| 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 | 37.7 | Very low | 45.3 | Very low | 251 Ų | 251 | 134 Ų | 134 | 100% | 1.236 | 79% | 0.791 | S | S | * | * | 0 | 91.5 | 0 | -91.2 | 170.4 | 169.1 | 0 | 0 | 107 | |||||
| 2 | E | 41.8 | Very low | 45.9 | Very low | 199 Ų | 199 | 137 Ų | 137 | 93% | 0.93 | 79% | 0.787 | S | S | * | * | trans | -70.1 | 139.6 | 163.1 | -77.3 | 161 | 116.5 | 0 | 0 | 108.6 | ||||
| 3 | S | 40.9 | Very low | 46.5 | Very low | 125 Ų | 125 | 139.2 Ų | 139.2 | 87% | 0.874 | 78% | 0.782 | S | S | * | * | trans | -132.1 | 105.1 | 159.7 | -179.2 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 4 | S | 45.3 | Very low | 46.7 | Very low | 112 Ų | 112 | 139.8 Ų | 139.8 | 78% | 0.783 | 77% | 0.768 | S | S | * | * | trans | -87.3 | 148.5 | 173.8 | 46.1 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 5 | G | 40.3 | Very low | 47.3 | Very low | 79 Ų | 79 | 142.3 Ų | 142.3 | 81% | 0.814 | 76% | 0.763 | S | S | * | * | trans | 107.6 | 127.2 | 162.5 | 0 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 6 | N | 39.2 | Very low | 48.5 | Very low | 121 Ų | 121 | 139.5 Ų | 139.5 | 65% | 0.647 | 75% | 0.748 | S | S | * | * | cis | -158.1 | 145.3 | 28.8 | -152.6 | 22.7 | 0 | 0 | 0 | 110.9 | E8 | N6-E8 WeakPolarHBondContact ND2-CG 3.05Å; N6-E8 PolarHBondContact ND2-OE1 3.34Å | ||
| 7 | P | 47.3 | Very low | 49.5 | Very low | 106 Ų | 106 | 137.1 Ų | 137.1 | 69% | 0.688 | 73% | 0.734 | S | S | * | * | trans | -97.9 | 102.3 | 169.8 | 33.4 | -22.7 | 0 | 0 | 0 | 110.8 | ||||
| 8 | E | 49 | Very low | 50.2 | Low | 156 Ų | 156 | 134.8 Ų | 134.8 | 73% | 0.729 | 72% | 0.718 | S | S | * | * | trans | -109.1 | 28.8 | 179.7 | -73.6 | -167.7 | 177 | 0 | 0 | 114.5 | N6 | N6-E8 WeakPolarHBondContact ND2-CG 3.05Å; N6-E8 PolarHBondContact ND2-OE1 3.34Å | ||
| 9 | T | 50.6 | Low | 51 | Low | 124 Ų | 124 | 130.8 Ų | 130.8 | 76% | 0.761 | 70% | 0.702 | S | S | * | * | S | Bend | trans | -117.5 | 6.7 | -175 | -16.2 | 0 | 0 | 0 | 0 | 115.1 | ||
| 10 | T | 52.5 | Low | 51.7 | Low | 108 Ų | 108 | 129.8 Ų | 129.8 | 66% | 0.663 | 69% | 0.693 | S | S | * | * | S | Bend | trans | -104.2 | -20.6 | -172.7 | -9.2 | 0 | 0 | 0 | 0 | 114.4 | Y14 | T10-Y14 WeakPolarHBondContact O-CB 3.4Š|
| 11 | T | 53.8 | Low | 52.4 | Low | 93 Ų | 93 | 127.6 Ų | 127.6 | 57% | 0.571 | 68% | 0.681 | S | S | * | * | H | α-helix | trans | -80.2 | -41.4 | -176.8 | 35.4 | 0 | 0 | 0 | 0 | 113 | F13 Y14 Y15 | T11-F13 PolarHBondContact O-N 3.15Å; T11-Y14 PolarHBondContact O-N 3.32Å; T11-Y15 VanDerWaalsContact O-CD2 3.23Å; T11-Y15 WeakPolarHBondContact O-CD2 3.38Å; T11-Y15 PolarHBondContact O-N 3.42Å |
| 12 | F | 51.8 | Low | 53.9 | Low | 170 Ų | 170 | 119.1 Ų | 119.1 | 75% | 0.746 | 65% | 0.645 | S | S | * | * | H | α-helix | trans | -63.3 | -42.7 | -175.4 | -155.2 | -93.1 | 0 | 0 | 0 | 112.7 | D16 | F12-D16 PolarHBondContact O-N 3.29Å |
| 13 | F | 54.5 | Low | 55.3 | Low | 166 Ų | 166 | 114.4 Ų | 114.4 | 73% | 0.728 | 62% | 0.623 | S | S | * | * | H | α-helix | trans | -68.7 | -32.4 | 175.5 | -101.8 | -83.1 | 0 | 0 | 0 | 113.4 | T11 L17 | T11-F13 PolarHBondContact O-N 3.15Å; F13-L17 VanDerWaalsContact O-CB 3.26Å; F13-L17 WeakPolarHBondContact O-CB 3.42Å; F13-L17 PolarHBondContact O-N 3.08Å |
| 14 | Y | 49.7 | Very low | 56.9 | Low | 147 Ų | 147 | 113.1 Ų | 113.1 | 58% | 0.576 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -74.6 | -38.7 | -178.6 | -169.9 | -88.6 | 0 | 0 | 0 | 112.1 | T10 T11 Q18 | T10-Y14 WeakPolarHBondContact O-CB 3.4Å; T11-Y14 PolarHBondContact O-N 3.32Å; Y14-Q18 VanDerWaalsContact CZ-OE1 3.23Å; Y14-Q18 VanDerWaalsContact O-CB 3.24Å; Y14-Q18 WeakPolarHBondContact O-CB 3.23Å; Y14-Q18 PolarHBondContact O-N 3.42Å; Y14-Q18 PolarHBondContact OH-OE1 3.16Å |
| 15 | Y | 55.5 | Low | 58.5 | Low | 177 Ų | 177 | 114 Ų | 114 | 69% | 0.694 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -63.7 | -41.6 | 173.9 | -84.6 | -74.9 | 0 | 0 | 0 | 112.1 | T11 S19 | T11-Y15 VanDerWaalsContact O-CD2 3.23Å; T11-Y15 WeakPolarHBondContact O-CD2 3.38Å; T11-Y15 PolarHBondContact O-N 3.42Å; Y15-S19 VanDerWaalsContact O-CB 3.31Å; Y15-S19 WeakPolarHBondContact O-CB 3.23Å; Y15-S19 PolarHBondContact O-N 3.19Å; Y15-S19 PolarHBondContact O-OG 3.17Å |
| 16 | D | 66.4 | Low | 60.4 | Low | 98 Ų | 98 | 112.1 Ų | 112.1 | 52% | 0.524 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -72.3 | -36.6 | -179.5 | -137.6 | 15.8 | 0 | 0 | 0 | 111.9 | F12 S19 Q20 | F12-D16 PolarHBondContact O-N 3.29Å; D16-S19 WeakPolarHBondContact CA-OG 3.47Å; D16-S19 PolarHBondContact O-OG 2.87Å; D16-Q20 WeakPolarHBondContact O-CB 3.37Å; D16-Q20 PolarHBondContact O-N 3.14Å |
| 17 | L | 64.8 | Low | 62.4 | Low | 99 Ų | 99 | 113.6 Ų | 113.6 | 52% | 0.518 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -68.7 | -42.7 | 174 | -175 | 65.6 | 0 | 0 | 0 | 111.4 | F13 Q20 L21 | F13-L17 VanDerWaalsContact O-CB 3.26Å; F13-L17 WeakPolarHBondContact O-CB 3.42Å; F13-L17 PolarHBondContact O-N 3.08Å; L17-Q20 PolarHBondContact O-N 3.42Å; L17-L21 HydrophobicContact CD1-CD1 3.69Å; L17-L21 HydrophobicContact CD2-CD1 4.42Å; L17-L21 HydrophobicContact CG-CD1 3.6Å; L17-L21 WeakPolarHBondContact O-CB 3.15Å; L17-L21 WeakPolarHBondContact O-CD1 3.32Å; L17-L21 PolarHBondContact O-N 2.87Å |
| 18 | Q | 63.3 | Low | 64.2 | Low | 96 Ų | 96 | 111 Ų | 111 | 45% | 0.449 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -73.2 | -35.6 | -179.1 | -171.4 | 145.3 | -26 | 0 | 0 | 112.4 | Y14 C22 | Y14-Q18 VanDerWaalsContact CZ-OE1 3.23Å; Y14-Q18 VanDerWaalsContact O-CB 3.24Å; Y14-Q18 WeakPolarHBondContact O-CB 3.23Å; Y14-Q18 PolarHBondContact O-N 3.42Å; Y14-Q18 PolarHBondContact OH-OE1 3.16Å; Q18-C22 WeakPolarHBondContact O-CB 3.26Å; Q18-C22 PolarHBondContact O-N 2.99Å; Q18-C22 PolarHBondContact O-SG 2.95Å; Q18-C22 VanDerWaalsContact O-SG 3.34Å |
| 19 | S | 63.9 | Low | 66 | Low | 59 Ų | 59 | 110.9 Ų | 110.9 | 41% | 0.413 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -62.2 | -46 | 170 | 60.6 | 0 | 0 | 0 | 0 | 110.6 | Y15 D16 C22 E23 | Y15-S19 VanDerWaalsContact O-CB 3.31Å; Y15-S19 WeakPolarHBondContact O-CB 3.23Å; Y15-S19 PolarHBondContact O-N 3.19Å; Y15-S19 PolarHBondContact O-OG 3.17Å; D16-S19 WeakPolarHBondContact CA-OG 3.47Å; D16-S19 PolarHBondContact O-OG 2.87Å; S19-C22 PolarHBondContact O-N 3.37Å; S19-E23 VanDerWaalsContact O-CB 3.31Å; S19-E23 WeakPolarHBondContact O-CB 3.37Å; S19-E23 PolarHBondContact O-N 3.45Å |
| 20 | Q | 64.8 | Low | 67.8 | Low | 109 Ų | 109 | 106 Ų | 106 | 51% | 0.509 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -67.3 | -37.3 | 179.4 | -165.7 | 169.5 | 9.5 | 0 | 0 | 112.6 | D16 L17 N24 | D16-Q20 WeakPolarHBondContact O-CB 3.37Å; D16-Q20 PolarHBondContact O-N 3.14Å; L17-Q20 PolarHBondContact O-N 3.42Å; Q20-N24 VanDerWaalsContact O-CB 3.24Å; Q20-N24 WeakPolarHBondContact O-CB 3.02Å; Q20-N24 PolarHBondContact O-N 3.46Å; Q20-N24 PolarHBondContact O-ND2 3.32Å |
| 21 | L | 67.6 | Low | 69.5 | Low | 85 Ų | 85 | 101.7 Ų | 101.7 | 45% | 0.445 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -65 | -44.1 | 172.4 | -98.9 | 112.6 | 0 | 0 | 0 | 112.1 | L17 N24 Q25 | L17-L21 HydrophobicContact CD1-CD1 3.69Å; L17-L21 HydrophobicContact CD2-CD1 4.42Å; L17-L21 HydrophobicContact CG-CD1 3.6Å; L17-L21 WeakPolarHBondContact O-CB 3.15Å; L17-L21 WeakPolarHBondContact O-CD1 3.32Å; L17-L21 PolarHBondContact O-N 2.87Å; L21-N24 PolarHBondContact O-N 3.46Å; L21-Q25 WeakPolarHBondContact O-CB 3.4Å; L21-Q25 WeakPolarHBondContact O-CG 3.39Å; L21-Q25 PolarHBondContact O-N 3.3Å |
| 22 | C | 69.3 | Low | 71.3 | Confident | 72 Ų | 72 | 102.2 Ų | 102.2 | 49% | 0.486 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -65 | -41.2 | 176.9 | -77.5 | 0 | 0 | 0 | 0 | 111.8 | Q18 S19 Q25 A26 | Q18-C22 WeakPolarHBondContact O-CB 3.26Å; Q18-C22 PolarHBondContact O-N 2.99Å; Q18-C22 PolarHBondContact O-SG 2.95Å; Q18-C22 VanDerWaalsContact O-SG 3.34Å; S19-C22 PolarHBondContact O-N 3.37Å; C22-Q25 PolarHBondContact O-N 3.11Å; C22-A26 WeakPolarHBondContact O-CB 3.42Å; C22-A26 PolarHBondContact O-N 3.24Å |
| 23 | E | 71.4 | Confident | 73.2 | Confident | 100 Ų | 100 | 96.1 Ų | 96.1 | 47% | 0.467 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -65 | -42.7 | 176.9 | -168.6 | 168.7 | -173.8 | 0 | 0 | 111.1 | S19 A26 W27 | S19-E23 VanDerWaalsContact O-CB 3.31Å; S19-E23 WeakPolarHBondContact O-CB 3.37Å; S19-E23 PolarHBondContact O-N 3.45Å; E23-A26 PolarHBondContact O-N 2.87Å; E23-W27 WeakPolarHBondContact O-CB 3.38Å; E23-W27 PolarHBondContact O-N 3.06Å |
| 24 | N | 74.6 | Confident | 75 | Confident | 99 Ų | 99 | 88.3 Ų | 88.3 | 53% | 0.529 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -63.8 | -41.1 | 174.1 | -73.6 | -25.3 | 0 | 0 | 0 | 112.6 | Q20 L21 A28 | Q20-N24 VanDerWaalsContact O-CB 3.24Å; Q20-N24 WeakPolarHBondContact O-CB 3.02Å; Q20-N24 PolarHBondContact O-N 3.46Å; Q20-N24 PolarHBondContact O-ND2 3.32Å; L21-N24 PolarHBondContact O-N 3.46Å; N24-A28 VanDerWaalsContact O-CB 3.28Å; N24-A28 WeakPolarHBondContact O-CB 3.07Å; N24-A28 PolarHBondContact O-N 2.89Å |
| 25 | Q | 78.9 | Confident | 77.1 | Confident | 129 Ų | 129 | 82.6 Ų | 82.6 | 60% | 0.603 | 43% | 0.429 | S | S | * | . | H | α-helix | trans | -67.2 | -42.1 | 176.6 | -77.7 | -179 | -8.3 | 0 | 0 | 112.1 | L21 C22 A28 F29 | L21-Q25 WeakPolarHBondContact O-CB 3.4Å; L21-Q25 WeakPolarHBondContact O-CG 3.39Å; L21-Q25 PolarHBondContact O-N 3.3Å; C22-Q25 PolarHBondContact O-N 3.11Å; Q25-A28 PolarHBondContact O-N 2.92Å; Q25-F29 WeakPolarHBondContact O-CB 3.18Å; Q25-F29 PolarHBondContact O-N 2.94Å |
| 26 | A | 80.1 | Confident | 79 | Confident | 40 Ų | 40 | 79.2 Ų | 79.2 | 33% | 0.331 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -63.5 | -44.1 | 176.7 | 0 | 0 | 0 | 0 | 0 | 111.4 | C22 E23 F29 A30 | C22-A26 WeakPolarHBondContact O-CB 3.42Å; C22-A26 PolarHBondContact O-N 3.24Å; E23-A26 PolarHBondContact O-N 2.87Å; A26-F29 PolarHBondContact O-N 3.48Å; A26-A30 VanDerWaalsContact O-CB 3.27Å; A26-A30 WeakPolarHBondContact O-CB 3.35Å; A26-A30 PolarHBondContact O-N 3.37Å |
| 27 | W | 79.9 | Confident | 80.4 | Confident | 153 Ų | 153 | 77.1 Ų | 77.1 | 58% | 0.58 | 41% | 0.41 | S | S | * | . | H | α-helix | trans | -62.6 | -45.1 | 173.9 | -95.3 | 98.8 | 0 | 0 | 0 | 112.6 | E23 F29 A30 T31 | E23-W27 WeakPolarHBondContact O-CB 3.38Å; E23-W27 PolarHBondContact O-N 3.06Å; W27-F29 PolarHBondContact O-N 3.26Å; W27-A30 PolarHBondContact O-N 3.43Å; W27-T31 WeakPolarHBondContact O-CB 3.48Å; W27-T31 PolarHBondContact O-N 3.12Å; W27-T31 PolarHBondContact O-OG1 3.31Å; W27-T31 VanDerWaalsContact O-OG1 3.14Å |
| 28 | A | 86 | Confident | 81.8 | Confident | 51 Ų | 51 | 72.5 Ų | 72.5 | 42% | 0.421 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -61.9 | -44.6 | 177.2 | 0 | 0 | 0 | 0 | 0 | 111.7 | N24 Q25 T31 L32 | N24-A28 VanDerWaalsContact O-CB 3.28Å; N24-A28 WeakPolarHBondContact O-CB 3.07Å; N24-A28 PolarHBondContact O-N 2.89Å; Q25-A28 PolarHBondContact O-N 2.92Å; A28-T31 PolarHBondContact O-N 3.25Å; A28-L32 WeakPolarHBondContact O-CB 3.2Å; A28-L32 VanDerWaalsContact O-CG 3.31Å; A28-L32 WeakPolarHBondContact O-CG 3.4Å; A28-L32 PolarHBondContact O-N 3.36Å |
| 29 | F | 87.4 | Confident | 83.4 | Confident | 154 Ų | 154 | 70.8 Ų | 70.8 | 68% | 0.675 | 38% | 0.383 | S | S | * | . | H | α-helix | trans | -61.2 | -47 | 175.4 | 177.3 | -96.9 | 0 | 0 | 0 | 111.7 | Q25 A26 W27 T31 L32 A33 | Q25-F29 WeakPolarHBondContact O-CB 3.18Å; Q25-F29 PolarHBondContact O-N 2.94Å; A26-F29 PolarHBondContact O-N 3.48Å; W27-F29 PolarHBondContact O-N 3.26Å; F29-T31 PolarHBondContact O-N 2.99Å; F29-L32 PolarHBondContact O-N 3.31Å; F29-A33 VanDerWaalsContact O-CB 3.23Å; F29-A33 WeakPolarHBondContact O-CB 3.28Å; F29-A33 PolarHBondContact O-N 3.4Å |
| 30 | A | 87.2 | Confident | 84.9 | Confident | 22 Ų | 22 | 73.1 Ų | 73.1 | 18% | 0.182 | 39% | 0.391 | C | S | . | . | H | α-helix | trans | -59.8 | -43.3 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112.7 | A26 W27 T34 L270 | A26-A30 VanDerWaalsContact O-CB 3.27Å; A26-A30 WeakPolarHBondContact O-CB 3.35Å; A26-A30 PolarHBondContact O-N 3.37Å; W27-A30 PolarHBondContact O-N 3.43Å; A30-T34 VanDerWaalsContact O-CB 3.25Å; A30-T34 WeakPolarHBondContact O-CB 3.41Å; A30-T34 PolarHBondContact O-N 3.08Å; A30-T34 PolarHBondContact O-OG1 3.15Å; A30-L270 HydrophobicContact CB-CD2 3.77Å |
| 31 | T | 89 | Confident | 86.4 | Confident | 17 Ų | 17 | 68.2 Ų | 68.2 | 10% | 0.104 | 37% | 0.368 | C | S | . | . | H | α-helix | trans | -64.7 | -46.1 | 176.5 | -69.3 | 0 | 0 | 0 | 0 | 111.6 | W27 A28 F29 T35 | W27-T31 WeakPolarHBondContact O-CB 3.48Å; W27-T31 PolarHBondContact O-N 3.12Å; W27-T31 PolarHBondContact O-OG1 3.31Å; W27-T31 VanDerWaalsContact O-OG1 3.14Å; A28-T31 PolarHBondContact O-N 3.25Å; F29-T31 PolarHBondContact O-N 2.99Å; T31-T35 VanDerWaalsContact O-CB 3.31Å; T31-T35 WeakPolarHBondContact O-CB 3.08Å; T31-T35 PolarHBondContact O-N 3.13Å; T31-T35 PolarHBondContact O-OG1 3.07Å |
| 32 | L | 91.4 | Very high | 87.7 | Confident | 104 Ų | 104 | 66.6 Ų | 66.6 | 55% | 0.545 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -63.5 | -46.9 | 176.9 | -74.5 | 170.2 | 0 | 0 | 0 | 111.7 | A28 F29 T34 T35 I36 | A28-L32 WeakPolarHBondContact O-CB 3.2Å; A28-L32 VanDerWaalsContact O-CG 3.31Å; A28-L32 WeakPolarHBondContact O-CG 3.4Å; A28-L32 PolarHBondContact O-N 3.36Å; F29-L32 PolarHBondContact O-N 3.31Å; L32-T34 PolarHBondContact O-N 2.86Å; L32-T35 PolarHBondContact O-N 3.25Å; L32-I36 WeakPolarHBondContact O-CG1 3.37Å; L32-I36 PolarHBondContact O-N 3.47Å |
| 33 | A | 91.7 | Very high | 89 | Confident | 42 Ų | 42 | 67.9 Ų | 67.9 | 35% | 0.347 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -61 | -46 | 178.5 | 0 | 0 | 0 | 0 | 0 | 111.6 | F29 T35 I36 L37 | F29-A33 VanDerWaalsContact O-CB 3.23Å; F29-A33 WeakPolarHBondContact O-CB 3.28Å; F29-A33 PolarHBondContact O-N 3.4Å; A33-T35 PolarHBondContact O-N 3.15Å; A33-I36 PolarHBondContact O-N 2.94Å; A33-L37 VanDerWaalsContact O-CB 3.26Å; A33-L37 WeakPolarHBondContact O-CB 3.35Å; A33-L37 PolarHBondContact O-N 3.49Å |
| 34 | T | 92.3 | Very high | 90.1 | Very high | 1 Ų | 1 | 67.1 Ų | 67.1 | 1% | 0.006 | 36% | 0.358 | C | S | . | . | H | α-helix | trans | -61.8 | -43 | 175.8 | -59.1 | 0 | 0 | 0 | 0 | 111.5 | A30 L32 L37 Y38 Y91 N274 | A30-T34 VanDerWaalsContact O-CB 3.25Å; A30-T34 WeakPolarHBondContact O-CB 3.41Å; A30-T34 PolarHBondContact O-N 3.08Å; A30-T34 PolarHBondContact O-OG1 3.15Å; L32-T34 PolarHBondContact O-N 2.86Å; T34-L37 PolarHBondContact O-N 3.39Å; T34-Y38 HydrophobicContact CG2-CD1 4.24Å; T34-Y38 HydrophobicContact CG2-CD2 4.19Å; T34-Y38 HydrophobicContact CG2-CE1 3.99Å; T34-Y38 HydrophobicContact CG2-CE2 3.94Å; T34-Y38 HydrophobicContact CG2-CG 4.33Å; T34-Y38 WeakPolarHBondContact O-CB 3.1Å; T34-Y38 PolarHBondContact O-N 2.9Å; T34-Y91 HydrophobicContact CG2-CE2 4.03Å; T34-N274 WeakPolarHBondContact CG2-OD1 3.21Å; T34-N274 PolarHBondContact OG1-ND2 2.64Å; T34-N274 VanDerWaalsContact OG1-ND2 3.12Å |
| 35 | T | 93.8 | Very high | 91.1 | Very high | 28 Ų | 28 | 62.4 Ų | 62.4 | 17% | 0.172 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -60 | -52 | 177.6 | -61 | 0 | 0 | 0 | 0 | 111.1 | T31 L32 A33 L37 Y38 C39 I88 H92 | T31-T35 VanDerWaalsContact O-CB 3.31Å; T31-T35 WeakPolarHBondContact O-CB 3.08Å; T31-T35 PolarHBondContact O-N 3.13Å; T31-T35 PolarHBondContact O-OG1 3.07Å; L32-T35 PolarHBondContact O-N 3.25Å; A33-T35 PolarHBondContact O-N 3.15Å; T35-L37 VanDerWaalsContact C-N 3.34Å; T35-L37 PolarHBondContact O-N 3.19Å; T35-Y38 PolarHBondContact O-N 3.46Å; T35-C39 PolarHBondContact O-N 2.94Å; T35-C39 PolarHBondContact O-SG 3.29Å; T35-I88 HydrophobicContact CG2-CD1 4.45Å; T35-I88 HydrophobicContact CG2-CG2 3.9Å; T35-H92 PolarHBondContact OG1-NE2 3.07Å |
| 36 | I | 94.8 | Very high | 91.9 | Very high | 105 Ų | 105 | 59.2 Ų | 59.2 | 54% | 0.538 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -59.7 | -46.8 | 178.8 | -67.3 | 166.6 | 0 | 0 | 0 | 110.3 | L32 A33 Y38 C39 L40 | L32-I36 WeakPolarHBondContact O-CG1 3.37Å; L32-I36 PolarHBondContact O-N 3.47Å; A33-I36 PolarHBondContact O-N 2.94Å; I36-Y38 PolarHBondContact O-N 3.42Å; I36-C39 PolarHBondContact O-N 2.88Å; I36-L40 HydrophobicContact CG2-CD1 3.98Å; I36-L40 HydrophobicContact CG2-CG 4.45Å; I36-L40 WeakPolarHBondContact O-CG 3.21Å; I36-L40 PolarHBondContact O-N 3.34Å |
| 37 | L | 95.4 | Very high | 92.5 | Very high | 55 Ų | 55 | 62.1 Ų | 62.1 | 29% | 0.288 | 33% | 0.333 | S | S | . | . | H | α-helix | trans | -58.7 | -50.2 | 179.1 | 179 | 66.5 | 0 | 0 | 0 | 111.3 | A33 T34 T35 C39 L40 V41 N274 | A33-L37 VanDerWaalsContact O-CB 3.26Å; A33-L37 WeakPolarHBondContact O-CB 3.35Å; A33-L37 PolarHBondContact O-N 3.49Å; T34-L37 PolarHBondContact O-N 3.39Å; T35-L37 VanDerWaalsContact C-N 3.34Å; T35-L37 PolarHBondContact O-N 3.19Å; L37-C39 VanDerWaalsContact C-N 3.33Å; L37-C39 PolarHBondContact O-N 3.03Å; L37-L40 PolarHBondContact O-N 3Å; L37-V41 HydrophobicContact CD1-CG2 4.08Å; L37-V41 HydrophobicContact CG-CG2 4.27Å; L37-V41 WeakPolarHBondContact O-CB 3.33Å; L37-V41 VanDerWaalsContact O-CG2 3.26Å; L37-V41 WeakPolarHBondContact O-CG2 3.39Å; L37-V41 PolarHBondContact O-N 3.3Å; L37-N274 HydrophobicContact CD2-CB 3.65Å |
| 38 | Y | 95.9 | Very high | 93.1 | Very high | 1 Ų | 1 | 55.3 Ų | 55.3 | 0% | 0.004 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -66.2 | -35.9 | -177.3 | -77.1 | 14.2 | 0 | 0 | 0 | 111.8 | T34 T35 I36 F42 L84 W87 I88 N274 F277 | T34-Y38 HydrophobicContact CG2-CD1 4.24Å; T34-Y38 HydrophobicContact CG2-CD2 4.19Å; T34-Y38 HydrophobicContact CG2-CE1 3.99Å; T34-Y38 HydrophobicContact CG2-CE2 3.94Å; T34-Y38 HydrophobicContact CG2-CG 4.33Å; T34-Y38 WeakPolarHBondContact O-CB 3.1Å; T34-Y38 PolarHBondContact O-N 2.9Å; T35-Y38 PolarHBondContact O-N 3.46Å; I36-Y38 PolarHBondContact O-N 3.42Å; Y38-F42 WeakPolarHBondContact O-CB 3.23Å; Y38-F42 PolarHBondContact O-N 3.15Å; Y38-L84 HydrophobicContact CD2-CD2 4.21Å; Y38-L84 HydrophobicContact CE2-CD2 4.42Å; Y38-L84 HydrophobicContact CG-CD2 4.32Å; Y38-W87 HydrophobicContact CD2-CB 4.49Å; Y38-W87 HydrophobicContact CE2-CB 4.19Å; Y38-I88 HydrophobicContact CD2-CG1 3.82Å; Y38-I88 HydrophobicContact CG-CG1 4.3Å; Y38-N274 VanDerWaalsContact CE1-OD1 3.31Å; Y38-N274 WeakPolarHBondContact CE1-OD1 3.32Å; Y38-N274 PolarHBondContact OH-OD1 3.36Å; Y38-F277 HydrophobicContact CE1-CB 3.97Å; Y38-F277 HydrophobicContact CE1-CD2 4.13Å; Y38-F277 HydrophobicContact CE1-CG 4.44Å; Y38-F277 AromaticContact CE2-CD2 3.72Å; Y38-F277 HydrophobicContact CE2-CD2 3.72Å; Y38-F277 HydrophobicContact CE2-CE2 4.19Å; Y38-F277 AromaticContact CZ-CD2 3.39Å; Y38-F277 WeakPolarHBondContact OH-CD2 3.39Å |
| 39 | C | 95.6 | Very high | 93.5 | Very high | 60 Ų | 60 | 52.9 Ų | 52.9 | 41% | 0.405 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -62.2 | -45.4 | 171.3 | -70.9 | 0 | 0 | 0 | 0 | 112.1 | T35 I36 L37 F42 L43 | T35-C39 PolarHBondContact O-N 2.94Å; T35-C39 PolarHBondContact O-SG 3.29Å; I36-C39 PolarHBondContact O-N 2.88Å; L37-C39 VanDerWaalsContact C-N 3.33Å; L37-C39 PolarHBondContact O-N 3.03Å; C39-F42 PolarHBondContact O-N 3.26Å; C39-L43 WeakPolarHBondContact O-CG 3.48Å; C39-L43 PolarHBondContact O-N 3.37Å |
| 40 | L | 95.3 | Very high | 93.8 | Very high | 108 Ų | 108 | 48.1 Ų | 48.1 | 57% | 0.565 | 28% | 0.276 | S | S | * | . | H | α-helix | trans | -63.8 | -45.9 | 177.6 | -71.2 | 173.6 | 0 | 0 | 0 | 111.8 | I36 L37 F42 L43 L44 | I36-L40 HydrophobicContact CG2-CD1 3.98Å; I36-L40 HydrophobicContact CG2-CG 4.45Å; I36-L40 WeakPolarHBondContact O-CG 3.21Å; I36-L40 PolarHBondContact O-N 3.34Å; L37-L40 PolarHBondContact O-N 3Å; L40-F42 VanDerWaalsContact C-N 3.35Å; L40-L43 PolarHBondContact O-N 2.91Å; L40-L44 VanDerWaalsContact O-CB 3.28Å; L40-L44 WeakPolarHBondContact O-CB 3.38Å; L40-L44 PolarHBondContact O-N 3.34Å |
| 41 | V | 96.2 | Very high | 94 | Very high | 7 Ų | 7 | 49.6 Ų | 49.6 | 4% | 0.042 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -62 | -43.9 | 177.3 | 172.8 | 0 | 0 | 0 | 0 | 110.5 | L37 L44 S45 L84 C280 C281 | L37-V41 HydrophobicContact CD1-CG2 4.08Å; L37-V41 HydrophobicContact CG-CG2 4.27Å; L37-V41 WeakPolarHBondContact O-CB 3.33Å; L37-V41 VanDerWaalsContact O-CG2 3.26Å; L37-V41 WeakPolarHBondContact O-CG2 3.39Å; L37-V41 PolarHBondContact O-N 3.3Å; V41-L44 PolarHBondContact O-N 3.49Å; V41-S45 WeakPolarHBondContact O-CB 3.28Å; V41-S45 PolarHBondContact O-N 2.9Å; V41-L84 HydrophobicContact CB-CD1 4.02Å; V41-L84 HydrophobicContact CG1-CD1 3.52Å; V41-C280 WeakPolarHBondContact CG1-SG 3.4Å; V41-C281 HydrophobicContact CG1-CB 4.29Å |
| 42 | F | 96.4 | Very high | 94.1 | Very high | 51 Ų | 51 | 49 Ų | 49 | 22% | 0.224 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -56.8 | -53.1 | 175.8 | 168 | -110.5 | 0 | 0 | 0 | 111.5 | Y38 C39 L40 L44 S45 L46 A81 L84 P85 | Y38-F42 WeakPolarHBondContact O-CB 3.23Å; Y38-F42 PolarHBondContact O-N 3.15Å; C39-F42 PolarHBondContact O-N 3.26Å; L40-F42 VanDerWaalsContact C-N 3.35Å; F42-L44 PolarHBondContact O-N 2.9Å; F42-S45 PolarHBondContact O-N 3.45Å; F42-L46 HydrophobicContact CE1-CD2 4.45Å; F42-L46 HydrophobicContact CZ-CD2 4.04Å; F42-L46 WeakPolarHBondContact O-CB 3.4Å; F42-L46 PolarHBondContact O-N 3.01Å; F42-A81 HydrophobicContact CD2-CB 4.35Å; F42-A81 VanDerWaalsContact CD2-O 3.29Å; F42-A81 WeakPolarHBondContact CD2-O 3.41Å; F42-L84 HydrophobicContact CB-CD1 4.37Å; F42-P85 HydrophobicContact CD2-CG 4.19Å; F42-P85 HydrophobicContact CE2-CG 4.37Å; F42-P85 HydrophobicContact CG-CG 4.25Å |
| 43 | L | 95.6 | Very high | 94.2 | Very high | 98 Ų | 98 | 45.3 Ų | 45.3 | 51% | 0.513 | 26% | 0.258 | S | S | . | . | H | α-helix | trans | -62.6 | -44.7 | -179.3 | -69.1 | 174.1 | 0 | 0 | 0 | 111.9 | C39 L40 L46 V47 | C39-L43 WeakPolarHBondContact O-CG 3.48Å; C39-L43 PolarHBondContact O-N 3.37Å; L40-L43 PolarHBondContact O-N 2.91Å; L43-L46 PolarHBondContact O-N 3.48Å; L43-V47 WeakPolarHBondContact O-CB 3.35Å; L43-V47 WeakPolarHBondContact O-CG2 3.35Å; L43-V47 PolarHBondContact O-N 3.36Å |
| 44 | L | 94.4 | Very high | 94.1 | Very high | 85 Ų | 85 | 48.4 Ų | 48.4 | 45% | 0.445 | 26% | 0.26 | S | S | . | . | H | α-helix | trans | -67.5 | -41 | -178.9 | -170.9 | 63.7 | 0 | 0 | 0 | 111.7 | L40 V41 F42 G48 C281 V285 | L40-L44 VanDerWaalsContact O-CB 3.28Å; L40-L44 WeakPolarHBondContact O-CB 3.38Å; L40-L44 PolarHBondContact O-N 3.34Å; V41-L44 PolarHBondContact O-N 3.49Å; F42-L44 PolarHBondContact O-N 2.9Å; L44-G48 WeakPolarHBondContact O-CA 3.22Å; L44-G48 PolarHBondContact O-N 3.42Å; L44-C281 HydrophobicContact CB-CB 4.1Å; L44-C281 HydrophobicContact CD2-CB 3.89Å; L44-C281 HydrophobicContact CG-CB 4.02Å; L44-V285 HydrophobicContact CD2-CG2 4.08Å |
| 45 | S | 95.5 | Very high | 93.9 | Very high | 0 Ų | 0 | 48.5 Ų | 48.5 | 0% | 0 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -66.6 | -44.2 | 175.9 | -175.8 | 0 | 0 | 0 | 0 | 111.3 | V41 F42 N49 A81 C280 | V41-S45 WeakPolarHBondContact O-CB 3.28Å; V41-S45 PolarHBondContact O-N 2.9Å; F42-S45 PolarHBondContact O-N 3.45Å; S45-N49 VanDerWaalsContact O-CB 3.24Å; S45-N49 WeakPolarHBondContact O-CB 3.28Å; S45-N49 PolarHBondContact O-N 2.93Å; S45-N49 PolarHBondContact O-ND2 2.9Å; S45-N49 VanDerWaalsContact O-ND2 3.16Å; S45-N49 PolarHBondContact OG-ND2 3.44Å; S45-A81 WeakPolarHBondContact OG-CB 3.29Å; S45-C280 PolarHBondContact OG-O 3.16Å |
| 46 | L | 95.6 | Very high | 93.7 | Very high | 62 Ų | 62 | 47.8 Ų | 47.8 | 33% | 0.325 | 26% | 0.256 | S | S | . | . | H | α-helix | trans | -58.9 | -57.2 | 177.7 | -175.6 | 65.2 | 0 | 0 | 0 | 110.7 | F42 L43 G48 S50 L78 | F42-L46 HydrophobicContact CE1-CD2 4.45Å; F42-L46 HydrophobicContact CZ-CD2 4.04Å; F42-L46 WeakPolarHBondContact O-CB 3.4Å; F42-L46 PolarHBondContact O-N 3.01Å; L43-L46 PolarHBondContact O-N 3.48Å; L46-G48 PolarHBondContact O-N 3.01Å; L46-S50 WeakPolarHBondContact O-CB 3.35Å; L46-S50 PolarHBondContact O-N 2.95Å; L46-S50 PolarHBondContact O-OG 3.47Å; L46-L78 HydrophobicContact CD1-CD2 3.99Å |
| 47 | V | 93.9 | Very high | 93.4 | Very high | 100 Ų | 100 | 47.4 Ų | 47.4 | 61% | 0.606 | 26% | 0.258 | S | S | * | . | H | α-helix | trans | -62.8 | -46.6 | -179.3 | 174.7 | 0 | 0 | 0 | 0 | 111 | L43 L51 | L43-V47 WeakPolarHBondContact O-CB 3.35Å; L43-V47 WeakPolarHBondContact O-CG2 3.35Å; L43-V47 PolarHBondContact O-N 3.36Å; V47-L51 WeakPolarHBondContact O-CB 3.02Å; V47-L51 PolarHBondContact O-N 3.27Å |
| 48 | G | 92.3 | Very high | 93 | Very high | 11 Ų | 11 | 51.5 Ų | 51.5 | 11% | 0.113 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -65.3 | -53.5 | -175.2 | 0 | 0 | 0 | 0 | 0 | 112.9 | L44 L46 L51 V52 P284 | L44-G48 WeakPolarHBondContact O-CA 3.22Å; L44-G48 PolarHBondContact O-N 3.42Å; L46-G48 PolarHBondContact O-N 3.01Å; G48-L51 PolarHBondContact O-N 2.84Å; G48-V52 VanDerWaalsContact O-CG2 3.3Å; G48-V52 WeakPolarHBondContact O-CG2 3.13Å; G48-V52 PolarHBondContact O-N 3.48Å; G48-P284 VanDerWaalsContact C-CG 3.41Å; G48-P284 VanDerWaalsContact CA-CB 3.49Å |
| 49 | N | 94.9 | Very high | 92.4 | Very high | 0 Ų | 0 | 54.8 Ų | 54.8 | 0% | 0 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -71.3 | -36.3 | -177.5 | -72.4 | -62.6 | 0 | 0 | 0 | 111.7 | S45 L51 V52 L53 C74 L78 C280 P284 | S45-N49 VanDerWaalsContact O-CB 3.24Å; S45-N49 WeakPolarHBondContact O-CB 3.28Å; S45-N49 PolarHBondContact O-N 2.93Å; S45-N49 PolarHBondContact O-ND2 2.9Å; S45-N49 VanDerWaalsContact O-ND2 3.16Å; S45-N49 PolarHBondContact OG-ND2 3.44Å; N49-L51 VanDerWaalsContact C-N 3.35Å; N49-L51 PolarHBondContact O-N 3.32Å; N49-V52 PolarHBondContact O-N 3.23Å; N49-L53 WeakPolarHBondContact O-CG 3.24Å; N49-L53 PolarHBondContact O-N 3.22Å; N49-C74 HydrophobicContact CB-CB 4.13Å; N49-C74 PolarHBondContact OD1-SG 3.39Å; N49-C74 VanDerWaalsContact OD1-SG 3.33Å; N49-L78 HydrophobicContact CB-CD1 4.23Å; N49-L78 HydrophobicContact CB-CD2 3.82Å; N49-L78 HydrophobicContact CB-CG 3.68Å; N49-C280 PolarHBondContact ND2-O 3.25Å; N49-P284 HydrophobicContact CB-CG 4.34Å; N49-P284 VanDerWaalsContact CG-CG 3.5Å; N49-P284 WeakPolarHBondContact OD1-CG 3.44Å |
| 50 | S | 93.6 | Very high | 91.9 | Very high | 53 Ų | 53 | 53.9 Ų | 53.9 | 37% | 0.371 | 28% | 0.277 | S | S | . | . | H | α-helix | trans | -63.4 | -39.4 | 172.5 | -64.1 | 0 | 0 | 0 | 0 | 112.4 | L46 L53 W54 | L46-S50 WeakPolarHBondContact O-CB 3.35Å; L46-S50 PolarHBondContact O-N 2.95Å; L46-S50 PolarHBondContact O-OG 3.47Å; S50-L53 PolarHBondContact O-N 3.39Å; S50-W54 WeakPolarHBondContact O-CB 3.48Å; S50-W54 PolarHBondContact O-N 3.32Å |
| 51 | L | 91 | Very high | 91.1 | Very high | 53 Ų | 53 | 51.9 Ų | 51.9 | 28% | 0.277 | 27% | 0.272 | S | S | . | . | H | α-helix | trans | -64.4 | -42.4 | 174.8 | 179.7 | 65 | 0 | 0 | 0 | 111.6 | V47 G48 N49 W54 V55 F294 L298 | V47-L51 WeakPolarHBondContact O-CB 3.02Å; V47-L51 PolarHBondContact O-N 3.27Å; G48-L51 PolarHBondContact O-N 2.84Å; N49-L51 VanDerWaalsContact C-N 3.35Å; N49-L51 PolarHBondContact O-N 3.32Å; L51-W54 HydrophobicContact CD1-CE3 4.21Å; L51-W54 PolarHBondContact O-N 2.87Å; L51-V55 HydrophobicContact CD1-CG2 4.36Å; L51-V55 WeakPolarHBondContact O-CG2 3.3Å; L51-V55 PolarHBondContact O-N 3.47Å; L51-F294 HydrophobicContact CD2-CZ 3.97Å; L51-F294 HydrophobicContact CG-CZ 3.98Å; L51-L298 HydrophobicContact CD1-CD1 4.44Å; L51-L298 HydrophobicContact CD2-CD1 3.94Å |
| 52 | V | 91.3 | Very high | 90.5 | Very high | 4 Ų | 4 | 54.8 Ų | 54.8 | 2% | 0.024 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -61.4 | -47.1 | 175.6 | 174.7 | 0 | 0 | 0 | 0 | 110.9 | G48 N49 W54 V55 L56 I70 C74 Y287 F294 | G48-V52 VanDerWaalsContact O-CG2 3.3Å; G48-V52 WeakPolarHBondContact O-CG2 3.13Å; G48-V52 PolarHBondContact O-N 3.48Å; N49-V52 PolarHBondContact O-N 3.23Å; V52-W54 PolarHBondContact O-N 2.85Å; V52-V55 PolarHBondContact O-N 3.37Å; V52-L56 HydrophobicContact CG1-CD1 3.88Å; V52-L56 HydrophobicContact CG1-CG 4.31Å; V52-L56 WeakPolarHBondContact O-CB 3.36Å; V52-L56 VanDerWaalsContact O-CG 3.28Å; V52-L56 WeakPolarHBondContact O-CG 3.3Å; V52-L56 PolarHBondContact O-N 3.46Å; V52-I70 HydrophobicContact CG1-CG2 4.01Å; V52-C74 WeakPolarHBondContact CG1-SG 3.5Å; V52-Y287 HydrophobicContact CG1-CD2 4.21Å; V52-Y287 HydrophobicContact CG1-CE2 4.28Å; V52-Y287 HydrophobicContact CG2-CD2 3.77Å; V52-Y287 HydrophobicContact CG2-CG 4.49Å; V52-F294 HydrophobicContact CB-CE2 4.35Å; V52-F294 HydrophobicContact CG2-CD2 4.48Å; V52-F294 HydrophobicContact CG2-CE2 3.76Å; V52-F294 HydrophobicContact CG2-CZ 3.87Å |
| 53 | L | 92.2 | Very high | 89.8 | Confident | 28 Ų | 28 | 58 Ų | 58 | 15% | 0.147 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -57.3 | -47.7 | 175.2 | -75.1 | 177.5 | 0 | 0 | 0 | 112 | N49 S50 V55 L56 V57 L71 C74 L75 L78 | N49-L53 WeakPolarHBondContact O-CG 3.24Å; N49-L53 PolarHBondContact O-N 3.22Å; S50-L53 PolarHBondContact O-N 3.39Å; L53-V55 PolarHBondContact O-N 2.93Å; L53-L56 PolarHBondContact O-N 3.17Å; L53-V57 WeakPolarHBondContact O-CG2 3.48Å; L53-V57 PolarHBondContact O-N 3.11Å; L53-L71 HydrophobicContact CD2-CB 4.29Å; L53-L71 HydrophobicContact CD2-CD1 4.47Å; L53-L71 HydrophobicContact CD2-CG 3.7Å; L53-C74 HydrophobicContact CD1-CB 4.32Å; L53-C74 HydrophobicContact CD2-CB 3.76Å; L53-C74 HydrophobicContact CG-CB 3.75Å; L53-L75 HydrophobicContact CD1-CD2 3.99Å; L53-L75 HydrophobicContact CD2-CG 4.49Å; L53-L78 HydrophobicContact CD1-CD1 3.43Å; L53-L78 VanDerWaalsContact CD1-CD1 3.43Å |
