| 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 | 68.9 | Low | 78.8 | Confident | 147 Ų | 147 | 119.2 Ų | 119.2 | 72% | 0.724 | 58% | 0.582 | S | S | * | * | 0 | 133.9 | 0 | 180 | 167.2 | 158.3 | 0 | 0 | 107.7 | W8 R9 L10 | M1-W8 HydrophobicContact CE-CB 4.15Å; M1-W8 HydrophobicContact CE-CD2 3.64Å; M1-W8 HydrophobicContact CE-CE3 3.13Å; M1-W8 HydrophobicContact CE-CG 4.1Å; M1-W8 HydrophobicContact CE-CZ3 3.67Å; M1-W8 HydrophobicContact CG-CE3 4.16Å; M1-W8 HydrophobicContact SD-CE3 4.43Å; M1-R9 CarbonylContact C-O 3.55Å; M1-R9 VanDerWaalsContact CA-O 3.24Å; M1-R9 WeakPolarHBondContact CA-O 2.97Å; M1-L10 HydrophobicContact CB-CD1 4.2Å | |||
| 2 | Y | 80.9 | Confident | 77.9 | Confident | 98 Ų | 98 | 121.6 Ų | 121.6 | 38% | 0.384 | 60% | 0.598 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -143.8 | 157.7 | 178.8 | 60.4 | -94.7 | 0 | 0 | 0 | 110.3 | R4 R9 K11 | Y2-R4 HydrophobicContact CD2-CB 4.03Å; Y2-R4 HydrophobicContact CE2-CB 3.83Å; Y2-R9 HydrophobicContact CE2-CB 4.1Å; Y2-R9 PolarHBondContact N-O 3.48Å; Y2-R9 PolarHBondContact O-N 3.03Å; Y2-K11 HydrophobicContact CD1-CB 4.44Å; Y2-K11 HydrophobicContact CE1-CB 3.71Å; Y2-K11 HydrophobicContact CE1-CD 4.18Å |
| 3 | I | 78.1 | Confident | 77.1 | Confident | 103 Ų | 103 | 119.2 Ų | 119.2 | 53% | 0.528 | 60% | 0.601 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -91.8 | 128.4 | 175.1 | -59.7 | 172.8 | 0 | 0 | 0 | 108 | S7 W8 | I3-S7 WeakPolarHBondContact CA-O 2.95Å; I3-W8 HydrophobicContact CD1-CE3 4.22Å; I3-W8 HydrophobicContact CD1-CH2 3.73Å; I3-W8 HydrophobicContact CD1-CZ2 3.98Å; I3-W8 HydrophobicContact CD1-CZ3 3.85Å; I3-W8 HydrophobicContact CG1-CD2 4.02Å; I3-W8 HydrophobicContact CG1-CE3 3.62Å; I3-W8 HydrophobicContact CG1-CH2 4.07Å; I3-W8 HydrophobicContact CG1-CZ2 4.37Å; I3-W8 HydrophobicContact CG1-CZ3 3.67Å |
| 4 | R | 81.2 | Confident | 75.6 | Confident | 141 Ų | 141 | 115.9 Ų | 115.9 | 53% | 0.532 | 61% | 0.612 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -139 | 126.8 | 170.2 | -170.9 | 179.6 | 176.4 | 177.4 | 2.6 | 108.1 | Y2 G6 S7 | Y2-R4 HydrophobicContact CD2-CB 4.03Å; Y2-R4 HydrophobicContact CE2-CB 3.83Å; R4-G6 PolarHBondContact O-N 3.37Å; R4-S7 PolarHBondContact N-O 3.02Å; R4-S7 PolarHBondContact O-N 2.99Å; R4-S7 VanDerWaalsContact O-N 3.09Å; R4-S7 PolarHBondContact O-OG 3.48Å |
| 5 | D | 87.1 | Confident | 74.4 | Confident | 136 Ų | 136 | 117.2 Ų | 117.2 | 73% | 0.727 | 62% | 0.618 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 55.9 | 43.4 | -179.9 | -48.3 | -42.3 | 0 | 0 | 0 | 113.8 | S7 | D5-S7 PolarHBondContact O-N 2.49Š|
| 6 | G | 87.6 | Confident | 73.2 | Confident | 78 Ų | 78 | 115.9 Ų | 115.9 | 80% | 0.804 | 62% | 0.622 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 69 | 3.2 | -178.5 | 0 | 0 | 0 | 0 | 0 | 115 | R4 | R4-G6 PolarHBondContact O-N 3.37Š|
| 7 | S | 80.9 | Confident | 72.1 | Confident | 46 Ų | 46 | 116.4 Ų | 116.4 | 32% | 0.322 | 62% | 0.623 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -110.4 | 140.8 | 179.4 | 72.3 | 0 | 0 | 0 | 0 | 111.8 | I3 R4 D5 | I3-S7 WeakPolarHBondContact CA-O 2.95Å; R4-S7 PolarHBondContact N-O 3.02Å; R4-S7 PolarHBondContact O-N 2.99Å; R4-S7 VanDerWaalsContact O-N 3.09Å; R4-S7 PolarHBondContact O-OG 3.48Å; D5-S7 PolarHBondContact O-N 2.49Å |
