| 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 | 62 | Low | 64.4 | Low | 245 Ų | 245 | 146.2 Ų | 146.2 | 100% | 1.207 | 83% | 0.829 | S | S | * | * | 0 | 98.7 | 0 | -60 | 175.6 | 171.7 | 0 | 0 | 105.4 | |||||
| 2 | S | 63 | Low | 64.1 | Low | 125 Ų | 125 | 148.6 Ų | 148.6 | 87% | 0.874 | 83% | 0.828 | S | S | * | * | cis | -145.5 | 141.2 | 32.3 | -62.3 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 3 | S | 65.1 | Low | 64 | Low | 107 Ų | 107 | 150.5 Ų | 150.5 | 75% | 0.748 | 83% | 0.827 | S | S | * | * | trans | -75.2 | 143.2 | 174.3 | -42.9 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 4 | N | 75.7 | Confident | 63.7 | Low | 174 Ų | 174 | 153.5 Ų | 153.5 | 93% | 0.93 | 83% | 0.832 | S | S | * | * | trans | -149.9 | 105 | 146 | -100.9 | -11.3 | 0 | 0 | 0 | 108.9 | ||||
| 5 | Q | 72.5 | Confident | 63.4 | Low | 168 Ų | 168 | 150.9 Ų | 150.9 | 79% | 0.785 | 83% | 0.83 | S | S | * | * | trans | -100.6 | 157.9 | 171.4 | -68.9 | 180 | 5.1 | 0 | 0 | 109.4 | ||||
| 6 | N | 67.3 | Low | 63.8 | Low | 139 Ų | 139 | 148.3 Ų | 148.3 | 74% | 0.743 | 82% | 0.82 | S | S | * | * | trans | 78.4 | 141.2 | 153 | -80.7 | -5.1 | 0 | 0 | 0 | 118 | ||||
| 7 | T | 65.5 | Low | 64.2 | Low | 113 Ų | 113 | 147.2 Ų | 147.2 | 69% | 0.693 | 82% | 0.821 | S | S | * | * | cis | -163.9 | 145.2 | 9.4 | 12 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 8 | N | 61.1 | Low | 64.7 | Low | 157 Ų | 157 | 148.9 Ų | 148.9 | 84% | 0.84 | 82% | 0.822 | S | S | * | * | trans | -60.2 | 140.8 | 165.3 | -73.6 | -39.1 | 0 | 0 | 0 | 112.1 | ||||
| 9 | T | 59.2 | Low | 65.3 | Low | 140 Ų | 140 | 151.1 Ų | 151.1 | 86% | 0.859 | 82% | 0.822 | S | S | * | * | trans | -128.8 | 88.5 | 153.4 | -32.7 | 0 | 0 | 0 | 0 | 108.4 | N11 | T9-N11 PolarHBondContact O-N 3.33Š| ||
| 10 | S | 58.1 | Low | 65.9 | Low | 94 Ų | 94 | 148.9 Ų | 148.9 | 66% | 0.657 | 82% | 0.816 | S | S | * | * | trans | -73.9 | 109.2 | 172.7 | 41.2 | 0 | 0 | 0 | 0 | 110.2 | Q12 | S10-Q12 PolarHBondContact O-N 2.93Š| ||
| 11 | N | 59 | Low | 66.6 | Low | 146 Ų | 146 | 146.7 Ų | 146.7 | 78% | 0.781 | 81% | 0.809 | S | S | * | * | trans | -86.4 | 88.4 | 172 | -134.5 | 0.7 | 0 | 0 | 0 | 108.5 | T9 Q13 | T9-N11 PolarHBondContact O-N 3.33Å; N11-Q13 PolarHBondContact O-N 3.1Å | ||
| 12 | Q | 60.5 | Low | 67.7 | Low | 175 Ų | 175 | 139.7 Ų | 139.7 | 82% | 0.818 | 78% | 0.782 | S | S | * | * | trans | -83.7 | 92.7 | 170.8 | -69.7 | -173 | 43.6 | 0 | 0 | 108.9 | S10 Q14 | S10-Q12 PolarHBondContact O-N 2.93Å; Q12-Q14 PolarHBondContact O-N 3.02Å | ||
| 13 | Q | 62.8 | Low | 68.9 | Low | 174 Ų | 174 | 138.4 Ų | 138.4 | 81% | 0.813 | 76% | 0.763 | S | S | * | * | trans | -74.4 | 106 | 168.7 | -80.5 | 171 | -12.7 | 0 | 0 | 109.3 | N11 S15 | N11-Q13 PolarHBondContact O-N 3.1Å; Q13-S15 PolarHBondContact O-N 2.8Å | ||
| 14 | Q | 59.6 | Low | 70.2 | Confident | 192 Ų | 192 | 135.4 Ų | 135.4 | 90% | 0.897 | 74% | 0.74 | S | S | * | * | trans | -62.3 | 109.2 | 172.1 | -121.6 | 166.6 | 3.6 | 0 | 0 | 109.7 | Q12 T16 | Q12-Q14 PolarHBondContact O-N 3.02Å; Q14-T16 PolarHBondContact O-N 3.05Å | ||
