| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 41.7 | Very low | 52.6 | Low | 243 Ų | 243 | 121.5 Ų | 121.5 | 100% | 1.197 | 68% | 0.681 | S | S | * | * | 0 | 87 | 0 | -73.8 | -87.4 | 160.8 | 0 | 0 | 105.6 | S3 | M1-S3 PolarHBondContact O-N 2.67Š| |||
| 2 | A | 45.3 | Very low | 52.5 | Low | 86 Ų | 86 | 121.8 Ų | 121.8 | 71% | 0.711 | 70% | 0.698 | S | S | * | * | trans | -77.2 | 104.6 | -162.9 | 0 | 0 | 0 | 0 | 0 | 110.7 | D4 | A2-D4 VanDerWaalsContact C-N 3.29Å; A2-D4 PolarHBondContact O-N 3.02Å | ||
| 3 | S | 54 | Low | 52.2 | Low | 106 Ų | 106 | 125.4 Ų | 125.4 | 74% | 0.741 | 70% | 0.695 | S | S | * | * | trans | -93.9 | 65.6 | 161.7 | 59.3 | 0 | 0 | 0 | 0 | 108.2 | M1 S5 | M1-S3 PolarHBondContact O-N 2.67Å; S3-S5 PolarHBondContact O-N 2.93Å | ||
| 4 | D | 52.9 | Low | 52.3 | Low | 132 Ų | 132 | 125.9 Ų | 125.9 | 71% | 0.706 | 71% | 0.707 | S | S | * | * | trans | -79.3 | 103.5 | 170.2 | -61.9 | -24.6 | 0 | 0 | 0 | 105.9 | A2 I6 | A2-D4 VanDerWaalsContact C-N 3.29Å; A2-D4 PolarHBondContact O-N 3.02Å; D4-I6 PolarHBondContact O-N 2.82Å | ||
| 5 | S | 54.6 | Low | 52.5 | Low | 72 Ų | 72 | 123 Ų | 123 | 50% | 0.503 | 69% | 0.685 | S | S | . | * | trans | -55.5 | 129.9 | -172 | -67.3 | 0 | 0 | 0 | 0 | 109.6 | S3 F7 E8 | S3-S5 PolarHBondContact O-N 2.93Å; S5-F7 PolarHBondContact O-N 3.01Å; S5-E8 PolarHBondContact O-N 2.88Å | ||
| 6 | I | 61.5 | Low | 52.6 | Low | 140 Ų | 140 | 121.3 Ų | 121.3 | 72% | 0.718 | 68% | 0.683 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -54.8 | -17.3 | 179.9 | -142.6 | 161.9 | 0 | 0 | 0 | 113.1 | D4 F10 | D4-I6 PolarHBondContact O-N 2.82Å; I6-F10 WeakPolarHBondContact O-CE2 3.31Å |
| 7 | F | 53.5 | Low | 52.9 | Low | 153 Ų | 153 | 117.4 Ų | 117.4 | 67% | 0.671 | 66% | 0.657 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.1 | -24.2 | 175 | -97.5 | -93 | 0 | 0 | 0 | 114.8 | S5 | S5-F7 PolarHBondContact O-N 3.01Š|
| 8 | E | 55 | Low | 53.5 | Low | 155 Ų | 155 | 116.1 Ų | 116.1 | 72% | 0.724 | 65% | 0.646 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81.6 | -17.1 | 179.8 | -73 | -170.2 | 164.8 | 0 | 0 | 113 | S5 F10 | S5-E8 PolarHBondContact O-N 2.88Å; E8-F10 PolarHBondContact O-N 2.8Å |
| 9 | S | 55.5 | Low | 54.6 | Low | 102 Ų | 102 | 122.3 Ų | 122.3 | 71% | 0.713 | 66% | 0.659 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81.9 | 13.4 | 172 | -162.4 | 0 | 0 | 0 | 0 | 113.1 | P11 | S9-P11 WeakPolarHBondContact O-CD 3.44Š|
| 10 | F | 52.3 | Low | 55.7 | Low | 68 Ų | 68 | 119.6 Ų | 119.6 | 30% | 0.298 | 66% | 0.66 | S | S | . | * | S | Bend | trans | -98.4 | 105.8 | 166.1 | -63 | -65.3 | 0 | 0 | 0 | 108 | I6 E8 S12 | I6-F10 WeakPolarHBondContact O-CE2 3.31Å; E8-F10 PolarHBondContact O-N 2.8Å; F10-S12 PolarHBondContact O-N 3.27Å |
| 11 | P | 52.9 | Low | 57 | Low | 79 Ų | 79 | 119.8 Ų | 119.8 | 51% | 0.513 | 66% | 0.655 | S | S | . | * | trans | -55.5 | 136.7 | 176.8 | 23.4 | -31.6 | 0 | 0 | 0 | 108.5 | S9 Y13 | S9-P11 WeakPolarHBondContact O-CD 3.44Å; P11-Y13 HydrophobicContact CB-CD2 3.92Å; P11-Y13 HydrophobicContact CB-CE2 3.69Å; P11-Y13 HydrophobicContact CG-CD2 3.92Å; P11-Y13 HydrophobicContact CG-CE2 3.87Å; P11-Y13 WeakPolarHBondContact O-CD2 3.47Å; P11-Y13 PolarHBondContact O-N 2.84Å | ||
| 12 | S | 50.7 | Low | 59.3 | Low | 126 Ų | 126 | 110.7 Ų | 110.7 | 88% | 0.881 | 62% | 0.615 | S | S | * | * | S | Bend | trans | -53.7 | 79.1 | -178.9 | -177.2 | 0 | 0 | 0 | 0 | 112.5 | F10 | F10-S12 PolarHBondContact O-N 3.27Š|
| 13 | Y | 49.2 | Very low | 61.5 | Low | 168 Ų | 168 | 111 Ų | 111 | 66% | 0.659 | 60% | 0.6 | S | S | * | * | S | Bend | trans | -124.1 | 149.3 | 162.5 | -59.4 | -74.5 | 0 | 0 | 0 | 104.7 | P11 Q15 | P11-Y13 HydrophobicContact CB-CD2 3.92Å; P11-Y13 HydrophobicContact CB-CE2 3.69Å; P11-Y13 HydrophobicContact CG-CD2 3.92Å; P11-Y13 HydrophobicContact CG-CE2 3.87Å; P11-Y13 WeakPolarHBondContact O-CD2 3.47Å; P11-Y13 PolarHBondContact O-N 2.84Å; Y13-Q15 PolarHBondContact O-N 3.49Å |
| 14 | P | 53.6 | Low | 63.3 | Low | 132 Ų | 132 | 109 Ų | 109 | 86% | 0.857 | 58% | 0.584 | S | S | * | * | trans | -62.9 | 84 | 163.2 | 28.1 | -31.9 | 0 | 0 | 0 | 106.4 | C16 | P14-C16 PolarHBondContact O-N 3.43Š| ||
