| 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 | 33.5 | Very low | 49.4 | Very low | 243 Ų | 243 | 148.5 Ų | 148.5 | 100% | 1.197 | 83% | 0.825 | S | S | * | * | 0 | 117.2 | 0 | -70.1 | 160 | 94.8 | 0 | 0 | 106.8 | |||||
| 2 | W | 42.7 | Very low | 49.9 | Very low | 238 Ų | 238 | 149.1 Ų | 149.1 | 90% | 0.902 | 83% | 0.826 | S | S | * | * | trans | 34.6 | 115.7 | 168.5 | -121 | -88.2 | 0 | 0 | 0 | 117.5 | ||||
| 3 | G | 43.2 | Very low | 50.4 | Low | 64 Ų | 64 | 155.8 Ų | 155.8 | 66% | 0.66 | 83% | 0.831 | S | S | * | * | 67.1 | 119.4 | 67.6 | 0 | 0 | 0 | 0 | 0 | 109.1 | |||||
| 4 | S | 44.7 | Very low | 50.5 | Low | 106 Ų | 106 | 148.6 Ų | 148.6 | 74% | 0.741 | 81% | 0.812 | S | S | * | * | -159.8 | 128.5 | 83.9 | -73.3 | 0 | 0 | 0 | 0 | 111.4 | |||||
| 5 | R | 54.7 | Low | 50.9 | Low | 226 Ų | 226 | 141.6 Ų | 141.6 | 85% | 0.853 | 79% | 0.788 | S | S | * | * | trans | -56.2 | 125.4 | 158.4 | -177.8 | -174.1 | -64 | -115.8 | -0.1 | 108.7 | ||||
| 6 | A | 52.4 | Low | 51.3 | Low | 85 Ų | 85 | 137.1 Ų | 137.1 | 70% | 0.702 | 78% | 0.775 | S | S | * | * | trans | -109.2 | 108 | 159.3 | 0 | 0 | 0 | 0 | 0 | 107.6 | Q8 | A6-Q8 PolarHBondContact O-N 2.86Š| ||
| 7 | Q | 58.8 | Low | 51.8 | Low | 178 Ų | 178 | 134.4 Ų | 134.4 | 83% | 0.832 | 77% | 0.765 | S | S | * | * | trans | -66.9 | 120.1 | 160.4 | -79.4 | 166.7 | -91.2 | 0 | 0 | 107.3 | ||||
| 8 | Q | 49.9 | Very low | 52.6 | Low | 183 Ų | 183 | 133.3 Ų | 133.3 | 86% | 0.855 | 76% | 0.756 | S | S | * | * | trans | -107.7 | 109.7 | 162 | -79.5 | 171.8 | 6.5 | 0 | 0 | 107.8 | A6 G10 | A6-Q8 PolarHBondContact O-N 2.86Å; Q8-G10 PolarHBondContact O-N 2.88Å | ||
| 9 | S | 55.1 | Low | 53.6 | Low | 119 Ų | 119 | 132.5 Ų | 132.5 | 83% | 0.832 | 75% | 0.749 | S | S | * | * | P | Polyproline II helix | trans | -52.2 | 125.5 | 168.5 | 44.9 | 0 | 0 | 0 | 0 | 110.2 | ||
| 10 | G | 57.3 | Low | 54.7 | Low | 69 Ų | 69 | 128.4 Ų | 128.4 | 71% | 0.711 | 73% | 0.732 | S | S | * | * | P | Polyproline II helix | trans | -67 | 143.1 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | Q8 | Q8-G10 PolarHBondContact O-N 2.88Š|
| 11 | P | 51.4 | Low | 55.7 | Low | 122 Ų | 122 | 124.9 Ų | 124.9 | 79% | 0.792 | 72% | 0.719 | S | S | * | * | P | Polyproline II helix | trans | -75.7 | 135.7 | 171 | 28.8 | -31 | 0 | 0 | 0 | 111 | R13 | P11-R13 PolarHBondContact O-N 3.28Š|
| 12 | D | 54.7 | Low | 57.7 | Low | 156 Ų | 156 | 120 Ų | 120 | 83% | 0.834 | 69% | 0.691 | S | S | * | * | P | Polyproline II helix | trans | -50.8 | 120.2 | 178.4 | -85.1 | -48 | 0 | 0 | 0 | 112.7 | G14 | D12-G14 PolarHBondContact O-N 2.95Š|
| 13 | R | 57 | Low | 59.2 | Low | 237 Ų | 237 | 114.5 Ų | 114.5 | 89% | 0.894 | 68% | 0.678 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -66.4 | 1.2 | -176.3 | -87.5 | 179.6 | 174.7 | -136.4 | -0.5 | 115.4 | P11 | P11-R13 PolarHBondContact O-N 3.28Š|
| 14 | G | 52 | Low | 60.8 | Low | 55 Ų | 55 | 117 Ų | 117 | 57% | 0.567 | 68% | 0.676 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -90.6 | -32.3 | -174.1 | 0 | 0 | 0 | 0 | 0 | 115.8 | D12 | D12-G14 PolarHBondContact O-N 2.95Š|
| 15 | G | 55.4 | Low | 62 | Low | 43 Ų | 43 | 115.1 Ų | 115.1 | 44% | 0.443 | 66% | 0.662 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -93.1 | -29.3 | -171.3 | 0 | 0 | 0 | 0 | 0 | 115.2 | L19 | G15-L19 PolarHBondContact O-N 3.45Š|
| 16 | A | 58.3 | Low | 62.7 | Low | 70 Ų | 70 | 110.5 Ų | 110.5 | 58% | 0.579 | 65% | 0.649 | S | S | * | * | H | α-helix | trans | -72.2 | -33.1 | -174.9 | 0 | 0 | 0 | 0 | 0 | 113.3 | A20 | A16-A20 WeakPolarHBondContact O-CB 3.23Å; A16-A20 PolarHBondContact O-N 2.84Å |
| 17 | C | 59 | Low | 63.3 | Low | 91 Ų | 91 | 110.6 Ų | 110.6 | 62% | 0.615 | 64% | 0.644 | S | S | * | * | H | α-helix | trans | -69.2 | -35.5 | 178.7 | -76.6 | 0 | 0 | 0 | 0 | 112.8 | A21 | C17-A21 WeakPolarHBondContact O-CB 3.44Å; C17-A21 PolarHBondContact O-N 2.9Å |
| 18 | L | 65.9 | Low | 63.5 | Low | 114 Ų | 114 | 108.5 Ų | 108.5 | 60% | 0.597 | 64% | 0.638 | S | S | * | * | H | α-helix | trans | -70.3 | -43.7 | 179.3 | -68 | 173.8 | 0 | 0 | 0 | 111 | A21 F22 | L18-A21 PolarHBondContact O-N 3.01Å; L18-F22 WeakPolarHBondContact O-CD2 3.39Å; L18-F22 PolarHBondContact O-N 3.32Å |
| 19 | L | 72.2 | Confident | 63.9 | Low | 119 Ų | 119 | 105.6 Ų | 105.6 | 62% | 0.623 | 63% | 0.628 | S | S | * | * | H | α-helix | trans | -63.9 | -40.6 | 174.9 | -69.1 | 172.5 | 0 | 0 | 0 | 112.2 | G15 F22 L23 | G15-L19 PolarHBondContact O-N 3.45Å; L19-F22 PolarHBondContact O-N 3.24Å; L19-L23 WeakPolarHBondContact O-CG 3.48Å; L19-L23 PolarHBondContact O-N 3.03Å |
| 20 | A | 74.9 | Confident | 64 | Low | 49 Ų | 49 | 106.6 Ų | 106.6 | 41% | 0.405 | 62% | 0.619 | S | S | . | * | H | α-helix | trans | -63.1 | -41.5 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112.2 | A16 L23 L24 | A16-A20 WeakPolarHBondContact O-CB 3.23Å; A16-A20 PolarHBondContact O-N 2.84Å; A20-L23 PolarHBondContact O-N 3.02Å; A20-L24 WeakPolarHBondContact O-CB 3.46Å; A20-L24 VanDerWaalsContact O-CG 3.3Å; A20-L24 WeakPolarHBondContact O-CG 3.43Å; A20-L24 PolarHBondContact O-N 3.14Å |
