| 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 | T | 35.3 | Very low | 40.3 | Very low | 204 Ų | 204 | 153.1 Ų | 153.1 | 100% | 1.252 | 78% | 0.78 | S | S | * | * | 0 | 90.7 | 0 | -37.4 | 0 | 0 | 0 | 0 | 106.8 | |||||
| 2 | E | 34.1 | Very low | 41.3 | Very low | 196 Ų | 196 | 148 Ų | 148 | 92% | 0.916 | 76% | 0.755 | S | S | * | * | trans | -112.9 | 135.2 | -172.6 | -163 | 162 | -174.1 | 0 | 0 | 108.1 | ||||
| 3 | K | 30.6 | Very low | 42.2 | Very low | 185 Ų | 185 | 146 Ų | 146 | 80% | 0.804 | 75% | 0.748 | S | S | * | * | trans | -93.8 | 116 | -165.2 | -140.3 | -174.5 | -178.1 | -163.8 | 0 | 108.1 | D5 | K3-D5 PolarHBondContact O-N 3.3Å; K3-D5 VanDerWaalsContact O-N 3.15Å | ||
| 4 | M | 33 | Very low | 42.3 | Very low | 157 Ų | 157 | 148.8 Ų | 148.8 | 77% | 0.773 | 75% | 0.746 | S | S | * | * | trans | -70.7 | 104.3 | 164.7 | -80.1 | 176.4 | 168.3 | 0 | 0 | 108.4 | Y6 | M4-Y6 HydrophobicContact CB-CE2 4.21Å; M4-Y6 PolarHBondContact O-N 3.11Å | ||
| 5 | D | 35.7 | Very low | 42.8 | Very low | 141 Ų | 141 | 143.3 Ų | 143.3 | 75% | 0.754 | 73% | 0.727 | S | S | * | * | trans | -76.2 | 113.6 | 161.7 | -86.3 | -23.3 | 0 | 0 | 0 | 108.3 | K3 | K3-D5 PolarHBondContact O-N 3.3Å; K3-D5 VanDerWaalsContact O-N 3.15Å | ||
| 6 | Y | 38.6 | Very low | 43.1 | Very low | 191 Ų | 191 | 137.4 Ų | 137.4 | 75% | 0.749 | 70% | 0.698 | S | S | * | * | trans | -77.4 | 130.2 | 170.2 | -76.6 | -98.7 | 0 | 0 | 0 | 108.9 | M4 N8 | M4-Y6 HydrophobicContact CB-CE2 4.21Å; M4-Y6 PolarHBondContact O-N 3.11Å; Y6-N8 PolarHBondContact O-N 3.49Å; Y6-N8 VanDerWaalsContact O-N 3.17Å | ||
| 7 | P | 44 | Very low | 43.7 | Very low | 111 Ų | 111 | 133.8 Ų | 133.8 | 72% | 0.721 | 68% | 0.68 | S | S | * | * | trans | -66.8 | 115.5 | 174.2 | 26.7 | -32.4 | 0 | 0 | 0 | 109.8 | C9 | P7-C9 PolarHBondContact O-N 3.23Å; P7-C9 PolarHBondContact O-SG 3.04Å | ||
| 8 | N | 43.2 | Very low | 44.1 | Very low | 135 Ų | 135 | 130.7 Ų | 130.7 | 72% | 0.722 | 66% | 0.664 | S | S | * | * | trans | -73.9 | 119.7 | -177.1 | -161.5 | 32.4 | 0 | 0 | 0 | 111 | Y6 D10 | Y6-N8 PolarHBondContact O-N 3.49Å; Y6-N8 VanDerWaalsContact O-N 3.17Å; N8-D10 PolarHBondContact ND2-OD2 3.1Å; N8-D10 PolarHBondContact OD1-OD2 2.98Å | ||
| 9 | C | 52.1 | Low | 44.4 | Very low | 57 Ų | 57 | 129.5 Ų | 129.5 | 39% | 0.385 | 65% | 0.654 | S | S | . | * | trans | -106 | 21 | -167.1 | -67.8 | 0 | 0 | 0 | 0 | 114.6 | P7 H11 | P7-C9 PolarHBondContact O-N 3.23Å; P7-C9 PolarHBondContact O-SG 3.04Å; C9-H11 VanDerWaalsContact C-N 3.29Å; C9-H11 PolarHBondContact O-N 2.89Å | ||
| 10 | D | 45.9 | Very low | 44.6 | Very low | 120 Ų | 120 | 125.4 Ų | 125.4 | 64% | 0.642 | 64% | 0.637 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.7 | -1.4 | -169 | -66.9 | -30.5 | 0 | 0 | 0 | 116.1 | N8 | N8-D10 PolarHBondContact ND2-OD2 3.1Å; N8-D10 PolarHBondContact OD1-OD2 2.98Å |
| 11 | H | 51 | Low | 44.7 | Very low | 187 Ų | 187 | 128.3 Ų | 128.3 | 87% | 0.866 | 64% | 0.641 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -138.2 | 34.6 | -169.8 | -78.2 | -50.5 | 0 | 0 | 0 | 116 | C9 | C9-H11 VanDerWaalsContact C-N 3.29Å; C9-H11 PolarHBondContact O-N 2.89Å |
| 12 | L | 51.7 | Low | 45 | Very low | 92 Ų | 92 | 124.2 Ų | 124.2 | 48% | 0.482 | 61% | 0.607 | S | S | . | * | trans | -113.2 | 148.3 | 179.8 | -72.2 | 174 | 0 | 0 | 0 | 113.8 | D16 I17 | L12-D16 HydrophobicContact CB-CB 4.14Å; L12-D16 HydrophobicContact CD2-CB 4.37Å; L12-I17 HydrophobicContact CB-CG1 4.44Å; L12-I17 WeakPolarHBondContact O-CD1 3.35Å | ||
| 13 | N | 52.8 | Low | 45.3 | Very low | 122 Ų | 122 | 119.6 Ų | 119.6 | 65% | 0.652 | 59% | 0.589 | S | S | * | * | trans | -67.7 | 159.2 | 177.3 | -90.2 | -24.1 | 0 | 0 | 0 | 111.7 | S15 D16 I17 | N13-S15 VanDerWaalsContact C-N 3.25Å; N13-S15 PolarHBondContact O-N 3.32Å; N13-S15 VanDerWaalsContact O-N 3.11Å; N13-D16 WeakPolarHBondContact O-CA 3.49Å; N13-D16 PolarHBondContact O-N 3.2Å; N13-I17 PolarHBondContact O-N 3.12Å | ||
| 14 | Y | 44.7 | Very low | 45.8 | Very low | 185 Ų | 185 | 116.7 Ų | 116.7 | 73% | 0.725 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -52.6 | -37.6 | -176.2 | -170.9 | -102.5 | 0 | 0 | 0 | 114.2 | D16 I18 | Y14-D16 VanDerWaalsContact C-N 3.3Å; Y14-D16 PolarHBondContact O-N 3.18Å; Y14-I18 HydrophobicContact CD1-CD1 4.04Å; Y14-I18 HydrophobicContact CE1-CD1 3.69Å; Y14-I18 WeakPolarHBondContact O-CG1 3.41Å; Y14-I18 PolarHBondContact O-N 3.1Å |
| 15 | S | 48.9 | Very low | 46.1 | Very low | 67 Ų | 67 | 112.6 Ų | 112.6 | 47% | 0.469 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -65.7 | -29.7 | 174.7 | 50.5 | 0 | 0 | 0 | 0 | 114.2 | N13 K19 | N13-S15 VanDerWaalsContact C-N 3.25Å; N13-S15 PolarHBondContact O-N 3.32Å; N13-S15 VanDerWaalsContact O-N 3.11Å; S15-K19 WeakPolarHBondContact O-CG 3.48Å; S15-K19 PolarHBondContact O-N 3.46Å |
| 16 | D | 48.2 | Very low | 46.1 | Very low | 49 Ų | 49 | 112 Ų | 112 | 26% | 0.262 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -93.3 | -24.9 | -177 | -55 | -46.2 | 0 | 0 | 0 | 111.2 | L12 N13 Y14 I18 K19 C20 | L12-D16 HydrophobicContact CB-CB 4.14Å; L12-D16 HydrophobicContact CD2-CB 4.37Å; N13-D16 WeakPolarHBondContact O-CA 3.49Å; N13-D16 PolarHBondContact O-N 3.2Å; Y14-D16 VanDerWaalsContact C-N 3.3Å; Y14-D16 PolarHBondContact O-N 3.18Å; D16-I18 VanDerWaalsContact C-N 3.35Å; D16-K19 PolarHBondContact O-N 3.32Å; D16-K19 IonicContact OD1-NZ 3.87Å; D16-K19 PolarHBondContact OD1-NZ 3.02Å; D16-C20 VanDerWaalsContact O-CB 3.24Å; D16-C20 WeakPolarHBondContact O-CB 3.44Å; D16-C20 PolarHBondContact O-N 3.03Å |
| 17 | I | 52.4 | Low | 46 | Very low | 75 Ų | 75 | 108.2 Ų | 108.2 | 39% | 0.385 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -61.4 | -43.3 | 163.2 | -64.2 | 172.6 | 0 | 0 | 0 | 110.4 | L12 N13 C20 W21 | L12-I17 HydrophobicContact CB-CG1 4.44Å; L12-I17 WeakPolarHBondContact O-CD1 3.35Å; N13-I17 PolarHBondContact O-N 3.12Å; I17-C20 PolarHBondContact O-N 2.92Å; I17-W21 PolarHBondContact O-N 3.11Å |
| 18 | I | 51.9 | Low | 45.5 | Very low | 78 Ų | 78 | 107.6 Ų | 107.6 | 40% | 0.4 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -62 | -47.6 | 175.6 | -69.4 | 170.8 | 0 | 0 | 0 | 110.8 | Y14 D16 C20 W21 E22 | Y14-I18 HydrophobicContact CD1-CD1 4.04Å; Y14-I18 HydrophobicContact CE1-CD1 3.69Å; Y14-I18 WeakPolarHBondContact O-CG1 3.41Å; Y14-I18 PolarHBondContact O-N 3.1Å; D16-I18 VanDerWaalsContact C-N 3.35Å; I18-C20 VanDerWaalsContact C-N 3.27Å; I18-C20 PolarHBondContact O-N 3.15Å; I18-W21 CarbonylContact O-C 3.53Å; I18-W21 PolarHBondContact O-N 3.2Å; I18-E22 HydrophobicContact CG2-CG 4.44Å; I18-E22 PolarHBondContact O-N 3.32Å |
| 19 | K | 49.7 | Very low | 45.2 | Very low | 109 Ų | 109 | 103.5 Ų | 103.5 | 47% | 0.474 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -62.6 | -33.1 | 175 | -68.1 | 171.2 | -164.2 | 154.7 | 0 | 113 | S15 D16 N23 | S15-K19 WeakPolarHBondContact O-CG 3.48Å; S15-K19 PolarHBondContact O-N 3.46Å; D16-K19 PolarHBondContact O-N 3.32Å; D16-K19 IonicContact OD1-NZ 3.87Å; D16-K19 PolarHBondContact OD1-NZ 3.02Å; K19-N23 VanDerWaalsContact O-CB 3.25Å; K19-N23 WeakPolarHBondContact O-CB 3.46Å; K19-N23 VanDerWaalsContact O-CG 3.3Å; K19-N23 PolarHBondContact O-N 3.33Å |
| 20 | C | 47.2 | Very low | 44.3 | Very low | 46 Ų | 46 | 104.7 Ų | 104.7 | 31% | 0.311 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -69 | -40 | 175.6 | -165.8 | 0 | 0 | 0 | 0 | 110.9 | D16 I17 I18 N23 F24 | D16-C20 VanDerWaalsContact O-CB 3.24Å; D16-C20 WeakPolarHBondContact O-CB 3.44Å; D16-C20 PolarHBondContact O-N 3.03Å; I17-C20 PolarHBondContact O-N 2.92Å; I18-C20 VanDerWaalsContact C-N 3.27Å; I18-C20 PolarHBondContact O-N 3.15Å; C20-N23 PolarHBondContact O-N 2.87Å; C20-F24 VanDerWaalsContact O-CB 3.25Å; C20-F24 WeakPolarHBondContact O-CB 3.45Å; C20-F24 PolarHBondContact O-N 3Å |
| 21 | W | 48.1 | Very low | 43.7 | Very low | 187 Ų | 187 | 106.7 Ų | 106.7 | 71% | 0.708 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -67.5 | -39.1 | 171.1 | -98.9 | 83.6 | 0 | 0 | 0 | 113.3 | I17 I18 F24 S25 | I17-W21 PolarHBondContact O-N 3.11Å; I18-W21 CarbonylContact O-C 3.53Å; I18-W21 PolarHBondContact O-N 3.2Å; W21-F24 PolarHBondContact O-N 3.08Å; W21-S25 VanDerWaalsContact O-CB 3.24Å; W21-S25 WeakPolarHBondContact O-CB 3.37Å; W21-S25 PolarHBondContact O-N 2.92Å |
| 22 | E | 41.8 | Very low | 43.1 | Very low | 119 Ų | 119 | 103.3 Ų | 103.3 | 56% | 0.556 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -66.4 | -40 | 173.5 | -75.1 | -176.3 | 143.2 | 0 | 0 | 111.5 | I18 K26 | I18-E22 HydrophobicContact CG2-CG 4.44Å; I18-E22 PolarHBondContact O-N 3.32Å; E22-K26 VanDerWaalsContact O-CB 3.29Å; E22-K26 WeakPolarHBondContact O-CB 3.37Å; E22-K26 PolarHBondContact O-N 3.48Å |
| 23 | N | 40.6 | Very low | 42.3 | Very low | 99 Ų | 99 | 106.2 Ų | 106.2 | 53% | 0.529 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -72.4 | -31.3 | 174.5 | -76.9 | -15.3 | 0 | 0 | 0 | 112.8 | K19 C20 N27 | K19-N23 VanDerWaalsContact O-CB 3.25Å; K19-N23 WeakPolarHBondContact O-CB 3.46Å; K19-N23 VanDerWaalsContact O-CG 3.3Å; K19-N23 PolarHBondContact O-N 3.33Å; C20-N23 PolarHBondContact O-N 2.87Å; N23-N27 WeakPolarHBondContact O-CB 3.38Å; N23-N27 PolarHBondContact O-N 3.39Å |
| 24 | F | 40.1 | Very low | 41.3 | Very low | 124 Ų | 124 | 106 Ų | 106 | 54% | 0.544 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -69.2 | -46.4 | 171.7 | -172.1 | -89.2 | 0 | 0 | 0 | 110.2 | C20 W21 K26 N27 E28 | C20-F24 VanDerWaalsContact O-CB 3.25Å; C20-F24 WeakPolarHBondContact O-CB 3.45Å; C20-F24 PolarHBondContact O-N 3Å; W21-F24 PolarHBondContact O-N 3.08Å; F24-K26 VanDerWaalsContact C-N 3.3Å; F24-K26 PolarHBondContact O-N 3.16Å; F24-N27 PolarHBondContact O-N 3.22Å; F24-E28 VanDerWaalsContact O-CB 3.28Å; F24-E28 WeakPolarHBondContact O-CB 3.4Å; F24-E28 PolarHBondContact O-N 3.29Å |
| 25 | S | 38.6 | Very low | 41.3 | Very low | 71 Ų | 71 | 101 Ų | 101 | 50% | 0.497 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -66.7 | -29 | 175.6 | -173.3 | 0 | 0 | 0 | 0 | 113 | W21 S29 | W21-S25 VanDerWaalsContact O-CB 3.24Å; W21-S25 WeakPolarHBondContact O-CB 3.37Å; W21-S25 PolarHBondContact O-N 2.92Å; S25-S29 PolarHBondContact O-N 3.44Å; S25-S29 PolarHBondContact O-OG 2.94Å |
| 26 | K | 36.2 | Very low | 41.2 | Very low | 127 Ų | 127 | 103.4 Ų | 103.4 | 55% | 0.552 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -71.8 | -49.9 | 168.9 | -94.3 | -173.6 | 167.7 | -175.2 | 0 | 111.7 | E22 F24 E28 S29 D30 | E22-K26 VanDerWaalsContact O-CB 3.29Å; E22-K26 WeakPolarHBondContact O-CB 3.37Å; E22-K26 PolarHBondContact O-N 3.48Å; F24-K26 VanDerWaalsContact C-N 3.3Å; F24-K26 PolarHBondContact O-N 3.16Å; K26-E28 PolarHBondContact O-N 3.04Å; K26-E28 VanDerWaalsContact O-N 3.17Å; K26-S29 WeakPolarHBondContact CA-OG 3.41Å; K26-S29 CarbonylContact O-C 3.5Å; K26-S29 PolarHBondContact O-N 3.36Å; K26-S29 PolarHBondContact O-OG 3.08Å; K26-D30 VanDerWaalsContact O-CB 3.27Å; K26-D30 WeakPolarHBondContact O-CB 3.04Å; K26-D30 PolarHBondContact O-N 2.8Å |
| 27 | N | 36.9 | Very low | 41.5 | Very low | 113 Ų | 113 | 105.1 Ų | 105.1 | 60% | 0.604 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -59.7 | -30.9 | 174.8 | -77.4 | -4.8 | 0 | 0 | 0 | 111.7 | N23 F24 F31 | N23-N27 WeakPolarHBondContact O-CB 3.38Å; N23-N27 PolarHBondContact O-N 3.39Å; F24-N27 PolarHBondContact O-N 3.22Å; N27-F31 WeakPolarHBondContact O-CB 3.48Å; N27-F31 PolarHBondContact O-N 3.41Å |
| 28 | E | 33.8 | Very low | 42 | Very low | 97 Ų | 97 | 102.8 Ų | 102.8 | 45% | 0.453 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -77.6 | -27.7 | 174.7 | -161.6 | 169.8 | -141 | 0 | 0 | 112.9 | F24 K26 Y32 | F24-E28 VanDerWaalsContact O-CB 3.28Å; F24-E28 WeakPolarHBondContact O-CB 3.4Å; F24-E28 PolarHBondContact O-N 3.29Å; K26-E28 PolarHBondContact O-N 3.04Å; K26-E28 VanDerWaalsContact O-N 3.17Å; E28-Y32 WeakPolarHBondContact O-CD2 3.39Å |
| 29 | S | 35.6 | Very low | 42.3 | Very low | 50 Ų | 50 | 107.3 Ų | 107.3 | 35% | 0.35 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -73 | -47.2 | 166.4 | 57.5 | 0 | 0 | 0 | 0 | 112 | S25 K26 F31 Y32 E33 | S25-S29 PolarHBondContact O-N 3.44Å; S25-S29 PolarHBondContact O-OG 2.94Å; K26-S29 WeakPolarHBondContact CA-OG 3.41Å; K26-S29 CarbonylContact O-C 3.5Å; K26-S29 PolarHBondContact O-N 3.36Å; K26-S29 PolarHBondContact O-OG 3.08Å; S29-F31 VanDerWaalsContact C-N 3.31Å; S29-F31 PolarHBondContact O-N 3.42Å; S29-Y32 CarbonylContact O-C 3.38Å; S29-Y32 WeakPolarHBondContact O-CA 3.44Å; S29-Y32 PolarHBondContact O-N 2.96Å; S29-E33 PolarHBondContact O-N 3.02Å |
| 30 | D | 33.4 | Very low | 42.9 | Very low | 82 Ų | 82 | 104 Ų | 104 | 44% | 0.439 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -68.6 | -31.1 | -174.5 | -58.4 | 3.9 | 0 | 0 | 0 | 110.7 | K26 Y32 E33 | K26-D30 VanDerWaalsContact O-CB 3.27Å; K26-D30 WeakPolarHBondContact O-CB 3.04Å; K26-D30 PolarHBondContact O-N 2.8Å; D30-Y32 PolarHBondContact O-N 3.25Å; D30-E33 PolarHBondContact O-N 3.11Å |
| 31 | F | 34.6 | Very low | 43.8 | Very low | 162 Ų | 162 | 104.4 Ų | 104.4 | 71% | 0.711 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -70.8 | -11.8 | 171.2 | -166.6 | -99.3 | 0 | 0 | 0 | 113.8 | N27 S29 | N27-F31 WeakPolarHBondContact O-CB 3.48Å; N27-F31 PolarHBondContact O-N 3.41Å; S29-F31 VanDerWaalsContact C-N 3.31Å; S29-F31 PolarHBondContact O-N 3.42Å |
| 32 | Y | 38.5 | Very low | 44.6 | Very low | 116 Ų | 116 | 100.8 Ų | 100.8 | 46% | 0.455 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -117.6 | 2 | 173.9 | -69.6 | -56.3 | 0 | 0 | 0 | 114.2 | E28 S29 D30 | E28-Y32 WeakPolarHBondContact O-CD2 3.39Å; S29-Y32 CarbonylContact O-C 3.38Å; S29-Y32 WeakPolarHBondContact O-CA 3.44Å; S29-Y32 PolarHBondContact O-N 2.96Å; D30-Y32 PolarHBondContact O-N 3.25Å |
| 33 | E | 33.2 | Very low | 45.7 | Very low | 152 Ų | 152 | 98.9 Ų | 98.9 | 71% | 0.71 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -94.9 | -2.7 | 175.1 | -92.7 | -170.2 | 167.6 | 0 | 0 | 114.8 | S29 D30 D35 | S29-E33 PolarHBondContact O-N 3.02Å; D30-E33 PolarHBondContact O-N 3.11Å; E33-D35 PolarHBondContact O-N 3.31Å |
| 34 | N | 32.9 | Very low | 47.1 | Very low | 118 Ų | 118 | 96.5 Ų | 96.5 | 63% | 0.631 | 50% | 0.498 | S | S | * | . | trans | -70.9 | 78.9 | 156.4 | -84 | 14.4 | 0 | 0 | 0 | 110.2 | D36 | N34-D36 PolarHBondContact O-N 3.27Š| ||
| 35 | D | 45.2 | Very low | 48.6 | Very low | 81 Ų | 81 | 95.8 Ų | 95.8 | 43% | 0.433 | 50% | 0.495 | S | S | . | . | trans | -67.9 | 75.2 | 149 | -103.1 | -7.2 | 0 | 0 | 0 | 106.4 | E33 F37 K212 | E33-D35 PolarHBondContact O-N 3.31Å; D35-F37 VanDerWaalsContact C-N 3.32Å; D35-F37 HydrophobicContact CB-CE2 4.4Å; D35-F37 VanDerWaalsContact O-CD2 3.28Å; D35-F37 WeakPolarHBondContact O-CD2 3.4Å; D35-F37 PolarHBondContact O-N 2.93Å; D35-K212 IonicContact OD1-NZ 2.69Å; D35-K212 PolarHBondContact OD1-NZ 2.74Å; D35-K212 IonicContact OD2-NZ 2.65Å | ||
| 36 | D | 46.7 | Very low | 50.2 | Low | 116 Ų | 116 | 100.8 Ų | 100.8 | 62% | 0.62 | 50% | 0.504 | S | S | * | . | trans | -62.1 | 90.7 | 178.3 | -86.8 | -29.2 | 0 | 0 | 0 | 109.4 | N34 C38 | N34-D36 PolarHBondContact O-N 3.27Å; D36-C38 VanDerWaalsContact C-N 3.29Å; D36-C38 PolarHBondContact O-N 3.02Å | ||
| 37 | F | 54.2 | Low | 52.3 | Low | 85 Ų | 85 | 98.8 Ų | 98.8 | 37% | 0.373 | 50% | 0.502 | S | S | . | . | trans | -67.5 | 90.6 | 169.1 | -82.5 | -86.3 | 0 | 0 | 0 | 109.1 | D35 E39 Y202 | D35-F37 VanDerWaalsContact C-N 3.32Å; D35-F37 HydrophobicContact CB-CE2 4.4Å; D35-F37 VanDerWaalsContact O-CD2 3.28Å; D35-F37 WeakPolarHBondContact O-CD2 3.4Å; D35-F37 PolarHBondContact O-N 2.93Å; F37-E39 PolarHBondContact O-N 2.89Å; F37-Y202 HydrophobicContact CD1-CE1 4.44Å; F37-Y202 AromaticContact CE1-CD1 3.74Å; F37-Y202 HydrophobicContact CE1-CD1 3.74Å; F37-Y202 AromaticContact CE1-CD2 3.86Å; F37-Y202 HydrophobicContact CE1-CD2 3.86Å; F37-Y202 AromaticContact CE1-CE1 3.76Å; F37-Y202 HydrophobicContact CE1-CE1 3.76Å; F37-Y202 AromaticContact CE1-CE2 3.9Å; F37-Y202 HydrophobicContact CE1-CE2 3.9Å; F37-Y202 AromaticContact CE1-CG 3.78Å; F37-Y202 HydrophobicContact CE1-CG 3.78Å; F37-Y202 AromaticContact CE1-CZ 3.84Å; F37-Y202 HydrophobicContact CZ-CD1 4.32Å; F37-Y202 AromaticContact CZ-CD2 3.82Å; F37-Y202 HydrophobicContact CZ-CD2 3.82Å; F37-Y202 HydrophobicContact CZ-CE2 4.2Å; F37-Y202 AromaticContact CZ-CG 3.9Å; F37-Y202 HydrophobicContact CZ-CG 3.9Å | ||
| 38 | C | 61.8 | Low | 54.4 | Low | 26 Ų | 26 | 93.9 Ų | 93.9 | 18% | 0.176 | 48% | 0.476 | C | S | . | . | trans | -38.9 | 105.8 | 166.1 | -70.7 | 0 | 0 | 0 | 0 | 111.7 | D36 P40 C289 L291 | D36-C38 VanDerWaalsContact C-N 3.29Å; D36-C38 PolarHBondContact O-N 3.02Å; C38-P40 WeakPolarHBondContact O-CD 3.31Å; C38-C289 WeakPolarHBondContact CA-SG 3.32Å; C38-C289 HydrophobicContact CB-CB 4.48Å; C38-C289 WeakPolarHBondContact CB-SG 3.44Å; C38-C289 WeakPolarHBondContact SG-CA 3.26Å; C38-C289 WeakPolarHBondContact SG-CB 3.37Å; C38-C289 CovalentContact SG-SG 2.02Å; C38-C289 PolarHBondContact SG-SG 3.29Å; C38-L291 HydrophobicContact CB-CB 4.36Å; C38-L291 HydrophobicContact CB-CD1 4.21Å | ||
| 39 | E | 59.6 | Low | 56.7 | Low | 173 Ų | 173 | 90.2 Ų | 90.2 | 81% | 0.808 | 46% | 0.46 | S | S | * | . | P | Polyproline II helix | trans | -66.8 | 117.1 | 177.6 | -73.7 | -151.1 | 125 | 0 | 0 | 110.3 | F37 | F37-E39 PolarHBondContact O-N 2.89Š|
| 40 | P | 62.3 | Low | 59.1 | Low | 41 Ų | 41 | 94.1 Ų | 94.1 | 27% | 0.266 | 48% | 0.475 | S | S | . | . | P | Polyproline II helix | trans | -69 | 139.1 | 174.7 | 22.2 | -26.9 | 0 | 0 | 0 | 110.7 | C38 E44 K45 L291 | C38-P40 WeakPolarHBondContact O-CD 3.31Å; P40-E44 HydrophobicContact CB-CB 4.09Å; P40-K45 HydrophobicContact CB-CG 3.87Å; P40-K45 HydrophobicContact CG-CD 4.36Å; P40-K45 HydrophobicContact CG-CG 3.63Å; P40-K45 WeakPolarHBondContact O-CE 3.35Å; P40-L291 HydrophobicContact CB-CD2 3.61Å; P40-L291 HydrophobicContact CG-CD2 4.16Å |
| 41 | S | 66.4 | Low | 61.7 | Low | 53 Ų | 53 | 95.7 Ų | 95.7 | 37% | 0.371 | 48% | 0.478 | S | S | . | . | P | Polyproline II helix | trans | -63.5 | 162.1 | 170.7 | 68.2 | 0 | 0 | 0 | 0 | 111.7 | S43 E44 K45 | S41-S43 PolarHBondContact O-N 3.14Å; S41-S43 VanDerWaalsContact O-N 3.13Å; S41-S43 PolarHBondContact OG-OG 3.15Å; S41-E44 VanDerWaalsContact CB-OE2 3.26Å; S41-E44 WeakPolarHBondContact CB-OE2 3.47Å; S41-E44 PolarHBondContact N-OE2 3.44Å; S41-E44 PolarHBondContact O-N 3.24Å; S41-E44 VanDerWaalsContact OG-CG 3.25Å; S41-E44 WeakPolarHBondContact OG-CG 3.14Å; S41-E44 PolarHBondContact OG-OE2 3.37Å; S41-K45 PolarHBondContact O-N 2.99Å |
| 42 | T | 64.3 | Low | 64.2 | Low | 111 Ų | 111 | 88 Ų | 88 | 68% | 0.681 | 44% | 0.444 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -59.7 | -29.1 | -172.4 | -40.9 | 0 | 0 | 0 | 0 | 113.7 | Y46 | T42-Y46 WeakPolarHBondContact O-CD2 3.47Å; T42-Y46 WeakPolarHBondContact O-CE2 3.46Å |
| 43 | S | 65.8 | Low | 66.6 | Low | 79 Ų | 79 | 84 Ų | 84 | 55% | 0.552 | 43% | 0.432 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -78.7 | -41.5 | 174.3 | 47 | 0 | 0 | 0 | 0 | 112.4 | S41 K45 Y46 V47 | S41-S43 PolarHBondContact O-N 3.14Å; S41-S43 VanDerWaalsContact O-N 3.13Å; S41-S43 PolarHBondContact OG-OG 3.15Å; S43-K45 VanDerWaalsContact C-N 3.29Å; S43-K45 PolarHBondContact O-N 3.28Å; S43-Y46 PolarHBondContact O-N 3.3Å; S43-V47 WeakPolarHBondContact O-CG2 3.27Å; S43-V47 PolarHBondContact O-N 3.36Å |
| 44 | E | 69.6 | Low | 69.3 | Low | 50 Ų | 50 | 80.1 Ų | 80.1 | 23% | 0.234 | 42% | 0.42 | C | S | . | . | H | α-helix | trans | -61.5 | -36.9 | 178.4 | -71.1 | 171.3 | 138.3 | 0 | 0 | 112.2 | P40 S41 Y46 I48 M292 | P40-E44 HydrophobicContact CB-CB 4.09Å; S41-E44 VanDerWaalsContact CB-OE2 3.26Å; S41-E44 WeakPolarHBondContact CB-OE2 3.47Å; S41-E44 PolarHBondContact N-OE2 3.44Å; S41-E44 PolarHBondContact O-N 3.24Å; S41-E44 VanDerWaalsContact OG-CG 3.25Å; S41-E44 WeakPolarHBondContact OG-CG 3.14Å; S41-E44 PolarHBondContact OG-OE2 3.37Å; E44-Y46 PolarHBondContact O-N 3.05Å; E44-I48 HydrophobicContact CB-CD1 3.75Å; E44-I48 HydrophobicContact CB-CG1 4.3Å; E44-I48 HydrophobicContact CG-CD1 4.18Å; E44-I48 WeakPolarHBondContact O-CB 3.47Å; E44-I48 WeakPolarHBondContact O-CG1 3.22Å; E44-I48 PolarHBondContact O-N 3.23Å; E44-I48 VanDerWaalsContact O-N 3.15Å; E44-M292 HydrophobicContact CG-CE 3.97Å; E44-M292 HydrophobicContact CG-CG 4.33Å; E44-M292 WeakPolarHBondContact OE1-CG 3.18Å |
| 45 | K | 70.3 | Confident | 72.1 | Confident | 109 Ų | 109 | 75.2 Ų | 75.2 | 47% | 0.474 | 40% | 0.396 | S | S | . | . | H | α-helix | trans | -52 | -28.2 | 175.1 | -78.3 | 177.4 | 175.7 | 167.6 | 0 | 114.2 | P40 S41 S43 | P40-K45 HydrophobicContact CB-CG 3.87Å; P40-K45 HydrophobicContact CG-CD 4.36Å; P40-K45 HydrophobicContact CG-CG 3.63Å; P40-K45 WeakPolarHBondContact O-CE 3.35Å; S41-K45 PolarHBondContact O-N 2.99Å; S43-K45 VanDerWaalsContact C-N 3.29Å; S43-K45 PolarHBondContact O-N 3.28Å |
| 46 | Y | 73.1 | Confident | 74.3 | Confident | 176 Ų | 176 | 71.4 Ų | 71.4 | 69% | 0.69 | 38% | 0.376 | S | S | * | . | H | α-helix | trans | -109.4 | -39.7 | -179.3 | -59.1 | -76 | 0 | 0 | 0 | 113.6 | T42 S43 E44 M50 | T42-Y46 WeakPolarHBondContact O-CD2 3.47Å; T42-Y46 WeakPolarHBondContact O-CE2 3.46Å; S43-Y46 PolarHBondContact O-N 3.3Å; E44-Y46 PolarHBondContact O-N 3.05Å; Y46-M50 WeakPolarHBondContact O-CB 3.44Å; Y46-M50 PolarHBondContact O-N 3.26Å |
| 47 | V | 81.1 | Confident | 76.5 | Confident | 85 Ų | 85 | 68.7 Ų | 68.7 | 52% | 0.515 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -69.7 | -40.8 | -176 | 175.7 | 0 | 0 | 0 | 0 | 111.4 | S43 F51 | S43-V47 WeakPolarHBondContact O-CG2 3.27Å; S43-V47 PolarHBondContact O-N 3.36Å; V47-F51 WeakPolarHBondContact O-CB 3.49Å; V47-F51 PolarHBondContact O-N 3.33Å |
| 48 | I | 79.9 | Confident | 78.4 | Confident | 9 Ų | 9 | 70.3 Ų | 70.3 | 5% | 0.046 | 38% | 0.377 | C | S | . | . | H | α-helix | trans | -64.1 | -53.6 | -176.3 | -63.7 | 176.3 | 0 | 0 | 0 | 111.6 | E44 M50 F51 Q52 L291 M292 Y295 | E44-I48 HydrophobicContact CB-CD1 3.75Å; E44-I48 HydrophobicContact CB-CG1 4.3Å; E44-I48 HydrophobicContact CG-CD1 4.18Å; E44-I48 WeakPolarHBondContact O-CB 3.47Å; E44-I48 WeakPolarHBondContact O-CG1 3.22Å; E44-I48 PolarHBondContact O-N 3.23Å; E44-I48 VanDerWaalsContact O-N 3.15Å; I48-M50 VanDerWaalsContact C-N 3.34Å; I48-M50 PolarHBondContact O-N 2.68Å; I48-F51 PolarHBondContact O-N 2.93Å; I48-Q52 VanDerWaalsContact O-CB 3.27Å; I48-Q52 WeakPolarHBondContact O-CB 3.49Å; I48-Q52 PolarHBondContact O-N 3.48Å; I48-L291 HydrophobicContact CD1-CD2 4.49Å; I48-M292 HydrophobicContact CD1-CE 3.95Å; I48-M292 HydrophobicContact CD1-CG 3.94Å; I48-M292 HydrophobicContact CD1-SD 3.79Å; I48-M292 HydrophobicContact CG1-CE 3.5Å; I48-M292 HydrophobicContact CG1-CG 4.44Å; I48-M292 HydrophobicContact CG1-SD 3.64Å; I48-Y295 HydrophobicContact CD1-CD2 4.09Å; I48-Y295 HydrophobicContact CG2-CD1 4.17Å; I48-Y295 HydrophobicContact CG2-CD2 3.33Å; I48-Y295 HydrophobicContact CG2-CE2 3.81Å; I48-Y295 HydrophobicContact CG2-CG 3.51Å |
| 49 | P | 81.7 | Confident | 79.9 | Confident | 20 Ų | 20 | 69.5 Ų | 69.5 | 13% | 0.13 | 37% | 0.371 | C | S | . | . | H | α-helix | trans | -64 | -39.2 | -178.1 | -23.8 | 37 | 0 | 0 | 0 | 112.7 | Q52 T53 T111 H112 | P49-Q52 PolarHBondContact O-N 3.45Å; P49-T53 VanDerWaalsContact O-CB 3.27Å; P49-T53 WeakPolarHBondContact O-CB 3.28Å; P49-T53 PolarHBondContact O-N 2.96Å; P49-T53 PolarHBondContact O-OG1 2.87Å; P49-T53 VanDerWaalsContact O-OG1 3.11Å; P49-T111 HydrophobicContact CB-CG2 3.95Å; P49-T111 HydrophobicContact CG-CG2 4.34Å; P49-H112 VanDerWaalsContact CB-CE1 3.49Å; P49-H112 WeakPolarHBondContact CB-CE1 3.16Å; P49-H112 PolarHBondContact O-NE2 3.01Å |
| 50 | M | 85.9 | Confident | 81.6 | Confident | 133 Ų | 133 | 63.7 Ų | 63.7 | 66% | 0.655 | 34% | 0.343 | S | S | * | . | H | α-helix | trans | -64.4 | -46.8 | 179.1 | -172.1 | 177.4 | -176.5 | 0 | 0 | 112.1 | Y46 I48 C54 | Y46-M50 WeakPolarHBondContact O-CB 3.44Å; Y46-M50 PolarHBondContact O-N 3.26Å; I48-M50 VanDerWaalsContact C-N 3.34Å; I48-M50 PolarHBondContact O-N 2.68Å; M50-C54 WeakPolarHBondContact O-CB 3.47Å; M50-C54 PolarHBondContact O-N 3.19Å; M50-C54 VanDerWaalsContact O-N 3.14Å; M50-C54 PolarHBondContact O-SG 3.32Å |
| 51 | F | 88.6 | Confident | 83.1 | Confident | 115 Ų | 115 | 68.5 Ų | 68.5 | 50% | 0.504 | 36% | 0.36 | S | S | . | . | H | α-helix | trans | -61.4 | -49.6 | 175.9 | 170.7 | -98.9 | 0 | 0 | 0 | 111.4 | V47 I48 T53 C54 A55 T299 | V47-F51 WeakPolarHBondContact O-CB 3.49Å; V47-F51 PolarHBondContact O-N 3.33Å; I48-F51 PolarHBondContact O-N 2.93Å; F51-T53 PolarHBondContact O-N 2.96Å; F51-C54 PolarHBondContact O-N 2.87Å; F51-A55 WeakPolarHBondContact O-CB 3.47Å; F51-A55 PolarHBondContact O-N 3.01Å; F51-T299 HydrophobicContact CE1-CG2 4.36Å |
| 52 | Q | 86.3 | Confident | 84.4 | Confident | 1 Ų | 1 | 69.2 Ų | 69.2 | 1% | 0.005 | 36% | 0.362 | C | S | . | . | H | α-helix | trans | -65.3 | -41.6 | -175.3 | 178.5 | 157.3 | -71.2 | 0 | 0 | 112.3 | I48 P49 A55 F56 T111 Y295 T299 | I48-Q52 VanDerWaalsContact O-CB 3.27Å; I48-Q52 WeakPolarHBondContact O-CB 3.49Å; I48-Q52 PolarHBondContact O-N 3.48Å; P49-Q52 PolarHBondContact O-N 3.45Å; Q52-A55 PolarHBondContact O-N 3.46Å; Q52-F56 VanDerWaalsContact CD-CE2 3.49Å; Q52-F56 HydrophobicContact CG-CD2 3.64Å; Q52-F56 HydrophobicContact CG-CE1 4.3Å; Q52-F56 HydrophobicContact CG-CE2 3.14Å; Q52-F56 HydrophobicContact CG-CG 4.39Å; Q52-F56 HydrophobicContact CG-CZ 3.53Å; Q52-F56 WeakPolarHBondContact O-CB 3.26Å; Q52-F56 WeakPolarHBondContact O-CD2 3.32Å; Q52-F56 VanDerWaalsContact O-CG 3.32Å; Q52-F56 WeakPolarHBondContact O-CG 3.2Å; Q52-F56 PolarHBondContact O-N 2.72Å; Q52-T111 HydrophobicContact CB-CG2 4.21Å; Q52-T111 HydrophobicContact CG-CG2 4.18Å; Q52-T111 PolarHBondContact NE2-OG1 2.91Å; Q52-Y295 VanDerWaalsContact OE1-CD1 3.24Å; Q52-Y295 PolarHBondContact OE1-O 3.27Å; Q52-T299 PolarHBondContact OE1-OG1 3.37Å |
| 53 | T | 88.8 | Confident | 85.8 | Confident | 31 Ų | 31 | 64 Ų | 64 | 19% | 0.19 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -64.6 | -44.1 | 175.1 | -69.1 | 0 | 0 | 0 | 0 | 111.8 | P49 F51 A55 F56 C57 A108 H112 | P49-T53 VanDerWaalsContact O-CB 3.27Å; P49-T53 WeakPolarHBondContact O-CB 3.28Å; P49-T53 PolarHBondContact O-N 2.96Å; P49-T53 PolarHBondContact O-OG1 2.87Å; P49-T53 VanDerWaalsContact O-OG1 3.11Å; F51-T53 PolarHBondContact O-N 2.96Å; T53-A55 VanDerWaalsContact C-N 3.33Å; T53-A55 PolarHBondContact O-N 3.45Å; T53-F56 PolarHBondContact O-N 3.01Å; T53-C57 WeakPolarHBondContact O-CB 3.41Å; T53-C57 PolarHBondContact O-N 2.6Å; T53-C57 PolarHBondContact O-SG 2.87Å; T53-A108 HydrophobicContact CG2-CB 4.41Å; T53-H112 WeakPolarHBondContact CB-NE2 3.49Å; T53-H112 PolarHBondContact OG1-CD2 3.21Å; T53-H112 PolarHBondContact OG1-NE2 2.97Å |
| 54 | C | 90.8 | Very high | 87.2 | Confident | 70 Ų | 70 | 61.7 Ų | 61.7 | 47% | 0.473 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -59.2 | -44.2 | 173.8 | -74.9 | 0 | 0 | 0 | 0 | 111.9 | M50 F51 C57 L58 | M50-C54 WeakPolarHBondContact O-CB 3.47Å; M50-C54 PolarHBondContact O-N 3.19Å; M50-C54 VanDerWaalsContact O-N 3.14Å; M50-C54 PolarHBondContact O-SG 3.32Å; F51-C54 PolarHBondContact O-N 2.87Å; C54-C57 PolarHBondContact O-N 3.36Å; C54-L58 WeakPolarHBondContact O-CG 3.4Å; C54-L58 PolarHBondContact O-N 3.31Å; C54-L58 VanDerWaalsContact O-N 3.11Å |
| 55 | A | 91.5 | Very high | 88.2 | Confident | 15 Ų | 15 | 65.5 Ų | 65.5 | 12% | 0.124 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -64.2 | -47.2 | 177 | 0 | 0 | 0 | 0 | 0 | 112.1 | F51 Q52 T53 C57 L58 I59 T299 | F51-A55 WeakPolarHBondContact O-CB 3.47Å; F51-A55 PolarHBondContact O-N 3.01Å; Q52-A55 PolarHBondContact O-N 3.46Å; T53-A55 VanDerWaalsContact C-N 3.33Å; T53-A55 PolarHBondContact O-N 3.45Å; A55-C57 PolarHBondContact O-N 2.91Å; A55-L58 PolarHBondContact O-N 2.97Å; A55-I59 HydrophobicContact CB-CD1 4.49Å; A55-I59 WeakPolarHBondContact O-CB 3.3Å; A55-I59 WeakPolarHBondContact O-CD1 3.46Å; A55-I59 WeakPolarHBondContact O-CG1 3.44Å; A55-I59 PolarHBondContact O-N 3.48Å; A55-T299 HydrophobicContact CB-CG2 3.49Å; A55-T299 VanDerWaalsContact CB-CG2 3.49Å |
| 56 | F | 91.8 | Very high | 89.2 | Confident | 2 Ų | 2 | 60.9 Ų | 60.9 | 1% | 0.009 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -63.2 | -37.5 | 177.4 | -69.4 | -27.3 | 0 | 0 | 0 | 112.9 | Q52 T53 I59 F60 L104 Q107 A108 Y302 | Q52-F56 VanDerWaalsContact CD-CE2 3.49Å; Q52-F56 HydrophobicContact CG-CD2 3.64Å; Q52-F56 HydrophobicContact CG-CE1 4.3Å; Q52-F56 HydrophobicContact CG-CE2 3.14Å; Q52-F56 HydrophobicContact CG-CG 4.39Å; Q52-F56 HydrophobicContact CG-CZ 3.53Å; Q52-F56 WeakPolarHBondContact O-CB 3.26Å; Q52-F56 WeakPolarHBondContact O-CD2 3.32Å; Q52-F56 VanDerWaalsContact O-CG 3.32Å; Q52-F56 WeakPolarHBondContact O-CG 3.2Å; Q52-F56 PolarHBondContact O-N 2.72Å; T53-F56 PolarHBondContact O-N 3.01Å; F56-I59 HydrophobicContact CD1-CD1 4.24Å; F56-I59 PolarHBondContact O-N 3.05Å; F56-F60 WeakPolarHBondContact O-CB 3.49Å; F56-F60 PolarHBondContact O-N 3.4Å; F56-L104 HydrophobicContact CB-CD2 4.27Å; F56-L104 HydrophobicContact CD1-CD2 3.59Å; F56-L104 HydrophobicContact CE1-CD2 4.02Å; F56-L104 HydrophobicContact CG-CD2 3.91Å; F56-Q107 HydrophobicContact CD2-CB 4.48Å; F56-Q107 HydrophobicContact CD2-CG 4.13Å; F56-Q107 HydrophobicContact CE2-CB 4.2Å; F56-Q107 HydrophobicContact CE2-CG 3.39Å; F56-Q107 HydrophobicContact CZ-CG 3.75Å; F56-A108 HydrophobicContact CB-CB 4.37Å; F56-A108 HydrophobicContact CD2-CB 4.25Å; F56-Y302 AromaticContact CE1-CD2 3.69Å; F56-Y302 HydrophobicContact CE1-CD2 3.69Å; F56-Y302 HydrophobicContact CE1-CE2 4.36Å; F56-Y302 HydrophobicContact CE1-CG 4.09Å; F56-Y302 HydrophobicContact CZ-CD2 4.14Å; F56-Y302 HydrophobicContact CZ-CE2 4.4Å |
| 57 | C | 92.8 | Very high | 90.2 | Very high | 58 Ų | 58 | 52.6 Ų | 52.6 | 39% | 0.392 | 29% | 0.285 | S | S | . | . | H | α-helix | trans | -60.1 | -46.8 | 171.7 | -74.7 | 0 | 0 | 0 | 0 | 111.7 | T53 C54 A55 F60 F61 | T53-C57 WeakPolarHBondContact O-CB 3.41Å; T53-C57 PolarHBondContact O-N 2.6Å; T53-C57 PolarHBondContact O-SG 2.87Å; C54-C57 PolarHBondContact O-N 3.36Å; A55-C57 PolarHBondContact O-N 2.91Å; C57-F60 PolarHBondContact O-N 3.46Å; C57-F61 WeakPolarHBondContact O-CD2 3.48Å; C57-F61 PolarHBondContact O-N 2.88Å |
