| 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 | 56.7 | Low | 51.9 | Low | 236 Ų | 236 | 134.2 Ų | 134.2 | 100% | 1.163 | 71% | 0.708 | S | S | * | * | 0 | 55.5 | 0 | -114.2 | 73 | -176.9 | 0 | 0 | 110.2 | |||||
| 2 | T | 55.2 | Low | 52 | Low | 97 Ų | 97 | 132.6 Ų | 132.6 | 60% | 0.595 | 70% | 0.698 | S | S | * | * | trans | -142.1 | -16.7 | -179.2 | 44.6 | 0 | 0 | 0 | 0 | 112.9 | F4 W5 | T2-F4 VanDerWaalsContact C-N 3.31Å; T2-F4 PolarHBondContact O-N 3.26Å; T2-W5 PolarHBondContact O-N 2.77Å | ||
| 3 | E | 54 | Low | 52.4 | Low | 146 Ų | 146 | 127.8 Ų | 127.8 | 68% | 0.682 | 69% | 0.69 | S | S | * | * | H | α-helix | trans | -75.7 | -13.6 | -174.1 | -50.6 | -50.2 | 104 | 0 | 0 | 114.6 | W5 | E3-W5 VanDerWaalsContact C-N 3.34Å |
| 4 | F | 44.7 | Very low | 52.7 | Low | 174 Ų | 174 | 131.4 Ų | 131.4 | 76% | 0.763 | 70% | 0.7 | S | S | * | * | H | α-helix | trans | -77.9 | -20.8 | 179.7 | -160.7 | -97.5 | 0 | 0 | 0 | 112.9 | T2 | T2-F4 VanDerWaalsContact C-N 3.31Å; T2-F4 PolarHBondContact O-N 3.26Å |
| 5 | W | 52.5 | Low | 53.1 | Low | 204 Ų | 204 | 133.7 Ų | 133.7 | 77% | 0.773 | 70% | 0.704 | S | S | * | * | H | α-helix | trans | -94.2 | -15.1 | -176.4 | -74.5 | 70.2 | 0 | 0 | 0 | 113.6 | T2 E3 | T2-W5 PolarHBondContact O-N 2.77Å; E3-W5 VanDerWaalsContact C-N 3.34Å |
| 6 | V | 52.1 | Low | 53.6 | Low | 97 Ų | 97 | 131.9 Ų | 131.9 | 59% | 0.588 | 70% | 0.703 | S | S | * | * | H | α-helix | trans | -73.4 | -35.6 | 177.1 | 176.5 | 0 | 0 | 0 | 0 | 111.2 | ||
| 7 | C | 54.7 | Low | 54.4 | Low | 90 Ų | 90 | 134.3 Ų | 134.3 | 61% | 0.608 | 71% | 0.709 | S | S | * | * | H | α-helix | trans | -76.4 | -21.6 | 178.8 | -166 | 0 | 0 | 0 | 0 | 113.3 | ||
| 8 | F | 45.7 | Very low | 55.1 | Low | 137 Ų | 137 | 133.1 Ų | 133.1 | 60% | 0.601 | 71% | 0.71 | S | S | * | * | H | α-helix | trans | -75.6 | -28.8 | 179 | -140.6 | -103.5 | 0 | 0 | 0 | 112.6 | I12 | F8-I12 HydrophobicContact CD1-CD1 3.41Å; F8-I12 VanDerWaalsContact CD1-CD1 3.41Å; F8-I12 HydrophobicContact CD1-CG1 4.44Å; F8-I12 HydrophobicContact CE1-CD1 3.57Å; F8-I12 HydrophobicContact CG-CD1 4.45Å; F8-I12 WeakPolarHBondContact O-CD1 3.37Å; F8-I12 WeakPolarHBondContact O-CG1 3.39Å |
| 9 | S | 49.7 | Very low | 56 | Low | 94 Ų | 94 | 136.9 Ų | 136.9 | 66% | 0.657 | 72% | 0.72 | S | S | * | * | H | α-helix | trans | -77.8 | -23.5 | -179.7 | -61.4 | 0 | 0 | 0 | 0 | 113.4 | ||
| 10 | C | 52.7 | Low | 56.9 | Low | 96 Ų | 96 | 141.5 Ų | 141.5 | 65% | 0.649 | 73% | 0.727 | S | S | * | * | H | α-helix | trans | -82.4 | -22.4 | 177 | -68.3 | 0 | 0 | 0 | 0 | 113.5 | ||
| 11 | C | 52.8 | Low | 57.8 | Low | 105 Ų | 105 | 145.7 Ų | 145.7 | 71% | 0.709 | 73% | 0.734 | S | S | * | * | H | α-helix | trans | -95 | -12.1 | -178.2 | -65.7 | 0 | 0 | 0 | 0 | 113.8 | A13 | C11-A13 VanDerWaalsContact C-N 3.33Å |
| 12 | I | 53 | Low | 58.9 | Low | 115 Ų | 115 | 145.5 Ų | 145.5 | 59% | 0.59 | 72% | 0.72 | S | S | * | * | trans | -94.1 | 7.9 | 171.3 | -60 | 165.2 | 0 | 0 | 0 | 111 | F8 E14 | F8-I12 HydrophobicContact CD1-CD1 3.41Å; F8-I12 VanDerWaalsContact CD1-CD1 3.41Å; F8-I12 HydrophobicContact CD1-CG1 4.44Å; F8-I12 HydrophobicContact CE1-CD1 3.57Å; F8-I12 HydrophobicContact CG-CD1 4.45Å; F8-I12 WeakPolarHBondContact O-CD1 3.37Å; F8-I12 WeakPolarHBondContact O-CG1 3.39Å; I12-E14 PolarHBondContact O-N 3.11Å | ||
