| 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 | 41.3 | Very low | 50.8 | Low | 249 Ų | 249 | 127.5 Ų | 127.5 | 100% | 1.227 | 74% | 0.736 | S | S | * | * | 0 | 105.3 | 0 | -83.1 | 176.5 | 171.2 | 0 | 0 | 108.7 | A3 | M1-A3 PolarHBondContact O-N 3.09Š| |||
| 2 | T | 40.3 | Very low | 51.1 | Low | 146 Ų | 146 | 121.5 Ų | 121.5 | 90% | 0.896 | 70% | 0.704 | S | S | * | * | trans | -84.1 | 107.2 | 175.9 | 26.8 | 0 | 0 | 0 | 0 | 109.1 | N4 | T2-N4 PolarHBondContact O-N 3.5Å; T2-N4 VanDerWaalsContact O-N 3.09Å | ||
| 3 | A | 51.5 | Low | 51.2 | Low | 91 Ų | 91 | 117.7 Ų | 117.7 | 75% | 0.752 | 68% | 0.679 | S | S | * | * | trans | -69.8 | 105 | 175.9 | 0 | 0 | 0 | 0 | 0 | 109.5 | M1 K5 | M1-A3 PolarHBondContact O-N 3.09Å; A3-K5 PolarHBondContact O-N 3.01Å | ||
| 4 | N | 44 | Very low | 51.1 | Low | 145 Ų | 145 | 122.9 Ų | 122.9 | 78% | 0.775 | 68% | 0.682 | S | S | * | * | trans | -67.9 | 97 | 177.3 | -152 | -6.3 | 0 | 0 | 0 | 108.8 | T2 Q6 | T2-N4 PolarHBondContact O-N 3.5Å; T2-N4 VanDerWaalsContact O-N 3.09Å; N4-Q6 PolarHBondContact O-N 2.86Å | ||
| 5 | K | 49.1 | Very low | 51.2 | Low | 196 Ų | 196 | 124 Ų | 124 | 85% | 0.852 | 68% | 0.68 | S | S | * | * | trans | -76.6 | 71.4 | 175.7 | -67.1 | -176.2 | -177.5 | 178.3 | 0 | 109.3 | A3 | A3-K5 PolarHBondContact O-N 3.01Š| ||
| 6 | Q | 59.7 | Low | 51 | Low | 155 Ų | 155 | 123.6 Ų | 123.6 | 72% | 0.724 | 67% | 0.669 | S | S | * | * | P | Polyproline II helix | trans | -63.5 | 132.1 | 167.6 | -81 | -170.7 | -33.8 | 0 | 0 | 109.3 | N4 L8 | N4-Q6 PolarHBondContact O-N 2.86Å; Q6-L8 PolarHBondContact O-N 3.2Å; Q6-L8 VanDerWaalsContact O-N 3.14Å |
| 7 | P | 54.9 | Low | 50.8 | Low | 123 Ų | 123 | 123.6 Ų | 123.6 | 80% | 0.799 | 67% | 0.668 | S | S | * | * | P | Polyproline II helix | trans | -63.9 | 118.6 | 174.7 | 25 | -30.2 | 0 | 0 | 0 | 108.6 | S9 | P7-S9 PolarHBondContact O-N 3.49Å; P7-S9 VanDerWaalsContact O-N 3.14Å |
| 8 | L | 53.4 | Low | 50.7 | Low | 94 Ų | 94 | 125.5 Ų | 125.5 | 49% | 0.492 | 67% | 0.669 | S | S | . | * | P | Polyproline II helix | trans | -55.9 | 119.4 | 172.2 | -77.8 | 156.9 | 0 | 0 | 0 | 108.5 | Q6 A10 T12 | Q6-L8 PolarHBondContact O-N 3.2Å; Q6-L8 VanDerWaalsContact O-N 3.14Å; L8-A10 PolarHBondContact O-N 3.14Å; L8-T12 HydrophobicContact CD2-CG2 4.06Å |
| 9 | S | 54.9 | Low | 50.7 | Low | 74 Ų | 74 | 123.4 Ų | 123.4 | 52% | 0.517 | 66% | 0.661 | S | S | . | * | trans | -45.6 | 139.3 | 176 | 170.9 | 0 | 0 | 0 | 0 | 111.2 | P7 A11 T12 N13 | P7-S9 PolarHBondContact O-N 3.49Å; P7-S9 VanDerWaalsContact O-N 3.14Å; S9-A11 PolarHBondContact O-N 2.95Å; S9-T12 WeakPolarHBondContact O-CA 3.42Å; S9-T12 WeakPolarHBondContact O-CB 3.49Å; S9-T12 PolarHBondContact O-N 3Å; S9-N13 PolarHBondContact O-N 3.14Å | ||
| 10 | A | 54.8 | Low | 50.5 | Low | 67 Ų | 67 | 121.2 Ų | 121.2 | 55% | 0.554 | 65% | 0.653 | S | S | * | * | H | α-helix | trans | -53.8 | -27.3 | -178.9 | 0 | 0 | 0 | 0 | 0 | 113.2 | L8 R14 | L8-A10 PolarHBondContact O-N 3.14Å; A10-R14 WeakPolarHBondContact O-CG 3.35Å; A10-R14 PolarHBondContact O-N 2.93Å; A10-R14 VanDerWaalsContact O-N 3.07Å |
| 11 | A | 54.7 | Low | 50.4 | Low | 62 Ų | 62 | 116.6 Ų | 116.6 | 51% | 0.512 | 63% | 0.634 | S | S | . | * | H | α-helix | trans | -65.8 | -42.3 | 173.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | S9 R14 Q15 | S9-A11 PolarHBondContact O-N 2.95Å; A11-R14 PolarHBondContact O-N 3.48Å; A11-Q15 PolarHBondContact O-N 2.94Å |
| 12 | T | 54.6 | Low | 50.7 | Low | 56 Ų | 56 | 110 Ų | 110 | 34% | 0.344 | 60% | 0.602 | S | S | . | * | H | α-helix | trans | -70 | -36.5 | 179.2 | -44.3 | 0 | 0 | 0 | 0 | 111.5 | L8 S9 Q15 K16 | L8-T12 HydrophobicContact CD2-CG2 4.06Å; S9-T12 WeakPolarHBondContact O-CA 3.42Å; S9-T12 WeakPolarHBondContact O-CB 3.49Å; S9-T12 PolarHBondContact O-N 3Å; T12-Q15 PolarHBondContact O-N 3.37Å; T12-K16 PolarHBondContact O-N 3.23Å |
| 13 | N | 52.6 | Low | 51.2 | Low | 72 Ų | 72 | 107.1 Ų | 107.1 | 39% | 0.385 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -67.9 | -39 | 173.4 | -87.7 | -29.3 | 0 | 0 | 0 | 112.3 | S9 K16 L17 | S9-N13 PolarHBondContact O-N 3.14Å; N13-K16 PolarHBondContact O-N 3.4Å; N13-L17 WeakPolarHBondContact O-CB 3.39Å; N13-L17 WeakPolarHBondContact O-CD1 3.46Å; N13-L17 PolarHBondContact O-N 2.94Å |
| 14 | R | 48.8 | Very low | 51.3 | Low | 190 Ų | 190 | 106.9 Ų | 106.9 | 72% | 0.717 | 57% | 0.566 | S | S | * | * | H | α-helix | trans | -65.2 | -37.7 | 174.5 | -76.8 | 177.1 | 178.7 | 166.5 | 0.3 | 112.8 | A10 A11 K18 | A10-R14 WeakPolarHBondContact O-CG 3.35Å; A10-R14 PolarHBondContact O-N 2.93Å; A10-R14 VanDerWaalsContact O-N 3.07Å; A11-R14 PolarHBondContact O-N 3.48Å; R14-K18 WeakPolarHBondContact O-CG 3.49Å; R14-K18 PolarHBondContact O-N 3.06Å |
| 15 | Q | 53.4 | Low | 51.8 | Low | 140 Ų | 140 | 106.7 Ų | 106.7 | 65% | 0.654 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -66.3 | -46.2 | 172.2 | -93.5 | -179.4 | -16.4 | 0 | 0 | 111.7 | A11 T12 L17 K18 T19 | A11-Q15 PolarHBondContact O-N 2.94Å; T12-Q15 PolarHBondContact O-N 3.37Å; Q15-L17 VanDerWaalsContact C-N 3.33Å; Q15-L17 PolarHBondContact O-N 3.07Å; Q15-K18 PolarHBondContact O-N 2.82Å; Q15-T19 PolarHBondContact O-N 3.35Å; Q15-T19 PolarHBondContact O-OG1 2.94Å |
