| 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 | 60.2 | Low | 76.1 | Confident | 198 Ų | 198 | 102.3 Ų | 102.3 | 98% | 0.975 | 53% | 0.533 | S | S | * | . | 0 | -52.5 | 0 | -54.8 | -44.1 | -175.8 | 0 | 0 | 112.5 | F3 L4 T5 | M1-F3 PolarHBondContact O-N 3.47Å; M1-L4 PolarHBondContact O-N 3.07Å; M1-T5 PolarHBondContact O-N 3.35Å; M1-T5 PolarHBondContact O-OG1 2.94Å | |||
| 2 | Q | 72.4 | Confident | 76.3 | Confident | 145 Ų | 145 | 103.4 Ų | 103.4 | 68% | 0.678 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -56.8 | -40 | -177.4 | 71.1 | -171.8 | 8.4 | 0 | 0 | 115.4 | T5 L6 | Q2-T5 PolarHBondContact O-N 2.85Å; Q2-L6 PolarHBondContact O-N 3.36Å |
| 3 | F | 72.4 | Confident | 76.3 | Confident | 135 Ų | 135 | 101.8 Ų | 101.8 | 59% | 0.592 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -68.8 | -38.2 | -178.4 | -66.5 | -74.9 | 0 | 0 | 0 | 112.7 | M1 L6 I7 | M1-F3 PolarHBondContact O-N 3.47Å; F3-L6 PolarHBondContact O-N 3.23Å; F3-I7 WeakPolarHBondContact O-CG1 3.35Å; F3-I7 PolarHBondContact O-N 2.93Å |
| 4 | L | 76.5 | Confident | 76.1 | Confident | 117 Ų | 117 | 97 Ų | 97 | 61% | 0.613 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -64.7 | -43.7 | 176.4 | -174.7 | 67.5 | 0 | 0 | 0 | 110.3 | M1 L6 I7 T8 | M1-L4 PolarHBondContact O-N 3.07Å; L4-L6 VanDerWaalsContact C-N 3.32Å; L4-L6 PolarHBondContact O-N 2.81Å; L4-I7 PolarHBondContact O-N 3.19Å; L4-T8 PolarHBondContact O-N 3.44Å; L4-T8 PolarHBondContact O-OG1 3.03Å |
| 5 | T | 77.4 | Confident | 75.7 | Confident | 87 Ų | 87 | 99.9 Ų | 99.9 | 53% | 0.534 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -59 | -43.2 | 175.2 | -52.3 | 0 | 0 | 0 | 0 | 111.6 | M1 Q2 I7 T8 V9 | M1-T5 PolarHBondContact O-N 3.35Å; M1-T5 PolarHBondContact O-OG1 2.94Å; Q2-T5 PolarHBondContact O-N 2.85Å; T5-I7 PolarHBondContact O-N 3.13Å; T5-T8 PolarHBondContact O-N 3.47Å; T5-V9 HydrophobicContact CG2-CG2 4.5Å; T5-V9 VanDerWaalsContact O-CG2 3.28Å; T5-V9 WeakPolarHBondContact O-CG2 3.27Å; T5-V9 PolarHBondContact O-N 3.02Å |
| 6 | L | 79.9 | Confident | 74.9 | Confident | 99 Ų | 99 | 100.8 Ų | 100.8 | 52% | 0.518 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -60.2 | -46.5 | 176.4 | -175.3 | 67.4 | 0 | 0 | 0 | 111.5 | Q2 F3 L4 T8 V9 V10 | Q2-L6 PolarHBondContact O-N 3.36Å; F3-L6 PolarHBondContact O-N 3.23Å; L4-L6 VanDerWaalsContact C-N 3.32Å; L4-L6 PolarHBondContact O-N 2.81Å; L6-T8 PolarHBondContact O-N 2.69Å; L6-V9 PolarHBondContact O-N 3.31Å; L6-V10 WeakPolarHBondContact O-CG2 3.26Å; L6-V10 PolarHBondContact O-N 3.23Å |
| 7 | I | 80.2 | Confident | 74.1 | Confident | 72 Ų | 72 | 98.1 Ų | 98.1 | 37% | 0.369 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -60.9 | -44.8 | 177.4 | -67.5 | 161.9 | 0 | 0 | 0 | 110.9 | F3 L4 T5 V9 V10 L11 | F3-I7 WeakPolarHBondContact O-CG1 3.35Å; F3-I7 PolarHBondContact O-N 2.93Å; L4-I7 PolarHBondContact O-N 3.19Å; T5-I7 PolarHBondContact O-N 3.13Å; I7-V9 VanDerWaalsContact C-N 3.34Å; I7-V9 PolarHBondContact O-N 3.42Å; I7-V10 PolarHBondContact O-N 3.25Å; I7-L11 HydrophobicContact CG2-CD1 4.04Å; I7-L11 HydrophobicContact CG2-CG 4.43Å; I7-L11 WeakPolarHBondContact O-CB 3.4Å; I7-L11 WeakPolarHBondContact O-CG 3.05Å; I7-L11 PolarHBondContact O-N 2.87Å |
| 8 | T | 78.1 | Confident | 73 | Confident | 68 Ų | 68 | 96.7 Ų | 96.7 | 42% | 0.417 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -60.9 | -42.3 | 176.6 | -53.1 | 0 | 0 | 0 | 0 | 111.6 | L4 T5 L6 L11 L12 | L4-T8 PolarHBondContact O-N 3.44Å; L4-T8 PolarHBondContact O-OG1 3.03Å; T5-T8 PolarHBondContact O-N 3.47Å; L6-T8 PolarHBondContact O-N 2.69Å; T8-L11 PolarHBondContact O-N 3.1Å; T8-L12 HydrophobicContact CG2-CD1 4.1Å; T8-L12 WeakPolarHBondContact O-CB 3.48Å; T8-L12 WeakPolarHBondContact O-CG 3.47Å; T8-L12 PolarHBondContact O-N 3.3Å |
| 9 | V | 79.7 | Confident | 72.2 | Confident | 75 Ų | 75 | 98.2 Ų | 98.2 | 46% | 0.455 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -64.9 | -44 | 177.5 | 171.9 | 0 | 0 | 0 | 0 | 110.9 | T5 L6 I7 L12 V13 | T5-V9 HydrophobicContact CG2-CG2 4.5Å; T5-V9 VanDerWaalsContact O-CG2 3.28Å; T5-V9 WeakPolarHBondContact O-CG2 3.27Å; T5-V9 PolarHBondContact O-N 3.02Å; L6-V9 PolarHBondContact O-N 3.31Å; I7-V9 VanDerWaalsContact C-N 3.34Å; I7-V9 PolarHBondContact O-N 3.42Å; V9-L12 PolarHBondContact O-N 3.4Å; V9-V13 HydrophobicContact CG1-CG2 4.45Å; V9-V13 VanDerWaalsContact O-CG2 3.3Å; V9-V13 WeakPolarHBondContact O-CG2 3.4Å; V9-V13 PolarHBondContact O-N 3.28Å |
