| 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 | 54.6 | Low | 53.7 | Low | 240 Ų | 240 | 138.7 Ų | 138.7 | 100% | 1.182 | 72% | 0.721 | S | S | * | * | 0 | 52.2 | 0 | -78.5 | 165.6 | 159.4 | 0 | 0 | 111.3 | |||||
| 2 | S | 58.3 | Low | 53.3 | Low | 75 Ų | 75 | 137 Ų | 137 | 52% | 0.524 | 72% | 0.72 | S | S | . | * | trans | -116.9 | -12.4 | 177.7 | 49.6 | 0 | 0 | 0 | 0 | 113.2 | H6 | S2-H6 PolarHBondContact O-ND1 2.87Š| ||
| 3 | E | 56 | Low | 53.1 | Low | 156 Ų | 156 | 134.9 Ų | 134.9 | 73% | 0.729 | 72% | 0.716 | S | S | * | * | H | α-helix | trans | -79.3 | -18.1 | -174.5 | -64.1 | -87.1 | 105.3 | 0 | 0 | 113.7 | ||
| 4 | F | 48.8 | Very low | 53.2 | Low | 149 Ų | 149 | 137.6 Ų | 137.6 | 65% | 0.654 | 72% | 0.723 | S | S | * | * | H | α-helix | trans | -72.9 | -36.1 | -177 | -172.2 | -102.7 | 0 | 0 | 0 | 112.4 | L8 | F4-L8 HydrophobicContact CE1-CD1 4.21Å |
| 5 | W | 56.9 | Low | 53.5 | Low | 190 Ų | 190 | 139.9 Ų | 139.9 | 72% | 0.72 | 72% | 0.724 | S | S | * | * | H | α-helix | trans | -78.9 | -23.8 | -178.2 | -67.5 | 101.4 | 0 | 0 | 0 | 113.5 | K7 L8 | W5-K7 VanDerWaalsContact C-N 3.29Å; W5-K7 PolarHBondContact O-N 3.36Å; W5-L8 HydrophobicContact CE3-CD1 4.36Å; W5-L8 PolarHBondContact O-N 3.49Å |
| 6 | H | 54.5 | Low | 53.8 | Low | 146 Ų | 146 | 138.4 Ų | 138.4 | 68% | 0.676 | 73% | 0.726 | S | S | * | * | H | α-helix | trans | -72.8 | -20.2 | 179.4 | -72.8 | 83.2 | 0 | 0 | 0 | 113.2 | S2 | S2-H6 PolarHBondContact O-ND1 2.87Å |
| 7 | K | 54.6 | Low | 54.5 | Low | 184 Ų | 184 | 139.9 Ų | 139.9 | 80% | 0.8 | 73% | 0.728 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87.1 | -15.7 | 176.7 | -80.1 | -174.2 | -179.5 | -85 | 0 | 114.6 | W5 | W5-K7 VanDerWaalsContact C-N 3.29Å; W5-K7 PolarHBondContact O-N 3.36Å |
| 8 | L | 53.9 | Low | 55 | Low | 100 Ų | 100 | 138.1 Ų | 138.1 | 52% | 0.524 | 73% | 0.727 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -87.7 | -17.2 | 177.5 | -67.4 | 170.9 | 0 | 0 | 0 | 113 | F4 W5 | F4-L8 HydrophobicContact CE1-CD1 4.21Å; W5-L8 HydrophobicContact CE3-CD1 4.36Å; W5-L8 PolarHBondContact O-N 3.49Å |
| 9 | G | 50.7 | Low | 55.6 | Low | 52 Ų | 52 | 140.8 Ų | 140.8 | 54% | 0.536 | 73% | 0.732 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -79.1 | -12.9 | -178 | 0 | 0 | 0 | 0 | 0 | 115.7 | ||
| 10 | C | 50.7 | Low | 56.1 | Low | 114 Ų | 114 | 143.4 Ų | 143.4 | 77% | 0.77 | 74% | 0.737 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81.6 | -14.8 | -173.2 | -161.5 | 0 | 0 | 0 | 0 | 113.9 | ||
| 11 | C | 51.7 | Low | 56.8 | Low | 120 Ų | 120 | 145.9 Ų | 145.9 | 81% | 0.811 | 74% | 0.742 | S | S | * | * | S | Bend | trans | -109.7 | -2.7 | 179.1 | -64.9 | 0 | 0 | 0 | 0 | 114 | ||
| 12 | V | 49.2 | Very low | 57.7 | Low | 118 Ų | 118 | 145.6 Ų | 145.6 | 72% | 0.715 | 73% | 0.728 | S | S | * | * | trans | -101.6 | 33.4 | 179 | -167.6 | 0 | 0 | 0 | 0 | 111 | E14 | V12-E14 VanDerWaalsContact C-N 3.3Å; V12-E14 PolarHBondContact O-N 3.29Å | ||
| 13 | V | 50 | Low | 58.8 | Low | 110 Ų | 110 | 151.8 Ų | 151.8 | 67% | 0.667 | 74% | 0.74 | S | S | * | * | trans | -85.4 | 93.8 | 147.9 | 172.3 | 0 | 0 | 0 | 0 | 103.9 | K15 | V13-K15 PolarHBondContact O-N 2.62Š| ||
| 14 | E | 55.1 | Low | 60.1 | Low | 173 Ų | 173 | 153 Ų | 153 | 81% | 0.808 | 74% | 0.738 | S | S | * | * | trans | -56.5 | 85.4 | 164.9 | -165.8 | 178.9 | -169.5 | 0 | 0 | 106.2 | V12 P16 | V12-E14 VanDerWaalsContact C-N 3.3Å; V12-E14 PolarHBondContact O-N 3.29Å; E14-P16 WeakPolarHBondContact O-CD 3.49Å | ||
