| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 42.8 | Very low | 54.4 | Low | 256 Ų | 256 | 156.4 Ų | 156.4 | 100% | 1.261 | 85% | 0.845 | S | S | * | * | 0 | 111.9 | 0 | -97.5 | 169.3 | 162.9 | 0 | 0 | 108.1 | |||||
| 2 | L | 51.2 | Low | 54.8 | Low | 161 Ų | 161 | 146.7 Ų | 146.7 | 84% | 0.843 | 81% | 0.809 | S | S | * | * | trans | -101.2 | 124.9 | 174.8 | -158.6 | 97.8 | 0 | 0 | 0 | 106.7 | ||||
| 3 | C | 48.9 | Very low | 55 | Low | 125 Ų | 125 | 147.2 Ų | 147.2 | 85% | 0.845 | 81% | 0.81 | S | S | * | * | trans | -175.5 | 93 | 160 | -94.6 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 4 | N | 61.6 | Low | 55.3 | Low | 143 Ų | 143 | 149.1 Ų | 149.1 | 77% | 0.765 | 81% | 0.807 | S | S | * | * | 52.2 | 97.3 | 92.3 | -100.9 | -40.7 | 0 | 0 | 0 | 116 | |||||
| 5 | R | 54.9 | Low | 55.3 | Low | 240 Ų | 240 | 149.3 Ų | 149.3 | 91% | 0.906 | 81% | 0.807 | S | S | * | * | trans | -169.4 | 81.6 | 133.5 | -119.8 | 177.4 | -174.8 | 145.4 | 0.4 | 109.7 | A7 | R5-A7 PolarHBondContact O-N 3.36Š| ||
| 6 | T | 54.4 | Low | 55.4 | Low | 140 Ų | 140 | 145.1 Ų | 145.1 | 86% | 0.859 | 79% | 0.788 | S | S | * | * | trans | -63 | 89.5 | 150.6 | 31.4 | 0 | 0 | 0 | 0 | 106.8 | G8 | T6-G8 PolarHBondContact O-N 3.31Š| ||
| 7 | A | 57.8 | Low | 55.4 | Low | 90 Ų | 90 | 149.9 Ų | 149.9 | 74% | 0.744 | 79% | 0.794 | S | S | * | * | trans | -66.4 | 83.2 | 167.3 | 0 | 0 | 0 | 0 | 0 | 107.2 | R5 M9 | R5-A7 PolarHBondContact O-N 3.36Å; A7-M9 VanDerWaalsContact C-N 3.33Å; A7-M9 PolarHBondContact O-N 2.89Å | ||
| 8 | G | 60.2 | Low | 55 | Low | 65 Ų | 65 | 151.1 Ų | 151.1 | 67% | 0.67 | 79% | 0.791 | S | S | * | * | trans | -60.8 | 99.7 | 163 | 0 | 0 | 0 | 0 | 0 | 108.2 | T6 | T6-G8 PolarHBondContact O-N 3.31Š| ||
| 9 | M | 51.6 | Low | 54.7 | Low | 162 Ų | 162 | 149 Ų | 149 | 80% | 0.798 | 80% | 0.798 | S | S | * | * | trans | -118.9 | 109.6 | 140.1 | -111.4 | 103.5 | 135.1 | 0 | 0 | 105.4 | A7 R11 | A7-M9 VanDerWaalsContact C-N 3.33Å; A7-M9 PolarHBondContact O-N 2.89Å; M9-R11 PolarHBondContact O-N 3.02Å | ||
| 10 | P | 57.2 | Low | 54.9 | Low | 121 Ų | 121 | 147 Ų | 147 | 79% | 0.786 | 80% | 0.796 | S | S | * | * | trans | -62.2 | 101.8 | 148.2 | 28.2 | -26.8 | 0 | 0 | 0 | 104 | G12 | P10-G12 PolarHBondContact O-N 3.38Š| ||
| 11 | R | 57.9 | Low | 54.9 | Low | 217 Ų | 217 | 142.9 Ų | 142.9 | 82% | 0.819 | 79% | 0.788 | S | S | * | * | trans | -56.7 | 100.3 | 156.6 | -81.3 | -174.1 | 149.8 | 91.3 | 0.5 | 103.1 | M9 D13 | M9-R11 PolarHBondContact O-N 3.02Å; R11-D13 PolarHBondContact O-N 2.94Å | ||
| 12 | G | 58.8 | Low | 55.4 | Low | 40 Ų | 40 | 142.5 Ų | 142.5 | 41% | 0.412 | 77% | 0.773 | S | S | . | * | trans | -56.2 | 102.9 | 172.7 | 0 | 0 | 0 | 0 | 0 | 105 | P10 F14 | P10-G12 PolarHBondContact O-N 3.38Å; G12-F14 WeakPolarHBondContact O-CD2 3.2Å; G12-F14 PolarHBondContact O-N 3.02Å | ||
| 13 | D | 57.9 | Low | 55.3 | Low | 154 Ų | 154 | 143.7 Ų | 143.7 | 82% | 0.824 | 77% | 0.766 | S | S | * | * | trans | -67.7 | 73.3 | 162.1 | -66.7 | -41.3 | 0 | 0 | 0 | 105.2 | R11 N15 | R11-D13 PolarHBondContact O-N 2.94Å; D13-N15 PolarHBondContact O-N 3.32Å | ||
| 14 | F | 59.7 | Low | 55.6 | Low | 174 Ų | 174 | 141 Ų | 141 | 76% | 0.763 | 76% | 0.76 | S | S | * | * | trans | -67.3 | 82.8 | 157.3 | -52.8 | -74.3 | 0 | 0 | 0 | 103.7 | G12 V16 | G12-F14 WeakPolarHBondContact O-CD2 3.2Å; G12-F14 PolarHBondContact O-N 3.02Å; F14-V16 HydrophobicContact CB-CG2 3.99Å; F14-V16 WeakPolarHBondContact O-CG2 3.47Å; F14-V16 PolarHBondContact O-N 2.98Å | ||
| 15 | N | 55.4 | Low | 55.1 | Low | 151 Ų | 151 | 141.5 Ų | 141.5 | 81% | 0.807 | 75% | 0.752 | S | S | * | * | trans | -67.5 | 77.7 | 165 | -164.3 | -0.5 | 0 | 0 | 0 | 105.4 | D13 Y17 | D13-N15 PolarHBondContact O-N 3.32Å; N15-Y17 VanDerWaalsContact C-N 3.32Å; N15-Y17 PolarHBondContact O-N 3.27Å | ||
| 16 | V | 55.8 | Low | 55 | Low | 83 Ų | 83 | 135 Ų | 135 | 50% | 0.503 | 74% | 0.739 | S | S | . | * | trans | -65.4 | 100.5 | 176.8 | -178.3 | 0 | 0 | 0 | 0 | 105.1 | F14 F18 | F14-V16 HydrophobicContact CB-CG2 3.99Å; F14-V16 WeakPolarHBondContact O-CG2 3.47Å; F14-V16 PolarHBondContact O-N 2.98Å; V16-F18 HydrophobicContact CB-CD2 4.1Å; V16-F18 HydrophobicContact CB-CE2 4.2Å; V16-F18 HydrophobicContact CG1-CD2 3.58Å; V16-F18 HydrophobicContact CG1-CE2 3.32Å; V16-F18 HydrophobicContact CG1-CZ 4.22Å; V16-F18 WeakPolarHBondContact O-CD2 3.39Å; V16-F18 PolarHBondContact O-N 2.74Å | ||
| 17 | Y | 55.5 | Low | 55.3 | Low | 226 Ų | 226 | 138.1 Ų | 138.1 | 89% | 0.886 | 74% | 0.735 | S | S | * | * | S | Bend | trans | 8.8 | 57.7 | 138.1 | -92.8 | -93.1 | 0 | 0 | 0 | 116.5 | N15 | N15-Y17 VanDerWaalsContact C-N 3.32Å; N15-Y17 PolarHBondContact O-N 3.27Å |
| 18 | F | 47.9 | Very low | 55.3 | Low | 171 Ų | 171 | 138 Ų | 138 | 75% | 0.75 | 73% | 0.734 | S | S | * | * | trans | -128.6 | 49 | 167.5 | -69.6 | -67.4 | 0 | 0 | 0 | 109.4 | V16 S20 | V16-F18 HydrophobicContact CB-CD2 4.1Å; V16-F18 HydrophobicContact CB-CE2 4.2Å; V16-F18 HydrophobicContact CG1-CD2 3.58Å; V16-F18 HydrophobicContact CG1-CE2 3.32Å; V16-F18 HydrophobicContact CG1-CZ 4.22Å; V16-F18 WeakPolarHBondContact O-CD2 3.39Å; V16-F18 PolarHBondContact O-N 2.74Å; F18-S20 PolarHBondContact O-N 2.82Å | ||
