| 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 | 64.6 | Low | 88.6 | Confident | 193 Ų | 193 | 121.5 Ų | 121.5 | 95% | 0.951 | 61% | 0.606 | S | S | * | * | 0 | -67.6 | 0 | -82.2 | -158.5 | -78.3 | 0 | 0 | 111.9 | D4 E5 | M1-D4 PolarHBondContact N-OD2 3.17Å; M1-E5 PolarHBondContact O-N 3.12Å | |||
| 2 | M | 74.1 | Confident | 89.2 | Confident | 163 Ų | 163 | 121.6 Ų | 121.6 | 80% | 0.803 | 60% | 0.6 | S | S | * | * | H | α-helix | trans | -65.9 | -37.4 | 175.8 | -76.1 | -164.3 | -73.1 | 0 | 0 | 113.5 | M6 | M2-M6 WeakPolarHBondContact O-CB 3.33Å; M2-M6 PolarHBondContact O-N 2.8Å |
| 3 | D | 87.4 | Confident | 89.8 | Confident | 138 Ų | 138 | 118.1 Ų | 118.1 | 74% | 0.738 | 58% | 0.582 | S | S | * | * | H | α-helix | trans | -67.5 | -37.6 | 179.8 | -59.4 | -30.1 | 0 | 0 | 0 | 112.7 | S7 | D3-S7 WeakPolarHBondContact O-CB 3.49Å; D3-S7 PolarHBondContact O-N 3.38Å |
| 4 | D | 91.5 | Very high | 90.1 | Very high | 112 Ų | 112 | 118 Ų | 118 | 60% | 0.599 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -67.7 | -44.8 | 179.3 | -52.5 | -59.5 | 0 | 0 | 0 | 111 | M1 S7 E8 | M1-D4 PolarHBondContact N-OD2 3.17Å; D4-S7 PolarHBondContact O-N 3.31Å; D4-E8 PolarHBondContact O-N 3.43Å |
| 5 | E | 92.4 | Very high | 90.5 | Very high | 142 Ų | 142 | 117.8 Ų | 117.8 | 66% | 0.664 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -65.1 | -41.2 | 178.2 | -168.8 | 175 | -175 | 0 | 0 | 111.3 | M1 E8 Y9 | M1-E5 PolarHBondContact O-N 3.12Å; E5-E8 PolarHBondContact O-N 3.47Å; E5-Y9 WeakPolarHBondContact O-CB 3.43Å; E5-Y9 PolarHBondContact O-N 3.37Å |
| 6 | M | 92.6 | Very high | 90.9 | Very high | 109 Ų | 109 | 118.8 Ų | 118.8 | 54% | 0.537 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -63.9 | -42.8 | 174.8 | -173.3 | 57.2 | 60.7 | 0 | 0 | 111.8 | M2 Y9 L10 | M2-M6 WeakPolarHBondContact O-CB 3.33Å; M2-M6 PolarHBondContact O-N 2.8Å; M6-Y9 PolarHBondContact O-N 3.34Å; M6-Y9 HydrophobicContact SD-CD1 4.42Å; M6-L10 HydrophobicContact CG-CD1 4.25Å; M6-L10 VanDerWaalsContact O-CG 3.31Å; M6-L10 WeakPolarHBondContact O-CG 3.38Å; M6-L10 PolarHBondContact O-N 3.5Å; M6-L10 HydrophobicContact SD-CG 4.47Å |
| 7 | S | 92.8 | Very high | 91.2 | Very high | 61 Ų | 61 | 117.9 Ų | 117.9 | 43% | 0.427 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -61.3 | -44.2 | 176.3 | -176.7 | 0 | 0 | 0 | 0 | 111.8 | D3 D4 Y9 L10 N11 | D3-S7 WeakPolarHBondContact O-CB 3.49Å; D3-S7 PolarHBondContact O-N 3.38Å; D4-S7 PolarHBondContact O-N 3.31Å; S7-Y9 VanDerWaalsContact C-N 3.34Å; S7-Y9 PolarHBondContact O-N 3.5Å; S7-L10 PolarHBondContact O-N 2.91Å; S7-N11 WeakPolarHBondContact O-CB 3.3Å; S7-N11 VanDerWaalsContact O-CG 3.26Å; S7-N11 PolarHBondContact O-N 3.38Å; S7-N11 PolarHBondContact O-ND2 3.47Å; S7-N11 VanDerWaalsContact O-ND2 3.14Å |
| 8 | E | 95.2 | Very high | 91.4 | Very high | 105 Ų | 105 | 115.8 Ų | 115.8 | 49% | 0.491 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -61.9 | -42.5 | 175.9 | -168.7 | -176.2 | 156.7 | 0 | 0 | 111.7 | D4 E5 N11 K12 | D4-E8 PolarHBondContact O-N 3.43Å; E5-E8 PolarHBondContact O-N 3.47Å; E8-N11 PolarHBondContact O-N 2.95Å; E8-K12 WeakPolarHBondContact O-CG 3.46Å; E8-K12 PolarHBondContact O-N 3.27Å; E8-K12 WeakPolarHBondContact OE1-CE 3.46Å; E8-K12 IonicContact OE1-NZ 2.8Å; E8-K12 PolarHBondContact OE1-NZ 3.01Å |
| 9 | Y | 94.1 | Very high | 91.6 | Very high | 147 Ų | 147 | 113.1 Ų | 113.1 | 58% | 0.576 | 56% | 0.564 | S | S | * | * | H | α-helix | trans | -60.9 | -47.7 | 176 | 179.1 | -97.6 | 0 | 0 | 0 | 112 | E5 M6 S7 N11 K12 M13 | E5-Y9 WeakPolarHBondContact O-CB 3.43Å; E5-Y9 PolarHBondContact O-N 3.37Å; M6-Y9 PolarHBondContact O-N 3.34Å; M6-Y9 HydrophobicContact SD-CD1 4.42Å; S7-Y9 VanDerWaalsContact C-N 3.34Å; S7-Y9 PolarHBondContact O-N 3.5Å; Y9-N11 VanDerWaalsContact C-N 3.34Å; Y9-N11 PolarHBondContact O-N 3.45Å; Y9-K12 PolarHBondContact O-N 3.41Å; Y9-M13 PolarHBondContact O-N 2.97Å |
| 10 | L | 95.2 | Very high | 91.9 | Very high | 87 Ų | 87 | 113.1 Ų | 113.1 | 46% | 0.455 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -60.8 | -42 | 177.4 | -71 | 173 | 0 | 0 | 0 | 111.9 | M6 S7 M13 Q14 | M6-L10 HydrophobicContact CG-CD1 4.25Å; M6-L10 VanDerWaalsContact O-CG 3.31Å; M6-L10 WeakPolarHBondContact O-CG 3.38Å; M6-L10 PolarHBondContact O-N 3.5Å; M6-L10 HydrophobicContact SD-CG 4.47Å; S7-L10 PolarHBondContact O-N 2.91Å; L10-M13 HydrophobicContact CD2-CE 3.99Å; L10-M13 PolarHBondContact O-N 3.21Å; L10-Q14 WeakPolarHBondContact O-CB 3.34Å; L10-Q14 PolarHBondContact O-N 3.29Å |
| 11 | N | 95.1 | Very high | 92.2 | Very high | 79 Ų | 79 | 111.2 Ų | 111.2 | 42% | 0.422 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -62.4 | -44 | 176.7 | -74.1 | -32.9 | 0 | 0 | 0 | 112 | S7 E8 Y9 M13 Q14 I15 | S7-N11 WeakPolarHBondContact O-CB 3.3Å; S7-N11 VanDerWaalsContact O-CG 3.26Å; S7-N11 PolarHBondContact O-N 3.38Å; S7-N11 PolarHBondContact O-ND2 3.47Å; S7-N11 VanDerWaalsContact O-ND2 3.14Å; E8-N11 PolarHBondContact O-N 2.95Å; Y9-N11 VanDerWaalsContact C-N 3.34Å; Y9-N11 PolarHBondContact O-N 3.45Å; N11-M13 VanDerWaalsContact C-N 3.3Å; N11-M13 PolarHBondContact O-N 3.05Å; N11-Q14 PolarHBondContact O-N 2.98Å; N11-I15 WeakPolarHBondContact O-CG1 3.48Å; N11-I15 PolarHBondContact O-N 3.03Å |
| 12 | K | 96 | Very high | 93.7 | Very high | 123 Ų | 123 | 110.3 Ų | 110.3 | 54% | 0.535 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -60.3 | -42.6 | 176 | -76.2 | 175.3 | -176.3 | 164.4 | 0 | 111.5 | E8 Y9 K16 | E8-K12 WeakPolarHBondContact O-CG 3.46Å; E8-K12 PolarHBondContact O-N 3.27Å; E8-K12 WeakPolarHBondContact OE1-CE 3.46Å; E8-K12 IonicContact OE1-NZ 2.8Å; E8-K12 PolarHBondContact OE1-NZ 3.01Å; Y9-K12 PolarHBondContact O-N 3.41Å; K12-K16 PolarHBondContact O-N 3.4Å; K12-K16 VanDerWaalsContact O-N 3.17Å |
