| 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 | 43.2 | Very low | 51.1 | Low | 242 Ų | 242 | 153.6 Ų | 153.6 | 100% | 1.192 | 83% | 0.825 | S | S | * | * | 0 | 103.8 | 0 | -76.6 | -179.2 | 152.8 | 0 | 0 | 108.3 | S3 | M1-S3 PolarHBondContact O-N 3.05Š| |||
| 2 | T | 46.6 | Very low | 51.6 | Low | 146 Ų | 146 | 149.8 Ų | 149.8 | 90% | 0.896 | 82% | 0.815 | S | S | * | * | trans | -80 | 110.5 | -176.9 | 35.2 | 0 | 0 | 0 | 0 | 110.3 | A4 | T2-A4 PolarHBondContact O-N 3Š| ||
| 3 | S | 53.3 | Low | 51.5 | Low | 116 Ų | 116 | 156 Ų | 156 | 81% | 0.811 | 82% | 0.819 | S | S | * | * | trans | -59.6 | 114.8 | 174.9 | -59.1 | 0 | 0 | 0 | 0 | 110.7 | M1 K5 | M1-S3 PolarHBondContact O-N 3.05Å; S3-K5 PolarHBondContact O-N 3.4Å | ||
| 4 | A | 53.1 | Low | 51.6 | Low | 94 Ų | 94 | 150.1 Ų | 150.1 | 78% | 0.777 | 79% | 0.787 | S | S | * | * | trans | -62.4 | 108.8 | 168.3 | 0 | 0 | 0 | 0 | 0 | 108.7 | T2 K6 | T2-A4 PolarHBondContact O-N 3Å; A4-K6 PolarHBondContact O-N 3.31Å | ||
| 5 | K | 53.1 | Low | 51.1 | Low | 200 Ų | 200 | 156 Ų | 156 | 87% | 0.87 | 80% | 0.795 | S | S | * | * | trans | -61.4 | 100 | 166.7 | -76 | -177.9 | 177.7 | 178.7 | 0 | 107.2 | S3 Q7 | S3-K5 PolarHBondContact O-N 3.4Å; K5-Q7 PolarHBondContact O-N 2.97Å | ||
| 6 | K | 54.1 | Low | 51.2 | Low | 203 Ų | 203 | 151.3 Ų | 151.3 | 88% | 0.883 | 80% | 0.796 | S | S | * | * | trans | -55.1 | 108.6 | 169.2 | -83.6 | -178.1 | 175 | 178.6 | 0 | 107.5 | A4 | A4-K6 PolarHBondContact O-N 3.31Š| ||
| 7 | Q | 52.9 | Low | 51.2 | Low | 181 Ų | 181 | 146.1 Ų | 146.1 | 85% | 0.846 | 77% | 0.769 | S | S | * | * | trans | -61.1 | 140 | 170.2 | -76 | -170.3 | -23.9 | 0 | 0 | 108.8 | K5 Y9 | K5-Q7 PolarHBondContact O-N 2.97Å; Q7-Y9 PolarHBondContact O-N 3.08Å | ||
| 8 | P | 56.1 | Low | 51.3 | Low | 119 Ų | 119 | 141.3 Ų | 141.3 | 77% | 0.773 | 75% | 0.75 | S | S | * | * | trans | -60 | 136.3 | 175.5 | 24.7 | -31.6 | 0 | 0 | 0 | 109.4 | A10 | P8-A10 PolarHBondContact O-N 2.7Š| ||
| 9 | Y | 49.9 | Very low | 51.6 | Low | 224 Ų | 224 | 137 Ų | 137 | 88% | 0.878 | 74% | 0.742 | S | S | * | * | trans | -56.9 | 109.1 | -177.9 | -158.4 | -91.8 | 0 | 0 | 0 | 110.1 | Q7 N11 | Q7-Y9 PolarHBondContact O-N 3.08Å; Y9-N11 PolarHBondContact O-N 2.86Å | ||
| 10 | A | 49.8 | Very low | 52 | Low | 91 Ų | 91 | 136.2 Ų | 136.2 | 75% | 0.752 | 74% | 0.737 | S | S | * | * | trans | -90.7 | 98.6 | 176.5 | 0 | 0 | 0 | 0 | 0 | 108.7 | P8 P12 | P8-A10 PolarHBondContact O-N 2.7Å; A10-P12 VanDerWaalsContact O-CD 3.31Å; A10-P12 WeakPolarHBondContact O-CD 3.36Å | ||
| 11 | N | 49.9 | Very low | 52.8 | Low | 74 Ų | 74 | 133.3 Ų | 133.3 | 40% | 0.396 | 72% | 0.722 | S | S | . | * | trans | -69.1 | 117.7 | 174 | -174.6 | -20.9 | 0 | 0 | 0 | 109.5 | Y9 R13 I14 | Y9-N11 PolarHBondContact O-N 2.86Å; N11-R13 PolarHBondContact O-N 3.22Å; N11-R13 VanDerWaalsContact O-N 3.09Å; N11-R13 PolarHBondContact OD1-N 2.97Å; N11-R13 VanDerWaalsContact OD1-N 3.13Å; N11-I14 HydrophobicContact CB-CD1 3.92Å; N11-I14 HydrophobicContact CB-CG1 4.1Å; N11-I14 PolarHBondContact O-N 2.95Å; N11-I14 VanDerWaalsContact O-N 3.1Å | ||
| 12 | P | 56.9 | Low | 54.1 | Low | 108 Ų | 108 | 127.1 Ų | 127.1 | 70% | 0.701 | 69% | 0.688 | S | S | * | * | G | 310 helix | trans | -59.6 | -23.3 | -176.3 | -22.8 | 32.7 | 0 | 0 | 0 | 114.3 | A10 I14 | A10-P12 VanDerWaalsContact O-CD 3.31Å; A10-P12 WeakPolarHBondContact O-CD 3.36Å; P12-I14 PolarHBondContact O-N 3.39Å |
| 13 | R | 51.2 | Low | 55.6 | Low | 230 Ų | 230 | 127.3 Ų | 127.3 | 87% | 0.868 | 68% | 0.676 | S | S | * | * | G | 310 helix | trans | -75.4 | -7.2 | 179.2 | -69.1 | -179 | 171.3 | 153.5 | -2.3 | 114.3 | N11 | N11-R13 PolarHBondContact O-N 3.22Å; N11-R13 VanDerWaalsContact O-N 3.09Å; N11-R13 PolarHBondContact OD1-N 2.97Å; N11-R13 VanDerWaalsContact OD1-N 3.13Å |
| 14 | I | 52.2 | Low | 56.6 | Low | 73 Ų | 73 | 126.5 Ų | 126.5 | 37% | 0.374 | 66% | 0.66 | S | S | . | * | G | 310 helix | trans | -106.4 | 1.8 | -176.6 | -51 | -177.9 | 0 | 0 | 0 | 111.1 | N11 P12 G16 I17 | N11-I14 HydrophobicContact CB-CD1 3.92Å; N11-I14 HydrophobicContact CB-CG1 4.1Å; N11-I14 PolarHBondContact O-N 2.95Å; N11-I14 VanDerWaalsContact O-N 3.1Å; P12-I14 PolarHBondContact O-N 3.39Å; I14-G16 PolarHBondContact O-N 2.95Å; I14-G16 VanDerWaalsContact O-N 3.13Å; I14-I17 HydrophobicContact CG2-CB 4.4Å; I14-I17 HydrophobicContact CG2-CD1 4.23Å; I14-I17 PolarHBondContact O-N 3.2Å |
| 15 | R | 43.8 | Very low | 57.9 | Low | 239 Ų | 239 | 125 Ų | 125 | 90% | 0.902 | 64% | 0.641 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72.4 | 108.7 | -178.3 | -144.7 | -175.4 | -124.2 | -163.7 | 2.2 | 109.6 | ||
| 16 | G | 53.9 | Low | 59.2 | Low | 80 Ų | 80 | 119.7 Ų | 119.7 | 83% | 0.825 | 62% | 0.622 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 123.4 | -2.6 | 178.9 | 0 | 0 | 0 | 0 | 0 | 115.3 | I14 | I14-G16 PolarHBondContact O-N 2.95Å; I14-G16 VanDerWaalsContact O-N 3.13Å |
| 17 | I | 49.7 | Very low | 60.4 | Low | 63 Ų | 63 | 118.4 Ų | 118.4 | 32% | 0.323 | 61% | 0.611 | S | S | . | * | trans | -92.7 | 112.9 | -179.3 | -62.2 | -174.4 | 0 | 0 | 0 | 107.4 | I14 D21 K22 V25 | I14-I17 HydrophobicContact CG2-CB 4.4Å; I14-I17 HydrophobicContact CG2-CD1 4.23Å; I14-I17 PolarHBondContact O-N 3.2Å; I17-D21 HydrophobicContact CB-CB 4.19Å; I17-D21 HydrophobicContact CG2-CB 3.26Å; I17-K22 VanDerWaalsContact CG2-CA 3.48Å; I17-K22 HydrophobicContact CG2-CB 3.85Å; I17-V25 HydrophobicContact CD1-CG2 4.35Å | ||
| 18 | S | 53.4 | Low | 61.6 | Low | 61 Ų | 61 | 115.5 Ų | 115.5 | 43% | 0.427 | 60% | 0.596 | S | S | . | * | trans | -61.9 | 165.6 | 177.8 | 82.7 | 0 | 0 | 0 | 0 | 110.7 | D20 D21 K22 | S18-D20 PolarHBondContact O-N 3.2Å; S18-D20 VanDerWaalsContact O-N 3.09Å; S18-D21 VanDerWaalsContact CB-OD2 3.23Å; S18-D21 WeakPolarHBondContact CB-OD2 3.23Å; S18-D21 PolarHBondContact N-OD2 2.83Å; S18-D21 PolarHBondContact O-N 3.08Å; S18-D21 PolarHBondContact OG-OD2 3.09Å; S18-K22 PolarHBondContact O-N 3.49Å | ||