| 16 | K | 48 | Very low | 51.9 | Low | 117 Ų | 117 | 101.8 Ų | 101.8 | 51% | 0.509 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -59.4 | -41.8 | 174.7 | -85.1 | -175.9 | 174.3 | -178.4 | 0 | 112.1 | T12 N13 T19 V20 | T12-K16 PolarHBondContact O-N 3.23Å; N13-K16 PolarHBondContact O-N 3.4Å; K16-T19 PolarHBondContact O-N 3.3Å; K16-V20 WeakPolarHBondContact O-CB 3.4Å; K16-V20 WeakPolarHBondContact O-CG2 3.49Å; K16-V20 PolarHBondContact O-N 3.43Å |
| 17 | L | 47.7 | Very low | 51.5 | Low | 124 Ų | 124 | 101.9 Ų | 101.9 | 65% | 0.649 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -67.1 | -37.2 | 176.3 | -95.9 | 138.3 | 0 | 0 | 0 | 112.9 | N13 Q15 V20 G21 | N13-L17 WeakPolarHBondContact O-CB 3.39Å; N13-L17 WeakPolarHBondContact O-CD1 3.46Å; N13-L17 PolarHBondContact O-N 2.94Å; Q15-L17 VanDerWaalsContact C-N 3.33Å; Q15-L17 PolarHBondContact O-N 3.07Å; L17-V20 PolarHBondContact O-N 2.98Å; L17-G21 PolarHBondContact O-N 2.85Å |
| 18 | K | 49.6 | Very low | 51.4 | Low | 158 Ų | 158 | 100.3 Ų | 100.3 | 69% | 0.687 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -63.4 | -43.4 | 171.3 | -79.9 | -174.9 | 177.2 | -173.7 | 0 | 111.2 | R14 Q15 G21 I22 | R14-K18 WeakPolarHBondContact O-CG 3.49Å; R14-K18 PolarHBondContact O-N 3.06Å; Q15-K18 PolarHBondContact O-N 2.82Å; K18-G21 PolarHBondContact O-N 2.87Å; K18-I22 WeakPolarHBondContact O-CD1 3.47Å; K18-I22 WeakPolarHBondContact O-CG1 3.34Å; K18-I22 PolarHBondContact O-N 3.38Å |
| 19 | T | 50 | Low | 51.3 | Low | 85 Ų | 85 | 99 Ų | 99 | 52% | 0.521 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -66.1 | -38.2 | 177.4 | -50.4 | 0 | 0 | 0 | 0 | 112.1 | Q15 K16 L23 | Q15-T19 PolarHBondContact O-N 3.35Å; Q15-T19 PolarHBondContact O-OG1 2.94Å; K16-T19 PolarHBondContact O-N 3.3Å; T19-L23 WeakPolarHBondContact O-CD1 3.34Å; T19-L23 WeakPolarHBondContact O-CG 3.48Å; T19-L23 PolarHBondContact O-N 3.02Å |
| 20 | V | 47.3 | Very low | 51 | Low | 80 Ų | 80 | 98.8 Ų | 98.8 | 49% | 0.485 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -73.3 | -36.7 | 176.4 | 174.9 | 0 | 0 | 0 | 0 | 111.7 | K16 L17 L23 L24 | K16-V20 WeakPolarHBondContact O-CB 3.4Å; K16-V20 WeakPolarHBondContact O-CG2 3.49Å; K16-V20 PolarHBondContact O-N 3.43Å; L17-V20 PolarHBondContact O-N 2.98Å; V20-L23 WeakPolarHBondContact O-CB 3.24Å; V20-L23 PolarHBondContact O-N 3.41Å; V20-L24 PolarHBondContact O-N 2.79Å |
| 21 | G | 48.1 | Very low | 50.9 | Low | 25 Ų | 25 | 102.6 Ų | 102.6 | 26% | 0.258 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -66.2 | -38.3 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.7 | L17 K18 L23 L24 H25 | L17-G21 PolarHBondContact O-N 2.85Å; K18-G21 PolarHBondContact O-N 2.87Å; G21-L23 VanDerWaalsContact C-N 3.32Å; G21-L23 PolarHBondContact O-N 2.98Å; G21-L24 PolarHBondContact O-N 3.28Å; G21-H25 PolarHBondContact O-CD2 3.34Å; G21-H25 PolarHBondContact O-N 3.42Å |
| 22 | I | 47.6 | Very low | 50.7 | Low | 109 Ų | 109 | 103.7 Ų | 103.7 | 56% | 0.559 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -62.1 | -41.6 | 171.3 | -67.8 | 161.5 | 0 | 0 | 0 | 110.4 | K18 L24 H25 V26 | K18-I22 WeakPolarHBondContact O-CD1 3.47Å; K18-I22 WeakPolarHBondContact O-CG1 3.34Å; K18-I22 PolarHBondContact O-N 3.38Å; I22-L24 VanDerWaalsContact C-N 3.31Å; I22-L24 PolarHBondContact O-N 2.89Å; I22-H25 PolarHBondContact O-N 2.75Å; I22-V26 HydrophobicContact CG2-CG2 4.45Å; I22-V26 VanDerWaalsContact O-CG2 3.25Å; I22-V26 WeakPolarHBondContact O-CG2 3.16Å; I22-V26 PolarHBondContact O-N 2.86Å |
| 23 | L | 51.1 | Low | 50.3 | Low | 86 Ų | 86 | 103.5 Ų | 103.5 | 45% | 0.45 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -63.5 | -33.5 | 176.5 | -81.1 | 158.7 | 0 | 0 | 0 | 113 | T19 V20 G21 R27 | T19-L23 WeakPolarHBondContact O-CD1 3.34Å; T19-L23 WeakPolarHBondContact O-CG 3.48Å; T19-L23 PolarHBondContact O-N 3.02Å; V20-L23 WeakPolarHBondContact O-CB 3.24Å; V20-L23 PolarHBondContact O-N 3.41Å; G21-L23 VanDerWaalsContact C-N 3.32Å; G21-L23 PolarHBondContact O-N 2.98Å; L23-R27 VanDerWaalsContact O-CB 3.32Å; L23-R27 WeakPolarHBondContact O-CB 3.32Å; L23-R27 PolarHBondContact O-N 3.33Å |
| 24 | L | 53.1 | Low | 49.8 | Very low | 86 Ų | 86 | 105.7 Ų | 105.7 | 45% | 0.45 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -68.7 | -46.2 | 175.8 | -72.8 | 169.4 | 0 | 0 | 0 | 112 | V20 G21 I22 V26 R27 D28 | V20-L24 PolarHBondContact O-N 2.79Å; G21-L24 PolarHBondContact O-N 3.28Å; I22-L24 VanDerWaalsContact C-N 3.31Å; I22-L24 PolarHBondContact O-N 2.89Å; L24-V26 VanDerWaalsContact C-N 3.3Å; L24-V26 PolarHBondContact O-N 2.98Å; L24-R27 WeakPolarHBondContact O-CB 3.33Å; L24-R27 PolarHBondContact O-N 3.44Å; L24-R27 VanDerWaalsContact O-N 3.13Å; L24-D28 PolarHBondContact O-N 2.86Å |
| 25 | H | 55 | Low | 49.6 | Very low | 142 Ų | 142 | 101.1 Ų | 101.1 | 66% | 0.657 | 56% | 0.563 | S | S | * | * | H | α-helix | trans | -63.7 | -35.4 | 176.4 | -69.8 | -58.6 | 0 | 0 | 0 | 112.9 | G21 I22 A29 | G21-H25 PolarHBondContact O-CD2 3.34Å; G21-H25 PolarHBondContact O-N 3.42Å; I22-H25 PolarHBondContact O-N 2.75Å; H25-A29 VanDerWaalsContact O-CB 3.25Å; H25-A29 WeakPolarHBondContact O-CB 3.34Å; H25-A29 PolarHBondContact O-N 2.78Å |