| 8 | W | 83.1 | Confident | 71 | Confident | 179 Ų | 179 | 116.1 Ų | 116.1 | 68% | 0.678 | 62% | 0.622 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -79.4 | 123.2 | 173.5 | -66.1 | 96 | 0 | 0 | 0 | 109.9 | M1 I3 | M1-W8 HydrophobicContact CE-CB 4.15Å; M1-W8 HydrophobicContact CE-CD2 3.64Å; M1-W8 HydrophobicContact CE-CE3 3.13Å; M1-W8 HydrophobicContact CE-CG 4.1Å; M1-W8 HydrophobicContact CE-CZ3 3.67Å; M1-W8 HydrophobicContact CG-CE3 4.16Å; M1-W8 HydrophobicContact SD-CE3 4.43Å; I3-W8 HydrophobicContact CD1-CE3 4.22Å; I3-W8 HydrophobicContact CD1-CH2 3.73Å; I3-W8 HydrophobicContact CD1-CZ2 3.98Å; I3-W8 HydrophobicContact CD1-CZ3 3.85Å; I3-W8 HydrophobicContact CG1-CD2 4.02Å; I3-W8 HydrophobicContact CG1-CE3 3.62Å; I3-W8 HydrophobicContact CG1-CH2 4.07Å; I3-W8 HydrophobicContact CG1-CZ2 4.37Å; I3-W8 HydrophobicContact CG1-CZ3 3.67Å |
| 9 | R | 72.9 | Confident | 70.4 | Confident | 121 Ų | 121 | 117.7 Ų | 117.7 | 46% | 0.457 | 63% | 0.631 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -117 | 130.6 | 176 | -66.2 | -171 | 176 | -140.8 | 2.5 | 111.3 | M1 Y2 | M1-R9 CarbonylContact C-O 3.55Å; M1-R9 VanDerWaalsContact CA-O 3.24Å; M1-R9 WeakPolarHBondContact CA-O 2.97Å; Y2-R9 HydrophobicContact CE2-CB 4.1Å; Y2-R9 PolarHBondContact N-O 3.48Å; Y2-R9 PolarHBondContact O-N 3.03Å |
| 10 | L | 74.3 | Confident | 69.5 | Low | 123 Ų | 123 | 116.6 Ų | 116.6 | 64% | 0.644 | 63% | 0.628 | S | S | * | * | trans | -95.8 | 104.2 | 170.6 | -169.5 | 75.2 | 0 | 0 | 0 | 108.5 | M1 L12 | M1-L10 HydrophobicContact CB-CD1 4.2Å; L10-L12 HydrophobicContact CD2-CD1 4.41Å; L10-L12 HydrophobicContact CD2-CD2 4.06Å; L10-L12 HydrophobicContact CD2-CG 4.1Å; L10-L12 HydrophobicContact CG-CD2 4.35Å; L10-L12 HydrophobicContact CG-CG 4.32Å; L10-L12 PolarHBondContact O-N 3.48Å | ||
| 11 | K | 71.9 | Confident | 68.8 | Low | 139 Ų | 139 | 112.4 Ų | 112.4 | 60% | 0.604 | 61% | 0.605 | S | S | * | * | trans | -87.6 | 103 | 168.7 | -178.2 | 176.7 | -178.7 | -178.3 | 0 | 108.3 | Y2 S13 | Y2-K11 HydrophobicContact CD1-CB 4.44Å; Y2-K11 HydrophobicContact CE1-CB 3.71Å; Y2-K11 HydrophobicContact CE1-CD 4.18Å; K11-S13 PolarHBondContact O-N 3.36Å | ||
| 12 | L | 67.7 | Low | 68.1 | Low | 148 Ų | 148 | 112.7 Ų | 112.7 | 78% | 0.775 | 60% | 0.603 | S | S | * | * | trans | -79.8 | 93.6 | 164.1 | -64.5 | 171.2 | 0 | 0 | 0 | 106.3 | L10 G14 | L10-L12 HydrophobicContact CD2-CD1 4.41Å; L10-L12 HydrophobicContact CD2-CD2 4.06Å; L10-L12 HydrophobicContact CD2-CG 4.1Å; L10-L12 HydrophobicContact CG-CD2 4.35Å; L10-L12 HydrophobicContact CG-CG 4.32Å; L10-L12 PolarHBondContact O-N 3.48Å; L12-G14 PolarHBondContact O-N 3.23Å | ||
| 13 | S | 67.7 | Low | 67.3 | Low | 91 Ų | 91 | 117.5 Ų | 117.5 | 64% | 0.636 | 62% | 0.62 | S | S | * | * | trans | -67.5 | 122.7 | 170.6 | -62.9 | 0 | 0 | 0 | 0 | 107.6 | K11 L15 | K11-S13 PolarHBondContact O-N 3.36Å; S13-L15 PolarHBondContact O-N 3.07Å | ||
| 14 | G | 56.8 | Low | 66.6 | Low | 73 Ų | 73 | 117 Ų | 117 | 75% | 0.753 | 62% | 0.618 | S | S | * | * | trans | -49.3 | 124.7 | -171.2 | 0 | 0 | 0 | 0 | 0 | 114.2 | L12 S16 | L12-G14 PolarHBondContact O-N 3.23Å; G14-S16 VanDerWaalsContact C-N 3.32Å; G14-S16 PolarHBondContact O-N 3.23Å | ||
| 15 | L | 56.5 | Low | 65.8 | Low | 135 Ų | 135 | 112.3 Ų | 112.3 | 71% | 0.707 | 60% | 0.604 | S | S | * | * | trans | -66.8 | 92.6 | 159.3 | -84.5 | 143.4 | 0 | 0 | 0 | 107.5 | S13 L17 | S13-L15 PolarHBondContact O-N 3.07Å; L15-L17 PolarHBondContact O-N 3.33Å | ||
| 16 | S | 55.8 | Low | 65.2 | Low | 96 Ų | 96 | 110 Ų | 110 | 67% | 0.671 | 60% | 0.595 | S | S | * | * | trans | -88.8 | 97.7 | 172.2 | 170.6 | 0 | 0 | 0 | 0 | 108 | G14 N18 | G14-S16 VanDerWaalsContact C-N 3.32Å; G14-S16 PolarHBondContact O-N 3.23Å; S16-N18 VanDerWaalsContact C-N 3.28Å; S16-N18 PolarHBondContact O-N 3.05Å | ||
