| 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 | 68.7 | Low | 81.5 | Confident | 161 Ų | 161 | 112.9 Ų | 112.9 | 79% | 0.793 | 61% | 0.607 | S | S | * | * | 0 | 158.7 | 0 | -69.7 | -71.6 | 177.8 | 0 | 0 | 108.6 | |||||
| 2 | G | 80.4 | Confident | 81.3 | Confident | 77 Ų | 77 | 114.1 Ų | 114.1 | 79% | 0.794 | 61% | 0.613 | S | S | * | * | trans | -175.9 | -176.3 | -177.6 | 0 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 3 | I | 86.8 | Confident | 80.6 | Confident | 133 Ų | 133 | 116.5 Ų | 116.5 | 68% | 0.682 | 61% | 0.61 | S | S | * | * | trans | -77.9 | 125.7 | 177 | -60.3 | 177.1 | 0 | 0 | 0 | 109.4 | G5 L6 | I3-G5 PolarHBondContact O-N 3.42Å; I3-L6 HydrophobicContact CB-CB 4.1Å; I3-L6 HydrophobicContact CB-CD2 4.27Å; I3-L6 HydrophobicContact CD1-CD2 4.44Å; I3-L6 HydrophobicContact CG2-CB 4.24Å; I3-L6 PolarHBondContact O-N 3.36Å | ||
| 4 | R | 84.9 | Confident | 79.6 | Confident | 251 Ų | 251 | 110.6 Ų | 110.6 | 95% | 0.947 | 58% | 0.582 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -65.6 | 130.5 | -177.9 | -145.9 | 173 | 95.4 | -166.6 | 7.9 | 110.3 | L6 | R4-L6 VanDerWaalsContact C-N 3.29Å; R4-L6 PolarHBondContact O-N 2.68Å |
| 5 | G | 84 | Confident | 78.7 | Confident | 52 Ų | 52 | 112.5 Ų | 112.5 | 54% | 0.536 | 59% | 0.594 | S | S | . | * | T | Hydrogen-bonded Turn | trans | 84.6 | -13.8 | 179.4 | 0 | 0 | 0 | 0 | 0 | 115.5 | I3 M7 S8 F9 | I3-G5 PolarHBondContact O-N 3.42Å; G5-M7 PolarHBondContact O-N 3.3Å; G5-S8 PolarHBondContact O-N 2.92Å; G5-F9 PolarHBondContact O-N 3.04Å; G5-F9 VanDerWaalsContact O-N 3.11Å |
| 6 | L | 84.9 | Confident | 77.9 | Confident | 82 Ų | 82 | 116.8 Ų | 116.8 | 43% | 0.429 | 61% | 0.609 | S | S | . | * | H | α-helix | trans | -64.8 | -42.4 | -179.4 | -178.1 | 62.5 | 0 | 0 | 0 | 112.3 | I3 R4 F9 V10 | I3-L6 HydrophobicContact CB-CB 4.1Å; I3-L6 HydrophobicContact CB-CD2 4.27Å; I3-L6 HydrophobicContact CD1-CD2 4.44Å; I3-L6 HydrophobicContact CG2-CB 4.24Å; I3-L6 PolarHBondContact O-N 3.36Å; R4-L6 VanDerWaalsContact C-N 3.29Å; R4-L6 PolarHBondContact O-N 2.68Å; L6-F9 PolarHBondContact O-N 3.3Å; L6-V10 WeakPolarHBondContact O-CG2 3.44Å; L6-V10 PolarHBondContact O-N 3.28Å; L6-V10 VanDerWaalsContact O-N 3.08Å |
| 7 | M | 79.5 | Confident | 77.2 | Confident | 120 Ų | 120 | 118.6 Ų | 118.6 | 59% | 0.591 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -67.7 | -38.6 | 179.1 | -68.3 | -75.7 | 76.4 | 0 | 0 | 112.6 | G5 F9 V10 E11 | G5-M7 PolarHBondContact O-N 3.3Å; M7-F9 VanDerWaalsContact C-N 3.33Å; M7-F9 PolarHBondContact O-N 3.33Å; M7-V10 HydrophobicContact CE-CB 4.14Å; M7-V10 HydrophobicContact CE-CG1 4.38Å; M7-V10 HydrophobicContact CE-CG2 4.26Å; M7-V10 PolarHBondContact O-N 3.22Å; M7-E11 WeakPolarHBondContact O-CB 3.28Å; M7-E11 WeakPolarHBondContact O-CG 3.48Å; M7-E11 PolarHBondContact O-N 2.89Å |
| 8 | S | 82.8 | Confident | 76.6 | Confident | 71 Ų | 71 | 118.3 Ų | 118.3 | 50% | 0.497 | 61% | 0.605 | S | S | . | * | H | α-helix | trans | -64 | -39.3 | 175.9 | 176.5 | 0 | 0 | 0 | 0 | 111.8 | G5 V10 E11 D12 | G5-S8 PolarHBondContact O-N 2.92Å; S8-V10 VanDerWaalsContact C-N 3.34Å; S8-V10 PolarHBondContact O-N 2.75Å; S8-E11 PolarHBondContact O-N 3.38Å; S8-D12 PolarHBondContact O-N 3.23Å |