| 13 | M | 96.1 | Very high | 94.8 | Very high | 76 Ų | 76 | 106.7 Ų | 106.7 | 37% | 0.374 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -63 | -47 | 177.2 | -168.8 | 174.3 | 69.8 | 0 | 0 | 111.3 | Y9 L10 N11 I15 K16 E17 | Y9-M13 PolarHBondContact O-N 2.97Å; L10-M13 HydrophobicContact CD2-CE 3.99Å; L10-M13 PolarHBondContact O-N 3.21Å; N11-M13 VanDerWaalsContact C-N 3.3Å; N11-M13 PolarHBondContact O-N 3.05Å; M13-I15 PolarHBondContact O-N 3.28Å; M13-K16 WeakPolarHBondContact O-CB 3.22Å; M13-K16 PolarHBondContact O-N 2.84Å; M13-E17 WeakPolarHBondContact O-CG 3.46Å; M13-E17 PolarHBondContact O-N 3.45Å |
| 14 | Q | 94.9 | Very high | 95.3 | Very high | 117 Ų | 117 | 108.3 Ų | 108.3 | 55% | 0.547 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -60.7 | -42.2 | 179 | -173.4 | -175.7 | -1.4 | 0 | 0 | 112.5 | L10 N11 K16 E17 T18 | L10-Q14 WeakPolarHBondContact O-CB 3.34Å; L10-Q14 PolarHBondContact O-N 3.29Å; N11-Q14 PolarHBondContact O-N 2.98Å; Q14-K16 VanDerWaalsContact C-N 3.31Å; Q14-K16 PolarHBondContact O-N 2.99Å; Q14-E17 PolarHBondContact O-N 3.43Å; Q14-T18 VanDerWaalsContact O-CB 3.31Å; Q14-T18 WeakPolarHBondContact O-CB 3.39Å; Q14-T18 PolarHBondContact O-N 2.94Å; Q14-T18 PolarHBondContact O-OG1 3.33Å |
| 15 | I | 95.8 | Very high | 95.6 | Very high | 115 Ų | 115 | 104 Ų | 104 | 59% | 0.59 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -62.2 | -42.2 | 177.5 | -70.2 | 168.4 | 0 | 0 | 0 | 110.6 | N11 M13 T18 S19 | N11-I15 WeakPolarHBondContact O-CG1 3.48Å; N11-I15 PolarHBondContact O-N 3.03Å; M13-I15 PolarHBondContact O-N 3.28Å; I15-T18 PolarHBondContact O-N 3.4Å; I15-S19 WeakPolarHBondContact O-CB 3.43Å; I15-S19 PolarHBondContact O-N 3.28Å; I15-S19 PolarHBondContact O-OG 3.5Å |
| 16 | K | 97.3 | Very high | 95.9 | Very high | 134 Ų | 134 | 99.9 Ų | 99.9 | 58% | 0.583 | 49% | 0.489 | S | S | * | . | H | α-helix | trans | -61.6 | -51.7 | 177.5 | -176.5 | -174.1 | 172.9 | -170 | 0 | 111.1 | K12 M13 Q14 T18 S19 E20 | K12-K16 PolarHBondContact O-N 3.4Å; K12-K16 VanDerWaalsContact O-N 3.17Å; M13-K16 WeakPolarHBondContact O-CB 3.22Å; M13-K16 PolarHBondContact O-N 2.84Å; Q14-K16 VanDerWaalsContact C-N 3.31Å; Q14-K16 PolarHBondContact O-N 2.99Å; K16-T18 VanDerWaalsContact C-N 3.31Å; K16-T18 PolarHBondContact O-N 3.18Å; K16-S19 WeakPolarHBondContact O-CB 3.48Å; K16-S19 PolarHBondContact O-N 3.02Å; K16-S19 VanDerWaalsContact O-N 3.12Å; K16-E20 WeakPolarHBondContact CE-OE1 3.35Å; K16-E20 PolarHBondContact O-N 2.84Å |
| 17 | E | 95.2 | Very high | 96.2 | Very high | 103 Ų | 103 | 98 Ų | 98 | 48% | 0.481 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -61.1 | -40.7 | 179.6 | -69.4 | 179.1 | 165.2 | 0 | 0 | 112 | M13 Q14 S19 E20 L21 | M13-E17 WeakPolarHBondContact O-CG 3.46Å; M13-E17 PolarHBondContact O-N 3.45Å; Q14-E17 PolarHBondContact O-N 3.43Å; E17-S19 VanDerWaalsContact C-N 3.3Å; E17-S19 PolarHBondContact O-N 2.91Å; E17-E20 PolarHBondContact O-N 3.27Å; E17-L21 WeakPolarHBondContact O-CG 3.15Å; E17-L21 PolarHBondContact O-N 3.23Å |
| 18 | T | 94.5 | Very high | 96.4 | Very high | 80 Ų | 80 | 97.2 Ų | 97.2 | 49% | 0.491 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -63.4 | -38.6 | 176.6 | -57.5 | 0 | 0 | 0 | 0 | 111.4 | Q14 I15 K16 L21 Y22 | Q14-T18 VanDerWaalsContact O-CB 3.31Å; Q14-T18 WeakPolarHBondContact O-CB 3.39Å; Q14-T18 PolarHBondContact O-N 2.94Å; Q14-T18 PolarHBondContact O-OG1 3.33Å; I15-T18 PolarHBondContact O-N 3.4Å; K16-T18 VanDerWaalsContact C-N 3.31Å; K16-T18 PolarHBondContact O-N 3.18Å; T18-L21 PolarHBondContact O-N 3.29Å; T18-Y22 PolarHBondContact O-N 3.38Å |
| 19 | S | 96.8 | Very high | 96.6 | Very high | 65 Ų | 65 | 92.3 Ų | 92.3 | 46% | 0.455 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -65.9 | -41.4 | 176.9 | -58.9 | 0 | 0 | 0 | 0 | 111.7 | I15 K16 E17 Y22 V23 | I15-S19 WeakPolarHBondContact O-CB 3.43Å; I15-S19 PolarHBondContact O-N 3.28Å; I15-S19 PolarHBondContact O-OG 3.5Å; K16-S19 WeakPolarHBondContact O-CB 3.48Å; K16-S19 PolarHBondContact O-N 3.02Å; K16-S19 VanDerWaalsContact O-N 3.12Å; E17-S19 VanDerWaalsContact C-N 3.3Å; E17-S19 PolarHBondContact O-N 2.91Å; S19-Y22 WeakPolarHBondContact O-CB 3.31Å; S19-Y22 PolarHBondContact O-N 3.35Å; S19-V23 WeakPolarHBondContact O-CG2 3.16Å; S19-V23 PolarHBondContact O-N 3.44Å |
| 20 | E | 97.3 | Very high | 96.8 | Very high | 112 Ų | 112 | 90.3 Ų | 90.3 | 52% | 0.523 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -64.3 | -41.1 | 175.5 | -69.2 | 175.7 | -174.1 | 0 | 0 | 111.9 | K16 E17 Y22 V23 R24 | K16-E20 WeakPolarHBondContact CE-OE1 3.35Å; K16-E20 PolarHBondContact O-N 2.84Å; E17-E20 PolarHBondContact O-N 3.27Å; E20-Y22 VanDerWaalsContact C-N 3.33Å; E20-Y22 PolarHBondContact O-N 3.06Å; E20-V23 PolarHBondContact O-N 3.41Å; E20-R24 WeakPolarHBondContact O-CB 3.18Å; E20-R24 PolarHBondContact O-N 2.66Å |
| 21 | L | 96.6 | Very high | 96.9 | Very high | 75 Ų | 75 | 91.9 Ų | 91.9 | 39% | 0.393 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -62.2 | -39.7 | 173.8 | -76.3 | 171.2 | 0 | 0 | 0 | 112.2 | E17 T18 R24 C25 N61 | E17-L21 WeakPolarHBondContact O-CG 3.15Å; E17-L21 PolarHBondContact O-N 3.23Å; T18-L21 PolarHBondContact O-N 3.29Å; L21-R24 PolarHBondContact O-N 3.28Å; L21-C25 WeakPolarHBondContact O-CB 3.36Å; L21-C25 PolarHBondContact O-N 3.47Å; L21-N61 WeakPolarHBondContact CD2-OD1 3.31Å |
| 22 | Y | 97 | Very high | 97 | Very high | 174 Ų | 174 | 97.3 Ų | 97.3 | 68% | 0.682 | 47% | 0.471 | S | S | * | . | H | α-helix | trans | -61.7 | -48.7 | 176.4 | 177.7 | -96.5 | 0 | 0 | 0 | 111.7 | T18 S19 E20 R24 C25 S26 | T18-Y22 PolarHBondContact O-N 3.38Å; S19-Y22 WeakPolarHBondContact O-CB 3.31Å; S19-Y22 PolarHBondContact O-N 3.35Å; E20-Y22 VanDerWaalsContact C-N 3.33Å; E20-Y22 PolarHBondContact O-N 3.06Å; Y22-R24 VanDerWaalsContact C-N 3.3Å; Y22-R24 PolarHBondContact O-N 3.01Å; Y22-C25 WeakPolarHBondContact O-CB 3.47Å; Y22-C25 PolarHBondContact O-N 3.09Å; Y22-S26 PolarHBondContact O-N 3.39Å; Y22-S26 PolarHBondContact O-OG 3.03Å |