| 19 | A | 49.5 | Very low | 55.4 | Low | 112 Ų | 112 | 142.7 Ų | 142.7 | 93% | 0.926 | 74% | 0.739 | S | S | * | * | trans | -75.6 | 54.6 | 149.3 | 0 | 0 | 0 | 0 | 0 | 109 | G21 | A19-G21 PolarHBondContact O-N 2.77Š| ||
| 20 | S | 59.2 | Low | 55.8 | Low | 109 Ų | 109 | 138 Ų | 138 | 76% | 0.762 | 72% | 0.715 | S | S | * | * | trans | -74.5 | 102.8 | 162.7 | 163.8 | 0 | 0 | 0 | 0 | 107.1 | F18 | F18-S20 PolarHBondContact O-N 2.82Š| ||
| 21 | G | 55.9 | Low | 56.5 | Low | 61 Ų | 61 | 135.4 Ų | 135.4 | 63% | 0.629 | 70% | 0.703 | S | S | * | * | S | Bend | trans | 99.5 | 124.5 | 151.1 | 0 | 0 | 0 | 0 | 0 | 115.7 | A19 | A19-G21 PolarHBondContact O-N 2.77Š|
| 22 | R | 52.5 | Low | 57.6 | Low | 248 Ų | 248 | 130 Ų | 130 | 94% | 0.936 | 69% | 0.694 | S | S | * | * | trans | 70.9 | 64.9 | 153.1 | -56.5 | -177.1 | -177.5 | -138.9 | 1.8 | 117.1 | ||||
| 23 | R | 48.7 | Very low | 58.9 | Low | 186 Ų | 186 | 129.9 Ų | 129.9 | 70% | 0.702 | 69% | 0.693 | S | S | * | * | trans | -156.9 | 116.4 | 140 | -116.1 | 164.5 | 169.9 | 168.8 | -5.1 | 108.4 | Y25 | R23-Y25 VanDerWaalsContact C-N 3.28Å; R23-Y25 HydrophobicContact CB-CD2 3.51Å; R23-Y25 HydrophobicContact CB-CE2 3.24Å; R23-Y25 HydrophobicContact CB-CG 4.28Å; R23-Y25 WeakPolarHBondContact CD-OH 3.22Å; R23-Y25 HydrophobicContact CG-CE2 4.14Å; R23-Y25 VanDerWaalsContact O-CD2 3.23Å; R23-Y25 WeakPolarHBondContact O-CD2 3.1Å; R23-Y25 PolarHBondContact O-N 3.43Å | ||
| 24 | G | 54.4 | Low | 60.3 | Low | 69 Ų | 69 | 127.4 Ų | 127.4 | 71% | 0.711 | 68% | 0.679 | S | S | * | * | trans | -58.6 | 99.7 | 161.5 | 0 | 0 | 0 | 0 | 0 | 106.9 | V26 | G24-V26 VanDerWaalsContact C-N 3.31Å; G24-V26 PolarHBondContact O-N 3.42Å | ||
| 25 | Y | 51.6 | Low | 61.7 | Low | 152 Ų | 152 | 120.9 Ų | 120.9 | 60% | 0.596 | 66% | 0.66 | S | S | * | * | trans | -97.9 | 70.4 | 179.6 | -86.3 | -73 | 0 | 0 | 0 | 105.8 | R23 R27 E30 | R23-Y25 VanDerWaalsContact C-N 3.28Å; R23-Y25 HydrophobicContact CB-CD2 3.51Å; R23-Y25 HydrophobicContact CB-CE2 3.24Å; R23-Y25 HydrophobicContact CB-CG 4.28Å; R23-Y25 WeakPolarHBondContact CD-OH 3.22Å; R23-Y25 HydrophobicContact CG-CE2 4.14Å; R23-Y25 VanDerWaalsContact O-CD2 3.23Å; R23-Y25 WeakPolarHBondContact O-CD2 3.1Å; R23-Y25 PolarHBondContact O-N 3.43Å; Y25-R27 PolarHBondContact O-N 3.37Å; Y25-E30 WeakPolarHBondContact CA-OE1 3.25Å; Y25-E30 PolarHBondContact N-OE1 2.65Å; Y25-E30 VanDerWaalsContact O-CG 3.24Å; Y25-E30 WeakPolarHBondContact O-CG 3.2Å | ||
| 26 | V | 53.9 | Low | 63.4 | Low | 105 Ų | 105 | 119.1 Ų | 119.1 | 64% | 0.636 | 65% | 0.65 | S | S | * | * | trans | -71 | 62.7 | 175 | -163.6 | 0 | 0 | 0 | 0 | 109.7 | G24 E30 | G24-V26 VanDerWaalsContact C-N 3.31Å; G24-V26 PolarHBondContact O-N 3.42Å; V26-E30 VanDerWaalsContact CA-CD 3.43Å; V26-E30 WeakPolarHBondContact CA-OE2 3.05Å; V26-E30 HydrophobicContact CB-CB 4.06Å; V26-E30 HydrophobicContact CB-CG 4.45Å; V26-E30 WeakPolarHBondContact CB-OE2 3.49Å; V26-E30 HydrophobicContact CG1-CB 3.69Å; V26-E30 HydrophobicContact CG2-CB 4.37Å; V26-E30 WeakPolarHBondContact CG2-OE2 3.32Å; V26-E30 PolarHBondContact N-OE2 2.81Å; V26-E30 VanDerWaalsContact N-OE2 3.12Å | ||
| 27 | R | 59.8 | Low | 65.1 | Low | 205 Ų | 205 | 119.8 Ų | 119.8 | 77% | 0.774 | 65% | 0.65 | S | S | * | * | S | Bend | trans | -70 | 156.2 | 149.2 | -100.8 | -173.5 | 168.1 | -153.2 | -1.9 | 106.8 | Y25 E29 E30 | Y25-R27 PolarHBondContact O-N 3.37Å; R27-E29 PolarHBondContact O-N 2.97Å; R27-E30 PolarHBondContact O-N 3.37Å |
| 28 | A | 59 | Low | 66.9 | Low | 88 Ų | 88 | 113.2 Ų | 113.2 | 73% | 0.727 | 63% | 0.633 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -43.2 | -21.8 | -173.1 | 0 | 0 | 0 | 0 | 0 | 116.9 | E30 | A28-E30 VanDerWaalsContact C-N 3.34Å; A28-E30 PolarHBondContact O-N 2.75Å |
| 29 | E | 60.5 | Low | 69.2 | Low | 163 Ų | 163 | 110 Ų | 110 | 76% | 0.762 | 63% | 0.628 | S | S | * | * | H | α-helix | trans | -61.8 | -29.9 | 170.2 | -63.9 | -176 | 128.3 | 0 | 0 | 114.6 | R27 V32 G33 | R27-E29 PolarHBondContact O-N 2.97Å; E29-V32 PolarHBondContact O-N 3.28Å; E29-G33 PolarHBondContact O-N 3.45Å |
| 30 | E | 60.9 | Low | 71.4 | Confident | 63 Ų | 63 | 108.2 Ų | 108.2 | 29% | 0.294 | 61% | 0.605 | S | S | . | * | H | α-helix | trans | -76.6 | -28.7 | -179.6 | -71 | -160.7 | 176.1 | 0 | 0 | 112.8 | Y25 V26 R27 A28 G33 I34 | Y25-E30 WeakPolarHBondContact CA-OE1 3.25Å; Y25-E30 PolarHBondContact N-OE1 2.65Å; Y25-E30 VanDerWaalsContact O-CG 3.24Å; Y25-E30 WeakPolarHBondContact O-CG 3.2Å; V26-E30 VanDerWaalsContact CA-CD 3.43Å; V26-E30 WeakPolarHBondContact CA-OE2 3.05Å; V26-E30 HydrophobicContact CB-CB 4.06Å; V26-E30 HydrophobicContact CB-CG 4.45Å; V26-E30 WeakPolarHBondContact CB-OE2 3.49Å; V26-E30 HydrophobicContact CG1-CB 3.69Å; V26-E30 HydrophobicContact CG2-CB 4.37Å; V26-E30 WeakPolarHBondContact CG2-OE2 3.32Å; V26-E30 PolarHBondContact N-OE2 2.81Å; V26-E30 VanDerWaalsContact N-OE2 3.12Å; R27-E30 PolarHBondContact O-N 3.37Å; A28-E30 VanDerWaalsContact C-N 3.34Å; A28-E30 PolarHBondContact O-N 2.75Å; E30-G33 PolarHBondContact O-N 3.24Å; E30-I34 WeakPolarHBondContact O-CB 3.4Å; E30-I34 WeakPolarHBondContact O-CD1 3.31Å; E30-I34 WeakPolarHBondContact O-CG1 2.94Å; E30-I34 PolarHBondContact O-N 2.87Å |