| 54 | W | 90.4 | Very high | 89.3 | Confident | 106 Ų | 106 | 55.4 Ų | 55.4 | 40% | 0.402 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -62.4 | -44.6 | 179.9 | 179.2 | 81.8 | 0 | 0 | 0 | 111.9 | S50 L51 V52 L56 V57 K58 Y59 V301 | S50-W54 WeakPolarHBondContact O-CB 3.48Å; S50-W54 PolarHBondContact O-N 3.32Å; L51-W54 HydrophobicContact CD1-CE3 4.21Å; L51-W54 PolarHBondContact O-N 2.87Å; V52-W54 PolarHBondContact O-N 2.85Å; W54-L56 VanDerWaalsContact C-N 3.34Å; W54-L56 PolarHBondContact O-N 3.39Å; W54-V57 PolarHBondContact O-N 2.92Å; W54-K58 HydrophobicContact CZ2-CG 4.46Å; W54-K58 WeakPolarHBondContact O-CB 3.47Å; W54-K58 PolarHBondContact O-N 3.45Å; W54-Y59 HydrophobicContact CE3-CE2 4.45Å; W54-Y59 AromaticContact CH2-CE2 3.68Å; W54-Y59 HydrophobicContact CH2-CE2 3.68Å; W54-Y59 HydrophobicContact CZ2-CE2 4.41Å; W54-Y59 AromaticContact CZ3-CE2 3.71Å; W54-Y59 HydrophobicContact CZ3-CE2 3.71Å; W54-V301 HydrophobicContact CH2-CB 4.31Å; W54-V301 HydrophobicContact CH2-CG1 3.67Å; W54-V301 HydrophobicContact CH2-CG2 3.66Å; W54-V301 HydrophobicContact CZ3-CB 4.15Å; W54-V301 HydrophobicContact CZ3-CG1 3.59Å; W54-V301 HydrophobicContact CZ3-CG2 3.42Å; W54-V301 VanDerWaalsContact CZ3-CG2 3.42Å |
| 55 | V | 87.8 | Confident | 89 | Confident | 4 Ų | 4 | 52.2 Ų | 52.2 | 2% | 0.024 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -62.3 | -42.5 | 176 | 170.1 | 0 | 0 | 0 | 0 | 111.2 | L51 V52 L53 K58 Y59 F294 H297 | L51-V55 HydrophobicContact CD1-CG2 4.36Å; L51-V55 WeakPolarHBondContact O-CG2 3.3Å; L51-V55 PolarHBondContact O-N 3.47Å; V52-V55 PolarHBondContact O-N 3.37Å; L53-V55 PolarHBondContact O-N 2.93Å; V55-K58 PolarHBondContact O-N 3.47Å; V55-Y59 HydrophobicContact CG1-CD2 4.27Å; V55-Y59 WeakPolarHBondContact O-CB 3.45Å; V55-Y59 PolarHBondContact O-N 2.98Å; V55-F294 HydrophobicContact CB-CD2 4.43Å; V55-F294 HydrophobicContact CB-CE2 4.02Å; V55-F294 HydrophobicContact CG1-CD2 4.15Å; V55-F294 HydrophobicContact CG1-CE2 4.23Å; V55-F294 HydrophobicContact CG2-CE2 3.91Å; V55-H297 HydrophobicContact CG1-CB 3.76Å |
| 56 | L | 89.1 | Confident | 88.7 | Confident | 13 Ų | 13 | 52.6 Ų | 52.6 | 7% | 0.068 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -64.4 | -42.2 | 179.9 | -76.7 | 174 | 0 | 0 | 0 | 112.7 | V52 L53 W54 E60 N67 I70 L71 | V52-L56 HydrophobicContact CG1-CD1 3.88Å; V52-L56 HydrophobicContact CG1-CG 4.31Å; V52-L56 WeakPolarHBondContact O-CB 3.36Å; V52-L56 VanDerWaalsContact O-CG 3.28Å; V52-L56 WeakPolarHBondContact O-CG 3.3Å; V52-L56 PolarHBondContact O-N 3.46Å; L53-L56 PolarHBondContact O-N 3.17Å; W54-L56 VanDerWaalsContact C-N 3.34Å; W54-L56 PolarHBondContact O-N 3.39Å; L56-E60 HydrophobicContact CD2-CB 4.18Å; L56-E60 HydrophobicContact CD2-CG 4.23Å; L56-E60 CarbonylContact O-C 3.38Å; L56-E60 PolarHBondContact O-N 3.46Å; L56-N67 HydrophobicContact CD2-CB 4.23Å; L56-I70 HydrophobicContact CD1-CB 4.11Å; L56-I70 HydrophobicContact CD1-CG2 3.65Å; L56-L71 HydrophobicContact CD1-CB 4.33Å |
| 57 | V | 89.1 | Confident | 88.4 | Confident | 96 Ų | 96 | 50.5 Ų | 50.5 | 58% | 0.582 | 27% | 0.267 | S | S | * | . | H | α-helix | trans | -74 | -35.8 | 179.8 | 174.6 | 0 | 0 | 0 | 0 | 111.2 | L53 W54 L71 | L53-V57 WeakPolarHBondContact O-CG2 3.48Å; L53-V57 PolarHBondContact O-N 3.11Å; W54-V57 PolarHBondContact O-N 2.92Å; V57-L71 HydrophobicContact CG2-CD1 4.42Å |
| 58 | K | 87.1 | Confident | 88.3 | Confident | 142 Ų | 142 | 46.9 Ų | 46.9 | 62% | 0.617 | 24% | 0.244 | S | C | * | . | H | α-helix | trans | -86 | -40.8 | -173.6 | -173.5 | 61.6 | 176.8 | -177.2 | 0 | 114.2 | W54 V55 | W54-K58 HydrophobicContact CZ2-CG 4.46Å; W54-K58 WeakPolarHBondContact O-CB 3.47Å; W54-K58 PolarHBondContact O-N 3.45Å; V55-K58 PolarHBondContact O-N 3.47Å |
| 59 | Y | 82.9 | Confident | 88.4 | Confident | 69 Ų | 69 | 46.5 Ų | 46.5 | 27% | 0.271 | 24% | 0.239 | S | C | . | . | H | α-helix | trans | -116.7 | -16.5 | -168.2 | -63 | -74.7 | 0 | 0 | 0 | 114.5 | W54 V55 H297 V301 Q304 | W54-Y59 HydrophobicContact CE3-CE2 4.45Å; W54-Y59 AromaticContact CH2-CE2 3.68Å; W54-Y59 HydrophobicContact CH2-CE2 3.68Å; W54-Y59 HydrophobicContact CZ2-CE2 4.41Å; W54-Y59 AromaticContact CZ3-CE2 3.71Å; W54-Y59 HydrophobicContact CZ3-CE2 3.71Å; V55-Y59 HydrophobicContact CG1-CD2 4.27Å; V55-Y59 WeakPolarHBondContact O-CB 3.45Å; V55-Y59 PolarHBondContact O-N 2.98Å; Y59-H297 AromaticContact CG-ND1 3.86Å; Y59-V301 HydrophobicContact CD2-CG2 4.41Å; Y59-V301 HydrophobicContact CE2-CG2 3.42Å; Y59-V301 VanDerWaalsContact CE2-CG2 3.42Å; Y59-V301 WeakPolarHBondContact OH-CG2 3.49Å; Y59-Q304 PolarHBondContact OH-OE1 3.43Å |
| 60 | E | 84.7 | Confident | 88.2 | Confident | 42 Ų | 42 | 47.5 Ų | 47.5 | 20% | 0.196 | 25% | 0.245 | C | C | . | . | S | Bend | trans | -111.4 | 152.2 | 178.4 | -68 | -83.9 | -178.5 | 0 | 0 | 109.5 | L56 H297 | L56-E60 HydrophobicContact CD2-CB 4.18Å; L56-E60 HydrophobicContact CD2-CG 4.23Å; L56-E60 CarbonylContact O-C 3.38Å; L56-E60 PolarHBondContact O-N 3.46Å; E60-H297 IonicContact OE1-CD2 3.92Å; E60-H297 IonicContact OE1-NE2 3.46Å; E60-H297 PolarHBondContact OE1-NE2 3.5Å |
| 61 | S | 79.1 | Confident | 88.3 | Confident | 65 Ų | 65 | 46.5 Ų | 46.5 | 46% | 0.455 | 24% | 0.235 | S | C | . | . | trans | -83.7 | 132 | 172.9 | 67.4 | 0 | 0 | 0 | 0 | 109.9 | E63 N67 | S61-E63 PolarHBondContact O-N 3.4Å; S61-N67 PolarHBondContact O-ND2 3.44Å | ||
| 62 | L | 83.3 | Confident | 88.5 | Confident | 69 Ų | 69 | 44.4 Ų | 44.4 | 36% | 0.361 | 22% | 0.224 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -75.6 | 23.4 | 171 | -61.2 | -179.4 | 0 | 0 | 0 | 112.3 | I68 L71 | L62-I68 WeakPolarHBondContact O-CD1 3.23Å; L62-L71 HydrophobicContact CD1-CD1 4.1Å; L62-L71 HydrophobicContact CD2-CD1 3.77Å |
| 63 | E | 83.1 | Confident | 88.6 | Confident | 117 Ų | 117 | 44.3 Ų | 44.3 | 55% | 0.547 | 22% | 0.223 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -86.1 | -27.3 | 176.1 | -63.1 | -174.2 | 152.9 | 0 | 0 | 112.2 | S61 R146 | S61-E63 PolarHBondContact O-N 3.4Å; E63-R146 PolarHBondContact O-NH1 3.02Å |
| 64 | S | 84.9 | Confident | 88.8 | Confident | 44 Ų | 44 | 43 Ų | 43 | 31% | 0.308 | 22% | 0.216 | S | C | . | . | S | Bend | trans | -78.1 | 127.1 | 176.3 | -174.2 | 0 | 0 | 0 | 0 | 111.2 | T66 N67 I68 | S64-T66 PolarHBondContact O-N 3.43Å; S64-T66 VanDerWaalsContact O-N 3.11Å; S64-T66 PolarHBondContact OG-N 2.82Å; S64-N67 PolarHBondContact O-N 3.16Å; S64-I68 PolarHBondContact O-N 3.33Å; S64-I68 VanDerWaalsContact O-N 3.13Å |
| 65 | L | 87.5 | Confident | 89 | Confident | 18 Ų | 18 | 41.2 Ų | 41.2 | 9% | 0.094 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -53.5 | -32.2 | 172.1 | -80 | 169.6 | 0 | 0 | 0 | 112.8 | I68 F69 P141 R146 | L65-I68 PolarHBondContact O-N 3.04Å; L65-F69 HydrophobicContact CB-CE2 4.12Å; L65-F69 HydrophobicContact CB-CZ 4.18Å; L65-F69 HydrophobicContact CD2-CE1 4.32Å; L65-F69 HydrophobicContact CD2-CZ 4.08Å; L65-F69 VanDerWaalsContact O-CD2 3.24Å; L65-F69 WeakPolarHBondContact O-CD2 3.32Å; L65-F69 WeakPolarHBondContact O-CG 3.46Å; L65-F69 PolarHBondContact O-N 3.43Å; L65-P141 HydrophobicContact CD1-CB 3.87Å; L65-P141 HydrophobicContact CD1-CG 3.43Å; L65-P141 VanDerWaalsContact CD1-CG 3.43Å; L65-P141 HydrophobicContact CG-CB 3.97Å; L65-P141 HydrophobicContact CG-CG 3.7Å; L65-R146 HydrophobicContact CD2-CB 4.3Å; L65-R146 HydrophobicContact CD2-CG 3.82Å; L65-R146 HydrophobicContact CG-CG 4.41Å |
| 66 | T | 88.2 | Confident | 89.4 | Confident | 8 Ų | 8 | 41 Ų | 41 | 5% | 0.049 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -70.5 | -38.9 | 178.4 | -60.1 | 0 | 0 | 0 | 0 | 112.5 | S64 I68 F69 I70 H126 R127 | S64-T66 PolarHBondContact O-N 3.43Å; S64-T66 VanDerWaalsContact O-N 3.11Å; S64-T66 PolarHBondContact OG-N 2.82Å; T66-I68 VanDerWaalsContact C-N 3.29Å; T66-I68 PolarHBondContact O-N 2.86Å; T66-F69 PolarHBondContact O-N 2.85Å; T66-I70 HydrophobicContact CG2-CD1 3.99Å; T66-I70 VanDerWaalsContact O-CG1 3.22Å; T66-I70 WeakPolarHBondContact O-CG1 3.26Å; T66-I70 PolarHBondContact O-N 2.92Å; T66-H126 PolarHBondContact OG1-CE1 2.92Å; T66-H126 VanDerWaalsContact OG1-CE1 3.25Å; T66-H126 PolarHBondContact OG1-ND1 3.47Å; T66-H126 VanDerWaalsContact OG1-ND1 3.14Å; T66-R127 PolarHBondContact OG1-NE 3.19Å; T66-R127 PolarHBondContact OG1-NH2 3.06Å |
| 67 | N | 89.6 | Confident | 89.7 | Confident | 19 Ų | 19 | 40.4 Ų | 40.4 | 10% | 0.102 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -66 | -36.8 | 174.9 | -67.4 | -7.6 | 0 | 0 | 0 | 110.5 | L56 S61 S64 L71 | L56-N67 HydrophobicContact CD2-CB 4.23Å; S61-N67 PolarHBondContact O-ND2 3.44Å; S64-N67 PolarHBondContact O-N 3.16Å; N67-L71 VanDerWaalsContact O-CB 3.3Å; N67-L71 WeakPolarHBondContact O-CB 3.24Å; N67-L71 PolarHBondContact O-N 2.86Å |
| 68 | I | 92.5 | Very high | 90.1 | Very high | 23 Ų | 23 | 37 Ų | 37 | 12% | 0.118 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -64.7 | -45.1 | 173.9 | -64.9 | 179 | 0 | 0 | 0 | 111.7 | L62 S64 L65 T66 L71 N72 R146 T150 | L62-I68 WeakPolarHBondContact O-CD1 3.23Å; S64-I68 PolarHBondContact O-N 3.33Å; S64-I68 VanDerWaalsContact O-N 3.13Å; L65-I68 PolarHBondContact O-N 3.04Å; T66-I68 VanDerWaalsContact C-N 3.29Å; T66-I68 PolarHBondContact O-N 2.86Å; I68-L71 WeakPolarHBondContact O-CB 3.47Å; I68-L71 PolarHBondContact O-N 3.4Å; I68-N72 PolarHBondContact O-N 3.33Å; I68-N72 PolarHBondContact O-ND2 3.32Å; I68-R146 HydrophobicContact CD1-CB 3.72Å; I68-R146 HydrophobicContact CD1-CG 3.92Å; I68-T150 WeakPolarHBondContact CG2-OG1 3.42Å |
| 69 | F | 93.3 | Very high | 90.5 | Very high | 4 Ų | 4 | 33 Ų | 33 | 2% | 0.018 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -64.7 | -41.2 | 178.1 | -60 | -27.5 | 0 | 0 | 0 | 112 | L65 T66 L71 N72 L73 F119 I122 M123 H126 V149 | L65-F69 HydrophobicContact CB-CE2 4.12Å; L65-F69 HydrophobicContact CB-CZ 4.18Å; L65-F69 HydrophobicContact CD2-CE1 4.32Å; L65-F69 HydrophobicContact CD2-CZ 4.08Å; L65-F69 VanDerWaalsContact O-CD2 3.24Å; L65-F69 WeakPolarHBondContact O-CD2 3.32Å; L65-F69 WeakPolarHBondContact O-CG 3.46Å; L65-F69 PolarHBondContact O-N 3.43Å; T66-F69 PolarHBondContact O-N 2.85Å; F69-L71 VanDerWaalsContact C-N 3.33Å; F69-L71 PolarHBondContact O-N 3.38Å; F69-N72 PolarHBondContact O-N 3.13Å; F69-L73 WeakPolarHBondContact O-CB 3.33Å; F69-L73 PolarHBondContact O-N 2.98Å; F69-F119 HydrophobicContact CD1-CD1 4.07Å; F69-F119 HydrophobicContact CD1-CE1 4.34Å; F69-I122 HydrophobicContact CD1-CG2 4.19Å; F69-I122 HydrophobicContact CD2-CG2 4.36Å; F69-I122 HydrophobicContact CE1-CG2 4.01Å; F69-I122 HydrophobicContact CE2-CG1 4.5Å; F69-I122 HydrophobicContact CE2-CG2 4.17Å; F69-I122 HydrophobicContact CG-CG2 4.37Å; F69-I122 HydrophobicContact CZ-CD1 4.42Å; F69-I122 HydrophobicContact CZ-CG1 4.13Å; F69-I122 HydrophobicContact CZ-CG2 4Å; F69-M123 HydrophobicContact CB-CB 4.22Å; F69-M123 HydrophobicContact CD2-CB 3.92Å; F69-M123 HydrophobicContact CD2-CG 4.38Å; F69-M123 HydrophobicContact CG-CB 4.43Å; F69-H126 HydrophobicContact CE2-CB 3.86Å; F69-V149 HydrophobicContact CE1-CG1 3.85Å; F69-V149 HydrophobicContact CZ-CG1 4.03Å |
| 70 | I | 92.3 | Very high | 91.1 | Very high | 21 Ų | 21 | 29.8 Ų | 29.8 | 11% | 0.108 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -62.5 | -42.9 | 174.4 | -64.3 | 166.7 | 0 | 0 | 0 | 110.4 | V52 L56 T66 N72 L73 C74 M123 Y287 | V52-I70 HydrophobicContact CG1-CG2 4.01Å; L56-I70 HydrophobicContact CD1-CB 4.11Å; L56-I70 HydrophobicContact CD1-CG2 3.65Å; T66-I70 HydrophobicContact CG2-CD1 3.99Å; T66-I70 VanDerWaalsContact O-CG1 3.22Å; T66-I70 WeakPolarHBondContact O-CG1 3.26Å; T66-I70 PolarHBondContact O-N 2.92Å; I70-N72 PolarHBondContact O-N 3.42Å; I70-L73 PolarHBondContact O-N 3.06Å; I70-C74 PolarHBondContact O-N 3.46Å; I70-C74 PolarHBondContact O-SG 3.44Å; I70-M123 HydrophobicContact CG1-SD 4.29Å; I70-Y287 HydrophobicContact CD1-CE1 4.43Å; I70-Y287 HydrophobicContact CG2-CE1 4.42Å; I70-Y287 HydrophobicContact CG2-CE2 4.07Å; I70-Y287 WeakPolarHBondContact CG2-OH 3.35Å |
| 71 | L | 94.2 | Very high | 91.7 | Very high | 31 Ų | 31 | 27.9 Ų | 27.9 | 16% | 0.162 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -57.8 | -48.5 | 176.8 | 179.3 | 153.4 | 0 | 0 | 0 | 111.4 | L53 L56 V57 L62 N67 I68 F69 L73 C74 L75 | L53-L71 HydrophobicContact CD2-CB 4.29Å; L53-L71 HydrophobicContact CD2-CD1 4.47Å; L53-L71 HydrophobicContact CD2-CG 3.7Å; L56-L71 HydrophobicContact CD1-CB 4.33Å; V57-L71 HydrophobicContact CG2-CD1 4.42Å; L62-L71 HydrophobicContact CD1-CD1 4.1Å; L62-L71 HydrophobicContact CD2-CD1 3.77Å; N67-L71 VanDerWaalsContact O-CB 3.3Å; N67-L71 WeakPolarHBondContact O-CB 3.24Å; N67-L71 PolarHBondContact O-N 2.86Å; I68-L71 WeakPolarHBondContact O-CB 3.47Å; I68-L71 PolarHBondContact O-N 3.4Å; F69-L71 VanDerWaalsContact C-N 3.33Å; F69-L71 PolarHBondContact O-N 3.38Å; L71-L73 VanDerWaalsContact C-N 3.34Å; L71-L73 PolarHBondContact O-N 3.17Å; L71-C74 PolarHBondContact O-N 2.92Å; L71-L75 HydrophobicContact CD2-CD1 3.69Å; L71-L75 HydrophobicContact CD2-CG 4.28Å; L71-L75 WeakPolarHBondContact O-CG 3.47Å; L71-L75 PolarHBondContact O-N 3.49Å |
| 72 | N | 95.6 | Very high | 92.4 | Very high | 10 Ų | 10 | 28.1 Ų | 28.1 | 5% | 0.053 | 16% | 0.156 | C | C | . | . | H | α-helix | trans | -68.1 | -33.8 | 179.5 | -74.7 | -87.8 | 0 | 0 | 0 | 112.6 | I68 F69 I70 L75 S76 F119 T150 W154 | I68-N72 PolarHBondContact O-N 3.33Å; I68-N72 PolarHBondContact O-ND2 3.32Å; F69-N72 PolarHBondContact O-N 3.13Å; I70-N72 PolarHBondContact O-N 3.42Å; N72-L75 PolarHBondContact O-N 2.99Å; N72-S76 PolarHBondContact O-N 3.31Å; N72-F119 HydrophobicContact CB-CD1 4.01Å; N72-F119 HydrophobicContact CB-CD2 3.84Å; N72-F119 HydrophobicContact CB-CE1 3.64Å; N72-F119 HydrophobicContact CB-CE2 3.47Å; N72-F119 VanDerWaalsContact CB-CE2 3.47Å; N72-F119 HydrophobicContact CB-CG 4.13Å; N72-F119 HydrophobicContact CB-CZ 3.37Å; N72-T150 WeakPolarHBondContact ND2-CG2 3.37Å; N72-T150 VanDerWaalsContact OD1-CG2 3.31Å; N72-T150 WeakPolarHBondContact OD1-CG2 3.38Å; N72-W154 PolarHBondContact OD1-NE1 2.86Å |
| 73 | L | 94.3 | Very high | 93 | Very high | 2 Ų | 2 | 25.3 Ų | 25.3 | 1% | 0.01 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -62.4 | -45.6 | 173.3 | -170.2 | 64.9 | 0 | 0 | 0 | 110.9 | F69 I70 L71 L75 S76 D77 L120 N283 | F69-L73 WeakPolarHBondContact O-CB 3.33Å; F69-L73 PolarHBondContact O-N 2.98Å; I70-L73 PolarHBondContact O-N 3.06Å; L71-L73 VanDerWaalsContact C-N 3.34Å; L71-L73 PolarHBondContact O-N 3.17Å; L73-L75 VanDerWaalsContact C-N 3.31Å; L73-L75 PolarHBondContact O-N 2.83Å; L73-S76 WeakPolarHBondContact O-CB 3.18Å; L73-S76 PolarHBondContact O-N 3.21Å; L73-D77 WeakPolarHBondContact O-CB 3.5Å; L73-D77 VanDerWaalsContact O-CG 3.27Å; L73-D77 PolarHBondContact O-N 2.93Å; L73-L120 HydrophobicContact CD1-CG 4.22Å; L73-L120 HydrophobicContact CD2-CD2 4.01Å; L73-N283 WeakPolarHBondContact CD2-ND2 3.23Å |
| 74 | C | 95.1 | Very high | 93.5 | Very high | 0 Ų | 0 | 19.7 Ų | 19.7 | 0% | 0 | 12% | 0.115 | C | C | . | . | H | α-helix | trans | -62.3 | -36.8 | 174.3 | -70.6 | 0 | 0 | 0 | 0 | 112.8 | N49 V52 L53 I70 L71 L78 | N49-C74 HydrophobicContact CB-CB 4.13Å; N49-C74 PolarHBondContact OD1-SG 3.39Å; N49-C74 VanDerWaalsContact OD1-SG 3.33Å; V52-C74 WeakPolarHBondContact CG1-SG 3.5Å; L53-C74 HydrophobicContact CD1-CB 4.32Å; L53-C74 HydrophobicContact CD2-CB 3.76Å; L53-C74 HydrophobicContact CG-CB 3.75Å; I70-C74 PolarHBondContact O-N 3.46Å; I70-C74 PolarHBondContact O-SG 3.44Å; L71-C74 PolarHBondContact O-N 2.92Å; C74-L78 WeakPolarHBondContact O-CB 3.3Å; C74-L78 VanDerWaalsContact O-CG 3.22Å; C74-L78 WeakPolarHBondContact O-CG 3.47Å; C74-L78 PolarHBondContact O-N 3.05Å |
| 75 | L | 95.9 | Very high | 93.8 | Very high | 68 Ų | 68 | 20.4 Ų | 20.4 | 36% | 0.356 | 12% | 0.118 | S | C | . | . | H | α-helix | trans | -63.8 | -45.9 | 174.2 | -71.1 | 176 | 0 | 0 | 0 | 111.3 | L53 L71 N72 L73 L78 V79 | L53-L75 HydrophobicContact CD1-CD2 3.99Å; L53-L75 HydrophobicContact CD2-CG 4.49Å; L71-L75 HydrophobicContact CD2-CD1 3.69Å; L71-L75 HydrophobicContact CD2-CG 4.28Å; L71-L75 WeakPolarHBondContact O-CG 3.47Å; L71-L75 PolarHBondContact O-N 3.49Å; N72-L75 PolarHBondContact O-N 2.99Å; L73-L75 VanDerWaalsContact C-N 3.31Å; L73-L75 PolarHBondContact O-N 2.83Å; L75-L78 PolarHBondContact O-N 3.45Å; L75-V79 VanDerWaalsContact O-CG2 3.3Å; L75-V79 WeakPolarHBondContact O-CG2 3.14Å; L75-V79 PolarHBondContact O-N 3.22Å |
| 76 | S | 96.3 | Very high | 94 | Very high | 1 Ų | 1 | 21.3 Ų | 21.3 | 1% | 0.007 | 12% | 0.124 | C | C | . | . | H | α-helix | trans | -59.3 | -47.7 | 175.7 | -175.8 | 0 | 0 | 0 | 0 | 111.9 | N72 L73 L78 V79 F80 S112 S115 S116 | N72-S76 PolarHBondContact O-N 3.31Å; L73-S76 WeakPolarHBondContact O-CB 3.18Å; L73-S76 PolarHBondContact O-N 3.21Å; S76-L78 VanDerWaalsContact C-N 3.32Å; S76-L78 PolarHBondContact O-N 3.33Å; S76-V79 PolarHBondContact O-N 3.41Å; S76-F80 WeakPolarHBondContact O-CB 3.4Å; S76-F80 PolarHBondContact O-N 2.92Å; S76-S112 VanDerWaalsContact OG-CA 3.28Å; S76-S112 WeakPolarHBondContact OG-CA 3.36Å; S76-S112 PolarHBondContact OG-O 2.94Å; S76-S115 WeakPolarHBondContact CB-OG 3.44Å; S76-S115 PolarHBondContact OG-OG 3.39Å; S76-S116 WeakPolarHBondContact CB-OG 3.42Å; S76-S116 PolarHBondContact OG-OG 3.35Å |
| 77 | D | 95.7 | Very high | 94.1 | Very high | 0 Ų | 0 | 23.2 Ų | 23.2 | 0% | 0 | 13% | 0.131 | C | C | . | . | H | α-helix | trans | -64.3 | -35.1 | -179.8 | -69.1 | -24.3 | 0 | 0 | 0 | 112.6 | L73 A81 H279 C280 N283 | L73-D77 WeakPolarHBondContact O-CB 3.5Å; L73-D77 VanDerWaalsContact O-CG 3.27Å; L73-D77 PolarHBondContact O-N 2.93Å; D77-A81 VanDerWaalsContact O-CB 3.25Å; D77-A81 WeakPolarHBondContact O-CB 3.34Å; D77-A81 PolarHBondContact O-N 3.1Å; D77-H279 IonicContact OD1-NE2 3.7Å; D77-C280 HydrophobicContact CB-CB 3.98Å; D77-N283 PolarHBondContact OD2-ND2 3.36Å |
| 78 | L | 96.2 | Very high | 94.1 | Very high | 23 Ų | 23 | 23.2 Ų | 23.2 | 12% | 0.12 | 13% | 0.131 | C | C | . | . | H | α-helix | trans | -68.7 | -44.6 | 174.3 | -77.4 | 172.4 | 0 | 0 | 0 | 111.8 | L46 N49 L53 C74 L75 S76 F80 A81 C82 | L46-L78 HydrophobicContact CD1-CD2 3.99Å; N49-L78 HydrophobicContact CB-CD1 4.23Å; N49-L78 HydrophobicContact CB-CD2 3.82Å; N49-L78 HydrophobicContact CB-CG 3.68Å; L53-L78 HydrophobicContact CD1-CD1 3.43Å; L53-L78 VanDerWaalsContact CD1-CD1 3.43Å; C74-L78 WeakPolarHBondContact O-CB 3.3Å; C74-L78 VanDerWaalsContact O-CG 3.22Å; C74-L78 WeakPolarHBondContact O-CG 3.47Å; C74-L78 PolarHBondContact O-N 3.05Å; L75-L78 PolarHBondContact O-N 3.45Å; S76-L78 VanDerWaalsContact C-N 3.32Å; S76-L78 PolarHBondContact O-N 3.33Å; L78-F80 VanDerWaalsContact C-N 3.32Å; L78-F80 PolarHBondContact O-N 3.01Å; L78-A81 PolarHBondContact O-N 3.03Å; L78-C82 PolarHBondContact O-N 3.31Å; L78-C82 PolarHBondContact O-SG 3.31Å |
| 79 | V | 95.9 | Very high | 93.8 | Very high | 59 Ų | 59 | 23.1 Ų | 23.1 | 36% | 0.358 | 13% | 0.132 | S | C | . | . | H | α-helix | trans | -59.9 | -46.4 | 175.8 | 172.2 | 0 | 0 | 0 | 0 | 109.8 | L75 S76 A81 C82 L83 I108 S112 | L75-V79 VanDerWaalsContact O-CG2 3.3Å; L75-V79 WeakPolarHBondContact O-CG2 3.14Å; L75-V79 PolarHBondContact O-N 3.22Å; S76-V79 PolarHBondContact O-N 3.41Å; V79-A81 PolarHBondContact O-N 3.44Å; V79-C82 PolarHBondContact O-N 3.18Å; V79-L83 PolarHBondContact O-N 3.43Å; V79-I108 HydrophobicContact CG1-CG2 3.23Å; V79-S112 WeakPolarHBondContact CG1-OG 3.42Å |
| 80 | F | 95.9 | Very high | 93.4 | Very high | 2 Ų | 2 | 25.1 Ų | 25.1 | 1% | 0.009 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -59.2 | -46.3 | 174.5 | -173.2 | -86.5 | 0 | 0 | 0 | 112.3 | S76 L78 C82 L83 L84 F109 W238 F277 H279 C280 | S76-F80 WeakPolarHBondContact O-CB 3.4Å; S76-F80 PolarHBondContact O-N 2.92Å; L78-F80 VanDerWaalsContact C-N 3.32Å; L78-F80 PolarHBondContact O-N 3.01Å; F80-C82 VanDerWaalsContact C-N 3.3Å; F80-C82 PolarHBondContact O-N 2.86Å; F80-L83 WeakPolarHBondContact O-CB 3.36Å; F80-L83 PolarHBondContact O-N 3.39Å; F80-L84 HydrophobicContact CE1-CD2 3.92Å; F80-L84 HydrophobicContact CE1-CG 4.48Å; F80-F109 HydrophobicContact CD2-CD2 4.14Å; F80-F109 HydrophobicContact CD2-CE2 4.3Å; F80-F109 AromaticContact CE2-CD2 3.56Å; F80-F109 HydrophobicContact CE2-CD2 3.56Å; F80-F109 AromaticContact CE2-CE2 3.3Å; F80-F109 HydrophobicContact CE2-CE2 3.3Å; F80-F109 HydrophobicContact CE2-CZ 4.22Å; F80-F109 HydrophobicContact CZ-CD2 4.33Å; F80-F109 AromaticContact CZ-CE2 3.83Å; F80-F109 HydrophobicContact CZ-CE2 3.83Å; F80-W238 HydrophobicContact CE2-CH2 4.16Å; F80-W238 HydrophobicContact CE2-CZ2 4.09Å; F80-W238 HydrophobicContact CZ-CH2 4.3Å; F80-W238 HydrophobicContact CZ-CZ2 4.18Å; F80-F277 HydrophobicContact CE1-CB 4.17Å; F80-F277 HydrophobicContact CE1-CG 4.23Å; F80-F277 WeakPolarHBondContact CE1-O 3.41Å; F80-F277 HydrophobicContact CZ-CB 4.19Å; F80-F277 AromaticContact CZ-CD1 3.8Å; F80-F277 HydrophobicContact CZ-CD1 3.8Å; F80-F277 HydrophobicContact CZ-CD2 4.28Å; F80-F277 HydrophobicContact CZ-CE1 4.25Å; F80-F277 AromaticContact CZ-CG 3.83Å; F80-F277 HydrophobicContact CZ-CG 3.83Å; F80-H279 AromaticContact CD1-CE1 3.98Å; F80-H279 AromaticContact CE1-CE1 3.93Å; F80-H279 AromaticContact CZ-CE1 3.99Å; F80-C280 HydrophobicContact CD1-CB 4Å |
| 81 | A | 96.2 | Very high | 93 | Very high | 1 Ų | 1 | 26.7 Ų | 26.7 | 1% | 0.008 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -59.7 | -41.3 | 179.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | F42 S45 D77 L78 V79 L83 L84 P85 | F42-A81 HydrophobicContact CD2-CB 4.35Å; F42-A81 VanDerWaalsContact CD2-O 3.29Å; F42-A81 WeakPolarHBondContact CD2-O 3.41Å; S45-A81 WeakPolarHBondContact OG-CB 3.29Å; D77-A81 VanDerWaalsContact O-CB 3.25Å; D77-A81 WeakPolarHBondContact O-CB 3.34Å; D77-A81 PolarHBondContact O-N 3.1Å; L78-A81 PolarHBondContact O-N 3.03Å; V79-A81 PolarHBondContact O-N 3.44Å; A81-L83 PolarHBondContact O-N 3.36Å; A81-L84 WeakPolarHBondContact O-CB 3.25Å; A81-L84 PolarHBondContact O-N 3Å; A81-P85 WeakPolarHBondContact O-CD 3.46Å |
| 82 | C | 95.3 | Very high | 92.5 | Very high | 71 Ų | 71 | 29.3 Ų | 29.3 | 48% | 0.48 | 16% | 0.161 | S | C | . | . | H | α-helix | trans | -62.4 | -19.9 | 176.4 | -70.6 | 0 | 0 | 0 | 0 | 113.6 | L78 V79 F80 | L78-C82 PolarHBondContact O-N 3.31Å; L78-C82 PolarHBondContact O-SG 3.31Å; V79-C82 PolarHBondContact O-N 3.18Å; F80-C82 VanDerWaalsContact C-N 3.3Å; F80-C82 PolarHBondContact O-N 2.86Å |
| 83 | L | 94.7 | Very high | 91.9 | Very high | 9 Ų | 9 | 38 Ų | 38 | 5% | 0.047 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -80.3 | -25.2 | 173.3 | -58.4 | 176.9 | 0 | 0 | 0 | 112.8 | V79 F80 A81 V86 W87 L105 I108 F109 | V79-L83 PolarHBondContact O-N 3.43Å; F80-L83 WeakPolarHBondContact O-CB 3.36Å; F80-L83 PolarHBondContact O-N 3.39Å; A81-L83 PolarHBondContact O-N 3.36Å; L83-V86 WeakPolarHBondContact O-CA 3.5Å; L83-V86 WeakPolarHBondContact O-CB 3.48Å; L83-V86 PolarHBondContact O-N 3Å; L83-W87 VanDerWaalsContact C-CD1 3.48Å; L83-W87 PolarHBondContact O-N 3.43Å; L83-L105 HydrophobicContact CD2-CD2 3.55Å; L83-I108 HydrophobicContact CD1-CB 4.26Å; L83-I108 HydrophobicContact CD1-CG2 3.94Å; L83-I108 HydrophobicContact CD2-CB 4.26Å; L83-I108 HydrophobicContact CD2-CG2 3.99Å; L83-I108 HydrophobicContact CG-CG2 4.25Å; L83-F109 VanDerWaalsContact CD1-CA 3.5Å; L83-F109 HydrophobicContact CD1-CB 3.77Å |
| 84 | L | 94.3 | Very high | 91.4 | Very high | 0 Ų | 0 | 39.4 Ų | 39.4 | 0% | 0 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -54.2 | -44.7 | -175.2 | -65.7 | 175.5 | 0 | 0 | 0 | 113.5 | Y38 V41 F42 F80 A81 V86 W87 I88 F277 | Y38-L84 HydrophobicContact CD2-CD2 4.21Å; Y38-L84 HydrophobicContact CE2-CD2 4.42Å; Y38-L84 HydrophobicContact CG-CD2 4.32Å; V41-L84 HydrophobicContact CB-CD1 4.02Å; V41-L84 HydrophobicContact CG1-CD1 3.52Å; F42-L84 HydrophobicContact CB-CD1 4.37Å; F80-L84 HydrophobicContact CE1-CD2 3.92Å; F80-L84 HydrophobicContact CE1-CG 4.48Å; A81-L84 WeakPolarHBondContact O-CB 3.25Å; A81-L84 PolarHBondContact O-N 3Å; L84-V86 PolarHBondContact O-N 2.85Å; L84-W87 PolarHBondContact O-N 3.35Å; L84-W87 VanDerWaalsContact O-N 3.12Å; L84-I88 WeakPolarHBondContact O-CG1 3.11Å; L84-I88 PolarHBondContact O-N 2.84Å; L84-F277 HydrophobicContact CD2-CB 4.03Å; L84-F277 HydrophobicContact CD2-CD2 3.64Å; L84-F277 HydrophobicContact CD2-CG 4.22Å |
| 85 | P | 91.5 | Very high | 91.1 | Very high | 59 Ų | 59 | 41 Ų | 41 | 38% | 0.383 | 22% | 0.215 | S | C | . | . | H | α-helix | trans | -59.2 | -35.3 | 175.3 | -24.3 | 35.2 | 0 | 0 | 0 | 113.1 | F42 A81 I88 | F42-P85 HydrophobicContact CD2-CG 4.19Å; F42-P85 HydrophobicContact CE2-CG 4.37Å; F42-P85 HydrophobicContact CG-CG 4.25Å; A81-P85 WeakPolarHBondContact O-CD 3.46Å; P85-I88 WeakPolarHBondContact O-CB 3.24Å; P85-I88 PolarHBondContact O-N 3.18Å |
| 86 | V | 91.3 | Very high | 90.7 | Very high | 37 Ų | 37 | 42.5 Ų | 42.5 | 22% | 0.224 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -70.3 | -38 | 177.6 | -173.3 | 0 | 0 | 0 | 0 | 110.9 | L83 L84 I88 S89 P90 W95 L97 L105 | L83-V86 WeakPolarHBondContact O-CA 3.5Å; L83-V86 WeakPolarHBondContact O-CB 3.48Å; L83-V86 PolarHBondContact O-N 3Å; L84-V86 PolarHBondContact O-N 2.85Å; V86-I88 PolarHBondContact O-N 2.98Å; V86-S89 WeakPolarHBondContact O-CB 3.37Å; V86-S89 PolarHBondContact O-N 3.37Å; V86-S89 VanDerWaalsContact O-N 3.13Å; V86-P90 VanDerWaalsContact O-CD 3.26Å; V86-P90 WeakPolarHBondContact O-CD 3.22Å; V86-W95 HydrophobicContact CG1-CH2 4.48Å; V86-L97 HydrophobicContact CG1-CD1 3.47Å; V86-L97 VanDerWaalsContact CG1-CD1 3.47Å; V86-L105 HydrophobicContact CB-CD1 4.47Å; V86-L105 HydrophobicContact CG1-CD1 3.48Å; V86-L105 VanDerWaalsContact CG1-CD1 3.48Å |
| 87 | W | 89.6 | Confident | 90.4 | Very high | 48 Ų | 48 | 45.7 Ų | 45.7 | 18% | 0.182 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -67.1 | -16.4 | 174.7 | -67.5 | 116 | 0 | 0 | 0 | 114 | Y38 L83 L84 Y91 N106 F109 F277 | Y38-W87 HydrophobicContact CD2-CB 4.49Å; Y38-W87 HydrophobicContact CE2-CB 4.19Å; L83-W87 VanDerWaalsContact C-CD1 3.48Å; L83-W87 PolarHBondContact O-N 3.43Å; L84-W87 PolarHBondContact O-N 3.35Å; L84-W87 VanDerWaalsContact O-N 3.12Å; W87-Y91 WeakPolarHBondContact O-CD2 3.38Å; W87-Y91 WeakPolarHBondContact O-CE2 3.3Å; W87-N106 WeakPolarHBondContact CH2-OD1 3.22Å; W87-F109 HydrophobicContact CZ2-CB 4.1Å; W87-F109 HydrophobicContact CZ2-CD2 4.14Å; W87-F109 HydrophobicContact CZ2-CG 4.18Å; W87-F109 AromaticContact NE1-CD2 3.95Å; W87-F277 HydrophobicContact CB-CE2 4.43Å; W87-F277 HydrophobicContact CG-CE2 4.13Å |
| 88 | I | 89.1 | Confident | 90.2 | Very high | 19 Ų | 19 | 47.3 Ų | 47.3 | 10% | 0.097 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -77.5 | -33.9 | 172 | -62.2 | 168.7 | 0 | 0 | 0 | 111.2 | T35 Y38 L84 P85 V86 Y91 | T35-I88 HydrophobicContact CG2-CD1 4.45Å; T35-I88 HydrophobicContact CG2-CG2 3.9Å; Y38-I88 HydrophobicContact CD2-CG1 3.82Å; Y38-I88 HydrophobicContact CG-CG1 4.3Å; L84-I88 WeakPolarHBondContact O-CG1 3.11Å; L84-I88 PolarHBondContact O-N 2.84Å; P85-I88 WeakPolarHBondContact O-CB 3.24Å; P85-I88 PolarHBondContact O-N 3.18Å; V86-I88 PolarHBondContact O-N 2.98Å; I88-Y91 WeakPolarHBondContact O-CD2 3.44Å; I88-Y91 PolarHBondContact O-N 2.72Å; I88-Y91 VanDerWaalsContact O-N 3.14Å |
| 89 | S | 86.4 | Confident | 89.9 | Confident | 20 Ų | 20 | 49.3 Ų | 49.3 | 14% | 0.14 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -53.1 | -44.5 | -173.1 | 178.5 | 0 | 0 | 0 | 0 | 114.1 | V86 Y91 H92 W93 | V86-S89 WeakPolarHBondContact O-CB 3.37Å; V86-S89 PolarHBondContact O-N 3.37Å; V86-S89 VanDerWaalsContact O-N 3.13Å; S89-Y91 PolarHBondContact O-N 3.37Å; S89-H92 PolarHBondContact O-N 3.32Å; S89-H92 VanDerWaalsContact O-N 3.11Å; S89-W93 PolarHBondContact O-N 3.22Å |
| 90 | P | 85.1 | Confident | 89.7 | Confident | 47 Ų | 47 | 53.7 Ų | 53.7 | 31% | 0.305 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -62.3 | -26.4 | -177.6 | -26.2 | 37.2 | 0 | 0 | 0 | 114.6 | V86 H92 G94 W95 | V86-P90 VanDerWaalsContact O-CD 3.26Å; V86-P90 WeakPolarHBondContact O-CD 3.22Å; P90-H92 VanDerWaalsContact C-N 3.25Å; P90-H92 PolarHBondContact O-N 3Å; P90-G94 WeakPolarHBondContact O-CA 3.41Å; P90-G94 PolarHBondContact O-N 3.01Å; P90-G94 VanDerWaalsContact O-N 3.17Å; P90-W95 HydrophobicContact CG-CE3 3.87Å; P90-W95 HydrophobicContact CG-CZ3 4.37Å |
| 91 | Y | 83.7 | Confident | 89.6 | Confident | 53 Ų | 53 | 56.4 Ų | 56.4 | 21% | 0.208 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -71.8 | -19.9 | 178.4 | -59.5 | -84.2 | 0 | 0 | 0 | 113.5 | T34 W87 I88 S89 R273 | T34-Y91 HydrophobicContact CG2-CE2 4.03Å; W87-Y91 WeakPolarHBondContact O-CD2 3.38Å; W87-Y91 WeakPolarHBondContact O-CE2 3.3Å; I88-Y91 WeakPolarHBondContact O-CD2 3.44Å; I88-Y91 PolarHBondContact O-N 2.72Å; I88-Y91 VanDerWaalsContact O-N 3.14Å; S89-Y91 PolarHBondContact O-N 3.37Å; Y91-R273 PolarHBondContact OH-NE 2.8Å; Y91-R273 PolarHBondContact OH-NH2 2.73Å |
| 92 | H | 83.6 | Confident | 89.4 | Confident | 86 Ų | 86 | 56.4 Ų | 56.4 | 40% | 0.398 | 30% | 0.299 | S | S | . | . | H | α-helix | trans | -109.3 | -40.1 | -176.4 | -66.4 | -78.5 | 0 | 0 | 0 | 112.8 | T35 S89 P90 | T35-H92 PolarHBondContact OG1-NE2 3.07Å; S89-H92 PolarHBondContact O-N 3.32Å; S89-H92 VanDerWaalsContact O-N 3.11Å; P90-H92 VanDerWaalsContact C-N 3.25Å; P90-H92 PolarHBondContact O-N 3Å |
| 93 | W | 83.3 | Confident | 89.4 | Confident | 193 Ų | 193 | 56 Ų | 56 | 73% | 0.731 | 29% | 0.29 | S | S | * | . | H | α-helix | trans | -125.9 | 2.9 | -172.4 | -55.5 | -66.1 | 0 | 0 | 0 | 113.9 | S89 | S89-W93 PolarHBondContact O-N 3.22Å |
| 94 | G | 84.4 | Confident | 89.3 | Confident | 32 Ų | 32 | 58.1 Ų | 58.1 | 33% | 0.33 | 30% | 0.301 | S | S | . | . | trans | 67.2 | -174.3 | -166.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | P90 V96 | P90-G94 WeakPolarHBondContact O-CA 3.41Å; P90-G94 PolarHBondContact O-N 3.01Å; P90-G94 VanDerWaalsContact O-N 3.17Å; G94-V96 PolarHBondContact O-N 3.17Å | ||
| 95 | W | 88.2 | Confident | 89.3 | Confident | 32 Ų | 32 | 59.1 Ų | 59.1 | 12% | 0.121 | 31% | 0.306 | C | S | . | . | trans | -83.1 | 106.1 | 178.8 | -172.5 | -89.3 | 0 | 0 | 0 | 111.5 | V86 P90 L97 G98 L101 C102 L105 C175 | V86-W95 HydrophobicContact CG1-CH2 4.48Å; P90-W95 HydrophobicContact CG-CE3 3.87Å; P90-W95 HydrophobicContact CG-CZ3 4.37Å; W95-L97 HydrophobicContact CH2-CD1 4.24Å; W95-L97 HydrophobicContact CZ2-CB 3.82Å; W95-L97 HydrophobicContact CZ2-CD1 4.25Å; W95-G98 PolarHBondContact NE1-O 3.32Å; W95-L101 HydrophobicContact CZ2-CB 4.42Å; W95-C102 HydrophobicContact CZ2-CB 3.77Å; W95-L105 HydrophobicContact CH2-CD1 3.59Å; W95-L105 HydrophobicContact CZ2-CD1 4.11Å; W95-C175 HydrophobicContact CB-CB 4.43Å; W95-C175 HydrophobicContact CD2-CB 3.44Å; W95-C175 VanDerWaalsContact CD2-CB 3.44Å; W95-C175 HydrophobicContact CE3-CB 3.69Å; W95-C175 HydrophobicContact CG-CB 3.75Å; W95-C175 HydrophobicContact CH2-CB 4.47Å; W95-C175 HydrophobicContact CZ2-CB 4.31Å; W95-C175 HydrophobicContact CZ3-CB 4.19Å | ||