| 23 | V | 97.7 | Very high | 97.1 | Very high | 87 Ų | 87 | 91.8 Ų | 91.8 | 53% | 0.527 | 45% | 0.449 | S | S | . | . | H | α-helix | trans | -62.7 | -38.3 | 177.5 | 174 | 0 | 0 | 0 | 0 | 111.4 | S19 E20 S26 T27 | S19-V23 WeakPolarHBondContact O-CG2 3.16Å; S19-V23 PolarHBondContact O-N 3.44Å; E20-V23 PolarHBondContact O-N 3.41Å; V23-S26 PolarHBondContact O-OG 3.07Å; V23-T27 WeakPolarHBondContact O-CB 3.45Å; V23-T27 PolarHBondContact O-N 2.73Å; V23-T27 VanDerWaalsContact O-N 3.08Å; V23-T27 PolarHBondContact O-OG1 2.96Å |
| 24 | R | 97.9 | Very high | 97.2 | Very high | 172 Ų | 172 | 89 Ų | 89 | 65% | 0.649 | 44% | 0.436 | S | S | * | . | H | α-helix | trans | -68.2 | -40.8 | 176.3 | -176.2 | 162.4 | -83.9 | 159.6 | -4.2 | 111.9 | E20 L21 Y22 T27 V28 F57 | E20-R24 WeakPolarHBondContact O-CB 3.18Å; E20-R24 PolarHBondContact O-N 2.66Å; L21-R24 PolarHBondContact O-N 3.28Å; Y22-R24 VanDerWaalsContact C-N 3.3Å; Y22-R24 PolarHBondContact O-N 3.01Å; R24-T27 PolarHBondContact O-N 2.79Å; R24-V28 HydrophobicContact CG-CG2 4.37Å; R24-V28 WeakPolarHBondContact O-CB 3.47Å; R24-V28 VanDerWaalsContact O-CG2 3.26Å; R24-V28 WeakPolarHBondContact O-CG2 3.31Å; R24-V28 PolarHBondContact O-N 3.44Å; R24-F57 HydrophobicContact CB-CZ 4.31Å; R24-F57 HydrophobicContact CG-CE2 4.29Å; R24-F57 HydrophobicContact CG-CZ 4.04Å |
| 25 | C | 98.2 | Very high | 97.1 | Very high | 21 Ų | 21 | 88.2 Ų | 88.2 | 14% | 0.142 | 44% | 0.443 | C | S | . | . | H | α-helix | trans | -58.6 | -49.9 | 175.2 | -172.6 | 0 | 0 | 0 | 0 | 111 | L21 Y22 T27 V28 C29 F57 | L21-C25 WeakPolarHBondContact O-CB 3.36Å; L21-C25 PolarHBondContact O-N 3.47Å; Y22-C25 WeakPolarHBondContact O-CB 3.47Å; Y22-C25 PolarHBondContact O-N 3.09Å; C25-T27 PolarHBondContact O-N 3.28Å; C25-V28 PolarHBondContact O-N 3.39Å; C25-C29 WeakPolarHBondContact O-CB 3.35Å; C25-C29 PolarHBondContact O-N 3.17Å; C25-C29 PolarHBondContact O-SG 2.76Å; C25-F57 HydrophobicContact CB-CD1 3.54Å; C25-F57 HydrophobicContact CB-CE1 3.46Å; C25-F57 VanDerWaalsContact CB-CE1 3.46Å; C25-F57 HydrophobicContact CB-CG 4.2Å; C25-F57 HydrophobicContact CB-CZ 4.07Å; C25-F57 WeakPolarHBondContact SG-CD1 3.44Å |
| 26 | S | 97.9 | Very high | 97 | Very high | 56 Ų | 56 | 86.1 Ų | 86.1 | 39% | 0.392 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -62.3 | -44.4 | -178.7 | 64.5 | 0 | 0 | 0 | 0 | 111.9 | Y22 V23 C29 F30 | Y22-S26 PolarHBondContact O-N 3.39Å; Y22-S26 PolarHBondContact O-OG 3.03Å; V23-S26 PolarHBondContact O-OG 3.07Å; S26-C29 PolarHBondContact O-N 2.96Å; S26-F30 VanDerWaalsContact O-CB 3.24Å; S26-F30 WeakPolarHBondContact O-CB 3.48Å; S26-F30 PolarHBondContact O-N 3.29Å |
| 27 | T | 98.1 | Very high | 97 | Very high | 70 Ų | 70 | 87 Ų | 87 | 43% | 0.429 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -61.7 | -49 | 177.7 | -52.2 | 0 | 0 | 0 | 0 | 111.2 | V23 R24 C25 C29 F30 D31 | V23-T27 WeakPolarHBondContact O-CB 3.45Å; V23-T27 PolarHBondContact O-N 2.73Å; V23-T27 VanDerWaalsContact O-N 3.08Å; V23-T27 PolarHBondContact O-OG1 2.96Å; R24-T27 PolarHBondContact O-N 2.79Å; C25-T27 PolarHBondContact O-N 3.28Å; T27-C29 PolarHBondContact O-N 3.06Å; T27-F30 PolarHBondContact O-N 3.43Å; T27-D31 PolarHBondContact O-N 3.12Å |
| 28 | V | 98.1 | Very high | 97 | Very high | 43 Ų | 43 | 88 Ų | 88 | 26% | 0.261 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -62.9 | -42 | -179.4 | 168.9 | 0 | 0 | 0 | 0 | 111.8 | R24 C25 R32 F57 | R24-V28 HydrophobicContact CG-CG2 4.37Å; R24-V28 WeakPolarHBondContact O-CB 3.47Å; R24-V28 VanDerWaalsContact O-CG2 3.26Å; R24-V28 WeakPolarHBondContact O-CG2 3.31Å; R24-V28 PolarHBondContact O-N 3.44Å; C25-V28 PolarHBondContact O-N 3.39Å; V28-R32 WeakPolarHBondContact O-CB 3.4Å; V28-R32 VanDerWaalsContact O-CG 3.27Å; V28-R32 WeakPolarHBondContact O-CG 3.44Å; V28-R32 PolarHBondContact O-N 3.46Å; V28-F57 HydrophobicContact CG1-CD2 4.49Å; V28-F57 HydrophobicContact CG2-CE2 4.45Å |
| 29 | C | 98.4 | Very high | 97 | Very high | 3 Ų | 3 | 87.8 Ų | 87.8 | 2% | 0.02 | 45% | 0.452 | C | S | . | . | H | α-helix | trans | -75 | -33.2 | -179.5 | -66.5 | 0 | 0 | 0 | 0 | 112.5 | C25 S26 T27 C33 C53 | C25-C29 WeakPolarHBondContact O-CB 3.35Å; C25-C29 PolarHBondContact O-N 3.17Å; C25-C29 PolarHBondContact O-SG 2.76Å; S26-C29 PolarHBondContact O-N 2.96Å; T27-C29 PolarHBondContact O-N 3.06Å; C29-C33 WeakPolarHBondContact O-CB 3.49Å; C29-C33 PolarHBondContact O-N 3.47Å; C29-C53 WeakPolarHBondContact CA-SG 3.5Å; C29-C53 HydrophobicContact CB-CB 3.82Å; C29-C53 WeakPolarHBondContact CB-SG 3.46Å; C29-C53 WeakPolarHBondContact SG-CB 3.4Å; C29-C53 CovalentContact SG-SG 2.05Å; C29-C53 PolarHBondContact SG-SG 2.91Å |
| 30 | F | 98.1 | Very high | 97 | Very high | 104 Ų | 104 | 97 Ų | 97 | 46% | 0.456 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -60.8 | -53.7 | 171.2 | -177.3 | -96.4 | 0 | 0 | 0 | 111.1 | S26 T27 R32 C33 V34 F37 | S26-F30 VanDerWaalsContact O-CB 3.24Å; S26-F30 WeakPolarHBondContact O-CB 3.48Å; S26-F30 PolarHBondContact O-N 3.29Å; T27-F30 PolarHBondContact O-N 3.43Å; F30-R32 PolarHBondContact O-N 3Å; F30-C33 PolarHBondContact O-N 3.31Å; F30-V34 HydrophobicContact CD2-CB 3.92Å; F30-V34 HydrophobicContact CD2-CG1 4.35Å; F30-V34 HydrophobicContact CD2-CG2 3.68Å; F30-V34 HydrophobicContact CE2-CB 3.91Å; F30-V34 HydrophobicContact CE2-CG1 3.85Å; F30-V34 HydrophobicContact CE2-CG2 4.03Å; F30-V34 HydrophobicContact CG-CB 4.47Å; F30-V34 HydrophobicContact CG-CG2 4.4Å; F30-V34 HydrophobicContact CZ-CB 4.45Å; F30-V34 HydrophobicContact CZ-CG1 4.31Å; F30-V34 WeakPolarHBondContact O-CB 3.34Å; F30-V34 PolarHBondContact O-N 2.91Å; F30-F37 HydrophobicContact CZ-CE1 4.04Å; F30-F37 HydrophobicContact CZ-CZ 4.37Å |
