| 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 | T | 42.3 | Very low | 54 | Low | 190 Ų | 190 | 130.8 Ų | 130.8 | 100% | 1.166 | 69% | 0.685 | S | S | * | * | 0 | 95.1 | 0 | 38.5 | 0 | 0 | 0 | 0 | 107.3 | S3 | T1-S3 PolarHBondContact O-N 2.9Š| |||
| 2 | M | 45.7 | Very low | 55.4 | Low | 166 Ų | 166 | 124.3 Ų | 124.3 | 82% | 0.818 | 65% | 0.651 | S | S | * | * | trans | -69.3 | 121.7 | 176.6 | -76.6 | -63.4 | 172.7 | 0 | 0 | 108 | ||||
| 3 | S | 49.3 | Very low | 56.9 | Low | 90 Ų | 90 | 119 Ų | 119 | 63% | 0.629 | 63% | 0.63 | S | S | * | * | trans | -78.2 | 120.7 | -172.1 | 50.8 | 0 | 0 | 0 | 0 | 109.7 | T1 V5 | T1-S3 PolarHBondContact O-N 2.9Å; S3-V5 WeakPolarHBondContact O-CG2 3.39Å; S3-V5 PolarHBondContact O-N 2.99Å | ||
| 4 | H | 51.4 | Low | 58.3 | Low | 132 Ų | 132 | 122.7 Ų | 122.7 | 61% | 0.611 | 64% | 0.638 | S | S | * | * | trans | -53.8 | 108.9 | 175.3 | -174.1 | 62.7 | 0 | 0 | 0 | 111.2 | ||||
| 5 | V | 54.4 | Low | 59.9 | Low | 62 Ų | 62 | 122.3 Ų | 122.3 | 38% | 0.376 | 63% | 0.63 | S | S | . | * | trans | -90 | 114.9 | 175.6 | -175.2 | 0 | 0 | 0 | 0 | 109.6 | S3 | S3-V5 WeakPolarHBondContact O-CG2 3.39Å; S3-V5 PolarHBondContact O-N 2.99Å | ||
| 6 | D | 53.3 | Low | 61 | Low | 102 Ų | 102 | 117.1 Ų | 117.1 | 55% | 0.545 | 60% | 0.602 | S | S | . | * | trans | -62.8 | 134.7 | 173.3 | -102.1 | -38.8 | 0 | 0 | 0 | 111.3 | K8 N9 | D6-K8 PolarHBondContact O-N 3.34Å; D6-N9 PolarHBondContact O-N 2.96Å | ||
| 7 | V | 53.5 | Low | 62 | Low | 99 Ų | 99 | 117.7 Ų | 117.7 | 60% | 0.6 | 60% | 0.602 | S | S | * | * | G | 310 helix | trans | -51.6 | -27.7 | -175 | -176.6 | 0 | 0 | 0 | 0 | 113.6 | N9 T29 | V7-N9 VanDerWaalsContact C-N 3.26Å; V7-N9 PolarHBondContact O-N 3.13Å; V7-T29 HydrophobicContact CB-CG2 4.35Å; V7-T29 HydrophobicContact CG1-CG2 3.97Å; V7-T29 HydrophobicContact CG2-CG2 3.78Å |
| 8 | K | 56 | Low | 63.2 | Low | 204 Ų | 204 | 119.4 Ų | 119.4 | 89% | 0.887 | 61% | 0.607 | S | S | * | * | G | 310 helix | trans | -73.2 | -16 | 179.6 | -65.6 | -178.6 | 179.7 | 179 | 0 | 113.9 | D6 | D6-K8 PolarHBondContact O-N 3.34Š|
| 9 | N | 56.7 | Low | 64.2 | Low | 123 Ų | 123 | 118.8 Ų | 118.8 | 66% | 0.658 | 60% | 0.601 | S | S | * | * | G | 310 helix | trans | -112.3 | 4.5 | -174.6 | -66.1 | -28 | 0 | 0 | 0 | 113.4 | D6 V7 K11 | D6-N9 PolarHBondContact O-N 2.96Å; V7-N9 VanDerWaalsContact C-N 3.26Å; V7-N9 PolarHBondContact O-N 3.13Å; N9-K11 PolarHBondContact O-N 3.29Å; N9-K11 VanDerWaalsContact O-N 3.15Å |
| 10 | L | 64.5 | Low | 65.1 | Low | 71 Ų | 71 | 116.9 Ų | 116.9 | 37% | 0.372 | 59% | 0.587 | S | S | . | * | trans | -76.4 | 102.5 | 176.7 | -170.2 | 68.1 | 0 | 0 | 0 | 109.3 | L12 L28 | L10-L12 PolarHBondContact O-N 3.05Å; L10-L28 HydrophobicContact CD2-CB 4.08Å | ||
| 11 | K | 66.9 | Low | 65.7 | Low | 200 Ų | 200 | 115.2 Ų | 115.2 | 87% | 0.87 | 58% | 0.579 | S | S | * | * | trans | -76.2 | 105.2 | 170 | -72.2 | -171.4 | 176.7 | -175.9 | 0 | 108.6 | N9 | N9-K11 PolarHBondContact O-N 3.29Å; N9-K11 VanDerWaalsContact O-N 3.15Å | ||
| 12 | L | 70.9 | Confident | 67 | Low | 53 Ų | 53 | 113.1 Ų | 113.1 | 28% | 0.277 | 56% | 0.557 | S | S | . | * | trans | -63.9 | 142.4 | 171.1 | -72 | 137.9 | 0 | 0 | 0 | 109.4 | L10 E16 E17 R25 L28 | L10-L12 PolarHBondContact O-N 3.05Å; L12-E16 HydrophobicContact CB-CB 4.4Å; L12-E16 HydrophobicContact CD2-CB 3.74Å; L12-E17 HydrophobicContact CB-CG 3.98Å; L12-R25 HydrophobicContact CD2-CG 4.07Å; L12-L28 HydrophobicContact CD2-CD1 3.73Å | ||
| 13 | S | 75.4 | Confident | 68 | Low | 55 Ų | 55 | 112.6 Ų | 112.6 | 39% | 0.385 | 55% | 0.547 | S | S | . | . | trans | -72.6 | 155.9 | 169.7 | 67.7 | 0 | 0 | 0 | 0 | 110.3 | F15 E16 E17 | S13-F15 PolarHBondContact O-N 2.77Å; S13-F15 VanDerWaalsContact O-N 3.09Å; S13-E16 WeakPolarHBondContact CB-OE2 3.37Å; S13-E16 PolarHBondContact N-OE2 2.71Å; S13-E16 PolarHBondContact O-N 3.25Å; S13-E16 VanDerWaalsContact OG-CD 3.31Å; S13-E16 VanDerWaalsContact OG-CG 3.31Å; S13-E16 WeakPolarHBondContact OG-CG 3.4Å; S13-E16 PolarHBondContact OG-N 3.06Å; S13-E16 PolarHBondContact OG-OE2 3.13Å; S13-E17 PolarHBondContact O-N 3.02Å | ||
| 14 | K | 76.4 | Confident | 69.2 | Low | 171 Ų | 171 | 111.5 Ų | 111.5 | 74% | 0.743 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -55.2 | -30.3 | 176.3 | -166.2 | -179.4 | 179.6 | -173.4 | 0 | 112.8 | E18 | K14-E18 PolarHBondContact O-N 2.87Å |