| 15 | K | 57.9 | Low | 61.9 | Low | 171 Ų | 171 | 151.7 Ų | 151.7 | 74% | 0.743 | 74% | 0.736 | S | S | * | * | P | Polyproline II helix | trans | -52.3 | 117.6 | 171 | -78.4 | -178.8 | 178.5 | 172.3 | 0 | 103.5 | V13 Q17 | V13-K15 PolarHBondContact O-N 2.62Å; K15-Q17 PolarHBondContact O-N 3.37Å |
| 16 | P | 58.6 | Low | 63.4 | Low | 116 Ų | 116 | 146.3 Ų | 146.3 | 75% | 0.753 | 72% | 0.722 | S | S | * | * | P | Polyproline II helix | trans | -52.7 | 116.3 | -179.6 | 19.7 | -30.8 | 0 | 0 | 0 | 105.2 | E14 | E14-P16 WeakPolarHBondContact O-CD 3.49Š|
| 17 | Q | 64.9 | Low | 64.8 | Low | 165 Ų | 165 | 145.8 Ų | 145.8 | 77% | 0.771 | 71% | 0.714 | S | S | * | * | P | Polyproline II helix | trans | -47 | 124.1 | -174.3 | -70 | -166 | 14.2 | 0 | 0 | 106.2 | K15 K19 | K15-Q17 PolarHBondContact O-N 3.37Å; Q17-K19 VanDerWaalsContact C-N 3.3Å; Q17-K19 PolarHBondContact O-N 2.89Å |
| 18 | P | 63.3 | Low | 66.6 | Low | 107 Ų | 107 | 143.2 Ų | 143.2 | 70% | 0.695 | 71% | 0.713 | S | S | * | * | trans | -56.7 | 106.1 | -177.4 | 19.4 | -29.4 | 0 | 0 | 0 | 105.2 | K20 | P18-K20 PolarHBondContact O-N 3.34Š| ||
| 19 | K | 66.3 | Low | 68.3 | Low | 189 Ų | 189 | 142.4 Ų | 142.4 | 82% | 0.822 | 71% | 0.708 | S | S | * | * | trans | -61.6 | 96.1 | 179.3 | -68.1 | -178 | -177.7 | 180 | 0 | 103.2 | Q17 K21 | Q17-K19 VanDerWaalsContact C-N 3.3Å; Q17-K19 PolarHBondContact O-N 2.89Å; K19-K21 PolarHBondContact O-N 3.02Å | ||
| 20 | K | 65.4 | Low | 70.1 | Confident | 192 Ų | 192 | 145.5 Ų | 145.5 | 84% | 0.835 | 71% | 0.711 | S | S | * | * | trans | -63.9 | 86.1 | -179.2 | -69.5 | -178.1 | -177.1 | 175.9 | 0 | 105.2 | P18 R22 | P18-K20 PolarHBondContact O-N 3.34Å; K20-R22 VanDerWaalsContact C-N 3.34Å; K20-R22 PolarHBondContact O-N 2.95Å | ||
| 21 | K | 71.3 | Confident | 72.2 | Confident | 197 Ų | 197 | 143.1 Ų | 143.1 | 86% | 0.857 | 71% | 0.706 | S | S | * | * | trans | -61.9 | 105.2 | 173.8 | -77 | -174.7 | -179.6 | 177.6 | 0 | 104.2 | K19 R23 | K19-K21 PolarHBondContact O-N 3.02Å; K21-R23 PolarHBondContact O-N 2.9Å; K21-R23 VanDerWaalsContact O-N 3.1Å | ||
| 22 | R | 74.5 | Confident | 74.3 | Confident | 234 Ų | 234 | 145.5 Ų | 145.5 | 88% | 0.883 | 71% | 0.705 | S | S | * | * | P | Polyproline II helix | trans | -51.2 | 123.1 | 172.6 | -77.9 | 176.6 | 66.8 | -169.2 | 1.1 | 106.6 | K20 R24 | K20-R22 VanDerWaalsContact C-N 3.34Å; K20-R22 PolarHBondContact O-N 2.95Å; R22-R24 PolarHBondContact O-N 3.31Å |
| 23 | R | 81 | Confident | 76.4 | Confident | 205 Ų | 205 | 144.8 Ų | 144.8 | 77% | 0.774 | 70% | 0.703 | S | S | * | * | P | Polyproline II helix | trans | -55.9 | 132.9 | 177.8 | -165.2 | 173.7 | 75.9 | -174.1 | 4.3 | 107.8 | K21 | K21-R23 PolarHBondContact O-N 2.9Å; K21-R23 VanDerWaalsContact O-N 3.1Å |
| 24 | R | 82.6 | Confident | 78.5 | Confident | 182 Ų | 182 | 147 Ų | 147 | 69% | 0.687 | 71% | 0.708 | S | S | * | * | P | Polyproline II helix | trans | -65 | 144.9 | 174.5 | -73.8 | -176.6 | 174.8 | 169.7 | 0.2 | 109 | R22 | R22-R24 PolarHBondContact O-N 3.31Š|
| 25 | I | 86.1 | Confident | 80.2 | Confident | 121 Ų | 121 | 145.8 Ų | 145.8 | 62% | 0.621 | 71% | 0.707 | S | S | * | * | P | Polyproline II helix | trans | -89.7 | 128.9 | 173.5 | -59.4 | 170.9 | 0 | 0 | 0 | 107 | M29 I30 | I25-M29 HydrophobicContact CB-CE 4.43Å; I25-M29 HydrophobicContact CG2-CB 4Å; I25-M29 HydrophobicContact CG2-CE 4.3Å; I25-I30 HydrophobicContact CG2-CD1 4.2Å; I25-I30 HydrophobicContact CG2-CG1 3.76Å |
