| 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 | 32.3 | Very low | 41.5 | Very low | 236 Ų | 236 | 130.9 Ų | 130.9 | 100% | 1.163 | 66% | 0.657 | S | S | * | * | 0 | 125.6 | 0 | -87 | 179.1 | 172.5 | 0 | 0 | 107.8 | |||||
| 2 | T | 40.9 | Very low | 42.5 | Very low | 91 Ų | 91 | 123.8 Ų | 123.8 | 56% | 0.558 | 63% | 0.627 | S | S | * | * | trans | -103.5 | 121 | 178.3 | -49.8 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 3 | I | 38.9 | Very low | 43.7 | Very low | 105 Ų | 105 | 119.3 Ų | 119.3 | 54% | 0.538 | 61% | 0.612 | S | S | . | * | trans | -95 | 114.4 | 176.6 | -58.3 | 172.2 | 0 | 0 | 0 | 107.5 | ||||
| 4 | K | 41 | Very low | 44.3 | Very low | 189 Ų | 189 | 119.9 Ų | 119.9 | 82% | 0.822 | 62% | 0.617 | S | S | * | * | trans | -89 | 120.5 | 170.1 | -71.2 | -179.8 | -179.7 | 173.6 | 0 | 108.6 | ||||
| 5 | M | 44.2 | Very low | 44.9 | Very low | 74 Ų | 74 | 126.7 Ų | 126.7 | 37% | 0.365 | 63% | 0.632 | S | S | . | * | trans | -126.4 | 139.9 | 174.8 | 64.9 | -174.6 | -172.6 | 0 | 0 | 111.1 | I16 I46 | M5-I16 HydrophobicContact CE-CD1 4.03Å; M5-I16 HydrophobicContact CE-CG2 4.31Å; M5-I16 HydrophobicContact SD-CD1 3.49Å; M5-I16 WeakPolarHBondContact SD-CD1 3.49Å; M5-I16 HydrophobicContact SD-CG1 3.8Å; M5-I46 HydrophobicContact CE-CD1 4.46Å | ||
| 6 | R | 40.9 | Very low | 45.6 | Very low | 247 Ų | 247 | 119.6 Ų | 119.6 | 93% | 0.932 | 60% | 0.596 | S | S | * | * | trans | -104.1 | 122.8 | 169.1 | -70.4 | -174.2 | 176.8 | 172.9 | -0.8 | 107.6 | ||||
| 7 | C | 40 | Very low | 46 | Very low | 22 Ų | 22 | 117.2 Ų | 117.2 | 15% | 0.149 | 58% | 0.583 | C | S | . | * | trans | -110.3 | 151.3 | 168.3 | -53.3 | 0 | 0 | 0 | 0 | 109.6 | I16 L40 | C7-I16 WeakPolarHBondContact SG-CD1 3.49Å; C7-L40 HydrophobicContact CB-CD1 3.64Å; C7-L40 HydrophobicContact CB-CD2 3.72Å; C7-L40 HydrophobicContact CB-CG 4.15Å; C7-L40 WeakPolarHBondContact O-CD2 3.48Å | ||
| 8 | K | 43.2 | Very low | 46.4 | Very low | 154 Ų | 154 | 115 Ų | 115 | 67% | 0.67 | 58% | 0.581 | S | S | * | * | B | Isolated β-bridge | trans | -90.2 | 135.4 | 171.2 | -165.3 | 170.9 | -177 | 177.6 | 0 | 107.1 | G10 Q11 | K8-G10 PolarHBondContact O-N 3.01Å; K8-G10 VanDerWaalsContact O-N 3.16Å; K8-Q11 CarbonylContact O-C 3.55Å; K8-Q11 PolarHBondContact O-N 3.14Å |
| 9 | V | 43.3 | Very low | 46.9 | Very low | 122 Ų | 122 | 111.6 Ų | 111.6 | 74% | 0.739 | 56% | 0.564 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -50.4 | 123.4 | 177.3 | 177.3 | 0 | 0 | 0 | 0 | 109.1 | ||
| 10 | G | 47.2 | Very low | 47.3 | Very low | 63 Ų | 63 | 107.2 Ų | 107.2 | 65% | 0.649 | 54% | 0.541 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 84.2 | -0.8 | -177.4 | 0 | 0 | 0 | 0 | 0 | 116.6 | K8 | K8-G10 PolarHBondContact O-N 3.01Å; K8-G10 VanDerWaalsContact O-N 3.16Å |
| 11 | Q | 44.8 | Very low | 47.7 | Very low | 137 Ų | 137 | 105.3 Ų | 105.3 | 64% | 0.64 | 54% | 0.535 | S | S | * | . | B | Isolated β-bridge | trans | -134.9 | 94.5 | 173.9 | -68.1 | -174.2 | 23.6 | 0 | 0 | 110.7 | K8 P13 | K8-Q11 CarbonylContact O-C 3.55Å; K8-Q11 PolarHBondContact O-N 3.14Å; Q11-P13 WeakPolarHBondContact O-CD 3.5Å |
| 12 | C | 53.5 | Low | 48.7 | Very low | 45 Ų | 45 | 101.3 Ų | 101.3 | 30% | 0.304 | 52% | 0.518 | S | S | . | . | trans | -83.9 | 114.4 | 166.2 | -49.5 | 0 | 0 | 0 | 0 | 107 | N14 C36 | C12-N14 PolarHBondContact O-N 3.27Å; C12-C36 HydrophobicContact CB-CB 4.28Å; C12-C36 WeakPolarHBondContact CB-SG 3.45Å; C12-C36 WeakPolarHBondContact SG-CB 3.18Å; C12-C36 CovalentContact SG-SG 2.02Å; C12-C36 PolarHBondContact SG-SG 3.2Å | ||
| 13 | P | 57.7 | Low | 49.5 | Very low | 66 Ų | 66 | 100.5 Ų | 100.5 | 43% | 0.429 | 51% | 0.51 | S | S | . | . | trans | -54.2 | 138.3 | 176 | 17.9 | -30.3 | 0 | 0 | 0 | 110 | Q11 R15 I16 | Q11-P13 WeakPolarHBondContact O-CD 3.5Å; P13-R15 PolarHBondContact O-N 3.35Å; P13-I16 HydrophobicContact CG-CD1 3.61Å; P13-I16 HydrophobicContact CG-CG1 3.99Å; P13-I16 WeakPolarHBondContact O-CB 3.45Å; P13-I16 PolarHBondContact O-N 3.04Å | ||
