| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 59.3 | Low | 84.2 | Confident | 238 Ų | 238 | 115.7 Ų | 115.7 | 100% | 1.172 | 61% | 0.606 | S | S | * | * | 0 | 120.5 | 0 | -77.9 | -66.9 | 120.2 | 0 | 0 | 108.1 | |||||
| 2 | A | 66.9 | Low | 85.1 | Confident | 56 Ų | 56 | 117.9 Ų | 117.9 | 46% | 0.463 | 60% | 0.602 | S | S | . | * | trans | -65.5 | 151.7 | 177.2 | 0 | 0 | 0 | 0 | 0 | 111.2 | Q6 | A2-Q6 HydrophobicContact CB-CB 4.2Š| ||
| 3 | S | 83.6 | Confident | 85.7 | Confident | 43 Ų | 43 | 114.7 Ų | 114.7 | 30% | 0.301 | 59% | 0.586 | S | S | . | * | trans | -68.2 | 151.2 | 178.9 | 85.4 | 0 | 0 | 0 | 0 | 111 | Q5 Q6 S7 | S3-Q5 PolarHBondContact O-N 3.19Å; S3-Q5 PolarHBondContact OG-N 2.69Å; S3-Q6 WeakPolarHBondContact O-CB 3.43Å; S3-Q6 PolarHBondContact O-N 3.31Å; S3-Q6 WeakPolarHBondContact OG-CG 3.17Å; S3-Q6 PolarHBondContact OG-N 3.1Å; S3-Q6 VanDerWaalsContact OG-N 3.13Å; S3-S7 PolarHBondContact O-N 2.79Å; S3-S7 PolarHBondContact O-OG 3.27Å | ||
| 4 | P | 82.9 | Confident | 86.1 | Confident | 118 Ų | 118 | 116.8 Ų | 116.8 | 77% | 0.766 | 59% | 0.593 | S | S | * | * | H | α-helix | trans | -57.6 | -21.1 | 176.5 | -26.6 | 35.5 | 0 | 0 | 0 | 114.1 | R8 | P4-R8 WeakPolarHBondContact O-CB 3.4Å; P4-R8 PolarHBondContact O-N 2.9Å |
| 5 | Q | 84.9 | Confident | 86.5 | Confident | 151 Ų | 151 | 123.3 Ų | 123.3 | 71% | 0.706 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -77.5 | -44.9 | 172.3 | -65.7 | 178.9 | -13.7 | 0 | 0 | 111.6 | S3 R8 I9 | S3-Q5 PolarHBondContact O-N 3.19Å; S3-Q5 PolarHBondContact OG-N 2.69Å; Q5-R8 PolarHBondContact O-N 2.87Å; Q5-I9 VanDerWaalsContact O-CG1 3.31Å; Q5-I9 WeakPolarHBondContact O-CG1 3.18Å; Q5-I9 PolarHBondContact O-N 3.22Å |
| 6 | Q | 87.3 | Confident | 86.8 | Confident | 113 Ų | 113 | 120.1 Ų | 120.1 | 53% | 0.528 | 59% | 0.593 | S | S | . | * | H | α-helix | trans | -59.3 | -48.7 | 174.7 | -75.1 | 167.7 | -36.6 | 0 | 0 | 111.2 | A2 S3 R8 I9 Q10 | A2-Q6 HydrophobicContact CB-CB 4.2Å; S3-Q6 WeakPolarHBondContact O-CB 3.43Å; S3-Q6 PolarHBondContact O-N 3.31Å; S3-Q6 WeakPolarHBondContact OG-CG 3.17Å; S3-Q6 PolarHBondContact OG-N 3.1Å; S3-Q6 VanDerWaalsContact OG-N 3.13Å; Q6-R8 VanDerWaalsContact C-N 3.27Å; Q6-R8 PolarHBondContact O-N 2.93Å; Q6-I9 PolarHBondContact O-N 2.68Å; Q6-I9 VanDerWaalsContact O-N 3.08Å; Q6-Q10 WeakPolarHBondContact O-CB 3.47Å; Q6-Q10 PolarHBondContact O-N 3.07Å |
| 7 | S | 91.5 | Very high | 87.1 | Confident | 55 Ų | 55 | 121.6 Ų | 121.6 | 39% | 0.385 | 60% | 0.595 | S | S | . | * | H | α-helix | trans | -61.1 | -35 | 178.1 | -48.7 | 0 | 0 | 0 | 0 | 112.6 | S3 S11 | S3-S7 PolarHBondContact O-N 2.79Å; S3-S7 PolarHBondContact O-OG 3.27Å; S7-S11 VanDerWaalsContact O-CB 3.26Å; S7-S11 WeakPolarHBondContact O-CB 3.31Å; S7-S11 PolarHBondContact O-N 3.43Å |
| 8 | R | 93.9 | Very high | 87.3 | Confident | 202 Ų | 202 | 118.2 Ų | 118.2 | 76% | 0.762 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -68.3 | -38.7 | 174.3 | -179.5 | 178.9 | 175.4 | -174.6 | -1.8 | 112.3 | P4 Q5 Q6 Y12 | P4-R8 WeakPolarHBondContact O-CB 3.4Å; P4-R8 PolarHBondContact O-N 2.9Å; Q5-R8 PolarHBondContact O-N 2.87Å; Q6-R8 VanDerWaalsContact C-N 3.27Å; Q6-R8 PolarHBondContact O-N 2.93Å; R8-Y12 WeakPolarHBondContact O-CB 3.36Å; R8-Y12 PolarHBondContact O-N 3.05Å; R8-Y12 VanDerWaalsContact O-N 3.14Å |
| 9 | I | 93.1 | Very high | 87.5 | Confident | 105 Ų | 105 | 114.2 Ų | 114.2 | 54% | 0.538 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -68.3 | -48.7 | 176.3 | -68.5 | 162.4 | 0 | 0 | 0 | 109.9 | Q5 Q6 S11 Y12 L13 | Q5-I9 VanDerWaalsContact O-CG1 3.31Å; Q5-I9 WeakPolarHBondContact O-CG1 3.18Å; Q5-I9 PolarHBondContact O-N 3.22Å; Q6-I9 PolarHBondContact O-N 2.68Å; Q6-I9 VanDerWaalsContact O-N 3.08Å; I9-S11 PolarHBondContact O-N 2.91Å; I9-Y12 WeakPolarHBondContact O-CB 3.34Å; I9-Y12 PolarHBondContact O-N 3.31Å; I9-Y12 VanDerWaalsContact O-N 3.08Å; I9-L13 HydrophobicContact CG2-CD1 3.96Å; I9-L13 HydrophobicContact CG2-CG 4.35Å; I9-L13 WeakPolarHBondContact O-CG 3.33Å; I9-L13 PolarHBondContact O-N 2.91Å |
| 10 | Q | 90.6 | Very high | 87.7 | Confident | 127 Ų | 127 | 112.6 Ų | 112.6 | 59% | 0.593 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -58.5 | -48.7 | 178.7 | -172.1 | 174.3 | 5.2 | 0 | 0 | 111.6 | Q6 Y12 L13 E14 | Q6-Q10 WeakPolarHBondContact O-CB 3.47Å; Q6-Q10 PolarHBondContact O-N 3.07Å; Q10-Y12 VanDerWaalsContact C-N 3.26Å; Q10-Y12 PolarHBondContact O-N 3.39Å; Q10-L13 PolarHBondContact O-N 3.07Å; Q10-L13 VanDerWaalsContact O-N 3.14Å; Q10-E14 WeakPolarHBondContact O-CB 3.14Å; Q10-E14 PolarHBondContact O-N 3.47Å |