| 58 | L | 93.5 | Very high | 90.7 | Very high | 120 Ų | 120 | 51 Ų | 51 | 63% | 0.628 | 28% | 0.277 | S | S | * | . | H | α-helix | trans | -63.3 | -46 | 176.9 | -69.8 | 171.2 | 0 | 0 | 0 | 112.1 | C54 A55 F60 F61 V62 | C54-L58 WeakPolarHBondContact O-CG 3.4Å; C54-L58 PolarHBondContact O-N 3.31Å; C54-L58 VanDerWaalsContact O-N 3.11Å; A55-L58 PolarHBondContact O-N 2.97Å; L58-F60 VanDerWaalsContact C-N 3.32Å; L58-F60 PolarHBondContact O-N 2.93Å; L58-F61 PolarHBondContact O-N 3.3Å; L58-V62 WeakPolarHBondContact O-CB 3.45Å; L58-V62 VanDerWaalsContact O-CG2 3.3Å; L58-V62 WeakPolarHBondContact O-CG2 3.25Å; L58-V62 PolarHBondContact O-N 3.47Å |
| 59 | I | 94.3 | Very high | 91.1 | Very high | 9 Ų | 9 | 53.2 Ų | 53.2 | 5% | 0.046 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -62.9 | -40.1 | 177.9 | -63.3 | 158.8 | 0 | 0 | 0 | 110.4 | A55 F56 G63 L101 L104 T299 T303 | A55-I59 HydrophobicContact CB-CD1 4.49Å; A55-I59 WeakPolarHBondContact O-CB 3.3Å; A55-I59 WeakPolarHBondContact O-CD1 3.46Å; A55-I59 WeakPolarHBondContact O-CG1 3.44Å; A55-I59 PolarHBondContact O-N 3.48Å; F56-I59 HydrophobicContact CD1-CD1 4.24Å; F56-I59 PolarHBondContact O-N 3.05Å; I59-G63 VanDerWaalsContact O-CA 3.24Å; I59-G63 WeakPolarHBondContact O-CA 3.41Å; I59-G63 PolarHBondContact O-N 2.92Å; I59-L101 HydrophobicContact CG2-CD2 3.79Å; I59-L101 WeakPolarHBondContact O-CD2 3.39Å; I59-L104 HydrophobicContact CB-CD1 4.09Å; I59-L104 HydrophobicContact CG2-CD1 3.73Å; I59-T299 HydrophobicContact CD1-CG2 4.22Å; I59-T303 VanDerWaalsContact CD1-OG1 3.28Å; I59-T303 WeakPolarHBondContact CD1-OG1 3.29Å |
| 60 | F | 94.8 | Very high | 91.4 | Very high | 50 Ų | 50 | 52.4 Ų | 52.4 | 22% | 0.219 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -59.7 | -58.6 | 175.1 | 177.2 | -97.8 | 0 | 0 | 0 | 111.2 | F56 C57 L58 V62 G63 V64 L101 L104 P105 | F56-F60 WeakPolarHBondContact O-CB 3.49Å; F56-F60 PolarHBondContact O-N 3.4Å; C57-F60 PolarHBondContact O-N 3.46Å; L58-F60 VanDerWaalsContact C-N 3.32Å; L58-F60 PolarHBondContact O-N 2.93Å; F60-V62 PolarHBondContact O-N 3.4Å; F60-G63 PolarHBondContact O-N 3.25Å; F60-V64 HydrophobicContact CD2-CG2 3.94Å; F60-V64 HydrophobicContact CE2-CG2 3.85Å; F60-V64 HydrophobicContact CG-CG2 4.4Å; F60-V64 HydrophobicContact CZ-CG2 4.23Å; F60-V64 WeakPolarHBondContact O-CB 3.37Å; F60-V64 WeakPolarHBondContact O-CG2 3.34Å; F60-V64 PolarHBondContact O-N 3.09Å; F60-L101 WeakPolarHBondContact CD2-O 3.47Å; F60-L104 HydrophobicContact CB-CB 4.49Å; F60-L104 HydrophobicContact CB-CD1 4.16Å; F60-L104 HydrophobicContact CD2-CB 4.43Å; F60-P105 HydrophobicContact CD2-CG 4.1Å; F60-P105 HydrophobicContact CE2-CG 3.9Å; F60-P105 HydrophobicContact CZ-CG 4.42Å |
| 61 | F | 94 | Very high | 91.5 | Very high | 143 Ų | 143 | 47.9 Ų | 47.9 | 63% | 0.627 | 26% | 0.261 | S | S | * | . | H | α-helix | trans | -63.7 | -47.2 | -176.4 | -73.2 | -64.6 | 0 | 0 | 0 | 112.6 | C57 L58 L65 | C57-F61 WeakPolarHBondContact O-CD2 3.48Å; C57-F61 PolarHBondContact O-N 2.88Å; L58-F61 PolarHBondContact O-N 3.3Å; F61-L65 WeakPolarHBondContact O-CB 3.24Å; F61-L65 PolarHBondContact O-N 2.9Å; F61-L65 VanDerWaalsContact O-N 3.08Å |
| 62 | V | 93.3 | Very high | 91.3 | Very high | 68 Ų | 68 | 43.8 Ų | 43.8 | 41% | 0.412 | 25% | 0.249 | S | C | . | . | H | α-helix | trans | -68.5 | -42.2 | -179.6 | 178.6 | 0 | 0 | 0 | 0 | 111.1 | L58 F60 G66 C306 I310 | L58-V62 WeakPolarHBondContact O-CB 3.45Å; L58-V62 VanDerWaalsContact O-CG2 3.3Å; L58-V62 WeakPolarHBondContact O-CG2 3.25Å; L58-V62 PolarHBondContact O-N 3.47Å; F60-V62 PolarHBondContact O-N 3.4Å; V62-G66 PolarHBondContact O-N 3.39Å; V62-C306 HydrophobicContact CB-CB 4.44Å; V62-C306 HydrophobicContact CG1-CB 4.15Å; V62-I310 HydrophobicContact CG1-CD1 4.12Å |
| 63 | G | 93.6 | Very high | 91.1 | Very high | 0 Ų | 0 | 43.8 Ų | 43.8 | 0% | 0 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -68.1 | -47.4 | -179.5 | 0 | 0 | 0 | 0 | 0 | 112.8 | I59 F60 G66 N67 | I59-G63 VanDerWaalsContact O-CA 3.24Å; I59-G63 WeakPolarHBondContact O-CA 3.41Å; I59-G63 PolarHBondContact O-N 2.92Å; F60-G63 PolarHBondContact O-N 3.25Å; G63-G66 PolarHBondContact O-N 3.48Å; G63-N67 WeakPolarHBondContact O-CB 3.44Å; G63-N67 PolarHBondContact O-N 3.09Å; G63-N67 PolarHBondContact O-ND2 3.23Å |
| 64 | V | 94.5 | Very high | 90.7 | Very high | 32 Ų | 32 | 42.8 Ų | 42.8 | 19% | 0.194 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -63.8 | -48.8 | 178.3 | 171.7 | 0 | 0 | 0 | 0 | 109.5 | F60 G66 N67 C68 L98 L101 | F60-V64 HydrophobicContact CD2-CG2 3.94Å; F60-V64 HydrophobicContact CE2-CG2 3.85Å; F60-V64 HydrophobicContact CG-CG2 4.4Å; F60-V64 HydrophobicContact CZ-CG2 4.23Å; F60-V64 WeakPolarHBondContact O-CB 3.37Å; F60-V64 WeakPolarHBondContact O-CG2 3.34Å; F60-V64 PolarHBondContact O-N 3.09Å; V64-G66 PolarHBondContact O-N 2.85Å; V64-N67 PolarHBondContact O-N 3.13Å; V64-C68 WeakPolarHBondContact O-CB 3.35Å; V64-C68 PolarHBondContact O-N 3.13Å; V64-C68 PolarHBondContact O-SG 3.31Å; V64-L98 HydrophobicContact CB-CD1 4.39Å; V64-L98 HydrophobicContact CG1-CD1 4.13Å; V64-L98 HydrophobicContact CG2-CD1 4.11Å; V64-L101 HydrophobicContact CG2-CB 4Å |
| 65 | L | 92.6 | Very high | 90.2 | Very high | 130 Ų | 130 | 41.3 Ų | 41.3 | 68% | 0.681 | 23% | 0.234 | S | C | * | . | H | α-helix | trans | -58.2 | -47 | 177.4 | -177.8 | 64.4 | 0 | 0 | 0 | 111.7 | F61 L69 | F61-L65 WeakPolarHBondContact O-CB 3.24Å; F61-L65 PolarHBondContact O-N 2.9Å; F61-L65 VanDerWaalsContact O-N 3.08Å; L65-L69 VanDerWaalsContact O-CB 3.22Å; L65-L69 WeakPolarHBondContact O-CB 3.33Å; L65-L69 PolarHBondContact O-N 3.43Å |
| 66 | G | 91.1 | Very high | 89.3 | Confident | 12 Ų | 12 | 46.5 Ų | 46.5 | 12% | 0.124 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -64.4 | -47.3 | -179.6 | 0 | 0 | 0 | 0 | 0 | 113.6 | V62 G63 V64 L69 V70 P309 | V62-G66 PolarHBondContact O-N 3.39Å; G63-G66 PolarHBondContact O-N 3.48Å; V64-G66 PolarHBondContact O-N 2.85Å; G66-L69 WeakPolarHBondContact O-CB 3.49Å; G66-L69 PolarHBondContact O-N 3.2Å; G66-V70 WeakPolarHBondContact O-CG2 3.1Å; G66-V70 PolarHBondContact O-N 3.02Å; G66-P309 VanDerWaalsContact C-CG 3.47Å |
| 67 | N | 93 | Very high | 88 | Confident | 1 Ų | 1 | 51.1 Ų | 51.1 | 1% | 0.005 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -74.2 | -37 | -178.7 | -72.3 | -62.9 | 0 | 0 | 0 | 112.1 | G63 V64 L69 V70 I71 A94 L98 L101 C305 P309 | G63-N67 WeakPolarHBondContact O-CB 3.44Å; G63-N67 PolarHBondContact O-N 3.09Å; G63-N67 PolarHBondContact O-ND2 3.23Å; V64-N67 PolarHBondContact O-N 3.13Å; N67-L69 VanDerWaalsContact C-N 3.33Å; N67-L69 PolarHBondContact O-N 3.15Å; N67-V70 WeakPolarHBondContact O-CB 3.48Å; N67-V70 PolarHBondContact O-N 3.34Å; N67-I71 WeakPolarHBondContact O-CG1 3.46Å; N67-I71 PolarHBondContact O-N 2.94Å; N67-A94 HydrophobicContact CB-CB 4.34Å; N67-L98 HydrophobicContact CB-CB 4.38Å; N67-L101 WeakPolarHBondContact ND2-CD1 3.31Å; N67-C305 PolarHBondContact ND2-O 2.81Å; N67-P309 WeakPolarHBondContact OD1-CG 3.4Å |
| 68 | C | 91.6 | Very high | 86.8 | Confident | 51 Ų | 51 | 50 Ų | 50 | 35% | 0.345 | 27% | 0.265 | S | S | . | . | H | α-helix | trans | -61.3 | -39.6 | 169.7 | -72.7 | 0 | 0 | 0 | 0 | 111.8 | V64 I71 A72 | V64-C68 WeakPolarHBondContact O-CB 3.35Å; V64-C68 PolarHBondContact O-N 3.13Å; V64-C68 PolarHBondContact O-SG 3.31Å; C68-I71 PolarHBondContact O-N 3.08Å; C68-A72 WeakPolarHBondContact O-CB 3.5Å; C68-A72 PolarHBondContact O-N 3.07Å |
| 69 | L | 88.4 | Confident | 85.4 | Confident | 57 Ų | 57 | 54.8 Ų | 54.8 | 30% | 0.298 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -63.3 | -41.1 | 174.7 | -179.8 | 68.4 | 0 | 0 | 0 | 112.2 | L65 G66 N67 T73 V323 L326 | L65-L69 VanDerWaalsContact O-CB 3.22Å; L65-L69 WeakPolarHBondContact O-CB 3.33Å; L65-L69 PolarHBondContact O-N 3.43Å; G66-L69 WeakPolarHBondContact O-CB 3.49Å; G66-L69 PolarHBondContact O-N 3.2Å; N67-L69 VanDerWaalsContact C-N 3.33Å; N67-L69 PolarHBondContact O-N 3.15Å; L69-T73 WeakPolarHBondContact O-CB 3.47Å; L69-T73 PolarHBondContact O-N 3.44Å; L69-T73 PolarHBondContact O-OG1 3.21Å; L69-V323 HydrophobicContact CD1-CG1 4.43Å; L69-V323 HydrophobicContact CD1-CG2 4.48Å; L69-V323 HydrophobicContact CD2-CG1 3.89Å; L69-V323 HydrophobicContact CD2-CG2 4.09Å; L69-V323 HydrophobicContact CG-CG2 4.18Å; L69-L326 HydrophobicContact CD1-CD2 3.85Å |
| 70 | V | 87.6 | Confident | 84 | Confident | 2 Ų | 2 | 60.3 Ų | 60.3 | 1% | 0.012 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -59.5 | -51.4 | 173.2 | 172.1 | 0 | 0 | 0 | 0 | 110.3 | G66 N67 T73 F74 A94 P309 Y312 F319 | G66-V70 WeakPolarHBondContact O-CG2 3.1Å; G66-V70 PolarHBondContact O-N 3.02Å; N67-V70 WeakPolarHBondContact O-CB 3.48Å; N67-V70 PolarHBondContact O-N 3.34Å; V70-T73 WeakPolarHBondContact O-CB 3.47Å; V70-T73 PolarHBondContact O-N 3.4Å; V70-F74 HydrophobicContact CG1-CD2 3.96Å; V70-F74 HydrophobicContact CG1-CE2 3.55Å; V70-F74 WeakPolarHBondContact O-CD2 3.45Å; V70-F74 PolarHBondContact O-N 3.12Å; V70-A94 HydrophobicContact CB-CB 4.12Å; V70-A94 HydrophobicContact CG1-CB 3.72Å; V70-P309 HydrophobicContact CG2-CB 4.17Å; V70-P309 HydrophobicContact CG2-CG 4.24Å; V70-Y312 HydrophobicContact CG2-CD2 4.32Å; V70-F319 HydrophobicContact CB-CZ 4.38Å; V70-F319 HydrophobicContact CG2-CE1 4.39Å; V70-F319 HydrophobicContact CG2-CE2 4.07Å; V70-F319 HydrophobicContact CG2-CZ 3.56Å |
| 71 | I | 88.8 | Confident | 82.5 | Confident | 39 Ų | 39 | 66.7 Ų | 66.7 | 20% | 0.2 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -60.5 | -47.1 | 179 | -70.5 | 166 | 0 | 0 | 0 | 111.4 | N67 C68 T73 F74 A75 F91 A94 L98 | N67-I71 WeakPolarHBondContact O-CG1 3.46Å; N67-I71 PolarHBondContact O-N 2.94Å; C68-I71 PolarHBondContact O-N 3.08Å; I71-T73 VanDerWaalsContact C-N 3.33Å; I71-T73 PolarHBondContact O-N 2.82Å; I71-F74 PolarHBondContact O-N 3.31Å; I71-F74 VanDerWaalsContact O-N 3.12Å; I71-A75 PolarHBondContact O-N 3.26Å; I71-F91 HydrophobicContact CG1-CE2 4.36Å; I71-F91 HydrophobicContact CG2-CE2 4.18Å; I71-A94 HydrophobicContact CD1-CB 4.44Å; I71-A94 HydrophobicContact CG1-CB 4.14Å; I71-L98 HydrophobicContact CD1-CD2 3.85Å |
| 72 | A | 84.8 | Confident | 81.4 | Confident | 29 Ų | 29 | 61.6 Ų | 61.6 | 24% | 0.24 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -62.3 | -37.5 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | C68 F74 A75 L76 | C68-A72 WeakPolarHBondContact O-CB 3.5Å; C68-A72 PolarHBondContact O-N 3.07Å; A72-F74 VanDerWaalsContact C-N 3.32Å; A72-F74 PolarHBondContact O-N 2.88Å; A72-A75 PolarHBondContact O-N 3.38Å; A72-L76 HydrophobicContact CB-CD1 4.43Å; A72-L76 WeakPolarHBondContact O-CB 3.24Å; A72-L76 PolarHBondContact O-N 3.19Å |
| 73 | T | 81.4 | Confident | 80.3 | Confident | 1 Ų | 1 | 64.8 Ų | 64.8 | 1% | 0.006 | 31% | 0.31 | C | S | . | . | I | π-helix | trans | -62.2 | -38.8 | 174.3 | -58.2 | 0 | 0 | 0 | 0 | 111.5 | L69 V70 I71 Y77 R78 F319 D322 | L69-T73 WeakPolarHBondContact O-CB 3.47Å; L69-T73 PolarHBondContact O-N 3.44Å; L69-T73 PolarHBondContact O-OG1 3.21Å; V70-T73 WeakPolarHBondContact O-CB 3.47Å; V70-T73 PolarHBondContact O-N 3.4Å; I71-T73 VanDerWaalsContact C-N 3.33Å; I71-T73 PolarHBondContact O-N 2.82Å; T73-Y77 WeakPolarHBondContact O-CB 3.21Å; T73-Y77 PolarHBondContact O-N 3.3Å; T73-R78 PolarHBondContact O-N 2.95Å; T73-F319 HydrophobicContact CG2-CE2 4.3Å; T73-D322 HydrophobicContact CG2-CB 3.76Å |
| 74 | F | 80.9 | Confident | 79.6 | Confident | 9 Ų | 9 | 66.8 Ų | 66.8 | 4% | 0.039 | 32% | 0.324 | C | S | . | . | I | π-helix | trans | -72.2 | -40 | 174.3 | -70.8 | -64.7 | 0 | 0 | 0 | 113 | V70 I71 A72 R78 L80 L82 D87 L90 F91 | V70-F74 HydrophobicContact CG1-CD2 3.96Å; V70-F74 HydrophobicContact CG1-CE2 3.55Å; V70-F74 WeakPolarHBondContact O-CD2 3.45Å; V70-F74 PolarHBondContact O-N 3.12Å; I71-F74 PolarHBondContact O-N 3.31Å; I71-F74 VanDerWaalsContact O-N 3.12Å; A72-F74 VanDerWaalsContact C-N 3.32Å; A72-F74 PolarHBondContact O-N 2.88Å; F74-R78 WeakPolarHBondContact O-CB 3.35Å; F74-L80 PolarHBondContact O-N 2.89Å; F74-L80 VanDerWaalsContact O-N 3.11Å; F74-L82 HydrophobicContact CD1-CD2 3.85Å; F74-L82 HydrophobicContact CE1-CD2 4.3Å; F74-L82 HydrophobicContact CG-CD2 4.39Å; F74-D87 HydrophobicContact CE1-CB 3.75Å; F74-D87 HydrophobicContact CZ-CB 4.38Å; F74-L90 HydrophobicContact CE2-CB 4.45Å; F74-L90 HydrophobicContact CZ-CB 4.25Å; F74-F91 HydrophobicContact CB-CD2 4.11Å; F74-F91 HydrophobicContact CD2-CB 4.11Å; F74-F91 HydrophobicContact CD2-CD2 4.04Å; F74-F91 HydrophobicContact CE2-CB 4.22Å; F74-F91 HydrophobicContact CG-CD2 4.31Å |
| 75 | A | 79.2 | Confident | 79 | Confident | 39 Ų | 39 | 65.9 Ų | 65.9 | 32% | 0.322 | 32% | 0.318 | S | S | . | . | I | π-helix | trans | -69.9 | -57.5 | -179.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | I71 A72 R79 L80 | I71-A75 PolarHBondContact O-N 3.26Å; A72-A75 PolarHBondContact O-N 3.38Å; A75-R79 WeakPolarHBondContact O-CA 3.34Å; A75-R79 PolarHBondContact O-N 3.01Å; A75-L80 HydrophobicContact CB-CD2 4.33Å |
| 76 | L | 73.7 | Confident | 78.5 | Confident | 125 Ų | 125 | 59.9 Ų | 59.9 | 65% | 0.654 | 29% | 0.287 | S | S | * | . | I | π-helix | trans | -80.7 | -58.7 | -171 | -58.6 | 174.8 | 0 | 0 | 0 | 112 | A72 L326 | A72-L76 HydrophobicContact CB-CD1 4.43Å; A72-L76 WeakPolarHBondContact O-CB 3.24Å; A72-L76 PolarHBondContact O-N 3.19Å; L76-L326 HydrophobicContact CD1-CD1 4.24Å |
| 77 | Y | 64.9 | Low | 78.2 | Confident | 98 Ų | 98 | 60.3 Ų | 60.3 | 38% | 0.384 | 29% | 0.286 | S | S | . | . | I | π-helix | trans | -77.6 | -34.1 | -170.7 | -165.8 | -115.6 | 0 | 0 | 0 | 112.9 | T73 D322 Q325 | T73-Y77 WeakPolarHBondContact O-CB 3.21Å; T73-Y77 PolarHBondContact O-N 3.3Å; Y77-D322 HydrophobicContact CD1-CB 4.07Å; Y77-D322 HydrophobicContact CE1-CB 4.28Å; Y77-D322 WeakPolarHBondContact CE1-OD1 3.31Å; Y77-Q325 HydrophobicContact CE2-CG 4.1Å; Y77-Q325 PolarHBondContact OH-OE1 2.74Å |
| 78 | R | 67 | Low | 77.9 | Confident | 36 Ų | 36 | 60.3 Ų | 60.3 | 14% | 0.136 | 29% | 0.286 | C | S | . | . | S | Bend | trans | -95.4 | -3.2 | 177.9 | -60.5 | 179.7 | 177.2 | -164.3 | 9.3 | 113.5 | T73 F74 L80 R81 D87 D322 | T73-R78 PolarHBondContact O-N 2.95Å; F74-R78 WeakPolarHBondContact O-CB 3.35Å; R78-L80 VanDerWaalsContact C-N 3.27Å; R78-L80 PolarHBondContact O-N 3.4Å; R78-R81 WeakPolarHBondContact O-CA 3.31Å; R78-R81 WeakPolarHBondContact O-CB 3.37Å; R78-R81 PolarHBondContact O-N 3.43Å; R78-D87 IonicContact CZ-OD1 3.62Å; R78-D87 IonicContact NH1-OD1 3.99Å; R78-D87 PolarHBondContact NH1-OD1 3.48Å; R78-D87 IonicContact NH1-OD2 3.45Å; R78-D322 IonicContact CZ-OD2 3.9Å; R78-D322 IonicContact NE-OD2 2.69Å; R78-D322 PolarHBondContact NE-OD2 3.42Å; R78-D322 IonicContact NH2-OD2 2.9Å; R78-D322 PolarHBondContact NH2-OD2 3.14Å |
| 79 | R | 63.6 | Low | 77.9 | Confident | 220 Ų | 220 | 58.2 Ų | 58.2 | 83% | 0.83 | 27% | 0.271 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 48.8 | 46.4 | -179.3 | -160.1 | -168.1 | -67 | -155.5 | -2.8 | 112.2 | A75 R81 | A75-R79 WeakPolarHBondContact O-CA 3.34Å; A75-R79 PolarHBondContact O-N 3.01Å; R79-R81 PolarHBondContact O-N 3.45Å |
| 80 | L | 64.6 | Low | 77.8 | Confident | 125 Ų | 125 | 56.7 Ų | 56.7 | 65% | 0.654 | 26% | 0.263 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 56.1 | 9.9 | -173.9 | -58.9 | 170.9 | 0 | 0 | 0 | 115.3 | F74 A75 R78 L82 | F74-L80 PolarHBondContact O-N 2.89Å; F74-L80 VanDerWaalsContact O-N 3.11Å; A75-L80 HydrophobicContact CB-CD2 4.33Å; R78-L80 VanDerWaalsContact C-N 3.27Å; R78-L80 PolarHBondContact O-N 3.4Å; L80-L82 PolarHBondContact O-N 2.99Å |
| 81 | R | 63.3 | Low | 77.9 | Confident | 183 Ų | 183 | 58.9 Ų | 58.9 | 69% | 0.691 | 27% | 0.273 | S | S | * | . | trans | -85.5 | 78 | -178.3 | -152.5 | 174.2 | -160.8 | 171 | 6.4 | 109.7 | R78 R79 R83 | R78-R81 WeakPolarHBondContact O-CA 3.31Å; R78-R81 WeakPolarHBondContact O-CB 3.37Å; R78-R81 PolarHBondContact O-N 3.43Å; R79-R81 PolarHBondContact O-N 3.45Å; R81-R83 WeakPolarHBondContact O-CG 3.44Å; R81-R83 PolarHBondContact O-N 3.41Å; R81-R83 VanDerWaalsContact O-N 3.15Å | ||
| 82 | L | 71.4 | Confident | 78.1 | Confident | 37 Ų | 37 | 58.8 Ų | 58.8 | 19% | 0.194 | 27% | 0.271 | C | S | . | . | trans | -58.4 | 113.6 | 173.3 | -57.5 | 169.3 | 0 | 0 | 0 | 108.7 | F74 L80 D87 V88 | F74-L82 HydrophobicContact CD1-CD2 3.85Å; F74-L82 HydrophobicContact CE1-CD2 4.3Å; F74-L82 HydrophobicContact CG-CD2 4.39Å; L80-L82 PolarHBondContact O-N 2.99Å; L82-D87 HydrophobicContact CB-CB 4.37Å; L82-D87 HydrophobicContact CD2-CB 4.07Å; L82-V88 HydrophobicContact CB-CG2 3.93Å; L82-V88 HydrophobicContact CD1-CB 4.31Å; L82-V88 HydrophobicContact CD1-CG1 4.41Å; L82-V88 HydrophobicContact CD1-CG2 3.84Å; L82-V88 HydrophobicContact CG-CG2 4.42Å | ||
| 83 | R | 70.1 | Confident | 78.5 | Confident | 135 Ų | 135 | 57.4 Ų | 57.4 | 51% | 0.509 | 26% | 0.26 | S | S | . | . | trans | -95.6 | -10.8 | -167.6 | -74 | -170 | 172.9 | 111.7 | -7.3 | 113.8 | R81 D87 R161 | R81-R83 WeakPolarHBondContact O-CG 3.44Å; R81-R83 PolarHBondContact O-N 3.41Å; R81-R83 VanDerWaalsContact O-N 3.15Å; R83-D87 PolarHBondContact N-OD2 2.88Å; R83-R161 PolarHBondContact O-NH2 3.15Å | ||
| 84 | S | 78.6 | Confident | 79 | Confident | 41 Ų | 41 | 57.5 Ų | 57.5 | 29% | 0.287 | 26% | 0.261 | S | S | . | . | S | Bend | trans | -148.4 | 165.5 | 177.5 | 66.9 | 0 | 0 | 0 | 0 | 110.9 | T86 D87 | S84-T86 VanDerWaalsContact C-N 3.3Å; S84-T86 PolarHBondContact O-N 3.02Å; S84-D87 PolarHBondContact N-OD2 2.84Å; S84-D87 WeakPolarHBondContact O-CB 3.32Å; S84-D87 PolarHBondContact O-N 3.15Å; S84-D87 PolarHBondContact OG-N 3.19Å; S84-D87 PolarHBondContact OG-OD2 3.03Å |
| 85 | M | 82 | Confident | 79.7 | Confident | 14 Ų | 14 | 59.9 Ų | 59.9 | 7% | 0.069 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -60.9 | -40.4 | 175.2 | -55.1 | -84.5 | 62 | 0 | 0 | 112.6 | D87 V88 F89 D146 I164 L165 G168 | M85-D87 PolarHBondContact O-N 2.65Å; M85-V88 HydrophobicContact CE-CG2 4.33Å; M85-V88 WeakPolarHBondContact O-CA 3.49Å; M85-V88 VanDerWaalsContact O-CB 3.27Å; M85-V88 WeakPolarHBondContact O-CB 3.18Å; M85-V88 PolarHBondContact O-N 3.49Å; M85-F89 HydrophobicContact CB-CD2 4.39Å; M85-F89 HydrophobicContact CB-CE2 3.87Å; M85-F89 HydrophobicContact CB-CZ 4.4Å; M85-F89 WeakPolarHBondContact O-CD2 3.2Å; M85-F89 PolarHBondContact O-N 3.41Å; M85-D146 HydrophobicContact CB-CB 4.12Å; M85-D146 WeakPolarHBondContact CB-OD1 3.47Å; M85-D146 WeakPolarHBondContact CG-OD1 3.45Å; M85-I164 HydrophobicContact CE-CG2 4.48Å; M85-I164 WeakPolarHBondContact CE-O 3.47Å; M85-I164 HydrophobicContact CG-CG2 3.63Å; M85-I164 HydrophobicContact SD-CG2 3.51Å; M85-I164 VanDerWaalsContact SD-CG2 3.51Å; M85-L165 VanDerWaalsContact CE-CA 3.49Å; M85-L165 HydrophobicContact CE-CD2 4.27Å; M85-G168 WeakPolarHBondContact SD-CA 3.24Å; M85-G168 PolarHBondContact SD-N 2.88Å; M85-G168 VanDerWaalsContact SD-N 3.41Å |
| 86 | T | 83.1 | Confident | 80.4 | Confident | 3 Ų | 3 | 58.1 Ų | 58.1 | 2% | 0.018 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -61 | -36.8 | 179.4 | -18.5 | 0 | 0 | 0 | 0 | 111.7 | S84 V88 F89 L90 I143 D146 R147 M262 | S84-T86 VanDerWaalsContact C-N 3.3Å; S84-T86 PolarHBondContact O-N 3.02Å; T86-V88 PolarHBondContact O-N 2.67Å; T86-F89 PolarHBondContact O-N 3.09Å; T86-L90 HydrophobicContact CG2-CD1 4.11Å; T86-L90 HydrophobicContact CG2-CG 4.27Å; T86-L90 VanDerWaalsContact O-CB 3.24Å; T86-L90 WeakPolarHBondContact O-CB 3.31Å; T86-L90 WeakPolarHBondContact O-CG 3.36Å; T86-L90 PolarHBondContact O-N 2.82Å; T86-I143 HydrophobicContact CG2-CG1 4.06Å; T86-I143 HydrophobicContact CG2-CG2 3.95Å; T86-D146 PolarHBondContact N-OD2 2.69Å; T86-D146 PolarHBondContact OG1-OD2 2.97Å; T86-R147 VanDerWaalsContact CG2-NH2 3.29Å; T86-R147 VanDerWaalsContact OG1-CZ 3.25Å; T86-R147 PolarHBondContact OG1-NH1 3.12Å; T86-R147 PolarHBondContact OG1-NH2 3.09Å; T86-M262 HydrophobicContact CG2-CE 3.94Å |
| 87 | D | 83.8 | Confident | 81.4 | Confident | 21 Ų | 21 | 52.1 Ų | 52.1 | 11% | 0.112 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -61.4 | -36.2 | 175.7 | -60 | -46.6 | 0 | 0 | 0 | 111.2 | F74 R78 L82 R83 S84 M85 F91 | F74-D87 HydrophobicContact CE1-CB 3.75Å; F74-D87 HydrophobicContact CZ-CB 4.38Å; R78-D87 IonicContact CZ-OD1 3.62Å; R78-D87 IonicContact NH1-OD1 3.99Å; R78-D87 PolarHBondContact NH1-OD1 3.48Å; R78-D87 IonicContact NH1-OD2 3.45Å; L82-D87 HydrophobicContact CB-CB 4.37Å; L82-D87 HydrophobicContact CD2-CB 4.07Å; R83-D87 PolarHBondContact N-OD2 2.88Å; S84-D87 PolarHBondContact N-OD2 2.84Å; S84-D87 WeakPolarHBondContact O-CB 3.32Å; S84-D87 PolarHBondContact O-N 3.15Å; S84-D87 PolarHBondContact OG-N 3.19Å; S84-D87 PolarHBondContact OG-OD2 3.03Å; M85-D87 PolarHBondContact O-N 2.65Å; D87-F91 WeakPolarHBondContact O-CB 3.25Å; D87-F91 PolarHBondContact O-N 3.14Å; D87-F91 VanDerWaalsContact O-N 3.15Å |
| 88 | V | 88.2 | Confident | 82.9 | Confident | 1 Ų | 1 | 48.8 Ų | 48.8 | 1% | 0.006 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -65.9 | -52.8 | 174.5 | -173.2 | 0 | 0 | 0 | 0 | 110.2 | L82 M85 T86 L90 F91 H92 K169 A172 | L82-V88 HydrophobicContact CB-CG2 3.93Å; L82-V88 HydrophobicContact CD1-CB 4.31Å; L82-V88 HydrophobicContact CD1-CG1 4.41Å; L82-V88 HydrophobicContact CD1-CG2 3.84Å; L82-V88 HydrophobicContact CG-CG2 4.42Å; M85-V88 HydrophobicContact CE-CG2 4.33Å; M85-V88 WeakPolarHBondContact O-CA 3.49Å; M85-V88 VanDerWaalsContact O-CB 3.27Å; M85-V88 WeakPolarHBondContact O-CB 3.18Å; M85-V88 PolarHBondContact O-N 3.49Å; T86-V88 PolarHBondContact O-N 2.67Å; V88-L90 PolarHBondContact O-N 3.13Å; V88-F91 WeakPolarHBondContact O-CB 3.27Å; V88-F91 PolarHBondContact O-N 3.42Å; V88-H92 PolarHBondContact O-CD2 3.15Å; V88-H92 VanDerWaalsContact O-CD2 3.24Å; V88-H92 PolarHBondContact O-N 2.97Å; V88-K169 HydrophobicContact CG1-CG 4.34Å; V88-A172 HydrophobicContact CG1-CB 4.16Å |
| 89 | F | 89.7 | Confident | 84.2 | Confident | 8 Ų | 8 | 50.7 Ų | 50.7 | 4% | 0.035 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -65.9 | -37.5 | -177 | -56.7 | -40.1 | 0 | 0 | 0 | 112.9 | M85 T86 H92 L93 L139 C142 I143 D146 G168 A171 A172 | M85-F89 HydrophobicContact CB-CD2 4.39Å; M85-F89 HydrophobicContact CB-CE2 3.87Å; M85-F89 HydrophobicContact CB-CZ 4.4Å; M85-F89 WeakPolarHBondContact O-CD2 3.2Å; M85-F89 PolarHBondContact O-N 3.41Å; T86-F89 PolarHBondContact O-N 3.09Å; F89-H92 PolarHBondContact O-N 3.4Å; F89-L93 VanDerWaalsContact O-CB 3.31Å; F89-L93 WeakPolarHBondContact O-CB 3.13Å; F89-L93 PolarHBondContact O-N 3.42Å; F89-L139 HydrophobicContact CB-CD2 4.13Å; F89-L139 HydrophobicContact CD1-CD2 3.91Å; F89-L139 HydrophobicContact CG-CD2 4.39Å; F89-C142 HydrophobicContact CD1-CB 4.3Å; F89-C142 HydrophobicContact CD2-CB 3.97Å; F89-C142 HydrophobicContact CE1-CB 4Å; F89-C142 HydrophobicContact CE2-CB 3.64Å; F89-C142 HydrophobicContact CG-CB 4.3Å; F89-C142 HydrophobicContact CZ-CB 3.66Å; F89-I143 HydrophobicContact CB-CD1 3.88Å; F89-I143 HydrophobicContact CB-CG1 3.53Å; F89-I143 HydrophobicContact CD2-CG1 3.83Å; F89-I143 HydrophobicContact CG-CG1 4.12Å; F89-D146 HydrophobicContact CE2-CB 4.38Å; F89-G168 WeakPolarHBondContact CE1-O 3.3Å; F89-A171 HydrophobicContact CE1-CB 4.24Å; F89-A171 HydrophobicContact CZ-CB 4.34Å; F89-A172 HydrophobicContact CD1-CB 4.36Å; F89-A172 HydrophobicContact CE1-CB 4.37Å |
| 90 | L | 87.8 | Confident | 85.7 | Confident | 24 Ų | 24 | 40.2 Ų | 40.2 | 13% | 0.126 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -66.4 | -35.6 | 174.8 | -69.6 | 173.7 | 0 | 0 | 0 | 112.5 | F74 T86 V88 A94 I143 Y312 | F74-L90 HydrophobicContact CE2-CB 4.45Å; F74-L90 HydrophobicContact CZ-CB 4.25Å; T86-L90 HydrophobicContact CG2-CD1 4.11Å; T86-L90 HydrophobicContact CG2-CG 4.27Å; T86-L90 VanDerWaalsContact O-CB 3.24Å; T86-L90 WeakPolarHBondContact O-CB 3.31Å; T86-L90 WeakPolarHBondContact O-CG 3.36Å; T86-L90 PolarHBondContact O-N 2.82Å; V88-L90 PolarHBondContact O-N 3.13Å; L90-A94 WeakPolarHBondContact O-CB 3.12Å; L90-A94 PolarHBondContact O-N 2.88Å; L90-I143 HydrophobicContact CD2-CD1 4.08Å; L90-I143 HydrophobicContact CG-CD1 4.46Å; L90-Y312 HydrophobicContact CD2-CD1 4.38Å; L90-Y312 HydrophobicContact CD2-CE1 3.52Å; L90-Y312 HydrophobicContact CD2-CE2 3.99Å; L90-Y312 VanDerWaalsContact CD2-OH 3.27Å; L90-Y312 WeakPolarHBondContact CD2-OH 2.92Å |
| 91 | F | 89.9 | Confident | 87.2 | Confident | 48 Ų | 48 | 34.3 Ų | 34.3 | 21% | 0.211 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -65.3 | -47.1 | 173.2 | 174.2 | -92 | 0 | 0 | 0 | 111.6 | I71 F74 D87 V88 L93 A94 L95 | I71-F91 HydrophobicContact CG1-CE2 4.36Å; I71-F91 HydrophobicContact CG2-CE2 4.18Å; F74-F91 HydrophobicContact CB-CD2 4.11Å; F74-F91 HydrophobicContact CD2-CB 4.11Å; F74-F91 HydrophobicContact CD2-CD2 4.04Å; F74-F91 HydrophobicContact CE2-CB 4.22Å; F74-F91 HydrophobicContact CG-CD2 4.31Å; D87-F91 WeakPolarHBondContact O-CB 3.25Å; D87-F91 PolarHBondContact O-N 3.14Å; D87-F91 VanDerWaalsContact O-N 3.15Å; V88-F91 WeakPolarHBondContact O-CB 3.27Å; V88-F91 PolarHBondContact O-N 3.42Å; F91-L93 VanDerWaalsContact C-N 3.31Å; F91-L93 PolarHBondContact O-N 3.4Å; F91-A94 PolarHBondContact O-N 3.49Å; F91-L95 WeakPolarHBondContact O-CB 3Å; F91-L95 PolarHBondContact O-N 3.41Å |
| 92 | H | 92.9 | Very high | 88.7 | Confident | 37 Ų | 37 | 30.4 Ų | 30.4 | 17% | 0.171 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -67.2 | -31.2 | 177 | -75.1 | -75.4 | 0 | 0 | 0 | 113.1 | V88 F89 L95 A96 L139 A172 W176 | V88-H92 PolarHBondContact O-CD2 3.15Å; V88-H92 VanDerWaalsContact O-CD2 3.24Å; V88-H92 PolarHBondContact O-N 2.97Å; F89-H92 PolarHBondContact O-N 3.4Å; H92-L95 PolarHBondContact O-N 2.98Å; H92-A96 WeakPolarHBondContact O-CB 3.4Å; H92-A96 PolarHBondContact O-N 3.43Å; H92-L139 HydrophobicContact CB-CD1 3.99Å; H92-L139 HydrophobicContact CB-CD2 4.12Å; H92-A172 VanDerWaalsContact CD2-CB 3.46Å; H92-A172 WeakPolarHBondContact CD2-CB 3.29Å; H92-W176 AromaticContact CG-NE1 3.69Å; H92-W176 AromaticContact ND1-CD1 3.85Å; H92-W176 AromaticContact ND1-NE1 3.14Å; H92-W176 PolarHBondContact ND1-NE1 2.92Å; H92-W176 VanDerWaalsContact ND1-NE1 3.14Å |
| 93 | L | 91.9 | Very high | 89.7 | Confident | 1 Ų | 1 | 29 Ų | 29 | 1% | 0.005 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -66.9 | -47.9 | 174.5 | -174.7 | 65.1 | 0 | 0 | 0 | 110.8 | F89 F91 L95 A96 D97 L139 Y312 | F89-L93 VanDerWaalsContact O-CB 3.31Å; F89-L93 WeakPolarHBondContact O-CB 3.13Å; F89-L93 PolarHBondContact O-N 3.42Å; F91-L93 VanDerWaalsContact C-N 3.31Å; F91-L93 PolarHBondContact O-N 3.4Å; L93-L95 VanDerWaalsContact C-N 3.25Å; L93-L95 PolarHBondContact O-N 3.37Å; L93-A96 PolarHBondContact O-N 3.14Å; L93-D97 WeakPolarHBondContact O-CB 3.49Å; L93-D97 PolarHBondContact O-N 3.47Å; L93-L139 HydrophobicContact CB-CD1 4.04Å; L93-L139 HydrophobicContact CD1-CD1 4.3Å; L93-Y312 WeakPolarHBondContact CD2-OH 3.45Å |
| 94 | A | 93 | Very high | 90.8 | Very high | 2 Ų | 2 | 22.7 Ų | 22.7 | 2% | 0.017 | 12% | 0.12 | C | C | . | . | H | α-helix | trans | -62.6 | -32.1 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.8 | N67 V70 I71 L90 F91 L98 | N67-A94 HydrophobicContact CB-CB 4.34Å; V70-A94 HydrophobicContact CB-CB 4.12Å; V70-A94 HydrophobicContact CG1-CB 3.72Å; I71-A94 HydrophobicContact CD1-CB 4.44Å; I71-A94 HydrophobicContact CG1-CB 4.14Å; L90-A94 WeakPolarHBondContact O-CB 3.12Å; L90-A94 PolarHBondContact O-N 2.88Å; F91-A94 PolarHBondContact O-N 3.49Å; A94-L98 WeakPolarHBondContact O-CB 3.26Å; A94-L98 PolarHBondContact O-N 2.84Å |
| 95 | L | 94.4 | Very high | 91.4 | Very high | 59 Ų | 59 | 23.9 Ų | 23.9 | 31% | 0.309 | 13% | 0.127 | S | C | . | . | H | α-helix | trans | -68.4 | -44.6 | 173.1 | -178.5 | 63.7 | 0 | 0 | 0 | 112 | F91 H92 L93 L98 L99 W176 | F91-L95 WeakPolarHBondContact O-CB 3Å; F91-L95 PolarHBondContact O-N 3.41Å; H92-L95 PolarHBondContact O-N 2.98Å; L93-L95 VanDerWaalsContact C-N 3.25Å; L93-L95 PolarHBondContact O-N 3.37Å; L95-L98 PolarHBondContact O-N 2.93Å; L95-L99 HydrophobicContact CG-CD1 4.46Å; L95-L99 WeakPolarHBondContact O-CG 3.24Å; L95-L99 PolarHBondContact O-N 3.17Å; L95-W176 HydrophobicContact CD2-CZ2 4.38Å |
| 96 | A | 95.3 | Very high | 91.9 | Very high | 2 Ų | 2 | 24.7 Ų | 24.7 | 2% | 0.017 | 13% | 0.131 | C | C | . | . | H | α-helix | trans | -66.5 | -44.6 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112 | H92 L93 L98 L99 L100 N132 W176 | H92-A96 WeakPolarHBondContact O-CB 3.4Å; H92-A96 PolarHBondContact O-N 3.43Å; L93-A96 PolarHBondContact O-N 3.14Å; A96-L98 VanDerWaalsContact C-N 3.34Å; A96-L98 PolarHBondContact O-N 3.01Å; A96-L99 PolarHBondContact O-N 3.25Å; A96-L100 PolarHBondContact O-N 3.15Å; A96-L100 VanDerWaalsContact O-N 3.12Å; A96-N132 VanDerWaalsContact CB-OD1 3.23Å; A96-N132 WeakPolarHBondContact CB-OD1 3.41Å; A96-N132 PolarHBondContact O-OD1 2.97Å; A96-W176 HydrophobicContact CB-CH2 3.85Å; A96-W176 HydrophobicContact CB-CZ2 3.97Å |
| 97 | D | 94.9 | Very high | 92.1 | Very high | 0 Ų | 0 | 25.5 Ų | 25.5 | 0% | 0 | 14% | 0.135 | C | C | . | . | H | α-helix | trans | -61.1 | -42.4 | 174.2 | -77 | -30.8 | 0 | 0 | 0 | 110.7 | L93 L100 L101 N132 R304 C305 N308 | L93-D97 WeakPolarHBondContact O-CB 3.49Å; L93-D97 PolarHBondContact O-N 3.47Å; D97-L100 PolarHBondContact O-N 2.92Å; D97-L101 WeakPolarHBondContact O-CB 3.49Å; D97-L101 WeakPolarHBondContact O-CD1 3.32Å; D97-L101 WeakPolarHBondContact O-CG 3.3Å; D97-L101 PolarHBondContact O-N 3.26Å; D97-N132 PolarHBondContact N-OD1 3.04Å; D97-N132 PolarHBondContact OD1-ND2 3.46Å; D97-N132 VanDerWaalsContact OD1-ND2 3.1Å; D97-N132 PolarHBondContact OD1-OD1 3.45Å; D97-R304 IonicContact OD1-NH1 2.74Å; D97-R304 PolarHBondContact OD1-NH1 2.93Å; D97-C305 HydrophobicContact CB-CB 4.03Å; D97-C305 PolarHBondContact OD1-SG 2.67Å; D97-N308 PolarHBondContact OD2-ND2 3Å |
| 98 | L | 95.1 | Very high | 92.4 | Very high | 27 Ų | 27 | 25.1 Ų | 25.1 | 14% | 0.141 | 13% | 0.134 | C | C | . | . | H | α-helix | trans | -62.3 | -43.1 | 176.3 | -178.4 | 63.4 | 0 | 0 | 0 | 112.5 | V64 N67 I71 A94 L95 A96 L100 L101 L102 | V64-L98 HydrophobicContact CB-CD1 4.39Å; V64-L98 HydrophobicContact CG1-CD1 4.13Å; V64-L98 HydrophobicContact CG2-CD1 4.11Å; N67-L98 HydrophobicContact CB-CB 4.38Å; I71-L98 HydrophobicContact CD1-CD2 3.85Å; A94-L98 WeakPolarHBondContact O-CB 3.26Å; A94-L98 PolarHBondContact O-N 2.84Å; L95-L98 PolarHBondContact O-N 2.93Å; A96-L98 VanDerWaalsContact C-N 3.34Å; A96-L98 PolarHBondContact O-N 3.01Å; L98-L100 VanDerWaalsContact C-N 3.31Å; L98-L100 PolarHBondContact O-N 2.94Å; L98-L101 PolarHBondContact O-N 2.87Å; L98-L102 WeakPolarHBondContact O-CG 3.36Å; L98-L102 PolarHBondContact O-N 2.71Å |