| 31 | A | 70.6 | Confident | 73.2 | Confident | 66 Ų | 66 | 108 Ų | 108 | 55% | 0.545 | 60% | 0.595 | S | S | . | * | H | α-helix | trans | -66.9 | -41.8 | 171.9 | 0 | 0 | 0 | 0 | 0 | 111 | G33 G35 | A31-G33 VanDerWaalsContact C-N 3.34Å; A31-G35 PolarHBondContact O-N 2.75Å |
| 32 | V | 82.8 | Confident | 75.1 | Confident | 104 Ų | 104 | 107.4 Ų | 107.4 | 63% | 0.63 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -65.8 | -39.1 | 172.3 | 177.7 | 0 | 0 | 0 | 0 | 110.6 | E29 G35 L36 | E29-V32 PolarHBondContact O-N 3.28Å; V32-G35 PolarHBondContact O-N 3.25Å; V32-L36 VanDerWaalsContact O-CB 3.3Å; V32-L36 WeakPolarHBondContact O-CB 3.15Å; V32-L36 PolarHBondContact O-N 2.81Å |
| 33 | G | 84.6 | Confident | 77.2 | Confident | 37 Ų | 37 | 97.5 Ų | 97.5 | 38% | 0.381 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -63.5 | -45.6 | 177.3 | 0 | 0 | 0 | 0 | 0 | 113.1 | E29 E30 A31 L36 L37 | E29-G33 PolarHBondContact O-N 3.45Å; E30-G33 PolarHBondContact O-N 3.24Å; A31-G33 VanDerWaalsContact C-N 3.34Å; G33-L36 PolarHBondContact O-N 3.46Å; G33-L37 VanDerWaalsContact O-CB 3.29Å; G33-L37 WeakPolarHBondContact O-CB 3.23Å; G33-L37 PolarHBondContact O-N 2.92Å |
| 34 | I | 87.3 | Confident | 79.4 | Confident | 103 Ų | 103 | 94 Ų | 94 | 53% | 0.528 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -64.9 | -44.2 | 174.8 | -64.8 | 160.1 | 0 | 0 | 0 | 109.9 | E30 L36 L37 V38 | E30-I34 WeakPolarHBondContact O-CB 3.4Å; E30-I34 WeakPolarHBondContact O-CD1 3.31Å; E30-I34 WeakPolarHBondContact O-CG1 2.94Å; E30-I34 PolarHBondContact O-N 2.87Å; I34-L36 PolarHBondContact O-N 3.42Å; I34-L37 PolarHBondContact O-N 2.73Å; I34-V38 HydrophobicContact CG2-CG2 4.41Å; I34-V38 VanDerWaalsContact O-CG2 3.31Å; I34-V38 WeakPolarHBondContact O-CG2 3.2Å; I34-V38 PolarHBondContact O-N 2.75Å |
| 35 | G | 89.3 | Confident | 81.1 | Confident | 36 Ų | 36 | 97.7 Ų | 97.7 | 37% | 0.371 | 55% | 0.55 | S | S | . | * | H | α-helix | trans | -57.5 | -47.9 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | A31 V32 L37 V38 V39 | A31-G35 PolarHBondContact O-N 2.75Å; V32-G35 PolarHBondContact O-N 3.25Å; G35-L37 PolarHBondContact O-N 3.48Å; G35-V38 PolarHBondContact O-N 3.48Å; G35-V39 VanDerWaalsContact O-CG2 3.31Å; G35-V39 WeakPolarHBondContact O-CG2 3.13Å; G35-V39 PolarHBondContact O-N 2.88Å |
| 36 | L | 90.9 | Very high | 83.1 | Confident | 114 Ų | 114 | 96.1 Ų | 96.1 | 60% | 0.597 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -63.7 | -40.8 | 177 | -172.6 | 146.6 | 0 | 0 | 0 | 111.7 | V32 G33 I34 V38 V39 V40 | V32-L36 VanDerWaalsContact O-CB 3.3Å; V32-L36 WeakPolarHBondContact O-CB 3.15Å; V32-L36 PolarHBondContact O-N 2.81Å; G33-L36 PolarHBondContact O-N 3.46Å; I34-L36 PolarHBondContact O-N 3.42Å; L36-V38 PolarHBondContact O-N 3.23Å; L36-V39 PolarHBondContact O-N 3.42Å; L36-V40 HydrophobicContact CD2-CG2 4.14Å; L36-V40 WeakPolarHBondContact O-CG2 3.5Å; L36-V40 PolarHBondContact O-N 2.97Å |
| 37 | L | 91.4 | Very high | 84.9 | Confident | 98 Ų | 98 | 95.9 Ų | 95.9 | 51% | 0.513 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -61.1 | -44.7 | 176.3 | -174.6 | 151 | 0 | 0 | 0 | 111.4 | G33 I34 G35 V40 L41 | G33-L37 VanDerWaalsContact O-CB 3.29Å; G33-L37 WeakPolarHBondContact O-CB 3.23Å; G33-L37 PolarHBondContact O-N 2.92Å; I34-L37 PolarHBondContact O-N 2.73Å; G35-L37 PolarHBondContact O-N 3.48Å; L37-V40 PolarHBondContact O-N 2.97Å; L37-L41 HydrophobicContact CD2-CD1 3.83Å; L37-L41 HydrophobicContact CG-CD1 4.2Å; L37-L41 WeakPolarHBondContact O-CD1 3.48Å; L37-L41 PolarHBondContact O-N 3.33Å |
| 38 | V | 94.9 | Very high | 86.2 | Confident | 87 Ų | 87 | 87.4 Ų | 87.4 | 53% | 0.527 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -63 | -42.7 | 177.1 | 173 | 0 | 0 | 0 | 0 | 111.1 | I34 G35 L36 L41 A42 | I34-V38 HydrophobicContact CG2-CG2 4.41Å; I34-V38 VanDerWaalsContact O-CG2 3.31Å; I34-V38 WeakPolarHBondContact O-CG2 3.2Å; I34-V38 PolarHBondContact O-N 2.75Å; G35-V38 PolarHBondContact O-N 3.48Å; L36-V38 PolarHBondContact O-N 3.23Å; V38-L41 PolarHBondContact O-N 3.38Å; V38-A42 WeakPolarHBondContact O-CB 3.36Å; V38-A42 PolarHBondContact O-N 2.95Å |
| 39 | V | 96.1 | Very high | 87.3 | Confident | 105 Ų | 105 | 85.8 Ų | 85.8 | 64% | 0.636 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -61.8 | -44.8 | 177.5 | 171 | 0 | 0 | 0 | 0 | 111.4 | G35 L36 A42 G43 | G35-V39 VanDerWaalsContact O-CG2 3.31Å; G35-V39 WeakPolarHBondContact O-CG2 3.13Å; G35-V39 PolarHBondContact O-N 2.88Å; L36-V39 PolarHBondContact O-N 3.42Å; V39-A42 PolarHBondContact O-N 3.34Å; V39-G43 PolarHBondContact O-N 3.38Å |