| 13 | A | 56.9 | Low | 60.3 | Low | 71 Ų | 71 | 151.7 Ų | 151.7 | 59% | 0.587 | 73% | 0.733 | S | S | * | * | S | Bend | trans | -65.7 | 89.2 | 163.2 | 0 | 0 | 0 | 0 | 0 | 107.6 | C11 Q15 | C11-A13 VanDerWaalsContact C-N 3.33Å; A13-Q15 PolarHBondContact O-N 2.68Å |
| 14 | E | 56.8 | Low | 61.8 | Low | 178 Ų | 178 | 150.3 Ų | 150.3 | 83% | 0.832 | 73% | 0.729 | S | S | * | * | trans | -1.9 | 89.5 | 160.8 | -160.4 | 170.1 | 125.3 | 0 | 0 | 111.1 | I12 P16 | I12-E14 PolarHBondContact O-N 3.11Å; E14-P16 WeakPolarHBondContact O-CD 3.31Å | ||
| 15 | Q | 59.1 | Low | 63.7 | Low | 165 Ų | 165 | 146.5 Ų | 146.5 | 77% | 0.771 | 72% | 0.716 | S | S | * | * | trans | -48.2 | 110.7 | 172.2 | -100.4 | -92.9 | 2.5 | 0 | 0 | 105.5 | A13 Q17 | A13-Q15 PolarHBondContact O-N 2.68Å; Q15-Q17 PolarHBondContact O-N 3.09Å | ||
| 16 | P | 60.9 | Low | 64.9 | Low | 106 Ų | 106 | 147 Ų | 147 | 69% | 0.688 | 72% | 0.718 | S | S | * | * | trans | -59.2 | 116.5 | -174.3 | 20.2 | -29.7 | 0 | 0 | 0 | 105.5 | E14 P18 | E14-P16 WeakPolarHBondContact O-CD 3.31Å; P16-P18 VanDerWaalsContact O-N 3.13Å | ||
| 17 | Q | 67.8 | Low | 66.3 | Low | 172 Ų | 172 | 147 Ų | 147 | 80% | 0.804 | 72% | 0.723 | S | S | * | * | trans | -43 | 126.9 | -171.4 | -75.4 | -132.9 | 20.5 | 0 | 0 | 108.9 | Q15 K19 | Q15-Q17 PolarHBondContact O-N 3.09Å; Q17-K19 PolarHBondContact O-N 2.95Å | ||
| 18 | P | 67.4 | Low | 67.7 | Low | 112 Ų | 112 | 148.5 Ų | 148.5 | 73% | 0.727 | 72% | 0.722 | S | S | * | * | trans | -53.2 | 109.9 | -172.6 | 16.9 | -28.8 | 0 | 0 | 0 | 107.6 | P16 R20 | P16-P18 VanDerWaalsContact O-N 3.13Å; P18-R20 PolarHBondContact O-N 2.91Å | ||
| 19 | K | 71.6 | Confident | 69.4 | Low | 207 Ų | 207 | 145.9 Ų | 145.9 | 90% | 0.9 | 71% | 0.713 | S | S | * | * | trans | -53 | 109.4 | -174.7 | -80.4 | 178.5 | 178.7 | 173.2 | 0 | 106.2 | Q17 R21 | Q17-K19 PolarHBondContact O-N 2.95Å; K19-R21 PolarHBondContact O-N 2.91Å | ||
| 20 | R | 73.5 | Confident | 71 | Confident | 227 Ų | 227 | 144.2 Ų | 144.2 | 86% | 0.857 | 71% | 0.711 | S | S | * | * | P | Polyproline II helix | trans | -51.7 | 118.1 | -179.3 | -75 | -176.1 | 82.3 | -175.8 | 8.7 | 106.7 | P18 R22 | P18-R20 PolarHBondContact O-N 2.91Å; R20-R22 PolarHBondContact O-N 3.32Å |
| 21 | R | 75.3 | Confident | 72.3 | Confident | 231 Ų | 231 | 146.4 Ų | 146.4 | 87% | 0.872 | 71% | 0.712 | S | S | * | * | P | Polyproline II helix | trans | -54 | 121.1 | -178.9 | -157.1 | 175.2 | -171.3 | -127.1 | 3.1 | 106.8 | K19 R23 | K19-R21 PolarHBondContact O-N 2.91Å; R21-R23 PolarHBondContact O-N 2.9Å |
| 22 | R | 80.3 | Confident | 73.6 | Confident | 232 Ų | 232 | 143 Ų | 143 | 88% | 0.875 | 69% | 0.688 | S | S | * | * | P | Polyproline II helix | trans | -57 | 136.1 | -178.1 | -69 | -175.6 | 177.7 | -174.8 | -0.8 | 108.1 | R20 | R20-R22 PolarHBondContact O-N 3.32Š|
| 23 | R | 84.6 | Confident | 74.7 | Confident | 227 Ų | 227 | 141.8 Ų | 141.8 | 86% | 0.857 | 69% | 0.686 | S | S | * | * | P | Polyproline II helix | trans | -59.9 | 141.1 | 174.3 | -77.6 | -178.2 | 165.8 | 135.2 | -5.3 | 108.4 | R21 D25 | R21-R23 PolarHBondContact O-N 2.9Å; R23-D25 PolarHBondContact O-N 2.68Å |