| 15 | S | 59.9 | Low | 71.2 | Confident | 115 Ų | 115 | 130.2 Ų | 130.2 | 80% | 0.804 | 71% | 0.708 | S | S | * | * | trans | -69.5 | 106 | 173.6 | 54.7 | 0 | 0 | 0 | 0 | 109.9 | Q13 | Q13-S15 PolarHBondContact O-N 2.8Š| ||
| 16 | T | 69.7 | Low | 72.4 | Confident | 108 Ų | 108 | 123.9 Ų | 123.9 | 66% | 0.663 | 68% | 0.681 | S | S | * | * | trans | -62 | 141.7 | 164.3 | 51.1 | 0 | 0 | 0 | 0 | 108.9 | Q14 Q18 | Q14-T16 PolarHBondContact O-N 3.05Å; T16-Q18 PolarHBondContact O-N 3.09Å | ||
| 17 | P | 69.5 | Low | 73.8 | Confident | 130 Ų | 130 | 117.4 Ų | 117.4 | 84% | 0.844 | 65% | 0.646 | S | S | * | * | trans | -64.7 | 99.2 | 177.5 | 24.5 | -31.2 | 0 | 0 | 0 | 109 | K19 | P17-K19 PolarHBondContact O-N 3.45Š| ||
| 18 | Q | 73.7 | Confident | 75.3 | Confident | 178 Ų | 178 | 113.7 Ų | 113.7 | 83% | 0.832 | 63% | 0.63 | S | S | * | * | P | Polyproline II helix | trans | -64.6 | 122.7 | 177 | -68.9 | -176.2 | -4.5 | 0 | 0 | 108.5 | T16 | T16-Q18 PolarHBondContact O-N 3.09Š|
| 19 | K | 76.9 | Confident | 77 | Confident | 191 Ų | 191 | 111.8 Ų | 111.8 | 83% | 0.83 | 62% | 0.62 | S | S | * | * | P | Polyproline II helix | trans | -55.1 | 140.6 | 172.9 | -69.9 | 177.2 | -177 | 174 | 0 | 108.8 | P17 | P17-K19 PolarHBondContact O-N 3.45Š|
| 20 | P | 77.1 | Confident | 78.8 | Confident | 107 Ų | 107 | 107.9 Ų | 107.9 | 70% | 0.695 | 60% | 0.597 | S | S | * | * | P | Polyproline II helix | trans | -56.8 | 137 | 178.3 | 23.4 | -32.4 | 0 | 0 | 0 | 109.5 | ||
| 21 | P | 81.2 | Confident | 80.6 | Confident | 103 Ų | 103 | 106.7 Ų | 106.7 | 67% | 0.669 | 59% | 0.594 | S | S | * | * | P | Polyproline II helix | trans | -60.2 | 148.7 | 179.8 | 25.2 | -33.6 | 0 | 0 | 0 | 110.2 | M23 | P21-M23 PolarHBondContact O-N 3.23Š|
| 22 | P | 83.5 | Confident | 82.4 | Confident | 98 Ų | 98 | 105.3 Ų | 105.3 | 64% | 0.636 | 58% | 0.578 | S | S | * | * | P | Polyproline II helix | trans | -56.9 | 134.9 | 175.1 | 24.5 | -32.6 | 0 | 0 | 0 | 110.1 | ||
| 23 | M | 89 | Confident | 84.1 | Confident | 98 Ų | 98 | 101.7 Ų | 101.7 | 48% | 0.483 | 56% | 0.561 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -92.9 | 124.2 | 179.6 | -65.9 | -166.9 | -169.3 | 0 | 0 | 110.1 | P21 Y25 I36 | P21-M23 PolarHBondContact O-N 3.23Å; M23-Y25 HydrophobicContact CB-CD2 4.47Å; M23-Y25 HydrophobicContact CB-CE2 3.73Å; M23-I36 PolarHBondContact O-N 3.32Å |
| 24 | V | 93.2 | Very high | 85.6 | Confident | 43 Ų | 43 | 93.5 Ų | 93.5 | 26% | 0.261 | 52% | 0.523 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -94.9 | 127.1 | 175.9 | -175.7 | 0 | 0 | 0 | 0 | 109.5 | E33 E35 | V24-E33 HydrophobicContact CG1-CB 3.86Å; V24-E33 HydrophobicContact CG1-CG 4.29Å; V24-E35 HydrophobicContact CG2-CG 4.24Å |
