| 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 | 42.7 | Very low | 42.7 | Very low | 239 Ų | 239 | 147 Ų | 147 | 100% | 1.177 | 79% | 0.791 | S | S | * | * | 0 | 123.7 | 0 | -70.4 | 161.6 | -165.4 | 0 | 0 | 105.2 | |||||
| 2 | S | 32.7 | Very low | 42.9 | Very low | 120 Ų | 120 | 139.3 Ų | 139.3 | 84% | 0.839 | 77% | 0.772 | S | S | * | * | -165.1 | 141.9 | 56.8 | -60.5 | 0 | 0 | 0 | 0 | 112.3 | |||||
| 3 | V | 55.9 | Low | 43 | Very low | 142 Ų | 142 | 145.8 Ų | 145.8 | 86% | 0.861 | 79% | 0.787 | S | S | * | * | trans | -62.7 | 148.6 | 167.1 | -67.4 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 4 | A | 37.7 | Very low | 43.7 | Very low | 57 Ų | 57 | 139.1 Ų | 139.1 | 47% | 0.471 | 77% | 0.77 | S | S | . | * | trans | 168.2 | 121 | 160.7 | 0 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 5 | F | 37.1 | Very low | 44 | Very low | 181 Ų | 181 | 141.7 Ų | 141.7 | 79% | 0.794 | 77% | 0.774 | S | S | * | * | cis | -156 | 125.2 | 0.6 | -92.1 | -94.2 | 0 | 0 | 0 | 103.8 | A7 | F5-A7 PolarHBondContact O-N 2.88Å; F5-A7 VanDerWaalsContact O-N 3.08Å | ||
| 6 | A | 42.5 | Very low | 44.8 | Very low | 99 Ų | 99 | 140.4 Ų | 140.4 | 82% | 0.818 | 77% | 0.765 | S | S | * | * | trans | -59.4 | 115.2 | 147.6 | 0 | 0 | 0 | 0 | 0 | 104.1 | P8 | A6-P8 WeakPolarHBondContact O-CD 3.31Å; A6-P8 VanDerWaalsContact O-N 3.07Å | ||
| 7 | A | 38.1 | Very low | 46 | Very low | 74 Ų | 74 | 136.2 Ų | 136.2 | 61% | 0.612 | 74% | 0.744 | S | S | * | * | trans | -47.1 | 127.1 | 175.2 | 0 | 0 | 0 | 0 | 0 | 106.4 | F5 R9 | F5-A7 PolarHBondContact O-N 2.88Å; F5-A7 VanDerWaalsContact O-N 3.08Å; A7-R9 PolarHBondContact O-N 2.72Å | ||
| 8 | P | 42.7 | Very low | 47.3 | Very low | 112 Ų | 112 | 134 Ų | 134 | 73% | 0.727 | 74% | 0.738 | S | S | * | * | trans | -64.9 | 83.1 | 163.3 | 27.3 | -29.1 | 0 | 0 | 0 | 104.4 | A6 Q10 | A6-P8 WeakPolarHBondContact O-CD 3.31Å; A6-P8 VanDerWaalsContact O-N 3.07Å; P8-Q10 PolarHBondContact O-N 3.34Å | ||
| 9 | R | 48.5 | Very low | 48.5 | Very low | 180 Ų | 180 | 130.6 Ų | 130.6 | 68% | 0.679 | 73% | 0.73 | S | S | * | * | trans | -59.7 | 98.6 | 162.3 | -102.9 | -173.9 | 78.2 | -121.7 | 8.3 | 102.5 | A7 R11 M24 | A7-R9 PolarHBondContact O-N 2.72Å; R9-R11 VanDerWaalsContact C-N 3.32Å; R9-R11 PolarHBondContact O-N 2.92Å; R9-M24 PolarHBondContact NH1-SD 2.7Å | ||
| 10 | Q | 47.4 | Very low | 49.6 | Very low | 182 Ų | 182 | 126.4 Ų | 126.4 | 85% | 0.85 | 71% | 0.712 | S | S | * | * | trans | 3.4 | 84.9 | 162.1 | -64 | -100.1 | -82.9 | 0 | 0 | 109.9 | P8 G12 | P8-Q10 PolarHBondContact O-N 3.34Å; Q10-G12 PolarHBondContact O-N 3.12Å | ||
| 11 | R | 44 | Very low | 51 | Low | 231 Ų | 231 | 124.2 Ų | 124.2 | 87% | 0.872 | 70% | 0.698 | S | S | * | * | trans | -73.1 | 45.9 | 164 | -164.7 | 177.4 | -175.9 | 172.7 | 1.1 | 107.3 | R9 K13 | R9-R11 VanDerWaalsContact C-N 3.32Å; R9-R11 PolarHBondContact O-N 2.92Å; R11-K13 PolarHBondContact O-N 2.97Å | ||
| 12 | G | 45.1 | Very low | 52.6 | Low | 55 Ų | 55 | 119.5 Ų | 119.5 | 57% | 0.567 | 67% | 0.673 | S | S | * | * | trans | -78.9 | 103.2 | 168.3 | 0 | 0 | 0 | 0 | 0 | 105 | Q10 G14 | Q10-G12 PolarHBondContact O-N 3.12Å; G12-G14 VanDerWaalsContact C-N 3.27Å; G12-G14 PolarHBondContact O-N 3.21Å | ||