| 24 | I | 85.1 | Confident | 75.6 | Confident | 117 Ų | 117 | 144.4 Ų | 144.4 | 60% | 0.6 | 69% | 0.69 | S | S | * | * | P | Polyproline II helix | trans | -72.7 | 117.8 | 176.4 | -59.1 | 173.6 | 0 | 0 | 0 | 107.1 | M28 I29 | I24-M28 VanDerWaalsContact CA-CE 3.48Å; I24-M28 HydrophobicContact CB-CE 4.29Å; I24-M28 HydrophobicContact CG2-CB 4.01Å; I24-M28 HydrophobicContact CG2-CE 4.12Å; I24-I29 HydrophobicContact CG2-CG1 4.1Å |
| 25 | D | 85.3 | Confident | 76.8 | Confident | 93 Ų | 93 | 143.5 Ų | 143.5 | 50% | 0.497 | 68% | 0.684 | S | S | . | * | P | Polyproline II helix | trans | -78.3 | 151.1 | 169.2 | -177.7 | 29.5 | 0 | 0 | 0 | 110.1 | R23 S27 M28 | R23-D25 PolarHBondContact O-N 2.68Å; D25-S27 PolarHBondContact O-N 3.12Å; D25-S27 PolarHBondContact OD2-OG 3.29Å; D25-M28 HydrophobicContact CB-CE 4.12Å; D25-M28 WeakPolarHBondContact O-CB 3.31Å; D25-M28 PolarHBondContact O-N 3.2Å |
| 26 | R | 78.9 | Confident | 77.9 | Confident | 216 Ų | 216 | 140.7 Ų | 140.7 | 82% | 0.815 | 68% | 0.678 | S | S | * | * | G | 310 helix | trans | -59.4 | -29 | -176.7 | -65.1 | 176.4 | 177.8 | -163.8 | -2 | 112.4 | M28 I29 | R26-M28 PolarHBondContact O-N 3.36Å; R26-I29 PolarHBondContact O-N 3.18Å; R26-I29 VanDerWaalsContact O-N 3.12Å |
| 27 | S | 81 | Confident | 79.1 | Confident | 97 Ų | 97 | 142.9 Ų | 142.9 | 68% | 0.678 | 68% | 0.679 | S | S | * | * | G | 310 helix | trans | -63 | -22.9 | 173.2 | 60.1 | 0 | 0 | 0 | 0 | 113.9 | D25 I29 | D25-S27 PolarHBondContact O-N 3.12Å; D25-S27 PolarHBondContact OD2-OG 3.29Å; S27-I29 VanDerWaalsContact C-N 3.33Å |
| 28 | M | 82.8 | Confident | 79.9 | Confident | 121 Ų | 121 | 138.6 Ų | 138.6 | 60% | 0.596 | 66% | 0.664 | S | S | * | * | G | 310 helix | trans | -88.1 | -1.4 | 176.7 | -62.4 | -167.9 | -75.4 | 0 | 0 | 112.9 | I24 D25 R26 | I24-M28 VanDerWaalsContact CA-CE 3.48Å; I24-M28 HydrophobicContact CB-CE 4.29Å; I24-M28 HydrophobicContact CG2-CB 4.01Å; I24-M28 HydrophobicContact CG2-CE 4.12Å; D25-M28 HydrophobicContact CB-CE 4.12Å; D25-M28 WeakPolarHBondContact O-CB 3.31Å; D25-M28 PolarHBondContact O-N 3.2Å; R26-M28 PolarHBondContact O-N 3.36Å |
| 29 | I | 82.7 | Confident | 80.5 | Confident | 82 Ų | 82 | 136 Ų | 136 | 42% | 0.421 | 65% | 0.646 | S | S | . | * | S | Bend | trans | -97.1 | 105.6 | 177.1 | -50.8 | 178.5 | 0 | 0 | 0 | 107.5 | I24 R26 S27 T33 | I24-I29 HydrophobicContact CG2-CG1 4.1Å; R26-I29 PolarHBondContact O-N 3.18Å; R26-I29 VanDerWaalsContact O-N 3.12Å; S27-I29 VanDerWaalsContact C-N 3.33Å; I29-T33 HydrophobicContact CB-CG2 4.33Å; I29-T33 HydrophobicContact CG2-CG2 3.93Å |
| 30 | G | 82.4 | Confident | 81.2 | Confident | 59 Ų | 59 | 133.4 Ų | 133.4 | 61% | 0.608 | 64% | 0.637 | S | S | * | * | P | Polyproline II helix | trans | -61 | 156.2 | 172.9 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||
| 31 | E | 79.5 | Confident | 81.5 | Confident | 141 Ų | 141 | 126.2 Ų | 126.2 | 66% | 0.659 | 62% | 0.618 | S | S | * | * | S | Bend | trans | -65 | 151.7 | 172.9 | -69.7 | -163.5 | 156.6 | 0 | 0 | 111.9 | Y66 | E31-Y66 HydrophobicContact CB-CD1 3.63Å; E31-Y66 HydrophobicContact CB-CE1 3.44Å; E31-Y66 VanDerWaalsContact CB-CE1 3.44Å; E31-Y66 HydrophobicContact CB-CG 4.44Å; E31-Y66 WeakPolarHBondContact OE2-CD1 3.24Å; E31-Y66 WeakPolarHBondContact OE2-CE1 3.38Å |