| 25 | Y | 96.3 | Very high | 87.2 | Confident | 65 Ų | 65 | 89.9 Ų | 89.9 | 26% | 0.255 | 51% | 0.506 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -112.7 | 155.9 | 174.7 | -63.3 | -95.6 | 0 | 0 | 0 | 110.7 | M23 E33 N34 I36 L52 Y53 K54 | M23-Y25 HydrophobicContact CB-CD2 4.47Å; M23-Y25 HydrophobicContact CB-CE2 3.73Å; Y25-E33 CarbonylContact O-C 3.59Å; Y25-E33 WeakPolarHBondContact O-CA 3.37Å; Y25-N34 PolarHBondContact N-O 2.76Å; Y25-N34 PolarHBondContact O-N 3.45Å; Y25-I36 HydrophobicContact CD2-CB 3.87Å; Y25-I36 HydrophobicContact CD2-CG1 3.93Å; Y25-I36 HydrophobicContact CE2-CB 4Å; Y25-L52 HydrophobicContact CD1-CB 4.47Å; Y25-L52 HydrophobicContact CG-CB 4.46Å; Y25-Y53 CarbonylContact C-O 3.53Å; Y25-Y53 VanDerWaalsContact CA-O 3.23Å; Y25-Y53 WeakPolarHBondContact CA-O 3.24Å; Y25-K54 HydrophobicContact CD1-CB 4.41Å; Y25-K54 HydrophobicContact CE1-CB 4.35Å |
| 26 | V | 96.7 | Very high | 88.8 | Confident | 36 Ų | 36 | 85.3 Ų | 85.3 | 22% | 0.218 | 47% | 0.472 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -113.5 | 129.2 | -179.5 | -177.4 | 0 | 0 | 0 | 0 | 108.7 | A31 L52 Y53 K55 | V26-A31 HydrophobicContact CG1-CB 4.46Å; V26-A31 WeakPolarHBondContact CG1-O 3.41Å; V26-L52 CarbonylContact O-C 3.45Å; V26-L52 WeakPolarHBondContact O-CA 3.47Å; V26-Y53 PolarHBondContact N-O 2.61Å; V26-Y53 PolarHBondContact O-N 2.75Å; V26-K55 HydrophobicContact CG2-CB 4.4Å; V26-K55 HydrophobicContact CG2-CG 4.4Å |
| 27 | C | 97.8 | Very high | 89.7 | Confident | 3 Ų | 3 | 88.9 Ų | 88.9 | 2% | 0.02 | 47% | 0.474 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -63.8 | 136.2 | 177.5 | -175.8 | 0 | 0 | 0 | 0 | 111.4 | D29 C30 A31 Y32 C44 L52 | C27-D29 VanDerWaalsContact C-N 3.26Å; C27-D29 PolarHBondContact O-N 2.86Å; C27-C30 VanDerWaalsContact CB-SG 3.54Å; C27-A31 VanDerWaalsContact O-CA 3.25Å; C27-A31 WeakPolarHBondContact O-CA 3.49Å; C27-A31 PolarHBondContact O-N 2.74Å; C27-Y32 PolarHBondContact N-O 3.04Å; C27-C44 HydrophobicContact CB-CB 4.06Å; C27-C44 VanDerWaalsContact SG-CB 3.57Å; C27-C44 VanDerWaalsContact SG-SG 3.62Å; C27-L52 HydrophobicContact CB-CD2 4.17Å |
| 28 | G | 96.2 | Very high | 90.7 | Very high | 34 Ų | 34 | 88.3 Ų | 88.3 | 35% | 0.351 | 47% | 0.47 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -70.9 | -17.2 | 179 | 0 | 0 | 0 | 0 | 0 | 115.3 | V51 | G28-V51 PolarHBondContact N-O 3.21Å; G28-V51 VanDerWaalsContact N-O 3.09Å |
| 29 | D | 97.4 | Very high | 91.5 | Very high | 118 Ų | 118 | 90.4 Ų | 90.4 | 63% | 0.631 | 48% | 0.476 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -105.6 | -60.3 | -176.9 | -171.6 | 31.4 | 0 | 0 | 0 | 111.6 | C27 Y49 | C27-D29 VanDerWaalsContact C-N 3.26Å; C27-D29 PolarHBondContact O-N 2.86Å; D29-Y49 HydrophobicContact CB-CD1 3.82Å; D29-Y49 HydrophobicContact CB-CE1 4.23Å; D29-Y49 HydrophobicContact CB-CG 3.99Å |
| 30 | C | 97.2 | Very high | 92.2 | Very high | 57 Ų | 57 | 84.5 Ų | 84.5 | 39% | 0.385 | 45% | 0.454 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -90.2 | -0.2 | -178.2 | 67.4 | 0 | 0 | 0 | 0 | 115 | C27 Y32 C47 | C27-C30 VanDerWaalsContact CB-SG 3.54Å; C30-Y32 PolarHBondContact O-N 2.96Å; C30-Y32 VanDerWaalsContact SG-CB 3.52Å; C30-C47 HydrophobicContact CB-CB 4.44Å |
