| 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 | 39.9 | Very low | 38.7 | Very low | 218 Ų | 218 | 151 Ų | 151 | 100% | 1.074 | 78% | 0.778 | S | S | * | * | 0 | 84.7 | 0 | -94.2 | -171.5 | -176.7 | 0 | 0 | 103.5 | Y3 | M1-Y3 PolarHBondContact O-N 3.44Š| |||
| 2 | D | 33.5 | Very low | 38.8 | Very low | 153 Ų | 153 | 150.3 Ų | 150.3 | 82% | 0.818 | 78% | 0.775 | S | S | * | * | trans | -100.2 | 104.8 | -158.4 | -62.4 | -0.5 | 0 | 0 | 0 | 107.7 | Q4 | D2-Q4 PolarHBondContact O-N 3.25Š| ||
| 3 | Y | 40.9 | Very low | 38.8 | Very low | 222 Ų | 222 | 148.4 Ų | 148.4 | 87% | 0.871 | 77% | 0.767 | S | S | * | * | trans | -72.7 | 104 | 169 | -81 | -91.7 | 0 | 0 | 0 | 108.4 | M1 | M1-Y3 PolarHBondContact O-N 3.44Š| ||
| 4 | Q | 35.3 | Very low | 38.8 | Very low | 180 Ų | 180 | 152.6 Ų | 152.6 | 84% | 0.841 | 77% | 0.77 | S | S | * | * | trans | -93.7 | 99.5 | 163.1 | -87 | 173.3 | -41.8 | 0 | 0 | 109.1 | D2 | D2-Q4 PolarHBondContact O-N 3.25Š| ||
| 5 | V | 48.1 | Very low | 39.1 | Very low | 141 Ų | 141 | 156.3 Ų | 156.3 | 86% | 0.855 | 77% | 0.773 | S | S | * | * | trans | -90.2 | 101.9 | 156.8 | 178.1 | 0 | 0 | 0 | 0 | 106.1 | ||||
| 6 | S | 36.9 | Very low | 39.6 | Very low | 106 Ų | 106 | 154.3 Ų | 154.3 | 74% | 0.741 | 77% | 0.772 | S | S | * | * | trans | -130.5 | 97.3 | 170.1 | 60.8 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 7 | S | 42.1 | Very low | 40 | Very low | 85 Ų | 85 | 151.9 Ų | 151.9 | 59% | 0.594 | 77% | 0.774 | S | S | * | * | trans | -144.2 | 132.2 | 154.5 | -174.5 | 0 | 0 | 0 | 0 | 107.4 | I9 | S7-I9 PolarHBondContact OG-N 3.2Š| ||
| 8 | P | 39.3 | Very low | 40.7 | Very low | 102 Ų | 102 | 153.7 Ų | 153.7 | 66% | 0.662 | 78% | 0.779 | S | S | * | * | -131.8 | 77.9 | 120.8 | 36.3 | -24.2 | 0 | 0 | 0 | 109.3 | Y10 | P8-Y10 HydrophobicContact CB-CD2 4.5Å; P8-Y10 HydrophobicContact CB-CE2 4.21Å; P8-Y10 PolarHBondContact O-N 3.34Å | |||
| 9 | I | 38 | Very low | 41.8 | Very low | 132 Ų | 132 | 151.6 Ų | 151.6 | 68% | 0.677 | 78% | 0.777 | S | S | * | * | trans | -70.8 | 108.5 | 141.7 | -62.1 | 176.6 | 0 | 0 | 0 | 103.8 | S7 D11 | S7-I9 PolarHBondContact OG-N 3.2Å; I9-D11 PolarHBondContact O-N 3.02Å | ||
| 10 | Y | 36.8 | Very low | 43 | Very low | 205 Ų | 205 | 146.3 Ų | 146.3 | 80% | 0.804 | 75% | 0.753 | S | S | * | * | trans | -65.3 | 85.7 | 169.9 | -72.2 | -87.6 | 0 | 0 | 0 | 107.6 | P8 I12 | P8-Y10 HydrophobicContact CB-CD2 4.5Å; P8-Y10 HydrophobicContact CB-CE2 4.21Å; P8-Y10 PolarHBondContact O-N 3.34Å; Y10-I12 VanDerWaalsContact C-N 3.33Å; Y10-I12 PolarHBondContact O-N 3.45Å | ||
| 11 | D | 34.8 | Very low | 44.1 | Very low | 117 Ų | 117 | 146.4 Ų | 146.4 | 63% | 0.626 | 75% | 0.75 | S | S | * | * | trans | -64.2 | 100.6 | 162.5 | -83.8 | -26.5 | 0 | 0 | 0 | 106.7 | I9 N13 | I9-D11 PolarHBondContact O-N 3.02Å; D11-N13 PolarHBondContact O-N 3.14Å | ||
| 12 | I | 40.4 | Very low | 45.4 | Very low | 143 Ų | 143 | 140.1 Ų | 140.1 | 73% | 0.733 | 72% | 0.717 | S | S | * | * | trans | -69.1 | 79.1 | 162.1 | -59.1 | 175.4 | 0 | 0 | 0 | 105.8 | Y10 Y14 | Y10-I12 VanDerWaalsContact C-N 3.33Å; Y10-I12 PolarHBondContact O-N 3.45Å; I12-Y14 VanDerWaalsContact C-N 3.31Å; I12-Y14 HydrophobicContact CG2-CD2 3.85Å; I12-Y14 HydrophobicContact CG2-CE2 4.2Å; I12-Y14 PolarHBondContact O-N 3.35Å | ||
| 13 | N | 38.7 | Very low | 47 | Very low | 125 Ų | 125 | 137.1 Ų | 137.1 | 67% | 0.668 | 70% | 0.7 | S | S | * | * | trans | -71.9 | 86.3 | 173 | -86.7 | -41.6 | 0 | 0 | 0 | 109.2 | D11 Y15 | D11-N13 PolarHBondContact O-N 3.14Å; N13-Y15 PolarHBondContact O-N 3.1Å | ||
| 14 | Y | 38.1 | Very low | 48.3 | Very low | 208 Ų | 208 | 132.1 Ų | 132.1 | 82% | 0.816 | 69% | 0.688 | S | S | * | * | trans | -79.7 | 99.8 | 152.2 | -93.3 | -88.7 | 0 | 0 | 0 | 107.7 | I12 T16 | I12-Y14 VanDerWaalsContact C-N 3.31Å; I12-Y14 HydrophobicContact CG2-CD2 3.85Å; I12-Y14 HydrophobicContact CG2-CE2 4.2Å; I12-Y14 PolarHBondContact O-N 3.35Å; Y14-T16 PolarHBondContact O-N 3.28Å | ||
| 15 | Y | 43.7 | Very low | 50.1 | Low | 208 Ų | 208 | 124.8 Ų | 124.8 | 82% | 0.816 | 66% | 0.656 | S | S | * | * | trans | -54.5 | 130 | 162.3 | -108.2 | -103.8 | 0 | 0 | 0 | 108.5 | N13 | N13-Y15 PolarHBondContact O-N 3.1Š| ||
| 16 | T | 46.7 | Very low | 51.3 | Low | 124 Ų | 124 | 123.7 Ų | 123.7 | 76% | 0.761 | 64% | 0.639 | S | S | * | * | S | Bend | trans | 90 | 112.6 | 177.6 | 64.6 | 0 | 0 | 0 | 0 | 118 | Y14 | Y14-T16 PolarHBondContact O-N 3.28Š|
| 17 | S | 47 | Very low | 53.4 | Low | 114 Ų | 114 | 124.1 Ų | 124.1 | 80% | 0.797 | 63% | 0.63 | S | S | * | * | trans | 75.3 | 85.1 | 164 | -37 | 0 | 0 | 0 | 0 | 116.6 | ||||
| 18 | E | 51.8 | Low | 55.2 | Low | 184 Ų | 184 | 125.5 Ų | 125.5 | 86% | 0.86 | 63% | 0.629 | S | S | * | * | trans | -54.6 | 130.3 | 158.3 | -74.2 | -173.6 | 168.7 | 0 | 0 | 109.3 | C20 | E18-C20 PolarHBondContact O-N 3.22Š| ||
| 19 | P | 61.6 | Low | 57.2 | Low | 114 Ų | 114 | 121.4 Ų | 121.4 | 74% | 0.74 | 60% | 0.604 | S | S | * | * | trans | -60.3 | 124.3 | 175.4 | 21.8 | -29.7 | 0 | 0 | 0 | 109.5 | Q21 | P19-Q21 PolarHBondContact O-N 3.4Š| ||
| 20 | C | 67.3 | Low | 59.5 | Low | 45 Ų | 45 | 116.5 Ų | 116.5 | 30% | 0.304 | 58% | 0.583 | S | S | . | * | trans | -52.4 | 107.3 | -179 | -174 | 0 | 0 | 0 | 0 | 110.1 | E18 K22 C269 | E18-C20 PolarHBondContact O-N 3.22Å; C20-K22 PolarHBondContact O-N 3.06Å; C20-C269 HydrophobicContact CB-CB 4.07Å; C20-C269 WeakPolarHBondContact CB-SG 3.42Å; C20-C269 WeakPolarHBondContact SG-CB 2.81Å; C20-C269 CovalentContact SG-SG 2.06Å; C20-C269 PolarHBondContact SG-SG 3.16Å | ||
| 21 | Q | 65.6 | Low | 61.9 | Low | 149 Ų | 149 | 116.9 Ų | 116.9 | 70% | 0.696 | 58% | 0.583 | S | S | * | * | trans | -76 | 119.6 | -172.9 | -70.7 | -165.4 | -13.2 | 0 | 0 | 111.8 | P19 I23 | P19-Q21 PolarHBondContact O-N 3.4Å; Q21-I23 HydrophobicContact CB-CD1 4.38Å; Q21-I23 HydrophobicContact CB-CG1 4.39Å | ||
| 22 | K | 67.8 | Low | 64.5 | Low | 85 Ų | 85 | 116.5 Ų | 116.5 | 37% | 0.37 | 58% | 0.581 | S | S | . | * | trans | -104.8 | 29.7 | -175.9 | -55.2 | -178.9 | -169.9 | 179 | 0 | 114 | C20 N24 V25 K26 D276 | C20-K22 PolarHBondContact O-N 3.06Å; K22-N24 PolarHBondContact O-N 3.48Å; K22-V25 PolarHBondContact O-N 2.91Å; K22-K26 PolarHBondContact O-N 3.26Å; K22-D276 WeakPolarHBondContact CD-OD2 3.31Å; K22-D276 WeakPolarHBondContact CE-OD2 3.23Å; K22-D276 IonicContact NZ-OD1 2.78Å; K22-D276 PolarHBondContact NZ-OD1 3.49Å; K22-D276 IonicContact NZ-OD2 2.77Å; K22-D276 PolarHBondContact NZ-OD2 3.34Å | ||
| 23 | I | 65.9 | Low | 66.8 | Low | 90 Ų | 90 | 110.1 Ų | 110.1 | 46% | 0.462 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -57.2 | -44.6 | -166.2 | -60.9 | 170.6 | 0 | 0 | 0 | 112.8 | Q21 V25 Q27 | Q21-I23 HydrophobicContact CB-CD1 4.38Å; Q21-I23 HydrophobicContact CB-CG1 4.39Å; I23-V25 PolarHBondContact O-N 3.08Å; I23-Q27 PolarHBondContact O-N 3.2Å |
| 24 | N | 69.2 | Low | 69.3 | Low | 118 Ų | 118 | 105.3 Ų | 105.3 | 63% | 0.631 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -66.9 | -33.9 | -175.6 | -67.4 | -13 | 0 | 0 | 0 | 113.2 | K22 I28 | K22-N24 PolarHBondContact O-N 3.48Å; N24-I28 WeakPolarHBondContact O-CG1 3.43Å; N24-I28 PolarHBondContact O-N 2.94Å |
| 25 | V | 72.3 | Confident | 72 | Confident | 26 Ų | 26 | 99.1 Ų | 99.1 | 16% | 0.158 | 51% | 0.509 | C | S | . | . | H | α-helix | trans | -71.9 | -43.8 | -177.3 | -176.7 | 0 | 0 | 0 | 0 | 110.7 | K22 I23 Q27 I28 A29 Q277 | K22-V25 PolarHBondContact O-N 2.91Å; I23-V25 PolarHBondContact O-N 3.08Å; V25-Q27 VanDerWaalsContact C-N 3.33Å; V25-Q27 PolarHBondContact O-N 3.35Å; V25-I28 PolarHBondContact O-N 3.27Å; V25-A29 WeakPolarHBondContact O-CB 3.45Å; V25-A29 PolarHBondContact O-N 3.4Å; V25-Q277 HydrophobicContact CB-CG 4.31Å; V25-Q277 HydrophobicContact CG1-CG 3.82Å; V25-Q277 HydrophobicContact CG2-CG 3.45Å; V25-Q277 VanDerWaalsContact CG2-CG 3.45Å |
| 26 | K | 74.6 | Confident | 74.3 | Confident | 117 Ų | 117 | 91.8 Ų | 91.8 | 51% | 0.509 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -62.6 | -40.2 | -180 | -166.6 | 178.3 | 179.8 | -176.8 | 0 | 111.7 | K22 A29 A30 | K22-K26 PolarHBondContact O-N 3.26Å; K26-A29 PolarHBondContact O-N 2.97Å; K26-A30 VanDerWaalsContact O-CB 3.3Å; K26-A30 WeakPolarHBondContact O-CB 3.49Å; K26-A30 PolarHBondContact O-N 2.64Å |
| 27 | Q | 80 | Confident | 76.5 | Confident | 115 Ų | 115 | 86.2 Ų | 86.2 | 54% | 0.537 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -67.8 | -40.3 | 179 | -70.8 | 179.5 | -4.3 | 0 | 0 | 113.1 | I23 V25 A30 R31 | I23-Q27 PolarHBondContact O-N 3.2Å; V25-Q27 VanDerWaalsContact C-N 3.33Å; V25-Q27 PolarHBondContact O-N 3.35Å; Q27-A30 PolarHBondContact O-N 3.14Å; Q27-R31 PolarHBondContact O-N 3.16Å |
| 28 | I | 80.2 | Confident | 78.7 | Confident | 114 Ų | 114 | 83.6 Ų | 83.6 | 59% | 0.585 | 43% | 0.43 | S | S | * | . | H | α-helix | trans | -66.6 | -45.9 | 176.3 | -66.3 | 168.4 | 0 | 0 | 0 | 110 | N24 V25 A30 R31 L32 | N24-I28 WeakPolarHBondContact O-CG1 3.43Å; N24-I28 PolarHBondContact O-N 2.94Å; V25-I28 PolarHBondContact O-N 3.27Å; I28-A30 VanDerWaalsContact C-N 3.33Å; I28-A30 PolarHBondContact O-N 3.16Å; I28-R31 PolarHBondContact O-N 3.03Å; I28-L32 PolarHBondContact O-N 3.41Å |
| 29 | A | 81.9 | Confident | 80.7 | Confident | 16 Ų | 16 | 79 Ų | 79 | 13% | 0.132 | 41% | 0.411 | C | S | . | . | H | α-helix | trans | -58 | -43.6 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | V25 K26 R31 L32 L33 Q280 | V25-A29 WeakPolarHBondContact O-CB 3.45Å; V25-A29 PolarHBondContact O-N 3.4Å; K26-A29 PolarHBondContact O-N 2.97Å; A29-R31 PolarHBondContact O-N 2.74Å; A29-L32 PolarHBondContact O-N 3.08Å; A29-L33 HydrophobicContact CB-CD1 3.77Å; A29-L33 HydrophobicContact CB-CG 4.25Å; A29-L33 VanDerWaalsContact O-CB 3.27Å; A29-L33 WeakPolarHBondContact O-CB 3.48Å; A29-L33 VanDerWaalsContact O-CG 3.25Å; A29-L33 WeakPolarHBondContact O-CG 3.39Å; A29-L33 PolarHBondContact O-N 2.9Å; A29-Q280 HydrophobicContact CB-CG 4.47Å |
| 30 | A | 84.4 | Confident | 82.2 | Confident | 29 Ų | 29 | 73.9 Ų | 73.9 | 24% | 0.24 | 38% | 0.378 | C | S | . | . | H | α-helix | trans | -62.5 | -25.9 | 178.8 | 0 | 0 | 0 | 0 | 0 | 114.1 | K26 Q27 I28 P34 A90 | K26-A30 VanDerWaalsContact O-CB 3.3Å; K26-A30 WeakPolarHBondContact O-CB 3.49Å; K26-A30 PolarHBondContact O-N 2.64Å; Q27-A30 PolarHBondContact O-N 3.14Å; I28-A30 VanDerWaalsContact C-N 3.33Å; I28-A30 PolarHBondContact O-N 3.16Å; A30-P34 VanDerWaalsContact O-CD 3.29Å; A30-P34 WeakPolarHBondContact O-CD 3.5Å; A30-P34 VanDerWaalsContact O-CG 3.28Å; A30-P34 WeakPolarHBondContact O-CG 3.41Å; A30-A90 VanDerWaalsContact CA-O 3.24Å; A30-A90 WeakPolarHBondContact CA-O 3.45Å; A30-A90 WeakPolarHBondContact CB-O 3.21Å |
| 31 | R | 88.1 | Confident | 83.5 | Confident | 213 Ų | 213 | 74.4 Ų | 74.4 | 80% | 0.804 | 38% | 0.375 | S | S | * | . | H | α-helix | trans | -88.6 | -35.8 | 176.4 | -67.4 | -178.4 | -176.9 | -174.7 | 1.9 | 112.9 | Q27 I28 A29 P35 | Q27-R31 PolarHBondContact O-N 3.16Å; I28-R31 PolarHBondContact O-N 3.03Å; A29-R31 PolarHBondContact O-N 2.74Å; R31-P35 WeakPolarHBondContact O-CD 3.35Å; R31-P35 WeakPolarHBondContact O-CG 3.37Å |
| 32 | L | 88.5 | Confident | 84.9 | Confident | 110 Ų | 110 | 72 Ų | 72 | 58% | 0.576 | 37% | 0.366 | S | S | * | . | H | α-helix | trans | -90.9 | -40.3 | -172 | -172.5 | 68.8 | 0 | 0 | 0 | 113.5 | I28 A29 P35 L36 | I28-L32 PolarHBondContact O-N 3.41Å; A29-L32 PolarHBondContact O-N 3.08Å; L32-P35 WeakPolarHBondContact O-CD 3.29Å; L32-P35 WeakPolarHBondContact O-CG 2.91Å; L32-L36 WeakPolarHBondContact O-CB 3.33Å; L32-L36 PolarHBondContact O-N 3.33Å |
| 33 | L | 89.4 | Confident | 86.1 | Confident | 8 Ų | 8 | 73.8 Ų | 73.8 | 4% | 0.042 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -67.9 | -44.7 | -173.2 | -62.1 | 177 | 0 | 0 | 0 | 113.4 | A29 L36 Y37 A90 Q280 T284 | A29-L33 HydrophobicContact CB-CD1 3.77Å; A29-L33 HydrophobicContact CB-CG 4.25Å; A29-L33 VanDerWaalsContact O-CB 3.27Å; A29-L33 WeakPolarHBondContact O-CB 3.48Å; A29-L33 VanDerWaalsContact O-CG 3.25Å; A29-L33 WeakPolarHBondContact O-CG 3.39Å; A29-L33 PolarHBondContact O-N 2.9Å; L33-L36 PolarHBondContact O-N 3.45Å; L33-Y37 HydrophobicContact CB-CD2 4.41Å; L33-Y37 HydrophobicContact CB-CE2 4.16Å; L33-Y37 HydrophobicContact CD2-CE1 4.2Å; L33-Y37 VanDerWaalsContact O-CB 3.29Å; L33-Y37 WeakPolarHBondContact O-CB 3.38Å; L33-Y37 PolarHBondContact O-N 3.04Å; L33-A90 HydrophobicContact CB-CB 3.96Å; L33-A90 HydrophobicContact CD1-CB 3.93Å; L33-Q280 HydrophobicContact CD1-CG 4.37Å; L33-Q280 VanDerWaalsContact CD1-NE2 3.26Å; L33-T284 HydrophobicContact CD2-CG2 3.72Å; L33-T284 WeakPolarHBondContact CD2-OG1 3.24Å |
| 34 | P | 92.1 | Very high | 87.4 | Confident | 24 Ų | 24 | 69.5 Ų | 69.5 | 16% | 0.156 | 35% | 0.352 | C | S | . | . | H | α-helix | trans | -59 | -48.6 | -177.2 | -22.5 | 33 | 0 | 0 | 0 | 115 | A30 L36 S38 A87 A91 | A30-P34 VanDerWaalsContact O-CD 3.29Å; A30-P34 WeakPolarHBondContact O-CD 3.5Å; A30-P34 VanDerWaalsContact O-CG 3.28Å; A30-P34 WeakPolarHBondContact O-CG 3.41Å; P34-L36 VanDerWaalsContact C-N 3.35Å; P34-L36 PolarHBondContact O-N 3.11Å; P34-S38 WeakPolarHBondContact O-CB 3.47Å; P34-S38 PolarHBondContact O-N 3.22Å; P34-S38 PolarHBondContact O-OG 3Å; P34-A87 HydrophobicContact CB-CB 4.48Å; P34-A91 HydrophobicContact CB-CB 4.48Å; P34-A91 HydrophobicContact CG-CB 3.72Å |
| 35 | P | 93.1 | Very high | 88.7 | Confident | 79 Ų | 79 | 67.3 Ų | 67.3 | 51% | 0.513 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -66.7 | -36.9 | 177.3 | 25.2 | -32.8 | 0 | 0 | 0 | 112.1 | R31 L32 S38 L39 | R31-P35 WeakPolarHBondContact O-CD 3.35Å; R31-P35 WeakPolarHBondContact O-CG 3.37Å; L32-P35 WeakPolarHBondContact O-CD 3.29Å; L32-P35 WeakPolarHBondContact O-CG 2.91Å; P35-S38 PolarHBondContact O-N 2.66Å; P35-L39 PolarHBondContact O-N 3.25Å |
| 36 | L | 92.3 | Very high | 89.7 | Confident | 54 Ų | 54 | 70.4 Ų | 70.4 | 28% | 0.283 | 36% | 0.355 | S | S | . | . | H | α-helix | trans | -65.3 | -47.5 | 177.7 | -179.9 | 62.3 | 0 | 0 | 0 | 111.9 | L32 L33 P34 S38 L39 V40 T284 | L32-L36 WeakPolarHBondContact O-CB 3.33Å; L32-L36 PolarHBondContact O-N 3.33Å; L33-L36 PolarHBondContact O-N 3.45Å; P34-L36 VanDerWaalsContact C-N 3.35Å; P34-L36 PolarHBondContact O-N 3.11Å; L36-S38 VanDerWaalsContact C-N 3.3Å; L36-S38 PolarHBondContact O-N 3.49Å; L36-L39 WeakPolarHBondContact O-CB 3.41Å; L36-L39 PolarHBondContact O-N 3.42Å; L36-L39 VanDerWaalsContact O-N 3.16Å; L36-V40 WeakPolarHBondContact O-CG2 3.5Å; L36-V40 PolarHBondContact O-N 2.95Å; L36-T284 HydrophobicContact CD2-CG2 3.34Å |
| 37 | Y | 92.6 | Very high | 90.6 | Very high | 6 Ų | 6 | 65.5 Ų | 65.5 | 2% | 0.024 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -64.3 | -35.7 | 176.9 | -75.1 | -1.9 | 0 | 0 | 0 | 112.1 | L33 L39 V40 F41 V83 W86 A87 T284 M287 | L33-Y37 HydrophobicContact CB-CD2 4.41Å; L33-Y37 HydrophobicContact CB-CE2 4.16Å; L33-Y37 HydrophobicContact CD2-CE1 4.2Å; L33-Y37 VanDerWaalsContact O-CB 3.29Å; L33-Y37 WeakPolarHBondContact O-CB 3.38Å; L33-Y37 PolarHBondContact O-N 3.04Å; Y37-L39 VanDerWaalsContact C-N 3.34Å; Y37-L39 PolarHBondContact O-N 2.93Å; Y37-V40 PolarHBondContact O-N 2.82Å; Y37-F41 WeakPolarHBondContact O-CB 3.41Å; Y37-F41 PolarHBondContact O-N 2.8Å; Y37-V83 HydrophobicContact CD2-CG1 4.49Å; Y37-V83 HydrophobicContact CG-CG1 4.01Å; Y37-V83 WeakPolarHBondContact O-CG1 3.38Å; Y37-W86 HydrophobicContact CD2-CB 4.33Å; Y37-W86 HydrophobicContact CE2-CB 4.15Å; Y37-A87 HydrophobicContact CD2-CB 4.06Å; Y37-A87 HydrophobicContact CG-CB 4.48Å; Y37-T284 HydrophobicContact CE1-CG2 4.03Å; Y37-T284 PolarHBondContact OH-OG1 3.32Å; Y37-M287 HydrophobicContact CD1-SD 4.38Å; Y37-M287 HydrophobicContact CE1-CB 4.32Å; Y37-M287 HydrophobicContact CE1-CG 4.48Å; Y37-M287 HydrophobicContact CE1-SD 3.57Å; Y37-M287 VanDerWaalsContact CE1-SD 3.57Å; Y37-M287 HydrophobicContact CE2-SD 3.93Å; Y37-M287 PolarHBondContact OH-SD 3.26Å |
| 38 | S | 93.5 | Very high | 91.3 | Very high | 59 Ų | 59 | 60 Ų | 60 | 41% | 0.413 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -61.7 | -42.8 | 172.2 | -59.2 | 0 | 0 | 0 | 0 | 111.5 | P34 P35 L36 F41 I42 | P34-S38 WeakPolarHBondContact O-CB 3.47Å; P34-S38 PolarHBondContact O-N 3.22Å; P34-S38 PolarHBondContact O-OG 3Å; P35-S38 PolarHBondContact O-N 2.66Å; L36-S38 VanDerWaalsContact C-N 3.3Å; L36-S38 PolarHBondContact O-N 3.49Å; S38-F41 PolarHBondContact O-N 3.46Å; S38-I42 VanDerWaalsContact O-CG1 3.3Å; S38-I42 WeakPolarHBondContact O-CG1 3.34Å; S38-I42 PolarHBondContact O-N 3.21Å |
| 39 | L | 93.6 | Very high | 92 | Very high | 89 Ų | 89 | 57.8 Ų | 57.8 | 47% | 0.466 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -64.5 | -45.1 | 176.6 | -165.4 | 70.7 | 0 | 0 | 0 | 111.9 | P35 L36 Y37 F41 I42 F43 | P35-L39 PolarHBondContact O-N 3.25Å; L36-L39 WeakPolarHBondContact O-CB 3.41Å; L36-L39 PolarHBondContact O-N 3.42Å; L36-L39 VanDerWaalsContact O-N 3.16Å; Y37-L39 VanDerWaalsContact C-N 3.34Å; Y37-L39 PolarHBondContact O-N 2.93Å; L39-F41 VanDerWaalsContact C-N 3.31Å; L39-F41 PolarHBondContact O-N 3.07Å; L39-I42 PolarHBondContact O-N 3.27Å; L39-F43 HydrophobicContact CD1-CD2 3.91Å; L39-F43 HydrophobicContact CD1-CE2 3.32Å; L39-F43 HydrophobicContact CD1-CZ 4.13Å; L39-F43 HydrophobicContact CD2-CD2 4.49Å; L39-F43 HydrophobicContact CD2-CE2 4.09Å; L39-F43 HydrophobicContact CG-CD2 3.7Å; L39-F43 HydrophobicContact CG-CE2 3.51Å; L39-F43 WeakPolarHBondContact O-CD2 3.2Å; L39-F43 PolarHBondContact O-N 3.42Å |
| 40 | V | 93.8 | Very high | 92.4 | Very high | 6 Ų | 6 | 58.8 Ų | 58.8 | 4% | 0.036 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -59.5 | -44 | 175.1 | 171.5 | 0 | 0 | 0 | 0 | 110.6 | L36 Y37 G44 L80 T288 | L36-V40 WeakPolarHBondContact O-CG2 3.5Å; L36-V40 PolarHBondContact O-N 2.95Å; Y37-V40 PolarHBondContact O-N 2.82Å; V40-G44 WeakPolarHBondContact O-CA 3.38Å; V40-G44 PolarHBondContact O-N 3.23Å; V40-L80 HydrophobicContact CG1-CD2 4.21Å; V40-T288 HydrophobicContact CG2-CG2 3.65Å |
| 41 | F | 94.9 | Very high | 92.7 | Very high | 56 Ų | 56 | 57.5 Ų | 57.5 | 25% | 0.246 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -60.4 | -50.4 | 177.1 | 178.6 | -103.2 | 0 | 0 | 0 | 111.6 | Y37 S38 L39 F45 L80 V83 P84 | Y37-F41 WeakPolarHBondContact O-CB 3.41Å; Y37-F41 PolarHBondContact O-N 2.8Å; S38-F41 PolarHBondContact O-N 3.46Å; L39-F41 VanDerWaalsContact C-N 3.31Å; L39-F41 PolarHBondContact O-N 3.07Å; F41-F45 HydrophobicContact CE2-CD2 4.32Å; F41-F45 HydrophobicContact CZ-CD2 4.31Å; F41-F45 WeakPolarHBondContact O-CB 3.39Å; F41-F45 PolarHBondContact O-N 3.43Å; F41-L80 HydrophobicContact CD2-CB 4.48Å; F41-L80 VanDerWaalsContact CD2-O 3.3Å; F41-L80 WeakPolarHBondContact CD2-O 3.42Å; F41-V83 HydrophobicContact CB-CG1 4.38Å; F41-P84 HydrophobicContact CD1-CG 4.37Å; F41-P84 HydrophobicContact CD2-CG 3.71Å; F41-P84 HydrophobicContact CE1-CG 4.49Å; F41-P84 HydrophobicContact CE2-CG 3.85Å; F41-P84 HydrophobicContact CG-CG 3.99Å; F41-P84 HydrophobicContact CZ-CG 4.25Å |
| 42 | I | 94.6 | Very high | 93 | Very high | 97 Ų | 97 | 48.5 Ų | 48.5 | 50% | 0.497 | 26% | 0.26 | S | S | . | . | H | α-helix | trans | -60.8 | -54.8 | -178.3 | -68.1 | 164.9 | 0 | 0 | 0 | 110.9 | S38 L39 V46 | S38-I42 VanDerWaalsContact O-CG1 3.3Å; S38-I42 WeakPolarHBondContact O-CG1 3.34Å; S38-I42 PolarHBondContact O-N 3.21Å; L39-I42 PolarHBondContact O-N 3.27Å; I42-V46 WeakPolarHBondContact O-CB 3.2Å; I42-V46 VanDerWaalsContact O-CG2 3.29Å; I42-V46 WeakPolarHBondContact O-CG2 3.4Å; I42-V46 PolarHBondContact O-N 3.24Å; I42-V46 VanDerWaalsContact O-N 3.1Å |
| 43 | F | 93.2 | Very high | 93.1 | Very high | 123 Ų | 123 | 46.8 Ų | 46.8 | 54% | 0.539 | 25% | 0.252 | S | S | . | . | H | α-helix | trans | -68.4 | -40.7 | -177.7 | -71.4 | -54.8 | 0 | 0 | 0 | 112.4 | L39 G47 C291 | L39-F43 HydrophobicContact CD1-CD2 3.91Å; L39-F43 HydrophobicContact CD1-CE2 3.32Å; L39-F43 HydrophobicContact CD1-CZ 4.13Å; L39-F43 HydrophobicContact CD2-CD2 4.49Å; L39-F43 HydrophobicContact CD2-CE2 4.09Å; L39-F43 HydrophobicContact CG-CD2 3.7Å; L39-F43 HydrophobicContact CG-CE2 3.51Å; L39-F43 WeakPolarHBondContact O-CD2 3.2Å; L39-F43 PolarHBondContact O-N 3.42Å; F43-G47 WeakPolarHBondContact O-CA 3.35Å; F43-G47 PolarHBondContact O-N 3.24Å; F43-C291 HydrophobicContact CB-CB 4.34Å |
| 44 | G | 94.4 | Very high | 92.9 | Very high | 0 Ų | 0 | 46.4 Ų | 46.4 | 0% | 0 | 25% | 0.25 | C | C | . | . | H | α-helix | trans | -64.3 | -45.7 | 178.3 | 0 | 0 | 0 | 0 | 0 | 111.9 | V40 N48 L80 | V40-G44 WeakPolarHBondContact O-CA 3.38Å; V40-G44 PolarHBondContact O-N 3.23Å; G44-N48 VanDerWaalsContact O-CB 3.29Å; G44-N48 WeakPolarHBondContact O-CB 3.32Å; G44-N48 PolarHBondContact O-N 3.2Å; G44-N48 PolarHBondContact O-ND2 2.95Å; G44-L80 WeakPolarHBondContact O-CD1 3.49Å |
| 45 | F | 95.4 | Very high | 92.8 | Very high | 72 Ų | 72 | 45.4 Ų | 45.4 | 32% | 0.316 | 24% | 0.243 | S | C | . | . | H | α-helix | trans | -66.1 | -51 | -178.9 | -172.8 | -92.3 | 0 | 0 | 0 | 111.1 | F41 G47 M49 L77 | F41-F45 HydrophobicContact CE2-CD2 4.32Å; F41-F45 HydrophobicContact CZ-CD2 4.31Å; F41-F45 WeakPolarHBondContact O-CB 3.39Å; F41-F45 PolarHBondContact O-N 3.43Å; F45-G47 PolarHBondContact O-N 3.23Å; F45-M49 HydrophobicContact CD1-CG 4.17Å; F45-M49 HydrophobicContact CD2-CE 4.38Å; F45-M49 HydrophobicContact CE1-CE 4.31Å; F45-M49 HydrophobicContact CE1-CG 3.94Å; F45-M49 HydrophobicContact CE2-CE 3.58Å; F45-M49 HydrophobicContact CE2-CG 4.48Å; F45-M49 HydrophobicContact CZ-CE 3.54Å; F45-M49 HydrophobicContact CZ-CG 4.11Å; F45-M49 VanDerWaalsContact O-CB 3.24Å; F45-M49 WeakPolarHBondContact O-CB 3.36Å; F45-M49 WeakPolarHBondContact O-CG 3.44Å; F45-M49 PolarHBondContact O-N 3.29Å; F45-L77 HydrophobicContact CD2-CD2 3.87Å; F45-L77 HydrophobicContact CE2-CD2 4.28Å |
| 46 | V | 94.1 | Very high | 92.6 | Very high | 91 Ų | 91 | 45.4 Ų | 45.4 | 55% | 0.552 | 24% | 0.238 | S | C | * | . | H | α-helix | trans | -61.8 | -45.2 | 178.9 | 174.9 | 0 | 0 | 0 | 0 | 110.9 | I42 L50 | I42-V46 WeakPolarHBondContact O-CB 3.2Å; I42-V46 VanDerWaalsContact O-CG2 3.29Å; I42-V46 WeakPolarHBondContact O-CG2 3.4Å; I42-V46 PolarHBondContact O-N 3.24Å; I42-V46 VanDerWaalsContact O-N 3.1Å; V46-L50 WeakPolarHBondContact O-CB 3.41Å; V46-L50 PolarHBondContact O-N 3.08Å |
| 47 | G | 92.7 | Very high | 92.2 | Very high | 15 Ų | 15 | 47 Ų | 47 | 16% | 0.155 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -62.4 | -51.7 | -179.7 | 0 | 0 | 0 | 0 | 0 | 112.7 | F43 F45 L50 V51 P294 | F43-G47 WeakPolarHBondContact O-CA 3.35Å; F43-G47 PolarHBondContact O-N 3.24Å; F45-G47 PolarHBondContact O-N 3.23Å; G47-L50 WeakPolarHBondContact O-CB 3.49Å; G47-L50 PolarHBondContact O-N 2.87Å; G47-V51 WeakPolarHBondContact O-CG2 3.41Å; G47-V51 PolarHBondContact O-N 2.9Å; G47-P294 VanDerWaalsContact C-CG 3.42Å |
| 48 | N | 94.8 | Very high | 91.7 | Very high | 0 Ų | 0 | 48.6 Ų | 48.6 | 0% | 0 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -69 | -36.7 | -178.6 | -74 | -63.7 | 0 | 0 | 0 | 112.2 | G44 L50 V51 I52 A73 L77 C290 | G44-N48 VanDerWaalsContact O-CB 3.29Å; G44-N48 WeakPolarHBondContact O-CB 3.32Å; G44-N48 PolarHBondContact O-N 3.2Å; G44-N48 PolarHBondContact O-ND2 2.95Å; N48-L50 VanDerWaalsContact C-N 3.32Å; N48-L50 PolarHBondContact O-N 3.42Å; N48-V51 WeakPolarHBondContact O-CB 3.33Å; N48-V51 PolarHBondContact O-N 3.47Å; N48-I52 WeakPolarHBondContact O-CG1 3.45Å; N48-I52 PolarHBondContact O-N 2.96Å; N48-A73 HydrophobicContact CB-CB 4.49Å; N48-L77 HydrophobicContact CB-CD2 3.99Å; N48-L77 HydrophobicContact CB-CG 4.1Å; N48-C290 PolarHBondContact ND2-O 3.49Å |
| 49 | M | 94.3 | Very high | 91 | Very high | 67 Ų | 67 | 47.8 Ų | 47.8 | 33% | 0.33 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -61.1 | -41.3 | 171.9 | -75 | -62.6 | 177.1 | 0 | 0 | 112 | F45 V51 I52 L53 L77 | F45-M49 HydrophobicContact CD1-CG 4.17Å; F45-M49 HydrophobicContact CD2-CE 4.38Å; F45-M49 HydrophobicContact CE1-CE 4.31Å; F45-M49 HydrophobicContact CE1-CG 3.94Å; F45-M49 HydrophobicContact CE2-CE 3.58Å; F45-M49 HydrophobicContact CE2-CG 4.48Å; F45-M49 HydrophobicContact CZ-CE 3.54Å; F45-M49 HydrophobicContact CZ-CG 4.11Å; F45-M49 VanDerWaalsContact O-CB 3.24Å; F45-M49 WeakPolarHBondContact O-CB 3.36Å; F45-M49 WeakPolarHBondContact O-CG 3.44Å; F45-M49 PolarHBondContact O-N 3.29Å; M49-V51 VanDerWaalsContact C-N 3.35Å; M49-V51 PolarHBondContact O-N 3.24Å; M49-I52 PolarHBondContact O-N 3.38Å; M49-I52 HydrophobicContact SD-CD1 4.5Å; M49-L53 WeakPolarHBondContact O-CB 3.37Å; M49-L53 VanDerWaalsContact O-CG 3.3Å; M49-L53 WeakPolarHBondContact O-CG 3.34Å; M49-L53 PolarHBondContact O-N 2.91Å; M49-L77 HydrophobicContact CE-CD1 3.44Å; M49-L77 VanDerWaalsContact CE-CD1 3.44Å; M49-L77 HydrophobicContact CE-CD2 3.93Å; M49-L77 HydrophobicContact CE-CG 4.33Å; M49-L77 HydrophobicContact CG-CD2 4.37Å; M49-L77 HydrophobicContact SD-CD1 3.87Å |
| 50 | L | 91.1 | Very high | 90.6 | Very high | 36 Ų | 36 | 52.1 Ų | 52.1 | 19% | 0.188 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -64.2 | -40.3 | 176.5 | -173.9 | 59.7 | 0 | 0 | 0 | 112 | V46 G47 N48 L53 I54 L308 F311 | V46-L50 WeakPolarHBondContact O-CB 3.41Å; V46-L50 PolarHBondContact O-N 3.08Å; G47-L50 WeakPolarHBondContact O-CB 3.49Å; G47-L50 PolarHBondContact O-N 2.87Å; N48-L50 VanDerWaalsContact C-N 3.32Å; N48-L50 PolarHBondContact O-N 3.42Å; L50-L53 PolarHBondContact O-N 2.71Å; L50-I54 HydrophobicContact CD1-CD1 4.13Å; L50-I54 HydrophobicContact CD1-CG1 4.41Å; L50-I54 HydrophobicContact CG-CD1 3.93Å; L50-I54 WeakPolarHBondContact O-CB 3.21Å; L50-I54 VanDerWaalsContact O-CG1 3.3Å; L50-I54 WeakPolarHBondContact O-CG1 3.39Å; L50-I54 PolarHBondContact O-N 2.9Å; L50-L308 HydrophobicContact CD2-CD2 3.64Å; L50-L308 HydrophobicContact CD2-CG 4.49Å; L50-L308 HydrophobicContact CG-CD2 4.46Å; L50-F311 HydrophobicContact CD1-CD1 3.78Å; L50-F311 HydrophobicContact CD1-CE1 3.63Å; L50-F311 HydrophobicContact CD1-CZ 4.33Å |
| 51 | V | 91.2 | Very high | 90.3 | Very high | 2 Ų | 2 | 53.8 Ų | 53.8 | 1% | 0.012 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -57.8 | -49.9 | 173.5 | 172.2 | 0 | 0 | 0 | 0 | 110.6 | G47 N48 M49 L53 I54 L55 A73 P294 Y297 F304 | G47-V51 WeakPolarHBondContact O-CG2 3.41Å; G47-V51 PolarHBondContact O-N 2.9Å; N48-V51 WeakPolarHBondContact O-CB 3.33Å; N48-V51 PolarHBondContact O-N 3.47Å; M49-V51 VanDerWaalsContact C-N 3.35Å; M49-V51 PolarHBondContact O-N 3.24Å; V51-L53 PolarHBondContact O-N 2.6Å; V51-I54 PolarHBondContact O-N 2.77Å; V51-L55 HydrophobicContact CG1-CD1 3.75Å; V51-L55 HydrophobicContact CG1-CG 4.27Å; V51-L55 WeakPolarHBondContact O-CB 3.25Å; V51-L55 VanDerWaalsContact O-CG 3.26Å; V51-L55 WeakPolarHBondContact O-CG 3.42Å; V51-L55 PolarHBondContact O-N 2.7Å; V51-A73 HydrophobicContact CB-CB 4.47Å; V51-A73 HydrophobicContact CG1-CB 4.09Å; V51-P294 HydrophobicContact CG2-CB 4.02Å; V51-P294 HydrophobicContact CG2-CG 4.14Å; V51-Y297 HydrophobicContact CG1-CD2 4.29Å; V51-Y297 HydrophobicContact CG1-CE2 4.2Å; V51-Y297 HydrophobicContact CG2-CD2 3.77Å; V51-Y297 HydrophobicContact CG2-CE2 4.22Å; V51-F304 HydrophobicContact CB-CZ 4.41Å; V51-F304 HydrophobicContact CG2-CE2 4.12Å; V51-F304 HydrophobicContact CG2-CZ 3.67Å |
| 52 | I | 93.4 | Very high | 89.8 | Confident | 24 Ų | 24 | 58.6 Ų | 58.6 | 12% | 0.123 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -57.8 | -48.8 | 178.2 | -68.3 | 171.3 | 0 | 0 | 0 | 110.8 | N48 M49 I54 L55 I56 L70 A73 I74 L77 | N48-I52 WeakPolarHBondContact O-CG1 3.45Å; N48-I52 PolarHBondContact O-N 2.96Å; M49-I52 PolarHBondContact O-N 3.38Å; M49-I52 HydrophobicContact SD-CD1 4.5Å; I52-I54 VanDerWaalsContact C-N 3.34Å; I52-I54 PolarHBondContact O-N 3.01Å; I52-L55 PolarHBondContact O-N 3.32Å; I52-I56 HydrophobicContact CG2-CD1 3.68Å; I52-I56 HydrophobicContact CG2-CG1 4.47Å; I52-I56 WeakPolarHBondContact O-CG1 3.38Å; I52-I56 PolarHBondContact O-N 3.11Å; I52-L70 HydrophobicContact CB-CD1 4.28Å; I52-L70 HydrophobicContact CG1-CD1 4.01Å; I52-L70 HydrophobicContact CG2-CD1 3.95Å; I52-A73 HydrophobicContact CD1-CB 4.21Å; I52-A73 HydrophobicContact CG1-CB 3.77Å; I52-I74 HydrophobicContact CD1-CG1 4.19Å; I52-L77 HydrophobicContact CD1-CD1 3.38Å; I52-L77 HydrophobicContact CD1-CG 4.46Å |
| 53 | L | 90.1 | Very high | 89.4 | Confident | 75 Ų | 75 | 55.9 Ų | 55.9 | 39% | 0.393 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -60 | -42.2 | 179.5 | -73 | 171.1 | 0 | 0 | 0 | 112.3 | M49 L50 V51 N57 F311 | M49-L53 WeakPolarHBondContact O-CB 3.37Å; M49-L53 VanDerWaalsContact O-CG 3.3Å; M49-L53 WeakPolarHBondContact O-CG 3.34Å; M49-L53 PolarHBondContact O-N 2.91Å; L50-L53 PolarHBondContact O-N 2.71Å; V51-L53 PolarHBondContact O-N 2.6Å; L53-N57 WeakPolarHBondContact O-CB 3.3Å; L53-N57 PolarHBondContact O-N 3.34Å; L53-N57 PolarHBondContact O-ND2 3.31Å; L53-F311 HydrophobicContact CB-CE2 4.48Å; L53-F311 HydrophobicContact CD1-CZ 4.3Å |
| 54 | I | 86.8 | Confident | 89.2 | Confident | 0 Ų | 0 | 50.7 Ų | 50.7 | 0% | 0 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -67.2 | -42.5 | 177.7 | -72.1 | 168.1 | 0 | 0 | 0 | 110.9 | L50 V51 I52 C58 K59 F304 Y307 L308 | L50-I54 HydrophobicContact CD1-CD1 4.13Å; L50-I54 HydrophobicContact CD1-CG1 4.41Å; L50-I54 HydrophobicContact CG-CD1 3.93Å; L50-I54 WeakPolarHBondContact O-CB 3.21Å; L50-I54 VanDerWaalsContact O-CG1 3.3Å; L50-I54 WeakPolarHBondContact O-CG1 3.39Å; L50-I54 PolarHBondContact O-N 2.9Å; V51-I54 PolarHBondContact O-N 2.77Å; I52-I54 VanDerWaalsContact C-N 3.34Å; I52-I54 PolarHBondContact O-N 3.01Å; I54-C58 HydrophobicContact CG2-CB 4.29Å; I54-C58 WeakPolarHBondContact O-CA 3.49Å; I54-C58 VanDerWaalsContact O-CB 3.25Å; I54-C58 WeakPolarHBondContact O-CB 3.48Å; I54-C58 PolarHBondContact O-N 3.06Å; I54-K59 PolarHBondContact O-N 3.17Å; I54-F304 HydrophobicContact CB-CE2 4.08Å; I54-F304 HydrophobicContact CD1-CE1 4.36Å; I54-F304 HydrophobicContact CD1-CE2 3.73Å; I54-F304 HydrophobicContact CD1-CZ 3.64Å; I54-F304 HydrophobicContact CG2-CD2 4.06Å; I54-F304 HydrophobicContact CG2-CE2 3.85Å; I54-Y307 HydrophobicContact CG2-CG 4.36Å; I54-L308 HydrophobicContact CD1-CB 4.44Å; I54-L308 HydrophobicContact CD1-CD2 4.41Å; I54-L308 HydrophobicContact CD1-CG 3.79Å |