| 11 | S | 92.4 | Very high | 87.8 | Confident | 65 Ų | 65 | 110.9 Ų | 110.9 | 46% | 0.455 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -61.9 | -31.2 | 175.7 | -175.8 | 0 | 0 | 0 | 0 | 112.9 | S7 I9 R15 | S7-S11 VanDerWaalsContact O-CB 3.26Å; S7-S11 WeakPolarHBondContact O-CB 3.31Å; S7-S11 PolarHBondContact O-N 3.43Å; I9-S11 PolarHBondContact O-N 2.91Å; S11-R15 WeakPolarHBondContact O-CB 3.4Å; S11-R15 PolarHBondContact O-N 2.92Å |
| 12 | Y | 94.4 | Very high | 89.4 | Confident | 142 Ų | 142 | 105.7 Ų | 105.7 | 56% | 0.557 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -71.3 | -43 | 172.7 | 178.3 | -91.6 | 0 | 0 | 0 | 112.4 | R8 I9 Q10 N16 I18 | R8-Y12 WeakPolarHBondContact O-CB 3.36Å; R8-Y12 PolarHBondContact O-N 3.05Å; R8-Y12 VanDerWaalsContact O-N 3.14Å; I9-Y12 WeakPolarHBondContact O-CB 3.34Å; I9-Y12 PolarHBondContact O-N 3.31Å; I9-Y12 VanDerWaalsContact O-N 3.08Å; Q10-Y12 VanDerWaalsContact C-N 3.26Å; Q10-Y12 PolarHBondContact O-N 3.39Å; Y12-N16 WeakPolarHBondContact CD2-ND2 3.44Å; Y12-N16 VanDerWaalsContact CE2-ND2 3.29Å; Y12-N16 WeakPolarHBondContact CE2-ND2 3.44Å; Y12-N16 PolarHBondContact O-N 2.92Å; Y12-N16 PolarHBondContact O-ND2 3.49Å; Y12-I18 HydrophobicContact CD1-CD1 4.11Å; Y12-I18 HydrophobicContact CE1-CD1 3.64Å |
| 13 | L | 93.6 | Very high | 90.6 | Very high | 76 Ų | 76 | 109 Ų | 109 | 40% | 0.398 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -62.9 | -44.9 | 177.2 | -67.6 | 170.7 | 0 | 0 | 0 | 111.5 | I9 Q10 K17 I18 | I9-L13 HydrophobicContact CG2-CD1 3.96Å; I9-L13 HydrophobicContact CG2-CG 4.35Å; I9-L13 WeakPolarHBondContact O-CG 3.33Å; I9-L13 PolarHBondContact O-N 2.91Å; Q10-L13 PolarHBondContact O-N 3.07Å; Q10-L13 VanDerWaalsContact O-N 3.14Å; L13-K17 PolarHBondContact O-N 3.21Å; L13-K17 VanDerWaalsContact O-N 3.08Å; L13-I18 HydrophobicContact CD2-CB 3.87Å; L13-I18 HydrophobicContact CD2-CD1 4.01Å; L13-I18 HydrophobicContact CD2-CG2 3.7Å; L13-I18 PolarHBondContact O-N 2.94Å |
| 14 | E | 91.6 | Very high | 91 | Very high | 144 Ų | 144 | 110 Ų | 110 | 67% | 0.673 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -62.8 | -53.7 | 176.5 | -177.3 | -170.8 | -173.9 | 0 | 0 | 111.7 | Q10 N16 K17 | Q10-E14 WeakPolarHBondContact O-CB 3.14Å; Q10-E14 PolarHBondContact O-N 3.47Å; E14-N16 PolarHBondContact O-N 3.46Å; E14-N16 VanDerWaalsContact O-N 3.17Å; E14-K17 PolarHBondContact O-N 2.62Å |
| 15 | R | 91.8 | Very high | 91.4 | Very high | 215 Ų | 215 | 105.6 Ų | 105.6 | 81% | 0.811 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -58 | -33 | -178.2 | -179.1 | -179.7 | -178.8 | 114.5 | 4.2 | 113.3 | S11 | S11-R15 WeakPolarHBondContact O-CB 3.4Å; S11-R15 PolarHBondContact O-N 2.92Å |
| 16 | N | 91.4 | Very high | 91.8 | Very high | 71 Ų | 71 | 102 Ų | 102 | 38% | 0.38 | 49% | 0.493 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -98.5 | 5.9 | 178.5 | -62.1 | -78.7 | 0 | 0 | 0 | 112.9 | Y12 E14 I18 | Y12-N16 WeakPolarHBondContact CD2-ND2 3.44Å; Y12-N16 VanDerWaalsContact CE2-ND2 3.29Å; Y12-N16 WeakPolarHBondContact CE2-ND2 3.44Å; Y12-N16 PolarHBondContact O-N 2.92Å; Y12-N16 PolarHBondContact O-ND2 3.49Å; E14-N16 PolarHBondContact O-N 3.46Å; E14-N16 VanDerWaalsContact O-N 3.17Å; N16-I18 HydrophobicContact CB-CD1 3.81Å; N16-I18 HydrophobicContact CB-CG1 3.8Å; N16-I18 PolarHBondContact O-N 3.39Å |
| 17 | K | 91.6 | Very high | 92 | Very high | 146 Ų | 146 | 100 Ų | 100 | 64% | 0.635 | 49% | 0.489 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 50.2 | 36 | -177.5 | -59.3 | -168.1 | 174.6 | -166.3 | 0 | 114.4 | L13 E14 G19 P20 L21 | L13-K17 PolarHBondContact O-N 3.21Å; L13-K17 VanDerWaalsContact O-N 3.08Å; E14-K17 PolarHBondContact O-N 2.62Å; K17-G19 VanDerWaalsContact C-N 3.3Å; K17-G19 PolarHBondContact O-N 3.01Å; K17-P20 WeakPolarHBondContact O-CD 3.5Å; K17-L21 WeakPolarHBondContact O-CB 3.22Å; K17-L21 VanDerWaalsContact O-CG 3.31Å; K17-L21 WeakPolarHBondContact O-CG 3.4Å; K17-L21 PolarHBondContact O-N 3Å |
| 18 | I | 90.7 | Very high | 91.7 | Very high | 61 Ų | 61 | 99.7 Ų | 99.7 | 31% | 0.313 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -65.6 | -32 | -172.2 | -69.6 | 169.6 | 0 | 0 | 0 | 112 | Y12 L13 N16 F22 | Y12-I18 HydrophobicContact CD1-CD1 4.11Å; Y12-I18 HydrophobicContact CE1-CD1 3.64Å; L13-I18 HydrophobicContact CD2-CB 3.87Å; L13-I18 HydrophobicContact CD2-CD1 4.01Å; L13-I18 HydrophobicContact CD2-CG2 3.7Å; L13-I18 PolarHBondContact O-N 2.94Å; N16-I18 HydrophobicContact CB-CD1 3.81Å; N16-I18 HydrophobicContact CB-CG1 3.8Å; N16-I18 PolarHBondContact O-N 3.39Å; I18-F22 WeakPolarHBondContact O-CB 3.45Å; I18-F22 PolarHBondContact O-N 3.09Å |
