| 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 | 60.3 | Low | 91.8 | Very high | 203 Ų | 203 | 111.7 Ų | 111.7 | 100% | 1 | 57% | 0.565 | S | S | * | * | 0 | 128.3 | 0 | -76 | -172.3 | -90.9 | 0 | 0 | 107.9 | Q6 | M1-Q6 HydrophobicContact CB-CG 4.41Š| |||
| 2 | S | 85.8 | Confident | 92.3 | Very high | 69 Ų | 69 | 111.9 Ų | 111.9 | 48% | 0.483 | 56% | 0.563 | S | S | . | * | trans | -73.1 | 145.5 | 179.3 | 78.1 | 0 | 0 | 0 | 0 | 110 | L4 S5 Q6 | S2-L4 PolarHBondContact O-N 3.09Å; S2-L4 VanDerWaalsContact O-N 3.15Å; S2-S5 PolarHBondContact N-OG 3.16Å; S2-S5 WeakPolarHBondContact O-CB 3.24Å; S2-S5 PolarHBondContact O-N 3.16Å; S2-S5 PolarHBondContact O-OG 3.26Å; S2-S5 PolarHBondContact OG-N 2.66Å; S2-Q6 PolarHBondContact O-N 2.65Å | ||
| 3 | T | 94.8 | Very high | 92.8 | Very high | 105 Ų | 105 | 110.4 Ų | 110.4 | 64% | 0.644 | 55% | 0.552 | S | S | * | * | H | α-helix | trans | -48.9 | -39.3 | 174.1 | 50 | 0 | 0 | 0 | 0 | 112.1 | S5 Q6 Q7 | T3-S5 PolarHBondContact O-N 3.21Å; T3-Q6 PolarHBondContact O-N 3.25Å; T3-Q7 WeakPolarHBondContact O-CG 3.39Å; T3-Q7 PolarHBondContact O-N 3.01Å |
| 4 | L | 94.5 | Very high | 93.2 | Very high | 93 Ų | 93 | 108.9 Ų | 108.9 | 49% | 0.487 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -61.5 | -42 | 175.8 | -172.3 | 67.9 | 0 | 0 | 0 | 112.8 | S2 Q7 R8 | S2-L4 PolarHBondContact O-N 3.09Å; S2-L4 VanDerWaalsContact O-N 3.15Å; L4-Q7 PolarHBondContact O-N 2.89Å; L4-R8 WeakPolarHBondContact O-CG 3.4Å; L4-R8 PolarHBondContact O-N 3.33Å |
| 5 | S | 94.5 | Very high | 93.5 | Very high | 50 Ų | 50 | 113.1 Ų | 113.1 | 35% | 0.35 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -64.9 | -39.3 | 177 | 65.1 | 0 | 0 | 0 | 0 | 112.3 | S2 T3 R8 K9 | S2-S5 PolarHBondContact N-OG 3.16Å; S2-S5 WeakPolarHBondContact O-CB 3.24Å; S2-S5 PolarHBondContact O-N 3.16Å; S2-S5 PolarHBondContact O-OG 3.26Å; S2-S5 PolarHBondContact OG-N 2.66Å; T3-S5 PolarHBondContact O-N 3.21Å; S5-R8 PolarHBondContact O-N 3.4Å; S5-K9 PolarHBondContact O-N 3.46Å; S5-K9 VanDerWaalsContact O-N 3.17Å |
| 6 | Q | 95.3 | Very high | 93.8 | Very high | 106 Ų | 106 | 113.3 Ų | 113.3 | 50% | 0.495 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -65.6 | -44.4 | 175.7 | -68.2 | 173 | -28.4 | 0 | 0 | 111.7 | M1 S2 T3 R8 K9 L10 | M1-Q6 HydrophobicContact CB-CG 4.41Å; S2-Q6 PolarHBondContact O-N 2.65Å; T3-Q6 PolarHBondContact O-N 3.25Å; Q6-R8 VanDerWaalsContact C-N 3.34Å; Q6-R8 PolarHBondContact O-N 3.32Å; Q6-K9 PolarHBondContact O-N 3.25Å; Q6-L10 PolarHBondContact O-N 2.85Å |
| 7 | Q | 96.5 | Very high | 94 | Very high | 120 Ų | 120 | 111.5 Ų | 111.5 | 56% | 0.561 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -61.9 | -40.5 | 176.8 | -74.4 | 176.9 | -25.1 | 0 | 0 | 112.2 | T3 L4 L10 V11 | T3-Q7 WeakPolarHBondContact O-CG 3.39Å; T3-Q7 PolarHBondContact O-N 3.01Å; L4-Q7 PolarHBondContact O-N 2.89Å; Q7-L10 PolarHBondContact O-N 3.44Å; Q7-V11 WeakPolarHBondContact O-CG2 3.45Å; Q7-V11 PolarHBondContact O-N 2.7Å |
| 8 | R | 96.6 | Very high | 94.2 | Very high | 174 Ų | 174 | 109.1 Ų | 109.1 | 66% | 0.657 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -60.3 | -45.9 | 175 | -75.3 | 177.6 | 179.5 | -167 | -0.3 | 111.9 | L4 S5 Q6 L10 V11 E12 | L4-R8 WeakPolarHBondContact O-CG 3.4Å; L4-R8 PolarHBondContact O-N 3.33Å; S5-R8 PolarHBondContact O-N 3.4Å; Q6-R8 VanDerWaalsContact C-N 3.34Å; Q6-R8 PolarHBondContact O-N 3.32Å; R8-L10 VanDerWaalsContact C-N 3.33Å; R8-L10 PolarHBondContact O-N 3.34Å; R8-V11 PolarHBondContact O-N 2.9Å; R8-E12 WeakPolarHBondContact O-CB 3.47Å; R8-E12 PolarHBondContact O-N 3.05Å |
| 9 | K | 96.9 | Very high | 94.3 | Very high | 149 Ų | 149 | 110.1 Ų | 110.1 | 65% | 0.648 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -61.7 | -41.3 | 176.8 | -173.4 | 179.1 | 179 | -178.2 | 0 | 111.9 | S5 Q6 E12 Q13 | S5-K9 PolarHBondContact O-N 3.46Å; S5-K9 VanDerWaalsContact O-N 3.17Å; Q6-K9 PolarHBondContact O-N 3.25Å; K9-E12 PolarHBondContact O-N 3.05Å; K9-Q13 WeakPolarHBondContact O-CB 3.36Å; K9-Q13 PolarHBondContact O-N 3.29Å |