| 19 | G | 56.9 | Low | 62.7 | Low | 59 Ų | 59 | 114.2 Ų | 114.2 | 61% | 0.608 | 58% | 0.582 | S | S | * | * | H | α-helix | trans | -54.8 | -31.5 | -177.1 | 0 | 0 | 0 | 0 | 0 | 114 | ||
| 20 | D | 60.5 | Low | 64 | Low | 121 Ų | 121 | 109.8 Ų | 109.8 | 65% | 0.647 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -77.7 | -41.7 | 174.8 | -73.2 | -28.8 | 0 | 0 | 0 | 111.8 | S18 K22 K23 E24 | S18-D20 PolarHBondContact O-N 3.2Å; S18-D20 VanDerWaalsContact O-N 3.09Å; D20-K22 PolarHBondContact O-N 3.11Å; D20-K23 PolarHBondContact O-N 3.05Å; D20-E24 PolarHBondContact O-N 3.37Å |
| 21 | D | 67.5 | Low | 65 | Low | 76 Ų | 76 | 109.3 Ų | 109.3 | 41% | 0.406 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -61.4 | -33.7 | 176.5 | -57.1 | -49.1 | 0 | 0 | 0 | 111.4 | I17 S18 E24 V25 | I17-D21 HydrophobicContact CB-CB 4.19Å; I17-D21 HydrophobicContact CG2-CB 3.26Å; S18-D21 VanDerWaalsContact CB-OD2 3.23Å; S18-D21 WeakPolarHBondContact CB-OD2 3.23Å; S18-D21 PolarHBondContact N-OD2 2.83Å; S18-D21 PolarHBondContact O-N 3.08Å; S18-D21 PolarHBondContact OG-OD2 3.09Å; D21-E24 PolarHBondContact O-N 3.01Å; D21-V25 VanDerWaalsContact O-CB 3.31Å; D21-V25 WeakPolarHBondContact O-CB 3.04Å; D21-V25 WeakPolarHBondContact O-CG2 3.4Å; D21-V25 PolarHBondContact O-N 2.96Å |
| 22 | K | 72.1 | Confident | 65.9 | Low | 111 Ų | 111 | 111.1 Ų | 111.1 | 48% | 0.483 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -70.9 | -38.6 | -179.2 | -172.6 | 178.1 | 177.6 | -178.2 | 0 | 111.2 | I17 S18 D20 L26 | I17-K22 VanDerWaalsContact CG2-CA 3.48Å; I17-K22 HydrophobicContact CG2-CB 3.85Å; S18-K22 PolarHBondContact O-N 3.49Å; D20-K22 PolarHBondContact O-N 3.11Å; K22-L26 HydrophobicContact CG-CD1 4.36Å; K22-L26 WeakPolarHBondContact O-CB 3.44Å; K22-L26 WeakPolarHBondContact O-CG 3.33Å; K22-L26 PolarHBondContact O-N 2.96Å |
| 23 | K | 77.3 | Confident | 66.6 | Low | 151 Ų | 151 | 110.2 Ų | 110.2 | 66% | 0.657 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -66.3 | -41.3 | 173.2 | -74 | 178.7 | -178.2 | 171 | 0 | 110.7 | D20 L26 R27 | D20-K23 PolarHBondContact O-N 3.05Å; K23-L26 PolarHBondContact O-N 3.37Å; K23-R27 WeakPolarHBondContact O-CB 3.43Å; K23-R27 PolarHBondContact O-N 3.04Å |
| 24 | E | 75.4 | Confident | 67.4 | Low | 99 Ų | 99 | 108.7 Ų | 108.7 | 46% | 0.463 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -67.5 | -40.9 | 178.8 | -170.3 | 163.9 | 151.2 | 0 | 0 | 112.1 | D20 D21 R27 K28 | D20-E24 PolarHBondContact O-N 3.37Å; D21-E24 PolarHBondContact O-N 3.01Å; E24-R27 PolarHBondContact O-N 2.93Å; E24-K28 HydrophobicContact CG-CD 4.4Å; E24-K28 WeakPolarHBondContact O-CG 3.4Å; E24-K28 PolarHBondContact O-N 3.41Å; E24-K28 VanDerWaalsContact OE1-CE 3.29Å; E24-K28 WeakPolarHBondContact OE1-CE 3.41Å; E24-K28 IonicContact OE1-NZ 2.77Å; E24-K28 PolarHBondContact OE1-NZ 3.37Å |
| 25 | V | 78.8 | Confident | 67.8 | Low | 62 Ų | 62 | 110.7 Ų | 110.7 | 38% | 0.376 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -63.7 | -43.7 | 174.1 | 168.1 | 0 | 0 | 0 | 0 | 111.1 | I17 D21 R27 K28 L29 | I17-V25 HydrophobicContact CD1-CG2 4.35Å; D21-V25 VanDerWaalsContact O-CB 3.31Å; D21-V25 WeakPolarHBondContact O-CB 3.04Å; D21-V25 WeakPolarHBondContact O-CG2 3.4Å; D21-V25 PolarHBondContact O-N 2.96Å; V25-R27 VanDerWaalsContact C-N 3.33Å; V25-R27 PolarHBondContact O-N 2.9Å; V25-K28 PolarHBondContact O-N 3.23Å; V25-L29 HydrophobicContact CG1-CD1 3.91Å; V25-L29 WeakPolarHBondContact O-CB 3.5Å; V25-L29 PolarHBondContact O-N 3.47Å |
| 26 | L | 81.5 | Confident | 68.5 | Low | 89 Ų | 89 | 105.2 Ų | 105.2 | 47% | 0.466 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -61.7 | -40.5 | 173.7 | -85.7 | 162.9 | 0 | 0 | 0 | 112 | K22 K23 L29 Q30 | K22-L26 HydrophobicContact CG-CD1 4.36Å; K22-L26 WeakPolarHBondContact O-CB 3.44Å; K22-L26 WeakPolarHBondContact O-CG 3.33Å; K22-L26 PolarHBondContact O-N 2.96Å; K23-L26 PolarHBondContact O-N 3.37Å; L26-L29 PolarHBondContact O-N 3.23Å; L26-Q30 WeakPolarHBondContact O-CB 3.31Å; L26-Q30 WeakPolarHBondContact O-CG 3.45Å; L26-Q30 PolarHBondContact O-N 3.48Å |
| 27 | R | 78.3 | Confident | 68.8 | Low | 175 Ų | 175 | 103.8 Ų | 103.8 | 66% | 0.66 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -63.7 | -44.9 | 176.5 | -172 | -176.2 | 174 | 179.1 | -0.8 | 111.3 | K23 E24 V25 Q30 L31 | K23-R27 WeakPolarHBondContact O-CB 3.43Å; K23-R27 PolarHBondContact O-N 3.04Å; E24-R27 PolarHBondContact O-N 2.93Å; V25-R27 VanDerWaalsContact C-N 3.33Å; V25-R27 PolarHBondContact O-N 2.9Å; R27-Q30 PolarHBondContact O-N 3.32Å; R27-L31 HydrophobicContact CG-CD1 4.26Å; R27-L31 WeakPolarHBondContact O-CB 3.14Å; R27-L31 PolarHBondContact O-N 2.92Å |
| 28 | K | 78 | Confident | 69.5 | Low | 121 Ų | 121 | 108.8 Ų | 108.8 | 53% | 0.526 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -63.2 | -42.1 | 175.8 | -74.1 | 174.5 | -176.5 | 165 | 0 | 111.7 | E24 V25 L31 L32 | E24-K28 HydrophobicContact CG-CD 4.4Å; E24-K28 WeakPolarHBondContact O-CG 3.4Å; E24-K28 PolarHBondContact O-N 3.41Å; E24-K28 VanDerWaalsContact OE1-CE 3.29Å; E24-K28 WeakPolarHBondContact OE1-CE 3.41Å; E24-K28 IonicContact OE1-NZ 2.77Å; E24-K28 PolarHBondContact OE1-NZ 3.37Å; V25-K28 PolarHBondContact O-N 3.23Å; K28-L31 WeakPolarHBondContact O-CB 3.44Å; K28-L31 PolarHBondContact O-N 2.65Å; K28-L32 WeakPolarHBondContact O-CB 3.47Å; K28-L32 WeakPolarHBondContact O-CG 3.39Å; K28-L32 PolarHBondContact O-N 3.12Å |