| 31 | A | 96 | Very high | 93 | Very high | 70 Ų | 70 | 83.4 Ų | 83.4 | 58% | 0.579 | 45% | 0.454 | S | S | * | . | trans | 56.7 | 13.5 | -175.8 | 0 | 0 | 0 | 0 | 0 | 115.8 | V26 C27 | V26-A31 HydrophobicContact CG1-CB 4.46Å; V26-A31 WeakPolarHBondContact CG1-O 3.41Å; C27-A31 VanDerWaalsContact O-CA 3.25Å; C27-A31 WeakPolarHBondContact O-CA 3.49Å; C27-A31 PolarHBondContact O-N 2.74Å | ||
| 32 | Y | 96.6 | Very high | 93.6 | Very high | 117 Ų | 117 | 83.1 Ų | 83.1 | 46% | 0.459 | 45% | 0.446 | S | S | . | . | trans | -73.1 | 143.8 | -179.9 | -165.4 | -96.7 | 0 | 0 | 0 | 112.6 | C27 C30 N34 E46 | C27-Y32 PolarHBondContact N-O 3.04Å; C30-Y32 PolarHBondContact O-N 2.96Å; C30-Y32 VanDerWaalsContact SG-CB 3.52Å; Y32-N34 PolarHBondContact O-ND2 2.78Å; Y32-N34 VanDerWaalsContact O-ND2 3.15Å; Y32-E46 HydrophobicContact CD1-CG 3.53Å; Y32-E46 HydrophobicContact CD2-CG 3.92Å; Y32-E46 HydrophobicContact CE1-CG 3.82Å; Y32-E46 HydrophobicContact CE2-CG 4.17Å; Y32-E46 HydrophobicContact CG-CG 3.58Å | ||
| 33 | E | 95.7 | Very high | 94.2 | Very high | 98 Ų | 98 | 84.7 Ų | 84.7 | 46% | 0.458 | 44% | 0.439 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -82.1 | 121.3 | 178.9 | -63.7 | -169.3 | -160.3 | 0 | 0 | 111 | V24 Y25 K55 | V24-E33 HydrophobicContact CG1-CB 3.86Å; V24-E33 HydrophobicContact CG1-CG 4.29Å; Y25-E33 CarbonylContact O-C 3.59Å; Y25-E33 WeakPolarHBondContact O-CA 3.37Å; E33-K55 IonicContact OE1-NZ 2.61Å; E33-K55 PolarHBondContact OE1-NZ 3.31Å; E33-K55 IonicContact OE2-NZ 2.75Å; E33-K55 PolarHBondContact OE2-NZ 3.38Å |
| 34 | N | 94.7 | Very high | 94.6 | Very high | 2 Ų | 2 | 80.1 Ų | 80.1 | 1% | 0.011 | 42% | 0.417 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -117.5 | 125.1 | -179.4 | -68.4 | -84.1 | 0 | 0 | 0 | 110.5 | Y25 Y32 I36 C44 R45 | Y25-N34 PolarHBondContact N-O 2.76Å; Y25-N34 PolarHBondContact O-N 3.45Å; Y32-N34 PolarHBondContact O-ND2 2.78Å; Y32-N34 VanDerWaalsContact O-ND2 3.15Å; N34-I36 HydrophobicContact CB-CD1 4.28Å; N34-I36 HydrophobicContact CB-CG1 4.4Å; N34-C44 PolarHBondContact ND2-SG 3.28Å; N34-R45 PolarHBondContact OD1-N 2.88Å |
| 35 | E | 93.7 | Very high | 94.6 | Very high | 117 Ų | 117 | 86.3 Ų | 86.3 | 55% | 0.547 | 44% | 0.435 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -83.3 | 117.9 | 167.1 | -68 | -175.3 | -171.8 | 0 | 0 | 109.9 | V24 R45 | V24-E35 HydrophobicContact CG2-CG 4.24Å; E35-R45 PolarHBondContact O-NH2 3.38Å |
| 36 | I | 92.3 | Very high | 94.6 | Very high | 18 Ų | 18 | 89 Ų | 89 | 9% | 0.092 | 45% | 0.45 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -120.1 | 123.3 | -178.9 | -55.5 | -63.3 | 0 | 0 | 0 | 108.4 | M23 Y25 N34 D40 I42 L52 | M23-I36 PolarHBondContact O-N 3.32Å; Y25-I36 HydrophobicContact CD2-CB 3.87Å; Y25-I36 HydrophobicContact CD2-CG1 3.93Å; Y25-I36 HydrophobicContact CE2-CB 4Å; N34-I36 HydrophobicContact CB-CD1 4.28Å; N34-I36 HydrophobicContact CB-CG1 4.4Å; I36-D40 HydrophobicContact CG2-CB 3.99Å; I36-I42 HydrophobicContact CG2-CD1 4.11Å; I36-L52 HydrophobicContact CD1-CD1 4.09Å; I36-L52 HydrophobicContact CG1-CD1 3.87Å |