| 21 | A | 75.7 | Confident | 63.8 | Low | 55 Ų | 55 | 107.1 Ų | 107.1 | 46% | 0.455 | 62% | 0.617 | S | S | . | * | H | α-helix | trans | -65.1 | -40.3 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | C17 L18 C25 | C17-A21 WeakPolarHBondContact O-CB 3.44Å; C17-A21 PolarHBondContact O-N 2.9Å; L18-A21 PolarHBondContact O-N 3.01Å; A21-C25 VanDerWaalsContact O-CB 3.23Å; A21-C25 WeakPolarHBondContact O-CB 3.34Å; A21-C25 PolarHBondContact O-N 3.48Å |
| 22 | F | 76.9 | Confident | 63.6 | Low | 141 Ų | 141 | 109.3 Ų | 109.3 | 62% | 0.618 | 62% | 0.616 | S | S | * | * | H | α-helix | trans | -64.5 | -43.5 | 175.7 | -94 | -78.5 | 0 | 0 | 0 | 112.7 | L18 L19 C25 F26 | L18-F22 WeakPolarHBondContact O-CD2 3.39Å; L18-F22 PolarHBondContact O-N 3.32Å; L19-F22 PolarHBondContact O-N 3.24Å; F22-C25 PolarHBondContact O-N 3.06Å; F22-F26 WeakPolarHBondContact O-CB 3.1Å; F22-F26 PolarHBondContact O-N 2.96Å |
| 23 | L | 74.4 | Confident | 63.6 | Low | 122 Ų | 122 | 108.5 Ų | 108.5 | 64% | 0.639 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -67.7 | -37.9 | 178.4 | -69.8 | 173.1 | 0 | 0 | 0 | 112.7 | L19 A20 S27 | L19-L23 WeakPolarHBondContact O-CG 3.48Å; L19-L23 PolarHBondContact O-N 3.03Å; A20-L23 PolarHBondContact O-N 3.02Å; L23-S27 WeakPolarHBondContact O-CB 3.46Å; L23-S27 PolarHBondContact O-N 3.29Å; L23-S27 PolarHBondContact O-OG 3.45Å |
| 24 | L | 74.9 | Confident | 63.4 | Low | 116 Ų | 116 | 107.3 Ų | 107.3 | 61% | 0.607 | 61% | 0.609 | S | S | * | * | H | α-helix | trans | -67.1 | -39.8 | 173.8 | -72.1 | 172.2 | 0 | 0 | 0 | 111.6 | A20 S27 L28 | A20-L24 WeakPolarHBondContact O-CB 3.46Å; A20-L24 VanDerWaalsContact O-CG 3.3Å; A20-L24 WeakPolarHBondContact O-CG 3.43Å; A20-L24 PolarHBondContact O-N 3.14Å; L24-S27 PolarHBondContact O-N 2.61Å; L24-L28 WeakPolarHBondContact O-CD1 3.32Å; L24-L28 WeakPolarHBondContact O-CG 3.35Å; L24-L28 PolarHBondContact O-N 3.24Å; L24-L28 VanDerWaalsContact O-N 3.11Å |
| 25 | C | 71.8 | Confident | 63.4 | Low | 67 Ų | 67 | 109.9 Ų | 109.9 | 45% | 0.453 | 61% | 0.614 | S | S | . | * | H | α-helix | trans | -66.5 | -42.3 | 176.1 | -163.5 | 0 | 0 | 0 | 0 | 112 | A21 F22 S27 L28 L29 | A21-C25 VanDerWaalsContact O-CB 3.23Å; A21-C25 WeakPolarHBondContact O-CB 3.34Å; A21-C25 PolarHBondContact O-N 3.48Å; F22-C25 PolarHBondContact O-N 3.06Å; C25-S27 VanDerWaalsContact C-N 3.31Å; C25-S27 PolarHBondContact O-N 2.97Å; C25-L28 PolarHBondContact O-N 2.99Å; C25-L29 PolarHBondContact O-N 3.33Å |
| 26 | F | 68.3 | Low | 63.3 | Low | 129 Ų | 129 | 112.2 Ų | 112.2 | 57% | 0.566 | 62% | 0.621 | S | S | * | * | H | α-helix | trans | -62.8 | -35.5 | 174.7 | -105.3 | -93 | 0 | 0 | 0 | 112.8 | F22 H30 | F22-F26 WeakPolarHBondContact O-CB 3.1Å; F22-F26 PolarHBondContact O-N 2.96Å; F26-H30 AromaticContact CD1-CE1 3.92Å; F26-H30 PolarHBondContact O-N 3.35Å; F26-H30 PolarHBondContact O-ND1 3.16Å |
| 27 | S | 65.1 | Low | 63 | Low | 87 Ų | 87 | 114.1 Ų | 114.1 | 61% | 0.608 | 63% | 0.63 | S | S | * | * | H | α-helix | trans | -69.7 | -34.4 | 176.3 | -55.9 | 0 | 0 | 0 | 0 | 112.2 | L23 L24 C25 | L23-S27 WeakPolarHBondContact O-CB 3.46Å; L23-S27 PolarHBondContact O-N 3.29Å; L23-S27 PolarHBondContact O-OG 3.45Å; L24-S27 PolarHBondContact O-N 2.61Å; C25-S27 VanDerWaalsContact C-N 3.31Å; C25-S27 PolarHBondContact O-N 2.97Å |
| 28 | L | 62.1 | Low | 62.3 | Low | 134 Ų | 134 | 118.6 Ų | 118.6 | 70% | 0.702 | 64% | 0.642 | S | S | * | * | H | α-helix | trans | -77.7 | -29.2 | 176.3 | -72.5 | 160.7 | 0 | 0 | 0 | 112.6 | L24 C25 H30 A31 | L24-L28 WeakPolarHBondContact O-CD1 3.32Å; L24-L28 WeakPolarHBondContact O-CG 3.35Å; L24-L28 PolarHBondContact O-N 3.24Å; L24-L28 VanDerWaalsContact O-N 3.11Å; C25-L28 PolarHBondContact O-N 2.99Å; L28-H30 VanDerWaalsContact C-N 3.34Å; L28-A31 PolarHBondContact O-N 3.25Å |
| 29 | L | 58.7 | Low | 61.8 | Low | 123 Ų | 123 | 119 Ų | 119 | 64% | 0.644 | 65% | 0.65 | S | S | * | * | H | α-helix | trans | -73.6 | -20.3 | 176.2 | -108.8 | 72.2 | 0 | 0 | 0 | 114.1 | C25 A31 | C25-L29 PolarHBondContact O-N 3.33Å; L29-A31 VanDerWaalsContact C-N 3.33Å |
| 30 | H | 57.8 | Low | 61.2 | Low | 139 Ų | 139 | 118.4 Ų | 118.4 | 64% | 0.644 | 65% | 0.653 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87.5 | 1.5 | 175 | -74.4 | 86.5 | 0 | 0 | 0 | 113.8 | F26 L28 Q32 | F26-H30 AromaticContact CD1-CE1 3.92Å; F26-H30 PolarHBondContact O-N 3.35Å; F26-H30 PolarHBondContact O-ND1 3.16Å; L28-H30 VanDerWaalsContact C-N 3.34Å; H30-Q32 PolarHBondContact O-N 2.89Å |
| 31 | A | 52.7 | Low | 60.6 | Low | 81 Ų | 81 | 121.3 Ų | 121.3 | 67% | 0.669 | 67% | 0.668 | S | S | * | * | trans | -76.2 | 51.4 | 163.7 | 0 | 0 | 0 | 0 | 0 | 110 | L28 L29 D33 | L28-A31 PolarHBondContact O-N 3.25Å; L29-A31 VanDerWaalsContact C-N 3.33Å; A31-D33 PolarHBondContact O-N 2.96Å | ||
| 32 | Q | 47.7 | Very low | 59.8 | Low | 167 Ų | 167 | 124.3 Ų | 124.3 | 78% | 0.78 | 68% | 0.682 | S | S | * | * | trans | -75.5 | 120.5 | 161.7 | -79.5 | -178.3 | -38.9 | 0 | 0 | 106.7 | H30 Y34 | H30-Q32 PolarHBondContact O-N 2.89Å; Q32-Y34 PolarHBondContact O-N 2.89Å | ||
| 33 | D | 53.7 | Low | 58.9 | Low | 139 Ų | 139 | 124 Ų | 124 | 74% | 0.743 | 69% | 0.692 | S | S | * | * | trans | -32.4 | 103.7 | 172.5 | -66 | -77.9 | 0 | 0 | 0 | 112.1 | A31 T35 | A31-D33 PolarHBondContact O-N 2.96Å; D33-T35 HydrophobicContact CB-CG2 4.44Å; D33-T35 PolarHBondContact O-N 2.82Å; D33-T35 PolarHBondContact O-OG1 3.37Å | ||