| 9 | F | 85.3 | Confident | 76.2 | Confident | 127 Ų | 127 | 118.2 Ų | 118.2 | 56% | 0.557 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -64.2 | -38.2 | 173.9 | 175.3 | -98 | 0 | 0 | 0 | 112.4 | G5 L6 M7 Y13 | G5-F9 PolarHBondContact O-N 3.04Å; G5-F9 VanDerWaalsContact O-N 3.11Å; L6-F9 PolarHBondContact O-N 3.3Å; M7-F9 VanDerWaalsContact C-N 3.33Å; M7-F9 PolarHBondContact O-N 3.33Å; F9-Y13 HydrophobicContact CE2-CE2 4.17Å; F9-Y13 HydrophobicContact CZ-CE2 4.09Å; F9-Y13 VanDerWaalsContact O-CD2 3.29Å; F9-Y13 WeakPolarHBondContact O-CD2 3.29Å |
| 10 | V | 81.9 | Confident | 75.9 | Confident | 44 Ų | 44 | 117.9 Ų | 117.9 | 27% | 0.267 | 61% | 0.61 | S | S | . | * | H | α-helix | trans | -75.5 | -32.1 | 178.3 | 172.2 | 0 | 0 | 0 | 0 | 111.9 | L6 M7 S8 D12 Y13 S14 F18 | L6-V10 WeakPolarHBondContact O-CG2 3.44Å; L6-V10 PolarHBondContact O-N 3.28Å; L6-V10 VanDerWaalsContact O-N 3.08Å; M7-V10 HydrophobicContact CE-CB 4.14Å; M7-V10 HydrophobicContact CE-CG1 4.38Å; M7-V10 HydrophobicContact CE-CG2 4.26Å; M7-V10 PolarHBondContact O-N 3.22Å; S8-V10 VanDerWaalsContact C-N 3.34Å; S8-V10 PolarHBondContact O-N 2.75Å; V10-D12 PolarHBondContact O-N 3.09Å; V10-Y13 CarbonylContact O-C 3.43Å; V10-Y13 PolarHBondContact O-N 3.48Å; V10-S14 PolarHBondContact O-N 3.05Å; V10-F18 HydrophobicContact CG1-CE2 4.1Å |
| 11 | E | 77.6 | Confident | 75.8 | Confident | 124 Ų | 124 | 116.8 Ų | 116.8 | 58% | 0.579 | 60% | 0.604 | S | S | * | * | H | α-helix | trans | -58.2 | -37.5 | 176.9 | -85.3 | 172.2 | -174.5 | 0 | 0 | 112.1 | M7 S8 Y13 S14 | M7-E11 WeakPolarHBondContact O-CB 3.28Å; M7-E11 WeakPolarHBondContact O-CG 3.48Å; M7-E11 PolarHBondContact O-N 2.89Å; S8-E11 PolarHBondContact O-N 3.38Å; E11-Y13 PolarHBondContact O-N 2.89Å; E11-Y13 VanDerWaalsContact O-N 3.08Å; E11-S14 WeakPolarHBondContact O-CB 3.43Å; E11-S14 PolarHBondContact O-N 3.4Å; E11-S14 PolarHBondContact O-OG 2.75Å |
| 12 | D | 78.9 | Confident | 76.4 | Confident | 127 Ų | 127 | 116.3 Ų | 116.3 | 68% | 0.679 | 60% | 0.598 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -59.1 | -21.5 | 174.7 | -65.1 | -24.7 | 0 | 0 | 0 | 113.2 | S8 V10 | S8-D12 PolarHBondContact O-N 3.23Å; V10-D12 PolarHBondContact O-N 3.09Å |
| 13 | Y | 72.3 | Confident | 76.6 | Confident | 146 Ų | 146 | 116.5 Ų | 116.5 | 57% | 0.573 | 58% | 0.58 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -114.4 | 2.4 | 177.4 | -58.5 | -86.9 | 0 | 0 | 0 | 113.3 | F9 V10 E11 N15 E16 | F9-Y13 HydrophobicContact CE2-CE2 4.17Å; F9-Y13 HydrophobicContact CZ-CE2 4.09Å; F9-Y13 VanDerWaalsContact O-CD2 3.29Å; F9-Y13 WeakPolarHBondContact O-CD2 3.29Å; V10-Y13 CarbonylContact O-C 3.43Å; V10-Y13 PolarHBondContact O-N 3.48Å; E11-Y13 PolarHBondContact O-N 2.89Å; E11-Y13 VanDerWaalsContact O-N 3.08Å; Y13-N15 VanDerWaalsContact C-N 3.32Å; Y13-N15 PolarHBondContact O-N 2.93Å; Y13-E16 PolarHBondContact O-N 2.73Å |