| 99 | L | 95.3 | Very high | 92.4 | Very high | 76 Ų | 76 | 26.5 Ų | 26.5 | 40% | 0.398 | 14% | 0.144 | S | C | . | . | H | α-helix | trans | -61.2 | -39 | 177.2 | -73.2 | 169.7 | 0 | 0 | 0 | 112 | L95 A96 W176 | L95-L99 HydrophobicContact CG-CD1 4.46Å; L95-L99 WeakPolarHBondContact O-CG 3.24Å; L95-L99 PolarHBondContact O-N 3.17Å; A96-L99 PolarHBondContact O-N 3.25Å; L99-W176 HydrophobicContact CD1-CH2 4Å; L99-W176 HydrophobicContact CD1-CZ3 4.45Å |
| 100 | L | 95.1 | Very high | 92.2 | Very high | 1 Ų | 1 | 27.9 Ų | 27.9 | 1% | 0.005 | 15% | 0.149 | C | C | . | . | H | α-helix | trans | -70.8 | -40.1 | 174.2 | -176.7 | 58.7 | 0 | 0 | 0 | 112.5 | A96 D97 L98 L102 T103 C128 Y129 N132 Y302 | A96-L100 PolarHBondContact O-N 3.15Å; A96-L100 VanDerWaalsContact O-N 3.12Å; D97-L100 PolarHBondContact O-N 2.92Å; L98-L100 VanDerWaalsContact C-N 3.31Å; L98-L100 PolarHBondContact O-N 2.94Å; L100-L102 PolarHBondContact O-N 2.98Å; L100-T103 PolarHBondContact O-N 3.47Å; L100-T103 PolarHBondContact O-OG1 3.23Å; L100-C128 HydrophobicContact CD1-CB 4.25Å; L100-Y129 HydrophobicContact CD1-CD2 4.27Å; L100-Y129 HydrophobicContact CD2-CD2 4.24Å; L100-N132 HydrophobicContact CB-CB 4.04Å; L100-N132 HydrophobicContact CD2-CB 3.98Å; L100-N132 VanDerWaalsContact CD2-ND2 3.34Å; L100-N132 WeakPolarHBondContact CD2-ND2 3.23Å; L100-Y302 HydrophobicContact CD1-CD1 4.44Å; L100-Y302 HydrophobicContact CD1-CE1 3.61Å; L100-Y302 HydrophobicContact CD2-CD1 4.02Å; L100-Y302 HydrophobicContact CD2-CE1 3.91Å; L100-Y302 HydrophobicContact CG-CD1 4.05Å; L100-Y302 HydrophobicContact CG-CE1 3.71Å |
| 101 | L | 95.8 | Very high | 92 | Very high | 1 Ų | 1 | 27.5 Ų | 27.5 | 1% | 0.005 | 15% | 0.148 | C | C | . | . | H | α-helix | trans | -61.1 | -34.4 | 178.2 | -72.2 | 162.3 | 0 | 0 | 0 | 111.7 | I59 F60 V64 N67 D97 L98 T103 L104 C305 | I59-L101 HydrophobicContact CG2-CD2 3.79Å; I59-L101 WeakPolarHBondContact O-CD2 3.39Å; F60-L101 WeakPolarHBondContact CD2-O 3.47Å; V64-L101 HydrophobicContact CG2-CB 4Å; N67-L101 WeakPolarHBondContact ND2-CD1 3.31Å; D97-L101 WeakPolarHBondContact O-CB 3.49Å; D97-L101 WeakPolarHBondContact O-CD1 3.32Å; D97-L101 WeakPolarHBondContact O-CG 3.3Å; D97-L101 PolarHBondContact O-N 3.26Å; L98-L101 PolarHBondContact O-N 2.87Å; L101-T103 PolarHBondContact O-N 3.32Å; L101-L104 HydrophobicContact CD2-CD1 3.7Å; L101-L104 WeakPolarHBondContact O-CB 3.32Å; L101-L104 PolarHBondContact O-N 2.95Å; L101-L104 VanDerWaalsContact O-N 3.14Å; L101-C305 HydrophobicContact CD1-CB 4.27Å; L101-C305 HydrophobicContact CD2-CB 4.1Å; L101-C305 HydrophobicContact CG-CB 4.1Å |
| 102 | L | 94.8 | Very high | 91.6 | Very high | 100 Ų | 100 | 29.2 Ų | 29.2 | 52% | 0.524 | 16% | 0.156 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -64.4 | -17.8 | 175.5 | -70.2 | 172.2 | 0 | 0 | 0 | 114.1 | L98 L100 P105 | L98-L102 WeakPolarHBondContact O-CG 3.36Å; L98-L102 PolarHBondContact O-N 2.71Å; L100-L102 PolarHBondContact O-N 2.98Å; L102-P105 WeakPolarHBondContact O-CD 3.48Å |
| 103 | T | 92.9 | Very high | 91.1 | Very high | 8 Ų | 8 | 36.2 Ų | 36.2 | 5% | 0.049 | 18% | 0.181 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -91.1 | -8.9 | 175.2 | 73.7 | 0 | 0 | 0 | 0 | 113.5 | L100 L101 P105 L106 Q107 C128 | L100-T103 PolarHBondContact O-N 3.47Å; L100-T103 PolarHBondContact O-OG1 3.23Å; L101-T103 PolarHBondContact O-N 3.32Å; T103-P105 VanDerWaalsContact C-CD 3.48Å; T103-L106 WeakPolarHBondContact O-CB 3.44Å; T103-L106 PolarHBondContact O-N 3.19Å; T103-L106 VanDerWaalsContact O-N 3.15Å; T103-Q107 PolarHBondContact O-N 2.95Å; T103-C128 HydrophobicContact CG2-CB 3.89Å |
| 104 | L | 92 | Very high | 90.7 | Very high | 2 Ų | 2 | 36.4 Ų | 36.4 | 1% | 0.01 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -57.8 | -37.1 | 178.5 | -77.5 | 179.8 | 0 | 0 | 0 | 115.1 | F56 I59 F60 L101 L106 Q107 A108 Y302 | F56-L104 HydrophobicContact CB-CD2 4.27Å; F56-L104 HydrophobicContact CD1-CD2 3.59Å; F56-L104 HydrophobicContact CE1-CD2 4.02Å; F56-L104 HydrophobicContact CG-CD2 3.91Å; I59-L104 HydrophobicContact CB-CD1 4.09Å; I59-L104 HydrophobicContact CG2-CD1 3.73Å; F60-L104 HydrophobicContact CB-CB 4.49Å; F60-L104 HydrophobicContact CB-CD1 4.16Å; F60-L104 HydrophobicContact CD2-CB 4.43Å; L101-L104 HydrophobicContact CD2-CD1 3.7Å; L101-L104 WeakPolarHBondContact O-CB 3.32Å; L101-L104 PolarHBondContact O-N 2.95Å; L101-L104 VanDerWaalsContact O-N 3.14Å; L104-L106 VanDerWaalsContact C-N 3.27Å; L104-L106 PolarHBondContact O-N 3.23Å; L104-Q107 PolarHBondContact O-N 3.44Å; L104-A108 WeakPolarHBondContact O-CB 3.3Å; L104-A108 PolarHBondContact O-N 2.97Å; L104-Y302 HydrophobicContact CD2-CD1 3.39Å; L104-Y302 HydrophobicContact CD2-CD2 4.34Å; L104-Y302 HydrophobicContact CD2-CE1 3.69Å; L104-Y302 HydrophobicContact CD2-CG 3.74Å; L104-Y302 HydrophobicContact CG-CD1 4.17Å; L104-Y302 HydrophobicContact CG-CE1 4.47Å |
| 105 | P | 92.1 | Very high | 90.5 | Very high | 66 Ų | 66 | 36.5 Ų | 36.5 | 43% | 0.429 | 18% | 0.184 | S | C | . | . | H | α-helix | trans | -60.3 | -36 | 175.8 | -26.1 | 36.6 | 0 | 0 | 0 | 113.1 | F60 L102 T103 S109 | F60-P105 HydrophobicContact CD2-CG 4.1Å; F60-P105 HydrophobicContact CE2-CG 3.9Å; F60-P105 HydrophobicContact CZ-CG 4.42Å; L102-P105 WeakPolarHBondContact O-CD 3.48Å; T103-P105 VanDerWaalsContact C-CD 3.48Å; P105-S109 PolarHBondContact O-N 3.14Å; P105-S109 PolarHBondContact O-OG 2.87Å |
| 106 | L | 91.3 | Very high | 90.3 | Very high | 31 Ų | 31 | 39 Ų | 39 | 16% | 0.162 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -66.9 | -45.2 | 175.1 | -55.7 | 174.2 | 0 | 0 | 0 | 110.7 | T103 L104 A108 S109 Y110 W115 F117 L121 M125 | T103-L106 WeakPolarHBondContact O-CB 3.44Å; T103-L106 PolarHBondContact O-N 3.19Å; T103-L106 VanDerWaalsContact O-N 3.15Å; L104-L106 VanDerWaalsContact C-N 3.27Å; L104-L106 PolarHBondContact O-N 3.23Å; L106-A108 VanDerWaalsContact C-N 3.34Å; L106-A108 PolarHBondContact O-N 2.89Å; L106-S109 PolarHBondContact O-N 3.41Å; L106-S109 PolarHBondContact O-OG 2.97Å; L106-S109 VanDerWaalsContact O-OG 3.05Å; L106-Y110 VanDerWaalsContact O-CB 3.26Å; L106-Y110 WeakPolarHBondContact O-CB 3.38Å; L106-Y110 PolarHBondContact O-N 3.48Å; L106-W115 HydrophobicContact CB-CH2 4.49Å; L106-F117 HydrophobicContact CB-CE2 4.07Å; L106-F117 HydrophobicContact CD2-CD1 4.29Å; L106-F117 HydrophobicContact CD2-CD2 4.05Å; L106-F117 HydrophobicContact CD2-CE1 3.9Å; L106-F117 HydrophobicContact CD2-CE2 3.61Å; L106-F117 HydrophobicContact CD2-CG 4.37Å; L106-F117 HydrophobicContact CD2-CZ 3.53Å; L106-F117 HydrophobicContact CG-CE2 4.46Å; L106-L121 HydrophobicContact CD1-CB 4.43Å; L106-L121 HydrophobicContact CD1-CD2 4.31Å; L106-L121 HydrophobicContact CD2-CD1 4.32Å; L106-M125 HydrophobicContact CB-SD 4.15Å |
| 107 | Q | 88.8 | Confident | 90.1 | Very high | 21 Ų | 21 | 41.6 Ų | 41.6 | 10% | 0.098 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -63 | -38.4 | 177.9 | -171.5 | 71.9 | 26.1 | 0 | 0 | 112 | F56 T103 L104 T111 M125 | F56-Q107 HydrophobicContact CD2-CB 4.48Å; F56-Q107 HydrophobicContact CD2-CG 4.13Å; F56-Q107 HydrophobicContact CE2-CB 4.2Å; F56-Q107 HydrophobicContact CE2-CG 3.39Å; F56-Q107 HydrophobicContact CZ-CG 3.75Å; T103-Q107 PolarHBondContact O-N 2.95Å; L104-Q107 PolarHBondContact O-N 3.44Å; Q107-T111 PolarHBondContact O-N 2.86Å; Q107-T111 VanDerWaalsContact O-N 3.16Å; Q107-T111 PolarHBondContact O-OG1 3.28Å; Q107-M125 HydrophobicContact CB-SD 4.17Å; Q107-M125 PolarHBondContact OE1-SD 3.25Å |
| 108 | A | 88.4 | Confident | 89.9 | Confident | 12 Ų | 12 | 45.8 Ų | 45.8 | 10% | 0.099 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -64.3 | -49.6 | 176.3 | 0 | 0 | 0 | 0 | 0 | 111.6 | T53 F56 L104 L106 Y110 T111 | T53-A108 HydrophobicContact CG2-CB 4.41Å; F56-A108 HydrophobicContact CB-CB 4.37Å; F56-A108 HydrophobicContact CD2-CB 4.25Å; L104-A108 WeakPolarHBondContact O-CB 3.3Å; L104-A108 PolarHBondContact O-N 2.97Å; L106-A108 VanDerWaalsContact C-N 3.34Å; L106-A108 PolarHBondContact O-N 2.89Å; A108-Y110 VanDerWaalsContact C-N 3.34Å; A108-Y110 PolarHBondContact O-N 3.37Å; A108-T111 WeakPolarHBondContact O-CB 3.07Å; A108-T111 PolarHBondContact O-N 3.28Å |
| 109 | S | 89.4 | Confident | 89.6 | Confident | 30 Ų | 30 | 48.1 Ų | 48.1 | 21% | 0.21 | 25% | 0.25 | C | C | . | . | H | α-helix | trans | -65.9 | -36.6 | 176.9 | 61.8 | 0 | 0 | 0 | 0 | 112.7 | P105 L106 T111 H112 W113 F117 | P105-S109 PolarHBondContact O-N 3.14Å; P105-S109 PolarHBondContact O-OG 2.87Å; L106-S109 PolarHBondContact O-N 3.41Å; L106-S109 PolarHBondContact O-OG 2.97Å; L106-S109 VanDerWaalsContact O-OG 3.05Å; S109-T111 PolarHBondContact O-N 3.12Å; S109-H112 PolarHBondContact O-N 2.68Å; S109-H112 VanDerWaalsContact O-N 3.1Å; S109-W113 PolarHBondContact O-N 3.03Å; S109-F117 WeakPolarHBondContact OG-CE2 3.49Å; S109-F117 VanDerWaalsContact OG-CZ 3.29Å; S109-F117 WeakPolarHBondContact OG-CZ 3.44Å |
| 110 | Y | 85.6 | Confident | 89.3 | Confident | 38 Ų | 38 | 47.8 Ų | 47.8 | 15% | 0.149 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -55.2 | -38.4 | 173.9 | 166.4 | -113.5 | 0 | 0 | 0 | 112.3 | L106 A108 H112 G114 W115 Y202 | L106-Y110 VanDerWaalsContact O-CB 3.26Å; L106-Y110 WeakPolarHBondContact O-CB 3.38Å; L106-Y110 PolarHBondContact O-N 3.48Å; A108-Y110 VanDerWaalsContact C-N 3.34Å; A108-Y110 PolarHBondContact O-N 3.37Å; Y110-H112 PolarHBondContact O-N 2.96Å; Y110-G114 WeakPolarHBondContact CA-O 3.38Å; Y110-G114 WeakPolarHBondContact O-CA 3.26Å; Y110-G114 PolarHBondContact O-N 3.38Å; Y110-W115 HydrophobicContact CD2-CB 4Å; Y110-W115 AromaticContact CD2-CE3 3.83Å; Y110-W115 HydrophobicContact CD2-CE3 3.83Å; Y110-W115 HydrophobicContact CE2-CB 4.17Å; Y110-W115 HydrophobicContact CG-CE3 4.1Å; Y110-Y202 HydrophobicContact CE2-CD1 4.3Å |
| 111 | T | 82.5 | Confident | 89.1 | Confident | 15 Ų | 15 | 50.8 Ų | 50.8 | 9% | 0.092 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -65.9 | -24.1 | -179.4 | -46.3 | 0 | 0 | 0 | 0 | 112.9 | P49 Q52 Q107 A108 S109 Y295 | P49-T111 HydrophobicContact CB-CG2 3.95Å; P49-T111 HydrophobicContact CG-CG2 4.34Å; Q52-T111 HydrophobicContact CB-CG2 4.21Å; Q52-T111 HydrophobicContact CG-CG2 4.18Å; Q52-T111 PolarHBondContact NE2-OG1 2.91Å; Q107-T111 PolarHBondContact O-N 2.86Å; Q107-T111 VanDerWaalsContact O-N 3.16Å; Q107-T111 PolarHBondContact O-OG1 3.28Å; A108-T111 WeakPolarHBondContact O-CB 3.07Å; A108-T111 PolarHBondContact O-N 3.28Å; S109-T111 PolarHBondContact O-N 3.12Å; T111-Y295 HydrophobicContact CG2-CE1 4.43Å |
| 112 | H | 82.3 | Confident | 88.8 | Confident | 85 Ų | 85 | 50.8 Ų | 50.8 | 39% | 0.394 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -97.7 | -40.7 | 179.3 | -75.5 | -81.8 | 0 | 0 | 0 | 114 | P49 T53 S109 Y110 | P49-H112 VanDerWaalsContact CB-CE1 3.49Å; P49-H112 WeakPolarHBondContact CB-CE1 3.16Å; P49-H112 PolarHBondContact O-NE2 3.01Å; T53-H112 WeakPolarHBondContact CB-NE2 3.49Å; T53-H112 PolarHBondContact OG1-CD2 3.21Å; T53-H112 PolarHBondContact OG1-NE2 2.97Å; S109-H112 PolarHBondContact O-N 2.68Å; S109-H112 VanDerWaalsContact O-N 3.1Å; Y110-H112 PolarHBondContact O-N 2.96Å |
| 113 | W | 82.9 | Confident | 88.6 | Confident | 183 Ų | 183 | 48 Ų | 48 | 69% | 0.693 | 26% | 0.259 | S | S | * | . | H | α-helix | trans | -114.5 | -0.7 | -166.5 | -56.6 | 102.2 | 0 | 0 | 0 | 113.8 | S109 I116 | S109-W113 PolarHBondContact O-N 3.03Å; W113-I116 HydrophobicContact CB-CG2 3.99Å |
| 114 | G | 82.9 | Confident | 88.5 | Confident | 6 Ų | 6 | 51.2 Ų | 51.2 | 6% | 0.062 | 28% | 0.279 | C | S | . | . | trans | 68 | -168.9 | -162.6 | 0 | 0 | 0 | 0 | 0 | 111.4 | Y110 I116 | Y110-G114 WeakPolarHBondContact CA-O 3.38Å; Y110-G114 WeakPolarHBondContact O-CA 3.26Å; Y110-G114 PolarHBondContact O-N 3.38Å; G114-I116 PolarHBondContact O-N 3.29Å; G114-I116 VanDerWaalsContact O-N 3.11Å | ||
| 115 | W | 87.8 | Confident | 88.5 | Confident | 4 Ų | 4 | 51.4 Ų | 51.4 | 2% | 0.015 | 28% | 0.28 | C | S | . | . | trans | -85.1 | 85.9 | -172.3 | -168.3 | -92.2 | 0 | 0 | 0 | 112 | L106 Y110 F117 L121 C122 M125 V192 K201 C203 | L106-W115 HydrophobicContact CB-CH2 4.49Å; Y110-W115 HydrophobicContact CD2-CB 4Å; Y110-W115 AromaticContact CD2-CE3 3.83Å; Y110-W115 HydrophobicContact CD2-CE3 3.83Å; Y110-W115 HydrophobicContact CE2-CB 4.17Å; Y110-W115 HydrophobicContact CG-CE3 4.1Å; W115-F117 VanDerWaalsContact C-N 3.33Å; W115-F117 HydrophobicContact CD2-CD2 4.49Å; W115-F117 HydrophobicContact CE3-CD2 4.4Å; W115-F117 HydrophobicContact CH2-CB 4.34Å; W115-F117 AromaticContact CH2-CD2 3.87Å; W115-F117 HydrophobicContact CH2-CD2 3.87Å; W115-F117 HydrophobicContact CZ2-CB 3.57Å; W115-F117 AromaticContact CZ2-CD2 3.93Å; W115-F117 HydrophobicContact CZ2-CD2 3.93Å; W115-F117 HydrophobicContact CZ2-CG 4.22Å; W115-F117 HydrophobicContact CZ3-CD2 4.1Å; W115-F117 PolarHBondContact NE1-O 3.1Å; W115-L121 HydrophobicContact CH2-CB 4.29Å; W115-L121 VanDerWaalsContact CZ2-C 3.44Å; W115-L121 HydrophobicContact CZ2-CB 3.82Å; W115-C122 HydrophobicContact CD2-CB 4.31Å; W115-C122 HydrophobicContact CH2-CB 4.27Å; W115-C122 HydrophobicContact CZ2-CB 3.63Å; W115-M125 HydrophobicContact CE3-CE 4.18Å; W115-M125 HydrophobicContact CH2-CE 4.05Å; W115-M125 HydrophobicContact CH2-SD 4.04Å; W115-M125 HydrophobicContact CZ3-CE 3.42Å; W115-M125 VanDerWaalsContact CZ3-CE 3.42Å; W115-M125 HydrophobicContact CZ3-SD 3.68Å; W115-V192 HydrophobicContact CG-CG2 4.23Å; W115-K201 HydrophobicContact CB-CB 4.15Å; W115-K201 WeakPolarHBondContact CB-O 3.32Å; W115-K201 PolarHBondContact N-O 2.03Å; W115-K201 VanDerWaalsContact O-CB 3.32Å; W115-K201 WeakPolarHBondContact O-CB 3.42Å; W115-C203 HydrophobicContact CB-CB 4.47Å; W115-C203 HydrophobicContact CD2-CB 3.7Å; W115-C203 HydrophobicContact CE3-CB 3.63Å; W115-C203 HydrophobicContact CG-CB 4.04Å; W115-C203 HydrophobicContact CZ3-CB 4.28Å | ||
| 116 | I | 90.5 | Very high | 88.3 | Confident | 111 Ų | 111 | 51.3 Ų | 51.3 | 57% | 0.569 | 27% | 0.271 | S | S | * | . | trans | -83 | -3.1 | 179.8 | 63 | 171.2 | 0 | 0 | 0 | 114.5 | W113 G114 | W113-I116 HydrophobicContact CB-CG2 3.99Å; G114-I116 PolarHBondContact O-N 3.29Å; G114-I116 VanDerWaalsContact O-N 3.11Å | ||
| 117 | F | 90.8 | Very high | 88.3 | Confident | 57 Ų | 57 | 50.5 Ų | 50.5 | 25% | 0.25 | 27% | 0.268 | C | S | . | . | S | Bend | trans | -97.3 | 165.2 | -173.8 | -59 | -68.8 | 0 | 0 | 0 | 112.9 | L106 S109 W115 L121 | L106-F117 HydrophobicContact CB-CE2 4.07Å; L106-F117 HydrophobicContact CD2-CD1 4.29Å; L106-F117 HydrophobicContact CD2-CD2 4.05Å; L106-F117 HydrophobicContact CD2-CE1 3.9Å; L106-F117 HydrophobicContact CD2-CE2 3.61Å; L106-F117 HydrophobicContact CD2-CG 4.37Å; L106-F117 HydrophobicContact CD2-CZ 3.53Å; L106-F117 HydrophobicContact CG-CE2 4.46Å; S109-F117 WeakPolarHBondContact OG-CE2 3.49Å; S109-F117 VanDerWaalsContact OG-CZ 3.29Å; S109-F117 WeakPolarHBondContact OG-CZ 3.44Å; W115-F117 VanDerWaalsContact C-N 3.33Å; W115-F117 HydrophobicContact CD2-CD2 4.49Å; W115-F117 HydrophobicContact CE3-CD2 4.4Å; W115-F117 HydrophobicContact CH2-CB 4.34Å; W115-F117 AromaticContact CH2-CD2 3.87Å; W115-F117 HydrophobicContact CH2-CD2 3.87Å; W115-F117 HydrophobicContact CZ2-CB 3.57Å; W115-F117 AromaticContact CZ2-CD2 3.93Å; W115-F117 HydrophobicContact CZ2-CD2 3.93Å; W115-F117 HydrophobicContact CZ2-CG 4.22Å; W115-F117 HydrophobicContact CZ3-CD2 4.1Å; W115-F117 PolarHBondContact NE1-O 3.1Å; F117-L121 HydrophobicContact CB-CB 4.19Å; F117-L121 HydrophobicContact CB-CD1 4.07Å; F117-L121 HydrophobicContact CD1-CD1 4.15Å; F117-L121 HydrophobicContact CG-CD1 4.23Å |
| 118 | P | 90.6 | Very high | 88.5 | Confident | 88 Ų | 88 | 50.8 Ų | 50.8 | 57% | 0.571 | 27% | 0.273 | S | S | * | . | trans | -58.1 | 152.9 | 170.6 | -24.9 | 35.3 | 0 | 0 | 0 | 113.2 | A120 L121 | P118-A120 PolarHBondContact O-N 2.91Å; P118-L121 PolarHBondContact O-N 3.3Å | ||
| 119 | V | 89.3 | Confident | 88.7 | Confident | 76 Ų | 76 | 51.4 Ų | 51.4 | 46% | 0.461 | 27% | 0.272 | S | S | . | . | H | α-helix | trans | -52.5 | -39.7 | 176.6 | -174.7 | 0 | 0 | 0 | 0 | 111.7 | L121 C122 N123 V192 | V119-L121 PolarHBondContact O-N 2.94Å; V119-L121 VanDerWaalsContact O-N 3.16Å; V119-C122 WeakPolarHBondContact O-CA 3.2Å; V119-C122 VanDerWaalsContact O-CB 3.3Å; V119-C122 WeakPolarHBondContact O-CB 3.24Å; V119-C122 PolarHBondContact O-N 2.89Å; V119-N123 PolarHBondContact O-N 3.06Å; V119-N123 PolarHBondContact O-OD1 2.78Å; V119-V192 HydrophobicContact CB-CG2 4.31Å; V119-V192 HydrophobicContact CG1-CG2 4.44Å; V119-V192 HydrophobicContact CG2-CB 4.28Å; V119-V192 HydrophobicContact CG2-CG2 3.89Å |
| 120 | A | 89.8 | Confident | 88.7 | Confident | 69 Ų | 69 | 50.4 Ų | 50.4 | 57% | 0.57 | 27% | 0.266 | S | S | * | . | H | α-helix | trans | -54.2 | -37.1 | 177.8 | 0 | 0 | 0 | 0 | 0 | 113.8 | P118 V124 | P118-A120 PolarHBondContact O-N 2.91Å; A120-V124 VanDerWaalsContact O-CG2 3.29Å; A120-V124 WeakPolarHBondContact O-CG2 3.3Å; A120-V124 PolarHBondContact O-N 3.42Å |
| 121 | L | 90.9 | Very high | 89.1 | Confident | 64 Ų | 64 | 50 Ų | 50 | 34% | 0.335 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -75.1 | -26.8 | 177 | -74.1 | -179.3 | 0 | 0 | 0 | 112.6 | L106 W115 F117 P118 V119 M125 | L106-L121 HydrophobicContact CD1-CB 4.43Å; L106-L121 HydrophobicContact CD1-CD2 4.31Å; L106-L121 HydrophobicContact CD2-CD1 4.32Å; W115-L121 HydrophobicContact CH2-CB 4.29Å; W115-L121 VanDerWaalsContact CZ2-C 3.44Å; W115-L121 HydrophobicContact CZ2-CB 3.82Å; F117-L121 HydrophobicContact CB-CB 4.19Å; F117-L121 HydrophobicContact CB-CD1 4.07Å; F117-L121 HydrophobicContact CD1-CD1 4.15Å; F117-L121 HydrophobicContact CG-CD1 4.23Å; P118-L121 PolarHBondContact O-N 3.3Å; V119-L121 PolarHBondContact O-N 2.94Å; V119-L121 VanDerWaalsContact O-N 3.16Å; L121-M125 VanDerWaalsContact O-CB 3.25Å; L121-M125 WeakPolarHBondContact O-CB 3.48Å; L121-M125 PolarHBondContact O-N 3.3Å |
| 122 | C | 89.5 | Confident | 89.6 | Confident | 0 Ų | 0 | 49.4 Ų | 49.4 | 0% | 0 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -67 | -48.9 | 173.8 | 169.9 | 0 | 0 | 0 | 0 | 109.1 | W115 V119 V124 M125 R126 G191 V192 C203 | W115-C122 HydrophobicContact CD2-CB 4.31Å; W115-C122 HydrophobicContact CH2-CB 4.27Å; W115-C122 HydrophobicContact CZ2-CB 3.63Å; V119-C122 WeakPolarHBondContact O-CA 3.2Å; V119-C122 VanDerWaalsContact O-CB 3.3Å; V119-C122 WeakPolarHBondContact O-CB 3.24Å; V119-C122 PolarHBondContact O-N 2.89Å; C122-V124 PolarHBondContact O-N 2.94Å; C122-M125 PolarHBondContact O-N 3.01Å; C122-R126 WeakPolarHBondContact O-CG 3.34Å; C122-R126 PolarHBondContact O-N 3.06Å; C122-G191 PolarHBondContact SG-O 3.15Å; C122-V192 HydrophobicContact CB-CG2 4.18Å; C122-C203 WeakPolarHBondContact CA-SG 3.44Å; C122-C203 HydrophobicContact CB-CB 3.9Å; C122-C203 WeakPolarHBondContact CB-SG 3.29Å; C122-C203 WeakPolarHBondContact SG-CA 3.19Å; C122-C203 WeakPolarHBondContact SG-CB 3.36Å; C122-C203 CovalentContact SG-SG 2.03Å; C122-C203 PolarHBondContact SG-SG 3.42Å |
| 123 | N | 89.8 | Confident | 89.9 | Confident | 41 Ų | 41 | 45.3 Ų | 45.3 | 22% | 0.219 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -63.3 | -42.6 | 179.7 | -62.9 | 40.2 | 0 | 0 | 0 | 110.9 | V119 A127 S190 | V119-N123 PolarHBondContact O-N 3.06Å; V119-N123 PolarHBondContact O-OD1 2.78Å; N123-A127 WeakPolarHBondContact O-CB 3.36Å; N123-A127 PolarHBondContact O-N 2.87Å; N123-S190 WeakPolarHBondContact CA-OG 3.49Å; N123-S190 VanDerWaalsContact CG-OG 3.29Å; N123-S190 PolarHBondContact ND2-O 3.41Å; N123-S190 PolarHBondContact ND2-OG 3.34Å; N123-S190 PolarHBondContact OD1-O 3.29Å |
| 124 | V | 91.6 | Very high | 90.3 | Very high | 76 Ų | 76 | 36.7 Ų | 36.7 | 46% | 0.461 | 21% | 0.211 | S | C | . | . | H | α-helix | trans | -61.3 | -46.2 | 173.3 | 168.4 | 0 | 0 | 0 | 0 | 111.8 | A120 C122 A127 C128 | A120-V124 VanDerWaalsContact O-CG2 3.29Å; A120-V124 WeakPolarHBondContact O-CG2 3.3Å; A120-V124 PolarHBondContact O-N 3.42Å; C122-V124 PolarHBondContact O-N 2.94Å; V124-A127 PolarHBondContact O-N 3.08Å; V124-C128 WeakPolarHBondContact O-CB 3.36Å; V124-C128 PolarHBondContact O-N 3.16Å; V124-C128 PolarHBondContact O-SG 3.01Å; V124-C128 VanDerWaalsContact O-SG 3.33Å |
| 125 | M | 91.3 | Very high | 90.8 | Very high | 7 Ų | 7 | 36.4 Ų | 36.4 | 3% | 0.034 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -61.2 | -48 | -179.6 | -176 | 178.1 | 77.9 | 0 | 0 | 112 | L106 Q107 W115 L121 C122 C128 Y129 C203 | L106-M125 HydrophobicContact CB-SD 4.15Å; Q107-M125 HydrophobicContact CB-SD 4.17Å; Q107-M125 PolarHBondContact OE1-SD 3.25Å; W115-M125 HydrophobicContact CE3-CE 4.18Å; W115-M125 HydrophobicContact CH2-CE 4.05Å; W115-M125 HydrophobicContact CH2-SD 4.04Å; W115-M125 HydrophobicContact CZ3-CE 3.42Å; W115-M125 VanDerWaalsContact CZ3-CE 3.42Å; W115-M125 HydrophobicContact CZ3-SD 3.68Å; L121-M125 VanDerWaalsContact O-CB 3.25Å; L121-M125 WeakPolarHBondContact O-CB 3.48Å; L121-M125 PolarHBondContact O-N 3.3Å; C122-M125 PolarHBondContact O-N 3.01Å; M125-C128 PolarHBondContact O-N 3.46Å; M125-Y129 PolarHBondContact O-N 2.95Å; M125-Y129 VanDerWaalsContact O-N 3.13Å; M125-C203 HydrophobicContact CE-CB 4.38Å |
| 126 | R | 88.9 | Confident | 91 | Very high | 64 Ų | 64 | 36.2 Ų | 36.2 | 24% | 0.242 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -68.5 | -38.4 | 178.4 | -64.7 | -172.1 | 67.9 | 120.1 | 5.3 | 111.9 | C122 Y129 A130 E186 C203 | C122-R126 WeakPolarHBondContact O-CG 3.34Å; C122-R126 PolarHBondContact O-N 3.06Å; R126-Y129 PolarHBondContact O-N 3.29Å; R126-A130 PolarHBondContact O-N 2.93Å; R126-E186 HydrophobicContact CB-CG 4Å; R126-E186 IonicContact CZ-OE1 3.44Å; R126-E186 IonicContact NE-OE1 3.3Å; R126-E186 PolarHBondContact NE-OE1 2.71Å; R126-E186 IonicContact NH2-OE1 3.11Å; R126-E186 PolarHBondContact NH2-OE1 3.35Å; R126-E186 IonicContact NH2-OE2 2.94Å; R126-C203 VanDerWaalsContact CD-SG 3.51Å; R126-C203 PolarHBondContact NH1-O 2.94Å |
| 127 | A | 91.1 | Very high | 90.9 | Very high | 13 Ų | 13 | 31.3 Ų | 31.3 | 11% | 0.107 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -60.2 | -48.5 | 172.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | N123 V124 Y129 A130 I131 I187 | N123-A127 WeakPolarHBondContact O-CB 3.36Å; N123-A127 PolarHBondContact O-N 2.87Å; V124-A127 PolarHBondContact O-N 3.08Å; A127-Y129 VanDerWaalsContact C-N 3.28Å; A127-Y129 PolarHBondContact O-N 2.87Å; A127-A130 PolarHBondContact O-N 3.22Å; A127-I131 HydrophobicContact CB-CD1 4.4Å; A127-I131 VanDerWaalsContact O-CB 3.29Å; A127-I131 WeakPolarHBondContact O-CB 3.06Å; A127-I131 WeakPolarHBondContact O-CD1 3.23Å; A127-I131 WeakPolarHBondContact O-CG1 3.4Å; A127-I131 PolarHBondContact O-N 3.43Å; A127-I187 HydrophobicContact CB-CD1 4.33Å; A127-I187 HydrophobicContact CB-CG1 3.64Å |
| 128 | C | 93.7 | Very high | 90.9 | Very high | 28 Ų | 28 | 30.5 Ų | 30.5 | 19% | 0.189 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -58.8 | -40 | 177.2 | -75.9 | 0 | 0 | 0 | 0 | 111.8 | L100 T103 V124 M125 N132 | L100-C128 HydrophobicContact CD1-CB 4.25Å; T103-C128 HydrophobicContact CG2-CB 3.89Å; V124-C128 WeakPolarHBondContact O-CB 3.36Å; V124-C128 PolarHBondContact O-N 3.16Å; V124-C128 PolarHBondContact O-SG 3.01Å; V124-C128 VanDerWaalsContact O-SG 3.33Å; M125-C128 PolarHBondContact O-N 3.46Å; C128-N132 VanDerWaalsContact O-CB 3.3Å; C128-N132 WeakPolarHBondContact O-CB 3.35Å; C128-N132 PolarHBondContact O-N 3.44Å |
| 129 | Y | 91.2 | Very high | 90.9 | Very high | 25 Ų | 25 | 26.3 Ų | 26.3 | 10% | 0.098 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -64 | -50.2 | 176.6 | -177 | -88.5 | 0 | 0 | 0 | 112.6 | L100 M125 R126 A127 T133 Q273 Y276 Y302 | L100-Y129 HydrophobicContact CD1-CD2 4.27Å; L100-Y129 HydrophobicContact CD2-CD2 4.24Å; M125-Y129 PolarHBondContact O-N 2.95Å; M125-Y129 VanDerWaalsContact O-N 3.13Å; R126-Y129 PolarHBondContact O-N 3.29Å; A127-Y129 VanDerWaalsContact C-N 3.28Å; A127-Y129 PolarHBondContact O-N 2.87Å; Y129-T133 WeakPolarHBondContact O-CB 3.37Å; Y129-T133 PolarHBondContact O-N 3.12Å; Y129-T133 PolarHBondContact O-OG1 3.35Å; Y129-Q273 PolarHBondContact OH-NE2 2.87Å; Y129-Y276 HydrophobicContact CE1-CE1 4.08Å; Y129-Y276 AromaticContact CZ-CE1 3.76Å; Y129-Y276 WeakPolarHBondContact OH-CD1 3.44Å; Y129-Y276 WeakPolarHBondContact OH-CE1 3.45Å; Y129-Y302 HydrophobicContact CD2-CE1 4.15Å; Y129-Y302 HydrophobicContact CD2-CE2 4.22Å; Y129-Y302 AromaticContact CD2-CZ 3.73Å; Y129-Y302 HydrophobicContact CE2-CE2 4.2Å |
| 130 | A | 90 | Very high | 90.8 | Very high | 8 Ų | 8 | 23.1 Ų | 23.1 | 7% | 0.066 | 13% | 0.133 | C | C | . | . | H | α-helix | trans | -63.3 | -49 | 178.4 | 0 | 0 | 0 | 0 | 0 | 111.7 | R126 A127 N132 T133 Y134 S183 E186 | R126-A130 PolarHBondContact O-N 2.93Å; A127-A130 PolarHBondContact O-N 3.22Å; A130-N132 PolarHBondContact O-N 3.33Å; A130-T133 PolarHBondContact O-N 3.44Å; A130-T133 VanDerWaalsContact O-N 3.13Å; A130-Y134 HydrophobicContact CB-CD2 4.46Å; A130-Y134 HydrophobicContact CB-CE2 4.33Å; A130-Y134 WeakPolarHBondContact O-CD2 3.3Å; A130-Y134 PolarHBondContact O-N 3.04Å; A130-S183 WeakPolarHBondContact CB-OG 3.3Å; A130-E186 HydrophobicContact CB-CB 4.1Å; A130-E186 HydrophobicContact CB-CG 4.02Å |
| 131 | I | 93.1 | Very high | 90.7 | Very high | 30 Ų | 30 | 20.2 Ų | 20.2 | 15% | 0.154 | 11% | 0.109 | C | C | . | . | H | α-helix | trans | -59.1 | -48.2 | -179.7 | -67.3 | 166.4 | 0 | 0 | 0 | 110 | A127 T133 Y134 S135 W176 I180 S183 | A127-I131 HydrophobicContact CB-CD1 4.4Å; A127-I131 VanDerWaalsContact O-CB 3.29Å; A127-I131 WeakPolarHBondContact O-CB 3.06Å; A127-I131 WeakPolarHBondContact O-CD1 3.23Å; A127-I131 WeakPolarHBondContact O-CG1 3.4Å; A127-I131 PolarHBondContact O-N 3.43Å; I131-T133 VanDerWaalsContact C-N 3.3Å; I131-T133 PolarHBondContact O-N 3.46Å; I131-Y134 PolarHBondContact O-N 2.99Å; I131-S135 VanDerWaalsContact O-CB 3.27Å; I131-S135 WeakPolarHBondContact O-CB 3.4Å; I131-S135 PolarHBondContact O-N 3.39Å; I131-S135 PolarHBondContact O-OG 3.32Å; I131-W176 HydrophobicContact CG2-CE3 4.09Å; I131-W176 HydrophobicContact CG2-CZ3 3.67Å; I131-I180 HydrophobicContact CD1-CG1 4.05Å; I131-I180 HydrophobicContact CG1-CG1 4.25Å; I131-S183 WeakPolarHBondContact CA-OG 3.04Å; I131-S183 WeakPolarHBondContact CG1-OG 3.47Å; I131-S183 PolarHBondContact N-OG 3.46Å |
| 132 | N | 93.8 | Very high | 90.7 | Very high | 2 Ų | 2 | 18.5 Ų | 18.5 | 1% | 0.011 | 10% | 0.102 | C | C | . | . | H | α-helix | trans | -62.5 | -37.3 | 178.3 | -172.2 | 43.2 | 0 | 0 | 0 | 112.4 | A96 D97 L100 C128 A130 G136 R304 | A96-N132 VanDerWaalsContact CB-OD1 3.23Å; A96-N132 WeakPolarHBondContact CB-OD1 3.41Å; A96-N132 PolarHBondContact O-OD1 2.97Å; D97-N132 PolarHBondContact N-OD1 3.04Å; D97-N132 PolarHBondContact OD1-ND2 3.46Å; D97-N132 VanDerWaalsContact OD1-ND2 3.1Å; D97-N132 PolarHBondContact OD1-OD1 3.45Å; L100-N132 HydrophobicContact CB-CB 4.04Å; L100-N132 HydrophobicContact CD2-CB 3.98Å; L100-N132 VanDerWaalsContact CD2-ND2 3.34Å; L100-N132 WeakPolarHBondContact CD2-ND2 3.23Å; C128-N132 VanDerWaalsContact O-CB 3.3Å; C128-N132 WeakPolarHBondContact O-CB 3.35Å; C128-N132 PolarHBondContact O-N 3.44Å; A130-N132 PolarHBondContact O-N 3.33Å; N132-G136 WeakPolarHBondContact O-CA 3.47Å; N132-G136 PolarHBondContact O-N 2.86Å; N132-R304 PolarHBondContact ND2-NH2 2.86Å |
| 133 | T | 89 | Confident | 90.6 | Very high | 0 Ų | 0 | 18.5 Ų | 18.5 | 0% | 0 | 10% | 0.103 | C | C | . | . | H | α-helix | trans | -66.6 | -49.5 | 179.7 | -60.5 | 0 | 0 | 0 | 0 | 111.2 | Y129 A130 I131 L137 I219 | Y129-T133 WeakPolarHBondContact O-CB 3.37Å; Y129-T133 PolarHBondContact O-N 3.12Å; Y129-T133 PolarHBondContact O-OG1 3.35Å; A130-T133 PolarHBondContact O-N 3.44Å; A130-T133 VanDerWaalsContact O-N 3.13Å; I131-T133 VanDerWaalsContact C-N 3.3Å; I131-T133 PolarHBondContact O-N 3.46Å; T133-L137 WeakPolarHBondContact O-CG 3.13Å; T133-L137 PolarHBondContact O-N 3.41Å; T133-I219 HydrophobicContact CG2-CG2 4.39Å |
| 134 | Y | 91.1 | Very high | 90.3 | Very high | 2 Ų | 2 | 16.6 Ų | 16.6 | 1% | 0.008 | 9% | 0.092 | C | C | . | . | H | α-helix | trans | -68.5 | -47 | 177.2 | -68 | -62 | 0 | 0 | 0 | 112.6 | A130 I131 G136 L137 L138 L182 S183 I219 V222 | A130-Y134 HydrophobicContact CB-CD2 4.46Å; A130-Y134 HydrophobicContact CB-CE2 4.33Å; A130-Y134 WeakPolarHBondContact O-CD2 3.3Å; A130-Y134 PolarHBondContact O-N 3.04Å; I131-Y134 PolarHBondContact O-N 2.99Å; Y134-G136 VanDerWaalsContact C-N 3.33Å; Y134-G136 PolarHBondContact O-N 3.19Å; Y134-L137 PolarHBondContact O-N 2.99Å; Y134-L138 WeakPolarHBondContact O-CB 3.09Å; Y134-L138 VanDerWaalsContact O-CG 3.29Å; Y134-L138 WeakPolarHBondContact O-CG 3.29Å; Y134-L138 PolarHBondContact O-N 2.87Å; Y134-L138 VanDerWaalsContact O-N 3.09Å; Y134-L182 HydrophobicContact CD1-CB 4.07Å; Y134-L182 HydrophobicContact CD1-CD1 3.92Å; Y134-L182 HydrophobicContact CD2-CB 3.82Å; Y134-L182 HydrophobicContact CE1-CB 4.06Å; Y134-L182 HydrophobicContact CE1-CD1 4.31Å; Y134-L182 HydrophobicContact CE2-CB 3.81Å; Y134-L182 WeakPolarHBondContact CE2-O 3.16Å; Y134-L182 HydrophobicContact CG-CB 3.95Å; Y134-L182 HydrophobicContact CG-CD1 4.24Å; Y134-S183 WeakPolarHBondContact CD2-OG 3.43Å; Y134-I219 HydrophobicContact CE1-CG1 3.91Å; Y134-I219 WeakPolarHBondContact OH-CG1 3.26Å; Y134-V222 HydrophobicContact CD1-CB 4.22Å; Y134-V222 HydrophobicContact CD1-CG1 4.25Å; Y134-V222 HydrophobicContact CD1-CG2 4.04Å; Y134-V222 HydrophobicContact CE1-CB 4.45Å; Y134-V222 HydrophobicContact CE1-CG2 4.1Å |
| 135 | S | 93.8 | Very high | 90.1 | Very high | 0 Ų | 0 | 16.9 Ų | 16.9 | 0% | 0 | 9% | 0.09 | C | C | . | . | H | α-helix | trans | -64.6 | -39 | 179.2 | 67.4 | 0 | 0 | 0 | 0 | 111.4 | I131 L138 L139 | I131-S135 VanDerWaalsContact O-CB 3.27Å; I131-S135 WeakPolarHBondContact O-CB 3.4Å; I131-S135 PolarHBondContact O-N 3.39Å; I131-S135 PolarHBondContact O-OG 3.32Å; S135-L138 PolarHBondContact O-N 3.39Å; S135-L139 WeakPolarHBondContact O-CB 3.36Å; S135-L139 WeakPolarHBondContact O-CG 3.47Å; S135-L139 PolarHBondContact O-N 3.41Å |