| 31 | D | 97.8 | Very high | 96.9 | Very high | 120 Ų | 120 | 99.8 Ų | 99.8 | 64% | 0.642 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -60.9 | -30.3 | -178.4 | -74.5 | -8.9 | 0 | 0 | 0 | 113.5 | T27 | T27-D31 PolarHBondContact O-N 3.12Å |
| 32 | R | 97.6 | Very high | 96.9 | Very high | 193 Ų | 193 | 100.2 Ų | 100.2 | 73% | 0.728 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -88.8 | -35.3 | -178.2 | -73 | -179.6 | -178.6 | -136 | 1.6 | 113.9 | V28 F30 | V28-R32 WeakPolarHBondContact O-CB 3.4Å; V28-R32 VanDerWaalsContact O-CG 3.27Å; V28-R32 WeakPolarHBondContact O-CG 3.44Å; V28-R32 PolarHBondContact O-N 3.46Å; F30-R32 PolarHBondContact O-N 3Å |
| 33 | C | 98.3 | Very high | 96.9 | Very high | 8 Ų | 8 | 94.7 Ų | 94.7 | 5% | 0.054 | 47% | 0.472 | C | S | . | . | H | α-helix | trans | -106 | -31 | -168.8 | -67.8 | 0 | 0 | 0 | 0 | 113.5 | C29 F30 S35 E46 C49 V50 | C29-C33 WeakPolarHBondContact O-CB 3.49Å; C29-C33 PolarHBondContact O-N 3.47Å; F30-C33 PolarHBondContact O-N 3.31Å; C33-S35 PolarHBondContact O-N 3.14Å; C33-E46 WeakPolarHBondContact O-CG 3.24Å; C33-C49 WeakPolarHBondContact CA-SG 3.42Å; C33-C49 HydrophobicContact CB-CB 3.57Å; C33-C49 WeakPolarHBondContact CB-SG 3.28Å; C33-C49 WeakPolarHBondContact SG-CB 3.21Å; C33-C49 PolarHBondContact SG-O 3.4Å; C33-C49 CovalentContact SG-SG 2.05Å; C33-C49 PolarHBondContact SG-SG 3.2Å; C33-V50 HydrophobicContact CB-CG2 3.73Å |
| 34 | V | 97.5 | Very high | 96.8 | Very high | 18 Ų | 18 | 97.4 Ų | 97.4 | 11% | 0.109 | 48% | 0.484 | C | S | . | . | trans | -94.1 | 104.9 | -176.7 | -172.9 | 0 | 0 | 0 | 0 | 108.9 | F30 F37 L42 | F30-V34 HydrophobicContact CD2-CB 3.92Å; F30-V34 HydrophobicContact CD2-CG1 4.35Å; F30-V34 HydrophobicContact CD2-CG2 3.68Å; F30-V34 HydrophobicContact CE2-CB 3.91Å; F30-V34 HydrophobicContact CE2-CG1 3.85Å; F30-V34 HydrophobicContact CE2-CG2 4.03Å; F30-V34 HydrophobicContact CG-CB 4.47Å; F30-V34 HydrophobicContact CG-CG2 4.4Å; F30-V34 HydrophobicContact CZ-CB 4.45Å; F30-V34 HydrophobicContact CZ-CG1 4.31Å; F30-V34 WeakPolarHBondContact O-CB 3.34Å; F30-V34 PolarHBondContact O-N 2.91Å; V34-F37 HydrophobicContact CG1-CE1 4.04Å; V34-F37 HydrophobicContact CG1-CZ 4.22Å; V34-L42 HydrophobicContact CG1-CD2 4.13Å; V34-L42 HydrophobicContact CG2-CD2 3.67Å | ||
| 35 | S | 94.1 | Very high | 96.8 | Very high | 99 Ų | 99 | 97.4 Ų | 97.4 | 69% | 0.692 | 49% | 0.488 | S | S | * | . | trans | -126.2 | -14.5 | -175.4 | 57 | 0 | 0 | 0 | 0 | 113.2 | C33 E46 | C33-S35 PolarHBondContact O-N 3.14Å; S35-E46 PolarHBondContact N-OE1 3.38Å; S35-E46 VanDerWaalsContact N-OE1 3.15Å | ||
| 36 | N | 93.3 | Very high | 96.8 | Very high | 71 Ų | 71 | 96.9 Ų | 96.9 | 38% | 0.38 | 48% | 0.484 | S | S | . | . | trans | -110.6 | 111 | -178.3 | -177 | 0.4 | 0 | 0 | 0 | 111 | T38 E46 | N36-T38 PolarHBondContact ND2-OG1 3.41Å; N36-T38 WeakPolarHBondContact OD1-CB 3.26Å; N36-T38 VanDerWaalsContact OD1-CG2 3.29Å; N36-T38 WeakPolarHBondContact OD1-CG2 3.41Å; N36-T38 PolarHBondContact OD1-N 2.8Å; N36-T38 VanDerWaalsContact OD1-N 3.1Å; N36-T38 PolarHBondContact OD1-OG1 2.95Å; N36-E46 PolarHBondContact N-OE1 3Å; N36-E46 VanDerWaalsContact N-OE1 3.09Å | ||
| 37 | F | 96 | Very high | 96.7 | Very high | 152 Ų | 152 | 97 Ų | 97 | 67% | 0.667 | 48% | 0.482 | S | S | * | . | trans | -101 | 24.4 | -177.4 | -60.4 | -82.8 | 0 | 0 | 0 | 113.6 | F30 V34 | F30-F37 HydrophobicContact CZ-CE1 4.04Å; F30-F37 HydrophobicContact CZ-CZ 4.37Å; V34-F37 HydrophobicContact CG1-CE1 4.04Å; V34-F37 HydrophobicContact CG1-CZ 4.22Å | ||
| 38 | T | 95.8 | Very high | 96.7 | Very high | 125 Ų | 125 | 98.6 Ų | 98.6 | 77% | 0.767 | 49% | 0.485 | S | S | * | . | S | Bend | trans | -82.7 | -12 | 178.4 | 57 | 0 | 0 | 0 | 0 | 113.9 | N36 | N36-T38 PolarHBondContact ND2-OG1 3.41Å; N36-T38 WeakPolarHBondContact OD1-CB 3.26Å; N36-T38 VanDerWaalsContact OD1-CG2 3.29Å; N36-T38 WeakPolarHBondContact OD1-CG2 3.41Å; N36-T38 PolarHBondContact OD1-N 2.8Å; N36-T38 VanDerWaalsContact OD1-N 3.1Å; N36-T38 PolarHBondContact OD1-OG1 2.95Å |
| 39 | S | 95.1 | Very high | 96.8 | Very high | 76 Ų | 76 | 98.8 Ų | 98.8 | 53% | 0.531 | 49% | 0.487 | S | S | . | . | S | Bend | trans | -135.1 | 154.7 | 178.6 | 175.2 | 0 | 0 | 0 | 0 | 110.8 | K41 | S39-K41 VanDerWaalsContact C-N 3.29Å; S39-K41 PolarHBondContact OG-N 3.38Å; S39-K41 VanDerWaalsContact OG-N 3.14Å; S39-K41 PolarHBondContact OG-O 2.95Å |
| 40 | R | 95.7 | Very high | 96.7 | Very high | 258 Ų | 258 | 100.5 Ų | 100.5 | 97% | 0.974 | 50% | 0.497 | S | S | * | . | S | Bend | trans | -77.8 | -13.8 | 172.3 | -67.5 | -175 | 175.2 | -162.1 | -1.4 | 113.5 | ||
| 41 | K | 96.3 | Very high | 96.8 | Very high | 171 Ų | 171 | 100.4 Ų | 100.4 | 74% | 0.743 | 50% | 0.502 | S | S | * | . | S | Bend | trans | -108.4 | 141.5 | 179.6 | -64.3 | -175.7 | 179.3 | -177.3 | 0 | 109.3 | S39 | S39-K41 VanDerWaalsContact C-N 3.29Å; S39-K41 PolarHBondContact OG-N 3.38Å; S39-K41 VanDerWaalsContact OG-N 3.14Å; S39-K41 PolarHBondContact OG-O 2.95Å |
| 42 | L | 96.4 | Very high | 96.8 | Very high | 83 Ų | 83 | 100.4 Ų | 100.4 | 44% | 0.435 | 50% | 0.496 | S | S | . | . | trans | -58.8 | 138.2 | 168.3 | -62 | 180 | 0 | 0 | 0 | 109.4 | V34 E46 | V34-L42 HydrophobicContact CG1-CD2 4.13Å; V34-L42 HydrophobicContact CG2-CD2 3.67Å; L42-E46 HydrophobicContact CB-CB 4.22Å; L42-E46 HydrophobicContact CD2-CB 4.1Å | ||
| 43 | N | 95.8 | Very high | 96.8 | Very high | 58 Ų | 58 | 92 Ų | 92 | 31% | 0.31 | 47% | 0.467 | S | S | . | . | trans | -80.2 | 170.8 | 168.4 | 68.4 | 63.5 | 0 | 0 | 0 | 110.8 | K45 E46 T47 | N43-K45 VanDerWaalsContact C-N 3.27Å; N43-K45 PolarHBondContact O-N 2.89Å; N43-K45 WeakPolarHBondContact OD1-CA 3.4Å; N43-K45 WeakPolarHBondContact OD1-CB 3.44Å; N43-K45 PolarHBondContact OD1-N 3.4Å; N43-E46 PolarHBondContact N-OE2 3.36Å; N43-E46 VanDerWaalsContact N-OE2 3.14Å; N43-E46 WeakPolarHBondContact ND2-CG 3.2Å; N43-E46 PolarHBondContact ND2-OE2 3.43Å; N43-E46 PolarHBondContact O-N 3.08Å; N43-E46 PolarHBondContact OD1-N 2.85Å; N43-T47 PolarHBondContact O-N 2.99Å; N43-T47 PolarHBondContact O-OG1 3.24Å | ||
