| 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 | 32.4 | Very low | 34.2 | Very low | 246 Ų | 246 | 140.8 Ų | 140.8 | 100% | 1.212 | 78% | 0.78 | S | S | * | * | 0 | 93.4 | 0 | -93.5 | 175.4 | 174.3 | 0 | 0 | 106.7 | A3 | M1-A3 PolarHBondContact O-N 3.48Š| |||
| 2 | E | 34 | Very low | 34.8 | Very low | 182 Ų | 182 | 138.7 Ų | 138.7 | 85% | 0.85 | 77% | 0.774 | S | S | * | * | trans | -79.9 | 111.7 | 177.9 | -66.9 | 171.3 | 160.1 | 0 | 0 | 107.7 | N4 | E2-N4 PolarHBondContact O-N 3.28Š| ||
| 3 | A | 30.7 | Very low | 35.7 | Very low | 80 Ų | 80 | 133.9 Ų | 133.9 | 66% | 0.661 | 74% | 0.742 | S | S | * | * | trans | -82.7 | 93.9 | 173.4 | 0 | 0 | 0 | 0 | 0 | 108.6 | M1 Y5 | M1-A3 PolarHBondContact O-N 3.48Å; A3-Y5 HydrophobicContact CB-CE2 4.28Å; A3-Y5 PolarHBondContact O-N 2.77Å; A3-Y5 VanDerWaalsContact O-N 3.12Å | ||
| 4 | N | 31.4 | Very low | 36 | Very low | 143 Ų | 143 | 134.4 Ų | 134.4 | 77% | 0.765 | 74% | 0.738 | S | S | * | * | trans | -64.7 | 103.2 | 165.6 | -80.6 | -30.6 | 0 | 0 | 0 | 109 | E2 S6 | E2-N4 PolarHBondContact O-N 3.28Å; N4-S6 VanDerWaalsContact C-N 3.29Å; N4-S6 PolarHBondContact O-N 3.25Å | ||
| 5 | Y | 31 | Very low | 36.5 | Very low | 215 Ų | 215 | 132.4 Ų | 132.4 | 84% | 0.843 | 73% | 0.731 | S | S | * | * | trans | -78.1 | 83.1 | 165.7 | -82.7 | -88.7 | 0 | 0 | 0 | 109.2 | A3 I7 | A3-Y5 HydrophobicContact CB-CE2 4.28Å; A3-Y5 PolarHBondContact O-N 2.77Å; A3-Y5 VanDerWaalsContact O-N 3.12Å; Y5-I7 PolarHBondContact O-N 3.18Å | ||
| 6 | S | 35.5 | Very low | 37.1 | Very low | 105 Ų | 105 | 128.8 Ų | 128.8 | 73% | 0.734 | 71% | 0.714 | S | S | * | * | trans | -77.2 | 109.5 | 160.2 | 50.9 | 0 | 0 | 0 | 0 | 108.6 | N4 | N4-S6 VanDerWaalsContact C-N 3.29Å; N4-S6 PolarHBondContact O-N 3.25Å | ||
| 7 | I | 37.1 | Very low | 37.6 | Very low | 138 Ų | 138 | 129.9 Ų | 129.9 | 71% | 0.708 | 71% | 0.706 | S | S | * | * | trans | -69.3 | 126.5 | 174.8 | -60.3 | 173.7 | 0 | 0 | 0 | 108.5 | Y5 L9 | Y5-I7 PolarHBondContact O-N 3.18Å; I7-L9 PolarHBondContact O-N 3.36Å | ||
| 8 | P | 30.2 | Very low | 38.5 | Very low | 105 Ų | 105 | 128.2 Ų | 128.2 | 68% | 0.682 | 70% | 0.696 | S | S | * | * | trans | -72.4 | 115.5 | 171 | 28.5 | -28.9 | 0 | 0 | 0 | 108.8 | N10 | P8-N10 VanDerWaalsContact C-N 3.34Å; P8-N10 PolarHBondContact O-N 3.12Å | ||
| 9 | L | 41.3 | Very low | 40.3 | Very low | 147 Ų | 147 | 124.2 Ų | 124.2 | 77% | 0.77 | 68% | 0.678 | S | S | * | * | trans | -67.1 | 88.4 | 175.7 | -151 | 90.5 | 0 | 0 | 0 | 108.8 | I7 E13 | I7-L9 PolarHBondContact O-N 3.36Å; L9-E13 VanDerWaalsContact CA-OE2 3.31Å; L9-E13 WeakPolarHBondContact CA-OE2 3.5Å; L9-E13 VanDerWaalsContact CD1-OE2 3.26Å; L9-E13 WeakPolarHBondContact CD1-OE2 3.49Å; L9-E13 WeakPolarHBondContact CG-OE2 3.17Å | ||
| 10 | N | 32.7 | Very low | 42.4 | Very low | 118 Ų | 118 | 124.6 Ų | 124.6 | 63% | 0.631 | 68% | 0.678 | S | S | * | * | trans | -86.6 | 127.7 | -177.6 | -129.4 | 2 | 0 | 0 | 0 | 109.3 | P8 T12 E13 | P8-N10 VanDerWaalsContact C-N 3.34Å; P8-N10 PolarHBondContact O-N 3.12Å; N10-T12 PolarHBondContact O-N 3.37Å; N10-E13 WeakPolarHBondContact O-CB 3.4Å; N10-E13 VanDerWaalsContact O-CG 3.28Å; N10-E13 WeakPolarHBondContact O-CG 3.38Å; N10-E13 PolarHBondContact O-N 2.96Å | ||
| 11 | G | 40.2 | Very low | 44.4 | Very low | 70 Ų | 70 | 123 Ų | 123 | 72% | 0.722 | 67% | 0.673 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -59 | 7 | -165.5 | 0 | 0 | 0 | 0 | 0 | 118.8 | ||
| 12 | T | 41.4 | Very low | 46.8 | Very low | 115 Ų | 115 | 112.2 Ų | 112.2 | 71% | 0.706 | 62% | 0.622 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -85.9 | -13.5 | 164.8 | 16.1 | 0 | 0 | 0 | 0 | 113.1 | N10 M14 | N10-T12 PolarHBondContact O-N 3.37Å; T12-M14 VanDerWaalsContact C-N 3.26Å; T12-M14 PolarHBondContact O-N 3.4Å |
| 13 | E | 45.8 | Very low | 49.3 | Very low | 77 Ų | 77 | 108.3 Ų | 108.3 | 36% | 0.36 | 60% | 0.602 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -65 | -22.7 | -178.3 | -77.3 | 176.4 | 172.2 | 0 | 0 | 114.6 | L9 N10 | L9-E13 VanDerWaalsContact CA-OE2 3.31Å; L9-E13 WeakPolarHBondContact CA-OE2 3.5Å; L9-E13 VanDerWaalsContact CD1-OE2 3.26Å; L9-E13 WeakPolarHBondContact CD1-OE2 3.49Å; L9-E13 WeakPolarHBondContact CG-OE2 3.17Å; N10-E13 WeakPolarHBondContact O-CB 3.4Å; N10-E13 VanDerWaalsContact O-CG 3.28Å; N10-E13 WeakPolarHBondContact O-CG 3.38Å; N10-E13 PolarHBondContact O-N 2.96Å |
| 14 | M | 40.1 | Very low | 52.1 | Low | 141 Ų | 141 | 108.5 Ų | 108.5 | 70% | 0.695 | 60% | 0.595 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -94.3 | -10.1 | -172.3 | -147 | -179.6 | -69.3 | 0 | 0 | 114.3 | T12 D18 | T12-M14 VanDerWaalsContact C-N 3.26Å; T12-M14 PolarHBondContact O-N 3.4Å; M14-D18 WeakPolarHBondContact O-CB 3.47Å |
| 15 | V | 43.2 | Very low | 55 | Low | 104 Ų | 104 | 104 Ų | 104 | 63% | 0.63 | 57% | 0.571 | S | S | * | * | S | Bend | trans | -87.1 | -28.1 | -169.6 | -177.3 | 0 | 0 | 0 | 0 | 113.2 | ||
| 16 | V | 46.2 | Very low | 57.8 | Low | 75 Ų | 75 | 97.4 Ų | 97.4 | 46% | 0.455 | 54% | 0.544 | S | S | . | . | S | Bend | trans | -85.1 | -28.3 | -174.5 | -177.5 | 0 | 0 | 0 | 0 | 112.5 | I281 | V16-I281 HydrophobicContact CG1-CD1 4.25Š|
| 17 | Y | 45.8 | Very low | 60.5 | Low | 148 Ų | 148 | 97.1 Ų | 97.1 | 58% | 0.58 | 53% | 0.533 | S | S | * | . | S | Bend | trans | -90.3 | -8.6 | 179.2 | -126.1 | -90.4 | 0 | 0 | 0 | 113.8 | ||
| 18 | D | 53.8 | Low | 63.3 | Low | 99 Ų | 99 | 94.9 Ų | 94.9 | 53% | 0.529 | 52% | 0.522 | S | S | . | . | S | Bend | trans | -109.4 | 5.3 | -179.1 | -151.2 | 33.6 | 0 | 0 | 0 | 113.6 | M14 I20 K23 | M14-D18 WeakPolarHBondContact O-CB 3.47Å; D18-I20 PolarHBondContact O-N 2.78Å; D18-K23 WeakPolarHBondContact OD1-CE 3.14Å; D18-K23 IonicContact OD1-NZ 2.69Å; D18-K23 PolarHBondContact OD1-NZ 2.83Å |
| 19 | S | 73.4 | Confident | 66.3 | Low | 51 Ų | 51 | 89.9 Ų | 89.9 | 36% | 0.357 | 49% | 0.49 | S | S | . | . | trans | -62.5 | 127.9 | 174.4 | 174.5 | 0 | 0 | 0 | 0 | 110.5 | T21 S22 K23 | S19-T21 PolarHBondContact O-N 3.47Å; S19-T21 PolarHBondContact OG-N 2.94Å; S19-S22 PolarHBondContact O-N 3.08Å; S19-K23 PolarHBondContact O-N 3.41Å | ||
| 20 | I | 82.1 | Confident | 68.9 | Low | 132 Ų | 132 | 83.9 Ų | 83.9 | 68% | 0.677 | 46% | 0.458 | S | S | * | . | H | α-helix | trans | -47.1 | -38.8 | 175 | -64.2 | 171.8 | 0 | 0 | 0 | 110.6 | D18 S22 K23 V24 | D18-I20 PolarHBondContact O-N 2.78Å; I20-S22 PolarHBondContact O-N 3.15Å; I20-K23 PolarHBondContact O-N 2.72Å; I20-V24 HydrophobicContact CG2-CG2 4.09Å; I20-V24 WeakPolarHBondContact O-CB 3.36Å; I20-V24 VanDerWaalsContact O-CG2 3.26Å; I20-V24 WeakPolarHBondContact O-CG2 3.41Å; I20-V24 PolarHBondContact O-N 2.65Å |
| 21 | T | 83.9 | Confident | 71.9 | Confident | 92 Ų | 92 | 81.8 Ų | 81.8 | 56% | 0.564 | 45% | 0.449 | S | S | * | . | H | α-helix | trans | -60 | -43.4 | 179.5 | -50.1 | 0 | 0 | 0 | 0 | 112.9 | S19 V24 L25 | S19-T21 PolarHBondContact O-N 3.47Å; S19-T21 PolarHBondContact OG-N 2.94Å; T21-V24 PolarHBondContact O-N 2.84Å; T21-L25 HydrophobicContact CG2-CD1 4.21Å; T21-L25 WeakPolarHBondContact O-CB 3.22Å; T21-L25 VanDerWaalsContact O-CG 3.3Å; T21-L25 WeakPolarHBondContact O-CG 3.45Å; T21-L25 PolarHBondContact O-N 3.49Å |
| 22 | S | 82.4 | Confident | 74.5 | Confident | 20 Ų | 20 | 80.2 Ų | 80.2 | 14% | 0.14 | 43% | 0.426 | C | S | . | . | H | α-helix | trans | -65.1 | -44.6 | 179.2 | 175.2 | 0 | 0 | 0 | 0 | 111 | S19 I20 V24 L25 W26 | S19-S22 PolarHBondContact O-N 3.08Å; I20-S22 PolarHBondContact O-N 3.15Å; S22-V24 PolarHBondContact O-N 3.33Å; S22-L25 PolarHBondContact O-N 3.45Å; S22-W26 WeakPolarHBondContact O-CB 3.46Å; S22-W26 PolarHBondContact O-N 3.21Å |
| 23 | K | 86.9 | Confident | 77.1 | Confident | 100 Ų | 100 | 74.7 Ų | 74.7 | 44% | 0.435 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -61.3 | -43.8 | 176.2 | -67 | 177.5 | -177.7 | 168.1 | 0 | 111.8 | D18 S19 I20 W26 I27 | D18-K23 WeakPolarHBondContact OD1-CE 3.14Å; D18-K23 IonicContact OD1-NZ 2.69Å; D18-K23 PolarHBondContact OD1-NZ 2.83Å; S19-K23 PolarHBondContact O-N 3.41Å; I20-K23 PolarHBondContact O-N 2.72Å; K23-W26 PolarHBondContact O-N 3.36Å; K23-I27 VanDerWaalsContact O-CG1 3.3Å; K23-I27 WeakPolarHBondContact O-CG1 3.39Å; K23-I27 PolarHBondContact O-N 3.47Å |
| 24 | V | 90.5 | Very high | 79.5 | Confident | 84 Ų | 84 | 73.2 Ų | 73.2 | 51% | 0.509 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -62.8 | -45.8 | 177.4 | 170.5 | 0 | 0 | 0 | 0 | 111.1 | I20 T21 S22 W26 I27 L28 | I20-V24 HydrophobicContact CG2-CG2 4.09Å; I20-V24 WeakPolarHBondContact O-CB 3.36Å; I20-V24 VanDerWaalsContact O-CG2 3.26Å; I20-V24 WeakPolarHBondContact O-CG2 3.41Å; I20-V24 PolarHBondContact O-N 2.65Å; T21-V24 PolarHBondContact O-N 2.84Å; S22-V24 PolarHBondContact O-N 3.33Å; V24-W26 VanDerWaalsContact C-N 3.33Å; V24-W26 PolarHBondContact O-N 2.96Å; V24-I27 PolarHBondContact O-N 2.79Å; V24-L28 VanDerWaalsContact O-CB 3.23Å; V24-L28 WeakPolarHBondContact O-CB 3.39Å; V24-L28 PolarHBondContact O-N 3.08Å |
| 25 | L | 91.3 | Very high | 82.1 | Confident | 49 Ų | 49 | 70.4 Ų | 70.4 | 26% | 0.257 | 38% | 0.377 | S | S | . | . | H | α-helix | trans | -62.8 | -39.2 | 177.5 | -73.2 | 173 | 0 | 0 | 0 | 112.3 | T21 S22 L28 S29 I281 | T21-L25 HydrophobicContact CG2-CD1 4.21Å; T21-L25 WeakPolarHBondContact O-CB 3.22Å; T21-L25 VanDerWaalsContact O-CG 3.3Å; T21-L25 WeakPolarHBondContact O-CG 3.45Å; T21-L25 PolarHBondContact O-N 3.49Å; S22-L25 PolarHBondContact O-N 3.45Å; L25-L28 PolarHBondContact O-N 3.19Å; L25-S29 WeakPolarHBondContact O-CB 3.48Å; L25-S29 PolarHBondContact O-N 2.83Å; L25-S29 PolarHBondContact O-OG 3.03Å; L25-I281 HydrophobicContact CD1-CG2 4.23Å |
| 26 | W | 90.2 | Very high | 84.5 | Confident | 75 Ų | 75 | 65.4 Ų | 65.4 | 28% | 0.284 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -65.8 | -48.3 | 177.1 | -176.4 | 72.7 | 0 | 0 | 0 | 111.9 | S22 K23 V24 L28 S29 M30 M85 H284 | S22-W26 WeakPolarHBondContact O-CB 3.46Å; S22-W26 PolarHBondContact O-N 3.21Å; K23-W26 PolarHBondContact O-N 3.36Å; V24-W26 VanDerWaalsContact C-N 3.33Å; V24-W26 PolarHBondContact O-N 2.96Å; W26-L28 VanDerWaalsContact C-N 3.34Å; W26-L28 PolarHBondContact O-N 2.82Å; W26-S29 WeakPolarHBondContact O-CB 3.43Å; W26-S29 PolarHBondContact O-N 3Å; W26-M30 HydrophobicContact CD2-CE 3.95Å; W26-M30 HydrophobicContact CG-CE 4.45Å; W26-M30 HydrophobicContact CH2-CE 4.23Å; W26-M30 HydrophobicContact CZ2-CE 3.61Å; W26-M30 WeakPolarHBondContact O-CG 3.46Å; W26-M30 PolarHBondContact O-N 2.82Å; W26-M30 VanDerWaalsContact O-N 3.16Å; W26-M85 WeakPolarHBondContact CZ2-O 2.84Å; W26-H284 AromaticContact CD1-CD2 3.95Å |
| 27 | I | 92.7 | Very high | 86.9 | Confident | 99 Ų | 99 | 64.5 Ų | 64.5 | 51% | 0.508 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -60.8 | -44.3 | 175.1 | -66.8 | 167.8 | 0 | 0 | 0 | 110.7 | K23 V24 S29 M30 V31 | K23-I27 VanDerWaalsContact O-CG1 3.3Å; K23-I27 WeakPolarHBondContact O-CG1 3.39Å; K23-I27 PolarHBondContact O-N 3.47Å; V24-I27 PolarHBondContact O-N 2.79Å; I27-S29 VanDerWaalsContact C-N 3.27Å; I27-S29 PolarHBondContact O-N 3.34Å; I27-M30 WeakPolarHBondContact O-CB 3.48Å; I27-M30 PolarHBondContact O-N 3.3Å; I27-M30 VanDerWaalsContact O-N 3.16Å; I27-V31 HydrophobicContact CG2-CG2 4.5Å; I27-V31 WeakPolarHBondContact O-CG2 3.18Å; I27-V31 PolarHBondContact O-N 3.29Å |
| 28 | L | 94.5 | Very high | 89.2 | Confident | 91 Ų | 91 | 63.7 Ų | 63.7 | 48% | 0.476 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -57.9 | -42.1 | 176.7 | -179.9 | 64.5 | 0 | 0 | 0 | 111.3 | V24 L25 W26 M30 V31 V32 | V24-L28 VanDerWaalsContact O-CB 3.23Å; V24-L28 WeakPolarHBondContact O-CB 3.39Å; V24-L28 PolarHBondContact O-N 3.08Å; L25-L28 PolarHBondContact O-N 3.19Å; W26-L28 VanDerWaalsContact C-N 3.34Å; W26-L28 PolarHBondContact O-N 2.82Å; L28-M30 VanDerWaalsContact C-N 3.34Å; L28-M30 PolarHBondContact O-N 3.03Å; L28-V31 PolarHBondContact O-N 3.26Å; L28-V32 HydrophobicContact CD1-CG2 4.36Å; L28-V32 HydrophobicContact CG-CG2 4.45Å; L28-V32 WeakPolarHBondContact O-CG2 3.46Å; L28-V32 PolarHBondContact O-N 3.41Å |
| 29 | S | 94.7 | Very high | 91.1 | Very high | 1 Ų | 1 | 61.6 Ų | 61.6 | 1% | 0.007 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -59.7 | -43.8 | 177.2 | -55.6 | 0 | 0 | 0 | 0 | 111.4 | L25 W26 I27 V31 V32 I33 H284 P285 | L25-S29 WeakPolarHBondContact O-CB 3.48Å; L25-S29 PolarHBondContact O-N 2.83Å; L25-S29 PolarHBondContact O-OG 3.03Å; W26-S29 WeakPolarHBondContact O-CB 3.43Å; W26-S29 PolarHBondContact O-N 3Å; I27-S29 VanDerWaalsContact C-N 3.27Å; I27-S29 PolarHBondContact O-N 3.34Å; S29-V31 PolarHBondContact O-N 3.4Å; S29-V32 PolarHBondContact O-N 3Å; S29-I33 WeakPolarHBondContact O-CG1 3.42Å; S29-I33 PolarHBondContact O-N 3.34Å; S29-H284 VanDerWaalsContact OG-C 3.23Å; S29-H284 PolarHBondContact OG-O 3.07Å; S29-P285 WeakPolarHBondContact OG-CA 3.49Å; S29-P285 VanDerWaalsContact OG-N 3.09Å |
| 30 | M | 94.8 | Very high | 92 | Very high | 21 Ų | 21 | 59.2 Ų | 59.2 | 10% | 0.103 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -60.1 | -44.9 | 175.3 | -59.4 | -67.4 | -179.9 | 0 | 0 | 112.5 | W26 I27 L28 I33 S34 V82 M85 A86 | W26-M30 HydrophobicContact CD2-CE 3.95Å; W26-M30 HydrophobicContact CG-CE 4.45Å; W26-M30 HydrophobicContact CH2-CE 4.23Å; W26-M30 HydrophobicContact CZ2-CE 3.61Å; W26-M30 WeakPolarHBondContact O-CG 3.46Å; W26-M30 PolarHBondContact O-N 2.82Å; W26-M30 VanDerWaalsContact O-N 3.16Å; I27-M30 WeakPolarHBondContact O-CB 3.48Å; I27-M30 PolarHBondContact O-N 3.3Å; I27-M30 VanDerWaalsContact O-N 3.16Å; L28-M30 VanDerWaalsContact C-N 3.34Å; L28-M30 PolarHBondContact O-N 3.03Å; M30-I33 PolarHBondContact O-N 3.34Å; M30-S34 WeakPolarHBondContact O-CB 3.32Å; M30-S34 PolarHBondContact O-N 2.84Å; M30-S34 PolarHBondContact O-OG 3.24Å; M30-V82 HydrophobicContact SD-CG1 3.96Å; M30-M85 HydrophobicContact CE-CB 3.38Å; M30-M85 HydrophobicContact CE-CG 3.14Å; M30-M85 HydrophobicContact CE-SD 3.32Å; M30-M85 WeakPolarHBondContact CE-SD 3.48Å; M30-M85 HydrophobicContact CG-SD 4.4Å; M30-M85 HydrophobicContact SD-CB 3.69Å; M30-M85 HydrophobicContact SD-CG 3.84Å; M30-M85 HydrophobicContact SD-SD 3.5Å; M30-A86 HydrophobicContact CE-CB 4.35Å |
| 31 | V | 95.9 | Very high | 92.6 | Very high | 73 Ų | 73 | 54.8 Ų | 54.8 | 44% | 0.442 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -62.7 | -46.7 | -179.8 | 172.5 | 0 | 0 | 0 | 0 | 109.7 | I27 L28 S29 I33 S34 I35 | I27-V31 HydrophobicContact CG2-CG2 4.5Å; I27-V31 WeakPolarHBondContact O-CG2 3.18Å; I27-V31 PolarHBondContact O-N 3.29Å; L28-V31 PolarHBondContact O-N 3.26Å; S29-V31 PolarHBondContact O-N 3.4Å; V31-I33 PolarHBondContact O-N 3.22Å; V31-S34 PolarHBondContact O-N 3.06Å; V31-I35 HydrophobicContact CG1-CD1 3.84Å; V31-I35 WeakPolarHBondContact O-CG1 3.29Å; V31-I35 PolarHBondContact O-N 3.43Å |
| 32 | V | 95.6 | Very high | 93 | Very high | 37 Ų | 37 | 56.3 Ų | 56.3 | 22% | 0.224 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -60.4 | -45.7 | 177 | 171.7 | 0 | 0 | 0 | 0 | 111.1 | L28 S29 S34 I35 T36 | L28-V32 HydrophobicContact CD1-CG2 4.36Å; L28-V32 HydrophobicContact CG-CG2 4.45Å; L28-V32 WeakPolarHBondContact O-CG2 3.46Å; L28-V32 PolarHBondContact O-N 3.41Å; S29-V32 PolarHBondContact O-N 3Å; V32-S34 VanDerWaalsContact C-N 3.33Å; V32-S34 PolarHBondContact O-N 2.87Å; V32-I35 PolarHBondContact O-N 2.77Å; V32-T36 WeakPolarHBondContact O-CB 2.89Å; V32-T36 PolarHBondContact O-N 2.89Å; V32-T36 PolarHBondContact O-OG1 3.46Å |
| 33 | I | 94.8 | Very high | 93.4 | Very high | 0 Ų | 0 | 56.2 Ų | 56.2 | 0% | 0 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -65.9 | -37.7 | 179.1 | -61.6 | 167.3 | 0 | 0 | 0 | 111.1 | S29 M30 V31 T36 F37 L78 V82 M85 F291 | S29-I33 WeakPolarHBondContact O-CG1 3.42Å; S29-I33 PolarHBondContact O-N 3.34Å; M30-I33 PolarHBondContact O-N 3.34Å; V31-I33 PolarHBondContact O-N 3.22Å; I33-T36 CarbonylContact O-C 3.36Å; I33-T36 WeakPolarHBondContact O-CB 3.3Å; I33-T36 PolarHBondContact O-N 3.09Å; I33-F37 PolarHBondContact O-N 3.06Å; I33-L78 HydrophobicContact CG2-CB 3.93Å; I33-L78 HydrophobicContact CG2-CD1 4.17Å; I33-L78 HydrophobicContact CG2-CD2 3.83Å; I33-L78 HydrophobicContact CG2-CG 4.18Å; I33-V82 HydrophobicContact CB-CG2 3.59Å; I33-V82 HydrophobicContact CG2-CG2 3.18Å; I33-M85 HydrophobicContact CD1-CE 3.53Å; I33-M85 HydrophobicContact CD1-SD 4.45Å; I33-F291 HydrophobicContact CD1-CD2 4.21Å; I33-F291 HydrophobicContact CD1-CE2 4.43Å; I33-F291 HydrophobicContact CG1-CD2 4.12Å |
| 34 | S | 95.9 | Very high | 93.6 | Very high | 45 Ų | 45 | 51.4 Ų | 51.4 | 32% | 0.315 | 27% | 0.272 | S | S | . | . | H | α-helix | trans | -65 | -43.1 | 176.6 | -57.8 | 0 | 0 | 0 | 0 | 111.6 | M30 V31 V32 T36 F37 F38 | M30-S34 WeakPolarHBondContact O-CB 3.32Å; M30-S34 PolarHBondContact O-N 2.84Å; M30-S34 PolarHBondContact O-OG 3.24Å; V31-S34 PolarHBondContact O-N 3.06Å; V32-S34 VanDerWaalsContact C-N 3.33Å; V32-S34 PolarHBondContact O-N 2.87Å; S34-T36 VanDerWaalsContact C-N 3.32Å; S34-T36 PolarHBondContact O-N 3.34Å; S34-F37 WeakPolarHBondContact O-CB 3.47Å; S34-F37 PolarHBondContact O-N 3.16Å; S34-F38 WeakPolarHBondContact O-CD2 3.32Å; S34-F38 PolarHBondContact O-N 2.87Å |
| 35 | I | 95.3 | Very high | 93.7 | Very high | 82 Ų | 82 | 48.5 Ų | 48.5 | 42% | 0.421 | 26% | 0.259 | S | S | . | . | H | α-helix | trans | -62.8 | -42.6 | 173.3 | -68.5 | 167.6 | 0 | 0 | 0 | 110.4 | V31 V32 F37 F38 I39 | V31-I35 HydrophobicContact CG1-CD1 3.84Å; V31-I35 WeakPolarHBondContact O-CG1 3.29Å; V31-I35 PolarHBondContact O-N 3.43Å; V32-I35 PolarHBondContact O-N 2.77Å; I35-F37 VanDerWaalsContact C-N 3.27Å; I35-F37 PolarHBondContact O-N 3.31Å; I35-F38 PolarHBondContact O-N 3.32Å; I35-I39 HydrophobicContact CG2-CD1 3.5Å; I35-I39 VanDerWaalsContact CG2-CD1 3.5Å; I35-I39 HydrophobicContact CG2-CG1 4.15Å; I35-I39 WeakPolarHBondContact O-CG1 3.13Å; I35-I39 PolarHBondContact O-N 3.06Å |
| 36 | T | 94.8 | Very high | 93.6 | Very high | 0 Ų | 0 | 48.9 Ų | 48.9 | 0% | 0 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -58.5 | -39.8 | 176.2 | -57.4 | 0 | 0 | 0 | 0 | 111 | V32 I33 S34 G40 L78 F291 F292 C295 | V32-T36 WeakPolarHBondContact O-CB 2.89Å; V32-T36 PolarHBondContact O-N 2.89Å; V32-T36 PolarHBondContact O-OG1 3.46Å; I33-T36 CarbonylContact O-C 3.36Å; I33-T36 WeakPolarHBondContact O-CB 3.3Å; I33-T36 PolarHBondContact O-N 3.09Å; S34-T36 VanDerWaalsContact C-N 3.32Å; S34-T36 PolarHBondContact O-N 3.34Å; T36-G40 VanDerWaalsContact O-CA 3.29Å; T36-G40 WeakPolarHBondContact O-CA 3.25Å; T36-G40 PolarHBondContact O-N 3.47Å; T36-L78 HydrophobicContact CG2-CD1 3.56Å; T36-F291 HydrophobicContact CG2-CB 4.41Å; T36-F291 WeakPolarHBondContact CG2-O 3.16Å; T36-F292 WeakPolarHBondContact OG1-CD2 3.22Å; T36-C295 VanDerWaalsContact CA-SG 3.59Å; T36-C295 WeakPolarHBondContact CG2-SG 3.25Å; T36-C295 PolarHBondContact O-SG 2.98Å |
| 37 | F | 95.7 | Very high | 93.5 | Very high | 56 Ų | 56 | 45.4 Ų | 45.4 | 25% | 0.246 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -58.3 | -55 | 174.6 | 165.9 | -105.5 | 0 | 0 | 0 | 111.8 | I33 S34 I35 G40 V41 T75 L78 P79 | I33-F37 PolarHBondContact O-N 3.06Å; S34-F37 WeakPolarHBondContact O-CB 3.47Å; S34-F37 PolarHBondContact O-N 3.16Å; I35-F37 VanDerWaalsContact C-N 3.27Å; I35-F37 PolarHBondContact O-N 3.31Å; F37-G40 PolarHBondContact O-N 2.7Å; F37-V41 HydrophobicContact CD2-CG2 3.84Å; F37-V41 HydrophobicContact CE2-CG2 3.66Å; F37-V41 HydrophobicContact CZ-CG2 4.39Å; F37-V41 WeakPolarHBondContact O-CB 3.49Å; F37-V41 WeakPolarHBondContact O-CG2 3.37Å; F37-V41 PolarHBondContact O-N 3.29Å; F37-T75 WeakPolarHBondContact CD2-O 3.34Å; F37-L78 HydrophobicContact CB-CB 4.2Å; F37-L78 HydrophobicContact CB-CD1 4.28Å; F37-P79 HydrophobicContact CD2-CG 3.57Å; F37-P79 HydrophobicContact CE1-CG 4.49Å; F37-P79 HydrophobicContact CE2-CG 3.49Å; F37-P79 VanDerWaalsContact CE2-CG 3.49Å; F37-P79 HydrophobicContact CG-CG 4.11Å; F37-P79 HydrophobicContact CZ-CG 3.98Å |
| 38 | F | 94.8 | Very high | 93.4 | Very high | 131 Ų | 131 | 42.2 Ų | 42.2 | 58% | 0.575 | 23% | 0.232 | S | C | * | . | H | α-helix | trans | -64.1 | -47.8 | -176.7 | -71.9 | -71.2 | 0 | 0 | 0 | 112.5 | S34 I35 G40 L42 | S34-F38 WeakPolarHBondContact O-CD2 3.32Å; S34-F38 PolarHBondContact O-N 2.87Å; I35-F38 PolarHBondContact O-N 3.32Å; F38-G40 VanDerWaalsContact C-N 3.32Å; F38-G40 PolarHBondContact O-N 3.34Å; F38-L42 WeakPolarHBondContact O-CB 3.35Å; F38-L42 WeakPolarHBondContact O-CD1 3.34Å; F38-L42 VanDerWaalsContact O-CG 3.24Å; F38-L42 WeakPolarHBondContact O-CG 3.46Å; F38-L42 PolarHBondContact O-N 3.34Å |
| 39 | I | 93.3 | Very high | 93 | Very high | 55 Ų | 55 | 41.7 Ų | 41.7 | 28% | 0.282 | 22% | 0.224 | S | C | . | . | H | α-helix | trans | -65.6 | -40.7 | 179.4 | -62.1 | 178 | 0 | 0 | 0 | 110.3 | I35 G43 C295 M299 | I35-I39 HydrophobicContact CG2-CD1 3.5Å; I35-I39 VanDerWaalsContact CG2-CD1 3.5Å; I35-I39 HydrophobicContact CG2-CG1 4.15Å; I35-I39 WeakPolarHBondContact O-CG1 3.13Å; I35-I39 PolarHBondContact O-N 3.06Å; I39-G43 WeakPolarHBondContact O-CA 2.92Å; I39-G43 PolarHBondContact O-N 2.91Å; I39-C295 HydrophobicContact CB-CB 4.25Å; I39-C295 HydrophobicContact CG2-CB 3.77Å; I39-M299 HydrophobicContact CG2-CE 3.82Å |
| 40 | G | 92.9 | Very high | 92.4 | Very high | 0 Ų | 0 | 41.6 Ų | 41.6 | 0% | 0 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -66.2 | -50.1 | -176.7 | 0 | 0 | 0 | 0 | 0 | 112.8 | T36 F37 F38 N44 C295 | T36-G40 VanDerWaalsContact O-CA 3.29Å; T36-G40 WeakPolarHBondContact O-CA 3.25Å; T36-G40 PolarHBondContact O-N 3.47Å; F37-G40 PolarHBondContact O-N 2.7Å; F38-G40 VanDerWaalsContact C-N 3.32Å; F38-G40 PolarHBondContact O-N 3.34Å; G40-N44 WeakPolarHBondContact O-CB 3.37Å; G40-N44 PolarHBondContact O-N 3.43Å; G40-N44 PolarHBondContact O-ND2 2.95Å; G40-C295 WeakPolarHBondContact CA-SG 3.5Å; G40-C295 PolarHBondContact N-SG 3.45Å |
| 41 | V | 93.8 | Very high | 91.8 | Very high | 39 Ų | 39 | 40.8 Ų | 40.8 | 24% | 0.236 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -64.2 | -47.2 | 179.2 | 171.7 | 0 | 0 | 0 | 0 | 110.8 | F37 G45 F72 | F37-V41 HydrophobicContact CD2-CG2 3.84Å; F37-V41 HydrophobicContact CE2-CG2 3.66Å; F37-V41 HydrophobicContact CZ-CG2 4.39Å; F37-V41 WeakPolarHBondContact O-CB 3.49Å; F37-V41 WeakPolarHBondContact O-CG2 3.37Å; F37-V41 PolarHBondContact O-N 3.29Å; V41-G45 WeakPolarHBondContact O-CA 3.29Å; V41-G45 PolarHBondContact O-N 3.07Å; V41-F72 HydrophobicContact CG1-CE2 3.84Å |
| 42 | L | 92.1 | Very high | 91.2 | Very high | 124 Ų | 124 | 38 Ų | 38 | 65% | 0.649 | 21% | 0.205 | S | C | * | . | H | α-helix | trans | -66.7 | -48 | -180 | -67.2 | 173.9 | 0 | 0 | 0 | 111.7 | F38 L46 | F38-L42 WeakPolarHBondContact O-CB 3.35Å; F38-L42 WeakPolarHBondContact O-CD1 3.34Å; F38-L42 VanDerWaalsContact O-CG 3.24Å; F38-L42 WeakPolarHBondContact O-CG 3.46Å; F38-L42 PolarHBondContact O-N 3.34Å; L42-L46 VanDerWaalsContact O-CB 3.25Å; L42-L46 WeakPolarHBondContact O-CB 3.45Å; L42-L46 PolarHBondContact O-N 3.41Å |
| 43 | G | 90.4 | Very high | 90.5 | Very high | 18 Ų | 18 | 43.9 Ų | 43.9 | 19% | 0.186 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -66.9 | -51.3 | -177.1 | 0 | 0 | 0 | 0 | 0 | 112.6 | I39 L46 V47 | I39-G43 WeakPolarHBondContact O-CA 2.92Å; I39-G43 PolarHBondContact O-N 2.91Å; G43-L46 PolarHBondContact O-N 2.9Å; G43-V47 WeakPolarHBondContact O-CG2 3.47Å; G43-V47 PolarHBondContact O-N 3.36Å |
| 44 | N | 92.3 | Very high | 89.7 | Confident | 0 Ų | 0 | 48.9 Ų | 48.9 | 0% | 0 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -70 | -36 | 179.4 | -66.5 | -62.5 | 0 | 0 | 0 | 111.6 | G40 L46 V47 I48 A68 F72 S294 P298 | G40-N44 WeakPolarHBondContact O-CB 3.37Å; G40-N44 PolarHBondContact O-N 3.43Å; G40-N44 PolarHBondContact O-ND2 2.95Å; N44-L46 VanDerWaalsContact C-N 3.34Å; N44-L46 PolarHBondContact O-N 2.82Å; N44-V47 PolarHBondContact O-N 3.06Å; N44-I48 VanDerWaalsContact O-CG1 3.29Å; N44-I48 WeakPolarHBondContact O-CG1 3.24Å; N44-I48 PolarHBondContact O-N 3.4Å; N44-A68 HydrophobicContact CB-CB 4.48Å; N44-F72 HydrophobicContact CB-CB 3.91Å; N44-F72 HydrophobicContact CB-CD2 4.46Å; N44-S294 PolarHBondContact ND2-O 2.88Å; N44-P298 WeakPolarHBondContact OD1-CD 3.42Å; N44-P298 WeakPolarHBondContact OD1-CG 3.46Å |
| 45 | G | 92.1 | Very high | 88.9 | Confident | 23 Ų | 23 | 48 Ų | 48 | 24% | 0.237 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -60 | -42.7 | 172.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | V41 I48 W49 | V41-G45 WeakPolarHBondContact O-CA 3.29Å; V41-G45 PolarHBondContact O-N 3.07Å; G45-I48 PolarHBondContact O-N 3.35Å; G45-W49 PolarHBondContact O-N 2.87Å |
| 46 | L | 88.7 | Confident | 88.2 | Confident | 56 Ų | 56 | 48.8 Ų | 48.8 | 29% | 0.293 | 25% | 0.248 | S | C | . | . | H | α-helix | trans | -63.2 | -41.5 | 174.8 | -175.1 | 66 | 0 | 0 | 0 | 112.1 | L42 G43 N44 W49 V50 L312 | L42-L46 VanDerWaalsContact O-CB 3.25Å; L42-L46 WeakPolarHBondContact O-CB 3.45Å; L42-L46 PolarHBondContact O-N 3.41Å; G43-L46 PolarHBondContact O-N 2.9Å; N44-L46 VanDerWaalsContact C-N 3.34Å; N44-L46 PolarHBondContact O-N 2.82Å; L46-W49 HydrophobicContact CD1-CE3 3.92Å; L46-W49 HydrophobicContact CD1-CZ3 4.18Å; L46-W49 PolarHBondContact O-N 3.49Å; L46-V50 HydrophobicContact CD1-CG2 4.38Å; L46-V50 WeakPolarHBondContact O-CG2 3.29Å; L46-V50 PolarHBondContact O-N 2.86Å; L46-L312 HydrophobicContact CD1-CD1 3.9Å; L46-L312 HydrophobicContact CD2-CD1 3.66Å; L46-L312 HydrophobicContact CG-CD1 3.83Å |
| 47 | V | 87.8 | Confident | 87.6 | Confident | 3 Ų | 3 | 54 Ų | 54 | 2% | 0.018 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -63.6 | -44.3 | 175.3 | 175 | 0 | 0 | 0 | 0 | 111 | G43 N44 W49 V50 A51 A68 P298 Y301 F308 | G43-V47 WeakPolarHBondContact O-CG2 3.47Å; G43-V47 PolarHBondContact O-N 3.36Å; N44-V47 PolarHBondContact O-N 3.06Å; V47-W49 VanDerWaalsContact C-N 3.29Å; V47-W49 PolarHBondContact O-N 3.44Å; V47-V50 PolarHBondContact O-N 3.47Å; V47-A51 HydrophobicContact CG1-CB 4.46Å; V47-A51 WeakPolarHBondContact O-CB 3.31Å; V47-A51 PolarHBondContact O-N 3.16Å; V47-A68 HydrophobicContact CB-CB 3.93Å; V47-A68 HydrophobicContact CG1-CB 3.61Å; V47-P298 HydrophobicContact CG2-CB 3.83Å; V47-P298 HydrophobicContact CG2-CG 4.21Å; V47-Y301 HydrophobicContact CG1-CD2 4.45Å; V47-Y301 HydrophobicContact CG2-CD2 4.44Å; V47-F308 HydrophobicContact CG2-CZ 4.04Å |
| 48 | I | 90.8 | Very high | 87.2 | Confident | 32 Ų | 32 | 53.9 Ų | 53.9 | 16% | 0.164 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -57.6 | -45.7 | 175.6 | -69.9 | 162.9 | 0 | 0 | 0 | 110.2 | N44 G45 G52 L65 A68 L69 F72 | N44-I48 VanDerWaalsContact O-CG1 3.29Å; N44-I48 WeakPolarHBondContact O-CG1 3.24Å; N44-I48 PolarHBondContact O-N 3.4Å; G45-I48 PolarHBondContact O-N 3.35Å; I48-G52 WeakPolarHBondContact O-CA 3.27Å; I48-G52 PolarHBondContact O-N 2.98Å; I48-L65 HydrophobicContact CB-CD1 4.27Å; I48-L65 HydrophobicContact CG1-CD1 4.26Å; I48-L65 HydrophobicContact CG2-CD1 4.14Å; I48-A68 HydrophobicContact CD1-CB 4.5Å; I48-A68 HydrophobicContact CG1-CB 3.8Å; I48-L69 HydrophobicContact CD1-CD2 3.92Å; I48-L69 HydrophobicContact CD1-CG 4.34Å; I48-L69 HydrophobicContact CG1-CD2 4.31Å; I48-L69 HydrophobicContact CG1-CG 4.37Å; I48-F72 HydrophobicContact CD1-CB 3.74Å; I48-F72 HydrophobicContact CD1-CD1 4.46Å; I48-F72 HydrophobicContact CD1-CD2 4.32Å; I48-F72 HydrophobicContact CD1-CG 3.93Å |
| 49 | W | 87.3 | Confident | 86.7 | Confident | 79 Ų | 79 | 48.2 Ų | 48.2 | 30% | 0.299 | 25% | 0.252 | S | S | . | . | H | α-helix | trans | -64.8 | -50.3 | -179.9 | 178.4 | 63.7 | 0 | 0 | 0 | 112.6 | G45 L46 V47 F53 S319 | G45-W49 PolarHBondContact O-N 2.87Å; L46-W49 HydrophobicContact CD1-CE3 3.92Å; L46-W49 HydrophobicContact CD1-CZ3 4.18Å; L46-W49 PolarHBondContact O-N 3.49Å; V47-W49 VanDerWaalsContact C-N 3.29Å; V47-W49 PolarHBondContact O-N 3.44Å; W49-F53 WeakPolarHBondContact O-CB 3.45Å; W49-F53 PolarHBondContact O-N 3Å; W49-S319 VanDerWaalsContact CH2-OG 3.22Å; W49-S319 WeakPolarHBondContact CH2-OG 3.4Å; W49-S319 WeakPolarHBondContact CZ2-OG 3.33Å |
| 50 | V | 82.4 | Confident | 86.1 | Confident | 0 Ų | 0 | 46.6 Ų | 46.6 | 0% | 0 | 24% | 0.244 | C | C | . | . | I | π-helix | trans | -68.8 | -49.8 | -177.9 | 174.6 | 0 | 0 | 0 | 0 | 111.4 | L46 V47 R54 M55 F308 L312 | L46-V50 HydrophobicContact CD1-CG2 4.38Å; L46-V50 WeakPolarHBondContact O-CG2 3.29Å; L46-V50 PolarHBondContact O-N 2.86Å; V47-V50 PolarHBondContact O-N 3.47Å; V50-R54 CarbonylContact O-C 3.57Å; V50-R54 WeakPolarHBondContact O-CA 3.33Å; V50-R54 WeakPolarHBondContact O-CB 3.47Å; V50-R54 PolarHBondContact O-N 3.21Å; V50-M55 HydrophobicContact CG1-CE 4.36Å; V50-M55 HydrophobicContact CG1-CG 4.25Å; V50-M55 HydrophobicContact CG1-SD 4.36Å; V50-M55 PolarHBondContact O-N 3.37Å; V50-F308 HydrophobicContact CB-CE2 4.16Å; V50-F308 HydrophobicContact CB-CZ 4.14Å; V50-F308 HydrophobicContact CG1-CD2 4.32Å; V50-F308 HydrophobicContact CG1-CE2 3.76Å; V50-F308 HydrophobicContact CG1-CZ 4.05Å; V50-L312 HydrophobicContact CG2-CD1 4.06Å |
| 51 | A | 80.4 | Confident | 85.6 | Confident | 3 Ų | 3 | 47.4 Ų | 47.4 | 3% | 0.025 | 25% | 0.249 | C | C | . | . | I | π-helix | trans | -73 | -32.8 | -176.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | V47 | V47-A51 HydrophobicContact CG1-CB 4.46Å; V47-A51 WeakPolarHBondContact O-CB 3.31Å; V47-A51 PolarHBondContact O-N 3.16Å |
| 52 | G | 83.6 | Confident | 85.4 | Confident | 14 Ų | 14 | 46.4 Ų | 46.4 | 14% | 0.144 | 24% | 0.242 | C | C | . | . | I | π-helix | trans | -79.1 | -43.6 | -179.3 | 0 | 0 | 0 | 0 | 0 | 113.7 | I48 H57 | I48-G52 WeakPolarHBondContact O-CA 3.27Å; I48-G52 PolarHBondContact O-N 2.98Å; G52-H57 PolarHBondContact O-NE2 3Å |
| 53 | F | 81.4 | Confident | 85.1 | Confident | 162 Ų | 162 | 40.8 Ų | 40.8 | 71% | 0.711 | 21% | 0.213 | S | C | * | . | I | π-helix | trans | -115 | -23.6 | -169.2 | -57.1 | -82.6 | 0 | 0 | 0 | 114.7 | W49 | W49-F53 WeakPolarHBondContact O-CB 3.45Å; W49-F53 PolarHBondContact O-N 3Å |
| 54 | R | 78.6 | Confident | 84.9 | Confident | 104 Ų | 104 | 41.6 Ų | 41.6 | 39% | 0.392 | 21% | 0.211 | S | C | . | . | I | π-helix | trans | -108.1 | -9.2 | -174.5 | -57 | -62.2 | -161.9 | 171.9 | 5.6 | 114.1 | V50 R311 S319 | V50-R54 CarbonylContact O-C 3.57Å; V50-R54 WeakPolarHBondContact O-CA 3.33Å; V50-R54 WeakPolarHBondContact O-CB 3.47Å; V50-R54 PolarHBondContact O-N 3.21Å; R54-R311 PolarHBondContact O-NH1 3.23Å; R54-S319 PolarHBondContact NH2-OG 3.21Å |