| 14 | S | 67.1 | Low | 76.5 | Confident | 33 Ų | 33 | 121.3 Ų | 121.3 | 23% | 0.231 | 59% | 0.59 | C | S | . | * | H | α-helix | trans | -68.6 | -27.1 | -166.5 | 61.2 | 0 | 0 | 0 | 0 | 114.5 | V10 E11 E16 F17 F18 | V10-S14 PolarHBondContact O-N 3.05Å; E11-S14 WeakPolarHBondContact O-CB 3.43Å; E11-S14 PolarHBondContact O-N 3.4Å; E11-S14 PolarHBondContact O-OG 2.75Å; S14-E16 PolarHBondContact O-N 2.79Å; S14-F17 PolarHBondContact O-N 3.49Å; S14-F18 PolarHBondContact O-N 2.88Å |
| 15 | N | 65.3 | Low | 76.7 | Confident | 140 Ų | 140 | 117.5 Ų | 117.5 | 75% | 0.749 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -64.8 | -18.9 | 178.3 | -86.6 | -23.7 | 0 | 0 | 0 | 113.6 | Y13 V19 | Y13-N15 VanDerWaalsContact C-N 3.32Å; Y13-N15 PolarHBondContact O-N 2.93Å; N15-V19 WeakPolarHBondContact O-CG2 3.4Å |
| 16 | E | 66.3 | Low | 77 | Confident | 181 Ų | 181 | 118.9 Ų | 118.9 | 85% | 0.846 | 59% | 0.586 | S | S | * | * | H | α-helix | trans | -96.1 | -28.2 | 175.9 | -62.7 | -169.7 | 172.5 | 0 | 0 | 112.3 | Y13 S14 | Y13-E16 PolarHBondContact O-N 2.73Å; S14-E16 PolarHBondContact O-N 2.79Å |
| 17 | F | 65.9 | Low | 77.3 | Confident | 148 Ų | 148 | 124.7 Ų | 124.7 | 65% | 0.649 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -90.6 | -30.9 | -168.6 | -155.9 | -96.1 | 0 | 0 | 0 | 114 | S14 | S14-F17 PolarHBondContact O-N 3.49Å |
| 18 | F | 65.9 | Low | 77.8 | Confident | 112 Ų | 112 | 124.1 Ų | 124.1 | 49% | 0.491 | 61% | 0.607 | S | S | . | * | S | Bend | trans | -108.3 | -3.3 | -169.4 | -64.6 | -78 | 0 | 0 | 0 | 115 | V10 S14 | V10-F18 HydrophobicContact CG1-CE2 4.1Å; S14-F18 PolarHBondContact O-N 2.88Å |
| 19 | V | 68.9 | Low | 78.3 | Confident | 117 Ų | 117 | 128.8 Ų | 128.8 | 71% | 0.709 | 62% | 0.624 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76.7 | -30.2 | -173.5 | 177.2 | 0 | 0 | 0 | 0 | 113.3 | N15 | N15-V19 WeakPolarHBondContact O-CG2 3.4Š|
| 20 | D | 70.3 | Confident | 78.6 | Confident | 112 Ų | 112 | 128.5 Ų | 128.5 | 60% | 0.599 | 63% | 0.627 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -128.9 | 47 | 177.2 | -170.1 | 35 | 0 | 0 | 0 | 112.1 | K22 | D20-K22 PolarHBondContact O-N 3.41Å; D20-K22 IonicContact OD1-NZ 3.3Å; D20-K22 PolarHBondContact OD1-NZ 2.91Å; D20-K22 IonicContact OD2-NZ 2.68Å; D20-K22 PolarHBondContact OD2-NZ 2.78Å |
| 21 | L | 74 | Confident | 78.9 | Confident | 94 Ų | 94 | 130.8 Ų | 130.8 | 49% | 0.492 | 64% | 0.638 | S | S | . | * | trans | -73.3 | 91.4 | 177 | -168.5 | 67.8 | 0 | 0 | 0 | 110.5 | L23 | L21-L23 HydrophobicContact CD1-CD2 4.38Å; L21-L23 HydrophobicContact CD2-CD1 4.15Å; L21-L23 HydrophobicContact CD2-CD2 3.77Å; L21-L23 HydrophobicContact CD2-CG 4.07Å; L21-L23 HydrophobicContact CG-CD2 3.72Å; L21-L23 HydrophobicContact CG-CG 3.96Å; L21-L23 PolarHBondContact O-N 3.15Å | ||
| 22 | K | 81 | Confident | 79.5 | Confident | 152 Ų | 152 | 127.1 Ų | 127.1 | 66% | 0.661 | 63% | 0.634 | S | S | * | * | trans | -74.1 | 92.1 | 176.6 | -67.9 | -170 | 171.2 | 82.2 | 0 | 111.3 | D20 R24 | D20-K22 PolarHBondContact O-N 3.41Å; D20-K22 IonicContact OD1-NZ 3.3Å; D20-K22 PolarHBondContact OD1-NZ 2.91Å; D20-K22 IonicContact OD2-NZ 2.68Å; D20-K22 PolarHBondContact OD2-NZ 2.78Å; K22-R24 VanDerWaalsContact C-N 3.28Å; K22-R24 PolarHBondContact O-N 2.93Å | ||