| 26 | V | 51.6 | Low | 48.8 | Very low | 93 Ų | 93 | 99.4 Ų | 99.4 | 56% | 0.564 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -69.1 | -37.4 | 174.5 | 174.3 | 0 | 0 | 0 | 0 | 111.1 | I22 L24 A30 | I22-V26 HydrophobicContact CG2-CG2 4.45Å; I22-V26 VanDerWaalsContact O-CG2 3.25Å; I22-V26 WeakPolarHBondContact O-CG2 3.16Å; I22-V26 PolarHBondContact O-N 2.86Å; L24-V26 VanDerWaalsContact C-N 3.3Å; L24-V26 PolarHBondContact O-N 2.98Å; V26-A30 VanDerWaalsContact O-CB 3.31Å; V26-A30 WeakPolarHBondContact O-CB 3.48Å; V26-A30 PolarHBondContact O-N 3.44Å |
| 27 | R | 50.4 | Low | 48.5 | Very low | 156 Ų | 156 | 101.4 Ų | 101.4 | 59% | 0.589 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -65.9 | -42.9 | 174.6 | -174.9 | -175.1 | -176.9 | -171.6 | 1.1 | 111.8 | L23 L24 A30 K31 | L23-R27 VanDerWaalsContact O-CB 3.32Å; L23-R27 WeakPolarHBondContact O-CB 3.32Å; L23-R27 PolarHBondContact O-N 3.33Å; L24-R27 WeakPolarHBondContact O-CB 3.33Å; L24-R27 PolarHBondContact O-N 3.44Å; L24-R27 VanDerWaalsContact O-N 3.13Å; R27-A30 PolarHBondContact O-N 3.44Å; R27-K31 WeakPolarHBondContact O-CB 3.39Å; R27-K31 PolarHBondContact O-N 3.42Å |
| 28 | D | 52.6 | Low | 48.1 | Very low | 91 Ų | 91 | 101.5 Ų | 101.5 | 49% | 0.487 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -70.5 | -38.9 | 179.8 | -69 | -24.1 | 0 | 0 | 0 | 111.4 | L24 A30 K31 A32 | L24-D28 PolarHBondContact O-N 2.86Å; D28-A30 VanDerWaalsContact C-N 3.34Å; D28-A30 PolarHBondContact O-N 2.91Å; D28-K31 PolarHBondContact O-N 3.37Å; D28-A32 WeakPolarHBondContact O-CB 3.47Å; D28-A32 PolarHBondContact O-N 3.23Å |
| 29 | A | 51.4 | Low | 47.8 | Very low | 67 Ų | 67 | 97.4 Ų | 97.4 | 55% | 0.554 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -64.2 | -36.5 | 172.3 | 0 | 0 | 0 | 0 | 0 | 112.6 | H25 | H25-A29 VanDerWaalsContact O-CB 3.25Å; H25-A29 WeakPolarHBondContact O-CB 3.34Å; H25-A29 PolarHBondContact O-N 2.78Å |
| 30 | A | 49.8 | Very low | 47.4 | Very low | 69 Ų | 69 | 98.1 Ų | 98.1 | 57% | 0.57 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -73 | -31.5 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112.8 | V26 R27 D28 | V26-A30 VanDerWaalsContact O-CB 3.31Å; V26-A30 WeakPolarHBondContact O-CB 3.48Å; V26-A30 PolarHBondContact O-N 3.44Å; R27-A30 PolarHBondContact O-N 3.44Å; D28-A30 VanDerWaalsContact C-N 3.34Å; D28-A30 PolarHBondContact O-N 2.91Å |
| 31 | K | 51 | Low | 47 | Very low | 147 Ų | 147 | 98.4 Ų | 98.4 | 64% | 0.639 | 58% | 0.576 | S | S | * | * | H | α-helix | trans | -72.9 | -32.1 | 173.9 | -111.9 | -177.9 | 174.8 | -171.9 | 0 | 112.9 | R27 D28 A33 | R27-K31 WeakPolarHBondContact O-CB 3.39Å; R27-K31 PolarHBondContact O-N 3.42Å; D28-K31 PolarHBondContact O-N 3.37Å; K31-A33 PolarHBondContact O-N 3.32Å |
| 32 | A | 52.2 | Low | 46.8 | Very low | 85 Ų | 85 | 103.9 Ų | 103.9 | 70% | 0.702 | 60% | 0.599 | S | S | * | * | S | Bend | trans | -72.6 | -13.3 | 179.1 | 0 | 0 | 0 | 0 | 0 | 113.6 | D28 | D28-A32 WeakPolarHBondContact O-CB 3.47Å; D28-A32 PolarHBondContact O-N 3.23Å |
| 33 | A | 45.6 | Very low | 46.7 | Very low | 52 Ų | 52 | 104.4 Ų | 104.4 | 43% | 0.43 | 61% | 0.607 | S | S | . | * | trans | -129.2 | 76 | 179.5 | 0 | 0 | 0 | 0 | 0 | 112 | K31 S35 | K31-A33 PolarHBondContact O-N 3.32Å; A33-S35 PolarHBondContact O-N 3.46Å | ||
| 34 | P | 41.4 | Very low | 46.2 | Very low | 118 Ų | 118 | 102.9 Ų | 102.9 | 77% | 0.766 | 60% | 0.603 | S | S | * | * | trans | -80.7 | 6.6 | 180 | 4.9 | 12.4 | 0 | 0 | 0 | 114.3 | ||||
| 35 | S | 43.8 | Very low | 45.7 | Very low | 93 Ų | 93 | 103.4 Ų | 103.4 | 65% | 0.65 | 61% | 0.611 | S | S | * | * | S | Bend | trans | -142.9 | 102.2 | 177.9 | 53.8 | 0 | 0 | 0 | 0 | 112.4 | A33 H37 | A33-S35 PolarHBondContact O-N 3.46Å; S35-H37 PolarHBondContact O-N 3.47Å |
| 36 | S | 37.3 | Very low | 45.3 | Very low | 105 Ų | 105 | 107.5 Ų | 107.5 | 73% | 0.734 | 62% | 0.621 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -4 | 101.3 | 145.5 | 53.2 | 0 | 0 | 0 | 0 | 114.6 | ||
| 37 | H | 42.1 | Very low | 45 | Very low | 158 Ų | 158 | 108.5 Ų | 108.5 | 73% | 0.731 | 62% | 0.615 | S | S | * | * | T | Hydrogen-bonded Turn | -152.4 | 1.8 | 82.6 | -83.9 | -65.9 | 0 | 0 | 0 | 113.8 | S35 | S35-H37 PolarHBondContact O-N 3.47Š| |
| 38 | I | 40 | Very low | 44.7 | Very low | 127 Ų | 127 | 104.7 Ų | 104.7 | 65% | 0.651 | 61% | 0.606 | S | S | * | * | S | Bend | trans | -92.2 | -24.6 | -166.2 | -61.3 | 173.5 | 0 | 0 | 0 | 112.8 | T40 N41 L42 | I38-T40 VanDerWaalsContact C-N 3.25Å; I38-T40 PolarHBondContact O-N 2.66Å; I38-N41 PolarHBondContact O-N 2.94Å; I38-L42 HydrophobicContact CG2-CD1 4.41Å |
| 39 | A | 43 | Very low | 44.4 | Very low | 71 Ų | 71 | 103.1 Ų | 103.1 | 59% | 0.587 | 61% | 0.606 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71.1 | -15.7 | -178 | 0 | 0 | 0 | 0 | 0 | 114.5 | ||
| 40 | T | 41.9 | Very low | 44.1 | Very low | 100 Ų | 100 | 107.2 Ų | 107.2 | 61% | 0.613 | 61% | 0.608 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.5 | -25.5 | 174.4 | -40.2 | 0 | 0 | 0 | 0 | 112 | I38 | I38-T40 VanDerWaalsContact C-N 3.25Å; I38-T40 PolarHBondContact O-N 2.66Å |
