| 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 | 49.4 | Very low | 59.7 | Low | 241 Ų | 241 | 130.5 Ų | 130.5 | 100% | 1.187 | 72% | 0.719 | S | S | * | * | 0 | 58.8 | 0 | -68.2 | -164.6 | 174.1 | 0 | 0 | 110.9 | |||||
| 2 | A | 55.9 | Low | 61.4 | Low | 72 Ų | 72 | 123.1 Ų | 123.1 | 60% | 0.595 | 69% | 0.688 | S | S | * | * | trans | -160.4 | 60.3 | -179.6 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 3 | D | 50.7 | Low | 63 | Low | 149 Ų | 149 | 118.1 Ų | 118.1 | 80% | 0.797 | 66% | 0.662 | S | S | * | * | trans | -108.8 | 9.2 | 170.1 | -65.9 | -50.6 | 0 | 0 | 0 | 112.8 | ||||
| 4 | W | 59.1 | Low | 64.6 | Low | 202 Ų | 202 | 119.4 Ų | 119.4 | 77% | 0.765 | 66% | 0.66 | S | S | * | * | G | 310 helix | trans | -78.2 | -19.5 | -179 | 60.2 | -93.6 | 0 | 0 | 0 | 113.3 | R6 A7 | W4-R6 VanDerWaalsContact C-N 3.35Å; W4-R6 PolarHBondContact O-N 3.36Å; W4-A7 WeakPolarHBondContact O-CB 3.43Å; W4-A7 PolarHBondContact O-N 3.5Å |
| 5 | A | 55 | Low | 66 | Low | 85 Ų | 85 | 118.1 Ų | 118.1 | 70% | 0.702 | 65% | 0.647 | S | S | * | * | G | 310 helix | trans | -78.7 | -15.5 | -179 | 0 | 0 | 0 | 0 | 0 | 113.9 | A7 | A5-A7 VanDerWaalsContact C-N 3.33Š|
| 6 | R | 50.6 | Low | 67.3 | Low | 235 Ų | 235 | 117.4 Ų | 117.4 | 89% | 0.887 | 64% | 0.641 | S | S | * | * | G | 310 helix | trans | -86.4 | -6.3 | 173 | -155.4 | 174 | -155 | 99.4 | 5 | 112.8 | W4 | W4-R6 VanDerWaalsContact C-N 3.35Å; W4-R6 PolarHBondContact O-N 3.36Å |
| 7 | A | 54.6 | Low | 68.5 | Low | 73 Ų | 73 | 117.1 Ų | 117.1 | 60% | 0.603 | 64% | 0.638 | S | S | * | * | S | Bend | trans | -92.3 | 0.4 | -165.4 | 0 | 0 | 0 | 0 | 0 | 115.5 | W4 A5 | W4-A7 WeakPolarHBondContact O-CB 3.43Å; W4-A7 PolarHBondContact O-N 3.5Å; A5-A7 VanDerWaalsContact C-N 3.33Å |
| 8 | Q | 61 | Low | 69.7 | Low | 161 Ų | 161 | 115.3 Ų | 115.3 | 75% | 0.752 | 63% | 0.628 | S | S | * | * | trans | -131.4 | 70.9 | 172.8 | -78.3 | 171 | 20.2 | 0 | 0 | 109.7 | V13 | Q8-V13 HydrophobicContact CB-CG2 4.24Å; Q8-V13 HydrophobicContact CG-CG2 4.32Å | ||
| 9 | S | 69.4 | Low | 70.9 | Confident | 71 Ų | 71 | 116.8 Ų | 116.8 | 50% | 0.497 | 62% | 0.623 | S | S | . | * | trans | -60.1 | 129 | 162.2 | 175.6 | 0 | 0 | 0 | 0 | 107.9 | G11 A12 V13 | S9-G11 PolarHBondContact O-N 3.42Å; S9-G11 VanDerWaalsContact O-N 3.08Å; S9-A12 WeakPolarHBondContact O-CA 3.49Å; S9-A12 WeakPolarHBondContact O-CB 3.34Å; S9-A12 PolarHBondContact O-N 3.24Å; S9-V13 PolarHBondContact O-N 2.9Å | ||
| 10 | P | 72.3 | Confident | 71.9 | Confident | 101 Ų | 101 | 116.1 Ų | 116.1 | 66% | 0.656 | 62% | 0.616 | S | S | * | * | H | α-helix | trans | -48.5 | -38.7 | 177.8 | -27.8 | 33.2 | 0 | 0 | 0 | 112.8 | A12 V13 E14 | P10-A12 PolarHBondContact O-N 3.23Å; P10-V13 PolarHBondContact O-N 2.85Å; P10-E14 PolarHBondContact O-N 3.08Å |
| 11 | G | 78.2 | Confident | 72.9 | Confident | 45 Ų | 45 | 115.2 Ų | 115.2 | 46% | 0.464 | 61% | 0.611 | S | S | . | * | H | α-helix | trans | -66.8 | -30.1 | 176.6 | 0 | 0 | 0 | 0 | 0 | 114.8 | S9 E15 | S9-G11 PolarHBondContact O-N 3.42Å; S9-G11 VanDerWaalsContact O-N 3.08Å; G11-E15 WeakPolarHBondContact O-CB 3.4Å; G11-E15 PolarHBondContact O-N 3.34Å |
| 12 | A | 80.3 | Confident | 75 | Confident | 42 Ų | 42 | 109.4 Ų | 109.4 | 35% | 0.347 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -73 | -34.6 | 174.6 | 0 | 0 | 0 | 0 | 0 | 111.5 | S9 P10 I16 | S9-A12 WeakPolarHBondContact O-CA 3.49Å; S9-A12 WeakPolarHBondContact O-CB 3.34Å; S9-A12 PolarHBondContact O-N 3.24Å; P10-A12 PolarHBondContact O-N 3.23Å; A12-I16 WeakPolarHBondContact O-CD1 3.38Å; A12-I16 WeakPolarHBondContact O-CG1 3.33Å; A12-I16 PolarHBondContact O-N 3.45Å; A12-I16 VanDerWaalsContact O-N 3.13Å |
| 13 | V | 83 | Confident | 76.8 | Confident | 58 Ų | 58 | 114.8 Ų | 114.8 | 35% | 0.352 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -70.5 | -41.9 | 174.5 | -172 | 0 | 0 | 0 | 0 | 110.4 | Q8 S9 P10 E15 I16 L17 | Q8-V13 HydrophobicContact CB-CG2 4.24Å; Q8-V13 HydrophobicContact CG-CG2 4.32Å; S9-V13 PolarHBondContact O-N 2.9Å; P10-V13 PolarHBondContact O-N 2.85Å; V13-E15 PolarHBondContact O-N 2.97Å; V13-I16 PolarHBondContact O-N 2.95Å; V13-L17 HydrophobicContact CG1-CD1 4.21Å; V13-L17 WeakPolarHBondContact O-CG 3.35Å; V13-L17 PolarHBondContact O-N 3.49Å |
| 14 | E | 85.4 | Confident | 78.8 | Confident | 136 Ų | 136 | 112.6 Ų | 112.6 | 64% | 0.636 | 57% | 0.571 | S | S | * | * | H | α-helix | trans | -56 | -49.6 | 172.6 | -148.5 | 99 | -175.3 | 0 | 0 | 110.8 | P10 I16 L17 D18 | P10-E14 PolarHBondContact O-N 3.08Å; E14-I16 VanDerWaalsContact C-N 3.31Å; E14-I16 PolarHBondContact O-N 3.25Å; E14-L17 PolarHBondContact O-N 3Å; E14-D18 VanDerWaalsContact O-CB 3.25Å; E14-D18 WeakPolarHBondContact O-CB 3.18Å; E14-D18 PolarHBondContact O-N 2.85Å |
| 15 | E | 85.6 | Confident | 80.4 | Confident | 101 Ų | 101 | 105.4 Ų | 105.4 | 47% | 0.472 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -63.2 | -35.4 | 179.9 | -168.7 | -173.3 | 158.1 | 0 | 0 | 112.7 | G11 V13 R19 | G11-E15 WeakPolarHBondContact O-CB 3.4Å; G11-E15 PolarHBondContact O-N 3.34Å; V13-E15 PolarHBondContact O-N 2.97Å; E15-R19 WeakPolarHBondContact O-CB 3.45Å; E15-R19 WeakPolarHBondContact O-CG 3.47Å; E15-R19 PolarHBondContact O-N 2.76Å; E15-R19 IonicContact OE1-CZ 3.09Å; E15-R19 IonicContact OE1-NH1 2.73Å; E15-R19 PolarHBondContact OE1-NH1 2.87Å; E15-R19 IonicContact OE1-NH2 2.76Å; E15-R19 PolarHBondContact OE1-NH2 3.28Å |
| 16 | I | 86.6 | Confident | 82.3 | Confident | 107 Ų | 107 | 107 Ų | 107 | 55% | 0.549 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -67.9 | -47.2 | 175.6 | -69.9 | 164.6 | 0 | 0 | 0 | 110.5 | A12 V13 E14 D18 R19 E20 | A12-I16 WeakPolarHBondContact O-CD1 3.38Å; A12-I16 WeakPolarHBondContact O-CG1 3.33Å; A12-I16 PolarHBondContact O-N 3.45Å; A12-I16 VanDerWaalsContact O-N 3.13Å; V13-I16 PolarHBondContact O-N 2.95Å; E14-I16 VanDerWaalsContact C-N 3.31Å; E14-I16 PolarHBondContact O-N 3.25Å; I16-D18 VanDerWaalsContact C-N 3.3Å; I16-D18 PolarHBondContact O-N 3.28Å; I16-R19 PolarHBondContact O-N 3.35Å; I16-E20 PolarHBondContact O-N 3.13Å |
| 17 | L | 87.9 | Confident | 84.4 | Confident | 112 Ų | 112 | 98.1 Ų | 98.1 | 59% | 0.586 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -61.3 | -40.7 | 176.7 | -73.2 | 168.3 | 0 | 0 | 0 | 111.4 | V13 E14 E20 N21 | V13-L17 HydrophobicContact CG1-CD1 4.21Å; V13-L17 WeakPolarHBondContact O-CG 3.35Å; V13-L17 PolarHBondContact O-N 3.49Å; E14-L17 PolarHBondContact O-N 3Å; L17-E20 WeakPolarHBondContact O-CB 3.42Å; L17-E20 PolarHBondContact O-N 3.02Å; L17-N21 WeakPolarHBondContact O-CB 3.43Å; L17-N21 PolarHBondContact O-N 2.85Å |
| 18 | D | 90.1 | Very high | 86.3 | Confident | 85 Ų | 85 | 99.9 Ų | 99.9 | 46% | 0.455 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -71.8 | -31.3 | -178.1 | -144.9 | 41.8 | 0 | 0 | 0 | 112 | E14 I16 K22 | E14-D18 VanDerWaalsContact O-CB 3.25Å; E14-D18 WeakPolarHBondContact O-CB 3.18Å; E14-D18 PolarHBondContact O-N 2.85Å; I16-D18 VanDerWaalsContact C-N 3.3Å; I16-D18 PolarHBondContact O-N 3.28Å; D18-K22 VanDerWaalsContact O-CG 3.32Å; D18-K22 WeakPolarHBondContact O-CG 3.25Å; D18-K22 PolarHBondContact O-N 2.75Å; D18-K22 VanDerWaalsContact O-N 3.13Å; D18-K22 IonicContact OD2-NZ 2.89Å; D18-K22 PolarHBondContact OD2-NZ 2.73Å |