| 23 | L | 84.1 | Confident | 79.9 | Confident | 81 Ų | 81 | 127.9 Ų | 127.9 | 42% | 0.424 | 63% | 0.628 | S | S | . | * | trans | -84.8 | 6.3 | 178.9 | -62.7 | 177.5 | 0 | 0 | 0 | 114.5 | L21 N25 T26 L28 | L21-L23 HydrophobicContact CD1-CD2 4.38Å; L21-L23 HydrophobicContact CD2-CD1 4.15Å; L21-L23 HydrophobicContact CD2-CD2 3.77Å; L21-L23 HydrophobicContact CD2-CG 4.07Å; L21-L23 HydrophobicContact CG-CD2 3.72Å; L21-L23 HydrophobicContact CG-CG 3.96Å; L21-L23 PolarHBondContact O-N 3.15Å; L23-N25 PolarHBondContact O-N 3.1Å; L23-T26 PolarHBondContact O-N 2.94Å; L23-L28 HydrophobicContact CD1-CD1 4.09Å; L23-L28 HydrophobicContact CD2-CD2 4.13Å | ||
| 24 | R | 86.7 | Confident | 80.6 | Confident | 234 Ų | 234 | 122.7 Ų | 122.7 | 88% | 0.883 | 61% | 0.613 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -65.3 | 130.2 | -175.4 | -169 | 178.1 | -174.4 | 173.1 | 1.8 | 110.3 | K22 T26 | K22-R24 VanDerWaalsContact C-N 3.28Å; K22-R24 PolarHBondContact O-N 2.93Å; R24-T26 PolarHBondContact O-N 3.25Å |
| 25 | N | 87.8 | Confident | 81.5 | Confident | 170 Ų | 170 | 125.1 Ų | 125.1 | 91% | 0.909 | 62% | 0.623 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 65.3 | 18.4 | 178.6 | -142.5 | 57.8 | 0 | 0 | 0 | 114.9 | L23 | L23-N25 PolarHBondContact O-N 3.1Š|
| 26 | T | 91.3 | Very high | 82.5 | Confident | 81 Ų | 81 | 123 Ų | 123 | 50% | 0.497 | 61% | 0.608 | S | S | . | * | trans | -100 | 130.4 | 175.6 | -55.5 | 0 | 0 | 0 | 0 | 109.9 | L23 R24 L28 | L23-T26 PolarHBondContact O-N 2.94Å; R24-T26 PolarHBondContact O-N 3.25Å; T26-L28 HydrophobicContact CG2-CD2 4.49Å; T26-L28 PolarHBondContact O-N 3.07Å | ||
| 27 | K | 90.8 | Very high | 83.4 | Confident | 204 Ų | 204 | 116.9 Ų | 116.9 | 89% | 0.887 | 58% | 0.579 | S | S | * | * | trans | -76.5 | 109.5 | 170.4 | -69.9 | -177.2 | -178 | 179.4 | 0 | 108.8 | ||||
| 28 | L | 90.6 | Very high | 84.2 | Confident | 108 Ų | 108 | 117.5 Ų | 117.5 | 57% | 0.565 | 58% | 0.577 | S | S | * | * | trans | -89.2 | 129.9 | 175.3 | -66.3 | 169.4 | 0 | 0 | 0 | 109.6 | L23 T26 | L23-L28 HydrophobicContact CD1-CD1 4.09Å; L23-L28 HydrophobicContact CD2-CD2 4.13Å; T26-L28 HydrophobicContact CG2-CD2 4.49Å; T26-L28 PolarHBondContact O-N 3.07Å | ||
| 29 | I | 92.2 | Very high | 85.1 | Confident | 169 Ų | 169 | 115.8 Ų | 115.8 | 87% | 0.867 | 57% | 0.572 | S | S | * | * | trans | -100.4 | 123.5 | 171.4 | -57.5 | 176 | 0 | 0 | 0 | 107 | ||||
| 30 | I | 91.1 | Very high | 85.6 | Confident | 121 Ų | 121 | 112.4 Ų | 112.4 | 62% | 0.621 | 55% | 0.553 | S | S | * | * | trans | -107.9 | 127.9 | -178.8 | -57.4 | 174.5 | 0 | 0 | 0 | 107.9 | G32 L35 | I30-G32 PolarHBondContact O-N 3.09Å; I30-L35 HydrophobicContact CG2-CB 4.31Å; I30-L35 HydrophobicContact CG2-CD2 4.11Å | ||