| 17 | L | 53.9 | Low | 64.9 | Low | 124 Ų | 124 | 112.3 Ų | 112.3 | 65% | 0.649 | 58% | 0.583 | S | S | * | * | trans | -56 | 80.1 | 177.8 | -61.6 | 171 | 0 | 0 | 0 | 112.2 | L15 D21 N25 | L15-L17 PolarHBondContact O-N 3.33Å; L17-D21 VanDerWaalsContact CA-OD2 3.23Å; L17-D21 WeakPolarHBondContact CA-OD2 3.48Å; L17-D21 HydrophobicContact CB-CB 4.48Å; L17-D21 HydrophobicContact CD2-CB 3.98Å; L17-N25 WeakPolarHBondContact CD2-ND2 3.36Å | ||
| 18 | N | 53.3 | Low | 64.8 | Low | 111 Ų | 111 | 114.9 Ų | 114.9 | 59% | 0.594 | 59% | 0.593 | S | S | * | * | trans | -85.1 | 148.8 | 169.1 | -159.3 | 11.2 | 0 | 0 | 0 | 107.9 | S16 T20 D21 | S16-N18 VanDerWaalsContact C-N 3.28Å; S16-N18 PolarHBondContact O-N 3.05Å; N18-T20 CarbonylContact O-C 3.53Å; N18-T20 PolarHBondContact O-N 3.46Å; N18-D21 PolarHBondContact N-OD2 3.25Å; N18-D21 WeakPolarHBondContact O-CA 3.35Å; N18-D21 WeakPolarHBondContact O-CB 3.27Å; N18-D21 PolarHBondContact O-N 3.49Å | ||
| 19 | D | 58.5 | Low | 64.8 | Low | 148 Ų | 148 | 111.5 Ų | 111.5 | 79% | 0.791 | 59% | 0.587 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -60 | -9.2 | -165.9 | -83.1 | -46.7 | 0 | 0 | 0 | 116.7 | ||
| 20 | T | 54 | Low | 65.4 | Low | 94 Ų | 94 | 112 Ų | 112 | 58% | 0.577 | 59% | 0.59 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -69.7 | -32.5 | 163 | -3.8 | 0 | 0 | 0 | 0 | 113.6 | N18 K22 R23 D24 | N18-T20 CarbonylContact O-C 3.53Å; N18-T20 PolarHBondContact O-N 3.46Å; T20-K22 PolarHBondContact O-N 2.71Å; T20-R23 WeakPolarHBondContact O-CB 3.43Å; T20-R23 PolarHBondContact O-N 3.33Å; T20-D24 PolarHBondContact O-N 3Å |
| 21 | D | 54.8 | Low | 66 | Low | 29 Ų | 29 | 110.1 Ų | 110.1 | 16% | 0.155 | 58% | 0.579 | C | S | . | * | H | α-helix | trans | -60.1 | -21.7 | 171.6 | -78.4 | -70.4 | 0 | 0 | 0 | 112.9 | L17 N18 R23 D24 N25 | L17-D21 VanDerWaalsContact CA-OD2 3.23Å; L17-D21 WeakPolarHBondContact CA-OD2 3.48Å; L17-D21 HydrophobicContact CB-CB 4.48Å; L17-D21 HydrophobicContact CD2-CB 3.98Å; N18-D21 PolarHBondContact N-OD2 3.25Å; N18-D21 WeakPolarHBondContact O-CA 3.35Å; N18-D21 WeakPolarHBondContact O-CB 3.27Å; N18-D21 PolarHBondContact O-N 3.49Å; D21-R23 PolarHBondContact O-N 3.24Å; D21-D24 PolarHBondContact O-N 3.34Å; D21-N25 WeakPolarHBondContact O-CB 3.39Å; D21-N25 PolarHBondContact O-N 3.4Å; D21-N25 PolarHBondContact O-ND2 3.01Å |
| 22 | K | 53.3 | Low | 66.7 | Low | 154 Ų | 154 | 107.3 Ų | 107.3 | 67% | 0.67 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -62.8 | -35.1 | 174.3 | -157.5 | 173.1 | -173.1 | 175.6 | 0 | 110.4 | T20 T26 | T20-K22 PolarHBondContact O-N 2.71Å; K22-T26 VanDerWaalsContact O-CB 3.3Å; K22-T26 WeakPolarHBondContact O-CB 3.41Å; K22-T26 PolarHBondContact O-N 3.44Å; K22-T26 VanDerWaalsContact O-N 3.1Å; K22-T26 PolarHBondContact O-OG1 2.93Å |
| 23 | R | 63.4 | Low | 67.6 | Low | 199 Ų | 199 | 103.7 Ų | 103.7 | 75% | 0.751 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -75.1 | -42.6 | 177.1 | -146.6 | -176.2 | -61.7 | -178.4 | 2.5 | 111.4 | T20 D21 T26 F27 | T20-R23 WeakPolarHBondContact O-CB 3.43Å; T20-R23 PolarHBondContact O-N 3.33Å; D21-R23 PolarHBondContact O-N 3.24Å; R23-T26 PolarHBondContact O-N 3.39Å; R23-F27 PolarHBondContact O-N 3.24Å |
