 | S | S | * | * | trans | 54.2 | 131.1 | 144.9 | -63.7 | 175.7 | 161.7 | 0 | 0 | 122.3 | ||||
| 559 | K | 32.6 | Very low | 32.9 | Very low | 200 Ų | 200 | 153.6 Ų | 153.6 | 87% | 0.87 | 80% | 0.798 | S | S | * | * | trans | -88.4 | 152.8 | 156.5 | -60 | 169.7 | 177.9 | 172.8 | 0 | 109 | ||||
| 560 | E | 28.6 | Very low | 33 | Very low | 182 Ų | 182 | 155.5 Ų | 155.5 | 85% | 0.85 | 80% | 0.804 | S | S | * | * | trans | -134.5 | 156.1 | 145.3 | -97.9 | -70.8 | 94 | 0 | 0 | 108.6 | ||||
| 561 | P | 43.6 | Very low | 32.6 | Very low | 107 Ų | 107 | 151.3 Ų | 151.3 | 70% | 0.695 | 80% | 0.798 | S | S | * | * | trans | -96.9 | 158.8 | -159.1 | 37.1 | -37.2 | 0 | 0 | 0 | 115.2 | ||||
| 562 | A | 29.5 | Very low | 32.3 | Very low | 107 Ų | 107 | 153.7 Ų | 153.7 | 88% | 0.884 | 80% | 0.804 | S | S | * | * | trans | -92.6 | 127.7 | 163.1 | 0 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 563 | G | 31.3 | Very low | 32 | Very low | 77 Ų | 77 | 147.2 Ų | 147.2 | 79% | 0.794 | 80% | 0.796 | S | S | * | * | trans | -115.1 | 110.1 | -178.8 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 564 | E | 32.6 | Very low | 32.5 | Very low | 171 Ų | 171 | 143.6 Ų | 143.6 | 80% | 0.799 | 79% | 0.789 | S | S | * | * | trans | -2.6 | 131 | 161 | -45.8 | 177.4 | 160 | 0 | 0 | 120.3 | ||||
| 565 | N | 29.9 | Very low | 32.1 | Very low | 115 Ų | 115 | 143.6 Ų | 143.6 | 62% | 0.615 | 79% | 0.789 | S | S | * | * | 167.8 | 135.5 | 100 | -96 | -82.7 | 0 | 0 | 0 | 115.7 | |||||
| 566 | K | 34 | Very low | 32.2 | Very low | 190 Ų | 190 | 142.9 Ų | 142.9 | 83% | 0.826 | 78% | 0.784 | S | S | * | * | trans | 74.1 | 121.6 | 141.4 | -69.7 | 170.9 | -177.1 | 171.7 | 0 | 124.3 | ||||
| 567 | E | 31.5 | Very low | 32.3 | Very low | 179 Ų | 179 | 142.5 Ų | 142.5 | 84% | 0.836 | 78% | 0.784 | S | S | * | * | trans | -40.4 | 177.3 | 141.5 | -94.9 | -169.2 | 105.9 | 0 | 0 | 117.7 | ||||
| 568 | P | 47.9 | Very low | 33.1 | Very low | 108 Ų | 108 | 141.5 Ų | 141.5 | 70% | 0.701 | 79% | 0.787 | S | S | * | * | cis | -136.7 | 171.4 | 10.1 | 26.4 | -1.7 | 0 | 0 | 0 | 118.7 | ||||
| 569 | A | 30.8 | Very low | 33.2 | Very low | 84 Ų | 84 | 138.7 Ų | 138.7 | 69% | 0.694 | 79% | 0.786 | S | S | * | * | trans | 35.6 | 130.7 | 142.1 | 0 | 0 | 0 | 0 | 0 | 124.8 | ||||
| 570 | E | 31.4 | Very low | 33.2 | Very low | 175 Ų | 175 | 138.3 Ų | 138.3 | 82% | 0.818 | 79% | 0.787 | S | S | * | * | trans | 42.2 | 128.5 | 136.4 | -54.6 | -170 | 145.7 | 0 | 0 | 122.7 | ||||
| 571 | L | 27.5 | Very low | 33.3 | Very low | 143 Ų | 143 | 135.5 Ų | 135.5 | 75% | 0.749 | 78% | 0.782 | S | S | * | * | -179.4 | 139 | 94.9 | -94 | 174.6 | 0 | 0 | 0 | 114.5 | |||||
| 572 | L | 29.3 | Very low | 32.8 | Very low | 159 Ų | 159 | 135.9 Ų | 135.9 | 83% | 0.832 | 79% | 0.788 | S | S | * | * | trans | 67.2 | 134.2 | 154.8 | -58.3 | 174.5 | 0 | 0 | 0 | 122.4 | ||||
| 573 | S | 27 | Very low | 32.8 | Very low | 112 Ų | 112 | 134.5 Ų | 134.5 | 78% | 0.783 | 78% | 0.784 | S | S | * | * | trans | -90.6 | -168.3 | 166.3 | -36.7 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 574 | P | 43.2 | Very low | 32.8 | Very low | 110 Ų | 110 | 140 Ų | 140 | 71% | 0.714 | 79% | 0.789 | S | S | * | * | cis | -142.2 | -154.1 | 8.3 | 41.1 | -17.7 | 0 | 0 | 0 | 115.4 | ||||
| 575 | L | 26 | Very low | 32.7 | Very low | 156 Ų | 156 | 137.9 Ų | 137.9 | 82% | 0.817 | 79% | 0.787 | S | S | * | * | trans | 90.7 | 103.5 | 174.1 | -53.2 | 176 | 0 | 0 | 0 | 114.6 | ||||
| 576 | V | 28.7 | Very low | 32.6 | Very low | 134 Ų | 134 | 139.4 Ų | 139.4 | 81% | 0.812 | 80% | 0.795 | S | S | * | * | cis | 91.3 | 123.4 | 34.5 | -176.1 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 577 | M | 35.1 | Very low | 32.4 | Very low | 164 Ų | 164 | 135.2 Ų | 135.2 | 81% | 0.808 | 79% | 0.79 | S | S | * | * | trans | -71.9 | 179.9 | 174.9 | -63 | -71.4 | -71.5 | 0 | 0 | 111.7 | ||||
| 578 | P | 45.7 | Very low | 32.3 | Very low | 125 Ų | 125 | 134 Ų | 134 | 81% | 0.812 | 79% | 0.794 | S | S | * | * | -143 | 170.7 | 109.5 | 37.9 | -25.7 | 0 | 0 | 0 | 115.1 | |||||