| 96 | V | 89.1 | Confident | 89.4 | Confident | 101 Ų | 101 | 57 Ų | 57 | 61% | 0.612 | 29% | 0.291 | S | S | * | . | trans | -110.2 | -4.4 | -177.5 | -60.6 | 0 | 0 | 0 | 0 | 114.4 | G94 G98 | G94-V96 PolarHBondContact O-N 3.17Å; V96-G98 VanDerWaalsContact C-N 3.26Å; V96-G98 PolarHBondContact O-N 3.01Å | ||
| 97 | L | 88.9 | Confident | 89.5 | Confident | 67 Ų | 67 | 57.8 Ų | 57.8 | 35% | 0.351 | 29% | 0.293 | S | S | . | . | S | Bend | trans | -81.5 | -0.8 | -172 | -65.7 | 176.9 | 0 | 0 | 0 | 114.1 | V86 W95 L101 L105 | V86-L97 HydrophobicContact CG1-CD1 3.47Å; V86-L97 VanDerWaalsContact CG1-CD1 3.47Å; W95-L97 HydrophobicContact CH2-CD1 4.24Å; W95-L97 HydrophobicContact CZ2-CB 3.82Å; W95-L97 HydrophobicContact CZ2-CD1 4.25Å; L97-L101 HydrophobicContact CB-CB 3.85Å; L97-L101 HydrophobicContact CB-CD1 3.76Å; L97-L101 HydrophobicContact CB-CG 4.43Å; L97-L101 HydrophobicContact CD2-CD1 4.09Å; L97-L101 HydrophobicContact CG-CD1 4.35Å; L97-L101 WeakPolarHBondContact O-CB 3.48Å; L97-L101 WeakPolarHBondContact O-CD1 3.42Å; L97-L105 HydrophobicContact CD1-CD1 3.98Å |
| 98 | G | 91 | Very high | 89.8 | Confident | 35 Ų | 35 | 57.6 Ų | 57.6 | 36% | 0.361 | 30% | 0.295 | S | S | . | . | H | α-helix | trans | 76.5 | 177.5 | 180 | 0 | 0 | 0 | 0 | 0 | 114.5 | W95 V96 C102 | W95-G98 PolarHBondContact NE1-O 3.32Å; V96-G98 VanDerWaalsContact C-N 3.26Å; V96-G98 PolarHBondContact O-N 3.01Å; G98-C102 WeakPolarHBondContact O-CB 3.31Å; G98-C102 PolarHBondContact O-N 2.97Å; G98-C102 VanDerWaalsContact O-N 3.15Å |
| 99 | D | 91.1 | Very high | 90 | Very high | 64 Ų | 64 | 57.6 Ų | 57.6 | 34% | 0.342 | 30% | 0.295 | S | S | . | . | H | α-helix | trans | -71.6 | -39.8 | -171.6 | -174.2 | 75.6 | 0 | 0 | 0 | 113.6 | L101 C102 K103 K169 V170 | D99-L101 PolarHBondContact O-N 3.37Å; D99-C102 WeakPolarHBondContact O-CB 3.47Å; D99-C102 PolarHBondContact O-N 2.89Å; D99-K103 PolarHBondContact O-N 3.17Å; D99-K103 VanDerWaalsContact O-N 3.11Å; D99-K103 IonicContact OD1-NZ 3.76Å; D99-K103 VanDerWaalsContact OD2-CE 3.32Å; D99-K103 WeakPolarHBondContact OD2-CE 3.4Å; D99-K103 IonicContact OD2-NZ 2.69Å; D99-K103 PolarHBondContact OD2-NZ 3.38Å; D99-K169 WeakPolarHBondContact OD1-CA 3.37Å; D99-V170 HydrophobicContact CB-CG2 4.32Å; D99-V170 PolarHBondContact OD1-N 2.9Å |
| 100 | F | 92.1 | Very high | 90.4 | Very high | 152 Ų | 152 | 56.7 Ų | 56.7 | 67% | 0.667 | 29% | 0.288 | S | S | * | . | H | α-helix | trans | -59.9 | -48.9 | 178.4 | 174.6 | -101.2 | 0 | 0 | 0 | 111.8 | C102 K103 L104 | F100-C102 VanDerWaalsContact C-N 3.32Å; F100-C102 PolarHBondContact O-N 3.23Å; F100-K103 PolarHBondContact O-N 3.4Å; F100-L104 HydrophobicContact CE1-CD2 3.81Å; F100-L104 HydrophobicContact CZ-CD2 4.07Å; F100-L104 WeakPolarHBondContact O-CB 3.05Å; F100-L104 PolarHBondContact O-N 3.32Å |
| 101 | L | 92.7 | Very high | 90.9 | Very high | 59 Ų | 59 | 55.6 Ų | 55.6 | 31% | 0.309 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -69 | -31.4 | 178.2 | -69.6 | 178.2 | 0 | 0 | 0 | 111.9 | W95 L97 D99 K103 L104 L105 | W95-L101 HydrophobicContact CZ2-CB 4.42Å; L97-L101 HydrophobicContact CB-CB 3.85Å; L97-L101 HydrophobicContact CB-CD1 3.76Å; L97-L101 HydrophobicContact CB-CG 4.43Å; L97-L101 HydrophobicContact CD2-CD1 4.09Å; L97-L101 HydrophobicContact CG-CD1 4.35Å; L97-L101 WeakPolarHBondContact O-CB 3.48Å; L97-L101 WeakPolarHBondContact O-CD1 3.42Å; D99-L101 PolarHBondContact O-N 3.37Å; L101-K103 PolarHBondContact O-N 2.98Å; L101-L104 HydrophobicContact CD2-CD2 4.16Å; L101-L104 PolarHBondContact O-N 2.87Å; L101-L105 HydrophobicContact CB-CD1 4.14Å; L101-L105 VanDerWaalsContact O-CB 3.24Å; L101-L105 WeakPolarHBondContact O-CB 3.26Å; L101-L105 WeakPolarHBondContact O-CD1 3.25Å; L101-L105 WeakPolarHBondContact O-CG 3.32Å; L101-L105 PolarHBondContact O-N 2.92Å |
| 102 | C | 92.7 | Very high | 91.5 | Very high | 0 Ų | 0 | 53.1 Ų | 53.1 | 0% | 0 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -57.1 | -50.4 | 174.3 | 168.8 | 0 | 0 | 0 | 0 | 111 | W95 G98 D99 F100 N106 V170 C175 | W95-C102 HydrophobicContact CZ2-CB 3.77Å; G98-C102 WeakPolarHBondContact O-CB 3.31Å; G98-C102 PolarHBondContact O-N 2.97Å; G98-C102 VanDerWaalsContact O-N 3.15Å; D99-C102 WeakPolarHBondContact O-CB 3.47Å; D99-C102 PolarHBondContact O-N 2.89Å; F100-C102 VanDerWaalsContact C-N 3.32Å; F100-C102 PolarHBondContact O-N 3.23Å; C102-N106 WeakPolarHBondContact O-CB 3.26Å; C102-N106 PolarHBondContact O-N 3.37Å; C102-N106 PolarHBondContact O-ND2 3.35Å; C102-V170 HydrophobicContact CB-CG2 3.94Å; C102-C175 WeakPolarHBondContact CA-SG 3.35Å; C102-C175 HydrophobicContact CB-CB 3.77Å; C102-C175 WeakPolarHBondContact CB-SG 3.27Å; C102-C175 WeakPolarHBondContact SG-CB 3.47Å; C102-C175 CovalentContact SG-SG 2.01Å; C102-C175 PolarHBondContact SG-SG 3.29Å |
| 103 | K | 93.9 | Very high | 92 | Very high | 64 Ų | 64 | 49.7 Ų | 49.7 | 28% | 0.278 | 25% | 0.254 | S | S | . | . | H | α-helix | trans | -67.5 | -46 | 177 | -69.1 | 168 | 179.4 | 161.2 | 0 | 112.2 | D99 F100 L101 M107 H168 | D99-K103 PolarHBondContact O-N 3.17Å; D99-K103 VanDerWaalsContact O-N 3.11Å; D99-K103 IonicContact OD1-NZ 3.76Å; D99-K103 VanDerWaalsContact OD2-CE 3.32Å; D99-K103 WeakPolarHBondContact OD2-CE 3.4Å; D99-K103 IonicContact OD2-NZ 2.69Å; D99-K103 PolarHBondContact OD2-NZ 3.38Å; F100-K103 PolarHBondContact O-N 3.4Å; L101-K103 PolarHBondContact O-N 2.98Å; K103-M107 WeakPolarHBondContact O-CB 3.43Å; K103-M107 PolarHBondContact O-N 2.94Å; K103-H168 WeakPolarHBondContact CE-O 3.41Å; K103-H168 HydrophobicContact CG-CB 4.32Å; K103-H168 VanDerWaalsContact CG-O 3.29Å; K103-H168 WeakPolarHBondContact CG-O 3.48Å |
| 104 | L | 93.4 | Very high | 92.6 | Very high | 53 Ų | 53 | 40.6 Ų | 40.6 | 28% | 0.277 | 22% | 0.22 | S | C | . | . | H | α-helix | trans | -62.9 | -45.9 | -176.7 | -179.9 | 62.6 | 0 | 0 | 0 | 112.1 | F100 L101 M107 I108 | F100-L104 HydrophobicContact CE1-CD2 3.81Å; F100-L104 HydrophobicContact CZ-CD2 4.07Å; F100-L104 WeakPolarHBondContact O-CB 3.05Å; F100-L104 PolarHBondContact O-N 3.32Å; L101-L104 HydrophobicContact CD2-CD2 4.16Å; L101-L104 PolarHBondContact O-N 2.87Å; L104-M107 HydrophobicContact CD1-CE 3.85Å; L104-M107 WeakPolarHBondContact O-CB 3.4Å; L104-M107 PolarHBondContact O-N 3.27Å; L104-I108 HydrophobicContact CD1-CD1 4.07Å; L104-I108 HydrophobicContact CD1-CG1 4.36Å; L104-I108 HydrophobicContact CG-CD1 3.94Å; L104-I108 VanDerWaalsContact O-CG1 3.27Å; L104-I108 WeakPolarHBondContact O-CG1 3.23Å; L104-I108 PolarHBondContact O-N 3.49Å |
| 105 | L | 93.8 | Very high | 93.2 | Very high | 21 Ų | 21 | 39.1 Ų | 39.1 | 11% | 0.11 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -70.8 | -37.3 | -177 | -66.8 | 165.2 | 0 | 0 | 0 | 111.8 | L83 V86 W95 L97 L101 I108 F109 | L83-L105 HydrophobicContact CD2-CD2 3.55Å; V86-L105 HydrophobicContact CB-CD1 4.47Å; V86-L105 HydrophobicContact CG1-CD1 3.48Å; V86-L105 VanDerWaalsContact CG1-CD1 3.48Å; W95-L105 HydrophobicContact CH2-CD1 3.59Å; W95-L105 HydrophobicContact CZ2-CD1 4.11Å; L97-L105 HydrophobicContact CD1-CD1 3.98Å; L101-L105 HydrophobicContact CB-CD1 4.14Å; L101-L105 VanDerWaalsContact O-CB 3.24Å; L101-L105 WeakPolarHBondContact O-CB 3.26Å; L101-L105 WeakPolarHBondContact O-CD1 3.25Å; L101-L105 WeakPolarHBondContact O-CG 3.32Å; L101-L105 PolarHBondContact O-N 2.92Å; L105-I108 PolarHBondContact O-N 3.46Å; L105-F109 WeakPolarHBondContact O-CB 3.33Å; L105-F109 PolarHBondContact O-N 2.96Å |
| 106 | N | 93.3 | Very high | 93.6 | Very high | 14 Ų | 14 | 37.6 Ų | 37.6 | 8% | 0.075 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -64.4 | -39.8 | 170 | -81.7 | -72.1 | 0 | 0 | 0 | 111.7 | W87 C102 I108 F109 S110 H168 C175 | W87-N106 WeakPolarHBondContact CH2-OD1 3.22Å; C102-N106 WeakPolarHBondContact O-CB 3.26Å; C102-N106 PolarHBondContact O-N 3.37Å; C102-N106 PolarHBondContact O-ND2 3.35Å; N106-I108 PolarHBondContact O-N 3.5Å; N106-F109 WeakPolarHBondContact O-CB 3.31Å; N106-F109 PolarHBondContact O-N 3.11Å; N106-S110 PolarHBondContact O-N 3.37Å; N106-S110 PolarHBondContact O-OG 3.34Å; N106-S110 VanDerWaalsContact O-OG 3.09Å; N106-H168 VanDerWaalsContact CG-CD2 3.4Å; N106-H168 PolarHBondContact ND2-CD2 3.48Å; N106-H168 PolarHBondContact OD1-NE2 2.72Å; N106-C175 PolarHBondContact ND2-SG 3.46Å |
| 107 | M | 94.3 | Very high | 93.9 | Very high | 54 Ų | 54 | 33 Ų | 33 | 27% | 0.266 | 17% | 0.171 | S | C | . | . | H | α-helix | trans | -60.4 | -47.5 | 173.9 | -167.9 | -177.1 | 71.4 | 0 | 0 | 111.9 | K103 L104 F109 S110 I111 I162 A165 | K103-M107 WeakPolarHBondContact O-CB 3.43Å; K103-M107 PolarHBondContact O-N 2.94Å; L104-M107 HydrophobicContact CD1-CE 3.85Å; L104-M107 WeakPolarHBondContact O-CB 3.4Å; L104-M107 PolarHBondContact O-N 3.27Å; M107-F109 VanDerWaalsContact C-N 3.29Å; M107-F109 PolarHBondContact O-N 3.23Å; M107-S110 PolarHBondContact O-N 3.29Å; M107-I111 HydrophobicContact CE-CD1 4.24Å; M107-I111 HydrophobicContact CG-CD1 3.95Å; M107-I111 HydrophobicContact CG-CG1 4.48Å; M107-I111 WeakPolarHBondContact O-CB 3.26Å; M107-I111 WeakPolarHBondContact O-CG1 3.38Å; M107-I111 PolarHBondContact O-N 3.24Å; M107-I162 HydrophobicContact SD-CG1 4.42Å; M107-A165 HydrophobicContact CB-CB 3.48Å; M107-A165 VanDerWaalsContact CB-CB 3.48Å; M107-A165 HydrophobicContact CG-CB 3.91Å |
| 108 | I | 95.4 | Very high | 94.3 | Very high | 44 Ų | 44 | 31.5 Ų | 31.5 | 23% | 0.226 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -64.3 | -37.5 | 178.9 | -64.1 | 166.6 | 0 | 0 | 0 | 110.5 | V79 L83 L104 L105 N106 I111 S112 | V79-I108 HydrophobicContact CG1-CG2 3.23Å; L83-I108 HydrophobicContact CD1-CB 4.26Å; L83-I108 HydrophobicContact CD1-CG2 3.94Å; L83-I108 HydrophobicContact CD2-CB 4.26Å; L83-I108 HydrophobicContact CD2-CG2 3.99Å; L83-I108 HydrophobicContact CG-CG2 4.25Å; L104-I108 HydrophobicContact CD1-CD1 4.07Å; L104-I108 HydrophobicContact CD1-CG1 4.36Å; L104-I108 HydrophobicContact CG-CD1 3.94Å; L104-I108 VanDerWaalsContact O-CG1 3.27Å; L104-I108 WeakPolarHBondContact O-CG1 3.23Å; L104-I108 PolarHBondContact O-N 3.49Å; L105-I108 PolarHBondContact O-N 3.46Å; N106-I108 PolarHBondContact O-N 3.5Å; I108-I111 PolarHBondContact O-N 3.25Å; I108-S112 WeakPolarHBondContact O-CB 3.4Å; I108-S112 PolarHBondContact O-N 3.14Å; I108-S112 PolarHBondContact O-OG 2.8Å |
| 109 | F | 94.4 | Very high | 94.5 | Very high | 19 Ų | 19 | 29.9 Ų | 29.9 | 8% | 0.083 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -58.8 | -53.2 | 173.6 | 173.9 | -91.4 | 0 | 0 | 0 | 111 | F80 L83 W87 L105 N106 M107 I111 S112 L113 W238 F277 | F80-F109 HydrophobicContact CD2-CD2 4.14Å; F80-F109 HydrophobicContact CD2-CE2 4.3Å; F80-F109 AromaticContact CE2-CD2 3.56Å; F80-F109 HydrophobicContact CE2-CD2 3.56Å; F80-F109 AromaticContact CE2-CE2 3.3Å; F80-F109 HydrophobicContact CE2-CE2 3.3Å; F80-F109 HydrophobicContact CE2-CZ 4.22Å; F80-F109 HydrophobicContact CZ-CD2 4.33Å; F80-F109 AromaticContact CZ-CE2 3.83Å; F80-F109 HydrophobicContact CZ-CE2 3.83Å; L83-F109 VanDerWaalsContact CD1-CA 3.5Å; L83-F109 HydrophobicContact CD1-CB 3.77Å; W87-F109 HydrophobicContact CZ2-CB 4.1Å; W87-F109 HydrophobicContact CZ2-CD2 4.14Å; W87-F109 HydrophobicContact CZ2-CG 4.18Å; W87-F109 AromaticContact NE1-CD2 3.95Å; L105-F109 WeakPolarHBondContact O-CB 3.33Å; L105-F109 PolarHBondContact O-N 2.96Å; N106-F109 WeakPolarHBondContact O-CB 3.31Å; N106-F109 PolarHBondContact O-N 3.11Å; M107-F109 VanDerWaalsContact C-N 3.29Å; M107-F109 PolarHBondContact O-N 3.23Å; F109-I111 VanDerWaalsContact C-N 3.34Å; F109-I111 PolarHBondContact O-N 3.17Å; F109-S112 PolarHBondContact O-N 3.34Å; F109-L113 PolarHBondContact O-N 2.91Å; F109-W238 HydrophobicContact CE2-CH2 4.38Å; F109-W238 AromaticContact CZ-CH2 3.95Å; F109-W238 HydrophobicContact CZ-CH2 3.95Å; F109-W238 HydrophobicContact CZ-CZ3 4.41Å; F109-F277 HydrophobicContact CD2-CZ 4.44Å; F109-F277 HydrophobicContact CE2-CD1 4.41Å; F109-F277 AromaticContact CE2-CE1 3.53Å; F109-F277 HydrophobicContact CE2-CE1 3.53Å; F109-F277 HydrophobicContact CE2-CE2 4.3Å; F109-F277 AromaticContact CE2-CZ 3.47Å; F109-F277 HydrophobicContact CE2-CZ 3.47Å; F109-F277 VanDerWaalsContact CE2-CZ 3.47Å; F109-F277 AromaticContact CZ-CE1 3.76Å; F109-F277 HydrophobicContact CZ-CE1 3.76Å; F109-F277 AromaticContact CZ-CZ 3.96Å; F109-F277 HydrophobicContact CZ-CZ 3.96Å |
| 110 | S | 94.5 | Very high | 94.7 | Very high | 0 Ų | 0 | 26.8 Ų | 26.8 | 0% | 0 | 13% | 0.128 | C | C | . | . | H | α-helix | trans | -65.5 | -36.1 | -179.4 | -53.9 | 0 | 0 | 0 | 0 | 111.8 | N106 M107 S112 L113 Y114 S161 D164 | N106-S110 PolarHBondContact O-N 3.37Å; N106-S110 PolarHBondContact O-OG 3.34Å; N106-S110 VanDerWaalsContact O-OG 3.09Å; M107-S110 PolarHBondContact O-N 3.29Å; S110-S112 VanDerWaalsContact C-N 3.32Å; S110-S112 PolarHBondContact O-N 3Å; S110-L113 PolarHBondContact O-N 2.86Å; S110-Y114 WeakPolarHBondContact O-CB 3.4Å; S110-Y114 WeakPolarHBondContact O-CD2 3.46Å; S110-Y114 PolarHBondContact O-N 3.23Å; S110-S161 PolarHBondContact O-OG 3.19Å; S110-D164 PolarHBondContact OG-OD2 2.98Å |
| 111 | I | 96 | Very high | 94.9 | Very high | 24 Ų | 24 | 20.1 Ų | 20.1 | 12% | 0.123 | 10% | 0.1 | C | C | . | . | H | α-helix | trans | -60.7 | -46 | 174.7 | -73.1 | 167.8 | 0 | 0 | 0 | 110 | M107 I108 F109 S115 W154 I158 S161 | M107-I111 HydrophobicContact CE-CD1 4.24Å; M107-I111 HydrophobicContact CG-CD1 3.95Å; M107-I111 HydrophobicContact CG-CG1 4.48Å; M107-I111 WeakPolarHBondContact O-CB 3.26Å; M107-I111 WeakPolarHBondContact O-CG1 3.38Å; M107-I111 PolarHBondContact O-N 3.24Å; I108-I111 PolarHBondContact O-N 3.25Å; F109-I111 VanDerWaalsContact C-N 3.34Å; F109-I111 PolarHBondContact O-N 3.17Å; I111-S115 WeakPolarHBondContact O-CB 3.2Å; I111-S115 PolarHBondContact O-N 3.49Å; I111-S115 PolarHBondContact O-OG 3.28Å; I111-W154 HydrophobicContact CG2-CE3 4.22Å; I111-W154 HydrophobicContact CG2-CZ3 3.73Å; I111-I158 HydrophobicContact CD1-CG1 4.05Å; I111-I158 HydrophobicContact CG1-CG1 4.18Å; I111-S161 WeakPolarHBondContact CA-OG 3.31Å; I111-S161 VanDerWaalsContact CG1-OG 3.28Å; I111-S161 WeakPolarHBondContact CG1-OG 3.41Å; I111-S161 PolarHBondContact N-OG 2.99Å |
| 112 | S | 95.4 | Very high | 95 | Very high | 2 Ų | 2 | 19.2 Ų | 19.2 | 1% | 0.014 | 10% | 0.095 | C | C | . | . | H | α-helix | trans | -65.9 | -43.4 | -179.4 | -51.4 | 0 | 0 | 0 | 0 | 110.5 | S76 V79 I108 F109 S110 S115 S116 | S76-S112 VanDerWaalsContact OG-CA 3.28Å; S76-S112 WeakPolarHBondContact OG-CA 3.36Å; S76-S112 PolarHBondContact OG-O 2.94Å; V79-S112 WeakPolarHBondContact CG1-OG 3.42Å; I108-S112 WeakPolarHBondContact O-CB 3.4Å; I108-S112 PolarHBondContact O-N 3.14Å; I108-S112 PolarHBondContact O-OG 2.8Å; F109-S112 PolarHBondContact O-N 3.34Å; S110-S112 VanDerWaalsContact C-N 3.32Å; S110-S112 PolarHBondContact O-N 3Å; S112-S115 PolarHBondContact O-OG 2.97Å; S112-S116 VanDerWaalsContact O-CB 3.29Å; S112-S116 WeakPolarHBondContact O-CB 3.3Å; S112-S116 PolarHBondContact O-N 3.28Å; S112-S116 PolarHBondContact O-OG 3.36Å |
| 113 | L | 94.1 | Very high | 95 | Very high | 13 Ų | 13 | 19.3 Ų | 19.3 | 7% | 0.068 | 10% | 0.095 | C | C | . | . | H | α-helix | trans | -58.2 | -54.9 | 175.9 | -176 | 82.7 | 0 | 0 | 0 | 112.5 | F109 S110 S116 I117 H190 W238 | F109-L113 PolarHBondContact O-N 2.91Å; S110-L113 PolarHBondContact O-N 2.86Å; L113-S116 PolarHBondContact O-N 2.97Å; L113-I117 PolarHBondContact O-N 3.1Å; L113-H190 WeakPolarHBondContact CD2-CD2 3.08Å; L113-H190 WeakPolarHBondContact CD2-NE2 3.25Å; L113-W238 HydrophobicContact CD1-CD2 3.79Å; L113-W238 HydrophobicContact CD1-CE3 3.66Å; L113-W238 HydrophobicContact CD1-CH2 3.23Å; L113-W238 HydrophobicContact CD1-CZ2 3.33Å; L113-W238 HydrophobicContact CD1-CZ3 3.38Å |
| 114 | Y | 95.9 | Very high | 95 | Very high | 3 Ų | 3 | 16.2 Ų | 16.2 | 1% | 0.012 | 8% | 0.082 | C | C | . | . | H | α-helix | trans | -68.3 | -40.4 | -176 | -68.4 | -50.2 | 0 | 0 | 0 | 112 | S110 S116 I117 F118 S161 Q189 H190 F193 | S110-Y114 WeakPolarHBondContact O-CB 3.4Å; S110-Y114 WeakPolarHBondContact O-CD2 3.46Å; S110-Y114 PolarHBondContact O-N 3.23Å; Y114-S116 PolarHBondContact O-N 3.32Å; Y114-I117 WeakPolarHBondContact O-CG2 3.18Å; Y114-I117 PolarHBondContact O-N 3.4Å; Y114-F118 VanDerWaalsContact O-CB 3.31Å; Y114-F118 WeakPolarHBondContact O-CB 3.5Å; Y114-F118 VanDerWaalsContact O-CD2 3.25Å; Y114-F118 WeakPolarHBondContact O-CD2 3.37Å; Y114-F118 WeakPolarHBondContact O-CG 3.36Å; Y114-F118 PolarHBondContact O-N 2.84Å; Y114-S161 WeakPolarHBondContact CD2-OG 3.31Å; Y114-Q189 PolarHBondContact OH-NE2 3Å; Y114-H190 AromaticContact CE1-CD2 3.78Å; Y114-H190 AromaticContact CZ-CD2 3.58Å; Y114-H190 AromaticContact CZ-NE2 3.53Å; Y114-H190 PolarHBondContact OH-CD2 3.46Å; Y114-H190 PolarHBondContact OH-CE1 2.96Å; Y114-H190 PolarHBondContact OH-NE2 2.92Å; Y114-F193 AromaticContact CD1-CD2 3.96Å; Y114-F193 HydrophobicContact CD1-CD2 3.96Å; Y114-F193 HydrophobicContact CE1-CB 4.47Å; Y114-F193 AromaticContact CE1-CD2 3.52Å; Y114-F193 HydrophobicContact CE1-CD2 3.52Å; Y114-F193 HydrophobicContact CE1-CE2 4.23Å; Y114-F193 HydrophobicContact CE1-CG 4.44Å |
| 115 | S | 96.9 | Very high | 95 | Very high | 0 Ų | 0 | 16.5 Ų | 16.5 | 0% | 0 | 8% | 0.083 | C | C | . | . | H | α-helix | trans | -64 | -42.4 | 176.6 | 62.3 | 0 | 0 | 0 | 0 | 111.2 | S76 I111 S112 I117 F118 F119 S157 | S76-S115 WeakPolarHBondContact CB-OG 3.44Å; S76-S115 PolarHBondContact OG-OG 3.39Å; I111-S115 WeakPolarHBondContact O-CB 3.2Å; I111-S115 PolarHBondContact O-N 3.49Å; I111-S115 PolarHBondContact O-OG 3.28Å; S112-S115 PolarHBondContact O-OG 2.97Å; S115-I117 PolarHBondContact O-N 2.89Å; S115-F118 PolarHBondContact O-N 3.38Å; S115-F119 WeakPolarHBondContact O-CB 3.26Å; S115-F119 WeakPolarHBondContact O-CD2 3.26Å; S115-F119 PolarHBondContact O-N 3.19Å; S115-S157 WeakPolarHBondContact CA-OG 3.33Å; S115-S157 WeakPolarHBondContact CB-OG 3.43Å; S115-S157 PolarHBondContact N-OG 3.46Å |
| 116 | S | 95.6 | Very high | 94.8 | Very high | 0 Ų | 0 | 16.9 Ų | 16.9 | 0% | 0 | 8% | 0.084 | C | C | . | . | H | α-helix | trans | -58 | -50.2 | 176.9 | -71.7 | 0 | 0 | 0 | 0 | 112.2 | S76 S112 L113 Y114 F119 L120 | S76-S116 WeakPolarHBondContact CB-OG 3.42Å; S76-S116 PolarHBondContact OG-OG 3.35Å; S112-S116 VanDerWaalsContact O-CB 3.29Å; S112-S116 WeakPolarHBondContact O-CB 3.3Å; S112-S116 PolarHBondContact O-N 3.28Å; S112-S116 PolarHBondContact O-OG 3.36Å; L113-S116 PolarHBondContact O-N 2.97Å; Y114-S116 PolarHBondContact O-N 3.32Å; S116-F119 PolarHBondContact O-N 3.46Å; S116-L120 WeakPolarHBondContact O-CB 3.41Å; S116-L120 VanDerWaalsContact O-CG 3.23Å; S116-L120 WeakPolarHBondContact O-CG 3.44Å; S116-L120 PolarHBondContact O-N 2.83Å |
| 117 | I | 96.1 | Very high | 94.7 | Very high | 5 Ų | 5 | 18.4 Ų | 18.4 | 3% | 0.026 | 9% | 0.089 | C | C | . | . | H | α-helix | trans | -68.8 | -37.1 | -179.9 | -160.2 | 172.7 | 0 | 0 | 0 | 112.9 | L113 Y114 S115 L120 T121 F194 S197 Y234 | L113-I117 PolarHBondContact O-N 3.1Å; Y114-I117 WeakPolarHBondContact O-CG2 3.18Å; Y114-I117 PolarHBondContact O-N 3.4Å; S115-I117 PolarHBondContact O-N 2.89Å; I117-L120 PolarHBondContact O-N 3.32Å; I117-T121 WeakPolarHBondContact O-CB 3.39Å; I117-T121 PolarHBondContact O-N 3.45Å; I117-T121 PolarHBondContact O-OG1 3.27Å; I117-F194 HydrophobicContact CD1-CB 4.47Å; I117-F194 HydrophobicContact CD1-CD2 4.06Å; I117-S197 VanDerWaalsContact CD1-CB 3.48Å; I117-Y234 HydrophobicContact CB-CE1 4.11Å; I117-Y234 HydrophobicContact CD1-CE1 3.85Å; I117-Y234 HydrophobicContact CG1-CE1 3.82Å |
| 118 | F | 97.3 | Very high | 94.5 | Very high | 35 Ų | 35 | 18.2 Ų | 18.2 | 15% | 0.154 | 9% | 0.086 | C | C | . | . | H | α-helix | trans | -69 | -40.6 | 177.5 | -65.6 | -19.6 | 0 | 0 | 0 | 112 | Y114 S115 L120 T121 I122 V153 A156 F193 | Y114-F118 VanDerWaalsContact O-CB 3.31Å; Y114-F118 WeakPolarHBondContact O-CB 3.5Å; Y114-F118 VanDerWaalsContact O-CD2 3.25Å; Y114-F118 WeakPolarHBondContact O-CD2 3.37Å; Y114-F118 WeakPolarHBondContact O-CG 3.36Å; Y114-F118 PolarHBondContact O-N 2.84Å; S115-F118 PolarHBondContact O-N 3.38Å; F118-L120 VanDerWaalsContact C-N 3.34Å; F118-T121 PolarHBondContact O-N 2.94Å; F118-I122 WeakPolarHBondContact O-CG2 3.32Å; F118-I122 PolarHBondContact O-N 3.22Å; F118-V153 HydrophobicContact CB-CG1 3.69Å; F118-A156 HydrophobicContact CD2-CB 4.33Å; F118-A156 HydrophobicContact CE2-CB 4.12Å; F118-F193 HydrophobicContact CE1-CB 4.45Å; F118-F193 HydrophobicContact CE1-CD1 4.32Å; F118-F193 HydrophobicContact CE1-CG 4.35Å; F118-F193 HydrophobicContact CZ-CD1 4.29Å; F118-F193 HydrophobicContact CZ-CD2 4.45Å; F118-F193 HydrophobicContact CZ-CE1 4.48Å; F118-F193 HydrophobicContact CZ-CG 4.28Å |
| 119 | F | 96.5 | Very high | 94.2 | Very high | 1 Ų | 1 | 19.7 Ų | 19.7 | 0% | 0.004 | 9% | 0.093 | C | C | . | . | H | α-helix | trans | -64.5 | -37.7 | 173.2 | -79.8 | -60.4 | 0 | 0 | 0 | 112 | F69 N72 S115 S116 I122 M123 T150 V153 W154 | F69-F119 HydrophobicContact CD1-CD1 4.07Å; F69-F119 HydrophobicContact CD1-CE1 4.34Å; N72-F119 HydrophobicContact CB-CD1 4.01Å; N72-F119 HydrophobicContact CB-CD2 3.84Å; N72-F119 HydrophobicContact CB-CE1 3.64Å; N72-F119 HydrophobicContact CB-CE2 3.47Å; N72-F119 VanDerWaalsContact CB-CE2 3.47Å; N72-F119 HydrophobicContact CB-CG 4.13Å; N72-F119 HydrophobicContact CB-CZ 3.37Å; S115-F119 WeakPolarHBondContact O-CB 3.26Å; S115-F119 WeakPolarHBondContact O-CD2 3.26Å; S115-F119 PolarHBondContact O-N 3.19Å; S116-F119 PolarHBondContact O-N 3.46Å; F119-I122 HydrophobicContact CD1-CG2 4.34Å; F119-I122 WeakPolarHBondContact O-CG2 3.29Å; F119-M123 WeakPolarHBondContact O-CB 3.23Å; F119-M123 PolarHBondContact O-N 3.45Å; F119-T150 HydrophobicContact CE1-CG2 4.3Å; F119-T150 HydrophobicContact CZ-CG2 4.12Å; F119-V153 HydrophobicContact CD1-CG1 4.03Å; F119-V153 HydrophobicContact CD2-CG1 3.83Å; F119-V153 HydrophobicContact CE1-CB 3.95Å; F119-V153 HydrophobicContact CE1-CG1 3.8Å; F119-V153 HydrophobicContact CE1-CG2 4.26Å; F119-V153 HydrophobicContact CE2-CB 4.36Å; F119-V153 HydrophobicContact CE2-CG1 3.57Å; F119-V153 HydrophobicContact CG-CG1 4.03Å; F119-V153 HydrophobicContact CZ-CB 3.85Å; F119-V153 HydrophobicContact CZ-CG1 3.54Å; F119-W154 AromaticContact CE2-CE2 3.96Å; F119-W154 HydrophobicContact CE2-CZ2 4.2Å; F119-W154 AromaticContact CE2-NE1 3.91Å; F119-W154 AromaticContact CZ-NE1 3.7Å |
| 120 | L | 94.6 | Very high | 93.7 | Very high | 0 Ų | 0 | 19.6 Ų | 19.6 | 0% | 0 | 10% | 0.095 | C | C | . | . | H | α-helix | trans | -63.7 | -44.2 | 173.3 | -75 | 170.7 | 0 | 0 | 0 | 112.4 | L73 S116 I117 F118 M123 T124 I230 V231 Y234 | L73-L120 HydrophobicContact CD1-CG 4.22Å; L73-L120 HydrophobicContact CD2-CD2 4.01Å; S116-L120 WeakPolarHBondContact O-CB 3.41Å; S116-L120 VanDerWaalsContact O-CG 3.23Å; S116-L120 WeakPolarHBondContact O-CG 3.44Å; S116-L120 PolarHBondContact O-N 2.83Å; I117-L120 PolarHBondContact O-N 3.32Å; F118-L120 VanDerWaalsContact C-N 3.34Å; L120-M123 HydrophobicContact CD2-CE 3.7Å; L120-T124 WeakPolarHBondContact O-CB 3.15Å; L120-T124 PolarHBondContact O-N 3.29Å; L120-T124 PolarHBondContact O-OG1 2.97Å; L120-I230 HydrophobicContact CD2-CG2 3.44Å; L120-I230 VanDerWaalsContact CD2-CG2 3.44Å; L120-V231 HydrophobicContact CD2-CG2 4.5Å; L120-Y234 HydrophobicContact CD1-CD1 4.07Å; L120-Y234 HydrophobicContact CD1-CD2 3.41Å; L120-Y234 VanDerWaalsContact CD1-CD2 3.41Å; L120-Y234 HydrophobicContact CD1-CE2 3.99Å; L120-Y234 HydrophobicContact CD1-CG 3.46Å; L120-Y234 VanDerWaalsContact CD1-CG 3.46Å |
| 121 | T | 96.3 | Very high | 93.3 | Very high | 11 Ų | 11 | 19.9 Ų | 19.9 | 7% | 0.067 | 10% | 0.097 | C | C | . | . | H | α-helix | trans | -63.3 | -51.5 | 178.2 | -63 | 0 | 0 | 0 | 0 | 111.1 | I117 F118 M123 T124 I125 S197 I200 | I117-T121 WeakPolarHBondContact O-CB 3.39Å; I117-T121 PolarHBondContact O-N 3.45Å; I117-T121 PolarHBondContact O-OG1 3.27Å; F118-T121 PolarHBondContact O-N 2.94Å; T121-M123 VanDerWaalsContact C-N 3.34Å; T121-M123 PolarHBondContact O-N 2.84Å; T121-T124 WeakPolarHBondContact O-CB 3.46Å; T121-T124 PolarHBondContact O-N 2.93Å; T121-T124 VanDerWaalsContact O-N 3.11Å; T121-I125 HydrophobicContact CG2-CD1 4.12Å; T121-I125 WeakPolarHBondContact O-CG1 3.46Å; T121-I125 PolarHBondContact O-N 3.24Å; T121-S197 VanDerWaalsContact OG1-CB 3.3Å; T121-S197 WeakPolarHBondContact OG1-CB 3.49Å; T121-S197 PolarHBondContact OG1-OG 3.49Å; T121-I200 HydrophobicContact CG2-CB 4.14Å; T121-I200 HydrophobicContact CG2-CD1 4.21Å; T121-I200 HydrophobicContact CG2-CG2 3.72Å |
| 122 | I | 95.3 | Very high | 92.6 | Very high | 41 Ų | 41 | 21 Ų | 21 | 21% | 0.21 | 11% | 0.105 | C | C | . | . | H | α-helix | trans | -68.2 | -33.9 | -179.3 | -159.9 | 163.1 | 0 | 0 | 0 | 112.5 | F69 F118 F119 T124 I125 H126 V149 V153 | F69-I122 HydrophobicContact CD1-CG2 4.19Å; F69-I122 HydrophobicContact CD2-CG2 4.36Å; F69-I122 HydrophobicContact CE1-CG2 4.01Å; F69-I122 HydrophobicContact CE2-CG1 4.5Å; F69-I122 HydrophobicContact CE2-CG2 4.17Å; F69-I122 HydrophobicContact CG-CG2 4.37Å; F69-I122 HydrophobicContact CZ-CD1 4.42Å; F69-I122 HydrophobicContact CZ-CG1 4.13Å; F69-I122 HydrophobicContact CZ-CG2 4Å; F118-I122 WeakPolarHBondContact O-CG2 3.32Å; F118-I122 PolarHBondContact O-N 3.22Å; F119-I122 HydrophobicContact CD1-CG2 4.34Å; F119-I122 WeakPolarHBondContact O-CG2 3.29Å; I122-T124 VanDerWaalsContact C-N 3.3Å; I122-T124 PolarHBondContact O-N 3.5Å; I122-I125 PolarHBondContact O-N 3.43Å; I122-H126 VanDerWaalsContact O-CB 3.29Å; I122-H126 WeakPolarHBondContact O-CB 3.45Å; I122-H126 PolarHBondContact O-N 2.93Å; I122-V149 HydrophobicContact CD1-CG1 3.28Å; I122-V149 HydrophobicContact CG1-CG1 4.41Å; I122-V153 HydrophobicContact CD1-CG2 4.3Å |
| 123 | M | 92.9 | Very high | 91.8 | Very high | 1 Ų | 1 | 23.4 Ų | 23.4 | 1% | 0.005 | 12% | 0.121 | C | C | . | . | H | α-helix | trans | -60.7 | -42.7 | 171.6 | 178.5 | 174.4 | 52.4 | 0 | 0 | 110.6 | F69 I70 F119 L120 T121 H126 R127 I227 | F69-M123 HydrophobicContact CB-CB 4.22Å; F69-M123 HydrophobicContact CD2-CB 3.92Å; F69-M123 HydrophobicContact CD2-CG 4.38Å; F69-M123 HydrophobicContact CG-CB 4.43Å; I70-M123 HydrophobicContact CG1-SD 4.29Å; F119-M123 WeakPolarHBondContact O-CB 3.23Å; F119-M123 PolarHBondContact O-N 3.45Å; L120-M123 HydrophobicContact CD2-CE 3.7Å; T121-M123 VanDerWaalsContact C-N 3.34Å; T121-M123 PolarHBondContact O-N 2.84Å; M123-H126 PolarHBondContact O-N 2.73Å; M123-R127 VanDerWaalsContact O-CG 3.3Å; M123-R127 WeakPolarHBondContact O-CG 3.42Å; M123-R127 PolarHBondContact O-N 2.91Å; M123-I227 HydrophobicContact CE-CG1 4.32Å; M123-I227 HydrophobicContact CE-CG2 3.81Å; M123-I227 HydrophobicContact CG-CD1 3.95Å; M123-I227 HydrophobicContact CG-CG1 4.48Å; M123-I227 HydrophobicContact CG-CG2 4.25Å; M123-I227 HydrophobicContact SD-CD1 3.89Å; M123-I227 HydrophobicContact SD-CG1 3.94Å; M123-I227 HydrophobicContact SD-CG2 4.25Å |
| 124 | T | 93.4 | Very high | 90.6 | Very high | 0 Ų | 0 | 25.3 Ų | 25.3 | 0% | 0 | 14% | 0.135 | C | C | . | . | H | α-helix | trans | -66.3 | -44.6 | 177.5 | -56.5 | 0 | 0 | 0 | 0 | 111.8 | L120 T121 I122 H126 R127 Y128 I201 C204 Y205 | L120-T124 WeakPolarHBondContact O-CB 3.15Å; L120-T124 PolarHBondContact O-N 3.29Å; L120-T124 PolarHBondContact O-OG1 2.97Å; T121-T124 WeakPolarHBondContact O-CB 3.46Å; T121-T124 PolarHBondContact O-N 2.93Å; T121-T124 VanDerWaalsContact O-N 3.11Å; I122-T124 VanDerWaalsContact C-N 3.3Å; I122-T124 PolarHBondContact O-N 3.5Å; T124-H126 VanDerWaalsContact C-N 3.34Å; T124-H126 PolarHBondContact O-N 2.77Å; T124-R127 WeakPolarHBondContact O-CB 3.37Å; T124-R127 PolarHBondContact O-N 3.23Å; T124-Y128 PolarHBondContact O-N 3.13Å; T124-I201 HydrophobicContact CG2-CB 4.46Å; T124-I201 HydrophobicContact CG2-CG1 4.26Å; T124-I201 HydrophobicContact CG2-CG2 4.29Å; T124-C204 HydrophobicContact CG2-CB 3.75Å; T124-Y205 HydrophobicContact CG2-CD2 3.86Å; T124-Y205 HydrophobicContact CG2-CE2 3.53Å |
| 125 | I | 93.3 | Very high | 89.1 | Confident | 58 Ų | 58 | 32.4 Ų | 32.4 | 30% | 0.297 | 17% | 0.172 | S | C | . | . | H | α-helix | trans | -57.9 | -47.6 | 174.5 | -67.1 | 168.2 | 0 | 0 | 0 | 110.6 | T121 I122 R127 Y128 L129 I200 | T121-I125 HydrophobicContact CG2-CD1 4.12Å; T121-I125 WeakPolarHBondContact O-CG1 3.46Å; T121-I125 PolarHBondContact O-N 3.24Å; I122-I125 PolarHBondContact O-N 3.43Å; I125-R127 VanDerWaalsContact C-N 3.28Å; I125-R127 PolarHBondContact O-N 2.61Å; I125-Y128 WeakPolarHBondContact O-CB 3.47Å; I125-Y128 PolarHBondContact O-N 2.94Å; I125-Y128 VanDerWaalsContact O-N 3.13Å; I125-L129 HydrophobicContact CG2-CD1 4.08Å; I125-L129 HydrophobicContact CG2-CG 4.39Å; I125-L129 WeakPolarHBondContact O-CG 3.44Å; I125-L129 PolarHBondContact O-N 3.44Å; I125-I200 HydrophobicContact CD1-CG2 3.9Å; I125-I200 HydrophobicContact CG1-CG2 3.9Å |
| 126 | H | 90.4 | Very high | 87.3 | Confident | 30 Ų | 30 | 36.2 Ų | 36.2 | 14% | 0.139 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -61.6 | -37.8 | 179.3 | 174 | -117.8 | 0 | 0 | 0 | 112.1 | T66 F69 I122 M123 T124 S130 | T66-H126 PolarHBondContact OG1-CE1 2.92Å; T66-H126 VanDerWaalsContact OG1-CE1 3.25Å; T66-H126 PolarHBondContact OG1-ND1 3.47Å; T66-H126 VanDerWaalsContact OG1-ND1 3.14Å; F69-H126 HydrophobicContact CE2-CB 3.86Å; I122-H126 VanDerWaalsContact O-CB 3.29Å; I122-H126 WeakPolarHBondContact O-CB 3.45Å; I122-H126 PolarHBondContact O-N 2.93Å; M123-H126 PolarHBondContact O-N 2.73Å; T124-H126 VanDerWaalsContact C-N 3.34Å; T124-H126 PolarHBondContact O-N 2.77Å; H126-S130 WeakPolarHBondContact O-CB 3.47Å; H126-S130 PolarHBondContact O-N 3.2Å; H126-S130 PolarHBondContact O-OG 2.93Å |