| 10 | L | 97.3 | Very high | 94.5 | Very high | 91 Ų | 91 | 109.8 Ų | 109.8 | 48% | 0.476 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -63.1 | -46 | 175.8 | 179 | 62.7 | 0 | 0 | 0 | 111.6 | Q6 Q7 R8 E12 Q13 L14 | Q6-L10 PolarHBondContact O-N 2.85Å; Q7-L10 PolarHBondContact O-N 3.44Å; R8-L10 VanDerWaalsContact C-N 3.33Å; R8-L10 PolarHBondContact O-N 3.34Å; L10-E12 VanDerWaalsContact C-N 3.3Å; L10-E12 PolarHBondContact O-N 3.33Å; L10-Q13 PolarHBondContact O-N 2.94Å; L10-L14 HydrophobicContact CD1-CD1 4.22Å; L10-L14 HydrophobicContact CD1-CG 4.17Å; L10-L14 HydrophobicContact CG-CD1 3.98Å; L10-L14 HydrophobicContact CG-CG 4.36Å; L10-L14 WeakPolarHBondContact O-CB 3.44Å; L10-L14 VanDerWaalsContact O-CG 3.27Å; L10-L14 WeakPolarHBondContact O-CG 3.47Å; L10-L14 PolarHBondContact O-N 3.46Å |
| 11 | V | 97.8 | Very high | 94.5 | Very high | 69 Ų | 69 | 112.5 Ų | 112.5 | 42% | 0.418 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -61.9 | -40.4 | 177.2 | 170.1 | 0 | 0 | 0 | 0 | 111.3 | Q7 R8 L14 R15 | Q7-V11 WeakPolarHBondContact O-CG2 3.45Å; Q7-V11 PolarHBondContact O-N 2.7Å; R8-V11 PolarHBondContact O-N 2.9Å; V11-L14 PolarHBondContact O-N 2.85Å; V11-R15 HydrophobicContact CG1-CG 4.48Å; V11-R15 WeakPolarHBondContact O-CB 3.22Å; V11-R15 VanDerWaalsContact O-CG 3.24Å; V11-R15 WeakPolarHBondContact O-CG 3.45Å; V11-R15 PolarHBondContact O-N 2.96Å |
| 12 | E | 97.8 | Very high | 96.2 | Very high | 114 Ų | 114 | 111.3 Ų | 111.3 | 53% | 0.533 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -60.8 | -48.1 | 175 | -173.7 | -178.9 | 176.2 | 0 | 0 | 111.6 | R8 K9 L10 R15 Q16 | R8-E12 WeakPolarHBondContact O-CB 3.47Å; R8-E12 PolarHBondContact O-N 3.05Å; K9-E12 PolarHBondContact O-N 3.05Å; L10-E12 VanDerWaalsContact C-N 3.3Å; L10-E12 PolarHBondContact O-N 3.33Å; E12-R15 PolarHBondContact O-N 3.43Å; E12-Q16 WeakPolarHBondContact O-CG 3.5Å; E12-Q16 PolarHBondContact O-N 2.93Å |
| 13 | Q | 98.2 | Very high | 96.7 | Very high | 92 Ų | 92 | 113.1 Ų | 113.1 | 43% | 0.43 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -59.9 | -48 | 175.5 | -179.8 | -177.3 | -20.9 | 0 | 0 | 111.7 | K9 L10 R15 Q16 E17 | K9-Q13 WeakPolarHBondContact O-CB 3.36Å; K9-Q13 PolarHBondContact O-N 3.29Å; L10-Q13 PolarHBondContact O-N 2.94Å; Q13-R15 VanDerWaalsContact C-N 3.28Å; Q13-R15 PolarHBondContact O-N 3.39Å; Q13-Q16 WeakPolarHBondContact O-CA 3.44Å; Q13-Q16 WeakPolarHBondContact O-CB 3.35Å; Q13-Q16 PolarHBondContact O-N 3.3Å; Q13-E17 WeakPolarHBondContact CG-OE1 3.5Å; Q13-E17 PolarHBondContact NE2-OE1 3.47Å; Q13-E17 PolarHBondContact O-N 2.93Å |
| 14 | L | 98.2 | Very high | 96.9 | Very high | 89 Ų | 89 | 111.7 Ų | 111.7 | 47% | 0.466 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -61.1 | -37.1 | 178.9 | -71.5 | 173.2 | 0 | 0 | 0 | 112 | L10 V11 E17 A18 | L10-L14 HydrophobicContact CD1-CD1 4.22Å; L10-L14 HydrophobicContact CD1-CG 4.17Å; L10-L14 HydrophobicContact CG-CD1 3.98Å; L10-L14 HydrophobicContact CG-CG 4.36Å; L10-L14 WeakPolarHBondContact O-CB 3.44Å; L10-L14 VanDerWaalsContact O-CG 3.27Å; L10-L14 WeakPolarHBondContact O-CG 3.47Å; L10-L14 PolarHBondContact O-N 3.46Å; V11-L14 PolarHBondContact O-N 2.85Å; L14-E17 PolarHBondContact O-N 3.27Å; L14-A18 WeakPolarHBondContact O-CB 3.49Å; L14-A18 PolarHBondContact O-N 2.97Å |
| 15 | R | 98.3 | Very high | 97 | Very high | 173 Ų | 173 | 112.7 Ų | 112.7 | 65% | 0.653 | 55% | 0.55 | S | S | * | * | H | α-helix | trans | -64.3 | -40.7 | 173.6 | -75.6 | 172 | 179.8 | -170.2 | 0.1 | 111.6 | V11 E12 Q13 N19 | V11-R15 HydrophobicContact CG1-CG 4.48Å; V11-R15 WeakPolarHBondContact O-CB 3.22Å; V11-R15 VanDerWaalsContact O-CG 3.24Å; V11-R15 WeakPolarHBondContact O-CG 3.45Å; V11-R15 PolarHBondContact O-N 2.96Å; E12-R15 PolarHBondContact O-N 3.43Å; Q13-R15 VanDerWaalsContact C-N 3.28Å; Q13-R15 PolarHBondContact O-N 3.39Å; R15-N19 WeakPolarHBondContact O-CB 3.44Å; R15-N19 PolarHBondContact O-N 3.46Å; R15-N19 VanDerWaalsContact O-N 3.09Å; R15-N19 PolarHBondContact O-ND2 3.01Å; R15-N19 VanDerWaalsContact O-ND2 3.16Å |
| 16 | Q | 97.8 | Very high | 97.2 | Very high | 116 Ų | 116 | 114.8 Ų | 114.8 | 54% | 0.542 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -63 | -47.6 | 175.2 | -68.1 | 173.2 | 6.4 | 0 | 0 | 111 | E12 Q13 A18 N19 L20 | E12-Q16 WeakPolarHBondContact O-CG 3.5Å; E12-Q16 PolarHBondContact O-N 2.93Å; Q13-Q16 WeakPolarHBondContact O-CA 3.44Å; Q13-Q16 WeakPolarHBondContact O-CB 3.35Å; Q13-Q16 PolarHBondContact O-N 3.3Å; Q16-A18 PolarHBondContact O-N 3.31Å; Q16-N19 PolarHBondContact O-N 3.46Å; Q16-L20 PolarHBondContact O-N 2.96Å |