| 55 | L | 88.4 | Confident | 88.9 | Confident | 2 Ų | 2 | 51 Ų | 51 | 1% | 0.01 | 26% | 0.256 | C | S | . | . | I | π-helix | trans | -63.5 | -43.1 | -179.8 | -72.5 | 174.6 | 0 | 0 | 0 | 111.9 | V51 I52 K59 R60 L61 D66 L69 L70 | V51-L55 HydrophobicContact CG1-CD1 3.75Å; V51-L55 HydrophobicContact CG1-CG 4.27Å; V51-L55 WeakPolarHBondContact O-CB 3.25Å; V51-L55 VanDerWaalsContact O-CG 3.26Å; V51-L55 WeakPolarHBondContact O-CG 3.42Å; V51-L55 PolarHBondContact O-N 2.7Å; I52-L55 PolarHBondContact O-N 3.32Å; L55-K59 HydrophobicContact CD2-CD 3.75Å; L55-K59 CarbonylContact O-C 3.35Å; L55-R60 PolarHBondContact O-N 3.39Å; L55-L61 HydrophobicContact CB-CD2 3.9Å; L55-L61 PolarHBondContact O-N 2.9Å; L55-D66 HydrophobicContact CD2-CB 4.23Å; L55-L69 HydrophobicContact CD1-CB 3.92Å; L55-L69 HydrophobicContact CD2-CB 4.48Å; L55-L70 HydrophobicContact CD1-CB 4.02Å |
| 56 | I | 88.9 | Confident | 88.6 | Confident | 80 Ų | 80 | 48.3 Ų | 48.3 | 41% | 0.41 | 24% | 0.244 | S | C | . | . | I | π-helix | trans | -75.3 | -53.4 | -180 | -64.1 | 173.5 | 0 | 0 | 0 | 111 | I52 R60 L61 L70 | I52-I56 HydrophobicContact CG2-CD1 3.68Å; I52-I56 HydrophobicContact CG2-CG1 4.47Å; I52-I56 WeakPolarHBondContact O-CG1 3.38Å; I52-I56 PolarHBondContact O-N 3.11Å; I56-R60 WeakPolarHBondContact O-CA 3.43Å; I56-R60 PolarHBondContact O-N 3.15Å; I56-L61 HydrophobicContact CG1-CD1 4.35Å; I56-L70 HydrophobicContact CD1-CD1 4.4Å; I56-L70 HydrophobicContact CG1-CD1 4.39Å |
| 57 | N | 84.4 | Confident | 88.6 | Confident | 88 Ų | 88 | 44.7 Ų | 44.7 | 47% | 0.471 | 22% | 0.222 | S | C | . | . | I | π-helix | trans | -85.5 | -35.6 | -168.2 | -61.9 | -41.1 | 0 | 0 | 0 | 113.7 | L53 | L53-N57 WeakPolarHBondContact O-CB 3.3Å; L53-N57 PolarHBondContact O-N 3.34Å; L53-N57 PolarHBondContact O-ND2 3.31Å |
| 58 | C | 81.8 | Confident | 88.7 | Confident | 39 Ų | 39 | 44.1 Ų | 44.1 | 26% | 0.264 | 22% | 0.215 | S | C | . | . | I | π-helix | trans | -97.1 | -49.1 | -175.5 | -56.3 | 0 | 0 | 0 | 0 | 111.8 | I54 Y307 | I54-C58 HydrophobicContact CG2-CB 4.29Å; I54-C58 WeakPolarHBondContact O-CA 3.49Å; I54-C58 VanDerWaalsContact O-CB 3.25Å; I54-C58 WeakPolarHBondContact O-CB 3.48Å; I54-C58 PolarHBondContact O-N 3.06Å; C58-Y307 HydrophobicContact CB-CD1 3.68Å; C58-Y307 HydrophobicContact CB-CE1 4.27Å; C58-Y307 HydrophobicContact CB-CG 4.2Å |
| 59 | K | 80.2 | Confident | 88.5 | Confident | 41 Ų | 41 | 45.1 Ų | 45.1 | 18% | 0.178 | 22% | 0.22 | C | C | . | . | I | π-helix | trans | -86.5 | -22.4 | -177.8 | -77.3 | 177.9 | 139.8 | -154.7 | 0 | 114 | I54 L55 L61 D66 Y307 | I54-K59 PolarHBondContact O-N 3.17Å; L55-K59 HydrophobicContact CD2-CD 3.75Å; L55-K59 CarbonylContact O-C 3.35Å; K59-L61 PolarHBondContact O-N 2.85Å; K59-D66 IonicContact NZ-OD1 3.93Å; K59-D66 PolarHBondContact NZ-OD1 3.3Å; K59-Y307 HydrophobicContact CD-CD2 4.29Å; K59-Y307 HydrophobicContact CD-CE2 4.12Å; K59-Y307 HydrophobicContact CG-CD2 3.97Å; K59-Y307 HydrophobicContact CG-CE2 3.61Å |
| 60 | R | 85.3 | Confident | 88.6 | Confident | 180 Ų | 180 | 43 Ų | 43 | 68% | 0.679 | 21% | 0.21 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 54.6 | 31.9 | 179.4 | -54 | -175.5 | -178 | -177.6 | -0.2 | 113.8 | L55 I56 K62 | L55-R60 PolarHBondContact O-N 3.39Å; I56-R60 WeakPolarHBondContact O-CA 3.43Å; I56-R60 PolarHBondContact O-N 3.15Å; R60-K62 HydrophobicContact CB-CG 4.37Å; R60-K62 PolarHBondContact O-N 3Å |
| 61 | L | 86 | Confident | 88.8 | Confident | 42 Ų | 42 | 42.2 Ų | 42.2 | 22% | 0.22 | 21% | 0.206 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 47.5 | 40.1 | 172.2 | -55.8 | 174.7 | 0 | 0 | 0 | 115 | L55 I56 K59 S63 D66 I67 L70 | L55-L61 HydrophobicContact CB-CD2 3.9Å; L55-L61 PolarHBondContact O-N 2.9Å; I56-L61 HydrophobicContact CG1-CD1 4.35Å; K59-L61 PolarHBondContact O-N 2.85Å; L61-S63 PolarHBondContact O-N 3.03Å; L61-D66 HydrophobicContact CD2-CB 4.24Å; L61-I67 HydrophobicContact CB-CD1 3.89Å; L61-I67 HydrophobicContact CD1-CD1 4.29Å; L61-I67 HydrophobicContact CG-CD1 4.46Å; L61-L70 HydrophobicContact CD1-CD2 3.79Å; L61-L70 HydrophobicContact CD2-CB 4.18Å; L61-L70 HydrophobicContact CD2-CD2 4.02Å |
| 62 | K | 84.3 | Confident | 89 | Confident | 157 Ų | 157 | 42.2 Ų | 42.2 | 68% | 0.683 | 21% | 0.206 | S | C | * | . | trans | -76.3 | -6.7 | -172.1 | -65.9 | -175.4 | 179.9 | -172.7 | 0 | 114.6 | R60 | R60-K62 HydrophobicContact CB-CG 4.37Å; R60-K62 PolarHBondContact O-N 3Å | ||
| 63 | S | 86.2 | Confident | 89.1 | Confident | 40 Ų | 40 | 41.1 Ų | 41.1 | 28% | 0.28 | 20% | 0.201 | S | C | . | . | S | Bend | trans | -133.1 | 151.4 | -177.3 | 74.2 | 0 | 0 | 0 | 0 | 111.8 | L61 T65 D66 I67 | L61-S63 PolarHBondContact O-N 3.03Å; S63-T65 PolarHBondContact O-N 3.48Å; S63-D66 PolarHBondContact N-OD2 2.92Å; S63-D66 WeakPolarHBondContact O-CB 3.43Å; S63-D66 PolarHBondContact O-N 2.98Å; S63-D66 PolarHBondContact OG-N 3.3Å; S63-D66 PolarHBondContact OG-OD2 3.39Å; S63-I67 PolarHBondContact O-N 3Å |
| 64 | M | 89.2 | Confident | 89.4 | Confident | 13 Ų | 13 | 40 Ų | 40 | 6% | 0.064 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -53.3 | -38.2 | 174.3 | -176.3 | 173.7 | 176.8 | 0 | 0 | 112.4 | D66 I67 Y68 R140 F144 | M64-D66 PolarHBondContact O-N 3.23Å; M64-I67 WeakPolarHBondContact O-CB 3.37Å; M64-I67 PolarHBondContact O-N 2.98Å; M64-Y68 HydrophobicContact CE-CE2 3.69Å; M64-Y68 VanDerWaalsContact CE-CZ 3.49Å; M64-Y68 WeakPolarHBondContact CE-OH 3.36Å; M64-Y68 HydrophobicContact CG-CD2 4.46Å; M64-Y68 HydrophobicContact CG-CE2 3.93Å; M64-Y68 PolarHBondContact O-N 3.31Å; M64-Y68 VanDerWaalsContact O-N 3.08Å; M64-R140 HydrophobicContact SD-CB 4.02Å; M64-R140 HydrophobicContact SD-CG 4.09Å; M64-F144 HydrophobicContact CE-CD1 3.55Å; M64-F144 HydrophobicContact CE-CE1 3.92Å; M64-F144 HydrophobicContact SD-CD1 4.26Å |
| 65 | T | 88.6 | Confident | 89.9 | Confident | 7 Ų | 7 | 40 Ų | 40 | 4% | 0.043 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -63 | -40.4 | 174.6 | -40.8 | 0 | 0 | 0 | 0 | 112.5 | S63 I67 Y68 L69 L122 D125 R126 R140 | S63-T65 PolarHBondContact O-N 3.48Å; T65-I67 VanDerWaalsContact C-N 3.25Å; T65-I67 PolarHBondContact O-N 2.86Å; T65-Y68 PolarHBondContact O-N 3.36Å; T65-L69 HydrophobicContact CG2-CD1 4.23Å; T65-L69 HydrophobicContact CG2-CG 4.43Å; T65-L69 WeakPolarHBondContact O-CG 3.1Å; T65-L69 PolarHBondContact O-N 3.02Å; T65-L122 HydrophobicContact CG2-CD2 3.58Å; T65-D125 PolarHBondContact OG1-OD2 3.5Å; T65-R126 VanDerWaalsContact CB-NH2 3.3Å; T65-R126 PolarHBondContact OG1-NH2 3.23Å; T65-R140 PolarHBondContact OG1-NH2 2.89Å |
| 66 | D | 89.6 | Confident | 90.2 | Very high | 15 Ų | 15 | 40.3 Ų | 40.3 | 8% | 0.08 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -65.6 | -32.8 | 178.5 | -61.7 | -48.5 | 0 | 0 | 0 | 110.9 | L55 K59 L61 S63 M64 L70 | L55-D66 HydrophobicContact CD2-CB 4.23Å; K59-D66 IonicContact NZ-OD1 3.93Å; K59-D66 PolarHBondContact NZ-OD1 3.3Å; L61-D66 HydrophobicContact CD2-CB 4.24Å; S63-D66 PolarHBondContact N-OD2 2.92Å; S63-D66 WeakPolarHBondContact O-CB 3.43Å; S63-D66 PolarHBondContact O-N 2.98Å; S63-D66 PolarHBondContact OG-N 3.3Å; S63-D66 PolarHBondContact OG-OD2 3.39Å; M64-D66 PolarHBondContact O-N 3.23Å; D66-L70 WeakPolarHBondContact O-CB 3.37Å; D66-L70 PolarHBondContact O-N 3.23Å |
| 67 | I | 93.8 | Very high | 90.6 | Very high | 15 Ų | 15 | 37.3 Ų | 37.3 | 8% | 0.077 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -64.2 | -46.4 | 172 | -58.5 | -64.7 | 0 | 0 | 0 | 111 | L61 S63 M64 T65 L70 N71 V142 | L61-I67 HydrophobicContact CB-CD1 3.89Å; L61-I67 HydrophobicContact CD1-CD1 4.29Å; L61-I67 HydrophobicContact CG-CD1 4.46Å; S63-I67 PolarHBondContact O-N 3Å; M64-I67 WeakPolarHBondContact O-CB 3.37Å; M64-I67 PolarHBondContact O-N 2.98Å; T65-I67 VanDerWaalsContact C-N 3.25Å; T65-I67 PolarHBondContact O-N 2.86Å; I67-L70 WeakPolarHBondContact O-CB 3.33Å; I67-L70 PolarHBondContact O-N 3.45Å; I67-N71 PolarHBondContact O-N 2.78Å; I67-N71 PolarHBondContact O-ND2 3.37Å; I67-V142 HydrophobicContact CD1-CG1 4.16Å; I67-V142 HydrophobicContact CG1-CG1 4.19Å |
| 68 | Y | 93.8 | Very high | 91.2 | Very high | 4 Ų | 4 | 36.2 Ų | 36.2 | 2% | 0.016 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -67.1 | -38.3 | 178.4 | -64.5 | -23.8 | 0 | 0 | 0 | 113.1 | M64 T65 L70 N71 L72 F118 L121 L122 D125 T148 | M64-Y68 HydrophobicContact CE-CE2 3.69Å; M64-Y68 VanDerWaalsContact CE-CZ 3.49Å; M64-Y68 WeakPolarHBondContact CE-OH 3.36Å; M64-Y68 HydrophobicContact CG-CD2 4.46Å; M64-Y68 HydrophobicContact CG-CE2 3.93Å; M64-Y68 PolarHBondContact O-N 3.31Å; M64-Y68 VanDerWaalsContact O-N 3.08Å; T65-Y68 PolarHBondContact O-N 3.36Å; Y68-L70 VanDerWaalsContact C-N 3.3Å; Y68-L70 PolarHBondContact O-N 3Å; Y68-N71 PolarHBondContact O-N 3.11Å; Y68-L72 WeakPolarHBondContact O-CB 3.25Å; Y68-L72 PolarHBondContact O-N 2.69Å; Y68-F118 HydrophobicContact CD1-CD1 4.13Å; Y68-F118 HydrophobicContact CD1-CE1 4.27Å; Y68-L121 HydrophobicContact CD1-CD1 4.42Å; Y68-L121 HydrophobicContact CD2-CB 4.02Å; Y68-L121 HydrophobicContact CE1-CB 4.43Å; Y68-L121 HydrophobicContact CE1-CD1 3.94Å; Y68-L121 HydrophobicContact CE2-CB 3.79Å; Y68-L121 HydrophobicContact CG-CB 4.41Å; Y68-L122 HydrophobicContact CD2-CD2 4.35Å; Y68-D125 HydrophobicContact CD2-CB 4.3Å; Y68-D125 HydrophobicContact CE2-CB 4.12Å; Y68-T148 WeakPolarHBondContact CE1-OG1 3.46Å; Y68-T148 WeakPolarHBondContact OH-CB 3.36Å; Y68-T148 PolarHBondContact OH-OG1 2.94Å |
| 69 | L | 91.9 | Very high | 91.7 | Very high | 20 Ų | 20 | 34.7 Ų | 34.7 | 11% | 0.105 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -63.8 | -36.8 | 173.3 | -70.7 | 171.7 | 0 | 0 | 0 | 111.9 | L55 T65 A73 L122 Y297 | L55-L69 HydrophobicContact CD1-CB 3.92Å; L55-L69 HydrophobicContact CD2-CB 4.48Å; T65-L69 HydrophobicContact CG2-CD1 4.23Å; T65-L69 HydrophobicContact CG2-CG 4.43Å; T65-L69 WeakPolarHBondContact O-CG 3.1Å; T65-L69 PolarHBondContact O-N 3.02Å; L69-A73 PolarHBondContact O-N 3.48Å; L69-A73 VanDerWaalsContact O-N 3.08Å; L69-L122 HydrophobicContact CD2-CD1 3.88Å; L69-L122 HydrophobicContact CD2-CD2 4.2Å; L69-L122 HydrophobicContact CG-CD2 4.11Å; L69-Y297 HydrophobicContact CD2-CE1 3.96Å; L69-Y297 WeakPolarHBondContact CD2-OH 3.37Å |
| 70 | L | 94.8 | Very high | 92.5 | Very high | 23 Ų | 23 | 32.8 Ų | 32.8 | 12% | 0.12 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -63.2 | -49.1 | 174.9 | 177.6 | 69.8 | 0 | 0 | 0 | 110.9 | I52 L55 I56 L61 D66 I67 Y68 L72 A73 I74 | I52-L70 HydrophobicContact CB-CD1 4.28Å; I52-L70 HydrophobicContact CG1-CD1 4.01Å; I52-L70 HydrophobicContact CG2-CD1 3.95Å; L55-L70 HydrophobicContact CD1-CB 4.02Å; I56-L70 HydrophobicContact CD1-CD1 4.4Å; I56-L70 HydrophobicContact CG1-CD1 4.39Å; L61-L70 HydrophobicContact CD1-CD2 3.79Å; L61-L70 HydrophobicContact CD2-CB 4.18Å; L61-L70 HydrophobicContact CD2-CD2 4.02Å; D66-L70 WeakPolarHBondContact O-CB 3.37Å; D66-L70 PolarHBondContact O-N 3.23Å; I67-L70 WeakPolarHBondContact O-CB 3.33Å; I67-L70 PolarHBondContact O-N 3.45Å; Y68-L70 VanDerWaalsContact C-N 3.3Å; Y68-L70 PolarHBondContact O-N 3Å; L70-L72 VanDerWaalsContact C-N 3.32Å; L70-L72 PolarHBondContact O-N 3.47Å; L70-A73 PolarHBondContact O-N 3.27Å; L70-I74 HydrophobicContact CD1-CD1 4.45Å; L70-I74 HydrophobicContact CG-CD1 4.07Å; L70-I74 WeakPolarHBondContact O-CG1 3.46Å; L70-I74 PolarHBondContact O-N 2.99Å |
| 71 | N | 96.9 | Very high | 93 | Very high | 20 Ų | 20 | 27.9 Ų | 27.9 | 11% | 0.107 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -66.3 | -34.5 | 180 | -75 | -81.3 | 0 | 0 | 0 | 112.5 | I67 Y68 I74 S75 F118 S149 W153 | I67-N71 PolarHBondContact O-N 2.78Å; I67-N71 PolarHBondContact O-ND2 3.37Å; Y68-N71 PolarHBondContact O-N 3.11Å; N71-I74 PolarHBondContact O-N 3.28Å; N71-S75 WeakPolarHBondContact O-CB 3.38Å; N71-S75 PolarHBondContact O-N 3.01Å; N71-F118 HydrophobicContact CB-CD1 3.8Å; N71-F118 HydrophobicContact CB-CD2 3.84Å; N71-F118 HydrophobicContact CB-CE1 3.44Å; N71-F118 VanDerWaalsContact CB-CE1 3.44Å; N71-F118 HydrophobicContact CB-CE2 3.5Å; N71-F118 HydrophobicContact CB-CG 4.01Å; N71-F118 HydrophobicContact CB-CZ 3.3Å; N71-S149 PolarHBondContact ND2-OG 3.34Å; N71-W153 PolarHBondContact OD1-NE1 3.5Å |
| 72 | L | 94.4 | Very high | 93.4 | Very high | 1 Ų | 1 | 25.9 Ų | 25.9 | 1% | 0.005 | 13% | 0.129 | C | C | . | . | H | α-helix | trans | -61.5 | -44.3 | 172.2 | -178.2 | 58.9 | 0 | 0 | 0 | 111.5 | Y68 L70 I74 S75 D76 G115 F118 I119 L122 Y297 | Y68-L72 WeakPolarHBondContact O-CB 3.25Å; Y68-L72 PolarHBondContact O-N 2.69Å; L70-L72 VanDerWaalsContact C-N 3.32Å; L70-L72 PolarHBondContact O-N 3.47Å; L72-I74 VanDerWaalsContact C-N 3.35Å; L72-I74 PolarHBondContact O-N 2.9Å; L72-S75 WeakPolarHBondContact O-CB 3.26Å; L72-S75 PolarHBondContact O-N 3.27Å; L72-D76 PolarHBondContact O-N 3.47Å; L72-G115 WeakPolarHBondContact CD1-O 3.29Å; L72-F118 HydrophobicContact CB-CB 4.15Å; L72-F118 HydrophobicContact CD1-CB 4.35Å; L72-I119 HydrophobicContact CD1-CD1 4.43Å; L72-I119 HydrophobicContact CD1-CG1 4.05Å; L72-I119 HydrophobicContact CD2-CG1 4.06Å; L72-L122 HydrophobicContact CD2-CD1 3.93Å; L72-Y297 WeakPolarHBondContact CD2-OH 3.22Å |
| 73 | A | 95.4 | Very high | 93.9 | Very high | 2 Ų | 2 | 18.5 Ų | 18.5 | 2% | 0.017 | 10% | 0.097 | C | C | . | . | H | α-helix | trans | -64.7 | -37.3 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | N48 V51 I52 L69 L70 D76 L77 | N48-A73 HydrophobicContact CB-CB 4.49Å; V51-A73 HydrophobicContact CB-CB 4.47Å; V51-A73 HydrophobicContact CG1-CB 4.09Å; I52-A73 HydrophobicContact CD1-CB 4.21Å; I52-A73 HydrophobicContact CG1-CB 3.77Å; L69-A73 PolarHBondContact O-N 3.48Å; L69-A73 VanDerWaalsContact O-N 3.08Å; L70-A73 PolarHBondContact O-N 3.27Å; A73-D76 PolarHBondContact O-N 3.44Å; A73-L77 WeakPolarHBondContact O-CG 3.49Å; A73-L77 PolarHBondContact O-N 3.13Å |
| 74 | I | 97.1 | Very high | 94.3 | Very high | 50 Ų | 50 | 19.1 Ų | 19.1 | 26% | 0.256 | 10% | 0.101 | S | C | . | . | H | α-helix | trans | -65.1 | -41.6 | 174.2 | -67 | 167.2 | 0 | 0 | 0 | 110.9 | I52 L70 N71 L72 L77 F78 W153 | I52-I74 HydrophobicContact CD1-CG1 4.19Å; L70-I74 HydrophobicContact CD1-CD1 4.45Å; L70-I74 HydrophobicContact CG-CD1 4.07Å; L70-I74 WeakPolarHBondContact O-CG1 3.46Å; L70-I74 PolarHBondContact O-N 2.99Å; N71-I74 PolarHBondContact O-N 3.28Å; L72-I74 VanDerWaalsContact C-N 3.35Å; L72-I74 PolarHBondContact O-N 2.9Å; I74-L77 WeakPolarHBondContact O-CB 3.37Å; I74-L77 PolarHBondContact O-N 2.9Å; I74-F78 HydrophobicContact CG2-CE1 4.38Å; I74-F78 HydrophobicContact CG2-CE2 4.34Å; I74-F78 HydrophobicContact CG2-CZ 4.17Å; I74-F78 PolarHBondContact O-N 3.22Å; I74-W153 HydrophobicContact CB-CZ2 4.29Å; I74-W153 HydrophobicContact CG2-CH2 4Å; I74-W153 HydrophobicContact CG2-CZ2 3.82Å |
| 75 | S | 96.9 | Very high | 94.6 | Very high | 0 Ų | 0 | 21 Ų | 21 | 0% | 0 | 11% | 0.108 | C | C | . | . | H | α-helix | trans | -59 | -46.2 | 174.6 | 174.3 | 0 | 0 | 0 | 0 | 112 | N71 L72 L77 F78 F79 G111 S114 G115 | N71-S75 WeakPolarHBondContact O-CB 3.38Å; N71-S75 PolarHBondContact O-N 3.01Å; L72-S75 WeakPolarHBondContact O-CB 3.26Å; L72-S75 PolarHBondContact O-N 3.27Å; S75-L77 VanDerWaalsContact C-N 3.28Å; S75-L77 PolarHBondContact O-N 2.89Å; S75-F78 PolarHBondContact O-N 3.44Å; S75-F79 PolarHBondContact O-N 2.87Å; S75-F79 VanDerWaalsContact O-N 3.16Å; S75-G111 WeakPolarHBondContact O-CA 3.39Å; S75-G111 PolarHBondContact OG-O 2.95Å; S75-S114 WeakPolarHBondContact CB-OG 3.17Å; S75-S114 PolarHBondContact OG-OG 2.82Å; S75-G115 VanDerWaalsContact OG-CA 3.23Å; S75-G115 WeakPolarHBondContact OG-CA 3.46Å; S75-G115 PolarHBondContact OG-N 3.14Å |
| 76 | D | 95.7 | Very high | 94.7 | Very high | 10 Ų | 10 | 22.1 Ų | 22.1 | 5% | 0.053 | 11% | 0.112 | C | C | . | . | H | α-helix | trans | -62.2 | -36.9 | 175.4 | -72.4 | -32.3 | 0 | 0 | 0 | 111.3 | L72 A73 F79 L80 C290 N293 | L72-D76 PolarHBondContact O-N 3.47Å; A73-D76 PolarHBondContact O-N 3.44Å; D76-F79 WeakPolarHBondContact O-CB 3.39Å; D76-F79 PolarHBondContact O-N 2.86Å; D76-L80 WeakPolarHBondContact O-CB 3.43Å; D76-L80 WeakPolarHBondContact O-CD1 3.18Å; D76-L80 VanDerWaalsContact O-CG 3.22Å; D76-L80 WeakPolarHBondContact O-CG 3.39Å; D76-L80 PolarHBondContact O-N 3.4Å; D76-C290 HydrophobicContact CB-CB 4.39Å; D76-N293 PolarHBondContact OD2-ND2 2.89Å |
| 77 | L | 96.4 | Very high | 94.8 | Very high | 16 Ų | 16 | 21.8 Ų | 21.8 | 8% | 0.084 | 11% | 0.111 | C | C | . | . | H | α-helix | trans | -65.4 | -42.9 | 174.8 | -72.9 | 176.9 | 0 | 0 | 0 | 113 | F45 N48 M49 I52 A73 I74 S75 F79 L80 L81 | F45-L77 HydrophobicContact CD2-CD2 3.87Å; F45-L77 HydrophobicContact CE2-CD2 4.28Å; N48-L77 HydrophobicContact CB-CD2 3.99Å; N48-L77 HydrophobicContact CB-CG 4.1Å; M49-L77 HydrophobicContact CE-CD1 3.44Å; M49-L77 VanDerWaalsContact CE-CD1 3.44Å; M49-L77 HydrophobicContact CE-CD2 3.93Å; M49-L77 HydrophobicContact CE-CG 4.33Å; M49-L77 HydrophobicContact CG-CD2 4.37Å; M49-L77 HydrophobicContact SD-CD1 3.87Å; I52-L77 HydrophobicContact CD1-CD1 3.38Å; I52-L77 HydrophobicContact CD1-CG 4.46Å; A73-L77 WeakPolarHBondContact O-CG 3.49Å; A73-L77 PolarHBondContact O-N 3.13Å; I74-L77 WeakPolarHBondContact O-CB 3.37Å; I74-L77 PolarHBondContact O-N 2.9Å; S75-L77 VanDerWaalsContact C-N 3.28Å; S75-L77 PolarHBondContact O-N 2.89Å; L77-F79 PolarHBondContact O-N 2.88Å; L77-L80 HydrophobicContact CD2-CD1 4.29Å; L77-L80 PolarHBondContact O-N 3.27Å; L77-L81 VanDerWaalsContact O-CG 3.26Å; L77-L81 WeakPolarHBondContact O-CG 3.3Å; L77-L81 PolarHBondContact O-N 3.42Å |
| 78 | F | 96.1 | Very high | 94.8 | Very high | 66 Ų | 66 | 24.6 Ų | 24.6 | 29% | 0.289 | 12% | 0.124 | S | C | . | . | H | α-helix | trans | -58.1 | -40.6 | 174.4 | -74.4 | -11.8 | 0 | 0 | 0 | 111.8 | I74 S75 L107 I110 W153 | I74-F78 HydrophobicContact CG2-CE1 4.38Å; I74-F78 HydrophobicContact CG2-CE2 4.34Å; I74-F78 HydrophobicContact CG2-CZ 4.17Å; I74-F78 PolarHBondContact O-N 3.22Å; S75-F78 PolarHBondContact O-N 3.44Å; F78-L107 HydrophobicContact CD1-CD2 4.47Å; F78-L107 HydrophobicContact CG-CD2 4.37Å; F78-I110 HydrophobicContact CD2-CG2 4.01Å; F78-I110 HydrophobicContact CE2-CG2 4.45Å; F78-W153 AromaticContact CD2-CH2 3.62Å; F78-W153 HydrophobicContact CD2-CH2 3.62Å; F78-W153 AromaticContact CD2-CZ3 3.61Å; F78-W153 HydrophobicContact CD2-CZ3 3.61Å; F78-W153 HydrophobicContact CE2-CE3 4.38Å; F78-W153 AromaticContact CE2-CH2 3.5Å; F78-W153 HydrophobicContact CE2-CH2 3.5Å; F78-W153 VanDerWaalsContact CE2-CH2 3.5Å; F78-W153 HydrophobicContact CE2-CZ2 4.45Å; F78-W153 AromaticContact CE2-CZ3 3.46Å; F78-W153 HydrophobicContact CE2-CZ3 3.46Å; F78-W153 VanDerWaalsContact CE2-CZ3 3.46Å |
| 79 | F | 94.1 | Very high | 94.7 | Very high | 7 Ų | 7 | 27.4 Ų | 27.4 | 3% | 0.031 | 14% | 0.135 | C | C | . | . | H | α-helix | trans | -63.4 | -50.6 | 173.7 | -169.6 | -93.3 | 0 | 0 | 0 | 111.7 | S75 D76 L77 L81 T82 V83 Y108 F112 W248 M287 C290 | S75-F79 PolarHBondContact O-N 2.87Å; S75-F79 VanDerWaalsContact O-N 3.16Å; D76-F79 WeakPolarHBondContact O-CB 3.39Å; D76-F79 PolarHBondContact O-N 2.86Å; L77-F79 PolarHBondContact O-N 2.88Å; F79-L81 VanDerWaalsContact C-N 3.32Å; F79-L81 PolarHBondContact O-N 3.47Å; F79-T82 PolarHBondContact O-N 2.83Å; F79-T82 PolarHBondContact O-OG1 3.06Å; F79-V83 HydrophobicContact CD1-CG2 4.35Å; F79-V83 HydrophobicContact CE1-CG2 4.37Å; F79-Y108 AromaticContact CD2-CD2 3.92Å; F79-Y108 HydrophobicContact CD2-CD2 3.92Å; F79-Y108 HydrophobicContact CD2-CE2 4.16Å; F79-Y108 HydrophobicContact CD2-CG 4.49Å; F79-Y108 AromaticContact CE2-CD2 3.4Å; F79-Y108 HydrophobicContact CE2-CD2 3.4Å; F79-Y108 AromaticContact CE2-CE2 3.19Å; F79-Y108 HydrophobicContact CE2-CE2 3.19Å; F79-Y108 HydrophobicContact CE2-CG 4.21Å; F79-Y108 AromaticContact CE2-CZ 3.83Å; F79-Y108 HydrophobicContact CZ-CD2 4.02Å; F79-Y108 AromaticContact CZ-CE2 3.55Å; F79-Y108 HydrophobicContact CZ-CE2 3.55Å; F79-F112 HydrophobicContact CE2-CD2 4.19Å; F79-W248 HydrophobicContact CE2-CH2 4.46Å; F79-W248 HydrophobicContact CZ-CH2 4.2Å; F79-W248 HydrophobicContact CZ-CZ2 4.38Å; F79-M287 HydrophobicContact CE1-CB 4.16Å; F79-M287 HydrophobicContact CE1-CG 4.21Å; F79-M287 HydrophobicContact CZ-CB 4.32Å; F79-M287 HydrophobicContact CZ-CG 3.93Å; F79-C290 HydrophobicContact CD1-CB 3.99Å |
| 80 | L | 95.8 | Very high | 94.5 | Very high | 0 Ų | 0 | 27.5 Ų | 27.5 | 0% | 0 | 14% | 0.138 | C | C | . | . | H | α-helix | trans | -59.8 | -36.7 | -178.9 | -78.1 | 161.1 | 0 | 0 | 0 | 113.4 | V40 F41 G44 D76 L77 T82 V83 P84 C290 | V40-L80 HydrophobicContact CG1-CD2 4.21Å; F41-L80 HydrophobicContact CD2-CB 4.48Å; F41-L80 VanDerWaalsContact CD2-O 3.3Å; F41-L80 WeakPolarHBondContact CD2-O 3.42Å; G44-L80 WeakPolarHBondContact O-CD1 3.49Å; D76-L80 WeakPolarHBondContact O-CB 3.43Å; D76-L80 WeakPolarHBondContact O-CD1 3.18Å; D76-L80 VanDerWaalsContact O-CG 3.22Å; D76-L80 WeakPolarHBondContact O-CG 3.39Å; D76-L80 PolarHBondContact O-N 3.4Å; L77-L80 HydrophobicContact CD2-CD1 4.29Å; L77-L80 PolarHBondContact O-N 3.27Å; L80-T82 PolarHBondContact O-N 3.39Å; L80-T82 VanDerWaalsContact O-N 3.14Å; L80-V83 WeakPolarHBondContact O-CB 3.5Å; L80-V83 PolarHBondContact O-N 3.41Å; L80-V83 VanDerWaalsContact O-N 3.08Å; L80-P84 VanDerWaalsContact O-CD 3.3Å; L80-P84 WeakPolarHBondContact O-CD 3.45Å; L80-C290 WeakPolarHBondContact CD2-SG 3.4Å; L80-C290 HydrophobicContact CG-CB 4.31Å |
| 81 | L | 96 | Very high | 94.1 | Very high | 78 Ų | 78 | 29.1 Ų | 29.1 | 41% | 0.408 | 16% | 0.155 | S | C | . | . | H | α-helix | trans | -60.2 | -23.8 | 177.4 | -73.1 | 171.9 | 0 | 0 | 0 | 112.8 | L77 F79 F85 | L77-L81 VanDerWaalsContact O-CG 3.26Å; L77-L81 WeakPolarHBondContact O-CG 3.3Å; L77-L81 PolarHBondContact O-N 3.42Å; F79-L81 VanDerWaalsContact C-N 3.32Å; F79-L81 PolarHBondContact O-N 3.47Å; L81-F85 WeakPolarHBondContact O-CD2 3.25Å; L81-F85 WeakPolarHBondContact O-CE2 3.29Å |
| 82 | T | 95.3 | Very high | 93.7 | Very high | 0 Ų | 0 | 30.5 Ų | 30.5 | 0% | 0 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -85 | -24.1 | 177.3 | 73.9 | 0 | 0 | 0 | 0 | 113.4 | F79 L80 F85 W86 L104 L107 | F79-T82 PolarHBondContact O-N 2.83Å; F79-T82 PolarHBondContact O-OG1 3.06Å; L80-T82 PolarHBondContact O-N 3.39Å; L80-T82 VanDerWaalsContact O-N 3.14Å; T82-F85 WeakPolarHBondContact O-CB 3.32Å; T82-F85 PolarHBondContact O-N 3.49Å; T82-W86 PolarHBondContact O-N 2.91Å; T82-W86 PolarHBondContact OG1-NE1 2.99Å; T82-W86 VanDerWaalsContact OG1-NE1 3.13Å; T82-L104 HydrophobicContact CG2-CB 4.44Å; T82-L104 HydrophobicContact CG2-CD2 4.02Å; T82-L104 WeakPolarHBondContact CG2-O 3.45Å; T82-L107 HydrophobicContact CG2-CB 3.6Å |
| 83 | V | 94.1 | Very high | 93.5 | Very high | 1 Ų | 1 | 32.9 Ų | 32.9 | 1% | 0.006 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -57.3 | -42.4 | -172.4 | 175 | 0 | 0 | 0 | 0 | 113.8 | Y37 F41 F79 L80 F85 W86 A87 | Y37-V83 HydrophobicContact CD2-CG1 4.49Å; Y37-V83 HydrophobicContact CG-CG1 4.01Å; Y37-V83 WeakPolarHBondContact O-CG1 3.38Å; F41-V83 HydrophobicContact CB-CG1 4.38Å; F79-V83 HydrophobicContact CD1-CG2 4.35Å; F79-V83 HydrophobicContact CE1-CG2 4.37Å; L80-V83 WeakPolarHBondContact O-CB 3.5Å; L80-V83 PolarHBondContact O-N 3.41Å; L80-V83 VanDerWaalsContact O-N 3.08Å; V83-F85 VanDerWaalsContact C-N 3.26Å; V83-F85 PolarHBondContact O-N 3.33Å; V83-W86 PolarHBondContact O-N 2.91Å; V83-A87 WeakPolarHBondContact O-CB 3.28Å; V83-A87 PolarHBondContact O-N 3.36Å |
| 84 | P | 94.4 | Very high | 93.4 | Very high | 54 Ų | 54 | 33 Ų | 33 | 35% | 0.351 | 18% | 0.18 | S | C | . | . | H | α-helix | trans | -60.2 | -34.2 | 176.9 | -25.7 | 35.5 | 0 | 0 | 0 | 113.7 | F41 L80 A87 H88 | F41-P84 HydrophobicContact CD1-CG 4.37Å; F41-P84 HydrophobicContact CD2-CG 3.71Å; F41-P84 HydrophobicContact CE1-CG 4.49Å; F41-P84 HydrophobicContact CE2-CG 3.85Å; F41-P84 HydrophobicContact CG-CG 3.99Å; F41-P84 HydrophobicContact CZ-CG 4.25Å; L80-P84 VanDerWaalsContact O-CD 3.3Å; L80-P84 WeakPolarHBondContact O-CD 3.45Å; P84-A87 WeakPolarHBondContact O-CB 3.46Å; P84-A87 PolarHBondContact O-N 3.07Å; P84-H88 PolarHBondContact O-N 3.05Å |
| 85 | F | 94.6 | Very high | 93.2 | Very high | 51 Ų | 51 | 34.7 Ų | 34.7 | 22% | 0.224 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -72.4 | -39.9 | 178.6 | -61.3 | -90.3 | 0 | 0 | 0 | 111.2 | L81 T82 V83 A87 H88 Y89 F96 M100 L104 | L81-F85 WeakPolarHBondContact O-CD2 3.25Å; L81-F85 WeakPolarHBondContact O-CE2 3.29Å; T82-F85 WeakPolarHBondContact O-CB 3.32Å; T82-F85 PolarHBondContact O-N 3.49Å; V83-F85 VanDerWaalsContact C-N 3.26Å; V83-F85 PolarHBondContact O-N 3.33Å; F85-A87 VanDerWaalsContact C-N 3.3Å; F85-A87 PolarHBondContact O-N 3.02Å; F85-H88 PolarHBondContact O-N 3.18Å; F85-Y89 WeakPolarHBondContact O-CB 3.18Å; F85-Y89 PolarHBondContact O-N 3.48Å; F85-F96 HydrophobicContact CB-CE2 4.31Å; F85-F96 AromaticContact CD1-CD1 3.97Å; F85-F96 HydrophobicContact CD1-CD1 3.97Å; F85-F96 AromaticContact CD1-CD2 3.96Å; F85-F96 HydrophobicContact CD1-CD2 3.96Å; F85-F96 AromaticContact CD1-CE1 3.76Å; F85-F96 HydrophobicContact CD1-CE1 3.76Å; F85-F96 AromaticContact CD1-CE2 3.76Å; F85-F96 HydrophobicContact CD1-CE2 3.76Å; F85-F96 HydrophobicContact CD1-CG 4.07Å; F85-F96 AromaticContact CD1-CZ 3.66Å; F85-F96 HydrophobicContact CD1-CZ 3.66Å; F85-F96 HydrophobicContact CE1-CD1 4.05Å; F85-F96 AromaticContact CE1-CE1 3.92Å; F85-F96 HydrophobicContact CE1-CE1 3.92Å; F85-F96 HydrophobicContact CE1-CZ 4.26Å; F85-M100 HydrophobicContact CD1-CE 4.4Å; F85-M100 HydrophobicContact CE1-CE 3.51Å; F85-M100 HydrophobicContact CE2-CE 4.42Å; F85-M100 HydrophobicContact CZ-CE 3.52Å; F85-L104 HydrophobicContact CB-CD1 3.56Å; F85-L104 HydrophobicContact CD1-CD1 3.59Å; F85-L104 HydrophobicContact CD2-CD1 3.8Å; F85-L104 HydrophobicContact CD2-CD2 3.7Å; F85-L104 HydrophobicContact CD2-CG 4.44Å; F85-L104 HydrophobicContact CE1-CD1 4.21Å; F85-L104 HydrophobicContact CE2-CD1 4.39Å; F85-L104 HydrophobicContact CE2-CD2 3.92Å; F85-L104 HydrophobicContact CG-CD1 3.36Å; F85-L104 HydrophobicContact CG-CD2 4.17Å; F85-L104 HydrophobicContact CG-CG 4.43Å |
| 86 | W | 92.1 | Very high | 92.9 | Very high | 32 Ų | 32 | 38.3 Ų | 38.3 | 12% | 0.121 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -66 | -33.2 | 172.9 | -58.6 | 123.6 | 0 | 0 | 0 | 112.2 | Y37 T82 V83 Y89 A90 W94 Y108 | Y37-W86 HydrophobicContact CD2-CB 4.33Å; Y37-W86 HydrophobicContact CE2-CB 4.15Å; T82-W86 PolarHBondContact O-N 2.91Å; T82-W86 PolarHBondContact OG1-NE1 2.99Å; T82-W86 VanDerWaalsContact OG1-NE1 3.13Å; V83-W86 PolarHBondContact O-N 2.91Å; W86-Y89 HydrophobicContact CE3-CD1 4.07Å; W86-Y89 HydrophobicContact CZ3-CD1 4.34Å; W86-Y89 PolarHBondContact O-N 3.31Å; W86-A90 WeakPolarHBondContact O-CB 3.41Å; W86-A90 PolarHBondContact O-N 3.12Å; W86-W94 HydrophobicContact CE3-CZ3 4.2Å; W86-W94 HydrophobicContact CH2-CZ3 4.37Å; W86-W94 AromaticContact CZ3-CZ3 3.87Å; W86-W94 HydrophobicContact CZ3-CZ3 3.87Å; W86-Y108 AromaticContact NE1-CD2 3.95Å |
| 87 | A | 91.9 | Very high | 92.8 | Very high | 7 Ų | 7 | 39.5 Ų | 39.5 | 6% | 0.058 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -64 | -46.8 | 173.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | P34 Y37 V83 P84 F85 A90 A91 | P34-A87 HydrophobicContact CB-CB 4.48Å; Y37-A87 HydrophobicContact CD2-CB 4.06Å; Y37-A87 HydrophobicContact CG-CB 4.48Å; V83-A87 WeakPolarHBondContact O-CB 3.28Å; V83-A87 PolarHBondContact O-N 3.36Å; P84-A87 WeakPolarHBondContact O-CB 3.46Å; P84-A87 PolarHBondContact O-N 3.07Å; F85-A87 VanDerWaalsContact C-N 3.3Å; F85-A87 PolarHBondContact O-N 3.02Å; A87-A90 PolarHBondContact O-N 3.3Å; A87-A91 PolarHBondContact O-N 3.47Å; A87-A91 VanDerWaalsContact O-N 3.15Å |
| 88 | H | 93.4 | Very high | 92.7 | Very high | 74 Ų | 74 | 41.7 Ų | 41.7 | 34% | 0.343 | 23% | 0.232 | S | C | . | . | H | α-helix | trans | -62.2 | -45.3 | 173.9 | -178 | 78 | 0 | 0 | 0 | 111.7 | P84 F85 A90 A91 A92 D95 F96 | P84-H88 PolarHBondContact O-N 3.05Å; F85-H88 PolarHBondContact O-N 3.18Å; H88-A90 VanDerWaalsContact C-N 3.3Å; H88-A90 PolarHBondContact O-N 2.88Å; H88-A91 PolarHBondContact O-N 2.9Å; H88-A91 VanDerWaalsContact O-N 3.1Å; H88-A92 PolarHBondContact O-N 2.93Å; H88-D95 IonicContact CD2-OD2 2.61Å; H88-D95 IonicContact CE1-OD2 2.85Å; H88-D95 IonicContact NE2-OD2 2.98Å; H88-D95 PolarHBondContact NE2-OD2 3.27Å; H88-F96 HydrophobicContact CB-CE2 4.32Å; H88-F96 HydrophobicContact CB-CZ 4.21Å; H88-F96 AromaticContact CD2-CE2 3.65Å; H88-F96 AromaticContact CD2-CZ 3.68Å |
| 89 | Y | 91 | Very high | 92.5 | Very high | 64 Ų | 64 | 44.1 Ų | 44.1 | 25% | 0.251 | 25% | 0.253 | S | S | . | . | H | α-helix | trans | -59.1 | -40.5 | 178.5 | 178.2 | -121.5 | 0 | 0 | 0 | 112.5 | F85 W86 A92 W94 | F85-Y89 WeakPolarHBondContact O-CB 3.18Å; F85-Y89 PolarHBondContact O-N 3.48Å; W86-Y89 HydrophobicContact CE3-CD1 4.07Å; W86-Y89 HydrophobicContact CZ3-CD1 4.34Å; W86-Y89 PolarHBondContact O-N 3.31Å; Y89-A92 CarbonylContact O-C 3.59Å; Y89-W94 HydrophobicContact CD2-CB 3.88Å; Y89-W94 AromaticContact CD2-CE3 3.88Å; Y89-W94 HydrophobicContact CD2-CE3 3.88Å; Y89-W94 HydrophobicContact CE2-CB 3.93Å; Y89-W94 AromaticContact CG-CE3 4Å; Y89-W94 HydrophobicContact CG-CE3 4Å |
| 90 | A | 87.6 | Confident | 92.5 | Very high | 22 Ų | 22 | 46.5 Ų | 46.5 | 18% | 0.182 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -66.7 | -36 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.7 | A30 L33 W86 A87 H88 | A30-A90 VanDerWaalsContact CA-O 3.24Å; A30-A90 WeakPolarHBondContact CA-O 3.45Å; A30-A90 WeakPolarHBondContact CB-O 3.21Å; L33-A90 HydrophobicContact CB-CB 3.96Å; L33-A90 HydrophobicContact CD1-CB 3.93Å; W86-A90 WeakPolarHBondContact O-CB 3.41Å; W86-A90 PolarHBondContact O-N 3.12Å; A87-A90 PolarHBondContact O-N 3.3Å; H88-A90 VanDerWaalsContact C-N 3.3Å; H88-A90 PolarHBondContact O-N 2.88Å |
| 91 | A | 87.8 | Confident | 92.5 | Very high | 56 Ų | 56 | 46.5 Ų | 46.5 | 46% | 0.463 | 27% | 0.265 | S | S | . | . | H | α-helix | trans | -74.7 | -35.6 | -179.8 | 0 | 0 | 0 | 0 | 0 | 113.1 | P34 A87 H88 | P34-A91 HydrophobicContact CB-CB 4.48Å; P34-A91 HydrophobicContact CG-CB 3.72Å; A87-A91 PolarHBondContact O-N 3.47Å; A87-A91 VanDerWaalsContact O-N 3.15Å; H88-A91 PolarHBondContact O-N 2.9Å; H88-A91 VanDerWaalsContact O-N 3.1Å |