| 136 | G | 91.2 | Very high | 89.8 | Confident | 0 Ų | 0 | 17 Ų | 17 | 0% | 0 | 9% | 0.091 | C | C | . | . | H | α-helix | trans | -60.4 | -47.4 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | N132 Y134 L140 | N132-G136 WeakPolarHBondContact O-CA 3.47Å; N132-G136 PolarHBondContact O-N 2.86Å; Y134-G136 VanDerWaalsContact C-N 3.33Å; Y134-G136 PolarHBondContact O-N 3.19Å; G136-L140 WeakPolarHBondContact O-CB 3.36Å; G136-L140 VanDerWaalsContact O-CG 3.25Å; G136-L140 WeakPolarHBondContact O-CG 3.27Å; G136-L140 PolarHBondContact O-N 2.93Å |
| 137 | L | 88.5 | Confident | 89.5 | Confident | 8 Ų | 8 | 15.9 Ų | 15.9 | 4% | 0.042 | 9% | 0.087 | C | C | . | . | H | α-helix | trans | -58.7 | -49.5 | 175.3 | -80.7 | 169.8 | 0 | 0 | 0 | 112.5 | T133 Y134 L140 G141 V222 F223 S226 F269 | T133-L137 WeakPolarHBondContact O-CG 3.13Å; T133-L137 PolarHBondContact O-N 3.41Å; Y134-L137 PolarHBondContact O-N 2.99Å; L137-L140 PolarHBondContact O-N 3.33Å; L137-G141 PolarHBondContact O-N 3.12Å; L137-V222 HydrophobicContact CB-CG1 4.02Å; L137-V222 HydrophobicContact CD1-CB 4.44Å; L137-V222 HydrophobicContact CD1-CG1 3.98Å; L137-F223 HydrophobicContact CD1-CB 4.12Å; L137-F223 HydrophobicContact CD2-CB 4.47Å; L137-F223 HydrophobicContact CD2-CD2 3.97Å; L137-S226 PolarHBondContact O-OG 3.17Å; L137-F269 HydrophobicContact CD1-CE1 4.2Å; L137-F269 HydrophobicContact CD1-CZ 4.06Å; L137-F269 HydrophobicContact CD2-CD1 3.77Å; L137-F269 HydrophobicContact CD2-CE1 3.32Å; L137-F269 HydrophobicContact CD2-CE2 4.15Å; L137-F269 HydrophobicContact CD2-CG 4.39Å; L137-F269 HydrophobicContact CD2-CZ 3.57Å; L137-F269 HydrophobicContact CG-CE1 3.7Å; L137-F269 HydrophobicContact CG-CE2 4.02Å; L137-F269 HydrophobicContact CG-CZ 3.42Å; L137-F269 VanDerWaalsContact CG-CZ 3.42Å |
| 138 | L | 91.1 | Very high | 89.1 | Confident | 39 Ų | 39 | 18.5 Ų | 18.5 | 20% | 0.204 | 9% | 0.094 | C | C | . | . | H | α-helix | trans | -67.8 | -42.6 | -178 | -67.8 | 171.3 | 0 | 0 | 0 | 112.1 | Y134 S135 L140 G141 C142 V175 V178 V222 | Y134-L138 WeakPolarHBondContact O-CB 3.09Å; Y134-L138 VanDerWaalsContact O-CG 3.29Å; Y134-L138 WeakPolarHBondContact O-CG 3.29Å; Y134-L138 PolarHBondContact O-N 2.87Å; Y134-L138 VanDerWaalsContact O-N 3.09Å; S135-L138 PolarHBondContact O-N 3.39Å; L138-L140 PolarHBondContact O-N 2.62Å; L138-G141 WeakPolarHBondContact O-CA 3.17Å; L138-G141 PolarHBondContact O-N 3.15Å; L138-G141 VanDerWaalsContact O-N 3.14Å; L138-C142 PolarHBondContact O-N 2.98Å; L138-C142 PolarHBondContact O-SG 2.99Å; L138-V175 HydrophobicContact CB-CB 4.36Å; L138-V175 HydrophobicContact CB-CG1 3.55Å; L138-V175 HydrophobicContact CB-CG2 3.92Å; L138-V175 HydrophobicContact CD1-CG1 4.15Å; L138-V178 HydrophobicContact CD1-CB 4.26Å; L138-V178 HydrophobicContact CD1-CG1 3.79Å; L138-V222 HydrophobicContact CD2-CG1 4.24Å; L138-V222 HydrophobicContact CG-CG1 4.31Å |
| 139 | L | 91 | Very high | 88.4 | Confident | 0 Ų | 0 | 20.3 Ų | 20.3 | 0% | 0 | 10% | 0.101 | C | C | . | . | H | α-helix | trans | -62.1 | -41.8 | 175.9 | -74.2 | 170.5 | 0 | 0 | 0 | 111.6 | F89 H92 L93 S135 C142 I143 V175 | F89-L139 HydrophobicContact CB-CD2 4.13Å; F89-L139 HydrophobicContact CD1-CD2 3.91Å; F89-L139 HydrophobicContact CG-CD2 4.39Å; H92-L139 HydrophobicContact CB-CD1 3.99Å; H92-L139 HydrophobicContact CB-CD2 4.12Å; L93-L139 HydrophobicContact CB-CD1 4.04Å; L93-L139 HydrophobicContact CD1-CD1 4.3Å; S135-L139 WeakPolarHBondContact O-CB 3.36Å; S135-L139 WeakPolarHBondContact O-CG 3.47Å; S135-L139 PolarHBondContact O-N 3.41Å; L139-C142 PolarHBondContact O-N 3.33Å; L139-I143 VanDerWaalsContact O-CG1 3.26Å; L139-I143 WeakPolarHBondContact O-CG1 3.17Å; L139-I143 PolarHBondContact O-N 3.36Å; L139-V175 HydrophobicContact CD2-CG1 4.22Å; L139-V175 HydrophobicContact CG-CG1 3.97Å |
| 140 | L | 86.9 | Confident | 87.9 | Confident | 10 Ų | 10 | 22 Ų | 22 | 5% | 0.052 | 11% | 0.114 | C | C | . | . | H | α-helix | trans | -59.7 | -47.4 | 171.7 | -74.1 | 172.9 | 0 | 0 | 0 | 110.3 | G136 L137 L138 C142 I143 S144 M230 L265 F269 | G136-L140 WeakPolarHBondContact O-CB 3.36Å; G136-L140 VanDerWaalsContact O-CG 3.25Å; G136-L140 WeakPolarHBondContact O-CG 3.27Å; G136-L140 PolarHBondContact O-N 2.93Å; L137-L140 PolarHBondContact O-N 3.33Å; L138-L140 PolarHBondContact O-N 2.62Å; L140-C142 PolarHBondContact O-N 2.84Å; L140-I143 WeakPolarHBondContact O-CB 3.25Å; L140-I143 PolarHBondContact O-N 3.37Å; L140-I143 VanDerWaalsContact O-N 3.15Å; L140-S144 PolarHBondContact O-N 3.45Å; L140-S144 VanDerWaalsContact O-N 3.14Å; L140-M230 HydrophobicContact CB-CE 3.58Å; L140-M230 WeakPolarHBondContact O-CE 3.39Å; L140-L265 HydrophobicContact CD2-CB 3.95Å; L140-L265 HydrophobicContact CD2-CD1 4.12Å; L140-F269 HydrophobicContact CD1-CB 4.09Å; L140-F269 HydrophobicContact CD1-CD2 3.64Å; L140-F269 HydrophobicContact CD1-CG 4.08Å |
| 141 | G | 88 | Confident | 87.2 | Confident | 7 Ų | 7 | 22.3 Ų | 22.3 | 7% | 0.072 | 12% | 0.115 | C | C | . | . | H | α-helix | trans | -51.8 | -51.1 | 173.8 | 0 | 0 | 0 | 0 | 0 | 112.9 | L137 L138 I143 S144 I145 | L137-G141 PolarHBondContact O-N 3.12Å; L138-G141 WeakPolarHBondContact O-CA 3.17Å; L138-G141 PolarHBondContact O-N 3.15Å; L138-G141 VanDerWaalsContact O-N 3.14Å; G141-I143 PolarHBondContact O-N 3.06Å; G141-S144 PolarHBondContact O-N 3.13Å; G141-S144 VanDerWaalsContact O-N 3.15Å; G141-I145 WeakPolarHBondContact O-CG1 3.24Å; G141-I145 PolarHBondContact O-N 2.82Å; G141-I145 VanDerWaalsContact O-N 3.09Å |
| 142 | C | 89.8 | Confident | 86.3 | Confident | 28 Ų | 28 | 22.7 Ų | 22.7 | 19% | 0.189 | 12% | 0.123 | C | C | . | . | H | α-helix | trans | -61.6 | -38.1 | 177 | -65 | 0 | 0 | 0 | 0 | 113.3 | F89 L138 L139 L140 S144 I145 D146 | F89-C142 HydrophobicContact CD1-CB 4.3Å; F89-C142 HydrophobicContact CD2-CB 3.97Å; F89-C142 HydrophobicContact CE1-CB 4Å; F89-C142 HydrophobicContact CE2-CB 3.64Å; F89-C142 HydrophobicContact CG-CB 4.3Å; F89-C142 HydrophobicContact CZ-CB 3.66Å; L138-C142 PolarHBondContact O-N 2.98Å; L138-C142 PolarHBondContact O-SG 2.99Å; L139-C142 PolarHBondContact O-N 3.33Å; L140-C142 PolarHBondContact O-N 2.84Å; C142-S144 VanDerWaalsContact C-N 3.27Å; C142-S144 PolarHBondContact O-N 3.33Å; C142-I145 PolarHBondContact O-N 3Å; C142-D146 WeakPolarHBondContact O-CB 3.35Å; C142-D146 PolarHBondContact O-N 2.94Å |
| 143 | I | 87.4 | Confident | 85.3 | Confident | 1 Ų | 1 | 28.5 Ų | 28.5 | 1% | 0.005 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -59.4 | -39.2 | 174.5 | -75.5 | 164.6 | 0 | 0 | 0 | 111 | T86 F89 L90 L139 L140 G141 D146 R147 M262 | T86-I143 HydrophobicContact CG2-CG1 4.06Å; T86-I143 HydrophobicContact CG2-CG2 3.95Å; F89-I143 HydrophobicContact CB-CD1 3.88Å; F89-I143 HydrophobicContact CB-CG1 3.53Å; F89-I143 HydrophobicContact CD2-CG1 3.83Å; F89-I143 HydrophobicContact CG-CG1 4.12Å; L90-I143 HydrophobicContact CD2-CD1 4.08Å; L90-I143 HydrophobicContact CG-CD1 4.46Å; L139-I143 VanDerWaalsContact O-CG1 3.26Å; L139-I143 WeakPolarHBondContact O-CG1 3.17Å; L139-I143 PolarHBondContact O-N 3.36Å; L140-I143 WeakPolarHBondContact O-CB 3.25Å; L140-I143 PolarHBondContact O-N 3.37Å; L140-I143 VanDerWaalsContact O-N 3.15Å; G141-I143 PolarHBondContact O-N 3.06Å; I143-D146 PolarHBondContact O-N 3.2Å; I143-R147 VanDerWaalsContact O-CG 3.24Å; I143-R147 WeakPolarHBondContact O-CG 3.02Å; I143-R147 PolarHBondContact O-N 3.28Å; I143-M262 HydrophobicContact CG2-CE 3.87Å; I143-M262 HydrophobicContact CG2-CG 4.32Å; I143-M262 HydrophobicContact CG2-SD 3.51Å; I143-M262 VanDerWaalsContact CG2-SD 3.51Å |
| 144 | S | 85.1 | Confident | 84.4 | Confident | 0 Ų | 0 | 30.3 Ų | 30.3 | 0% | 0 | 16% | 0.159 | C | C | . | . | H | α-helix | trans | -77.6 | -35 | -178.3 | -69 | 0 | 0 | 0 | 0 | 113.7 | L140 G141 C142 R147 Y148 M230 Y234 | L140-S144 PolarHBondContact O-N 3.45Å; L140-S144 VanDerWaalsContact O-N 3.14Å; G141-S144 PolarHBondContact O-N 3.13Å; G141-S144 VanDerWaalsContact O-N 3.15Å; C142-S144 VanDerWaalsContact C-N 3.27Å; C142-S144 PolarHBondContact O-N 3.33Å; S144-R147 WeakPolarHBondContact O-CB 3.35Å; S144-R147 PolarHBondContact O-N 2.95Å; S144-Y148 PolarHBondContact O-N 2.85Å; S144-M230 VanDerWaalsContact CB-SD 3.55Å; S144-M230 WeakPolarHBondContact OG-CE 3.42Å; S144-M230 PolarHBondContact OG-SD 3.42Å; S144-Y234 PolarHBondContact OG-OH 3.45Å |
| 145 | I | 85.8 | Confident | 83.2 | Confident | 82 Ų | 82 | 36.7 Ų | 36.7 | 42% | 0.421 | 19% | 0.189 | S | C | . | . | H | α-helix | trans | -61.2 | -46.4 | 168.6 | -64 | 168.1 | 0 | 0 | 0 | 109.9 | G141 C142 R147 Y148 M149 T229 | G141-I145 WeakPolarHBondContact O-CG1 3.24Å; G141-I145 PolarHBondContact O-N 2.82Å; G141-I145 VanDerWaalsContact O-N 3.09Å; C142-I145 PolarHBondContact O-N 3Å; I145-R147 VanDerWaalsContact C-N 3.33Å; I145-R147 PolarHBondContact O-N 3.05Å; I145-Y148 PolarHBondContact O-N 3.44Å; I145-M149 HydrophobicContact CG2-CG 4.42Å; I145-M149 VanDerWaalsContact O-CG 3.26Å; I145-M149 WeakPolarHBondContact O-CG 3.22Å; I145-M149 PolarHBondContact O-N 3.37Å; I145-T229 HydrophobicContact CD1-CG2 3.99Å; I145-T229 HydrophobicContact CG1-CG2 3.93Å |
| 146 | D | 85.3 | Confident | 81.9 | Confident | 11 Ų | 11 | 41.6 Ų | 41.6 | 6% | 0.059 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -57.4 | -44.1 | 173.3 | 169.1 | 57.6 | 0 | 0 | 0 | 111.6 | M85 T86 F89 C142 I143 Y148 M149 V150 | M85-D146 HydrophobicContact CB-CB 4.12Å; M85-D146 WeakPolarHBondContact CB-OD1 3.47Å; M85-D146 WeakPolarHBondContact CG-OD1 3.45Å; T86-D146 PolarHBondContact N-OD2 2.69Å; T86-D146 PolarHBondContact OG1-OD2 2.97Å; F89-D146 HydrophobicContact CE2-CB 4.38Å; C142-D146 WeakPolarHBondContact O-CB 3.35Å; C142-D146 PolarHBondContact O-N 2.94Å; I143-D146 PolarHBondContact O-N 3.2Å; D146-Y148 PolarHBondContact O-N 3.1Å; D146-M149 PolarHBondContact O-N 3.1Å; D146-V150 VanDerWaalsContact O-CG2 3.29Å; D146-V150 WeakPolarHBondContact O-CG2 3.44Å; D146-V150 PolarHBondContact O-N 3.32Å |
| 147 | R | 83.4 | Confident | 80.7 | Confident | 39 Ų | 39 | 43.2 Ų | 43.2 | 15% | 0.147 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -60.2 | -44.2 | 175.6 | -73.6 | -73.9 | 155 | -76.1 | 6.6 | 113 | T86 I143 S144 I145 V150 V151 I237 M262 | T86-R147 VanDerWaalsContact CG2-NH2 3.29Å; T86-R147 VanDerWaalsContact OG1-CZ 3.25Å; T86-R147 PolarHBondContact OG1-NH1 3.12Å; T86-R147 PolarHBondContact OG1-NH2 3.09Å; I143-R147 VanDerWaalsContact O-CG 3.24Å; I143-R147 WeakPolarHBondContact O-CG 3.02Å; I143-R147 PolarHBondContact O-N 3.28Å; S144-R147 WeakPolarHBondContact O-CB 3.35Å; S144-R147 PolarHBondContact O-N 2.95Å; I145-R147 VanDerWaalsContact C-N 3.33Å; I145-R147 PolarHBondContact O-N 3.05Å; R147-V150 PolarHBondContact O-N 3.09Å; R147-V151 WeakPolarHBondContact O-CG2 3.44Å; R147-V151 PolarHBondContact O-N 3.17Å; R147-V151 VanDerWaalsContact O-N 3.13Å; R147-I237 HydrophobicContact CB-CD1 4.21Å; R147-M262 HydrophobicContact CG-CG 4.22Å |
| 148 | Y | 82.1 | Confident | 79.6 | Confident | 68 Ų | 68 | 48.9 Ų | 48.9 | 27% | 0.267 | 25% | 0.25 | S | C | . | . | H | α-helix | trans | -60.8 | -48.8 | 175.1 | 168.6 | -102.8 | 0 | 0 | 0 | 110.9 | S144 I145 D146 V150 V151 A152 I237 | S144-Y148 PolarHBondContact O-N 2.85Å; I145-Y148 PolarHBondContact O-N 3.44Å; D146-Y148 PolarHBondContact O-N 3.1Å; Y148-V150 PolarHBondContact O-N 2.82Å; Y148-V151 PolarHBondContact O-N 3.09Å; Y148-V151 VanDerWaalsContact O-N 3.09Å; Y148-A152 HydrophobicContact CD2-CB 4.18Å; Y148-A152 HydrophobicContact CE2-CB 3.75Å; Y148-A152 WeakPolarHBondContact O-CB 3.46Å; Y148-A152 PolarHBondContact O-N 3.38Å; Y148-I237 HydrophobicContact CD2-CG1 4.12Å |
| 149 | M | 80.1 | Confident | 78.6 | Confident | 67 Ų | 67 | 57.2 Ų | 57.2 | 33% | 0.33 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -60.9 | -41.5 | 179.1 | -66.9 | -67.1 | -79.5 | 0 | 0 | 112.6 | I145 D146 V151 R153 M157 | I145-M149 HydrophobicContact CG2-CG 4.42Å; I145-M149 VanDerWaalsContact O-CG 3.26Å; I145-M149 WeakPolarHBondContact O-CG 3.22Å; I145-M149 PolarHBondContact O-N 3.37Å; D146-M149 PolarHBondContact O-N 3.1Å; M149-V151 VanDerWaalsContact C-N 3.32Å; M149-V151 PolarHBondContact O-N 2.94Å; M149-R153 CarbonylContact O-C 3.43Å; M149-R153 WeakPolarHBondContact O-CA 3.41Å; M149-R153 PolarHBondContact O-N 3.35Å; M149-R153 HydrophobicContact SD-CG 4.46Å; M149-M157 HydrophobicContact CB-CE 4.12Å; M149-M157 HydrophobicContact CB-SD 3.87Å; M149-M157 WeakPolarHBondContact O-CG 3.37Å |
| 150 | V | 78.8 | Confident | 77.9 | Confident | 60 Ų | 60 | 60.3 Ų | 60.3 | 36% | 0.364 | 30% | 0.295 | S | S | . | . | H | α-helix | trans | -61.7 | -37.2 | 174.3 | 170.4 | 0 | 0 | 0 | 0 | 112.2 | D146 R147 Y148 A154 M157 | D146-V150 VanDerWaalsContact O-CG2 3.29Å; D146-V150 WeakPolarHBondContact O-CG2 3.44Å; D146-V150 PolarHBondContact O-N 3.32Å; R147-V150 PolarHBondContact O-N 3.09Å; Y148-V150 PolarHBondContact O-N 2.82Å; V150-A154 WeakPolarHBondContact O-CB 3.1Å; V150-M157 HydrophobicContact CB-CE 4.3Å; V150-M157 HydrophobicContact CG2-CE 3.42Å; V150-M157 VanDerWaalsContact CG2-CE 3.42Å |
| 151 | V | 75.5 | Confident | 77.3 | Confident | 15 Ų | 15 | 66.5 Ų | 66.5 | 9% | 0.091 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -83.7 | -50.3 | -175.2 | 175 | 0 | 0 | 0 | 0 | 111.9 | R147 Y148 M149 I237 V240 R255 | R147-V151 WeakPolarHBondContact O-CG2 3.44Å; R147-V151 PolarHBondContact O-N 3.17Å; R147-V151 VanDerWaalsContact O-N 3.13Å; Y148-V151 PolarHBondContact O-N 3.09Å; Y148-V151 VanDerWaalsContact O-N 3.09Å; M149-V151 VanDerWaalsContact C-N 3.32Å; M149-V151 PolarHBondContact O-N 2.94Å; V151-I237 HydrophobicContact CB-CG1 4.37Å; V151-I237 HydrophobicContact CB-CG2 4.42Å; V151-I237 HydrophobicContact CG1-CG2 4.06Å; V151-I237 HydrophobicContact CG2-CG2 4.34Å; V151-V240 HydrophobicContact CG1-CG1 4.04Å; V151-R255 PolarHBondContact O-NH2 3.42Å |
| 152 | A | 73.8 | Confident | 76.6 | Confident | 38 Ų | 38 | 70.3 Ų | 70.3 | 31% | 0.314 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -81.7 | -37.7 | -175.1 | 0 | 0 | 0 | 0 | 0 | 113.4 | Y148 V240 | Y148-A152 HydrophobicContact CD2-CB 4.18Å; Y148-A152 HydrophobicContact CE2-CB 3.75Å; Y148-A152 WeakPolarHBondContact O-CB 3.46Å; Y148-A152 PolarHBondContact O-N 3.38Å; A152-V240 HydrophobicContact CB-CG2 4.34Å |
| 153 | R | 72.9 | Confident | 76.2 | Confident | 123 Ų | 123 | 75 Ų | 75 | 46% | 0.464 | 36% | 0.362 | S | S | . | . | S | Bend | trans | -113.3 | 32.9 | -174.1 | -60.7 | -171.1 | -177.4 | -115.7 | 1.1 | 113.5 | M149 Q155 Q156 M157 | M149-R153 CarbonylContact O-C 3.43Å; M149-R153 WeakPolarHBondContact O-CA 3.41Å; M149-R153 PolarHBondContact O-N 3.35Å; M149-R153 HydrophobicContact SD-CG 4.46Å; R153-Q155 VanDerWaalsContact C-N 3.27Å; R153-Q155 PolarHBondContact O-N 3.47Å; R153-Q155 VanDerWaalsContact O-N 3.08Å; R153-Q156 HydrophobicContact CB-CB 4.5Å; R153-Q156 PolarHBondContact O-N 2.84Å; R153-M157 VanDerWaalsContact O-CG 3.31Å; R153-M157 WeakPolarHBondContact O-CG 3.27Å; R153-M157 PolarHBondContact O-N 2.82Å |
| 154 | A | 70.7 | Confident | 75.9 | Confident | 38 Ų | 38 | 76.8 Ų | 76.8 | 31% | 0.314 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -51.3 | -36.3 | -173 | 0 | 0 | 0 | 0 | 0 | 115.4 | V150 L158 | V150-A154 WeakPolarHBondContact O-CB 3.1Å; A154-L158 WeakPolarHBondContact O-CG 3.41Å; A154-L158 PolarHBondContact O-N 3.21Å |
| 155 | Q | 66.6 | Low | 75.8 | Confident | 137 Ų | 137 | 78.7 Ų | 78.7 | 64% | 0.64 | 38% | 0.381 | S | S | * | . | H | α-helix | trans | -69.7 | -42.1 | 178.5 | -70.9 | -69.8 | -6.8 | 0 | 0 | 112.5 | R153 L158 | R153-Q155 VanDerWaalsContact C-N 3.27Å; R153-Q155 PolarHBondContact O-N 3.47Å; R153-Q155 VanDerWaalsContact O-N 3.08Å; Q155-L158 PolarHBondContact O-N 3.41Å |
| 156 | Q | 65.1 | Low | 75.8 | Confident | 103 Ų | 103 | 79 Ų | 79 | 48% | 0.481 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -69.6 | -39.4 | 178.4 | -165.3 | 171.9 | 5.5 | 0 | 0 | 110.8 | R153 L158 R159 L160 | R153-Q156 HydrophobicContact CB-CB 4.5Å; R153-Q156 PolarHBondContact O-N 2.84Å; Q156-L158 VanDerWaalsContact C-N 3.28Å; Q156-L158 PolarHBondContact O-N 3.04Å; Q156-R159 PolarHBondContact O-N 3.36Å; Q156-L160 HydrophobicContact CG-CD1 4.18Å; Q156-L160 PolarHBondContact O-N 3.07Å; Q156-L160 VanDerWaalsContact O-N 3.15Å |
| 157 | M | 66.1 | Low | 75.9 | Confident | 33 Ų | 33 | 81.2 Ų | 81.2 | 16% | 0.163 | 41% | 0.407 | C | S | . | . | H | α-helix | trans | -59.7 | -32.8 | 175.9 | -68.7 | -75.9 | -78.9 | 0 | 0 | 113.8 | M149 V150 R153 I164 | M149-M157 HydrophobicContact CB-CE 4.12Å; M149-M157 HydrophobicContact CB-SD 3.87Å; M149-M157 WeakPolarHBondContact O-CG 3.37Å; V150-M157 HydrophobicContact CB-CE 4.3Å; V150-M157 HydrophobicContact CG2-CE 3.42Å; V150-M157 VanDerWaalsContact CG2-CE 3.42Å; R153-M157 VanDerWaalsContact O-CG 3.31Å; R153-M157 WeakPolarHBondContact O-CG 3.27Å; R153-M157 PolarHBondContact O-N 2.82Å; M157-I164 HydrophobicContact CB-CD1 4.43Å; M157-I164 HydrophobicContact SD-CD1 3.68Å |
| 158 | L | 66.3 | Low | 76.1 | Confident | 128 Ų | 128 | 79.5 Ų | 79.5 | 67% | 0.67 | 40% | 0.401 | S | S | * | . | H | α-helix | trans | -74.5 | -34.8 | 177.6 | -74.9 | 168.8 | 0 | 0 | 0 | 112.5 | A154 Q155 Q156 | A154-L158 WeakPolarHBondContact O-CG 3.41Å; A154-L158 PolarHBondContact O-N 3.21Å; Q155-L158 PolarHBondContact O-N 3.41Å; Q156-L158 VanDerWaalsContact C-N 3.28Å; Q156-L158 PolarHBondContact O-N 3.04Å |
| 159 | R | 70.3 | Confident | 76.5 | Confident | 213 Ų | 213 | 82 Ų | 82 | 80% | 0.804 | 41% | 0.413 | S | S | * | . | H | α-helix | trans | -75.5 | -41.6 | -179.6 | -68.6 | -177.9 | -179.2 | -179.1 | -0.6 | 112.7 | Q156 | Q156-R159 PolarHBondContact O-N 3.36Å |
| 160 | L | 76.8 | Confident | 77.1 | Confident | 65 Ų | 65 | 82.8 Ų | 82.8 | 34% | 0.34 | 42% | 0.422 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -96.7 | 23.2 | -175.1 | -73.2 | 81.3 | 0 | 0 | 0 | 114 | Q156 S162 Q163 I164 | Q156-L160 HydrophobicContact CG-CD1 4.18Å; Q156-L160 PolarHBondContact O-N 3.07Å; Q156-L160 VanDerWaalsContact O-N 3.15Å; L160-S162 VanDerWaalsContact C-N 3.3Å; L160-S162 PolarHBondContact O-N 3.25Å; L160-S162 VanDerWaalsContact O-N 3.1Å; L160-Q163 PolarHBondContact O-N 3.48Å; L160-Q163 VanDerWaalsContact O-N 3.11Å; L160-I164 HydrophobicContact CB-CD1 3.91Å; L160-I164 HydrophobicContact CB-CG1 4.21Å; L160-I164 WeakPolarHBondContact O-CG1 3.48Å; L160-I164 PolarHBondContact O-N 2.95Å |
| 161 | R | 73.1 | Confident | 77.8 | Confident | 140 Ų | 140 | 81.5 Ų | 81.5 | 53% | 0.528 | 42% | 0.417 | S | S | . | . | H | α-helix | trans | -55.1 | -37.1 | -166.8 | -172.2 | 178.1 | -179.4 | -177.7 | 2.1 | 114.9 | R83 L165 | R83-R161 PolarHBondContact O-NH2 3.15Å; R161-L165 WeakPolarHBondContact O-CG 3.34Å; R161-L165 PolarHBondContact O-N 3.36Å; R161-L165 VanDerWaalsContact O-N 3.12Å |
| 162 | S | 74.3 | Confident | 78.7 | Confident | 87 Ų | 87 | 80.8 Ų | 80.8 | 61% | 0.608 | 41% | 0.413 | S | S | * | . | H | α-helix | trans | -71.4 | -45.9 | 177.8 | 49.3 | 0 | 0 | 0 | 0 | 112.4 | L160 I164 L165 T166 | L160-S162 VanDerWaalsContact C-N 3.3Å; L160-S162 PolarHBondContact O-N 3.25Å; L160-S162 VanDerWaalsContact O-N 3.1Å; S162-I164 VanDerWaalsContact C-N 3.34Å; S162-I164 PolarHBondContact O-N 3.35Å; S162-L165 PolarHBondContact O-N 2.93Å; S162-T166 PolarHBondContact O-N 3.22Å; S162-T166 VanDerWaalsContact O-N 3.11Å; S162-T166 PolarHBondContact O-OG1 2.91Å |
| 163 | Q | 81 | Confident | 79.7 | Confident | 128 Ų | 128 | 82.9 Ų | 82.9 | 60% | 0.598 | 42% | 0.422 | S | S | * | . | H | α-helix | trans | -63.4 | -41 | 177.2 | -69.1 | 172.6 | -46.9 | 0 | 0 | 111.3 | L160 T166 A167 | L160-Q163 PolarHBondContact O-N 3.48Å; L160-Q163 VanDerWaalsContact O-N 3.11Å; Q163-T166 WeakPolarHBondContact O-CB 3.43Å; Q163-T166 PolarHBondContact O-N 3.42Å; Q163-A167 PolarHBondContact O-N 2.9Å |
| 164 | I | 81.8 | Confident | 80.8 | Confident | 37 Ų | 37 | 80.6 Ų | 80.6 | 19% | 0.19 | 42% | 0.421 | C | S | . | . | H | α-helix | trans | -59 | -49.8 | 173.2 | -68.3 | 160.5 | 0 | 0 | 0 | 109.7 | M85 M157 L160 S162 T166 A167 G168 | M85-I164 HydrophobicContact CE-CG2 4.48Å; M85-I164 WeakPolarHBondContact CE-O 3.47Å; M85-I164 HydrophobicContact CG-CG2 3.63Å; M85-I164 HydrophobicContact SD-CG2 3.51Å; M85-I164 VanDerWaalsContact SD-CG2 3.51Å; M157-I164 HydrophobicContact CB-CD1 4.43Å; M157-I164 HydrophobicContact SD-CD1 3.68Å; L160-I164 HydrophobicContact CB-CD1 3.91Å; L160-I164 HydrophobicContact CB-CG1 4.21Å; L160-I164 WeakPolarHBondContact O-CG1 3.48Å; L160-I164 PolarHBondContact O-N 2.95Å; S162-I164 VanDerWaalsContact C-N 3.34Å; S162-I164 PolarHBondContact O-N 3.35Å; I164-T166 PolarHBondContact O-N 2.87Å; I164-A167 WeakPolarHBondContact O-CB 3.32Å; I164-A167 PolarHBondContact O-N 3.49Å; I164-G168 PolarHBondContact O-N 2.89Å; I164-G168 VanDerWaalsContact O-N 3.08Å |
| 165 | L | 82.2 | Confident | 82 | Confident | 40 Ų | 40 | 79.2 Ų | 79.2 | 21% | 0.209 | 41% | 0.409 | C | S | . | . | H | α-helix | trans | -55.9 | -33.2 | 176.6 | -79.5 | 173.8 | 0 | 0 | 0 | 114 | M85 R161 S162 K169 | M85-L165 VanDerWaalsContact CE-CA 3.49Å; M85-L165 HydrophobicContact CE-CD2 4.27Å; R161-L165 WeakPolarHBondContact O-CG 3.34Å; R161-L165 PolarHBondContact O-N 3.36Å; R161-L165 VanDerWaalsContact O-N 3.12Å; S162-L165 PolarHBondContact O-N 2.93Å; L165-K169 WeakPolarHBondContact O-CG 3.45Å |
| 166 | T | 86.1 | Confident | 83.4 | Confident | 90 Ų | 90 | 74.8 Ų | 74.8 | 55% | 0.552 | 39% | 0.386 | S | S | * | . | H | α-helix | trans | -72.1 | -46.2 | 171.6 | -54.1 | 0 | 0 | 0 | 0 | 111.5 | S162 Q163 I164 G168 K169 V170 | S162-T166 PolarHBondContact O-N 3.22Å; S162-T166 VanDerWaalsContact O-N 3.11Å; S162-T166 PolarHBondContact O-OG1 2.91Å; Q163-T166 WeakPolarHBondContact O-CB 3.43Å; Q163-T166 PolarHBondContact O-N 3.42Å; I164-T166 PolarHBondContact O-N 2.87Å; T166-G168 VanDerWaalsContact C-N 3.35Å; T166-G168 PolarHBondContact O-N 3.4Å; T166-K169 WeakPolarHBondContact O-CB 3.41Å; T166-K169 PolarHBondContact O-N 3.14Å; T166-K169 VanDerWaalsContact O-N 3.1Å; T166-V170 PolarHBondContact O-N 3.42Å |
| 167 | A | 87.4 | Confident | 84.8 | Confident | 57 Ų | 57 | 74.3 Ų | 74.3 | 47% | 0.471 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -57.2 | -41.5 | -178.4 | 0 | 0 | 0 | 0 | 0 | 113.2 | Q163 I164 V170 A171 | Q163-A167 PolarHBondContact O-N 2.9Å; I164-A167 WeakPolarHBondContact O-CB 3.32Å; I164-A167 PolarHBondContact O-N 3.49Å; A167-V170 PolarHBondContact O-N 3.46Å; A167-A171 WeakPolarHBondContact O-CB 3.42Å; A167-A171 PolarHBondContact O-N 3.42Å |
| 168 | G | 88.4 | Confident | 86.2 | Confident | 2 Ų | 2 | 75.4 Ų | 75.4 | 2% | 0.021 | 39% | 0.394 | C | S | . | . | H | α-helix | trans | -78.1 | -19.7 | 177.1 | 0 | 0 | 0 | 0 | 0 | 115.3 | M85 F89 I164 T166 A172 | M85-G168 WeakPolarHBondContact SD-CA 3.24Å; M85-G168 PolarHBondContact SD-N 2.88Å; M85-G168 VanDerWaalsContact SD-N 3.41Å; F89-G168 WeakPolarHBondContact CE1-O 3.3Å; I164-G168 PolarHBondContact O-N 2.89Å; I164-G168 VanDerWaalsContact O-N 3.08Å; T166-G168 VanDerWaalsContact C-N 3.35Å; T166-G168 PolarHBondContact O-N 3.4Å; G168-A172 WeakPolarHBondContact O-CB 3.3Å; G168-A172 PolarHBondContact O-N 3.35Å |
| 169 | K | 89.8 | Confident | 87.5 | Confident | 120 Ų | 120 | 69.3 Ų | 69.3 | 52% | 0.522 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -67.4 | -45.7 | 165.1 | -72.6 | 177.6 | 176.9 | -173.9 | 0 | 110.3 | V88 L165 T166 A172 V173 | V88-K169 HydrophobicContact CG1-CG 4.34Å; L165-K169 WeakPolarHBondContact O-CG 3.45Å; T166-K169 WeakPolarHBondContact O-CB 3.41Å; T166-K169 PolarHBondContact O-N 3.14Å; T166-K169 VanDerWaalsContact O-N 3.1Å; K169-A172 PolarHBondContact O-N 2.83Å; K169-V173 WeakPolarHBondContact O-CG2 3.3Å; K169-V173 PolarHBondContact O-N 2.81Å |
| 170 | V | 92.9 | Very high | 88.6 | Confident | 85 Ų | 85 | 63 Ų | 63 | 52% | 0.515 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -60 | -46.5 | 173.7 | 175.9 | 0 | 0 | 0 | 0 | 110.3 | T166 A167 A172 V173 V174 | T166-V170 PolarHBondContact O-N 3.42Å; A167-V170 PolarHBondContact O-N 3.46Å; V170-A172 VanDerWaalsContact C-N 3.34Å; V170-A172 PolarHBondContact O-N 2.95Å; V170-V173 PolarHBondContact O-N 3.28Å; V170-V173 VanDerWaalsContact O-N 3.16Å; V170-V174 HydrophobicContact CG1-CG2 4.37Å; V170-V174 WeakPolarHBondContact O-CG2 3.45Å; V170-V174 PolarHBondContact O-N 2.83Å |
| 171 | A | 93.3 | Very high | 89.3 | Confident | 32 Ų | 32 | 65.3 Ų | 65.3 | 26% | 0.264 | 36% | 0.356 | S | S | . | . | H | α-helix | trans | -60.1 | -41 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | F89 A167 V174 V175 | F89-A171 HydrophobicContact CE1-CB 4.24Å; F89-A171 HydrophobicContact CZ-CB 4.34Å; A167-A171 WeakPolarHBondContact O-CB 3.42Å; A167-A171 PolarHBondContact O-N 3.42Å; A171-V174 PolarHBondContact O-N 2.91Å; A171-V175 VanDerWaalsContact O-CG2 3.32Å; A171-V175 WeakPolarHBondContact O-CG2 3.44Å; A171-V175 PolarHBondContact O-N 2.79Å |
| 172 | A | 93.6 | Very high | 90.1 | Very high | 0 Ų | 0 | 61.3 Ų | 61.3 | 0% | 0 | 35% | 0.345 | C | S | . | . | H | α-helix | trans | -61.8 | -44.9 | 174.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | V88 F89 H92 G168 K169 V170 V174 V175 W176 | V88-A172 HydrophobicContact CG1-CB 4.16Å; F89-A172 HydrophobicContact CD1-CB 4.36Å; F89-A172 HydrophobicContact CE1-CB 4.37Å; H92-A172 VanDerWaalsContact CD2-CB 3.46Å; H92-A172 WeakPolarHBondContact CD2-CB 3.29Å; G168-A172 WeakPolarHBondContact O-CB 3.3Å; G168-A172 PolarHBondContact O-N 3.35Å; K169-A172 PolarHBondContact O-N 2.83Å; V170-A172 VanDerWaalsContact C-N 3.34Å; V170-A172 PolarHBondContact O-N 2.95Å; A172-V174 PolarHBondContact O-N 3.35Å; A172-V175 PolarHBondContact O-N 3.17Å; A172-W176 VanDerWaalsContact O-CD1 3.22Å; A172-W176 PolarHBondContact O-N 3.43Å |
| 173 | V | 95.1 | Very high | 90.8 | Very high | 82 Ų | 82 | 57.1 Ų | 57.1 | 50% | 0.497 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -60.8 | -43.4 | 175.2 | 173.2 | 0 | 0 | 0 | 0 | 111.5 | K169 V170 V175 W176 I177 | K169-V173 WeakPolarHBondContact O-CG2 3.3Å; K169-V173 PolarHBondContact O-N 2.81Å; V170-V173 PolarHBondContact O-N 3.28Å; V170-V173 VanDerWaalsContact O-N 3.16Å; V173-V175 VanDerWaalsContact C-N 3.33Å; V173-V175 PolarHBondContact O-N 2.87Å; V173-W176 PolarHBondContact O-N 3.45Å; V173-I177 HydrophobicContact CG1-CD1 3.95Å; V173-I177 WeakPolarHBondContact O-CG1 3.48Å; V173-I177 PolarHBondContact O-N 2.82Å |
| 174 | V | 95.6 | Very high | 91 | Very high | 75 Ų | 75 | 53.3 Ų | 53.3 | 46% | 0.455 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -59.9 | -42.5 | 174.4 | 170.8 | 0 | 0 | 0 | 0 | 111 | V170 A171 A172 W176 I177 V178 | V170-V174 HydrophobicContact CG1-CG2 4.37Å; V170-V174 WeakPolarHBondContact O-CG2 3.45Å; V170-V174 PolarHBondContact O-N 2.83Å; A171-V174 PolarHBondContact O-N 2.91Å; A172-V174 PolarHBondContact O-N 3.35Å; V174-W176 VanDerWaalsContact C-N 3.35Å; V174-W176 PolarHBondContact O-N 3.11Å; V174-I177 PolarHBondContact O-N 3.17Å; V174-V178 HydrophobicContact CG1-CG2 4.19Å; V174-V178 WeakPolarHBondContact O-CB 3.36Å; V174-V178 VanDerWaalsContact O-CG2 3.3Å; V174-V178 WeakPolarHBondContact O-CG2 3.35Å; V174-V178 PolarHBondContact O-N 3.2Å |
| 175 | V | 95.6 | Very high | 91 | Very high | 10 Ų | 10 | 53.2 Ų | 53.2 | 6% | 0.061 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -61.6 | -40.5 | 176 | 167.5 | 0 | 0 | 0 | 0 | 111.9 | L138 L139 A171 A172 V173 A179 | L138-V175 HydrophobicContact CB-CB 4.36Å; L138-V175 HydrophobicContact CB-CG1 3.55Å; L138-V175 HydrophobicContact CB-CG2 3.92Å; L138-V175 HydrophobicContact CD1-CG1 4.15Å; L139-V175 HydrophobicContact CD2-CG1 4.22Å; L139-V175 HydrophobicContact CG-CG1 3.97Å; A171-V175 VanDerWaalsContact O-CG2 3.32Å; A171-V175 WeakPolarHBondContact O-CG2 3.44Å; A171-V175 PolarHBondContact O-N 2.79Å; A172-V175 PolarHBondContact O-N 3.17Å; V173-V175 VanDerWaalsContact C-N 3.33Å; V173-V175 PolarHBondContact O-N 2.87Å; V175-A179 WeakPolarHBondContact O-CB 3.27Å; V175-A179 PolarHBondContact O-N 2.82Å |
| 176 | W | 96.4 | Very high | 90.9 | Very high | 44 Ų | 44 | 52.2 Ų | 52.2 | 17% | 0.167 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -63.1 | -46 | 173.9 | -81.7 | 96.1 | 0 | 0 | 0 | 112.3 | H92 L95 A96 L99 I131 A172 V173 V174 A179 I180 | H92-W176 AromaticContact CG-NE1 3.69Å; H92-W176 AromaticContact ND1-CD1 3.85Å; H92-W176 AromaticContact ND1-NE1 3.14Å; H92-W176 PolarHBondContact ND1-NE1 2.92Å; H92-W176 VanDerWaalsContact ND1-NE1 3.14Å; L95-W176 HydrophobicContact CD2-CZ2 4.38Å; A96-W176 HydrophobicContact CB-CH2 3.85Å; A96-W176 HydrophobicContact CB-CZ2 3.97Å; L99-W176 HydrophobicContact CD1-CH2 4Å; L99-W176 HydrophobicContact CD1-CZ3 4.45Å; I131-W176 HydrophobicContact CG2-CE3 4.09Å; I131-W176 HydrophobicContact CG2-CZ3 3.67Å; A172-W176 VanDerWaalsContact O-CD1 3.22Å; A172-W176 PolarHBondContact O-N 3.43Å; V173-W176 PolarHBondContact O-N 3.45Å; V174-W176 VanDerWaalsContact C-N 3.35Å; V174-W176 PolarHBondContact O-N 3.11Å; W176-A179 PolarHBondContact O-N 3.33Å; W176-I180 WeakPolarHBondContact O-CB 3.22Å; W176-I180 WeakPolarHBondContact O-CD1 3.5Å; W176-I180 VanDerWaalsContact O-CG1 3.26Å; W176-I180 WeakPolarHBondContact O-CG1 3.12Å; W176-I180 PolarHBondContact O-N 3.45Å |
| 177 | I | 96.1 | Very high | 90.8 | Very high | 93 Ų | 93 | 50.7 Ų | 50.7 | 48% | 0.477 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -60.3 | -49.2 | 177.6 | -66.4 | 165.7 | 0 | 0 | 0 | 110.4 | V173 V174 A179 I180 L181 | V173-I177 HydrophobicContact CG1-CD1 3.95Å; V173-I177 WeakPolarHBondContact O-CG1 3.48Å; V173-I177 PolarHBondContact O-N 2.82Å; V174-I177 PolarHBondContact O-N 3.17Å; I177-A179 PolarHBondContact O-N 2.94Å; I177-I180 PolarHBondContact O-N 2.89Å; I177-L181 HydrophobicContact CG2-CD1 3.85Å; I177-L181 HydrophobicContact CG2-CG 4.4Å; I177-L181 WeakPolarHBondContact O-CB 3.47Å; I177-L181 VanDerWaalsContact O-CG 3.28Å; I177-L181 WeakPolarHBondContact O-CG 3.39Å; I177-L181 PolarHBondContact O-N 3.24Å |
| 178 | V | 94.4 | Very high | 90.7 | Very high | 55 Ų | 55 | 53.8 Ų | 53.8 | 33% | 0.333 | 30% | 0.295 | S | S | . | . | H | α-helix | trans | -63 | -42.4 | 179 | 172.7 | 0 | 0 | 0 | 0 | 111.3 | L138 V174 I180 L181 L182 | L138-V178 HydrophobicContact CD1-CB 4.26Å; L138-V178 HydrophobicContact CD1-CG1 3.79Å; V174-V178 HydrophobicContact CG1-CG2 4.19Å; V174-V178 WeakPolarHBondContact O-CB 3.36Å; V174-V178 VanDerWaalsContact O-CG2 3.3Å; V174-V178 WeakPolarHBondContact O-CG2 3.35Å; V174-V178 PolarHBondContact O-N 3.2Å; V178-I180 PolarHBondContact O-N 3.12Å; V178-L181 PolarHBondContact O-N 2.96Å; V178-L182 HydrophobicContact CG1-CD1 3.71Å; V178-L182 HydrophobicContact CG1-CG 4.28Å; V178-L182 WeakPolarHBondContact O-CB 3.43Å; V178-L182 VanDerWaalsContact O-CG 3.25Å; V178-L182 WeakPolarHBondContact O-CG 3.21Å; V178-L182 PolarHBondContact O-N 3.42Å |