| 24 | D | 63.4 | Low | 68.5 | Low | 91 Ų | 91 | 103.5 Ų | 103.5 | 49% | 0.487 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -71.6 | -37.5 | -179.5 | -65.5 | -25.3 | 0 | 0 | 0 | 112.5 | T20 D21 F27 L28 | T20-D24 PolarHBondContact O-N 3Å; D21-D24 PolarHBondContact O-N 3.34Å; D24-F27 PolarHBondContact O-N 3.08Å; D24-L28 WeakPolarHBondContact O-CG 2.98Å; D24-L28 PolarHBondContact O-N 3.47Å |
| 25 | N | 66.1 | Low | 69.9 | Low | 43 Ų | 43 | 102.6 Ų | 102.6 | 23% | 0.23 | 54% | 0.537 | C | S | . | . | H | α-helix | trans | -67.5 | -38 | 170.7 | -68.8 | -47.3 | 0 | 0 | 0 | 112 | L17 D21 F27 L28 I29 | L17-N25 WeakPolarHBondContact CD2-ND2 3.36Å; D21-N25 WeakPolarHBondContact O-CB 3.39Å; D21-N25 PolarHBondContact O-N 3.4Å; D21-N25 PolarHBondContact O-ND2 3.01Å; N25-F27 VanDerWaalsContact C-N 3.26Å; N25-F27 PolarHBondContact O-N 3.45Å; N25-L28 PolarHBondContact O-N 3.06Å; N25-I29 VanDerWaalsContact O-CB 3.32Å; N25-I29 WeakPolarHBondContact O-CB 3.35Å; N25-I29 WeakPolarHBondContact O-CD1 3.46Å; N25-I29 WeakPolarHBondContact O-CG1 3.33Å; N25-I29 PolarHBondContact O-N 2.97Å |
| 26 | T | 73.6 | Confident | 71.3 | Confident | 88 Ų | 88 | 102.4 Ų | 102.4 | 54% | 0.54 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -61.6 | -40.8 | 174.4 | -59.4 | 0 | 0 | 0 | 0 | 110.4 | K22 R23 Y30 | K22-T26 VanDerWaalsContact O-CB 3.3Å; K22-T26 WeakPolarHBondContact O-CB 3.41Å; K22-T26 PolarHBondContact O-N 3.44Å; K22-T26 VanDerWaalsContact O-N 3.1Å; K22-T26 PolarHBondContact O-OG1 2.93Å; R23-T26 PolarHBondContact O-N 3.39Å; T26-Y30 VanDerWaalsContact O-CB 3.23Å; T26-Y30 WeakPolarHBondContact O-CB 3.23Å; T26-Y30 PolarHBondContact O-N 3.29Å |
| 27 | F | 80.9 | Confident | 72.8 | Confident | 126 Ų | 126 | 101.3 Ų | 101.3 | 55% | 0.553 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -65.5 | -44.5 | 175.8 | -178.5 | -105.8 | 0 | 0 | 0 | 112.5 | R23 D24 N25 Y30 I31 | R23-F27 PolarHBondContact O-N 3.24Å; D24-F27 PolarHBondContact O-N 3.08Å; N25-F27 VanDerWaalsContact C-N 3.26Å; N25-F27 PolarHBondContact O-N 3.45Å; F27-Y30 PolarHBondContact O-N 2.89Å; F27-I31 HydrophobicContact CD1-CD1 3.83Å; F27-I31 HydrophobicContact CD2-CD1 4.44Å; F27-I31 HydrophobicContact CE1-CD1 3.26Å; F27-I31 HydrophobicContact CE1-CG1 4.4Å; F27-I31 HydrophobicContact CE2-CD1 3.94Å; F27-I31 HydrophobicContact CE2-CG1 4.44Å; F27-I31 HydrophobicContact CG-CD1 4.4Å; F27-I31 HydrophobicContact CZ-CD1 3.34Å; F27-I31 HydrophobicContact CZ-CG1 4.3Å; F27-I31 WeakPolarHBondContact O-CG1 3.39Å; F27-I31 PolarHBondContact O-N 3.25Å |
| 28 | L | 79.1 | Confident | 74.4 | Confident | 100 Ų | 100 | 99.6 Ų | 99.6 | 52% | 0.524 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -63.6 | -42.1 | 176.2 | -74.3 | 171.1 | 0 | 0 | 0 | 112.4 | D24 N25 I31 S32 | D24-L28 WeakPolarHBondContact O-CG 2.98Å; D24-L28 PolarHBondContact O-N 3.47Å; N25-L28 PolarHBondContact O-N 3.06Å; L28-I31 PolarHBondContact O-N 2.98Å; L28-S32 VanDerWaalsContact O-CB 3.31Å; L28-S32 WeakPolarHBondContact O-CB 3.14Å; L28-S32 PolarHBondContact O-N 3.42Å |
| 29 | I | 83.6 | Confident | 75.8 | Confident | 108 Ų | 108 | 98.5 Ų | 98.5 | 55% | 0.554 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -62.9 | -44.3 | 174.9 | -68.9 | 164.5 | 0 | 0 | 0 | 109.8 | N25 S32 T33 | N25-I29 VanDerWaalsContact O-CB 3.32Å; N25-I29 WeakPolarHBondContact O-CB 3.35Å; N25-I29 WeakPolarHBondContact O-CD1 3.46Å; N25-I29 WeakPolarHBondContact O-CG1 3.33Å; N25-I29 PolarHBondContact O-N 2.97Å; I29-S32 PolarHBondContact O-N 3.13Å; I29-T33 HydrophobicContact CG2-CG2 4.39Å; I29-T33 WeakPolarHBondContact O-CG2 3.32Å; I29-T33 PolarHBondContact O-N 3.05Å; I29-T33 PolarHBondContact O-OG1 2.93Å; I29-T33 VanDerWaalsContact O-OG1 3.13Å |