| 14 | N | 52.2 | Low | 50.1 | Low | 127 Ų | 127 | 98.2 Ų | 98.2 | 68% | 0.679 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -47.4 | -27.7 | -178.6 | -94.4 | -56.9 | 0 | 0 | 0 | 113.9 | C12 I16 Q17 S18 | C12-N14 PolarHBondContact O-N 3.27Å; N14-I16 PolarHBondContact O-N 3.07Å; N14-Q17 WeakPolarHBondContact O-CB 3.31Å; N14-Q17 PolarHBondContact O-N 3.27Å; N14-S18 PolarHBondContact O-N 3.46Å |
| 15 | R | 53.4 | Low | 50.6 | Low | 222 Ų | 222 | 96 Ų | 96 | 84% | 0.838 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -57.5 | -29.3 | 173 | -99.8 | -174.9 | 175.4 | -146 | -1.7 | 114.5 | P13 L19 | P13-R15 PolarHBondContact O-N 3.35Å; R15-L19 PolarHBondContact O-N 3.21Å |
| 16 | I | 56.4 | Low | 50.7 | Low | 13 Ų | 13 | 97.5 Ų | 97.5 | 7% | 0.067 | 50% | 0.5 | C | S | . | . | H | α-helix | trans | -77.9 | -38 | -179.9 | -63.9 | 177.6 | 0 | 0 | 0 | 110.3 | M5 C7 P13 N14 S18 L19 F20 | M5-I16 HydrophobicContact CE-CD1 4.03Å; M5-I16 HydrophobicContact CE-CG2 4.31Å; M5-I16 HydrophobicContact SD-CD1 3.49Å; M5-I16 WeakPolarHBondContact SD-CD1 3.49Å; M5-I16 HydrophobicContact SD-CG1 3.8Å; C7-I16 WeakPolarHBondContact SG-CD1 3.49Å; P13-I16 HydrophobicContact CG-CD1 3.61Å; P13-I16 HydrophobicContact CG-CG1 3.99Å; P13-I16 WeakPolarHBondContact O-CB 3.45Å; P13-I16 PolarHBondContact O-N 3.04Å; N14-I16 PolarHBondContact O-N 3.07Å; I16-S18 VanDerWaalsContact C-N 3.25Å; I16-S18 PolarHBondContact O-N 2.78Å; I16-L19 WeakPolarHBondContact O-CB 3.34Å; I16-L19 PolarHBondContact O-N 2.82Å; I16-F20 HydrophobicContact CG2-CD2 3.5Å; I16-F20 HydrophobicContact CG2-CE2 3.43Å; I16-F20 VanDerWaalsContact CG2-CE2 3.43Å; I16-F20 VanDerWaalsContact O-CD2 3.31Å; I16-F20 WeakPolarHBondContact O-CD2 3.48Å; I16-F20 PolarHBondContact O-N 2.81Å |
| 17 | Q | 52 | Low | 50.8 | Low | 79 Ų | 79 | 94.5 Ų | 94.5 | 37% | 0.369 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -53.3 | -48.2 | 170.2 | -89.6 | -172.2 | 5.2 | 0 | 0 | 110.5 | N14 L19 F20 T21 W26 | N14-Q17 WeakPolarHBondContact O-CB 3.31Å; N14-Q17 PolarHBondContact O-N 3.27Å; Q17-L19 VanDerWaalsContact C-N 3.29Å; Q17-L19 PolarHBondContact O-N 2.61Å; Q17-F20 PolarHBondContact O-N 2.68Å; Q17-T21 WeakPolarHBondContact O-CB 3.31Å; Q17-T21 PolarHBondContact O-N 3.03Å; Q17-T21 PolarHBondContact O-OG1 3.13Å; Q17-W26 HydrophobicContact CB-CZ3 4.38Å; Q17-W26 HydrophobicContact CG-CZ3 4.19Å |
| 18 | S | 52.6 | Low | 50.9 | Low | 78 Ų | 78 | 96.4 Ų | 96.4 | 55% | 0.545 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -59 | -38.7 | 177.1 | -58.2 | 0 | 0 | 0 | 0 | 112.9 | N14 I16 L22 | N14-S18 PolarHBondContact O-N 3.46Å; I16-S18 VanDerWaalsContact C-N 3.25Å; I16-S18 PolarHBondContact O-N 2.78Å; S18-L22 VanDerWaalsContact O-CB 3.28Å; S18-L22 WeakPolarHBondContact O-CB 3.24Å; S18-L22 PolarHBondContact O-N 2.64Å |
| 19 | L | 56.4 | Low | 51.3 | Low | 51 Ų | 51 | 92.5 Ų | 92.5 | 27% | 0.267 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -67.2 | -43 | 178.2 | -160.9 | 86 | 0 | 0 | 0 | 112 | R15 I16 Q17 L22 L23 L48 | R15-L19 PolarHBondContact O-N 3.21Å; I16-L19 WeakPolarHBondContact O-CB 3.34Å; I16-L19 PolarHBondContact O-N 2.82Å; Q17-L19 VanDerWaalsContact C-N 3.29Å; Q17-L19 PolarHBondContact O-N 2.61Å; L19-L22 PolarHBondContact O-N 2.79Å; L19-L23 HydrophobicContact CD2-CD1 4.28Å; L19-L23 HydrophobicContact CG-CD1 4.1Å; L19-L23 WeakPolarHBondContact O-CB 3.22Å; L19-L23 VanDerWaalsContact O-CG 3.22Å; L19-L23 WeakPolarHBondContact O-CG 3.39Å; L19-L23 PolarHBondContact O-N 3.42Å; L19-L48 HydrophobicContact CD2-CD1 4.08Å |