| 26 | D | 88.6 | Confident | 81.8 | Confident | 77 Ų | 77 | 146.1 Ų | 146.1 | 41% | 0.412 | 71% | 0.709 | S | S | . | * | P | Polyproline II helix | trans | -92.1 | 169.7 | 170 | 68.3 | 36.3 | 0 | 0 | 0 | 110.5 | T28 M29 | D26-T28 PolarHBondContact O-N 2.84Å; D26-T28 WeakPolarHBondContact OD1-CA 3.42Å; D26-T28 WeakPolarHBondContact OD1-CB 3.44Å; D26-T28 PolarHBondContact OD1-N 3.33Å; D26-T28 PolarHBondContact OD1-OG1 3.1Å; D26-T28 PolarHBondContact OD2-OG1 3.35Å; D26-M29 HydrophobicContact CB-CE 4.16Å; D26-M29 PolarHBondContact O-N 3.48Å; D26-M29 WeakPolarHBondContact OD1-CG 3.38Å; D26-M29 PolarHBondContact OD1-N 3.22Å |
| 27 | R | 85.6 | Confident | 83.4 | Confident | 135 Ų | 135 | 145.7 Ų | 145.7 | 51% | 0.509 | 70% | 0.704 | S | S | . | * | G | 310 helix | trans | -66.6 | -26 | -178.4 | -59.9 | -175.8 | -170.7 | 174 | 11.2 | 113 | M29 I30 W73 | R27-M29 VanDerWaalsContact C-N 3.28Å; R27-M29 PolarHBondContact O-N 3.04Å; R27-I30 PolarHBondContact O-N 3.33Å; R27-W73 VanDerWaalsContact CZ-CZ2 3.45Å; R27-W73 VanDerWaalsContact NH2-CE2 3.26Å |
| 28 | T | 90.4 | Very high | 84.6 | Confident | 129 Ų | 129 | 145 Ų | 145 | 79% | 0.791 | 70% | 0.7 | S | S | * | * | G | 310 helix | trans | -75.1 | -19.7 | 179.9 | 58.5 | 0 | 0 | 0 | 0 | 112.9 | D26 | D26-T28 PolarHBondContact O-N 2.84Å; D26-T28 WeakPolarHBondContact OD1-CA 3.42Å; D26-T28 WeakPolarHBondContact OD1-CB 3.44Å; D26-T28 PolarHBondContact OD1-N 3.33Å; D26-T28 PolarHBondContact OD1-OG1 3.1Å; D26-T28 PolarHBondContact OD2-OG1 3.35Å |
| 29 | M | 90 | Very high | 85.7 | Confident | 84 Ų | 84 | 145.4 Ų | 145.4 | 41% | 0.414 | 70% | 0.696 | S | S | . | * | G | 310 helix | trans | -86.3 | -4.9 | 174.1 | -70.1 | -171.3 | -73 | 0 | 0 | 113.7 | I25 D26 R27 | I25-M29 HydrophobicContact CB-CE 4.43Å; I25-M29 HydrophobicContact CG2-CB 4Å; I25-M29 HydrophobicContact CG2-CE 4.3Å; D26-M29 HydrophobicContact CB-CE 4.16Å; D26-M29 PolarHBondContact O-N 3.48Å; D26-M29 WeakPolarHBondContact OD1-CG 3.38Å; D26-M29 PolarHBondContact OD1-N 3.22Å; R27-M29 VanDerWaalsContact C-N 3.28Å; R27-M29 PolarHBondContact O-N 3.04Å |
| 30 | I | 90 | Very high | 86.5 | Confident | 116 Ų | 116 | 139.4 Ų | 139.4 | 60% | 0.595 | 68% | 0.675 | S | S | * | * | trans | -100.7 | 107.7 | 180 | -55.5 | 173.5 | 0 | 0 | 0 | 108.6 | I25 R27 | I25-I30 HydrophobicContact CG2-CD1 4.2Å; I25-I30 HydrophobicContact CG2-CG1 3.76Å; R27-I30 PolarHBondContact O-N 3.33Å | ||
| 31 | G | 94.1 | Very high | 87.4 | Confident | 64 Ų | 64 | 136.5 Ų | 136.5 | 66% | 0.66 | 66% | 0.664 | S | S | * | * | trans | -78 | -173.6 | 173.3 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 32 | E | 95.3 | Very high | 87.9 | Confident | 170 Ų | 170 | 130.7 Ų | 130.7 | 79% | 0.794 | 64% | 0.642 | S | S | * | * | trans | -67.9 | 143 | 179.8 | -63.7 | -174.2 | 163 | 0 | 0 | 112.1 | M34 | E32-M34 PolarHBondContact O-N 3.35Š| ||
| 33 | P | 93.1 | Very high | 88.3 | Confident | 103 Ų | 103 | 120.4 Ų | 120.4 | 67% | 0.669 | 61% | 0.609 | S | S | * | * | trans | -71.4 | 119.3 | 177.7 | -12.3 | 27.4 | 0 | 0 | 0 | 110.7 | F36 | P33-F36 HydrophobicContact CB-CE1 4.43Å; P33-F36 HydrophobicContact CB-CE2 4.34Å; P33-F36 HydrophobicContact CB-CZ 3.84Å | ||
| 34 | M | 93.8 | Very high | 88.1 | Confident | 156 Ų | 156 | 116.9 Ų | 116.9 | 77% | 0.768 | 62% | 0.616 | S | S | * | * | trans | -120.2 | -14 | -177.9 | -61.2 | -178.2 | 76.2 | 0 | 0 | 114.2 | E32 | E32-M34 PolarHBondContact O-N 3.35Š| ||