| 19 | G | 91.2 | Very high | 91.6 | Very high | 42 Ų | 42 | 91.7 Ų | 91.7 | 43% | 0.433 | 45% | 0.452 | S | S | . | . | H | α-helix | trans | -60.2 | -64.2 | 172.9 | 0 | 0 | 0 | 0 | 0 | 112.6 | K17 L21 F22 E23 | K17-G19 VanDerWaalsContact C-N 3.3Å; K17-G19 PolarHBondContact O-N 3.01Å; G19-L21 PolarHBondContact O-N 3.37Å; G19-F22 WeakPolarHBondContact O-CB 3.29Å; G19-F22 PolarHBondContact O-N 3.4Å; G19-E23 PolarHBondContact O-N 2.75Å |
| 20 | P | 91.6 | Very high | 91.4 | Very high | 81 Ų | 81 | 92.4 Ų | 92.4 | 53% | 0.526 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -57.4 | -31.6 | 177 | -29.5 | 36.4 | 0 | 0 | 0 | 114.7 | K17 E24 | K17-P20 WeakPolarHBondContact O-CD 3.5Å; P20-E24 PolarHBondContact O-N 2.88Å |
| 21 | L | 89.8 | Confident | 91.4 | Very high | 77 Ų | 77 | 90.9 Ų | 90.9 | 40% | 0.403 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -68 | -43 | 173.3 | -73 | 170.6 | 0 | 0 | 0 | 112.1 | K17 G19 E23 E24 L25 | K17-L21 WeakPolarHBondContact O-CB 3.22Å; K17-L21 VanDerWaalsContact O-CG 3.31Å; K17-L21 WeakPolarHBondContact O-CG 3.4Å; K17-L21 PolarHBondContact O-N 3Å; G19-L21 PolarHBondContact O-N 3.37Å; L21-E23 VanDerWaalsContact C-N 3.31Å; L21-E24 PolarHBondContact O-N 2.99Å; L21-L25 WeakPolarHBondContact O-CB 3.41Å; L21-L25 VanDerWaalsContact O-CD1 3.3Å; L21-L25 WeakPolarHBondContact O-CD1 3.46Å; L21-L25 WeakPolarHBondContact O-CG 3.47Å; L21-L25 PolarHBondContact O-N 2.68Å |
| 22 | F | 91.8 | Very high | 91 | Very high | 130 Ų | 130 | 92.6 Ų | 92.6 | 57% | 0.57 | 46% | 0.456 | S | S | * | . | H | α-helix | trans | -62.9 | -40.1 | 174.3 | 176.7 | -101.3 | 0 | 0 | 0 | 111.5 | I18 G19 L25 M26 | I18-F22 WeakPolarHBondContact O-CB 3.45Å; I18-F22 PolarHBondContact O-N 3.09Å; G19-F22 WeakPolarHBondContact O-CB 3.29Å; G19-F22 PolarHBondContact O-N 3.4Å; F22-L25 PolarHBondContact O-N 3.48Å; F22-M26 HydrophobicContact CD1-CG 4.11Å; F22-M26 HydrophobicContact CD2-CG 4.12Å; F22-M26 HydrophobicContact CE1-CG 3.69Å; F22-M26 HydrophobicContact CE2-CG 3.69Å; F22-M26 HydrophobicContact CE2-SD 3.96Å; F22-M26 HydrophobicContact CG-CG 4.31Å; F22-M26 HydrophobicContact CZ-CG 3.46Å; F22-M26 VanDerWaalsContact CZ-CG 3.46Å; F22-M26 HydrophobicContact CZ-SD 3.91Å; F22-M26 WeakPolarHBondContact O-CB 3.22Å; F22-M26 VanDerWaalsContact O-CG 3.3Å; F22-M26 WeakPolarHBondContact O-CG 3.4Å; F22-M26 PolarHBondContact O-N 3.1Å |
| 23 | E | 92.6 | Very high | 90.6 | Very high | 126 Ų | 126 | 91.3 Ų | 91.3 | 59% | 0.589 | 46% | 0.463 | S | S | * | . | H | α-helix | trans | -62.8 | -44.6 | 176 | -171.6 | 172 | -160.6 | 0 | 0 | 112.6 | G19 L21 L25 T27 | G19-E23 PolarHBondContact O-N 2.75Å; L21-E23 VanDerWaalsContact C-N 3.31Å; E23-L25 PolarHBondContact O-N 3.29Å; E23-T27 VanDerWaalsContact O-CB 3.26Å; E23-T27 WeakPolarHBondContact O-CB 3.47Å; E23-T27 PolarHBondContact O-N 3Å; E23-T27 PolarHBondContact O-OG1 2.81Å |
| 24 | E | 92.8 | Very high | 90.2 | Very high | 63 Ų | 63 | 89.3 Ų | 89.3 | 29% | 0.294 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -61.7 | -44.1 | 173.8 | -170.6 | -173.9 | 179.4 | 0 | 0 | 111.7 | P20 L21 T27 K28 H44 K48 | P20-E24 PolarHBondContact O-N 2.88Å; L21-E24 PolarHBondContact O-N 2.99Å; E24-T27 PolarHBondContact O-N 3.26Å; E24-K28 HydrophobicContact CG-CD 4.39Å; E24-K28 PolarHBondContact O-N 3.16Å; E24-K28 IonicContact OE1-NZ 2.61Å; E24-K28 PolarHBondContact OE1-NZ 3.47Å; E24-H44 IonicContact OE1-NE2 3.49Å; E24-K48 IonicContact OE1-NZ 3.82Å; E24-K48 PolarHBondContact OE1-NZ 2.89Å; E24-K48 IonicContact OE2-NZ 3.66Å; E24-K48 PolarHBondContact OE2-NZ 3.47Å |
| 25 | L | 91.7 | Very high | 90 | Very high | 25 Ų | 25 | 89.9 Ų | 89.9 | 13% | 0.131 | 46% | 0.463 | C | S | . | . | H | α-helix | trans | -66.5 | -43.6 | -179 | -70.7 | 164.1 | 0 | 0 | 0 | 112.3 | L21 F22 E23 L29 L41 H44 L45 | L21-L25 WeakPolarHBondContact O-CB 3.41Å; L21-L25 VanDerWaalsContact O-CD1 3.3Å; L21-L25 WeakPolarHBondContact O-CD1 3.46Å; L21-L25 WeakPolarHBondContact O-CG 3.47Å; L21-L25 PolarHBondContact O-N 2.68Å; F22-L25 PolarHBondContact O-N 3.48Å; E23-L25 PolarHBondContact O-N 3.29Å; L25-L29 PolarHBondContact O-N 3.39Å; L25-L29 VanDerWaalsContact O-N 3.1Å; L25-L41 HydrophobicContact CB-CD2 3.79Å; L25-L41 HydrophobicContact CD2-CD2 3.76Å; L25-L41 HydrophobicContact CG-CD2 4.27Å; L25-H44 HydrophobicContact CD2-CB 4.27Å; L25-L45 HydrophobicContact CD1-CD2 3.85Å; L25-L45 HydrophobicContact CD1-CG 4.36Å; L25-L45 HydrophobicContact CD2-CD2 4.29Å; L25-L45 HydrophobicContact CD2-CG 4.18Å |