| 19 | R | 91.5 | Very high | 87.9 | Confident | 143 Ų | 143 | 94.6 Ų | 94.6 | 54% | 0.54 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -68.8 | -43.1 | 168.4 | -84.8 | -168.1 | -179.6 | 102.9 | 8.8 | 112.5 | E15 I16 K22 R23 | E15-R19 WeakPolarHBondContact O-CB 3.45Å; E15-R19 WeakPolarHBondContact O-CG 3.47Å; E15-R19 PolarHBondContact O-N 2.76Å; E15-R19 IonicContact OE1-CZ 3.09Å; E15-R19 IonicContact OE1-NH1 2.73Å; E15-R19 PolarHBondContact OE1-NH1 2.87Å; E15-R19 IonicContact OE1-NH2 2.76Å; E15-R19 PolarHBondContact OE1-NH2 3.28Å; I16-R19 PolarHBondContact O-N 3.35Å; R19-K22 PolarHBondContact O-N 3.17Å; R19-R23 PolarHBondContact O-N 3.46Å |
| 20 | E | 90.9 | Very high | 89.1 | Confident | 102 Ų | 102 | 94.6 Ų | 94.6 | 48% | 0.477 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -59.6 | -47.1 | 175.5 | -108.3 | -87.7 | 141 | 0 | 0 | 110.7 | I16 L17 K22 R23 M24 | I16-E20 PolarHBondContact O-N 3.13Å; L17-E20 WeakPolarHBondContact O-CB 3.42Å; L17-E20 PolarHBondContact O-N 3.02Å; E20-K22 PolarHBondContact O-N 3.47Å; E20-R23 WeakPolarHBondContact O-CB 3.46Å; E20-R23 PolarHBondContact O-N 3.02Å; E20-M24 HydrophobicContact CB-CE 4.29Å; E20-M24 WeakPolarHBondContact O-CG 3.32Å; E20-M24 PolarHBondContact O-N 3.13Å; E20-M24 WeakPolarHBondContact OE2-CE 3.45Å |
| 21 | N | 93.3 | Very high | 90.3 | Very high | 98 Ų | 98 | 95.8 Ų | 95.8 | 52% | 0.524 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -63.7 | -42.2 | 179.8 | -155.3 | -11.1 | 0 | 0 | 0 | 112 | L17 R23 M24 A25 | L17-N21 WeakPolarHBondContact O-CB 3.43Å; L17-N21 PolarHBondContact O-N 2.85Å; N21-R23 PolarHBondContact O-N 3.47Å; N21-M24 PolarHBondContact O-N 2.95Å; N21-A25 WeakPolarHBondContact O-CB 3.42Å; N21-A25 PolarHBondContact O-N 2.88Å |
| 22 | K | 93.1 | Very high | 91.2 | Very high | 119 Ų | 119 | 97.6 Ų | 97.6 | 52% | 0.517 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -60.6 | -43.5 | 172.3 | -74.8 | -179.5 | -172 | 75.8 | 0 | 112.4 | D18 R19 E20 M24 A25 D26 | D18-K22 VanDerWaalsContact O-CG 3.32Å; D18-K22 WeakPolarHBondContact O-CG 3.25Å; D18-K22 PolarHBondContact O-N 2.75Å; D18-K22 VanDerWaalsContact O-N 3.13Å; D18-K22 IonicContact OD2-NZ 2.89Å; D18-K22 PolarHBondContact OD2-NZ 2.73Å; R19-K22 PolarHBondContact O-N 3.17Å; E20-K22 PolarHBondContact O-N 3.47Å; K22-M24 VanDerWaalsContact C-N 3.35Å; K22-M24 PolarHBondContact O-N 3.48Å; K22-A25 PolarHBondContact O-N 3.46Å; K22-D26 PolarHBondContact O-N 2.89Å |
| 23 | R | 93.9 | Very high | 91.9 | Very high | 186 Ų | 186 | 100.1 Ų | 100.1 | 70% | 0.702 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -62.6 | -40.6 | 175.4 | -79.2 | -177.7 | 175.4 | -178.7 | -0.3 | 112.6 | R19 E20 N21 S27 | R19-R23 PolarHBondContact O-N 3.46Å; E20-R23 WeakPolarHBondContact O-CB 3.46Å; E20-R23 PolarHBondContact O-N 3.02Å; N21-R23 PolarHBondContact O-N 3.47Å; R23-S27 WeakPolarHBondContact O-CB 3.33Å; R23-S27 PolarHBondContact O-N 3.27Å |
| 24 | M | 92.9 | Very high | 92.5 | Very high | 102 Ų | 102 | 106.3 Ų | 106.3 | 50% | 0.502 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -65.1 | -42.2 | 176.1 | -74.9 | -171.2 | -84.2 | 0 | 0 | 111.4 | E20 N21 K22 S27 L28 | E20-M24 HydrophobicContact CB-CE 4.29Å; E20-M24 WeakPolarHBondContact O-CG 3.32Å; E20-M24 PolarHBondContact O-N 3.13Å; E20-M24 WeakPolarHBondContact OE2-CE 3.45Å; N21-M24 PolarHBondContact O-N 2.95Å; K22-M24 VanDerWaalsContact C-N 3.35Å; K22-M24 PolarHBondContact O-N 3.48Å; M24-S27 PolarHBondContact O-N 3.09Å; M24-L28 WeakPolarHBondContact O-CB 3.41Å; M24-L28 PolarHBondContact O-N 2.92Å |
| 25 | A | 93.6 | Very high | 93 | Very high | 52 Ų | 52 | 105.5 Ų | 105.5 | 43% | 0.43 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -62.6 | -45.1 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | N21 K22 S27 L28 A29 | N21-A25 WeakPolarHBondContact O-CB 3.42Å; N21-A25 PolarHBondContact O-N 2.88Å; K22-A25 PolarHBondContact O-N 3.46Å; A25-S27 PolarHBondContact O-N 3.43Å; A25-L28 PolarHBondContact O-N 2.84Å; A25-A29 WeakPolarHBondContact O-CB 3.35Å; A25-A29 PolarHBondContact O-N 3.23Å |
| 26 | D | 95.1 | Very high | 93.6 | Very high | 117 Ų | 117 | 107.7 Ų | 107.7 | 63% | 0.626 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -63.3 | -42.2 | 176.2 | -76.9 | -18.6 | 0 | 0 | 0 | 111.7 | K22 L28 A29 S30 | K22-D26 PolarHBondContact O-N 2.89Å; D26-L28 VanDerWaalsContact C-N 3.33Å; D26-L28 PolarHBondContact O-N 3.29Å; D26-A29 PolarHBondContact O-N 2.71Å; D26-S30 WeakPolarHBondContact O-CB 3.47Å; D26-S30 PolarHBondContact O-N 3.43Å |
| 27 | S | 93.6 | Very high | 94 | Very high | 50 Ų | 50 | 105.4 Ų | 105.4 | 35% | 0.35 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -60.4 | -43.8 | 174.5 | -174.3 | 0 | 0 | 0 | 0 | 111.1 | R23 M24 A25 S30 K31 | R23-S27 WeakPolarHBondContact O-CB 3.33Å; R23-S27 PolarHBondContact O-N 3.27Å; M24-S27 PolarHBondContact O-N 3.09Å; A25-S27 PolarHBondContact O-N 3.43Å; S27-S30 PolarHBondContact O-N 3.49Å; S27-S30 PolarHBondContact O-OG 3Å; S27-K31 WeakPolarHBondContact O-CG 3.36Å; S27-K31 PolarHBondContact O-N 3.39Å; S27-K31 VanDerWaalsContact O-N 3.09Å |
| 28 | L | 94.9 | Very high | 94.4 | Very high | 109 Ų | 109 | 104.1 Ų | 104.1 | 57% | 0.571 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -65.6 | -45.6 | 177.1 | -174 | 62.5 | 0 | 0 | 0 | 111.9 | M24 A25 D26 S30 K31 V32 | M24-L28 WeakPolarHBondContact O-CB 3.41Å; M24-L28 PolarHBondContact O-N 2.92Å; A25-L28 PolarHBondContact O-N 2.84Å; D26-L28 VanDerWaalsContact C-N 3.33Å; D26-L28 PolarHBondContact O-N 3.29Å; L28-S30 VanDerWaalsContact C-N 3.28Å; L28-S30 PolarHBondContact O-N 2.88Å; L28-K31 PolarHBondContact O-N 3.36Å; L28-K31 VanDerWaalsContact O-N 3.13Å; L28-V32 HydrophobicContact CD1-CG2 4.46Å; L28-V32 HydrophobicContact CG-CG2 4.46Å; L28-V32 WeakPolarHBondContact O-CG2 3.41Å; L28-V32 PolarHBondContact O-N 2.91Å |
| 29 | A | 94.8 | Very high | 94.6 | Very high | 51 Ų | 51 | 103 Ų | 103 | 42% | 0.421 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -59.2 | -40.7 | 177.1 | 0 | 0 | 0 | 0 | 0 | 111.6 | A25 D26 V32 T33 | A25-A29 WeakPolarHBondContact O-CB 3.35Å; A25-A29 PolarHBondContact O-N 3.23Å; D26-A29 PolarHBondContact O-N 2.71Å; A29-V32 PolarHBondContact O-N 3.37Å; A29-T33 WeakPolarHBondContact O-CB 3.45Å; A29-T33 PolarHBondContact O-N 2.91Å; A29-T33 PolarHBondContact O-OG1 3.24Å |
| 30 | S | 95.2 | Very high | 94.8 | Very high | 71 Ų | 71 | 100.2 Ų | 100.2 | 50% | 0.497 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -62.7 | -42.7 | 175.4 | 80.1 | 0 | 0 | 0 | 0 | 112.2 | D26 S27 L28 T33 R34 | D26-S30 WeakPolarHBondContact O-CB 3.47Å; D26-S30 PolarHBondContact O-N 3.43Å; S27-S30 PolarHBondContact O-N 3.49Å; S27-S30 PolarHBondContact O-OG 3Å; L28-S30 VanDerWaalsContact C-N 3.28Å; L28-S30 PolarHBondContact O-N 2.88Å; S30-T33 PolarHBondContact O-N 3.13Å; S30-R34 WeakPolarHBondContact O-CB 3.45Å; S30-R34 PolarHBondContact O-N 3.43Å |
| 31 | K | 96.6 | Very high | 95.1 | Very high | 125 Ų | 125 | 98.8 Ų | 98.8 | 54% | 0.543 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -66.1 | -43 | 177.6 | -71.2 | 171.5 | -176.6 | 178.5 | 0 | 111.7 | S27 L28 R34 L35 | S27-K31 WeakPolarHBondContact O-CG 3.36Å; S27-K31 PolarHBondContact O-N 3.39Å; S27-K31 VanDerWaalsContact O-N 3.09Å; L28-K31 PolarHBondContact O-N 3.36Å; L28-K31 VanDerWaalsContact O-N 3.13Å; K31-R34 PolarHBondContact O-N 2.92Å; K31-L35 WeakPolarHBondContact O-CG 3.38Å; K31-L35 PolarHBondContact O-N 2.82Å |