| 20 | F | 56.1 | Low | 51.3 | Low | 22 Ų | 22 | 94.5 Ų | 94.5 | 10% | 0.096 | 50% | 0.501 | C | S | . | . | H | α-helix | trans | -68.1 | -37.7 | 176.8 | -83.1 | -92.9 | 0 | 0 | 0 | 111.9 | I16 Q17 L23 G24 W25 L39 | I16-F20 HydrophobicContact CG2-CD2 3.5Å; I16-F20 HydrophobicContact CG2-CE2 3.43Å; I16-F20 VanDerWaalsContact CG2-CE2 3.43Å; I16-F20 VanDerWaalsContact O-CD2 3.31Å; I16-F20 WeakPolarHBondContact O-CD2 3.48Å; I16-F20 PolarHBondContact O-N 2.81Å; Q17-F20 PolarHBondContact O-N 2.68Å; F20-L23 PolarHBondContact O-N 2.96Å; F20-G24 PolarHBondContact O-N 3.17Å; F20-W25 HydrophobicContact CB-CB 4.3Å; F20-W25 HydrophobicContact CD1-CB 3.73Å; F20-W25 HydrophobicContact CD1-CD2 4.42Å; F20-W25 HydrophobicContact CD1-CE3 4.49Å; F20-W25 HydrophobicContact CD1-CG 4.12Å; F20-W25 HydrophobicContact CE1-CE3 4.36Å; F20-W25 PolarHBondContact O-N 3.46Å; F20-L39 HydrophobicContact CE1-CD1 4.47Å; F20-L39 HydrophobicContact CZ-CD1 3.75Å |
| 21 | T | 53.9 | Low | 51 | Low | 69 Ų | 69 | 92.9 Ų | 92.9 | 42% | 0.423 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -61.8 | -44.7 | 171.1 | -53.5 | 0 | 0 | 0 | 0 | 111.2 | Q17 L23 G24 W26 | Q17-T21 WeakPolarHBondContact O-CB 3.31Å; Q17-T21 PolarHBondContact O-N 3.03Å; Q17-T21 PolarHBondContact O-OG1 3.13Å; T21-L23 VanDerWaalsContact C-N 3.29Å; T21-L23 PolarHBondContact O-N 2.9Å; T21-G24 PolarHBondContact O-N 3.44Å; T21-W26 WeakPolarHBondContact OG1-CZ3 3.41Å |
| 22 | L | 53.4 | Low | 51.1 | Low | 152 Ų | 152 | 87 Ų | 87 | 80% | 0.796 | 46% | 0.46 | S | S | * | . | H | α-helix | trans | -65.7 | -33.2 | 179.7 | -149 | 99 | 0 | 0 | 0 | 112.4 | S18 L19 G24 | S18-L22 VanDerWaalsContact O-CB 3.28Å; S18-L22 WeakPolarHBondContact O-CB 3.24Å; S18-L22 PolarHBondContact O-N 2.64Å; L19-L22 PolarHBondContact O-N 2.79Å; L22-G24 VanDerWaalsContact C-N 3.27Å; L22-G24 PolarHBondContact O-N 2.87Å |
| 23 | L | 57.8 | Low | 50.9 | Low | 74 Ų | 74 | 88.4 Ų | 88.4 | 39% | 0.387 | 47% | 0.467 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -82.1 | -0.3 | 178.5 | -69.3 | 168.9 | 0 | 0 | 0 | 113.3 | L19 F20 T21 W25 L48 | L19-L23 HydrophobicContact CD2-CD1 4.28Å; L19-L23 HydrophobicContact CG-CD1 4.1Å; L19-L23 WeakPolarHBondContact O-CB 3.22Å; L19-L23 VanDerWaalsContact O-CG 3.22Å; L19-L23 WeakPolarHBondContact O-CG 3.39Å; L19-L23 PolarHBondContact O-N 3.42Å; F20-L23 PolarHBondContact O-N 2.96Å; T21-L23 VanDerWaalsContact C-N 3.29Å; T21-L23 PolarHBondContact O-N 2.9Å; L23-W25 VanDerWaalsContact O-CD1 3.25Å; L23-L48 HydrophobicContact CD1-CD1 4.28Å; L23-L48 HydrophobicContact CD1-CD2 4Å |
| 24 | G | 52.1 | Low | 50.4 | Low | 56 Ų | 56 | 88.1 Ų | 88.1 | 58% | 0.577 | 47% | 0.47 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 80.5 | 11.2 | -180 | 0 | 0 | 0 | 0 | 0 | 114.9 | F20 T21 L22 W26 | F20-G24 PolarHBondContact O-N 3.17Å; T21-G24 PolarHBondContact O-N 3.44Å; L22-G24 VanDerWaalsContact C-N 3.27Å; L22-G24 PolarHBondContact O-N 2.87Å; G24-W26 PolarHBondContact O-N 3.4Å; G24-W26 VanDerWaalsContact O-N 3.17Å |
| 25 | W | 50.8 | Low | 50.3 | Low | 142 Ų | 142 | 85.6 Ų | 85.6 | 54% | 0.538 | 46% | 0.457 | S | S | . | . | trans | -85 | 24.4 | -178.7 | -71.5 | 61.3 | 0 | 0 | 0 | 113 | F20 L23 H27 | F20-W25 HydrophobicContact CB-CB 4.3Å; F20-W25 HydrophobicContact CD1-CB 3.73Å; F20-W25 HydrophobicContact CD1-CD2 4.42Å; F20-W25 HydrophobicContact CD1-CE3 4.49Å; F20-W25 HydrophobicContact CD1-CG 4.12Å; F20-W25 HydrophobicContact CE1-CE3 4.36Å; F20-W25 PolarHBondContact O-N 3.46Å; L23-W25 VanDerWaalsContact O-CD1 3.25Å; W25-H27 PolarHBondContact O-N 3.48Å | ||
| 26 | W | 47.4 | Very low | 50.1 | Low | 107 Ų | 107 | 75.3 Ų | 75.3 | 41% | 0.405 | 42% | 0.418 | S | S | . | . | trans | -100.5 | 81.3 | -172.2 | -167.7 | -92.3 | 0 | 0 | 0 | 112.3 | Q17 T21 G24 | Q17-W26 HydrophobicContact CB-CZ3 4.38Å; Q17-W26 HydrophobicContact CG-CZ3 4.19Å; T21-W26 WeakPolarHBondContact OG1-CZ3 3.41Å; G24-W26 PolarHBondContact O-N 3.4Å; G24-W26 VanDerWaalsContact O-N 3.17Å | ||
| 27 | H | 43.6 | Very low | 49.7 | Very low | 184 Ų | 184 | 77.3 Ų | 77.3 | 85% | 0.852 | 43% | 0.434 | S | S | * | . | S | Bend | trans | -122.3 | -1.9 | 164.3 | -96.7 | -111.4 | 0 | 0 | 0 | 114.5 | W25 | W25-H27 PolarHBondContact O-N 3.48Š|