| 15 | Q | 55.4 | Low | 65.2 | Low | 83 Ų | 83 | 106.8 Ų | 106.8 | 39% | 0.388 | 57% | 0.572 | S | S | . | * | trans | -69.2 | 87.2 | -174.7 | -176.8 | 106.6 | -39.3 | 0 | 0 | 104.8 | Y13 F17 | Y13-Q15 PolarHBondContact O-N 3.49Å; Q15-F17 PolarHBondContact O-N 2.81Å | ||
| 16 | C | 53 | Low | 67.2 | Low | 96 Ų | 96 | 107.4 Ų | 107.4 | 65% | 0.649 | 57% | 0.573 | S | S | * | * | trans | -44.5 | 90 | 153.1 | 173.6 | 0 | 0 | 0 | 0 | 105.3 | P14 M18 | P14-C16 PolarHBondContact O-N 3.43Å; C16-M18 VanDerWaalsContact C-N 3.34Å; C16-M18 WeakPolarHBondContact O-CA 3.48Å; C16-M18 PolarHBondContact O-N 3.49Å | ||
| 17 | F | 58.3 | Low | 68.8 | Low | 55 Ų | 55 | 105.7 Ų | 105.7 | 24% | 0.241 | 56% | 0.564 | C | S | . | * | trans | -47.1 | 108.2 | 174.7 | -96 | -76.9 | 0 | 0 | 0 | 105.5 | Q15 R19 F23 I45 | Q15-F17 PolarHBondContact O-N 2.81Å; F17-R19 PolarHBondContact O-N 2.97Å; F17-F23 HydrophobicContact CD1-CE2 4.43Å; F17-F23 HydrophobicContact CE1-CE2 4.46Å; F17-I45 WeakPolarHBondContact CB-O 3.47Å; F17-I45 HydrophobicContact CD1-CB 3.54Å; F17-I45 HydrophobicContact CD1-CG2 3.48Å; F17-I45 VanDerWaalsContact CD1-CG2 3.48Å; F17-I45 HydrophobicContact CD2-CG2 4.32Å; F17-I45 HydrophobicContact CE1-CB 3.58Å; F17-I45 HydrophobicContact CE1-CG1 4.34Å; F17-I45 HydrophobicContact CE1-CG2 3.22Å; F17-I45 HydrophobicContact CE2-CG2 4.1Å; F17-I45 HydrophobicContact CG-CB 4.35Å; F17-I45 HydrophobicContact CG-CG2 4.03Å; F17-I45 HydrophobicContact CZ-CB 4.41Å; F17-I45 HydrophobicContact CZ-CG2 3.56Å | ||
| 18 | M | 64.6 | Low | 70.8 | Confident | 93 Ų | 93 | 101.4 Ų | 101.4 | 46% | 0.458 | 55% | 0.55 | S | S | . | * | trans | -52.2 | 104.6 | -150.7 | -77.7 | -134.6 | 54.2 | 0 | 0 | 110.8 | C16 G20 K21 | C16-M18 VanDerWaalsContact C-N 3.34Å; C16-M18 WeakPolarHBondContact O-CA 3.48Å; C16-M18 PolarHBondContact O-N 3.49Å; M18-G20 PolarHBondContact O-N 3.22Å; M18-K21 HydrophobicContact CB-CB 3.8Å; M18-K21 HydrophobicContact CB-CD 3.66Å; M18-K21 HydrophobicContact CB-CG 3.76Å; M18-K21 HydrophobicContact CE-CD 3.81Å; M18-K21 HydrophobicContact CE-CG 4.46Å; M18-K21 VanDerWaalsContact CE-NZ 3.28Å; M18-K21 HydrophobicContact CG-CD 4.1Å; M18-K21 PolarHBondContact O-N 2.74Å; M18-K21 HydrophobicContact SD-CD 3.55Å; M18-K21 VanDerWaalsContact SD-CD 3.55Å; M18-K21 WeakPolarHBondContact SD-CE 3.38Å; M18-K21 PolarHBondContact SD-NZ 3.19Å | ||
| 19 | R | 74.5 | Confident | 72.9 | Confident | 235 Ų | 235 | 97.7 Ų | 97.7 | 89% | 0.887 | 54% | 0.538 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -52.6 | 111.7 | -178 | 178.7 | 177.7 | 166 | 115.3 | -2.1 | 108 | F17 | F17-R19 PolarHBondContact O-N 2.97Š|
| 20 | G | 76.3 | Confident | 74.8 | Confident | 67 Ų | 67 | 101.7 Ų | 101.7 | 69% | 0.691 | 54% | 0.543 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 96.7 | 1.5 | -179.4 | 0 | 0 | 0 | 0 | 0 | 116.7 | M18 | M18-G20 PolarHBondContact O-N 3.22Š|
| 21 | K | 83.3 | Confident | 77 | Confident | 124 Ų | 124 | 101 Ų | 101 | 54% | 0.539 | 54% | 0.544 | S | S | . | . | trans | -105.6 | 142.3 | 174.1 | -59.8 | -169.5 | -178.1 | 175 | 0 | 111.6 | M18 K44 | M18-K21 HydrophobicContact CB-CB 3.8Å; M18-K21 HydrophobicContact CB-CD 3.66Å; M18-K21 HydrophobicContact CB-CG 3.76Å; M18-K21 HydrophobicContact CE-CD 3.81Å; M18-K21 HydrophobicContact CE-CG 4.46Å; M18-K21 VanDerWaalsContact CE-NZ 3.28Å; M18-K21 HydrophobicContact CG-CD 4.1Å; M18-K21 PolarHBondContact O-N 2.74Å; M18-K21 HydrophobicContact SD-CD 3.55Å; M18-K21 VanDerWaalsContact SD-CD 3.55Å; M18-K21 WeakPolarHBondContact SD-CE 3.38Å; M18-K21 PolarHBondContact SD-NZ 3.19Å; K21-K44 WeakPolarHBondContact O-CG 3.45Å | ||
| 22 | S | 90.1 | Very high | 79 | Confident | 53 Ų | 53 | 105.2 Ų | 105.2 | 37% | 0.371 | 56% | 0.562 | S | S | . | * | trans | -116.2 | 145.3 | 177.9 | -55.6 | 0 | 0 | 0 | 0 | 110.2 | I43 | S22-I43 CarbonylContact C-O 3.52Å; S22-I43 WeakPolarHBondContact CA-O 3.39Å | ||
