| 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 | 62.2 | Low | 69.3 | Low | 200 Ų | 200 | 125.9 Ų | 125.9 | 99% | 0.985 | 62% | 0.622 | S | S | * | * | 0 | -30.6 | 0 | -132.2 | 161.6 | 174.2 | 0 | 0 | 114 | T4 | M1-T4 PolarHBondContact O-OG1 2.69Å; M1-T4 VanDerWaalsContact O-OG1 3.05Å | |||
| 2 | F | 63.3 | Low | 69.1 | Low | 154 Ų | 154 | 122.2 Ų | 122.2 | 68% | 0.675 | 63% | 0.626 | S | S | * | * | H | α-helix | trans | -74.9 | -20.8 | -178.4 | -66.7 | -82.6 | 0 | 0 | 0 | 116.3 | M5 N6 | F2-M5 HydrophobicContact CB-CE 4.31Å; F2-M5 HydrophobicContact CD1-CE 3.26Å; F2-M5 HydrophobicContact CE1-CE 3.61Å; F2-M5 HydrophobicContact CG-CE 3.89Å; F2-M5 HydrophobicContact CZ-CE 4.48Å; F2-M5 PolarHBondContact O-N 3.38Å; F2-N6 PolarHBondContact O-N 2.93Å |
| 3 | R | 65 | Low | 68.8 | Low | 226 Ų | 226 | 127.6 Ų | 127.6 | 85% | 0.853 | 63% | 0.634 | S | S | * | * | H | α-helix | trans | -68.4 | -39.9 | -178.4 | -70.4 | 175.7 | 124.4 | 179 | -0.9 | 113.1 | A7 | R3-A7 PolarHBondContact O-N 3.15Å; R3-A7 VanDerWaalsContact O-N 3.08Å |
| 4 | T | 71.8 | Confident | 68.4 | Low | 96 Ų | 96 | 131.7 Ų | 131.7 | 59% | 0.589 | 64% | 0.639 | S | S | * | * | H | α-helix | trans | -68.6 | -38.4 | 176.2 | 41.9 | 0 | 0 | 0 | 0 | 111.2 | M1 A7 V8 | M1-T4 PolarHBondContact O-OG1 2.69Å; M1-T4 VanDerWaalsContact O-OG1 3.05Å; T4-A7 PolarHBondContact O-N 3.19Å; T4-V8 VanDerWaalsContact O-CG2 3.32Å; T4-V8 WeakPolarHBondContact O-CG2 3.32Å; T4-V8 PolarHBondContact O-N 2.94Å |
| 5 | M | 70.4 | Confident | 67.9 | Low | 98 Ų | 98 | 129.5 Ų | 129.5 | 48% | 0.483 | 64% | 0.642 | S | S | . | * | H | α-helix | trans | -63.8 | -42.8 | 175.7 | -65.2 | -169 | -69 | 0 | 0 | 112.2 | F2 A7 V8 Q9 | F2-M5 HydrophobicContact CB-CE 4.31Å; F2-M5 HydrophobicContact CD1-CE 3.26Å; F2-M5 HydrophobicContact CE1-CE 3.61Å; F2-M5 HydrophobicContact CG-CE 3.89Å; F2-M5 HydrophobicContact CZ-CE 4.48Å; F2-M5 PolarHBondContact O-N 3.38Å; M5-A7 PolarHBondContact O-N 3.46Å; M5-V8 PolarHBondContact O-N 3.12Å; M5-Q9 WeakPolarHBondContact O-CB 3.46Å; M5-Q9 PolarHBondContact O-N 3.39Å |
| 6 | N | 72.4 | Confident | 67.5 | Low | 92 Ų | 92 | 130.9 Ų | 130.9 | 49% | 0.492 | 65% | 0.65 | S | S | . | * | H | α-helix | trans | -66.1 | -35.9 | 175.3 | -71.8 | -18.6 | 0 | 0 | 0 | 112.6 | F2 Q9 Q10 | F2-N6 PolarHBondContact O-N 2.93Å; N6-Q9 PolarHBondContact O-N 3.32Å; N6-Q10 WeakPolarHBondContact O-CB 3.41Å; N6-Q10 WeakPolarHBondContact O-CG 3.33Å; N6-Q10 PolarHBondContact O-N 3.35Å |
| 7 | A | 74.1 | Confident | 66.9 | Low | 48 Ų | 48 | 129.1 Ų | 129.1 | 40% | 0.397 | 65% | 0.652 | S | S | . | * | H | α-helix | trans | -66.8 | -41.7 | 175.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | R3 T4 M5 Q10 M11 | R3-A7 PolarHBondContact O-N 3.15Å; R3-A7 VanDerWaalsContact O-N 3.08Å; T4-A7 PolarHBondContact O-N 3.19Å; M5-A7 PolarHBondContact O-N 3.46Å; A7-Q10 PolarHBondContact O-N 3.33Å; A7-M11 WeakPolarHBondContact O-CG 3.32Å; A7-M11 PolarHBondContact O-N 3.44Å |
| 8 | V | 71.5 | Confident | 66.4 | Low | 100 Ų | 100 | 127.5 Ų | 127.5 | 61% | 0.606 | 66% | 0.655 | S | S | * | * | H | α-helix | trans | -64.6 | -42.2 | 173.6 | 172 | 0 | 0 | 0 | 0 | 110.8 | T4 M5 Q10 M11 A12 | T4-V8 VanDerWaalsContact O-CG2 3.32Å; T4-V8 WeakPolarHBondContact O-CG2 3.32Å; T4-V8 PolarHBondContact O-N 2.94Å; M5-V8 PolarHBondContact O-N 3.12Å; V8-Q10 VanDerWaalsContact C-N 3.33Å; V8-Q10 PolarHBondContact O-N 2.86Å; V8-M11 PolarHBondContact O-N 3.38Å; V8-A12 WeakPolarHBondContact O-CB 3.22Å; V8-A12 PolarHBondContact O-N 2.82Å |
| 9 | Q | 72.6 | Confident | 66 | Low | 90 Ų | 90 | 125 Ų | 125 | 42% | 0.421 | 65% | 0.65 | S | S | . | * | H | α-helix | trans | -64.7 | -36.6 | 176.6 | -163.1 | -170.2 | -34.9 | 0 | 0 | 112 | M5 N6 R13 | M5-Q9 WeakPolarHBondContact O-CB 3.46Å; M5-Q9 PolarHBondContact O-N 3.39Å; N6-Q9 PolarHBondContact O-N 3.32Å; Q9-R13 VanDerWaalsContact NE2-NH2 3.16Å; Q9-R13 WeakPolarHBondContact O-CB 3.36Å; Q9-R13 VanDerWaalsContact O-CG 3.24Å; Q9-R13 WeakPolarHBondContact O-CG 3.22Å; Q9-R13 PolarHBondContact O-N 2.87Å |
| 10 | Q | 71.5 | Confident | 65.7 | Low | 148 Ų | 148 | 123.2 Ų | 123.2 | 69% | 0.692 | 65% | 0.654 | S | S | * | * | H | α-helix | trans | -68.2 | -38 | 172.5 | -80.8 | -170.6 | -29 | 0 | 0 | 112.5 | N6 A7 V8 R13 R14 | N6-Q10 WeakPolarHBondContact O-CB 3.41Å; N6-Q10 WeakPolarHBondContact O-CG 3.33Å; N6-Q10 PolarHBondContact O-N 3.35Å; A7-Q10 PolarHBondContact O-N 3.33Å; V8-Q10 VanDerWaalsContact C-N 3.33Å; V8-Q10 PolarHBondContact O-N 2.86Å; Q10-R13 PolarHBondContact O-N 3.4Å; Q10-R14 PolarHBondContact O-N 2.91Å |
| 11 | M | 67.6 | Low | 65.4 | Low | 133 Ų | 133 | 127.1 Ų | 127.1 | 66% | 0.655 | 66% | 0.66 | S | S | * | * | H | α-helix | trans | -69.6 | -37.1 | 175.1 | -74.1 | -167.8 | 158.8 | 0 | 0 | 112.5 | A7 V8 R13 R14 | A7-M11 WeakPolarHBondContact O-CG 3.32Å; A7-M11 PolarHBondContact O-N 3.44Å; V8-M11 PolarHBondContact O-N 3.38Å; M11-R13 VanDerWaalsContact C-N 3.34Å; M11-R14 WeakPolarHBondContact O-CB 3.32Å; M11-R14 PolarHBondContact O-N 3.28Å |
