| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 32 | Very low | 25.9 | Very low | 232 Ų | 232 | 142.3 Ų | 142.3 | 100% | 1.143 | 85% | 0.845 | S | S | * | * | 0 | 107.3 | 0 | -77.3 | 173.2 | 144.9 | 0 | 0 | 107.4 | |||||
| 2 | D | 24 | Very low | 25.7 | Very low | 133 Ų | 133 | 142.3 Ų | 142.3 | 71% | 0.711 | 84% | 0.837 | S | S | * | * | cis | -169.1 | 126.2 | -12.8 | -97.1 | -33.4 | 0 | 0 | 0 | 103.1 | ||||
| 3 | H | 23.4 | Very low | 25.5 | Very low | 166 Ų | 166 | 147 Ų | 147 | 77% | 0.769 | 85% | 0.846 | S | S | * | * | 60.2 | 118.1 | 104.9 | -95.7 | -65.3 | 0 | 0 | 0 | 117.2 | |||||
| 4 | S | 24.9 | Very low | 25.3 | Very low | 113 Ų | 113 | 144.9 Ų | 144.9 | 79% | 0.79 | 84% | 0.837 | S | S | * | * | trans | 87.3 | 129.4 | 131.1 | -52.3 | 0 | 0 | 0 | 0 | 120.3 | ||||
| 5 | G | 24.5 | Very low | 25.1 | Very low | 80 Ų | 80 | 140.1 Ų | 140.1 | 83% | 0.825 | 82% | 0.815 | S | S | * | * | trans | 166 | 78.3 | 163.1 | 0 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 6 | M | 25.6 | Very low | 24.9 | Very low | 177 Ų | 177 | 139.1 Ų | 139.1 | 87% | 0.872 | 81% | 0.814 | S | S | * | * | trans | -62.8 | 151.2 | 173.8 | -69.5 | 160 | 62.8 | 0 | 0 | 113.4 | ||||
| 7 | T | 25.3 | Very low | 24.8 | Very low | 134 Ų | 134 | 140.7 Ų | 140.7 | 82% | 0.822 | 81% | 0.809 | S | S | * | * | 154.7 | 121.1 | 124.3 | 40.8 | 0 | 0 | 0 | 0 | 108.6 | |||||
| 8 | G | 27.8 | Very low | 24.8 | Very low | 85 Ų | 85 | 142.4 Ų | 142.4 | 88% | 0.876 | 81% | 0.809 | S | S | * | * | cis | 90.4 | 38.1 | 28.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 9 | A | 27.5 | Very low | 24.7 | Very low | 88 Ų | 88 | 139.9 Ų | 139.9 | 73% | 0.727 | 80% | 0.801 | S | S | * | * | trans | -146.2 | 80.8 | -179.6 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 10 | Q | 26.3 | Very low | 24.7 | Very low | 190 Ų | 190 | 136.3 Ų | 136.3 | 89% | 0.888 | 79% | 0.789 | S | S | * | * | trans | 178.8 | 90.8 | 149.6 | -102.2 | 172 | 5 | 0 | 0 | 107.9 | ||||
| 11 | L | 23.7 | Very low | 24.7 | Very low | 167 Ų | 167 | 136.3 Ų | 136.3 | 87% | 0.874 | 78% | 0.78 | S | S | * | * | S | Bend | trans | 176.6 | 129.1 | 147.5 | -95.7 | 159.2 | 0 | 0 | 0 | 108.6 | ||
| 12 | L | 23.2 | Very low | 24.3 | Very low | 142 Ų | 142 | 127.8 Ų | 127.8 | 74% | 0.743 | 74% | 0.743 | S | S | * | * | trans | 76.5 | 83.1 | 167.3 | -65.7 | 141.8 | 0 | 0 | 0 | 116.6 | T14 | L12-T14 HydrophobicContact CB-CG2 4.32Å; L12-T14 PolarHBondContact O-N 2.96Å | ||
| 13 | E | 22.6 | Very low | 24.4 | Very low | 204 Ų | 204 | 128.1 Ų | 128.1 | 95% | 0.953 | 74% | 0.74 | S | S | * | * | trans | -55.4 | 94.8 | 138.6 | -78.6 | 179.4 | 131.6 | 0 | 0 | 108.4 | S15 | E13-S15 PolarHBondContact O-N 3.14Å; E13-S15 VanDerWaalsContact O-N 3.13Å | ||
| 14 | T | 22.8 | Very low | 24.5 | Very low | 118 Ų | 118 | 128 Ų | 128 | 72% | 0.724 | 73% | 0.732 | S | S | * | * | trans | -72.6 | 102 | 168.9 | 42.9 | 0 | 0 | 0 | 0 | 108.5 | L12 | L12-T14 HydrophobicContact CB-CG2 4.32Å; L12-T14 PolarHBondContact O-N 2.96Å | ||
| 15 | S | 22.8 | Very low | 24.6 | Very low | 73 Ų | 73 | 126.4 Ų | 126.4 | 51% | 0.51 | 71% | 0.714 | S | S | . | * | trans | -52.1 | 133.2 | 169.3 | -166.4 | 0 | 0 | 0 | 0 | 110.4 | E13 K17 | E13-S15 PolarHBondContact O-N 3.14Å; E13-S15 VanDerWaalsContact O-N 3.13Å; S15-K17 PolarHBondContact O-N 2.97Å | ||
| 16 | P | 22.4 | Very low | 24.6 | Very low | 123 Ų | 123 | 123.6 Ų | 123.6 | 80% | 0.799 | 68% | 0.683 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77.6 | 47.4 | -176.4 | 32.5 | -35.7 | 0 | 0 | 0 | 112.7 | ||
| 17 | K | 22.9 | Very low | 24.7 | Very low | 167 Ų | 167 | 118.1 Ų | 118.1 | 73% | 0.726 | 66% | 0.662 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -104.3 | -8.7 | -174.7 | -77 | -177.9 | 177.7 | 173.9 | 0 | 115 | S15 | S15-K17 PolarHBondContact O-N 2.97Š|
| 18 | E | 25.1 | Very low | 24.7 | Very low | 172 Ų | 172 | 114.8 Ų | 114.8 | 80% | 0.804 | 64% | 0.642 | S | S | * | * | S | Bend | trans | -88.9 | -23.6 | -176.1 | -77.4 | -178.1 | 147.3 | 0 | 0 | 114.8 | A20 F21 | E18-A20 PolarHBondContact O-N 2.88Å; E18-F21 PolarHBondContact O-N 2.8Å |
| 19 | S | 22.1 | Very low | 24.7 | Very low | 95 Ų | 95 | 112.5 Ų | 112.5 | 66% | 0.664 | 62% | 0.615 | S | S | * | * | H | α-helix | trans | -72.8 | -15.3 | 178.3 | 79 | 0 | 0 | 0 | 0 | 113.8 | F21 | S19-F21 VanDerWaalsContact C-N 3.27Å; S19-F21 PolarHBondContact O-N 2.86Å |
| 20 | A | 24.2 | Very low | 25.3 | Very low | 67 Ų | 67 | 111.4 Ų | 111.4 | 55% | 0.554 | 60% | 0.599 | S | S | * | * | H | α-helix | trans | -78.3 | -8.7 | 176.5 | 0 | 0 | 0 | 0 | 0 | 113.6 | E18 | E18-A20 PolarHBondContact O-N 2.88Å |
| 21 | F | 25.3 | Very low | 25.6 | Very low | 137 Ų | 137 | 104.1 Ų | 104.1 | 60% | 0.601 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -88.4 | -36.3 | -177.3 | -149.9 | -102.9 | 0 | 0 | 0 | 112.8 | E18 S19 H23 R24 M25 | E18-F21 PolarHBondContact O-N 2.8Å; S19-F21 VanDerWaalsContact C-N 3.27Å; S19-F21 PolarHBondContact O-N 2.86Å; F21-H23 VanDerWaalsContact C-N 3.35Å; F21-H23 PolarHBondContact O-N 3.41Å; F21-R24 PolarHBondContact O-N 3.03Å; F21-M25 HydrophobicContact CD1-CE 3.75Å; F21-M25 HydrophobicContact CE1-CE 3.35Å; F21-M25 HydrophobicContact CZ-CE 4.27Å |
| 22 | S | 24.2 | Very low | 26.4 | Very low | 52 Ų | 52 | 105.1 Ų | 105.1 | 36% | 0.364 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -66.4 | -30.7 | 179.6 | -79.9 | 0 | 0 | 0 | 0 | 114 | R24 | S22-R24 PolarHBondContact O-N 3.39Å |
| 23 | H | 25.5 | Very low | 27 | Very low | 140 Ų | 140 | 99.4 Ų | 99.4 | 65% | 0.648 | 53% | 0.532 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -72.1 | -8.2 | 178.4 | -86.4 | -71.7 | 0 | 0 | 0 | 114.7 | F21 | F21-H23 VanDerWaalsContact C-N 3.35Å; F21-H23 PolarHBondContact O-N 3.41Å |
| 24 | R | 26.1 | Very low | 28.2 | Very low | 163 Ų | 163 | 96.2 Ų | 96.2 | 62% | 0.615 | 53% | 0.527 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -88.8 | -8.3 | -178.3 | -80.8 | -175.8 | 179.8 | -177.9 | 3.3 | 115.1 | F21 S22 | F21-R24 PolarHBondContact O-N 3.03Å; S22-R24 PolarHBondContact O-N 3.39Å |
| 25 | M | 26.7 | Very low | 29.2 | Very low | 81 Ų | 81 | 97.1 Ų | 97.1 | 40% | 0.399 | 53% | 0.526 | S | S | . | . | S | Bend | trans | -104.1 | -3.1 | -164.8 | -72.6 | -175.6 | -171.9 | 0 | 0 | 116.3 | F21 S143 | F21-M25 HydrophobicContact CD1-CE 3.75Å; F21-M25 HydrophobicContact CE1-CE 3.35Å; F21-M25 HydrophobicContact CZ-CE 4.27Å; M25-S143 WeakPolarHBondContact SD-CB 3.45Å; M25-S143 PolarHBondContact SD-OG 3.34Å |
| 26 | A | 24.8 | Very low | 29.9 | Very low | 21 Ų | 21 | 95.4 Ų | 95.4 | 17% | 0.174 | 52% | 0.521 | C | S | . | . | S | Bend | trans | -103.6 | 6.3 | 178.5 | 0 | 0 | 0 | 0 | 0 | 114.9 | F47 Y128 | A26-F47 HydrophobicContact CB-CE1 4.07Å; A26-F47 HydrophobicContact CB-CZ 4.34Å; A26-Y128 HydrophobicContact CB-CD1 4.38Å; A26-Y128 HydrophobicContact CB-CE1 4.3Å |
| 27 | S | 26.8 | Very low | 30.9 | Very low | 61 Ų | 61 | 95.7 Ų | 95.7 | 43% | 0.427 | 52% | 0.522 | S | S | . | . | S | Bend | trans | -132.6 | 139.7 | 177.5 | -121.3 | 0 | 0 | 0 | 0 | 110 | A29 | S27-A29 PolarHBondContact O-N 2.83Å; S27-A29 VanDerWaalsContact O-N 3.08Å |
| 28 | P | 25.9 | Very low | 32.3 | Very low | 65 Ų | 65 | 90.8 Ų | 90.8 | 42% | 0.422 | 51% | 0.508 | S | S | . | . | S | Bend | trans | -48.9 | 124.8 | 163.1 | 0.8 | 4.1 | 0 | 0 | 0 | 106.4 | V30 | P28-V30 PolarHBondContact O-N 3.37Š|
| 29 | A | 28.6 | Very low | 33.7 | Very low | 36 Ų | 36 | 86.2 Ų | 86.2 | 30% | 0.298 | 49% | 0.492 | S | S | . | . | trans | -38.8 | 104.1 | -170.1 | 0 | 0 | 0 | 0 | 0 | 111.7 | S27 P31 F225 | S27-A29 PolarHBondContact O-N 2.83Å; S27-A29 VanDerWaalsContact O-N 3.08Å; A29-P31 VanDerWaalsContact O-CD 3.25Å; A29-P31 WeakPolarHBondContact O-CD 3.3Å; A29-F225 HydrophobicContact CB-CD1 3.81Å; A29-F225 HydrophobicContact CB-CD2 4.04Å; A29-F225 HydrophobicContact CB-CE1 3.19Å; A29-F225 HydrophobicContact CB-CE2 3.46Å; A29-F225 VanDerWaalsContact CB-CE2 3.46Å; A29-F225 HydrophobicContact CB-CG 4.21Å; A29-F225 HydrophobicContact CB-CZ 3Å | ||
| 30 | V | 39 | Very low | 35.5 | Very low | 65 Ų | 65 | 86.3 Ų | 86.3 | 39% | 0.394 | 50% | 0.499 | S | S | . | . | P | Polyproline II helix | trans | -67.5 | 117.2 | -175.6 | -167 | 0 | 0 | 0 | 0 | 105.8 | P28 R32 W326 | P28-V30 PolarHBondContact O-N 3.37Å; V30-R32 PolarHBondContact O-N 2.96Å; V30-W326 HydrophobicContact CG1-CZ3 4.03Å |
| 31 | P | 33 | Very low | 37.7 | Very low | 37 Ų | 37 | 84 Ų | 84 | 24% | 0.24 | 48% | 0.479 | C | S | . | . | P | Polyproline II helix | trans | -51.3 | 135.5 | 161.7 | -17.4 | 29.7 | 0 | 0 | 0 | 106.7 | A29 S33 M323 | A29-P31 VanDerWaalsContact O-CD 3.25Å; A29-P31 WeakPolarHBondContact O-CD 3.3Å; P31-S33 PolarHBondContact O-N 3.43Å; P31-M323 WeakPolarHBondContact CD-SD 3.14Å; P31-M323 HydrophobicContact CG-CE 3.91Å; P31-M323 HydrophobicContact CG-SD 3.7Å |
| 32 | R | 40.1 | Very low | 40.1 | Very low | 188 Ų | 188 | 86.1 Ų | 86.1 | 71% | 0.709 | 48% | 0.482 | S | S | * | . | P | Polyproline II helix | trans | -46.1 | 125.8 | 171 | -79.6 | 176.3 | 165.3 | 154.9 | -6.3 | 107.9 | V30 V34 | V30-R32 PolarHBondContact O-N 2.96Å; R32-V34 PolarHBondContact O-N 3.41Å |
| 33 | S | 37.2 | Very low | 42.5 | Very low | 22 Ų | 22 | 86.2 Ų | 86.2 | 15% | 0.154 | 48% | 0.482 | C | S | . | . | trans | -34.9 | 137.9 | 174.8 | 33.7 | 0 | 0 | 0 | 0 | 110.4 | P31 L35 G36 | P31-S33 PolarHBondContact O-N 3.43Å; S33-L35 PolarHBondContact O-N 3.22Å; S33-G36 PolarHBondContact O-N 3.36Å; S33-G36 PolarHBondContact OG-O 3.47Å | ||
| 34 | V | 47.5 | Very low | 45 | Very low | 138 Ų | 138 | 83.3 Ų | 83.3 | 84% | 0.836 | 48% | 0.475 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -56.1 | -11.8 | -179.4 | 177.1 | 0 | 0 | 0 | 0 | 112.1 | R32 | R32-V34 PolarHBondContact O-N 3.41Š|
| 35 | L | 42.4 | Very low | 47.6 | Very low | 136 Ų | 136 | 78.9 Ų | 78.9 | 71% | 0.712 | 46% | 0.464 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -127.8 | 27.5 | -170.5 | -81.8 | 145.5 | 0 | 0 | 0 | 115.9 | S33 | S33-L35 PolarHBondContact O-N 3.22Š|
| 36 | G | 37.4 | Very low | 50.2 | Low | 38 Ų | 38 | 76.8 Ų | 76.8 | 39% | 0.392 | 45% | 0.454 | S | S | . | . | S | Bend | trans | 93.2 | 177.3 | 170.7 | 0 | 0 | 0 | 0 | 0 | 115.1 | S33 | S33-G36 PolarHBondContact O-N 3.36Å; S33-G36 PolarHBondContact OG-O 3.47Å |
| 37 | P | 44.8 | Very low | 52.7 | Low | 129 Ų | 129 | 78.7 Ų | 78.7 | 84% | 0.838 | 46% | 0.458 | S | S | * | . | S | Bend | trans | -64.4 | 124.7 | -170.3 | 26 | -32.3 | 0 | 0 | 0 | 110.7 | ||
| 38 | P | 51.4 | Low | 55.3 | Low | 64 Ų | 64 | 77.9 Ų | 77.9 | 42% | 0.416 | 46% | 0.456 | S | S | . | . | P | Polyproline II helix | trans | -82.2 | 143.1 | -167.2 | 32.1 | -36.1 | 0 | 0 | 0 | 112.3 | R330 | P38-R330 VanDerWaalsContact CB-CZ 3.46Å; P38-R330 VanDerWaalsContact CB-NH1 3.26Å |
| 39 | P | 54.5 | Low | 58.2 | Low | 75 Ų | 75 | 75.5 Ų | 75.5 | 49% | 0.487 | 44% | 0.439 | S | S | . | . | P | Polyproline II helix | trans | -62.5 | 146.8 | 175.9 | -19.3 | 30.5 | 0 | 0 | 0 | 112.7 | V41 R330 I334 | P39-V41 PolarHBondContact O-N 3.42Å; P39-R330 PolarHBondContact O-NH2 2.99Å; P39-I334 HydrophobicContact CB-CD1 3.89Å; P39-I334 HydrophobicContact CB-CG2 4.36Å; P39-I334 HydrophobicContact CG-CD1 3.84Å; P39-I334 HydrophobicContact CG-CG2 4.32Å |
| 40 | A | 59.8 | Low | 60.7 | Low | 98 Ų | 98 | 74.7 Ų | 74.7 | 81% | 0.81 | 44% | 0.435 | S | S | * | . | P | Polyproline II helix | trans | -64.3 | 117 | -176.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | ||
| 41 | V | 70 | Confident | 62.9 | Low | 19 Ų | 19 | 72.5 Ų | 72.5 | 12% | 0.115 | 42% | 0.423 | C | S | . | . | trans | -106.5 | 151.4 | 173.4 | -179.2 | 0 | 0 | 0 | 0 | 108.3 | P39 L45 D46 R330 I334 | P39-V41 PolarHBondContact O-N 3.42Å; V41-L45 HydrophobicContact CG1-CB 4.22Å; V41-L45 HydrophobicContact CG1-CD2 3.74Å; V41-L45 HydrophobicContact CG1-CG 3.98Å; V41-D46 HydrophobicContact CG1-CB 4.42Å; V41-R330 HydrophobicContact CG2-CG 3.79Å; V41-I334 HydrophobicContact CG2-CD1 3.74Å; V41-I334 HydrophobicContact CG2-CG1 3.61Å | ||
| 42 | W | 76.4 | Confident | 65.6 | Low | 180 Ų | 180 | 75.4 Ų | 75.4 | 68% | 0.682 | 44% | 0.436 | S | S | * | . | trans | -58.8 | 127.4 | 179.3 | -140 | 53.3 | 0 | 0 | 0 | 109.7 | P44 L45 D46 | W42-P44 HydrophobicContact CE3-CB 4.26Å; W42-P44 HydrophobicContact CE3-CG 3.92Å; W42-P44 HydrophobicContact CZ3-CB 4.46Å; W42-P44 HydrophobicContact CZ3-CG 4.07Å; W42-L45 HydrophobicContact CB-CB 4.17Å; W42-L45 WeakPolarHBondContact O-CA 3.36Å; W42-L45 WeakPolarHBondContact O-CB 3.31Å; W42-L45 PolarHBondContact O-N 2.94Å; W42-D46 PolarHBondContact O-N 2.77Å | ||
| 43 | P | 75.1 | Confident | 67.9 | Low | 55 Ų | 55 | 66.5 Ų | 66.5 | 36% | 0.357 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -55.2 | -44.5 | -170.6 | -24.6 | 31.3 | 0 | 0 | 0 | 114.5 | L45 D46 F47 | P43-L45 VanDerWaalsContact C-N 3.27Å; P43-L45 PolarHBondContact O-N 2.95Å; P43-D46 PolarHBondContact O-N 2.76Å; P43-F47 HydrophobicContact CB-CE2 4.27Å; P43-F47 WeakPolarHBondContact O-CD2 3.14Å; P43-F47 WeakPolarHBondContact O-CG 3.26Å; P43-F47 PolarHBondContact O-N 2.95Å |
| 44 | P | 77.4 | Confident | 70.2 | Confident | 78 Ų | 78 | 66.7 Ų | 66.7 | 51% | 0.506 | 40% | 0.404 | S | S | . | . | H | α-helix | trans | -61.3 | -35.7 | 176.8 | -23.1 | 34.7 | 0 | 0 | 0 | 113.2 | W42 A48 | W42-P44 HydrophobicContact CE3-CB 4.26Å; W42-P44 HydrophobicContact CE3-CG 3.92Å; W42-P44 HydrophobicContact CZ3-CB 4.46Å; W42-P44 HydrophobicContact CZ3-CG 4.07Å; P44-A48 WeakPolarHBondContact O-CB 3.22Å; P44-A48 PolarHBondContact O-N 2.9Å |
| 45 | L | 82 | Confident | 72.2 | Confident | 71 Ų | 71 | 61.1 Ų | 61.1 | 37% | 0.372 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -67.5 | -48.1 | 176.2 | 177.8 | 61.6 | 0 | 0 | 0 | 110.2 | V41 W42 P43 F47 A48 L49 | V41-L45 HydrophobicContact CG1-CB 4.22Å; V41-L45 HydrophobicContact CG1-CD2 3.74Å; V41-L45 HydrophobicContact CG1-CG 3.98Å; W42-L45 HydrophobicContact CB-CB 4.17Å; W42-L45 WeakPolarHBondContact O-CA 3.36Å; W42-L45 WeakPolarHBondContact O-CB 3.31Å; W42-L45 PolarHBondContact O-N 2.94Å; P43-L45 VanDerWaalsContact C-N 3.27Å; P43-L45 PolarHBondContact O-N 2.95Å; L45-F47 PolarHBondContact O-N 3.37Å; L45-A48 WeakPolarHBondContact O-CB 3.49Å; L45-A48 PolarHBondContact O-N 3.02Å; L45-L49 HydrophobicContact CD1-CD2 4.37Å; L45-L49 HydrophobicContact CD1-CG 4.29Å; L45-L49 HydrophobicContact CG-CD1 4.41Å; L45-L49 HydrophobicContact CG-CG 4.43Å; L45-L49 VanDerWaalsContact O-CG 3.29Å; L45-L49 WeakPolarHBondContact O-CG 3.19Å; L45-L49 PolarHBondContact O-N 3.36Å |
| 46 | D | 79.7 | Confident | 74.6 | Confident | 36 Ų | 36 | 56.2 Ų | 56.2 | 19% | 0.193 | 35% | 0.35 | C | S | . | . | H | α-helix | trans | -58 | -37.6 | 179.3 | -162 | 27 | 0 | 0 | 0 | 112.1 | V41 W42 P43 G50 W326 R330 | V41-D46 HydrophobicContact CG1-CB 4.42Å; W42-D46 PolarHBondContact O-N 2.77Å; P43-D46 PolarHBondContact O-N 2.76Å; D46-G50 PolarHBondContact O-N 2.92Å; D46-W326 PolarHBondContact O-NE1 3.32Å; D46-W326 VanDerWaalsContact OD1-CE2 3.26Å; D46-W326 WeakPolarHBondContact OD1-CZ2 3.16Å; D46-W326 PolarHBondContact OD1-NE1 2.93Å; D46-R330 IonicContact OD1-NE 3.69Å |
| 47 | F | 77 | Confident | 77 | Confident | 61 Ų | 61 | 54.4 Ų | 54.4 | 27% | 0.268 | 33% | 0.331 | S | S | . | . | H | α-helix | trans | -70.3 | -40.5 | 173.8 | -70.6 | -58.5 | 0 | 0 | 0 | 113.9 | A26 P43 L45 L49 G50 A51 L125 | A26-F47 HydrophobicContact CB-CE1 4.07Å; A26-F47 HydrophobicContact CB-CZ 4.34Å; P43-F47 HydrophobicContact CB-CE2 4.27Å; P43-F47 WeakPolarHBondContact O-CD2 3.14Å; P43-F47 WeakPolarHBondContact O-CG 3.26Å; P43-F47 PolarHBondContact O-N 2.95Å; L45-F47 PolarHBondContact O-N 3.37Å; F47-L49 VanDerWaalsContact C-N 3.32Å; F47-G50 PolarHBondContact O-N 3.47Å; F47-G50 VanDerWaalsContact O-N 3.17Å; F47-A51 PolarHBondContact O-N 3.31Å; F47-L125 HydrophobicContact CB-CD1 3.62Å; F47-L125 HydrophobicContact CB-CD2 3.67Å; F47-L125 HydrophobicContact CB-CG 4.28Å; F47-L125 HydrophobicContact CD1-CD2 3.32Å; F47-L125 HydrophobicContact CD2-CD2 3.88Å; F47-L125 HydrophobicContact CE1-CD2 3.82Å; F47-L125 HydrophobicContact CE2-CD2 4.35Å; F47-L125 HydrophobicContact CG-CD1 4.29Å; F47-L125 HydrophobicContact CG-CD2 3.36Å; F47-L125 HydrophobicContact CG-CG 4.44Å; F47-L125 HydrophobicContact CZ-CD2 4.31Å |
| 48 | A | 82.6 | Confident | 79.1 | Confident | 45 Ų | 45 | 48.6 Ų | 48.6 | 37% | 0.372 | 29% | 0.293 | S | S | . | . | H | α-helix | trans | -62.2 | -41.7 | 174.3 | 0 | 0 | 0 | 0 | 0 | 111.1 | P44 L45 G50 A51 L52 | P44-A48 WeakPolarHBondContact O-CB 3.22Å; P44-A48 PolarHBondContact O-N 2.9Å; L45-A48 WeakPolarHBondContact O-CB 3.49Å; L45-A48 PolarHBondContact O-N 3.02Å; A48-G50 VanDerWaalsContact C-N 3.3Å; A48-G50 PolarHBondContact O-N 2.94Å; A48-A51 PolarHBondContact O-N 2.89Å; A48-L52 WeakPolarHBondContact O-CG 3.46Å; A48-L52 PolarHBondContact O-N 3.45Å |
| 49 | L | 85.6 | Confident | 81.1 | Confident | 15 Ų | 15 | 48.1 Ų | 48.1 | 8% | 0.079 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -60.8 | -40.9 | 172.5 | -62.4 | -177.4 | 0 | 0 | 0 | 111 | L45 F47 L52 A53 M329 R330 A333 | L45-L49 HydrophobicContact CD1-CD2 4.37Å; L45-L49 HydrophobicContact CD1-CG 4.29Å; L45-L49 HydrophobicContact CG-CD1 4.41Å; L45-L49 HydrophobicContact CG-CG 4.43Å; L45-L49 VanDerWaalsContact O-CG 3.29Å; L45-L49 WeakPolarHBondContact O-CG 3.19Å; L45-L49 PolarHBondContact O-N 3.36Å; F47-L49 VanDerWaalsContact C-N 3.32Å; L49-L52 PolarHBondContact O-N 3.22Å; L49-A53 VanDerWaalsContact O-CB 3.23Å; L49-A53 WeakPolarHBondContact O-CB 3.29Å; L49-A53 PolarHBondContact O-N 3.38Å; L49-M329 HydrophobicContact CB-CB 4.5Å; L49-M329 HydrophobicContact CD2-CB 4.14Å; L49-M329 HydrophobicContact CD2-CE 3.69Å; L49-R330 HydrophobicContact CD1-CB 4.23Å; L49-A333 HydrophobicContact CD1-CB 4.1Å |
| 50 | G | 82.9 | Confident | 82.8 | Confident | 19 Ų | 19 | 50.8 Ų | 50.8 | 20% | 0.196 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -62.2 | -41.8 | 174.5 | 0 | 0 | 0 | 0 | 0 | 113.3 | D46 F47 A48 A53 C54 | D46-G50 PolarHBondContact O-N 2.92Å; F47-G50 PolarHBondContact O-N 3.47Å; F47-G50 VanDerWaalsContact O-N 3.17Å; A48-G50 VanDerWaalsContact C-N 3.3Å; A48-G50 PolarHBondContact O-N 2.94Å; G50-A53 PolarHBondContact O-N 3.4Å; G50-C54 PolarHBondContact O-N 3.46Å; G50-C54 PolarHBondContact O-SG 3.13Å; G50-C54 VanDerWaalsContact O-SG 3.35Å |
| 51 | A | 84.6 | Confident | 84.3 | Confident | 19 Ų | 19 | 46.2 Ų | 46.2 | 16% | 0.157 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -64.8 | -44.4 | 176 | 0 | 0 | 0 | 0 | 0 | 111.7 | F47 A48 C54 C55 N121 | F47-A51 PolarHBondContact O-N 3.31Å; A48-A51 PolarHBondContact O-N 2.89Å; A51-C54 PolarHBondContact O-N 3.38Å; A51-C55 PolarHBondContact O-N 3.13Å; A51-C55 PolarHBondContact O-SG 2.9Å; A51-C55 VanDerWaalsContact O-SG 3.41Å; A51-N121 HydrophobicContact CB-CB 3.86Å |
| 52 | L | 88.9 | Confident | 85.4 | Confident | 97 Ų | 97 | 45.3 Ų | 45.3 | 51% | 0.508 | 25% | 0.25 | S | C | . | . | H | α-helix | trans | -63.9 | -40.6 | 176.2 | -71.4 | 171.2 | 0 | 0 | 0 | 112.1 | A48 L49 C54 C55 A56 M329 | A48-L52 WeakPolarHBondContact O-CG 3.46Å; A48-L52 PolarHBondContact O-N 3.45Å; L49-L52 PolarHBondContact O-N 3.22Å; L52-C54 PolarHBondContact O-N 3.4Å; L52-C55 WeakPolarHBondContact O-CB 3.14Å; L52-C55 PolarHBondContact O-N 3.38Å; L52-C55 VanDerWaalsContact O-N 3.16Å; L52-A56 PolarHBondContact O-N 2.96Å; L52-M329 HydrophobicContact CB-CE 3.47Å; L52-M329 VanDerWaalsContact CB-CE 3.47Å; L52-M329 HydrophobicContact CB-SD 4.09Å; L52-M329 HydrophobicContact CD1-CE 3.59Å; L52-M329 HydrophobicContact CG-CE 4.18Å |
| 53 | A | 88.1 | Confident | 86.2 | Confident | 1 Ų | 1 | 38 Ų | 38 | 1% | 0.008 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -61.3 | -42.8 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112 | L49 G50 C55 A56 A57 S322 F325 W326 M329 | L49-A53 VanDerWaalsContact O-CB 3.23Å; L49-A53 WeakPolarHBondContact O-CB 3.29Å; L49-A53 PolarHBondContact O-N 3.38Å; G50-A53 PolarHBondContact O-N 3.4Å; A53-C55 VanDerWaalsContact C-N 3.35Å; A53-C55 PolarHBondContact O-N 3.14Å; A53-A56 PolarHBondContact O-N 3.32Å; A53-A57 WeakPolarHBondContact O-CB 3.35Å; A53-A57 PolarHBondContact O-N 3.21Å; A53-S322 WeakPolarHBondContact CB-O 3.1Å; A53-F325 HydrophobicContact CB-CB 3.74Å; A53-W326 HydrophobicContact CB-CB 3.79Å; A53-M329 HydrophobicContact CB-SD 4.37Å |
| 54 | C | 86.6 | Confident | 87 | Confident | 26 Ų | 26 | 36.3 Ų | 36.3 | 18% | 0.176 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -63.8 | -38.5 | 173.3 | -71.6 | 0 | 0 | 0 | 0 | 112.5 | G50 A51 L52 A57 C58 Q117 | G50-C54 PolarHBondContact O-N 3.46Å; G50-C54 PolarHBondContact O-SG 3.13Å; G50-C54 VanDerWaalsContact O-SG 3.35Å; A51-C54 PolarHBondContact O-N 3.38Å; L52-C54 PolarHBondContact O-N 3.4Å; C54-A57 PolarHBondContact O-N 2.9Å; C54-C58 WeakPolarHBondContact O-CB 3.3Å; C54-C58 PolarHBondContact O-N 3.03Å; C54-Q117 HydrophobicContact CB-CG 3.93Å |
| 55 | C | 90.1 | Very high | 87.6 | Confident | 22 Ų | 22 | 33.6 Ų | 33.6 | 15% | 0.149 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -62.7 | -44.3 | 173.9 | -75 | 0 | 0 | 0 | 0 | 111.3 | A51 L52 A53 C58 V59 L114 | A51-C55 PolarHBondContact O-N 3.13Å; A51-C55 PolarHBondContact O-SG 2.9Å; A51-C55 VanDerWaalsContact O-SG 3.41Å; L52-C55 WeakPolarHBondContact O-CB 3.14Å; L52-C55 PolarHBondContact O-N 3.38Å; L52-C55 VanDerWaalsContact O-N 3.16Å; A53-C55 VanDerWaalsContact C-N 3.35Å; A53-C55 PolarHBondContact O-N 3.14Å; C55-C58 VanDerWaalsContact O-CB 3.27Å; C55-C58 WeakPolarHBondContact O-CB 3.44Å; C55-C58 PolarHBondContact O-N 3.4Å; C55-V59 PolarHBondContact O-N 3.5Å; C55-L114 HydrophobicContact CB-CD2 3.81Å; C55-L114 WeakPolarHBondContact O-CD2 3.35Å |
| 56 | A | 91.1 | Very high | 88.1 | Confident | 33 Ų | 33 | 30.2 Ų | 30.2 | 27% | 0.273 | 18% | 0.177 | S | C | . | . | H | α-helix | trans | -61.7 | -45.4 | 175.4 | 0 | 0 | 0 | 0 | 0 | 111.6 | L52 A53 C58 V59 F60 F325 | L52-A56 PolarHBondContact O-N 2.96Å; A53-A56 PolarHBondContact O-N 3.32Å; A56-C58 VanDerWaalsContact C-N 3.26Å; A56-C58 PolarHBondContact O-N 3.45Å; A56-V59 WeakPolarHBondContact O-CB 3.36Å; A56-V59 PolarHBondContact O-N 3.36Å; A56-F60 WeakPolarHBondContact O-CD2 3.25Å; A56-F325 HydrophobicContact CB-CD2 3.52Å; A56-F325 HydrophobicContact CB-CE2 3.77Å; A56-F325 HydrophobicContact CB-CG 3.96Å; A56-F325 HydrophobicContact CB-CZ 4.4Å |
| 57 | A | 89.2 | Confident | 88.7 | Confident | 0 Ų | 0 | 28.5 Ų | 28.5 | 0% | 0 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -62.6 | -32.4 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.7 | A53 C54 V59 F60 T61 L321 S322 F325 | A53-A57 WeakPolarHBondContact O-CB 3.35Å; A53-A57 PolarHBondContact O-N 3.21Å; C54-A57 PolarHBondContact O-N 2.9Å; A57-V59 VanDerWaalsContact C-N 3.3Å; A57-V59 PolarHBondContact O-N 3.18Å; A57-F60 PolarHBondContact O-N 3.41Å; A57-T61 WeakPolarHBondContact O-CB 3.19Å; A57-T61 WeakPolarHBondContact O-CG2 3.2Å; A57-T61 PolarHBondContact O-N 3.25Å; A57-T61 VanDerWaalsContact O-N 3.1Å; A57-T61 PolarHBondContact O-OG1 3.44Å; A57-L321 HydrophobicContact CB-CB 3.86Å; A57-S322 WeakPolarHBondContact CB-OG 3.12Å; A57-F325 HydrophobicContact CB-CD2 4.38Å |
| 58 | C | 88.9 | Confident | 89.4 | Confident | 6 Ų | 6 | 26.1 Ų | 26.1 | 4% | 0.041 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -60.7 | -38.3 | 176 | -168.8 | 0 | 0 | 0 | 0 | 111.7 | C54 C55 A56 F60 T61 N62 L114 | C54-C58 WeakPolarHBondContact O-CB 3.3Å; C54-C58 PolarHBondContact O-N 3.03Å; C55-C58 VanDerWaalsContact O-CB 3.27Å; C55-C58 WeakPolarHBondContact O-CB 3.44Å; C55-C58 PolarHBondContact O-N 3.4Å; A56-C58 VanDerWaalsContact C-N 3.26Å; A56-C58 PolarHBondContact O-N 3.45Å; C58-F60 VanDerWaalsContact C-N 3.28Å; C58-F60 PolarHBondContact O-N 3.1Å; C58-T61 WeakPolarHBondContact CA-OG1 3.48Å; C58-T61 PolarHBondContact O-N 3.21Å; C58-T61 VanDerWaalsContact O-N 3.11Å; C58-N62 VanDerWaalsContact O-CB 3.27Å; C58-N62 WeakPolarHBondContact O-CB 3.33Å; C58-N62 PolarHBondContact O-N 3.41Å; C58-L114 HydrophobicContact CB-CD2 4.21Å |
| 59 | V | 92.6 | Very high | 89.8 | Confident | 54 Ų | 54 | 24.1 Ų | 24.1 | 33% | 0.327 | 14% | 0.14 | S | C | . | . | H | α-helix | trans | -55.9 | -42.9 | 177.4 | -179.6 | 0 | 0 | 0 | 0 | 111.7 | C55 A56 A57 Q107 L110 | C55-V59 PolarHBondContact O-N 3.5Å; A56-V59 WeakPolarHBondContact O-CB 3.36Å; A56-V59 PolarHBondContact O-N 3.36Å; A57-V59 VanDerWaalsContact C-N 3.3Å; A57-V59 PolarHBondContact O-N 3.18Å; V59-Q107 PolarHBondContact O-NE2 2.83Å; V59-L110 HydrophobicContact CG1-CD2 4.46Å; V59-L110 HydrophobicContact CG2-CD1 4.32Å; V59-L110 HydrophobicContact CG2-CD2 4.45Å |
| 60 | F | 91.2 | Very high | 90.1 | Very high | 131 Ų | 131 | 23.4 Ų | 23.4 | 58% | 0.575 | 14% | 0.136 | S | C | * | . | H | α-helix | trans | -78.9 | -27 | 179.7 | -64.7 | -82.7 | 0 | 0 | 0 | 113.4 | A56 A57 C58 L321 F325 | A56-F60 WeakPolarHBondContact O-CD2 3.25Å; A57-F60 PolarHBondContact O-N 3.41Å; C58-F60 VanDerWaalsContact C-N 3.28Å; C58-F60 PolarHBondContact O-N 3.1Å; F60-L321 HydrophobicContact CB-CD1 3.66Å; F60-L321 HydrophobicContact CD2-CD1 4.29Å; F60-L321 HydrophobicContact CG-CD1 4.08Å; F60-F325 HydrophobicContact CD2-CE2 4.06Å; F60-F325 HydrophobicContact CD2-CZ 4.13Å; F60-F325 AromaticContact CE2-CE2 3.96Å; F60-F325 HydrophobicContact CE2-CE2 3.96Å; F60-F325 AromaticContact CE2-CZ 3.6Å; F60-F325 HydrophobicContact CE2-CZ 3.6Å; F60-F325 HydrophobicContact CZ-CZ 4.43Å |
| 61 | T | 90.5 | Very high | 90.5 | Very high | 2 Ų | 2 | 23.4 Ų | 23.4 | 1% | 0.012 | 13% | 0.132 | C | C | . | . | H | α-helix | trans | -99.3 | -10.3 | -172.7 | 53.2 | 0 | 0 | 0 | 0 | 114 | A57 C58 P63 L64 E65 P317 H318 | A57-T61 WeakPolarHBondContact O-CB 3.19Å; A57-T61 WeakPolarHBondContact O-CG2 3.2Å; A57-T61 PolarHBondContact O-N 3.25Å; A57-T61 VanDerWaalsContact O-N 3.1Å; A57-T61 PolarHBondContact O-OG1 3.44Å; C58-T61 WeakPolarHBondContact CA-OG1 3.48Å; C58-T61 PolarHBondContact O-N 3.21Å; C58-T61 VanDerWaalsContact O-N 3.11Å; T61-P63 VanDerWaalsContact C-CD 3.49Å; T61-L64 WeakPolarHBondContact O-CB 3.37Å; T61-L64 PolarHBondContact O-N 2.85Å; T61-L64 VanDerWaalsContact O-N 3.1Å; T61-E65 PolarHBondContact O-N 3.09Å; T61-P317 HydrophobicContact CG2-CG 4.48Å; T61-H318 HydrophobicContact CG2-CB 3.87Å; T61-H318 PolarHBondContact OG1-ND1 3.45Å; T61-H318 VanDerWaalsContact OG1-ND1 3.11Å |