| 44 | D | 97 | Very high | 96.8 | Very high | 145 Ų | 145 | 94.3 Ų | 94.3 | 78% | 0.775 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -59.8 | -36.6 | -176.1 | -60.1 | -22.1 | 0 | 0 | 0 | 112.7 | T47 E48 | D44-T47 PolarHBondContact O-N 2.8Å; D44-E48 WeakPolarHBondContact O-CB 3.41Å; D44-E48 PolarHBondContact O-N 3.49Å |
| 45 | K | 96.9 | Very high | 96.9 | Very high | 172 Ų | 172 | 98.5 Ų | 98.5 | 75% | 0.748 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -69.5 | -40.3 | 178.2 | -62.8 | -176.3 | 177.7 | -179.5 | 0 | 112.1 | N43 T47 C49 | N43-K45 VanDerWaalsContact C-N 3.27Å; N43-K45 PolarHBondContact O-N 2.89Å; N43-K45 WeakPolarHBondContact OD1-CA 3.4Å; N43-K45 WeakPolarHBondContact OD1-CB 3.44Å; N43-K45 PolarHBondContact OD1-N 3.4Å; K45-T47 VanDerWaalsContact C-N 3.35Å; K45-C49 VanDerWaalsContact O-CB 3.31Å; K45-C49 WeakPolarHBondContact O-CB 3.05Å; K45-C49 PolarHBondContact O-N 3.39Å |
| 46 | E | 97.8 | Very high | 97.1 | Very high | 10 Ų | 10 | 101.1 Ų | 101.1 | 5% | 0.047 | 50% | 0.498 | C | S | . | . | H | α-helix | trans | -66.5 | -41.1 | 176.3 | -66.7 | 177.1 | 137.2 | 0 | 0 | 110.5 | C33 S35 N36 L42 N43 C49 V50 | C33-E46 WeakPolarHBondContact O-CG 3.24Å; S35-E46 PolarHBondContact N-OE1 3.38Å; S35-E46 VanDerWaalsContact N-OE1 3.15Å; N36-E46 PolarHBondContact N-OE1 3Å; N36-E46 VanDerWaalsContact N-OE1 3.09Å; L42-E46 HydrophobicContact CB-CB 4.22Å; L42-E46 HydrophobicContact CD2-CB 4.1Å; N43-E46 PolarHBondContact N-OE2 3.36Å; N43-E46 VanDerWaalsContact N-OE2 3.14Å; N43-E46 WeakPolarHBondContact ND2-CG 3.2Å; N43-E46 PolarHBondContact ND2-OE2 3.43Å; N43-E46 PolarHBondContact O-N 3.08Å; N43-E46 PolarHBondContact OD1-N 2.85Å; E46-C49 WeakPolarHBondContact O-CB 3.46Å; E46-C49 PolarHBondContact O-N 2.96Å; E46-V50 WeakPolarHBondContact O-CG2 3.27Å; E46-V50 PolarHBondContact O-N 3.47Å |
| 47 | T | 97.3 | Very high | 97.3 | Very high | 57 Ų | 57 | 98.9 Ų | 98.9 | 35% | 0.35 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -61 | -51.6 | 176.1 | -53.8 | 0 | 0 | 0 | 0 | 111.1 | N43 D44 K45 C49 V50 D51 | N43-T47 PolarHBondContact O-N 2.99Å; N43-T47 PolarHBondContact O-OG1 3.24Å; D44-T47 PolarHBondContact O-N 2.8Å; K45-T47 VanDerWaalsContact C-N 3.35Å; T47-C49 VanDerWaalsContact C-N 3.27Å; T47-C49 PolarHBondContact O-N 2.93Å; T47-V50 PolarHBondContact O-N 3.24Å; T47-V50 VanDerWaalsContact O-N 3.13Å; T47-D51 PolarHBondContact O-N 2.9Å |
| 48 | E | 98.3 | Very high | 97.4 | Very high | 105 Ų | 105 | 93.9 Ų | 93.9 | 49% | 0.491 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -59.6 | -37.6 | 176.6 | -173.1 | -173.1 | 177.6 | 0 | 0 | 112.1 | D44 K52 | D44-E48 WeakPolarHBondContact O-CB 3.41Å; D44-E48 PolarHBondContact O-N 3.49Å; E48-K52 HydrophobicContact CG-CD 4.45Å; E48-K52 WeakPolarHBondContact O-CG 3.45Å; E48-K52 PolarHBondContact O-N 3.06Å; E48-K52 VanDerWaalsContact O-N 3.13Å; E48-K52 VanDerWaalsContact OE1-CE 3.3Å; E48-K52 WeakPolarHBondContact OE1-CE 3.05Å; E48-K52 IonicContact OE1-NZ 2.73Å; E48-K52 PolarHBondContact OE1-NZ 3.46Å |
| 49 | C | 98.5 | Very high | 97.5 | Very high | 47 Ų | 47 | 93.6 Ų | 93.6 | 32% | 0.318 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -64.4 | -45.2 | 175.4 | -177.5 | 0 | 0 | 0 | 0 | 111.7 | C33 K45 E46 T47 D51 K52 C53 | C33-C49 WeakPolarHBondContact CA-SG 3.42Å; C33-C49 HydrophobicContact CB-CB 3.57Å; C33-C49 WeakPolarHBondContact CB-SG 3.28Å; C33-C49 WeakPolarHBondContact SG-CB 3.21Å; C33-C49 PolarHBondContact SG-O 3.4Å; C33-C49 CovalentContact SG-SG 2.05Å; C33-C49 PolarHBondContact SG-SG 3.2Å; K45-C49 VanDerWaalsContact O-CB 3.31Å; K45-C49 WeakPolarHBondContact O-CB 3.05Å; K45-C49 PolarHBondContact O-N 3.39Å; E46-C49 WeakPolarHBondContact O-CB 3.46Å; E46-C49 PolarHBondContact O-N 2.96Å; T47-C49 VanDerWaalsContact C-N 3.27Å; T47-C49 PolarHBondContact O-N 2.93Å; C49-D51 VanDerWaalsContact C-N 3.34Å; C49-D51 PolarHBondContact O-N 2.9Å; C49-K52 PolarHBondContact O-N 3.08Å; C49-C53 WeakPolarHBondContact O-CB 3.47Å; C49-C53 PolarHBondContact O-N 2.98Å |
| 50 | V | 98.3 | Very high | 97.6 | Very high | 38 Ų | 38 | 94.3 Ų | 94.3 | 23% | 0.23 | 46% | 0.456 | C | S | . | . | H | α-helix | trans | -62 | -42.4 | 179.2 | 170.5 | 0 | 0 | 0 | 0 | 110.8 | C33 E46 T47 K52 C53 T54 | C33-V50 HydrophobicContact CB-CG2 3.73Å; E46-V50 WeakPolarHBondContact O-CG2 3.27Å; E46-V50 PolarHBondContact O-N 3.47Å; T47-V50 PolarHBondContact O-N 3.24Å; T47-V50 VanDerWaalsContact O-N 3.13Å; V50-K52 PolarHBondContact O-N 3.34Å; V50-C53 PolarHBondContact O-N 3.46Å; V50-T54 HydrophobicContact CG1-CG2 4.28Å; V50-T54 VanDerWaalsContact O-CG2 3.31Å; V50-T54 WeakPolarHBondContact O-CG2 3Å; V50-T54 PolarHBondContact O-N 3.04Å; V50-T54 PolarHBondContact O-OG1 3.45Å; V50-T54 VanDerWaalsContact O-OG1 3.07Å |
| 51 | D | 98.3 | Very high | 97.6 | Very high | 103 Ų | 103 | 83.6 Ų | 83.6 | 55% | 0.551 | 42% | 0.418 | S | S | * | . | H | α-helix | trans | -59.7 | -48.6 | 176.1 | -70.7 | -21.3 | 0 | 0 | 0 | 111.5 | T47 C49 C53 T54 E55 | T47-D51 PolarHBondContact O-N 2.9Å; C49-D51 VanDerWaalsContact C-N 3.34Å; C49-D51 PolarHBondContact O-N 2.9Å; D51-C53 VanDerWaalsContact C-N 3.34Å; D51-C53 PolarHBondContact O-N 3.49Å; D51-T54 PolarHBondContact O-OG1 3.45Å; D51-E55 PolarHBondContact O-N 2.98Å; D51-E55 VanDerWaalsContact O-N 3.16Å |