| 35 | N | 91.6 | Very high | 87.8 | Confident | 149 Ų | 149 | 111.3 Ų | 111.3 | 80% | 0.797 | 62% | 0.615 | S | S | * | * | trans | -121.8 | 73.9 | -169.7 | -63.6 | -43.5 | 0 | 0 | 0 | 111.4 | V37 | N35-V37 PolarHBondContact O-N 2.89Š| ||
| 36 | F | 91.4 | Very high | 86.8 | Confident | 177 Ų | 177 | 108 Ų | 108 | 78% | 0.776 | 60% | 0.596 | S | S | * | * | trans | -75.3 | 116.7 | 176.5 | -65 | -83.6 | 0 | 0 | 0 | 110.2 | P33 | P33-F36 HydrophobicContact CB-CE1 4.43Å; P33-F36 HydrophobicContact CB-CE2 4.34Å; P33-F36 HydrophobicContact CB-CZ 3.84Å | ||
| 37 | V | 91.3 | Very high | 85.6 | Confident | 107 Ų | 107 | 111 Ų | 111 | 65% | 0.648 | 61% | 0.61 | S | S | * | * | trans | -116.5 | 125.4 | 177.8 | -178.1 | 0 | 0 | 0 | 0 | 108.5 | N35 L39 | N35-V37 PolarHBondContact O-N 2.89Å; V37-L39 HydrophobicContact CG1-CD2 4.26Å; V37-L39 PolarHBondContact O-N 2.66Å | ||
| 38 | H | 91.3 | Very high | 84.3 | Confident | 150 Ų | 150 | 108.1 Ų | 108.1 | 69% | 0.694 | 62% | 0.622 | S | S | * | * | trans | -71.9 | 113.6 | 172.4 | -164.7 | 145 | 0 | 0 | 0 | 108.7 | ||||
| 39 | L | 85.4 | Confident | 82.6 | Confident | 117 Ų | 117 | 104.5 Ų | 104.5 | 61% | 0.613 | 61% | 0.605 | S | S | * | * | trans | -97.5 | -48.1 | 179.3 | -67.2 | 175.1 | 0 | 0 | 0 | 112.5 | V37 M63 | V37-L39 HydrophobicContact CG1-CD2 4.26Å; V37-L39 PolarHBondContact O-N 2.66Å; L39-M63 HydrophobicContact CD1-CE 3.78Å | ||
| 40 | T | 83.4 | Confident | 81 | Confident | 62 Ų | 62 | 103.8 Ų | 103.8 | 38% | 0.38 | 62% | 0.619 | S | S | . | * | trans | -153.7 | 152.5 | 178 | -152.5 | 0 | 0 | 0 | 0 | 109.1 | I42 V59 | T40-I42 HydrophobicContact CG2-CD1 4.44Å; T40-I42 HydrophobicContact CG2-CG1 4.12Å; T40-V59 HydrophobicContact CG2-CB 4.45Å; T40-V59 HydrophobicContact CG2-CG1 4.04Å; T40-V59 HydrophobicContact CG2-CG2 3.9Å | ||
| 41 | H | 84.9 | Confident | 79.5 | Confident | 131 Ų | 131 | 105.1 Ų | 105.1 | 61% | 0.606 | 63% | 0.627 | S | S | * | * | trans | -114.3 | 125 | 172.9 | 170.9 | -87.3 | 0 | 0 | 0 | 107.8 | E46 | H41-E46 VanDerWaalsContact O-OE1 3.14Š| ||
| 42 | I | 82.3 | Confident | 77.5 | Confident | 76 Ų | 76 | 102.6 Ų | 102.6 | 39% | 0.39 | 60% | 0.601 | S | S | . | * | trans | -108.7 | 100.3 | 175 | -56.9 | 178.2 | 0 | 0 | 0 | 109.8 | T40 E46 M47 T56 | T40-I42 HydrophobicContact CG2-CD1 4.44Å; T40-I42 HydrophobicContact CG2-CG1 4.12Å; I42-E46 WeakPolarHBondContact CA-OE1 3.46Å; I42-E46 WeakPolarHBondContact CA-OE2 3.34Å; I42-E46 WeakPolarHBondContact CG1-OE2 3.45Å; I42-E46 VanDerWaalsContact CG2-CD 3.49Å; I42-E46 HydrophobicContact CG2-CG 3.72Å; I42-E46 WeakPolarHBondContact CG2-OE2 3.46Å; I42-M47 HydrophobicContact CG2-CE 3.47Å; I42-M47 VanDerWaalsContact CG2-CE 3.47Å; I42-M47 HydrophobicContact CG2-CG 4.2Å; I42-T56 HydrophobicContact CD1-CG2 3.88Å; I42-T56 HydrophobicContact CG1-CG2 4.42Å | ||
| 43 | G | 81.6 | Confident | 75.7 | Confident | 18 Ų | 18 | 100.4 Ų | 100.4 | 19% | 0.186 | 60% | 0.595 | C | S | . | * | trans | -83.4 | 154.2 | 178.6 | 0 | 0 | 0 | 0 | 0 | 113.2 | G45 E46 | G43-G45 PolarHBondContact O-N 2.91Å; G43-E46 PolarHBondContact N-OE1 2.69Å; G43-E46 WeakPolarHBondContact O-CG 3.47Å; G43-E46 PolarHBondContact O-N 2.69Å | ||
| 44 | S | 77.6 | Confident | 74.1 | Confident | 131 Ų | 131 | 99 Ų | 99 | 92% | 0.916 | 59% | 0.591 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -58.7 | -20.1 | -176.9 | -53.9 | 0 | 0 | 0 | 0 | 115.2 | ||
| 45 | G | 75.4 | Confident | 72.6 | Confident | 65 Ų | 65 | 97.9 Ų | 97.9 | 67% | 0.67 | 59% | 0.586 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -91.4 | -14.2 | 177.1 | 0 | 0 | 0 | 0 | 0 | 115.2 | G43 | G43-G45 PolarHBondContact O-N 2.91Š|