| 34 | Y | 52.8 | Low | 58.5 | Low | 213 Ų | 213 | 122.3 Ų | 122.3 | 84% | 0.835 | 69% | 0.691 | S | S | * | * | trans | -69.3 | 76.7 | 154.9 | -176.5 | -99.9 | 0 | 0 | 0 | 106.4 | Q32 P36 | Q32-Y34 PolarHBondContact O-N 2.89Å; Y34-P36 HydrophobicContact CE1-CB 4.29Å; Y34-P36 WeakPolarHBondContact O-CD 3.35Å | ||
| 35 | T | 53.7 | Low | 58.3 | Low | 109 Ų | 109 | 124.4 Ų | 124.4 | 67% | 0.669 | 70% | 0.702 | S | S | * | * | trans | -72.6 | 108.7 | 164 | 19 | 0 | 0 | 0 | 0 | 105.3 | D33 S37 | D33-T35 HydrophobicContact CB-CG2 4.44Å; D33-T35 PolarHBondContact O-N 2.82Å; D33-T35 PolarHBondContact O-OG1 3.37Å; T35-S37 PolarHBondContact O-N 2.84Å | ||
| 36 | P | 52.7 | Low | 57.8 | Low | 92 Ų | 92 | 126.2 Ų | 126.2 | 60% | 0.597 | 71% | 0.712 | S | S | * | * | trans | -61.5 | 112.4 | 173.2 | 25.1 | -31.1 | 0 | 0 | 0 | 107.3 | Y34 Q38 | Y34-P36 HydrophobicContact CE1-CB 4.29Å; Y34-P36 WeakPolarHBondContact O-CD 3.35Å; P36-Q38 PolarHBondContact O-N 3.09Å; P36-Q38 VanDerWaalsContact O-N 3.11Å | ||
| 37 | S | 51.7 | Low | 57.7 | Low | 110 Ų | 110 | 126 Ų | 126 | 77% | 0.769 | 73% | 0.727 | S | S | * | * | trans | -47.8 | 117.6 | 174.7 | -174.9 | 0 | 0 | 0 | 0 | 109.1 | T35 T39 | T35-S37 PolarHBondContact O-N 2.84Å; S37-T39 PolarHBondContact O-N 3.27Å; S37-T39 VanDerWaalsContact O-N 3.09Å | ||
| 38 | Q | 43.8 | Very low | 57.5 | Low | 184 Ų | 184 | 127.1 Ų | 127.1 | 86% | 0.86 | 73% | 0.725 | S | S | * | * | trans | -64.9 | 108.4 | 171.1 | -66.5 | -175.4 | 7.5 | 0 | 0 | 107.9 | P36 | P36-Q38 PolarHBondContact O-N 3.09Å; P36-Q38 VanDerWaalsContact O-N 3.11Å | ||
| 39 | T | 56.2 | Low | 57.5 | Low | 123 Ų | 123 | 129.4 Ų | 129.4 | 76% | 0.755 | 73% | 0.729 | S | S | * | * | P | Polyproline II helix | trans | -54.2 | 129.7 | 161.9 | -54.1 | 0 | 0 | 0 | 0 | 108.2 | S37 | S37-T39 PolarHBondContact O-N 3.27Å; S37-T39 VanDerWaalsContact O-N 3.09Å |
| 40 | P | 60.4 | Low | 57.6 | Low | 106 Ų | 106 | 128.8 Ų | 128.8 | 69% | 0.688 | 73% | 0.733 | S | S | * | * | P | Polyproline II helix | trans | -57.5 | 138 | 176.5 | 23 | -32.3 | 0 | 0 | 0 | 109.8 | ||
| 41 | P | 60.6 | Low | 57.7 | Low | 111 Ų | 111 | 130 Ų | 130 | 72% | 0.721 | 73% | 0.732 | S | S | * | * | P | Polyproline II helix | trans | -62.3 | 136.8 | 179.9 | 25 | -33 | 0 | 0 | 0 | 110 | T43 | P41-T43 PolarHBondContact O-N 3.26Š|
| 42 | P | 58.8 | Low | 57.9 | Low | 117 Ų | 117 | 129.2 Ų | 129.2 | 76% | 0.76 | 73% | 0.731 | S | S | * | * | trans | -64.2 | 110.4 | 166.6 | 25.3 | -30.3 | 0 | 0 | 0 | 108.6 | S44 | P42-S44 VanDerWaalsContact C-N 3.33Å; P42-S44 PolarHBondContact O-N 3.06Å | ||
| 43 | T | 58.1 | Low | 58.4 | Low | 134 Ų | 134 | 131.9 Ų | 131.9 | 82% | 0.822 | 73% | 0.734 | S | S | * | * | trans | -61.2 | 92.9 | 167.8 | 14.2 | 0 | 0 | 0 | 0 | 108.8 | P41 | P41-T43 PolarHBondContact O-N 3.26Š| ||
| 44 | S | 67.6 | Low | 58.5 | Low | 88 Ų | 88 | 130 Ų | 130 | 62% | 0.615 | 73% | 0.728 | S | S | * | * | trans | -113.8 | 94.5 | 162.5 | 51.2 | 0 | 0 | 0 | 0 | 107.5 | P42 T46 | P42-S44 VanDerWaalsContact C-N 3.33Å; P42-S44 PolarHBondContact O-N 3.06Å; S44-T46 VanDerWaalsContact C-N 3.26Å; S44-T46 PolarHBondContact O-N 3.37Å | ||
| 45 | N | 69.1 | Low | 58.8 | Low | 159 Ų | 159 | 126.1 Ų | 126.1 | 85% | 0.85 | 72% | 0.717 | S | S | * | * | trans | -65.4 | 92.1 | 167.9 | -69.6 | -13.9 | 0 | 0 | 0 | 107.7 | ||||
| 46 | T | 61.2 | Low | 59.1 | Low | 105 Ų | 105 | 128.7 Ų | 128.7 | 64% | 0.644 | 72% | 0.719 | S | S | * | * | trans | -145.2 | 118.4 | 166 | -55.6 | 0 | 0 | 0 | 0 | 106.7 | S44 L48 | S44-T46 VanDerWaalsContact C-N 3.26Å; S44-T46 PolarHBondContact O-N 3.37Å; T46-L48 WeakPolarHBondContact O-CG 3.4Å; T46-L48 PolarHBondContact O-N 2.88Å | ||
| 47 | S | 66.8 | Low | 59.9 | Low | 126 Ų | 126 | 131.2 Ų | 131.2 | 88% | 0.881 | 72% | 0.723 | S | S | * | * | trans | -40 | 100.3 | 177.4 | -174.4 | 0 | 0 | 0 | 0 | 111.7 | K49 | S47-K49 PolarHBondContact O-N 2.88Š| ||
| 48 | L | 61.1 | Low | 61.5 | Low | 109 Ų | 109 | 132.8 Ų | 132.8 | 57% | 0.571 | 72% | 0.722 | S | S | * | * | trans | -83.2 | 99.6 | 179 | -67.4 | 178.2 | 0 | 0 | 0 | 108.4 | T46 R51 | T46-L48 WeakPolarHBondContact O-CG 3.4Å; T46-L48 PolarHBondContact O-N 2.88Å; L48-R51 VanDerWaalsContact CD1-NH2 3.35Å; L48-R51 VanDerWaalsContact CD2-CZ 3.42Å; L48-R51 VanDerWaalsContact CD2-NH2 3.31Å | ||
| 49 | K | 63.1 | Low | 63.8 | Low | 182 Ų | 182 | 127.8 Ų | 127.8 | 79% | 0.791 | 71% | 0.706 | S | S | * | * | trans | -45.5 | 135.2 | 150.6 | -172.9 | 177 | -175.4 | -178.2 | 0 | 107.9 | S47 R51 | S47-K49 PolarHBondContact O-N 2.88Å; K49-R51 PolarHBondContact O-N 3.38Å | ||
| 50 | P | 60.3 | Low | 65.5 | Low | 111 Ų | 111 | 124.8 Ų | 124.8 | 72% | 0.721 | 70% | 0.699 | S | S | * | * | trans | -59.9 | 107.6 | -174.2 | -20 | 30.4 | 0 | 0 | 0 | 109.9 | G52 | P50-G52 PolarHBondContact O-N 2.76Š| ||
| 51 | R | 60.1 | Low | 67 | Low | 165 Ų | 165 | 125.6 Ų | 125.6 | 62% | 0.623 | 69% | 0.692 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -64 | 0.9 | 178.2 | -75.4 | -170.7 | -82.5 | -144 | -1.3 | 113.5 | L48 K49 R53 | L48-R51 VanDerWaalsContact CD1-NH2 3.35Å; L48-R51 VanDerWaalsContact CD2-CZ 3.42Å; L48-R51 VanDerWaalsContact CD2-NH2 3.31Å; K49-R51 PolarHBondContact O-N 3.38Å; R51-R53 PolarHBondContact O-N 3.29Å |