| 29 | L | 78.7 | Confident | 70.3 | Confident | 92 Ų | 92 | 111.1 Ų | 111.1 | 48% | 0.482 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -63.3 | -42.8 | 174.4 | -90.8 | 156.5 | 0 | 0 | 0 | 112.6 | V25 L26 L31 L32 C33 | V25-L29 HydrophobicContact CG1-CD1 3.91Å; V25-L29 WeakPolarHBondContact O-CB 3.5Å; V25-L29 PolarHBondContact O-N 3.47Å; L26-L29 PolarHBondContact O-N 3.23Å; L29-L31 VanDerWaalsContact C-N 3.34Å; L29-L32 PolarHBondContact O-N 2.74Å; L29-C33 WeakPolarHBondContact O-CB 3.29Å; L29-C33 PolarHBondContact O-N 2.92Å; L29-C33 PolarHBondContact O-SG 2.88Å |
| 30 | Q | 78.3 | Confident | 71 | Confident | 130 Ų | 130 | 113 Ų | 113 | 61% | 0.607 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -64.6 | -39.1 | 175.9 | -78.5 | 178 | -16.3 | 0 | 0 | 112.3 | L26 R27 R34 | L26-Q30 WeakPolarHBondContact O-CB 3.31Å; L26-Q30 WeakPolarHBondContact O-CG 3.45Å; L26-Q30 PolarHBondContact O-N 3.48Å; R27-Q30 PolarHBondContact O-N 3.32Å; Q30-R34 WeakPolarHBondContact O-CG 3.45Å; Q30-R34 PolarHBondContact O-N 3.1Å; Q30-R34 VanDerWaalsContact O-N 3.08Å |
| 31 | L | 71.6 | Confident | 71.5 | Confident | 82 Ų | 82 | 112.8 Ų | 112.8 | 43% | 0.429 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -60.8 | -51.7 | 172.5 | -108.1 | 128 | 0 | 0 | 0 | 110.3 | R27 K28 L29 C33 R34 Y35 | R27-L31 HydrophobicContact CG-CD1 4.26Å; R27-L31 WeakPolarHBondContact O-CB 3.14Å; R27-L31 PolarHBondContact O-N 2.92Å; K28-L31 WeakPolarHBondContact O-CB 3.44Å; K28-L31 PolarHBondContact O-N 2.65Å; L29-L31 VanDerWaalsContact C-N 3.34Å; L31-C33 PolarHBondContact O-N 3.4Å; L31-R34 WeakPolarHBondContact O-CB 3.36Å; L31-R34 PolarHBondContact O-N 3.06Å; L31-R34 VanDerWaalsContact O-N 3.11Å; L31-Y35 HydrophobicContact CD2-CD2 4.12Å; L31-Y35 HydrophobicContact CD2-CE2 3.63Å; L31-Y35 WeakPolarHBondContact O-CD2 3.35Å; L31-Y35 PolarHBondContact O-N 3.32Å |
| 32 | L | 68.8 | Low | 71.8 | Confident | 112 Ų | 112 | 111.2 Ų | 111.2 | 59% | 0.586 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -54.2 | -53.9 | 175.8 | -78.2 | 163.6 | 0 | 0 | 0 | 110.5 | K28 L29 R34 Y35 D36 | K28-L32 WeakPolarHBondContact O-CB 3.47Å; K28-L32 WeakPolarHBondContact O-CG 3.39Å; K28-L32 PolarHBondContact O-N 3.12Å; L29-L32 PolarHBondContact O-N 2.74Å; L32-R34 PolarHBondContact O-N 2.9Å; L32-R34 VanDerWaalsContact O-N 3.12Å; L32-Y35 CarbonylContact O-C 3.57Å; L32-Y35 WeakPolarHBondContact O-CA 3.48Å; L32-Y35 PolarHBondContact O-N 2.92Å; L32-D36 WeakPolarHBondContact O-CA 3.24Å; L32-D36 VanDerWaalsContact O-CB 3.23Å; L32-D36 WeakPolarHBondContact O-CB 3.39Å; L32-D36 PolarHBondContact O-N 3.36Å |
| 33 | C | 70.4 | Confident | 72.2 | Confident | 89 Ų | 89 | 109.8 Ų | 109.8 | 60% | 0.601 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -59.9 | -26.3 | 179.4 | -68.1 | 0 | 0 | 0 | 0 | 114.8 | L29 L31 | L29-C33 WeakPolarHBondContact O-CB 3.29Å; L29-C33 PolarHBondContact O-N 2.92Å; L29-C33 PolarHBondContact O-SG 2.88Å; L31-C33 PolarHBondContact O-N 3.4Å |
| 34 | R | 67.9 | Low | 72.5 | Confident | 197 Ų | 197 | 107 Ų | 107 | 74% | 0.743 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -72.1 | -44.5 | 171.5 | -76.3 | -177 | -179.2 | -157.2 | 0.4 | 111.1 | Q30 L31 L32 D36 | Q30-R34 WeakPolarHBondContact O-CG 3.45Å; Q30-R34 PolarHBondContact O-N 3.1Å; Q30-R34 VanDerWaalsContact O-N 3.08Å; L31-R34 WeakPolarHBondContact O-CB 3.36Å; L31-R34 PolarHBondContact O-N 3.06Å; L31-R34 VanDerWaalsContact O-N 3.11Å; L32-R34 PolarHBondContact O-N 2.9Å; L32-R34 VanDerWaalsContact O-N 3.12Å; R34-D36 VanDerWaalsContact C-N 3.34Å |
| 35 | Y | 62.1 | Low | 72.8 | Confident | 116 Ų | 116 | 108.1 Ų | 108.1 | 46% | 0.455 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -80.6 | -12.2 | 178.6 | -70.7 | -71 | 0 | 0 | 0 | 114 | L31 L32 S37 M41 | L31-Y35 HydrophobicContact CD2-CD2 4.12Å; L31-Y35 HydrophobicContact CD2-CE2 3.63Å; L31-Y35 WeakPolarHBondContact O-CD2 3.35Å; L31-Y35 PolarHBondContact O-N 3.32Å; L32-Y35 CarbonylContact O-C 3.57Å; L32-Y35 WeakPolarHBondContact O-CA 3.48Å; L32-Y35 PolarHBondContact O-N 2.92Å; Y35-S37 PolarHBondContact O-N 3.39Å; Y35-M41 VanDerWaalsContact O-CG 3.3Å; Y35-M41 WeakPolarHBondContact O-CG 3.37Å |
| 36 | D | 58.3 | Low | 73.1 | Confident | 124 Ų | 124 | 108.3 Ų | 108.3 | 66% | 0.663 | 54% | 0.535 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -77.2 | 0.8 | 178.6 | -148.6 | 29.5 | 0 | 0 | 0 | 112.1 | L32 R34 E38 | L32-D36 WeakPolarHBondContact O-CA 3.24Å; L32-D36 VanDerWaalsContact O-CB 3.23Å; L32-D36 WeakPolarHBondContact O-CB 3.39Å; L32-D36 PolarHBondContact O-N 3.36Å; R34-D36 VanDerWaalsContact C-N 3.34Å; D36-E38 PolarHBondContact O-N 3.49Å |
| 37 | S | 60.4 | Low | 73.3 | Confident | 49 Ų | 49 | 107.5 Ų | 107.5 | 34% | 0.343 | 53% | 0.533 | S | S | . | . | trans | -66 | 97.1 | 156.2 | 75.4 | 0 | 0 | 0 | 0 | 106.3 | Y35 N39 E40 | Y35-S37 PolarHBondContact O-N 3.39Å; S37-N39 CarbonylContact O-C 3.38Å; S37-N39 PolarHBondContact O-N 3.35Å; S37-E40 PolarHBondContact O-N 2.87Å; S37-E40 WeakPolarHBondContact OG-CB 3.49Å; S37-E40 WeakPolarHBondContact OG-CG 3.23Å | ||
| 38 | E | 63.1 | Low | 73.7 | Confident | 168 Ų | 168 | 102 Ų | 102 | 79% | 0.785 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -42.8 | -32.4 | 178.9 | -72.2 | 177.9 | 154.4 | 0 | 0 | 111.8 | D36 A42 | D36-E38 PolarHBondContact O-N 3.49Å; E38-A42 WeakPolarHBondContact O-CB 3.48Å; E38-A42 PolarHBondContact O-N 2.91Å |
| 39 | N | 70.7 | Confident | 74.1 | Confident | 111 Ų | 111 | 99.4 Ų | 99.4 | 59% | 0.594 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -60.6 | -42.9 | 175.3 | -167.2 | 46 | 0 | 0 | 0 | 114.5 | S37 N43 | S37-N39 CarbonylContact O-C 3.38Å; S37-N39 PolarHBondContact O-N 3.35Å; N39-N43 WeakPolarHBondContact O-CB 3.11Å; N39-N43 PolarHBondContact O-N 2.98Å; N39-N43 PolarHBondContact O-ND2 2.96Å; N39-N43 PolarHBondContact OD1-ND2 3.12Å |