| 92 | A | 88.6 | Confident | 92.5 | Very high | 50 Ų | 50 | 45.6 Ų | 45.6 | 41% | 0.413 | 26% | 0.258 | S | S | . | . | S | Bend | trans | -133.9 | -107.2 | -171.8 | 0 | 0 | 0 | 0 | 0 | 111.5 | H88 Y89 | H88-A92 PolarHBondContact O-N 2.93Å; Y89-A92 CarbonylContact O-C 3.59Å |
| 93 | Q | 88.4 | Confident | 92.5 | Very high | 51 Ų | 51 | 50.2 Ų | 50.2 | 24% | 0.238 | 28% | 0.283 | C | S | . | . | trans | -148.5 | 179.3 | -177.9 | 69.5 | -177.2 | 3.8 | 0 | 0 | 110.2 | D95 H175 | Q93-D95 WeakPolarHBondContact CG-OD1 3.5Å; Q93-D95 PolarHBondContact NE2-OD1 3.36Å; Q93-D95 PolarHBondContact O-N 3.05Å; Q93-H175 HydrophobicContact CB-CB 4.34Å; Q93-H175 PolarHBondContact OE1-ND1 2.87Å; Q93-H175 VanDerWaalsContact OE1-ND1 3.16Å | ||
| 94 | W | 93.3 | Very high | 92.6 | Very high | 3 Ų | 3 | 50.4 Ų | 50.4 | 1% | 0.011 | 28% | 0.284 | C | S | . | . | trans | -84.4 | 97.2 | 178 | -169.7 | -94.7 | 0 | 0 | 0 | 112.4 | W86 Y89 F96 G97 M100 C101 L104 S169 Y176 C178 | W86-W94 HydrophobicContact CE3-CZ3 4.2Å; W86-W94 HydrophobicContact CH2-CZ3 4.37Å; W86-W94 AromaticContact CZ3-CZ3 3.87Å; W86-W94 HydrophobicContact CZ3-CZ3 3.87Å; Y89-W94 HydrophobicContact CD2-CB 3.88Å; Y89-W94 AromaticContact CD2-CE3 3.88Å; Y89-W94 HydrophobicContact CD2-CE3 3.88Å; Y89-W94 HydrophobicContact CE2-CB 3.93Å; Y89-W94 AromaticContact CG-CE3 4Å; Y89-W94 HydrophobicContact CG-CE3 4Å; W94-F96 HydrophobicContact CD2-CD2 4.21Å; W94-F96 HydrophobicContact CE3-CD2 4.24Å; W94-F96 HydrophobicContact CH2-CD2 4.14Å; W94-F96 HydrophobicContact CZ2-CB 3.92Å; W94-F96 HydrophobicContact CZ2-CD2 4.03Å; W94-F96 HydrophobicContact CZ2-CG 4.43Å; W94-F96 HydrophobicContact CZ3-CD2 4.22Å; W94-G97 PolarHBondContact NE1-O 3.5Å; W94-M100 HydrophobicContact CZ2-CB 4.45Å; W94-C101 HydrophobicContact CZ2-CB 3.66Å; W94-L104 HydrophobicContact CH2-CD1 3.6Å; W94-L104 HydrophobicContact CZ2-CD1 4.12Å; W94-S169 VanDerWaalsContact CD1-OG 3.22Å; W94-Y176 WeakPolarHBondContact CB-O 3.3Å; W94-Y176 PolarHBondContact N-O 3.18Å; W94-Y176 WeakPolarHBondContact O-CB 3.49Å; W94-C178 HydrophobicContact CB-CB 4.4Å; W94-C178 HydrophobicContact CD2-CB 3.49Å; W94-C178 VanDerWaalsContact CD2-CB 3.49Å; W94-C178 HydrophobicContact CE3-CB 3.66Å; W94-C178 HydrophobicContact CG-CB 3.8Å; W94-C178 HydrophobicContact CH2-CB 4.49Å; W94-C178 HydrophobicContact CZ2-CB 4.41Å; W94-C178 HydrophobicContact CZ3-CB 4.15Å | ||
| 95 | D | 92.9 | Very high | 92.6 | Very high | 86 Ų | 86 | 48.2 Ų | 48.2 | 46% | 0.46 | 27% | 0.269 | S | S | . | . | trans | -96 | -2.7 | -177.6 | -59.4 | -51.5 | 0 | 0 | 0 | 114.2 | H88 Q93 | H88-D95 IonicContact CD2-OD2 2.61Å; H88-D95 IonicContact CE1-OD2 2.85Å; H88-D95 IonicContact NE2-OD2 2.98Å; H88-D95 PolarHBondContact NE2-OD2 3.27Å; Q93-D95 WeakPolarHBondContact CG-OD1 3.5Å; Q93-D95 PolarHBondContact NE2-OD1 3.36Å; Q93-D95 PolarHBondContact O-N 3.05Å | ||
| 96 | F | 92.5 | Very high | 92.7 | Very high | 76 Ų | 76 | 46 Ų | 46 | 33% | 0.333 | 26% | 0.26 | S | S | . | . | S | Bend | trans | -91.7 | 0.3 | -170 | -50.9 | -75.6 | 0 | 0 | 0 | 114.7 | F85 H88 W94 M100 | F85-F96 HydrophobicContact CB-CE2 4.31Å; F85-F96 AromaticContact CD1-CD1 3.97Å; F85-F96 HydrophobicContact CD1-CD1 3.97Å; F85-F96 AromaticContact CD1-CD2 3.96Å; F85-F96 HydrophobicContact CD1-CD2 3.96Å; F85-F96 AromaticContact CD1-CE1 3.76Å; F85-F96 HydrophobicContact CD1-CE1 3.76Å; F85-F96 AromaticContact CD1-CE2 3.76Å; F85-F96 HydrophobicContact CD1-CE2 3.76Å; F85-F96 HydrophobicContact CD1-CG 4.07Å; F85-F96 AromaticContact CD1-CZ 3.66Å; F85-F96 HydrophobicContact CD1-CZ 3.66Å; F85-F96 HydrophobicContact CE1-CD1 4.05Å; F85-F96 AromaticContact CE1-CE1 3.92Å; F85-F96 HydrophobicContact CE1-CE1 3.92Å; F85-F96 HydrophobicContact CE1-CZ 4.26Å; H88-F96 HydrophobicContact CB-CE2 4.32Å; H88-F96 HydrophobicContact CB-CZ 4.21Å; H88-F96 AromaticContact CD2-CE2 3.65Å; H88-F96 AromaticContact CD2-CZ 3.68Å; W94-F96 HydrophobicContact CD2-CD2 4.21Å; W94-F96 HydrophobicContact CE3-CD2 4.24Å; W94-F96 HydrophobicContact CH2-CD2 4.14Å; W94-F96 HydrophobicContact CZ2-CB 3.92Å; W94-F96 HydrophobicContact CZ2-CD2 4.03Å; W94-F96 HydrophobicContact CZ2-CG 4.43Å; W94-F96 HydrophobicContact CZ3-CD2 4.22Å; F96-M100 HydrophobicContact CB-CB 3.7Å; F96-M100 HydrophobicContact CB-CG 3.76Å; F96-M100 HydrophobicContact CG-CG 4.48Å; F96-M100 WeakPolarHBondContact O-CB 3.47Å |
| 97 | G | 92.8 | Very high | 92.9 | Very high | 35 Ų | 35 | 46.5 Ų | 46.5 | 36% | 0.361 | 27% | 0.265 | S | S | . | . | H | α-helix | trans | 72.7 | 177.2 | -179.7 | 0 | 0 | 0 | 0 | 0 | 114.7 | W94 C101 | W94-G97 PolarHBondContact NE1-O 3.5Å; G97-C101 PolarHBondContact O-N 3.39Å |
| 98 | N | 93.3 | Very high | 93.1 | Very high | 62 Ų | 62 | 46.8 Ų | 46.8 | 33% | 0.332 | 27% | 0.265 | S | S | . | . | H | α-helix | trans | -69.2 | -41.2 | -171.7 | -175.5 | 73.3 | 0 | 0 | 0 | 113.7 | M100 C101 Q102 K168 S169 | N98-M100 VanDerWaalsContact C-N 3.32Å; N98-M100 PolarHBondContact O-N 3.05Å; N98-C101 WeakPolarHBondContact O-CB 3.26Å; N98-C101 PolarHBondContact O-N 3.33Å; N98-Q102 PolarHBondContact O-N 3.24Å; N98-K168 WeakPolarHBondContact OD1-CA 3.33Å; N98-S169 PolarHBondContact OD1-N 3.08Å |
| 99 | T | 93.4 | Very high | 93.1 | Very high | 117 Ų | 117 | 44.3 Ų | 44.3 | 72% | 0.718 | 25% | 0.253 | S | S | * | . | H | α-helix | trans | -60.6 | -43.2 | -178.7 | -49.2 | 0 | 0 | 0 | 0 | 111.6 | Q102 L103 | T99-Q102 PolarHBondContact O-N 3.36Å; T99-L103 WeakPolarHBondContact O-CB 3.26Å; T99-L103 PolarHBondContact O-N 3.48Å |
| 100 | M | 94.5 | Very high | 93.4 | Very high | 58 Ų | 58 | 42.5 Ų | 42.5 | 29% | 0.286 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -70.2 | -34.9 | 178.4 | -160.6 | 64 | 153.6 | 0 | 0 | 111.7 | F85 W94 F96 N98 L103 L104 | F85-M100 HydrophobicContact CD1-CE 4.4Å; F85-M100 HydrophobicContact CE1-CE 3.51Å; F85-M100 HydrophobicContact CE2-CE 4.42Å; F85-M100 HydrophobicContact CZ-CE 3.52Å; W94-M100 HydrophobicContact CZ2-CB 4.45Å; F96-M100 HydrophobicContact CB-CB 3.7Å; F96-M100 HydrophobicContact CB-CG 3.76Å; F96-M100 HydrophobicContact CG-CG 4.48Å; F96-M100 WeakPolarHBondContact O-CB 3.47Å; N98-M100 VanDerWaalsContact C-N 3.32Å; N98-M100 PolarHBondContact O-N 3.05Å; M100-L103 PolarHBondContact O-N 2.84Å; M100-L103 HydrophobicContact SD-CD2 4.13Å; M100-L104 HydrophobicContact CE-CD1 4.41Å; M100-L104 HydrophobicContact CG-CD1 3.64Å; M100-L104 HydrophobicContact CG-CG 4.08Å; M100-L104 VanDerWaalsContact O-CB 3.29Å; M100-L104 WeakPolarHBondContact O-CB 3.37Å; M100-L104 VanDerWaalsContact O-CG 3.24Å; M100-L104 WeakPolarHBondContact O-CG 3.46Å; M100-L104 PolarHBondContact O-N 2.85Å; M100-L104 HydrophobicContact SD-CD1 4.4Å; M100-L104 HydrophobicContact SD-CG 4.34Å |
| 101 | C | 95.2 | Very high | 93.8 | Very high | 0 Ų | 0 | 41.6 Ų | 41.6 | 0% | 0 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -58.1 | -51.1 | 174.4 | 172.4 | 0 | 0 | 0 | 0 | 110.5 | W94 G97 N98 L103 L104 T105 T167 C178 | W94-C101 HydrophobicContact CZ2-CB 3.66Å; G97-C101 PolarHBondContact O-N 3.39Å; N98-C101 WeakPolarHBondContact O-CB 3.26Å; N98-C101 PolarHBondContact O-N 3.33Å; C101-L103 PolarHBondContact O-N 3.28Å; C101-L104 PolarHBondContact O-N 3.24Å; C101-T105 VanDerWaalsContact O-CB 3.27Å; C101-T105 WeakPolarHBondContact O-CB 3.35Å; C101-T105 PolarHBondContact O-N 3.24Å; C101-T105 PolarHBondContact O-OG1 2.92Å; C101-T167 VanDerWaalsContact SG-CG2 3.53Å; C101-C178 VanDerWaalsContact CA-SG 3.59Å; C101-C178 HydrophobicContact CB-CB 3.94Å; C101-C178 WeakPolarHBondContact CB-SG 3.44Å; C101-C178 WeakPolarHBondContact SG-CB 3.39Å; C101-C178 CovalentContact SG-SG 2.03Å; C101-C178 PolarHBondContact SG-SG 2.86Å |
| 102 | Q | 94.8 | Very high | 94 | Very high | 58 Ų | 58 | 39.3 Ų | 39.3 | 27% | 0.271 | 22% | 0.22 | S | C | . | . | H | α-helix | trans | -63.2 | -42.6 | 178.1 | -68.8 | -178.1 | -32.4 | 0 | 0 | 113 | N98 T99 G106 I164 T167 | N98-Q102 PolarHBondContact O-N 3.24Å; T99-Q102 PolarHBondContact O-N 3.36Å; Q102-G106 PolarHBondContact O-N 3.32Å; Q102-I164 HydrophobicContact CB-CG2 4.27Å; Q102-T167 WeakPolarHBondContact CG-O 3.47Å; Q102-T167 PolarHBondContact NE2-O 3.43Å |
| 103 | L | 95.7 | Very high | 94.3 | Very high | 98 Ų | 98 | 36.9 Ų | 36.9 | 51% | 0.513 | 20% | 0.2 | S | C | . | . | H | α-helix | trans | -63.6 | -49.1 | 178.7 | 179.6 | 64.2 | 0 | 0 | 0 | 111.9 | T99 M100 C101 G106 L107 | T99-L103 WeakPolarHBondContact O-CB 3.26Å; T99-L103 PolarHBondContact O-N 3.48Å; M100-L103 PolarHBondContact O-N 2.84Å; M100-L103 HydrophobicContact SD-CD2 4.13Å; C101-L103 PolarHBondContact O-N 3.28Å; L103-G106 WeakPolarHBondContact O-CA 3.47Å; L103-G106 PolarHBondContact O-N 2.9Å; L103-G106 VanDerWaalsContact O-N 3.16Å; L103-L107 HydrophobicContact CG-CD1 4.46Å; L103-L107 PolarHBondContact O-N 2.89Å |
| 104 | L | 96.2 | Very high | 94.7 | Very high | 5 Ų | 5 | 34.5 Ų | 34.5 | 3% | 0.026 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -68.7 | -38.4 | -178.4 | -68.8 | 172.3 | 0 | 0 | 0 | 111.6 | T82 F85 W94 M100 C101 G106 L107 Y108 | T82-L104 HydrophobicContact CG2-CB 4.44Å; T82-L104 HydrophobicContact CG2-CD2 4.02Å; T82-L104 WeakPolarHBondContact CG2-O 3.45Å; F85-L104 HydrophobicContact CB-CD1 3.56Å; F85-L104 HydrophobicContact CD1-CD1 3.59Å; F85-L104 HydrophobicContact CD2-CD1 3.8Å; F85-L104 HydrophobicContact CD2-CD2 3.7Å; F85-L104 HydrophobicContact CD2-CG 4.44Å; F85-L104 HydrophobicContact CE1-CD1 4.21Å; F85-L104 HydrophobicContact CE2-CD1 4.39Å; F85-L104 HydrophobicContact CE2-CD2 3.92Å; F85-L104 HydrophobicContact CG-CD1 3.36Å; F85-L104 HydrophobicContact CG-CD2 4.17Å; F85-L104 HydrophobicContact CG-CG 4.43Å; W94-L104 HydrophobicContact CH2-CD1 3.6Å; W94-L104 HydrophobicContact CZ2-CD1 4.12Å; M100-L104 HydrophobicContact CE-CD1 4.41Å; M100-L104 HydrophobicContact CG-CD1 3.64Å; M100-L104 HydrophobicContact CG-CG 4.08Å; M100-L104 VanDerWaalsContact O-CB 3.29Å; M100-L104 WeakPolarHBondContact O-CB 3.37Å; M100-L104 VanDerWaalsContact O-CG 3.24Å; M100-L104 WeakPolarHBondContact O-CG 3.46Å; M100-L104 PolarHBondContact O-N 2.85Å; M100-L104 HydrophobicContact SD-CD1 4.4Å; M100-L104 HydrophobicContact SD-CG 4.34Å; C101-L104 PolarHBondContact O-N 3.24Å; L104-G106 VanDerWaalsContact C-N 3.27Å; L104-G106 PolarHBondContact O-N 3.48Å; L104-L107 PolarHBondContact O-N 3.47Å; L104-Y108 VanDerWaalsContact O-CB 3.28Å; L104-Y108 WeakPolarHBondContact O-CB 3.3Å; L104-Y108 PolarHBondContact O-N 2.81Å |
| 105 | T | 95.1 | Very high | 94.8 | Very high | 8 Ų | 8 | 34.7 Ų | 34.7 | 5% | 0.049 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -61.8 | -38.2 | 170.4 | -63.2 | 0 | 0 | 0 | 0 | 111.5 | C101 Y108 F109 T167 | C101-T105 VanDerWaalsContact O-CB 3.27Å; C101-T105 WeakPolarHBondContact O-CB 3.35Å; C101-T105 PolarHBondContact O-N 3.24Å; C101-T105 PolarHBondContact O-OG1 2.92Å; T105-Y108 PolarHBondContact O-N 3.44Å; T105-F109 HydrophobicContact CG2-CD2 3.57Å; T105-F109 HydrophobicContact CG2-CE2 3.48Å; T105-F109 VanDerWaalsContact CG2-CE2 3.48Å; T105-F109 VanDerWaalsContact O-CD2 3.25Å; T105-F109 WeakPolarHBondContact O-CD2 2.96Å; T105-F109 PolarHBondContact O-N 3.12Å; T105-T167 HydrophobicContact CG2-CG2 4.07Å; T105-T167 WeakPolarHBondContact OG1-CG2 3.35Å |
| 106 | G | 96.2 | Very high | 94.9 | Very high | 4 Ų | 4 | 30.6 Ų | 30.6 | 4% | 0.041 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -62.1 | -51.8 | 173.4 | 0 | 0 | 0 | 0 | 0 | 112.7 | Q102 L103 L104 Y108 F109 I110 | Q102-G106 PolarHBondContact O-N 3.32Å; L103-G106 WeakPolarHBondContact O-CA 3.47Å; L103-G106 PolarHBondContact O-N 2.9Å; L103-G106 VanDerWaalsContact O-N 3.16Å; L104-G106 VanDerWaalsContact C-N 3.27Å; L104-G106 PolarHBondContact O-N 3.48Å; G106-Y108 VanDerWaalsContact C-N 3.3Å; G106-Y108 PolarHBondContact O-N 2.93Å; G106-F109 PolarHBondContact O-N 3.48Å; G106-I110 VanDerWaalsContact O-CB 3.27Å; G106-I110 WeakPolarHBondContact O-CB 3.48Å; G106-I110 WeakPolarHBondContact O-CD1 3.16Å; G106-I110 WeakPolarHBondContact O-CG1 3.4Å; G106-I110 PolarHBondContact O-N 3.44Å |
| 107 | L | 96.7 | Very high | 95.1 | Very high | 42 Ų | 42 | 28 Ų | 28 | 22% | 0.22 | 16% | 0.159 | C | C | . | . | H | α-helix | trans | -59.9 | -40.4 | 177.2 | -71.9 | 174.8 | 0 | 0 | 0 | 112.3 | F78 T82 L103 L104 G111 | F78-L107 HydrophobicContact CD1-CD2 4.47Å; F78-L107 HydrophobicContact CG-CD2 4.37Å; T82-L107 HydrophobicContact CG2-CB 3.6Å; L103-L107 HydrophobicContact CG-CD1 4.46Å; L103-L107 PolarHBondContact O-N 2.89Å; L104-L107 PolarHBondContact O-N 3.47Å; L107-G111 PolarHBondContact O-N 3.23Å |
| 108 | Y | 95.1 | Very high | 95.2 | Very high | 13 Ų | 13 | 26.4 Ų | 26.4 | 5% | 0.051 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -57.6 | -56.6 | 174.6 | 175.3 | -87.5 | 0 | 0 | 0 | 110.5 | F79 W86 L104 T105 G106 I110 G111 F112 E283 M287 | F79-Y108 AromaticContact CD2-CD2 3.92Å; F79-Y108 HydrophobicContact CD2-CD2 3.92Å; F79-Y108 HydrophobicContact CD2-CE2 4.16Å; F79-Y108 HydrophobicContact CD2-CG 4.49Å; F79-Y108 AromaticContact CE2-CD2 3.4Å; F79-Y108 HydrophobicContact CE2-CD2 3.4Å; F79-Y108 AromaticContact CE2-CE2 3.19Å; F79-Y108 HydrophobicContact CE2-CE2 3.19Å; F79-Y108 HydrophobicContact CE2-CG 4.21Å; F79-Y108 AromaticContact CE2-CZ 3.83Å; F79-Y108 HydrophobicContact CZ-CD2 4.02Å; F79-Y108 AromaticContact CZ-CE2 3.55Å; F79-Y108 HydrophobicContact CZ-CE2 3.55Å; W86-Y108 AromaticContact NE1-CD2 3.95Å; L104-Y108 VanDerWaalsContact O-CB 3.28Å; L104-Y108 WeakPolarHBondContact O-CB 3.3Å; L104-Y108 PolarHBondContact O-N 2.81Å; T105-Y108 PolarHBondContact O-N 3.44Å; G106-Y108 VanDerWaalsContact C-N 3.3Å; G106-Y108 PolarHBondContact O-N 2.93Å; Y108-I110 PolarHBondContact O-N 2.99Å; Y108-G111 PolarHBondContact O-N 3.28Å; Y108-F112 HydrophobicContact CE1-CD2 4.27Å; Y108-F112 HydrophobicContact CE1-CE2 4.35Å; Y108-F112 WeakPolarHBondContact O-CB 3.4Å; Y108-F112 PolarHBondContact O-N 3.37Å; Y108-E283 PolarHBondContact OH-OE1 3.5Å; Y108-M287 HydrophobicContact CE2-CE 4.03Å |
| 109 | F | 94.9 | Very high | 95.2 | Very high | 23 Ų | 23 | 23.6 Ų | 23.6 | 10% | 0.101 | 13% | 0.127 | C | C | . | . | H | α-helix | trans | -67.6 | -36.1 | -178 | -78.6 | -59 | 0 | 0 | 0 | 113 | T105 G106 F112 F113 S160 I198 | T105-F109 HydrophobicContact CG2-CD2 3.57Å; T105-F109 HydrophobicContact CG2-CE2 3.48Å; T105-F109 VanDerWaalsContact CG2-CE2 3.48Å; T105-F109 VanDerWaalsContact O-CD2 3.25Å; T105-F109 WeakPolarHBondContact O-CD2 2.96Å; T105-F109 PolarHBondContact O-N 3.12Å; G106-F109 PolarHBondContact O-N 3.48Å; F109-F112 HydrophobicContact CD1-CD1 4.33Å; F109-F112 WeakPolarHBondContact O-CB 3.46Å; F109-F112 PolarHBondContact O-N 3.31Å; F109-F113 HydrophobicContact CB-CD2 4.25Å; F109-F113 HydrophobicContact CB-CE2 4.19Å; F109-F113 AromaticContact CD1-CE2 3.91Å; F109-F113 HydrophobicContact CD1-CE2 3.91Å; F109-F113 HydrophobicContact CG-CE2 4.38Å; F109-F113 WeakPolarHBondContact O-CD2 3.48Å; F109-F113 PolarHBondContact O-N 3.49Å; F109-S160 VanDerWaalsContact C-OG 3.22Å; F109-S160 WeakPolarHBondContact CB-OG 3.22Å; F109-S160 PolarHBondContact O-OG 3.04Å; F109-I198 HydrophobicContact CE1-CD1 4.41Å |
| 110 | I | 96.8 | Very high | 95.2 | Very high | 25 Ų | 25 | 18.7 Ų | 18.7 | 13% | 0.128 | 10% | 0.096 | C | C | . | . | H | α-helix | trans | -62.6 | -51 | 177.1 | -73.1 | 166.8 | 0 | 0 | 0 | 109.7 | F78 G106 Y108 F112 S114 W153 V157 S160 | F78-I110 HydrophobicContact CD2-CG2 4.01Å; F78-I110 HydrophobicContact CE2-CG2 4.45Å; G106-I110 VanDerWaalsContact O-CB 3.27Å; G106-I110 WeakPolarHBondContact O-CB 3.48Å; G106-I110 WeakPolarHBondContact O-CD1 3.16Å; G106-I110 WeakPolarHBondContact O-CG1 3.4Å; G106-I110 PolarHBondContact O-N 3.44Å; Y108-I110 PolarHBondContact O-N 2.99Å; I110-F112 VanDerWaalsContact C-N 3.26Å; I110-F112 PolarHBondContact O-N 3.02Å; I110-S114 VanDerWaalsContact O-CB 3.25Å; I110-S114 WeakPolarHBondContact O-CB 3.27Å; I110-S114 PolarHBondContact O-N 3.25Å; I110-S114 PolarHBondContact O-OG 3.11Å; I110-W153 HydrophobicContact CG2-CE3 4.07Å; I110-W153 HydrophobicContact CG2-CZ3 3.61Å; I110-V157 HydrophobicContact CD1-CG2 4Å; I110-V157 HydrophobicContact CG1-CG2 4.21Å; I110-S160 PolarHBondContact N-OG 2.94Å |
| 111 | G | 95.7 | Very high | 95.2 | Very high | 3 Ų | 3 | 17.4 Ų | 17.4 | 3% | 0.031 | 9% | 0.09 | C | C | . | . | H | α-helix | trans | -63.2 | -33.7 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | S75 L107 Y108 G115 | S75-G111 WeakPolarHBondContact O-CA 3.39Å; S75-G111 PolarHBondContact OG-O 2.95Å; L107-G111 PolarHBondContact O-N 3.23Å; Y108-G111 PolarHBondContact O-N 3.28Å; G111-G115 PolarHBondContact O-N 3.45Å; G111-G115 VanDerWaalsContact O-N 3.1Å |
| 112 | F | 92.1 | Very high | 95 | Very high | 8 Ų | 8 | 17.5 Ų | 17.5 | 4% | 0.035 | 9% | 0.09 | C | C | . | . | H | α-helix | trans | -69.6 | -44.5 | 179 | -175.1 | -102.4 | 0 | 0 | 0 | 113.8 | F79 Y108 F109 I110 I198 R202 W248 Y251 | F79-F112 HydrophobicContact CE2-CD2 4.19Å; Y108-F112 HydrophobicContact CE1-CD2 4.27Å; Y108-F112 HydrophobicContact CE1-CE2 4.35Å; Y108-F112 WeakPolarHBondContact O-CB 3.4Å; Y108-F112 PolarHBondContact O-N 3.37Å; F109-F112 HydrophobicContact CD1-CD1 4.33Å; F109-F112 WeakPolarHBondContact O-CB 3.46Å; F109-F112 PolarHBondContact O-N 3.31Å; I110-F112 VanDerWaalsContact C-N 3.26Å; I110-F112 PolarHBondContact O-N 3.02Å; F112-I198 HydrophobicContact CE1-CG2 4.3Å; F112-R202 VanDerWaalsContact CD1-CD 3.4Å; F112-R202 HydrophobicContact CE1-CG 4.41Å; F112-W248 AromaticContact CD2-CH2 3.65Å; F112-W248 HydrophobicContact CD2-CH2 3.65Å; F112-W248 HydrophobicContact CD2-CZ2 4.06Å; F112-W248 HydrophobicContact CD2-CZ3 4.09Å; F112-W248 HydrophobicContact CE2-CE3 4.02Å; F112-W248 AromaticContact CE2-CH2 3.34Å; F112-W248 HydrophobicContact CE2-CH2 3.34Å; F112-W248 HydrophobicContact CE2-CZ2 4.1Å; F112-W248 AromaticContact CE2-CZ3 3.31Å; F112-W248 HydrophobicContact CE2-CZ3 3.31Å; F112-W248 HydrophobicContact CZ-CZ3 4.2Å; F112-Y251 HydrophobicContact CZ-CE1 4.36Å |
| 113 | F | 95.6 | Very high | 94.8 | Very high | 0 Ų | 0 | 14.8 Ų | 14.8 | 0% | 0 | 8% | 0.078 | C | C | . | . | H | α-helix | trans | -78.4 | -44.9 | 177.9 | -73.3 | -60.7 | 0 | 0 | 0 | 112.4 | F109 G115 I116 F117 A156 A159 I198 L201 R202 | F109-F113 HydrophobicContact CB-CD2 4.25Å; F109-F113 HydrophobicContact CB-CE2 4.19Å; F109-F113 AromaticContact CD1-CE2 3.91Å; F109-F113 HydrophobicContact CD1-CE2 3.91Å; F109-F113 HydrophobicContact CG-CE2 4.38Å; F109-F113 WeakPolarHBondContact O-CD2 3.48Å; F109-F113 PolarHBondContact O-N 3.49Å; F113-G115 VanDerWaalsContact C-N 3.26Å; F113-G115 PolarHBondContact O-N 3.4Å; F113-I116 WeakPolarHBondContact O-CG2 3.32Å; F113-I116 PolarHBondContact O-N 3.37Å; F113-F117 HydrophobicContact CB-CD2 4.49Å; F113-F117 HydrophobicContact CB-CE2 4.04Å; F113-F117 HydrophobicContact CB-CZ 4.44Å; F113-F117 VanDerWaalsContact O-CD2 3.29Å; F113-F117 WeakPolarHBondContact O-CD2 3.42Å; F113-F117 VanDerWaalsContact O-CG 3.22Å; F113-F117 WeakPolarHBondContact O-CG 3.43Å; F113-F117 PolarHBondContact O-N 3.03Å; F113-F117 VanDerWaalsContact O-N 3.08Å; F113-A156 HydrophobicContact CB-CB 4.23Å; F113-A159 HydrophobicContact CD1-CB 4.41Å; F113-A159 HydrophobicContact CD2-CB 3.87Å; F113-A159 HydrophobicContact CE2-CB 4.17Å; F113-A159 HydrophobicContact CG-CB 4.03Å; F113-I198 HydrophobicContact CZ-CG1 4.18Å; F113-L201 HydrophobicContact CD1-CD1 4.26Å; F113-L201 HydrophobicContact CE1-CB 4.31Å; F113-L201 HydrophobicContact CE1-CD1 3.97Å; F113-R202 HydrophobicContact CD1-CG 4.39Å; F113-R202 HydrophobicContact CE1-CG 4.25Å |
| 114 | S | 97.1 | Very high | 94.5 | Very high | 0 Ų | 0 | 13 Ų | 13 | 0% | 0 | 7% | 0.068 | C | C | . | . | H | α-helix | trans | -62.2 | -36.6 | 178.9 | 58.9 | 0 | 0 | 0 | 0 | 111.5 | S75 I110 I116 F117 F118 | S75-S114 WeakPolarHBondContact CB-OG 3.17Å; S75-S114 PolarHBondContact OG-OG 2.82Å; I110-S114 VanDerWaalsContact O-CB 3.25Å; I110-S114 WeakPolarHBondContact O-CB 3.27Å; I110-S114 PolarHBondContact O-N 3.25Å; I110-S114 PolarHBondContact O-OG 3.11Å; S114-I116 PolarHBondContact O-N 3.47Å; S114-F117 PolarHBondContact O-N 3.28Å; S114-F118 WeakPolarHBondContact O-CD2 3Å; S114-F118 PolarHBondContact O-N 3.45Å |
| 115 | G | 94.8 | Very high | 94.2 | Very high | 7 Ų | 7 | 12.9 Ų | 12.9 | 7% | 0.072 | 7% | 0.068 | C | C | . | . | H | α-helix | trans | -56.5 | -51.4 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.8 | L72 S75 G111 F113 F118 I119 | L72-G115 WeakPolarHBondContact CD1-O 3.29Å; S75-G115 VanDerWaalsContact OG-CA 3.23Å; S75-G115 WeakPolarHBondContact OG-CA 3.46Å; S75-G115 PolarHBondContact OG-N 3.14Å; G111-G115 PolarHBondContact O-N 3.45Å; G111-G115 VanDerWaalsContact O-N 3.1Å; F113-G115 VanDerWaalsContact C-N 3.26Å; F113-G115 PolarHBondContact O-N 3.4Å; G115-F118 PolarHBondContact O-N 2.95Å; G115-I119 WeakPolarHBondContact O-CG1 3.34Å; G115-I119 PolarHBondContact O-N 3.43Å; G115-I119 VanDerWaalsContact O-N 3.1Å |
| 116 | I | 94.3 | Very high | 93.7 | Very high | 1 Ų | 1 | 15 Ų | 15 | 1% | 0.005 | 8% | 0.075 | C | C | . | . | H | α-helix | trans | -68 | -36.8 | 178 | -172.6 | 51.9 | 0 | 0 | 0 | 112.3 | F113 S114 F118 I119 I120 R202 P206 Y244 | F113-I116 WeakPolarHBondContact O-CG2 3.32Å; F113-I116 PolarHBondContact O-N 3.37Å; S114-I116 PolarHBondContact O-N 3.47Å; I116-F118 PolarHBondContact O-N 3.38Å; I116-I119 HydrophobicContact CD1-CB 4.33Å; I116-I119 HydrophobicContact CD1-CG2 4.43Å; I116-I119 PolarHBondContact O-N 3.16Å; I116-I120 HydrophobicContact CG1-CD1 4.24Å; I116-I120 WeakPolarHBondContact O-CG1 3.23Å; I116-I120 PolarHBondContact O-N 2.92Å; I116-R202 HydrophobicContact CG2-CG 4.19Å; I116-P206 HydrophobicContact CD1-CB 3.68Å; I116-P206 HydrophobicContact CD1-CG 3.92Å; I116-P206 HydrophobicContact CG1-CB 4.1Å; I116-P206 HydrophobicContact CG1-CG 3.98Å; I116-Y244 HydrophobicContact CB-CE2 4.22Å; I116-Y244 HydrophobicContact CD1-CD1 3.94Å; I116-Y244 HydrophobicContact CD1-CD2 4.22Å; I116-Y244 HydrophobicContact CD1-CE1 3.47Å; I116-Y244 VanDerWaalsContact CD1-CE1 3.47Å; I116-Y244 HydrophobicContact CD1-CE2 3.78Å; I116-Y244 HydrophobicContact CD1-CG 4.29Å; I116-Y244 HydrophobicContact CG1-CE1 4.24Å; I116-Y244 HydrophobicContact CG1-CE2 4.31Å |
| 117 | F | 96.8 | Very high | 93.3 | Very high | 22 Ų | 22 | 17.1 Ų | 17.1 | 10% | 0.096 | 8% | 0.082 | C | C | . | . | H | α-helix | trans | -64.9 | -39.9 | 177.8 | -64 | -24.6 | 0 | 0 | 0 | 112 | F113 S114 I120 L121 T152 V155 A156 L201 L205 | F113-F117 HydrophobicContact CB-CD2 4.49Å; F113-F117 HydrophobicContact CB-CE2 4.04Å; F113-F117 HydrophobicContact CB-CZ 4.44Å; F113-F117 VanDerWaalsContact O-CD2 3.29Å; F113-F117 WeakPolarHBondContact O-CD2 3.42Å; F113-F117 VanDerWaalsContact O-CG 3.22Å; F113-F117 WeakPolarHBondContact O-CG 3.43Å; F113-F117 PolarHBondContact O-N 3.03Å; F113-F117 VanDerWaalsContact O-N 3.08Å; S114-F117 PolarHBondContact O-N 3.28Å; F117-I120 HydrophobicContact CD1-CD1 4.38Å; F117-I120 WeakPolarHBondContact O-CB 3.36Å; F117-I120 PolarHBondContact O-N 3.44Å; F117-L121 WeakPolarHBondContact O-CG 3.16Å; F117-L121 PolarHBondContact O-N 2.88Å; F117-T152 HydrophobicContact CB-CG2 3.5Å; F117-T152 HydrophobicContact CD2-CG2 4.16Å; F117-T152 HydrophobicContact CG-CG2 4.32Å; F117-V155 HydrophobicContact CE2-CG1 3.84Å; F117-V155 HydrophobicContact CZ-CG1 4.34Å; F117-A156 HydrophobicContact CD2-CB 4.32Å; F117-A156 HydrophobicContact CE2-CB 4.42Å; F117-L201 HydrophobicContact CE1-CB 4.47Å; F117-L201 HydrophobicContact CE1-CD2 4.41Å; F117-L201 HydrophobicContact CZ-CD1 4.33Å; F117-L201 HydrophobicContact CZ-CD2 4.42Å; F117-L205 HydrophobicContact CE1-CD2 4.46Å |
| 118 | F | 95.5 | Very high | 92.7 | Very high | 0 Ų | 0 | 17.5 Ų | 17.5 | 0% | 0 | 8% | 0.084 | C | C | . | . | H | α-helix | trans | -68.2 | -33.5 | 174.2 | -75.5 | -62.4 | 0 | 0 | 0 | 112.6 | Y68 N71 L72 S114 G115 I116 L121 L122 T152 W153 | Y68-F118 HydrophobicContact CD1-CD1 4.13Å; Y68-F118 HydrophobicContact CD1-CE1 4.27Å; N71-F118 HydrophobicContact CB-CD1 3.8Å; N71-F118 HydrophobicContact CB-CD2 3.84Å; N71-F118 HydrophobicContact CB-CE1 3.44Å; N71-F118 VanDerWaalsContact CB-CE1 3.44Å; N71-F118 HydrophobicContact CB-CE2 3.5Å; N71-F118 HydrophobicContact CB-CG 4.01Å; N71-F118 HydrophobicContact CB-CZ 3.3Å; L72-F118 HydrophobicContact CB-CB 4.15Å; L72-F118 HydrophobicContact CD1-CB 4.35Å; S114-F118 WeakPolarHBondContact O-CD2 3Å; S114-F118 PolarHBondContact O-N 3.45Å; G115-F118 PolarHBondContact O-N 2.95Å; I116-F118 PolarHBondContact O-N 3.38Å; F118-L121 HydrophobicContact CD1-CD1 4.05Å; F118-L121 HydrophobicContact CE1-CD1 4.22Å; F118-L121 PolarHBondContact O-N 3.3Å; F118-L122 WeakPolarHBondContact O-CB 3.38Å; F118-L122 VanDerWaalsContact O-CG 3.26Å; F118-L122 WeakPolarHBondContact O-CG 3.34Å; F118-L122 PolarHBondContact O-N 3.43Å; F118-T152 HydrophobicContact CD2-CG2 4.41Å; F118-T152 HydrophobicContact CE1-CG2 4.14Å; F118-T152 HydrophobicContact CE2-CG2 3.99Å; F118-T152 HydrophobicContact CZ-CG2 3.82Å; F118-W153 HydrophobicContact CE2-CD2 4.49Å; F118-W153 AromaticContact CE2-CE2 3.93Å; F118-W153 HydrophobicContact CE2-CZ2 4.14Å; F118-W153 AromaticContact CE2-NE1 3.91Å; F118-W153 AromaticContact CZ-NE1 3.72Å |
| 119 | I | 92.4 | Very high | 92.2 | Very high | 3 Ų | 3 | 17.9 Ų | 17.9 | 2% | 0.015 | 9% | 0.09 | C | C | . | . | H | α-helix | trans | -64.2 | -41.2 | 171.3 | -68.7 | 170.2 | 0 | 0 | 0 | 111.2 | L72 G115 I116 L122 T123 I240 M241 Y244 | L72-I119 HydrophobicContact CD1-CD1 4.43Å; L72-I119 HydrophobicContact CD1-CG1 4.05Å; L72-I119 HydrophobicContact CD2-CG1 4.06Å; G115-I119 WeakPolarHBondContact O-CG1 3.34Å; G115-I119 PolarHBondContact O-N 3.43Å; G115-I119 VanDerWaalsContact O-N 3.1Å; I116-I119 HydrophobicContact CD1-CB 4.33Å; I116-I119 HydrophobicContact CD1-CG2 4.43Å; I116-I119 PolarHBondContact O-N 3.16Å; I119-L122 PolarHBondContact O-N 2.95Å; I119-T123 PolarHBondContact O-N 3.18Å; I119-T123 PolarHBondContact O-OG1 3.02Å; I119-I240 HydrophobicContact CD1-CG2 4.35Å; I119-I240 HydrophobicContact CG1-CG2 4.31Å; I119-M241 HydrophobicContact CG2-CE 3.43Å; I119-M241 VanDerWaalsContact CG2-CE 3.43Å; I119-M241 HydrophobicContact CG2-SD 3.83Å; I119-Y244 HydrophobicContact CD1-CD2 4.03Å; I119-Y244 HydrophobicContact CD1-CG 4.41Å |
| 120 | I | 94.1 | Very high | 91.4 | Very high | 15 Ų | 15 | 17.2 Ų | 17.2 | 8% | 0.077 | 9% | 0.087 | C | C | . | . | H | α-helix | trans | -61.3 | -49 | 173.9 | -73.2 | 167.4 | 0 | 0 | 0 | 110.2 | I116 F117 L122 T123 I124 L205 P206 V209 | I116-I120 HydrophobicContact CG1-CD1 4.24Å; I116-I120 WeakPolarHBondContact O-CG1 3.23Å; I116-I120 PolarHBondContact O-N 2.92Å; F117-I120 HydrophobicContact CD1-CD1 4.38Å; F117-I120 WeakPolarHBondContact O-CB 3.36Å; F117-I120 PolarHBondContact O-N 3.44Å; I120-L122 VanDerWaalsContact C-N 3.33Å; I120-L122 PolarHBondContact O-N 3.26Å; I120-T123 WeakPolarHBondContact O-CA 3.14Å; I120-T123 WeakPolarHBondContact O-CB 3.27Å; I120-T123 PolarHBondContact O-N 3.46Å; I120-I124 HydrophobicContact CG2-CD1 3.78Å; I120-I124 HydrophobicContact CG2-CG1 4.47Å; I120-I124 WeakPolarHBondContact O-CG1 3.46Å; I120-I124 PolarHBondContact O-N 3.08Å; I120-L205 HydrophobicContact CD1-CD2 4.01Å; I120-L205 HydrophobicContact CD1-CG 4.06Å; I120-P206 HydrophobicContact CD1-CB 3.94Å; I120-P206 HydrophobicContact CG1-CB 3.91Å; I120-V209 HydrophobicContact CG2-CG1 4.23Å; I120-V209 HydrophobicContact CG2-CG2 4.1Å |
| 121 | L | 94.4 | Very high | 90.7 | Very high | 31 Ų | 31 | 17.8 Ų | 17.8 | 16% | 0.162 | 9% | 0.092 | C | C | . | . | H | α-helix | trans | -61.6 | -38.9 | 178.1 | -73.6 | 178.7 | 0 | 0 | 0 | 112.5 | Y68 F117 F118 T123 I124 D125 T152 | Y68-L121 HydrophobicContact CD1-CD1 4.42Å; Y68-L121 HydrophobicContact CD2-CB 4.02Å; Y68-L121 HydrophobicContact CE1-CB 4.43Å; Y68-L121 HydrophobicContact CE1-CD1 3.94Å; Y68-L121 HydrophobicContact CE2-CB 3.79Å; Y68-L121 HydrophobicContact CG-CB 4.41Å; F117-L121 WeakPolarHBondContact O-CG 3.16Å; F117-L121 PolarHBondContact O-N 2.88Å; F118-L121 HydrophobicContact CD1-CD1 4.05Å; F118-L121 HydrophobicContact CE1-CD1 4.22Å; F118-L121 PolarHBondContact O-N 3.3Å; L121-T123 VanDerWaalsContact C-N 3.3Å; L121-T123 PolarHBondContact O-N 2.97Å; L121-I124 PolarHBondContact O-N 3.16Å; L121-D125 WeakPolarHBondContact O-CB 3.2Å; L121-D125 PolarHBondContact O-N 3.42Å; L121-T152 HydrophobicContact CD1-CG2 4.4Å; L121-T152 VanDerWaalsContact CD1-OG1 3.32Å; L121-T152 WeakPolarHBondContact CD1-OG1 3.15Å |
| 122 | L | 90.5 | Very high | 90 | Very high | 1 Ų | 1 | 21.8 Ų | 21.8 | 1% | 0.005 | 11% | 0.11 | C | C | . | . | H | α-helix | trans | -61.9 | -38.9 | 172.6 | -77.9 | 167.4 | 0 | 0 | 0 | 111.9 | T65 Y68 L69 L72 F118 I119 I120 R126 | T65-L122 HydrophobicContact CG2-CD2 3.58Å; Y68-L122 HydrophobicContact CD2-CD2 4.35Å; L69-L122 HydrophobicContact CD2-CD1 3.88Å; L69-L122 HydrophobicContact CD2-CD2 4.2Å; L69-L122 HydrophobicContact CG-CD2 4.11Å; L72-L122 HydrophobicContact CD2-CD1 3.93Å; F118-L122 WeakPolarHBondContact O-CB 3.38Å; F118-L122 VanDerWaalsContact O-CG 3.26Å; F118-L122 WeakPolarHBondContact O-CG 3.34Å; F118-L122 PolarHBondContact O-N 3.43Å; I119-L122 PolarHBondContact O-N 2.95Å; I120-L122 VanDerWaalsContact C-N 3.33Å; I120-L122 PolarHBondContact O-N 3.26Å; L122-R126 WeakPolarHBondContact O-CG 3.44Å; L122-R126 PolarHBondContact O-N 3.12Å |
| 123 | T | 89.9 | Confident | 89.1 | Confident | 1 Ų | 1 | 23.8 Ų | 23.8 | 1% | 0.006 | 13% | 0.128 | C | C | . | . | H | α-helix | trans | -67.2 | -45.2 | 177.8 | -57.5 | 0 | 0 | 0 | 0 | 111.2 | I119 I120 L121 R126 Y127 V209 C213 Y214 M241 | I119-T123 PolarHBondContact O-N 3.18Å; I119-T123 PolarHBondContact O-OG1 3.02Å; I120-T123 WeakPolarHBondContact O-CA 3.14Å; I120-T123 WeakPolarHBondContact O-CB 3.27Å; I120-T123 PolarHBondContact O-N 3.46Å; L121-T123 VanDerWaalsContact C-N 3.3Å; L121-T123 PolarHBondContact O-N 2.97Å; T123-R126 PolarHBondContact O-N 2.96Å; T123-Y127 WeakPolarHBondContact O-CB 3.33Å; T123-Y127 PolarHBondContact O-N 3.39Å; T123-V209 HydrophobicContact CG2-CG1 4.15Å; T123-C213 HydrophobicContact CG2-CB 3.84Å; T123-Y214 HydrophobicContact CG2-CE2 3.89Å; T123-M241 HydrophobicContact CG2-CE 4.42Å; T123-M241 WeakPolarHBondContact OG1-CE 3.33Å |