| 37 | R | 90.3 | Very high | 94.6 | Very high | 183 Ų | 183 | 90.1 Ų | 90.1 | 69% | 0.691 | 46% | 0.459 | S | S | * | . | trans | -90.2 | 160.8 | 176.5 | -54.9 | 176 | 69.7 | -161.6 | 1.6 | 110.2 | K39 D40 | R37-K39 PolarHBondContact O-N 3.19Å; R37-D40 VanDerWaalsContact CB-OD2 3.24Å; R37-D40 WeakPolarHBondContact CB-OD2 3.38Å; R37-D40 PolarHBondContact N-OD2 3.15Å; R37-D40 WeakPolarHBondContact O-CB 3.48Å; R37-D40 PolarHBondContact O-N 3.36Å; R37-D40 VanDerWaalsContact O-N 3.1Å | ||
| 38 | P | 89.6 | Confident | 94.5 | Very high | 119 Ų | 119 | 91.2 Ų | 91.2 | 77% | 0.773 | 47% | 0.471 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -55.4 | 133.9 | 170.8 | -23.3 | 33.8 | 0 | 0 | 0 | 110.6 | D40 | P38-D40 VanDerWaalsContact C-N 3.32Š|
| 39 | K | 90.2 | Very high | 94.5 | Very high | 221 Ų | 221 | 94.5 Ų | 94.5 | 96% | 0.961 | 47% | 0.474 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 78.1 | -5.1 | -175.8 | -48.8 | 176.1 | 178.9 | -176.9 | 0 | 116.4 | R37 | R37-K39 PolarHBondContact O-N 3.19Š|
| 40 | D | 91 | Very high | 94.5 | Very high | 67 Ų | 67 | 96.6 Ų | 96.6 | 36% | 0.358 | 47% | 0.473 | S | S | . | . | trans | -69.7 | 150.2 | 173.2 | -70.6 | -10.2 | 0 | 0 | 0 | 110.8 | I36 R37 P38 | I36-D40 HydrophobicContact CG2-CB 3.99Å; R37-D40 VanDerWaalsContact CB-OD2 3.24Å; R37-D40 WeakPolarHBondContact CB-OD2 3.38Å; R37-D40 PolarHBondContact N-OD2 3.15Å; R37-D40 WeakPolarHBondContact O-CB 3.48Å; R37-D40 PolarHBondContact O-N 3.36Å; R37-D40 VanDerWaalsContact O-N 3.1Å; P38-D40 VanDerWaalsContact C-N 3.32Å | ||
| 41 | A | 93.9 | Very high | 94.5 | Very high | 84 Ų | 84 | 97 Ų | 97 | 69% | 0.694 | 47% | 0.473 | S | S | * | . | trans | -67 | 134.9 | 175 | 0 | 0 | 0 | 0 | 0 | 111 | R43 | A41-R43 PolarHBondContact O-N 3.17Š| ||
| 42 | I | 94.7 | Very high | 94.5 | Very high | 97 Ų | 97 | 94.9 Ų | 94.9 | 50% | 0.497 | 45% | 0.452 | S | S | . | . | trans | -75.1 | 97.4 | 177.5 | -51.5 | -57.1 | 0 | 0 | 0 | 109.5 | I36 R50 L52 | I36-I42 HydrophobicContact CG2-CD1 4.11Å; I42-R50 WeakPolarHBondContact CG2-O 3.33Å; I42-L52 HydrophobicContact CG2-CD1 4.04Å; I42-L52 HydrophobicContact CG2-CG 4.24Å | ||
| 43 | R | 95.7 | Very high | 94.5 | Very high | 131 Ų | 131 | 96.2 Ų | 96.2 | 49% | 0.494 | 46% | 0.457 | S | S | . | . | trans | -156 | 137.5 | 177.8 | -169 | -175.2 | -70.4 | -171.4 | 0.7 | 110.5 | A41 G48 Y49 | A41-R43 PolarHBondContact O-N 3.17Å; R43-G48 WeakPolarHBondContact CG-O 3.23Å; R43-Y49 CarbonylContact C-O 3.51Å; R43-Y49 WeakPolarHBondContact CA-O 3.47Å | ||
| 44 | C | 96.8 | Very high | 94.4 | Very high | 2 Ų | 2 | 99.2 Ų | 99.2 | 1% | 0.014 | 47% | 0.469 | C | S | . | . | trans | -67 | 130.4 | 167.2 | -177.9 | 0 | 0 | 0 | 0 | 110.1 | C27 N34 E46 C47 G48 Y49 L52 | C27-C44 HydrophobicContact CB-CB 4.06Å; C27-C44 VanDerWaalsContact SG-CB 3.57Å; C27-C44 VanDerWaalsContact SG-SG 3.62Å; N34-C44 PolarHBondContact ND2-SG 3.28Å; C44-E46 VanDerWaalsContact C-N 3.31Å; C44-E46 PolarHBondContact O-N 2.83Å; C44-C47 VanDerWaalsContact SG-SG 3.68Å; C44-G48 WeakPolarHBondContact O-CA 3.37Å; C44-G48 PolarHBondContact O-N 2.99Å; C44-Y49 PolarHBondContact N-O 3.18Å; C44-L52 HydrophobicContact CB-CD2 4.09Å | ||