| 41 | N | 38.9 | Very low | 43.9 | Very low | 86 Ų | 86 | 104.7 Ų | 104.7 | 46% | 0.46 | 59% | 0.586 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -90.4 | -10.7 | -174.7 | -75.8 | -11.7 | 0 | 0 | 0 | 114.6 | I38 P45 | I38-N41 PolarHBondContact O-N 2.94Å; N41-P45 VanDerWaalsContact O-CD 3.31Å; N41-P45 WeakPolarHBondContact O-CD 3.14Å |
| 42 | L | 44 | Very low | 43.9 | Very low | 140 Ų | 140 | 105 Ų | 105 | 73% | 0.733 | 59% | 0.589 | S | S | * | * | S | Bend | trans | -82.2 | -15.7 | 178 | -79.6 | 160.7 | 0 | 0 | 0 | 113.6 | I38 | I38-L42 HydrophobicContact CG2-CD1 4.41Š|
| 43 | V | 43.9 | Very low | 44 | Very low | 120 Ų | 120 | 111.5 Ų | 111.5 | 73% | 0.727 | 60% | 0.596 | S | S | * | * | S | Bend | trans | -96.7 | -10.2 | 178.3 | -172.9 | 0 | 0 | 0 | 0 | 112 | ||
| 44 | C | 41 | Very low | 44.2 | Very low | 54 Ų | 54 | 117 Ų | 117 | 37% | 0.365 | 61% | 0.61 | S | S | . | * | trans | -155.7 | 44.2 | -172.5 | -99 | 0 | 0 | 0 | 0 | 117 | R46 W47 | C44-R46 PolarHBondContact O-N 3.18Å; C44-W47 HydrophobicContact CB-CB 3.64Å; C44-W47 PolarHBondContact O-N 3.3Å | ||
| 45 | P | 41.9 | Very low | 44.4 | Very low | 97 Ų | 97 | 112.5 Ų | 112.5 | 63% | 0.63 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -64.3 | -14.7 | 175.7 | 26.4 | -30.5 | 0 | 0 | 0 | 113.3 | N41 | N41-P45 VanDerWaalsContact O-CD 3.31Å; N41-P45 WeakPolarHBondContact O-CD 3.14Å |
| 46 | R | 47.5 | Very low | 44.3 | Very low | 228 Ų | 228 | 110.7 Ų | 110.7 | 86% | 0.86 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -90.6 | -11.9 | 171.7 | -83 | -176.6 | 175.4 | 173.9 | -1.2 | 114.8 | C44 Y50 | C44-R46 PolarHBondContact O-N 3.18Å; R46-Y50 WeakPolarHBondContact O-CB 3.44Å; R46-Y50 PolarHBondContact O-N 3Å |
| 47 | W | 44.3 | Very low | 44.7 | Very low | 114 Ų | 114 | 111.6 Ų | 111.6 | 43% | 0.432 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -82.4 | -42.4 | -178.6 | -170.9 | -93.4 | 0 | 0 | 0 | 111.5 | C44 A49 Y50 T51 V63 | C44-W47 HydrophobicContact CB-CB 3.64Å; C44-W47 PolarHBondContact O-N 3.3Å; W47-A49 PolarHBondContact O-N 2.82Å; W47-Y50 PolarHBondContact O-N 3.32Å; W47-T51 PolarHBondContact NE1-OG1 3.44Å; W47-T51 WeakPolarHBondContact O-CB 3.37Å; W47-T51 PolarHBondContact O-N 3.3Å; W47-T51 PolarHBondContact O-OG1 3.39Å; W47-V63 HydrophobicContact CZ2-CG2 4.18Å |
| 48 | D | 45.6 | Very low | 45 | Very low | 76 Ų | 76 | 113.5 Ų | 113.5 | 41% | 0.406 | 58% | 0.584 | S | S | . | * | H | α-helix | trans | -62.9 | -43.5 | 177.8 | -69.4 | -25.8 | 0 | 0 | 0 | 111.4 | Y50 T51 E52 | D48-Y50 VanDerWaalsContact C-N 3.31Å; D48-Y50 PolarHBondContact O-N 3.2Å; D48-T51 PolarHBondContact O-N 2.84Å; D48-E52 WeakPolarHBondContact O-CB 3.41Å; D48-E52 WeakPolarHBondContact O-CG 3.34Å; D48-E52 PolarHBondContact O-N 3.35Å |
| 49 | A | 45.9 | Very low | 45.3 | Very low | 58 Ų | 58 | 113.1 Ų | 113.1 | 48% | 0.479 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -65.8 | -28.7 | 177.1 | 0 | 0 | 0 | 0 | 0 | 114.1 | W47 | W47-A49 PolarHBondContact O-N 2.82Å |
| 50 | Y | 46 | Very low | 45.4 | Very low | 154 Ų | 154 | 115 Ų | 115 | 60% | 0.604 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -83.5 | -36 | 178.4 | -170.6 | -98.1 | 0 | 0 | 0 | 111.9 | R46 W47 D48 | R46-Y50 WeakPolarHBondContact O-CB 3.44Å; R46-Y50 PolarHBondContact O-N 3Å; W47-Y50 PolarHBondContact O-N 3.32Å; D48-Y50 VanDerWaalsContact C-N 3.31Å; D48-Y50 PolarHBondContact O-N 3.2Å |
| 51 | T | 45.5 | Very low | 45.8 | Very low | 16 Ų | 16 | 115.2 Ų | 115.2 | 10% | 0.098 | 57% | 0.571 | C | S | . | * | H | α-helix | trans | -81.6 | -30.6 | -175.3 | -43.7 | 0 | 0 | 0 | 0 | 112 | W47 D48 R53 C55 | W47-T51 PolarHBondContact NE1-OG1 3.44Å; W47-T51 WeakPolarHBondContact O-CB 3.37Å; W47-T51 PolarHBondContact O-N 3.3Å; W47-T51 PolarHBondContact O-OG1 3.39Å; D48-T51 PolarHBondContact O-N 2.84Å; T51-R53 VanDerWaalsContact C-N 3.34Å; T51-R53 PolarHBondContact O-N 2.79Å; T51-C55 HydrophobicContact CG2-CB 3.82Å; T51-C55 WeakPolarHBondContact O-CB 3.15Å; T51-C55 PolarHBondContact O-N 3.27Å |
| 52 | E | 50.8 | Low | 46.3 | Very low | 152 Ų | 152 | 112.9 Ų | 112.9 | 71% | 0.71 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -68.8 | -26.5 | 176.5 | -79 | -172.6 | 153.1 | 0 | 0 | 114.2 | D48 | D48-E52 WeakPolarHBondContact O-CB 3.41Å; D48-E52 WeakPolarHBondContact O-CG 3.34Å; D48-E52 PolarHBondContact O-N 3.35Å |
| 53 | R | 52.8 | Low | 46.8 | Very low | 222 Ų | 222 | 107.9 Ų | 107.9 | 84% | 0.838 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -93.1 | -16.1 | -176.2 | -67 | -166.4 | -162.3 | -170.5 | 5 | 115.4 | T51 | T51-R53 VanDerWaalsContact C-N 3.34Å; T51-R53 PolarHBondContact O-N 2.79Å |
| 54 | K | 51.1 | Low | 47.3 | Very low | 167 Ų | 167 | 106.5 Ų | 106.5 | 73% | 0.726 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -137.4 | -7.6 | -169 | -77.5 | -164.3 | 174.3 | -173.8 | 0 | 116.8 | ||
| 55 | C | 44.2 | Very low | 47.8 | Very low | 24 Ų | 24 | 109.7 Ų | 109.7 | 16% | 0.162 | 54% | 0.54 | C | S | . | . | trans | -115.8 | 101.6 | -169.3 | -62.5 | 0 | 0 | 0 | 0 | 111.1 | T51 Q59 | T51-C55 HydrophobicContact CG2-CB 3.82Å; T51-C55 WeakPolarHBondContact O-CB 3.15Å; T51-C55 PolarHBondContact O-N 3.27Å; C55-Q59 HydrophobicContact CB-CB 3.93Å; C55-Q59 PolarHBondContact SG-OE1 2.78Å | ||