| 124 | I | 91.1 | Very high | 87.7 | Confident | 61 Ų | 61 | 30 Ų | 30 | 31% | 0.313 | 17% | 0.165 | S | C | . | . | H | α-helix | trans | -64.9 | -44.2 | 176.4 | -64.6 | 168.6 | 0 | 0 | 0 | 110.8 | I120 L121 R126 Y127 L128 V209 | I120-I124 HydrophobicContact CG2-CD1 3.78Å; I120-I124 HydrophobicContact CG2-CG1 4.47Å; I120-I124 WeakPolarHBondContact O-CG1 3.46Å; I120-I124 PolarHBondContact O-N 3.08Å; L121-I124 PolarHBondContact O-N 3.16Å; I124-R126 VanDerWaalsContact C-N 3.28Å; I124-R126 PolarHBondContact O-N 3.37Å; I124-Y127 WeakPolarHBondContact O-CB 3.35Å; I124-Y127 PolarHBondContact O-N 2.92Å; I124-Y127 VanDerWaalsContact O-N 3.15Å; I124-L128 HydrophobicContact CG2-CD1 4.01Å; I124-L128 HydrophobicContact CG2-CG 4.29Å; I124-L128 WeakPolarHBondContact O-CG 3.32Å; I124-L128 PolarHBondContact O-N 3.37Å; I124-V209 HydrophobicContact CG1-CG1 4.04Å |
| 125 | D | 88.4 | Confident | 86.1 | Confident | 3 Ų | 3 | 35.5 Ų | 35.5 | 2% | 0.016 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -55.7 | -43.7 | 176 | 175.3 | 63.8 | 0 | 0 | 0 | 111.6 | T65 Y68 L121 A129 R140 | T65-D125 PolarHBondContact OG1-OD2 3.5Å; Y68-D125 HydrophobicContact CD2-CB 4.3Å; Y68-D125 HydrophobicContact CE2-CB 4.12Å; L121-D125 WeakPolarHBondContact O-CB 3.2Å; L121-D125 PolarHBondContact O-N 3.42Å; D125-A129 WeakPolarHBondContact O-CB 3.22Å; D125-A129 PolarHBondContact O-N 3.37Å; D125-A129 VanDerWaalsContact O-N 3.11Å; D125-R140 IonicContact OD1-CZ 3.94Å; D125-R140 IonicContact OD1-NE 2.71Å; D125-R140 PolarHBondContact OD1-NE 3.1Å; D125-R140 IonicContact OD1-NH2 3.42Å; D125-R140 PolarHBondContact OD1-NH2 3.13Å; D125-R140 IonicContact OD2-CZ 3.6Å; D125-R140 IonicContact OD2-NH2 2.65Å; D125-R140 PolarHBondContact OD2-NH2 3.49Å |
| 126 | R | 85.6 | Confident | 84.6 | Confident | 53 Ų | 53 | 35.7 Ų | 35.7 | 20% | 0.2 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -69 | -41.9 | 175.3 | -72.6 | -60.7 | 136 | -160.6 | 8.2 | 113 | T65 L122 T123 I124 A129 V130 I237 | T65-R126 VanDerWaalsContact CB-NH2 3.3Å; T65-R126 PolarHBondContact OG1-NH2 3.23Å; L122-R126 WeakPolarHBondContact O-CG 3.44Å; L122-R126 PolarHBondContact O-N 3.12Å; T123-R126 PolarHBondContact O-N 2.96Å; I124-R126 VanDerWaalsContact C-N 3.28Å; I124-R126 PolarHBondContact O-N 3.37Å; R126-A129 PolarHBondContact O-N 3.08Å; R126-V130 WeakPolarHBondContact O-CG2 3.12Å; R126-V130 PolarHBondContact O-N 3.4Å; R126-I237 HydrophobicContact CG-CB 4.29Å; R126-I237 HydrophobicContact CG-CG1 3.56Å |
| 127 | Y | 86.8 | Confident | 83.1 | Confident | 48 Ų | 48 | 43 Ų | 43 | 19% | 0.188 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -56.2 | -52.1 | 176.9 | 173.5 | -100.1 | 0 | 0 | 0 | 111.2 | T123 I124 A129 V130 V131 H132 C213 I217 | T123-Y127 WeakPolarHBondContact O-CB 3.33Å; T123-Y127 PolarHBondContact O-N 3.39Å; I124-Y127 WeakPolarHBondContact O-CB 3.35Å; I124-Y127 PolarHBondContact O-N 2.92Å; I124-Y127 VanDerWaalsContact O-N 3.15Å; Y127-A129 VanDerWaalsContact C-N 3.32Å; Y127-A129 PolarHBondContact O-N 3.15Å; Y127-V130 PolarHBondContact O-N 2.99Å; Y127-V131 HydrophobicContact CD2-CB 4.37Å; Y127-V131 HydrophobicContact CD2-CG2 3.75Å; Y127-V131 HydrophobicContact CE2-CB 4.08Å; Y127-V131 HydrophobicContact CE2-CG1 4.29Å; Y127-V131 HydrophobicContact CE2-CG2 3.61Å; Y127-V131 WeakPolarHBondContact O-CB 3.37Å; Y127-V131 PolarHBondContact O-N 3.42Å; Y127-H132 AromaticContact CE1-CD2 3.78Å; Y127-H132 AromaticContact CE1-NE2 3.89Å; Y127-C213 VanDerWaalsContact CD2-CA 3.46Å; Y127-C213 HydrophobicContact CD2-CB 3.88Å; Y127-C213 VanDerWaalsContact CD2-O 3.25Å; Y127-C213 WeakPolarHBondContact CD2-O 3.29Å; Y127-C213 HydrophobicContact CG-CB 4.1Å; Y127-I217 HydrophobicContact CD2-CD1 4.49Å; Y127-I217 HydrophobicContact CD2-CG1 4.1Å |
| 128 | L | 85.9 | Confident | 81.6 | Confident | 49 Ų | 49 | 50 Ų | 50 | 26% | 0.257 | 26% | 0.259 | S | S | . | . | H | α-helix | trans | -60.8 | -42.5 | 178.9 | -67.6 | 175.2 | 0 | 0 | 0 | 111.5 | I124 V130 H132 | I124-L128 HydrophobicContact CG2-CD1 4.01Å; I124-L128 HydrophobicContact CG2-CG 4.29Å; I124-L128 WeakPolarHBondContact O-CG 3.32Å; I124-L128 PolarHBondContact O-N 3.37Å; L128-V130 VanDerWaalsContact C-N 3.27Å; L128-V130 PolarHBondContact O-N 3.22Å; L128-H132 HydrophobicContact CD2-CB 4.5Å; L128-H132 CarbonylContact O-C 3.55Å; L128-H132 WeakPolarHBondContact O-CA 3.18Å; L128-H132 PolarHBondContact O-N 3.29Å |
| 129 | A | 83.1 | Confident | 80 | Confident | 21 Ų | 21 | 53.1 Ų | 53.1 | 17% | 0.174 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -63 | -30.6 | 178.7 | 0 | 0 | 0 | 0 | 0 | 113.8 | D125 R126 Y127 | D125-A129 WeakPolarHBondContact O-CB 3.22Å; D125-A129 PolarHBondContact O-N 3.37Å; D125-A129 VanDerWaalsContact O-N 3.11Å; R126-A129 PolarHBondContact O-N 3.08Å; Y127-A129 VanDerWaalsContact C-N 3.32Å; Y127-A129 PolarHBondContact O-N 3.15Å |
| 130 | V | 79.3 | Confident | 79.2 | Confident | 9 Ų | 9 | 56.3 Ų | 56.3 | 6% | 0.055 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -94.4 | -46.3 | -175.7 | 172.5 | 0 | 0 | 0 | 0 | 112.2 | R126 Y127 L128 I217 T220 R230 V234 | R126-V130 WeakPolarHBondContact O-CG2 3.12Å; R126-V130 PolarHBondContact O-N 3.4Å; Y127-V130 PolarHBondContact O-N 2.99Å; L128-V130 VanDerWaalsContact C-N 3.27Å; L128-V130 PolarHBondContact O-N 3.22Å; V130-I217 HydrophobicContact CB-CG1 4.36Å; V130-I217 HydrophobicContact CG1-CG1 4.34Å; V130-I217 HydrophobicContact CG1-CG2 4.24Å; V130-T220 HydrophobicContact CG1-CG2 4.49Å; V130-R230 HydrophobicContact CG2-CG 4.02Å; V130-V234 HydrophobicContact CG2-CG2 4.02Å |
| 131 | V | 82.6 | Confident | 78.7 | Confident | 38 Ų | 38 | 59 Ų | 59 | 23% | 0.23 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -89.1 | -34.8 | -172.8 | -177.7 | 0 | 0 | 0 | 0 | 111.5 | Y127 I217 | Y127-V131 HydrophobicContact CD2-CB 4.37Å; Y127-V131 HydrophobicContact CD2-CG2 3.75Å; Y127-V131 HydrophobicContact CE2-CB 4.08Å; Y127-V131 HydrophobicContact CE2-CG1 4.29Å; Y127-V131 HydrophobicContact CE2-CG2 3.61Å; Y127-V131 WeakPolarHBondContact O-CB 3.37Å; Y127-V131 PolarHBondContact O-N 3.42Å; V131-I217 HydrophobicContact CG2-CG1 4.21Å |
| 132 | H | 80.8 | Confident | 78.3 | Confident | 86 Ų | 86 | 60.1 Ų | 60.1 | 40% | 0.398 | 31% | 0.313 | S | S | . | . | trans | -121 | 48.5 | -175.9 | -62 | -72.5 | 0 | 0 | 0 | 111.9 | Y127 L128 V134 F135 A136 | Y127-H132 AromaticContact CE1-CD2 3.78Å; Y127-H132 AromaticContact CE1-NE2 3.89Å; L128-H132 HydrophobicContact CD2-CB 4.5Å; L128-H132 CarbonylContact O-C 3.55Å; L128-H132 WeakPolarHBondContact O-CA 3.18Å; L128-H132 PolarHBondContact O-N 3.29Å; H132-V134 VanDerWaalsContact C-N 3.26Å; H132-V134 PolarHBondContact O-N 2.83Å; H132-V134 VanDerWaalsContact O-N 3.11Å; H132-F135 HydrophobicContact CB-CB 4.21Å; H132-F135 PolarHBondContact O-N 3.46Å; H132-A136 WeakPolarHBondContact O-CB 3.24Å; H132-A136 PolarHBondContact O-N 3.3Å | ||
| 133 | A | 72.6 | Confident | 78.3 | Confident | 51 Ų | 51 | 65 Ų | 65 | 42% | 0.421 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -53.7 | -35.2 | -171.9 | 0 | 0 | 0 | 0 | 0 | 114.8 | L137 | A133-L137 PolarHBondContact O-N 2.61Å |
| 134 | V | 66.1 | Low | 78.2 | Confident | 129 Ų | 129 | 69.9 Ų | 69.9 | 78% | 0.782 | 36% | 0.364 | S | S | * | . | H | α-helix | trans | -71.5 | -41.1 | 178.8 | -179.2 | 0 | 0 | 0 | 0 | 111.9 | H132 | H132-V134 VanDerWaalsContact C-N 3.26Å; H132-V134 PolarHBondContact O-N 2.83Å; H132-V134 VanDerWaalsContact O-N 3.11Å |
| 135 | F | 62.7 | Low | 78.3 | Confident | 117 Ų | 117 | 67 Ų | 67 | 51% | 0.513 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -69.3 | -37.8 | 175.2 | -177.1 | -100.2 | 0 | 0 | 0 | 111.3 | H132 L137 K138 D139 | H132-F135 HydrophobicContact CB-CB 4.21Å; H132-F135 PolarHBondContact O-N 3.46Å; F135-L137 PolarHBondContact O-N 2.85Å; F135-K138 PolarHBondContact O-N 3.27Å; F135-K138 VanDerWaalsContact O-N 3.1Å; F135-D139 HydrophobicContact CE1-CB 4.3Å; F135-D139 VanDerWaalsContact CE1-OD2 3.23Å; F135-D139 WeakPolarHBondContact CE1-OD2 3.43Å; F135-D139 VanDerWaalsContact CE2-OD2 3.31Å; F135-D139 WeakPolarHBondContact CE2-OD2 3.14Å; F135-D139 WeakPolarHBondContact CZ-OD2 3.23Å; F135-D139 PolarHBondContact O-N 2.86Å |
| 136 | A | 63.8 | Low | 78.6 | Confident | 10 Ų | 10 | 70.1 Ų | 70.1 | 8% | 0.083 | 37% | 0.369 | C | S | . | . | H | α-helix | trans | -61.7 | -24.8 | 178.5 | 0 | 0 | 0 | 0 | 0 | 114.3 | H132 K138 R140 | H132-A136 WeakPolarHBondContact O-CB 3.24Å; H132-A136 PolarHBondContact O-N 3.3Å; A136-K138 VanDerWaalsContact C-N 3.33Å; A136-R140 HydrophobicContact CB-CG 4.33Å; A136-R140 VanDerWaalsContact O-CB 3.29Å; A136-R140 WeakPolarHBondContact O-CB 3.25Å; A136-R140 WeakPolarHBondContact O-CG 3.13Å; A136-R140 PolarHBondContact O-N 2.88Å |
| 137 | L | 63.8 | Low | 79 | Confident | 154 Ų | 154 | 71.1 Ų | 71.1 | 81% | 0.806 | 38% | 0.38 | S | S | * | . | H | α-helix | trans | -71 | -27.2 | 175.8 | -76.8 | 164.3 | 0 | 0 | 0 | 112.9 | A133 F135 | A133-L137 PolarHBondContact O-N 2.61Å; F135-L137 PolarHBondContact O-N 2.85Å |
| 138 | K | 63.9 | Low | 79.5 | Confident | 169 Ų | 169 | 69.9 Ų | 69.9 | 74% | 0.735 | 38% | 0.378 | S | S | * | . | H | α-helix | trans | -90.9 | -38 | -178.1 | -167.2 | 177.7 | 176.6 | -175.2 | 0 | 112.5 | F135 A136 | F135-K138 PolarHBondContact O-N 3.27Å; F135-K138 VanDerWaalsContact O-N 3.1Å; A136-K138 VanDerWaalsContact C-N 3.33Å |
| 139 | D | 63 | Low | 80 | Confident | 66 Ų | 66 | 67.7 Ų | 67.7 | 35% | 0.353 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -103.3 | -11.7 | -167 | -72.9 | 2 | 0 | 0 | 0 | 115.2 | F135 T141 | F135-D139 HydrophobicContact CE1-CB 4.3Å; F135-D139 VanDerWaalsContact CE1-OD2 3.23Å; F135-D139 WeakPolarHBondContact CE1-OD2 3.43Å; F135-D139 VanDerWaalsContact CE2-OD2 3.31Å; F135-D139 WeakPolarHBondContact CE2-OD2 3.14Å; F135-D139 WeakPolarHBondContact CZ-OD2 3.23Å; F135-D139 PolarHBondContact O-N 2.86Å; D139-T141 VanDerWaalsContact C-N 3.27Å; D139-T141 PolarHBondContact O-N 3.39Å; D139-T141 VanDerWaalsContact O-N 3.14Å |
| 140 | R | 75.2 | Confident | 80.7 | Confident | 71 Ų | 71 | 70.9 Ų | 70.9 | 27% | 0.268 | 38% | 0.383 | S | S | . | . | trans | -90.4 | 46.3 | -178.8 | -63.1 | 176.2 | 70.7 | -135.1 | -0.3 | 113.5 | M64 T65 D125 A136 | M64-R140 HydrophobicContact SD-CB 4.02Å; M64-R140 HydrophobicContact SD-CG 4.09Å; T65-R140 PolarHBondContact OG1-NH2 2.89Å; D125-R140 IonicContact OD1-CZ 3.94Å; D125-R140 IonicContact OD1-NE 2.71Å; D125-R140 PolarHBondContact OD1-NE 3.1Å; D125-R140 IonicContact OD1-NH2 3.42Å; D125-R140 PolarHBondContact OD1-NH2 3.13Å; D125-R140 IonicContact OD2-CZ 3.6Å; D125-R140 IonicContact OD2-NH2 2.65Å; D125-R140 PolarHBondContact OD2-NH2 3.49Å; A136-R140 HydrophobicContact CB-CG 4.33Å; A136-R140 VanDerWaalsContact O-CB 3.29Å; A136-R140 WeakPolarHBondContact O-CB 3.25Å; A136-R140 WeakPolarHBondContact O-CG 3.13Å; A136-R140 PolarHBondContact O-N 2.88Å | ||
| 141 | T | 82.7 | Confident | 81.6 | Confident | 70 Ų | 70 | 75 Ų | 75 | 43% | 0.429 | 41% | 0.405 | S | S | . | . | trans | -77 | 154.4 | 175.2 | 64.9 | 0 | 0 | 0 | 0 | 111.1 | D139 T143 F144 G145 | D139-T141 VanDerWaalsContact C-N 3.27Å; D139-T141 PolarHBondContact O-N 3.39Å; D139-T141 VanDerWaalsContact O-N 3.14Å; T141-T143 PolarHBondContact O-N 2.71Å; T141-F144 PolarHBondContact O-N 3.35Å; T141-F144 PolarHBondContact OG1-N 3.14Å; T141-G145 PolarHBondContact O-N 3.08Å; T141-G145 VanDerWaalsContact O-N 3.16Å | ||
| 142 | V | 86.9 | Confident | 82.3 | Confident | 56 Ų | 56 | 74 Ų | 74 | 34% | 0.339 | 40% | 0.399 | S | S | . | . | H | α-helix | trans | -59.4 | -37.9 | 175.2 | 174.3 | 0 | 0 | 0 | 0 | 110.7 | I67 F144 G145 V146 | I67-V142 HydrophobicContact CD1-CG1 4.16Å; I67-V142 HydrophobicContact CG1-CG1 4.19Å; V142-F144 PolarHBondContact O-N 2.65Å; V142-G145 PolarHBondContact O-N 3.38Å; V142-G145 VanDerWaalsContact O-N 3.16Å; V142-V146 HydrophobicContact CG1-CG2 4.43Å; V142-V146 WeakPolarHBondContact O-CG2 3.41Å; V142-V146 PolarHBondContact O-N 3.34Å |
| 143 | T | 89.3 | Confident | 83.2 | Confident | 103 Ų | 103 | 72.2 Ų | 72.2 | 63% | 0.632 | 39% | 0.388 | S | S | * | . | H | α-helix | trans | -57.2 | -47.8 | 176.7 | -48.4 | 0 | 0 | 0 | 0 | 111.8 | T141 G145 V146 V147 | T141-T143 PolarHBondContact O-N 2.71Å; T143-G145 VanDerWaalsContact C-N 3.33Å; T143-G145 PolarHBondContact O-N 3.43Å; T143-V146 PolarHBondContact O-N 2.9Å; T143-V147 WeakPolarHBondContact O-CG2 3.22Å; T143-V147 PolarHBondContact O-N 2.89Å |
| 144 | F | 89.3 | Confident | 84.4 | Confident | 103 Ų | 103 | 73.1 Ų | 73.1 | 45% | 0.452 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -62.7 | -42 | 177.3 | -170.6 | -103.1 | 0 | 0 | 0 | 111.4 | M64 T141 V142 V146 V147 T148 | M64-F144 HydrophobicContact CE-CD1 3.55Å; M64-F144 HydrophobicContact CE-CE1 3.92Å; M64-F144 HydrophobicContact SD-CD1 4.26Å; T141-F144 PolarHBondContact O-N 3.35Å; T141-F144 PolarHBondContact OG1-N 3.14Å; V142-F144 PolarHBondContact O-N 2.65Å; F144-V146 VanDerWaalsContact C-N 3.3Å; F144-V146 PolarHBondContact O-N 3.38Å; F144-V147 PolarHBondContact O-N 3.43Å; F144-T148 HydrophobicContact CD1-CG2 3.9Å; F144-T148 HydrophobicContact CE1-CG2 3.48Å; F144-T148 VanDerWaalsContact CE1-CG2 3.48Å; F144-T148 HydrophobicContact CE2-CG2 4.21Å; F144-T148 HydrophobicContact CG-CG2 4.42Å; F144-T148 HydrophobicContact CZ-CG2 3.66Å; F144-T148 WeakPolarHBondContact O-CG2 3.25Å; F144-T148 PolarHBondContact O-N 3.03Å; F144-T148 PolarHBondContact O-OG1 2.87Å |
| 145 | G | 91.7 | Very high | 85.9 | Confident | 0 Ų | 0 | 70.3 Ų | 70.3 | 0% | 0 | 37% | 0.371 | C | S | . | . | H | α-helix | trans | -59 | -36 | 174.2 | 0 | 0 | 0 | 0 | 0 | 114.4 | T141 V142 T143 T148 S149 | T141-G145 PolarHBondContact O-N 3.08Å; T141-G145 VanDerWaalsContact O-N 3.16Å; V142-G145 PolarHBondContact O-N 3.38Å; V142-G145 VanDerWaalsContact O-N 3.16Å; T143-G145 VanDerWaalsContact C-N 3.33Å; T143-G145 PolarHBondContact O-N 3.43Å; G145-T148 WeakPolarHBondContact CA-OG1 3.46Å; G145-T148 PolarHBondContact O-OG1 2.9Å; G145-T148 VanDerWaalsContact O-OG1 3.08Å; G145-S149 WeakPolarHBondContact O-CB 3.27Å; G145-S149 PolarHBondContact O-N 3.22Å; G145-S149 VanDerWaalsContact O-N 3.14Å; G145-S149 PolarHBondContact O-OG 3.1Å |
| 146 | V | 94.7 | Very high | 87.5 | Confident | 70 Ų | 70 | 64.8 Ų | 64.8 | 42% | 0.424 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -70.2 | -47.9 | 175.2 | 172.5 | 0 | 0 | 0 | 0 | 110.6 | V142 T143 F144 T148 S149 V150 | V142-V146 HydrophobicContact CG1-CG2 4.43Å; V142-V146 WeakPolarHBondContact O-CG2 3.41Å; V142-V146 PolarHBondContact O-N 3.34Å; T143-V146 PolarHBondContact O-N 2.9Å; F144-V146 VanDerWaalsContact C-N 3.3Å; F144-V146 PolarHBondContact O-N 3.38Å; V146-T148 PolarHBondContact O-N 3.47Å; V146-S149 WeakPolarHBondContact O-CB 3.37Å; V146-S149 PolarHBondContact O-N 3.39Å; V146-V150 WeakPolarHBondContact O-CG2 3.44Å; V146-V150 PolarHBondContact O-N 3.07Å |
| 147 | V | 95.6 | Very high | 89.1 | Confident | 74 Ų | 74 | 67.2 Ų | 67.2 | 45% | 0.448 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -60 | -48 | 179.9 | 172.8 | 0 | 0 | 0 | 0 | 111.1 | T143 F144 S149 V150 I151 | T143-V147 WeakPolarHBondContact O-CG2 3.22Å; T143-V147 PolarHBondContact O-N 2.89Å; F144-V147 PolarHBondContact O-N 3.43Å; V147-S149 VanDerWaalsContact C-N 3.3Å; V147-S149 PolarHBondContact O-N 3.41Å; V147-V150 PolarHBondContact O-N 2.9Å; V147-I151 HydrophobicContact CG1-CD1 4.02Å; V147-I151 WeakPolarHBondContact O-CG1 3.37Å; V147-I151 PolarHBondContact O-N 3.36Å; V147-I151 VanDerWaalsContact O-N 3.08Å |
| 148 | T | 95.8 | Very high | 90.7 | Very high | 21 Ų | 21 | 66.3 Ų | 66.3 | 13% | 0.129 | 35% | 0.351 | C | S | . | . | H | α-helix | trans | -62 | -38.9 | 177.2 | 53.9 | 0 | 0 | 0 | 0 | 111.7 | Y68 F144 G145 V146 I151 T152 | Y68-T148 WeakPolarHBondContact CE1-OG1 3.46Å; Y68-T148 WeakPolarHBondContact OH-CB 3.36Å; Y68-T148 PolarHBondContact OH-OG1 2.94Å; F144-T148 HydrophobicContact CD1-CG2 3.9Å; F144-T148 HydrophobicContact CE1-CG2 3.48Å; F144-T148 VanDerWaalsContact CE1-CG2 3.48Å; F144-T148 HydrophobicContact CE2-CG2 4.21Å; F144-T148 HydrophobicContact CG-CG2 4.42Å; F144-T148 HydrophobicContact CZ-CG2 3.66Å; F144-T148 WeakPolarHBondContact O-CG2 3.25Å; F144-T148 PolarHBondContact O-N 3.03Å; F144-T148 PolarHBondContact O-OG1 2.87Å; G145-T148 WeakPolarHBondContact CA-OG1 3.46Å; G145-T148 PolarHBondContact O-OG1 2.9Å; G145-T148 VanDerWaalsContact O-OG1 3.08Å; V146-T148 PolarHBondContact O-N 3.47Å; T148-I151 PolarHBondContact O-N 2.95Å; T148-T152 WeakPolarHBondContact O-CB 3.3Å; T148-T152 PolarHBondContact O-N 3.04Å; T148-T152 PolarHBondContact O-OG1 3.29Å |
| 149 | S | 97.1 | Very high | 92.2 | Very high | 4 Ų | 4 | 59 Ų | 59 | 3% | 0.028 | 32% | 0.321 | C | S | . | . | H | α-helix | trans | -62.9 | -43.3 | 176.6 | -59.4 | 0 | 0 | 0 | 0 | 112.2 | N71 G145 V146 V147 I151 T152 W153 | N71-S149 PolarHBondContact ND2-OG 3.34Å; G145-S149 WeakPolarHBondContact O-CB 3.27Å; G145-S149 PolarHBondContact O-N 3.22Å; G145-S149 VanDerWaalsContact O-N 3.14Å; G145-S149 PolarHBondContact O-OG 3.1Å; V146-S149 WeakPolarHBondContact O-CB 3.37Å; V146-S149 PolarHBondContact O-N 3.39Å; V147-S149 VanDerWaalsContact C-N 3.3Å; V147-S149 PolarHBondContact O-N 3.41Å; S149-I151 VanDerWaalsContact C-N 3.35Å; S149-I151 PolarHBondContact O-N 3.32Å; S149-T152 WeakPolarHBondContact O-CB 3.42Å; S149-T152 PolarHBondContact O-N 2.87Å; S149-W153 PolarHBondContact O-N 3.4Å |
| 150 | V | 98 | Very high | 93.7 | Very high | 87 Ų | 87 | 55.8 Ų | 55.8 | 53% | 0.527 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -60.3 | -45.8 | 176.3 | 171.8 | 0 | 0 | 0 | 0 | 110.7 | V146 V147 T152 W153 V154 | V146-V150 WeakPolarHBondContact O-CG2 3.44Å; V146-V150 PolarHBondContact O-N 3.07Å; V147-V150 PolarHBondContact O-N 2.9Å; V150-T152 VanDerWaalsContact C-N 3.32Å; V150-T152 PolarHBondContact O-N 2.99Å; V150-W153 PolarHBondContact O-N 2.8Å; V150-V154 WeakPolarHBondContact O-CG2 3.34Å; V150-V154 PolarHBondContact O-N 2.78Å; V150-V154 VanDerWaalsContact O-N 3.07Å |
| 151 | I | 97.9 | Very high | 94.6 | Very high | 97 Ų | 97 | 55.5 Ų | 55.5 | 50% | 0.497 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -59.9 | -44.7 | 176.2 | -65.3 | 166.7 | 0 | 0 | 0 | 110.4 | V147 T148 S149 W153 V154 V155 | V147-I151 HydrophobicContact CG1-CD1 4.02Å; V147-I151 WeakPolarHBondContact O-CG1 3.37Å; V147-I151 PolarHBondContact O-N 3.36Å; V147-I151 VanDerWaalsContact O-N 3.08Å; T148-I151 PolarHBondContact O-N 2.95Å; S149-I151 VanDerWaalsContact C-N 3.35Å; S149-I151 PolarHBondContact O-N 3.32Å; I151-W153 VanDerWaalsContact C-N 3.34Å; I151-W153 PolarHBondContact O-N 2.83Å; I151-V154 PolarHBondContact O-N 3.17Å; I151-V155 HydrophobicContact CG2-CG2 4.33Å; I151-V155 WeakPolarHBondContact O-CG2 3.26Å; I151-V155 PolarHBondContact O-N 2.93Å |
| 152 | T | 98 | Very high | 95 | Very high | 17 Ų | 17 | 53.3 Ų | 53.3 | 10% | 0.104 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -60.9 | -40.6 | 178.2 | -64 | 0 | 0 | 0 | 0 | 112.7 | F117 F118 L121 T148 S149 V150 V155 A156 | F117-T152 HydrophobicContact CB-CG2 3.5Å; F117-T152 HydrophobicContact CD2-CG2 4.16Å; F117-T152 HydrophobicContact CG-CG2 4.32Å; F118-T152 HydrophobicContact CD2-CG2 4.41Å; F118-T152 HydrophobicContact CE1-CG2 4.14Å; F118-T152 HydrophobicContact CE2-CG2 3.99Å; F118-T152 HydrophobicContact CZ-CG2 3.82Å; L121-T152 HydrophobicContact CD1-CG2 4.4Å; L121-T152 VanDerWaalsContact CD1-OG1 3.32Å; L121-T152 WeakPolarHBondContact CD1-OG1 3.15Å; T148-T152 WeakPolarHBondContact O-CB 3.3Å; T148-T152 PolarHBondContact O-N 3.04Å; T148-T152 PolarHBondContact O-OG1 3.29Å; S149-T152 WeakPolarHBondContact O-CB 3.42Å; S149-T152 PolarHBondContact O-N 2.87Å; V150-T152 VanDerWaalsContact C-N 3.32Å; V150-T152 PolarHBondContact O-N 2.99Å; T152-V155 PolarHBondContact O-N 3.42Å; T152-A156 WeakPolarHBondContact O-CB 3.46Å; T152-A156 PolarHBondContact O-N 2.95Å |
| 153 | W | 98.2 | Very high | 95.1 | Very high | 47 Ų | 47 | 50.7 Ų | 50.7 | 18% | 0.178 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -61.7 | -45.7 | 174.2 | -81 | 112.6 | 0 | 0 | 0 | 112 | N71 I74 F78 I110 F118 S149 V150 I151 V155 A156 V157 | N71-W153 PolarHBondContact OD1-NE1 3.5Å; I74-W153 HydrophobicContact CB-CZ2 4.29Å; I74-W153 HydrophobicContact CG2-CH2 4Å; I74-W153 HydrophobicContact CG2-CZ2 3.82Å; F78-W153 AromaticContact CD2-CH2 3.62Å; F78-W153 HydrophobicContact CD2-CH2 3.62Å; F78-W153 AromaticContact CD2-CZ3 3.61Å; F78-W153 HydrophobicContact CD2-CZ3 3.61Å; F78-W153 HydrophobicContact CE2-CE3 4.38Å; F78-W153 AromaticContact CE2-CH2 3.5Å; F78-W153 HydrophobicContact CE2-CH2 3.5Å; F78-W153 VanDerWaalsContact CE2-CH2 3.5Å; F78-W153 HydrophobicContact CE2-CZ2 4.45Å; F78-W153 AromaticContact CE2-CZ3 3.46Å; F78-W153 HydrophobicContact CE2-CZ3 3.46Å; F78-W153 VanDerWaalsContact CE2-CZ3 3.46Å; I110-W153 HydrophobicContact CG2-CE3 4.07Å; I110-W153 HydrophobicContact CG2-CZ3 3.61Å; F118-W153 HydrophobicContact CE2-CD2 4.49Å; F118-W153 AromaticContact CE2-CE2 3.93Å; F118-W153 HydrophobicContact CE2-CZ2 4.14Å; F118-W153 AromaticContact CE2-NE1 3.91Å; F118-W153 AromaticContact CZ-NE1 3.72Å; S149-W153 PolarHBondContact O-N 3.4Å; V150-W153 PolarHBondContact O-N 2.8Å; I151-W153 VanDerWaalsContact C-N 3.34Å; I151-W153 PolarHBondContact O-N 2.83Å; W153-V155 VanDerWaalsContact C-N 3.35Å; W153-V155 PolarHBondContact O-N 3.42Å; W153-A156 PolarHBondContact O-N 3.3Å; W153-V157 WeakPolarHBondContact O-CG2 3.35Å; W153-V157 PolarHBondContact O-N 3.25Å |
| 154 | V | 98.2 | Very high | 95.2 | Very high | 71 Ų | 71 | 47.7 Ų | 47.7 | 43% | 0.43 | 26% | 0.259 | S | S | . | . | H | α-helix | trans | -58.8 | -47.9 | 176.6 | 172.5 | 0 | 0 | 0 | 0 | 110.5 | V150 I151 A156 V157 F158 | V150-V154 WeakPolarHBondContact O-CG2 3.34Å; V150-V154 PolarHBondContact O-N 2.78Å; V150-V154 VanDerWaalsContact O-N 3.07Å; I151-V154 PolarHBondContact O-N 3.17Å; V154-A156 VanDerWaalsContact C-N 3.34Å; V154-A156 PolarHBondContact O-N 3.19Å; V154-V157 PolarHBondContact O-N 2.88Å; V154-F158 HydrophobicContact CG1-CD2 3.65Å; V154-F158 HydrophobicContact CG1-CE2 3.49Å; V154-F158 VanDerWaalsContact CG1-CE2 3.49Å; V154-F158 WeakPolarHBondContact O-CD2 3.36Å; V154-F158 PolarHBondContact O-N 3.35Å |
| 155 | V | 97.8 | Very high | 95.4 | Very high | 70 Ų | 70 | 47.8 Ų | 47.8 | 42% | 0.424 | 26% | 0.263 | S | S | . | . | H | α-helix | trans | -61.3 | -41.2 | 177.3 | 174.5 | 0 | 0 | 0 | 0 | 111.8 | F117 I151 T152 W153 V157 F158 A159 | F117-V155 HydrophobicContact CE2-CG1 3.84Å; F117-V155 HydrophobicContact CZ-CG1 4.34Å; I151-V155 HydrophobicContact CG2-CG2 4.33Å; I151-V155 WeakPolarHBondContact O-CG2 3.26Å; I151-V155 PolarHBondContact O-N 2.93Å; T152-V155 PolarHBondContact O-N 3.42Å; W153-V155 VanDerWaalsContact C-N 3.35Å; W153-V155 PolarHBondContact O-N 3.42Å; V155-V157 PolarHBondContact O-N 2.89Å; V155-F158 PolarHBondContact O-N 3.26Å; V155-A159 WeakPolarHBondContact O-CB 3.24Å; V155-A159 PolarHBondContact O-N 3.45Å |
| 156 | A | 97.6 | Very high | 95.4 | Very high | 0 Ų | 0 | 49 Ų | 49 | 0% | 0 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -64 | -39.6 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | F113 F117 T152 W153 V154 A159 S160 | F113-A156 HydrophobicContact CB-CB 4.23Å; F117-A156 HydrophobicContact CD2-CB 4.32Å; F117-A156 HydrophobicContact CE2-CB 4.42Å; T152-A156 WeakPolarHBondContact O-CB 3.46Å; T152-A156 PolarHBondContact O-N 2.95Å; W153-A156 PolarHBondContact O-N 3.3Å; V154-A156 VanDerWaalsContact C-N 3.34Å; V154-A156 PolarHBondContact O-N 3.19Å; A156-A159 PolarHBondContact O-N 3.4Å; A156-S160 WeakPolarHBondContact O-CB 3.26Å; A156-S160 PolarHBondContact O-N 3.22Å; A156-S160 VanDerWaalsContact O-N 3.13Å; A156-S160 PolarHBondContact O-OG 3.4Å |
| 157 | V | 97.2 | Very high | 95.3 | Very high | 61 Ų | 61 | 45.8 Ų | 45.8 | 37% | 0.37 | 25% | 0.249 | S | C | . | . | H | α-helix | trans | -62.3 | -50.4 | 173.7 | 171.9 | 0 | 0 | 0 | 0 | 110.2 | I110 W153 V154 V155 A159 S160 L161 | I110-V157 HydrophobicContact CD1-CG2 4Å; I110-V157 HydrophobicContact CG1-CG2 4.21Å; W153-V157 WeakPolarHBondContact O-CG2 3.35Å; W153-V157 PolarHBondContact O-N 3.25Å; V154-V157 PolarHBondContact O-N 2.88Å; V155-V157 PolarHBondContact O-N 2.89Å; V157-A159 VanDerWaalsContact C-N 3.34Å; V157-A159 PolarHBondContact O-N 2.64Å; V157-S160 WeakPolarHBondContact O-CA 3.41Å; V157-S160 WeakPolarHBondContact O-CB 3.35Å; V157-S160 PolarHBondContact O-N 3.13Å; V157-L161 WeakPolarHBondContact O-CG 3.48Å; V157-L161 PolarHBondContact O-N 3.34Å; V157-L161 VanDerWaalsContact O-N 3.11Å |
| 158 | F | 96.6 | Very high | 95.1 | Very high | 136 Ų | 136 | 47.4 Ų | 47.4 | 60% | 0.596 | 25% | 0.25 | S | C | * | . | H | α-helix | trans | -59 | -42 | 177.8 | -82.4 | -69.4 | 0 | 0 | 0 | 112.9 | V154 V155 S160 L161 | V154-F158 HydrophobicContact CG1-CD2 3.65Å; V154-F158 HydrophobicContact CG1-CE2 3.49Å; V154-F158 VanDerWaalsContact CG1-CE2 3.49Å; V154-F158 WeakPolarHBondContact O-CD2 3.36Å; V154-F158 PolarHBondContact O-N 3.35Å; V155-F158 PolarHBondContact O-N 3.26Å; F158-S160 PolarHBondContact O-N 3.35Å; F158-L161 HydrophobicContact CD1-CD1 3.64Å; F158-L161 HydrophobicContact CE1-CD1 4.11Å; F158-L161 HydrophobicContact CG-CD1 4.47Å; F158-L161 PolarHBondContact O-N 3.24Å |
| 159 | A | 95.1 | Very high | 94.9 | Very high | 14 Ų | 14 | 47.5 Ų | 47.5 | 12% | 0.116 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -62.9 | -27.7 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.9 | F113 V155 A156 V157 K197 L201 | F113-A159 HydrophobicContact CD1-CB 4.41Å; F113-A159 HydrophobicContact CD2-CB 3.87Å; F113-A159 HydrophobicContact CE2-CB 4.17Å; F113-A159 HydrophobicContact CG-CB 4.03Å; V155-A159 WeakPolarHBondContact O-CB 3.24Å; V155-A159 PolarHBondContact O-N 3.45Å; A156-A159 PolarHBondContact O-N 3.4Å; V157-A159 VanDerWaalsContact C-N 3.34Å; V157-A159 PolarHBondContact O-N 2.64Å; A159-K197 PolarHBondContact O-NZ 3.19Å; A159-L201 HydrophobicContact CB-CD1 4.38Å |
| 160 | S | 95.4 | Very high | 94.5 | Very high | 0 Ų | 0 | 51 Ų | 51 | 0% | 0 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -82.8 | -26.5 | -179.9 | -55.8 | 0 | 0 | 0 | 0 | 113.1 | F109 I110 A156 V157 F158 G163 I164 | F109-S160 VanDerWaalsContact C-OG 3.22Å; F109-S160 WeakPolarHBondContact CB-OG 3.22Å; F109-S160 PolarHBondContact O-OG 3.04Å; I110-S160 PolarHBondContact N-OG 2.94Å; A156-S160 WeakPolarHBondContact O-CB 3.26Å; A156-S160 PolarHBondContact O-N 3.22Å; A156-S160 VanDerWaalsContact O-N 3.13Å; A156-S160 PolarHBondContact O-OG 3.4Å; V157-S160 WeakPolarHBondContact O-CA 3.41Å; V157-S160 WeakPolarHBondContact O-CB 3.35Å; V157-S160 PolarHBondContact O-N 3.13Å; F158-S160 PolarHBondContact O-N 3.35Å; S160-G163 WeakPolarHBondContact O-CA 3.29Å; S160-G163 PolarHBondContact O-N 3.38Å; S160-I164 PolarHBondContact O-N 3.37Å; S160-I164 VanDerWaalsContact O-N 3.15Å |
| 161 | L | 93.9 | Very high | 94 | Very high | 65 Ų | 65 | 53 Ų | 53 | 34% | 0.34 | 27% | 0.269 | S | S | . | . | H | α-helix | trans | -51.6 | -47.5 | -173.7 | -71.8 | 176.6 | 0 | 0 | 0 | 114.7 | V157 F158 G163 I164 I165 | V157-L161 WeakPolarHBondContact O-CG 3.48Å; V157-L161 PolarHBondContact O-N 3.34Å; V157-L161 VanDerWaalsContact O-N 3.11Å; F158-L161 HydrophobicContact CD1-CD1 3.64Å; F158-L161 HydrophobicContact CE1-CD1 4.11Å; F158-L161 HydrophobicContact CG-CD1 4.47Å; F158-L161 PolarHBondContact O-N 3.24Å; L161-G163 VanDerWaalsContact C-N 3.26Å; L161-G163 PolarHBondContact O-N 2.77Å; L161-I164 PolarHBondContact O-N 2.86Å; L161-I164 VanDerWaalsContact O-N 3.08Å; L161-I165 VanDerWaalsContact O-CG1 3.3Å; L161-I165 WeakPolarHBondContact O-CG1 3.49Å; L161-I165 PolarHBondContact O-N 3.21Å |
| 162 | P | 90.9 | Very high | 93.2 | Very high | 24 Ų | 24 | 52.4 Ų | 52.4 | 16% | 0.156 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -59.2 | -40 | 178.6 | -23.5 | 34.3 | 0 | 0 | 0 | 112 | I164 I165 F166 F193 | P162-I164 VanDerWaalsContact C-N 3.3Å; P162-I164 PolarHBondContact O-N 2.85Å; P162-I165 PolarHBondContact O-N 3.39Å; P162-F166 HydrophobicContact CB-CD2 4.44Å; P162-F166 HydrophobicContact CB-CE2 4.31Å; P162-F166 WeakPolarHBondContact O-CD2 3.19Å; P162-F166 PolarHBondContact O-N 3.47Å; P162-F166 VanDerWaalsContact O-N 3.12Å; P162-F193 HydrophobicContact CG-CE1 4.36Å |
| 163 | G | 88.8 | Confident | 92.4 | Very high | 1 Ų | 1 | 54.8 Ų | 54.8 | 1% | 0.01 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -62.1 | -38 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | S160 L161 T167 | S160-G163 WeakPolarHBondContact O-CA 3.29Å; S160-G163 PolarHBondContact O-N 3.38Å; L161-G163 VanDerWaalsContact C-N 3.26Å; L161-G163 PolarHBondContact O-N 2.77Å; G163-T167 VanDerWaalsContact O-CB 3.23Å; G163-T167 WeakPolarHBondContact O-CB 3.47Å; G163-T167 PolarHBondContact O-N 2.88Å; G163-T167 PolarHBondContact O-OG1 3.39Å |
| 164 | I | 92.3 | Very high | 91.6 | Very high | 39 Ų | 39 | 59.9 Ų | 59.9 | 20% | 0.2 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -70.3 | -45.1 | 178.9 | -60 | 167.1 | 0 | 0 | 0 | 110.8 | Q102 S160 L161 P162 F166 T167 | Q102-I164 HydrophobicContact CB-CG2 4.27Å; S160-I164 PolarHBondContact O-N 3.37Å; S160-I164 VanDerWaalsContact O-N 3.15Å; L161-I164 PolarHBondContact O-N 2.86Å; L161-I164 VanDerWaalsContact O-N 3.08Å; P162-I164 VanDerWaalsContact C-N 3.3Å; P162-I164 PolarHBondContact O-N 2.85Å; I164-F166 PolarHBondContact O-N 3.05Å; I164-T167 PolarHBondContact O-N 3.18Å |
| 165 | I | 92.6 | Very high | 91 | Very high | 105 Ų | 105 | 60.4 Ų | 60.4 | 54% | 0.538 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -64.9 | -42.3 | -175.9 | -67.1 | 163.9 | 0 | 0 | 0 | 111.3 | L161 P162 | L161-I165 VanDerWaalsContact O-CG1 3.3Å; L161-I165 WeakPolarHBondContact O-CG1 3.49Å; L161-I165 PolarHBondContact O-N 3.21Å; P162-I165 PolarHBondContact O-N 3.39Å |