| 40 | E | 70.8 | Confident | 74.6 | Confident | 97 Ų | 97 | 101.4 Ų | 101.4 | 45% | 0.453 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -71 | -42.3 | 178.9 | -79.5 | -174.3 | 172.1 | 0 | 0 | 111.9 | S37 N43 L44 | S37-E40 PolarHBondContact O-N 2.87Å; S37-E40 WeakPolarHBondContact OG-CB 3.49Å; S37-E40 WeakPolarHBondContact OG-CG 3.23Å; E40-N43 PolarHBondContact O-N 2.95Å; E40-L44 WeakPolarHBondContact O-CB 3.39Å; E40-L44 PolarHBondContact O-N 2.77Å |
| 41 | M | 71.5 | Confident | 75.2 | Confident | 117 Ų | 117 | 104.1 Ų | 104.1 | 58% | 0.576 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -63.6 | -45.4 | 174.6 | -84.2 | -84.3 | -81.3 | 0 | 0 | 111.6 | Y35 N43 L44 E45 | Y35-M41 VanDerWaalsContact O-CG 3.3Å; Y35-M41 WeakPolarHBondContact O-CG 3.37Å; M41-N43 VanDerWaalsContact C-N 3.32Å; M41-N43 PolarHBondContact O-N 2.72Å; M41-L44 WeakPolarHBondContact O-CB 3.34Å; M41-L44 PolarHBondContact O-N 2.89Å; M41-E45 WeakPolarHBondContact O-CB 3.46Å; M41-E45 PolarHBondContact O-N 3.47Å |
| 42 | A | 72.9 | Confident | 75.9 | Confident | 44 Ų | 44 | 103 Ų | 103 | 36% | 0.364 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -63.1 | -37.5 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | E38 T46 | E38-A42 WeakPolarHBondContact O-CB 3.48Å; E38-A42 PolarHBondContact O-N 2.91Å; A42-T46 WeakPolarHBondContact O-CB 3.29Å; A42-T46 PolarHBondContact O-N 2.83Å; A42-T46 PolarHBondContact O-OG1 3.2Å |
| 43 | N | 81.5 | Confident | 76.8 | Confident | 81 Ų | 81 | 102.7 Ų | 102.7 | 43% | 0.433 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -66.6 | -41.7 | 173.5 | -79.6 | -38.7 | 0 | 0 | 0 | 111.8 | N39 E40 M41 T46 V47 | N39-N43 WeakPolarHBondContact O-CB 3.11Å; N39-N43 PolarHBondContact O-N 2.98Å; N39-N43 PolarHBondContact O-ND2 2.96Å; N39-N43 PolarHBondContact OD1-ND2 3.12Å; E40-N43 PolarHBondContact O-N 2.95Å; M41-N43 VanDerWaalsContact C-N 3.32Å; M41-N43 PolarHBondContact O-N 2.72Å; N43-T46 PolarHBondContact O-N 2.92Å; N43-V47 WeakPolarHBondContact O-CB 3.31Å; N43-V47 VanDerWaalsContact O-CG2 3.24Å; N43-V47 WeakPolarHBondContact O-CG2 3.37Å; N43-V47 PolarHBondContact O-N 3.39Å |
| 44 | L | 82.6 | Confident | 77.7 | Confident | 91 Ų | 91 | 100.8 Ų | 100.8 | 48% | 0.476 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -61 | -44.8 | 175.2 | -108 | 156.6 | 0 | 0 | 0 | 111.5 | E40 M41 V47 T48 | E40-L44 WeakPolarHBondContact O-CB 3.39Å; E40-L44 PolarHBondContact O-N 2.77Å; M41-L44 WeakPolarHBondContact O-CB 3.34Å; M41-L44 PolarHBondContact O-N 2.89Å; L44-V47 PolarHBondContact O-N 3.36Å; L44-T48 VanDerWaalsContact O-CB 3.24Å; L44-T48 WeakPolarHBondContact O-CB 3.42Å; L44-T48 PolarHBondContact O-N 2.87Å; L44-T48 PolarHBondContact O-OG1 3.13Å |
| 45 | E | 82.8 | Confident | 78.6 | Confident | 124 Ų | 124 | 93.4 Ų | 93.4 | 58% | 0.579 | 48% | 0.479 | S | S | * | . | H | α-helix | trans | -61.9 | -46.5 | 174.9 | -177.4 | 169.9 | -155.3 | 0 | 0 | 111.3 | M41 V47 T48 N49 | M41-E45 WeakPolarHBondContact O-CB 3.46Å; M41-E45 PolarHBondContact O-N 3.47Å; E45-V47 PolarHBondContact O-N 3.26Å; E45-T48 PolarHBondContact O-N 2.89Å; E45-N49 WeakPolarHBondContact O-CB 3.48Å; E45-N49 PolarHBondContact O-N 3.11Å |
| 46 | T | 84.5 | Confident | 79.8 | Confident | 66 Ų | 66 | 93.3 Ų | 93.3 | 41% | 0.405 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -60 | -46.1 | 177.2 | -60.3 | 0 | 0 | 0 | 0 | 111.8 | A42 N43 N49 K50 | A42-T46 WeakPolarHBondContact O-CB 3.29Å; A42-T46 PolarHBondContact O-N 2.83Å; A42-T46 PolarHBondContact O-OG1 3.2Å; N43-T46 PolarHBondContact O-N 2.92Å; T46-N49 PolarHBondContact O-N 3.47Å; T46-K50 WeakPolarHBondContact O-CG 3.17Å; T46-K50 PolarHBondContact O-N 2.91Å |
| 47 | V | 86 | Confident | 81.2 | Confident | 71 Ų | 71 | 93.9 Ų | 93.9 | 43% | 0.43 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -64.6 | -43.4 | 177.7 | 169.2 | 0 | 0 | 0 | 0 | 110.1 | N43 L44 E45 N49 K50 W51 | N43-V47 WeakPolarHBondContact O-CB 3.31Å; N43-V47 VanDerWaalsContact O-CG2 3.24Å; N43-V47 WeakPolarHBondContact O-CG2 3.37Å; N43-V47 PolarHBondContact O-N 3.39Å; L44-V47 PolarHBondContact O-N 3.36Å; E45-V47 PolarHBondContact O-N 3.26Å; V47-N49 VanDerWaalsContact C-N 3.33Å; V47-N49 PolarHBondContact O-N 2.7Å; V47-K50 WeakPolarHBondContact O-CB 3.42Å; V47-K50 PolarHBondContact O-N 2.94Å; V47-W51 PolarHBondContact O-N 3.35Å |
| 48 | T | 87 | Confident | 82.4 | Confident | 61 Ų | 61 | 93.7 Ų | 93.7 | 37% | 0.374 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -60.1 | -43.6 | 176.8 | -59.9 | 0 | 0 | 0 | 0 | 111.2 | L44 E45 K50 W51 K52 | L44-T48 VanDerWaalsContact O-CB 3.24Å; L44-T48 WeakPolarHBondContact O-CB 3.42Å; L44-T48 PolarHBondContact O-N 2.87Å; L44-T48 PolarHBondContact O-OG1 3.13Å; E45-T48 PolarHBondContact O-N 2.89Å; T48-K50 PolarHBondContact O-N 2.93Å; T48-W51 PolarHBondContact O-N 3.37Å; T48-K52 HydrophobicContact CG2-CD 4.49Å; T48-K52 WeakPolarHBondContact O-CG 3.24Å; T48-K52 PolarHBondContact O-N 3.25Å |
| 49 | N | 85.7 | Confident | 83.5 | Confident | 65 Ų | 65 | 86.1 Ų | 86.1 | 35% | 0.348 | 44% | 0.442 | S | S | . | . | H | α-helix | trans | -64.5 | -38.7 | 176.9 | -76.5 | -20.3 | 0 | 0 | 0 | 112.5 | E45 T46 V47 K52 Q53 | E45-N49 WeakPolarHBondContact O-CB 3.48Å; E45-N49 PolarHBondContact O-N 3.11Å; T46-N49 PolarHBondContact O-N 3.47Å; V47-N49 VanDerWaalsContact C-N 3.33Å; V47-N49 PolarHBondContact O-N 2.7Å; N49-K52 PolarHBondContact O-N 3Å; N49-Q53 PolarHBondContact O-N 3.09Å |
| 50 | K | 89.6 | Confident | 84.1 | Confident | 134 Ų | 134 | 87.5 Ų | 87.5 | 58% | 0.583 | 44% | 0.439 | S | S | * | . | H | α-helix | trans | -62 | -43.5 | 173.2 | -73 | 174.1 | -179.4 | 175.3 | 0 | 111.9 | T46 V47 T48 Q53 A54 | T46-K50 WeakPolarHBondContact O-CG 3.17Å; T46-K50 PolarHBondContact O-N 2.91Å; V47-K50 WeakPolarHBondContact O-CB 3.42Å; V47-K50 PolarHBondContact O-N 2.94Å; T48-K50 PolarHBondContact O-N 2.93Å; K50-Q53 PolarHBondContact O-N 2.82Å; K50-A54 WeakPolarHBondContact O-CB 3.43Å; K50-A54 PolarHBondContact O-N 3.34Å |