| 31 | D | 89.6 | Confident | 85.9 | Confident | 92 Ų | 92 | 111.2 Ų | 111.2 | 49% | 0.492 | 54% | 0.543 | S | S | . | . | trans | -72.3 | 107.6 | 168.1 | 173.4 | 16.3 | 0 | 0 | 0 | 109.7 | Y33 S34 L35 | D31-Y33 VanDerWaalsContact C-N 3.31Å; D31-Y33 PolarHBondContact O-N 2.99Å; D31-Y33 PolarHBondContact OD1-N 3.04Å; D31-S34 PolarHBondContact O-N 3.46Å; D31-S34 WeakPolarHBondContact OD2-CB 3.33Å; D31-S34 PolarHBondContact OD2-N 3.46Å; D31-S34 PolarHBondContact OD2-OG 3.49Å; D31-L35 WeakPolarHBondContact O-CB 3.36Å; D31-L35 PolarHBondContact O-N 3.22Å | ||
| 32 | G | 90.1 | Very high | 85.8 | Confident | 47 Ų | 47 | 111.9 Ų | 111.9 | 49% | 0.485 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -63.6 | -32.9 | -178.3 | 0 | 0 | 0 | 0 | 0 | 113.7 | I30 L35 F36 | I30-G32 PolarHBondContact O-N 3.09Å; G32-L35 PolarHBondContact O-N 3.28Å; G32-F36 VanDerWaalsContact O-CB 3.28Å; G32-F36 WeakPolarHBondContact O-CB 3.08Å; G32-F36 PolarHBondContact O-N 3.25Å |
| 33 | Y | 87.4 | Confident | 84.7 | Confident | 144 Ų | 144 | 106.2 Ų | 106.2 | 57% | 0.565 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -71.1 | -45.8 | -179.4 | -179.3 | -106.6 | 0 | 0 | 0 | 111.1 | D31 L35 F36 H37 | D31-Y33 VanDerWaalsContact C-N 3.31Å; D31-Y33 PolarHBondContact O-N 2.99Å; D31-Y33 PolarHBondContact OD1-N 3.04Å; Y33-L35 VanDerWaalsContact C-N 3.32Å; Y33-L35 PolarHBondContact O-N 3.29Å; Y33-F36 PolarHBondContact O-N 3.4Å; Y33-H37 PolarHBondContact O-N 2.59Å |
| 34 | S | 86.2 | Confident | 83.5 | Confident | 37 Ų | 37 | 110.7 Ų | 110.7 | 26% | 0.259 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -64.6 | -36.3 | 175.3 | -68.9 | 0 | 0 | 0 | 0 | 112.4 | D31 R38 | D31-S34 PolarHBondContact O-N 3.46Å; D31-S34 WeakPolarHBondContact OD2-CB 3.33Å; D31-S34 PolarHBondContact OD2-N 3.46Å; D31-S34 PolarHBondContact OD2-OG 3.49Å; S34-R38 WeakPolarHBondContact O-CB 3.5Å; S34-R38 PolarHBondContact O-N 2.67Å; S34-R38 VanDerWaalsContact O-N 3.09Å |
| 35 | L | 86.8 | Confident | 82.1 | Confident | 83 Ų | 83 | 105 Ų | 105 | 44% | 0.435 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -65.7 | -47.9 | 174.4 | 179.6 | 63.6 | 0 | 0 | 0 | 111.7 | I30 D31 G32 Y33 H37 R38 L39 | I30-L35 HydrophobicContact CG2-CB 4.31Å; I30-L35 HydrophobicContact CG2-CD2 4.11Å; D31-L35 WeakPolarHBondContact O-CB 3.36Å; D31-L35 PolarHBondContact O-N 3.22Å; G32-L35 PolarHBondContact O-N 3.28Å; Y33-L35 VanDerWaalsContact C-N 3.32Å; Y33-L35 PolarHBondContact O-N 3.29Å; L35-H37 PolarHBondContact O-N 3.09Å; L35-R38 PolarHBondContact O-N 3.02Å; L35-R38 VanDerWaalsContact O-N 3.07Å; L35-L39 HydrophobicContact CD1-CD1 4.11Å; L35-L39 HydrophobicContact CD1-CG 4.18Å; L35-L39 HydrophobicContact CG-CD1 3.96Å; L35-L39 HydrophobicContact CG-CG 4.41Å; L35-L39 WeakPolarHBondContact O-CG 3.36Å; L35-L39 PolarHBondContact O-N 3.41Å |
| 36 | F | 86.1 | Confident | 80.5 | Confident | 97 Ų | 97 | 105.7 Ų | 105.7 | 43% | 0.425 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -56.1 | -51 | 177.7 | 171.2 | -99.4 | 0 | 0 | 0 | 111.2 | G32 Y33 R38 L39 C40 | G32-F36 VanDerWaalsContact O-CB 3.28Å; G32-F36 WeakPolarHBondContact O-CB 3.08Å; G32-F36 PolarHBondContact O-N 3.25Å; Y33-F36 PolarHBondContact O-N 3.4Å; F36-R38 PolarHBondContact O-N 2.96Å; F36-L39 PolarHBondContact O-N 3.08Å; F36-L39 VanDerWaalsContact O-N 3.15Å; F36-C40 WeakPolarHBondContact CE2-SG 3.4Å; F36-C40 HydrophobicContact CZ-CB 4.49Å; F36-C40 VanDerWaalsContact CZ-SG 3.56Å; F36-C40 WeakPolarHBondContact O-CB 3.32Å; F36-C40 PolarHBondContact O-N 3.42Å; F36-C40 PolarHBondContact O-SG 2.98Å; F36-C40 VanDerWaalsContact O-SG 3.41Å |