| 62 | N | 92.9 | Very high | 90.8 | Very high | 0 Ų | 0 | 22.5 Ų | 22.5 | 0% | 0 | 12% | 0.124 | C | C | . | . | H | α-helix | trans | -58.7 | -36.4 | 178.4 | -172.4 | 53.8 | 0 | 0 | 0 | 114.4 | C58 L64 E65 V66 Q107 K108 L110 Q169 | C58-N62 VanDerWaalsContact O-CB 3.27Å; C58-N62 WeakPolarHBondContact O-CB 3.33Å; C58-N62 PolarHBondContact O-N 3.41Å; N62-L64 VanDerWaalsContact C-N 3.25Å; N62-L64 PolarHBondContact O-N 3.4Å; N62-E65 WeakPolarHBondContact O-CA 3.27Å; N62-E65 WeakPolarHBondContact O-CB 3.32Å; N62-E65 PolarHBondContact O-N 3.31Å; N62-V66 PolarHBondContact O-N 3.3Å; N62-Q107 VanDerWaalsContact ND2-CA 3.32Å; N62-Q107 WeakPolarHBondContact ND2-CA 3.45Å; N62-Q107 PolarHBondContact ND2-O 2.91Å; N62-Q107 VanDerWaalsContact ND2-O 3.14Å; N62-Q107 PolarHBondContact ND2-OE1 3.08Å; N62-K108 PolarHBondContact ND2-O 2.99Å; N62-L110 HydrophobicContact CB-CD1 3.94Å; N62-L110 WeakPolarHBondContact ND2-CB 3.36Å; N62-Q169 PolarHBondContact OD1-NE2 2.86Å |
| 63 | P | 93 | Very high | 90.8 | Very high | 26 Ų | 26 | 17.9 Ų | 17.9 | 17% | 0.169 | 10% | 0.1 | C | C | . | . | H | α-helix | trans | -55.2 | -38.2 | 172 | -29.2 | 37.8 | 0 | 0 | 0 | 114.2 | T61 E65 V67 L94 L106 | T61-P63 VanDerWaalsContact C-CD 3.49Å; P63-E65 VanDerWaalsContact C-N 3.32Å; P63-V67 PolarHBondContact O-N 2.99Å; P63-L94 HydrophobicContact CB-CD2 4.13Å; P63-L106 VanDerWaalsContact CA-O 3.23Å; P63-L106 WeakPolarHBondContact CA-O 3.49Å; P63-L106 HydrophobicContact CB-CB 4.15Å; P63-L106 HydrophobicContact CB-CD2 4.29Å; P63-L106 HydrophobicContact CG-CB 4.35Å |
| 64 | L | 91.8 | Very high | 90.7 | Very high | 21 Ų | 21 | 18.3 Ų | 18.3 | 11% | 0.11 | 10% | 0.102 | C | C | . | . | H | α-helix | trans | -72.6 | -28.5 | 176.4 | -64.3 | 172.3 | 0 | 0 | 0 | 111.8 | T61 N62 K68 V90 L94 L313 R314 P317 | T61-L64 WeakPolarHBondContact O-CB 3.37Å; T61-L64 PolarHBondContact O-N 2.85Å; T61-L64 VanDerWaalsContact O-N 3.1Å; N62-L64 VanDerWaalsContact C-N 3.25Å; N62-L64 PolarHBondContact O-N 3.4Å; L64-K68 VanDerWaalsContact O-CB 3.28Å; L64-K68 WeakPolarHBondContact O-CB 3.31Å; L64-K68 PolarHBondContact O-N 2.94Å; L64-V90 HydrophobicContact CD2-CG1 4.07Å; L64-L94 HydrophobicContact CD2-CD1 3.94Å; L64-L94 HydrophobicContact CD2-CD2 4.4Å; L64-L313 HydrophobicContact CD1-CG 4.4Å; L64-L313 HydrophobicContact CD2-CD2 3.92Å; L64-L313 HydrophobicContact CD2-CG 4.35Å; L64-R314 HydrophobicContact CB-CB 3.97Å; L64-R314 HydrophobicContact CB-CG 4.11Å; L64-R314 HydrophobicContact CD1-CB 4.03Å; L64-R314 HydrophobicContact CD1-CG 4.41Å; L64-P317 HydrophobicContact CD1-CG 4.4Å |
| 65 | E | 90.5 | Very high | 90.5 | Very high | 21 Ų | 21 | 17.7 Ų | 17.7 | 10% | 0.098 | 10% | 0.099 | C | C | . | . | H | α-helix | trans | -71.1 | -41.8 | 174 | -64 | -166.5 | 146.3 | 0 | 0 | 112.3 | T61 N62 P63 V67 K68 T69 K165 R314 | T61-E65 PolarHBondContact O-N 3.09Å; N62-E65 WeakPolarHBondContact O-CA 3.27Å; N62-E65 WeakPolarHBondContact O-CB 3.32Å; N62-E65 PolarHBondContact O-N 3.31Å; P63-E65 VanDerWaalsContact C-N 3.32Å; E65-V67 VanDerWaalsContact C-N 3.32Å; E65-V67 PolarHBondContact O-N 3.18Å; E65-K68 WeakPolarHBondContact O-CB 3.42Å; E65-K68 PolarHBondContact O-N 3.21Å; E65-T69 WeakPolarHBondContact O-CG2 3.31Å; E65-T69 PolarHBondContact O-N 3.47Å; E65-T69 PolarHBondContact O-OG1 2.83Å; E65-K165 IonicContact OE1-NZ 2.62Å; E65-K165 WeakPolarHBondContact OE2-CE 3.49Å; E65-K165 IonicContact OE2-NZ 3.97Å; E65-K165 PolarHBondContact OE2-NZ 2.94Å; E65-R314 HydrophobicContact CG-CG 4.5Å; E65-R314 IonicContact OE1-CZ 3.64Å; E65-R314 IonicContact OE1-NE 3.05Å; E65-R314 IonicContact OE1-NH1 2.65Å; E65-R314 PolarHBondContact OE1-NH1 3.04Å |
| 66 | V | 91.8 | Very high | 90.1 | Very high | 0 Ų | 0 | 17.9 Ų | 17.9 | 0% | 0 | 10% | 0.098 | C | C | . | . | H | α-helix | trans | -59 | -45.4 | 173.3 | 175.1 | 0 | 0 | 0 | 0 | 110.7 | N62 T69 R70 V97 L106 K108 Q169 | N62-V66 PolarHBondContact O-N 3.3Å; V66-T69 PolarHBondContact O-N 2.75Å; V66-T69 PolarHBondContact O-OG1 2.96Å; V66-R70 WeakPolarHBondContact O-CG 3.01Å; V66-R70 PolarHBondContact O-N 2.98Å; V66-V97 HydrophobicContact CG1-CG1 4.49Å; V66-L106 WeakPolarHBondContact CG2-O 3.24Å; V66-K108 HydrophobicContact CG2-CB 4.49Å; V66-Q169 HydrophobicContact CG2-CB 4.39Å; V66-Q169 HydrophobicContact CG2-CG 3.97Å |
| 67 | V | 92.5 | Very high | 89.6 | Confident | 0 Ų | 0 | 19 Ų | 19 | 0% | 0 | 10% | 0.099 | C | C | . | . | H | α-helix | trans | -66.6 | -38.7 | 177.6 | 165 | 0 | 0 | 0 | 0 | 111.8 | P63 E65 L71 V90 A93 L94 P310 | P63-V67 PolarHBondContact O-N 2.99Å; E65-V67 VanDerWaalsContact C-N 3.32Å; E65-V67 PolarHBondContact O-N 3.18Å; V67-L71 HydrophobicContact CG1-CD1 3.68Å; V67-L71 HydrophobicContact CG1-CG 4.48Å; V67-L71 WeakPolarHBondContact O-CB 3.49Å; V67-L71 WeakPolarHBondContact O-CG 3.44Å; V67-L71 PolarHBondContact O-N 3.2Å; V67-V90 HydrophobicContact CG1-CG1 4.06Å; V67-A93 HydrophobicContact CB-CB 4.32Å; V67-A93 HydrophobicContact CG1-CB 3.49Å; V67-A93 VanDerWaalsContact CG1-CB 3.49Å; V67-A93 HydrophobicContact CG2-CB 3.97Å; V67-L94 HydrophobicContact CB-CD2 4.48Å; V67-L94 HydrophobicContact CG2-CD2 3.62Å; V67-L94 HydrophobicContact CG2-CG 3.89Å; V67-P310 HydrophobicContact CG1-CG 4.2Å |
| 68 | K | 92.4 | Very high | 89.3 | Confident | 10 Ų | 10 | 25.9 Ų | 25.9 | 4% | 0.043 | 13% | 0.125 | C | C | . | . | H | α-helix | trans | -57.8 | -55.1 | 174.5 | 177.9 | -168.6 | 171.3 | 177.8 | 0 | 110.8 | L64 E65 R70 L71 Q72 D265 P310 V311 | L64-K68 VanDerWaalsContact O-CB 3.28Å; L64-K68 WeakPolarHBondContact O-CB 3.31Å; L64-K68 PolarHBondContact O-N 2.94Å; E65-K68 WeakPolarHBondContact O-CB 3.42Å; E65-K68 PolarHBondContact O-N 3.21Å; K68-R70 VanDerWaalsContact C-N 3.32Å; K68-R70 PolarHBondContact O-N 3.19Å; K68-L71 PolarHBondContact O-N 3.21Å; K68-Q72 VanDerWaalsContact CE-NE2 3.26Å; K68-Q72 HydrophobicContact CG-CG 4.31Å; K68-Q72 WeakPolarHBondContact O-CB 3.13Å; K68-Q72 VanDerWaalsContact O-CG 3.25Å; K68-Q72 WeakPolarHBondContact O-CG 3.38Å; K68-Q72 PolarHBondContact O-N 3.41Å; K68-D265 WeakPolarHBondContact CE-OD2 3.46Å; K68-D265 IonicContact NZ-OD2 3.95Å; K68-D265 PolarHBondContact NZ-OD2 3.39Å; K68-P310 HydrophobicContact CB-CB 3.75Å; K68-P310 HydrophobicContact CG-CB 4.35Å; K68-V311 HydrophobicContact CD-CG2 3.64Å; K68-V311 HydrophobicContact CG-CG2 4.11Å |
| 69 | T | 91.5 | Very high | 88.6 | Confident | 3 Ų | 3 | 28.1 Ų | 28.1 | 2% | 0.018 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -59.7 | -44.2 | -175.7 | 52.3 | 0 | 0 | 0 | 0 | 111.3 | E65 V66 L71 Q72 L73 Q169 T269 | E65-T69 WeakPolarHBondContact O-CG2 3.31Å; E65-T69 PolarHBondContact O-N 3.47Å; E65-T69 PolarHBondContact O-OG1 2.83Å; V66-T69 PolarHBondContact O-N 2.75Å; V66-T69 PolarHBondContact O-OG1 2.96Å; T69-L71 PolarHBondContact O-N 3.21Å; T69-Q72 PolarHBondContact O-N 3.38Å; T69-L73 VanDerWaalsContact O-CG 3.29Å; T69-L73 WeakPolarHBondContact O-CG 3.3Å; T69-L73 PolarHBondContact O-N 2.88Å; T69-Q169 HydrophobicContact CG2-CB 4.13Å; T69-Q169 VanDerWaalsContact CG2-OE1 3.25Å; T69-Q169 WeakPolarHBondContact OG1-CB 3.28Å; T69-T269 HydrophobicContact CG2-CG2 4.38Å |
| 70 | R | 92.1 | Very high | 87.7 | Confident | 1 Ų | 1 | 32.4 Ų | 32.4 | 0% | 0.004 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -63 | -44.1 | 177.1 | -67 | 179.6 | -171.7 | -160.2 | 6.5 | 112.8 | V66 K68 Q72 L73 Q74 Y87 D101 Q169 Q171 T172 V178 | V66-R70 WeakPolarHBondContact O-CG 3.01Å; V66-R70 PolarHBondContact O-N 2.98Å; K68-R70 VanDerWaalsContact C-N 3.32Å; K68-R70 PolarHBondContact O-N 3.19Å; R70-Q72 VanDerWaalsContact C-N 3.3Å; R70-Q72 PolarHBondContact O-N 3.19Å; R70-L73 PolarHBondContact O-N 2.87Å; R70-Q74 PolarHBondContact O-N 3.42Å; R70-Y87 HydrophobicContact CB-CD2 4.42Å; R70-Y87 HydrophobicContact CB-CE2 4Å; R70-D101 IonicContact CZ-OD2 2.7Å; R70-D101 VanDerWaalsContact CZ-OD2 3.29Å; R70-D101 IonicContact NH1-OD2 2.89Å; R70-D101 PolarHBondContact NH1-OD2 3.35Å; R70-D101 IonicContact NH2-OD2 3.14Å; R70-D101 PolarHBondContact NH2-OD2 3.1Å; R70-Q169 PolarHBondContact NE-O 3.23Å; R70-Q171 PolarHBondContact NH2-O 2.98Å; R70-Q171 VanDerWaalsContact NH2-O 3.07Å; R70-T172 VanDerWaalsContact NH1-CB 3.31Å; R70-T172 PolarHBondContact NH1-OG1 3.41Å; R70-V178 HydrophobicContact CB-CG2 3.8Å; R70-V178 HydrophobicContact CG-CG2 4.11Å; R70-V178 WeakPolarHBondContact O-CG2 3.12Å |
| 71 | L | 91.1 | Very high | 86.8 | Confident | 18 Ų | 18 | 29.6 Ų | 29.6 | 9% | 0.094 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -64.4 | -33.4 | 176.1 | -83.4 | 165.9 | 0 | 0 | 0 | 112.8 | V67 K68 T69 Y87 A93 P310 | V67-L71 HydrophobicContact CG1-CD1 3.68Å; V67-L71 HydrophobicContact CG1-CG 4.48Å; V67-L71 WeakPolarHBondContact O-CB 3.49Å; V67-L71 WeakPolarHBondContact O-CG 3.44Å; V67-L71 PolarHBondContact O-N 3.2Å; K68-L71 PolarHBondContact O-N 3.21Å; T69-L71 PolarHBondContact O-N 3.21Å; L71-Y87 VanDerWaalsContact CD2-CB 3.49Å; L71-A93 HydrophobicContact CD1-CB 4.45Å; L71-P310 HydrophobicContact CD1-CG 3.46Å; L71-P310 VanDerWaalsContact CD1-CG 3.46Å |
| 72 | Q | 89.8 | Confident | 86.2 | Confident | 0 Ų | 0 | 33.2 Ų | 33.2 | 0% | 0 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -72.6 | -31.5 | 177.9 | -71.2 | -173.4 | -31.8 | 0 | 0 | 113.1 | K68 T69 R70 V266 T269 R270 K306 | K68-Q72 VanDerWaalsContact CE-NE2 3.26Å; K68-Q72 HydrophobicContact CG-CG 4.31Å; K68-Q72 WeakPolarHBondContact O-CB 3.13Å; K68-Q72 VanDerWaalsContact O-CG 3.25Å; K68-Q72 WeakPolarHBondContact O-CG 3.38Å; K68-Q72 PolarHBondContact O-N 3.41Å; T69-Q72 PolarHBondContact O-N 3.38Å; R70-Q72 VanDerWaalsContact C-N 3.3Å; R70-Q72 PolarHBondContact O-N 3.19Å; Q72-V266 HydrophobicContact CB-CG2 4.46Å; Q72-V266 HydrophobicContact CG-CG2 3.94Å; Q72-T269 HydrophobicContact CB-CG2 4.18Å; Q72-T269 PolarHBondContact OE1-OG1 3.06Å; Q72-R270 PolarHBondContact O-NE 3.42Å; Q72-R270 VanDerWaalsContact O-NE 3.15Å; Q72-R270 PolarHBondContact O-NH2 3.01Å; Q72-K306 WeakPolarHBondContact CG-O 3.38Å |
| 73 | L | 89.3 | Confident | 85.7 | Confident | 1 Ų | 1 | 34.7 Ų | 34.7 | 1% | 0.005 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -86.1 | -16.4 | 177.6 | -65 | 171.3 | 0 | 0 | 0 | 113.3 | T69 R70 G75 E76 A170 V178 T269 R270 N273 | T69-L73 VanDerWaalsContact O-CG 3.29Å; T69-L73 WeakPolarHBondContact O-CG 3.3Å; T69-L73 PolarHBondContact O-N 2.88Å; R70-L73 PolarHBondContact O-N 2.87Å; L73-G75 PolarHBondContact O-N 2.76Å; L73-E76 WeakPolarHBondContact O-CB 3.27Å; L73-E76 PolarHBondContact O-N 3.24Å; L73-A170 HydrophobicContact CD1-CB 3.52Å; L73-V178 HydrophobicContact CB-CG2 4.39Å; L73-T269 HydrophobicContact CD1-CG2 4.44Å; L73-T269 HydrophobicContact CD2-CG2 4.08Å; L73-T269 HydrophobicContact CG-CG2 4.04Å; L73-R270 HydrophobicContact CD2-CG 4.04Å; L73-N273 HydrophobicContact CD1-CB 3.98Å; L73-N273 WeakPolarHBondContact CD1-ND2 3.13Å; L73-N273 HydrophobicContact CD2-CB 3.65Å; L73-N273 HydrophobicContact CG-CB 4.47Å |
| 74 | Q | 87 | Confident | 85 | Confident | 10 Ų | 10 | 40.8 Ų | 40.8 | 5% | 0.047 | 22% | 0.219 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -65.2 | 123 | -179.1 | -175.1 | 177 | -99.7 | 0 | 0 | 112.1 | R70 Y83 Y87 V178 K306 | R70-Q74 PolarHBondContact O-N 3.42Å; Q74-Y83 HydrophobicContact CG-CD2 4.3Å; Q74-Y83 HydrophobicContact CG-CE2 3.73Å; Q74-Y87 PolarHBondContact NE2-O 3.43Å; Q74-Y87 VanDerWaalsContact OE1-CD2 3.31Å; Q74-V178 HydrophobicContact CB-CB 4.48Å; Q74-V178 HydrophobicContact CB-CG1 4.05Å; Q74-V178 HydrophobicContact CG-CG1 4.11Å; Q74-K306 PolarHBondContact O-NZ 2.76Å |
| 75 | G | 80.6 | Confident | 84.6 | Confident | 12 Ų | 12 | 44.5 Ų | 44.5 | 12% | 0.124 | 24% | 0.238 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 72.4 | 31.1 | 180 | 0 | 0 | 0 | 0 | 0 | 113.1 | L73 L77 R78 E299 | L73-G75 PolarHBondContact O-N 2.76Å; G75-L77 PolarHBondContact O-N 3.45Å; G75-R78 PolarHBondContact O-N 3.31Å; G75-R78 VanDerWaalsContact O-N 3.16Å; G75-E299 VanDerWaalsContact O-CD 3.3Å |
| 76 | E | 83.4 | Confident | 84.3 | Confident | 26 Ų | 26 | 46.1 Ų | 46.1 | 12% | 0.121 | 25% | 0.246 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -54.3 | 122.4 | 175.7 | 175.5 | 169.3 | -128.2 | 0 | 0 | 111.7 | L73 R78 R270 Y285 | L73-E76 WeakPolarHBondContact O-CB 3.27Å; L73-E76 PolarHBondContact O-N 3.24Å; E76-R78 PolarHBondContact O-N 3.29Å; E76-R270 WeakPolarHBondContact OE1-CG 3.06Å; E76-Y285 WeakPolarHBondContact OE1-CE2 3.23Å |
| 77 | L | 80.7 | Confident | 84 | Confident | 56 Ų | 56 | 46.2 Ų | 46.2 | 29% | 0.293 | 25% | 0.246 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 58.1 | 23.7 | -178.6 | -61.9 | -178.8 | 0 | 0 | 0 | 114.8 | G75 L284 Y285 K294 A298 E299 | G75-L77 PolarHBondContact O-N 3.45Å; L77-L284 HydrophobicContact CD1-CB 4.27Å; L77-L284 HydrophobicContact CD1-CD2 3.91Å; L77-Y285 HydrophobicContact CD1-CE1 4.18Å; L77-Y285 HydrophobicContact CD2-CE1 3.77Å; L77-Y285 WeakPolarHBondContact CD2-OH 3.5Å; L77-Y285 HydrophobicContact CG-CE1 4.23Å; L77-Y285 WeakPolarHBondContact CG-OH 3.08Å; L77-K294 HydrophobicContact CD2-CB 3.79Å; L77-A298 HydrophobicContact CD2-CB 4.43Å; L77-E299 PolarHBondContact N-OE1 3.02Å |
| 78 | R | 81.6 | Confident | 83.7 | Confident | 146 Ų | 146 | 56.4 Ų | 56.4 | 55% | 0.551 | 28% | 0.284 | S | S | * | . | trans | -117.3 | 137.1 | 176.2 | -65.4 | -173.6 | -175.1 | -172.9 | 4.1 | 111 | G75 E76 Y83 E299 | G75-R78 PolarHBondContact O-N 3.31Å; G75-R78 VanDerWaalsContact O-N 3.16Å; E76-R78 PolarHBondContact O-N 3.29Å; R78-Y83 HydrophobicContact CB-CD1 3.86Å; R78-Y83 HydrophobicContact CB-CG 4.42Å; R78-E299 WeakPolarHBondContact O-CG 3.43Å | ||
| 79 | A | 75.1 | Confident | 83.4 | Confident | 52 Ų | 52 | 57.2 Ų | 57.2 | 43% | 0.43 | 30% | 0.296 | S | S | . | . | trans | -53.8 | 147 | 173.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | G81 S82 Y83 A298 | A79-G81 PolarHBondContact O-N 3.41Å; A79-S82 PolarHBondContact N-OG 2.79Å; A79-S82 PolarHBondContact O-N 3.48Å; A79-S82 VanDerWaalsContact O-N 3.12Å; A79-S82 PolarHBondContact O-OG 3.49Å; A79-Y83 WeakPolarHBondContact O-CD1 3.41Å; A79-A298 VanDerWaalsContact CA-O 3.25Å; A79-A298 WeakPolarHBondContact CA-O 3.25Å | ||
| 80 | R | 72.5 | Confident | 83.3 | Confident | 145 Ų | 145 | 58.2 Ų | 58.2 | 55% | 0.547 | 30% | 0.302 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -58.7 | 129.7 | 175 | -90.8 | -179.2 | 167.6 | -170.8 | -3.7 | 110.1 | S82 L302 | R80-S82 VanDerWaalsContact C-N 3.34Å; R80-L302 VanDerWaalsContact NH1-CD1 3.27Å; R80-L302 VanDerWaalsContact NH2-CB 3.3Å |
| 81 | G | 73.9 | Confident | 83.2 | Confident | 71 Ų | 71 | 64.5 Ų | 64.5 | 73% | 0.732 | 34% | 0.335 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 87.6 | -9.5 | -179.5 | 0 | 0 | 0 | 0 | 0 | 115.1 | A79 | A79-G81 PolarHBondContact O-N 3.41Š|
| 82 | S | 76.9 | Confident | 83.3 | Confident | 78 Ų | 78 | 67.3 Ų | 67.3 | 55% | 0.545 | 35% | 0.347 | S | S | . | . | S | Bend | trans | -91.3 | 2.9 | 178.8 | 72.2 | 0 | 0 | 0 | 0 | 114.4 | A79 R80 | A79-S82 PolarHBondContact N-OG 2.79Å; A79-S82 PolarHBondContact O-N 3.48Å; A79-S82 VanDerWaalsContact O-N 3.12Å; A79-S82 PolarHBondContact O-OG 3.49Å; R80-S82 VanDerWaalsContact C-N 3.34Å |
| 83 | Y | 81.6 | Confident | 83.3 | Confident | 32 Ų | 32 | 67.3 Ų | 67.3 | 13% | 0.125 | 35% | 0.347 | C | S | . | . | S | Bend | trans | -132.3 | 153.9 | -177.9 | 67.8 | -93.9 | 0 | 0 | 0 | 111.4 | Q74 R78 A79 I85 K306 | Q74-Y83 HydrophobicContact CG-CD2 4.3Å; Q74-Y83 HydrophobicContact CG-CE2 3.73Å; R78-Y83 HydrophobicContact CB-CD1 3.86Å; R78-Y83 HydrophobicContact CB-CG 4.42Å; A79-Y83 WeakPolarHBondContact O-CD1 3.41Å; Y83-I85 HydrophobicContact CD2-CG1 4.5Å; Y83-I85 HydrophobicContact CE2-CG1 4.03Å; Y83-I85 PolarHBondContact O-N 2.88Å; Y83-K306 PolarHBondContact OH-NZ 3.41Å |
| 84 | Q | 79.4 | Confident | 83.4 | Confident | 154 Ų | 154 | 69.3 Ų | 69.3 | 72% | 0.72 | 36% | 0.358 | S | S | * | . | trans | -71.3 | 128.5 | 176.9 | -67.7 | -151 | -15 | 0 | 0 | 111.8 | H86 | Q84-H86 PolarHBondContact O-N 3.49Å; Q84-H86 PolarHBondContact O-ND1 2.95Å | ||
| 85 | I | 83.6 | Confident | 83.7 | Confident | 99 Ų | 99 | 76.9 Ų | 76.9 | 51% | 0.508 | 39% | 0.386 | S | S | . | . | trans | -91.5 | 95.9 | -178.3 | -56.8 | 172.5 | 0 | 0 | 0 | 108.4 | Y83 Y87 R88 | Y83-I85 HydrophobicContact CD2-CG1 4.5Å; Y83-I85 HydrophobicContact CE2-CG1 4.03Å; Y83-I85 PolarHBondContact O-N 2.88Å; I85-Y87 WeakPolarHBondContact CG2-O 3.34Å; I85-R88 HydrophobicContact CG2-CG 4.04Å | ||
| 86 | H | 84.1 | Confident | 84.2 | Confident | 54 Ų | 54 | 77 Ų | 77 | 25% | 0.25 | 39% | 0.385 | C | S | . | . | S | Bend | trans | -75.4 | -33.6 | 175 | -58.2 | 94.6 | 0 | 0 | 0 | 111.6 | Q84 A175 | Q84-H86 PolarHBondContact O-N 3.49Å; Q84-H86 PolarHBondContact O-ND1 2.95Å; H86-A175 PolarHBondContact CD2-O 3.36Å |
| 87 | Y | 85.8 | Confident | 84.5 | Confident | 3 Ų | 3 | 75.8 Ų | 75.8 | 1% | 0.012 | 38% | 0.379 | C | S | . | . | trans | -121.3 | 108.5 | -175.4 | -52.7 | -69.8 | 0 | 0 | 0 | 110.1 | R70 L71 Q74 I85 A93 V96 V97 I176 V178 | R70-Y87 HydrophobicContact CB-CD2 4.42Å; R70-Y87 HydrophobicContact CB-CE2 4Å; L71-Y87 VanDerWaalsContact CD2-CB 3.49Å; Q74-Y87 PolarHBondContact NE2-O 3.43Å; Q74-Y87 VanDerWaalsContact OE1-CD2 3.31Å; I85-Y87 WeakPolarHBondContact CG2-O 3.34Å; Y87-A93 HydrophobicContact CD1-CB 3.52Å; Y87-A93 HydrophobicContact CE1-CB 4.31Å; Y87-A93 HydrophobicContact CG-CB 4.13Å; Y87-V96 HydrophobicContact CE1-CB 4.5Å; Y87-V96 HydrophobicContact CE1-CG1 4.14Å; Y87-V97 HydrophobicContact CE1-CG2 3.82Å; Y87-I176 WeakPolarHBondContact OH-CD1 3.45Å; Y87-I176 PolarHBondContact OH-O 2.9Å; Y87-V178 HydrophobicContact CD2-CG1 4.18Å; Y87-V178 HydrophobicContact CE2-CG1 3.79Å; Y87-V178 HydrophobicContact CE2-CG2 3.95Å | ||
| 88 | R | 84.6 | Confident | 85 | Confident | 213 Ų | 213 | 74.4 Ų | 74.4 | 80% | 0.804 | 38% | 0.378 | S | S | * | . | S | Bend | trans | -87 | -20.8 | 179.8 | -57.7 | 179.9 | 100 | 177.6 | 6 | 113.4 | I85 | I85-R88 HydrophobicContact CG2-CG 4.04Š|
| 89 | G | 87.3 | Confident | 85.4 | Confident | 27 Ų | 27 | 76.9 Ų | 76.9 | 28% | 0.278 | 39% | 0.387 | S | S | . | . | S | Bend | trans | -177.5 | -179.8 | -177.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | A93 | G89-A93 WeakPolarHBondContact O-CB 3.1Å; G89-A93 PolarHBondContact O-N 3.39Å |
| 90 | V | 88.3 | Confident | 86.1 | Confident | 25 Ų | 25 | 77.6 Ų | 77.6 | 15% | 0.152 | 39% | 0.386 | C | S | . | . | H | α-helix | trans | -65.6 | -50.5 | -172.7 | -164.4 | 0 | 0 | 0 | 0 | 112.1 | L64 V67 A93 L94 P310 L313 | L64-V90 HydrophobicContact CD2-CG1 4.07Å; V67-V90 HydrophobicContact CG1-CG1 4.06Å; V90-A93 PolarHBondContact O-N 3.31Å; V90-L94 HydrophobicContact CG1-CD1 4.48Å; V90-L94 WeakPolarHBondContact O-CG 3.39Å; V90-L94 PolarHBondContact O-N 2.87Å; V90-P310 HydrophobicContact CB-CG 4.42Å; V90-P310 HydrophobicContact CG1-CB 4.35Å; V90-P310 HydrophobicContact CG1-CG 4.15Å; V90-P310 HydrophobicContact CG2-CB 4.45Å; V90-P310 HydrophobicContact CG2-CG 3.66Å; V90-L313 HydrophobicContact CB-CD2 4.47Å; V90-L313 HydrophobicContact CG1-CD2 3.86Å |
| 91 | L | 91.4 | Very high | 86.7 | Confident | 133 Ų | 133 | 72 Ų | 72 | 70% | 0.696 | 37% | 0.367 | S | S | * | . | H | α-helix | trans | -65.4 | -43.4 | -178.5 | -60.7 | 179.3 | 0 | 0 | 0 | 111.5 | A93 L94 W95 | L91-A93 VanDerWaalsContact C-N 3.32Å; L91-A93 PolarHBondContact O-N 3.48Å; L91-L94 PolarHBondContact O-N 3.47Å; L91-W95 WeakPolarHBondContact O-CB 3.33Å; L91-W95 PolarHBondContact O-N 2.93Å |
| 92 | H | 92.4 | Very high | 87.4 | Confident | 77 Ų | 77 | 70 Ų | 70 | 36% | 0.356 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -61.5 | -42.2 | 175.1 | -174.7 | -93.9 | 0 | 0 | 0 | 111.2 | W95 V96 | H92-W95 PolarHBondContact O-N 3.32Å; H92-V96 WeakPolarHBondContact CE1-CG2 3.46Å; H92-V96 WeakPolarHBondContact O-CB 3.48Å; H92-V96 VanDerWaalsContact O-CG2 3.27Å; H92-V96 WeakPolarHBondContact O-CG2 3.49Å; H92-V96 PolarHBondContact O-N 3.39Å |
| 93 | A | 89.9 | Confident | 88 | Confident | 0 Ų | 0 | 73.1 Ų | 73.1 | 0% | 0 | 36% | 0.356 | C | S | . | . | H | α-helix | trans | -66.1 | -42.9 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | V67 L71 Y87 G89 V90 L91 W95 V96 V97 | V67-A93 HydrophobicContact CB-CB 4.32Å; V67-A93 HydrophobicContact CG1-CB 3.49Å; V67-A93 VanDerWaalsContact CG1-CB 3.49Å; V67-A93 HydrophobicContact CG2-CB 3.97Å; L71-A93 HydrophobicContact CD1-CB 4.45Å; Y87-A93 HydrophobicContact CD1-CB 3.52Å; Y87-A93 HydrophobicContact CE1-CB 4.31Å; Y87-A93 HydrophobicContact CG-CB 4.13Å; G89-A93 WeakPolarHBondContact O-CB 3.1Å; G89-A93 PolarHBondContact O-N 3.39Å; V90-A93 PolarHBondContact O-N 3.31Å; L91-A93 VanDerWaalsContact C-N 3.32Å; L91-A93 PolarHBondContact O-N 3.48Å; A93-W95 VanDerWaalsContact C-N 3.29Å; A93-W95 PolarHBondContact O-N 3.46Å; A93-V96 PolarHBondContact O-N 2.97Å; A93-V97 WeakPolarHBondContact O-CB 3.41Å; A93-V97 WeakPolarHBondContact O-CG2 3.46Å; A93-V97 PolarHBondContact O-N 3.39Å |
| 94 | L | 92.1 | Very high | 88.2 | Confident | 42 Ų | 42 | 82.5 Ų | 82.5 | 22% | 0.22 | 39% | 0.391 | C | S | . | . | H | α-helix | trans | -57.6 | -44.3 | 173.5 | -74.7 | 170.5 | 0 | 0 | 0 | 111.5 | P63 L64 V67 V90 L91 G98 L106 | P63-L94 HydrophobicContact CB-CD2 4.13Å; L64-L94 HydrophobicContact CD2-CD1 3.94Å; L64-L94 HydrophobicContact CD2-CD2 4.4Å; V67-L94 HydrophobicContact CB-CD2 4.48Å; V67-L94 HydrophobicContact CG2-CD2 3.62Å; V67-L94 HydrophobicContact CG2-CG 3.89Å; V90-L94 HydrophobicContact CG1-CD1 4.48Å; V90-L94 WeakPolarHBondContact O-CG 3.39Å; V90-L94 PolarHBondContact O-N 2.87Å; L91-L94 PolarHBondContact O-N 3.47Å; L94-G98 PolarHBondContact O-N 3.21Å; L94-L106 HydrophobicContact CD2-CD2 3.85Å |
| 95 | W | 92.4 | Very high | 88.5 | Confident | 169 Ų | 169 | 75.2 Ų | 75.2 | 64% | 0.64 | 36% | 0.357 | S | S | * | . | H | α-helix | trans | -65.7 | -49.1 | 178.4 | -177.6 | 84.6 | 0 | 0 | 0 | 112.2 | L91 H92 A93 V97 G98 R99 | L91-W95 WeakPolarHBondContact O-CB 3.33Å; L91-W95 PolarHBondContact O-N 2.93Å; H92-W95 PolarHBondContact O-N 3.32Å; A93-W95 VanDerWaalsContact C-N 3.29Å; A93-W95 PolarHBondContact O-N 3.46Å; W95-V97 PolarHBondContact O-N 3.39Å; W95-G98 PolarHBondContact O-N 3.16Å; W95-R99 VanDerWaalsContact O-CB 3.27Å; W95-R99 WeakPolarHBondContact O-CB 3.38Å; W95-R99 PolarHBondContact O-N 2.95Å |
| 96 | V | 91.4 | Very high | 88.8 | Confident | 16 Ų | 16 | 71.5 Ų | 71.5 | 10% | 0.097 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -59.3 | -50.5 | 178.8 | 169 | 0 | 0 | 0 | 0 | 110.4 | Y87 H92 A93 R99 T100 I176 | Y87-V96 HydrophobicContact CE1-CB 4.5Å; Y87-V96 HydrophobicContact CE1-CG1 4.14Å; H92-V96 WeakPolarHBondContact CE1-CG2 3.46Å; H92-V96 WeakPolarHBondContact O-CB 3.48Å; H92-V96 VanDerWaalsContact O-CG2 3.27Å; H92-V96 WeakPolarHBondContact O-CG2 3.49Å; H92-V96 PolarHBondContact O-N 3.39Å; A93-V96 PolarHBondContact O-N 2.97Å; V96-R99 PolarHBondContact O-N 3Å; V96-T100 HydrophobicContact CG1-CG2 4.41Å; V96-T100 WeakPolarHBondContact O-CB 3.29Å; V96-T100 WeakPolarHBondContact O-CG2 3.47Å; V96-T100 PolarHBondContact O-N 2.97Å; V96-T100 PolarHBondContact O-OG1 3.4Å; V96-I176 HydrophobicContact CG1-CD1 4.2Å; V96-I176 HydrophobicContact CG1-CG2 3.94Å |
| 97 | V | 90.2 | Very high | 89.3 | Confident | 0 Ų | 0 | 71.7 Ų | 71.7 | 0% | 0 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -64.1 | -43.3 | -179.9 | 177.5 | 0 | 0 | 0 | 0 | 111.1 | V66 Y87 A93 W95 R99 T100 D101 G102 L106 | V66-V97 HydrophobicContact CG1-CG1 4.49Å; Y87-V97 HydrophobicContact CE1-CG2 3.82Å; A93-V97 WeakPolarHBondContact O-CB 3.41Å; A93-V97 WeakPolarHBondContact O-CG2 3.46Å; A93-V97 PolarHBondContact O-N 3.39Å; W95-V97 PolarHBondContact O-N 3.39Å; V97-R99 VanDerWaalsContact C-N 3.29Å; V97-R99 PolarHBondContact O-N 3.07Å; V97-T100 PolarHBondContact O-N 3.18Å; V97-D101 HydrophobicContact CG1-CB 4.25Å; V97-D101 PolarHBondContact O-N 3.38Å; V97-G102 PolarHBondContact O-N 2.71Å; V97-L106 HydrophobicContact CB-CD2 3.96Å; V97-L106 HydrophobicContact CG1-CD2 3.75Å; V97-L106 HydrophobicContact CG1-CG 4.05Å |
| 98 | G | 90.6 | Very high | 89.5 | Confident | 26 Ų | 26 | 74.6 Ų | 74.6 | 27% | 0.268 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -63.7 | -33.5 | 177.3 | 0 | 0 | 0 | 0 | 0 | 113.4 | L94 W95 G102 | L94-G98 PolarHBondContact O-N 3.21Å; W95-G98 PolarHBondContact O-N 3.16Å; G98-G102 WeakPolarHBondContact O-CA 3.24Å; G98-G102 PolarHBondContact O-N 2.92Å |
| 99 | R | 90.2 | Very high | 89.7 | Confident | 199 Ų | 199 | 64.7 Ų | 64.7 | 75% | 0.751 | 32% | 0.316 | S | S | * | . | H | α-helix | trans | -78.5 | -35.1 | 178.5 | -170.3 | 69.9 | 178 | 168.6 | 2.3 | 112.9 | W95 V96 V97 | W95-R99 VanDerWaalsContact O-CB 3.27Å; W95-R99 WeakPolarHBondContact O-CB 3.38Å; W95-R99 PolarHBondContact O-N 2.95Å; V96-R99 PolarHBondContact O-N 3Å; V97-R99 VanDerWaalsContact C-N 3.29Å; V97-R99 PolarHBondContact O-N 3.07Å |
| 100 | T | 89 | Confident | 90 | Very high | 66 Ų | 66 | 65.1 Ų | 65.1 | 41% | 0.405 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -95 | -52.1 | -172.9 | 51.6 | 0 | 0 | 0 | 0 | 113 | V96 V97 I176 | V96-T100 HydrophobicContact CG1-CG2 4.41Å; V96-T100 WeakPolarHBondContact O-CB 3.29Å; V96-T100 WeakPolarHBondContact O-CG2 3.47Å; V96-T100 PolarHBondContact O-N 2.97Å; V96-T100 PolarHBondContact O-OG1 3.4Å; V97-T100 PolarHBondContact O-N 3.18Å; T100-I176 HydrophobicContact CG2-CD1 4.37Å; T100-I176 WeakPolarHBondContact OG1-CD1 3.35Å |
| 101 | D | 85.8 | Confident | 90.2 | Very high | 29 Ų | 29 | 67 Ų | 67 | 16% | 0.155 | 33% | 0.326 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -92.2 | -7.9 | 179.6 | -69.8 | -12.2 | 0 | 0 | 0 | 112.6 | R70 V97 G105 K108 T172 V173 | R70-D101 IonicContact CZ-OD2 2.7Å; R70-D101 VanDerWaalsContact CZ-OD2 3.29Å; R70-D101 IonicContact NH1-OD2 2.89Å; R70-D101 PolarHBondContact NH1-OD2 3.35Å; R70-D101 IonicContact NH2-OD2 3.14Å; R70-D101 PolarHBondContact NH2-OD2 3.1Å; V97-D101 HydrophobicContact CG1-CB 4.25Å; V97-D101 PolarHBondContact O-N 3.38Å; D101-G105 PolarHBondContact O-N 3.44Å; D101-K108 IonicContact OD2-NZ 2.76Å; D101-T172 PolarHBondContact OD1-OG1 2.94Å; D101-T172 WeakPolarHBondContact OD2-CB 3.49Å; D101-T172 PolarHBondContact OD2-OG1 2.86Å; D101-V173 PolarHBondContact OD1-N 3.02Å |