| 46 | E | 66.3 | Low | 71.5 | Confident | 50 Ų | 50 | 92.5 Ų | 92.5 | 23% | 0.234 | 56% | 0.559 | C | S | . | * | T | Hydrogen-bonded Turn | trans | -81.4 | -24.5 | -172.7 | 84.6 | -178.8 | 56 | 0 | 0 | 113.1 | H41 I42 G43 G48 G52 | H41-E46 VanDerWaalsContact O-OE1 3.14Å; I42-E46 WeakPolarHBondContact CA-OE1 3.46Å; I42-E46 WeakPolarHBondContact CA-OE2 3.34Å; I42-E46 WeakPolarHBondContact CG1-OE2 3.45Å; I42-E46 VanDerWaalsContact CG2-CD 3.49Å; I42-E46 HydrophobicContact CG2-CG 3.72Å; I42-E46 WeakPolarHBondContact CG2-OE2 3.46Å; G43-E46 PolarHBondContact N-OE1 2.69Å; G43-E46 WeakPolarHBondContact O-CG 3.47Å; G43-E46 PolarHBondContact O-N 2.69Å; E46-G48 PolarHBondContact O-N 3.01Å; E46-G52 WeakPolarHBondContact O-CA 3.09Å |
| 47 | M | 61.9 | Low | 70.4 | Confident | 142 Ų | 142 | 85.5 Ų | 85.5 | 70% | 0.7 | 54% | 0.537 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -70.6 | -14.7 | 177.3 | -63.9 | 178.5 | 176.5 | 0 | 0 | 112.7 | I42 | I42-M47 HydrophobicContact CG2-CE 3.47Å; I42-M47 VanDerWaalsContact CG2-CE 3.47Å; I42-M47 HydrophobicContact CG2-CG 4.2Å |
| 48 | G | 58.2 | Low | 69.6 | Low | 73 Ų | 73 | 82.9 Ų | 82.9 | 75% | 0.753 | 53% | 0.526 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -97.9 | -19.6 | -174.5 | 0 | 0 | 0 | 0 | 0 | 115.4 | E46 | E46-G48 PolarHBondContact O-N 3.01Š|
| 49 | A | 56.6 | Low | 68.9 | Low | 54 Ų | 54 | 77.3 Ų | 77.3 | 45% | 0.446 | 50% | 0.502 | S | S | . | . | S | Bend | trans | -92.5 | 129.6 | 175.3 | 0 | 0 | 0 | 0 | 0 | 108.7 | D51 G52 | A49-D51 PolarHBondContact O-N 3.29Å; A49-G52 PolarHBondContact O-N 2.84Å |
| 50 | G | 55.8 | Low | 68.6 | Low | 69 Ų | 69 | 76.9 Ų | 76.9 | 71% | 0.711 | 50% | 0.497 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -53.2 | -13.1 | -176.4 | 0 | 0 | 0 | 0 | 0 | 116 | ||
| 51 | D | 57.2 | Low | 68.4 | Low | 143 Ų | 143 | 78.7 Ų | 78.7 | 77% | 0.765 | 50% | 0.501 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -86 | -18.9 | 175.6 | -64.6 | -30.7 | 0 | 0 | 0 | 114.5 | A49 L53 A54 | A49-D51 PolarHBondContact O-N 3.29Å; D51-L53 VanDerWaalsContact C-N 3.34Å; D51-L53 PolarHBondContact O-N 2.96Å; D51-A54 PolarHBondContact O-N 2.68Å |
| 52 | G | 53.9 | Low | 68.3 | Low | 11 Ų | 11 | 79.3 Ų | 79.3 | 11% | 0.113 | 51% | 0.505 | C | S | . | . | H | α-helix | trans | -71.4 | -27.6 | 179.4 | 0 | 0 | 0 | 0 | 0 | 113.6 | E46 A49 A54 M55 T56 | E46-G52 WeakPolarHBondContact O-CA 3.09Å; A49-G52 PolarHBondContact O-N 2.84Å; G52-A54 PolarHBondContact O-N 3.37Å; G52-M55 PolarHBondContact O-N 3.25Å; G52-T56 WeakPolarHBondContact O-CG2 3.43Å; G52-T56 PolarHBondContact O-N 3.4Å; G52-T56 PolarHBondContact O-OG1 3.45Å |
| 53 | L | 56.1 | Low | 68.2 | Low | 124 Ų | 124 | 79.8 Ų | 79.8 | 65% | 0.649 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -58.8 | -33.1 | 175.4 | -94.1 | 145 | 0 | 0 | 0 | 112.8 | D51 T56 G57 | D51-L53 VanDerWaalsContact C-N 3.34Å; D51-L53 PolarHBondContact O-N 2.96Å; L53-T56 WeakPolarHBondContact CA-OG1 3.34Å; L53-T56 PolarHBondContact O-OG1 3.29Å; L53-T56 VanDerWaalsContact O-OG1 3.09Å; L53-G57 PolarHBondContact O-N 3.08Å |
| 54 | A | 60.2 | Low | 68.1 | Low | 73 Ų | 73 | 87 Ų | 87 | 60% | 0.603 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -67.9 | -43.7 | 179.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | D51 G52 G57 A58 | D51-A54 PolarHBondContact O-N 2.68Å; G52-A54 PolarHBondContact O-N 3.37Å; A54-G57 PolarHBondContact O-N 3.4Å; A54-A58 PolarHBondContact O-N 2.81Å |