| 52 | G | 56.6 | Low | 68.4 | Low | 64 Ų | 64 | 122.6 Ų | 122.6 | 66% | 0.66 | 67% | 0.672 | S | S | * | * | H | α-helix | trans | -69.4 | -25.7 | -177.7 | 0 | 0 | 0 | 0 | 0 | 114.9 | P50 | P50-G52 PolarHBondContact O-N 2.76Å |
| 53 | R | 57.7 | Low | 69.9 | Low | 222 Ų | 222 | 125.5 Ų | 125.5 | 84% | 0.838 | 67% | 0.673 | S | S | * | * | H | α-helix | trans | -86 | -27.1 | -177.3 | -164.1 | 177.7 | -71.7 | -161 | -0.3 | 113.9 | R51 | R51-R53 PolarHBondContact O-N 3.29Å |
| 54 | V | 57.2 | Low | 71.4 | Confident | 101 Ų | 101 | 121.7 Ų | 121.7 | 61% | 0.612 | 65% | 0.645 | S | S | * | * | H | α-helix | trans | -83.5 | -30.4 | -174.8 | -177.5 | 0 | 0 | 0 | 0 | 112.4 | ||
| 55 | Q | 58.7 | Low | 72.5 | Confident | 130 Ų | 130 | 126.1 Ų | 126.1 | 61% | 0.607 | 66% | 0.655 | S | S | * | * | H | α-helix | trans | -71.1 | -33.4 | -175.7 | -72.7 | -88.2 | -15.3 | 0 | 0 | 113.5 | E57 L58 | Q55-E57 PolarHBondContact O-N 2.86Å; Q55-L58 PolarHBondContact O-N 2.68Å |
| 56 | K | 59.1 | Low | 73.6 | Confident | 163 Ų | 163 | 121.7 Ų | 121.7 | 71% | 0.709 | 65% | 0.648 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -69.4 | -18.2 | -176.4 | -164.8 | 176.4 | -178.2 | 179.5 | 0 | 113.9 | K61 | K56-K61 WeakPolarHBondContact O-CE 3.32Š|
| 57 | E | 69.7 | Low | 75.1 | Confident | 146 Ų | 146 | 124.3 Ų | 124.3 | 68% | 0.682 | 65% | 0.65 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.3 | -23.4 | 179.8 | -69.5 | -81.1 | 133 | 0 | 0 | 112.5 | Q55 | Q55-E57 PolarHBondContact O-N 2.86Š|
| 58 | L | 85.8 | Confident | 76.2 | Confident | 142 Ų | 142 | 123.3 Ų | 123.3 | 74% | 0.743 | 63% | 0.634 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -100.3 | -27.9 | -164.9 | -66 | 170.2 | 0 | 0 | 0 | 115.1 | Q55 | Q55-L58 PolarHBondContact O-N 2.68Š|
| 59 | C | 91.6 | Very high | 77.8 | Confident | 80 Ų | 80 | 126.6 Ų | 126.6 | 54% | 0.541 | 64% | 0.64 | S | S | . | * | S | Bend | trans | -118.9 | 163.4 | -174 | 68.7 | 0 | 0 | 0 | 0 | 113 | K61 | C59-K61 PolarHBondContact O-N 3.11Å; C59-K61 VanDerWaalsContact O-N 3.16Å |
| 60 | G | 91.5 | Very high | 79.3 | Confident | 59 Ų | 59 | 122.1 Ų | 122.1 | 61% | 0.608 | 65% | 0.645 | S | S | * | * | S | Bend | trans | 66.7 | 15.3 | 173.5 | 0 | 0 | 0 | 0 | 0 | 115.9 | W81 | G60-W81 VanDerWaalsContact C-CZ3 3.45Š|
| 61 | K | 91.6 | Very high | 80.9 | Confident | 124 Ų | 124 | 119.7 Ų | 119.7 | 54% | 0.539 | 64% | 0.641 | S | S | . | * | trans | -91.1 | 118.6 | 178.2 | -58.3 | -61.3 | -174.7 | 173.3 | 0 | 111.5 | K56 C59 W81 | K56-K61 WeakPolarHBondContact O-CE 3.32Å; C59-K61 PolarHBondContact O-N 3.11Å; C59-K61 VanDerWaalsContact O-N 3.16Å; K61-W81 WeakPolarHBondContact O-CZ3 2.96Å | ||
| 62 | T | 91.6 | Very high | 82.4 | Confident | 47 Ų | 47 | 120 Ų | 120 | 29% | 0.288 | 65% | 0.649 | S | S | . | * | trans | -116 | 150.2 | 170.7 | 175 | 0 | 0 | 0 | 0 | 110.1 | F64 R78 W79 W81 | T62-F64 HydrophobicContact CG2-CB 4.07Å; T62-F64 PolarHBondContact O-N 2.93Å; T62-F64 WeakPolarHBondContact OG1-CB 3.34Å; T62-F64 PolarHBondContact OG1-N 3.29Å; T62-R78 WeakPolarHBondContact CB-O 3.34Å; T62-R78 PolarHBondContact OG1-O 3.29Å; T62-W79 HydrophobicContact CG2-CE3 4.48Å; T62-W79 HydrophobicContact CG2-CZ3 3.93Å; T62-W81 HydrophobicContact CG2-CH2 4.15Å | ||
| 63 | K | 89.1 | Confident | 84.2 | Confident | 179 Ų | 179 | 124.6 Ų | 124.6 | 78% | 0.778 | 66% | 0.657 | S | S | * | * | S | Bend | trans | -75.2 | -6.3 | 168.4 | -63.1 | 177.5 | -177.8 | 169.4 | 0 | 112.2 | ||
| 64 | F | 91 | Very high | 85.9 | Confident | 54 Ų | 54 | 116.3 Ų | 116.3 | 24% | 0.237 | 64% | 0.636 | C | S | . | * | trans | -76.6 | 136.3 | 176.4 | -172.9 | -113.7 | 0 | 0 | 0 | 111.5 | T62 G66 I68 R78 W79 | T62-F64 HydrophobicContact CG2-CB 4.07Å; T62-F64 PolarHBondContact O-N 2.93Å; T62-F64 WeakPolarHBondContact OG1-CB 3.34Å; T62-F64 PolarHBondContact OG1-N 3.29Å; F64-G66 WeakPolarHBondContact CE1-O 3.38Å; F64-I68 HydrophobicContact CE1-CD1 4.39Å; F64-I68 HydrophobicContact CE1-CG1 3.69Å; F64-I68 HydrophobicContact CZ-CG1 3.86Å; F64-R78 HydrophobicContact CB-CG 4.25Å; F64-R78 VanDerWaalsContact CD2-NH1 3.25Å; F64-W79 HydrophobicContact CB-CH2 4.14Å; F64-W79 HydrophobicContact CB-CZ2 4.31Å; F64-W79 AromaticContact CD1-CH2 3.67Å; F64-W79 HydrophobicContact CD1-CH2 3.67Å; F64-W79 AromaticContact CD1-CZ2 3.96Å; F64-W79 HydrophobicContact CD1-CZ2 3.96Å; F64-W79 HydrophobicContact CE1-CH2 4.45Å; F64-W79 HydrophobicContact CG-CH2 4.14Å; F64-W79 HydrophobicContact CG-CZ2 4.16Å | ||
| 65 | Q | 90.4 | Very high | 87.6 | Confident | 180 Ų | 180 | 119 Ų | 119 | 84% | 0.841 | 64% | 0.639 | S | S | * | * | trans | -126.1 | 138.9 | 171.9 | -63.9 | -179.2 | -8.7 | 0 | 0 | 108.7 | ||||
| 66 | G | 90.9 | Very high | 89.1 | Confident | 67 Ų | 67 | 117.3 Ų | 117.3 | 69% | 0.691 | 65% | 0.648 | S | S | * | * | S | Bend | trans | 106.3 | -165.5 | 178 | 0 | 0 | 0 | 0 | 0 | 114.6 | F64 | F64-G66 WeakPolarHBondContact CE1-O 3.38Š|
| 67 | K | 92.4 | Very high | 90.5 | Very high | 159 Ų | 159 | 116.8 Ų | 116.8 | 69% | 0.691 | 65% | 0.648 | S | S | * | * | trans | -108.2 | 150.4 | -179.5 | -67.5 | 177.2 | -179.7 | 178.7 | 0 | 110.1 | Y69 | K67-Y69 HydrophobicContact CB-CD2 4.32Å; K67-Y69 HydrophobicContact CB-CE2 3.53Å; K67-Y69 HydrophobicContact CD-CE2 4.49Å; K67-Y69 WeakPolarHBondContact CD-OH 3.45Å | ||