| 28 | S | 41 | Very low | 49.6 | Very low | 61 Ų | 61 | 76.2 Ų | 76.2 | 43% | 0.427 | 44% | 0.438 | S | S | . | . | trans | -166.3 | 131 | 167.3 | -92.4 | 0 | 0 | 0 | 0 | 113.1 | Q30 G31 A32 | S28-Q30 PolarHBondContact O-N 2.95Å; S28-G31 PolarHBondContact O-N 3.48Å; S28-A32 PolarHBondContact O-N 3.07Å | ||
| 29 | P | 50.9 | Low | 49.5 | Very low | 73 Ų | 73 | 74.9 Ų | 74.9 | 47% | 0.474 | 43% | 0.425 | S | S | . | . | H | α-helix | trans | -59.6 | -27.4 | 170.3 | 24.3 | -32.7 | 0 | 0 | 0 | 112.1 | T33 | P29-T33 PolarHBondContact O-N 2.96Å; P29-T33 PolarHBondContact O-OG1 3.19Å |
| 30 | Q | 44.6 | Very low | 49.1 | Very low | 163 Ų | 163 | 75 Ų | 75 | 76% | 0.762 | 43% | 0.426 | S | S | * | . | H | α-helix | trans | -71.5 | -35.8 | 173 | -70.3 | 174.5 | 53.9 | 0 | 0 | 112.3 | S28 T33 A34 | S28-Q30 PolarHBondContact O-N 2.95Å; Q30-T33 PolarHBondContact O-N 3.32Å; Q30-A34 WeakPolarHBondContact O-CB 3.05Å; Q30-A34 PolarHBondContact O-N 2.88Å |
| 31 | G | 41.7 | Very low | 48.4 | Very low | 29 Ų | 29 | 81.1 Ų | 81.1 | 30% | 0.299 | 46% | 0.459 | S | S | . | . | H | α-helix | trans | -72.4 | -38.2 | 176.7 | 0 | 0 | 0 | 0 | 0 | 113 | S28 T33 N35 | S28-G31 PolarHBondContact O-N 3.48Å; G31-T33 VanDerWaalsContact C-N 3.32Å; G31-T33 PolarHBondContact O-N 3.31Å; G31-N35 VanDerWaalsContact O-CB 3.31Å; G31-N35 WeakPolarHBondContact O-CB 3.22Å; G31-N35 PolarHBondContact O-N 3.41Å; G31-N35 PolarHBondContact O-ND2 3.08Å |
| 32 | A | 45.3 | Very low | 48 | Very low | 15 Ų | 15 | 80.8 Ų | 80.8 | 12% | 0.124 | 46% | 0.457 | C | S | . | . | H | α-helix | trans | -64.1 | -38.3 | 173.9 | 0 | 0 | 0 | 0 | 0 | 111.8 | S28 C36 | S28-A32 PolarHBondContact O-N 3.07Å; A32-C36 WeakPolarHBondContact O-CB 3.18Å; A32-C36 PolarHBondContact O-N 3.41Å |
| 33 | T | 49 | Very low | 47.5 | Very low | 74 Ų | 74 | 80.4 Ų | 80.4 | 45% | 0.454 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -73.8 | -40.5 | 178.9 | -52.1 | 0 | 0 | 0 | 0 | 112.2 | P29 Q30 G31 C36 S37 | P29-T33 PolarHBondContact O-N 2.96Å; P29-T33 PolarHBondContact O-OG1 3.19Å; Q30-T33 PolarHBondContact O-N 3.32Å; G31-T33 VanDerWaalsContact C-N 3.32Å; G31-T33 PolarHBondContact O-N 3.31Å; T33-C36 PolarHBondContact O-N 2.88Å; T33-S37 PolarHBondContact O-N 2.97Å; T33-S37 PolarHBondContact O-OG 3.26Å |
| 34 | A | 48 | Very low | 46.9 | Very low | 60 Ų | 60 | 84 Ų | 84 | 50% | 0.496 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -64 | -45.3 | 175.2 | 0 | 0 | 0 | 0 | 0 | 111.7 | Q30 C36 S37 A38 | Q30-A34 WeakPolarHBondContact O-CB 3.05Å; Q30-A34 PolarHBondContact O-N 2.88Å; A34-C36 VanDerWaalsContact C-N 3.33Å; A34-C36 PolarHBondContact O-N 2.74Å; A34-S37 PolarHBondContact O-N 3.03Å; A34-A38 PolarHBondContact O-N 2.96Å |
| 35 | N | 50.4 | Low | 46.6 | Very low | 74 Ų | 74 | 91.8 Ų | 91.8 | 40% | 0.396 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -68.6 | -31.4 | 177 | -80 | -27.1 | 0 | 0 | 0 | 112.8 | G31 S37 A38 L39 | G31-N35 VanDerWaalsContact O-CB 3.31Å; G31-N35 WeakPolarHBondContact O-CB 3.22Å; G31-N35 PolarHBondContact O-N 3.41Å; G31-N35 PolarHBondContact O-ND2 3.08Å; N35-S37 VanDerWaalsContact C-N 3.3Å; N35-S37 PolarHBondContact O-N 3.5Å; N35-A38 PolarHBondContact O-N 3.24Å; N35-L39 WeakPolarHBondContact O-CB 3.5Å; N35-L39 WeakPolarHBondContact O-CD1 3.46Å; N35-L39 VanDerWaalsContact O-CG 3.24Å; N35-L39 WeakPolarHBondContact O-CG 3.49Å; N35-L39 PolarHBondContact O-N 3.02Å |
| 36 | C | 48.4 | Very low | 46.5 | Very low | 5 Ų | 5 | 88.1 Ų | 88.1 | 3% | 0.034 | 48% | 0.478 | C | S | . | . | H | α-helix | trans | -66.4 | -34.2 | 175.8 | -167.3 | 0 | 0 | 0 | 0 | 111.7 | C12 A32 T33 A34 L40 | C12-C36 HydrophobicContact CB-CB 4.28Å; C12-C36 WeakPolarHBondContact CB-SG 3.45Å; C12-C36 WeakPolarHBondContact SG-CB 3.18Å; C12-C36 CovalentContact SG-SG 2.02Å; C12-C36 PolarHBondContact SG-SG 3.2Å; A32-C36 WeakPolarHBondContact O-CB 3.18Å; A32-C36 PolarHBondContact O-N 3.41Å; T33-C36 PolarHBondContact O-N 2.88Å; A34-C36 VanDerWaalsContact C-N 3.33Å; A34-C36 PolarHBondContact O-N 2.74Å; C36-L40 WeakPolarHBondContact O-CD1 3.28Å; C36-L40 WeakPolarHBondContact O-CG 2.86Å |