| 10 | V | 81.6 | Confident | 71.2 | Confident | 47 Ų | 47 | 101.7 Ų | 101.7 | 29% | 0.285 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -61.3 | -46.8 | 176.9 | 172.8 | 0 | 0 | 0 | 0 | 110.7 | L6 I7 L12 V13 L14 V40 I44 | L6-V10 WeakPolarHBondContact O-CG2 3.26Å; L6-V10 PolarHBondContact O-N 3.23Å; I7-V10 PolarHBondContact O-N 3.25Å; V10-L12 PolarHBondContact O-N 3.28Å; V10-V13 PolarHBondContact O-N 3.03Å; V10-L14 HydrophobicContact CG1-CD1 3.85Å; V10-L14 HydrophobicContact CG1-CG 4.37Å; V10-L14 WeakPolarHBondContact O-CB 2.86Å; V10-L14 VanDerWaalsContact O-CG 3.22Å; V10-L14 WeakPolarHBondContact O-CG 3.49Å; V10-L14 PolarHBondContact O-N 3.23Å; V10-V40 HydrophobicContact CG1-CG1 4.1Å; V10-I44 HydrophobicContact CG1-CD1 4.12Å |
| 11 | L | 79.1 | Confident | 70.4 | Confident | 82 Ų | 82 | 98.5 Ų | 98.5 | 43% | 0.429 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -61.1 | -42.8 | 176.4 | -71.6 | 174.2 | 0 | 0 | 0 | 112.1 | I7 T8 V13 L14 F15 | I7-L11 HydrophobicContact CG2-CD1 4.04Å; I7-L11 HydrophobicContact CG2-CG 4.43Å; I7-L11 WeakPolarHBondContact O-CB 3.4Å; I7-L11 WeakPolarHBondContact O-CG 3.05Å; I7-L11 PolarHBondContact O-N 2.87Å; T8-L11 PolarHBondContact O-N 3.1Å; L11-V13 PolarHBondContact O-N 3.41Å; L11-L14 HydrophobicContact CD2-CD1 4.46Å; L11-L14 PolarHBondContact O-N 3.43Å; L11-F15 WeakPolarHBondContact O-CB 3.5Å; L11-F15 WeakPolarHBondContact O-CD2 3.2Å; L11-F15 PolarHBondContact O-N 2.86Å |
| 12 | L | 77.9 | Confident | 69.9 | Low | 116 Ų | 116 | 98.1 Ų | 98.1 | 61% | 0.607 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -60.6 | -44.9 | 176.2 | -83.7 | 165.4 | 0 | 0 | 0 | 111.9 | T8 V9 V10 L14 F15 E16 | T8-L12 HydrophobicContact CG2-CD1 4.1Å; T8-L12 WeakPolarHBondContact O-CB 3.48Å; T8-L12 WeakPolarHBondContact O-CG 3.47Å; T8-L12 PolarHBondContact O-N 3.3Å; V9-L12 PolarHBondContact O-N 3.4Å; V10-L12 PolarHBondContact O-N 3.28Å; L12-L14 VanDerWaalsContact C-N 3.32Å; L12-L14 PolarHBondContact O-N 2.88Å; L12-F15 PolarHBondContact O-N 3.44Å; L12-E16 WeakPolarHBondContact O-CB 3.38Å; L12-E16 PolarHBondContact O-N 3.29Å |
| 13 | V | 77.3 | Confident | 69.1 | Low | 83 Ų | 83 | 95.4 Ų | 95.4 | 50% | 0.503 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -63.5 | -39.7 | 177.1 | 172.7 | 0 | 0 | 0 | 0 | 110.9 | V9 V10 L11 S17 | V9-V13 HydrophobicContact CG1-CG2 4.45Å; V9-V13 VanDerWaalsContact O-CG2 3.3Å; V9-V13 WeakPolarHBondContact O-CG2 3.4Å; V9-V13 PolarHBondContact O-N 3.28Å; V10-V13 PolarHBondContact O-N 3.03Å; L11-V13 PolarHBondContact O-N 3.41Å; V13-S17 VanDerWaalsContact O-CB 3.25Å; V13-S17 WeakPolarHBondContact O-CB 3.36Å; V13-S17 PolarHBondContact O-N 3.17Å; V13-S17 PolarHBondContact O-OG 2.93Å |
| 14 | L | 73.5 | Confident | 67.9 | Low | 34 Ų | 34 | 90.5 Ų | 90.5 | 18% | 0.178 | 48% | 0.483 | C | S | . | . | H | α-helix | trans | -65 | -47.1 | 176 | -69.8 | 167.1 | 0 | 0 | 0 | 111.9 | V10 L11 L12 S17 H18 L37 V40 | V10-L14 HydrophobicContact CG1-CD1 3.85Å; V10-L14 HydrophobicContact CG1-CG 4.37Å; V10-L14 WeakPolarHBondContact O-CB 2.86Å; V10-L14 VanDerWaalsContact O-CG 3.22Å; V10-L14 WeakPolarHBondContact O-CG 3.49Å; V10-L14 PolarHBondContact O-N 3.23Å; L11-L14 HydrophobicContact CD2-CD1 4.46Å; L11-L14 PolarHBondContact O-N 3.43Å; L12-L14 VanDerWaalsContact C-N 3.32Å; L12-L14 PolarHBondContact O-N 2.88Å; L14-S17 PolarHBondContact O-N 2.67Å; L14-H18 WeakPolarHBondContact O-CB 3.34Å; L14-H18 PolarHBondContact O-N 3.2Å; L14-H18 PolarHBondContact O-ND1 2.91Å; L14-L37 HydrophobicContact CD2-CD1 3.46Å; L14-L37 VanDerWaalsContact CD2-CD1 3.46Å; L14-L37 HydrophobicContact CD2-CG 4.36Å; L14-V40 HydrophobicContact CD1-CG1 3.92Å; L14-V40 HydrophobicContact CD2-CB 4.26Å; L14-V40 HydrophobicContact CD2-CG1 4.01Å; L14-V40 HydrophobicContact CD2-CG2 4.23Å; L14-V40 HydrophobicContact CG-CG1 4.43Å |