| 12 | A | 66.6 | Low | 65.4 | Low | 81 Ų | 81 | 128.6 Ų | 128.6 | 67% | 0.669 | 65% | 0.654 | S | S | * | * | H | α-helix | trans | -71.3 | -27.7 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.9 | V8 | V8-A12 WeakPolarHBondContact O-CB 3.22Å; V8-A12 PolarHBondContact O-N 2.82Å |
| 13 | R | 65.4 | Low | 65.5 | Low | 193 Ų | 193 | 129.7 Ų | 129.7 | 73% | 0.728 | 66% | 0.662 | S | S | * | * | H | α-helix | trans | -80.4 | -11.9 | 173.5 | -77.7 | 178 | 172.4 | -172.8 | -2.4 | 113.8 | Q9 Q10 M11 S15 | Q9-R13 VanDerWaalsContact NE2-NH2 3.16Å; Q9-R13 WeakPolarHBondContact O-CB 3.36Å; Q9-R13 VanDerWaalsContact O-CG 3.24Å; Q9-R13 WeakPolarHBondContact O-CG 3.22Å; Q9-R13 PolarHBondContact O-N 2.87Å; Q10-R13 PolarHBondContact O-N 3.4Å; M11-R13 VanDerWaalsContact C-N 3.34Å; R13-S15 PolarHBondContact O-N 3Å |
| 14 | R | 62.9 | Low | 66.2 | Low | 185 Ų | 185 | 124.8 Ų | 124.8 | 70% | 0.698 | 66% | 0.656 | S | S | * | * | S | Bend | trans | -68.4 | 106.6 | 163.6 | -71.1 | -176.2 | 170.4 | -177 | -3.2 | 106.2 | Q10 M11 I16 | Q10-R14 PolarHBondContact O-N 2.91Å; M11-R14 WeakPolarHBondContact O-CB 3.32Å; M11-R14 PolarHBondContact O-N 3.28Å; R14-I16 PolarHBondContact O-N 3.47Å |
| 15 | S | 61.6 | Low | 67 | Low | 98 Ų | 98 | 125.8 Ų | 125.8 | 69% | 0.685 | 65% | 0.654 | S | S | * | * | trans | -49.5 | 110.2 | 169.3 | -175.6 | 0 | 0 | 0 | 0 | 107.6 | R13 C17 | R13-S15 PolarHBondContact O-N 3Å; S15-C17 PolarHBondContact O-N 2.92Å | ||
| 16 | I | 61.5 | Low | 68 | Low | 152 Ų | 152 | 126.2 Ų | 126.2 | 78% | 0.779 | 66% | 0.659 | S | S | * | * | trans | -74.4 | 76.5 | 171.3 | -54.8 | 179 | 0 | 0 | 0 | 105.1 | R14 S18 | R14-I16 PolarHBondContact O-N 3.47Å; I16-S18 PolarHBondContact O-N 3.43Å | ||
| 17 | C | 56.3 | Low | 69.1 | Low | 101 Ų | 101 | 126.7 Ų | 126.7 | 68% | 0.682 | 66% | 0.656 | S | S | * | * | trans | -68.4 | 77.9 | 161.8 | -86.7 | 0 | 0 | 0 | 0 | 106.9 | S15 S19 | S15-C17 PolarHBondContact O-N 2.92Å; C17-S19 PolarHBondContact O-N 3.32Å | ||
| 18 | S | 58.8 | Low | 70.2 | Confident | 100 Ų | 100 | 128.2 Ų | 128.2 | 70% | 0.699 | 66% | 0.661 | S | S | * | * | trans | -74.4 | 56.4 | 163.8 | -167.3 | 0 | 0 | 0 | 0 | 109.1 | I16 A20 | I16-S18 PolarHBondContact O-N 3.43Å; S18-A20 PolarHBondContact O-N 3.24Å | ||
| 19 | S | 59.3 | Low | 71.4 | Confident | 80 Ų | 80 | 126.9 Ų | 126.9 | 56% | 0.559 | 65% | 0.654 | S | S | * | * | trans | -82.2 | 81 | 144.9 | 63 | 0 | 0 | 0 | 0 | 104.1 | C17 R21 | C17-S19 PolarHBondContact O-N 3.32Å; S19-R21 PolarHBondContact O-N 2.99Å | ||
| 20 | A | 58.7 | Low | 72.5 | Confident | 88 Ų | 88 | 126.8 Ų | 126.8 | 73% | 0.727 | 65% | 0.654 | S | S | * | * | trans | -56.4 | 91.8 | 154.6 | 0 | 0 | 0 | 0 | 0 | 104.4 | S18 R22 | S18-A20 PolarHBondContact O-N 3.24Å; A20-R22 PolarHBondContact O-N 3.39Å | ||
| 21 | R | 60.1 | Low | 73.7 | Confident | 206 Ų | 206 | 125.4 Ų | 125.4 | 78% | 0.777 | 65% | 0.645 | S | S | * | * | trans | -63.2 | 99.9 | 175.5 | -63.5 | -159.4 | -168.2 | -165.7 | 7.3 | 102.7 | S19 Q23 | S19-R21 PolarHBondContact O-N 2.99Å; R21-Q23 HydrophobicContact CB-CG 4.17Å; R21-Q23 PolarHBondContact O-N 3.43Å | ||
| 22 | R | 61.3 | Low | 75.2 | Confident | 231 Ų | 231 | 123.8 Ų | 123.8 | 87% | 0.872 | 64% | 0.636 | S | S | * | * | trans | -54.9 | 94 | 144 | -90.1 | -175.3 | 176 | 175 | -0.4 | 102.5 | A20 V24 | A20-R22 PolarHBondContact O-N 3.39Å; R22-V24 HydrophobicContact CB-CG2 4.12Å; R22-V24 PolarHBondContact O-N 3.03Å | ||
| 23 | Q | 65.8 | Low | 76.6 | Confident | 177 Ų | 177 | 128.1 Ų | 128.1 | 83% | 0.827 | 64% | 0.64 | S | S | * | * | trans | -66.6 | 75.2 | 167.7 | -87.8 | -176.9 | -61.1 | 0 | 0 | 104.8 | R21 E25 | R21-Q23 HydrophobicContact CB-CG 4.17Å; R21-Q23 PolarHBondContact O-N 3.43Å; Q23-E25 PolarHBondContact O-N 2.87Å | ||
| 24 | V | 81 | Confident | 78.1 | Confident | 123 Ų | 123 | 122.4 Ų | 122.4 | 75% | 0.745 | 62% | 0.622 | S | S | * | * | trans | -64.9 | 116.1 | 162.8 | -177.1 | 0 | 0 | 0 | 0 | 103.6 | R22 N26 | R22-V24 HydrophobicContact CB-CG2 4.12Å; R22-V24 PolarHBondContact O-N 3.03Å; V24-N26 PolarHBondContact O-N 3.48Å | ||
| 25 | E | 88.4 | Confident | 79.7 | Confident | 117 Ų | 117 | 117.4 Ų | 117.4 | 55% | 0.547 | 61% | 0.606 | S | S | . | * | trans | -55.2 | 135.6 | 177.3 | -167 | -166.4 | 138.3 | 0 | 0 | 109 | Q23 K27 | Q23-E25 PolarHBondContact O-N 2.87Å; E25-K27 PolarHBondContact O-N 3.43Å; E25-K27 IonicContact OE1-NZ 2.69Å; E25-K27 PolarHBondContact OE1-NZ 2.98Å; E25-K27 WeakPolarHBondContact OE2-CE 3.5Å; E25-K27 IonicContact OE2-NZ 3.98Å; E25-K27 PolarHBondContact OE2-NZ 2.98Å | ||
| 26 | N | 91.2 | Very high | 81.5 | Confident | 107 Ų | 107 | 119.8 Ų | 119.8 | 57% | 0.572 | 61% | 0.606 | S | S | * | * | trans | -65.4 | 110.7 | 176.7 | -178.1 | -1.4 | 0 | 0 | 0 | 109.5 | V24 V28 Q30 | V24-N26 PolarHBondContact O-N 3.48Å; N26-V28 VanDerWaalsContact OD1-CB 3.23Å; N26-V28 WeakPolarHBondContact OD1-CB 3.28Å; N26-V28 VanDerWaalsContact OD1-CG2 3.29Å; N26-V28 WeakPolarHBondContact OD1-CG2 3.48Å; N26-V28 PolarHBondContact OD1-N 2.95Å; N26-Q30 PolarHBondContact O-OE1 3.3Å | ||