| 56 | G | 42.2 | Very low | 48.6 | Very low | 55 Ų | 55 | 113.9 Ų | 113.9 | 57% | 0.567 | 54% | 0.544 | S | S | * | . | trans | -54.7 | 156.3 | 172.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | K58 Q59 | G56-K58 PolarHBondContact O-N 3.43Å; G56-Q59 PolarHBondContact O-N 2.89Å | ||
| 57 | V | 47.2 | Very low | 48.9 | Very low | 125 Ų | 125 | 107 Ų | 107 | 76% | 0.758 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -43.1 | -34 | -167.8 | -177.2 | 0 | 0 | 0 | 0 | 114.8 | Q59 K60 L61 | V57-Q59 PolarHBondContact O-N 3.44Å; V57-K60 PolarHBondContact O-N 3.37Å; V57-L61 PolarHBondContact O-N 3.39Å |
| 58 | K | 48.3 | Very low | 49.5 | Very low | 198 Ų | 198 | 106.7 Ų | 106.7 | 86% | 0.861 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -64.5 | -32.5 | 177.9 | -72.6 | -174.2 | 175.6 | -178.3 | 0 | 114.6 | G56 | G56-K58 PolarHBondContact O-N 3.43Å |
| 59 | Q | 44.6 | Very low | 50 | Low | 119 Ų | 119 | 112 Ų | 112 | 56% | 0.556 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -77.1 | -30.9 | 176.9 | -74.9 | -175.3 | 15.3 | 0 | 0 | 112.1 | C55 G56 V57 L61 G62 V63 | C55-Q59 HydrophobicContact CB-CB 3.93Å; C55-Q59 PolarHBondContact SG-OE1 2.78Å; G56-Q59 PolarHBondContact O-N 2.89Å; V57-Q59 PolarHBondContact O-N 3.44Å; Q59-L61 VanDerWaalsContact C-N 3.27Å; Q59-L61 PolarHBondContact O-N 2.84Å; Q59-G62 PolarHBondContact O-N 2.77Å; Q59-V63 WeakPolarHBondContact O-CG2 3.3Å; Q59-V63 PolarHBondContact O-N 3.5Å |
| 60 | K | 45 | Very low | 50.4 | Low | 111 Ų | 111 | 110.5 Ų | 110.5 | 48% | 0.483 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -60.1 | -38.1 | 174 | -69.3 | -170.4 | 175.8 | -171.2 | 0 | 111.8 | V57 L64 | V57-K60 PolarHBondContact O-N 3.37Å; K60-L64 WeakPolarHBondContact O-CB 3.44Å; K60-L64 PolarHBondContact O-N 2.76Å |
| 61 | L | 50.2 | Low | 50.6 | Low | 103 Ų | 103 | 105.4 Ų | 105.4 | 54% | 0.539 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -66.6 | -45.4 | 176.9 | -170.6 | 65.3 | 0 | 0 | 0 | 112.1 | V57 Q59 V63 L64 E65 | V57-L61 PolarHBondContact O-N 3.39Å; Q59-L61 VanDerWaalsContact C-N 3.27Å; Q59-L61 PolarHBondContact O-N 2.84Å; L61-V63 VanDerWaalsContact C-N 3.33Å; L61-V63 PolarHBondContact O-N 3.23Å; L61-L64 PolarHBondContact O-N 2.96Å; L61-E65 WeakPolarHBondContact O-CG 3.47Å; L61-E65 PolarHBondContact O-N 2.85Å |
| 62 | G | 51.3 | Low | 51.1 | Low | 38 Ų | 38 | 108.1 Ų | 108.1 | 39% | 0.392 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -63.8 | -36.1 | 177.3 | 0 | 0 | 0 | 0 | 0 | 113.4 | Q59 W66 | Q59-G62 PolarHBondContact O-N 2.77Å; G62-W66 WeakPolarHBondContact O-CB 3.32Å; G62-W66 PolarHBondContact O-N 3.34Å |
| 63 | V | 54.6 | Low | 51.3 | Low | 35 Ų | 35 | 104.3 Ų | 104.3 | 21% | 0.212 | 53% | 0.526 | C | S | . | . | H | α-helix | trans | -67.1 | -42 | 173.6 | 173.5 | 0 | 0 | 0 | 0 | 111 | W47 Q59 L61 W66 Q67 | W47-V63 HydrophobicContact CZ2-CG2 4.18Å; Q59-V63 WeakPolarHBondContact O-CG2 3.3Å; Q59-V63 PolarHBondContact O-N 3.5Å; L61-V63 VanDerWaalsContact C-N 3.33Å; L61-V63 PolarHBondContact O-N 3.23Å; V63-W66 PolarHBondContact O-N 2.89Å; V63-Q67 HydrophobicContact CG1-CG 4.43Å; V63-Q67 WeakPolarHBondContact O-CB 3.27Å; V63-Q67 WeakPolarHBondContact O-CG 3.24Å; V63-Q67 PolarHBondContact O-N 3.45Å |
| 64 | L | 53.5 | Low | 51.4 | Low | 90 Ų | 90 | 100.3 Ų | 100.3 | 47% | 0.471 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -63.4 | -44.6 | 176.6 | -174.3 | 66.1 | 0 | 0 | 0 | 111.5 | K60 L61 W66 Q67 I68 | K60-L64 WeakPolarHBondContact O-CB 3.44Å; K60-L64 PolarHBondContact O-N 2.76Å; L61-L64 PolarHBondContact O-N 2.96Å; L64-W66 VanDerWaalsContact C-N 3.33Å; L64-W66 PolarHBondContact O-N 3.43Å; L64-Q67 PolarHBondContact O-N 2.87Å; L64-I68 HydrophobicContact CD1-CD1 4.44Å; L64-I68 HydrophobicContact CG-CD1 3.98Å; L64-I68 WeakPolarHBondContact O-CB 3.37Å; L64-I68 VanDerWaalsContact O-CG1 3.24Å; L64-I68 WeakPolarHBondContact O-CG1 3.42Å; L64-I68 PolarHBondContact O-N 2.93Å |
| 65 | E | 51.8 | Low | 51.7 | Low | 121 Ų | 121 | 95.9 Ų | 95.9 | 57% | 0.565 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -60.8 | -41.2 | 174.4 | -74.1 | -174.5 | 170.2 | 0 | 0 | 112.1 | L61 I68 R69 | L61-E65 WeakPolarHBondContact O-CG 3.47Å; L61-E65 PolarHBondContact O-N 2.85Å; E65-I68 PolarHBondContact O-N 3.2Å; E65-R69 WeakPolarHBondContact O-CB 3.46Å; E65-R69 PolarHBondContact O-N 2.83Å |
| 66 | W | 58.3 | Low | 52.3 | Low | 186 Ų | 186 | 101.4 Ų | 101.4 | 71% | 0.705 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -66.3 | -40.9 | 176.2 | -169.9 | 86.4 | 0 | 0 | 0 | 111.8 | G62 V63 L64 R69 A70 | G62-W66 WeakPolarHBondContact O-CB 3.32Å; G62-W66 PolarHBondContact O-N 3.34Å; V63-W66 PolarHBondContact O-N 2.89Å; L64-W66 VanDerWaalsContact C-N 3.33Å; L64-W66 PolarHBondContact O-N 3.43Å; W66-R69 PolarHBondContact O-N 3.39Å; W66-A70 HydrophobicContact CE3-CB 4.5Å; W66-A70 HydrophobicContact CZ3-CB 4.49Å; W66-A70 VanDerWaalsContact O-CB 3.24Å; W66-A70 WeakPolarHBondContact O-CB 3.24Å; W66-A70 PolarHBondContact O-N 2.91Å |