| 68 | I | 90.8 | Very high | 91.7 | Very high | 105 Ų | 105 | 112.5 Ų | 112.5 | 54% | 0.538 | 63% | 0.625 | S | S | . | * | trans | -96 | 127.1 | 178.1 | -54.7 | 173.1 | 0 | 0 | 0 | 108.5 | F64 W79 | F64-I68 HydrophobicContact CE1-CD1 4.39Å; F64-I68 HydrophobicContact CE1-CG1 3.69Å; F64-I68 HydrophobicContact CZ-CG1 3.86Å; I68-W79 HydrophobicContact CD1-CH2 4.15Å; I68-W79 HydrophobicContact CD1-CZ2 3.69Å | ||
| 69 | Y | 95.1 | Very high | 92.1 | Very high | 179 Ų | 179 | 109.9 Ų | 109.9 | 70% | 0.702 | 61% | 0.606 | S | S | * | * | trans | -129.7 | 136.9 | 173.1 | -58.6 | -81.2 | 0 | 0 | 0 | 108.4 | K67 G71 | K67-Y69 HydrophobicContact CB-CD2 4.32Å; K67-Y69 HydrophobicContact CB-CE2 3.53Å; K67-Y69 HydrophobicContact CD-CE2 4.49Å; K67-Y69 WeakPolarHBondContact CD-OH 3.45Å; Y69-G71 PolarHBondContact O-N 2.04Å | ||
| 70 | G | 95.1 | Very high | 92.2 | Very high | 87 Ų | 87 | 109.7 Ų | 109.7 | 90% | 0.897 | 60% | 0.603 | S | S | * | * | S | Bend | trans | 51.4 | 49.4 | 174.9 | 0 | 0 | 0 | 0 | 0 | 114.2 | ||
| 71 | G | 92.5 | Very high | 92.4 | Very high | 61 Ų | 61 | 109.9 Ų | 109.9 | 63% | 0.629 | 59% | 0.586 | S | S | * | * | trans | -43.8 | 156.1 | -160.3 | 0 | 0 | 0 | 0 | 0 | 118 | Y69 | Y69-G71 PolarHBondContact O-N 2.04Š| ||
| 72 | Q | 92 | Very high | 92.7 | Very high | 172 Ų | 172 | 110 Ų | 110 | 80% | 0.804 | 59% | 0.588 | S | S | * | * | trans | -128.9 | 169.2 | -178.6 | 60.9 | 179.7 | 86.6 | 0 | 0 | 110.9 | A74 | Q72-A74 PolarHBondContact O-N 3.16Š| ||
| 73 | I | 94.1 | Very high | 92.9 | Very high | 160 Ų | 160 | 108.9 Ų | 108.9 | 82% | 0.821 | 58% | 0.584 | S | S | * | * | P | Polyproline II helix | trans | -57.3 | 126.7 | 172.7 | -63.2 | 173.8 | 0 | 0 | 0 | 109.4 | ||
| 74 | A | 93.5 | Very high | 93.3 | Very high | 48 Ų | 48 | 103.2 Ų | 103.2 | 40% | 0.397 | 57% | 0.567 | S | S | . | * | P | Polyproline II helix | trans | -73 | 141.7 | 177.4 | 0 | 0 | 0 | 0 | 0 | 110.6 | Q72 R78 | Q72-A74 PolarHBondContact O-N 3.16Å; A74-R78 HydrophobicContact CB-CB 4.21Å |
| 75 | K | 92.6 | Very high | 93.6 | Very high | 156 Ų | 156 | 102 Ų | 102 | 68% | 0.678 | 56% | 0.562 | S | S | * | * | P | Polyproline II helix | trans | -62 | 151.6 | 166.5 | -68.2 | -177 | 179.7 | -177.4 | 0 | 109.3 | E77 R78 | K75-E77 PolarHBondContact O-N 2.99Å; K75-R78 VanDerWaalsContact O-CB 3.23Å; K75-R78 WeakPolarHBondContact O-CB 3.27Å; K75-R78 PolarHBondContact O-N 3.15Å; K75-R78 VanDerWaalsContact O-N 3.14Å |
| 76 | A | 90.8 | Very high | 93.9 | Very high | 96 Ų | 96 | 98.8 Ų | 98.8 | 79% | 0.793 | 55% | 0.55 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -49.2 | 141.6 | 171.9 | 0 | 0 | 0 | 0 | 0 | 110.7 | R78 | A76-R78 PolarHBondContact O-N 3.03Š|
| 77 | E | 88.7 | Confident | 94.1 | Very high | 151 Ų | 151 | 99.9 Ų | 99.9 | 71% | 0.706 | 54% | 0.536 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 60.5 | 8.2 | -179.8 | -49.3 | -175.7 | 142.9 | 0 | 0 | 116.2 | K75 W79 P80 | K75-E77 PolarHBondContact O-N 2.99Å; E77-W79 PolarHBondContact O-N 2.77Å; E77-P80 WeakPolarHBondContact O-CD 3.2Å; E77-P80 WeakPolarHBondContact O-CG 3.46Å |
| 78 | R | 93.7 | Very high | 94.2 | Very high | 56 Ų | 56 | 102.4 Ų | 102.4 | 21% | 0.211 | 54% | 0.541 | C | S | . | . | S | Bend | trans | -60 | -36.2 | 175.1 | -170 | 78 | 72.7 | 84 | 2.6 | 111.5 | T62 F64 A74 K75 A76 | T62-R78 WeakPolarHBondContact CB-O 3.34Å; T62-R78 PolarHBondContact OG1-O 3.29Å; F64-R78 HydrophobicContact CB-CG 4.25Å; F64-R78 VanDerWaalsContact CD2-NH1 3.25Å; A74-R78 HydrophobicContact CB-CB 4.21Å; K75-R78 VanDerWaalsContact O-CB 3.23Å; K75-R78 WeakPolarHBondContact O-CB 3.27Å; K75-R78 PolarHBondContact O-N 3.15Å; K75-R78 VanDerWaalsContact O-N 3.14Å; A76-R78 PolarHBondContact O-N 3.03Å |
| 79 | W | 94.6 | Very high | 94.5 | Very high | 87 Ų | 87 | 100.9 Ų | 100.9 | 33% | 0.33 | 55% | 0.551 | S | S | . | * | S | Bend | trans | -124.9 | 80.1 | 179.9 | -53.5 | 109.7 | 0 | 0 | 0 | 108.1 | T62 F64 I68 E77 W81 Q82 | T62-W79 HydrophobicContact CG2-CE3 4.48Å; T62-W79 HydrophobicContact CG2-CZ3 3.93Å; F64-W79 HydrophobicContact CB-CH2 4.14Å; F64-W79 HydrophobicContact CB-CZ2 4.31Å; F64-W79 AromaticContact CD1-CH2 3.67Å; F64-W79 HydrophobicContact CD1-CH2 3.67Å; F64-W79 AromaticContact CD1-CZ2 3.96Å; F64-W79 HydrophobicContact CD1-CZ2 3.96Å; F64-W79 HydrophobicContact CE1-CH2 4.45Å; F64-W79 HydrophobicContact CG-CH2 4.14Å; F64-W79 HydrophobicContact CG-CZ2 4.16Å; I68-W79 HydrophobicContact CD1-CH2 4.15Å; I68-W79 HydrophobicContact CD1-CZ2 3.69Å; E77-W79 PolarHBondContact O-N 2.77Å; W79-W81 HydrophobicContact CE3-CH2 4.21Å; W79-W81 AromaticContact CE3-CZ2 3.57Å; W79-W81 HydrophobicContact CE3-CZ2 3.57Å; W79-W81 HydrophobicContact CZ3-CZ2 4.04Å; W79-W81 PolarHBondContact O-N 3.46Å; W79-Q82 HydrophobicContact CB-CB 4.11Å; W79-Q82 WeakPolarHBondContact O-CB 3.44Å; W79-Q82 PolarHBondContact O-N 3.03Å |
| 80 | P | 93.9 | Very high | 94.6 | Very high | 76 Ų | 76 | 101.5 Ų | 101.5 | 49% | 0.494 | 55% | 0.553 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -60 | -23.6 | -168.8 | -25.2 | 33.8 | 0 | 0 | 0 | 114.5 | E77 | E77-P80 WeakPolarHBondContact O-CD 3.2Å; E77-P80 WeakPolarHBondContact O-CG 3.46Å |