| 102 | G | 89.3 | Confident | 90.2 | Very high | 27 Ų | 27 | 60.6 Ų | 60.6 | 28% | 0.278 | 29% | 0.293 | S | S | . | . | H | α-helix | trans | 73.6 | -177.5 | -176.1 | 0 | 0 | 0 | 0 | 0 | 114.1 | V97 G98 R104 G105 L106 | V97-G102 PolarHBondContact O-N 2.71Å; G98-G102 WeakPolarHBondContact O-CA 3.24Å; G98-G102 PolarHBondContact O-N 2.92Å; G102-R104 VanDerWaalsContact C-N 3.26Å; G102-R104 PolarHBondContact O-N 2.86Å; G102-G105 WeakPolarHBondContact O-CA 3.4Å; G102-G105 PolarHBondContact O-N 3Å; G102-L106 PolarHBondContact O-N 3.06Å |
| 103 | L | 88.3 | Confident | 90.1 | Very high | 144 Ų | 144 | 57 Ų | 57 | 75% | 0.754 | 28% | 0.276 | S | S | * | . | H | α-helix | trans | -63 | -31.2 | 179.2 | -66.2 | 176.4 | 0 | 0 | 0 | 113 | G105 L106 Q107 | L103-G105 VanDerWaalsContact C-N 3.32Å; L103-L106 HydrophobicContact CD2-CD1 4.4Å; L103-L106 PolarHBondContact O-N 2.99Å; L103-Q107 PolarHBondContact O-N 3.39Å |
| 104 | R | 86.8 | Confident | 90.2 | Very high | 230 Ų | 230 | 59.6 Ų | 59.6 | 87% | 0.868 | 29% | 0.29 | S | S | * | . | H | α-helix | trans | -68.3 | -32.9 | 173.5 | -70.7 | -177.5 | 174.9 | 172.7 | -1.4 | 111.8 | G102 Q107 K108 | G102-R104 VanDerWaalsContact C-N 3.26Å; G102-R104 PolarHBondContact O-N 2.86Å; R104-Q107 CarbonylContact O-C 3.52Å; R104-Q107 PolarHBondContact O-N 3.25Å; R104-Q107 VanDerWaalsContact O-N 3.11Å; R104-K108 PolarHBondContact O-N 3.24Å |
| 105 | G | 85.5 | Confident | 90.2 | Very high | 1 Ų | 1 | 61.2 Ų | 61.2 | 1% | 0.01 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -58 | -44.9 | 172.2 | 0 | 0 | 0 | 0 | 0 | 113.5 | D101 G102 L103 Q107 K108 | D101-G105 PolarHBondContact O-N 3.44Å; G102-G105 WeakPolarHBondContact O-CA 3.4Å; G102-G105 PolarHBondContact O-N 3Å; L103-G105 VanDerWaalsContact C-N 3.32Å; G105-Q107 PolarHBondContact O-N 3.45Å; G105-K108 WeakPolarHBondContact O-CB 3.17Å; G105-K108 WeakPolarHBondContact O-CG 3.4Å; G105-K108 PolarHBondContact O-N 2.93Å |
| 106 | L | 89.7 | Confident | 90.1 | Very high | 20 Ų | 20 | 54.8 Ų | 54.8 | 11% | 0.105 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -66 | -20.6 | 175.7 | -72.3 | 167.9 | 0 | 0 | 0 | 113.1 | P63 V66 L94 V97 G102 L103 | P63-L106 VanDerWaalsContact CA-O 3.23Å; P63-L106 WeakPolarHBondContact CA-O 3.49Å; P63-L106 HydrophobicContact CB-CB 4.15Å; P63-L106 HydrophobicContact CB-CD2 4.29Å; P63-L106 HydrophobicContact CG-CB 4.35Å; V66-L106 WeakPolarHBondContact CG2-O 3.24Å; L94-L106 HydrophobicContact CD2-CD2 3.85Å; V97-L106 HydrophobicContact CB-CD2 3.96Å; V97-L106 HydrophobicContact CG1-CD2 3.75Å; V97-L106 HydrophobicContact CG1-CG 4.05Å; G102-L106 PolarHBondContact O-N 3.06Å; L103-L106 HydrophobicContact CD2-CD1 4.4Å; L103-L106 PolarHBondContact O-N 2.99Å |
| 107 | Q | 93.5 | Very high | 90 | Very high | 59 Ų | 59 | 55.5 Ų | 55.5 | 28% | 0.276 | 28% | 0.276 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -101.7 | 10.9 | 178.1 | -73.4 | -69.1 | 0.4 | 0 | 0 | 113.8 | V59 N62 L103 R104 G105 G109 L110 | V59-Q107 PolarHBondContact O-NE2 2.83Å; N62-Q107 VanDerWaalsContact ND2-CA 3.32Å; N62-Q107 WeakPolarHBondContact ND2-CA 3.45Å; N62-Q107 PolarHBondContact ND2-O 2.91Å; N62-Q107 VanDerWaalsContact ND2-O 3.14Å; N62-Q107 PolarHBondContact ND2-OE1 3.08Å; L103-Q107 PolarHBondContact O-N 3.39Å; R104-Q107 CarbonylContact O-C 3.52Å; R104-Q107 PolarHBondContact O-N 3.25Å; R104-Q107 VanDerWaalsContact O-N 3.11Å; G105-Q107 PolarHBondContact O-N 3.45Å; Q107-G109 PolarHBondContact O-N 2.91Å; Q107-L110 WeakPolarHBondContact O-CB 3.46Å; Q107-L110 PolarHBondContact O-N 3.44Å |
| 108 | K | 90.8 | Very high | 89.8 | Confident | 63 Ų | 63 | 58.1 Ų | 58.1 | 27% | 0.274 | 30% | 0.298 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -57.4 | 141.4 | 177 | -76.7 | -175.2 | -176.6 | -175.4 | 0 | 111.4 | N62 V66 D101 R104 G105 L110 L168 Q169 Q171 | N62-K108 PolarHBondContact ND2-O 2.99Å; V66-K108 HydrophobicContact CG2-CB 4.49Å; D101-K108 IonicContact OD2-NZ 2.76Å; R104-K108 PolarHBondContact O-N 3.24Å; G105-K108 WeakPolarHBondContact O-CB 3.17Å; G105-K108 WeakPolarHBondContact O-CG 3.4Å; G105-K108 PolarHBondContact O-N 2.93Å; K108-L110 PolarHBondContact O-N 3.26Å; K108-L168 WeakPolarHBondContact CB-O 3.19Å; K108-L168 WeakPolarHBondContact CD-O 3.32Å; K108-Q169 WeakPolarHBondContact O-CG 3.49Å; K108-Q171 WeakPolarHBondContact CD-O 3.11Å; K108-Q171 PolarHBondContact NZ-O 3.39Å |
| 109 | G | 89.8 | Confident | 89.8 | Confident | 6 Ų | 6 | 59.2 Ų | 59.2 | 6% | 0.062 | 30% | 0.299 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 72.1 | 4.9 | -179.8 | 0 | 0 | 0 | 0 | 0 | 115.6 | Q107 S111 A112 G113 | Q107-G109 PolarHBondContact O-N 2.91Å; G109-S111 PolarHBondContact O-N 3Å; G109-A112 PolarHBondContact O-N 2.87Å; G109-G113 PolarHBondContact O-N 3.33Å |
| 110 | L | 92.5 | Very high | 89.6 | Confident | 35 Ų | 35 | 50.4 Ų | 50.4 | 18% | 0.183 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -55.2 | -50.9 | -179.8 | 178.3 | 61.2 | 0 | 0 | 0 | 112 | V59 N62 Q107 K108 A112 G113 L114 | V59-L110 HydrophobicContact CG1-CD2 4.46Å; V59-L110 HydrophobicContact CG2-CD1 4.32Å; V59-L110 HydrophobicContact CG2-CD2 4.45Å; N62-L110 HydrophobicContact CB-CD1 3.94Å; N62-L110 WeakPolarHBondContact ND2-CB 3.36Å; Q107-L110 WeakPolarHBondContact O-CB 3.46Å; Q107-L110 PolarHBondContact O-N 3.44Å; K108-L110 PolarHBondContact O-N 3.26Å; L110-A112 PolarHBondContact O-N 3.24Å; L110-G113 CarbonylContact O-C 3.49Å; L110-G113 WeakPolarHBondContact O-CA 3.38Å; L110-G113 PolarHBondContact O-N 3.27Å; L110-L114 HydrophobicContact CD1-CD2 4.44Å; L110-L114 HydrophobicContact CD1-CG 4.23Å; L110-L114 HydrophobicContact CG-CD1 4.27Å; L110-L114 HydrophobicContact CG-CG 4.38Å; L110-L114 WeakPolarHBondContact O-CG 3.49Å; L110-L114 PolarHBondContact O-N 2.88Å |
| 111 | S | 92.6 | Very high | 89.3 | Confident | 64 Ų | 64 | 47.5 Ų | 47.5 | 45% | 0.448 | 25% | 0.248 | S | C | . | . | H | α-helix | trans | -61.6 | -42.1 | -178.4 | 41.5 | 0 | 0 | 0 | 0 | 112.5 | G109 G113 L114 I115 V187 | G109-S111 PolarHBondContact O-N 3Å; S111-G113 VanDerWaalsContact C-N 3.29Å; S111-G113 PolarHBondContact O-N 3Å; S111-L114 PolarHBondContact O-N 3.28Å; S111-I115 WeakPolarHBondContact O-CG1 3.27Å; S111-I115 PolarHBondContact O-N 3.12Å; S111-V187 WeakPolarHBondContact OG-CG2 3.38Å |
| 112 | A | 91.7 | Very high | 89.2 | Confident | 0 Ų | 0 | 48.1 Ų | 48.1 | 0% | 0 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -64 | -35.7 | 172.1 | 0 | 0 | 0 | 0 | 0 | 112 | G109 L110 I115 Y116 V164 K165 V187 | G109-A112 PolarHBondContact O-N 2.87Å; L110-A112 PolarHBondContact O-N 3.24Å; A112-I115 PolarHBondContact O-N 2.91Å; A112-Y116 WeakPolarHBondContact O-CB 3.48Å; A112-Y116 PolarHBondContact O-N 3.37Å; A112-V164 HydrophobicContact CB-CB 4.47Å; A112-V164 HydrophobicContact CB-CG1 4.09Å; A112-K165 HydrophobicContact CB-CB 3.8Å; A112-V187 HydrophobicContact CB-CG1 4.3Å; A112-V187 HydrophobicContact CB-CG2 3.95Å |
| 113 | G | 90 | Very high | 89.1 | Confident | 1 Ų | 1 | 48.1 Ų | 48.1 | 1% | 0.01 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -64.2 | -40 | 172.7 | 0 | 0 | 0 | 0 | 0 | 113.9 | G109 L110 S111 Y116 Q117 | G109-G113 PolarHBondContact O-N 3.33Å; L110-G113 CarbonylContact O-C 3.49Å; L110-G113 WeakPolarHBondContact O-CA 3.38Å; L110-G113 PolarHBondContact O-N 3.27Å; S111-G113 VanDerWaalsContact C-N 3.29Å; S111-G113 PolarHBondContact O-N 3Å; G113-Y116 WeakPolarHBondContact O-CB 3.36Å; G113-Y116 PolarHBondContact O-N 2.62Å; G113-Q117 WeakPolarHBondContact O-CB 3.14Å; G113-Q117 PolarHBondContact O-N 3.29Å |
| 114 | L | 92.3 | Very high | 88.7 | Confident | 55 Ų | 55 | 45.4 Ų | 45.4 | 29% | 0.288 | 24% | 0.236 | S | C | . | . | H | α-helix | trans | -67.1 | -42.9 | 175.3 | -65.4 | 177.6 | 0 | 0 | 0 | 111.3 | C55 C58 L110 S111 Y116 Q117 A118 | C55-L114 HydrophobicContact CB-CD2 3.81Å; C55-L114 WeakPolarHBondContact O-CD2 3.35Å; C58-L114 HydrophobicContact CB-CD2 4.21Å; L110-L114 HydrophobicContact CD1-CD2 4.44Å; L110-L114 HydrophobicContact CD1-CG 4.23Å; L110-L114 HydrophobicContact CG-CD1 4.27Å; L110-L114 HydrophobicContact CG-CG 4.38Å; L110-L114 WeakPolarHBondContact O-CG 3.49Å; L110-L114 PolarHBondContact O-N 2.88Å; S111-L114 PolarHBondContact O-N 3.28Å; L114-Y116 VanDerWaalsContact C-N 3.34Å; L114-Q117 PolarHBondContact O-N 2.93Å; L114-A118 WeakPolarHBondContact O-CB 3.35Å; L114-A118 PolarHBondContact O-N 3.37Å |
| 115 | I | 92.1 | Very high | 88.2 | Confident | 76 Ų | 76 | 36.1 Ų | 36.1 | 39% | 0.39 | 20% | 0.204 | S | C | . | . | H | α-helix | trans | -59.6 | -48.1 | 173.8 | -66.1 | 165.5 | 0 | 0 | 0 | 109.9 | S111 A112 Q117 A118 V119 A161 V187 | S111-I115 WeakPolarHBondContact O-CG1 3.27Å; S111-I115 PolarHBondContact O-N 3.12Å; A112-I115 PolarHBondContact O-N 2.91Å; I115-Q117 VanDerWaalsContact C-N 3.32Å; I115-Q117 PolarHBondContact O-N 3.35Å; I115-A118 PolarHBondContact O-N 3.09Å; I115-V119 HydrophobicContact CG2-CG2 4.25Å; I115-V119 WeakPolarHBondContact O-CB 3.45Å; I115-V119 VanDerWaalsContact O-CG2 3.29Å; I115-V119 WeakPolarHBondContact O-CG2 3.29Å; I115-V119 PolarHBondContact O-N 3.27Å; I115-A161 HydrophobicContact CB-CB 4.33Å; I115-A161 HydrophobicContact CG2-CB 3.86Å; I115-V187 HydrophobicContact CD1-CG1 4.35Å |
| 116 | Y | 90.6 | Very high | 87.9 | Confident | 33 Ų | 33 | 38.4 Ų | 38.4 | 13% | 0.129 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -55.6 | -47.6 | 176 | 169.5 | -94 | 0 | 0 | 0 | 111.6 | A112 G113 L114 V119 M120 A158 Y162 | A112-Y116 WeakPolarHBondContact O-CB 3.48Å; A112-Y116 PolarHBondContact O-N 3.37Å; G113-Y116 WeakPolarHBondContact O-CB 3.36Å; G113-Y116 PolarHBondContact O-N 2.62Å; L114-Y116 VanDerWaalsContact C-N 3.34Å; Y116-V119 PolarHBondContact O-N 2.98Å; Y116-M120 HydrophobicContact CE2-CE 3.86Å; Y116-M120 WeakPolarHBondContact O-CB 3.47Å; Y116-M120 PolarHBondContact O-N 3.42Å; Y116-M120 WeakPolarHBondContact OH-CE 3.48Å; Y116-A158 HydrophobicContact CD2-CB 3.57Å; Y116-A158 HydrophobicContact CE2-CB 3.78Å; Y116-Y162 AromaticContact CD2-CD2 3.93Å; Y116-Y162 HydrophobicContact CD2-CD2 3.93Å; Y116-Y162 HydrophobicContact CD2-CG 4.3Å; Y116-Y162 HydrophobicContact CE1-CD2 4.38Å; Y116-Y162 AromaticContact CE2-CD2 3.68Å; Y116-Y162 HydrophobicContact CE2-CD2 3.68Å; Y116-Y162 HydrophobicContact CE2-CG 4.14Å; Y116-Y162 HydrophobicContact CG-CD2 4.36Å; Y116-Y162 AromaticContact CZ-CD2 3.92Å |
| 117 | Q | 88.1 | Confident | 87.6 | Confident | 32 Ų | 32 | 38.5 Ų | 38.5 | 15% | 0.15 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -65.4 | -42.5 | -178.8 | -167 | 64.6 | 17.2 | 0 | 0 | 111.6 | C54 G113 L114 I115 N121 | C54-Q117 HydrophobicContact CB-CG 3.93Å; G113-Q117 WeakPolarHBondContact O-CB 3.14Å; G113-Q117 PolarHBondContact O-N 3.29Å; L114-Q117 PolarHBondContact O-N 2.93Å; I115-Q117 VanDerWaalsContact C-N 3.32Å; I115-Q117 PolarHBondContact O-N 3.35Å; Q117-N121 VanDerWaalsContact CD-ND2 3.28Å; Q117-N121 WeakPolarHBondContact CG-ND2 3.49Å; Q117-N121 PolarHBondContact NE2-ND2 2.96Å; Q117-N121 WeakPolarHBondContact O-CB 3.4Å; Q117-N121 PolarHBondContact O-N 3.19Å; Q117-N121 PolarHBondContact O-ND2 2.95Å |
| 118 | A | 87.6 | Confident | 86.8 | Confident | 54 Ų | 54 | 36.9 Ų | 36.9 | 45% | 0.446 | 22% | 0.221 | S | C | . | . | H | α-helix | trans | -62 | -49.5 | 177.3 | 0 | 0 | 0 | 0 | 0 | 111.7 | L114 I115 G122 | L114-A118 WeakPolarHBondContact O-CB 3.35Å; L114-A118 PolarHBondContact O-N 3.37Å; I115-A118 PolarHBondContact O-N 3.09Å; A118-G122 PolarHBondContact O-N 2.96Å |
| 119 | V | 89.9 | Confident | 86.2 | Confident | 49 Ų | 49 | 37 Ų | 37 | 30% | 0.297 | 23% | 0.23 | S | C | . | . | H | α-helix | trans | -65.3 | -47.8 | -179.6 | 174.6 | 0 | 0 | 0 | 0 | 111.1 | I115 Y116 N121 G122 V123 I157 A158 | I115-V119 HydrophobicContact CG2-CG2 4.25Å; I115-V119 WeakPolarHBondContact O-CB 3.45Å; I115-V119 VanDerWaalsContact O-CG2 3.29Å; I115-V119 WeakPolarHBondContact O-CG2 3.29Å; I115-V119 PolarHBondContact O-N 3.27Å; Y116-V119 PolarHBondContact O-N 2.98Å; V119-N121 PolarHBondContact O-N 3.44Å; V119-G122 PolarHBondContact O-N 3.43Å; V119-V123 HydrophobicContact CG1-CG2 4.31Å; V119-V123 WeakPolarHBondContact O-CG2 3.48Å; V119-V123 PolarHBondContact O-N 3.44Å; V119-I157 HydrophobicContact CG1-CB 4.46Å; V119-I157 HydrophobicContact CG1-CG2 3.7Å; V119-A158 HydrophobicContact CB-CB 4.26Å; V119-A158 HydrophobicContact CG1-CB 3.93Å |
| 120 | M | 85.4 | Confident | 85.9 | Confident | 15 Ų | 15 | 40.1 Ų | 40.1 | 7% | 0.074 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -58.5 | -48.3 | -179.8 | 176.2 | 62.9 | 81.3 | 0 | 0 | 111.7 | Y116 R124 G154 A155 A158 | Y116-M120 HydrophobicContact CE2-CE 3.86Å; Y116-M120 WeakPolarHBondContact O-CB 3.47Å; Y116-M120 PolarHBondContact O-N 3.42Å; Y116-M120 WeakPolarHBondContact OH-CE 3.48Å; M120-R124 VanDerWaalsContact O-CB 3.27Å; M120-R124 WeakPolarHBondContact O-CB 3.34Å; M120-R124 PolarHBondContact O-N 3.42Å; M120-G154 VanDerWaalsContact SD-C 3.5Å; M120-A155 HydrophobicContact CE-CB 4.01Å; M120-A158 HydrophobicContact CB-CB 4.28Å; M120-A158 HydrophobicContact CE-CB 4.46Å |
| 121 | N | 84 | Confident | 85.2 | Confident | 4 Ų | 4 | 39.7 Ų | 39.7 | 2% | 0.021 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -68.8 | -41.2 | 179.3 | -70.1 | -67.3 | 0 | 0 | 0 | 111.5 | A51 Q117 V119 V123 R124 L125 | A51-N121 HydrophobicContact CB-CB 3.86Å; Q117-N121 VanDerWaalsContact CD-ND2 3.28Å; Q117-N121 WeakPolarHBondContact CG-ND2 3.49Å; Q117-N121 PolarHBondContact NE2-ND2 2.96Å; Q117-N121 WeakPolarHBondContact O-CB 3.4Å; Q117-N121 PolarHBondContact O-N 3.19Å; Q117-N121 PolarHBondContact O-ND2 2.95Å; V119-N121 PolarHBondContact O-N 3.44Å; N121-V123 PolarHBondContact O-N 2.86Å; N121-R124 PolarHBondContact O-N 3.42Å; N121-R124 PolarHBondContact OD1-NH2 3.32Å; N121-L125 WeakPolarHBondContact O-CD1 3.36Å; N121-L125 WeakPolarHBondContact O-CG 3.3Å; N121-L125 PolarHBondContact O-N 3.36Å |
| 122 | G | 83.7 | Confident | 84.4 | Confident | 43 Ų | 43 | 39.8 Ų | 39.8 | 44% | 0.443 | 25% | 0.245 | S | C | . | . | H | α-helix | trans | -57.9 | -48.8 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112.6 | A118 V119 L125 G126 | A118-G122 PolarHBondContact O-N 2.96Å; V119-G122 PolarHBondContact O-N 3.43Å; G122-L125 PolarHBondContact O-N 3.03Å; G122-G126 PolarHBondContact O-N 3.01Å |
| 123 | V | 86.1 | Confident | 83.8 | Confident | 26 Ų | 26 | 44.9 Ų | 44.9 | 16% | 0.158 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -65.7 | -42.2 | 178.3 | 174.4 | 0 | 0 | 0 | 0 | 111.4 | V119 N121 L125 G126 S127 L153 I157 | V119-V123 HydrophobicContact CG1-CG2 4.31Å; V119-V123 WeakPolarHBondContact O-CG2 3.48Å; V119-V123 PolarHBondContact O-N 3.44Å; N121-V123 PolarHBondContact O-N 2.86Å; V123-L125 VanDerWaalsContact C-N 3.29Å; V123-L125 PolarHBondContact O-N 3.3Å; V123-G126 PolarHBondContact O-N 3.23Å; V123-S127 WeakPolarHBondContact O-CB 3.31Å; V123-S127 PolarHBondContact O-N 2.89Å; V123-S127 PolarHBondContact O-OG 3.26Å; V123-L153 HydrophobicContact CG1-CB 4.26Å; V123-I157 HydrophobicContact CG1-CD1 3.92Å; V123-I157 HydrophobicContact CG2-CB 4.09Å; V123-I157 HydrophobicContact CG2-CD1 3.76Å; V123-I157 HydrophobicContact CG2-CG1 4.5Å; V123-I157 HydrophobicContact CG2-CG2 3.99Å |
| 124 | R | 79.6 | Confident | 83.5 | Confident | 88 Ų | 88 | 50.6 Ų | 50.6 | 33% | 0.332 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -58.6 | -43.7 | 178.5 | -173.3 | 178.7 | 70.3 | -161.3 | -2 | 111.3 | M120 N121 Y128 A150 | M120-R124 VanDerWaalsContact O-CB 3.27Å; M120-R124 WeakPolarHBondContact O-CB 3.34Å; M120-R124 PolarHBondContact O-N 3.42Å; N121-R124 PolarHBondContact O-N 3.42Å; N121-R124 PolarHBondContact OD1-NH2 3.32Å; R124-Y128 WeakPolarHBondContact O-CB 3.47Å; R124-Y128 PolarHBondContact O-N 3.14Å; R124-A150 HydrophobicContact CG-CB 4.37Å |
| 125 | L | 76.4 | Confident | 82.8 | Confident | 35 Ų | 35 | 49.4 Ų | 49.4 | 18% | 0.183 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -67.3 | -51.8 | 178.9 | -66.2 | 168 | 0 | 0 | 0 | 111.8 | F47 N121 G122 V123 S127 Y128 S129 | F47-L125 HydrophobicContact CB-CD1 3.62Å; F47-L125 HydrophobicContact CB-CD2 3.67Å; F47-L125 HydrophobicContact CB-CG 4.28Å; F47-L125 HydrophobicContact CD1-CD2 3.32Å; F47-L125 HydrophobicContact CD2-CD2 3.88Å; F47-L125 HydrophobicContact CE1-CD2 3.82Å; F47-L125 HydrophobicContact CE2-CD2 4.35Å; F47-L125 HydrophobicContact CG-CD1 4.29Å; F47-L125 HydrophobicContact CG-CD2 3.36Å; F47-L125 HydrophobicContact CG-CG 4.44Å; F47-L125 HydrophobicContact CZ-CD2 4.31Å; N121-L125 WeakPolarHBondContact O-CD1 3.36Å; N121-L125 WeakPolarHBondContact O-CG 3.3Å; N121-L125 PolarHBondContact O-N 3.36Å; G122-L125 PolarHBondContact O-N 3.03Å; V123-L125 VanDerWaalsContact C-N 3.29Å; V123-L125 PolarHBondContact O-N 3.3Å; L125-S127 VanDerWaalsContact C-N 3.28Å; L125-S127 PolarHBondContact O-N 3.39Å; L125-Y128 PolarHBondContact O-N 3.34Å; L125-S129 PolarHBondContact O-N 3.41Å; L125-S129 PolarHBondContact O-OG 2.83Å |
| 126 | G | 80.3 | Confident | 82 | Confident | 48 Ų | 48 | 49 Ų | 49 | 50% | 0.495 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -59 | -41.8 | 179.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | G122 V123 C130 | G122-G126 PolarHBondContact O-N 3.01Å; V123-G126 PolarHBondContact O-N 3.23Å; G126-C130 WeakPolarHBondContact O-CB 3.35Å; G126-C130 PolarHBondContact O-N 3.29Å; G126-C130 VanDerWaalsContact O-N 3.09Å |
| 127 | S | 82.8 | Confident | 81.2 | Confident | 22 Ų | 22 | 48.2 Ų | 48.2 | 15% | 0.154 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -68.8 | -42.3 | 178.5 | -54 | 0 | 0 | 0 | 0 | 111.8 | V123 L125 C130 C131 | V123-S127 WeakPolarHBondContact O-CB 3.31Å; V123-S127 PolarHBondContact O-N 2.89Å; V123-S127 PolarHBondContact O-OG 3.26Å; L125-S127 VanDerWaalsContact C-N 3.28Å; L125-S127 PolarHBondContact O-N 3.39Å; S127-C130 WeakPolarHBondContact O-CB 3.08Å; S127-C130 PolarHBondContact O-N 3.26Å; S127-C131 PolarHBondContact O-N 2.71Å; S127-C131 PolarHBondContact O-SG 3.27Å; S127-C131 VanDerWaalsContact O-SG 3.33Å |
| 128 | Y | 77.3 | Confident | 80.4 | Confident | 26 Ų | 26 | 50.9 Ų | 50.9 | 10% | 0.102 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -64.7 | -45.9 | 178 | -172.3 | -95.5 | 0 | 0 | 0 | 111.9 | A26 R124 L125 C130 C131 D132 T137 | A26-Y128 HydrophobicContact CB-CD1 4.38Å; A26-Y128 HydrophobicContact CB-CE1 4.3Å; R124-Y128 WeakPolarHBondContact O-CB 3.47Å; R124-Y128 PolarHBondContact O-N 3.14Å; L125-Y128 PolarHBondContact O-N 3.34Å; Y128-C130 VanDerWaalsContact C-N 3.27Å; Y128-C130 PolarHBondContact O-N 3.24Å; Y128-C131 PolarHBondContact O-N 2.95Å; Y128-C131 VanDerWaalsContact O-N 3.17Å; Y128-D132 WeakPolarHBondContact O-CB 3.18Å; Y128-D132 PolarHBondContact O-N 2.88Å; Y128-T137 HydrophobicContact CE2-CG2 4.24Å |
| 129 | S | 78.1 | Confident | 79.9 | Confident | 65 Ų | 65 | 55.6 Ų | 55.6 | 46% | 0.455 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -60.6 | -36.2 | 176 | -65.7 | 0 | 0 | 0 | 0 | 112.5 | L125 S133 | L125-S129 PolarHBondContact O-N 3.41Å; L125-S129 PolarHBondContact O-OG 2.83Å; S129-S133 WeakPolarHBondContact O-CB 3.38Å; S129-S133 PolarHBondContact O-N 3.41Å; S129-S133 PolarHBondContact O-OG 3.39Å |
| 130 | C | 81.9 | Confident | 79.1 | Confident | 71 Ų | 71 | 63.4 Ų | 63.4 | 48% | 0.48 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -65.5 | -48.2 | 173.2 | -173.7 | 0 | 0 | 0 | 0 | 111.5 | G126 S127 Y128 D132 S133 L134 | G126-C130 WeakPolarHBondContact O-CB 3.35Å; G126-C130 PolarHBondContact O-N 3.29Å; G126-C130 VanDerWaalsContact O-N 3.09Å; S127-C130 WeakPolarHBondContact O-CB 3.08Å; S127-C130 PolarHBondContact O-N 3.26Å; Y128-C130 VanDerWaalsContact C-N 3.27Å; Y128-C130 PolarHBondContact O-N 3.24Å; C130-D132 VanDerWaalsContact C-N 3.3Å; C130-D132 PolarHBondContact O-N 3.11Å; C130-S133 PolarHBondContact O-N 2.95Å; C130-L134 VanDerWaalsContact O-CG 3.28Å; C130-L134 WeakPolarHBondContact O-CG 3.23Å; C130-L134 PolarHBondContact O-N 3.29Å |
| 131 | C | 79.3 | Confident | 78.4 | Confident | 27 Ų | 27 | 64.6 Ų | 64.6 | 18% | 0.182 | 39% | 0.394 | C | S | . | . | H | α-helix | trans | -61.8 | -36.9 | 177.4 | -70 | 0 | 0 | 0 | 0 | 113.2 | S127 Y128 L134 G135 I136 | S127-C131 PolarHBondContact O-N 2.71Å; S127-C131 PolarHBondContact O-SG 3.27Å; S127-C131 VanDerWaalsContact O-SG 3.33Å; Y128-C131 PolarHBondContact O-N 2.95Å; Y128-C131 VanDerWaalsContact O-N 3.17Å; C131-L134 PolarHBondContact O-N 2.96Å; C131-G135 PolarHBondContact O-N 2.73Å; C131-I136 WeakPolarHBondContact O-CB 3.36Å; C131-I136 PolarHBondContact O-N 2.87Å; C131-I136 VanDerWaalsContact O-N 3.08Å |
| 132 | D | 75.8 | Confident | 78.1 | Confident | 66 Ų | 66 | 64.5 Ų | 64.5 | 35% | 0.353 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -68 | -43.7 | 176.3 | -164.8 | 56.9 | 0 | 0 | 0 | 111.1 | Y128 C130 L134 G135 T137 | Y128-D132 WeakPolarHBondContact O-CB 3.18Å; Y128-D132 PolarHBondContact O-N 2.88Å; C130-D132 VanDerWaalsContact C-N 3.3Å; C130-D132 PolarHBondContact O-N 3.11Å; D132-L134 PolarHBondContact O-N 3.31Å; D132-G135 PolarHBondContact O-N 2.72Å; D132-T137 HydrophobicContact CB-CG2 4.05Å; D132-T137 WeakPolarHBondContact OD1-CB 3.21Å; D132-T137 PolarHBondContact OD1-OG1 2.6Å |
| 133 | S | 79.3 | Confident | 77.5 | Confident | 107 Ų | 107 | 63.5 Ų | 63.5 | 75% | 0.748 | 38% | 0.381 | S | S | * | . | H | α-helix | trans | -63.3 | -27.8 | 175.5 | -57.3 | 0 | 0 | 0 | 0 | 113.1 | S129 C130 G135 | S129-S133 WeakPolarHBondContact O-CB 3.38Å; S129-S133 PolarHBondContact O-N 3.41Å; S129-S133 PolarHBondContact O-OG 3.39Å; C130-S133 PolarHBondContact O-N 2.95Å; S133-G135 VanDerWaalsContact C-N 3.29Å |
| 134 | L | 83.3 | Confident | 77 | Confident | 120 Ų | 120 | 65.7 Ų | 65.7 | 63% | 0.628 | 39% | 0.391 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -83.5 | -0.4 | 175.2 | -69 | 169.2 | 0 | 0 | 0 | 113.3 | C130 C131 D132 I136 | C130-L134 VanDerWaalsContact O-CG 3.28Å; C130-L134 WeakPolarHBondContact O-CG 3.23Å; C130-L134 PolarHBondContact O-N 3.29Å; C131-L134 PolarHBondContact O-N 2.96Å; D132-L134 PolarHBondContact O-N 3.31Å; L134-I136 HydrophobicContact CB-CD1 4.02Å; L134-I136 HydrophobicContact CB-CG1 4.01Å; L134-I136 HydrophobicContact CD1-CD1 4.24Å; L134-I136 PolarHBondContact O-N 2.9Å |
| 135 | G | 77.6 | Confident | 77 | Confident | 30 Ų | 30 | 67.5 Ų | 67.5 | 31% | 0.309 | 41% | 0.407 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 71.6 | 11.6 | -180 | 0 | 0 | 0 | 0 | 0 | 114.6 | C131 D132 S133 T137 A138 | C131-G135 PolarHBondContact O-N 2.73Å; D132-G135 PolarHBondContact O-N 2.72Å; S133-G135 VanDerWaalsContact C-N 3.29Å; G135-T137 VanDerWaalsContact C-N 3.27Å; G135-T137 PolarHBondContact O-N 2.91Å; G135-A138 WeakPolarHBondContact O-CB 3.38Å; G135-A138 PolarHBondContact O-N 3.06Å |
| 136 | I | 75.9 | Confident | 77.2 | Confident | 69 Ų | 69 | 66 Ų | 66 | 35% | 0.354 | 40% | 0.4 | S | S | . | . | G | 310 helix | trans | -69.3 | -30.4 | -178.4 | -60.8 | 172.8 | 0 | 0 | 0 | 110.5 | C131 L134 A138 G142 | C131-I136 WeakPolarHBondContact O-CB 3.36Å; C131-I136 PolarHBondContact O-N 2.87Å; C131-I136 VanDerWaalsContact O-N 3.08Å; L134-I136 HydrophobicContact CB-CD1 4.02Å; L134-I136 HydrophobicContact CB-CG1 4.01Å; L134-I136 HydrophobicContact CD1-CD1 4.24Å; L134-I136 PolarHBondContact O-N 2.9Å; I136-A138 PolarHBondContact O-N 3.26Å; I136-G142 WeakPolarHBondContact O-CA 3.31Å |
| 137 | T | 72.5 | Confident | 77.1 | Confident | 16 Ų | 16 | 65 Ų | 65 | 10% | 0.098 | 39% | 0.389 | C | S | . | . | G | 310 helix | trans | -67.8 | -20.1 | 177.4 | 51.7 | 0 | 0 | 0 | 0 | 113.5 | Y128 D132 G135 F139 S143 | Y128-T137 HydrophobicContact CE2-CG2 4.24Å; D132-T137 HydrophobicContact CB-CG2 4.05Å; D132-T137 WeakPolarHBondContact OD1-CB 3.21Å; D132-T137 PolarHBondContact OD1-OG1 2.6Å; G135-T137 VanDerWaalsContact C-N 3.27Å; G135-T137 PolarHBondContact O-N 2.91Å; T137-F139 VanDerWaalsContact C-N 3.35Å; T137-F139 PolarHBondContact O-N 2.96Å; T137-S143 PolarHBondContact O-OG 3.43Å |
| 138 | A | 71.9 | Confident | 77 | Confident | 87 Ų | 87 | 64.9 Ų | 64.9 | 72% | 0.719 | 39% | 0.389 | S | S | * | . | G | 310 helix | trans | -75.9 | -19.7 | -177.4 | 0 | 0 | 0 | 0 | 0 | 113.7 | G135 I136 | G135-A138 WeakPolarHBondContact O-CB 3.38Å; G135-A138 PolarHBondContact O-N 3.06Å; I136-A138 PolarHBondContact O-N 3.26Å |
| 139 | F | 77.9 | Confident | 77.3 | Confident | 154 Ų | 154 | 65.2 Ų | 65.2 | 68% | 0.675 | 40% | 0.401 | S | S | * | . | S | Bend | trans | -78.1 | 153.2 | 178.3 | -65 | -80.9 | 0 | 0 | 0 | 112.2 | T137 G141 G142 | T137-F139 VanDerWaalsContact C-N 3.35Å; T137-F139 PolarHBondContact O-N 2.96Å; F139-G141 PolarHBondContact O-N 2.65Å; F139-G142 PolarHBondContact O-N 2.92Å |
| 140 | H | 71.4 | Confident | 77.6 | Confident | 212 Ų | 212 | 62.2 Ų | 62.2 | 98% | 0.981 | 38% | 0.38 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -60.1 | 113.7 | 175 | -135.4 | 85.7 | 0 | 0 | 0 | 109.9 | G142 | H140-G142 VanDerWaalsContact C-N 3.32Š|
| 141 | G | 72 | Confident | 77.7 | Confident | 40 Ų | 40 | 59.1 Ų | 59.1 | 41% | 0.412 | 36% | 0.36 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 83 | -2.5 | -173.8 | 0 | 0 | 0 | 0 | 0 | 115.5 | F139 S143 L144 L145 | F139-G141 PolarHBondContact O-N 2.65Å; G141-S143 VanDerWaalsContact C-N 3.29Å; G141-S143 PolarHBondContact O-N 2.93Å; G141-L144 WeakPolarHBondContact O-CB 3.44Å; G141-L144 PolarHBondContact O-N 3.24Å; G141-L145 PolarHBondContact O-N 3.01Å |
| 142 | G | 76.2 | Confident | 78.1 | Confident | 3 Ų | 3 | 58.6 Ų | 58.6 | 3% | 0.031 | 36% | 0.357 | C | S | . | . | H | α-helix | trans | -60.8 | -34.4 | 178.4 | 0 | 0 | 0 | 0 | 0 | 113.9 | I136 F139 H140 L145 S146 | I136-G142 WeakPolarHBondContact O-CA 3.31Å; F139-G142 PolarHBondContact O-N 2.92Å; H140-G142 VanDerWaalsContact C-N 3.32Å; G142-L145 PolarHBondContact O-N 3.24Å; G142-S146 WeakPolarHBondContact O-CB 3.4Å; G142-S146 PolarHBondContact O-N 3.38Å; G142-S146 PolarHBondContact O-OG 3.39Å |