| 27 | K | 94.7 | Very high | 83.2 | Confident | 102 Ų | 102 | 118 Ų | 118 | 44% | 0.443 | 60% | 0.595 | S | S | . | * | trans | -96.3 | 3.8 | 178.1 | -63.6 | -60.1 | -177.3 | -170.9 | 0 | 114.3 | E25 Q30 K31 | E25-K27 PolarHBondContact O-N 3.43Å; E25-K27 IonicContact OE1-NZ 2.69Å; E25-K27 PolarHBondContact OE1-NZ 2.98Å; E25-K27 WeakPolarHBondContact OE2-CE 3.5Å; E25-K27 IonicContact OE2-NZ 3.98Å; E25-K27 PolarHBondContact OE2-NZ 2.98Å; K27-Q30 PolarHBondContact O-N 2.84Å; K27-Q30 PolarHBondContact O-OE1 3.43Å; K27-Q30 VanDerWaalsContact O-OE1 3.05Å; K27-K31 WeakPolarHBondContact O-CG 3.45Å; K27-K31 PolarHBondContact O-N 2.85Å; K27-K31 VanDerWaalsContact O-N 3.13Å | ||
| 28 | V | 96.7 | Very high | 85.1 | Confident | 81 Ų | 81 | 120.9 Ų | 120.9 | 49% | 0.491 | 60% | 0.603 | S | S | . | * | H | α-helix | trans | -60.3 | -47.3 | -176.9 | 174.7 | 0 | 0 | 0 | 0 | 112.2 | N26 Q30 K31 Q32 | N26-V28 VanDerWaalsContact OD1-CB 3.23Å; N26-V28 WeakPolarHBondContact OD1-CB 3.28Å; N26-V28 VanDerWaalsContact OD1-CG2 3.29Å; N26-V28 WeakPolarHBondContact OD1-CG2 3.48Å; N26-V28 PolarHBondContact OD1-N 2.95Å; V28-Q30 VanDerWaalsContact C-N 3.28Å; V28-Q30 PolarHBondContact O-N 2.88Å; V28-K31 PolarHBondContact O-N 2.9Å; V28-K31 VanDerWaalsContact O-N 3.15Å; V28-Q32 HydrophobicContact CG1-CG 4.07Å; V28-Q32 WeakPolarHBondContact O-CG 3.31Å; V28-Q32 PolarHBondContact O-N 2.97Å |
| 29 | P | 97.4 | Very high | 86.8 | Confident | 72 Ų | 72 | 118.9 Ų | 118.9 | 47% | 0.468 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -60.2 | -37.3 | 180 | -25 | 35.7 | 0 | 0 | 0 | 113.2 | Q32 K33 | P29-Q32 PolarHBondContact O-N 3.28Å; P29-K33 PolarHBondContact O-N 2.93Å |
| 30 | Q | 96.4 | Very high | 88.6 | Confident | 87 Ų | 87 | 118.5 Ų | 118.5 | 41% | 0.407 | 59% | 0.593 | S | S | . | * | H | α-helix | trans | -67.2 | -41.2 | 178.1 | -60.4 | 85.7 | -17.5 | 0 | 0 | 110.9 | N26 K27 V28 M34 | N26-Q30 PolarHBondContact O-OE1 3.3Å; K27-Q30 PolarHBondContact O-N 2.84Å; K27-Q30 PolarHBondContact O-OE1 3.43Å; K27-Q30 VanDerWaalsContact O-OE1 3.05Å; V28-Q30 VanDerWaalsContact C-N 3.28Å; V28-Q30 PolarHBondContact O-N 2.88Å; Q30-M34 PolarHBondContact O-N 3.34Å; Q30-M34 VanDerWaalsContact O-N 3.11Å |
| 31 | K | 96.2 | Very high | 90.3 | Very high | 120 Ų | 120 | 118.1 Ų | 118.1 | 52% | 0.522 | 58% | 0.577 | S | S | . | * | H | α-helix | trans | -69.4 | -41.3 | 176.1 | -65.5 | -63.6 | -177.8 | 179.2 | 0 | 111.8 | K27 V28 K33 M34 F35 | K27-K31 WeakPolarHBondContact O-CG 3.45Å; K27-K31 PolarHBondContact O-N 2.85Å; K27-K31 VanDerWaalsContact O-N 3.13Å; V28-K31 PolarHBondContact O-N 2.9Å; V28-K31 VanDerWaalsContact O-N 3.15Å; K31-K33 VanDerWaalsContact C-N 3.33Å; K31-K33 PolarHBondContact O-N 3.38Å; K31-M34 PolarHBondContact O-N 2.9Å; K31-F35 WeakPolarHBondContact O-CD2 3.46Å; K31-F35 PolarHBondContact O-N 3.36Å |
| 32 | Q | 98.2 | Very high | 92.1 | Very high | 99 Ų | 99 | 111.3 Ų | 111.3 | 46% | 0.463 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -56.9 | -47.4 | 173.6 | -75.7 | 174.9 | -28 | 0 | 0 | 111 | V28 P29 M34 F35 Q36 | V28-Q32 HydrophobicContact CG1-CG 4.07Å; V28-Q32 WeakPolarHBondContact O-CG 3.31Å; V28-Q32 PolarHBondContact O-N 2.97Å; P29-Q32 PolarHBondContact O-N 3.28Å; Q32-M34 VanDerWaalsContact C-N 3.35Å; Q32-M34 PolarHBondContact O-N 3.02Å; Q32-F35 PolarHBondContact O-N 2.92Å; Q32-Q36 WeakPolarHBondContact O-CB 3.47Å; Q32-Q36 WeakPolarHBondContact O-CG 3.34Å; Q32-Q36 PolarHBondContact O-N 3.39Å |
| 33 | K | 97.4 | Very high | 93.8 | Very high | 172 Ų | 172 | 106.2 Ų | 106.2 | 75% | 0.748 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -57.9 | -45.2 | 175.9 | -174.7 | 176.1 | 179.2 | 180 | 0 | 112.5 | P29 K31 E37 | P29-K33 PolarHBondContact O-N 2.93Å; K31-K33 VanDerWaalsContact C-N 3.33Å; K31-K33 PolarHBondContact O-N 3.38Å; K33-E37 PolarHBondContact O-N 3.42Å; K33-E37 VanDerWaalsContact O-N 3.15Å |
| 34 | M | 96.6 | Very high | 95.2 | Very high | 72 Ų | 72 | 102.7 Ų | 102.7 | 36% | 0.355 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -64.1 | -46.8 | 179.4 | -177.5 | -176.6 | 179 | 0 | 0 | 112.4 | Q30 K31 Q32 G47 | Q30-M34 PolarHBondContact O-N 3.34Å; Q30-M34 VanDerWaalsContact O-N 3.11Å; K31-M34 PolarHBondContact O-N 2.9Å; Q32-M34 VanDerWaalsContact C-N 3.35Å; Q32-M34 PolarHBondContact O-N 3.02Å; M34-G47 WeakPolarHBondContact CE-O 3.45Å |
| 35 | F | 97.3 | Very high | 96 | Very high | 81 Ų | 81 | 99 Ų | 99 | 36% | 0.355 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -80 | -20.2 | -176.2 | -78.9 | -81.2 | 0 | 0 | 0 | 113.8 | K31 Q32 I43 K46 | K31-F35 WeakPolarHBondContact O-CD2 3.46Å; K31-F35 PolarHBondContact O-N 3.36Å; Q32-F35 PolarHBondContact O-N 2.92Å; F35-I43 HydrophobicContact CD1-CD1 3.84Å; F35-I43 HydrophobicContact CE1-CD1 4.43Å; F35-K46 HydrophobicContact CB-CG 4.48Å; F35-K46 HydrophobicContact CD1-CB 3.68Å; F35-K46 HydrophobicContact CD1-CG 3.57Å; F35-K46 HydrophobicContact CE1-CB 3.81Å; F35-K46 HydrophobicContact CE1-CG 4.17Å; F35-K46 HydrophobicContact CG-CG 4.33Å; F35-K46 VanDerWaalsContact O-CE 3.27Å; F35-K46 WeakPolarHBondContact O-CE 3.3Å |