| 579 | S | 32 | Very low | 31.2 | Very low | 114 Ų | 114 | 132.1 Ų | 132.1 | 80% | 0.797 | 79% | 0.794 | S | S | * | * | trans | -133.1 | 128.6 | 161.9 | 160 | 0 | 0 | 0 | 0 | 106.4 | ||||
| 580 | E | 30.8 | Very low | 31 | Very low | 192 Ų | 192 | 131.8 Ų | 131.8 | 90% | 0.897 | 80% | 0.799 | S | S | * | * | trans | -156.4 | 168.9 | 167.2 | -124.1 | 171.5 | -162.5 | 0 | 0 | 115.2 | ||||
| 581 | V | 32.6 | Very low | 32.1 | Very low | 123 Ų | 123 | 128.4 Ų | 128.4 | 75% | 0.745 | 79% | 0.792 | S | S | * | * | trans | -98.2 | 167.1 | -143.8 | 66.2 | 0 | 0 | 0 | 0 | 115 | ||||
| 582 | S | 33.2 | Very low | 32.1 | Very low | 116 Ų | 116 | 132.5 Ų | 132.5 | 81% | 0.811 | 80% | 0.798 | S | S | * | * | trans | 75 | 142.6 | 152.4 | 65.1 | 0 | 0 | 0 | 0 | 121.8 | ||||
| 583 | G | 27.4 | Very low | 32.3 | Very low | 78 Ų | 78 | 130.1 Ų | 130.1 | 80% | 0.804 | 79% | 0.79 | S | S | * | * | trans | 169.1 | 110.6 | 169.2 | 0 | 0 | 0 | 0 | 0 | 111 | ||||
| 584 | E | 31.8 | Very low | 33.3 | Very low | 192 Ų | 192 | 129.8 Ų | 129.8 | 90% | 0.897 | 79% | 0.785 | S | S | * | * | trans | -89 | -172.6 | 179.1 | -64.3 | -179.9 | 92.1 | 0 | 0 | 112.8 | ||||
| 585 | V | 31.6 | Very low | 32.6 | Very low | 126 Ų | 126 | 131.3 Ų | 131.3 | 76% | 0.764 | 79% | 0.787 | S | S | * | * | trans | 114.5 | 105.8 | 151 | -177.1 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 586 | L | 27.4 | Very low | 33.1 | Very low | 148 Ų | 148 | 130 Ų | 130 | 78% | 0.775 | 78% | 0.781 | S | S | * | * | trans | 44.8 | 113.8 | 139.5 | -56.2 | 175.2 | 0 | 0 | 0 | 123 | ||||
| 587 | S | 30.5 | Very low | 33.3 | Very low | 102 Ų | 102 | 130.4 Ų | 130.4 | 71% | 0.713 | 77% | 0.774 | S | S | * | * | 59.7 | 145.5 | 118.4 | -55.4 | 0 | 0 | 0 | 0 | 124.2 | |||||
| 588 | V | 27.7 | Very low | 33.1 | Very low | 152 Ų | 152 | 129 Ų | 129 | 92% | 0.921 | 77% | 0.768 | S | S | * | * | trans | 75.7 | 134 | 167.2 | -165.4 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 589 | G | 24.8 | Very low | 32.3 | Very low | 69 Ų | 69 | 128.6 Ų | 128.6 | 71% | 0.711 | 76% | 0.763 | S | S | * | * | cis | 165.6 | 92.2 | -10.2 | 0 | 0 | 0 | 0 | 0 | 115.9 | ||||
| 590 | G | 27.1 | Very low | 32.1 | Very low | 78 Ų | 78 | 128 Ų | 128 | 80% | 0.804 | 76% | 0.76 | S | S | * | * | trans | 65.8 | -165.2 | 165.4 | 0 | 0 | 0 | 0 | 0 | 116.7 | ||||
| 591 | P | 54 | Low | 32 | Very low | 103 Ų | 103 | 124.1 Ų | 124.1 | 67% | 0.669 | 75% | 0.753 | S | S | * | * | cis | -133.8 | -172.4 | -9.1 | 42.4 | -26.7 | 0 | 0 | 0 | 114.3 | ||||
| 592 | W | 27.7 | Very low | 31.9 | Very low | 230 Ų | 230 | 126.9 Ų | 126.9 | 87% | 0.871 | 76% | 0.758 | S | S | * | * | trans | 74.2 | 138.8 | 150.6 | -74.2 | -5.4 | 0 | 0 | 0 | 119.5 | ||||
| 593 | T | 34.6 | Very low | 32.8 | Very low | 109 Ų | 109 | 125.8 Ų | 125.8 | 67% | 0.669 | 75% | 0.748 | S | S | * | * | cis | 167.2 | 165.3 | -15.9 | 23.4 | 0 | 0 | 0 | 0 | 106.5 | ||||
| 594 | P | 48 | Very low | 33 | Very low | 105 Ų | 105 | 128.8 Ų | 128.8 | 68% | 0.682 | 75% | 0.745 | S | S | * | * | cis | -113.9 | -109.8 | 16 | 30.7 | -7.6 | 0 | 0 | 0 | 114.5 | ||||
| 595 | D | 28.1 | Very low | 32.9 | Very low | 141 Ų | 141 | 126.7 Ų | 126.7 | 75% | 0.754 | 74% | 0.74 | S | S | * | * | cis | -143.8 | -178 | 13.1 | -139.9 | -44.8 | 0 | 0 | 0 | 111.7 | ||||
| 596 | L | 37.3 | Very low | 32.8 | Very low | 130 Ų | 130 | 123.9 Ų | 123.9 | 68% | 0.681 | 74% | 0.736 | S | S | * | * | trans | -116.4 | 162 | -165.7 | -101.1 | 79.7 | 0 | 0 | 0 | 113.4 | ||||
| 597 | E | 31.7 | Very low | 33 | Very low | 142 Ų | 142 | 124.5 Ų | 124.5 | 66% | 0.664 | 74% | 0.735 | S | S | * | * | cis | -175.7 | 167 | -18.5 | -144.4 | 177.6 | -140.6 | 0 | 0 | 113 | ||||
| 598 | I | 31.5 | Very low | 32.9 | Very low | 135 Ų | 135 | 127.1 Ų | 127.1 | 69% | 0.692 | 74% | 0.736 | S | S | * | * | trans | 46.4 | 160.2 | 155.9 | 43.4 | 159.2 | 0 | 0 | 0 | 122.4 | ||||