| 45 | R | 94.1 | Very high | 94.3 | Very high | 173 Ų | 173 | 103.3 Ų | 103.3 | 65% | 0.653 | 49% | 0.487 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -69.1 | -29.7 | -178.2 | -62.2 | -175.8 | -174 | -154.6 | 5.5 | 113 | N34 E35 | N34-R45 PolarHBondContact OD1-N 2.88Å; E35-R45 PolarHBondContact O-NH2 3.38Å |
| 46 | E | 96.1 | Very high | 94.3 | Very high | 121 Ų | 121 | 106.1 Ų | 106.1 | 57% | 0.565 | 49% | 0.492 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -81.9 | -56.7 | -179.3 | -59 | -56.5 | 143.6 | 0 | 0 | 113.7 | Y32 C44 | Y32-E46 HydrophobicContact CD1-CG 3.53Å; Y32-E46 HydrophobicContact CD2-CG 3.92Å; Y32-E46 HydrophobicContact CE1-CG 3.82Å; Y32-E46 HydrophobicContact CE2-CG 4.17Å; Y32-E46 HydrophobicContact CG-CG 3.58Å; C44-E46 VanDerWaalsContact C-N 3.31Å; C44-E46 PolarHBondContact O-N 2.83Å |
| 47 | C | 96.6 | Very high | 94.2 | Very high | 60 Ų | 60 | 109.1 Ų | 109.1 | 41% | 0.405 | 51% | 0.511 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -105.7 | -6.3 | -172.5 | 66.9 | 0 | 0 | 0 | 0 | 115 | C30 C44 Y49 | C30-C47 HydrophobicContact CB-CB 4.44Å; C44-C47 VanDerWaalsContact SG-SG 3.68Å; C47-Y49 PolarHBondContact O-N 3.25Å; C47-Y49 VanDerWaalsContact SG-CB 3.54Å |
| 48 | G | 95.8 | Very high | 94.3 | Very high | 27 Ų | 27 | 112.2 Ų | 112.2 | 28% | 0.278 | 52% | 0.523 | S | S | . | . | trans | 75 | 0.3 | -178.7 | 0 | 0 | 0 | 0 | 0 | 115.7 | R43 C44 | R43-G48 WeakPolarHBondContact CG-O 3.23Å; C44-G48 WeakPolarHBondContact O-CA 3.37Å; C44-G48 PolarHBondContact O-N 2.99Å | ||
| 49 | Y | 96.7 | Very high | 94.4 | Very high | 103 Ų | 103 | 116.4 Ų | 116.4 | 40% | 0.404 | 52% | 0.523 | S | S | . | . | trans | -60 | 148.6 | 174.5 | -165.3 | -125.2 | 0 | 0 | 0 | 111.4 | D29 R43 C44 C47 V51 | D29-Y49 HydrophobicContact CB-CD1 3.82Å; D29-Y49 HydrophobicContact CB-CE1 4.23Å; D29-Y49 HydrophobicContact CB-CG 3.99Å; R43-Y49 CarbonylContact C-O 3.51Å; R43-Y49 WeakPolarHBondContact CA-O 3.47Å; C44-Y49 PolarHBondContact N-O 3.18Å; C47-Y49 PolarHBondContact O-N 3.25Å; C47-Y49 VanDerWaalsContact SG-CB 3.54Å; Y49-V51 HydrophobicContact CD1-CB 4.12Å; Y49-V51 WeakPolarHBondContact CD1-O 3.25Å; Y49-V51 HydrophobicContact CE1-CB 3.52Å; Y49-V51 HydrophobicContact CE1-CG2 3.97Å | ||
| 50 | R | 96.5 | Very high | 94.6 | Very high | 162 Ų | 162 | 114.8 Ų | 114.8 | 61% | 0.611 | 52% | 0.519 | S | S | * | . | trans | -108.8 | 1.2 | -169.9 | -66.2 | -178.7 | 178 | 79.1 | -6.4 | 114.4 | I42 | I42-R50 WeakPolarHBondContact CG2-O 3.33Š| ||
| 51 | V | 96.9 | Very high | 94.8 | Very high | 64 Ų | 64 | 116.7 Ų | 116.7 | 39% | 0.388 | 53% | 0.528 | S | S | . | . | trans | -106.3 | 123.1 | 174.9 | -173.9 | 0 | 0 | 0 | 0 | 108.9 | G28 Y49 Y53 | G28-V51 PolarHBondContact N-O 3.21Å; G28-V51 VanDerWaalsContact N-O 3.09Å; Y49-V51 HydrophobicContact CD1-CB 4.12Å; Y49-V51 WeakPolarHBondContact CD1-O 3.25Å; Y49-V51 HydrophobicContact CE1-CB 3.52Å; Y49-V51 HydrophobicContact CE1-CG2 3.97Å; V51-Y53 HydrophobicContact CG1-CE1 4.43Å | ||