| 179 | A | 94.3 | Very high | 90.4 | Very high | 0 Ų | 0 | 57.2 Ų | 57.2 | 0% | 0 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -63.2 | -40.6 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | V175 W176 I177 S183 | V175-A179 WeakPolarHBondContact O-CB 3.27Å; V175-A179 PolarHBondContact O-N 2.82Å; W176-A179 PolarHBondContact O-N 3.33Å; I177-A179 PolarHBondContact O-N 2.94Å; A179-S183 VanDerWaalsContact O-CB 3.32Å; A179-S183 WeakPolarHBondContact O-CB 3.06Å; A179-S183 PolarHBondContact O-N 3.5Å; A179-S183 PolarHBondContact O-OG 3.38Å |
| 180 | I | 93.3 | Very high | 90.1 | Very high | 82 Ų | 82 | 51.8 Ų | 51.8 | 42% | 0.421 | 29% | 0.285 | S | S | . | . | H | α-helix | trans | -67 | -43.8 | 176.1 | -68.1 | 164.2 | 0 | 0 | 0 | 110.8 | I131 W176 I177 V178 S183 S184 | I131-I180 HydrophobicContact CD1-CG1 4.05Å; I131-I180 HydrophobicContact CG1-CG1 4.25Å; W176-I180 WeakPolarHBondContact O-CB 3.22Å; W176-I180 WeakPolarHBondContact O-CD1 3.5Å; W176-I180 VanDerWaalsContact O-CG1 3.26Å; W176-I180 WeakPolarHBondContact O-CG1 3.12Å; W176-I180 PolarHBondContact O-N 3.45Å; I177-I180 PolarHBondContact O-N 2.89Å; V178-I180 PolarHBondContact O-N 3.12Å; I180-S183 CarbonylContact O-C 3.51Å; I180-S183 PolarHBondContact O-N 3.26Å; I180-S183 VanDerWaalsContact O-N 3.15Å; I180-S184 PolarHBondContact O-N 2.64Å; I180-S184 VanDerWaalsContact O-N 3.09Å |
| 181 | L | 91.7 | Very high | 89.7 | Confident | 113 Ų | 113 | 47.9 Ų | 47.9 | 59% | 0.592 | 26% | 0.262 | S | S | * | . | H | α-helix | trans | -61.3 | -44.5 | 176.6 | -71.9 | 171.3 | 0 | 0 | 0 | 112 | I177 V178 S183 S184 | I177-L181 HydrophobicContact CG2-CD1 3.85Å; I177-L181 HydrophobicContact CG2-CG 4.4Å; I177-L181 WeakPolarHBondContact O-CB 3.47Å; I177-L181 VanDerWaalsContact O-CG 3.28Å; I177-L181 WeakPolarHBondContact O-CG 3.39Å; I177-L181 PolarHBondContact O-N 3.24Å; V178-L181 PolarHBondContact O-N 2.96Å; L181-S183 VanDerWaalsContact C-N 3.27Å; L181-S183 PolarHBondContact O-N 3.41Å; L181-S184 VanDerWaalsContact O-CB 3.25Å; L181-S184 WeakPolarHBondContact O-CB 3.25Å; L181-S184 PolarHBondContact O-N 3.25Å; L181-S184 VanDerWaalsContact O-N 3.13Å; L181-S184 PolarHBondContact O-OG 3.39Å |
| 182 | L | 88.2 | Confident | 89.3 | Confident | 55 Ų | 55 | 47.8 Ų | 47.8 | 29% | 0.288 | 26% | 0.258 | S | S | . | . | H | α-helix | trans | -67.4 | -26.6 | 175.1 | -69.2 | 169.3 | 0 | 0 | 0 | 113 | Y134 V178 S184 P185 V222 | Y134-L182 HydrophobicContact CD1-CB 4.07Å; Y134-L182 HydrophobicContact CD1-CD1 3.92Å; Y134-L182 HydrophobicContact CD2-CB 3.82Å; Y134-L182 HydrophobicContact CE1-CB 4.06Å; Y134-L182 HydrophobicContact CE1-CD1 4.31Å; Y134-L182 HydrophobicContact CE2-CB 3.81Å; Y134-L182 WeakPolarHBondContact CE2-O 3.16Å; Y134-L182 HydrophobicContact CG-CB 3.95Å; Y134-L182 HydrophobicContact CG-CD1 4.24Å; V178-L182 HydrophobicContact CG1-CD1 3.71Å; V178-L182 HydrophobicContact CG1-CG 4.28Å; V178-L182 WeakPolarHBondContact O-CB 3.43Å; V178-L182 VanDerWaalsContact O-CG 3.25Å; V178-L182 WeakPolarHBondContact O-CG 3.21Å; V178-L182 PolarHBondContact O-N 3.42Å; L182-S184 VanDerWaalsContact C-N 3.3Å; L182-P185 WeakPolarHBondContact O-CD 3.47Å; L182-V222 HydrophobicContact CD1-CG2 3.85Å |
| 183 | S | 89.3 | Confident | 88.8 | Confident | 0 Ų | 0 | 50.1 Ų | 50.1 | 0% | 0 | 27% | 0.274 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -81.1 | -7.1 | 173.5 | -54.4 | 0 | 0 | 0 | 0 | 113.3 | A130 I131 Y134 A179 I180 L181 P185 E186 I187 | A130-S183 WeakPolarHBondContact CB-OG 3.3Å; I131-S183 WeakPolarHBondContact CA-OG 3.04Å; I131-S183 WeakPolarHBondContact CG1-OG 3.47Å; I131-S183 PolarHBondContact N-OG 3.46Å; Y134-S183 WeakPolarHBondContact CD2-OG 3.43Å; A179-S183 VanDerWaalsContact O-CB 3.32Å; A179-S183 WeakPolarHBondContact O-CB 3.06Å; A179-S183 PolarHBondContact O-N 3.5Å; A179-S183 PolarHBondContact O-OG 3.38Å; I180-S183 CarbonylContact O-C 3.51Å; I180-S183 PolarHBondContact O-N 3.26Å; I180-S183 VanDerWaalsContact O-N 3.15Å; L181-S183 VanDerWaalsContact C-N 3.27Å; L181-S183 PolarHBondContact O-N 3.41Å; S183-P185 VanDerWaalsContact C-CD 3.41Å; S183-E186 WeakPolarHBondContact O-CB 3.45Å; S183-E186 PolarHBondContact O-N 2.89Å; S183-E186 VanDerWaalsContact O-N 3.12Å; S183-I187 VanDerWaalsContact O-CG1 3.31Å; S183-I187 WeakPolarHBondContact O-CG1 3.35Å; S183-I187 PolarHBondContact O-N 2.95Å |
| 184 | S | 85.4 | Confident | 88.2 | Confident | 48 Ų | 48 | 51.5 Ų | 51.5 | 34% | 0.336 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -58.5 | -35.7 | -175.5 | 65.1 | 0 | 0 | 0 | 0 | 115.2 | I180 L181 L182 E186 I187 L188 | I180-S184 PolarHBondContact O-N 2.64Å; I180-S184 VanDerWaalsContact O-N 3.09Å; L181-S184 VanDerWaalsContact O-CB 3.25Å; L181-S184 WeakPolarHBondContact O-CB 3.25Å; L181-S184 PolarHBondContact O-N 3.25Å; L181-S184 VanDerWaalsContact O-N 3.13Å; L181-S184 PolarHBondContact O-OG 3.39Å; L182-S184 VanDerWaalsContact C-N 3.3Å; S184-E186 VanDerWaalsContact C-N 3.35Å; S184-E186 PolarHBondContact O-N 2.92Å; S184-I187 PolarHBondContact O-N 3.01Å; S184-L188 VanDerWaalsContact O-CB 3.31Å; S184-L188 WeakPolarHBondContact O-CB 3.45Å; S184-L188 WeakPolarHBondContact O-CG 3.14Å; S184-L188 PolarHBondContact O-N 3.02Å |
| 185 | P | 82.4 | Confident | 87.2 | Confident | 34 Ų | 34 | 48.3 Ų | 48.3 | 22% | 0.221 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -63.7 | -43.1 | 174.8 | -19.2 | 33.3 | 0 | 0 | 0 | 111.4 | L182 S183 I187 L188 Y189 V211 | L182-P185 WeakPolarHBondContact O-CD 3.47Å; S183-P185 VanDerWaalsContact C-CD 3.41Å; P185-I187 VanDerWaalsContact C-N 3.33Å; P185-I187 PolarHBondContact O-N 2.82Å; P185-L188 PolarHBondContact O-N 3.16Å; P185-Y189 HydrophobicContact CB-CD2 4.22Å; P185-Y189 HydrophobicContact CB-CE2 4.44Å; P185-Y189 WeakPolarHBondContact O-CB 3.32Å; P185-Y189 WeakPolarHBondContact O-CD2 3.39Å; P185-Y189 PolarHBondContact O-N 3.19Å; P185-V211 HydrophobicContact CB-CG1 4.39Å |
| 186 | E | 80.6 | Confident | 85.9 | Confident | 20 Ų | 20 | 57.6 Ų | 57.6 | 9% | 0.093 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -63 | -39.8 | 177.6 | -164.5 | 72.5 | -170.5 | 0 | 0 | 111.4 | R126 A130 S183 S184 S190 | R126-E186 HydrophobicContact CB-CG 4Å; R126-E186 IonicContact CZ-OE1 3.44Å; R126-E186 IonicContact NE-OE1 3.3Å; R126-E186 PolarHBondContact NE-OE1 2.71Å; R126-E186 IonicContact NH2-OE1 3.11Å; R126-E186 PolarHBondContact NH2-OE1 3.35Å; R126-E186 IonicContact NH2-OE2 2.94Å; A130-E186 HydrophobicContact CB-CB 4.1Å; A130-E186 HydrophobicContact CB-CG 4.02Å; S183-E186 WeakPolarHBondContact O-CB 3.45Å; S183-E186 PolarHBondContact O-N 2.89Å; S183-E186 VanDerWaalsContact O-N 3.12Å; S184-E186 VanDerWaalsContact C-N 3.35Å; S184-E186 PolarHBondContact O-N 2.92Å; E186-S190 WeakPolarHBondContact O-CB 3.39Å; E186-S190 PolarHBondContact O-N 3.05Å; E186-S190 VanDerWaalsContact O-N 3.15Å; E186-S190 PolarHBondContact O-OG 3.31Å |
| 187 | I | 84.1 | Confident | 84.5 | Confident | 57 Ų | 57 | 60 Ų | 60 | 29% | 0.292 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -69.8 | -42.2 | 179 | -65.6 | 161.2 | 0 | 0 | 0 | 111.9 | A127 S183 S184 P185 S190 | A127-I187 HydrophobicContact CB-CD1 4.33Å; A127-I187 HydrophobicContact CB-CG1 3.64Å; S183-I187 VanDerWaalsContact O-CG1 3.31Å; S183-I187 WeakPolarHBondContact O-CG1 3.35Å; S183-I187 PolarHBondContact O-N 2.95Å; S184-I187 PolarHBondContact O-N 3.01Å; P185-I187 VanDerWaalsContact C-N 3.33Å; P185-I187 PolarHBondContact O-N 2.82Å; I187-S190 PolarHBondContact O-OG 3.25Å |
| 188 | L | 83.7 | Confident | 83.4 | Confident | 122 Ų | 122 | 58.6 Ų | 58.6 | 64% | 0.639 | 32% | 0.316 | S | S | * | . | H | α-helix | trans | -82 | -26.8 | -173.5 | -69.1 | 171.4 | 0 | 0 | 0 | 113.6 | S184 P185 | S184-L188 VanDerWaalsContact O-CB 3.31Å; S184-L188 WeakPolarHBondContact O-CB 3.45Å; S184-L188 WeakPolarHBondContact O-CG 3.14Å; S184-L188 PolarHBondContact O-N 3.02Å; P185-L188 PolarHBondContact O-N 3.16Å |
| 189 | Y | 82.7 | Confident | 82.5 | Confident | 74 Ų | 74 | 58.3 Ų | 58.3 | 29% | 0.29 | 32% | 0.324 | S | S | . | . | H | α-helix | trans | -115.2 | 1.2 | -174.4 | -53.2 | -53.3 | 0 | 0 | 0 | 113.8 | P185 M205 Q206 K207 V211 | P185-Y189 HydrophobicContact CB-CD2 4.22Å; P185-Y189 HydrophobicContact CB-CE2 4.44Å; P185-Y189 WeakPolarHBondContact O-CB 3.32Å; P185-Y189 WeakPolarHBondContact O-CD2 3.39Å; P185-Y189 PolarHBondContact O-N 3.19Å; Y189-M205 CarbonylContact O-C 3.59Å; Y189-M205 VanDerWaalsContact O-CA 3.31Å; Y189-M205 WeakPolarHBondContact O-CA 3.19Å; Y189-Q206 PolarHBondContact O-N 3.22Å; Y189-K207 HydrophobicContact CD1-CB 4.09Å; Y189-K207 HydrophobicContact CD1-CD 3.42Å; Y189-K207 VanDerWaalsContact CD1-CD 3.42Å; Y189-K207 HydrophobicContact CD1-CG 4.4Å; Y189-K207 HydrophobicContact CD2-CD 4.25Å; Y189-K207 HydrophobicContact CE1-CD 3.26Å; Y189-K207 HydrophobicContact CE2-CD 4.11Å; Y189-K207 HydrophobicContact CG-CB 4Å; Y189-K207 HydrophobicContact CG-CD 3.92Å; Y189-K207 PolarHBondContact OH-NZ 3.05Å; Y189-V211 HydrophobicContact CD2-CG1 3.51Å; Y189-V211 HydrophobicContact CE2-CG1 3.91Å; Y189-V211 HydrophobicContact CG-CG1 4.37Å |
| 190 | S | 82.9 | Confident | 81.8 | Confident | 7 Ų | 7 | 62.4 Ų | 62.4 | 5% | 0.049 | 34% | 0.342 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -69.4 | 140.6 | 165 | 44.5 | 0 | 0 | 0 | 0 | 111.1 | N123 E186 I187 | N123-S190 WeakPolarHBondContact CA-OG 3.49Å; N123-S190 VanDerWaalsContact CG-OG 3.29Å; N123-S190 PolarHBondContact ND2-O 3.41Å; N123-S190 PolarHBondContact ND2-OG 3.34Å; N123-S190 PolarHBondContact OD1-O 3.29Å; E186-S190 WeakPolarHBondContact O-CB 3.39Å; E186-S190 PolarHBondContact O-N 3.05Å; E186-S190 VanDerWaalsContact O-N 3.15Å; E186-S190 PolarHBondContact O-OG 3.31Å; I187-S190 PolarHBondContact O-OG 3.25Å |
| 191 | G | 84.7 | Confident | 81.4 | Confident | 2 Ų | 2 | 63 Ų | 63 | 2% | 0.021 | 34% | 0.341 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -167.8 | -172.2 | 176.5 | 0 | 0 | 0 | 0 | 0 | 111.5 | C122 C203 V204 | C122-G191 PolarHBondContact SG-O 3.15Å; G191-C203 CarbonylContact O-C 3.58Å; G191-V204 PolarHBondContact N-O 2.95Å; G191-V204 PolarHBondContact O-N 3.43Å |
| 192 | V | 85.5 | Confident | 80.9 | Confident | 30 Ų | 30 | 59.5 Ų | 59.5 | 18% | 0.182 | 32% | 0.32 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -109 | 124.8 | 179.2 | -178.1 | 0 | 0 | 0 | 0 | 108.3 | W115 V119 C122 K201 Y202 Q206 | W115-V192 HydrophobicContact CG-CG2 4.23Å; V119-V192 HydrophobicContact CB-CG2 4.31Å; V119-V192 HydrophobicContact CG1-CG2 4.44Å; V119-V192 HydrophobicContact CG2-CB 4.28Å; V119-V192 HydrophobicContact CG2-CG2 3.89Å; C122-V192 HydrophobicContact CB-CG2 4.18Å; V192-K201 HydrophobicContact CG1-CB 3.68Å; V192-K201 HydrophobicContact CG1-CD 4.33Å; V192-K201 HydrophobicContact CG1-CG 4.01Å; V192-Y202 WeakPolarHBondContact CA-O 3.03Å; V192-Q206 PolarHBondContact O-NE2 3.13Å |
| 193 | S | 82.9 | Confident | 80.7 | Confident | 49 Ų | 49 | 57.2 Ų | 57.2 | 34% | 0.343 | 31% | 0.309 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -107.6 | 153.5 | 168.5 | -162.6 | 0 | 0 | 0 | 0 | 109.5 | K201 Y202 | S193-K201 CarbonylContact O-C 3.5Å; S193-K201 WeakPolarHBondContact O-CA 3.37Å; S193-Y202 PolarHBondContact N-O 2.87Å; S193-Y202 PolarHBondContact O-N 2.92Å |
| 194 | E | 81.6 | Confident | 80.3 | Confident | 111 Ų | 111 | 58.4 Ų | 58.4 | 52% | 0.519 | 32% | 0.316 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -109.8 | 129.1 | 176.8 | -167 | 162.6 | 167.5 | 0 | 0 | 108.1 | K201 | E194-K201 HydrophobicContact CB-CG 4.24Å; E194-K201 HydrophobicContact CG-CG 4.12Å; E194-K201 WeakPolarHBondContact OE2-CE 3.19Å; E194-K201 IonicContact OE2-NZ 3.12Å; E194-K201 PolarHBondContact OE2-NZ 3.3Å; E194-K201 VanDerWaalsContact OE2-NZ 3.11Å |
| 195 | S | 74.6 | Confident | 79.9 | Confident | 8 Ų | 8 | 56.8 Ų | 56.8 | 6% | 0.056 | 30% | 0.303 | C | S | . | . | trans | -82.8 | 123.6 | 179.8 | -175.5 | 0 | 0 | 0 | 0 | 110.1 | S197 G199 K200 | S195-S197 PolarHBondContact O-N 2.89Å; S195-S197 PolarHBondContact OG-N 3.4Å; S195-S197 PolarHBondContact OG-OG 3.47Å; S195-G199 WeakPolarHBondContact O-CA 3.31Å; S195-G199 PolarHBondContact O-N 2.92Å; S195-K200 PolarHBondContact N-O 3.21Å | ||
| 196 | E | 69.3 | Low | 79.4 | Confident | 206 Ų | 206 | 61.3 Ų | 61.3 | 96% | 0.963 | 32% | 0.322 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63.7 | -23 | 176.8 | -59.4 | -167 | 152.8 | 0 | 0 | 112.8 | ||
| 197 | S | 67.5 | Low | 78.8 | Confident | 95 Ų | 95 | 64.7 Ų | 64.7 | 66% | 0.664 | 34% | 0.336 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -79.9 | -26.7 | -175.8 | 62.5 | 0 | 0 | 0 | 0 | 114.9 | S195 | S195-S197 PolarHBondContact O-N 2.89Å; S195-S197 PolarHBondContact OG-N 3.4Å; S195-S197 PolarHBondContact OG-OG 3.47Å |
| 198 | D | 72.4 | Confident | 78 | Confident | 63 Ų | 63 | 65 Ų | 65 | 34% | 0.337 | 34% | 0.343 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -139.9 | 1.5 | -176.3 | 85.2 | -17.6 | 0 | 0 | 0 | 115.4 | K200 Y202 | D198-K200 PolarHBondContact O-N 2.91Å; D198-K200 VanDerWaalsContact OD1-CB 3.26Å; D198-K200 WeakPolarHBondContact OD1-CB 3.34Å; D198-K200 PolarHBondContact OD1-N 2.95Å; D198-K200 WeakPolarHBondContact OD2-CD 3.32Å; D198-K200 WeakPolarHBondContact OD2-CG 3.49Å; D198-K200 IonicContact OD2-NZ 2.71Å; D198-K200 PolarHBondContact OD2-NZ 3.06Å; D198-Y202 PolarHBondContact OD2-OH 3.44Å |
| 199 | G | 75.4 | Confident | 77.1 | Confident | 48 Ų | 48 | 59.9 Ų | 59.9 | 50% | 0.495 | 32% | 0.32 | S | S | . | . | trans | 66.3 | 9.2 | -179.8 | 0 | 0 | 0 | 0 | 0 | 114.5 | S195 | S195-G199 WeakPolarHBondContact O-CA 3.31Å; S195-G199 PolarHBondContact O-N 2.92Å | ||
| 200 | K | 79.1 | Confident | 76.6 | Confident | 87 Ų | 87 | 61.9 Ų | 61.9 | 38% | 0.378 | 33% | 0.332 | S | S | . | . | trans | -85.8 | 153.2 | 176.5 | -63.3 | -165.7 | -162.7 | 82.4 | 0 | 111.4 | S195 D198 Y202 | S195-K200 PolarHBondContact N-O 3.21Å; D198-K200 PolarHBondContact O-N 2.91Å; D198-K200 VanDerWaalsContact OD1-CB 3.26Å; D198-K200 WeakPolarHBondContact OD1-CB 3.34Å; D198-K200 PolarHBondContact OD1-N 2.95Å; D198-K200 WeakPolarHBondContact OD2-CD 3.32Å; D198-K200 WeakPolarHBondContact OD2-CG 3.49Å; D198-K200 IonicContact OD2-NZ 2.71Å; D198-K200 PolarHBondContact OD2-NZ 3.06Å; K200-Y202 HydrophobicContact CB-CE2 3.73Å; K200-Y202 WeakPolarHBondContact O-CD2 3.38Å; K200-Y202 WeakPolarHBondContact O-CE2 3.39Å | ||
| 201 | K | 84.8 | Confident | 76 | Confident | 94 Ų | 94 | 62.6 Ų | 62.6 | 41% | 0.409 | 34% | 0.336 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -94.1 | 143.4 | 176.3 | -75.8 | 170.1 | -176.4 | 177.8 | 0 | 110.4 | W115 V192 S193 E194 | W115-K201 HydrophobicContact CB-CB 4.15Å; W115-K201 WeakPolarHBondContact CB-O 3.32Å; W115-K201 PolarHBondContact N-O 2.03Å; W115-K201 VanDerWaalsContact O-CB 3.32Å; W115-K201 WeakPolarHBondContact O-CB 3.42Å; V192-K201 HydrophobicContact CG1-CB 3.68Å; V192-K201 HydrophobicContact CG1-CD 4.33Å; V192-K201 HydrophobicContact CG1-CG 4.01Å; S193-K201 CarbonylContact O-C 3.5Å; S193-K201 WeakPolarHBondContact O-CA 3.37Å; E194-K201 HydrophobicContact CB-CG 4.24Å; E194-K201 HydrophobicContact CG-CG 4.12Å; E194-K201 WeakPolarHBondContact OE2-CE 3.19Å; E194-K201 IonicContact OE2-NZ 3.12Å; E194-K201 PolarHBondContact OE2-NZ 3.3Å; E194-K201 VanDerWaalsContact OE2-NZ 3.11Å |
| 202 | Y | 82.4 | Confident | 75.3 | Confident | 39 Ų | 39 | 64.9 Ų | 64.9 | 15% | 0.153 | 35% | 0.345 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -132.7 | 134.3 | -175.9 | -67 | -90.1 | 0 | 0 | 0 | 110.6 | F37 Y110 V192 S193 D198 K200 V204 | F37-Y202 HydrophobicContact CD1-CE1 4.44Å; F37-Y202 AromaticContact CE1-CD1 3.74Å; F37-Y202 HydrophobicContact CE1-CD1 3.74Å; F37-Y202 AromaticContact CE1-CD2 3.86Å; F37-Y202 HydrophobicContact CE1-CD2 3.86Å; F37-Y202 AromaticContact CE1-CE1 3.76Å; F37-Y202 HydrophobicContact CE1-CE1 3.76Å; F37-Y202 AromaticContact CE1-CE2 3.9Å; F37-Y202 HydrophobicContact CE1-CE2 3.9Å; F37-Y202 AromaticContact CE1-CG 3.78Å; F37-Y202 HydrophobicContact CE1-CG 3.78Å; F37-Y202 AromaticContact CE1-CZ 3.84Å; F37-Y202 HydrophobicContact CZ-CD1 4.32Å; F37-Y202 AromaticContact CZ-CD2 3.82Å; F37-Y202 HydrophobicContact CZ-CD2 3.82Å; F37-Y202 HydrophobicContact CZ-CE2 4.2Å; F37-Y202 AromaticContact CZ-CG 3.9Å; F37-Y202 HydrophobicContact CZ-CG 3.9Å; Y110-Y202 HydrophobicContact CE2-CD1 4.3Å; V192-Y202 WeakPolarHBondContact CA-O 3.03Å; S193-Y202 PolarHBondContact N-O 2.87Å; S193-Y202 PolarHBondContact O-N 2.92Å; D198-Y202 PolarHBondContact OD2-OH 3.44Å; K200-Y202 HydrophobicContact CB-CE2 3.73Å; K200-Y202 WeakPolarHBondContact O-CD2 3.38Å; K200-Y202 WeakPolarHBondContact O-CE2 3.39Å; Y202-V204 PolarHBondContact O-N 3.22Å |
| 203 | C | 84.4 | Confident | 74.7 | Confident | 7 Ų | 7 | 69.5 Ų | 69.5 | 5% | 0.047 | 37% | 0.366 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -86.3 | 88.6 | 179 | 174.4 | 0 | 0 | 0 | 0 | 109.9 | W115 C122 M125 R126 G191 | W115-C203 HydrophobicContact CB-CB 4.47Å; W115-C203 HydrophobicContact CD2-CB 3.7Å; W115-C203 HydrophobicContact CE3-CB 3.63Å; W115-C203 HydrophobicContact CG-CB 4.04Å; W115-C203 HydrophobicContact CZ3-CB 4.28Å; C122-C203 WeakPolarHBondContact CA-SG 3.44Å; C122-C203 HydrophobicContact CB-CB 3.9Å; C122-C203 WeakPolarHBondContact CB-SG 3.29Å; C122-C203 WeakPolarHBondContact SG-CA 3.19Å; C122-C203 WeakPolarHBondContact SG-CB 3.36Å; C122-C203 CovalentContact SG-SG 2.03Å; C122-C203 PolarHBondContact SG-SG 3.42Å; M125-C203 HydrophobicContact CE-CB 4.38Å; R126-C203 VanDerWaalsContact CD-SG 3.51Å; R126-C203 PolarHBondContact NH1-O 2.94Å; G191-C203 CarbonylContact O-C 3.58Å |
| 204 | V | 80.4 | Confident | 74.4 | Confident | 25 Ų | 25 | 71.5 Ų | 71.5 | 15% | 0.152 | 38% | 0.377 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -116.3 | 167 | -170.4 | -63.6 | 0 | 0 | 0 | 0 | 112.1 | G191 Y202 Q206 | G191-V204 PolarHBondContact N-O 2.95Å; G191-V204 PolarHBondContact O-N 3.43Å; Y202-V204 PolarHBondContact O-N 3.22Å; V204-Q206 HydrophobicContact CG2-CG 4.49Å |
| 205 | M | 76.4 | Confident | 74 | Confident | 14 Ų | 14 | 66.6 Ų | 66.6 | 7% | 0.069 | 35% | 0.354 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -89.3 | 112.3 | 166.6 | -177.5 | 148.1 | 70.5 | 0 | 0 | 108.5 | Y189 K207 V211 K212 | Y189-M205 CarbonylContact O-C 3.59Å; Y189-M205 VanDerWaalsContact O-CA 3.31Å; Y189-M205 WeakPolarHBondContact O-CA 3.19Å; M205-K207 VanDerWaalsContact C-N 3.28Å; M205-K207 PolarHBondContact O-N 2.98Å; M205-V211 HydrophobicContact CE-CG1 4.19Å; M205-V211 HydrophobicContact SD-CG1 4.13Å; M205-K212 HydrophobicContact CE-CB 4.28Å; M205-K212 HydrophobicContact CE-CG 4.01Å; M205-K212 WeakPolarHBondContact O-CE 3.05Å |
| 206 | Q | 71.9 | Confident | 74 | Confident | 129 Ų | 129 | 66.8 Ų | 66.8 | 60% | 0.603 | 36% | 0.355 | S | S | * | . | trans | -77.8 | -2.1 | -167.8 | -67.7 | -175.2 | -14.1 | 0 | 0 | 114.7 | Y189 V192 V204 | Y189-Q206 PolarHBondContact O-N 3.22Å; V192-Q206 PolarHBondContact O-NE2 3.13Å; V204-Q206 HydrophobicContact CG2-CG 4.49Å | ||
| 207 | K | 67.4 | Low | 74.4 | Confident | 92 Ų | 92 | 58.9 Ų | 58.9 | 40% | 0.4 | 33% | 0.328 | S | S | . | . | S | Bend | trans | -108.1 | 149.3 | -174 | -161 | 163.4 | 178.2 | 171.5 | 0 | 112.3 | Y189 M205 V211 | Y189-K207 HydrophobicContact CD1-CB 4.09Å; Y189-K207 HydrophobicContact CD1-CD 3.42Å; Y189-K207 VanDerWaalsContact CD1-CD 3.42Å; Y189-K207 HydrophobicContact CD1-CG 4.4Å; Y189-K207 HydrophobicContact CD2-CD 4.25Å; Y189-K207 HydrophobicContact CE1-CD 3.26Å; Y189-K207 HydrophobicContact CE2-CD 4.11Å; Y189-K207 HydrophobicContact CG-CB 4Å; Y189-K207 HydrophobicContact CG-CD 3.92Å; Y189-K207 PolarHBondContact OH-NZ 3.05Å; M205-K207 VanDerWaalsContact C-N 3.28Å; M205-K207 PolarHBondContact O-N 2.98Å; K207-V211 HydrophobicContact CB-CB 4.42Å; K207-V211 HydrophobicContact CB-CG2 4.31Å; K207-V211 HydrophobicContact CD-CG2 4.02Å; K207-V211 HydrophobicContact CG-CG2 3.88Å |
| 208 | S | 67.7 | Low | 75.1 | Confident | 62 Ų | 62 | 55.9 Ų | 55.9 | 43% | 0.434 | 31% | 0.309 | S | S | . | . | trans | -27.5 | 148.7 | -179.2 | 170.9 | 0 | 0 | 0 | 0 | 116.9 | H210 V211 K212 | S208-H210 PolarHBondContact O-N 2.89Å; S208-V211 WeakPolarHBondContact O-CB 3.29Å; S208-V211 PolarHBondContact O-N 3.24Å; S208-K212 PolarHBondContact O-N 3.32Å | ||
| 209 | G | 66.1 | Low | 75.4 | Confident | 16 Ų | 16 | 53.8 Ų | 53.8 | 17% | 0.165 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -46 | -34.3 | 177 | 0 | 0 | 0 | 0 | 0 | 115.1 | V211 K212 M213 | G209-V211 VanDerWaalsContact C-N 3.32Å; G209-V211 PolarHBondContact O-N 3.48Å; G209-K212 PolarHBondContact O-N 2.89Å; G209-M213 WeakPolarHBondContact O-CB 3.49Å; G209-M213 PolarHBondContact O-N 3.03Å |
| 210 | H | 70.6 | Confident | 75.7 | Confident | 116 Ų | 116 | 55 Ų | 55 | 54% | 0.537 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -59.9 | -37.3 | 173.8 | -72.8 | -73.9 | 0 | 0 | 0 | 113.4 | S208 M213 T214 | S208-H210 PolarHBondContact O-N 2.89Å; H210-M213 PolarHBondContact O-N 2.96Å; H210-T214 WeakPolarHBondContact O-CB 3.09Å; H210-T214 WeakPolarHBondContact O-CG2 3.46Å; H210-T214 PolarHBondContact O-N 3.33Å; H210-T214 PolarHBondContact O-OG1 2.98Å |
| 211 | V | 71.1 | Confident | 75.8 | Confident | 22 Ų | 22 | 52.3 Ų | 52.3 | 13% | 0.133 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -72.7 | -42.7 | 177.1 | -178 | 0 | 0 | 0 | 0 | 110.6 | P185 Y189 M205 K207 S208 G209 M213 T214 T215 | P185-V211 HydrophobicContact CB-CG1 4.39Å; Y189-V211 HydrophobicContact CD2-CG1 3.51Å; Y189-V211 HydrophobicContact CE2-CG1 3.91Å; Y189-V211 HydrophobicContact CG-CG1 4.37Å; M205-V211 HydrophobicContact CE-CG1 4.19Å; M205-V211 HydrophobicContact SD-CG1 4.13Å; K207-V211 HydrophobicContact CB-CB 4.42Å; K207-V211 HydrophobicContact CB-CG2 4.31Å; K207-V211 HydrophobicContact CD-CG2 4.02Å; K207-V211 HydrophobicContact CG-CG2 3.88Å; S208-V211 WeakPolarHBondContact O-CB 3.29Å; S208-V211 PolarHBondContact O-N 3.24Å; G209-V211 VanDerWaalsContact C-N 3.32Å; G209-V211 PolarHBondContact O-N 3.48Å; V211-M213 VanDerWaalsContact C-N 3.3Å; V211-M213 PolarHBondContact O-N 3.21Å; V211-T214 WeakPolarHBondContact CA-OG1 3.48Å; V211-T214 PolarHBondContact O-N 2.97Å; V211-T214 PolarHBondContact O-OG1 2.85Å; V211-T214 VanDerWaalsContact O-OG1 3.09Å; V211-T215 WeakPolarHBondContact O-CB 3.33Å; V211-T215 PolarHBondContact O-N 2.79Å; V211-T215 PolarHBondContact O-OG1 3.32Å |
| 212 | K | 70.7 | Confident | 75.7 | Confident | 49 Ų | 49 | 48.9 Ų | 48.9 | 21% | 0.213 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -55.1 | -47 | 171.5 | -61.2 | 179.4 | 179.5 | 174.4 | 0 | 110 | D35 M205 S208 G209 N216 I284 | D35-K212 IonicContact OD1-NZ 2.69Å; D35-K212 PolarHBondContact OD1-NZ 2.74Å; D35-K212 IonicContact OD2-NZ 2.65Å; M205-K212 HydrophobicContact CE-CB 4.28Å; M205-K212 HydrophobicContact CE-CG 4.01Å; M205-K212 WeakPolarHBondContact O-CE 3.05Å; S208-K212 PolarHBondContact O-N 3.32Å; G209-K212 PolarHBondContact O-N 2.89Å; K212-N216 PolarHBondContact O-N 3.38Å; K212-I284 HydrophobicContact CB-CD1 3.88Å; K212-I284 HydrophobicContact CB-CG1 4.04Å; K212-I284 HydrophobicContact CB-CG2 4.12Å |
| 213 | M | 72.4 | Confident | 75.6 | Confident | 127 Ų | 127 | 48.2 Ų | 48.2 | 63% | 0.626 | 28% | 0.275 | S | S | * | . | H | α-helix | trans | -67.9 | -45.3 | -179.9 | -168.7 | -178 | -169.9 | 0 | 0 | 113.7 | G209 H210 V211 N216 G217 I284 | G209-M213 WeakPolarHBondContact O-CB 3.49Å; G209-M213 PolarHBondContact O-N 3.03Å; H210-M213 PolarHBondContact O-N 2.96Å; V211-M213 VanDerWaalsContact C-N 3.3Å; V211-M213 PolarHBondContact O-N 3.21Å; M213-N216 PolarHBondContact O-N 3.1Å; M213-G217 PolarHBondContact O-N 3.33Å; M213-I284 HydrophobicContact CB-CG2 4.21Å |
| 214 | T | 76.4 | Confident | 75.5 | Confident | 91 Ų | 91 | 51.2 Ų | 51.2 | 56% | 0.558 | 30% | 0.295 | S | S | * | . | H | α-helix | trans | -65.1 | -38.3 | 178.7 | 45.9 | 0 | 0 | 0 | 0 | 112.5 | H210 V211 G217 A218 | H210-T214 WeakPolarHBondContact O-CB 3.09Å; H210-T214 WeakPolarHBondContact O-CG2 3.46Å; H210-T214 PolarHBondContact O-N 3.33Å; H210-T214 PolarHBondContact O-OG1 2.98Å; V211-T214 WeakPolarHBondContact CA-OG1 3.48Å; V211-T214 PolarHBondContact O-N 2.97Å; V211-T214 PolarHBondContact O-OG1 2.85Å; V211-T214 VanDerWaalsContact O-OG1 3.09Å; T214-G217 PolarHBondContact O-N 2.91Å; T214-A218 WeakPolarHBondContact O-CB 3.39Å; T214-A218 PolarHBondContact O-N 2.94Å |
| 215 | T | 73.5 | Confident | 75.6 | Confident | 8 Ų | 8 | 54.4 Ų | 54.4 | 5% | 0.049 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -63.8 | -47.1 | 175.5 | -53.7 | 0 | 0 | 0 | 0 | 111.1 | V211 G217 A218 I219 | V211-T215 WeakPolarHBondContact O-CB 3.33Å; V211-T215 PolarHBondContact O-N 2.79Å; V211-T215 PolarHBondContact O-OG1 3.32Å; T215-G217 PolarHBondContact O-N 2.71Å; T215-A218 WeakPolarHBondContact O-CB 3.44Å; T215-A218 PolarHBondContact O-N 3.32Å; T215-I219 PolarHBondContact O-N 3.37Å |
| 216 | N | 74.6 | Confident | 75.9 | Confident | 13 Ų | 13 | 54 Ų | 54 | 7% | 0.07 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -64.4 | -39.4 | 174.6 | -90.4 | 21.7 | 0 | 0 | 0 | 112.8 | K212 M213 A218 I219 I220 L280 S281 I284 | K212-N216 PolarHBondContact O-N 3.38Å; M213-N216 PolarHBondContact O-N 3.1Å; N216-A218 VanDerWaalsContact C-N 3.29Å; N216-A218 PolarHBondContact O-N 3.39Å; N216-I219 PolarHBondContact O-N 3.26Å; N216-I220 VanDerWaalsContact O-CG1 3.32Å; N216-I220 WeakPolarHBondContact O-CG1 3.26Å; N216-I220 PolarHBondContact O-N 2.87Å; N216-L280 WeakPolarHBondContact ND2-CG 3.35Å; N216-L280 WeakPolarHBondContact OD1-CD2 3.49Å; N216-S281 PolarHBondContact ND2-N 2.81Å; N216-I284 HydrophobicContact CB-CD1 4.3Å; N216-I284 WeakPolarHBondContact ND2-CD1 3.33Å |
| 217 | G | 78.1 | Confident | 76.3 | Confident | 39 Ų | 39 | 52.2 Ų | 52.2 | 40% | 0.402 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -58.9 | -39.1 | 173.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | M213 T214 T215 I220 G221 | M213-G217 PolarHBondContact O-N 3.33Å; T214-G217 PolarHBondContact O-N 2.91Å; T215-G217 PolarHBondContact O-N 2.71Å; G217-I220 PolarHBondContact O-N 3.16Å; G217-G221 PolarHBondContact O-N 3.47Å |
| 218 | A | 81.1 | Confident | 77.1 | Confident | 32 Ų | 32 | 54.5 Ų | 54.5 | 26% | 0.264 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -67.1 | -41.9 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | T214 T215 N216 G221 V222 | T214-A218 WeakPolarHBondContact O-CB 3.39Å; T214-A218 PolarHBondContact O-N 2.94Å; T215-A218 WeakPolarHBondContact O-CB 3.44Å; T215-A218 PolarHBondContact O-N 3.32Å; N216-A218 VanDerWaalsContact C-N 3.29Å; N216-A218 PolarHBondContact O-N 3.39Å; A218-G221 PolarHBondContact O-N 3.45Å; A218-V222 VanDerWaalsContact O-CG2 3.3Å; A218-V222 WeakPolarHBondContact O-CG2 3.35Å; A218-V222 PolarHBondContact O-N 2.75Å |
| 219 | I | 78.6 | Confident | 77.8 | Confident | 19 Ų | 19 | 53.3 Ų | 53.3 | 10% | 0.097 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -59 | -48.8 | 173.4 | -64.6 | 172.9 | 0 | 0 | 0 | 110.4 | T133 Y134 T215 N216 F223 T277 | T133-I219 HydrophobicContact CG2-CG2 4.39Å; Y134-I219 HydrophobicContact CE1-CG1 3.91Å; Y134-I219 WeakPolarHBondContact OH-CG1 3.26Å; T215-I219 PolarHBondContact O-N 3.37Å; N216-I219 PolarHBondContact O-N 3.26Å; I219-F223 WeakPolarHBondContact O-CB 3.38Å; I219-F223 PolarHBondContact O-N 2.69Å; I219-T277 HydrophobicContact CG2-CG2 4.03Å |
| 220 | I | 81.5 | Confident | 78.3 | Confident | 73 Ų | 73 | 52.8 Ų | 52.8 | 37% | 0.374 | 30% | 0.297 | S | S | . | . | H | α-helix | trans | -63.1 | -42.8 | 178.5 | -65.8 | 165.9 | 0 | 0 | 0 | 110.8 | N216 G217 F223 C224 T277 | N216-I220 VanDerWaalsContact O-CG1 3.32Å; N216-I220 WeakPolarHBondContact O-CG1 3.26Å; N216-I220 PolarHBondContact O-N 2.87Å; G217-I220 PolarHBondContact O-N 3.16Å; I220-F223 WeakPolarHBondContact O-CB 3.22Å; I220-F223 PolarHBondContact O-N 2.91Å; I220-C224 WeakPolarHBondContact O-CB 3.44Å; I220-C224 PolarHBondContact O-N 2.87Å; I220-C224 PolarHBondContact O-SG 3.41Å; I220-T277 HydrophobicContact CD1-CG2 4.2Å; I220-T277 HydrophobicContact CG1-CG2 3.62Å |
| 221 | G | 82.4 | Confident | 78.9 | Confident | 32 Ų | 32 | 50.3 Ų | 50.3 | 33% | 0.33 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -61.2 | -50.3 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.8 | G217 A218 F223 C224 V225 | G217-G221 PolarHBondContact O-N 3.47Å; A218-G221 PolarHBondContact O-N 3.45Å; G221-F223 VanDerWaalsContact C-N 3.3Å; G221-F223 PolarHBondContact O-N 2.92Å; G221-C224 PolarHBondContact O-N 2.91Å; G221-V225 WeakPolarHBondContact O-CG2 3.28Å; G221-V225 PolarHBondContact O-N 2.77Å |
| 222 | V | 81.8 | Confident | 79.5 | Confident | 22 Ų | 22 | 52.2 Ų | 52.2 | 13% | 0.133 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -64.3 | -36.7 | 177.6 | 176.1 | 0 | 0 | 0 | 0 | 111.4 | Y134 L137 L138 L182 A218 S226 | Y134-V222 HydrophobicContact CD1-CB 4.22Å; Y134-V222 HydrophobicContact CD1-CG1 4.25Å; Y134-V222 HydrophobicContact CD1-CG2 4.04Å; Y134-V222 HydrophobicContact CE1-CB 4.45Å; Y134-V222 HydrophobicContact CE1-CG2 4.1Å; L137-V222 HydrophobicContact CB-CG1 4.02Å; L137-V222 HydrophobicContact CD1-CB 4.44Å; L137-V222 HydrophobicContact CD1-CG1 3.98Å; L138-V222 HydrophobicContact CD2-CG1 4.24Å; L138-V222 HydrophobicContact CG-CG1 4.31Å; L182-V222 HydrophobicContact CD1-CG2 3.85Å; A218-V222 VanDerWaalsContact O-CG2 3.3Å; A218-V222 WeakPolarHBondContact O-CG2 3.35Å; A218-V222 PolarHBondContact O-N 2.75Å; V222-S226 VanDerWaalsContact O-CB 3.31Å; V222-S226 WeakPolarHBondContact O-CB 3.24Å; V222-S226 PolarHBondContact O-N 3.29Å; V222-S226 PolarHBondContact O-OG 3.22Å |