| 599 | T | 28.1 | Very low | 33 | Very low | 115 Ų | 115 | 124.7 Ų | 124.7 | 71% | 0.706 | 72% | 0.718 | S | S | * | * | cis | -151.1 | 159.3 | 4.7 | -9.1 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 600 | S | 28 | Very low | 33.4 | Very low | 103 Ų | 103 | 129.2 Ų | 129.2 | 72% | 0.72 | 72% | 0.718 | S | S | * | * | trans | 20.9 | 142 | 134.8 | -156.2 | 0 | 0 | 0 | 0 | 120.6 | ||||
| 601 | S | 29.3 | Very low | 33.5 | Very low | 109 Ų | 109 | 132 Ų | 132 | 76% | 0.762 | 71% | 0.714 | S | S | * | * | -167.4 | 170.7 | 51.7 | -50.9 | 0 | 0 | 0 | 0 | 115.5 | |||||
| 602 | Q | 30.1 | Very low | 32.4 | Very low | 181 Ų | 181 | 133.9 Ų | 133.9 | 85% | 0.846 | 72% | 0.717 | S | S | * | * | trans | -107.8 | -166 | 172.7 | -127.8 | -173.1 | -3.9 | 0 | 0 | 109.8 | ||||
| 603 | P | 53.4 | Low | 32.3 | Very low | 94 Ų | 94 | 130.3 Ų | 130.3 | 61% | 0.61 | 71% | 0.71 | S | S | * | * | cis | -139.6 | -159.8 | -20 | 29.4 | -3.1 | 0 | 0 | 0 | 114.5 | ||||
| 604 | L | 31.4 | Very low | 31.9 | Very low | 140 Ų | 140 | 130.6 Ų | 130.6 | 73% | 0.733 | 71% | 0.711 | S | S | * | * | trans | 109.9 | 140.2 | 142.4 | -77.1 | 159.9 | 0 | 0 | 0 | 123.6 | ||||
| 605 | D | 28.8 | Very low | 30.9 | Very low | 149 Ų | 149 | 130.1 Ų | 130.1 | 80% | 0.797 | 71% | 0.711 | S | S | * | * | trans | 53.5 | 152.4 | 158.4 | -54.5 | -32.2 | 0 | 0 | 0 | 121.8 | ||||
| 606 | G | 30.4 | Very low | 31 | Very low | 66 Ų | 66 | 128.3 Ų | 128.3 | 68% | 0.68 | 71% | 0.709 | S | S | * | * | cis | -170.3 | 140.6 | -5.4 | 0 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 607 | Q | 30.1 | Very low | 30.8 | Very low | 162 Ų | 162 | 129.4 Ų | 129.4 | 76% | 0.757 | 72% | 0.715 | S | S | * | * | 86.9 | 115.1 | 89.9 | 176.2 | 166.3 | -4.3 | 0 | 0 | 115.9 | |||||
| 608 | E | 28 | Very low | 30.5 | Very low | 157 Ų | 157 | 130.1 Ų | 130.1 | 73% | 0.734 | 72% | 0.723 | S | S | * | * | trans | 65.5 | 157.3 | 150.7 | -83.7 | 167.9 | -176.8 | 0 | 0 | 120.2 | ||||
| 609 | D | 31.1 | Very low | 30.5 | Very low | 101 Ų | 101 | 130.7 Ų | 130.7 | 54% | 0.54 | 73% | 0.726 | S | S | . | * | cis | -165.4 | 166.7 | -16.2 | -148.4 | -12.7 | 0 | 0 | 0 | 111.4 | ||||
| 610 | K | 33.7 | Very low | 30.9 | Very low | 164 Ų | 164 | 131.1 Ų | 131.1 | 71% | 0.713 | 73% | 0.731 | S | S | * | * | trans | 59 | 161.6 | 147.5 | -79.8 | 158.8 | -170.7 | 142.5 | 0 | 121.2 | ||||
| 611 | L | 28.3 | Very low | 31.1 | Very low | 135 Ų | 135 | 135 Ų | 135 | 71% | 0.707 | 74% | 0.738 | S | S | * | * | cis | -168.9 | 155.3 | -31.1 | -123.4 | -174.1 | 0 | 0 | 0 | 110.1 | ||||
| 612 | L | 30.2 | Very low | 30.8 | Very low | 143 Ų | 143 | 141.7 Ų | 141.7 | 75% | 0.749 | 75% | 0.746 | S | S | * | * | trans | 66.8 | 164.2 | 164.9 | -52.6 | 173.6 | 0 | 0 | 0 | 116.9 | ||||
| 613 | H | 25.6 | Very low | 30.8 | Very low | 156 Ų | 156 | 137.3 Ų | 137.3 | 72% | 0.722 | 74% | 0.735 | S | S | * | * | cis | -146.1 | 163.5 | 2.1 | -157.1 | -92.1 | 0 | 0 | 0 | 113.7 | ||||
| 614 | V | 28 | Very low | 29.7 | Very low | 114 Ų | 114 | 143.8 Ų | 143.8 | 69% | 0.691 | 75% | 0.749 | S | S | * | * | trans | -63.7 | 146.3 | 171 | -174.7 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 615 | S | 26.9 | Very low | 29.5 | Very low | 95 Ų | 95 | 140.5 Ų | 140.5 | 66% | 0.664 | 75% | 0.749 | S | S | * | * | -177.1 | 156.8 | 75.7 | -45.2 | 0 | 0 | 0 | 0 | 116.7 | |||||
| 616 | S | 28.4 | Very low | 29.6 | Very low | 103 Ų | 103 | 140.2 Ų | 140.2 | 72% | 0.72 | 75% | 0.747 | S | S | * | * | trans | 72.9 | 117.1 | 139.7 | -64.7 | 0 | 0 | 0 | 0 | 124 | ||||
| 617 | L | 33 | Very low | 29.6 | Very low | 154 Ų | 154 | 145.2 Ų | 145.2 | 81% | 0.806 | 76% | 0.757 | S | S | * | * | 47.9 | 123.4 | 123.7 | -67.1 | 160.8 | 0 | 0 | 0 | 121.1 | |||||
| 618 | D | 25.3 | Very low | 29.8 | Very low | 157 Ų | 157 | 142.5 Ų | 142.5 | 84% | 0.84 | 76% | 0.757 | S | S | * | * | -158.1 | 158.4 | 110.7 | -127 | -23.4 | 0 | 0 | 0 | 113.4 | |||||