| 30 | Y | 85.7 | Confident | 76.9 | Confident | 133 Ų | 133 | 96.3 Ų | 96.3 | 52% | 0.522 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -61.8 | -44.3 | 178.4 | -176.8 | -100.4 | 0 | 0 | 0 | 112.7 | T26 F27 T33 M34 | T26-Y30 VanDerWaalsContact O-CB 3.23Å; T26-Y30 WeakPolarHBondContact O-CB 3.23Å; T26-Y30 PolarHBondContact O-N 3.29Å; F27-Y30 PolarHBondContact O-N 2.89Å; Y30-T33 PolarHBondContact O-OG1 2.88Å; Y30-M34 HydrophobicContact CD1-SD 3.93Å; Y30-M34 HydrophobicContact CE1-CE 3.55Å; Y30-M34 HydrophobicContact CE1-CG 4.36Å; Y30-M34 HydrophobicContact CE1-SD 3.35Å; Y30-M34 WeakPolarHBondContact CE1-SD 3.49Å; Y30-M34 HydrophobicContact CE2-CE 4.05Å; Y30-M34 WeakPolarHBondContact O-CB 3.31Å; Y30-M34 WeakPolarHBondContact O-CG 3.47Å; Y30-M34 PolarHBondContact O-N 2.89Å; Y30-M34 WeakPolarHBondContact OH-CE 3.18Å |
| 31 | I | 86.9 | Confident | 78.1 | Confident | 82 Ų | 82 | 99 Ų | 99 | 42% | 0.421 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -64.3 | -42.6 | 174.8 | -71.4 | 175.8 | 0 | 0 | 0 | 110.9 | F27 L28 M34 A35 | F27-I31 HydrophobicContact CD1-CD1 3.83Å; F27-I31 HydrophobicContact CD2-CD1 4.44Å; F27-I31 HydrophobicContact CE1-CD1 3.26Å; F27-I31 HydrophobicContact CE1-CG1 4.4Å; F27-I31 HydrophobicContact CE2-CD1 3.94Å; F27-I31 HydrophobicContact CE2-CG1 4.44Å; F27-I31 HydrophobicContact CG-CD1 4.4Å; F27-I31 HydrophobicContact CZ-CD1 3.34Å; F27-I31 HydrophobicContact CZ-CG1 4.3Å; F27-I31 WeakPolarHBondContact O-CG1 3.39Å; F27-I31 PolarHBondContact O-N 3.25Å; L28-I31 PolarHBondContact O-N 2.98Å; I31-M34 PolarHBondContact O-N 3.34Å; I31-A35 WeakPolarHBondContact O-CB 3.4Å; I31-A35 PolarHBondContact O-N 2.61Å |
| 32 | S | 85.8 | Confident | 79.3 | Confident | 81 Ų | 81 | 102.8 Ų | 102.8 | 57% | 0.566 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -63.6 | -42.6 | -179.9 | -178.6 | 0 | 0 | 0 | 0 | 112.3 | L28 I29 A35 F36 | L28-S32 VanDerWaalsContact O-CB 3.31Å; L28-S32 WeakPolarHBondContact O-CB 3.14Å; L28-S32 PolarHBondContact O-N 3.42Å; I29-S32 PolarHBondContact O-N 3.13Å; S32-A35 PolarHBondContact O-N 2.94Å; S32-F36 PolarHBondContact O-N 3.1Å; S32-F36 VanDerWaalsContact O-N 3.08Å |
| 33 | T | 87.4 | Confident | 80 | Confident | 71 Ų | 71 | 100 Ų | 100 | 44% | 0.436 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -67.3 | -42.6 | 176.8 | 53 | 0 | 0 | 0 | 0 | 111.6 | I29 Y30 A35 F36 T37 | I29-T33 HydrophobicContact CG2-CG2 4.39Å; I29-T33 WeakPolarHBondContact O-CG2 3.32Å; I29-T33 PolarHBondContact O-N 3.05Å; I29-T33 PolarHBondContact O-OG1 2.93Å; I29-T33 VanDerWaalsContact O-OG1 3.13Å; Y30-T33 PolarHBondContact O-OG1 2.88Å; T33-A35 PolarHBondContact O-N 3.48Å; T33-F36 PolarHBondContact O-N 2.84Å; T33-T37 WeakPolarHBondContact O-CG2 3.37Å; T33-T37 PolarHBondContact O-N 3.38Å; T33-T37 PolarHBondContact O-OG1 3.33Å |
| 34 | M | 86.6 | Confident | 79.8 | Confident | 87 Ų | 87 | 95.6 Ų | 95.6 | 43% | 0.429 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -57.6 | -47.7 | 174.3 | -77 | -170.5 | 147.6 | 0 | 0 | 112 | Y30 I31 F36 T37 V38 | Y30-M34 HydrophobicContact CD1-SD 3.93Å; Y30-M34 HydrophobicContact CE1-CE 3.55Å; Y30-M34 HydrophobicContact CE1-CG 4.36Å; Y30-M34 HydrophobicContact CE1-SD 3.35Å; Y30-M34 WeakPolarHBondContact CE1-SD 3.49Å; Y30-M34 HydrophobicContact CE2-CE 4.05Å; Y30-M34 WeakPolarHBondContact O-CB 3.31Å; Y30-M34 WeakPolarHBondContact O-CG 3.47Å; Y30-M34 PolarHBondContact O-N 2.89Å; Y30-M34 WeakPolarHBondContact OH-CE 3.18Å; I31-M34 PolarHBondContact O-N 3.34Å; M34-F36 VanDerWaalsContact C-N 3.33Å; M34-F36 PolarHBondContact O-N 3.31Å; M34-T37 WeakPolarHBondContact CA-OG1 3.48Å; M34-T37 PolarHBondContact O-N 3.43Å; M34-T37 PolarHBondContact O-OG1 3.07Å; M34-V38 WeakPolarHBondContact O-CG2 3.3Å; M34-V38 PolarHBondContact O-N 2.95Å |