| 17 | E | 97.4 | Very high | 97.3 | Very high | 83 Ų | 83 | 114 Ų | 114 | 39% | 0.388 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -65 | -36 | 178.6 | -70.2 | 177.4 | -162.4 | 0 | 0 | 113.2 | Q13 L14 L20 R22 | Q13-E17 WeakPolarHBondContact CG-OE1 3.5Å; Q13-E17 PolarHBondContact NE2-OE1 3.47Å; Q13-E17 PolarHBondContact O-N 2.93Å; L14-E17 PolarHBondContact O-N 3.27Å; E17-L20 WeakPolarHBondContact O-CB 3.39Å; E17-L20 PolarHBondContact O-N 3.44Å; E17-R22 PolarHBondContact O-NH2 3.2Å |
| 18 | A | 97.2 | Very high | 97.4 | Very high | 67 Ų | 67 | 110.4 Ų | 110.4 | 55% | 0.554 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -66.1 | -39.3 | 175.5 | 0 | 0 | 0 | 0 | 0 | 111.6 | L14 Q16 L20 | L14-A18 WeakPolarHBondContact O-CB 3.49Å; L14-A18 PolarHBondContact O-N 2.97Å; Q16-A18 PolarHBondContact O-N 3.31Å; A18-L20 PolarHBondContact O-N 3.15Å |
| 19 | N | 97.6 | Very high | 97.5 | Very high | 128 Ų | 128 | 105.3 Ų | 105.3 | 68% | 0.684 | 54% | 0.537 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -77.8 | -1.1 | 179.5 | -70.2 | -23 | 0 | 0 | 0 | 114 | R15 Q16 N21 | R15-N19 WeakPolarHBondContact O-CB 3.44Å; R15-N19 PolarHBondContact O-N 3.46Å; R15-N19 VanDerWaalsContact O-N 3.09Å; R15-N19 PolarHBondContact O-ND2 3.01Å; R15-N19 VanDerWaalsContact O-ND2 3.16Å; Q16-N19 PolarHBondContact O-N 3.46Å; N19-N21 PolarHBondContact O-N 3.17Å |
| 20 | L | 96.6 | Very high | 97.6 | Very high | 105 Ų | 105 | 103.6 Ų | 103.6 | 55% | 0.55 | 53% | 0.531 | S | S | . | . | P | Polyproline II helix | trans | -65.8 | 118.7 | 172.7 | -66.6 | 176.1 | 0 | 0 | 0 | 110 | Q16 E17 A18 R22 | Q16-L20 PolarHBondContact O-N 2.96Å; E17-L20 WeakPolarHBondContact O-CB 3.39Å; E17-L20 PolarHBondContact O-N 3.44Å; A18-L20 PolarHBondContact O-N 3.15Å; L20-R22 PolarHBondContact O-N 3.2Å; L20-R22 PolarHBondContact O-NH1 2.61Å |
| 21 | N | 96.2 | Very high | 97.6 | Very high | 167 Ų | 167 | 104 Ų | 104 | 89% | 0.893 | 53% | 0.53 | S | S | * | . | P | Polyproline II helix | trans | -65.4 | 118.7 | 171.9 | -67.8 | -44.4 | 0 | 0 | 0 | 109.3 | N19 | N19-N21 PolarHBondContact O-N 3.17Š|
| 22 | R | 95.8 | Very high | 97.6 | Very high | 177 Ų | 177 | 105.7 Ų | 105.7 | 67% | 0.668 | 54% | 0.535 | S | S | * | . | P | Polyproline II helix | trans | -103.5 | 136.4 | 177.6 | -66.4 | 173 | -170.9 | 74 | 0.9 | 109.3 | E17 L20 | E17-R22 PolarHBondContact O-NH2 3.2Å; L20-R22 PolarHBondContact O-N 3.2Å; L20-R22 PolarHBondContact O-NH1 2.61Å |
| 23 | R | 96 | Very high | 97.6 | Very high | 108 Ų | 108 | 103.7 Ų | 103.7 | 41% | 0.408 | 53% | 0.527 | S | S | . | . | P | Polyproline II helix | trans | -83.9 | 147.2 | 172.5 | -64.9 | 174.3 | 64.9 | -157.8 | 2 | 109.8 | E27 E31 | R23-E27 IonicContact CZ-OE1 2.7Å; R23-E27 IonicContact NE-OE1 3Å; R23-E27 PolarHBondContact NE-OE1 3.14Å; R23-E27 VanDerWaalsContact NE-OE1 3.16Å; R23-E27 VanDerWaalsContact NH2-CD 3.34Å; R23-E27 IonicContact NH2-OE1 3.34Å; R23-E27 PolarHBondContact NH2-OE1 2.96Å; R23-E31 IonicContact CZ-OE1 3.26Å; R23-E31 IonicContact CZ-OE2 3.16Å; R23-E31 VanDerWaalsContact NH1-CD 3.34Å; R23-E31 IonicContact NH1-OE1 3.27Å; R23-E31 PolarHBondContact NH1-OE1 3.3Å; R23-E31 IonicContact NH1-OE2 2.65Å; R23-E31 PolarHBondContact NH1-OE2 2.92Å; R23-E31 IonicContact NH2-OE1 3.35Å; R23-E31 PolarHBondContact NH2-OE1 3.23Å; R23-E31 IonicContact NH2-OE2 2.66Å; R23-E31 PolarHBondContact NH2-OE2 3.05Å |
| 24 | P | 97.8 | Very high | 97.6 | Very high | 74 Ų | 74 | 102.3 Ų | 102.3 | 48% | 0.481 | 53% | 0.525 | S | S | . | . | P | Polyproline II helix | trans | -55.8 | 140.3 | 173.8 | -23.2 | 33.4 | 0 | 0 | 0 | 111.4 | S26 E27 C28 | P24-S26 PolarHBondContact O-N 3.23Å; P24-E27 HydrophobicContact CB-CB 4.4Å; P24-E27 WeakPolarHBondContact CD-OE2 3.32Å; P24-E27 WeakPolarHBondContact O-CB 3.38Å; P24-E27 PolarHBondContact O-N 3.36Å; P24-C28 PolarHBondContact O-N 3.2Å; P24-C28 VanDerWaalsContact O-N 3.14Å |
| 25 | V | 98 | Very high | 97.6 | Very high | 115 Ų | 115 | 105.3 Ų | 105.3 | 70% | 0.697 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -58.1 | -36.2 | 178.2 | 177 | 0 | 0 | 0 | 0 | 111.2 | E27 C28 V29 | V25-E27 VanDerWaalsContact C-N 3.31Å; V25-E27 PolarHBondContact O-N 2.88Å; V25-C28 PolarHBondContact O-N 3.39Å; V25-V29 HydrophobicContact CG1-CG2 4.01Å; V25-V29 WeakPolarHBondContact O-CB 3.48Å; V25-V29 VanDerWaalsContact O-CG2 3.23Å; V25-V29 WeakPolarHBondContact O-CG2 3.23Å; V25-V29 PolarHBondContact O-N 3.05Å |