| 15 | F | 68.8 | Low | 66.9 | Low | 141 Ų | 141 | 91.5 Ų | 91.5 | 62% | 0.618 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -62.1 | -44.4 | 177.6 | -95.8 | -82.6 | 0 | 0 | 0 | 112.1 | L11 L12 S17 H18 I19 | L11-F15 WeakPolarHBondContact O-CB 3.5Å; L11-F15 WeakPolarHBondContact O-CD2 3.2Å; L11-F15 PolarHBondContact O-N 2.86Å; L12-F15 PolarHBondContact O-N 3.44Å; F15-S17 VanDerWaalsContact C-N 3.33Å; F15-H18 WeakPolarHBondContact O-CB 3.5Å; F15-H18 PolarHBondContact O-N 3.32Å; F15-I19 PolarHBondContact O-N 3.28Å |
| 16 | E | 63.7 | Low | 66 | Low | 114 Ų | 114 | 89.3 Ų | 89.3 | 53% | 0.533 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -67.6 | -36.8 | 178.3 | -147.8 | -151.4 | 168.8 | 0 | 0 | 111.5 | L12 R20 | L12-E16 WeakPolarHBondContact O-CB 3.38Å; L12-E16 PolarHBondContact O-N 3.29Å; E16-R20 PolarHBondContact O-N 2.79Å; E16-R20 IonicContact OE1-CZ 3.72Å; E16-R20 IonicContact OE1-NH2 2.69Å; E16-R20 PolarHBondContact OE1-NH2 3.45Å; E16-R20 IonicContact OE2-NH2 3.37Å; E16-R20 PolarHBondContact OE2-NH2 2.92Å |
| 17 | S | 60.6 | Low | 65.2 | Low | 55 Ų | 55 | 90.1 Ų | 90.1 | 39% | 0.385 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -63.5 | -42.4 | 173.1 | -60.6 | 0 | 0 | 0 | 0 | 111.2 | V13 L14 F15 R20 V21 | V13-S17 VanDerWaalsContact O-CB 3.25Å; V13-S17 WeakPolarHBondContact O-CB 3.36Å; V13-S17 PolarHBondContact O-N 3.17Å; V13-S17 PolarHBondContact O-OG 2.93Å; L14-S17 PolarHBondContact O-N 2.67Å; F15-S17 VanDerWaalsContact C-N 3.33Å; S17-R20 PolarHBondContact O-N 2.92Å; S17-V21 WeakPolarHBondContact O-CB 3.32Å; S17-V21 WeakPolarHBondContact O-CG2 3.5Å; S17-V21 PolarHBondContact O-N 3.31Å; S17-V21 VanDerWaalsContact O-N 3.08Å |
| 18 | H | 54.9 | Low | 64.6 | Low | 73 Ų | 73 | 92.4 Ų | 92.4 | 34% | 0.338 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -61.5 | -44.8 | 177.5 | -86.1 | 28.8 | 0 | 0 | 0 | 113.3 | L14 F15 R20 V21 F22 L37 | L14-H18 WeakPolarHBondContact O-CB 3.34Å; L14-H18 PolarHBondContact O-N 3.2Å; L14-H18 PolarHBondContact O-ND1 2.91Å; F15-H18 WeakPolarHBondContact O-CB 3.5Å; F15-H18 PolarHBondContact O-N 3.32Å; H18-R20 VanDerWaalsContact C-N 3.28Å; H18-R20 PolarHBondContact O-N 3.49Å; H18-V21 PolarHBondContact O-N 2.91Å; H18-F22 WeakPolarHBondContact O-CB 3.28Å; H18-F22 PolarHBondContact O-N 3.45Å; H18-L37 WeakPolarHBondContact CE1-CD1 3.43Å; H18-L37 WeakPolarHBondContact CE1-CD2 3.41Å; H18-L37 VanDerWaalsContact NE2-CD2 3.28Å; H18-L37 WeakPolarHBondContact NE2-CD2 3.42Å |
| 19 | I | 57.7 | Low | 64 | Low | 125 Ų | 125 | 92.7 Ų | 92.7 | 64% | 0.641 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -60.5 | -41.3 | 177.5 | -74.1 | 168.3 | 0 | 0 | 0 | 110.8 | F15 V21 | F15-I19 PolarHBondContact O-N 3.28Å; I19-V21 VanDerWaalsContact C-N 3.32Å; I19-V21 PolarHBondContact O-N 2.95Å |
| 20 | R | 53.4 | Low | 63.5 | Low | 168 Ų | 168 | 91.2 Ų | 91.2 | 63% | 0.634 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -69.7 | -31.1 | -179 | -130.8 | -176.7 | -64.9 | -92.6 | 2.4 | 112.8 | E16 S17 H18 | E16-R20 PolarHBondContact O-N 2.79Å; E16-R20 IonicContact OE1-CZ 3.72Å; E16-R20 IonicContact OE1-NH2 2.69Å; E16-R20 PolarHBondContact OE1-NH2 3.45Å; E16-R20 IonicContact OE2-NH2 3.37Å; E16-R20 PolarHBondContact OE2-NH2 2.92Å; S17-R20 PolarHBondContact O-N 2.92Å; H18-R20 VanDerWaalsContact C-N 3.28Å; H18-R20 PolarHBondContact O-N 3.49Å |
| 21 | V | 52.6 | Low | 63.1 | Low | 35 Ų | 35 | 94.1 Ų | 94.1 | 21% | 0.212 | 51% | 0.511 | C | S | . | . | H | α-helix | trans | -82.1 | -41.6 | -177.3 | 167.2 | 0 | 0 | 0 | 0 | 111.1 | S17 H18 I19 A23 G24 I29 V33 | S17-V21 WeakPolarHBondContact O-CB 3.32Å; S17-V21 WeakPolarHBondContact O-CG2 3.5Å; S17-V21 PolarHBondContact O-N 3.31Å; S17-V21 VanDerWaalsContact O-N 3.08Å; H18-V21 PolarHBondContact O-N 2.91Å; I19-V21 VanDerWaalsContact C-N 3.32Å; I19-V21 PolarHBondContact O-N 2.95Å; V21-A23 PolarHBondContact O-N 3.3Å; V21-G24 PolarHBondContact O-N 3.45Å; V21-I29 HydrophobicContact CB-CG2 4.34Å; V21-I29 HydrophobicContact CG1-CG2 3.55Å; V21-V33 HydrophobicContact CB-CG1 4.42Å; V21-V33 HydrophobicContact CB-CG2 4Å; V21-V33 HydrophobicContact CG1-CB 3.65Å; V21-V33 HydrophobicContact CG1-CG1 3.88Å; V21-V33 HydrophobicContact CG1-CG2 3.35Å; V21-V33 HydrophobicContact CG2-CB 4.47Å; V21-V33 HydrophobicContact CG2-CG1 4.4Å; V21-V33 HydrophobicContact CG2-CG2 3.51Å |