| 166 | F | 92 | Very high | 90.6 | Very high | 26 Ų | 26 | 62.4 Ų | 62.4 | 11% | 0.114 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -82.6 | -14.9 | -178.6 | -63.9 | -59.4 | 0 | 0 | 0 | 113.5 | P162 I164 S180 H181 F182 P183 W190 | P162-F166 HydrophobicContact CB-CD2 4.44Å; P162-F166 HydrophobicContact CB-CE2 4.31Å; P162-F166 WeakPolarHBondContact O-CD2 3.19Å; P162-F166 PolarHBondContact O-N 3.47Å; P162-F166 VanDerWaalsContact O-N 3.12Å; I164-F166 PolarHBondContact O-N 3.05Å; F166-S180 WeakPolarHBondContact O-CA 3.26Å; F166-H181 PolarHBondContact O-N 3.04Å; F166-F182 HydrophobicContact CB-CD1 3.89Å; F166-F182 HydrophobicContact CB-CE1 3.83Å; F166-F182 AromaticContact CD1-CD1 3.98Å; F166-F182 HydrophobicContact CD1-CD1 3.98Å; F166-F182 AromaticContact CD2-CD1 3.84Å; F166-F182 HydrophobicContact CD2-CD1 3.84Å; F166-F182 AromaticContact CD2-CE1 3.77Å; F166-F182 HydrophobicContact CD2-CE1 3.77Å; F166-F182 HydrophobicContact CE2-CD1 4.44Å; F166-F182 AromaticContact CG-CD1 3.62Å; F166-F182 HydrophobicContact CG-CD1 3.62Å; F166-F182 AromaticContact CG-CE1 3.82Å; F166-F182 HydrophobicContact CG-CE1 3.82Å; F166-P183 HydrophobicContact CE1-CG 4.44Å; F166-W190 HydrophobicContact CD2-CE3 4.35Å; F166-W190 HydrophobicContact CE1-CD2 4.35Å; F166-W190 AromaticContact CE2-CD2 3.69Å; F166-W190 HydrophobicContact CE2-CD2 3.69Å; F166-W190 AromaticContact CE2-CE3 3.27Å; F166-W190 HydrophobicContact CE2-CE3 3.27Å; F166-W190 HydrophobicContact CE2-CG 4.38Å; F166-W190 HydrophobicContact CE2-CH2 4.08Å; F166-W190 HydrophobicContact CE2-CZ2 4.45Å; F166-W190 AromaticContact CE2-CZ3 3.49Å; F166-W190 HydrophobicContact CE2-CZ3 3.49Å; F166-W190 VanDerWaalsContact CE2-CZ3 3.49Å; F166-W190 AromaticContact CZ-CD2 3.43Å; F166-W190 HydrophobicContact CZ-CD2 3.43Å; F166-W190 VanDerWaalsContact CZ-CD2 3.43Å; F166-W190 AromaticContact CZ-CE2 3.6Å; F166-W190 AromaticContact CZ-CE3 3.49Å; F166-W190 HydrophobicContact CZ-CE3 3.49Å; F166-W190 VanDerWaalsContact CZ-CE3 3.49Å; F166-W190 HydrophobicContact CZ-CG 4.04Å; F166-W190 AromaticContact CZ-CH2 3.85Å; F166-W190 HydrophobicContact CZ-CH2 3.85Å; F166-W190 AromaticContact CZ-CZ2 3.81Å; F166-W190 HydrophobicContact CZ-CZ2 3.81Å; F166-W190 AromaticContact CZ-CZ3 3.71Å; F166-W190 HydrophobicContact CZ-CZ3 3.71Å |
| 167 | T | 92.2 | Very high | 90.2 | Very high | 3 Ų | 3 | 63 Ų | 63 | 2% | 0.018 | 32% | 0.324 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -85.2 | 126.8 | 179.1 | -60 | 0 | 0 | 0 | 0 | 111 | C101 Q102 T105 G163 I164 S179 S180 | C101-T167 VanDerWaalsContact SG-CG2 3.53Å; Q102-T167 WeakPolarHBondContact CG-O 3.47Å; Q102-T167 PolarHBondContact NE2-O 3.43Å; T105-T167 HydrophobicContact CG2-CG2 4.07Å; T105-T167 WeakPolarHBondContact OG1-CG2 3.35Å; G163-T167 VanDerWaalsContact O-CB 3.23Å; G163-T167 WeakPolarHBondContact O-CB 3.47Å; G163-T167 PolarHBondContact O-N 2.88Å; G163-T167 PolarHBondContact O-OG1 3.39Å; I164-T167 PolarHBondContact O-N 3.18Å; T167-S179 WeakPolarHBondContact CA-O 3.24Å; T167-S180 PolarHBondContact OG1-OG 3.14Å |
| 168 | K | 92 | Very high | 90 | Very high | 108 Ų | 108 | 60.7 Ų | 60.7 | 47% | 0.47 | 31% | 0.311 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -138.8 | 155.4 | 179.3 | -64.1 | -175.4 | -179.7 | 178.7 | 0 | 110 | N98 S179 | N98-K168 WeakPolarHBondContact OD1-CA 3.33Å; K168-S179 PolarHBondContact N-O 3.06Å; K168-S179 PolarHBondContact O-N 2.89Å; K168-S179 VanDerWaalsContact O-N 3.14Å |
| 169 | S | 92.1 | Very high | 89.6 | Confident | 23 Ų | 23 | 55.8 Ų | 55.8 | 16% | 0.161 | 29% | 0.293 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -93.3 | 125.5 | 166.4 | -175.1 | 0 | 0 | 0 | 0 | 110 | W94 N98 T177 | W94-S169 VanDerWaalsContact CD1-OG 3.22Å; N98-S169 PolarHBondContact OD1-N 3.08Å; S169-T177 WeakPolarHBondContact CA-O 3.29Å; S169-T177 PolarHBondContact OG-O 3.33Å; S169-T177 VanDerWaalsContact OG-O 3.05Å |
| 170 | Q | 88.8 | Confident | 89.3 | Confident | 78 Ų | 78 | 57.8 Ų | 57.8 | 36% | 0.364 | 31% | 0.306 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -140.6 | 160.6 | 176.5 | 61.5 | 170.5 | 31 | 0 | 0 | 111.2 | E172 T177 H181 | Q170-E172 HydrophobicContact CG-CG 4.14Å; Q170-E172 PolarHBondContact NE2-OE1 2.96Å; Q170-T177 PolarHBondContact N-O 3.2Å; Q170-T177 PolarHBondContact O-N 3.26Å; Q170-T177 PolarHBondContact O-OG1 3.36Å; Q170-H181 WeakPolarHBondContact CG-NE2 3.23Å; Q170-H181 PolarHBondContact NE2-CE1 2.92Å; Q170-H181 PolarHBondContact NE2-NE2 3.39Å |
| 171 | K | 87.1 | Confident | 88.9 | Confident | 128 Ų | 128 | 60.2 Ų | 60.2 | 56% | 0.557 | 32% | 0.317 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -86.3 | 112.2 | 175.8 | -170.7 | 178.7 | 179.2 | -177 | 0 | 109.1 | G173 Y176 | K171-G173 WeakPolarHBondContact CE-O 3.47Å; K171-Y176 HydrophobicContact CB-CD1 4.12Å; K171-Y176 HydrophobicContact CB-CE1 3.91Å; K171-Y176 HydrophobicContact CG-CE1 4.47Å |
| 172 | E | 81.4 | Confident | 88.7 | Confident | 84 Ų | 84 | 58.6 Ų | 58.6 | 39% | 0.393 | 31% | 0.308 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -107.8 | 102.6 | 175.9 | -74.2 | 175.3 | 170.9 | 0 | 0 | 108.9 | Q170 L174 H175 T177 H181 | Q170-E172 HydrophobicContact CG-CG 4.14Å; Q170-E172 PolarHBondContact NE2-OE1 2.96Å; E172-L174 PolarHBondContact O-N 2.92Å; E172-H175 PolarHBondContact N-O 3.46Å; E172-H175 PolarHBondContact O-N 3Å; E172-T177 HydrophobicContact CB-CG2 4.25Å; E172-T177 WeakPolarHBondContact OE2-CG2 3.37Å; E172-T177 PolarHBondContact OE2-OG1 2.93Å; E172-H181 IonicContact OE1-CE1 3.16Å; E172-H181 PolarHBondContact OE1-CE1 3.48Å; E172-H181 VanDerWaalsContact OE1-CE1 3.32Å; E172-H181 IonicContact OE1-NE2 2.9Å |
| 173 | G | 80.7 | Confident | 88.6 | Confident | 68 Ų | 68 | 59.8 Ų | 59.8 | 70% | 0.701 | 32% | 0.315 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 66.3 | -117.9 | -172.5 | 0 | 0 | 0 | 0 | 0 | 111.9 | K171 | K171-G173 WeakPolarHBondContact CE-O 3.47Š|
| 174 | L | 81.8 | Confident | 88.5 | Confident | 153 Ų | 153 | 70.3 Ų | 70.3 | 80% | 0.801 | 36% | 0.356 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -90.9 | -10.3 | -178.8 | -70.5 | 168.1 | 0 | 0 | 0 | 113.9 | E172 | E172-L174 PolarHBondContact O-N 2.92Š|
| 175 | H | 84.5 | Confident | 88.4 | Confident | 82 Ų | 82 | 73.8 Ų | 73.8 | 38% | 0.38 | 38% | 0.384 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -121.3 | 150.5 | -170.9 | -64.4 | -66.6 | 0 | 0 | 0 | 112.5 | Q93 E172 | Q93-H175 HydrophobicContact CB-CB 4.34Å; Q93-H175 PolarHBondContact OE1-ND1 2.87Å; Q93-H175 VanDerWaalsContact OE1-ND1 3.16Å; E172-H175 PolarHBondContact N-O 3.46Å; E172-H175 PolarHBondContact O-N 3Å |
| 176 | Y | 89.2 | Confident | 88.3 | Confident | 112 Ų | 112 | 73.5 Ų | 73.5 | 44% | 0.439 | 38% | 0.38 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -83.4 | 131.1 | 167.3 | -72.7 | -85.5 | 0 | 0 | 0 | 110.1 | W94 K171 | W94-Y176 WeakPolarHBondContact CB-O 3.3Å; W94-Y176 PolarHBondContact N-O 3.18Å; W94-Y176 WeakPolarHBondContact O-CB 3.49Å; K171-Y176 HydrophobicContact CB-CD1 4.12Å; K171-Y176 HydrophobicContact CB-CE1 3.91Å; K171-Y176 HydrophobicContact CG-CE1 4.47Å |
| 177 | T | 89.9 | Confident | 88.1 | Confident | 14 Ų | 14 | 77.6 Ų | 77.6 | 9% | 0.086 | 40% | 0.396 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -117.7 | 159.6 | 176.4 | 58.5 | 0 | 0 | 0 | 0 | 110.3 | S169 Q170 E172 | S169-T177 WeakPolarHBondContact CA-O 3.29Å; S169-T177 PolarHBondContact OG-O 3.33Å; S169-T177 VanDerWaalsContact OG-O 3.05Å; Q170-T177 PolarHBondContact N-O 3.2Å; Q170-T177 PolarHBondContact O-N 3.26Å; Q170-T177 PolarHBondContact O-OG1 3.36Å; E172-T177 HydrophobicContact CB-CG2 4.25Å; E172-T177 WeakPolarHBondContact OE2-CG2 3.37Å; E172-T177 PolarHBondContact OE2-OG1 2.93Å |
| 178 | C | 92.3 | Very high | 87.9 | Confident | 12 Ų | 12 | 81.5 Ų | 81.5 | 8% | 0.081 | 41% | 0.414 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -122.9 | 100 | 170.1 | 173.4 | 0 | 0 | 0 | 0 | 106.6 | W94 C101 | W94-C178 HydrophobicContact CB-CB 4.4Å; W94-C178 HydrophobicContact CD2-CB 3.49Å; W94-C178 VanDerWaalsContact CD2-CB 3.49Å; W94-C178 HydrophobicContact CE3-CB 3.66Å; W94-C178 HydrophobicContact CG-CB 3.8Å; W94-C178 HydrophobicContact CH2-CB 4.49Å; W94-C178 HydrophobicContact CZ2-CB 4.41Å; W94-C178 HydrophobicContact CZ3-CB 4.15Å; C101-C178 VanDerWaalsContact CA-SG 3.59Å; C101-C178 HydrophobicContact CB-CB 3.94Å; C101-C178 WeakPolarHBondContact CB-SG 3.44Å; C101-C178 WeakPolarHBondContact SG-CB 3.39Å; C101-C178 CovalentContact SG-SG 2.03Å; C101-C178 PolarHBondContact SG-SG 2.86Å |
| 179 | S | 88.6 | Confident | 87.9 | Confident | 32 Ų | 32 | 82.4 Ų | 82.4 | 22% | 0.224 | 42% | 0.418 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -142.6 | 162.1 | -169.8 | 49.6 | 0 | 0 | 0 | 0 | 111.5 | T167 K168 H181 | T167-S179 WeakPolarHBondContact CA-O 3.24Å; K168-S179 PolarHBondContact N-O 3.06Å; K168-S179 PolarHBondContact O-N 2.89Å; K168-S179 VanDerWaalsContact O-N 3.14Å; S179-H181 PolarHBondContact O-CD2 2.95Å; S179-H181 VanDerWaalsContact O-CD2 3.3Å; S179-H181 PolarHBondContact OG-CE1 2.87Å; S179-H181 PolarHBondContact OG-NE2 3.5Å |
| 180 | S | 88.3 | Confident | 87.9 | Confident | 56 Ų | 56 | 84.2 Ų | 84.2 | 39% | 0.392 | 42% | 0.421 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -83 | 123.9 | 179.4 | -63.3 | 0 | 0 | 0 | 0 | 111 | F166 T167 | F166-S180 WeakPolarHBondContact O-CA 3.26Å; T167-S180 PolarHBondContact OG1-OG 3.14Å |
| 181 | H | 88.3 | Confident | 87.9 | Confident | 52 Ų | 52 | 82.5 Ų | 82.5 | 24% | 0.241 | 41% | 0.413 | C | S | . | . | trans | -115.7 | 107.3 | 177.4 | -64.2 | -68.8 | 0 | 0 | 0 | 110.5 | F166 Q170 E172 S179 | F166-H181 PolarHBondContact O-N 3.04Å; Q170-H181 WeakPolarHBondContact CG-NE2 3.23Å; Q170-H181 PolarHBondContact NE2-CE1 2.92Å; Q170-H181 PolarHBondContact NE2-NE2 3.39Å; E172-H181 IonicContact OE1-CE1 3.16Å; E172-H181 PolarHBondContact OE1-CE1 3.48Å; E172-H181 VanDerWaalsContact OE1-CE1 3.32Å; E172-H181 IonicContact OE1-NE2 2.9Å; S179-H181 PolarHBondContact O-CD2 2.95Å; S179-H181 VanDerWaalsContact O-CD2 3.3Å; S179-H181 PolarHBondContact OG-CE1 2.87Å; S179-H181 PolarHBondContact OG-NE2 3.5Å | ||
| 182 | F | 88.9 | Confident | 88.1 | Confident | 31 Ų | 31 | 78.2 Ų | 78.2 | 14% | 0.136 | 40% | 0.396 | C | S | . | . | trans | -87.5 | 148.5 | 174.7 | -55.1 | -58.9 | 0 | 0 | 0 | 111 | F166 Y184 Y187 W190 K191 Q194 | F166-F182 HydrophobicContact CB-CD1 3.89Å; F166-F182 HydrophobicContact CB-CE1 3.83Å; F166-F182 AromaticContact CD1-CD1 3.98Å; F166-F182 HydrophobicContact CD1-CD1 3.98Å; F166-F182 AromaticContact CD2-CD1 3.84Å; F166-F182 HydrophobicContact CD2-CD1 3.84Å; F166-F182 AromaticContact CD2-CE1 3.77Å; F166-F182 HydrophobicContact CD2-CE1 3.77Å; F166-F182 HydrophobicContact CE2-CD1 4.44Å; F166-F182 AromaticContact CG-CD1 3.62Å; F166-F182 HydrophobicContact CG-CD1 3.62Å; F166-F182 AromaticContact CG-CE1 3.82Å; F166-F182 HydrophobicContact CG-CE1 3.82Å; F182-Y184 PolarHBondContact O-N 3.13Å; F182-Y187 HydrophobicContact CB-CD2 3.88Å; F182-Y187 HydrophobicContact CB-CE2 4.39Å; F182-Y187 HydrophobicContact CD2-CD2 4.34Å; F182-Y187 HydrophobicContact CD2-CE2 4.09Å; F182-W190 HydrophobicContact CB-CB 4.01Å; F182-W190 HydrophobicContact CD1-CB 3.57Å; F182-W190 HydrophobicContact CD1-CG 4.44Å; F182-W190 HydrophobicContact CE1-CB 4.22Å; F182-W190 HydrophobicContact CG-CB 3.83Å; F182-K191 HydrophobicContact CD2-CB 4.29Å; F182-K191 HydrophobicContact CE2-CB 4.25Å; F182-Q194 HydrophobicContact CZ-CB 4.31Å | ||
| 183 | P | 88.6 | Confident | 88.6 | Confident | 49 Ų | 49 | 78.6 Ų | 78.6 | 32% | 0.318 | 40% | 0.396 | S | S | . | . | trans | -63 | 130.8 | 177.3 | 25.2 | -33.4 | 0 | 0 | 0 | 111 | F166 S185 Q186 Y187 | F166-P183 HydrophobicContact CE1-CG 4.44Å; P183-S185 VanDerWaalsContact C-N 3.27Å; P183-S185 PolarHBondContact O-N 3.35Å; P183-Q186 HydrophobicContact CG-CB 4.44Å; P183-Q186 CarbonylContact O-C 3.47Å; P183-Q186 PolarHBondContact O-N 2.97Å; P183-Y187 WeakPolarHBondContact O-CA 3.4Å; P183-Y187 PolarHBondContact O-N 2.71Å | ||
| 184 | Y | 87.1 | Confident | 89.1 | Confident | 222 Ų | 222 | 76 Ų | 76 | 87% | 0.871 | 37% | 0.366 | S | S | * | . | G | 310 helix | trans | -54.5 | -38.9 | -175.4 | -68.2 | -75.8 | 0 | 0 | 0 | 113.7 | F182 Q186 Y187 | F182-Y184 PolarHBondContact O-N 3.13Å; Y184-Q186 PolarHBondContact O-N 3.29Å; Y184-Y187 PolarHBondContact O-N 2.86Å |
| 185 | S | 90.2 | Very high | 89.5 | Confident | 111 Ų | 111 | 68.8 Ų | 68.8 | 78% | 0.776 | 33% | 0.329 | S | S | * | . | G | 310 helix | trans | -63.5 | -23.4 | 179.8 | 56 | 0 | 0 | 0 | 0 | 114 | P183 | P183-S185 VanDerWaalsContact C-N 3.27Å; P183-S185 PolarHBondContact O-N 3.35Å |
| 186 | Q | 90.9 | Very high | 89.9 | Confident | 100 Ų | 100 | 68.5 Ų | 68.5 | 47% | 0.467 | 33% | 0.329 | S | S | . | . | G | 310 helix | trans | -133.1 | 26.6 | -176.6 | -65.4 | -178.5 | -18.8 | 0 | 0 | 111.5 | P183 Y184 Q188 F189 W190 | P183-Q186 HydrophobicContact CG-CB 4.44Å; P183-Q186 CarbonylContact O-C 3.47Å; P183-Q186 PolarHBondContact O-N 2.97Å; Y184-Q186 PolarHBondContact O-N 3.29Å; Q186-Q188 PolarHBondContact O-N 2.97Å; Q186-F189 HydrophobicContact CB-CB 4.44Å; Q186-F189 PolarHBondContact O-N 2.93Å; Q186-F189 VanDerWaalsContact O-N 3.16Å; Q186-W190 PolarHBondContact O-N 3.16Å; Q186-W190 VanDerWaalsContact OE1-NE1 3.12Å |
| 187 | Y | 88.1 | Confident | 90.2 | Very high | 111 Ų | 111 | 64.3 Ų | 64.3 | 44% | 0.435 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -55.7 | -51.4 | -171.1 | 177.6 | -96.3 | 0 | 0 | 0 | 112.1 | F182 P183 Y184 F189 W190 K191 | F182-Y187 HydrophobicContact CB-CD2 3.88Å; F182-Y187 HydrophobicContact CB-CE2 4.39Å; F182-Y187 HydrophobicContact CD2-CD2 4.34Å; F182-Y187 HydrophobicContact CD2-CE2 4.09Å; P183-Y187 WeakPolarHBondContact O-CA 3.4Å; P183-Y187 PolarHBondContact O-N 2.71Å; Y184-Y187 PolarHBondContact O-N 2.86Å; Y187-F189 VanDerWaalsContact C-N 3.32Å; Y187-F189 PolarHBondContact O-N 2.77Å; Y187-W190 PolarHBondContact O-N 3.22Å; Y187-K191 HydrophobicContact CE1-CD 4.16Å; Y187-K191 WeakPolarHBondContact O-CB 3.34Å; Y187-K191 PolarHBondContact O-N 3.02Å |
| 188 | Q | 88.1 | Confident | 90.3 | Very high | 86 Ų | 86 | 63.9 Ų | 63.9 | 40% | 0.402 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -64.3 | -37.4 | -179.1 | -167.3 | 63.3 | 41.1 | 0 | 0 | 112.3 | Q186 N192 | Q186-Q188 PolarHBondContact O-N 2.97Å; Q188-N192 PolarHBondContact NE2-OD1 3.42Å; Q188-N192 VanDerWaalsContact O-CB 3.24Å; Q188-N192 WeakPolarHBondContact O-CB 3.08Å; Q188-N192 PolarHBondContact O-N 3.45Å; Q188-N192 PolarHBondContact O-ND2 2.66Å; Q188-N192 PolarHBondContact O-OD1 3.47Å |
| 189 | F | 91.3 | Very high | 90.2 | Very high | 127 Ų | 127 | 63.9 Ų | 63.9 | 56% | 0.557 | 31% | 0.31 | S | S | * | . | H | α-helix | trans | -62.6 | -51.1 | 178.6 | 175.2 | -93.9 | 0 | 0 | 0 | 111 | Q186 Y187 N192 F193 | Q186-F189 HydrophobicContact CB-CB 4.44Å; Q186-F189 PolarHBondContact O-N 2.93Å; Q186-F189 VanDerWaalsContact O-N 3.16Å; Y187-F189 VanDerWaalsContact C-N 3.32Å; Y187-F189 PolarHBondContact O-N 2.77Å; F189-N192 PolarHBondContact O-N 3.1Å; F189-F193 VanDerWaalsContact O-CB 3.24Å; F189-F193 WeakPolarHBondContact O-CB 3.27Å; F189-F193 PolarHBondContact O-N 2.98Å |
| 190 | W | 91.4 | Very high | 90.5 | Very high | 60 Ų | 60 | 66.6 Ų | 66.6 | 23% | 0.227 | 32% | 0.321 | C | S | . | . | H | α-helix | trans | -69.3 | -38.2 | -179 | -74.9 | 106.7 | 0 | 0 | 0 | 112.7 | F166 F182 Q186 Y187 F193 Q194 | F166-W190 HydrophobicContact CD2-CE3 4.35Å; F166-W190 HydrophobicContact CE1-CD2 4.35Å; F166-W190 AromaticContact CE2-CD2 3.69Å; F166-W190 HydrophobicContact CE2-CD2 3.69Å; F166-W190 AromaticContact CE2-CE3 3.27Å; F166-W190 HydrophobicContact CE2-CE3 3.27Å; F166-W190 HydrophobicContact CE2-CG 4.38Å; F166-W190 HydrophobicContact CE2-CH2 4.08Å; F166-W190 HydrophobicContact CE2-CZ2 4.45Å; F166-W190 AromaticContact CE2-CZ3 3.49Å; F166-W190 HydrophobicContact CE2-CZ3 3.49Å; F166-W190 VanDerWaalsContact CE2-CZ3 3.49Å; F166-W190 AromaticContact CZ-CD2 3.43Å; F166-W190 HydrophobicContact CZ-CD2 3.43Å; F166-W190 VanDerWaalsContact CZ-CD2 3.43Å; F166-W190 AromaticContact CZ-CE2 3.6Å; F166-W190 AromaticContact CZ-CE3 3.49Å; F166-W190 HydrophobicContact CZ-CE3 3.49Å; F166-W190 VanDerWaalsContact CZ-CE3 3.49Å; F166-W190 HydrophobicContact CZ-CG 4.04Å; F166-W190 AromaticContact CZ-CH2 3.85Å; F166-W190 HydrophobicContact CZ-CH2 3.85Å; F166-W190 AromaticContact CZ-CZ2 3.81Å; F166-W190 HydrophobicContact CZ-CZ2 3.81Å; F166-W190 AromaticContact CZ-CZ3 3.71Å; F166-W190 HydrophobicContact CZ-CZ3 3.71Å; F182-W190 HydrophobicContact CB-CB 4.01Å; F182-W190 HydrophobicContact CD1-CB 3.57Å; F182-W190 HydrophobicContact CD1-CG 4.44Å; F182-W190 HydrophobicContact CE1-CB 4.22Å; F182-W190 HydrophobicContact CG-CB 3.83Å; Q186-W190 PolarHBondContact O-N 3.16Å; Q186-W190 VanDerWaalsContact OE1-NE1 3.12Å; Y187-W190 PolarHBondContact O-N 3.22Å; W190-F193 HydrophobicContact CE3-CD1 4.07Å; W190-F193 HydrophobicContact CZ3-CD1 4.06Å; W190-F193 HydrophobicContact CZ3-CE1 4.29Å; W190-F193 PolarHBondContact O-N 2.99Å; W190-Q194 WeakPolarHBondContact O-CB 3.39Å; W190-Q194 PolarHBondContact O-N 2.76Å |
| 191 | K | 89 | Confident | 90.8 | Very high | 42 Ų | 42 | 65.8 Ų | 65.8 | 18% | 0.183 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -57.7 | -53 | 172.4 | -169.8 | -175.2 | 178.6 | -170.5 | 0 | 110.3 | F182 Y187 F193 Q194 T195 D258 T259 | F182-K191 HydrophobicContact CD2-CB 4.29Å; F182-K191 HydrophobicContact CE2-CB 4.25Å; Y187-K191 HydrophobicContact CE1-CD 4.16Å; Y187-K191 WeakPolarHBondContact O-CB 3.34Å; Y187-K191 PolarHBondContact O-N 3.02Å; K191-F193 PolarHBondContact O-N 3.09Å; K191-Q194 PolarHBondContact O-N 3.3Å; K191-T195 PolarHBondContact O-N 3.26Å; K191-T195 VanDerWaalsContact O-N 3.09Å; K191-T195 PolarHBondContact O-OG1 3.06Å; K191-T195 VanDerWaalsContact O-OG1 3.08Å; K191-D258 PolarHBondContact NZ-O 2.83Å; K191-T259 HydrophobicContact CD-CG2 4.47Å; K191-T259 HydrophobicContact CG-CG2 4.21Å |
| 192 | N | 91 | Very high | 90.9 | Very high | 39 Ų | 39 | 63.4 Ų | 63.4 | 21% | 0.209 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -61.6 | -45.2 | 178.7 | -71.3 | -5.6 | 0 | 0 | 0 | 112.3 | Q188 F189 Q194 T195 L196 T259 | Q188-N192 PolarHBondContact NE2-OD1 3.42Å; Q188-N192 VanDerWaalsContact O-CB 3.24Å; Q188-N192 WeakPolarHBondContact O-CB 3.08Å; Q188-N192 PolarHBondContact O-N 3.45Å; Q188-N192 PolarHBondContact O-ND2 2.66Å; Q188-N192 PolarHBondContact O-OD1 3.47Å; F189-N192 PolarHBondContact O-N 3.1Å; N192-Q194 PolarHBondContact O-N 3.46Å; N192-T195 PolarHBondContact O-N 3.06Å; N192-L196 VanDerWaalsContact O-CB 3.29Å; N192-L196 WeakPolarHBondContact O-CB 3.45Å; N192-L196 VanDerWaalsContact O-CG 3.25Å; N192-L196 WeakPolarHBondContact O-CG 3.37Å; N192-L196 PolarHBondContact O-N 3.38Å; N192-T259 WeakPolarHBondContact OD1-CG2 3.41Å |
| 193 | F | 93 | Very high | 90.9 | Very high | 91 Ų | 91 | 63.7 Ų | 63.7 | 40% | 0.399 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -59.1 | -46.7 | 179.4 | 176 | -98.9 | 0 | 0 | 0 | 111.3 | P162 F189 W190 K191 K197 | P162-F193 HydrophobicContact CG-CE1 4.36Å; F189-F193 VanDerWaalsContact O-CB 3.24Å; F189-F193 WeakPolarHBondContact O-CB 3.27Å; F189-F193 PolarHBondContact O-N 2.98Å; W190-F193 HydrophobicContact CE3-CD1 4.07Å; W190-F193 HydrophobicContact CZ3-CD1 4.06Å; W190-F193 HydrophobicContact CZ3-CE1 4.29Å; W190-F193 PolarHBondContact O-N 2.99Å; K191-F193 PolarHBondContact O-N 3.09Å; F193-K197 WeakPolarHBondContact O-CB 3.22Å; F193-K197 PolarHBondContact O-N 3.4Å |
| 194 | Q | 90.8 | Very high | 91.2 | Very high | 13 Ų | 13 | 65 Ų | 65 | 6% | 0.061 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -64 | -45.8 | -179.7 | -173.2 | 71.3 | -7.7 | 0 | 0 | 111.5 | F182 W190 K191 N192 I198 | F182-Q194 HydrophobicContact CZ-CB 4.31Å; W190-Q194 WeakPolarHBondContact O-CB 3.39Å; W190-Q194 PolarHBondContact O-N 2.76Å; K191-Q194 PolarHBondContact O-N 3.3Å; N192-Q194 PolarHBondContact O-N 3.46Å; Q194-I198 HydrophobicContact CG-CD1 4.25Å; Q194-I198 WeakPolarHBondContact O-CG1 3.39Å; Q194-I198 PolarHBondContact O-N 2.96Å; Q194-I198 VanDerWaalsContact O-N 3.08Å |
| 195 | T | 90.8 | Very high | 91.5 | Very high | 3 Ų | 3 | 57.4 Ų | 57.4 | 2% | 0.018 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -63 | -51.2 | 177.9 | -57.8 | 0 | 0 | 0 | 0 | 111.5 | K191 N192 K197 I198 V199 L256 T259 | K191-T195 PolarHBondContact O-N 3.26Å; K191-T195 VanDerWaalsContact O-N 3.09Å; K191-T195 PolarHBondContact O-OG1 3.06Å; K191-T195 VanDerWaalsContact O-OG1 3.08Å; N192-T195 PolarHBondContact O-N 3.06Å; T195-K197 VanDerWaalsContact C-N 3.32Å; T195-K197 PolarHBondContact O-N 3.21Å; T195-I198 PolarHBondContact O-N 3.47Å; T195-V199 HydrophobicContact CG2-CG2 4.38Å; T195-V199 WeakPolarHBondContact O-CG2 3.23Å; T195-V199 PolarHBondContact O-N 3.39Å; T195-L256 HydrophobicContact CG2-CD1 4.28Å; T195-T259 WeakPolarHBondContact CB-OG1 3.28Å; T195-T259 HydrophobicContact CG2-CG2 4.07Å; T195-T259 WeakPolarHBondContact CG2-OG1 3.03Å; T195-T259 PolarHBondContact OG1-OG1 3.38Å |
| 196 | L | 92.9 | Very high | 91.5 | Very high | 75 Ų | 75 | 52.1 Ų | 52.1 | 39% | 0.393 | 25% | 0.248 | S | C | . | . | H | α-helix | trans | -61.5 | -41.8 | -179.7 | -71.3 | 175.2 | 0 | 0 | 0 | 111.2 | N192 I198 V199 I200 F260 | N192-L196 VanDerWaalsContact O-CB 3.29Å; N192-L196 WeakPolarHBondContact O-CB 3.45Å; N192-L196 VanDerWaalsContact O-CG 3.25Å; N192-L196 WeakPolarHBondContact O-CG 3.37Å; N192-L196 PolarHBondContact O-N 3.38Å; L196-I198 PolarHBondContact O-N 2.93Å; L196-V199 PolarHBondContact O-N 2.94Å; L196-I200 HydrophobicContact CB-CD1 4.32Å; L196-I200 VanDerWaalsContact O-CB 3.23Å; L196-I200 WeakPolarHBondContact O-CB 3.44Å; L196-I200 WeakPolarHBondContact O-CD1 3.08Å; L196-I200 WeakPolarHBondContact O-CG1 3.25Å; L196-I200 PolarHBondContact O-N 3.16Å; L196-F260 HydrophobicContact CD2-CE2 4.37Å; L196-F260 HydrophobicContact CD2-CZ 4.41Å |
| 197 | K | 94.2 | Very high | 91.5 | Very high | 24 Ų | 24 | 51.2 Ų | 51.2 | 10% | 0.104 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -56 | -49.4 | 174.2 | -179.7 | -158.7 | 73.5 | 178.4 | 0 | 111.3 | A159 F193 T195 L201 | A159-K197 PolarHBondContact O-NZ 3.19Å; F193-K197 WeakPolarHBondContact O-CB 3.22Å; F193-K197 PolarHBondContact O-N 3.4Å; T195-K197 VanDerWaalsContact C-N 3.32Å; T195-K197 PolarHBondContact O-N 3.21Å; K197-L201 HydrophobicContact CG-CD1 3.85Å; K197-L201 WeakPolarHBondContact O-CB 3.36Å; K197-L201 VanDerWaalsContact O-CG 3.27Å; K197-L201 WeakPolarHBondContact O-CG 3.24Å; K197-L201 PolarHBondContact O-N 3.01Å |
| 198 | I | 91.8 | Very high | 91.8 | Very high | 5 Ų | 5 | 50.7 Ų | 50.7 | 3% | 0.026 | 25% | 0.25 | C | S | . | . | H | α-helix | trans | -61.2 | -51.4 | 179.3 | -70.5 | 168.5 | 0 | 0 | 0 | 110.2 | F109 F112 F113 Q194 T195 L196 I200 L201 R202 | F109-I198 HydrophobicContact CE1-CD1 4.41Å; F112-I198 HydrophobicContact CE1-CG2 4.3Å; F113-I198 HydrophobicContact CZ-CG1 4.18Å; Q194-I198 HydrophobicContact CG-CD1 4.25Å; Q194-I198 WeakPolarHBondContact O-CG1 3.39Å; Q194-I198 PolarHBondContact O-N 2.96Å; Q194-I198 VanDerWaalsContact O-N 3.08Å; T195-I198 PolarHBondContact O-N 3.47Å; L196-I198 PolarHBondContact O-N 2.93Å; I198-I200 PolarHBondContact O-N 3.4Å; I198-L201 PolarHBondContact O-N 3.06Å; I198-R202 WeakPolarHBondContact O-CB 3.49Å; I198-R202 WeakPolarHBondContact O-CG 3.5Å; I198-R202 PolarHBondContact O-N 3.47Å |
| 199 | V | 91.8 | Very high | 92 | Very high | 13 Ų | 13 | 47.6 Ų | 47.6 | 8% | 0.079 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -62.9 | -45 | -177.8 | 172.7 | 0 | 0 | 0 | 0 | 111.6 | T195 L196 L203 V204 L256 | T195-V199 HydrophobicContact CG2-CG2 4.38Å; T195-V199 WeakPolarHBondContact O-CG2 3.23Å; T195-V199 PolarHBondContact O-N 3.39Å; L196-V199 PolarHBondContact O-N 2.94Å; V199-L203 HydrophobicContact CG1-CB 4.45Å; V199-L203 HydrophobicContact CG1-CD2 4.34Å; V199-L203 WeakPolarHBondContact O-CA 3.48Å; V199-L203 VanDerWaalsContact O-CB 3.24Å; V199-L203 WeakPolarHBondContact O-CB 3.49Å; V199-L203 PolarHBondContact O-N 3.45Å; V199-V204 HydrophobicContact CG1-CG2 4.38Å; V199-V204 PolarHBondContact O-N 2.94Å; V199-V204 VanDerWaalsContact O-N 3.09Å; V199-L256 HydrophobicContact CG2-CB 4.33Å; V199-L256 HydrophobicContact CG2-CD1 4.27Å |
| 200 | I | 94 | Very high | 91.8 | Very high | 88 Ų | 88 | 42.9 Ų | 42.9 | 45% | 0.451 | 22% | 0.217 | S | C | . | . | I | π-helix | trans | -62.7 | -50.7 | 179.6 | -69.7 | 166.2 | 0 | 0 | 0 | 110.2 | L196 I198 R202 V204 L205 | L196-I200 HydrophobicContact CB-CD1 4.32Å; L196-I200 VanDerWaalsContact O-CB 3.23Å; L196-I200 WeakPolarHBondContact O-CB 3.44Å; L196-I200 WeakPolarHBondContact O-CD1 3.08Å; L196-I200 WeakPolarHBondContact O-CG1 3.25Å; L196-I200 PolarHBondContact O-N 3.16Å; I198-I200 PolarHBondContact O-N 3.4Å; I200-R202 PolarHBondContact O-N 3.08Å; I200-V204 PolarHBondContact O-N 3.35Å; I200-L205 VanDerWaalsContact O-CB 3.25Å; I200-L205 WeakPolarHBondContact O-CB 3.43Å; I200-L205 PolarHBondContact O-N 3.08Å |
| 201 | L | 94.3 | Very high | 91.7 | Very high | 40 Ų | 40 | 44.1 Ų | 44.1 | 21% | 0.209 | 23% | 0.231 | C | C | . | . | I | π-helix | trans | -73 | -28.4 | -174.6 | -65.9 | 177.5 | 0 | 0 | 0 | 113.4 | F113 F117 A159 K197 I198 L205 P206 | F113-L201 HydrophobicContact CD1-CD1 4.26Å; F113-L201 HydrophobicContact CE1-CB 4.31Å; F113-L201 HydrophobicContact CE1-CD1 3.97Å; F117-L201 HydrophobicContact CE1-CB 4.47Å; F117-L201 HydrophobicContact CE1-CD2 4.41Å; F117-L201 HydrophobicContact CZ-CD1 4.33Å; F117-L201 HydrophobicContact CZ-CD2 4.42Å; A159-L201 HydrophobicContact CB-CD1 4.38Å; K197-L201 HydrophobicContact CG-CD1 3.85Å; K197-L201 WeakPolarHBondContact O-CB 3.36Å; K197-L201 VanDerWaalsContact O-CG 3.27Å; K197-L201 WeakPolarHBondContact O-CG 3.24Å; K197-L201 PolarHBondContact O-N 3.01Å; I198-L201 PolarHBondContact O-N 3.06Å; L201-L205 HydrophobicContact CD2-CD2 4.25Å; L201-P206 WeakPolarHBondContact O-CD 3.24Å |
| 202 | R | 90 | Very high | 91.8 | Very high | 2 Ų | 2 | 46.6 Ų | 46.6 | 1% | 0.008 | 25% | 0.245 | C | C | . | . | I | π-helix | trans | -109.6 | -18.5 | -170.6 | -62.4 | -167.9 | 69.7 | -129.1 | 14.5 | 115.5 | F112 F113 I116 I198 I200 P206 Y244 W248 | F112-R202 VanDerWaalsContact CD1-CD 3.4Å; F112-R202 HydrophobicContact CE1-CG 4.41Å; F113-R202 HydrophobicContact CD1-CG 4.39Å; F113-R202 HydrophobicContact CE1-CG 4.25Å; I116-R202 HydrophobicContact CG2-CG 4.19Å; I198-R202 WeakPolarHBondContact O-CB 3.49Å; I198-R202 WeakPolarHBondContact O-CG 3.5Å; I198-R202 PolarHBondContact O-N 3.47Å; I200-R202 PolarHBondContact O-N 3.08Å; R202-P206 VanDerWaalsContact C-CG 3.46Å; R202-P206 WeakPolarHBondContact O-CG 3.34Å; R202-Y244 WeakPolarHBondContact CB-OH 3.24Å; R202-Y244 PolarHBondContact NE-OH 3.38Å; R202-Y244 WeakPolarHBondContact O-CE1 3.48Å; R202-Y244 PolarHBondContact O-OH 3.09Å; R202-W248 VanDerWaalsContact NH1-CE3 3.35Å; R202-W248 VanDerWaalsContact NH2-CE3 3.26Å |
| 203 | L | 90.6 | Very high | 91.7 | Very high | 36 Ų | 36 | 45 Ų | 45 | 19% | 0.188 | 24% | 0.238 | C | C | . | . | I | π-helix | trans | -116.2 | -59.5 | 177.6 | -173.3 | 66.1 | 0 | 0 | 0 | 110.1 | V199 L207 Y245 A249 N252 | V199-L203 HydrophobicContact CG1-CB 4.45Å; V199-L203 HydrophobicContact CG1-CD2 4.34Å; V199-L203 WeakPolarHBondContact O-CA 3.48Å; V199-L203 VanDerWaalsContact O-CB 3.24Å; V199-L203 WeakPolarHBondContact O-CB 3.49Å; V199-L203 PolarHBondContact O-N 3.45Å; L203-L207 WeakPolarHBondContact O-CB 3.18Å; L203-L207 PolarHBondContact O-N 3.48Å; L203-Y245 HydrophobicContact CD1-CD1 4.06Å; L203-Y245 HydrophobicContact CD1-CE1 4.01Å; L203-A249 HydrophobicContact CD1-CB 4Å; L203-N252 HydrophobicContact CB-CB 4.46Å; L203-N252 HydrophobicContact CD2-CB 4.35Å |
| 204 | V | 93.4 | Very high | 91.3 | Very high | 77 Ų | 77 | 42 Ų | 42 | 47% | 0.467 | 22% | 0.224 | S | C | . | . | I | π-helix | trans | -69.7 | -51.1 | -171 | -177.2 | 0 | 0 | 0 | 0 | 112.2 | V199 I200 L207 L208 | V199-V204 HydrophobicContact CG1-CG2 4.38Å; V199-V204 PolarHBondContact O-N 2.94Å; V199-V204 VanDerWaalsContact O-N 3.09Å; I200-V204 PolarHBondContact O-N 3.35Å; V204-L207 PolarHBondContact O-N 3.45Å; V204-L208 WeakPolarHBondContact O-CB 3.3Å; V204-L208 PolarHBondContact O-N 3.4Å |
| 205 | L | 93.6 | Very high | 91.1 | Very high | 62 Ų | 62 | 44.8 Ų | 44.8 | 33% | 0.325 | 25% | 0.245 | S | C | . | . | H | α-helix | trans | -59.1 | -54.3 | -179.1 | 178.1 | 67.2 | 0 | 0 | 0 | 112.8 | F117 I120 I200 L201 L207 L208 V209 | F117-L205 HydrophobicContact CE1-CD2 4.46Å; I120-L205 HydrophobicContact CD1-CD2 4.01Å; I120-L205 HydrophobicContact CD1-CG 4.06Å; I200-L205 VanDerWaalsContact O-CB 3.25Å; I200-L205 WeakPolarHBondContact O-CB 3.43Å; I200-L205 PolarHBondContact O-N 3.08Å; L201-L205 HydrophobicContact CD2-CD2 4.25Å; L205-L207 PolarHBondContact O-N 3.17Å; L205-L208 PolarHBondContact O-N 3.46Å; L205-V209 WeakPolarHBondContact O-CG2 3.44Å; L205-V209 PolarHBondContact O-N 3.36Å |
| 206 | P | 90.7 | Very high | 90.8 | Very high | 0 Ų | 0 | 45.4 Ų | 45.4 | 0% | 0 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -65.1 | -27.7 | 178.6 | 25.9 | -34.4 | 0 | 0 | 0 | 111.9 | I116 I120 L201 R202 M210 Y245 | I116-P206 HydrophobicContact CD1-CB 3.68Å; I116-P206 HydrophobicContact CD1-CG 3.92Å; I116-P206 HydrophobicContact CG1-CB 4.1Å; I116-P206 HydrophobicContact CG1-CG 3.98Å; I120-P206 HydrophobicContact CD1-CB 3.94Å; I120-P206 HydrophobicContact CG1-CB 3.91Å; L201-P206 WeakPolarHBondContact O-CD 3.24Å; R202-P206 VanDerWaalsContact C-CG 3.46Å; R202-P206 WeakPolarHBondContact O-CG 3.34Å; P206-M210 VanDerWaalsContact O-CB 3.25Å; P206-M210 WeakPolarHBondContact O-CB 3.33Å; P206-M210 PolarHBondContact O-N 2.92Å; P206-Y245 WeakPolarHBondContact CB-OH 3.39Å; P206-Y245 HydrophobicContact CG-CE1 4.46Å; P206-Y245 WeakPolarHBondContact CG-OH 3.33Å; P206-Y245 PolarHBondContact O-OH 3.37Å |
| 207 | L | 91.1 | Very high | 90.3 | Very high | 82 Ų | 82 | 42 Ų | 42 | 43% | 0.429 | 23% | 0.234 | S | C | . | . | H | α-helix | trans | -72 | -43.1 | 179.9 | -173.9 | 79.7 | 0 | 0 | 0 | 109.8 | L203 V204 L205 M210 V211 Y245 | L203-L207 WeakPolarHBondContact O-CB 3.18Å; L203-L207 PolarHBondContact O-N 3.48Å; V204-L207 PolarHBondContact O-N 3.45Å; L205-L207 PolarHBondContact O-N 3.17Å; L207-M210 WeakPolarHBondContact O-CB 3.43Å; L207-M210 PolarHBondContact O-N 3.14Å; L207-V211 WeakPolarHBondContact O-CG2 3.24Å; L207-V211 PolarHBondContact O-N 2.96Å; L207-Y245 WeakPolarHBondContact CA-OH 3.38Å; L207-Y245 HydrophobicContact CD1-CE2 4.49Å; L207-Y245 PolarHBondContact N-OH 3.44Å |