| 223 | F | 79.7 | Confident | 80 | Confident | 25 Ų | 25 | 50.4 Ų | 50.4 | 11% | 0.11 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -60.7 | -50.9 | 172.9 | 178.8 | -82.8 | 0 | 0 | 0 | 111.3 | L137 I219 I220 G221 V225 S226 F227 F269 L270 L274 | L137-F223 HydrophobicContact CD1-CB 4.12Å; L137-F223 HydrophobicContact CD2-CB 4.47Å; L137-F223 HydrophobicContact CD2-CD2 3.97Å; I219-F223 WeakPolarHBondContact O-CB 3.38Å; I219-F223 PolarHBondContact O-N 2.69Å; I220-F223 WeakPolarHBondContact O-CB 3.22Å; I220-F223 PolarHBondContact O-N 2.91Å; G221-F223 VanDerWaalsContact C-N 3.3Å; G221-F223 PolarHBondContact O-N 2.92Å; F223-V225 PolarHBondContact O-N 3Å; F223-S226 PolarHBondContact O-N 2.92Å; F223-F227 HydrophobicContact CE1-CB 4.46Å; F223-F227 VanDerWaalsContact O-CB 3.3Å; F223-F227 WeakPolarHBondContact O-CB 3.33Å; F223-F227 PolarHBondContact O-N 3.29Å; F223-F269 HydrophobicContact CD2-CD1 4.23Å; F223-F269 AromaticContact CD2-CE1 3.98Å; F223-F269 HydrophobicContact CD2-CE1 3.98Å; F223-F269 HydrophobicContact CE2-CD1 4.01Å; F223-F269 HydrophobicContact CE2-CE1 4.18Å; F223-L270 HydrophobicContact CE1-CD2 4.33Å; F223-L270 HydrophobicContact CE2-CD2 3.71Å; F223-L270 HydrophobicContact CZ-CB 4.42Å; F223-L270 HydrophobicContact CZ-CD2 3.34Å; F223-L270 HydrophobicContact CZ-CG 4.37Å; F223-L274 HydrophobicContact CD1-CD2 4.09Å; F223-L274 HydrophobicContact CD2-CD2 4.2Å; F223-L274 HydrophobicContact CE1-CD1 4.16Å; F223-L274 HydrophobicContact CE1-CD2 3.59Å; F223-L274 HydrophobicContact CE1-CG 4.11Å; F223-L274 HydrophobicContact CE2-CD1 4.38Å; F223-L274 HydrophobicContact CE2-CD2 3.68Å; F223-L274 HydrophobicContact CE2-CG 3.73Å; F223-L274 HydrophobicContact CG-CD2 4.38Å; F223-L274 HydrophobicContact CZ-CD1 3.6Å; F223-L274 HydrophobicContact CZ-CD2 3.35Å; F223-L274 HydrophobicContact CZ-CG 3.4Å |
| 224 | C | 83.3 | Confident | 80.3 | Confident | 69 Ų | 69 | 46.1 Ų | 46.1 | 47% | 0.466 | 27% | 0.272 | S | S | . | . | H | α-helix | trans | -60.9 | -43.3 | 178.3 | -73.4 | 0 | 0 | 0 | 0 | 112.3 | I220 G221 F227 F228 | I220-C224 WeakPolarHBondContact O-CB 3.44Å; I220-C224 PolarHBondContact O-N 2.87Å; I220-C224 PolarHBondContact O-SG 3.41Å; G221-C224 PolarHBondContact O-N 2.91Å; C224-F227 PolarHBondContact O-N 2.97Å; C224-F228 VanDerWaalsContact O-CB 3.24Å; C224-F228 WeakPolarHBondContact O-CB 3.24Å; C224-F228 PolarHBondContact O-N 2.93Å |
| 225 | V | 83.4 | Confident | 80.5 | Confident | 92 Ų | 92 | 45.6 Ų | 45.6 | 56% | 0.558 | 27% | 0.269 | S | S | * | . | H | α-helix | trans | -62.2 | -45 | 175.6 | 169.7 | 0 | 0 | 0 | 0 | 111.2 | G221 F223 T229 | G221-V225 WeakPolarHBondContact O-CG2 3.28Å; G221-V225 PolarHBondContact O-N 2.77Å; F223-V225 PolarHBondContact O-N 3Å; V225-T229 VanDerWaalsContact O-CB 3.32Å; V225-T229 WeakPolarHBondContact O-CB 3.25Å; V225-T229 PolarHBondContact O-N 3.4Å; V225-T229 PolarHBondContact O-OG1 3.49Å |
| 226 | S | 81.1 | Confident | 80.9 | Confident | 7 Ų | 7 | 47 Ų | 47 | 5% | 0.049 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -66.1 | -44.2 | 178.8 | -60.4 | 0 | 0 | 0 | 0 | 111.3 | L137 V222 F223 T229 M230 | L137-S226 PolarHBondContact O-OG 3.17Å; V222-S226 VanDerWaalsContact O-CB 3.31Å; V222-S226 WeakPolarHBondContact O-CB 3.24Å; V222-S226 PolarHBondContact O-N 3.29Å; V222-S226 PolarHBondContact O-OG 3.22Å; F223-S226 PolarHBondContact O-N 2.92Å; S226-T229 PolarHBondContact O-N 3.27Å; S226-M230 WeakPolarHBondContact O-CG 3.42Å; S226-M230 PolarHBondContact O-N 3.36Å |
| 227 | F | 81.4 | Confident | 81 | Confident | 91 Ų | 91 | 46.5 Ų | 46.5 | 40% | 0.399 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -65.3 | -43.4 | 177.3 | -179.1 | -101.2 | 0 | 0 | 0 | 112.6 | F223 C224 M230 V231 V266 L270 | F223-F227 HydrophobicContact CE1-CB 4.46Å; F223-F227 VanDerWaalsContact O-CB 3.3Å; F223-F227 WeakPolarHBondContact O-CB 3.33Å; F223-F227 PolarHBondContact O-N 3.29Å; C224-F227 PolarHBondContact O-N 2.97Å; F227-M230 VanDerWaalsContact O-CB 3.3Å; F227-M230 WeakPolarHBondContact O-CB 3.29Å; F227-M230 PolarHBondContact O-N 2.81Å; F227-V231 HydrophobicContact CD1-CG2 4.31Å; F227-V231 HydrophobicContact CE1-CG2 3.85Å; F227-V231 HydrophobicContact CE2-CG2 4.25Å; F227-V231 HydrophobicContact CZ-CG2 3.82Å; F227-V231 WeakPolarHBondContact O-CG2 3.46Å; F227-V231 PolarHBondContact O-N 3.25Å; F227-V266 HydrophobicContact CD2-CG1 4.44Å; F227-L270 HydrophobicContact CD2-CD1 4.19Å; F227-L270 HydrophobicContact CD2-CD2 3.92Å; F227-L270 HydrophobicContact CE2-CD1 3.84Å; F227-L270 HydrophobicContact CE2-CD2 4.41Å |
| 228 | F | 83.3 | Confident | 80.8 | Confident | 140 Ų | 140 | 46.4 Ų | 46.4 | 61% | 0.614 | 28% | 0.275 | S | S | * | . | H | α-helix | trans | -61.1 | -46.9 | 174.8 | 179.3 | -100.7 | 0 | 0 | 0 | 111.5 | C224 M230 V231 V232 | C224-F228 VanDerWaalsContact O-CB 3.24Å; C224-F228 WeakPolarHBondContact O-CB 3.24Å; C224-F228 PolarHBondContact O-N 2.93Å; F228-M230 VanDerWaalsContact C-N 3.27Å; F228-M230 PolarHBondContact O-N 3.28Å; F228-V231 PolarHBondContact O-N 3.02Å; F228-V232 HydrophobicContact CD1-CG2 4.26Å; F228-V232 HydrophobicContact CD2-CG2 4.43Å; F228-V232 HydrophobicContact CE1-CG2 3.82Å; F228-V232 HydrophobicContact CE2-CG2 4.01Å; F228-V232 HydrophobicContact CZ-CG2 3.69Å; F228-V232 WeakPolarHBondContact O-CG2 3.25Å; F228-V232 PolarHBondContact O-N 3.38Å |
| 229 | T | 82.4 | Confident | 80.8 | Confident | 36 Ų | 36 | 48.6 Ų | 48.6 | 22% | 0.221 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -55.8 | -42.5 | 174.7 | -58.2 | 0 | 0 | 0 | 0 | 111.5 | I145 V225 S226 C233 | I145-T229 HydrophobicContact CD1-CG2 3.99Å; I145-T229 HydrophobicContact CG1-CG2 3.93Å; V225-T229 VanDerWaalsContact O-CB 3.32Å; V225-T229 WeakPolarHBondContact O-CB 3.25Å; V225-T229 PolarHBondContact O-N 3.4Å; V225-T229 PolarHBondContact O-OG1 3.49Å; S226-T229 PolarHBondContact O-N 3.27Å; T229-C233 VanDerWaalsContact O-CB 3.3Å; T229-C233 WeakPolarHBondContact O-CB 3.16Å; T229-C233 PolarHBondContact O-N 3.44Å; T229-C233 PolarHBondContact O-SG 2.79Å |
| 230 | M | 77.3 | Confident | 80.6 | Confident | 6 Ų | 6 | 49.8 Ų | 49.8 | 3% | 0.03 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -59.8 | -52.7 | 175.2 | -71.4 | -80.6 | 175.5 | 0 | 0 | 112.1 | L140 S144 S226 F227 F228 V232 C233 Y234 V266 | L140-M230 HydrophobicContact CB-CE 3.58Å; L140-M230 WeakPolarHBondContact O-CE 3.39Å; S144-M230 VanDerWaalsContact CB-SD 3.55Å; S144-M230 WeakPolarHBondContact OG-CE 3.42Å; S144-M230 PolarHBondContact OG-SD 3.42Å; S226-M230 WeakPolarHBondContact O-CG 3.42Å; S226-M230 PolarHBondContact O-N 3.36Å; F227-M230 VanDerWaalsContact O-CB 3.3Å; F227-M230 WeakPolarHBondContact O-CB 3.29Å; F227-M230 PolarHBondContact O-N 2.81Å; F228-M230 VanDerWaalsContact C-N 3.27Å; F228-M230 PolarHBondContact O-N 3.28Å; M230-V232 PolarHBondContact O-N 2.87Å; M230-C233 PolarHBondContact O-N 2.84Å; M230-Y234 HydrophobicContact CB-CD2 4.27Å; M230-Y234 HydrophobicContact CB-CE2 3.99Å; M230-Y234 HydrophobicContact CG-CE2 4.44Å; M230-Y234 WeakPolarHBondContact O-CD2 3.2Å; M230-Y234 PolarHBondContact O-N 2.81Å; M230-Y234 HydrophobicContact SD-CE2 3.57Å; M230-Y234 VanDerWaalsContact SD-CE2 3.57Å; M230-Y234 PolarHBondContact SD-OH 3.42Å; M230-V266 HydrophobicContact CE-CG2 3.61Å; M230-V266 HydrophobicContact CG-CG2 3.88Å; M230-V266 HydrophobicContact SD-CG2 3.27Å; M230-V266 WeakPolarHBondContact SD-CG2 3.23Å |
| 231 | V | 82.4 | Confident | 80.2 | Confident | 63 Ų | 63 | 47.1 Ų | 47.1 | 38% | 0.382 | 28% | 0.28 | S | S | . | . | H | α-helix | trans | -58.1 | -51.2 | -178.6 | 172 | 0 | 0 | 0 | 0 | 110 | F227 F228 C233 Y234 T235 | F227-V231 HydrophobicContact CD1-CG2 4.31Å; F227-V231 HydrophobicContact CE1-CG2 3.85Å; F227-V231 HydrophobicContact CE2-CG2 4.25Å; F227-V231 HydrophobicContact CZ-CG2 3.82Å; F227-V231 WeakPolarHBondContact O-CG2 3.46Å; F227-V231 PolarHBondContact O-N 3.25Å; F228-V231 PolarHBondContact O-N 3.02Å; V231-C233 PolarHBondContact O-N 3.48Å; V231-Y234 PolarHBondContact O-N 3.42Å; V231-T235 HydrophobicContact CG1-CG2 4.24Å; V231-T235 WeakPolarHBondContact O-CG2 3.45Å; V231-T235 PolarHBondContact O-N 3.38Å; V231-T235 PolarHBondContact O-OG1 2.85Å |
| 232 | V | 84.2 | Confident | 79.7 | Confident | 62 Ų | 62 | 55 Ų | 55 | 38% | 0.376 | 30% | 0.299 | S | S | . | . | H | α-helix | trans | -60.3 | -42.5 | 178.4 | 174.9 | 0 | 0 | 0 | 0 | 112.1 | F228 M230 T235 S236 | F228-V232 HydrophobicContact CD1-CG2 4.26Å; F228-V232 HydrophobicContact CD2-CG2 4.43Å; F228-V232 HydrophobicContact CE1-CG2 3.82Å; F228-V232 HydrophobicContact CE2-CG2 4.01Å; F228-V232 HydrophobicContact CZ-CG2 3.69Å; F228-V232 WeakPolarHBondContact O-CG2 3.25Å; F228-V232 PolarHBondContact O-N 3.38Å; M230-V232 PolarHBondContact O-N 2.87Å; V232-T235 PolarHBondContact O-OG1 2.99Å; V232-T235 VanDerWaalsContact O-OG1 3.14Å; V232-S236 VanDerWaalsContact O-CB 3.24Å; V232-S236 WeakPolarHBondContact O-CB 3.32Å; V232-S236 PolarHBondContact O-N 3.01Å; V232-S236 VanDerWaalsContact O-N 3.12Å; V232-S236 PolarHBondContact O-OG 2.8Å |
| 233 | C | 81.6 | Confident | 79.3 | Confident | 12 Ų | 12 | 60.2 Ų | 60.2 | 8% | 0.081 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -63.4 | -44.7 | 176.6 | -72.5 | 0 | 0 | 0 | 0 | 111.7 | T229 M230 V231 I237 | T229-C233 VanDerWaalsContact O-CB 3.3Å; T229-C233 WeakPolarHBondContact O-CB 3.16Å; T229-C233 PolarHBondContact O-N 3.44Å; T229-C233 PolarHBondContact O-SG 2.79Å; M230-C233 PolarHBondContact O-N 2.84Å; V231-C233 PolarHBondContact O-N 3.48Å; C233-I237 WeakPolarHBondContact O-CB 3.16Å; C233-I237 WeakPolarHBondContact O-CD1 3.35Å; C233-I237 WeakPolarHBondContact O-CG1 3.34Å; C233-I237 PolarHBondContact O-N 2.9Å |
| 234 | Y | 79.3 | Confident | 78.5 | Confident | 37 Ų | 37 | 60.8 Ų | 60.8 | 15% | 0.145 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -76.1 | -36.1 | -176.4 | -63.7 | -45.3 | 0 | 0 | 0 | 113.7 | S144 M230 V231 I237 G238 L259 M262 V263 V266 | S144-Y234 PolarHBondContact OG-OH 3.45Å; M230-Y234 HydrophobicContact CB-CD2 4.27Å; M230-Y234 HydrophobicContact CB-CE2 3.99Å; M230-Y234 HydrophobicContact CG-CE2 4.44Å; M230-Y234 WeakPolarHBondContact O-CD2 3.2Å; M230-Y234 PolarHBondContact O-N 2.81Å; M230-Y234 HydrophobicContact SD-CE2 3.57Å; M230-Y234 VanDerWaalsContact SD-CE2 3.57Å; M230-Y234 PolarHBondContact SD-OH 3.42Å; V231-Y234 PolarHBondContact O-N 3.42Å; Y234-I237 HydrophobicContact CD1-CD1 4.24Å; Y234-I237 PolarHBondContact O-N 2.84Å; Y234-G238 PolarHBondContact O-N 2.8Å; Y234-L259 HydrophobicContact CD1-CD2 3.65Å; Y234-L259 HydrophobicContact CE1-CD2 3.98Å; Y234-M262 HydrophobicContact CE1-CB 4.19Å; Y234-M262 VanDerWaalsContact OH-C 3.32Å; Y234-M262 WeakPolarHBondContact OH-CB 3.35Å; Y234-M262 PolarHBondContact OH-O 3.41Å; Y234-V263 HydrophobicContact CD2-CG2 4.03Å; Y234-V263 HydrophobicContact CE2-CG2 3.94Å; Y234-V263 HydrophobicContact CG-CG2 4.38Å; Y234-V266 HydrophobicContact CE2-CG2 4.4Å |
| 235 | T | 80.7 | Confident | 77.1 | Confident | 80 Ų | 80 | 61.1 Ų | 61.1 | 49% | 0.491 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -62.4 | -46.3 | 171.8 | 54.3 | 0 | 0 | 0 | 0 | 110.2 | V231 V232 I237 G238 V239 | V231-T235 HydrophobicContact CG1-CG2 4.24Å; V231-T235 WeakPolarHBondContact O-CG2 3.45Å; V231-T235 PolarHBondContact O-N 3.38Å; V231-T235 PolarHBondContact O-OG1 2.85Å; V232-T235 PolarHBondContact O-OG1 2.99Å; V232-T235 VanDerWaalsContact O-OG1 3.14Å; T235-I237 VanDerWaalsContact C-N 3.33Å; T235-I237 PolarHBondContact O-N 3.21Å; T235-G238 WeakPolarHBondContact O-CA 3.5Å; T235-G238 PolarHBondContact O-N 3.35Å; T235-V239 WeakPolarHBondContact O-CG2 3.36Å; T235-V239 PolarHBondContact O-N 3.3Å |
| 236 | S | 80.3 | Confident | 75.6 | Confident | 38 Ų | 38 | 62.8 Ų | 62.8 | 27% | 0.266 | 34% | 0.34 | S | S | . | . | H | α-helix | trans | -60.3 | -40.1 | 176.1 | -56.6 | 0 | 0 | 0 | 0 | 112.5 | V232 G238 V240 | V232-S236 VanDerWaalsContact O-CB 3.24Å; V232-S236 WeakPolarHBondContact O-CB 3.32Å; V232-S236 PolarHBondContact O-N 3.01Å; V232-S236 VanDerWaalsContact O-N 3.12Å; V232-S236 PolarHBondContact O-OG 2.8Å; S236-G238 VanDerWaalsContact C-N 3.34Å; S236-V240 WeakPolarHBondContact O-CG2 3.22Å; S236-V240 PolarHBondContact O-N 2.79Å; S236-V240 VanDerWaalsContact O-N 3.08Å |
| 237 | I | 76.3 | Confident | 74.1 | Confident | 1 Ų | 1 | 70.6 Ų | 70.6 | 1% | 0.005 | 38% | 0.375 | C | S | . | . | H | α-helix | trans | -66.3 | -37.7 | 173 | -68.8 | 162.9 | 0 | 0 | 0 | 111.3 | R147 Y148 V151 C233 Y234 T235 L241 L259 | R147-I237 HydrophobicContact CB-CD1 4.21Å; Y148-I237 HydrophobicContact CD2-CG1 4.12Å; V151-I237 HydrophobicContact CB-CG1 4.37Å; V151-I237 HydrophobicContact CB-CG2 4.42Å; V151-I237 HydrophobicContact CG1-CG2 4.06Å; V151-I237 HydrophobicContact CG2-CG2 4.34Å; C233-I237 WeakPolarHBondContact O-CB 3.16Å; C233-I237 WeakPolarHBondContact O-CD1 3.35Å; C233-I237 WeakPolarHBondContact O-CG1 3.34Å; C233-I237 PolarHBondContact O-N 2.9Å; Y234-I237 HydrophobicContact CD1-CD1 4.24Å; Y234-I237 PolarHBondContact O-N 2.84Å; T235-I237 VanDerWaalsContact C-N 3.33Å; T235-I237 PolarHBondContact O-N 3.21Å; I237-L241 HydrophobicContact CG2-CD1 3.83Å; I237-L241 HydrophobicContact CG2-CG 4.22Å; I237-L241 VanDerWaalsContact O-CB 3.32Å; I237-L241 WeakPolarHBondContact O-CB 3.24Å; I237-L241 VanDerWaalsContact O-CG 3.26Å; I237-L241 WeakPolarHBondContact O-CG 3.37Å; I237-L241 PolarHBondContact O-N 3.35Å; I237-L259 HydrophobicContact CB-CD2 4.31Å; I237-L259 HydrophobicContact CD1-CD2 3.84Å; I237-L259 HydrophobicContact CG2-CD1 3.53Å; I237-L259 HydrophobicContact CG2-CD2 3.72Å; I237-L259 HydrophobicContact CG2-CG 4.2Å |
| 238 | G | 75.3 | Confident | 72.9 | Confident | 37 Ų | 37 | 75 Ų | 75 | 38% | 0.381 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -58.5 | -48.8 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | Y234 T235 S236 L241 W242 | Y234-G238 PolarHBondContact O-N 2.8Å; T235-G238 WeakPolarHBondContact O-CA 3.5Å; T235-G238 PolarHBondContact O-N 3.35Å; S236-G238 VanDerWaalsContact C-N 3.34Å; G238-L241 PolarHBondContact O-N 3.15Å; G238-W242 WeakPolarHBondContact O-CB 3.46Å; G238-W242 PolarHBondContact O-N 3.17Å |
| 239 | V | 80.1 | Confident | 71.5 | Confident | 78 Ų | 78 | 79.4 Ų | 79.4 | 47% | 0.473 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -59.2 | -52.9 | 175.8 | 174.3 | 0 | 0 | 0 | 0 | 111.2 | T235 L241 W242 E243 | T235-V239 WeakPolarHBondContact O-CG2 3.36Å; T235-V239 PolarHBondContact O-N 3.3Å; V239-L241 PolarHBondContact O-N 2.86Å; V239-W242 WeakPolarHBondContact O-CB 3.43Å; V239-W242 PolarHBondContact O-N 3.01Å; V239-E243 WeakPolarHBondContact CG1-OE1 3.32Å; V239-E243 WeakPolarHBondContact O-CG 3.34Å; V239-E243 PolarHBondContact O-N 2.84Å |
| 240 | V | 74.9 | Confident | 70.3 | Confident | 45 Ų | 45 | 81.2 Ų | 81.2 | 27% | 0.273 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -61.4 | -30.4 | 178.9 | 171.1 | 0 | 0 | 0 | 0 | 112.6 | V151 A152 S236 G244 | V151-V240 HydrophobicContact CG1-CG1 4.04Å; A152-V240 HydrophobicContact CB-CG2 4.34Å; S236-V240 WeakPolarHBondContact O-CG2 3.22Å; S236-V240 PolarHBondContact O-N 2.79Å; S236-V240 VanDerWaalsContact O-N 3.08Å; V240-G244 PolarHBondContact O-N 3.14Å; V240-G244 VanDerWaalsContact O-N 3.07Å |
| 241 | L | 73.2 | Confident | 69.4 | Low | 17 Ų | 17 | 88.1 Ų | 88.1 | 9% | 0.089 | 46% | 0.457 | C | S | . | . | H | α-helix | trans | -75 | -38.7 | 173.2 | -77.6 | 175.3 | 0 | 0 | 0 | 112.5 | I237 G238 V239 G244 H245 R255 L259 | I237-L241 HydrophobicContact CG2-CD1 3.83Å; I237-L241 HydrophobicContact CG2-CG 4.22Å; I237-L241 VanDerWaalsContact O-CB 3.32Å; I237-L241 WeakPolarHBondContact O-CB 3.24Å; I237-L241 VanDerWaalsContact O-CG 3.26Å; I237-L241 WeakPolarHBondContact O-CG 3.37Å; I237-L241 PolarHBondContact O-N 3.35Å; G238-L241 PolarHBondContact O-N 3.15Å; V239-L241 PolarHBondContact O-N 2.86Å; L241-G244 CarbonylContact O-C 3.5Å; L241-G244 PolarHBondContact O-N 3.23Å; L241-H245 PolarHBondContact O-CD2 3.49Å; L241-H245 PolarHBondContact O-N 3.2Å; L241-R255 HydrophobicContact CD2-CB 4.43Å; L241-L259 HydrophobicContact CD1-CD1 3.49Å; L241-L259 VanDerWaalsContact CD1-CD1 3.49Å |
| 242 | W | 72.6 | Confident | 68.4 | Low | 196 Ų | 196 | 86.9 Ų | 86.9 | 74% | 0.742 | 45% | 0.448 | S | S | * | . | H | α-helix | trans | -64.1 | -48.6 | 177.5 | -171.6 | -101 | 0 | 0 | 0 | 111.5 | G238 V239 G244 H245 | G238-W242 WeakPolarHBondContact O-CB 3.46Å; G238-W242 PolarHBondContact O-N 3.17Å; V239-W242 WeakPolarHBondContact O-CB 3.43Å; V239-W242 PolarHBondContact O-N 3.01Å; W242-G244 VanDerWaalsContact C-N 3.3Å; W242-G244 PolarHBondContact O-N 2.83Å; W242-H245 WeakPolarHBondContact O-CB 3.46Å; W242-H245 PolarHBondContact O-N 3.02Å |
| 243 | E | 71.8 | Confident | 67.2 | Low | 132 Ų | 132 | 91.3 Ų | 91.3 | 62% | 0.617 | 46% | 0.458 | S | S | * | . | H | α-helix | trans | -60.8 | -40.4 | 172.3 | -66.2 | 168.5 | 179.4 | 0 | 0 | 111.3 | V239 H245 | V239-E243 WeakPolarHBondContact CG1-OE1 3.32Å; V239-E243 WeakPolarHBondContact O-CG 3.34Å; V239-E243 PolarHBondContact O-N 2.84Å; E243-H245 VanDerWaalsContact C-N 3.35Å; E243-H245 PolarHBondContact O-N 3.48Å |
| 244 | G | 62.9 | Low | 66.3 | Low | 37 Ų | 37 | 95.7 Ų | 95.7 | 38% | 0.381 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -74.1 | -13.3 | 179.2 | 0 | 0 | 0 | 0 | 0 | 116.1 | V240 L241 W242 V246 H247 | V240-G244 PolarHBondContact O-N 3.14Å; V240-G244 VanDerWaalsContact O-N 3.07Å; L241-G244 CarbonylContact O-C 3.5Å; L241-G244 PolarHBondContact O-N 3.23Å; W242-G244 VanDerWaalsContact C-N 3.3Å; W242-G244 PolarHBondContact O-N 2.83Å; G244-V246 PolarHBondContact O-N 3.47Å; G244-H247 PolarHBondContact O-N 3.08Å |
| 245 | H | 54 | Low | 65.7 | Low | 77 Ų | 77 | 97.9 Ų | 97.9 | 36% | 0.356 | 48% | 0.484 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -58 | -31.2 | 179 | -88.2 | -168.8 | 0 | 0 | 0 | 112.1 | L241 W242 E243 H247 Q252 | L241-H245 PolarHBondContact O-CD2 3.49Å; L241-H245 PolarHBondContact O-N 3.2Å; W242-H245 WeakPolarHBondContact O-CB 3.46Å; W242-H245 PolarHBondContact O-N 3.02Å; E243-H245 VanDerWaalsContact C-N 3.35Å; E243-H245 PolarHBondContact O-N 3.48Å; H245-H247 PolarHBondContact O-N 2.8Å; H245-H247 VanDerWaalsContact O-N 3.15Å; H245-Q252 PolarHBondContact CD2-NE2 3.46Å; H245-Q252 VanDerWaalsContact CD2-NE2 3.29Å; H245-Q252 PolarHBondContact CD2-OE1 3.39Å; H245-Q252 PolarHBondContact NE2-NE2 2.8Å |
| 246 | V | 52.8 | Low | 65.2 | Low | 126 Ų | 126 | 97.9 Ų | 97.9 | 76% | 0.764 | 48% | 0.479 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -66.4 | -13.4 | -177.4 | -175.3 | 0 | 0 | 0 | 0 | 112.8 | G244 | G244-V246 PolarHBondContact O-N 3.47Š|
| 247 | H | 49.7 | Very low | 64.8 | Low | 171 Ų | 171 | 99 Ų | 99 | 79% | 0.792 | 48% | 0.478 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -132.1 | -19.8 | -169.5 | -111.3 | 44.6 | 0 | 0 | 0 | 118.3 | G244 H245 | G244-H247 PolarHBondContact O-N 3.08Å; H245-H247 PolarHBondContact O-N 2.8Å; H245-H247 VanDerWaalsContact O-N 3.15Å |
| 248 | R | 55.7 | Low | 64.6 | Low | 183 Ų | 183 | 101.4 Ų | 101.4 | 69% | 0.691 | 49% | 0.492 | S | S | * | . | trans | -144.4 | 68.4 | -173.8 | -75.1 | -169.6 | 168.4 | 161.9 | -2.3 | 116.7 | G250 | R248-G250 VanDerWaalsContact C-N 3.3Å; R248-G250 PolarHBondContact O-N 2.98Å; R248-G250 VanDerWaalsContact O-N 3.17Å | ||
| 249 | R | 54.1 | Low | 64.3 | Low | 233 Ų | 233 | 101 Ų | 101 | 88% | 0.879 | 48% | 0.481 | S | S | * | . | G | 310 helix | trans | -54.9 | -33 | -179.5 | -150.4 | 164.1 | -177.7 | 136.1 | -4.6 | 115.3 | ||
| 250 | G | 57 | Low | 64.1 | Low | 74 Ų | 74 | 104.8 Ų | 104.8 | 76% | 0.763 | 49% | 0.491 | S | S | * | . | G | 310 helix | trans | -78.6 | -27.8 | -173.4 | 0 | 0 | 0 | 0 | 0 | 117.4 | R248 | R248-G250 VanDerWaalsContact C-N 3.3Å; R248-G250 PolarHBondContact O-N 2.98Å; R248-G250 VanDerWaalsContact O-N 3.17Å |
| 251 | K | 57.8 | Low | 64.2 | Low | 152 Ų | 152 | 103.4 Ų | 103.4 | 66% | 0.661 | 48% | 0.482 | S | S | * | . | G | 310 helix | trans | -90.3 | -4.2 | -179.4 | -103.5 | 175.9 | -179.5 | 170.9 | 0 | 113.8 | ||
| 252 | Q | 62.8 | Low | 64.2 | Low | 37 Ų | 37 | 103 Ų | 103 | 17% | 0.173 | 48% | 0.48 | C | S | . | . | H | α-helix | trans | -75.1 | -41.8 | -167.1 | -169.6 | 168.5 | -52.3 | 0 | 0 | 113.6 | H245 H254 R255 Q256 | H245-Q252 PolarHBondContact CD2-NE2 3.46Å; H245-Q252 VanDerWaalsContact CD2-NE2 3.29Å; H245-Q252 PolarHBondContact CD2-OE1 3.39Å; H245-Q252 PolarHBondContact NE2-NE2 2.8Å; Q252-H254 VanDerWaalsContact C-N 3.34Å; Q252-H254 PolarHBondContact O-N 3.24Å; Q252-R255 WeakPolarHBondContact O-CB 3.25Å; Q252-R255 PolarHBondContact O-N 3.12Å; Q252-Q256 HydrophobicContact CG-CG 4.41Å; Q252-Q256 PolarHBondContact O-N 3.43Å |
| 253 | W | 58 | Low | 64.4 | Low | 155 Ų | 155 | 96.4 Ų | 96.4 | 59% | 0.587 | 46% | 0.461 | S | S | * | . | H | α-helix | trans | -59.4 | -42.6 | -178.6 | -173 | 82.7 | 0 | 0 | 0 | 112.6 | R255 R257 | W253-R255 PolarHBondContact O-N 3.13Å; W253-R257 VanDerWaalsContact CH2-NH1 3.31Å; W253-R257 VanDerWaalsContact O-CB 3.24Å; W253-R257 WeakPolarHBondContact O-CB 3.24Å; W253-R257 PolarHBondContact O-N 2.71Å |
| 254 | H | 62.6 | Low | 64.9 | Low | 103 Ų | 103 | 91.4 Ų | 91.4 | 48% | 0.477 | 44% | 0.442 | S | S | . | . | H | α-helix | trans | -63.8 | -38.1 | 174.2 | -73.5 | -55.9 | 0 | 0 | 0 | 112.8 | Q252 T258 | Q252-H254 VanDerWaalsContact C-N 3.34Å; Q252-H254 PolarHBondContact O-N 3.24Å; H254-T258 PolarHBondContact O-N 2.83Å; H254-T258 PolarHBondContact O-OG1 3.24Å |
| 255 | R | 67.8 | Low | 65.7 | Low | 83 Ų | 83 | 89.7 Ų | 89.7 | 31% | 0.313 | 43% | 0.425 | S | S | . | . | H | α-helix | trans | -66.8 | -50.4 | 177 | -73.9 | -180 | 163.6 | -164 | -13.5 | 111.5 | V151 L241 Q252 W253 R257 T258 L259 | V151-R255 PolarHBondContact O-NH2 3.42Å; L241-R255 HydrophobicContact CD2-CB 4.43Å; Q252-R255 WeakPolarHBondContact O-CB 3.25Å; Q252-R255 PolarHBondContact O-N 3.12Å; W253-R255 PolarHBondContact O-N 3.13Å; R255-R257 VanDerWaalsContact C-N 3.31Å; R255-R257 PolarHBondContact O-N 2.93Å; R255-T258 PolarHBondContact O-N 3.14Å; R255-L259 WeakPolarHBondContact O-CG 3.47Å; R255-L259 PolarHBondContact O-N 3.35Å |
| 256 | Q | 69.7 | Low | 66.8 | Low | 81 Ų | 81 | 86.7 Ų | 86.7 | 38% | 0.379 | 41% | 0.411 | S | S | . | . | H | α-helix | trans | -59 | -40.9 | 176.4 | -72.7 | -177.6 | -16.6 | 0 | 0 | 112.1 | Q252 L259 K260 | Q252-Q256 HydrophobicContact CG-CG 4.41Å; Q252-Q256 PolarHBondContact O-N 3.43Å; Q256-L259 PolarHBondContact O-N 3.07Å; Q256-K260 WeakPolarHBondContact O-CG 3.5Å; Q256-K260 PolarHBondContact O-N 3.01Å |
| 257 | R | 72.8 | Confident | 68.1 | Low | 62 Ų | 62 | 84.7 Ų | 84.7 | 23% | 0.234 | 40% | 0.396 | C | S | . | . | H | α-helix | trans | -63.5 | -41.2 | 175.6 | -176.6 | 173.8 | -179.4 | 139.9 | 8.5 | 112.6 | W253 R255 L261 V315 | W253-R257 VanDerWaalsContact CH2-NH1 3.31Å; W253-R257 VanDerWaalsContact O-CB 3.24Å; W253-R257 WeakPolarHBondContact O-CB 3.24Å; W253-R257 PolarHBondContact O-N 2.71Å; R255-R257 VanDerWaalsContact C-N 3.31Å; R255-R257 PolarHBondContact O-N 2.93Å; R257-L261 PolarHBondContact O-N 3.23Å; R257-L261 VanDerWaalsContact O-N 3.09Å; R257-V315 HydrophobicContact CG-CG1 4.47Å; R257-V315 VanDerWaalsContact CZ-O 3.27Å; R257-V315 PolarHBondContact NE-O 3.48Å; R257-V315 PolarHBondContact NH2-O 3.33Å |
| 258 | T | 70.3 | Confident | 69.8 | Low | 51 Ų | 51 | 77.6 Ų | 77.6 | 31% | 0.313 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -66.1 | -38.3 | 174.8 | -56.2 | 0 | 0 | 0 | 0 | 111.6 | H254 R255 L261 M262 | H254-T258 PolarHBondContact O-N 2.83Å; H254-T258 PolarHBondContact O-OG1 3.24Å; R255-T258 PolarHBondContact O-N 3.14Å; T258-L261 WeakPolarHBondContact O-CB 3.35Å; T258-L261 PolarHBondContact O-N 3.49Å; T258-M262 HydrophobicContact CG2-CE 4.29Å; T258-M262 WeakPolarHBondContact O-CG 3.26Å; T258-M262 PolarHBondContact O-N 3.04Å; T258-M262 VanDerWaalsContact O-N 3.1Å |
| 259 | L | 70.6 | Confident | 70.9 | Confident | 29 Ų | 29 | 69.3 Ų | 69.3 | 15% | 0.152 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -63.8 | -46.9 | 174.6 | -72.4 | 160.2 | 0 | 0 | 0 | 112.3 | Y234 I237 L241 R255 Q256 L261 M262 V263 | Y234-L259 HydrophobicContact CD1-CD2 3.65Å; Y234-L259 HydrophobicContact CE1-CD2 3.98Å; I237-L259 HydrophobicContact CB-CD2 4.31Å; I237-L259 HydrophobicContact CD1-CD2 3.84Å; I237-L259 HydrophobicContact CG2-CD1 3.53Å; I237-L259 HydrophobicContact CG2-CD2 3.72Å; I237-L259 HydrophobicContact CG2-CG 4.2Å; L241-L259 HydrophobicContact CD1-CD1 3.49Å; L241-L259 VanDerWaalsContact CD1-CD1 3.49Å; R255-L259 WeakPolarHBondContact O-CG 3.47Å; R255-L259 PolarHBondContact O-N 3.35Å; Q256-L259 PolarHBondContact O-N 3.07Å; L259-L261 PolarHBondContact O-N 3.13Å; L259-M262 PolarHBondContact O-N 2.98Å; L259-M262 VanDerWaalsContact O-N 3.1Å; L259-V263 WeakPolarHBondContact O-CG2 3.33Å; L259-V263 PolarHBondContact O-N 3.16Å |
| 260 | K | 76.1 | Confident | 72.1 | Confident | 156 Ų | 156 | 59.7 Ų | 59.7 | 68% | 0.678 | 30% | 0.299 | S | S | * | . | H | α-helix | trans | -56.4 | -38.6 | 174.3 | -73.8 | -174.3 | 176.7 | -169.6 | 0 | 112.3 | Q256 A264 | Q256-K260 WeakPolarHBondContact O-CG 3.5Å; Q256-K260 PolarHBondContact O-N 3.01Å; K260-A264 VanDerWaalsContact O-CB 3.26Å; K260-A264 WeakPolarHBondContact O-CB 3.29Å; K260-A264 PolarHBondContact O-N 3.06Å |
| 261 | L | 75.9 | Confident | 73.5 | Confident | 17 Ų | 17 | 61.1 Ų | 61.1 | 9% | 0.089 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -61.1 | -49.9 | 174.2 | -166.7 | 157.5 | 0 | 0 | 0 | 111.4 | R257 T258 L259 A264 L265 Y312 V315 | R257-L261 PolarHBondContact O-N 3.23Å; R257-L261 VanDerWaalsContact O-N 3.09Å; T258-L261 WeakPolarHBondContact O-CB 3.35Å; T258-L261 PolarHBondContact O-N 3.49Å; L259-L261 PolarHBondContact O-N 3.13Å; L261-A264 WeakPolarHBondContact O-CB 3.36Å; L261-A264 PolarHBondContact O-N 3.27Å; L261-L265 HydrophobicContact CD2-CD1 3.78Å; L261-L265 HydrophobicContact CD2-CG 4.1Å; L261-L265 PolarHBondContact O-N 3.33Å; L261-Y312 HydrophobicContact CD2-CD1 4.15Å; L261-Y312 HydrophobicContact CD2-CE1 4.19Å; L261-V315 HydrophobicContact CB-CB 4.12Å; L261-V315 HydrophobicContact CB-CG1 3.61Å; L261-V315 HydrophobicContact CD1-CB 3.74Å; L261-V315 HydrophobicContact CD1-CG1 3.97Å; L261-V315 HydrophobicContact CG-CB 3.84Å; L261-V315 HydrophobicContact CG-CG1 3.93Å |
| 262 | M | 73.6 | Confident | 74.8 | Confident | 9 Ų | 9 | 55.8 Ų | 55.8 | 4% | 0.044 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -73.5 | -33.8 | -174.8 | -55.3 | -58.5 | 178 | 0 | 0 | 112.5 | T86 I143 R147 Y234 T258 L259 A264 L265 V266 | T86-M262 HydrophobicContact CG2-CE 3.94Å; I143-M262 HydrophobicContact CG2-CE 3.87Å; I143-M262 HydrophobicContact CG2-CG 4.32Å; I143-M262 HydrophobicContact CG2-SD 3.51Å; I143-M262 VanDerWaalsContact CG2-SD 3.51Å; R147-M262 HydrophobicContact CG-CG 4.22Å; Y234-M262 HydrophobicContact CE1-CB 4.19Å; Y234-M262 VanDerWaalsContact OH-C 3.32Å; Y234-M262 WeakPolarHBondContact OH-CB 3.35Å; Y234-M262 PolarHBondContact OH-O 3.41Å; T258-M262 HydrophobicContact CG2-CE 4.29Å; T258-M262 WeakPolarHBondContact O-CG 3.26Å; T258-M262 PolarHBondContact O-N 3.04Å; T258-M262 VanDerWaalsContact O-N 3.1Å; L259-M262 PolarHBondContact O-N 2.98Å; L259-M262 VanDerWaalsContact O-N 3.1Å; M262-A264 VanDerWaalsContact C-N 3.34Å; M262-L265 PolarHBondContact O-N 2.94Å; M262-L265 HydrophobicContact SD-CD1 3.56Å; M262-L265 VanDerWaalsContact SD-CD1 3.56Å; M262-V266 WeakPolarHBondContact O-CG2 3.48Å; M262-V266 PolarHBondContact O-N 2.95Å; M262-V266 VanDerWaalsContact O-N 3.14Å |
| 263 | V | 76.4 | Confident | 75.9 | Confident | 57 Ų | 57 | 54.1 Ų | 54.1 | 35% | 0.345 | 26% | 0.258 | S | S | . | . | H | α-helix | trans | -63 | -40.7 | 168.2 | 173 | 0 | 0 | 0 | 0 | 110.8 | Y234 L259 V266 L267 | Y234-V263 HydrophobicContact CD2-CG2 4.03Å; Y234-V263 HydrophobicContact CE2-CG2 3.94Å; Y234-V263 HydrophobicContact CG-CG2 4.38Å; L259-V263 WeakPolarHBondContact O-CG2 3.33Å; L259-V263 PolarHBondContact O-N 3.16Å; V263-V266 PolarHBondContact O-N 3.1Å; V263-L267 HydrophobicContact CG1-CD1 3.93Å; V263-L267 HydrophobicContact CG1-CG 4.24Å; V263-L267 WeakPolarHBondContact O-CG 3.45Å; V263-L267 PolarHBondContact O-N 2.9Å |
| 264 | A | 81.8 | Confident | 77 | Confident | 26 Ų | 26 | 49.8 Ų | 49.8 | 22% | 0.215 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -64.5 | -39 | 176.4 | 0 | 0 | 0 | 0 | 0 | 113 | K260 L261 M262 V266 L267 V268 L311 | K260-A264 VanDerWaalsContact O-CB 3.26Å; K260-A264 WeakPolarHBondContact O-CB 3.29Å; K260-A264 PolarHBondContact O-N 3.06Å; L261-A264 WeakPolarHBondContact O-CB 3.36Å; L261-A264 PolarHBondContact O-N 3.27Å; M262-A264 VanDerWaalsContact C-N 3.34Å; A264-V266 VanDerWaalsContact C-N 3.33Å; A264-V266 PolarHBondContact O-N 2.93Å; A264-L267 PolarHBondContact O-N 3.49Å; A264-V268 WeakPolarHBondContact O-CB 3.22Å; A264-V268 WeakPolarHBondContact O-CG2 3.17Å; A264-V268 PolarHBondContact O-N 3.09Å; A264-L311 HydrophobicContact CB-CD2 4.2Å |
| 265 | L | 79.9 | Confident | 78.1 | Confident | 2 Ų | 2 | 46.9 Ų | 46.9 | 1% | 0.01 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -59.4 | -44.4 | 172.2 | -68.4 | 170 | 0 | 0 | 0 | 111.5 | L140 L261 M262 F269 L311 Y312 | L140-L265 HydrophobicContact CD2-CB 3.95Å; L140-L265 HydrophobicContact CD2-CD1 4.12Å; L261-L265 HydrophobicContact CD2-CD1 3.78Å; L261-L265 HydrophobicContact CD2-CG 4.1Å; L261-L265 PolarHBondContact O-N 3.33Å; M262-L265 PolarHBondContact O-N 2.94Å; M262-L265 HydrophobicContact SD-CD1 3.56Å; M262-L265 VanDerWaalsContact SD-CD1 3.56Å; L265-F269 PolarHBondContact O-N 3.18Å; L265-L311 HydrophobicContact CD2-CB 4.2Å; L265-L311 HydrophobicContact CD2-CD1 3.75Å; L265-L311 HydrophobicContact CG-CD1 4.41Å; L265-Y312 HydrophobicContact CD1-CE1 3.91Å; L265-Y312 HydrophobicContact CD2-CE1 3.72Å; L265-Y312 HydrophobicContact CG-CE1 4.35Å |
| 266 | V | 77 | Confident | 78.9 | Confident | 13 Ų | 13 | 44.8 Ų | 44.8 | 8% | 0.079 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -62.2 | -52.3 | 176.6 | 175.4 | 0 | 0 | 0 | 0 | 110.2 | F227 M230 Y234 M262 V263 A264 V268 F269 L270 | F227-V266 HydrophobicContact CD2-CG1 4.44Å; M230-V266 HydrophobicContact CE-CG2 3.61Å; M230-V266 HydrophobicContact CG-CG2 3.88Å; M230-V266 HydrophobicContact SD-CG2 3.27Å; M230-V266 WeakPolarHBondContact SD-CG2 3.23Å; Y234-V266 HydrophobicContact CE2-CG2 4.4Å; M262-V266 WeakPolarHBondContact O-CG2 3.48Å; M262-V266 PolarHBondContact O-N 2.95Å; M262-V266 VanDerWaalsContact O-N 3.14Å; V263-V266 PolarHBondContact O-N 3.1Å; A264-V266 VanDerWaalsContact C-N 3.33Å; A264-V266 PolarHBondContact O-N 2.93Å; V266-V268 VanDerWaalsContact C-N 3.3Å; V266-V268 PolarHBondContact O-N 3.41Å; V266-F269 CarbonylContact O-C 3.49Å; V266-F269 WeakPolarHBondContact O-CA 3.21Å; V266-F269 VanDerWaalsContact O-CB 3.29Å; V266-F269 WeakPolarHBondContact O-CB 3.34Å; V266-F269 PolarHBondContact O-N 3.29Å; V266-L270 HydrophobicContact CG1-CD1 4.39Å; V266-L270 HydrophobicContact CG1-CD2 3.83Å; V266-L270 HydrophobicContact CG1-CG 4.11Å; V266-L270 VanDerWaalsContact O-CG 3.26Å; V266-L270 WeakPolarHBondContact O-CG 3.27Å; V266-L270 PolarHBondContact O-N 3.23Å |