| 22 | F | 50.6 | Low | 62.8 | Low | 189 Ų | 189 | 96.5 Ų | 96.5 | 83% | 0.829 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -67.8 | -22.1 | -179.2 | -167 | -101.8 | 0 | 0 | 0 | 113.1 | H18 G24 | H18-F22 WeakPolarHBondContact O-CB 3.28Å; H18-F22 PolarHBondContact O-N 3.45Å; F22-G24 PolarHBondContact O-N 3.24Å |
| 23 | A | 54.5 | Low | 62.5 | Low | 89 Ų | 89 | 92.5 Ų | 92.5 | 74% | 0.736 | 50% | 0.499 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -72.6 | -4.8 | 175.1 | 0 | 0 | 0 | 0 | 0 | 114.2 | V21 | V21-A23 PolarHBondContact O-N 3.3Š|
| 24 | G | 48.8 | Very low | 62.4 | Low | 31 Ų | 31 | 94.4 Ų | 94.4 | 32% | 0.32 | 51% | 0.505 | S | S | . | . | S | Bend | trans | -102.9 | 127.4 | 178.2 | 0 | 0 | 0 | 0 | 0 | 113.1 | V21 F22 S26 | V21-G24 PolarHBondContact O-N 3.45Å; F22-G24 PolarHBondContact O-N 3.24Å; G24-S26 VanDerWaalsContact C-N 3.31Å; G24-S26 PolarHBondContact O-N 3.47Å |
| 25 | P | 55.5 | Low | 62.5 | Low | 139 Ų | 139 | 95.3 Ų | 95.3 | 90% | 0.903 | 52% | 0.518 | S | S | * | . | trans | -76.9 | 80.8 | 173.3 | 32 | -33.1 | 0 | 0 | 0 | 109.9 | ||||
| 26 | S | 57.2 | Low | 62.8 | Low | 41 Ų | 41 | 90.1 Ų | 90.1 | 29% | 0.287 | 50% | 0.504 | S | S | . | . | trans | -159.5 | 110 | 171.2 | 50.9 | 0 | 0 | 0 | 0 | 109.8 | G24 E28 I29 A30 | G24-S26 VanDerWaalsContact C-N 3.31Å; G24-S26 PolarHBondContact O-N 3.47Å; S26-E28 PolarHBondContact O-N 2.9Å; S26-E28 VanDerWaalsContact O-N 3.15Å; S26-I29 PolarHBondContact O-N 2.97Å; S26-I29 VanDerWaalsContact OG-CB 3.28Å; S26-I29 WeakPolarHBondContact OG-CB 3.22Å; S26-I29 WeakPolarHBondContact OG-CD1 3.37Å; S26-I29 WeakPolarHBondContact OG-CG1 3.49Å; S26-A30 PolarHBondContact O-N 2.97Å | ||
| 27 | T | 63.5 | Low | 63.3 | Low | 116 Ų | 116 | 86.9 Ų | 86.9 | 71% | 0.712 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -49.6 | -33.8 | 169.7 | 49.4 | 0 | 0 | 0 | 0 | 111.9 | I29 A30 D31 | T27-I29 PolarHBondContact O-N 3.22Å; T27-A30 WeakPolarHBondContact O-CB 3.32Å; T27-A30 PolarHBondContact O-N 3.25Å; T27-A30 VanDerWaalsContact O-N 3.17Å; T27-D31 VanDerWaalsContact O-CG 3.32Å; T27-D31 PolarHBondContact O-N 2.93Å |
| 28 | E | 67.2 | Low | 64.1 | Low | 119 Ų | 119 | 89 Ų | 89 | 56% | 0.556 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -62.7 | -38.2 | 177.1 | -165.5 | -169.1 | 158.4 | 0 | 0 | 113.3 | S26 K32 | S26-E28 PolarHBondContact O-N 2.9Å; S26-E28 VanDerWaalsContact O-N 3.15Å; E28-K32 WeakPolarHBondContact O-CG 3.4Å; E28-K32 PolarHBondContact O-N 2.98Å; E28-K32 VanDerWaalsContact O-N 3.17Å; E28-K32 IonicContact OE1-NZ 2.76Å; E28-K32 PolarHBondContact OE1-NZ 2.9Å |
| 29 | I | 67.1 | Low | 65.3 | Low | 75 Ų | 75 | 90.9 Ų | 90.9 | 39% | 0.385 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -71.9 | -38.7 | 175.8 | -69.2 | 179.4 | 0 | 0 | 0 | 109.7 | V21 S26 T27 D31 K32 V33 | V21-I29 HydrophobicContact CB-CG2 4.34Å; V21-I29 HydrophobicContact CG1-CG2 3.55Å; S26-I29 PolarHBondContact O-N 2.97Å; S26-I29 VanDerWaalsContact OG-CB 3.28Å; S26-I29 WeakPolarHBondContact OG-CB 3.22Å; S26-I29 WeakPolarHBondContact OG-CD1 3.37Å; S26-I29 WeakPolarHBondContact OG-CG1 3.49Å; T27-I29 PolarHBondContact O-N 3.22Å; I29-D31 PolarHBondContact O-N 3.47Å; I29-K32 PolarHBondContact O-N 2.94Å; I29-V33 WeakPolarHBondContact O-CB 3.3Å; I29-V33 WeakPolarHBondContact O-CG2 3.32Å; I29-V33 PolarHBondContact O-N 3.18Å |
| 30 | A | 68.3 | Low | 66.2 | Low | 43 Ų | 43 | 87 Ų | 87 | 36% | 0.355 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -60.7 | -45 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111.6 | S26 T27 K32 V33 L34 | S26-A30 PolarHBondContact O-N 2.97Å; T27-A30 WeakPolarHBondContact O-CB 3.32Å; T27-A30 PolarHBondContact O-N 3.25Å; T27-A30 VanDerWaalsContact O-N 3.17Å; A30-K32 PolarHBondContact O-N 2.87Å; A30-V33 PolarHBondContact O-N 3.13Å; A30-L34 WeakPolarHBondContact O-CD1 3.49Å; A30-L34 PolarHBondContact O-N 3.08Å |