| 26 | M | 92 | Very high | 89.7 | Confident | 75 Ų | 75 | 86.2 Ų | 86.2 | 37% | 0.369 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -67.7 | -41.1 | 176.1 | -73.3 | -57.7 | -56 | 0 | 0 | 111.6 | F22 K28 L29 I30 | F22-M26 HydrophobicContact CD1-CG 4.11Å; F22-M26 HydrophobicContact CD2-CG 4.12Å; F22-M26 HydrophobicContact CE1-CG 3.69Å; F22-M26 HydrophobicContact CE2-CG 3.69Å; F22-M26 HydrophobicContact CE2-SD 3.96Å; F22-M26 HydrophobicContact CG-CG 4.31Å; F22-M26 HydrophobicContact CZ-CG 3.46Å; F22-M26 VanDerWaalsContact CZ-CG 3.46Å; F22-M26 HydrophobicContact CZ-SD 3.91Å; F22-M26 WeakPolarHBondContact O-CB 3.22Å; F22-M26 VanDerWaalsContact O-CG 3.3Å; F22-M26 WeakPolarHBondContact O-CG 3.4Å; F22-M26 PolarHBondContact O-N 3.1Å; M26-K28 PolarHBondContact O-N 2.86Å; M26-L29 PolarHBondContact O-N 3.01Å; M26-L29 HydrophobicContact SD-CD1 4.46Å; M26-I30 WeakPolarHBondContact O-CD1 3.44Å; M26-I30 VanDerWaalsContact O-CG1 3.3Å; M26-I30 WeakPolarHBondContact O-CG1 3.4Å; M26-I30 PolarHBondContact O-N 2.9Å; M26-I30 VanDerWaalsContact O-N 3.12Å |
| 27 | T | 91.1 | Very high | 89.6 | Confident | 73 Ų | 73 | 85.7 Ų | 85.7 | 45% | 0.448 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -57.4 | -50.1 | 175.1 | -59.9 | 0 | 0 | 0 | 0 | 110.7 | E23 E24 L29 I30 T31 | E23-T27 VanDerWaalsContact O-CB 3.26Å; E23-T27 WeakPolarHBondContact O-CB 3.47Å; E23-T27 PolarHBondContact O-N 3Å; E23-T27 PolarHBondContact O-OG1 2.81Å; E24-T27 PolarHBondContact O-N 3.26Å; T27-L29 PolarHBondContact O-N 2.92Å; T27-I30 PolarHBondContact O-N 3.04Å; T27-T31 HydrophobicContact CG2-CG2 4.2Å; T27-T31 WeakPolarHBondContact O-CG2 3.39Å; T27-T31 PolarHBondContact O-N 2.65Å; T27-T31 PolarHBondContact O-OG1 3.08Å |
| 28 | K | 87 | Confident | 89.4 | Confident | 48 Ų | 48 | 84.4 Ų | 84.4 | 21% | 0.209 | 45% | 0.454 | C | S | . | . | H | α-helix | trans | -63 | -39.6 | 179.6 | -79.2 | 173.5 | 168.4 | 156.1 | 0 | 114 | E24 M26 I30 T31 E32 F40 H44 | E24-K28 HydrophobicContact CG-CD 4.39Å; E24-K28 PolarHBondContact O-N 3.16Å; E24-K28 IonicContact OE1-NZ 2.61Å; E24-K28 PolarHBondContact OE1-NZ 3.47Å; M26-K28 PolarHBondContact O-N 2.86Å; K28-I30 PolarHBondContact O-N 3.33Å; K28-T31 WeakPolarHBondContact CA-OG1 3.12Å; K28-T31 PolarHBondContact O-N 3.39Å; K28-T31 PolarHBondContact O-OG1 3.31Å; K28-E32 WeakPolarHBondContact O-CB 3.48Å; K28-E32 PolarHBondContact O-N 3.25Å; K28-F40 HydrophobicContact CB-CE1 3.96Å; K28-F40 HydrophobicContact CB-CZ 4.12Å; K28-H44 PolarHBondContact NZ-CE1 2.83Å; K28-H44 PolarHBondContact NZ-NE2 3.08Å |
| 29 | L | 91.3 | Very high | 89.4 | Confident | 33 Ų | 33 | 85.2 Ų | 85.2 | 17% | 0.173 | 46% | 0.463 | C | S | . | . | H | α-helix | trans | -59.3 | -34.9 | 172.4 | -81.6 | -174.8 | 0 | 0 | 0 | 113.2 | L25 M26 T27 T33 P34 P37 F40 L41 | L25-L29 PolarHBondContact O-N 3.39Å; L25-L29 VanDerWaalsContact O-N 3.1Å; M26-L29 PolarHBondContact O-N 3.01Å; M26-L29 HydrophobicContact SD-CD1 4.46Å; T27-L29 PolarHBondContact O-N 2.92Å; L29-T33 PolarHBondContact O-N 2.97Å; L29-P34 HydrophobicContact CD2-CG 3.74Å; L29-P34 WeakPolarHBondContact O-CD 3.46Å; L29-P37 HydrophobicContact CD1-CB 4.36Å; L29-P37 HydrophobicContact CD2-CB 3.42Å; L29-P37 VanDerWaalsContact CD2-CB 3.42Å; L29-F40 HydrophobicContact CD2-CD1 3.72Å; L29-F40 HydrophobicContact CD2-CE1 4.3Å; L29-L41 HydrophobicContact CD1-CD1 3.84Å; L29-L41 HydrophobicContact CD1-CD2 3.88Å; L29-L41 HydrophobicContact CD1-CG 3.88Å; L29-L41 HydrophobicContact CD2-CD2 4.44Å; L29-L41 HydrophobicContact CD2-CG 4.19Å; L29-L41 HydrophobicContact CG-CD2 3.95Å; L29-L41 HydrophobicContact CG-CG 4.14Å |
| 30 | I | 89.3 | Confident | 89.3 | Confident | 120 Ų | 120 | 85.2 Ų | 85.2 | 62% | 0.615 | 45% | 0.451 | S | S | * | . | H | α-helix | trans | -79.4 | -41.2 | 179.4 | -66 | 164.5 | 0 | 0 | 0 | 110.9 | M26 T27 K28 T33 | M26-I30 WeakPolarHBondContact O-CD1 3.44Å; M26-I30 VanDerWaalsContact O-CG1 3.3Å; M26-I30 WeakPolarHBondContact O-CG1 3.4Å; M26-I30 PolarHBondContact O-N 2.9Å; M26-I30 VanDerWaalsContact O-N 3.12Å; T27-I30 PolarHBondContact O-N 3.04Å; K28-I30 PolarHBondContact O-N 3.33Å; I30-T33 WeakPolarHBondContact O-CG2 3.5Å |