| 37 | S | 48.7 | Very low | 46.3 | Very low | 56 Ų | 56 | 88.3 Ų | 88.3 | 39% | 0.392 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -73 | -37 | 171.6 | -59 | 0 | 0 | 0 | 0 | 112.7 | T33 A34 N35 L40 | T33-S37 PolarHBondContact O-N 2.97Å; T33-S37 PolarHBondContact O-OG 3.26Å; A34-S37 PolarHBondContact O-N 3.03Å; N35-S37 VanDerWaalsContact C-N 3.3Å; N35-S37 PolarHBondContact O-N 3.5Å; S37-L40 PolarHBondContact O-N 3.46Å |
| 38 | A | 49.6 | Very low | 46.5 | Very low | 55 Ų | 55 | 83.3 Ų | 83.3 | 46% | 0.455 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -68.4 | -41.6 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | A34 N35 L40 N41 T42 | A34-A38 PolarHBondContact O-N 2.96Å; N35-A38 PolarHBondContact O-N 3.24Å; A38-L40 PolarHBondContact O-N 3.27Å; A38-N41 PolarHBondContact O-N 3.01Å; A38-T42 PolarHBondContact O-OG1 3.23Å |
| 39 | L | 50 | Low | 46.6 | Very low | 51 Ų | 51 | 84 Ų | 84 | 27% | 0.267 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -65.7 | -20.4 | 177.4 | -79.7 | 163.4 | 0 | 0 | 0 | 113.6 | F20 N35 T42 I46 | F20-L39 HydrophobicContact CE1-CD1 4.47Å; F20-L39 HydrophobicContact CZ-CD1 3.75Å; N35-L39 WeakPolarHBondContact O-CB 3.5Å; N35-L39 WeakPolarHBondContact O-CD1 3.46Å; N35-L39 VanDerWaalsContact O-CG 3.24Å; N35-L39 WeakPolarHBondContact O-CG 3.49Å; N35-L39 PolarHBondContact O-N 3.02Å; L39-T42 VanDerWaalsContact O-O 3.05Å; L39-I46 HydrophobicContact CB-CD1 4.15Å; L39-I46 HydrophobicContact CD1-CD1 4.03Å; L39-I46 HydrophobicContact CD2-CD1 3.24Å; L39-I46 HydrophobicContact CD2-CG1 3.47Å; L39-I46 VanDerWaalsContact CD2-CG1 3.47Å; L39-I46 HydrophobicContact CG-CD1 3.99Å |
| 40 | L | 47.8 | Very low | 46.5 | Very low | 54 Ų | 54 | 86 Ų | 86 | 28% | 0.283 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -87.9 | -24 | -179.5 | -75.4 | 161.5 | 0 | 0 | 0 | 113.6 | C7 C36 S37 A38 | C7-L40 HydrophobicContact CB-CD1 3.64Å; C7-L40 HydrophobicContact CB-CD2 3.72Å; C7-L40 HydrophobicContact CB-CG 4.15Å; C7-L40 WeakPolarHBondContact O-CD2 3.48Å; C36-L40 WeakPolarHBondContact O-CD1 3.28Å; C36-L40 WeakPolarHBondContact O-CG 2.86Å; S37-L40 PolarHBondContact O-N 3.46Å; A38-L40 PolarHBondContact O-N 3.27Å |
| 41 | N | 42.4 | Very low | 46.7 | Very low | 150 Ų | 150 | 85.5 Ų | 85.5 | 80% | 0.802 | 48% | 0.482 | S | S | * | . | H | α-helix | trans | -84.3 | -19.6 | 178.1 | -148.5 | 17.8 | 0 | 0 | 0 | 112 | A38 | A38-N41 PolarHBondContact O-N 3.01Å |
| 42 | T | 44.4 | Very low | 47 | Very low | 61 Ų | 61 | 89.4 Ų | 89.4 | 37% | 0.374 | 50% | 0.502 | S | S | . | . | trans | -96.9 | 100.9 | 168.8 | 54.5 | 0 | 0 | 0 | 0 | 107.9 | A38 L39 E44 | A38-T42 PolarHBondContact O-OG1 3.23Å; L39-T42 VanDerWaalsContact O-O 3.05Å; T42-E44 PolarHBondContact O-N 3.46Å | ||
| 43 | T | 43.3 | Very low | 47.3 | Very low | 145 Ų | 145 | 96.4 Ų | 96.4 | 89% | 0.89 | 54% | 0.536 | S | S | * | . | trans | -70.4 | 44.1 | 167.7 | -52.6 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 44 | E | 46.4 | Very low | 47.3 | Very low | 150 Ų | 150 | 97.3 Ų | 97.3 | 70% | 0.701 | 55% | 0.546 | S | S | * | . | trans | -103.6 | 131.9 | -179.4 | -63.6 | -156 | 92.9 | 0 | 0 | 107.2 | T42 I46 | T42-E44 PolarHBondContact O-N 3.46Å; E44-I46 PolarHBondContact O-N 3.4Å | ||
| 45 | R | 44.8 | Very low | 47.3 | Very low | 218 Ų | 218 | 100.1 Ų | 100.1 | 82% | 0.823 | 56% | 0.559 | S | S | * | * | trans | -54.3 | 115.7 | 179.7 | -67.5 | 175.4 | 169.6 | -167.8 | -1.6 | 108 | D47 | R45-D47 VanDerWaalsContact C-N 3.3Å; R45-D47 PolarHBondContact O-N 2.82Å | ||