| 35 | A | 85.1 | Confident | 79.6 | Confident | 55 Ų | 55 | 100.4 Ų | 100.4 | 46% | 0.455 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -59.4 | -43.2 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | I31 S32 T33 V38 V39 | I31-A35 WeakPolarHBondContact O-CB 3.4Å; I31-A35 PolarHBondContact O-N 2.61Å; S32-A35 PolarHBondContact O-N 2.94Å; T33-A35 PolarHBondContact O-N 3.48Å; A35-V38 PolarHBondContact O-N 3.23Å; A35-V39 WeakPolarHBondContact O-CG2 2.86Å; A35-V39 PolarHBondContact O-N 2.64Å |
| 36 | F | 86.8 | Confident | 79.1 | Confident | 131 Ų | 131 | 103.2 Ų | 103.2 | 58% | 0.575 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -62.9 | -43.1 | 176.7 | -176.2 | -103.8 | 0 | 0 | 0 | 112.4 | S32 T33 M34 V38 V39 L40 | S32-F36 PolarHBondContact O-N 3.1Å; S32-F36 VanDerWaalsContact O-N 3.08Å; T33-F36 PolarHBondContact O-N 2.84Å; M34-F36 VanDerWaalsContact C-N 3.33Å; M34-F36 PolarHBondContact O-N 3.31Å; F36-V38 VanDerWaalsContact C-N 3.33Å; F36-V38 PolarHBondContact O-N 2.8Å; F36-V39 PolarHBondContact O-N 3.31Å; F36-L40 HydrophobicContact CD1-CD1 3.84Å; F36-L40 HydrophobicContact CD1-CG 4.38Å; F36-L40 HydrophobicContact CE1-CD1 3.32Å; F36-L40 HydrophobicContact CE1-CG 4.01Å; F36-L40 HydrophobicContact CZ-CD1 3.83Å; F36-L40 HydrophobicContact CZ-CD2 4.32Å; F36-L40 HydrophobicContact CZ-CG 4.14Å; F36-L40 PolarHBondContact O-N 3.47Å |
| 37 | T | 86.4 | Confident | 78 | Confident | 73 Ų | 73 | 106.6 Ų | 106.6 | 45% | 0.448 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -63 | -38.5 | 176.6 | 56.8 | 0 | 0 | 0 | 0 | 112.5 | T33 M34 L40 L41 | T33-T37 WeakPolarHBondContact O-CG2 3.37Å; T33-T37 PolarHBondContact O-N 3.38Å; T33-T37 PolarHBondContact O-OG1 3.33Å; M34-T37 WeakPolarHBondContact CA-OG1 3.48Å; M34-T37 PolarHBondContact O-N 3.43Å; M34-T37 PolarHBondContact O-OG1 3.07Å; T37-L40 PolarHBondContact O-N 3.47Å; T37-L41 WeakPolarHBondContact O-CG 3.1Å; T37-L41 PolarHBondContact O-N 2.76Å |
| 38 | V | 86.9 | Confident | 76.5 | Confident | 87 Ų | 87 | 107.8 Ų | 107.8 | 53% | 0.527 | 60% | 0.596 | S | S | . | * | H | α-helix | trans | -64.1 | -43 | 175.4 | 171.9 | 0 | 0 | 0 | 0 | 110.7 | M34 A35 F36 L40 L41 V42 | M34-V38 WeakPolarHBondContact O-CG2 3.3Å; M34-V38 PolarHBondContact O-N 2.95Å; A35-V38 PolarHBondContact O-N 3.23Å; F36-V38 VanDerWaalsContact C-N 3.33Å; F36-V38 PolarHBondContact O-N 2.8Å; V38-L40 PolarHBondContact O-N 2.78Å; V38-L41 PolarHBondContact O-N 2.73Å; V38-V42 HydrophobicContact CG1-CG2 4.47Å; V38-V42 VanDerWaalsContact O-CG2 3.27Å; V38-V42 WeakPolarHBondContact O-CG2 3.36Å; V38-V42 PolarHBondContact O-N 3.06Å; V38-V42 VanDerWaalsContact O-N 3.07Å |
| 39 | V | 83.1 | Confident | 74.9 | Confident | 89 Ų | 89 | 110.7 Ų | 110.7 | 54% | 0.539 | 61% | 0.609 | S | S | . | * | H | α-helix | trans | -61.7 | -44.4 | 177 | 172.1 | 0 | 0 | 0 | 0 | 111.4 | A35 F36 L41 V42 V43 | A35-V39 WeakPolarHBondContact O-CG2 2.86Å; A35-V39 PolarHBondContact O-N 2.64Å; F36-V39 PolarHBondContact O-N 3.31Å; V39-L41 VanDerWaalsContact C-N 3.34Å; V39-L41 PolarHBondContact O-N 2.8Å; V39-V42 PolarHBondContact O-N 3.36Å; V39-V43 WeakPolarHBondContact O-CG2 3.23Å; V39-V43 PolarHBondContact O-N 3.29Å |