| 208 | L | 93.9 | Very high | 89.7 | Confident | 100 Ų | 100 | 45.9 Ų | 45.9 | 52% | 0.524 | 26% | 0.255 | S | S | . | . | H | α-helix | trans | -58.8 | -48.4 | 173.7 | -178.7 | 64.1 | 0 | 0 | 0 | 111.1 | V204 L205 M210 V211 I212 | V204-L208 WeakPolarHBondContact O-CB 3.3Å; V204-L208 PolarHBondContact O-N 3.4Å; L205-L208 PolarHBondContact O-N 3.46Å; L208-M210 VanDerWaalsContact C-N 3.29Å; L208-M210 PolarHBondContact O-N 3.31Å; L208-V211 PolarHBondContact O-N 2.9Å; L208-I212 HydrophobicContact CD1-CD1 3.84Å; L208-I212 HydrophobicContact CD1-CG1 4.39Å; L208-I212 HydrophobicContact CG-CD1 3.89Å; L208-I212 VanDerWaalsContact O-CG1 3.32Å; L208-I212 WeakPolarHBondContact O-CG1 3.25Å; L208-I212 PolarHBondContact O-N 2.88Å |
| 209 | V | 92.1 | Very high | 89.3 | Confident | 21 Ų | 21 | 53.5 Ų | 53.5 | 13% | 0.127 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -59.3 | -43.3 | 176.4 | 172.8 | 0 | 0 | 0 | 0 | 110.6 | I120 T123 I124 L205 C213 | I120-V209 HydrophobicContact CG2-CG1 4.23Å; I120-V209 HydrophobicContact CG2-CG2 4.1Å; T123-V209 HydrophobicContact CG2-CG1 4.15Å; I124-V209 HydrophobicContact CG1-CG1 4.04Å; L205-V209 WeakPolarHBondContact O-CG2 3.44Å; L205-V209 PolarHBondContact O-N 3.36Å; V209-C213 WeakPolarHBondContact O-CB 3.38Å; V209-C213 PolarHBondContact O-N 2.95Å; V209-C213 PolarHBondContact O-SG 2.8Å |
| 210 | M | 87.2 | Confident | 88.7 | Confident | 28 Ų | 28 | 54.4 Ų | 54.4 | 14% | 0.138 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -59.8 | -52.9 | 178.5 | -174.4 | -175.1 | -169.4 | 0 | 0 | 111 | P206 L207 L208 I212 C213 Y214 F238 M241 I242 Y245 | P206-M210 VanDerWaalsContact O-CB 3.25Å; P206-M210 WeakPolarHBondContact O-CB 3.33Å; P206-M210 PolarHBondContact O-N 2.92Å; L207-M210 WeakPolarHBondContact O-CB 3.43Å; L207-M210 PolarHBondContact O-N 3.14Å; L208-M210 VanDerWaalsContact C-N 3.29Å; L208-M210 PolarHBondContact O-N 3.31Å; M210-I212 VanDerWaalsContact C-N 3.35Å; M210-I212 PolarHBondContact O-N 3.35Å; M210-C213 PolarHBondContact O-N 3.29Å; M210-Y214 HydrophobicContact CB-CD2 4.29Å; M210-Y214 HydrophobicContact CG-CD2 3.49Å; M210-Y214 VanDerWaalsContact CG-CD2 3.49Å; M210-Y214 HydrophobicContact CG-CE2 3.82Å; M210-Y214 WeakPolarHBondContact O-CB 3.17Å; M210-Y214 VanDerWaalsContact O-CD2 3.27Å; M210-Y214 WeakPolarHBondContact O-CD2 3.4Å; M210-Y214 PolarHBondContact O-N 3.41Å; M210-F238 HydrophobicContact CE-CD2 3.98Å; M210-F238 HydrophobicContact CE-CE2 3.63Å; M210-M241 HydrophobicContact CE-CB 4.48Å; M210-M241 HydrophobicContact CE-CG 4.02Å; M210-M241 HydrophobicContact CG-CG 4.13Å; M210-M241 HydrophobicContact SD-CG 3.73Å; M210-I242 HydrophobicContact CE-CG1 4.13Å; M210-Y245 HydrophobicContact SD-CD2 4.19Å; M210-Y245 HydrophobicContact SD-CE2 3.63Å |
| 211 | V | 89.8 | Confident | 87.8 | Confident | 85 Ų | 85 | 51.1 Ų | 51.1 | 52% | 0.515 | 28% | 0.277 | S | S | . | . | H | α-helix | trans | -58 | -48.5 | -178.8 | 171.4 | 0 | 0 | 0 | 0 | 110.7 | L207 L208 S215 | L207-V211 WeakPolarHBondContact O-CG2 3.24Å; L207-V211 PolarHBondContact O-N 2.96Å; L208-V211 PolarHBondContact O-N 2.9Å; V211-S215 WeakPolarHBondContact O-CB 3.41Å; V211-S215 PolarHBondContact O-N 2.93Å; V211-S215 VanDerWaalsContact O-N 3.13Å; V211-S215 PolarHBondContact O-OG 3.44Å |
| 212 | I | 91.1 | Very high | 86.9 | Confident | 94 Ų | 94 | 55.9 Ų | 55.9 | 48% | 0.482 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -64.1 | -51.8 | -179.2 | -64.8 | 168.5 | 0 | 0 | 0 | 111 | L208 M210 G216 | L208-I212 HydrophobicContact CD1-CD1 3.84Å; L208-I212 HydrophobicContact CD1-CG1 4.39Å; L208-I212 HydrophobicContact CG-CD1 3.89Å; L208-I212 VanDerWaalsContact O-CG1 3.32Å; L208-I212 WeakPolarHBondContact O-CG1 3.25Å; L208-I212 PolarHBondContact O-N 2.88Å; M210-I212 VanDerWaalsContact C-N 3.35Å; M210-I212 PolarHBondContact O-N 3.35Å; I212-G216 PolarHBondContact O-N 2.86Å |
| 213 | C | 88.8 | Confident | 86.2 | Confident | 7 Ų | 7 | 66.4 Ų | 66.4 | 5% | 0.047 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -66.9 | -48.3 | -173.6 | -68.8 | 0 | 0 | 0 | 0 | 111.7 | T123 Y127 V209 M210 S215 G216 I217 | T123-C213 HydrophobicContact CG2-CB 3.84Å; Y127-C213 VanDerWaalsContact CD2-CA 3.46Å; Y127-C213 HydrophobicContact CD2-CB 3.88Å; Y127-C213 VanDerWaalsContact CD2-O 3.25Å; Y127-C213 WeakPolarHBondContact CD2-O 3.29Å; Y127-C213 HydrophobicContact CG-CB 4.1Å; V209-C213 WeakPolarHBondContact O-CB 3.38Å; V209-C213 PolarHBondContact O-N 2.95Å; V209-C213 PolarHBondContact O-SG 2.8Å; M210-C213 PolarHBondContact O-N 3.29Å; C213-S215 PolarHBondContact O-N 3.02Å; C213-G216 PolarHBondContact O-N 2.82Å; C213-I217 VanDerWaalsContact O-CG1 3.29Å; C213-I217 WeakPolarHBondContact O-CG1 3.39Å; C213-I217 PolarHBondContact O-N 3.44Å |
| 214 | Y | 84.3 | Confident | 85 | Confident | 28 Ų | 28 | 67.5 Ų | 67.5 | 11% | 0.11 | 35% | 0.351 | C | S | . | . | H | α-helix | trans | -71.9 | -30.4 | -176.9 | -74.7 | -75.4 | 0 | 0 | 0 | 112.8 | T123 M210 G216 I217 L218 V234 I237 F238 | T123-Y214 HydrophobicContact CG2-CE2 3.89Å; M210-Y214 HydrophobicContact CB-CD2 4.29Å; M210-Y214 HydrophobicContact CG-CD2 3.49Å; M210-Y214 VanDerWaalsContact CG-CD2 3.49Å; M210-Y214 HydrophobicContact CG-CE2 3.82Å; M210-Y214 WeakPolarHBondContact O-CB 3.17Å; M210-Y214 VanDerWaalsContact O-CD2 3.27Å; M210-Y214 WeakPolarHBondContact O-CD2 3.4Å; M210-Y214 PolarHBondContact O-N 3.41Å; Y214-G216 PolarHBondContact O-N 3.09Å; Y214-I217 HydrophobicContact CD1-CD1 4.21Å; Y214-I217 HydrophobicContact CE1-CD1 4.35Å; Y214-I217 PolarHBondContact O-N 2.9Å; Y214-L218 VanDerWaalsContact O-CB 3.22Å; Y214-L218 WeakPolarHBondContact O-CB 3.39Å; Y214-L218 PolarHBondContact O-N 2.97Å; Y214-V234 HydrophobicContact CE1-CG1 4.22Å; Y214-I237 WeakPolarHBondContact OH-CG2 3.34Å; Y214-I237 PolarHBondContact OH-O 3.3Å; Y214-F238 AromaticContact CD1-CD2 3.82Å; Y214-F238 HydrophobicContact CD1-CD2 3.82Å; Y214-F238 HydrophobicContact CD2-CD2 4.3Å; Y214-F238 HydrophobicContact CE1-CB 3.71Å; Y214-F238 AromaticContact CE1-CD2 3.65Å; Y214-F238 HydrophobicContact CE1-CD2 3.65Å; Y214-F238 HydrophobicContact CE1-CG 4.13Å; Y214-F238 HydrophobicContact CE2-CD2 4.15Å; Y214-F238 HydrophobicContact CG-CD2 4.15Å; Y214-F238 AromaticContact CZ-CD2 3.83Å; Y214-F238 WeakPolarHBondContact OH-CA 3.24Å; Y214-F238 PolarHBondContact OH-N 3.48Å |
| 215 | S | 86.2 | Confident | 83.3 | Confident | 71 Ų | 71 | 74.8 Ų | 74.8 | 50% | 0.497 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -60.4 | -45.7 | 171.7 | -62.3 | 0 | 0 | 0 | 0 | 111.4 | V211 C213 K219 | V211-S215 WeakPolarHBondContact O-CB 3.41Å; V211-S215 PolarHBondContact O-N 2.93Å; V211-S215 VanDerWaalsContact O-N 3.13Å; V211-S215 PolarHBondContact O-OG 3.44Å; C213-S215 PolarHBondContact O-N 3.02Å; S215-K219 WeakPolarHBondContact O-CB 3.09Å; S215-K219 PolarHBondContact O-N 3.46Å |
| 216 | G | 85.2 | Confident | 81.5 | Confident | 16 Ų | 16 | 79.1 Ų | 79.1 | 17% | 0.165 | 39% | 0.394 | C | S | . | . | H | α-helix | trans | -69.7 | -38.2 | 177.2 | 0 | 0 | 0 | 0 | 0 | 113.4 | I212 C213 Y214 T220 | I212-G216 PolarHBondContact O-N 2.86Å; C213-G216 PolarHBondContact O-N 2.82Å; Y214-G216 PolarHBondContact O-N 3.09Å; G216-T220 PolarHBondContact O-N 2.73Å; G216-T220 VanDerWaalsContact O-N 3.08Å; G216-T220 PolarHBondContact O-OG1 2.86Å |
| 217 | I | 83.1 | Confident | 80.3 | Confident | 4 Ų | 4 | 84.7 Ų | 84.7 | 2% | 0.021 | 42% | 0.42 | C | S | . | . | H | α-helix | trans | -61.9 | -48.3 | 174.5 | -71.3 | 164 | 0 | 0 | 0 | 110.4 | Y127 V130 V131 C213 Y214 K219 T220 L221 V234 | Y127-I217 HydrophobicContact CD2-CD1 4.49Å; Y127-I217 HydrophobicContact CD2-CG1 4.1Å; V130-I217 HydrophobicContact CB-CG1 4.36Å; V130-I217 HydrophobicContact CG1-CG1 4.34Å; V130-I217 HydrophobicContact CG1-CG2 4.24Å; V131-I217 HydrophobicContact CG2-CG1 4.21Å; C213-I217 VanDerWaalsContact O-CG1 3.29Å; C213-I217 WeakPolarHBondContact O-CG1 3.39Å; C213-I217 PolarHBondContact O-N 3.44Å; Y214-I217 HydrophobicContact CD1-CD1 4.21Å; Y214-I217 HydrophobicContact CE1-CD1 4.35Å; Y214-I217 PolarHBondContact O-N 2.9Å; I217-K219 PolarHBondContact O-N 2.88Å; I217-T220 PolarHBondContact O-N 3.42Å; I217-L221 HydrophobicContact CG2-CD1 3.58Å; I217-L221 HydrophobicContact CG2-CG 4.14Å; I217-L221 WeakPolarHBondContact O-CB 3.5Å; I217-L221 VanDerWaalsContact O-CG 3.3Å; I217-L221 WeakPolarHBondContact O-CG 3.29Å; I217-L221 PolarHBondContact O-N 3.02Å; I217-V234 HydrophobicContact CG2-CB 4.4Å; I217-V234 HydrophobicContact CG2-CG1 3.64Å; I217-V234 HydrophobicContact CG2-CG2 3.83Å |
| 218 | L | 81.5 | Confident | 78.8 | Confident | 104 Ų | 104 | 86.7 Ų | 86.7 | 55% | 0.545 | 43% | 0.431 | S | S | . | . | H | α-helix | trans | -61.7 | -45.6 | -179.2 | -175.3 | 62.7 | 0 | 0 | 0 | 110.9 | Y214 T220 L221 L222 | Y214-L218 VanDerWaalsContact O-CB 3.22Å; Y214-L218 WeakPolarHBondContact O-CB 3.39Å; Y214-L218 PolarHBondContact O-N 2.97Å; L218-T220 VanDerWaalsContact C-N 3.31Å; L218-T220 PolarHBondContact O-N 2.81Å; L218-L221 PolarHBondContact O-N 3.29Å; L218-L222 HydrophobicContact CD1-CD1 4.38Å; L218-L222 HydrophobicContact CD1-CG 4.32Å; L218-L222 HydrophobicContact CG-CD1 4.06Å; L218-L222 HydrophobicContact CG-CG 4.43Å; L218-L222 WeakPolarHBondContact O-CB 3.47Å; L218-L222 VanDerWaalsContact O-CG 3.28Å; L218-L222 WeakPolarHBondContact O-CG 3.43Å; L218-L222 PolarHBondContact O-N 3.08Å |
| 219 | K | 83.3 | Confident | 77.2 | Confident | 165 Ų | 165 | 90.8 Ų | 90.8 | 72% | 0.717 | 45% | 0.445 | S | S | * | . | H | α-helix | trans | -56.6 | -44.2 | 175.7 | -173 | 176.8 | -178.4 | 177 | 0 | 112.1 | S215 I217 R223 | S215-K219 WeakPolarHBondContact O-CB 3.09Å; S215-K219 PolarHBondContact O-N 3.46Å; I217-K219 PolarHBondContact O-N 2.88Å; K219-R223 PolarHBondContact O-N 2.82Å |
| 220 | T | 78.1 | Confident | 75.8 | Confident | 33 Ų | 33 | 92.4 Ų | 92.4 | 20% | 0.202 | 45% | 0.449 | C | S | . | . | H | α-helix | trans | -73.2 | -34.4 | 179.9 | -57 | 0 | 0 | 0 | 0 | 112.4 | V130 G216 I217 L218 R223 C224 | V130-T220 HydrophobicContact CG1-CG2 4.49Å; G216-T220 PolarHBondContact O-N 2.73Å; G216-T220 VanDerWaalsContact O-N 3.08Å; G216-T220 PolarHBondContact O-OG1 2.86Å; I217-T220 PolarHBondContact O-N 3.42Å; L218-T220 VanDerWaalsContact C-N 3.31Å; L218-T220 PolarHBondContact O-N 2.81Å; T220-R223 PolarHBondContact O-N 2.89Å; T220-C224 WeakPolarHBondContact O-CB 3.44Å; T220-C224 PolarHBondContact O-N 3.39Å; T220-C224 VanDerWaalsContact O-N 3.12Å |
| 221 | L | 75.2 | Confident | 74.9 | Confident | 19 Ų | 19 | 94.1 Ų | 94.1 | 10% | 0.099 | 46% | 0.456 | C | S | . | . | H | α-helix | trans | -69.9 | -40.2 | 175.5 | -72.1 | 173.2 | 0 | 0 | 0 | 112.2 | I217 L218 R223 C224 V234 | I217-L221 HydrophobicContact CG2-CD1 3.58Å; I217-L221 HydrophobicContact CG2-CG 4.14Å; I217-L221 WeakPolarHBondContact O-CB 3.5Å; I217-L221 VanDerWaalsContact O-CG 3.3Å; I217-L221 WeakPolarHBondContact O-CG 3.29Å; I217-L221 PolarHBondContact O-N 3.02Å; L218-L221 PolarHBondContact O-N 3.29Å; L221-R223 PolarHBondContact O-N 3.1Å; L221-C224 CarbonylContact O-C 3.09Å; L221-C224 PolarHBondContact O-N 3.06Å; L221-V234 HydrophobicContact CD1-CG1 4.3Å; L221-V234 HydrophobicContact CD1-CG2 4.45Å |
| 222 | L | 75.3 | Confident | 73.8 | Confident | 139 Ų | 139 | 97 Ų | 97 | 73% | 0.728 | 46% | 0.458 | S | S | * | . | H | α-helix | trans | -62.2 | -31.7 | 174.5 | -70.6 | 171.6 | 0 | 0 | 0 | 112.1 | L218 | L218-L222 HydrophobicContact CD1-CD1 4.38Å; L218-L222 HydrophobicContact CD1-CG 4.32Å; L218-L222 HydrophobicContact CG-CD1 4.06Å; L218-L222 HydrophobicContact CG-CG 4.43Å; L218-L222 WeakPolarHBondContact O-CB 3.47Å; L218-L222 VanDerWaalsContact O-CG 3.28Å; L218-L222 WeakPolarHBondContact O-CG 3.43Å; L218-L222 PolarHBondContact O-N 3.08Å |
| 223 | R | 75.1 | Confident | 72.6 | Confident | 223 Ų | 223 | 94 Ų | 94 | 84% | 0.842 | 45% | 0.448 | S | S | * | . | H | α-helix | trans | -78.9 | -27.7 | 177.4 | -166.1 | 173.8 | -178.7 | -178.3 | 0.7 | 113.5 | K219 T220 L221 | K219-R223 PolarHBondContact O-N 2.82Å; T220-R223 PolarHBondContact O-N 2.89Å; L221-R223 PolarHBondContact O-N 3.1Å |
| 224 | C | 65.9 | Low | 71.7 | Confident | 59 Ų | 59 | 94.3 Ų | 94.3 | 40% | 0.399 | 45% | 0.449 | S | S | . | . | trans | -116.7 | 87.4 | -175.4 | -62.6 | 0 | 0 | 0 | 0 | 111 | T220 L221 N226 | T220-C224 WeakPolarHBondContact O-CB 3.44Å; T220-C224 PolarHBondContact O-N 3.39Å; T220-C224 VanDerWaalsContact O-N 3.12Å; L221-C224 CarbonylContact O-C 3.09Å; L221-C224 PolarHBondContact O-N 3.06Å; C224-N226 VanDerWaalsContact C-N 3.3Å; C224-N226 PolarHBondContact O-N 3.03Å | ||
| 225 | R | 58.4 | Low | 71.1 | Confident | 231 Ų | 231 | 98.5 Ų | 98.5 | 87% | 0.872 | 47% | 0.471 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -71.3 | -3.9 | -169.4 | -173 | 163.1 | 132.8 | 167 | -4.9 | 116.6 | ||
| 226 | N | 55.5 | Low | 70.4 | Confident | 153 Ų | 153 | 96.8 Ų | 96.8 | 82% | 0.818 | 46% | 0.456 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -120.9 | 15.6 | -161.4 | -100.5 | 5.5 | 0 | 0 | 0 | 118.5 | C224 | C224-N226 VanDerWaalsContact C-N 3.3Å; C224-N226 PolarHBondContact O-N 3.03Å |
| 227 | E | 65.1 | Low | 69.7 | Low | 116 Ų | 116 | 96.3 Ų | 96.3 | 54% | 0.542 | 45% | 0.45 | S | S | . | . | trans | -120.8 | 80.2 | -179.2 | -69.6 | -143.5 | 176.3 | 0 | 0 | 115.8 | K229 R230 H231 | E227-K229 PolarHBondContact O-N 2.03Å; E227-K229 VanDerWaalsContact O-N 3.12Å; E227-R230 HydrophobicContact CB-CB 4.11Å; E227-R230 WeakPolarHBondContact O-CB 3.3Å; E227-R230 PolarHBondContact O-N 3.14Å; E227-H231 PolarHBondContact O-CD2 3.05Å; E227-H231 VanDerWaalsContact O-CD2 3.3Å; E227-H231 PolarHBondContact O-N 3.18Å | ||
| 228 | N | 60.3 | Low | 69.4 | Low | 125 Ų | 125 | 99.6 Ų | 99.6 | 67% | 0.668 | 46% | 0.464 | S | S | * | . | H | α-helix | trans | -53.4 | -32.7 | 179.4 | -69.9 | -12.6 | 0 | 0 | 0 | 114.9 | ||
| 229 | K | 58.8 | Low | 69.3 | Low | 186 Ų | 186 | 96.6 Ų | 96.6 | 81% | 0.809 | 45% | 0.451 | S | S | * | . | H | α-helix | trans | -70.5 | -31.5 | 178.6 | -76.1 | -179.4 | -179.6 | 170.6 | 0 | 112.8 | E227 | E227-K229 PolarHBondContact O-N 2.03Å; E227-K229 VanDerWaalsContact O-N 3.12Å |
| 230 | R | 64 | Low | 69.1 | Low | 54 Ų | 54 | 88.8 Ų | 88.8 | 20% | 0.204 | 42% | 0.418 | C | S | . | . | H | α-helix | trans | -73.4 | -36.3 | -179.2 | -149.9 | 174.1 | 76.8 | 173.3 | 3.7 | 111.1 | V130 E227 R232 V234 | V130-R230 HydrophobicContact CG2-CG 4.02Å; E227-R230 HydrophobicContact CB-CB 4.11Å; E227-R230 WeakPolarHBondContact O-CB 3.3Å; E227-R230 PolarHBondContact O-N 3.14Å; R230-R232 PolarHBondContact O-N 3.23Å; R230-V234 WeakPolarHBondContact O-CG2 3.05Å; R230-V234 PolarHBondContact O-N 3.08Å |
| 231 | H | 67.4 | Low | 69.2 | Low | 65 Ų | 65 | 87.2 Ų | 87.2 | 30% | 0.301 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -59.3 | -43.8 | 173.4 | -75.6 | -83 | 0 | 0 | 0 | 113 | E227 A233 V234 M235 | E227-H231 PolarHBondContact O-CD2 3.05Å; E227-H231 VanDerWaalsContact O-CD2 3.3Å; E227-H231 PolarHBondContact O-N 3.18Å; H231-A233 PolarHBondContact O-N 3.06Å; H231-V234 PolarHBondContact O-N 3.04Å; H231-M235 WeakPolarHBondContact O-CG 3.3Å; H231-M235 PolarHBondContact O-N 3.34Å |
| 232 | R | 67.6 | Low | 69.8 | Low | 144 Ų | 144 | 89.4 Ų | 89.4 | 54% | 0.543 | 42% | 0.419 | S | S | . | . | H | α-helix | trans | -63.1 | -41.1 | -177.8 | -68.6 | -178.2 | -176.2 | 175.4 | -0.7 | 113.2 | R230 M235 L236 E302 | R230-R232 PolarHBondContact O-N 3.23Å; R232-M235 PolarHBondContact O-N 2.81Å; R232-L236 PolarHBondContact O-N 3.3Å; R232-E302 IonicContact CZ-OE1 3.32Å; R232-E302 IonicContact CZ-OE2 2.98Å; R232-E302 IonicContact NE-OE1 3.86Å; R232-E302 IonicContact NH1-OE1 3.78Å; R232-E302 PolarHBondContact NH1-OE1 2.78Å; R232-E302 IonicContact NH1-OE2 3.98Å; R232-E302 PolarHBondContact NH1-OE2 3.25Å; R232-E302 IonicContact NH2-OE1 3.87Å |
| 233 | A | 64.8 | Low | 70.5 | Confident | 33 Ų | 33 | 84.1 Ų | 84.1 | 27% | 0.273 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -69 | -34.8 | 178.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | H231 I237 | H231-A233 PolarHBondContact O-N 3.06Å; A233-I237 PolarHBondContact O-N 3.32Å |
| 234 | V | 69.8 | Low | 71.1 | Confident | 13 Ų | 13 | 73.7 Ų | 73.7 | 8% | 0.079 | 35% | 0.353 | C | S | . | . | H | α-helix | trans | -66.6 | -45.1 | 173.5 | 170.9 | 0 | 0 | 0 | 0 | 110.6 | V130 Y214 I217 L221 R230 H231 L236 I237 F238 | V130-V234 HydrophobicContact CG2-CG2 4.02Å; Y214-V234 HydrophobicContact CE1-CG1 4.22Å; I217-V234 HydrophobicContact CG2-CB 4.4Å; I217-V234 HydrophobicContact CG2-CG1 3.64Å; I217-V234 HydrophobicContact CG2-CG2 3.83Å; L221-V234 HydrophobicContact CD1-CG1 4.3Å; L221-V234 HydrophobicContact CD1-CG2 4.45Å; R230-V234 WeakPolarHBondContact O-CG2 3.05Å; R230-V234 PolarHBondContact O-N 3.08Å; H231-V234 PolarHBondContact O-N 3.04Å; V234-L236 VanDerWaalsContact C-N 3.32Å; V234-L236 PolarHBondContact O-N 3Å; V234-I237 PolarHBondContact O-N 3.46Å; V234-F238 VanDerWaalsContact O-CB 3.32Å; V234-F238 WeakPolarHBondContact O-CB 3.39Å; V234-F238 PolarHBondContact O-N 3.28Å |
| 235 | M | 72.4 | Confident | 72.2 | Confident | 115 Ų | 115 | 72.2 Ų | 72.2 | 57% | 0.567 | 34% | 0.34 | S | S | * | . | H | α-helix | trans | -60.2 | -40.1 | 177.2 | -71.3 | -59 | -154.9 | 0 | 0 | 112.2 | H231 R232 F238 S239 | H231-M235 WeakPolarHBondContact O-CG 3.3Å; H231-M235 PolarHBondContact O-N 3.34Å; R232-M235 PolarHBondContact O-N 2.81Å; M235-F238 PolarHBondContact O-N 2.8Å; M235-S239 WeakPolarHBondContact O-CB 3.44Å; M235-S239 PolarHBondContact O-N 3.32Å; M235-S239 PolarHBondContact O-OG 3.22Å |
| 236 | L | 71.2 | Confident | 73.9 | Confident | 35 Ų | 35 | 66.4 Ų | 66.4 | 18% | 0.183 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -58.7 | -51.1 | 176.8 | 178.2 | 66.8 | 0 | 0 | 0 | 112.3 | R232 V234 F238 S239 I240 I296 Y297 V300 | R232-L236 PolarHBondContact O-N 3.3Å; V234-L236 VanDerWaalsContact C-N 3.32Å; V234-L236 PolarHBondContact O-N 3Å; L236-F238 VanDerWaalsContact C-N 3.32Å; L236-S239 PolarHBondContact O-N 2.86Å; L236-I240 HydrophobicContact CD1-CD1 4.45Å; L236-I240 HydrophobicContact CG-CD1 4.22Å; L236-I240 VanDerWaalsContact O-CG1 3.3Å; L236-I240 WeakPolarHBondContact O-CG1 3.07Å; L236-I240 PolarHBondContact O-N 3.03Å; L236-I296 HydrophobicContact CD1-CG2 3.9Å; L236-Y297 HydrophobicContact CD1-CD1 4.49Å; L236-V300 HydrophobicContact CB-CG1 4.14Å; L236-V300 HydrophobicContact CD1-CB 3.64Å; L236-V300 HydrophobicContact CD1-CG1 3.61Å |
| 237 | I | 71.3 | Confident | 75.6 | Confident | 7 Ų | 7 | 61 Ų | 61 | 4% | 0.036 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -70.6 | -32.7 | -178.6 | -56.9 | -48 | 0 | 0 | 0 | 111.2 | R126 Y214 A233 V234 I240 M241 | R126-I237 HydrophobicContact CG-CB 4.29Å; R126-I237 HydrophobicContact CG-CG1 3.56Å; Y214-I237 WeakPolarHBondContact OH-CG2 3.34Å; Y214-I237 PolarHBondContact OH-O 3.3Å; A233-I237 PolarHBondContact O-N 3.32Å; V234-I237 PolarHBondContact O-N 3.46Å; I237-I240 HydrophobicContact CD1-CD1 3.78Å; I237-I240 PolarHBondContact O-N 3.21Å; I237-M241 PolarHBondContact O-N 2.82Å |
| 238 | F | 77.5 | Confident | 76.9 | Confident | 73 Ų | 73 | 56 Ų | 56 | 32% | 0.32 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -63.7 | -44.1 | 174.4 | -175.3 | -110.5 | 0 | 0 | 0 | 111.5 | M210 Y214 V234 M235 L236 M241 I242 | M210-F238 HydrophobicContact CE-CD2 3.98Å; M210-F238 HydrophobicContact CE-CE2 3.63Å; Y214-F238 AromaticContact CD1-CD2 3.82Å; Y214-F238 HydrophobicContact CD1-CD2 3.82Å; Y214-F238 HydrophobicContact CD2-CD2 4.3Å; Y214-F238 HydrophobicContact CE1-CB 3.71Å; Y214-F238 AromaticContact CE1-CD2 3.65Å; Y214-F238 HydrophobicContact CE1-CD2 3.65Å; Y214-F238 HydrophobicContact CE1-CG 4.13Å; Y214-F238 HydrophobicContact CE2-CD2 4.15Å; Y214-F238 HydrophobicContact CG-CD2 4.15Å; Y214-F238 AromaticContact CZ-CD2 3.83Å; Y214-F238 WeakPolarHBondContact OH-CA 3.24Å; Y214-F238 PolarHBondContact OH-N 3.48Å; V234-F238 VanDerWaalsContact O-CB 3.32Å; V234-F238 WeakPolarHBondContact O-CB 3.39Å; V234-F238 PolarHBondContact O-N 3.28Å; M235-F238 PolarHBondContact O-N 2.8Å; L236-F238 VanDerWaalsContact C-N 3.32Å; F238-M241 PolarHBondContact O-N 2.94Å; F238-I242 HydrophobicContact CD1-CD1 3.71Å; F238-I242 HydrophobicContact CE1-CD1 3.18Å; F238-I242 HydrophobicContact CE1-CG1 4.28Å; F238-I242 HydrophobicContact CE2-CD1 4.08Å; F238-I242 HydrophobicContact CE2-CG1 4.47Å; F238-I242 HydrophobicContact CG-CD1 4.37Å; F238-I242 HydrophobicContact CZ-CD1 3.41Å; F238-I242 VanDerWaalsContact CZ-CD1 3.41Å; F238-I242 HydrophobicContact CZ-CG1 4.25Å; F238-I242 PolarHBondContact O-N 3.28Å |
| 239 | S | 79.4 | Confident | 78.3 | Confident | 40 Ų | 40 | 50.9 Ų | 50.9 | 28% | 0.28 | 25% | 0.246 | S | C | . | . | H | α-helix | trans | -60.6 | -45.8 | 174.1 | -63.7 | 0 | 0 | 0 | 0 | 112.2 | M235 L236 M241 I242 V243 | M235-S239 WeakPolarHBondContact O-CB 3.44Å; M235-S239 PolarHBondContact O-N 3.32Å; M235-S239 PolarHBondContact O-OG 3.22Å; L236-S239 PolarHBondContact O-N 2.86Å; S239-M241 VanDerWaalsContact C-N 3.28Å; S239-M241 PolarHBondContact O-N 3.11Å; S239-I242 PolarHBondContact O-N 3.39Å; S239-V243 WeakPolarHBondContact O-CB 3.36Å; S239-V243 VanDerWaalsContact O-CG2 3.25Å; S239-V243 WeakPolarHBondContact O-CG2 3.07Å; S239-V243 PolarHBondContact O-N 3.14Å |
| 240 | I | 79 | Confident | 80 | Confident | 2 Ų | 2 | 44.1 Ų | 44.1 | 1% | 0.01 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -57.1 | -44.1 | 176.8 | -65.2 | 163.7 | 0 | 0 | 0 | 110.7 | I119 L236 I237 Y244 I296 Y297 | I119-I240 HydrophobicContact CD1-CG2 4.35Å; I119-I240 HydrophobicContact CG1-CG2 4.31Å; L236-I240 HydrophobicContact CD1-CD1 4.45Å; L236-I240 HydrophobicContact CG-CD1 4.22Å; L236-I240 VanDerWaalsContact O-CG1 3.3Å; L236-I240 WeakPolarHBondContact O-CG1 3.07Å; L236-I240 PolarHBondContact O-N 3.03Å; I237-I240 HydrophobicContact CD1-CD1 3.78Å; I237-I240 PolarHBondContact O-N 3.21Å; I240-Y244 WeakPolarHBondContact O-CB 3.17Å; I240-Y244 PolarHBondContact O-N 3.29Å; I240-I296 HydrophobicContact CG1-CD1 4.26Å; I240-I296 HydrophobicContact CG1-CG2 3.77Å; I240-Y297 HydrophobicContact CD1-CD1 4.48Å; I240-Y297 HydrophobicContact CD1-CE1 3.67Å; I240-Y297 HydrophobicContact CG1-CE1 4.41Å |
| 241 | M | 80.2 | Confident | 81.3 | Confident | 0 Ų | 0 | 42.5 Ų | 42.5 | 0% | 0 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -68.5 | -43.5 | -179 | -171.3 | 66.9 | 75.1 | 0 | 0 | 112.8 | I119 T123 M210 I237 F238 S239 V243 Y244 Y245 | I119-M241 HydrophobicContact CG2-CE 3.43Å; I119-M241 VanDerWaalsContact CG2-CE 3.43Å; I119-M241 HydrophobicContact CG2-SD 3.83Å; T123-M241 HydrophobicContact CG2-CE 4.42Å; T123-M241 WeakPolarHBondContact OG1-CE 3.33Å; M210-M241 HydrophobicContact CE-CB 4.48Å; M210-M241 HydrophobicContact CE-CG 4.02Å; M210-M241 HydrophobicContact CG-CG 4.13Å; M210-M241 HydrophobicContact SD-CG 3.73Å; I237-M241 PolarHBondContact O-N 2.82Å; F238-M241 PolarHBondContact O-N 2.94Å; S239-M241 VanDerWaalsContact C-N 3.28Å; S239-M241 PolarHBondContact O-N 3.11Å; M241-V243 VanDerWaalsContact C-N 3.34Å; M241-Y244 WeakPolarHBondContact O-CB 3.07Å; M241-Y244 PolarHBondContact O-N 2.89Å; M241-Y245 HydrophobicContact CG-CD2 4.14Å; M241-Y245 HydrophobicContact CG-CE2 3.65Å; M241-Y245 WeakPolarHBondContact O-CD2 3.45Å; M241-Y245 PolarHBondContact O-N 3.01Å; M241-Y245 VanDerWaalsContact O-N 3.14Å; M241-Y245 HydrophobicContact SD-CE2 3.73Å |
| 242 | I | 86.9 | Confident | 82.4 | Confident | 64 Ų | 64 | 39.4 Ų | 39.4 | 33% | 0.328 | 20% | 0.201 | S | C | . | . | H | α-helix | trans | -61.5 | -46.7 | 176.2 | -73.6 | 177.9 | 0 | 0 | 0 | 110.3 | M210 F238 S239 Y244 Y245 L246 | M210-I242 HydrophobicContact CE-CG1 4.13Å; F238-I242 HydrophobicContact CD1-CD1 3.71Å; F238-I242 HydrophobicContact CE1-CD1 3.18Å; F238-I242 HydrophobicContact CE1-CG1 4.28Å; F238-I242 HydrophobicContact CE2-CD1 4.08Å; F238-I242 HydrophobicContact CE2-CG1 4.47Å; F238-I242 HydrophobicContact CG-CD1 4.37Å; F238-I242 HydrophobicContact CZ-CD1 3.41Å; F238-I242 VanDerWaalsContact CZ-CD1 3.41Å; F238-I242 HydrophobicContact CZ-CG1 4.25Å; F238-I242 PolarHBondContact O-N 3.28Å; S239-I242 PolarHBondContact O-N 3.39Å; I242-Y244 VanDerWaalsContact C-N 3.27Å; I242-Y244 PolarHBondContact O-N 3.28Å; I242-Y245 PolarHBondContact O-N 3.34Å; I242-Y245 VanDerWaalsContact O-N 3.11Å; I242-L246 HydrophobicContact CG2-CD1 3.84Å; I242-L246 HydrophobicContact CG2-CG 4.14Å; I242-L246 WeakPolarHBondContact O-CG 3.4Å; I242-L246 PolarHBondContact O-N 2.75Å |
| 243 | V | 89.2 | Confident | 83.5 | Confident | 28 Ų | 28 | 36.8 Ų | 36.8 | 17% | 0.17 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -61 | -40.2 | 179.2 | 172.8 | 0 | 0 | 0 | 0 | 110.6 | S239 M241 Y245 L246 F247 I292 I296 | S239-V243 WeakPolarHBondContact O-CB 3.36Å; S239-V243 VanDerWaalsContact O-CG2 3.25Å; S239-V243 WeakPolarHBondContact O-CG2 3.07Å; S239-V243 PolarHBondContact O-N 3.14Å; M241-V243 VanDerWaalsContact C-N 3.34Å; V243-Y245 VanDerWaalsContact C-N 3.35Å; V243-Y245 PolarHBondContact O-N 3.13Å; V243-L246 PolarHBondContact O-N 2.68Å; V243-F247 HydrophobicContact CG1-CD2 3.85Å; V243-F247 HydrophobicContact CG1-CE2 3.82Å; V243-F247 WeakPolarHBondContact O-CD2 3.47Å; V243-F247 PolarHBondContact O-N 2.83Å; V243-F247 VanDerWaalsContact O-N 3.13Å; V243-I292 HydrophobicContact CG1-CG2 3.73Å; V243-I296 HydrophobicContact CB-CD1 3.97Å; V243-I296 HydrophobicContact CG1-CD1 3.99Å; V243-I296 HydrophobicContact CG2-CD1 4.03Å |
| 244 | Y | 87.9 | Confident | 84.7 | Confident | 4 Ų | 4 | 36 Ų | 36 | 2% | 0.016 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -54.8 | -48.7 | 172.6 | 172.4 | -92.3 | 0 | 0 | 0 | 112.1 | I116 I119 R202 I240 M241 I242 F247 W248 H289 | I116-Y244 HydrophobicContact CB-CE2 4.22Å; I116-Y244 HydrophobicContact CD1-CD1 3.94Å; I116-Y244 HydrophobicContact CD1-CD2 4.22Å; I116-Y244 HydrophobicContact CD1-CE1 3.47Å; I116-Y244 VanDerWaalsContact CD1-CE1 3.47Å; I116-Y244 HydrophobicContact CD1-CE2 3.78Å; I116-Y244 HydrophobicContact CD1-CG 4.29Å; I116-Y244 HydrophobicContact CG1-CE1 4.24Å; I116-Y244 HydrophobicContact CG1-CE2 4.31Å; I119-Y244 HydrophobicContact CD1-CD2 4.03Å; I119-Y244 HydrophobicContact CD1-CG 4.41Å; R202-Y244 WeakPolarHBondContact CB-OH 3.24Å; R202-Y244 PolarHBondContact NE-OH 3.38Å; R202-Y244 WeakPolarHBondContact O-CE1 3.48Å; R202-Y244 PolarHBondContact O-OH 3.09Å; I240-Y244 WeakPolarHBondContact O-CB 3.17Å; I240-Y244 PolarHBondContact O-N 3.29Å; M241-Y244 WeakPolarHBondContact O-CB 3.07Å; M241-Y244 PolarHBondContact O-N 2.89Å; I242-Y244 VanDerWaalsContact C-N 3.27Å; I242-Y244 PolarHBondContact O-N 3.28Å; Y244-F247 PolarHBondContact O-N 3.1Å; Y244-W248 AromaticContact CD2-CD1 3.45Å; Y244-W248 VanDerWaalsContact CD2-CD1 3.45Å; Y244-W248 HydrophobicContact CD2-CG 4.28Å; Y244-W248 HydrophobicContact CE1-CB 4.43Å; Y244-W248 HydrophobicContact CE2-CB 4.18Å; Y244-W248 AromaticContact CE2-CD1 3.39Å; Y244-W248 AromaticContact CE2-CG 3.89Å; Y244-W248 HydrophobicContact CE2-CG 3.89Å; Y244-W248 WeakPolarHBondContact O-CB 3.42Å; Y244-W248 PolarHBondContact O-N 3.29Å; Y244-H289 WeakPolarHBondContact CA-NE2 3.37Å; Y244-H289 AromaticContact CD2-CE1 4Å |
| 245 | Y | 90.4 | Very high | 85.6 | Confident | 29 Ų | 29 | 36.8 Ų | 36.8 | 11% | 0.114 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -66.9 | -39.2 | 178.6 | -72.7 | -62.2 | 0 | 0 | 0 | 113.5 | L203 P206 L207 M210 M241 I242 V243 F247 A249 P250 | L203-Y245 HydrophobicContact CD1-CD1 4.06Å; L203-Y245 HydrophobicContact CD1-CE1 4.01Å; P206-Y245 WeakPolarHBondContact CB-OH 3.39Å; P206-Y245 HydrophobicContact CG-CE1 4.46Å; P206-Y245 WeakPolarHBondContact CG-OH 3.33Å; P206-Y245 PolarHBondContact O-OH 3.37Å; L207-Y245 WeakPolarHBondContact CA-OH 3.38Å; L207-Y245 HydrophobicContact CD1-CE2 4.49Å; L207-Y245 PolarHBondContact N-OH 3.44Å; M210-Y245 HydrophobicContact SD-CD2 4.19Å; M210-Y245 HydrophobicContact SD-CE2 3.63Å; M241-Y245 HydrophobicContact CG-CD2 4.14Å; M241-Y245 HydrophobicContact CG-CE2 3.65Å; M241-Y245 WeakPolarHBondContact O-CD2 3.45Å; M241-Y245 PolarHBondContact O-N 3.01Å; M241-Y245 VanDerWaalsContact O-N 3.14Å; M241-Y245 HydrophobicContact SD-CE2 3.73Å; I242-Y245 PolarHBondContact O-N 3.34Å; I242-Y245 VanDerWaalsContact O-N 3.11Å; V243-Y245 VanDerWaalsContact C-N 3.35Å; V243-Y245 PolarHBondContact O-N 3.13Å; Y245-F247 PolarHBondContact O-N 3.2Å; Y245-A249 HydrophobicContact CD1-CB 4.38Å; Y245-A249 WeakPolarHBondContact O-CA 3.23Å; Y245-A249 WeakPolarHBondContact O-CB 3.44Å; Y245-A249 PolarHBondContact O-N 2.88Å; Y245-P250 WeakPolarHBondContact O-CD 3.32Å |
| 246 | L | 92.4 | Very high | 86.4 | Confident | 109 Ų | 109 | 34.3 Ų | 34.3 | 57% | 0.571 | 18% | 0.18 | S | C | * | . | H | α-helix | trans | -58.6 | -35.7 | 177.5 | -71.2 | 174.5 | 0 | 0 | 0 | 111.8 | I242 V243 | I242-L246 HydrophobicContact CG2-CD1 3.84Å; I242-L246 HydrophobicContact CG2-CG 4.14Å; I242-L246 WeakPolarHBondContact O-CG 3.4Å; I242-L246 PolarHBondContact O-N 2.75Å; V243-L246 PolarHBondContact O-N 2.68Å |
| 247 | F | 91.9 | Very high | 87.2 | Confident | 39 Ų | 39 | 35.7 Ų | 35.7 | 17% | 0.171 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -89.2 | -38.2 | -177.5 | -77.2 | -114.6 | 0 | 0 | 0 | 112.6 | V243 Y244 Y245 L285 T288 H289 I292 | V243-F247 HydrophobicContact CG1-CD2 3.85Å; V243-F247 HydrophobicContact CG1-CE2 3.82Å; V243-F247 WeakPolarHBondContact O-CD2 3.47Å; V243-F247 PolarHBondContact O-N 2.83Å; V243-F247 VanDerWaalsContact O-N 3.13Å; Y244-F247 PolarHBondContact O-N 3.1Å; Y245-F247 PolarHBondContact O-N 3.2Å; F247-L285 HydrophobicContact CD1-CD1 3.94Å; F247-L285 HydrophobicContact CD1-CG 4.25Å; F247-L285 VanDerWaalsContact CD1-O 3.32Å; F247-L285 WeakPolarHBondContact CD1-O 3.16Å; F247-L285 HydrophobicContact CE1-CD1 4.03Å; F247-L285 HydrophobicContact CG-CD1 4.47Å; F247-T288 WeakPolarHBondContact CD1-OG1 3.31Å; F247-T288 VanDerWaalsContact CE1-OG1 3.24Å; F247-T288 WeakPolarHBondContact CE1-OG1 3.4Å; F247-H289 HydrophobicContact CB-CB 3.97Å; F247-H289 HydrophobicContact CD1-CB 4.02Å; F247-H289 HydrophobicContact CG-CB 4.21Å; F247-I292 HydrophobicContact CE1-CD1 4.31Å; F247-I292 HydrophobicContact CE1-CG1 3.87Å; F247-I292 HydrophobicContact CZ-CD1 4.21Å; F247-I292 HydrophobicContact CZ-CG1 3.93Å |