| 40 | V | 95.7 | Very high | 88.6 | Confident | 74 Ų | 74 | 85.9 Ų | 85.9 | 45% | 0.448 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -64.2 | -44.9 | 177.3 | 171.8 | 0 | 0 | 0 | 0 | 111.1 | L36 L37 A42 G43 L44 | L36-V40 HydrophobicContact CD2-CG2 4.14Å; L36-V40 WeakPolarHBondContact O-CG2 3.5Å; L36-V40 PolarHBondContact O-N 2.97Å; L37-V40 PolarHBondContact O-N 2.97Å; V40-A42 PolarHBondContact O-N 3.36Å; V40-G43 PolarHBondContact O-N 3.48Å; V40-L44 HydrophobicContact CG1-CD1 3.83Å; V40-L44 HydrophobicContact CG1-CG 4.46Å; V40-L44 WeakPolarHBondContact O-CB 3.39Å; V40-L44 WeakPolarHBondContact O-CG 3.45Å; V40-L44 PolarHBondContact O-N 3.43Å |
| 41 | L | 95.9 | Very high | 89.7 | Confident | 105 Ų | 105 | 89.2 Ų | 89.2 | 55% | 0.55 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -60.8 | -43.8 | 175.8 | -103.2 | 76.6 | 0 | 0 | 0 | 111.8 | L37 V38 L44 F45 | L37-L41 HydrophobicContact CD2-CD1 3.83Å; L37-L41 HydrophobicContact CG-CD1 4.2Å; L37-L41 WeakPolarHBondContact O-CD1 3.48Å; L37-L41 PolarHBondContact O-N 3.33Å; V38-L41 PolarHBondContact O-N 3.38Å; L41-L44 PolarHBondContact O-N 3.13Å; L41-F45 VanDerWaalsContact O-CB 3.23Å; L41-F45 WeakPolarHBondContact O-CB 3.47Å; L41-F45 PolarHBondContact O-N 3.44Å |
| 42 | A | 96 | Very high | 89.6 | Confident | 47 Ų | 47 | 91 Ų | 91 | 39% | 0.388 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -62.2 | -44.5 | 178.2 | 0 | 0 | 0 | 0 | 0 | 111.5 | V38 V39 V40 F45 I46 | V38-A42 WeakPolarHBondContact O-CB 3.36Å; V38-A42 PolarHBondContact O-N 2.95Å; V39-A42 PolarHBondContact O-N 3.34Å; V40-A42 PolarHBondContact O-N 3.36Å; A42-F45 PolarHBondContact O-N 2.83Å; A42-I46 WeakPolarHBondContact O-CB 3.33Å; A42-I46 VanDerWaalsContact O-CG1 3.23Å; A42-I46 WeakPolarHBondContact O-CG1 3.3Å; A42-I46 PolarHBondContact O-N 3.45Å |
| 43 | G | 96.2 | Very high | 89.1 | Confident | 40 Ų | 40 | 94.1 Ų | 94.1 | 41% | 0.412 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -62.3 | -47 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.8 | V39 V40 F45 I46 L47 | V39-G43 PolarHBondContact O-N 3.38Å; V40-G43 PolarHBondContact O-N 3.48Å; G43-F45 VanDerWaalsContact C-N 3.32Å; G43-F45 PolarHBondContact O-N 2.85Å; G43-I46 PolarHBondContact O-N 2.83Å; G43-L47 WeakPolarHBondContact O-CB 3.42Å; G43-L47 PolarHBondContact O-N 3.33Å |
| 44 | L | 94.6 | Very high | 88.5 | Confident | 114 Ų | 114 | 100.2 Ų | 100.2 | 60% | 0.597 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -62.4 | -38.5 | 175.5 | -75 | 167.3 | 0 | 0 | 0 | 112 | V40 L41 G48 | V40-L44 HydrophobicContact CG1-CD1 3.83Å; V40-L44 HydrophobicContact CG1-CG 4.46Å; V40-L44 WeakPolarHBondContact O-CB 3.39Å; V40-L44 WeakPolarHBondContact O-CG 3.45Å; V40-L44 PolarHBondContact O-N 3.43Å; L41-L44 PolarHBondContact O-N 3.13Å; L44-G48 WeakPolarHBondContact O-CA 3.31Å; L44-G48 PolarHBondContact O-N 3.49Å |
| 45 | F | 91.8 | Very high | 87.5 | Confident | 146 Ų | 146 | 103.3 Ų | 103.3 | 64% | 0.64 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -68.8 | -45.7 | 178 | -172.3 | -102 | 0 | 0 | 0 | 111.4 | L41 A42 G43 L47 G48 C49 | L41-F45 VanDerWaalsContact O-CB 3.23Å; L41-F45 WeakPolarHBondContact O-CB 3.47Å; L41-F45 PolarHBondContact O-N 3.44Å; A42-F45 PolarHBondContact O-N 2.83Å; G43-F45 VanDerWaalsContact C-N 3.32Å; G43-F45 PolarHBondContact O-N 2.85Å; F45-L47 PolarHBondContact O-N 3.3Å; F45-G48 PolarHBondContact O-N 3.33Å; F45-C49 WeakPolarHBondContact CE1-SG 3.33Å; F45-C49 WeakPolarHBondContact CZ-SG 3.29Å; F45-C49 WeakPolarHBondContact O-CB 3.23Å; F45-C49 PolarHBondContact O-N 2.91Å; F45-C49 PolarHBondContact O-SG 3.46Å |
| 46 | I | 92.9 | Very high | 85.8 | Confident | 118 Ų | 118 | 103.5 Ų | 103.5 | 61% | 0.605 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -62 | -45.3 | 176.5 | -67 | 164.8 | 0 | 0 | 0 | 110.4 | A42 G43 C49 W50 | A42-I46 WeakPolarHBondContact O-CB 3.33Å; A42-I46 VanDerWaalsContact O-CG1 3.23Å; A42-I46 WeakPolarHBondContact O-CG1 3.3Å; A42-I46 PolarHBondContact O-N 3.45Å; G43-I46 PolarHBondContact O-N 2.83Å; I46-C49 PolarHBondContact O-N 2.92Å; I46-W50 VanDerWaalsContact O-CB 3.25Å; I46-W50 WeakPolarHBondContact O-CB 3.31Å; I46-W50 PolarHBondContact O-N 3.49Å |
| 47 | L | 90.6 | Very high | 84.3 | Confident | 101 Ų | 101 | 100.7 Ų | 100.7 | 53% | 0.529 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -66.7 | -41.5 | 177.6 | -174.8 | 60.2 | 0 | 0 | 0 | 111.6 | G43 F45 W50 Y51 | G43-L47 WeakPolarHBondContact O-CB 3.42Å; G43-L47 PolarHBondContact O-N 3.33Å; F45-L47 PolarHBondContact O-N 3.3Å; L47-W50 HydrophobicContact CD1-CE3 4.07Å; L47-W50 PolarHBondContact O-N 3.02Å; L47-Y51 WeakPolarHBondContact O-CB 3.47Å; L47-Y51 PolarHBondContact O-N 3.24Å |
| 48 | G | 87.8 | Confident | 82.5 | Confident | 27 Ų | 27 | 105.8 Ų | 105.8 | 28% | 0.278 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -62.4 | -46.8 | 175 | 0 | 0 | 0 | 0 | 0 | 111.8 | L44 F45 Y51 L52 | L44-G48 WeakPolarHBondContact O-CA 3.31Å; L44-G48 PolarHBondContact O-N 3.49Å; F45-G48 PolarHBondContact O-N 3.33Å; G48-Y51 PolarHBondContact O-N 2.89Å; G48-L52 WeakPolarHBondContact O-CB 3.24Å; G48-L52 WeakPolarHBondContact O-CG 3.19Å; G48-L52 PolarHBondContact O-N 3.36Å |