| 40 | L | 81.2 | Confident | 73.4 | Confident | 102 Ų | 102 | 114.4 Ų | 114.4 | 53% | 0.534 | 62% | 0.623 | S | S | . | * | H | α-helix | trans | -63 | -39 | 177.7 | -73.9 | 178.2 | 0 | 0 | 0 | 112.8 | F36 T37 V38 V42 V43 | F36-L40 HydrophobicContact CD1-CD1 3.84Å; F36-L40 HydrophobicContact CD1-CG 4.38Å; F36-L40 HydrophobicContact CE1-CD1 3.32Å; F36-L40 HydrophobicContact CE1-CG 4.01Å; F36-L40 HydrophobicContact CZ-CD1 3.83Å; F36-L40 HydrophobicContact CZ-CD2 4.32Å; F36-L40 HydrophobicContact CZ-CG 4.14Å; F36-L40 PolarHBondContact O-N 3.47Å; T37-L40 PolarHBondContact O-N 3.47Å; V38-L40 PolarHBondContact O-N 2.78Å; L40-V42 VanDerWaalsContact C-N 3.31Å; L40-V42 PolarHBondContact O-N 3.34Å; L40-V43 PolarHBondContact O-N 3.45Å |
| 41 | L | 80.2 | Confident | 71.7 | Confident | 149 Ų | 149 | 116.4 Ų | 116.4 | 78% | 0.78 | 64% | 0.642 | S | S | * | * | H | α-helix | trans | -67.9 | -31.1 | 176.7 | -72.7 | 168.6 | 0 | 0 | 0 | 112.7 | T37 V38 V39 V43 | T37-L41 WeakPolarHBondContact O-CG 3.1Å; T37-L41 PolarHBondContact O-N 2.76Å; V38-L41 PolarHBondContact O-N 2.73Å; V39-L41 VanDerWaalsContact C-N 3.34Å; V39-L41 PolarHBondContact O-N 2.8Å; L41-V43 VanDerWaalsContact C-N 3.32Å |
| 42 | V | 79.4 | Confident | 70.1 | Confident | 109 Ų | 109 | 119.1 Ų | 119.1 | 66% | 0.661 | 66% | 0.658 | S | S | * | * | H | α-helix | trans | -78.4 | -16.1 | 178.9 | 173.2 | 0 | 0 | 0 | 0 | 112.3 | V38 V39 L40 P44 | V38-V42 HydrophobicContact CG1-CG2 4.47Å; V38-V42 VanDerWaalsContact O-CG2 3.27Å; V38-V42 WeakPolarHBondContact O-CG2 3.36Å; V38-V42 PolarHBondContact O-N 3.06Å; V38-V42 VanDerWaalsContact O-N 3.07Å; V39-V42 PolarHBondContact O-N 3.36Å; L40-V42 VanDerWaalsContact C-N 3.31Å; L40-V42 PolarHBondContact O-N 3.34Å; V42-P44 WeakPolarHBondContact O-CD 3.24Å |
| 43 | V | 67.9 | Low | 68.3 | Low | 95 Ų | 95 | 121.2 Ų | 121.2 | 58% | 0.576 | 66% | 0.663 | S | S | * | * | S | Bend | trans | -95.5 | 91.7 | 172.8 | -178.1 | 0 | 0 | 0 | 0 | 109 | V39 L40 L41 E45 | V39-V43 WeakPolarHBondContact O-CG2 3.23Å; V39-V43 PolarHBondContact O-N 3.29Å; L40-V43 PolarHBondContact O-N 3.45Å; L41-V43 VanDerWaalsContact C-N 3.32Å; V43-E45 PolarHBondContact O-N 2.91Å |
| 44 | P | 60.4 | Low | 66.6 | Low | 107 Ų | 107 | 127.3 Ų | 127.3 | 70% | 0.695 | 68% | 0.683 | S | S | * | * | trans | -64.4 | 137.2 | 173.6 | 27.1 | -34.1 | 0 | 0 | 0 | 109.9 | V42 S46 | V42-P44 WeakPolarHBondContact O-CD 3.24Å; P44-S46 PolarHBondContact O-N 2.96Å | ||
| 45 | E | 59.2 | Low | 64.8 | Low | 193 Ų | 193 | 126.9 Ų | 126.9 | 90% | 0.902 | 70% | 0.701 | S | S | * | * | trans | -42.5 | 108.9 | 178.3 | -67.6 | 175.4 | 138.7 | 0 | 0 | 112 | V43 H47 | V43-E45 PolarHBondContact O-N 2.91Å; E45-H47 PolarHBondContact O-N 3.04Å | ||
| 46 | S | 54 | Low | 63.1 | Low | 102 Ų | 102 | 130.3 Ų | 130.3 | 71% | 0.713 | 72% | 0.72 | S | S | * | * | trans | -74.6 | 92.7 | 169.5 | 38.3 | 0 | 0 | 0 | 0 | 109.7 | P44 | P44-S46 PolarHBondContact O-N 2.96Š| ||
| 47 | H | 52.4 | Low | 61.3 | Low | 159 Ų | 159 | 133.3 Ų | 133.3 | 74% | 0.736 | 73% | 0.733 | S | S | * | * | trans | 44.4 | 90.4 | 147.3 | -53.7 | -78.3 | 0 | 0 | 0 | 117.9 | E45 | E45-H47 PolarHBondContact O-N 3.04Š| ||