| 267 | L | 81.1 | Confident | 79.4 | Confident | 85 Ų | 85 | 41.4 Ų | 41.4 | 45% | 0.445 | 21% | 0.214 | S | C | . | . | H | α-helix | trans | -57.9 | -41 | -179.7 | -71.2 | 173.8 | 0 | 0 | 0 | 112.2 | V263 A264 L270 I271 | V263-L267 HydrophobicContact CG1-CD1 3.93Å; V263-L267 HydrophobicContact CG1-CG 4.24Å; V263-L267 WeakPolarHBondContact O-CG 3.45Å; V263-L267 PolarHBondContact O-N 2.9Å; A264-L267 PolarHBondContact O-N 3.49Å; L267-L270 HydrophobicContact CD2-CD1 4.26Å; L267-L270 PolarHBondContact O-N 3.32Å; L267-I271 WeakPolarHBondContact O-CB 3.45Å; L267-I271 WeakPolarHBondContact O-CD1 3.32Å; L267-I271 WeakPolarHBondContact O-CG1 3.42Å; L267-I271 PolarHBondContact O-N 2.91Å |
| 268 | V | 84.8 | Confident | 79.9 | Confident | 22 Ų | 22 | 41.7 Ų | 41.7 | 13% | 0.133 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -63.6 | -41.1 | 171.8 | 164 | 0 | 0 | 0 | 0 | 111.3 | A264 V266 L270 F272 R304 L307 L311 | A264-V268 WeakPolarHBondContact O-CB 3.22Å; A264-V268 WeakPolarHBondContact O-CG2 3.17Å; A264-V268 PolarHBondContact O-N 3.09Å; V266-V268 VanDerWaalsContact C-N 3.3Å; V266-V268 PolarHBondContact O-N 3.41Å; V268-L270 PolarHBondContact O-N 3.33Å; V268-F272 HydrophobicContact CB-CD2 4.47Å; V268-F272 HydrophobicContact CG1-CD2 3.98Å; V268-F272 HydrophobicContact CG1-CE2 4.39Å; V268-F272 HydrophobicContact CG2-CE2 4.49Å; V268-F272 WeakPolarHBondContact O-CB 3.07Å; V268-F272 VanDerWaalsContact O-CD2 3.26Å; V268-F272 WeakPolarHBondContact O-CD2 3.13Å; V268-F272 PolarHBondContact O-N 3.33Å; V268-F272 VanDerWaalsContact O-N 3.09Å; V268-R304 HydrophobicContact CG1-CG 4.48Å; V268-L307 HydrophobicContact CG1-CB 3.87Å; V268-L307 HydrophobicContact CG1-CD1 3.58Å; V268-L307 HydrophobicContact CG1-CG 4.39Å; V268-L307 HydrophobicContact CG2-CD1 4.4Å; V268-L311 HydrophobicContact CB-CD1 4.25Å; V268-L311 HydrophobicContact CG2-CD1 3.95Å |
| 269 | F | 79.7 | Confident | 80.4 | Confident | 8 Ų | 8 | 39.9 Ų | 39.9 | 4% | 0.035 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -59.2 | -47.6 | 171.9 | -162.7 | -70.6 | 0 | 0 | 0 | 111.6 | L137 L140 F223 L265 V266 Q273 R304 | L137-F269 HydrophobicContact CD1-CE1 4.2Å; L137-F269 HydrophobicContact CD1-CZ 4.06Å; L137-F269 HydrophobicContact CD2-CD1 3.77Å; L137-F269 HydrophobicContact CD2-CE1 3.32Å; L137-F269 HydrophobicContact CD2-CE2 4.15Å; L137-F269 HydrophobicContact CD2-CG 4.39Å; L137-F269 HydrophobicContact CD2-CZ 3.57Å; L137-F269 HydrophobicContact CG-CE1 3.7Å; L137-F269 HydrophobicContact CG-CE2 4.02Å; L137-F269 HydrophobicContact CG-CZ 3.42Å; L137-F269 VanDerWaalsContact CG-CZ 3.42Å; L140-F269 HydrophobicContact CD1-CB 4.09Å; L140-F269 HydrophobicContact CD1-CD2 3.64Å; L140-F269 HydrophobicContact CD1-CG 4.08Å; F223-F269 HydrophobicContact CD2-CD1 4.23Å; F223-F269 AromaticContact CD2-CE1 3.98Å; F223-F269 HydrophobicContact CD2-CE1 3.98Å; F223-F269 HydrophobicContact CE2-CD1 4.01Å; F223-F269 HydrophobicContact CE2-CE1 4.18Å; L265-F269 PolarHBondContact O-N 3.18Å; V266-F269 CarbonylContact O-C 3.49Å; V266-F269 WeakPolarHBondContact O-CA 3.21Å; V266-F269 VanDerWaalsContact O-CB 3.29Å; V266-F269 WeakPolarHBondContact O-CB 3.34Å; V266-F269 PolarHBondContact O-N 3.29Å; F269-Q273 HydrophobicContact CD1-CB 3.87Å; F269-Q273 HydrophobicContact CD1-CG 4.4Å; F269-Q273 HydrophobicContact CE1-CB 3.51Å; F269-Q273 HydrophobicContact CE1-CG 3.54Å; F269-Q273 HydrophobicContact CZ-CB 4.04Å; F269-Q273 HydrophobicContact CZ-CG 3.79Å; F269-Q273 WeakPolarHBondContact O-CB 3.32Å; F269-Q273 PolarHBondContact O-N 3.33Å; F269-R304 VanDerWaalsContact CD2-CD 3.43Å |
| 270 | L | 79 | Confident | 80.5 | Confident | 31 Ų | 31 | 40.3 Ų | 40.3 | 16% | 0.162 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -61.3 | -55.1 | -180 | -41.8 | -174.2 | 0 | 0 | 0 | 110.7 | F223 F227 V266 L267 V268 F272 L274 | F223-L270 HydrophobicContact CE1-CD2 4.33Å; F223-L270 HydrophobicContact CE2-CD2 3.71Å; F223-L270 HydrophobicContact CZ-CB 4.42Å; F223-L270 HydrophobicContact CZ-CD2 3.34Å; F223-L270 HydrophobicContact CZ-CG 4.37Å; F227-L270 HydrophobicContact CD2-CD1 4.19Å; F227-L270 HydrophobicContact CD2-CD2 3.92Å; F227-L270 HydrophobicContact CE2-CD1 3.84Å; F227-L270 HydrophobicContact CE2-CD2 4.41Å; V266-L270 HydrophobicContact CG1-CD1 4.39Å; V266-L270 HydrophobicContact CG1-CD2 3.83Å; V266-L270 HydrophobicContact CG1-CG 4.11Å; V266-L270 VanDerWaalsContact O-CG 3.26Å; V266-L270 WeakPolarHBondContact O-CG 3.27Å; V266-L270 PolarHBondContact O-N 3.23Å; L267-L270 HydrophobicContact CD2-CD1 4.26Å; L267-L270 PolarHBondContact O-N 3.32Å; V268-L270 PolarHBondContact O-N 3.33Å; L270-F272 VanDerWaalsContact C-N 3.31Å; L270-F272 PolarHBondContact O-N 2.96Å; L270-L274 HydrophobicContact CB-CD1 4.12Å; L270-L274 WeakPolarHBondContact O-CB 3.48Å; L270-L274 WeakPolarHBondContact O-CG 3.29Å; L270-L274 PolarHBondContact O-N 3.17Å |
| 271 | I | 85.5 | Confident | 80.4 | Confident | 104 Ų | 104 | 34.9 Ų | 34.9 | 53% | 0.533 | 20% | 0.195 | S | C | . | . | H | α-helix | trans | -62.5 | -37.3 | -172.4 | -68.8 | 164.9 | 0 | 0 | 0 | 111.8 | L267 P275 | L267-I271 WeakPolarHBondContact O-CB 3.45Å; L267-I271 WeakPolarHBondContact O-CD1 3.32Å; L267-I271 WeakPolarHBondContact O-CG1 3.42Å; L267-I271 PolarHBondContact O-N 2.91Å; I271-P275 WeakPolarHBondContact O-CD 3.47Å; I271-P275 VanDerWaalsContact O-CG 3.23Å; I271-P275 WeakPolarHBondContact O-CG 3.34Å |
| 272 | F | 86.5 | Confident | 80.5 | Confident | 40 Ų | 40 | 38.2 Ų | 38.2 | 18% | 0.175 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -94.4 | -28.5 | -174.8 | -71.2 | -98.3 | 0 | 0 | 0 | 113.3 | V268 L270 L300 A301 T303 R304 L307 | V268-F272 HydrophobicContact CB-CD2 4.47Å; V268-F272 HydrophobicContact CG1-CD2 3.98Å; V268-F272 HydrophobicContact CG1-CE2 4.39Å; V268-F272 HydrophobicContact CG2-CE2 4.49Å; V268-F272 WeakPolarHBondContact O-CB 3.07Å; V268-F272 VanDerWaalsContact O-CD2 3.26Å; V268-F272 WeakPolarHBondContact O-CD2 3.13Å; V268-F272 PolarHBondContact O-N 3.33Å; V268-F272 VanDerWaalsContact O-N 3.09Å; L270-F272 VanDerWaalsContact C-N 3.31Å; L270-F272 PolarHBondContact O-N 2.96Å; F272-L300 WeakPolarHBondContact CB-O 3.31Å; F272-L300 HydrophobicContact CD1-CB 3.98Å; F272-L300 HydrophobicContact CD1-CD2 3.67Å; F272-L300 HydrophobicContact CD1-CG 4.45Å; F272-L300 WeakPolarHBondContact CD1-O 3.31Å; F272-L300 HydrophobicContact CE1-CD2 3.62Å; F272-L300 CarbonylContact O-C 3.59Å; F272-A301 VanDerWaalsContact O-CA 3.24Å; F272-A301 WeakPolarHBondContact O-CA 3.45Å; F272-A301 PolarHBondContact O-N 3.36Å; F272-A301 VanDerWaalsContact O-N 3.16Å; F272-T303 HydrophobicContact CD1-CG2 4.11Å; F272-T303 HydrophobicContact CE1-CG2 3.76Å; F272-R304 HydrophobicContact CB-CB 4.14Å; F272-L307 HydrophobicContact CD1-CD1 4.23Å; F272-L307 HydrophobicContact CD2-CD1 3.98Å; F272-L307 HydrophobicContact CE1-CD1 3.85Å; F272-L307 HydrophobicContact CE2-CD1 3.58Å; F272-L307 HydrophobicContact CG-CD1 4.29Å; F272-L307 HydrophobicContact CZ-CD1 3.51Å |
| 273 | Q | 84.2 | Confident | 80.4 | Confident | 3 Ų | 3 | 42.2 Ų | 42.2 | 1% | 0.014 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -93.3 | -41.7 | 180 | -166.3 | 74.1 | 44.1 | 0 | 0 | 113.5 | Y129 F269 Y276 T277 | Y129-Q273 PolarHBondContact OH-NE2 2.87Å; F269-Q273 HydrophobicContact CD1-CB 3.87Å; F269-Q273 HydrophobicContact CD1-CG 4.4Å; F269-Q273 HydrophobicContact CE1-CB 3.51Å; F269-Q273 HydrophobicContact CE1-CG 3.54Å; F269-Q273 HydrophobicContact CZ-CB 4.04Å; F269-Q273 HydrophobicContact CZ-CG 3.79Å; F269-Q273 WeakPolarHBondContact O-CB 3.32Å; F269-Q273 PolarHBondContact O-N 3.33Å; Q273-Y276 PolarHBondContact O-N 3.32Å; Q273-T277 PolarHBondContact O-N 3.36Å; Q273-T277 PolarHBondContact O-OG1 3.34Å |
| 274 | L | 82.2 | Confident | 80 | Confident | 63 Ų | 63 | 41.8 Ų | 41.8 | 33% | 0.33 | 22% | 0.218 | S | C | . | . | H | α-helix | trans | -57.9 | -44.2 | -175 | -80.2 | 178.2 | 0 | 0 | 0 | 114.1 | F223 L270 Y276 T277 V278 | F223-L274 HydrophobicContact CD1-CD2 4.09Å; F223-L274 HydrophobicContact CD2-CD2 4.2Å; F223-L274 HydrophobicContact CE1-CD1 4.16Å; F223-L274 HydrophobicContact CE1-CD2 3.59Å; F223-L274 HydrophobicContact CE1-CG 4.11Å; F223-L274 HydrophobicContact CE2-CD1 4.38Å; F223-L274 HydrophobicContact CE2-CD2 3.68Å; F223-L274 HydrophobicContact CE2-CG 3.73Å; F223-L274 HydrophobicContact CG-CD2 4.38Å; F223-L274 HydrophobicContact CZ-CD1 3.6Å; F223-L274 HydrophobicContact CZ-CD2 3.35Å; F223-L274 HydrophobicContact CZ-CG 3.4Å; L270-L274 HydrophobicContact CB-CD1 4.12Å; L270-L274 WeakPolarHBondContact O-CB 3.48Å; L270-L274 WeakPolarHBondContact O-CG 3.29Å; L270-L274 PolarHBondContact O-N 3.17Å; L274-Y276 PolarHBondContact O-N 2.94Å; L274-T277 PolarHBondContact O-N 3.01Å; L274-V278 WeakPolarHBondContact O-CG2 3.26Å; L274-V278 PolarHBondContact O-N 2.75Å |
| 275 | P | 85.4 | Confident | 79.4 | Confident | 43 Ų | 43 | 43.6 Ų | 43.6 | 28% | 0.279 | 23% | 0.233 | S | C | . | . | H | α-helix | trans | -57 | -39.7 | -176.9 | -27.8 | 37.6 | 0 | 0 | 0 | 112.1 | I271 V278 V279 T297 | I271-P275 WeakPolarHBondContact O-CD 3.47Å; I271-P275 VanDerWaalsContact O-CG 3.23Å; I271-P275 WeakPolarHBondContact O-CG 3.34Å; P275-V278 PolarHBondContact O-N 3.43Å; P275-V279 VanDerWaalsContact O-CG2 3.31Å; P275-V279 WeakPolarHBondContact O-CG2 3.3Å; P275-V279 PolarHBondContact O-N 2.93Å; P275-T297 HydrophobicContact CB-CG2 3.42Å; P275-T297 VanDerWaalsContact CB-CG2 3.42Å |
| 276 | Y | 83.6 | Confident | 78.7 | Confident | 38 Ų | 38 | 47 Ų | 47 | 15% | 0.149 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -68.1 | -46 | 178.5 | -176.6 | -110 | 0 | 0 | 0 | 112.1 | Y129 Q273 L274 V278 V279 L280 C298 A301 | Y129-Y276 HydrophobicContact CE1-CE1 4.08Å; Y129-Y276 AromaticContact CZ-CE1 3.76Å; Y129-Y276 WeakPolarHBondContact OH-CD1 3.44Å; Y129-Y276 WeakPolarHBondContact OH-CE1 3.45Å; Q273-Y276 PolarHBondContact O-N 3.32Å; L274-Y276 PolarHBondContact O-N 2.94Å; Y276-V278 VanDerWaalsContact C-N 3.26Å; Y276-V278 PolarHBondContact O-N 3.39Å; Y276-V279 PolarHBondContact O-N 2.93Å; Y276-L280 HydrophobicContact CE1-CD2 4.28Å; Y276-L280 VanDerWaalsContact O-CB 3.29Å; Y276-L280 WeakPolarHBondContact O-CB 3.35Å; Y276-L280 PolarHBondContact O-N 3.39Å; Y276-C298 HydrophobicContact CD2-CB 3.85Å; Y276-C298 HydrophobicContact CE2-CB 3.69Å; Y276-A301 HydrophobicContact CD1-CB 4.49Å; Y276-A301 HydrophobicContact CG-CB 4.37Å |
| 277 | T | 82 | Confident | 77.9 | Confident | 11 Ų | 11 | 53.7 Ų | 53.7 | 7% | 0.067 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -59.2 | -38.9 | 175.9 | -52.9 | 0 | 0 | 0 | 0 | 111.7 | I219 I220 Q273 L274 S281 | I219-T277 HydrophobicContact CG2-CG2 4.03Å; I220-T277 HydrophobicContact CD1-CG2 4.2Å; I220-T277 HydrophobicContact CG1-CG2 3.62Å; Q273-T277 PolarHBondContact O-N 3.36Å; Q273-T277 PolarHBondContact O-OG1 3.34Å; L274-T277 PolarHBondContact O-N 3.01Å; T277-S281 WeakPolarHBondContact O-CB 2.73Å; T277-S281 PolarHBondContact O-N 3Å; T277-S281 PolarHBondContact O-OG 3.15Å |
| 278 | V | 82 | Confident | 76.9 | Confident | 68 Ų | 68 | 51.5 Ų | 51.5 | 41% | 0.412 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -68.2 | -49.5 | 177.3 | 171.8 | 0 | 0 | 0 | 0 | 111.3 | L274 P275 Y276 L280 S281 R282 | L274-V278 WeakPolarHBondContact O-CG2 3.26Å; L274-V278 PolarHBondContact O-N 2.75Å; P275-V278 PolarHBondContact O-N 3.43Å; Y276-V278 VanDerWaalsContact C-N 3.26Å; Y276-V278 PolarHBondContact O-N 3.39Å; V278-L280 VanDerWaalsContact C-N 3.33Å; V278-L280 PolarHBondContact O-N 3.47Å; V278-S281 PolarHBondContact O-N 2.71Å; V278-S281 VanDerWaalsContact O-N 3.15Å; V278-S281 PolarHBondContact O-OG 2.95Å; V278-R282 PolarHBondContact O-N 3.37Å |
| 279 | V | 80.3 | Confident | 76.1 | Confident | 12 Ų | 12 | 54.9 Ų | 54.9 | 7% | 0.073 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -57.7 | -47.3 | 177.3 | 171.7 | 0 | 0 | 0 | 0 | 110.5 | P275 Y276 S281 R282 K283 E294 T297 | P275-V279 VanDerWaalsContact O-CG2 3.31Å; P275-V279 WeakPolarHBondContact O-CG2 3.3Å; P275-V279 PolarHBondContact O-N 2.93Å; Y276-V279 PolarHBondContact O-N 2.93Å; V279-S281 VanDerWaalsContact C-N 3.31Å; V279-S281 PolarHBondContact O-N 3.42Å; V279-R282 PolarHBondContact O-N 2.84Å; V279-K283 PolarHBondContact O-N 3.17Å; V279-E294 HydrophobicContact CG1-CB 4Å; V279-T297 HydrophobicContact CG2-CG2 4.07Å |
| 280 | L | 73.4 | Confident | 75.7 | Confident | 38 Ų | 38 | 57.6 Ų | 57.6 | 20% | 0.199 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -63.1 | -35.6 | 178.1 | -168.3 | 64.4 | 0 | 0 | 0 | 112.2 | N216 Y276 V278 I284 | N216-L280 WeakPolarHBondContact ND2-CG 3.35Å; N216-L280 WeakPolarHBondContact OD1-CD2 3.49Å; Y276-L280 HydrophobicContact CE1-CD2 4.28Å; Y276-L280 VanDerWaalsContact O-CB 3.29Å; Y276-L280 WeakPolarHBondContact O-CB 3.35Å; Y276-L280 PolarHBondContact O-N 3.39Å; V278-L280 VanDerWaalsContact C-N 3.33Å; V278-L280 PolarHBondContact O-N 3.47Å; L280-I284 HydrophobicContact CG-CD1 4.26Å; L280-I284 WeakPolarHBondContact O-CD1 3.36Å; L280-I284 WeakPolarHBondContact O-CG1 3.4Å; L280-I284 PolarHBondContact O-N 3.17Å; L280-I284 VanDerWaalsContact O-N 3.1Å |
| 281 | S | 75.1 | Confident | 75.4 | Confident | 42 Ų | 42 | 57.5 Ų | 57.5 | 29% | 0.294 | 33% | 0.329 | S | S | . | . | H | α-helix | trans | -67.5 | -38.2 | 173.9 | 69.7 | 0 | 0 | 0 | 0 | 113.4 | N216 T277 V278 V279 I284 A285 | N216-S281 PolarHBondContact ND2-N 2.81Å; T277-S281 WeakPolarHBondContact O-CB 2.73Å; T277-S281 PolarHBondContact O-N 3Å; T277-S281 PolarHBondContact O-OG 3.15Å; V278-S281 PolarHBondContact O-N 2.71Å; V278-S281 VanDerWaalsContact O-N 3.15Å; V278-S281 PolarHBondContact O-OG 2.95Å; V279-S281 VanDerWaalsContact C-N 3.31Å; V279-S281 PolarHBondContact O-N 3.42Å; S281-I284 PolarHBondContact O-N 3.45Å; S281-A285 WeakPolarHBondContact O-CB 3.32Å; S281-A285 PolarHBondContact O-N 3.11Å |
| 282 | R | 77.1 | Confident | 74.8 | Confident | 88 Ų | 88 | 55.4 Ų | 55.4 | 33% | 0.332 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -68.6 | -36.2 | 176.6 | -64.6 | -171.5 | -50.5 | -147.6 | 5.2 | 111.8 | V278 V279 A285 G286 Q287 S288 D290 | V278-R282 PolarHBondContact O-N 3.37Å; V279-R282 PolarHBondContact O-N 2.84Å; R282-A285 PolarHBondContact O-N 2.91Å; R282-G286 PolarHBondContact O-N 3.4Å; R282-Q287 PolarHBondContact O-N 3.14Å; R282-S288 VanDerWaalsContact CB-OG 3.31Å; R282-S288 WeakPolarHBondContact CB-OG 3.45Å; R282-S288 PolarHBondContact NE-OG 3.1Å; R282-D290 IonicContact NH2-OD2 2.58Å |
| 283 | K | 70.9 | Confident | 74.4 | Confident | 92 Ų | 92 | 54 Ų | 54 | 40% | 0.4 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -62 | -48.1 | 174.4 | -174.4 | 171.1 | -179.1 | 171 | 0 | 111.5 | V279 A285 G286 E294 | V279-K283 PolarHBondContact O-N 3.17Å; K283-A285 VanDerWaalsContact C-N 3.28Å; K283-A285 PolarHBondContact O-N 3.44Å; K283-G286 PolarHBondContact O-N 3.04Å; K283-G286 VanDerWaalsContact O-N 3.15Å; K283-E294 IonicContact NZ-OE1 3.55Å; K283-E294 PolarHBondContact NZ-OE1 3.19Å; K283-E294 IonicContact NZ-OE2 2.82Å; K283-E294 PolarHBondContact NZ-OE2 2.78Å |
| 284 | I | 69.2 | Low | 74.2 | Confident | 48 Ų | 48 | 55.7 Ų | 55.7 | 25% | 0.246 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -66.5 | -29.9 | 176.7 | -65.5 | 164.6 | 0 | 0 | 0 | 112.1 | K212 M213 N216 L280 S281 G286 | K212-I284 HydrophobicContact CB-CD1 3.88Å; K212-I284 HydrophobicContact CB-CG1 4.04Å; K212-I284 HydrophobicContact CB-CG2 4.12Å; M213-I284 HydrophobicContact CB-CG2 4.21Å; N216-I284 HydrophobicContact CB-CD1 4.3Å; N216-I284 WeakPolarHBondContact ND2-CD1 3.33Å; L280-I284 HydrophobicContact CG-CD1 4.26Å; L280-I284 WeakPolarHBondContact O-CD1 3.36Å; L280-I284 WeakPolarHBondContact O-CG1 3.4Å; L280-I284 PolarHBondContact O-N 3.17Å; L280-I284 VanDerWaalsContact O-N 3.1Å; S281-I284 PolarHBondContact O-N 3.45Å; I284-G286 PolarHBondContact O-N 3.11Å |
| 285 | A | 68.5 | Low | 74.1 | Confident | 64 Ų | 64 | 55.6 Ų | 55.6 | 53% | 0.529 | 32% | 0.319 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -79.6 | 6.1 | 175.2 | 0 | 0 | 0 | 0 | 0 | 114.3 | S281 R282 K283 Q287 | S281-A285 WeakPolarHBondContact O-CB 3.32Å; S281-A285 PolarHBondContact O-N 3.11Å; R282-A285 PolarHBondContact O-N 2.91Å; K283-A285 VanDerWaalsContact C-N 3.28Å; K283-A285 PolarHBondContact O-N 3.44Å; A285-Q287 HydrophobicContact CB-CG 4.47Å; A285-Q287 PolarHBondContact O-N 3.05Å; A285-Q287 VanDerWaalsContact O-N 3.14Å |
| 286 | G | 65.3 | Low | 74 | Confident | 73 Ų | 73 | 57.2 Ų | 57.2 | 75% | 0.753 | 32% | 0.324 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 64.3 | 14.4 | -178.6 | 0 | 0 | 0 | 0 | 0 | 114.7 | R282 K283 I284 | R282-G286 PolarHBondContact O-N 3.4Å; K283-G286 PolarHBondContact O-N 3.04Å; K283-G286 VanDerWaalsContact O-N 3.15Å; I284-G286 PolarHBondContact O-N 3.11Å |
| 287 | Q | 60.8 | Low | 74.1 | Confident | 154 Ų | 154 | 56 Ų | 56 | 72% | 0.72 | 32% | 0.321 | S | S | * | . | trans | -92.4 | -21.6 | -166.4 | -92.7 | -175.3 | -21.1 | 0 | 0 | 115.3 | R282 A285 | R282-Q287 PolarHBondContact O-N 3.14Å; A285-Q287 HydrophobicContact CB-CG 4.47Å; A285-Q287 PolarHBondContact O-N 3.05Å; A285-Q287 VanDerWaalsContact O-N 3.14Å | ||
| 288 | S | 59.8 | Low | 74.3 | Confident | 40 Ų | 40 | 56 Ų | 56 | 28% | 0.28 | 32% | 0.32 | S | S | . | . | trans | -159.9 | 126.9 | -175.4 | 65.3 | 0 | 0 | 0 | 0 | 113.7 | R282 | R282-S288 VanDerWaalsContact CB-OG 3.31Å; R282-S288 WeakPolarHBondContact CB-OG 3.45Å; R282-S288 PolarHBondContact NE-OG 3.1Å | ||
| 289 | C | 66.9 | Low | 74.6 | Confident | 92 Ų | 92 | 53.1 Ų | 53.1 | 62% | 0.622 | 30% | 0.303 | S | S | * | . | trans | -94.9 | 81.8 | 169.7 | 174.1 | 0 | 0 | 0 | 0 | 109.6 | C38 | C38-C289 WeakPolarHBondContact CA-SG 3.32Å; C38-C289 HydrophobicContact CB-CB 4.48Å; C38-C289 WeakPolarHBondContact CB-SG 3.44Å; C38-C289 WeakPolarHBondContact SG-CA 3.26Å; C38-C289 WeakPolarHBondContact SG-CB 3.37Å; C38-C289 CovalentContact SG-SG 2.02Å; C38-C289 PolarHBondContact SG-SG 3.29Å | ||
| 290 | D | 72.6 | Confident | 75 | Confident | 66 Ų | 66 | 55.3 Ų | 55.3 | 35% | 0.353 | 31% | 0.314 | S | S | . | . | trans | -116.7 | 78.9 | -177.9 | 176.9 | 14.8 | 0 | 0 | 0 | 110.2 | R282 G293 E294 | R282-D290 IonicContact NH2-OD2 2.58Å; D290-G293 PolarHBondContact O-N 3.21Å; D290-G293 WeakPolarHBondContact OD1-CA 3.48Å; D290-G293 PolarHBondContact OD1-N 2.92Å; D290-E294 PolarHBondContact O-N 3.44Å | ||
| 291 | L | 72.1 | Confident | 75.7 | Confident | 29 Ų | 29 | 53.5 Ų | 53.5 | 15% | 0.152 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -65.3 | -42.8 | -174.1 | -167.9 | 76.3 | 0 | 0 | 0 | 112 | C38 P40 I48 E294 Y295 | C38-L291 HydrophobicContact CB-CB 4.36Å; C38-L291 HydrophobicContact CB-CD1 4.21Å; P40-L291 HydrophobicContact CB-CD2 3.61Å; P40-L291 HydrophobicContact CG-CD2 4.16Å; I48-L291 HydrophobicContact CD1-CD2 4.49Å; L291-E294 PolarHBondContact O-N 3.47Å; L291-Y295 HydrophobicContact CD1-CD2 4.35Å; L291-Y295 HydrophobicContact CD1-CE2 3.74Å; L291-Y295 HydrophobicContact CD2-CE2 4.09Å; L291-Y295 HydrophobicContact CG-CD2 3.94Å; L291-Y295 HydrophobicContact CG-CE2 3.62Å; L291-Y295 WeakPolarHBondContact O-CD2 3.32Å; L291-Y295 PolarHBondContact O-N 2.86Å; L291-Y295 VanDerWaalsContact O-N 3.14Å |
| 292 | M | 73.8 | Confident | 76.4 | Confident | 59 Ų | 59 | 51.9 Ų | 51.9 | 29% | 0.291 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -59.4 | -46.6 | 174.1 | -96.2 | -71 | -169.3 | 0 | 0 | 111.5 | E44 I48 E294 Y295 I296 | E44-M292 HydrophobicContact CG-CE 3.97Å; E44-M292 HydrophobicContact CG-CG 4.33Å; E44-M292 WeakPolarHBondContact OE1-CG 3.18Å; I48-M292 HydrophobicContact CD1-CE 3.95Å; I48-M292 HydrophobicContact CD1-CG 3.94Å; I48-M292 HydrophobicContact CD1-SD 3.79Å; I48-M292 HydrophobicContact CG1-CE 3.5Å; I48-M292 HydrophobicContact CG1-CG 4.44Å; I48-M292 HydrophobicContact CG1-SD 3.64Å; M292-E294 PolarHBondContact O-N 3.42Å; M292-Y295 PolarHBondContact O-N 2.74Å; M292-I296 WeakPolarHBondContact O-CB 3.37Å; M292-I296 VanDerWaalsContact O-CG1 3.26Å; M292-I296 WeakPolarHBondContact O-CG1 3.28Å; M292-I296 PolarHBondContact O-N 3.17Å; M292-I296 HydrophobicContact SD-CD1 4.25Å |
| 293 | G | 77.8 | Confident | 77 | Confident | 12 Ų | 12 | 49.1 Ų | 49.1 | 12% | 0.124 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -59.8 | -41.9 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.9 | D290 T297 | D290-G293 PolarHBondContact O-N 3.21Å; D290-G293 WeakPolarHBondContact OD1-CA 3.48Å; D290-G293 PolarHBondContact OD1-N 2.92Å; G293-T297 VanDerWaalsContact O-CB 3.28Å; G293-T297 WeakPolarHBondContact O-CB 3.5Å; G293-T297 WeakPolarHBondContact O-CG2 3.44Å; G293-T297 PolarHBondContact O-N 3.16Å; G293-T297 PolarHBondContact O-OG1 3.49Å |
| 294 | E | 79.7 | Confident | 78 | Confident | 37 Ų | 37 | 44.8 Ų | 44.8 | 17% | 0.173 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -60.2 | -49.4 | 177.3 | -173.2 | 172.3 | -174.7 | 0 | 0 | 112 | V279 K283 D290 L291 M292 T297 C298 | V279-E294 HydrophobicContact CG1-CB 4Å; K283-E294 IonicContact NZ-OE1 3.55Å; K283-E294 PolarHBondContact NZ-OE1 3.19Å; K283-E294 IonicContact NZ-OE2 2.82Å; K283-E294 PolarHBondContact NZ-OE2 2.78Å; D290-E294 PolarHBondContact O-N 3.44Å; L291-E294 PolarHBondContact O-N 3.47Å; M292-E294 PolarHBondContact O-N 3.42Å; E294-T297 PolarHBondContact O-OG1 3.45Å; E294-C298 WeakPolarHBondContact O-CB 3.49Å; E294-C298 PolarHBondContact O-N 3.11Å |
| 295 | Y | 80.5 | Confident | 78.9 | Confident | 62 Ų | 62 | 42.5 Ų | 42.5 | 24% | 0.243 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -69 | -41.5 | -179.6 | -73.1 | -63 | 0 | 0 | 0 | 113.5 | I48 Q52 T111 L291 M292 T299 | I48-Y295 HydrophobicContact CD1-CD2 4.09Å; I48-Y295 HydrophobicContact CG2-CD1 4.17Å; I48-Y295 HydrophobicContact CG2-CD2 3.33Å; I48-Y295 HydrophobicContact CG2-CE2 3.81Å; I48-Y295 HydrophobicContact CG2-CG 3.51Å; Q52-Y295 VanDerWaalsContact OE1-CD1 3.24Å; Q52-Y295 PolarHBondContact OE1-O 3.27Å; T111-Y295 HydrophobicContact CG2-CE1 4.43Å; L291-Y295 HydrophobicContact CD1-CD2 4.35Å; L291-Y295 HydrophobicContact CD1-CE2 3.74Å; L291-Y295 HydrophobicContact CD2-CE2 4.09Å; L291-Y295 HydrophobicContact CG-CD2 3.94Å; L291-Y295 HydrophobicContact CG-CE2 3.62Å; L291-Y295 WeakPolarHBondContact O-CD2 3.32Å; L291-Y295 PolarHBondContact O-N 2.86Å; L291-Y295 VanDerWaalsContact O-N 3.14Å; M292-Y295 PolarHBondContact O-N 2.74Å; Y295-T299 WeakPolarHBondContact O-CB 3.22Å; Y295-T299 PolarHBondContact O-N 2.76Å; Y295-T299 PolarHBondContact O-OG1 2.83Å |
| 296 | I | 83.7 | Confident | 79.8 | Confident | 77 Ų | 77 | 40 Ų | 40 | 40% | 0.395 | 23% | 0.233 | S | C | . | . | H | α-helix | trans | -63.3 | -47.6 | 176.3 | -68.4 | 167.4 | 0 | 0 | 0 | 110.4 | M292 T299 L300 | M292-I296 WeakPolarHBondContact O-CB 3.37Å; M292-I296 VanDerWaalsContact O-CG1 3.26Å; M292-I296 WeakPolarHBondContact O-CG1 3.28Å; M292-I296 PolarHBondContact O-N 3.17Å; M292-I296 HydrophobicContact SD-CD1 4.25Å; I296-T299 WeakPolarHBondContact O-CB 3.28Å; I296-T299 PolarHBondContact O-N 2.88Å; I296-L300 HydrophobicContact CG2-CD1 4.4Å; I296-L300 WeakPolarHBondContact O-CG 3.28Å; I296-L300 PolarHBondContact O-N 2.85Å |
| 297 | T | 85.7 | Confident | 80.8 | Confident | 13 Ų | 13 | 38.4 Ų | 38.4 | 8% | 0.08 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -71 | -33.1 | -178.6 | 60 | 0 | 0 | 0 | 0 | 112.7 | P275 V279 G293 E294 L300 A301 | P275-T297 HydrophobicContact CB-CG2 3.42Å; P275-T297 VanDerWaalsContact CB-CG2 3.42Å; V279-T297 HydrophobicContact CG2-CG2 4.07Å; G293-T297 VanDerWaalsContact O-CB 3.28Å; G293-T297 WeakPolarHBondContact O-CB 3.5Å; G293-T297 WeakPolarHBondContact O-CG2 3.44Å; G293-T297 PolarHBondContact O-N 3.16Å; G293-T297 PolarHBondContact O-OG1 3.49Å; E294-T297 PolarHBondContact O-OG1 3.45Å; T297-L300 WeakPolarHBondContact O-CB 3.11Å; T297-L300 PolarHBondContact O-N 3.31Å; T297-A301 PolarHBondContact O-N 2.89Å |
| 298 | C | 85.9 | Confident | 81.8 | Confident | 9 Ų | 9 | 31.3 Ų | 31.3 | 6% | 0.061 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -59 | -49 | 169.1 | -175.2 | 0 | 0 | 0 | 0 | 111.1 | Y276 E294 L300 A301 Y302 | Y276-C298 HydrophobicContact CD2-CB 3.85Å; Y276-C298 HydrophobicContact CE2-CB 3.69Å; E294-C298 WeakPolarHBondContact O-CB 3.49Å; E294-C298 PolarHBondContact O-N 3.11Å; C298-L300 VanDerWaalsContact C-N 3.3Å; C298-L300 PolarHBondContact O-N 3.26Å; C298-A301 WeakPolarHBondContact O-CB 3.44Å; C298-A301 PolarHBondContact O-N 3.04Å; C298-A301 VanDerWaalsContact O-N 3.07Å; C298-Y302 WeakPolarHBondContact O-CD2 3.27Å; C298-Y302 PolarHBondContact O-N 3.28Å; C298-Y302 VanDerWaalsContact O-N 3.14Å |
| 299 | T | 87.4 | Confident | 82.8 | Confident | 8 Ų | 8 | 29.8 Ų | 29.8 | 5% | 0.049 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -59.2 | -39.7 | 177 | -59.8 | 0 | 0 | 0 | 0 | 112 | F51 Q52 A55 I59 Y295 I296 Y302 T303 | F51-T299 HydrophobicContact CE1-CG2 4.36Å; Q52-T299 PolarHBondContact OE1-OG1 3.37Å; A55-T299 HydrophobicContact CB-CG2 3.49Å; A55-T299 VanDerWaalsContact CB-CG2 3.49Å; I59-T299 HydrophobicContact CD1-CG2 4.22Å; Y295-T299 WeakPolarHBondContact O-CB 3.22Å; Y295-T299 PolarHBondContact O-N 2.76Å; Y295-T299 PolarHBondContact O-OG1 2.83Å; I296-T299 WeakPolarHBondContact O-CB 3.28Å; I296-T299 PolarHBondContact O-N 2.88Å; T299-Y302 PolarHBondContact O-N 2.98Å; T299-T303 PolarHBondContact O-N 2.65Å; T299-T303 PolarHBondContact O-OG1 3.29Å |
| 300 | L | 88.1 | Confident | 83.4 | Confident | 58 Ų | 58 | 28.4 Ų | 28.4 | 30% | 0.304 | 15% | 0.149 | S | C | . | . | H | α-helix | trans | -61.5 | -47.5 | 172 | -70.1 | 170.8 | 0 | 0 | 0 | 111.6 | F272 I296 T297 C298 Y302 T303 R304 | F272-L300 WeakPolarHBondContact CB-O 3.31Å; F272-L300 HydrophobicContact CD1-CB 3.98Å; F272-L300 HydrophobicContact CD1-CD2 3.67Å; F272-L300 HydrophobicContact CD1-CG 4.45Å; F272-L300 WeakPolarHBondContact CD1-O 3.31Å; F272-L300 HydrophobicContact CE1-CD2 3.62Å; F272-L300 CarbonylContact O-C 3.59Å; I296-L300 HydrophobicContact CG2-CD1 4.4Å; I296-L300 WeakPolarHBondContact O-CG 3.28Å; I296-L300 PolarHBondContact O-N 2.85Å; T297-L300 WeakPolarHBondContact O-CB 3.11Å; T297-L300 PolarHBondContact O-N 3.31Å; C298-L300 VanDerWaalsContact C-N 3.3Å; C298-L300 PolarHBondContact O-N 3.26Å; L300-Y302 VanDerWaalsContact C-N 3.26Å; L300-Y302 PolarHBondContact O-N 2.77Å; L300-T303 WeakPolarHBondContact O-CA 3.43Å; L300-T303 VanDerWaalsContact O-CB 3.32Å; L300-T303 WeakPolarHBondContact O-CB 3.38Å; L300-T303 PolarHBondContact O-N 2.82Å; L300-R304 PolarHBondContact O-N 2.89Å |
| 301 | A | 88.8 | Confident | 83.4 | Confident | 0 Ų | 0 | 26.5 Ų | 26.5 | 0% | 0 | 14% | 0.139 | C | C | . | . | H | α-helix | trans | -57.8 | -38 | -179.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | F272 Y276 T297 C298 R304 | F272-A301 VanDerWaalsContact O-CA 3.24Å; F272-A301 WeakPolarHBondContact O-CA 3.45Å; F272-A301 PolarHBondContact O-N 3.36Å; F272-A301 VanDerWaalsContact O-N 3.16Å; Y276-A301 HydrophobicContact CD1-CB 4.49Å; Y276-A301 HydrophobicContact CG-CB 4.37Å; T297-A301 PolarHBondContact O-N 2.89Å; C298-A301 WeakPolarHBondContact O-CB 3.44Å; C298-A301 PolarHBondContact O-N 3.04Å; C298-A301 VanDerWaalsContact O-N 3.07Å; A301-R304 VanDerWaalsContact O-CB 3.25Å; A301-R304 WeakPolarHBondContact O-CB 3.4Å |
| 302 | Y | 90.5 | Very high | 83.4 | Confident | 8 Ų | 8 | 25.8 Ų | 25.8 | 3% | 0.031 | 13% | 0.134 | C | C | . | . | H | α-helix | trans | -71 | -38 | 172.7 | -77.8 | -78.5 | 0 | 0 | 0 | 113.3 | F56 L100 L104 Y129 C298 T299 L300 R304 C305 | F56-Y302 AromaticContact CE1-CD2 3.69Å; F56-Y302 HydrophobicContact CE1-CD2 3.69Å; F56-Y302 HydrophobicContact CE1-CE2 4.36Å; F56-Y302 HydrophobicContact CE1-CG 4.09Å; F56-Y302 HydrophobicContact CZ-CD2 4.14Å; F56-Y302 HydrophobicContact CZ-CE2 4.4Å; L100-Y302 HydrophobicContact CD1-CD1 4.44Å; L100-Y302 HydrophobicContact CD1-CE1 3.61Å; L100-Y302 HydrophobicContact CD2-CD1 4.02Å; L100-Y302 HydrophobicContact CD2-CE1 3.91Å; L100-Y302 HydrophobicContact CG-CD1 4.05Å; L100-Y302 HydrophobicContact CG-CE1 3.71Å; L104-Y302 HydrophobicContact CD2-CD1 3.39Å; L104-Y302 HydrophobicContact CD2-CD2 4.34Å; L104-Y302 HydrophobicContact CD2-CE1 3.69Å; L104-Y302 HydrophobicContact CD2-CG 3.74Å; L104-Y302 HydrophobicContact CG-CD1 4.17Å; L104-Y302 HydrophobicContact CG-CE1 4.47Å; Y129-Y302 HydrophobicContact CD2-CE1 4.15Å; Y129-Y302 HydrophobicContact CD2-CE2 4.22Å; Y129-Y302 AromaticContact CD2-CZ 3.73Å; Y129-Y302 HydrophobicContact CE2-CE2 4.2Å; C298-Y302 WeakPolarHBondContact O-CD2 3.27Å; C298-Y302 PolarHBondContact O-N 3.28Å; C298-Y302 VanDerWaalsContact O-N 3.14Å; T299-Y302 PolarHBondContact O-N 2.98Å; L300-Y302 VanDerWaalsContact C-N 3.26Å; L300-Y302 PolarHBondContact O-N 2.77Å; Y302-R304 PolarHBondContact O-N 3.33Å; Y302-R304 VanDerWaalsContact O-N 3.13Å; Y302-C305 WeakPolarHBondContact O-CB 3.36Å; Y302-C305 PolarHBondContact O-N 2.88Å; Y302-C305 PolarHBondContact O-SG 3.42Å; Y302-C305 VanDerWaalsContact O-SG 3.39Å |
| 303 | T | 90 | Very high | 83.1 | Confident | 30 Ų | 30 | 24.7 Ų | 24.7 | 18% | 0.184 | 14% | 0.135 | C | C | . | . | H | α-helix | trans | -56 | -30.6 | 177.9 | -57.5 | 0 | 0 | 0 | 0 | 112.4 | I59 F272 T299 L300 C305 C306 L307 | I59-T303 VanDerWaalsContact CD1-OG1 3.28Å; I59-T303 WeakPolarHBondContact CD1-OG1 3.29Å; F272-T303 HydrophobicContact CD1-CG2 4.11Å; F272-T303 HydrophobicContact CE1-CG2 3.76Å; T299-T303 PolarHBondContact O-N 2.65Å; T299-T303 PolarHBondContact O-OG1 3.29Å; L300-T303 WeakPolarHBondContact O-CA 3.43Å; L300-T303 VanDerWaalsContact O-CB 3.32Å; L300-T303 WeakPolarHBondContact O-CB 3.38Å; L300-T303 PolarHBondContact O-N 2.82Å; T303-C305 PolarHBondContact O-N 2.87Å; T303-C306 PolarHBondContact O-N 2.94Å; T303-C306 VanDerWaalsContact O-N 3.13Å; T303-C306 PolarHBondContact O-SG 3.36Å; T303-L307 HydrophobicContact CG2-CD1 4.19Å; T303-L307 HydrophobicContact CG2-CG 4.34Å; T303-L307 PolarHBondContact O-N 3.38Å |