| 143 | S | 72.4 | Confident | 78.7 | Confident | 21 Ų | 21 | 59.6 Ų | 59.6 | 15% | 0.147 | 36% | 0.362 | C | S | . | . | H | α-helix | trans | -67.5 | -31.9 | 172.2 | -60.4 | 0 | 0 | 0 | 0 | 113.9 | M25 T137 G141 S146 G147 | M25-S143 WeakPolarHBondContact SD-CB 3.45Å; M25-S143 PolarHBondContact SD-OG 3.34Å; T137-S143 PolarHBondContact O-OG 3.43Å; G141-S143 VanDerWaalsContact C-N 3.29Å; G141-S143 PolarHBondContact O-N 2.93Å; S143-S146 VanDerWaalsContact CA-OG 3.25Å; S143-S146 WeakPolarHBondContact CA-OG 3.4Å; S143-S146 PolarHBondContact O-OG 3.01Å; S143-S146 VanDerWaalsContact O-OG 3.11Å; S143-G147 PolarHBondContact O-N 3.33Å |
| 144 | L | 75.1 | Confident | 79.2 | Confident | 72 Ų | 72 | 54.5 Ų | 54.5 | 38% | 0.377 | 33% | 0.326 | S | S | . | . | H | α-helix | trans | -71.9 | -44 | 173.9 | 171.1 | 60.5 | 0 | 0 | 0 | 110.3 | G141 G147 A148 L222 | G141-L144 WeakPolarHBondContact O-CB 3.44Å; G141-L144 PolarHBondContact O-N 3.24Å; L144-G147 PolarHBondContact O-N 3.01Å; L144-A148 VanDerWaalsContact O-CB 3.26Å; L144-A148 WeakPolarHBondContact O-CB 3.19Å; L144-A148 PolarHBondContact O-N 2.87Å; L144-L222 HydrophobicContact CB-CD2 3.99Å; L144-L222 HydrophobicContact CD1-CD2 3.69Å; L144-L222 HydrophobicContact CD2-CD2 4.21Å; L144-L222 HydrophobicContact CG-CD2 4.15Å |
| 145 | L | 79.9 | Confident | 79.3 | Confident | 127 Ų | 127 | 48.9 Ų | 48.9 | 67% | 0.665 | 30% | 0.297 | S | S | * | . | H | α-helix | trans | -63.8 | -45.2 | 177.7 | -70.5 | 173.7 | 0 | 0 | 0 | 112 | G141 G142 A148 G149 | G141-L145 PolarHBondContact O-N 3.01Å; G142-L145 PolarHBondContact O-N 3.24Å; L145-A148 PolarHBondContact O-N 2.73Å; L145-G149 PolarHBondContact O-N 3.47Å |
| 146 | S | 80.4 | Confident | 80 | Confident | 4 Ų | 4 | 50.5 Ų | 50.5 | 3% | 0.028 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -65.4 | -40.9 | 175.6 | 54.4 | 0 | 0 | 0 | 0 | 112 | G142 S143 A150 | G142-S146 WeakPolarHBondContact O-CB 3.4Å; G142-S146 PolarHBondContact O-N 3.38Å; G142-S146 PolarHBondContact O-OG 3.39Å; S143-S146 VanDerWaalsContact CA-OG 3.25Å; S143-S146 WeakPolarHBondContact CA-OG 3.4Å; S143-S146 PolarHBondContact O-OG 3.01Å; S143-S146 VanDerWaalsContact O-OG 3.11Å; S146-A150 WeakPolarHBondContact O-CB 3.34Å; S146-A150 PolarHBondContact O-N 2.86Å |
| 147 | G | 77.4 | Confident | 80.7 | Confident | 26 Ų | 26 | 51.7 Ų | 51.7 | 27% | 0.268 | 31% | 0.305 | S | S | . | . | H | α-helix | trans | -63.1 | -45.3 | 174.4 | 0 | 0 | 0 | 0 | 0 | 113 | S143 L144 G151 | S143-G147 PolarHBondContact O-N 3.33Å; L144-G147 PolarHBondContact O-N 3.01Å; G147-G151 PolarHBondContact O-N 3.28Å |
| 148 | A | 80.6 | Confident | 81.5 | Confident | 20 Ų | 20 | 51 Ų | 51 | 17% | 0.165 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -66.6 | -42.9 | 177.3 | 0 | 0 | 0 | 0 | 0 | 111.9 | L144 L145 G151 A152 | L144-A148 VanDerWaalsContact O-CB 3.26Å; L144-A148 WeakPolarHBondContact O-CB 3.19Å; L144-A148 PolarHBondContact O-N 2.87Å; L145-A148 PolarHBondContact O-N 2.73Å; A148-G151 PolarHBondContact O-N 2.93Å; A148-A152 WeakPolarHBondContact O-CB 3.34Å; A148-A152 PolarHBondContact O-N 3.49Å |
| 149 | G | 84.7 | Confident | 82.5 | Confident | 33 Ų | 33 | 46.8 Ų | 46.8 | 34% | 0.34 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -64.4 | -46.6 | 176 | 0 | 0 | 0 | 0 | 0 | 112.4 | L145 G151 A152 L153 | L145-G149 PolarHBondContact O-N 3.47Å; G149-G151 VanDerWaalsContact C-N 3.31Å; G149-G151 PolarHBondContact O-N 2.92Å; G149-A152 PolarHBondContact O-N 3.22Å; G149-L153 WeakPolarHBondContact O-CB 3.32Å; G149-L153 WeakPolarHBondContact O-CG 3.23Å; G149-L153 PolarHBondContact O-N 2.99Å |
| 150 | A | 84.8 | Confident | 83.2 | Confident | 2 Ų | 2 | 40.1 Ų | 40.1 | 2% | 0.017 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -61.1 | -39.9 | 174.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | R124 S146 G154 | R124-A150 HydrophobicContact CG-CB 4.37Å; S146-A150 WeakPolarHBondContact O-CB 3.34Å; S146-A150 PolarHBondContact O-N 2.86Å; A150-G154 PolarHBondContact O-N 3.19Å |
| 151 | G | 82.8 | Confident | 84.2 | Confident | 5 Ų | 5 | 30.3 Ų | 30.3 | 5% | 0.052 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -65.7 | -41.6 | 174.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | G147 A148 G149 G154 A155 | G147-G151 PolarHBondContact O-N 3.28Å; A148-G151 PolarHBondContact O-N 2.93Å; G149-G151 VanDerWaalsContact C-N 3.31Å; G149-G151 PolarHBondContact O-N 2.92Å; G151-G154 PolarHBondContact O-N 3.38Å; G151-A155 WeakPolarHBondContact O-CB 3.35Å; G151-A155 PolarHBondContact O-N 3.32Å |
| 152 | A | 87.3 | Confident | 85 | Confident | 16 Ų | 16 | 29 Ų | 29 | 13% | 0.132 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -65 | -45.5 | 176.3 | 0 | 0 | 0 | 0 | 0 | 111.7 | A148 G149 A155 L156 V211 | A148-A152 WeakPolarHBondContact O-CB 3.34Å; A148-A152 PolarHBondContact O-N 3.49Å; G149-A152 PolarHBondContact O-N 3.22Å; A152-A155 PolarHBondContact O-N 3.39Å; A152-L156 VanDerWaalsContact O-CG 3.3Å; A152-L156 WeakPolarHBondContact O-CG 3.48Å; A152-L156 PolarHBondContact O-N 2.74Å; A152-V211 HydrophobicContact CB-CG1 3.93Å |
| 153 | L | 89.9 | Confident | 85.8 | Confident | 87 Ų | 87 | 29.1 Ų | 29.1 | 46% | 0.455 | 18% | 0.176 | S | C | . | . | H | α-helix | trans | -62 | -42.8 | 173.6 | -71.3 | 174.7 | 0 | 0 | 0 | 111.6 | V123 G149 A155 L156 I157 | V123-L153 HydrophobicContact CG1-CB 4.26Å; G149-L153 WeakPolarHBondContact O-CB 3.32Å; G149-L153 WeakPolarHBondContact O-CG 3.23Å; G149-L153 PolarHBondContact O-N 2.99Å; L153-A155 VanDerWaalsContact C-N 3.33Å; L153-A155 PolarHBondContact O-N 3.5Å; L153-L156 HydrophobicContact CD2-CD1 4.33Å; L153-L156 WeakPolarHBondContact O-CB 3.37Å; L153-L156 PolarHBondContact O-N 3.24Å; L153-I157 WeakPolarHBondContact O-CG1 3.05Å; L153-I157 PolarHBondContact O-N 3.25Å |
| 154 | G | 88.3 | Confident | 86.7 | Confident | 0 Ų | 0 | 28.1 Ų | 28.1 | 0% | 0 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -59.4 | -42.9 | 173.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | M120 A150 G151 I157 A158 | M120-G154 VanDerWaalsContact SD-C 3.5Å; A150-G154 PolarHBondContact O-N 3.19Å; G151-G154 PolarHBondContact O-N 3.38Å; G154-I157 PolarHBondContact O-N 3Å; G154-A158 WeakPolarHBondContact O-CB 3.38Å; G154-A158 PolarHBondContact O-N 3Å |
| 155 | A | 87.3 | Confident | 87.6 | Confident | 2 Ų | 2 | 25.2 Ų | 25.2 | 2% | 0.017 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -65.9 | -37.2 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.5 | M120 G151 A152 L153 S159 A210 V211 V214 | M120-A155 HydrophobicContact CE-CB 4.01Å; G151-A155 WeakPolarHBondContact O-CB 3.35Å; G151-A155 PolarHBondContact O-N 3.32Å; A152-A155 PolarHBondContact O-N 3.39Å; L153-A155 VanDerWaalsContact C-N 3.33Å; L153-A155 PolarHBondContact O-N 3.5Å; A155-S159 WeakPolarHBondContact O-CA 3.37Å; A155-S159 VanDerWaalsContact O-CB 3.31Å; A155-S159 WeakPolarHBondContact O-CB 3.46Å; A155-S159 PolarHBondContact O-N 3.17Å; A155-A210 HydrophobicContact CB-CB 4.49Å; A155-V211 HydrophobicContact CB-CG2 4.38Å; A155-V214 HydrophobicContact CB-CB 4.46Å; A155-V214 HydrophobicContact CB-CG2 3.98Å |
| 156 | L | 90.8 | Very high | 88.1 | Confident | 65 Ų | 65 | 19.1 Ų | 19.1 | 34% | 0.34 | 12% | 0.122 | S | C | . | . | H | α-helix | trans | -64 | -52.6 | 174.8 | -73.4 | 161.2 | 0 | 0 | 0 | 110.6 | A152 L153 S159 W204 V207 V211 | A152-L156 VanDerWaalsContact O-CG 3.3Å; A152-L156 WeakPolarHBondContact O-CG 3.48Å; A152-L156 PolarHBondContact O-N 2.74Å; L153-L156 HydrophobicContact CD2-CD1 4.33Å; L153-L156 WeakPolarHBondContact O-CB 3.37Å; L153-L156 PolarHBondContact O-N 3.24Å; L156-S159 VanDerWaalsContact O-CB 3.31Å; L156-S159 WeakPolarHBondContact O-CB 3.43Å; L156-S159 PolarHBondContact O-N 3.34Å; L156-W204 PolarHBondContact O-NE1 3.34Å; L156-V207 HydrophobicContact CD2-CB 4.49Å; L156-V207 HydrophobicContact CD2-CG1 4.16Å; L156-V207 HydrophobicContact CD2-CG2 3.53Å; L156-V207 HydrophobicContact CG-CG2 4.23Å; L156-V211 HydrophobicContact CD2-CG2 4.15Å; L156-V211 HydrophobicContact CG-CG2 4Å |
| 157 | I | 91 | Very high | 88.6 | Confident | 93 Ų | 93 | 19.5 Ų | 19.5 | 48% | 0.477 | 12% | 0.123 | S | C | . | . | H | α-helix | trans | -69.5 | -37.3 | -176.8 | -62.8 | 177.1 | 0 | 0 | 0 | 111.5 | V119 V123 L153 G154 S159 P160 | V119-I157 HydrophobicContact CG1-CB 4.46Å; V119-I157 HydrophobicContact CG1-CG2 3.7Å; V123-I157 HydrophobicContact CG1-CD1 3.92Å; V123-I157 HydrophobicContact CG2-CB 4.09Å; V123-I157 HydrophobicContact CG2-CD1 3.76Å; V123-I157 HydrophobicContact CG2-CG1 4.5Å; V123-I157 HydrophobicContact CG2-CG2 3.99Å; L153-I157 WeakPolarHBondContact O-CG1 3.05Å; L153-I157 PolarHBondContact O-N 3.25Å; G154-I157 PolarHBondContact O-N 3Å; I157-S159 VanDerWaalsContact C-N 3.32Å; I157-S159 PolarHBondContact O-N 3.37Å; I157-P160 WeakPolarHBondContact O-CD 3.36Å |
| 158 | A | 90.4 | Very high | 89.2 | Confident | 1 Ų | 1 | 18.9 Ų | 18.9 | 1% | 0.008 | 11% | 0.114 | C | C | . | . | H | α-helix | trans | -83.4 | -4.4 | 179.4 | 0 | 0 | 0 | 0 | 0 | 113.9 | Y116 V119 M120 G154 P160 A161 Y162 | Y116-A158 HydrophobicContact CD2-CB 3.57Å; Y116-A158 HydrophobicContact CE2-CB 3.78Å; V119-A158 HydrophobicContact CB-CB 4.26Å; V119-A158 HydrophobicContact CG1-CB 3.93Å; M120-A158 HydrophobicContact CB-CB 4.28Å; M120-A158 HydrophobicContact CE-CB 4.46Å; G154-A158 WeakPolarHBondContact O-CB 3.38Å; G154-A158 PolarHBondContact O-N 3Å; A158-P160 VanDerWaalsContact C-CD 3.46Å; A158-A161 PolarHBondContact O-N 3.42Å; A158-Y162 PolarHBondContact O-N 2.95Å; A158-Y162 VanDerWaalsContact O-N 3.1Å |
| 159 | S | 91.4 | Very high | 89.6 | Confident | 0 Ų | 0 | 18 Ų | 18 | 0% | 0 | 11% | 0.106 | C | C | . | . | H | α-helix | trans | -52.4 | -43.7 | -177.5 | -175.5 | 0 | 0 | 0 | 0 | 113.7 | A155 L156 I157 A161 Y162 L163 Y272 | A155-S159 WeakPolarHBondContact O-CA 3.37Å; A155-S159 VanDerWaalsContact O-CB 3.31Å; A155-S159 WeakPolarHBondContact O-CB 3.46Å; A155-S159 PolarHBondContact O-N 3.17Å; L156-S159 VanDerWaalsContact O-CB 3.31Å; L156-S159 WeakPolarHBondContact O-CB 3.43Å; L156-S159 PolarHBondContact O-N 3.34Å; I157-S159 VanDerWaalsContact C-N 3.32Å; I157-S159 PolarHBondContact O-N 3.37Å; S159-A161 PolarHBondContact O-N 3.39Å; S159-Y162 CarbonylContact O-C 3.6Å; S159-Y162 WeakPolarHBondContact O-CB 3.44Å; S159-Y162 PolarHBondContact O-N 3.09Å; S159-Y162 VanDerWaalsContact O-N 3.09Å; S159-L163 PolarHBondContact O-N 3.35Å; S159-Y272 PolarHBondContact OG-OH 2.94Å |
| 160 | P | 92.2 | Very high | 89.8 | Confident | 13 Ų | 13 | 16.5 Ų | 16.5 | 8% | 0.084 | 9% | 0.09 | C | C | . | . | H | α-helix | trans | -62.1 | -39.8 | 179.6 | -24.7 | 36.1 | 0 | 0 | 0 | 113.8 | I157 A158 Y162 L163 V164 F191 L203 W204 | I157-P160 WeakPolarHBondContact O-CD 3.36Å; A158-P160 VanDerWaalsContact C-CD 3.46Å; P160-Y162 VanDerWaalsContact C-N 3.32Å; P160-L163 PolarHBondContact O-N 3.33Å; P160-V164 WeakPolarHBondContact O-CG2 3.2Å; P160-V164 PolarHBondContact O-N 2.91Å; P160-V164 VanDerWaalsContact O-N 3.1Å; P160-F191 HydrophobicContact CB-CE1 3.84Å; P160-L203 WeakPolarHBondContact CA-O 3.18Å; P160-L203 HydrophobicContact CB-CB 3.98Å; P160-L203 HydrophobicContact CB-CD2 4.02Å; P160-L203 HydrophobicContact CB-CG 4.28Å; P160-L203 HydrophobicContact CG-CB 4.02Å; P160-L203 HydrophobicContact CG-CD2 4.48Å; P160-W204 HydrophobicContact CG-CD2 4.04Å; P160-W204 HydrophobicContact CG-CE3 4.1Å; P160-W204 HydrophobicContact CG-CH2 3.87Å; P160-W204 HydrophobicContact CG-CZ2 3.77Å; P160-W204 HydrophobicContact CG-CZ3 4.03Å |
| 161 | A | 92.6 | Very high | 89.8 | Confident | 6 Ų | 6 | 16.9 Ų | 16.9 | 5% | 0.05 | 9% | 0.092 | C | C | . | . | H | α-helix | trans | -67.2 | -36.7 | 175.8 | 0 | 0 | 0 | 0 | 0 | 111.4 | I115 A158 S159 K165 F191 | I115-A161 HydrophobicContact CB-CB 4.33Å; I115-A161 HydrophobicContact CG2-CB 3.86Å; A158-A161 PolarHBondContact O-N 3.42Å; S159-A161 PolarHBondContact O-N 3.39Å; A161-K165 VanDerWaalsContact O-CB 3.24Å; A161-K165 WeakPolarHBondContact O-CB 3.18Å; A161-K165 PolarHBondContact O-N 3.33Å; A161-F191 HydrophobicContact CB-CZ 4.45Å |
| 162 | Y | 90.5 | Very high | 89.9 | Confident | 14 Ų | 14 | 17.2 Ų | 17.2 | 6% | 0.055 | 9% | 0.093 | C | C | . | . | H | α-helix | trans | -67.9 | -39.8 | 175.5 | -165.3 | -90.1 | 0 | 0 | 0 | 112.5 | Y116 A158 S159 P160 K165 T166 R213 Y272 | Y116-Y162 AromaticContact CD2-CD2 3.93Å; Y116-Y162 HydrophobicContact CD2-CD2 3.93Å; Y116-Y162 HydrophobicContact CD2-CG 4.3Å; Y116-Y162 HydrophobicContact CE1-CD2 4.38Å; Y116-Y162 AromaticContact CE2-CD2 3.68Å; Y116-Y162 HydrophobicContact CE2-CD2 3.68Å; Y116-Y162 HydrophobicContact CE2-CG 4.14Å; Y116-Y162 HydrophobicContact CG-CD2 4.36Å; Y116-Y162 AromaticContact CZ-CD2 3.92Å; A158-Y162 PolarHBondContact O-N 2.95Å; A158-Y162 VanDerWaalsContact O-N 3.1Å; S159-Y162 CarbonylContact O-C 3.6Å; S159-Y162 WeakPolarHBondContact O-CB 3.44Å; S159-Y162 PolarHBondContact O-N 3.09Å; S159-Y162 VanDerWaalsContact O-N 3.09Å; P160-Y162 VanDerWaalsContact C-N 3.32Å; Y162-K165 WeakPolarHBondContact O-CB 3.27Å; Y162-K165 PolarHBondContact O-N 3.07Å; Y162-T166 WeakPolarHBondContact CE1-OG1 3.4Å; Y162-T166 WeakPolarHBondContact O-CB 3.4Å; Y162-T166 PolarHBondContact O-N 3.46Å; Y162-T166 PolarHBondContact O-OG1 3.3Å; Y162-R213 VanDerWaalsContact CZ-NH1 3.33Å; Y162-R213 PolarHBondContact OH-NH1 2.88Å; Y162-Y272 HydrophobicContact CD1-CD1 4.38Å; Y162-Y272 AromaticContact CD1-CD2 3.54Å; Y162-Y272 HydrophobicContact CD1-CD2 3.54Å; Y162-Y272 HydrophobicContact CD1-CE1 4.19Å; Y162-Y272 AromaticContact CD1-CE2 3.33Å; Y162-Y272 HydrophobicContact CD1-CE2 3.33Å; Y162-Y272 HydrophobicContact CD1-CG 4.1Å; Y162-Y272 AromaticContact CD1-CZ 3.69Å; Y162-Y272 AromaticContact CE1-CD2 3.55Å; Y162-Y272 HydrophobicContact CE1-CD2 3.55Å; Y162-Y272 AromaticContact CE1-CE2 3.65Å; Y162-Y272 HydrophobicContact CE1-CE2 3.65Å; Y162-Y272 HydrophobicContact CE1-CG 4.31Å; Y162-Y272 HydrophobicContact CG-CE2 4.45Å |
| 163 | L | 91.6 | Very high | 89.5 | Confident | 4 Ų | 4 | 19.8 Ų | 19.8 | 2% | 0.021 | 11% | 0.107 | C | C | . | . | H | α-helix | trans | -58.8 | -54.3 | 174.3 | 174.3 | 69.5 | 0 | 0 | 0 | 110.7 | S159 P160 K165 T166 H167 I194 G202 Y272 | S159-L163 PolarHBondContact O-N 3.35Å; P160-L163 PolarHBondContact O-N 3.33Å; L163-K165 VanDerWaalsContact C-N 3.32Å; L163-K165 PolarHBondContact O-N 3.22Å; L163-T166 PolarHBondContact O-N 2.68Å; L163-T166 VanDerWaalsContact O-N 3.08Å; L163-H167 PolarHBondContact O-N 2.74Å; L163-I194 HydrophobicContact CD2-CD1 4.11Å; L163-I194 HydrophobicContact CD2-CG2 4.19Å; L163-I194 HydrophobicContact CG-CD1 4.34Å; L163-G202 VanDerWaalsContact CD2-O 3.27Å; L163-G202 WeakPolarHBondContact CD2-O 3.21Å; L163-Y272 HydrophobicContact CB-CD1 3.73Å; L163-Y272 HydrophobicContact CB-CE1 3.9Å; L163-Y272 HydrophobicContact CD1-CD1 3.6Å; L163-Y272 HydrophobicContact CD1-CE1 4.44Å; L163-Y272 HydrophobicContact CD1-CG 4.48Å; L163-Y272 WeakPolarHBondContact CD1-O 3.39Å; L163-Y272 HydrophobicContact CG-CD1 4.26Å |
| 164 | V | 92.3 | Very high | 88.9 | Confident | 1 Ų | 1 | 22.4 Ų | 22.4 | 1% | 0.006 | 12% | 0.121 | C | C | . | . | H | α-helix | trans | -60.7 | -42.4 | 179.7 | 171.4 | 0 | 0 | 0 | 0 | 111.5 | A112 P160 T166 H167 L168 V187 A190 F191 I194 | A112-V164 HydrophobicContact CB-CB 4.47Å; A112-V164 HydrophobicContact CB-CG1 4.09Å; P160-V164 WeakPolarHBondContact O-CG2 3.2Å; P160-V164 PolarHBondContact O-N 2.91Å; P160-V164 VanDerWaalsContact O-N 3.1Å; V164-T166 VanDerWaalsContact C-N 3.33Å; V164-T166 PolarHBondContact O-N 2.78Å; V164-H167 PolarHBondContact O-N 2.97Å; V164-L168 HydrophobicContact CG1-CD1 3.84Å; V164-L168 HydrophobicContact CG1-CG 4.4Å; V164-L168 WeakPolarHBondContact O-CG 3.44Å; V164-L168 PolarHBondContact O-N 3.01Å; V164-V187 HydrophobicContact CG1-CB 4.42Å; V164-V187 HydrophobicContact CG1-CG1 4.05Å; V164-V187 HydrophobicContact CG1-CG2 4.42Å; V164-A190 HydrophobicContact CB-CB 4.48Å; V164-A190 HydrophobicContact CG1-CB 3.64Å; V164-A190 HydrophobicContact CG2-CB 4.2Å; V164-F191 HydrophobicContact CB-CE2 4.18Å; V164-F191 HydrophobicContact CB-CZ 4.22Å; V164-F191 HydrophobicContact CG1-CD2 4.37Å; V164-F191 HydrophobicContact CG1-CE2 4.23Å; V164-F191 HydrophobicContact CG2-CD1 3.78Å; V164-F191 HydrophobicContact CG2-CD2 3.97Å; V164-F191 HydrophobicContact CG2-CE1 3.74Å; V164-F191 HydrophobicContact CG2-CE2 3.93Å; V164-F191 HydrophobicContact CG2-CG 3.9Å; V164-F191 HydrophobicContact CG2-CZ 3.81Å; V164-I194 HydrophobicContact CG2-CD1 3.97Å |
| 165 | K | 92.9 | Very high | 88.1 | Confident | 10 Ų | 10 | 26.2 Ų | 26.2 | 4% | 0.043 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -55 | -49.7 | 172.8 | 176.1 | -173.8 | -177.1 | 171.2 | 0 | 111.1 | E65 A112 A161 Y162 L163 H167 L168 Q169 | E65-K165 IonicContact OE1-NZ 2.62Å; E65-K165 WeakPolarHBondContact OE2-CE 3.49Å; E65-K165 IonicContact OE2-NZ 3.97Å; E65-K165 PolarHBondContact OE2-NZ 2.94Å; A112-K165 HydrophobicContact CB-CB 3.8Å; A161-K165 VanDerWaalsContact O-CB 3.24Å; A161-K165 WeakPolarHBondContact O-CB 3.18Å; A161-K165 PolarHBondContact O-N 3.33Å; Y162-K165 WeakPolarHBondContact O-CB 3.27Å; Y162-K165 PolarHBondContact O-N 3.07Å; L163-K165 VanDerWaalsContact C-N 3.32Å; L163-K165 PolarHBondContact O-N 3.22Å; K165-H167 PolarHBondContact O-N 3.15Å; K165-L168 PolarHBondContact O-N 3.41Å; K165-Q169 VanDerWaalsContact CE-NE2 3.26Å; K165-Q169 HydrophobicContact CG-CG 4.27Å; K165-Q169 WeakPolarHBondContact O-CB 3.1Å; K165-Q169 VanDerWaalsContact O-CG 3.24Å; K165-Q169 WeakPolarHBondContact O-CG 3.2Å; K165-Q169 PolarHBondContact O-N 3.23Å |
| 166 | T | 90.3 | Very high | 87.7 | Confident | 0 Ų | 0 | 26.7 Ų | 26.7 | 0% | 0 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -63.2 | -43.4 | -176.5 | -50.8 | 0 | 0 | 0 | 0 | 111.2 | Y162 L163 V164 Q169 A170 T269 N273 | Y162-T166 WeakPolarHBondContact CE1-OG1 3.4Å; Y162-T166 WeakPolarHBondContact O-CB 3.4Å; Y162-T166 PolarHBondContact O-N 3.46Å; Y162-T166 PolarHBondContact O-OG1 3.3Å; L163-T166 PolarHBondContact O-N 2.68Å; L163-T166 VanDerWaalsContact O-N 3.08Å; V164-T166 VanDerWaalsContact C-N 3.33Å; V164-T166 PolarHBondContact O-N 2.78Å; T166-Q169 PolarHBondContact O-N 2.82Å; T166-A170 WeakPolarHBondContact O-CB 3.34Å; T166-A170 PolarHBondContact O-N 2.83Å; T166-T269 HydrophobicContact CG2-CG2 4.07Å; T166-N273 HydrophobicContact CG2-CB 4.47Å |
| 167 | H | 91.6 | Very high | 86.9 | Confident | 11 Ų | 11 | 25 Ų | 25 | 5% | 0.051 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -60.2 | -46.9 | 175.7 | -72.8 | -177.4 | 0 | 0 | 0 | 112.6 | L163 V164 K165 A170 Q171 H182 H184 Y272 | L163-H167 PolarHBondContact O-N 2.74Å; V164-H167 PolarHBondContact O-N 2.97Å; K165-H167 PolarHBondContact O-N 3.15Å; H167-A170 PolarHBondContact O-N 3.43Å; H167-Q171 VanDerWaalsContact O-CG 3.25Å; H167-Q171 WeakPolarHBondContact O-CG 3.37Å; H167-Q171 PolarHBondContact O-N 3.26Å; H167-H182 HydrophobicContact CB-CB 4.5Å; H167-H182 AromaticContact CD2-CE1 3.61Å; H167-H182 AromaticContact CD2-ND1 3.51Å; H167-H182 AromaticContact CE1-CD2 3.91Å; H167-H182 AromaticContact CE1-CE1 3.8Å; H167-H182 AromaticContact CE1-CG 3.98Å; H167-H182 AromaticContact CE1-ND1 3.95Å; H167-H182 AromaticContact CE1-NE2 3.85Å; H167-H182 AromaticContact CG-ND1 3.77Å; H167-H182 AromaticContact ND1-CG 3.96Å; H167-H182 AromaticContact NE2-CE1 3.31Å; H167-H182 PolarHBondContact NE2-CE1 3.42Å; H167-H182 VanDerWaalsContact NE2-CE1 3.31Å; H167-H182 AromaticContact NE2-ND1 3.63Å; H167-H182 AromaticContact NE2-NE2 3.72Å; H167-H184 AromaticContact ND1-NE2 3.46Å; H167-H184 PolarHBondContact ND1-NE2 3.12Å; H167-Y272 PolarHBondContact NE2-O 3.08Å |
| 168 | L | 89.4 | Confident | 86.2 | Confident | 14 Ų | 14 | 21 Ų | 21 | 7% | 0.073 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -68.6 | -35.2 | -179.6 | -69 | 172.1 | 0 | 0 | 0 | 112.3 | K108 V164 K165 Q171 H184 V187 | K108-L168 WeakPolarHBondContact CB-O 3.19Å; K108-L168 WeakPolarHBondContact CD-O 3.32Å; V164-L168 HydrophobicContact CG1-CD1 3.84Å; V164-L168 HydrophobicContact CG1-CG 4.4Å; V164-L168 WeakPolarHBondContact O-CG 3.44Å; V164-L168 PolarHBondContact O-N 3.01Å; K165-L168 PolarHBondContact O-N 3.41Å; L168-Q171 PolarHBondContact O-N 3.4Å; L168-H184 HydrophobicContact CD2-CB 3.89Å; L168-V187 HydrophobicContact CD1-CB 4.37Å; L168-V187 HydrophobicContact CD1-CG2 3.45Å; L168-V187 VanDerWaalsContact CD1-CG2 3.45Å |
| 169 | Q | 90.3 | Very high | 85.7 | Confident | 2 Ų | 2 | 22.5 Ų | 22.5 | 1% | 0.009 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -72.5 | -32.7 | 178.4 | -70.4 | -175.7 | -27.5 | 0 | 0 | 112.5 | N62 V66 T69 R70 K108 K165 T166 Q171 | N62-Q169 PolarHBondContact OD1-NE2 2.86Å; V66-Q169 HydrophobicContact CG2-CB 4.39Å; V66-Q169 HydrophobicContact CG2-CG 3.97Å; T69-Q169 HydrophobicContact CG2-CB 4.13Å; T69-Q169 VanDerWaalsContact CG2-OE1 3.25Å; T69-Q169 WeakPolarHBondContact OG1-CB 3.28Å; R70-Q169 PolarHBondContact NE-O 3.23Å; K108-Q169 WeakPolarHBondContact O-CG 3.49Å; K165-Q169 VanDerWaalsContact CE-NE2 3.26Å; K165-Q169 HydrophobicContact CG-CG 4.27Å; K165-Q169 WeakPolarHBondContact O-CB 3.1Å; K165-Q169 VanDerWaalsContact O-CG 3.24Å; K165-Q169 WeakPolarHBondContact O-CG 3.2Å; K165-Q169 PolarHBondContact O-N 3.23Å; T166-Q169 PolarHBondContact O-N 2.82Å; Q169-Q171 VanDerWaalsContact C-N 3.3Å |
| 170 | A | 88.2 | Confident | 85.2 | Confident | 0 Ų | 0 | 25.7 Ų | 25.7 | 0% | 0 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -71.2 | -24.5 | 173.6 | 0 | 0 | 0 | 0 | 0 | 113 | L73 T166 H167 Q181 N273 | L73-A170 HydrophobicContact CD1-CB 3.52Å; T166-A170 WeakPolarHBondContact O-CB 3.34Å; T166-A170 PolarHBondContact O-N 2.83Å; H167-A170 PolarHBondContact O-N 3.43Å; A170-Q181 PolarHBondContact O-NE2 2.89Å; A170-Q181 PolarHBondContact O-OE1 3.16Å; A170-N273 WeakPolarHBondContact CB-OD1 3.41Å |
| 171 | Q | 85.9 | Confident | 84.8 | Confident | 11 Ų | 11 | 26.7 Ų | 26.7 | 5% | 0.051 | 16% | 0.163 | C | C | . | . | trans | -70.6 | 128.6 | -176.4 | -82.1 | 167.6 | 10.1 | 0 | 0 | 113.8 | R70 K108 H167 L168 Q169 H184 | R70-Q171 PolarHBondContact NH2-O 2.98Å; R70-Q171 VanDerWaalsContact NH2-O 3.07Å; K108-Q171 WeakPolarHBondContact CD-O 3.11Å; K108-Q171 PolarHBondContact NZ-O 3.39Å; H167-Q171 VanDerWaalsContact O-CG 3.25Å; H167-Q171 WeakPolarHBondContact O-CG 3.37Å; H167-Q171 PolarHBondContact O-N 3.26Å; L168-Q171 PolarHBondContact O-N 3.4Å; Q169-Q171 VanDerWaalsContact C-N 3.3Å; Q171-H184 PolarHBondContact NE2-CD2 3.16Å; Q171-H184 PolarHBondContact OE1-O 2.86Å | ||
| 172 | T | 84.3 | Confident | 84.2 | Confident | 12 Ų | 12 | 27.9 Ų | 27.9 | 7% | 0.074 | 17% | 0.168 | C | C | . | . | trans | -159 | 174.3 | 179.5 | -170.6 | 0 | 0 | 0 | 0 | 111.3 | R70 D101 I176 A177 | R70-T172 VanDerWaalsContact NH1-CB 3.31Å; R70-T172 PolarHBondContact NH1-OG1 3.41Å; D101-T172 PolarHBondContact OD1-OG1 2.94Å; D101-T172 WeakPolarHBondContact OD2-CB 3.49Å; D101-T172 PolarHBondContact OD2-OG1 2.86Å; T172-I176 HydrophobicContact CG2-CG1 3.88Å; T172-I176 WeakPolarHBondContact CG2-O 3.4Å; T172-I176 WeakPolarHBondContact OG1-CD1 3.21Å; T172-I176 WeakPolarHBondContact OG1-CG1 3.09Å; T172-A177 VanDerWaalsContact CG2-CA 3.45Å; T172-A177 HydrophobicContact CG2-CB 4.14Å | ||
| 173 | V | 78.6 | Confident | 83.7 | Confident | 70 Ų | 70 | 33.1 Ų | 33.1 | 42% | 0.424 | 20% | 0.197 | S | C | . | . | trans | -63 | 145.6 | 174.8 | -62.8 | 0 | 0 | 0 | 0 | 111 | D101 A175 I176 A177 | D101-V173 PolarHBondContact OD1-N 3.02Å; V173-A175 HydrophobicContact CG2-CB 4.46Å; V173-A175 PolarHBondContact O-N 3.17Å; V173-I176 HydrophobicContact CG2-CD1 4.28Å; V173-I176 HydrophobicContact CG2-CG1 3.77Å; V173-I176 PolarHBondContact O-N 3.28Å; V173-A177 PolarHBondContact O-N 3.03Å; V173-A177 VanDerWaalsContact O-N 3.16Å | ||
| 174 | D | 77.5 | Confident | 83.3 | Confident | 142 Ų | 142 | 33.8 Ų | 33.8 | 76% | 0.759 | 20% | 0.2 | S | C | * | . | G | 310 helix | trans | -53.9 | -30.9 | -173.7 | -66.3 | -32.7 | 0 | 0 | 0 | 113.5 | I176 A177 | D174-I176 PolarHBondContact O-N 3.45Å; D174-A177 PolarHBondContact O-N 3.48Å |
| 175 | A | 70.8 | Confident | 82.7 | Confident | 79 Ų | 79 | 41.7 Ų | 41.7 | 65% | 0.653 | 24% | 0.241 | S | C | * | . | G | 310 helix | trans | -61.6 | -21.8 | 178.1 | 0 | 0 | 0 | 0 | 0 | 114.7 | H86 V173 | H86-A175 PolarHBondContact CD2-O 3.36Å; V173-A175 HydrophobicContact CG2-CB 4.46Å; V173-A175 PolarHBondContact O-N 3.17Å |
| 176 | I | 78.3 | Confident | 82.4 | Confident | 13 Ų | 13 | 42.3 Ų | 42.3 | 7% | 0.067 | 25% | 0.25 | C | C | . | . | G | 310 helix | trans | -132.9 | 17.7 | 179 | 62.4 | 167.6 | 0 | 0 | 0 | 112.5 | Y87 V96 T100 T172 V173 D174 | Y87-I176 WeakPolarHBondContact OH-CD1 3.45Å; Y87-I176 PolarHBondContact OH-O 2.9Å; V96-I176 HydrophobicContact CG1-CD1 4.2Å; V96-I176 HydrophobicContact CG1-CG2 3.94Å; T100-I176 HydrophobicContact CG2-CD1 4.37Å; T100-I176 WeakPolarHBondContact OG1-CD1 3.35Å; T172-I176 HydrophobicContact CG2-CG1 3.88Å; T172-I176 WeakPolarHBondContact CG2-O 3.4Å; T172-I176 WeakPolarHBondContact OG1-CD1 3.21Å; T172-I176 WeakPolarHBondContact OG1-CG1 3.09Å; V173-I176 HydrophobicContact CG2-CD1 4.28Å; V173-I176 HydrophobicContact CG2-CG1 3.77Å; V173-I176 PolarHBondContact O-N 3.28Å; D174-I176 PolarHBondContact O-N 3.45Å |
| 177 | A | 75 | Confident | 82.3 | Confident | 29 Ų | 29 | 43.4 Ų | 43.4 | 24% | 0.24 | 26% | 0.256 | C | S | . | . | trans | -66.6 | 133.9 | -179.1 | 0 | 0 | 0 | 0 | 0 | 111.7 | T172 V173 D174 Q181 | T172-A177 VanDerWaalsContact CG2-CA 3.45Å; T172-A177 HydrophobicContact CG2-CB 4.14Å; V173-A177 PolarHBondContact O-N 3.03Å; V173-A177 VanDerWaalsContact O-N 3.16Å; D174-A177 PolarHBondContact O-N 3.48Å; A177-Q181 HydrophobicContact CB-CG 3.89Å | ||
| 178 | V | 76.9 | Confident | 82.2 | Confident | 10 Ų | 10 | 47.3 Ų | 47.3 | 6% | 0.061 | 29% | 0.285 | C | S | . | . | trans | -136.2 | 142.6 | 178.8 | -70.2 | 0 | 0 | 0 | 0 | 109.5 | R70 L73 Q74 Y87 Q181 | R70-V178 HydrophobicContact CB-CG2 3.8Å; R70-V178 HydrophobicContact CG-CG2 4.11Å; R70-V178 WeakPolarHBondContact O-CG2 3.12Å; L73-V178 HydrophobicContact CB-CG2 4.39Å; Q74-V178 HydrophobicContact CB-CB 4.48Å; Q74-V178 HydrophobicContact CB-CG1 4.05Å; Q74-V178 HydrophobicContact CG-CG1 4.11Å; Y87-V178 HydrophobicContact CD2-CG1 4.18Å; Y87-V178 HydrophobicContact CE2-CG1 3.79Å; Y87-V178 HydrophobicContact CE2-CG2 3.95Å; V178-Q181 PolarHBondContact O-NE2 3.21Å | ||