| 248 | W | 91.4 | Very high | 87.8 | Confident | 10 Ų | 10 | 36.5 Ų | 36.5 | 4% | 0.038 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -103.2 | -28.2 | -171.7 | -74.1 | 109.1 | 0 | 0 | 0 | 115.3 | F79 F112 R202 Y244 P250 Y251 N252 G286 H289 | F79-W248 HydrophobicContact CE2-CH2 4.46Å; F79-W248 HydrophobicContact CZ-CH2 4.2Å; F79-W248 HydrophobicContact CZ-CZ2 4.38Å; F112-W248 AromaticContact CD2-CH2 3.65Å; F112-W248 HydrophobicContact CD2-CH2 3.65Å; F112-W248 HydrophobicContact CD2-CZ2 4.06Å; F112-W248 HydrophobicContact CD2-CZ3 4.09Å; F112-W248 HydrophobicContact CE2-CE3 4.02Å; F112-W248 AromaticContact CE2-CH2 3.34Å; F112-W248 HydrophobicContact CE2-CH2 3.34Å; F112-W248 HydrophobicContact CE2-CZ2 4.1Å; F112-W248 AromaticContact CE2-CZ3 3.31Å; F112-W248 HydrophobicContact CE2-CZ3 3.31Å; F112-W248 HydrophobicContact CZ-CZ3 4.2Å; R202-W248 VanDerWaalsContact NH1-CE3 3.35Å; R202-W248 VanDerWaalsContact NH2-CE3 3.26Å; Y244-W248 AromaticContact CD2-CD1 3.45Å; Y244-W248 VanDerWaalsContact CD2-CD1 3.45Å; Y244-W248 HydrophobicContact CD2-CG 4.28Å; Y244-W248 HydrophobicContact CE1-CB 4.43Å; Y244-W248 HydrophobicContact CE2-CB 4.18Å; Y244-W248 AromaticContact CE2-CD1 3.39Å; Y244-W248 AromaticContact CE2-CG 3.89Å; Y244-W248 HydrophobicContact CE2-CG 3.89Å; Y244-W248 WeakPolarHBondContact O-CB 3.42Å; Y244-W248 PolarHBondContact O-N 3.29Å; W248-P250 VanDerWaalsContact C-CD 3.47Å; W248-Y251 HydrophobicContact CE3-CD1 4.23Å; W248-Y251 HydrophobicContact CZ3-CD1 4.27Å; W248-Y251 PolarHBondContact O-N 2.88Å; W248-N252 PolarHBondContact O-N 3.41Å; W248-N252 VanDerWaalsContact O-N 3.1Å; W248-N252 PolarHBondContact O-ND2 3.23Å; W248-G286 VanDerWaalsContact CE2-O 3.29Å; W248-G286 VanDerWaalsContact CZ2-C 3.4Å; W248-G286 WeakPolarHBondContact CZ2-O 3.37Å; W248-H289 AromaticContact CD1-CG 3.86Å; W248-H289 AromaticContact NE1-CG 3.45Å; W248-H289 AromaticContact NE1-ND1 3.55Å |
| 249 | A | 90.8 | Very high | 88.2 | Confident | 18 Ų | 18 | 33.4 Ų | 33.4 | 15% | 0.149 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -59.7 | -41.1 | 179 | 0 | 0 | 0 | 0 | 0 | 112.8 | L203 Y245 Y251 N252 I253 | L203-A249 HydrophobicContact CD1-CB 4Å; Y245-A249 HydrophobicContact CD1-CB 4.38Å; Y245-A249 WeakPolarHBondContact O-CA 3.23Å; Y245-A249 WeakPolarHBondContact O-CB 3.44Å; Y245-A249 PolarHBondContact O-N 2.88Å; A249-Y251 VanDerWaalsContact C-N 3.31Å; A249-Y251 PolarHBondContact O-N 2.91Å; A249-N252 PolarHBondContact O-N 2.98Å; A249-I253 VanDerWaalsContact O-CG1 3.29Å; A249-I253 WeakPolarHBondContact O-CG1 3.42Å; A249-I253 PolarHBondContact O-N 3.4Å |
| 250 | P | 93.7 | Very high | 88.4 | Confident | 44 Ų | 44 | 34.4 Ų | 34.4 | 29% | 0.286 | 18% | 0.178 | S | C | . | . | H | α-helix | trans | -54.9 | -46.2 | 176.6 | -26.9 | 36 | 0 | 0 | 0 | 112.5 | Y245 W248 I253 V254 T282 L285 | Y245-P250 WeakPolarHBondContact O-CD 3.32Å; W248-P250 VanDerWaalsContact C-CD 3.47Å; P250-I253 PolarHBondContact O-N 3.26Å; P250-V254 WeakPolarHBondContact O-CG2 3.17Å; P250-V254 PolarHBondContact O-N 3.34Å; P250-T282 HydrophobicContact CB-CG2 3.6Å; P250-L285 HydrophobicContact CG-CD2 4.39Å |
| 251 | Y | 91.6 | Very high | 88.3 | Confident | 20 Ų | 20 | 36 Ų | 36 | 8% | 0.078 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -63 | -47.3 | 177.8 | 173 | -99.4 | 0 | 0 | 0 | 112.1 | F112 W248 A249 I253 V254 H255 M279 E283 | F112-Y251 HydrophobicContact CZ-CE1 4.36Å; W248-Y251 HydrophobicContact CE3-CD1 4.23Å; W248-Y251 HydrophobicContact CZ3-CD1 4.27Å; W248-Y251 PolarHBondContact O-N 2.88Å; A249-Y251 VanDerWaalsContact C-N 3.31Å; A249-Y251 PolarHBondContact O-N 2.91Å; Y251-I253 VanDerWaalsContact C-N 3.28Å; Y251-I253 PolarHBondContact O-N 3.11Å; Y251-V254 PolarHBondContact O-N 3.38Å; Y251-H255 VanDerWaalsContact O-CB 3.25Å; Y251-H255 WeakPolarHBondContact O-CB 3.43Å; Y251-H255 PolarHBondContact O-N 3.09Å; Y251-M279 HydrophobicContact CE2-CG 4.25Å; Y251-E283 HydrophobicContact CD2-CB 3.64Å; Y251-E283 HydrophobicContact CD2-CG 4.29Å; Y251-E283 HydrophobicContact CE2-CB 3.69Å; Y251-E283 HydrophobicContact CE2-CG 4Å |
| 252 | N | 90.8 | Very high | 87.7 | Confident | 1 Ų | 1 | 44 Ų | 44 | 1% | 0.005 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -62.8 | -36 | -179.1 | -69.4 | -73 | 0 | 0 | 0 | 112 | L203 W248 A249 L256 | L203-N252 HydrophobicContact CB-CB 4.46Å; L203-N252 HydrophobicContact CD2-CB 4.35Å; W248-N252 PolarHBondContact O-N 3.41Å; W248-N252 VanDerWaalsContact O-N 3.1Å; W248-N252 PolarHBondContact O-ND2 3.23Å; A249-N252 PolarHBondContact O-N 2.98Å; N252-L256 WeakPolarHBondContact O-CB 3.25Å; N252-L256 PolarHBondContact O-N 3.43Å; N252-L256 VanDerWaalsContact O-N 3.09Å |
| 253 | I | 90.9 | Very high | 87 | Confident | 89 Ų | 89 | 50.1 Ų | 50.1 | 46% | 0.456 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -67.8 | -48.3 | 176 | -66.6 | 164.8 | 0 | 0 | 0 | 110.4 | A249 P250 Y251 H255 L256 L257 | A249-I253 VanDerWaalsContact O-CG1 3.29Å; A249-I253 WeakPolarHBondContact O-CG1 3.42Å; A249-I253 PolarHBondContact O-N 3.4Å; P250-I253 PolarHBondContact O-N 3.26Å; Y251-I253 VanDerWaalsContact C-N 3.28Å; Y251-I253 PolarHBondContact O-N 3.11Å; I253-H255 VanDerWaalsContact C-N 3.34Å; I253-H255 PolarHBondContact O-N 3.14Å; I253-L256 WeakPolarHBondContact O-CB 3.25Å; I253-L256 PolarHBondContact O-N 3.26Å; I253-L257 HydrophobicContact CG2-CD1 4.24Å; I253-L257 WeakPolarHBondContact O-CG 3.5Å; I253-L257 PolarHBondContact O-N 3.3Å |
| 254 | V | 90.7 | Very high | 85.8 | Confident | 17 Ų | 17 | 51.3 Ų | 51.3 | 10% | 0.103 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -63.5 | -40.6 | 179 | 174.6 | 0 | 0 | 0 | 0 | 111.4 | P250 Y251 L256 L257 D258 L275 A278 M279 T282 | P250-V254 WeakPolarHBondContact O-CG2 3.17Å; P250-V254 PolarHBondContact O-N 3.34Å; Y251-V254 PolarHBondContact O-N 3.38Å; V254-L256 VanDerWaalsContact C-N 3.32Å; V254-L256 PolarHBondContact O-N 2.96Å; V254-L257 WeakPolarHBondContact O-CB 3.37Å; V254-L257 PolarHBondContact O-N 2.93Å; V254-D258 PolarHBondContact O-N 2.88Å; V254-L275 HydrophobicContact CG1-CD1 3.98Å; V254-L275 HydrophobicContact CG1-CG 4.24Å; V254-A278 HydrophobicContact CG1-CB 4.06Å; V254-A278 HydrophobicContact CG2-CB 4.18Å; V254-M279 HydrophobicContact CG1-CB 3.88Å; V254-T282 HydrophobicContact CG2-CG2 4.16Å |
| 255 | H | 88.5 | Confident | 84.7 | Confident | 28 Ų | 28 | 53.5 Ų | 53.5 | 13% | 0.13 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -63.9 | -36.2 | 176.9 | -169.8 | 61.8 | 0 | 0 | 0 | 112.6 | Y251 I253 D258 T259 | Y251-H255 VanDerWaalsContact O-CB 3.25Å; Y251-H255 WeakPolarHBondContact O-CB 3.43Å; Y251-H255 PolarHBondContact O-N 3.09Å; I253-H255 VanDerWaalsContact C-N 3.34Å; I253-H255 PolarHBondContact O-N 3.14Å; H255-D258 PolarHBondContact O-N 3.48Å; H255-T259 PolarHBondContact O-N 3.09Å; H255-T259 VanDerWaalsContact O-N 3.14Å; H255-T259 PolarHBondContact O-OG1 3.48Å |
| 256 | L | 89.1 | Confident | 83.6 | Confident | 63 Ų | 63 | 54.6 Ų | 54.6 | 33% | 0.33 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -64.8 | -47 | 172.2 | -173.5 | 71.5 | 0 | 0 | 0 | 111 | T195 V199 N252 I253 V254 D258 T259 F260 | T195-L256 HydrophobicContact CG2-CD1 4.28Å; V199-L256 HydrophobicContact CG2-CB 4.33Å; V199-L256 HydrophobicContact CG2-CD1 4.27Å; N252-L256 WeakPolarHBondContact O-CB 3.25Å; N252-L256 PolarHBondContact O-N 3.43Å; N252-L256 VanDerWaalsContact O-N 3.09Å; I253-L256 WeakPolarHBondContact O-CB 3.25Å; I253-L256 PolarHBondContact O-N 3.26Å; V254-L256 VanDerWaalsContact C-N 3.32Å; V254-L256 PolarHBondContact O-N 2.96Å; L256-D258 VanDerWaalsContact C-N 3.29Å; L256-D258 PolarHBondContact O-N 2.85Å; L256-T259 PolarHBondContact O-N 2.88Å; L256-F260 HydrophobicContact CD1-CD2 3.68Å; L256-F260 HydrophobicContact CD1-CE2 3.55Å; L256-F260 HydrophobicContact CG-CD2 4.14Å; L256-F260 HydrophobicContact CG-CE2 4.49Å; L256-F260 WeakPolarHBondContact O-CD2 3.49Å; L256-F260 PolarHBondContact O-N 3.4Å; L256-F260 VanDerWaalsContact O-N 3.09Å |
| 257 | L | 87.7 | Confident | 82.5 | Confident | 64 Ų | 64 | 54.8 Ų | 54.8 | 34% | 0.335 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -60.7 | -38 | 176.7 | -69.4 | 172.2 | 0 | 0 | 0 | 112.1 | I253 V254 T259 F260 Q261 L275 | I253-L257 HydrophobicContact CG2-CD1 4.24Å; I253-L257 WeakPolarHBondContact O-CG 3.5Å; I253-L257 PolarHBondContact O-N 3.3Å; V254-L257 WeakPolarHBondContact O-CB 3.37Å; V254-L257 PolarHBondContact O-N 2.93Å; L257-T259 VanDerWaalsContact C-N 3.33Å; L257-T259 PolarHBondContact O-N 3.05Å; L257-F260 CarbonylContact O-C 3.5Å; L257-F260 PolarHBondContact O-N 2.9Å; L257-Q261 WeakPolarHBondContact O-CG 3.37Å; L257-Q261 PolarHBondContact O-N 3.45Å; L257-Q261 VanDerWaalsContact O-N 3.1Å; L257-L275 HydrophobicContact CB-CD1 4.09Å; L257-L275 HydrophobicContact CB-CD2 4.48Å |
| 258 | D | 84.3 | Confident | 81.8 | Confident | 24 Ų | 24 | 57.4 Ų | 57.4 | 13% | 0.128 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -66.5 | -35.3 | 177.6 | -176.9 | 73.4 | 0 | 0 | 0 | 112.9 | K191 V254 H255 L256 Q261 L275 | K191-D258 PolarHBondContact NZ-O 2.83Å; V254-D258 PolarHBondContact O-N 2.88Å; H255-D258 PolarHBondContact O-N 3.48Å; L256-D258 VanDerWaalsContact C-N 3.29Å; L256-D258 PolarHBondContact O-N 2.85Å; D258-Q261 WeakPolarHBondContact O-CG 3.2Å; D258-Q261 PolarHBondContact OD1-NE2 3.36Å; D258-L275 HydrophobicContact CB-CD2 3.68Å; D258-L275 HydrophobicContact CB-CG 4.43Å |
| 259 | T | 84.3 | Confident | 81.1 | Confident | 8 Ų | 8 | 60.4 Ų | 60.4 | 5% | 0.049 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -73.7 | -36.4 | 178.1 | -58 | 0 | 0 | 0 | 0 | 111.9 | K191 N192 T195 H255 L256 L257 | K191-T259 HydrophobicContact CD-CG2 4.47Å; K191-T259 HydrophobicContact CG-CG2 4.21Å; N192-T259 WeakPolarHBondContact OD1-CG2 3.41Å; T195-T259 WeakPolarHBondContact CB-OG1 3.28Å; T195-T259 HydrophobicContact CG2-CG2 4.07Å; T195-T259 WeakPolarHBondContact CG2-OG1 3.03Å; T195-T259 PolarHBondContact OG1-OG1 3.38Å; H255-T259 PolarHBondContact O-N 3.09Å; H255-T259 VanDerWaalsContact O-N 3.14Å; H255-T259 PolarHBondContact O-OG1 3.48Å; L256-T259 PolarHBondContact O-N 2.88Å; L257-T259 VanDerWaalsContact C-N 3.33Å; L257-T259 PolarHBondContact O-N 3.05Å |
| 260 | F | 83.8 | Confident | 80.5 | Confident | 62 Ų | 62 | 63.2 Ų | 63.2 | 27% | 0.272 | 35% | 0.346 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -109.5 | 38.6 | -176.6 | -61.4 | -72.2 | 0 | 0 | 0 | 112.8 | L196 L256 L257 E262 F263 S264 | L196-F260 HydrophobicContact CD2-CE2 4.37Å; L196-F260 HydrophobicContact CD2-CZ 4.41Å; L256-F260 HydrophobicContact CD1-CD2 3.68Å; L256-F260 HydrophobicContact CD1-CE2 3.55Å; L256-F260 HydrophobicContact CG-CD2 4.14Å; L256-F260 HydrophobicContact CG-CE2 4.49Å; L256-F260 WeakPolarHBondContact O-CD2 3.49Å; L256-F260 PolarHBondContact O-N 3.4Å; L256-F260 VanDerWaalsContact O-N 3.09Å; L257-F260 CarbonylContact O-C 3.5Å; L257-F260 PolarHBondContact O-N 2.9Å; F260-E262 VanDerWaalsContact C-N 3.3Å; F260-E262 PolarHBondContact O-N 3.44Å; F260-F263 HydrophobicContact CB-CB 4.44Å; F260-F263 PolarHBondContact O-N 3.38Å; F260-S264 WeakPolarHBondContact O-CB 3.34Å; F260-S264 PolarHBondContact O-N 3.49Å; F260-S264 PolarHBondContact O-OG 3.36Å |
| 261 | Q | 77.3 | Confident | 79.8 | Confident | 36 Ų | 36 | 62.5 Ų | 62.5 | 17% | 0.168 | 34% | 0.342 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -57.9 | -40 | 178.9 | -77 | 174.8 | -3.5 | 0 | 0 | 112.9 | L257 D258 F263 S264 G265 L266 L275 | L257-Q261 WeakPolarHBondContact O-CG 3.37Å; L257-Q261 PolarHBondContact O-N 3.45Å; L257-Q261 VanDerWaalsContact O-N 3.1Å; D258-Q261 WeakPolarHBondContact O-CG 3.2Å; D258-Q261 PolarHBondContact OD1-NE2 3.36Å; Q261-F263 VanDerWaalsContact C-N 3.35Å; Q261-F263 PolarHBondContact O-N 2.83Å; Q261-S264 PolarHBondContact O-N 3.23Å; Q261-G265 PolarHBondContact O-N 2.97Å; Q261-L266 PolarHBondContact O-N 3.42Å; Q261-L275 HydrophobicContact CG-CD2 3.91Å; Q261-L275 VanDerWaalsContact NE2-CD2 3.27Å |
| 262 | E | 69 | Low | 79.1 | Confident | 166 Ų | 166 | 62.6 Ų | 62.6 | 78% | 0.776 | 35% | 0.346 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -62.5 | -41.7 | 179.2 | -67.2 | -177 | 175 | 0 | 0 | 111.7 | F260 | F260-E262 VanDerWaalsContact C-N 3.3Å; F260-E262 PolarHBondContact O-N 3.44Å |
| 263 | F | 71.6 | Confident | 78.6 | Confident | 194 Ų | 194 | 64.6 Ų | 64.6 | 85% | 0.851 | 36% | 0.356 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -74.2 | -28.8 | 177.9 | -166.8 | -96.3 | 0 | 0 | 0 | 112.5 | F260 Q261 G265 | F260-F263 HydrophobicContact CB-CB 4.44Å; F260-F263 PolarHBondContact O-N 3.38Å; Q261-F263 VanDerWaalsContact C-N 3.35Å; Q261-F263 PolarHBondContact O-N 2.83Å; F263-G265 VanDerWaalsContact C-N 3.33Å |
| 264 | S | 63.9 | Low | 78.2 | Confident | 52 Ų | 52 | 69.4 Ų | 69.4 | 36% | 0.364 | 37% | 0.369 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -86.5 | -1 | -178.3 | -51.5 | 0 | 0 | 0 | 0 | 113.6 | F260 Q261 L266 | F260-S264 WeakPolarHBondContact O-CB 3.34Å; F260-S264 PolarHBondContact O-N 3.49Å; F260-S264 PolarHBondContact O-OG 3.36Å; Q261-S264 PolarHBondContact O-N 3.23Å; S264-L266 VanDerWaalsContact C-N 3.28Å; S264-L266 PolarHBondContact O-N 2.99Å |
| 265 | G | 63.7 | Low | 77.9 | Confident | 51 Ų | 51 | 69.4 Ų | 69.4 | 53% | 0.526 | 37% | 0.368 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 68.9 | 22.5 | -177.4 | 0 | 0 | 0 | 0 | 0 | 114.2 | Q261 F263 | Q261-G265 PolarHBondContact O-N 2.97Å; F263-G265 VanDerWaalsContact C-N 3.33Å |
| 266 | L | 69.1 | Low | 77.5 | Confident | 51 Ų | 51 | 69.3 Ų | 69.3 | 27% | 0.267 | 37% | 0.369 | S | S | . | . | trans | -102.8 | 22 | -175.2 | -70.8 | 168.1 | 0 | 0 | 0 | 113.3 | Q261 S264 N268 S271 | Q261-L266 PolarHBondContact O-N 3.42Å; S264-L266 VanDerWaalsContact C-N 3.28Å; S264-L266 PolarHBondContact O-N 2.99Å; L266-N268 PolarHBondContact O-N 3.47Å; L266-N268 VanDerWaalsContact O-N 3.14Å; L266-S271 WeakPolarHBondContact O-CB 3.43Å | ||
| 267 | N | 67.9 | Low | 77.2 | Confident | 113 Ų | 113 | 70.5 Ų | 70.5 | 60% | 0.604 | 37% | 0.372 | S | S | * | . | trans | -73.7 | 2.1 | -173.3 | 63.8 | -14.5 | 0 | 0 | 0 | 115.5 | ||||
| 268 | N | 77.6 | Confident | 77.1 | Confident | 95 Ų | 95 | 69.1 Ų | 69.1 | 51% | 0.508 | 37% | 0.371 | S | S | . | . | S | Bend | trans | -82.2 | 143.4 | 177.1 | -65 | -36 | 0 | 0 | 0 | 111.5 | L266 S270 S271 S272 | L266-N268 PolarHBondContact O-N 3.47Å; L266-N268 VanDerWaalsContact O-N 3.14Å; N268-S270 PolarHBondContact O-N 2.92Å; N268-S271 WeakPolarHBondContact O-CB 3.45Å; N268-S271 PolarHBondContact O-N 3.36Å; N268-S272 PolarHBondContact O-N 3.02Å |
| 269 | C | 76.6 | Confident | 77.3 | Confident | 72 Ų | 72 | 70 Ų | 70 | 49% | 0.486 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -57.6 | -33.2 | -179.7 | 166.1 | 0 | 0 | 0 | 0 | 113.1 | C20 N273 | C20-C269 HydrophobicContact CB-CB 4.07Å; C20-C269 WeakPolarHBondContact CB-SG 3.42Å; C20-C269 WeakPolarHBondContact SG-CB 2.81Å; C20-C269 CovalentContact SG-SG 2.06Å; C20-C269 PolarHBondContact SG-SG 3.16Å; C269-N273 WeakPolarHBondContact O-CB 3.3Å; C269-N273 PolarHBondContact O-N 3.45Å |
| 270 | S | 77.9 | Confident | 77.3 | Confident | 77 Ų | 77 | 72.8 Ų | 72.8 | 54% | 0.538 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -66.6 | -40.4 | 174.4 | 63.5 | 0 | 0 | 0 | 0 | 112.8 | N268 R274 | N268-S270 PolarHBondContact O-N 2.92Å; S270-R274 WeakPolarHBondContact O-CG 3.29Å; S270-R274 PolarHBondContact O-N 2.91Å |
| 271 | S | 78.9 | Confident | 77.5 | Confident | 29 Ų | 29 | 74.7 Ų | 74.7 | 20% | 0.203 | 40% | 0.403 | C | S | . | . | H | α-helix | trans | -69.2 | -43.8 | 176.5 | -64.4 | 0 | 0 | 0 | 0 | 111.5 | L266 N268 N273 R274 L275 | L266-S271 WeakPolarHBondContact O-CB 3.43Å; N268-S271 WeakPolarHBondContact O-CB 3.45Å; N268-S271 PolarHBondContact O-N 3.36Å; S271-N273 PolarHBondContact O-N 2.92Å; S271-R274 PolarHBondContact O-N 2.82Å; S271-L275 WeakPolarHBondContact O-CB 3.35Å; S271-L275 PolarHBondContact O-N 3.45Å |
| 272 | S | 78.3 | Confident | 78.2 | Confident | 23 Ų | 23 | 73.8 Ų | 73.8 | 16% | 0.161 | 40% | 0.4 | C | S | . | . | H | α-helix | trans | -58.2 | -47.5 | 174.4 | 177.2 | 0 | 0 | 0 | 0 | 111.4 | N268 R274 L275 D276 | N268-S272 PolarHBondContact O-N 3.02Å; S272-R274 PolarHBondContact O-N 2.87Å; S272-L275 WeakPolarHBondContact O-CA 3.19Å; S272-L275 WeakPolarHBondContact O-CB 3.2Å; S272-L275 PolarHBondContact O-N 3.31Å; S272-D276 PolarHBondContact O-N 2.62Å |
| 273 | N | 79.5 | Confident | 79.2 | Confident | 43 Ų | 43 | 67.9 Ų | 67.9 | 23% | 0.23 | 37% | 0.372 | C | S | . | . | H | α-helix | trans | -62.4 | -39.1 | 178.6 | -169.3 | 24.8 | 0 | 0 | 0 | 112.8 | C269 S271 L275 D276 Q277 | C269-N273 WeakPolarHBondContact O-CB 3.3Å; C269-N273 PolarHBondContact O-N 3.45Å; S271-N273 PolarHBondContact O-N 2.92Å; N273-L275 VanDerWaalsContact C-N 3.3Å; N273-L275 PolarHBondContact O-N 3.18Å; N273-D276 PolarHBondContact O-N 3.09Å; N273-Q277 WeakPolarHBondContact O-CG 3.49Å; N273-Q277 PolarHBondContact O-N 3.45Å; N273-Q277 VanDerWaalsContact O-N 3.14Å |
| 274 | R | 82.6 | Confident | 80 | Confident | 190 Ų | 190 | 59.2 Ų | 59.2 | 72% | 0.717 | 34% | 0.336 | S | S | * | . | H | α-helix | trans | -64.8 | -36.3 | 173.1 | -72.6 | 179.7 | -173.5 | -154.2 | 2.5 | 111.8 | S270 S271 S272 Q277 A278 | S270-R274 WeakPolarHBondContact O-CG 3.29Å; S270-R274 PolarHBondContact O-N 2.91Å; S271-R274 PolarHBondContact O-N 2.82Å; S272-R274 PolarHBondContact O-N 2.87Å; R274-Q277 PolarHBondContact O-N 3.22Å; R274-A278 WeakPolarHBondContact O-CB 3.34Å; R274-A278 PolarHBondContact O-N 2.92Å |
| 275 | L | 83.6 | Confident | 81.3 | Confident | 17 Ų | 17 | 60 Ų | 60 | 9% | 0.089 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -71 | -38.5 | 179.2 | -161 | 71.8 | 0 | 0 | 0 | 111.8 | V254 L257 D258 Q261 S271 S272 N273 Q277 A278 M279 | V254-L275 HydrophobicContact CG1-CD1 3.98Å; V254-L275 HydrophobicContact CG1-CG 4.24Å; L257-L275 HydrophobicContact CB-CD1 4.09Å; L257-L275 HydrophobicContact CB-CD2 4.48Å; D258-L275 HydrophobicContact CB-CD2 3.68Å; D258-L275 HydrophobicContact CB-CG 4.43Å; Q261-L275 HydrophobicContact CG-CD2 3.91Å; Q261-L275 VanDerWaalsContact NE2-CD2 3.27Å; S271-L275 WeakPolarHBondContact O-CB 3.35Å; S271-L275 PolarHBondContact O-N 3.45Å; S272-L275 WeakPolarHBondContact O-CA 3.19Å; S272-L275 WeakPolarHBondContact O-CB 3.2Å; S272-L275 PolarHBondContact O-N 3.31Å; N273-L275 VanDerWaalsContact C-N 3.3Å; N273-L275 PolarHBondContact O-N 3.18Å; L275-Q277 VanDerWaalsContact C-N 3.33Å; L275-Q277 PolarHBondContact O-N 2.83Å; L275-A278 CarbonylContact O-C 3.6Å; L275-A278 PolarHBondContact O-N 3.41Å; L275-M279 WeakPolarHBondContact O-CB 3.34Å; L275-M279 PolarHBondContact O-N 3.44Å |
| 276 | D | 80.4 | Confident | 82.6 | Confident | 26 Ų | 26 | 57.5 Ų | 57.5 | 14% | 0.139 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -61.8 | -42.1 | 172.4 | -63.1 | -65.7 | 0 | 0 | 0 | 111.8 | K22 S272 N273 M279 Q280 | K22-D276 WeakPolarHBondContact CD-OD2 3.31Å; K22-D276 WeakPolarHBondContact CE-OD2 3.23Å; K22-D276 IonicContact NZ-OD1 2.78Å; K22-D276 PolarHBondContact NZ-OD1 3.49Å; K22-D276 IonicContact NZ-OD2 2.77Å; K22-D276 PolarHBondContact NZ-OD2 3.34Å; S272-D276 PolarHBondContact O-N 2.62Å; N273-D276 PolarHBondContact O-N 3.09Å; D276-M279 PolarHBondContact O-N 3.45Å; D276-Q280 WeakPolarHBondContact O-CB 3.33Å; D276-Q280 PolarHBondContact O-N 3.46Å |
| 277 | Q | 82.4 | Confident | 83.5 | Confident | 87 Ų | 87 | 55.4 Ų | 55.4 | 41% | 0.407 | 30% | 0.299 | S | S | . | . | H | α-helix | trans | -60.3 | -47.1 | 174.2 | -71.5 | 174.1 | 5.9 | 0 | 0 | 111 | V25 N273 R274 L275 M279 Q280 V281 | V25-Q277 HydrophobicContact CB-CG 4.31Å; V25-Q277 HydrophobicContact CG1-CG 3.82Å; V25-Q277 HydrophobicContact CG2-CG 3.45Å; V25-Q277 VanDerWaalsContact CG2-CG 3.45Å; N273-Q277 WeakPolarHBondContact O-CG 3.49Å; N273-Q277 PolarHBondContact O-N 3.45Å; N273-Q277 VanDerWaalsContact O-N 3.14Å; R274-Q277 PolarHBondContact O-N 3.22Å; L275-Q277 VanDerWaalsContact C-N 3.33Å; L275-Q277 PolarHBondContact O-N 2.83Å; Q277-M279 VanDerWaalsContact C-N 3.29Å; Q277-M279 PolarHBondContact O-N 3.08Å; Q277-Q280 PolarHBondContact O-N 2.69Å; Q277-V281 VanDerWaalsContact O-CG2 3.32Å; Q277-V281 WeakPolarHBondContact O-CG2 3.45Å; Q277-V281 PolarHBondContact O-N 3.32Å |
| 278 | A | 87.4 | Confident | 84.5 | Confident | 36 Ų | 36 | 51 Ų | 51 | 30% | 0.298 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -60.6 | -40.3 | 176 | 0 | 0 | 0 | 0 | 0 | 111.3 | V254 R274 L275 V281 T282 | V254-A278 HydrophobicContact CG1-CB 4.06Å; V254-A278 HydrophobicContact CG2-CB 4.18Å; R274-A278 WeakPolarHBondContact O-CB 3.34Å; R274-A278 PolarHBondContact O-N 2.92Å; L275-A278 CarbonylContact O-C 3.6Å; L275-A278 PolarHBondContact O-N 3.41Å; A278-V281 PolarHBondContact O-N 3.4Å; A278-T282 VanDerWaalsContact O-CB 3.31Å; A278-T282 WeakPolarHBondContact O-CB 3.45Å; A278-T282 VanDerWaalsContact O-CG2 3.24Å; A278-T282 WeakPolarHBondContact O-CG2 3.38Å; A278-T282 PolarHBondContact O-N 3.01Å; A278-T282 PolarHBondContact O-OG1 3.41Å |
| 279 | M | 86.8 | Confident | 85.1 | Confident | 42 Ų | 42 | 47 Ų | 47 | 21% | 0.207 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -64.2 | -47 | 178.7 | -171.6 | 162.7 | 63.2 | 0 | 0 | 110.6 | Y251 V254 L275 D276 Q277 V281 T282 E283 | Y251-M279 HydrophobicContact CE2-CG 4.25Å; V254-M279 HydrophobicContact CG1-CB 3.88Å; L275-M279 WeakPolarHBondContact O-CB 3.34Å; L275-M279 PolarHBondContact O-N 3.44Å; D276-M279 PolarHBondContact O-N 3.45Å; Q277-M279 VanDerWaalsContact C-N 3.29Å; Q277-M279 PolarHBondContact O-N 3.08Å; M279-V281 PolarHBondContact O-N 2.92Å; M279-T282 PolarHBondContact O-N 3.35Å; M279-T282 PolarHBondContact O-OG1 3.03Å; M279-E283 WeakPolarHBondContact O-CB 3.29Å; M279-E283 PolarHBondContact O-N 2.86Å |
| 280 | Q | 85.4 | Confident | 85.7 | Confident | 66 Ų | 66 | 43.7 Ų | 43.7 | 31% | 0.308 | 23% | 0.232 | S | C | . | . | H | α-helix | trans | -60.5 | -45.7 | 177.5 | -168.7 | 69.4 | 57 | 0 | 0 | 112.1 | A29 L33 D276 Q277 T284 | A29-Q280 HydrophobicContact CB-CG 4.47Å; L33-Q280 HydrophobicContact CD1-CG 4.37Å; L33-Q280 VanDerWaalsContact CD1-NE2 3.26Å; D276-Q280 WeakPolarHBondContact O-CB 3.33Å; D276-Q280 PolarHBondContact O-N 3.46Å; Q277-Q280 PolarHBondContact O-N 2.69Å; Q280-T284 VanDerWaalsContact O-CB 3.28Å; Q280-T284 WeakPolarHBondContact O-CB 3.35Å; Q280-T284 PolarHBondContact O-N 2.86Å; Q280-T284 PolarHBondContact O-OG1 3Å |
| 281 | V | 88.3 | Confident | 86.2 | Confident | 102 Ų | 102 | 40.8 Ų | 40.8 | 62% | 0.618 | 21% | 0.212 | S | C | * | . | H | α-helix | trans | -67 | -46.6 | -179.5 | 171.3 | 0 | 0 | 0 | 0 | 111 | Q277 A278 M279 T284 L285 | Q277-V281 VanDerWaalsContact O-CG2 3.32Å; Q277-V281 WeakPolarHBondContact O-CG2 3.45Å; Q277-V281 PolarHBondContact O-N 3.32Å; A278-V281 PolarHBondContact O-N 3.4Å; M279-V281 PolarHBondContact O-N 2.92Å; V281-T284 WeakPolarHBondContact O-CB 3.41Å; V281-T284 PolarHBondContact O-N 3.1Å; V281-L285 PolarHBondContact O-N 3.49Å |
| 282 | T | 91.9 | Very high | 86.6 | Confident | 17 Ų | 17 | 41.1 Ų | 41.1 | 10% | 0.104 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -71.3 | -34 | -178.5 | 55.6 | 0 | 0 | 0 | 0 | 112.6 | P250 V254 A278 M279 L285 G286 | P250-T282 HydrophobicContact CB-CG2 3.6Å; V254-T282 HydrophobicContact CG2-CG2 4.16Å; A278-T282 VanDerWaalsContact O-CB 3.31Å; A278-T282 WeakPolarHBondContact O-CB 3.45Å; A278-T282 VanDerWaalsContact O-CG2 3.24Å; A278-T282 WeakPolarHBondContact O-CG2 3.38Å; A278-T282 PolarHBondContact O-N 3.01Å; A278-T282 PolarHBondContact O-OG1 3.41Å; M279-T282 PolarHBondContact O-N 3.35Å; M279-T282 PolarHBondContact O-OG1 3.03Å; T282-L285 PolarHBondContact O-N 3.25Å; T282-G286 PolarHBondContact O-N 3.01Å |
| 283 | E | 89.4 | Confident | 86.9 | Confident | 42 Ų | 42 | 40 Ų | 40 | 20% | 0.196 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -63 | -46.8 | 171.1 | -177.1 | 173.1 | -158.7 | 0 | 0 | 110.6 | Y108 Y251 M279 L285 G286 M287 | Y108-E283 PolarHBondContact OH-OE1 3.5Å; Y251-E283 HydrophobicContact CD2-CB 3.64Å; Y251-E283 HydrophobicContact CD2-CG 4.29Å; Y251-E283 HydrophobicContact CE2-CB 3.69Å; Y251-E283 HydrophobicContact CE2-CG 4Å; M279-E283 WeakPolarHBondContact O-CB 3.29Å; M279-E283 PolarHBondContact O-N 2.86Å; E283-L285 VanDerWaalsContact C-N 3.32Å; E283-L285 PolarHBondContact O-N 3.36Å; E283-G286 CarbonylContact O-C 3.4Å; E283-G286 WeakPolarHBondContact O-CA 3.32Å; E283-G286 PolarHBondContact O-N 3.17Å; E283-G286 VanDerWaalsContact O-N 3.08Å; E283-M287 HydrophobicContact CG-CE 4.03Å; E283-M287 HydrophobicContact CG-CG 4.47Å; E283-M287 WeakPolarHBondContact O-CG 3.24Å; E283-M287 PolarHBondContact O-N 2.84Å |
| 284 | T | 88.4 | Confident | 87.1 | Confident | 13 Ų | 13 | 38.5 Ų | 38.5 | 8% | 0.08 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -59.4 | -43.3 | 177.2 | -61.1 | 0 | 0 | 0 | 0 | 111.5 | L33 L36 Y37 Q280 V281 M287 T288 | L33-T284 HydrophobicContact CD2-CG2 3.72Å; L33-T284 WeakPolarHBondContact CD2-OG1 3.24Å; L36-T284 HydrophobicContact CD2-CG2 3.34Å; Y37-T284 HydrophobicContact CE1-CG2 4.03Å; Y37-T284 PolarHBondContact OH-OG1 3.32Å; Q280-T284 VanDerWaalsContact O-CB 3.28Å; Q280-T284 WeakPolarHBondContact O-CB 3.35Å; Q280-T284 PolarHBondContact O-N 2.86Å; Q280-T284 PolarHBondContact O-OG1 3Å; V281-T284 WeakPolarHBondContact O-CB 3.41Å; V281-T284 PolarHBondContact O-N 3.1Å; T284-M287 PolarHBondContact O-N 3.01Å; T284-T288 WeakPolarHBondContact O-CG2 3.43Å; T284-T288 PolarHBondContact O-N 3.2Å |
| 285 | L | 91.9 | Very high | 87.2 | Confident | 67 Ų | 67 | 33.2 Ų | 33.2 | 35% | 0.351 | 18% | 0.181 | S | C | . | . | H | α-helix | trans | -57.4 | -51 | 171.7 | 179.6 | 65.2 | 0 | 0 | 0 | 110.4 | F247 P250 V281 T282 E283 M287 T288 | F247-L285 HydrophobicContact CD1-CD1 3.94Å; F247-L285 HydrophobicContact CD1-CG 4.25Å; F247-L285 VanDerWaalsContact CD1-O 3.32Å; F247-L285 WeakPolarHBondContact CD1-O 3.16Å; F247-L285 HydrophobicContact CE1-CD1 4.03Å; F247-L285 HydrophobicContact CG-CD1 4.47Å; P250-L285 HydrophobicContact CG-CD2 4.39Å; V281-L285 PolarHBondContact O-N 3.49Å; T282-L285 PolarHBondContact O-N 3.25Å; E283-L285 VanDerWaalsContact C-N 3.32Å; E283-L285 PolarHBondContact O-N 3.36Å; L285-M287 VanDerWaalsContact C-N 3.31Å; L285-M287 PolarHBondContact O-N 3.16Å; L285-T288 PolarHBondContact O-N 2.94Å; L285-T288 VanDerWaalsContact O-N 3.09Å; L285-T288 PolarHBondContact O-OG1 3.35Å |
| 286 | G | 90.8 | Very high | 87 | Confident | 0 Ų | 0 | 33 Ų | 33 | 0% | 0 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -54.2 | -44.5 | 175.3 | 0 | 0 | 0 | 0 | 0 | 113.1 | W248 T282 E283 T288 H289 | W248-G286 VanDerWaalsContact CE2-O 3.29Å; W248-G286 VanDerWaalsContact CZ2-C 3.4Å; W248-G286 WeakPolarHBondContact CZ2-O 3.37Å; T282-G286 PolarHBondContact O-N 3.01Å; E283-G286 CarbonylContact O-C 3.4Å; E283-G286 WeakPolarHBondContact O-CA 3.32Å; E283-G286 PolarHBondContact O-N 3.17Å; E283-G286 VanDerWaalsContact O-N 3.08Å; G286-T288 VanDerWaalsContact C-N 3.27Å; G286-T288 PolarHBondContact O-N 3.26Å; G286-H289 WeakPolarHBondContact O-CB 3.32Å; G286-H289 PolarHBondContact O-N 3.15Å |
| 287 | M | 86.8 | Confident | 86.9 | Confident | 6 Ų | 6 | 32.3 Ų | 32.3 | 3% | 0.03 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -59.5 | -36.4 | 178 | -67.8 | -159.9 | -179.8 | 0 | 0 | 112.5 | Y37 F79 Y108 E283 T284 L285 H289 C290 | Y37-M287 HydrophobicContact CD1-SD 4.38Å; Y37-M287 HydrophobicContact CE1-CB 4.32Å; Y37-M287 HydrophobicContact CE1-CG 4.48Å; Y37-M287 HydrophobicContact CE1-SD 3.57Å; Y37-M287 VanDerWaalsContact CE1-SD 3.57Å; Y37-M287 HydrophobicContact CE2-SD 3.93Å; Y37-M287 PolarHBondContact OH-SD 3.26Å; F79-M287 HydrophobicContact CE1-CB 4.16Å; F79-M287 HydrophobicContact CE1-CG 4.21Å; F79-M287 HydrophobicContact CZ-CB 4.32Å; F79-M287 HydrophobicContact CZ-CG 3.93Å; Y108-M287 HydrophobicContact CE2-CE 4.03Å; E283-M287 HydrophobicContact CG-CE 4.03Å; E283-M287 HydrophobicContact CG-CG 4.47Å; E283-M287 WeakPolarHBondContact O-CG 3.24Å; E283-M287 PolarHBondContact O-N 2.84Å; T284-M287 PolarHBondContact O-N 3.01Å; L285-M287 VanDerWaalsContact C-N 3.31Å; L285-M287 PolarHBondContact O-N 3.16Å; M287-H289 PolarHBondContact O-N 3.42Å; M287-C290 PolarHBondContact O-SG 3.36Å |
| 288 | T | 89.9 | Confident | 86.5 | Confident | 22 Ų | 22 | 29.6 Ų | 29.6 | 14% | 0.135 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -65.7 | -19.9 | 178 | 65.6 | 0 | 0 | 0 | 0 | 113.1 | V40 F247 T284 L285 G286 C290 C291 | V40-T288 HydrophobicContact CG2-CG2 3.65Å; F247-T288 WeakPolarHBondContact CD1-OG1 3.31Å; F247-T288 VanDerWaalsContact CE1-OG1 3.24Å; F247-T288 WeakPolarHBondContact CE1-OG1 3.4Å; T284-T288 WeakPolarHBondContact O-CG2 3.43Å; T284-T288 PolarHBondContact O-N 3.2Å; L285-T288 PolarHBondContact O-N 2.94Å; L285-T288 VanDerWaalsContact O-N 3.09Å; L285-T288 PolarHBondContact O-OG1 3.35Å; G286-T288 VanDerWaalsContact C-N 3.27Å; G286-T288 PolarHBondContact O-N 3.26Å; T288-C290 PolarHBondContact O-N 2.75Å; T288-C290 VanDerWaalsContact O-N 3.14Å; T288-C291 PolarHBondContact O-N 3.1Å; T288-C291 PolarHBondContact O-SG 2.81Å |
| 289 | H | 91 | Very high | 85.7 | Confident | 9 Ų | 9 | 35.9 Ų | 35.9 | 4% | 0.042 | 19% | 0.188 | C | C | . | . | G | 310 helix | trans | -55.1 | -35.1 | 179.8 | 177.7 | -93.8 | 0 | 0 | 0 | 113.4 | Y244 F247 W248 G286 M287 C291 I292 | Y244-H289 WeakPolarHBondContact CA-NE2 3.37Å; Y244-H289 AromaticContact CD2-CE1 4Å; F247-H289 HydrophobicContact CB-CB 3.97Å; F247-H289 HydrophobicContact CD1-CB 4.02Å; F247-H289 HydrophobicContact CG-CB 4.21Å; W248-H289 AromaticContact CD1-CG 3.86Å; W248-H289 AromaticContact NE1-CG 3.45Å; W248-H289 AromaticContact NE1-ND1 3.55Å; G286-H289 WeakPolarHBondContact O-CB 3.32Å; G286-H289 PolarHBondContact O-N 3.15Å; M287-H289 PolarHBondContact O-N 3.42Å; H289-C291 PolarHBondContact O-N 3.29Å; H289-C291 VanDerWaalsContact O-N 3.11Å; H289-I292 WeakPolarHBondContact O-CB 3.5Å; H289-I292 PolarHBondContact O-N 3.26Å |