| 15 | F | 81.2 | Confident | 70.3 | Confident | 116 Ų | 116 | 109.9 Ų | 109.9 | 51% | 0.509 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -66.8 | -48.9 | 175.3 | 177.1 | -96.5 | 0 | 0 | 0 | 111.7 | S13 E17 E18 H19 Y20 | S13-F15 PolarHBondContact O-N 2.77Å; S13-F15 VanDerWaalsContact O-N 3.09Å; F15-E17 VanDerWaalsContact C-N 3.32Å; F15-E17 PolarHBondContact O-N 3.43Å; F15-E18 PolarHBondContact O-N 3.36Å; F15-H19 AromaticContact CD2-CE1 3.74Å; F15-H19 AromaticContact CD2-ND1 3.54Å; F15-H19 HydrophobicContact CE1-CB 4.45Å; F15-H19 AromaticContact CE2-CD2 3.99Å; F15-H19 AromaticContact CE2-CE1 3.82Å; F15-H19 AromaticContact CE2-CG 3.81Å; F15-H19 AromaticContact CE2-ND1 3.68Å; F15-H19 AromaticContact CE2-NE2 3.98Å; F15-H19 HydrophobicContact CZ-CB 4.29Å; F15-H19 WeakPolarHBondContact O-CB 3.49Å; F15-H19 PolarHBondContact O-N 2.97Å; F15-H19 PolarHBondContact O-ND1 3.48Å; F15-Y20 HydrophobicContact CE1-CE1 4.17Å |
| 16 | E | 77.9 | Confident | 70.9 | Confident | 40 Ų | 40 | 110.7 Ų | 110.7 | 19% | 0.187 | 52% | 0.519 | C | S | . | . | H | α-helix | trans | -65.1 | -36.7 | 179.8 | -65.7 | 162.5 | 138.6 | 0 | 0 | 111.3 | L12 S13 E18 Y20 L28 | L12-E16 HydrophobicContact CB-CB 4.4Å; L12-E16 HydrophobicContact CD2-CB 3.74Å; S13-E16 WeakPolarHBondContact CB-OE2 3.37Å; S13-E16 PolarHBondContact N-OE2 2.71Å; S13-E16 PolarHBondContact O-N 3.25Å; S13-E16 VanDerWaalsContact OG-CD 3.31Å; S13-E16 VanDerWaalsContact OG-CG 3.31Å; S13-E16 WeakPolarHBondContact OG-CG 3.4Å; S13-E16 PolarHBondContact OG-N 3.06Å; S13-E16 PolarHBondContact OG-OE2 3.13Å; E16-E18 VanDerWaalsContact C-N 3.28Å; E16-E18 PolarHBondContact O-N 3.25Å; E16-Y20 HydrophobicContact CB-CD2 3.96Å; E16-Y20 HydrophobicContact CB-CE2 4.32Å; E16-Y20 HydrophobicContact CB-CG 4.36Å; E16-Y20 HydrophobicContact CG-CD2 3.91Å; E16-Y20 HydrophobicContact CG-CE2 3.75Å; E16-Y20 WeakPolarHBondContact O-CB 3.49Å; E16-Y20 PolarHBondContact O-N 2.97Å; E16-L28 HydrophobicContact CG-CD1 4.28Å; E16-L28 WeakPolarHBondContact OE1-CD1 3.47Å |
| 17 | E | 78.4 | Confident | 71.5 | Confident | 127 Ų | 127 | 109 Ų | 109 | 59% | 0.593 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -62.4 | -34 | 175.7 | -71 | -177.7 | 171.1 | 0 | 0 | 113.4 | L12 S13 F15 | L12-E17 HydrophobicContact CB-CG 3.98Å; S13-E17 PolarHBondContact O-N 3.02Å; F15-E17 VanDerWaalsContact C-N 3.32Å; F15-E17 PolarHBondContact O-N 3.43Å |
| 18 | E | 83.8 | Confident | 72.1 | Confident | 149 Ų | 149 | 106.9 Ų | 106.9 | 70% | 0.696 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -90.3 | -29.1 | -175.1 | -173.4 | 170.8 | -160.5 | 0 | 0 | 113 | K14 F15 E16 | K14-E18 PolarHBondContact O-N 2.87Å; F15-E18 PolarHBondContact O-N 3.36Å; E16-E18 VanDerWaalsContact C-N 3.28Å; E16-E18 PolarHBondContact O-N 3.25Å |
| 19 | H | 82.1 | Confident | 72.6 | Confident | 107 Ų | 107 | 97.7 Ų | 97.7 | 50% | 0.495 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -110.6 | -19.8 | -171 | -61.4 | 75.8 | 0 | 0 | 0 | 114.1 | F15 | F15-H19 AromaticContact CD2-CE1 3.74Å; F15-H19 AromaticContact CD2-ND1 3.54Å; F15-H19 HydrophobicContact CE1-CB 4.45Å; F15-H19 AromaticContact CE2-CD2 3.99Å; F15-H19 AromaticContact CE2-CE1 3.82Å; F15-H19 AromaticContact CE2-CG 3.81Å; F15-H19 AromaticContact CE2-ND1 3.68Å; F15-H19 AromaticContact CE2-NE2 3.98Å; F15-H19 HydrophobicContact CZ-CB 4.29Å; F15-H19 WeakPolarHBondContact O-CB 3.49Å; F15-H19 PolarHBondContact O-N 2.97Å; F15-H19 PolarHBondContact O-ND1 3.48Å |
| 20 | Y | 81.1 | Confident | 72.6 | Confident | 81 Ų | 81 | 94.1 Ų | 94.1 | 32% | 0.318 | 44% | 0.437 | S | S | . | . | trans | -101 | 132.8 | -175.2 | -70.7 | 4.4 | 0 | 0 | 0 | 111.3 | F15 E16 D24 L28 | F15-Y20 HydrophobicContact CE1-CE1 4.17Å; E16-Y20 HydrophobicContact CB-CD2 3.96Å; E16-Y20 HydrophobicContact CB-CE2 4.32Å; E16-Y20 HydrophobicContact CB-CG 4.36Å; E16-Y20 HydrophobicContact CG-CD2 3.91Å; E16-Y20 HydrophobicContact CG-CE2 3.75Å; E16-Y20 WeakPolarHBondContact O-CB 3.49Å; E16-Y20 PolarHBondContact O-N 2.97Å; Y20-D24 HydrophobicContact CD1-CB 4.35Å; Y20-D24 HydrophobicContact CD2-CB 3.95Å; Y20-D24 HydrophobicContact CG-CB 3.72Å; Y20-L28 HydrophobicContact CD2-CD1 3.7Å; Y20-L28 HydrophobicContact CD2-CG 4.44Å; Y20-L28 HydrophobicContact CE2-CD1 3.81Å; Y20-L28 HydrophobicContact CE2-CD2 4.25Å; Y20-L28 HydrophobicContact CE2-CG 4.27Å | ||
| 21 | D | 78.5 | Confident | 72.2 | Confident | 81 Ų | 81 | 96.9 Ų | 96.9 | 43% | 0.433 | 45% | 0.446 | S | S | . | . | trans | -77.6 | -179.7 | 172.4 | 76.9 | 8.3 | 0 | 0 | 0 | 111.4 | Y23 D24 R25 | D21-Y23 PolarHBondContact O-N 3.45Å; D21-Y23 WeakPolarHBondContact OD1-CA 3.3Å; D21-Y23 VanDerWaalsContact OD1-CB 3.32Å; D21-Y23 WeakPolarHBondContact OD1-CB 3.31Å; D21-Y23 PolarHBondContact OD1-N 3.08Å; D21-D24 PolarHBondContact N-OD2 3.35Å; D21-D24 PolarHBondContact O-N 3.21Å; D21-D24 PolarHBondContact OD1-N 3.22Å; D21-R25 VanDerWaalsContact O-CG 3.3Å; D21-R25 WeakPolarHBondContact O-CG 3.43Å; D21-R25 PolarHBondContact O-N 2.98Å; D21-R25 VanDerWaalsContact O-N 3.17Å | ||