| 31 | D | 72.9 | Confident | 67.3 | Low | 108 Ų | 108 | 83.6 Ų | 83.6 | 58% | 0.578 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -62 | -44.1 | 177.9 | -68.6 | -23.6 | 0 | 0 | 0 | 111.6 | T27 I29 V33 L34 A35 | T27-D31 VanDerWaalsContact O-CG 3.32Å; T27-D31 PolarHBondContact O-N 2.93Å; I29-D31 PolarHBondContact O-N 3.47Å; D31-V33 VanDerWaalsContact C-N 3.26Å; D31-V33 PolarHBondContact O-N 2.7Å; D31-L34 PolarHBondContact O-N 3.44Å; D31-A35 WeakPolarHBondContact O-CB 3.02Å; D31-A35 PolarHBondContact O-N 3.27Å |
| 32 | K | 72.3 | Confident | 68.4 | Low | 132 Ų | 132 | 86 Ų | 86 | 57% | 0.574 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -63.7 | -33.6 | 176.3 | -75.1 | 178 | -179 | 159.8 | 0 | 112.4 | E28 I29 A30 G36 | E28-K32 WeakPolarHBondContact O-CG 3.4Å; E28-K32 PolarHBondContact O-N 2.98Å; E28-K32 VanDerWaalsContact O-N 3.17Å; E28-K32 IonicContact OE1-NZ 2.76Å; E28-K32 PolarHBondContact OE1-NZ 2.9Å; I29-K32 PolarHBondContact O-N 2.94Å; A30-K32 PolarHBondContact O-N 2.87Å; K32-G36 PolarHBondContact O-N 2.62Å |
| 33 | V | 71.6 | Confident | 69.5 | Low | 33 Ų | 33 | 79.8 Ų | 79.8 | 20% | 0.2 | 48% | 0.48 | C | S | . | . | H | α-helix | trans | -79.1 | -34.4 | 178.2 | 170.6 | 0 | 0 | 0 | 0 | 112.6 | V21 I29 A30 D31 A35 G36 L37 | V21-V33 HydrophobicContact CB-CG1 4.42Å; V21-V33 HydrophobicContact CB-CG2 4Å; V21-V33 HydrophobicContact CG1-CB 3.65Å; V21-V33 HydrophobicContact CG1-CG1 3.88Å; V21-V33 HydrophobicContact CG1-CG2 3.35Å; V21-V33 HydrophobicContact CG2-CB 4.47Å; V21-V33 HydrophobicContact CG2-CG1 4.4Å; V21-V33 HydrophobicContact CG2-CG2 3.51Å; I29-V33 WeakPolarHBondContact O-CB 3.3Å; I29-V33 WeakPolarHBondContact O-CG2 3.32Å; I29-V33 PolarHBondContact O-N 3.18Å; A30-V33 PolarHBondContact O-N 3.13Å; D31-V33 VanDerWaalsContact C-N 3.26Å; D31-V33 PolarHBondContact O-N 2.7Å; V33-A35 VanDerWaalsContact C-N 3.34Å; V33-G36 PolarHBondContact O-N 3.47Å; V33-L37 WeakPolarHBondContact O-CB 3.25Å; V33-L37 PolarHBondContact O-N 3.49Å |
| 34 | L | 74.8 | Confident | 70.4 | Confident | 122 Ų | 122 | 78.3 Ų | 78.3 | 64% | 0.639 | 46% | 0.459 | S | S | * | . | H | α-helix | trans | -59.4 | -47.9 | 167.9 | -102 | 82.5 | 0 | 0 | 0 | 110.7 | A30 D31 G36 L37 D38 | A30-L34 WeakPolarHBondContact O-CD1 3.49Å; A30-L34 PolarHBondContact O-N 3.08Å; D31-L34 PolarHBondContact O-N 3.44Å; L34-G36 PolarHBondContact O-N 2.94Å; L34-L37 WeakPolarHBondContact O-CB 3.44Å; L34-L37 PolarHBondContact O-N 2.9Å; L34-L37 VanDerWaalsContact O-N 3.08Å; L34-D38 PolarHBondContact O-N 2.9Å |
| 35 | A | 76.2 | Confident | 71.4 | Confident | 54 Ų | 54 | 79.4 Ų | 79.4 | 45% | 0.446 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -59.6 | -46.8 | 177.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | D31 V33 L37 D38 D39 | D31-A35 WeakPolarHBondContact O-CB 3.02Å; D31-A35 PolarHBondContact O-N 3.27Å; V33-A35 VanDerWaalsContact C-N 3.34Å; A35-L37 PolarHBondContact O-N 3.39Å; A35-D38 WeakPolarHBondContact O-CB 3.33Å; A35-D38 PolarHBondContact O-N 2.76Å; A35-D39 PolarHBondContact O-N 3.26Å |
| 36 | G | 75.1 | Confident | 72.2 | Confident | 32 Ų | 32 | 80.2 Ų | 80.2 | 33% | 0.33 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -64.3 | -24 | 175.9 | 0 | 0 | 0 | 0 | 0 | 113.8 | K32 V33 L34 V40 | K32-G36 PolarHBondContact O-N 2.62Å; V33-G36 PolarHBondContact O-N 3.47Å; L34-G36 PolarHBondContact O-N 2.94Å; G36-V40 WeakPolarHBondContact O-CG2 3.42Å; G36-V40 PolarHBondContact O-N 2.85Å |
| 37 | L | 75.1 | Confident | 72.6 | Confident | 46 Ų | 46 | 81.2 Ų | 81.2 | 24% | 0.241 | 46% | 0.459 | C | S | . | . | H | α-helix | trans | -77.3 | -40.5 | 173.6 | -125.6 | 66.2 | 0 | 0 | 0 | 112.8 | L14 H18 V33 L34 A35 D39 V40 I41 | L14-L37 HydrophobicContact CD2-CD1 3.46Å; L14-L37 VanDerWaalsContact CD2-CD1 3.46Å; L14-L37 HydrophobicContact CD2-CG 4.36Å; H18-L37 WeakPolarHBondContact CE1-CD1 3.43Å; H18-L37 WeakPolarHBondContact CE1-CD2 3.41Å; H18-L37 VanDerWaalsContact NE2-CD2 3.28Å; H18-L37 WeakPolarHBondContact NE2-CD2 3.42Å; V33-L37 WeakPolarHBondContact O-CB 3.25Å; V33-L37 PolarHBondContact O-N 3.49Å; L34-L37 WeakPolarHBondContact O-CB 3.44Å; L34-L37 PolarHBondContact O-N 2.9Å; L34-L37 VanDerWaalsContact O-N 3.08Å; A35-L37 PolarHBondContact O-N 3.39Å; L37-D39 VanDerWaalsContact C-N 3.25Å; L37-D39 PolarHBondContact O-N 2.86Å; L37-V40 PolarHBondContact O-N 3.17Å; L37-V40 VanDerWaalsContact O-N 3.1Å; L37-I41 VanDerWaalsContact O-CG1 3.32Å; L37-I41 WeakPolarHBondContact O-CG1 3.34Å; L37-I41 PolarHBondContact O-N 2.96Å |