| 46 | I | 48.4 | Very low | 47.3 | Very low | 66 Ų | 66 | 101.9 Ų | 101.9 | 34% | 0.338 | 58% | 0.577 | S | S | . | * | trans | -73.6 | 96.3 | 168.1 | -49.6 | 165.5 | 0 | 0 | 0 | 105.5 | M5 L39 E44 L48 | M5-I46 HydrophobicContact CE-CD1 4.46Å; L39-I46 HydrophobicContact CB-CD1 4.15Å; L39-I46 HydrophobicContact CD1-CD1 4.03Å; L39-I46 HydrophobicContact CD2-CD1 3.24Å; L39-I46 HydrophobicContact CD2-CG1 3.47Å; L39-I46 VanDerWaalsContact CD2-CG1 3.47Å; L39-I46 HydrophobicContact CG-CD1 3.99Å; E44-I46 PolarHBondContact O-N 3.4Å; I46-L48 VanDerWaalsContact C-N 3.32Å; I46-L48 HydrophobicContact CG2-CD2 3.68Å; I46-L48 HydrophobicContact CG2-CG 3.99Å; I46-L48 PolarHBondContact O-N 3.28Å | ||
| 47 | D | 43 | Very low | 47.3 | Very low | 110 Ų | 110 | 107.9 Ų | 107.9 | 59% | 0.588 | 61% | 0.605 | S | S | * | * | trans | -72.9 | 96.3 | 166.1 | -161.5 | -95.2 | 0 | 0 | 0 | 107.1 | R45 S49 | R45-D47 VanDerWaalsContact C-N 3.3Å; R45-D47 PolarHBondContact O-N 2.82Å; D47-S49 PolarHBondContact O-N 3.04Å; D47-S49 WeakPolarHBondContact OD1-CB 3.41Å; D47-S49 PolarHBondContact OD1-N 3.26Å; D47-S49 PolarHBondContact OD1-OG 3.46Å | ||
| 48 | L | 49.5 | Very low | 47.3 | Very low | 80 Ų | 80 | 110.8 Ų | 110.8 | 42% | 0.419 | 63% | 0.625 | S | S | . | * | trans | -73.8 | 64.5 | 169.9 | -63.6 | 171.7 | 0 | 0 | 0 | 108.1 | L19 L23 I46 | L19-L48 HydrophobicContact CD2-CD1 4.08Å; L23-L48 HydrophobicContact CD1-CD1 4.28Å; L23-L48 HydrophobicContact CD1-CD2 4Å; I46-L48 VanDerWaalsContact C-N 3.32Å; I46-L48 HydrophobicContact CG2-CD2 3.68Å; I46-L48 HydrophobicContact CG2-CG 3.99Å; I46-L48 PolarHBondContact O-N 3.28Å | ||
| 49 | S | 43 | Very low | 47.2 | Very low | 75 Ų | 75 | 115.4 Ų | 115.4 | 52% | 0.524 | 64% | 0.642 | S | S | . | * | trans | -66.2 | 127.1 | 160.3 | -81.7 | 0 | 0 | 0 | 0 | 106.4 | D47 Q51 | D47-S49 PolarHBondContact O-N 3.04Å; D47-S49 WeakPolarHBondContact OD1-CB 3.41Å; D47-S49 PolarHBondContact OD1-N 3.26Å; D47-S49 PolarHBondContact OD1-OG 3.46Å; S49-Q51 VanDerWaalsContact C-N 3.31Å; S49-Q51 PolarHBondContact O-N 3.36Å | ||
| 50 | P | 48.4 | Very low | 47.2 | Very low | 114 Ų | 114 | 121.7 Ų | 121.7 | 74% | 0.74 | 66% | 0.663 | S | S | * | * | trans | -57.5 | 104.6 | 171 | 24.4 | -30.8 | 0 | 0 | 0 | 105.8 | P52 | P50-P52 VanDerWaalsContact O-N 3.15Š| ||
| 51 | Q | 48.9 | Very low | 47.1 | Very low | 153 Ų | 153 | 123.5 Ų | 123.5 | 72% | 0.715 | 67% | 0.673 | S | S | * | * | trans | -57.8 | 126.1 | 165.7 | -74.1 | -163.5 | 91.3 | 0 | 0 | 104.2 | S49 L53 | S49-Q51 VanDerWaalsContact C-N 3.31Å; S49-Q51 PolarHBondContact O-N 3.36Å; Q51-L53 PolarHBondContact O-N 2.8Å | ||
| 52 | P | 47 | Very low | 47.7 | Very low | 111 Ų | 111 | 123.7 Ų | 123.7 | 72% | 0.721 | 67% | 0.674 | S | S | * | * | trans | -50.2 | 127.8 | 170.3 | 23.2 | -31.2 | 0 | 0 | 0 | 104.8 | P50 S54 | P50-P52 VanDerWaalsContact O-N 3.15Å; P52-S54 PolarHBondContact O-N 2.98Å | ||
| 53 | L | 52.1 | Low | 48.2 | Very low | 162 Ų | 162 | 129.2 Ų | 129.2 | 85% | 0.848 | 70% | 0.696 | S | S | * | * | trans | -51.4 | 98.7 | 162.7 | -72.7 | 156.4 | 0 | 0 | 0 | 103.5 | Q51 P55 | Q51-L53 PolarHBondContact O-N 2.8Å; L53-P55 WeakPolarHBondContact O-CD 3.1Å | ||
| 54 | S | 49.6 | Very low | 48.9 | Very low | 94 Ų | 94 | 127.4 Ų | 127.4 | 66% | 0.657 | 68% | 0.677 | S | S | * | * | trans | -46.6 | 124.4 | 158.6 | -76 | 0 | 0 | 0 | 0 | 102.7 | P52 S56 | P52-S54 PolarHBondContact O-N 2.98Å; S54-S56 PolarHBondContact O-N 3.31Å | ||
| 55 | P | 47.9 | Very low | 49.2 | Very low | 118 Ų | 118 | 131.1 Ų | 131.1 | 77% | 0.766 | 69% | 0.685 | S | S | * | * | trans | -57.6 | 96.1 | 176.1 | 22.3 | -30.7 | 0 | 0 | 0 | 105.7 | L53 Q57 | L53-P55 WeakPolarHBondContact O-CD 3.1Å; P55-Q57 PolarHBondContact O-N 3.4Å | ||
| 56 | S | 49.2 | Very low | 49.7 | Very low | 112 Ų | 112 | 124.2 Ų | 124.2 | 78% | 0.783 | 68% | 0.682 | S | S | * | * | trans | -64.5 | 94.1 | 168.5 | -100.6 | 0 | 0 | 0 | 0 | 103 | S54 S58 | S54-S56 PolarHBondContact O-N 3.31Å; S56-S58 PolarHBondContact O-N 3.23Å | ||