| 127 | R | 89.9 | Confident | 85.6 | Confident | 45 Ų | 45 | 38.6 Ų | 38.6 | 17% | 0.17 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -66.3 | -42.4 | 172.9 | -71.8 | -60.6 | 103.6 | -147.2 | 3 | 112.3 | T66 M123 T124 I125 S130 V131 I227 | T66-R127 PolarHBondContact OG1-NE 3.19Å; T66-R127 PolarHBondContact OG1-NH2 3.06Å; M123-R127 VanDerWaalsContact O-CG 3.3Å; M123-R127 WeakPolarHBondContact O-CG 3.42Å; M123-R127 PolarHBondContact O-N 2.91Å; T124-R127 WeakPolarHBondContact O-CB 3.37Å; T124-R127 PolarHBondContact O-N 3.23Å; I125-R127 VanDerWaalsContact C-N 3.28Å; I125-R127 PolarHBondContact O-N 2.61Å; R127-S130 PolarHBondContact O-N 3.01Å; R127-V131 WeakPolarHBondContact O-CG2 3.42Å; R127-V131 PolarHBondContact O-N 3.45Å; R127-V131 VanDerWaalsContact O-N 3.07Å; R127-I227 HydrophobicContact CG-CD1 3.32Å |
| 128 | Y | 90.1 | Very high | 83.9 | Confident | 51 Ų | 51 | 44.6 Ų | 44.6 | 20% | 0.2 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -56.4 | -52.9 | 174.6 | 159.3 | -102.6 | 0 | 0 | 0 | 111.1 | T124 I125 S130 V131 V132 C204 E207 I208 | T124-Y128 PolarHBondContact O-N 3.13Å; I125-Y128 WeakPolarHBondContact O-CB 3.47Å; I125-Y128 PolarHBondContact O-N 2.94Å; I125-Y128 VanDerWaalsContact O-N 3.13Å; Y128-S130 VanDerWaalsContact C-N 3.29Å; Y128-S130 PolarHBondContact O-N 3.36Å; Y128-V131 PolarHBondContact O-N 2.88Å; Y128-V132 HydrophobicContact CD2-CB 4.47Å; Y128-V132 HydrophobicContact CD2-CG2 3.63Å; Y128-V132 HydrophobicContact CE2-CB 4.08Å; Y128-V132 HydrophobicContact CE2-CG1 4.44Å; Y128-V132 HydrophobicContact CE2-CG2 3.4Å; Y128-V132 PolarHBondContact O-N 2.91Å; Y128-C204 HydrophobicContact CG-CB 4.33Å; Y128-E207 HydrophobicContact CD2-CB 3.81Å; Y128-E207 HydrophobicContact CE2-CB 3.42Å; Y128-E207 VanDerWaalsContact CE2-CB 3.42Å; Y128-E207 HydrophobicContact CE2-CG 3.97Å; Y128-I208 HydrophobicContact CD2-CG1 4.28Å |
| 129 | L | 88.8 | Confident | 82.6 | Confident | 74 Ų | 74 | 53.2 Ų | 53.2 | 39% | 0.387 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -58.1 | -41.2 | 177.7 | -67.3 | 174.2 | 0 | 0 | 0 | 111.9 | I125 V131 S133 T137 | I125-L129 HydrophobicContact CG2-CD1 4.08Å; I125-L129 HydrophobicContact CG2-CG 4.39Å; I125-L129 WeakPolarHBondContact O-CG 3.44Å; I125-L129 PolarHBondContact O-N 3.44Å; L129-V131 VanDerWaalsContact C-N 3.25Å; L129-V131 PolarHBondContact O-N 3.01Å; L129-S133 CarbonylContact O-C 3.57Å; L129-S133 WeakPolarHBondContact O-CA 3.2Å; L129-S133 PolarHBondContact O-N 3.44Å; L129-T137 HydrophobicContact CB-CG2 4.18Å |
| 130 | S | 85.3 | Confident | 81.3 | Confident | 18 Ų | 18 | 58 Ų | 58 | 13% | 0.126 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -65.8 | -24.8 | 177.5 | -60.5 | 0 | 0 | 0 | 0 | 113.9 | H126 R127 Y128 R220 | H126-S130 WeakPolarHBondContact O-CB 3.47Å; H126-S130 PolarHBondContact O-N 3.2Å; H126-S130 PolarHBondContact O-OG 2.93Å; R127-S130 PolarHBondContact O-N 3.01Å; Y128-S130 VanDerWaalsContact C-N 3.29Å; Y128-S130 PolarHBondContact O-N 3.36Å; S130-R220 PolarHBondContact O-NH2 3.11Å |
| 131 | V | 84.5 | Confident | 80.5 | Confident | 5 Ų | 5 | 59.6 Ų | 59.6 | 3% | 0.03 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -90.7 | -49.5 | -178.6 | 170.5 | 0 | 0 | 0 | 0 | 110.9 | R127 Y128 L129 I208 T211 L212 R220 V224 | R127-V131 WeakPolarHBondContact O-CG2 3.42Å; R127-V131 PolarHBondContact O-N 3.45Å; R127-V131 VanDerWaalsContact O-N 3.07Å; Y128-V131 PolarHBondContact O-N 2.88Å; L129-V131 VanDerWaalsContact C-N 3.25Å; L129-V131 PolarHBondContact O-N 3.01Å; V131-I208 HydrophobicContact CB-CG1 4.48Å; V131-I208 HydrophobicContact CG1-CG2 4.42Å; V131-T211 HydrophobicContact CG1-CG2 3.87Å; V131-L212 HydrophobicContact CG1-CD2 4.08Å; V131-L212 HydrophobicContact CG1-CG 4.35Å; V131-R220 PolarHBondContact O-NH1 3.29Å; V131-R220 PolarHBondContact O-NH2 3.31Å; V131-V224 HydrophobicContact CG2-CG2 4.28Å |
| 132 | V | 82.8 | Confident | 80 | Confident | 48 Ų | 48 | 63.3 Ų | 63.3 | 29% | 0.291 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -77.5 | -38.2 | -174.5 | 178.6 | 0 | 0 | 0 | 0 | 112 | Y128 P134 | Y128-V132 HydrophobicContact CD2-CB 4.47Å; Y128-V132 HydrophobicContact CD2-CG2 3.63Å; Y128-V132 HydrophobicContact CE2-CB 4.08Å; Y128-V132 HydrophobicContact CE2-CG1 4.44Å; Y128-V132 HydrophobicContact CE2-CG2 3.4Å; Y128-V132 PolarHBondContact O-N 2.91Å; V132-P134 WeakPolarHBondContact O-CD 3.44Å |
| 133 | S | 78.1 | Confident | 79.6 | Confident | 52 Ų | 52 | 66.8 Ų | 66.8 | 36% | 0.364 | 36% | 0.357 | S | S | . | . | trans | -125.2 | 73.5 | -178.4 | -60.7 | 0 | 0 | 0 | 0 | 111.3 | L129 L135 S136 T137 | L129-S133 CarbonylContact O-C 3.57Å; L129-S133 WeakPolarHBondContact O-CA 3.2Å; L129-S133 PolarHBondContact O-N 3.44Å; S133-L135 PolarHBondContact O-N 2.88Å; S133-S136 WeakPolarHBondContact CB-OG 3.37Å; S133-S136 PolarHBondContact O-N 2.92Å; S133-S136 PolarHBondContact O-OG 2.92Å; S133-T137 PolarHBondContact O-OG1 3.06Å | ||
| 134 | P | 69.6 | Low | 79.4 | Confident | 54 Ų | 54 | 77 Ų | 77 | 35% | 0.351 | 40% | 0.396 | S | S | . | . | H | α-helix | trans | -57 | -35 | 179.1 | 14.3 | -23.8 | 0 | 0 | 0 | 113.5 | V132 T137 L138 | V132-P134 WeakPolarHBondContact O-CD 3.44Å; P134-T137 PolarHBondContact O-N 3.5Å; P134-T137 PolarHBondContact O-OG1 3.2Å; P134-L138 PolarHBondContact O-N 3.32Å |
| 135 | L | 62.6 | Low | 79.2 | Confident | 151 Ų | 151 | 79.5 Ų | 79.5 | 79% | 0.791 | 41% | 0.412 | S | S | * | . | H | α-helix | trans | -71.4 | -31 | -176 | -64.1 | 175.7 | 0 | 0 | 0 | 113.2 | S133 L138 | S133-L135 PolarHBondContact O-N 2.88Å; L135-L138 HydrophobicContact CD2-CD1 3.89Å |
| 136 | S | 60.5 | Low | 79 | Confident | 81 Ų | 81 | 78.6 Ų | 78.6 | 57% | 0.566 | 41% | 0.405 | S | S | * | . | H | α-helix | trans | -79.1 | -19.6 | 176.1 | 61 | 0 | 0 | 0 | 0 | 113.2 | S133 | S133-S136 WeakPolarHBondContact CB-OG 3.37Å; S133-S136 PolarHBondContact O-N 2.92Å; S133-S136 PolarHBondContact O-OG 2.92Å |
| 137 | T | 60 | Low | 79.1 | Confident | 49 Ų | 49 | 80.9 Ų | 80.9 | 30% | 0.301 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -100.9 | -2.5 | -178.1 | 51.8 | 0 | 0 | 0 | 0 | 114.2 | L129 S133 P134 R139 | L129-T137 HydrophobicContact CB-CG2 4.18Å; S133-T137 PolarHBondContact O-OG1 3.06Å; P134-T137 PolarHBondContact O-N 3.5Å; P134-T137 PolarHBondContact O-OG1 3.2Å; T137-R139 PolarHBondContact O-N 2.81Å |
| 138 | L | 60.6 | Low | 79.3 | Confident | 131 Ų | 131 | 84.5 Ų | 84.5 | 69% | 0.686 | 44% | 0.443 | S | S | * | . | S | Bend | trans | -65.8 | -20.3 | 171.5 | -96.3 | 149 | 0 | 0 | 0 | 112.9 | P134 L135 V140 | P134-L138 PolarHBondContact O-N 3.32Å; L135-L138 HydrophobicContact CD2-CD1 3.89Å; L138-V140 PolarHBondContact O-N 3.16Å |
| 139 | R | 68.3 | Low | 79.4 | Confident | 217 Ų | 217 | 83.5 Ų | 83.5 | 82% | 0.819 | 44% | 0.442 | S | S | * | . | S | Bend | trans | -77.3 | 117.7 | 175.9 | -162.8 | 172.1 | -122.5 | 176.9 | 0.3 | 109.7 | T137 P141 | T137-R139 PolarHBondContact O-N 2.81Å; R139-P141 WeakPolarHBondContact O-CD 3.35Å |
| 140 | V | 69.3 | Low | 79.7 | Confident | 100 Ų | 100 | 80.9 Ų | 80.9 | 61% | 0.606 | 43% | 0.429 | S | S | * | . | P | Polyproline II helix | trans | -57.4 | 124.2 | 174 | 179.8 | 0 | 0 | 0 | 0 | 108.6 | L138 T142 | L138-V140 PolarHBondContact O-N 3.16Å; V140-T142 PolarHBondContact O-N 3.34Å |
| 141 | P | 78.8 | Confident | 80.2 | Confident | 34 Ų | 34 | 83.5 Ų | 83.5 | 22% | 0.221 | 45% | 0.445 | C | S | . | . | P | Polyproline II helix | trans | -58.9 | 129.5 | 178.4 | -24.5 | 34.5 | 0 | 0 | 0 | 110.6 | L65 R139 R146 | L65-P141 HydrophobicContact CD1-CB 3.87Å; L65-P141 HydrophobicContact CD1-CG 3.43Å; L65-P141 VanDerWaalsContact CD1-CG 3.43Å; L65-P141 HydrophobicContact CG-CB 3.97Å; L65-P141 HydrophobicContact CG-CG 3.7Å; R139-P141 WeakPolarHBondContact O-CD 3.35Å; P141-R146 HydrophobicContact CB-CG 3.98Å |
| 142 | T | 85.4 | Confident | 80.8 | Confident | 90 Ų | 90 | 85.8 Ų | 85.8 | 55% | 0.552 | 46% | 0.464 | S | S | * | . | P | Polyproline II helix | trans | -64.2 | 152.7 | 176.1 | 64.1 | 0 | 0 | 0 | 0 | 110.3 | V140 R144 C145 R146 | V140-T142 PolarHBondContact O-N 3.34Å; T142-R144 PolarHBondContact O-N 2.83Å; T142-C145 WeakPolarHBondContact O-CB 3.45Å; T142-C145 PolarHBondContact O-N 2.98Å; T142-C145 PolarHBondContact OG1-N 2.91Å; T142-R146 WeakPolarHBondContact O-CG 3.38Å; T142-R146 PolarHBondContact O-N 2.88Å; T142-R146 VanDerWaalsContact O-N 3.1Å |
| 143 | L | 87.4 | Confident | 81.4 | Confident | 113 Ų | 113 | 84.1 Ų | 84.1 | 59% | 0.592 | 45% | 0.454 | S | S | * | . | H | α-helix | trans | -52.1 | -41.4 | 175.3 | 177.4 | 64.2 | 0 | 0 | 0 | 111.8 | C145 R146 V147 | L143-C145 PolarHBondContact O-N 3.4Å; L143-R146 VanDerWaalsContact CD1-NH2 3.33Å; L143-R146 PolarHBondContact O-N 3.19Å; L143-V147 HydrophobicContact CD1-CG2 4.1Å; L143-V147 HydrophobicContact CG-CG2 4.4Å; L143-V147 WeakPolarHBondContact O-CG2 3.06Å; L143-V147 PolarHBondContact O-N 3.11Å |
| 144 | R | 88.3 | Confident | 82.3 | Confident | 217 Ų | 217 | 84.8 Ų | 84.8 | 82% | 0.819 | 45% | 0.449 | S | S | * | . | H | α-helix | trans | -57.7 | -45.4 | 176.3 | -66.7 | -175.9 | -176.7 | 170.1 | 0.9 | 112.3 | T142 L148 | T142-R144 PolarHBondContact O-N 2.83Å; R144-L148 WeakPolarHBondContact O-CB 3.45Å; R144-L148 PolarHBondContact O-N 3.44Å |
| 145 | C | 88.7 | Confident | 83.6 | Confident | 52 Ų | 52 | 86.4 Ų | 86.4 | 35% | 0.351 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -62.3 | -44.6 | 177.3 | 177.4 | 0 | 0 | 0 | 0 | 111.6 | T142 L143 L148 V149 | T142-C145 WeakPolarHBondContact O-CB 3.45Å; T142-C145 PolarHBondContact O-N 2.98Å; T142-C145 PolarHBondContact OG1-N 2.91Å; L143-C145 PolarHBondContact O-N 3.4Å; C145-L148 PolarHBondContact O-N 3.44Å; C145-V149 WeakPolarHBondContact O-CB 3.36Å; C145-V149 VanDerWaalsContact O-CG2 3.28Å; C145-V149 WeakPolarHBondContact O-CG2 3.41Å; C145-V149 PolarHBondContact O-N 3Å |
| 146 | R | 89.9 | Confident | 85.2 | Confident | 38 Ų | 38 | 81.1 Ų | 81.1 | 14% | 0.143 | 44% | 0.435 | C | S | . | . | H | α-helix | trans | -62 | -45.8 | 179.8 | -60.3 | -178.3 | -50.1 | -146.5 | 3.7 | 112.1 | E63 L65 I68 P141 T142 L143 T150 | E63-R146 PolarHBondContact O-NH1 3.02Å; L65-R146 HydrophobicContact CD2-CB 4.3Å; L65-R146 HydrophobicContact CD2-CG 3.82Å; L65-R146 HydrophobicContact CG-CG 4.41Å; I68-R146 HydrophobicContact CD1-CB 3.72Å; I68-R146 HydrophobicContact CD1-CG 3.92Å; P141-R146 HydrophobicContact CB-CG 3.98Å; T142-R146 WeakPolarHBondContact O-CG 3.38Å; T142-R146 PolarHBondContact O-N 2.88Å; T142-R146 VanDerWaalsContact O-N 3.1Å; L143-R146 VanDerWaalsContact CD1-NH2 3.33Å; L143-R146 PolarHBondContact O-N 3.19Å; R146-T150 WeakPolarHBondContact O-CB 3.29Å; R146-T150 PolarHBondContact O-N 3.35Å; R146-T150 PolarHBondContact O-OG1 3.17Å |
| 147 | V | 91.8 | Very high | 87 | Confident | 78 Ų | 78 | 77.2 Ų | 77.2 | 47% | 0.473 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -64.6 | -50.1 | 176.8 | 172.9 | 0 | 0 | 0 | 0 | 110.1 | L143 V149 T150 T151 | L143-V147 HydrophobicContact CD1-CG2 4.1Å; L143-V147 HydrophobicContact CG-CG2 4.4Å; L143-V147 WeakPolarHBondContact O-CG2 3.06Å; L143-V147 PolarHBondContact O-N 3.11Å; V147-V149 PolarHBondContact O-N 2.9Å; V147-T150 PolarHBondContact O-N 3.02Å; V147-T151 WeakPolarHBondContact O-CB 3.29Å; V147-T151 PolarHBondContact O-N 3.12Å; V147-T151 PolarHBondContact O-OG1 3.46Å |
| 148 | L | 93.9 | Very high | 88.7 | Confident | 121 Ų | 121 | 78.2 Ų | 78.2 | 63% | 0.634 | 41% | 0.411 | S | S | * | . | H | α-helix | trans | -57.6 | -47.5 | -178.1 | -176.8 | 149.1 | 0 | 0 | 0 | 112.2 | R144 C145 A152 | R144-L148 WeakPolarHBondContact O-CB 3.45Å; R144-L148 PolarHBondContact O-N 3.44Å; C145-L148 PolarHBondContact O-N 3.44Å; L148-A152 WeakPolarHBondContact O-CB 3.28Å; L148-A152 PolarHBondContact O-N 3.29Å |
| 149 | V | 93.3 | Very high | 90.3 | Very high | 30 Ų | 30 | 77.2 Ų | 77.2 | 18% | 0.182 | 41% | 0.406 | C | S | . | . | H | α-helix | trans | -63 | -45.4 | 179.9 | 171 | 0 | 0 | 0 | 0 | 111.2 | F69 I122 C145 V147 A152 V153 | F69-V149 HydrophobicContact CE1-CG1 3.85Å; F69-V149 HydrophobicContact CZ-CG1 4.03Å; I122-V149 HydrophobicContact CD1-CG1 3.28Å; I122-V149 HydrophobicContact CG1-CG1 4.41Å; C145-V149 WeakPolarHBondContact O-CB 3.36Å; C145-V149 VanDerWaalsContact O-CG2 3.28Å; C145-V149 WeakPolarHBondContact O-CG2 3.41Å; C145-V149 PolarHBondContact O-N 3Å; V147-V149 PolarHBondContact O-N 2.9Å; V149-A152 PolarHBondContact O-N 3.13Å; V149-V153 WeakPolarHBondContact O-CG2 3.48Å; V149-V153 PolarHBondContact O-N 3.28Å; V149-V153 VanDerWaalsContact O-N 3.16Å |
| 150 | T | 94.3 | Very high | 91.5 | Very high | 19 Ų | 19 | 67.5 Ų | 67.5 | 12% | 0.117 | 37% | 0.371 | C | S | . | . | H | α-helix | trans | -66.4 | -46.9 | -178.6 | -53.6 | 0 | 0 | 0 | 0 | 111 | I68 N72 F119 R146 V147 A152 V153 W154 | I68-T150 WeakPolarHBondContact CG2-OG1 3.42Å; N72-T150 WeakPolarHBondContact ND2-CG2 3.37Å; N72-T150 VanDerWaalsContact OD1-CG2 3.31Å; N72-T150 WeakPolarHBondContact OD1-CG2 3.38Å; F119-T150 HydrophobicContact CE1-CG2 4.3Å; F119-T150 HydrophobicContact CZ-CG2 4.12Å; R146-T150 WeakPolarHBondContact O-CB 3.29Å; R146-T150 PolarHBondContact O-N 3.35Å; R146-T150 PolarHBondContact O-OG1 3.17Å; V147-T150 PolarHBondContact O-N 3.02Å; T150-A152 VanDerWaalsContact C-N 3.33Å; T150-A152 PolarHBondContact O-N 2.98Å; T150-V153 PolarHBondContact O-N 3.29Å; T150-W154 VanDerWaalsContact O-CD1 3.25Å; T150-W154 PolarHBondContact O-N 3.29Å; T150-W154 VanDerWaalsContact O-N 3.08Å |
| 151 | T | 95.6 | Very high | 92.7 | Very high | 73 Ų | 73 | 62.8 Ų | 62.8 | 45% | 0.448 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -62.4 | -40 | 177.4 | -57.9 | 0 | 0 | 0 | 0 | 111.4 | V147 V153 W154 V155 | V147-T151 WeakPolarHBondContact O-CB 3.29Å; V147-T151 PolarHBondContact O-N 3.12Å; V147-T151 PolarHBondContact O-OG1 3.46Å; T151-V153 VanDerWaalsContact C-N 3.34Å; T151-V153 PolarHBondContact O-N 2.94Å; T151-W154 PolarHBondContact O-N 3.49Å; T151-V155 HydrophobicContact CG2-CG2 4.15Å; T151-V155 WeakPolarHBondContact O-CB 3.28Å; T151-V155 VanDerWaalsContact O-CG2 3.28Å; T151-V155 WeakPolarHBondContact O-CG2 3.33Å; T151-V155 PolarHBondContact O-N 2.8Å |
| 152 | A | 96.8 | Very high | 93.1 | Very high | 54 Ų | 54 | 64.3 Ų | 64.3 | 45% | 0.446 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -60.5 | -42.6 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | L148 V149 T150 V155 A156 | L148-A152 WeakPolarHBondContact O-CB 3.28Å; L148-A152 PolarHBondContact O-N 3.29Å; V149-A152 PolarHBondContact O-N 3.13Å; T150-A152 VanDerWaalsContact C-N 3.33Å; T150-A152 PolarHBondContact O-N 2.98Å; A152-V155 PolarHBondContact O-N 3.49Å; A152-A156 VanDerWaalsContact O-CB 3.32Å; A152-A156 WeakPolarHBondContact O-CB 3.46Å; A152-A156 PolarHBondContact O-N 3.01Å |
| 153 | V | 96.9 | Very high | 92.8 | Very high | 13 Ų | 13 | 64.8 Ų | 64.8 | 8% | 0.079 | 35% | 0.347 | C | S | . | . | H | α-helix | trans | -63.6 | -45.2 | 176.3 | 173.3 | 0 | 0 | 0 | 0 | 111.2 | F118 F119 I122 V149 T150 T151 A156 S157 | F118-V153 HydrophobicContact CB-CG1 3.69Å; F119-V153 HydrophobicContact CD1-CG1 4.03Å; F119-V153 HydrophobicContact CD2-CG1 3.83Å; F119-V153 HydrophobicContact CE1-CB 3.95Å; F119-V153 HydrophobicContact CE1-CG1 3.8Å; F119-V153 HydrophobicContact CE1-CG2 4.26Å; F119-V153 HydrophobicContact CE2-CB 4.36Å; F119-V153 HydrophobicContact CE2-CG1 3.57Å; F119-V153 HydrophobicContact CG-CG1 4.03Å; F119-V153 HydrophobicContact CZ-CB 3.85Å; F119-V153 HydrophobicContact CZ-CG1 3.54Å; I122-V153 HydrophobicContact CD1-CG2 4.3Å; V149-V153 WeakPolarHBondContact O-CG2 3.48Å; V149-V153 PolarHBondContact O-N 3.28Å; V149-V153 VanDerWaalsContact O-N 3.16Å; T150-V153 PolarHBondContact O-N 3.29Å; T151-V153 VanDerWaalsContact C-N 3.34Å; T151-V153 PolarHBondContact O-N 2.94Å; V153-A156 PolarHBondContact O-N 3.02Å; V153-S157 WeakPolarHBondContact O-CB 3.35Å; V153-S157 PolarHBondContact O-N 3.37Å; V153-S157 PolarHBondContact O-OG 2.76Å |
| 154 | W | 97.4 | Very high | 92.4 | Very high | 66 Ų | 66 | 59.7 Ų | 59.7 | 25% | 0.25 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -62.9 | -45.7 | 177.3 | -80.4 | 111.8 | 0 | 0 | 0 | 112.6 | N72 I111 F119 T150 T151 A156 S157 I158 | N72-W154 PolarHBondContact OD1-NE1 2.86Å; I111-W154 HydrophobicContact CG2-CE3 4.22Å; I111-W154 HydrophobicContact CG2-CZ3 3.73Å; F119-W154 AromaticContact CE2-CE2 3.96Å; F119-W154 HydrophobicContact CE2-CZ2 4.2Å; F119-W154 AromaticContact CE2-NE1 3.91Å; F119-W154 AromaticContact CZ-NE1 3.7Å; T150-W154 VanDerWaalsContact O-CD1 3.25Å; T150-W154 PolarHBondContact O-N 3.29Å; T150-W154 VanDerWaalsContact O-N 3.08Å; T151-W154 PolarHBondContact O-N 3.49Å; W154-A156 PolarHBondContact O-N 3.26Å; W154-S157 PolarHBondContact O-N 3.38Å; W154-I158 WeakPolarHBondContact O-CB 3.41Å; W154-I158 VanDerWaalsContact O-CG1 3.28Å; W154-I158 WeakPolarHBondContact O-CG1 3.35Å; W154-I158 PolarHBondContact O-N 3.04Å |
| 155 | V | 96.9 | Very high | 92.1 | Very high | 88 Ų | 88 | 49.6 Ų | 49.6 | 53% | 0.533 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -60.9 | -44.9 | 177.1 | 170 | 0 | 0 | 0 | 0 | 110.8 | T151 A152 S157 I158 L159 | T151-V155 HydrophobicContact CG2-CG2 4.15Å; T151-V155 WeakPolarHBondContact O-CB 3.28Å; T151-V155 VanDerWaalsContact O-CG2 3.28Å; T151-V155 WeakPolarHBondContact O-CG2 3.33Å; T151-V155 PolarHBondContact O-N 2.8Å; A152-V155 PolarHBondContact O-N 3.49Å; V155-S157 VanDerWaalsContact C-N 3.31Å; V155-S157 PolarHBondContact O-N 2.9Å; V155-I158 PolarHBondContact O-N 2.88Å; V155-L159 VanDerWaalsContact O-CB 3.31Å; V155-L159 WeakPolarHBondContact O-CB 3.27Å; V155-L159 PolarHBondContact O-N 2.77Å |
| 156 | A | 96.1 | Very high | 92.1 | Very high | 39 Ų | 39 | 51.7 Ų | 51.7 | 32% | 0.322 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -61.5 | -39.8 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | F118 A152 V153 W154 S160 | F118-A156 HydrophobicContact CD2-CB 4.33Å; F118-A156 HydrophobicContact CE2-CB 4.12Å; A152-A156 VanDerWaalsContact O-CB 3.32Å; A152-A156 WeakPolarHBondContact O-CB 3.46Å; A152-A156 PolarHBondContact O-N 3.01Å; V153-A156 PolarHBondContact O-N 3.02Å; W154-A156 PolarHBondContact O-N 3.26Å; A156-S160 WeakPolarHBondContact O-CB 3.44Å; A156-S160 PolarHBondContact O-N 2.99Å; A156-S160 PolarHBondContact O-OG 3.08Å |
| 157 | S | 96.9 | Very high | 92 | Very high | 0 Ų | 0 | 52.1 Ų | 52.1 | 0% | 0 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -66.1 | -47.1 | 177.9 | -52.4 | 0 | 0 | 0 | 0 | 111.3 | S115 V153 W154 V155 S160 S161 | S115-S157 WeakPolarHBondContact CA-OG 3.33Å; S115-S157 WeakPolarHBondContact CB-OG 3.43Å; S115-S157 PolarHBondContact N-OG 3.46Å; V153-S157 WeakPolarHBondContact O-CB 3.35Å; V153-S157 PolarHBondContact O-N 3.37Å; V153-S157 PolarHBondContact O-OG 2.76Å; W154-S157 PolarHBondContact O-N 3.38Å; V155-S157 VanDerWaalsContact C-N 3.31Å; V155-S157 PolarHBondContact O-N 2.9Å; S157-S160 PolarHBondContact O-N 2.88Å; S157-S161 WeakPolarHBondContact O-CB 3.2Å; S157-S161 PolarHBondContact O-N 3.27Å; S157-S161 PolarHBondContact O-OG 3.16Å |
| 158 | I | 95.8 | Very high | 91.9 | Very high | 69 Ų | 69 | 48.7 Ų | 48.7 | 35% | 0.354 | 27% | 0.272 | S | S | . | . | H | α-helix | trans | -62.9 | -47.5 | 178.5 | -68.1 | 164.8 | 0 | 0 | 0 | 110.6 | I111 W154 V155 S160 S161 I162 | I111-I158 HydrophobicContact CD1-CG1 4.05Å; I111-I158 HydrophobicContact CG1-CG1 4.18Å; W154-I158 WeakPolarHBondContact O-CB 3.41Å; W154-I158 VanDerWaalsContact O-CG1 3.28Å; W154-I158 WeakPolarHBondContact O-CG1 3.35Å; W154-I158 PolarHBondContact O-N 3.04Å; V155-I158 PolarHBondContact O-N 2.88Å; I158-S160 VanDerWaalsContact C-N 3.33Å; I158-S160 PolarHBondContact O-N 2.97Å; I158-S161 WeakPolarHBondContact O-CB 3.16Å; I158-S161 PolarHBondContact O-N 3.44Å; I158-S161 VanDerWaalsContact O-N 3.08Å; I158-I162 HydrophobicContact CG2-CD1 3.74Å; I158-I162 HydrophobicContact CG2-CG1 4.27Å; I158-I162 VanDerWaalsContact O-CG1 3.32Å; I158-I162 WeakPolarHBondContact O-CG1 3.49Å; I158-I162 PolarHBondContact O-N 2.84Å |
| 159 | L | 94.8 | Very high | 91.8 | Very high | 110 Ų | 110 | 47.7 Ų | 47.7 | 58% | 0.576 | 26% | 0.262 | S | S | * | . | H | α-helix | trans | -59.6 | -44.4 | 179.2 | -177.6 | 61.2 | 0 | 0 | 0 | 111.7 | V155 S161 | V155-L159 VanDerWaalsContact O-CB 3.31Å; V155-L159 WeakPolarHBondContact O-CB 3.27Å; V155-L159 PolarHBondContact O-N 2.77Å; L159-S161 VanDerWaalsContact C-N 3.26Å; L159-S161 PolarHBondContact O-N 3.24Å |
| 160 | S | 93.3 | Very high | 91.7 | Very high | 14 Ų | 14 | 49.1 Ų | 49.1 | 10% | 0.098 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -64 | -32.7 | 176.7 | -55 | 0 | 0 | 0 | 0 | 112.3 | A156 S157 I158 Q189 | A156-S160 WeakPolarHBondContact O-CB 3.44Å; A156-S160 PolarHBondContact O-N 2.99Å; A156-S160 PolarHBondContact O-OG 3.08Å; S157-S160 PolarHBondContact O-N 2.88Å; I158-S160 VanDerWaalsContact C-N 3.33Å; I158-S160 PolarHBondContact O-N 2.97Å; S160-Q189 PolarHBondContact O-NE2 2.96Å |
| 161 | S | 94 | Very high | 91.4 | Very high | 0 Ų | 0 | 51.9 Ų | 51.9 | 0% | 0 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -79.3 | -33.9 | -178.3 | -54.6 | 0 | 0 | 0 | 0 | 113.6 | S110 I111 Y114 S157 I158 L159 L163 D164 A165 | S110-S161 PolarHBondContact O-OG 3.19Å; I111-S161 WeakPolarHBondContact CA-OG 3.31Å; I111-S161 VanDerWaalsContact CG1-OG 3.28Å; I111-S161 WeakPolarHBondContact CG1-OG 3.41Å; I111-S161 PolarHBondContact N-OG 2.99Å; Y114-S161 WeakPolarHBondContact CD2-OG 3.31Å; S157-S161 WeakPolarHBondContact O-CB 3.2Å; S157-S161 PolarHBondContact O-N 3.27Å; S157-S161 PolarHBondContact O-OG 3.16Å; I158-S161 WeakPolarHBondContact O-CB 3.16Å; I158-S161 PolarHBondContact O-N 3.44Å; I158-S161 VanDerWaalsContact O-N 3.08Å; L159-S161 VanDerWaalsContact C-N 3.26Å; L159-S161 PolarHBondContact O-N 3.24Å; S161-L163 VanDerWaalsContact C-N 3.28Å; S161-L163 PolarHBondContact O-N 3.43Å; S161-D164 PolarHBondContact O-N 3.36Å; S161-D164 VanDerWaalsContact O-N 3.16Å; S161-A165 WeakPolarHBondContact O-CB 3.39Å; S161-A165 PolarHBondContact O-N 2.98Å |
| 162 | I | 88.7 | Confident | 90.7 | Very high | 66 Ų | 66 | 55 Ų | 55 | 34% | 0.338 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -61 | -42.9 | 178.3 | -72.6 | 166.5 | 0 | 0 | 0 | 110.1 | M107 I158 D164 A165 I166 | M107-I162 HydrophobicContact SD-CG1 4.42Å; I158-I162 HydrophobicContact CG2-CD1 3.74Å; I158-I162 HydrophobicContact CG2-CG1 4.27Å; I158-I162 VanDerWaalsContact O-CG1 3.32Å; I158-I162 WeakPolarHBondContact O-CG1 3.49Å; I158-I162 PolarHBondContact O-N 2.84Å; I162-D164 PolarHBondContact O-N 2.97Å; I162-A165 PolarHBondContact O-N 3.4Å; I162-I166 HydrophobicContact CG2-CD1 3.53Å; I162-I166 HydrophobicContact CG2-CG1 4.23Å; I162-I166 VanDerWaalsContact O-CG1 3.31Å; I162-I166 WeakPolarHBondContact O-CG1 3.27Å; I162-I166 PolarHBondContact O-N 3.44Å |
| 163 | L | 78.1 | Confident | 89.6 | Confident | 100 Ų | 100 | 57 Ų | 57 | 52% | 0.524 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -60.3 | -30.6 | 178.1 | -64.7 | 179.5 | 0 | 0 | 0 | 112.6 | S161 F167 | S161-L163 VanDerWaalsContact C-N 3.28Å; S161-L163 PolarHBondContact O-N 3.43Å; L163-F167 VanDerWaalsContact O-CD2 3.28Å; L163-F167 WeakPolarHBondContact O-CD2 3.47Å; L163-F167 WeakPolarHBondContact O-CE2 3.31Å |
| 164 | D | 79.1 | Confident | 89.1 | Confident | 7 Ų | 7 | 57.1 Ų | 57.1 | 4% | 0.037 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -84.8 | -40 | 179.9 | -174.9 | 33.7 | 0 | 0 | 0 | 112.4 | S110 S161 I162 H168 Y177 S186 H190 | S110-D164 PolarHBondContact OG-OD2 2.98Å; S161-D164 PolarHBondContact O-N 3.36Å; S161-D164 VanDerWaalsContact O-N 3.16Å; I162-D164 PolarHBondContact O-N 2.97Å; D164-H168 PolarHBondContact O-CE1 3.49Å; D164-H168 PolarHBondContact O-ND1 2.9Å; D164-Y177 WeakPolarHBondContact OD1-CE1 3.42Å; D164-Y177 PolarHBondContact OD1-OH 2.64Å; D164-S186 WeakPolarHBondContact OD1-CB 3.22Å; D164-S186 PolarHBondContact OD1-OG 2.83Å; D164-H190 IonicContact OD2-CE1 2.64Å; D164-H190 PolarHBondContact OD2-CE1 3.33Å; D164-H190 VanDerWaalsContact OD2-CE1 3.31Å; D164-H190 IonicContact OD2-NE2 3.5Å |
| 165 | A | 83 | Confident | 88.7 | Confident | 4 Ų | 4 | 55.3 Ų | 55.3 | 3% | 0.033 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -76.9 | -31.8 | -172.3 | 0 | 0 | 0 | 0 | 0 | 114.9 | M107 S161 I162 F167 H168 | M107-A165 HydrophobicContact CB-CB 3.48Å; M107-A165 VanDerWaalsContact CB-CB 3.48Å; M107-A165 HydrophobicContact CG-CB 3.91Å; S161-A165 WeakPolarHBondContact O-CB 3.39Å; S161-A165 PolarHBondContact O-N 2.98Å; I162-A165 PolarHBondContact O-N 3.4Å; A165-F167 PolarHBondContact O-N 3.29Å; A165-F167 VanDerWaalsContact O-N 3.15Å; A165-H168 PolarHBondContact O-N 3.46Å |
| 166 | I | 87.3 | Confident | 88.4 | Confident | 97 Ų | 97 | 54.6 Ų | 54.6 | 50% | 0.497 | 31% | 0.313 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -59.6 | -30.4 | -174.6 | -74.2 | 169.4 | 0 | 0 | 0 | 112.3 | I162 | I162-I166 HydrophobicContact CG2-CD1 3.53Å; I162-I166 HydrophobicContact CG2-CG1 4.23Å; I162-I166 VanDerWaalsContact O-CG1 3.31Å; I162-I166 WeakPolarHBondContact O-CG1 3.27Å; I162-I166 PolarHBondContact O-N 3.44Å |
| 167 | F | 88.9 | Confident | 88 | Confident | 47 Ų | 47 | 54.4 Ų | 54.4 | 21% | 0.206 | 31% | 0.305 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -91.5 | -0.8 | -174 | -58.5 | -68.2 | 0 | 0 | 0 | 114.4 | L163 A165 S178 W182 | L163-F167 VanDerWaalsContact O-CD2 3.28Å; L163-F167 WeakPolarHBondContact O-CD2 3.47Å; L163-F167 WeakPolarHBondContact O-CE2 3.31Å; A165-F167 PolarHBondContact O-N 3.29Å; A165-F167 VanDerWaalsContact O-N 3.15Å; F167-S178 WeakPolarHBondContact O-CB 3.25Å; F167-S178 PolarHBondContact O-N 3.14Å; F167-S178 PolarHBondContact O-OG 2.9Å; F167-W182 HydrophobicContact CB-CB 3.62Å; F167-W182 HydrophobicContact CB-CD2 4.21Å; F167-W182 HydrophobicContact CB-CG 3.63Å; F167-W182 HydrophobicContact CD1-CB 4.45Å; F167-W182 AromaticContact CD1-CD1 3.42Å; F167-W182 VanDerWaalsContact CD1-CD1 3.42Å; F167-W182 AromaticContact CD1-CD2 3.46Å; F167-W182 HydrophobicContact CD1-CD2 3.46Å; F167-W182 VanDerWaalsContact CD1-CD2 3.46Å; F167-W182 AromaticContact CD1-CE2 3.35Å; F167-W182 HydrophobicContact CD1-CE3 4.18Å; F167-W182 AromaticContact CD1-CG 3.54Å; F167-W182 HydrophobicContact CD1-CG 3.54Å; F167-W182 AromaticContact CD1-CZ2 3.99Å; F167-W182 HydrophobicContact CD1-CZ2 3.99Å; F167-W182 AromaticContact CD1-NE1 3.33Å; F167-W182 VanDerWaalsContact CD1-NE1 3.33Å; F167-W182 HydrophobicContact CD2-CB 4.22Å; F167-W182 AromaticContact CD2-CD2 3.48Å; F167-W182 HydrophobicContact CD2-CD2 3.48Å; F167-W182 VanDerWaalsContact CD2-CD2 3.48Å; F167-W182 AromaticContact CD2-CE3 3.39Å; F167-W182 HydrophobicContact CD2-CE3 3.39Å; F167-W182 AromaticContact CD2-CG 3.84Å; F167-W182 HydrophobicContact CD2-CG 3.84Å; F167-W182 AromaticContact CD2-CZ3 3.97Å; F167-W182 HydrophobicContact CD2-CZ3 3.97Å; F167-W182 AromaticContact CE1-CD2 3.58Å; F167-W182 HydrophobicContact CE1-CD2 3.58Å; F167-W182 AromaticContact CE1-CE2 3.13Å; F167-W182 HydrophobicContact CE1-CE3 4.06Å; F167-W182 HydrophobicContact CE1-CG 4.17Å; F167-W182 AromaticContact CE1-CH2 3.78Å; F167-W182 HydrophobicContact CE1-CH2 3.78Å; F167-W182 AromaticContact CE1-CZ2 3.26Å; F167-W182 HydrophobicContact CE1-CZ2 3.26Å; F167-W182 HydrophobicContact CE1-CZ3 4.15Å; F167-W182 AromaticContact CE1-NE1 3.49Å; F167-W182 AromaticContact CE2-CD2 3.6Å; F167-W182 HydrophobicContact CE2-CD2 3.6Å; F167-W182 AromaticContact CE2-CE2 3.95Å; F167-W182 AromaticContact CE2-CE3 3.24Å; F167-W182 HydrophobicContact CE2-CE3 3.24Å; F167-W182 HydrophobicContact CE2-CG 4.42Å; F167-W182 AromaticContact CE2-CH2 3.69Å; F167-W182 HydrophobicContact CE2-CH2 3.69Å; F167-W182 HydrophobicContact CE2-CZ2 4.01Å; F167-W182 AromaticContact CE2-CZ3 3.29Å; F167-W182 HydrophobicContact CE2-CZ3 3.29Å; F167-W182 HydrophobicContact CG-CB 3.84Å; F167-W182 AromaticContact CG-CD1 3.7Å; F167-W182 AromaticContact CG-CD2 3.41Å; F167-W182 HydrophobicContact CG-CD2 3.41Å; F167-W182 VanDerWaalsContact CG-CD2 3.41Å; F167-W182 AromaticContact CG-CE2 3.85Å; F167-W182 AromaticContact CG-CE3 3.87Å; F167-W182 HydrophobicContact CG-CE3 3.87Å; F167-W182 AromaticContact CG-CG 3.36Å; F167-W182 HydrophobicContact CG-CG 3.36Å; F167-W182 AromaticContact CZ-CD2 3.65Å; F167-W182 HydrophobicContact CZ-CD2 3.65Å; F167-W182 AromaticContact CZ-CE2 3.46Å; F167-W182 VanDerWaalsContact CZ-CE2 3.46Å; F167-W182 AromaticContact CZ-CE3 3.6Å; F167-W182 HydrophobicContact CZ-CE3 3.6Å; F167-W182 AromaticContact CZ-CH2 3.22Å; F167-W182 HydrophobicContact CZ-CH2 3.22Å; F167-W182 AromaticContact CZ-CZ2 3.27Å; F167-W182 HydrophobicContact CZ-CZ2 3.27Å; F167-W182 AromaticContact CZ-CZ3 3.4Å; F167-W182 HydrophobicContact CZ-CZ3 3.4Å |
| 168 | H | 89.9 | Confident | 87.6 | Confident | 6 Ų | 6 | 56 Ų | 56 | 3% | 0.028 | 32% | 0.316 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -73.8 | 138.5 | 170.7 | -74.5 | 79 | 0 | 0 | 0 | 110.6 | K103 N106 D164 A165 D176 Y177 | K103-H168 WeakPolarHBondContact CE-O 3.41Å; K103-H168 HydrophobicContact CG-CB 4.32Å; K103-H168 VanDerWaalsContact CG-O 3.29Å; K103-H168 WeakPolarHBondContact CG-O 3.48Å; N106-H168 VanDerWaalsContact CG-CD2 3.4Å; N106-H168 PolarHBondContact ND2-CD2 3.48Å; N106-H168 PolarHBondContact OD1-NE2 2.72Å; D164-H168 PolarHBondContact O-CE1 3.49Å; D164-H168 PolarHBondContact O-ND1 2.9Å; A165-H168 PolarHBondContact O-N 3.46Å; H168-D176 CarbonylContact C-O 3.51Å; H168-D176 WeakPolarHBondContact CA-O 3.27Å; H168-Y177 AromaticContact CE1-CE1 3.39Å; H168-Y177 WeakPolarHBondContact CE1-CE1 3.47Å; H168-Y177 AromaticContact CE1-CE2 3.89Å; H168-Y177 AromaticContact CE1-CZ 3.28Å; H168-Y177 PolarHBondContact CE1-OH 3.42Å; H168-Y177 AromaticContact ND1-CE1 3.92Å; H168-Y177 AromaticContact NE2-CE1 3.96Å; H168-Y177 AromaticContact NE2-CE2 3.65Å; H168-Y177 AromaticContact NE2-CZ 3.55Å |