| 38 | D | 77.7 | Confident | 72.2 | Confident | 98 Ų | 98 | 81.8 Ų | 81.8 | 52% | 0.524 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -57.6 | -44.9 | 176.5 | -151.4 | 38 | 0 | 0 | 0 | 109.8 | L34 A35 V40 I41 D42 | L34-D38 PolarHBondContact O-N 2.9Å; A35-D38 WeakPolarHBondContact O-CB 3.33Å; A35-D38 PolarHBondContact O-N 2.76Å; D38-V40 VanDerWaalsContact C-N 3.31Å; D38-V40 PolarHBondContact O-N 3.38Å; D38-I41 PolarHBondContact O-N 3.48Å; D38-D42 WeakPolarHBondContact O-CB 3.45Å; D38-D42 PolarHBondContact O-N 3.37Å |
| 39 | D | 79.7 | Confident | 71.9 | Confident | 113 Ų | 113 | 78.5 Ų | 78.5 | 60% | 0.604 | 46% | 0.462 | S | S | * | . | H | α-helix | trans | -58 | -40.1 | 174.4 | -71.5 | -24.6 | 0 | 0 | 0 | 112.9 | A35 L37 A43 | A35-D39 PolarHBondContact O-N 3.26Å; L37-D39 VanDerWaalsContact C-N 3.25Å; L37-D39 PolarHBondContact O-N 2.86Å; D39-A43 WeakPolarHBondContact O-CB 3.36Å; D39-A43 PolarHBondContact O-N 3.5Å |
| 40 | V | 76.4 | Confident | 71.3 | Confident | 44 Ų | 44 | 77.7 Ų | 77.7 | 27% | 0.267 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -73.8 | -38.5 | 179.5 | 175.4 | 0 | 0 | 0 | 0 | 111.2 | V10 L14 G36 L37 D38 D42 A43 I44 | V10-V40 HydrophobicContact CG1-CG1 4.1Å; L14-V40 HydrophobicContact CD1-CG1 3.92Å; L14-V40 HydrophobicContact CD2-CB 4.26Å; L14-V40 HydrophobicContact CD2-CG1 4.01Å; L14-V40 HydrophobicContact CD2-CG2 4.23Å; L14-V40 HydrophobicContact CG-CG1 4.43Å; G36-V40 WeakPolarHBondContact O-CG2 3.42Å; G36-V40 PolarHBondContact O-N 2.85Å; L37-V40 PolarHBondContact O-N 3.17Å; L37-V40 VanDerWaalsContact O-N 3.1Å; D38-V40 VanDerWaalsContact C-N 3.31Å; D38-V40 PolarHBondContact O-N 3.38Å; V40-D42 VanDerWaalsContact C-N 3.32Å; V40-A43 PolarHBondContact O-N 2.88Å; V40-I44 HydrophobicContact CG1-CD1 3.83Å; V40-I44 HydrophobicContact CG1-CG1 4.35Å; V40-I44 WeakPolarHBondContact O-CB 3.19Å; V40-I44 WeakPolarHBondContact O-CG1 3.44Å; V40-I44 PolarHBondContact O-N 3.17Å |
| 41 | I | 75.8 | Confident | 70.5 | Confident | 97 Ų | 97 | 80.2 Ų | 80.2 | 50% | 0.497 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -62.2 | -43.6 | 174.9 | -69.7 | 165.3 | 0 | 0 | 0 | 109.8 | L37 D38 I44 A45 | L37-I41 VanDerWaalsContact O-CG1 3.32Å; L37-I41 WeakPolarHBondContact O-CG1 3.34Å; L37-I41 PolarHBondContact O-N 2.96Å; D38-I41 PolarHBondContact O-N 3.48Å; I41-I44 PolarHBondContact O-N 2.83Å; I41-A45 WeakPolarHBondContact O-CB 3.34Å; I41-A45 PolarHBondContact O-N 2.93Å |
| 42 | D | 76 | Confident | 69.4 | Low | 86 Ų | 86 | 83.5 Ų | 83.5 | 46% | 0.46 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -63.5 | -44 | 175.2 | -86.8 | -10.5 | 0 | 0 | 0 | 112.1 | D38 V40 I44 A45 Q46 | D38-D42 WeakPolarHBondContact O-CB 3.45Å; D38-D42 PolarHBondContact O-N 3.37Å; V40-D42 VanDerWaalsContact C-N 3.32Å; D42-I44 VanDerWaalsContact C-N 3.29Å; D42-I44 PolarHBondContact O-N 3.04Å; D42-A45 WeakPolarHBondContact O-CB 3.41Å; D42-A45 PolarHBondContact O-N 3.35Å; D42-Q46 WeakPolarHBondContact O-CG 3.08Å; D42-Q46 PolarHBondContact O-N 3.15Å |
| 43 | A | 74.6 | Confident | 68.1 | Low | 57 Ų | 57 | 79.8 Ų | 79.8 | 47% | 0.471 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -61.9 | -38.9 | 175.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | D39 V40 Q46 | D39-A43 WeakPolarHBondContact O-CB 3.36Å; D39-A43 PolarHBondContact O-N 3.5Å; V40-A43 PolarHBondContact O-N 2.88Å; A43-Q46 PolarHBondContact O-N 3.37Å |
| 44 | I | 71.7 | Confident | 66.8 | Low | 58 Ų | 58 | 81.6 Ų | 81.6 | 30% | 0.297 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -64.4 | -50.1 | 173.9 | -73.3 | 169.4 | 0 | 0 | 0 | 109.1 | V10 V40 I41 D42 Q46 I47 I50 | V10-I44 HydrophobicContact CG1-CD1 4.12Å; V40-I44 HydrophobicContact CG1-CD1 3.83Å; V40-I44 HydrophobicContact CG1-CG1 4.35Å; V40-I44 WeakPolarHBondContact O-CB 3.19Å; V40-I44 WeakPolarHBondContact O-CG1 3.44Å; V40-I44 PolarHBondContact O-N 3.17Å; I41-I44 PolarHBondContact O-N 2.83Å; D42-I44 VanDerWaalsContact C-N 3.29Å; D42-I44 PolarHBondContact O-N 3.04Å; I44-Q46 PolarHBondContact O-N 2.69Å; I44-Q46 VanDerWaalsContact O-N 3.13Å; I44-I47 VanDerWaalsContact O-CB 3.27Å; I44-I47 WeakPolarHBondContact O-CB 3.11Å; I44-I47 WeakPolarHBondContact O-CG1 3.02Å; I44-I47 PolarHBondContact O-N 3.32Å; I44-I50 HydrophobicContact CB-CD1 4.36Å; I44-I50 HydrophobicContact CG2-CD1 3.29Å; I44-I50 WeakPolarHBondContact O-CD1 3.28Å; I44-I50 WeakPolarHBondContact O-CG1 3.47Å |