| 57 | Q | 48.2 | Very low | 50.1 | Low | 131 Ų | 131 | 130.4 Ų | 130.4 | 61% | 0.612 | 70% | 0.701 | S | S | * | * | S | Bend | trans | 27.5 | 60.1 | 168 | -73.6 | 175.7 | -24.3 | 0 | 0 | 113 | P55 D59 Y60 | P55-Q57 PolarHBondContact O-N 3.4Å; Q57-D59 PolarHBondContact O-N 3.04Å; Q57-Y60 HydrophobicContact CB-CD2 3.85Å; Q57-Y60 HydrophobicContact CB-CE2 4.29Å; Q57-Y60 PolarHBondContact O-N 2.9Å |
| 58 | S | 49.1 | Very low | 50.7 | Low | 117 Ų | 117 | 136.5 Ų | 136.5 | 82% | 0.818 | 72% | 0.716 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76.2 | 10 | 152.9 | -57.4 | 0 | 0 | 0 | 0 | 110.6 | S56 Y60 | S56-S58 PolarHBondContact O-N 3.23Å; S58-Y60 VanDerWaalsContact C-N 3.33Å |
| 59 | D | 47.8 | Very low | 50.7 | Low | 151 Ų | 151 | 136.5 Ų | 136.5 | 81% | 0.807 | 74% | 0.735 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -96.5 | 28.6 | 159 | -148.8 | -105.7 | 0 | 0 | 0 | 110.9 | Q57 D61 | Q57-D59 PolarHBondContact O-N 3.04Å; D59-D61 PolarHBondContact O-N 3.36Å; D59-D61 VanDerWaalsContact O-N 3.07Å |
| 60 | Y | 49.8 | Very low | 51.2 | Low | 184 Ų | 184 | 135.9 Ų | 135.9 | 72% | 0.722 | 74% | 0.74 | S | S | * | * | S | Bend | trans | -76.1 | 81.5 | 151.1 | -101.7 | -79.9 | 0 | 0 | 0 | 106.8 | Q57 S58 | Q57-Y60 HydrophobicContact CB-CD2 3.85Å; Q57-Y60 HydrophobicContact CB-CE2 4.29Å; Q57-Y60 PolarHBondContact O-N 2.9Å; S58-Y60 VanDerWaalsContact C-N 3.33Å |
| 61 | D | 46.7 | Very low | 51.5 | Low | 91 Ų | 91 | 140.3 Ų | 140.3 | 49% | 0.487 | 75% | 0.751 | S | S | . | * | trans | 46.5 | 82.7 | 145.4 | -150.4 | -87.3 | 0 | 0 | 0 | 115.3 | D59 E63 E64 | D59-D61 PolarHBondContact O-N 3.36Å; D59-D61 VanDerWaalsContact O-N 3.07Å; D61-E63 PolarHBondContact O-N 3.33Å; D61-E63 VanDerWaalsContact O-N 3.14Å; D61-E63 WeakPolarHBondContact OD1-CA 3.13Å; D61-E63 WeakPolarHBondContact OD1-CB 3.37Å; D61-E63 PolarHBondContact OD1-N 3.22Å; D61-E64 WeakPolarHBondContact OD1-CB 3.35Å; D61-E64 PolarHBondContact OD1-N 2.02Å | ||
| 62 | D | 54.8 | Low | 51.7 | Low | 154 Ų | 154 | 136.5 Ų | 136.5 | 82% | 0.824 | 75% | 0.753 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -70.9 | 16.1 | 161.3 | -163.4 | -121.2 | 0 | 0 | 0 | 111.7 | ||
| 63 | E | 55.4 | Low | 52.4 | Low | 177 Ų | 177 | 142.7 Ų | 142.7 | 83% | 0.827 | 76% | 0.762 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -107 | -22.4 | -178.8 | -139 | -179.6 | 98.6 | 0 | 0 | 114 | D61 | D61-E63 PolarHBondContact O-N 3.33Å; D61-E63 VanDerWaalsContact O-N 3.14Å; D61-E63 WeakPolarHBondContact OD1-CA 3.13Å; D61-E63 WeakPolarHBondContact OD1-CB 3.37Å; D61-E63 PolarHBondContact OD1-N 3.22Å |
| 64 | E | 56 | Low | 52.8 | Low | 107 Ų | 107 | 144.3 Ų | 144.3 | 50% | 0.5 | 77% | 0.765 | S | S | . | * | G | 310 helix | trans | -88.8 | -1.5 | 175.9 | -85.9 | -111.2 | 104.1 | 0 | 0 | 114.6 | D61 G66 R67 | D61-E64 WeakPolarHBondContact OD1-CB 3.35Å; D61-E64 PolarHBondContact OD1-N 2.02Å; E64-G66 PolarHBondContact O-N 2.92Å; E64-R67 PolarHBondContact O-N 3.23Å |
| 65 | R | 54.5 | Low | 53.5 | Low | 229 Ų | 229 | 147.4 Ų | 147.4 | 86% | 0.864 | 77% | 0.774 | S | S | * | * | G | 310 helix | trans | -71.7 | 7.5 | 175.1 | -152.8 | 175.4 | -173.5 | 146.6 | 3.5 | 114.1 | ||
| 66 | G | 54.8 | Low | 53.9 | Low | 73 Ų | 73 | 149.1 Ų | 149.1 | 75% | 0.753 | 78% | 0.776 | S | S | * | * | G | 310 helix | trans | -111.5 | -2.4 | 178.3 | 0 | 0 | 0 | 0 | 0 | 116.4 | E64 | E64-G66 PolarHBondContact O-N 2.92Š|
| 67 | R | 55.9 | Low | 54.2 | Low | 196 Ų | 196 | 147.3 Ų | 147.3 | 74% | 0.74 | 77% | 0.768 | S | S | * | * | trans | -107.2 | -8.9 | -163 | -151.3 | 171.1 | -166.2 | 170.5 | 5.6 | 117.9 | E64 G69 | E64-R67 PolarHBondContact O-N 3.23Å; R67-G69 PolarHBondContact O-N 2.79Å | ||
| 68 | W | 56.1 | Low | 54.7 | Low | 238 Ų | 238 | 147.1 Ų | 147.1 | 90% | 0.902 | 78% | 0.782 | S | S | * | * | trans | -90.9 | 31.1 | 175.2 | -64.7 | 86.5 | 0 | 0 | 0 | 113.7 | G70 | W68-G70 VanDerWaalsContact C-N 3.29Å; W68-G70 PolarHBondContact O-N 2.87Å | ||