| 13 | K | 44.3 | Very low | 54.4 | Low | 223 Ų | 223 | 120.6 Ų | 120.6 | 97% | 0.97 | 66% | 0.663 | S | S | * | * | S | Bend | trans | 26.1 | 63.6 | 148.7 | -79.1 | 166.3 | 149.5 | 177 | 0 | 114.2 | R11 | R11-K13 PolarHBondContact O-N 2.97Š|
| 14 | G | 52.8 | Low | 55.2 | Low | 53 Ų | 53 | 118 Ų | 118 | 55% | 0.546 | 64% | 0.642 | S | S | . | * | trans | -128.1 | 119.4 | 169.3 | 0 | 0 | 0 | 0 | 0 | 103.9 | G12 I16 | G12-G14 VanDerWaalsContact C-N 3.27Å; G12-G14 PolarHBondContact O-N 3.21Å; G14-I16 PolarHBondContact O-N 3.28Å; G14-I16 VanDerWaalsContact O-N 3.08Å | ||
| 15 | E | 47.9 | Very low | 57.2 | Low | 178 Ų | 178 | 119.6 Ų | 119.6 | 83% | 0.832 | 64% | 0.642 | S | S | * | * | trans | -42.8 | 121.5 | 178.4 | -65.5 | 178.3 | 95.3 | 0 | 0 | 108.9 | T17 | E15-T17 PolarHBondContact O-N 3.47Å; E15-T17 PolarHBondContact O-OG1 2.97Å | ||
| 16 | I | 58 | Low | 59.1 | Low | 121 Ų | 121 | 116.2 Ų | 116.2 | 62% | 0.621 | 63% | 0.632 | S | S | * | * | trans | -74.8 | 74.6 | 175.7 | -57.9 | 173 | 0 | 0 | 0 | 105.2 | G14 I21 | G14-I16 PolarHBondContact O-N 3.28Å; G14-I16 VanDerWaalsContact O-N 3.08Å; I16-I21 HydrophobicContact CG2-CD1 3.73Å; I16-I21 HydrophobicContact CG2-CG1 3.8Å | ||
| 17 | T | 64.6 | Low | 60.8 | Low | 68 Ų | 68 | 115.3 Ų | 115.3 | 42% | 0.417 | 61% | 0.614 | S | S | . | * | trans | -75.7 | 140.5 | 178.7 | -34.1 | 0 | 0 | 0 | 0 | 107.3 | E15 A19 A20 I21 | E15-T17 PolarHBondContact O-N 3.47Å; E15-T17 PolarHBondContact O-OG1 2.97Å; T17-A19 HydrophobicContact CG2-CB 4.46Å; T17-A19 PolarHBondContact O-N 3.41Å; T17-A20 WeakPolarHBondContact O-CB 3.42Å; T17-A20 PolarHBondContact O-N 2.9Å; T17-I21 PolarHBondContact O-N 3.4Å | ||
| 18 | P | 69 | Low | 62.7 | Low | 97 Ų | 97 | 115.9 Ų | 115.9 | 63% | 0.63 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -52.4 | -30.1 | 176.1 | 17.2 | -31.3 | 0 | 0 | 0 | 113.2 | I21 Q22 | P18-I21 PolarHBondContact O-N 3.31Å; P18-Q22 VanDerWaalsContact O-CG 3.3Å; P18-Q22 WeakPolarHBondContact O-CG 3.46Å; P18-Q22 PolarHBondContact O-N 3.2Å |
| 19 | A | 71.1 | Confident | 64.4 | Low | 70 Ų | 70 | 115.5 Ų | 115.5 | 58% | 0.579 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -63.5 | -37.9 | 173 | 0 | 0 | 0 | 0 | 0 | 113.8 | T17 K23 | T17-A19 HydrophobicContact CG2-CB 4.46Å; T17-A19 PolarHBondContact O-N 3.41Å; A19-K23 PolarHBondContact O-N 3.12Å; A19-K23 VanDerWaalsContact O-N 3.11Å |
| 20 | A | 70.8 | Confident | 65.7 | Low | 46 Ų | 46 | 113.7 Ų | 113.7 | 38% | 0.38 | 60% | 0.597 | S | S | . | * | H | α-helix | trans | -72.7 | -35.5 | 177.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | T17 K23 M24 | T17-A20 WeakPolarHBondContact O-CB 3.42Å; T17-A20 PolarHBondContact O-N 2.9Å; A20-K23 PolarHBondContact O-N 2.94Å; A20-M24 WeakPolarHBondContact O-CG 3.35Å; A20-M24 PolarHBondContact O-N 3.37Å; A20-M24 VanDerWaalsContact O-N 3.09Å |