| 32 | P | 80.1 | Confident | 81.9 | Confident | 33 Ų | 33 | 116.5 Ų | 116.5 | 21% | 0.214 | 59% | 0.59 | C | S | . | * | P | Polyproline II helix | cis | -83.7 | 137.3 | -4.2 | 32.5 | -28.3 | 0 | 0 | 0 | 110.1 | F35 K63 Y66 | P32-F35 WeakPolarHBondContact O-CE2 3.18Å; P32-F35 VanDerWaalsContact O-CZ 3.22Å; P32-F35 WeakPolarHBondContact O-CZ 3.22Å; P32-K63 HydrophobicContact CG-CD 4.35Å; P32-Y66 VanDerWaalsContact CD-OH 3.31Å; P32-Y66 WeakPolarHBondContact CD-OH 3.5Å |
| 33 | T | 76.9 | Confident | 81.8 | Confident | 91 Ų | 91 | 111.7 Ų | 111.7 | 56% | 0.558 | 59% | 0.592 | S | S | * | * | trans | -90.5 | -8.1 | 178.6 | 55.8 | 0 | 0 | 0 | 0 | 112.4 | I29 | I29-T33 HydrophobicContact CB-CG2 4.33Å; I29-T33 HydrophobicContact CG2-CG2 3.93Å | ||
| 34 | N | 76.4 | Confident | 81.6 | Confident | 125 Ų | 125 | 103.4 Ų | 103.4 | 67% | 0.668 | 58% | 0.577 | S | S | * | * | trans | -102.7 | 99.8 | 176.8 | -171.1 | -5.7 | 0 | 0 | 0 | 110.4 | V36 | N34-V36 WeakPolarHBondContact OD1-CG2 3.41Š| ||
| 35 | F | 80.6 | Confident | 81 | Confident | 160 Ų | 160 | 99.4 Ų | 99.4 | 70% | 0.702 | 56% | 0.557 | S | S | * | * | trans | -94.5 | 113.8 | 175.2 | -62.3 | -82.2 | 0 | 0 | 0 | 109.3 | P32 | P32-F35 WeakPolarHBondContact O-CE2 3.18Å; P32-F35 VanDerWaalsContact O-CZ 3.22Å; P32-F35 WeakPolarHBondContact O-CZ 3.22Å | ||
| 36 | V | 83.2 | Confident | 80.2 | Confident | 106 Ų | 106 | 101.4 Ų | 101.4 | 64% | 0.642 | 57% | 0.565 | S | S | * | * | trans | -105.3 | 127.7 | 178 | -176.5 | 0 | 0 | 0 | 0 | 109.1 | N34 T38 | N34-V36 WeakPolarHBondContact OD1-CG2 3.41Å; V36-T38 PolarHBondContact O-N 3.06Å; V36-T38 PolarHBondContact O-OG1 3.48Å | ||
| 37 | H | 86.9 | Confident | 79.5 | Confident | 152 Ų | 152 | 94.5 Ų | 94.5 | 70% | 0.704 | 56% | 0.561 | S | S | * | * | trans | -66.6 | 119.4 | 170.4 | 179.5 | 73.4 | 0 | 0 | 0 | 109.1 | T39 | H37-T39 PolarHBondContact CE1-O 3.43Š| ||
| 38 | T | 82.8 | Confident | 78.7 | Confident | 81 Ų | 81 | 96 Ų | 96 | 50% | 0.497 | 56% | 0.561 | S | S | . | * | trans | -92.2 | -51.7 | -174.2 | -54.6 | 0 | 0 | 0 | 0 | 111.8 | V36 | V36-T38 PolarHBondContact O-N 3.06Å; V36-T38 PolarHBondContact O-OG1 3.48Å | ||
| 39 | T | 80.6 | Confident | 77.7 | Confident | 58 Ų | 58 | 93.5 Ų | 93.5 | 36% | 0.356 | 57% | 0.566 | S | S | . | * | trans | -165.6 | 165.7 | 179.9 | -168.5 | 0 | 0 | 0 | 0 | 111.4 | H37 V41 V56 | H37-T39 PolarHBondContact CE1-O 3.43Å; T39-V41 HydrophobicContact CG2-CG2 3.94Å; T39-V56 HydrophobicContact CG2-CG1 4.48Å; T39-V56 HydrophobicContact CG2-CG2 3.55Å | ||
| 40 | H | 85.5 | Confident | 76.8 | Confident | 153 Ų | 153 | 93 Ų | 93 | 71% | 0.708 | 56% | 0.563 | S | S | * | * | trans | -106.7 | 130.8 | 170.4 | 172.5 | -86.2 | 0 | 0 | 0 | 109.8 | ||||
| 41 | V | 81.6 | Confident | 76.1 | Confident | 75 Ų | 75 | 94.5 Ų | 94.5 | 46% | 0.455 | 56% | 0.562 | S | S | . | * | trans | -120.6 | 106.6 | -176.6 | -179.4 | 0 | 0 | 0 | 0 | 107.4 | T39 D45 M46 | T39-V41 HydrophobicContact CG2-CG2 3.94Å; V41-D45 VanDerWaalsContact C-OD1 3.25Å; V41-D45 VanDerWaalsContact CA-OD1 3.24Å; V41-D45 WeakPolarHBondContact CA-OD1 3.24Å; V41-D45 WeakPolarHBondContact CG1-OD2 3.44Å; V41-M46 HydrophobicContact CG1-CG 4.08Å; V41-M46 HydrophobicContact CG1-SD 3.84Å | ||
| 42 | G | 83.4 | Confident | 75.6 | Confident | 27 Ų | 27 | 90.8 Ų | 90.8 | 28% | 0.278 | 55% | 0.552 | S | S | . | * | trans | -92.2 | 171.1 | 173.7 | 0 | 0 | 0 | 0 | 0 | 113.8 | G44 D45 | G42-G44 PolarHBondContact O-N 3.45Å; G42-D45 WeakPolarHBondContact CA-OD1 3.43Å; G42-D45 PolarHBondContact N-OD1 2.83Å; G42-D45 PolarHBondContact O-N 3.31Å | ||