| 26 | S | 98.2 | Very high | 97.5 | Very high | 94 Ų | 94 | 102.4 Ų | 102.4 | 66% | 0.657 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -58.7 | -40.5 | 176.3 | 49.6 | 0 | 0 | 0 | 0 | 112.9 | P24 Q30 | P24-S26 PolarHBondContact O-N 3.23Å; S26-Q30 WeakPolarHBondContact O-CB 3.27Å; S26-Q30 PolarHBondContact O-N 3.05Å |
| 27 | E | 98 | Very high | 97.5 | Very high | 88 Ų | 88 | 102 Ų | 102 | 41% | 0.411 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -70.8 | -46.2 | 178.7 | -164.4 | -174.1 | 147.1 | 0 | 0 | 110.9 | R23 P24 V25 V29 Q30 E31 | R23-E27 IonicContact CZ-OE1 2.7Å; R23-E27 IonicContact NE-OE1 3Å; R23-E27 PolarHBondContact NE-OE1 3.14Å; R23-E27 VanDerWaalsContact NE-OE1 3.16Å; R23-E27 VanDerWaalsContact NH2-CD 3.34Å; R23-E27 IonicContact NH2-OE1 3.34Å; R23-E27 PolarHBondContact NH2-OE1 2.96Å; P24-E27 HydrophobicContact CB-CB 4.4Å; P24-E27 WeakPolarHBondContact CD-OE2 3.32Å; P24-E27 WeakPolarHBondContact O-CB 3.38Å; P24-E27 PolarHBondContact O-N 3.36Å; V25-E27 VanDerWaalsContact C-N 3.31Å; V25-E27 PolarHBondContact O-N 2.88Å; E27-V29 VanDerWaalsContact C-N 3.33Å; E27-V29 PolarHBondContact O-N 3.33Å; E27-Q30 WeakPolarHBondContact O-CB 3.39Å; E27-Q30 PolarHBondContact O-N 3.43Å; E27-E31 PolarHBondContact O-N 2.79Å |
| 28 | C | 98.1 | Very high | 97.5 | Very high | 46 Ų | 46 | 104.8 Ų | 104.8 | 31% | 0.311 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -59.2 | -43.9 | 176.1 | -63.2 | 0 | 0 | 0 | 0 | 111.9 | P24 V25 Q30 E31 M32 | P24-C28 PolarHBondContact O-N 3.2Å; P24-C28 VanDerWaalsContact O-N 3.14Å; V25-C28 PolarHBondContact O-N 3.39Å; C28-Q30 VanDerWaalsContact C-N 3.35Å; C28-E31 PolarHBondContact O-N 3.27Å; C28-M32 VanDerWaalsContact O-CG 3.3Å; C28-M32 WeakPolarHBondContact O-CG 3.3Å; C28-M32 PolarHBondContact O-N 3.33Å |
| 29 | V | 98.5 | Very high | 97.4 | Very high | 66 Ų | 66 | 103.7 Ų | 103.7 | 40% | 0.4 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -64.8 | -40.3 | 177.9 | 169.6 | 0 | 0 | 0 | 0 | 110.9 | V25 E27 E31 M32 I33 | V25-V29 HydrophobicContact CG1-CG2 4.01Å; V25-V29 WeakPolarHBondContact O-CB 3.48Å; V25-V29 VanDerWaalsContact O-CG2 3.23Å; V25-V29 WeakPolarHBondContact O-CG2 3.23Å; V25-V29 PolarHBondContact O-N 3.05Å; E27-V29 VanDerWaalsContact C-N 3.33Å; E27-V29 PolarHBondContact O-N 3.33Å; V29-E31 VanDerWaalsContact C-N 3.32Å; V29-E31 PolarHBondContact O-N 3.3Å; V29-M32 WeakPolarHBondContact O-CB 3.31Å; V29-M32 PolarHBondContact O-N 2.86Å; V29-I33 HydrophobicContact CG1-CD1 3.87Å; V29-I33 HydrophobicContact CG1-CG1 4.4Å; V29-I33 VanDerWaalsContact O-CG1 3.31Å; V29-I33 WeakPolarHBondContact O-CG1 3.48Å; V29-I33 PolarHBondContact O-N 2.91Å |
| 30 | Q | 98.5 | Very high | 97.2 | Very high | 113 Ų | 113 | 103.3 Ų | 103.3 | 53% | 0.528 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -60.2 | -43.1 | 176.1 | -174.1 | 64.3 | 15.5 | 0 | 0 | 111.6 | S26 E27 C28 I33 V34 | S26-Q30 WeakPolarHBondContact O-CB 3.27Å; S26-Q30 PolarHBondContact O-N 3.05Å; E27-Q30 WeakPolarHBondContact O-CB 3.39Å; E27-Q30 PolarHBondContact O-N 3.43Å; C28-Q30 VanDerWaalsContact C-N 3.35Å; Q30-I33 PolarHBondContact O-N 3.4Å; Q30-V34 WeakPolarHBondContact O-CG2 3.47Å; Q30-V34 PolarHBondContact O-N 2.98Å |
| 31 | E | 98.2 | Very high | 97 | Very high | 99 Ų | 99 | 104.9 Ų | 104.9 | 46% | 0.463 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -64.8 | -40.4 | 175.2 | -71 | -172.4 | 163.7 | 0 | 0 | 112.9 | R23 E27 C28 V29 I33 V34 Y35 | R23-E31 IonicContact CZ-OE1 3.26Å; R23-E31 IonicContact CZ-OE2 3.16Å; R23-E31 VanDerWaalsContact NH1-CD 3.34Å; R23-E31 IonicContact NH1-OE1 3.27Å; R23-E31 PolarHBondContact NH1-OE1 3.3Å; R23-E31 IonicContact NH1-OE2 2.65Å; R23-E31 PolarHBondContact NH1-OE2 2.92Å; R23-E31 IonicContact NH2-OE1 3.35Å; R23-E31 PolarHBondContact NH2-OE1 3.23Å; R23-E31 IonicContact NH2-OE2 2.66Å; R23-E31 PolarHBondContact NH2-OE2 3.05Å; E27-E31 PolarHBondContact O-N 2.79Å; C28-E31 PolarHBondContact O-N 3.27Å; V29-E31 VanDerWaalsContact C-N 3.32Å; V29-E31 PolarHBondContact O-N 3.3Å; E31-I33 VanDerWaalsContact C-N 3.31Å; E31-I33 PolarHBondContact O-N 3.35Å; E31-V34 PolarHBondContact O-N 2.9Å; E31-Y35 WeakPolarHBondContact O-CB 3.37Å; E31-Y35 PolarHBondContact O-N 3.47Å |