| 45 | A | 70.8 | Confident | 65.5 | Low | 55 Ų | 55 | 80.7 Ų | 80.7 | 46% | 0.455 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -55.2 | -31 | 178.7 | 0 | 0 | 0 | 0 | 0 | 113.5 | I41 D42 I47 | I41-A45 WeakPolarHBondContact O-CB 3.34Å; I41-A45 PolarHBondContact O-N 2.93Å; D42-A45 WeakPolarHBondContact O-CB 3.41Å; D42-A45 PolarHBondContact O-N 3.35Å; A45-I47 VanDerWaalsContact C-N 3.3Å; A45-I47 PolarHBondContact O-N 3.26Å |
| 46 | Q | 71.6 | Confident | 64.1 | Low | 155 Ų | 155 | 86.2 Ų | 86.2 | 72% | 0.724 | 53% | 0.53 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -73.5 | -14.5 | 174.9 | -72.2 | -178.7 | 42.2 | 0 | 0 | 114.4 | D42 A43 I44 P48 | D42-Q46 WeakPolarHBondContact O-CG 3.08Å; D42-Q46 PolarHBondContact O-N 3.15Å; A43-Q46 PolarHBondContact O-N 3.37Å; I44-Q46 PolarHBondContact O-N 2.69Å; I44-Q46 VanDerWaalsContact O-N 3.13Å; Q46-P48 WeakPolarHBondContact O-CD 3.4Å; Q46-P48 VanDerWaalsContact O-N 3.14Å |
| 47 | I | 66.5 | Low | 62.7 | Low | 62 Ų | 62 | 93.5 Ų | 93.5 | 32% | 0.318 | 56% | 0.558 | S | S | . | * | S | Bend | trans | -68 | 109.9 | 177 | -59.8 | 172.8 | 0 | 0 | 0 | 108.6 | I44 A45 G49 I50 | I44-I47 VanDerWaalsContact O-CB 3.27Å; I44-I47 WeakPolarHBondContact O-CB 3.11Å; I44-I47 WeakPolarHBondContact O-CG1 3.02Å; I44-I47 PolarHBondContact O-N 3.32Å; A45-I47 VanDerWaalsContact C-N 3.3Å; A45-I47 PolarHBondContact O-N 3.26Å; I47-G49 PolarHBondContact O-N 3.08Å; I47-I50 HydrophobicContact CB-CG1 4.21Å; I47-I50 HydrophobicContact CB-CG2 4.44Å; I47-I50 HydrophobicContact CG2-CG2 4.28Å; I47-I50 VanDerWaalsContact O-CG1 3.26Å; I47-I50 WeakPolarHBondContact O-CG1 3.49Å; I47-I50 PolarHBondContact O-N 3.47Å |
| 48 | P | 55.1 | Low | 61.3 | Low | 129 Ų | 129 | 96.4 Ų | 96.4 | 84% | 0.838 | 57% | 0.574 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67.2 | 115.8 | 179.7 | -14.4 | 30.9 | 0 | 0 | 0 | 108.7 | Q46 | Q46-P48 WeakPolarHBondContact O-CD 3.4Å; Q46-P48 VanDerWaalsContact O-N 3.14Å |
| 49 | G | 59.9 | Low | 59.9 | Low | 49 Ų | 49 | 98.6 Ų | 98.6 | 51% | 0.505 | 59% | 0.585 | S | S | . | * | T | Hydrogen-bonded Turn | trans | 125.8 | -19 | 179.8 | 0 | 0 | 0 | 0 | 0 | 114.8 | I47 | I47-G49 PolarHBondContact O-N 3.08Š|
| 50 | I | 55.2 | Low | 58.3 | Low | 58 Ų | 58 | 97.1 Ų | 97.1 | 30% | 0.297 | 58% | 0.584 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -82.3 | -29.9 | 171.8 | 61.7 | 151.3 | 0 | 0 | 0 | 112.8 | I44 I47 Q52 G53 | I44-I50 HydrophobicContact CB-CD1 4.36Å; I44-I50 HydrophobicContact CG2-CD1 3.29Å; I44-I50 WeakPolarHBondContact O-CD1 3.28Å; I44-I50 WeakPolarHBondContact O-CG1 3.47Å; I47-I50 HydrophobicContact CB-CG1 4.21Å; I47-I50 HydrophobicContact CB-CG2 4.44Å; I47-I50 HydrophobicContact CG2-CG2 4.28Å; I47-I50 VanDerWaalsContact O-CG1 3.26Å; I47-I50 WeakPolarHBondContact O-CG1 3.49Å; I47-I50 PolarHBondContact O-N 3.47Å; I50-Q52 PolarHBondContact O-N 3.26Å; I50-G53 WeakPolarHBondContact O-CA 3.37Å; I50-G53 PolarHBondContact O-N 3.29Å |
| 51 | S | 52.3 | Low | 57.3 | Low | 96 Ų | 96 | 99.8 Ų | 99.8 | 67% | 0.671 | 60% | 0.6 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67 | -17.2 | 176 | -39 | 0 | 0 | 0 | 0 | 112.4 | ||
| 52 | Q | 48.3 | Very low | 55.8 | Low | 178 Ų | 178 | 99.8 Ų | 99.8 | 83% | 0.832 | 61% | 0.608 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -99.1 | -2.7 | 173.2 | -59.5 | -169.7 | 32.7 | 0 | 0 | 112.6 | I50 G54 | I50-Q52 PolarHBondContact O-N 3.26Å; Q52-G54 PolarHBondContact O-N 3.39Å |
| 53 | G | 45.7 | Very low | 55.1 | Low | 53 Ų | 53 | 102.6 Ų | 102.6 | 55% | 0.546 | 62% | 0.622 | S | S | . | * | trans | -82.8 | 6.1 | 174.6 | 0 | 0 | 0 | 0 | 0 | 113.9 | I50 S55 | I50-G53 WeakPolarHBondContact O-CA 3.37Å; I50-G53 PolarHBondContact O-N 3.29Å; G53-S55 PolarHBondContact O-N 3.07Å | ||