| 51 | W | 90 | Very high | 84.8 | Confident | 187 Ų | 187 | 89.4 Ų | 89.4 | 71% | 0.708 | 45% | 0.448 | S | S | * | . | H | α-helix | trans | -64.8 | -41.6 | 175.8 | -79.7 | 109.3 | 0 | 0 | 0 | 112.3 | V47 T48 A54 A55 | V47-W51 PolarHBondContact O-N 3.35Å; T48-W51 PolarHBondContact O-N 3.37Å; W51-A54 PolarHBondContact O-N 2.95Å; W51-A55 WeakPolarHBondContact O-CB 3.4Å; W51-A55 PolarHBondContact O-N 2.87Å |
| 52 | K | 88.1 | Confident | 85.4 | Confident | 59 Ų | 59 | 88.5 Ų | 88.5 | 26% | 0.257 | 45% | 0.445 | S | S | . | . | H | α-helix | trans | -60 | -45.8 | 173.8 | -72.7 | -177.5 | -178 | -169.7 | 0 | 111.7 | T48 N49 A54 A55 W56 T85 L88 | T48-K52 HydrophobicContact CG2-CD 4.49Å; T48-K52 WeakPolarHBondContact O-CG 3.24Å; T48-K52 PolarHBondContact O-N 3.25Å; N49-K52 PolarHBondContact O-N 3Å; K52-A54 PolarHBondContact O-N 3.21Å; K52-A55 PolarHBondContact O-N 2.87Å; K52-W56 WeakPolarHBondContact O-CB 3.47Å; K52-W56 PolarHBondContact O-N 2.98Å; K52-T85 WeakPolarHBondContact CE-O 3.37Å; K52-L88 HydrophobicContact CB-CD2 4.05Å; K52-L88 HydrophobicContact CB-CG 4.35Å |
| 53 | Q | 87.8 | Confident | 85.9 | Confident | 105 Ų | 105 | 88.4 Ų | 88.4 | 49% | 0.491 | 44% | 0.438 | S | S | . | . | H | α-helix | trans | -60.7 | -42.7 | 174.7 | -82.5 | -175.4 | -11.6 | 0 | 0 | 112.6 | N49 K50 W56 K57 L88 | N49-Q53 PolarHBondContact O-N 3.09Å; K50-Q53 PolarHBondContact O-N 2.82Å; Q53-W56 PolarHBondContact O-N 3.25Å; Q53-K57 WeakPolarHBondContact O-CG 3.24Å; Q53-K57 PolarHBondContact O-N 2.84Å; Q53-L88 HydrophobicContact CB-CD1 4.46Å; Q53-L88 HydrophobicContact CG-CD1 3.6Å; Q53-L88 HydrophobicContact CG-CD2 4.22Å |
| 54 | A | 88.9 | Confident | 85.9 | Confident | 50 Ų | 50 | 87.9 Ų | 87.9 | 41% | 0.413 | 44% | 0.441 | S | S | . | . | H | α-helix | trans | -64 | -44.7 | 177.8 | 0 | 0 | 0 | 0 | 0 | 111.5 | K50 W51 K52 W56 K57 A58 | K50-A54 WeakPolarHBondContact O-CB 3.43Å; K50-A54 PolarHBondContact O-N 3.34Å; W51-A54 PolarHBondContact O-N 2.95Å; K52-A54 PolarHBondContact O-N 3.21Å; A54-W56 VanDerWaalsContact C-N 3.34Å; A54-W56 PolarHBondContact O-N 2.69Å; A54-K57 PolarHBondContact O-N 3.38Å; A54-A58 PolarHBondContact O-N 2.84Å |
| 55 | A | 87.2 | Confident | 85.8 | Confident | 41 Ų | 41 | 92.6 Ų | 92.6 | 34% | 0.339 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -61.8 | -42.5 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111.7 | W51 K52 A58 L59 I86 | W51-A55 WeakPolarHBondContact O-CB 3.4Å; W51-A55 PolarHBondContact O-N 2.87Å; K52-A55 PolarHBondContact O-N 2.87Å; A55-A58 PolarHBondContact O-N 3.38Å; A55-L59 WeakPolarHBondContact O-CB 3.37Å; A55-L59 PolarHBondContact O-N 3.48Å; A55-I86 HydrophobicContact CB-CG2 3.9Å |
| 56 | W | 85.8 | Confident | 85.3 | Confident | 115 Ų | 115 | 88.5 Ų | 88.5 | 44% | 0.436 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -65.8 | -40.1 | 178.2 | -160.5 | 80.1 | 0 | 0 | 0 | 112.3 | K52 Q53 A54 L59 Y60 | K52-W56 WeakPolarHBondContact O-CB 3.47Å; K52-W56 PolarHBondContact O-N 2.98Å; Q53-W56 PolarHBondContact O-N 3.25Å; A54-W56 VanDerWaalsContact C-N 3.34Å; A54-W56 PolarHBondContact O-N 2.69Å; W56-L59 WeakPolarHBondContact O-CB 3.46Å; W56-L59 PolarHBondContact O-N 3.24Å; W56-Y60 WeakPolarHBondContact O-CB 3.47Å; W56-Y60 PolarHBondContact O-N 3.45Å |
| 57 | K | 87.5 | Confident | 84.7 | Confident | 135 Ų | 135 | 87.3 Ų | 87.3 | 59% | 0.587 | 44% | 0.444 | S | S | * | . | H | α-helix | trans | -62 | -46.4 | 172.4 | -77.2 | -179.2 | 178.4 | -178.4 | 0 | 112.3 | Q53 A54 L59 Y60 E61 | Q53-K57 WeakPolarHBondContact O-CG 3.24Å; Q53-K57 PolarHBondContact O-N 2.84Å; A54-K57 PolarHBondContact O-N 3.38Å; K57-L59 VanDerWaalsContact C-N 3.28Å; K57-L59 PolarHBondContact O-N 3.03Å; K57-Y60 PolarHBondContact O-N 3.22Å; K57-E61 WeakPolarHBondContact O-CG 3.41Å; K57-E61 PolarHBondContact O-N 2.82Å |
| 58 | A | 87.1 | Confident | 83.8 | Confident | 46 Ų | 46 | 93.7 Ų | 93.7 | 38% | 0.38 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -61.5 | -38.6 | 177.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | A54 A55 E61 L62 | A54-A58 PolarHBondContact O-N 2.84Å; A55-A58 PolarHBondContact O-N 3.38Å; A58-E61 PolarHBondContact O-N 3.43Å; A58-L62 WeakPolarHBondContact O-CB 3.39Å; A58-L62 WeakPolarHBondContact O-CG 3.5Å; A58-L62 PolarHBondContact O-N 3.26Å |
| 59 | L | 85.4 | Confident | 83 | Confident | 9 Ų | 9 | 99.7 Ų | 99.7 | 5% | 0.047 | 49% | 0.49 | C | S | . | . | H | α-helix | trans | -63.8 | -45.1 | 174.2 | -177.4 | 64.3 | 0 | 0 | 0 | 111.8 | A55 W56 K57 E61 L62 I63 E72 I75 L76 I86 | A55-L59 WeakPolarHBondContact O-CB 3.37Å; A55-L59 PolarHBondContact O-N 3.48Å; W56-L59 WeakPolarHBondContact O-CB 3.46Å; W56-L59 PolarHBondContact O-N 3.24Å; K57-L59 VanDerWaalsContact C-N 3.28Å; K57-L59 PolarHBondContact O-N 3.03Å; L59-E61 PolarHBondContact O-N 3.44Å; L59-L62 WeakPolarHBondContact O-CB 3.42Å; L59-L62 PolarHBondContact O-N 2.97Å; L59-I63 HydrophobicContact CG-CD1 4.14Å; L59-I63 VanDerWaalsContact O-CG1 3.31Å; L59-I63 WeakPolarHBondContact O-CG1 3.48Å; L59-I63 PolarHBondContact O-N 2.87Å; L59-E72 HydrophobicContact CD1-CG 4.28Å; L59-E72 HydrophobicContact CD2-CG 3.47Å; L59-E72 VanDerWaalsContact CD2-CG 3.47Å; L59-E72 WeakPolarHBondContact CD2-OE1 3.48Å; L59-E72 HydrophobicContact CG-CG 4Å; L59-I75 HydrophobicContact CD1-CB 3.96Å; L59-I75 HydrophobicContact CD1-CG2 3.58Å; L59-L76 HydrophobicContact CD1-CD2 3.94Å; L59-L76 HydrophobicContact CD1-CG 4.13Å; L59-L76 HydrophobicContact CD2-CD1 4.15Å; L59-L76 HydrophobicContact CD2-CD2 3.82Å; L59-L76 HydrophobicContact CD2-CG 4.09Å; L59-I86 HydrophobicContact CD2-CD1 3.58Å |