| 22 | E | 68.7 | Low | 71.5 | Confident | 147 Ų | 147 | 89.8 Ų | 89.8 | 69% | 0.687 | 41% | 0.414 | S | S | * | . | H | α-helix | trans | -61 | -29 | 178.7 | -168.6 | 175.6 | -174.8 | 0 | 0 | 113.6 | Y26 | E22-Y26 PolarHBondContact O-N 2.86Å |
| 23 | Y | 67.6 | Low | 70.8 | Confident | 155 Ų | 155 | 90.1 Ų | 90.1 | 61% | 0.608 | 43% | 0.425 | S | S | * | . | H | α-helix | trans | -77.6 | -40.9 | 179.7 | -67 | -81.1 | 0 | 0 | 0 | 112 | D21 R25 Y26 N27 | D21-Y23 PolarHBondContact O-N 3.45Å; D21-Y23 WeakPolarHBondContact OD1-CA 3.3Å; D21-Y23 VanDerWaalsContact OD1-CB 3.32Å; D21-Y23 WeakPolarHBondContact OD1-CB 3.31Å; D21-Y23 PolarHBondContact OD1-N 3.08Å; Y23-R25 VanDerWaalsContact C-N 3.33Å; Y23-R25 PolarHBondContact O-N 3.08Å; Y23-Y26 WeakPolarHBondContact O-CB 3.38Å; Y23-Y26 PolarHBondContact O-N 3.09Å; Y23-N27 PolarHBondContact O-N 2.99Å; Y23-N27 PolarHBondContact O-ND2 3.02Å |
| 24 | D | 75.1 | Confident | 69.9 | Low | 67 Ų | 67 | 93.1 Ų | 93.1 | 36% | 0.358 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -60.7 | -44 | 175.4 | -71.1 | -32.1 | 0 | 0 | 0 | 110.9 | Y20 D21 Y26 N27 L28 | Y20-D24 HydrophobicContact CD1-CB 4.35Å; Y20-D24 HydrophobicContact CD2-CB 3.95Å; Y20-D24 HydrophobicContact CG-CB 3.72Å; D21-D24 PolarHBondContact N-OD2 3.35Å; D21-D24 PolarHBondContact O-N 3.21Å; D21-D24 PolarHBondContact OD1-N 3.22Å; D24-Y26 VanDerWaalsContact C-N 3.29Å; D24-Y26 PolarHBondContact O-N 3Å; D24-N27 PolarHBondContact O-N 3.4Å; D24-N27 VanDerWaalsContact O-N 3.16Å; D24-L28 PolarHBondContact O-N 3.03Å |
| 25 | R | 74 | Confident | 68.8 | Low | 97 Ų | 97 | 86.8 Ų | 86.8 | 37% | 0.366 | 42% | 0.416 | S | S | . | . | H | α-helix | trans | -62.4 | -34.2 | 176.9 | -65.8 | -178.8 | -50.6 | -137.4 | 7.1 | 113.3 | L12 D21 Y23 N27 L28 | L12-R25 HydrophobicContact CD2-CG 4.07Å; D21-R25 VanDerWaalsContact O-CG 3.3Å; D21-R25 WeakPolarHBondContact O-CG 3.43Å; D21-R25 PolarHBondContact O-N 2.98Å; D21-R25 VanDerWaalsContact O-N 3.17Å; Y23-R25 VanDerWaalsContact C-N 3.33Å; Y23-R25 PolarHBondContact O-N 3.08Å; R25-N27 VanDerWaalsContact C-N 3.26Å; R25-N27 PolarHBondContact O-N 3.44Å; R25-L28 PolarHBondContact O-N 3.48Å |
| 26 | Y | 66.6 | Low | 67.4 | Low | 79 Ų | 79 | 86 Ų | 86 | 31% | 0.31 | 43% | 0.425 | S | S | . | . | H | α-helix | trans | -65.1 | -33.6 | 178.3 | -175.9 | -86.1 | 0 | 0 | 0 | 111.9 | E22 Y23 D24 T29 Y32 K44 | E22-Y26 PolarHBondContact O-N 2.86Å; Y23-Y26 WeakPolarHBondContact O-CB 3.38Å; Y23-Y26 PolarHBondContact O-N 3.09Å; D24-Y26 VanDerWaalsContact C-N 3.29Å; D24-Y26 PolarHBondContact O-N 3Å; Y26-T29 PolarHBondContact O-OG1 3.19Å; Y26-Y32 HydrophobicContact CD1-CD2 4.5Å; Y26-Y32 HydrophobicContact CE1-CD1 4.38Å; Y26-Y32 AromaticContact CE1-CD2 3.79Å; Y26-Y32 HydrophobicContact CE1-CD2 3.79Å; Y26-Y32 HydrophobicContact CE1-CE1 4.47Å; Y26-Y32 AromaticContact CE1-CE2 3.89Å; Y26-Y32 HydrophobicContact CE1-CE2 3.89Å; Y26-Y32 HydrophobicContact CE1-CG 4.09Å; Y26-Y32 HydrophobicContact CE2-CE2 4.49Å; Y26-Y32 AromaticContact CZ-CE2 3.67Å; Y26-Y32 AromaticContact CZ-CZ 3.98Å; Y26-Y32 WeakPolarHBondContact OH-CE2 3.45Å; Y26-Y32 VanDerWaalsContact OH-CZ 3.22Å; Y26-Y32 PolarHBondContact OH-OH 3.32Å; Y26-K44 HydrophobicContact CD1-CD 3.66Å; Y26-K44 HydrophobicContact CD1-CG 4.29Å; Y26-K44 HydrophobicContact CE1-CB 3.8Å; Y26-K44 HydrophobicContact CE1-CD 3.34Å; Y26-K44 HydrophobicContact CE1-CG 3.5Å |
| 27 | N | 66.2 | Low | 66.2 | Low | 66 Ų | 66 | 85 Ų | 85 | 35% | 0.353 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -77.6 | -19.1 | -178.7 | -64.5 | -32 | 0 | 0 | 0 | 113.6 | Y23 D24 R25 T29 | Y23-N27 PolarHBondContact O-N 2.99Å; Y23-N27 PolarHBondContact O-ND2 3.02Å; D24-N27 PolarHBondContact O-N 3.4Å; D24-N27 VanDerWaalsContact O-N 3.16Å; R25-N27 VanDerWaalsContact C-N 3.26Å; R25-N27 PolarHBondContact O-N 3.44Å; N27-T29 PolarHBondContact O-N 3.45Å |
| 28 | L | 67.1 | Low | 65.6 | Low | 56 Ų | 56 | 89.7 Ų | 89.7 | 29% | 0.293 | 44% | 0.435 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -72.9 | -7.2 | 177 | -73.7 | 172 | 0 | 0 | 0 | 114 | L10 L12 E16 Y20 D24 R25 | L10-L28 HydrophobicContact CD2-CB 4.08Å; L12-L28 HydrophobicContact CD2-CD1 3.73Å; E16-L28 HydrophobicContact CG-CD1 4.28Å; E16-L28 WeakPolarHBondContact OE1-CD1 3.47Å; Y20-L28 HydrophobicContact CD2-CD1 3.7Å; Y20-L28 HydrophobicContact CD2-CG 4.44Å; Y20-L28 HydrophobicContact CE2-CD1 3.81Å; Y20-L28 HydrophobicContact CE2-CD2 4.25Å; Y20-L28 HydrophobicContact CE2-CG 4.27Å; D24-L28 PolarHBondContact O-N 3.03Å; R25-L28 PolarHBondContact O-N 3.48Å |