| 169 | K | 91.9 | Very high | 87.3 | Confident | 100 Ų | 100 | 58 Ų | 58 | 44% | 0.435 | 32% | 0.324 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -144 | 157.9 | 175.5 | -69.5 | -173 | -175.3 | 172.7 | 0 | 110.5 | D99 L171 D176 | D99-K169 WeakPolarHBondContact OD1-CA 3.37Å; K169-L171 PolarHBondContact O-N 3.4Å; K169-D176 PolarHBondContact N-O 3.31Å; K169-D176 PolarHBondContact O-N 3.16Å |
| 170 | V | 90.6 | Very high | 87.1 | Confident | 59 Ų | 59 | 56.5 Ų | 56.5 | 36% | 0.358 | 32% | 0.316 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -79.5 | 117 | 169.9 | 179.3 | 0 | 0 | 0 | 0 | 109.4 | D99 C102 | D99-V170 HydrophobicContact CB-CG2 4.32Å; D99-V170 PolarHBondContact OD1-N 2.9Å; C102-V170 HydrophobicContact CB-CG2 3.94Å |
| 171 | L | 87.3 | Confident | 87 | Confident | 78 Ų | 78 | 60 Ų | 60 | 41% | 0.408 | 34% | 0.336 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -106.1 | 173.3 | 172.4 | -61 | 175.6 | 0 | 0 | 0 | 109.8 | K169 S173 G174 D176 | K169-L171 PolarHBondContact O-N 3.4Å; L171-S173 PolarHBondContact O-N 3.33Å; L171-G174 PolarHBondContact N-O 3.04Å; L171-G174 PolarHBondContact O-N 3.47Å; L171-D176 HydrophobicContact CD1-CB 4.13Å |
| 172 | S | 80.4 | Confident | 86.8 | Confident | 138 Ų | 138 | 64 Ų | 64 | 97% | 0.965 | 35% | 0.352 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -59.7 | -27.2 | 175.5 | 52 | 0 | 0 | 0 | 0 | 113.2 | ||
| 173 | S | 75.2 | Confident | 87 | Confident | 97 Ų | 97 | 62 Ų | 62 | 68% | 0.678 | 34% | 0.34 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -85.2 | -7.6 | 176.6 | 51.3 | 0 | 0 | 0 | 0 | 114.3 | L171 | L171-S173 PolarHBondContact O-N 3.33Š|
| 174 | G | 86.3 | Confident | 87.7 | Confident | 14 Ų | 14 | 58.7 Ų | 58.7 | 14% | 0.144 | 32% | 0.323 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | 125.6 | -159.7 | -177 | 0 | 0 | 0 | 0 | 0 | 113.7 | L171 | L171-G174 PolarHBondContact N-O 3.04Å; L171-G174 PolarHBondContact O-N 3.47Å |
| 175 | C | 89.3 | Confident | 88.3 | Confident | 28 Ų | 28 | 61.4 Ų | 61.4 | 19% | 0.189 | 34% | 0.34 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -84.3 | 112.4 | 176.3 | 171.6 | 0 | 0 | 0 | 0 | 110.1 | W95 C102 N106 | W95-C175 HydrophobicContact CB-CB 4.43Å; W95-C175 HydrophobicContact CD2-CB 3.44Å; W95-C175 VanDerWaalsContact CD2-CB 3.44Å; W95-C175 HydrophobicContact CE3-CB 3.69Å; W95-C175 HydrophobicContact CG-CB 3.75Å; W95-C175 HydrophobicContact CH2-CB 4.47Å; W95-C175 HydrophobicContact CZ2-CB 4.31Å; W95-C175 HydrophobicContact CZ3-CB 4.19Å; C102-C175 WeakPolarHBondContact CA-SG 3.35Å; C102-C175 HydrophobicContact CB-CB 3.77Å; C102-C175 WeakPolarHBondContact CB-SG 3.27Å; C102-C175 WeakPolarHBondContact SG-CB 3.47Å; C102-C175 CovalentContact SG-SG 2.01Å; C102-C175 PolarHBondContact SG-SG 3.29Å; N106-C175 PolarHBondContact ND2-SG 3.46Å |
| 176 | D | 89.6 | Confident | 88.7 | Confident | 73 Ų | 73 | 61.5 Ų | 61.5 | 39% | 0.39 | 34% | 0.34 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -149.9 | 175 | -174.8 | -158.3 | -6.5 | 0 | 0 | 0 | 111.2 | H168 K169 L171 | H168-D176 CarbonylContact C-O 3.51Å; H168-D176 WeakPolarHBondContact CA-O 3.27Å; K169-D176 PolarHBondContact N-O 3.31Å; K169-D176 PolarHBondContact O-N 3.16Å; L171-D176 HydrophobicContact CD1-CB 4.13Å |
| 177 | Y | 88.3 | Confident | 89 | Confident | 36 Ų | 36 | 57 Ų | 57 | 14% | 0.141 | 32% | 0.317 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -64.4 | 137.9 | 175.8 | -69.1 | -88.3 | 0 | 0 | 0 | 111.7 | D164 H168 E179 W182 Y183 S186 | D164-Y177 WeakPolarHBondContact OD1-CE1 3.42Å; D164-Y177 PolarHBondContact OD1-OH 2.64Å; H168-Y177 AromaticContact CE1-CE1 3.39Å; H168-Y177 WeakPolarHBondContact CE1-CE1 3.47Å; H168-Y177 AromaticContact CE1-CE2 3.89Å; H168-Y177 AromaticContact CE1-CZ 3.28Å; H168-Y177 PolarHBondContact CE1-OH 3.42Å; H168-Y177 AromaticContact ND1-CE1 3.92Å; H168-Y177 AromaticContact NE2-CE1 3.96Å; H168-Y177 AromaticContact NE2-CE2 3.65Å; H168-Y177 AromaticContact NE2-CZ 3.55Å; Y177-E179 VanDerWaalsContact C-N 3.29Å; Y177-E179 PolarHBondContact O-N 2.9Å; Y177-W182 HydrophobicContact CD1-CB 4.19Å; Y177-Y183 AromaticContact CD2-CD2 3.61Å; Y177-Y183 HydrophobicContact CD2-CD2 3.61Å; Y177-Y183 HydrophobicContact CD2-CG 4.29Å; Y177-Y183 AromaticContact CE2-CD2 3.8Å; Y177-Y183 HydrophobicContact CE2-CD2 3.8Å; Y177-Y183 HydrophobicContact CG-CD2 4.4Å; Y177-S186 WeakPolarHBondContact OH-CB 3.4Å; Y177-S186 PolarHBondContact OH-OG 3.21Å |
| 178 | S | 88.3 | Confident | 89.3 | Confident | 34 Ų | 34 | 60 Ų | 60 | 24% | 0.238 | 33% | 0.328 | C | S | . | . | S | Bend | trans | -66.9 | -30.5 | -178.4 | 66.9 | 0 | 0 | 0 | 0 | 113.6 | F167 | F167-S178 WeakPolarHBondContact O-CB 3.25Å; F167-S178 PolarHBondContact O-N 3.14Å; F167-S178 PolarHBondContact O-OG 2.9Å |
| 179 | E | 90.1 | Very high | 89.5 | Confident | 111 Ų | 111 | 61.2 Ų | 61.2 | 52% | 0.519 | 33% | 0.334 | S | S | . | . | S | Bend | trans | -144.4 | 151.2 | -178.9 | -58.4 | 176.2 | -163.7 | 0 | 0 | 110.7 | Y177 T181 W182 Y183 | Y177-E179 VanDerWaalsContact C-N 3.29Å; Y177-E179 PolarHBondContact O-N 2.9Å; E179-T181 VanDerWaalsContact C-N 3.25Å; E179-T181 PolarHBondContact O-N 3.25Å; E179-W182 PolarHBondContact O-N 2.89Å; E179-W182 VanDerWaalsContact O-N 3.16Å; E179-Y183 PolarHBondContact O-N 3.39Å |
| 180 | L | 88.9 | Confident | 89.5 | Confident | 78 Ų | 78 | 57.4 Ų | 57.4 | 41% | 0.408 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -58.1 | -37.2 | 178.2 | 178.6 | 61.7 | 0 | 0 | 0 | 112.3 | W182 Y183 L184 H252 | L180-W182 VanDerWaalsContact C-N 3.27Å; L180-W182 PolarHBondContact O-N 2.76Å; L180-Y183 HydrophobicContact CD1-CD1 3.92Å; L180-Y183 WeakPolarHBondContact O-CB 3.11Å; L180-Y183 PolarHBondContact O-N 3.02Å; L180-L184 HydrophobicContact CD1-CD2 4.4Å; L180-L184 HydrophobicContact CD1-CG 4.13Å; L180-L184 HydrophobicContact CG-CD1 4.14Å; L180-L184 HydrophobicContact CG-CG 4.19Å; L180-L184 VanDerWaalsContact O-CG 3.29Å; L180-L184 WeakPolarHBondContact O-CG 3.07Å; L180-L184 PolarHBondContact O-N 3.18Å; L180-H252 HydrophobicContact CD1-CB 3.72Å; L180-H252 HydrophobicContact CD2-CB 4.32Å |
| 181 | T | 91.3 | Very high | 89.7 | Confident | 86 Ų | 86 | 55.6 Ų | 55.6 | 53% | 0.528 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -58.4 | -39.6 | 179.4 | -50.5 | 0 | 0 | 0 | 0 | 112.1 | E179 T185 | E179-T181 VanDerWaalsContact C-N 3.25Å; E179-T181 PolarHBondContact O-N 3.25Å; T181-T185 WeakPolarHBondContact O-CB 3.4Å; T181-T185 PolarHBondContact O-N 2.88Å; T181-T185 PolarHBondContact O-OG1 3.12Å |
| 182 | W | 91.1 | Very high | 90.1 | Very high | 84 Ų | 84 | 57.2 Ų | 57.2 | 32% | 0.318 | 31% | 0.314 | S | S | . | . | H | α-helix | trans | -74.5 | -38.9 | 179.2 | -64.4 | 119.6 | 0 | 0 | 0 | 112.1 | F167 Y177 E179 L180 L184 T185 S186 | F167-W182 HydrophobicContact CB-CB 3.62Å; F167-W182 HydrophobicContact CB-CD2 4.21Å; F167-W182 HydrophobicContact CB-CG 3.63Å; F167-W182 HydrophobicContact CD1-CB 4.45Å; F167-W182 AromaticContact CD1-CD1 3.42Å; F167-W182 VanDerWaalsContact CD1-CD1 3.42Å; F167-W182 AromaticContact CD1-CD2 3.46Å; F167-W182 HydrophobicContact CD1-CD2 3.46Å; F167-W182 VanDerWaalsContact CD1-CD2 3.46Å; F167-W182 AromaticContact CD1-CE2 3.35Å; F167-W182 HydrophobicContact CD1-CE3 4.18Å; F167-W182 AromaticContact CD1-CG 3.54Å; F167-W182 HydrophobicContact CD1-CG 3.54Å; F167-W182 AromaticContact CD1-CZ2 3.99Å; F167-W182 HydrophobicContact CD1-CZ2 3.99Å; F167-W182 AromaticContact CD1-NE1 3.33Å; F167-W182 VanDerWaalsContact CD1-NE1 3.33Å; F167-W182 HydrophobicContact CD2-CB 4.22Å; F167-W182 AromaticContact CD2-CD2 3.48Å; F167-W182 HydrophobicContact CD2-CD2 3.48Å; F167-W182 VanDerWaalsContact CD2-CD2 3.48Å; F167-W182 AromaticContact CD2-CE3 3.39Å; F167-W182 HydrophobicContact CD2-CE3 3.39Å; F167-W182 AromaticContact CD2-CG 3.84Å; F167-W182 HydrophobicContact CD2-CG 3.84Å; F167-W182 AromaticContact CD2-CZ3 3.97Å; F167-W182 HydrophobicContact CD2-CZ3 3.97Å; F167-W182 AromaticContact CE1-CD2 3.58Å; F167-W182 HydrophobicContact CE1-CD2 3.58Å; F167-W182 AromaticContact CE1-CE2 3.13Å; F167-W182 HydrophobicContact CE1-CE3 4.06Å; F167-W182 HydrophobicContact CE1-CG 4.17Å; F167-W182 AromaticContact CE1-CH2 3.78Å; F167-W182 HydrophobicContact CE1-CH2 3.78Å; F167-W182 AromaticContact CE1-CZ2 3.26Å; F167-W182 HydrophobicContact CE1-CZ2 3.26Å; F167-W182 HydrophobicContact CE1-CZ3 4.15Å; F167-W182 AromaticContact CE1-NE1 3.49Å; F167-W182 AromaticContact CE2-CD2 3.6Å; F167-W182 HydrophobicContact CE2-CD2 3.6Å; F167-W182 AromaticContact CE2-CE2 3.95Å; F167-W182 AromaticContact CE2-CE3 3.24Å; F167-W182 HydrophobicContact CE2-CE3 3.24Å; F167-W182 HydrophobicContact CE2-CG 4.42Å; F167-W182 AromaticContact CE2-CH2 3.69Å; F167-W182 HydrophobicContact CE2-CH2 3.69Å; F167-W182 HydrophobicContact CE2-CZ2 4.01Å; F167-W182 AromaticContact CE2-CZ3 3.29Å; F167-W182 HydrophobicContact CE2-CZ3 3.29Å; F167-W182 HydrophobicContact CG-CB 3.84Å; F167-W182 AromaticContact CG-CD1 3.7Å; F167-W182 AromaticContact CG-CD2 3.41Å; F167-W182 HydrophobicContact CG-CD2 3.41Å; F167-W182 VanDerWaalsContact CG-CD2 3.41Å; F167-W182 AromaticContact CG-CE2 3.85Å; F167-W182 AromaticContact CG-CE3 3.87Å; F167-W182 HydrophobicContact CG-CE3 3.87Å; F167-W182 AromaticContact CG-CG 3.36Å; F167-W182 HydrophobicContact CG-CG 3.36Å; F167-W182 AromaticContact CZ-CD2 3.65Å; F167-W182 HydrophobicContact CZ-CD2 3.65Å; F167-W182 AromaticContact CZ-CE2 3.46Å; F167-W182 VanDerWaalsContact CZ-CE2 3.46Å; F167-W182 AromaticContact CZ-CE3 3.6Å; F167-W182 HydrophobicContact CZ-CE3 3.6Å; F167-W182 AromaticContact CZ-CH2 3.22Å; F167-W182 HydrophobicContact CZ-CH2 3.22Å; F167-W182 AromaticContact CZ-CZ2 3.27Å; F167-W182 HydrophobicContact CZ-CZ2 3.27Å; F167-W182 AromaticContact CZ-CZ3 3.4Å; F167-W182 HydrophobicContact CZ-CZ3 3.4Å; Y177-W182 HydrophobicContact CD1-CB 4.19Å; E179-W182 PolarHBondContact O-N 2.89Å; E179-W182 VanDerWaalsContact O-N 3.16Å; L180-W182 VanDerWaalsContact C-N 3.27Å; L180-W182 PolarHBondContact O-N 2.76Å; W182-L184 PolarHBondContact O-N 3.44Å; W182-T185 PolarHBondContact O-N 3.47Å; W182-S186 WeakPolarHBondContact O-CB 3.3Å; W182-S186 PolarHBondContact O-N 3.37Å |
| 183 | Y | 91.4 | Very high | 90.8 | Very high | 26 Ų | 26 | 52.8 Ų | 52.8 | 10% | 0.102 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -55.9 | -50.5 | 169.7 | 171.7 | -101.4 | 0 | 0 | 0 | 111.4 | Y177 E179 L180 T185 S186 V187 Q248 T249 H252 | Y177-Y183 AromaticContact CD2-CD2 3.61Å; Y177-Y183 HydrophobicContact CD2-CD2 3.61Å; Y177-Y183 HydrophobicContact CD2-CG 4.29Å; Y177-Y183 AromaticContact CE2-CD2 3.8Å; Y177-Y183 HydrophobicContact CE2-CD2 3.8Å; Y177-Y183 HydrophobicContact CG-CD2 4.4Å; E179-Y183 PolarHBondContact O-N 3.39Å; L180-Y183 HydrophobicContact CD1-CD1 3.92Å; L180-Y183 WeakPolarHBondContact O-CB 3.11Å; L180-Y183 PolarHBondContact O-N 3.02Å; Y183-T185 PolarHBondContact O-N 2.92Å; Y183-S186 PolarHBondContact O-N 2.87Å; Y183-V187 HydrophobicContact CD2-CG2 4.29Å; Y183-V187 HydrophobicContact CE1-CG2 4.1Å; Y183-V187 HydrophobicContact CE2-CG2 3.82Å; Y183-V187 WeakPolarHBondContact O-CG2 3.41Å; Y183-V187 PolarHBondContact O-N 3.43Å; Y183-Q248 PolarHBondContact OH-OE1 3.4Å; Y183-T249 HydrophobicContact CE1-CG2 4.01Å; Y183-H252 AromaticContact CE1-CD2 3.98Å |
| 184 | L | 92.8 | Very high | 91.8 | Very high | 29 Ų | 29 | 49.1 Ų | 49.1 | 15% | 0.152 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -59.7 | -47.7 | 178.2 | -67.9 | 178.2 | 0 | 0 | 0 | 111.7 | L180 W182 S186 V187 Y188 T249 T253 | L180-L184 HydrophobicContact CD1-CD2 4.4Å; L180-L184 HydrophobicContact CD1-CG 4.13Å; L180-L184 HydrophobicContact CG-CD1 4.14Å; L180-L184 HydrophobicContact CG-CG 4.19Å; L180-L184 VanDerWaalsContact O-CG 3.29Å; L180-L184 WeakPolarHBondContact O-CG 3.07Å; L180-L184 PolarHBondContact O-N 3.18Å; W182-L184 PolarHBondContact O-N 3.44Å; L184-S186 VanDerWaalsContact C-N 3.28Å; L184-S186 PolarHBondContact O-N 3.47Å; L184-V187 PolarHBondContact O-N 3.47Å; L184-Y188 HydrophobicContact CB-CD2 4.34Å; L184-Y188 HydrophobicContact CB-CE2 4.13Å; L184-Y188 WeakPolarHBondContact O-CD2 3.26Å; L184-Y188 PolarHBondContact O-N 2.84Å; L184-T249 HydrophobicContact CD2-CG2 3.61Å; L184-T253 HydrophobicContact CD1-CG2 4.06Å; L184-T253 HydrophobicContact CD2-CG2 4.31Å |
| 185 | T | 92.3 | Very high | 92.3 | Very high | 65 Ų | 65 | 53.4 Ų | 53.4 | 40% | 0.399 | 27% | 0.269 | S | S | . | . | H | α-helix | trans | -57.4 | -44.5 | 178.9 | -59.8 | 0 | 0 | 0 | 0 | 110.7 | T181 W182 Y183 Y188 Q189 | T181-T185 WeakPolarHBondContact O-CB 3.4Å; T181-T185 PolarHBondContact O-N 2.88Å; T181-T185 PolarHBondContact O-OG1 3.12Å; W182-T185 PolarHBondContact O-N 3.47Å; Y183-T185 PolarHBondContact O-N 2.92Å; T185-Y188 PolarHBondContact O-N 3.3Å; T185-Q189 WeakPolarHBondContact O-CB 3.38Å; T185-Q189 PolarHBondContact O-N 3.15Å |
| 186 | S | 92.3 | Very high | 92.6 | Very high | 5 Ų | 5 | 56.8 Ų | 56.8 | 4% | 0.035 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -63.1 | -49.5 | 176.6 | -179.6 | 0 | 0 | 0 | 0 | 112.4 | D164 Y177 W182 Y183 L184 Y188 Q189 H190 | D164-S186 WeakPolarHBondContact OD1-CB 3.22Å; D164-S186 PolarHBondContact OD1-OG 2.83Å; Y177-S186 WeakPolarHBondContact OH-CB 3.4Å; Y177-S186 PolarHBondContact OH-OG 3.21Å; W182-S186 WeakPolarHBondContact O-CB 3.3Å; W182-S186 PolarHBondContact O-N 3.37Å; Y183-S186 PolarHBondContact O-N 2.87Å; L184-S186 VanDerWaalsContact C-N 3.28Å; L184-S186 PolarHBondContact O-N 3.47Å; S186-Y188 VanDerWaalsContact C-N 3.29Å; S186-Y188 PolarHBondContact O-N 3.47Å; S186-Q189 PolarHBondContact O-N 3.16Å; S186-Q189 VanDerWaalsContact O-N 3.16Å; S186-H190 WeakPolarHBondContact O-CB 3.36Å; S186-H190 PolarHBondContact O-N 2.73Å; S186-H190 PolarHBondContact O-ND1 3.42Å; S186-H190 PolarHBondContact OG-CE1 3.36Å; S186-H190 PolarHBondContact OG-ND1 2.89Å |
| 187 | V | 93.3 | Very high | 93 | Very high | 3 Ų | 3 | 53.5 Ų | 53.5 | 2% | 0.018 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -60.1 | -40.9 | -180 | 173.8 | 0 | 0 | 0 | 0 | 111.3 | Y183 L184 N191 L245 T249 | Y183-V187 HydrophobicContact CD2-CG2 4.29Å; Y183-V187 HydrophobicContact CE1-CG2 4.1Å; Y183-V187 HydrophobicContact CE2-CG2 3.82Å; Y183-V187 WeakPolarHBondContact O-CG2 3.41Å; Y183-V187 PolarHBondContact O-N 3.43Å; L184-V187 PolarHBondContact O-N 3.47Å; V187-N191 WeakPolarHBondContact O-CB 3.12Å; V187-N191 PolarHBondContact O-N 2.93Å; V187-N191 PolarHBondContact O-ND2 3.02Å; V187-L245 HydrophobicContact CG1-CB 4.06Å; V187-L245 HydrophobicContact CG2-CB 4.36Å; V187-T249 HydrophobicContact CB-CG2 3.93Å; V187-T249 HydrophobicContact CG1-CG2 3.65Å; V187-T249 HydrophobicContact CG2-CG2 4.19Å |
| 188 | Y | 94.2 | Very high | 93.4 | Very high | 110 Ų | 110 | 54 Ų | 54 | 43% | 0.431 | 27% | 0.272 | S | S | . | . | H | α-helix | trans | -68.2 | -39.9 | 176.1 | -69.9 | -51.9 | 0 | 0 | 0 | 112.6 | L184 T185 S186 N191 L192 F246 | L184-Y188 HydrophobicContact CB-CD2 4.34Å; L184-Y188 HydrophobicContact CB-CE2 4.13Å; L184-Y188 WeakPolarHBondContact O-CD2 3.26Å; L184-Y188 PolarHBondContact O-N 2.84Å; T185-Y188 PolarHBondContact O-N 3.3Å; S186-Y188 VanDerWaalsContact C-N 3.29Å; S186-Y188 PolarHBondContact O-N 3.47Å; Y188-N191 PolarHBondContact O-N 3.42Å; Y188-L192 WeakPolarHBondContact O-CB 3.31Å; Y188-L192 PolarHBondContact O-N 3.39Å; Y188-F246 HydrophobicContact CE1-CD2 4.18Å; Y188-F246 HydrophobicContact CE1-CE2 4.06Å |
| 189 | Q | 93.9 | Very high | 93.8 | Very high | 32 Ų | 32 | 54.2 Ų | 54.2 | 15% | 0.15 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -60.7 | -47.6 | 174.8 | -177.8 | -180 | -71.4 | 0 | 0 | 111.5 | Y114 S160 T185 S186 L192 F193 | Y114-Q189 PolarHBondContact OH-NE2 3Å; S160-Q189 PolarHBondContact O-NE2 2.96Å; T185-Q189 WeakPolarHBondContact O-CB 3.38Å; T185-Q189 PolarHBondContact O-N 3.15Å; S186-Q189 PolarHBondContact O-N 3.16Å; S186-Q189 VanDerWaalsContact O-N 3.16Å; Q189-L192 PolarHBondContact O-N 3.11Å; Q189-F193 HydrophobicContact CG-CD2 3.85Å; Q189-F193 HydrophobicContact CG-CE2 3.57Å; Q189-F193 HydrophobicContact CG-CZ 4.49Å; Q189-F193 WeakPolarHBondContact O-CD2 3.33Å; Q189-F193 PolarHBondContact O-N 3.14Å |
| 190 | H | 92.9 | Very high | 94.1 | Very high | 19 Ų | 19 | 51.7 Ų | 51.7 | 9% | 0.088 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -57.9 | -50.6 | 176.8 | -76.1 | 111.3 | 0 | 0 | 0 | 111.7 | L113 Y114 D164 S186 L192 F193 F194 | L113-H190 WeakPolarHBondContact CD2-CD2 3.08Å; L113-H190 WeakPolarHBondContact CD2-NE2 3.25Å; Y114-H190 AromaticContact CE1-CD2 3.78Å; Y114-H190 AromaticContact CZ-CD2 3.58Å; Y114-H190 AromaticContact CZ-NE2 3.53Å; Y114-H190 PolarHBondContact OH-CD2 3.46Å; Y114-H190 PolarHBondContact OH-CE1 2.96Å; Y114-H190 PolarHBondContact OH-NE2 2.92Å; D164-H190 IonicContact OD2-CE1 2.64Å; D164-H190 PolarHBondContact OD2-CE1 3.33Å; D164-H190 VanDerWaalsContact OD2-CE1 3.31Å; D164-H190 IonicContact OD2-NE2 3.5Å; S186-H190 WeakPolarHBondContact O-CB 3.36Å; S186-H190 PolarHBondContact O-N 2.73Å; S186-H190 PolarHBondContact O-ND1 3.42Å; S186-H190 PolarHBondContact OG-CE1 3.36Å; S186-H190 PolarHBondContact OG-ND1 2.89Å; H190-L192 VanDerWaalsContact C-N 3.34Å; H190-L192 PolarHBondContact O-N 3.21Å; H190-F193 PolarHBondContact O-N 3.13Å; H190-F194 WeakPolarHBondContact O-CB 3.24Å; H190-F194 PolarHBondContact O-N 3.18Å |
| 191 | N | 95 | Very high | 94.4 | Very high | 22 Ų | 22 | 48.1 Ų | 48.1 | 12% | 0.118 | 25% | 0.25 | C | C | . | . | H | α-helix | trans | -63.2 | -38.9 | 177.9 | -84.9 | -83.3 | 0 | 0 | 0 | 112.3 | V187 Y188 F194 L195 N242 | V187-N191 WeakPolarHBondContact O-CB 3.12Å; V187-N191 PolarHBondContact O-N 2.93Å; V187-N191 PolarHBondContact O-ND2 3.02Å; Y188-N191 PolarHBondContact O-N 3.42Å; N191-F194 PolarHBondContact O-N 3.4Å; N191-L195 WeakPolarHBondContact O-CB 3.39Å; N191-L195 VanDerWaalsContact O-CG 3.24Å; N191-L195 WeakPolarHBondContact O-CG 3.47Å; N191-L195 PolarHBondContact O-N 3.18Å; N191-N242 PolarHBondContact ND2-O 3.32Å |
| 192 | L | 95.5 | Very high | 94.6 | Very high | 111 Ų | 111 | 48.7 Ų | 48.7 | 58% | 0.581 | 25% | 0.249 | S | C | * | . | H | α-helix | trans | -61.8 | -51.9 | 178 | 178.4 | 65 | 0 | 0 | 0 | 111.4 | Y188 Q189 H190 F194 L195 L196 | Y188-L192 WeakPolarHBondContact O-CB 3.31Å; Y188-L192 PolarHBondContact O-N 3.39Å; Q189-L192 PolarHBondContact O-N 3.11Å; H190-L192 VanDerWaalsContact C-N 3.34Å; H190-L192 PolarHBondContact O-N 3.21Å; L192-F194 VanDerWaalsContact C-N 3.3Å; L192-F194 PolarHBondContact O-N 3.33Å; L192-L195 PolarHBondContact O-N 2.98Å; L192-L196 WeakPolarHBondContact O-CB 3.2Å; L192-L196 PolarHBondContact O-N 2.97Å |
| 193 | F | 95.3 | Very high | 94.8 | Very high | 46 Ų | 46 | 50.4 Ų | 50.4 | 20% | 0.202 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -66.4 | -34.4 | 178.6 | -71.1 | -42.6 | 0 | 0 | 0 | 112.5 | Y114 F118 Q189 H190 S197 | Y114-F193 AromaticContact CD1-CD2 3.96Å; Y114-F193 HydrophobicContact CD1-CD2 3.96Å; Y114-F193 HydrophobicContact CE1-CB 4.47Å; Y114-F193 AromaticContact CE1-CD2 3.52Å; Y114-F193 HydrophobicContact CE1-CD2 3.52Å; Y114-F193 HydrophobicContact CE1-CE2 4.23Å; Y114-F193 HydrophobicContact CE1-CG 4.44Å; F118-F193 HydrophobicContact CE1-CB 4.45Å; F118-F193 HydrophobicContact CE1-CD1 4.32Å; F118-F193 HydrophobicContact CE1-CG 4.35Å; F118-F193 HydrophobicContact CZ-CD1 4.29Å; F118-F193 HydrophobicContact CZ-CD2 4.45Å; F118-F193 HydrophobicContact CZ-CE1 4.48Å; F118-F193 HydrophobicContact CZ-CG 4.28Å; Q189-F193 HydrophobicContact CG-CD2 3.85Å; Q189-F193 HydrophobicContact CG-CE2 3.57Å; Q189-F193 HydrophobicContact CG-CZ 4.49Å; Q189-F193 WeakPolarHBondContact O-CD2 3.33Å; Q189-F193 PolarHBondContact O-N 3.14Å; H190-F193 PolarHBondContact O-N 3.13Å; F193-S197 WeakPolarHBondContact O-CB 3.44Å; F193-S197 PolarHBondContact O-N 3.26Å; F193-S197 PolarHBondContact O-OG 2.9Å |
| 194 | F | 95.3 | Very high | 95 | Very high | 19 Ų | 19 | 49.4 Ų | 49.4 | 8% | 0.083 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -62.4 | -51 | 174.6 | -175.9 | -97 | 0 | 0 | 0 | 111.9 | I117 H190 N191 L192 S197 L198 Y234 F235 W238 G239 | I117-F194 HydrophobicContact CD1-CB 4.47Å; I117-F194 HydrophobicContact CD1-CD2 4.06Å; H190-F194 WeakPolarHBondContact O-CB 3.24Å; H190-F194 PolarHBondContact O-N 3.18Å; N191-F194 PolarHBondContact O-N 3.4Å; L192-F194 VanDerWaalsContact C-N 3.3Å; L192-F194 PolarHBondContact O-N 3.33Å; F194-S197 PolarHBondContact O-N 2.93Å; F194-L198 VanDerWaalsContact O-CB 3.32Å; F194-L198 WeakPolarHBondContact O-CB 3.16Å; F194-L198 PolarHBondContact O-N 2.77Å; F194-Y234 HydrophobicContact CD2-CE1 4.48Å; F194-Y234 HydrophobicContact CE2-CE1 4.3Å; F194-F235 HydrophobicContact CD1-CE1 4.43Å; F194-F235 HydrophobicContact CD2-CD1 4.25Å; F194-F235 AromaticContact CD2-CE1 3.95Å; F194-F235 HydrophobicContact CD2-CE1 3.95Å; F194-F235 AromaticContact CE1-CD1 3.87Å; F194-F235 HydrophobicContact CE1-CD1 3.87Å; F194-F235 HydrophobicContact CE1-CE1 4.12Å; F194-F235 AromaticContact CE2-CD1 3.43Å; F194-F235 HydrophobicContact CE2-CD1 3.43Å; F194-F235 VanDerWaalsContact CE2-CD1 3.43Å; F194-F235 AromaticContact CE2-CE1 3.6Å; F194-F235 HydrophobicContact CE2-CE1 3.6Å; F194-F235 HydrophobicContact CE2-CG 4.47Å; F194-F235 HydrophobicContact CG-CE1 4.37Å; F194-F235 AromaticContact CZ-CD1 3.24Å; F194-F235 HydrophobicContact CZ-CD1 3.24Å; F194-F235 AromaticContact CZ-CE1 3.72Å; F194-F235 HydrophobicContact CZ-CE1 3.72Å; F194-F235 HydrophobicContact CZ-CG 4.32Å; F194-W238 HydrophobicContact CD2-CB 4.46Å; F194-W238 HydrophobicContact CE2-CB 3.74Å; F194-G239 VanDerWaalsContact CZ-CA 3.4Å |
| 195 | L | 96.4 | Very high | 94.9 | Very high | 105 Ų | 105 | 48.5 Ų | 48.5 | 55% | 0.55 | 25% | 0.25 | S | S | . | . | H | α-helix | trans | -67.9 | -39.6 | 179.4 | -69.2 | 173.5 | 0 | 0 | 0 | 112.4 | N191 L192 L198 G199 | N191-L195 WeakPolarHBondContact O-CB 3.39Å; N191-L195 VanDerWaalsContact O-CG 3.24Å; N191-L195 WeakPolarHBondContact O-CG 3.47Å; N191-L195 PolarHBondContact O-N 3.18Å; L192-L195 PolarHBondContact O-N 2.98Å; L195-L198 PolarHBondContact O-N 3.37Å; L195-G199 PolarHBondContact O-N 3.41Å |
| 196 | L | 97.1 | Very high | 94.8 | Very high | 98 Ų | 98 | 48.4 Ų | 48.4 | 51% | 0.513 | 25% | 0.25 | S | C | . | . | H | α-helix | trans | -60.2 | -49.6 | 175.1 | 178.5 | 64.9 | 0 | 0 | 0 | 110.9 | L192 L198 G199 I200 | L192-L196 WeakPolarHBondContact O-CB 3.2Å; L192-L196 PolarHBondContact O-N 2.97Å; L196-L198 PolarHBondContact O-N 3.48Å; L196-G199 PolarHBondContact O-N 2.9Å; L196-I200 HydrophobicContact CD1-CD1 4.18Å; L196-I200 HydrophobicContact CG-CD1 4.09Å; L196-I200 WeakPolarHBondContact O-CG1 3.45Å; L196-I200 PolarHBondContact O-N 3.47Å |
| 197 | S | 96.8 | Very high | 94.8 | Very high | 4 Ų | 4 | 50.2 Ų | 50.2 | 3% | 0.028 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -62.4 | -43.1 | 177.7 | -63 | 0 | 0 | 0 | 0 | 111.4 | I117 T121 F193 F194 G199 I200 I201 | I117-S197 VanDerWaalsContact CD1-CB 3.48Å; T121-S197 VanDerWaalsContact OG1-CB 3.3Å; T121-S197 WeakPolarHBondContact OG1-CB 3.49Å; T121-S197 PolarHBondContact OG1-OG 3.49Å; F193-S197 WeakPolarHBondContact O-CB 3.44Å; F193-S197 PolarHBondContact O-N 3.26Å; F193-S197 PolarHBondContact O-OG 2.9Å; F194-S197 PolarHBondContact O-N 2.93Å; S197-G199 PolarHBondContact O-N 3.19Å; S197-I200 PolarHBondContact O-N 3.46Å; S197-I201 VanDerWaalsContact O-CB 3.27Å; S197-I201 WeakPolarHBondContact O-CB 3.42Å; S197-I201 VanDerWaalsContact O-CG1 3.22Å; S197-I201 WeakPolarHBondContact O-CG1 3.37Å; S197-I201 PolarHBondContact O-N 3.01Å |
| 198 | L | 96.4 | Very high | 94.6 | Very high | 47 Ų | 47 | 50 Ų | 50 | 25% | 0.246 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -57.8 | -48.6 | 175.3 | -178.4 | 59.5 | 0 | 0 | 0 | 111.3 | F194 L195 L196 I200 I201 L202 F235 | F194-L198 VanDerWaalsContact O-CB 3.32Å; F194-L198 WeakPolarHBondContact O-CB 3.16Å; F194-L198 PolarHBondContact O-N 2.77Å; L195-L198 PolarHBondContact O-N 3.37Å; L196-L198 PolarHBondContact O-N 3.48Å; L198-I200 PolarHBondContact O-N 2.85Å; L198-I201 PolarHBondContact O-N 2.91Å; L198-L202 HydrophobicContact CD1-CD1 3.88Å; L198-L202 HydrophobicContact CD1-CD2 4.47Å; L198-L202 HydrophobicContact CD1-CG 3.92Å; L198-L202 HydrophobicContact CG-CD1 3.83Å; L198-L202 HydrophobicContact CG-CG 4.27Å; L198-L202 WeakPolarHBondContact O-CB 3.43Å; L198-L202 VanDerWaalsContact O-CG 3.24Å; L198-L202 WeakPolarHBondContact O-CG 3.42Å; L198-L202 PolarHBondContact O-N 3.43Å; L198-F235 HydrophobicContact CB-CD1 4.28Å; L198-F235 HydrophobicContact CB-CE1 3.55Å; L198-F235 HydrophobicContact CB-CZ 3.83Å; L198-F235 HydrophobicContact CD1-CD1 3.73Å; L198-F235 HydrophobicContact CD1-CD2 4.14Å; L198-F235 HydrophobicContact CD1-CE1 3.75Å; L198-F235 HydrophobicContact CD1-CE2 4.12Å; L198-F235 HydrophobicContact CD1-CG 3.99Å; L198-F235 HydrophobicContact CD1-CZ 3.94Å; L198-F235 HydrophobicContact CG-CD1 4.38Å; L198-F235 HydrophobicContact CG-CE1 4.11Å; L198-F235 HydrophobicContact CG-CZ 4.49Å |
| 199 | G | 97.3 | Very high | 94.3 | Very high | 38 Ų | 38 | 48.6 Ų | 48.6 | 39% | 0.392 | 26% | 0.256 | S | S | . | . | H | α-helix | trans | -59.3 | -47.3 | 179.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | L195 L196 S197 L202 F203 | L195-G199 PolarHBondContact O-N 3.41Å; L196-G199 PolarHBondContact O-N 2.9Å; S197-G199 PolarHBondContact O-N 3.19Å; G199-L202 PolarHBondContact O-N 2.74Å; G199-F203 WeakPolarHBondContact O-CB 3.17Å; G199-F203 PolarHBondContact O-N 2.94Å |
| 200 | I | 97.3 | Very high | 94 | Very high | 59 Ų | 59 | 53.9 Ų | 53.9 | 30% | 0.303 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -61.4 | -47 | 177.5 | -66.6 | 166.6 | 0 | 0 | 0 | 110.8 | T121 I125 L196 S197 L198 F203 C204 | T121-I200 HydrophobicContact CG2-CB 4.14Å; T121-I200 HydrophobicContact CG2-CD1 4.21Å; T121-I200 HydrophobicContact CG2-CG2 3.72Å; I125-I200 HydrophobicContact CD1-CG2 3.9Å; I125-I200 HydrophobicContact CG1-CG2 3.9Å; L196-I200 HydrophobicContact CD1-CD1 4.18Å; L196-I200 HydrophobicContact CG-CD1 4.09Å; L196-I200 WeakPolarHBondContact O-CG1 3.45Å; L196-I200 PolarHBondContact O-N 3.47Å; S197-I200 PolarHBondContact O-N 3.46Å; L198-I200 PolarHBondContact O-N 2.85Å; I200-F203 PolarHBondContact O-N 3.42Å; I200-C204 WeakPolarHBondContact O-CB 3.43Å; I200-C204 PolarHBondContact O-N 3.44Å; I200-C204 PolarHBondContact O-SG 3.28Å |
| 201 | I | 95.5 | Very high | 93.6 | Very high | 2 Ų | 2 | 54.7 Ų | 54.7 | 1% | 0.01 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -63.4 | -46.9 | -179.1 | -76.1 | 173.7 | 0 | 0 | 0 | 110.7 | T124 S197 L198 C204 Y205 V231 F235 | T124-I201 HydrophobicContact CG2-CB 4.46Å; T124-I201 HydrophobicContact CG2-CG1 4.26Å; T124-I201 HydrophobicContact CG2-CG2 4.29Å; S197-I201 VanDerWaalsContact O-CB 3.27Å; S197-I201 WeakPolarHBondContact O-CB 3.42Å; S197-I201 VanDerWaalsContact O-CG1 3.22Å; S197-I201 WeakPolarHBondContact O-CG1 3.37Å; S197-I201 PolarHBondContact O-N 3.01Å; L198-I201 PolarHBondContact O-N 2.91Å; I201-C204 PolarHBondContact O-N 3.46Å; I201-Y205 HydrophobicContact CG2-CD2 3.69Å; I201-Y205 HydrophobicContact CG2-CE2 3.84Å; I201-Y205 VanDerWaalsContact O-CD2 3.29Å; I201-Y205 WeakPolarHBondContact O-CD2 3.43Å; I201-Y205 PolarHBondContact O-N 2.87Å; I201-V231 HydrophobicContact CD1-CG2 4.46Å; I201-V231 HydrophobicContact CG2-CG1 3.47Å; I201-V231 VanDerWaalsContact CG2-CG1 3.47Å; I201-V231 HydrophobicContact CG2-CG2 4.36Å; I201-F235 HydrophobicContact CD1-CE2 3.72Å; I201-F235 HydrophobicContact CD1-CZ 4.06Å |
| 202 | L | 95.2 | Very high | 92.9 | Very high | 99 Ų | 99 | 54.4 Ų | 54.4 | 52% | 0.518 | 28% | 0.28 | S | S | . | . | H | α-helix | trans | -60.6 | -47.6 | 178.2 | -74.4 | 176.1 | 0 | 0 | 0 | 111.2 | L198 G199 C204 Y205 V206 | L198-L202 HydrophobicContact CD1-CD1 3.88Å; L198-L202 HydrophobicContact CD1-CD2 4.47Å; L198-L202 HydrophobicContact CD1-CG 3.92Å; L198-L202 HydrophobicContact CG-CD1 3.83Å; L198-L202 HydrophobicContact CG-CG 4.27Å; L198-L202 WeakPolarHBondContact O-CB 3.43Å; L198-L202 VanDerWaalsContact O-CG 3.24Å; L198-L202 WeakPolarHBondContact O-CG 3.42Å; L198-L202 PolarHBondContact O-N 3.43Å; G199-L202 PolarHBondContact O-N 2.74Å; L202-C204 VanDerWaalsContact C-N 3.35Å; L202-C204 PolarHBondContact O-N 2.91Å; L202-Y205 PolarHBondContact O-N 2.68Å; L202-V206 VanDerWaalsContact O-CG2 3.31Å; L202-V206 WeakPolarHBondContact O-CG2 3.33Å; L202-V206 PolarHBondContact O-N 2.88Å |
| 203 | F | 95.3 | Very high | 92.2 | Very high | 119 Ų | 119 | 57.5 Ų | 57.5 | 52% | 0.522 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -55.4 | -50.5 | 175.2 | 172.3 | -98.3 | 0 | 0 | 0 | 111.4 | G199 I200 Y205 V206 E207 | G199-F203 WeakPolarHBondContact O-CB 3.17Å; G199-F203 PolarHBondContact O-N 2.94Å; I200-F203 PolarHBondContact O-N 3.42Å; F203-Y205 VanDerWaalsContact C-N 3.32Å; F203-Y205 PolarHBondContact O-N 3.23Å; F203-V206 PolarHBondContact O-N 3.25Å; F203-E207 HydrophobicContact CE1-CG 4.45Å; F203-E207 HydrophobicContact CE2-CG 4.28Å; F203-E207 HydrophobicContact CZ-CG 4.12Å; F203-E207 PolarHBondContact O-N 2.92Å; F203-E207 VanDerWaalsContact O-N 3.16Å |
| 204 | C | 94.2 | Very high | 91.5 | Very high | 5 Ų | 5 | 66.1 Ų | 66.1 | 3% | 0.034 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -58.2 | -43.2 | 177.9 | -71.1 | 0 | 0 | 0 | 0 | 112.1 | T124 Y128 I200 I201 L202 E207 I208 | T124-C204 HydrophobicContact CG2-CB 3.75Å; Y128-C204 HydrophobicContact CG-CB 4.33Å; I200-C204 WeakPolarHBondContact O-CB 3.43Å; I200-C204 PolarHBondContact O-N 3.44Å; I200-C204 PolarHBondContact O-SG 3.28Å; I201-C204 PolarHBondContact O-N 3.46Å; L202-C204 VanDerWaalsContact C-N 3.35Å; L202-C204 PolarHBondContact O-N 2.91Å; C204-E207 PolarHBondContact O-N 3.5Å; C204-I208 WeakPolarHBondContact O-CB 3.28Å; C204-I208 WeakPolarHBondContact O-CD1 3.43Å; C204-I208 WeakPolarHBondContact O-CG1 3.49Å; C204-I208 PolarHBondContact O-N 3.47Å |