| 81 | W | 96 | Very high | 94.6 | Very high | 64 Ų | 64 | 103.1 Ų | 103.1 | 24% | 0.242 | 54% | 0.537 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -85.2 | -8.1 | 178.7 | 51.2 | 80.9 | 0 | 0 | 0 | 114 | G60 K61 T62 W79 A83 V96 L97 | G60-W81 VanDerWaalsContact C-CZ3 3.45Å; K61-W81 WeakPolarHBondContact O-CZ3 2.96Å; T62-W81 HydrophobicContact CG2-CH2 4.15Å; W79-W81 HydrophobicContact CE3-CH2 4.21Å; W79-W81 AromaticContact CE3-CZ2 3.57Å; W79-W81 HydrophobicContact CE3-CZ2 3.57Å; W79-W81 HydrophobicContact CZ3-CZ2 4.04Å; W79-W81 PolarHBondContact O-N 3.46Å; W81-A83 PolarHBondContact O-N 2.94Å; W81-V96 HydrophobicContact CB-CG1 4.03Å; W81-V96 HydrophobicContact CG-CG1 4.21Å; W81-V96 CarbonylContact O-C 3.48Å; W81-V96 VanDerWaalsContact O-CA 3.32Å; W81-V96 WeakPolarHBondContact O-CA 3.21Å; W81-L97 HydrophobicContact CB-CB 4.2Å; W81-L97 PolarHBondContact O-N 3.33Å |
| 82 | Q | 97.1 | Very high | 94.8 | Very high | 126 Ų | 126 | 104.1 Ų | 104.1 | 59% | 0.589 | 53% | 0.526 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -71.7 | 122.9 | -178.8 | -176.8 | 67.6 | 3.9 | 0 | 0 | 110.6 | W79 | W79-Q82 HydrophobicContact CB-CB 4.11Å; W79-Q82 WeakPolarHBondContact O-CB 3.44Å; W79-Q82 PolarHBondContact O-N 3.03Å |
| 83 | A | 97.1 | Very high | 95.1 | Very high | 24 Ų | 24 | 96.9 Ų | 96.9 | 20% | 0.198 | 50% | 0.495 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -124.9 | 155.4 | 178.8 | 0 | 0 | 0 | 0 | 0 | 112 | W81 A95 L103 | W81-A83 PolarHBondContact O-N 2.94Å; A83-A95 HydrophobicContact CB-CB 4.08Å; A83-A95 PolarHBondContact N-O 3.06Å; A83-A95 PolarHBondContact O-N 3.32Å; A83-L103 HydrophobicContact CB-CD1 4.39Å; A83-L103 HydrophobicContact CB-CD2 3.59Å |
| 84 | S | 96.8 | Very high | 95.3 | Very high | 59 Ų | 59 | 91 Ų | 91 | 41% | 0.413 | 47% | 0.473 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -111.1 | 122.8 | 176.1 | 175.5 | 0 | 0 | 0 | 0 | 109.1 | H91 | S84-H91 PolarHBondContact OG-ND1 3.11Å |
| 85 | L | 97.1 | Very high | 95.5 | Very high | 28 Ų | 28 | 88.8 Ų | 88.8 | 15% | 0.147 | 46% | 0.455 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -80.3 | 122.5 | 167.9 | -62.4 | -176.3 | 0 | 0 | 0 | 108.6 | H91 I92 C93 A95 S105 C109 F110 | L85-H91 WeakPolarHBondContact O-CA 3.16Å; L85-I92 HydrophobicContact CB-CD1 4.41Å; L85-I92 HydrophobicContact CB-CG1 3.94Å; L85-I92 WeakPolarHBondContact O-CG1 3.5Å; L85-I92 PolarHBondContact O-N 2.9Å; L85-C93 HydrophobicContact CB-CB 4.24Å; L85-C93 WeakPolarHBondContact CB-O 2.99Å; L85-C93 HydrophobicContact CD1-CB 3.95Å; L85-C93 HydrophobicContact CG-CB 4.44Å; L85-C93 PolarHBondContact N-O 3.46Å; L85-A95 HydrophobicContact CD1-CB 4.42Å; L85-A95 HydrophobicContact CD2-CB 3.89Å; L85-A95 HydrophobicContact CG-CB 3.93Å; L85-S105 WeakPolarHBondContact CD1-OG 3.22Å; L85-C109 HydrophobicContact CD1-CB 4.32Å; L85-F110 HydrophobicContact CD1-CE1 4.08Å; L85-F110 HydrophobicContact CD1-CE2 4.47Å; L85-F110 HydrophobicContact CD1-CZ 3.69Å |
| 86 | I | 96.8 | Very high | 95.8 | Very high | 114 Ų | 114 | 84.1 Ų | 84.1 | 59% | 0.585 | 44% | 0.44 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -116.8 | 123.6 | -177.9 | -60.3 | 176.8 | 0 | 0 | 0 | 108.6 | R90 | I86-R90 CarbonylContact C-O 3.56Å; I86-R90 VanDerWaalsContact CA-O 3.27Å; I86-R90 WeakPolarHBondContact CA-O 3.46Å |
| 87 | F | 94.7 | Very high | 96.1 | Very high | 90 Ų | 90 | 83.6 Ų | 83.6 | 40% | 0.395 | 42% | 0.423 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -124.1 | 127.6 | 174.1 | -178 | -101.7 | 0 | 0 | 0 | 109.4 | G89 R90 I92 | F87-G89 PolarHBondContact O-N 3.41Å; F87-R90 PolarHBondContact N-O 2.92Å; F87-R90 PolarHBondContact O-N 3.43Å; F87-I92 HydrophobicContact CB-CD1 3.7Å; F87-I92 HydrophobicContact CB-CG1 4.13Å; F87-I92 HydrophobicContact CB-CG2 3.89Å |
| 88 | R | 95.6 | Very high | 96.4 | Very high | 211 Ų | 211 | 81.2 Ų | 81.2 | 80% | 0.796 | 41% | 0.414 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 49.9 | 44.4 | -175.2 | -64 | -179.9 | 173.7 | -179.4 | -4 | 112.8 | R90 | R88-R90 PolarHBondContact O-N 2.82Š|
| 89 | G | 97.1 | Very high | 96.4 | Very high | 73 Ų | 73 | 83 Ų | 83 | 75% | 0.753 | 43% | 0.428 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 74.2 | 3.8 | 178.6 | 0 | 0 | 0 | 0 | 0 | 115.5 | F87 | F87-G89 PolarHBondContact O-N 3.41Š|
| 90 | R | 96.4 | Very high | 96.3 | Very high | 193 Ų | 193 | 87.9 Ų | 87.9 | 73% | 0.728 | 45% | 0.451 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -115.2 | 138.3 | 179.5 | -62.6 | -176.8 | 67.3 | -178.8 | -0.2 | 111.5 | I86 F87 R88 I92 | I86-R90 CarbonylContact C-O 3.56Å; I86-R90 VanDerWaalsContact CA-O 3.27Å; I86-R90 WeakPolarHBondContact CA-O 3.46Å; F87-R90 PolarHBondContact N-O 2.92Å; F87-R90 PolarHBondContact O-N 3.43Å; R88-R90 PolarHBondContact O-N 2.82Å; R90-I92 PolarHBondContact O-N 3.22Å |
| 91 | H | 96.6 | Very high | 96.4 | Very high | 121 Ų | 121 | 89.9 Ų | 89.9 | 56% | 0.56 | 46% | 0.462 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -58.7 | 128.2 | 166.4 | 179.5 | 108 | 0 | 0 | 0 | 109.2 | S84 L85 C93 | S84-H91 PolarHBondContact OG-ND1 3.11Å; L85-H91 WeakPolarHBondContact O-CA 3.16Å; H91-C93 PolarHBondContact CE1-O 2.79Å; H91-C93 VanDerWaalsContact CE1-O 3.29Å; H91-C93 PolarHBondContact NE2-O 3.4Å |