| 29 | T | 64.9 | Low | 64.7 | Low | 11 Ų | 11 | 91.7 Ų | 91.7 | 7% | 0.067 | 44% | 0.442 | C | S | . | . | S | Bend | trans | -80.9 | 134.3 | 179.8 | 61.5 | 0 | 0 | 0 | 0 | 111 | V7 Y26 N27 K31 Y32 A33 | V7-T29 HydrophobicContact CB-CG2 4.35Å; V7-T29 HydrophobicContact CG1-CG2 3.97Å; V7-T29 HydrophobicContact CG2-CG2 3.78Å; Y26-T29 PolarHBondContact O-OG1 3.19Å; N27-T29 PolarHBondContact O-N 3.45Å; T29-K31 PolarHBondContact O-N 3.4Å; T29-Y32 PolarHBondContact O-N 3.49Å; T29-Y32 WeakPolarHBondContact OG1-CD2 3.33Å; T29-A33 PolarHBondContact O-N 3.43Å |
| 30 | D | 57 | Low | 63.8 | Low | 47 Ų | 47 | 90 Ų | 90 | 25% | 0.251 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -53.3 | -33 | -173.8 | -127.7 | 0.4 | 0 | 0 | 0 | 113.2 | Y32 E34 | D30-Y32 PolarHBondContact O-N 3.31Å; D30-E34 PolarHBondContact O-N 3.07Å |
| 31 | K | 56.5 | Low | 63.1 | Low | 130 Ų | 130 | 91.1 Ų | 91.1 | 57% | 0.565 | 46% | 0.457 | S | S | * | . | H | α-helix | trans | -58.2 | -34.9 | 175.9 | -169.9 | 177.4 | -179 | -178.1 | 0 | 112.8 | T29 K43 | T29-K31 PolarHBondContact O-N 3.4Å; K31-K43 WeakPolarHBondContact O-CD 3.33Å; K31-K43 PolarHBondContact O-NZ 3.06Å |
| 32 | Y | 53.2 | Low | 62.5 | Low | 50 Ų | 50 | 89.9 Ų | 89.9 | 20% | 0.196 | 45% | 0.452 | C | S | . | . | H | α-helix | trans | -107.8 | -17.5 | -176.5 | -61.1 | -73.7 | 0 | 0 | 0 | 113.5 | Y26 T29 D30 K43 K44 | Y26-Y32 HydrophobicContact CD1-CD2 4.5Å; Y26-Y32 HydrophobicContact CE1-CD1 4.38Å; Y26-Y32 AromaticContact CE1-CD2 3.79Å; Y26-Y32 HydrophobicContact CE1-CD2 3.79Å; Y26-Y32 HydrophobicContact CE1-CE1 4.47Å; Y26-Y32 AromaticContact CE1-CE2 3.89Å; Y26-Y32 HydrophobicContact CE1-CE2 3.89Å; Y26-Y32 HydrophobicContact CE1-CG 4.09Å; Y26-Y32 HydrophobicContact CE2-CE2 4.49Å; Y26-Y32 AromaticContact CZ-CE2 3.67Å; Y26-Y32 AromaticContact CZ-CZ 3.98Å; Y26-Y32 WeakPolarHBondContact OH-CE2 3.45Å; Y26-Y32 VanDerWaalsContact OH-CZ 3.22Å; Y26-Y32 PolarHBondContact OH-OH 3.32Å; T29-Y32 PolarHBondContact O-N 3.49Å; T29-Y32 WeakPolarHBondContact OG1-CD2 3.33Å; D30-Y32 PolarHBondContact O-N 3.31Å; Y32-K43 HydrophobicContact CD1-CB 3.65Å; Y32-K43 HydrophobicContact CE1-CB 4.42Å; Y32-K44 HydrophobicContact CD1-CB 4.41Å |
| 33 | A | 54.5 | Low | 62.4 | Low | 61 Ų | 61 | 86 Ų | 86 | 50% | 0.504 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -74.6 | -35 | 176.5 | 0 | 0 | 0 | 0 | 0 | 113.6 | T29 G35 | T29-A33 PolarHBondContact O-N 3.43Å; A33-G35 VanDerWaalsContact C-N 3.31Å; A33-G35 PolarHBondContact O-N 2.87Å |
| 34 | E | 56.3 | Low | 62.3 | Low | 118 Ų | 118 | 80.9 Ų | 80.9 | 55% | 0.551 | 41% | 0.414 | S | S | * | . | S | Bend | trans | -82.8 | 63.3 | -174.2 | -68.8 | -168.9 | 149.3 | 0 | 0 | 114.1 | D30 K43 | D30-E34 PolarHBondContact O-N 3.07Å; E34-K43 VanDerWaalsContact C-NZ 3.27Å; E34-K43 WeakPolarHBondContact O-CE 3.41Å; E34-K43 PolarHBondContact O-NZ 3.37Å |
| 35 | G | 53.9 | Low | 61.7 | Low | 38 Ų | 38 | 81.8 Ų | 81.8 | 39% | 0.392 | 42% | 0.416 | S | S | . | . | trans | 134.1 | 125.7 | 158.7 | 0 | 0 | 0 | 0 | 0 | 114.7 | A33 A37 K43 | A33-G35 VanDerWaalsContact C-N 3.31Å; A33-G35 PolarHBondContact O-N 2.87Å; G35-A37 PolarHBondContact O-N 2.9Å; G35-K43 WeakPolarHBondContact O-CG 3.35Å | ||
| 36 | S | 52.3 | Low | 61.5 | Low | 99 Ų | 99 | 78.2 Ų | 78.2 | 69% | 0.692 | 41% | 0.407 | S | S | * | . | trans | -45.7 | 112 | 160.4 | 166.9 | 0 | 0 | 0 | 0 | 109.3 | R38 | S36-R38 PolarHBondContact O-N 2.94Š| ||
| 37 | A | 52.8 | Low | 61.4 | Low | 18 Ų | 18 | 77.7 Ų | 77.7 | 15% | 0.149 | 42% | 0.415 | C | S | . | . | B | Isolated β-bridge | trans | -63.1 | 131.3 | 166.5 | 0 | 0 | 0 | 0 | 0 | 106.5 | G35 K39 G40 R41 A46 | G35-A37 PolarHBondContact O-N 2.9Å; A37-K39 PolarHBondContact O-N 3.11Å; A37-G40 PolarHBondContact O-N 2.57Å; A37-R41 WeakPolarHBondContact CA-O 3.48Å; A37-R41 HydrophobicContact CB-CB 4.28Å; A37-R41 VanDerWaalsContact CB-O 3.24Å; A37-R41 WeakPolarHBondContact CB-O 3.45Å; A37-R41 PolarHBondContact N-O 3.25Å; A37-R41 PolarHBondContact O-N 2.8Å; A37-A46 HydrophobicContact CB-CB 3.61Å |
| 38 | R | 66.2 | Low | 61.4 | Low | 227 Ų | 227 | 77.8 Ų | 77.8 | 86% | 0.857 | 42% | 0.416 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -45.8 | 134.4 | -174 | -65.3 | -175.1 | -174 | 175.1 | 2.1 | 110.6 | S36 R41 | S36-R38 PolarHBondContact O-N 2.94Å; R38-R41 PolarHBondContact O-NH2 2.84Å |