| 52 | K | 98.5 | Very high | 97.6 | Very high | 120 Ų | 120 | 81.7 Ų | 81.7 | 52% | 0.522 | 41% | 0.412 | S | S | . | . | H | α-helix | trans | -65.3 | -37.7 | 176.5 | -70 | 175.8 | -173.9 | 170.9 | 0 | 112.5 | E48 C49 V50 K56 | E48-K52 HydrophobicContact CG-CD 4.45Å; E48-K52 WeakPolarHBondContact O-CG 3.45Å; E48-K52 PolarHBondContact O-N 3.06Å; E48-K52 VanDerWaalsContact O-N 3.13Å; E48-K52 VanDerWaalsContact OE1-CE 3.3Å; E48-K52 WeakPolarHBondContact OE1-CE 3.05Å; E48-K52 IonicContact OE1-NZ 2.73Å; E48-K52 PolarHBondContact OE1-NZ 3.46Å; C49-K52 PolarHBondContact O-N 3.08Å; V50-K52 PolarHBondContact O-N 3.34Å; K52-K56 VanDerWaalsContact O-CB 3.25Å; K52-K56 WeakPolarHBondContact O-CB 3.39Å; K52-K56 PolarHBondContact O-N 3.23Å |
| 53 | C | 98.7 | Very high | 97.7 | Very high | 17 Ų | 17 | 87.2 Ų | 87.2 | 12% | 0.115 | 43% | 0.427 | C | S | . | . | H | α-helix | trans | -64.8 | -47.7 | -179.9 | 176.7 | 0 | 0 | 0 | 0 | 111.1 | C29 C49 V50 D51 K56 F57 | C29-C53 WeakPolarHBondContact CA-SG 3.5Å; C29-C53 HydrophobicContact CB-CB 3.82Å; C29-C53 WeakPolarHBondContact CB-SG 3.46Å; C29-C53 WeakPolarHBondContact SG-CB 3.4Å; C29-C53 CovalentContact SG-SG 2.05Å; C29-C53 PolarHBondContact SG-SG 2.91Å; C49-C53 WeakPolarHBondContact O-CB 3.47Å; C49-C53 PolarHBondContact O-N 2.98Å; V50-C53 PolarHBondContact O-N 3.46Å; D51-C53 VanDerWaalsContact C-N 3.34Å; D51-C53 PolarHBondContact O-N 3.49Å; C53-K56 PolarHBondContact O-N 2.88Å; C53-F57 VanDerWaalsContact O-CB 3.27Å; C53-F57 WeakPolarHBondContact O-CB 3.45Å; C53-F57 PolarHBondContact O-N 2.95Å |
| 54 | T | 98.2 | Very high | 97.8 | Very high | 56 Ų | 56 | 89.2 Ų | 89.2 | 34% | 0.344 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -64.3 | -43.2 | -179.7 | 54.8 | 0 | 0 | 0 | 0 | 111.5 | V50 D51 K56 F57 A58 | V50-T54 HydrophobicContact CG1-CG2 4.28Å; V50-T54 VanDerWaalsContact O-CG2 3.31Å; V50-T54 WeakPolarHBondContact O-CG2 3Å; V50-T54 PolarHBondContact O-N 3.04Å; V50-T54 PolarHBondContact O-OG1 3.45Å; V50-T54 VanDerWaalsContact O-OG1 3.07Å; D51-T54 PolarHBondContact O-OG1 3.45Å; T54-K56 PolarHBondContact O-N 2.97Å; T54-F57 PolarHBondContact O-N 3.39Å; T54-A58 WeakPolarHBondContact O-CB 3.37Å; T54-A58 PolarHBondContact O-N 2.96Å |
| 55 | E | 98.2 | Very high | 97.7 | Very high | 106 Ų | 106 | 85.5 Ų | 85.5 | 50% | 0.495 | 42% | 0.42 | S | S | . | . | H | α-helix | trans | -60.2 | -47.4 | 174.7 | -172.3 | -172.3 | -179.9 | 0 | 0 | 111.6 | D51 F57 A58 K59 | D51-E55 PolarHBondContact O-N 2.98Å; D51-E55 VanDerWaalsContact O-N 3.16Å; E55-F57 PolarHBondContact O-N 3.19Å; E55-A58 PolarHBondContact O-N 2.93Å; E55-K59 HydrophobicContact CG-CD 4.38Å; E55-K59 WeakPolarHBondContact O-CG 3.21Å; E55-K59 PolarHBondContact O-N 3.18Å; E55-K59 VanDerWaalsContact OE1-CE 3.24Å; E55-K59 WeakPolarHBondContact OE1-CE 3.33Å; E55-K59 IonicContact OE1-NZ 3.68Å; E55-K59 PolarHBondContact OE1-NZ 3.43Å |
| 56 | K | 98.5 | Very high | 97.7 | Very high | 153 Ų | 153 | 82.7 Ų | 82.7 | 67% | 0.665 | 41% | 0.412 | S | S | * | . | H | α-helix | trans | -64.6 | -40.9 | 179 | -173.7 | 173.7 | -178.2 | 175.6 | 0 | 111.8 | K52 C53 T54 M60 | K52-K56 VanDerWaalsContact O-CB 3.25Å; K52-K56 WeakPolarHBondContact O-CB 3.39Å; K52-K56 PolarHBondContact O-N 3.23Å; C53-K56 PolarHBondContact O-N 2.88Å; T54-K56 PolarHBondContact O-N 2.97Å; K56-M60 VanDerWaalsContact O-CB 3.23Å; K56-M60 WeakPolarHBondContact O-CB 3.27Å; K56-M60 PolarHBondContact O-N 2.05Å |
| 57 | F | 98.3 | Very high | 97.7 | Very high | 24 Ų | 24 | 87.7 Ų | 87.7 | 11% | 0.105 | 43% | 0.431 | C | S | . | . | H | α-helix | trans | -62 | -45.8 | 177 | -176.3 | -90.3 | 0 | 0 | 0 | 110.8 | R24 C25 V28 C53 T54 E55 M60 N61 | R24-F57 HydrophobicContact CB-CZ 4.31Å; R24-F57 HydrophobicContact CG-CE2 4.29Å; R24-F57 HydrophobicContact CG-CZ 4.04Å; C25-F57 HydrophobicContact CB-CD1 3.54Å; C25-F57 HydrophobicContact CB-CE1 3.46Å; C25-F57 VanDerWaalsContact CB-CE1 3.46Å; C25-F57 HydrophobicContact CB-CG 4.2Å; C25-F57 HydrophobicContact CB-CZ 4.07Å; C25-F57 WeakPolarHBondContact SG-CD1 3.44Å; V28-F57 HydrophobicContact CG1-CD2 4.49Å; V28-F57 HydrophobicContact CG2-CE2 4.45Å; C53-F57 VanDerWaalsContact O-CB 3.27Å; C53-F57 WeakPolarHBondContact O-CB 3.45Å; C53-F57 PolarHBondContact O-N 2.95Å; T54-F57 PolarHBondContact O-N 3.39Å; E55-F57 PolarHBondContact O-N 3.19Å; F57-M60 HydrophobicContact CD2-CE 4.2Å; F57-M60 HydrophobicContact CE2-CE 4.32Å; F57-M60 PolarHBondContact O-N 2.8Å; F57-N61 WeakPolarHBondContact CD1-ND2 3.23Å; F57-N61 WeakPolarHBondContact CE1-ND2 3.41Å; F57-N61 WeakPolarHBondContact CZ-ND2 3.29Å; F57-N61 PolarHBondContact O-N 2.92Å; F57-N61 PolarHBondContact O-ND2 2.94Å |
| 58 | A | 96.9 | Very high | 97.6 | Very high | 47 Ų | 47 | 89.5 Ų | 89.5 | 39% | 0.388 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -61.1 | -50.5 | 178 | 0 | 0 | 0 | 0 | 0 | 111.9 | T54 E55 M60 N61 Q62 | T54-A58 WeakPolarHBondContact O-CB 3.37Å; T54-A58 PolarHBondContact O-N 2.96Å; E55-A58 PolarHBondContact O-N 2.93Å; A58-M60 VanDerWaalsContact C-N 3.31Å; A58-M60 PolarHBondContact O-N 3.5Å; A58-N61 PolarHBondContact O-N 3.38Å; A58-Q62 WeakPolarHBondContact O-CG 3.47Å; A58-Q62 PolarHBondContact O-N 3.1Å |
| 59 | K | 98.1 | Very high | 97.5 | Very high | 120 Ų | 120 | 90.9 Ų | 90.9 | 52% | 0.522 | 44% | 0.442 | S | S | . | . | H | α-helix | trans | -60.8 | -40 | 177.6 | -70.8 | 179.2 | -175.6 | 173.8 | 0 | 112.3 | E55 R63 | E55-K59 HydrophobicContact CG-CD 4.38Å; E55-K59 WeakPolarHBondContact O-CG 3.21Å; E55-K59 PolarHBondContact O-N 3.18Å; E55-K59 VanDerWaalsContact OE1-CE 3.24Å; E55-K59 WeakPolarHBondContact OE1-CE 3.33Å; E55-K59 IonicContact OE1-NZ 3.68Å; E55-K59 PolarHBondContact OE1-NZ 3.43Å; K59-R63 WeakPolarHBondContact O-CB 3.31Å; K59-R63 PolarHBondContact O-N 3.09Å |