| 55 | M | 77.7 | Confident | 84.8 | Confident | 27 Ų | 27 | 43 Ų | 43 | 13% | 0.133 | 22% | 0.219 | C | C | . | . | S | Bend | trans | -114.1 | 148.8 | 178.9 | -74.6 | -169.9 | 156.7 | 0 | 0 | 111.8 | V50 T61 F308 R311 | V50-M55 HydrophobicContact CG1-CE 4.36Å; V50-M55 HydrophobicContact CG1-CG 4.25Å; V50-M55 HydrophobicContact CG1-SD 4.36Å; V50-M55 PolarHBondContact O-N 3.37Å; M55-T61 HydrophobicContact CB-CG2 4.34Å; M55-T61 HydrophobicContact SD-CG2 4.08Å; M55-F308 HydrophobicContact CE-CB 4Å; M55-F308 HydrophobicContact CE-CD2 3.57Å; M55-F308 HydrophobicContact CE-CE2 4.42Å; M55-F308 HydrophobicContact CE-CG 4.12Å; M55-F308 HydrophobicContact SD-CD2 3.93Å; M55-F308 HydrophobicContact SD-CE2 4.39Å; M55-R311 HydrophobicContact CE-CB 4.21Å; M55-R311 HydrophobicContact CE-CG 4.34Å |
| 56 | T | 81.5 | Confident | 84.8 | Confident | 99 Ų | 99 | 43.2 Ų | 43.2 | 61% | 0.607 | 21% | 0.214 | S | C | * | . | trans | -65 | 136.2 | 169.4 | 48.8 | 0 | 0 | 0 | 0 | 109.9 | T58 T61 | T56-T58 PolarHBondContact O-N 3.27Å; T56-T58 VanDerWaalsContact O-N 3.07Å; T56-T61 PolarHBondContact O-OG1 3.2Å | ||
| 57 | H | 82.8 | Confident | 84.9 | Confident | 109 Ų | 109 | 40.6 Ų | 40.6 | 51% | 0.505 | 20% | 0.2 | S | C | . | . | trans | -72.2 | 104.6 | -178.5 | -74.6 | -128.6 | 0 | 0 | 0 | 110.3 | G52 V139 | G52-H57 PolarHBondContact O-NE2 3Å; H57-V139 WeakPolarHBondContact O-CG2 3.46Å | ||
| 58 | T | 85.8 | Confident | 85.1 | Confident | 54 Ų | 54 | 40.4 Ų | 40.4 | 33% | 0.331 | 20% | 0.199 | S | C | . | . | trans | -113.1 | 166.8 | 173 | 66.5 | 0 | 0 | 0 | 0 | 110 | T56 T60 T61 I62 | T56-T58 PolarHBondContact O-N 3.27Å; T56-T58 VanDerWaalsContact O-N 3.07Å; T58-T60 PolarHBondContact O-N 3.25Å; T58-T61 PolarHBondContact N-OG1 2.98Å; T58-T61 PolarHBondContact O-N 2.97Å; T58-T61 PolarHBondContact O-OG1 3.08Å; T58-T61 WeakPolarHBondContact OG1-CG2 3.47Å; T58-T61 PolarHBondContact OG1-N 3.31Å; T58-T61 PolarHBondContact OG1-OG1 3.37Å; T58-I62 WeakPolarHBondContact O-CG1 3.36Å; T58-I62 PolarHBondContact O-N 3.42Å | ||
| 59 | V | 84.8 | Confident | 85.2 | Confident | 12 Ų | 12 | 42.1 Ų | 42.1 | 7% | 0.073 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -52.5 | -44.9 | 174.8 | 174.5 | 0 | 0 | 0 | 0 | 111.6 | I62 C63 R137 A142 | V59-I62 PolarHBondContact O-N 3.48Å; V59-C63 PolarHBondContact O-N 2.83Å; V59-C63 PolarHBondContact O-SG 3.27Å; V59-C63 VanDerWaalsContact O-SG 3.37Å; V59-R137 HydrophobicContact CB-CG 4.48Å; V59-R137 HydrophobicContact CG1-CG 4.46Å; V59-R137 HydrophobicContact CG2-CG 3.95Å; V59-A142 HydrophobicContact CB-CB 4Å; V59-A142 HydrophobicContact CG1-CB 3.71Å; V59-A142 HydrophobicContact CG2-CB 3.72Å |
| 60 | T | 80.2 | Confident | 85.5 | Confident | 20 Ų | 20 | 38.5 Ų | 38.5 | 12% | 0.123 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -67.9 | -44 | -179.6 | -55.8 | 0 | 0 | 0 | 0 | 112.5 | T58 I62 C63 Y64 R137 | T58-T60 PolarHBondContact O-N 3.25Å; T60-I62 VanDerWaalsContact C-N 3.3Å; T60-I62 PolarHBondContact O-N 2.8Å; T60-C63 PolarHBondContact O-N 3.4Å; T60-Y64 HydrophobicContact CG2-CD2 3.94Å; T60-Y64 HydrophobicContact CG2-CE1 4.11Å; T60-Y64 HydrophobicContact CG2-CE2 3.37Å; T60-Y64 VanDerWaalsContact CG2-CZ 3.46Å; T60-Y64 PolarHBondContact O-N 3.02Å; T60-R137 PolarHBondContact OG1-NH2 3.39Å |
| 61 | T | 83.6 | Confident | 86.1 | Confident | 17 Ų | 17 | 38.5 Ų | 38.5 | 10% | 0.104 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -67.5 | -32.5 | -179.8 | 57.8 | 0 | 0 | 0 | 0 | 111.6 | M55 T56 T58 Y64 L65 | M55-T61 HydrophobicContact CB-CG2 4.34Å; M55-T61 HydrophobicContact SD-CG2 4.08Å; T56-T61 PolarHBondContact O-OG1 3.2Å; T58-T61 PolarHBondContact N-OG1 2.98Å; T58-T61 PolarHBondContact O-N 2.97Å; T58-T61 PolarHBondContact O-OG1 3.08Å; T58-T61 WeakPolarHBondContact OG1-CG2 3.47Å; T58-T61 PolarHBondContact OG1-N 3.31Å; T58-T61 PolarHBondContact OG1-OG1 3.37Å; T61-Y64 PolarHBondContact O-N 2.9Å; T61-L65 VanDerWaalsContact O-CB 3.25Å; T61-L65 WeakPolarHBondContact O-CB 3.33Å; T61-L65 PolarHBondContact O-N 3.34Å |
| 62 | I | 88.7 | Confident | 86.7 | Confident | 18 Ų | 18 | 41.9 Ų | 41.9 | 9% | 0.092 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -65.1 | -44.1 | 174.1 | -71 | 163 | 0 | 0 | 0 | 111.3 | T58 V59 T60 L65 N66 V139 | T58-I62 WeakPolarHBondContact O-CG1 3.36Å; T58-I62 PolarHBondContact O-N 3.42Å; V59-I62 PolarHBondContact O-N 3.48Å; T60-I62 VanDerWaalsContact C-N 3.3Å; T60-I62 PolarHBondContact O-N 2.8Å; I62-L65 PolarHBondContact O-N 3.39Å; I62-N66 PolarHBondContact O-N 2.92Å; I62-N66 PolarHBondContact O-ND2 3.38Å; I62-V139 HydrophobicContact CD1-CG1 3.63Å |
| 63 | C | 86.1 | Confident | 87.3 | Confident | 6 Ų | 6 | 43.8 Ų | 43.8 | 4% | 0.041 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -64.1 | -42.4 | 176.5 | -65.6 | 0 | 0 | 0 | 0 | 111.8 | V59 T60 L65 N66 L67 I119 | V59-C63 PolarHBondContact O-N 2.83Å; V59-C63 PolarHBondContact O-SG 3.27Å; V59-C63 VanDerWaalsContact O-SG 3.37Å; T60-C63 PolarHBondContact O-N 3.4Å; C63-L65 VanDerWaalsContact C-N 3.35Å; C63-N66 PolarHBondContact O-N 3.23Å; C63-L67 PolarHBondContact O-N 3.46Å; C63-I119 HydrophobicContact CB-CD1 4.06Å; C63-I119 HydrophobicContact CB-CG1 3.62Å |
| 64 | Y | 86.3 | Confident | 87.9 | Confident | 36 Ų | 36 | 36.2 Ų | 36.2 | 14% | 0.141 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -65.6 | -37.4 | 175.9 | -64.7 | -16.5 | 0 | 0 | 0 | 112.5 | T60 T61 L67 A68 I119 Y301 | T60-Y64 HydrophobicContact CG2-CD2 3.94Å; T60-Y64 HydrophobicContact CG2-CE1 4.11Å; T60-Y64 HydrophobicContact CG2-CE2 3.37Å; T60-Y64 VanDerWaalsContact CG2-CZ 3.46Å; T60-Y64 PolarHBondContact O-N 3.02Å; T61-Y64 PolarHBondContact O-N 2.9Å; Y64-L67 PolarHBondContact O-N 3.37Å; Y64-A68 VanDerWaalsContact O-CB 3.31Å; Y64-A68 WeakPolarHBondContact O-CB 3.46Å; Y64-A68 PolarHBondContact O-N 3.4Å; Y64-I119 HydrophobicContact CD1-CD1 3.82Å; Y64-I119 HydrophobicContact CE1-CD1 3.89Å; Y64-I119 HydrophobicContact CE1-CG1 4.35Å; Y64-I119 HydrophobicContact CE1-CG2 4.1Å; Y64-Y301 AromaticContact CD1-CD1 3.94Å; Y64-Y301 HydrophobicContact CD1-CD1 3.94Å; Y64-Y301 AromaticContact CD1-CE1 3.27Å; Y64-Y301 HydrophobicContact CD1-CE1 3.27Å; Y64-Y301 HydrophobicContact CD1-CE2 4.33Å; Y64-Y301 AromaticContact CD1-CZ 3.45Å; Y64-Y301 VanDerWaalsContact CD1-CZ 3.45Å; Y64-Y301 WeakPolarHBondContact CD1-OH 3.12Å; Y64-Y301 HydrophobicContact CD2-CD1 4.16Å; Y64-Y301 HydrophobicContact CD2-CE1 4.31Å; Y64-Y301 AromaticContact CE1-CD1 3.74Å; Y64-Y301 HydrophobicContact CE1-CD1 3.74Å; Y64-Y301 AromaticContact CE1-CE1 3.19Å; Y64-Y301 HydrophobicContact CE1-CE1 3.19Å; Y64-Y301 AromaticContact CE1-CZ 3.88Å; Y64-Y301 AromaticContact CE2-CD1 3.96Å; Y64-Y301 HydrophobicContact CE2-CD1 3.96Å; Y64-Y301 HydrophobicContact CE2-CE1 4.24Å; Y64-Y301 HydrophobicContact CG-CD1 4.15Å; Y64-Y301 AromaticContact CG-CE1 3.86Å; Y64-Y301 HydrophobicContact CG-CE1 3.86Å; Y64-Y301 HydrophobicContact CG-CE2 4.38Å; Y64-Y301 AromaticContact CG-CZ 3.92Å; Y64-Y301 AromaticContact CZ-CD1 3.75Å; Y64-Y301 AromaticContact CZ-CE1 3.71Å |
| 65 | L | 90.3 | Very high | 88.7 | Confident | 30 Ų | 30 | 31.3 Ų | 31.3 | 16% | 0.157 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -63.7 | -43.7 | 174.8 | -178.3 | 63.6 | 0 | 0 | 0 | 111.4 | I48 T61 I62 C63 A68 L69 | I48-L65 HydrophobicContact CB-CD1 4.27Å; I48-L65 HydrophobicContact CG1-CD1 4.26Å; I48-L65 HydrophobicContact CG2-CD1 4.14Å; T61-L65 VanDerWaalsContact O-CB 3.25Å; T61-L65 WeakPolarHBondContact O-CB 3.33Å; T61-L65 PolarHBondContact O-N 3.34Å; I62-L65 PolarHBondContact O-N 3.39Å; C63-L65 VanDerWaalsContact C-N 3.35Å; L65-A68 PolarHBondContact O-N 3.31Å; L65-L69 HydrophobicContact CG-CD1 4.29Å; L65-L69 WeakPolarHBondContact O-CB 3.48Å; L65-L69 VanDerWaalsContact O-CG 3.29Å; L65-L69 WeakPolarHBondContact O-CG 3.24Å; L65-L69 PolarHBondContact O-N 3.32Å |
| 66 | N | 92.6 | Very high | 89.5 | Confident | 26 Ų | 26 | 32 Ų | 32 | 14% | 0.139 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -65.7 | -39.1 | 176.1 | -82 | -95.5 | 0 | 0 | 0 | 112 | I62 C63 L69 A70 L115 V146 W150 | I62-N66 PolarHBondContact O-N 2.92Å; I62-N66 PolarHBondContact O-ND2 3.38Å; C63-N66 PolarHBondContact O-N 3.23Å; N66-L69 PolarHBondContact O-N 2.95Å; N66-A70 PolarHBondContact O-N 2.99Å; N66-L115 HydrophobicContact CB-CD1 3.93Å; N66-L115 HydrophobicContact CB-CD2 4.06Å; N66-V146 HydrophobicContact CB-CG2 3.85Å; N66-W150 PolarHBondContact OD1-NE1 3.48Å |
| 67 | L | 90.7 | Very high | 90.2 | Very high | 1 Ų | 1 | 27.9 Ų | 27.9 | 1% | 0.005 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -64.9 | -45.9 | 176.1 | -170.2 | 67.1 | 0 | 0 | 0 | 110.8 | C63 Y64 L69 A70 D71 S112 L115 I116 N297 Y301 | C63-L67 PolarHBondContact O-N 3.46Å; Y64-L67 PolarHBondContact O-N 3.37Å; L67-L69 VanDerWaalsContact C-N 3.29Å; L67-L69 PolarHBondContact O-N 2.88Å; L67-A70 PolarHBondContact O-N 3.23Å; L67-D71 PolarHBondContact O-N 3.44Å; L67-S112 VanDerWaalsContact CD1-CB 3.46Å; L67-S112 WeakPolarHBondContact CD1-O 3.38Å; L67-S112 WeakPolarHBondContact CD1-OG 3.48Å; L67-L115 HydrophobicContact CB-CD1 4.39Å; L67-L115 HydrophobicContact CD1-CB 3.96Å; L67-L115 HydrophobicContact CD1-CD1 4.23Å; L67-I116 HydrophobicContact CD1-CG1 4.31Å; L67-I116 HydrophobicContact CD2-CD1 4.38Å; L67-I116 HydrophobicContact CD2-CG1 3.92Å; L67-N297 HydrophobicContact CD2-CB 4.08Å; L67-Y301 HydrophobicContact CD2-CE2 4.42Å; L67-Y301 WeakPolarHBondContact CD2-OH 3.3Å |
| 68 | A | 91.8 | Very high | 90.8 | Very high | 0 Ų | 0 | 22.7 Ų | 22.7 | 0% | 0 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -62.8 | -35.4 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | N44 V47 I48 Y64 L65 F72 | N44-A68 HydrophobicContact CB-CB 4.48Å; V47-A68 HydrophobicContact CB-CB 3.93Å; V47-A68 HydrophobicContact CG1-CB 3.61Å; I48-A68 HydrophobicContact CD1-CB 4.5Å; I48-A68 HydrophobicContact CG1-CB 3.8Å; Y64-A68 VanDerWaalsContact O-CB 3.31Å; Y64-A68 WeakPolarHBondContact O-CB 3.46Å; Y64-A68 PolarHBondContact O-N 3.4Å; L65-A68 PolarHBondContact O-N 3.31Å; A68-F72 WeakPolarHBondContact O-CB 3.35Å; A68-F72 PolarHBondContact O-N 3.37Å |
| 69 | L | 93.6 | Very high | 91.3 | Very high | 68 Ų | 68 | 22.4 Ų | 22.4 | 36% | 0.356 | 13% | 0.129 | S | C | . | . | H | α-helix | trans | -64.9 | -42.6 | 173.3 | -77.9 | 167.6 | 0 | 0 | 0 | 112.4 | I48 L65 N66 L67 S73 | I48-L69 HydrophobicContact CD1-CD2 3.92Å; I48-L69 HydrophobicContact CD1-CG 4.34Å; I48-L69 HydrophobicContact CG1-CD2 4.31Å; I48-L69 HydrophobicContact CG1-CG 4.37Å; L65-L69 HydrophobicContact CG-CD1 4.29Å; L65-L69 WeakPolarHBondContact O-CB 3.48Å; L65-L69 VanDerWaalsContact O-CG 3.29Å; L65-L69 WeakPolarHBondContact O-CG 3.24Å; L65-L69 PolarHBondContact O-N 3.32Å; N66-L69 PolarHBondContact O-N 2.95Å; L67-L69 VanDerWaalsContact C-N 3.29Å; L67-L69 PolarHBondContact O-N 2.88Å; L69-S73 WeakPolarHBondContact O-CB 3.38Å; L69-S73 PolarHBondContact O-N 3.27Å; L69-S73 PolarHBondContact O-OG 2.95Å |
| 70 | A | 93.5 | Very high | 91.9 | Very high | 3 Ų | 3 | 24.8 Ų | 24.8 | 3% | 0.025 | 14% | 0.138 | C | C | . | . | H | α-helix | trans | -63.6 | -51.8 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.1 | N66 L67 F72 S73 F74 N108 S112 W150 | N66-A70 PolarHBondContact O-N 2.99Å; L67-A70 PolarHBondContact O-N 3.23Å; A70-F72 PolarHBondContact O-N 2.91Å; A70-S73 PolarHBondContact O-N 3.38Å; A70-F74 PolarHBondContact O-N 3.04Å; A70-N108 WeakPolarHBondContact CB-OD1 3.25Å; A70-N108 PolarHBondContact O-OD1 3.06Å; A70-S112 WeakPolarHBondContact CB-OG 3.34Å; A70-W150 HydrophobicContact CB-CH2 3.91Å; A70-W150 HydrophobicContact CB-CZ2 4.29Å |
| 71 | D | 93.6 | Very high | 92.5 | Very high | 0 Ų | 0 | 25 Ų | 25 | 0% | 0 | 14% | 0.138 | C | C | . | . | H | α-helix | trans | -65.7 | -36.5 | -179.5 | -74.3 | -32.9 | 0 | 0 | 0 | 112.4 | L67 T75 N108 S112 S294 N297 | L67-D71 PolarHBondContact O-N 3.44Å; D71-T75 WeakPolarHBondContact O-CB 3.39Å; D71-T75 WeakPolarHBondContact O-CG2 3.03Å; D71-T75 PolarHBondContact O-N 3.02Å; D71-T75 PolarHBondContact O-OG1 3.43Å; D71-N108 PolarHBondContact N-OD1 3.02Å; D71-N108 PolarHBondContact OD1-OD1 3.44Å; D71-S112 PolarHBondContact OD1-OG 3.49Å; D71-S294 VanDerWaalsContact OD1-CB 3.22Å; D71-S294 WeakPolarHBondContact OD1-CB 3.41Å; D71-S294 PolarHBondContact OD1-OG 3.2Å; D71-N297 PolarHBondContact OD2-ND2 3.37Å |
| 72 | F | 94.6 | Very high | 93.1 | Very high | 73 Ų | 73 | 25.2 Ų | 25.2 | 32% | 0.32 | 14% | 0.14 | S | C | . | . | H | α-helix | trans | -64.4 | -47.8 | 173.8 | -179.1 | -92.3 | 0 | 0 | 0 | 111.4 | V41 N44 I48 A68 A70 F74 T75 A76 | V41-F72 HydrophobicContact CG1-CE2 3.84Å; N44-F72 HydrophobicContact CB-CB 3.91Å; N44-F72 HydrophobicContact CB-CD2 4.46Å; I48-F72 HydrophobicContact CD1-CB 3.74Å; I48-F72 HydrophobicContact CD1-CD1 4.46Å; I48-F72 HydrophobicContact CD1-CD2 4.32Å; I48-F72 HydrophobicContact CD1-CG 3.93Å; A68-F72 WeakPolarHBondContact O-CB 3.35Å; A68-F72 PolarHBondContact O-N 3.37Å; A70-F72 PolarHBondContact O-N 2.91Å; F72-F74 VanDerWaalsContact C-N 3.26Å; F72-F74 PolarHBondContact O-N 3.35Å; F72-T75 WeakPolarHBondContact CA-OG1 3.49Å; F72-T75 PolarHBondContact O-N 3.18Å; F72-T75 PolarHBondContact O-OG1 2.89Å; F72-T75 VanDerWaalsContact O-OG1 3.1Å; F72-A76 WeakPolarHBondContact O-CB 3.11Å; F72-A76 PolarHBondContact O-N 3.02Å |
| 73 | S | 94.8 | Very high | 93.4 | Very high | 54 Ų | 54 | 27.1 Ų | 27.1 | 38% | 0.378 | 15% | 0.152 | S | C | . | . | H | α-helix | trans | -60.3 | -40.1 | 179.7 | -57.8 | 0 | 0 | 0 | 0 | 111.2 | L69 A70 V104 | L69-S73 WeakPolarHBondContact O-CB 3.38Å; L69-S73 PolarHBondContact O-N 3.27Å; L69-S73 PolarHBondContact O-OG 2.95Å; A70-S73 PolarHBondContact O-N 3.38Å; S73-V104 WeakPolarHBondContact O-CG1 3.18Å |
| 74 | F | 94.9 | Very high | 93.7 | Very high | 4 Ų | 4 | 27.3 Ų | 27.3 | 2% | 0.018 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -70.3 | -47 | 175 | 162.6 | -108.1 | 0 | 0 | 0 | 113.8 | A70 F72 A76 T77 L78 V105 N108 F291 | A70-F74 PolarHBondContact O-N 3.04Å; F72-F74 VanDerWaalsContact C-N 3.26Å; F72-F74 PolarHBondContact O-N 3.35Å; F74-A76 PolarHBondContact O-N 3.31Å; F74-T77 PolarHBondContact O-N 2.93Å; F74-T77 PolarHBondContact O-OG1 3.22Å; F74-L78 HydrophobicContact CE1-CD2 4.16Å; F74-L78 HydrophobicContact CE2-CD2 3.86Å; F74-L78 HydrophobicContact CZ-CD2 3.57Å; F74-L78 HydrophobicContact CZ-CG 4.41Å; F74-L78 PolarHBondContact O-N 2.91Å; F74-V105 HydrophobicContact CD2-CB 4.41Å; F74-V105 HydrophobicContact CD2-CG1 4.5Å; F74-V105 HydrophobicContact CD2-CG2 3.98Å; F74-V105 HydrophobicContact CE2-CG1 4.22Å; F74-V105 HydrophobicContact CE2-CG2 4.06Å; F74-N108 HydrophobicContact CB-CB 3.47Å; F74-N108 VanDerWaalsContact CB-CB 3.47Å; F74-N108 WeakPolarHBondContact CB-ND2 3.38Å; F74-N108 WeakPolarHBondContact CD1-ND2 3.41Å; F74-N108 HydrophobicContact CD2-CB 4.39Å; F74-N108 HydrophobicContact CG-CB 4.06Å; F74-N108 WeakPolarHBondContact CG-ND2 3.37Å; F74-F291 HydrophobicContact CE1-CB 4.13Å; F74-F291 HydrophobicContact CE1-CD1 4.41Å; F74-F291 HydrophobicContact CE1-CG 4.4Å; F74-F291 HydrophobicContact CE2-CD1 4.05Å; F74-F291 HydrophobicContact CE2-CE1 4.19Å; F74-F291 HydrophobicContact CE2-CG 4.39Å; F74-F291 HydrophobicContact CZ-CB 3.74Å; F74-F291 AromaticContact CZ-CD1 3.43Å; F74-F291 HydrophobicContact CZ-CD1 3.43Å; F74-F291 VanDerWaalsContact CZ-CD1 3.43Å; F74-F291 HydrophobicContact CZ-CD2 4.2Å; F74-F291 HydrophobicContact CZ-CE1 4.03Å; F74-F291 AromaticContact CZ-CG 3.54Å; F74-F291 HydrophobicContact CZ-CG 3.54Å |
| 75 | T | 95.1 | Very high | 94 | Very high | 0 Ų | 0 | 26.2 Ų | 26.2 | 0% | 0 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -61.3 | -34.3 | -180 | 49.5 | 0 | 0 | 0 | 0 | 110.5 | F37 D71 F72 T77 L78 | F37-T75 WeakPolarHBondContact CD2-O 3.34Å; D71-T75 WeakPolarHBondContact O-CB 3.39Å; D71-T75 WeakPolarHBondContact O-CG2 3.03Å; D71-T75 PolarHBondContact O-N 3.02Å; D71-T75 PolarHBondContact O-OG1 3.43Å; F72-T75 WeakPolarHBondContact CA-OG1 3.49Å; F72-T75 PolarHBondContact O-N 3.18Å; F72-T75 PolarHBondContact O-OG1 2.89Å; F72-T75 VanDerWaalsContact O-OG1 3.1Å; T75-T77 PolarHBondContact O-N 3.23Å; T75-L78 HydrophobicContact CG2-CD1 4.23Å; T75-L78 WeakPolarHBondContact O-CB 3.46Å; T75-L78 WeakPolarHBondContact O-CG 3.33Å; T75-L78 PolarHBondContact O-N 3.44Å |
| 76 | A | 95.3 | Very high | 94.2 | Very high | 41 Ų | 41 | 27.4 Ų | 27.4 | 34% | 0.339 | 16% | 0.164 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -62.8 | -21.6 | 172.1 | 0 | 0 | 0 | 0 | 0 | 114.8 | F72 F74 P79 | F72-A76 WeakPolarHBondContact O-CB 3.11Å; F72-A76 PolarHBondContact O-N 3.02Å; F74-A76 PolarHBondContact O-N 3.31Å; A76-P79 WeakPolarHBondContact O-CD 3.12Å |
| 77 | T | 95.4 | Very high | 94.1 | Very high | 13 Ų | 13 | 30.3 Ų | 30.3 | 8% | 0.08 | 18% | 0.178 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -89.9 | -11.4 | 176.1 | 68.3 | 0 | 0 | 0 | 0 | 114.1 | F74 T75 P79 F80 L81 V101 V104 | F74-T77 PolarHBondContact O-N 2.93Å; F74-T77 PolarHBondContact O-OG1 3.22Å; T75-T77 PolarHBondContact O-N 3.23Å; T77-P79 VanDerWaalsContact C-CD 3.4Å; T77-F80 WeakPolarHBondContact O-CB 2.84Å; T77-F80 PolarHBondContact O-N 2.99Å; T77-F80 VanDerWaalsContact O-N 3.14Å; T77-L81 PolarHBondContact O-N 3.29Å; T77-V101 HydrophobicContact CG2-CG2 4.49Å; T77-V104 HydrophobicContact CG2-CB 4Å; T77-V104 HydrophobicContact CG2-CG1 3.69Å |
| 78 | L | 95.3 | Very high | 94.1 | Very high | 1 Ų | 1 | 37.9 Ų | 37.9 | 1% | 0.005 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -56.6 | -37.2 | -179.4 | -66.8 | -179.7 | 0 | 0 | 0 | 115 | I33 T36 F37 F74 T75 F80 L81 V82 F291 | I33-L78 HydrophobicContact CG2-CB 3.93Å; I33-L78 HydrophobicContact CG2-CD1 4.17Å; I33-L78 HydrophobicContact CG2-CD2 3.83Å; I33-L78 HydrophobicContact CG2-CG 4.18Å; T36-L78 HydrophobicContact CG2-CD1 3.56Å; F37-L78 HydrophobicContact CB-CB 4.2Å; F37-L78 HydrophobicContact CB-CD1 4.28Å; F74-L78 HydrophobicContact CE1-CD2 4.16Å; F74-L78 HydrophobicContact CE2-CD2 3.86Å; F74-L78 HydrophobicContact CZ-CD2 3.57Å; F74-L78 HydrophobicContact CZ-CG 4.41Å; F74-L78 PolarHBondContact O-N 2.91Å; T75-L78 HydrophobicContact CG2-CD1 4.23Å; T75-L78 WeakPolarHBondContact O-CB 3.46Å; T75-L78 WeakPolarHBondContact O-CG 3.33Å; T75-L78 PolarHBondContact O-N 3.44Å; L78-F80 PolarHBondContact O-N 3.12Å; L78-L81 HydrophobicContact CD2-CD1 4.11Å; L78-L81 PolarHBondContact O-N 2.88Å; L78-L81 VanDerWaalsContact O-N 3.1Å; L78-V82 WeakPolarHBondContact O-CG2 3.3Å; L78-V82 PolarHBondContact O-N 3.14Å; L78-F291 HydrophobicContact CD2-CD2 4.03Å; L78-F291 HydrophobicContact CD2-CG 4.46Å |
| 79 | P | 96.3 | Very high | 94 | Very high | 47 Ų | 47 | 41.7 Ų | 41.7 | 31% | 0.305 | 23% | 0.229 | S | C | . | . | H | α-helix | trans | -58.1 | -35.8 | 177 | -26.5 | 36.4 | 0 | 0 | 0 | 113.3 | F37 A76 T77 T83 | F37-P79 HydrophobicContact CD2-CG 3.57Å; F37-P79 HydrophobicContact CE1-CG 4.49Å; F37-P79 HydrophobicContact CE2-CG 3.49Å; F37-P79 VanDerWaalsContact CE2-CG 3.49Å; F37-P79 HydrophobicContact CG-CG 4.11Å; F37-P79 HydrophobicContact CZ-CG 3.98Å; A76-P79 WeakPolarHBondContact O-CD 3.12Å; T77-P79 VanDerWaalsContact C-CD 3.4Å; P79-T83 WeakPolarHBondContact O-CB 3.46Å; P79-T83 PolarHBondContact O-N 2.99Å; P79-T83 PolarHBondContact O-OG1 3.33Å |
| 80 | F | 96.4 | Very high | 94 | Very high | 63 Ų | 63 | 41.2 Ų | 41.2 | 28% | 0.276 | 22% | 0.224 | S | C | . | . | H | α-helix | trans | -68.1 | -41.6 | 176.7 | -58.9 | -84.4 | 0 | 0 | 0 | 111.2 | T77 L78 T83 S84 W91 F93 V101 | T77-F80 WeakPolarHBondContact O-CB 2.84Å; T77-F80 PolarHBondContact O-N 2.99Å; T77-F80 VanDerWaalsContact O-N 3.14Å; L78-F80 PolarHBondContact O-N 3.12Å; F80-T83 PolarHBondContact O-N 3.35Å; F80-S84 WeakPolarHBondContact O-CB 3.24Å; F80-S84 PolarHBondContact O-N 3.43Å; F80-W91 HydrophobicContact CB-CH2 4.05Å; F80-F93 HydrophobicContact CB-CD2 4.39Å; F80-F93 HydrophobicContact CB-CE2 4.09Å; F80-F93 HydrophobicContact CB-CZ 4.47Å; F80-F93 AromaticContact CD1-CD1 3.71Å; F80-F93 HydrophobicContact CD1-CD1 3.71Å; F80-F93 AromaticContact CD1-CD2 3.96Å; F80-F93 HydrophobicContact CD1-CD2 3.96Å; F80-F93 AromaticContact CD1-CE1 3.72Å; F80-F93 HydrophobicContact CD1-CE1 3.72Å; F80-F93 AromaticContact CD1-CE2 3.98Å; F80-F93 HydrophobicContact CD1-CE2 3.98Å; F80-F93 AromaticContact CD1-CG 3.82Å; F80-F93 HydrophobicContact CD1-CG 3.82Å; F80-F93 AromaticContact CD1-CZ 3.84Å; F80-F93 HydrophobicContact CD1-CZ 3.84Å; F80-F93 HydrophobicContact CE1-CD1 4.01Å; F80-F93 HydrophobicContact CE1-CE1 4.15Å; F80-F93 HydrophobicContact CE1-CG 4.42Å; F80-V101 HydrophobicContact CB-CG1 4.4Å; F80-V101 HydrophobicContact CB-CG2 3.99Å; F80-V101 HydrophobicContact CD2-CG2 4.06Å; F80-V101 HydrophobicContact CG-CG2 3.98Å |
| 81 | L | 94.2 | Very high | 94.1 | Very high | 23 Ų | 23 | 41.3 Ų | 41.3 | 12% | 0.12 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -66.9 | -43.8 | 177.5 | -62.3 | -179.9 | 0 | 0 | 0 | 112 | T77 L78 T83 S84 M85 V101 V105 F291 | T77-L81 PolarHBondContact O-N 3.29Å; L78-L81 HydrophobicContact CD2-CD1 4.11Å; L78-L81 PolarHBondContact O-N 2.88Å; L78-L81 VanDerWaalsContact O-N 3.1Å; L81-T83 VanDerWaalsContact C-N 3.33Å; L81-T83 PolarHBondContact O-N 3.41Å; L81-S84 PolarHBondContact O-N 3.43Å; L81-M85 VanDerWaalsContact O-CB 3.31Å; L81-M85 WeakPolarHBondContact O-CB 3.44Å; L81-M85 PolarHBondContact O-N 3.17Å; L81-V101 HydrophobicContact CD2-CG1 3.71Å; L81-V101 HydrophobicContact CG-CG1 4.09Å; L81-V105 HydrophobicContact CD1-CG2 3.88Å; L81-F291 HydrophobicContact CD1-CE2 4.18Å; L81-F291 HydrophobicContact CD1-CZ 4.4Å |
| 82 | V | 95.2 | Very high | 94.1 | Very high | 23 Ų | 23 | 44.6 Ų | 44.6 | 14% | 0.139 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -63.2 | -41.4 | 176.6 | 173 | 0 | 0 | 0 | 0 | 111 | M30 I33 L78 M85 A86 | M30-V82 HydrophobicContact SD-CG1 3.96Å; I33-V82 HydrophobicContact CB-CG2 3.59Å; I33-V82 HydrophobicContact CG2-CG2 3.18Å; L78-V82 WeakPolarHBondContact O-CG2 3.3Å; L78-V82 PolarHBondContact O-N 3.14Å; V82-M85 PolarHBondContact O-N 3.32Å; V82-A86 VanDerWaalsContact O-CB 3.26Å; V82-A86 WeakPolarHBondContact O-CB 3.31Å; V82-A86 PolarHBondContact O-N 2.86Å |
| 83 | T | 95.3 | Very high | 94.2 | Very high | 57 Ų | 57 | 44.4 Ų | 44.4 | 35% | 0.35 | 24% | 0.244 | S | C | . | . | H | α-helix | trans | -65.2 | -44.9 | 177.2 | -54.4 | 0 | 0 | 0 | 0 | 111.1 | P79 F80 L81 M85 A86 M87 F93 | P79-T83 WeakPolarHBondContact O-CB 3.46Å; P79-T83 PolarHBondContact O-N 2.99Å; P79-T83 PolarHBondContact O-OG1 3.33Å; F80-T83 PolarHBondContact O-N 3.35Å; L81-T83 VanDerWaalsContact C-N 3.33Å; L81-T83 PolarHBondContact O-N 3.41Å; T83-M85 VanDerWaalsContact C-N 3.33Å; T83-M85 PolarHBondContact O-N 3.42Å; T83-A86 PolarHBondContact O-N 3.06Å; T83-M87 HydrophobicContact CG2-SD 4.22Å; T83-M87 WeakPolarHBondContact O-CG 3.39Å; T83-M87 PolarHBondContact O-N 2.97Å; T83-F93 HydrophobicContact CG2-CE2 4.22Å; T83-F93 HydrophobicContact CG2-CZ 3.68Å |
| 84 | S | 93.8 | Very high | 94.2 | Very high | 10 Ų | 10 | 43.4 Ų | 43.4 | 7% | 0.07 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -57.4 | -48.4 | 175 | -177.6 | 0 | 0 | 0 | 0 | 111.1 | F80 L81 A86 M87 E89 K90 | F80-S84 WeakPolarHBondContact O-CB 3.24Å; F80-S84 PolarHBondContact O-N 3.43Å; L81-S84 PolarHBondContact O-N 3.43Å; S84-A86 PolarHBondContact O-N 2.89Å; S84-M87 PolarHBondContact O-N 3.2Å; S84-E89 VanDerWaalsContact O-CA 3.25Å; S84-E89 WeakPolarHBondContact O-CA 3.49Å; S84-E89 PolarHBondContact O-N 3.14Å; S84-K90 WeakPolarHBondContact CA-O 3.31Å; S84-K90 PolarHBondContact OG-O 3.34Å |
| 85 | M | 91.9 | Very high | 94.2 | Very high | 13 Ų | 13 | 49.6 Ų | 49.6 | 6% | 0.064 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -60.6 | -48.4 | 178.1 | -160.4 | -166.2 | -71 | 0 | 0 | 109.4 | W26 M30 I33 L81 V82 T83 M87 K88 E89 H284 | W26-M85 WeakPolarHBondContact CZ2-O 2.84Å; M30-M85 HydrophobicContact CE-CB 3.38Å; M30-M85 HydrophobicContact CE-CG 3.14Å; M30-M85 HydrophobicContact CE-SD 3.32Å; M30-M85 WeakPolarHBondContact CE-SD 3.48Å; M30-M85 HydrophobicContact CG-SD 4.4Å; M30-M85 HydrophobicContact SD-CB 3.69Å; M30-M85 HydrophobicContact SD-CG 3.84Å; M30-M85 HydrophobicContact SD-SD 3.5Å; I33-M85 HydrophobicContact CD1-CE 3.53Å; I33-M85 HydrophobicContact CD1-SD 4.45Å; L81-M85 VanDerWaalsContact O-CB 3.31Å; L81-M85 WeakPolarHBondContact O-CB 3.44Å; L81-M85 PolarHBondContact O-N 3.17Å; V82-M85 PolarHBondContact O-N 3.32Å; T83-M85 VanDerWaalsContact C-N 3.33Å; T83-M85 PolarHBondContact O-N 3.42Å; M85-M87 PolarHBondContact O-N 3.1Å; M85-K88 WeakPolarHBondContact O-CA 3.2Å; M85-K88 PolarHBondContact O-N 2.76Å; M85-E89 WeakPolarHBondContact CA-OE1 3.34Å; M85-E89 VanDerWaalsContact CG-OE1 3.29Å; M85-E89 WeakPolarHBondContact CG-OE1 3.29Å; M85-H284 HydrophobicContact CE-CB 4.45Å; M85-H284 WeakPolarHBondContact CE-ND1 3.15Å; M85-H284 HydrophobicContact SD-CB 4.31Å |
| 86 | A | 93.2 | Very high | 94.2 | Very high | 56 Ų | 56 | 55.6 Ų | 55.6 | 46% | 0.463 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -61.3 | -30.6 | -178.5 | 0 | 0 | 0 | 0 | 0 | 113 | M30 V82 T83 S84 K88 | M30-A86 HydrophobicContact CE-CB 4.35Å; V82-A86 VanDerWaalsContact O-CB 3.26Å; V82-A86 WeakPolarHBondContact O-CB 3.31Å; V82-A86 PolarHBondContact O-N 2.86Å; T83-A86 PolarHBondContact O-N 3.06Å; S84-A86 PolarHBondContact O-N 2.89Å; A86-K88 PolarHBondContact O-N 2.85Å |
| 87 | M | 92.4 | Very high | 94.3 | Very high | 86 Ų | 86 | 56.7 Ų | 56.7 | 42% | 0.424 | 29% | 0.291 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -83.8 | 17.8 | 173.5 | -63.2 | -175.1 | 71.2 | 0 | 0 | 113.5 | T83 S84 M85 K90 P92 | T83-M87 HydrophobicContact CG2-SD 4.22Å; T83-M87 WeakPolarHBondContact O-CG 3.39Å; T83-M87 PolarHBondContact O-N 2.97Å; S84-M87 PolarHBondContact O-N 3.2Å; M85-M87 PolarHBondContact O-N 3.1Å; M87-K90 HydrophobicContact CB-CB 3.99Å; M87-K90 WeakPolarHBondContact O-CB 3.21Å; M87-K90 WeakPolarHBondContact O-CD 3.34Å; M87-K90 WeakPolarHBondContact O-CG 3.23Å; M87-K90 PolarHBondContact O-N 2.79Å; M87-P92 HydrophobicContact SD-CB 4.28Å; M87-P92 HydrophobicContact SD-CG 3.78Å |
| 88 | K | 89.6 | Confident | 94.3 | Very high | 160 Ų | 160 | 56.1 Ų | 56.1 | 70% | 0.696 | 29% | 0.287 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 60.3 | 52.1 | -177.5 | -54.7 | 179.1 | 178.1 | -177.8 | 0 | 112.2 | M85 A86 K90 | M85-K88 WeakPolarHBondContact O-CA 3.2Å; M85-K88 PolarHBondContact O-N 2.76Å; A86-K88 PolarHBondContact O-N 2.85Å; K88-K90 PolarHBondContact O-N 2.9Å |
| 89 | E | 89.4 | Confident | 94.3 | Very high | 80 Ų | 80 | 57.2 Ų | 57.2 | 37% | 0.374 | 29% | 0.292 | S | S | . | . | S | Bend | trans | 66.7 | 11.2 | -180 | -52.6 | -53.1 | 135.1 | 0 | 0 | 115.6 | S84 M85 Y175 H284 | S84-E89 VanDerWaalsContact O-CA 3.25Å; S84-E89 WeakPolarHBondContact O-CA 3.49Å; S84-E89 PolarHBondContact O-N 3.14Å; M85-E89 WeakPolarHBondContact CA-OE1 3.34Å; M85-E89 VanDerWaalsContact CG-OE1 3.29Å; M85-E89 WeakPolarHBondContact CG-OE1 3.29Å; E89-Y175 VanDerWaalsContact O-CD1 3.3Å; E89-Y175 WeakPolarHBondContact O-CD1 3.48Å; E89-H284 IonicContact OE1-CE1 3.36Å; E89-H284 PolarHBondContact OE1-CE1 2.9Å; E89-H284 IonicContact OE1-ND1 2.61Å; E89-H284 IonicContact OE1-NE2 4Å |
| 90 | K | 93.3 | Very high | 94.2 | Very high | 59 Ų | 59 | 58.2 Ų | 58.2 | 26% | 0.257 | 30% | 0.295 | S | S | . | . | B | Isolated β-bridge | trans | -74.4 | 142.1 | 173.5 | -62.8 | 177 | -173.5 | -162.3 | 0 | 110.5 | S84 M87 K88 P92 D173 V174 Y175 | S84-K90 WeakPolarHBondContact CA-O 3.31Å; S84-K90 PolarHBondContact OG-O 3.34Å; M87-K90 HydrophobicContact CB-CB 3.99Å; M87-K90 WeakPolarHBondContact O-CB 3.21Å; M87-K90 WeakPolarHBondContact O-CD 3.34Å; M87-K90 WeakPolarHBondContact O-CG 3.23Å; M87-K90 PolarHBondContact O-N 2.79Å; K88-K90 PolarHBondContact O-N 2.9Å; K90-P92 VanDerWaalsContact O-CD 3.29Å; K90-P92 WeakPolarHBondContact O-CD 3.3Å; K90-D173 HydrophobicContact CD-CB 4.48Å; K90-D173 VanDerWaalsContact CE-OD1 3.28Å; K90-D173 WeakPolarHBondContact CE-OD1 3.34Å; K90-D173 WeakPolarHBondContact CE-OD2 3.25Å; K90-D173 IonicContact NZ-OD1 3.16Å; K90-D173 PolarHBondContact NZ-OD1 2.99Å; K90-D173 IonicContact NZ-OD2 4Å; K90-D173 PolarHBondContact NZ-OD2 3.21Å; K90-V174 CarbonylContact C-O 3.51Å; K90-V174 WeakPolarHBondContact CA-O 3.28Å; K90-Y175 HydrophobicContact CG-CE1 4.18Å |
| 91 | W | 95.9 | Very high | 94.2 | Very high | 4 Ų | 4 | 55.4 Ų | 55.4 | 2% | 0.015 | 28% | 0.282 | C | S | . | . | trans | -111.5 | 98.1 | -176.5 | -169.8 | -95.5 | 0 | 0 | 0 | 112.8 | F80 F93 G94 M97 C98 V101 V174 C176 | F80-W91 HydrophobicContact CB-CH2 4.05Å; W91-F93 HydrophobicContact CD2-CD2 4.07Å; W91-F93 AromaticContact CE2-CD2 3.81Å; W91-F93 HydrophobicContact CE3-CD2 4.22Å; W91-F93 AromaticContact CH2-CD2 3.91Å; W91-F93 HydrophobicContact CH2-CD2 3.91Å; W91-F93 HydrophobicContact CZ2-CB 3.92Å; W91-F93 AromaticContact CZ2-CD2 3.72Å; W91-F93 HydrophobicContact CZ2-CD2 3.72Å; W91-F93 HydrophobicContact CZ2-CG 4.25Å; W91-F93 HydrophobicContact CZ3-CD2 4.15Å; W91-G94 PolarHBondContact NE1-O 3.02Å; W91-M97 VanDerWaalsContact CZ2-C 3.47Å; W91-M97 HydrophobicContact CZ2-CB 4.01Å; W91-M97 WeakPolarHBondContact CZ2-O 3.42Å; W91-C98 HydrophobicContact CD2-CB 4.4Å; W91-C98 VanDerWaalsContact CE2-CA 3.48Å; W91-C98 HydrophobicContact CG-CB 4.41Å; W91-C98 HydrophobicContact CZ2-CB 4.34Å; W91-V101 HydrophobicContact CH2-CB 3.95Å; W91-V101 HydrophobicContact CH2-CG1 4.02Å; W91-V101 HydrophobicContact CH2-CG2 4.02Å; W91-V101 HydrophobicContact CZ2-CB 4.42Å; W91-V101 HydrophobicContact CZ2-CG2 4.32Å; W91-V174 PolarHBondContact N-O 3.01Å; W91-C176 HydrophobicContact CB-CB 3.79Å; W91-C176 HydrophobicContact CD2-CB 3.82Å; W91-C176 HydrophobicContact CE3-CB 4.13Å; W91-C176 HydrophobicContact CG-CB 3.64Å | ||
| 92 | P | 94.9 | Very high | 94.2 | Very high | 70 Ų | 70 | 56.5 Ų | 56.5 | 46% | 0.455 | 29% | 0.287 | S | S | . | . | trans | -84.6 | -12.5 | -177.3 | 34.3 | -38 | 0 | 0 | 0 | 114.4 | M87 K90 G94 | M87-P92 HydrophobicContact SD-CB 4.28Å; M87-P92 HydrophobicContact SD-CG 3.78Å; K90-P92 VanDerWaalsContact O-CD 3.29Å; K90-P92 WeakPolarHBondContact O-CD 3.3Å; P92-G94 VanDerWaalsContact C-N 3.31Å; P92-G94 PolarHBondContact O-N 2.71Å | ||