| 32 | V | 96.6 | Very high | 95.1 | Very high | 83 Ų | 83 | 99.2 Ų | 99.2 | 50% | 0.503 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -63.5 | -43 | 177 | 171.3 | 0 | 0 | 0 | 0 | 110.7 | L28 A29 R34 L35 K36 | L28-V32 HydrophobicContact CD1-CG2 4.46Å; L28-V32 HydrophobicContact CG-CG2 4.46Å; L28-V32 WeakPolarHBondContact O-CG2 3.41Å; L28-V32 PolarHBondContact O-N 2.91Å; A29-V32 PolarHBondContact O-N 3.37Å; V32-R34 VanDerWaalsContact C-N 3.27Å; V32-R34 PolarHBondContact O-N 3.29Å; V32-L35 PolarHBondContact O-N 3.39Å; V32-K36 WeakPolarHBondContact O-CB 3.5Å; V32-K36 PolarHBondContact O-N 3.35Å |
| 33 | T | 95.6 | Very high | 95.2 | Very high | 96 Ų | 96 | 98.6 Ų | 98.6 | 59% | 0.589 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -60.8 | -40.4 | 176 | -59.4 | 0 | 0 | 0 | 0 | 111.1 | A29 S30 K36 S37 | A29-T33 WeakPolarHBondContact O-CB 3.45Å; A29-T33 PolarHBondContact O-N 2.91Å; A29-T33 PolarHBondContact O-OG1 3.24Å; S30-T33 PolarHBondContact O-N 3.13Å; T33-K36 PolarHBondContact O-N 3.3Å; T33-S37 PolarHBondContact O-N 2.99Å |
| 34 | R | 95.8 | Very high | 95.3 | Very high | 187 Ų | 187 | 97.1 Ų | 97.1 | 71% | 0.706 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -67.1 | -42.5 | 177.6 | -154.7 | 170 | -170.2 | -106.8 | 0.7 | 112.3 | S30 K31 V32 K36 S37 L38 | S30-R34 WeakPolarHBondContact O-CB 3.45Å; S30-R34 PolarHBondContact O-N 3.43Å; K31-R34 PolarHBondContact O-N 2.92Å; V32-R34 VanDerWaalsContact C-N 3.27Å; V32-R34 PolarHBondContact O-N 3.29Å; R34-K36 VanDerWaalsContact C-N 3.33Å; R34-S37 WeakPolarHBondContact O-CB 3.46Å; R34-S37 PolarHBondContact O-N 3.27Å; R34-L38 PolarHBondContact O-N 3.35Å |
| 35 | L | 96.1 | Very high | 95.3 | Very high | 120 Ų | 120 | 96.7 Ų | 96.7 | 63% | 0.628 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -62.3 | -40.2 | 173.4 | -75.5 | 170.9 | 0 | 0 | 0 | 112 | K31 V32 S37 L38 A39 | K31-L35 WeakPolarHBondContact O-CG 3.38Å; K31-L35 PolarHBondContact O-N 2.82Å; V32-L35 PolarHBondContact O-N 3.39Å; L35-S37 VanDerWaalsContact C-N 3.33Å; L35-S37 PolarHBondContact O-N 2.99Å; L35-L38 PolarHBondContact O-N 3.4Å; L35-A39 WeakPolarHBondContact O-CB 3.46Å; L35-A39 PolarHBondContact O-N 3.48Å |
| 36 | K | 96.8 | Very high | 95.2 | Very high | 146 Ų | 146 | 96.8 Ų | 96.8 | 64% | 0.635 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -61.3 | -42.2 | 174.8 | -176.4 | -179.3 | 179 | -175.8 | 0 | 111.7 | V32 T33 R34 A39 L40 | V32-K36 WeakPolarHBondContact O-CB 3.5Å; V32-K36 PolarHBondContact O-N 3.35Å; T33-K36 PolarHBondContact O-N 3.3Å; R34-K36 VanDerWaalsContact C-N 3.33Å; K36-A39 PolarHBondContact O-N 3.05Å; K36-L40 HydrophobicContact CG-CD1 4.45Å; K36-L40 WeakPolarHBondContact O-CG 3.24Å; K36-L40 PolarHBondContact O-N 2.88Å |
| 37 | S | 96.1 | Very high | 95.1 | Very high | 60 Ų | 60 | 96.6 Ų | 96.6 | 42% | 0.42 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -61.1 | -48.9 | 174.7 | -165.7 | 0 | 0 | 0 | 0 | 111.1 | T33 R34 L35 A39 L40 D41 | T33-S37 PolarHBondContact O-N 2.99Å; R34-S37 WeakPolarHBondContact O-CB 3.46Å; R34-S37 PolarHBondContact O-N 3.27Å; L35-S37 VanDerWaalsContact C-N 3.33Å; L35-S37 PolarHBondContact O-N 2.99Å; S37-A39 VanDerWaalsContact C-N 3.3Å; S37-A39 PolarHBondContact O-N 2.87Å; S37-L40 PolarHBondContact O-N 3.39Å; S37-L40 VanDerWaalsContact O-N 3.13Å; S37-D41 VanDerWaalsContact O-CG 3.26Å; S37-D41 PolarHBondContact O-N 2.87Å |
| 38 | L | 95.8 | Very high | 95 | Very high | 85 Ų | 85 | 98.5 Ų | 98.5 | 45% | 0.445 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -57.4 | -42 | 176.6 | -97.9 | 136.5 | 0 | 0 | 0 | 112.5 | R34 L35 D41 I42 | R34-L38 PolarHBondContact O-N 3.35Å; L35-L38 PolarHBondContact O-N 3.4Å; L38-D41 PolarHBondContact O-N 3.34Å; L38-I42 WeakPolarHBondContact O-CD1 3.42Å; L38-I42 VanDerWaalsContact O-CG1 3.24Å; L38-I42 WeakPolarHBondContact O-CG1 3.31Å; L38-I42 PolarHBondContact O-N 2.93Å |
| 39 | A | 94.9 | Very high | 94.8 | Very high | 60 Ų | 60 | 99.2 Ų | 99.2 | 50% | 0.496 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -64 | -40.8 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | L35 K36 S37 I42 D43 | L35-A39 WeakPolarHBondContact O-CB 3.46Å; L35-A39 PolarHBondContact O-N 3.48Å; K36-A39 PolarHBondContact O-N 3.05Å; S37-A39 VanDerWaalsContact C-N 3.3Å; S37-A39 PolarHBondContact O-N 2.87Å; A39-I42 PolarHBondContact O-N 3.03Å; A39-D43 WeakPolarHBondContact O-CB 3.45Å; A39-D43 PolarHBondContact O-N 3.5Å |
| 40 | L | 96.1 | Very high | 94.5 | Very high | 85 Ų | 85 | 101.2 Ų | 101.2 | 45% | 0.445 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -67.1 | -37.9 | 175.1 | -74.8 | 168.8 | 0 | 0 | 0 | 112.4 | K36 S37 D43 R44 | K36-L40 HydrophobicContact CG-CD1 4.45Å; K36-L40 WeakPolarHBondContact O-CG 3.24Å; K36-L40 PolarHBondContact O-N 2.88Å; S37-L40 PolarHBondContact O-N 3.39Å; S37-L40 VanDerWaalsContact O-N 3.13Å; L40-D43 PolarHBondContact O-N 2.88Å; L40-R44 WeakPolarHBondContact O-CG 3.46Å; L40-R44 PolarHBondContact O-N 3.41Å; L40-R44 VanDerWaalsContact O-N 3.1Å |
| 41 | D | 96 | Very high | 94.1 | Very high | 73 Ų | 73 | 104.5 Ų | 104.5 | 39% | 0.39 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -66.7 | -42.4 | 177.1 | -66 | -25.3 | 0 | 0 | 0 | 110.5 | S37 L38 D43 R44 D45 | S37-D41 VanDerWaalsContact O-CG 3.26Å; S37-D41 PolarHBondContact O-N 2.87Å; L38-D41 PolarHBondContact O-N 3.34Å; D41-D43 PolarHBondContact O-N 3.36Å; D41-R44 PolarHBondContact O-N 3.47Å; D41-D45 WeakPolarHBondContact O-CB 3.45Å; D41-D45 PolarHBondContact O-N 3.44Å |
| 42 | I | 94.7 | Very high | 93.6 | Very high | 106 Ų | 106 | 106.6 Ų | 106.6 | 54% | 0.544 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -62.3 | -41.6 | 174.8 | -69 | 164.3 | 0 | 0 | 0 | 111.7 | L38 A39 R44 D45 A46 | L38-I42 WeakPolarHBondContact O-CD1 3.42Å; L38-I42 VanDerWaalsContact O-CG1 3.24Å; L38-I42 WeakPolarHBondContact O-CG1 3.31Å; L38-I42 PolarHBondContact O-N 2.93Å; A39-I42 PolarHBondContact O-N 3.03Å; I42-R44 VanDerWaalsContact C-N 3.35Å; I42-D45 PolarHBondContact O-N 3.38Å; I42-A46 VanDerWaalsContact O-CB 3.31Å; I42-A46 WeakPolarHBondContact O-CB 3.42Å; I42-A46 PolarHBondContact O-N 3.13Å |
| 43 | D | 95 | Very high | 93.1 | Very high | 106 Ų | 106 | 106.9 Ų | 106.9 | 57% | 0.567 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -61.1 | -45 | 178.6 | -169.3 | 57.6 | 0 | 0 | 0 | 111.1 | A39 L40 D41 A46 E47 | A39-D43 WeakPolarHBondContact O-CB 3.45Å; A39-D43 PolarHBondContact O-N 3.5Å; L40-D43 PolarHBondContact O-N 2.88Å; D41-D43 PolarHBondContact O-N 3.36Å; D43-A46 PolarHBondContact O-N 2.87Å; D43-E47 PolarHBondContact O-N 3.18Å |
| 44 | R | 94.4 | Very high | 92.7 | Very high | 155 Ų | 155 | 107.6 Ų | 107.6 | 59% | 0.585 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -64.7 | -45.9 | 174.6 | -72.3 | 174.7 | 178.6 | 169.1 | -1 | 112.6 | L40 D41 I42 A46 E47 D48 | L40-R44 WeakPolarHBondContact O-CG 3.46Å; L40-R44 PolarHBondContact O-N 3.41Å; L40-R44 VanDerWaalsContact O-N 3.1Å; D41-R44 PolarHBondContact O-N 3.47Å; I42-R44 VanDerWaalsContact C-N 3.35Å; R44-A46 VanDerWaalsContact C-N 3.26Å; R44-A46 PolarHBondContact O-N 2.89Å; R44-E47 PolarHBondContact O-N 2.87Å; R44-D48 PolarHBondContact O-N 3.1Å |