| 60 | Y | 83.5 | Confident | 82.3 | Confident | 139 Ų | 139 | 98 Ų | 98 | 55% | 0.545 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -62.7 | -40.9 | 176.9 | -171.3 | -91.7 | 0 | 0 | 0 | 112.4 | W56 K57 I63 S64 | W56-Y60 WeakPolarHBondContact O-CB 3.47Å; W56-Y60 PolarHBondContact O-N 3.45Å; K57-Y60 PolarHBondContact O-N 3.22Å; Y60-I63 PolarHBondContact O-N 3.34Å; Y60-S64 WeakPolarHBondContact O-CB 3.36Å; Y60-S64 PolarHBondContact O-N 2.87Å; Y60-S64 PolarHBondContact O-OG 2.99Å |
| 61 | E | 86.3 | Confident | 81.8 | Confident | 138 Ų | 138 | 95.6 Ų | 95.6 | 65% | 0.645 | 48% | 0.478 | S | S | * | . | H | α-helix | trans | -62.5 | -42.7 | 173.5 | -75.8 | 178.3 | -171 | 0 | 0 | 111.6 | K57 A58 L59 S64 F65 | K57-E61 WeakPolarHBondContact O-CG 3.41Å; K57-E61 PolarHBondContact O-N 2.82Å; A58-E61 PolarHBondContact O-N 3.43Å; L59-E61 PolarHBondContact O-N 3.44Å; E61-S64 PolarHBondContact O-N 3.41Å; E61-F65 WeakPolarHBondContact O-CB 3.37Å; E61-F65 PolarHBondContact O-N 3.1Å |
| 62 | L | 83.8 | Confident | 81.3 | Confident | 97 Ų | 97 | 90.4 Ų | 90.4 | 51% | 0.508 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -61.8 | -44.4 | 175.6 | -84.5 | 161.7 | 0 | 0 | 0 | 112.4 | A58 L59 F65 S66 I75 | A58-L62 WeakPolarHBondContact O-CB 3.39Å; A58-L62 WeakPolarHBondContact O-CG 3.5Å; A58-L62 PolarHBondContact O-N 3.26Å; L59-L62 WeakPolarHBondContact O-CB 3.42Å; L59-L62 PolarHBondContact O-N 2.97Å; L62-F65 PolarHBondContact O-N 3.4Å; L62-S66 WeakPolarHBondContact O-CB 3.45Å; L62-S66 PolarHBondContact O-N 3.45Å; L62-I75 HydrophobicContact CB-CD1 4.32Å; L62-I75 HydrophobicContact CD1-CG2 4.39Å |
| 63 | I | 82.7 | Confident | 81 | Confident | 43 Ų | 43 | 94.1 Ų | 94.1 | 22% | 0.221 | 48% | 0.481 | C | S | . | . | H | α-helix | trans | -61.6 | -49.1 | 176.3 | -67.3 | 163.8 | 0 | 0 | 0 | 109.8 | L59 Y60 F65 S66 G67 E72 I75 | L59-I63 HydrophobicContact CG-CD1 4.14Å; L59-I63 VanDerWaalsContact O-CG1 3.31Å; L59-I63 WeakPolarHBondContact O-CG1 3.48Å; L59-I63 PolarHBondContact O-N 2.87Å; Y60-I63 PolarHBondContact O-N 3.34Å; I63-F65 VanDerWaalsContact C-N 3.27Å; I63-F65 PolarHBondContact O-N 3.46Å; I63-S66 PolarHBondContact O-N 2.83Å; I63-S66 PolarHBondContact O-OG 3.33Å; I63-S66 VanDerWaalsContact O-OG 3.09Å; I63-G67 PolarHBondContact O-N 2.87Å; I63-G67 VanDerWaalsContact O-N 3.11Å; I63-E72 HydrophobicContact CD1-CB 3.71Å; I63-E72 HydrophobicContact CD1-CG 3.97Å; I63-I75 HydrophobicContact CB-CD1 4.48Å; I63-I75 HydrophobicContact CG1-CD1 3.53Å |
| 64 | S | 81.6 | Confident | 80.7 | Confident | 70 Ų | 70 | 93.6 Ų | 93.6 | 49% | 0.49 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -58.9 | -38.8 | 179.2 | -60.8 | 0 | 0 | 0 | 0 | 112.1 | Y60 E61 | Y60-S64 WeakPolarHBondContact O-CB 3.36Å; Y60-S64 PolarHBondContact O-N 2.87Å; Y60-S64 PolarHBondContact O-OG 2.99Å; E61-S64 PolarHBondContact O-N 3.41Å |
| 65 | F | 81.2 | Confident | 80.4 | Confident | 189 Ų | 189 | 92.1 Ų | 92.1 | 83% | 0.829 | 46% | 0.463 | S | S | * | . | H | α-helix | trans | -70.1 | -34.8 | 175.8 | -169.8 | -94.1 | 0 | 0 | 0 | 112.6 | E61 L62 I63 G67 | E61-F65 WeakPolarHBondContact O-CB 3.37Å; E61-F65 PolarHBondContact O-N 3.1Å; L62-F65 PolarHBondContact O-N 3.4Å; I63-F65 VanDerWaalsContact C-N 3.27Å; I63-F65 PolarHBondContact O-N 3.46Å; F65-G67 VanDerWaalsContact C-N 3.31Å; F65-G67 PolarHBondContact O-N 3.11Å |
| 66 | S | 73 | Confident | 80.3 | Confident | 38 Ų | 38 | 90.4 Ų | 90.4 | 27% | 0.266 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -78.5 | -13.8 | -178.6 | 89.7 | 0 | 0 | 0 | 0 | 114.2 | L62 I63 T70 | L62-S66 WeakPolarHBondContact O-CB 3.45Å; L62-S66 PolarHBondContact O-N 3.45Å; I63-S66 PolarHBondContact O-N 2.83Å; I63-S66 PolarHBondContact O-OG 3.33Å; I63-S66 VanDerWaalsContact O-OG 3.09Å; S66-T70 WeakPolarHBondContact CB-OG1 3.18Å; S66-T70 WeakPolarHBondContact OG-CB 3.49Å; S66-T70 PolarHBondContact OG-OG1 3.36Å |
| 67 | G | 70.7 | Confident | 80.3 | Confident | 41 Ų | 41 | 89.1 Ų | 89.1 | 42% | 0.423 | 46% | 0.457 | S | S | . | . | G | 310 helix | trans | 66.8 | -155.7 | -172.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | I63 F65 K69 | I63-G67 PolarHBondContact O-N 2.87Å; I63-G67 VanDerWaalsContact O-N 3.11Å; F65-G67 VanDerWaalsContact C-N 3.31Å; F65-G67 PolarHBondContact O-N 3.11Å; G67-K69 PolarHBondContact O-N 3.05Å; G67-K69 VanDerWaalsContact O-N 3.08Å |
| 68 | E | 67.2 | Low | 80.2 | Confident | 205 Ų | 205 | 90.7 Ų | 90.7 | 96% | 0.958 | 46% | 0.464 | S | S | * | . | G | 310 helix | trans | -67.2 | -3.1 | -178.9 | -101 | -178.2 | 174 | 0 | 0 | 115.1 | ||
| 69 | K | 70.8 | Confident | 80 | Confident | 187 Ų | 187 | 93.1 Ų | 93.1 | 81% | 0.813 | 47% | 0.474 | S | S | * | . | G | 310 helix | trans | -87.3 | -16.2 | -167.1 | -71.6 | -173 | 178.8 | 179.9 | 0 | 115.3 | G67 | G67-K69 PolarHBondContact O-N 3.05Å; G67-K69 VanDerWaalsContact O-N 3.08Å |
| 70 | T | 71 | Confident | 79.9 | Confident | 31 Ų | 31 | 96 Ų | 96 | 19% | 0.19 | 51% | 0.505 | C | S | . | . | trans | -132.5 | 120.4 | -174.9 | -11.7 | 0 | 0 | 0 | 0 | 109.8 | S66 E74 I75 | S66-T70 WeakPolarHBondContact CB-OG1 3.18Å; S66-T70 WeakPolarHBondContact OG-CB 3.49Å; S66-T70 PolarHBondContact OG-OG1 3.36Å; T70-E74 HydrophobicContact CG2-CB 4.12Å; T70-I75 HydrophobicContact CG2-CG1 4.08Å | ||
| 71 | T | 78.8 | Confident | 79.8 | Confident | 82 Ų | 82 | 92.5 Ų | 92.5 | 50% | 0.503 | 50% | 0.495 | S | S | . | . | trans | -76.9 | 153.4 | 176.5 | 53.2 | 0 | 0 | 0 | 0 | 110.6 | Q73 E74 I75 | T71-Q73 PolarHBondContact O-N 3.3Å; T71-E74 PolarHBondContact N-OE2 2.68Å; T71-E74 PolarHBondContact O-N 3.28Å; T71-E74 WeakPolarHBondContact OG1-CG 3.42Å; T71-E74 PolarHBondContact OG1-OE2 3.08Å; T71-E74 VanDerWaalsContact OG1-OE2 3.05Å; T71-I75 PolarHBondContact O-N 3.12Å | ||