| 31 | T | 89.1 | Confident | 89.2 | Confident | 95 Ų | 95 | 83.6 Ų | 83.6 | 58% | 0.583 | 44% | 0.438 | S | S | * | . | H | α-helix | trans | -78.3 | -34.9 | -176.6 | 55.5 | 0 | 0 | 0 | 0 | 114.1 | T27 K28 | T27-T31 HydrophobicContact CG2-CG2 4.2Å; T27-T31 WeakPolarHBondContact O-CG2 3.39Å; T27-T31 PolarHBondContact O-N 2.65Å; T27-T31 PolarHBondContact O-OG1 3.08Å; K28-T31 WeakPolarHBondContact CA-OG1 3.12Å; K28-T31 PolarHBondContact O-N 3.39Å; K28-T31 PolarHBondContact O-OG1 3.31Å |
| 32 | E | 84.8 | Confident | 89.2 | Confident | 101 Ų | 101 | 83.8 Ų | 83.8 | 47% | 0.472 | 44% | 0.438 | S | S | . | . | S | Bend | trans | -93 | -9.2 | -177.1 | -60 | -178.2 | -131.7 | 0 | 0 | 112.5 | K28 P34 F40 | K28-E32 WeakPolarHBondContact O-CB 3.48Å; K28-E32 PolarHBondContact O-N 3.25Å; E32-P34 VanDerWaalsContact C-CD 3.44Å; E32-P34 VanDerWaalsContact C-N 3.33Å; E32-P34 VanDerWaalsContact O-N 3.16Å; E32-F40 HydrophobicContact CB-CZ 4.44Å; E32-F40 VanDerWaalsContact CD-CZ 3.49Å; E32-F40 HydrophobicContact CG-CZ 4.46Å; E32-F40 WeakPolarHBondContact OE1-CZ 3.38Å; E32-F40 VanDerWaalsContact OE2-CE2 3.22Å; E32-F40 WeakPolarHBondContact OE2-CE2 3.38Å; E32-F40 WeakPolarHBondContact OE2-CZ 3.48Å |
| 33 | T | 86.8 | Confident | 89 | Confident | 115 Ų | 115 | 82.1 Ų | 82.1 | 71% | 0.706 | 44% | 0.436 | S | S | * | . | trans | 41.4 | 47.4 | 178.1 | 58.5 | 0 | 0 | 0 | 0 | 114.7 | L29 I30 D35 | L29-T33 PolarHBondContact O-N 2.97Å; I30-T33 WeakPolarHBondContact O-CG2 3.5Å; T33-D35 PolarHBondContact O-N 3.39Å | ||
| 34 | P | 84.7 | Confident | 88.8 | Confident | 34 Ų | 34 | 77.5 Ų | 77.5 | 22% | 0.221 | 41% | 0.414 | C | S | . | . | trans | -69.7 | 134 | -168.7 | 29 | -35.2 | 0 | 0 | 0 | 112.1 | L29 E32 H36 P37 F40 | L29-P34 HydrophobicContact CD2-CG 3.74Å; L29-P34 WeakPolarHBondContact O-CD 3.46Å; E32-P34 VanDerWaalsContact C-CD 3.44Å; E32-P34 VanDerWaalsContact C-N 3.33Å; E32-P34 VanDerWaalsContact O-N 3.16Å; P34-H36 PolarHBondContact O-N 3.2Å; P34-P37 HydrophobicContact CG-CB 4.38Å; P34-F40 HydrophobicContact CB-CB 4.19Å; P34-F40 HydrophobicContact CB-CD2 4.44Å; P34-F40 HydrophobicContact CB-CG 4.25Å; P34-F40 HydrophobicContact CG-CB 4.12Å; P34-F40 HydrophobicContact CG-CD1 4.13Å; P34-F40 HydrophobicContact CG-CG 4Å | ||
| 35 | D | 86.3 | Confident | 88.5 | Confident | 157 Ų | 157 | 78.3 Ų | 78.3 | 84% | 0.84 | 42% | 0.42 | S | S | * | . | S | Bend | trans | -50 | -31.6 | 175.2 | -69.6 | -55.3 | 0 | 0 | 0 | 112.9 | T33 | T33-D35 PolarHBondContact O-N 3.39Š|
| 36 | H | 87.1 | Confident | 88.1 | Confident | 138 Ų | 138 | 82.5 Ų | 82.5 | 64% | 0.639 | 44% | 0.439 | S | S | * | . | S | Bend | trans | -128.4 | 83.1 | -176.6 | -65.2 | -8.3 | 0 | 0 | 0 | 110.2 | P34 I38 P39 F40 | P34-H36 PolarHBondContact O-N 3.2Å; H36-I38 VanDerWaalsContact C-N 3.35Å; H36-I38 PolarHBondContact O-N 2.88Å; H36-P39 HydrophobicContact CB-CG 4.06Å; H36-P39 WeakPolarHBondContact O-CD 3.36Å; H36-F40 PolarHBondContact O-N 2.91Å |
| 37 | P | 88.1 | Confident | 87.6 | Confident | 59 Ų | 59 | 82.6 Ų | 82.6 | 38% | 0.383 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -67.4 | -30.5 | -171.5 | 25.7 | -35.6 | 0 | 0 | 0 | 113.8 | L29 P34 L41 | L29-P37 HydrophobicContact CD1-CB 4.36Å; L29-P37 HydrophobicContact CD2-CB 3.42Å; L29-P37 VanDerWaalsContact CD2-CB 3.42Å; P34-P37 HydrophobicContact CG-CB 4.38Å; P37-L41 WeakPolarHBondContact O-CG 3.39Å; P37-L41 PolarHBondContact O-N 3.48Å |
| 38 | I | 88.1 | Confident | 86.6 | Confident | 119 Ų | 119 | 83 Ų | 83 | 61% | 0.61 | 44% | 0.439 | S | S | * | . | H | α-helix | trans | -71.6 | -50.2 | -178.1 | -63.2 | 171.5 | 0 | 0 | 0 | 111.8 | H36 F40 L41 I42 | H36-I38 VanDerWaalsContact C-N 3.35Å; H36-I38 PolarHBondContact O-N 2.88Å; I38-F40 VanDerWaalsContact C-N 3.29Å; I38-F40 PolarHBondContact O-N 3.24Å; I38-L41 PolarHBondContact O-N 2.86Å; I38-I42 HydrophobicContact CG2-CD1 3.95Å; I38-I42 VanDerWaalsContact O-CG1 3.31Å; I38-I42 WeakPolarHBondContact O-CG1 3.47Å; I38-I42 PolarHBondContact O-N 3.13Å; I38-I42 VanDerWaalsContact O-N 3.08Å |
| 39 | P | 90.8 | Very high | 85.5 | Confident | 78 Ų | 78 | 88 Ų | 88 | 51% | 0.506 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -54.7 | -41.7 | 170.1 | -29.8 | 36.6 | 0 | 0 | 0 | 113.7 | H36 I42 D43 | H36-P39 HydrophobicContact CB-CG 4.06Å; H36-P39 WeakPolarHBondContact O-CD 3.36Å; P39-I42 PolarHBondContact O-N 2.85Å; P39-D43 PolarHBondContact O-N 3.19Å |