| 55 | M | 62.5 | Low | 68.1 | Low | 134 Ų | 134 | 85.6 Ų | 85.6 | 66% | 0.66 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -71.6 | -42.5 | 178.5 | -68.4 | -59.6 | -170.1 | 0 | 0 | 111.7 | G52 G57 A58 V59 | G52-M55 PolarHBondContact O-N 3.25Å; M55-G57 VanDerWaalsContact C-N 3.29Å; M55-G57 PolarHBondContact O-N 3.45Å; M55-A58 PolarHBondContact O-N 3.49Å; M55-V59 PolarHBondContact O-N 2.86Å |
| 56 | T | 67.3 | Low | 68.2 | Low | 36 Ų | 36 | 90.3 Ų | 90.3 | 22% | 0.221 | 52% | 0.52 | C | S | . | . | H | α-helix | trans | -63.8 | -37.1 | 174.9 | 59.3 | 0 | 0 | 0 | 0 | 111.8 | I42 G52 L53 V59 Q60 | I42-T56 HydrophobicContact CD1-CG2 3.88Å; I42-T56 HydrophobicContact CG1-CG2 4.42Å; G52-T56 WeakPolarHBondContact O-CG2 3.43Å; G52-T56 PolarHBondContact O-N 3.4Å; G52-T56 PolarHBondContact O-OG1 3.45Å; L53-T56 WeakPolarHBondContact CA-OG1 3.34Å; L53-T56 PolarHBondContact O-OG1 3.29Å; L53-T56 VanDerWaalsContact O-OG1 3.09Å; T56-V59 PolarHBondContact O-N 2.91Å; T56-Q60 WeakPolarHBondContact O-CB 3.43Å; T56-Q60 PolarHBondContact O-N 2.71Å |
| 57 | G | 69.8 | Low | 68.3 | Low | 30 Ų | 30 | 90.3 Ų | 90.3 | 31% | 0.309 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -64.7 | -41.3 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.7 | L53 A54 M55 Q60 E61 | L53-G57 PolarHBondContact O-N 3.08Å; A54-G57 PolarHBondContact O-N 3.4Å; M55-G57 VanDerWaalsContact C-N 3.29Å; M55-G57 PolarHBondContact O-N 3.45Å; G57-Q60 PolarHBondContact O-N 3.09Å; G57-E61 VanDerWaalsContact O-CB 3.32Å; G57-E61 WeakPolarHBondContact O-CB 3.37Å; G57-E61 PolarHBondContact O-N 3.42Å |
| 58 | A | 73.9 | Confident | 68.4 | Low | 52 Ų | 52 | 88.3 Ų | 88.3 | 43% | 0.43 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -64.1 | -44 | 177 | 0 | 0 | 0 | 0 | 0 | 112.3 | A54 M55 E61 Q62 | A54-A58 PolarHBondContact O-N 2.81Å; M55-A58 PolarHBondContact O-N 3.49Å; A58-E61 PolarHBondContact O-N 3.47Å; A58-Q62 WeakPolarHBondContact O-CG 3.25Å; A58-Q62 PolarHBondContact O-N 3.06Å; A58-Q62 VanDerWaalsContact O-N 3.08Å |
| 59 | V | 77.6 | Confident | 68.5 | Low | 32 Ų | 32 | 94.7 Ų | 94.7 | 19% | 0.194 | 53% | 0.527 | C | S | . | . | H | α-helix | trans | -67.5 | -41.2 | 177.1 | 175.4 | 0 | 0 | 0 | 0 | 110.8 | T40 M55 T56 E61 Q62 M63 | T40-V59 HydrophobicContact CG2-CB 4.45Å; T40-V59 HydrophobicContact CG2-CG1 4.04Å; T40-V59 HydrophobicContact CG2-CG2 3.9Å; M55-V59 PolarHBondContact O-N 2.86Å; T56-V59 PolarHBondContact O-N 2.91Å; V59-E61 VanDerWaalsContact C-N 3.33Å; V59-E61 PolarHBondContact O-N 2.99Å; V59-Q62 PolarHBondContact O-N 3.03Å; V59-M63 HydrophobicContact CG1-CG 4.48Å; V59-M63 HydrophobicContact CG1-SD 4.12Å; V59-M63 WeakPolarHBondContact O-CB 3.41Å; V59-M63 WeakPolarHBondContact O-CG 3.34Å; V59-M63 PolarHBondContact O-N 3.18Å |
| 60 | Q | 77.9 | Confident | 68.8 | Low | 108 Ų | 108 | 99.3 Ų | 99.3 | 51% | 0.505 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -59.7 | -43.5 | 175.1 | 179.3 | 175.1 | -5.4 | 0 | 0 | 111.7 | T56 G57 M63 R64 | T56-Q60 WeakPolarHBondContact O-CB 3.43Å; T56-Q60 PolarHBondContact O-N 2.71Å; G57-Q60 PolarHBondContact O-N 3.09Å; Q60-M63 CarbonylContact O-C 3.58Å; Q60-M63 PolarHBondContact O-N 3.33Å; Q60-R64 PolarHBondContact O-N 3.25Å |