| 179 | G | 79 | Confident | 82.2 | Confident | 31 Ų | 31 | 49 Ų | 49 | 32% | 0.32 | 29% | 0.294 | S | S | . | . | S | Bend | trans | 62.4 | -171.7 | -169 | 0 | 0 | 0 | 0 | 0 | 112.6 | ||
| 180 | H | 80.4 | Confident | 82.1 | Confident | 68 Ų | 68 | 48.9 Ų | 48.9 | 32% | 0.315 | 29% | 0.294 | S | S | . | . | trans | -73.9 | 133.6 | 176.7 | -174.3 | -100.2 | 0 | 0 | 0 | 112 | H182 N273 P275 | H180-H182 AromaticContact CE1-CD2 3.74Å; H180-H182 AromaticContact CE1-NE2 3.74Å; H180-H182 AromaticContact ND1-CD2 3.45Å; H180-H182 PolarHBondContact ND1-CD2 3Å; H180-H182 AromaticContact ND1-CE1 3.3Å; H180-H182 PolarHBondContact ND1-CE1 2.8Å; H180-H182 VanDerWaalsContact ND1-CE1 3.3Å; H180-H182 AromaticContact ND1-CG 3.74Å; H180-H182 AromaticContact ND1-ND1 3.63Å; H180-H182 AromaticContact ND1-NE2 3.13Å; H180-H182 PolarHBondContact ND1-NE2 2.89Å; H180-H182 VanDerWaalsContact ND1-NE2 3.13Å; H180-N273 PolarHBondContact N-ND2 3.41Å; H180-N273 PolarHBondContact O-ND2 2.9Å; H180-N273 PolarHBondContact O-OD1 3.15Å; H180-P275 HydrophobicContact CB-CG 4.38Å | ||
| 181 | Q | 85.3 | Confident | 82.2 | Confident | 33 Ų | 33 | 51.4 Ų | 51.4 | 15% | 0.154 | 31% | 0.305 | C | S | . | . | trans | -97.6 | 116 | 179.9 | -60.6 | -64.4 | -55.8 | 0 | 0 | 109.8 | A170 A177 V178 | A170-Q181 PolarHBondContact O-NE2 2.89Å; A170-Q181 PolarHBondContact O-OE1 3.16Å; A177-Q181 HydrophobicContact CB-CG 3.89Å; V178-Q181 PolarHBondContact O-NE2 3.21Å | ||
| 182 | H | 78.6 | Confident | 82.4 | Confident | 31 Ų | 31 | 54.1 Ų | 54.1 | 14% | 0.144 | 32% | 0.322 | C | S | . | . | trans | -91.6 | 0.8 | -176.6 | -66.8 | 94.6 | 0 | 0 | 0 | 114.8 | H167 H180 H184 N273 | H167-H182 HydrophobicContact CB-CB 4.5Å; H167-H182 AromaticContact CD2-CE1 3.61Å; H167-H182 AromaticContact CD2-ND1 3.51Å; H167-H182 AromaticContact CE1-CD2 3.91Å; H167-H182 AromaticContact CE1-CE1 3.8Å; H167-H182 AromaticContact CE1-CG 3.98Å; H167-H182 AromaticContact CE1-ND1 3.95Å; H167-H182 AromaticContact CE1-NE2 3.85Å; H167-H182 AromaticContact CG-ND1 3.77Å; H167-H182 AromaticContact ND1-CG 3.96Å; H167-H182 AromaticContact NE2-CE1 3.31Å; H167-H182 PolarHBondContact NE2-CE1 3.42Å; H167-H182 VanDerWaalsContact NE2-CE1 3.31Å; H167-H182 AromaticContact NE2-ND1 3.63Å; H167-H182 AromaticContact NE2-NE2 3.72Å; H180-H182 AromaticContact CE1-CD2 3.74Å; H180-H182 AromaticContact CE1-NE2 3.74Å; H180-H182 AromaticContact ND1-CD2 3.45Å; H180-H182 PolarHBondContact ND1-CD2 3Å; H180-H182 AromaticContact ND1-CE1 3.3Å; H180-H182 PolarHBondContact ND1-CE1 2.8Å; H180-H182 VanDerWaalsContact ND1-CE1 3.3Å; H180-H182 AromaticContact ND1-CG 3.74Å; H180-H182 AromaticContact ND1-ND1 3.63Å; H180-H182 AromaticContact ND1-NE2 3.13Å; H180-H182 PolarHBondContact ND1-NE2 2.89Å; H180-H182 VanDerWaalsContact ND1-NE2 3.13Å; H182-H184 VanDerWaalsContact CB-NE2 3.3Å; H182-H184 WeakPolarHBondContact CB-NE2 3.4Å; H182-H184 PolarHBondContact O-N 3.35Å; H182-N273 PolarHBondContact CE1-O 2.7Å | ||
| 183 | N | 80.9 | Confident | 82.5 | Confident | 124 Ų | 124 | 56 Ų | 56 | 66% | 0.663 | 33% | 0.334 | S | S | * | . | trans | 33.5 | 69.6 | 179.9 | -66.7 | -6.7 | 0 | 0 | 0 | 115.8 | ||||
| 184 | H | 83.1 | Confident | 83 | Confident | 19 Ų | 19 | 53 Ų | 53 | 9% | 0.088 | 32% | 0.315 | C | S | . | . | trans | -101.3 | 139.9 | 177 | -61.4 | -58.2 | 0 | 0 | 0 | 109.2 | H167 L168 Q171 H182 A190 | H167-H184 AromaticContact ND1-NE2 3.46Å; H167-H184 PolarHBondContact ND1-NE2 3.12Å; L168-H184 HydrophobicContact CD2-CB 3.89Å; Q171-H184 PolarHBondContact NE2-CD2 3.16Å; Q171-H184 PolarHBondContact OE1-O 2.86Å; H182-H184 VanDerWaalsContact CB-NE2 3.3Å; H182-H184 WeakPolarHBondContact CB-NE2 3.4Å; H182-H184 PolarHBondContact O-N 3.35Å; H184-A190 HydrophobicContact CB-CB 3.82Å | ||
| 185 | L | 80.1 | Confident | 83.5 | Confident | 167 Ų | 167 | 52.3 Ų | 52.3 | 87% | 0.874 | 30% | 0.303 | S | S | * | . | S | Bend | trans | -77.8 | -25.2 | 179.2 | -65.5 | 168.8 | 0 | 0 | 0 | 112.2 | D189 | L185-D189 HydrophobicContact CB-CB 4.32Å; L185-D189 PolarHBondContact N-OD2 3.38Å |
| 186 | G | 86.1 | Confident | 84.3 | Confident | 22 Ų | 22 | 58.4 Ų | 58.4 | 23% | 0.227 | 31% | 0.309 | C | S | . | . | S | Bend | trans | -173.2 | -173.6 | -178.7 | 0 | 0 | 0 | 0 | 0 | 113.2 | A190 | G186-A190 WeakPolarHBondContact O-CB 3.5Å; G186-A190 PolarHBondContact O-N 2.87Å |
| 187 | V | 88.5 | Confident | 84.6 | Confident | 23 Ų | 23 | 64.5 Ų | 64.5 | 14% | 0.139 | 33% | 0.331 | C | S | . | . | H | α-helix | trans | -68.2 | -48.1 | -179 | 174 | 0 | 0 | 0 | 0 | 111.9 | S111 A112 I115 V164 L168 A190 F191 | S111-V187 WeakPolarHBondContact OG-CG2 3.38Å; A112-V187 HydrophobicContact CB-CG1 4.3Å; A112-V187 HydrophobicContact CB-CG2 3.95Å; I115-V187 HydrophobicContact CD1-CG1 4.35Å; V164-V187 HydrophobicContact CG1-CB 4.42Å; V164-V187 HydrophobicContact CG1-CG1 4.05Å; V164-V187 HydrophobicContact CG1-CG2 4.42Å; L168-V187 HydrophobicContact CD1-CB 4.37Å; L168-V187 HydrophobicContact CD1-CG2 3.45Å; L168-V187 VanDerWaalsContact CD1-CG2 3.45Å; V187-A190 PolarHBondContact O-N 3.42Å; V187-F191 HydrophobicContact CG1-CD2 3.7Å; V187-F191 HydrophobicContact CG1-CE2 3.58Å; V187-F191 WeakPolarHBondContact O-CD2 3.49Å; V187-F191 PolarHBondContact O-N 3.35Å |
| 188 | S | 88.3 | Confident | 84.9 | Confident | 93 Ų | 93 | 64 Ų | 64 | 65% | 0.65 | 32% | 0.324 | S | S | * | . | H | α-helix | trans | -62.1 | -45.1 | 178.5 | 48.1 | 0 | 0 | 0 | 0 | 111.4 | F191 V192 | S188-F191 PolarHBondContact O-N 2.86Å; S188-V192 VanDerWaalsContact O-CG2 3.31Å; S188-V192 WeakPolarHBondContact O-CG2 3.17Å; S188-V192 PolarHBondContact O-N 2.85Å |
| 189 | D | 90.3 | Very high | 85.3 | Confident | 50 Ų | 50 | 64.8 Ų | 64.8 | 27% | 0.267 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -60.9 | -44.2 | 175.6 | -178.1 | 56 | 0 | 0 | 0 | 111.9 | L185 F191 V192 T193 | L185-D189 HydrophobicContact CB-CB 4.32Å; L185-D189 PolarHBondContact N-OD2 3.38Å; D189-F191 PolarHBondContact O-N 3.28Å; D189-V192 PolarHBondContact O-N 3.18Å; D189-T193 WeakPolarHBondContact O-CB 3.41Å; D189-T193 PolarHBondContact O-N 2.87Å; D189-T193 PolarHBondContact O-OG1 3.25Å |
| 190 | A | 88.1 | Confident | 85.6 | Confident | 0 Ų | 0 | 68.6 Ų | 68.6 | 0% | 0 | 35% | 0.347 | C | S | . | . | H | α-helix | trans | -60.9 | -44.9 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | V164 H184 G186 V187 I194 | V164-A190 HydrophobicContact CB-CB 4.48Å; V164-A190 HydrophobicContact CG1-CB 3.64Å; V164-A190 HydrophobicContact CG2-CB 4.2Å; H184-A190 HydrophobicContact CB-CB 3.82Å; G186-A190 WeakPolarHBondContact O-CB 3.5Å; G186-A190 PolarHBondContact O-N 2.87Å; V187-A190 PolarHBondContact O-N 3.42Å; A190-I194 WeakPolarHBondContact O-CB 3.36Å; A190-I194 VanDerWaalsContact O-CD1 3.29Å; A190-I194 WeakPolarHBondContact O-CD1 3.39Å; A190-I194 WeakPolarHBondContact O-CG1 3.43Å; A190-I194 PolarHBondContact O-N 3.07Å |
| 191 | F | 90 | Very high | 85.8 | Confident | 52 Ų | 52 | 70.8 Ų | 70.8 | 23% | 0.228 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -61.3 | -48.5 | 176.4 | -87 | -68.2 | 0 | 0 | 0 | 112 | P160 A161 V164 V187 S188 D189 Y195 L203 | P160-F191 HydrophobicContact CB-CE1 3.84Å; A161-F191 HydrophobicContact CB-CZ 4.45Å; V164-F191 HydrophobicContact CB-CE2 4.18Å; V164-F191 HydrophobicContact CB-CZ 4.22Å; V164-F191 HydrophobicContact CG1-CD2 4.37Å; V164-F191 HydrophobicContact CG1-CE2 4.23Å; V164-F191 HydrophobicContact CG2-CD1 3.78Å; V164-F191 HydrophobicContact CG2-CD2 3.97Å; V164-F191 HydrophobicContact CG2-CE1 3.74Å; V164-F191 HydrophobicContact CG2-CE2 3.93Å; V164-F191 HydrophobicContact CG2-CG 3.9Å; V164-F191 HydrophobicContact CG2-CZ 3.81Å; V187-F191 HydrophobicContact CG1-CD2 3.7Å; V187-F191 HydrophobicContact CG1-CE2 3.58Å; V187-F191 WeakPolarHBondContact O-CD2 3.49Å; V187-F191 PolarHBondContact O-N 3.35Å; S188-F191 PolarHBondContact O-N 2.86Å; D189-F191 PolarHBondContact O-N 3.28Å; F191-Y195 WeakPolarHBondContact O-CB 3.25Å; F191-Y195 PolarHBondContact O-N 2.96Å; F191-L203 HydrophobicContact CD1-CD2 4.16Å; F191-L203 HydrophobicContact CE1-CD2 4.45Å |
| 192 | V | 89.6 | Confident | 85.7 | Confident | 68 Ų | 68 | 69.4 Ų | 69.4 | 41% | 0.412 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -65.6 | -42.9 | -178.9 | 172.7 | 0 | 0 | 0 | 0 | 110.9 | S188 D189 Y195 R196 | S188-V192 VanDerWaalsContact O-CG2 3.31Å; S188-V192 WeakPolarHBondContact O-CG2 3.17Å; S188-V192 PolarHBondContact O-N 2.85Å; D189-V192 PolarHBondContact O-N 3.18Å; V192-Y195 PolarHBondContact O-N 2.98Å; V192-R196 HydrophobicContact CG1-CG 4.32Å; V192-R196 WeakPolarHBondContact O-CB 3.35Å; V192-R196 VanDerWaalsContact O-CG 3.3Å; V192-R196 WeakPolarHBondContact O-CG 3.41Å; V192-R196 PolarHBondContact O-N 3.31Å |
| 193 | T | 88.1 | Confident | 86.1 | Confident | 53 Ų | 53 | 69 Ų | 69 | 33% | 0.325 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -65.3 | -45.9 | -179.8 | -65 | 0 | 0 | 0 | 0 | 111.3 | D189 R196 R197 | D189-T193 WeakPolarHBondContact O-CB 3.41Å; D189-T193 PolarHBondContact O-N 2.87Å; D189-T193 PolarHBondContact O-OG1 3.25Å; T193-R196 PolarHBondContact O-N 2.95Å; T193-R197 VanDerWaalsContact O-CB 3.22Å; T193-R197 WeakPolarHBondContact O-CB 3.32Å; T193-R197 PolarHBondContact O-N 3.35Å |
| 194 | I | 88.1 | Confident | 86.4 | Confident | 7 Ų | 7 | 68.2 Ų | 68.2 | 4% | 0.036 | 35% | 0.347 | C | S | . | . | H | α-helix | trans | -63.9 | -44.3 | 176.3 | -64.1 | 164.2 | 0 | 0 | 0 | 110 | L163 V164 A190 R196 R197 D198 L203 | L163-I194 HydrophobicContact CD2-CD1 4.11Å; L163-I194 HydrophobicContact CD2-CG2 4.19Å; L163-I194 HydrophobicContact CG-CD1 4.34Å; V164-I194 HydrophobicContact CG2-CD1 3.97Å; A190-I194 WeakPolarHBondContact O-CB 3.36Å; A190-I194 VanDerWaalsContact O-CD1 3.29Å; A190-I194 WeakPolarHBondContact O-CD1 3.39Å; A190-I194 WeakPolarHBondContact O-CG1 3.43Å; A190-I194 PolarHBondContact O-N 3.07Å; I194-R196 PolarHBondContact O-N 3.39Å; I194-R197 PolarHBondContact O-N 3.03Å; I194-D198 WeakPolarHBondContact O-CA 3.42Å; I194-D198 PolarHBondContact O-N 3.45Å; I194-L203 HydrophobicContact CG2-CD1 3.97Å; I194-L203 HydrophobicContact CG2-CG 4.45Å |
| 195 | Y | 87.9 | Confident | 86.4 | Confident | 126 Ų | 126 | 69.1 Ų | 69.1 | 49% | 0.494 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -61.7 | -41.8 | 178.5 | -179.8 | -100.4 | 0 | 0 | 0 | 112.6 | F191 V192 G199 L200 L203 | F191-Y195 WeakPolarHBondContact O-CB 3.25Å; F191-Y195 PolarHBondContact O-N 2.96Å; V192-Y195 PolarHBondContact O-N 2.98Å; Y195-G199 WeakPolarHBondContact O-CA 3.46Å; Y195-G199 PolarHBondContact O-N 3.25Å; Y195-L200 HydrophobicContact CD2-CD2 4.14Å; Y195-L200 HydrophobicContact CD2-CG 4.48Å; Y195-L200 HydrophobicContact CE2-CD2 3.6Å; Y195-L200 HydrophobicContact CE2-CG 3.79Å; Y195-L203 HydrophobicContact CD2-CD1 4.21Å |
| 196 | R | 87.5 | Confident | 86.5 | Confident | 208 Ų | 208 | 61.5 Ų | 61.5 | 79% | 0.785 | 31% | 0.312 | S | S | * | . | H | α-helix | trans | -71.7 | -35.5 | 178.9 | -75 | -178.1 | 178.5 | -167.5 | 0.6 | 113 | V192 T193 I194 | V192-R196 HydrophobicContact CG1-CG 4.32Å; V192-R196 WeakPolarHBondContact O-CB 3.35Å; V192-R196 VanDerWaalsContact O-CG 3.3Å; V192-R196 WeakPolarHBondContact O-CG 3.41Å; V192-R196 PolarHBondContact O-N 3.31Å; T193-R196 PolarHBondContact O-N 2.95Å; I194-R196 PolarHBondContact O-N 3.39Å |
| 197 | R | 84.7 | Confident | 86.4 | Confident | 140 Ų | 140 | 61.3 Ų | 61.3 | 53% | 0.528 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -84.4 | -45.8 | -175.8 | -174.8 | -177.6 | 161.1 | 158.9 | 0.5 | 112.6 | T193 I194 H280 | T193-R197 VanDerWaalsContact O-CB 3.22Å; T193-R197 WeakPolarHBondContact O-CB 3.32Å; T193-R197 PolarHBondContact O-N 3.35Å; I194-R197 PolarHBondContact O-N 3.03Å; R197-H280 PolarHBondContact O-NE2 3.4Å |
| 198 | D | 81.8 | Confident | 86.3 | Confident | 18 Ų | 18 | 65.5 Ų | 65.5 | 10% | 0.096 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -114.8 | -0.7 | -169.7 | -58.9 | -32.4 | 0 | 0 | 0 | 113.5 | I194 T201 G202 V276 H280 | I194-D198 WeakPolarHBondContact O-CA 3.42Å; I194-D198 PolarHBondContact O-N 3.45Å; D198-T201 PolarHBondContact O-OG1 3.3Å; D198-G202 PolarHBondContact O-N 3.16Å; D198-V276 WeakPolarHBondContact OD1-CG2 3.4Å; D198-H280 IonicContact OD1-CD2 3.42Å; D198-H280 PolarHBondContact OD1-CD2 3.42Å |
| 199 | G | 85.5 | Confident | 86.1 | Confident | 28 Ų | 28 | 61 Ų | 61 | 29% | 0.289 | 30% | 0.297 | S | S | . | . | H | α-helix | trans | 67.8 | -163.2 | -179.8 | 0 | 0 | 0 | 0 | 0 | 113.5 | Y195 G202 L203 | Y195-G199 WeakPolarHBondContact O-CA 3.46Å; Y195-G199 PolarHBondContact O-N 3.25Å; G199-G202 PolarHBondContact O-N 2.86Å; G199-L203 VanDerWaalsContact O-CD1 3.26Å; G199-L203 WeakPolarHBondContact O-CD1 3.4Å |
| 200 | L | 85.5 | Confident | 85.8 | Confident | 111 Ų | 111 | 59.1 Ų | 59.1 | 58% | 0.581 | 29% | 0.287 | S | S | * | . | H | α-helix | trans | -65.5 | -38.1 | 178.2 | -75.8 | 169.4 | 0 | 0 | 0 | 112.5 | Y195 G202 L203 | Y195-L200 HydrophobicContact CD2-CD2 4.14Å; Y195-L200 HydrophobicContact CD2-CG 4.48Å; Y195-L200 HydrophobicContact CE2-CD2 3.6Å; Y195-L200 HydrophobicContact CE2-CG 3.79Å; L200-G202 PolarHBondContact O-N 3.49Å; L200-L203 PolarHBondContact O-N 3.48Å |
| 201 | T | 84.1 | Confident | 85.8 | Confident | 113 Ų | 113 | 60.5 Ų | 60.5 | 69% | 0.693 | 30% | 0.296 | S | S | * | . | H | α-helix | trans | -66.6 | -29.1 | -179.6 | 49.9 | 0 | 0 | 0 | 0 | 112.1 | D198 L203 W204 | D198-T201 PolarHBondContact O-OG1 3.3Å; T201-L203 VanDerWaalsContact C-N 3.3Å; T201-L203 PolarHBondContact O-N 3.34Å; T201-W204 PolarHBondContact O-N 3.42Å |
| 202 | G | 82.8 | Confident | 85.7 | Confident | 5 Ų | 5 | 59.7 Ų | 59.7 | 5% | 0.052 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -59.1 | -36 | 172.7 | 0 | 0 | 0 | 0 | 0 | 114 | L163 D198 G199 L200 W204 R205 | L163-G202 VanDerWaalsContact CD2-O 3.27Å; L163-G202 WeakPolarHBondContact CD2-O 3.21Å; D198-G202 PolarHBondContact O-N 3.16Å; G199-G202 PolarHBondContact O-N 2.86Å; L200-G202 PolarHBondContact O-N 3.49Å; G202-W204 VanDerWaalsContact C-N 3.32Å; G202-W204 PolarHBondContact O-N 3.2Å; G202-R205 WeakPolarHBondContact O-CB 3.25Å; G202-R205 PolarHBondContact O-N 2.9Å |
| 203 | L | 86.7 | Confident | 85.6 | Confident | 21 Ų | 21 | 58 Ų | 58 | 11% | 0.11 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -69 | -28.2 | -178.1 | -85 | 77.5 | 0 | 0 | 0 | 113.1 | P160 F191 I194 Y195 G199 L200 T201 R205 | P160-L203 WeakPolarHBondContact CA-O 3.18Å; P160-L203 HydrophobicContact CB-CB 3.98Å; P160-L203 HydrophobicContact CB-CD2 4.02Å; P160-L203 HydrophobicContact CB-CG 4.28Å; P160-L203 HydrophobicContact CG-CB 4.02Å; P160-L203 HydrophobicContact CG-CD2 4.48Å; F191-L203 HydrophobicContact CD1-CD2 4.16Å; F191-L203 HydrophobicContact CE1-CD2 4.45Å; I194-L203 HydrophobicContact CG2-CD1 3.97Å; I194-L203 HydrophobicContact CG2-CG 4.45Å; Y195-L203 HydrophobicContact CD2-CD1 4.21Å; G199-L203 VanDerWaalsContact O-CD1 3.26Å; G199-L203 WeakPolarHBondContact O-CD1 3.4Å; L200-L203 PolarHBondContact O-N 3.48Å; T201-L203 VanDerWaalsContact C-N 3.3Å; T201-L203 PolarHBondContact O-N 3.34Å; L203-R205 VanDerWaalsContact C-N 3.35Å |
| 204 | W | 88.6 | Confident | 85.5 | Confident | 108 Ų | 108 | 56.7 Ų | 56.7 | 41% | 0.409 | 27% | 0.274 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -95.6 | 9.9 | 177.2 | -83.3 | -94.8 | 0 | 0 | 0 | 113.1 | L156 P160 T201 G202 G206 V207 | L156-W204 PolarHBondContact O-NE1 3.34Å; P160-W204 HydrophobicContact CG-CD2 4.04Å; P160-W204 HydrophobicContact CG-CE3 4.1Å; P160-W204 HydrophobicContact CG-CH2 3.87Å; P160-W204 HydrophobicContact CG-CZ2 3.77Å; P160-W204 HydrophobicContact CG-CZ3 4.03Å; T201-W204 PolarHBondContact O-N 3.42Å; G202-W204 VanDerWaalsContact C-N 3.32Å; G202-W204 PolarHBondContact O-N 3.2Å; W204-G206 PolarHBondContact O-N 3.17Å; W204-V207 VanDerWaalsContact O-CB 3.27Å; W204-V207 WeakPolarHBondContact O-CB 3.42Å; W204-V207 WeakPolarHBondContact O-CG1 3.19Å; W204-V207 PolarHBondContact O-N 2.82Å |
| 205 | R | 81.5 | Confident | 85.2 | Confident | 38 Ų | 38 | 60.7 Ų | 60.7 | 14% | 0.143 | 29% | 0.294 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -68.8 | 131.6 | 178.9 | -173 | 169.8 | 159.6 | 154.2 | -18 | 110.1 | G202 L203 Y272 Q274 P275 H280 K281 | G202-R205 WeakPolarHBondContact O-CB 3.25Å; G202-R205 PolarHBondContact O-N 2.9Å; L203-R205 VanDerWaalsContact C-N 3.35Å; R205-Y272 WeakPolarHBondContact O-CD1 3.47Å; R205-Y272 WeakPolarHBondContact O-CE1 3.48Å; R205-Q274 PolarHBondContact NH2-O 3.08Å; R205-P275 PolarHBondContact NH2-O 3.06Å; R205-H280 PolarHBondContact NH1-O 2.93Å; R205-K281 PolarHBondContact NH1-O 2.9Å |
| 206 | G | 81.8 | Confident | 85.2 | Confident | 8 Ų | 8 | 56.8 Ų | 56.8 | 8% | 0.082 | 28% | 0.283 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 93 | -4.7 | -175.2 | 0 | 0 | 0 | 0 | 0 | 114.4 | W204 N208 G209 A210 Y272 | W204-G206 PolarHBondContact O-N 3.17Å; G206-N208 PolarHBondContact O-N 3.27Å; G206-G209 WeakPolarHBondContact O-CA 3.42Å; G206-G209 PolarHBondContact O-N 3.29Å; G206-A210 PolarHBondContact O-N 2.84Å; G206-Y272 WeakPolarHBondContact O-CE2 3.19Å |
| 207 | V | 85.9 | Confident | 84.9 | Confident | 17 Ų | 17 | 47.2 Ų | 47.2 | 10% | 0.103 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -61.4 | -31.1 | -179.9 | 83.4 | 0 | 0 | 0 | 0 | 113.1 | L156 W204 G209 A210 V211 | L156-V207 HydrophobicContact CD2-CB 4.49Å; L156-V207 HydrophobicContact CD2-CG1 4.16Å; L156-V207 HydrophobicContact CD2-CG2 3.53Å; L156-V207 HydrophobicContact CG-CG2 4.23Å; W204-V207 VanDerWaalsContact O-CB 3.27Å; W204-V207 WeakPolarHBondContact O-CB 3.42Å; W204-V207 WeakPolarHBondContact O-CG1 3.19Å; W204-V207 PolarHBondContact O-N 2.82Å; V207-G209 PolarHBondContact O-N 3.11Å; V207-G209 VanDerWaalsContact O-N 3.12Å; V207-A210 PolarHBondContact O-N 3.27Å; V207-V211 HydrophobicContact CG2-CG2 4.27Å; V207-V211 PolarHBondContact O-N 2.88Å |
| 208 | N | 86 | Confident | 84.8 | Confident | 111 Ų | 111 | 42.7 Ų | 42.7 | 59% | 0.594 | 24% | 0.239 | S | C | * | . | H | α-helix | trans | -59.4 | -21 | 172.3 | -67.9 | -15.8 | 0 | 0 | 0 | 113.2 | G206 P212 L271 | G206-N208 PolarHBondContact O-N 3.27Å; N208-P212 WeakPolarHBondContact O-CD 3.29Å; N208-P212 VanDerWaalsContact O-CG 3.23Å; N208-P212 WeakPolarHBondContact O-CG 3.45Å; N208-L271 HydrophobicContact CB-CD2 4.41Å |
| 209 | G | 83.4 | Confident | 84.8 | Confident | 0 Ų | 0 | 44.1 Ų | 44.1 | 0% | 0 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -93.2 | -30 | 170.9 | 0 | 0 | 0 | 0 | 0 | 113.7 | G206 V207 R213 | G206-G209 WeakPolarHBondContact O-CA 3.42Å; G206-G209 PolarHBondContact O-N 3.29Å; V207-G209 PolarHBondContact O-N 3.11Å; V207-G209 VanDerWaalsContact O-N 3.12Å; G209-R213 WeakPolarHBondContact O-CB 3.34Å; G209-R213 PolarHBondContact O-N 2.9Å |
| 210 | A | 85.1 | Confident | 84.7 | Confident | 9 Ų | 9 | 43.4 Ų | 43.4 | 7% | 0.074 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -72.1 | -41.1 | 179.4 | 0 | 0 | 0 | 0 | 0 | 113.2 | A155 G206 V207 R213 V214 Y272 | A155-A210 HydrophobicContact CB-CB 4.49Å; G206-A210 PolarHBondContact O-N 2.84Å; V207-A210 PolarHBondContact O-N 3.27Å; A210-R213 WeakPolarHBondContact O-CB 3.37Å; A210-R213 PolarHBondContact O-N 3Å; A210-V214 WeakPolarHBondContact O-CG2 3.27Å; A210-V214 PolarHBondContact O-N 3.3Å; A210-Y272 HydrophobicContact CB-CE2 3.95Å; A210-Y272 VanDerWaalsContact CB-OH 3.27Å; A210-Y272 WeakPolarHBondContact CB-OH 3.11Å |
| 211 | V | 87.4 | Confident | 84.6 | Confident | 29 Ų | 29 | 41.7 Ų | 41.7 | 18% | 0.176 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -63.4 | -52.1 | -177.8 | 173.3 | 0 | 0 | 0 | 0 | 111.5 | A152 A155 L156 V207 R213 V214 M215 | A152-V211 HydrophobicContact CB-CG1 3.93Å; A155-V211 HydrophobicContact CB-CG2 4.38Å; L156-V211 HydrophobicContact CD2-CG2 4.15Å; L156-V211 HydrophobicContact CG-CG2 4Å; V207-V211 HydrophobicContact CG2-CG2 4.27Å; V207-V211 PolarHBondContact O-N 2.88Å; V211-R213 VanDerWaalsContact C-N 3.26Å; V211-R213 PolarHBondContact O-N 3.36Å; V211-V214 PolarHBondContact O-N 2.9Å; V211-V214 VanDerWaalsContact O-N 3.17Å; V211-M215 HydrophobicContact CG1-CG 4.32Å; V211-M215 HydrophobicContact CG1-SD 3.81Å; V211-M215 WeakPolarHBondContact O-CG 3.34Å; V211-M215 PolarHBondContact O-N 3.18Å |
| 212 | P | 88.4 | Confident | 84.3 | Confident | 35 Ų | 35 | 40 Ų | 40 | 23% | 0.227 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -58.8 | -38.5 | 176.5 | -25.4 | 35.6 | 0 | 0 | 0 | 112.8 | N208 V214 M215 V216 F264 | N208-P212 WeakPolarHBondContact O-CD 3.29Å; N208-P212 VanDerWaalsContact O-CG 3.23Å; N208-P212 WeakPolarHBondContact O-CG 3.45Å; P212-V214 PolarHBondContact O-N 3.1Å; P212-M215 PolarHBondContact O-N 3.45Å; P212-V216 WeakPolarHBondContact O-CB 3.46Å; P212-V216 VanDerWaalsContact O-CG2 3.25Å; P212-V216 WeakPolarHBondContact O-CG2 3.49Å; P212-V216 PolarHBondContact O-N 3.5Å; P212-F264 HydrophobicContact CB-CD1 3.94Å; P212-F264 HydrophobicContact CB-CE1 4.14Å |
| 213 | R | 87.4 | Confident | 84.2 | Confident | 32 Ų | 32 | 42.2 Ų | 42.2 | 12% | 0.121 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -58.3 | -48.9 | 176.1 | 174.3 | -168.7 | 165.8 | 169 | 0.8 | 112 | Y162 G209 A210 V211 G217 M261 F264 D265 | Y162-R213 VanDerWaalsContact CZ-NH1 3.33Å; Y162-R213 PolarHBondContact OH-NH1 2.88Å; G209-R213 WeakPolarHBondContact O-CB 3.34Å; G209-R213 PolarHBondContact O-N 2.9Å; A210-R213 WeakPolarHBondContact O-CB 3.37Å; A210-R213 PolarHBondContact O-N 3Å; V211-R213 VanDerWaalsContact C-N 3.26Å; V211-R213 PolarHBondContact O-N 3.36Å; R213-G217 PolarHBondContact O-N 2.96Å; R213-M261 HydrophobicContact CG-CG 4.17Å; R213-F264 HydrophobicContact CB-CB 3.93Å; R213-F264 HydrophobicContact CG-CB 4.34Å; R213-D265 WeakPolarHBondContact CD-OD1 3.42Å; R213-D265 WeakPolarHBondContact CG-OD1 3.49Å; R213-D265 IonicContact CZ-OD1 3.29Å; R213-D265 IonicContact NE-OD1 2.71Å; R213-D265 PolarHBondContact NE-OD1 2.89Å; R213-D265 IonicContact NH1-OD1 2.95Å; R213-D265 IonicContact NH2-OD1 2.68Å |
| 214 | V | 84.4 | Confident | 84 | Confident | 26 Ų | 26 | 42.7 Ų | 42.7 | 16% | 0.158 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -68.7 | -39.6 | -178.6 | 173.5 | 0 | 0 | 0 | 0 | 111.1 | A155 A210 V211 P212 S218 | A155-V214 HydrophobicContact CB-CB 4.46Å; A155-V214 HydrophobicContact CB-CG2 3.98Å; A210-V214 WeakPolarHBondContact O-CG2 3.27Å; A210-V214 PolarHBondContact O-N 3.3Å; V211-V214 PolarHBondContact O-N 2.9Å; V211-V214 VanDerWaalsContact O-N 3.17Å; P212-V214 PolarHBondContact O-N 3.1Å; V214-S218 WeakPolarHBondContact O-CB 2.92Å; V214-S218 PolarHBondContact O-N 2.94Å; V214-S218 PolarHBondContact O-OG 3.36Å |
| 215 | M | 83.5 | Confident | 83.5 | Confident | 92 Ų | 92 | 39.1 Ų | 39.1 | 45% | 0.453 | 23% | 0.229 | S | C | . | . | H | α-helix | trans | -62.7 | -51 | 176.4 | -70.1 | 179.2 | 69.3 | 0 | 0 | 111.8 | V211 P212 S218 A219 | V211-M215 HydrophobicContact CG1-CG 4.32Å; V211-M215 HydrophobicContact CG1-SD 3.81Å; V211-M215 WeakPolarHBondContact O-CG 3.34Å; V211-M215 PolarHBondContact O-N 3.18Å; P212-M215 PolarHBondContact O-N 3.45Å; M215-S218 PolarHBondContact O-N 3.24Å; M215-A219 WeakPolarHBondContact O-CB 3.27Å; M215-A219 PolarHBondContact O-N 3.39Å |
| 216 | V | 86.7 | Confident | 83.3 | Confident | 43 Ų | 43 | 40.1 Ų | 40.1 | 26% | 0.261 | 24% | 0.239 | S | C | . | . | H | α-helix | trans | -65.2 | -43.2 | -179.8 | 172.6 | 0 | 0 | 0 | 0 | 110.9 | P212 S218 A219 A220 F264 | P212-V216 WeakPolarHBondContact O-CB 3.46Å; P212-V216 VanDerWaalsContact O-CG2 3.25Å; P212-V216 WeakPolarHBondContact O-CG2 3.49Å; P212-V216 PolarHBondContact O-N 3.5Å; V216-S218 VanDerWaalsContact C-N 3.33Å; V216-S218 PolarHBondContact O-N 2.9Å; V216-A219 PolarHBondContact O-N 2.84Å; V216-A220 WeakPolarHBondContact O-CB 3.27Å; V216-A220 PolarHBondContact O-N 2.8Å; V216-F264 HydrophobicContact CB-CD2 4.22Å; V216-F264 HydrophobicContact CB-CE2 4.15Å; V216-F264 HydrophobicContact CB-CZ 4.47Å; V216-F264 HydrophobicContact CG1-CD2 3.94Å; V216-F264 HydrophobicContact CG1-CE2 3.74Å; V216-F264 HydrophobicContact CG1-CZ 4.42Å; V216-F264 HydrophobicContact CG2-CD1 4.44Å; V216-F264 HydrophobicContact CG2-CD2 4.3Å; V216-F264 HydrophobicContact CG2-CE1 4Å; V216-F264 HydrophobicContact CG2-CE2 3.86Å; V216-F264 HydrophobicContact CG2-CZ 3.7Å |
| 217 | G | 82.6 | Confident | 83.3 | Confident | 7 Ų | 7 | 43.3 Ų | 43.3 | 7% | 0.072 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -58.1 | -45.2 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | R213 Q221 | R213-G217 PolarHBondContact O-N 2.96Å; G217-Q221 VanDerWaalsContact O-CB 3.22Å; G217-Q221 WeakPolarHBondContact O-CB 3.43Å; G217-Q221 PolarHBondContact O-N 2.91Å |
| 218 | S | 80.9 | Confident | 83.1 | Confident | 45 Ų | 45 | 43.2 Ų | 43.2 | 32% | 0.315 | 26% | 0.26 | S | S | . | . | H | α-helix | trans | -67.6 | -44.5 | 179.3 | -55.2 | 0 | 0 | 0 | 0 | 112.2 | V214 M215 V216 Q221 L222 | V214-S218 WeakPolarHBondContact O-CB 2.92Å; V214-S218 PolarHBondContact O-N 2.94Å; V214-S218 PolarHBondContact O-OG 3.36Å; M215-S218 PolarHBondContact O-N 3.24Å; V216-S218 VanDerWaalsContact C-N 3.33Å; V216-S218 PolarHBondContact O-N 2.9Å; S218-Q221 PolarHBondContact O-N 2.63Å; S218-L222 WeakPolarHBondContact O-CB 3.39Å; S218-L222 PolarHBondContact O-N 2.67Å |
| 219 | A | 82.2 | Confident | 82.5 | Confident | 48 Ų | 48 | 41.8 Ų | 41.8 | 40% | 0.397 | 25% | 0.248 | S | C | . | . | H | α-helix | trans | -64.3 | -46.7 | 178.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | M215 V216 Q221 L222 A223 | M215-A219 WeakPolarHBondContact O-CB 3.27Å; M215-A219 PolarHBondContact O-N 3.39Å; V216-A219 PolarHBondContact O-N 2.84Å; A219-Q221 PolarHBondContact O-N 2.87Å; A219-L222 PolarHBondContact O-N 3.39Å; A219-A223 VanDerWaalsContact O-CB 3.31Å; A219-A223 WeakPolarHBondContact O-CB 3.49Å; A219-A223 PolarHBondContact O-N 2.83Å |