| 36 | Q | 97.9 | Very high | 96.5 | Very high | 147 Ų | 147 | 94.2 Ų | 94.2 | 69% | 0.687 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -97.3 | -1.9 | 176.9 | -62.7 | 174 | 22.3 | 0 | 0 | 113.5 | Q32 D38 | Q32-Q36 WeakPolarHBondContact O-CB 3.47Å; Q32-Q36 WeakPolarHBondContact O-CG 3.34Å; Q32-Q36 PolarHBondContact O-N 3.39Å; Q36-D38 PolarHBondContact O-N 2.95Å |
| 37 | E | 96.7 | Very high | 96.7 | Very high | 116 Ų | 116 | 90.3 Ų | 90.3 | 54% | 0.542 | 47% | 0.47 | S | S | . | . | trans | -57 | 129.3 | 173.2 | -177 | -179.5 | -141.5 | 0 | 0 | 110.5 | K33 N39 K46 | K33-E37 PolarHBondContact O-N 3.42Å; K33-E37 VanDerWaalsContact O-N 3.15Å; E37-N39 HydrophobicContact CG-CB 4.24Å; E37-N39 PolarHBondContact O-N 2.94Å; E37-N39 PolarHBondContact OE2-ND2 3.39Å; E37-K46 VanDerWaalsContact O-CE 3.3Å; E37-K46 WeakPolarHBondContact O-CE 3.46Å; E37-K46 PolarHBondContact O-NZ 2.93Å | ||
| 38 | D | 96.7 | Very high | 96.7 | Very high | 161 Ų | 161 | 86.7 Ų | 86.7 | 86% | 0.861 | 46% | 0.462 | S | S | * | . | trans | -83 | 67.7 | -178.9 | -168.5 | 17.9 | 0 | 0 | 0 | 111.9 | Q36 | Q36-D38 PolarHBondContact O-N 2.95Š| ||
| 39 | N | 95.5 | Very high | 96.7 | Very high | 58 Ų | 58 | 88 Ų | 88 | 31% | 0.31 | 47% | 0.474 | S | S | . | . | S | Bend | trans | -102.6 | 11.1 | 179.5 | 61.7 | 26.8 | 0 | 0 | 0 | 113.1 | E37 M41 K46 | E37-N39 HydrophobicContact CG-CB 4.24Å; E37-N39 PolarHBondContact O-N 2.94Å; E37-N39 PolarHBondContact OE2-ND2 3.39Å; N39-M41 WeakPolarHBondContact ND2-CE 3.26Å; N39-M41 PolarHBondContact O-N 2.67Å; N39-M41 VanDerWaalsContact OD1-CB 3.31Å; N39-M41 WeakPolarHBondContact OD1-CB 3.5Å; N39-M41 WeakPolarHBondContact OD1-CG 3.42Å; N39-M41 PolarHBondContact OD1-N 3.13Å; N39-M41 VanDerWaalsContact OD1-N 3.13Å; N39-K46 WeakPolarHBondContact OD1-CE 3.33Å; N39-K46 PolarHBondContact OD1-NZ 3.34Å |
| 40 | G | 96 | Very high | 96.8 | Very high | 71 Ų | 71 | 88.8 Ų | 88.8 | 73% | 0.732 | 48% | 0.482 | S | S | * | . | trans | 66.4 | -0.4 | -179.9 | 0 | 0 | 0 | 0 | 0 | 116.1 | ||||
| 41 | M | 95.9 | Very high | 96.9 | Very high | 81 Ų | 81 | 87 Ų | 87 | 40% | 0.399 | 47% | 0.474 | S | S | . | . | trans | -72.3 | 138.4 | 179.9 | -66.9 | -161.7 | -70.8 | 0 | 0 | 111.9 | N39 K46 | N39-M41 WeakPolarHBondContact ND2-CE 3.26Å; N39-M41 PolarHBondContact O-N 2.67Å; N39-M41 VanDerWaalsContact OD1-CB 3.31Å; N39-M41 WeakPolarHBondContact OD1-CB 3.5Å; N39-M41 WeakPolarHBondContact OD1-CG 3.42Å; N39-M41 PolarHBondContact OD1-N 3.13Å; N39-M41 VanDerWaalsContact OD1-N 3.13Å; M41-K46 HydrophobicContact CB-CD 3.89Å; M41-K46 HydrophobicContact CE-CD 4.28Å | ||
| 42 | P | 96.5 | Very high | 96.9 | Very high | 62 Ų | 62 | 82.5 Ų | 82.5 | 40% | 0.403 | 46% | 0.46 | S | S | . | . | trans | -67.2 | 151.2 | 173.6 | 30.4 | -35.5 | 0 | 0 | 0 | 111.1 | H44 L45 K46 | P42-H44 PolarHBondContact O-N 3.01Å; P42-H44 VanDerWaalsContact O-N 3.1Å; P42-L45 HydrophobicContact CG-CB 4.29Å; P42-L45 HydrophobicContact CG-CD1 4.01Å; P42-L45 HydrophobicContact CG-CG 4.24Å; P42-L45 PolarHBondContact O-N 2.69Å; P42-K46 PolarHBondContact O-N 2.9Å | ||
| 43 | I | 96.9 | Very high | 96.9 | Very high | 124 Ų | 124 | 83.8 Ų | 83.8 | 64% | 0.636 | 47% | 0.469 | S | S | * | . | G | 310 helix | trans | -56.8 | -33.2 | -171.2 | -170.9 | 59.9 | 0 | 0 | 0 | 114.1 | F35 L45 K46 | F35-I43 HydrophobicContact CD1-CD1 3.84Å; F35-I43 HydrophobicContact CE1-CD1 4.43Å; I43-L45 VanDerWaalsContact C-N 3.27Å; I43-L45 PolarHBondContact O-N 3.1Å; I43-K46 HydrophobicContact CD1-CB 4.39Å; I43-K46 WeakPolarHBondContact O-CB 3.37Å; I43-K46 PolarHBondContact O-N 3.36Å |
| 44 | H | 96.6 | Very high | 97 | Very high | 103 Ų | 103 | 81 Ų | 81 | 48% | 0.477 | 46% | 0.462 | S | S | . | . | G | 310 helix | trans | -78.8 | -3.1 | -179.2 | 65 | -93.9 | 0 | 0 | 0 | 114.4 | P42 D51 | P42-H44 PolarHBondContact O-N 3.01Å; P42-H44 VanDerWaalsContact O-N 3.1Å; H44-D51 WeakPolarHBondContact O-CB 3.17Å |
| 45 | L | 97.6 | Very high | 97.1 | Very high | 45 Ų | 45 | 82.9 Ų | 82.9 | 24% | 0.236 | 47% | 0.466 | C | S | . | . | G | 310 helix | trans | -119 | -0.6 | 171.4 | -62.3 | 178.5 | 0 | 0 | 0 | 112.2 | P42 I43 G47 G48 A52 Y55 | P42-L45 HydrophobicContact CG-CB 4.29Å; P42-L45 HydrophobicContact CG-CD1 4.01Å; P42-L45 HydrophobicContact CG-CG 4.24Å; P42-L45 PolarHBondContact O-N 2.69Å; I43-L45 VanDerWaalsContact C-N 3.27Å; I43-L45 PolarHBondContact O-N 3.1Å; L45-G47 PolarHBondContact O-N 3.23Å; L45-G48 PolarHBondContact O-N 2.99Å; L45-A52 HydrophobicContact CD2-CB 4.21Å; L45-Y55 HydrophobicContact CD2-CG 4.4Å |