| 93 | F | 95.2 | Very high | 94.1 | Very high | 68 Ų | 68 | 56.8 Ų | 56.8 | 30% | 0.298 | 29% | 0.287 | S | S | . | . | S | Bend | trans | -85.7 | 3.7 | -166 | -52.4 | -74.5 | 0 | 0 | 0 | 115.2 | F80 T83 W91 M97 | F80-F93 HydrophobicContact CB-CD2 4.39Å; F80-F93 HydrophobicContact CB-CE2 4.09Å; F80-F93 HydrophobicContact CB-CZ 4.47Å; F80-F93 AromaticContact CD1-CD1 3.71Å; F80-F93 HydrophobicContact CD1-CD1 3.71Å; F80-F93 AromaticContact CD1-CD2 3.96Å; F80-F93 HydrophobicContact CD1-CD2 3.96Å; F80-F93 AromaticContact CD1-CE1 3.72Å; F80-F93 HydrophobicContact CD1-CE1 3.72Å; F80-F93 AromaticContact CD1-CE2 3.98Å; F80-F93 HydrophobicContact CD1-CE2 3.98Å; F80-F93 AromaticContact CD1-CG 3.82Å; F80-F93 HydrophobicContact CD1-CG 3.82Å; F80-F93 AromaticContact CD1-CZ 3.84Å; F80-F93 HydrophobicContact CD1-CZ 3.84Å; F80-F93 HydrophobicContact CE1-CD1 4.01Å; F80-F93 HydrophobicContact CE1-CE1 4.15Å; F80-F93 HydrophobicContact CE1-CG 4.42Å; T83-F93 HydrophobicContact CG2-CE2 4.22Å; T83-F93 HydrophobicContact CG2-CZ 3.68Å; W91-F93 HydrophobicContact CD2-CD2 4.07Å; W91-F93 AromaticContact CE2-CD2 3.81Å; W91-F93 HydrophobicContact CE3-CD2 4.22Å; W91-F93 AromaticContact CH2-CD2 3.91Å; W91-F93 HydrophobicContact CH2-CD2 3.91Å; W91-F93 HydrophobicContact CZ2-CB 3.92Å; W91-F93 AromaticContact CZ2-CD2 3.72Å; W91-F93 HydrophobicContact CZ2-CD2 3.72Å; W91-F93 HydrophobicContact CZ2-CG 4.25Å; W91-F93 HydrophobicContact CZ3-CD2 4.15Å; F93-M97 HydrophobicContact CB-CB 3.66Å; F93-M97 HydrophobicContact CB-CG 4.17Å; F93-M97 WeakPolarHBondContact O-CB 3.35Å |
| 94 | G | 94.8 | Very high | 94.1 | Very high | 33 Ų | 33 | 55.6 Ų | 55.6 | 34% | 0.34 | 28% | 0.28 | S | S | . | . | H | α-helix | trans | 78.1 | 177 | -179.3 | 0 | 0 | 0 | 0 | 0 | 114.8 | W91 P92 C98 | W91-G94 PolarHBondContact NE1-O 3.02Å; P92-G94 VanDerWaalsContact C-N 3.31Å; P92-G94 PolarHBondContact O-N 2.71Å; G94-C98 PolarHBondContact O-N 3.27Å; G94-C98 VanDerWaalsContact O-N 3.14Å |
| 95 | W | 95.2 | Very high | 94 | Very high | 134 Ų | 134 | 56 Ų | 56 | 51% | 0.508 | 28% | 0.282 | S | S | . | . | H | α-helix | trans | -63.9 | -45.4 | -170.2 | 174.4 | 88.2 | 0 | 0 | 0 | 114 | M97 C98 K99 T165 T166 | W95-M97 PolarHBondContact O-N 3.06Å; W95-C98 WeakPolarHBondContact O-CB 3.29Å; W95-C98 PolarHBondContact O-N 3.23Å; W95-K99 HydrophobicContact CD2-CD 4.48Å; W95-K99 HydrophobicContact CH2-CD 4.1Å; W95-K99 HydrophobicContact CZ2-CD 3.6Å; W95-K99 PolarHBondContact O-N 3.31Å; W95-T165 PolarHBondContact NE1-OG1 3.44Å; W95-T166 HydrophobicContact CB-CG2 4.4Å |
| 96 | F | 96.1 | Very high | 93.8 | Very high | 127 Ų | 127 | 55.5 Ų | 55.5 | 56% | 0.557 | 28% | 0.279 | S | S | * | . | H | α-helix | trans | -62.7 | -47.1 | -177.3 | 175.4 | -101.5 | 0 | 0 | 0 | 111.4 | C98 K99 L100 | F96-C98 VanDerWaalsContact C-N 3.34Å; F96-C98 PolarHBondContact O-N 3.13Å; F96-K99 PolarHBondContact O-N 2.82Å; F96-L100 HydrophobicContact CE1-CB 4.4Å; F96-L100 HydrophobicContact CE1-CD2 3.7Å; F96-L100 HydrophobicContact CZ-CD2 4.02Å; F96-L100 WeakPolarHBondContact O-CB 3.32Å; F96-L100 PolarHBondContact O-N 2.83Å |
| 97 | M | 96 | Very high | 93.8 | Very high | 64 Ų | 64 | 54.1 Ų | 54.1 | 32% | 0.315 | 26% | 0.264 | S | S | . | . | H | α-helix | trans | -67 | -34.5 | 178.9 | -69.1 | -63 | 171.1 | 0 | 0 | 112.2 | W91 F93 W95 K99 L100 V101 | W91-M97 VanDerWaalsContact CZ2-C 3.47Å; W91-M97 HydrophobicContact CZ2-CB 4.01Å; W91-M97 WeakPolarHBondContact CZ2-O 3.42Å; F93-M97 HydrophobicContact CB-CB 3.66Å; F93-M97 HydrophobicContact CB-CG 4.17Å; F93-M97 WeakPolarHBondContact O-CB 3.35Å; W95-M97 PolarHBondContact O-N 3.06Å; M97-K99 VanDerWaalsContact C-N 3.33Å; M97-K99 PolarHBondContact O-N 3.14Å; M97-L100 PolarHBondContact O-N 3.24Å; M97-L100 HydrophobicContact SD-CD2 4.14Å; M97-V101 VanDerWaalsContact O-CB 3.28Å; M97-V101 WeakPolarHBondContact O-CB 3.36Å; M97-V101 VanDerWaalsContact O-CG2 3.31Å; M97-V101 WeakPolarHBondContact O-CG2 3.4Å; M97-V101 PolarHBondContact O-N 3.36Å |
| 98 | C | 95.9 | Very high | 93.7 | Very high | 0 Ų | 0 | 50.2 Ų | 50.2 | 0% | 0 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -54.9 | -50.2 | 174.1 | 163.8 | 0 | 0 | 0 | 0 | 110.7 | W91 G94 W95 F96 H102 T166 C176 | W91-C98 HydrophobicContact CD2-CB 4.4Å; W91-C98 VanDerWaalsContact CE2-CA 3.48Å; W91-C98 HydrophobicContact CG-CB 4.41Å; W91-C98 HydrophobicContact CZ2-CB 4.34Å; G94-C98 PolarHBondContact O-N 3.27Å; G94-C98 VanDerWaalsContact O-N 3.14Å; W95-C98 WeakPolarHBondContact O-CB 3.29Å; W95-C98 PolarHBondContact O-N 3.23Å; F96-C98 VanDerWaalsContact C-N 3.34Å; F96-C98 PolarHBondContact O-N 3.13Å; C98-H102 PolarHBondContact O-N 3.36Å; C98-H102 PolarHBondContact O-ND1 3.31Å; C98-T166 HydrophobicContact CB-CG2 3.65Å; C98-C176 VanDerWaalsContact CA-SG 3.51Å; C98-C176 HydrophobicContact CB-CB 3.83Å; C98-C176 WeakPolarHBondContact CB-SG 3.48Å; C98-C176 WeakPolarHBondContact SG-CB 3.36Å; C98-C176 CovalentContact SG-SG 2.02Å; C98-C176 PolarHBondContact SG-SG 3.47Å |
| 99 | K | 95.3 | Very high | 93.5 | Very high | 24 Ų | 24 | 43 Ų | 43 | 10% | 0.104 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -67.4 | -52.5 | 176.5 | -72.1 | -176 | 176.3 | -72.1 | 0 | 111.8 | W95 F96 M97 V101 H102 I103 F161 L164 | W95-K99 HydrophobicContact CD2-CD 4.48Å; W95-K99 HydrophobicContact CH2-CD 4.1Å; W95-K99 HydrophobicContact CZ2-CD 3.6Å; W95-K99 PolarHBondContact O-N 3.31Å; F96-K99 PolarHBondContact O-N 2.82Å; M97-K99 VanDerWaalsContact C-N 3.33Å; M97-K99 PolarHBondContact O-N 3.14Å; K99-V101 PolarHBondContact O-N 3.24Å; K99-H102 PolarHBondContact O-N 3.17Å; K99-I103 HydrophobicContact CB-CD1 4.21Å; K99-I103 WeakPolarHBondContact O-CB 3.33Å; K99-I103 WeakPolarHBondContact O-CD1 3.36Å; K99-I103 WeakPolarHBondContact O-CG1 3.41Å; K99-I103 PolarHBondContact O-N 2.87Å; K99-F161 PolarHBondContact NZ-O 3.39Å; K99-L164 WeakPolarHBondContact CE-O 3.39Å; K99-L164 PolarHBondContact NZ-O 2.95Å |
| 100 | L | 95.3 | Very high | 93.5 | Very high | 69 Ų | 69 | 39.3 Ų | 39.3 | 36% | 0.361 | 20% | 0.196 | S | C | . | . | H | α-helix | trans | -57.9 | -49.2 | -174.3 | -179.7 | 64.8 | 0 | 0 | 0 | 112.2 | F96 M97 H102 I103 V104 | F96-L100 HydrophobicContact CE1-CB 4.4Å; F96-L100 HydrophobicContact CE1-CD2 3.7Å; F96-L100 HydrophobicContact CZ-CD2 4.02Å; F96-L100 WeakPolarHBondContact O-CB 3.32Å; F96-L100 PolarHBondContact O-N 2.83Å; M97-L100 PolarHBondContact O-N 3.24Å; M97-L100 HydrophobicContact SD-CD2 4.14Å; L100-H102 PolarHBondContact O-N 2.73Å; L100-I103 PolarHBondContact O-N 3.39Å; L100-V104 HydrophobicContact CD1-CG2 4.16Å; L100-V104 VanDerWaalsContact O-CG2 3.3Å; L100-V104 WeakPolarHBondContact O-CG2 3.49Å; L100-V104 PolarHBondContact O-N 2.82Å |
| 101 | V | 95.4 | Very high | 93.3 | Very high | 3 Ų | 3 | 36.5 Ų | 36.5 | 2% | 0.018 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -60.2 | -49.6 | -178.1 | 166.8 | 0 | 0 | 0 | 0 | 110.6 | T77 F80 L81 W91 M97 K99 I103 V104 V105 | T77-V101 HydrophobicContact CG2-CG2 4.49Å; F80-V101 HydrophobicContact CB-CG1 4.4Å; F80-V101 HydrophobicContact CB-CG2 3.99Å; F80-V101 HydrophobicContact CD2-CG2 4.06Å; F80-V101 HydrophobicContact CG-CG2 3.98Å; L81-V101 HydrophobicContact CD2-CG1 3.71Å; L81-V101 HydrophobicContact CG-CG1 4.09Å; W91-V101 HydrophobicContact CH2-CB 3.95Å; W91-V101 HydrophobicContact CH2-CG1 4.02Å; W91-V101 HydrophobicContact CH2-CG2 4.02Å; W91-V101 HydrophobicContact CZ2-CB 4.42Å; W91-V101 HydrophobicContact CZ2-CG2 4.32Å; M97-V101 VanDerWaalsContact O-CB 3.28Å; M97-V101 WeakPolarHBondContact O-CB 3.36Å; M97-V101 VanDerWaalsContact O-CG2 3.31Å; M97-V101 WeakPolarHBondContact O-CG2 3.4Å; M97-V101 PolarHBondContact O-N 3.36Å; K99-V101 PolarHBondContact O-N 3.24Å; V101-I103 PolarHBondContact O-N 3.43Å; V101-V104 PolarHBondContact O-N 2.97Å; V101-V105 HydrophobicContact CG1-CG2 4.47Å; V101-V105 WeakPolarHBondContact O-CG2 3.16Å; V101-V105 PolarHBondContact O-N 3.16Å |
| 102 | H | 94.1 | Very high | 92.9 | Very high | 46 Ų | 46 | 36.4 Ų | 36.4 | 21% | 0.213 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -71.2 | -30.9 | -178.1 | -69.4 | 84.2 | 0 | 0 | 0 | 113 | C98 K99 L100 D106 I160 L164 C176 | C98-H102 PolarHBondContact O-N 3.36Å; C98-H102 PolarHBondContact O-ND1 3.31Å; K99-H102 PolarHBondContact O-N 3.17Å; L100-H102 PolarHBondContact O-N 2.73Å; H102-D106 PolarHBondContact O-N 2.9Å; H102-I160 HydrophobicContact CB-CG2 4.11Å; H102-L164 HydrophobicContact CB-CD2 3.37Å; H102-L164 VanDerWaalsContact CG-CD2 3.5Å; H102-C176 PolarHBondContact CE1-SG 3.35Å; H102-C176 PolarHBondContact ND1-SG 2.99Å |
| 103 | I | 94.1 | Very high | 92.6 | Very high | 30 Ų | 30 | 33.1 Ų | 33.1 | 15% | 0.154 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -63.8 | -49 | 171.2 | -71 | 165.6 | 0 | 0 | 0 | 109.9 | K99 L100 V101 V105 D106 I107 I160 F161 | K99-I103 HydrophobicContact CB-CD1 4.21Å; K99-I103 WeakPolarHBondContact O-CB 3.33Å; K99-I103 WeakPolarHBondContact O-CD1 3.36Å; K99-I103 WeakPolarHBondContact O-CG1 3.41Å; K99-I103 PolarHBondContact O-N 2.87Å; L100-I103 PolarHBondContact O-N 3.39Å; V101-I103 PolarHBondContact O-N 3.43Å; I103-V105 VanDerWaalsContact C-N 3.29Å; I103-V105 PolarHBondContact O-N 2.92Å; I103-D106 PolarHBondContact O-N 2.86Å; I103-I107 HydrophobicContact CG2-CD1 3.51Å; I103-I107 HydrophobicContact CG2-CG1 4.14Å; I103-I107 WeakPolarHBondContact O-CB 3.37Å; I103-I107 VanDerWaalsContact O-CG1 3.26Å; I103-I107 WeakPolarHBondContact O-CG1 3.38Å; I103-I107 PolarHBondContact O-N 3.37Å; I103-I160 HydrophobicContact CG1-CB 4.4Å; I103-I160 HydrophobicContact CG1-CG2 3.56Å; I103-F161 HydrophobicContact CD1-CB 4.44Å; I103-F161 HydrophobicContact CD1-CD2 3.84Å |
| 104 | V | 94.3 | Very high | 92.4 | Very high | 31 Ų | 31 | 30.8 Ų | 30.8 | 19% | 0.188 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -61.7 | -39.5 | 179.1 | 171.1 | 0 | 0 | 0 | 0 | 111.2 | S73 T77 L100 V101 I107 N108 | S73-V104 WeakPolarHBondContact O-CG1 3.18Å; T77-V104 HydrophobicContact CG2-CB 4Å; T77-V104 HydrophobicContact CG2-CG1 3.69Å; L100-V104 HydrophobicContact CD1-CG2 4.16Å; L100-V104 VanDerWaalsContact O-CG2 3.3Å; L100-V104 WeakPolarHBondContact O-CG2 3.49Å; L100-V104 PolarHBondContact O-N 2.82Å; V101-V104 PolarHBondContact O-N 2.97Å; V104-I107 PolarHBondContact O-N 3.27Å; V104-N108 WeakPolarHBondContact O-CB 3.39Å; V104-N108 PolarHBondContact O-N 3.46Å |
| 105 | V | 91.1 | Very high | 92.2 | Very high | 18 Ų | 18 | 29.2 Ų | 29.2 | 11% | 0.109 | 14% | 0.136 | C | C | . | . | H | α-helix | trans | -60.9 | -48.4 | 175 | 171.6 | 0 | 0 | 0 | 0 | 111.3 | F74 L81 V101 I103 N108 L109 | F74-V105 HydrophobicContact CD2-CB 4.41Å; F74-V105 HydrophobicContact CD2-CG1 4.5Å; F74-V105 HydrophobicContact CD2-CG2 3.98Å; F74-V105 HydrophobicContact CE2-CG1 4.22Å; F74-V105 HydrophobicContact CE2-CG2 4.06Å; L81-V105 HydrophobicContact CD1-CG2 3.88Å; V101-V105 HydrophobicContact CG1-CG2 4.47Å; V101-V105 WeakPolarHBondContact O-CG2 3.16Å; V101-V105 PolarHBondContact O-N 3.16Å; I103-V105 VanDerWaalsContact C-N 3.29Å; I103-V105 PolarHBondContact O-N 2.92Å; V105-N108 PolarHBondContact O-N 3.35Å; V105-L109 WeakPolarHBondContact O-CB 3.47Å; V105-L109 PolarHBondContact O-N 2.92Å |
| 106 | D | 89.6 | Confident | 91.8 | Very high | 4 Ų | 4 | 23.5 Ų | 23.5 | 2% | 0.021 | 12% | 0.116 | C | C | . | . | H | α-helix | trans | -70.2 | -37.2 | 179.9 | -83.6 | 9.1 | 0 | 0 | 0 | 112.4 | H102 I103 N108 L109 F110 T157 I160 R201 R205 | H102-D106 PolarHBondContact O-N 2.9Å; I103-D106 PolarHBondContact O-N 2.86Å; D106-N108 VanDerWaalsContact C-N 3.32Å; D106-N108 PolarHBondContact O-N 3.32Å; D106-L109 WeakPolarHBondContact O-CB 3.46Å; D106-L109 PolarHBondContact O-N 3.31Å; D106-F110 VanDerWaalsContact O-CD2 3.23Å; D106-F110 WeakPolarHBondContact O-CD2 3.19Å; D106-F110 PolarHBondContact O-N 3.12Å; D106-T157 HydrophobicContact CB-CG2 3.5Å; D106-I160 WeakPolarHBondContact OD2-CG1 3.22Å; D106-R201 IonicContact OD1-NH2 3.66Å; D106-R201 IonicContact OD2-CZ 3.55Å; D106-R201 IonicContact OD2-NH1 3.59Å; D106-R201 IonicContact OD2-NH2 2.76Å; D106-R201 PolarHBondContact OD2-NH2 3.25Å; D106-R205 IonicContact OD1-CZ 3.61Å; D106-R205 IonicContact OD1-NH2 2.61Å; D106-R205 PolarHBondContact OD1-NH2 2.88Å; D106-R205 IonicContact OD2-NH2 3.72Å |
| 107 | I | 91.3 | Very high | 91.5 | Very high | 26 Ų | 26 | 17.7 Ų | 17.7 | 13% | 0.133 | 9% | 0.091 | C | C | . | . | H | α-helix | trans | -62.1 | -43.3 | 174.2 | -71.1 | 171.8 | 0 | 0 | 0 | 109.8 | I103 V104 G111 W150 A153 L154 T157 | I103-I107 HydrophobicContact CG2-CD1 3.51Å; I103-I107 HydrophobicContact CG2-CG1 4.14Å; I103-I107 WeakPolarHBondContact O-CB 3.37Å; I103-I107 VanDerWaalsContact O-CG1 3.26Å; I103-I107 WeakPolarHBondContact O-CG1 3.38Å; I103-I107 PolarHBondContact O-N 3.37Å; V104-I107 PolarHBondContact O-N 3.27Å; I107-G111 VanDerWaalsContact O-CA 3.29Å; I107-G111 WeakPolarHBondContact O-CA 3.29Å; I107-G111 PolarHBondContact O-N 3.46Å; I107-W150 HydrophobicContact CG2-CE3 3.98Å; I107-W150 HydrophobicContact CG2-CZ3 3.65Å; I107-A153 HydrophobicContact CG2-CB 4.48Å; I107-L154 HydrophobicContact CD1-CD2 3.57Å; I107-L154 HydrophobicContact CG1-CD2 4.22Å; I107-T157 HydrophobicContact CB-CG2 4.37Å; I107-T157 HydrophobicContact CG1-CG2 3.55Å |
| 108 | N | 90.6 | Very high | 91.3 | Very high | 4 Ų | 4 | 16.3 Ų | 16.3 | 2% | 0.021 | 9% | 0.085 | C | C | . | . | H | α-helix | trans | -66.1 | -44.1 | 176.7 | -179.8 | 52.9 | 0 | 0 | 0 | 111.9 | A70 D71 F74 V104 V105 D106 F110 G111 S112 S294 | A70-N108 WeakPolarHBondContact CB-OD1 3.25Å; A70-N108 PolarHBondContact O-OD1 3.06Å; D71-N108 PolarHBondContact N-OD1 3.02Å; D71-N108 PolarHBondContact OD1-OD1 3.44Å; F74-N108 HydrophobicContact CB-CB 3.47Å; F74-N108 VanDerWaalsContact CB-CB 3.47Å; F74-N108 WeakPolarHBondContact CB-ND2 3.38Å; F74-N108 WeakPolarHBondContact CD1-ND2 3.41Å; F74-N108 HydrophobicContact CD2-CB 4.39Å; F74-N108 HydrophobicContact CG-CB 4.06Å; F74-N108 WeakPolarHBondContact CG-ND2 3.37Å; V104-N108 WeakPolarHBondContact O-CB 3.39Å; V104-N108 PolarHBondContact O-N 3.46Å; V105-N108 PolarHBondContact O-N 3.35Å; D106-N108 VanDerWaalsContact C-N 3.32Å; D106-N108 PolarHBondContact O-N 3.32Å; N108-F110 VanDerWaalsContact C-N 3.34Å; N108-F110 PolarHBondContact O-N 3.43Å; N108-G111 PolarHBondContact O-N 3.26Å; N108-S112 WeakPolarHBondContact O-CB 3.37Å; N108-S112 PolarHBondContact O-N 2.96Å; N108-S112 PolarHBondContact O-OG 3.36Å; N108-S112 PolarHBondContact OD1-OG 3.15Å; N108-S294 PolarHBondContact ND2-OG 3.29Å |
| 109 | L | 84.9 | Confident | 90.9 | Very high | 8 Ų | 8 | 17 Ų | 17 | 4% | 0.042 | 9% | 0.088 | C | C | . | . | H | α-helix | trans | -50.8 | -54 | 175.5 | 170.4 | 67.4 | 0 | 0 | 0 | 111 | V105 D106 V113 R205 W254 | V105-L109 WeakPolarHBondContact O-CB 3.47Å; V105-L109 PolarHBondContact O-N 2.92Å; D106-L109 WeakPolarHBondContact O-CB 3.46Å; D106-L109 PolarHBondContact O-N 3.31Å; L109-V113 WeakPolarHBondContact O-CB 3.45Å; L109-V113 WeakPolarHBondContact O-CG2 3.35Å; L109-R205 HydrophobicContact CD2-CG 4.47Å; L109-W254 HydrophobicContact CD1-CE3 3.89Å; L109-W254 HydrophobicContact CD1-CH2 3.18Å; L109-W254 HydrophobicContact CD1-CZ2 4.15Å; L109-W254 HydrophobicContact CD1-CZ3 3.04Å; L109-W254 HydrophobicContact CG-CH2 4.47Å; L109-W254 HydrophobicContact CG-CZ3 4.49Å |
| 110 | F | 89.9 | Confident | 90.4 | Very high | 3 Ų | 3 | 15.8 Ų | 15.8 | 1% | 0.013 | 8% | 0.083 | C | C | . | . | H | α-helix | trans | -75 | -46.1 | -179.2 | -70.8 | -62.6 | 0 | 0 | 0 | 112.1 | D106 N108 V113 F114 A153 L156 T157 R205 | D106-F110 VanDerWaalsContact O-CD2 3.23Å; D106-F110 WeakPolarHBondContact O-CD2 3.19Å; D106-F110 PolarHBondContact O-N 3.12Å; N108-F110 VanDerWaalsContact C-N 3.34Å; N108-F110 PolarHBondContact O-N 3.43Å; F110-V113 PolarHBondContact O-N 3.48Å; F110-F114 HydrophobicContact CB-CD2 4.23Å; F110-F114 HydrophobicContact CB-CE2 3.73Å; F110-F114 HydrophobicContact CB-CZ 4.18Å; F110-F114 HydrophobicContact CD1-CE2 4.33Å; F110-F114 AromaticContact CD1-CZ 3.95Å; F110-F114 HydrophobicContact CD1-CZ 3.95Å; F110-F114 HydrophobicContact CG-CE2 4.39Å; F110-F114 HydrophobicContact CG-CZ 4.46Å; F110-F114 WeakPolarHBondContact O-CB 3.33Å; F110-F114 WeakPolarHBondContact O-CD2 3.37Å; F110-F114 WeakPolarHBondContact O-CG 3.45Å; F110-F114 PolarHBondContact O-N 3.41Å; F110-A153 HydrophobicContact CB-CB 3.73Å; F110-L156 HydrophobicContact CD1-CD1 3.65Å; F110-L156 HydrophobicContact CD2-CB 3.77Å; F110-L156 HydrophobicContact CD2-CD1 4.33Å; F110-L156 HydrophobicContact CE1-CB 4.4Å; F110-L156 HydrophobicContact CE1-CD1 3.81Å; F110-L156 HydrophobicContact CE2-CB 3.65Å; F110-L156 HydrophobicContact CE2-CD1 4.48Å; F110-L156 HydrophobicContact CG-CB 4.21Å; F110-L156 HydrophobicContact CG-CD1 3.93Å; F110-L156 HydrophobicContact CZ-CB 3.98Å; F110-L156 HydrophobicContact CZ-CD1 4.23Å; F110-T157 HydrophobicContact CD2-CG2 4.47Å; F110-R205 HydrophobicContact CZ-CG 3.84Å |
| 111 | G | 90.1 | Very high | 90.2 | Very high | 0 Ų | 0 | 15.8 Ų | 15.8 | 0% | 0 | 8% | 0.083 | C | C | . | . | H | α-helix | trans | -59.2 | -51.5 | -177 | 0 | 0 | 0 | 0 | 0 | 112.2 | I107 N108 V113 F114 L115 | I107-G111 VanDerWaalsContact O-CA 3.29Å; I107-G111 WeakPolarHBondContact O-CA 3.29Å; I107-G111 PolarHBondContact O-N 3.46Å; N108-G111 PolarHBondContact O-N 3.26Å; G111-V113 VanDerWaalsContact C-N 3.35Å; G111-V113 PolarHBondContact O-N 2.94Å; G111-F114 PolarHBondContact O-N 2.99Å; G111-L115 VanDerWaalsContact O-CB 3.31Å; G111-L115 WeakPolarHBondContact O-CB 3.31Å; G111-L115 WeakPolarHBondContact O-CD1 3.01Å; G111-L115 WeakPolarHBondContact O-CG 3.14Å; G111-L115 PolarHBondContact O-N 2.84Å |
| 112 | S | 87.8 | Confident | 89.9 | Confident | 3 Ų | 3 | 16.7 Ų | 16.7 | 2% | 0.021 | 9% | 0.088 | C | C | . | . | H | α-helix | trans | -63.9 | -42 | -178.5 | -74 | 0 | 0 | 0 | 0 | 112.4 | L67 A70 D71 N108 L115 I116 | L67-S112 VanDerWaalsContact CD1-CB 3.46Å; L67-S112 WeakPolarHBondContact CD1-O 3.38Å; L67-S112 WeakPolarHBondContact CD1-OG 3.48Å; A70-S112 WeakPolarHBondContact CB-OG 3.34Å; D71-S112 PolarHBondContact OD1-OG 3.49Å; N108-S112 WeakPolarHBondContact O-CB 3.37Å; N108-S112 PolarHBondContact O-N 2.96Å; N108-S112 PolarHBondContact O-OG 3.36Å; N108-S112 PolarHBondContact OD1-OG 3.15Å; S112-L115 PolarHBondContact O-N 2.9Å; S112-I116 WeakPolarHBondContact O-CB 2.97Å; S112-I116 VanDerWaalsContact O-CG1 3.23Å; S112-I116 WeakPolarHBondContact O-CG1 3.48Å; S112-I116 PolarHBondContact O-N 3.5Å |
| 113 | V | 86.9 | Confident | 89.5 | Confident | 1 Ų | 1 | 19 Ų | 19 | 1% | 0.006 | 10% | 0.095 | C | C | . | . | H | α-helix | trans | -67.2 | -43.1 | 179.1 | 177.8 | 0 | 0 | 0 | 0 | 111.4 | L109 F110 G111 I116 A117 P213 F250 | L109-V113 WeakPolarHBondContact O-CB 3.45Å; L109-V113 WeakPolarHBondContact O-CG2 3.35Å; F110-V113 PolarHBondContact O-N 3.48Å; G111-V113 VanDerWaalsContact C-N 3.35Å; G111-V113 PolarHBondContact O-N 2.94Å; V113-I116 PolarHBondContact O-N 3.38Å; V113-A117 PolarHBondContact O-N 2.88Å; V113-P213 HydrophobicContact CG1-CB 3.12Å; V113-P213 HydrophobicContact CG1-CG 3.28Å; V113-F250 HydrophobicContact CB-CE2 4.34Å; V113-F250 HydrophobicContact CB-CZ 4.22Å; V113-F250 HydrophobicContact CG1-CE2 4.17Å; V113-F250 HydrophobicContact CG1-CZ 3.69Å; V113-F250 HydrophobicContact CG2-CE2 3.74Å; V113-F250 HydrophobicContact CG2-CZ 3.64Å |
| 114 | F | 92 | Very high | 89.2 | Confident | 18 Ų | 18 | 18.1 Ų | 18.1 | 8% | 0.079 | 9% | 0.091 | C | C | . | . | H | α-helix | trans | -65.7 | -38.1 | 175.5 | -64.5 | -26.7 | 0 | 0 | 0 | 112.6 | F110 G111 A117 L118 P149 L152 L156 I208 P213 | F110-F114 HydrophobicContact CB-CD2 4.23Å; F110-F114 HydrophobicContact CB-CE2 3.73Å; F110-F114 HydrophobicContact CB-CZ 4.18Å; F110-F114 HydrophobicContact CD1-CE2 4.33Å; F110-F114 AromaticContact CD1-CZ 3.95Å; F110-F114 HydrophobicContact CD1-CZ 3.95Å; F110-F114 HydrophobicContact CG-CE2 4.39Å; F110-F114 HydrophobicContact CG-CZ 4.46Å; F110-F114 WeakPolarHBondContact O-CB 3.33Å; F110-F114 WeakPolarHBondContact O-CD2 3.37Å; F110-F114 WeakPolarHBondContact O-CG 3.45Å; F110-F114 PolarHBondContact O-N 3.41Å; G111-F114 PolarHBondContact O-N 2.99Å; F114-A117 PolarHBondContact O-N 3.48Å; F114-L118 WeakPolarHBondContact O-CB 3.22Å; F114-L118 PolarHBondContact O-N 3.2Å; F114-P149 HydrophobicContact CB-CB 3.81Å; F114-P149 HydrophobicContact CB-CG 4.32Å; F114-P149 HydrophobicContact CD2-CB 4.49Å; F114-L152 HydrophobicContact CD2-CB 4.43Å; F114-L152 HydrophobicContact CD2-CD2 4.15Å; F114-L152 HydrophobicContact CD2-CG 4.4Å; F114-L152 HydrophobicContact CE1-CD2 4.32Å; F114-L152 HydrophobicContact CE2-CB 4.04Å; F114-L152 HydrophobicContact CE2-CD2 3.58Å; F114-L152 HydrophobicContact CE2-CG 3.63Å; F114-L152 HydrophobicContact CZ-CD2 3.69Å; F114-L152 HydrophobicContact CZ-CG 4.03Å; F114-L156 HydrophobicContact CE2-CD1 3.87Å; F114-L156 HydrophobicContact CZ-CD1 3.61Å; F114-I208 HydrophobicContact CE1-CG2 3.89Å; F114-I208 HydrophobicContact CZ-CG2 3.7Å; F114-P213 HydrophobicContact CD1-CG 4.2Å; F114-P213 HydrophobicContact CE1-CG 4.25Å |
| 115 | L | 90.6 | Very high | 89 | Confident | 0 Ų | 0 | 19.5 Ų | 19.5 | 0% | 0 | 10% | 0.097 | C | C | . | . | H | α-helix | trans | -66.2 | -39.3 | 175.5 | -72.8 | 169.1 | 0 | 0 | 0 | 111.4 | N66 L67 G111 S112 L118 I119 V146 P149 | N66-L115 HydrophobicContact CB-CD1 3.93Å; N66-L115 HydrophobicContact CB-CD2 4.06Å; L67-L115 HydrophobicContact CB-CD1 4.39Å; L67-L115 HydrophobicContact CD1-CB 3.96Å; L67-L115 HydrophobicContact CD1-CD1 4.23Å; G111-L115 VanDerWaalsContact O-CB 3.31Å; G111-L115 WeakPolarHBondContact O-CB 3.31Å; G111-L115 WeakPolarHBondContact O-CD1 3.01Å; G111-L115 WeakPolarHBondContact O-CG 3.14Å; G111-L115 PolarHBondContact O-N 2.84Å; S112-L115 PolarHBondContact O-N 2.9Å; L115-L118 PolarHBondContact O-N 3.25Å; L115-I119 WeakPolarHBondContact O-CB 3.28Å; L115-I119 WeakPolarHBondContact O-CD1 3.33Å; L115-I119 WeakPolarHBondContact O-CG1 3.33Å; L115-I119 PolarHBondContact O-N 3.36Å; L115-V146 HydrophobicContact CD2-CG2 3.56Å; L115-P149 HydrophobicContact CD2-CB 4.4Å; L115-P149 HydrophobicContact CD2-CG 4.5Å |
| 116 | I | 86.3 | Confident | 88.7 | Confident | 15 Ų | 15 | 20.2 Ų | 20.2 | 8% | 0.077 | 10% | 0.102 | C | C | . | . | H | α-helix | trans | -62 | -45.7 | 173.1 | -71 | 166.3 | 0 | 0 | 0 | 110.7 | L67 S112 V113 L118 I119 A120 V217 F250 | L67-I116 HydrophobicContact CD1-CG1 4.31Å; L67-I116 HydrophobicContact CD2-CD1 4.38Å; L67-I116 HydrophobicContact CD2-CG1 3.92Å; S112-I116 WeakPolarHBondContact O-CB 2.97Å; S112-I116 VanDerWaalsContact O-CG1 3.23Å; S112-I116 WeakPolarHBondContact O-CG1 3.48Å; S112-I116 PolarHBondContact O-N 3.5Å; V113-I116 PolarHBondContact O-N 3.38Å; I116-L118 VanDerWaalsContact C-N 3.34Å; I116-L118 PolarHBondContact O-N 2.91Å; I116-I119 PolarHBondContact O-N 3.13Å; I116-A120 PolarHBondContact O-N 2.98Å; I116-V217 HydrophobicContact CG2-CG2 3.99Å; I116-F250 HydrophobicContact CD1-CD2 3.86Å; I116-F250 HydrophobicContact CD1-CE2 3.96Å |
| 117 | A | 90.4 | Very high | 88.5 | Confident | 5 Ų | 5 | 22.7 Ų | 22.7 | 4% | 0.041 | 12% | 0.118 | C | C | . | . | H | α-helix | trans | -61.8 | -41.1 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112 | V113 F114 A120 L121 P213 I216 V217 | V113-A117 PolarHBondContact O-N 2.88Å; F114-A117 PolarHBondContact O-N 3.48Å; A117-A120 PolarHBondContact O-N 3.38Å; A117-L121 WeakPolarHBondContact O-CG 3.1Å; A117-L121 PolarHBondContact O-N 3.45Å; A117-P213 HydrophobicContact CB-CB 4.26Å; A117-I216 HydrophobicContact CB-CB 4.36Å; A117-I216 HydrophobicContact CB-CD1 4.48Å; A117-I216 HydrophobicContact CB-CG2 4.04Å; A117-V217 HydrophobicContact CB-CG2 4.43Å |
| 118 | L | 91.3 | Very high | 88.4 | Confident | 35 Ų | 35 | 23.7 Ų | 23.7 | 18% | 0.183 | 12% | 0.123 | C | C | . | . | H | α-helix | trans | -63.2 | -41.2 | 175.6 | 179.9 | 62.5 | 0 | 0 | 0 | 111.9 | F114 L115 I116 L121 D122 V145 P149 | F114-L118 WeakPolarHBondContact O-CB 3.22Å; F114-L118 PolarHBondContact O-N 3.2Å; L115-L118 PolarHBondContact O-N 3.25Å; I116-L118 VanDerWaalsContact C-N 3.34Å; I116-L118 PolarHBondContact O-N 2.91Å; L118-L121 PolarHBondContact O-N 2.94Å; L118-D122 PolarHBondContact O-N 3.48Å; L118-V145 HydrophobicContact CD1-CG1 3.64Å; L118-V145 HydrophobicContact CD2-CG1 4.05Å; L118-P149 HydrophobicContact CD2-CG 4.27Å |
| 119 | I | 86.9 | Confident | 88.3 | Confident | 13 Ų | 13 | 29 Ų | 29 | 7% | 0.067 | 15% | 0.147 | C | C | . | . | H | α-helix | trans | -62.7 | -43.9 | 174.3 | -70 | 159.5 | 0 | 0 | 0 | 110.3 | C63 Y64 L115 I116 L121 D122 R123 | C63-I119 HydrophobicContact CB-CD1 4.06Å; C63-I119 HydrophobicContact CB-CG1 3.62Å; Y64-I119 HydrophobicContact CD1-CD1 3.82Å; Y64-I119 HydrophobicContact CE1-CD1 3.89Å; Y64-I119 HydrophobicContact CE1-CG1 4.35Å; Y64-I119 HydrophobicContact CE1-CG2 4.1Å; L115-I119 WeakPolarHBondContact O-CB 3.28Å; L115-I119 WeakPolarHBondContact O-CD1 3.33Å; L115-I119 WeakPolarHBondContact O-CG1 3.33Å; L115-I119 PolarHBondContact O-N 3.36Å; I116-I119 PolarHBondContact O-N 3.13Å; I119-L121 VanDerWaalsContact C-N 3.35Å; I119-L121 PolarHBondContact O-N 2.97Å; I119-D122 PolarHBondContact O-N 3.26Å; I119-R123 VanDerWaalsContact O-CG 3.28Å; I119-R123 WeakPolarHBondContact O-CG 3.46Å; I119-R123 PolarHBondContact O-N 3.31Å |
| 120 | A | 86.7 | Confident | 88.4 | Confident | 0 Ų | 0 | 31.6 Ų | 31.6 | 0% | 0 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -62.2 | -42.2 | 177.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | I116 A117 R123 C124 V217 C220 Y221 | I116-A120 PolarHBondContact O-N 2.98Å; A117-A120 PolarHBondContact O-N 3.38Å; A120-R123 PolarHBondContact O-N 3.45Å; A120-C124 WeakPolarHBondContact O-CB 3.18Å; A120-C124 PolarHBondContact O-N 3.38Å; A120-V217 HydrophobicContact CB-CB 4.44Å; A120-V217 HydrophobicContact CB-CG2 3.98Å; A120-C220 HydrophobicContact CB-CB 4.1Å; A120-Y221 HydrophobicContact CB-CD1 4.47Å; A120-Y221 HydrophobicContact CB-CE1 3.9Å; A120-Y221 HydrophobicContact CB-CE2 4.24Å |
| 121 | L | 90.9 | Very high | 88.4 | Confident | 68 Ų | 68 | 36.3 Ų | 36.3 | 36% | 0.356 | 19% | 0.194 | S | C | . | . | H | α-helix | trans | -63.5 | -47.6 | 174.8 | -76.7 | 165.5 | 0 | 0 | 0 | 112.4 | A117 L118 I119 R123 C124 I125 I216 C220 | A117-L121 WeakPolarHBondContact O-CG 3.1Å; A117-L121 PolarHBondContact O-N 3.45Å; L118-L121 PolarHBondContact O-N 2.94Å; I119-L121 VanDerWaalsContact C-N 3.35Å; I119-L121 PolarHBondContact O-N 2.97Å; L121-R123 VanDerWaalsContact C-N 3.27Å; L121-R123 PolarHBondContact O-N 3.19Å; L121-C124 WeakPolarHBondContact O-CB 3.39Å; L121-C124 PolarHBondContact O-N 3.46Å; L121-C124 VanDerWaalsContact O-N 3.13Å; L121-I125 WeakPolarHBondContact O-CG1 3.18Å; L121-I125 PolarHBondContact O-N 3.14Å; L121-I216 HydrophobicContact CD1-CG2 3.79Å; L121-I216 HydrophobicContact CD2-CG2 4Å; L121-I216 HydrophobicContact CG-CG2 3.61Å; L121-C220 VanDerWaalsContact CD2-SG 3.52Å |
| 122 | D | 88.9 | Confident | 88.6 | Confident | 22 Ų | 22 | 41.8 Ų | 41.8 | 12% | 0.118 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -55 | -45.2 | 176.1 | 176.9 | 66.1 | 0 | 0 | 0 | 110.9 | L118 I119 I125 C126 R137 | L118-D122 PolarHBondContact O-N 3.48Å; I119-D122 PolarHBondContact O-N 3.26Å; D122-I125 PolarHBondContact O-N 3.28Å; D122-C126 PolarHBondContact O-N 3.25Å; D122-C126 PolarHBondContact O-SG 3.34Å; D122-R137 IonicContact OD1-CZ 3.66Å; D122-R137 IonicContact OD1-NE 2.8Å; D122-R137 PolarHBondContact OD1-NE 3.42Å; D122-R137 IonicContact OD1-NH2 3.62Å; D122-R137 IonicContact OD2-CZ 3.59Å; D122-R137 IonicContact OD2-NE 3.48Å; D122-R137 PolarHBondContact OD2-NE 3.17Å; D122-R137 IonicContact OD2-NH2 2.83Å; D122-R137 PolarHBondContact OD2-NH2 3.03Å |
| 123 | R | 84.9 | Confident | 88.6 | Confident | 94 Ų | 94 | 42.2 Ų | 42.2 | 36% | 0.355 | 22% | 0.218 | S | C | . | . | H | α-helix | trans | -66.3 | -41.1 | 177.5 | -67 | -60.7 | -175.4 | 172.9 | 2.4 | 112.5 | I119 A120 L121 C126 V127 I224 | I119-R123 VanDerWaalsContact O-CG 3.28Å; I119-R123 WeakPolarHBondContact O-CG 3.46Å; I119-R123 PolarHBondContact O-N 3.31Å; A120-R123 PolarHBondContact O-N 3.45Å; L121-R123 VanDerWaalsContact C-N 3.27Å; L121-R123 PolarHBondContact O-N 3.19Å; R123-C126 PolarHBondContact O-N 3.25Å; R123-V127 WeakPolarHBondContact O-CG2 3.12Å; R123-V127 PolarHBondContact O-N 3.01Å; R123-V127 VanDerWaalsContact O-N 3.14Å; R123-I224 HydrophobicContact CB-CD1 3.99Å |
| 124 | C | 87.6 | Confident | 88.5 | Confident | 12 Ų | 12 | 50 Ų | 50 | 8% | 0.081 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -59.3 | -48.9 | 175.9 | -169.3 | 0 | 0 | 0 | 0 | 110.6 | A120 L121 C126 V127 L128 C220 I224 | A120-C124 WeakPolarHBondContact O-CB 3.18Å; A120-C124 PolarHBondContact O-N 3.38Å; L121-C124 WeakPolarHBondContact O-CB 3.39Å; L121-C124 PolarHBondContact O-N 3.46Å; L121-C124 VanDerWaalsContact O-N 3.13Å; C124-C126 PolarHBondContact O-N 2.95Å; C124-V127 PolarHBondContact O-N 2.81Å; C124-V127 VanDerWaalsContact O-N 3.17Å; C124-L128 WeakPolarHBondContact O-CB 3.37Å; C124-L128 WeakPolarHBondContact O-CD1 3.26Å; C124-L128 PolarHBondContact O-N 3.14Å; C124-C220 HydrophobicContact CB-CB 3.83Å; C124-I224 HydrophobicContact CB-CD1 4.43Å |
| 125 | I | 89.9 | Confident | 88.5 | Confident | 60 Ų | 60 | 54.4 Ų | 54.4 | 31% | 0.308 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -60.4 | -43.7 | 178 | -66.4 | 165.9 | 0 | 0 | 0 | 111.1 | L121 D122 V127 H129 W132 | L121-I125 WeakPolarHBondContact O-CG1 3.18Å; L121-I125 PolarHBondContact O-N 3.14Å; D122-I125 PolarHBondContact O-N 3.28Å; I125-V127 VanDerWaalsContact C-N 3.28Å; I125-V127 PolarHBondContact O-N 2.91Å; I125-H129 CarbonylContact O-C 3.44Å; I125-H129 WeakPolarHBondContact O-CA 3.42Å; I125-H129 PolarHBondContact O-N 2.9Å; I125-W132 HydrophobicContact CG2-CE3 3.58Å; I125-W132 HydrophobicContact CG2-CZ3 3.75Å |
| 126 | C | 86.1 | Confident | 88.5 | Confident | 34 Ų | 34 | 58.9 Ų | 58.9 | 23% | 0.23 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -59.8 | -36.3 | 177.7 | -70.1 | 0 | 0 | 0 | 0 | 113.2 | D122 R123 C124 R137 | D122-C126 PolarHBondContact O-N 3.25Å; D122-C126 PolarHBondContact O-SG 3.34Å; R123-C126 PolarHBondContact O-N 3.25Å; C124-C126 PolarHBondContact O-N 2.95Å; C126-R137 VanDerWaalsContact SG-CD 3.57Å; C126-R137 PolarHBondContact SG-NE 3.26Å; C126-R137 VanDerWaalsContact SG-NE 3.42Å |