| 220 | A | 84.4 | Confident | 82.4 | Confident | 14 Ų | 14 | 46.4 Ų | 46.4 | 12% | 0.116 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -62.7 | -43.6 | 177.9 | 0 | 0 | 0 | 0 | 0 | 111.2 | V216 T224 V257 T260 | V216-A220 WeakPolarHBondContact O-CB 3.27Å; V216-A220 PolarHBondContact O-N 2.8Å; A220-T224 VanDerWaalsContact O-CB 3.25Å; A220-T224 WeakPolarHBondContact O-CB 3.43Å; A220-T224 WeakPolarHBondContact O-CG2 3.48Å; A220-T224 PolarHBondContact O-N 3.41Å; A220-T224 PolarHBondContact O-OG1 2.84Å; A220-V257 HydrophobicContact CB-CG2 4.26Å; A220-T260 VanDerWaalsContact CB-OG1 3.26Å; A220-T260 WeakPolarHBondContact CB-OG1 3.34Å |
| 221 | Q | 82.1 | Confident | 82.1 | Confident | 74 Ų | 74 | 53.5 Ų | 53.5 | 35% | 0.346 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -62.3 | -47.1 | 178.6 | -170.3 | -173.8 | -62.3 | 0 | 0 | 111.1 | G217 S218 A219 T224 F225 S253 V257 | G217-Q221 VanDerWaalsContact O-CB 3.22Å; G217-Q221 WeakPolarHBondContact O-CB 3.43Å; G217-Q221 PolarHBondContact O-N 2.91Å; S218-Q221 PolarHBondContact O-N 2.63Å; A219-Q221 PolarHBondContact O-N 2.87Å; Q221-T224 PolarHBondContact O-OG1 3.46Å; Q221-F225 WeakPolarHBondContact O-CB 3.42Å; Q221-F225 PolarHBondContact O-N 2.77Å; Q221-S253 PolarHBondContact O-OG 3.11Å; Q221-V257 HydrophobicContact CB-CG2 3.66Å; Q221-V257 HydrophobicContact CG-CG2 4.18Å |
| 222 | L | 77.9 | Confident | 81.6 | Confident | 77 Ų | 77 | 52.5 Ų | 52.5 | 40% | 0.403 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -63.9 | -52.8 | -179.8 | -173 | 67.7 | 0 | 0 | 0 | 111.3 | L144 S218 A219 T224 F225 T226 | L144-L222 HydrophobicContact CB-CD2 3.99Å; L144-L222 HydrophobicContact CD1-CD2 3.69Å; L144-L222 HydrophobicContact CD2-CD2 4.21Å; L144-L222 HydrophobicContact CG-CD2 4.15Å; S218-L222 WeakPolarHBondContact O-CB 3.39Å; S218-L222 PolarHBondContact O-N 2.67Å; A219-L222 PolarHBondContact O-N 3.39Å; L222-T224 PolarHBondContact O-N 3Å; L222-F225 PolarHBondContact O-N 2.97Å; L222-T226 HydrophobicContact CD1-CG2 4.28Å; L222-T226 WeakPolarHBondContact O-CG2 3.38Å; L222-T226 PolarHBondContact O-N 2.81Å; L222-T226 PolarHBondContact O-OG1 3.11Å |
| 223 | A | 81.5 | Confident | 80.8 | Confident | 53 Ų | 53 | 53.6 Ų | 53.6 | 44% | 0.438 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -60.6 | -47 | -176.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | A219 T226 S227 | A219-A223 VanDerWaalsContact O-CB 3.31Å; A219-A223 WeakPolarHBondContact O-CB 3.49Å; A219-A223 PolarHBondContact O-N 2.83Å; A223-T226 PolarHBondContact O-OG1 2.93Å; A223-T226 VanDerWaalsContact O-OG1 3.07Å; A223-S227 WeakPolarHBondContact O-CB 3.45Å; A223-S227 PolarHBondContact O-N 3.41Å; A223-S227 PolarHBondContact O-OG 2.97Å |
| 224 | T | 82.1 | Confident | 80.1 | Confident | 31 Ų | 31 | 59.7 Ų | 59.7 | 19% | 0.19 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -70 | -36.4 | -178.6 | 59.4 | 0 | 0 | 0 | 0 | 111.4 | A220 Q221 L222 T228 S253 A256 | A220-T224 VanDerWaalsContact O-CB 3.25Å; A220-T224 WeakPolarHBondContact O-CB 3.43Å; A220-T224 WeakPolarHBondContact O-CG2 3.48Å; A220-T224 PolarHBondContact O-N 3.41Å; A220-T224 PolarHBondContact O-OG1 2.84Å; Q221-T224 PolarHBondContact O-OG1 3.46Å; L222-T224 PolarHBondContact O-N 3Å; T224-T228 WeakPolarHBondContact O-CB 3.38Å; T224-T228 PolarHBondContact O-N 2.86Å; T224-T228 PolarHBondContact O-OG1 3.2Å; T224-S253 WeakPolarHBondContact OG1-CA 3.37Å; T224-S253 WeakPolarHBondContact OG1-CB 3.47Å; T224-S253 PolarHBondContact OG1-OG 2.95Å; T224-A256 HydrophobicContact CG2-CB 3.47Å; T224-A256 VanDerWaalsContact CG2-CB 3.47Å |
| 225 | F | 77.7 | Confident | 79.2 | Confident | 32 Ų | 32 | 60.9 Ų | 60.9 | 14% | 0.14 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -68.3 | -46 | 178.3 | -176 | -95.3 | 0 | 0 | 0 | 111.8 | A29 Q221 L222 K229 A249 | A29-F225 HydrophobicContact CB-CD1 3.81Å; A29-F225 HydrophobicContact CB-CD2 4.04Å; A29-F225 HydrophobicContact CB-CE1 3.19Å; A29-F225 HydrophobicContact CB-CE2 3.46Å; A29-F225 VanDerWaalsContact CB-CE2 3.46Å; A29-F225 HydrophobicContact CB-CG 4.21Å; A29-F225 HydrophobicContact CB-CZ 3Å; Q221-F225 WeakPolarHBondContact O-CB 3.42Å; Q221-F225 PolarHBondContact O-N 2.77Å; L222-F225 PolarHBondContact O-N 2.97Å; F225-K229 HydrophobicContact CE1-CD 3.88Å; F225-K229 HydrophobicContact CZ-CD 4.17Å; F225-K229 WeakPolarHBondContact O-CB 3.27Å; F225-K229 PolarHBondContact O-N 3.01Å; F225-A249 HydrophobicContact CE2-CB 4.16Å |
| 226 | T | 78.3 | Confident | 78.1 | Confident | 59 Ų | 59 | 60.7 Ų | 60.7 | 36% | 0.362 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -63.2 | -51.6 | 178.2 | 51.3 | 0 | 0 | 0 | 0 | 110.9 | L222 A223 T228 K229 D230 | L222-T226 HydrophobicContact CD1-CG2 4.28Å; L222-T226 WeakPolarHBondContact O-CG2 3.38Å; L222-T226 PolarHBondContact O-N 2.81Å; L222-T226 PolarHBondContact O-OG1 3.11Å; A223-T226 PolarHBondContact O-OG1 2.93Å; A223-T226 VanDerWaalsContact O-OG1 3.07Å; T226-T228 VanDerWaalsContact C-N 3.34Å; T226-T228 PolarHBondContact O-N 3.42Å; T226-K229 PolarHBondContact O-N 3.31Å; T226-D230 PolarHBondContact O-N 3.34Å |
| 227 | S | 81.8 | Confident | 76.7 | Confident | 76 Ų | 76 | 69.3 Ų | 69.3 | 53% | 0.531 | 37% | 0.366 | S | S | . | . | H | α-helix | trans | -61.7 | -40.9 | -179.6 | -61 | 0 | 0 | 0 | 0 | 112.5 | A223 W231 | A223-S227 WeakPolarHBondContact O-CB 3.45Å; A223-S227 PolarHBondContact O-N 3.41Å; A223-S227 PolarHBondContact O-OG 2.97Å; S227-W231 WeakPolarHBondContact O-CB 3.35Å; S227-W231 PolarHBondContact O-N 3.28Å |
| 228 | T | 80.6 | Confident | 75.5 | Confident | 14 Ų | 14 | 72.7 Ų | 72.7 | 9% | 0.086 | 38% | 0.379 | C | S | . | . | H | α-helix | trans | -68.7 | -40.7 | 177.9 | -51 | 0 | 0 | 0 | 0 | 111.3 | T224 T226 D230 W231 V232 A249 I252 | T224-T228 WeakPolarHBondContact O-CB 3.38Å; T224-T228 PolarHBondContact O-N 2.86Å; T224-T228 PolarHBondContact O-OG1 3.2Å; T226-T228 VanDerWaalsContact C-N 3.34Å; T226-T228 PolarHBondContact O-N 3.42Å; T228-D230 VanDerWaalsContact C-N 3.33Å; T228-D230 PolarHBondContact O-N 3.07Å; T228-W231 PolarHBondContact O-N 3.11Å; T228-V232 HydrophobicContact CG2-CG2 4.14Å; T228-V232 VanDerWaalsContact O-CG2 3.27Å; T228-V232 WeakPolarHBondContact O-CG2 3.2Å; T228-V232 PolarHBondContact O-N 3.4Å; T228-A249 HydrophobicContact CG2-CB 4Å; T228-I252 HydrophobicContact CG2-CB 3.96Å; T228-I252 HydrophobicContact CG2-CD1 3.71Å; T228-I252 HydrophobicContact CG2-CG1 4.41Å; T228-I252 HydrophobicContact CG2-CG2 4.02Å |
| 229 | K | 75.1 | Confident | 74.1 | Confident | 81 Ų | 81 | 80.1 Ų | 80.1 | 35% | 0.352 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -63.4 | -41.3 | 178.5 | -174.9 | 178.5 | 179.2 | -178.8 | 0 | 111.7 | F225 T226 S233 A249 | F225-K229 HydrophobicContact CE1-CD 3.88Å; F225-K229 HydrophobicContact CZ-CD 4.17Å; F225-K229 WeakPolarHBondContact O-CB 3.27Å; F225-K229 PolarHBondContact O-N 3.01Å; T226-K229 PolarHBondContact O-N 3.31Å; K229-S233 VanDerWaalsContact O-CB 3.25Å; K229-S233 WeakPolarHBondContact O-CB 3.28Å; K229-S233 PolarHBondContact O-N 3.49Å; K229-S233 PolarHBondContact O-OG 3.02Å; K229-A249 HydrophobicContact CB-CB 4.5Å |
| 230 | D | 79.5 | Confident | 72.7 | Confident | 97 Ų | 97 | 82.2 Ų | 82.2 | 52% | 0.519 | 42% | 0.417 | S | S | . | . | H | α-helix | trans | -66.1 | -44.3 | 177.5 | -65.1 | -19.6 | 0 | 0 | 0 | 110.7 | T226 T228 S233 H234 | T226-D230 PolarHBondContact O-N 3.34Å; T228-D230 VanDerWaalsContact C-N 3.33Å; T228-D230 PolarHBondContact O-N 3.07Å; D230-S233 PolarHBondContact O-N 3.41Å; D230-H234 WeakPolarHBondContact O-CB 3.49Å; D230-H234 PolarHBondContact O-N 3.27Å |
| 231 | W | 80.5 | Confident | 71.8 | Confident | 158 Ų | 158 | 85 Ų | 85 | 60% | 0.598 | 43% | 0.43 | S | S | * | . | H | α-helix | trans | -59.3 | -50.3 | 174.9 | -179.8 | 77.7 | 0 | 0 | 0 | 112.6 | S227 T228 S233 H234 S235 | S227-W231 WeakPolarHBondContact O-CB 3.35Å; S227-W231 PolarHBondContact O-N 3.28Å; T228-W231 PolarHBondContact O-N 3.11Å; W231-S233 VanDerWaalsContact C-N 3.28Å; W231-S233 PolarHBondContact O-N 3.35Å; W231-H234 PolarHBondContact O-N 3.33Å; W231-S235 PolarHBondContact O-N 3.24Å |
| 232 | V | 76.1 | Confident | 71.1 | Confident | 9 Ų | 9 | 84.2 Ų | 84.2 | 6% | 0.055 | 44% | 0.436 | C | S | . | . | H | α-helix | trans | -65 | -33.8 | 178.8 | -179.4 | 0 | 0 | 0 | 0 | 111.5 | T228 F238 T245 I248 | T228-V232 HydrophobicContact CG2-CG2 4.14Å; T228-V232 VanDerWaalsContact O-CG2 3.27Å; T228-V232 WeakPolarHBondContact O-CG2 3.2Å; T228-V232 PolarHBondContact O-N 3.4Å; V232-F238 HydrophobicContact CG1-CD2 4.47Å; V232-T245 HydrophobicContact CB-CG2 4Å; V232-T245 HydrophobicContact CG1-CG2 3.45Å; V232-T245 VanDerWaalsContact CG1-CG2 3.45Å; V232-I248 HydrophobicContact CG2-CG2 4.35Å |
| 233 | S | 70.8 | Confident | 70.7 | Confident | 57 Ų | 57 | 87.1 Ų | 87.1 | 40% | 0.399 | 44% | 0.442 | S | S | . | . | H | α-helix | trans | -70.5 | -35.7 | 178 | -59.9 | 0 | 0 | 0 | 0 | 112.3 | K229 D230 W231 Q236 | K229-S233 VanDerWaalsContact O-CB 3.25Å; K229-S233 WeakPolarHBondContact O-CB 3.28Å; K229-S233 PolarHBondContact O-N 3.49Å; K229-S233 PolarHBondContact O-OG 3.02Å; D230-S233 PolarHBondContact O-N 3.41Å; W231-S233 VanDerWaalsContact C-N 3.28Å; W231-S233 PolarHBondContact O-N 3.35Å; S233-Q236 PolarHBondContact O-NE2 3.03Å |
| 234 | H | 72.9 | Confident | 70.1 | Confident | 160 Ų | 160 | 86.6 Ų | 86.6 | 74% | 0.741 | 43% | 0.431 | S | S | * | . | H | α-helix | trans | -73.1 | -35.2 | 176.3 | -80.9 | -160.2 | 0 | 0 | 0 | 112.7 | D230 W231 Q236 | D230-H234 WeakPolarHBondContact O-CB 3.49Å; D230-H234 PolarHBondContact O-N 3.27Å; W231-H234 PolarHBondContact O-N 3.33Å; H234-Q236 PolarHBondContact O-N 3.29Å; H234-Q236 VanDerWaalsContact O-N 3.1Å |
| 235 | S | 66.1 | Low | 69.7 | Low | 52 Ų | 52 | 86.2 Ų | 86.2 | 36% | 0.364 | 43% | 0.429 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -69.1 | -4.4 | -176.3 | -81.4 | 0 | 0 | 0 | 0 | 116.2 | W231 W237 | W231-S235 PolarHBondContact O-N 3.24Å; S235-W237 PolarHBondContact O-N 3.23Å |
| 236 | Q | 61 | Low | 69.4 | Low | 87 Ų | 87 | 85.9 Ų | 85.9 | 41% | 0.407 | 43% | 0.432 | S | S | . | . | trans | 57.2 | -12.7 | 175.4 | -62.7 | -62.9 | -62.2 | 0 | 0 | 118 | S233 H234 F238 R239 | S233-Q236 PolarHBondContact O-NE2 3.03Å; H234-Q236 PolarHBondContact O-N 3.29Å; H234-Q236 VanDerWaalsContact O-N 3.1Å; Q236-F238 PolarHBondContact O-N 2.93Å; Q236-F238 VanDerWaalsContact O-N 3.16Å; Q236-R239 VanDerWaalsContact NE2-NH2 3.2Å | ||
| 237 | W | 56.9 | Low | 69.2 | Low | 224 Ų | 224 | 87.1 Ų | 87.1 | 85% | 0.848 | 44% | 0.436 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -62.9 | -24.8 | -173.4 | -85.1 | 36.3 | 0 | 0 | 0 | 114.3 | S235 | S235-W237 PolarHBondContact O-N 3.23Š|
| 238 | F | 56.2 | Low | 69 | Low | 79 Ų | 79 | 85.8 Ų | 85.8 | 35% | 0.346 | 42% | 0.422 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -123.5 | 19.4 | -172.6 | -63.8 | -72.5 | 0 | 0 | 0 | 114.4 | V232 Q236 A240 N241 L244 I248 | V232-F238 HydrophobicContact CG1-CD2 4.47Å; Q236-F238 PolarHBondContact O-N 2.93Å; Q236-F238 VanDerWaalsContact O-N 3.16Å; F238-A240 PolarHBondContact O-N 3.1Å; F238-N241 PolarHBondContact O-N 2.98Å; F238-L244 HydrophobicContact CD1-CD2 3.55Å; F238-L244 HydrophobicContact CD1-CG 4.36Å; F238-L244 HydrophobicContact CE1-CD2 3.77Å; F238-L244 HydrophobicContact CG-CD2 4.49Å; F238-I248 HydrophobicContact CD2-CD1 4.37Å; F238-I248 HydrophobicContact CE2-CD1 4.06Å; F238-I248 HydrophobicContact CZ-CD1 4.15Å |
| 239 | R | 52.3 | Low | 68.8 | Low | 201 Ų | 201 | 85.1 Ų | 85.1 | 76% | 0.758 | 42% | 0.418 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -54.9 | -16.3 | -176.9 | -101.1 | -162.8 | 176.2 | 162.1 | -3.5 | 114.9 | Q236 | Q236-R239 VanDerWaalsContact NE2-NH2 3.2Š|
| 240 | A | 53.9 | Low | 68.8 | Low | 91 Ų | 91 | 83.1 Ų | 83.1 | 75% | 0.752 | 42% | 0.417 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -78.2 | -20.5 | 178.3 | 0 | 0 | 0 | 0 | 0 | 115 | F238 | F238-A240 PolarHBondContact O-N 3.1Š|
| 241 | N | 63.7 | Low | 68.8 | Low | 74 Ų | 74 | 81.7 Ų | 81.7 | 40% | 0.396 | 41% | 0.414 | S | S | . | . | trans | -138.8 | 90.8 | -169.4 | -79.6 | -43.5 | 0 | 0 | 0 | 113.1 | F238 W243 L244 T245 | F238-N241 PolarHBondContact O-N 2.98Å; N241-W243 VanDerWaalsContact CG-NE1 3.31Å; N241-W243 PolarHBondContact O-N 2.84Å; N241-W243 PolarHBondContact OD1-NE1 3.17Å; N241-L244 HydrophobicContact CB-CB 3.96Å; N241-L244 PolarHBondContact O-N 3.44Å; N241-T245 PolarHBondContact O-N 2.96Å | ||
| 242 | A | 68.6 | Low | 69 | Low | 56 Ų | 56 | 77.8 Ų | 77.8 | 46% | 0.463 | 40% | 0.404 | S | S | . | . | H | α-helix | trans | -55.6 | -26.5 | 178.8 | 0 | 0 | 0 | 0 | 0 | 114.3 | A246 | A242-A246 PolarHBondContact O-N 3.22Å |
| 243 | W | 68.6 | Low | 69.2 | Low | 139 Ų | 139 | 77.5 Ų | 77.5 | 53% | 0.527 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -73.2 | -41.6 | 177.7 | 69.8 | -88 | 0 | 0 | 0 | 112.2 | N241 A246 L247 | N241-W243 VanDerWaalsContact CG-NE1 3.31Å; N241-W243 PolarHBondContact O-N 2.84Å; N241-W243 PolarHBondContact OD1-NE1 3.17Å; W243-A246 PolarHBondContact O-N 3.46Å; W243-L247 HydrophobicContact CZ3-CD2 4.3Å; W243-L247 WeakPolarHBondContact O-CB 3.3Å; W243-L247 PolarHBondContact O-N 2.97Å |
| 244 | L | 70.4 | Confident | 69.7 | Low | 42 Ų | 42 | 75.5 Ų | 75.5 | 22% | 0.22 | 39% | 0.391 | C | S | . | . | H | α-helix | trans | -69.3 | -40.1 | -177.9 | -175 | 63.3 | 0 | 0 | 0 | 110.7 | F238 N241 A246 L247 I248 | F238-L244 HydrophobicContact CD1-CD2 3.55Å; F238-L244 HydrophobicContact CD1-CG 4.36Å; F238-L244 HydrophobicContact CE1-CD2 3.77Å; F238-L244 HydrophobicContact CG-CD2 4.49Å; N241-L244 HydrophobicContact CB-CB 3.96Å; N241-L244 PolarHBondContact O-N 3.44Å; L244-A246 PolarHBondContact O-N 2.89Å; L244-L247 PolarHBondContact O-N 2.72Å; L244-I248 HydrophobicContact CD1-CD1 4.34Å; L244-I248 HydrophobicContact CG-CD1 4.06Å; L244-I248 WeakPolarHBondContact O-CG1 3.45Å; L244-I248 PolarHBondContact O-N 3.1Å |
| 245 | T | 73.6 | Confident | 70.4 | Confident | 22 Ų | 22 | 70.9 Ų | 70.9 | 14% | 0.135 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -58.3 | -45.8 | 171.6 | -62.1 | 0 | 0 | 0 | 0 | 111.9 | V232 N241 L247 A249 | V232-T245 HydrophobicContact CB-CG2 4Å; V232-T245 HydrophobicContact CG1-CG2 3.45Å; V232-T245 VanDerWaalsContact CG1-CG2 3.45Å; N241-T245 PolarHBondContact O-N 2.96Å; T245-L247 VanDerWaalsContact C-N 3.34Å; T245-A249 VanDerWaalsContact O-CB 3.29Å; T245-A249 WeakPolarHBondContact O-CB 3.42Å; T245-A249 PolarHBondContact O-N 2.98Å |
| 246 | A | 71.6 | Confident | 71.4 | Confident | 25 Ų | 25 | 69.6 Ų | 69.6 | 21% | 0.207 | 37% | 0.367 | C | S | . | . | H | α-helix | trans | -65 | -38.7 | 177.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | A242 W243 L244 A250 | A242-A246 PolarHBondContact O-N 3.22Å; W243-A246 PolarHBondContact O-N 3.46Å; L244-A246 PolarHBondContact O-N 2.89Å; A246-A250 WeakPolarHBondContact O-CB 3.48Å; A246-A250 PolarHBondContact O-N 3.35Å |
| 247 | L | 73.8 | Confident | 72.5 | Confident | 86 Ų | 86 | 66.1 Ų | 66.1 | 45% | 0.45 | 35% | 0.351 | S | S | . | . | H | α-helix | trans | -66.4 | -45 | 178.9 | -177 | 63.7 | 0 | 0 | 0 | 112.4 | W243 L244 T245 A250 S251 | W243-L247 HydrophobicContact CZ3-CD2 4.3Å; W243-L247 WeakPolarHBondContact O-CB 3.3Å; W243-L247 PolarHBondContact O-N 2.97Å; L244-L247 PolarHBondContact O-N 2.72Å; T245-L247 VanDerWaalsContact C-N 3.34Å; L247-A250 PolarHBondContact O-N 3.05Å; L247-S251 WeakPolarHBondContact O-CB 3.38Å; L247-S251 PolarHBondContact O-N 3.36Å; L247-S251 PolarHBondContact O-OG 2.67Å |
| 248 | I | 77.9 | Confident | 73.9 | Confident | 47 Ų | 47 | 55.6 Ų | 55.6 | 24% | 0.241 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -64.4 | -45.6 | 176.9 | -67.6 | 168.1 | 0 | 0 | 0 | 109.8 | V232 F238 L244 A250 S251 I252 | V232-I248 HydrophobicContact CG2-CG2 4.35Å; F238-I248 HydrophobicContact CD2-CD1 4.37Å; F238-I248 HydrophobicContact CE2-CD1 4.06Å; F238-I248 HydrophobicContact CZ-CD1 4.15Å; L244-I248 HydrophobicContact CD1-CD1 4.34Å; L244-I248 HydrophobicContact CG-CD1 4.06Å; L244-I248 WeakPolarHBondContact O-CG1 3.45Å; L244-I248 PolarHBondContact O-N 3.1Å; I248-A250 PolarHBondContact O-N 2.9Å; I248-S251 PolarHBondContact O-N 3.35Å; I248-I252 HydrophobicContact CG2-CD1 3.8Å; I248-I252 WeakPolarHBondContact O-CG1 3.33Å; I248-I252 PolarHBondContact O-N 3.45Å |
| 249 | A | 75.7 | Confident | 75.4 | Confident | 0 Ų | 0 | 55.5 Ų | 55.5 | 0% | 0 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -61 | -43.4 | 177 | 0 | 0 | 0 | 0 | 0 | 112.3 | F225 T228 K229 T245 S253 | F225-A249 HydrophobicContact CE2-CB 4.16Å; T228-A249 HydrophobicContact CG2-CB 4Å; K229-A249 HydrophobicContact CB-CB 4.5Å; T245-A249 VanDerWaalsContact O-CB 3.29Å; T245-A249 WeakPolarHBondContact O-CB 3.42Å; T245-A249 PolarHBondContact O-N 2.98Å; A249-S253 WeakPolarHBondContact O-CB 3.46Å; A249-S253 PolarHBondContact O-N 3.39Å |
| 250 | A | 74.9 | Confident | 77.2 | Confident | 39 Ų | 39 | 48.6 Ų | 48.6 | 32% | 0.322 | 30% | 0.295 | S | S | . | . | H | α-helix | trans | -65.5 | -36.2 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | A246 L247 I248 G254 | A246-A250 WeakPolarHBondContact O-CB 3.48Å; A246-A250 PolarHBondContact O-N 3.35Å; L247-A250 PolarHBondContact O-N 3.05Å; I248-A250 PolarHBondContact O-N 2.9Å; A250-G254 PolarHBondContact O-N 3.26Å |
| 251 | S | 80.3 | Confident | 78.8 | Confident | 68 Ų | 68 | 45.6 Ų | 45.6 | 48% | 0.476 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -69.5 | -46.8 | 179.6 | -59.4 | 0 | 0 | 0 | 0 | 111.8 | L247 I248 G254 V255 | L247-S251 WeakPolarHBondContact O-CB 3.38Å; L247-S251 PolarHBondContact O-N 3.36Å; L247-S251 PolarHBondContact O-OG 2.67Å; I248-S251 PolarHBondContact O-N 3.35Å; S251-G254 PolarHBondContact O-N 3.45Å; S251-V255 WeakPolarHBondContact O-CG2 3.25Å; S251-V255 PolarHBondContact O-N 3.06Å |
| 252 | I | 83.3 | Confident | 80.1 | Confident | 75 Ų | 75 | 42 Ų | 42 | 39% | 0.385 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -63.9 | -45.4 | 176.7 | -66.6 | 168.8 | 0 | 0 | 0 | 110.1 | T228 I248 G254 V255 A256 | T228-I252 HydrophobicContact CG2-CB 3.96Å; T228-I252 HydrophobicContact CG2-CD1 3.71Å; T228-I252 HydrophobicContact CG2-CG1 4.41Å; T228-I252 HydrophobicContact CG2-CG2 4.02Å; I248-I252 HydrophobicContact CG2-CD1 3.8Å; I248-I252 WeakPolarHBondContact O-CG1 3.33Å; I248-I252 PolarHBondContact O-N 3.45Å; I252-G254 VanDerWaalsContact C-N 3.33Å; I252-G254 PolarHBondContact O-N 2.9Å; I252-V255 PolarHBondContact O-N 3.14Å; I252-A256 PolarHBondContact O-N 3.43Å |
| 253 | S | 81.8 | Confident | 81.1 | Confident | 4 Ų | 4 | 40.3 Ų | 40.3 | 3% | 0.028 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -59.2 | -44.2 | 174.6 | 179.1 | 0 | 0 | 0 | 0 | 111.5 | Q221 T224 A249 V255 A256 V257 | Q221-S253 PolarHBondContact O-OG 3.11Å; T224-S253 WeakPolarHBondContact OG1-CA 3.37Å; T224-S253 WeakPolarHBondContact OG1-CB 3.47Å; T224-S253 PolarHBondContact OG1-OG 2.95Å; A249-S253 WeakPolarHBondContact O-CB 3.46Å; A249-S253 PolarHBondContact O-N 3.39Å; S253-V255 PolarHBondContact O-N 3.42Å; S253-A256 PolarHBondContact O-N 3.21Å; S253-V257 WeakPolarHBondContact O-CB 3.4Å; S253-V257 VanDerWaalsContact O-CG2 3.24Å; S253-V257 WeakPolarHBondContact O-CG2 3.24Å; S253-V257 PolarHBondContact O-N 3.29Å |
| 254 | G | 81.2 | Confident | 82.2 | Confident | 15 Ų | 15 | 36 Ų | 36 | 16% | 0.155 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -60.3 | -40.6 | 177.8 | 0 | 0 | 0 | 0 | 0 | 113.6 | A250 S251 I252 A258 | A250-G254 PolarHBondContact O-N 3.26Å; S251-G254 PolarHBondContact O-N 3.45Å; I252-G254 VanDerWaalsContact C-N 3.33Å; I252-G254 PolarHBondContact O-N 2.9Å; G254-A258 WeakPolarHBondContact O-CB 3.25Å; G254-A258 PolarHBondContact O-N 3.01Å |
| 255 | V | 85.9 | Confident | 83.1 | Confident | 62 Ų | 62 | 34 Ų | 34 | 38% | 0.376 | 21% | 0.205 | S | C | . | . | H | α-helix | trans | -64.2 | -47.6 | 173.8 | 173.3 | 0 | 0 | 0 | 0 | 110.7 | S251 I252 S253 V257 A258 I259 F312 | S251-V255 WeakPolarHBondContact O-CG2 3.25Å; S251-V255 PolarHBondContact O-N 3.06Å; I252-V255 PolarHBondContact O-N 3.14Å; S253-V255 PolarHBondContact O-N 3.42Å; V255-V257 VanDerWaalsContact C-N 3.34Å; V255-V257 PolarHBondContact O-N 3.39Å; V255-A258 PolarHBondContact O-N 3.46Å; V255-I259 HydrophobicContact CG1-CD1 3.85Å; V255-I259 WeakPolarHBondContact O-CG1 3.33Å; V255-I259 PolarHBondContact O-N 3.36Å; V255-F312 HydrophobicContact CG2-CE2 3.71Å; V255-F312 HydrophobicContact CG2-CZ 4.47Å |
| 256 | A | 86.9 | Confident | 83.9 | Confident | 26 Ų | 26 | 33 Ų | 33 | 22% | 0.215 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -63.5 | -39.4 | -179.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | T224 I252 S253 I259 T260 | T224-A256 HydrophobicContact CG2-CB 3.47Å; T224-A256 VanDerWaalsContact CG2-CB 3.47Å; I252-A256 PolarHBondContact O-N 3.43Å; S253-A256 PolarHBondContact O-N 3.21Å; A256-I259 PolarHBondContact O-N 3.2Å; A256-T260 WeakPolarHBondContact O-CB 3.35Å; A256-T260 WeakPolarHBondContact O-CG2 3.37Å; A256-T260 PolarHBondContact O-N 2.94Å; A256-T260 PolarHBondContact O-OG1 2.91Å |
| 257 | V | 85.2 | Confident | 84.9 | Confident | 13 Ų | 13 | 31.9 Ų | 31.9 | 8% | 0.079 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -63.6 | -43.9 | 172.8 | 172.1 | 0 | 0 | 0 | 0 | 110.9 | A220 Q221 S253 V255 I259 T260 M261 | A220-V257 HydrophobicContact CB-CG2 4.26Å; Q221-V257 HydrophobicContact CB-CG2 3.66Å; Q221-V257 HydrophobicContact CG-CG2 4.18Å; S253-V257 WeakPolarHBondContact O-CB 3.4Å; S253-V257 VanDerWaalsContact O-CG2 3.24Å; S253-V257 WeakPolarHBondContact O-CG2 3.24Å; S253-V257 PolarHBondContact O-N 3.29Å; V255-V257 VanDerWaalsContact C-N 3.34Å; V255-V257 PolarHBondContact O-N 3.39Å; V257-I259 VanDerWaalsContact C-N 3.35Å; V257-I259 PolarHBondContact O-N 3.2Å; V257-T260 WeakPolarHBondContact CA-OG1 3.07Å; V257-T260 PolarHBondContact O-N 2.94Å; V257-T260 PolarHBondContact O-OG1 3.17Å; V257-M261 HydrophobicContact CG1-CB 4.48Å; V257-M261 WeakPolarHBondContact O-CB 3.44Å; V257-M261 PolarHBondContact O-N 3.19Å |
| 258 | A | 85.4 | Confident | 85.7 | Confident | 4 Ų | 4 | 27.8 Ų | 27.8 | 3% | 0.033 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -60.3 | -45.1 | 177.4 | 0 | 0 | 0 | 0 | 0 | 111.5 | G254 V255 T262 V311 | G254-A258 WeakPolarHBondContact O-CB 3.25Å; G254-A258 PolarHBondContact O-N 3.01Å; V255-A258 PolarHBondContact O-N 3.46Å; A258-T262 VanDerWaalsContact O-CB 3.28Å; A258-T262 WeakPolarHBondContact O-CB 3.2Å; A258-T262 WeakPolarHBondContact O-CG2 3.49Å; A258-T262 PolarHBondContact O-N 3Å; A258-T262 PolarHBondContact O-OG1 3.19Å; A258-V311 HydrophobicContact CB-CG1 4.3Å |
| 259 | I | 89.3 | Confident | 86.2 | Confident | 77 Ų | 77 | 25.5 Ų | 25.5 | 40% | 0.395 | 16% | 0.157 | S | C | . | . | H | α-helix | trans | -63 | -46.4 | 178.7 | -66.4 | 166.9 | 0 | 0 | 0 | 110.9 | V255 A256 V257 T262 P263 Y305 | V255-I259 HydrophobicContact CG1-CD1 3.85Å; V255-I259 WeakPolarHBondContact O-CG1 3.33Å; V255-I259 PolarHBondContact O-N 3.36Å; A256-I259 PolarHBondContact O-N 3.2Å; V257-I259 VanDerWaalsContact C-N 3.35Å; V257-I259 PolarHBondContact O-N 3.2Å; I259-T262 PolarHBondContact O-OG1 3.47Å; I259-T262 VanDerWaalsContact O-OG1 3.08Å; I259-P263 WeakPolarHBondContact O-CD 3.35Å; I259-Y305 HydrophobicContact CG2-CE1 4.26Å; I259-Y305 WeakPolarHBondContact O-CE1 3.47Å |
| 260 | T | 88.5 | Confident | 86.9 | Confident | 56 Ų | 56 | 25.5 Ų | 25.5 | 34% | 0.344 | 16% | 0.157 | S | C | . | . | H | α-helix | trans | -75.4 | -34.3 | -176.1 | 51 | 0 | 0 | 0 | 0 | 113.6 | A220 A256 V257 P263 F264 | A220-T260 VanDerWaalsContact CB-OG1 3.26Å; A220-T260 WeakPolarHBondContact CB-OG1 3.34Å; A256-T260 WeakPolarHBondContact O-CB 3.35Å; A256-T260 WeakPolarHBondContact O-CG2 3.37Å; A256-T260 PolarHBondContact O-N 2.94Å; A256-T260 PolarHBondContact O-OG1 2.91Å; V257-T260 WeakPolarHBondContact CA-OG1 3.07Å; V257-T260 PolarHBondContact O-N 2.94Å; V257-T260 PolarHBondContact O-OG1 3.17Å; T260-P263 WeakPolarHBondContact O-CD 3.48Å; T260-P263 WeakPolarHBondContact O-CG 3.37Å; T260-F264 WeakPolarHBondContact O-CD2 3.4Å |
| 261 | M | 88.3 | Confident | 87.6 | Confident | 27 Ų | 27 | 24 Ų | 24 | 13% | 0.133 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -85.7 | -28.3 | -176.1 | -167.9 | -176.9 | 77.8 | 0 | 0 | 113.3 | R213 V257 F264 D265 | R213-M261 HydrophobicContact CG-CG 4.17Å; V257-M261 HydrophobicContact CG1-CB 4.48Å; V257-M261 WeakPolarHBondContact O-CB 3.44Å; V257-M261 PolarHBondContact O-N 3.19Å; M261-F264 PolarHBondContact O-N 3.49Å; M261-F264 VanDerWaalsContact O-N 3.11Å; M261-D265 VanDerWaalsContact CE-OD2 3.3Å; M261-D265 WeakPolarHBondContact CE-OD2 3.2Å; M261-D265 PolarHBondContact O-N 2.97Å |
| 262 | T | 89.9 | Confident | 88 | Confident | 0 Ų | 0 | 20.9 Ų | 20.9 | 0% | 0 | 12% | 0.121 | C | C | . | . | H | α-helix | trans | -53.3 | -43.4 | -178.8 | 43.3 | 0 | 0 | 0 | 0 | 115.8 | A258 I259 F264 D265 V266 Y305 M308 V311 | A258-T262 VanDerWaalsContact O-CB 3.28Å; A258-T262 WeakPolarHBondContact O-CB 3.2Å; A258-T262 WeakPolarHBondContact O-CG2 3.49Å; A258-T262 PolarHBondContact O-N 3Å; A258-T262 PolarHBondContact O-OG1 3.19Å; I259-T262 PolarHBondContact O-OG1 3.47Å; I259-T262 VanDerWaalsContact O-OG1 3.08Å; T262-F264 VanDerWaalsContact C-N 3.32Å; T262-F264 PolarHBondContact O-N 3.41Å; T262-D265 WeakPolarHBondContact O-CB 3.43Å; T262-D265 PolarHBondContact O-N 3.5Å; T262-V266 WeakPolarHBondContact O-CG2 3.11Å; T262-V266 PolarHBondContact O-N 2.93Å; T262-Y305 WeakPolarHBondContact OG1-CD1 3.26Å; T262-M308 HydrophobicContact CG2-CB 3.94Å; T262-M308 HydrophobicContact CG2-CG 4.01Å; T262-V311 HydrophobicContact CG2-CB 4.27Å; T262-V311 HydrophobicContact CG2-CG1 4.25Å; T262-V311 HydrophobicContact CG2-CG2 4.22Å |
| 263 | P | 91.1 | Very high | 88.2 | Confident | 19 Ų | 19 | 17.3 Ų | 17.3 | 12% | 0.123 | 10% | 0.103 | C | C | . | . | H | α-helix | trans | -60.9 | -40.8 | 176.1 | 21.5 | -33.6 | 0 | 0 | 0 | 112.5 | I259 T260 V266 I267 L304 | I259-P263 WeakPolarHBondContact O-CD 3.35Å; T260-P263 WeakPolarHBondContact O-CD 3.48Å; T260-P263 WeakPolarHBondContact O-CG 3.37Å; P263-V266 PolarHBondContact O-N 3.21Å; P263-I267 WeakPolarHBondContact O-CD1 3.27Å; P263-I267 VanDerWaalsContact O-CG1 3.32Å; P263-I267 WeakPolarHBondContact O-CG1 3.41Å; P263-I267 PolarHBondContact O-N 3.38Å; P263-I267 VanDerWaalsContact O-N 3.16Å; P263-L304 WeakPolarHBondContact CA-O 3.26Å; P263-L304 HydrophobicContact CB-CB 4.06Å; P263-L304 HydrophobicContact CB-CD1 4.5Å |