| 21 | I | 77.4 | Confident | 66.9 | Low | 81 Ų | 81 | 107 Ų | 107 | 42% | 0.415 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -64.1 | -46.1 | 173.2 | -58.3 | 175.6 | 0 | 0 | 0 | 110.1 | I16 T17 P18 K23 M24 L25 | I16-I21 HydrophobicContact CG2-CD1 3.73Å; I16-I21 HydrophobicContact CG2-CG1 3.8Å; T17-I21 PolarHBondContact O-N 3.4Å; P18-I21 PolarHBondContact O-N 3.31Å; I21-K23 VanDerWaalsContact C-N 3.32Å; I21-K23 PolarHBondContact O-N 3.01Å; I21-M24 PolarHBondContact O-N 2.95Å; I21-M24 VanDerWaalsContact O-N 3.14Å; I21-L25 HydrophobicContact CG2-CD1 4.08Å; I21-L25 HydrophobicContact CG2-CG 4.4Å; I21-L25 WeakPolarHBondContact O-CG 3.46Å; I21-L25 PolarHBondContact O-N 3.12Å |
| 22 | Q | 76.5 | Confident | 68.6 | Low | 140 Ų | 140 | 100.3 Ų | 100.3 | 65% | 0.654 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -57.6 | -44.6 | 177.1 | -75.7 | -109.5 | -62.7 | 0 | 0 | 111.7 | P18 M24 L25 D26 | P18-Q22 VanDerWaalsContact O-CG 3.3Å; P18-Q22 WeakPolarHBondContact O-CG 3.46Å; P18-Q22 PolarHBondContact O-N 3.2Å; Q22-M24 VanDerWaalsContact C-N 3.34Å; Q22-M24 PolarHBondContact O-N 3.49Å; Q22-L25 PolarHBondContact O-N 3.17Å; Q22-L25 VanDerWaalsContact O-N 3.16Å; Q22-D26 PolarHBondContact O-N 3.37Å |
| 23 | K | 71.5 | Confident | 69.9 | Low | 143 Ų | 143 | 103.5 Ų | 103.5 | 62% | 0.622 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -60.4 | -41.9 | 175.4 | -172.8 | 176.1 | 177.9 | 176.4 | 0 | 112.4 | A19 A20 I21 L25 D26 D27 | A19-K23 PolarHBondContact O-N 3.12Å; A19-K23 VanDerWaalsContact O-N 3.11Å; A20-K23 PolarHBondContact O-N 2.94Å; I21-K23 VanDerWaalsContact C-N 3.32Å; I21-K23 PolarHBondContact O-N 3.01Å; K23-L25 VanDerWaalsContact C-N 3.33Å; K23-L25 PolarHBondContact O-N 3.41Å; K23-D26 PolarHBondContact O-N 3.44Å; K23-D27 WeakPolarHBondContact O-CB 3.32Å; K23-D27 PolarHBondContact O-N 3.12Å |
| 24 | M | 73 | Confident | 71.2 | Confident | 88 Ų | 88 | 95.3 Ų | 95.3 | 43% | 0.433 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -66.4 | -33.7 | 175.8 | -71.8 | 177.9 | 61.4 | 0 | 0 | 113 | R9 A20 I21 Q22 N28 | R9-M24 PolarHBondContact NH1-SD 2.7Å; A20-M24 WeakPolarHBondContact O-CG 3.35Å; A20-M24 PolarHBondContact O-N 3.37Å; A20-M24 VanDerWaalsContact O-N 3.09Å; I21-M24 PolarHBondContact O-N 2.95Å; I21-M24 VanDerWaalsContact O-N 3.14Å; Q22-M24 VanDerWaalsContact C-N 3.34Å; Q22-M24 PolarHBondContact O-N 3.49Å; M24-N28 WeakPolarHBondContact O-CB 3.48Å; M24-N28 VanDerWaalsContact O-CG 3.26Å; M24-N28 PolarHBondContact O-N 3.17Å; M24-N28 VanDerWaalsContact O-N 3.13Å; M24-N28 PolarHBondContact O-ND2 3.45Å |
| 25 | L | 78.7 | Confident | 72.2 | Confident | 90 Ų | 90 | 93.9 Ų | 93.9 | 47% | 0.471 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -71.4 | -37.4 | 175.5 | -71.9 | 171.4 | 0 | 0 | 0 | 112 | I21 Q22 K23 N28 N29 | I21-L25 HydrophobicContact CG2-CD1 4.08Å; I21-L25 HydrophobicContact CG2-CG 4.4Å; I21-L25 WeakPolarHBondContact O-CG 3.46Å; I21-L25 PolarHBondContact O-N 3.12Å; Q22-L25 PolarHBondContact O-N 3.17Å; Q22-L25 VanDerWaalsContact O-N 3.16Å; K23-L25 VanDerWaalsContact C-N 3.33Å; K23-L25 PolarHBondContact O-N 3.41Å; L25-N28 PolarHBondContact O-N 3.33Å; L25-N29 PolarHBondContact O-N 3.23Å; L25-N29 PolarHBondContact O-ND2 3.26Å; L25-N29 VanDerWaalsContact O-ND2 3.09Å |