| 290 | C | 87.8 | Confident | 84.7 | Confident | 4 Ų | 4 | 36.9 Ų | 36.9 | 3% | 0.027 | 20% | 0.197 | C | C | . | . | G | 310 helix | trans | -62.2 | -20.4 | -176.2 | 65.6 | 0 | 0 | 0 | 0 | 114 | N48 D76 F79 L80 M287 T288 | N48-C290 PolarHBondContact ND2-O 3.49Å; D76-C290 HydrophobicContact CB-CB 4.39Å; F79-C290 HydrophobicContact CD1-CB 3.99Å; L80-C290 WeakPolarHBondContact CD2-SG 3.4Å; L80-C290 HydrophobicContact CG-CB 4.31Å; M287-C290 PolarHBondContact O-SG 3.36Å; T288-C290 PolarHBondContact O-N 2.75Å; T288-C290 VanDerWaalsContact O-N 3.14Å |
| 291 | C | 88.3 | Confident | 83.8 | Confident | 16 Ų | 16 | 34.2 Ų | 34.2 | 11% | 0.108 | 19% | 0.187 | C | C | . | . | G | 310 helix | trans | -94.6 | -8 | 174.3 | 73 | 0 | 0 | 0 | 0 | 113.8 | F43 T288 H289 | F43-C291 HydrophobicContact CB-CB 4.34Å; T288-C291 PolarHBondContact O-N 3.1Å; T288-C291 PolarHBondContact O-SG 2.81Å; H289-C291 PolarHBondContact O-N 3.29Å; H289-C291 VanDerWaalsContact O-N 3.11Å |
| 292 | I | 87.7 | Confident | 82.9 | Confident | 35 Ų | 35 | 33.6 Ų | 33.6 | 18% | 0.179 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -82.2 | -29.9 | -177 | -53.6 | -59.6 | 0 | 0 | 0 | 111.9 | V243 F247 H289 I295 I296 | V243-I292 HydrophobicContact CG1-CG2 3.73Å; F247-I292 HydrophobicContact CE1-CD1 4.31Å; F247-I292 HydrophobicContact CE1-CG1 3.87Å; F247-I292 HydrophobicContact CZ-CD1 4.21Å; F247-I292 HydrophobicContact CZ-CG1 3.93Å; H289-I292 WeakPolarHBondContact O-CB 3.5Å; H289-I292 PolarHBondContact O-N 3.26Å; I292-I295 HydrophobicContact CD1-CD1 4.22Å; I292-I295 WeakPolarHBondContact O-CA 3.36Å; I292-I295 WeakPolarHBondContact O-CB 3.28Å; I292-I295 PolarHBondContact O-N 3.46Å; I292-I296 HydrophobicContact CG2-CD1 3.93Å; I292-I296 HydrophobicContact CG2-CG1 3.95Å; I292-I296 WeakPolarHBondContact O-CG1 3.44Å; I292-I296 PolarHBondContact O-N 2.88Å |
| 293 | N | 84.7 | Confident | 81.7 | Confident | 0 Ų | 0 | 40.3 Ų | 40.3 | 0% | 0 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -54.7 | -50.8 | -179.6 | -74.3 | -28.6 | 0 | 0 | 0 | 113.1 | D76 I295 I296 Y297 | D76-N293 PolarHBondContact OD2-ND2 2.89Å; N293-I295 VanDerWaalsContact C-N 3.3Å; N293-I295 PolarHBondContact O-N 3.36Å; N293-I296 PolarHBondContact O-N 3.42Å; N293-Y297 HydrophobicContact CB-CE2 4.28Å; N293-Y297 VanDerWaalsContact O-CD2 3.24Å; N293-Y297 WeakPolarHBondContact O-CD2 3.37Å; N293-Y297 VanDerWaalsContact O-CG 3.26Å; N293-Y297 PolarHBondContact O-N 3.24Å; N293-Y297 VanDerWaalsContact O-N 3.09Å |
| 294 | P | 84.8 | Confident | 80.7 | Confident | 12 Ų | 12 | 39.3 Ų | 39.3 | 8% | 0.078 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -59 | -36.8 | 173.7 | -25.3 | 34.5 | 0 | 0 | 0 | 114.1 | G47 V51 Y297 A298 | G47-P294 VanDerWaalsContact C-CG 3.42Å; V51-P294 HydrophobicContact CG2-CB 4.02Å; V51-P294 HydrophobicContact CG2-CG 4.14Å; P294-Y297 PolarHBondContact O-N 2.69Å; P294-A298 PolarHBondContact O-N 3Å |
| 295 | I | 83.3 | Confident | 80.1 | Confident | 78 Ų | 78 | 44.7 Ų | 44.7 | 40% | 0.4 | 22% | 0.219 | S | C | . | . | H | α-helix | trans | -63.3 | -48.5 | 177.7 | -63.5 | 175.8 | 0 | 0 | 0 | 109.3 | I292 N293 Y297 A298 F299 | I292-I295 HydrophobicContact CD1-CD1 4.22Å; I292-I295 WeakPolarHBondContact O-CA 3.36Å; I292-I295 WeakPolarHBondContact O-CB 3.28Å; I292-I295 PolarHBondContact O-N 3.46Å; N293-I295 VanDerWaalsContact C-N 3.3Å; N293-I295 PolarHBondContact O-N 3.36Å; I295-Y297 VanDerWaalsContact C-N 3.26Å; I295-Y297 PolarHBondContact O-N 2.89Å; I295-A298 PolarHBondContact O-N 2.61Å; I295-A298 VanDerWaalsContact O-N 3.1Å; I295-F299 HydrophobicContact CG2-CD2 3.59Å; I295-F299 HydrophobicContact CG2-CE2 3.76Å; I295-F299 VanDerWaalsContact O-CD2 3.23Å; I295-F299 WeakPolarHBondContact O-CD2 3.18Å; I295-F299 PolarHBondContact O-N 2.9Å |
| 296 | I | 80.9 | Confident | 79.4 | Confident | 13 Ų | 13 | 45.9 Ų | 45.9 | 7% | 0.067 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -56.7 | -43.6 | 176.2 | -64 | 169.6 | 0 | 0 | 0 | 110.4 | L236 I240 V243 I292 N293 A298 F299 V300 | L236-I296 HydrophobicContact CD1-CG2 3.9Å; I240-I296 HydrophobicContact CG1-CD1 4.26Å; I240-I296 HydrophobicContact CG1-CG2 3.77Å; V243-I296 HydrophobicContact CB-CD1 3.97Å; V243-I296 HydrophobicContact CG1-CD1 3.99Å; V243-I296 HydrophobicContact CG2-CD1 4.03Å; I292-I296 HydrophobicContact CG2-CD1 3.93Å; I292-I296 HydrophobicContact CG2-CG1 3.95Å; I292-I296 WeakPolarHBondContact O-CG1 3.44Å; I292-I296 PolarHBondContact O-N 2.88Å; N293-I296 PolarHBondContact O-N 3.42Å; I296-A298 PolarHBondContact O-N 2.98Å; I296-F299 PolarHBondContact O-N 3.42Å; I296-V300 HydrophobicContact CG2-CB 4.26Å; I296-V300 HydrophobicContact CG2-CG2 4.04Å; I296-V300 WeakPolarHBondContact O-CA 3.37Å; I296-V300 VanDerWaalsContact O-CB 3.24Å; I296-V300 WeakPolarHBondContact O-CB 3.39Å; I296-V300 PolarHBondContact O-N 3.49Å |
| 297 | Y | 78.4 | Confident | 78.6 | Confident | 11 Ų | 11 | 49.8 Ų | 49.8 | 4% | 0.043 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -64.4 | -39 | 178.4 | -55 | -31.5 | 0 | 0 | 0 | 112.9 | V51 L69 L72 L236 I240 N293 P294 I295 G301 F304 | V51-Y297 HydrophobicContact CG1-CD2 4.29Å; V51-Y297 HydrophobicContact CG1-CE2 4.2Å; V51-Y297 HydrophobicContact CG2-CD2 3.77Å; V51-Y297 HydrophobicContact CG2-CE2 4.22Å; L69-Y297 HydrophobicContact CD2-CE1 3.96Å; L69-Y297 WeakPolarHBondContact CD2-OH 3.37Å; L72-Y297 WeakPolarHBondContact CD2-OH 3.22Å; L236-Y297 HydrophobicContact CD1-CD1 4.49Å; I240-Y297 HydrophobicContact CD1-CD1 4.48Å; I240-Y297 HydrophobicContact CD1-CE1 3.67Å; I240-Y297 HydrophobicContact CG1-CE1 4.41Å; N293-Y297 HydrophobicContact CB-CE2 4.28Å; N293-Y297 VanDerWaalsContact O-CD2 3.24Å; N293-Y297 WeakPolarHBondContact O-CD2 3.37Å; N293-Y297 VanDerWaalsContact O-CG 3.26Å; N293-Y297 PolarHBondContact O-N 3.24Å; N293-Y297 VanDerWaalsContact O-N 3.09Å; P294-Y297 PolarHBondContact O-N 2.69Å; I295-Y297 VanDerWaalsContact C-N 3.26Å; I295-Y297 PolarHBondContact O-N 2.89Å; Y297-G301 VanDerWaalsContact O-CA 3.24Å; Y297-G301 WeakPolarHBondContact O-CA 3.24Å; Y297-G301 PolarHBondContact O-N 3.02Å; Y297-F304 WeakPolarHBondContact O-CD1 3.39Å |
| 298 | A | 73.6 | Confident | 78.1 | Confident | 30 Ų | 30 | 50.7 Ų | 50.7 | 25% | 0.248 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -67.5 | -39.7 | 179.2 | 0 | 0 | 0 | 0 | 0 | 112.9 | P294 I295 I296 L308 | P294-A298 PolarHBondContact O-N 3Å; I295-A298 PolarHBondContact O-N 2.61Å; I295-A298 VanDerWaalsContact O-N 3.1Å; I296-A298 PolarHBondContact O-N 2.98Å; A298-L308 HydrophobicContact CB-CD1 4.13Å |
| 299 | F | 70 | Confident | 77.5 | Confident | 168 Ų | 168 | 54 Ų | 54 | 74% | 0.737 | 26% | 0.263 | S | S | * | . | H | α-helix | trans | -91 | -39.3 | -175.6 | -72.7 | -74.9 | 0 | 0 | 0 | 113.7 | I295 I296 | I295-F299 HydrophobicContact CG2-CD2 3.59Å; I295-F299 HydrophobicContact CG2-CE2 3.76Å; I295-F299 VanDerWaalsContact O-CD2 3.23Å; I295-F299 WeakPolarHBondContact O-CD2 3.18Å; I295-F299 PolarHBondContact O-N 2.9Å; I296-F299 PolarHBondContact O-N 3.42Å |
| 300 | V | 66.3 | Low | 76.9 | Confident | 64 Ų | 64 | 57.3 Ų | 57.3 | 39% | 0.388 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -95.5 | -26.2 | -175.2 | -172.1 | 0 | 0 | 0 | 0 | 111.6 | L236 I296 E302 | L236-V300 HydrophobicContact CB-CG1 4.14Å; L236-V300 HydrophobicContact CD1-CB 3.64Å; L236-V300 HydrophobicContact CD1-CG1 3.61Å; I296-V300 HydrophobicContact CG2-CB 4.26Å; I296-V300 HydrophobicContact CG2-CG2 4.04Å; I296-V300 WeakPolarHBondContact O-CA 3.37Å; I296-V300 VanDerWaalsContact O-CB 3.24Å; I296-V300 WeakPolarHBondContact O-CB 3.39Å; I296-V300 PolarHBondContact O-N 3.49Å; V300-E302 PolarHBondContact O-N 3.49Å |
| 301 | G | 66.8 | Low | 76.4 | Confident | 10 Ų | 10 | 58.2 Ų | 58.2 | 10% | 0.103 | 29% | 0.286 | C | S | . | . | trans | -92.7 | 89 | -177.6 | 0 | 0 | 0 | 0 | 0 | 114.1 | Y297 K303 F304 R305 | Y297-G301 VanDerWaalsContact O-CA 3.24Å; Y297-G301 WeakPolarHBondContact O-CA 3.24Å; Y297-G301 PolarHBondContact O-N 3.02Å; G301-K303 PolarHBondContact O-N 2.97Å; G301-K303 VanDerWaalsContact O-N 3.14Å; G301-F304 WeakPolarHBondContact O-CA 3.29Å; G301-F304 WeakPolarHBondContact O-CB 3.27Å; G301-F304 PolarHBondContact O-N 3.45Å; G301-R305 PolarHBondContact O-N 3.14Å | ||
| 302 | E | 67.8 | Low | 75.9 | Confident | 88 Ų | 88 | 61.7 Ų | 61.7 | 41% | 0.411 | 30% | 0.3 | S | S | . | . | H | α-helix | trans | -51.4 | -41.1 | 176.4 | -73 | 179.4 | 163.4 | 0 | 0 | 113.6 | R232 V300 R305 N306 | R232-E302 IonicContact CZ-OE1 3.32Å; R232-E302 IonicContact CZ-OE2 2.98Å; R232-E302 IonicContact NE-OE1 3.86Å; R232-E302 IonicContact NH1-OE1 3.78Å; R232-E302 PolarHBondContact NH1-OE1 2.78Å; R232-E302 IonicContact NH1-OE2 3.98Å; R232-E302 PolarHBondContact NH1-OE2 3.25Å; R232-E302 IonicContact NH2-OE1 3.87Å; V300-E302 PolarHBondContact O-N 3.49Å; E302-R305 PolarHBondContact O-N 2.97Å; E302-N306 PolarHBondContact O-N 3.37Å; E302-N306 VanDerWaalsContact O-N 3.13Å |
| 303 | K | 68.3 | Low | 75.4 | Confident | 159 Ų | 159 | 66.1 Ų | 66.1 | 69% | 0.691 | 32% | 0.32 | S | S | * | . | H | α-helix | trans | -64.4 | -42.6 | 176.6 | -69.7 | -175.5 | 179.4 | -179.4 | 0 | 111.6 | G301 N306 Y307 | G301-K303 PolarHBondContact O-N 2.97Å; G301-K303 VanDerWaalsContact O-N 3.14Å; K303-N306 PolarHBondContact O-N 3.48Å; K303-Y307 HydrophobicContact CB-CE2 4.43Å; K303-Y307 WeakPolarHBondContact O-CD2 3.49Å; K303-Y307 PolarHBondContact O-N 3.23Å; K303-Y307 VanDerWaalsContact O-N 3.11Å |
| 304 | F | 67.8 | Low | 74.8 | Confident | 20 Ų | 20 | 72.7 Ų | 72.7 | 9% | 0.088 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -66 | -43.2 | -179.8 | -174 | -99.8 | 0 | 0 | 0 | 110.5 | V51 I54 Y297 G301 N306 Y307 L308 | V51-F304 HydrophobicContact CB-CZ 4.41Å; V51-F304 HydrophobicContact CG2-CE2 4.12Å; V51-F304 HydrophobicContact CG2-CZ 3.67Å; I54-F304 HydrophobicContact CB-CE2 4.08Å; I54-F304 HydrophobicContact CD1-CE1 4.36Å; I54-F304 HydrophobicContact CD1-CE2 3.73Å; I54-F304 HydrophobicContact CD1-CZ 3.64Å; I54-F304 HydrophobicContact CG2-CD2 4.06Å; I54-F304 HydrophobicContact CG2-CE2 3.85Å; Y297-F304 WeakPolarHBondContact O-CD1 3.39Å; G301-F304 WeakPolarHBondContact O-CA 3.29Å; G301-F304 WeakPolarHBondContact O-CB 3.27Å; G301-F304 PolarHBondContact O-N 3.45Å; F304-N306 VanDerWaalsContact C-N 3.33Å; F304-N306 PolarHBondContact O-N 3.14Å; F304-Y307 PolarHBondContact O-N 3.38Å; F304-Y307 VanDerWaalsContact O-N 3.14Å; F304-L308 HydrophobicContact CD1-CD1 3.63Å; F304-L308 HydrophobicContact CD1-CG 4.39Å; F304-L308 HydrophobicContact CE1-CD1 3.35Å; F304-L308 HydrophobicContact CE1-CG 4.03Å; F304-L308 HydrophobicContact CZ-CD1 4.29Å; F304-L308 WeakPolarHBondContact O-CB 3.28Å; F304-L308 PolarHBondContact O-N 3.18Å |
| 305 | R | 75.4 | Confident | 74 | Confident | 127 Ų | 127 | 76.3 Ų | 76.3 | 48% | 0.479 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -55.7 | -44.3 | 173.5 | -170.3 | 176.6 | 69.2 | -169.2 | 1.4 | 112.7 | G301 E302 L308 L309 | G301-R305 PolarHBondContact O-N 3.14Å; E302-R305 PolarHBondContact O-N 2.97Å; R305-L308 VanDerWaalsContact O-CB 3.23Å; R305-L308 WeakPolarHBondContact O-CB 2.92Å; R305-L308 PolarHBondContact O-N 3.5Å; R305-L309 WeakPolarHBondContact O-CG 3.48Å; R305-L309 PolarHBondContact O-N 3.41Å |
| 306 | N | 76.6 | Confident | 73.3 | Confident | 92 Ų | 92 | 75.5 Ų | 75.5 | 49% | 0.492 | 36% | 0.36 | S | S | . | . | H | α-helix | trans | -64.6 | -40.5 | 177.2 | -71.8 | -6.1 | 0 | 0 | 0 | 112.1 | E302 K303 F304 L309 V310 | E302-N306 PolarHBondContact O-N 3.37Å; E302-N306 VanDerWaalsContact O-N 3.13Å; K303-N306 PolarHBondContact O-N 3.48Å; F304-N306 VanDerWaalsContact C-N 3.33Å; F304-N306 PolarHBondContact O-N 3.14Å; N306-L309 PolarHBondContact O-N 3.41Å; N306-V310 WeakPolarHBondContact O-CG2 3.16Å; N306-V310 PolarHBondContact O-N 2.92Å |
| 307 | Y | 75.6 | Confident | 72.4 | Confident | 82 Ų | 82 | 76.9 Ų | 76.9 | 32% | 0.322 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -66.5 | -38.2 | 174.1 | -70.7 | -60.7 | 0 | 0 | 0 | 112.6 | I54 C58 K59 K303 F304 V310 F311 | I54-Y307 HydrophobicContact CG2-CG 4.36Å; C58-Y307 HydrophobicContact CB-CD1 3.68Å; C58-Y307 HydrophobicContact CB-CE1 4.27Å; C58-Y307 HydrophobicContact CB-CG 4.2Å; K59-Y307 HydrophobicContact CD-CD2 4.29Å; K59-Y307 HydrophobicContact CD-CE2 4.12Å; K59-Y307 HydrophobicContact CG-CD2 3.97Å; K59-Y307 HydrophobicContact CG-CE2 3.61Å; K303-Y307 HydrophobicContact CB-CE2 4.43Å; K303-Y307 WeakPolarHBondContact O-CD2 3.49Å; K303-Y307 PolarHBondContact O-N 3.23Å; K303-Y307 VanDerWaalsContact O-N 3.11Å; F304-Y307 PolarHBondContact O-N 3.38Å; F304-Y307 VanDerWaalsContact O-N 3.14Å; Y307-V310 PolarHBondContact O-N 3.29Å; Y307-F311 VanDerWaalsContact O-CB 3.26Å; Y307-F311 WeakPolarHBondContact O-CB 3.39Å; Y307-F311 PolarHBondContact O-N 3.36Å |
| 308 | L | 76.1 | Confident | 71.3 | Confident | 24 Ų | 24 | 83.7 Ų | 83.7 | 13% | 0.126 | 40% | 0.403 | C | S | . | . | H | α-helix | trans | -55.1 | -51.9 | 172.2 | -114.7 | 164.9 | 0 | 0 | 0 | 110.5 | L50 I54 A298 F304 R305 V310 F311 F312 | L50-L308 HydrophobicContact CD2-CD2 3.64Å; L50-L308 HydrophobicContact CD2-CG 4.49Å; L50-L308 HydrophobicContact CG-CD2 4.46Å; I54-L308 HydrophobicContact CD1-CB 4.44Å; I54-L308 HydrophobicContact CD1-CD2 4.41Å; I54-L308 HydrophobicContact CD1-CG 3.79Å; A298-L308 HydrophobicContact CB-CD1 4.13Å; F304-L308 HydrophobicContact CD1-CD1 3.63Å; F304-L308 HydrophobicContact CD1-CG 4.39Å; F304-L308 HydrophobicContact CE1-CD1 3.35Å; F304-L308 HydrophobicContact CE1-CG 4.03Å; F304-L308 HydrophobicContact CZ-CD1 4.29Å; F304-L308 WeakPolarHBondContact O-CB 3.28Å; F304-L308 PolarHBondContact O-N 3.18Å; R305-L308 VanDerWaalsContact O-CB 3.23Å; R305-L308 WeakPolarHBondContact O-CB 2.92Å; R305-L308 PolarHBondContact O-N 3.5Å; L308-V310 PolarHBondContact O-N 3.06Å; L308-F311 PolarHBondContact O-N 3.5Å; L308-F312 HydrophobicContact CD2-CD2 3.62Å; L308-F312 HydrophobicContact CD2-CE2 3.28Å; L308-F312 HydrophobicContact CD2-CZ 4.49Å; L308-F312 WeakPolarHBondContact O-CB 3.48Å; L308-F312 VanDerWaalsContact O-CD2 3.26Å; L308-F312 WeakPolarHBondContact O-CD2 3.44Å; L308-F312 PolarHBondContact O-N 3.37Å |
| 309 | L | 76.6 | Confident | 70.4 | Confident | 93 Ų | 93 | 91.7 Ų | 91.7 | 49% | 0.487 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -60 | -45.9 | 178.1 | -71.4 | 170.7 | 0 | 0 | 0 | 112.1 | R305 N306 F311 F312 Q313 | R305-L309 WeakPolarHBondContact O-CG 3.48Å; R305-L309 PolarHBondContact O-N 3.41Å; N306-L309 PolarHBondContact O-N 3.41Å; L309-F311 VanDerWaalsContact C-N 3.34Å; L309-F311 PolarHBondContact O-N 3.45Å; L309-F312 PolarHBondContact O-N 3.32Å; L309-Q313 WeakPolarHBondContact O-CB 3.49Å; L309-Q313 VanDerWaalsContact O-CG 3.26Å; L309-Q313 WeakPolarHBondContact O-CG 3.32Å; L309-Q313 PolarHBondContact O-N 2.95Å |
| 310 | V | 78.2 | Confident | 69.6 | Low | 77 Ų | 77 | 90.6 Ų | 90.6 | 47% | 0.467 | 42% | 0.422 | S | S | . | . | H | α-helix | trans | -63.8 | -39.9 | 177 | 172 | 0 | 0 | 0 | 0 | 111.5 | N306 Y307 L308 Q313 K314 | N306-V310 WeakPolarHBondContact O-CG2 3.16Å; N306-V310 PolarHBondContact O-N 2.92Å; Y307-V310 PolarHBondContact O-N 3.29Å; L308-V310 PolarHBondContact O-N 3.06Å; V310-Q313 PolarHBondContact O-N 3.43Å; V310-K314 WeakPolarHBondContact O-CB 3.47Å; V310-K314 PolarHBondContact O-N 3.43Å |
| 311 | F | 76.5 | Confident | 68.7 | Low | 23 Ų | 23 | 91.1 Ų | 91.1 | 10% | 0.101 | 43% | 0.428 | C | S | . | . | H | α-helix | trans | -64 | -47.7 | 176.5 | -178.6 | -92.8 | 0 | 0 | 0 | 111.1 | L50 L53 Y307 L308 L309 Q313 K314 H315 I316 | L50-F311 HydrophobicContact CD1-CD1 3.78Å; L50-F311 HydrophobicContact CD1-CE1 3.63Å; L50-F311 HydrophobicContact CD1-CZ 4.33Å; L53-F311 HydrophobicContact CB-CE2 4.48Å; L53-F311 HydrophobicContact CD1-CZ 4.3Å; Y307-F311 VanDerWaalsContact O-CB 3.26Å; Y307-F311 WeakPolarHBondContact O-CB 3.39Å; Y307-F311 PolarHBondContact O-N 3.36Å; L308-F311 PolarHBondContact O-N 3.5Å; L309-F311 VanDerWaalsContact C-N 3.34Å; L309-F311 PolarHBondContact O-N 3.45Å; F311-Q313 PolarHBondContact O-N 2.98Å; F311-K314 PolarHBondContact O-N 3.26Å; F311-H315 AromaticContact CD2-CD2 3.65Å; F311-H315 AromaticContact CE2-CD2 3.67Å; F311-H315 HydrophobicContact CZ-CB 4.41Å; F311-H315 WeakPolarHBondContact O-CB 3.48Å; F311-H315 PolarHBondContact O-N 3.35Å; F311-I316 HydrophobicContact CE1-CD1 4.49Å |
| 312 | F | 79.5 | Confident | 67.6 | Low | 90 Ų | 90 | 99.7 Ų | 99.7 | 40% | 0.395 | 46% | 0.463 | S | S | . | . | I | π-helix | trans | -57.9 | -47.2 | 174.4 | -90.5 | -75.1 | 0 | 0 | 0 | 111.2 | L308 L309 K314 I316 A317 | L308-F312 HydrophobicContact CD2-CD2 3.62Å; L308-F312 HydrophobicContact CD2-CE2 3.28Å; L308-F312 HydrophobicContact CD2-CZ 4.49Å; L308-F312 WeakPolarHBondContact O-CB 3.48Å; L308-F312 VanDerWaalsContact O-CD2 3.26Å; L308-F312 WeakPolarHBondContact O-CD2 3.44Å; L308-F312 PolarHBondContact O-N 3.37Å; L309-F312 PolarHBondContact O-N 3.32Å; F312-K314 PolarHBondContact O-N 3.41Å; F312-I316 HydrophobicContact CD1-CB 3.93Å; F312-I316 HydrophobicContact CD1-CD1 3.27Å; F312-I316 HydrophobicContact CD1-CG1 4.14Å; F312-I316 HydrophobicContact CD1-CG2 4.03Å; F312-I316 HydrophobicContact CE1-CD1 3.26Å; F312-I316 HydrophobicContact CE1-CG1 4.47Å; F312-I316 HydrophobicContact CE1-CG2 4.45Å; F312-I316 HydrophobicContact CG-CD1 4.17Å; F312-I316 HydrophobicContact CZ-CD1 4.15Å; F312-I316 CarbonylContact O-C 3.51Å; F312-I316 WeakPolarHBondContact O-CA 3.41Å; F312-I316 WeakPolarHBondContact O-CB 3.3Å; F312-I316 PolarHBondContact O-N 3.2Å; F312-A317 PolarHBondContact O-N 2.06Å |
| 313 | Q | 75.9 | Confident | 66.6 | Low | 127 Ų | 127 | 100.9 Ų | 100.9 | 59% | 0.593 | 48% | 0.479 | S | S | * | . | I | π-helix | trans | -61.7 | -45 | 177.7 | -74 | 171.2 | -7.6 | 0 | 0 | 112.4 | L309 V310 F311 K318 | L309-Q313 WeakPolarHBondContact O-CB 3.49Å; L309-Q313 VanDerWaalsContact O-CG 3.26Å; L309-Q313 WeakPolarHBondContact O-CG 3.32Å; L309-Q313 PolarHBondContact O-N 2.95Å; V310-Q313 PolarHBondContact O-N 3.43Å; F311-Q313 PolarHBondContact O-N 2.98Å; Q313-K318 PolarHBondContact O-N 3.31Å |
| 314 | K | 71.6 | Confident | 65.3 | Low | 139 Ų | 139 | 97.1 Ų | 97.1 | 60% | 0.604 | 47% | 0.472 | S | S | * | . | I | π-helix | trans | -75.6 | -37.4 | -173.8 | -170.4 | 177.9 | 179.9 | -175.5 | 0 | 113.6 | V310 F311 F312 K318 | V310-K314 WeakPolarHBondContact O-CB 3.47Å; V310-K314 PolarHBondContact O-N 3.43Å; F311-K314 PolarHBondContact O-N 3.26Å; F312-K314 PolarHBondContact O-N 3.41Å; K314-K318 VanDerWaalsContact O-CB 3.3Å; K314-K318 WeakPolarHBondContact O-CB 3.32Å |
| 315 | H | 69.7 | Low | 63.6 | Low | 88 Ų | 88 | 101.8 Ų | 101.8 | 41% | 0.407 | 51% | 0.507 | S | S | . | . | I | π-helix | trans | -110.5 | -31.1 | -170.7 | -70 | -79.5 | 0 | 0 | 0 | 114.2 | F311 R319 | F311-H315 AromaticContact CD2-CD2 3.65Å; F311-H315 AromaticContact CE2-CD2 3.67Å; F311-H315 HydrophobicContact CZ-CB 4.41Å; F311-H315 WeakPolarHBondContact O-CB 3.48Å; F311-H315 PolarHBondContact O-N 3.35Å; H315-R319 WeakPolarHBondContact O-CB 3.35Å; H315-R319 WeakPolarHBondContact O-CD 3.14Å; H315-R319 WeakPolarHBondContact O-CG 3.34Å |
| 316 | I | 67.6 | Low | 62.1 | Low | 60 Ų | 60 | 102.8 Ų | 102.8 | 31% | 0.308 | 52% | 0.521 | S | S | . | . | I | π-helix | trans | -101.4 | -56.5 | -175.2 | -66.2 | 170.6 | 0 | 0 | 0 | 109.3 | F311 F312 K318 R319 F320 | F311-I316 HydrophobicContact CE1-CD1 4.49Å; F312-I316 HydrophobicContact CD1-CB 3.93Å; F312-I316 HydrophobicContact CD1-CD1 3.27Å; F312-I316 HydrophobicContact CD1-CG1 4.14Å; F312-I316 HydrophobicContact CD1-CG2 4.03Å; F312-I316 HydrophobicContact CE1-CD1 3.26Å; F312-I316 HydrophobicContact CE1-CG1 4.47Å; F312-I316 HydrophobicContact CE1-CG2 4.45Å; F312-I316 HydrophobicContact CG-CD1 4.17Å; F312-I316 HydrophobicContact CZ-CD1 4.15Å; F312-I316 CarbonylContact O-C 3.51Å; F312-I316 WeakPolarHBondContact O-CA 3.41Å; F312-I316 WeakPolarHBondContact O-CB 3.3Å; F312-I316 PolarHBondContact O-N 3.2Å; I316-K318 VanDerWaalsContact C-N 3.32Å; I316-K318 PolarHBondContact O-N 3.17Å; I316-R319 PolarHBondContact O-N 3.49Å; I316-F320 HydrophobicContact CG2-CD2 3.63Å; I316-F320 HydrophobicContact CG2-CE2 3.82Å; I316-F320 WeakPolarHBondContact O-CD2 3.25Å; I316-F320 PolarHBondContact O-N 3.18Å |
| 317 | A | 61.3 | Low | 60.2 | Low | 43 Ų | 43 | 107.4 Ų | 107.4 | 36% | 0.355 | 54% | 0.536 | S | S | . | . | I | π-helix | trans | -61.6 | -38.3 | 177 | 0 | 0 | 0 | 0 | 0 | 112 | F312 R319 F320 C321 | F312-A317 PolarHBondContact O-N 2.06Å; A317-R319 VanDerWaalsContact C-N 3.3Å; A317-R319 PolarHBondContact O-N 2.98Å; A317-F320 PolarHBondContact O-N 2.9Å; A317-C321 WeakPolarHBondContact O-CA 3.23Å; A317-C321 WeakPolarHBondContact O-CB 3.34Å; A317-C321 PolarHBondContact O-N 3Å; A317-C321 PolarHBondContact O-SG 2.78Å; A317-C321 VanDerWaalsContact O-SG 3.39Å |
| 318 | K | 55.6 | Low | 58.5 | Low | 154 Ų | 154 | 112.6 Ų | 112.6 | 67% | 0.67 | 56% | 0.564 | S | S | * | * | H | α-helix | trans | -68.3 | -25.3 | 174.9 | -153.1 | 175.6 | -174.6 | 178.2 | 0 | 114 | Q313 K314 I316 K322 | Q313-K318 PolarHBondContact O-N 3.31Å; K314-K318 VanDerWaalsContact O-CB 3.3Å; K314-K318 WeakPolarHBondContact O-CB 3.32Å; I316-K318 VanDerWaalsContact C-N 3.32Å; I316-K318 PolarHBondContact O-N 3.17Å; K318-K322 PolarHBondContact O-N 3Å |
| 319 | R | 54.9 | Low | 56.6 | Low | 198 Ų | 198 | 120.1 Ų | 120.1 | 75% | 0.747 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -82.1 | -40.7 | 172.9 | -89 | -177.2 | 170.3 | 179.1 | -3.6 | 111.7 | H315 I316 A317 K322 C323 | H315-R319 WeakPolarHBondContact O-CB 3.35Å; H315-R319 WeakPolarHBondContact O-CD 3.14Å; H315-R319 WeakPolarHBondContact O-CG 3.34Å; I316-R319 PolarHBondContact O-N 3.49Å; A317-R319 VanDerWaalsContact C-N 3.3Å; A317-R319 PolarHBondContact O-N 2.98Å; R319-K322 WeakPolarHBondContact O-CB 3.45Å; R319-K322 PolarHBondContact O-N 3.29Å; R319-C323 PolarHBondContact O-N 2.81Å |
| 320 | F | 52.6 | Low | 54.7 | Low | 144 Ų | 144 | 124.2 Ų | 124.2 | 63% | 0.632 | 62% | 0.615 | S | S | * | * | H | α-helix | trans | -72.5 | -36.9 | 176.1 | -83.7 | -81.6 | 0 | 0 | 0 | 112.6 | I316 A317 K322 C323 C324 | I316-F320 HydrophobicContact CG2-CD2 3.63Å; I316-F320 HydrophobicContact CG2-CE2 3.82Å; I316-F320 WeakPolarHBondContact O-CD2 3.25Å; I316-F320 PolarHBondContact O-N 3.18Å; A317-F320 PolarHBondContact O-N 2.9Å; F320-K322 PolarHBondContact O-N 3.4Å; F320-C323 CarbonylContact O-C 3.58Å; F320-C323 WeakPolarHBondContact O-CA 3.4Å; F320-C323 WeakPolarHBondContact O-CB 3.36Å; F320-C323 PolarHBondContact O-N 2.98Å; F320-C324 PolarHBondContact O-N 3.35Å |
| 321 | C | 47.4 | Very low | 52.7 | Low | 76 Ų | 76 | 124.9 Ų | 124.9 | 51% | 0.514 | 63% | 0.628 | S | S | . | * | H | α-helix | trans | -69.1 | -16.8 | 169.1 | -73.5 | 0 | 0 | 0 | 0 | 113.2 | A317 C323 C324 | A317-C321 WeakPolarHBondContact O-CA 3.23Å; A317-C321 WeakPolarHBondContact O-CB 3.34Å; A317-C321 PolarHBondContact O-N 3Å; A317-C321 PolarHBondContact O-SG 2.78Å; A317-C321 VanDerWaalsContact O-SG 3.39Å; C321-C323 VanDerWaalsContact C-N 3.31Å; C321-C324 CarbonylContact O-C 3.53Å |
| 322 | K | 45.3 | Very low | 50.7 | Low | 190 Ų | 190 | 129.9 Ų | 129.9 | 83% | 0.826 | 66% | 0.663 | S | S | * | * | H | α-helix | trans | -74.4 | -22.7 | 166.3 | -108.7 | -174.4 | 175.4 | -169.2 | 0 | 112.5 | K318 R319 F320 | K318-K322 PolarHBondContact O-N 3Å; R319-K322 WeakPolarHBondContact O-CB 3.45Å; R319-K322 PolarHBondContact O-N 3.29Å; F320-K322 PolarHBondContact O-N 3.4Å |
| 323 | C | 45.8 | Very low | 48.6 | Very low | 112 Ų | 112 | 134.6 Ų | 134.6 | 76% | 0.757 | 69% | 0.687 | S | S | * | * | H | α-helix | trans | -91.5 | -13.3 | 170.9 | -76.8 | 0 | 0 | 0 | 0 | 113.6 | R319 F320 C321 | R319-C323 PolarHBondContact O-N 2.81Å; F320-C323 CarbonylContact O-C 3.58Å; F320-C323 WeakPolarHBondContact O-CA 3.4Å; F320-C323 WeakPolarHBondContact O-CB 3.36Å; F320-C323 PolarHBondContact O-N 2.98Å; C321-C323 VanDerWaalsContact C-N 3.31Å |
| 324 | C | 40.3 | Very low | 46.8 | Very low | 81 Ų | 81 | 140.5 Ų | 140.5 | 55% | 0.547 | 70% | 0.703 | S | S | . | * | trans | -112.8 | 95.8 | 174.4 | -76.4 | 0 | 0 | 0 | 0 | 110.5 | F320 C321 I326 | F320-C324 PolarHBondContact O-N 3.35Å; C321-C324 CarbonylContact O-C 3.53Å; C324-I326 PolarHBondContact O-N 2.95Å | ||
| 325 | S | 33.4 | Very low | 45 | Very low | 118 Ų | 118 | 139 Ų | 139 | 83% | 0.825 | 72% | 0.717 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71 | 32.1 | 176.2 | 62.5 | 0 | 0 | 0 | 0 | 114.5 | ||
| 326 | I | 43.6 | Very low | 43.5 | Very low | 148 Ų | 148 | 140.1 Ų | 140.1 | 76% | 0.759 | 74% | 0.735 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -116.6 | -11.4 | -173.5 | -65 | -178.3 | 0 | 0 | 0 | 113 | C324 | C324-I326 PolarHBondContact O-N 2.95Š|
| 327 | F | 36.6 | Very low | 42.1 | Very low | 188 Ų | 188 | 142.4 Ų | 142.4 | 83% | 0.825 | 76% | 0.756 | S | S | * | * | trans | -119.1 | 43.2 | 179.9 | -111 | -84.1 | 0 | 0 | 0 | 113.7 | ||||
| 328 | Q | 40.1 | Very low | 41.1 | Very low | 191 Ų | 191 | 146.8 Ų | 146.8 | 89% | 0.893 | 78% | 0.778 | S | S | * | * | trans | -104.1 | 75.3 | 165.8 | -155.8 | 169.1 | -17 | 0 | 0 | 107.7 | ||||
| 329 | Q | 36.3 | Very low | 40.1 | Very low | 182 Ų | 182 | 149.3 Ų | 149.3 | 85% | 0.85 | 79% | 0.785 | S | S | * | * | trans | -111.1 | 131.7 | 162.8 | -155.1 | 162.7 | 7.9 | 0 | 0 | 108.4 | ||||
| 330 | E | 36.3 | Very low | 39.3 | Very low | 180 Ų | 180 | 146 Ų | 146 | 84% | 0.841 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -61.9 | 147.8 | -155.2 | -67.5 | 157.8 | 145.8 | 0 | 0 | 114.5 | ||
| 331 | A | 35.3 | Very low | 38.3 | Very low | 90 Ų | 90 | 149.7 Ų | 149.7 | 74% | 0.744 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -70.4 | 134 | 163.9 | 0 | 0 | 0 | 0 | 0 | 109.4 | E333 | A331-E333 PolarHBondContact O-N 3.26Š|
| 332 | P | 36 | Very low | 37.7 | Very low | 129 Ų | 129 | 150.9 Ų | 150.9 | 84% | 0.838 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -75.7 | 126.5 | 164.9 | 5 | 10.4 | 0 | 0 | 0 | 109 | ||
| 333 | E | 35.4 | Very low | 37.3 | Very low | 189 Ų | 189 | 147.1 Ų | 147.1 | 88% | 0.883 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -58.9 | 145.3 | 179.7 | -66.9 | 178.8 | 143.7 | 0 | 0 | 112.8 | A331 A335 | A331-E333 PolarHBondContact O-N 3.26Å; E333-A335 PolarHBondContact O-N 3.48Å |
| 334 | R | 37.3 | Very low | 36.8 | Very low | 250 Ų | 250 | 145.5 Ų | 145.5 | 94% | 0.943 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -67.2 | 116 | 168.4 | -80.4 | 175 | 172.5 | 166.6 | -3.4 | 109.5 | ||
| 335 | A | 33.8 | Very low | 36.6 | Very low | 107 Ų | 107 | 150.6 Ų | 150.6 | 88% | 0.884 | 82% | 0.816 | S | S | * | * | P | Polyproline II helix | trans | -88.5 | 119.2 | 155 | 0 | 0 | 0 | 0 | 0 | 109.4 | E333 | E333-A335 PolarHBondContact O-N 3.48Š|
| 336 | S | 38.8 | Very low | 36.7 | Very low | 113 Ų | 113 | 154 Ų | 154 | 79% | 0.79 | 82% | 0.819 | S | S | * | * | P | Polyproline II helix | trans | -93.5 | 127.8 | 173.4 | 51.5 | 0 | 0 | 0 | 0 | 111.3 | ||
| 337 | S | 37.5 | Very low | 36.4 | Very low | 107 Ų | 107 | 156.1 Ų | 156.1 | 75% | 0.748 | 83% | 0.826 | S | S | * | * | trans | -171.7 | 102.9 | 148 | 55.5 | 0 | 0 | 0 | 0 | 107.4 | ||||
| 338 | V | 40.9 | Very low | 36.4 | Very low | 135 Ų | 135 | 154.5 Ų | 154.5 | 82% | 0.818 | 82% | 0.824 | S | S | * | * | 48.8 | 94.9 | 87.1 | -172.3 | 0 | 0 | 0 | 0 | 112.6 | |||||
| 339 | Y | 34.6 | Very low | 36.1 | Very low | 208 Ų | 208 | 150.5 Ų | 150.5 | 82% | 0.816 | 82% | 0.817 | S | S | * | * | -172.5 | 131.3 | 115.6 | -137.6 | -96.6 | 0 | 0 | 0 | 111 | |||||
| 340 | T | 37.7 | Very low | 36.1 | Very low | 127 Ų | 127 | 148.6 Ų | 148.6 | 78% | 0.779 | 82% | 0.818 | S | S | * | * | trans | -96.8 | 135.5 | 170.3 | -43.3 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 341 | R | 31.3 | Very low | 36.1 | Very low | 223 Ų | 223 | 143.2 Ų | 143.2 | 84% | 0.842 | 81% | 0.811 | S | S | * | * | trans | -154.4 | 113.4 | 143.1 | -156.4 | 167 | -178.4 | 163.8 | -0.3 | 111.8 | ||||
| 342 | S | 34.6 | Very low | 35.9 | Very low | 100 Ų | 100 | 151.1 Ų | 151.1 | 70% | 0.699 | 84% | 0.839 | S | S | * | * | trans | -72.6 | 137.6 | 157.9 | 166.3 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 343 | T | 37.6 | Very low | 35.9 | Very low | 112 Ų | 112 | 152.2 Ų | 152.2 | 69% | 0.687 | 84% | 0.839 | S | S | * | * | trans | -170 | 116.8 | 133.6 | 24.9 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 344 | G | 35.6 | Very low | 35.9 | Very low | 78 Ų | 78 | 150.3 Ų | 150.3 | 80% | 0.804 | 84% | 0.837 | S | S | * | * | trans | -78.3 | 138.8 | 156.6 | 0 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 345 | E | 35.3 | Very low | 35.8 | Very low | 187 Ų | 187 | 144.7 Ų | 144.7 | 87% | 0.874 | 83% | 0.831 | S | S | * | * | trans | -134.3 | 109.3 | 161.2 | -90.9 | 174 | 170 | 0 | 0 | 107.2 | ||||
| 346 | Q | 36.9 | Very low | 35.9 | Very low | 189 Ų | 189 | 146.9 Ų | 146.9 | 88% | 0.883 | 83% | 0.828 | S | S | * | * | trans | -107.3 | 111.7 | 159.8 | -114.9 | 178.6 | -23 | 0 | 0 | 104.4 | ||||
| 347 | E | 36.6 | Very low | 35.8 | Very low | 194 Ų | 194 | 149.1 Ų | 149.1 | 91% | 0.907 | 83% | 0.83 | S | S | * | * | trans | -132.7 | 119.5 | 158.8 | -85.9 | -166.8 | 160.9 | 0 | 0 | 109.6 | ||||
| 348 | I | 35.9 | Very low | 35.7 | Very low | 153 Ų | 153 | 151.9 Ų | 151.9 | 79% | 0.785 | 84% | 0.836 | S | S | * | * | trans | -97.7 | 126.7 | 163.9 | -67.6 | 169.1 | 0 | 0 | 0 | 104.9 | ||||
| 349 | S | 33.6 | Very low | 35.3 | Very low | 107 Ų | 107 | 153.1 Ų | 153.1 | 75% | 0.748 | 84% | 0.837 | S | S | * | * | trans | 161 | 126.3 | 131.2 | -78.9 | 0 | 0 | 0 | 0 | 115.9 | ||||
| 350 | V | 36.2 | Very low | 35.3 | Very low | 143 Ų | 143 | 148.8 Ų | 148.8 | 87% | 0.867 | 84% | 0.838 | S | S | * | * | trans | 86.7 | 110.6 | 138 | -176.5 | 0 | 0 | 0 | 0 | 120.4 | ||||
| 351 | G | 36.3 | Very low | 35.1 | Very low | 67 Ų | 67 | 150.7 Ų | 150.7 | 69% | 0.691 | 84% | 0.843 | S | S | * | * | 82.1 | 102.6 | 119.7 | 0 | 0 | 0 | 0 | 0 | 119.2 | |||||
| 352 | L | 31.7 | Very low | 35.5 | Very low | 255 Ų | 255 | 144.1 Ų | 144.1 | 100% | 1.335 | 84% | 0.844 | S | S | * | * | -166.8 | 0 | 92.3 | -136.8 | 108.4 | 0 | 0 | 0 | 109.9 |
Retrieved 352 of 352 residues in 620.9 ms
(Link to these results)