| 23 | F | 90.4 | Very high | 81.1 | Confident | 91 Ų | 91 | 104.1 Ų | 104.1 | 40% | 0.399 | 55% | 0.553 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -79.8 | 145.2 | 174.5 | -75 | -93.3 | 0 | 0 | 0 | 111.1 | F17 R41 A42 I43 I45 | F17-F23 HydrophobicContact CD1-CE2 4.43Å; F17-F23 HydrophobicContact CE1-CE2 4.46Å; F23-R41 CarbonylContact O-C 3.42Å; F23-R41 WeakPolarHBondContact O-CA 3.18Å; F23-A42 PolarHBondContact O-N 2.79Å; F23-I43 HydrophobicContact CB-CG2 3.93Å; F23-I43 PolarHBondContact N-O 3.16Å; F23-I43 PolarHBondContact O-N 2.82Å; F23-I45 HydrophobicContact CD2-CB 4.43Å; F23-I45 HydrophobicContact CD2-CG1 3.75Å; F23-I45 HydrophobicContact CE2-CB 4.11Å; F23-I45 HydrophobicContact CE2-CG1 3.77Å |
| 24 | T | 92.5 | Very high | 83.4 | Confident | 66 Ų | 66 | 100 Ų | 100 | 41% | 0.405 | 55% | 0.547 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -94.1 | 129.9 | 168.4 | -64.8 | 0 | 0 | 0 | 0 | 107.8 | T38 Y39 | T24-T38 HydrophobicContact CG2-CG2 3.53Å; T24-Y39 WeakPolarHBondContact CA-O 3.22Å |
| 25 | L | 92.8 | Very high | 85.4 | Confident | 84 Ų | 84 | 99.5 Ų | 99.5 | 44% | 0.44 | 53% | 0.533 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -99.3 | 131.5 | 176 | -65.7 | 177.2 | 0 | 0 | 0 | 109.4 | Y39 A42 | L25-Y39 PolarHBondContact N-O 3.23Å; L25-Y39 PolarHBondContact O-N 2.84Å; L25-A42 HydrophobicContact CB-CB 4.05Å; L25-A42 HydrophobicContact CD1-CB 3.7Å; L25-A42 HydrophobicContact CG-CB 3.66Å |
| 26 | T | 95.3 | Very high | 87.4 | Confident | 85 Ų | 85 | 99.9 Ų | 99.9 | 52% | 0.521 | 54% | 0.54 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -115 | 115.8 | 173.3 | -56.8 | 0 | 0 | 0 | 0 | 107.8 | V36 A37 | T26-V36 HydrophobicContact CG2-CG1 3.38Å; T26-A37 WeakPolarHBondContact CA-O 3.49Å |
| 27 | I | 95.7 | Very high | 89.4 | Confident | 104 Ų | 104 | 98 Ų | 98 | 53% | 0.533 | 53% | 0.532 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -105.4 | 120.9 | 179.7 | -56.2 | 168.4 | 0 | 0 | 0 | 107.3 | A37 | I27-A37 PolarHBondContact N-O 2.92Å; I27-A37 PolarHBondContact O-N 3.17Å |
| 28 | T | 96.2 | Very high | 91.3 | Very high | 64 Ų | 64 | 99 Ų | 99 | 39% | 0.393 | 54% | 0.542 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -103.6 | 121.1 | 176.2 | -56.9 | 0 | 0 | 0 | 0 | 109.2 | F30 V36 | T28-F30 HydrophobicContact CG2-CD1 4.43Å; T28-F30 HydrophobicContact CG2-CE1 4.1Å; T28-F30 HydrophobicContact CG2-CZ 4.24Å; T28-V36 HydrophobicContact CG2-CG2 4.34Å |
| 29 | V | 97.5 | Very high | 92.8 | Very high | 77 Ų | 77 | 101.9 Ų | 101.9 | 47% | 0.467 | 55% | 0.549 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -100.6 | 117.7 | 173.1 | -170.2 | 0 | 0 | 0 | 0 | 108.3 | T31 Q35 | V29-T31 VanDerWaalsContact C-N 3.27Å; V29-T31 HydrophobicContact CG1-CG2 4.05Å; V29-T31 PolarHBondContact O-N 3.08Å; V29-Q35 PolarHBondContact N-O 3.33Å; V29-Q35 PolarHBondContact O-N 2.84Å |
| 30 | F | 97 | Very high | 93.8 | Very high | 186 Ų | 186 | 96.8 Ų | 96.8 | 82% | 0.816 | 54% | 0.535 | S | S | * | . | trans | -78.8 | 74.3 | -179.8 | -64.8 | -72.2 | 0 | 0 | 0 | 111.4 | T28 | T28-F30 HydrophobicContact CG2-CD1 4.43Å; T28-F30 HydrophobicContact CG2-CE1 4.1Å; T28-F30 HydrophobicContact CG2-CZ 4.24Å | ||
| 31 | T | 97 | Very high | 94.6 | Very high | 53 Ų | 53 | 103.1 Ų | 103.1 | 33% | 0.325 | 54% | 0.539 | S | S | . | . | trans | -98.5 | 175.6 | 164.1 | 52.7 | 0 | 0 | 0 | 0 | 110.4 | V29 P33 P34 Q35 | V29-T31 VanDerWaalsContact C-N 3.27Å; V29-T31 HydrophobicContact CG1-CG2 4.05Å; V29-T31 PolarHBondContact O-N 3.08Å; T31-P33 VanDerWaalsContact C-C 3.4Å; T31-P33 CarbonylContact C-O 3.24Å; T31-P33 VanDerWaalsContact C-O 3.24Å; T31-P33 CarbonylContact O-C 2.94Å; T31-P33 PolarHBondContact OG1-O 3.5Å; T31-P34 VanDerWaalsContact O-CA 3.31Å; T31-P34 WeakPolarHBondContact O-CA 3.17Å; T31-P34 WeakPolarHBondContact O-CD 3.37Å; T31-Q35 PolarHBondContact OG1-NE2 2.82Å | ||
| 32 | N | 95.5 | Very high | 95.1 | Very high | 167 Ų | 167 | 98.6 Ų | 98.6 | 89% | 0.893 | 52% | 0.524 | S | S | * | . | S | Bend | trans | -111.9 | 103 | 168.7 | -80.5 | -24.9 | 0 | 0 | 0 | 109.3 | ||
| 33 | P | 95.4 | Very high | 95.2 | Very high | 104 Ų | 104 | 99.6 Ų | 99.6 | 68% | 0.675 | 53% | 0.525 | S | S | * | . | S | Bend | cis | -79 | 159.6 | 3 | 32.7 | -36.2 | 0 | 0 | 0 | 113.9 | T31 | T31-P33 VanDerWaalsContact C-C 3.4Å; T31-P33 CarbonylContact C-O 3.24Å; T31-P33 VanDerWaalsContact C-O 3.24Å; T31-P33 CarbonylContact O-C 2.94Å; T31-P33 PolarHBondContact OG1-O 3.5Å |