| 619 | I | 32.5 | Very low | 30.5 | Very low | 147 Ų | 147 | 140.7 Ų | 140.7 | 75% | 0.754 | 76% | 0.758 | S | S | * | * | trans | -142 | 124.6 | 175.8 | -72.9 | 177.4 | 0 | 0 | 0 | 109.1 | ||||
| 620 | P | 36.3 | Very low | 30.8 | Very low | 123 Ų | 123 | 141.7 Ų | 141.7 | 80% | 0.799 | 77% | 0.771 | S | S | * | * | -146.1 | 165.9 | 121.8 | 33.8 | -16.3 | 0 | 0 | 0 | 116.3 | |||||
| 621 | Q | 31.4 | Very low | 30.5 | Very low | 186 Ų | 186 | 140 Ų | 140 | 87% | 0.869 | 78% | 0.778 | S | S | * | * | trans | -70.4 | 160.7 | -177.2 | -56.2 | 171.8 | -39.3 | 0 | 0 | 114.8 | ||||
| 622 | R | 24.6 | Very low | 30.7 | Very low | 249 Ų | 249 | 138.3 Ų | 138.3 | 94% | 0.94 | 78% | 0.777 | S | S | * | * | trans | -147.3 | 174.8 | 136.5 | -122.6 | 173.1 | -172.8 | 164.4 | 4 | 112.7 | ||||
| 623 | S | 29.6 | Very low | 30.7 | Very low | 88 Ų | 88 | 138.7 Ų | 138.7 | 62% | 0.615 | 78% | 0.78 | S | S | * | * | trans | -152.4 | 171.6 | -148.4 | 51.1 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 624 | Y | 29.9 | Very low | 30.8 | Very low | 231 Ų | 231 | 143.3 Ų | 143.3 | 91% | 0.906 | 79% | 0.791 | S | S | * | * | trans | 69.9 | 152.7 | -177.4 | -63.5 | -90.4 | 0 | 0 | 0 | 115 | ||||
| 625 | G | 26.4 | Very low | 30.9 | Very low | 70 Ų | 70 | 143.7 Ų | 143.7 | 72% | 0.722 | 79% | 0.794 | S | S | * | * | cis | -163.7 | 169.5 | 2.1 | 0 | 0 | 0 | 0 | 0 | 114 | ||||
| 626 | D | 32.3 | Very low | 31.5 | Very low | 143 Ų | 143 | 148 Ų | 148 | 77% | 0.765 | 80% | 0.803 | S | S | * | * | trans | -85 | 133.8 | -174.1 | -176.5 | 9 | 0 | 0 | 0 | 112.2 | ||||
| 627 | L | 29.8 | Very low | 31.5 | Very low | 171 Ų | 171 | 149.6 Ų | 149.6 | 90% | 0.895 | 81% | 0.809 | S | S | * | * | trans | -158.6 | 124.2 | 160.7 | -84.1 | -167.8 | 0 | 0 | 0 | 111.5 | ||||
| 628 | S | 33.5 | Very low | 31.2 | Very low | 106 Ų | 106 | 145.4 Ų | 145.4 | 74% | 0.741 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -90.5 | 150.4 | 165.1 | -63.7 | 0 | 0 | 0 | 0 | 111.5 | ||
| 629 | P | 44.6 | Very low | 31.3 | Very low | 118 Ų | 118 | 145.9 Ų | 145.9 | 77% | 0.766 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -77.4 | 149.4 | 173.5 | 32.5 | -34.5 | 0 | 0 | 0 | 112.2 | ||
| 630 | P | 36.5 | Very low | 31.1 | Very low | 123 Ų | 123 | 146.7 Ų | 146.7 | 80% | 0.799 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -84.7 | 150.2 | 178.2 | 34.3 | -35 | 0 | 0 | 0 | 112.7 | ||
| 631 | C | 27.4 | Very low | 30.6 | Very low | 128 Ų | 128 | 147.5 Ų | 147.5 | 87% | 0.865 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -85 | 128.3 | 165.6 | -69.4 | 0 | 0 | 0 | 0 | 110.6 | ||
| 632 | S | 32.3 | Very low | 30.3 | Very low | 99 Ų | 99 | 142.9 Ų | 142.9 | 69% | 0.692 | 80% | 0.796 | S | S | * | * | trans | -161.6 | 111.3 | 159.4 | -81.5 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 633 | N | 29.8 | Very low | 30.5 | Very low | 152 Ų | 152 | 137.7 Ų | 137.7 | 81% | 0.813 | 79% | 0.786 | S | S | * | * | trans | 24.8 | 120.6 | 141.3 | -48 | -8.3 | 0 | 0 | 0 | 118.3 | ||||
| 634 | W | 29.2 | Very low | 30.3 | Very low | 253 Ų | 253 | 140.4 Ų | 140.4 | 96% | 0.958 | 80% | 0.799 | S | S | * | * | trans | -121.1 | 139 | 150.3 | -89.6 | 83.7 | 0 | 0 | 0 | 110.6 | ||||
| 635 | V | 29.2 | Very low | 30.4 | Very low | 122 Ų | 122 | 134.3 Ų | 134.3 | 74% | 0.739 | 79% | 0.786 | S | S | * | * | trans | -94.9 | 146.6 | -177.1 | 168.5 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 636 | E | 39.1 | Very low | 30.4 | Very low | 186 Ų | 186 | 137.7 Ų | 137.7 | 87% | 0.869 | 79% | 0.788 | S | S | * | * | trans | -68.5 | 125.2 | 176.8 | -175.9 | 170.4 | -142 | 0 | 0 | 111.8 | ||||
| 637 | T | 29.4 | Very low | 30.3 | Very low | 135 Ų | 135 | 138 Ų | 138 | 83% | 0.828 | 79% | 0.785 | S | S | * | * | trans | -162.4 | 125.6 | 161.7 | -16.3 | 0 | 0 | 0 | 0 | 109 | ||||
| 638 | G | 27.1 | Very low | 30.2 | Very low | 67 Ų | 67 | 136.7 Ų | 136.7 | 69% | 0.691 | 78% | 0.778 | S | S | * | * | trans | -102.1 | 169.8 | 178.1 | 0 | 0 | 0 | 0 | 0 | 113 | ||||