| 45 | D | 93.2 | Very high | 92.1 | Very high | 93 Ų | 93 | 100.3 Ų | 100.3 | 50% | 0.497 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -60.4 | -39.5 | 178 | -82.9 | -3.3 | 0 | 0 | 0 | 111 | D41 I42 Q49 | D41-D45 WeakPolarHBondContact O-CB 3.45Å; D41-D45 PolarHBondContact O-N 3.44Å; I42-D45 PolarHBondContact O-N 3.38Å; D45-Q49 WeakPolarHBondContact O-CB 3.16Å; D45-Q49 WeakPolarHBondContact O-CG 3.21Å; D45-Q49 PolarHBondContact O-N 2.9Å |
| 46 | A | 92.9 | Very high | 91.5 | Very high | 54 Ų | 54 | 98.8 Ų | 98.8 | 45% | 0.446 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -65.6 | -41.6 | 176 | 0 | 0 | 0 | 0 | 0 | 111.7 | I42 D43 R44 N50 | I42-A46 VanDerWaalsContact O-CB 3.31Å; I42-A46 WeakPolarHBondContact O-CB 3.42Å; I42-A46 PolarHBondContact O-N 3.13Å; D43-A46 PolarHBondContact O-N 2.87Å; R44-A46 VanDerWaalsContact C-N 3.26Å; R44-A46 PolarHBondContact O-N 2.89Å; A46-N50 VanDerWaalsContact O-CB 3.32Å; A46-N50 WeakPolarHBondContact O-CB 3.33Å; A46-N50 PolarHBondContact O-N 2.9Å |
| 47 | E | 92.1 | Very high | 90.9 | Very high | 114 Ų | 114 | 97.3 Ų | 97.3 | 53% | 0.533 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -66.5 | -43.8 | 177.6 | -154.6 | -167.7 | 150 | 0 | 0 | 112 | D43 R44 N50 R51 | D43-E47 PolarHBondContact O-N 3.18Å; R44-E47 PolarHBondContact O-N 2.87Å; E47-N50 PolarHBondContact O-N 2.89Å; E47-R51 PolarHBondContact O-N 2.87Å; E47-R51 IonicContact OE1-NH2 2.75Å; E47-R51 PolarHBondContact OE1-NH2 2.91Å |
| 48 | D | 91.9 | Very high | 90.3 | Very high | 90 Ų | 90 | 97.7 Ų | 97.7 | 48% | 0.481 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -67.6 | -40.2 | 177.1 | -84.2 | -12.3 | 0 | 0 | 0 | 111.8 | R44 R51 Y52 | R44-D48 PolarHBondContact O-N 3.1Å; D48-R51 PolarHBondContact O-N 3.16Å; D48-R51 IonicContact OD1-CZ 3.29Å; D48-R51 IonicContact OD1-NH1 3.9Å; D48-R51 PolarHBondContact OD1-NH1 3.33Å; D48-Y52 WeakPolarHBondContact O-CB 3.32Å; D48-Y52 PolarHBondContact O-N 3.45Å |
| 49 | Q | 90.3 | Very high | 89.9 | Confident | 123 Ų | 123 | 98.8 Ų | 98.8 | 58% | 0.575 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -63.8 | -40.4 | 172.6 | -76.5 | 175.4 | 30.9 | 0 | 0 | 111.7 | D45 R51 Y52 L53 | D45-Q49 WeakPolarHBondContact O-CB 3.16Å; D45-Q49 WeakPolarHBondContact O-CG 3.21Å; D45-Q49 PolarHBondContact O-N 2.9Å; Q49-R51 VanDerWaalsContact C-N 3.31Å; Q49-R51 PolarHBondContact O-N 3Å; Q49-Y52 WeakPolarHBondContact O-CB 3.42Å; Q49-Y52 PolarHBondContact O-N 3.04Å; Q49-Y52 VanDerWaalsContact O-N 3.16Å; Q49-L53 WeakPolarHBondContact O-CG 3.48Å; Q49-L53 PolarHBondContact O-N 3.34Å |
| 50 | N | 89 | Confident | 89.5 | Confident | 94 Ų | 94 | 102.6 Ų | 102.6 | 50% | 0.503 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -62.3 | -42.3 | 176.6 | -166.5 | 71.5 | 0 | 0 | 0 | 111.1 | A46 E47 Y52 L53 D54 | A46-N50 VanDerWaalsContact O-CB 3.32Å; A46-N50 WeakPolarHBondContact O-CB 3.33Å; A46-N50 PolarHBondContact O-N 2.9Å; E47-N50 PolarHBondContact O-N 2.89Å; N50-Y52 VanDerWaalsContact C-N 3.31Å; N50-Y52 PolarHBondContact O-N 3.34Å; N50-L53 PolarHBondContact O-N 3.49Å; N50-D54 PolarHBondContact O-N 3.49Å |
| 51 | R | 86.6 | Confident | 89 | Confident | 140 Ų | 140 | 102.6 Ų | 102.6 | 53% | 0.528 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -63.3 | -36.9 | 173.9 | -164.7 | 179.8 | -62 | 127.4 | 5.1 | 112.4 | E47 D48 Q49 G55 | E47-R51 PolarHBondContact O-N 2.87Å; E47-R51 IonicContact OE1-NH2 2.75Å; E47-R51 PolarHBondContact OE1-NH2 2.91Å; D48-R51 PolarHBondContact O-N 3.16Å; D48-R51 IonicContact OD1-CZ 3.29Å; D48-R51 IonicContact OD1-NH1 3.9Å; D48-R51 PolarHBondContact OD1-NH1 3.33Å; Q49-R51 VanDerWaalsContact C-N 3.31Å; Q49-R51 PolarHBondContact O-N 3Å; R51-G55 PolarHBondContact O-N 3.16Å |
| 52 | Y | 85.3 | Confident | 88.6 | Confident | 168 Ų | 168 | 102.3 Ų | 102.3 | 66% | 0.659 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -65.5 | -41.7 | 174 | 179.9 | -103.8 | 0 | 0 | 0 | 112.1 | D48 Q49 N50 G55 M56 | D48-Y52 WeakPolarHBondContact O-CB 3.32Å; D48-Y52 PolarHBondContact O-N 3.45Å; Q49-Y52 WeakPolarHBondContact O-CB 3.42Å; Q49-Y52 PolarHBondContact O-N 3.04Å; Q49-Y52 VanDerWaalsContact O-N 3.16Å; N50-Y52 VanDerWaalsContact C-N 3.31Å; N50-Y52 PolarHBondContact O-N 3.34Å; Y52-G55 PolarHBondContact O-N 3.01Å; Y52-M56 PolarHBondContact O-N 3.44Å |
| 53 | L | 87.6 | Confident | 88.2 | Confident | 90 Ų | 90 | 103.3 Ų | 103.3 | 47% | 0.471 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -62.6 | -40.7 | 175.8 | -69 | 174.8 | 0 | 0 | 0 | 111.9 | Q49 N50 G55 M56 D57 | Q49-L53 WeakPolarHBondContact O-CG 3.48Å; Q49-L53 PolarHBondContact O-N 3.34Å; N50-L53 PolarHBondContact O-N 3.49Å; L53-G55 VanDerWaalsContact C-N 3.31Å; L53-G55 PolarHBondContact O-N 3.36Å; L53-M56 HydrophobicContact CD2-CE 3.35Å; L53-M56 WeakPolarHBondContact O-CB 3.37Å; L53-M56 PolarHBondContact O-N 3.23Å; L53-M56 VanDerWaalsContact O-N 3.16Å; L53-D57 PolarHBondContact O-N 3.43Å |
| 54 | D | 86.4 | Confident | 87.9 | Confident | 110 Ų | 110 | 101.4 Ų | 101.4 | 59% | 0.588 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -61.6 | -38.7 | 174.8 | -72.4 | -22.2 | 0 | 0 | 0 | 111.9 | N50 M56 | N50-D54 PolarHBondContact O-N 3.49Å; D54-M56 VanDerWaalsContact C-N 3.34Å |
| 55 | G | 82.1 | Confident | 87.5 | Confident | 34 Ų | 34 | 96.1 Ų | 96.1 | 35% | 0.351 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -67.2 | -34 | 174.3 | 0 | 0 | 0 | 0 | 0 | 113.3 | R51 Y52 L53 D57 S58 D59 | R51-G55 PolarHBondContact O-N 3.16Å; Y52-G55 PolarHBondContact O-N 3.01Å; L53-G55 VanDerWaalsContact C-N 3.31Å; L53-G55 PolarHBondContact O-N 3.36Å; G55-D57 PolarHBondContact O-N 3.29Å; G55-S58 WeakPolarHBondContact O-CB 3.32Å; G55-S58 PolarHBondContact O-N 2.86Å; G55-D59 PolarHBondContact O-N 3.29Å; G55-D59 VanDerWaalsContact O-N 3.16Å |
| 56 | M | 85.1 | Confident | 87.4 | Confident | 88 Ų | 88 | 97.8 Ų | 97.8 | 43% | 0.433 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -67.1 | -35.1 | -178.3 | -170.8 | 174.7 | 54.5 | 0 | 0 | 113.1 | Y52 L53 D54 S58 D59 F60 | Y52-M56 PolarHBondContact O-N 3.44Å; L53-M56 HydrophobicContact CD2-CE 3.35Å; L53-M56 WeakPolarHBondContact O-CB 3.37Å; L53-M56 PolarHBondContact O-N 3.23Å; L53-M56 VanDerWaalsContact O-N 3.16Å; D54-M56 VanDerWaalsContact C-N 3.34Å; M56-S58 VanDerWaalsContact C-N 3.33Å; M56-S58 PolarHBondContact O-N 3.2Å; M56-D59 PolarHBondContact O-N 3.02Å; M56-F60 WeakPolarHBondContact O-CB 3.43Å; M56-F60 PolarHBondContact O-N 3.24Å |
| 57 | D | 83.2 | Confident | 87.2 | Confident | 115 Ų | 115 | 100.7 Ų | 100.7 | 62% | 0.615 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -63.3 | -39.7 | 175.5 | -174.7 | 57.2 | 0 | 0 | 0 | 111.9 | L53 G55 F60 T61 | L53-D57 PolarHBondContact O-N 3.43Å; G55-D57 PolarHBondContact O-N 3.29Å; D57-F60 PolarHBondContact O-N 2.91Å; D57-T61 VanDerWaalsContact O-CB 3.3Å; D57-T61 WeakPolarHBondContact O-CB 3.4Å; D57-T61 PolarHBondContact O-N 3.46Å; D57-T61 PolarHBondContact O-OG1 2.76Å |
| 58 | S | 84.3 | Confident | 86.9 | Confident | 69 Ų | 69 | 99.2 Ų | 99.2 | 48% | 0.483 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -63.3 | -44.8 | 174.7 | 169.9 | 0 | 0 | 0 | 0 | 111.9 | G55 M56 T61 S62 | G55-S58 WeakPolarHBondContact O-CB 3.32Å; G55-S58 PolarHBondContact O-N 2.86Å; M56-S58 VanDerWaalsContact C-N 3.33Å; M56-S58 PolarHBondContact O-N 3.2Å; S58-T61 PolarHBondContact O-N 3.45Å; S58-S62 WeakPolarHBondContact O-CB 3.45Å; S58-S62 PolarHBondContact O-N 3.33Å; S58-S62 PolarHBondContact O-OG 2.8Å |