| 52 | L | 96.4 | Very high | 94.8 | Very high | 27 Ų | 27 | 119.1 Ų | 119.1 | 14% | 0.141 | 53% | 0.533 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -127.4 | 135 | -179.8 | -54.3 | 177.3 | 0 | 0 | 0 | 109 | Y25 V26 C27 I36 I42 C44 | Y25-L52 HydrophobicContact CD1-CB 4.47Å; Y25-L52 HydrophobicContact CG-CB 4.46Å; V26-L52 CarbonylContact O-C 3.45Å; V26-L52 WeakPolarHBondContact O-CA 3.47Å; C27-L52 HydrophobicContact CB-CD2 4.17Å; I36-L52 HydrophobicContact CD1-CD1 4.09Å; I36-L52 HydrophobicContact CG1-CD1 3.87Å; I42-L52 HydrophobicContact CG2-CD1 4.04Å; I42-L52 HydrophobicContact CG2-CG 4.24Å; C44-L52 HydrophobicContact CB-CD2 4.09Å |
| 53 | Y | 96.9 | Very high | 94.8 | Very high | 144 Ų | 144 | 121.3 Ų | 121.3 | 57% | 0.565 | 54% | 0.54 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -97.4 | 145.8 | 176.7 | -61.3 | -64.2 | 0 | 0 | 0 | 111.2 | Y25 V26 V51 | Y25-Y53 CarbonylContact C-O 3.53Å; Y25-Y53 VanDerWaalsContact CA-O 3.23Å; Y25-Y53 WeakPolarHBondContact CA-O 3.24Å; V26-Y53 PolarHBondContact N-O 2.61Å; V26-Y53 PolarHBondContact O-N 2.75Å; V51-Y53 HydrophobicContact CG1-CE1 4.43Å |
| 54 | K | 94.1 | Very high | 94.8 | Very high | 161 Ų | 161 | 120.6 Ų | 120.6 | 70% | 0.7 | 55% | 0.546 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -76.7 | 131.9 | 173.6 | -174 | -177.5 | 177.4 | -172.9 | 0 | 109.9 | Y25 | Y25-K54 HydrophobicContact CD1-CB 4.41Å; Y25-K54 HydrophobicContact CE1-CB 4.35Å |
| 55 | K | 92.5 | Very high | 94.7 | Very high | 89 Ų | 89 | 125.6 Ų | 125.6 | 39% | 0.387 | 59% | 0.587 | S | S | . | * | P | Polyproline II helix | trans | -63.6 | 143.5 | 177.6 | -158.5 | 172.5 | -166.3 | 172.6 | 0 | 111.5 | V26 E33 | V26-K55 HydrophobicContact CG2-CB 4.4Å; V26-K55 HydrophobicContact CG2-CG 4.4Å; E33-K55 IonicContact OE1-NZ 2.61Å; E33-K55 PolarHBondContact OE1-NZ 3.31Å; E33-K55 IonicContact OE2-NZ 2.75Å; E33-K55 PolarHBondContact OE2-NZ 3.38Å |
| 56 | R | 92.7 | Very high | 94.6 | Very high | 176 Ų | 176 | 130.8 Ų | 130.8 | 66% | 0.664 | 61% | 0.606 | S | S | * | * | P | Polyproline II helix | trans | -57.7 | 144.8 | 173.9 | -173.4 | -178 | 168.7 | 104.7 | 0.1 | 110 | ||
| 57 | T | 91.9 | Very high | 94.5 | Very high | 81 Ų | 81 | 131.3 Ų | 131.3 | 50% | 0.497 | 61% | 0.608 | S | S | . | * | P | Polyproline II helix | trans | -62.6 | 148.7 | 173.2 | -174.7 | 0 | 0 | 0 | 0 | 111.5 | R59 | T57-R59 VanDerWaalsContact C-N 3.28Å; T57-R59 HydrophobicContact CG2-CB 4.26Å; T57-R59 PolarHBondContact OG1-N 3.3Å |
| 58 | R | 90.9 | Very high | 94.4 | Very high | 248 Ų | 248 | 135 Ų | 135 | 94% | 0.936 | 62% | 0.619 | S | S | * | * | S | Bend | trans | -81.4 | -7.5 | 170.6 | -66.1 | -174.9 | -179.5 | 176.7 | 0 | 113.2 | ||
| 59 | R | 92 | Very high | 94.3 | Very high | 206 Ų | 206 | 141 Ų | 141 | 78% | 0.777 | 64% | 0.638 | S | S | * | * | S | Bend | trans | -70.1 | 140.9 | 177.6 | -63.3 | -179 | -176.9 | 171.8 | -0.8 | 109.7 | T57 | T57-R59 VanDerWaalsContact C-N 3.28Å; T57-R59 HydrophobicContact CG2-CB 4.26Å; T57-R59 PolarHBondContact OG1-N 3.3Å |