| 43 | S | 78.1 | Confident | 75.3 | Confident | 131 Ų | 131 | 91.2 Ų | 91.2 | 92% | 0.916 | 55% | 0.554 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62.1 | -12.2 | -170.3 | -162.8 | 0 | 0 | 0 | 0 | 116 | ||
| 44 | G | 80.4 | Confident | 75.4 | Confident | 53 Ų | 53 | 91.8 Ų | 91.8 | 55% | 0.546 | 55% | 0.554 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -101.1 | -14.1 | -177.3 | 0 | 0 | 0 | 0 | 0 | 115.5 | G42 L48 | G42-G44 PolarHBondContact O-N 3.45Å; G44-L48 WeakPolarHBondContact O-CG 3.42Å |
| 45 | D | 71.8 | Confident | 75.4 | Confident | 34 Ų | 34 | 91.5 Ų | 91.5 | 18% | 0.182 | 55% | 0.552 | C | S | . | * | T | Hydrogen-bonded Turn | trans | -83 | -29.2 | -176.1 | 49.7 | -123.1 | 0 | 0 | 0 | 113.5 | V41 G42 G47 L48 L50 | V41-D45 VanDerWaalsContact C-OD1 3.25Å; V41-D45 VanDerWaalsContact CA-OD1 3.24Å; V41-D45 WeakPolarHBondContact CA-OD1 3.24Å; V41-D45 WeakPolarHBondContact CG1-OD2 3.44Å; G42-D45 WeakPolarHBondContact CA-OD1 3.43Å; G42-D45 PolarHBondContact N-OD1 2.83Å; G42-D45 PolarHBondContact O-N 3.31Å; D45-G47 PolarHBondContact O-N 3.14Å; D45-L48 PolarHBondContact O-N 2.96Å; D45-L50 HydrophobicContact CB-CD1 4.31Å |
| 46 | M | 67.6 | Low | 75.4 | Confident | 135 Ų | 135 | 85.2 Ų | 85.2 | 67% | 0.665 | 53% | 0.526 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -65.5 | -24.7 | 177 | -63.1 | -65.5 | -78.9 | 0 | 0 | 112.7 | V41 V53 | V41-M46 HydrophobicContact CG1-CG 4.08Å; V41-M46 HydrophobicContact CG1-SD 3.84Å; M46-V53 HydrophobicContact SD-CG1 4.17Å; M46-V53 HydrophobicContact SD-CG2 4.38Å |
| 47 | G | 65.6 | Low | 75.3 | Confident | 70 Ų | 70 | 85 Ų | 85 | 72% | 0.722 | 52% | 0.518 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -87.7 | -13.4 | -178.8 | 0 | 0 | 0 | 0 | 0 | 114.7 | D45 | D45-G47 PolarHBondContact O-N 3.14Š|
| 48 | L | 64.2 | Low | 74.9 | Confident | 129 Ų | 129 | 80.6 Ų | 80.6 | 68% | 0.675 | 51% | 0.508 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -98.3 | 3.9 | -172.1 | -67.8 | 176.6 | 0 | 0 | 0 | 113.9 | G44 D45 L50 | G44-L48 WeakPolarHBondContact O-CG 3.42Å; D45-L48 PolarHBondContact O-N 2.96Å; L48-L50 HydrophobicContact CB-CD1 3.99Å; L48-L50 HydrophobicContact CB-CG 3.84Å; L48-L50 HydrophobicContact CD1-CD1 4.31Å; L48-L50 PolarHBondContact O-N 2.79Å; L48-L50 VanDerWaalsContact O-N 3.12Å |
| 49 | G | 62.3 | Low | 74.6 | Confident | 68 Ų | 68 | 82.9 Ų | 82.9 | 70% | 0.701 | 51% | 0.513 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 54.1 | 35 | 179.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||
| 50 | L | 63.5 | Low | 74.4 | Confident | 71 Ų | 71 | 86.9 Ų | 86.9 | 37% | 0.372 | 53% | 0.529 | S | S | . | . | trans | -71 | 137.8 | -173.1 | -76.4 | 164.2 | 0 | 0 | 0 | 110 | D45 L48 S52 V53 | D45-L50 HydrophobicContact CB-CD1 4.31Å; L48-L50 HydrophobicContact CB-CD1 3.99Å; L48-L50 HydrophobicContact CB-CG 3.84Å; L48-L50 HydrophobicContact CD1-CD1 4.31Å; L48-L50 PolarHBondContact O-N 2.79Å; L48-L50 VanDerWaalsContact O-N 3.12Å; L50-S52 PolarHBondContact O-N 2.89Å; L50-V53 PolarHBondContact O-N 2.89Å | ||
| 51 | P | 66.2 | Low | 73.7 | Confident | 91 Ų | 91 | 86.6 Ų | 86.6 | 59% | 0.591 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -59.3 | -16.2 | 179 | 25.3 | -35.2 | 0 | 0 | 0 | 113.3 | L55 | P51-L55 WeakPolarHBondContact O-CB 3.26Å; P51-L55 PolarHBondContact O-N 3.31Å; P51-L55 VanDerWaalsContact O-N 3.13Å |