| 40 | F | 89.8 | Confident | 83.4 | Confident | 43 Ų | 43 | 93.3 Ų | 93.3 | 19% | 0.189 | 49% | 0.492 | C | S | . | . | H | α-helix | trans | -60.8 | -47.7 | 177.2 | 175.3 | -92.1 | 0 | 0 | 0 | 112.4 | K28 L29 E32 P34 H36 I38 I42 D43 H44 | K28-F40 HydrophobicContact CB-CE1 3.96Å; K28-F40 HydrophobicContact CB-CZ 4.12Å; L29-F40 HydrophobicContact CD2-CD1 3.72Å; L29-F40 HydrophobicContact CD2-CE1 4.3Å; E32-F40 HydrophobicContact CB-CZ 4.44Å; E32-F40 VanDerWaalsContact CD-CZ 3.49Å; E32-F40 HydrophobicContact CG-CZ 4.46Å; E32-F40 WeakPolarHBondContact OE1-CZ 3.38Å; E32-F40 VanDerWaalsContact OE2-CE2 3.22Å; E32-F40 WeakPolarHBondContact OE2-CE2 3.38Å; E32-F40 WeakPolarHBondContact OE2-CZ 3.48Å; P34-F40 HydrophobicContact CB-CB 4.19Å; P34-F40 HydrophobicContact CB-CD2 4.44Å; P34-F40 HydrophobicContact CB-CG 4.25Å; P34-F40 HydrophobicContact CG-CB 4.12Å; P34-F40 HydrophobicContact CG-CD1 4.13Å; P34-F40 HydrophobicContact CG-CG 4Å; H36-F40 PolarHBondContact O-N 2.91Å; I38-F40 VanDerWaalsContact C-N 3.29Å; I38-F40 PolarHBondContact O-N 3.24Å; F40-I42 VanDerWaalsContact C-N 3.28Å; F40-I42 PolarHBondContact O-N 3.11Å; F40-D43 PolarHBondContact O-N 3.34Å; F40-H44 WeakPolarHBondContact O-CB 3.29Å; F40-H44 PolarHBondContact O-N 3.07Å |
| 41 | L | 89 | Confident | 81.5 | Confident | 46 Ų | 46 | 91.1 Ų | 91.1 | 24% | 0.241 | 49% | 0.487 | C | S | . | . | H | α-helix | trans | -58.6 | -38.5 | 174.1 | -77.3 | 177.3 | 0 | 0 | 0 | 112.6 | L25 L29 P37 I38 H44 L45 | L25-L41 HydrophobicContact CB-CD2 3.79Å; L25-L41 HydrophobicContact CD2-CD2 3.76Å; L25-L41 HydrophobicContact CG-CD2 4.27Å; L29-L41 HydrophobicContact CD1-CD1 3.84Å; L29-L41 HydrophobicContact CD1-CD2 3.88Å; L29-L41 HydrophobicContact CD1-CG 3.88Å; L29-L41 HydrophobicContact CD2-CD2 4.44Å; L29-L41 HydrophobicContact CD2-CG 4.19Å; L29-L41 HydrophobicContact CG-CD2 3.95Å; L29-L41 HydrophobicContact CG-CG 4.14Å; P37-L41 WeakPolarHBondContact O-CG 3.39Å; P37-L41 PolarHBondContact O-N 3.48Å; I38-L41 PolarHBondContact O-N 2.86Å; L41-H44 PolarHBondContact O-N 2.8Å; L41-L45 WeakPolarHBondContact O-CB 3.39Å; L41-L45 VanDerWaalsContact O-CG 3.25Å; L41-L45 WeakPolarHBondContact O-CG 3.34Å; L41-L45 PolarHBondContact O-N 3.03Å |
| 42 | I | 90 | Very high | 79.5 | Confident | 82 Ų | 82 | 92.6 Ų | 92.6 | 42% | 0.421 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -67 | -47.1 | -179.1 | -69.5 | 165.2 | 0 | 0 | 0 | 110.5 | I38 P39 F40 L45 Q46 | I38-I42 HydrophobicContact CG2-CD1 3.95Å; I38-I42 VanDerWaalsContact O-CG1 3.31Å; I38-I42 WeakPolarHBondContact O-CG1 3.47Å; I38-I42 PolarHBondContact O-N 3.13Å; I38-I42 VanDerWaalsContact O-N 3.08Å; P39-I42 PolarHBondContact O-N 2.85Å; F40-I42 VanDerWaalsContact C-N 3.28Å; F40-I42 PolarHBondContact O-N 3.11Å; I42-L45 PolarHBondContact O-N 3.37Å; I42-Q46 WeakPolarHBondContact O-CB 3.11Å; I42-Q46 VanDerWaalsContact O-CG 3.27Å; I42-Q46 WeakPolarHBondContact O-CG 3.46Å; I42-Q46 PolarHBondContact O-N 3.4Å |
| 43 | D | 87.2 | Confident | 77.6 | Confident | 95 Ų | 95 | 91.3 Ų | 91.3 | 51% | 0.508 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -62 | -43.1 | 175 | -173.2 | 79.3 | 0 | 0 | 0 | 111.3 | P39 F40 L45 Q46 T47 | P39-D43 PolarHBondContact O-N 3.19Å; F40-D43 PolarHBondContact O-N 3.34Å; D43-L45 VanDerWaalsContact C-N 3.33Å; D43-L45 PolarHBondContact O-N 3.02Å; D43-Q46 PolarHBondContact O-N 3.43Å; D43-T47 WeakPolarHBondContact O-CB 3.43Å; D43-T47 WeakPolarHBondContact O-CG2 3.35Å; D43-T47 PolarHBondContact O-N 2.69Å; D43-T47 PolarHBondContact O-OG1 2.96Å |
| 44 | H | 87.8 | Confident | 75.6 | Confident | 29 Ų | 29 | 93.8 Ų | 93.8 | 13% | 0.134 | 51% | 0.513 | C | S | . | . | H | α-helix | trans | -64.7 | -34.9 | 177.7 | -152 | 67.3 | 0 | 0 | 0 | 113.5 | E24 L25 K28 F40 L41 T47 K48 | E24-H44 IonicContact OE1-NE2 3.49Å; L25-H44 HydrophobicContact CD2-CB 4.27Å; K28-H44 PolarHBondContact NZ-CE1 2.83Å; K28-H44 PolarHBondContact NZ-NE2 3.08Å; F40-H44 WeakPolarHBondContact O-CB 3.29Å; F40-H44 PolarHBondContact O-N 3.07Å; L41-H44 PolarHBondContact O-N 2.8Å; H44-T47 WeakPolarHBondContact CA-OG1 3.33Å; H44-T47 PolarHBondContact O-OG1 2.64Å; H44-K48 VanDerWaalsContact NE2-CE 3.3Å; H44-K48 WeakPolarHBondContact NE2-CE 3.46Å; H44-K48 WeakPolarHBondContact O-CB 3.4Å; H44-K48 WeakPolarHBondContact O-CG 3.48Å; H44-K48 PolarHBondContact O-N 3.42Å |