| 67 | Q | 54 | Low | 53 | Low | 84 Ų | 84 | 103.4 Ų | 103.4 | 39% | 0.393 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -63.6 | -43 | 174.4 | -76.5 | -178.9 | -12 | 0 | 0 | 111.8 | V63 L64 A70 A71 | V63-Q67 HydrophobicContact CG1-CG 4.43Å; V63-Q67 WeakPolarHBondContact O-CB 3.27Å; V63-Q67 WeakPolarHBondContact O-CG 3.24Å; V63-Q67 PolarHBondContact O-N 3.45Å; L64-Q67 PolarHBondContact O-N 2.87Å; Q67-A70 PolarHBondContact O-N 3.33Å; Q67-A71 WeakPolarHBondContact O-CB 3.23Å; Q67-A71 PolarHBondContact O-N 2.9Å |
| 68 | I | 56.5 | Low | 53.7 | Low | 107 Ų | 107 | 102.3 Ų | 102.3 | 55% | 0.549 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -62.6 | -43.4 | 174.8 | -68.5 | 165.3 | 0 | 0 | 0 | 110.3 | L64 E65 A71 S72 | L64-I68 HydrophobicContact CD1-CD1 4.44Å; L64-I68 HydrophobicContact CG-CD1 3.98Å; L64-I68 WeakPolarHBondContact O-CB 3.37Å; L64-I68 VanDerWaalsContact O-CG1 3.24Å; L64-I68 WeakPolarHBondContact O-CG1 3.42Å; L64-I68 PolarHBondContact O-N 2.93Å; E65-I68 PolarHBondContact O-N 3.2Å; I68-A71 PolarHBondContact O-N 3.29Å; I68-S72 VanDerWaalsContact O-CB 3.24Å; I68-S72 WeakPolarHBondContact O-CB 3.49Å; I68-S72 PolarHBondContact O-N 3.46Å |
| 69 | R | 55.4 | Low | 54.2 | Low | 187 Ų | 187 | 99.5 Ų | 99.5 | 71% | 0.706 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -67 | -42.6 | 178 | -170.3 | -179.7 | -69.8 | -151.9 | 0.2 | 112.2 | E65 W66 S72 T73 | E65-R69 WeakPolarHBondContact O-CB 3.46Å; E65-R69 PolarHBondContact O-N 2.83Å; W66-R69 PolarHBondContact O-N 3.39Å; R69-S72 PolarHBondContact O-N 3.4Å; R69-T73 WeakPolarHBondContact O-CB 3.35Å; R69-T73 PolarHBondContact O-N 3.42Å; R69-T73 PolarHBondContact O-OG1 3.33Å |
| 70 | A | 54.8 | Low | 55.1 | Low | 26 Ų | 26 | 96.8 Ų | 96.8 | 22% | 0.215 | 48% | 0.483 | C | S | . | . | H | α-helix | trans | -66.3 | -40.4 | 176.1 | 0 | 0 | 0 | 0 | 0 | 111.3 | W66 Q67 T73 K74 | W66-A70 HydrophobicContact CE3-CB 4.5Å; W66-A70 HydrophobicContact CZ3-CB 4.49Å; W66-A70 VanDerWaalsContact O-CB 3.24Å; W66-A70 WeakPolarHBondContact O-CB 3.24Å; W66-A70 PolarHBondContact O-N 2.91Å; Q67-A70 PolarHBondContact O-N 3.33Å; A70-T73 PolarHBondContact O-N 3.24Å; A70-K74 WeakPolarHBondContact O-CB 3.44Å; A70-K74 VanDerWaalsContact O-CG 3.3Å; A70-K74 WeakPolarHBondContact O-CG 3.23Å; A70-K74 PolarHBondContact O-N 2.94Å |
| 71 | A | 51.4 | Low | 55.8 | Low | 48 Ų | 48 | 97.9 Ų | 97.9 | 40% | 0.397 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -64.6 | -42.5 | 172.9 | 0 | 0 | 0 | 0 | 0 | 111.1 | Q67 I68 T73 K74 S75 | Q67-A71 WeakPolarHBondContact O-CB 3.23Å; Q67-A71 PolarHBondContact O-N 2.9Å; I68-A71 PolarHBondContact O-N 3.29Å; A71-T73 VanDerWaalsContact C-N 3.33Å; A71-T73 PolarHBondContact O-N 3.32Å; A71-K74 PolarHBondContact O-N 3.45Å; A71-S75 WeakPolarHBondContact O-CB 3.31Å; A71-S75 PolarHBondContact O-N 2.96Å; A71-S75 PolarHBondContact O-OG 3.38Å |
| 72 | S | 54.2 | Low | 56.3 | Low | 73 Ų | 73 | 97.9 Ų | 97.9 | 51% | 0.51 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -62 | -40.9 | 175.3 | 179.2 | 0 | 0 | 0 | 0 | 111.6 | I68 R69 S75 Y76 | I68-S72 VanDerWaalsContact O-CB 3.24Å; I68-S72 WeakPolarHBondContact O-CB 3.49Å; I68-S72 PolarHBondContact O-N 3.46Å; R69-S72 PolarHBondContact O-N 3.4Å; S72-S75 PolarHBondContact O-N 3.21Å; S72-Y76 VanDerWaalsContact O-CB 3.23Å; S72-Y76 WeakPolarHBondContact O-CB 3.43Å; S72-Y76 PolarHBondContact O-N 3.02Å |
| 73 | T | 54.9 | Low | 57 | Low | 72 Ų | 72 | 99.8 Ų | 99.8 | 44% | 0.442 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -67.6 | -39.6 | 175.9 | -49.2 | 0 | 0 | 0 | 0 | 111.1 | R69 A70 A71 Y76 N77 | R69-T73 WeakPolarHBondContact O-CB 3.35Å; R69-T73 PolarHBondContact O-N 3.42Å; R69-T73 PolarHBondContact O-OG1 3.33Å; A70-T73 PolarHBondContact O-N 3.24Å; A71-T73 VanDerWaalsContact C-N 3.33Å; A71-T73 PolarHBondContact O-N 3.32Å; T73-Y76 PolarHBondContact O-N 3.03Å; T73-N77 WeakPolarHBondContact O-CB 3.25Å; T73-N77 PolarHBondContact O-N 3.05Å; T73-N77 PolarHBondContact O-ND2 3.4Å |
| 74 | K | 56.5 | Low | 57.5 | Low | 138 Ų | 138 | 103.7 Ų | 103.7 | 60% | 0.6 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -63.9 | -45.8 | 173 | -75.6 | 177.3 | -178.1 | -178.5 | 0 | 111.5 | A70 A71 N77 I78 | A70-K74 WeakPolarHBondContact O-CB 3.44Å; A70-K74 VanDerWaalsContact O-CG 3.3Å; A70-K74 WeakPolarHBondContact O-CG 3.23Å; A70-K74 PolarHBondContact O-N 2.94Å; A71-K74 PolarHBondContact O-N 3.45Å; K74-N77 PolarHBondContact O-N 3.04Å; K74-I78 WeakPolarHBondContact O-CB 3.4Å; K74-I78 WeakPolarHBondContact O-CD1 3.32Å; K74-I78 WeakPolarHBondContact O-CG1 3.4Å; K74-I78 PolarHBondContact O-N 3.26Å |
| 75 | S | 56.5 | Low | 58 | Low | 73 Ų | 73 | 103.4 Ų | 103.4 | 51% | 0.51 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -63.8 | -40.3 | 176.9 | -61.8 | 0 | 0 | 0 | 0 | 111.8 | A71 S72 I78 Y79 | A71-S75 WeakPolarHBondContact O-CB 3.31Å; A71-S75 PolarHBondContact O-N 2.96Å; A71-S75 PolarHBondContact O-OG 3.38Å; S72-S75 PolarHBondContact O-N 3.21Å; S75-I78 PolarHBondContact O-N 3.19Å; S75-Y79 WeakPolarHBondContact O-CB 3.44Å; S75-Y79 PolarHBondContact O-N 3.26Å |