| 60 | M | 97.6 | Very high | 97.3 | Very high | 90 Ų | 90 | 93.2 Ų | 93.2 | 44% | 0.443 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -62.4 | -48.7 | 176.2 | -178.8 | -163.5 | 75 | 0 | 0 | 111.1 | K56 F57 A58 Q62 R63 L64 | K56-M60 VanDerWaalsContact O-CB 3.23Å; K56-M60 WeakPolarHBondContact O-CB 3.27Å; K56-M60 PolarHBondContact O-N 2.05Å; F57-M60 HydrophobicContact CD2-CE 4.2Å; F57-M60 HydrophobicContact CE2-CE 4.32Å; F57-M60 PolarHBondContact O-N 2.8Å; A58-M60 VanDerWaalsContact C-N 3.31Å; A58-M60 PolarHBondContact O-N 3.5Å; M60-Q62 PolarHBondContact O-N 3.35Å; M60-R63 PolarHBondContact O-N 3.33Å; M60-L64 HydrophobicContact CE-CD1 4.14Å; M60-L64 HydrophobicContact CG-CD1 3.99Å; M60-L64 HydrophobicContact CG-CG 4.38Å; M60-L64 WeakPolarHBondContact O-CG 3.2Å; M60-L64 PolarHBondContact O-N 3.37Å; M60-L64 HydrophobicContact SD-CD1 4.41Å |
| 61 | N | 96.4 | Very high | 97.2 | Very high | 33 Ų | 33 | 95 Ų | 95 | 18% | 0.176 | 46% | 0.457 | C | S | . | . | H | α-helix | trans | -60.9 | -45.9 | 179.2 | -82 | -83.3 | 0 | 0 | 0 | 111.3 | L21 F57 A58 R63 L64 T65 | L21-N61 WeakPolarHBondContact CD2-OD1 3.31Å; F57-N61 WeakPolarHBondContact CD1-ND2 3.23Å; F57-N61 WeakPolarHBondContact CE1-ND2 3.41Å; F57-N61 WeakPolarHBondContact CZ-ND2 3.29Å; F57-N61 PolarHBondContact O-N 2.92Å; F57-N61 PolarHBondContact O-ND2 2.94Å; A58-N61 PolarHBondContact O-N 3.38Å; N61-R63 VanDerWaalsContact C-N 3.31Å; N61-R63 PolarHBondContact O-N 3.04Å; N61-L64 PolarHBondContact O-N 3.38Å; N61-T65 PolarHBondContact O-N 2.93Å; N61-T65 PolarHBondContact O-OG1 2.05Å; N61-T65 VanDerWaalsContact O-OG1 3.06Å |
| 62 | Q | 96.4 | Very high | 97.1 | Very high | 132 Ų | 132 | 94 Ų | 94 | 62% | 0.617 | 45% | 0.451 | S | S | * | . | H | α-helix | trans | -55.4 | -46.1 | 175.1 | -72.9 | 174 | -17.3 | 0 | 0 | 112.1 | A58 M60 T65 L66 | A58-Q62 WeakPolarHBondContact O-CG 3.47Å; A58-Q62 PolarHBondContact O-N 3.1Å; M60-Q62 PolarHBondContact O-N 3.35Å; Q62-T65 PolarHBondContact O-N 3.49Å; Q62-L66 WeakPolarHBondContact O-CG 3.01Å; Q62-L66 PolarHBondContact O-N 2.65Å; Q62-L66 VanDerWaalsContact O-N 3.08Å |
| 63 | R | 98.2 | Very high | 96.8 | Very high | 198 Ų | 198 | 97.4 Ų | 97.4 | 75% | 0.747 | 46% | 0.461 | S | S | * | . | H | α-helix | trans | -65.7 | -40.8 | 178.8 | -173.4 | 172.8 | -176 | -96.9 | -0.6 | 112.6 | K59 M60 N61 L66 R67 | K59-R63 WeakPolarHBondContact O-CB 3.31Å; K59-R63 PolarHBondContact O-N 3.09Å; M60-R63 PolarHBondContact O-N 3.33Å; N61-R63 VanDerWaalsContact C-N 3.31Å; N61-R63 PolarHBondContact O-N 3.04Å; R63-L66 PolarHBondContact O-N 3.25Å; R63-R67 PolarHBondContact O-N 3.48Å |
| 64 | L | 97 | Very high | 96.5 | Very high | 100 Ų | 100 | 101.2 Ų | 101.2 | 52% | 0.524 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -63.8 | -42.7 | 176.6 | -73.1 | 173.5 | 0 | 0 | 0 | 111.2 | M60 N61 L66 R67 L68 | M60-L64 HydrophobicContact CE-CD1 4.14Å; M60-L64 HydrophobicContact CG-CD1 3.99Å; M60-L64 HydrophobicContact CG-CG 4.38Å; M60-L64 WeakPolarHBondContact O-CG 3.2Å; M60-L64 PolarHBondContact O-N 3.37Å; M60-L64 HydrophobicContact SD-CD1 4.41Å; N61-L64 PolarHBondContact O-N 3.38Å; L64-L66 PolarHBondContact O-N 3.15Å; L64-R67 PolarHBondContact O-N 3.48Å; L64-L68 WeakPolarHBondContact O-CB 3.09Å; L64-L68 PolarHBondContact O-N 3.07Å |
| 65 | T | 95.5 | Very high | 96.2 | Very high | 68 Ų | 68 | 103.3 Ų | 103.3 | 42% | 0.417 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -59.9 | -46 | 176.3 | -62.5 | 0 | 0 | 0 | 0 | 111.7 | N61 Q62 R67 L68 F69 | N61-T65 PolarHBondContact O-N 2.93Å; N61-T65 PolarHBondContact O-OG1 2.05Å; N61-T65 VanDerWaalsContact O-OG1 3.06Å; Q62-T65 PolarHBondContact O-N 3.49Å; T65-R67 PolarHBondContact O-N 2.91Å; T65-L68 PolarHBondContact O-N 3.25Å; T65-F69 HydrophobicContact CG2-CD2 3.87Å; T65-F69 HydrophobicContact CG2-CE2 3.34Å; T65-F69 HydrophobicContact CG2-CZ 4.12Å; T65-F69 WeakPolarHBondContact O-CD2 3.45Å; T65-F69 PolarHBondContact O-N 3.16Å |
| 66 | L | 96.8 | Very high | 95.7 | Very high | 112 Ų | 112 | 104 Ų | 104 | 59% | 0.586 | 49% | 0.489 | S | S | * | . | H | α-helix | trans | -59.2 | -47.1 | 175.4 | -70.3 | 172.5 | 0 | 0 | 0 | 111.6 | Q62 R63 L64 L68 F69 E70 | Q62-L66 WeakPolarHBondContact O-CG 3.01Å; Q62-L66 PolarHBondContact O-N 2.65Å; Q62-L66 VanDerWaalsContact O-N 3.08Å; R63-L66 PolarHBondContact O-N 3.25Å; L64-L66 PolarHBondContact O-N 3.15Å; L66-L68 VanDerWaalsContact C-N 3.31Å; L66-L68 PolarHBondContact O-N 3.33Å; L66-F69 PolarHBondContact O-N 3.44Å; L66-E70 WeakPolarHBondContact O-CG 3.25Å; L66-E70 PolarHBondContact O-N 2.6Å; L66-E70 VanDerWaalsContact O-N 3.09Å |
| 67 | R | 97.7 | Very high | 95.3 | Very high | 116 Ų | 116 | 102.4 Ų | 102.4 | 44% | 0.438 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -65.6 | -35.3 | 179.8 | -172.3 | 56.6 | -178 | 161.7 | 10.4 | 112.3 | R63 L64 T65 E70 L71 | R63-R67 PolarHBondContact O-N 3.48Å; L64-R67 PolarHBondContact O-N 3.48Å; T65-R67 PolarHBondContact O-N 2.91Å; R67-E70 WeakPolarHBondContact CD-OE2 3.41Å; R67-E70 IonicContact CZ-OE2 2.66Å; R67-E70 IonicContact NE-OE2 2.61Å; R67-E70 IonicContact NH1-OE2 2.6Å; R67-E70 PolarHBondContact NH1-OE2 3.14Å; R67-E70 PolarHBondContact O-N 3.34Å; R67-L71 HydrophobicContact CG-CD1 4.22Å; R67-L71 HydrophobicContact CG-CG 4.49Å; R67-L71 VanDerWaalsContact O-CG 3.3Å; R67-L71 WeakPolarHBondContact O-CG 3.44Å; R67-L71 PolarHBondContact O-N 3.39Å |
| 68 | L | 96 | Very high | 94.6 | Very high | 94 Ų | 94 | 108.3 Ų | 108.3 | 49% | 0.492 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -62.6 | -43.6 | 175.1 | 179.7 | 61.6 | 0 | 0 | 0 | 111.1 | L64 T65 L66 E70 L71 N72 | L64-L68 WeakPolarHBondContact O-CB 3.09Å; L64-L68 PolarHBondContact O-N 3.07Å; T65-L68 PolarHBondContact O-N 3.25Å; L66-L68 VanDerWaalsContact C-N 3.31Å; L66-L68 PolarHBondContact O-N 3.33Å; L68-E70 PolarHBondContact O-N 2.79Å; L68-L71 PolarHBondContact O-N 2.99Å; L68-N72 WeakPolarHBondContact O-CB 3.49Å; L68-N72 PolarHBondContact O-N 3.49Å; L68-N72 PolarHBondContact O-ND2 3.29Å; L68-N72 PolarHBondContact O-OD1 2.92Å |