| 59 | D | 86.4 | Confident | 86.6 | Confident | 107 Ų | 107 | 96.5 Ų | 96.5 | 57% | 0.572 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -65.2 | -41.9 | 177.7 | -74.2 | -12.6 | 0 | 0 | 0 | 111.4 | G55 M56 S62 M63 | G55-D59 PolarHBondContact O-N 3.29Å; G55-D59 VanDerWaalsContact O-N 3.16Å; M56-D59 PolarHBondContact O-N 3.02Å; D59-S62 PolarHBondContact O-N 3.48Å; D59-M63 WeakPolarHBondContact O-CG 3.08Å; D59-M63 PolarHBondContact O-N 2.91Å |
| 60 | F | 86.7 | Confident | 86.3 | Confident | 140 Ų | 140 | 94.2 Ų | 94.2 | 61% | 0.614 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -66.3 | -40.4 | 178.2 | -152.5 | -88.1 | 0 | 0 | 0 | 112.1 | M56 D57 M63 T64 | M56-F60 WeakPolarHBondContact O-CB 3.43Å; M56-F60 PolarHBondContact O-N 3.24Å; D57-F60 PolarHBondContact O-N 2.91Å; F60-M63 PolarHBondContact O-N 2.89Å; F60-T64 WeakPolarHBondContact O-CB 3.24Å; F60-T64 PolarHBondContact O-N 2.88Å; F60-T64 PolarHBondContact O-OG1 2.92Å |
| 61 | T | 86.8 | Confident | 86 | Confident | 85 Ų | 85 | 94.3 Ų | 94.3 | 52% | 0.521 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -62.9 | -42.7 | 173.6 | -65.7 | 0 | 0 | 0 | 0 | 111.1 | D57 S58 T64 G65 | D57-T61 VanDerWaalsContact O-CB 3.3Å; D57-T61 WeakPolarHBondContact O-CB 3.4Å; D57-T61 PolarHBondContact O-N 3.46Å; D57-T61 PolarHBondContact O-OG1 2.76Å; S58-T61 PolarHBondContact O-N 3.45Å; T61-T64 PolarHBondContact O-N 3.42Å; T61-G65 PolarHBondContact O-N 2.95Å |
| 62 | S | 87.1 | Confident | 85.8 | Confident | 67 Ų | 67 | 95 Ų | 95 | 47% | 0.469 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -63.7 | -46.1 | 177.7 | -63.5 | 0 | 0 | 0 | 0 | 111.9 | S58 D59 T64 G65 L66 | S58-S62 WeakPolarHBondContact O-CB 3.45Å; S58-S62 PolarHBondContact O-N 3.33Å; S58-S62 PolarHBondContact O-OG 2.8Å; D59-S62 PolarHBondContact O-N 3.48Å; S62-T64 VanDerWaalsContact C-N 3.34Å; S62-T64 PolarHBondContact O-N 3.16Å; S62-G65 PolarHBondContact O-N 3.32Å; S62-L66 WeakPolarHBondContact O-CG 3.37Å; S62-L66 PolarHBondContact O-N 3.35Å; S62-L66 VanDerWaalsContact O-N 3.08Å |
| 63 | M | 86.7 | Confident | 85.7 | Confident | 128 Ų | 128 | 96.6 Ų | 96.6 | 63% | 0.631 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -60.3 | -43 | 173.7 | -75 | -170.5 | 158.6 | 0 | 0 | 111.9 | D59 F60 G65 L66 L67 | D59-M63 WeakPolarHBondContact O-CG 3.08Å; D59-M63 PolarHBondContact O-N 2.91Å; F60-M63 PolarHBondContact O-N 2.89Å; M63-G65 VanDerWaalsContact C-N 3.34Å; M63-G65 PolarHBondContact O-N 3.29Å; M63-L66 PolarHBondContact O-N 2.93Å; M63-L67 WeakPolarHBondContact O-CB 3.3Å; M63-L67 VanDerWaalsContact O-CG 3.32Å; M63-L67 WeakPolarHBondContact O-CG 3.45Å; M63-L67 PolarHBondContact O-N 3.46Å |
| 64 | T | 87.6 | Confident | 85.3 | Confident | 65 Ų | 65 | 99.3 Ų | 99.3 | 40% | 0.399 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -62.2 | -40.3 | 177.2 | -61.2 | 0 | 0 | 0 | 0 | 111.8 | F60 T61 S62 T68 | F60-T64 WeakPolarHBondContact O-CB 3.24Å; F60-T64 PolarHBondContact O-N 2.88Å; F60-T64 PolarHBondContact O-OG1 2.92Å; T61-T64 PolarHBondContact O-N 3.42Å; S62-T64 VanDerWaalsContact C-N 3.34Å; S62-T64 PolarHBondContact O-N 3.16Å; T64-T68 VanDerWaalsContact O-CB 3.24Å; T64-T68 WeakPolarHBondContact O-CB 3.34Å; T64-T68 PolarHBondContact O-N 2.86Å; T64-T68 PolarHBondContact O-OG1 2.91Å |
| 65 | G | 86.4 | Confident | 85 | Confident | 45 Ų | 45 | 97.1 Ų | 97.1 | 46% | 0.464 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -62.8 | -45 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.9 | T61 S62 M63 T68 G69 | T61-G65 PolarHBondContact O-N 2.95Å; S62-G65 PolarHBondContact O-N 3.32Å; M63-G65 VanDerWaalsContact C-N 3.34Å; M63-G65 PolarHBondContact O-N 3.29Å; G65-T68 PolarHBondContact O-N 2.89Å; G65-G69 PolarHBondContact O-N 2.89Å |
| 66 | L | 90.9 | Very high | 84.8 | Confident | 128 Ų | 128 | 98.2 Ų | 98.2 | 67% | 0.67 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -65 | -44.5 | 177.4 | -68.2 | 175.8 | 0 | 0 | 0 | 112.3 | S62 M63 G69 S70 | S62-L66 WeakPolarHBondContact O-CG 3.37Å; S62-L66 PolarHBondContact O-N 3.35Å; S62-L66 VanDerWaalsContact O-N 3.08Å; M63-L66 PolarHBondContact O-N 2.93Å; L66-G69 PolarHBondContact O-N 3.41Å; L66-S70 WeakPolarHBondContact O-CB 3.41Å; L66-S70 PolarHBondContact O-N 3.46Å; L66-S70 PolarHBondContact O-OG 3.37Å |
| 67 | L | 87.8 | Confident | 84.3 | Confident | 114 Ų | 114 | 100 Ų | 100 | 60% | 0.597 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -64 | -45.1 | 176.3 | -70.9 | 172.6 | 0 | 0 | 0 | 110.9 | M63 G69 S70 V71 | M63-L67 WeakPolarHBondContact O-CB 3.3Å; M63-L67 VanDerWaalsContact O-CG 3.32Å; M63-L67 WeakPolarHBondContact O-CG 3.45Å; M63-L67 PolarHBondContact O-N 3.46Å; L67-G69 VanDerWaalsContact C-N 3.32Å; L67-G69 PolarHBondContact O-N 3.44Å; L67-S70 CarbonylContact O-C 3.6Å; L67-S70 WeakPolarHBondContact O-CB 3.5Å; L67-S70 PolarHBondContact O-N 3.5Å; L67-S70 VanDerWaalsContact O-N 3.08Å; L67-V71 WeakPolarHBondContact O-CG2 3.42Å; L67-V71 PolarHBondContact O-N 2.8Å |
| 68 | T | 86.8 | Confident | 83.7 | Confident | 83 Ų | 83 | 97.1 Ų | 97.1 | 51% | 0.509 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -58.3 | -43.3 | 176.1 | -62.8 | 0 | 0 | 0 | 0 | 111.6 | T64 G65 S70 V71 K72 | T64-T68 VanDerWaalsContact O-CB 3.24Å; T64-T68 WeakPolarHBondContact O-CB 3.34Å; T64-T68 PolarHBondContact O-N 2.86Å; T64-T68 PolarHBondContact O-OG1 2.91Å; G65-T68 PolarHBondContact O-N 2.89Å; T68-S70 VanDerWaalsContact C-N 3.34Å; T68-S70 PolarHBondContact O-N 2.82Å; T68-V71 PolarHBondContact O-N 3.37Å; T68-K72 WeakPolarHBondContact O-CB 3.41Å; T68-K72 PolarHBondContact O-N 2.93Å |
| 69 | G | 85.4 | Confident | 82.9 | Confident | 34 Ų | 34 | 102.3 Ų | 102.3 | 35% | 0.351 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -60.7 | -42.1 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112.9 | G65 L66 L67 K72 R73 | G65-G69 PolarHBondContact O-N 2.89Å; L66-G69 PolarHBondContact O-N 3.41Å; L67-G69 VanDerWaalsContact C-N 3.32Å; L67-G69 PolarHBondContact O-N 3.44Å; G69-K72 PolarHBondContact O-N 2.87Å; G69-R73 PolarHBondContact O-N 3.48Å |
| 70 | S | 83.7 | Confident | 81.8 | Confident | 75 Ų | 75 | 100.6 Ų | 100.6 | 52% | 0.524 | 55% | 0.55 | S | S | . | * | H | α-helix | trans | -66.1 | -47.1 | 178 | -59.6 | 0 | 0 | 0 | 0 | 111.8 | L66 L67 T68 K72 R73 F74 | L66-S70 WeakPolarHBondContact O-CB 3.41Å; L66-S70 PolarHBondContact O-N 3.46Å; L66-S70 PolarHBondContact O-OG 3.37Å; L67-S70 CarbonylContact O-C 3.6Å; L67-S70 WeakPolarHBondContact O-CB 3.5Å; L67-S70 PolarHBondContact O-N 3.5Å; L67-S70 VanDerWaalsContact O-N 3.08Å; T68-S70 VanDerWaalsContact C-N 3.34Å; T68-S70 PolarHBondContact O-N 2.82Å; S70-K72 VanDerWaalsContact C-N 3.32Å; S70-K72 PolarHBondContact O-N 3.29Å; S70-R73 PolarHBondContact O-N 3.46Å; S70-F74 WeakPolarHBondContact O-CB 3.3Å; S70-F74 PolarHBondContact O-N 2.92Å |
| 71 | V | 83.5 | Confident | 80.7 | Confident | 95 Ų | 95 | 96.1 Ų | 96.1 | 58% | 0.576 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -64.4 | -38.2 | 176.7 | -170.8 | 0 | 0 | 0 | 0 | 110.5 | L67 T68 F74 S75 | L67-V71 WeakPolarHBondContact O-CG2 3.42Å; L67-V71 PolarHBondContact O-N 2.8Å; T68-V71 PolarHBondContact O-N 3.37Å; V71-F74 PolarHBondContact O-N 2.81Å; V71-S75 WeakPolarHBondContact O-CB 3.17Å; V71-S75 PolarHBondContact O-N 3.37Å |