| 34 | P | 96.5 | Very high | 95.1 | Very high | 82 Ų | 82 | 101 Ų | 101 | 53% | 0.532 | 53% | 0.53 | S | S | . | . | trans | -64.1 | 140.7 | 177.7 | -23.3 | 33.8 | 0 | 0 | 0 | 111.9 | T31 | T31-P34 VanDerWaalsContact O-CA 3.31Å; T31-P34 WeakPolarHBondContact O-CA 3.17Å; T31-P34 WeakPolarHBondContact O-CD 3.37Å | ||
| 35 | Q | 96.6 | Very high | 94.8 | Very high | 121 Ų | 121 | 100.9 Ų | 100.9 | 57% | 0.565 | 53% | 0.526 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -112.9 | 134.8 | -179.9 | -67.6 | 175.8 | 64.7 | 0 | 0 | 109.8 | V29 T31 | V29-Q35 PolarHBondContact N-O 3.33Å; V29-Q35 PolarHBondContact O-N 2.84Å; T31-Q35 PolarHBondContact OG1-NE2 2.82Å |
| 36 | V | 96.7 | Very high | 94.4 | Very high | 90 Ų | 90 | 99 Ų | 99 | 55% | 0.545 | 52% | 0.519 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -119.7 | 122.3 | -179.7 | -175.8 | 0 | 0 | 0 | 0 | 109 | T26 T28 | T26-V36 HydrophobicContact CG2-CG1 3.38Å; T28-V36 HydrophobicContact CG2-CG2 4.34Å |
| 37 | A | 96.1 | Very high | 93.9 | Very high | 58 Ų | 58 | 101.2 Ų | 101.2 | 48% | 0.479 | 53% | 0.532 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -110.2 | 125.7 | 174.3 | 0 | 0 | 0 | 0 | 0 | 109.6 | T26 I27 | T26-A37 WeakPolarHBondContact CA-O 3.49Å; I27-A37 PolarHBondContact N-O 2.92Å; I27-A37 PolarHBondContact O-N 3.17Å |
| 38 | T | 96.9 | Very high | 93.3 | Very high | 74 Ų | 74 | 100.3 Ų | 100.3 | 45% | 0.454 | 53% | 0.528 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -110.5 | 122.9 | 179.8 | -56.2 | 0 | 0 | 0 | 0 | 109.8 | T24 | T24-T38 HydrophobicContact CG2-CG2 3.53Å |
| 39 | Y | 97.5 | Very high | 92.9 | Very high | 155 Ų | 155 | 98.7 Ų | 98.7 | 61% | 0.608 | 52% | 0.524 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -112.6 | 105.8 | 175 | -171.4 | -141.6 | 0 | 0 | 0 | 110.8 | T24 L25 A42 | T24-Y39 WeakPolarHBondContact CA-O 3.22Å; L25-Y39 PolarHBondContact N-O 3.23Å; L25-Y39 PolarHBondContact O-N 2.84Å; Y39-A42 HydrophobicContact CD1-CB 3.24Å; Y39-A42 HydrophobicContact CE1-CB 3.73Å; Y39-A42 HydrophobicContact CG-CB 3.94Å; Y39-A42 WeakPolarHBondContact O-CB 3.43Å |
| 40 | H | 95.6 | Very high | 92.5 | Very high | 128 Ų | 128 | 101.6 Ų | 101.6 | 59% | 0.593 | 54% | 0.544 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -74.4 | 137.5 | -177.4 | -65 | -67.5 | 0 | 0 | 0 | 112.2 | A42 | H40-A42 PolarHBondContact O-N 3.15Å |
| 41 | R | 92.4 | Very high | 92 | Very high | 200 Ų | 200 | 98.9 Ų | 98.9 | 76% | 0.755 | 53% | 0.529 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | 53.7 | 38.3 | 179.5 | -54.9 | 176.6 | -65.9 | -165.5 | -1.4 | 112.5 | F23 I43 | F23-R41 CarbonylContact O-C 3.42Å; F23-R41 WeakPolarHBondContact O-CA 3.18Å; R41-I43 PolarHBondContact O-N 3.13Å |
| 42 | A | 92.9 | Very high | 91.7 | Very high | 28 Ų | 28 | 103.6 Ų | 103.6 | 23% | 0.231 | 55% | 0.547 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -65.6 | -37.2 | -174.1 | 0 | 0 | 0 | 0 | 0 | 113.6 | F23 L25 Y39 H40 | F23-A42 PolarHBondContact O-N 2.79Å; L25-A42 HydrophobicContact CB-CB 4.05Å; L25-A42 HydrophobicContact CD1-CB 3.7Å; L25-A42 HydrophobicContact CG-CB 3.66Å; Y39-A42 HydrophobicContact CD1-CB 3.24Å; Y39-A42 HydrophobicContact CE1-CB 3.73Å; Y39-A42 HydrophobicContact CG-CB 3.94Å; Y39-A42 WeakPolarHBondContact O-CB 3.43Å; H40-A42 PolarHBondContact O-N 3.15Å |
| 43 | I | 92.1 | Very high | 91.5 | Very high | 75 Ų | 75 | 101.2 Ų | 101.2 | 39% | 0.385 | 54% | 0.541 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -148.2 | 135.7 | -175.8 | -170.7 | 165.5 | 0 | 0 | 0 | 112 | S22 F23 R41 I45 | S22-I43 CarbonylContact C-O 3.52Å; S22-I43 WeakPolarHBondContact CA-O 3.39Å; F23-I43 HydrophobicContact CB-CG2 3.93Å; F23-I43 PolarHBondContact N-O 3.16Å; F23-I43 PolarHBondContact O-N 2.82Å; R41-I43 PolarHBondContact O-N 3.13Å; I43-I45 HydrophobicContact CD1-CD1 3.64Å; I43-I45 HydrophobicContact CG1-CD1 3.8Å; I43-I45 HydrophobicContact CG2-CD1 4.19Å |
| 44 | K | 88.7 | Confident | 91.1 | Very high | 120 Ų | 120 | 104.6 Ų | 104.6 | 52% | 0.522 | 54% | 0.54 | S | S | . | . | trans | -99.8 | 111.9 | 167.2 | -176.4 | -175.4 | 65.2 | -179.7 | 0 | 107.9 | K21 T46 | K21-K44 WeakPolarHBondContact O-CG 3.45Å; K44-T46 HydrophobicContact CD-CG2 4.03Å; K44-T46 HydrophobicContact CG-CG2 3.95Å | ||