| 49 | C | 83.2 | Confident | 80.5 | Confident | 54 Ų | 54 | 108.5 Ų | 108.5 | 37% | 0.365 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -63.3 | -41.2 | 174.2 | -74.2 | 0 | 0 | 0 | 0 | 111.8 | F45 I46 K53 | F45-C49 WeakPolarHBondContact CE1-SG 3.33Å; F45-C49 WeakPolarHBondContact CZ-SG 3.29Å; F45-C49 WeakPolarHBondContact O-CB 3.23Å; F45-C49 PolarHBondContact O-N 2.91Å; F45-C49 PolarHBondContact O-SG 3.46Å; I46-C49 PolarHBondContact O-N 2.92Å; C49-K53 WeakPolarHBondContact O-CA 3.48Å; C49-K53 WeakPolarHBondContact O-CB 3.42Å; C49-K53 PolarHBondContact O-N 3.08Å |
| 50 | W | 87.6 | Confident | 78.5 | Confident | 164 Ų | 164 | 109.9 Ų | 109.9 | 62% | 0.621 | 55% | 0.55 | S | S | * | . | H | α-helix | trans | -69.2 | -41.7 | 177.7 | -174.5 | 38.9 | 0 | 0 | 0 | 111.7 | I46 L47 K53 K54 | I46-W50 VanDerWaalsContact O-CB 3.25Å; I46-W50 WeakPolarHBondContact O-CB 3.31Å; I46-W50 PolarHBondContact O-N 3.49Å; L47-W50 HydrophobicContact CD1-CE3 4.07Å; L47-W50 PolarHBondContact O-N 3.02Å; W50-K53 PolarHBondContact O-N 2.73Å; W50-K54 WeakPolarHBondContact O-CB 3.23Å; W50-K54 PolarHBondContact O-N 3.31Å |
| 51 | Y | 84 | Confident | 76.5 | Confident | 133 Ų | 133 | 113.2 Ų | 113.2 | 52% | 0.522 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -66.5 | -45.2 | 176.5 | -176.4 | -106.4 | 0 | 0 | 0 | 111.6 | L47 G48 K54 R55 | L47-Y51 WeakPolarHBondContact O-CB 3.47Å; L47-Y51 PolarHBondContact O-N 3.24Å; G48-Y51 PolarHBondContact O-N 2.89Å; Y51-K54 PolarHBondContact O-N 2.78Å; Y51-R55 WeakPolarHBondContact O-CB 3.44Å; Y51-R55 PolarHBondContact O-N 3.37Å |
| 52 | L | 68.1 | Low | 74.3 | Confident | 104 Ų | 104 | 119.2 Ų | 119.2 | 55% | 0.545 | 58% | 0.579 | S | S | . | * | H | α-helix | trans | -65.5 | -39.1 | 173.1 | -70.9 | 173.3 | 0 | 0 | 0 | 111 | G48 R55 S56 | G48-L52 WeakPolarHBondContact O-CB 3.24Å; G48-L52 WeakPolarHBondContact O-CG 3.19Å; G48-L52 PolarHBondContact O-N 3.36Å; L52-R55 CarbonylContact O-C 3.59Å; L52-R55 PolarHBondContact O-N 3.47Å; L52-S56 VanDerWaalsContact O-CA 3.31Å; L52-S56 WeakPolarHBondContact O-CA 3.42Å; L52-S56 WeakPolarHBondContact O-CB 3.19Å; L52-S56 PolarHBondContact O-N 3.48Å; L52-S56 PolarHBondContact O-OG 3.22Å |
| 53 | K | 71.8 | Confident | 72 | Confident | 170 Ų | 170 | 120.1 Ų | 120.1 | 74% | 0.739 | 58% | 0.582 | S | S | * | * | H | α-helix | trans | -64.3 | -45.2 | 174.7 | -178.3 | 173 | -178.4 | 175.4 | 0 | 111.4 | C49 W50 R55 | C49-K53 WeakPolarHBondContact O-CA 3.48Å; C49-K53 WeakPolarHBondContact O-CB 3.42Å; C49-K53 PolarHBondContact O-N 3.08Å; W50-K53 PolarHBondContact O-N 2.73Å; K53-R55 VanDerWaalsContact C-N 3.27Å; K53-R55 PolarHBondContact O-N 2.99Å |
| 54 | K | 73 | Confident | 69.8 | Low | 164 Ų | 164 | 124.8 Ų | 124.8 | 71% | 0.713 | 60% | 0.603 | S | S | * | * | H | α-helix | trans | -65.2 | -29.5 | 177.5 | -168 | 174.3 | -177.1 | -178.5 | 0 | 112.2 | W50 Y51 | W50-K54 WeakPolarHBondContact O-CB 3.23Å; W50-K54 PolarHBondContact O-N 3.31Å; Y51-K54 PolarHBondContact O-N 2.78Å |
| 55 | R | 64.9 | Low | 67.7 | Low | 169 Ų | 169 | 123.2 Ų | 123.2 | 64% | 0.638 | 61% | 0.613 | S | S | * | * | H | α-helix | trans | -97.2 | -23.4 | 179.2 | -156 | 178.7 | -174.9 | -172.1 | 3.5 | 114.4 | Y51 L52 K53 G57 | Y51-R55 WeakPolarHBondContact O-CB 3.44Å; Y51-R55 PolarHBondContact O-N 3.37Å; L52-R55 CarbonylContact O-C 3.59Å; L52-R55 PolarHBondContact O-N 3.47Å; K53-R55 VanDerWaalsContact C-N 3.27Å; K53-R55 PolarHBondContact O-N 2.99Å; R55-G57 VanDerWaalsContact C-N 3.33Å |
| 56 | S | 55.3 | Low | 65.6 | Low | 40 Ų | 40 | 121.3 Ų | 121.3 | 28% | 0.28 | 62% | 0.618 | S | S | . | * | H | α-helix | trans | -85.8 | -0.3 | -180 | -73.1 | 0 | 0 | 0 | 0 | 113.6 | L52 Y58 K59 | L52-S56 VanDerWaalsContact O-CA 3.31Å; L52-S56 WeakPolarHBondContact O-CA 3.42Å; L52-S56 WeakPolarHBondContact O-CB 3.19Å; L52-S56 PolarHBondContact O-N 3.48Å; L52-S56 PolarHBondContact O-OG 3.22Å; S56-Y58 PolarHBondContact O-N 2.82Å; S56-K59 PolarHBondContact O-N 2.98Å |
| 57 | G | 58.6 | Low | 63.4 | Low | 54 Ų | 54 | 119.7 Ų | 119.7 | 56% | 0.557 | 63% | 0.631 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -52.5 | -16.6 | 165.6 | 0 | 0 | 0 | 0 | 0 | 114 | R55 | R55-G57 VanDerWaalsContact C-N 3.33Š|
| 58 | Y | 53.8 | Low | 61 | Low | 206 Ų | 206 | 119.7 Ų | 119.7 | 81% | 0.808 | 64% | 0.639 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -115.7 | -0.4 | 176.2 | -60.2 | -78.5 | 0 | 0 | 0 | 115.1 | S56 | S56-Y58 PolarHBondContact O-N 2.82Š|
| 59 | K | 52 | Low | 59.2 | Low | 144 Ų | 144 | 123.3 Ų | 123.3 | 63% | 0.626 | 67% | 0.666 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -103.2 | -3.7 | -178.2 | -79.5 | -174.4 | 75.4 | -178.4 | 0 | 114.9 | S56 I61 R62 | S56-K59 PolarHBondContact O-N 2.98Å; K59-I61 PolarHBondContact O-N 3.22Å; K59-R62 PolarHBondContact O-N 3.1Å |
| 60 | I | 55.5 | Low | 57.2 | Low | 134 Ų | 134 | 123.5 Ų | 123.5 | 69% | 0.687 | 68% | 0.678 | S | S | * | * | G | 310 helix | trans | -68.6 | -17.8 | 175 | -59.2 | 162.5 | 0 | 0 | 0 | 111.2 | R62 | I60-R62 VanDerWaalsContact C-N 3.31Å; I60-R62 PolarHBondContact O-N 2.71Å |
| 61 | I | 53.9 | Low | 55.1 | Low | 143 Ų | 143 | 122.9 Ų | 122.9 | 73% | 0.733 | 68% | 0.68 | S | S | * | * | G | 310 helix | trans | -82.5 | -5.2 | 178.3 | -35.6 | 179.6 | 0 | 0 | 0 | 112.3 | K59 | K59-I61 PolarHBondContact O-N 3.22Š|