| 127 | V | 85.3 | Confident | 88.6 | Confident | 56 Ų | 56 | 61.9 Ų | 61.9 | 34% | 0.339 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -86.3 | -40.6 | -177.2 | 174.7 | 0 | 0 | 0 | 0 | 112.1 | R123 C124 I125 I224 K227 | R123-V127 WeakPolarHBondContact O-CG2 3.12Å; R123-V127 PolarHBondContact O-N 3.01Å; R123-V127 VanDerWaalsContact O-N 3.14Å; C124-V127 PolarHBondContact O-N 2.81Å; C124-V127 VanDerWaalsContact O-N 3.17Å; I125-V127 VanDerWaalsContact C-N 3.28Å; I125-V127 PolarHBondContact O-N 2.91Å; V127-I224 HydrophobicContact CB-CG1 4.15Å; V127-I224 HydrophobicContact CG1-CG1 4.38Å; V127-I224 HydrophobicContact CG1-CG2 4.35Å; V127-I224 HydrophobicContact CG2-CD1 4.4Å; V127-I224 HydrophobicContact CG2-CG1 4.25Å; V127-I224 HydrophobicContact CG2-CG2 4.32Å; V127-K227 HydrophobicContact CG1-CB 4.28Å; V127-K227 HydrophobicContact CG1-CG 4.09Å |
| 128 | L | 87.7 | Confident | 88.7 | Confident | 46 Ų | 46 | 65 Ų | 65 | 24% | 0.241 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -81.2 | -37.2 | -176.9 | -85.1 | 69.7 | 0 | 0 | 0 | 112.1 | C124 P130 L223 I224 | C124-L128 WeakPolarHBondContact O-CB 3.37Å; C124-L128 WeakPolarHBondContact O-CD1 3.26Å; C124-L128 PolarHBondContact O-N 3.14Å; L128-P130 WeakPolarHBondContact O-CD 3.4Å; L128-L223 HydrophobicContact CD1-CB 4.2Å; L128-L223 HydrophobicContact CD2-CB 4.13Å; L128-L223 HydrophobicContact CD2-CD1 4.09Å; L128-I224 HydrophobicContact CD1-CG1 4.42Å |
| 129 | H | 89.5 | Confident | 88.7 | Confident | 116 Ų | 116 | 66.4 Ų | 66.4 | 54% | 0.537 | 34% | 0.338 | S | S | . | . | trans | -128.9 | 64.7 | -173.7 | -61 | -74.4 | 0 | 0 | 0 | 112.3 | I125 V131 W132 A133 | I125-H129 CarbonylContact O-C 3.44Å; I125-H129 WeakPolarHBondContact O-CA 3.42Å; I125-H129 PolarHBondContact O-N 2.9Å; H129-V131 PolarHBondContact O-N 3.3Å; H129-W132 HydrophobicContact CB-CB 4.18Å; H129-W132 PolarHBondContact O-N 3.46Å; H129-A133 PolarHBondContact O-N 2.91Å | ||
| 130 | P | 86.4 | Confident | 88.9 | Confident | 63 Ų | 63 | 69.3 Ų | 69.3 | 41% | 0.409 | 36% | 0.36 | S | S | . | . | H | α-helix | trans | -62.2 | -36.6 | -173.3 | 24.2 | -34.5 | 0 | 0 | 0 | 113.9 | L128 A133 Q134 | L128-P130 WeakPolarHBondContact O-CD 3.4Å; P130-A133 PolarHBondContact O-N 3.49Å; P130-Q134 WeakPolarHBondContact O-CB 3.26Å; P130-Q134 PolarHBondContact O-N 2.88Å |
| 131 | V | 90.9 | Very high | 89.1 | Confident | 102 Ų | 102 | 72.8 Ų | 72.8 | 62% | 0.618 | 38% | 0.378 | S | S | * | . | H | α-helix | trans | -66.2 | -41.8 | 178.7 | -179.9 | 0 | 0 | 0 | 0 | 111.3 | H129 Q134 N135 | H129-V131 PolarHBondContact O-N 3.3Å; V131-Q134 PolarHBondContact O-N 3.41Å; V131-N135 PolarHBondContact O-N 3.4Å |
| 132 | W | 93.4 | Very high | 89 | Confident | 115 Ų | 115 | 70 Ų | 70 | 44% | 0.436 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -65.8 | -44.6 | 176 | -174 | 92.5 | 0 | 0 | 0 | 110.8 | I125 H129 Q134 N135 H136 L141 | I125-W132 HydrophobicContact CG2-CE3 3.58Å; I125-W132 HydrophobicContact CG2-CZ3 3.75Å; H129-W132 HydrophobicContact CB-CB 4.18Å; H129-W132 PolarHBondContact O-N 3.46Å; W132-Q134 VanDerWaalsContact C-N 3.31Å; W132-Q134 PolarHBondContact O-N 3.32Å; W132-N135 PolarHBondContact O-N 2.89Å; W132-N135 VanDerWaalsContact O-N 3.16Å; W132-H136 AromaticContact CD1-CE1 3.93Å; W132-H136 AromaticContact CD1-ND1 3.49Å; W132-H136 HydrophobicContact CD2-CB 3.95Å; W132-H136 AromaticContact CE2-CG 3.75Å; W132-H136 AromaticContact CE2-ND1 3.93Å; W132-H136 HydrophobicContact CE3-CB 4.26Å; W132-H136 AromaticContact CG-ND1 3.9Å; W132-H136 HydrophobicContact CH2-CB 3.93Å; W132-H136 HydrophobicContact CZ2-CB 3.59Å; W132-H136 HydrophobicContact CZ3-CB 4.24Å; W132-H136 AromaticContact NE1-CE1 3.95Å; W132-H136 AromaticContact NE1-CG 3.64Å; W132-H136 AromaticContact NE1-ND1 3.5Å; W132-H136 WeakPolarHBondContact O-CB 3.46Å; W132-H136 PolarHBondContact O-N 3.13Å; W132-H136 PolarHBondContact O-ND1 3.43Å; W132-L141 HydrophobicContact CH2-CD2 4.5Å |
| 133 | A | 88.2 | Confident | 89.1 | Confident | 12 Ų | 12 | 77.9 Ų | 77.9 | 10% | 0.099 | 39% | 0.393 | C | S | . | . | H | α-helix | trans | -58.4 | -43.5 | 177.4 | 0 | 0 | 0 | 0 | 0 | 111.2 | H129 P130 N135 R137 | H129-A133 PolarHBondContact O-N 2.91Å; P130-A133 PolarHBondContact O-N 3.49Å; A133-N135 VanDerWaalsContact C-N 3.29Å; A133-N135 PolarHBondContact O-N 2.99Å; A133-R137 HydrophobicContact CB-CB 4.44Å; A133-R137 WeakPolarHBondContact O-CB 3.39Å; A133-R137 PolarHBondContact O-N 2.63Å |
| 134 | Q | 85.9 | Confident | 89.5 | Confident | 165 Ų | 165 | 80.3 Ų | 80.3 | 77% | 0.771 | 41% | 0.406 | S | S | * | . | H | α-helix | trans | -62.3 | -35.7 | 178.1 | -171.7 | 170.3 | -1.5 | 0 | 0 | 113.2 | P130 V131 W132 | P130-Q134 WeakPolarHBondContact O-CB 3.26Å; P130-Q134 PolarHBondContact O-N 2.88Å; V131-Q134 PolarHBondContact O-N 3.41Å; W132-Q134 VanDerWaalsContact C-N 3.31Å; W132-Q134 PolarHBondContact O-N 3.32Å |
| 135 | N | 90.5 | Very high | 89.8 | Confident | 109 Ų | 109 | 82.9 Ų | 82.9 | 58% | 0.583 | 42% | 0.421 | S | S | * | . | H | α-helix | trans | -91.7 | -28.8 | -173.9 | -67.3 | -14.6 | 0 | 0 | 0 | 114.2 | V131 W132 A133 | V131-N135 PolarHBondContact O-N 3.4Å; W132-N135 PolarHBondContact O-N 2.89Å; W132-N135 VanDerWaalsContact O-N 3.16Å; A133-N135 VanDerWaalsContact C-N 3.29Å; A133-N135 PolarHBondContact O-N 2.99Å |
| 136 | H | 90.6 | Very high | 90 | Very high | 95 Ų | 95 | 80.4 Ų | 80.4 | 44% | 0.44 | 41% | 0.409 | S | S | . | . | H | α-helix | trans | -119.7 | -18.5 | -170.9 | -61.7 | 85.9 | 0 | 0 | 0 | 114.4 | W132 T138 | W132-H136 AromaticContact CD1-CE1 3.93Å; W132-H136 AromaticContact CD1-ND1 3.49Å; W132-H136 HydrophobicContact CD2-CB 3.95Å; W132-H136 AromaticContact CE2-CG 3.75Å; W132-H136 AromaticContact CE2-ND1 3.93Å; W132-H136 HydrophobicContact CE3-CB 4.26Å; W132-H136 AromaticContact CG-ND1 3.9Å; W132-H136 HydrophobicContact CH2-CB 3.93Å; W132-H136 HydrophobicContact CZ2-CB 3.59Å; W132-H136 HydrophobicContact CZ3-CB 4.24Å; W132-H136 AromaticContact NE1-CE1 3.95Å; W132-H136 AromaticContact NE1-CG 3.64Å; W132-H136 AromaticContact NE1-ND1 3.5Å; W132-H136 WeakPolarHBondContact O-CB 3.46Å; W132-H136 PolarHBondContact O-N 3.13Å; W132-H136 PolarHBondContact O-ND1 3.43Å; H136-T138 VanDerWaalsContact C-N 3.27Å; H136-T138 PolarHBondContact O-N 3.43Å |
| 137 | R | 89.5 | Confident | 90.4 | Very high | 78 Ų | 78 | 83 Ų | 83 | 29% | 0.294 | 42% | 0.42 | S | S | . | . | trans | -76.6 | 78 | -178.8 | -170.8 | -178.2 | 172.7 | -111.5 | 5.3 | 110.8 | V59 T60 D122 C126 A133 | V59-R137 HydrophobicContact CB-CG 4.48Å; V59-R137 HydrophobicContact CG1-CG 4.46Å; V59-R137 HydrophobicContact CG2-CG 3.95Å; T60-R137 PolarHBondContact OG1-NH2 3.39Å; D122-R137 IonicContact OD1-CZ 3.66Å; D122-R137 IonicContact OD1-NE 2.8Å; D122-R137 PolarHBondContact OD1-NE 3.42Å; D122-R137 IonicContact OD1-NH2 3.62Å; D122-R137 IonicContact OD2-CZ 3.59Å; D122-R137 IonicContact OD2-NE 3.48Å; D122-R137 PolarHBondContact OD2-NE 3.17Å; D122-R137 IonicContact OD2-NH2 2.83Å; D122-R137 PolarHBondContact OD2-NH2 3.03Å; C126-R137 VanDerWaalsContact SG-CD 3.57Å; C126-R137 PolarHBondContact SG-NE 3.26Å; C126-R137 VanDerWaalsContact SG-NE 3.42Å; A133-R137 HydrophobicContact CB-CB 4.44Å; A133-R137 WeakPolarHBondContact O-CB 3.39Å; A133-R137 PolarHBondContact O-N 2.63Å | ||
| 138 | T | 91.8 | Very high | 90.8 | Very high | 70 Ų | 70 | 82.1 Ų | 82.1 | 43% | 0.429 | 42% | 0.422 | S | S | . | . | trans | -99 | 155.2 | 179.4 | 65.4 | 0 | 0 | 0 | 0 | 112.1 | H136 S140 L141 A142 | H136-T138 VanDerWaalsContact C-N 3.27Å; H136-T138 PolarHBondContact O-N 3.43Å; T138-S140 VanDerWaalsContact C-N 3.27Å; T138-S140 PolarHBondContact O-N 3.23Å; T138-L141 PolarHBondContact O-N 3.48Å; T138-L141 WeakPolarHBondContact OG1-CB 3.19Å; T138-L141 PolarHBondContact OG1-N 3.35Å; T138-A142 PolarHBondContact O-N 2.92Å; T138-A142 VanDerWaalsContact O-N 3.09Å | ||
| 139 | V | 90.3 | Very high | 91.2 | Very high | 64 Ų | 64 | 80.9 Ų | 80.9 | 39% | 0.388 | 42% | 0.417 | S | S | . | . | H | α-helix | trans | -61.2 | -36.7 | 174.5 | 169.9 | 0 | 0 | 0 | 0 | 111.8 | H57 I62 A142 R143 | H57-V139 WeakPolarHBondContact O-CG2 3.46Å; I62-V139 HydrophobicContact CD1-CG1 3.63Å; V139-A142 PolarHBondContact O-N 3.14Å; V139-R143 PolarHBondContact O-N 3.4Å |
| 140 | S | 91.5 | Very high | 91.4 | Very high | 75 Ų | 75 | 78.3 Ų | 78.3 | 52% | 0.524 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -63 | -44.3 | 176.6 | -177 | 0 | 0 | 0 | 0 | 111.8 | T138 R143 K144 | T138-S140 VanDerWaalsContact C-N 3.27Å; T138-S140 PolarHBondContact O-N 3.23Å; S140-R143 PolarHBondContact O-N 2.82Å; S140-K144 WeakPolarHBondContact O-CG 3.34Å; S140-K144 PolarHBondContact O-N 3.49Å |
| 141 | L | 91.3 | Very high | 91.9 | Very high | 72 Ų | 72 | 79.6 Ų | 79.6 | 38% | 0.377 | 41% | 0.405 | S | S | . | . | H | α-helix | trans | -62.5 | -45.4 | 175.4 | -178.8 | 60.8 | 0 | 0 | 0 | 111.2 | W132 T138 R143 K144 V145 | W132-L141 HydrophobicContact CH2-CD2 4.5Å; T138-L141 PolarHBondContact O-N 3.48Å; T138-L141 WeakPolarHBondContact OG1-CB 3.19Å; T138-L141 PolarHBondContact OG1-N 3.35Å; L141-R143 VanDerWaalsContact C-N 3.33Å; L141-R143 PolarHBondContact O-N 2.89Å; L141-K144 PolarHBondContact O-N 3.02Å; L141-K144 VanDerWaalsContact O-N 3.08Å; L141-V145 HydrophobicContact CD1-CG2 3.95Å; L141-V145 HydrophobicContact CG-CG2 4.14Å; L141-V145 WeakPolarHBondContact O-CG2 3.35Å; L141-V145 PolarHBondContact O-N 3.38Å |
| 142 | A | 89.8 | Confident | 92.1 | Very high | 11 Ų | 11 | 78 Ų | 78 | 9% | 0.091 | 39% | 0.393 | C | S | . | . | H | α-helix | trans | -58.7 | -42.6 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | V59 T138 V139 K144 V145 V146 | V59-A142 HydrophobicContact CB-CB 4Å; V59-A142 HydrophobicContact CG1-CB 3.71Å; V59-A142 HydrophobicContact CG2-CB 3.72Å; T138-A142 PolarHBondContact O-N 2.92Å; T138-A142 VanDerWaalsContact O-N 3.09Å; V139-A142 PolarHBondContact O-N 3.14Å; A142-K144 VanDerWaalsContact C-N 3.26Å; A142-K144 PolarHBondContact O-N 3.48Å; A142-V145 PolarHBondContact O-N 2.96Å; A142-V146 WeakPolarHBondContact O-CB 3.46Å; A142-V146 PolarHBondContact O-N 3.31Å |
| 143 | R | 90.6 | Very high | 92.1 | Very high | 186 Ų | 186 | 72.6 Ų | 72.6 | 70% | 0.702 | 37% | 0.372 | S | S | * | . | H | α-helix | trans | -63.1 | -30.6 | 176.6 | -170.1 | 175.9 | -177.9 | 175.6 | 1.1 | 112.8 | V139 S140 L141 V146 I147 | V139-R143 PolarHBondContact O-N 3.4Å; S140-R143 PolarHBondContact O-N 2.82Å; L141-R143 VanDerWaalsContact C-N 3.33Å; L141-R143 PolarHBondContact O-N 2.89Å; R143-V146 WeakPolarHBondContact O-CG1 3.16Å; R143-I147 WeakPolarHBondContact O-CG1 3.47Å |
| 144 | K | 93.3 | Very high | 92.4 | Very high | 145 Ų | 145 | 76.3 Ų | 76.3 | 63% | 0.63 | 39% | 0.39 | S | S | * | . | H | α-helix | trans | -77 | -46 | 174.3 | -67.1 | 175.7 | -175.8 | -178.8 | 0 | 111.5 | S140 L141 A142 V146 I147 | S140-K144 WeakPolarHBondContact O-CG 3.34Å; S140-K144 PolarHBondContact O-N 3.49Å; L141-K144 PolarHBondContact O-N 3.02Å; L141-K144 VanDerWaalsContact O-N 3.08Å; A142-K144 VanDerWaalsContact C-N 3.26Å; A142-K144 PolarHBondContact O-N 3.48Å; K144-V146 VanDerWaalsContact C-N 3.32Å; K144-V146 PolarHBondContact O-N 2.92Å; K144-I147 WeakPolarHBondContact O-CB 3.44Å; K144-I147 PolarHBondContact O-N 3.24Å |
| 145 | V | 93.6 | Very high | 92.8 | Very high | 66 Ų | 66 | 72.8 Ų | 72.8 | 40% | 0.4 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -64.4 | -36.3 | -177.1 | 174 | 0 | 0 | 0 | 0 | 111.7 | L118 L141 A142 I147 G148 P149 | L118-V145 HydrophobicContact CD1-CG1 3.64Å; L118-V145 HydrophobicContact CD2-CG1 4.05Å; L141-V145 HydrophobicContact CD1-CG2 3.95Å; L141-V145 HydrophobicContact CG-CG2 4.14Å; L141-V145 WeakPolarHBondContact O-CG2 3.35Å; L141-V145 PolarHBondContact O-N 3.38Å; A142-V145 PolarHBondContact O-N 2.96Å; V145-I147 PolarHBondContact O-N 2.92Å; V145-G148 PolarHBondContact O-N 3.38Å; V145-G148 VanDerWaalsContact O-N 3.12Å; V145-P149 WeakPolarHBondContact O-CD 3.46Å |
| 146 | V | 93.3 | Very high | 92.9 | Very high | 8 Ų | 8 | 68.9 Ų | 68.9 | 5% | 0.048 | 35% | 0.354 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -65.7 | -23.3 | -179.5 | 82 | 0 | 0 | 0 | 0 | 113.4 | N66 L115 A142 R143 K144 G148 P149 W150 | N66-V146 HydrophobicContact CB-CG2 3.85Å; L115-V146 HydrophobicContact CD2-CG2 3.56Å; A142-V146 WeakPolarHBondContact O-CB 3.46Å; A142-V146 PolarHBondContact O-N 3.31Å; R143-V146 WeakPolarHBondContact O-CG1 3.16Å; K144-V146 VanDerWaalsContact C-N 3.32Å; K144-V146 PolarHBondContact O-N 2.92Å; V146-G148 VanDerWaalsContact C-N 3.27Å; V146-G148 PolarHBondContact O-N 3.39Å; V146-P149 WeakPolarHBondContact O-CD 3.23Å; V146-W150 VanDerWaalsContact O-CD1 3.22Å |
| 147 | I | 94.6 | Very high | 93 | Very high | 89 Ų | 89 | 64.7 Ų | 64.7 | 46% | 0.456 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -67.3 | -31.5 | 176.4 | -62.5 | 168.4 | 0 | 0 | 0 | 110.8 | R143 K144 V145 W150 I151 | R143-I147 WeakPolarHBondContact O-CG1 3.47Å; K144-I147 WeakPolarHBondContact O-CB 3.44Å; K144-I147 PolarHBondContact O-N 3.24Å; V145-I147 PolarHBondContact O-N 2.92Å; I147-W150 PolarHBondContact O-N 2.92Å; I147-I151 HydrophobicContact CG2-CD1 3.6Å; I147-I151 HydrophobicContact CG2-CG1 3.98Å; I147-I151 WeakPolarHBondContact O-CG1 3.39Å; I147-I151 PolarHBondContact O-N 3.15Å |
| 148 | G | 94.9 | Very high | 93.2 | Very high | 38 Ų | 38 | 65.2 Ų | 65.2 | 39% | 0.392 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -55.9 | -55.9 | -179.8 | 0 | 0 | 0 | 0 | 0 | 113.5 | V145 V146 W150 I151 L152 | V145-G148 PolarHBondContact O-N 3.38Å; V145-G148 VanDerWaalsContact O-N 3.12Å; V146-G148 VanDerWaalsContact C-N 3.27Å; V146-G148 PolarHBondContact O-N 3.39Å; G148-W150 VanDerWaalsContact C-N 3.28Å; G148-W150 PolarHBondContact O-N 2.82Å; G148-I151 PolarHBondContact O-N 3.41Å; G148-L152 WeakPolarHBondContact O-CB 3.14Å; G148-L152 PolarHBondContact O-N 3.5Å |
| 149 | P | 94.5 | Very high | 93.1 | Very high | 19 Ų | 19 | 63.5 Ų | 63.5 | 12% | 0.123 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -50.6 | -42 | 173.1 | -33.2 | 37 | 0 | 0 | 0 | 114.7 | F114 L115 L118 V145 V146 L152 A153 | F114-P149 HydrophobicContact CB-CB 3.81Å; F114-P149 HydrophobicContact CB-CG 4.32Å; F114-P149 HydrophobicContact CD2-CB 4.49Å; L115-P149 HydrophobicContact CD2-CB 4.4Å; L115-P149 HydrophobicContact CD2-CG 4.5Å; L118-P149 HydrophobicContact CD2-CG 4.27Å; V145-P149 WeakPolarHBondContact O-CD 3.46Å; V146-P149 WeakPolarHBondContact O-CD 3.23Å; P149-L152 PolarHBondContact O-N 2.94Å; P149-A153 VanDerWaalsContact O-CB 3.3Å; P149-A153 WeakPolarHBondContact O-CB 3.5Å; P149-A153 PolarHBondContact O-N 3.28Å |
| 150 | W | 95.3 | Very high | 93.1 | Very high | 63 Ų | 63 | 60.6 Ų | 60.6 | 24% | 0.239 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -66.9 | -45.8 | 178.7 | -74.4 | 107.4 | 0 | 0 | 0 | 112.3 | N66 A70 I107 V146 I147 G148 L152 A153 L154 | N66-W150 PolarHBondContact OD1-NE1 3.48Å; A70-W150 HydrophobicContact CB-CH2 3.91Å; A70-W150 HydrophobicContact CB-CZ2 4.29Å; I107-W150 HydrophobicContact CG2-CE3 3.98Å; I107-W150 HydrophobicContact CG2-CZ3 3.65Å; V146-W150 VanDerWaalsContact O-CD1 3.22Å; I147-W150 PolarHBondContact O-N 2.92Å; G148-W150 VanDerWaalsContact C-N 3.28Å; G148-W150 PolarHBondContact O-N 2.82Å; W150-L152 VanDerWaalsContact C-N 3.32Å; W150-L152 PolarHBondContact O-N 2.73Å; W150-A153 PolarHBondContact O-N 3.37Å; W150-L154 VanDerWaalsContact O-CG 3.31Å; W150-L154 WeakPolarHBondContact O-CG 3.08Å; W150-L154 PolarHBondContact O-N 3.45Å |
| 151 | I | 95.8 | Very high | 93.1 | Very high | 89 Ų | 89 | 62.6 Ų | 62.6 | 46% | 0.456 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -60.6 | -45.6 | 175.9 | -67.6 | 174.9 | 0 | 0 | 0 | 110.1 | I147 G148 A153 L154 I155 | I147-I151 HydrophobicContact CG2-CD1 3.6Å; I147-I151 HydrophobicContact CG2-CG1 3.98Å; I147-I151 WeakPolarHBondContact O-CG1 3.39Å; I147-I151 PolarHBondContact O-N 3.15Å; G148-I151 PolarHBondContact O-N 3.41Å; I151-A153 PolarHBondContact O-N 3.13Å; I151-L154 PolarHBondContact O-N 3.06Å; I151-I155 HydrophobicContact CG2-CD1 3.85Å; I151-I155 HydrophobicContact CG2-CG1 4.47Å; I151-I155 WeakPolarHBondContact O-CG1 2.98Å; I151-I155 PolarHBondContact O-N 2.91Å |
| 152 | L | 94.8 | Very high | 93 | Very high | 70 Ų | 70 | 63.8 Ų | 63.8 | 37% | 0.366 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -63.3 | -43.4 | 179.5 | -174.2 | 60.3 | 0 | 0 | 0 | 111.4 | F114 G148 P149 W150 L154 I155 L156 | F114-L152 HydrophobicContact CD2-CB 4.43Å; F114-L152 HydrophobicContact CD2-CD2 4.15Å; F114-L152 HydrophobicContact CD2-CG 4.4Å; F114-L152 HydrophobicContact CE1-CD2 4.32Å; F114-L152 HydrophobicContact CE2-CB 4.04Å; F114-L152 HydrophobicContact CE2-CD2 3.58Å; F114-L152 HydrophobicContact CE2-CG 3.63Å; F114-L152 HydrophobicContact CZ-CD2 3.69Å; F114-L152 HydrophobicContact CZ-CG 4.03Å; G148-L152 WeakPolarHBondContact O-CB 3.14Å; G148-L152 PolarHBondContact O-N 3.5Å; P149-L152 PolarHBondContact O-N 2.94Å; W150-L152 VanDerWaalsContact C-N 3.32Å; W150-L152 PolarHBondContact O-N 2.73Å; L152-L154 VanDerWaalsContact C-N 3.35Å; L152-L154 PolarHBondContact O-N 3.37Å; L152-I155 PolarHBondContact O-N 2.66Å; L152-L156 HydrophobicContact CD1-CD1 4.34Å; L152-L156 HydrophobicContact CD1-CG 4.41Å; L152-L156 HydrophobicContact CG-CD1 4.05Å; L152-L156 VanDerWaalsContact O-CG 3.23Å; L152-L156 WeakPolarHBondContact O-CG 3.23Å; L152-L156 PolarHBondContact O-N 3.08Å |
| 153 | A | 94.6 | Very high | 93 | Very high | 0 Ų | 0 | 64.6 Ų | 64.6 | 0% | 0 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -58.6 | -46.1 | 174.5 | 0 | 0 | 0 | 0 | 0 | 111.5 | I107 F110 P149 W150 I151 I155 L156 T157 | I107-A153 HydrophobicContact CG2-CB 4.48Å; F110-A153 HydrophobicContact CB-CB 3.73Å; P149-A153 VanDerWaalsContact O-CB 3.3Å; P149-A153 WeakPolarHBondContact O-CB 3.5Å; P149-A153 PolarHBondContact O-N 3.28Å; W150-A153 PolarHBondContact O-N 3.37Å; I151-A153 PolarHBondContact O-N 3.13Å; A153-I155 PolarHBondContact O-N 2.74Å; A153-L156 PolarHBondContact O-N 3.28Å; A153-T157 WeakPolarHBondContact O-CG2 3.11Å; A153-T157 PolarHBondContact O-N 3.06Å; A153-T157 PolarHBondContact O-OG1 3.47Å |
| 154 | L | 93.9 | Very high | 93.2 | Very high | 90 Ų | 90 | 56 Ų | 56 | 47% | 0.471 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -58.8 | -46 | 177.1 | -74.1 | 167.8 | 0 | 0 | 0 | 112.1 | I107 W150 I151 L152 L156 T157 L158 | I107-L154 HydrophobicContact CD1-CD2 3.57Å; I107-L154 HydrophobicContact CG1-CD2 4.22Å; W150-L154 VanDerWaalsContact O-CG 3.31Å; W150-L154 WeakPolarHBondContact O-CG 3.08Å; W150-L154 PolarHBondContact O-N 3.45Å; I151-L154 PolarHBondContact O-N 3.06Å; L152-L154 VanDerWaalsContact C-N 3.35Å; L152-L154 PolarHBondContact O-N 3.37Å; L154-L156 VanDerWaalsContact C-N 3.33Å; L154-L156 PolarHBondContact O-N 3.42Å; L154-T157 WeakPolarHBondContact CA-OG1 3.3Å; L154-T157 PolarHBondContact O-N 2.94Å; L154-T157 VanDerWaalsContact O-N 3.15Å; L154-T157 PolarHBondContact O-OG1 2.71Å; L154-L158 PolarHBondContact O-N 3.13Å |
| 155 | I | 94.6 | Very high | 93.2 | Very high | 92 Ų | 92 | 50.5 Ų | 50.5 | 47% | 0.472 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -59.9 | -45 | 176.9 | -68.4 | 167.2 | 0 | 0 | 0 | 110.7 | I151 L152 A153 T157 L158 | I151-I155 HydrophobicContact CG2-CD1 3.85Å; I151-I155 HydrophobicContact CG2-CG1 4.47Å; I151-I155 WeakPolarHBondContact O-CG1 2.98Å; I151-I155 PolarHBondContact O-N 2.91Å; L152-I155 PolarHBondContact O-N 2.66Å; A153-I155 PolarHBondContact O-N 2.74Å; I155-T157 PolarHBondContact O-N 3.09Å; I155-L158 HydrophobicContact CG2-CD1 4.38Å; I155-L158 VanDerWaalsContact O-CB 3.32Å; I155-L158 WeakPolarHBondContact O-CB 3.42Å; I155-L158 WeakPolarHBondContact O-CD1 3.36Å; I155-L158 WeakPolarHBondContact O-CG 3.45Å; I155-L158 PolarHBondContact O-N 3.05Å |
| 156 | L | 93.2 | Very high | 93.3 | Very high | 27 Ų | 27 | 49.1 Ų | 49.1 | 14% | 0.141 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -69 | -20.2 | -179.8 | -64.6 | 172 | 0 | 0 | 0 | 113.1 | F110 F114 L152 A153 L154 P159 I204 I208 | F110-L156 HydrophobicContact CD1-CD1 3.65Å; F110-L156 HydrophobicContact CD2-CB 3.77Å; F110-L156 HydrophobicContact CD2-CD1 4.33Å; F110-L156 HydrophobicContact CE1-CB 4.4Å; F110-L156 HydrophobicContact CE1-CD1 3.81Å; F110-L156 HydrophobicContact CE2-CB 3.65Å; F110-L156 HydrophobicContact CE2-CD1 4.48Å; F110-L156 HydrophobicContact CG-CB 4.21Å; F110-L156 HydrophobicContact CG-CD1 3.93Å; F110-L156 HydrophobicContact CZ-CB 3.98Å; F110-L156 HydrophobicContact CZ-CD1 4.23Å; F114-L156 HydrophobicContact CE2-CD1 3.87Å; F114-L156 HydrophobicContact CZ-CD1 3.61Å; L152-L156 HydrophobicContact CD1-CD1 4.34Å; L152-L156 HydrophobicContact CD1-CG 4.41Å; L152-L156 HydrophobicContact CG-CD1 4.05Å; L152-L156 VanDerWaalsContact O-CG 3.23Å; L152-L156 WeakPolarHBondContact O-CG 3.23Å; L152-L156 PolarHBondContact O-N 3.08Å; A153-L156 PolarHBondContact O-N 3.28Å; L154-L156 VanDerWaalsContact C-N 3.33Å; L154-L156 PolarHBondContact O-N 3.42Å; L156-P159 WeakPolarHBondContact O-CD 3.34Å; L156-I204 HydrophobicContact CD2-CG2 3.7Å; L156-I208 HydrophobicContact CD1-CG2 3.89Å; L156-I208 HydrophobicContact CD2-CD1 4.24Å |
| 157 | T | 92.9 | Very high | 93.3 | Very high | 6 Ų | 6 | 50.7 Ų | 50.7 | 4% | 0.037 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -84.7 | -7.2 | 174.8 | 64.5 | 0 | 0 | 0 | 0 | 114.7 | D106 I107 F110 A153 L154 I155 P159 I160 F161 | D106-T157 HydrophobicContact CB-CG2 3.5Å; I107-T157 HydrophobicContact CB-CG2 4.37Å; I107-T157 HydrophobicContact CG1-CG2 3.55Å; F110-T157 HydrophobicContact CD2-CG2 4.47Å; A153-T157 WeakPolarHBondContact O-CG2 3.11Å; A153-T157 PolarHBondContact O-N 3.06Å; A153-T157 PolarHBondContact O-OG1 3.47Å; L154-T157 WeakPolarHBondContact CA-OG1 3.3Å; L154-T157 PolarHBondContact O-N 2.94Å; L154-T157 VanDerWaalsContact O-N 3.15Å; L154-T157 PolarHBondContact O-OG1 2.71Å; I155-T157 PolarHBondContact O-N 3.09Å; T157-P159 VanDerWaalsContact C-N 3.3Å; T157-I160 WeakPolarHBondContact O-CB 3.32Å; T157-I160 PolarHBondContact O-N 3.25Å; T157-F161 PolarHBondContact O-N 3.37Å |
| 158 | L | 91.9 | Very high | 93.2 | Very high | 89 Ų | 89 | 55.7 Ų | 55.7 | 47% | 0.466 | 28% | 0.284 | S | S | . | . | H | α-helix | trans | -51.6 | -39.3 | 179.3 | -71.4 | 172.8 | 0 | 0 | 0 | 114.2 | L154 I155 I160 F161 L162 | L154-L158 PolarHBondContact O-N 3.13Å; I155-L158 HydrophobicContact CG2-CD1 4.38Å; I155-L158 VanDerWaalsContact O-CB 3.32Å; I155-L158 WeakPolarHBondContact O-CB 3.42Å; I155-L158 WeakPolarHBondContact O-CD1 3.36Å; I155-L158 WeakPolarHBondContact O-CG 3.45Å; I155-L158 PolarHBondContact O-N 3.05Å; L158-I160 VanDerWaalsContact C-N 3.3Å; L158-I160 PolarHBondContact O-N 3.35Å; L158-F161 WeakPolarHBondContact O-CB 3.24Å; L158-F161 PolarHBondContact O-N 2.82Å; L158-F161 VanDerWaalsContact O-N 3.09Å; L158-L162 WeakPolarHBondContact O-CG 3.44Å; L158-L162 PolarHBondContact O-N 3.43Å |
| 159 | P | 90.1 | Very high | 93 | Very high | 35 Ų | 35 | 56.4 Ų | 56.4 | 23% | 0.227 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -61.3 | -34.4 | 176.6 | -24.3 | 35.5 | 0 | 0 | 0 | 113.6 | L156 T157 F163 M197 | L156-P159 WeakPolarHBondContact O-CD 3.34Å; T157-P159 VanDerWaalsContact C-N 3.3Å; P159-F163 HydrophobicContact CB-CD2 4.34Å; P159-F163 WeakPolarHBondContact O-CB 3.21Å; P159-F163 VanDerWaalsContact O-CD2 3.29Å; P159-F163 WeakPolarHBondContact O-CD2 3.37Å; P159-F163 PolarHBondContact O-N 2.91Å; P159-M197 HydrophobicContact CB-SD 4Å |
| 160 | I | 90.6 | Very high | 92.5 | Very high | 2 Ų | 2 | 62.1 Ų | 62.1 | 1% | 0.01 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -63.9 | -48.7 | 172.1 | -71.6 | -63 | 0 | 0 | 0 | 110.1 | H102 I103 D106 T157 L158 L162 L164 F178 R201 | H102-I160 HydrophobicContact CB-CG2 4.11Å; I103-I160 HydrophobicContact CG1-CB 4.4Å; I103-I160 HydrophobicContact CG1-CG2 3.56Å; D106-I160 WeakPolarHBondContact OD2-CG1 3.22Å; T157-I160 WeakPolarHBondContact O-CB 3.32Å; T157-I160 PolarHBondContact O-N 3.25Å; L158-I160 VanDerWaalsContact C-N 3.3Å; L158-I160 PolarHBondContact O-N 3.35Å; I160-L162 PolarHBondContact O-N 3.44Å; I160-L164 HydrophobicContact CD1-CB 4.36Å; I160-L164 HydrophobicContact CD1-CD2 4.31Å; I160-L164 HydrophobicContact CG2-CB 4.04Å; I160-L164 HydrophobicContact CG2-CD2 3.88Å; I160-L164 WeakPolarHBondContact O-CB 3.43Å; I160-L164 PolarHBondContact O-N 2.73Å; I160-F178 HydrophobicContact CD1-CE1 3.95Å; I160-F178 HydrophobicContact CD1-CZ 3.63Å; I160-R201 VanDerWaalsContact CG1-NH1 3.28Å |
| 161 | F | 90.9 | Very high | 92 | Very high | 118 Ų | 118 | 62.8 Ų | 62.8 | 52% | 0.518 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -57.2 | -41.2 | -175.5 | -177.4 | -96.9 | 0 | 0 | 0 | 111.8 | K99 I103 T157 L158 | K99-F161 PolarHBondContact NZ-O 3.39Å; I103-F161 HydrophobicContact CD1-CB 4.44Å; I103-F161 HydrophobicContact CD1-CD2 3.84Å; T157-F161 PolarHBondContact O-N 3.37Å; L158-F161 WeakPolarHBondContact O-CB 3.24Å; L158-F161 PolarHBondContact O-N 2.82Å; L158-F161 VanDerWaalsContact O-N 3.09Å |
| 162 | L | 90.5 | Very high | 91.7 | Very high | 97 Ų | 97 | 60.9 Ų | 60.9 | 51% | 0.508 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -80.9 | -49.2 | -177.9 | -62.7 | 174.3 | 0 | 0 | 0 | 113.2 | L158 I160 | L158-L162 WeakPolarHBondContact O-CG 3.44Å; L158-L162 PolarHBondContact O-N 3.43Å; I160-L162 PolarHBondContact O-N 3.44Å |
| 163 | F | 90.1 | Very high | 91.6 | Very high | 27 Ų | 27 | 60.1 Ų | 60.1 | 12% | 0.118 | 34% | 0.343 | C | S | . | . | H | α-helix | trans | -100.1 | -21.3 | -164.9 | -62 | -85.7 | 0 | 0 | 0 | 114.6 | P159 F178 N179 F180 W183 M197 | P159-F163 HydrophobicContact CB-CD2 4.34Å; P159-F163 WeakPolarHBondContact O-CB 3.21Å; P159-F163 VanDerWaalsContact O-CD2 3.29Å; P159-F163 WeakPolarHBondContact O-CD2 3.37Å; P159-F163 PolarHBondContact O-N 2.91Å; F163-F178 HydrophobicContact CB-CD1 3.67Å; F163-F178 HydrophobicContact CB-CE1 4.23Å; F163-F178 WeakPolarHBondContact O-CA 3.33Å; F163-N179 PolarHBondContact O-N 3Å; F163-F180 HydrophobicContact CD1-CD1 4.03Å; F163-F180 AromaticContact CD1-CE1 3.82Å; F163-F180 HydrophobicContact CD1-CE1 3.82Å; F163-F180 HydrophobicContact CE1-CD1 4.38Å; F163-F180 HydrophobicContact CE1-CE1 4.28Å; F163-F180 HydrophobicContact CG-CE1 4.43Å; F163-W183 HydrophobicContact CD1-CD2 4.3Å; F163-W183 AromaticContact CD1-CE2 3.79Å; F163-W183 HydrophobicContact CD1-CZ2 4.11Å; F163-W183 AromaticContact CD1-NE1 3.71Å; F163-W183 AromaticContact CE1-CD2 3.52Å; F163-W183 HydrophobicContact CE1-CD2 3.52Å; F163-W183 AromaticContact CE1-CE2 3.28Å; F163-W183 AromaticContact CE1-CE3 3.9Å; F163-W183 HydrophobicContact CE1-CE3 3.9Å; F163-W183 HydrophobicContact CE1-CG 4.04Å; F163-W183 AromaticContact CE1-CH2 3.88Å; F163-W183 HydrophobicContact CE1-CH2 3.88Å; F163-W183 AromaticContact CE1-CZ2 3.49Å; F163-W183 HydrophobicContact CE1-CZ2 3.49Å; F163-W183 VanDerWaalsContact CE1-CZ2 3.49Å; F163-W183 HydrophobicContact CE1-CZ3 4.07Å; F163-W183 AromaticContact CE1-NE1 3.67Å; F163-W183 HydrophobicContact CZ-CD2 4.28Å; F163-W183 HydrophobicContact CZ-CE3 4.26Å; F163-W183 AromaticContact CZ-CH2 3.73Å; F163-W183 HydrophobicContact CZ-CH2 3.73Å; F163-W183 AromaticContact CZ-CZ2 3.74Å; F163-W183 HydrophobicContact CZ-CZ2 3.74Å; F163-W183 HydrophobicContact CZ-CZ3 4Å; F163-M197 HydrophobicContact CB-CE 3.68Å; F163-M197 HydrophobicContact CD1-CE 4.12Å; F163-M197 HydrophobicContact CD2-CE 3.84Å; F163-M197 HydrophobicContact CD2-CG 4.04Å; F163-M197 HydrophobicContact CD2-SD 4.01Å; F163-M197 HydrophobicContact CE1-CG 4.46Å; F163-M197 HydrophobicContact CE2-CG 3.82Å; F163-M197 HydrophobicContact CE2-SD 4.36Å; F163-M197 HydrophobicContact CG-CE 3.63Å; F163-M197 HydrophobicContact CG-CG 4.49Å; F163-M197 HydrophobicContact CG-SD 4.41Å; F163-M197 HydrophobicContact CZ-CG 4.05Å |
| 164 | L | 93.7 | Very high | 91.6 | Very high | 5 Ų | 5 | 61.7 Ų | 61.7 | 3% | 0.026 | 35% | 0.352 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -80.4 | 126.8 | -179.1 | -167.4 | 80 | 0 | 0 | 0 | 110.6 | K99 H102 I160 F178 | K99-L164 WeakPolarHBondContact CE-O 3.39Å; K99-L164 PolarHBondContact NZ-O 2.95Å; H102-L164 HydrophobicContact CB-CD2 3.37Å; H102-L164 VanDerWaalsContact CG-CD2 3.5Å; I160-L164 HydrophobicContact CD1-CB 4.36Å; I160-L164 HydrophobicContact CD1-CD2 4.31Å; I160-L164 HydrophobicContact CG2-CB 4.04Å; I160-L164 HydrophobicContact CG2-CD2 3.88Å; I160-L164 WeakPolarHBondContact O-CB 3.43Å; I160-L164 PolarHBondContact O-N 2.73Å; L164-F178 HydrophobicContact CB-CD1 4.49Å; L164-F178 HydrophobicContact CB-CE1 4.33Å; L164-F178 HydrophobicContact CD1-CD1 4.38Å; L164-F178 HydrophobicContact CD1-CE1 4.29Å; L164-F178 HydrophobicContact CD1-CE2 4.4Å; L164-F178 HydrophobicContact CD1-CZ 4.28Å |
| 165 | T | 94.4 | Very high | 91.6 | Very high | 31 Ų | 31 | 60.9 Ų | 60.9 | 19% | 0.19 | 34% | 0.343 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -149.8 | 170 | 177.6 | -165 | 0 | 0 | 0 | 0 | 111.5 | W95 V167 T177 N179 | W95-T165 PolarHBondContact NE1-OG1 3.44Å; T165-V167 HydrophobicContact CG2-CG2 4.13Å; T165-T177 PolarHBondContact N-O 3.18Å; T165-T177 PolarHBondContact O-N 3.03Å; T165-N179 HydrophobicContact CG2-CB 3.39Å |
| 166 | T | 94.6 | Very high | 91.6 | Very high | 37 Ų | 37 | 57.6 Ų | 57.6 | 23% | 0.227 | 33% | 0.328 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -83.3 | 125 | 171.1 | 50.3 | 0 | 0 | 0 | 0 | 110.3 | W95 C98 V174 Y175 | W95-T166 HydrophobicContact CB-CG2 4.4Å; C98-T166 HydrophobicContact CB-CG2 3.65Å; T166-V174 HydrophobicContact CG2-CG1 4.33Å; T166-Y175 CarbonylContact C-O 3.34Å; T166-Y175 VanDerWaalsContact CA-O 3.27Å; T166-Y175 WeakPolarHBondContact CA-O 3.38Å |
| 167 | V | 93.3 | Very high | 91.5 | Very high | 41 Ų | 41 | 59.5 Ų | 59.5 | 25% | 0.248 | 34% | 0.341 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -112.9 | 130.4 | 176.3 | -178.8 | 0 | 0 | 0 | 0 | 108.4 | T165 V174 Y175 T177 N179 | T165-V167 HydrophobicContact CG2-CG2 4.13Å; V167-V174 WeakPolarHBondContact O-CA 3.45Å; V167-Y175 PolarHBondContact N-O 2.89Å; V167-Y175 PolarHBondContact O-N 3.29Å; V167-T177 HydrophobicContact CB-CG2 4.31Å; V167-T177 HydrophobicContact CG2-CG2 3.95Å; V167-N179 HydrophobicContact CG2-CB 4.03Å |
| 168 | R | 92.9 | Very high | 91.4 | Very high | 193 Ų | 193 | 61.4 Ų | 61.4 | 73% | 0.728 | 35% | 0.349 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -100.1 | 123.9 | 174.3 | -176.1 | 174.1 | -73.7 | -177.9 | -2.2 | 109 | D173 V174 | R168-D173 WeakPolarHBondContact CA-O 3.36Å; R168-V174 HydrophobicContact CB-CG2 4.37Å; R168-V174 HydrophobicContact CG-CG2 4.27Å |