| 45 | I | 86.4 | Confident | 90.5 | Very high | 63 Ų | 63 | 107.9 Ų | 107.9 | 32% | 0.323 | 55% | 0.553 | S | S | . | * | trans | -79.8 | 131.5 | 172.8 | -51.6 | -62.6 | 0 | 0 | 0 | 107.9 | F17 F23 I43 | F17-I45 WeakPolarHBondContact CB-O 3.47Å; F17-I45 HydrophobicContact CD1-CB 3.54Å; F17-I45 HydrophobicContact CD1-CG2 3.48Å; F17-I45 VanDerWaalsContact CD1-CG2 3.48Å; F17-I45 HydrophobicContact CD2-CG2 4.32Å; F17-I45 HydrophobicContact CE1-CB 3.58Å; F17-I45 HydrophobicContact CE1-CG1 4.34Å; F17-I45 HydrophobicContact CE1-CG2 3.22Å; F17-I45 HydrophobicContact CE2-CG2 4.1Å; F17-I45 HydrophobicContact CG-CB 4.35Å; F17-I45 HydrophobicContact CG-CG2 4.03Å; F17-I45 HydrophobicContact CZ-CB 4.41Å; F17-I45 HydrophobicContact CZ-CG2 3.56Å; F23-I45 HydrophobicContact CD2-CB 4.43Å; F23-I45 HydrophobicContact CD2-CG1 3.75Å; F23-I45 HydrophobicContact CE2-CB 4.11Å; F23-I45 HydrophobicContact CE2-CG1 3.77Å; I43-I45 HydrophobicContact CD1-CD1 3.64Å; I43-I45 HydrophobicContact CG1-CD1 3.8Å; I43-I45 HydrophobicContact CG2-CD1 4.19Å | ||
| 46 | T | 85.4 | Confident | 89.4 | Confident | 45 Ų | 45 | 113.5 Ų | 113.5 | 28% | 0.276 | 57% | 0.569 | S | S | . | * | trans | -146.1 | 151.2 | 175.6 | 54.6 | 0 | 0 | 0 | 0 | 107.8 | K44 D48 G49 | K44-T46 HydrophobicContact CD-CG2 4.03Å; K44-T46 HydrophobicContact CG-CG2 3.95Å; T46-D48 PolarHBondContact O-N 3.09Å; T46-G49 WeakPolarHBondContact OG1-CA 3.18Å; T46-G49 PolarHBondContact OG1-N 2.79Å; T46-G49 VanDerWaalsContact OG1-N 3.08Å | ||
| 47 | V | 84.2 | Confident | 88 | Confident | 132 Ų | 132 | 115 Ų | 115 | 80% | 0.8 | 58% | 0.579 | S | S | * | * | S | Bend | trans | -60.5 | -47.3 | 178.8 | 178.9 | 0 | 0 | 0 | 0 | 112 | ||
| 48 | D | 83.1 | Confident | 86.4 | Confident | 84 Ų | 84 | 120.2 Ų | 120.2 | 45% | 0.449 | 59% | 0.593 | S | S | . | * | S | Bend | trans | -86 | -15.9 | -174.6 | -83.1 | -11.2 | 0 | 0 | 0 | 113.6 | T46 R51 R54 | T46-D48 PolarHBondContact O-N 3.09Å; D48-R51 HydrophobicContact CB-CB 4.22Å; D48-R51 VanDerWaalsContact CG-NH1 3.26Å; D48-R51 IonicContact OD1-NH1 3.24Å; D48-R51 PolarHBondContact OD1-NH1 3.3Å; D48-R51 VanDerWaalsContact OD2-CD 3.22Å; D48-R51 WeakPolarHBondContact OD2-CD 3.25Å; D48-R51 IonicContact OD2-CZ 3.72Å; D48-R51 IonicContact OD2-NE 3.86Å; D48-R51 IonicContact OD2-NH1 2.79Å; D48-R51 PolarHBondContact OD2-NH1 3.07Å; D48-R54 IonicContact OD2-NH2 3.09Å; D48-R54 PolarHBondContact OD2-NH2 2.7Å; D48-R54 VanDerWaalsContact OD2-NH2 3.09Å |
| 49 | G | 86.8 | Confident | 84.6 | Confident | 30 Ų | 30 | 126.1 Ų | 126.1 | 31% | 0.309 | 61% | 0.613 | S | S | . | * | trans | 67.4 | -164.8 | -167.2 | 0 | 0 | 0 | 0 | 0 | 113 | T46 R51 | T46-G49 WeakPolarHBondContact OG1-CA 3.18Å; T46-G49 PolarHBondContact OG1-N 2.79Å; T46-G49 VanDerWaalsContact OG1-N 3.08Å; G49-R51 PolarHBondContact O-N 3.24Å; G49-R51 VanDerWaalsContact O-N 3.16Å | ||
| 50 | P | 89.6 | Confident | 82.4 | Confident | 138 Ų | 138 | 125.9 Ų | 125.9 | 90% | 0.896 | 62% | 0.617 | S | S | * | * | S | Bend | trans | -59.7 | 113.6 | 165.3 | -17.1 | 31.2 | 0 | 0 | 0 | 108.8 | ||
| 51 | R | 87.4 | Confident | 80.5 | Confident | 130 Ų | 130 | 125.3 Ų | 125.3 | 49% | 0.491 | 63% | 0.627 | S | S | . | * | trans | -126.9 | 137.8 | -175.9 | -175.6 | 176.9 | 179.4 | 158.5 | 9.4 | 110.3 | D48 G49 R54 | D48-R51 HydrophobicContact CB-CB 4.22Å; D48-R51 VanDerWaalsContact CG-NH1 3.26Å; D48-R51 IonicContact OD1-NH1 3.24Å; D48-R51 PolarHBondContact OD1-NH1 3.3Å; D48-R51 VanDerWaalsContact OD2-CD 3.22Å; D48-R51 WeakPolarHBondContact OD2-CD 3.25Å; D48-R51 IonicContact OD2-CZ 3.72Å; D48-R51 IonicContact OD2-NE 3.86Å; D48-R51 IonicContact OD2-NH1 2.79Å; D48-R51 PolarHBondContact OD2-NH1 3.07Å; G49-R51 PolarHBondContact O-N 3.24Å; G49-R51 VanDerWaalsContact O-N 3.16Å; R51-R54 VanDerWaalsContact NH2-NE 3.17Å | ||
| 52 | E | 90.4 | Very high | 78.4 | Confident | 152 Ų | 152 | 119.1 Ų | 119.1 | 71% | 0.71 | 61% | 0.612 | S | S | * | * | trans | -59.3 | 150.4 | 175.2 | -68.1 | 69.9 | -153.3 | 0 | 0 | 111.3 | R54 | E52-R54 PolarHBondContact O-N 2.92Š| ||
| 53 | P | 91.1 | Very high | 76.7 | Confident | 117 Ų | 117 | 125.4 Ų | 125.4 | 76% | 0.76 | 64% | 0.638 | S | S | * | * | trans | -54.7 | 125.7 | 170.3 | -22.4 | 33.3 | 0 | 0 | 0 | 110 | N55 | P53-N55 PolarHBondContact O-N 2.73Å; P53-N55 VanDerWaalsContact O-N 3.15Å | ||