| 92 | I | 96.4 | Very high | 96.4 | Very high | 81 Ų | 81 | 94.7 Ų | 94.7 | 42% | 0.415 | 48% | 0.481 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -116.8 | -30.9 | 177.8 | 56 | 160 | 0 | 0 | 0 | 113.2 | L85 F87 R90 | L85-I92 HydrophobicContact CB-CD1 4.41Å; L85-I92 HydrophobicContact CB-CG1 3.94Å; L85-I92 WeakPolarHBondContact O-CG1 3.5Å; L85-I92 PolarHBondContact O-N 2.9Å; F87-I92 HydrophobicContact CB-CD1 3.7Å; F87-I92 HydrophobicContact CB-CG1 4.13Å; F87-I92 HydrophobicContact CB-CG2 3.89Å; R90-I92 PolarHBondContact O-N 3.22Å |
| 93 | C | 97.9 | Very high | 96.5 | Very high | 21 Ų | 21 | 92.9 Ų | 92.9 | 14% | 0.142 | 47% | 0.474 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -160.5 | 163.8 | -177.1 | -90.4 | 0 | 0 | 0 | 0 | 111.4 | L85 H91 C109 | L85-C93 HydrophobicContact CB-CB 4.24Å; L85-C93 WeakPolarHBondContact CB-O 2.99Å; L85-C93 HydrophobicContact CD1-CB 3.95Å; L85-C93 HydrophobicContact CG-CB 4.44Å; L85-C93 PolarHBondContact N-O 3.46Å; H91-C93 PolarHBondContact CE1-O 2.79Å; H91-C93 VanDerWaalsContact CE1-O 3.29Å; H91-C93 PolarHBondContact NE2-O 3.4Å; C93-C109 HydrophobicContact CB-CB 3.66Å; C93-C109 WeakPolarHBondContact CB-SG 3.33Å; C93-C109 WeakPolarHBondContact SG-CB 3.35Å; C93-C109 CovalentContact SG-SG 2.04Å; C93-C109 PolarHBondContact SG-SG 3.47Å |
| 94 | G | 97.8 | Very high | 96.5 | Very high | 35 Ų | 35 | 96.7 Ų | 96.7 | 36% | 0.361 | 49% | 0.491 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -81.8 | 159.9 | 165.3 | 0 | 0 | 0 | 0 | 0 | 113 | S105 | G94-S105 PolarHBondContact O-OG 3.38Å |
| 95 | A | 98.3 | Very high | 96.5 | Very high | 3 Ų | 3 | 95.6 Ų | 95.6 | 3% | 0.025 | 48% | 0.483 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -148.2 | 164.9 | 169.3 | 0 | 0 | 0 | 0 | 0 | 111 | A83 L85 L103 L104 | A83-A95 HydrophobicContact CB-CB 4.08Å; A83-A95 PolarHBondContact N-O 3.06Å; A83-A95 PolarHBondContact O-N 3.32Å; L85-A95 HydrophobicContact CD1-CB 4.42Å; L85-A95 HydrophobicContact CD2-CB 3.89Å; L85-A95 HydrophobicContact CG-CB 3.93Å; A95-L103 HydrophobicContact CB-CB 4.37Å; A95-L103 HydrophobicContact CB-CD2 4.31Å; A95-L104 CarbonylContact C-O 3.57Å; A95-L104 WeakPolarHBondContact CA-O 3.45Å; A95-L104 WeakPolarHBondContact CB-O 3.48Å |
| 96 | V | 98 | Very high | 96.5 | Very high | 58 Ų | 58 | 96.1 Ų | 96.1 | 35% | 0.352 | 49% | 0.492 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -126.5 | 128.3 | -179.9 | -179.8 | 0 | 0 | 0 | 0 | 110.3 | W81 I98 L103 L104 | W81-V96 HydrophobicContact CB-CG1 4.03Å; W81-V96 HydrophobicContact CG-CG1 4.21Å; W81-V96 CarbonylContact O-C 3.48Å; W81-V96 VanDerWaalsContact O-CA 3.32Å; W81-V96 WeakPolarHBondContact O-CA 3.21Å; V96-I98 HydrophobicContact CG1-CG2 4.47Å; V96-I98 PolarHBondContact O-N 3.37Å; V96-L103 CarbonylContact O-C 3.54Å; V96-L103 WeakPolarHBondContact O-CA 3.3Å; V96-L104 PolarHBondContact N-O 2.88Å; V96-L104 PolarHBondContact O-N 3.38Å |
| 97 | L | 96.6 | Very high | 96.4 | Very high | 85 Ų | 85 | 93.7 Ų | 93.7 | 45% | 0.445 | 49% | 0.489 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -70.2 | 117.2 | 172.9 | -168.3 | 72.6 | 0 | 0 | 0 | 110.2 | W81 D99 L103 | W81-L97 HydrophobicContact CB-CB 4.2Å; W81-L97 PolarHBondContact O-N 3.33Å; L97-D99 WeakPolarHBondContact CD1-O 3.39Å; L97-D99 WeakPolarHBondContact CG-O 3.43Å; L97-L103 HydrophobicContact CB-CD2 4.06Å; L97-L103 HydrophobicContact CD1-CD2 3.98Å; L97-L103 HydrophobicContact CD1-CG 4.39Å |
| 98 | I | 95.8 | Very high | 96.4 | Very high | 100 Ų | 100 | 96 Ų | 96 | 51% | 0.513 | 50% | 0.5 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -109.7 | -20.8 | -179.1 | 58.7 | 164.7 | 0 | 0 | 0 | 112.6 | V96 W102 L104 | V96-I98 HydrophobicContact CG1-CG2 4.47Å; V96-I98 PolarHBondContact O-N 3.37Å; I98-W102 HydrophobicContact CD1-CB 4.19Å; I98-W102 HydrophobicContact CG1-CB 3.85Å; I98-W102 WeakPolarHBondContact CG1-O 3.23Å; I98-W102 PolarHBondContact N-O 3.48Å; I98-L104 HydrophobicContact CD1-CB 4.26Å; I98-L104 HydrophobicContact CG2-CB 3.85Å; I98-L104 HydrophobicContact CG2-CD2 4.43Å |
| 99 | D | 94 | Very high | 96.4 | Very high | 93 Ų | 93 | 87 Ų | 87 | 50% | 0.497 | 47% | 0.469 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -154 | 174.1 | 172.5 | -157 | -15.9 | 0 | 0 | 0 | 109.6 | L97 T101 W102 | L97-D99 WeakPolarHBondContact CD1-O 3.39Å; L97-D99 WeakPolarHBondContact CG-O 3.43Å; D99-T101 PolarHBondContact O-N 2.95Å; D99-W102 HydrophobicContact CB-CB 4.04Å; D99-W102 PolarHBondContact N-O 3.03Å; D99-W102 PolarHBondContact O-N 3.05Å |
| 100 | K | 92.6 | Very high | 96 | Very high | 191 Ų | 191 | 90.1 Ų | 90.1 | 83% | 0.83 | 46% | 0.462 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -50.3 | -31.3 | -178.4 | -64.6 | 179.7 | -179.1 | -179.7 | 0 | 114.1 | ||
| 101 | T | 95.9 | Very high | 95.6 | Very high | 118 Ų | 118 | 87.6 Ų | 87.6 | 72% | 0.724 | 46% | 0.459 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -131.1 | 12.3 | -176.1 | 61.1 | 0 | 0 | 0 | 0 | 112.9 | D99 | D99-T101 PolarHBondContact O-N 2.95Š|
| 102 | W | 96.6 | Very high | 94.2 | Very high | 165 Ų | 165 | 90.9 Ų | 90.9 | 63% | 0.625 | 47% | 0.466 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -127.2 | 127.2 | -174.8 | -69.2 | 102.4 | 0 | 0 | 0 | 111.9 | I98 D99 | I98-W102 HydrophobicContact CD1-CB 4.19Å; I98-W102 HydrophobicContact CG1-CB 3.85Å; I98-W102 WeakPolarHBondContact CG1-O 3.23Å; I98-W102 PolarHBondContact N-O 3.48Å; D99-W102 HydrophobicContact CB-CB 4.04Å; D99-W102 PolarHBondContact N-O 3.03Å; D99-W102 PolarHBondContact O-N 3.05Å |