| 72 | K | 82.6 | Confident | 79.5 | Confident | 156 Ų | 156 | 99.3 Ų | 99.3 | 68% | 0.678 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -62.9 | -47.5 | 176.5 | -169.9 | 174.7 | -176 | 178.5 | 0 | 111.6 | T68 G69 S70 S75 A76 | T68-K72 WeakPolarHBondContact O-CB 3.41Å; T68-K72 PolarHBondContact O-N 2.93Å; G69-K72 PolarHBondContact O-N 2.87Å; S70-K72 VanDerWaalsContact C-N 3.32Å; S70-K72 PolarHBondContact O-N 3.29Å; K72-S75 PolarHBondContact O-N 3.38Å; K72-S75 PolarHBondContact O-OG 3.45Å; K72-A76 WeakPolarHBondContact O-CB 3.38Å; K72-A76 PolarHBondContact O-N 3.45Å |
| 73 | R | 81.9 | Confident | 78.3 | Confident | 201 Ų | 201 | 100.3 Ų | 100.3 | 76% | 0.758 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -62.2 | -43 | 174.4 | -84.6 | -178 | 168.9 | 152.6 | -2.5 | 112.1 | G69 S70 A76 M77 | G69-R73 PolarHBondContact O-N 3.48Å; S70-R73 PolarHBondContact O-N 3.46Å; R73-A76 PolarHBondContact O-N 3.08Å; R73-M77 WeakPolarHBondContact O-CB 3.38Å; R73-M77 PolarHBondContact O-N 3.28Å |
| 74 | F | 81 | Confident | 77.3 | Confident | 146 Ų | 146 | 98.9 Ų | 98.9 | 64% | 0.64 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -62.7 | -44.3 | 176.1 | -174.1 | -96.9 | 0 | 0 | 0 | 111.8 | S70 V71 A76 M77 A78 | S70-F74 WeakPolarHBondContact O-CB 3.3Å; S70-F74 PolarHBondContact O-N 2.92Å; V71-F74 PolarHBondContact O-N 2.81Å; F74-A76 VanDerWaalsContact C-N 3.35Å; F74-A76 PolarHBondContact O-N 3.47Å; F74-M77 PolarHBondContact O-N 3.08Å; F74-A78 VanDerWaalsContact O-CB 3.3Å; F74-A78 WeakPolarHBondContact O-CB 3.2Å; F74-A78 PolarHBondContact O-N 2.99Å |
| 75 | S | 79.1 | Confident | 76.5 | Confident | 64 Ų | 64 | 105.3 Ų | 105.3 | 45% | 0.448 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -63.8 | -39.4 | 176.6 | 84.5 | 0 | 0 | 0 | 0 | 112.1 | V71 K72 A78 R79 | V71-S75 WeakPolarHBondContact O-CB 3.17Å; V71-S75 PolarHBondContact O-N 3.37Å; K72-S75 PolarHBondContact O-N 3.38Å; K72-S75 PolarHBondContact O-OG 3.45Å; S75-A78 PolarHBondContact O-N 2.96Å; S75-R79 WeakPolarHBondContact O-CB 3.36Å; S75-R79 PolarHBondContact O-N 3.11Å |
| 76 | A | 77.4 | Confident | 75.9 | Confident | 58 Ų | 58 | 109.9 Ų | 109.9 | 48% | 0.479 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -65.8 | -40.9 | 177 | 0 | 0 | 0 | 0 | 0 | 111 | K72 R73 F74 R79 S80 | K72-A76 WeakPolarHBondContact O-CB 3.38Å; K72-A76 PolarHBondContact O-N 3.45Å; R73-A76 PolarHBondContact O-N 3.08Å; F74-A76 VanDerWaalsContact C-N 3.35Å; F74-A76 PolarHBondContact O-N 3.47Å; A76-R79 PolarHBondContact O-N 3.26Å; A76-S80 VanDerWaalsContact O-CB 3.28Å; A76-S80 WeakPolarHBondContact O-CB 3.33Å; A76-S80 PolarHBondContact O-N 3.17Å; A76-S80 PolarHBondContact O-OG 3.37Å |
| 77 | M | 74.2 | Confident | 75.3 | Confident | 125 Ų | 125 | 109.6 Ų | 109.6 | 62% | 0.616 | 56% | 0.564 | S | S | * | * | H | α-helix | trans | -68.4 | -44.1 | 176.4 | -166 | -170.6 | -40.6 | 0 | 0 | 112.3 | R73 F74 R79 S80 G81 | R73-M77 WeakPolarHBondContact O-CB 3.38Å; R73-M77 PolarHBondContact O-N 3.28Å; F74-M77 PolarHBondContact O-N 3.08Å; M77-R79 VanDerWaalsContact C-N 3.29Å; M77-R79 PolarHBondContact O-N 3.45Å; M77-S80 PolarHBondContact O-N 3.39Å; M77-S80 PolarHBondContact O-OG 3.42Å; M77-S80 VanDerWaalsContact O-OG 3.08Å; M77-G81 PolarHBondContact O-N 3.32Å; M77-G81 VanDerWaalsContact O-N 3.15Å |
| 78 | A | 72.6 | Confident | 74.9 | Confident | 54 Ų | 54 | 109.4 Ų | 109.4 | 45% | 0.446 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -64.9 | -33.6 | 176 | 0 | 0 | 0 | 0 | 0 | 112.1 | F74 S75 | F74-A78 VanDerWaalsContact O-CB 3.3Å; F74-A78 WeakPolarHBondContact O-CB 3.2Å; F74-A78 PolarHBondContact O-N 2.99Å; S75-A78 PolarHBondContact O-N 2.96Å |
| 79 | R | 66 | Low | 74.6 | Confident | 179 Ų | 179 | 109.3 Ų | 109.3 | 68% | 0.675 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -79.7 | -38.9 | 177.8 | -158.5 | 170.8 | -169.4 | 162.5 | 1.9 | 112.1 | S75 A76 M77 G81 R82 D83 | S75-R79 WeakPolarHBondContact O-CB 3.36Å; S75-R79 PolarHBondContact O-N 3.11Å; A76-R79 PolarHBondContact O-N 3.26Å; M77-R79 VanDerWaalsContact C-N 3.29Å; M77-R79 PolarHBondContact O-N 3.45Å; R79-G81 VanDerWaalsContact C-N 3.32Å; R79-G81 PolarHBondContact O-N 3.28Å; R79-R82 WeakPolarHBondContact O-CB 3.31Å; R79-R82 PolarHBondContact O-N 3.05Å; R79-D83 PolarHBondContact O-N 3.15Å |
| 80 | S | 63.4 | Low | 74.6 | Confident | 70 Ų | 70 | 109.9 Ų | 109.9 | 49% | 0.49 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -64.7 | -34.7 | 177.2 | 74.1 | 0 | 0 | 0 | 0 | 112.5 | A76 M77 R82 D83 N84 | A76-S80 VanDerWaalsContact O-CB 3.28Å; A76-S80 WeakPolarHBondContact O-CB 3.33Å; A76-S80 PolarHBondContact O-N 3.17Å; A76-S80 PolarHBondContact O-OG 3.37Å; M77-S80 PolarHBondContact O-N 3.39Å; M77-S80 PolarHBondContact O-OG 3.42Å; M77-S80 VanDerWaalsContact O-OG 3.08Å; S80-R82 PolarHBondContact O-N 3.43Å; S80-D83 PolarHBondContact O-N 3.17Å; S80-N84 PolarHBondContact O-N 3.48Å |
| 81 | G | 63.3 | Low | 74.6 | Confident | 47 Ų | 47 | 113 Ų | 113 | 49% | 0.485 | 58% | 0.579 | S | S | . | * | H | α-helix | trans | -60.8 | -28.3 | 171.8 | 0 | 0 | 0 | 0 | 0 | 113.7 | M77 R79 R85 | M77-G81 PolarHBondContact O-N 3.32Å; M77-G81 VanDerWaalsContact O-N 3.15Å; R79-G81 VanDerWaalsContact C-N 3.32Å; R79-G81 PolarHBondContact O-N 3.28Å; G81-R85 PolarHBondContact O-N 3.35Å |
| 82 | R | 61.9 | Low | 74.8 | Confident | 152 Ų | 152 | 110.9 Ų | 110.9 | 57% | 0.574 | 57% | 0.571 | S | S | * | * | H | α-helix | trans | -79.5 | -40.6 | 179.5 | -170.7 | 177.3 | -66.2 | 119.7 | 0.1 | 112.7 | R79 S80 R85 K86 | R79-R82 WeakPolarHBondContact O-CB 3.31Å; R79-R82 PolarHBondContact O-N 3.05Å; S80-R82 PolarHBondContact O-N 3.43Å; R82-R85 PolarHBondContact O-N 3.47Å; R82-K86 PolarHBondContact O-N 3.34Å |
| 83 | D | 62.7 | Low | 75.3 | Confident | 87 Ų | 87 | 107.4 Ų | 107.4 | 47% | 0.465 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -71.3 | -36.3 | 179.3 | -75.6 | -19.3 | 0 | 0 | 0 | 111.8 | R79 S80 R85 K86 L87 | R79-D83 PolarHBondContact O-N 3.15Å; S80-D83 PolarHBondContact O-N 3.17Å; D83-R85 VanDerWaalsContact C-N 3.29Å; D83-R85 PolarHBondContact O-N 2.83Å; D83-K86 PolarHBondContact O-N 3Å; D83-L87 PolarHBondContact O-N 3.4Å |
| 84 | N | 65.2 | Low | 75.9 | Confident | 98 Ų | 98 | 99.7 Ų | 99.7 | 52% | 0.524 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -61.9 | -38 | 173.9 | -161.6 | 26.2 | 0 | 0 | 0 | 112 | S80 K86 L87 L88 | S80-N84 PolarHBondContact O-N 3.48Å; N84-K86 VanDerWaalsContact C-N 3.34Å; N84-K86 PolarHBondContact O-N 3.14Å; N84-L87 PolarHBondContact O-N 3.08Å; N84-L88 WeakPolarHBondContact O-CB 3.37Å; N84-L88 VanDerWaalsContact O-CG 3.27Å; N84-L88 WeakPolarHBondContact O-CG 3.28Å; N84-L88 PolarHBondContact O-N 3.47Å |
| 85 | R | 71.1 | Confident | 76.4 | Confident | 201 Ų | 201 | 98.7 Ų | 98.7 | 76% | 0.758 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -66.5 | -34 | 176.5 | -167 | 171.8 | -177.8 | -99.1 | 1.6 | 112.8 | G81 R82 D83 C89 | G81-R85 PolarHBondContact O-N 3.35Å; R82-R85 PolarHBondContact O-N 3.47Å; D83-R85 VanDerWaalsContact C-N 3.29Å; D83-R85 PolarHBondContact O-N 2.83Å; R85-C89 WeakPolarHBondContact O-CB 3.22Å; R85-C89 PolarHBondContact O-N 2.91Å; R85-C89 VanDerWaalsContact O-N 3.11Å |