| 54 | R | 87.4 | Confident | 74.7 | Confident | 174 Ų | 174 | 127.5 Ų | 127.5 | 66% | 0.657 | 66% | 0.656 | S | S | * | * | trans | -69.5 | 115.1 | 175.4 | -65.2 | -176.7 | -163.1 | 153.4 | 3.8 | 108.4 | D48 R51 E52 R56 | D48-R54 IonicContact OD2-NH2 3.09Å; D48-R54 PolarHBondContact OD2-NH2 2.7Å; D48-R54 VanDerWaalsContact OD2-NH2 3.09Å; R51-R54 VanDerWaalsContact NH2-NE 3.17Å; E52-R54 PolarHBondContact O-N 2.92Å; R54-R56 PolarHBondContact O-N 2.86Å | ||
| 55 | N | 83.8 | Confident | 73.1 | Confident | 151 Ų | 151 | 129.4 Ų | 129.4 | 81% | 0.807 | 67% | 0.673 | S | S | * | * | trans | -59.8 | 121 | 170.7 | -67.9 | -31.4 | 0 | 0 | 0 | 108.8 | P53 T57 | P53-N55 PolarHBondContact O-N 2.73Å; P53-N55 VanDerWaalsContact O-N 3.15Å; N55-T57 PolarHBondContact O-N 2.72Å; N55-T57 VanDerWaalsContact O-N 3.13Å | ||
| 56 | R | 72.9 | Confident | 71.3 | Confident | 239 Ų | 239 | 130.8 Ų | 130.8 | 90% | 0.902 | 69% | 0.688 | S | S | * | * | trans | -74.9 | 98.6 | 162.8 | -80.9 | -176.6 | 172.8 | 176.5 | -2.2 | 105.9 | R54 E58 | R54-R56 PolarHBondContact O-N 2.86Å; R56-E58 VanDerWaalsContact C-N 3.32Å; R56-E58 PolarHBondContact O-N 2.63Å | ||
| 57 | T | 67.1 | Low | 69.8 | Low | 121 Ų | 121 | 134.2 Ų | 134.2 | 74% | 0.742 | 71% | 0.711 | S | S | * | * | trans | -56.6 | 107.9 | 157.8 | -53.1 | 0 | 0 | 0 | 0 | 105.4 | N55 K59 | N55-T57 PolarHBondContact O-N 2.72Å; N55-T57 VanDerWaalsContact O-N 3.13Å; T57-K59 VanDerWaalsContact C-N 3.26Å; T57-K59 PolarHBondContact O-N 2.66Å | ||
| 58 | E | 62.5 | Low | 68.5 | Low | 168 Ų | 168 | 134.3 Ų | 134.3 | 79% | 0.785 | 71% | 0.711 | S | S | * | * | trans | -54.8 | 105.9 | 159.6 | -69.1 | -163 | 162.9 | 0 | 0 | 104.6 | R56 H60 | R56-E58 VanDerWaalsContact C-N 3.32Å; R56-E58 PolarHBondContact O-N 2.63Å; E58-H60 PolarHBondContact O-N 3.31Å | ||
| 59 | K | 60.2 | Low | 66.9 | Low | 199 Ų | 199 | 137.7 Ų | 137.7 | 87% | 0.865 | 73% | 0.729 | S | S | * | * | trans | -65.1 | 83.8 | 162.1 | -67.2 | -172.7 | 179.9 | -176.7 | 0 | 104.2 | T57 S61 | T57-K59 VanDerWaalsContact C-N 3.26Å; T57-K59 PolarHBondContact O-N 2.66Å; K59-S61 PolarHBondContact O-N 3.4Å | ||
| 60 | H | 51.2 | Low | 65.4 | Low | 150 Ų | 150 | 142.6 Ų | 142.6 | 69% | 0.694 | 75% | 0.753 | S | S | * | * | trans | -58.2 | 93.4 | 160.8 | -166.4 | -124.6 | 0 | 0 | 0 | 103.9 | E58 T62 | E58-H60 PolarHBondContact O-N 3.31Å; H60-T62 PolarHBondContact CD2-OG1 2.81Å; H60-T62 WeakPolarHBondContact CE1-CB 3.36Å; H60-T62 PolarHBondContact CE1-OG1 3.32Å; H60-T62 VanDerWaalsContact CG-OG1 3.25Å; H60-T62 WeakPolarHBondContact ND1-CB 3.15Å; H60-T62 PolarHBondContact ND1-OG1 2.92Å; H60-T62 PolarHBondContact NE2-OG1 2.8Å; H60-T62 PolarHBondContact O-N 3.03Å | ||
| 61 | S | 54.5 | Low | 63.3 | Low | 115 Ų | 115 | 143.3 Ų | 143.3 | 80% | 0.804 | 74% | 0.742 | S | S | * | * | trans | -64.7 | 74 | 163.5 | 162.6 | 0 | 0 | 0 | 0 | 106.3 | K59 | K59-S61 PolarHBondContact O-N 3.4Š| ||
| 62 | T | 49.4 | Very low | 61.6 | Low | 71 Ų | 71 | 143.9 Ų | 143.9 | 44% | 0.436 | 76% | 0.76 | S | S | . | * | trans | -128 | 91.5 | 173.4 | -54.7 | 0 | 0 | 0 | 0 | 105.6 | H60 | H60-T62 PolarHBondContact CD2-OG1 2.81Å; H60-T62 WeakPolarHBondContact CE1-CB 3.36Å; H60-T62 PolarHBondContact CE1-OG1 3.32Å; H60-T62 VanDerWaalsContact CG-OG1 3.25Å; H60-T62 WeakPolarHBondContact ND1-CB 3.15Å; H60-T62 PolarHBondContact ND1-OG1 2.92Å; H60-T62 PolarHBondContact NE2-OG1 2.8Å; H60-T62 PolarHBondContact O-N 3.03Å | ||
| 63 | M | 56.6 | Low | 59.5 | Low | 159 Ų | 159 | 142.6 Ų | 142.6 | 78% | 0.783 | 75% | 0.754 | S | S | * | * | trans | -44.8 | 131.5 | 158.5 | -68.8 | -75.4 | 167.1 | 0 | 0 | 107.9 | D65 | M63-D65 PolarHBondContact O-N 3Š| ||
| 64 | P | 49.9 | Very low | 57.7 | Low | 119 Ų | 119 | 142.5 Ų | 142.5 | 77% | 0.773 | 76% | 0.756 | S | S | * | * | S | Bend | trans | -77.2 | 91.1 | 178.8 | 31.7 | -30.1 | 0 | 0 | 0 | 108.3 | ||
| 65 | D | 54.1 | Low | 56.1 | Low | 161 Ų | 161 | 143.4 Ų | 143.4 | 86% | 0.861 | 76% | 0.76 | S | S | * | * | trans | 170.9 | 66 | 152.7 | -97.3 | -13.4 | 0 | 0 | 0 | 110.6 | M63 | M63-D65 PolarHBondContact O-N 3Š| ||