| 37 | H | 84.8 | Confident | 78.8 | Confident | 51 Ų | 51 | 106.8 Ų | 106.8 | 24% | 0.236 | 54% | 0.537 | C | S | . | . | H | α-helix | trans | -58.8 | -37.4 | 177.2 | -174.4 | -66.5 | 0 | 0 | 0 | 111.6 | Y33 L35 F41 | Y33-H37 PolarHBondContact O-N 2.59Å; L35-H37 PolarHBondContact O-N 3.09Å; H37-F41 HydrophobicContact CB-CD2 4.44Å; H37-F41 AromaticContact CD2-CD2 3.81Å; H37-F41 AromaticContact CE1-CD2 3.97Å; H37-F41 AromaticContact CG-CD2 3.84Å; H37-F41 AromaticContact ND1-CD2 3.93Å; H37-F41 AromaticContact NE2-CD2 3.94Å; H37-F41 WeakPolarHBondContact O-CB 3.35Å; H37-F41 WeakPolarHBondContact O-CD2 3.29Å; H37-F41 PolarHBondContact O-N 3.35Å; H37-F41 VanDerWaalsContact O-N 3.09Å |
| 38 | R | 83.8 | Confident | 76.7 | Confident | 162 Ų | 162 | 102.7 Ų | 102.7 | 61% | 0.611 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -68 | -41.5 | 177.9 | -173.7 | 159.2 | 178.4 | 119.1 | -0.3 | 112.3 | S34 L35 F36 N42 S43 | S34-R38 WeakPolarHBondContact O-CB 3.5Å; S34-R38 PolarHBondContact O-N 2.67Å; S34-R38 VanDerWaalsContact O-N 3.09Å; L35-R38 PolarHBondContact O-N 3.02Å; L35-R38 VanDerWaalsContact O-N 3.07Å; F36-R38 PolarHBondContact O-N 2.96Å; R38-N42 HydrophobicContact CG-CB 3.95Å; R38-N42 CarbonylContact O-C 3.46Å; R38-N42 WeakPolarHBondContact O-CA 3.11Å; R38-N42 WeakPolarHBondContact O-CB 3.4Å; R38-N42 PolarHBondContact O-N 3.08Å; R38-S43 PolarHBondContact O-N 3.48Å; R38-S43 VanDerWaalsContact O-N 3.1Å |
| 39 | L | 83.4 | Confident | 74.8 | Confident | 76 Ų | 76 | 99.3 Ų | 99.3 | 40% | 0.398 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -71.3 | -33 | 179.1 | -68 | 173.4 | 0 | 0 | 0 | 113.1 | L35 F36 S43 | L35-L39 HydrophobicContact CD1-CD1 4.11Å; L35-L39 HydrophobicContact CD1-CG 4.18Å; L35-L39 HydrophobicContact CG-CD1 3.96Å; L35-L39 HydrophobicContact CG-CG 4.41Å; L35-L39 WeakPolarHBondContact O-CG 3.36Å; L35-L39 PolarHBondContact O-N 3.41Å; F36-L39 PolarHBondContact O-N 3.08Å; F36-L39 VanDerWaalsContact O-N 3.15Å; L39-S43 WeakPolarHBondContact CA-OG 3.33Å; L39-S43 PolarHBondContact O-OG 2.79Å |
| 40 | C | 80.5 | Confident | 72.8 | Confident | 45 Ų | 45 | 97 Ų | 97 | 30% | 0.304 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -85.1 | -27.3 | -177.9 | -67.7 | 0 | 0 | 0 | 0 | 113.6 | F36 | F36-C40 WeakPolarHBondContact CE2-SG 3.4Å; F36-C40 HydrophobicContact CZ-CB 4.49Å; F36-C40 VanDerWaalsContact CZ-SG 3.56Å; F36-C40 WeakPolarHBondContact O-CB 3.32Å; F36-C40 PolarHBondContact O-N 3.42Å; F36-C40 PolarHBondContact O-SG 2.98Å; F36-C40 VanDerWaalsContact O-SG 3.41Å |