| 61 | E | 79.8 | Confident | 69.1 | Low | 100 Ų | 100 | 102.3 Ų | 102.3 | 47% | 0.467 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -63 | -41.5 | 177.9 | -179.6 | 67.3 | -179.8 | 0 | 0 | 111.7 | G57 A58 V59 M63 R64 | G57-E61 VanDerWaalsContact O-CB 3.32Å; G57-E61 WeakPolarHBondContact O-CB 3.37Å; G57-E61 PolarHBondContact O-N 3.42Å; A58-E61 PolarHBondContact O-N 3.47Å; V59-E61 VanDerWaalsContact C-N 3.33Å; V59-E61 PolarHBondContact O-N 2.99Å; E61-M63 VanDerWaalsContact C-N 3.35Å; E61-M63 PolarHBondContact O-N 2.89Å; E61-R64 VanDerWaalsContact CD-CZ 3.47Å; E61-R64 WeakPolarHBondContact O-CD 3.38Å; E61-R64 VanDerWaalsContact O-CG 3.25Å; E61-R64 WeakPolarHBondContact O-CG 3.45Å; E61-R64 IonicContact OE1-CZ 2.94Å; E61-R64 IonicContact OE1-NE 3.72Å; E61-R64 IonicContact OE1-NH1 3.5Å; E61-R64 PolarHBondContact OE1-NH1 2.87Å; E61-R64 IonicContact OE1-NH2 3.2Å; E61-R64 PolarHBondContact OE1-NH2 2.88Å; E61-R64 WeakPolarHBondContact OE2-CD 3.36Å; E61-R64 IonicContact OE2-CZ 2.87Å; E61-R64 IonicContact OE2-NE 3.74Å; E61-R64 IonicContact OE2-NH1 2.57Å; E61-R64 PolarHBondContact OE2-NH1 3.49Å |
| 62 | Q | 81.9 | Confident | 69.2 | Low | 145 Ų | 145 | 101 Ų | 101 | 68% | 0.678 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -65.5 | -37.3 | 174.8 | -71.8 | -176.5 | -9.4 | 0 | 0 | 112.6 | A58 V59 | A58-Q62 WeakPolarHBondContact O-CG 3.25Å; A58-Q62 PolarHBondContact O-N 3.06Å; A58-Q62 VanDerWaalsContact O-N 3.08Å; V59-Q62 PolarHBondContact O-N 3.03Å |
| 63 | M | 81.3 | Confident | 69.6 | Low | 86 Ų | 86 | 109.7 Ų | 109.7 | 42% | 0.424 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -89.5 | -9.3 | -176.3 | -70.5 | -169.8 | 151.5 | 0 | 0 | 114.4 | L39 V59 Q60 E61 S65 K66 | L39-M63 HydrophobicContact CD1-CE 3.78Å; V59-M63 HydrophobicContact CG1-CG 4.48Å; V59-M63 HydrophobicContact CG1-SD 4.12Å; V59-M63 WeakPolarHBondContact O-CB 3.41Å; V59-M63 WeakPolarHBondContact O-CG 3.34Å; V59-M63 PolarHBondContact O-N 3.18Å; Q60-M63 CarbonylContact O-C 3.58Å; Q60-M63 PolarHBondContact O-N 3.33Å; E61-M63 VanDerWaalsContact C-N 3.35Å; E61-M63 PolarHBondContact O-N 2.89Å; M63-S65 PolarHBondContact O-N 3.39Å; M63-K66 WeakPolarHBondContact O-CB 3.22Å; M63-K66 PolarHBondContact O-N 3.07Å |
| 64 | R | 79.6 | Confident | 69.9 | Low | 169 Ų | 169 | 107.6 Ų | 107.6 | 64% | 0.638 | 56% | 0.558 | S | S | * | * | G | 310 helix | trans | -54 | -30.9 | -176.6 | 78.5 | -171.3 | 179.7 | -179.9 | -8.8 | 114 | Q60 E61 | Q60-R64 PolarHBondContact O-N 3.25Å; E61-R64 VanDerWaalsContact CD-CZ 3.47Å; E61-R64 WeakPolarHBondContact O-CD 3.38Å; E61-R64 VanDerWaalsContact O-CG 3.25Å; E61-R64 WeakPolarHBondContact O-CG 3.45Å; E61-R64 IonicContact OE1-CZ 2.94Å; E61-R64 IonicContact OE1-NE 3.72Å; E61-R64 IonicContact OE1-NH1 3.5Å; E61-R64 PolarHBondContact OE1-NH1 2.87Å; E61-R64 IonicContact OE1-NH2 3.2Å; E61-R64 PolarHBondContact OE1-NH2 2.88Å; E61-R64 WeakPolarHBondContact OE2-CD 3.36Å; E61-R64 IonicContact OE2-CZ 2.87Å; E61-R64 IonicContact OE2-NE 3.74Å; E61-R64 IonicContact OE2-NH1 2.57Å; E61-R64 PolarHBondContact OE2-NH1 3.49Å |
| 65 | S | 76.3 | Confident | 69.7 | Low | 101 Ų | 101 | 109.7 Ų | 109.7 | 71% | 0.706 | 56% | 0.559 | S | S | * | * | G | 310 helix | trans | -82.4 | -12.4 | -178.2 | 66.6 | 0 | 0 | 0 | 0 | 113.9 | M63 | M63-S65 PolarHBondContact O-N 3.39Š|
| 66 | K | 78.3 | Confident | 69.6 | Low | 164 Ų | 164 | 108.4 Ų | 108.4 | 71% | 0.713 | 56% | 0.564 | S | S | * | * | G | 310 helix | trans | -88.8 | 1.2 | -173.1 | -66.3 | -174.6 | 176.4 | 178.7 | 0 | 114.1 | M63 | M63-K66 WeakPolarHBondContact O-CB 3.22Å; M63-K66 PolarHBondContact O-N 3.07Å |