| 66 | S | 50.5 | Low | 54.7 | Low | 92 Ų | 92 | 144.1 Ų | 144.1 | 64% | 0.643 | 76% | 0.763 | S | S | * | * | trans | -109.4 | 111.7 | 164.4 | -49.4 | 0 | 0 | 0 | 0 | 107.5 | V68 | S66-V68 PolarHBondContact O-N 2.81Š| ||
| 67 | P | 53.1 | Low | 53.9 | Low | 117 Ų | 117 | 137.2 Ų | 137.2 | 76% | 0.76 | 75% | 0.747 | S | S | * | * | trans | -64.6 | 135.5 | -178.8 | 26.9 | -31.3 | 0 | 0 | 0 | 109.3 | D69 | P67-D69 PolarHBondContact O-N 3.32Å; P67-D69 VanDerWaalsContact O-N 3.14Å | ||
| 68 | V | 56.6 | Low | 53.5 | Low | 133 Ų | 133 | 137.3 Ų | 137.3 | 81% | 0.806 | 75% | 0.75 | S | S | * | * | trans | -71.4 | 101 | -175.7 | -166.4 | 0 | 0 | 0 | 0 | 108.3 | S66 | S66-V68 PolarHBondContact O-N 2.81Š| ||
| 69 | D | 50.8 | Low | 53.2 | Low | 155 Ų | 155 | 135 Ų | 135 | 83% | 0.829 | 75% | 0.75 | S | S | * | * | trans | -124.7 | 106.4 | 165.5 | -84.9 | -56.5 | 0 | 0 | 0 | 111.7 | P67 K71 | P67-D69 PolarHBondContact O-N 3.32Å; P67-D69 VanDerWaalsContact O-N 3.14Å; D69-K71 PolarHBondContact O-N 3.14Å | ||
| 70 | V | 53.3 | Low | 53 | Low | 133 Ų | 133 | 132 Ų | 132 | 81% | 0.806 | 75% | 0.748 | S | S | * | * | trans | -52.4 | 115.3 | 172.1 | 173.2 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 71 | K | 45.8 | Very low | 53.5 | Low | 154 Ų | 154 | 132.9 Ų | 132.9 | 67% | 0.67 | 76% | 0.755 | S | S | * | * | trans | -153.3 | 102.9 | 145 | -151.7 | 173.8 | -172.2 | -170.1 | 0 | 112.2 | D69 Q73 | D69-K71 PolarHBondContact O-N 3.14Å; K71-Q73 VanDerWaalsContact C-N 3.3Å; K71-Q73 HydrophobicContact CG-CB 4.37Å; K71-Q73 PolarHBondContact O-N 2.91Å | ||
| 72 | T | 52.7 | Low | 53.9 | Low | 142 Ų | 142 | 132.2 Ų | 132.2 | 87% | 0.871 | 75% | 0.747 | S | S | * | * | trans | -53.2 | 98.2 | 150.8 | -53.2 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 73 | Q | 45.5 | Very low | 54.4 | Low | 124 Ų | 124 | 134.2 Ų | 134.2 | 58% | 0.579 | 76% | 0.762 | S | S | * | * | trans | -142.6 | 99.4 | 160.9 | -121.4 | 178.6 | -22.4 | 0 | 0 | 107.8 | K71 R75 | K71-Q73 VanDerWaalsContact C-N 3.3Å; K71-Q73 HydrophobicContact CG-CB 4.37Å; K71-Q73 PolarHBondContact O-N 2.91Å; Q73-R75 PolarHBondContact O-N 2.89Å | ||
| 74 | S | 53.8 | Low | 54.4 | Low | 115 Ų | 115 | 131.6 Ų | 131.6 | 80% | 0.804 | 76% | 0.756 | S | S | * | * | trans | -50.5 | 101.7 | 159.5 | 164.9 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 75 | R | 53.4 | Low | 54.7 | Low | 193 Ų | 193 | 131.6 Ų | 131.6 | 73% | 0.728 | 76% | 0.757 | S | S | * | * | trans | -136.7 | 95.2 | 172.6 | -156.4 | 171.2 | -149.4 | -90.3 | 1.3 | 109.6 | Q73 T77 | Q73-R75 PolarHBondContact O-N 2.89Å; R75-T77 PolarHBondContact O-N 2.95Å | ||
| 76 | L | 55 | Low | 54.7 | Low | 167 Ų | 167 | 130.8 Ų | 130.8 | 87% | 0.874 | 76% | 0.758 | S | S | * | * | trans | -70.6 | 37.5 | -178 | -75.6 | 169.5 | 0 | 0 | 0 | 114.8 | ||||
| 77 | T | 56.1 | Low | 55.1 | Low | 93 Ų | 93 | 132.9 Ų | 132.9 | 57% | 0.571 | 77% | 0.766 | S | S | * | * | trans | -154.8 | 124.7 | 170.4 | 43.9 | 0 | 0 | 0 | 0 | 112.3 | R75 | R75-T77 PolarHBondContact O-N 2.95Š| ||
| 78 | P | 58.9 | Low | 54.7 | Low | 124 Ų | 124 | 135.9 Ų | 135.9 | 81% | 0.805 | 77% | 0.77 | S | S | * | * | trans | -67.2 | 139.9 | 162.3 | -13.4 | 28 | 0 | 0 | 0 | 110.2 | ||||
| 79 | P | 55.2 | Low | 54 | Low | 120 Ų | 120 | 133.1 Ų | 133.1 | 78% | 0.779 | 77% | 0.769 | S | S | * | * | trans | -75.7 | 127.8 | 175.2 | 30.8 | -30.5 | 0 | 0 | 0 | 110.3 | ||||
| 80 | T | 57.2 | Low | 53.8 | Low | 136 Ų | 136 | 129.3 Ų | 129.3 | 83% | 0.834 | 76% | 0.759 | S | S | * | * | trans | 54.7 | 87.7 | 149.8 | -45.2 | 0 | 0 | 0 | 0 | 116.9 | ||||
| 81 | M | 60.5 | Low | 53.4 | Low | 168 Ų | 168 | 128.7 Ų | 128.7 | 83% | 0.828 | 76% | 0.758 | S | S | * | * | trans | -115.2 | 126.9 | 142.1 | -153.2 | 175 | 75 | 0 | 0 | 107.3 | ||||
| 82 | P | 62.9 | Low | 53.6 | Low | 100 Ų | 100 | 133 Ų | 133 | 65% | 0.649 | 77% | 0.77 | S | S | * | * | P | Polyproline II helix | trans | -61.7 | 141.1 | 175 | 25.5 | -31.2 | 0 | 0 | 0 | 109 | ||
| 83 | P | 61.1 | Low | 53.4 | Low | 114 Ų | 114 | 132 Ų | 132 | 74% | 0.74 | 76% | 0.764 | S | S | * | * | P | Polyproline II helix | trans | -61.4 | 143 | 177.8 | 25.7 | -32.7 | 0 | 0 | 0 | 109.8 | ||