| 48 | T | 47.6 | Very low | 59.4 | Low | 151 Ų | 151 | 137.4 Ų | 137.4 | 93% | 0.926 | 75% | 0.752 | S | S | * | * | trans | -103.6 | 87.6 | 149.3 | 29.5 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 49 | M | 45.7 | Very low | 57.3 | Low | 160 Ų | 160 | 136.5 Ų | 136.5 | 79% | 0.788 | 75% | 0.75 | S | S | * | * | trans | -110.6 | 123 | 161.8 | -76.8 | -165.8 | -86.3 | 0 | 0 | 109.2 | L51 | M49-L51 PolarHBondContact O-N 2.74Š| ||
| 50 | H | 52.7 | Low | 55.6 | Low | 186 Ų | 186 | 139.5 Ų | 139.5 | 86% | 0.861 | 76% | 0.762 | S | S | * | * | trans | -38.3 | 124.5 | 175.2 | -106.7 | 74.2 | 0 | 0 | 0 | 114.2 | ||||
| 51 | L | 50.9 | Low | 54.1 | Low | 175 Ų | 175 | 143.8 Ų | 143.8 | 92% | 0.916 | 78% | 0.776 | S | S | * | * | trans | -125.5 | 92.5 | 153.7 | -80.7 | 169.3 | 0 | 0 | 0 | 109.1 | M49 | M49-L51 PolarHBondContact O-N 2.74Š| ||
| 52 | N | 52.8 | Low | 52.3 | Low | 140 Ų | 140 | 142.9 Ų | 142.9 | 75% | 0.749 | 78% | 0.777 | S | S | * | * | trans | -61.9 | 141.8 | 160.5 | -170.8 | 4.1 | 0 | 0 | 0 | 108.7 | ||||
| 53 | N | 48.1 | Very low | 50.5 | Low | 125 Ų | 125 | 146 Ų | 146 | 67% | 0.668 | 80% | 0.801 | S | S | * | * | S | Bend | trans | 81.1 | 102.5 | 161.2 | -129.3 | 0.9 | 0 | 0 | 0 | 118.4 | ||
| 54 | K | 52.2 | Low | 49.6 | Very low | 199 Ų | 199 | 148.5 Ų | 148.5 | 87% | 0.865 | 81% | 0.812 | S | S | * | * | trans | 51.6 | 103 | 144.7 | -69.1 | 173.4 | 179.8 | 175.3 | 0 | 118.5 | ||||
| 55 | G | 48.4 | Very low | 49 | Very low | 78 Ų | 78 | 150.7 Ų | 150.7 | 80% | 0.804 | 82% | 0.819 | S | S | * | * | trans | 161.6 | 131.2 | 155.3 | 0 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 56 | C | 48.8 | Very low | 48.5 | Very low | 127 Ų | 127 | 148.3 Ų | 148.3 | 86% | 0.858 | 81% | 0.814 | S | S | * | * | trans | -50.9 | 151.6 | -171.7 | -70.8 | 0 | 0 | 0 | 0 | 117.4 | ||||
| 57 | F | 48.8 | Very low | 48.1 | Very low | 193 Ų | 193 | 151.1 Ų | 151.1 | 85% | 0.846 | 82% | 0.82 | S | S | * | * | trans | -27.7 | 125.6 | 151.4 | -108.3 | -105.5 | 0 | 0 | 0 | 113.9 | ||||
| 58 | N | 47.3 | Very low | 47.9 | Very low | 159 Ų | 159 | 150.6 Ų | 150.6 | 85% | 0.85 | 83% | 0.825 | S | S | * | * | trans | -155.5 | 131.2 | 150.5 | -89.8 | -38.2 | 0 | 0 | 0 | 109.2 | ||||
| 59 | S | 42.6 | Very low | 47.9 | Very low | 69 Ų | 69 | 150.5 Ų | 150.5 | 48% | 0.483 | 82% | 0.818 | S | S | . | * | trans | 88.8 | 103.8 | 165.3 | -146.1 | 0 | 0 | 0 | 0 | 120.5 | C63 | S59-C63 WeakPolarHBondContact CB-O 3.48Å; S59-C63 PolarHBondContact OG-N 3.4Å; S59-C63 PolarHBondContact OG-O 3.09Å | ||
| 60 | I | 46 | Very low | 48 | Very low | 152 Ų | 152 | 149.9 Ų | 149.9 | 78% | 0.779 | 82% | 0.821 | S | S | * | * | S | Bend | trans | -96.9 | 126.2 | 155.8 | -65.4 | 163.3 | 0 | 0 | 0 | 105.2 | ||
| 61 | F | 50.8 | Low | 47.7 | Very low | 192 Ų | 192 | 147.1 Ų | 147.1 | 84% | 0.842 | 82% | 0.818 | S | S | * | * | S | Bend | trans | 48.9 | 88 | 179.9 | -106.8 | -88.1 | 0 | 0 | 0 | 114 | C63 | F61-C63 PolarHBondContact O-N 3.06Š|
| 62 | T | 41.4 | Very low | 47.4 | Very low | 130 Ų | 130 | 144.8 Ų | 144.8 | 80% | 0.798 | 81% | 0.809 | S | S | * | * | trans | 44.3 | 71.9 | 160.5 | 48.5 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 63 | C | 41.7 | Very low | 46.9 | Very low | 173 Ų | 173 | 145.2 Ų | 145.2 | 100% | 1.169 | 82% | 0.815 | S | S | * | * | trans | -152.6 | 0 | 149.6 | -104.3 | 0 | 0 | 0 | 0 | 108.6 | S59 F61 | S59-C63 WeakPolarHBondContact CB-O 3.48Å; S59-C63 PolarHBondContact OG-N 3.4Å; S59-C63 PolarHBondContact OG-O 3.09Å; F61-C63 PolarHBondContact O-N 3.06Å |
Retrieved 63 of 63 residues in 77.6 ms
(Link to these results)