| 86 | K | 74.1 | Confident | 77.1 | Confident | 140 Ų | 140 | 100.3 Ų | 100.3 | 61% | 0.609 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -69.2 | -43.7 | 175.1 | -72.4 | -177.6 | 176.9 | -179.7 | 0 | 111.7 | R82 D83 N84 C89 G90 | R82-K86 PolarHBondContact O-N 3.34Å; D83-K86 PolarHBondContact O-N 3Å; N84-K86 VanDerWaalsContact C-N 3.34Å; N84-K86 PolarHBondContact O-N 3.14Å; K86-C89 PolarHBondContact O-N 3.38Å; K86-G90 PolarHBondContact O-N 3.33Å |
| 87 | L | 77.5 | Confident | 78 | Confident | 123 Ų | 123 | 101.2 Ų | 101.2 | 64% | 0.644 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -63.4 | -44.7 | 176.8 | -71.9 | 170.1 | 0 | 0 | 0 | 111.9 | D83 N84 C89 G90 M91 | D83-L87 PolarHBondContact O-N 3.4Å; N84-L87 PolarHBondContact O-N 3.08Å; L87-C89 PolarHBondContact O-N 3.08Å; L87-G90 PolarHBondContact O-N 2.97Å; L87-M91 PolarHBondContact O-N 3.08Å |
| 88 | L | 79.2 | Confident | 78.9 | Confident | 110 Ų | 110 | 97.8 Ų | 97.8 | 58% | 0.576 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -61.1 | -43.7 | 176.7 | -74.3 | 168.6 | 0 | 0 | 0 | 112.2 | N84 A92 | N84-L88 WeakPolarHBondContact O-CB 3.37Å; N84-L88 VanDerWaalsContact O-CG 3.27Å; N84-L88 WeakPolarHBondContact O-CG 3.28Å; N84-L88 PolarHBondContact O-N 3.47Å; L88-A92 WeakPolarHBondContact O-CB 3.32Å; L88-A92 PolarHBondContact O-N 3.43Å; L88-A92 VanDerWaalsContact O-N 3.08Å |
| 89 | C | 81.3 | Confident | 79.9 | Confident | 80 Ų | 80 | 102.2 Ų | 102.2 | 54% | 0.541 | 55% | 0.55 | S | S | . | . | H | α-helix | trans | -66.1 | -41.3 | 177.6 | -162.1 | 0 | 0 | 0 | 0 | 111.8 | R85 K86 L87 A92 V93 | R85-C89 WeakPolarHBondContact O-CB 3.22Å; R85-C89 PolarHBondContact O-N 2.91Å; R85-C89 VanDerWaalsContact O-N 3.11Å; K86-C89 PolarHBondContact O-N 3.38Å; L87-C89 PolarHBondContact O-N 3.08Å; C89-A92 PolarHBondContact O-N 2.95Å; C89-V93 VanDerWaalsContact O-CG2 3.31Å; C89-V93 WeakPolarHBondContact O-CG2 3.5Å; C89-V93 PolarHBondContact O-N 2.99Å; C89-V93 VanDerWaalsContact O-N 3.08Å |
| 90 | G | 85.7 | Confident | 81.3 | Confident | 46 Ų | 46 | 100.3 Ų | 100.3 | 47% | 0.474 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -62.2 | -44.5 | 176.4 | 0 | 0 | 0 | 0 | 0 | 113.1 | K86 L87 V93 G94 | K86-G90 PolarHBondContact O-N 3.33Å; L87-G90 PolarHBondContact O-N 2.97Å; G90-V93 PolarHBondContact O-N 2.96Å; G90-G94 PolarHBondContact O-N 2.78Å |
| 91 | M | 83.8 | Confident | 82.7 | Confident | 141 Ų | 141 | 101.2 Ų | 101.2 | 70% | 0.695 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -62.4 | -43.3 | 175.5 | -80.7 | -71.5 | -172.8 | 0 | 0 | 112.3 | L87 G94 L95 | L87-M91 PolarHBondContact O-N 3.08Å; M91-G94 PolarHBondContact O-N 3.49Å; M91-L95 WeakPolarHBondContact O-CG 3.27Å; M91-L95 PolarHBondContact O-N 3.28Å |
| 92 | A | 88 | Confident | 84.1 | Confident | 51 Ų | 51 | 104.3 Ų | 104.3 | 42% | 0.421 | 55% | 0.55 | S | S | . | . | H | α-helix | trans | -61.5 | -46 | 178.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | L88 C89 L95 I96 | L88-A92 WeakPolarHBondContact O-CB 3.32Å; L88-A92 PolarHBondContact O-N 3.43Å; L88-A92 VanDerWaalsContact O-N 3.08Å; C89-A92 PolarHBondContact O-N 2.95Å; A92-L95 PolarHBondContact O-N 2.96Å; A92-I96 VanDerWaalsContact O-CG1 3.32Å; A92-I96 WeakPolarHBondContact O-CG1 3.41Å; A92-I96 PolarHBondContact O-N 3.39Å; A92-I96 VanDerWaalsContact O-N 3.14Å |
| 93 | V | 92.8 | Very high | 85.4 | Confident | 82 Ų | 82 | 99 Ų | 99 | 50% | 0.497 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -64 | -42.3 | 176.5 | 175.8 | 0 | 0 | 0 | 0 | 111 | C89 G90 L95 I96 V97 | C89-V93 VanDerWaalsContact O-CG2 3.31Å; C89-V93 WeakPolarHBondContact O-CG2 3.5Å; C89-V93 PolarHBondContact O-N 2.99Å; C89-V93 VanDerWaalsContact O-N 3.08Å; G90-V93 PolarHBondContact O-N 2.96Å; V93-L95 PolarHBondContact O-N 3.02Å; V93-I96 PolarHBondContact O-N 3.27Å; V93-V97 HydrophobicContact CG1-CG2 4.42Å; V93-V97 WeakPolarHBondContact O-CG2 3.5Å; V93-V97 PolarHBondContact O-N 3.06Å |
| 94 | G | 93.3 | Very high | 86.9 | Confident | 40 Ų | 40 | 101.8 Ų | 101.8 | 41% | 0.412 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -59 | -43.5 | 177 | 0 | 0 | 0 | 0 | 0 | 113 | G90 M91 V97 A98 | G90-G94 PolarHBondContact O-N 2.78Å; M91-G94 PolarHBondContact O-N 3.49Å; G94-V97 PolarHBondContact O-N 2.92Å; G94-A98 VanDerWaalsContact O-CB 3.32Å; G94-A98 WeakPolarHBondContact O-CB 3.5Å; G94-A98 PolarHBondContact O-N 3.47Å |
| 95 | L | 92.9 | Very high | 88.1 | Confident | 125 Ų | 125 | 103.2 Ų | 103.2 | 65% | 0.654 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -64.7 | -40.1 | 176.6 | -72.9 | 176.9 | 0 | 0 | 0 | 112.5 | M91 A92 V93 A98 F99 | M91-L95 WeakPolarHBondContact O-CG 3.27Å; M91-L95 PolarHBondContact O-N 3.28Å; A92-L95 PolarHBondContact O-N 2.96Å; V93-L95 PolarHBondContact O-N 3.02Å; L95-A98 PolarHBondContact O-N 3.24Å; L95-F99 WeakPolarHBondContact O-CB 3.37Å; L95-F99 PolarHBondContact O-N 3.26Å |
| 96 | I | 93.9 | Very high | 88.9 | Confident | 98 Ų | 98 | 98.9 Ų | 98.9 | 50% | 0.503 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -61.9 | -49.3 | 176.1 | -67.5 | 165.7 | 0 | 0 | 0 | 110 | A92 V93 A98 F99 F100 | A92-I96 VanDerWaalsContact O-CG1 3.32Å; A92-I96 WeakPolarHBondContact O-CG1 3.41Å; A92-I96 PolarHBondContact O-N 3.39Å; A92-I96 VanDerWaalsContact O-N 3.14Å; V93-I96 PolarHBondContact O-N 3.27Å; I96-A98 PolarHBondContact O-N 3.43Å; I96-F99 WeakPolarHBondContact O-CB 3.41Å; I96-F99 PolarHBondContact O-N 3.45Å; I96-F100 HydrophobicContact CG2-CD2 3.8Å; I96-F100 HydrophobicContact CG2-CE2 3.69Å; I96-F100 VanDerWaalsContact O-CD2 3.22Å; I96-F100 WeakPolarHBondContact O-CD2 3.36Å; I96-F100 PolarHBondContact O-N 2.91Å |
| 97 | V | 94.9 | Very high | 89.5 | Confident | 77 Ų | 77 | 95.8 Ų | 95.8 | 47% | 0.467 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -61.7 | -44.7 | 178.8 | 173.2 | 0 | 0 | 0 | 0 | 111.2 | V93 G94 F99 F100 I101 | V93-V97 HydrophobicContact CG1-CG2 4.42Å; V93-V97 WeakPolarHBondContact O-CG2 3.5Å; V93-V97 PolarHBondContact O-N 3.06Å; G94-V97 PolarHBondContact O-N 2.92Å; V97-F99 VanDerWaalsContact C-N 3.33Å; V97-F99 PolarHBondContact O-N 3.44Å; V97-F100 PolarHBondContact O-N 3.36Å; V97-I101 HydrophobicContact CG1-CD1 3.76Å; V97-I101 HydrophobicContact CG1-CG1 4.39Å; V97-I101 WeakPolarHBondContact O-CG1 3.39Å; V97-I101 PolarHBondContact O-N 2.89Å |
| 98 | A | 93.5 | Very high | 89.9 | Confident | 52 Ų | 52 | 97.8 Ų | 97.8 | 43% | 0.43 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -60.3 | -42.6 | 177.2 | 0 | 0 | 0 | 0 | 0 | 111.7 | G94 L95 I96 I101 L102 | G94-A98 VanDerWaalsContact O-CB 3.32Å; G94-A98 WeakPolarHBondContact O-CB 3.5Å; G94-A98 PolarHBondContact O-N 3.47Å; L95-A98 PolarHBondContact O-N 3.24Å; I96-A98 PolarHBondContact O-N 3.43Å; A98-I101 PolarHBondContact O-N 3.41Å; A98-L102 WeakPolarHBondContact O-CB 3.32Å; A98-L102 PolarHBondContact O-N 2.7Å |
| 99 | F | 94.2 | Very high | 89.8 | Confident | 148 Ų | 148 | 96.6 Ų | 96.6 | 65% | 0.649 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -60.8 | -44.6 | 175.7 | -177.3 | -96.5 | 0 | 0 | 0 | 111.9 | L95 I96 V97 L102 S103 | L95-F99 WeakPolarHBondContact O-CB 3.37Å; L95-F99 PolarHBondContact O-N 3.26Å; I96-F99 WeakPolarHBondContact O-CB 3.41Å; I96-F99 PolarHBondContact O-N 3.45Å; V97-F99 VanDerWaalsContact C-N 3.33Å; V97-F99 PolarHBondContact O-N 3.44Å; F99-L102 PolarHBondContact O-N 2.97Å; F99-S103 VanDerWaalsContact O-CB 3.27Å; F99-S103 WeakPolarHBondContact O-CB 3.26Å; F99-S103 PolarHBondContact O-N 3.31Å; F99-S103 PolarHBondContact O-OG 2.84Å |