| 169 | V | 90.3 | Very high | 91.3 | Very high | 54 Ų | 54 | 60.1 Ų | 60.1 | 33% | 0.327 | 34% | 0.343 | S | S | . | . | P | Polyproline II helix | trans | -94.6 | 157.5 | 179.5 | -69.3 | 0 | 0 | 0 | 0 | 111.7 | G171 G172 D173 Y175 | V169-G171 PolarHBondContact O-N 3.33Å; V169-G171 VanDerWaalsContact O-N 3.13Å; V169-G172 PolarHBondContact O-N 3.19Å; V169-D173 HydrophobicContact CG2-CB 3.76Å; V169-D173 WeakPolarHBondContact CG2-O 3.36Å; V169-D173 PolarHBondContact N-O 3.29Å; V169-Y175 HydrophobicContact CG1-CD2 4.19Å; V169-Y175 HydrophobicContact CG1-CE2 4.37Å; V169-Y175 HydrophobicContact CG2-CD2 3.98Å; V169-Y175 HydrophobicContact CG2-CE2 3.57Å |
| 170 | P | 83.6 | Confident | 91.1 | Very high | 139 Ų | 139 | 59.5 Ų | 59.5 | 90% | 0.903 | 34% | 0.337 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -55.9 | 117.4 | 170.2 | -22 | 33.5 | 0 | 0 | 0 | 109.8 | ||
| 171 | G | 85 | Confident | 90.7 | Very high | 76 Ų | 76 | 61.8 Ų | 61.8 | 78% | 0.784 | 36% | 0.356 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 122.9 | -10 | -168 | 0 | 0 | 0 | 0 | 0 | 113.9 | V169 D173 | V169-G171 PolarHBondContact O-N 3.33Å; V169-G171 VanDerWaalsContact O-N 3.13Å; G171-D173 VanDerWaalsContact C-N 3.27Å; G171-D173 PolarHBondContact O-N 2.97Å |
| 172 | G | 89.6 | Confident | 90.3 | Very high | 49 Ų | 49 | 61 Ų | 61 | 51% | 0.505 | 37% | 0.365 | S | S | . | . | S | Bend | trans | 87.3 | -9.6 | 174.1 | 0 | 0 | 0 | 0 | 0 | 114.4 | V169 | V169-G172 PolarHBondContact O-N 3.19Š|
| 173 | D | 93.1 | Very high | 89.8 | Confident | 55 Ų | 55 | 62.2 Ų | 62.2 | 29% | 0.294 | 36% | 0.363 | S | S | . | . | trans | -65.8 | 143 | 175.5 | -73 | -30.5 | 0 | 0 | 0 | 111.7 | K90 R168 V169 G171 Y175 | K90-D173 HydrophobicContact CD-CB 4.48Å; K90-D173 VanDerWaalsContact CE-OD1 3.28Å; K90-D173 WeakPolarHBondContact CE-OD1 3.34Å; K90-D173 WeakPolarHBondContact CE-OD2 3.25Å; K90-D173 IonicContact NZ-OD1 3.16Å; K90-D173 PolarHBondContact NZ-OD1 2.99Å; K90-D173 IonicContact NZ-OD2 4Å; K90-D173 PolarHBondContact NZ-OD2 3.21Å; R168-D173 WeakPolarHBondContact CA-O 3.36Å; V169-D173 HydrophobicContact CG2-CB 3.76Å; V169-D173 WeakPolarHBondContact CG2-O 3.36Å; V169-D173 PolarHBondContact N-O 3.29Å; G171-D173 VanDerWaalsContact C-N 3.27Å; G171-D173 PolarHBondContact O-N 2.97Å; D173-Y175 HydrophobicContact CB-CE2 3.77Å | ||
| 174 | V | 94.9 | Very high | 89.6 | Confident | 33 Ų | 33 | 61.7 Ų | 61.7 | 20% | 0.2 | 37% | 0.365 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -119.2 | 131 | -178.6 | -179.9 | 0 | 0 | 0 | 0 | 108.8 | K90 W91 T166 V167 R168 | K90-V174 CarbonylContact C-O 3.51Å; K90-V174 WeakPolarHBondContact CA-O 3.28Å; W91-V174 PolarHBondContact N-O 3.01Å; T166-V174 HydrophobicContact CG2-CG1 4.33Å; V167-V174 WeakPolarHBondContact O-CA 3.45Å; R168-V174 HydrophobicContact CB-CG2 4.37Å; R168-V174 HydrophobicContact CG-CG2 4.27Å |
| 175 | Y | 93.1 | Very high | 89.2 | Confident | 72 Ų | 72 | 68.7 Ų | 68.7 | 28% | 0.282 | 40% | 0.403 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -122 | 145.6 | 179.1 | -65.7 | -87.8 | 0 | 0 | 0 | 110.2 | E89 K90 T166 V167 V169 D173 | E89-Y175 VanDerWaalsContact O-CD1 3.3Å; E89-Y175 WeakPolarHBondContact O-CD1 3.48Å; K90-Y175 HydrophobicContact CG-CE1 4.18Å; T166-Y175 CarbonylContact C-O 3.34Å; T166-Y175 VanDerWaalsContact CA-O 3.27Å; T166-Y175 WeakPolarHBondContact CA-O 3.38Å; V167-Y175 PolarHBondContact N-O 2.89Å; V167-Y175 PolarHBondContact O-N 3.29Å; V169-Y175 HydrophobicContact CG1-CD2 4.19Å; V169-Y175 HydrophobicContact CG1-CE2 4.37Å; V169-Y175 HydrophobicContact CG2-CD2 3.98Å; V169-Y175 HydrophobicContact CG2-CE2 3.57Å; D173-Y175 HydrophobicContact CB-CE2 3.77Å |
| 176 | C | 94.9 | Very high | 89 | Confident | 23 Ų | 23 | 70.5 Ų | 70.5 | 16% | 0.155 | 41% | 0.414 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -99.7 | 98.8 | 172.2 | 178.5 | 0 | 0 | 0 | 0 | 108.3 | W91 C98 H102 | W91-C176 HydrophobicContact CB-CB 3.79Å; W91-C176 HydrophobicContact CD2-CB 3.82Å; W91-C176 HydrophobicContact CE3-CB 4.13Å; W91-C176 HydrophobicContact CG-CB 3.64Å; C98-C176 VanDerWaalsContact CA-SG 3.51Å; C98-C176 HydrophobicContact CB-CB 3.83Å; C98-C176 WeakPolarHBondContact CB-SG 3.48Å; C98-C176 WeakPolarHBondContact SG-CB 3.36Å; C98-C176 CovalentContact SG-SG 2.02Å; C98-C176 PolarHBondContact SG-SG 3.47Å; H102-C176 PolarHBondContact CE1-SG 3.35Å; H102-C176 PolarHBondContact ND1-SG 2.99Å |
| 177 | T | 91.9 | Very high | 88.6 | Confident | 67 Ų | 67 | 74.6 Ų | 74.6 | 41% | 0.411 | 43% | 0.434 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -145.5 | 171.9 | -171.9 | -168.3 | 0 | 0 | 0 | 0 | 111.8 | T165 V167 | T165-T177 PolarHBondContact N-O 3.18Å; T165-T177 PolarHBondContact O-N 3.03Å; V167-T177 HydrophobicContact CB-CG2 4.31Å; V167-T177 HydrophobicContact CG2-CG2 3.95Å |
| 178 | F | 90 | Very high | 88.3 | Confident | 46 Ų | 46 | 78.4 Ų | 78.4 | 20% | 0.202 | 45% | 0.451 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -71.5 | 129.7 | 175 | -66.6 | -75.5 | 0 | 0 | 0 | 110.4 | I160 F163 L164 F180 M197 L198 | I160-F178 HydrophobicContact CD1-CE1 3.95Å; I160-F178 HydrophobicContact CD1-CZ 3.63Å; F163-F178 HydrophobicContact CB-CD1 3.67Å; F163-F178 HydrophobicContact CB-CE1 4.23Å; F163-F178 WeakPolarHBondContact O-CA 3.33Å; L164-F178 HydrophobicContact CB-CD1 4.49Å; L164-F178 HydrophobicContact CB-CE1 4.33Å; L164-F178 HydrophobicContact CD1-CD1 4.38Å; L164-F178 HydrophobicContact CD1-CE1 4.29Å; L164-F178 HydrophobicContact CD1-CE2 4.4Å; L164-F178 HydrophobicContact CD1-CZ 4.28Å; F178-F180 HydrophobicContact CB-CD2 4.48Å; F178-F180 HydrophobicContact CB-CE2 3.58Å; F178-F180 HydrophobicContact CB-CZ 3.83Å; F178-F180 HydrophobicContact CG-CZ 4.46Å; F178-M197 HydrophobicContact CD1-CE 3.73Å; F178-M197 HydrophobicContact CE1-CE 4.05Å; F178-M197 HydrophobicContact CG-CE 4.31Å; F178-L198 HydrophobicContact CD2-CD2 3.81Å; F178-L198 HydrophobicContact CE2-CD2 4.05Å; F178-L198 HydrophobicContact CG-CD2 4.29Å |
| 179 | N | 89.3 | Confident | 88.2 | Confident | 62 Ų | 62 | 73.8 Ų | 73.8 | 33% | 0.332 | 44% | 0.438 | S | S | . | . | trans | -118.9 | 124.4 | 175.7 | -173.9 | 8 | 0 | 0 | 0 | 110.4 | F163 T165 V167 A181 | F163-N179 PolarHBondContact O-N 3Å; T165-N179 HydrophobicContact CG2-CB 3.39Å; V167-N179 HydrophobicContact CG2-CB 4.03Å; N179-A181 VanDerWaalsContact OD1-CB 3.23Å; N179-A181 WeakPolarHBondContact OD1-CB 3.38Å; N179-A181 PolarHBondContact OD1-N 3.4Å | ||
| 180 | F | 87.1 | Confident | 88.1 | Confident | 23 Ų | 23 | 75 Ų | 75 | 10% | 0.101 | 44% | 0.436 | C | S | . | . | trans | -110.7 | 9.6 | 179.9 | -56.3 | -86.4 | 0 | 0 | 0 | 113 | F163 F178 S182 W183 A194 M197 L198 | F163-F180 HydrophobicContact CD1-CD1 4.03Å; F163-F180 AromaticContact CD1-CE1 3.82Å; F163-F180 HydrophobicContact CD1-CE1 3.82Å; F163-F180 HydrophobicContact CE1-CD1 4.38Å; F163-F180 HydrophobicContact CE1-CE1 4.28Å; F163-F180 HydrophobicContact CG-CE1 4.43Å; F178-F180 HydrophobicContact CB-CD2 4.48Å; F178-F180 HydrophobicContact CB-CE2 3.58Å; F178-F180 HydrophobicContact CB-CZ 3.83Å; F178-F180 HydrophobicContact CG-CZ 4.46Å; F180-S182 PolarHBondContact O-N 3.4Å; F180-S182 VanDerWaalsContact O-N 3.12Å; F180-W183 PolarHBondContact O-N 2.85Å; F180-A194 HydrophobicContact CB-CB 4.37Å; F180-A194 HydrophobicContact CD1-CB 4.02Å; F180-A194 HydrophobicContact CD2-CB 3.38Å; F180-A194 HydrophobicContact CE1-CB 4.1Å; F180-A194 HydrophobicContact CE2-CB 3.46Å; F180-A194 VanDerWaalsContact CE2-CB 3.46Å; F180-A194 HydrophobicContact CG-CB 3.65Å; F180-A194 HydrophobicContact CZ-CB 3.82Å; F180-M197 HydrophobicContact CE1-CB 4.13Å; F180-M197 HydrophobicContact CE1-CE 3.36Å; F180-M197 HydrophobicContact CZ-CE 3.29Å; F180-L198 HydrophobicContact CZ-CG 4.27Å | ||
| 181 | A | 81.9 | Confident | 88.3 | Confident | 50 Ų | 50 | 72.1 Ų | 72.1 | 41% | 0.413 | 41% | 0.413 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -56.6 | -30.7 | -177.8 | 0 | 0 | 0 | 0 | 0 | 113.4 | N179 R190 | N179-A181 VanDerWaalsContact OD1-CB 3.23Å; N179-A181 WeakPolarHBondContact OD1-CB 3.38Å; N179-A181 PolarHBondContact OD1-N 3.4Å; A181-R190 PolarHBondContact O-NE 3.31Å; A181-R190 PolarHBondContact O-NH2 3.36Å |
| 182 | S | 81.7 | Confident | 88.5 | Confident | 101 Ų | 101 | 72.5 Ų | 72.5 | 71% | 0.706 | 40% | 0.397 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -91.2 | 5.4 | 179.2 | 62.5 | 0 | 0 | 0 | 0 | 114.6 | F180 | F180-S182 PolarHBondContact O-N 3.4Å; F180-S182 VanDerWaalsContact O-N 3.12Å |
| 183 | W | 81.4 | Confident | 88.5 | Confident | 122 Ų | 122 | 71.7 Ų | 71.7 | 46% | 0.462 | 39% | 0.385 | S | S | . | . | S | Bend | trans | -115.3 | 22.1 | -170 | -68.4 | 86.8 | 0 | 0 | 0 | 113.4 | F163 F180 | F163-W183 HydrophobicContact CD1-CD2 4.3Å; F163-W183 AromaticContact CD1-CE2 3.79Å; F163-W183 HydrophobicContact CD1-CZ2 4.11Å; F163-W183 AromaticContact CD1-NE1 3.71Å; F163-W183 AromaticContact CE1-CD2 3.52Å; F163-W183 HydrophobicContact CE1-CD2 3.52Å; F163-W183 AromaticContact CE1-CE2 3.28Å; F163-W183 AromaticContact CE1-CE3 3.9Å; F163-W183 HydrophobicContact CE1-CE3 3.9Å; F163-W183 HydrophobicContact CE1-CG 4.04Å; F163-W183 AromaticContact CE1-CH2 3.88Å; F163-W183 HydrophobicContact CE1-CH2 3.88Å; F163-W183 AromaticContact CE1-CZ2 3.49Å; F163-W183 HydrophobicContact CE1-CZ2 3.49Å; F163-W183 VanDerWaalsContact CE1-CZ2 3.49Å; F163-W183 HydrophobicContact CE1-CZ3 4.07Å; F163-W183 AromaticContact CE1-NE1 3.67Å; F163-W183 HydrophobicContact CZ-CD2 4.28Å; F163-W183 HydrophobicContact CZ-CE3 4.26Å; F163-W183 AromaticContact CZ-CH2 3.73Å; F163-W183 HydrophobicContact CZ-CH2 3.73Å; F163-W183 AromaticContact CZ-CZ2 3.74Å; F163-W183 HydrophobicContact CZ-CZ2 3.74Å; F163-W183 HydrophobicContact CZ-CZ3 4Å; F180-W183 PolarHBondContact O-N 2.85Å |
| 184 | G | 84.4 | Confident | 88.3 | Confident | 17 Ų | 17 | 69.7 Ų | 69.7 | 18% | 0.175 | 38% | 0.377 | C | S | . | . | trans | 179.3 | 151.7 | 174.3 | 0 | 0 | 0 | 0 | 0 | 110.7 | R190 | G184-R190 PolarHBondContact O-NE 3.3Å; G184-R190 PolarHBondContact O-NH2 3.04Å | ||
| 185 | D | 85.3 | Confident | 88.1 | Confident | 151 Ų | 151 | 69.3 Ų | 69.3 | 81% | 0.807 | 37% | 0.373 | S | S | * | . | S | Bend | trans | -86.5 | -35.5 | 178.5 | -70.4 | -28.9 | 0 | 0 | 0 | 110.6 | E189 | D185-E189 PolarHBondContact N-OE2 3.01Š|
| 186 | T | 90.6 | Very high | 88 | Confident | 70 Ų | 70 | 70.4 Ų | 70.4 | 43% | 0.429 | 39% | 0.388 | S | S | . | . | S | Bend | trans | -99.9 | 153.5 | 175.3 | 66.1 | 0 | 0 | 0 | 0 | 112.5 | M188 E189 R190 | T186-M188 PolarHBondContact O-N 2.88Å; T186-E189 PolarHBondContact N-OE2 3.47Å; T186-E189 PolarHBondContact O-N 3.33Å; T186-E189 WeakPolarHBondContact OG1-CB 3.29Å; T186-E189 WeakPolarHBondContact OG1-CG 3.38Å; T186-E189 PolarHBondContact OG1-N 2.92Å; T186-E189 PolarHBondContact OG1-OE2 3.41Å; T186-R190 WeakPolarHBondContact O-CG 3.45Å; T186-R190 PolarHBondContact O-N 2.92Å; T186-R190 VanDerWaalsContact O-N 3.09Å |
| 187 | D | 86.1 | Confident | 87.8 | Confident | 123 Ų | 123 | 70.5 Ų | 70.5 | 66% | 0.658 | 39% | 0.386 | S | S | * | . | H | α-helix | trans | -62.4 | -31.2 | 177.6 | -66.3 | -33.4 | 0 | 0 | 0 | 112.6 | R190 L191 | D187-R190 IonicContact OD1-NH1 2.79Å; D187-R190 PolarHBondContact OD1-NH1 3.43Å; D187-L191 VanDerWaalsContact O-CB 3.3Å; D187-L191 WeakPolarHBondContact O-CB 3.35Å; D187-L191 PolarHBondContact O-N 3.49Å |
| 188 | M | 87.5 | Confident | 87.7 | Confident | 120 Ų | 120 | 69.3 Ų | 69.3 | 59% | 0.591 | 38% | 0.377 | S | S | * | . | H | α-helix | trans | -66.8 | -42.9 | 175.7 | -172.3 | 63.3 | 68.5 | 0 | 0 | 112 | T186 L191 N192 | T186-M188 PolarHBondContact O-N 2.88Å; M188-L191 PolarHBondContact O-N 3.25Å; M188-N192 WeakPolarHBondContact O-CB 3.32Å; M188-N192 VanDerWaalsContact O-CG 3.25Å; M188-N192 PolarHBondContact O-N 3.1Å; M188-N192 PolarHBondContact O-ND2 3.32Å |
| 189 | E | 89.6 | Confident | 87.8 | Confident | 97 Ų | 97 | 69.1 Ų | 69.1 | 45% | 0.453 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -64.9 | -43.9 | 176.5 | -73.5 | 164.6 | 150.2 | 0 | 0 | 111.6 | D185 T186 L191 N192 A193 | D185-E189 PolarHBondContact N-OE2 3.01Å; T186-E189 PolarHBondContact N-OE2 3.47Å; T186-E189 PolarHBondContact O-N 3.33Å; T186-E189 WeakPolarHBondContact OG1-CB 3.29Å; T186-E189 WeakPolarHBondContact OG1-CG 3.38Å; T186-E189 PolarHBondContact OG1-N 2.92Å; T186-E189 PolarHBondContact OG1-OE2 3.41Å; E189-L191 VanDerWaalsContact C-N 3.34Å; E189-L191 PolarHBondContact O-N 3.33Å; E189-N192 PolarHBondContact O-N 3.48Å; E189-A193 WeakPolarHBondContact O-CB 3.49Å; E189-A193 PolarHBondContact O-N 2.89Å |
| 190 | R | 88.8 | Confident | 88 | Confident | 78 Ų | 78 | 68.3 Ų | 68.3 | 29% | 0.294 | 38% | 0.382 | S | S | . | . | H | α-helix | trans | -60.2 | -44 | 176.2 | -66.5 | 172.8 | -178.7 | 160.1 | 2.8 | 111.6 | A181 G184 T186 D187 A193 A194 | A181-R190 PolarHBondContact O-NE 3.31Å; A181-R190 PolarHBondContact O-NH2 3.36Å; G184-R190 PolarHBondContact O-NE 3.3Å; G184-R190 PolarHBondContact O-NH2 3.04Å; T186-R190 WeakPolarHBondContact O-CG 3.45Å; T186-R190 PolarHBondContact O-N 2.92Å; T186-R190 VanDerWaalsContact O-N 3.09Å; D187-R190 IonicContact OD1-NH1 2.79Å; D187-R190 PolarHBondContact OD1-NH1 3.43Å; R190-A193 PolarHBondContact O-N 2.93Å; R190-A194 WeakPolarHBondContact O-CB 3.33Å; R190-A194 PolarHBondContact O-N 2.9Å |
| 191 | L | 87.4 | Confident | 88.2 | Confident | 80 Ų | 80 | 68.6 Ų | 68.6 | 42% | 0.419 | 38% | 0.382 | S | S | . | . | H | α-helix | trans | -64.2 | -44.2 | 177.5 | -178.2 | 62.8 | 0 | 0 | 0 | 111.5 | D187 M188 E189 A194 I195 L272 | D187-L191 VanDerWaalsContact O-CB 3.3Å; D187-L191 WeakPolarHBondContact O-CB 3.35Å; D187-L191 PolarHBondContact O-N 3.49Å; M188-L191 PolarHBondContact O-N 3.25Å; E189-L191 VanDerWaalsContact C-N 3.34Å; E189-L191 PolarHBondContact O-N 3.33Å; L191-A194 WeakPolarHBondContact O-CB 3.34Å; L191-A194 PolarHBondContact O-N 2.77Å; L191-I195 HydrophobicContact CD1-CD1 3.96Å; L191-I195 HydrophobicContact CD1-CG1 4.29Å; L191-I195 HydrophobicContact CG-CD1 3.85Å; L191-I195 WeakPolarHBondContact O-CB 3.4Å; L191-I195 VanDerWaalsContact O-CG1 3.32Å; L191-I195 WeakPolarHBondContact O-CG1 3.33Å; L191-I195 PolarHBondContact O-N 2.87Å; L191-L272 HydrophobicContact CD1-CD1 4.36Å |
| 192 | N | 89.1 | Confident | 88.6 | Confident | 83 Ų | 83 | 66.7 Ų | 66.7 | 44% | 0.444 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -64.5 | -40.9 | 177.5 | -74.4 | -27.9 | 0 | 0 | 0 | 112.1 | M188 E189 T196 | M188-N192 WeakPolarHBondContact O-CB 3.32Å; M188-N192 VanDerWaalsContact O-CG 3.25Å; M188-N192 PolarHBondContact O-N 3.1Å; M188-N192 PolarHBondContact O-ND2 3.32Å; E189-N192 PolarHBondContact O-N 3.48Å; N192-T196 VanDerWaalsContact O-CB 3.25Å; N192-T196 WeakPolarHBondContact O-CB 3.49Å; N192-T196 PolarHBondContact O-N 3.26Å; N192-T196 PolarHBondContact O-OG1 2.88Å |
| 193 | A | 89.6 | Confident | 89.1 | Confident | 32 Ų | 32 | 65.9 Ų | 65.9 | 26% | 0.264 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -62.2 | -44 | 173.5 | 0 | 0 | 0 | 0 | 0 | 111.3 | E189 R190 T196 M197 | E189-A193 WeakPolarHBondContact O-CB 3.49Å; E189-A193 PolarHBondContact O-N 2.89Å; R190-A193 PolarHBondContact O-N 2.93Å; A193-T196 PolarHBondContact O-N 2.97Å; A193-M197 VanDerWaalsContact O-CB 3.32Å; A193-M197 WeakPolarHBondContact O-CB 3.29Å; A193-M197 PolarHBondContact O-N 2.73Å |
| 194 | A | 89.7 | Confident | 89.7 | Confident | 13 Ų | 13 | 63.2 Ų | 63.2 | 11% | 0.107 | 35% | 0.348 | C | S | . | . | H | α-helix | trans | -60.1 | -52.3 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | F180 R190 L191 T196 M197 L198 | F180-A194 HydrophobicContact CB-CB 4.37Å; F180-A194 HydrophobicContact CD1-CB 4.02Å; F180-A194 HydrophobicContact CD2-CB 3.38Å; F180-A194 HydrophobicContact CE1-CB 4.1Å; F180-A194 HydrophobicContact CE2-CB 3.46Å; F180-A194 VanDerWaalsContact CE2-CB 3.46Å; F180-A194 HydrophobicContact CG-CB 3.65Å; F180-A194 HydrophobicContact CZ-CB 3.82Å; R190-A194 WeakPolarHBondContact O-CB 3.33Å; R190-A194 PolarHBondContact O-N 2.9Å; L191-A194 WeakPolarHBondContact O-CB 3.34Å; L191-A194 PolarHBondContact O-N 2.77Å; A194-T196 VanDerWaalsContact C-N 3.34Å; A194-T196 PolarHBondContact O-N 3.26Å; A194-M197 PolarHBondContact O-N 3.5Å; A194-L198 VanDerWaalsContact O-CB 3.28Å; A194-L198 WeakPolarHBondContact O-CB 3.07Å; A194-L198 VanDerWaalsContact O-CG 3.23Å; A194-L198 WeakPolarHBondContact O-CG 3.06Å; A194-L198 PolarHBondContact O-N 3.35Å |
| 195 | I | 90 | Very high | 90 | Very high | 25 Ų | 25 | 64.8 Ų | 64.8 | 13% | 0.128 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -60.5 | -45.8 | 179.5 | -69.6 | 168.2 | 0 | 0 | 0 | 110.4 | L191 T199 L268 K269 L272 | L191-I195 HydrophobicContact CD1-CD1 3.96Å; L191-I195 HydrophobicContact CD1-CG1 4.29Å; L191-I195 HydrophobicContact CG-CD1 3.85Å; L191-I195 WeakPolarHBondContact O-CB 3.4Å; L191-I195 VanDerWaalsContact O-CG1 3.32Å; L191-I195 WeakPolarHBondContact O-CG1 3.33Å; L191-I195 PolarHBondContact O-N 2.87Å; I195-T199 WeakPolarHBondContact O-CB 3.08Å; I195-T199 PolarHBondContact O-N 3.48Å; I195-T199 PolarHBondContact O-OG1 3.1Å; I195-L268 HydrophobicContact CB-CD2 4.36Å; I195-L268 HydrophobicContact CG1-CD2 4.31Å; I195-L268 HydrophobicContact CG2-CD2 4.27Å; I195-K269 HydrophobicContact CD1-CG 4.11Å; I195-L272 HydrophobicContact CG1-CD1 4.27Å |
| 196 | T | 91.3 | Very high | 90.3 | Very high | 96 Ų | 96 | 59.9 Ų | 59.9 | 59% | 0.589 | 32% | 0.321 | S | S | * | . | H | α-helix | trans | -63.5 | -46.8 | -178.4 | -57.8 | 0 | 0 | 0 | 0 | 111.1 | N192 A193 A194 T199 A200 | N192-T196 VanDerWaalsContact O-CB 3.25Å; N192-T196 WeakPolarHBondContact O-CB 3.49Å; N192-T196 PolarHBondContact O-N 3.26Å; N192-T196 PolarHBondContact O-OG1 2.88Å; A193-T196 PolarHBondContact O-N 2.97Å; A194-T196 VanDerWaalsContact C-N 3.34Å; A194-T196 PolarHBondContact O-N 3.26Å; T196-T199 PolarHBondContact O-N 3.45Å; T196-A200 VanDerWaalsContact O-CB 3.29Å; T196-A200 WeakPolarHBondContact O-CB 3.4Å; T196-A200 PolarHBondContact O-N 2.93Å |
| 197 | M | 91.2 | Very high | 90.5 | Very high | 25 Ų | 25 | 59.9 Ų | 59.9 | 12% | 0.123 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -68.4 | -45.2 | -178.9 | -167.2 | -78.6 | -69.2 | 0 | 0 | 112 | P159 F163 F178 F180 A193 A194 T199 A200 R201 | P159-M197 HydrophobicContact CB-SD 4Å; F163-M197 HydrophobicContact CB-CE 3.68Å; F163-M197 HydrophobicContact CD1-CE 4.12Å; F163-M197 HydrophobicContact CD2-CE 3.84Å; F163-M197 HydrophobicContact CD2-CG 4.04Å; F163-M197 HydrophobicContact CD2-SD 4.01Å; F163-M197 HydrophobicContact CE1-CG 4.46Å; F163-M197 HydrophobicContact CE2-CG 3.82Å; F163-M197 HydrophobicContact CE2-SD 4.36Å; F163-M197 HydrophobicContact CG-CE 3.63Å; F163-M197 HydrophobicContact CG-CG 4.49Å; F163-M197 HydrophobicContact CG-SD 4.41Å; F163-M197 HydrophobicContact CZ-CG 4.05Å; F178-M197 HydrophobicContact CD1-CE 3.73Å; F178-M197 HydrophobicContact CE1-CE 4.05Å; F178-M197 HydrophobicContact CG-CE 4.31Å; F180-M197 HydrophobicContact CE1-CB 4.13Å; F180-M197 HydrophobicContact CE1-CE 3.36Å; F180-M197 HydrophobicContact CZ-CE 3.29Å; A193-M197 VanDerWaalsContact O-CB 3.32Å; A193-M197 WeakPolarHBondContact O-CB 3.29Å; A193-M197 PolarHBondContact O-N 2.73Å; A194-M197 PolarHBondContact O-N 3.5Å; M197-T199 VanDerWaalsContact C-N 3.34Å; M197-T199 PolarHBondContact O-N 3.37Å; M197-A200 PolarHBondContact O-N 3.26Å; M197-R201 VanDerWaalsContact O-CB 3.25Å; M197-R201 WeakPolarHBondContact O-CB 3.17Å; M197-R201 PolarHBondContact O-N 2.92Å; M197-R201 HydrophobicContact SD-CB 4.47Å |
| 198 | L | 90.6 | Very high | 90.8 | Very high | 41 Ų | 41 | 56.3 Ų | 56.3 | 22% | 0.215 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -63.3 | -40.4 | 176.9 | -70.2 | 171 | 0 | 0 | 0 | 111.6 | F178 F180 A194 R201 G202 L268 | F178-L198 HydrophobicContact CD2-CD2 3.81Å; F178-L198 HydrophobicContact CE2-CD2 4.05Å; F178-L198 HydrophobicContact CG-CD2 4.29Å; F180-L198 HydrophobicContact CZ-CG 4.27Å; A194-L198 VanDerWaalsContact O-CB 3.28Å; A194-L198 WeakPolarHBondContact O-CB 3.07Å; A194-L198 VanDerWaalsContact O-CG 3.23Å; A194-L198 WeakPolarHBondContact O-CG 3.06Å; A194-L198 PolarHBondContact O-N 3.35Å; L198-R201 PolarHBondContact O-N 3.48Å; L198-G202 PolarHBondContact O-N 3Å; L198-L268 HydrophobicContact CB-CD2 3.74Å; L198-L268 HydrophobicContact CD1-CD1 4.29Å; L198-L268 HydrophobicContact CD1-CD2 4.19Å |
| 199 | T | 91.6 | Very high | 90.8 | Very high | 43 Ų | 43 | 50.7 Ų | 50.7 | 26% | 0.264 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -63.6 | -49.5 | 175.4 | -57 | 0 | 0 | 0 | 0 | 111.6 | I195 T196 M197 R201 G202 I203 T265 | I195-T199 WeakPolarHBondContact O-CB 3.08Å; I195-T199 PolarHBondContact O-N 3.48Å; I195-T199 PolarHBondContact O-OG1 3.1Å; T196-T199 PolarHBondContact O-N 3.45Å; M197-T199 VanDerWaalsContact C-N 3.34Å; M197-T199 PolarHBondContact O-N 3.37Å; T199-R201 VanDerWaalsContact C-N 3.34Å; T199-R201 PolarHBondContact O-N 2.88Å; T199-G202 PolarHBondContact O-N 2.67Å; T199-I203 HydrophobicContact CG2-CD1 3.81Å; T199-I203 HydrophobicContact CG2-CG1 4.45Å; T199-I203 WeakPolarHBondContact O-CG1 3.5Å; T199-I203 PolarHBondContact O-N 3.43Å; T199-T265 HydrophobicContact CG2-CG2 4.18Å |
| 200 | A | 92.6 | Very high | 90.8 | Very high | 45 Ų | 45 | 46.6 Ų | 46.6 | 37% | 0.372 | 25% | 0.254 | S | S | . | . | H | α-helix | trans | -59.5 | -45.1 | 177.6 | 0 | 0 | 0 | 0 | 0 | 111.6 | T196 M197 G202 I203 I204 | T196-A200 VanDerWaalsContact O-CB 3.29Å; T196-A200 WeakPolarHBondContact O-CB 3.4Å; T196-A200 PolarHBondContact O-N 2.93Å; M197-A200 PolarHBondContact O-N 3.26Å; A200-G202 PolarHBondContact O-N 2.84Å; A200-I203 PolarHBondContact O-N 3.16Å; A200-I204 WeakPolarHBondContact O-CB 3.36Å; A200-I204 WeakPolarHBondContact O-CD1 3.47Å; A200-I204 WeakPolarHBondContact O-CG1 3.17Å; A200-I204 PolarHBondContact O-N 3.16Å |
| 201 | R | 91.1 | Very high | 90.9 | Very high | 28 Ų | 28 | 45.1 Ų | 45.1 | 11% | 0.106 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -57.6 | -47.5 | 175.4 | 179.1 | -161.4 | 173.1 | 81.9 | 9.3 | 111.5 | D106 I160 M197 L198 T199 I204 R205 | D106-R201 IonicContact OD1-NH2 3.66Å; D106-R201 IonicContact OD2-CZ 3.55Å; D106-R201 IonicContact OD2-NH1 3.59Å; D106-R201 IonicContact OD2-NH2 2.76Å; D106-R201 PolarHBondContact OD2-NH2 3.25Å; I160-R201 VanDerWaalsContact CG1-NH1 3.28Å; M197-R201 VanDerWaalsContact O-CB 3.25Å; M197-R201 WeakPolarHBondContact O-CB 3.17Å; M197-R201 PolarHBondContact O-N 2.92Å; M197-R201 HydrophobicContact SD-CB 4.47Å; L198-R201 PolarHBondContact O-N 3.48Å; T199-R201 VanDerWaalsContact C-N 3.34Å; T199-R201 PolarHBondContact O-N 2.88Å; R201-I204 PolarHBondContact O-N 2.86Å; R201-R205 WeakPolarHBondContact O-CB 3.39Å; R201-R205 WeakPolarHBondContact O-CG 3.08Å; R201-R205 PolarHBondContact O-N 3.32Å |
| 202 | G | 91.5 | Very high | 91.2 | Very high | 10 Ų | 10 | 46.2 Ų | 46.2 | 10% | 0.103 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -62.2 | -46.3 | 179.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | L198 T199 A200 R205 F206 T265 | L198-G202 PolarHBondContact O-N 3Å; T199-G202 PolarHBondContact O-N 2.67Å; A200-G202 PolarHBondContact O-N 2.84Å; G202-R205 PolarHBondContact O-N 3.04Å; G202-F206 PolarHBondContact O-N 2.98Å; G202-T265 WeakPolarHBondContact CA-OG1 3.26Å |
| 203 | I | 92.8 | Very high | 91.2 | Very high | 85 Ų | 85 | 42.4 Ų | 42.4 | 44% | 0.436 | 24% | 0.239 | S | C | . | . | H | α-helix | trans | -62.2 | -47.4 | 176.7 | -66.2 | 169 | 0 | 0 | 0 | 110.8 | T199 A200 R205 F206 V207 | T199-I203 HydrophobicContact CG2-CD1 3.81Å; T199-I203 HydrophobicContact CG2-CG1 4.45Å; T199-I203 WeakPolarHBondContact O-CG1 3.5Å; T199-I203 PolarHBondContact O-N 3.43Å; A200-I203 PolarHBondContact O-N 3.16Å; I203-R205 VanDerWaalsContact C-N 3.34Å; I203-R205 PolarHBondContact O-N 3.41Å; I203-F206 PolarHBondContact O-N 2.02Å; I203-V207 HydrophobicContact CG2-CG2 4.08Å; I203-V207 WeakPolarHBondContact O-CB 3.08Å; I203-V207 WeakPolarHBondContact O-CG2 3.43Å; I203-V207 PolarHBondContact O-N 2.94Å |
| 204 | I | 92.7 | Very high | 91.1 | Very high | 66 Ų | 66 | 41.9 Ų | 41.9 | 34% | 0.338 | 23% | 0.232 | S | C | . | . | H | α-helix | trans | -59.9 | -45.1 | 178.3 | -73.6 | 167.3 | 0 | 0 | 0 | 110.8 | L156 A200 R201 F206 I208 G209 | L156-I204 HydrophobicContact CD2-CG2 3.7Å; A200-I204 WeakPolarHBondContact O-CB 3.36Å; A200-I204 WeakPolarHBondContact O-CD1 3.47Å; A200-I204 WeakPolarHBondContact O-CG1 3.17Å; A200-I204 PolarHBondContact O-N 3.16Å; R201-I204 PolarHBondContact O-N 2.86Å; I204-F206 PolarHBondContact O-N 3.5Å; I204-I208 HydrophobicContact CG2-CD1 4.14Å; I204-I208 HydrophobicContact CG2-CG1 4.48Å; I204-I208 WeakPolarHBondContact O-CA 3.5Å; I204-I208 VanDerWaalsContact O-CB 3.29Å; I204-I208 WeakPolarHBondContact O-CB 3.29Å; I204-I208 PolarHBondContact O-N 3.06Å; I204-G209 PolarHBondContact O-N 2.99Å |
| 205 | R | 91.3 | Very high | 91.2 | Very high | 49 Ų | 49 | 43.9 Ų | 43.9 | 19% | 0.185 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -60.2 | -43.8 | 176.8 | -86.8 | 179.3 | 143.9 | -170.6 | -10.8 | 112.1 | D106 L109 F110 R201 G202 I203 G209 F210 | D106-R205 IonicContact OD1-CZ 3.61Å; D106-R205 IonicContact OD1-NH2 2.61Å; D106-R205 PolarHBondContact OD1-NH2 2.88Å; D106-R205 IonicContact OD2-NH2 3.72Å; L109-R205 HydrophobicContact CD2-CG 4.47Å; F110-R205 HydrophobicContact CZ-CG 3.84Å; R201-R205 WeakPolarHBondContact O-CB 3.39Å; R201-R205 WeakPolarHBondContact O-CG 3.08Å; R201-R205 PolarHBondContact O-N 3.32Å; G202-R205 PolarHBondContact O-N 3.04Å; I203-R205 VanDerWaalsContact C-N 3.34Å; I203-R205 PolarHBondContact O-N 3.41Å; R205-G209 CarbonylContact O-C 3.6Å; R205-G209 WeakPolarHBondContact O-CA 3.4Å; R205-G209 PolarHBondContact O-N 3.48Å; R205-F210 PolarHBondContact O-N 3.41Å |
| 206 | F | 92.4 | Very high | 91.3 | Very high | 49 Ų | 49 | 44.6 Ų | 44.6 | 22% | 0.215 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -70.8 | -48.3 | 179.6 | -177.5 | -101.6 | 0 | 0 | 0 | 112.3 | G202 I203 I204 F210 S211 Q258 L262 | G202-F206 PolarHBondContact O-N 2.98Å; I203-F206 PolarHBondContact O-N 2.02Å; I204-F206 PolarHBondContact O-N 3.5Å; F206-F210 HydrophobicContact CD2-CD1 4.4Å; F206-F210 HydrophobicContact CE2-CD1 4.05Å; F206-F210 WeakPolarHBondContact O-CB 3.46Å; F206-F210 PolarHBondContact O-N 3.5Å; F206-S211 WeakPolarHBondContact O-CB 3.36Å; F206-S211 PolarHBondContact O-N 3.18Å; F206-Q258 HydrophobicContact CD2-CB 4.23Å; F206-L262 HydrophobicContact CB-CD1 4.2Å; F206-L262 HydrophobicContact CD1-CD1 4.36Å; F206-L262 HydrophobicContact CD1-CD2 4.04Å; F206-L262 HydrophobicContact CD2-CB 4.18Å; F206-L262 HydrophobicContact CD2-CD2 3.92Å; F206-L262 HydrophobicContact CD2-CG 4.47Å; F206-L262 HydrophobicContact CE1-CD2 3.95Å; F206-L262 HydrophobicContact CE2-CD2 3.83Å; F206-L262 HydrophobicContact CG-CD1 4.14Å; F206-L262 HydrophobicContact CG-CD2 4.03Å; F206-L262 HydrophobicContact CG-CG 4.46Å; F206-L262 HydrophobicContact CZ-CD2 3.85Å |
| 207 | V | 93.5 | Very high | 91.2 | Very high | 70 Ų | 70 | 40.3 Ų | 40.3 | 42% | 0.424 | 22% | 0.223 | S | C | . | . | I | π-helix | trans | -71.9 | -54.1 | -175.3 | 175.5 | 0 | 0 | 0 | 0 | 110.9 | I203 S211 M212 | I203-V207 HydrophobicContact CG2-CG2 4.08Å; I203-V207 WeakPolarHBondContact O-CB 3.08Å; I203-V207 WeakPolarHBondContact O-CG2 3.43Å; I203-V207 PolarHBondContact O-N 2.94Å; V207-S211 PolarHBondContact O-N 3.49Å; V207-M212 WeakPolarHBondContact O-CB 3.02Å; V207-M212 PolarHBondContact O-N 2.96Å |
| 208 | I | 92.4 | Very high | 91 | Very high | 48 Ų | 48 | 41.5 Ų | 41.5 | 25% | 0.246 | 24% | 0.237 | C | C | . | . | I | π-helix | trans | -86.7 | -39.7 | -174 | -51.4 | -172.4 | 0 | 0 | 0 | 111 | F114 L156 I204 P213 | F114-I208 HydrophobicContact CE1-CG2 3.89Å; F114-I208 HydrophobicContact CZ-CG2 3.7Å; L156-I208 HydrophobicContact CD1-CG2 3.89Å; L156-I208 HydrophobicContact CD2-CD1 4.24Å; I204-I208 HydrophobicContact CG2-CD1 4.14Å; I204-I208 HydrophobicContact CG2-CG1 4.48Å; I204-I208 WeakPolarHBondContact O-CA 3.5Å; I204-I208 VanDerWaalsContact O-CB 3.29Å; I204-I208 WeakPolarHBondContact O-CB 3.29Å; I204-I208 PolarHBondContact O-N 3.06Å; I208-P213 WeakPolarHBondContact O-CD 3.23Å; I208-P213 WeakPolarHBondContact O-CG 3.31Å |
| 209 | G | 88.5 | Confident | 91.1 | Very high | 1 Ų | 1 | 44.7 Ų | 44.7 | 1% | 0.01 | 25% | 0.252 | C | S | . | . | I | π-helix | trans | -81.8 | -11 | -177.1 | 0 | 0 | 0 | 0 | 0 | 115.1 | I204 R205 | I204-G209 PolarHBondContact O-N 2.99Å; R205-G209 CarbonylContact O-C 3.6Å; R205-G209 WeakPolarHBondContact O-CA 3.4Å; R205-G209 PolarHBondContact O-N 3.48Å |
| 210 | F | 89.3 | Confident | 91 | Very high | 12 Ų | 12 | 42.9 Ų | 42.9 | 5% | 0.053 | 24% | 0.242 | C | C | . | . | I | π-helix | trans | -138.6 | -60.8 | 179.9 | 178.4 | -102.2 | 0 | 0 | 0 | 113.4 | R205 F206 P213 M214 F250 F251 W254 F255 Q258 | R205-F210 PolarHBondContact O-N 3.41Å; F206-F210 HydrophobicContact CD2-CD1 4.4Å; F206-F210 HydrophobicContact CE2-CD1 4.05Å; F206-F210 WeakPolarHBondContact O-CB 3.46Å; F206-F210 PolarHBondContact O-N 3.5Å; F210-P213 WeakPolarHBondContact O-CD 3.21Å; F210-M214 HydrophobicContact CD2-CG 4.08Å; F210-M214 HydrophobicContact CE2-CG 3.83Å; F210-M214 HydrophobicContact CZ-CG 4.08Å; F210-M214 VanDerWaalsContact O-CB 3.23Å; F210-M214 WeakPolarHBondContact O-CB 3.46Å; F210-M214 VanDerWaalsContact O-CG 3.31Å; F210-M214 WeakPolarHBondContact O-CG 3.21Å; F210-M214 PolarHBondContact O-N 3.48Å; F210-F250 HydrophobicContact CD2-CE1 4.08Å; F210-F250 HydrophobicContact CE2-CE1 4.16Å; F210-F251 HydrophobicContact CZ-CD2 4.07Å; F210-F251 HydrophobicContact CZ-CE2 4.21Å; F210-W254 HydrophobicContact CD2-CB 3.87Å; F210-W254 HydrophobicContact CE2-CB 3.79Å; F210-F255 AromaticContact CE1-CD2 3.81Å; F210-F255 HydrophobicContact CE1-CD2 3.81Å; F210-F255 HydrophobicContact CE2-CB 4.23Å; F210-F255 HydrophobicContact CZ-CB 3.78Å; F210-F255 AromaticContact CZ-CD2 3.7Å; F210-F255 HydrophobicContact CZ-CD2 3.7Å; F210-F255 HydrophobicContact CZ-CG 4.24Å; F210-Q258 HydrophobicContact CB-CB 4.39Å; F210-Q258 HydrophobicContact CB-CG 3.78Å; F210-Q258 HydrophobicContact CD1-CB 4.3Å; F210-Q258 HydrophobicContact CD1-CG 4.45Å; F210-Q258 HydrophobicContact CD2-CB 4.37Å; F210-Q258 HydrophobicContact CD2-CG 3.81Å; F210-Q258 HydrophobicContact CG-CB 4.1Å; F210-Q258 HydrophobicContact CG-CG 3.76Å |