| 32 | M | 98.1 | Very high | 96.7 | Very high | 105 Ų | 105 | 105 Ų | 105 | 52% | 0.517 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -59.5 | -44.3 | 174.4 | -70.5 | 174.2 | 69.7 | 0 | 0 | 111.1 | C28 V29 Y35 M36 | C28-M32 VanDerWaalsContact O-CG 3.3Å; C28-M32 WeakPolarHBondContact O-CG 3.3Å; C28-M32 PolarHBondContact O-N 3.33Å; V29-M32 WeakPolarHBondContact O-CB 3.31Å; V29-M32 PolarHBondContact O-N 2.86Å; M32-Y35 PolarHBondContact O-N 3.14Å; M32-M36 HydrophobicContact CE-CE 4.27Å; M32-M36 WeakPolarHBondContact O-CB 3.47Å; M32-M36 VanDerWaalsContact O-CG 3.22Å; M32-M36 WeakPolarHBondContact O-CG 3.22Å; M32-M36 PolarHBondContact O-N 3.37Å |
| 33 | I | 97.8 | Very high | 96.6 | Very high | 73 Ų | 73 | 99.9 Ų | 99.9 | 37% | 0.374 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -61.5 | -47.8 | 176.5 | -68.7 | 165 | 0 | 0 | 0 | 110.5 | V29 Q30 E31 Y35 M36 E37 | V29-I33 HydrophobicContact CG1-CD1 3.87Å; V29-I33 HydrophobicContact CG1-CG1 4.4Å; V29-I33 VanDerWaalsContact O-CG1 3.31Å; V29-I33 WeakPolarHBondContact O-CG1 3.48Å; V29-I33 PolarHBondContact O-N 2.91Å; Q30-I33 PolarHBondContact O-N 3.4Å; E31-I33 VanDerWaalsContact C-N 3.31Å; E31-I33 PolarHBondContact O-N 3.35Å; I33-Y35 VanDerWaalsContact C-N 3.3Å; I33-Y35 PolarHBondContact O-N 3.46Å; I33-M36 PolarHBondContact O-N 2.91Å; I33-M36 VanDerWaalsContact O-N 3.14Å; I33-E37 HydrophobicContact CG2-CG 4.3Å; I33-E37 WeakPolarHBondContact O-CG 3.46Å; I33-E37 PolarHBondContact O-N 3.22Å |
| 34 | V | 98.3 | Very high | 96.4 | Very high | 63 Ų | 63 | 97 Ų | 97 | 38% | 0.382 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -58.1 | -44.9 | 178.2 | 169.7 | 0 | 0 | 0 | 0 | 110.9 | Q30 E31 E37 Q38 | Q30-V34 WeakPolarHBondContact O-CG2 3.47Å; Q30-V34 PolarHBondContact O-N 2.98Å; E31-V34 PolarHBondContact O-N 2.9Å; V34-E37 PolarHBondContact O-N 3Å; V34-Q38 HydrophobicContact CG1-CG 4.48Å; V34-Q38 WeakPolarHBondContact O-CB 3.23Å; V34-Q38 VanDerWaalsContact O-CG 3.23Å; V34-Q38 WeakPolarHBondContact O-CG 3.42Å; V34-Q38 PolarHBondContact O-N 2.82Å |
| 35 | Y | 97.9 | Very high | 96.1 | Very high | 151 Ų | 151 | 100.1 Ų | 100.1 | 59% | 0.592 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -61.3 | -44.1 | 176 | 175.8 | -92.2 | 0 | 0 | 0 | 112.1 | E31 M32 I33 Q38 N39 | E31-Y35 WeakPolarHBondContact O-CB 3.37Å; E31-Y35 PolarHBondContact O-N 3.47Å; M32-Y35 PolarHBondContact O-N 3.14Å; I33-Y35 VanDerWaalsContact C-N 3.3Å; I33-Y35 PolarHBondContact O-N 3.46Å; Y35-Q38 PolarHBondContact O-N 3.17Å; Y35-N39 WeakPolarHBondContact CE2-ND2 3.49Å; Y35-N39 PolarHBondContact O-N 3.43Å; Y35-N39 PolarHBondContact O-ND2 3.45Å |
| 36 | M | 96.5 | Very high | 95.8 | Very high | 112 Ų | 112 | 98.6 Ų | 98.6 | 55% | 0.552 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -62.3 | -47.9 | 178.1 | -72.1 | 170.7 | -175.4 | 0 | 0 | 111.3 | M32 I33 Q38 N39 R40 | M32-M36 HydrophobicContact CE-CE 4.27Å; M32-M36 WeakPolarHBondContact O-CB 3.47Å; M32-M36 VanDerWaalsContact O-CG 3.22Å; M32-M36 WeakPolarHBondContact O-CG 3.22Å; M32-M36 PolarHBondContact O-N 3.37Å; I33-M36 PolarHBondContact O-N 2.91Å; I33-M36 VanDerWaalsContact O-N 3.14Å; M36-Q38 VanDerWaalsContact C-N 3.34Å; M36-Q38 PolarHBondContact O-N 3Å; M36-N39 CarbonylContact O-C 3.2Å; M36-N39 PolarHBondContact O-N 3.27Å; M36-N39 VanDerWaalsContact O-N 3.14Å; M36-R40 WeakPolarHBondContact O-CA 3.4Å; M36-R40 PolarHBondContact O-N 2.85Å |
| 37 | E | 96.3 | Very high | 95.4 | Very high | 107 Ų | 107 | 97.4 Ų | 97.4 | 50% | 0.5 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -63.4 | -39.1 | 179 | -68.8 | -61.8 | 159.9 | 0 | 0 | 112 | I33 V34 N39 R40 | I33-E37 HydrophobicContact CG2-CG 4.3Å; I33-E37 WeakPolarHBondContact O-CG 3.46Å; I33-E37 PolarHBondContact O-N 3.22Å; V34-E37 PolarHBondContact O-N 3Å; E37-N39 PolarHBondContact O-N 3.46Å; E37-R40 WeakPolarHBondContact O-CB 3.43Å; E37-R40 PolarHBondContact O-N 3.31Å; E37-R40 IonicContact OE1-NH1 3.42Å; E37-R40 PolarHBondContact OE1-NH1 3.14Å; E37-R40 WeakPolarHBondContact OE2-CD 3.49Å; E37-R40 IonicContact OE2-NH1 3.4Å; E37-R40 PolarHBondContact OE2-NH1 3.06Å |
| 38 | Q | 97.1 | Very high | 95.1 | Very high | 142 Ų | 142 | 95 Ų | 95 | 66% | 0.664 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -64.1 | -27.5 | 175.5 | -75.3 | 174.3 | 0.3 | 0 | 0 | 113.8 | V34 Y35 M36 | V34-Q38 HydrophobicContact CG1-CG 4.48Å; V34-Q38 WeakPolarHBondContact O-CB 3.23Å; V34-Q38 VanDerWaalsContact O-CG 3.23Å; V34-Q38 WeakPolarHBondContact O-CG 3.42Å; V34-Q38 PolarHBondContact O-N 2.82Å; Y35-Q38 PolarHBondContact O-N 3.17Å; M36-Q38 VanDerWaalsContact C-N 3.34Å; M36-Q38 PolarHBondContact O-N 3Å |