| 100 | F | 94 | Very high | 89.2 | Confident | 138 Ų | 138 | 104 Ų | 104 | 61% | 0.605 | 55% | 0.552 | S | S | * | * | H | α-helix | trans | -61.3 | -46.8 | 175.5 | -85.8 | -73.5 | 0 | 0 | 0 | 112 | I96 V97 L102 S103 Y104 | I96-F100 HydrophobicContact CG2-CD2 3.8Å; I96-F100 HydrophobicContact CG2-CE2 3.69Å; I96-F100 VanDerWaalsContact O-CD2 3.22Å; I96-F100 WeakPolarHBondContact O-CD2 3.36Å; I96-F100 PolarHBondContact O-N 2.91Å; V97-F100 PolarHBondContact O-N 3.36Å; F100-L102 PolarHBondContact O-N 3.48Å; F100-S103 WeakPolarHBondContact CA-OG 3.27Å; F100-S103 PolarHBondContact O-N 2.94Å; F100-S103 PolarHBondContact O-OG 2.83Å; F100-Y104 WeakPolarHBondContact O-CB 3.39Å; F100-Y104 PolarHBondContact O-N 3.34Å |
| 101 | I | 93.4 | Very high | 87.6 | Confident | 90 Ų | 90 | 110.1 Ų | 110.1 | 46% | 0.462 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -60.6 | -47.2 | 177.5 | -67 | 169.5 | 0 | 0 | 0 | 110.5 | V97 A98 S103 Y104 F105 | V97-I101 HydrophobicContact CG1-CD1 3.76Å; V97-I101 HydrophobicContact CG1-CG1 4.39Å; V97-I101 WeakPolarHBondContact O-CG1 3.39Å; V97-I101 PolarHBondContact O-N 2.89Å; A98-I101 PolarHBondContact O-N 3.41Å; I101-S103 PolarHBondContact O-N 2.89Å; I101-Y104 PolarHBondContact O-N 3.34Å; I101-F105 HydrophobicContact CG2-CD2 3.78Å; I101-F105 HydrophobicContact CG2-CE2 3.96Å; I101-F105 WeakPolarHBondContact O-CD2 3.33Å; I101-F105 PolarHBondContact O-N 2.89Å |
| 102 | L | 92.4 | Very high | 87.8 | Confident | 112 Ų | 112 | 108.6 Ų | 108.6 | 59% | 0.586 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -63.2 | -43.3 | -180 | -144.1 | 100.6 | 0 | 0 | 0 | 111.3 | A98 F99 F100 Y104 F105 L106 | A98-L102 WeakPolarHBondContact O-CB 3.32Å; A98-L102 PolarHBondContact O-N 2.7Å; F99-L102 PolarHBondContact O-N 2.97Å; F100-L102 PolarHBondContact O-N 3.48Å; L102-Y104 VanDerWaalsContact C-N 3.32Å; L102-Y104 PolarHBondContact O-N 3.46Å; L102-F105 PolarHBondContact O-N 3.5Å; L102-L106 HydrophobicContact CD2-CD1 3.9Å; L102-L106 HydrophobicContact CG-CD1 4.34Å; L102-L106 VanDerWaalsContact O-CB 3.32Å; L102-L106 WeakPolarHBondContact O-CB 3.3Å; L102-L106 WeakPolarHBondContact O-CD1 3.36Å; L102-L106 WeakPolarHBondContact O-CG 3.49Å; L102-L106 PolarHBondContact O-N 3.36Å |
| 103 | S | 90.4 | Very high | 87.8 | Confident | 41 Ų | 41 | 111.6 Ų | 111.6 | 29% | 0.287 | 58% | 0.583 | S | S | . | * | H | α-helix | trans | -63.5 | -37.3 | 177.1 | 75 | 0 | 0 | 0 | 0 | 112.2 | F99 F100 I101 S107 | F99-S103 VanDerWaalsContact O-CB 3.27Å; F99-S103 WeakPolarHBondContact O-CB 3.26Å; F99-S103 PolarHBondContact O-N 3.31Å; F99-S103 PolarHBondContact O-OG 2.84Å; F100-S103 WeakPolarHBondContact CA-OG 3.27Å; F100-S103 PolarHBondContact O-N 2.94Å; F100-S103 PolarHBondContact O-OG 2.83Å; I101-S103 PolarHBondContact O-N 2.89Å; S103-S107 VanDerWaalsContact O-CB 3.26Å; S103-S107 WeakPolarHBondContact O-CB 3.27Å; S103-S107 PolarHBondContact O-N 3.39Å; S103-S107 PolarHBondContact O-OG 2.92Å |
| 104 | Y | 93.3 | Very high | 87.5 | Confident | 145 Ų | 145 | 113.3 Ų | 113.3 | 57% | 0.569 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -67.5 | -46.1 | 175.5 | 178.6 | -100.5 | 0 | 0 | 0 | 111.3 | F100 I101 L102 S107 R108 | F100-Y104 WeakPolarHBondContact O-CB 3.39Å; F100-Y104 PolarHBondContact O-N 3.34Å; I101-Y104 PolarHBondContact O-N 3.34Å; L102-Y104 VanDerWaalsContact C-N 3.32Å; L102-Y104 PolarHBondContact O-N 3.46Å; Y104-S107 PolarHBondContact O-N 3.39Å; Y104-R108 VanDerWaalsContact O-CB 3.27Å; Y104-R108 WeakPolarHBondContact O-CB 3.35Å; Y104-R108 PolarHBondContact O-N 3.46Å |
| 105 | F | 91.2 | Very high | 87.2 | Confident | 128 Ų | 128 | 117.6 Ų | 117.6 | 56% | 0.561 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -63.4 | -42.5 | 175.7 | -92.9 | -81.7 | 0 | 0 | 0 | 112.4 | I101 L102 R108 A109 | I101-F105 HydrophobicContact CG2-CD2 3.78Å; I101-F105 HydrophobicContact CG2-CE2 3.96Å; I101-F105 WeakPolarHBondContact O-CD2 3.33Å; I101-F105 PolarHBondContact O-N 2.89Å; L102-F105 PolarHBondContact O-N 3.5Å; F105-R108 PolarHBondContact O-N 3.26Å; F105-A109 VanDerWaalsContact O-CB 3.27Å; F105-A109 WeakPolarHBondContact O-CB 3.32Å; F105-A109 PolarHBondContact O-N 2.85Å |
| 106 | L | 86.8 | Confident | 86.8 | Confident | 110 Ų | 110 | 117.1 Ų | 117.1 | 58% | 0.576 | 59% | 0.594 | S | S | * | * | H | α-helix | trans | -64.7 | -42.3 | 176 | -80.3 | 161.4 | 0 | 0 | 0 | 112 | L102 R108 A109 R110 | L102-L106 HydrophobicContact CD2-CD1 3.9Å; L102-L106 HydrophobicContact CG-CD1 4.34Å; L102-L106 VanDerWaalsContact O-CB 3.32Å; L102-L106 WeakPolarHBondContact O-CB 3.3Å; L102-L106 WeakPolarHBondContact O-CD1 3.36Å; L102-L106 WeakPolarHBondContact O-CG 3.49Å; L102-L106 PolarHBondContact O-N 3.36Å; L106-R108 VanDerWaalsContact C-N 3.31Å; L106-R108 PolarHBondContact O-N 3.47Å; L106-A109 PolarHBondContact O-N 3.01Å; L106-R110 VanDerWaalsContact O-CB 3.3Å; L106-R110 WeakPolarHBondContact O-CB 3.27Å; L106-R110 PolarHBondContact O-N 3.34Å |
| 107 | S | 87.6 | Confident | 86.4 | Confident | 74 Ų | 74 | 118.4 Ų | 118.4 | 52% | 0.517 | 60% | 0.6 | S | S | . | * | H | α-helix | trans | -65.2 | -38.6 | 176.5 | -57.9 | 0 | 0 | 0 | 0 | 111.1 | S103 Y104 R110 T111 | S103-S107 VanDerWaalsContact O-CB 3.26Å; S103-S107 WeakPolarHBondContact O-CB 3.27Å; S103-S107 PolarHBondContact O-N 3.39Å; S103-S107 PolarHBondContact O-OG 2.92Å; Y104-S107 PolarHBondContact O-N 3.39Å; S107-R110 PolarHBondContact O-N 2.84Å; S107-T111 PolarHBondContact O-N 3.34Å; S107-T111 PolarHBondContact O-OG1 2.82Å |
| 108 | R | 85.6 | Confident | 85.7 | Confident | 165 Ų | 165 | 121.4 Ų | 121.4 | 62% | 0.623 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -72.4 | -30.3 | 176.1 | -166 | -177.8 | 179.1 | -171.7 | 1.6 | 113.3 | Y104 F105 L106 T111 | Y104-R108 VanDerWaalsContact O-CB 3.27Å; Y104-R108 WeakPolarHBondContact O-CB 3.35Å; Y104-R108 PolarHBondContact O-N 3.46Å; F105-R108 PolarHBondContact O-N 3.26Å; L106-R108 VanDerWaalsContact C-N 3.31Å; L106-R108 PolarHBondContact O-N 3.47Å; R108-T111 VanDerWaalsContact O-OXT 3.13Å |
| 109 | A | 76.1 | Confident | 85.2 | Confident | 86 Ų | 86 | 126.7 Ų | 126.7 | 71% | 0.711 | 62% | 0.624 | S | S | * | * | H | α-helix | trans | -80.3 | -19.2 | 176.1 | 0 | 0 | 0 | 0 | 0 | 113.1 | F105 L106 | F105-A109 VanDerWaalsContact O-CB 3.27Å; F105-A109 WeakPolarHBondContact O-CB 3.32Å; F105-A109 PolarHBondContact O-N 2.85Å; L106-A109 PolarHBondContact O-N 3.01Å |
| 110 | R | 69.9 | Low | 84.4 | Confident | 235 Ų | 235 | 124.9 Ų | 124.9 | 89% | 0.887 | 62% | 0.621 | S | S | * | * | trans | -91.8 | -8.7 | 177.6 | -161.4 | 173 | -170.7 | 161.9 | 3.6 | 113.2 | L106 S107 | L106-R110 VanDerWaalsContact O-CB 3.3Å; L106-R110 WeakPolarHBondContact O-CB 3.27Å; L106-R110 PolarHBondContact O-N 3.34Å; S107-R110 PolarHBondContact O-N 2.84Å | ||
| 111 | T | 52.2 | Low | 83.5 | Confident | 175 Ų | 175 | 123.7 Ų | 123.7 | 100% | 1.074 | 62% | 0.623 | S | S | * | * | trans | -102.3 | 0 | 172.3 | -40.4 | 0 | 0 | 0 | 0 | 108.8 | S107 R108 | S107-T111 PolarHBondContact O-N 3.34Å; S107-T111 PolarHBondContact O-OG1 2.82Å; R108-T111 VanDerWaalsContact O-OXT 3.13Å |
Retrieved 111 of 111 residues in 605.5 ms
(Link to these results)