| 39 | K | 65 | Low | 61.4 | Low | 190 Ų | 190 | 80.7 Ų | 80.7 | 83% | 0.826 | 43% | 0.431 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 79.8 | 41.5 | -173.5 | -156.2 | 170.2 | 179.7 | 176.8 | 0 | 114.3 | A37 R41 | A37-K39 PolarHBondContact O-N 3.11Å; K39-R41 PolarHBondContact O-N 2.97Å; K39-R41 VanDerWaalsContact O-N 3.15Å |
| 40 | G | 63.1 | Low | 61.3 | Low | 71 Ų | 71 | 84.1 Ų | 84.1 | 73% | 0.732 | 45% | 0.452 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 64.7 | 20.8 | 168.7 | 0 | 0 | 0 | 0 | 0 | 115.1 | A37 | A37-G40 PolarHBondContact O-N 2.57Š|
| 41 | R | 64.8 | Low | 61.5 | Low | 105 Ų | 105 | 88.1 Ų | 88.1 | 40% | 0.396 | 47% | 0.474 | S | S | . | . | B | Isolated β-bridge | trans | -98.6 | 149.3 | -179.3 | -75.4 | 176.7 | -68.3 | 166.6 | 2.6 | 110.2 | A37 R38 K39 E45 | A37-R41 WeakPolarHBondContact CA-O 3.48Å; A37-R41 HydrophobicContact CB-CB 4.28Å; A37-R41 VanDerWaalsContact CB-O 3.24Å; A37-R41 WeakPolarHBondContact CB-O 3.45Å; A37-R41 PolarHBondContact N-O 3.25Å; A37-R41 PolarHBondContact O-N 2.8Å; R38-R41 PolarHBondContact O-NH2 2.84Å; K39-R41 PolarHBondContact O-N 2.97Å; K39-R41 VanDerWaalsContact O-N 3.15Å; R41-E45 WeakPolarHBondContact CA-OE2 3.45Å; R41-E45 HydrophobicContact CB-CB 4.15Å; R41-E45 WeakPolarHBondContact CB-OE2 3.21Å; R41-E45 HydrophobicContact CG-CB 4.47Å |
| 42 | T | 66.4 | Low | 61.9 | Low | 55 Ų | 55 | 90.6 Ų | 90.6 | 34% | 0.337 | 48% | 0.48 | S | S | . | . | trans | -69.1 | 154.4 | 167.3 | 70.3 | 0 | 0 | 0 | 0 | 109.7 | K44 E45 A46 | T42-K44 PolarHBondContact O-N 2.97Å; T42-E45 PolarHBondContact N-OE2 3.16Å; T42-E45 PolarHBondContact O-N 2.82Å; T42-E45 VanDerWaalsContact O-N 3.16Å; T42-E45 VanDerWaalsContact OG1-CG 3.27Å; T42-E45 WeakPolarHBondContact OG1-CG 3.37Å; T42-E45 PolarHBondContact OG1-N 3.12Å; T42-E45 VanDerWaalsContact OG1-N 3.12Å; T42-A46 PolarHBondContact O-N 3.28Å | ||
| 43 | K | 66.4 | Low | 62.4 | Low | 66 Ų | 66 | 97.4 Ų | 97.4 | 29% | 0.287 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -58.9 | -28.5 | 174.4 | -79 | -179.9 | -179.3 | 177.9 | 0 | 112.4 | K31 Y32 E34 G35 S47 | K31-K43 WeakPolarHBondContact O-CD 3.33Å; K31-K43 PolarHBondContact O-NZ 3.06Å; Y32-K43 HydrophobicContact CD1-CB 3.65Å; Y32-K43 HydrophobicContact CE1-CB 4.42Å; E34-K43 VanDerWaalsContact C-NZ 3.27Å; E34-K43 WeakPolarHBondContact O-CE 3.41Å; E34-K43 PolarHBondContact O-NZ 3.37Å; G35-K43 WeakPolarHBondContact O-CG 3.35Å; K43-S47 WeakPolarHBondContact O-CB 3.41Å; K43-S47 PolarHBondContact O-N 3.21Å |
| 44 | K | 66.2 | Low | 62.6 | Low | 47 Ų | 47 | 97.6 Ų | 97.6 | 20% | 0.204 | 51% | 0.506 | C | S | . | . | H | α-helix | trans | -65.2 | -53.3 | 172.3 | -168.4 | -168.9 | -170.3 | 169.6 | 0 | 111.1 | Y26 Y32 T42 A46 S47 D48 | Y26-K44 HydrophobicContact CD1-CD 3.66Å; Y26-K44 HydrophobicContact CD1-CG 4.29Å; Y26-K44 HydrophobicContact CE1-CB 3.8Å; Y26-K44 HydrophobicContact CE1-CD 3.34Å; Y26-K44 HydrophobicContact CE1-CG 3.5Å; Y32-K44 HydrophobicContact CD1-CB 4.41Å; T42-K44 PolarHBondContact O-N 2.97Å; K44-A46 PolarHBondContact O-N 2.96Å; K44-S47 CarbonylContact O-C 3.55Å; K44-S47 WeakPolarHBondContact O-CA 3.35Å; K44-S47 WeakPolarHBondContact O-CB 3.29Å; K44-S47 PolarHBondContact O-N 3.25Å; K44-D48 PolarHBondContact O-N 3.18Å |
| 45 | E | 63.1 | Low | 63.1 | Low | 87 Ų | 87 | 98.5 Ų | 98.5 | 41% | 0.407 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -57.4 | -38.6 | 177.2 | -74.1 | 172.4 | 155.9 | 0 | 0 | 111.8 | R41 T42 N49 | R41-E45 WeakPolarHBondContact CA-OE2 3.45Å; R41-E45 HydrophobicContact CB-CB 4.15Å; R41-E45 WeakPolarHBondContact CB-OE2 3.21Å; R41-E45 HydrophobicContact CG-CB 4.47Å; T42-E45 PolarHBondContact N-OE2 3.16Å; T42-E45 PolarHBondContact O-N 2.82Å; T42-E45 VanDerWaalsContact O-N 3.16Å; T42-E45 VanDerWaalsContact OG1-CG 3.27Å; T42-E45 WeakPolarHBondContact OG1-CG 3.37Å; T42-E45 PolarHBondContact OG1-N 3.12Å; T42-E45 VanDerWaalsContact OG1-N 3.12Å; E45-N49 WeakPolarHBondContact O-CB 3.43Å; E45-N49 PolarHBondContact O-N 3.15Å; E45-N49 PolarHBondContact O-ND2 3.28Å |
| 46 | A | 68.3 | Low | 63.8 | Low | 22 Ų | 22 | 98.1 Ų | 98.1 | 18% | 0.182 | 52% | 0.515 | C | S | . | . | H | α-helix | trans | -63.6 | -45.7 | 173.4 | 0 | 0 | 0 | 0 | 0 | 111.5 | A37 T42 K44 N49 T50 | A37-A46 HydrophobicContact CB-CB 3.61Å; T42-A46 PolarHBondContact O-N 3.28Å; K44-A46 PolarHBondContact O-N 2.96Å; A46-N49 CarbonylContact O-C 3.58Å; A46-T50 VanDerWaalsContact O-CB 3.29Å; A46-T50 WeakPolarHBondContact O-CB 3.18Å; A46-T50 PolarHBondContact O-N 3.18Å; A46-T50 PolarHBondContact O-OG1 2.64Å |