| 45 | L | 85.9 | Confident | 73.6 | Confident | 79 Ų | 79 | 100.5 Ų | 100.5 | 41% | 0.414 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -72.5 | -36.5 | 173.8 | -76.9 | 168.1 | 0 | 0 | 0 | 112.3 | L25 L41 I42 D43 Q49 | L25-L45 HydrophobicContact CD1-CD2 3.85Å; L25-L45 HydrophobicContact CD1-CG 4.36Å; L25-L45 HydrophobicContact CD2-CD2 4.29Å; L25-L45 HydrophobicContact CD2-CG 4.18Å; L41-L45 WeakPolarHBondContact O-CB 3.39Å; L41-L45 VanDerWaalsContact O-CG 3.25Å; L41-L45 WeakPolarHBondContact O-CG 3.34Å; L41-L45 PolarHBondContact O-N 3.03Å; I42-L45 PolarHBondContact O-N 3.37Å; D43-L45 VanDerWaalsContact C-N 3.33Å; D43-L45 PolarHBondContact O-N 3.02Å; L45-Q49 WeakPolarHBondContact O-CB 3.38Å; L45-Q49 WeakPolarHBondContact O-CG 3.36Å; L45-Q49 PolarHBondContact O-N 3.49Å |
| 46 | Q | 83.9 | Confident | 71.6 | Confident | 114 Ų | 114 | 101.2 Ų | 101.2 | 53% | 0.533 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -71.3 | -49.5 | 179.8 | -75 | 173.3 | 0.3 | 0 | 0 | 111.5 | I42 D43 K48 Q49 D50 | I42-Q46 WeakPolarHBondContact O-CB 3.11Å; I42-Q46 VanDerWaalsContact O-CG 3.27Å; I42-Q46 WeakPolarHBondContact O-CG 3.46Å; I42-Q46 PolarHBondContact O-N 3.4Å; D43-Q46 PolarHBondContact O-N 3.43Å; Q46-K48 PolarHBondContact O-N 2.86Å; Q46-Q49 PolarHBondContact O-N 3.38Å; Q46-D50 PolarHBondContact O-N 2.96Å |
| 47 | T | 80.9 | Confident | 69.5 | Low | 76 Ų | 76 | 105 Ų | 105 | 47% | 0.466 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -56.4 | -33.2 | 175.2 | 51.3 | 0 | 0 | 0 | 0 | 112.6 | D43 H44 | D43-T47 WeakPolarHBondContact O-CB 3.43Å; D43-T47 WeakPolarHBondContact O-CG2 3.35Å; D43-T47 PolarHBondContact O-N 2.69Å; D43-T47 PolarHBondContact O-OG1 2.96Å; H44-T47 WeakPolarHBondContact CA-OG1 3.33Å; H44-T47 PolarHBondContact O-OG1 2.64Å |
| 48 | K | 70.6 | Confident | 67.3 | Low | 81 Ų | 81 | 107 Ų | 107 | 35% | 0.352 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -71.6 | -44.5 | 170.3 | -66.7 | -89.4 | -179.4 | 155.7 | 0 | 112.4 | E24 H44 Q46 D50 S51 | E24-K48 IonicContact OE1-NZ 3.82Å; E24-K48 PolarHBondContact OE1-NZ 2.89Å; E24-K48 IonicContact OE2-NZ 3.66Å; E24-K48 PolarHBondContact OE2-NZ 3.47Å; H44-K48 VanDerWaalsContact NE2-CE 3.3Å; H44-K48 WeakPolarHBondContact NE2-CE 3.46Å; H44-K48 WeakPolarHBondContact O-CB 3.4Å; H44-K48 WeakPolarHBondContact O-CG 3.48Å; H44-K48 PolarHBondContact O-N 3.42Å; Q46-K48 PolarHBondContact O-N 2.86Å; K48-D50 PolarHBondContact O-N 3.43Å; K48-S51 PolarHBondContact O-N 2.92Å; K48-S51 VanDerWaalsContact O-N 3.17Å; K48-S51 PolarHBondContact O-OG 3.36Å |
| 49 | Q | 63.9 | Low | 65.1 | Low | 153 Ų | 153 | 111.4 Ų | 111.4 | 72% | 0.715 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -70.5 | -22.5 | -177.5 | -77.7 | -164.6 | 25.8 | 0 | 0 | 115 | L45 Q46 S51 P52 | L45-Q49 WeakPolarHBondContact O-CB 3.38Å; L45-Q49 WeakPolarHBondContact O-CG 3.36Å; L45-Q49 PolarHBondContact O-N 3.49Å; Q46-Q49 PolarHBondContact O-N 3.38Å; Q49-S51 PolarHBondContact O-N 3.31Å; Q49-P52 VanDerWaalsContact O-CD 3.32Å; Q49-P52 WeakPolarHBondContact O-CD 3.36Å |
| 50 | D | 46.7 | Very low | 63 | Low | 146 Ų | 146 | 112 Ų | 112 | 78% | 0.781 | 60% | 0.596 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.1 | 1.3 | 170.8 | -78.4 | -38 | 0 | 0 | 0 | 113.6 | Q46 K48 | Q46-D50 PolarHBondContact O-N 2.96Å; K48-D50 PolarHBondContact O-N 3.43Å |
| 51 | S | 49.5 | Very low | 60.4 | Low | 73 Ų | 73 | 112.8 Ų | 112.8 | 51% | 0.51 | 62% | 0.615 | S | S | . | * | trans | -116.5 | 34.1 | -179.9 | 75.1 | 0 | 0 | 0 | 0 | 117.2 | K48 Q49 G53 | K48-S51 PolarHBondContact O-N 2.92Å; K48-S51 VanDerWaalsContact O-N 3.17Å; K48-S51 PolarHBondContact O-OG 3.36Å; Q49-S51 PolarHBondContact O-N 3.31Å; S51-G53 PolarHBondContact O-N 2.97Å | ||
| 52 | P | 47.1 | Very low | 58.2 | Low | 127 Ų | 127 | 116.2 Ų | 116.2 | 83% | 0.825 | 64% | 0.644 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.6 | 26.8 | -165.8 | 39.1 | -37.5 | 0 | 0 | 0 | 113.9 | Q49 | Q49-P52 VanDerWaalsContact O-CD 3.32Å; Q49-P52 WeakPolarHBondContact O-CD 3.36Å |
| 53 | G | 45.7 | Very low | 56 | Low | 73 Ų | 73 | 116.5 Ų | 116.5 | 75% | 0.753 | 66% | 0.658 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -148.4 | 9.6 | -167.9 | 0 | 0 | 0 | 0 | 0 | 116.7 | S51 | S51-G53 PolarHBondContact O-N 2.97Š|
| 54 | K | 43.8 | Very low | 54.1 | Low | 168 Ų | 168 | 115.3 Ų | 115.3 | 73% | 0.73 | 66% | 0.662 | S | S | * | * | trans | -145.5 | 35.6 | -178.1 | -135.6 | 174.5 | -173.7 | 179.6 | 0 | 117.6 | H56 | K54-H56 PolarHBondContact O-N 3.06Š| ||
| 55 | L | 43 | Very low | 52.2 | Low | 174 Ų | 174 | 120.7 Ų | 120.7 | 91% | 0.911 | 69% | 0.69 | S | S | * | * | trans | -73.7 | 55.6 | 161.9 | -78.5 | 178.7 | 0 | 0 | 0 | 112.4 | ||||