| 264 | F | 91.5 | Very high | 88.3 | Confident | 49 Ų | 49 | 17.5 Ų | 17.5 | 22% | 0.215 | 10% | 0.103 | C | C | . | . | H | α-helix | trans | -68.9 | -35.6 | 176.9 | -63.7 | -88.4 | 0 | 0 | 0 | 111.9 | P212 R213 V216 T260 M261 T262 S268 F288 | P212-F264 HydrophobicContact CB-CD1 3.94Å; P212-F264 HydrophobicContact CB-CE1 4.14Å; R213-F264 HydrophobicContact CB-CB 3.93Å; R213-F264 HydrophobicContact CG-CB 4.34Å; V216-F264 HydrophobicContact CB-CD2 4.22Å; V216-F264 HydrophobicContact CB-CE2 4.15Å; V216-F264 HydrophobicContact CB-CZ 4.47Å; V216-F264 HydrophobicContact CG1-CD2 3.94Å; V216-F264 HydrophobicContact CG1-CE2 3.74Å; V216-F264 HydrophobicContact CG1-CZ 4.42Å; V216-F264 HydrophobicContact CG2-CD1 4.44Å; V216-F264 HydrophobicContact CG2-CD2 4.3Å; V216-F264 HydrophobicContact CG2-CE1 4Å; V216-F264 HydrophobicContact CG2-CE2 3.86Å; V216-F264 HydrophobicContact CG2-CZ 3.7Å; T260-F264 WeakPolarHBondContact O-CD2 3.4Å; M261-F264 PolarHBondContact O-N 3.49Å; M261-F264 VanDerWaalsContact O-N 3.11Å; T262-F264 VanDerWaalsContact C-N 3.32Å; T262-F264 PolarHBondContact O-N 3.41Å; F264-S268 WeakPolarHBondContact O-CB 3.23Å; F264-S268 PolarHBondContact O-N 2.98Å; F264-F288 AromaticContact CD1-CE2 3.88Å; F264-F288 HydrophobicContact CD1-CE2 3.88Å; F264-F288 AromaticContact CD1-CZ 3.5Å; F264-F288 HydrophobicContact CD1-CZ 3.5Å; F264-F288 VanDerWaalsContact CD1-CZ 3.5Å; F264-F288 HydrophobicContact CE1-CE1 4.31Å; F264-F288 HydrophobicContact CE1-CE2 4.38Å; F264-F288 AromaticContact CE1-CZ 3.58Å; F264-F288 HydrophobicContact CE1-CZ 3.58Å |
| 265 | D | 89.6 | Confident | 88.3 | Confident | 0 Ų | 0 | 17.6 Ų | 17.6 | 0% | 0 | 10% | 0.101 | C | C | . | . | H | α-helix | trans | -61 | -47.5 | 173.8 | -77 | -6.7 | 0 | 0 | 0 | 111.5 | K68 R213 M261 T262 S268 T269 | K68-D265 WeakPolarHBondContact CE-OD2 3.46Å; K68-D265 IonicContact NZ-OD2 3.95Å; K68-D265 PolarHBondContact NZ-OD2 3.39Å; R213-D265 WeakPolarHBondContact CD-OD1 3.42Å; R213-D265 WeakPolarHBondContact CG-OD1 3.49Å; R213-D265 IonicContact CZ-OD1 3.29Å; R213-D265 IonicContact NE-OD1 2.71Å; R213-D265 PolarHBondContact NE-OD1 2.89Å; R213-D265 IonicContact NH1-OD1 2.95Å; R213-D265 IonicContact NH2-OD1 2.68Å; M261-D265 VanDerWaalsContact CE-OD2 3.3Å; M261-D265 WeakPolarHBondContact CE-OD2 3.2Å; M261-D265 PolarHBondContact O-N 2.97Å; T262-D265 WeakPolarHBondContact O-CB 3.43Å; T262-D265 PolarHBondContact O-N 3.5Å; D265-S268 PolarHBondContact O-N 3.43Å; D265-T269 WeakPolarHBondContact O-CB 3.42Å; D265-T269 PolarHBondContact O-N 3.08Å; D265-T269 PolarHBondContact O-OG1 2.84Å |
| 266 | V | 90.6 | Very high | 87.7 | Confident | 0 Ų | 0 | 15.1 Ų | 15.1 | 0% | 0 | 9% | 0.086 | C | C | . | . | H | α-helix | trans | -62 | -47.3 | -179.1 | 172.7 | 0 | 0 | 0 | 0 | 110.8 | Q72 T262 P263 T269 R270 L304 K306 | Q72-V266 HydrophobicContact CB-CG2 4.46Å; Q72-V266 HydrophobicContact CG-CG2 3.94Å; T262-V266 WeakPolarHBondContact O-CG2 3.11Å; T262-V266 PolarHBondContact O-N 2.93Å; P263-V266 PolarHBondContact O-N 3.21Å; V266-T269 PolarHBondContact O-N 2.85Å; V266-R270 WeakPolarHBondContact O-CD 3.44Å; V266-R270 WeakPolarHBondContact O-CG 3.37Å; V266-R270 PolarHBondContact O-N 2.96Å; V266-R270 VanDerWaalsContact O-N 3.09Å; V266-L304 WeakPolarHBondContact CG2-O 3.47Å; V266-K306 VanDerWaalsContact CG2-O 3.24Å; V266-K306 WeakPolarHBondContact CG2-O 3.2Å |
| 267 | I | 91.1 | Very high | 87.1 | Confident | 2 Ų | 2 | 16.9 Ų | 16.9 | 1% | 0.01 | 9% | 0.092 | C | C | . | . | H | α-helix | trans | -63.3 | -45.7 | 179.2 | -65.2 | 162.1 | 0 | 0 | 0 | 110.6 | P263 R270 L271 F288 C291 L292 L304 | P263-I267 WeakPolarHBondContact O-CD1 3.27Å; P263-I267 VanDerWaalsContact O-CG1 3.32Å; P263-I267 WeakPolarHBondContact O-CG1 3.41Å; P263-I267 PolarHBondContact O-N 3.38Å; P263-I267 VanDerWaalsContact O-N 3.16Å; I267-R270 PolarHBondContact O-N 2.83Å; I267-L271 VanDerWaalsContact O-CB 3.31Å; I267-L271 WeakPolarHBondContact O-CB 3.47Å; I267-L271 PolarHBondContact O-N 3.44Å; I267-F288 HydrophobicContact CB-CD2 4.39Å; I267-F288 HydrophobicContact CB-CE2 3.99Å; I267-F288 HydrophobicContact CD1-CE2 3.95Å; I267-F288 HydrophobicContact CD1-CZ 3.83Å; I267-F288 HydrophobicContact CG2-CD2 3.42Å; I267-F288 VanDerWaalsContact CG2-CD2 3.42Å; I267-F288 HydrophobicContact CG2-CE2 3.51Å; I267-F288 HydrophobicContact CG2-CG 4.26Å; I267-F288 HydrophobicContact CG2-CZ 4.38Å; I267-C291 HydrophobicContact CG2-CB 3.98Å; I267-L292 HydrophobicContact CD1-CB 3.98Å; I267-L292 HydrophobicContact CD1-CD1 3.69Å; I267-L292 HydrophobicContact CD1-CG 4.38Å; I267-L304 HydrophobicContact CD1-CD2 4.08Å; I267-L304 HydrophobicContact CG1-CD2 4.06Å |
| 268 | S | 90.6 | Very high | 86.2 | Confident | 0 Ų | 0 | 24.1 Ų | 24.1 | 0% | 0 | 12% | 0.124 | C | C | . | . | H | α-helix | trans | -59.3 | -49.9 | 178.1 | -177.6 | 0 | 0 | 0 | 0 | 111.1 | F264 D265 R270 L271 Y272 | F264-S268 WeakPolarHBondContact O-CB 3.23Å; F264-S268 PolarHBondContact O-N 2.98Å; D265-S268 PolarHBondContact O-N 3.43Å; S268-R270 VanDerWaalsContact C-N 3.31Å; S268-R270 PolarHBondContact O-N 2.85Å; S268-L271 PolarHBondContact O-N 3.18Å; S268-Y272 WeakPolarHBondContact O-CD2 3.49Å; S268-Y272 PolarHBondContact O-N 3.09Å; S268-Y272 WeakPolarHBondContact OG-CD2 3.16Å; S268-Y272 WeakPolarHBondContact OG-CE2 3.26Å |
| 269 | T | 90 | Very high | 85 | Confident | 0 Ų | 0 | 31.7 Ų | 31.7 | 0% | 0 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -58.8 | -40.8 | 179.8 | -62.3 | 0 | 0 | 0 | 0 | 112.3 | T69 Q72 L73 T166 D265 V266 N273 | T69-T269 HydrophobicContact CG2-CG2 4.38Å; Q72-T269 HydrophobicContact CB-CG2 4.18Å; Q72-T269 PolarHBondContact OE1-OG1 3.06Å; L73-T269 HydrophobicContact CD1-CG2 4.44Å; L73-T269 HydrophobicContact CD2-CG2 4.08Å; L73-T269 HydrophobicContact CG-CG2 4.04Å; T166-T269 HydrophobicContact CG2-CG2 4.07Å; D265-T269 WeakPolarHBondContact O-CB 3.42Å; D265-T269 PolarHBondContact O-N 3.08Å; D265-T269 PolarHBondContact O-OG1 2.84Å; V266-T269 PolarHBondContact O-N 2.85Å; T269-N273 WeakPolarHBondContact O-CB 3.44Å; T269-N273 PolarHBondContact O-N 3.12Å |
| 270 | R | 90.4 | Very high | 83.8 | Confident | 0 Ų | 0 | 32.7 Ų | 32.7 | 0% | 0 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -69.6 | -41.8 | 177.3 | -72.6 | 167.2 | 174.1 | -120.2 | 6.8 | 112.9 | Q72 L73 E76 V266 I267 S268 Y272 N273 Q274 Y285 E299 | Q72-R270 PolarHBondContact O-NE 3.42Å; Q72-R270 VanDerWaalsContact O-NE 3.15Å; Q72-R270 PolarHBondContact O-NH2 3.01Å; L73-R270 HydrophobicContact CD2-CG 4.04Å; E76-R270 WeakPolarHBondContact OE1-CG 3.06Å; V266-R270 WeakPolarHBondContact O-CD 3.44Å; V266-R270 WeakPolarHBondContact O-CG 3.37Å; V266-R270 PolarHBondContact O-N 2.96Å; V266-R270 VanDerWaalsContact O-N 3.09Å; I267-R270 PolarHBondContact O-N 2.83Å; S268-R270 VanDerWaalsContact C-N 3.31Å; S268-R270 PolarHBondContact O-N 2.85Å; R270-Y272 VanDerWaalsContact C-N 3.27Å; R270-Y272 PolarHBondContact O-N 3.11Å; R270-N273 PolarHBondContact O-N 3.04Å; R270-Q274 PolarHBondContact O-N 3.42Å; R270-Y285 HydrophobicContact CB-CE2 3.97Å; R270-Y285 PolarHBondContact NH1-OH 3.41Å; R270-E299 IonicContact CZ-OE1 3.53Å; R270-E299 IonicContact CZ-OE2 2.8Å; R270-E299 IonicContact NH1-OE1 3.96Å; R270-E299 PolarHBondContact NH1-OE1 3.46Å; R270-E299 IonicContact NH1-OE2 3.24Å; R270-E299 IonicContact NH2-OE1 2.67Å; R270-E299 PolarHBondContact NH2-OE1 3.39Å; R270-E299 IonicContact NH2-OE2 3.65Å; R270-E299 PolarHBondContact NH2-OE2 3.08Å |
| 271 | L | 88.9 | Confident | 82.7 | Confident | 7 Ų | 7 | 36.9 Ų | 36.9 | 4% | 0.037 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -66.3 | -30.9 | 177.6 | -163.3 | 72.8 | 0 | 0 | 0 | 112.3 | N208 I267 S268 Q274 | N208-L271 HydrophobicContact CB-CD2 4.41Å; I267-L271 VanDerWaalsContact O-CB 3.31Å; I267-L271 WeakPolarHBondContact O-CB 3.47Å; I267-L271 PolarHBondContact O-N 3.44Å; S268-L271 PolarHBondContact O-N 3.18Å; L271-Q274 VanDerWaalsContact O-CG 3.3Å; L271-Q274 WeakPolarHBondContact O-CG 3.33Å; L271-Q274 PolarHBondContact O-NE2 3.42Å |
| 272 | Y | 87.8 | Confident | 81.9 | Confident | 3 Ų | 3 | 36.4 Ų | 36.4 | 1% | 0.012 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -75.8 | -36.2 | 171.5 | -82.6 | -68.2 | 0 | 0 | 0 | 112.5 | S159 Y162 L163 H167 R205 G206 A210 S268 R270 | S159-Y272 PolarHBondContact OG-OH 2.94Å; Y162-Y272 HydrophobicContact CD1-CD1 4.38Å; Y162-Y272 AromaticContact CD1-CD2 3.54Å; Y162-Y272 HydrophobicContact CD1-CD2 3.54Å; Y162-Y272 HydrophobicContact CD1-CE1 4.19Å; Y162-Y272 AromaticContact CD1-CE2 3.33Å; Y162-Y272 HydrophobicContact CD1-CE2 3.33Å; Y162-Y272 HydrophobicContact CD1-CG 4.1Å; Y162-Y272 AromaticContact CD1-CZ 3.69Å; Y162-Y272 AromaticContact CE1-CD2 3.55Å; Y162-Y272 HydrophobicContact CE1-CD2 3.55Å; Y162-Y272 AromaticContact CE1-CE2 3.65Å; Y162-Y272 HydrophobicContact CE1-CE2 3.65Å; Y162-Y272 HydrophobicContact CE1-CG 4.31Å; Y162-Y272 HydrophobicContact CG-CE2 4.45Å; L163-Y272 HydrophobicContact CB-CD1 3.73Å; L163-Y272 HydrophobicContact CB-CE1 3.9Å; L163-Y272 HydrophobicContact CD1-CD1 3.6Å; L163-Y272 HydrophobicContact CD1-CE1 4.44Å; L163-Y272 HydrophobicContact CD1-CG 4.48Å; L163-Y272 WeakPolarHBondContact CD1-O 3.39Å; L163-Y272 HydrophobicContact CG-CD1 4.26Å; H167-Y272 PolarHBondContact NE2-O 3.08Å; R205-Y272 WeakPolarHBondContact O-CD1 3.47Å; R205-Y272 WeakPolarHBondContact O-CE1 3.48Å; G206-Y272 WeakPolarHBondContact O-CE2 3.19Å; A210-Y272 HydrophobicContact CB-CE2 3.95Å; A210-Y272 VanDerWaalsContact CB-OH 3.27Å; A210-Y272 WeakPolarHBondContact CB-OH 3.11Å; S268-Y272 WeakPolarHBondContact O-CD2 3.49Å; S268-Y272 PolarHBondContact O-N 3.09Å; S268-Y272 WeakPolarHBondContact OG-CD2 3.16Å; S268-Y272 WeakPolarHBondContact OG-CE2 3.26Å; R270-Y272 VanDerWaalsContact C-N 3.27Å; R270-Y272 PolarHBondContact O-N 3.11Å |
| 273 | N | 88.1 | Confident | 81.3 | Confident | 0 Ų | 0 | 43.6 Ų | 43.6 | 0% | 0 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -91.3 | -4.8 | -175.9 | -164.1 | 65.1 | 0 | 0 | 0 | 115.3 | L73 T166 A170 H180 H182 T269 R270 | L73-N273 HydrophobicContact CD1-CB 3.98Å; L73-N273 WeakPolarHBondContact CD1-ND2 3.13Å; L73-N273 HydrophobicContact CD2-CB 3.65Å; L73-N273 HydrophobicContact CG-CB 4.47Å; T166-N273 HydrophobicContact CG2-CB 4.47Å; A170-N273 WeakPolarHBondContact CB-OD1 3.41Å; H180-N273 PolarHBondContact N-ND2 3.41Å; H180-N273 PolarHBondContact O-ND2 2.9Å; H180-N273 PolarHBondContact O-OD1 3.15Å; H182-N273 PolarHBondContact CE1-O 2.7Å; T269-N273 WeakPolarHBondContact O-CB 3.44Å; T269-N273 PolarHBondContact O-N 3.12Å; R270-N273 PolarHBondContact O-N 3.04Å |
| 274 | Q | 83.6 | Confident | 80.7 | Confident | 7 Ų | 7 | 45 Ų | 45 | 3% | 0.033 | 21% | 0.209 | C | C | . | . | P | Polyproline II helix | trans | -68.8 | 146 | -176.9 | 54.6 | 163.9 | -23.3 | 0 | 0 | 113.5 | R205 R270 L271 L284 Y285 | R205-Q274 PolarHBondContact NH2-O 3.08Å; R270-Q274 PolarHBondContact O-N 3.42Å; L271-Q274 VanDerWaalsContact O-CG 3.3Å; L271-Q274 WeakPolarHBondContact O-CG 3.33Å; L271-Q274 PolarHBondContact O-NE2 3.42Å; Q274-L284 HydrophobicContact CB-CB 4.21Å; Q274-L284 HydrophobicContact CB-CD1 4.02Å; Q274-L284 HydrophobicContact CB-CG 4.43Å; Q274-Y285 HydrophobicContact CB-CD2 4.21Å; Q274-Y285 PolarHBondContact NE2-O 3.28Å; Q274-Y285 PolarHBondContact OE1-O 3.4Å |
| 275 | P | 80.9 | Confident | 80.3 | Confident | 17 Ų | 17 | 42.8 Ų | 42.8 | 11% | 0.11 | 20% | 0.199 | C | C | . | . | P | Polyproline II helix | trans | -66.5 | 151.5 | 175.8 | 24.2 | -27.2 | 0 | 0 | 0 | 112.5 | H180 R205 R283 L284 | H180-P275 HydrophobicContact CB-CG 4.38Å; R205-P275 PolarHBondContact NH2-O 3.06Å; P275-R283 HydrophobicContact CG-CB 4.24Å; P275-R283 PolarHBondContact O-N 2.96Å; P275-R283 VanDerWaalsContact O-N 3.14Å; P275-L284 VanDerWaalsContact CD-CD1 3.47Å; P275-L284 HydrophobicContact CG-CD1 4.22Å; P275-L284 HydrophobicContact CG-CG 4.25Å |
| 276 | V | 74.6 | Confident | 79.9 | Confident | 11 Ų | 11 | 49.5 Ų | 49.5 | 7% | 0.067 | 23% | 0.234 | C | C | . | . | B | Isolated β-bridge | trans | -96 | 141.3 | 176.3 | -48.4 | 0 | 0 | 0 | 0 | 110.2 | D198 K281 | D198-V276 WeakPolarHBondContact OD1-CG2 3.4Å; V276-K281 WeakPolarHBondContact CA-O 3.42Å |
| 277 | D | 74.6 | Confident | 79.6 | Confident | 62 Ų | 62 | 50.1 Ų | 50.1 | 33% | 0.332 | 24% | 0.241 | S | C | . | . | P | Polyproline II helix | trans | -85.1 | 173 | 170.9 | -140.2 | -7.2 | 0 | 0 | 0 | 111.7 | F279 H280 K281 R283 | D277-F279 PolarHBondContact O-N 3.37Å; D277-F279 VanDerWaalsContact O-N 3.14Å; D277-H280 PolarHBondContact O-N 2.94Å; D277-K281 PolarHBondContact N-O 3.49Å; D277-R283 HydrophobicContact CB-CG 3.63Å; D277-R283 VanDerWaalsContact CG-NE 3.31Å; D277-R283 IonicContact OD1-CZ 3.19Å; D277-R283 IonicContact OD1-NE 2.76Å; D277-R283 PolarHBondContact OD1-NE 2.69Å; D277-R283 IonicContact OD1-NH2 2.77Å; D277-R283 PolarHBondContact OD1-NH2 3.21Å; D277-R283 IonicContact OD2-NE 3.92Å |
| 278 | E | 65.1 | Low | 79.5 | Confident | 165 Ų | 165 | 51.9 Ų | 51.9 | 77% | 0.771 | 25% | 0.249 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -58.4 | -25.5 | 176.9 | -72.2 | -176.9 | 161.4 | 0 | 0 | 113.2 | H280 | E278-H280 VanDerWaalsContact C-N 3.33Š|
| 279 | F | 60.9 | Low | 79.4 | Confident | 163 Ų | 163 | 56.6 Ų | 56.6 | 72% | 0.715 | 28% | 0.277 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -92.3 | 20.5 | 175.1 | -58.7 | -76.4 | 0 | 0 | 0 | 113.8 | D277 K281 | D277-F279 PolarHBondContact O-N 3.37Å; D277-F279 VanDerWaalsContact O-N 3.14Å; F279-K281 PolarHBondContact O-N 3.45Å |
| 280 | H | 64.8 | Low | 79.4 | Confident | 99 Ų | 99 | 58.3 Ų | 58.3 | 46% | 0.458 | 29% | 0.287 | S | S | . | . | S | Bend | trans | 60.2 | 11.1 | 178.8 | -54.7 | 101.3 | 0 | 0 | 0 | 115.6 | R197 D198 R205 D277 E278 | R197-H280 PolarHBondContact O-NE2 3.4Å; D198-H280 IonicContact OD1-CD2 3.42Å; D198-H280 PolarHBondContact OD1-CD2 3.42Å; R205-H280 PolarHBondContact NH1-O 2.93Å; D277-H280 PolarHBondContact O-N 2.94Å; E278-H280 VanDerWaalsContact C-N 3.33Å |
| 281 | K | 64.5 | Low | 79.3 | Confident | 144 Ų | 144 | 58.3 Ų | 58.3 | 63% | 0.626 | 29% | 0.287 | S | S | * | . | S | Bend | trans | -87 | 159.9 | 176.5 | -71.1 | -176.3 | -178.2 | 177.9 | 0 | 112.1 | R205 V276 D277 F279 R283 | R205-K281 PolarHBondContact NH1-O 2.9Å; V276-K281 WeakPolarHBondContact CA-O 3.42Å; D277-K281 PolarHBondContact N-O 3.49Å; F279-K281 PolarHBondContact O-N 3.45Å; K281-R283 PolarHBondContact O-N 3.43Å |
| 282 | G | 71.3 | Confident | 79.4 | Confident | 17 Ų | 17 | 60.8 Ų | 60.8 | 18% | 0.175 | 30% | 0.299 | C | S | . | . | B | Isolated β-bridge | trans | -66.2 | 116.4 | 170.9 | 0 | 0 | 0 | 0 | 0 | 111.8 | L284 | G282-L284 VanDerWaalsContact C-N 3.3Å |
| 283 | R | 76.4 | Confident | 79.5 | Confident | 150 Ų | 150 | 65.5 Ų | 65.5 | 57% | 0.566 | 32% | 0.324 | S | S | * | . | S | Bend | trans | -65.9 | -36.1 | 175.5 | -82.9 | -171.3 | 173.1 | 168.9 | 3.2 | 111.8 | P275 D277 K281 | P275-R283 HydrophobicContact CG-CB 4.24Å; P275-R283 PolarHBondContact O-N 2.96Å; P275-R283 VanDerWaalsContact O-N 3.14Å; D277-R283 HydrophobicContact CB-CG 3.63Å; D277-R283 VanDerWaalsContact CG-NE 3.31Å; D277-R283 IonicContact OD1-CZ 3.19Å; D277-R283 IonicContact OD1-NE 2.76Å; D277-R283 PolarHBondContact OD1-NE 2.69Å; D277-R283 IonicContact OD1-NH2 2.77Å; D277-R283 PolarHBondContact OD1-NH2 3.21Å; D277-R283 IonicContact OD2-NE 3.92Å; K281-R283 PolarHBondContact O-N 3.43Å |
| 284 | L | 79.7 | Confident | 79.6 | Confident | 49 Ų | 49 | 68.5 Ų | 68.5 | 26% | 0.257 | 34% | 0.337 | S | S | . | . | S | Bend | trans | -90.6 | -42.5 | -176.8 | -61.7 | 173 | 0 | 0 | 0 | 111.5 | L77 Q274 P275 G282 K294 | L77-L284 HydrophobicContact CD1-CB 4.27Å; L77-L284 HydrophobicContact CD1-CD2 3.91Å; Q274-L284 HydrophobicContact CB-CB 4.21Å; Q274-L284 HydrophobicContact CB-CD1 4.02Å; Q274-L284 HydrophobicContact CB-CG 4.43Å; P275-L284 VanDerWaalsContact CD-CD1 3.47Å; P275-L284 HydrophobicContact CG-CD1 4.22Å; P275-L284 HydrophobicContact CG-CG 4.25Å; G282-L284 VanDerWaalsContact C-N 3.3Å; L284-K294 PolarHBondContact O-NZ 2.88Å |
| 285 | Y | 83.4 | Confident | 79.9 | Confident | 2 Ų | 2 | 68.2 Ų | 68.2 | 1% | 0.008 | 34% | 0.336 | C | S | . | . | trans | -135.3 | 128.5 | -170.6 | -52.9 | -67.4 | 0 | 0 | 0 | 112.3 | E76 L77 R270 Q274 D290 C291 K294 | E76-Y285 WeakPolarHBondContact OE1-CE2 3.23Å; L77-Y285 HydrophobicContact CD1-CE1 4.18Å; L77-Y285 HydrophobicContact CD2-CE1 3.77Å; L77-Y285 WeakPolarHBondContact CD2-OH 3.5Å; L77-Y285 HydrophobicContact CG-CE1 4.23Å; L77-Y285 WeakPolarHBondContact CG-OH 3.08Å; R270-Y285 HydrophobicContact CB-CE2 3.97Å; R270-Y285 PolarHBondContact NH1-OH 3.41Å; Q274-Y285 HydrophobicContact CB-CD2 4.21Å; Q274-Y285 PolarHBondContact NE2-O 3.28Å; Q274-Y285 PolarHBondContact OE1-O 3.4Å; Y285-D290 WeakPolarHBondContact CA-OD2 3.44Å; Y285-C291 HydrophobicContact CD1-CB 3.55Å; Y285-C291 HydrophobicContact CD2-CB 4.47Å; Y285-C291 HydrophobicContact CE1-CB 3.97Å; Y285-C291 VanDerWaalsContact CE1-SG 3.55Å; Y285-C291 HydrophobicContact CG-CB 3.79Å; Y285-K294 HydrophobicContact CD1-CD 4.03Å; Y285-K294 HydrophobicContact CE1-CB 4.16Å; Y285-K294 HydrophobicContact CE1-CD 4.23Å | ||
| 286 | L | 80.9 | Confident | 80.3 | Confident | 141 Ų | 141 | 69.1 Ų | 69.1 | 74% | 0.738 | 34% | 0.343 | S | S | * | . | S | Bend | trans | -77.9 | -24.8 | 175.4 | -66.6 | 169.9 | 0 | 0 | 0 | 112.3 | D290 | L286-D290 HydrophobicContact CB-CB 4.29Å; L286-D290 PolarHBondContact N-OD2 3.3Å |
| 287 | G | 84.8 | Confident | 81 | Confident | 14 Ų | 14 | 76.3 Ų | 76.3 | 14% | 0.144 | 38% | 0.375 | C | S | . | . | S | Bend | trans | -178.3 | -170.7 | -178.4 | 0 | 0 | 0 | 0 | 0 | 113.2 | C291 | G287-C291 WeakPolarHBondContact O-CB 3.22Å; G287-C291 PolarHBondContact O-N 2.98Å |
| 288 | F | 87.6 | Confident | 81.6 | Confident | 39 Ų | 39 | 75 Ų | 75 | 17% | 0.171 | 37% | 0.373 | C | S | . | . | H | α-helix | trans | -63 | -48.2 | -177.7 | 179.3 | -91.5 | 0 | 0 | 0 | 112.6 | F264 I267 C291 L292 | F264-F288 AromaticContact CD1-CE2 3.88Å; F264-F288 HydrophobicContact CD1-CE2 3.88Å; F264-F288 AromaticContact CD1-CZ 3.5Å; F264-F288 HydrophobicContact CD1-CZ 3.5Å; F264-F288 VanDerWaalsContact CD1-CZ 3.5Å; F264-F288 HydrophobicContact CE1-CE1 4.31Å; F264-F288 HydrophobicContact CE1-CE2 4.38Å; F264-F288 AromaticContact CE1-CZ 3.58Å; F264-F288 HydrophobicContact CE1-CZ 3.58Å; I267-F288 HydrophobicContact CB-CD2 4.39Å; I267-F288 HydrophobicContact CB-CE2 3.99Å; I267-F288 HydrophobicContact CD1-CE2 3.95Å; I267-F288 HydrophobicContact CD1-CZ 3.83Å; I267-F288 HydrophobicContact CG2-CD2 3.42Å; I267-F288 VanDerWaalsContact CG2-CD2 3.42Å; I267-F288 HydrophobicContact CG2-CE2 3.51Å; I267-F288 HydrophobicContact CG2-CG 4.26Å; I267-F288 HydrophobicContact CG2-CZ 4.38Å; F288-C291 PolarHBondContact O-N 3.49Å; F288-L292 PolarHBondContact O-N 2.88Å |
| 289 | T | 88.8 | Confident | 82.7 | Confident | 99 Ų | 99 | 67.5 Ų | 67.5 | 61% | 0.607 | 34% | 0.338 | S | S | * | . | H | α-helix | trans | -67.7 | -42 | -178.2 | 49 | 0 | 0 | 0 | 0 | 112.3 | C291 L292 L293 | T289-C291 VanDerWaalsContact C-N 3.35Å; T289-L292 PolarHBondContact O-N 3Å; T289-L293 WeakPolarHBondContact O-CG 3.24Å; T289-L293 PolarHBondContact O-N 2.9Å |
| 290 | D | 90.1 | Very high | 83.9 | Confident | 36 Ų | 36 | 61 Ų | 61 | 19% | 0.193 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -61.4 | -43 | 174.1 | -179.9 | 48.3 | 0 | 0 | 0 | 111.4 | Y285 L286 L293 K294 | Y285-D290 WeakPolarHBondContact CA-OD2 3.44Å; L286-D290 HydrophobicContact CB-CB 4.29Å; L286-D290 PolarHBondContact N-OD2 3.3Å; D290-L293 PolarHBondContact O-N 3.05Å; D290-K294 WeakPolarHBondContact O-CB 3.45Å; D290-K294 WeakPolarHBondContact O-CG 3.31Å; D290-K294 PolarHBondContact O-N 3.35Å; D290-K294 WeakPolarHBondContact OD1-CE 3.45Å; D290-K294 IonicContact OD1-NZ 2.8Å; D290-K294 PolarHBondContact OD1-NZ 2.93Å; D290-K294 IonicContact OD2-NZ 3.74Å; D290-K294 PolarHBondContact OD2-NZ 3.45Å |
| 291 | C | 88.1 | Confident | 85 | Confident | 0 Ų | 0 | 62.3 Ų | 62.3 | 0% | 0 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -61.7 | -44.7 | 174.1 | -174.1 | 0 | 0 | 0 | 0 | 112.4 | I267 Y285 G287 F288 T289 V295 | I267-C291 HydrophobicContact CG2-CB 3.98Å; Y285-C291 HydrophobicContact CD1-CB 3.55Å; Y285-C291 HydrophobicContact CD2-CB 4.47Å; Y285-C291 HydrophobicContact CE1-CB 3.97Å; Y285-C291 VanDerWaalsContact CE1-SG 3.55Å; Y285-C291 HydrophobicContact CG-CB 3.79Å; G287-C291 WeakPolarHBondContact O-CB 3.22Å; G287-C291 PolarHBondContact O-N 2.98Å; F288-C291 PolarHBondContact O-N 3.49Å; T289-C291 VanDerWaalsContact C-N 3.35Å; C291-V295 WeakPolarHBondContact O-CB 2.96Å; C291-V295 WeakPolarHBondContact O-CG2 3.28Å; C291-V295 PolarHBondContact O-N 3.4Å |
| 292 | L | 90.9 | Very high | 86 | Confident | 58 Ų | 58 | 60.5 Ų | 60.5 | 30% | 0.304 | 32% | 0.324 | S | S | . | . | H | α-helix | trans | -58.9 | -49.8 | 177.3 | 176 | 65.4 | 0 | 0 | 0 | 111.1 | I267 F288 T289 V295 C296 L304 | I267-L292 HydrophobicContact CD1-CB 3.98Å; I267-L292 HydrophobicContact CD1-CD1 3.69Å; I267-L292 HydrophobicContact CD1-CG 4.38Å; F288-L292 PolarHBondContact O-N 2.88Å; T289-L292 PolarHBondContact O-N 3Å; L292-V295 PolarHBondContact O-N 2.99Å; L292-C296 WeakPolarHBondContact O-CB 3.36Å; L292-C296 PolarHBondContact O-N 3.38Å; L292-C296 PolarHBondContact O-SG 3.27Å; L292-L304 HydrophobicContact CD1-CD1 3.82Å; L292-L304 HydrophobicContact CD1-CD2 4.01Å |
| 293 | L | 91.1 | Very high | 86.5 | Confident | 102 Ų | 102 | 59.7 Ų | 59.7 | 53% | 0.534 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -63.1 | -48.2 | -178.5 | -71.8 | 171 | 0 | 0 | 0 | 111.8 | T289 D290 V295 C296 Q297 | T289-L293 WeakPolarHBondContact O-CG 3.24Å; T289-L293 PolarHBondContact O-N 2.9Å; D290-L293 PolarHBondContact O-N 3.05Å; L293-V295 PolarHBondContact O-N 2.8Å; L293-C296 PolarHBondContact O-N 3.47Å; L293-Q297 WeakPolarHBondContact O-CB 3.39Å; L293-Q297 VanDerWaalsContact O-CG 3.31Å; L293-Q297 WeakPolarHBondContact O-CG 3.38Å; L293-Q297 PolarHBondContact O-N 3.27Å |
| 294 | K | 90.6 | Very high | 87.1 | Confident | 64 Ų | 64 | 53.1 Ų | 53.1 | 28% | 0.278 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -63.4 | -39.4 | 179.2 | -75.4 | 173.4 | 173.9 | 161.7 | 0 | 112.6 | L77 L284 Y285 D290 Q297 A298 | L77-K294 HydrophobicContact CD2-CB 3.79Å; L284-K294 PolarHBondContact O-NZ 2.88Å; Y285-K294 HydrophobicContact CD1-CD 4.03Å; Y285-K294 HydrophobicContact CE1-CB 4.16Å; Y285-K294 HydrophobicContact CE1-CD 4.23Å; D290-K294 WeakPolarHBondContact O-CB 3.45Å; D290-K294 WeakPolarHBondContact O-CG 3.31Å; D290-K294 PolarHBondContact O-N 3.35Å; D290-K294 WeakPolarHBondContact OD1-CE 3.45Å; D290-K294 IonicContact OD1-NZ 2.8Å; D290-K294 PolarHBondContact OD1-NZ 2.93Å; D290-K294 IonicContact OD2-NZ 3.74Å; D290-K294 PolarHBondContact OD2-NZ 3.45Å; K294-Q297 PolarHBondContact O-N 3.05Å; K294-A298 WeakPolarHBondContact O-CB 3.29Å; K294-A298 PolarHBondContact O-N 3.37Å |
| 295 | V | 89.8 | Confident | 87.5 | Confident | 0 Ų | 0 | 55.1 Ų | 55.1 | 0% | 0 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -66.2 | -44.1 | 175.7 | 172.6 | 0 | 0 | 0 | 0 | 110.5 | C291 L292 L293 Q297 E299 G300 L304 | C291-V295 WeakPolarHBondContact O-CB 2.96Å; C291-V295 WeakPolarHBondContact O-CG2 3.28Å; C291-V295 PolarHBondContact O-N 3.4Å; L292-V295 PolarHBondContact O-N 2.99Å; L293-V295 PolarHBondContact O-N 2.8Å; V295-Q297 VanDerWaalsContact C-N 3.32Å; V295-Q297 PolarHBondContact O-N 2.73Å; V295-E299 HydrophobicContact CG1-CB 4.42Å; V295-E299 WeakPolarHBondContact O-CA 3.19Å; V295-E299 WeakPolarHBondContact O-CB 3.26Å; V295-E299 PolarHBondContact O-N 3.43Å; V295-G300 PolarHBondContact O-N 3.28Å; V295-L304 HydrophobicContact CB-CD2 4.35Å; V295-L304 HydrophobicContact CG1-CD2 3.76Å; V295-L304 HydrophobicContact CG1-CG 4.19Å |
| 296 | C | 89.6 | Confident | 87.5 | Confident | 37 Ų | 37 | 56.2 Ų | 56.2 | 25% | 0.25 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -60.9 | -40.1 | 175.8 | -73.9 | 0 | 0 | 0 | 0 | 112.6 | L292 L293 G300 | L292-C296 WeakPolarHBondContact O-CB 3.36Å; L292-C296 PolarHBondContact O-N 3.38Å; L292-C296 PolarHBondContact O-SG 3.27Å; L293-C296 PolarHBondContact O-N 3.47Å; C296-G300 WeakPolarHBondContact O-CA 3.43Å; C296-G300 PolarHBondContact O-N 3.27Å |
| 297 | Q | 88.5 | Confident | 87.5 | Confident | 161 Ų | 161 | 50 Ų | 50 | 75% | 0.752 | 27% | 0.27 | S | S | * | . | H | α-helix | trans | -74 | -43.2 | 179.8 | -72.5 | 174.2 | -7 | 0 | 0 | 112.8 | L293 K294 V295 | L293-Q297 WeakPolarHBondContact O-CB 3.39Å; L293-Q297 VanDerWaalsContact O-CG 3.31Å; L293-Q297 WeakPolarHBondContact O-CG 3.38Å; L293-Q297 PolarHBondContact O-N 3.27Å; K294-Q297 PolarHBondContact O-N 3.05Å; V295-Q297 VanDerWaalsContact C-N 3.32Å; V295-Q297 PolarHBondContact O-N 2.73Å |
| 298 | A | 87.9 | Confident | 87.6 | Confident | 34 Ų | 34 | 53 Ų | 53 | 28% | 0.281 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -84 | -40 | -175.1 | 0 | 0 | 0 | 0 | 0 | 113.1 | L77 A79 K294 | L77-A298 HydrophobicContact CD2-CB 4.43Å; A79-A298 VanDerWaalsContact CA-O 3.25Å; A79-A298 WeakPolarHBondContact CA-O 3.25Å; K294-A298 WeakPolarHBondContact O-CB 3.29Å; K294-A298 PolarHBondContact O-N 3.37Å |
| 299 | E | 86.3 | Confident | 87.5 | Confident | 8 Ų | 8 | 53 Ų | 53 | 4% | 0.037 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -110.9 | -13.2 | -171.7 | -65.6 | 177.6 | -132 | 0 | 0 | 113.7 | G75 L77 R78 R270 V295 K306 | G75-E299 VanDerWaalsContact O-CD 3.3Å; L77-E299 PolarHBondContact N-OE1 3.02Å; R78-E299 WeakPolarHBondContact O-CG 3.43Å; R270-E299 IonicContact CZ-OE1 3.53Å; R270-E299 IonicContact CZ-OE2 2.8Å; R270-E299 IonicContact NH1-OE1 3.96Å; R270-E299 PolarHBondContact NH1-OE1 3.46Å; R270-E299 IonicContact NH1-OE2 3.24Å; R270-E299 IonicContact NH2-OE1 2.67Å; R270-E299 PolarHBondContact NH2-OE1 3.39Å; R270-E299 IonicContact NH2-OE2 3.65Å; R270-E299 PolarHBondContact NH2-OE2 3.08Å; V295-E299 HydrophobicContact CG1-CB 4.42Å; V295-E299 WeakPolarHBondContact O-CA 3.19Å; V295-E299 WeakPolarHBondContact O-CB 3.26Å; V295-E299 PolarHBondContact O-N 3.43Å; E299-K306 WeakPolarHBondContact OE2-CE 3.3Å; E299-K306 IonicContact OE2-NZ 3.92Å; E299-K306 PolarHBondContact OE2-NZ 2.95Å |