| 205 | Y | 91 | Very high | 90.4 | Very high | 10 Ų | 10 | 67.5 Ų | 67.5 | 4% | 0.039 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -69.4 | -38.8 | -179.9 | -90.7 | -67.2 | 0 | 0 | 0 | 113.3 | T124 I201 L202 F203 E207 I208 L209 V224 I227 F228 V231 | T124-Y205 HydrophobicContact CG2-CD2 3.86Å; T124-Y205 HydrophobicContact CG2-CE2 3.53Å; I201-Y205 HydrophobicContact CG2-CD2 3.69Å; I201-Y205 HydrophobicContact CG2-CE2 3.84Å; I201-Y205 VanDerWaalsContact O-CD2 3.29Å; I201-Y205 WeakPolarHBondContact O-CD2 3.43Å; I201-Y205 PolarHBondContact O-N 2.87Å; L202-Y205 PolarHBondContact O-N 2.68Å; F203-Y205 VanDerWaalsContact C-N 3.32Å; F203-Y205 PolarHBondContact O-N 3.23Å; Y205-E207 VanDerWaalsContact C-N 3.3Å; Y205-E207 PolarHBondContact O-N 2.93Å; Y205-I208 HydrophobicContact CD1-CD1 4.31Å; Y205-I208 HydrophobicContact CE1-CD1 4.47Å; Y205-I208 PolarHBondContact O-N 3.41Å; Y205-L209 WeakPolarHBondContact O-CB 3.28Å; Y205-L209 VanDerWaalsContact O-CG 3.26Å; Y205-L209 WeakPolarHBondContact O-CG 3.22Å; Y205-L209 PolarHBondContact O-N 3.43Å; Y205-V224 HydrophobicContact CE1-CG1 4.07Å; Y205-I227 VanDerWaalsContact OH-CG2 3.26Å; Y205-I227 WeakPolarHBondContact OH-CG2 3.19Å; Y205-I227 PolarHBondContact OH-O 3.38Å; Y205-F228 AromaticContact CD1-CD2 3.8Å; Y205-F228 HydrophobicContact CD1-CD2 3.8Å; Y205-F228 HydrophobicContact CD2-CD2 4.27Å; Y205-F228 HydrophobicContact CE1-CB 3.69Å; Y205-F228 AromaticContact CE1-CD2 3.72Å; Y205-F228 HydrophobicContact CE1-CD2 3.72Å; Y205-F228 HydrophobicContact CE1-CG 4.17Å; Y205-F228 HydrophobicContact CE2-CD2 4.19Å; Y205-F228 HydrophobicContact CG-CD2 4.1Å; Y205-F228 AromaticContact CZ-CD2 3.93Å; Y205-F228 WeakPolarHBondContact OH-CA 3.12Å; Y205-F228 PolarHBondContact OH-N 2.82Å; Y205-V231 HydrophobicContact CE2-CB 4.4Å; Y205-V231 HydrophobicContact CE2-CG1 4.27Å; Y205-V231 HydrophobicContact CE2-CG2 4.2Å |
| 206 | V | 91.5 | Very high | 89 | Confident | 64 Ų | 64 | 74.7 Ų | 74.7 | 39% | 0.388 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -57.9 | -47.3 | 174.8 | 168.7 | 0 | 0 | 0 | 0 | 109.9 | L202 F203 L209 R210 | L202-V206 VanDerWaalsContact O-CG2 3.31Å; L202-V206 WeakPolarHBondContact O-CG2 3.33Å; L202-V206 PolarHBondContact O-N 2.88Å; F203-V206 PolarHBondContact O-N 3.25Å; V206-L209 PolarHBondContact O-N 2.93Å; V206-R210 WeakPolarHBondContact O-CB 3.4Å; V206-R210 VanDerWaalsContact O-CG 3.27Å; V206-R210 WeakPolarHBondContact O-CG 3.27Å; V206-R210 PolarHBondContact O-N 2.89Å |
| 207 | E | 91.1 | Very high | 87.6 | Confident | 42 Ų | 42 | 72.8 Ų | 72.8 | 20% | 0.196 | 35% | 0.346 | C | S | . | . | H | α-helix | trans | -68.1 | -39 | 177.9 | -66.9 | -54.6 | 126.3 | 0 | 0 | 113.5 | Y128 F203 C204 Y205 L209 R210 T211 | Y128-E207 HydrophobicContact CD2-CB 3.81Å; Y128-E207 HydrophobicContact CE2-CB 3.42Å; Y128-E207 VanDerWaalsContact CE2-CB 3.42Å; Y128-E207 HydrophobicContact CE2-CG 3.97Å; F203-E207 HydrophobicContact CE1-CG 4.45Å; F203-E207 HydrophobicContact CE2-CG 4.28Å; F203-E207 HydrophobicContact CZ-CG 4.12Å; F203-E207 PolarHBondContact O-N 2.92Å; F203-E207 VanDerWaalsContact O-N 3.16Å; C204-E207 PolarHBondContact O-N 3.5Å; Y205-E207 VanDerWaalsContact C-N 3.3Å; Y205-E207 PolarHBondContact O-N 2.93Å; E207-L209 VanDerWaalsContact C-N 3.35Å; E207-R210 PolarHBondContact O-N 2.91Å; E207-R210 IonicContact OE1-CZ 3.75Å; E207-R210 IonicContact OE1-NE 3.88Å; E207-R210 IonicContact OE1-NH1 3.31Å; E207-R210 PolarHBondContact OE1-NH1 2.87Å; E207-T211 WeakPolarHBondContact O-CB 3.38Å; E207-T211 PolarHBondContact O-N 3.34Å; E207-T211 PolarHBondContact O-OG1 2.86Å |
| 208 | I | 89.3 | Confident | 85.9 | Confident | 0 Ų | 0 | 81 Ų | 81 | 0% | 0 | 38% | 0.381 | C | S | . | . | H | α-helix | trans | -57.9 | -50.7 | 173.2 | -72.7 | 162.8 | 0 | 0 | 0 | 109.4 | Y128 V131 C204 Y205 T211 L212 V224 | Y128-I208 HydrophobicContact CD2-CG1 4.28Å; V131-I208 HydrophobicContact CB-CG1 4.48Å; V131-I208 HydrophobicContact CG1-CG2 4.42Å; C204-I208 WeakPolarHBondContact O-CB 3.28Å; C204-I208 WeakPolarHBondContact O-CD1 3.43Å; C204-I208 WeakPolarHBondContact O-CG1 3.49Å; C204-I208 PolarHBondContact O-N 3.47Å; Y205-I208 HydrophobicContact CD1-CD1 4.31Å; Y205-I208 HydrophobicContact CE1-CD1 4.47Å; Y205-I208 PolarHBondContact O-N 3.41Å; I208-T211 PolarHBondContact O-N 3.28Å; I208-L212 HydrophobicContact CG2-CD1 3.64Å; I208-L212 HydrophobicContact CG2-CG 4.08Å; I208-L212 WeakPolarHBondContact O-CB 3.36Å; I208-L212 VanDerWaalsContact O-CG 3.23Å; I208-L212 WeakPolarHBondContact O-CG 3.24Å; I208-L212 PolarHBondContact O-N 2.91Å; I208-V224 HydrophobicContact CG2-CG1 3.71Å; I208-V224 HydrophobicContact CG2-CG2 4.23Å |
| 209 | L | 87.2 | Confident | 84.1 | Confident | 80 Ų | 80 | 89.2 Ų | 89.2 | 42% | 0.419 | 41% | 0.409 | S | S | . | . | H | α-helix | trans | -62.5 | -46.3 | -178.8 | -71.2 | 174 | 0 | 0 | 0 | 111.2 | Y205 V206 E207 T211 L212 F213 | Y205-L209 WeakPolarHBondContact O-CB 3.28Å; Y205-L209 VanDerWaalsContact O-CG 3.26Å; Y205-L209 WeakPolarHBondContact O-CG 3.22Å; Y205-L209 PolarHBondContact O-N 3.43Å; V206-L209 PolarHBondContact O-N 2.93Å; E207-L209 VanDerWaalsContact C-N 3.35Å; L209-T211 VanDerWaalsContact C-N 3.26Å; L209-T211 PolarHBondContact O-N 3.31Å; L209-L212 PolarHBondContact O-N 3.37Å; L209-F213 HydrophobicContact CB-CD2 4.35Å; L209-F213 HydrophobicContact CB-CE2 4.21Å; L209-F213 WeakPolarHBondContact O-CD2 3.33Å; L209-F213 PolarHBondContact O-N 2.93Å |
| 210 | R | 87.6 | Confident | 82.5 | Confident | 142 Ų | 142 | 91 Ų | 91 | 54% | 0.536 | 40% | 0.404 | S | S | . | . | H | α-helix | trans | -53.1 | -45 | 174 | -74.4 | 171.9 | -176.9 | 178.6 | -0.2 | 111.9 | V206 E207 R214 | V206-R210 WeakPolarHBondContact O-CB 3.4Å; V206-R210 VanDerWaalsContact O-CG 3.27Å; V206-R210 WeakPolarHBondContact O-CG 3.27Å; V206-R210 PolarHBondContact O-N 2.89Å; E207-R210 PolarHBondContact O-N 2.91Å; E207-R210 IonicContact OE1-CZ 3.75Å; E207-R210 IonicContact OE1-NE 3.88Å; E207-R210 IonicContact OE1-NH1 3.31Å; E207-R210 PolarHBondContact OE1-NH1 2.87Å; R210-R214 WeakPolarHBondContact O-CG 3.28Å; R210-R214 PolarHBondContact O-N 3.07Å |
| 211 | T | 84.5 | Confident | 81.3 | Confident | 37 Ų | 37 | 91.8 Ų | 91.8 | 23% | 0.227 | 41% | 0.406 | C | S | . | . | H | α-helix | trans | -70.6 | -39.3 | -179.9 | -55.3 | 0 | 0 | 0 | 0 | 112.2 | V131 E207 I208 L209 R214 S215 | V131-T211 HydrophobicContact CG1-CG2 3.87Å; E207-T211 WeakPolarHBondContact O-CB 3.38Å; E207-T211 PolarHBondContact O-N 3.34Å; E207-T211 PolarHBondContact O-OG1 2.86Å; I208-T211 PolarHBondContact O-N 3.28Å; L209-T211 VanDerWaalsContact C-N 3.26Å; L209-T211 PolarHBondContact O-N 3.31Å; T211-R214 PolarHBondContact O-N 2.93Å; T211-S215 WeakPolarHBondContact O-CB 3.38Å; T211-S215 PolarHBondContact O-N 3Å |
| 212 | L | 81.8 | Confident | 80.3 | Confident | 16 Ų | 16 | 99.8 Ų | 99.8 | 8% | 0.084 | 44% | 0.436 | C | S | . | . | H | α-helix | trans | -68.9 | -39.5 | 178.2 | -70.4 | -179.8 | 0 | 0 | 0 | 111.8 | V131 I208 L209 R214 S215 R220 V224 | V131-L212 HydrophobicContact CG1-CD2 4.08Å; V131-L212 HydrophobicContact CG1-CG 4.35Å; I208-L212 HydrophobicContact CG2-CD1 3.64Å; I208-L212 HydrophobicContact CG2-CG 4.08Å; I208-L212 WeakPolarHBondContact O-CB 3.36Å; I208-L212 VanDerWaalsContact O-CG 3.23Å; I208-L212 WeakPolarHBondContact O-CG 3.24Å; I208-L212 PolarHBondContact O-N 2.91Å; L209-L212 PolarHBondContact O-N 3.37Å; L212-R214 PolarHBondContact O-N 3.41Å; L212-S215 PolarHBondContact O-N 3.45Å; L212-R220 HydrophobicContact CD2-CB 4.11Å; L212-V224 HydrophobicContact CD1-CG1 4.16Å; L212-V224 HydrophobicContact CD1-CG2 4.48Å |
| 213 | F | 81.1 | Confident | 79.5 | Confident | 175 Ų | 175 | 97.9 Ų | 97.9 | 77% | 0.768 | 43% | 0.429 | S | S | * | . | H | α-helix | trans | -62.5 | -30.3 | 174.4 | -78.7 | -62.5 | 0 | 0 | 0 | 112.6 | L209 | L209-F213 HydrophobicContact CB-CD2 4.35Å; L209-F213 HydrophobicContact CB-CE2 4.21Å; L209-F213 WeakPolarHBondContact O-CD2 3.33Å; L209-F213 PolarHBondContact O-N 2.93Å |
| 214 | R | 80.7 | Confident | 78.9 | Confident | 228 Ų | 228 | 92.8 Ų | 92.8 | 86% | 0.86 | 41% | 0.407 | S | S | * | . | H | α-helix | trans | -78.9 | -16.9 | 174.7 | -70.7 | 176.2 | 176 | 178.5 | -1 | 113.6 | R210 T211 L212 | R210-R214 WeakPolarHBondContact O-CG 3.28Å; R210-R214 PolarHBondContact O-N 3.07Å; T211-R214 PolarHBondContact O-N 2.93Å; L212-R214 PolarHBondContact O-N 3.41Å |
| 215 | S | 71.9 | Confident | 78.4 | Confident | 48 Ų | 48 | 99.5 Ų | 99.5 | 34% | 0.336 | 44% | 0.436 | S | S | . | . | trans | -112 | 132.8 | -172.4 | -173.2 | 0 | 0 | 0 | 0 | 112.7 | T211 L212 S217 | T211-S215 WeakPolarHBondContact O-CB 3.38Å; T211-S215 PolarHBondContact O-N 3Å; L212-S215 PolarHBondContact O-N 3.45Å; S215-S217 VanDerWaalsContact C-N 3.27Å; S215-S217 PolarHBondContact O-N 2.89Å | ||
| 216 | R | 66.2 | Low | 78.2 | Confident | 256 Ų | 256 | 100.1 Ų | 100.1 | 97% | 0.966 | 44% | 0.44 | S | S | * | . | trans | -78 | 5.4 | -179.8 | -69.2 | -170.8 | 176.7 | -177.6 | 0.1 | 115.4 | ||||
| 217 | S | 67.4 | Low | 77.9 | Confident | 57 Ų | 57 | 97.3 Ų | 97.3 | 40% | 0.399 | 42% | 0.423 | S | S | . | . | trans | -88.6 | 111.6 | -170.9 | -175.1 | 0 | 0 | 0 | 0 | 114.6 | S215 R219 | S215-S217 VanDerWaalsContact C-N 3.27Å; S215-S217 PolarHBondContact O-N 2.89Å; S217-R219 PolarHBondContact O-N 2.9Å | ||
| 218 | K | 61.9 | Low | 77.9 | Confident | 176 Ų | 176 | 99.9 Ų | 99.9 | 77% | 0.765 | 43% | 0.434 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -75.1 | -20 | -178.2 | -63.7 | -176.9 | 179.7 | 179.3 | 0 | 115.3 | H221 | K218-H221 PolarHBondContact O-N 3.47Š|
| 219 | R | 58.2 | Low | 78 | Confident | 220 Ų | 220 | 101.1 Ų | 101.1 | 83% | 0.83 | 44% | 0.443 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -71.4 | -31.5 | -174.7 | -167 | 175.6 | 178.9 | -179.1 | -0.3 | 112.6 | S217 H221 | S217-R219 PolarHBondContact O-N 2.9Å; R219-H221 VanDerWaalsContact C-N 3.33Å; R219-H221 PolarHBondContact O-N 2.84Å |
| 220 | R | 64.2 | Low | 78.2 | Confident | 75 Ų | 75 | 97.3 Ų | 97.3 | 28% | 0.283 | 42% | 0.424 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -68.6 | -27 | 177.6 | -87.6 | 177.7 | 164.2 | -176.1 | -9.9 | 113.6 | S130 V131 L212 R222 V224 | S130-R220 PolarHBondContact O-NH2 3.11Å; V131-R220 PolarHBondContact O-NH1 3.29Å; V131-R220 PolarHBondContact O-NH2 3.31Å; L212-R220 HydrophobicContact CD2-CB 4.11Å; R220-R222 VanDerWaalsContact C-N 3.31Å; R220-R222 PolarHBondContact O-N 2.8Å; R220-V224 WeakPolarHBondContact O-CG2 3.22Å |
| 221 | H | 71.2 | Confident | 78.4 | Confident | 76 Ų | 76 | 90.9 Ų | 90.9 | 35% | 0.352 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -68.7 | -26.7 | -174 | -61.7 | 174.8 | 0 | 0 | 0 | 113.6 | K218 R219 K225 | K218-H221 PolarHBondContact O-N 3.47Å; R219-H221 VanDerWaalsContact C-N 3.33Å; R219-H221 PolarHBondContact O-N 2.84Å; H221-K225 WeakPolarHBondContact O-CB 3.24Å; H221-K225 PolarHBondContact O-N 3.36Å |
| 222 | R | 75.9 | Confident | 78.9 | Confident | 170 Ų | 170 | 91.7 Ų | 91.7 | 64% | 0.642 | 41% | 0.405 | S | S | * | . | H | α-helix | trans | -69.2 | -50.8 | -172.3 | -65.4 | -177.7 | -176.6 | 173.1 | 0.5 | 112.8 | R220 K225 L226 | R220-R222 VanDerWaalsContact C-N 3.31Å; R220-R222 PolarHBondContact O-N 2.8Å; R222-K225 PolarHBondContact O-N 3.46Å; R222-L226 PolarHBondContact O-N 3.48Å; R222-L226 VanDerWaalsContact O-N 3.11Å |
| 223 | T | 76.6 | Confident | 79.5 | Confident | 59 Ų | 59 | 91.9 Ų | 91.9 | 36% | 0.362 | 41% | 0.409 | S | S | . | . | H | α-helix | trans | -67.2 | -39 | 178.5 | -54.8 | 0 | 0 | 0 | 0 | 111.2 | L226 I227 | T223-L226 PolarHBondContact O-N 3.23Å; T223-I227 HydrophobicContact CG2-CD1 3.82Å; T223-I227 WeakPolarHBondContact O-CG1 3.44Å; T223-I227 PolarHBondContact O-N 3.08Å |
| 224 | V | 82.8 | Confident | 80.1 | Confident | 12 Ų | 12 | 84 Ų | 84 | 7% | 0.073 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -61.6 | -44.7 | 175.2 | 174.6 | 0 | 0 | 0 | 0 | 110.9 | V131 Y205 I208 L212 R220 L226 I227 F228 | V131-V224 HydrophobicContact CG2-CG2 4.28Å; Y205-V224 HydrophobicContact CE1-CG1 4.07Å; I208-V224 HydrophobicContact CG2-CG1 3.71Å; I208-V224 HydrophobicContact CG2-CG2 4.23Å; L212-V224 HydrophobicContact CD1-CG1 4.16Å; L212-V224 HydrophobicContact CD1-CG2 4.48Å; R220-V224 WeakPolarHBondContact O-CG2 3.22Å; V224-L226 PolarHBondContact O-N 3.01Å; V224-I227 PolarHBondContact O-N 2.9Å; V224-F228 VanDerWaalsContact O-CB 3.25Å; V224-F228 WeakPolarHBondContact O-CB 3.37Å; V224-F228 PolarHBondContact O-N 3.13Å |
| 225 | K | 85.3 | Confident | 80.8 | Confident | 147 Ų | 147 | 74.4 Ų | 74.4 | 64% | 0.639 | 34% | 0.338 | S | S | * | . | H | α-helix | trans | -61.1 | -41.9 | 177.2 | -176.2 | 177.4 | -179.4 | 177.4 | 0 | 112.5 | H221 R222 A229 V290 | H221-K225 WeakPolarHBondContact O-CB 3.24Å; H221-K225 PolarHBondContact O-N 3.36Å; R222-K225 PolarHBondContact O-N 3.46Å; K225-A229 WeakPolarHBondContact O-CB 3.33Å; K225-A229 PolarHBondContact O-N 3.1Å; K225-V290 HydrophobicContact CG-CG1 4.47Å |
| 226 | L | 85.4 | Confident | 81.9 | Confident | 23 Ų | 23 | 77.7 Ų | 77.7 | 12% | 0.12 | 35% | 0.351 | C | S | . | . | H | α-helix | trans | -63.5 | -49.8 | 177.5 | 173.2 | 64.5 | 0 | 0 | 0 | 111.4 | R222 T223 V224 F228 A229 I230 L286 Y287 V290 | R222-L226 PolarHBondContact O-N 3.48Å; R222-L226 VanDerWaalsContact O-N 3.11Å; T223-L226 PolarHBondContact O-N 3.23Å; V224-L226 PolarHBondContact O-N 3.01Å; L226-F228 VanDerWaalsContact C-N 3.28Å; L226-F228 PolarHBondContact O-N 3.38Å; L226-A229 PolarHBondContact O-N 2.96Å; L226-I230 HydrophobicContact CD1-CD1 4.11Å; L226-I230 HydrophobicContact CD1-CG1 4.49Å; L226-I230 HydrophobicContact CG-CD1 4.06Å; L226-I230 WeakPolarHBondContact O-CG1 3.32Å; L226-I230 PolarHBondContact O-N 3.34Å; L226-L286 HydrophobicContact CD1-CB 4.44Å; L226-Y287 HydrophobicContact CD1-CD1 3.94Å; L226-Y287 HydrophobicContact CD1-CE1 4.3Å; L226-Y287 HydrophobicContact CD2-CD1 3.81Å; L226-Y287 HydrophobicContact CD2-CE1 3.95Å; L226-Y287 HydrophobicContact CG-CD1 4.28Å; L226-Y287 HydrophobicContact CG-CE1 4.3Å; L226-V290 HydrophobicContact CB-CG1 4.24Å; L226-V290 HydrophobicContact CD1-CB 3.92Å; L226-V290 HydrophobicContact CD1-CG1 4.2Å |
| 227 | I | 86.4 | Confident | 83.3 | Confident | 4 Ų | 4 | 65.6 Ų | 65.6 | 2% | 0.021 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -66.2 | -35.2 | -179.4 | -63.6 | 168.8 | 0 | 0 | 0 | 110.4 | M123 R127 Y205 T223 V224 I230 V231 | M123-I227 HydrophobicContact CE-CG1 4.32Å; M123-I227 HydrophobicContact CE-CG2 3.81Å; M123-I227 HydrophobicContact CG-CD1 3.95Å; M123-I227 HydrophobicContact CG-CG1 4.48Å; M123-I227 HydrophobicContact CG-CG2 4.25Å; M123-I227 HydrophobicContact SD-CD1 3.89Å; M123-I227 HydrophobicContact SD-CG1 3.94Å; M123-I227 HydrophobicContact SD-CG2 4.25Å; R127-I227 HydrophobicContact CG-CD1 3.32Å; Y205-I227 VanDerWaalsContact OH-CG2 3.26Å; Y205-I227 WeakPolarHBondContact OH-CG2 3.19Å; Y205-I227 PolarHBondContact OH-O 3.38Å; T223-I227 HydrophobicContact CG2-CD1 3.82Å; T223-I227 WeakPolarHBondContact O-CG1 3.44Å; T223-I227 PolarHBondContact O-N 3.08Å; V224-I227 PolarHBondContact O-N 2.9Å; I227-I230 PolarHBondContact O-N 3.31Å; I227-V231 HydrophobicContact CG2-CG2 4.44Å; I227-V231 WeakPolarHBondContact O-CB 3.37Å; I227-V231 VanDerWaalsContact O-CG2 3.3Å; I227-V231 WeakPolarHBondContact O-CG2 3.21Å; I227-V231 PolarHBondContact O-N 2.8Å |
| 228 | F | 90.4 | Very high | 84.7 | Confident | 97 Ų | 97 | 63 Ų | 63 | 43% | 0.425 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -63.2 | -44.6 | 174.5 | -179.8 | -101.8 | 0 | 0 | 0 | 111.3 | Y205 V224 L226 I230 V231 V232 | Y205-F228 AromaticContact CD1-CD2 3.8Å; Y205-F228 HydrophobicContact CD1-CD2 3.8Å; Y205-F228 HydrophobicContact CD2-CD2 4.27Å; Y205-F228 HydrophobicContact CE1-CB 3.69Å; Y205-F228 AromaticContact CE1-CD2 3.72Å; Y205-F228 HydrophobicContact CE1-CD2 3.72Å; Y205-F228 HydrophobicContact CE1-CG 4.17Å; Y205-F228 HydrophobicContact CE2-CD2 4.19Å; Y205-F228 HydrophobicContact CG-CD2 4.1Å; Y205-F228 AromaticContact CZ-CD2 3.93Å; Y205-F228 WeakPolarHBondContact OH-CA 3.12Å; Y205-F228 PolarHBondContact OH-N 2.82Å; V224-F228 VanDerWaalsContact O-CB 3.25Å; V224-F228 WeakPolarHBondContact O-CB 3.37Å; V224-F228 PolarHBondContact O-N 3.13Å; L226-F228 VanDerWaalsContact C-N 3.28Å; L226-F228 PolarHBondContact O-N 3.38Å; F228-I230 VanDerWaalsContact C-N 3.33Å; F228-I230 PolarHBondContact O-N 2.99Å; F228-V231 PolarHBondContact O-N 2.88Å; F228-V232 HydrophobicContact CD1-CG2 4.16Å; F228-V232 HydrophobicContact CD2-CG2 4.38Å; F228-V232 HydrophobicContact CE1-CG2 3.73Å; F228-V232 HydrophobicContact CE2-CG2 3.98Å; F228-V232 HydrophobicContact CG-CG2 4.47Å; F228-V232 HydrophobicContact CZ-CG2 3.63Å; F228-V232 WeakPolarHBondContact O-CG2 3.37Å; F228-V232 PolarHBondContact O-N 3.31Å |
| 229 | A | 91 | Very high | 86.3 | Confident | 25 Ų | 25 | 55.5 Ų | 55.5 | 21% | 0.207 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -61.2 | -41.9 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112 | K225 L226 V232 A233 L286 | K225-A229 WeakPolarHBondContact O-CB 3.33Å; K225-A229 PolarHBondContact O-N 3.1Å; L226-A229 PolarHBondContact O-N 2.96Å; A229-V232 PolarHBondContact O-N 3.48Å; A229-A233 WeakPolarHBondContact O-CB 3.42Å; A229-A233 PolarHBondContact O-N 3.46Å; A229-L286 HydrophobicContact CB-CD1 4.43Å; A229-L286 HydrophobicContact CB-CD2 4.12Å |
| 230 | I | 91.5 | Very high | 88.1 | Confident | 1 Ų | 1 | 47.3 Ų | 47.3 | 1% | 0.005 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -61.7 | -47.3 | 176.2 | -69.8 | 165.6 | 0 | 0 | 0 | 110.9 | L120 L226 I227 F228 A233 Y234 N283 L286 Y287 | L120-I230 HydrophobicContact CD2-CG2 3.44Å; L120-I230 VanDerWaalsContact CD2-CG2 3.44Å; L226-I230 HydrophobicContact CD1-CD1 4.11Å; L226-I230 HydrophobicContact CD1-CG1 4.49Å; L226-I230 HydrophobicContact CG-CD1 4.06Å; L226-I230 WeakPolarHBondContact O-CG1 3.32Å; L226-I230 PolarHBondContact O-N 3.34Å; I227-I230 PolarHBondContact O-N 3.31Å; F228-I230 VanDerWaalsContact C-N 3.33Å; F228-I230 PolarHBondContact O-N 2.99Å; I230-A233 PolarHBondContact O-N 3.4Å; I230-Y234 PolarHBondContact O-N 2.79Å; I230-N283 WeakPolarHBondContact CG2-OD1 3.49Å; I230-L286 HydrophobicContact CB-CD1 4.38Å; I230-L286 HydrophobicContact CG1-CB 4.26Å; I230-L286 HydrophobicContact CG1-CD1 3.88Å; I230-Y287 HydrophobicContact CD1-CD1 4.39Å; I230-Y287 HydrophobicContact CD1-CE1 3.53Å |
| 231 | V | 92.9 | Very high | 89.6 | Confident | 6 Ų | 6 | 45.6 Ų | 45.6 | 4% | 0.036 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -60.1 | -49.1 | 177.6 | 161.7 | 0 | 0 | 0 | 0 | 111 | L120 I201 Y205 I227 F228 A233 Y234 F235 | L120-V231 HydrophobicContact CD2-CG2 4.5Å; I201-V231 HydrophobicContact CD1-CG2 4.46Å; I201-V231 HydrophobicContact CG2-CG1 3.47Å; I201-V231 VanDerWaalsContact CG2-CG1 3.47Å; I201-V231 HydrophobicContact CG2-CG2 4.36Å; Y205-V231 HydrophobicContact CE2-CB 4.4Å; Y205-V231 HydrophobicContact CE2-CG1 4.27Å; Y205-V231 HydrophobicContact CE2-CG2 4.2Å; I227-V231 HydrophobicContact CG2-CG2 4.44Å; I227-V231 WeakPolarHBondContact O-CB 3.37Å; I227-V231 VanDerWaalsContact O-CG2 3.3Å; I227-V231 WeakPolarHBondContact O-CG2 3.21Å; I227-V231 PolarHBondContact O-N 2.8Å; F228-V231 PolarHBondContact O-N 2.88Å; V231-A233 VanDerWaalsContact C-N 3.34Å; V231-A233 PolarHBondContact O-N 2.95Å; V231-Y234 WeakPolarHBondContact O-CB 3.01Å; V231-Y234 PolarHBondContact O-N 2.97Å; V231-F235 HydrophobicContact CG1-CD2 3.8Å; V231-F235 HydrophobicContact CG1-CE2 3.95Å; V231-F235 VanDerWaalsContact O-CD2 3.26Å; V231-F235 WeakPolarHBondContact O-CD2 3.21Å; V231-F235 PolarHBondContact O-N 3.48Å |
| 232 | V | 94.1 | Very high | 90.8 | Very high | 55 Ų | 55 | 42.4 Ų | 42.4 | 33% | 0.333 | 22% | 0.215 | S | C | . | . | H | α-helix | trans | -60.5 | -45.3 | 178.9 | 170.4 | 0 | 0 | 0 | 0 | 110.7 | F228 A229 Y234 F235 L236 | F228-V232 HydrophobicContact CD1-CG2 4.16Å; F228-V232 HydrophobicContact CD2-CG2 4.38Å; F228-V232 HydrophobicContact CE1-CG2 3.73Å; F228-V232 HydrophobicContact CE2-CG2 3.98Å; F228-V232 HydrophobicContact CG-CG2 4.47Å; F228-V232 HydrophobicContact CZ-CG2 3.63Å; F228-V232 WeakPolarHBondContact O-CG2 3.37Å; F228-V232 PolarHBondContact O-N 3.31Å; A229-V232 PolarHBondContact O-N 3.48Å; V232-Y234 VanDerWaalsContact C-N 3.32Å; V232-Y234 PolarHBondContact O-N 3.33Å; V232-F235 PolarHBondContact O-N 2.97Å; V232-L236 HydrophobicContact CG1-CD1 3.6Å; V232-L236 HydrophobicContact CG1-CG 4.06Å; V232-L236 WeakPolarHBondContact O-CB 3.33Å; V232-L236 VanDerWaalsContact O-CG 3.26Å; V232-L236 WeakPolarHBondContact O-CG 3.38Å; V232-L236 PolarHBondContact O-N 2.89Å |
| 233 | A | 94.2 | Very high | 91.7 | Very high | 19 Ų | 19 | 40 Ų | 40 | 16% | 0.157 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -58.9 | -43.3 | 176.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | A229 I230 V231 S237 F282 L286 | A229-A233 WeakPolarHBondContact O-CB 3.42Å; A229-A233 PolarHBondContact O-N 3.46Å; I230-A233 PolarHBondContact O-N 3.4Å; V231-A233 VanDerWaalsContact C-N 3.34Å; V231-A233 PolarHBondContact O-N 2.95Å; A233-S237 WeakPolarHBondContact O-CB 3.2Å; A233-S237 PolarHBondContact O-N 3.44Å; A233-S237 PolarHBondContact O-OG 3.17Å; A233-F282 HydrophobicContact CB-CB 4.35Å; A233-F282 HydrophobicContact CB-CD2 4.27Å; A233-L286 HydrophobicContact CB-CD1 3.86Å |
| 234 | Y | 94.4 | Very high | 92.6 | Very high | 10 Ų | 10 | 37.7 Ų | 37.7 | 4% | 0.039 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -59.2 | -52.4 | 176.8 | -175.1 | -88.6 | 0 | 0 | 0 | 112.1 | I117 L120 F194 I230 V231 V232 S237 W238 | I117-Y234 HydrophobicContact CB-CE1 4.11Å; I117-Y234 HydrophobicContact CD1-CE1 3.85Å; I117-Y234 HydrophobicContact CG1-CE1 3.82Å; L120-Y234 HydrophobicContact CD1-CD1 4.07Å; L120-Y234 HydrophobicContact CD1-CD2 3.41Å; L120-Y234 VanDerWaalsContact CD1-CD2 3.41Å; L120-Y234 HydrophobicContact CD1-CE2 3.99Å; L120-Y234 HydrophobicContact CD1-CG 3.46Å; L120-Y234 VanDerWaalsContact CD1-CG 3.46Å; F194-Y234 HydrophobicContact CD2-CE1 4.48Å; F194-Y234 HydrophobicContact CE2-CE1 4.3Å; I230-Y234 PolarHBondContact O-N 2.79Å; V231-Y234 WeakPolarHBondContact O-CB 3.01Å; V231-Y234 PolarHBondContact O-N 2.97Å; V232-Y234 VanDerWaalsContact C-N 3.32Å; V232-Y234 PolarHBondContact O-N 3.33Å; Y234-S237 PolarHBondContact O-N 3.4Å; Y234-S237 VanDerWaalsContact O-N 3.16Å; Y234-W238 AromaticContact CD2-CD1 3.67Å; Y234-W238 HydrophobicContact CE1-CB 4.33Å; Y234-W238 AromaticContact CE1-CD1 3.85Å; Y234-W238 HydrophobicContact CE1-CG 4.23Å; Y234-W238 AromaticContact CE2-CD1 3.37Å; Y234-W238 HydrophobicContact CE2-CG 4.34Å; Y234-W238 AromaticContact CE2-NE1 3.48Å; Y234-W238 AromaticContact CZ-CD1 3.44Å; Y234-W238 VanDerWaalsContact CZ-CD1 3.44Å; Y234-W238 AromaticContact CZ-NE1 3.82Å; Y234-W238 PolarHBondContact O-N 3Å |
| 235 | F | 95.3 | Very high | 93.1 | Very high | 26 Ų | 26 | 38 Ų | 38 | 11% | 0.114 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -69.5 | -34.4 | -177.5 | -78.1 | -76.1 | 0 | 0 | 0 | 113.2 | F194 L198 I201 V231 V232 S237 G239 | F194-F235 HydrophobicContact CD1-CE1 4.43Å; F194-F235 HydrophobicContact CD2-CD1 4.25Å; F194-F235 AromaticContact CD2-CE1 3.95Å; F194-F235 HydrophobicContact CD2-CE1 3.95Å; F194-F235 AromaticContact CE1-CD1 3.87Å; F194-F235 HydrophobicContact CE1-CD1 3.87Å; F194-F235 HydrophobicContact CE1-CE1 4.12Å; F194-F235 AromaticContact CE2-CD1 3.43Å; F194-F235 HydrophobicContact CE2-CD1 3.43Å; F194-F235 VanDerWaalsContact CE2-CD1 3.43Å; F194-F235 AromaticContact CE2-CE1 3.6Å; F194-F235 HydrophobicContact CE2-CE1 3.6Å; F194-F235 HydrophobicContact CE2-CG 4.47Å; F194-F235 HydrophobicContact CG-CE1 4.37Å; F194-F235 AromaticContact CZ-CD1 3.24Å; F194-F235 HydrophobicContact CZ-CD1 3.24Å; F194-F235 AromaticContact CZ-CE1 3.72Å; F194-F235 HydrophobicContact CZ-CE1 3.72Å; F194-F235 HydrophobicContact CZ-CG 4.32Å; L198-F235 HydrophobicContact CB-CD1 4.28Å; L198-F235 HydrophobicContact CB-CE1 3.55Å; L198-F235 HydrophobicContact CB-CZ 3.83Å; L198-F235 HydrophobicContact CD1-CD1 3.73Å; L198-F235 HydrophobicContact CD1-CD2 4.14Å; L198-F235 HydrophobicContact CD1-CE1 3.75Å; L198-F235 HydrophobicContact CD1-CE2 4.12Å; L198-F235 HydrophobicContact CD1-CG 3.99Å; L198-F235 HydrophobicContact CD1-CZ 3.94Å; L198-F235 HydrophobicContact CG-CD1 4.38Å; L198-F235 HydrophobicContact CG-CE1 4.11Å; L198-F235 HydrophobicContact CG-CZ 4.49Å; I201-F235 HydrophobicContact CD1-CE2 3.72Å; I201-F235 HydrophobicContact CD1-CZ 4.06Å; V231-F235 HydrophobicContact CG1-CD2 3.8Å; V231-F235 HydrophobicContact CG1-CE2 3.95Å; V231-F235 VanDerWaalsContact O-CD2 3.26Å; V231-F235 WeakPolarHBondContact O-CD2 3.21Å; V231-F235 PolarHBondContact O-N 3.48Å; V232-F235 PolarHBondContact O-N 2.97Å; F235-S237 VanDerWaalsContact C-N 3.26Å; F235-S237 PolarHBondContact O-N 3.04Å; F235-G239 VanDerWaalsContact O-CA 3.27Å; F235-G239 WeakPolarHBondContact O-CA 3.42Å; F235-G239 PolarHBondContact O-N 3.49Å |
| 236 | L | 95.3 | Very high | 93.5 | Very high | 117 Ų | 117 | 34.2 Ų | 34.2 | 61% | 0.613 | 18% | 0.18 | S | C | * | . | H | α-helix | trans | -67.6 | -29.3 | 172.4 | -71.3 | 178.8 | 0 | 0 | 0 | 112.2 | V232 P240 | V232-L236 HydrophobicContact CG1-CD1 3.6Å; V232-L236 HydrophobicContact CG1-CG 4.06Å; V232-L236 WeakPolarHBondContact O-CB 3.33Å; V232-L236 VanDerWaalsContact O-CG 3.26Å; V232-L236 WeakPolarHBondContact O-CG 3.38Å; V232-L236 PolarHBondContact O-N 2.89Å; L236-P240 WeakPolarHBondContact O-CD 3.46Å; L236-P240 WeakPolarHBondContact O-CG 3.04Å |
| 237 | S | 95.6 | Very high | 93.9 | Very high | 2 Ų | 2 | 35.3 Ų | 35.3 | 1% | 0.014 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -77.7 | -50.3 | 178.2 | -51.6 | 0 | 0 | 0 | 0 | 111.8 | A233 Y234 F235 A276 F282 | A233-S237 WeakPolarHBondContact O-CB 3.2Å; A233-S237 PolarHBondContact O-N 3.44Å; A233-S237 PolarHBondContact O-OG 3.17Å; Y234-S237 PolarHBondContact O-N 3.4Å; Y234-S237 VanDerWaalsContact O-N 3.16Å; F235-S237 VanDerWaalsContact C-N 3.26Å; F235-S237 PolarHBondContact O-N 3.04Å; S237-A276 WeakPolarHBondContact O-CA 3.48Å; S237-A276 WeakPolarHBondContact O-CB 3.33Å; S237-A276 PolarHBondContact O-N 3.16Å; S237-F282 WeakPolarHBondContact OG-CD2 3.39Å; S237-F282 WeakPolarHBondContact OG-CE2 3.31Å |
| 238 | W | 96.1 | Very high | 94.1 | Very high | 3 Ų | 3 | 37.4 Ų | 37.4 | 1% | 0.011 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -88.3 | -27.2 | -172.4 | -77.1 | 102.5 | 0 | 0 | 0 | 113.9 | F80 F109 L113 F194 Y234 Y241 N242 A276 F277 H279 | F80-W238 HydrophobicContact CE2-CH2 4.16Å; F80-W238 HydrophobicContact CE2-CZ2 4.09Å; F80-W238 HydrophobicContact CZ-CH2 4.3Å; F80-W238 HydrophobicContact CZ-CZ2 4.18Å; F109-W238 HydrophobicContact CE2-CH2 4.38Å; F109-W238 AromaticContact CZ-CH2 3.95Å; F109-W238 HydrophobicContact CZ-CH2 3.95Å; F109-W238 HydrophobicContact CZ-CZ3 4.41Å; L113-W238 HydrophobicContact CD1-CD2 3.79Å; L113-W238 HydrophobicContact CD1-CE3 3.66Å; L113-W238 HydrophobicContact CD1-CH2 3.23Å; L113-W238 HydrophobicContact CD1-CZ2 3.33Å; L113-W238 HydrophobicContact CD1-CZ3 3.38Å; F194-W238 HydrophobicContact CD2-CB 4.46Å; F194-W238 HydrophobicContact CE2-CB 3.74Å; Y234-W238 AromaticContact CD2-CD1 3.67Å; Y234-W238 HydrophobicContact CE1-CB 4.33Å; Y234-W238 AromaticContact CE1-CD1 3.85Å; Y234-W238 HydrophobicContact CE1-CG 4.23Å; Y234-W238 AromaticContact CE2-CD1 3.37Å; Y234-W238 HydrophobicContact CE2-CG 4.34Å; Y234-W238 AromaticContact CE2-NE1 3.48Å; Y234-W238 AromaticContact CZ-CD1 3.44Å; Y234-W238 VanDerWaalsContact CZ-CD1 3.44Å; Y234-W238 AromaticContact CZ-NE1 3.82Å; Y234-W238 PolarHBondContact O-N 3Å; W238-Y241 AromaticContact CE3-CD1 3.93Å; W238-Y241 HydrophobicContact CE3-CD1 3.93Å; W238-Y241 AromaticContact CZ3-CD1 3.8Å; W238-Y241 HydrophobicContact CZ3-CD1 3.8Å; W238-Y241 HydrophobicContact CZ3-CE1 4.06Å; W238-Y241 PolarHBondContact O-N 3.42Å; W238-N242 PolarHBondContact O-N 3.09Å; W238-N242 PolarHBondContact O-ND2 3.07Å; W238-A276 HydrophobicContact CD2-CB 3.96Å; W238-A276 HydrophobicContact CE3-CB 3.77Å; W238-A276 HydrophobicContact CH2-CB 4.31Å; W238-A276 HydrophobicContact CZ3-CB 3.96Å; W238-F277 HydrophobicContact CH2-CD1 4.3Å; W238-F277 HydrophobicContact CH2-CE1 4.34Å; W238-H279 AromaticContact CE2-CE1 3.84Å; W238-H279 AromaticContact CE2-ND1 3.58Å; W238-H279 AromaticContact CZ2-CE1 3.5Å; W238-H279 AromaticContact CZ2-ND1 3.49Å; W238-H279 WeakPolarHBondContact CZ2-ND1 2.87Å; W238-H279 AromaticContact NE1-CD2 3.52Å; W238-H279 AromaticContact NE1-CE1 3.57Å; W238-H279 AromaticContact NE1-CG 3.17Å; W238-H279 AromaticContact NE1-ND1 3.2Å; W238-H279 PolarHBondContact NE1-ND1 3.05Å; W238-H279 VanDerWaalsContact NE1-ND1 3.2Å; W238-H279 AromaticContact NE1-NE2 3.73Å |
| 239 | G | 95.6 | Very high | 94.3 | Very high | 18 Ų | 18 | 32.8 Ų | 32.8 | 19% | 0.186 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -58.6 | -52.1 | -177.3 | 0 | 0 | 0 | 0 | 0 | 113.5 | F194 F235 Y241 N242 F243 | F194-G239 VanDerWaalsContact CZ-CA 3.4Å; F235-G239 VanDerWaalsContact O-CA 3.27Å; F235-G239 WeakPolarHBondContact O-CA 3.42Å; F235-G239 PolarHBondContact O-N 3.49Å; G239-Y241 VanDerWaalsContact C-N 3.29Å; G239-Y241 PolarHBondContact O-N 2.83Å; G239-N242 PolarHBondContact O-N 2.64Å; G239-F243 WeakPolarHBondContact O-CB 3.48Å; G239-F243 PolarHBondContact O-N 3.35Å |
| 240 | P | 96.4 | Very high | 94.3 | Very high | 48 Ų | 48 | 33 Ų | 33 | 31% | 0.312 | 17% | 0.172 | S | C | . | . | H | α-helix | trans | -57 | -42.7 | 177 | -25.9 | 35.5 | 0 | 0 | 0 | 112.3 | L236 F243 T244 C272 L275 | L236-P240 WeakPolarHBondContact O-CD 3.46Å; L236-P240 WeakPolarHBondContact O-CG 3.04Å; P240-F243 PolarHBondContact O-N 2.01Å; P240-T244 WeakPolarHBondContact O-CG2 3.21Å; P240-T244 PolarHBondContact O-N 3.23Å; P240-T244 PolarHBondContact O-OG1 3.3Å; P240-T244 VanDerWaalsContact O-OG1 3.08Å; P240-C272 HydrophobicContact CB-CB 4.08Å; P240-C272 VanDerWaalsContact CB-SG 3.53Å; P240-L275 HydrophobicContact CG-CD2 4.44Å |