| 69 | G | 50 | Low | 55.2 | Low | 80 Ų | 80 | 152.9 Ų | 152.9 | 83% | 0.825 | 79% | 0.785 | S | S | * | * | trans | -71.4 | 85.5 | 159.5 | 0 | 0 | 0 | 0 | 0 | 109.5 | R67 | R67-G69 PolarHBondContact O-N 2.79Š| ||
| 70 | G | 53.9 | Low | 55.7 | Low | 62 Ų | 62 | 152 Ų | 152 | 64% | 0.639 | 78% | 0.78 | S | S | * | * | trans | -173.8 | 101.1 | -179.6 | 0 | 0 | 0 | 0 | 0 | 113 | W68 | W68-G70 VanDerWaalsContact C-N 3.29Å; W68-G70 PolarHBondContact O-N 2.87Å | ||
| 71 | E | 54 | Low | 56 | Low | 207 Ų | 207 | 146.9 Ų | 146.9 | 97% | 0.967 | 77% | 0.772 | S | S | * | * | trans | 75.1 | 95 | 145.8 | -146 | 159 | 96.8 | 0 | 0 | 117.7 | ||||
| 72 | G | 53.6 | Low | 56.7 | Low | 72 Ų | 72 | 149.8 Ų | 149.8 | 74% | 0.742 | 79% | 0.793 | S | S | * | * | trans | -162.7 | 60.7 | 167.9 | 0 | 0 | 0 | 0 | 0 | 111.6 | H74 | G72-H74 PolarHBondContact O-N 3.39Å; G72-H74 VanDerWaalsContact O-N 3.13Å | ||
| 73 | R | 60.1 | Low | 57 | Low | 241 Ų | 241 | 149 Ų | 149 | 91% | 0.909 | 79% | 0.794 | S | S | * | * | trans | -64.5 | 105.2 | 164.6 | -77.2 | -178.4 | 175.1 | 155 | -1.5 | 108.3 | ||||
| 74 | H | 60.9 | Low | 57.1 | Low | 197 Ų | 197 | 144.8 Ų | 144.8 | 91% | 0.912 | 79% | 0.79 | S | S | * | * | trans | -116.4 | 85.3 | 158.1 | -87.3 | 166.6 | 0 | 0 | 0 | 109 | G72 | G72-H74 PolarHBondContact O-N 3.39Å; G72-H74 VanDerWaalsContact O-N 3.13Å | ||
| 75 | D | 64.3 | Low | 57.5 | Low | 159 Ų | 159 | 148.1 Ų | 148.1 | 85% | 0.85 | 81% | 0.81 | S | S | * | * | trans | -67.9 | 111.4 | 151 | -119.1 | -87.4 | 0 | 0 | 0 | 106.8 | ||||
| 76 | N | 57.7 | Low | 57.7 | Low | 153 Ų | 153 | 150.5 Ų | 150.5 | 82% | 0.818 | 83% | 0.826 | S | S | * | * | trans | -157.2 | 94.6 | 148.8 | -148.5 | -9.9 | 0 | 0 | 0 | 112.2 | ||||
| 77 | A | 54.8 | Low | 57.8 | Low | 74 Ų | 74 | 154.4 Ų | 154.4 | 61% | 0.612 | 83% | 0.83 | S | S | * | * | trans | 43.6 | 103.9 | 144 | 0 | 0 | 0 | 0 | 0 | 118.1 | R79 | A77-R79 PolarHBondContact O-N 2.87Å; A77-R79 VanDerWaalsContact O-N 3.08Å | ||
| 78 | S | 58.2 | Low | 57.9 | Low | 128 Ų | 128 | 152.2 Ų | 152.2 | 90% | 0.895 | 84% | 0.835 | S | S | * | * | trans | -40.2 | 111.8 | 137.6 | -58.5 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 79 | R | 60.9 | Low | 58 | Low | 237 Ų | 237 | 147.4 Ų | 147.4 | 89% | 0.894 | 83% | 0.831 | S | S | * | * | trans | -101.3 | 93 | 164.4 | -171 | 168.1 | 162.8 | 174.1 | -5.8 | 104.1 | A77 | A77-R79 PolarHBondContact O-N 2.87Å; A77-R79 VanDerWaalsContact O-N 3.08Å | ||
| 80 | D | 56.8 | Low | 58.5 | Low | 132 Ų | 132 | 151.4 Ų | 151.4 | 71% | 0.706 | 83% | 0.832 | S | S | * | * | 54.2 | 129 | 86.1 | -163.8 | -91.9 | 0 | 0 | 0 | 110.7 | |||||
| 81 | S | 56.3 | Low | 58.8 | Low | 77 Ų | 77 | 156.9 Ų | 156.9 | 54% | 0.538 | 84% | 0.844 | S | S | . | * | cis | -166.6 | 151.9 | -13.9 | -103.4 | 0 | 0 | 0 | 0 | 102.8 | T83 | S81-T83 PolarHBondContact O-N 3.16Š| ||
| 82 | T | 62.2 | Low | 59.1 | Low | 152 Ų | 152 | 153.6 Ų | 153.6 | 93% | 0.933 | 84% | 0.835 | S | S | * | * | trans | -50.2 | 99.4 | 166 | -37 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 83 | T | 61.1 | Low | 59.5 | Low | 137 Ų | 137 | 159.4 Ų | 159.4 | 84% | 0.84 | 84% | 0.842 | S | S | * | * | trans | -90.3 | 115 | 170.4 | 17.8 | 0 | 0 | 0 | 0 | 111.3 | S81 | S81-T83 PolarHBondContact O-N 3.16Š| ||
| 84 | A | 57.6 | Low | 59.4 | Low | 90 Ų | 90 | 153.2 Ų | 153.2 | 74% | 0.744 | 84% | 0.837 | S | S | * | * | trans | 79.9 | 99.1 | 141 | 0 | 0 | 0 | 0 | 0 | 118.3 | ||||
| 85 | L | 63.4 | Low | 59.3 | Low | 177 Ų | 177 | 149.5 Ų | 149.5 | 93% | 0.927 | 83% | 0.831 | S | S | * | * | trans | -48.9 | 132.8 | 141.9 | -73.6 | 90.6 | 0 | 0 | 0 | 111 | ||||
| 86 | K | 58.3 | Low | 58.8 | Low | 278 Ų | 278 | 148.6 Ų | 148.6 | 100% | 1.209 | 83% | 0.829 | S | S | * | * | -151.5 | 0 | 125 | -156.7 | 166.4 | -174.7 | 169.9 | 0 | 109.6 |
Retrieved 86 of 86 residues in 58.2 ms
(Link to these results)