| 211 | S | 91.4 | Very high | 90.6 | Very high | 47 Ų | 47 | 41.9 Ų | 41.9 | 33% | 0.329 | 23% | 0.229 | S | C | . | . | I | π-helix | trans | -63 | -49.4 | -170.4 | -175.7 | 0 | 0 | 0 | 0 | 113.4 | F206 V207 M214 S215 | F206-S211 WeakPolarHBondContact O-CB 3.36Å; F206-S211 PolarHBondContact O-N 3.18Å; V207-S211 PolarHBondContact O-N 3.49Å; S211-M214 PolarHBondContact O-N 3.22Å; S211-S215 WeakPolarHBondContact O-CB 3.33Å; S211-S215 PolarHBondContact O-N 3.41Å; S211-S215 PolarHBondContact O-OG 2.61Å |
| 212 | M | 92.2 | Very high | 90.4 | Very high | 102 Ų | 102 | 42.5 Ų | 42.5 | 50% | 0.502 | 24% | 0.243 | S | C | . | . | H | α-helix | trans | -62.4 | -53.1 | 179 | 165.8 | -166.4 | -177.1 | 0 | 0 | 112 | V207 M214 S215 I216 | V207-M212 WeakPolarHBondContact O-CB 3.02Å; V207-M212 PolarHBondContact O-N 2.96Å; M212-M214 VanDerWaalsContact C-N 3.31Å; M212-M214 PolarHBondContact O-N 3.39Å; M212-S215 PolarHBondContact O-N 3.07Å; M212-I216 HydrophobicContact CE-CD1 3.93Å; M212-I216 HydrophobicContact CG-CD1 3.96Å; M212-I216 WeakPolarHBondContact O-CG1 3.29Å; M212-I216 PolarHBondContact O-N 2.74Å |
| 213 | P | 89.6 | Confident | 90.3 | Very high | 3 Ų | 3 | 45.8 Ų | 45.8 | 2% | 0.019 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -59.2 | -40.5 | 177 | -27.4 | 35.8 | 0 | 0 | 0 | 113.1 | V113 F114 A117 I208 F210 I216 V217 | V113-P213 HydrophobicContact CG1-CB 3.12Å; V113-P213 HydrophobicContact CG1-CG 3.28Å; F114-P213 HydrophobicContact CD1-CG 4.2Å; F114-P213 HydrophobicContact CE1-CG 4.25Å; A117-P213 HydrophobicContact CB-CB 4.26Å; I208-P213 WeakPolarHBondContact O-CD 3.23Å; I208-P213 WeakPolarHBondContact O-CG 3.31Å; F210-P213 WeakPolarHBondContact O-CD 3.21Å; P213-I216 PolarHBondContact O-N 2.9Å; P213-V217 WeakPolarHBondContact O-CB 3.06Å; P213-V217 VanDerWaalsContact O-CG2 3.24Å; P213-V217 WeakPolarHBondContact O-CG2 3.44Å; P213-V217 PolarHBondContact O-N 2.87Å |
| 214 | M | 88.4 | Confident | 90 | Very high | 21 Ų | 21 | 42.8 Ų | 42.8 | 10% | 0.103 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -64 | -42 | 176.2 | -80.8 | -57.3 | -78.8 | 0 | 0 | 113 | F210 S211 M212 I216 V217 A218 V247 F250 F251 | F210-M214 HydrophobicContact CD2-CG 4.08Å; F210-M214 HydrophobicContact CE2-CG 3.83Å; F210-M214 HydrophobicContact CZ-CG 4.08Å; F210-M214 VanDerWaalsContact O-CB 3.23Å; F210-M214 WeakPolarHBondContact O-CB 3.46Å; F210-M214 VanDerWaalsContact O-CG 3.31Å; F210-M214 WeakPolarHBondContact O-CG 3.21Å; F210-M214 PolarHBondContact O-N 3.48Å; S211-M214 PolarHBondContact O-N 3.22Å; M212-M214 VanDerWaalsContact C-N 3.31Å; M212-M214 PolarHBondContact O-N 3.39Å; M214-I216 VanDerWaalsContact C-N 3.33Å; M214-I216 PolarHBondContact O-N 3Å; M214-V217 PolarHBondContact O-N 3.18Å; M214-A218 WeakPolarHBondContact O-CB 3.4Å; M214-A218 PolarHBondContact O-N 2.99Å; M214-V247 HydrophobicContact CE-CG1 4.31Å; M214-F250 HydrophobicContact CE-CD1 4.13Å; M214-F250 HydrophobicContact CG-CD1 3.94Å; M214-F250 HydrophobicContact CG-CE1 3.6Å; M214-F250 HydrophobicContact SD-CD1 3.08Å; M214-F250 WeakPolarHBondContact SD-CD1 3.43Å; M214-F250 HydrophobicContact SD-CE1 3.36Å; M214-F250 WeakPolarHBondContact SD-CE1 3.17Å; M214-F250 HydrophobicContact SD-CG 4.05Å; M214-F250 HydrophobicContact SD-CZ 4.49Å; M214-F251 HydrophobicContact CE-CB 3.68Å; M214-F251 HydrophobicContact CE-CD2 3.76Å; M214-F251 HydrophobicContact CE-CG 4.19Å |
| 215 | S | 91.8 | Very high | 89.5 | Confident | 56 Ų | 56 | 41 Ų | 41 | 39% | 0.392 | 24% | 0.238 | S | C | . | . | H | α-helix | trans | -61.2 | -45 | 174.9 | -58.3 | 0 | 0 | 0 | 0 | 110.8 | S211 M212 A218 I219 | S211-S215 WeakPolarHBondContact O-CB 3.33Å; S211-S215 PolarHBondContact O-N 3.41Å; S211-S215 PolarHBondContact O-OG 2.61Å; M212-S215 PolarHBondContact O-N 3.07Å; S215-A218 PolarHBondContact O-N 2.95Å; S215-I219 VanDerWaalsContact O-CB 3.3Å; S215-I219 WeakPolarHBondContact O-CB 3.36Å; S215-I219 WeakPolarHBondContact O-CD1 3.16Å; S215-I219 WeakPolarHBondContact O-CG1 3.4Å; S215-I219 PolarHBondContact O-N 3.38Å |
| 216 | I | 92.1 | Very high | 89.3 | Confident | 40 Ų | 40 | 41.6 Ų | 41.6 | 21% | 0.205 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -59.7 | -50.6 | 177.4 | -69.2 | 166.8 | 0 | 0 | 0 | 110.7 | A117 L121 M212 P213 M214 I219 C220 | A117-I216 HydrophobicContact CB-CB 4.36Å; A117-I216 HydrophobicContact CB-CD1 4.48Å; A117-I216 HydrophobicContact CB-CG2 4.04Å; L121-I216 HydrophobicContact CD1-CG2 3.79Å; L121-I216 HydrophobicContact CD2-CG2 4Å; L121-I216 HydrophobicContact CG-CG2 3.61Å; M212-I216 HydrophobicContact CE-CD1 3.93Å; M212-I216 HydrophobicContact CG-CD1 3.96Å; M212-I216 WeakPolarHBondContact O-CG1 3.29Å; M212-I216 PolarHBondContact O-N 2.74Å; P213-I216 PolarHBondContact O-N 2.9Å; M214-I216 VanDerWaalsContact C-N 3.33Å; M214-I216 PolarHBondContact O-N 3Å; I216-I219 PolarHBondContact O-N 2.76Å; I216-C220 WeakPolarHBondContact O-CB 3.3Å; I216-C220 PolarHBondContact O-N 2.97Å; I216-C220 PolarHBondContact O-SG 2.91Å |
| 217 | V | 88.6 | Confident | 88.9 | Confident | 6 Ų | 6 | 42.3 Ų | 42.3 | 4% | 0.036 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -61.1 | -48.2 | -179.2 | 170.3 | 0 | 0 | 0 | 0 | 110.7 | I116 A117 A120 P213 M214 C220 Y221 V247 | I116-V217 HydrophobicContact CG2-CG2 3.99Å; A117-V217 HydrophobicContact CB-CG2 4.43Å; A120-V217 HydrophobicContact CB-CB 4.44Å; A120-V217 HydrophobicContact CB-CG2 3.98Å; P213-V217 WeakPolarHBondContact O-CB 3.06Å; P213-V217 VanDerWaalsContact O-CG2 3.24Å; P213-V217 WeakPolarHBondContact O-CG2 3.44Å; P213-V217 PolarHBondContact O-N 2.87Å; M214-V217 PolarHBondContact O-N 3.18Å; V217-C220 PolarHBondContact O-N 2.88Å; V217-Y221 HydrophobicContact CG1-CD2 3.58Å; V217-Y221 HydrophobicContact CG1-CE2 3.6Å; V217-Y221 WeakPolarHBondContact O-CB 3.45Å; V217-Y221 WeakPolarHBondContact O-CD2 3.35Å; V217-Y221 PolarHBondContact O-N 3.05Å; V217-V247 HydrophobicContact CG1-CG2 3.84Å |
| 218 | A | 87.6 | Confident | 88.2 | Confident | 50 Ų | 50 | 40.9 Ų | 40.9 | 41% | 0.413 | 25% | 0.246 | S | C | . | . | H | α-helix | trans | -62.4 | -46.3 | 179.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | M214 S215 G222 | M214-A218 WeakPolarHBondContact O-CB 3.4Å; M214-A218 PolarHBondContact O-N 2.99Å; S215-A218 PolarHBondContact O-N 2.95Å; A218-G222 PolarHBondContact O-N 3.43Å |
| 219 | I | 91.4 | Very high | 87.6 | Confident | 107 Ų | 107 | 45.4 Ų | 45.4 | 55% | 0.549 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -64.4 | -49.4 | 178.1 | -67.7 | 165.5 | 0 | 0 | 0 | 110.3 | S215 I216 Y221 G222 L223 | S215-I219 VanDerWaalsContact O-CB 3.3Å; S215-I219 WeakPolarHBondContact O-CB 3.36Å; S215-I219 WeakPolarHBondContact O-CD1 3.16Å; S215-I219 WeakPolarHBondContact O-CG1 3.4Å; S215-I219 PolarHBondContact O-N 3.38Å; I216-I219 PolarHBondContact O-N 2.76Å; I219-Y221 VanDerWaalsContact C-N 3.33Å; I219-Y221 PolarHBondContact O-N 2.85Å; I219-G222 PolarHBondContact O-N 3.34Å; I219-L223 HydrophobicContact CG2-CD1 3.9Å; I219-L223 HydrophobicContact CG2-CG 4.31Å; I219-L223 WeakPolarHBondContact O-CB 3.26Å; I219-L223 VanDerWaalsContact O-CG 3.25Å; I219-L223 WeakPolarHBondContact O-CG 3.39Å; I219-L223 PolarHBondContact O-N 3.35Å |
| 220 | C | 89.9 | Confident | 87.3 | Confident | 6 Ų | 6 | 55.7 Ų | 55.7 | 4% | 0.041 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -56.6 | -48.3 | -179.7 | -74.8 | 0 | 0 | 0 | 0 | 111.6 | A120 L121 C124 I216 V217 L223 I224 | A120-C220 HydrophobicContact CB-CB 4.1Å; L121-C220 VanDerWaalsContact CD2-SG 3.52Å; C124-C220 HydrophobicContact CB-CB 3.83Å; I216-C220 WeakPolarHBondContact O-CB 3.3Å; I216-C220 PolarHBondContact O-N 2.97Å; I216-C220 PolarHBondContact O-SG 2.91Å; V217-C220 PolarHBondContact O-N 2.88Å; C220-L223 PolarHBondContact O-N 3.35Å; C220-I224 VanDerWaalsContact O-CG1 3.29Å; C220-I224 WeakPolarHBondContact O-CG1 3.43Å; C220-I224 PolarHBondContact O-N 3.44Å |
| 221 | Y | 85 | Confident | 86.8 | Confident | 24 Ų | 24 | 62.3 Ų | 62.3 | 9% | 0.094 | 33% | 0.329 | C | S | . | . | H | α-helix | trans | -75.1 | -32.1 | -178 | -69.1 | -22.6 | 0 | 0 | 0 | 113.3 | A120 V217 I219 I224 A225 L243 V246 V247 | A120-Y221 HydrophobicContact CB-CD1 4.47Å; A120-Y221 HydrophobicContact CB-CE1 3.9Å; A120-Y221 HydrophobicContact CB-CE2 4.24Å; V217-Y221 HydrophobicContact CG1-CD2 3.58Å; V217-Y221 HydrophobicContact CG1-CE2 3.6Å; V217-Y221 WeakPolarHBondContact O-CB 3.45Å; V217-Y221 WeakPolarHBondContact O-CD2 3.35Å; V217-Y221 PolarHBondContact O-N 3.05Å; I219-Y221 VanDerWaalsContact C-N 3.33Å; I219-Y221 PolarHBondContact O-N 2.85Å; Y221-I224 HydrophobicContact CD1-CD1 3.89Å; Y221-I224 HydrophobicContact CE1-CD1 4.32Å; Y221-I224 PolarHBondContact O-N 2.9Å; Y221-A225 WeakPolarHBondContact O-CB 3.42Å; Y221-A225 PolarHBondContact O-N 3.46Å; Y221-L243 HydrophobicContact CD1-CD1 3.21Å; Y221-L243 HydrophobicContact CD1-CD2 3.97Å; Y221-L243 HydrophobicContact CD1-CG 3.82Å; Y221-L243 HydrophobicContact CD2-CD1 3.69Å; Y221-L243 HydrophobicContact CD2-CG 3.89Å; Y221-L243 HydrophobicContact CE1-CD1 3.26Å; Y221-L243 HydrophobicContact CE1-CG 4.32Å; Y221-L243 HydrophobicContact CE2-CD1 3.73Å; Y221-L243 HydrophobicContact CE2-CG 4.38Å; Y221-L243 HydrophobicContact CG-CD1 3.4Å; Y221-L243 HydrophobicContact CG-CD2 3.83Å; Y221-L243 HydrophobicContact CG-CG 3.54Å; Y221-V246 HydrophobicContact CE2-CG1 4.43Å; Y221-V247 HydrophobicContact CD2-CG2 3.42Å; Y221-V247 VanDerWaalsContact CD2-CG2 3.42Å; Y221-V247 HydrophobicContact CE2-CG2 4.02Å; Y221-V247 HydrophobicContact CG-CG2 4.47Å |
| 222 | G | 86.5 | Confident | 85.7 | Confident | 40 Ų | 40 | 63.6 Ų | 63.6 | 41% | 0.412 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -60.7 | -43.8 | 168.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | A218 I219 A225 A226 | A218-G222 PolarHBondContact O-N 3.43Å; I219-G222 PolarHBondContact O-N 3.34Å; G222-A225 PolarHBondContact O-N 2.86Å; G222-A226 WeakPolarHBondContact O-CB 3.44Å; G222-A226 PolarHBondContact O-N 3.49Å |
| 223 | L | 89.5 | Confident | 84.4 | Confident | 80 Ų | 80 | 64.3 Ų | 64.3 | 42% | 0.419 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -64.9 | -42 | 176.2 | -70.7 | 174 | 0 | 0 | 0 | 112.4 | L128 I219 C220 A226 K227 | L128-L223 HydrophobicContact CD1-CB 4.2Å; L128-L223 HydrophobicContact CD2-CB 4.13Å; L128-L223 HydrophobicContact CD2-CD1 4.09Å; I219-L223 HydrophobicContact CG2-CD1 3.9Å; I219-L223 HydrophobicContact CG2-CG 4.31Å; I219-L223 WeakPolarHBondContact O-CB 3.26Å; I219-L223 VanDerWaalsContact O-CG 3.25Å; I219-L223 WeakPolarHBondContact O-CG 3.39Å; I219-L223 PolarHBondContact O-N 3.35Å; C220-L223 PolarHBondContact O-N 3.35Å; L223-A226 PolarHBondContact O-N 2.84Å; L223-K227 WeakPolarHBondContact O-CB 3.48Å; L223-K227 PolarHBondContact O-N 3.23Å |
| 224 | I | 85.6 | Confident | 83 | Confident | 21 Ų | 21 | 66.7 Ų | 66.7 | 11% | 0.108 | 36% | 0.362 | C | S | . | . | H | α-helix | trans | -60.4 | -46.8 | 174 | -69.2 | 175.2 | 0 | 0 | 0 | 110.4 | R123 C124 V127 L128 C220 Y221 K227 L228 L243 | R123-I224 HydrophobicContact CB-CD1 3.99Å; C124-I224 HydrophobicContact CB-CD1 4.43Å; V127-I224 HydrophobicContact CB-CG1 4.15Å; V127-I224 HydrophobicContact CG1-CG1 4.38Å; V127-I224 HydrophobicContact CG1-CG2 4.35Å; V127-I224 HydrophobicContact CG2-CD1 4.4Å; V127-I224 HydrophobicContact CG2-CG1 4.25Å; V127-I224 HydrophobicContact CG2-CG2 4.32Å; L128-I224 HydrophobicContact CD1-CG1 4.42Å; C220-I224 VanDerWaalsContact O-CG1 3.29Å; C220-I224 WeakPolarHBondContact O-CG1 3.43Å; C220-I224 PolarHBondContact O-N 3.44Å; Y221-I224 HydrophobicContact CD1-CD1 3.89Å; Y221-I224 HydrophobicContact CE1-CD1 4.32Å; Y221-I224 PolarHBondContact O-N 2.9Å; I224-K227 PolarHBondContact O-N 2.95Å; I224-L228 WeakPolarHBondContact O-CB 3.4Å; I224-L228 PolarHBondContact O-N 3.38Å; I224-L243 HydrophobicContact CG2-CD2 4.37Å |
| 225 | A | 82.7 | Confident | 81.2 | Confident | 30 Ų | 30 | 73.7 Ų | 73.7 | 25% | 0.248 | 40% | 0.4 | C | S | . | . | H | α-helix | trans | -61.9 | -46.8 | 179.3 | 0 | 0 | 0 | 0 | 0 | 111.9 | Y221 G222 K227 L228 H229 L240 | Y221-A225 WeakPolarHBondContact O-CB 3.42Å; Y221-A225 PolarHBondContact O-N 3.46Å; G222-A225 PolarHBondContact O-N 2.86Å; A225-K227 VanDerWaalsContact C-N 3.34Å; A225-K227 PolarHBondContact O-N 3.45Å; A225-L228 PolarHBondContact O-N 2.9Å; A225-H229 WeakPolarHBondContact O-CB 3.31Å; A225-H229 PolarHBondContact O-N 3.22Å; A225-L240 HydrophobicContact CB-CD2 3.54Å |
| 226 | A | 86 | Confident | 79.5 | Confident | 61 Ų | 61 | 74.2 Ų | 74.2 | 50% | 0.504 | 40% | 0.404 | S | S | . | . | H | α-helix | trans | -60.2 | -43 | 176.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | G222 L223 R230 | G222-A226 WeakPolarHBondContact O-CB 3.44Å; G222-A226 PolarHBondContact O-N 3.49Å; L223-A226 PolarHBondContact O-N 2.84Å; A226-R230 WeakPolarHBondContact O-CB 3.25Å; A226-R230 PolarHBondContact O-N 2.87Å |
| 227 | K | 84.4 | Confident | 77.9 | Confident | 63 Ų | 63 | 76.2 Ų | 76.2 | 27% | 0.274 | 42% | 0.422 | S | S | . | . | H | α-helix | trans | -65.4 | -42.2 | 178 | -171.8 | 65.2 | 166.8 | -166 | 0 | 112 | V127 L223 I224 A225 R230 R231 | V127-K227 HydrophobicContact CG1-CB 4.28Å; V127-K227 HydrophobicContact CG1-CG 4.09Å; L223-K227 WeakPolarHBondContact O-CB 3.48Å; L223-K227 PolarHBondContact O-N 3.23Å; I224-K227 PolarHBondContact O-N 2.95Å; A225-K227 VanDerWaalsContact C-N 3.34Å; A225-K227 PolarHBondContact O-N 3.45Å; K227-R230 PolarHBondContact O-N 2.76Å; K227-R231 PolarHBondContact O-N 2.96Å |
| 228 | L | 79.6 | Confident | 76.7 | Confident | 40 Ų | 40 | 81.2 Ų | 81.2 | 21% | 0.209 | 44% | 0.44 | C | S | . | . | H | α-helix | trans | -67.1 | -42.1 | 179.5 | -171 | 66.2 | 0 | 0 | 0 | 111.4 | I224 A225 R231 A232 L233 V234 L240 | I224-L228 WeakPolarHBondContact O-CB 3.4Å; I224-L228 PolarHBondContact O-N 3.38Å; A225-L228 PolarHBondContact O-N 2.9Å; L228-R231 PolarHBondContact O-N 2.98Å; L228-A232 PolarHBondContact O-N 3.25Å; L228-L233 HydrophobicContact CD1-CB 3.55Å; L228-L233 HydrophobicContact CD1-CD2 4.43Å; L228-L233 HydrophobicContact CG-CB 4.43Å; L228-L233 PolarHBondContact O-N 3.22Å; L228-V234 HydrophobicContact CG-CG2 4.45Å; L228-L240 HydrophobicContact CD2-CD1 4.27Å; L228-L240 HydrophobicContact CD2-CG 4.15Å |
| 229 | H | 80.1 | Confident | 75.5 | Confident | 144 Ų | 144 | 82.6 Ų | 82.6 | 67% | 0.667 | 44% | 0.444 | S | S | * | . | H | α-helix | trans | -60.9 | -46.5 | 174.2 | -168.9 | -83.7 | 0 | 0 | 0 | 111.7 | A225 R231 A232 V234 | A225-H229 WeakPolarHBondContact O-CB 3.31Å; A225-H229 PolarHBondContact O-N 3.22Å; H229-R231 PolarHBondContact O-N 3.28Å; H229-A232 PolarHBondContact O-N 3.46Å; H229-V234 HydrophobicContact CB-CG2 4.34Å |
| 230 | R | 82.1 | Confident | 74.2 | Confident | 217 Ų | 217 | 79.6 Ų | 79.6 | 82% | 0.819 | 43% | 0.429 | S | S | * | . | H | α-helix | trans | -63 | -28.7 | 179.6 | -164.3 | 178.1 | -177.8 | -162.5 | -0.5 | 113.4 | A226 K227 A232 | A226-R230 WeakPolarHBondContact O-CB 3.25Å; A226-R230 PolarHBondContact O-N 2.87Å; K227-R230 PolarHBondContact O-N 2.76Å; R230-A232 VanDerWaalsContact C-N 3.3Å |
| 231 | R | 77.8 | Confident | 73.3 | Confident | 150 Ų | 150 | 87.3 Ų | 87.3 | 57% | 0.566 | 46% | 0.457 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -85.9 | 3.5 | 177 | -70.5 | -169.3 | 173.5 | -164 | 0.9 | 113.8 | K227 L228 H229 L233 | K227-R231 PolarHBondContact O-N 2.96Å; L228-R231 PolarHBondContact O-N 2.98Å; H229-R231 PolarHBondContact O-N 3.28Å; R231-L233 HydrophobicContact CB-CD1 3.99Å; R231-L233 WeakPolarHBondContact O-CD1 3.2Å; R231-L233 PolarHBondContact O-N 3.06Å |
| 232 | A | 68.7 | Low | 72.6 | Confident | 74 Ų | 74 | 87.7 Ų | 87.7 | 61% | 0.612 | 46% | 0.462 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 51.4 | 22.6 | -173.6 | 0 | 0 | 0 | 0 | 0 | 113.7 | L228 H229 R230 V234 | L228-A232 PolarHBondContact O-N 3.25Å; H229-A232 PolarHBondContact O-N 3.46Å; R230-A232 VanDerWaalsContact C-N 3.3Å; A232-V234 PolarHBondContact O-N 3.37Å |
| 233 | L | 64.6 | Low | 71.8 | Confident | 117 Ų | 117 | 87.1 Ų | 87.1 | 61% | 0.613 | 45% | 0.45 | S | S | * | . | trans | -80.9 | 14 | 177.2 | -107.2 | 87.2 | 0 | 0 | 0 | 112.1 | L228 R231 N235 | L228-L233 HydrophobicContact CD1-CB 3.55Å; L228-L233 HydrophobicContact CD1-CD2 4.43Å; L228-L233 HydrophobicContact CG-CB 4.43Å; L228-L233 PolarHBondContact O-N 3.22Å; R231-L233 HydrophobicContact CB-CD1 3.99Å; R231-L233 WeakPolarHBondContact O-CD1 3.2Å; R231-L233 PolarHBondContact O-N 3.06Å; L233-N235 PolarHBondContact O-N 3.46Å; L233-N235 VanDerWaalsContact O-N 3.12Å | ||
| 234 | V | 60.3 | Low | 71 | Confident | 53 Ų | 53 | 87.7 Ų | 87.7 | 32% | 0.321 | 46% | 0.457 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -78.7 | 14.3 | -175.7 | -166.6 | 0 | 0 | 0 | 0 | 112.4 | L228 H229 A232 S236 L240 | L228-V234 HydrophobicContact CG-CG2 4.45Å; H229-V234 HydrophobicContact CB-CG2 4.34Å; A232-V234 PolarHBondContact O-N 3.37Å; V234-S236 PolarHBondContact O-N 2.9Å; V234-L240 HydrophobicContact CG1-CD1 4.14Å |
| 235 | N | 50.7 | Low | 70.6 | Confident | 168 Ų | 168 | 88.9 Ų | 88.9 | 90% | 0.898 | 47% | 0.47 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -62.6 | -7 | 178.3 | -74.5 | -8.3 | 0 | 0 | 0 | 113.9 | L233 | L233-N235 PolarHBondContact O-N 3.46Å; L233-N235 VanDerWaalsContact O-N 3.12Å |
| 236 | S | 55.7 | Low | 70.2 | Confident | 68 Ų | 68 | 88.7 Ų | 88.7 | 48% | 0.476 | 47% | 0.465 | S | S | . | . | trans | -134 | 114.3 | 166.7 | -171.5 | 0 | 0 | 0 | 0 | 110.7 | V234 R238 P239 | V234-S236 PolarHBondContact O-N 2.9Å; S236-R238 PolarHBondContact O-N 3.37Å; S236-R238 VanDerWaalsContact O-N 3.13Å; S236-P239 WeakPolarHBondContact O-CD 3.27Å | ||
| 237 | S | 59.9 | Low | 69.8 | Low | 82 Ų | 82 | 87.4 Ų | 87.4 | 57% | 0.573 | 45% | 0.451 | S | S | * | . | S | Bend | trans | -68 | -4.9 | 175.8 | 57 | 0 | 0 | 0 | 0 | 113.9 | R241 | S237-R241 WeakPolarHBondContact O-CB 3.4Å; S237-R241 PolarHBondContact O-N 3.47Å |
| 238 | R | 63.1 | Low | 69.7 | Low | 111 Ų | 111 | 86.2 Ų | 86.2 | 42% | 0.419 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -66 | -46.2 | -171.2 | -171.4 | 176.8 | 178.8 | 166.9 | -0 | 114.1 | S236 R241 V242 | S236-R238 PolarHBondContact O-N 3.37Å; S236-R238 VanDerWaalsContact O-N 3.13Å; R238-R241 PolarHBondContact O-N 2.78Å; R238-V242 WeakPolarHBondContact O-CB 3.45Å; R238-V242 VanDerWaalsContact O-CG2 3.26Å; R238-V242 WeakPolarHBondContact O-CG2 3.3Å; R238-V242 PolarHBondContact O-N 3.39Å |
| 239 | P | 62.3 | Low | 69.9 | Low | 79 Ų | 79 | 85.4 Ų | 85.4 | 51% | 0.513 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -66 | -38.8 | 178.9 | -20.3 | 34.4 | 0 | 0 | 0 | 112.4 | S236 V242 L243 | S236-P239 WeakPolarHBondContact O-CD 3.27Å; P239-V242 PolarHBondContact O-N 3.24Å; P239-L243 WeakPolarHBondContact O-CB 3.4Å; P239-L243 PolarHBondContact O-N 3.4Å |
| 240 | L | 64.6 | Low | 70 | Confident | 43 Ų | 43 | 79 Ų | 79 | 23% | 0.225 | 42% | 0.42 | C | S | . | . | H | α-helix | trans | -65.7 | -44.1 | 175.2 | -77.8 | 167.1 | 0 | 0 | 0 | 111.8 | A225 L228 V234 V242 L243 T244 | A225-L240 HydrophobicContact CB-CD2 3.54Å; L228-L240 HydrophobicContact CD2-CD1 4.27Å; L228-L240 HydrophobicContact CD2-CG 4.15Å; V234-L240 HydrophobicContact CG1-CD1 4.14Å; L240-V242 VanDerWaalsContact C-N 3.28Å; L240-V242 PolarHBondContact O-N 3.5Å; L240-L243 VanDerWaalsContact O-CB 3.3Å; L240-L243 WeakPolarHBondContact O-CB 3.44Å; L240-L243 PolarHBondContact O-N 2.85Å; L240-L243 VanDerWaalsContact O-N 3.13Å; L240-T244 PolarHBondContact O-N 2.88Å; L240-T244 PolarHBondContact O-OG1 2.93Å; L240-T244 VanDerWaalsContact O-OG1 3.05Å |
| 241 | R | 70.7 | Confident | 70.2 | Confident | 169 Ų | 169 | 72.8 Ų | 72.8 | 64% | 0.638 | 40% | 0.4 | S | S | * | . | H | α-helix | trans | -60.1 | -40.9 | 176.7 | -174.1 | 173.2 | 68.6 | -173.8 | 3.3 | 112.1 | S237 R238 A245 | S237-R241 WeakPolarHBondContact O-CB 3.4Å; S237-R241 PolarHBondContact O-N 3.47Å; R238-R241 PolarHBondContact O-N 2.78Å; R241-A245 WeakPolarHBondContact O-CB 3.13Å; R241-A245 PolarHBondContact O-N 2.96Å |
| 242 | V | 70.4 | Confident | 70.8 | Confident | 32 Ų | 32 | 70.6 Ų | 70.6 | 19% | 0.194 | 40% | 0.398 | C | S | . | . | H | α-helix | trans | -65.3 | -42.5 | 175.4 | 166.5 | 0 | 0 | 0 | 0 | 111 | R238 P239 L240 A245 V246 V304 | R238-V242 WeakPolarHBondContact O-CB 3.45Å; R238-V242 VanDerWaalsContact O-CG2 3.26Å; R238-V242 WeakPolarHBondContact O-CG2 3.3Å; R238-V242 PolarHBondContact O-N 3.39Å; P239-V242 PolarHBondContact O-N 3.24Å; L240-V242 VanDerWaalsContact C-N 3.28Å; L240-V242 PolarHBondContact O-N 3.5Å; V242-A245 PolarHBondContact O-N 3.47Å; V242-V246 WeakPolarHBondContact O-CG2 3.11Å; V242-V246 PolarHBondContact O-N 2.81Å; V242-V246 VanDerWaalsContact O-N 3.08Å; V242-V304 HydrophobicContact CB-CG2 4.49Å; V242-V304 HydrophobicContact CG1-CB 3.81Å; V242-V304 HydrophobicContact CG1-CG1 3.79Å; V242-V304 HydrophobicContact CG1-CG2 3.08Å |
| 243 | L | 68.3 | Low | 71.9 | Confident | 28 Ų | 28 | 67.3 Ų | 67.3 | 15% | 0.147 | 37% | 0.37 | C | S | . | . | H | α-helix | trans | -59.6 | -50.3 | 176.7 | -157 | 63 | 0 | 0 | 0 | 112 | Y221 I224 P239 L240 A245 V246 V247 | Y221-L243 HydrophobicContact CD1-CD1 3.21Å; Y221-L243 HydrophobicContact CD1-CD2 3.97Å; Y221-L243 HydrophobicContact CD1-CG 3.82Å; Y221-L243 HydrophobicContact CD2-CD1 3.69Å; Y221-L243 HydrophobicContact CD2-CG 3.89Å; Y221-L243 HydrophobicContact CE1-CD1 3.26Å; Y221-L243 HydrophobicContact CE1-CG 4.32Å; Y221-L243 HydrophobicContact CE2-CD1 3.73Å; Y221-L243 HydrophobicContact CE2-CG 4.38Å; Y221-L243 HydrophobicContact CG-CD1 3.4Å; Y221-L243 HydrophobicContact CG-CD2 3.83Å; Y221-L243 HydrophobicContact CG-CG 3.54Å; I224-L243 HydrophobicContact CG2-CD2 4.37Å; P239-L243 WeakPolarHBondContact O-CB 3.4Å; P239-L243 PolarHBondContact O-N 3.4Å; L240-L243 VanDerWaalsContact O-CB 3.3Å; L240-L243 WeakPolarHBondContact O-CB 3.44Å; L240-L243 PolarHBondContact O-N 2.85Å; L240-L243 VanDerWaalsContact O-N 3.13Å; L243-A245 VanDerWaalsContact C-N 3.28Å; L243-A245 PolarHBondContact O-N 2.82Å; L243-V246 PolarHBondContact O-N 2.88Å; L243-V247 WeakPolarHBondContact O-CG2 3.28Å; L243-V247 PolarHBondContact O-N 3.39Å |
| 244 | T | 72.8 | Confident | 73.1 | Confident | 92 Ų | 92 | 62.2 Ų | 62.2 | 56% | 0.564 | 34% | 0.343 | S | S | * | . | H | α-helix | trans | -61 | -39 | 177.3 | -54.6 | 0 | 0 | 0 | 0 | 111.2 | L240 V246 V247 A248 | L240-T244 PolarHBondContact O-N 2.88Å; L240-T244 PolarHBondContact O-OG1 2.93Å; L240-T244 VanDerWaalsContact O-OG1 3.05Å; T244-V246 PolarHBondContact O-N 2.9Å; T244-V247 PolarHBondContact O-N 3.34Å; T244-A248 WeakPolarHBondContact O-CB 3.5Å; T244-A248 PolarHBondContact O-N 3.35Å |
| 245 | A | 77.3 | Confident | 74.6 | Confident | 46 Ų | 46 | 63 Ų | 63 | 38% | 0.38 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -63.8 | -39.1 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | R241 V242 L243 S249 | R241-A245 WeakPolarHBondContact O-CB 3.13Å; R241-A245 PolarHBondContact O-N 2.96Å; V242-A245 PolarHBondContact O-N 3.47Å; L243-A245 VanDerWaalsContact C-N 3.28Å; L243-A245 PolarHBondContact O-N 2.82Å; A245-S249 VanDerWaalsContact O-CB 3.26Å; A245-S249 WeakPolarHBondContact O-CB 3.13Å; A245-S249 PolarHBondContact O-N 3.38Å; A245-S249 PolarHBondContact O-OG 3.48Å |
| 246 | V | 74.7 | Confident | 76.6 | Confident | 26 Ų | 26 | 56.9 Ų | 56.9 | 16% | 0.158 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -64.7 | -46.6 | 176.3 | 175.4 | 0 | 0 | 0 | 0 | 110.9 | Y221 V242 L243 T244 S249 F250 L300 | Y221-V246 HydrophobicContact CE2-CG1 4.43Å; V242-V246 WeakPolarHBondContact O-CG2 3.11Å; V242-V246 PolarHBondContact O-N 2.81Å; V242-V246 VanDerWaalsContact O-N 3.08Å; L243-V246 PolarHBondContact O-N 2.88Å; T244-V246 PolarHBondContact O-N 2.9Å; V246-S249 PolarHBondContact O-OG 3.12Å; V246-F250 PolarHBondContact O-N 2.95Å; V246-L300 HydrophobicContact CG2-CD1 4.18Å; V246-L300 HydrophobicContact CG2-CD2 3.89Å; V246-L300 HydrophobicContact CG2-CG 4.42Å |
| 247 | V | 77.6 | Confident | 78.4 | Confident | 34 Ų | 34 | 54.8 Ų | 54.8 | 21% | 0.206 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -65.5 | -45.1 | 178.7 | -176.6 | 0 | 0 | 0 | 0 | 111.5 | M214 V217 Y221 L243 T244 F251 | M214-V247 HydrophobicContact CE-CG1 4.31Å; V217-V247 HydrophobicContact CG1-CG2 3.84Å; Y221-V247 HydrophobicContact CD2-CG2 3.42Å; Y221-V247 VanDerWaalsContact CD2-CG2 3.42Å; Y221-V247 HydrophobicContact CE2-CG2 4.02Å; Y221-V247 HydrophobicContact CG-CG2 4.47Å; L243-V247 WeakPolarHBondContact O-CG2 3.28Å; L243-V247 PolarHBondContact O-N 3.39Å; T244-V247 PolarHBondContact O-N 3.34Å; V247-F251 WeakPolarHBondContact O-CB 3.31Å; V247-F251 PolarHBondContact O-N 3.16Å |
| 248 | A | 83.4 | Confident | 79.9 | Confident | 38 Ų | 38 | 51 Ų | 51 | 31% | 0.314 | 27% | 0.267 | S | S | . | . | H | α-helix | trans | -65.4 | -44.7 | -178.5 | 0 | 0 | 0 | 0 | 0 | 111.5 | T244 F250 F251 I252 | T244-A248 WeakPolarHBondContact O-CB 3.5Å; T244-A248 PolarHBondContact O-N 3.35Å; A248-F250 PolarHBondContact O-N 3.45Å; A248-F251 PolarHBondContact O-N 2.99Å; A248-I252 HydrophobicContact CB-CD1 4.44Å; A248-I252 VanDerWaalsContact O-CB 3.29Å; A248-I252 WeakPolarHBondContact O-CB 3.23Å; A248-I252 WeakPolarHBondContact O-CD1 3.25Å; A248-I252 WeakPolarHBondContact O-CG1 3.03Å; A248-I252 PolarHBondContact O-N 3.37Å |
| 249 | S | 83.6 | Confident | 81.4 | Confident | 22 Ų | 22 | 49 Ų | 49 | 15% | 0.154 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -60.4 | -46.8 | 177.9 | 52.4 | 0 | 0 | 0 | 0 | 111.7 | A245 V246 F251 I252 C253 | A245-S249 VanDerWaalsContact O-CB 3.26Å; A245-S249 WeakPolarHBondContact O-CB 3.13Å; A245-S249 PolarHBondContact O-N 3.38Å; A245-S249 PolarHBondContact O-OG 3.48Å; V246-S249 PolarHBondContact O-OG 3.12Å; S249-F251 PolarHBondContact O-N 3.08Å; S249-I252 PolarHBondContact O-N 3.35Å; S249-C253 WeakPolarHBondContact O-CB 3.35Å; S249-C253 PolarHBondContact O-N 2.75Å; S249-C253 PolarHBondContact O-SG 3.33Å |
| 250 | F | 81.2 | Confident | 82.9 | Confident | 9 Ų | 9 | 46 Ų | 46 | 4% | 0.039 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -60 | -49.3 | 176 | -173.8 | -77 | 0 | 0 | 0 | 111.6 | V113 I116 F210 M214 V246 A248 C253 W254 | V113-F250 HydrophobicContact CB-CE2 4.34Å; V113-F250 HydrophobicContact CB-CZ 4.22Å; V113-F250 HydrophobicContact CG1-CE2 4.17Å; V113-F250 HydrophobicContact CG1-CZ 3.69Å; V113-F250 HydrophobicContact CG2-CE2 3.74Å; V113-F250 HydrophobicContact CG2-CZ 3.64Å; I116-F250 HydrophobicContact CD1-CD2 3.86Å; I116-F250 HydrophobicContact CD1-CE2 3.96Å; F210-F250 HydrophobicContact CD2-CE1 4.08Å; F210-F250 HydrophobicContact CE2-CE1 4.16Å; M214-F250 HydrophobicContact CE-CD1 4.13Å; M214-F250 HydrophobicContact CG-CD1 3.94Å; M214-F250 HydrophobicContact CG-CE1 3.6Å; M214-F250 HydrophobicContact SD-CD1 3.08Å; M214-F250 WeakPolarHBondContact SD-CD1 3.43Å; M214-F250 HydrophobicContact SD-CE1 3.36Å; M214-F250 WeakPolarHBondContact SD-CE1 3.17Å; M214-F250 HydrophobicContact SD-CG 4.05Å; M214-F250 HydrophobicContact SD-CZ 4.49Å; V246-F250 PolarHBondContact O-N 2.95Å; A248-F250 PolarHBondContact O-N 3.45Å; F250-C253 PolarHBondContact O-N 3.36Å; F250-W254 HydrophobicContact CD1-CB 4.36Å; F250-W254 AromaticContact CD1-CD1 3.82Å; F250-W254 HydrophobicContact CD1-CG 4.36Å; F250-W254 AromaticContact CD2-CD1 3.59Å; F250-W254 AromaticContact CD2-NE1 3.85Å; F250-W254 HydrophobicContact CE1-CB 4.09Å; F250-W254 AromaticContact CE1-CD1 3.75Å; F250-W254 HydrophobicContact CE1-CG 4.03Å; F250-W254 AromaticContact CE2-CD1 3.51Å; F250-W254 HydrophobicContact CE2-CG 4.34Å; F250-W254 AromaticContact CE2-NE1 3.59Å; F250-W254 AromaticContact CG-CD1 3.77Å; F250-W254 AromaticContact CZ-CD1 3.61Å; F250-W254 HydrophobicContact CZ-CG 4.02Å; F250-W254 AromaticContact CZ-NE1 4Å; F250-W254 WeakPolarHBondContact O-CB 3.37Å; F250-W254 PolarHBondContact O-N 2.98Å |
| 251 | F | 87.3 | Confident | 84.1 | Confident | 88 Ų | 88 | 45.4 Ų | 45.4 | 39% | 0.386 | 25% | 0.246 | S | C | . | . | H | α-helix | trans | -60.7 | -49.1 | -179.5 | -176.4 | -98.3 | 0 | 0 | 0 | 111.6 | F210 M214 V247 A248 S249 C253 W254 F255 | F210-F251 HydrophobicContact CZ-CD2 4.07Å; F210-F251 HydrophobicContact CZ-CE2 4.21Å; M214-F251 HydrophobicContact CE-CB 3.68Å; M214-F251 HydrophobicContact CE-CD2 3.76Å; M214-F251 HydrophobicContact CE-CG 4.19Å; V247-F251 WeakPolarHBondContact O-CB 3.31Å; V247-F251 PolarHBondContact O-N 3.16Å; A248-F251 PolarHBondContact O-N 2.99Å; S249-F251 PolarHBondContact O-N 3.08Å; F251-C253 VanDerWaalsContact C-N 3.29Å; F251-C253 PolarHBondContact O-N 2.85Å; F251-W254 PolarHBondContact O-N 2.96Å; F251-F255 HydrophobicContact CD1-CB 4.35Å; F251-F255 HydrophobicContact CD2-CB 4.05Å; F251-F255 HydrophobicContact CD2-CG 4.42Å; F251-F255 HydrophobicContact CE1-CB 4.18Å; F251-F255 HydrophobicContact CE1-CD1 4.11Å; F251-F255 HydrophobicContact CE1-CG 4.12Å; F251-F255 HydrophobicContact CE2-CB 3.87Å; F251-F255 HydrophobicContact CE2-CD1 4.42Å; F251-F255 AromaticContact CE2-CD2 3.72Å; F251-F255 HydrophobicContact CE2-CD2 3.72Å; F251-F255 HydrophobicContact CE2-CE2 4.37Å; F251-F255 AromaticContact CE2-CG 3.74Å; F251-F255 HydrophobicContact CE2-CG 3.74Å; F251-F255 HydrophobicContact CG-CB 4.3Å; F251-F255 HydrophobicContact CZ-CB 3.94Å; F251-F255 AromaticContact CZ-CD1 3.78Å; F251-F255 HydrophobicContact CZ-CD1 3.78Å; F251-F255 AromaticContact CZ-CD2 3.85Å; F251-F255 HydrophobicContact CZ-CD2 3.85Å; F251-F255 HydrophobicContact CZ-CE1 4.22Å; F251-F255 HydrophobicContact CZ-CE2 4.28Å; F251-F255 AromaticContact CZ-CG 3.56Å; F251-F255 HydrophobicContact CZ-CG 3.56Å; F251-F255 HydrophobicContact CZ-CZ 4.45Å; F251-F255 WeakPolarHBondContact O-CB 3.29Å; F251-F255 PolarHBondContact O-N 2.87Å |
| 252 | I | 90.6 | Very high | 85.2 | Confident | 103 Ų | 103 | 39.4 Ų | 39.4 | 53% | 0.528 | 23% | 0.227 | S | C | . | . | H | α-helix | trans | -61.6 | -38.7 | -178.7 | -69.8 | 166.1 | 0 | 0 | 0 | 111 | A248 S249 P256 | A248-I252 HydrophobicContact CB-CD1 4.44Å; A248-I252 VanDerWaalsContact O-CB 3.29Å; A248-I252 WeakPolarHBondContact O-CB 3.23Å; A248-I252 WeakPolarHBondContact O-CD1 3.25Å; A248-I252 WeakPolarHBondContact O-CG1 3.03Å; A248-I252 PolarHBondContact O-N 3.37Å; S249-I252 PolarHBondContact O-N 3.35Å; I252-P256 WeakPolarHBondContact O-CD 3.45Å; I252-P256 WeakPolarHBondContact O-CG 3.24Å |