| 241 | Y | 95.8 | Very high | 94.1 | Very high | 39 Ų | 39 | 34.2 Ų | 34.2 | 15% | 0.153 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -64.8 | -48.9 | 179.9 | -179 | -115.1 | 0 | 0 | 0 | 112.7 | W238 G239 F243 T244 L245 C272 R273 A276 | W238-Y241 AromaticContact CE3-CD1 3.93Å; W238-Y241 HydrophobicContact CE3-CD1 3.93Å; W238-Y241 AromaticContact CZ3-CD1 3.8Å; W238-Y241 HydrophobicContact CZ3-CD1 3.8Å; W238-Y241 HydrophobicContact CZ3-CE1 4.06Å; W238-Y241 PolarHBondContact O-N 3.42Å; G239-Y241 VanDerWaalsContact C-N 3.29Å; G239-Y241 PolarHBondContact O-N 2.83Å; Y241-F243 VanDerWaalsContact C-N 3.26Å; Y241-F243 PolarHBondContact O-N 3.29Å; Y241-T244 WeakPolarHBondContact CA-OG1 3.45Å; Y241-T244 PolarHBondContact O-N 2.63Å; Y241-T244 PolarHBondContact O-OG1 3Å; Y241-L245 HydrophobicContact CD1-CD1 3.97Å; Y241-L245 HydrophobicContact CD2-CG 4.5Å; Y241-L245 HydrophobicContact CE1-CD1 3.44Å; Y241-L245 VanDerWaalsContact CE1-CD1 3.44Å; Y241-L245 HydrophobicContact CE1-CG 4.19Å; Y241-L245 HydrophobicContact CE2-CD1 4.23Å; Y241-L245 HydrophobicContact CE2-CD2 4.33Å; Y241-L245 HydrophobicContact CE2-CG 4.11Å; Y241-L245 WeakPolarHBondContact O-CG 3.28Å; Y241-L245 PolarHBondContact O-N 2.73Å; Y241-C272 HydrophobicContact CD2-CB 4.48Å; Y241-R273 HydrophobicContact CD2-CB 3.85Å; Y241-R273 HydrophobicContact CE2-CB 3.69Å; Y241-R273 HydrophobicContact CE2-CG 4.06Å; Y241-A276 HydrophobicContact CD1-CB 4.28Å; Y241-A276 HydrophobicContact CG-CB 4.1Å |
| 242 | N | 95.3 | Very high | 93.9 | Very high | 9 Ų | 9 | 38 Ų | 38 | 5% | 0.048 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -60.5 | -38.3 | 177.1 | -78.3 | -77.2 | 0 | 0 | 0 | 111.9 | N191 W238 G239 L245 F246 | N191-N242 PolarHBondContact ND2-O 3.32Å; W238-N242 PolarHBondContact O-N 3.09Å; W238-N242 PolarHBondContact O-ND2 3.07Å; G239-N242 PolarHBondContact O-N 2.64Å; N242-L245 PolarHBondContact O-N 3.41Å; N242-F246 WeakPolarHBondContact O-CB 3.06Å; N242-F246 PolarHBondContact O-N 2.91Å |
| 243 | F | 95.1 | Very high | 93.7 | Very high | 121 Ų | 121 | 38 Ų | 38 | 53% | 0.531 | 20% | 0.195 | S | C | . | . | H | α-helix | trans | -65.6 | -46 | 175.2 | -179.4 | -110 | 0 | 0 | 0 | 112 | G239 P240 Y241 L245 F246 L247 | G239-F243 WeakPolarHBondContact O-CB 3.48Å; G239-F243 PolarHBondContact O-N 3.35Å; P240-F243 PolarHBondContact O-N 2.01Å; Y241-F243 VanDerWaalsContact C-N 3.26Å; Y241-F243 PolarHBondContact O-N 3.29Å; F243-L245 VanDerWaalsContact C-N 3.34Å; F243-L245 PolarHBondContact O-N 3.42Å; F243-F246 WeakPolarHBondContact O-CB 3.37Å; F243-F246 PolarHBondContact O-N 3.48Å; F243-L247 HydrophobicContact CD1-CD1 4.07Å; F243-L247 HydrophobicContact CD1-CG 4.48Å; F243-L247 HydrophobicContact CE1-CD1 3.51Å; F243-L247 HydrophobicContact CE1-CG 4.11Å; F243-L247 HydrophobicContact CE2-CD2 4.39Å; F243-L247 HydrophobicContact CE2-CG 4.4Å; F243-L247 HydrophobicContact CZ-CD1 3.84Å; F243-L247 HydrophobicContact CZ-CD2 4.11Å; F243-L247 HydrophobicContact CZ-CG 4.06Å; F243-L247 WeakPolarHBondContact O-CG 3.36Å; F243-L247 PolarHBondContact O-N 3.38Å |
| 244 | T | 94.9 | Very high | 93.2 | Very high | 9 Ų | 9 | 42.1 Ų | 42.1 | 6% | 0.055 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -63.9 | -37.5 | 176.6 | 49.6 | 0 | 0 | 0 | 0 | 112.6 | P240 Y241 L247 Q248 L265 A268 L269 C272 | P240-T244 WeakPolarHBondContact O-CG2 3.21Å; P240-T244 PolarHBondContact O-N 3.23Å; P240-T244 PolarHBondContact O-OG1 3.3Å; P240-T244 VanDerWaalsContact O-OG1 3.08Å; Y241-T244 WeakPolarHBondContact CA-OG1 3.45Å; Y241-T244 PolarHBondContact O-N 2.63Å; Y241-T244 PolarHBondContact O-OG1 3Å; T244-L247 PolarHBondContact O-N 3.08Å; T244-Q248 PolarHBondContact O-N 3.38Å; T244-L265 HydrophobicContact CG2-CD1 4.17Å; T244-A268 HydrophobicContact CG2-CB 4.09Å; T244-L269 WeakPolarHBondContact OG1-CD2 3.46Å; T244-C272 HydrophobicContact CG2-CB 4.42Å |
| 245 | L | 93.3 | Very high | 92.8 | Very high | 19 Ų | 19 | 47.3 Ų | 47.3 | 10% | 0.099 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -63.3 | -43 | 173 | -76.4 | 177.9 | 0 | 0 | 0 | 111.5 | V187 Y241 N242 F243 Q248 T249 L269 | V187-L245 HydrophobicContact CG1-CB 4.06Å; V187-L245 HydrophobicContact CG2-CB 4.36Å; Y241-L245 HydrophobicContact CD1-CD1 3.97Å; Y241-L245 HydrophobicContact CD2-CG 4.5Å; Y241-L245 HydrophobicContact CE1-CD1 3.44Å; Y241-L245 VanDerWaalsContact CE1-CD1 3.44Å; Y241-L245 HydrophobicContact CE1-CG 4.19Å; Y241-L245 HydrophobicContact CE2-CD1 4.23Å; Y241-L245 HydrophobicContact CE2-CD2 4.33Å; Y241-L245 HydrophobicContact CE2-CG 4.11Å; Y241-L245 WeakPolarHBondContact O-CG 3.28Å; Y241-L245 PolarHBondContact O-N 2.73Å; N242-L245 PolarHBondContact O-N 3.41Å; F243-L245 VanDerWaalsContact C-N 3.34Å; F243-L245 PolarHBondContact O-N 3.42Å; L245-Q248 WeakPolarHBondContact O-CB 3.43Å; L245-Q248 PolarHBondContact O-N 2.95Å; L245-T249 WeakPolarHBondContact O-CG2 3.38Å; L245-T249 PolarHBondContact O-N 3.48Å; L245-L269 HydrophobicContact CD2-CD2 3.98Å; L245-L269 HydrophobicContact CG-CD2 4.29Å |
| 246 | F | 94.6 | Very high | 92.2 | Very high | 68 Ų | 68 | 49 Ų | 49 | 30% | 0.298 | 25% | 0.248 | S | C | . | . | H | α-helix | trans | -60.3 | -45 | 174.1 | 171.8 | -97.4 | 0 | 0 | 0 | 111.4 | Y188 N242 F243 Q248 T249 L250 | Y188-F246 HydrophobicContact CE1-CD2 4.18Å; Y188-F246 HydrophobicContact CE1-CE2 4.06Å; N242-F246 WeakPolarHBondContact O-CB 3.06Å; N242-F246 PolarHBondContact O-N 2.91Å; F243-F246 WeakPolarHBondContact O-CB 3.37Å; F243-F246 PolarHBondContact O-N 3.48Å; F246-Q248 VanDerWaalsContact C-N 3.26Å; F246-Q248 PolarHBondContact O-N 3.22Å; F246-T249 PolarHBondContact O-N 3.47Å; F246-T249 VanDerWaalsContact O-N 3.16Å; F246-T249 PolarHBondContact O-OG1 3.21Å; F246-L250 HydrophobicContact CE1-CD1 3.99Å; F246-L250 HydrophobicContact CE1-CG 4.45Å; F246-L250 HydrophobicContact CZ-CD1 4.4Å; F246-L250 HydrophobicContact CZ-CD2 4.29Å |
| 247 | L | 93.6 | Very high | 91.5 | Very high | 45 Ų | 45 | 53.2 Ų | 53.2 | 24% | 0.236 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -60.1 | -38.7 | 175.1 | -69.1 | -178.8 | 0 | 0 | 0 | 111.8 | F243 T244 T249 L250 F251 L265 | F243-L247 HydrophobicContact CD1-CD1 4.07Å; F243-L247 HydrophobicContact CD1-CG 4.48Å; F243-L247 HydrophobicContact CE1-CD1 3.51Å; F243-L247 HydrophobicContact CE1-CG 4.11Å; F243-L247 HydrophobicContact CE2-CD2 4.39Å; F243-L247 HydrophobicContact CE2-CG 4.4Å; F243-L247 HydrophobicContact CZ-CD1 3.84Å; F243-L247 HydrophobicContact CZ-CD2 4.11Å; F243-L247 HydrophobicContact CZ-CG 4.06Å; F243-L247 WeakPolarHBondContact O-CG 3.36Å; F243-L247 PolarHBondContact O-N 3.38Å; T244-L247 PolarHBondContact O-N 3.08Å; L247-T249 VanDerWaalsContact C-N 3.25Å; L247-T249 PolarHBondContact O-N 3.11Å; L247-L250 HydrophobicContact CD2-CD1 4.12Å; L247-L250 WeakPolarHBondContact O-CB 3.32Å; L247-L250 PolarHBondContact O-N 3.05Å; L247-F251 WeakPolarHBondContact O-CD2 3.44Å; L247-F251 PolarHBondContact O-N 3.32Å; L247-L265 HydrophobicContact CB-CD1 4.02Å; L247-L265 HydrophobicContact CB-CD2 4.16Å; L247-L265 HydrophobicContact CD1-CD1 4.33Å |
| 248 | Q | 91.8 | Very high | 90.9 | Very high | 48 Ų | 48 | 55.4 Ų | 55.4 | 22% | 0.224 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -60.6 | -34.5 | 178.1 | -164.5 | 178.6 | 9.9 | 0 | 0 | 112.1 | Y183 T244 L245 F246 L250 F251 H252 L265 L269 | Y183-Q248 PolarHBondContact OH-OE1 3.4Å; T244-Q248 PolarHBondContact O-N 3.38Å; L245-Q248 WeakPolarHBondContact O-CB 3.43Å; L245-Q248 PolarHBondContact O-N 2.95Å; F246-Q248 VanDerWaalsContact C-N 3.26Å; F246-Q248 PolarHBondContact O-N 3.22Å; Q248-L250 VanDerWaalsContact C-N 3.3Å; Q248-L250 PolarHBondContact O-N 3.15Å; Q248-F251 PolarHBondContact O-N 2.89Å; Q248-H252 PolarHBondContact O-CD2 3.48Å; Q248-H252 VanDerWaalsContact O-CD2 3.24Å; Q248-H252 PolarHBondContact O-N 3.02Å; Q248-L265 HydrophobicContact CB-CD2 4.04Å; Q248-L265 HydrophobicContact CG-CD2 4.49Å; Q248-L269 HydrophobicContact CB-CD1 4.35Å; Q248-L269 HydrophobicContact CG-CD1 4.18Å |
| 249 | T | 92.8 | Very high | 90.2 | Very high | 0 Ų | 0 | 60.9 Ų | 60.9 | 0% | 0 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -64.1 | -34.7 | 175 | 76 | 0 | 0 | 0 | 0 | 112.6 | Y183 L184 V187 L245 F246 L247 F251 H252 T253 | Y183-T249 HydrophobicContact CE1-CG2 4.01Å; L184-T249 HydrophobicContact CD2-CG2 3.61Å; V187-T249 HydrophobicContact CB-CG2 3.93Å; V187-T249 HydrophobicContact CG1-CG2 3.65Å; V187-T249 HydrophobicContact CG2-CG2 4.19Å; L245-T249 WeakPolarHBondContact O-CG2 3.38Å; L245-T249 PolarHBondContact O-N 3.48Å; F246-T249 PolarHBondContact O-N 3.47Å; F246-T249 VanDerWaalsContact O-N 3.16Å; F246-T249 PolarHBondContact O-OG1 3.21Å; L247-T249 VanDerWaalsContact C-N 3.25Å; L247-T249 PolarHBondContact O-N 3.11Å; T249-F251 VanDerWaalsContact C-N 3.31Å; T249-F251 PolarHBondContact O-N 3.39Å; T249-H252 PolarHBondContact O-N 3.01Å; T249-T253 WeakPolarHBondContact O-CB 3.37Å; T249-T253 WeakPolarHBondContact O-CG2 3.32Å; T249-T253 PolarHBondContact O-N 2.95Å; T249-T253 PolarHBondContact O-OG1 2.89Å |
| 250 | L | 91.5 | Very high | 89.6 | Confident | 30 Ų | 30 | 66.5 Ų | 66.5 | 16% | 0.157 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -67.2 | -32.7 | 178.1 | -56 | -179.3 | 0 | 0 | 0 | 112.1 | F246 L247 Q248 T253 Q254 I255 I256 | F246-L250 HydrophobicContact CE1-CD1 3.99Å; F246-L250 HydrophobicContact CE1-CG 4.45Å; F246-L250 HydrophobicContact CZ-CD1 4.4Å; F246-L250 HydrophobicContact CZ-CD2 4.29Å; L247-L250 HydrophobicContact CD2-CD1 4.12Å; L247-L250 WeakPolarHBondContact O-CB 3.32Å; L247-L250 PolarHBondContact O-N 3.05Å; Q248-L250 VanDerWaalsContact C-N 3.3Å; Q248-L250 PolarHBondContact O-N 3.15Å; L250-T253 WeakPolarHBondContact CA-OG1 3.49Å; L250-T253 PolarHBondContact O-OG1 3.41Å; L250-Q254 PolarHBondContact O-N 2.93Å; L250-I255 HydrophobicContact CD2-CD1 3.94Å; L250-I255 PolarHBondContact O-N 3.4Å; L250-I256 HydrophobicContact CB-CD1 3.98Å; L250-I256 HydrophobicContact CB-CG1 4.22Å; L250-I256 HydrophobicContact CD1-CD1 4Å; L250-I256 PolarHBondContact O-N 2.86Å |
| 251 | F | 88.8 | Confident | 89.1 | Confident | 26 Ų | 26 | 65.8 Ų | 65.8 | 11% | 0.114 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -72.7 | -44.9 | 172.2 | -76.1 | -84.8 | 0 | 0 | 0 | 111.6 | L247 Q248 T249 T253 Q254 I256 S258 A261 K262 L265 | L247-F251 WeakPolarHBondContact O-CD2 3.44Å; L247-F251 PolarHBondContact O-N 3.32Å; Q248-F251 PolarHBondContact O-N 2.89Å; T249-F251 VanDerWaalsContact C-N 3.31Å; T249-F251 PolarHBondContact O-N 3.39Å; F251-T253 VanDerWaalsContact C-N 3.28Å; F251-T253 PolarHBondContact O-N 2.92Å; F251-Q254 PolarHBondContact O-N 3.44Å; F251-Q254 PolarHBondContact O-NE2 2.83Å; F251-I256 HydrophobicContact CD1-CB 4.23Å; F251-I256 HydrophobicContact CD1-CG2 4.18Å; F251-I256 WeakPolarHBondContact CD1-O 3.31Å; F251-I256 HydrophobicContact CE1-CB 4.05Å; F251-I256 HydrophobicContact CE1-CG2 3.52Å; F251-I256 HydrophobicContact CE2-CB 4.49Å; F251-I256 HydrophobicContact CE2-CD1 4.43Å; F251-I256 HydrophobicContact CE2-CG2 4.29Å; F251-I256 HydrophobicContact CZ-CB 4.18Å; F251-I256 HydrophobicContact CZ-CG2 3.58Å; F251-S258 WeakPolarHBondContact CE1-O 3.26Å; F251-A261 HydrophobicContact CE1-CB 4.16Å; F251-A261 HydrophobicContact CZ-CB 3.72Å; F251-K262 HydrophobicContact CD1-CB 4.1Å; F251-K262 HydrophobicContact CE1-CB 4.07Å; F251-L265 HydrophobicContact CD2-CD2 3.53Å; F251-L265 HydrophobicContact CE2-CD2 3.68Å |
| 252 | H | 87.7 | Confident | 88.4 | Confident | 87 Ų | 87 | 69 Ų | 69 | 40% | 0.403 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -62 | -36.2 | 177.7 | -80.7 | -67.9 | 0 | 0 | 0 | 112.9 | L180 Y183 Q248 T249 Q254 | L180-H252 HydrophobicContact CD1-CB 3.72Å; L180-H252 HydrophobicContact CD2-CB 4.32Å; Y183-H252 AromaticContact CE1-CD2 3.98Å; Q248-H252 PolarHBondContact O-CD2 3.48Å; Q248-H252 VanDerWaalsContact O-CD2 3.24Å; Q248-H252 PolarHBondContact O-N 3.02Å; T249-H252 PolarHBondContact O-N 3.01Å; H252-Q254 PolarHBondContact O-N 2.89Å |
| 253 | T | 88.9 | Confident | 87.9 | Confident | 53 Ų | 53 | 72.7 Ų | 72.7 | 33% | 0.325 | 36% | 0.359 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -81.3 | 4.3 | 176.6 | 54.1 | 0 | 0 | 0 | 0 | 113.7 | L184 T249 L250 F251 I255 | L184-T253 HydrophobicContact CD1-CG2 4.06Å; L184-T253 HydrophobicContact CD2-CG2 4.31Å; T249-T253 WeakPolarHBondContact O-CB 3.37Å; T249-T253 WeakPolarHBondContact O-CG2 3.32Å; T249-T253 PolarHBondContact O-N 2.95Å; T249-T253 PolarHBondContact O-OG1 2.89Å; L250-T253 WeakPolarHBondContact CA-OG1 3.49Å; L250-T253 PolarHBondContact O-OG1 3.41Å; F251-T253 VanDerWaalsContact C-N 3.28Å; F251-T253 PolarHBondContact O-N 2.92Å; T253-I255 PolarHBondContact O-N 2.87Å; T253-I255 WeakPolarHBondContact OG1-CD1 3.18Å; T253-I255 WeakPolarHBondContact OG1-CG1 3.24Å |
| 254 | Q | 85.6 | Confident | 87.5 | Confident | 106 Ų | 106 | 72.5 Ų | 72.5 | 50% | 0.495 | 36% | 0.36 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 60 | 22.9 | 177.5 | -56.5 | -64.7 | -39.1 | 0 | 0 | 114.3 | L250 F251 H252 R257 | L250-Q254 PolarHBondContact O-N 2.93Å; F251-Q254 PolarHBondContact O-N 3.44Å; F251-Q254 PolarHBondContact O-NE2 2.83Å; H252-Q254 PolarHBondContact O-N 2.89Å; Q254-R257 PolarHBondContact O-NE 3.03Å |
| 255 | I | 84.8 | Confident | 87.3 | Confident | 120 Ų | 120 | 72.8 Ų | 72.8 | 62% | 0.615 | 36% | 0.361 | S | S | * | . | S | Bend | trans | -72 | -41.8 | 172.9 | -63.8 | 173.4 | 0 | 0 | 0 | 109.4 | L250 T253 | L250-I255 HydrophobicContact CD2-CD1 3.94Å; L250-I255 PolarHBondContact O-N 3.4Å; T253-I255 PolarHBondContact O-N 2.87Å; T253-I255 WeakPolarHBondContact OG1-CD1 3.18Å; T253-I255 WeakPolarHBondContact OG1-CG1 3.24Å |
| 256 | I | 82.6 | Confident | 87 | Confident | 62 Ų | 62 | 76.7 Ų | 76.7 | 32% | 0.318 | 38% | 0.379 | S | S | . | . | S | Bend | trans | -109.1 | 127.2 | 173.4 | -55.8 | 175.7 | 0 | 0 | 0 | 108.5 | L250 F251 | L250-I256 HydrophobicContact CB-CD1 3.98Å; L250-I256 HydrophobicContact CB-CG1 4.22Å; L250-I256 HydrophobicContact CD1-CD1 4Å; L250-I256 PolarHBondContact O-N 2.86Å; F251-I256 HydrophobicContact CD1-CB 4.23Å; F251-I256 HydrophobicContact CD1-CG2 4.18Å; F251-I256 WeakPolarHBondContact CD1-O 3.31Å; F251-I256 HydrophobicContact CE1-CB 4.05Å; F251-I256 HydrophobicContact CE1-CG2 3.52Å; F251-I256 HydrophobicContact CE2-CB 4.49Å; F251-I256 HydrophobicContact CE2-CD1 4.43Å; F251-I256 HydrophobicContact CE2-CG2 4.29Å; F251-I256 HydrophobicContact CZ-CB 4.18Å; F251-I256 HydrophobicContact CZ-CG2 3.58Å |
| 257 | R | 80.5 | Confident | 86.6 | Confident | 204 Ų | 204 | 78.6 Ų | 78.6 | 77% | 0.77 | 39% | 0.385 | S | S | * | . | trans | -125 | 64.1 | -176.7 | -59.5 | -176.9 | -171.1 | 177.7 | -2.7 | 111.4 | Q254 | Q254-R257 PolarHBondContact O-NE 3.03Š| ||
| 258 | S | 84.3 | Confident | 86.6 | Confident | 49 Ų | 49 | 78 Ų | 78 | 34% | 0.343 | 39% | 0.387 | S | S | . | . | trans | -125.2 | 118.5 | 174.9 | 171.9 | 0 | 0 | 0 | 0 | 110.5 | F251 A261 K262 | F251-S258 WeakPolarHBondContact CE1-O 3.26Å; S258-A261 WeakPolarHBondContact OG-CB 3.31Å; S258-A261 PolarHBondContact OG-N 3.43Å; S258-K262 WeakPolarHBondContact O-CB 3.35Å; S258-K262 PolarHBondContact O-N 3.29Å | ||
| 259 | C | 79.8 | Confident | 86.6 | Confident | 117 Ų | 117 | 76.7 Ų | 76.7 | 79% | 0.791 | 38% | 0.381 | S | S | * | . | H | α-helix | trans | -66.8 | -40.5 | 179.5 | -65.8 | 0 | 0 | 0 | 0 | 112 | K262 H263 | C259-K262 WeakPolarHBondContact O-CB 3.31Å; C259-K262 PolarHBondContact O-N 3.12Å; C259-H263 PolarHBondContact O-N 3.4Å |
| 260 | E | 84.2 | Confident | 86.5 | Confident | 137 Ų | 137 | 78.3 Ų | 78.3 | 64% | 0.64 | 39% | 0.39 | S | S | * | . | H | α-helix | trans | -63.4 | -45.9 | 177.6 | -174.5 | -179.8 | 177.6 | 0 | 0 | 111.2 | K262 H263 Q264 | E260-K262 VanDerWaalsContact C-N 3.29Å; E260-K262 PolarHBondContact O-N 3.31Å; E260-H263 PolarHBondContact O-N 3.43Å; E260-Q264 WeakPolarHBondContact O-CG 2.95Å; E260-Q264 PolarHBondContact O-N 3.21Å |
| 261 | A | 85.1 | Confident | 86.6 | Confident | 32 Ų | 32 | 82.5 Ų | 82.5 | 26% | 0.264 | 41% | 0.411 | S | S | . | . | H | α-helix | trans | -65.6 | -33.4 | 178.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | F251 S258 L265 | F251-A261 HydrophobicContact CE1-CB 4.16Å; F251-A261 HydrophobicContact CZ-CB 3.72Å; S258-A261 WeakPolarHBondContact OG-CB 3.31Å; S258-A261 PolarHBondContact OG-N 3.43Å; A261-L265 VanDerWaalsContact O-CB 3.32Å; A261-L265 WeakPolarHBondContact O-CB 3.16Å; A261-L265 PolarHBondContact O-N 3.45Å |
| 262 | K | 82.4 | Confident | 86.9 | Confident | 107 Ų | 107 | 82.2 Ų | 82.2 | 47% | 0.465 | 41% | 0.412 | S | S | . | . | H | α-helix | trans | -63.2 | -46 | 173.2 | -173.8 | -174.3 | 174.4 | -168.8 | 0 | 111.1 | F251 S258 C259 E260 Q264 L265 E266 | F251-K262 HydrophobicContact CD1-CB 4.1Å; F251-K262 HydrophobicContact CE1-CB 4.07Å; S258-K262 WeakPolarHBondContact O-CB 3.35Å; S258-K262 PolarHBondContact O-N 3.29Å; C259-K262 WeakPolarHBondContact O-CB 3.31Å; C259-K262 PolarHBondContact O-N 3.12Å; E260-K262 VanDerWaalsContact C-N 3.29Å; E260-K262 PolarHBondContact O-N 3.31Å; K262-Q264 PolarHBondContact O-N 2.96Å; K262-L265 WeakPolarHBondContact O-CB 3.44Å; K262-L265 PolarHBondContact O-N 2.9Å; K262-E266 PolarHBondContact O-N 2.8Å; K262-E266 VanDerWaalsContact O-N 3.12Å |
| 263 | H | 83.1 | Confident | 87.3 | Confident | 87 Ų | 87 | 81.5 Ų | 81.5 | 40% | 0.403 | 41% | 0.406 | S | S | . | . | H | α-helix | trans | -63 | -43.5 | 178.3 | -168.4 | -11.1 | 0 | 0 | 0 | 111.9 | C259 E260 L265 E266 Y267 | C259-H263 PolarHBondContact O-N 3.4Å; E260-H263 PolarHBondContact O-N 3.43Å; H263-L265 VanDerWaalsContact C-N 3.28Å; H263-L265 PolarHBondContact O-N 3.5Å; H263-E266 PolarHBondContact O-N 2.94Å; H263-Y267 AromaticContact CE1-CD2 3.82Å; H263-Y267 AromaticContact CE1-CE2 2.95Å; H263-Y267 WeakPolarHBondContact CE1-CE2 3.39Å; H263-Y267 AromaticContact CE1-CZ 3.36Å; H263-Y267 PolarHBondContact CE1-OH 3.43Å; H263-Y267 VanDerWaalsContact CE1-OH 3.31Å; H263-Y267 AromaticContact ND1-CD2 3.57Å; H263-Y267 AromaticContact ND1-CE2 3.16Å; H263-Y267 WeakPolarHBondContact ND1-CE2 3.39Å; H263-Y267 AromaticContact ND1-CZ 3.98Å; H263-Y267 AromaticContact NE2-CE2 3.86Å; H263-Y267 WeakPolarHBondContact O-CD2 3.37Å; H263-Y267 PolarHBondContact O-N 3.31Å |
| 264 | Q | 87.8 | Confident | 87.5 | Confident | 117 Ų | 117 | 80 Ų | 80 | 55% | 0.547 | 40% | 0.396 | S | S | . | . | H | α-helix | trans | -61.5 | -37.4 | 175.3 | -69.7 | 177.5 | -1.9 | 0 | 0 | 112.1 | E260 K262 Y267 A268 | E260-Q264 WeakPolarHBondContact O-CG 2.95Å; E260-Q264 PolarHBondContact O-N 3.21Å; K262-Q264 PolarHBondContact O-N 2.96Å; Q264-Y267 PolarHBondContact O-N 3.2Å; Q264-A268 WeakPolarHBondContact O-CB 3.11Å; Q264-A268 PolarHBondContact O-N 2.97Å |
| 265 | L | 89.9 | Confident | 88 | Confident | 14 Ų | 14 | 78.5 Ų | 78.5 | 7% | 0.073 | 39% | 0.391 | C | S | . | . | H | α-helix | trans | -65.3 | -37.7 | 177.8 | -179 | 62.5 | 0 | 0 | 0 | 112.4 | T244 L247 Q248 F251 A261 K262 H263 A268 L269 | T244-L265 HydrophobicContact CG2-CD1 4.17Å; L247-L265 HydrophobicContact CB-CD1 4.02Å; L247-L265 HydrophobicContact CB-CD2 4.16Å; L247-L265 HydrophobicContact CD1-CD1 4.33Å; Q248-L265 HydrophobicContact CB-CD2 4.04Å; Q248-L265 HydrophobicContact CG-CD2 4.49Å; F251-L265 HydrophobicContact CD2-CD2 3.53Å; F251-L265 HydrophobicContact CE2-CD2 3.68Å; A261-L265 VanDerWaalsContact O-CB 3.32Å; A261-L265 WeakPolarHBondContact O-CB 3.16Å; A261-L265 PolarHBondContact O-N 3.45Å; K262-L265 WeakPolarHBondContact O-CB 3.44Å; K262-L265 PolarHBondContact O-N 2.9Å; H263-L265 VanDerWaalsContact C-N 3.28Å; H263-L265 PolarHBondContact O-N 3.5Å; L265-A268 PolarHBondContact O-N 3.37Å; L265-L269 HydrophobicContact CD1-CG 4.41Å; L265-L269 HydrophobicContact CG-CD1 4.09Å; L265-L269 HydrophobicContact CG-CG 4.42Å; L265-L269 WeakPolarHBondContact O-CB 3.36Å; L265-L269 WeakPolarHBondContact O-CG 3.5Å; L265-L269 PolarHBondContact O-N 3.02Å |
| 266 | E | 86.9 | Confident | 88.6 | Confident | 101 Ų | 101 | 72.8 Ų | 72.8 | 47% | 0.472 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -63.4 | -41.1 | 177.5 | -72.3 | 175.6 | -175.3 | 0 | 0 | 111.9 | K262 H263 L269 L270 | K262-E266 PolarHBondContact O-N 2.8Å; K262-E266 VanDerWaalsContact O-N 3.12Å; H263-E266 PolarHBondContact O-N 2.94Å; E266-L269 PolarHBondContact O-N 3.45Å; E266-L270 PolarHBondContact O-N 2.88Å; E266-L270 VanDerWaalsContact O-N 3.13Å |
| 267 | Y | 87.4 | Confident | 89.2 | Confident | 108 Ų | 108 | 70.2 Ų | 70.2 | 42% | 0.424 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -64.9 | -42.9 | 171.5 | -71.5 | -64.2 | 0 | 0 | 0 | 112.3 | H263 Q264 L269 L270 I271 | H263-Y267 AromaticContact CE1-CD2 3.82Å; H263-Y267 AromaticContact CE1-CE2 2.95Å; H263-Y267 WeakPolarHBondContact CE1-CE2 3.39Å; H263-Y267 AromaticContact CE1-CZ 3.36Å; H263-Y267 PolarHBondContact CE1-OH 3.43Å; H263-Y267 VanDerWaalsContact CE1-OH 3.31Å; H263-Y267 AromaticContact ND1-CD2 3.57Å; H263-Y267 AromaticContact ND1-CE2 3.16Å; H263-Y267 WeakPolarHBondContact ND1-CE2 3.39Å; H263-Y267 AromaticContact ND1-CZ 3.98Å; H263-Y267 AromaticContact NE2-CE2 3.86Å; H263-Y267 WeakPolarHBondContact O-CD2 3.37Å; H263-Y267 PolarHBondContact O-N 3.31Å; Q264-Y267 PolarHBondContact O-N 3.2Å; Y267-L269 VanDerWaalsContact C-N 3.33Å; Y267-L269 PolarHBondContact O-N 2.9Å; Y267-L270 PolarHBondContact O-N 3.22Å; Y267-I271 WeakPolarHBondContact O-CG1 3.49Å; Y267-I271 PolarHBondContact O-N 3.35Å; Y267-I271 VanDerWaalsContact O-N 3.11Å |
| 268 | A | 92.9 | Very high | 89.9 | Confident | 34 Ų | 34 | 61 Ų | 61 | 28% | 0.281 | 31% | 0.314 | S | S | . | . | H | α-helix | trans | -62 | -41.9 | 177.7 | 0 | 0 | 0 | 0 | 0 | 111.5 | T244 Q264 L265 L270 I271 C272 | T244-A268 HydrophobicContact CG2-CB 4.09Å; Q264-A268 WeakPolarHBondContact O-CB 3.11Å; Q264-A268 PolarHBondContact O-N 2.97Å; L265-A268 PolarHBondContact O-N 3.37Å; A268-L270 PolarHBondContact O-N 2.96Å; A268-I271 PolarHBondContact O-N 3.46Å; A268-C272 VanDerWaalsContact O-CB 3.22Å; A268-C272 WeakPolarHBondContact O-CB 3.4Å; A268-C272 PolarHBondContact O-N 3.29Å; A268-C272 PolarHBondContact O-SG 2.9Å |
| 269 | L | 92.1 | Very high | 90.4 | Very high | 19 Ų | 19 | 58.8 Ų | 58.8 | 10% | 0.099 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -58.5 | -45.5 | 175.2 | -83.3 | 163.4 | 0 | 0 | 0 | 111.4 | T244 L245 Q248 L265 E266 Y267 R273 | T244-L269 WeakPolarHBondContact OG1-CD2 3.46Å; L245-L269 HydrophobicContact CD2-CD2 3.98Å; L245-L269 HydrophobicContact CG-CD2 4.29Å; Q248-L269 HydrophobicContact CB-CD1 4.35Å; Q248-L269 HydrophobicContact CG-CD1 4.18Å; L265-L269 HydrophobicContact CD1-CG 4.41Å; L265-L269 HydrophobicContact CG-CD1 4.09Å; L265-L269 HydrophobicContact CG-CG 4.42Å; L265-L269 WeakPolarHBondContact O-CB 3.36Å; L265-L269 WeakPolarHBondContact O-CG 3.5Å; L265-L269 PolarHBondContact O-N 3.02Å; E266-L269 PolarHBondContact O-N 3.45Å; Y267-L269 VanDerWaalsContact C-N 3.33Å; Y267-L269 PolarHBondContact O-N 2.9Å; L269-R273 WeakPolarHBondContact O-CB 3.47Å; L269-R273 PolarHBondContact O-N 2.88Å |
| 270 | L | 90.8 | Very high | 91.1 | Very high | 35 Ų | 35 | 53.2 Ų | 53.2 | 18% | 0.183 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -59.4 | -50.4 | 177.5 | 176.6 | 65.5 | 0 | 0 | 0 | 111.7 | A30 E266 Y267 A268 R273 N274 | A30-L270 HydrophobicContact CB-CD2 3.77Å; E266-L270 PolarHBondContact O-N 2.88Å; E266-L270 VanDerWaalsContact O-N 3.13Å; Y267-L270 PolarHBondContact O-N 3.22Å; A268-L270 PolarHBondContact O-N 2.96Å; L270-R273 VanDerWaalsContact CD1-NH2 3.33Å; L270-R273 PolarHBondContact O-N 3.42Å; L270-N274 WeakPolarHBondContact O-CB 3.44Å; L270-N274 PolarHBondContact O-N 3.09Å |
| 271 | I | 92.7 | Very high | 91.5 | Very high | 117 Ų | 117 | 47.1 Ų | 47.1 | 60% | 0.6 | 23% | 0.233 | S | C | * | . | H | α-helix | trans | -64.4 | -46.8 | -178.9 | -64.8 | 168.4 | 0 | 0 | 0 | 110.5 | Y267 A268 R273 N274 L275 | Y267-I271 WeakPolarHBondContact O-CG1 3.49Å; Y267-I271 PolarHBondContact O-N 3.35Å; Y267-I271 VanDerWaalsContact O-N 3.11Å; A268-I271 PolarHBondContact O-N 3.46Å; I271-R273 VanDerWaalsContact C-N 3.34Å; I271-R273 PolarHBondContact O-N 3.02Å; I271-N274 PolarHBondContact O-N 3.44Å; I271-L275 PolarHBondContact O-N 2.84Å |
| 272 | C | 96.1 | Very high | 91.7 | Very high | 20 Ų | 20 | 48.5 Ų | 48.5 | 14% | 0.135 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -65.7 | -37.6 | -179.6 | -66.5 | 0 | 0 | 0 | 0 | 111.7 | P240 Y241 T244 A268 L275 A276 | P240-C272 HydrophobicContact CB-CB 4.08Å; P240-C272 VanDerWaalsContact CB-SG 3.53Å; Y241-C272 HydrophobicContact CD2-CB 4.48Å; T244-C272 HydrophobicContact CG2-CB 4.42Å; A268-C272 VanDerWaalsContact O-CB 3.22Å; A268-C272 WeakPolarHBondContact O-CB 3.4Å; A268-C272 PolarHBondContact O-N 3.29Å; A268-C272 PolarHBondContact O-SG 2.9Å; C272-L275 PolarHBondContact O-N 3.44Å; C272-A276 WeakPolarHBondContact O-CB 3.5Å; C272-A276 PolarHBondContact O-N 2.88Å |
| 273 | R | 94.9 | Very high | 91.9 | Very high | 73 Ų | 73 | 43.7 Ų | 43.7 | 28% | 0.275 | 21% | 0.213 | S | C | . | . | H | α-helix | trans | -62 | -46.9 | 173.7 | -178.7 | 175.6 | 61.3 | -168.4 | -12.1 | 111.3 | Y91 Y241 L269 L270 I271 L275 A276 F277 | Y91-R273 PolarHBondContact OH-NE 2.8Å; Y91-R273 PolarHBondContact OH-NH2 2.73Å; Y241-R273 HydrophobicContact CD2-CB 3.85Å; Y241-R273 HydrophobicContact CE2-CB 3.69Å; Y241-R273 HydrophobicContact CE2-CG 4.06Å; L269-R273 WeakPolarHBondContact O-CB 3.47Å; L269-R273 PolarHBondContact O-N 2.88Å; L270-R273 VanDerWaalsContact CD1-NH2 3.33Å; L270-R273 PolarHBondContact O-N 3.42Å; I271-R273 VanDerWaalsContact C-N 3.34Å; I271-R273 PolarHBondContact O-N 3.02Å; R273-L275 VanDerWaalsContact C-N 3.28Å; R273-L275 PolarHBondContact O-N 3.31Å; R273-A276 PolarHBondContact O-N 2.87Å; R273-F277 HydrophobicContact CG-CD1 4.03Å; R273-F277 HydrophobicContact CG-CE1 3.81Å; R273-F277 HydrophobicContact CG-CE2 4.4Å; R273-F277 HydrophobicContact CG-CG 4.43Å; R273-F277 HydrophobicContact CG-CZ 4Å; R273-F277 WeakPolarHBondContact O-CB 3.24Å; R273-F277 WeakPolarHBondContact O-CD1 3.36Å; R273-F277 PolarHBondContact O-N 2.55Å |
| 274 | N | 94.6 | Very high | 91.8 | Very high | 22 Ų | 22 | 39.8 Ų | 39.8 | 12% | 0.118 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -59.3 | -40.9 | 178.2 | -79.7 | -10.9 | 0 | 0 | 0 | 111.8 | T34 L37 Y38 L270 I271 S278 | T34-N274 WeakPolarHBondContact CG2-OD1 3.21Å; T34-N274 PolarHBondContact OG1-ND2 2.64Å; T34-N274 VanDerWaalsContact OG1-ND2 3.12Å; L37-N274 HydrophobicContact CD2-CB 3.65Å; Y38-N274 VanDerWaalsContact CE1-OD1 3.31Å; Y38-N274 WeakPolarHBondContact CE1-OD1 3.32Å; Y38-N274 PolarHBondContact OH-OD1 3.36Å; L270-N274 WeakPolarHBondContact O-CB 3.44Å; L270-N274 PolarHBondContact O-N 3.09Å; I271-N274 PolarHBondContact O-N 3.44Å; N274-S278 PolarHBondContact O-N 3.05Å; N274-S278 PolarHBondContact O-OG 2.81Å |
| 275 | L | 96 | Very high | 91.5 | Very high | 74 Ų | 74 | 36.5 Ų | 36.5 | 39% | 0.387 | 18% | 0.183 | S | C | . | . | H | α-helix | trans | -65.9 | -46.4 | 174 | -179 | 63.7 | 0 | 0 | 0 | 112.1 | P240 I271 C272 R273 F277 S278 | P240-L275 HydrophobicContact CG-CD2 4.44Å; I271-L275 PolarHBondContact O-N 2.84Å; C272-L275 PolarHBondContact O-N 3.44Å; R273-L275 VanDerWaalsContact C-N 3.28Å; R273-L275 PolarHBondContact O-N 3.31Å; L275-F277 VanDerWaalsContact C-N 3.35Å; L275-F277 PolarHBondContact O-N 2.85Å; L275-S278 WeakPolarHBondContact O-CB 3.44Å; L275-S278 PolarHBondContact O-N 2.89Å |
| 276 | A | 96.2 | Very high | 91.1 | Very high | 0 Ų | 0 | 37.3 Ų | 37.3 | 0% | 0 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -59.8 | -43.2 | 178.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | S237 W238 Y241 C272 R273 S278 H279 | S237-A276 WeakPolarHBondContact O-CA 3.48Å; S237-A276 WeakPolarHBondContact O-CB 3.33Å; S237-A276 PolarHBondContact O-N 3.16Å; W238-A276 HydrophobicContact CD2-CB 3.96Å; W238-A276 HydrophobicContact CE3-CB 3.77Å; W238-A276 HydrophobicContact CH2-CB 4.31Å; W238-A276 HydrophobicContact CZ3-CB 3.96Å; Y241-A276 HydrophobicContact CD1-CB 4.28Å; Y241-A276 HydrophobicContact CG-CB 4.1Å; C272-A276 WeakPolarHBondContact O-CB 3.5Å; C272-A276 PolarHBondContact O-N 2.88Å; R273-A276 PolarHBondContact O-N 2.87Å; A276-S278 PolarHBondContact O-N 2.77Å; A276-H279 VanDerWaalsContact O-CB 3.32Å; A276-H279 WeakPolarHBondContact O-CB 3.46Å; A276-H279 PolarHBondContact O-N 3.01Å; A276-H279 VanDerWaalsContact O-N 3.16Å; A276-H279 PolarHBondContact O-ND1 2.9Å |
| 277 | F | 95.4 | Very high | 90.8 | Very high | 7 Ų | 7 | 33 Ų | 33 | 3% | 0.031 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -71.1 | -23.7 | -178.9 | -78.5 | 29.3 | 0 | 0 | 0 | 112 | Y38 F80 L84 W87 F109 W238 R273 L275 H279 C280 | Y38-F277 HydrophobicContact CE1-CB 3.97Å; Y38-F277 HydrophobicContact CE1-CD2 4.13Å; Y38-F277 HydrophobicContact CE1-CG 4.44Å; Y38-F277 AromaticContact CE2-CD2 3.72Å; Y38-F277 HydrophobicContact CE2-CD2 3.72Å; Y38-F277 HydrophobicContact CE2-CE2 4.19Å; Y38-F277 AromaticContact CZ-CD2 3.39Å; Y38-F277 WeakPolarHBondContact OH-CD2 3.39Å; F80-F277 HydrophobicContact CE1-CB 4.17Å; F80-F277 HydrophobicContact CE1-CG 4.23Å; F80-F277 WeakPolarHBondContact CE1-O 3.41Å; F80-F277 HydrophobicContact CZ-CB 4.19Å; F80-F277 AromaticContact CZ-CD1 3.8Å; F80-F277 HydrophobicContact CZ-CD1 3.8Å; F80-F277 HydrophobicContact CZ-CD2 4.28Å; F80-F277 HydrophobicContact CZ-CE1 4.25Å; F80-F277 AromaticContact CZ-CG 3.83Å; F80-F277 HydrophobicContact CZ-CG 3.83Å; L84-F277 HydrophobicContact CD2-CB 4.03Å; L84-F277 HydrophobicContact CD2-CD2 3.64Å; L84-F277 HydrophobicContact CD2-CG 4.22Å; W87-F277 HydrophobicContact CB-CE2 4.43Å; W87-F277 HydrophobicContact CG-CE2 4.13Å; F109-F277 HydrophobicContact CD2-CZ 4.44Å; F109-F277 HydrophobicContact CE2-CD1 4.41Å; F109-F277 AromaticContact CE2-CE1 3.53Å; F109-F277 HydrophobicContact CE2-CE1 3.53Å; F109-F277 HydrophobicContact CE2-CE2 4.3Å; F109-F277 AromaticContact CE2-CZ 3.47Å; F109-F277 HydrophobicContact CE2-CZ 3.47Å; F109-F277 VanDerWaalsContact CE2-CZ 3.47Å; F109-F277 AromaticContact CZ-CE1 3.76Å; F109-F277 HydrophobicContact CZ-CE1 3.76Å; F109-F277 AromaticContact CZ-CZ 3.96Å; F109-F277 HydrophobicContact CZ-CZ 3.96Å; W238-F277 HydrophobicContact CH2-CD1 4.3Å; W238-F277 HydrophobicContact CH2-CE1 4.34Å; R273-F277 HydrophobicContact CG-CD1 4.03Å; R273-F277 HydrophobicContact CG-CE1 3.81Å; R273-F277 HydrophobicContact CG-CE2 4.4Å; R273-F277 HydrophobicContact CG-CG 4.43Å; R273-F277 HydrophobicContact CG-CZ 4Å; R273-F277 WeakPolarHBondContact O-CB 3.24Å; R273-F277 WeakPolarHBondContact O-CD1 3.36Å; R273-F277 PolarHBondContact O-N 2.55Å; L275-F277 VanDerWaalsContact C-N 3.35Å; L275-F277 PolarHBondContact O-N 2.85Å; F277-H279 PolarHBondContact O-N 3.47Å; F277-C280 PolarHBondContact O-SG 3.44Å |