| 47 | S | 66.1 | Low | 64.7 | Low | 67 Ų | 67 | 94.4 Ų | 94.4 | 47% | 0.469 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -62 | -49.1 | 177.5 | -178.9 | 0 | 0 | 0 | 0 | 112.3 | K43 K44 N49 T50 | K43-S47 WeakPolarHBondContact O-CB 3.41Å; K43-S47 PolarHBondContact O-N 3.21Å; K44-S47 CarbonylContact O-C 3.55Å; K44-S47 WeakPolarHBondContact O-CA 3.35Å; K44-S47 WeakPolarHBondContact O-CB 3.29Å; K44-S47 PolarHBondContact O-N 3.25Å; S47-N49 VanDerWaalsContact C-N 3.28Å; S47-N49 PolarHBondContact O-N 3.36Å; S47-T50 PolarHBondContact O-N 2.88Å; S47-T50 VanDerWaalsContact O-N 3.11Å |
| 48 | D | 66.4 | Low | 66 | Low | 69 Ų | 69 | 100.2 Ų | 100.2 | 37% | 0.369 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -68.4 | -30.2 | -176.3 | -69.6 | -14.5 | 0 | 0 | 0 | 112.2 | K44 R52 | K44-D48 PolarHBondContact O-N 3.18Å; D48-R52 VanDerWaalsContact O-CZ 3.26Å; D48-R52 PolarHBondContact O-NE 3.06Å; D48-R52 PolarHBondContact O-NH2 3.25Å |
| 49 | N | 65.9 | Low | 66.7 | Low | 117 Ų | 117 | 95.4 Ų | 95.4 | 63% | 0.626 | 50% | 0.504 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -95.9 | 5.9 | 174.7 | -66.1 | -65.7 | 0 | 0 | 0 | 113.6 | E45 A46 S47 | E45-N49 WeakPolarHBondContact O-CB 3.43Å; E45-N49 PolarHBondContact O-N 3.15Å; E45-N49 PolarHBondContact O-ND2 3.28Å; A46-N49 CarbonylContact O-C 3.58Å; S47-N49 VanDerWaalsContact C-N 3.28Å; S47-N49 PolarHBondContact O-N 3.36Å |
| 50 | T | 64.1 | Low | 67.6 | Low | 82 Ų | 82 | 93 Ų | 93 | 50% | 0.503 | 49% | 0.489 | S | S | . | . | S | Bend | trans | -83.6 | 129 | 173.9 | -71.1 | 0 | 0 | 0 | 0 | 109.9 | A46 S47 R52 | A46-T50 VanDerWaalsContact O-CB 3.29Å; A46-T50 WeakPolarHBondContact O-CB 3.18Å; A46-T50 PolarHBondContact O-N 3.18Å; A46-T50 PolarHBondContact O-OG1 2.64Å; S47-T50 PolarHBondContact O-N 2.88Å; S47-T50 VanDerWaalsContact O-N 3.11Å; T50-R52 VanDerWaalsContact C-N 3.33Å; T50-R52 PolarHBondContact O-N 3.32Å |
| 51 | N | 60.9 | Low | 68.6 | Low | 132 Ų | 132 | 94.5 Ų | 94.5 | 71% | 0.706 | 48% | 0.475 | S | S | * | . | trans | 16.9 | 65.1 | 163.3 | -67 | -45.4 | 0 | 0 | 0 | 115.8 | Q53 | N51-Q53 PolarHBondContact O-N 2.84Š| ||
| 52 | R | 63.7 | Low | 69.7 | Low | 182 Ų | 182 | 93.8 Ų | 93.8 | 69% | 0.687 | 48% | 0.479 | S | S | * | . | trans | -63.9 | 134.2 | 162.9 | -63.2 | -177.9 | -172.5 | -174.7 | -0.7 | 107.4 | D48 T50 N54 | D48-R52 VanDerWaalsContact O-CZ 3.26Å; D48-R52 PolarHBondContact O-NE 3.06Å; D48-R52 PolarHBondContact O-NH2 3.25Å; T50-R52 VanDerWaalsContact C-N 3.33Å; T50-R52 PolarHBondContact O-N 3.32Å; R52-N54 PolarHBondContact O-N 3.36Å | ||
| 53 | Q | 63.8 | Low | 70.8 | Confident | 193 Ų | 193 | 94.8 Ų | 94.8 | 90% | 0.902 | 49% | 0.485 | S | S | * | . | trans | -66 | 79.2 | 171.9 | -69.7 | -69.1 | -5.6 | 0 | 0 | 108.5 | N51 | N51-Q53 PolarHBondContact O-N 2.84Š| ||
| 54 | N | 59.3 | Low | 71.9 | Confident | 65 Ų | 65 | 97.2 Ų | 97.2 | 35% | 0.348 | 50% | 0.497 | S | S | . | . | trans | -87.8 | 128.6 | 168.8 | -178.2 | -43.6 | 0 | 0 | 0 | 106 | R52 A56 G57 R60 | R52-N54 PolarHBondContact O-N 3.36Å; N54-A56 PolarHBondContact O-N 3.25Å; N54-A56 PolarHBondContact OD1-N 3.31Å; N54-G57 WeakPolarHBondContact O-CA 3.27Å; N54-G57 PolarHBondContact O-N 3.43Å; N54-R60 VanDerWaalsContact CB-NH2 3.26Å; N54-R60 PolarHBondContact ND2-NH2 3.33Å | ||
| 55 | P | 66.9 | Low | 73.1 | Confident | 136 Ų | 136 | 101.2 Ų | 101.2 | 88% | 0.883 | 51% | 0.514 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -55.7 | -20.9 | -179.8 | 20.1 | -31.2 | 0 | 0 | 0 | 113.6 | ||
| 56 | A | 67.6 | Low | 74.6 | Confident | 30 Ų | 30 | 102 Ų | 102 | 25% | 0.248 | 52% | 0.521 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -109 | 18.9 | 172.7 | 0 | 0 | 0 | 0 | 0 | 113.7 | N54 R60 | N54-A56 PolarHBondContact O-N 3.25Å; N54-A56 PolarHBondContact OD1-N 3.31Å; A56-R60 WeakPolarHBondContact O-CB 3.24Å; A56-R60 WeakPolarHBondContact O-CG 2.93Å; A56-R60 PolarHBondContact O-N 3.41Å; A56-R60 VanDerWaalsContact O-N 3.13Å; A56-R60 PolarHBondContact O-NE 2.94Å |
| 57 | G | 72.8 | Confident | 75.8 | Confident | 22 Ų | 22 | 105.8 Ų | 105.8 | 23% | 0.227 | 54% | 0.535 | C | S | . | . | H | α-helix | trans | -67.2 | -37.1 | -179.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | N54 K61 | N54-G57 WeakPolarHBondContact O-CA 3.27Å; N54-G57 PolarHBondContact O-N 3.43Å; G57-K61 VanDerWaalsContact O-CB 3.3Å; G57-K61 WeakPolarHBondContact O-CB 3.34Å; G57-K61 PolarHBondContact O-N 2.88Å |