| 52 | S | 69.2 | Low | 72.9 | Confident | 63 Ų | 63 | 88.1 Ų | 88.1 | 44% | 0.441 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -60.6 | -41.3 | 173.2 | -173.7 | 0 | 0 | 0 | 0 | 112.5 | L50 L55 V56 | L50-S52 PolarHBondContact O-N 2.89Å; S52-L55 PolarHBondContact O-N 3.39Å; S52-V56 WeakPolarHBondContact O-CG2 3.45Å; S52-V56 PolarHBondContact O-N 3.25Å; S52-V56 VanDerWaalsContact O-N 3.07Å |
| 53 | V | 75.3 | Confident | 72 | Confident | 43 Ų | 43 | 92.7 Ų | 92.7 | 26% | 0.261 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -71 | -41.1 | -177.7 | -178.6 | 0 | 0 | 0 | 0 | 110.7 | M46 L50 L55 V56 Q57 | M46-V53 HydrophobicContact SD-CG1 4.17Å; M46-V53 HydrophobicContact SD-CG2 4.38Å; L50-V53 PolarHBondContact O-N 2.89Å; V53-L55 PolarHBondContact O-N 2.93Å; V53-V56 PolarHBondContact O-N 3.29Å; V53-Q57 WeakPolarHBondContact O-CB 3.46Å; V53-Q57 PolarHBondContact O-N 3.49Å |
| 54 | D | 78.6 | Confident | 71.4 | Confident | 102 Ų | 102 | 90.1 Ų | 90.1 | 55% | 0.545 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -64.6 | -39.4 | 177.3 | -69.2 | -25.9 | 0 | 0 | 0 | 112.2 | Q57 A58 | D54-Q57 PolarHBondContact O-N 2.75Å; D54-A58 WeakPolarHBondContact O-CB 3.2Å; D54-A58 PolarHBondContact O-N 3.5Å |
| 55 | L | 77 | Confident | 70.5 | Confident | 120 Ų | 120 | 90.9 Ų | 90.9 | 63% | 0.628 | 55% | 0.554 | S | S | * | * | H | α-helix | trans | -63.8 | -44.1 | 174.7 | -92.9 | 161 | 0 | 0 | 0 | 112.3 | P51 S52 V53 Q57 A58 Q59 | P51-L55 WeakPolarHBondContact O-CB 3.26Å; P51-L55 PolarHBondContact O-N 3.31Å; P51-L55 VanDerWaalsContact O-N 3.13Å; S52-L55 PolarHBondContact O-N 3.39Å; V53-L55 PolarHBondContact O-N 2.93Å; L55-Q57 VanDerWaalsContact C-N 3.33Å; L55-A58 PolarHBondContact O-N 2.94Å; L55-Q59 PolarHBondContact O-N 3.41Å |
| 56 | V | 79.4 | Confident | 70.1 | Confident | 27 Ų | 27 | 94.8 Ų | 94.8 | 16% | 0.164 | 57% | 0.567 | C | S | . | * | H | α-helix | trans | -62.9 | -44 | 175.7 | 172 | 0 | 0 | 0 | 0 | 110.1 | T39 S52 V53 A58 Q59 M60 | T39-V56 HydrophobicContact CG2-CG1 4.48Å; T39-V56 HydrophobicContact CG2-CG2 3.55Å; S52-V56 WeakPolarHBondContact O-CG2 3.45Å; S52-V56 PolarHBondContact O-N 3.25Å; S52-V56 VanDerWaalsContact O-N 3.07Å; V53-V56 PolarHBondContact O-N 3.29Å; V56-A58 VanDerWaalsContact C-N 3.32Å; V56-A58 PolarHBondContact O-N 3.26Å; V56-Q59 PolarHBondContact O-N 3.13Å; V56-M60 HydrophobicContact CG1-CG 4.33Å; V56-M60 HydrophobicContact CG1-SD 3.69Å; V56-M60 WeakPolarHBondContact O-CB 3.47Å; V56-M60 VanDerWaalsContact O-CG 3.26Å; V56-M60 WeakPolarHBondContact O-CG 3.46Å; V56-M60 PolarHBondContact O-N 3.5Å |
| 57 | Q | 80.4 | Confident | 69.8 | Low | 102 Ų | 102 | 94.7 Ų | 94.7 | 48% | 0.477 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -60.7 | -42 | 176.7 | -164.7 | -168.6 | 11.7 | 0 | 0 | 111.5 | V53 D54 L55 M60 K61 | V53-Q57 WeakPolarHBondContact O-CB 3.46Å; V53-Q57 PolarHBondContact O-N 3.49Å; D54-Q57 PolarHBondContact O-N 2.75Å; L55-Q57 VanDerWaalsContact C-N 3.33Å; Q57-M60 PolarHBondContact O-N 3.07Å; Q57-K61 VanDerWaalsContact O-CG 3.24Å; Q57-K61 WeakPolarHBondContact O-CG 2.89Å; Q57-K61 PolarHBondContact O-N 3.33Å; Q57-K61 VanDerWaalsContact O-N 3.14Å |