| 639 | L | 27.1 | Very low | 29.9 | Very low | 167 Ų | 167 | 139.3 Ų | 139.3 | 87% | 0.874 | 78% | 0.783 | S | S | * | * | trans | -156.5 | 172 | 147.3 | -138.2 | 76.8 | 0 | 0 | 0 | 111.1 | ||||
| 640 | E | 27.9 | Very low | 28.9 | Very low | 163 Ų | 163 | 144.2 Ų | 144.2 | 76% | 0.762 | 79% | 0.787 | S | S | * | * | trans | -66.4 | 167.1 | -179.5 | -52.5 | 162.6 | 101.1 | 0 | 0 | 113.3 | ||||
| 641 | V | 25.3 | Very low | 29.7 | Very low | 140 Ų | 140 | 143 Ų | 143 | 85% | 0.848 | 78% | 0.78 | S | S | * | * | -173.1 | 126.2 | 110 | 145.6 | 0 | 0 | 0 | 0 | 112.9 | |||||
| 642 | S | 26.1 | Very low | 29.6 | Very low | 90 Ų | 90 | 141.8 Ų | 141.8 | 63% | 0.629 | 77% | 0.772 | S | S | * | * | trans | -47.2 | 172 | 160.2 | -62.5 | 0 | 0 | 0 | 0 | 115.2 | ||||
| 643 | L | 28 | Very low | 30.4 | Very low | 139 Ų | 139 | 143 Ų | 143 | 73% | 0.728 | 78% | 0.778 | S | S | * | * | cis | -170.7 | 151.2 | -11.1 | -108.8 | 167.1 | 0 | 0 | 0 | 105.7 | ||||
| 644 | T | 26.2 | Very low | 30.5 | Very low | 145 Ų | 145 | 145.3 Ų | 145.3 | 89% | 0.89 | 78% | 0.781 | S | S | * | * | trans | -145.4 | 147.6 | 148.4 | 39.9 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 645 | T | 30.6 | Very low | 30.6 | Very low | 104 Ų | 104 | 138.3 Ų | 138.3 | 64% | 0.638 | 78% | 0.777 | S | S | * | * | trans | -142.5 | 146.6 | -164.1 | -42 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 646 | D | 27.3 | Very low | 30.5 | Very low | 140 Ų | 140 | 135.9 Ų | 135.9 | 75% | 0.749 | 78% | 0.777 | S | S | * | * | trans | 173.3 | 116.1 | 135 | -87.7 | -2.7 | 0 | 0 | 0 | 107.5 | ||||
| 647 | E | 29.8 | Very low | 30.2 | Very low | 151 Ų | 151 | 135.6 Ų | 135.6 | 71% | 0.706 | 77% | 0.772 | S | S | * | * | 73.8 | 138.3 | 92.1 | -73.2 | -142.1 | 123.5 | 0 | 0 | 113.4 | |||||
| 648 | L | 27.8 | Very low | 30.1 | Very low | 142 Ų | 142 | 136.2 Ų | 136.2 | 74% | 0.743 | 77% | 0.766 | S | S | * | * | cis | -137.7 | 146.7 | 34.6 | -68.8 | 155.3 | 0 | 0 | 0 | 114 | ||||
| 649 | L | 26.3 | Very low | 30.1 | Very low | 162 Ų | 162 | 139 Ų | 139 | 85% | 0.848 | 77% | 0.77 | S | S | * | * | trans | 148.6 | 117.7 | 132.7 | -79.2 | 173.6 | 0 | 0 | 0 | 113.3 | ||||
| 650 | Y | 24.7 | Very low | 30.1 | Very low | 220 Ų | 220 | 136.7 Ų | 136.7 | 86% | 0.863 | 77% | 0.767 | S | S | * | * | trans | -154.5 | 176.6 | -175 | -109.9 | -116.2 | 0 | 0 | 0 | 106.7 | ||||
| 651 | P | 52.4 | Low | 30 | Very low | 99 Ų | 99 | 132.5 Ų | 132.5 | 64% | 0.643 | 77% | 0.768 | S | S | * | * | cis | -147.2 | -161.9 | -44.8 | 41.9 | -22.8 | 0 | 0 | 0 | 114.9 | ||||
| 652 | S | 26 | Very low | 30 | Very low | 101 Ų | 101 | 134.7 Ų | 134.7 | 71% | 0.706 | 77% | 0.768 | S | S | * | * | trans | 80.2 | 169 | 145.1 | -92.8 | 0 | 0 | 0 | 0 | 119.8 | ||||
| 653 | P | 49.9 | Very low | 30.2 | Very low | 125 Ų | 125 | 134.4 Ų | 134.4 | 81% | 0.812 | 77% | 0.767 | S | S | * | * | cis | -130.7 | 177.3 | 12 | 38.8 | -20 | 0 | 0 | 0 | 119.5 | ||||
| 654 | K | 30.1 | Very low | 30.3 | Very low | 200 Ų | 200 | 135.8 Ų | 135.8 | 87% | 0.87 | 77% | 0.769 | S | S | * | * | trans | -80 | 166.7 | -177.2 | -47.5 | 165.1 | 179 | 175.2 | 0 | 115.6 | ||||
| 655 | A | 32.7 | Very low | 30.3 | Very low | 107 Ų | 107 | 135.2 Ų | 135.2 | 88% | 0.884 | 76% | 0.76 | S | S | * | * | trans | -161.7 | 156.6 | 136.9 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 656 | G | 27.5 | Very low | 30.2 | Very low | 71 Ų | 71 | 138 Ų | 138 | 73% | 0.732 | 77% | 0.77 | S | S | * | * | cis | 165.3 | 154.3 | -12 | 0 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 657 | K | 31.3 | Very low | 30 | Very low | 179 Ų | 179 | 134.3 Ų | 134.3 | 78% | 0.778 | 77% | 0.765 | S | S | * | * | trans | 55.1 | 119.2 | 150.4 | -78.3 | -175.9 | 164.5 | -91.1 | 0 | 124.3 | ||||
| 658 | E | 27.2 | Very low | 29.8 | Very low | 148 Ų | 148 | 132.9 Ų | 132.9 | 69% | 0.692 | 77% | 0.772 | S | S | * | * | 52.2 | 135.5 | 105.9 | -67.2 | 178.7 | 145.9 | 0 | 0 | 124.5 | |||||