| 58 | H | 78.8 | Confident | 77 | Confident | 139 Ų | 139 | 106 Ų | 106 | 64% | 0.644 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -65.2 | -48.6 | 177.7 | -172.8 | 65.2 | 0 | 0 | 0 | 111.5 | K61 I62 | H58-K61 PolarHBondContact O-N 3.02Å; H58-I62 WeakPolarHBondContact NE2-CD1 3.43Å; H58-I62 WeakPolarHBondContact O-CG1 3.34Å; H58-I62 PolarHBondContact O-N 3.49Å |
| 59 | E | 82 | Confident | 78.3 | Confident | 127 Ų | 127 | 106.2 Ų | 106.2 | 59% | 0.593 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -61 | -48.9 | 179 | -64.8 | 165.6 | 177.1 | 0 | 0 | 111.4 | K61 I62 V63 | E59-K61 VanDerWaalsContact C-N 3.3Å; E59-K61 PolarHBondContact O-N 3.39Å; E59-I62 PolarHBondContact O-N 2.95Å; E59-I62 VanDerWaalsContact O-N 3.13Å; E59-V63 WeakPolarHBondContact O-CG2 3.43Å; E59-V63 PolarHBondContact O-N 3.3Å |
| 60 | R | 83.2 | Confident | 79.6 | Confident | 139 Ų | 139 | 105.5 Ų | 105.5 | 53% | 0.525 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -59.3 | -40.3 | 176.3 | -73.4 | -177.8 | -60.3 | 150.6 | 11.8 | 112.6 | N54 A56 I62 V63 E64 | N54-R60 VanDerWaalsContact CB-NH2 3.26Å; N54-R60 PolarHBondContact ND2-NH2 3.33Å; A56-R60 WeakPolarHBondContact O-CB 3.24Å; A56-R60 WeakPolarHBondContact O-CG 2.93Å; A56-R60 PolarHBondContact O-N 3.41Å; A56-R60 VanDerWaalsContact O-N 3.13Å; A56-R60 PolarHBondContact O-NE 2.94Å; R60-I62 VanDerWaalsContact C-N 3.33Å; R60-I62 PolarHBondContact O-N 2.93Å; R60-V63 PolarHBondContact O-N 3.25Å; R60-E64 VanDerWaalsContact O-CB 3.31Å; R60-E64 WeakPolarHBondContact O-CB 3.2Å; R60-E64 PolarHBondContact O-N 3.17Å |
| 61 | K | 84 | Confident | 80.9 | Confident | 102 Ų | 102 | 108.3 Ų | 108.3 | 44% | 0.443 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -64.8 | -37.4 | 177.2 | -175.7 | 175.4 | -174.2 | 173.4 | 0 | 112.2 | G57 H58 E59 K65 | G57-K61 VanDerWaalsContact O-CB 3.3Å; G57-K61 WeakPolarHBondContact O-CB 3.34Å; G57-K61 PolarHBondContact O-N 2.88Å; H58-K61 PolarHBondContact O-N 3.02Å; E59-K61 VanDerWaalsContact C-N 3.3Å; E59-K61 PolarHBondContact O-N 3.39Å; K61-K65 WeakPolarHBondContact O-CB 3.34Å; K61-K65 WeakPolarHBondContact O-CG 3.3Å; K61-K65 PolarHBondContact O-N 3.36Å; K61-K65 VanDerWaalsContact O-N 3.08Å |
| 62 | I | 87.3 | Confident | 82.2 | Confident | 90 Ų | 90 | 109.4 Ų | 109.4 | 46% | 0.462 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -66.4 | -48.7 | 175.2 | -69.7 | 170.3 | 0 | 0 | 0 | 110 | H58 E59 R60 E64 K65 L66 | H58-I62 WeakPolarHBondContact NE2-CD1 3.43Å; H58-I62 WeakPolarHBondContact O-CG1 3.34Å; H58-I62 PolarHBondContact O-N 3.49Å; E59-I62 PolarHBondContact O-N 2.95Å; E59-I62 VanDerWaalsContact O-N 3.13Å; R60-I62 VanDerWaalsContact C-N 3.33Å; R60-I62 PolarHBondContact O-N 2.93Å; I62-E64 VanDerWaalsContact C-N 3.35Å; I62-E64 PolarHBondContact O-N 3.39Å; I62-K65 PolarHBondContact O-N 2.85Å; I62-L66 PolarHBondContact O-N 3.39Å |
| 63 | V | 89.4 | Confident | 83.2 | Confident | 77 Ų | 77 | 104.8 Ų | 104.8 | 47% | 0.467 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -58.6 | -46.4 | 178.4 | 173.2 | 0 | 0 | 0 | 0 | 111.2 | E59 R60 K65 L66 Q67 | E59-V63 WeakPolarHBondContact O-CG2 3.43Å; E59-V63 PolarHBondContact O-N 3.3Å; R60-V63 PolarHBondContact O-N 3.25Å; V63-K65 PolarHBondContact O-N 2.92Å; V63-L66 PolarHBondContact O-N 3.05Å; V63-Q67 HydrophobicContact CG1-CG 4.44Å; V63-Q67 WeakPolarHBondContact O-CG 3.47Å; V63-Q67 PolarHBondContact O-N 3.38Å |
| 64 | E | 89.8 | Confident | 83.8 | Confident | 116 Ų | 116 | 104.1 Ų | 104.1 | 54% | 0.542 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -63 | -40.9 | 179 | -174.4 | -179.9 | -171.4 | 0 | 0 | 112.1 | R60 I62 N68 | R60-E64 VanDerWaalsContact O-CB 3.31Å; R60-E64 WeakPolarHBondContact O-CB 3.2Å; R60-E64 PolarHBondContact O-N 3.17Å; I62-E64 VanDerWaalsContact C-N 3.35Å; I62-E64 PolarHBondContact O-N 3.39Å; E64-N68 WeakPolarHBondContact O-CB 3.32Å; E64-N68 VanDerWaalsContact O-CG 3.24Å; E64-N68 PolarHBondContact O-N 3.01Å; E64-N68 PolarHBondContact O-ND2 3.46Å; E64-N68 VanDerWaalsContact O-ND2 3.09Å |
| 65 | K | 91.8 | Very high | 84.1 | Confident | 131 Ų | 131 | 111.8 Ų | 111.8 | 57% | 0.57 | 56% | 0.563 | S | S | * | * | H | α-helix | trans | -61.8 | -43.9 | 174.2 | -80.9 | -177.9 | 174.8 | -170 | 0 | 111.8 | K61 I62 V63 N68 S69 | K61-K65 WeakPolarHBondContact O-CB 3.34Å; K61-K65 WeakPolarHBondContact O-CG 3.3Å; K61-K65 PolarHBondContact O-N 3.36Å; K61-K65 VanDerWaalsContact O-N 3.08Å; I62-K65 PolarHBondContact O-N 2.85Å; V63-K65 PolarHBondContact O-N 2.92Å; K65-N68 PolarHBondContact O-N 3.04Å; K65-S69 WeakPolarHBondContact O-CB 3.42Å; K65-S69 PolarHBondContact O-N 2.8Å; K65-S69 PolarHBondContact O-OG 2.84Å; K65-S69 VanDerWaalsContact O-OG 3.08Å |