| 26 | D | 78.1 | Confident | 73.4 | Confident | 109 Ų | 109 | 90.5 Ų | 90.5 | 58% | 0.583 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -65.7 | -48.6 | 175.1 | -170.6 | -109.4 | 0 | 0 | 0 | 111.3 | Q22 K23 N28 N29 H30 | Q22-D26 PolarHBondContact O-N 3.37Å; K23-D26 PolarHBondContact O-N 3.44Å; D26-N28 VanDerWaalsContact C-N 3.25Å; D26-N28 PolarHBondContact O-N 3.41Å; D26-N29 PolarHBondContact O-N 2.93Å; D26-N29 VanDerWaalsContact O-N 3.09Å; D26-H30 PolarHBondContact O-N 3.32Å |
| 27 | D | 77.5 | Confident | 73.8 | Confident | 80 Ų | 80 | 88.3 Ų | 88.3 | 43% | 0.428 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -54.8 | -42.8 | 174.3 | -74.9 | -14.9 | 0 | 0 | 0 | 110.9 | K23 L31 | K23-D27 WeakPolarHBondContact O-CB 3.32Å; K23-D27 PolarHBondContact O-N 3.12Å; D27-L31 WeakPolarHBondContact O-CB 3.44Å; D27-L31 WeakPolarHBondContact O-CD1 3.24Å; D27-L31 WeakPolarHBondContact O-CG 3.49Å; D27-L31 PolarHBondContact O-N 2.94Å |
| 28 | N | 78.4 | Confident | 73.7 | Confident | 87 Ų | 87 | 86 Ų | 86 | 47% | 0.465 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -65.2 | -43.9 | 176.7 | -78.9 | -27.4 | 0 | 0 | 0 | 112.9 | M24 L25 D26 H30 L31 I32 | M24-N28 WeakPolarHBondContact O-CB 3.48Å; M24-N28 VanDerWaalsContact O-CG 3.26Å; M24-N28 PolarHBondContact O-N 3.17Å; M24-N28 VanDerWaalsContact O-N 3.13Å; M24-N28 PolarHBondContact O-ND2 3.45Å; L25-N28 PolarHBondContact O-N 3.33Å; D26-N28 VanDerWaalsContact C-N 3.25Å; D26-N28 PolarHBondContact O-N 3.41Å; N28-H30 VanDerWaalsContact C-N 3.33Å; N28-H30 PolarHBondContact O-N 2.62Å; N28-L31 PolarHBondContact O-N 2.94Å; N28-I32 WeakPolarHBondContact O-CD1 3.23Å; N28-I32 VanDerWaalsContact O-CG1 3.24Å; N28-I32 WeakPolarHBondContact O-CG1 3.22Å; N28-I32 PolarHBondContact O-N 2.95Å |
| 29 | N | 76.9 | Confident | 73.1 | Confident | 103 Ų | 103 | 84.8 Ų | 84.8 | 55% | 0.551 | 45% | 0.446 | S | S | * | . | H | α-helix | trans | -62.3 | -43.4 | 178 | -87 | -58.5 | 0 | 0 | 0 | 111.5 | L25 D26 I32 Q33 | L25-N29 PolarHBondContact O-N 3.23Å; L25-N29 PolarHBondContact O-ND2 3.26Å; L25-N29 VanDerWaalsContact O-ND2 3.09Å; D26-N29 PolarHBondContact O-N 2.93Å; D26-N29 VanDerWaalsContact O-N 3.09Å; N29-I32 PolarHBondContact O-N 3.4Å; N29-Q33 WeakPolarHBondContact O-CG 3.43Å; N29-Q33 PolarHBondContact O-N 3.5Å; N29-Q33 VanDerWaalsContact O-N 3.12Å |
| 30 | H | 77.1 | Confident | 72.7 | Confident | 142 Ų | 142 | 88.1 Ų | 88.1 | 66% | 0.657 | 45% | 0.453 | S | S | * | . | H | α-helix | trans | -65.5 | -39.6 | 177.6 | -168.8 | -123.9 | 0 | 0 | 0 | 111.9 | D26 N28 Q33 C34 | D26-H30 PolarHBondContact O-N 3.32Å; N28-H30 VanDerWaalsContact C-N 3.33Å; N28-H30 PolarHBondContact O-N 2.62Å; H30-Q33 PolarHBondContact O-N 3.13Å; H30-C34 WeakPolarHBondContact O-CB 3.16Å; H30-C34 PolarHBondContact O-N 3.44Å |