| 58 | A | 79.4 | Confident | 69.2 | Low | 59 Ų | 59 | 99.4 Ų | 99.4 | 49% | 0.488 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -63.7 | -43.1 | 176 | 0 | 0 | 0 | 0 | 0 | 112.3 | D54 L55 V56 M60 K61 | D54-A58 WeakPolarHBondContact O-CB 3.2Å; D54-A58 PolarHBondContact O-N 3.5Å; L55-A58 PolarHBondContact O-N 2.94Å; V56-A58 VanDerWaalsContact C-N 3.32Å; V56-A58 PolarHBondContact O-N 3.26Å; A58-M60 VanDerWaalsContact C-N 3.35Å; A58-M60 PolarHBondContact O-N 3.39Å; A58-K61 PolarHBondContact O-N 2.9Å |
| 59 | Q | 77.4 | Confident | 68.7 | Low | 129 Ų | 129 | 96.6 Ų | 96.6 | 60% | 0.603 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -61.9 | -41.1 | 174.7 | -80.6 | -166.4 | -30.1 | 0 | 0 | 112.5 | L55 V56 K61 | L55-Q59 PolarHBondContact O-N 3.41Å; V56-Q59 PolarHBondContact O-N 3.13Å; Q59-K61 VanDerWaalsContact C-N 3.33Å; Q59-K61 PolarHBondContact O-N 3.49Å |
| 60 | M | 74.8 | Confident | 67.8 | Low | 142 Ų | 142 | 95.5 Ų | 95.5 | 70% | 0.7 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -76 | -18 | -176.7 | -67.5 | 179.1 | 74.4 | 0 | 0 | 113.8 | V56 Q57 A58 S62 | V56-M60 HydrophobicContact CG1-CG 4.33Å; V56-M60 HydrophobicContact CG1-SD 3.69Å; V56-M60 WeakPolarHBondContact O-CB 3.47Å; V56-M60 VanDerWaalsContact O-CG 3.26Å; V56-M60 WeakPolarHBondContact O-CG 3.46Å; V56-M60 PolarHBondContact O-N 3.5Å; Q57-M60 PolarHBondContact O-N 3.07Å; A58-M60 VanDerWaalsContact C-N 3.35Å; A58-M60 PolarHBondContact O-N 3.39Å; M60-S62 PolarHBondContact O-N 2.9Å |
| 61 | K | 72.2 | Confident | 67.2 | Low | 147 Ų | 147 | 97.5 Ų | 97.5 | 64% | 0.639 | 59% | 0.588 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -68.4 | -16.8 | 177 | -81 | 166.2 | 174.9 | 170.8 | 0 | 113.8 | Q57 A58 Q59 K63 | Q57-K61 VanDerWaalsContact O-CG 3.24Å; Q57-K61 WeakPolarHBondContact O-CG 2.89Å; Q57-K61 PolarHBondContact O-N 3.33Å; Q57-K61 VanDerWaalsContact O-N 3.14Å; A58-K61 PolarHBondContact O-N 2.9Å; Q59-K61 VanDerWaalsContact C-N 3.33Å; Q59-K61 PolarHBondContact O-N 3.49Å; K61-K63 VanDerWaalsContact C-N 3.32Å; K61-K63 PolarHBondContact O-N 2.92Å |
| 62 | S | 64.3 | Low | 66.1 | Low | 107 Ų | 107 | 102.4 Ų | 102.4 | 75% | 0.748 | 60% | 0.603 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79.9 | 8.4 | -166.6 | -176.1 | 0 | 0 | 0 | 0 | 116.3 | M60 | M60-S62 PolarHBondContact O-N 2.9Š|
| 63 | K | 64.8 | Low | 64.8 | Low | 123 Ų | 123 | 102.5 Ų | 102.5 | 54% | 0.535 | 62% | 0.615 | S | S | . | * | trans | -114.1 | 80.7 | -163.9 | -160.7 | -179.8 | 167.4 | -170.1 | 0 | 113.8 | P32 K61 Y66 | P32-K63 HydrophobicContact CG-CD 4.35Å; K61-K63 VanDerWaalsContact C-N 3.32Å; K61-K63 PolarHBondContact O-N 2.92Å; K63-Y66 VanDerWaalsContact CE-OH 3.31Å; K63-Y66 WeakPolarHBondContact CE-OH 3.43Å; K63-Y66 HydrophobicContact CG-CE2 3.98Å | ||
| 64 | G | 65.2 | Low | 63.5 | Low | 78 Ų | 78 | 105.9 Ų | 105.9 | 80% | 0.804 | 64% | 0.64 | S | S | * | * | trans | -160.5 | 97.7 | 171.8 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 65 | G | 61 | Low | 61.7 | Low | 68 Ų | 68 | 109.4 Ų | 109.4 | 70% | 0.701 | 65% | 0.653 | S | S | * | * | trans | 174.8 | 12.8 | -179.4 | 0 | 0 | 0 | 0 | 0 | 115.7 | T67 | G65-T67 VanDerWaalsContact C-N 3.35Å; G65-T67 PolarHBondContact O-N 3.33Å | ||