| 69 | F | 95.2 | Very high | 92.9 | Very high | 135 Ų | 135 | 116 Ų | 116 | 59% | 0.592 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -63.9 | -39.7 | 176.1 | -71.7 | -52.7 | 0 | 0 | 0 | 113.1 | T65 L66 R73 | T65-F69 HydrophobicContact CG2-CD2 3.87Å; T65-F69 HydrophobicContact CG2-CE2 3.34Å; T65-F69 HydrophobicContact CG2-CZ 4.12Å; T65-F69 WeakPolarHBondContact O-CD2 3.45Å; T65-F69 PolarHBondContact O-N 3.16Å; L66-F69 PolarHBondContact O-N 3.44Å; F69-R73 WeakPolarHBondContact O-CB 3.34Å; F69-R73 PolarHBondContact O-N 3.19Å |
| 70 | E | 95.6 | Very high | 92.7 | Very high | 95 Ų | 95 | 115.8 Ų | 115.8 | 44% | 0.444 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -59.7 | -50.6 | 174.1 | -69.7 | 169.5 | -178.1 | 0 | 0 | 111.2 | L66 R67 L68 N72 R73 E74 | L66-E70 WeakPolarHBondContact O-CG 3.25Å; L66-E70 PolarHBondContact O-N 2.6Å; L66-E70 VanDerWaalsContact O-N 3.09Å; R67-E70 WeakPolarHBondContact CD-OE2 3.41Å; R67-E70 IonicContact CZ-OE2 2.66Å; R67-E70 IonicContact NE-OE2 2.61Å; R67-E70 IonicContact NH1-OE2 2.6Å; R67-E70 PolarHBondContact NH1-OE2 3.14Å; R67-E70 PolarHBondContact O-N 3.34Å; L68-E70 PolarHBondContact O-N 2.79Å; E70-N72 PolarHBondContact O-N 2.93Å; E70-R73 WeakPolarHBondContact O-CB 3.46Å; E70-R73 PolarHBondContact O-N 3.27Å; E70-E74 WeakPolarHBondContact O-CG 3.24Å; E70-E74 PolarHBondContact O-N 3.04Å |
| 71 | L | 96.1 | Very high | 92.4 | Very high | 77 Ų | 77 | 117.2 Ų | 117.2 | 40% | 0.403 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -63.1 | -42 | -179.9 | -70.1 | 172.2 | 0 | 0 | 0 | 112.3 | R67 L68 R73 E74 E75 | R67-L71 HydrophobicContact CG-CD1 4.22Å; R67-L71 HydrophobicContact CG-CG 4.49Å; R67-L71 VanDerWaalsContact O-CG 3.3Å; R67-L71 WeakPolarHBondContact O-CG 3.44Å; R67-L71 PolarHBondContact O-N 3.39Å; L68-L71 PolarHBondContact O-N 2.99Å; L71-R73 VanDerWaalsContact C-N 3.28Å; L71-R73 PolarHBondContact O-N 2.93Å; L71-E74 PolarHBondContact O-N 3.14Å; L71-E75 WeakPolarHBondContact O-CB 3.41Å; L71-E75 PolarHBondContact O-N 3.13Å |
| 72 | N | 94.7 | Very high | 92.2 | Very high | 82 Ų | 82 | 121.8 Ų | 121.8 | 44% | 0.439 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -62.8 | -37.7 | 177 | -71.6 | -11.2 | 0 | 0 | 0 | 111.5 | L68 E70 E75 L76 | L68-N72 WeakPolarHBondContact O-CB 3.49Å; L68-N72 PolarHBondContact O-N 3.49Å; L68-N72 PolarHBondContact O-ND2 3.29Å; L68-N72 PolarHBondContact O-OD1 2.92Å; E70-N72 PolarHBondContact O-N 2.93Å; N72-E75 PolarHBondContact O-N 2.94Å; N72-L76 WeakPolarHBondContact O-CG 3.41Å; N72-L76 PolarHBondContact O-N 3.45Å; N72-L76 VanDerWaalsContact O-N 3.12Å |
| 73 | R | 92.7 | Very high | 92 | Very high | 191 Ų | 191 | 121.2 Ų | 121.2 | 72% | 0.721 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -66.7 | -44.4 | 175.2 | -173.8 | -172.8 | -66 | -175.1 | -1.3 | 111.6 | F69 E70 L71 E75 L76 V77 | F69-R73 WeakPolarHBondContact O-CB 3.34Å; F69-R73 PolarHBondContact O-N 3.19Å; E70-R73 WeakPolarHBondContact O-CB 3.46Å; E70-R73 PolarHBondContact O-N 3.27Å; L71-R73 VanDerWaalsContact C-N 3.28Å; L71-R73 PolarHBondContact O-N 2.93Å; R73-E75 VanDerWaalsContact C-N 3.27Å; R73-E75 PolarHBondContact O-N 2.99Å; R73-L76 PolarHBondContact O-N 3.13Å; R73-V77 WeakPolarHBondContact O-CG2 3.3Å; R73-V77 PolarHBondContact O-N 2.94Å |
| 74 | E | 92.2 | Very high | 91.6 | Very high | 97 Ų | 97 | 116.4 Ų | 116.4 | 45% | 0.453 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -59.9 | -39.4 | 176.5 | -72.6 | 173.1 | -168.5 | 0 | 0 | 111.6 | E70 L71 V77 | E70-E74 WeakPolarHBondContact O-CG 3.24Å; E70-E74 PolarHBondContact O-N 3.04Å; L71-E74 PolarHBondContact O-N 3.14Å; E74-V77 PolarHBondContact O-N 3.31Å |
| 75 | E | 91.8 | Very high | 91.2 | Very high | 99 Ų | 99 | 117.5 Ų | 117.5 | 46% | 0.463 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -69.7 | -38.3 | 179.9 | -163.7 | 60.9 | -165.2 | 0 | 0 | 112.6 | L71 N72 R73 V77 K78 | L71-E75 WeakPolarHBondContact O-CB 3.41Å; L71-E75 PolarHBondContact O-N 3.13Å; N72-E75 PolarHBondContact O-N 2.94Å; R73-E75 VanDerWaalsContact C-N 3.27Å; R73-E75 PolarHBondContact O-N 2.99Å; E75-V77 PolarHBondContact O-N 2.98Å; E75-K78 PolarHBondContact O-N 2.61Å; E75-K78 VanDerWaalsContact O-N 3.17Å; E75-K78 IonicContact OE2-NZ 3.86Å; E75-K78 PolarHBondContact OE2-NZ 2.96Å |
| 76 | L | 88.8 | Confident | 90.9 | Very high | 121 Ų | 121 | 121.1 Ų | 121.1 | 63% | 0.634 | 57% | 0.572 | S | S | * | * | H | α-helix | trans | -62.4 | -28.8 | 174.7 | -74.6 | 167 | 0 | 0 | 0 | 113.2 | N72 R73 K78 | N72-L76 WeakPolarHBondContact O-CG 3.41Å; N72-L76 PolarHBondContact O-N 3.45Å; N72-L76 VanDerWaalsContact O-N 3.12Å; R73-L76 PolarHBondContact O-N 3.13Å; L76-K78 VanDerWaalsContact C-N 3.31Å |
| 77 | V | 88.7 | Confident | 90.5 | Very high | 119 Ų | 119 | 121.8 Ų | 121.8 | 72% | 0.721 | 57% | 0.571 | S | S | * | * | H | α-helix | trans | -77.4 | -18.2 | 179 | 174 | 0 | 0 | 0 | 0 | 112.3 | R73 E74 E75 | R73-V77 WeakPolarHBondContact O-CG2 3.3Å; R73-V77 PolarHBondContact O-N 2.94Å; E74-V77 PolarHBondContact O-N 3.31Å; E75-V77 PolarHBondContact O-N 2.98Å |
| 78 | K | 84.4 | Confident | 89.9 | Confident | 148 Ų | 148 | 122.3 Ų | 122.3 | 64% | 0.643 | 58% | 0.582 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -83.6 | -13.9 | 179 | -64.9 | 177.2 | -161.8 | 155.6 | 0 | 113.7 | E75 L76 | E75-K78 PolarHBondContact O-N 2.61Å; E75-K78 VanDerWaalsContact O-N 3.17Å; E75-K78 IonicContact OE2-NZ 3.86Å; E75-K78 PolarHBondContact OE2-NZ 2.96Å; L76-K78 VanDerWaalsContact C-N 3.31Å |
| 79 | Q | 62 | Low | 89.3 | Confident | 209 Ų | 209 | 124.8 Ų | 124.8 | 98% | 0.977 | 59% | 0.59 | S | S | * | * | trans | -85 | 0 | 176.4 | -65 | -175.8 | -9.9 | 0 | 0 | 110.7 |
Retrieved 79 of 79 residues in 17.3 ms
(Link to these results)