| 39 | N | 96 | Very high | 94.7 | Very high | 45 Ų | 45 | 95.6 Ų | 95.6 | 24% | 0.241 | 49% | 0.485 | C | S | . | . | H | α-helix | trans | -107.8 | 0.5 | -177.1 | -68.2 | -78.1 | 0 | 0 | 0 | 113.3 | Y35 M36 E37 D41 K42 D43 | Y35-N39 WeakPolarHBondContact CE2-ND2 3.49Å; Y35-N39 PolarHBondContact O-N 3.43Å; Y35-N39 PolarHBondContact O-ND2 3.45Å; M36-N39 CarbonylContact O-C 3.2Å; M36-N39 PolarHBondContact O-N 3.27Å; M36-N39 VanDerWaalsContact O-N 3.14Å; E37-N39 PolarHBondContact O-N 3.46Å; N39-D41 VanDerWaalsContact C-N 3.32Å; N39-D41 PolarHBondContact O-N 2.9Å; N39-K42 WeakPolarHBondContact O-CB 3.41Å; N39-K42 PolarHBondContact O-N 3.24Å; N39-D43 PolarHBondContact O-N 3.43Å |
| 40 | R | 93.7 | Very high | 94.2 | Very high | 120 Ų | 120 | 97.6 Ų | 97.6 | 45% | 0.453 | 51% | 0.508 | S | S | . | . | G | 310 helix | trans | -51.6 | -46.3 | -174.1 | -175.4 | -177.8 | -174.1 | 139.6 | 2.6 | 113.3 | M36 E37 K42 D43 V46 | M36-R40 WeakPolarHBondContact O-CA 3.4Å; M36-R40 PolarHBondContact O-N 2.85Å; E37-R40 WeakPolarHBondContact O-CB 3.43Å; E37-R40 PolarHBondContact O-N 3.31Å; E37-R40 IonicContact OE1-NH1 3.42Å; E37-R40 PolarHBondContact OE1-NH1 3.14Å; E37-R40 WeakPolarHBondContact OE2-CD 3.49Å; E37-R40 IonicContact OE2-NH1 3.4Å; E37-R40 PolarHBondContact OE2-NH1 3.06Å; R40-K42 PolarHBondContact O-N 3.04Å; R40-D43 WeakPolarHBondContact O-CB 3.49Å; R40-D43 PolarHBondContact O-N 3.31Å; R40-D43 VanDerWaalsContact O-N 3.12Å; R40-V46 HydrophobicContact CG-CG1 3.77Å |
| 41 | D | 91.4 | Very high | 93.7 | Very high | 138 Ų | 138 | 94.4 Ų | 94.4 | 74% | 0.738 | 50% | 0.498 | S | S | * | . | G | 310 helix | trans | -68.4 | -25.1 | -175.7 | -63.4 | -32.1 | 0 | 0 | 0 | 113 | N39 S47 | N39-D41 VanDerWaalsContact C-N 3.32Å; N39-D41 PolarHBondContact O-N 2.9Å; D41-S47 PolarHBondContact O-OG 2.96Å |
| 42 | K | 90.6 | Very high | 93.1 | Very high | 169 Ų | 169 | 97.5 Ų | 97.5 | 74% | 0.735 | 51% | 0.51 | S | S | * | . | G | 310 helix | trans | -83.8 | -16.2 | 176.9 | -59.8 | 175.9 | -173.3 | 165 | 0 | 112.5 | N39 R40 C44 | N39-K42 WeakPolarHBondContact O-CB 3.41Å; N39-K42 PolarHBondContact O-N 3.24Å; R40-K42 PolarHBondContact O-N 3.04Å; K42-C44 PolarHBondContact O-N 2.86Å |
| 43 | D | 93.2 | Very high | 92.6 | Very high | 69 Ų | 69 | 101.5 Ų | 101.5 | 37% | 0.369 | 53% | 0.525 | S | S | . | . | trans | -80.2 | 99.7 | 178 | -170.9 | -19 | 0 | 0 | 0 | 109.5 | N39 R40 L45 V46 S47 | N39-D43 PolarHBondContact O-N 3.43Å; R40-D43 WeakPolarHBondContact O-CB 3.49Å; R40-D43 PolarHBondContact O-N 3.31Å; R40-D43 VanDerWaalsContact O-N 3.12Å; D43-L45 PolarHBondContact O-N 2.89Å; D43-L45 VanDerWaalsContact O-N 3.1Å; D43-L45 WeakPolarHBondContact OD1-CB 3.32Å; D43-L45 PolarHBondContact OD1-N 3.3Å; D43-V46 HydrophobicContact CB-CB 4.15Å; D43-V46 HydrophobicContact CB-CG2 4.04Å; D43-V46 WeakPolarHBondContact O-CA 3.49Å; D43-V46 PolarHBondContact O-N 3.1Å; D43-S47 PolarHBondContact O-N 3.12Å; D43-S47 PolarHBondContact O-OG 3.22Å; D43-S47 VanDerWaalsContact O-OG 3.06Å | ||
| 44 | C | 91.8 | Very high | 92.1 | Very high | 47 Ų | 47 | 102.4 Ų | 102.4 | 32% | 0.318 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -62.8 | -16.4 | -179.5 | 62.2 | 0 | 0 | 0 | 0 | 113.8 | K42 V46 G48 F49 | K42-C44 PolarHBondContact O-N 2.86Å; C44-V46 VanDerWaalsContact C-N 3.33Å; C44-G48 WeakPolarHBondContact CA-O 3.42Å; C44-G48 CarbonylContact O-C 3.5Å; C44-G48 WeakPolarHBondContact O-CA 3.04Å; C44-G48 PolarHBondContact O-N 3.04Å; C44-F49 HydrophobicContact CB-CD1 3.86Å; C44-F49 HydrophobicContact CB-CE1 4.01Å; C44-F49 HydrophobicContact CB-CG 4.18Å; C44-F49 HydrophobicContact CB-CZ 4.45Å; C44-F49 VanDerWaalsContact SG-CE1 3.54Å |
| 45 | L | 91.2 | Very high | 91.8 | Very high | 141 Ų | 141 | 101.6 Ų | 101.6 | 74% | 0.738 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -79.2 | -21.4 | 173.1 | -56.8 | -178.6 | 0 | 0 | 0 | 111.8 | D43 | D43-L45 PolarHBondContact O-N 2.89Å; D43-L45 VanDerWaalsContact O-N 3.1Å; D43-L45 WeakPolarHBondContact OD1-CB 3.32Å; D43-L45 PolarHBondContact OD1-N 3.3Å |