| 31 | L | 72.1 | Confident | 72.1 | Confident | 41 Ų | 41 | 92 Ų | 92 | 22% | 0.215 | 46% | 0.462 | C | S | . | . | H | α-helix | trans | -62.2 | -46.9 | 174.4 | -76.1 | 167.2 | 0 | 0 | 0 | 112 | D27 N28 Q33 C34 I35 H50 | D27-L31 WeakPolarHBondContact O-CB 3.44Å; D27-L31 WeakPolarHBondContact O-CD1 3.24Å; D27-L31 WeakPolarHBondContact O-CG 3.49Å; D27-L31 PolarHBondContact O-N 2.94Å; N28-L31 PolarHBondContact O-N 2.94Å; L31-Q33 VanDerWaalsContact C-N 3.3Å; L31-Q33 PolarHBondContact O-N 2.96Å; L31-C34 WeakPolarHBondContact O-CB 3.35Å; L31-C34 PolarHBondContact O-N 2.94Å; L31-C34 VanDerWaalsContact O-N 3.17Å; L31-I35 VanDerWaalsContact O-CD1 3.22Å; L31-I35 WeakPolarHBondContact O-CD1 3.37Å; L31-I35 VanDerWaalsContact O-CG1 3.23Å; L31-I35 WeakPolarHBondContact O-CG1 3.45Å; L31-I35 PolarHBondContact O-N 3.09Å; L31-H50 HydrophobicContact CD2-CB 4.11Å |
| 32 | I | 79.5 | Confident | 71 | Confident | 91 Ų | 91 | 91.1 Ų | 91.1 | 47% | 0.467 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -57.9 | -43.9 | 178.3 | -68.8 | 162.8 | 0 | 0 | 0 | 110.8 | N28 N29 I35 M36 | N28-I32 WeakPolarHBondContact O-CD1 3.23Å; N28-I32 VanDerWaalsContact O-CG1 3.24Å; N28-I32 WeakPolarHBondContact O-CG1 3.22Å; N28-I32 PolarHBondContact O-N 2.95Å; N29-I32 PolarHBondContact O-N 3.4Å; I32-I35 PolarHBondContact O-N 3.01Å; I32-M36 WeakPolarHBondContact O-CB 3.49Å; I32-M36 PolarHBondContact O-N 3.34Å |
| 33 | Q | 72.3 | Confident | 69.7 | Low | 122 Ų | 122 | 91.7 Ų | 91.7 | 57% | 0.57 | 47% | 0.473 | S | S | * | . | H | α-helix | trans | -62.5 | -44.1 | 176.4 | -73.7 | -65.1 | -45.6 | 0 | 0 | 112.2 | N29 H30 L31 I35 M36 D37 | N29-Q33 WeakPolarHBondContact O-CG 3.43Å; N29-Q33 PolarHBondContact O-N 3.5Å; N29-Q33 VanDerWaalsContact O-N 3.12Å; H30-Q33 PolarHBondContact O-N 3.13Å; L31-Q33 VanDerWaalsContact C-N 3.3Å; L31-Q33 PolarHBondContact O-N 2.96Å; Q33-I35 VanDerWaalsContact C-N 3.34Å; Q33-I35 PolarHBondContact O-N 3.15Å; Q33-M36 PolarHBondContact O-N 3.42Å; Q33-D37 WeakPolarHBondContact O-CB 3.24Å; Q33-D37 PolarHBondContact O-N 2.98Å |
| 34 | C | 71.6 | Confident | 68.8 | Low | 51 Ų | 51 | 89.5 Ų | 89.5 | 35% | 0.345 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -61.9 | -41 | 177.2 | -175.8 | 0 | 0 | 0 | 0 | 112.2 | H30 L31 S38 | H30-C34 WeakPolarHBondContact O-CB 3.16Å; H30-C34 PolarHBondContact O-N 3.44Å; L31-C34 WeakPolarHBondContact O-CB 3.35Å; L31-C34 PolarHBondContact O-N 2.94Å; L31-C34 VanDerWaalsContact O-N 3.17Å; C34-S38 WeakPolarHBondContact O-CB 3.4Å; C34-S38 PolarHBondContact O-N 3.09Å; C34-S38 PolarHBondContact O-OG 3.09Å |
| 35 | I | 73.7 | Confident | 67.6 | Low | 23 Ų | 23 | 89.4 Ų | 89.4 | 12% | 0.118 | 48% | 0.48 | C | S | . | . | H | α-helix | trans | -67.2 | -43 | 177.3 | -63.9 | 151.4 | 0 | 0 | 0 | 111 | L31 I32 Q33 S38 Q39 I54 V58 | L31-I35 VanDerWaalsContact O-CD1 3.22Å; L31-I35 WeakPolarHBondContact O-CD1 3.37Å; L31-I35 VanDerWaalsContact O-CG1 3.23Å; L31-I35 WeakPolarHBondContact O-CG1 3.45Å; L31-I35 PolarHBondContact O-N 3.09Å; I32-I35 PolarHBondContact O-N 3.01Å; Q33-I35 VanDerWaalsContact C-N 3.34Å; Q33-I35 PolarHBondContact O-N 3.15Å; I35-S38 PolarHBondContact O-N 3.42Å; I35-Q39 WeakPolarHBondContact O-CG 3.48Å; I35-Q39 PolarHBondContact O-N 3.37Å; I35-I54 HydrophobicContact CD1-CB 4.41Å; I35-I54 HydrophobicContact CD1-CG2 3.27Å; I35-I54 HydrophobicContact CG1-CG2 3.79Å; I35-I54 HydrophobicContact CG2-CG2 4.07Å; I35-V58 HydrophobicContact CG2-CG2 4.12Å |