| 41 | F | 77.1 | Confident | 70.8 | Confident | 87 Ų | 87 | 101.6 Ų | 101.6 | 38% | 0.382 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -125.7 | -18.5 | -170.5 | -58.2 | -74.5 | 0 | 0 | 0 | 115.3 | H37 C56 F57 | H37-F41 HydrophobicContact CB-CD2 4.44Å; H37-F41 AromaticContact CD2-CD2 3.81Å; H37-F41 AromaticContact CE1-CD2 3.97Å; H37-F41 AromaticContact CG-CD2 3.84Å; H37-F41 AromaticContact ND1-CD2 3.93Å; H37-F41 AromaticContact NE2-CD2 3.94Å; H37-F41 WeakPolarHBondContact O-CB 3.35Å; H37-F41 WeakPolarHBondContact O-CD2 3.29Å; H37-F41 PolarHBondContact O-N 3.35Å; H37-F41 VanDerWaalsContact O-N 3.09Å; F41-C56 HydrophobicContact CE1-CB 4.31Å; F41-C56 HydrophobicContact CE2-CB 4.5Å; F41-C56 HydrophobicContact CZ-CB 3.73Å; F41-F57 HydrophobicContact CE1-CD2 4.37Å; F41-F57 AromaticContact CE1-CE2 3.98Å; F41-F57 HydrophobicContact CE1-CE2 3.98Å; F41-F57 HydrophobicContact CE2-CE2 4.07Å; F41-F57 AromaticContact CZ-CD2 3.82Å; F41-F57 HydrophobicContact CZ-CD2 3.82Å; F41-F57 AromaticContact CZ-CE2 3.33Å; F41-F57 HydrophobicContact CZ-CE2 3.33Å; F41-F57 HydrophobicContact CZ-CZ 4.34Å |
| 42 | N | 70 | Confident | 69 | Low | 108 Ų | 108 | 102 Ų | 102 | 58% | 0.578 | 53% | 0.527 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -120.3 | -7.2 | -173.4 | -93.4 | 16.3 | 0 | 0 | 0 | 114.3 | R38 | R38-N42 HydrophobicContact CG-CB 3.95Å; R38-N42 CarbonylContact O-C 3.46Å; R38-N42 WeakPolarHBondContact O-CA 3.11Å; R38-N42 WeakPolarHBondContact O-CB 3.4Å; R38-N42 PolarHBondContact O-N 3.08Å |
| 43 | S | 58.6 | Low | 66.9 | Low | 34 Ų | 34 | 103.4 Ų | 103.4 | 24% | 0.238 | 54% | 0.541 | C | S | . | . | S | Bend | trans | -98.9 | 128.3 | 168.4 | 48.8 | 0 | 0 | 0 | 0 | 108.9 | R38 L39 L45 | R38-S43 PolarHBondContact O-N 3.48Å; R38-S43 VanDerWaalsContact O-N 3.1Å; L39-S43 WeakPolarHBondContact CA-OG 3.33Å; L39-S43 PolarHBondContact O-OG 2.79Å; S43-L45 PolarHBondContact O-N 3.18Å |
| 44 | D | 59.8 | Low | 65.1 | Low | 175 Ų | 175 | 99.3 Ų | 99.3 | 94% | 0.936 | 54% | 0.544 | S | S | * | . | trans | -64.4 | 21.6 | 163.4 | -56.8 | -51 | 0 | 0 | 0 | 112.3 | E46 | D44-E46 PolarHBondContact O-N 3.49Š| ||
| 45 | L | 55.8 | Low | 63.4 | Low | 113 Ų | 113 | 106.5 Ų | 106.5 | 59% | 0.592 | 57% | 0.565 | S | S | * | * | trans | -70.6 | 87.9 | 164.3 | -73.6 | 167.3 | 0 | 0 | 0 | 105.8 | S43 L47 | S43-L45 PolarHBondContact O-N 3.18Å; L45-L47 PolarHBondContact O-N 3.46Å | ||
| 46 | E | 54.8 | Low | 61.8 | Low | 185 Ų | 185 | 104.8 Ų | 104.8 | 86% | 0.864 | 56% | 0.56 | S | S | * | * | trans | -55 | 90.6 | 154.7 | -78.9 | -166.9 | 158.6 | 0 | 0 | 107 | D44 S48 | D44-E46 PolarHBondContact O-N 3.49Å; E46-S48 PolarHBondContact O-N 3.48Å | ||
| 47 | L | 55.3 | Low | 60.1 | Low | 105 Ų | 105 | 108 Ų | 108 | 55% | 0.55 | 57% | 0.574 | S | S | . | * | trans | -67.3 | 80.4 | 167.1 | -97.4 | 149 | 0 | 0 | 0 | 106.1 | L45 S49 L52 | L45-L47 PolarHBondContact O-N 3.46Å; L47-S49 PolarHBondContact O-N 3.42Å; L47-L52 HydrophobicContact CD2-CD1 4.34Å | ||
| 48 | S | 47.7 | Very low | 58 | Low | 118 Ų | 118 | 113.8 Ų | 113.8 | 83% | 0.825 | 62% | 0.62 | S | S | * | * | trans | -67.6 | 59.8 | 168.4 | 170.9 | 0 | 0 | 0 | 0 | 109.4 | E46 | E46-S48 PolarHBondContact O-N 3.48Š| ||