| 300 | G | 87.6 | Confident | 87.3 | Confident | 28 Ų | 28 | 48.4 Ų | 48.4 | 29% | 0.289 | 27% | 0.265 | S | S | . | . | trans | 77.8 | 173.6 | -172.1 | 0 | 0 | 0 | 0 | 0 | 113.4 | V295 C296 L302 G303 | V295-G300 PolarHBondContact O-N 3.28Å; C296-G300 WeakPolarHBondContact O-CA 3.43Å; C296-G300 PolarHBondContact O-N 3.27Å; G300-L302 PolarHBondContact O-N 3.29Å; G300-G303 PolarHBondContact O-N 2.81Å | ||
| 301 | L | 86.8 | Confident | 86.9 | Confident | 126 Ų | 126 | 46.8 Ų | 46.8 | 66% | 0.66 | 26% | 0.256 | S | S | * | . | G | 310 helix | trans | -59.3 | -33.3 | 180 | -67.8 | 173.5 | 0 | 0 | 0 | 113.1 | G303 L304 | L301-G303 PolarHBondContact O-N 3.44Å; L301-L304 WeakPolarHBondContact O-CB 3.22Å; L301-L304 PolarHBondContact O-N 2.95Å |
| 302 | L | 85.6 | Confident | 86.8 | Confident | 105 Ų | 105 | 52.1 Ų | 52.1 | 55% | 0.55 | 28% | 0.28 | S | S | . | . | G | 310 helix | trans | -71.6 | -13 | 176.8 | -64.1 | 173.5 | 0 | 0 | 0 | 113.1 | R80 G300 L304 Y305 | R80-L302 VanDerWaalsContact NH1-CD1 3.27Å; R80-L302 VanDerWaalsContact NH2-CB 3.3Å; G300-L302 PolarHBondContact O-N 3.29Å; L302-L304 VanDerWaalsContact C-N 3.32Å; L302-Y305 PolarHBondContact O-N 3Å |
| 303 | G | 83 | Confident | 86.6 | Confident | 0 Ų | 0 | 53 Ų | 53 | 0% | 0 | 28% | 0.284 | C | S | . | . | G | 310 helix | trans | -65.6 | -34.7 | 170.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | G300 L301 Y305 K306 | G300-G303 PolarHBondContact O-N 2.81Å; L301-G303 PolarHBondContact O-N 3.44Å; G303-Y305 PolarHBondContact O-N 3.45Å; G303-K306 WeakPolarHBondContact O-CB 3.37Å; G303-K306 WeakPolarHBondContact O-CG 3.22Å; G303-K306 PolarHBondContact O-N 3.32Å |
| 304 | L | 87.6 | Confident | 86.2 | Confident | 13 Ų | 13 | 49.5 Ų | 49.5 | 7% | 0.068 | 26% | 0.264 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -68.9 | -19.9 | 178.5 | -66.5 | 171.3 | 0 | 0 | 0 | 113.7 | P263 V266 I267 L292 V295 L301 L302 | P263-L304 WeakPolarHBondContact CA-O 3.26Å; P263-L304 HydrophobicContact CB-CB 4.06Å; P263-L304 HydrophobicContact CB-CD1 4.5Å; V266-L304 WeakPolarHBondContact CG2-O 3.47Å; I267-L304 HydrophobicContact CD1-CD2 4.08Å; I267-L304 HydrophobicContact CG1-CD2 4.06Å; L292-L304 HydrophobicContact CD1-CD1 3.82Å; L292-L304 HydrophobicContact CD1-CD2 4.01Å; V295-L304 HydrophobicContact CB-CD2 4.35Å; V295-L304 HydrophobicContact CG1-CD2 3.76Å; V295-L304 HydrophobicContact CG1-CG 4.19Å; L301-L304 WeakPolarHBondContact O-CB 3.22Å; L301-L304 PolarHBondContact O-N 2.95Å; L302-L304 VanDerWaalsContact C-N 3.32Å |
| 305 | Y | 88.8 | Confident | 85.7 | Confident | 91 Ų | 91 | 48.6 Ų | 48.6 | 36% | 0.357 | 26% | 0.262 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -98.3 | 9.9 | 177.8 | -67.8 | -87.6 | 0 | 0 | 0 | 112.7 | I259 T262 L302 G303 G307 M308 | I259-Y305 HydrophobicContact CG2-CE1 4.26Å; I259-Y305 WeakPolarHBondContact O-CE1 3.47Å; T262-Y305 WeakPolarHBondContact OG1-CD1 3.26Å; L302-Y305 PolarHBondContact O-N 3Å; G303-Y305 PolarHBondContact O-N 3.45Å; Y305-G307 PolarHBondContact O-N 2.98Å; Y305-M308 HydrophobicContact CD1-SD 4.14Å; Y305-M308 WeakPolarHBondContact O-CB 3.37Å; Y305-M308 PolarHBondContact O-N 3.38Å |
| 306 | K | 83.8 | Confident | 85.2 | Confident | 25 Ų | 25 | 51.3 Ų | 51.3 | 11% | 0.109 | 28% | 0.284 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -59.4 | 133.1 | 171.1 | -77.8 | 178.4 | 175.9 | 177.4 | 0 | 109.8 | Q72 Q74 Y83 V266 E299 G303 M308 | Q72-K306 WeakPolarHBondContact CG-O 3.38Å; Q74-K306 PolarHBondContact O-NZ 2.76Å; Y83-K306 PolarHBondContact OH-NZ 3.41Å; V266-K306 VanDerWaalsContact CG2-O 3.24Å; V266-K306 WeakPolarHBondContact CG2-O 3.2Å; E299-K306 WeakPolarHBondContact OE2-CE 3.3Å; E299-K306 IonicContact OE2-NZ 3.92Å; E299-K306 PolarHBondContact OE2-NZ 2.95Å; G303-K306 WeakPolarHBondContact O-CB 3.37Å; G303-K306 WeakPolarHBondContact O-CG 3.22Å; G303-K306 PolarHBondContact O-N 3.32Å; K306-M308 VanDerWaalsContact C-N 3.33Å |
| 307 | G | 81.1 | Confident | 84.9 | Confident | 9 Ų | 9 | 51.8 Ų | 51.8 | 9% | 0.093 | 29% | 0.287 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 78.5 | 11.3 | -178.9 | 0 | 0 | 0 | 0 | 0 | 115 | Y305 G309 P310 V311 | Y305-G307 PolarHBondContact O-N 2.98Å; G307-G309 VanDerWaalsContact C-N 3.33Å; G307-G309 PolarHBondContact O-N 2.62Å; G307-P310 VanDerWaalsContact O-CD 3.23Å; G307-P310 WeakPolarHBondContact O-CD 3.4Å; G307-V311 WeakPolarHBondContact O-CG2 3.02Å; G307-V311 PolarHBondContact O-N 2.99Å |
| 308 | M | 86.3 | Confident | 84.7 | Confident | 77 Ų | 77 | 45.5 Ų | 45.5 | 38% | 0.379 | 26% | 0.257 | S | S | . | . | H | α-helix | trans | -59.7 | -40.7 | 171 | -179.2 | 173.5 | 72 | 0 | 0 | 112.7 | T262 Y305 K306 V311 F312 | T262-M308 HydrophobicContact CG2-CB 3.94Å; T262-M308 HydrophobicContact CG2-CG 4.01Å; Y305-M308 HydrophobicContact CD1-SD 4.14Å; Y305-M308 WeakPolarHBondContact O-CB 3.37Å; Y305-M308 PolarHBondContact O-N 3.38Å; K306-M308 VanDerWaalsContact C-N 3.33Å; M308-V311 WeakPolarHBondContact O-CB 2.93Å; M308-V311 PolarHBondContact O-N 3.19Å; M308-F312 PolarHBondContact O-N 3.02Å |
| 309 | G | 85.6 | Confident | 84.3 | Confident | 39 Ų | 39 | 46.4 Ų | 46.4 | 40% | 0.402 | 26% | 0.26 | S | S | . | . | H | α-helix | trans | -55.9 | -53.8 | 176.9 | 0 | 0 | 0 | 0 | 0 | 113.4 | G307 V311 F312 L313 | G307-G309 VanDerWaalsContact C-N 3.33Å; G307-G309 PolarHBondContact O-N 2.62Å; G309-V311 VanDerWaalsContact C-N 3.31Å; G309-V311 PolarHBondContact O-N 2.82Å; G309-F312 PolarHBondContact O-N 3.44Å; G309-L313 WeakPolarHBondContact O-CB 3.37Å; G309-L313 PolarHBondContact O-N 2.79Å |
| 310 | P | 84.3 | Confident | 84 | Confident | 4 Ų | 4 | 50.6 Ų | 50.6 | 3% | 0.026 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -57.4 | -39.1 | 173 | -25 | 30.8 | 0 | 0 | 0 | 113.7 | V67 K68 L71 V90 G307 R314 | V67-P310 HydrophobicContact CG1-CG 4.2Å; K68-P310 HydrophobicContact CB-CB 3.75Å; K68-P310 HydrophobicContact CG-CB 4.35Å; L71-P310 HydrophobicContact CD1-CG 3.46Å; L71-P310 VanDerWaalsContact CD1-CG 3.46Å; V90-P310 HydrophobicContact CB-CG 4.42Å; V90-P310 HydrophobicContact CG1-CB 4.35Å; V90-P310 HydrophobicContact CG1-CG 4.15Å; V90-P310 HydrophobicContact CG2-CB 4.45Å; V90-P310 HydrophobicContact CG2-CG 3.66Å; G307-P310 VanDerWaalsContact O-CD 3.23Å; G307-P310 WeakPolarHBondContact O-CD 3.4Å; P310-R314 WeakPolarHBondContact O-CB 3.42Å; P310-R314 PolarHBondContact O-N 3.4Å |
| 311 | V | 82.8 | Confident | 83.9 | Confident | 2 Ų | 2 | 51.2 Ų | 51.2 | 1% | 0.012 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -60.4 | -48.3 | 177.2 | 170.3 | 0 | 0 | 0 | 0 | 110.7 | K68 A258 T262 G307 M308 G309 R314 L315 | K68-V311 HydrophobicContact CD-CG2 3.64Å; K68-V311 HydrophobicContact CG-CG2 4.11Å; A258-V311 HydrophobicContact CB-CG1 4.3Å; T262-V311 HydrophobicContact CG2-CB 4.27Å; T262-V311 HydrophobicContact CG2-CG1 4.25Å; T262-V311 HydrophobicContact CG2-CG2 4.22Å; G307-V311 WeakPolarHBondContact O-CG2 3.02Å; G307-V311 PolarHBondContact O-N 2.99Å; M308-V311 WeakPolarHBondContact O-CB 2.93Å; M308-V311 PolarHBondContact O-N 3.19Å; G309-V311 VanDerWaalsContact C-N 3.31Å; G309-V311 PolarHBondContact O-N 2.82Å; V311-R314 PolarHBondContact O-N 3.31Å; V311-L315 WeakPolarHBondContact O-CB 3.34Å; V311-L315 PolarHBondContact O-N 3.04Å |
| 312 | F | 85 | Confident | 83.8 | Confident | 112 Ų | 112 | 45.9 Ų | 45.9 | 49% | 0.491 | 26% | 0.256 | S | S | . | . | H | α-helix | trans | -64.8 | -49.8 | 179.2 | -174.5 | -100.8 | 0 | 0 | 0 | 111.8 | V255 M308 G309 R314 L315 | V255-F312 HydrophobicContact CG2-CE2 3.71Å; V255-F312 HydrophobicContact CG2-CZ 4.47Å; M308-F312 PolarHBondContact O-N 3.02Å; G309-F312 PolarHBondContact O-N 3.44Å; F312-R314 PolarHBondContact O-N 3.07Å; F312-L315 PolarHBondContact O-N 3.07Å; F312-L315 VanDerWaalsContact O-N 3.14Å |
| 313 | L | 85.8 | Confident | 83.5 | Confident | 77 Ų | 77 | 43.2 Ų | 43.2 | 40% | 0.403 | 24% | 0.241 | S | C | . | . | H | α-helix | trans | -63.7 | -26.2 | -179.5 | -169.8 | 64.1 | 0 | 0 | 0 | 112.5 | L64 V90 G309 P317 | L64-L313 HydrophobicContact CD1-CG 4.4Å; L64-L313 HydrophobicContact CD2-CD2 3.92Å; L64-L313 HydrophobicContact CD2-CG 4.35Å; V90-L313 HydrophobicContact CB-CD2 4.47Å; V90-L313 HydrophobicContact CG1-CD2 3.86Å; G309-L313 WeakPolarHBondContact O-CB 3.37Å; G309-L313 PolarHBondContact O-N 2.79Å; L313-P317 WeakPolarHBondContact O-CD 3.42Å; L313-P317 WeakPolarHBondContact O-CG 3.41Å |
| 314 | R | 84.1 | Confident | 83.6 | Confident | 28 Ų | 28 | 47.3 Ų | 47.3 | 11% | 0.106 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -80.5 | -38.5 | 174.7 | -172.1 | -166.7 | 67.7 | 98.4 | 18 | 112.5 | L64 E65 P310 V311 F312 A316 P317 H318 | L64-R314 HydrophobicContact CB-CB 3.97Å; L64-R314 HydrophobicContact CB-CG 4.11Å; L64-R314 HydrophobicContact CD1-CB 4.03Å; L64-R314 HydrophobicContact CD1-CG 4.41Å; E65-R314 HydrophobicContact CG-CG 4.5Å; E65-R314 IonicContact OE1-CZ 3.64Å; E65-R314 IonicContact OE1-NE 3.05Å; E65-R314 IonicContact OE1-NH1 2.65Å; E65-R314 PolarHBondContact OE1-NH1 3.04Å; P310-R314 WeakPolarHBondContact O-CB 3.42Å; P310-R314 PolarHBondContact O-N 3.4Å; V311-R314 PolarHBondContact O-N 3.31Å; F312-R314 PolarHBondContact O-N 3.07Å; R314-A316 PolarHBondContact O-N 2.96Å; R314-P317 WeakPolarHBondContact O-CD 3.16Å; R314-P317 WeakPolarHBondContact O-CG 3.43Å; R314-H318 WeakPolarHBondContact O-CB 3.05Å; R314-H318 PolarHBondContact O-N 3.36Å |
| 315 | L | 78.6 | Confident | 83.6 | Confident | 44 Ų | 44 | 48.8 Ų | 48.8 | 23% | 0.23 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -62.1 | -44.4 | -170.7 | -172.2 | 65.8 | 0 | 0 | 0 | 112.2 | V311 F312 T319 | V311-L315 WeakPolarHBondContact O-CB 3.34Å; V311-L315 PolarHBondContact O-N 3.04Å; F312-L315 PolarHBondContact O-N 3.07Å; F312-L315 VanDerWaalsContact O-N 3.14Å; L315-T319 WeakPolarHBondContact O-CB 3.48Å; L315-T319 PolarHBondContact O-N 3.42Å; L315-T319 PolarHBondContact O-OG1 3.22Å |
| 316 | A | 80.3 | Confident | 83.4 | Confident | 58 Ų | 58 | 46.3 Ų | 46.3 | 48% | 0.479 | 26% | 0.258 | S | S | . | . | H | α-helix | trans | -62 | -59.2 | 179.5 | 0 | 0 | 0 | 0 | 0 | 113.1 | R314 H318 T319 V320 | R314-A316 PolarHBondContact O-N 2.96Å; A316-H318 VanDerWaalsContact C-N 3.31Å; A316-H318 PolarHBondContact O-N 2.8Å; A316-T319 PolarHBondContact O-N 2.77Å; A316-V320 WeakPolarHBondContact O-CG2 3.39Å; A316-V320 PolarHBondContact O-N 2.9Å |
| 317 | P | 82.6 | Confident | 83.3 | Confident | 47 Ų | 47 | 46.3 Ų | 46.3 | 31% | 0.305 | 26% | 0.259 | S | S | . | . | H | α-helix | trans | -64.9 | -34.5 | 179.9 | 25.3 | -34 | 0 | 0 | 0 | 112.3 | T61 L64 L313 R314 T319 L321 | T61-P317 HydrophobicContact CG2-CG 4.48Å; L64-P317 HydrophobicContact CD1-CG 4.4Å; L313-P317 WeakPolarHBondContact O-CD 3.42Å; L313-P317 WeakPolarHBondContact O-CG 3.41Å; R314-P317 WeakPolarHBondContact O-CD 3.16Å; R314-P317 WeakPolarHBondContact O-CG 3.43Å; P317-T319 PolarHBondContact O-N 3.04Å; P317-L321 VanDerWaalsContact O-CB 3.22Å; P317-L321 WeakPolarHBondContact O-CB 3.38Å; P317-L321 WeakPolarHBondContact O-CG 3.48Å; P317-L321 PolarHBondContact O-N 2.95Å |
| 318 | H | 83.9 | Confident | 83.6 | Confident | 28 Ų | 28 | 50.1 Ų | 50.1 | 13% | 0.13 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -60.8 | -46.2 | 176.4 | -171.8 | 78 | 0 | 0 | 0 | 111.5 | T61 R314 A316 S322 | T61-H318 HydrophobicContact CG2-CB 3.87Å; T61-H318 PolarHBondContact OG1-ND1 3.45Å; T61-H318 VanDerWaalsContact OG1-ND1 3.11Å; R314-H318 WeakPolarHBondContact O-CB 3.05Å; R314-H318 PolarHBondContact O-N 3.36Å; A316-H318 VanDerWaalsContact C-N 3.31Å; A316-H318 PolarHBondContact O-N 2.8Å; H318-S322 VanDerWaalsContact O-CB 3.26Å; H318-S322 WeakPolarHBondContact O-CB 3.36Å; H318-S322 PolarHBondContact O-N 2.85Å; H318-S322 PolarHBondContact O-OG 2.96Å |
| 319 | T | 80.1 | Confident | 83.6 | Confident | 53 Ų | 53 | 49.1 Ų | 49.1 | 33% | 0.325 | 27% | 0.272 | S | S | . | . | H | α-helix | trans | -66 | -47.6 | -179.5 | -54.8 | 0 | 0 | 0 | 0 | 111.1 | L315 A316 P317 S322 M323 | L315-T319 WeakPolarHBondContact O-CB 3.48Å; L315-T319 PolarHBondContact O-N 3.42Å; L315-T319 PolarHBondContact O-OG1 3.22Å; A316-T319 PolarHBondContact O-N 2.77Å; P317-T319 PolarHBondContact O-N 3.04Å; T319-S322 PolarHBondContact O-N 2.93Å; T319-M323 HydrophobicContact CG2-CE 3.6Å; T319-M323 HydrophobicContact CG2-SD 4.07Å; T319-M323 WeakPolarHBondContact O-CG 3.34Å; T319-M323 PolarHBondContact O-N 2.62Å |
| 320 | V | 80.6 | Confident | 83.5 | Confident | 97 Ų | 97 | 48.3 Ų | 48.3 | 59% | 0.588 | 26% | 0.257 | S | S | * | . | H | α-helix | trans | -62.1 | -47.1 | -180 | 173.3 | 0 | 0 | 0 | 0 | 111.3 | A316 M323 L324 | A316-V320 WeakPolarHBondContact O-CG2 3.39Å; A316-V320 PolarHBondContact O-N 2.9Å; V320-M323 PolarHBondContact O-N 2.95Å; V320-L324 WeakPolarHBondContact O-CB 3.41Å; V320-L324 PolarHBondContact O-N 3.36Å |
| 321 | L | 85.7 | Confident | 83.5 | Confident | 41 Ų | 41 | 51.6 Ų | 51.6 | 22% | 0.215 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -66.1 | -40.8 | 179 | -70.9 | 171.9 | 0 | 0 | 0 | 111.9 | A57 F60 P317 M323 L324 F325 | A57-L321 HydrophobicContact CB-CB 3.86Å; F60-L321 HydrophobicContact CB-CD1 3.66Å; F60-L321 HydrophobicContact CD2-CD1 4.29Å; F60-L321 HydrophobicContact CG-CD1 4.08Å; P317-L321 VanDerWaalsContact O-CB 3.22Å; P317-L321 WeakPolarHBondContact O-CB 3.38Å; P317-L321 WeakPolarHBondContact O-CG 3.48Å; P317-L321 PolarHBondContact O-N 2.95Å; L321-M323 VanDerWaalsContact C-N 3.32Å; L321-M323 PolarHBondContact O-N 3.13Å; L321-L324 PolarHBondContact O-N 2.66Å; L321-F325 HydrophobicContact CB-CD2 4.32Å; L321-F325 HydrophobicContact CB-CE2 4.05Å; L321-F325 HydrophobicContact CD2-CE2 4.36Å; L321-F325 HydrophobicContact CD2-CZ 4.48Å; L321-F325 WeakPolarHBondContact O-CB 3.25Å; L321-F325 WeakPolarHBondContact O-CD2 3.43Å; L321-F325 WeakPolarHBondContact O-CG 3.2Å; L321-F325 PolarHBondContact O-N 3.37Å |
| 322 | S | 83.6 | Confident | 83.6 | Confident | 14 Ų | 14 | 56.1 Ų | 56.1 | 10% | 0.098 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -62.4 | -41.9 | 177.8 | -58 | 0 | 0 | 0 | 0 | 111.3 | A53 A57 H318 T319 W326 | A53-S322 WeakPolarHBondContact CB-O 3.1Å; A57-S322 WeakPolarHBondContact CB-OG 3.12Å; H318-S322 VanDerWaalsContact O-CB 3.26Å; H318-S322 WeakPolarHBondContact O-CB 3.36Å; H318-S322 PolarHBondContact O-N 2.85Å; H318-S322 PolarHBondContact O-OG 2.96Å; T319-S322 PolarHBondContact O-N 2.93Å; S322-W326 VanDerWaalsContact O-CB 3.26Å; S322-W326 WeakPolarHBondContact O-CB 3.39Å; S322-W326 PolarHBondContact O-N 2.83Å |
| 323 | M | 80.3 | Confident | 83.4 | Confident | 48 Ų | 48 | 52 Ų | 52 | 24% | 0.236 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -66.7 | -45 | 176.1 | -72.3 | 174.3 | -179.3 | 0 | 0 | 111.9 | P31 T319 V320 L321 F325 W326 D327 | P31-M323 WeakPolarHBondContact CD-SD 3.14Å; P31-M323 HydrophobicContact CG-CE 3.91Å; P31-M323 HydrophobicContact CG-SD 3.7Å; T319-M323 HydrophobicContact CG2-CE 3.6Å; T319-M323 HydrophobicContact CG2-SD 4.07Å; T319-M323 WeakPolarHBondContact O-CG 3.34Å; T319-M323 PolarHBondContact O-N 2.62Å; V320-M323 PolarHBondContact O-N 2.95Å; L321-M323 VanDerWaalsContact C-N 3.32Å; L321-M323 PolarHBondContact O-N 3.13Å; M323-F325 PolarHBondContact O-N 2.93Å; M323-W326 PolarHBondContact O-N 3.5Å; M323-D327 WeakPolarHBondContact O-CB 3.25Å; M323-D327 PolarHBondContact O-N 3.27Å |
| 324 | L | 83.9 | Confident | 83.2 | Confident | 87 Ų | 87 | 50.6 Ų | 50.6 | 46% | 0.455 | 27% | 0.272 | S | S | . | . | H | α-helix | trans | -59.3 | -48.4 | 177.7 | -178.5 | 70.1 | 0 | 0 | 0 | 111.5 | V320 L321 W326 D327 L328 | V320-L324 WeakPolarHBondContact O-CB 3.41Å; V320-L324 PolarHBondContact O-N 3.36Å; L321-L324 PolarHBondContact O-N 2.66Å; L324-W326 VanDerWaalsContact C-N 3.35Å; L324-D327 PolarHBondContact O-N 3.01Å; L324-L328 HydrophobicContact CD1-CD1 4.31Å; L324-L328 HydrophobicContact CD1-CG 4.49Å; L324-L328 HydrophobicContact CG-CD1 4.03Å; L324-L328 WeakPolarHBondContact O-CB 3.2Å; L324-L328 VanDerWaalsContact O-CG 3.25Å; L324-L328 WeakPolarHBondContact O-CG 3.46Å; L324-L328 PolarHBondContact O-N 2.95Å |
| 325 | F | 88.2 | Confident | 82.8 | Confident | 44 Ų | 44 | 56.4 Ų | 56.4 | 19% | 0.193 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -64.6 | -40.8 | 178.5 | -69.8 | -46.1 | 0 | 0 | 0 | 111.7 | A53 A56 A57 F60 L321 M323 L328 M329 | A53-F325 HydrophobicContact CB-CB 3.74Å; A56-F325 HydrophobicContact CB-CD2 3.52Å; A56-F325 HydrophobicContact CB-CE2 3.77Å; A56-F325 HydrophobicContact CB-CG 3.96Å; A56-F325 HydrophobicContact CB-CZ 4.4Å; A57-F325 HydrophobicContact CB-CD2 4.38Å; F60-F325 HydrophobicContact CD2-CE2 4.06Å; F60-F325 HydrophobicContact CD2-CZ 4.13Å; F60-F325 AromaticContact CE2-CE2 3.96Å; F60-F325 HydrophobicContact CE2-CE2 3.96Å; F60-F325 AromaticContact CE2-CZ 3.6Å; F60-F325 HydrophobicContact CE2-CZ 3.6Å; F60-F325 HydrophobicContact CZ-CZ 4.43Å; L321-F325 HydrophobicContact CB-CD2 4.32Å; L321-F325 HydrophobicContact CB-CE2 4.05Å; L321-F325 HydrophobicContact CD2-CE2 4.36Å; L321-F325 HydrophobicContact CD2-CZ 4.48Å; L321-F325 WeakPolarHBondContact O-CB 3.25Å; L321-F325 WeakPolarHBondContact O-CD2 3.43Å; L321-F325 WeakPolarHBondContact O-CG 3.2Å; L321-F325 PolarHBondContact O-N 3.37Å; M323-F325 PolarHBondContact O-N 2.93Å; F325-L328 PolarHBondContact O-N 3.27Å; F325-M329 VanDerWaalsContact O-CB 3.27Å; F325-M329 WeakPolarHBondContact O-CB 3.29Å; F325-M329 WeakPolarHBondContact O-CG 3.35Å; F325-M329 PolarHBondContact O-N 3.01Å |
| 326 | W | 85.9 | Confident | 82.1 | Confident | 39 Ų | 39 | 60.1 Ų | 60.1 | 15% | 0.148 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -61.3 | -47.2 | 176.2 | 177.8 | 72.4 | 0 | 0 | 0 | 111.8 | V30 D46 A53 S322 M323 L324 L328 M329 R330 | V30-W326 HydrophobicContact CG1-CZ3 4.03Å; D46-W326 PolarHBondContact O-NE1 3.32Å; D46-W326 VanDerWaalsContact OD1-CE2 3.26Å; D46-W326 WeakPolarHBondContact OD1-CZ2 3.16Å; D46-W326 PolarHBondContact OD1-NE1 2.93Å; A53-W326 HydrophobicContact CB-CB 3.79Å; S322-W326 VanDerWaalsContact O-CB 3.26Å; S322-W326 WeakPolarHBondContact O-CB 3.39Å; S322-W326 PolarHBondContact O-N 2.83Å; M323-W326 PolarHBondContact O-N 3.5Å; L324-W326 VanDerWaalsContact C-N 3.35Å; W326-L328 PolarHBondContact O-N 3.48Å; W326-M329 PolarHBondContact O-N 2.68Å; W326-R330 VanDerWaalsContact CH2-NH1 3.28Å; W326-R330 VanDerWaalsContact O-CB 3.22Å; W326-R330 WeakPolarHBondContact O-CB 3.42Å; W326-R330 PolarHBondContact O-N 2.89Å |
| 327 | D | 80.8 | Confident | 81.1 | Confident | 24 Ų | 24 | 66.9 Ų | 66.9 | 13% | 0.128 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -60 | -47 | 177.2 | -85.1 | -14.1 | 0 | 0 | 0 | 111.6 | M323 L324 R330 Q331 | M323-D327 WeakPolarHBondContact O-CB 3.25Å; M323-D327 PolarHBondContact O-N 3.27Å; L324-D327 PolarHBondContact O-N 3.01Å; D327-R330 PolarHBondContact O-N 3.37Å; D327-Q331 VanDerWaalsContact O-CG 3.3Å; D327-Q331 WeakPolarHBondContact O-CG 3.17Å; D327-Q331 PolarHBondContact O-N 2.95Å |
| 328 | L | 86.9 | Confident | 81 | Confident | 90 Ų | 90 | 67.9 Ų | 67.9 | 47% | 0.471 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -63.4 | -47 | 179.4 | -72.2 | 173.3 | 0 | 0 | 0 | 112.2 | L324 F325 W326 R330 Q331 Q332 | L324-L328 HydrophobicContact CD1-CD1 4.31Å; L324-L328 HydrophobicContact CD1-CG 4.49Å; L324-L328 HydrophobicContact CG-CD1 4.03Å; L324-L328 WeakPolarHBondContact O-CB 3.2Å; L324-L328 VanDerWaalsContact O-CG 3.25Å; L324-L328 WeakPolarHBondContact O-CG 3.46Å; L324-L328 PolarHBondContact O-N 2.95Å; F325-L328 PolarHBondContact O-N 3.27Å; W326-L328 PolarHBondContact O-N 3.48Å; L328-R330 VanDerWaalsContact C-N 3.28Å; L328-R330 PolarHBondContact O-N 3.47Å; L328-Q331 PolarHBondContact O-N 3.05Å; L328-Q332 PolarHBondContact O-N 3.31Å |
| 329 | M | 87.1 | Confident | 80.8 | Confident | 56 Ų | 56 | 69.9 Ų | 69.9 | 28% | 0.276 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -63.5 | -38.3 | 179.3 | -70.9 | 177.4 | 74 | 0 | 0 | 111.4 | L49 L52 A53 F325 W326 Q332 A333 | L49-M329 HydrophobicContact CB-CB 4.5Å; L49-M329 HydrophobicContact CD2-CB 4.14Å; L49-M329 HydrophobicContact CD2-CE 3.69Å; L52-M329 HydrophobicContact CB-CE 3.47Å; L52-M329 VanDerWaalsContact CB-CE 3.47Å; L52-M329 HydrophobicContact CB-SD 4.09Å; L52-M329 HydrophobicContact CD1-CE 3.59Å; L52-M329 HydrophobicContact CG-CE 4.18Å; A53-M329 HydrophobicContact CB-SD 4.37Å; F325-M329 VanDerWaalsContact O-CB 3.27Å; F325-M329 WeakPolarHBondContact O-CB 3.29Å; F325-M329 WeakPolarHBondContact O-CG 3.35Å; F325-M329 PolarHBondContact O-N 3.01Å; W326-M329 PolarHBondContact O-N 2.68Å; M329-Q332 PolarHBondContact O-N 2.96Å; M329-A333 WeakPolarHBondContact O-CB 3.25Å; M329-A333 PolarHBondContact O-N 3.19Å |
| 330 | R | 83.3 | Confident | 80.9 | Confident | 22 Ų | 22 | 70.9 Ų | 70.9 | 8% | 0.083 | 35% | 0.351 | C | S | . | . | H | α-helix | trans | -69.3 | -42.6 | 177.9 | -168.7 | 179.1 | 172.7 | -172.8 | 1.9 | 112.2 | P38 P39 V41 D46 L49 W326 D327 L328 Q332 A333 I334 | P38-R330 VanDerWaalsContact CB-CZ 3.46Å; P38-R330 VanDerWaalsContact CB-NH1 3.26Å; P39-R330 PolarHBondContact O-NH2 2.99Å; V41-R330 HydrophobicContact CG2-CG 3.79Å; D46-R330 IonicContact OD1-NE 3.69Å; L49-R330 HydrophobicContact CD1-CB 4.23Å; W326-R330 VanDerWaalsContact CH2-NH1 3.28Å; W326-R330 VanDerWaalsContact O-CB 3.22Å; W326-R330 WeakPolarHBondContact O-CB 3.42Å; W326-R330 PolarHBondContact O-N 2.89Å; D327-R330 PolarHBondContact O-N 3.37Å; L328-R330 VanDerWaalsContact C-N 3.28Å; L328-R330 PolarHBondContact O-N 3.47Å; R330-Q332 VanDerWaalsContact C-N 3.26Å; R330-Q332 PolarHBondContact O-N 3.06Å; R330-A333 PolarHBondContact O-N 3.29Å; R330-I334 HydrophobicContact CG-CD1 4.03Å; R330-I334 WeakPolarHBondContact O-CD1 3.49Å; R330-I334 VanDerWaalsContact O-CG1 3.29Å; R330-I334 WeakPolarHBondContact O-CG1 3.27Å; R330-I334 PolarHBondContact O-N 3.36Å; R330-I334 VanDerWaalsContact O-N 3.08Å |
| 331 | Q | 83.3 | Confident | 80.9 | Confident | 73 Ų | 73 | 69.4 Ų | 69.4 | 34% | 0.341 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -58.5 | -41.2 | 174.1 | -75.5 | 176.3 | 15.1 | 0 | 0 | 111.5 | D327 L328 I334 K335 | D327-Q331 VanDerWaalsContact O-CG 3.3Å; D327-Q331 WeakPolarHBondContact O-CG 3.17Å; D327-Q331 PolarHBondContact O-N 2.95Å; L328-Q331 PolarHBondContact O-N 3.05Å; Q331-I334 PolarHBondContact O-N 3.06Å; Q331-K335 WeakPolarHBondContact O-CG 3.33Å; Q331-K335 PolarHBondContact O-N 3.26Å; Q331-K335 VanDerWaalsContact O-N 3.12Å |
| 332 | Q | 84.9 | Confident | 80.6 | Confident | 96 Ų | 96 | 71.1 Ų | 71.1 | 45% | 0.449 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -65.7 | -46.6 | 176.5 | -170.9 | 58.5 | 32.7 | 0 | 0 | 111.8 | L328 M329 R330 I334 K335 D336 | L328-Q332 PolarHBondContact O-N 3.31Å; M329-Q332 PolarHBondContact O-N 2.96Å; R330-Q332 VanDerWaalsContact C-N 3.26Å; R330-Q332 PolarHBondContact O-N 3.06Å; Q332-I334 PolarHBondContact O-N 3.2Å; Q332-I334 VanDerWaalsContact O-N 3.15Å; Q332-K335 PolarHBondContact O-N 3.39Å; Q332-D336 PolarHBondContact NE2-OD1 2.87Å; Q332-D336 VanDerWaalsContact NE2-OD1 3.09Å; Q332-D336 PolarHBondContact NE2-OD2 3.16Å; Q332-D336 VanDerWaalsContact NE2-OD2 3.1Å; Q332-D336 PolarHBondContact O-N 3.07Å; Q332-D336 VanDerWaalsContact O-N 3.11Å |
| 333 | A | 82.4 | Confident | 80.4 | Confident | 26 Ų | 26 | 74.9 Ų | 74.9 | 22% | 0.215 | 36% | 0.361 | C | S | . | . | H | α-helix | trans | -61.7 | -23.7 | 178.3 | 0 | 0 | 0 | 0 | 0 | 114.1 | L49 M329 R330 | L49-A333 HydrophobicContact CD1-CB 4.1Å; M329-A333 WeakPolarHBondContact O-CB 3.25Å; M329-A333 PolarHBondContact O-N 3.19Å; R330-A333 PolarHBondContact O-N 3.29Å |
| 334 | I | 80.8 | Confident | 80.4 | Confident | 48 Ų | 48 | 76.9 Ų | 76.9 | 25% | 0.246 | 37% | 0.37 | C | S | . | . | H | α-helix | trans | -83.3 | -35.3 | 174.4 | -66 | 159.7 | 0 | 0 | 0 | 111.4 | P39 V41 R330 Q331 Q332 D336 K337 | P39-I334 HydrophobicContact CB-CD1 3.89Å; P39-I334 HydrophobicContact CB-CG2 4.36Å; P39-I334 HydrophobicContact CG-CD1 3.84Å; P39-I334 HydrophobicContact CG-CG2 4.32Å; V41-I334 HydrophobicContact CG2-CD1 3.74Å; V41-I334 HydrophobicContact CG2-CG1 3.61Å; R330-I334 HydrophobicContact CG-CD1 4.03Å; R330-I334 WeakPolarHBondContact O-CD1 3.49Å; R330-I334 VanDerWaalsContact O-CG1 3.29Å; R330-I334 WeakPolarHBondContact O-CG1 3.27Å; R330-I334 PolarHBondContact O-N 3.36Å; R330-I334 VanDerWaalsContact O-N 3.08Å; Q331-I334 PolarHBondContact O-N 3.06Å; Q332-I334 PolarHBondContact O-N 3.2Å; Q332-I334 VanDerWaalsContact O-N 3.15Å; I334-D336 VanDerWaalsContact C-N 3.29Å; I334-K337 PolarHBondContact O-N 2.73Å |
| 335 | K | 76.2 | Confident | 80.1 | Confident | 150 Ų | 150 | 76.1 Ų | 76.1 | 65% | 0.652 | 36% | 0.363 | S | S | * | . | H | α-helix | trans | -68.1 | -29.6 | 176.9 | -76.1 | 177.6 | -178.1 | 179.3 | 0 | 113.1 | Q331 Q332 K337 | Q331-K335 WeakPolarHBondContact O-CG 3.33Å; Q331-K335 PolarHBondContact O-N 3.26Å; Q331-K335 VanDerWaalsContact O-N 3.12Å; Q332-K335 PolarHBondContact O-N 3.39Å; K335-K337 PolarHBondContact O-N 3.1Å |
| 336 | D | 63.8 | Low | 79.5 | Confident | 121 Ų | 121 | 78.8 Ų | 78.8 | 65% | 0.647 | 38% | 0.377 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -84.9 | 5.6 | -179.5 | -62.6 | -25.9 | 0 | 0 | 0 | 113 | Q332 I334 | Q332-D336 PolarHBondContact NE2-OD1 2.87Å; Q332-D336 VanDerWaalsContact NE2-OD1 3.09Å; Q332-D336 PolarHBondContact NE2-OD2 3.16Å; Q332-D336 VanDerWaalsContact NE2-OD2 3.1Å; Q332-D336 PolarHBondContact O-N 3.07Å; Q332-D336 VanDerWaalsContact O-N 3.11Å; I334-D336 VanDerWaalsContact C-N 3.29Å |
| 337 | K | 58.3 | Low | 78.9 | Confident | 200 Ų | 200 | 82.4 Ų | 82.4 | 87% | 0.87 | 40% | 0.398 | S | S | * | . | trans | -99.4 | 0 | 171.1 | -87.2 | -172 | 173.3 | -171.6 | 0 | 111.4 | I334 K335 | I334-K337 PolarHBondContact O-N 2.73Å; K335-K337 PolarHBondContact O-N 3.1Å |
Retrieved 337 of 337 residues in 106.4 ms
(Link to these results)