| 659 | V | 28.7 | Very low | 29.9 | Very low | 127 Ų | 127 | 134.1 Ų | 134.1 | 77% | 0.77 | 78% | 0.778 | S | S | * | * | trans | 97.4 | 114.1 | 137.3 | 163.4 | 0 | 0 | 0 | 0 | 122.6 | ||||
| 660 | S | 26.2 | Very low | 30.7 | Very low | 117 Ų | 117 | 132 Ų | 132 | 82% | 0.818 | 77% | 0.774 | S | S | * | * | trans | 50.8 | 143.6 | 148.7 | 71.9 | 0 | 0 | 0 | 0 | 123.3 | ||||
| 661 | G | 26 | Very low | 30.6 | Very low | 75 Ų | 75 | 125.7 Ų | 125.7 | 77% | 0.773 | 77% | 0.768 | S | S | * | * | trans | -156.2 | -47.4 | 179.4 | 0 | 0 | 0 | 0 | 0 | 122.6 | ||||
| 662 | H | 25.4 | Very low | 29.5 | Very low | 186 Ų | 186 | 125.9 Ų | 125.9 | 86% | 0.861 | 77% | 0.771 | S | S | * | * | trans | 64 | 144.1 | 177.3 | -136 | -76.6 | 0 | 0 | 0 | 120.5 | ||||
| 663 | S | 30 | Very low | 29.8 | Very low | 85 Ų | 85 | 126 Ų | 126 | 59% | 0.594 | 77% | 0.772 | S | S | * | * | trans | 60.2 | 144.9 | 168.3 | -73.5 | 0 | 0 | 0 | 0 | 117.5 | ||||
| 664 | E | 29.5 | Very low | 29 | Very low | 167 Ų | 167 | 127.5 Ų | 127.5 | 78% | 0.78 | 77% | 0.769 | S | S | * | * | cis | -150.4 | 165.7 | -5.3 | -105.1 | 148.1 | -135.6 | 0 | 0 | 105.8 | ||||
| 665 | L | 27.4 | Very low | 29.3 | Very low | 134 Ų | 134 | 125 Ų | 125 | 70% | 0.702 | 76% | 0.76 | S | S | * | * | cis | -159 | 146.6 | 23.5 | -167.5 | 88.8 | 0 | 0 | 0 | 108.2 | ||||
| 666 | L | 27.4 | Very low | 29.5 | Very low | 162 Ų | 162 | 128 Ų | 128 | 85% | 0.848 | 76% | 0.755 | S | S | * | * | trans | 38.5 | 134.8 | 161.3 | -76.6 | 158.8 | 0 | 0 | 0 | 121 | ||||
| 667 | G | 24.7 | Very low | 29.9 | Very low | 63 Ų | 63 | 131.1 Ų | 131.1 | 65% | 0.649 | 75% | 0.751 | S | S | * | * | cis | 144.4 | 142.4 | -0.9 | 0 | 0 | 0 | 0 | 0 | 113 | ||||
| 668 | S | 25.5 | Very low | 29.9 | Very low | 121 Ų | 121 | 128.9 Ų | 128.9 | 85% | 0.846 | 75% | 0.746 | S | S | * | * | trans | 74.2 | 102.2 | 159.2 | -53 | 0 | 0 | 0 | 0 | 121 | ||||
| 669 | L | 29.9 | Very low | 29.9 | Very low | 167 Ų | 167 | 128 Ų | 128 | 87% | 0.874 | 75% | 0.746 | S | S | * | * | trans | -66.4 | 179.4 | 130.9 | -63.9 | 165.7 | 0 | 0 | 0 | 109.7 | ||||
| 670 | P | 42.6 | Very low | 30 | Very low | 117 Ų | 117 | 127.4 Ų | 127.4 | 76% | 0.76 | 74% | 0.743 | S | S | * | * | cis | -131.4 | -154.1 | -4.1 | 40.4 | -20.9 | 0 | 0 | 0 | 112.4 | ||||
| 671 | A | 23.1 | Very low | 30.2 | Very low | 89 Ų | 89 | 127.7 Ų | 127.7 | 74% | 0.736 | 74% | 0.739 | S | S | * | * | trans | 75.5 | 150 | 151.8 | 0 | 0 | 0 | 0 | 0 | 118.1 | ||||
| 672 | S | 28.5 | Very low | 30.4 | Very low | 102 Ų | 102 | 129.9 Ų | 129.9 | 71% | 0.713 | 73% | 0.733 | S | S | * | * | cis | -171.4 | 163 | -12.7 | 45.6 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 673 | S | 32.8 | Very low | 30.6 | Very low | 103 Ų | 103 | 132.6 Ų | 132.6 | 72% | 0.72 | 74% | 0.736 | S | S | * | * | trans | 64.3 | 174.6 | 166.5 | -113.9 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 674 | E | 31.7 | Very low | 30.8 | Very low | 158 Ų | 158 | 134.3 Ų | 134.3 | 74% | 0.738 | 74% | 0.743 | S | S | * | * | cis | -155.4 | 152.1 | 4.3 | 27.5 | -151.6 | 66.8 | 0 | 0 | 105.6 | ||||
| 675 | E | 36.5 | Very low | 30.9 | Very low | 146 Ų | 146 | 131 Ų | 131 | 68% | 0.682 | 75% | 0.745 | S | S | * | * | cis | -171.6 | 155.9 | -9.4 | 55.6 | -156.9 | 168.3 | 0 | 0 | 108.4 | ||||
| 676 | E | 37.2 | Very low | 31.1 | Very low | 170 Ų | 170 | 134.5 Ų | 134.5 | 79% | 0.794 | 76% | 0.757 | S | S | * | * | trans | 52 | 157.9 | 149.8 | -69.1 | -174.9 | 136 | 0 | 0 | 121.9 | ||||
| 677 | E | 35.4 | Very low | 31.2 | Very low | 137 Ų | 137 | 130.4 Ų | 130.4 | 64% | 0.64 | 75% | 0.754 | S | S | * | * | cis | -156.5 | 144.8 | -4.6 | -134.7 | -155.5 | 138.4 | 0 | 0 | 110.8 | ||||
| 678 | I | 32 | Very low | 31.5 | Very low | 133 Ų | 133 | 138.4 Ų | 138.4 | 68% | 0.682 | 77% | 0.765 | S | S | * | * | trans | 39.4 | 166.9 | 153.5 | 66.8 | 167.6 | 0 | 0 | 0 | 122.4 | ||||
| 679 | D | 27.9 | Very low | 31.8 | Very low | 129 Ų | 129 | 140.2 Ų | 140.2 | 69% | 0.69 | 76% | 0.764 | S | S | * | * | cis | -144.6 | 159.8 | 0.7 | -151 | 11 | 0 | 0 | 0 | 115.1 | ||||