| 253 | C | 90.3 | Very high | 86.2 | Confident | 5 Ų | 5 | 40.3 Ų | 40.3 | 3% | 0.034 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -75.7 | -43.8 | -178.9 | -62.5 | 0 | 0 | 0 | 0 | 112.5 | S249 F250 F251 A290 N293 | S249-C253 WeakPolarHBondContact O-CB 3.35Å; S249-C253 PolarHBondContact O-N 2.75Å; S249-C253 PolarHBondContact O-SG 3.33Å; F250-C253 PolarHBondContact O-N 3.36Å; F251-C253 VanDerWaalsContact C-N 3.29Å; F251-C253 PolarHBondContact O-N 2.85Å; C253-A290 VanDerWaalsContact O-CA 3.28Å; C253-A290 WeakPolarHBondContact O-CA 3.23Å; C253-A290 PolarHBondContact O-N 2.85Å; C253-N293 HydrophobicContact CB-CB 3.7Å |
| 254 | W | 89.6 | Confident | 87.2 | Confident | 10 Ų | 10 | 40 Ų | 40 | 4% | 0.038 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -90.5 | -36.8 | -170.9 | -75 | 102.3 | 0 | 0 | 0 | 114.3 | L109 F210 F250 F251 F257 Q258 A290 N293 | L109-W254 HydrophobicContact CD1-CE3 3.89Å; L109-W254 HydrophobicContact CD1-CH2 3.18Å; L109-W254 HydrophobicContact CD1-CZ2 4.15Å; L109-W254 HydrophobicContact CD1-CZ3 3.04Å; L109-W254 HydrophobicContact CG-CH2 4.47Å; L109-W254 HydrophobicContact CG-CZ3 4.49Å; F210-W254 HydrophobicContact CD2-CB 3.87Å; F210-W254 HydrophobicContact CE2-CB 3.79Å; F250-W254 HydrophobicContact CD1-CB 4.36Å; F250-W254 AromaticContact CD1-CD1 3.82Å; F250-W254 HydrophobicContact CD1-CG 4.36Å; F250-W254 AromaticContact CD2-CD1 3.59Å; F250-W254 AromaticContact CD2-NE1 3.85Å; F250-W254 HydrophobicContact CE1-CB 4.09Å; F250-W254 AromaticContact CE1-CD1 3.75Å; F250-W254 HydrophobicContact CE1-CG 4.03Å; F250-W254 AromaticContact CE2-CD1 3.51Å; F250-W254 HydrophobicContact CE2-CG 4.34Å; F250-W254 AromaticContact CE2-NE1 3.59Å; F250-W254 AromaticContact CG-CD1 3.77Å; F250-W254 AromaticContact CZ-CD1 3.61Å; F250-W254 HydrophobicContact CZ-CG 4.02Å; F250-W254 AromaticContact CZ-NE1 4Å; F250-W254 WeakPolarHBondContact O-CB 3.37Å; F250-W254 PolarHBondContact O-N 2.98Å; F251-W254 PolarHBondContact O-N 2.96Å; W254-F257 HydrophobicContact CE3-CD1 4.38Å; W254-F257 HydrophobicContact CZ3-CD1 4.31Å; W254-F257 PolarHBondContact O-N 3.12Å; W254-Q258 WeakPolarHBondContact O-CB 3.48Å; W254-Q258 VanDerWaalsContact O-CG 3.24Å; W254-Q258 WeakPolarHBondContact O-CG 3.43Å; W254-Q258 PolarHBondContact O-N 2.99Å; W254-A290 HydrophobicContact CD2-CB 4.31Å; W254-A290 HydrophobicContact CE3-CB 3.83Å; W254-A290 HydrophobicContact CH2-CB 4.45Å; W254-A290 HydrophobicContact CZ3-CB 3.87Å; W254-N293 PolarHBondContact NE1-ND2 3.28Å |
| 255 | F | 91.9 | Very high | 88.1 | Confident | 71 Ų | 71 | 36.6 Ų | 36.6 | 31% | 0.311 | 21% | 0.213 | S | C | . | . | H | α-helix | trans | -58.6 | -44.9 | -173.8 | 179.2 | -105.9 | 0 | 0 | 0 | 113.3 | F210 F251 F257 Q258 L259 | F210-F255 AromaticContact CE1-CD2 3.81Å; F210-F255 HydrophobicContact CE1-CD2 3.81Å; F210-F255 HydrophobicContact CE2-CB 4.23Å; F210-F255 HydrophobicContact CZ-CB 3.78Å; F210-F255 AromaticContact CZ-CD2 3.7Å; F210-F255 HydrophobicContact CZ-CD2 3.7Å; F210-F255 HydrophobicContact CZ-CG 4.24Å; F251-F255 HydrophobicContact CD1-CB 4.35Å; F251-F255 HydrophobicContact CD2-CB 4.05Å; F251-F255 HydrophobicContact CD2-CG 4.42Å; F251-F255 HydrophobicContact CE1-CB 4.18Å; F251-F255 HydrophobicContact CE1-CD1 4.11Å; F251-F255 HydrophobicContact CE1-CG 4.12Å; F251-F255 HydrophobicContact CE2-CB 3.87Å; F251-F255 HydrophobicContact CE2-CD1 4.42Å; F251-F255 AromaticContact CE2-CD2 3.72Å; F251-F255 HydrophobicContact CE2-CD2 3.72Å; F251-F255 HydrophobicContact CE2-CE2 4.37Å; F251-F255 AromaticContact CE2-CG 3.74Å; F251-F255 HydrophobicContact CE2-CG 3.74Å; F251-F255 HydrophobicContact CG-CB 4.3Å; F251-F255 HydrophobicContact CZ-CB 3.94Å; F251-F255 AromaticContact CZ-CD1 3.78Å; F251-F255 HydrophobicContact CZ-CD1 3.78Å; F251-F255 AromaticContact CZ-CD2 3.85Å; F251-F255 HydrophobicContact CZ-CD2 3.85Å; F251-F255 HydrophobicContact CZ-CE1 4.22Å; F251-F255 HydrophobicContact CZ-CE2 4.28Å; F251-F255 AromaticContact CZ-CG 3.56Å; F251-F255 HydrophobicContact CZ-CG 3.56Å; F251-F255 HydrophobicContact CZ-CZ 4.45Å; F251-F255 WeakPolarHBondContact O-CB 3.29Å; F251-F255 PolarHBondContact O-N 2.87Å; F255-F257 VanDerWaalsContact C-N 3.34Å; F255-F257 PolarHBondContact O-N 3.17Å; F255-Q258 PolarHBondContact O-N 3.48Å; F255-L259 HydrophobicContact CE1-CD2 4.15Å; F255-L259 HydrophobicContact CZ-CD2 4.24Å; F255-L259 VanDerWaalsContact O-CB 3.32Å; F255-L259 WeakPolarHBondContact O-CB 3.48Å; F255-L259 PolarHBondContact O-N 2.91Å |
| 256 | P | 94.6 | Very high | 88.7 | Confident | 39 Ų | 39 | 39 Ų | 39 | 25% | 0.253 | 22% | 0.223 | S | C | . | . | H | α-helix | trans | -59.7 | -44.1 | -179.9 | -25.1 | 36.5 | 0 | 0 | 0 | 112.5 | I252 L259 V260 T286 L289 | I252-P256 WeakPolarHBondContact O-CD 3.45Å; I252-P256 WeakPolarHBondContact O-CG 3.24Å; P256-L259 PolarHBondContact O-N 3.47Å; P256-V260 WeakPolarHBondContact O-CG2 3.32Å; P256-V260 PolarHBondContact O-N 2.97Å; P256-T286 HydrophobicContact CB-CG2 3.83Å; P256-L289 HydrophobicContact CG-CD2 4.12Å |
| 257 | F | 92.8 | Very high | 89.3 | Confident | 23 Ų | 23 | 41.7 Ų | 41.7 | 10% | 0.101 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -65.8 | -45.5 | 177.6 | 174.5 | -113.3 | 0 | 0 | 0 | 111.9 | W254 F255 L259 V260 A261 V283 S287 A290 | W254-F257 HydrophobicContact CE3-CD1 4.38Å; W254-F257 HydrophobicContact CZ3-CD1 4.31Å; W254-F257 PolarHBondContact O-N 3.12Å; F255-F257 VanDerWaalsContact C-N 3.34Å; F255-F257 PolarHBondContact O-N 3.17Å; F257-L259 VanDerWaalsContact C-N 3.29Å; F257-L259 PolarHBondContact O-N 3.47Å; F257-V260 PolarHBondContact O-N 3.26Å; F257-A261 VanDerWaalsContact O-CB 3.3Å; F257-A261 WeakPolarHBondContact O-CB 3.29Å; F257-A261 PolarHBondContact O-N 3.45Å; F257-V283 HydrophobicContact CE2-CG2 4.46Å; F257-S287 VanDerWaalsContact CD2-OG 3.31Å; F257-S287 WeakPolarHBondContact CD2-OG 3.32Å; F257-S287 WeakPolarHBondContact CE2-OG 3.22Å; F257-A290 HydrophobicContact CB-CB 3.85Å; F257-A290 HydrophobicContact CD1-CB 4.2Å; F257-A290 HydrophobicContact CG-CB 4.12Å |
| 258 | Q | 91.9 | Very high | 89.7 | Confident | 3 Ų | 3 | 41.2 Ų | 41.2 | 1% | 0.014 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -65.4 | -34.3 | -179.7 | -68 | -69.4 | -4.8 | 0 | 0 | 112 | F206 F210 W254 F255 L262 | F206-Q258 HydrophobicContact CD2-CB 4.23Å; F210-Q258 HydrophobicContact CB-CB 4.39Å; F210-Q258 HydrophobicContact CB-CG 3.78Å; F210-Q258 HydrophobicContact CD1-CB 4.3Å; F210-Q258 HydrophobicContact CD1-CG 4.45Å; F210-Q258 HydrophobicContact CD2-CB 4.37Å; F210-Q258 HydrophobicContact CD2-CG 3.81Å; F210-Q258 HydrophobicContact CG-CB 4.1Å; F210-Q258 HydrophobicContact CG-CG 3.76Å; W254-Q258 WeakPolarHBondContact O-CB 3.48Å; W254-Q258 VanDerWaalsContact O-CG 3.24Å; W254-Q258 WeakPolarHBondContact O-CG 3.43Å; W254-Q258 PolarHBondContact O-N 2.99Å; F255-Q258 PolarHBondContact O-N 3.48Å; Q258-L262 WeakPolarHBondContact O-CB 3.36Å; Q258-L262 PolarHBondContact O-N 2.92Å |
| 259 | L | 93 | Very high | 89.8 | Confident | 69 Ų | 69 | 45.6 Ų | 45.6 | 36% | 0.361 | 24% | 0.238 | S | C | . | . | H | α-helix | trans | -66.5 | -49.3 | 173.5 | -179.3 | 62.1 | 0 | 0 | 0 | 111.5 | F255 P256 F257 A261 L262 L263 | F255-L259 HydrophobicContact CE1-CD2 4.15Å; F255-L259 HydrophobicContact CZ-CD2 4.24Å; F255-L259 VanDerWaalsContact O-CB 3.32Å; F255-L259 WeakPolarHBondContact O-CB 3.48Å; F255-L259 PolarHBondContact O-N 2.91Å; P256-L259 PolarHBondContact O-N 3.47Å; F257-L259 VanDerWaalsContact C-N 3.29Å; F257-L259 PolarHBondContact O-N 3.47Å; L259-A261 VanDerWaalsContact C-N 3.33Å; L259-A261 PolarHBondContact O-N 2.93Å; L259-L262 PolarHBondContact O-N 3.23Å; L259-L263 HydrophobicContact CD1-CD1 4.37Å; L259-L263 HydrophobicContact CD1-CG 4.35Å; L259-L263 HydrophobicContact CG-CD1 4.26Å; L259-L263 WeakPolarHBondContact O-CG 3.39Å; L259-L263 PolarHBondContact O-N 3.47Å |
| 260 | V | 93.7 | Very high | 89.8 | Confident | 15 Ų | 15 | 48.7 Ų | 48.7 | 9% | 0.091 | 25% | 0.25 | C | S | . | . | H | α-helix | trans | -60.5 | -44 | 177.3 | 170.9 | 0 | 0 | 0 | 0 | 111 | P256 F257 L263 G264 L279 L282 T286 | P256-V260 WeakPolarHBondContact O-CG2 3.32Å; P256-V260 PolarHBondContact O-N 2.97Å; F257-V260 PolarHBondContact O-N 3.26Å; V260-L263 PolarHBondContact O-N 3.47Å; V260-G264 PolarHBondContact O-N 3.27Å; V260-L279 HydrophobicContact CG1-CD2 4.24Å; V260-L282 HydrophobicContact CG1-CB 4.32Å; V260-L282 HydrophobicContact CG2-CB 3.98Å; V260-L282 HydrophobicContact CG2-CD1 4.42Å; V260-T286 HydrophobicContact CG2-CG2 3.98Å |
| 261 | A | 91.6 | Very high | 89.7 | Confident | 32 Ų | 32 | 49.9 Ų | 49.9 | 26% | 0.264 | 26% | 0.259 | S | S | . | . | H | α-helix | trans | -64.6 | -39.2 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112.6 | F257 L259 G264 T265 | F257-A261 VanDerWaalsContact O-CB 3.3Å; F257-A261 WeakPolarHBondContact O-CB 3.29Å; F257-A261 PolarHBondContact O-N 3.45Å; L259-A261 VanDerWaalsContact C-N 3.33Å; L259-A261 PolarHBondContact O-N 2.93Å; A261-G264 PolarHBondContact O-N 2.9Å; A261-T265 WeakPolarHBondContact O-CB 3.49Å; A261-T265 PolarHBondContact O-N 2.87Å; A261-T265 PolarHBondContact O-OG1 3.41Å |
| 262 | L | 92.9 | Very high | 89.3 | Confident | 43 Ų | 43 | 50.6 Ų | 50.6 | 23% | 0.225 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -67 | -43.7 | 175.7 | -178.3 | 65.4 | 0 | 0 | 0 | 111.4 | F206 Q258 L259 G264 T265 V266 | F206-L262 HydrophobicContact CB-CD1 4.2Å; F206-L262 HydrophobicContact CD1-CD1 4.36Å; F206-L262 HydrophobicContact CD1-CD2 4.04Å; F206-L262 HydrophobicContact CD2-CB 4.18Å; F206-L262 HydrophobicContact CD2-CD2 3.92Å; F206-L262 HydrophobicContact CD2-CG 4.47Å; F206-L262 HydrophobicContact CE1-CD2 3.95Å; F206-L262 HydrophobicContact CE2-CD2 3.83Å; F206-L262 HydrophobicContact CG-CD1 4.14Å; F206-L262 HydrophobicContact CG-CD2 4.03Å; F206-L262 HydrophobicContact CG-CG 4.46Å; F206-L262 HydrophobicContact CZ-CD2 3.85Å; Q258-L262 WeakPolarHBondContact O-CB 3.36Å; Q258-L262 PolarHBondContact O-N 2.92Å; L259-L262 PolarHBondContact O-N 3.23Å; L262-G264 VanDerWaalsContact C-N 3.34Å; L262-G264 PolarHBondContact O-N 3.48Å; L262-T265 WeakPolarHBondContact O-CA 3.38Å; L262-T265 VanDerWaalsContact O-CB 3.27Å; L262-T265 WeakPolarHBondContact O-CB 3.42Å; L262-T265 PolarHBondContact O-N 3.49Å; L262-V266 WeakPolarHBondContact O-CG2 3.34Å; L262-V266 PolarHBondContact O-N 3.39Å |
| 263 | L | 92.1 | Very high | 88.7 | Confident | 51 Ų | 51 | 50.8 Ų | 50.8 | 27% | 0.267 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -61.8 | -42.6 | 175.7 | -70.1 | 175.8 | 0 | 0 | 0 | 111.4 | L259 V260 T265 V266 W267 L279 | L259-L263 HydrophobicContact CD1-CD1 4.37Å; L259-L263 HydrophobicContact CD1-CG 4.35Å; L259-L263 HydrophobicContact CG-CD1 4.26Å; L259-L263 WeakPolarHBondContact O-CG 3.39Å; L259-L263 PolarHBondContact O-N 3.47Å; V260-L263 PolarHBondContact O-N 3.47Å; L263-T265 PolarHBondContact O-N 2.9Å; L263-V266 PolarHBondContact O-N 2.96Å; L263-W267 HydrophobicContact CB-CE3 4.12Å; L263-W267 HydrophobicContact CB-CZ3 4Å; L263-W267 HydrophobicContact CD1-CH2 4.35Å; L263-W267 HydrophobicContact CD1-CZ3 4.21Å; L263-W267 HydrophobicContact CD2-CH2 3.74Å; L263-W267 HydrophobicContact CD2-CZ2 4.02Å; L263-W267 HydrophobicContact CD2-CZ3 4.04Å; L263-W267 HydrophobicContact CG-CH2 4.44Å; L263-W267 HydrophobicContact CG-CZ3 4.3Å; L263-W267 WeakPolarHBondContact O-CB 3.34Å; L263-W267 PolarHBondContact O-N 3.42Å; L263-L279 HydrophobicContact CB-CD1 4.3Å; L263-L279 HydrophobicContact CB-CD2 3.94Å; L263-L279 HydrophobicContact CD1-CD2 4.37Å |
| 264 | G | 89.6 | Confident | 87.8 | Confident | 22 Ų | 22 | 52.7 Ų | 52.7 | 23% | 0.227 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -64 | -27 | 173.2 | 0 | 0 | 0 | 0 | 0 | 113.4 | V260 A261 L262 L268 | V260-G264 PolarHBondContact O-N 3.27Å; A261-G264 PolarHBondContact O-N 2.9Å; L262-G264 VanDerWaalsContact C-N 3.34Å; L262-G264 PolarHBondContact O-N 3.48Å; G264-L268 WeakPolarHBondContact O-CA 3.23Å; G264-L268 PolarHBondContact O-N 3.44Å |
| 265 | T | 89.8 | Confident | 87.1 | Confident | 19 Ų | 19 | 53.6 Ų | 53.6 | 12% | 0.117 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -73.3 | -44.9 | 173.1 | -58.1 | 0 | 0 | 0 | 0 | 111.7 | T199 G202 A261 L262 L263 L268 | T199-T265 HydrophobicContact CG2-CG2 4.18Å; G202-T265 WeakPolarHBondContact CA-OG1 3.26Å; A261-T265 WeakPolarHBondContact O-CB 3.49Å; A261-T265 PolarHBondContact O-N 2.87Å; A261-T265 PolarHBondContact O-OG1 3.41Å; L262-T265 WeakPolarHBondContact O-CA 3.38Å; L262-T265 VanDerWaalsContact O-CB 3.27Å; L262-T265 WeakPolarHBondContact O-CB 3.42Å; L262-T265 PolarHBondContact O-N 3.49Å; L263-T265 PolarHBondContact O-N 2.9Å; T265-L268 WeakPolarHBondContact O-CB 3.17Å |
| 266 | V | 90.2 | Very high | 86.6 | Confident | 98 Ų | 98 | 55.5 Ų | 55.5 | 59% | 0.594 | 32% | 0.315 | S | S | * | . | H | α-helix | trans | -69.8 | -40.2 | -178.7 | 173.1 | 0 | 0 | 0 | 0 | 111.4 | L262 L263 L268 | L262-V266 WeakPolarHBondContact O-CG2 3.34Å; L262-V266 PolarHBondContact O-N 3.39Å; L263-V266 PolarHBondContact O-N 2.96Å; V266-L268 VanDerWaalsContact C-N 3.33Å; V266-L268 PolarHBondContact O-N 2.86Å |
| 267 | W | 88.6 | Confident | 85.8 | Confident | 81 Ų | 81 | 57.4 Ų | 57.4 | 31% | 0.307 | 32% | 0.319 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -97.3 | 29.8 | 179.6 | -57.6 | -34.4 | 0 | 0 | 0 | 112.9 | L263 K269 E270 T271 Y276 L279 | L263-W267 HydrophobicContact CB-CE3 4.12Å; L263-W267 HydrophobicContact CB-CZ3 4Å; L263-W267 HydrophobicContact CD1-CH2 4.35Å; L263-W267 HydrophobicContact CD1-CZ3 4.21Å; L263-W267 HydrophobicContact CD2-CH2 3.74Å; L263-W267 HydrophobicContact CD2-CZ2 4.02Å; L263-W267 HydrophobicContact CD2-CZ3 4.04Å; L263-W267 HydrophobicContact CG-CH2 4.44Å; L263-W267 HydrophobicContact CG-CZ3 4.3Å; L263-W267 WeakPolarHBondContact O-CB 3.34Å; L263-W267 PolarHBondContact O-N 3.42Å; W267-K269 VanDerWaalsContact C-N 3.34Å; W267-K269 PolarHBondContact O-N 3.5Å; W267-E270 VanDerWaalsContact C-OE2 3.29Å; W267-E270 WeakPolarHBondContact CA-OE2 3.33Å; W267-E270 PolarHBondContact O-N 2.84Å; W267-T271 WeakPolarHBondContact O-CB 3.36Å; W267-T271 PolarHBondContact O-N 3.33Å; W267-T271 PolarHBondContact O-OG1 3.16Å; W267-Y276 HydrophobicContact CB-CD2 3.95Å; W267-Y276 HydrophobicContact CB-CE2 4.14Å; W267-Y276 HydrophobicContact CD2-CD2 4.34Å; W267-Y276 HydrophobicContact CD2-CE1 4.47Å; W267-Y276 HydrophobicContact CD2-CE2 4.24Å; W267-Y276 HydrophobicContact CD2-CG 4.49Å; W267-Y276 AromaticContact CE3-CD1 4Å; W267-Y276 HydrophobicContact CE3-CD1 4Å; W267-Y276 HydrophobicContact CE3-CD2 4.28Å; W267-Y276 HydrophobicContact CE3-CE1 4.27Å; W267-Y276 HydrophobicContact CE3-CG 4Å; W267-Y276 HydrophobicContact CG-CD2 4.22Å; W267-Y276 HydrophobicContact CG-CE2 4.06Å; W267-Y276 HydrophobicContact CZ3-CD1 4.19Å; W267-Y276 HydrophobicContact CZ3-CE1 4.41Å; W267-L279 HydrophobicContact CE3-CD1 3.88Å; W267-L279 HydrophobicContact CZ3-CD1 4.43Å |
| 268 | L | 85.9 | Confident | 85.4 | Confident | 25 Ų | 25 | 60.8 Ų | 60.8 | 13% | 0.131 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -60 | -42.4 | -174.2 | -179.3 | 62.4 | 0 | 0 | 0 | 112.1 | I195 L198 G264 T265 V266 T271 L272 | I195-L268 HydrophobicContact CB-CD2 4.36Å; I195-L268 HydrophobicContact CG1-CD2 4.31Å; I195-L268 HydrophobicContact CG2-CD2 4.27Å; L198-L268 HydrophobicContact CB-CD2 3.74Å; L198-L268 HydrophobicContact CD1-CD1 4.29Å; L198-L268 HydrophobicContact CD1-CD2 4.19Å; G264-L268 WeakPolarHBondContact O-CA 3.23Å; G264-L268 PolarHBondContact O-N 3.44Å; T265-L268 WeakPolarHBondContact O-CB 3.17Å; V266-L268 VanDerWaalsContact C-N 3.33Å; V266-L268 PolarHBondContact O-N 2.86Å; L268-T271 PolarHBondContact O-N 3.45Å; L268-L272 HydrophobicContact CD1-CD1 4.39Å; L268-L272 HydrophobicContact CD1-CG 4.41Å; L268-L272 HydrophobicContact CG-CD1 4.17Å; L268-L272 WeakPolarHBondContact O-CB 3.19Å; L268-L272 WeakPolarHBondContact O-CG 3.44Å; L268-L272 PolarHBondContact O-N 3.35Å |
| 269 | K | 84.1 | Confident | 85.1 | Confident | 129 Ų | 129 | 61.2 Ų | 61.2 | 56% | 0.561 | 34% | 0.339 | S | S | * | . | H | α-helix | trans | -67.2 | -40.1 | -178.2 | -69.3 | -176.1 | 178.8 | -176.9 | 0 | 112 | I195 W267 S273 | I195-K269 HydrophobicContact CD1-CG 4.11Å; W267-K269 VanDerWaalsContact C-N 3.34Å; W267-K269 PolarHBondContact O-N 3.5Å; K269-S273 PolarHBondContact O-N 3.43Å; K269-S273 VanDerWaalsContact O-N 3.14Å; K269-S273 PolarHBondContact O-OG 3.06Å |
| 270 | E | 85.1 | Confident | 84.5 | Confident | 87 Ų | 87 | 61.1 Ų | 61.1 | 41% | 0.407 | 34% | 0.34 | S | S | . | . | H | α-helix | trans | -70.7 | -40.4 | 179.1 | -63.7 | 75.9 | -169.9 | 0 | 0 | 110.5 | W267 S273 G274 G275 Y276 | W267-E270 VanDerWaalsContact C-OE2 3.29Å; W267-E270 WeakPolarHBondContact CA-OE2 3.33Å; W267-E270 PolarHBondContact O-N 2.84Å; E270-S273 CarbonylContact O-C 3.52Å; E270-S273 PolarHBondContact O-N 2.96Å; E270-S273 VanDerWaalsContact O-N 3.14Å; E270-G274 PolarHBondContact O-N 3.13Å; E270-G275 WeakPolarHBondContact O-CA 3.28Å; E270-G275 PolarHBondContact O-N 2.89Å; E270-Y276 HydrophobicContact CB-CD2 3.73Å; E270-Y276 HydrophobicContact CB-CE2 3.61Å; E270-Y276 HydrophobicContact CG-CE2 4.02Å |
| 271 | T | 78.9 | Confident | 84.1 | Confident | 35 Ų | 35 | 61.7 Ų | 61.7 | 22% | 0.215 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -63.5 | -43.7 | 174.8 | -53.3 | 0 | 0 | 0 | 0 | 111 | W267 L268 S273 G274 | W267-T271 WeakPolarHBondContact O-CB 3.36Å; W267-T271 PolarHBondContact O-N 3.33Å; W267-T271 PolarHBondContact O-OG1 3.16Å; L268-T271 PolarHBondContact O-N 3.45Å; T271-S273 PolarHBondContact O-N 3.42Å; T271-G274 PolarHBondContact O-N 2.79Å |
| 272 | L | 77.5 | Confident | 84.1 | Confident | 103 Ų | 103 | 63.2 Ų | 63.2 | 54% | 0.539 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -60.8 | -28.3 | 173.8 | -74.1 | 169.9 | 0 | 0 | 0 | 112.9 | L191 I195 L268 G274 | L191-L272 HydrophobicContact CD1-CD1 4.36Å; I195-L272 HydrophobicContact CG1-CD1 4.27Å; L268-L272 HydrophobicContact CD1-CD1 4.39Å; L268-L272 HydrophobicContact CD1-CG 4.41Å; L268-L272 HydrophobicContact CG-CD1 4.17Å; L268-L272 WeakPolarHBondContact O-CB 3.19Å; L268-L272 WeakPolarHBondContact O-CG 3.44Å; L268-L272 PolarHBondContact O-N 3.35Å; L272-G274 VanDerWaalsContact C-N 3.27Å; L272-G274 PolarHBondContact O-N 2.69Å |
| 273 | S | 78.8 | Confident | 84 | Confident | 107 Ų | 107 | 63.5 Ų | 63.5 | 75% | 0.748 | 35% | 0.349 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -86.7 | 7.2 | 176.7 | -52.5 | 0 | 0 | 0 | 0 | 113.1 | K269 E270 T271 | K269-S273 PolarHBondContact O-N 3.43Å; K269-S273 VanDerWaalsContact O-N 3.14Å; K269-S273 PolarHBondContact O-OG 3.06Å; E270-S273 CarbonylContact O-C 3.52Å; E270-S273 PolarHBondContact O-N 2.96Å; E270-S273 VanDerWaalsContact O-N 3.14Å; T271-S273 PolarHBondContact O-N 3.42Å |
| 274 | G | 72.3 | Confident | 83.9 | Confident | 45 Ų | 45 | 62.7 Ų | 62.7 | 46% | 0.464 | 34% | 0.343 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 88.2 | 7.3 | 179.3 | 0 | 0 | 0 | 0 | 0 | 115.4 | E270 T271 L272 | E270-G274 PolarHBondContact O-N 3.13Å; T271-G274 PolarHBondContact O-N 2.79Å; L272-G274 VanDerWaalsContact C-N 3.27Å; L272-G274 PolarHBondContact O-N 2.69Å |
| 275 | G | 74.8 | Confident | 84.1 | Confident | 28 Ų | 28 | 62.8 Ų | 62.8 | 29% | 0.289 | 34% | 0.34 | S | S | . | . | trans | -77.2 | 166.7 | 173.1 | 0 | 0 | 0 | 0 | 0 | 113.4 | E270 K277 | E270-G275 WeakPolarHBondContact O-CA 3.28Å; E270-G275 PolarHBondContact O-N 2.89Å; G275-K277 VanDerWaalsContact C-N 3.34Å; G275-K277 PolarHBondContact O-N 3.16Å | ||
| 276 | Y | 80.4 | Confident | 84.3 | Confident | 112 Ų | 112 | 62.7 Ų | 62.7 | 44% | 0.439 | 34% | 0.339 | S | S | . | . | trans | 51.7 | 37.9 | 171.7 | -56.3 | -72.2 | 0 | 0 | 0 | 117.3 | W267 E270 I278 L279 | W267-Y276 HydrophobicContact CB-CD2 3.95Å; W267-Y276 HydrophobicContact CB-CE2 4.14Å; W267-Y276 HydrophobicContact CD2-CD2 4.34Å; W267-Y276 HydrophobicContact CD2-CE1 4.47Å; W267-Y276 HydrophobicContact CD2-CE2 4.24Å; W267-Y276 HydrophobicContact CD2-CG 4.49Å; W267-Y276 AromaticContact CE3-CD1 4Å; W267-Y276 HydrophobicContact CE3-CD1 4Å; W267-Y276 HydrophobicContact CE3-CD2 4.28Å; W267-Y276 HydrophobicContact CE3-CE1 4.27Å; W267-Y276 HydrophobicContact CE3-CG 4Å; W267-Y276 HydrophobicContact CG-CD2 4.22Å; W267-Y276 HydrophobicContact CG-CE2 4.06Å; W267-Y276 HydrophobicContact CZ3-CD1 4.19Å; W267-Y276 HydrophobicContact CZ3-CE1 4.41Å; E270-Y276 HydrophobicContact CB-CD2 3.73Å; E270-Y276 HydrophobicContact CB-CE2 3.61Å; E270-Y276 HydrophobicContact CG-CE2 4.02Å; Y276-I278 PolarHBondContact O-N 2.71Å; Y276-L279 WeakPolarHBondContact O-CB 3.11Å; Y276-L279 PolarHBondContact O-N 3.48Å | ||
| 277 | K | 78.9 | Confident | 84.4 | Confident | 79 Ų | 79 | 58.7 Ų | 58.7 | 34% | 0.343 | 32% | 0.316 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -51.1 | -18.8 | 175 | -62 | -175.8 | 179.4 | -179.5 | 0 | 115.2 | G275 L279 D280 I281 | G275-K277 VanDerWaalsContact C-N 3.34Å; G275-K277 PolarHBondContact O-N 3.16Å; K277-L279 PolarHBondContact O-N 3.18Å; K277-D280 PolarHBondContact O-N 3.16Å; K277-I281 PolarHBondContact O-N 3.35Å |
| 278 | I | 84.2 | Confident | 84.7 | Confident | 93 Ų | 93 | 55.1 Ų | 55.1 | 48% | 0.477 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -59.3 | -32.6 | 172.9 | -170.2 | 59.3 | 0 | 0 | 0 | 112.3 | Y276 I281 L282 | Y276-I278 PolarHBondContact O-N 2.71Å; I278-I281 PolarHBondContact O-N 2.85Å; I278-L282 HydrophobicContact CD1-CD1 4.48Å; I278-L282 HydrophobicContact CD1-CG 4.4Å; I278-L282 HydrophobicContact CG1-CD1 3.99Å; I278-L282 HydrophobicContact CG1-CG 4.34Å; I278-L282 WeakPolarHBondContact O-CB 3.29Å; I278-L282 VanDerWaalsContact O-CG 3.29Å; I278-L282 WeakPolarHBondContact O-CG 3.48Å; I278-L282 PolarHBondContact O-N 3.12Å |
| 279 | L | 85.8 | Confident | 85.1 | Confident | 12 Ų | 12 | 57 Ų | 57 | 6% | 0.063 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -66.1 | -39.9 | 177.3 | -65.7 | -179 | 0 | 0 | 0 | 111.5 | V260 L263 W267 Y276 K277 I281 L282 V283 | V260-L279 HydrophobicContact CG1-CD2 4.24Å; L263-L279 HydrophobicContact CB-CD1 4.3Å; L263-L279 HydrophobicContact CB-CD2 3.94Å; L263-L279 HydrophobicContact CD1-CD2 4.37Å; W267-L279 HydrophobicContact CE3-CD1 3.88Å; W267-L279 HydrophobicContact CZ3-CD1 4.43Å; Y276-L279 WeakPolarHBondContact O-CB 3.11Å; Y276-L279 PolarHBondContact O-N 3.48Å; K277-L279 PolarHBondContact O-N 3.18Å; L279-I281 VanDerWaalsContact C-N 3.28Å; L279-I281 PolarHBondContact O-N 3.44Å; L279-L282 PolarHBondContact O-N 3.43Å; L279-V283 PolarHBondContact O-N 2.94Å |
| 280 | D | 80.3 | Confident | 85.5 | Confident | 68 Ų | 68 | 50.8 Ų | 50.8 | 36% | 0.364 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -64 | -35 | 175.4 | -57.1 | -31.3 | 0 | 0 | 0 | 111.6 | K277 V283 | K277-D280 PolarHBondContact O-N 3.16Å; D280-V283 WeakPolarHBondContact O-CG1 3.32Å |
| 281 | I | 85.1 | Confident | 85.8 | Confident | 27 Ų | 27 | 48 Ų | 48 | 14% | 0.138 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -70.5 | -39.2 | 175.7 | -62.8 | 170.8 | 0 | 0 | 0 | 110.9 | V16 L25 K277 I278 L279 P285 | V16-I281 HydrophobicContact CG1-CD1 4.25Å; L25-I281 HydrophobicContact CD1-CG2 4.23Å; K277-I281 PolarHBondContact O-N 3.35Å; I278-I281 PolarHBondContact O-N 2.85Å; L279-I281 VanDerWaalsContact C-N 3.28Å; L279-I281 PolarHBondContact O-N 3.44Å; I281-P285 WeakPolarHBondContact O-CD 3.33Å |
| 282 | L | 90.9 | Very high | 86.4 | Confident | 63 Ų | 63 | 49.3 Ų | 49.3 | 33% | 0.33 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -80.4 | -20 | -175.5 | -69.9 | 175.4 | 0 | 0 | 0 | 113.7 | V260 I278 L279 H284 P285 T286 | V260-L282 HydrophobicContact CG1-CB 4.32Å; V260-L282 HydrophobicContact CG2-CB 3.98Å; V260-L282 HydrophobicContact CG2-CD1 4.42Å; I278-L282 HydrophobicContact CD1-CD1 4.48Å; I278-L282 HydrophobicContact CD1-CG 4.4Å; I278-L282 HydrophobicContact CG1-CD1 3.99Å; I278-L282 HydrophobicContact CG1-CG 4.34Å; I278-L282 WeakPolarHBondContact O-CB 3.29Å; I278-L282 VanDerWaalsContact O-CG 3.29Å; I278-L282 WeakPolarHBondContact O-CG 3.48Å; I278-L282 PolarHBondContact O-N 3.12Å; L279-L282 PolarHBondContact O-N 3.43Å; L282-H284 PolarHBondContact O-N 2.69Å; L282-P285 WeakPolarHBondContact O-CD 3.32Å; L282-P285 WeakPolarHBondContact O-CG 3.19Å; L282-T286 WeakPolarHBondContact O-CB 3.22Å; L282-T286 WeakPolarHBondContact O-CG2 3.37Å; L282-T286 PolarHBondContact O-N 3.38Å; L282-T286 VanDerWaalsContact O-N 3.12Å; L282-T286 PolarHBondContact O-OG1 3.45Å |
| 283 | V | 90.2 | Very high | 86.9 | Confident | 50 Ų | 50 | 44.5 Ų | 44.5 | 30% | 0.303 | 25% | 0.25 | S | S | . | . | H | α-helix | trans | -62 | -43.7 | -175.9 | 77.6 | 0 | 0 | 0 | 0 | 112 | F257 L279 D280 T286 S287 | F257-V283 HydrophobicContact CE2-CG2 4.46Å; L279-V283 PolarHBondContact O-N 2.94Å; D280-V283 WeakPolarHBondContact O-CG1 3.32Å; V283-T286 PolarHBondContact O-OG1 3.22Å; V283-S287 WeakPolarHBondContact O-CB 3.38Å; V283-S287 PolarHBondContact O-N 2.86Å; V283-S287 PolarHBondContact O-OG 2.6Å |
| 284 | H | 90.6 | Very high | 87.4 | Confident | 33 Ų | 33 | 39.4 Ų | 39.4 | 15% | 0.153 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -64.6 | -53.5 | -179.1 | -58.6 | -68.3 | 0 | 0 | 0 | 113.5 | W26 S29 M85 E89 L282 T286 S287 S288 | W26-H284 AromaticContact CD1-CD2 3.95Å; S29-H284 VanDerWaalsContact OG-C 3.23Å; S29-H284 PolarHBondContact OG-O 3.07Å; M85-H284 HydrophobicContact CE-CB 4.45Å; M85-H284 WeakPolarHBondContact CE-ND1 3.15Å; M85-H284 HydrophobicContact SD-CB 4.31Å; E89-H284 IonicContact OE1-CE1 3.36Å; E89-H284 PolarHBondContact OE1-CE1 2.9Å; E89-H284 IonicContact OE1-ND1 2.61Å; E89-H284 IonicContact OE1-NE2 4Å; L282-H284 PolarHBondContact O-N 2.69Å; H284-T286 PolarHBondContact O-N 3.31Å; H284-S287 PolarHBondContact O-N 3.38Å; H284-S288 WeakPolarHBondContact O-CB 3.32Å; H284-S288 PolarHBondContact O-N 3.06Å; H284-S288 PolarHBondContact O-OG 3.27Å |
| 285 | P | 93.4 | Very high | 88 | Confident | 25 Ų | 25 | 37.3 Ų | 37.3 | 16% | 0.162 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -64.2 | -41.4 | -179.6 | 22.8 | -33.1 | 0 | 0 | 0 | 111.5 | S29 I281 L282 S288 L289 | S29-P285 WeakPolarHBondContact OG-CA 3.49Å; S29-P285 VanDerWaalsContact OG-N 3.09Å; I281-P285 WeakPolarHBondContact O-CD 3.33Å; L282-P285 WeakPolarHBondContact O-CD 3.32Å; L282-P285 WeakPolarHBondContact O-CG 3.19Å; P285-S288 PolarHBondContact O-N 2.9Å; P285-S288 PolarHBondContact O-OG 2.91Å; P285-L289 PolarHBondContact O-N 3.4Å; P285-L289 VanDerWaalsContact O-N 3.08Å |
| 286 | T | 94.9 | Very high | 88.4 | Confident | 16 Ų | 16 | 37.7 Ų | 37.7 | 10% | 0.098 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -68.3 | -38.9 | 178.3 | 59.2 | 0 | 0 | 0 | 0 | 112.6 | P256 V260 L282 V283 H284 L289 A290 | P256-T286 HydrophobicContact CB-CG2 3.83Å; V260-T286 HydrophobicContact CG2-CG2 3.98Å; L282-T286 WeakPolarHBondContact O-CB 3.22Å; L282-T286 WeakPolarHBondContact O-CG2 3.37Å; L282-T286 PolarHBondContact O-N 3.38Å; L282-T286 VanDerWaalsContact O-N 3.12Å; L282-T286 PolarHBondContact O-OG1 3.45Å; V283-T286 PolarHBondContact O-OG1 3.22Å; H284-T286 PolarHBondContact O-N 3.31Å; T286-L289 PolarHBondContact O-N 3.49Å; T286-A290 PolarHBondContact O-N 3.21Å |
| 287 | S | 92.3 | Very high | 88.3 | Confident | 14 Ų | 14 | 32.8 Ų | 32.8 | 10% | 0.098 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -63.1 | -44.2 | 173.8 | -58.5 | 0 | 0 | 0 | 0 | 111.5 | F257 V283 H284 L289 A290 F291 | F257-S287 VanDerWaalsContact CD2-OG 3.31Å; F257-S287 WeakPolarHBondContact CD2-OG 3.32Å; F257-S287 WeakPolarHBondContact CE2-OG 3.22Å; V283-S287 WeakPolarHBondContact O-CB 3.38Å; V283-S287 PolarHBondContact O-N 2.86Å; V283-S287 PolarHBondContact O-OG 2.6Å; H284-S287 PolarHBondContact O-N 3.38Å; S287-L289 VanDerWaalsContact C-N 3.27Å; S287-L289 PolarHBondContact O-N 2.92Å; S287-A290 WeakPolarHBondContact O-CB 3.3Å; S287-A290 PolarHBondContact O-N 3.3Å; S287-A290 VanDerWaalsContact O-N 3.16Å; S287-F291 WeakPolarHBondContact O-CB 3.48Å; S287-F291 VanDerWaalsContact O-CD1 3.29Å; S287-F291 WeakPolarHBondContact O-CD1 3.48Å; S287-F291 WeakPolarHBondContact O-CD2 3.27Å; S287-F291 WeakPolarHBondContact O-CG 3.34Å; S287-F291 PolarHBondContact O-N 3.36Å |
| 288 | S | 94.2 | Very high | 88 | Confident | 7 Ų | 7 | 29.5 Ų | 29.5 | 5% | 0.049 | 16% | 0.156 | C | C | . | . | H | α-helix | trans | -60.5 | -38.6 | 178.2 | 74.5 | 0 | 0 | 0 | 0 | 112 | H284 P285 F291 F292 | H284-S288 WeakPolarHBondContact O-CB 3.32Å; H284-S288 PolarHBondContact O-N 3.06Å; H284-S288 PolarHBondContact O-OG 3.27Å; P285-S288 PolarHBondContact O-N 2.9Å; P285-S288 PolarHBondContact O-OG 2.91Å; S288-F291 PolarHBondContact O-N 2.79Å; S288-F292 PolarHBondContact O-N 3.44Å |
| 289 | L | 94.4 | Very high | 87.2 | Confident | 63 Ų | 63 | 28.8 Ų | 28.8 | 33% | 0.33 | 15% | 0.152 | S | C | . | . | H | α-helix | trans | -67.6 | -41.2 | 175.3 | -176.2 | 64.9 | 0 | 0 | 0 | 111.8 | P256 P285 T286 S287 F291 F292 | P256-L289 HydrophobicContact CG-CD2 4.12Å; P285-L289 PolarHBondContact O-N 3.4Å; P285-L289 VanDerWaalsContact O-N 3.08Å; T286-L289 PolarHBondContact O-N 3.49Å; S287-L289 VanDerWaalsContact C-N 3.27Å; S287-L289 PolarHBondContact O-N 2.92Å; L289-F291 VanDerWaalsContact C-N 3.34Å; L289-F292 WeakPolarHBondContact O-CB 3.45Å; L289-F292 PolarHBondContact O-N 3.41Å |
| 290 | A | 91.8 | Very high | 86.2 | Confident | 0 Ų | 0 | 29.7 Ų | 29.7 | 0% | 0 | 16% | 0.156 | C | C | . | . | H | α-helix | trans | -62.6 | -42 | 174.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | C253 W254 F257 T286 S287 F292 N293 | C253-A290 VanDerWaalsContact O-CA 3.28Å; C253-A290 WeakPolarHBondContact O-CA 3.23Å; C253-A290 PolarHBondContact O-N 2.85Å; W254-A290 HydrophobicContact CD2-CB 4.31Å; W254-A290 HydrophobicContact CE3-CB 3.83Å; W254-A290 HydrophobicContact CH2-CB 4.45Å; W254-A290 HydrophobicContact CZ3-CB 3.87Å; F257-A290 HydrophobicContact CB-CB 3.85Å; F257-A290 HydrophobicContact CD1-CB 4.2Å; F257-A290 HydrophobicContact CG-CB 4.12Å; T286-A290 PolarHBondContact O-N 3.21Å; S287-A290 WeakPolarHBondContact O-CB 3.3Å; S287-A290 PolarHBondContact O-N 3.3Å; S287-A290 VanDerWaalsContact O-N 3.16Å; A290-F292 VanDerWaalsContact C-N 3.29Å; A290-F292 PolarHBondContact O-N 2.75Å; A290-N293 WeakPolarHBondContact O-CB 3.28Å; A290-N293 PolarHBondContact O-N 2.97Å; A290-N293 VanDerWaalsContact O-N 3.16Å |