| 76 | Y | 56.8 | Low | 58.6 | Low | 141 Ų | 141 | 100.1 Ų | 100.1 | 55% | 0.553 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -65.1 | -45.4 | 174.9 | -173.6 | -98.4 | 0 | 0 | 0 | 111.4 | S72 T73 I78 Y79 I80 | S72-Y76 VanDerWaalsContact O-CB 3.23Å; S72-Y76 WeakPolarHBondContact O-CB 3.43Å; S72-Y76 PolarHBondContact O-N 3.02Å; T73-Y76 PolarHBondContact O-N 3.03Å; Y76-I78 VanDerWaalsContact C-N 3.32Å; Y76-I78 PolarHBondContact O-N 3.41Å; Y76-Y79 WeakPolarHBondContact O-CB 3.31Å; Y76-Y79 PolarHBondContact O-N 3.04Å; Y76-I80 HydrophobicContact CD1-CG1 4.06Å; Y76-I80 HydrophobicContact CE1-CD1 4.19Å; Y76-I80 HydrophobicContact CE1-CG1 3.72Å; Y76-I80 VanDerWaalsContact O-CG1 3.32Å; Y76-I80 WeakPolarHBondContact O-CG1 3.49Å; Y76-I80 PolarHBondContact O-N 3.37Å |
| 77 | N | 57.7 | Low | 59 | Low | 96 Ų | 96 | 94.9 Ų | 94.9 | 51% | 0.513 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -63.9 | -38.1 | 175.8 | -73.1 | -21.1 | 0 | 0 | 0 | 112 | T73 K74 Y81 | T73-N77 WeakPolarHBondContact O-CB 3.25Å; T73-N77 PolarHBondContact O-N 3.05Å; T73-N77 PolarHBondContact O-ND2 3.4Å; K74-N77 PolarHBondContact O-N 3.04Å; N77-Y81 VanDerWaalsContact O-CB 3.27Å; N77-Y81 WeakPolarHBondContact O-CB 3.42Å; N77-Y81 PolarHBondContact O-N 3.07Å |
| 78 | I | 61.2 | Low | 59.6 | Low | 102 Ų | 102 | 95.5 Ų | 95.5 | 52% | 0.523 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -64.5 | -44.4 | 173.3 | -69.8 | 163 | 0 | 0 | 0 | 110.4 | K74 S75 Y76 Y81 L82 | K74-I78 WeakPolarHBondContact O-CB 3.4Å; K74-I78 WeakPolarHBondContact O-CD1 3.32Å; K74-I78 WeakPolarHBondContact O-CG1 3.4Å; K74-I78 PolarHBondContact O-N 3.26Å; S75-I78 PolarHBondContact O-N 3.19Å; Y76-I78 VanDerWaalsContact C-N 3.32Å; Y76-I78 PolarHBondContact O-N 3.41Å; I78-Y81 PolarHBondContact O-N 2.96Å; I78-L82 HydrophobicContact CG2-CD1 3.93Å; I78-L82 HydrophobicContact CG2-CG 4.35Å; I78-L82 WeakPolarHBondContact O-CB 3.41Å; I78-L82 WeakPolarHBondContact O-CG 3.35Å; I78-L82 PolarHBondContact O-N 2.98Å |
| 79 | Y | 59.3 | Low | 60 | Low | 139 Ų | 139 | 93.3 Ų | 93.3 | 55% | 0.545 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -59.5 | -48.8 | 176.6 | 174.1 | -98.4 | 0 | 0 | 0 | 111.7 | S75 Y76 Y81 L82 L83 | S75-Y79 WeakPolarHBondContact O-CB 3.44Å; S75-Y79 PolarHBondContact O-N 3.26Å; Y76-Y79 WeakPolarHBondContact O-CB 3.31Å; Y76-Y79 PolarHBondContact O-N 3.04Å; Y79-Y81 VanDerWaalsContact C-N 3.31Å; Y79-Y81 PolarHBondContact O-N 2.86Å; Y79-L82 PolarHBondContact O-N 3.49Å; Y79-L83 WeakPolarHBondContact O-CB 3.43Å; Y79-L83 PolarHBondContact O-N 3.41Å |
| 80 | I | 64 | Low | 60.6 | Low | 63 Ų | 63 | 90 Ų | 90 | 32% | 0.323 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -60.3 | -42.2 | 175.7 | -65.9 | -64.9 | 0 | 0 | 0 | 110.8 | Y76 L83 M84 | Y76-I80 HydrophobicContact CD1-CG1 4.06Å; Y76-I80 HydrophobicContact CE1-CD1 4.19Å; Y76-I80 HydrophobicContact CE1-CG1 3.72Å; Y76-I80 VanDerWaalsContact O-CG1 3.32Å; Y76-I80 WeakPolarHBondContact O-CG1 3.49Å; Y76-I80 PolarHBondContact O-N 3.37Å; I80-L83 PolarHBondContact O-N 3.45Å; I80-M84 HydrophobicContact CG2-CG 4.41Å; I80-M84 WeakPolarHBondContact O-CB 3.17Å; I80-M84 VanDerWaalsContact O-CG 3.23Å; I80-M84 WeakPolarHBondContact O-CG 3.34Å; I80-M84 PolarHBondContact O-N 3.23Å |
| 81 | Y | 59.6 | Low | 61.2 | Low | 134 Ų | 134 | 94 Ų | 94 | 53% | 0.525 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -63.1 | -44.2 | 177.7 | -173.2 | -95.7 | 0 | 0 | 0 | 112.3 | N77 I78 Y79 M84 L85 | N77-Y81 VanDerWaalsContact O-CB 3.27Å; N77-Y81 WeakPolarHBondContact O-CB 3.42Å; N77-Y81 PolarHBondContact O-N 3.07Å; I78-Y81 PolarHBondContact O-N 2.96Å; Y79-Y81 VanDerWaalsContact C-N 3.31Å; Y79-Y81 PolarHBondContact O-N 2.86Å; Y81-M84 PolarHBondContact O-N 2.88Å; Y81-L85 WeakPolarHBondContact O-CB 3.32Å; Y81-L85 PolarHBondContact O-N 3.29Å |
| 82 | L | 60.7 | Low | 61.6 | Low | 102 Ų | 102 | 97.3 Ų | 97.3 | 53% | 0.534 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -64.5 | -38.9 | 175.9 | -72.2 | 171.5 | 0 | 0 | 0 | 112 | I78 Y79 L85 S86 | I78-L82 HydrophobicContact CG2-CD1 3.93Å; I78-L82 HydrophobicContact CG2-CG 4.35Å; I78-L82 WeakPolarHBondContact O-CB 3.41Å; I78-L82 WeakPolarHBondContact O-CG 3.35Å; I78-L82 PolarHBondContact O-N 2.98Å; Y79-L82 PolarHBondContact O-N 3.49Å; L82-L85 PolarHBondContact O-N 2.97Å; L82-S86 WeakPolarHBondContact O-CB 3.39Å; L82-S86 PolarHBondContact O-N 3.34Å |
| 83 | L | 65.3 | Low | 62.1 | Low | 79 Ų | 79 | 100.9 Ų | 100.9 | 41% | 0.414 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -63.6 | -45.6 | 176.4 | -168.3 | 73.6 | 0 | 0 | 0 | 111.2 | Y79 I80 S86 N87 | Y79-L83 WeakPolarHBondContact O-CB 3.43Å; Y79-L83 PolarHBondContact O-N 3.41Å; I80-L83 PolarHBondContact O-N 3.45Å; L83-S86 PolarHBondContact O-N 2.97Å; L83-N87 PolarHBondContact O-N 3.47Å; L83-N87 PolarHBondContact O-ND2 2.87Å |
| 84 | M | 66 | Low | 62.1 | Low | 116 Ų | 116 | 105.9 Ų | 105.9 | 57% | 0.571 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -61.1 | -44.8 | 175.3 | -70 | -73 | -86.3 | 0 | 0 | 111.3 | I80 Y81 S86 N87 I88 | I80-M84 HydrophobicContact CG2-CG 4.41Å; I80-M84 WeakPolarHBondContact O-CB 3.17Å; I80-M84 VanDerWaalsContact O-CG 3.23Å; I80-M84 WeakPolarHBondContact O-CG 3.34Å; I80-M84 PolarHBondContact O-N 3.23Å; Y81-M84 PolarHBondContact O-N 2.88Å; M84-S86 VanDerWaalsContact C-N 3.34Å; M84-S86 PolarHBondContact O-N 2.98Å; M84-N87 PolarHBondContact O-N 3.45Å; M84-I88 VanDerWaalsContact O-CG1 3.31Å; M84-I88 WeakPolarHBondContact O-CG1 3.43Å; M84-I88 PolarHBondContact O-N 3.33Å |