| 103 | L | 97.8 | Very high | 92.5 | Very high | 87 Ų | 87 | 92.9 Ų | 92.9 | 46% | 0.455 | 49% | 0.488 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -111.2 | 141.3 | 171.8 | -73.9 | 168.5 | 0 | 0 | 0 | 109.6 | A83 A95 V96 L97 | A83-L103 HydrophobicContact CB-CD1 4.39Å; A83-L103 HydrophobicContact CB-CD2 3.59Å; A95-L103 HydrophobicContact CB-CB 4.37Å; A95-L103 HydrophobicContact CB-CD2 4.31Å; V96-L103 CarbonylContact O-C 3.54Å; V96-L103 WeakPolarHBondContact O-CA 3.3Å; L97-L103 HydrophobicContact CB-CD2 4.06Å; L97-L103 HydrophobicContact CD1-CD2 3.98Å; L97-L103 HydrophobicContact CD1-CG 4.39Å |
| 104 | L | 97.4 | Very high | 90.4 | Very high | 105 Ų | 105 | 100.9 Ų | 100.9 | 55% | 0.55 | 54% | 0.544 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -104.9 | 137.9 | 171.1 | -176.8 | 63.7 | 0 | 0 | 0 | 110.1 | A95 V96 I98 | A95-L104 CarbonylContact C-O 3.57Å; A95-L104 WeakPolarHBondContact CA-O 3.45Å; A95-L104 WeakPolarHBondContact CB-O 3.48Å; V96-L104 PolarHBondContact N-O 2.88Å; V96-L104 PolarHBondContact O-N 3.38Å; I98-L104 HydrophobicContact CD1-CB 4.26Å; I98-L104 HydrophobicContact CG2-CB 3.85Å; I98-L104 HydrophobicContact CG2-CD2 4.43Å |
| 105 | S | 97.7 | Very high | 90.1 | Very high | 36 Ų | 36 | 104.2 Ų | 104.2 | 25% | 0.252 | 55% | 0.553 | S | S | . | * | trans | -151.2 | 177.9 | 173.5 | -169.9 | 0 | 0 | 0 | 0 | 110.2 | L85 G94 | L85-S105 WeakPolarHBondContact CD1-OG 3.22Å; G94-S105 PolarHBondContact O-OG 3.38Å | ||
| 106 | A | 96.3 | Very high | 89.7 | Confident | 39 Ų | 39 | 109.5 Ų | 109.5 | 32% | 0.322 | 58% | 0.581 | S | S | . | * | trans | -78.3 | 143.3 | 178.5 | 0 | 0 | 0 | 0 | 0 | 111.6 | H108 C109 | A106-H108 VanDerWaalsContact C-N 3.29Å; A106-H108 VanDerWaalsContact CB-CE1 3.46Å; A106-H108 WeakPolarHBondContact CB-CE1 3.45Å; A106-H108 PolarHBondContact O-N 3.3Å; A106-C109 VanDerWaalsContact O-CB 3.22Å; A106-C109 WeakPolarHBondContact O-CB 3.33Å; A106-C109 PolarHBondContact O-N 3.05Å | ||
| 107 | A | 95.6 | Very high | 89.2 | Confident | 63 Ų | 63 | 112.4 Ų | 112.4 | 52% | 0.521 | 59% | 0.593 | S | S | . | * | G | 310 helix | trans | -58.7 | -38.1 | -179.8 | 0 | 0 | 0 | 0 | 0 | 113.3 | C109 F110 Q111 | A107-C109 PolarHBondContact O-N 2.95Å; A107-C109 VanDerWaalsContact O-N 3.15Å; A107-F110 PolarHBondContact O-N 3Å; A107-Q111 PolarHBondContact O-N 3.29Å; A107-Q111 VanDerWaalsContact O-N 3.16Å |
| 108 | H | 94.1 | Very high | 88.7 | Confident | 139 Ų | 139 | 114 Ų | 114 | 64% | 0.644 | 60% | 0.602 | S | S | * | * | G | 310 helix | trans | -65.4 | -15.4 | 178.3 | 70.9 | -105.9 | 0 | 0 | 0 | 113.4 | A106 F110 | A106-H108 VanDerWaalsContact C-N 3.29Å; A106-H108 VanDerWaalsContact CB-CE1 3.46Å; A106-H108 WeakPolarHBondContact CB-CE1 3.45Å; A106-H108 PolarHBondContact O-N 3.3Å; H108-F110 PolarHBondContact O-N 2.95Å |
| 109 | C | 94.8 | Very high | 88.3 | Confident | 21 Ų | 21 | 114.9 Ų | 114.9 | 14% | 0.142 | 61% | 0.608 | C | S | . | * | G | 310 helix | trans | -68.5 | -18 | 172.2 | -66.3 | 0 | 0 | 0 | 0 | 112.5 | L85 C93 A106 A107 | L85-C109 HydrophobicContact CD1-CB 4.32Å; C93-C109 HydrophobicContact CB-CB 3.66Å; C93-C109 WeakPolarHBondContact CB-SG 3.33Å; C93-C109 WeakPolarHBondContact SG-CB 3.35Å; C93-C109 CovalentContact SG-SG 2.04Å; C93-C109 PolarHBondContact SG-SG 3.47Å; A106-C109 VanDerWaalsContact O-CB 3.22Å; A106-C109 WeakPolarHBondContact O-CB 3.33Å; A106-C109 PolarHBondContact O-N 3.05Å; A107-C109 PolarHBondContact O-N 2.95Å; A107-C109 VanDerWaalsContact O-N 3.15Å |
| 110 | F | 90.4 | Very high | 87.9 | Confident | 139 Ų | 139 | 116.3 Ų | 116.3 | 61% | 0.61 | 62% | 0.615 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -113.2 | -22.9 | -178.8 | -54.1 | -76.3 | 0 | 0 | 0 | 113 | L85 A107 H108 | L85-F110 HydrophobicContact CD1-CE1 4.08Å; L85-F110 HydrophobicContact CD1-CE2 4.47Å; L85-F110 HydrophobicContact CD1-CZ 3.69Å; A107-F110 PolarHBondContact O-N 3Å; H108-F110 PolarHBondContact O-N 2.95Å |
| 111 | Q | 87 | Confident | 87.6 | Confident | 139 Ų | 139 | 111 Ų | 111 | 65% | 0.65 | 60% | 0.6 | S | S | * | * | trans | -87.4 | 113.5 | 175.4 | -61.8 | 175.6 | 21 | 0 | 0 | 109 | A107 S113 | A107-Q111 PolarHBondContact O-N 3.29Å; A107-Q111 VanDerWaalsContact O-N 3.16Å; Q111-S113 PolarHBondContact O-N 3.46Å | ||
| 112 | R | 66.6 | Low | 87 | Confident | 191 Ų | 191 | 110.5 Ų | 110.5 | 72% | 0.721 | 59% | 0.59 | S | S | * | * | trans | -74.6 | 121 | 162.1 | -72.4 | -175.9 | 169.5 | 138.1 | 5.8 | 107 | S114 | R112-S114 PolarHBondContact O-N 3.47Š| ||
| 113 | S | 61.6 | Low | 86.2 | Confident | 123 Ų | 123 | 105.9 Ų | 105.9 | 86% | 0.86 | 59% | 0.587 | S | S | * | * | trans | -56.7 | 110.8 | 164.8 | 53.4 | 0 | 0 | 0 | 0 | 108.1 | Q111 | Q111-S113 PolarHBondContact O-N 3.46Š| ||
| 114 | S | 54.7 | Low | 85.1 | Confident | 189 Ų | 189 | 107.6 Ų | 107.6 | 100% | 1.322 | 60% | 0.599 | S | S | * | * | trans | -70.9 | 0 | 166.1 | 55.9 | 0 | 0 | 0 | 0 | 110.4 | R112 | R112-S114 PolarHBondContact O-N 3.47Š|
Retrieved 114 of 114 residues in 23.3 ms
(Link to these results)