| 62 | R | 47.8 | Very low | 53.2 | Low | 232 Ų | 232 | 121.2 Ų | 121.2 | 88% | 0.875 | 68% | 0.683 | S | S | * | * | G | 310 helix | trans | -100.3 | 5.3 | -177 | -139.7 | -175.5 | -162.4 | -173.5 | 6.1 | 115.7 | K59 I60 | K59-R62 PolarHBondContact O-N 3.1Å; I60-R62 VanDerWaalsContact C-N 3.31Å; I60-R62 PolarHBondContact O-N 2.71Å |
| 63 | S | 47.8 | Very low | 52.2 | Low | 65 Ų | 65 | 120.2 Ų | 120.2 | 46% | 0.455 | 70% | 0.699 | S | S | . | * | trans | -116.5 | 45.4 | 170.2 | 63.6 | 0 | 0 | 0 | 0 | 111.7 | G65 | S63-G65 VanDerWaalsContact C-N 3.31Å; S63-G65 PolarHBondContact O-N 3.49Å | ||
| 64 | V | 50.1 | Low | 51 | Low | 139 Ų | 139 | 114.4 Ų | 114.4 | 84% | 0.842 | 69% | 0.687 | S | S | * | * | S | Bend | trans | -88.6 | 77.3 | 155.4 | 177.3 | 0 | 0 | 0 | 0 | 106.6 | ||
| 65 | G | 50.4 | Low | 49.7 | Very low | 80 Ų | 80 | 115 Ų | 115 | 83% | 0.825 | 69% | 0.692 | S | S | * | * | S | Bend | trans | 171.7 | -4.8 | 179.6 | 0 | 0 | 0 | 0 | 0 | 116.9 | S63 | S63-G65 VanDerWaalsContact C-N 3.31Å; S63-G65 PolarHBondContact O-N 3.49Å |
| 66 | S | 48.5 | Very low | 48.2 | Very low | 106 Ų | 106 | 115.6 Ų | 115.6 | 74% | 0.741 | 70% | 0.696 | S | S | * | * | S | Bend | trans | -148.3 | 111.1 | 166 | -168.5 | 0 | 0 | 0 | 0 | 106.7 | S68 | S66-S68 PolarHBondContact O-N 2.81Å; S66-S68 VanDerWaalsContact O-N 3.13Å |
| 67 | G | 47.1 | Very low | 47.5 | Very low | 84 Ų | 84 | 119.3 Ų | 119.3 | 87% | 0.866 | 72% | 0.722 | S | S | * | * | S | Bend | trans | -58.2 | 111.3 | -160.1 | 0 | 0 | 0 | 0 | 0 | 113.9 | ||
| 68 | S | 40.5 | Very low | 46.7 | Very low | 102 Ų | 102 | 125.3 Ų | 125.3 | 71% | 0.713 | 74% | 0.735 | S | S | * | * | trans | -176.7 | 86.5 | 136.2 | -172.2 | 0 | 0 | 0 | 0 | 107.6 | S66 | S66-S68 PolarHBondContact O-N 2.81Å; S66-S68 VanDerWaalsContact O-N 3.13Å | ||
| 69 | A | 50.3 | Low | 46.6 | Very low | 102 Ų | 102 | 120.6 Ų | 120.6 | 84% | 0.843 | 73% | 0.73 | S | S | * | * | trans | -96 | 104.5 | 165.2 | 0 | 0 | 0 | 0 | 0 | 107.2 | ||||
| 70 | G | 41.1 | Very low | 45.8 | Very low | 59 Ų | 59 | 117 Ų | 117 | 61% | 0.608 | 73% | 0.734 | S | S | * | * | trans | 147.8 | 116.1 | 162.2 | 0 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 71 | F | 42.9 | Very low | 44.9 | Very low | 150 Ų | 150 | 117 Ų | 117 | 66% | 0.658 | 74% | 0.74 | S | S | * | * | trans | 75.5 | 106.2 | 146.6 | -128.8 | -108.3 | 0 | 0 | 0 | 115.2 | Y76 | F71-Y76 HydrophobicContact CD1-CE2 4.05Å; F71-Y76 HydrophobicContact CE1-CE2 4.34Å | ||
| 72 | T | 43.6 | Very low | 44.7 | Very low | 98 Ų | 98 | 115.8 Ų | 115.8 | 60% | 0.601 | 74% | 0.744 | S | S | * | * | -161.5 | 72.8 | 92 | 28.8 | 0 | 0 | 0 | 0 | 110.5 | G74 Y76 | T72-G74 VanDerWaalsContact C-N 3.33Å; T72-G74 PolarHBondContact O-N 2.76Å; T72-Y76 HydrophobicContact CG2-CD2 3.4Å; T72-Y76 HydrophobicContact CG2-CE2 3.26Å | |||
| 73 | G | 46.8 | Very low | 44.5 | Very low | 84 Ų | 84 | 108.7 Ų | 108.7 | 87% | 0.866 | 74% | 0.736 | S | S | * | * | S | Bend | trans | -85 | 80.4 | 157.2 | 0 | 0 | 0 | 0 | 0 | 108.8 | ||
| 74 | G | 46.2 | Very low | 44 | Very low | 48 Ų | 48 | 112.7 Ų | 112.7 | 50% | 0.495 | 75% | 0.752 | S | S | . | * | S | Bend | trans | 102.6 | 128.3 | 173.5 | 0 | 0 | 0 | 0 | 0 | 114.2 | T72 | T72-G74 VanDerWaalsContact C-N 3.33Å; T72-G74 PolarHBondContact O-N 2.76Å |
| 75 | Q | 47.6 | Very low | 44.3 | Very low | 175 Ų | 175 | 113.7 Ų | 113.7 | 82% | 0.818 | 75% | 0.752 | S | S | * | * | trans | 77.2 | 109.9 | 177.6 | -49.2 | -153 | 8.1 | 0 | 0 | 115.5 | ||||
| 76 | Y | 33.5 | Very low | 43.9 | Very low | 182 Ų | 182 | 119 Ų | 119 | 71% | 0.714 | 75% | 0.753 | S | S | * | * | -154.3 | 110.1 | 128.1 | -83.5 | -66.5 | 0 | 0 | 0 | 108.9 | F71 T72 | F71-Y76 HydrophobicContact CD1-CE2 4.05Å; F71-Y76 HydrophobicContact CE1-CE2 4.34Å; T72-Y76 HydrophobicContact CG2-CD2 3.4Å; T72-Y76 HydrophobicContact CG2-CE2 3.26Å | |||
| 77 | S | 40.2 | Very low | 43.9 | Very low | 118 Ų | 118 | 122.5 Ų | 122.5 | 83% | 0.825 | 76% | 0.76 | S | S | * | * | trans | -71.5 | 132.5 | 148.6 | -65 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 78 | E | 40.3 | Very low | 43.6 | Very low | 180 Ų | 180 | 122.7 Ų | 122.7 | 84% | 0.841 | 75% | 0.747 | S | S | * | * | S | Bend | trans | 70.5 | 163.4 | 153 | -112.5 | -137.4 | 120.2 | 0 | 0 | 119.4 | ||
| 79 | P | 53 | Low | 44.2 | Very low | 108 Ų | 108 | 125.6 Ų | 125.6 | 70% | 0.701 | 75% | 0.754 | S | S | * | * | -116.1 | 159.9 | -122.3 | 25 | -0.7 | 0 | 0 | 0 | 112.2 | |||||
| 80 | G | 34.1 | Very low | 44.2 | Very low | 68 Ų | 68 | 124.3 Ų | 124.3 | 70% | 0.701 | 74% | 0.739 | S | S | * | * | trans | -176.2 | 79.7 | 178.8 | 0 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 81 | T | 37.1 | Very low | 44.7 | Very low | 134 Ų | 134 | 127.3 Ų | 127.3 | 82% | 0.822 | 74% | 0.741 | S | S | * | * | trans | 29.8 | 115.6 | 140.4 | 52.1 | 0 | 0 | 0 | 0 | 119.5 | ||||