| 85 | L | 63.5 | Low | 61.7 | Low | 85 Ų | 85 | 109.1 Ų | 109.1 | 45% | 0.445 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -61.2 | -42.9 | 176.6 | -159.6 | 87.8 | 0 | 0 | 0 | 111.6 | Y81 L82 N87 I88 V89 | Y81-L85 WeakPolarHBondContact O-CB 3.32Å; Y81-L85 PolarHBondContact O-N 3.29Å; L82-L85 PolarHBondContact O-N 2.97Å; L85-N87 PolarHBondContact O-N 3.38Å; L85-I88 PolarHBondContact O-N 3.13Å; L85-V89 WeakPolarHBondContact O-CG2 3.44Å; L85-V89 PolarHBondContact O-N 3.25Å |
| 86 | S | 63.1 | Low | 62 | Low | 51 Ų | 51 | 110.9 Ų | 110.9 | 36% | 0.357 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -61.3 | -42.5 | 177.8 | -174.7 | 0 | 0 | 0 | 0 | 112.1 | L82 L83 M84 V89 K90 | L82-S86 WeakPolarHBondContact O-CB 3.39Å; L82-S86 PolarHBondContact O-N 3.34Å; L83-S86 PolarHBondContact O-N 2.97Å; M84-S86 VanDerWaalsContact C-N 3.34Å; M84-S86 PolarHBondContact O-N 2.98Å; S86-V89 PolarHBondContact O-N 3.38Å; S86-K90 WeakPolarHBondContact O-CG 3.31Å; S86-K90 PolarHBondContact O-N 3.47Å |
| 87 | N | 67.9 | Low | 62.2 | Low | 76 Ų | 76 | 109.3 Ų | 109.3 | 41% | 0.406 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -65.9 | -42.2 | 177.4 | -70.7 | -23.7 | 0 | 0 | 0 | 111.9 | L83 M84 L85 V89 K90 D91 | L83-N87 PolarHBondContact O-N 3.47Å; L83-N87 PolarHBondContact O-ND2 2.87Å; M84-N87 PolarHBondContact O-N 3.45Å; L85-N87 PolarHBondContact O-N 3.38Å; N87-V89 PolarHBondContact O-N 3Å; N87-K90 PolarHBondContact O-N 3.32Å; N87-D91 PolarHBondContact O-N 2.94Å |
| 88 | I | 66.6 | Low | 62.5 | Low | 97 Ų | 97 | 110.1 Ų | 110.1 | 50% | 0.497 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -60.9 | -44.2 | 175.7 | -67.2 | 165.6 | 0 | 0 | 0 | 111.2 | M84 L85 D91 L92 | M84-I88 VanDerWaalsContact O-CG1 3.31Å; M84-I88 WeakPolarHBondContact O-CG1 3.43Å; M84-I88 PolarHBondContact O-N 3.33Å; L85-I88 PolarHBondContact O-N 3.13Å; I88-D91 PolarHBondContact O-N 3.18Å; I88-L92 HydrophobicContact CG2-CD1 4.03Å; I88-L92 WeakPolarHBondContact O-CG 3.47Å; I88-L92 PolarHBondContact O-N 2.93Å |
| 89 | V | 65.5 | Low | 62.6 | Low | 62 Ų | 62 | 110.5 Ų | 110.5 | 38% | 0.376 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -64.6 | -40.5 | 178 | 172.6 | 0 | 0 | 0 | 0 | 111.2 | L85 S86 N87 L92 M93 | L85-V89 WeakPolarHBondContact O-CG2 3.44Å; L85-V89 PolarHBondContact O-N 3.25Å; S86-V89 PolarHBondContact O-N 3.38Å; N87-V89 PolarHBondContact O-N 3Å; V89-L92 PolarHBondContact O-N 3.27Å; V89-M93 HydrophobicContact CG1-CE 3.76Å; V89-M93 HydrophobicContact CG1-CG 4.48Å; V89-M93 HydrophobicContact CG1-SD 4.17Å; V89-M93 WeakPolarHBondContact O-CG 3.25Å; V89-M93 PolarHBondContact O-N 3.22Å |
| 90 | K | 66.7 | Low | 62.8 | Low | 118 Ų | 118 | 108.8 Ų | 108.8 | 51% | 0.513 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -62.9 | -40.1 | 175.4 | -76.6 | 176.1 | -179.1 | 177.1 | 0 | 112.4 | S86 N87 M93 K94 | S86-K90 WeakPolarHBondContact O-CG 3.31Å; S86-K90 PolarHBondContact O-N 3.47Å; N87-K90 PolarHBondContact O-N 3.32Å; K90-M93 PolarHBondContact O-N 3.32Å; K90-K94 WeakPolarHBondContact O-CG 3.39Å; K90-K94 PolarHBondContact O-N 2.93Å |
| 91 | D | 67.3 | Low | 62.7 | Low | 109 Ų | 109 | 111.8 Ų | 111.8 | 58% | 0.583 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -68.4 | -38 | 176.8 | -78.6 | -8.7 | 0 | 0 | 0 | 111.6 | N87 I88 K94 | N87-D91 PolarHBondContact O-N 2.94Å; I88-D91 PolarHBondContact O-N 3.18Å; D91-K94 PolarHBondContact O-N 3.39Å |
| 92 | L | 60.3 | Low | 62.9 | Low | 117 Ų | 117 | 110.2 Ų | 110.2 | 61% | 0.613 | 56% | 0.563 | S | S | * | * | H | α-helix | trans | -66.6 | -34 | 174.7 | -76.7 | 168.2 | 0 | 0 | 0 | 113.3 | I88 V89 K94 | I88-L92 HydrophobicContact CG2-CD1 4.03Å; I88-L92 WeakPolarHBondContact O-CG 3.47Å; I88-L92 PolarHBondContact O-N 2.93Å; V89-L92 PolarHBondContact O-N 3.27Å; L92-K94 VanDerWaalsContact C-N 3.31Å |
| 93 | M | 63.8 | Low | 63.1 | Low | 148 Ų | 148 | 110.8 Ų | 110.8 | 73% | 0.729 | 57% | 0.565 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79 | -11.5 | 178.2 | -73.4 | -177.7 | 177.8 | 0 | 0 | 113.9 | V89 K90 | V89-M93 HydrophobicContact CG1-CE 3.76Å; V89-M93 HydrophobicContact CG1-CG 4.48Å; V89-M93 HydrophobicContact CG1-SD 4.17Å; V89-M93 WeakPolarHBondContact O-CG 3.25Å; V89-M93 PolarHBondContact O-N 3.22Å; K90-M93 PolarHBondContact O-N 3.32Å |
| 94 | K | 56.4 | Low | 62.9 | Low | 178 Ų | 178 | 113.5 Ų | 113.5 | 77% | 0.774 | 58% | 0.578 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -93.1 | 4.8 | 176.5 | -76.3 | -178.9 | 177.8 | -177.8 | 0 | 113.4 | K90 D91 L92 | K90-K94 WeakPolarHBondContact O-CG 3.39Å; K90-K94 PolarHBondContact O-N 2.93Å; D91-K94 PolarHBondContact O-N 3.39Å; L92-K94 VanDerWaalsContact C-N 3.31Å |
| 95 | L | 47.4 | Very low | 62.6 | Low | 205 Ų | 205 | 113.3 Ų | 113.3 | 100% | 1.073 | 58% | 0.579 | S | S | * | * | trans | -108.2 | 0 | 173.1 | -88.4 | 150.7 | 0 | 0 | 0 | 109.7 |
Retrieved 95 of 95 residues in 40.7 ms
(Link to these results)