| 66 | L | 94.2 | Very high | 84.9 | Confident | 105 Ų | 105 | 110.6 Ų | 110.6 | 55% | 0.55 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -61.4 | -51.2 | 179.3 | -173 | 67.3 | 0 | 0 | 0 | 110.8 | I62 V63 N68 S69 E70 | I62-L66 PolarHBondContact O-N 3.39Å; V63-L66 PolarHBondContact O-N 3.05Å; L66-N68 VanDerWaalsContact C-N 3.33Å; L66-N68 PolarHBondContact O-N 3.48Å; L66-S69 PolarHBondContact O-N 3.16Å; L66-E70 WeakPolarHBondContact O-CG 3.43Å; L66-E70 PolarHBondContact O-N 3.24Å |
| 67 | Q | 93.3 | Very high | 85.9 | Confident | 100 Ų | 100 | 114.8 Ų | 114.8 | 47% | 0.467 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -59.3 | -40.8 | 178.5 | -71 | 178.1 | -12.7 | 0 | 0 | 112.8 | V63 E70 K71 | V63-Q67 HydrophobicContact CG1-CG 4.44Å; V63-Q67 WeakPolarHBondContact O-CG 3.47Å; V63-Q67 PolarHBondContact O-N 3.38Å; Q67-E70 PolarHBondContact O-N 3.31Å; Q67-K71 WeakPolarHBondContact O-CG 3.31Å; Q67-K71 PolarHBondContact O-N 3.23Å |
| 68 | N | 93 | Very high | 86.6 | Confident | 71 Ų | 71 | 119.9 Ų | 119.9 | 38% | 0.38 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -69.9 | -37.9 | 178.6 | -74.1 | -31.5 | 0 | 0 | 0 | 112.4 | E64 K65 L66 K71 K72 | E64-N68 WeakPolarHBondContact O-CB 3.32Å; E64-N68 VanDerWaalsContact O-CG 3.24Å; E64-N68 PolarHBondContact O-N 3.01Å; E64-N68 PolarHBondContact O-ND2 3.46Å; E64-N68 VanDerWaalsContact O-ND2 3.09Å; K65-N68 PolarHBondContact O-N 3.04Å; L66-N68 VanDerWaalsContact C-N 3.33Å; L66-N68 PolarHBondContact O-N 3.48Å; N68-K71 PolarHBondContact O-N 3.35Å; N68-K72 WeakPolarHBondContact O-CG 3.43Å; N68-K72 PolarHBondContact O-N 3.38Å |
| 69 | S | 92.4 | Very high | 87 | Confident | 75 Ų | 75 | 118.8 Ų | 118.8 | 52% | 0.524 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -63.9 | -42.4 | 174 | -66.6 | 0 | 0 | 0 | 0 | 111.5 | K65 L66 K72 A73 | K65-S69 WeakPolarHBondContact O-CB 3.42Å; K65-S69 PolarHBondContact O-N 2.8Å; K65-S69 PolarHBondContact O-OG 2.84Å; K65-S69 VanDerWaalsContact O-OG 3.08Å; L66-S69 PolarHBondContact O-N 3.16Å; S69-K72 PolarHBondContact O-N 2.76Å; S69-A73 WeakPolarHBondContact O-CB 3.2Å; S69-A73 PolarHBondContact O-N 3.15Å |
| 70 | E | 93.4 | Very high | 87.4 | Confident | 102 Ų | 102 | 118.3 Ų | 118.3 | 48% | 0.477 | 58% | 0.577 | S | S | . | * | H | α-helix | trans | -62.8 | -42.6 | 175.3 | -73 | 177.5 | -171.9 | 0 | 0 | 112.6 | L66 Q67 A73 K74 | L66-E70 WeakPolarHBondContact O-CG 3.43Å; L66-E70 PolarHBondContact O-N 3.24Å; Q67-E70 PolarHBondContact O-N 3.31Å; E70-A73 PolarHBondContact O-N 2.88Å; E70-K74 WeakPolarHBondContact O-CG 3.42Å; E70-K74 PolarHBondContact O-N 2.99Å |
| 71 | K | 92.3 | Very high | 87.6 | Confident | 140 Ų | 140 | 116.9 Ų | 116.9 | 61% | 0.609 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -60.9 | -46.1 | 176.5 | -75.6 | 174.9 | -177 | 179.3 | 0 | 111.6 | Q67 N68 A73 K74 E75 | Q67-K71 WeakPolarHBondContact O-CG 3.31Å; Q67-K71 PolarHBondContact O-N 3.23Å; N68-K71 PolarHBondContact O-N 3.35Å; K71-A73 VanDerWaalsContact C-N 3.28Å; K71-A73 PolarHBondContact O-N 3.39Å; K71-K74 PolarHBondContact O-N 3.02Å; K71-E75 PolarHBondContact O-N 3.09Å |
| 72 | K | 86.8 | Confident | 87.9 | Confident | 156 Ų | 156 | 118 Ų | 118 | 68% | 0.678 | 59% | 0.59 | S | S | * | * | H | α-helix | trans | -66.1 | -28.2 | 178 | -73.2 | -178.1 | 177.9 | -168.2 | 0 | 113.8 | N68 S69 K74 | N68-K72 WeakPolarHBondContact O-CG 3.43Å; N68-K72 PolarHBondContact O-N 3.38Å; S69-K72 PolarHBondContact O-N 2.76Å; K72-K74 VanDerWaalsContact C-N 3.28Å |
| 73 | A | 85.4 | Confident | 87.9 | Confident | 85 Ų | 85 | 120.2 Ų | 120.2 | 70% | 0.702 | 60% | 0.6 | S | S | * | * | H | α-helix | trans | -78 | -15.6 | 177.1 | 0 | 0 | 0 | 0 | 0 | 113 | S69 E70 K71 | S69-A73 WeakPolarHBondContact O-CB 3.2Å; S69-A73 PolarHBondContact O-N 3.15Å; E70-A73 PolarHBondContact O-N 2.88Å; K71-A73 VanDerWaalsContact C-N 3.28Å; K71-A73 PolarHBondContact O-N 3.39Å |
| 74 | K | 77.5 | Confident | 87.8 | Confident | 178 Ų | 178 | 123.8 Ų | 123.8 | 77% | 0.774 | 61% | 0.611 | S | S | * | * | trans | -96 | -8.5 | 178 | -70.5 | 178.1 | -177.8 | -179.2 | 0 | 113.5 | E70 K71 K72 | E70-K74 WeakPolarHBondContact O-CG 3.42Å; E70-K74 PolarHBondContact O-N 2.99Å; K71-K74 PolarHBondContact O-N 3.02Å; K72-K74 VanDerWaalsContact C-N 3.28Å | ||
| 75 | E | 64.2 | Low | 87.6 | Confident | 226 Ų | 226 | 124.5 Ų | 124.5 | 100% | 1.056 | 62% | 0.617 | S | S | * | * | trans | -98.7 | 0 | 179.1 | -160.1 | 175.7 | -160.2 | 0 | 0 | 109.7 | K71 | K71-E75 PolarHBondContact O-N 3.09Š|
Retrieved 75 of 75 residues in 193.6 ms
(Link to these results)