| 36 | M | 73.1 | Confident | 66.1 | Low | 108 Ų | 108 | 93.4 Ų | 93.4 | 53% | 0.532 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -62.9 | -45 | 178.5 | -170.8 | 178.7 | -63.8 | 0 | 0 | 111.4 | I32 Q33 S38 Q39 N40 | I32-M36 WeakPolarHBondContact O-CB 3.49Å; I32-M36 PolarHBondContact O-N 3.34Å; Q33-M36 PolarHBondContact O-N 3.42Å; M36-S38 VanDerWaalsContact C-N 3.35Å; M36-Q39 PolarHBondContact O-N 3.47Å; M36-N40 VanDerWaalsContact O-CB 3.24Å; M36-N40 WeakPolarHBondContact O-CB 3.47Å; M36-N40 PolarHBondContact O-N 2.91Å |
| 37 | D | 66.9 | Low | 64.6 | Low | 74 Ų | 74 | 90 Ų | 90 | 40% | 0.396 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -64 | -39.7 | 175.3 | -173 | -102.2 | 0 | 0 | 0 | 111.8 | Q33 Q39 N40 K41 | Q33-D37 WeakPolarHBondContact O-CB 3.24Å; Q33-D37 PolarHBondContact O-N 2.98Å; D37-Q39 PolarHBondContact O-N 3.41Å; D37-N40 PolarHBondContact O-N 3.11Å; D37-K41 WeakPolarHBondContact O-CB 3.41Å; D37-K41 WeakPolarHBondContact O-CG 3.44Å; D37-K41 PolarHBondContact O-N 3.16Å; D37-K41 WeakPolarHBondContact OD1-CD 3.47Å; D37-K41 WeakPolarHBondContact OD1-CE 3.43Å; D37-K41 IonicContact OD1-NZ 2.72Å; D37-K41 PolarHBondContact OD1-NZ 2.93Å; D37-K41 VanDerWaalsContact OD2-CE 3.31Å; D37-K41 WeakPolarHBondContact OD2-CE 3.45Å; D37-K41 IonicContact OD2-NZ 2.88Å; D37-K41 PolarHBondContact OD2-NZ 3.19Å |
| 38 | S | 62.3 | Low | 63.1 | Low | 20 Ų | 20 | 90.7 Ų | 90.7 | 14% | 0.14 | 49% | 0.492 | C | S | . | . | H | α-helix | trans | -62.7 | -41 | 177 | -61 | 0 | 0 | 0 | 0 | 112.6 | C34 I35 M36 G42 K43 | C34-S38 WeakPolarHBondContact O-CB 3.4Å; C34-S38 PolarHBondContact O-N 3.09Å; C34-S38 PolarHBondContact O-OG 3.09Å; I35-S38 PolarHBondContact O-N 3.42Å; M36-S38 VanDerWaalsContact C-N 3.35Å; S38-G42 PolarHBondContact O-N 3.14Å; S38-K43 PolarHBondContact O-N 2.81Å |
| 39 | Q | 56 | Low | 61.5 | Low | 72 Ų | 72 | 94.9 Ų | 94.9 | 34% | 0.336 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -73.7 | -41.5 | 176.1 | -76.1 | -165.2 | 95.7 | 0 | 0 | 113.1 | I35 M36 D37 K41 G42 V58 | I35-Q39 WeakPolarHBondContact O-CG 3.48Å; I35-Q39 PolarHBondContact O-N 3.37Å; M36-Q39 PolarHBondContact O-N 3.47Å; D37-Q39 PolarHBondContact O-N 3.41Å; Q39-K41 PolarHBondContact O-N 2.98Å; Q39-G42 PolarHBondContact O-N 2.74Å; Q39-G42 VanDerWaalsContact O-N 3.12Å; Q39-V58 PolarHBondContact OE1-O 3.46Å |
| 40 | N | 62.8 | Low | 60 | Low | 139 Ų | 139 | 94.7 Ų | 94.7 | 74% | 0.743 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -62.3 | -29.8 | 176.8 | -170.5 | 45.1 | 0 | 0 | 0 | 111.7 | M36 D37 | M36-N40 VanDerWaalsContact O-CB 3.24Å; M36-N40 WeakPolarHBondContact O-CB 3.47Å; M36-N40 PolarHBondContact O-N 2.91Å; D37-N40 PolarHBondContact O-N 3.11Å |
| 41 | K | 57.8 | Low | 58.1 | Low | 127 Ų | 127 | 92.6 Ų | 92.6 | 55% | 0.552 | 50% | 0.503 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -91.7 | -3.4 | 176.6 | -72.5 | 172.4 | 179.4 | 156.5 | 0 | 114.6 | D37 Q39 K43 | D37-K41 WeakPolarHBondContact O-CB 3.41Å; D37-K41 WeakPolarHBondContact O-CG 3.44Å; D37-K41 PolarHBondContact O-N 3.16Å; D37-K41 WeakPolarHBondContact OD1-CD 3.47Å; D37-K41 WeakPolarHBondContact OD1-CE 3.43Å; D37-K41 IonicContact OD1-NZ 2.72Å; D37-K41 PolarHBondContact OD1-NZ 2.93Å; D37-K41 VanDerWaalsContact OD2-CE 3.31Å; D37-K41 WeakPolarHBondContact OD2-CE 3.45Å; D37-K41 IonicContact OD2-NZ 2.88Å; D37-K41 PolarHBondContact OD2-NZ 3.19Å; Q39-K41 PolarHBondContact O-N 2.98Å; K41-K43 PolarHBondContact O-N 2.66Å; K41-K43 VanDerWaalsContact O-N 3.12Å |