| 49 | S | 49.7 | Very low | 56.7 | Low | 36 Ų | 36 | 111.4 Ų | 111.4 | 25% | 0.252 | 62% | 0.62 | S | S | . | * | trans | -112.7 | 111.9 | 164.7 | 169.5 | 0 | 0 | 0 | 0 | 106.3 | L47 W51 L52 | L47-S49 PolarHBondContact O-N 3.42Å; S49-W51 PolarHBondContact O-N 3.11Å; S49-W51 PolarHBondContact OG-N 3.43Å; S49-L52 PolarHBondContact O-N 3.35Å; S49-L52 VanDerWaalsContact O-N 3.09Å | ||
| 50 | P | 50.6 | Low | 55.3 | Low | 120 Ų | 120 | 113.3 Ų | 113.3 | 78% | 0.779 | 63% | 0.632 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -57 | -12.1 | 176.8 | -22.6 | 32.2 | 0 | 0 | 0 | 113.7 | ||
| 51 | W | 49.7 | Very low | 53.9 | Low | 218 Ų | 218 | 117.1 Ų | 117.1 | 83% | 0.826 | 65% | 0.65 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -100.4 | -6.5 | -176.5 | -60.7 | 102.2 | 0 | 0 | 0 | 114.4 | S49 | S49-W51 PolarHBondContact O-N 3.11Å; S49-W51 PolarHBondContact OG-N 3.43Å |
| 52 | L | 51.3 | Low | 52.5 | Low | 100 Ų | 100 | 118.8 Ų | 118.8 | 52% | 0.524 | 67% | 0.666 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -112 | -12.9 | 177.5 | -76.7 | 165.7 | 0 | 0 | 0 | 113.6 | L47 S49 G54 | L47-L52 HydrophobicContact CD2-CD1 4.34Å; S49-L52 PolarHBondContact O-N 3.35Å; S49-L52 VanDerWaalsContact O-N 3.09Å; L52-G54 PolarHBondContact O-N 3.4Å |
| 53 | G | 46.1 | Very low | 51.4 | Low | 77 Ų | 77 | 119.5 Ų | 119.5 | 79% | 0.794 | 67% | 0.672 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -70.8 | 24.4 | -177.2 | 0 | 0 | 0 | 0 | 0 | 116.8 | ||
| 54 | G | 48.9 | Very low | 50.9 | Low | 59 Ų | 59 | 125.2 Ų | 125.2 | 61% | 0.608 | 70% | 0.701 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -149.5 | 7.8 | -176 | 0 | 0 | 0 | 0 | 0 | 117.2 | L52 | L52-G54 PolarHBondContact O-N 3.4Š|
| 55 | R | 50.1 | Low | 50.3 | Low | 187 Ų | 187 | 121.6 Ų | 121.6 | 71% | 0.706 | 68% | 0.684 | S | S | * | * | trans | -136.6 | 26.5 | -173.4 | -72.3 | -164.4 | -63.8 | -122.3 | -5.4 | 116.1 | F57 | R55-F57 VanDerWaalsContact C-N 3.27Š| ||
| 56 | C | 54.9 | Low | 49.9 | Very low | 48 Ų | 48 | 122.3 Ų | 122.3 | 32% | 0.324 | 69% | 0.691 | S | S | . | * | S | Bend | trans | -77.7 | -16.5 | 170.2 | -74.1 | 0 | 0 | 0 | 0 | 113.1 | F41 | F41-C56 HydrophobicContact CE1-CB 4.31Å; F41-C56 HydrophobicContact CE2-CB 4.5Å; F41-C56 HydrophobicContact CZ-CB 3.73Å |
| 57 | F | 48.5 | Very low | 49.4 | Very low | 164 Ų | 164 | 117.1 Ų | 117.1 | 72% | 0.719 | 68% | 0.676 | S | S | * | * | trans | -150.5 | 104.9 | 166.5 | -78.8 | -80.9 | 0 | 0 | 0 | 109.4 | F41 R55 | F41-F57 HydrophobicContact CE1-CD2 4.37Å; F41-F57 AromaticContact CE1-CE2 3.98Å; F41-F57 HydrophobicContact CE1-CE2 3.98Å; F41-F57 HydrophobicContact CE2-CE2 4.07Å; F41-F57 AromaticContact CZ-CD2 3.82Å; F41-F57 HydrophobicContact CZ-CD2 3.82Å; F41-F57 AromaticContact CZ-CE2 3.33Å; F41-F57 HydrophobicContact CZ-CE2 3.33Å; F41-F57 HydrophobicContact CZ-CZ 4.34Å; R55-F57 VanDerWaalsContact C-N 3.27Å | ||
| 58 | S | 40.5 | Very low | 48.9 | Very low | 173 Ų | 173 | 118.2 Ų | 118.2 | 100% | 1.21 | 69% | 0.688 | S | S | * | * | trans | -111.5 | 0 | 145.6 | -55.3 | 0 | 0 | 0 | 0 | 106.4 |
Retrieved 58 of 58 residues in 14.4 ms
(Link to these results)