| 304 | R | 90.1 | Very high | 82.4 | Confident | 2 Ų | 2 | 29.2 Ų | 29.2 | 1% | 0.008 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -46.2 | -38.4 | 172 | -172.7 | 176.8 | 57.3 | 63 | -7.3 | 113.5 | D97 N132 V268 F269 F272 L300 A301 Y302 C306 L307 | D97-R304 IonicContact OD1-NH1 2.74Å; D97-R304 PolarHBondContact OD1-NH1 2.93Å; N132-R304 PolarHBondContact ND2-NH2 2.86Å; V268-R304 HydrophobicContact CG1-CG 4.48Å; F269-R304 VanDerWaalsContact CD2-CD 3.43Å; F272-R304 HydrophobicContact CB-CB 4.14Å; L300-R304 PolarHBondContact O-N 2.89Å; A301-R304 VanDerWaalsContact O-CB 3.25Å; A301-R304 WeakPolarHBondContact O-CB 3.4Å; Y302-R304 PolarHBondContact O-N 3.33Å; Y302-R304 VanDerWaalsContact O-N 3.13Å; R304-C306 VanDerWaalsContact C-N 3.35Å; R304-C306 PolarHBondContact O-N 3.15Å; R304-L307 PolarHBondContact O-N 2.99Å |
| 305 | C | 89.9 | Confident | 81.3 | Confident | 0 Ų | 0 | 29.2 Ų | 29.2 | 0% | 0 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -71.8 | -24.6 | -173.3 | -51 | 0 | 0 | 0 | 0 | 113.4 | N67 D97 L101 Y302 T303 | N67-C305 PolarHBondContact ND2-O 2.81Å; D97-C305 HydrophobicContact CB-CB 4.03Å; D97-C305 PolarHBondContact OD1-SG 2.67Å; L101-C305 HydrophobicContact CD1-CB 4.27Å; L101-C305 HydrophobicContact CD2-CB 4.1Å; L101-C305 HydrophobicContact CG-CB 4.1Å; Y302-C305 WeakPolarHBondContact O-CB 3.36Å; Y302-C305 PolarHBondContact O-N 2.88Å; Y302-C305 PolarHBondContact O-SG 3.42Å; Y302-C305 VanDerWaalsContact O-SG 3.39Å; T303-C305 PolarHBondContact O-N 2.87Å |
| 306 | C | 87.5 | Confident | 80.3 | Confident | 12 Ų | 12 | 27 Ų | 27 | 8% | 0.081 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -91.2 | -22.8 | 175.8 | 73.3 | 0 | 0 | 0 | 0 | 112.9 | V62 T303 R304 I310 | V62-C306 HydrophobicContact CB-CB 4.44Å; V62-C306 HydrophobicContact CG1-CB 4.15Å; T303-C306 PolarHBondContact O-N 2.94Å; T303-C306 VanDerWaalsContact O-N 3.13Å; T303-C306 PolarHBondContact O-SG 3.36Å; R304-C306 VanDerWaalsContact C-N 3.35Å; R304-C306 PolarHBondContact O-N 3.15Å; C306-I310 WeakPolarHBondContact O-CD1 3.44Å; C306-I310 WeakPolarHBondContact O-CG1 3.26Å |
| 307 | L | 84.6 | Confident | 78.9 | Confident | 38 Ų | 38 | 26.2 Ų | 26.2 | 20% | 0.199 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -72 | -28.1 | 178.9 | -66.8 | 174.2 | 0 | 0 | 0 | 113.4 | V268 F272 T303 R304 I310 L311 | V268-L307 HydrophobicContact CG1-CB 3.87Å; V268-L307 HydrophobicContact CG1-CD1 3.58Å; V268-L307 HydrophobicContact CG1-CG 4.39Å; V268-L307 HydrophobicContact CG2-CD1 4.4Å; F272-L307 HydrophobicContact CD1-CD1 4.23Å; F272-L307 HydrophobicContact CD2-CD1 3.98Å; F272-L307 HydrophobicContact CE1-CD1 3.85Å; F272-L307 HydrophobicContact CE2-CD1 3.58Å; F272-L307 HydrophobicContact CG-CD1 4.29Å; F272-L307 HydrophobicContact CZ-CD1 3.51Å; T303-L307 HydrophobicContact CG2-CD1 4.19Å; T303-L307 HydrophobicContact CG2-CG 4.34Å; T303-L307 PolarHBondContact O-N 3.38Å; R304-L307 PolarHBondContact O-N 2.99Å; L307-I310 PolarHBondContact O-N 3.11Å; L307-L311 WeakPolarHBondContact O-CG 3.18Å; L307-L311 PolarHBondContact O-N 3.44Å |
| 308 | N | 82.4 | Confident | 77.5 | Confident | 5 Ų | 5 | 34.7 Ų | 34.7 | 3% | 0.027 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -56 | -58.4 | 179 | -77.9 | -22.1 | 0 | 0 | 0 | 112.4 | D97 I310 L311 Y312 | D97-N308 PolarHBondContact OD2-ND2 3Å; N308-I310 VanDerWaalsContact C-N 3.32Å; N308-I310 PolarHBondContact O-N 3.31Å; N308-L311 PolarHBondContact O-N 3.38Å; N308-Y312 VanDerWaalsContact C-CE2 3.49Å; N308-Y312 HydrophobicContact CB-CE2 4.12Å; N308-Y312 WeakPolarHBondContact O-CD2 3.26Å; N308-Y312 VanDerWaalsContact O-CE2 3.23Å; N308-Y312 WeakPolarHBondContact O-CE2 3.42Å; N308-Y312 PolarHBondContact O-N 3Å; N308-Y312 VanDerWaalsContact O-N 3.16Å |
| 309 | P | 81.9 | Confident | 76 | Confident | 8 Ų | 8 | 35.6 Ų | 35.6 | 5% | 0.052 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -53.9 | -41.6 | 171.8 | -28.3 | 34.2 | 0 | 0 | 0 | 114.8 | G66 N67 V70 L311 Y312 A313 | G66-P309 VanDerWaalsContact C-CG 3.47Å; N67-P309 WeakPolarHBondContact OD1-CG 3.4Å; V70-P309 HydrophobicContact CG2-CB 4.17Å; V70-P309 HydrophobicContact CG2-CG 4.24Å; P309-L311 PolarHBondContact O-N 3.15Å; P309-Y312 PolarHBondContact O-N 2.82Å; P309-A313 PolarHBondContact O-N 3.38Å |
| 310 | I | 78 | Confident | 74.8 | Confident | 64 Ų | 64 | 40.5 Ų | 40.5 | 33% | 0.328 | 20% | 0.204 | S | C | . | . | H | α-helix | trans | -64 | -41.7 | -178.8 | -64.9 | 171.4 | 0 | 0 | 0 | 110.4 | V62 C306 L307 N308 A313 L314 | V62-I310 HydrophobicContact CG1-CD1 4.12Å; C306-I310 WeakPolarHBondContact O-CD1 3.44Å; C306-I310 WeakPolarHBondContact O-CG1 3.26Å; L307-I310 PolarHBondContact O-N 3.11Å; N308-I310 VanDerWaalsContact C-N 3.32Å; N308-I310 PolarHBondContact O-N 3.31Å; I310-A313 PolarHBondContact O-N 3.17Å; I310-L314 HydrophobicContact CG2-CD1 3.63Å; I310-L314 HydrophobicContact CG2-CG 4.07Å; I310-L314 WeakPolarHBondContact O-CB 3.42Å; I310-L314 WeakPolarHBondContact O-CG 3.27Å; I310-L314 PolarHBondContact O-N 3.11Å |
| 311 | L | 73.6 | Confident | 73.6 | Confident | 26 Ų | 26 | 44.7 Ų | 44.7 | 14% | 0.136 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -65 | -37.2 | 174.7 | -73.3 | 172.1 | 0 | 0 | 0 | 112.4 | A264 L265 V268 L307 N308 P309 V315 | A264-L311 HydrophobicContact CB-CD2 4.2Å; L265-L311 HydrophobicContact CD2-CB 4.2Å; L265-L311 HydrophobicContact CD2-CD1 3.75Å; L265-L311 HydrophobicContact CG-CD1 4.41Å; V268-L311 HydrophobicContact CB-CD1 4.25Å; V268-L311 HydrophobicContact CG2-CD1 3.95Å; L307-L311 WeakPolarHBondContact O-CG 3.18Å; L307-L311 PolarHBondContact O-N 3.44Å; N308-L311 PolarHBondContact O-N 3.38Å; P309-L311 PolarHBondContact O-N 3.15Å; L311-V315 HydrophobicContact CD2-CG2 4.45Å; L311-V315 WeakPolarHBondContact O-CB 3.49Å; L311-V315 WeakPolarHBondContact O-CG2 3.04Å; L311-V315 PolarHBondContact O-N 2.91Å |
| 312 | Y | 71.1 | Confident | 72.3 | Confident | 14 Ų | 14 | 45.9 Ų | 45.9 | 6% | 0.055 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -65.2 | -41.2 | 174.1 | -53.7 | -39.1 | 0 | 0 | 0 | 112 | V70 L90 L93 L261 L265 N308 P309 G316 | V70-Y312 HydrophobicContact CG2-CD2 4.32Å; L90-Y312 HydrophobicContact CD2-CD1 4.38Å; L90-Y312 HydrophobicContact CD2-CE1 3.52Å; L90-Y312 HydrophobicContact CD2-CE2 3.99Å; L90-Y312 VanDerWaalsContact CD2-OH 3.27Å; L90-Y312 WeakPolarHBondContact CD2-OH 2.92Å; L93-Y312 WeakPolarHBondContact CD2-OH 3.45Å; L261-Y312 HydrophobicContact CD2-CD1 4.15Å; L261-Y312 HydrophobicContact CD2-CE1 4.19Å; L265-Y312 HydrophobicContact CD1-CE1 3.91Å; L265-Y312 HydrophobicContact CD2-CE1 3.72Å; L265-Y312 HydrophobicContact CG-CE1 4.35Å; N308-Y312 VanDerWaalsContact C-CE2 3.49Å; N308-Y312 HydrophobicContact CB-CE2 4.12Å; N308-Y312 WeakPolarHBondContact O-CD2 3.26Å; N308-Y312 VanDerWaalsContact O-CE2 3.23Å; N308-Y312 WeakPolarHBondContact O-CE2 3.42Å; N308-Y312 PolarHBondContact O-N 3Å; N308-Y312 VanDerWaalsContact O-N 3.16Å; P309-Y312 PolarHBondContact O-N 2.82Å; Y312-G316 WeakPolarHBondContact O-CA 3.16Å; Y312-G316 PolarHBondContact O-N 2.94Å |
| 313 | A | 67.5 | Low | 71 | Confident | 36 Ų | 36 | 46.3 Ų | 46.3 | 30% | 0.298 | 23% | 0.229 | S | C | . | . | H | α-helix | trans | -65 | -59.1 | 173.4 | 0 | 0 | 0 | 0 | 0 | 111.1 | P309 I310 V315 F319 R320 | P309-A313 PolarHBondContact O-N 3.38Å; I310-A313 PolarHBondContact O-N 3.17Å; A313-V315 PolarHBondContact O-N 2.89Å; A313-F319 HydrophobicContact CB-CD1 4.45Å; A313-R320 WeakPolarHBondContact O-CD 3.44Å; A313-R320 WeakPolarHBondContact O-CG 3.49Å; A313-R320 PolarHBondContact O-NE 3.24Å |
| 314 | L | 62.8 | Low | 69.8 | Low | 106 Ų | 106 | 50.4 Ų | 50.4 | 56% | 0.555 | 25% | 0.249 | S | C | * | . | H | α-helix | trans | -64.6 | -34.6 | -174.3 | -66.1 | -178.8 | 0 | 0 | 0 | 113.1 | I310 R320 | I310-L314 HydrophobicContact CG2-CD1 3.63Å; I310-L314 HydrophobicContact CG2-CG 4.07Å; I310-L314 WeakPolarHBondContact O-CB 3.42Å; I310-L314 WeakPolarHBondContact O-CG 3.27Å; I310-L314 PolarHBondContact O-N 3.11Å; L314-R320 PolarHBondContact O-NH2 3.49Å |
| 315 | V | 57.9 | Low | 68.8 | Low | 37 Ų | 37 | 54.3 Ų | 54.3 | 22% | 0.224 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -103.1 | -23.7 | -176.1 | -164.9 | 0 | 0 | 0 | 0 | 112.8 | R257 L261 L311 A313 | R257-V315 HydrophobicContact CG-CG1 4.47Å; R257-V315 VanDerWaalsContact CZ-O 3.27Å; R257-V315 PolarHBondContact NE-O 3.48Å; R257-V315 PolarHBondContact NH2-O 3.33Å; L261-V315 HydrophobicContact CB-CB 4.12Å; L261-V315 HydrophobicContact CB-CG1 3.61Å; L261-V315 HydrophobicContact CD1-CB 3.74Å; L261-V315 HydrophobicContact CD1-CG1 3.97Å; L261-V315 HydrophobicContact CG-CB 3.84Å; L261-V315 HydrophobicContact CG-CG1 3.93Å; L311-V315 HydrophobicContact CD2-CG2 4.45Å; L311-V315 WeakPolarHBondContact O-CB 3.49Å; L311-V315 WeakPolarHBondContact O-CG2 3.04Å; L311-V315 PolarHBondContact O-N 2.91Å; A313-V315 PolarHBondContact O-N 2.89Å |
| 316 | G | 58 | Low | 67.6 | Low | 16 Ų | 16 | 55.9 Ų | 55.9 | 17% | 0.165 | 28% | 0.276 | C | S | . | . | trans | -101 | 99.6 | -175.9 | 0 | 0 | 0 | 0 | 0 | 116.3 | Y312 R318 F319 R320 | Y312-G316 WeakPolarHBondContact O-CA 3.16Å; Y312-G316 PolarHBondContact O-N 2.94Å; G316-R318 VanDerWaalsContact C-N 3.25Å; G316-R318 PolarHBondContact O-N 2.9Å; G316-R318 VanDerWaalsContact O-N 3.17Å; G316-F319 PolarHBondContact O-N 3.33Å; G316-F319 VanDerWaalsContact O-N 3.12Å; G316-R320 PolarHBondContact O-N 2.97Å | ||
| 317 | V | 55.5 | Low | 66.6 | Low | 61 Ų | 61 | 61.5 Ų | 61.5 | 37% | 0.37 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -55.8 | -36.2 | 176.9 | -173.2 | 0 | 0 | 0 | 0 | 113.3 | K321 | V317-K321 WeakPolarHBondContact O-CG 3.36Å; V317-K321 PolarHBondContact O-N 3.27Å |
| 318 | R | 56.2 | Low | 65.7 | Low | 190 Ų | 190 | 65.7 Ų | 65.7 | 72% | 0.717 | 32% | 0.321 | S | S | * | . | H | α-helix | trans | -68.9 | -41.9 | 179.5 | -63.4 | -175.3 | -164.2 | 171.1 | 6.3 | 111.8 | G316 K321 D322 | G316-R318 VanDerWaalsContact C-N 3.25Å; G316-R318 PolarHBondContact O-N 2.9Å; G316-R318 VanDerWaalsContact O-N 3.17Å; R318-K321 PolarHBondContact O-N 2.91Å; R318-D322 VanDerWaalsContact O-CG 3.31Å; R318-D322 PolarHBondContact O-N 2.96Å |
| 319 | F | 54.4 | Low | 64.9 | Low | 28 Ų | 28 | 68.8 Ų | 68.8 | 12% | 0.123 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -65.7 | -42.1 | 176.4 | -172.2 | -105.2 | 0 | 0 | 0 | 111 | V70 T73 A313 G316 K321 D322 V323 | V70-F319 HydrophobicContact CB-CZ 4.38Å; V70-F319 HydrophobicContact CG2-CE1 4.39Å; V70-F319 HydrophobicContact CG2-CE2 4.07Å; V70-F319 HydrophobicContact CG2-CZ 3.56Å; T73-F319 HydrophobicContact CG2-CE2 4.3Å; A313-F319 HydrophobicContact CB-CD1 4.45Å; G316-F319 PolarHBondContact O-N 3.33Å; G316-F319 VanDerWaalsContact O-N 3.12Å; F319-K321 VanDerWaalsContact C-N 3.31Å; F319-K321 PolarHBondContact O-N 3.14Å; F319-D322 PolarHBondContact O-N 3.5Å; F319-V323 HydrophobicContact CD1-CG2 4.02Å; F319-V323 HydrophobicContact CD2-CG2 4.4Å; F319-V323 HydrophobicContact CE1-CG2 3.61Å; F319-V323 HydrophobicContact CE2-CG2 4.02Å; F319-V323 HydrophobicContact CG-CG2 4.39Å; F319-V323 HydrophobicContact CZ-CG2 3.6Å; F319-V323 WeakPolarHBondContact O-CB 3.42Å; F319-V323 WeakPolarHBondContact O-CG2 3.44Å; F319-V323 PolarHBondContact O-N 3.46Å |
| 320 | R | 62.8 | Low | 63.8 | Low | 112 Ų | 112 | 72.9 Ų | 72.9 | 42% | 0.423 | 37% | 0.366 | S | S | . | . | H | α-helix | trans | -55.7 | -43.8 | 170.8 | -62.1 | -164.5 | -156.8 | -170.9 | 5.2 | 112.7 | A313 L314 G316 V323 L324 | A313-R320 WeakPolarHBondContact O-CD 3.44Å; A313-R320 WeakPolarHBondContact O-CG 3.49Å; A313-R320 PolarHBondContact O-NE 3.24Å; L314-R320 PolarHBondContact O-NH2 3.49Å; G316-R320 PolarHBondContact O-N 2.97Å; R320-V323 PolarHBondContact O-N 2.99Å; R320-L324 HydrophobicContact CB-CD1 4.38Å; R320-L324 WeakPolarHBondContact O-CB 3.35Å; R320-L324 WeakPolarHBondContact O-CD1 3.35Å; R320-L324 PolarHBondContact O-N 2.88Å |
| 321 | K | 61.3 | Low | 62.8 | Low | 146 Ų | 146 | 72.6 Ų | 72.6 | 64% | 0.635 | 38% | 0.379 | S | S | * | . | H | α-helix | trans | -65.7 | -45.8 | 178.7 | -75.3 | -172.9 | 175.9 | -163.4 | 0 | 111.9 | V317 R318 F319 V323 Q325 | V317-K321 WeakPolarHBondContact O-CG 3.36Å; V317-K321 PolarHBondContact O-N 3.27Å; R318-K321 PolarHBondContact O-N 2.91Å; F319-K321 VanDerWaalsContact C-N 3.31Å; F319-K321 PolarHBondContact O-N 3.14Å; K321-V323 VanDerWaalsContact C-N 3.31Å; K321-V323 PolarHBondContact O-N 3.3Å; K321-Q325 VanDerWaalsContact O-CB 3.24Å; K321-Q325 WeakPolarHBondContact O-CB 3.26Å; K321-Q325 PolarHBondContact O-N 2.99Å |
| 322 | D | 62 | Low | 61.6 | Low | 25 Ų | 25 | 74.2 Ų | 74.2 | 13% | 0.134 | 39% | 0.392 | C | S | . | . | H | α-helix | trans | -60.6 | -40.7 | 176.4 | -65.4 | -8.3 | 0 | 0 | 0 | 111.1 | T73 Y77 R78 R318 F319 L326 | T73-D322 HydrophobicContact CG2-CB 3.76Å; Y77-D322 HydrophobicContact CD1-CB 4.07Å; Y77-D322 HydrophobicContact CE1-CB 4.28Å; Y77-D322 WeakPolarHBondContact CE1-OD1 3.31Å; R78-D322 IonicContact CZ-OD2 3.9Å; R78-D322 IonicContact NE-OD2 2.69Å; R78-D322 PolarHBondContact NE-OD2 3.42Å; R78-D322 IonicContact NH2-OD2 2.9Å; R78-D322 PolarHBondContact NH2-OD2 3.14Å; R318-D322 VanDerWaalsContact O-CG 3.31Å; R318-D322 PolarHBondContact O-N 2.96Å; F319-D322 PolarHBondContact O-N 3.5Å; D322-L326 PolarHBondContact O-N 3.29Å; D322-L326 VanDerWaalsContact O-N 3.08Å |
| 323 | V | 63 | Low | 60.7 | Low | 16 Ų | 16 | 78.8 Ų | 78.8 | 10% | 0.097 | 42% | 0.423 | C | S | . | . | H | α-helix | trans | -72.6 | -46.9 | 178.4 | 166.7 | 0 | 0 | 0 | 0 | 113.3 | L69 F319 R320 K321 Q325 L326 M327 | L69-V323 HydrophobicContact CD1-CG1 4.43Å; L69-V323 HydrophobicContact CD1-CG2 4.48Å; L69-V323 HydrophobicContact CD2-CG1 3.89Å; L69-V323 HydrophobicContact CD2-CG2 4.09Å; L69-V323 HydrophobicContact CG-CG2 4.18Å; F319-V323 HydrophobicContact CD1-CG2 4.02Å; F319-V323 HydrophobicContact CD2-CG2 4.4Å; F319-V323 HydrophobicContact CE1-CG2 3.61Å; F319-V323 HydrophobicContact CE2-CG2 4.02Å; F319-V323 HydrophobicContact CG-CG2 4.39Å; F319-V323 HydrophobicContact CZ-CG2 3.6Å; F319-V323 WeakPolarHBondContact O-CB 3.42Å; F319-V323 WeakPolarHBondContact O-CG2 3.44Å; F319-V323 PolarHBondContact O-N 3.46Å; R320-V323 PolarHBondContact O-N 2.99Å; K321-V323 VanDerWaalsContact C-N 3.31Å; K321-V323 PolarHBondContact O-N 3.3Å; V323-Q325 PolarHBondContact O-N 2.02Å; V323-L326 WeakPolarHBondContact O-CB 3.39Å; V323-L326 PolarHBondContact O-N 2.58Å; V323-L326 VanDerWaalsContact O-N 3.16Å; V323-M327 HydrophobicContact CG1-SD 4.28Å; V323-M327 WeakPolarHBondContact O-CG 3.25Å; V323-M327 PolarHBondContact O-N 3.39Å |
| 324 | L | 65.8 | Low | 59.8 | Low | 117 Ų | 117 | 82.9 Ų | 82.9 | 61% | 0.613 | 45% | 0.448 | S | S | * | . | H | α-helix | trans | -61.5 | -36.3 | 176.2 | -96.2 | 92.5 | 0 | 0 | 0 | 110.9 | R320 M327 H328 | R320-L324 HydrophobicContact CB-CD1 4.38Å; R320-L324 WeakPolarHBondContact O-CB 3.35Å; R320-L324 WeakPolarHBondContact O-CD1 3.35Å; R320-L324 PolarHBondContact O-N 2.88Å; L324-M327 PolarHBondContact O-N 3.01Å; L324-H328 VanDerWaalsContact O-CB 3.27Å; L324-H328 WeakPolarHBondContact O-CB 3.47Å; L324-H328 PolarHBondContact O-N 3.41Å |
| 325 | Q | 67.9 | Low | 59 | Low | 84 Ų | 84 | 87.2 Ų | 87.2 | 39% | 0.393 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -67.4 | -39.3 | 176 | -172.8 | 148.4 | 6 | 0 | 0 | 111.7 | Y77 K321 V323 H328 D329 | Y77-Q325 HydrophobicContact CE2-CG 4.1Å; Y77-Q325 PolarHBondContact OH-OE1 2.74Å; K321-Q325 VanDerWaalsContact O-CB 3.24Å; K321-Q325 WeakPolarHBondContact O-CB 3.26Å; K321-Q325 PolarHBondContact O-N 2.99Å; V323-Q325 PolarHBondContact O-N 2.02Å; Q325-H328 PolarHBondContact O-N 2.86Å; Q325-D329 VanDerWaalsContact O-CB 3.3Å; Q325-D329 WeakPolarHBondContact O-CB 3.2Å; Q325-D329 VanDerWaalsContact O-CG 3.29Å; Q325-D329 PolarHBondContact O-N 3.36Å |
| 326 | L | 65.3 | Low | 58.2 | Low | 32 Ų | 32 | 92.9 Ų | 92.9 | 17% | 0.168 | 49% | 0.485 | C | S | . | . | H | α-helix | trans | -60.6 | -46.4 | 171.1 | -177.5 | 63.9 | 0 | 0 | 0 | 112 | L69 L76 D322 V323 H328 S330 | L69-L326 HydrophobicContact CD1-CD2 3.85Å; L76-L326 HydrophobicContact CD1-CD1 4.24Å; D322-L326 PolarHBondContact O-N 3.29Å; D322-L326 VanDerWaalsContact O-N 3.08Å; V323-L326 WeakPolarHBondContact O-CB 3.39Å; V323-L326 PolarHBondContact O-N 2.58Å; V323-L326 VanDerWaalsContact O-N 3.16Å; L326-H328 PolarHBondContact O-N 3.47Å; L326-S330 VanDerWaalsContact O-CB 3.3Å; L326-S330 WeakPolarHBondContact O-CB 3.17Å; L326-S330 PolarHBondContact O-N 3.07Å; L326-S330 PolarHBondContact O-OG 2.6Å |
| 327 | M | 66.6 | Low | 57.4 | Low | 130 Ų | 130 | 100.3 Ų | 100.3 | 64% | 0.64 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -62.3 | -41.6 | 177 | -68.4 | 178.7 | 69.7 | 0 | 0 | 112.6 | V323 L324 G331 | V323-M327 HydrophobicContact CG1-SD 4.28Å; V323-M327 WeakPolarHBondContact O-CG 3.25Å; V323-M327 PolarHBondContact O-N 3.39Å; L324-M327 PolarHBondContact O-N 3.01Å; M327-G331 PolarHBondContact O-N 2.9Å |
| 328 | H | 66.6 | Low | 56.7 | Low | 127 Ų | 127 | 104.7 Ų | 104.7 | 59% | 0.588 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -68.1 | -45.3 | 178.2 | -178.2 | -80.4 | 0 | 0 | 0 | 112.4 | L324 Q325 L326 S330 G331 C332 | L324-H328 VanDerWaalsContact O-CB 3.27Å; L324-H328 WeakPolarHBondContact O-CB 3.47Å; L324-H328 PolarHBondContact O-N 3.41Å; Q325-H328 PolarHBondContact O-N 2.86Å; L326-H328 PolarHBondContact O-N 3.47Å; H328-S330 VanDerWaalsContact C-N 3.26Å; H328-S330 PolarHBondContact O-N 3.15Å; H328-G331 PolarHBondContact O-N 3.22Å; H328-G331 VanDerWaalsContact O-N 3.12Å; H328-C332 PolarHBondContact O-N 3.03Å |
| 329 | D | 64.2 | Low | 55.9 | Low | 70 Ų | 70 | 104.5 Ų | 104.5 | 37% | 0.374 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -69.7 | -25.9 | 178.9 | -69.9 | -15.5 | 0 | 0 | 0 | 111.6 | Q325 G331 | Q325-D329 VanDerWaalsContact O-CB 3.3Å; Q325-D329 WeakPolarHBondContact O-CB 3.2Å; Q325-D329 VanDerWaalsContact O-CG 3.29Å; Q325-D329 PolarHBondContact O-N 3.36Å; D329-G331 VanDerWaalsContact C-N 3.33Å |
| 330 | S | 60.2 | Low | 55 | Low | 93 Ų | 93 | 110.5 Ų | 110.5 | 65% | 0.65 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -73.8 | -22 | 171.8 | -54.9 | 0 | 0 | 0 | 0 | 113.2 | L326 H328 | L326-S330 VanDerWaalsContact O-CB 3.3Å; L326-S330 WeakPolarHBondContact O-CB 3.17Å; L326-S330 PolarHBondContact O-N 3.07Å; L326-S330 PolarHBondContact O-OG 2.6Å; H328-S330 VanDerWaalsContact C-N 3.26Å; H328-S330 PolarHBondContact O-N 3.15Å |
| 331 | G | 55.4 | Low | 53.7 | Low | 58 Ų | 58 | 113.8 Ų | 113.8 | 60% | 0.598 | 59% | 0.593 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87.9 | -8.5 | 175.7 | 0 | 0 | 0 | 0 | 0 | 114.9 | M327 H328 D329 P333 | M327-G331 PolarHBondContact O-N 2.9Å; H328-G331 PolarHBondContact O-N 3.22Å; H328-G331 VanDerWaalsContact O-N 3.12Å; D329-G331 VanDerWaalsContact C-N 3.33Å; G331-P333 WeakPolarHBondContact O-CD 3.41Å |
| 332 | C | 49 | Very low | 52.4 | Low | 61 Ų | 61 | 111.8 Ų | 111.8 | 41% | 0.412 | 60% | 0.597 | S | S | . | * | trans | -120.5 | 81.9 | -176 | -76.9 | 0 | 0 | 0 | 0 | 112.3 | H328 C334 R335 | H328-C332 PolarHBondContact O-N 3.03Å; C332-C334 PolarHBondContact O-N 3.39Å; C332-R335 PolarHBondContact O-N 3.13Å | ||
| 333 | P | 52.7 | Low | 51.2 | Low | 110 Ų | 110 | 116.3 Ų | 116.3 | 71% | 0.714 | 63% | 0.626 | S | S | * | * | G | 310 helix | trans | -60.2 | -23.2 | -175.2 | 22 | -32.7 | 0 | 0 | 0 | 114.5 | G331 R335 | G331-P333 WeakPolarHBondContact O-CD 3.41Å; P333-R335 PolarHBondContact O-N 3.06Å; P333-R335 VanDerWaalsContact O-N 3.15Å |
| 334 | C | 47.4 | Very low | 49.7 | Very low | 121 Ų | 121 | 124.3 Ų | 124.3 | 82% | 0.818 | 66% | 0.662 | S | S | * | * | G | 310 helix | trans | -67.8 | -11.9 | -175.9 | -57.9 | 0 | 0 | 0 | 0 | 115.5 | C332 | C332-C334 PolarHBondContact O-N 3.39Š|
| 335 | R | 46.4 | Very low | 48.2 | Very low | 198 Ų | 198 | 124.3 Ų | 124.3 | 75% | 0.747 | 67% | 0.672 | S | S | * | * | G | 310 helix | trans | -98.6 | -11.4 | -172.6 | -133 | 177.3 | -170.2 | -126.8 | -0.7 | 115.7 | C332 P333 | C332-R335 PolarHBondContact O-N 3.13Å; P333-R335 PolarHBondContact O-N 3.06Å; P333-R335 VanDerWaalsContact O-N 3.15Å |
| 336 | L | 41.5 | Very low | 46.4 | Very low | 156 Ų | 156 | 127.5 Ų | 127.5 | 82% | 0.817 | 70% | 0.697 | S | S | * | * | S | Bend | trans | -77.9 | -32.7 | -175.8 | -161.4 | 66.9 | 0 | 0 | 0 | 112.9 | ||
| 337 | Q | 41.1 | Very low | 44.9 | Very low | 171 Ų | 171 | 131.8 Ų | 131.8 | 80% | 0.799 | 73% | 0.73 | S | S | * | * | S | Bend | trans | -79.4 | -34.6 | -178.4 | -71.6 | -168.9 | -21.1 | 0 | 0 | 114.1 | K339 L340 | Q337-K339 PolarHBondContact O-N 3.06Å; Q337-L340 PolarHBondContact O-N 3.44Å |
| 338 | L | 40.3 | Very low | 43.4 | Very low | 154 Ų | 154 | 133.7 Ų | 133.7 | 81% | 0.806 | 74% | 0.741 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -65.6 | -14.6 | -172.8 | -148.9 | 90 | 0 | 0 | 0 | 114.3 | ||
| 339 | K | 39.1 | Very low | 41.6 | Very low | 185 Ų | 185 | 133.4 Ų | 133.4 | 80% | 0.804 | 75% | 0.753 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -100.7 | -5.7 | -176.9 | -145 | 170.9 | -171.4 | 172.5 | 0 | 114.5 | Q337 | Q337-K339 PolarHBondContact O-N 3.06Š|
| 340 | L | 36.8 | Very low | 40.3 | Very low | 155 Ų | 155 | 134.5 Ų | 134.5 | 81% | 0.812 | 77% | 0.772 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86 | -25.1 | 179.4 | -164.1 | 63.2 | 0 | 0 | 0 | 112.5 | Q337 | Q337-L340 PolarHBondContact O-N 3.44Š|
| 341 | H | 34.1 | Very low | 38.9 | Very low | 180 Ų | 180 | 135.8 Ų | 135.8 | 83% | 0.833 | 78% | 0.781 | S | S | * | * | S | Bend | trans | -94.8 | -7.2 | -169.1 | -132.9 | -51.3 | 0 | 0 | 0 | 116.1 | ||
| 342 | S | 34.2 | Very low | 37.8 | Very low | 104 Ų | 104 | 138.6 Ų | 138.6 | 73% | 0.727 | 79% | 0.791 | S | S | * | * | S | Bend | trans | -91.8 | 8.3 | -172.6 | -173.6 | 0 | 0 | 0 | 0 | 114.9 | ||
| 343 | V | 36.9 | Very low | 37.6 | Very low | 120 Ų | 120 | 142 Ų | 142 | 73% | 0.727 | 81% | 0.813 | S | S | * | * | S | Bend | trans | -127.5 | 57.2 | -176 | -164.9 | 0 | 0 | 0 | 0 | 111.2 | ||
| 344 | H | 33.3 | Very low | 36.7 | Very low | 184 Ų | 184 | 141.1 Ų | 141.1 | 85% | 0.852 | 82% | 0.815 | S | S | * | * | S | Bend | trans | -157.3 | 77.8 | 159.6 | -110 | -75.9 | 0 | 0 | 0 | 110.1 | ||
| 345 | S | 32.7 | Very low | 35.9 | Very low | 118 Ų | 118 | 143.2 Ų | 143.2 | 83% | 0.825 | 82% | 0.817 | S | S | * | * | trans | -175.4 | 85.1 | 160.2 | -83.2 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 346 | T | 31.6 | Very low | 35.1 | Very low | 150 Ų | 150 | 139.4 Ų | 139.4 | 92% | 0.92 | 82% | 0.816 | S | S | * | * | trans | -144.1 | 87.6 | 163.4 | 19.3 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 347 | S | 32 | Very low | 34.7 | Very low | 123 Ų | 123 | 137.8 Ų | 137.8 | 86% | 0.86 | 81% | 0.812 | S | S | * | * | trans | -114.8 | 133.9 | 160.1 | 51 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 348 | I | 36.8 | Very low | 34.1 | Very low | 170 Ų | 170 | 137.6 Ų | 137.6 | 87% | 0.872 | 82% | 0.816 | S | S | * | * | trans | -90.4 | 140.2 | -172.2 | -63.7 | 159.2 | 0 | 0 | 0 | 109.3 | ||||
| 349 | S | 27.9 | Very low | 33.6 | Very low | 120 Ų | 120 | 134.8 Ų | 134.8 | 84% | 0.839 | 81% | 0.809 | S | S | * | * | trans | -158.9 | 156.8 | 137.3 | -154.1 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 350 | A | 37 | Very low | 33.1 | Very low | 93 Ų | 93 | 132.2 Ų | 132.2 | 77% | 0.769 | 81% | 0.808 | S | S | * | * | trans | -134.4 | 124.9 | -175.8 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 351 | S | 31.2 | Very low | 32.7 | Very low | 121 Ų | 121 | 131.1 Ų | 131.1 | 85% | 0.846 | 81% | 0.808 | S | S | * | * | trans | -164.9 | 125.7 | 163.7 | 53.7 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 352 | S | 31.3 | Very low | 32.4 | Very low | 117 Ų | 117 | 127.8 Ų | 127.8 | 82% | 0.818 | 81% | 0.805 | S | S | * | * | trans | -65 | 175.1 | 174.2 | -56.6 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 353 | P | 44.3 | Very low | 32.6 | Very low | 132 Ų | 132 | 128.2 Ų | 128.2 | 86% | 0.857 | 81% | 0.805 | S | S | * | * | cis | -138 | -164.2 | 18 | 41.1 | -19.2 | 0 | 0 | 0 | 116.8 | ||||
| 354 | A | 35.2 | Very low | 32.2 | Very low | 92 Ų | 92 | 128.8 Ų | 128.8 | 76% | 0.76 | 81% | 0.809 | S | S | * | * | trans | -83.9 | 160 | -161 | 0 | 0 | 0 | 0 | 0 | 116.7 | ||||
| 355 | L | 29.3 | Very low | 32 | Very low | 165 Ų | 165 | 124.7 Ų | 124.7 | 86% | 0.864 | 80% | 0.801 | S | S | * | * | trans | -153.7 | 115.7 | 156.3 | -125.6 | 136.2 | 0 | 0 | 0 | 114.5 | ||||
| 356 | T | 30.2 | Very low | 32.4 | Very low | 117 Ų | 117 | 124.3 Ų | 124.3 | 72% | 0.718 | 80% | 0.796 | S | S | * | * | trans | 12.1 | 123.8 | 142 | -40 | 0 | 0 | 0 | 0 | 121.5 | ||||
| 357 | V | 34.1 | Very low | 32.2 | Very low | 123 Ų | 123 | 123.8 Ų | 123.8 | 75% | 0.745 | 79% | 0.787 | S | S | * | * | trans | 36.6 | 123.6 | 139.3 | -174.8 | 0 | 0 | 0 | 0 | 120.2 | ||||
| 358 | L | 27.8 | Very low | 32 | Very low | 167 Ų | 167 | 130 Ų | 130 | 87% | 0.874 | 79% | 0.792 | S | S | * | * | -160.9 | 141.2 | 127.2 | -112.5 | 153.5 | 0 | 0 | 0 | 113.5 | |||||
| 359 | S | 30 | Very low | 31.5 | Very low | 95 Ų | 95 | 127.2 Ų | 127.2 | 66% | 0.664 | 79% | 0.788 | S | S | * | * | trans | -106.2 | 129.8 | -178.6 | 53.2 | 0 | 0 | 0 | 0 | 112 | ||||
| 360 | V | 27.8 | Very low | 31.4 | Very low | 131 Ų | 131 | 127.7 Ų | 127.7 | 79% | 0.794 | 79% | 0.789 | S | S | * | * | trans | -147 | 99.1 | 163.8 | -174 | 0 | 0 | 0 | 0 | 106.3 | ||||
| 361 | V | 28.8 | Very low | 31 | Very low | 131 Ų | 131 | 128.1 Ų | 128.1 | 79% | 0.794 | 79% | 0.787 | S | S | * | * | 64.4 | 108.2 | 88.2 | 178 | 0 | 0 | 0 | 0 | 113.5 | |||||
| 362 | S | 27.9 | Very low | 30.9 | Very low | 110 Ų | 110 | 126.3 Ų | 126.3 | 77% | 0.769 | 77% | 0.774 | S | S | * | * | trans | -71 | 157.1 | 164.9 | -39.8 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 363 | P | 39 | Very low | 30.9 | Very low | 114 Ų | 114 | 131 Ų | 131 | 74% | 0.74 | 77% | 0.774 | S | S | * | * | -141.3 | -178.6 | 85.7 | 40.7 | -25.4 | 0 | 0 | 0 | 111.7 | |||||
| 364 | T | 28 | Very low | 30.2 | Very low | 132 Ų | 132 | 131.5 Ų | 131.5 | 81% | 0.81 | 77% | 0.769 | S | S | * | * | cis | -155.6 | 151.3 | 18.5 | -8.7 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 365 | S | 28.8 | Very low | 29.8 | Very low | 97 Ų | 97 | 130.4 Ų | 130.4 | 68% | 0.678 | 77% | 0.767 | S | S | * | * | trans | -85.9 | 174.7 | 160.2 | 62.4 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 366 | P | 42.2 | Very low | 29.8 | Very low | 111 Ų | 111 | 130.9 Ų | 130.9 | 72% | 0.721 | 77% | 0.77 | S | S | * | * | -139.5 | 149 | 77.8 | 29.8 | -9.9 | 0 | 0 | 0 | 116.7 | |||||
| 367 | D | 26.6 | Very low | 29.7 | Very low | 139 Ų | 139 | 131.6 Ų | 131.6 | 74% | 0.743 | 77% | 0.774 | S | S | * | * | trans | 48.8 | 117.7 | 140.1 | -52.6 | -26.9 | 0 | 0 | 0 | 122.4 | ||||
| 368 | R | 28.6 | Very low | 29.4 | Very low | 254 Ų | 254 | 130.8 Ų | 130.8 | 96% | 0.958 | 77% | 0.774 | S | S | * | * | -145.4 | 118.3 | 105.9 | -110.3 | 176 | -169.1 | -167.7 | 2.9 | 112.4 | |||||
| 369 | S | 26.2 | Very low | 29.4 | Very low | 111 Ų | 111 | 130.1 Ų | 130.1 | 78% | 0.776 | 77% | 0.771 | S | S | * | * | trans | -75.4 | 143.9 | 175.7 | 53.6 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 370 | C | 25.7 | Very low | 29.4 | Very low | 130 Ų | 130 | 135 Ų | 135 | 88% | 0.878 | 78% | 0.78 | S | S | * | * | trans | -150.2 | 113.9 | 132.2 | -144.7 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 371 | S | 27.4 | Very low | 29.4 | Very low | 101 Ų | 101 | 138.2 Ų | 138.2 | 71% | 0.706 | 78% | 0.783 | S | S | * | * | trans | -71.6 | 170.3 | 165.3 | -142.4 | 0 | 0 | 0 | 0 | 109 | ||||
| 372 | S | 29.7 | Very low | 29.6 | Very low | 84 Ų | 84 | 140.5 Ų | 140.5 | 59% | 0.587 | 79% | 0.786 | S | S | * | * | cis | -166.3 | 151.7 | 25.3 | -125.4 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 373 | R | 31 | Very low | 29.7 | Very low | 214 Ų | 214 | 144.2 Ų | 144.2 | 81% | 0.808 | 79% | 0.788 | S | S | * | * | 43.4 | 146 | 127.6 | -63.5 | -172.9 | 165.3 | 160.7 | -2.6 | 120.9 | |||||
| 374 | D | 30.1 | Very low | 30.1 | Very low | 143 Ų | 143 | 144.2 Ų | 144.2 | 77% | 0.765 | 79% | 0.788 | S | S | * | * | cis | -165.4 | 169.8 | -9 | -94.3 | -27.9 | 0 | 0 | 0 | 106.2 | ||||
| 375 | G | 27.7 | Very low | 30.5 | Very low | 70 Ų | 70 | 147.5 Ų | 147.5 | 72% | 0.722 | 81% | 0.808 | S | S | * | * | cis | 142.1 | 107.3 | -1.2 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 376 | L | 27.6 | Very low | 30.6 | Very low | 175 Ų | 175 | 150 Ų | 150 | 92% | 0.916 | 82% | 0.815 | S | S | * | * | trans | -140.9 | 126.8 | 174.6 | -166.8 | 68.2 | 0 | 0 | 0 | 113 | ||||
| 377 | T | 28.6 | Very low | 30 | Very low | 131 Ų | 131 | 152.1 Ų | 152.1 | 80% | 0.804 | 82% | 0.819 | S | S | * | * | trans | -84.2 | 137.5 | 174.9 | 46.6 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 378 | S | 27.1 | Very low | 30.1 | Very low | 106 Ų | 106 | 152.8 Ų | 152.8 | 74% | 0.741 | 82% | 0.824 | S | S | * | * | trans | -178.4 | 115.2 | 135.8 | -170.9 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 379 | L | 29.7 | Very low | 30.2 | Very low | 154 Ų | 154 | 146.8 Ų | 146.8 | 81% | 0.806 | 82% | 0.816 | S | S | * | * | 166.4 | 113.7 | 113.2 | -103.3 | 128.6 | 0 | 0 | 0 | 111.1 | |||||
| 380 | K | 28.6 | Very low | 30.5 | Very low | 197 Ų | 197 | 149.1 Ų | 149.1 | 86% | 0.857 | 82% | 0.818 | S | S | * | * | trans | -71.9 | 142.8 | 162.1 | -94.5 | 176.7 | 169.3 | 177.6 | 0 | 109.5 | ||||
| 381 | F | 29.2 | Very low | 30.8 | Very low | 198 Ų | 198 | 150.3 Ų | 150.3 | 87% | 0.868 | 81% | 0.814 | S | S | * | * | trans | -159.5 | 132.1 | 135 | -104.1 | -70.4 | 0 | 0 | 0 | 109.8 | ||||
| 382 | Q | 31.1 | Very low | 31.1 | Very low | 180 Ų | 180 | 153.9 Ų | 153.9 | 84% | 0.841 | 82% | 0.822 | S | S | * | * | trans | -151.6 | 131.6 | -175.9 | -179.5 | 177.4 | -0.8 | 0 | 0 | 110.2 | ||||
| 383 | F | 30.3 | Very low | 31.2 | Very low | 188 Ų | 188 | 159.2 Ų | 159.2 | 83% | 0.825 | 84% | 0.84 | S | S | * | * | trans | -167.2 | 163.9 | 164.5 | -88.1 | -65.6 | 0 | 0 | 0 | 106.1 | ||||
| 384 | P | 47.1 | Very low | 31.2 | Very low | 114 Ų | 114 | 154.7 Ų | 154.7 | 74% | 0.74 | 84% | 0.843 | S | S | * | * | cis | -106.2 | -174.7 | 8.3 | 40.3 | -27.4 | 0 | 0 | 0 | 111.9 | ||||
| 385 | T | 37.1 | Very low | 31.3 | Very low | 200 Ų | 200 | 155.7 Ų | 155.7 | 100% | 1.227 | 85% | 0.85 | S | S | * | * | cis | -145.6 | 0 | 16.9 | -26.8 | 0 | 0 | 0 | 0 | 109.7 |
Retrieved 385 of 385 residues in 181.5 ms
(Link to these results)