| 46 | K | 97.2 | Very high | 97.2 | Very high | 18 Ų | 18 | 87.5 Ų | 87.5 | 8% | 0.078 | 48% | 0.481 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -69.2 | -21.8 | -169.7 | -162.1 | 73.5 | 167.8 | -158.3 | 0 | 112.8 | F35 E37 N39 M41 P42 I43 G48 | F35-K46 HydrophobicContact CB-CG 4.48Å; F35-K46 HydrophobicContact CD1-CB 3.68Å; F35-K46 HydrophobicContact CD1-CG 3.57Å; F35-K46 HydrophobicContact CE1-CB 3.81Å; F35-K46 HydrophobicContact CE1-CG 4.17Å; F35-K46 HydrophobicContact CG-CG 4.33Å; F35-K46 VanDerWaalsContact O-CE 3.27Å; F35-K46 WeakPolarHBondContact O-CE 3.3Å; E37-K46 VanDerWaalsContact O-CE 3.3Å; E37-K46 WeakPolarHBondContact O-CE 3.46Å; E37-K46 PolarHBondContact O-NZ 2.93Å; N39-K46 WeakPolarHBondContact OD1-CE 3.33Å; N39-K46 PolarHBondContact OD1-NZ 3.34Å; M41-K46 HydrophobicContact CB-CD 3.89Å; M41-K46 HydrophobicContact CE-CD 4.28Å; P42-K46 PolarHBondContact O-N 2.9Å; I43-K46 HydrophobicContact CD1-CB 4.39Å; I43-K46 WeakPolarHBondContact O-CB 3.37Å; I43-K46 PolarHBondContact O-N 3.36Å; K46-G48 PolarHBondContact O-N 3.03Å |
| 47 | G | 95.5 | Very high | 97.2 | Very high | 25 Ų | 25 | 83 Ų | 83 | 26% | 0.258 | 47% | 0.469 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -74.2 | -7.6 | 172.6 | 0 | 0 | 0 | 0 | 0 | 114.2 | M34 L45 D51 | M34-G47 WeakPolarHBondContact CE-O 3.45Å; L45-G47 PolarHBondContact O-N 3.23Å; G47-D51 WeakPolarHBondContact CA-OD2 3.45Å; G47-D51 PolarHBondContact N-OD2 3.26Å |
| 48 | G | 96.3 | Very high | 97.3 | Very high | 26 Ų | 26 | 81 Ų | 81 | 27% | 0.268 | 47% | 0.465 | S | S | . | . | trans | 96.1 | -144.9 | 172.2 | 0 | 0 | 0 | 0 | 0 | 114 | L45 K46 S50 D51 A52 | L45-G48 PolarHBondContact O-N 2.99Å; K46-G48 PolarHBondContact O-N 3.03Å; G48-S50 VanDerWaalsContact C-N 3.29Å; G48-S50 PolarHBondContact O-N 3.36Å; G48-D51 WeakPolarHBondContact O-CB 3.31Å; G48-D51 PolarHBondContact O-N 3.45Å; G48-D51 VanDerWaalsContact O-N 3.11Å; G48-A52 PolarHBondContact O-N 3.39Å | ||
| 49 | S | 96.9 | Very high | 97.4 | Very high | 108 Ų | 108 | 77.3 Ų | 77.3 | 76% | 0.755 | 44% | 0.443 | S | S | * | . | H | α-helix | trans | -61.4 | -31.6 | -169.2 | -52 | 0 | 0 | 0 | 0 | 114.6 | A52 L53 | S49-A52 PolarHBondContact O-N 2.94Å; S49-L53 WeakPolarHBondContact O-CB 3.38Å; S49-L53 PolarHBondContact O-N 3.3Å |
| 50 | S | 97.8 | Very high | 97.6 | Very high | 89 Ų | 89 | 78.8 Ų | 78.8 | 62% | 0.622 | 45% | 0.454 | S | S | * | . | H | α-helix | trans | -64.8 | -43.3 | 176.6 | -171.2 | 0 | 0 | 0 | 0 | 111.4 | G48 A52 L53 L54 | G48-S50 VanDerWaalsContact C-N 3.29Å; G48-S50 PolarHBondContact O-N 3.36Å; S50-A52 VanDerWaalsContact C-N 3.34Å; S50-L53 PolarHBondContact O-N 3.5Å; S50-L54 WeakPolarHBondContact O-CB 3.4Å; S50-L54 PolarHBondContact O-N 3.38Å |
| 51 | D | 98.3 | Very high | 97.7 | Very high | 48 Ų | 48 | 81.3 Ų | 81.3 | 26% | 0.257 | 45% | 0.451 | S | S | . | . | H | α-helix | trans | -64.3 | -43.2 | 178.4 | -68.2 | 7.2 | 0 | 0 | 0 | 110.3 | H44 G47 G48 L54 Y55 | H44-D51 WeakPolarHBondContact O-CB 3.17Å; G47-D51 WeakPolarHBondContact CA-OD2 3.45Å; G47-D51 PolarHBondContact N-OD2 3.26Å; G48-D51 WeakPolarHBondContact O-CB 3.31Å; G48-D51 PolarHBondContact O-N 3.45Å; G48-D51 VanDerWaalsContact O-N 3.11Å; D51-L54 PolarHBondContact O-N 3.17Å; D51-Y55 VanDerWaalsContact O-CB 3.24Å; D51-Y55 WeakPolarHBondContact O-CB 3.24Å; D51-Y55 PolarHBondContact O-N 2.84Å |
| 52 | A | 97.8 | Very high | 97.8 | Very high | 26 Ų | 26 | 80.7 Ų | 80.7 | 22% | 0.215 | 45% | 0.452 | C | S | . | . | H | α-helix | trans | -63.7 | -42.3 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.9 | L45 G48 S49 S50 R56 | L45-A52 HydrophobicContact CD2-CB 4.21Å; G48-A52 PolarHBondContact O-N 3.39Å; S49-A52 PolarHBondContact O-N 2.94Å; S50-A52 VanDerWaalsContact C-N 3.34Å; A52-R56 WeakPolarHBondContact O-CB 3.25Å; A52-R56 VanDerWaalsContact O-CG 3.25Å; A52-R56 WeakPolarHBondContact O-CG 3.46Å; A52-R56 PolarHBondContact O-N 3.07Å |
| 53 | L | 98.6 | Very high | 97.9 | Very high | 126 Ų | 126 | 82.2 Ų | 82.2 | 66% | 0.66 | 46% | 0.459 | S | S | * | . | H | α-helix | trans | -63.8 | -47.6 | 176 | 179.1 | 62.5 | 0 | 0 | 0 | 110.8 | S49 S50 R56 A57 | S49-L53 WeakPolarHBondContact O-CB 3.38Å; S49-L53 PolarHBondContact O-N 3.3Å; S50-L53 PolarHBondContact O-N 3.5Å; L53-R56 PolarHBondContact O-N 3.42Å; L53-A57 WeakPolarHBondContact O-CB 3.27Å; L53-A57 PolarHBondContact O-N 3.15Å |
| 54 | L | 98.7 | Very high | 98 | Very high | 114 Ų | 114 | 81.9 Ų | 81.9 | 60% | 0.597 | 46% | 0.458 | S | S | * | . | H | α-helix | trans | -61.4 | -47.9 | 179.8 | -175.5 | 60.9 | 0 | 0 | 0 | 111 | S50 D51 R56 A57 T58 | S50-L54 WeakPolarHBondContact O-CB 3.4Å; S50-L54 PolarHBondContact O-N 3.38Å; D51-L54 PolarHBondContact O-N 3.17Å; L54-R56 PolarHBondContact O-N 2.94Å; L54-A57 PolarHBondContact O-N 3.39Å; L54-T58 WeakPolarHBondContact O-CB 3.36Å; L54-T58 PolarHBondContact O-N 3.11Å; L54-T58 PolarHBondContact O-OG1 3.21Å |
| 55 | Y | 98.5 | Very high | 98.1 | Very high | 111 Ų | 111 | 78.6 Ų | 78.6 | 44% | 0.435 | 45% | 0.452 | S | S | . | . | H | α-helix | trans | -55.4 | -50.2 | 176.7 | 172.3 | -100.8 | 0 | 0 | 0 | 112 | L45 D51 A57 T58 M59 | L45-Y55 HydrophobicContact CD2-CG 4.4Å; D51-Y55 VanDerWaalsContact O-CB 3.24Å; D51-Y55 WeakPolarHBondContact O-CB 3.24Å; D51-Y55 PolarHBondContact O-N 2.84Å; Y55-A57 PolarHBondContact O-N 2.92Å; Y55-T58 PolarHBondContact O-N 3.41Å; Y55-M59 HydrophobicContact CD1-CG 4.42Å; Y55-M59 HydrophobicContact CD2-CG 4.3Å; Y55-M59 HydrophobicContact CE1-CG 3.97Å; Y55-M59 HydrophobicContact CE2-CG 3.84Å; Y55-M59 HydrophobicContact CE2-SD 4.26Å; Y55-M59 WeakPolarHBondContact O-CB 3.2Å; Y55-M59 WeakPolarHBondContact O-CG 3.44Å; Y55-M59 PolarHBondContact O-N 3.42Å |