| 54 | G | 43.9 | Very low | 53.5 | Low | 72 Ų | 72 | 108.2 Ų | 108.2 | 74% | 0.742 | 64% | 0.638 | S | S | * | * | trans | -64.3 | 34.8 | 157.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | Q52 Q56 | Q52-G54 PolarHBondContact O-N 3.39Å; G54-Q56 PolarHBondContact O-N 2.91Å | ||
| 55 | S | 47.4 | Very low | 52.2 | Low | 102 Ų | 102 | 115.2 Ų | 115.2 | 71% | 0.713 | 68% | 0.684 | S | S | * | * | trans | -56.1 | 83.2 | 158.8 | 172.7 | 0 | 0 | 0 | 0 | 106.3 | G53 M57 | G53-S55 PolarHBondContact O-N 3.07Å; S55-M57 VanDerWaalsContact C-N 3.35Å; S55-M57 PolarHBondContact O-N 3.29Å | ||
| 56 | Q | 46.9 | Very low | 51.2 | Low | 170 Ų | 170 | 118.2 Ų | 118.2 | 79% | 0.794 | 70% | 0.696 | S | S | * | * | trans | 24.8 | 77.8 | 144.3 | -153.8 | 174.5 | -14.7 | 0 | 0 | 109.4 | G54 N58 | G54-Q56 PolarHBondContact O-N 2.91Å; Q56-N58 PolarHBondContact O-N 3.23Å | ||
| 57 | M | 46.3 | Very low | 50.2 | Low | 185 Ų | 185 | 116.3 Ų | 116.3 | 91% | 0.911 | 69% | 0.694 | S | S | * | * | trans | -62.5 | 87 | 161.9 | -162.2 | 175 | -153.9 | 0 | 0 | 103 | S55 N59 | S55-M57 VanDerWaalsContact C-N 3.35Å; S55-M57 PolarHBondContact O-N 3.29Å; M57-N59 VanDerWaalsContact C-N 3.27Å; M57-N59 PolarHBondContact O-N 3.15Å | ||
| 58 | N | 44.9 | Very low | 49.3 | Very low | 108 Ų | 108 | 119.3 Ų | 119.3 | 58% | 0.578 | 72% | 0.715 | S | S | * | * | trans | -61.3 | 106.8 | 175.5 | 106 | 43.5 | 0 | 0 | 0 | 101.9 | Q56 S60 | Q56-N58 PolarHBondContact O-N 3.23Å; N58-S60 VanDerWaalsContact CG-OG 3.29Å; N58-S60 PolarHBondContact O-N 3.17Å; N58-S60 WeakPolarHBondContact OD1-CA 3.43Å; N58-S60 WeakPolarHBondContact OD1-CB 3.28Å; N58-S60 PolarHBondContact OD1-N 3Å; N58-S60 PolarHBondContact OD1-OG 3.41Å | ||
| 59 | N | 48.4 | Very low | 48.9 | Very low | 143 Ų | 143 | 118.7 Ų | 118.7 | 77% | 0.765 | 71% | 0.708 | S | S | * | * | trans | -85.3 | 54.3 | 166.1 | -152.7 | 44.3 | 0 | 0 | 0 | 105.9 | M57 V61 | M57-N59 VanDerWaalsContact C-N 3.27Å; M57-N59 PolarHBondContact O-N 3.15Å; N59-V61 PolarHBondContact O-N 3.36Å; N59-V61 VanDerWaalsContact O-N 3.13Å | ||
| 60 | S | 46.6 | Very low | 48.2 | Very low | 82 Ų | 82 | 123.1 Ų | 123.1 | 57% | 0.573 | 72% | 0.72 | S | S | * | * | trans | -84.7 | 70.9 | 165 | -34.3 | 0 | 0 | 0 | 0 | 105.8 | N58 S62 | N58-S60 VanDerWaalsContact CG-OG 3.29Å; N58-S60 PolarHBondContact O-N 3.17Å; N58-S60 WeakPolarHBondContact OD1-CA 3.43Å; N58-S60 WeakPolarHBondContact OD1-CB 3.28Å; N58-S60 PolarHBondContact OD1-N 3Å; N58-S60 PolarHBondContact OD1-OG 3.41Å; S60-S62 PolarHBondContact O-N 3.27Å | ||
| 61 | V | 54.9 | Low | 47.8 | Very low | 100 Ų | 100 | 127.4 Ų | 127.4 | 61% | 0.606 | 75% | 0.749 | S | S | * | * | trans | -72.3 | 81.3 | 156.2 | 171.6 | 0 | 0 | 0 | 0 | 104.9 | N59 I63 | N59-V61 PolarHBondContact O-N 3.36Å; N59-V61 VanDerWaalsContact O-N 3.13Å; V61-I63 HydrophobicContact CG1-CD1 3.65Å; V61-I63 HydrophobicContact CG1-CG1 3.55Å; V61-I63 PolarHBondContact O-N 3.18Å | ||
| 62 | S | 45.9 | Very low | 47.5 | Very low | 97 Ų | 97 | 129.6 Ų | 129.6 | 68% | 0.678 | 75% | 0.754 | S | S | * | * | trans | -68.5 | 92.2 | 160.7 | -80.3 | 0 | 0 | 0 | 0 | 106.3 | S60 E64 | S60-S62 PolarHBondContact O-N 3.27Å; S62-E64 PolarHBondContact O-N 3.29Å; S62-E64 VanDerWaalsContact O-N 3.15Å | ||
| 63 | I | 61.2 | Low | 47.4 | Very low | 146 Ų | 146 | 125.9 Ų | 125.9 | 75% | 0.749 | 75% | 0.748 | S | S | * | * | trans | -79.3 | 89.8 | 158.6 | -63.6 | 155 | 0 | 0 | 0 | 104.7 | V61 T65 | V61-I63 HydrophobicContact CG1-CD1 3.65Å; V61-I63 HydrophobicContact CG1-CG1 3.55Å; V61-I63 PolarHBondContact O-N 3.18Å; I63-T65 PolarHBondContact O-N 2.94Å | ||
| 64 | E | 39.8 | Very low | 47.5 | Very low | 174 Ų | 174 | 132 Ų | 132 | 81% | 0.813 | 77% | 0.765 | S | S | * | * | trans | -71.6 | 107.9 | 159.5 | -65.5 | -175.6 | 125.3 | 0 | 0 | 107.3 | S62 | S62-E64 PolarHBondContact O-N 3.29Å; S62-E64 VanDerWaalsContact O-N 3.15Å | ||
| 65 | T | 44.3 | Very low | 47.9 | Very low | 205 Ų | 205 | 137.5 Ų | 137.5 | 100% | 1.258 | 77% | 0.767 | S | S | * | * | trans | 151 | 0 | 139.1 | -55.4 | 0 | 0 | 0 | 0 | 110 | I63 | I63-T65 PolarHBondContact O-N 2.94Š|
Retrieved 65 of 65 residues in 46.5 ms
(Link to these results)