| 42 | G | 54.9 | Low | 56.9 | Low | 64 Ų | 64 | 98 Ų | 98 | 66% | 0.66 | 53% | 0.527 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 60.1 | 19.1 | 178.9 | 0 | 0 | 0 | 0 | 0 | 115 | S38 Q39 | S38-G42 PolarHBondContact O-N 3.14Å; Q39-G42 PolarHBondContact O-N 2.74Å; Q39-G42 VanDerWaalsContact O-N 3.12Å |
| 43 | K | 49.8 | Very low | 55.3 | Low | 151 Ų | 151 | 101.7 Ų | 101.7 | 66% | 0.657 | 54% | 0.535 | S | S | * | . | trans | -119.8 | 90.6 | -174.4 | -73.1 | -175 | 179.4 | -176.7 | 0 | 110.8 | S38 K41 S45 | S38-K43 PolarHBondContact O-N 2.81Å; K41-K43 PolarHBondContact O-N 2.66Å; K41-K43 VanDerWaalsContact O-N 3.12Å; K43-S45 PolarHBondContact O-N 3.08Å | ||
| 44 | T | 52.9 | Low | 54.3 | Low | 97 Ų | 97 | 100.1 Ų | 100.1 | 60% | 0.595 | 53% | 0.529 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -73 | 52.2 | 173.7 | -39.9 | 0 | 0 | 0 | 0 | 111.8 | C55 | T44-C55 HydrophobicContact CG2-CB 4.13Š|
| 45 | S | 46 | Very low | 53.1 | Low | 86 Ų | 86 | 98.8 Ų | 98.8 | 60% | 0.601 | 52% | 0.52 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -135.4 | 5.2 | -173.5 | 76 | 0 | 0 | 0 | 0 | 117.3 | K43 | K43-S45 PolarHBondContact O-N 3.08Š|
| 46 | E | 48 | Very low | 51.9 | Low | 175 Ų | 175 | 102.3 Ų | 102.3 | 82% | 0.818 | 54% | 0.539 | S | S | * | . | S | Bend | trans | -129.9 | 11.8 | 178.9 | -100.7 | -167.1 | 90.9 | 0 | 0 | 116.5 | S48 | E46-S48 PolarHBondContact O-N 3.18Š|
| 47 | C | 47.4 | Very low | 50.6 | Low | 37 Ų | 37 | 107.6 Ų | 107.6 | 25% | 0.25 | 55% | 0.553 | C | S | . | * | trans | -91.3 | 50.4 | 170 | -142.8 | 0 | 0 | 0 | 0 | 111.2 | H49 | C47-H49 PolarHBondContact O-N 2.75Å; C47-H49 VanDerWaalsContact O-N 3.12Å | ||
| 48 | S | 44.7 | Very low | 49.9 | Very low | 94 Ų | 94 | 107 Ų | 107 | 66% | 0.657 | 55% | 0.552 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74.2 | 3.3 | -172.8 | -54.7 | 0 | 0 | 0 | 0 | 114.8 | E46 | E46-S48 PolarHBondContact O-N 3.18Š|
| 49 | H | 46.3 | Very low | 49.1 | Very low | 175 Ų | 175 | 111.6 Ų | 111.6 | 81% | 0.81 | 58% | 0.575 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -123.8 | -3.9 | -178.7 | -59.7 | 129.6 | 0 | 0 | 0 | 114.8 | C47 | C47-H49 PolarHBondContact O-N 2.75Å; C47-H49 VanDerWaalsContact O-N 3.12Å |
| 50 | H | 44.2 | Very low | 48.2 | Very low | 100 Ų | 100 | 116.3 Ų | 116.3 | 46% | 0.463 | 60% | 0.597 | S | S | . | * | S | Bend | trans | -129.3 | 132.4 | 176.6 | -70.1 | 76.1 | 0 | 0 | 0 | 109 | L31 H52 | L31-H50 HydrophobicContact CD2-CB 4.11Å; H50-H52 PolarHBondContact O-N 3.4Å |
| 51 | P | 38.4 | Very low | 47.3 | Very low | 98 Ų | 98 | 116 Ų | 116 | 64% | 0.636 | 63% | 0.626 | S | S | * | * | trans | -62.8 | 132.7 | -154.2 | 27.1 | -33.9 | 0 | 0 | 0 | 110.1 | R53 I54 | P51-R53 PolarHBondContact O-N 2.85Å; P51-I54 PolarHBondContact O-N 3.03Å | ||