| 56 | R | 98.5 | Very high | 98.2 | Very high | 178 Ų | 178 | 80.6 Ų | 80.6 | 67% | 0.672 | 47% | 0.466 | S | S | * | . | H | α-helix | trans | -64.2 | -43 | -179.7 | -71.4 | 173 | -177 | -175.7 | 1.2 | 112 | A52 L53 L54 M59 V60 | A52-R56 WeakPolarHBondContact O-CB 3.25Å; A52-R56 VanDerWaalsContact O-CG 3.25Å; A52-R56 WeakPolarHBondContact O-CG 3.46Å; A52-R56 PolarHBondContact O-N 3.07Å; L53-R56 PolarHBondContact O-N 3.42Å; L54-R56 PolarHBondContact O-N 2.94Å; R56-M59 PolarHBondContact O-N 2.88Å; R56-V60 WeakPolarHBondContact O-CG2 3.5Å; R56-V60 PolarHBondContact O-N 3.11Å |
| 57 | A | 98.7 | Very high | 98.3 | Very high | 54 Ų | 54 | 81.5 Ų | 81.5 | 45% | 0.446 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -61.3 | -44.9 | 177.5 | 0 | 0 | 0 | 0 | 0 | 111.4 | L53 L54 Y55 V60 L61 | L53-A57 WeakPolarHBondContact O-CB 3.27Å; L53-A57 PolarHBondContact O-N 3.15Å; L54-A57 PolarHBondContact O-N 3.39Å; Y55-A57 PolarHBondContact O-N 2.92Å; A57-V60 PolarHBondContact O-N 3.21Å; A57-L61 WeakPolarHBondContact O-CB 3.47Å; A57-L61 PolarHBondContact O-N 2.77Å |
| 58 | T | 98.7 | Very high | 98.4 | Very high | 73 Ų | 73 | 86.5 Ų | 86.5 | 45% | 0.448 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -64.2 | -42 | 176.6 | -56.7 | 0 | 0 | 0 | 0 | 111.9 | L54 Y55 L61 T62 | L54-T58 WeakPolarHBondContact O-CB 3.36Å; L54-T58 PolarHBondContact O-N 3.11Å; L54-T58 PolarHBondContact O-OG1 3.21Å; Y55-T58 PolarHBondContact O-N 3.41Å; T58-L61 PolarHBondContact O-N 2.95Å; T58-T62 HydrophobicContact CG2-CG2 4.34Å; T58-T62 WeakPolarHBondContact O-CB 3.07Å; T58-T62 VanDerWaalsContact O-CG2 3.31Å; T58-T62 WeakPolarHBondContact O-CG2 3.44Å; T58-T62 PolarHBondContact O-N 3.41Å; T58-T62 PolarHBondContact O-OG1 3.29Å |
| 59 | M | 98.8 | Very high | 98.5 | Very high | 83 Ų | 83 | 89.7 Ų | 89.7 | 41% | 0.409 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -61.1 | -45.6 | 175.4 | -77.2 | -61.6 | -60.9 | 0 | 0 | 111.9 | Y55 R56 T62 V63 | Y55-M59 HydrophobicContact CD1-CG 4.42Å; Y55-M59 HydrophobicContact CD2-CG 4.3Å; Y55-M59 HydrophobicContact CE1-CG 3.97Å; Y55-M59 HydrophobicContact CE2-CG 3.84Å; Y55-M59 HydrophobicContact CE2-SD 4.26Å; Y55-M59 WeakPolarHBondContact O-CB 3.2Å; Y55-M59 WeakPolarHBondContact O-CG 3.44Å; Y55-M59 PolarHBondContact O-N 3.42Å; R56-M59 PolarHBondContact O-N 2.88Å; M59-T62 WeakPolarHBondContact CA-OG1 3.4Å; M59-T62 PolarHBondContact O-N 2.98Å; M59-T62 PolarHBondContact O-OG1 3.37Å; M59-V63 WeakPolarHBondContact O-CB 3.33Å; M59-V63 VanDerWaalsContact O-CG2 3.28Å; M59-V63 WeakPolarHBondContact O-CG2 3.23Å; M59-V63 PolarHBondContact O-N 3.13Å |
| 60 | V | 98.9 | Very high | 98.6 | Very high | 89 Ų | 89 | 89.3 Ų | 89.3 | 54% | 0.539 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -61 | -49 | 176.9 | 169.3 | 0 | 0 | 0 | 0 | 110.7 | R56 A57 T62 V63 L64 | R56-V60 WeakPolarHBondContact O-CG2 3.5Å; R56-V60 PolarHBondContact O-N 3.11Å; A57-V60 PolarHBondContact O-N 3.21Å; V60-T62 VanDerWaalsContact C-N 3.33Å; V60-T62 PolarHBondContact O-N 3.43Å; V60-V63 PolarHBondContact O-N 3.15Å; V60-L64 HydrophobicContact CG1-CD1 3.8Å; V60-L64 HydrophobicContact CG1-CG 4.32Å; V60-L64 WeakPolarHBondContact O-CB 3.34Å; V60-L64 VanDerWaalsContact O-CG 3.26Å; V60-L64 WeakPolarHBondContact O-CG 3.36Å; V60-L64 PolarHBondContact O-N 2.91Å |
| 61 | L | 98.8 | Very high | 98.6 | Very high | 125 Ų | 125 | 91.8 Ų | 91.8 | 65% | 0.654 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -59.9 | -43.1 | -179.6 | -179.7 | 62.3 | 0 | 0 | 0 | 112.1 | A57 T58 G65 | A57-L61 WeakPolarHBondContact O-CB 3.47Å; A57-L61 PolarHBondContact O-N 2.77Å; T58-L61 PolarHBondContact O-N 2.95Å; L61-G65 PolarHBondContact O-N 3.35Å |
| 62 | T | 98.8 | Very high | 98.6 | Very high | 68 Ų | 68 | 92.9 Ų | 92.9 | 42% | 0.417 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -70.4 | -42.4 | -178.9 | 49.7 | 0 | 0 | 0 | 0 | 112.3 | T58 M59 V60 G65 V66 | T58-T62 HydrophobicContact CG2-CG2 4.34Å; T58-T62 WeakPolarHBondContact O-CB 3.07Å; T58-T62 VanDerWaalsContact O-CG2 3.31Å; T58-T62 WeakPolarHBondContact O-CG2 3.44Å; T58-T62 PolarHBondContact O-N 3.41Å; T58-T62 PolarHBondContact O-OG1 3.29Å; M59-T62 WeakPolarHBondContact CA-OG1 3.4Å; M59-T62 PolarHBondContact O-N 2.98Å; M59-T62 PolarHBondContact O-OG1 3.37Å; V60-T62 VanDerWaalsContact C-N 3.33Å; V60-T62 PolarHBondContact O-N 3.43Å; T62-G65 PolarHBondContact O-N 3.47Å; T62-V66 VanDerWaalsContact O-CG2 3.32Å; T62-V66 WeakPolarHBondContact O-CG2 3.42Å; T62-V66 PolarHBondContact O-N 2.83Å |
| 63 | V | 98.8 | Very high | 98.6 | Very high | 94 Ų | 94 | 96.4 Ų | 96.4 | 57% | 0.57 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -62.6 | -44.9 | 175.6 | 171.4 | 0 | 0 | 0 | 0 | 111 | M59 V60 V66 G67 | M59-V63 WeakPolarHBondContact O-CB 3.33Å; M59-V63 VanDerWaalsContact O-CG2 3.28Å; M59-V63 WeakPolarHBondContact O-CG2 3.23Å; M59-V63 PolarHBondContact O-N 3.13Å; V60-V63 PolarHBondContact O-N 3.15Å; V63-V66 PolarHBondContact O-N 2.69Å; V63-G67 PolarHBondContact O-N 3.17Å |