| 82 | S | 49.3 | Very low | 45.1 | Very low | 117 Ų | 117 | 129.1 Ų | 129.1 | 82% | 0.818 | 75% | 0.749 | S | S | * | * | trans | -21.5 | 130.5 | 145.5 | 55.7 | 0 | 0 | 0 | 0 | 116.2 | ||||
| 83 | A | 45.3 | Very low | 45.6 | Very low | 84 Ų | 84 | 128 Ų | 128 | 69% | 0.694 | 76% | 0.757 | S | S | * | * | trans | -173.9 | 140.1 | 135.6 | 0 | 0 | 0 | 0 | 0 | 112 | ||||
| 84 | D | 36.1 | Very low | 45.7 | Very low | 148 Ų | 148 | 129.1 Ų | 129.1 | 79% | 0.791 | 75% | 0.752 | S | S | * | * | trans | 87.8 | 71.8 | 151.3 | -52.4 | -32.1 | 0 | 0 | 0 | 119.8 | K86 | D84-K86 PolarHBondContact O-N 2.81Å; D84-K86 VanDerWaalsContact O-N 3.1Å | ||
| 85 | N | 55.6 | Low | 46 | Very low | 160 Ų | 160 | 135.5 Ų | 135.5 | 86% | 0.856 | 77% | 0.766 | S | S | * | * | -27.6 | 102.3 | 126.3 | -177.5 | -40.7 | 0 | 0 | 0 | 112.6 | |||||
| 86 | K | 42.6 | Very low | 46.3 | Very low | 191 Ų | 191 | 138.3 Ų | 138.3 | 83% | 0.83 | 77% | 0.769 | S | S | * | * | trans | -143.9 | 86.3 | 159.2 | -151.5 | 174.6 | -171 | -178.9 | 0 | 109 | D84 S88 | D84-K86 PolarHBondContact O-N 2.81Å; D84-K86 VanDerWaalsContact O-N 3.1Å; K86-S88 PolarHBondContact O-N 2.73Å | ||
| 87 | M | 48.4 | Very low | 47.2 | Very low | 181 Ų | 181 | 134.9 Ų | 134.9 | 89% | 0.892 | 77% | 0.772 | S | S | * | * | trans | -50.5 | 103 | 163.8 | -161.2 | 86.9 | 141.9 | 0 | 0 | 108.4 | L89 | M87-L89 PolarHBondContact O-N 2.81Š| ||
| 88 | S | 42.2 | Very low | 47.7 | Very low | 87 Ų | 87 | 135.5 Ų | 135.5 | 61% | 0.608 | 77% | 0.77 | S | S | * | * | trans | -79.6 | 107.8 | 175.6 | 59.8 | 0 | 0 | 0 | 0 | 108.7 | K86 S90 | K86-S88 PolarHBondContact O-N 2.73Å; S88-S90 PolarHBondContact O-N 2.91Å; S88-S90 PolarHBondContact O-OG 2.98Å; S88-S90 VanDerWaalsContact O-OG 3.08Å; S88-S90 PolarHBondContact OG-OG 2.66Å | ||
| 89 | L | 51.8 | Low | 48.2 | Very low | 164 Ų | 164 | 132.5 Ų | 132.5 | 86% | 0.859 | 76% | 0.764 | S | S | * | * | trans | -50.3 | 58.8 | 162.1 | -174.9 | 94.8 | 0 | 0 | 0 | 112.3 | M87 | M87-L89 PolarHBondContact O-N 2.81Š| ||
| 90 | S | 50 | Low | 48.5 | Very low | 75 Ų | 75 | 132.7 Ų | 132.7 | 52% | 0.524 | 77% | 0.765 | S | S | . | * | trans | -117.2 | -8 | -178.9 | 40.5 | 0 | 0 | 0 | 0 | 113 | S88 F92 | S88-S90 PolarHBondContact O-N 2.91Å; S88-S90 PolarHBondContact O-OG 2.98Å; S88-S90 VanDerWaalsContact O-OG 3.08Å; S88-S90 PolarHBondContact OG-OG 2.66Å; S90-F92 PolarHBondContact O-N 3.25Å | ||
| 91 | D | 51.3 | Low | 49.6 | Very low | 122 Ų | 122 | 136.9 Ų | 136.9 | 65% | 0.652 | 77% | 0.772 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87.9 | 3.4 | -175.2 | -71.5 | -32.5 | 0 | 0 | 0 | 115.4 | F95 | D91-F95 WeakPolarHBondContact O-CE2 2.83Š|
| 92 | F | 53 | Low | 50.9 | Low | 188 Ų | 188 | 133.8 Ų | 133.8 | 83% | 0.825 | 76% | 0.759 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -96.5 | -6 | 177.6 | -78.3 | -79.9 | 0 | 0 | 0 | 114.7 | S90 | S90-F92 PolarHBondContact O-N 3.25Š|
| 93 | G | 52.6 | Low | 51.4 | Low | 74 Ų | 74 | 133.7 Ų | 133.7 | 76% | 0.763 | 76% | 0.756 | S | S | * | * | S | Bend | trans | -93.9 | -14.1 | -177.6 | 0 | 0 | 0 | 0 | 0 | 115.7 | ||
| 94 | S | 49.9 | Very low | 52.3 | Low | 108 Ų | 108 | 135.6 Ų | 135.6 | 76% | 0.755 | 76% | 0.762 | S | S | * | * | trans | -107.5 | 13.2 | -168.1 | -153.8 | 0 | 0 | 0 | 0 | 114.4 | R96 | S94-R96 VanDerWaalsContact C-N 3.34Å; S94-R96 PolarHBondContact O-N 2.89Å | ||
| 95 | F | 52.4 | Low | 53.6 | Low | 181 Ų | 181 | 132.4 Ų | 132.4 | 79% | 0.794 | 76% | 0.756 | S | S | * | * | trans | -97.6 | 46.4 | 174 | -69.8 | -73.3 | 0 | 0 | 0 | 112.6 | D91 | D91-F95 WeakPolarHBondContact O-CE2 2.83Š| ||
| 96 | R | 53.3 | Low | 53.5 | Low | 234 Ų | 234 | 134.8 Ų | 134.8 | 88% | 0.883 | 75% | 0.754 | S | S | * | * | S | Bend | trans | -117.6 | 111.2 | 158.9 | -86.1 | -162.1 | 160.6 | -170.1 | -4.2 | 111.1 | S94 | S94-R96 VanDerWaalsContact C-N 3.34Å; S94-R96 PolarHBondContact O-N 2.89Å |
| 97 | S | 53 | Low | 54.2 | Low | 110 Ų | 110 | 133.1 Ų | 133.1 | 77% | 0.769 | 75% | 0.749 | S | S | * | * | trans | 75.8 | 80.7 | 142 | -179.9 | 0 | 0 | 0 | 0 | 116.8 | ||||
| 98 | V | 50.6 | Low | 54.8 | Low | 131 Ų | 131 | 133.4 Ų | 133.4 | 79% | 0.794 | 75% | 0.746 | S | S | * | * | trans | -140.7 | 81.2 | 142.8 | -170.3 | 0 | 0 | 0 | 0 | 109.3 | P100 | V98-P100 HydrophobicContact CG1-CB 4.33Å; V98-P100 WeakPolarHBondContact O-CD 3.36Å | ||
| 99 | V | 51.6 | Low | 55.3 | Low | 117 Ų | 117 | 135.5 Ų | 135.5 | 71% | 0.709 | 75% | 0.748 | S | S | * | * | trans | -79.9 | 112 | 153.4 | 171.7 | 0 | 0 | 0 | 0 | 105.4 | N101 | V99-N101 PolarHBondContact O-N 3.38Š| ||
| 100 | P | 58.1 | Low | 55.9 | Low | 113 Ų | 113 | 133.3 Ų | 133.3 | 73% | 0.734 | 75% | 0.747 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86 | 34 | -164.6 | 35.1 | -35.5 | 0 | 0 | 0 | 113.6 | V98 | V98-P100 HydrophobicContact CG1-CB 4.33Å; V98-P100 WeakPolarHBondContact O-CD 3.36Å |
| 101 | N | 58.4 | Low | 56.3 | Low | 156 Ų | 156 | 135.2 Ų | 135.2 | 83% | 0.834 | 76% | 0.76 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -172.5 | 52.3 | 167.9 | -132.3 | -52.8 | 0 | 0 | 0 | 113.2 | V99 | V99-N101 PolarHBondContact O-N 3.38Š|