| 72 | E | 80 | Confident | 79.6 | Confident | 79 Ų | 79 | 90.8 Ų | 90.8 | 37% | 0.369 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -49.5 | -46.2 | 175.4 | -174.6 | -177.7 | 161.3 | 0 | 0 | 111.5 | L59 I63 E74 I75 L76 | L59-E72 HydrophobicContact CD1-CG 4.28Å; L59-E72 HydrophobicContact CD2-CG 3.47Å; L59-E72 VanDerWaalsContact CD2-CG 3.47Å; L59-E72 WeakPolarHBondContact CD2-OE1 3.48Å; L59-E72 HydrophobicContact CG-CG 4Å; I63-E72 HydrophobicContact CD1-CB 3.71Å; I63-E72 HydrophobicContact CD1-CG 3.97Å; E72-E74 VanDerWaalsContact C-N 3.33Å; E72-E74 PolarHBondContact O-N 2.96Å; E72-I75 PolarHBondContact O-N 2.88Å; E72-L76 HydrophobicContact CG-CD1 3.91Å; E72-L76 HydrophobicContact CG-CG 4.42Å; E72-L76 VanDerWaalsContact O-CG 3.29Å; E72-L76 WeakPolarHBondContact O-CG 3.23Å; E72-L76 PolarHBondContact O-N 3.19Å |
| 73 | Q | 80 | Confident | 79.2 | Confident | 137 Ų | 137 | 88.2 Ų | 88.2 | 64% | 0.64 | 48% | 0.479 | S | S | * | . | H | α-helix | trans | -60.1 | -38.4 | 179.3 | -110.2 | 178.4 | -13.1 | 0 | 0 | 113.4 | T71 S77 P83 | T71-Q73 PolarHBondContact O-N 3.3Å; Q73-S77 VanDerWaalsContact O-CB 3.23Å; Q73-S77 WeakPolarHBondContact O-CB 3.5Å; Q73-S77 PolarHBondContact O-N 3.34Å; Q73-S77 PolarHBondContact O-OG 2.86Å; Q73-P83 HydrophobicContact CG-CG 4.45Å |
| 74 | E | 82.2 | Confident | 78.9 | Confident | 93 Ų | 93 | 89.4 Ų | 89.4 | 44% | 0.435 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -68.3 | -39.9 | 177.1 | -79.1 | 173.6 | 132.2 | 0 | 0 | 111.8 | T70 T71 E72 K78 | T70-E74 HydrophobicContact CG2-CB 4.12Å; T71-E74 PolarHBondContact N-OE2 2.68Å; T71-E74 PolarHBondContact O-N 3.28Å; T71-E74 WeakPolarHBondContact OG1-CG 3.42Å; T71-E74 PolarHBondContact OG1-OE2 3.08Å; T71-E74 VanDerWaalsContact OG1-OE2 3.05Å; E72-E74 VanDerWaalsContact C-N 3.33Å; E72-E74 PolarHBondContact O-N 2.96Å; E74-K78 WeakPolarHBondContact O-CB 3.3Å; E74-K78 WeakPolarHBondContact O-CG 3.47Å; E74-K78 PolarHBondContact O-N 3.32Å |
| 75 | I | 82.5 | Confident | 78.6 | Confident | 19 Ų | 19 | 89.8 Ų | 89.8 | 10% | 0.097 | 50% | 0.495 | C | S | . | . | H | α-helix | trans | -63.2 | -50.6 | 176.6 | -64.2 | 168.1 | 0 | 0 | 0 | 108.8 | L59 L62 I63 T70 T71 E72 S77 K78 V79 | L59-I75 HydrophobicContact CD1-CB 3.96Å; L59-I75 HydrophobicContact CD1-CG2 3.58Å; L62-I75 HydrophobicContact CB-CD1 4.32Å; L62-I75 HydrophobicContact CD1-CG2 4.39Å; I63-I75 HydrophobicContact CB-CD1 4.48Å; I63-I75 HydrophobicContact CG1-CD1 3.53Å; T70-I75 HydrophobicContact CG2-CG1 4.08Å; T71-I75 PolarHBondContact O-N 3.12Å; E72-I75 PolarHBondContact O-N 2.88Å; I75-S77 VanDerWaalsContact C-N 3.34Å; I75-S77 PolarHBondContact O-N 2.76Å; I75-K78 WeakPolarHBondContact O-CB 3.5Å; I75-K78 PolarHBondContact O-N 3.09Å; I75-K78 VanDerWaalsContact O-N 3.08Å; I75-V79 HydrophobicContact CG2-CG2 4.26Å; I75-V79 WeakPolarHBondContact O-CG2 3.32Å; I75-V79 PolarHBondContact O-N 3.34Å |
| 76 | L | 85.6 | Confident | 78.1 | Confident | 5 Ų | 5 | 81.3 Ų | 81.3 | 3% | 0.026 | 46% | 0.459 | C | S | . | . | H | α-helix | trans | -60.2 | -42.7 | 179.1 | -66.3 | 173.3 | 0 | 0 | 0 | 113 | L59 E72 K78 V79 G80 I81 P83 I86 | L59-L76 HydrophobicContact CD1-CD2 3.94Å; L59-L76 HydrophobicContact CD1-CG 4.13Å; L59-L76 HydrophobicContact CD2-CD1 4.15Å; L59-L76 HydrophobicContact CD2-CD2 3.82Å; L59-L76 HydrophobicContact CD2-CG 4.09Å; E72-L76 HydrophobicContact CG-CD1 3.91Å; E72-L76 HydrophobicContact CG-CG 4.42Å; E72-L76 VanDerWaalsContact O-CG 3.29Å; E72-L76 WeakPolarHBondContact O-CG 3.23Å; E72-L76 PolarHBondContact O-N 3.19Å; L76-K78 VanDerWaalsContact C-N 3.29Å; L76-K78 PolarHBondContact O-N 3.13Å; L76-V79 CarbonylContact O-C 3.58Å; L76-V79 PolarHBondContact O-N 2.84Å; L76-G80 PolarHBondContact O-N 3.43Å; L76-I81 HydrophobicContact CD2-CB 4.16Å; L76-I81 HydrophobicContact CD2-CG2 4.18Å; L76-I81 PolarHBondContact O-N 2.9Å; L76-P83 HydrophobicContact CD1-CB 4.12Å; L76-P83 HydrophobicContact CD1-CG 4.05Å; L76-I86 HydrophobicContact CD1-CD1 3.69Å; L76-I86 HydrophobicContact CD2-CD1 3.23Å; L76-I86 HydrophobicContact CD2-CG1 4.34Å; L76-I86 HydrophobicContact CG-CD1 4.06Å |
| 77 | S | 85.7 | Confident | 77.8 | Confident | 89 Ų | 89 | 83.3 Ų | 83.3 | 62% | 0.622 | 47% | 0.469 | S | S | * | . | H | α-helix | trans | -61.7 | -38.2 | 175.5 | -60 | 0 | 0 | 0 | 0 | 111.7 | Q73 I75 G80 | Q73-S77 VanDerWaalsContact O-CB 3.23Å; Q73-S77 WeakPolarHBondContact O-CB 3.5Å; Q73-S77 PolarHBondContact O-N 3.34Å; Q73-S77 PolarHBondContact O-OG 2.86Å; I75-S77 VanDerWaalsContact C-N 3.34Å; I75-S77 PolarHBondContact O-N 2.76Å; S77-G80 PolarHBondContact O-N 2.89Å |
| 78 | K | 84.8 | Confident | 77.2 | Confident | 168 Ų | 168 | 84.2 Ų | 84.2 | 73% | 0.73 | 46% | 0.464 | S | S | * | . | H | α-helix | trans | -67.2 | -37.5 | 175.7 | -79.6 | 177.4 | -179.4 | 177.1 | 0 | 113 | E74 I75 L76 G80 | E74-K78 WeakPolarHBondContact O-CB 3.3Å; E74-K78 WeakPolarHBondContact O-CG 3.47Å; E74-K78 PolarHBondContact O-N 3.32Å; I75-K78 WeakPolarHBondContact O-CB 3.5Å; I75-K78 PolarHBondContact O-N 3.09Å; I75-K78 VanDerWaalsContact O-N 3.08Å; L76-K78 VanDerWaalsContact C-N 3.29Å; L76-K78 PolarHBondContact O-N 3.13Å; K78-G80 VanDerWaalsContact C-N 3.27Å |
| 79 | V | 82.8 | Confident | 76.6 | Confident | 97 Ų | 97 | 83.2 Ų | 83.2 | 59% | 0.588 | 46% | 0.456 | S | S | * | . | H | α-helix | trans | -83.9 | -4.4 | 177.3 | -138 | 0 | 0 | 0 | 0 | 112.6 | I75 L76 I81 | I75-V79 HydrophobicContact CG2-CG2 4.26Å; I75-V79 WeakPolarHBondContact O-CG2 3.32Å; I75-V79 PolarHBondContact O-N 3.34Å; L76-V79 CarbonylContact O-C 3.58Å; L76-V79 PolarHBondContact O-N 2.84Å; V79-I81 VanDerWaalsContact C-N 3.34Å; V79-I81 HydrophobicContact CB-CD1 4.36Å; V79-I81 HydrophobicContact CB-CG1 4.33Å |