| 52 | H | 45.2 | Very low | 46.8 | Very low | 154 Ų | 154 | 115.5 Ų | 115.5 | 71% | 0.713 | 63% | 0.63 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -30.8 | -2.9 | 167.4 | -173.7 | -108.3 | 0 | 0 | 0 | 118 | H50 | H50-H52 PolarHBondContact O-N 3.4Š|
| 53 | R | 46.5 | Very low | 46.3 | Very low | 168 Ų | 168 | 118.2 Ų | 118.2 | 63% | 0.634 | 63% | 0.628 | S | S | * | * | H | α-helix | trans | -85.7 | -25.2 | -178.6 | -58.8 | -132.8 | 72.6 | 157.4 | 4.2 | 114.7 | P51 | P51-R53 PolarHBondContact O-N 2.85Å |
| 54 | I | 50.9 | Low | 46.1 | Very low | 90 Ų | 90 | 116.3 Ų | 116.3 | 46% | 0.462 | 63% | 0.627 | S | S | . | * | H | α-helix | trans | -84.1 | -41.7 | 179.3 | -78.6 | 164.7 | 0 | 0 | 0 | 112 | I35 P51 L56 W57 V58 | I35-I54 HydrophobicContact CD1-CB 4.41Å; I35-I54 HydrophobicContact CD1-CG2 3.27Å; I35-I54 HydrophobicContact CG1-CG2 3.79Å; I35-I54 HydrophobicContact CG2-CG2 4.07Å; P51-I54 PolarHBondContact O-N 3.03Å; I54-L56 PolarHBondContact O-N 2.79Å; I54-W57 PolarHBondContact O-N 2.81Å; I54-V58 PolarHBondContact O-N 3.08Å |
| 55 | C | 47.9 | Very low | 45.7 | Very low | 23 Ų | 23 | 117.5 Ų | 117.5 | 16% | 0.155 | 63% | 0.628 | C | S | . | * | H | α-helix | trans | -58.3 | -34 | 173.6 | -75.6 | 0 | 0 | 0 | 0 | 112.6 | T44 W57 L59 | T44-C55 HydrophobicContact CG2-CB 4.13Å; C55-W57 VanDerWaalsContact C-N 3.31Å; C55-W57 PolarHBondContact O-N 3.23Å; C55-L59 PolarHBondContact O-N 3.3Å |
| 56 | L | 46.5 | Very low | 45.7 | Very low | 97 Ų | 97 | 119.4 Ų | 119.4 | 51% | 0.508 | 63% | 0.63 | S | S | . | * | H | α-helix | trans | -70 | -27.7 | 176.2 | -144.6 | 78.2 | 0 | 0 | 0 | 112.9 | I54 E60 | I54-L56 PolarHBondContact O-N 2.79Å; L56-E60 WeakPolarHBondContact O-CG 3.3Å |
| 57 | W | 46.8 | Very low | 45.6 | Very low | 218 Ų | 218 | 115.7 Ų | 115.7 | 83% | 0.826 | 62% | 0.618 | S | S | * | * | H | α-helix | trans | -78.2 | -21.6 | -178.2 | -128.7 | 81 | 0 | 0 | 0 | 113.3 | I54 C55 | I54-W57 PolarHBondContact O-N 2.81Å; C55-W57 VanDerWaalsContact C-N 3.31Å; C55-W57 PolarHBondContact O-N 3.23Å |
| 58 | V | 52.2 | Low | 45.4 | Very low | 63 Ų | 63 | 121.4 Ų | 121.4 | 38% | 0.382 | 64% | 0.644 | S | S | . | * | H | α-helix | trans | -101.7 | -17.3 | -178 | -148.9 | 0 | 0 | 0 | 0 | 113.8 | I35 Q39 I54 | I35-V58 HydrophobicContact CG2-CG2 4.12Å; Q39-V58 PolarHBondContact OE1-O 3.46Å; I54-V58 PolarHBondContact O-N 3.08Å |
| 59 | L | 45.3 | Very low | 45.5 | Very low | 116 Ų | 116 | 123.5 Ų | 123.5 | 61% | 0.607 | 64% | 0.643 | S | S | * | * | H | α-helix | trans | -76.7 | -22.2 | 167.2 | -103.2 | 85.9 | 0 | 0 | 0 | 113.9 | C55 | C55-L59 PolarHBondContact O-N 3.3Å |
| 60 | E | 38.3 | Very low | 45.4 | Very low | 171 Ų | 171 | 119.2 Ų | 119.2 | 80% | 0.799 | 63% | 0.629 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -98.5 | 26.3 | -176.4 | -67.1 | -82.7 | 128.2 | 0 | 0 | 112.6 | L56 | L56-E60 WeakPolarHBondContact O-CG 3.3Š|
| 61 | G | 42.9 | Very low | 45.5 | Very low | 132 Ų | 132 | 120.9 Ų | 120.9 | 100% | 1.361 | 64% | 0.644 | S | S | * | * | trans | -111.9 | 0 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.2 |
Retrieved 61 of 61 residues in 39.7 ms
(Link to these results)