| 60 | E | 94.7 | Very high | 94.2 | Very high | 187 Ų | 187 | 143.2 Ų | 143.2 | 87% | 0.874 | 65% | 0.652 | S | S | * | * | trans | -59.3 | 140 | 172.1 | -66 | -178.2 | 166.3 | 0 | 0 | 109.9 | ||||
| 61 | M | 94 | Very high | 94 | Very high | 108 Ų | 108 | 142.1 Ų | 142.1 | 53% | 0.532 | 65% | 0.654 | S | S | . | * | trans | -126.3 | 111.4 | 177.7 | -167.3 | 174.4 | -176 | 0 | 0 | 106.8 | F63 | M61-F63 HydrophobicContact CB-CE2 4.05Å; M61-F63 HydrophobicContact CB-CZ 4.47Å; M61-F63 HydrophobicContact CE-CE1 3.39Å; M61-F63 HydrophobicContact CE-CE2 4.21Å; M61-F63 HydrophobicContact CE-CZ 3.22Å; M61-F63 HydrophobicContact CG-CD2 4.32Å; M61-F63 HydrophobicContact CG-CE1 4.24Å; M61-F63 HydrophobicContact CG-CE2 3.54Å; M61-F63 HydrophobicContact CG-CZ 3.54Å; M61-F63 HydrophobicContact SD-CE1 4.06Å; M61-F63 HydrophobicContact SD-CE2 3.76Å; M61-F63 HydrophobicContact SD-CZ 3.24Å; M61-F63 WeakPolarHBondContact SD-CZ 3.24Å | ||
| 62 | V | 95.3 | Very high | 93.8 | Very high | 134 Ų | 134 | 147.3 Ų | 147.3 | 81% | 0.812 | 67% | 0.672 | S | S | * | * | trans | -98.5 | 133.6 | -179.9 | -177.3 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 63 | F | 94.7 | Very high | 93.6 | Very high | 144 Ų | 144 | 155.9 Ų | 155.9 | 63% | 0.632 | 71% | 0.71 | S | S | * | * | trans | -122 | 137.3 | 176.6 | -60 | -90.5 | 0 | 0 | 0 | 108.3 | M61 | M61-F63 HydrophobicContact CB-CE2 4.05Å; M61-F63 HydrophobicContact CB-CZ 4.47Å; M61-F63 HydrophobicContact CE-CE1 3.39Å; M61-F63 HydrophobicContact CE-CE2 4.21Å; M61-F63 HydrophobicContact CE-CZ 3.22Å; M61-F63 HydrophobicContact CG-CD2 4.32Å; M61-F63 HydrophobicContact CG-CE1 4.24Å; M61-F63 HydrophobicContact CG-CE2 3.54Å; M61-F63 HydrophobicContact CG-CZ 3.54Å; M61-F63 HydrophobicContact SD-CE1 4.06Å; M61-F63 HydrophobicContact SD-CE2 3.76Å; M61-F63 HydrophobicContact SD-CZ 3.24Å; M61-F63 WeakPolarHBondContact SD-CZ 3.24Å | ||
| 64 | D | 95.6 | Very high | 93.4 | Very high | 116 Ų | 116 | 156.8 Ų | 156.8 | 62% | 0.62 | 72% | 0.721 | S | S | * | * | trans | -92.3 | 141.4 | 164.9 | -163.7 | 2.4 | 0 | 0 | 0 | 108.3 | R66 | D64-R66 VanDerWaalsContact C-N 3.3Å; D64-R66 IonicContact OD1-NE 3.96Å; D64-R66 VanDerWaalsContact OD2-CD 3.32Å; D64-R66 WeakPolarHBondContact OD2-CD 3.32Å; D64-R66 IonicContact OD2-NE 3.69Å; D64-R66 IonicContact OD2-NH1 3.99Å | ||
| 65 | A | 94.2 | Very high | 93.3 | Very high | 107 Ų | 107 | 156.4 Ų | 156.4 | 88% | 0.884 | 72% | 0.723 | S | S | * | * | trans | -96.6 | 22 | -174.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 66 | R | 91.4 | Very high | 93.4 | Very high | 281 Ų | 281 | 162.5 Ų | 162.5 | 100% | 1.06 | 75% | 0.754 | S | S | * | * | trans | -92.3 | 0 | -178.3 | -66.7 | 179.9 | -175.9 | 170.4 | -2.2 | 112.1 | D64 | D64-R66 VanDerWaalsContact C-N 3.3Å; D64-R66 IonicContact OD1-NE 3.96Å; D64-R66 VanDerWaalsContact OD2-CD 3.32Å; D64-R66 WeakPolarHBondContact OD2-CD 3.32Å; D64-R66 IonicContact OD2-NE 3.69Å; D64-R66 IonicContact OD2-NH1 3.99Å |
Retrieved 66 of 66 residues in 15.6 ms
(Link to these results)