| 80 | G | 83.6 | Confident | 75.3 | Confident | 69 Ų | 69 | 79.8 Ų | 79.8 | 71% | 0.711 | 46% | 0.456 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 70.8 | 27.3 | -179.3 | 0 | 0 | 0 | 0 | 0 | 113.8 | L76 S77 K78 | L76-G80 PolarHBondContact O-N 3.43Å; S77-G80 PolarHBondContact O-N 2.89Å; K78-G80 VanDerWaalsContact C-N 3.27Å |
| 81 | I | 81.9 | Confident | 73.7 | Confident | 66 Ų | 66 | 86.5 Ų | 86.5 | 34% | 0.338 | 49% | 0.485 | S | S | . | . | trans | -99.8 | 126.9 | 178.8 | -63 | 178.5 | 0 | 0 | 0 | 109 | L76 V79 I86 | L76-I81 HydrophobicContact CD2-CB 4.16Å; L76-I81 HydrophobicContact CD2-CG2 4.18Å; L76-I81 PolarHBondContact O-N 2.9Å; V79-I81 VanDerWaalsContact C-N 3.34Å; V79-I81 HydrophobicContact CB-CD1 4.36Å; V79-I81 HydrophobicContact CB-CG1 4.33Å; I81-I86 HydrophobicContact CG2-CG1 4.35Å; I81-I86 HydrophobicContact CG2-CG2 4.25Å | ||
| 82 | D | 81.6 | Confident | 71.4 | Confident | 101 Ų | 101 | 85.7 Ų | 85.7 | 54% | 0.54 | 49% | 0.494 | S | S | . | . | trans | -68.9 | 126.3 | 170.4 | -178.2 | -21.4 | 0 | 0 | 0 | 109.2 | A84 T85 | D82-A84 PolarHBondContact O-N 3.45Å; D82-A84 VanDerWaalsContact O-N 3.1Å; D82-A84 WeakPolarHBondContact OD1-CB 3.2Å; D82-A84 PolarHBondContact OD1-N 3.46Å; D82-T85 WeakPolarHBondContact CB-OG1 3.48Å; D82-T85 VanDerWaalsContact O-CB 3.24Å; D82-T85 WeakPolarHBondContact O-CB 3.13Å; D82-T85 PolarHBondContact O-N 2.89Å; D82-T85 PolarHBondContact O-OG1 2.99Å | ||
| 83 | P | 74.7 | Confident | 69.1 | Low | 43 Ų | 43 | 93.9 Ų | 93.9 | 28% | 0.279 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -48.9 | -35.9 | 176.5 | -26.2 | 32.1 | 0 | 0 | 0 | 113.9 | Q73 L76 T85 I86 T87 | Q73-P83 HydrophobicContact CG-CG 4.45Å; L76-P83 HydrophobicContact CD1-CB 4.12Å; L76-P83 HydrophobicContact CD1-CG 4.05Å; P83-T85 PolarHBondContact O-N 2.9Å; P83-T85 VanDerWaalsContact O-N 3.12Å; P83-I86 WeakPolarHBondContact O-CG1 3.31Å; P83-I86 PolarHBondContact O-N 2.84Å; P83-T87 PolarHBondContact O-N 2.8Å; P83-T87 PolarHBondContact O-OG1 3.42Å |
| 84 | A | 76.5 | Confident | 68.6 | Low | 68 Ų | 68 | 91.8 Ų | 91.8 | 56% | 0.562 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -61.9 | -22.9 | 179.2 | 0 | 0 | 0 | 0 | 0 | 113.2 | D82 | D82-A84 PolarHBondContact O-N 3.45Å; D82-A84 VanDerWaalsContact O-N 3.1Å; D82-A84 WeakPolarHBondContact OD1-CB 3.2Å; D82-A84 PolarHBondContact OD1-N 3.46Å |
| 85 | T | 75.1 | Confident | 67.9 | Low | 78 Ų | 78 | 91.7 Ų | 91.7 | 48% | 0.479 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -73.8 | -35.2 | -176.5 | -32.8 | 0 | 0 | 0 | 0 | 112.4 | K52 D82 P83 | K52-T85 WeakPolarHBondContact CE-O 3.37Å; D82-T85 WeakPolarHBondContact CB-OG1 3.48Å; D82-T85 VanDerWaalsContact O-CB 3.24Å; D82-T85 WeakPolarHBondContact O-CB 3.13Å; D82-T85 PolarHBondContact O-N 2.89Å; D82-T85 PolarHBondContact O-OG1 2.99Å; P83-T85 PolarHBondContact O-N 2.9Å; P83-T85 VanDerWaalsContact O-N 3.12Å |
| 86 | I | 72.4 | Confident | 67 | Low | 12 Ų | 12 | 95.7 Ų | 95.7 | 6% | 0.062 | 56% | 0.563 | C | S | . | * | H | α-helix | trans | -105.7 | -9.9 | -177 | 48.3 | 160.7 | 0 | 0 | 0 | 113.1 | A55 L59 L76 I81 P83 L88 | A55-I86 HydrophobicContact CB-CG2 3.9Å; L59-I86 HydrophobicContact CD2-CD1 3.58Å; L76-I86 HydrophobicContact CD1-CD1 3.69Å; L76-I86 HydrophobicContact CD2-CD1 3.23Å; L76-I86 HydrophobicContact CD2-CG1 4.34Å; L76-I86 HydrophobicContact CG-CD1 4.06Å; I81-I86 HydrophobicContact CG2-CG1 4.35Å; I81-I86 HydrophobicContact CG2-CG2 4.25Å; P83-I86 WeakPolarHBondContact O-CG1 3.31Å; P83-I86 PolarHBondContact O-N 2.84Å; I86-L88 PolarHBondContact O-N 3.06Å |
| 87 | T | 65.5 | Low | 66 | Low | 79 Ų | 79 | 101.1 Ų | 101.1 | 49% | 0.485 | 60% | 0.595 | S | S | . | * | trans | -60.3 | 105.7 | 172.9 | -52.4 | 0 | 0 | 0 | 0 | 108.1 | P83 K89 | P83-T87 PolarHBondContact O-N 2.8Å; P83-T87 PolarHBondContact O-OG1 3.42Å; T87-K89 PolarHBondContact O-N 2.97Å; T87-K89 VanDerWaalsContact O-N 3.12Å | ||
| 88 | L | 59 | Low | 64.7 | Low | 61 Ų | 61 | 101.8 Ų | 101.8 | 32% | 0.319 | 59% | 0.593 | S | S | . | * | trans | -67 | 109.6 | 163.9 | -74 | 156.5 | 0 | 0 | 0 | 104.6 | K52 Q53 I86 S90 | K52-L88 HydrophobicContact CB-CD2 4.05Å; K52-L88 HydrophobicContact CB-CG 4.35Å; Q53-L88 HydrophobicContact CB-CD1 4.46Å; Q53-L88 HydrophobicContact CG-CD1 3.6Å; Q53-L88 HydrophobicContact CG-CD2 4.22Å; I86-L88 PolarHBondContact O-N 3.06Å; L88-S90 PolarHBondContact O-N 2.93Å | ||
| 89 | K | 53.6 | Low | 63.4 | Low | 183 Ų | 183 | 97.4 Ų | 97.4 | 80% | 0.796 | 58% | 0.584 | S | S | * | * | trans | -50.2 | 119.9 | 161.4 | -83.1 | -175.6 | 176.3 | 179.1 | 0 | 104.7 | T87 E91 | T87-K89 PolarHBondContact O-N 2.97Å; T87-K89 VanDerWaalsContact O-N 3.12Å; K89-E91 PolarHBondContact O-N 3.19Å | ||
| 90 | S | 44.8 | Very low | 62 | Low | 115 Ų | 115 | 97.4 Ų | 97.4 | 80% | 0.804 | 58% | 0.584 | S | S | * | * | trans | -63.2 | 79.5 | 165.4 | 57.6 | 0 | 0 | 0 | 0 | 106.1 | L88 G92 | L88-S90 PolarHBondContact O-N 2.93Å; S90-G92 PolarHBondContact O-N 3.42Å; S90-G92 VanDerWaalsContact O-N 3.11Å | ||
| 91 | E | 37.4 | Very low | 60.3 | Low | 172 Ų | 172 | 99.6 Ų | 99.6 | 80% | 0.804 | 57% | 0.574 | S | S | * | * | trans | -61.6 | 113.3 | 154.8 | -74.8 | -170.2 | 163.9 | 0 | 0 | 104.3 | K89 | K89-E91 PolarHBondContact O-N 3.19Š| ||
| 92 | G | 30.7 | Very low | 58.5 | Low | 66 Ų | 66 | 102.4 Ų | 102.4 | 68% | 0.68 | 59% | 0.594 | S | S | * | * | trans | -48.4 | 146.3 | -164.4 | 0 | 0 | 0 | 0 | 0 | 113.3 | S90 | S90-G92 PolarHBondContact O-N 3.42Å; S90-G92 VanDerWaalsContact O-N 3.11Å | ||
| 93 | L | 31.3 | Very low | 56.4 | Low | 251 Ų | 251 | 102.5 Ų | 102.5 | 100% | 1.314 | 60% | 0.598 | S | S | * | * | trans | -47.6 | 0 | 144.8 | -78.8 | 159.4 | 0 | 0 | 0 | 110.6 |
Retrieved 93 of 93 residues in 53.5 ms
(Link to these results)