| 46 | V | 92.2 | Very high | 91.4 | Very high | 82 Ų | 82 | 99.3 Ų | 99.3 | 50% | 0.497 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -98.9 | -47.4 | 178.4 | -178.6 | 0 | 0 | 0 | 0 | 111.7 | R40 D43 C44 | R40-V46 HydrophobicContact CG-CG1 3.77Å; D43-V46 HydrophobicContact CB-CB 4.15Å; D43-V46 HydrophobicContact CB-CG2 4.04Å; D43-V46 WeakPolarHBondContact O-CA 3.49Å; D43-V46 PolarHBondContact O-N 3.1Å; C44-V46 VanDerWaalsContact C-N 3.33Å |
| 47 | S | 90.2 | Very high | 90.9 | Very high | 70 Ų | 70 | 102 Ų | 102 | 49% | 0.49 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -92.9 | -11.7 | -177.8 | 62.1 | 0 | 0 | 0 | 0 | 113.8 | D41 D43 | D41-S47 PolarHBondContact O-OG 2.96Å; D43-S47 PolarHBondContact O-N 3.12Å; D43-S47 PolarHBondContact O-OG 3.22Å; D43-S47 VanDerWaalsContact O-OG 3.06Å |
| 48 | G | 91 | Very high | 90.4 | Very high | 36 Ų | 36 | 100.9 Ų | 100.9 | 37% | 0.371 | 53% | 0.531 | S | S | . | . | trans | 88.7 | 163.8 | -171.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | C44 | C44-G48 WeakPolarHBondContact CA-O 3.42Å; C44-G48 CarbonylContact O-C 3.5Å; C44-G48 WeakPolarHBondContact O-CA 3.04Å; C44-G48 PolarHBondContact O-N 3.04Å | ||
| 49 | F | 91.3 | Very high | 89.7 | Confident | 60 Ų | 60 | 101 Ų | 101 | 26% | 0.263 | 53% | 0.532 | S | S | . | . | trans | -73.8 | 137.5 | 175.7 | -66.5 | -90.6 | 0 | 0 | 0 | 110.8 | C44 S51 D54 N55 | C44-F49 HydrophobicContact CB-CD1 3.86Å; C44-F49 HydrophobicContact CB-CE1 4.01Å; C44-F49 HydrophobicContact CB-CG 4.18Å; C44-F49 HydrophobicContact CB-CZ 4.45Å; C44-F49 VanDerWaalsContact SG-CE1 3.54Å; F49-S51 WeakPolarHBondContact CB-O 3.22Å; F49-S51 PolarHBondContact O-N 3.18Å; F49-D54 HydrophobicContact CB-CB 4.24Å; F49-D54 VanDerWaalsContact CD1-C 3.41Å; F49-D54 HydrophobicContact CD1-CB 3.97Å; F49-D54 VanDerWaalsContact CD1-O 3.22Å; F49-D54 WeakPolarHBondContact CD1-O 3.36Å; F49-D54 VanDerWaalsContact CE1-O 3.28Å; F49-D54 WeakPolarHBondContact CE1-O 3.4Å; F49-N55 HydrophobicContact CB-CB 4.22Å; F49-N55 HydrophobicContact CD1-CB 4.11Å; F49-N55 HydrophobicContact CD2-CB 3.4Å; F49-N55 HydrophobicContact CE1-CB 4.33Å; F49-N55 HydrophobicContact CE2-CB 3.65Å; F49-N55 WeakPolarHBondContact CE2-OD1 3.28Å; F49-N55 HydrophobicContact CG-CB 3.64Å; F49-N55 HydrophobicContact CZ-CB 4.12Å | ||
| 50 | A | 87.3 | Confident | 88.9 | Confident | 107 Ų | 107 | 109.4 Ų | 109.4 | 88% | 0.884 | 57% | 0.566 | S | S | * | * | S | Bend | trans | -56.5 | -38.2 | 179.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||
| 51 | S | 88.7 | Confident | 88.1 | Confident | 47 Ų | 47 | 106.2 Ų | 106.2 | 33% | 0.329 | 57% | 0.571 | S | S | . | * | S | Bend | trans | -130.5 | 155.3 | 167 | 82.6 | 0 | 0 | 0 | 0 | 110.9 | F49 K53 D54 | F49-S51 WeakPolarHBondContact CB-O 3.22Å; F49-S51 PolarHBondContact O-N 3.18Å; S51-K53 PolarHBondContact O-N 3.03Å; S51-K53 PolarHBondContact OG-N 2.64Å; S51-D54 VanDerWaalsContact CB-OD2 3.31Å; S51-D54 WeakPolarHBondContact CB-OD2 3.2Å; S51-D54 PolarHBondContact N-OD2 2.75Å; S51-D54 PolarHBondContact O-N 3.25Å; S51-D54 PolarHBondContact OG-N 2.97Å; S51-D54 PolarHBondContact OG-OD2 3.06Å |
| 52 | K | 84.9 | Confident | 87.4 | Confident | 164 Ų | 164 | 102.8 Ų | 102.8 | 71% | 0.713 | 57% | 0.568 | S | S | * | * | G | 310 helix | trans | -51.5 | -39.7 | 173.6 | -77.2 | -171 | 178.1 | -176.3 | 0 | 112 | D54 N55 Q58 | K52-D54 PolarHBondContact O-N 3.44Å; K52-N55 WeakPolarHBondContact O-CB 3.31Å; K52-N55 PolarHBondContact O-N 3.47Å; K52-N55 VanDerWaalsContact O-N 3.11Å; K52-Q58 PolarHBondContact O-OE1 2.95Å |
| 53 | K | 87.4 | Confident | 86.8 | Confident | 188 Ų | 188 | 100.1 Ų | 100.1 | 82% | 0.817 | 57% | 0.569 | S | S | * | * | G | 310 helix | trans | -65 | -24 | -179.2 | -65.5 | -176.3 | 179.1 | 179.7 | 0 | 114 | S51 N55 | S51-K53 PolarHBondContact O-N 3.03Å; S51-K53 PolarHBondContact OG-N 2.64Å; K53-N55 VanDerWaalsContact C-N 3.25Å |
| 54 | D | 88.2 | Confident | 86.1 | Confident | 92 Ų | 92 | 102.7 Ų | 102.7 | 49% | 0.492 | 59% | 0.587 | S | S | . | * | G | 310 helix | trans | -78.2 | -15.8 | 178.9 | -53.9 | -46.9 | 0 | 0 | 0 | 111.6 | F49 S51 K52 P56 | F49-D54 HydrophobicContact CB-CB 4.24Å; F49-D54 VanDerWaalsContact CD1-C 3.41Å; F49-D54 HydrophobicContact CD1-CB 3.97Å; F49-D54 VanDerWaalsContact CD1-O 3.22Å; F49-D54 WeakPolarHBondContact CD1-O 3.36Å; F49-D54 VanDerWaalsContact CE1-O 3.28Å; F49-D54 WeakPolarHBondContact CE1-O 3.4Å; S51-D54 VanDerWaalsContact CB-OD2 3.31Å; S51-D54 WeakPolarHBondContact CB-OD2 3.2Å; S51-D54 PolarHBondContact N-OD2 2.75Å; S51-D54 PolarHBondContact O-N 3.25Å; S51-D54 PolarHBondContact OG-N 2.97Å; S51-D54 PolarHBondContact OG-OD2 3.06Å; K52-D54 PolarHBondContact O-N 3.44Å; D54-P56 WeakPolarHBondContact O-CD 3.36Å |