| 680 | V | 29.5 | Very low | 32 | Very low | 115 Ų | 115 | 137.1 Ų | 137.1 | 70% | 0.697 | 75% | 0.752 | S | S | * | * | trans | -17.8 | 141.8 | 156.3 | 169.1 | 0 | 0 | 0 | 0 | 116.5 | ||||
| 681 | V | 30.5 | Very low | 31.6 | Very low | 122 Ų | 122 | 137.6 Ų | 137.6 | 74% | 0.739 | 76% | 0.755 | S | S | * | * | -143.2 | 138.8 | 65.7 | 177.7 | 0 | 0 | 0 | 0 | 114 | |||||
| 682 | D | 31.3 | Very low | 32.1 | Very low | 121 Ų | 121 | 139.2 Ų | 139.2 | 65% | 0.647 | 76% | 0.756 | S | S | * | * | trans | -111.6 | 151.2 | 161.6 | 176 | 33.3 | 0 | 0 | 0 | 110.6 | ||||
| 683 | W | 29.2 | Very low | 32.3 | Very low | 244 Ų | 244 | 139.7 Ų | 139.7 | 92% | 0.924 | 76% | 0.76 | S | S | * | * | trans | -145.6 | 77.6 | 169.2 | -105.1 | -1.8 | 0 | 0 | 0 | 112.4 | ||||
| 684 | T | 34.2 | Very low | 32.4 | Very low | 120 Ų | 120 | 140.7 Ų | 140.7 | 74% | 0.736 | 76% | 0.761 | S | S | * | * | trans | -67.6 | 134.1 | 157 | 49.9 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 685 | A | 30.8 | Very low | 32.5 | Very low | 99 Ų | 99 | 138.1 Ų | 138.1 | 82% | 0.818 | 76% | 0.758 | S | S | * | * | trans | -143.3 | 130.4 | 167.4 | 0 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 686 | E | 33.4 | Very low | 32.3 | Very low | 206 Ų | 206 | 136.9 Ų | 136.9 | 96% | 0.963 | 77% | 0.765 | S | S | * | * | trans | -78 | 139 | -169.2 | -63.9 | 162.1 | 98.9 | 0 | 0 | 112.9 | ||||
| 687 | G | 27.6 | Very low | 32.1 | Very low | 77 Ų | 77 | 134.9 Ų | 134.9 | 79% | 0.794 | 76% | 0.764 | S | S | * | * | trans | -142.7 | 41.1 | -170.3 | 0 | 0 | 0 | 0 | 0 | 115.2 | L689 | G687-L689 PolarHBondContact O-N 3.15Å; G687-L689 VanDerWaalsContact O-N 3.14Å | ||
| 688 | R | 31.4 | Very low | 32.1 | Very low | 231 Ų | 231 | 139.5 Ų | 139.5 | 87% | 0.872 | 78% | 0.776 | S | S | * | * | trans | -58.7 | 109.7 | 179.9 | 178.5 | -164.7 | -171.1 | -85.8 | 2 | 112.6 | ||||
| 689 | L | 32.3 | Very low | 32.2 | Very low | 159 Ų | 159 | 138.7 Ų | 138.7 | 83% | 0.832 | 78% | 0.779 | S | S | * | * | trans | -155.9 | 156.9 | 155.2 | -109.5 | 169.9 | 0 | 0 | 0 | 113.4 | G687 | G687-L689 PolarHBondContact O-N 3.15Å; G687-L689 VanDerWaalsContact O-N 3.14Å | ||
| 690 | V | 33.6 | Very low | 32.4 | Very low | 102 Ų | 102 | 139.8 Ų | 139.8 | 62% | 0.618 | 79% | 0.786 | S | S | * | * | trans | -77.7 | 146.3 | -168 | 176.3 | 0 | 0 | 0 | 0 | 112.2 | T692 | V690-T692 PolarHBondContact O-N 3.2Å; V690-T692 VanDerWaalsContact O-N 3.15Å | ||
| 691 | P | 35.9 | Very low | 33.1 | Very low | 127 Ų | 127 | 140.1 Ų | 140.1 | 83% | 0.825 | 79% | 0.79 | S | S | * | * | trans | -69.1 | 105.4 | 166.4 | -12.8 | 28.3 | 0 | 0 | 0 | 110.7 | S693 | P691-S693 PolarHBondContact O-N 3.07Š| ||
| 692 | T | 32.3 | Very low | 33.2 | Very low | 122 Ų | 122 | 139.3 Ų | 139.3 | 75% | 0.748 | 79% | 0.79 | S | S | * | * | trans | -77.6 | 118.5 | 173.3 | -47.8 | 0 | 0 | 0 | 0 | 109.7 | V690 V694 | V690-T692 PolarHBondContact O-N 3.2Å; V690-T692 VanDerWaalsContact O-N 3.15Å; T692-V694 PolarHBondContact O-N 3.21Å | ||
| 693 | S | 33.6 | Very low | 33.4 | Very low | 113 Ų | 113 | 139 Ų | 139 | 79% | 0.79 | 80% | 0.797 | S | S | * | * | trans | -68.1 | 115.7 | 173.4 | 42 | 0 | 0 | 0 | 0 | 111 | P691 | P691-S693 PolarHBondContact O-N 3.07Š| ||
| 694 | V | 33.7 | Very low | 33.9 | Very low | 124 Ų | 124 | 136.7 Ų | 136.7 | 75% | 0.752 | 80% | 0.796 | S | S | * | * | trans | -93.5 | 120.9 | 172.7 | -178.9 | 0 | 0 | 0 | 0 | 108.6 | T692 | T692-V694 PolarHBondContact O-N 3.21Š| ||
| 695 | P | 34.6 | Very low | 34.2 | Very low | 104 Ų | 104 | 135.6 Ų | 135.6 | 68% | 0.675 | 79% | 0.794 | S | S | * | * | trans | -74.2 | 129.6 | 176.5 | 29.7 | -33.2 | 0 | 0 | 0 | 110.7 | V697 | P695-V697 PolarHBondContact O-N 2.87Å; P695-V697 VanDerWaalsContact O-N 3.09Å | ||