| 278 | S | 95.6 | Very high | 90.2 | Very high | 10 Ų | 10 | 30.2 Ų | 30.2 | 7% | 0.07 | 16% | 0.161 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -71.2 | -11.7 | 174 | -58.7 | 0 | 0 | 0 | 0 | 113.6 | N274 L275 A276 C280 C281 | N274-S278 PolarHBondContact O-N 3.05Å; N274-S278 PolarHBondContact O-OG 2.81Å; L275-S278 WeakPolarHBondContact O-CB 3.44Å; L275-S278 PolarHBondContact O-N 2.89Å; A276-S278 PolarHBondContact O-N 2.77Å; S278-C280 PolarHBondContact O-N 3.04Å; S278-C280 VanDerWaalsContact O-N 3.13Å; S278-C281 PolarHBondContact O-N 3.44Å; S278-C281 PolarHBondContact O-SG 3.15Å |
| 279 | H | 94.8 | Very high | 89.2 | Confident | 4 Ų | 4 | 35.4 Ų | 35.4 | 2% | 0.019 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -57.1 | -33.9 | -175.6 | 83.6 | -77 | 0 | 0 | 0 | 113.7 | D77 F80 W238 A276 F277 C281 F282 | D77-H279 IonicContact OD1-NE2 3.7Å; F80-H279 AromaticContact CD1-CE1 3.98Å; F80-H279 AromaticContact CE1-CE1 3.93Å; F80-H279 AromaticContact CZ-CE1 3.99Å; W238-H279 AromaticContact CE2-CE1 3.84Å; W238-H279 AromaticContact CE2-ND1 3.58Å; W238-H279 AromaticContact CZ2-CE1 3.5Å; W238-H279 AromaticContact CZ2-ND1 3.49Å; W238-H279 WeakPolarHBondContact CZ2-ND1 2.87Å; W238-H279 AromaticContact NE1-CD2 3.52Å; W238-H279 AromaticContact NE1-CE1 3.57Å; W238-H279 AromaticContact NE1-CG 3.17Å; W238-H279 AromaticContact NE1-ND1 3.2Å; W238-H279 PolarHBondContact NE1-ND1 3.05Å; W238-H279 VanDerWaalsContact NE1-ND1 3.2Å; W238-H279 AromaticContact NE1-NE2 3.73Å; A276-H279 VanDerWaalsContact O-CB 3.32Å; A276-H279 WeakPolarHBondContact O-CB 3.46Å; A276-H279 PolarHBondContact O-N 3.01Å; A276-H279 VanDerWaalsContact O-N 3.16Å; A276-H279 PolarHBondContact O-ND1 2.9Å; F277-H279 PolarHBondContact O-N 3.47Å; H279-C281 PolarHBondContact O-N 3.22Å; H279-F282 WeakPolarHBondContact O-CB 3.29Å; H279-F282 PolarHBondContact O-N 3.27Å |
| 280 | C | 93.8 | Very high | 88.2 | Confident | 0 Ų | 0 | 36.6 Ų | 36.6 | 0% | 0 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -65.9 | -21.4 | -173.4 | 64.7 | 0 | 0 | 0 | 0 | 112.7 | V41 S45 N49 D77 F80 F277 S278 | V41-C280 WeakPolarHBondContact CG1-SG 3.4Å; S45-C280 PolarHBondContact OG-O 3.16Å; N49-C280 PolarHBondContact ND2-O 3.25Å; D77-C280 HydrophobicContact CB-CB 3.98Å; F80-C280 HydrophobicContact CD1-CB 4Å; F277-C280 PolarHBondContact O-SG 3.44Å; S278-C280 PolarHBondContact O-N 3.04Å; S278-C280 VanDerWaalsContact O-N 3.13Å |
| 281 | C | 92.1 | Very high | 87.3 | Confident | 8 Ų | 8 | 35.3 Ų | 35.3 | 5% | 0.054 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -92.1 | -13.4 | 176 | 78 | 0 | 0 | 0 | 0 | 113.5 | V41 L44 S278 H279 V285 | V41-C281 HydrophobicContact CG1-CB 4.29Å; L44-C281 HydrophobicContact CB-CB 4.1Å; L44-C281 HydrophobicContact CD2-CB 3.89Å; L44-C281 HydrophobicContact CG-CB 4.02Å; S278-C281 PolarHBondContact O-N 3.44Å; S278-C281 PolarHBondContact O-SG 3.15Å; H279-C281 PolarHBondContact O-N 3.22Å; C281-V285 VanDerWaalsContact O-CG2 3.28Å; C281-V285 WeakPolarHBondContact O-CG2 3.5Å |
| 282 | F | 90.5 | Very high | 86.2 | Confident | 61 Ų | 61 | 32.9 Ų | 32.9 | 27% | 0.268 | 17% | 0.171 | S | C | . | . | H | α-helix | trans | -71.2 | -33.2 | -179.8 | -62.9 | -22.8 | 0 | 0 | 0 | 112.7 | A233 S237 H279 V285 L286 | A233-F282 HydrophobicContact CB-CB 4.35Å; A233-F282 HydrophobicContact CB-CD2 4.27Å; S237-F282 WeakPolarHBondContact OG-CD2 3.39Å; S237-F282 WeakPolarHBondContact OG-CE2 3.31Å; H279-F282 WeakPolarHBondContact O-CB 3.29Å; H279-F282 PolarHBondContact O-N 3.27Å; F282-V285 PolarHBondContact O-N 2.91Å; F282-L286 WeakPolarHBondContact O-CB 3.48Å; F282-L286 VanDerWaalsContact O-CG 3.24Å; F282-L286 WeakPolarHBondContact O-CG 3.32Å; F282-L286 PolarHBondContact O-N 3.05Å |
| 283 | N | 85.6 | Confident | 84.9 | Confident | 6 Ų | 6 | 38.3 Ų | 38.3 | 3% | 0.032 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -59.4 | -55.7 | -178.8 | -69.5 | -18.1 | 0 | 0 | 0 | 112.2 | L73 D77 I230 V285 L286 Y287 | L73-N283 WeakPolarHBondContact CD2-ND2 3.23Å; D77-N283 PolarHBondContact OD2-ND2 3.36Å; I230-N283 WeakPolarHBondContact CG2-OD1 3.49Å; N283-V285 VanDerWaalsContact C-N 3.35Å; N283-V285 PolarHBondContact O-N 3.44Å; N283-L286 PolarHBondContact O-N 3.19Å; N283-Y287 HydrophobicContact CB-CE2 4.09Å; N283-Y287 WeakPolarHBondContact O-CD2 3.47Å; N283-Y287 PolarHBondContact O-N 3.35Å |
| 284 | P | 81.7 | Confident | 83.7 | Confident | 6 Ų | 6 | 36 Ų | 36 | 4% | 0.039 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -55.4 | -43.7 | 173.1 | -27.2 | 34.7 | 0 | 0 | 0 | 114.5 | G48 N49 L286 Y287 V288 | G48-P284 VanDerWaalsContact C-CG 3.41Å; G48-P284 VanDerWaalsContact CA-CB 3.49Å; N49-P284 HydrophobicContact CB-CG 4.34Å; N49-P284 VanDerWaalsContact CG-CG 3.5Å; N49-P284 WeakPolarHBondContact OD1-CG 3.44Å; P284-L286 VanDerWaalsContact C-N 3.34Å; P284-L286 PolarHBondContact O-N 3.43Å; P284-Y287 PolarHBondContact O-N 3.01Å; P284-Y287 VanDerWaalsContact O-N 3.17Å; P284-V288 WeakPolarHBondContact O-CG2 3.36Å; P284-V288 PolarHBondContact O-N 3.3Å |
| 285 | V | 82.1 | Confident | 82.9 | Confident | 47 Ų | 47 | 39.7 Ų | 39.7 | 29% | 0.285 | 20% | 0.196 | S | C | . | . | H | α-helix | trans | -57.5 | -49.5 | 177.5 | 166.6 | 0 | 0 | 0 | 0 | 109.7 | L44 C281 F282 N283 Y287 V288 F289 | L44-V285 HydrophobicContact CD2-CG2 4.08Å; C281-V285 VanDerWaalsContact O-CG2 3.28Å; C281-V285 WeakPolarHBondContact O-CG2 3.5Å; F282-V285 PolarHBondContact O-N 2.91Å; N283-V285 VanDerWaalsContact C-N 3.35Å; N283-V285 PolarHBondContact O-N 3.44Å; V285-Y287 VanDerWaalsContact C-N 3.33Å; V285-Y287 PolarHBondContact O-N 2.69Å; V285-V288 PolarHBondContact O-N 3.2Å; V285-V288 VanDerWaalsContact O-N 3.15Å; V285-F289 HydrophobicContact CG1-CD2 3.6Å; V285-F289 HydrophobicContact CG1-CE2 3.77Å; V285-F289 WeakPolarHBondContact O-CD2 3.43Å; V285-F289 PolarHBondContact O-N 3.38Å |
| 286 | L | 81.8 | Confident | 81.9 | Confident | 31 Ų | 31 | 39.4 Ų | 39.4 | 16% | 0.162 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -64.4 | -35.3 | 177.5 | -69.2 | 172.3 | 0 | 0 | 0 | 112.5 | L226 A229 I230 A233 F282 N283 P284 V290 G291 | L226-L286 HydrophobicContact CD1-CB 4.44Å; A229-L286 HydrophobicContact CB-CD1 4.43Å; A229-L286 HydrophobicContact CB-CD2 4.12Å; I230-L286 HydrophobicContact CB-CD1 4.38Å; I230-L286 HydrophobicContact CG1-CB 4.26Å; I230-L286 HydrophobicContact CG1-CD1 3.88Å; A233-L286 HydrophobicContact CB-CD1 3.86Å; F282-L286 WeakPolarHBondContact O-CB 3.48Å; F282-L286 VanDerWaalsContact O-CG 3.24Å; F282-L286 WeakPolarHBondContact O-CG 3.32Å; F282-L286 PolarHBondContact O-N 3.05Å; N283-L286 PolarHBondContact O-N 3.19Å; P284-L286 VanDerWaalsContact C-N 3.34Å; P284-L286 PolarHBondContact O-N 3.43Å; L286-V290 HydrophobicContact CD2-CG2 4.12Å; L286-V290 WeakPolarHBondContact O-CA 3.4Å; L286-V290 VanDerWaalsContact O-CB 3.23Å; L286-V290 WeakPolarHBondContact O-CB 3.22Å; L286-V290 PolarHBondContact O-N 3.32Å; L286-G291 PolarHBondContact O-N 3.04Å |
| 287 | Y | 79.9 | Confident | 81.1 | Confident | 11 Ų | 11 | 41.3 Ų | 41.3 | 4% | 0.043 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -63.8 | -39.2 | 172.5 | -65.8 | -49.8 | 0 | 0 | 0 | 112.5 | V52 I70 L226 I230 N283 P284 V285 G291 | V52-Y287 HydrophobicContact CG1-CD2 4.21Å; V52-Y287 HydrophobicContact CG1-CE2 4.28Å; V52-Y287 HydrophobicContact CG2-CD2 3.77Å; V52-Y287 HydrophobicContact CG2-CG 4.49Å; I70-Y287 HydrophobicContact CD1-CE1 4.43Å; I70-Y287 HydrophobicContact CG2-CE1 4.42Å; I70-Y287 HydrophobicContact CG2-CE2 4.07Å; I70-Y287 WeakPolarHBondContact CG2-OH 3.35Å; L226-Y287 HydrophobicContact CD1-CD1 3.94Å; L226-Y287 HydrophobicContact CD1-CE1 4.3Å; L226-Y287 HydrophobicContact CD2-CD1 3.81Å; L226-Y287 HydrophobicContact CD2-CE1 3.95Å; L226-Y287 HydrophobicContact CG-CD1 4.28Å; L226-Y287 HydrophobicContact CG-CE1 4.3Å; I230-Y287 HydrophobicContact CD1-CD1 4.39Å; I230-Y287 HydrophobicContact CD1-CE1 3.53Å; N283-Y287 HydrophobicContact CB-CE2 4.09Å; N283-Y287 WeakPolarHBondContact O-CD2 3.47Å; N283-Y287 PolarHBondContact O-N 3.35Å; P284-Y287 PolarHBondContact O-N 3.01Å; P284-Y287 VanDerWaalsContact O-N 3.17Å; V285-Y287 VanDerWaalsContact C-N 3.33Å; V285-Y287 PolarHBondContact O-N 2.69Å; Y287-G291 CarbonylContact O-C 3.6Å; Y287-G291 WeakPolarHBondContact O-CA 3.32Å; Y287-G291 PolarHBondContact O-N 3.49Å |
| 288 | V | 75.1 | Confident | 80.3 | Confident | 49 Ų | 49 | 42.6 Ų | 42.6 | 30% | 0.297 | 21% | 0.214 | S | C | . | . | H | α-helix | trans | -69.1 | -49.6 | 176 | 174.1 | 0 | 0 | 0 | 0 | 111.5 | P284 V285 F294 R295 | P284-V288 WeakPolarHBondContact O-CG2 3.36Å; P284-V288 PolarHBondContact O-N 3.3Å; V285-V288 PolarHBondContact O-N 3.2Å; V285-V288 VanDerWaalsContact O-N 3.15Å; V288-F294 HydrophobicContact CG2-CD1 4.04Å; V288-F294 HydrophobicContact CG2-CE1 3.59Å; V288-R295 WeakPolarHBondContact O-CD 3.14Å; V288-R295 WeakPolarHBondContact O-CG 3.44Å; V288-R295 PolarHBondContact O-NE 3.38Å |
| 289 | F | 71.6 | Confident | 79.6 | Confident | 143 Ų | 143 | 48.4 Ų | 48.4 | 63% | 0.627 | 24% | 0.238 | S | C | * | . | H | α-helix | trans | -80.8 | -40.2 | -172.3 | -70.4 | -71.9 | 0 | 0 | 0 | 112.9 | V285 R295 | V285-F289 HydrophobicContact CG1-CD2 3.6Å; V285-F289 HydrophobicContact CG1-CE2 3.77Å; V285-F289 WeakPolarHBondContact O-CD2 3.43Å; V285-F289 PolarHBondContact O-N 3.38Å; F289-R295 PolarHBondContact O-NH2 3.06Å |
| 290 | V | 72 | Confident | 78.8 | Confident | 45 Ų | 45 | 53 Ų | 53 | 27% | 0.273 | 26% | 0.259 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -99.8 | -33.8 | -174.8 | -170.5 | 0 | 0 | 0 | 0 | 111.5 | K225 L226 L286 V292 | K225-V290 HydrophobicContact CG-CG1 4.47Å; L226-V290 HydrophobicContact CB-CG1 4.24Å; L226-V290 HydrophobicContact CD1-CB 3.92Å; L226-V290 HydrophobicContact CD1-CG1 4.2Å; L286-V290 HydrophobicContact CD2-CG2 4.12Å; L286-V290 WeakPolarHBondContact O-CA 3.4Å; L286-V290 VanDerWaalsContact O-CB 3.23Å; L286-V290 WeakPolarHBondContact O-CB 3.22Å; L286-V290 PolarHBondContact O-N 3.32Å; V290-V292 PolarHBondContact O-N 3.3Å |
| 291 | G | 71.1 | Confident | 78 | Confident | 7 Ų | 7 | 53.2 Ų | 53.2 | 7% | 0.072 | 26% | 0.261 | C | S | . | . | trans | -73.8 | 108 | -178.1 | 0 | 0 | 0 | 0 | 0 | 113.8 | L286 Y287 R295 | L286-G291 PolarHBondContact O-N 3.04Å; Y287-G291 CarbonylContact O-C 3.6Å; Y287-G291 WeakPolarHBondContact O-CA 3.32Å; Y287-G291 PolarHBondContact O-N 3.49Å; G291-R295 WeakPolarHBondContact O-CG 3.43Å; G291-R295 PolarHBondContact O-N 3.19Å; G291-R295 PolarHBondContact O-NE 2.76Å | ||
| 292 | V | 69 | Low | 77.6 | Confident | 66 Ų | 66 | 57.7 Ų | 57.7 | 40% | 0.4 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -71.3 | -41.8 | 177.5 | -178.8 | 0 | 0 | 0 | 0 | 111.8 | V290 R295 T296 | V290-V292 PolarHBondContact O-N 3.3Å; V292-R295 PolarHBondContact O-N 3.34Å; V292-T296 PolarHBondContact O-N 3.48Å; V292-T296 VanDerWaalsContact O-N 3.13Å; V292-T296 PolarHBondContact O-OG1 3.25Å |
| 293 | K | 69.1 | Low | 77 | Confident | 135 Ų | 135 | 62.3 Ų | 62.3 | 59% | 0.587 | 30% | 0.299 | S | S | * | . | H | α-helix | trans | -61 | -48.9 | 178.7 | -71.5 | -171 | 170.9 | -164.3 | 0 | 111.9 | R295 T296 H297 | K293-R295 VanDerWaalsContact C-N 3.33Å; K293-R295 PolarHBondContact O-N 3.18Å; K293-T296 WeakPolarHBondContact O-CB 3.39Å; K293-T296 PolarHBondContact O-N 2.93Å; K293-T296 VanDerWaalsContact O-N 3.07Å; K293-H297 PolarHBondContact O-CD2 2.95Å; K293-H297 PolarHBondContact O-N 3.46Å; K293-H297 VanDerWaalsContact O-N 3.08Å |
| 294 | F | 70.8 | Confident | 76.4 | Confident | 23 Ų | 23 | 67.2 Ų | 67.2 | 10% | 0.101 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -58.5 | -45.4 | 179.7 | -173.8 | -101.6 | 0 | 0 | 0 | 111.6 | L51 V52 V55 V288 T296 H297 L298 | L51-F294 HydrophobicContact CD2-CZ 3.97Å; L51-F294 HydrophobicContact CG-CZ 3.98Å; V52-F294 HydrophobicContact CB-CE2 4.35Å; V52-F294 HydrophobicContact CG2-CD2 4.48Å; V52-F294 HydrophobicContact CG2-CE2 3.76Å; V52-F294 HydrophobicContact CG2-CZ 3.87Å; V55-F294 HydrophobicContact CB-CD2 4.43Å; V55-F294 HydrophobicContact CB-CE2 4.02Å; V55-F294 HydrophobicContact CG1-CD2 4.15Å; V55-F294 HydrophobicContact CG1-CE2 4.23Å; V55-F294 HydrophobicContact CG2-CE2 3.91Å; V288-F294 HydrophobicContact CG2-CD1 4.04Å; V288-F294 HydrophobicContact CG2-CE1 3.59Å; F294-T296 VanDerWaalsContact C-N 3.31Å; F294-T296 PolarHBondContact O-N 3.33Å; F294-H297 PolarHBondContact O-N 3.16Å; F294-L298 HydrophobicContact CE1-CD2 4.38Å; F294-L298 WeakPolarHBondContact O-CB 3.28Å; F294-L298 PolarHBondContact O-N 2.89Å |
| 295 | R | 76.7 | Confident | 76 | Confident | 100 Ų | 100 | 73.1 Ų | 73.1 | 38% | 0.377 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -58.4 | -39.6 | 173.9 | -77.7 | -175.2 | -77 | -173.7 | -5.5 | 113.6 | V288 F289 G291 V292 K293 K299 | V288-R295 WeakPolarHBondContact O-CD 3.14Å; V288-R295 WeakPolarHBondContact O-CG 3.44Å; V288-R295 PolarHBondContact O-NE 3.38Å; F289-R295 PolarHBondContact O-NH2 3.06Å; G291-R295 WeakPolarHBondContact O-CG 3.43Å; G291-R295 PolarHBondContact O-N 3.19Å; G291-R295 PolarHBondContact O-NE 2.76Å; V292-R295 PolarHBondContact O-N 3.34Å; K293-R295 VanDerWaalsContact C-N 3.33Å; K293-R295 PolarHBondContact O-N 3.18Å; R295-K299 VanDerWaalsContact O-CG 3.32Å; R295-K299 WeakPolarHBondContact O-CG 3.42Å; R295-K299 PolarHBondContact O-N 3.05Å |
| 296 | T | 75.7 | Confident | 75.3 | Confident | 68 Ų | 68 | 79.6 Ų | 79.6 | 42% | 0.417 | 37% | 0.366 | S | S | . | . | H | α-helix | trans | -63 | -49.2 | 177 | -57.7 | 0 | 0 | 0 | 0 | 110.6 | V292 K293 F294 L298 K299 H300 | V292-T296 PolarHBondContact O-N 3.48Å; V292-T296 VanDerWaalsContact O-N 3.13Å; V292-T296 PolarHBondContact O-OG1 3.25Å; K293-T296 WeakPolarHBondContact O-CB 3.39Å; K293-T296 PolarHBondContact O-N 2.93Å; K293-T296 VanDerWaalsContact O-N 3.07Å; F294-T296 VanDerWaalsContact C-N 3.31Å; F294-T296 PolarHBondContact O-N 3.33Å; T296-L298 PolarHBondContact O-N 3.21Å; T296-K299 PolarHBondContact O-N 3.25Å; T296-H300 PolarHBondContact O-CD2 2.95Å; T296-H300 VanDerWaalsContact O-CD2 3.26Å; T296-H300 PolarHBondContact O-N 2.91Å; T296-H300 VanDerWaalsContact O-N 3.12Å |
| 297 | H | 79.5 | Confident | 74.3 | Confident | 40 Ų | 40 | 84.3 Ų | 84.3 | 19% | 0.185 | 39% | 0.386 | C | S | . | . | H | α-helix | trans | -62 | -44.2 | 177.2 | -67.7 | -63.8 | 0 | 0 | 0 | 112 | V55 Y59 E60 K293 F294 K299 H300 V301 | V55-H297 HydrophobicContact CG1-CB 3.76Å; Y59-H297 AromaticContact CG-ND1 3.86Å; E60-H297 IonicContact OE1-CD2 3.92Å; E60-H297 IonicContact OE1-NE2 3.46Å; E60-H297 PolarHBondContact OE1-NE2 3.5Å; K293-H297 PolarHBondContact O-CD2 2.95Å; K293-H297 PolarHBondContact O-N 3.46Å; K293-H297 VanDerWaalsContact O-N 3.08Å; F294-H297 PolarHBondContact O-N 3.16Å; H297-K299 VanDerWaalsContact C-N 3.29Å; H297-K299 PolarHBondContact O-N 3.25Å; H297-H300 WeakPolarHBondContact O-CB 3.33Å; H297-H300 PolarHBondContact O-N 2.9Å; H297-V301 WeakPolarHBondContact O-CG2 3.39Å; H297-V301 PolarHBondContact O-N 3.36Å |
| 298 | L | 77.8 | Confident | 73.3 | Confident | 34 Ų | 34 | 88 Ų | 88 | 18% | 0.178 | 41% | 0.412 | C | S | . | . | H | α-helix | trans | -58.2 | -40.6 | 176.5 | -174.2 | 59.6 | 0 | 0 | 0 | 112.1 | L51 F294 T296 V301 L302 | L51-L298 HydrophobicContact CD1-CD1 4.44Å; L51-L298 HydrophobicContact CD2-CD1 3.94Å; F294-L298 HydrophobicContact CE1-CD2 4.38Å; F294-L298 WeakPolarHBondContact O-CB 3.28Å; F294-L298 PolarHBondContact O-N 2.89Å; T296-L298 PolarHBondContact O-N 3.21Å; L298-V301 PolarHBondContact O-N 3.27Å; L298-L302 HydrophobicContact CD1-CD1 4.35Å; L298-L302 HydrophobicContact CD1-CG 4.3Å; L298-L302 HydrophobicContact CG-CD1 3.98Å; L298-L302 HydrophobicContact CG-CG 4.39Å; L298-L302 WeakPolarHBondContact O-CB 3.44Å; L298-L302 VanDerWaalsContact O-CG 3.23Å; L298-L302 WeakPolarHBondContact O-CG 3.38Å; L298-L302 PolarHBondContact O-N 3.37Å |
| 299 | K | 80.4 | Confident | 72.3 | Confident | 133 Ų | 133 | 95.9 Ų | 95.9 | 58% | 0.578 | 44% | 0.437 | S | S | * | . | H | α-helix | trans | -63.8 | -40.2 | 174.6 | -75.5 | 177.7 | -179.3 | -173.2 | 0 | 112.6 | R295 T296 H297 R303 | R295-K299 VanDerWaalsContact O-CG 3.32Å; R295-K299 WeakPolarHBondContact O-CG 3.42Å; R295-K299 PolarHBondContact O-N 3.05Å; T296-K299 PolarHBondContact O-N 3.25Å; H297-K299 VanDerWaalsContact C-N 3.29Å; H297-K299 PolarHBondContact O-N 3.25Å; K299-R303 WeakPolarHBondContact O-CB 3.45Å; K299-R303 VanDerWaalsContact O-CG 3.23Å; K299-R303 WeakPolarHBondContact O-CG 3.01Å; K299-R303 PolarHBondContact O-N 3.32Å |
| 300 | H | 78.3 | Confident | 71.6 | Confident | 99 Ų | 99 | 94.7 Ų | 94.7 | 46% | 0.458 | 44% | 0.436 | S | S | . | . | H | α-helix | trans | -63.8 | -43.6 | 175.7 | -84 | -81.1 | 0 | 0 | 0 | 111.7 | T296 H297 R303 Q304 | T296-H300 PolarHBondContact O-CD2 2.95Å; T296-H300 VanDerWaalsContact O-CD2 3.26Å; T296-H300 PolarHBondContact O-N 2.91Å; T296-H300 VanDerWaalsContact O-N 3.12Å; H297-H300 WeakPolarHBondContact O-CB 3.33Å; H297-H300 PolarHBondContact O-N 2.9Å; H300-R303 PolarHBondContact O-N 3.04Å; H300-Q304 WeakPolarHBondContact O-CG 3.38Å; H300-Q304 PolarHBondContact O-N 3.28Å |
| 301 | V | 78.5 | Confident | 70.7 | Confident | 6 Ų | 6 | 100.1 Ų | 100.1 | 4% | 0.036 | 46% | 0.459 | C | S | . | . | H | α-helix | trans | -61.7 | -52.2 | 177.5 | 173.2 | 0 | 0 | 0 | 0 | 110.4 | W54 Y59 H297 L298 R303 Q304 F305 | W54-V301 HydrophobicContact CH2-CB 4.31Å; W54-V301 HydrophobicContact CH2-CG1 3.67Å; W54-V301 HydrophobicContact CH2-CG2 3.66Å; W54-V301 HydrophobicContact CZ3-CB 4.15Å; W54-V301 HydrophobicContact CZ3-CG1 3.59Å; W54-V301 HydrophobicContact CZ3-CG2 3.42Å; W54-V301 VanDerWaalsContact CZ3-CG2 3.42Å; Y59-V301 HydrophobicContact CD2-CG2 4.41Å; Y59-V301 HydrophobicContact CE2-CG2 3.42Å; Y59-V301 VanDerWaalsContact CE2-CG2 3.42Å; Y59-V301 WeakPolarHBondContact OH-CG2 3.49Å; H297-V301 WeakPolarHBondContact O-CG2 3.39Å; H297-V301 PolarHBondContact O-N 3.36Å; L298-V301 PolarHBondContact O-N 3.27Å; V301-R303 VanDerWaalsContact C-N 3.28Å; V301-R303 PolarHBondContact O-N 3.31Å; V301-Q304 PolarHBondContact O-N 3.45Å; V301-Q304 VanDerWaalsContact O-N 3.11Å; V301-F305 HydrophobicContact CG1-CD2 3.58Å; V301-F305 HydrophobicContact CG1-CE2 3.52Å; V301-F305 VanDerWaalsContact O-CD2 3.26Å; V301-F305 WeakPolarHBondContact O-CD2 3.48Å; V301-F305 PolarHBondContact O-N 3.31Å |
| 302 | L | 81.9 | Confident | 69.4 | Low | 102 Ų | 102 | 103.3 Ų | 103.3 | 53% | 0.534 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -58.9 | -40 | 178.6 | -72.1 | 171.1 | 0 | 0 | 0 | 111.7 | L298 F305 W306 | L298-L302 HydrophobicContact CD1-CD1 4.35Å; L298-L302 HydrophobicContact CD1-CG 4.3Å; L298-L302 HydrophobicContact CG-CD1 3.98Å; L298-L302 HydrophobicContact CG-CG 4.39Å; L298-L302 WeakPolarHBondContact O-CB 3.44Å; L298-L302 VanDerWaalsContact O-CG 3.23Å; L298-L302 WeakPolarHBondContact O-CG 3.38Å; L298-L302 PolarHBondContact O-N 3.37Å; L302-F305 PolarHBondContact O-N 3.36Å; L302-W306 WeakPolarHBondContact O-CB 3.39Å; L302-W306 PolarHBondContact O-N 2.82Å |
| 303 | R | 78.3 | Confident | 68.4 | Low | 157 Ų | 157 | 106 Ų | 106 | 59% | 0.592 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -62.9 | -47.2 | 173.8 | -76 | 174.2 | -179.7 | -170.4 | -1.8 | 111.8 | K299 H300 V301 F305 W306 F307 | K299-R303 WeakPolarHBondContact O-CB 3.45Å; K299-R303 VanDerWaalsContact O-CG 3.23Å; K299-R303 WeakPolarHBondContact O-CG 3.01Å; K299-R303 PolarHBondContact O-N 3.32Å; H300-R303 PolarHBondContact O-N 3.04Å; V301-R303 VanDerWaalsContact C-N 3.28Å; V301-R303 PolarHBondContact O-N 3.31Å; R303-F305 VanDerWaalsContact C-N 3.34Å; R303-F305 PolarHBondContact O-N 3.05Å; R303-W306 PolarHBondContact O-N 3.36Å; R303-W306 VanDerWaalsContact O-N 3.16Å; R303-F307 HydrophobicContact CB-CD2 4.34Å; R303-F307 HydrophobicContact CB-CE2 4.29Å; R303-F307 WeakPolarHBondContact O-CD2 3.5Å; R303-F307 PolarHBondContact O-N 3.42Å |
| 304 | Q | 74.3 | Confident | 67.8 | Low | 109 Ų | 109 | 104.9 Ų | 104.9 | 51% | 0.509 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -60.1 | -42.7 | 177.1 | -75.9 | -179.7 | -28.5 | 0 | 0 | 111.9 | Y59 H300 V301 W306 F307 C308 | Y59-Q304 PolarHBondContact OH-OE1 3.43Å; H300-Q304 WeakPolarHBondContact O-CG 3.38Å; H300-Q304 PolarHBondContact O-N 3.28Å; V301-Q304 PolarHBondContact O-N 3.45Å; V301-Q304 VanDerWaalsContact O-N 3.11Å; Q304-W306 VanDerWaalsContact C-N 3.34Å; Q304-W306 PolarHBondContact O-N 3.24Å; Q304-F307 PolarHBondContact O-N 2.93Å; Q304-C308 WeakPolarHBondContact O-CB 3.29Å; Q304-C308 PolarHBondContact O-N 2.75Å; Q304-C308 PolarHBondContact O-SG 3.02Å |
| 305 | F | 72.9 | Confident | 66.6 | Low | 130 Ų | 130 | 109.8 Ų | 109.8 | 57% | 0.57 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -63.9 | -36.8 | 174.2 | -84.4 | -74 | 0 | 0 | 0 | 113 | V301 L302 R303 R309 | V301-F305 HydrophobicContact CG1-CD2 3.58Å; V301-F305 HydrophobicContact CG1-CE2 3.52Å; V301-F305 VanDerWaalsContact O-CD2 3.26Å; V301-F305 WeakPolarHBondContact O-CD2 3.48Å; V301-F305 PolarHBondContact O-N 3.31Å; L302-F305 PolarHBondContact O-N 3.36Å; R303-F305 VanDerWaalsContact C-N 3.34Å; R303-F305 PolarHBondContact O-N 3.05Å; F305-R309 PolarHBondContact O-N 3.27Å; F305-R309 VanDerWaalsContact O-N 3.08Å |
| 306 | W | 67.9 | Low | 65.4 | Low | 183 Ų | 183 | 109.1 Ų | 109.1 | 69% | 0.693 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -68.4 | -44 | 176.4 | -132.8 | 71.3 | 0 | 0 | 0 | 111.9 | L302 R303 Q304 R309 L310 | L302-W306 WeakPolarHBondContact O-CB 3.39Å; L302-W306 PolarHBondContact O-N 2.82Å; R303-W306 PolarHBondContact O-N 3.36Å; R303-W306 VanDerWaalsContact O-N 3.16Å; Q304-W306 VanDerWaalsContact C-N 3.34Å; Q304-W306 PolarHBondContact O-N 3.24Å; W306-R309 PolarHBondContact O-N 3.42Å; W306-L310 HydrophobicContact CE3-CD1 3.72Å; W306-L310 HydrophobicContact CZ3-CD1 3.94Å; W306-L310 PolarHBondContact O-N 2.77Å |
| 307 | F | 60.8 | Low | 64.1 | Low | 130 Ų | 130 | 111.9 Ų | 111.9 | 57% | 0.57 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -67.5 | -38.2 | 175.6 | -74.1 | -65.6 | 0 | 0 | 0 | 112.5 | R303 Q304 R309 L310 Q311 | R303-F307 HydrophobicContact CB-CD2 4.34Å; R303-F307 HydrophobicContact CB-CE2 4.29Å; R303-F307 WeakPolarHBondContact O-CD2 3.5Å; R303-F307 PolarHBondContact O-N 3.42Å; Q304-F307 PolarHBondContact O-N 2.93Å; F307-R309 VanDerWaalsContact C-N 3.31Å; F307-R309 PolarHBondContact O-N 3.31Å; F307-L310 HydrophobicContact CD1-CD1 4.48Å; F307-L310 PolarHBondContact O-N 3.16Å; F307-L310 VanDerWaalsContact O-N 3.14Å; F307-Q311 PolarHBondContact O-N 3Å |
| 308 | C | 57 | Low | 62.8 | Low | 89 Ų | 89 | 116.7 Ų | 116.7 | 60% | 0.601 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -64.6 | -32 | 172.6 | -73.5 | 0 | 0 | 0 | 0 | 112.8 | Q304 L310 Q311 | Q304-C308 WeakPolarHBondContact O-CB 3.29Å; Q304-C308 PolarHBondContact O-N 2.75Å; Q304-C308 PolarHBondContact O-SG 3.02Å; C308-L310 VanDerWaalsContact C-N 3.34Å; C308-Q311 PolarHBondContact O-N 3.29Å |
| 309 | R | 55.2 | Low | 61.2 | Low | 214 Ų | 214 | 121 Ų | 121 | 81% | 0.808 | 64% | 0.637 | S | S | * | * | H | α-helix | trans | -70.9 | -28.4 | 172.6 | -82.2 | -170.3 | -173 | -131.6 | 3 | 113.1 | F305 W306 F307 Q311 | F305-R309 PolarHBondContact O-N 3.27Å; F305-R309 VanDerWaalsContact O-N 3.08Å; W306-R309 PolarHBondContact O-N 3.42Å; F307-R309 VanDerWaalsContact C-N 3.31Å; F307-R309 PolarHBondContact O-N 3.31Å; R309-Q311 VanDerWaalsContact C-N 3.32Å |
| 310 | L | 55.7 | Low | 59.4 | Low | 118 Ų | 118 | 123.3 Ų | 123.3 | 62% | 0.618 | 65% | 0.65 | S | S | * | * | H | α-helix | trans | -78.9 | -14.4 | 175.4 | -76.4 | 157.2 | 0 | 0 | 0 | 113.1 | W306 F307 C308 | W306-L310 HydrophobicContact CE3-CD1 3.72Å; W306-L310 HydrophobicContact CZ3-CD1 3.94Å; W306-L310 PolarHBondContact O-N 2.77Å; F307-L310 HydrophobicContact CD1-CD1 4.48Å; F307-L310 PolarHBondContact O-N 3.16Å; F307-L310 VanDerWaalsContact O-N 3.14Å; C308-L310 VanDerWaalsContact C-N 3.34Å |
| 311 | Q | 54.3 | Low | 57.7 | Low | 160 Ų | 160 | 124 Ų | 124 | 75% | 0.748 | 67% | 0.665 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -102.2 | 22.9 | 179.6 | -93.2 | 169.9 | -31.6 | 0 | 0 | 114.2 | F307 C308 R309 | F307-Q311 PolarHBondContact O-N 3Å; C308-Q311 PolarHBondContact O-N 3.29Å; R309-Q311 VanDerWaalsContact C-N 3.32Å |
| 312 | A | 43.1 | Very low | 55.9 | Low | 73 Ų | 73 | 130 Ų | 130 | 60% | 0.603 | 70% | 0.704 | S | S | * | * | S | Bend | trans | -64.9 | 146.1 | 165.1 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||
| 313 | P | 49.4 | Very low | 53.8 | Low | 124 Ų | 124 | 128.4 Ų | 128.4 | 81% | 0.805 | 71% | 0.713 | S | S | * | * | P | Polyproline II helix | trans | -69.4 | 134.8 | -152.3 | 4.3 | 4 | 0 | 0 | 0 | 113.1 | ||
| 314 | S | 55 | Low | 51.8 | Low | 110 Ų | 110 | 126 Ų | 126 | 77% | 0.769 | 73% | 0.727 | S | S | * | * | P | Polyproline II helix | trans | -55.2 | 145 | 158.9 | -77.7 | 0 | 0 | 0 | 0 | 109.7 | ||
| 315 | P | 46.4 | Very low | 50.2 | Low | 126 Ų | 126 | 130.1 Ų | 130.1 | 82% | 0.818 | 74% | 0.743 | S | S | * | * | P | Polyproline II helix | trans | -57.9 | 143.1 | 178.2 | 16 | -18.6 | 0 | 0 | 0 | 110.2 | ||
| 316 | A | 50.7 | Low | 48.3 | Very low | 86 Ų | 86 | 128.8 Ų | 128.8 | 71% | 0.711 | 76% | 0.756 | S | S | * | * | trans | -45.6 | 145.6 | -172.2 | 0 | 0 | 0 | 0 | 0 | 113.4 | I318 | A316-I318 PolarHBondContact O-N 3.18Š| ||
| 317 | P | 49.5 | Very low | 46.8 | Very low | 127 Ų | 127 | 130.2 Ų | 130.2 | 83% | 0.825 | 76% | 0.763 | S | S | * | * | P | Polyproline II helix | trans | -65.8 | 129.1 | 176 | 7.6 | 2.2 | 0 | 0 | 0 | 109.7 | ||
| 318 | I | 52.4 | Low | 45.5 | Very low | 140 Ų | 140 | 133.5 Ų | 133.5 | 72% | 0.718 | 78% | 0.78 | S | S | * | * | P | Polyproline II helix | trans | -57.4 | 133.7 | 169 | -59.9 | 166.4 | 0 | 0 | 0 | 107.6 | A316 H320 | A316-I318 PolarHBondContact O-N 3.18Å; I318-H320 PolarHBondContact O-N 3.37Å; I318-H320 VanDerWaalsContact O-N 3.15Å |
| 319 | P | 43.2 | Very low | 44.3 | Very low | 124 Ų | 124 | 132.6 Ų | 132.6 | 81% | 0.805 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -68.7 | 116.1 | 177.6 | 4.4 | 5.9 | 0 | 0 | 0 | 109.6 | ||
| 320 | H | 43.8 | Very low | 43.2 | Very low | 183 Ų | 183 | 127.1 Ų | 127.1 | 85% | 0.847 | 79% | 0.787 | S | S | * | * | P | Polyproline II helix | trans | -72.8 | 135.7 | 169.7 | -81.5 | -82.6 | 0 | 0 | 0 | 110.7 | I318 | I318-H320 PolarHBondContact O-N 3.37Å; I318-H320 VanDerWaalsContact O-N 3.15Å |
| 321 | S | 41.7 | Very low | 42.1 | Very low | 112 Ų | 112 | 126.4 Ų | 126.4 | 78% | 0.783 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -63.2 | 144.5 | 171.1 | -151.7 | 0 | 0 | 0 | 0 | 111 | G323 | S321-G323 PolarHBondContact O-N 3Š|
| 322 | P | 40.5 | Very low | 41.1 | Very low | 132 Ų | 132 | 127.5 Ų | 127.5 | 86% | 0.857 | 79% | 0.794 | S | S | * | * | trans | -80.6 | 113.6 | -175.8 | 31.2 | -30.4 | 0 | 0 | 0 | 110.4 | ||||
| 323 | G | 38 | Very low | 41 | Very low | 70 Ų | 70 | 138.6 Ų | 138.6 | 72% | 0.722 | 82% | 0.822 | S | S | * | * | trans | -167.3 | 119.3 | 173.9 | 0 | 0 | 0 | 0 | 0 | 113.3 | S321 | S321-G323 PolarHBondContact O-N 3Š| ||
| 324 | A | 35.3 | Very low | 40.5 | Very low | 106 Ų | 106 | 139.3 Ų | 139.3 | 88% | 0.876 | 82% | 0.823 | S | S | * | * | trans | 83.3 | 106.7 | 164 | 0 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 325 | F | 40.5 | Very low | 39.8 | Very low | 195 Ų | 195 | 140.8 Ų | 140.8 | 86% | 0.855 | 83% | 0.826 | S | S | * | * | trans | -46.8 | 138.2 | 157.6 | -83.4 | -106.2 | 0 | 0 | 0 | 113 | ||||
| 326 | A | 34.6 | Very low | 39.4 | Very low | 102 Ų | 102 | 141.7 Ų | 141.7 | 84% | 0.843 | 83% | 0.826 | S | S | * | * | trans | -145.5 | 117.5 | 147.3 | 0 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 327 | Y | 35.3 | Very low | 38.7 | Very low | 214 Ų | 214 | 144.9 Ų | 144.9 | 84% | 0.839 | 83% | 0.833 | S | S | * | * | trans | -81 | 133.5 | 168.3 | -108.4 | -98.1 | 0 | 0 | 0 | 109.1 | ||||
| 328 | E | 33.6 | Very low | 38.1 | Very low | 198 Ų | 198 | 146.1 Ų | 146.1 | 93% | 0.925 | 83% | 0.834 | S | S | * | * | trans | 172.3 | 127.7 | 151 | -100.6 | 170.5 | 176 | 0 | 0 | 105 | ||||
| 329 | G | 33.1 | Very low | 37.1 | Very low | 71 Ų | 71 | 146.5 Ų | 146.5 | 73% | 0.732 | 84% | 0.841 | S | S | * | * | cis | 123.3 | 133.5 | 37 | 0 | 0 | 0 | 0 | 0 | 107.2 | ||||
| 330 | A | 31.7 | Very low | 36.7 | Very low | 99 Ų | 99 | 148.1 Ų | 148.1 | 82% | 0.818 | 84% | 0.844 | S | S | * | * | trans | 77.5 | 110.6 | 175.1 | 0 | 0 | 0 | 0 | 0 | 116.8 | ||||
| 331 | S | 31.7 | Very low | 36.1 | Very low | 102 Ų | 102 | 145.4 Ų | 145.4 | 71% | 0.713 | 84% | 0.844 | S | S | * | * | 79 | 114 | 66.3 | -179.8 | 0 | 0 | 0 | 0 | 113.7 | |||||
| 332 | F | 33.6 | Very low | 35.7 | Very low | 184 Ų | 184 | 148.2 Ų | 148.2 | 81% | 0.807 | 85% | 0.849 | S | S | * | * | trans | 45.6 | 106.4 | 145.4 | -76 | -92.2 | 0 | 0 | 0 | 118.4 | ||||
| 333 | Y | 40.1 | Very low | 35.2 | Very low | 305 Ų | 305 | 149.6 Ų | 149.6 | 100% | 1.196 | 85% | 0.848 | S | S | * | * | -156.1 | 0 | 102.6 | -94.7 | -73.4 | 0 | 0 | 0 | 110.2 |
Retrieved 333 of 333 residues in 1054.3 ms
(Link to these results)