| 291 | F | 91.8 | Very high | 85.4 | Confident | 28 Ų | 28 | 27.5 Ų | 27.5 | 12% | 0.123 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -64.5 | -34.5 | 177.7 | -61.9 | -13.6 | 0 | 0 | 0 | 112.4 | I33 T36 F74 L78 L81 S287 S288 L289 N293 S294 | I33-F291 HydrophobicContact CD1-CD2 4.21Å; I33-F291 HydrophobicContact CD1-CE2 4.43Å; I33-F291 HydrophobicContact CG1-CD2 4.12Å; T36-F291 HydrophobicContact CG2-CB 4.41Å; T36-F291 WeakPolarHBondContact CG2-O 3.16Å; F74-F291 HydrophobicContact CE1-CB 4.13Å; F74-F291 HydrophobicContact CE1-CD1 4.41Å; F74-F291 HydrophobicContact CE1-CG 4.4Å; F74-F291 HydrophobicContact CE2-CD1 4.05Å; F74-F291 HydrophobicContact CE2-CE1 4.19Å; F74-F291 HydrophobicContact CE2-CG 4.39Å; F74-F291 HydrophobicContact CZ-CB 3.74Å; F74-F291 AromaticContact CZ-CD1 3.43Å; F74-F291 HydrophobicContact CZ-CD1 3.43Å; F74-F291 VanDerWaalsContact CZ-CD1 3.43Å; F74-F291 HydrophobicContact CZ-CD2 4.2Å; F74-F291 HydrophobicContact CZ-CE1 4.03Å; F74-F291 AromaticContact CZ-CG 3.54Å; F74-F291 HydrophobicContact CZ-CG 3.54Å; L78-F291 HydrophobicContact CD2-CD2 4.03Å; L78-F291 HydrophobicContact CD2-CG 4.46Å; L81-F291 HydrophobicContact CD1-CE2 4.18Å; L81-F291 HydrophobicContact CD1-CZ 4.4Å; S287-F291 WeakPolarHBondContact O-CB 3.48Å; S287-F291 VanDerWaalsContact O-CD1 3.29Å; S287-F291 WeakPolarHBondContact O-CD1 3.48Å; S287-F291 WeakPolarHBondContact O-CD2 3.27Å; S287-F291 WeakPolarHBondContact O-CG 3.34Å; S287-F291 PolarHBondContact O-N 3.36Å; S288-F291 PolarHBondContact O-N 2.79Å; L289-F291 VanDerWaalsContact C-N 3.34Å; F291-N293 PolarHBondContact O-N 3.32Å; F291-N293 VanDerWaalsContact O-N 3.16Å; F291-S294 PolarHBondContact O-N 3.06Å; F291-S294 VanDerWaalsContact O-N 3.17Å |
| 292 | F | 91.4 | Very high | 84.2 | Confident | 62 Ų | 62 | 27.8 Ų | 27.8 | 27% | 0.272 | 15% | 0.146 | S | C | . | . | H | α-helix | trans | -59.4 | -25.6 | 176.1 | -167.8 | -109.6 | 0 | 0 | 0 | 112.9 | T36 S288 L289 A290 S294 C295 L296 | T36-F292 WeakPolarHBondContact OG1-CD2 3.22Å; S288-F292 PolarHBondContact O-N 3.44Å; L289-F292 WeakPolarHBondContact O-CB 3.45Å; L289-F292 PolarHBondContact O-N 3.41Å; A290-F292 VanDerWaalsContact C-N 3.29Å; A290-F292 PolarHBondContact O-N 2.75Å; F292-S294 VanDerWaalsContact C-N 3.26Å; F292-S294 PolarHBondContact O-N 2.89Å; F292-C295 WeakPolarHBondContact O-CB 3.4Å; F292-C295 PolarHBondContact O-N 3.28Å; F292-L296 HydrophobicContact CD1-CD1 4.04Å; F292-L296 HydrophobicContact CD1-CD2 4.29Å; F292-L296 HydrophobicContact CD1-CG 4.07Å; F292-L296 HydrophobicContact CE1-CD1 4.18Å; F292-L296 HydrophobicContact CE1-CD2 3.7Å; F292-L296 HydrophobicContact CE1-CG 4.01Å; F292-L296 HydrophobicContact CZ-CD2 4.3Å; F292-L296 PolarHBondContact O-N 2.87Å |
| 293 | N | 89.3 | Confident | 82.4 | Confident | 2 Ų | 2 | 31.5 Ų | 31.5 | 1% | 0.011 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -56.6 | -37.4 | 175.9 | -171.9 | 72.4 | 0 | 0 | 0 | 113.1 | C253 W254 A290 F291 C295 L296 N297 | C253-N293 HydrophobicContact CB-CB 3.7Å; W254-N293 PolarHBondContact NE1-ND2 3.28Å; A290-N293 WeakPolarHBondContact O-CB 3.28Å; A290-N293 PolarHBondContact O-N 2.97Å; A290-N293 VanDerWaalsContact O-N 3.16Å; F291-N293 PolarHBondContact O-N 3.32Å; F291-N293 VanDerWaalsContact O-N 3.16Å; N293-C295 PolarHBondContact O-N 3.09Å; N293-C295 VanDerWaalsContact O-N 3.13Å; N293-L296 PolarHBondContact O-N 3.29Å; N293-N297 PolarHBondContact O-N 2.95Å |
| 294 | S | 88.1 | Confident | 80.6 | Confident | 1 Ų | 1 | 32.2 Ų | 32.2 | 1% | 0.007 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -64.4 | -15.6 | 177.9 | -73.5 | 0 | 0 | 0 | 0 | 113.5 | N44 D71 N108 F291 F292 | N44-S294 PolarHBondContact ND2-O 2.88Å; D71-S294 VanDerWaalsContact OD1-CB 3.22Å; D71-S294 WeakPolarHBondContact OD1-CB 3.41Å; D71-S294 PolarHBondContact OD1-OG 3.2Å; N108-S294 PolarHBondContact ND2-OG 3.29Å; F291-S294 PolarHBondContact O-N 3.06Å; F291-S294 VanDerWaalsContact O-N 3.17Å; F292-S294 VanDerWaalsContact C-N 3.26Å; F292-S294 PolarHBondContact O-N 2.89Å |
| 295 | C | 86.1 | Confident | 79 | Confident | 1 Ų | 1 | 31.8 Ų | 31.8 | 1% | 0.007 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -91.7 | -24.1 | 173.5 | -65.2 | 0 | 0 | 0 | 0 | 113.3 | T36 I39 G40 F292 N293 | T36-C295 VanDerWaalsContact CA-SG 3.59Å; T36-C295 WeakPolarHBondContact CG2-SG 3.25Å; T36-C295 PolarHBondContact O-SG 2.98Å; I39-C295 HydrophobicContact CB-CB 4.25Å; I39-C295 HydrophobicContact CG2-CB 3.77Å; G40-C295 WeakPolarHBondContact CA-SG 3.5Å; G40-C295 PolarHBondContact N-SG 3.45Å; F292-C295 WeakPolarHBondContact O-CB 3.4Å; F292-C295 PolarHBondContact O-N 3.28Å; N293-C295 PolarHBondContact O-N 3.09Å; N293-C295 VanDerWaalsContact O-N 3.13Å |
| 296 | L | 82.5 | Confident | 77.3 | Confident | 36 Ų | 36 | 36 Ų | 36 | 19% | 0.188 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -76.8 | -27.5 | -179.8 | -64.5 | 178.9 | 0 | 0 | 0 | 111.8 | F292 N293 M299 L300 | F292-L296 HydrophobicContact CD1-CD1 4.04Å; F292-L296 HydrophobicContact CD1-CD2 4.29Å; F292-L296 HydrophobicContact CD1-CG 4.07Å; F292-L296 HydrophobicContact CE1-CD1 4.18Å; F292-L296 HydrophobicContact CE1-CD2 3.7Å; F292-L296 HydrophobicContact CE1-CG 4.01Å; F292-L296 HydrophobicContact CZ-CD2 4.3Å; F292-L296 PolarHBondContact O-N 2.87Å; N293-L296 PolarHBondContact O-N 3.29Å; L296-M299 PolarHBondContact O-N 2.97Å; L296-M299 VanDerWaalsContact O-N 3.14Å; L296-L300 WeakPolarHBondContact O-CG 3.18Å; L296-L300 PolarHBondContact O-N 2.91Å |
| 297 | N | 78.6 | Confident | 75.6 | Confident | 9 Ų | 9 | 40.6 Ų | 40.6 | 5% | 0.048 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -55.2 | -51.2 | -179.2 | -69.3 | -23.2 | 0 | 0 | 0 | 113.1 | L67 D71 N293 M299 L300 Y301 | L67-N297 HydrophobicContact CD2-CB 4.08Å; D71-N297 PolarHBondContact OD2-ND2 3.37Å; N293-N297 PolarHBondContact O-N 2.95Å; N297-M299 PolarHBondContact O-N 3.45Å; N297-L300 PolarHBondContact O-N 3.43Å; N297-Y301 HydrophobicContact CB-CE2 4.4Å; N297-Y301 WeakPolarHBondContact O-CD2 3.47Å; N297-Y301 PolarHBondContact O-N 2.95Å; N297-Y301 VanDerWaalsContact O-N 3.13Å |
| 298 | P | 73.3 | Confident | 73.8 | Confident | 9 Ų | 9 | 40.7 Ų | 40.7 | 6% | 0.058 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -56 | -42.6 | 172.4 | -30 | 36.2 | 0 | 0 | 0 | 114.9 | N44 V47 L300 Y301 V302 | N44-P298 WeakPolarHBondContact OD1-CD 3.42Å; N44-P298 WeakPolarHBondContact OD1-CG 3.46Å; V47-P298 HydrophobicContact CG2-CB 3.83Å; V47-P298 HydrophobicContact CG2-CG 4.21Å; P298-L300 VanDerWaalsContact C-N 3.35Å; P298-Y301 PolarHBondContact O-N 2.9Å; P298-V302 WeakPolarHBondContact O-CG2 3.49Å; P298-V302 PolarHBondContact O-N 2.71Å; P298-V302 VanDerWaalsContact O-N 3.14Å |
| 299 | M | 67.5 | Low | 72.2 | Confident | 79 Ų | 79 | 47 Ų | 47 | 39% | 0.389 | 23% | 0.232 | S | C | . | . | H | α-helix | trans | -64.5 | -44.2 | -179.5 | -63.5 | -171.5 | -176.5 | 0 | 0 | 110.3 | I39 L296 N297 Y301 V302 F303 | I39-M299 HydrophobicContact CG2-CE 3.82Å; L296-M299 PolarHBondContact O-N 2.97Å; L296-M299 VanDerWaalsContact O-N 3.14Å; N297-M299 PolarHBondContact O-N 3.45Å; M299-Y301 VanDerWaalsContact C-N 3.3Å; M299-Y301 PolarHBondContact O-N 3.28Å; M299-V302 PolarHBondContact O-N 2.67Å; M299-F303 HydrophobicContact CB-CD2 4.19Å; M299-F303 HydrophobicContact CB-CE2 4.09Å; M299-F303 WeakPolarHBondContact O-CD2 3.38Å; M299-F303 PolarHBondContact O-N 2.83Å |
| 300 | L | 64 | Low | 70.7 | Confident | 30 Ų | 30 | 50.3 Ų | 50.3 | 16% | 0.157 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -55.4 | -46.7 | 174.4 | -69.3 | 166.1 | 0 | 0 | 0 | 110.1 | V246 L296 N297 P298 V302 F303 V304 | V246-L300 HydrophobicContact CG2-CD1 4.18Å; V246-L300 HydrophobicContact CG2-CD2 3.89Å; V246-L300 HydrophobicContact CG2-CG 4.42Å; L296-L300 WeakPolarHBondContact O-CG 3.18Å; L296-L300 PolarHBondContact O-N 2.91Å; N297-L300 PolarHBondContact O-N 3.43Å; P298-L300 VanDerWaalsContact C-N 3.35Å; L300-V302 PolarHBondContact O-N 2.87Å; L300-F303 PolarHBondContact O-N 3.45Å; L300-V304 VanDerWaalsContact O-CB 3.24Å; L300-V304 WeakPolarHBondContact O-CB 3.32Å; L300-V304 WeakPolarHBondContact O-CG2 3.16Å; L300-V304 PolarHBondContact O-N 2.91Å |
| 301 | Y | 63.8 | Low | 69.4 | Low | 22 Ų | 22 | 55.9 Ų | 55.9 | 9% | 0.086 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -59.9 | -42 | 178.6 | -58.2 | -40.5 | 0 | 0 | 0 | 114.7 | V47 Y64 L67 N297 P298 M299 G305 | V47-Y301 HydrophobicContact CG1-CD2 4.45Å; V47-Y301 HydrophobicContact CG2-CD2 4.44Å; Y64-Y301 AromaticContact CD1-CD1 3.94Å; Y64-Y301 HydrophobicContact CD1-CD1 3.94Å; Y64-Y301 AromaticContact CD1-CE1 3.27Å; Y64-Y301 HydrophobicContact CD1-CE1 3.27Å; Y64-Y301 HydrophobicContact CD1-CE2 4.33Å; Y64-Y301 AromaticContact CD1-CZ 3.45Å; Y64-Y301 VanDerWaalsContact CD1-CZ 3.45Å; Y64-Y301 WeakPolarHBondContact CD1-OH 3.12Å; Y64-Y301 HydrophobicContact CD2-CD1 4.16Å; Y64-Y301 HydrophobicContact CD2-CE1 4.31Å; Y64-Y301 AromaticContact CE1-CD1 3.74Å; Y64-Y301 HydrophobicContact CE1-CD1 3.74Å; Y64-Y301 AromaticContact CE1-CE1 3.19Å; Y64-Y301 HydrophobicContact CE1-CE1 3.19Å; Y64-Y301 AromaticContact CE1-CZ 3.88Å; Y64-Y301 AromaticContact CE2-CD1 3.96Å; Y64-Y301 HydrophobicContact CE2-CD1 3.96Å; Y64-Y301 HydrophobicContact CE2-CE1 4.24Å; Y64-Y301 HydrophobicContact CG-CD1 4.15Å; Y64-Y301 AromaticContact CG-CE1 3.86Å; Y64-Y301 HydrophobicContact CG-CE1 3.86Å; Y64-Y301 HydrophobicContact CG-CE2 4.38Å; Y64-Y301 AromaticContact CG-CZ 3.92Å; Y64-Y301 AromaticContact CZ-CD1 3.75Å; Y64-Y301 AromaticContact CZ-CE1 3.71Å; L67-Y301 HydrophobicContact CD2-CE2 4.42Å; L67-Y301 WeakPolarHBondContact CD2-OH 3.3Å; N297-Y301 HydrophobicContact CB-CE2 4.4Å; N297-Y301 WeakPolarHBondContact O-CD2 3.47Å; N297-Y301 PolarHBondContact O-N 2.95Å; N297-Y301 VanDerWaalsContact O-N 3.13Å; P298-Y301 PolarHBondContact O-N 2.9Å; M299-Y301 VanDerWaalsContact C-N 3.3Å; M299-Y301 PolarHBondContact O-N 3.28Å; Y301-G305 PolarHBondContact O-N 3.4Å |
| 302 | V | 59.8 | Low | 68 | Low | 33 Ų | 33 | 55.7 Ų | 55.7 | 20% | 0.2 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -67.8 | -38.8 | 178.3 | 176.8 | 0 | 0 | 0 | 0 | 111.5 | P298 M299 L300 F308 L312 | P298-V302 WeakPolarHBondContact O-CG2 3.49Å; P298-V302 PolarHBondContact O-N 2.71Å; P298-V302 VanDerWaalsContact O-N 3.14Å; M299-V302 PolarHBondContact O-N 2.67Å; L300-V302 PolarHBondContact O-N 2.87Å; V302-F308 HydrophobicContact CB-CD1 4.32Å; V302-F308 HydrophobicContact CG2-CD1 3.61Å; V302-F308 HydrophobicContact CG2-CE1 3.48Å; V302-F308 VanDerWaalsContact CG2-CE1 3.48Å; V302-L312 HydrophobicContact CG1-CD2 4.35Å; V302-L312 HydrophobicContact CG2-CD2 4.14Å |
| 303 | F | 51.7 | Low | 67 | Low | 142 Ų | 142 | 57.6 Ų | 57.6 | 62% | 0.623 | 28% | 0.277 | S | S | * | . | H | α-helix | trans | -81 | -27.8 | -179.2 | -68.3 | -59.2 | 0 | 0 | 0 | 113.4 | M299 L300 | M299-F303 HydrophobicContact CB-CD2 4.19Å; M299-F303 HydrophobicContact CB-CE2 4.09Å; M299-F303 WeakPolarHBondContact O-CD2 3.38Å; M299-F303 PolarHBondContact O-N 2.83Å; L300-F303 PolarHBondContact O-N 3.45Å |
| 304 | V | 54.1 | Low | 66.1 | Low | 65 Ų | 65 | 64.4 Ų | 64.4 | 39% | 0.394 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -79.2 | -43.8 | 176 | 179.9 | 0 | 0 | 0 | 0 | 111.4 | V242 L300 | V242-V304 HydrophobicContact CB-CG2 4.49Å; V242-V304 HydrophobicContact CG1-CB 3.81Å; V242-V304 HydrophobicContact CG1-CG1 3.79Å; V242-V304 HydrophobicContact CG1-CG2 3.08Å; L300-V304 VanDerWaalsContact O-CB 3.24Å; L300-V304 WeakPolarHBondContact O-CB 3.32Å; L300-V304 WeakPolarHBondContact O-CG2 3.16Å; L300-V304 PolarHBondContact O-N 2.91Å |
| 305 | G | 57.3 | Low | 65.3 | Low | 24 Ų | 24 | 65 Ų | 65 | 25% | 0.247 | 31% | 0.312 | C | S | . | . | trans | -97.8 | 104.8 | -170.2 | 0 | 0 | 0 | 0 | 0 | 113.7 | Y301 D307 F308 R309 | Y301-G305 PolarHBondContact O-N 3.4Å; G305-D307 PolarHBondContact O-N 3.46Å; G305-F308 PolarHBondContact O-N 3.38Å; G305-R309 PolarHBondContact O-N 2.93Å | ||
| 306 | Q | 57.2 | Low | 64.6 | Low | 112 Ų | 112 | 68.8 Ų | 68.8 | 52% | 0.523 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -57.9 | -36.1 | 173 | -67.2 | -164.2 | 0.2 | 0 | 0 | 112.3 | K310 | Q306-K310 WeakPolarHBondContact O-CG 3.3Å; Q306-K310 PolarHBondContact O-N 3.32Å |
| 307 | D | 57.9 | Low | 64 | Low | 114 Ų | 114 | 70.5 Ų | 70.5 | 61% | 0.61 | 35% | 0.345 | S | S | * | . | H | α-helix | trans | -72.8 | -33.8 | 178.8 | -59.2 | -39 | 0 | 0 | 0 | 112.8 | G305 R311 | G305-D307 PolarHBondContact O-N 3.46Å; D307-R311 PolarHBondContact O-N 3.41Å |
| 308 | F | 54.3 | Low | 63.4 | Low | 16 Ų | 16 | 72.2 Ų | 72.2 | 7% | 0.07 | 36% | 0.358 | C | S | . | . | H | α-helix | trans | -66.9 | -47.2 | 174.3 | -167 | -86.7 | 0 | 0 | 0 | 110.8 | V47 V50 M55 V302 G305 K310 R311 L312 | V47-F308 HydrophobicContact CG2-CZ 4.04Å; V50-F308 HydrophobicContact CB-CE2 4.16Å; V50-F308 HydrophobicContact CB-CZ 4.14Å; V50-F308 HydrophobicContact CG1-CD2 4.32Å; V50-F308 HydrophobicContact CG1-CE2 3.76Å; V50-F308 HydrophobicContact CG1-CZ 4.05Å; M55-F308 HydrophobicContact CE-CB 4Å; M55-F308 HydrophobicContact CE-CD2 3.57Å; M55-F308 HydrophobicContact CE-CE2 4.42Å; M55-F308 HydrophobicContact CE-CG 4.12Å; M55-F308 HydrophobicContact SD-CD2 3.93Å; M55-F308 HydrophobicContact SD-CE2 4.39Å; V302-F308 HydrophobicContact CB-CD1 4.32Å; V302-F308 HydrophobicContact CG2-CD1 3.61Å; V302-F308 HydrophobicContact CG2-CE1 3.48Å; V302-F308 VanDerWaalsContact CG2-CE1 3.48Å; G305-F308 PolarHBondContact O-N 3.38Å; F308-K310 PolarHBondContact O-N 2.94Å; F308-R311 PolarHBondContact O-N 3.28Å; F308-L312 VanDerWaalsContact O-CB 3.27Å; F308-L312 WeakPolarHBondContact O-CB 3.47Å; F308-L312 PolarHBondContact O-N 3.21Å |
| 309 | R | 62.1 | Low | 62.9 | Low | 138 Ų | 138 | 73.2 Ų | 73.2 | 52% | 0.521 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -58.5 | -45.4 | 175.2 | -176.6 | 176.8 | 172.3 | -170.9 | -2.8 | 112.2 | G305 L312 I313 | G305-R309 PolarHBondContact O-N 2.93Å; R309-L312 PolarHBondContact O-N 3.25Å; R309-I313 HydrophobicContact CG-CD1 3.72Å; R309-I313 HydrophobicContact CG-CG1 4.46Å; R309-I313 WeakPolarHBondContact O-CB 3.35Å; R309-I313 VanDerWaalsContact O-CG1 3.24Å; R309-I313 WeakPolarHBondContact O-CG1 3.38Å; R309-I313 PolarHBondContact O-N 2.94Å |
| 310 | K | 63.5 | Low | 62.7 | Low | 134 Ų | 134 | 74.5 Ų | 74.5 | 58% | 0.583 | 37% | 0.373 | S | S | * | . | H | α-helix | trans | -60.9 | -47.1 | 178.1 | -77.7 | 177.5 | -177.4 | 178 | 0 | 112.2 | Q306 F308 I313 H314 | Q306-K310 WeakPolarHBondContact O-CG 3.3Å; Q306-K310 PolarHBondContact O-N 3.32Å; F308-K310 PolarHBondContact O-N 2.94Å; K310-I313 PolarHBondContact O-N 3.27Å; K310-H314 WeakPolarHBondContact O-CB 3.29Å; K310-H314 PolarHBondContact O-N 2.72Å |
| 311 | R | 63.2 | Low | 62.9 | Low | 117 Ų | 117 | 79.2 Ų | 79.2 | 44% | 0.442 | 39% | 0.394 | S | S | . | . | H | α-helix | trans | -68 | -36.5 | 178.5 | -74.7 | -167.5 | -171.9 | -114 | -7.1 | 112.7 | R54 M55 D307 F308 H314 S315 | R54-R311 PolarHBondContact O-NH1 3.23Å; M55-R311 HydrophobicContact CE-CB 4.21Å; M55-R311 HydrophobicContact CE-CG 4.34Å; D307-R311 PolarHBondContact O-N 3.41Å; F308-R311 PolarHBondContact O-N 3.28Å; R311-H314 PolarHBondContact O-N 3Å; R311-S315 VanDerWaalsContact O-CB 3.22Å; R311-S315 WeakPolarHBondContact O-CB 3.49Å; R311-S315 PolarHBondContact O-N 3.5Å; R311-S315 PolarHBondContact O-OG 3.38Å |
| 312 | L | 62.5 | Low | 62.9 | Low | 23 Ų | 23 | 86.1 Ų | 86.1 | 12% | 0.12 | 42% | 0.42 | C | S | . | . | H | α-helix | trans | -61.1 | -50 | 175.5 | -174.9 | 68.6 | 0 | 0 | 0 | 110.9 | L46 V50 V302 F308 R309 H314 S315 L316 | L46-L312 HydrophobicContact CD1-CD1 3.9Å; L46-L312 HydrophobicContact CD2-CD1 3.66Å; L46-L312 HydrophobicContact CG-CD1 3.83Å; V50-L312 HydrophobicContact CG2-CD1 4.06Å; V302-L312 HydrophobicContact CG1-CD2 4.35Å; V302-L312 HydrophobicContact CG2-CD2 4.14Å; F308-L312 VanDerWaalsContact O-CB 3.27Å; F308-L312 WeakPolarHBondContact O-CB 3.47Å; F308-L312 PolarHBondContact O-N 3.21Å; R309-L312 PolarHBondContact O-N 3.25Å; L312-H314 VanDerWaalsContact C-N 3.26Å; L312-H314 PolarHBondContact O-N 2.96Å; L312-S315 PolarHBondContact O-N 3.48Å; L312-L316 HydrophobicContact CD1-CD1 3.57Å; L312-L316 HydrophobicContact CG-CD1 3.75Å; L312-L316 WeakPolarHBondContact O-CB 3.38Å; L312-L316 PolarHBondContact O-N 3.45Å |
| 313 | I | 69.5 | Low | 62.7 | Low | 102 Ų | 102 | 87 Ų | 87 | 52% | 0.523 | 43% | 0.431 | S | S | . | . | H | α-helix | trans | -62.7 | -31.5 | 178.3 | -67.4 | 169.2 | 0 | 0 | 0 | 111.9 | R309 K310 P317 | R309-I313 HydrophobicContact CG-CD1 3.72Å; R309-I313 HydrophobicContact CG-CG1 4.46Å; R309-I313 WeakPolarHBondContact O-CB 3.35Å; R309-I313 VanDerWaalsContact O-CG1 3.24Å; R309-I313 WeakPolarHBondContact O-CG1 3.38Å; R309-I313 PolarHBondContact O-N 2.94Å; K310-I313 PolarHBondContact O-N 3.27Å; I313-P317 WeakPolarHBondContact O-CD 3.22Å; I313-P317 WeakPolarHBondContact O-CG 3.34Å |
| 314 | H | 71.6 | Confident | 63.2 | Low | 146 Ų | 146 | 84.9 Ų | 84.9 | 68% | 0.676 | 43% | 0.426 | S | S | * | . | H | α-helix | trans | -82.3 | -32.9 | 177.6 | -167.6 | -90 | 0 | 0 | 0 | 113.3 | K310 R311 L312 S318 | K310-H314 WeakPolarHBondContact O-CB 3.29Å; K310-H314 PolarHBondContact O-N 2.72Å; R311-H314 PolarHBondContact O-N 3Å; L312-H314 VanDerWaalsContact C-N 3.26Å; L312-H314 PolarHBondContact O-N 2.96Å; H314-S318 PolarHBondContact O-OG 3.5Å |
| 315 | S | 70.4 | Confident | 63.6 | Low | 13 Ų | 13 | 84.9 Ų | 84.9 | 9% | 0.091 | 43% | 0.429 | C | S | . | . | H | α-helix | trans | -85.5 | -31 | -173.3 | -53.5 | 0 | 0 | 0 | 0 | 113.4 | R311 L312 S318 S319 | R311-S315 VanDerWaalsContact O-CB 3.22Å; R311-S315 WeakPolarHBondContact O-CB 3.49Å; R311-S315 PolarHBondContact O-N 3.5Å; R311-S315 PolarHBondContact O-OG 3.38Å; L312-S315 PolarHBondContact O-N 3.48Å; S315-S318 WeakPolarHBondContact CA-OG 3.42Å; S315-S318 PolarHBondContact O-OG 2.88Å; S315-S319 VanDerWaalsContact O-CB 3.29Å; S315-S319 WeakPolarHBondContact O-CB 3.41Å; S315-S319 PolarHBondContact O-N 3.36Å; S315-S319 VanDerWaalsContact O-N 3.08Å; S315-S319 PolarHBondContact O-OG 2.61Å |
| 316 | L | 71.1 | Confident | 63.4 | Low | 80 Ų | 80 | 89.3 Ų | 89.3 | 42% | 0.419 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -65.4 | -53.7 | 178.9 | -105.8 | 142.3 | 0 | 0 | 0 | 112.3 | L312 S318 S319 L320 | L312-L316 HydrophobicContact CD1-CD1 3.57Å; L312-L316 HydrophobicContact CG-CD1 3.75Å; L312-L316 WeakPolarHBondContact O-CB 3.38Å; L312-L316 PolarHBondContact O-N 3.45Å; L316-S318 PolarHBondContact O-N 3.34Å; L316-S319 PolarHBondContact O-N 2.89Å; L316-L320 WeakPolarHBondContact O-CB 3.49Å; L316-L320 PolarHBondContact O-N 3.43Å |
| 317 | P | 70.4 | Confident | 63 | Low | 73 Ų | 73 | 88.9 Ų | 88.9 | 47% | 0.474 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -61.9 | -44.3 | 179.2 | -22.2 | 33.9 | 0 | 0 | 0 | 111.8 | I313 S319 L320 E321 | I313-P317 WeakPolarHBondContact O-CD 3.22Å; I313-P317 WeakPolarHBondContact O-CG 3.34Å; P317-S319 VanDerWaalsContact C-N 3.3Å; P317-S319 PolarHBondContact O-N 3.23Å; P317-L320 PolarHBondContact O-N 3.32Å; P317-E321 WeakPolarHBondContact O-CB 3.3Å; P317-E321 PolarHBondContact O-N 3.38Å |
| 318 | S | 66.2 | Low | 62.6 | Low | 45 Ų | 45 | 87.8 Ų | 87.8 | 32% | 0.315 | 44% | 0.442 | S | S | . | . | H | α-helix | trans | -67.1 | -27.5 | -179.8 | 54.1 | 0 | 0 | 0 | 0 | 113.9 | H314 S315 L316 R322 | H314-S318 PolarHBondContact O-OG 3.5Å; S315-S318 WeakPolarHBondContact CA-OG 3.42Å; S315-S318 PolarHBondContact O-OG 2.88Å; L316-S318 PolarHBondContact O-N 3.34Å; S318-R322 WeakPolarHBondContact O-CB 3.4Å; S318-R322 PolarHBondContact O-N 2.95Å |
| 319 | S | 62.8 | Low | 62.4 | Low | 29 Ų | 29 | 90 Ų | 90 | 20% | 0.203 | 46% | 0.463 | C | S | . | . | H | α-helix | trans | -84.8 | -34.7 | 175.2 | -55 | 0 | 0 | 0 | 0 | 111.9 | W49 R54 S315 L316 P317 R322 A323 | W49-S319 VanDerWaalsContact CH2-OG 3.22Å; W49-S319 WeakPolarHBondContact CH2-OG 3.4Å; W49-S319 WeakPolarHBondContact CZ2-OG 3.33Å; R54-S319 PolarHBondContact NH2-OG 3.21Å; S315-S319 VanDerWaalsContact O-CB 3.29Å; S315-S319 WeakPolarHBondContact O-CB 3.41Å; S315-S319 PolarHBondContact O-N 3.36Å; S315-S319 VanDerWaalsContact O-N 3.08Å; S315-S319 PolarHBondContact O-OG 2.61Å; L316-S319 PolarHBondContact O-N 2.89Å; P317-S319 VanDerWaalsContact C-N 3.3Å; P317-S319 PolarHBondContact O-N 3.23Å; S319-R322 PolarHBondContact O-N 3.05Å; S319-A323 WeakPolarHBondContact O-CB 3.22Å; S319-A323 PolarHBondContact O-N 3.35Å |
| 320 | L | 62.9 | Low | 61.7 | Low | 107 Ų | 107 | 90.4 Ų | 90.4 | 56% | 0.56 | 47% | 0.471 | S | S | * | . | H | α-helix | trans | -65.1 | -43.9 | 171.7 | -158.5 | 96.1 | 0 | 0 | 0 | 110.7 | L316 P317 R322 A323 L324 | L316-L320 WeakPolarHBondContact O-CB 3.49Å; L316-L320 PolarHBondContact O-N 3.43Å; P317-L320 PolarHBondContact O-N 3.32Å; L320-R322 VanDerWaalsContact C-N 3.34Å; L320-R322 PolarHBondContact O-N 3.42Å; L320-A323 PolarHBondContact O-N 2.91Å; L320-L324 HydrophobicContact CD2-CD1 3.84Å; L320-L324 HydrophobicContact CG-CD1 3.98Å; L320-L324 VanDerWaalsContact O-CB 3.3Å; L320-L324 WeakPolarHBondContact O-CB 3.26Å; L320-L324 WeakPolarHBondContact O-CD1 3.36Å; L320-L324 WeakPolarHBondContact O-CG 3.5Å; L320-L324 PolarHBondContact O-N 2.86Å |
| 321 | E | 68.7 | Low | 60.8 | Low | 129 Ų | 129 | 89.3 Ų | 89.3 | 60% | 0.603 | 48% | 0.475 | S | S | * | . | H | α-helix | trans | -62.9 | -40.4 | 176 | -175 | 176.5 | -166.9 | 0 | 0 | 111.2 | P317 S325 | P317-E321 WeakPolarHBondContact O-CB 3.3Å; P317-E321 PolarHBondContact O-N 3.38Å; E321-S325 WeakPolarHBondContact O-CB 3.45Å; E321-S325 PolarHBondContact O-N 3.18Å; E321-S325 PolarHBondContact O-OG 3.34Å |
| 322 | R | 64 | Low | 59.9 | Low | 166 Ų | 166 | 87.7 Ų | 87.7 | 63% | 0.626 | 48% | 0.482 | S | S | * | . | H | α-helix | trans | -65.9 | -44.3 | 174.9 | -155.8 | -176.9 | -141.4 | 108.3 | -0.6 | 112.1 | S318 S319 L320 S325 E326 | S318-R322 WeakPolarHBondContact O-CB 3.4Å; S318-R322 PolarHBondContact O-N 2.95Å; S319-R322 PolarHBondContact O-N 3.05Å; L320-R322 VanDerWaalsContact C-N 3.34Å; L320-R322 PolarHBondContact O-N 3.42Å; R322-S325 PolarHBondContact O-N 3.49Å; R322-E326 WeakPolarHBondContact O-CB 3.26Å; R322-E326 WeakPolarHBondContact O-CG 3.2Å; R322-E326 PolarHBondContact O-N 3.14Å |
| 323 | A | 55.9 | Low | 58.9 | Low | 52 Ų | 52 | 89.7 Ų | 89.7 | 43% | 0.43 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -63.6 | -43.9 | 176.5 | 0 | 0 | 0 | 0 | 0 | 111.9 | S319 L320 E326 D327 | S319-A323 WeakPolarHBondContact O-CB 3.22Å; S319-A323 PolarHBondContact O-N 3.35Å; L320-A323 PolarHBondContact O-N 2.91Å; A323-E326 PolarHBondContact O-N 3.24Å; A323-D327 PolarHBondContact O-N 3.14Å; A323-D327 VanDerWaalsContact O-N 3.15Å |
| 324 | L | 61.2 | Low | 57.4 | Low | 97 Ų | 97 | 91 Ų | 91 | 51% | 0.508 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -67.8 | -34.1 | 176.7 | -69.9 | 166.8 | 0 | 0 | 0 | 112.4 | L320 T328 | L320-L324 HydrophobicContact CD2-CD1 3.84Å; L320-L324 HydrophobicContact CG-CD1 3.98Å; L320-L324 VanDerWaalsContact O-CB 3.3Å; L320-L324 WeakPolarHBondContact O-CB 3.26Å; L320-L324 WeakPolarHBondContact O-CD1 3.36Å; L320-L324 WeakPolarHBondContact O-CG 3.5Å; L320-L324 PolarHBondContact O-N 2.86Å; L324-T328 WeakPolarHBondContact O-CB 3.31Å; L324-T328 PolarHBondContact O-N 2.86Å; L324-T328 VanDerWaalsContact O-N 3.08Å; L324-T328 PolarHBondContact O-OG1 3.29Å |
| 325 | S | 62.3 | Low | 55.9 | Low | 66 Ų | 66 | 87.2 Ų | 87.2 | 46% | 0.462 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -72.9 | -34.7 | 176.5 | -60 | 0 | 0 | 0 | 0 | 112.2 | E321 R322 T328 A329 | E321-S325 WeakPolarHBondContact O-CB 3.45Å; E321-S325 PolarHBondContact O-N 3.18Å; E321-S325 PolarHBondContact O-OG 3.34Å; R322-S325 PolarHBondContact O-N 3.49Å; S325-T328 PolarHBondContact O-N 2.99Å; S325-A329 WeakPolarHBondContact O-CB 3.38Å; S325-A329 PolarHBondContact O-N 3.45Å |
| 326 | E | 54.7 | Low | 54.3 | Low | 116 Ų | 116 | 92.8 Ų | 92.8 | 54% | 0.542 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -65.9 | -40.5 | 173.3 | -77.6 | 173 | -173.3 | 0 | 0 | 111.6 | R322 A323 A329 Q330 | R322-E326 WeakPolarHBondContact O-CB 3.26Å; R322-E326 WeakPolarHBondContact O-CG 3.2Å; R322-E326 PolarHBondContact O-N 3.14Å; A323-E326 PolarHBondContact O-N 3.24Å; E326-A329 PolarHBondContact O-N 3.07Å; E326-Q330 PolarHBondContact O-N 3.22Å; E326-Q330 VanDerWaalsContact O-N 3.12Å |
| 327 | D | 48.6 | Very low | 52.6 | Low | 104 Ų | 104 | 99.1 Ų | 99.1 | 56% | 0.556 | 58% | 0.579 | S | S | * | * | H | α-helix | trans | -65.9 | -36 | 173.3 | -84.8 | -16.4 | 0 | 0 | 0 | 112.7 | A323 Q330 T331 | A323-D327 PolarHBondContact O-N 3.14Å; A323-D327 VanDerWaalsContact O-N 3.15Å; D327-Q330 PolarHBondContact O-N 2.84Å; D327-T331 PolarHBondContact O-N 3.12Å; D327-T331 PolarHBondContact O-OG1 3.49Å |
| 328 | T | 48.1 | Very low | 51 | Low | 90 Ų | 90 | 101.3 Ų | 101.3 | 55% | 0.552 | 60% | 0.597 | S | S | * | * | H | α-helix | trans | -71.8 | -33.2 | 177.2 | -51.1 | 0 | 0 | 0 | 0 | 111.8 | L324 S325 T331 S332 | L324-T328 WeakPolarHBondContact O-CB 3.31Å; L324-T328 PolarHBondContact O-N 2.86Å; L324-T328 VanDerWaalsContact O-N 3.08Å; L324-T328 PolarHBondContact O-OG1 3.29Å; S325-T328 PolarHBondContact O-N 2.99Å; T328-T331 PolarHBondContact O-OG1 3.33Å; T328-S332 PolarHBondContact O-N 3.28Å; T328-S332 PolarHBondContact O-OG 2.94Å |
| 329 | A | 51.6 | Low | 49.6 | Very low | 62 Ų | 62 | 104 Ų | 104 | 51% | 0.512 | 62% | 0.622 | S | S | . | * | H | α-helix | trans | -72.3 | -31 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | S325 E326 S332 G333 | S325-A329 WeakPolarHBondContact O-CB 3.38Å; S325-A329 PolarHBondContact O-N 3.45Å; E326-A329 PolarHBondContact O-N 3.07Å; A329-S332 WeakPolarHBondContact CA-OG 3.28Å; A329-S332 PolarHBondContact O-OG 2.75Å; A329-G333 PolarHBondContact O-N 2.91Å |
| 330 | Q | 46.6 | Very low | 48.3 | Very low | 147 Ų | 147 | 108.6 Ų | 108.6 | 69% | 0.687 | 65% | 0.654 | S | S | * | * | H | α-helix | trans | -77.1 | -33.3 | 176 | -75.1 | -175.1 | 0.3 | 0 | 0 | 113.2 | E326 D327 | E326-Q330 PolarHBondContact O-N 3.22Å; E326-Q330 VanDerWaalsContact O-N 3.12Å; D327-Q330 PolarHBondContact O-N 2.84Å |
| 331 | T | 44.8 | Very low | 47.1 | Very low | 111 Ų | 111 | 108.7 Ų | 108.7 | 68% | 0.681 | 66% | 0.663 | S | S | * | * | H | α-helix | trans | -76.9 | -23.8 | 176 | 34 | 0 | 0 | 0 | 0 | 113.8 | D327 T328 | D327-T331 PolarHBondContact O-N 3.12Å; D327-T331 PolarHBondContact O-OG1 3.49Å; T328-T331 PolarHBondContact O-OG1 3.33Å |
| 332 | S | 43.4 | Very low | 45.6 | Very low | 84 Ų | 84 | 110.9 Ų | 110.9 | 59% | 0.587 | 68% | 0.678 | S | S | * | * | H | α-helix | trans | -84.4 | -12.7 | 174.2 | 48.9 | 0 | 0 | 0 | 0 | 114 | T328 A329 | T328-S332 PolarHBondContact O-N 3.28Å; T328-S332 PolarHBondContact O-OG 2.94Å; A329-S332 WeakPolarHBondContact CA-OG 3.28Å; A329-S332 PolarHBondContact O-OG 2.75Å |
| 333 | G | 41.8 | Very low | 44.3 | Very low | 65 Ų | 65 | 107.3 Ų | 107.3 | 67% | 0.67 | 68% | 0.684 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.9 | -8 | -178.5 | 0 | 0 | 0 | 0 | 0 | 116.3 | A329 | A329-G333 PolarHBondContact O-N 2.91Š|
| 334 | T | 37.5 | Very low | 43.4 | Very low | 130 Ų | 130 | 112.8 Ų | 112.8 | 80% | 0.798 | 71% | 0.707 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -104.9 | 2.7 | -176.1 | -13.6 | 0 | 0 | 0 | 0 | 114.5 | ||
| 335 | G | 39.8 | Very low | 42.4 | Very low | 66 Ų | 66 | 116.3 Ų | 116.3 | 68% | 0.68 | 72% | 0.724 | S | S | * | * | S | Bend | trans | -101.9 | -6.5 | -172.6 | 0 | 0 | 0 | 0 | 0 | 117.7 | ||
| 336 | T | 38.3 | Very low | 41.2 | Very low | 130 Ų | 130 | 121.9 Ų | 121.9 | 80% | 0.798 | 74% | 0.743 | S | S | * | * | S | Bend | trans | -143.9 | 53.1 | -168.1 | -29.1 | 0 | 0 | 0 | 0 | 114.4 | ||
| 337 | K | 35.3 | Very low | 40.6 | Very low | 212 Ų | 212 | 124.8 Ų | 124.8 | 92% | 0.922 | 76% | 0.76 | S | S | * | * | trans | -139.1 | 66.1 | 163.4 | -77.4 | -169.6 | 178.8 | 177.9 | 0 | 111.3 | ||||
| 338 | S | 35.8 | Very low | 40.1 | Very low | 120 Ų | 120 | 129.9 Ų | 129.9 | 84% | 0.839 | 78% | 0.777 | S | S | * | * | S | Bend | trans | -165.1 | 62.5 | 161.5 | 178.2 | 0 | 0 | 0 | 0 | 111 | ||
| 339 | A | 36.7 | Very low | 39.5 | Very low | 102 Ų | 102 | 129.9 Ų | 129.9 | 84% | 0.843 | 79% | 0.787 | S | S | * | * | S | Bend | trans | -172.1 | 60.6 | 161.1 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||
| 340 | S | 35.5 | Very low | 38.8 | Very low | 125 Ų | 125 | 138.7 Ų | 138.7 | 87% | 0.874 | 82% | 0.823 | S | S | * | * | S | Bend | trans | -162.1 | 40.2 | 166.4 | 66.7 | 0 | 0 | 0 | 0 | 114.3 | ||
| 341 | S | 38.6 | Very low | 38.4 | Very low | 109 Ų | 109 | 138.3 Ų | 138.3 | 76% | 0.762 | 83% | 0.829 | S | S | * | * | S | Bend | trans | -133.7 | 28.6 | 178.4 | 77.6 | 0 | 0 | 0 | 0 | 115.9 | ||
| 342 | L | 37 | Very low | 38.1 | Very low | 174 Ų | 174 | 139.7 Ų | 139.7 | 91% | 0.911 | 84% | 0.837 | S | S | * | * | S | Bend | trans | -152.1 | 82.3 | 169.7 | -91.9 | 122.8 | 0 | 0 | 0 | 110.3 | ||
| 343 | A | 36.2 | Very low | 37.8 | Very low | 92 Ų | 92 | 142.8 Ų | 142.8 | 76% | 0.76 | 85% | 0.851 | S | S | * | * | S | Bend | trans | -159.9 | -3.9 | 162.4 | 0 | 0 | 0 | 0 | 0 | 115.4 | ||
| 344 | D | 37.1 | Very low | 37.6 | Very low | 167 Ų | 167 | 147.4 Ų | 147.4 | 89% | 0.893 | 86% | 0.862 | S | S | * | * | S | Bend | trans | -111.2 | 40.4 | -178.8 | -74.5 | -27.1 | 0 | 0 | 0 | 113.6 | ||
| 345 | I | 41 | Very low | 37.6 | Very low | 170 Ų | 170 | 148.5 Ų | 148.5 | 87% | 0.872 | 87% | 0.866 | S | S | * | * | trans | -135.7 | 67.4 | 165.9 | -49.8 | 179 | 0 | 0 | 0 | 109.2 | ||||
| 346 | E | 37.8 | Very low | 37.4 | Very low | 184 Ų | 184 | 154 Ų | 154 | 86% | 0.86 | 88% | 0.878 | S | S | * | * | trans | -164.3 | 100.9 | 151.6 | -127.9 | 173.6 | 175.7 | 0 | 0 | 108.9 | ||||
| 347 | I | 40.5 | Very low | 37.4 | Very low | 177 Ų | 177 | 155.7 Ų | 155.7 | 91% | 0.908 | 88% | 0.884 | S | S | * | * | trans | 177.9 | 80.7 | 143.4 | -81.2 | 148.4 | 0 | 0 | 0 | 105.1 | ||||
| 348 | K | 38.3 | Very low | 37.5 | Very low | 211 Ų | 211 | 151.4 Ų | 151.4 | 92% | 0.917 | 88% | 0.881 | S | S | * | * | trans | -155.2 | 68.2 | 155.7 | -150.2 | 179.4 | -170.1 | -178.8 | 0 | 109.4 | ||||
| 349 | A | 36.8 | Very low | 37.7 | Very low | 90 Ų | 90 | 154 Ų | 154 | 74% | 0.744 | 88% | 0.884 | S | S | * | * | trans | -157.6 | 118.3 | 157.7 | 0 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 350 | I | 36.6 | Very low | 37.8 | Very low | 247 Ų | 247 | 158.7 Ų | 158.7 | 100% | 1.267 | 89% | 0.888 | S | S | * | * | trans | 83.6 | 0 | 166.7 | -48.7 | 177.4 | 0 | 0 | 0 | 115.6 |
Retrieved 350 of 350 residues in 175.1 ms
(Link to these results)