| 84 | P | 56.8 | Low | 53.8 | Low | 103 Ų | 103 | 132 Ų | 132 | 67% | 0.669 | 78% | 0.778 | S | S | * | * | P | Polyproline II helix | trans | -58.9 | 145.9 | 172.1 | 25.9 | -32.9 | 0 | 0 | 0 | 109.5 | T86 | P84-T86 PolarHBondContact O-N 2.89Å; P84-T86 VanDerWaalsContact O-N 3.08Å |
| 85 | P | 55.4 | Low | 53.3 | Low | 120 Ų | 120 | 131.4 Ų | 131.4 | 78% | 0.779 | 77% | 0.773 | S | S | * | * | P | Polyproline II helix | trans | -59.2 | 119.5 | 177.9 | 23.7 | -31.5 | 0 | 0 | 0 | 109.2 | T87 | P85-T87 PolarHBondContact O-N 3.08Š|
| 86 | T | 54.1 | Low | 53.1 | Low | 144 Ų | 144 | 131.6 Ų | 131.6 | 88% | 0.883 | 78% | 0.779 | S | S | * | * | trans | -62.5 | 94.7 | 171.8 | 12 | 0 | 0 | 0 | 0 | 108.9 | P84 Q88 | P84-T86 PolarHBondContact O-N 2.89Å; P84-T86 VanDerWaalsContact O-N 3.08Å; T86-Q88 VanDerWaalsContact C-N 3.3Å; T86-Q88 PolarHBondContact O-N 3.05Å | ||
| 87 | T | 58 | Low | 53.3 | Low | 135 Ų | 135 | 129.4 Ų | 129.4 | 83% | 0.828 | 77% | 0.773 | S | S | * | * | trans | -66.9 | 99.4 | 160.2 | -56.8 | 0 | 0 | 0 | 0 | 106.7 | P85 G89 | P85-T87 PolarHBondContact O-N 3.08Å; T87-G89 PolarHBondContact O-N 2.8Å | ||
| 88 | Q | 45.6 | Very low | 52.8 | Low | 180 Ų | 180 | 130.3 Ų | 130.3 | 84% | 0.841 | 78% | 0.781 | S | S | * | * | trans | -43.6 | 113.1 | 170.7 | -160.5 | 172.1 | 15.7 | 0 | 0 | 108.4 | T86 A90 | T86-Q88 VanDerWaalsContact C-N 3.3Å; T86-Q88 PolarHBondContact O-N 3.05Å; Q88-A90 PolarHBondContact O-N 2.97Å | ||
| 89 | G | 42.5 | Very low | 52.2 | Low | 76 Ų | 76 | 130.8 Ų | 130.8 | 78% | 0.784 | 78% | 0.782 | S | S | * | * | trans | -62.4 | 90.1 | 172.3 | 0 | 0 | 0 | 0 | 0 | 109.1 | T87 | T87-G89 PolarHBondContact O-N 2.8Š| ||
| 90 | A | 46.2 | Very low | 52 | Low | 74 Ų | 74 | 134.9 Ų | 134.9 | 61% | 0.612 | 81% | 0.805 | S | S | * | * | trans | -58.9 | 141.2 | 155.3 | 0 | 0 | 0 | 0 | 0 | 107.6 | Q88 R92 | Q88-A90 PolarHBondContact O-N 2.97Å; A90-R92 PolarHBondContact O-N 3.04Å | ||
| 91 | P | 44.6 | Very low | 51.7 | Low | 120 Ų | 120 | 134.9 Ų | 134.9 | 78% | 0.779 | 80% | 0.803 | S | S | * | * | trans | -55.2 | 120 | -178.2 | 24.1 | -33.6 | 0 | 0 | 0 | 108.2 | T93 | P91-T93 PolarHBondContact O-N 3.26Š| ||
| 92 | R | 49.6 | Very low | 51.2 | Low | 245 Ų | 245 | 133.1 Ų | 133.1 | 93% | 0.925 | 80% | 0.802 | S | S | * | * | trans | -60.1 | 105 | -178.7 | -61 | -167.9 | 68.4 | -176.4 | -0.7 | 107.4 | A90 S94 | A90-R92 PolarHBondContact O-N 3.04Å; R92-S94 PolarHBondContact O-N 2.85Å | ||
| 93 | T | 48.5 | Very low | 50.6 | Low | 121 Ų | 121 | 134.9 Ų | 134.9 | 74% | 0.742 | 81% | 0.81 | S | S | * | * | trans | -60 | 126.1 | 168.8 | 75.5 | 0 | 0 | 0 | 0 | 106 | P91 S95 | P91-T93 PolarHBondContact O-N 3.26Å; T93-S95 PolarHBondContact O-N 3.04Å | ||
| 94 | S | 54.2 | Low | 50 | Low | 125 Ų | 125 | 136.2 Ų | 136.2 | 87% | 0.874 | 82% | 0.815 | S | S | * | * | trans | -68.8 | 98.8 | 175.9 | 51.2 | 0 | 0 | 0 | 0 | 108.4 | R92 | R92-S94 PolarHBondContact O-N 2.85Š| ||
| 95 | S | 44.4 | Very low | 49.6 | Very low | 101 Ų | 101 | 138.3 Ų | 138.3 | 71% | 0.706 | 82% | 0.824 | S | S | * | * | trans | -116.4 | 103.2 | 167.8 | 54.3 | 0 | 0 | 0 | 0 | 109.5 | T93 | T93-S95 PolarHBondContact O-N 3.04Š| ||
| 96 | F | 47.5 | Very low | 49.2 | Very low | 197 Ų | 197 | 139.5 Ų | 139.5 | 86% | 0.864 | 83% | 0.827 | S | S | * | * | trans | -84 | 121.6 | 166.2 | -140.3 | -89.4 | 0 | 0 | 0 | 106.7 | ||||
| 97 | T | 59.2 | Low | 48.8 | Very low | 121 Ų | 121 | 139.1 Ų | 139.1 | 74% | 0.742 | 82% | 0.823 | S | S | * | * | trans | -117 | 108.5 | 164.1 | 47.8 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 98 | P | 47 | Very low | 48.1 | Very low | 112 Ų | 112 | 139.5 Ų | 139.5 | 73% | 0.727 | 82% | 0.822 | S | S | * | * | trans | -76.3 | 133.3 | 167.7 | 30.9 | -29.3 | 0 | 0 | 0 | 108.9 | ||||
| 99 | T | 46 | Very low | 48.3 | Very low | 135 Ų | 135 | 136.1 Ų | 136.1 | 83% | 0.828 | 82% | 0.821 | S | S | * | * | trans | -101.6 | 131.5 | 168.8 | -57.1 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 100 | T | 49.9 | Very low | 48.8 | Very low | 206 Ų | 206 | 141.5 Ų | 141.5 | 100% | 1.264 | 82% | 0.824 | S | S | * | * | trans | -65.3 | 0 | 172.1 | -57.9 | 0 | 0 | 0 | 0 | 111.8 |
Retrieved 100 of 100 residues in 62.2 ms
(Link to these results)