| 696 | S | 31.7 | Very low | 35 | Very low | 119 Ų | 119 | 140.5 Ų | 140.5 | 83% | 0.832 | 80% | 0.8 | S | S | * | * | trans | -70.5 | 101.6 | 174.2 | -55.7 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 697 | V | 32.4 | Very low | 35.5 | Very low | 128 Ų | 128 | 136.5 Ų | 136.5 | 78% | 0.776 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -82.5 | 128 | 171.7 | 178.5 | 0 | 0 | 0 | 0 | 109.2 | P695 | P695-V697 PolarHBondContact O-N 2.87Å; P695-V697 VanDerWaalsContact O-N 3.09Å |
| 698 | W | 36.3 | Very low | 36 | Very low | 234 Ų | 234 | 141.9 Ų | 141.9 | 89% | 0.886 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -69.3 | 135.4 | 172.8 | -67.7 | 83 | 0 | 0 | 0 | 110.3 | ||
| 699 | P | 35.2 | Very low | 36.4 | Very low | 116 Ų | 116 | 136.8 Ų | 136.8 | 75% | 0.753 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -74.7 | 133.6 | 172.8 | 30.3 | -33 | 0 | 0 | 0 | 111.1 | ||
| 700 | D | 30.6 | Very low | 36.4 | Very low | 153 Ų | 153 | 136.2 Ų | 136.2 | 82% | 0.818 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -67.4 | 139.1 | 176.6 | -91.9 | -48.9 | 0 | 0 | 0 | 112.3 | S702 | D700-S702 PolarHBondContact O-N 3.14Š|
| 701 | P | 43.8 | Very low | 36.7 | Very low | 121 Ų | 121 | 138.9 Ų | 138.9 | 79% | 0.786 | 80% | 0.795 | S | S | * | * | S | Bend | trans | -82.5 | 76.5 | 176.3 | 34.2 | -34.5 | 0 | 0 | 0 | 111.1 | ||
| 702 | S | 32.8 | Very low | 36.8 | Very low | 105 Ų | 105 | 140.6 Ų | 140.6 | 73% | 0.734 | 80% | 0.797 | S | S | * | * | trans | -157.4 | 90.4 | 174.2 | -80.2 | 0 | 0 | 0 | 0 | 113.4 | D700 | D700-S702 PolarHBondContact O-N 3.14Š| ||
| 703 | S | 35.5 | Very low | 37.3 | Very low | 114 Ų | 114 | 144.5 Ų | 144.5 | 80% | 0.797 | 82% | 0.82 | S | S | * | * | trans | -168.4 | 60.7 | 159.1 | -80 | 0 | 0 | 0 | 0 | 110.1 | S705 | S703-S705 PolarHBondContact O-N 3.23Š| ||
| 704 | E | 41.2 | Very low | 37.5 | Very low | 196 Ų | 196 | 146.1 Ų | 146.1 | 92% | 0.916 | 82% | 0.822 | S | S | * | * | trans | -59.2 | 128.6 | 161.9 | 52.9 | -160.2 | 56.5 | 0 | 0 | 109.4 | ||||
| 705 | S | 38.9 | Very low | 37.6 | Very low | 97 Ų | 97 | 147.2 Ų | 147.2 | 68% | 0.678 | 83% | 0.826 | S | S | * | * | trans | -133.8 | 101.6 | -176.9 | 33.1 | 0 | 0 | 0 | 0 | 109.2 | S703 T707 | S703-S705 PolarHBondContact O-N 3.23Å; S705-T707 PolarHBondContact O-N 2.88Å | ||
| 706 | E | 47.6 | Very low | 37.8 | Very low | 202 Ų | 202 | 149.6 Ų | 149.6 | 94% | 0.944 | 83% | 0.834 | S | S | * | * | trans | -60.8 | 117.6 | 176.8 | -61.1 | 175.8 | 117.7 | 0 | 0 | 109.7 | ||||
| 707 | T | 44.8 | Very low | 38.2 | Very low | 123 Ų | 123 | 151.4 Ų | 151.4 | 76% | 0.755 | 83% | 0.834 | S | S | * | * | trans | -126.5 | 90.9 | 170 | 33.3 | 0 | 0 | 0 | 0 | 108.9 | S705 | S705-T707 PolarHBondContact O-N 2.88Š| ||
| 708 | E | 38.1 | Very low | 38.5 | Very low | 190 Ų | 190 | 152.9 Ų | 152.9 | 89% | 0.888 | 84% | 0.838 | S | S | * | * | trans | -57.8 | 135.4 | 169.3 | -175.1 | 171 | -144.2 | 0 | 0 | 110.1 | ||||
| 709 | V | 39.3 | Very low | 38.7 | Very low | 123 Ų | 123 | 147.5 Ų | 147.5 | 75% | 0.745 | 83% | 0.834 | S | S | * | * | trans | -131.3 | 109.4 | 178.3 | -175.7 | 0 | 0 | 0 | 0 | 109.2 | I711 | V709-I711 PolarHBondContact O-N 2.71Š| ||
| 710 | D | 33.4 | Very low | 38.9 | Very low | 148 Ų | 148 | 149.7 Ų | 149.7 | 79% | 0.791 | 84% | 0.84 | S | S | * | * | trans | -58.6 | 127.6 | 174.1 | -83.3 | -54.3 | 0 | 0 | 0 | 111.8 | L712 | D710-L712 PolarHBondContact O-N 3.42Š| ||
| 711 | I | 39.3 | Very low | 39.6 | Very low | 158 Ų | 158 | 149.5 Ų | 149.5 | 81% | 0.81 | 84% | 0.842 | S | S | * | * | trans | -90.6 | 100.1 | 166.6 | -57.4 | 177.8 | 0 | 0 | 0 | 108 | V709 | V709-I711 PolarHBondContact O-N 2.71Š| ||
| 712 | L | 36.7 | Very low | 39.2 | Very low | 163 Ų | 163 | 151.8 Ų | 151.8 | 85% | 0.853 | 85% | 0.847 | S | S | * | * | trans | -77.3 | 138.8 | 164.7 | -82.5 | 167.4 | 0 | 0 | 0 | 110.6 | D710 | D710-L712 PolarHBondContact O-N 3.42Š| ||
| 713 | T | 43 | Very low | 39.8 | Very low | 203 Ų | 203 | 156.1 Ų | 156.1 | 100% | 1.245 | 86% | 0.857 | S | S | * | * | trans | -77 | 0 | -171.1 | 56 | 0 | 0 | 0 | 0 | 114.7 |
Retrieved 713 of 713 residues in 2096.1 ms
(Link to these results)