| 66 | Y | 64.8 | Low | 59.9 | Low | 116 Ų | 116 | 115.4 Ų | 115.4 | 46% | 0.455 | 69% | 0.685 | S | S | . | * | trans | -69.5 | 99.9 | 171.6 | -53.4 | -67.7 | 0 | 0 | 0 | 106.9 | E31 P32 K63 H68 | E31-Y66 HydrophobicContact CB-CD1 3.63Å; E31-Y66 HydrophobicContact CB-CE1 3.44Å; E31-Y66 VanDerWaalsContact CB-CE1 3.44Å; E31-Y66 HydrophobicContact CB-CG 4.44Å; E31-Y66 WeakPolarHBondContact OE2-CD1 3.24Å; E31-Y66 WeakPolarHBondContact OE2-CE1 3.38Å; P32-Y66 VanDerWaalsContact CD-OH 3.31Å; P32-Y66 WeakPolarHBondContact CD-OH 3.5Å; K63-Y66 VanDerWaalsContact CE-OH 3.31Å; K63-Y66 WeakPolarHBondContact CE-OH 3.43Å; K63-Y66 HydrophobicContact CG-CE2 3.98Å; Y66-H68 PolarHBondContact O-N 3.12Å | ||
| 67 | T | 60.2 | Low | 58.9 | Low | 133 Ų | 133 | 119.9 Ų | 119.9 | 82% | 0.816 | 71% | 0.711 | S | S | * | * | trans | -50.6 | 112.7 | 172.5 | 51.3 | 0 | 0 | 0 | 0 | 107 | G65 G69 | G65-T67 VanDerWaalsContact C-N 3.35Å; G65-T67 PolarHBondContact O-N 3.33Å; T67-G69 VanDerWaalsContact C-N 3.29Å; T67-G69 PolarHBondContact O-N 2.99Å | ||
| 68 | H | 52.4 | Low | 57.8 | Low | 170 Ų | 170 | 120.8 Ų | 120.8 | 79% | 0.787 | 72% | 0.723 | S | S | * | * | trans | -56.8 | 107.8 | 159.2 | -169.6 | 91.8 | 0 | 0 | 0 | 103.7 | Y66 G70 | Y66-H68 PolarHBondContact O-N 3.12Å; H68-G70 PolarHBondContact O-N 3.34Å | ||
| 69 | G | 53.9 | Low | 56.6 | Low | 70 Ų | 70 | 124.2 Ų | 124.2 | 72% | 0.722 | 74% | 0.736 | S | S | * | * | trans | -58.3 | 89.2 | 164.8 | 0 | 0 | 0 | 0 | 0 | 105.2 | T67 S71 | T67-G69 VanDerWaalsContact C-N 3.29Å; T67-G69 PolarHBondContact O-N 2.99Å; G69-S71 PolarHBondContact O-N 3.29Å; G69-S71 VanDerWaalsContact O-N 3.09Å | ||
| 70 | G | 44 | Very low | 55.3 | Low | 45 Ų | 45 | 123.9 Ų | 123.9 | 46% | 0.464 | 74% | 0.744 | S | S | . | * | trans | -50.3 | 120.8 | 171.7 | 0 | 0 | 0 | 0 | 0 | 105 | H68 E72 | H68-G70 PolarHBondContact O-N 3.34Å; G70-E72 VanDerWaalsContact C-N 3.25Å; G70-E72 PolarHBondContact O-N 2.6Å | ||
| 71 | S | 51.1 | Low | 54.1 | Low | 113 Ų | 113 | 122.8 Ų | 122.8 | 79% | 0.79 | 75% | 0.747 | S | S | * | * | trans | -37.7 | 95.3 | 158 | 44 | 0 | 0 | 0 | 0 | 109.4 | G69 G73 | G69-S71 PolarHBondContact O-N 3.29Å; G69-S71 VanDerWaalsContact O-N 3.09Å; S71-G73 PolarHBondContact O-N 3.27Å; S71-G73 VanDerWaalsContact O-N 3.11Å | ||
| 72 | E | 43.8 | Very low | 52.9 | Low | 193 Ų | 193 | 121.2 Ų | 121.2 | 90% | 0.902 | 75% | 0.754 | S | S | * | * | trans | -70.9 | 106 | 161.6 | -61.8 | -155.3 | 138.5 | 0 | 0 | 104.7 | G70 | G70-E72 VanDerWaalsContact C-N 3.25Å; G70-E72 PolarHBondContact O-N 2.6Å | ||
| 73 | G | 41.8 | Very low | 52.1 | Low | 66 Ų | 66 | 122.2 Ų | 122.2 | 68% | 0.68 | 75% | 0.754 | S | S | * | * | trans | -56 | 148.8 | -179.9 | 0 | 0 | 0 | 0 | 0 | 110.8 | S71 Q75 | S71-G73 PolarHBondContact O-N 3.27Å; S71-G73 VanDerWaalsContact O-N 3.11Å; G73-Q75 PolarHBondContact O-N 2.9Å | ||
| 74 | S | 46.8 | Very low | 51.1 | Low | 113 Ų | 113 | 122.2 Ų | 122.2 | 79% | 0.79 | 77% | 0.771 | S | S | * | * | trans | -24.2 | 120.4 | 146.2 | -173.1 | 0 | 0 | 0 | 0 | 112 | ||||
| 75 | Q | 40.8 | Very low | 50 | Low | 177 Ų | 177 | 125.8 Ų | 125.8 | 83% | 0.827 | 77% | 0.769 | S | S | * | * | 178.8 | 129.7 | 129 | -94.5 | 161.8 | 43.5 | 0 | 0 | 111.9 | G73 | G73-Q75 PolarHBondContact O-N 2.9Š| |||
| 76 | L | 39.1 | Very low | 49 | Very low | 246 Ų | 246 | 131.1 Ų | 131.1 | 100% | 1.288 | 78% | 0.775 | S | S | * | * | trans | 85.6 | 0 | 169.4 | -47.5 | -176.5 | 0 | 0 | 0 | 117.2 |
Retrieved 76 of 76 residues in 13.9 ms
(Link to these results)