| 102 | A | 64.2 | Low | 56.9 | Low | 68 Ų | 68 | 132.4 Ų | 132.4 | 56% | 0.562 | 76% | 0.76 | S | S | * | * | P | Polyproline II helix | trans | -100.1 | 133.4 | 161.5 | 0 | 0 | 0 | 0 | 0 | 107.7 | ||
| 103 | P | 58.2 | Low | 57.4 | Low | 115 Ų | 115 | 129.8 Ų | 129.8 | 75% | 0.747 | 76% | 0.762 | S | S | * | * | P | Polyproline II helix | trans | -56.1 | 139.8 | 173.9 | 22.9 | -31 | 0 | 0 | 0 | 108.9 | A105 | P103-A105 PolarHBondContact O-N 3.12Š|
| 104 | P | 64.7 | Low | 58 | Low | 125 Ų | 125 | 134.1 Ų | 134.1 | 81% | 0.812 | 77% | 0.767 | S | S | * | * | P | Polyproline II helix | trans | -53.4 | 116.6 | -176.8 | 21.1 | -31.6 | 0 | 0 | 0 | 108.5 | Y106 | P104-Y106 PolarHBondContact O-N 2.69Š|
| 105 | A | 64.5 | Low | 59.2 | Low | 81 Ų | 81 | 133.8 Ų | 133.8 | 67% | 0.669 | 76% | 0.762 | S | S | * | * | P | Polyproline II helix | trans | -57.1 | 131.3 | 171.4 | 0 | 0 | 0 | 0 | 0 | 106.4 | P103 E107 | P103-A105 PolarHBondContact O-N 3.12Å; A105-E107 VanDerWaalsContact C-N 3.28Å; A105-E107 WeakPolarHBondContact O-CG 3.18Å; A105-E107 PolarHBondContact O-N 2.93Å |
| 106 | Y | 53.3 | Low | 60.2 | Low | 209 Ų | 209 | 129.3 Ų | 129.3 | 82% | 0.82 | 75% | 0.751 | S | S | * | * | trans | -63.5 | 91.9 | -175.1 | -152 | -86.7 | 0 | 0 | 0 | 108.8 | P104 K108 | P104-Y106 PolarHBondContact O-N 2.69Å; Y106-K108 HydrophobicContact CD1-CG 3.99Å; Y106-K108 HydrophobicContact CE1-CG 4.2Å; Y106-K108 PolarHBondContact O-N 2.81Å | ||
| 107 | E | 57.8 | Low | 61.2 | Low | 156 Ų | 156 | 124.1 Ų | 124.1 | 73% | 0.729 | 75% | 0.748 | S | S | * | * | trans | -67.9 | 86.2 | 175.7 | -59.8 | -168.5 | -157.2 | 0 | 0 | 107.5 | A105 I109 | A105-E107 VanDerWaalsContact C-N 3.28Å; A105-E107 WeakPolarHBondContact O-CG 3.18Å; A105-E107 PolarHBondContact O-N 2.93Å; E107-I109 HydrophobicContact CB-CD1 3.95Å; E107-I109 HydrophobicContact CB-CG1 4.03Å; E107-I109 PolarHBondContact O-N 2.98Å; E107-I109 WeakPolarHBondContact OE2-CD1 3.37Å | ||
| 108 | K | 60.5 | Low | 61.7 | Low | 188 Ų | 188 | 128.8 Ų | 128.8 | 82% | 0.817 | 75% | 0.75 | S | S | * | * | trans | -70.9 | 69.3 | 161.7 | -91.4 | -179.5 | -177.8 | -176.8 | 0 | 108 | Y106 | Y106-K108 HydrophobicContact CD1-CG 3.99Å; Y106-K108 HydrophobicContact CE1-CG 4.2Å; Y106-K108 PolarHBondContact O-N 2.81Å | ||
| 109 | I | 52.8 | Low | 62.3 | Low | 130 Ų | 130 | 127.8 Ų | 127.8 | 67% | 0.667 | 75% | 0.749 | S | S | * | * | trans | -98.5 | 105.7 | 167.5 | -47.1 | 164.9 | 0 | 0 | 0 | 106.1 | E107 S111 | E107-I109 HydrophobicContact CB-CD1 3.95Å; E107-I109 HydrophobicContact CB-CG1 4.03Å; E107-I109 PolarHBondContact O-N 2.98Å; E107-I109 WeakPolarHBondContact OE2-CD1 3.37Å; I109-S111 PolarHBondContact O-N 2.92Å | ||
| 110 | S | 63.1 | Low | 62.9 | Low | 118 Ų | 118 | 131.8 Ų | 131.8 | 83% | 0.825 | 78% | 0.777 | S | S | * | * | trans | -56.6 | 110.6 | 175.5 | 165.1 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 111 | S | 59.7 | Low | 63.1 | Low | 115 Ų | 115 | 132.8 Ų | 132.8 | 80% | 0.804 | 78% | 0.78 | S | S | * | * | trans | -174.7 | 65.9 | 143.2 | 62.3 | 0 | 0 | 0 | 0 | 111.2 | I109 | I109-S111 PolarHBondContact O-N 2.92Š| ||
| 112 | G | 64.2 | Low | 63.4 | Low | 63 Ų | 63 | 131.5 Ų | 131.5 | 65% | 0.649 | 78% | 0.777 | S | S | * | * | S | Bend | trans | -104.2 | 147.8 | 161.2 | 0 | 0 | 0 | 0 | 0 | 109.2 | L114 | G112-L114 PolarHBondContact O-N 2.8Š|
| 113 | P | 62.5 | Low | 63.4 | Low | 134 Ų | 134 | 135.1 Ų | 135.1 | 87% | 0.87 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -52 | 131.8 | -175.6 | -21.3 | 30.5 | 0 | 0 | 0 | 111 | ||
| 114 | L | 66 | Low | 63.7 | Low | 164 Ų | 164 | 136.2 Ų | 136.2 | 86% | 0.859 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -47.6 | 132.3 | 173.5 | -75.8 | 151.8 | 0 | 0 | 0 | 109.2 | G112 | G112-L114 PolarHBondContact O-N 2.8Š|
| 115 | P | 73.4 | Confident | 63.6 | Low | 102 Ų | 102 | 136.9 Ų | 136.9 | 66% | 0.662 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -60.5 | 145.5 | 177 | 26.4 | -33.2 | 0 | 0 | 0 | 109.5 | ||
| 116 | P | 74.8 | Confident | 63.5 | Low | 87 Ų | 87 | 140.7 Ų | 140.7 | 57% | 0.565 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -59.8 | 146.1 | -178 | 24.4 | -33 | 0 | 0 | 0 | 110.9 | Y118 | P116-Y118 PolarHBondContact O-N 2.88Š|
| 117 | P | 74.8 | Confident | 64.3 | Low | 125 Ų | 125 | 135.8 Ų | 135.8 | 81% | 0.812 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -61.8 | 127.3 | 176.9 | -14.9 | 27.5 | 0 | 0 | 0 | 109.7 | ||
| 118 | Y | 62.3 | Low | 64.8 | Low | 208 Ų | 208 | 134.2 Ų | 134.2 | 82% | 0.816 | 80% | 0.802 | S | S | * | * | trans | -90.6 | 108.4 | 167.9 | -65.4 | -76.9 | 0 | 0 | 0 | 108.4 | P116 | P116-Y118 PolarHBondContact O-N 2.88Š| ||
| 119 | S | 64.1 | Low | 65.1 | Low | 109 Ų | 109 | 129.8 Ų | 129.8 | 76% | 0.762 | 80% | 0.8 | S | S | * | * | trans | -94 | 154 | 153.6 | -69.3 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 120 | P | 63.8 | Low | 66.2 | Low | 202 Ų | 202 | 129.7 Ų | 129.7 | 100% | 1.312 | 81% | 0.812 | S | S | * | * | cis | -106.1 | 0 | 16.8 | 38.2 | -32.9 | 0 | 0 | 0 | 116.4 |
Retrieved 120 of 120 residues in 35.9 ms
(Link to these results)