| 64 | L | 98.8 | Very high | 98.6 | Very high | 117 Ų | 117 | 94.4 Ų | 94.4 | 61% | 0.613 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -62.1 | -44.2 | 175 | -71.5 | 178.7 | 0 | 0 | 0 | 111.7 | V60 G67 F68 | V60-L64 HydrophobicContact CG1-CD1 3.8Å; V60-L64 HydrophobicContact CG1-CG 4.32Å; V60-L64 WeakPolarHBondContact O-CB 3.34Å; V60-L64 VanDerWaalsContact O-CG 3.26Å; V60-L64 WeakPolarHBondContact O-CG 3.36Å; V60-L64 PolarHBondContact O-N 2.91Å; L64-G67 PolarHBondContact O-N 2.71Å; L64-F68 WeakPolarHBondContact O-CB 3.29Å; L64-F68 PolarHBondContact O-N 3.05Å |
| 65 | G | 98.8 | Very high | 98.5 | Very high | 33 Ų | 33 | 92.9 Ų | 92.9 | 34% | 0.34 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -59.2 | -47.2 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | L61 T62 G67 F68 T69 | L61-G65 PolarHBondContact O-N 3.35Å; T62-G65 PolarHBondContact O-N 3.47Å; G65-G67 PolarHBondContact O-N 2.74Å; G65-F68 PolarHBondContact O-N 2.69Å; G65-T69 WeakPolarHBondContact O-CB 3.44Å; G65-T69 PolarHBondContact O-N 3.3Å; G65-T69 PolarHBondContact O-OG1 2.88Å |
| 66 | V | 98.8 | Very high | 98.4 | Very high | 87 Ų | 87 | 91.4 Ų | 91.4 | 53% | 0.527 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -59.8 | -46.5 | 175.7 | 169.5 | 0 | 0 | 0 | 0 | 110.9 | T62 V63 F68 T69 L70 | T62-V66 VanDerWaalsContact O-CG2 3.32Å; T62-V66 WeakPolarHBondContact O-CG2 3.42Å; T62-V66 PolarHBondContact O-N 2.83Å; V63-V66 PolarHBondContact O-N 2.69Å; V66-F68 VanDerWaalsContact C-N 3.34Å; V66-F68 PolarHBondContact O-N 2.78Å; V66-T69 PolarHBondContact O-N 3.03Å; V66-L70 HydrophobicContact CG1-CD1 4.04Å; V66-L70 HydrophobicContact CG1-CG 4.42Å; V66-L70 WeakPolarHBondContact O-CG 3.46Å; V66-L70 PolarHBondContact O-N 3.39Å |
| 67 | G | 98.8 | Very high | 98.3 | Very high | 38 Ų | 38 | 86.8 Ų | 86.8 | 39% | 0.392 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -58.7 | -44.5 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.6 | V63 L64 G65 L70 Y71 | V63-G67 PolarHBondContact O-N 3.17Å; L64-G67 PolarHBondContact O-N 2.71Å; G65-G67 PolarHBondContact O-N 2.74Å; G67-L70 PolarHBondContact O-N 2.78Å; G67-Y71 PolarHBondContact O-N 2.9Å |
| 68 | F | 98.7 | Very high | 98.1 | Very high | 130 Ų | 130 | 90.8 Ų | 90.8 | 57% | 0.57 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -64.7 | -44.6 | 177.3 | -177.1 | -101.4 | 0 | 0 | 0 | 112.2 | L64 G65 V66 L70 Y71 E72 | L64-F68 WeakPolarHBondContact O-CB 3.29Å; L64-F68 PolarHBondContact O-N 3.05Å; G65-F68 PolarHBondContact O-N 2.69Å; V66-F68 VanDerWaalsContact C-N 3.34Å; V66-F68 PolarHBondContact O-N 2.78Å; F68-L70 VanDerWaalsContact C-N 3.33Å; F68-L70 PolarHBondContact O-N 2.82Å; F68-Y71 WeakPolarHBondContact O-CB 3.33Å; F68-Y71 PolarHBondContact O-N 3.22Å; F68-E72 HydrophobicContact CD1-CG 4.36Å; F68-E72 HydrophobicContact CE1-CG 3.81Å; F68-E72 HydrophobicContact CE2-CG 4.25Å; F68-E72 HydrophobicContact CZ-CG 3.74Å; F68-E72 PolarHBondContact O-N 3.32Å |
| 69 | T | 98.6 | Very high | 97.9 | Very high | 92 Ų | 92 | 93.2 Ų | 93.2 | 56% | 0.564 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -61.6 | -40.6 | 176.3 | -59.5 | 0 | 0 | 0 | 0 | 111.8 | G65 V66 E72 L73 | G65-T69 WeakPolarHBondContact O-CB 3.44Å; G65-T69 PolarHBondContact O-N 3.3Å; G65-T69 PolarHBondContact O-OG1 2.88Å; V66-T69 PolarHBondContact O-N 3.03Å; T69-E72 PolarHBondContact O-N 3.44Å; T69-L73 WeakPolarHBondContact O-CB 3.35Å; T69-L73 PolarHBondContact O-N 3Å |
| 70 | L | 98.7 | Very high | 97.4 | Very high | 101 Ų | 101 | 94.7 Ų | 94.7 | 53% | 0.529 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -65 | -41.2 | 175.7 | -71.5 | 174.7 | 0 | 0 | 0 | 112 | V66 G67 F68 L73 V74 | V66-L70 HydrophobicContact CG1-CD1 4.04Å; V66-L70 HydrophobicContact CG1-CG 4.42Å; V66-L70 WeakPolarHBondContact O-CG 3.46Å; V66-L70 PolarHBondContact O-N 3.39Å; G67-L70 PolarHBondContact O-N 2.78Å; F68-L70 VanDerWaalsContact C-N 3.33Å; F68-L70 PolarHBondContact O-N 2.82Å; L70-L73 PolarHBondContact O-N 2.81Å; L70-V74 WeakPolarHBondContact O-CG2 3.44Å; L70-V74 PolarHBondContact O-N 3.06Å |
| 71 | Y | 98.2 | Very high | 96.7 | Very high | 141 Ų | 141 | 100 Ų | 100 | 55% | 0.553 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -59.4 | -51.3 | 174.7 | 168.8 | -98.1 | 0 | 0 | 0 | 111.7 | G67 F68 L73 V74 K75 | G67-Y71 PolarHBondContact O-N 2.9Å; F68-Y71 WeakPolarHBondContact O-CB 3.33Å; F68-Y71 PolarHBondContact O-N 3.22Å; Y71-L73 VanDerWaalsContact C-N 3.32Å; Y71-L73 PolarHBondContact O-N 2.92Å; Y71-V74 PolarHBondContact O-N 3.34Å; Y71-K75 HydrophobicContact CE1-CD 4.24Å; Y71-K75 WeakPolarHBondContact O-CB 3.38Å; Y71-K75 PolarHBondContact O-N 2.82Å |