| 55 | N | 90.9 | Very high | 85.5 | Confident | 47 Ų | 47 | 106.8 Ų | 106.8 | 25% | 0.251 | 61% | 0.61 | S | S | . | * | trans | -79.7 | 108.7 | 175.2 | -175.9 | -1.2 | 0 | 0 | 0 | 110.6 | F49 K52 K53 F57 Q58 | F49-N55 HydrophobicContact CB-CB 4.22Å; F49-N55 HydrophobicContact CD1-CB 4.11Å; F49-N55 HydrophobicContact CD2-CB 3.4Å; F49-N55 HydrophobicContact CE1-CB 4.33Å; F49-N55 HydrophobicContact CE2-CB 3.65Å; F49-N55 WeakPolarHBondContact CE2-OD1 3.28Å; F49-N55 HydrophobicContact CG-CB 3.64Å; F49-N55 HydrophobicContact CZ-CB 4.12Å; K52-N55 WeakPolarHBondContact O-CB 3.31Å; K52-N55 PolarHBondContact O-N 3.47Å; K52-N55 VanDerWaalsContact O-N 3.11Å; K53-N55 VanDerWaalsContact C-N 3.25Å; N55-F57 PolarHBondContact O-N 3.15Å; N55-F57 VanDerWaalsContact O-N 3.15Å; N55-F57 WeakPolarHBondContact OD1-CB 3.39Å; N55-F57 PolarHBondContact OD1-N 3.27Å; N55-Q58 HydrophobicContact CB-CB 4.23Å; N55-Q58 WeakPolarHBondContact O-CB 3.45Å; N55-Q58 PolarHBondContact O-N 3.11Å | ||
| 56 | P | 89.1 | Confident | 84.9 | Confident | 103 Ų | 103 | 110.6 Ų | 110.6 | 67% | 0.669 | 63% | 0.629 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -66.4 | -17.8 | 179.8 | 29.1 | -35.1 | 0 | 0 | 0 | 113.1 | D54 | D54-P56 WeakPolarHBondContact O-CD 3.36Š|
| 57 | F | 86.3 | Confident | 84.5 | Confident | 169 Ų | 169 | 112.1 Ų | 112.1 | 74% | 0.741 | 64% | 0.636 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -94.3 | 5.6 | 177.1 | -53.9 | -74.2 | 0 | 0 | 0 | 113.2 | N55 E59 | N55-F57 PolarHBondContact O-N 3.15Å; N55-F57 VanDerWaalsContact O-N 3.15Å; N55-F57 WeakPolarHBondContact OD1-CB 3.39Å; N55-F57 PolarHBondContact OD1-N 3.27Å; F57-E59 PolarHBondContact O-N 3.1Å; F57-E59 VanDerWaalsContact O-N 3.1Å |
| 58 | Q | 85.4 | Confident | 84.2 | Confident | 82 Ų | 82 | 114.3 Ų | 114.3 | 38% | 0.383 | 64% | 0.644 | S | S | . | * | trans | -61.6 | 120.2 | 177.9 | -168.4 | -175.3 | 1.6 | 0 | 0 | 110.1 | K52 N55 K60 | K52-Q58 PolarHBondContact O-OE1 2.95Å; N55-Q58 HydrophobicContact CB-CB 4.23Å; N55-Q58 WeakPolarHBondContact O-CB 3.45Å; N55-Q58 PolarHBondContact O-N 3.11Å; Q58-K60 PolarHBondContact O-N 3.24Å | ||
| 59 | E | 82.4 | Confident | 83.8 | Confident | 145 Ų | 145 | 118.6 Ų | 118.6 | 68% | 0.678 | 66% | 0.659 | S | S | * | * | trans | -58.3 | 125.5 | 175.6 | -66.7 | -162.2 | 165.6 | 0 | 0 | 110.4 | F57 G61 | F57-E59 PolarHBondContact O-N 3.1Å; F57-E59 VanDerWaalsContact O-N 3.1Å; E59-G61 VanDerWaalsContact C-N 3.35Å | ||
| 60 | K | 80.4 | Confident | 83.4 | Confident | 221 Ų | 221 | 122.1 Ų | 122.1 | 96% | 0.961 | 68% | 0.682 | S | S | * | * | S | Bend | trans | -81.4 | -16.1 | 179.7 | -67.1 | -177.9 | -179.7 | 176.1 | 0 | 112.8 | Q58 | Q58-K60 PolarHBondContact O-N 3.24Š|
| 61 | G | 77.1 | Confident | 83.2 | Confident | 54 Ų | 54 | 123 Ų | 123 | 56% | 0.557 | 67% | 0.67 | S | S | * | * | S | Bend | trans | -144.9 | 130.8 | 176.7 | 0 | 0 | 0 | 0 | 0 | 108.9 | E59 | E59-G61 VanDerWaalsContact C-N 3.35Š|
| 62 | G | 76.1 | Confident | 82.8 | Confident | 65 Ų | 65 | 128.1 Ų | 128.1 | 67% | 0.67 | 69% | 0.692 | S | S | * | * | trans | -68.1 | 150.3 | 179.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | V64 | G62-V64 PolarHBondContact O-N 3.42Š| ||
| 63 | C | 78.3 | Confident | 82.7 | Confident | 113 Ų | 113 | 125.5 Ų | 125.5 | 76% | 0.764 | 69% | 0.691 | S | S | * | * | trans | -63.8 | 127.1 | 169.7 | -173.1 | 0 | 0 | 0 | 0 | 110 | ||||
| 64 | V | 78.5 | Confident | 82.3 | Confident | 124 Ų | 124 | 120.7 Ų | 120.7 | 75% | 0.752 | 68% | 0.681 | S | S | * | * | trans | -93.2 | 115.1 | 169.5 | -170.3 | 0 | 0 | 0 | 0 | 106.8 | G62 I66 | G62-V64 PolarHBondContact O-N 3.42Å; V64-I66 PolarHBondContact O-N 3.44Å | ||
| 65 | V | 78.8 | Confident | 81.8 | Confident | 132 Ų | 132 | 123.1 Ų | 123.1 | 80% | 0.8 | 70% | 0.697 | S | S | * | * | trans | -76.3 | 118.4 | 168 | -176.4 | 0 | 0 | 0 | 0 | 106.7 | ||||
| 66 | I | 78.3 | Confident | 81 | Confident | 222 Ų | 222 | 130 Ų | 130 | 100% | 1.138 | 74% | 0.737 | S | S | * | * | trans | -83.3 | 0 | 169.8 | -59.1 | 177 | 0 | 0 | 0 | 108.4 | V64 | V64-I66 PolarHBondContact O-N 3.44Š|
Retrieved 66 of 66 residues in 40.6 ms
(Link to these results)