| 67 | G | 68.1 | Low | 68.9 | Low | 50 Ų | 50 | 116.5 Ų | 116.5 | 52% | 0.515 | 59% | 0.59 | S | S | . | * | trans | -149.9 | 146.3 | 177.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 68 | N | 64.7 | Low | 67.9 | Low | 101 Ų | 101 | 118.9 Ų | 118.9 | 54% | 0.54 | 62% | 0.615 | S | S | . | * | trans | -102.6 | 91.4 | 169.8 | -164.9 | -39.7 | 0 | 0 | 0 | 107.3 | D70 R71 | N68-D70 PolarHBondContact O-N 2.57Å; N68-R71 HydrophobicContact CB-CB 4.22Å; N68-R71 WeakPolarHBondContact ND2-CD 3.32Å; N68-R71 PolarHBondContact O-N 3.2Å; N68-R71 PolarHBondContact OD1-N 3.28Å | ||
| 69 | R | 60.3 | Low | 66.3 | Low | 207 Ų | 207 | 128.1 Ų | 128.1 | 78% | 0.781 | 66% | 0.656 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -63.8 | -28.6 | -175.8 | -72.7 | -175.1 | 178.2 | 166.5 | -1.1 | 112.5 | ||
| 70 | D | 63.3 | Low | 65.7 | Low | 150 Ų | 150 | 132.9 Ų | 132.9 | 80% | 0.802 | 68% | 0.679 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -94.1 | -4.8 | -172.8 | -49.2 | -50.8 | 0 | 0 | 0 | 113.4 | N68 P72 | N68-D70 PolarHBondContact O-N 2.57Å; D70-P72 WeakPolarHBondContact O-CD 3.45Å |
| 71 | R | 62.1 | Low | 65.1 | Low | 132 Ų | 132 | 134.2 Ų | 134.2 | 50% | 0.498 | 69% | 0.688 | S | S | . | * | S | Bend | trans | -91.3 | 116 | 173.8 | -93.1 | -177.7 | 151.4 | -115.7 | -8.3 | 109.5 | N68 W73 | N68-R71 HydrophobicContact CB-CB 4.22Å; N68-R71 WeakPolarHBondContact ND2-CD 3.32Å; N68-R71 PolarHBondContact O-N 3.2Å; N68-R71 PolarHBondContact OD1-N 3.28Å; R71-W73 PolarHBondContact O-N 3.49Å |
| 72 | P | 59.3 | Low | 64.3 | Low | 115 Ų | 115 | 136.1 Ų | 136.1 | 75% | 0.747 | 70% | 0.7 | S | S | * | * | trans | -55.8 | 137.3 | 168.5 | 23.1 | -31 | 0 | 0 | 0 | 108.4 | D70 S74 | D70-P72 WeakPolarHBondContact O-CD 3.45Å; P72-S74 PolarHBondContact O-N 3.26Å | ||
| 73 | W | 62.1 | Low | 63.2 | Low | 194 Ų | 194 | 135.6 Ų | 135.6 | 74% | 0.735 | 70% | 0.702 | S | S | * | * | trans | -56.9 | 102.3 | 174.4 | 177.3 | -93.8 | 0 | 0 | 0 | 108.8 | R27 R71 N75 | R27-W73 VanDerWaalsContact CZ-CZ2 3.45Å; R27-W73 VanDerWaalsContact NH2-CE2 3.26Å; R71-W73 PolarHBondContact O-N 3.49Å; W73-N75 PolarHBondContact NE1-OD1 2.81Å; W73-N75 PolarHBondContact O-N 3.26Å | ||
| 74 | S | 61.8 | Low | 62.1 | Low | 80 Ų | 80 | 138.7 Ų | 138.7 | 56% | 0.559 | 72% | 0.719 | S | S | * | * | trans | -75.6 | 98.2 | 176.8 | 56.8 | 0 | 0 | 0 | 0 | 108 | P72 S76 | P72-S74 PolarHBondContact O-N 3.26Å; S74-S76 PolarHBondContact O-N 2.88Å | ||
| 75 | N | 55.8 | Low | 60.9 | Low | 117 Ų | 117 | 136.7 Ų | 136.7 | 63% | 0.626 | 72% | 0.724 | S | S | * | * | trans | -67.1 | 81.7 | 159.6 | -101.5 | -0.7 | 0 | 0 | 0 | 107.9 | W73 R77 | W73-N75 PolarHBondContact NE1-OD1 2.81Å; W73-N75 PolarHBondContact O-N 3.26Å; N75-R77 PolarHBondContact O-N 3.45Å | ||
| 76 | S | 59.9 | Low | 59.8 | Low | 108 Ų | 108 | 139.2 Ų | 139.2 | 76% | 0.755 | 73% | 0.726 | S | S | * | * | trans | -80.4 | 72 | 167.3 | 54.3 | 0 | 0 | 0 | 0 | 109.6 | S74 | S74-S76 PolarHBondContact O-N 2.88Š| ||
| 77 | R | 52.4 | Low | 58.4 | Low | 205 Ų | 205 | 137.3 Ų | 137.3 | 77% | 0.774 | 73% | 0.727 | S | S | * | * | trans | -157.5 | 111.2 | 153.2 | -71.5 | -162.4 | -81.5 | -139 | 2.9 | 105.8 | N75 | N75-R77 PolarHBondContact O-N 3.45Š| ||
| 78 | G | 50.5 | Low | 57.6 | Low | 80 Ų | 80 | 144.6 Ų | 144.6 | 83% | 0.825 | 74% | 0.744 | S | S | * | * | cis | 75.1 | 40.1 | 15.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 79 | L | 39.3 | Very low | 57 | Low | 246 Ų | 246 | 148.5 Ų | 148.5 | 100% | 1.288 | 76% | 0.763 | S | S | * | * | trans | 166.4 | 0 | 141.9 | -84.4 | 173.2 | 0 | 0 | 0 | 107.6 |
Retrieved 79 of 79 residues in 56.5 ms
(Link to these results)