| 72 | E | 97.8 | Very high | 95.6 | Very high | 70 Ų | 70 | 103.7 Ų | 103.7 | 33% | 0.327 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -63.5 | -38.2 | 178.2 | -75.2 | -61.9 | 145.2 | 0 | 0 | 111.8 | F68 T69 K75 A76 | F68-E72 HydrophobicContact CD1-CG 4.36Å; F68-E72 HydrophobicContact CE1-CG 3.81Å; F68-E72 HydrophobicContact CE2-CG 4.25Å; F68-E72 HydrophobicContact CZ-CG 3.74Å; F68-E72 PolarHBondContact O-N 3.32Å; T69-E72 PolarHBondContact O-N 3.44Å; E72-K75 PolarHBondContact O-N 2.89Å; E72-K75 IonicContact OE1-NZ 2.78Å; E72-A76 WeakPolarHBondContact O-CB 3.24Å; E72-A76 PolarHBondContact O-N 3.42Å |
| 73 | L | 98.3 | Very high | 93.9 | Very high | 101 Ų | 101 | 111.6 Ų | 111.6 | 53% | 0.529 | 60% | 0.598 | S | S | . | * | H | α-helix | trans | -61.9 | -47 | 175.8 | 179.8 | 64.2 | 0 | 0 | 0 | 111.6 | T69 L70 Y71 A76 S77 | T69-L73 WeakPolarHBondContact O-CB 3.35Å; T69-L73 PolarHBondContact O-N 3Å; L70-L73 PolarHBondContact O-N 2.81Å; Y71-L73 VanDerWaalsContact C-N 3.32Å; Y71-L73 PolarHBondContact O-N 2.92Å; L73-A76 PolarHBondContact O-N 3.21Å; L73-S77 WeakPolarHBondContact O-CB 3.46Å; L73-S77 PolarHBondContact O-N 3.36Å; L73-S77 PolarHBondContact O-OG 3.3Å |
| 74 | V | 97.8 | Very high | 93.7 | Very high | 84 Ų | 84 | 112.5 Ų | 112.5 | 51% | 0.509 | 60% | 0.599 | S | S | . | * | H | α-helix | trans | -63 | -47 | 177.5 | 169.9 | 0 | 0 | 0 | 0 | 110.2 | L70 Y71 A76 S77 F78 | L70-V74 WeakPolarHBondContact O-CG2 3.44Å; L70-V74 PolarHBondContact O-N 3.06Å; Y71-V74 PolarHBondContact O-N 3.34Å; V74-A76 VanDerWaalsContact C-N 3.31Å; V74-A76 PolarHBondContact O-N 2.87Å; V74-S77 WeakPolarHBondContact O-CB 3.37Å; V74-S77 PolarHBondContact O-N 3.48Å; V74-S77 VanDerWaalsContact O-N 3.12Å; V74-F78 HydrophobicContact CG1-CD2 4.45Å; V74-F78 HydrophobicContact CG1-CE2 4.25Å; V74-F78 WeakPolarHBondContact O-CD2 3.32Å |
| 75 | K | 96.4 | Very high | 93.4 | Very high | 82 Ų | 82 | 112.2 Ų | 112.2 | 36% | 0.357 | 60% | 0.598 | S | S | . | * | H | α-helix | trans | -57.2 | -44.6 | 176.5 | -178.1 | -176.9 | 171.4 | -166.8 | 0 | 111.6 | Y71 E72 S77 Q80 | Y71-K75 HydrophobicContact CE1-CD 4.24Å; Y71-K75 WeakPolarHBondContact O-CB 3.38Å; Y71-K75 PolarHBondContact O-N 2.82Å; E72-K75 PolarHBondContact O-N 2.89Å; E72-K75 IonicContact OE1-NZ 2.78Å; K75-S77 VanDerWaalsContact C-N 3.31Å; K75-S77 PolarHBondContact O-N 2.94Å; K75-Q80 PolarHBondContact O-NE2 3.45Å |
| 76 | A | 96 | Very high | 93.1 | Very high | 80 Ų | 80 | 116.6 Ų | 116.6 | 66% | 0.661 | 61% | 0.613 | S | S | * | * | H | α-helix | trans | -70.1 | -25.7 | 178.6 | 0 | 0 | 0 | 0 | 0 | 113.5 | E72 L73 V74 F78 | E72-A76 WeakPolarHBondContact O-CB 3.24Å; E72-A76 PolarHBondContact O-N 3.42Å; L73-A76 PolarHBondContact O-N 3.21Å; V74-A76 VanDerWaalsContact C-N 3.31Å; V74-A76 PolarHBondContact O-N 2.87Å; A76-F78 VanDerWaalsContact C-N 3.25Å; A76-F78 PolarHBondContact O-N 3.08Å |
| 77 | S | 97.2 | Very high | 92.8 | Very high | 81 Ų | 81 | 118.4 Ų | 118.4 | 57% | 0.566 | 62% | 0.618 | S | S | * | * | H | α-helix | trans | -71.6 | -18.4 | -179.4 | -61.7 | 0 | 0 | 0 | 0 | 113.4 | L73 V74 K75 | L73-S77 WeakPolarHBondContact O-CB 3.46Å; L73-S77 PolarHBondContact O-N 3.36Å; L73-S77 PolarHBondContact O-OG 3.3Å; V74-S77 WeakPolarHBondContact O-CB 3.37Å; V74-S77 PolarHBondContact O-N 3.48Å; V74-S77 VanDerWaalsContact O-N 3.12Å; K75-S77 VanDerWaalsContact C-N 3.31Å; K75-S77 PolarHBondContact O-N 2.94Å |
| 78 | F | 95.4 | Very high | 92.4 | Very high | 138 Ų | 138 | 123.4 Ų | 123.4 | 61% | 0.605 | 63% | 0.632 | S | S | * | * | S | Bend | trans | -112.9 | 142.8 | 178.5 | -65.4 | -77 | 0 | 0 | 0 | 111.7 | V74 A76 Q80 | V74-F78 HydrophobicContact CG1-CD2 4.45Å; V74-F78 HydrophobicContact CG1-CE2 4.25Å; V74-F78 WeakPolarHBondContact O-CD2 3.32Å; A76-F78 VanDerWaalsContact C-N 3.25Å; A76-F78 PolarHBondContact O-N 3.08Å; F78-Q80 PolarHBondContact O-N 3.06Å; F78-Q80 PolarHBondContact O-NE2 3.44Å; F78-Q80 VanDerWaalsContact O-NE2 3.15Å |
| 79 | P | 93.6 | Very high | 92 | Very high | 124 Ų | 124 | 122.9 Ų | 122.9 | 81% | 0.805 | 64% | 0.636 | S | S | * | * | P | Polyproline II helix | trans | -61.4 | 123.2 | 178.4 | 25.9 | -33.6 | 0 | 0 | 0 | 110 | ||
| 80 | Q | 88.1 | Confident | 91.5 | Very high | 114 Ų | 114 | 125.1 Ų | 125.1 | 53% | 0.533 | 64% | 0.641 | S | S | . | * | P | Polyproline II helix | trans | -78.9 | 134.1 | 173.9 | -57.7 | -61.6 | -66 | 0 | 0 | 108.5 | K75 F78 K82 | K75-Q80 PolarHBondContact O-NE2 3.45Å; F78-Q80 PolarHBondContact O-N 3.06Å; F78-Q80 PolarHBondContact O-NE2 3.44Å; F78-Q80 VanDerWaalsContact O-NE2 3.15Å; Q80-K82 PolarHBondContact O-N 3.05Å |
| 81 | K | 84.7 | Confident | 91 | Very high | 200 Ų | 200 | 127 Ų | 127 | 87% | 0.87 | 65% | 0.649 | S | S | * | * | P | Polyproline II helix | trans | -61.3 | 130.8 | 171.6 | -66.2 | -174.8 | 179.6 | -177.3 | 0 | 108 | ||
| 82 | K | 75.5 | Confident | 90.4 | Very high | 203 Ų | 203 | 125.8 Ų | 125.8 | 88% | 0.883 | 66% | 0.658 | S | S | * | * | P | Polyproline II helix | trans | -87.3 | 120.6 | 165.4 | -66.8 | 179.4 | 179.4 | 178.5 | 0 | 105.8 | Q80 | Q80-K82 PolarHBondContact O-N 3.05Š|
| 83 | D | 63.7 | Low | 89.7 | Confident | 233 Ų | 233 | 130.9 Ų | 130.9 | 100% | 1.246 | 69% | 0.688 | S | S | * | * | trans | -66.8 | 0 | 159.1 | -65.9 | -38.9 | 0 | 0 | 0 | 109.2 |
Retrieved 83 of 83 residues in 83.9 ms
(Link to these results)