| 56 | H | 43.6 | Very low | 50.2 | Low | 172 Ų | 172 | 128.4 Ų | 128.4 | 80% | 0.796 | 71% | 0.714 | S | S | * | * | S | Bend | trans | -147.9 | 123.9 | 163.1 | -93.5 | -70.8 | 0 | 0 | 0 | 110.5 | K54 | K54-H56 PolarHBondContact O-N 3.06Š|
| 57 | R | 43.9 | Very low | 48 | Very low | 217 Ų | 217 | 127 Ų | 127 | 82% | 0.819 | 72% | 0.722 | S | S | * | * | trans | 64 | 76.3 | 164.6 | -161.1 | 174.2 | -62.7 | -157.2 | -2.1 | 116 | ||||
| 58 | A | 41.6 | Very low | 45.8 | Very low | 103 Ų | 103 | 131 Ų | 131 | 85% | 0.851 | 74% | 0.736 | S | S | * | * | trans | -101.3 | 12.4 | 159.3 | 0 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 59 | F | 42.8 | Very low | 44.2 | Very low | 210 Ų | 210 | 132.6 Ų | 132.6 | 92% | 0.921 | 76% | 0.757 | S | S | * | * | trans | -97.5 | 83.1 | 157.6 | -68.8 | -63.5 | 0 | 0 | 0 | 108.3 | ||||
| 60 | S | 45.7 | Very low | 42.7 | Very low | 91 Ų | 91 | 130.3 Ų | 130.3 | 64% | 0.636 | 76% | 0.758 | S | S | * | * | S | Bend | trans | -161.4 | 123.8 | 172.8 | -162 | 0 | 0 | 0 | 0 | 107.9 | ||
| 61 | G | 36.2 | Very low | 42.5 | Very low | 59 Ų | 59 | 129.1 Ų | 129.1 | 61% | 0.608 | 76% | 0.758 | S | S | * | * | trans | -67.5 | 172.3 | -159.8 | 0 | 0 | 0 | 0 | 0 | 117 | A63 | G61-A63 PolarHBondContact O-N 3.38Š| ||
| 62 | S | 42.3 | Very low | 41.8 | Very low | 119 Ų | 119 | 134 Ų | 134 | 83% | 0.832 | 77% | 0.772 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -58.5 | -0 | -164.9 | -44.1 | 0 | 0 | 0 | 0 | 117.9 | ||
| 63 | A | 44.8 | Very low | 41.3 | Very low | 87 Ų | 87 | 135.4 Ų | 135.4 | 72% | 0.719 | 77% | 0.773 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77.4 | -23.1 | -178.7 | 0 | 0 | 0 | 0 | 0 | 114.3 | G61 L65 | G61-A63 PolarHBondContact O-N 3.38Å; A63-L65 VanDerWaalsContact C-N 3.3Å; A63-L65 PolarHBondContact O-N 2.89Å |
| 64 | A | 45.4 | Very low | 41 | Very low | 71 Ų | 71 | 139.5 Ų | 139.5 | 59% | 0.587 | 77% | 0.77 | S | S | * | * | G | 310 helix | trans | -73.5 | -8.2 | -164.9 | 0 | 0 | 0 | 0 | 0 | 116.3 | W66 | A64-W66 VanDerWaalsContact C-N 3.35Å; A64-W66 PolarHBondContact O-N 2.89Å |
| 65 | L | 48.6 | Very low | 40.5 | Very low | 141 Ų | 141 | 138.6 Ų | 138.6 | 74% | 0.738 | 77% | 0.774 | S | S | * | * | G | 310 helix | trans | -72.7 | -20.6 | -170.8 | -71.8 | 172.2 | 0 | 0 | 0 | 114.9 | A63 | A63-L65 VanDerWaalsContact C-N 3.3Å; A63-L65 PolarHBondContact O-N 2.89Å |
| 66 | W | 43.4 | Very low | 40 | Very low | 242 Ų | 242 | 136.7 Ų | 136.7 | 92% | 0.917 | 77% | 0.769 | S | S | * | * | G | 310 helix | trans | -86.7 | -3.3 | -172.2 | -60 | 93.6 | 0 | 0 | 0 | 115 | A64 | A64-W66 VanDerWaalsContact C-N 3.35Å; A64-W66 PolarHBondContact O-N 2.89Å |
| 67 | A | 39.5 | Very low | 39.5 | Very low | 85 Ų | 85 | 138.9 Ų | 138.9 | 70% | 0.702 | 77% | 0.77 | S | S | * | * | trans | -115.6 | 18.8 | -163.5 | 0 | 0 | 0 | 0 | 0 | 116 | S69 | A67-S69 PolarHBondContact O-N 3.32Š| ||
| 68 | Q | 33.5 | Very low | 39.5 | Very low | 160 Ų | 160 | 138.5 Ų | 138.5 | 75% | 0.748 | 77% | 0.769 | S | S | * | * | trans | -94.8 | 88.2 | 177.1 | -71.7 | -170.2 | 101.6 | 0 | 0 | 112.5 | ||||
| 69 | S | 36.6 | Very low | 39 | Very low | 113 Ų | 113 | 142.9 Ų | 142.9 | 79% | 0.79 | 77% | 0.772 | S | S | * | * | P | Polyproline II helix | trans | -76.5 | 141.9 | 167.8 | 55.9 | 0 | 0 | 0 | 0 | 112 | A67 | A67-S69 PolarHBondContact O-N 3.32Š|
| 70 | S | 32.6 | Very low | 38.6 | Very low | 105 Ų | 105 | 143.3 Ų | 143.3 | 73% | 0.734 | 77% | 0.769 | S | S | * | * | P | Polyproline II helix | trans | -58.9 | 137.3 | -174 | -177.3 | 0 | 0 | 0 | 0 | 114.8 | ||
| 71 | P | 42 | Very low | 38.1 | Very low | 121 Ų | 121 | 143.9 Ų | 143.9 | 79% | 0.786 | 77% | 0.773 | S | S | * | * | P | Polyproline II helix | trans | -82.3 | 119.9 | 165 | 32.2 | -31.2 | 0 | 0 | 0 | 111 | ||
| 72 | E | 36 | Very low | 37.9 | Very low | 175 Ų | 175 | 148.1 Ų | 148.1 | 82% | 0.818 | 78% | 0.782 | S | S | * | * | P | Polyproline II helix | trans | -74.5 | 126.3 | 175.1 | -63.9 | 173.9 | 96.2 | 0 | 0 | 111.6 | ||
| 73 | N | 36.4 | Very low | 37.5 | Very low | 157 Ų | 157 | 152.3 Ų | 152.3 | 84% | 0.84 | 79% | 0.785 | S | S | * | * | trans | -113.7 | 138 | 167.4 | -164 | -4.2 | 0 | 0 | 0 | 110.4 | ||||
| 74 | K | 39.8 | Very low | 37.2 | Very low | 160 Ų | 160 | 156.8 Ų | 156.8 | 70% | 0.696 | 79% | 0.792 | S | S | * | * | trans | -110.3 | 130.5 | -172.4 | -71.3 | 177 | -179.8 | 168.9 | 0 | 111.1 | ||||
| 75 | N | 33.2 | Very low | 37.2 | Very low | 149 Ų | 149 | 159.5 Ų | 159.5 | 80% | 0.797 | 79% | 0.79 | S | S | * | * | trans | 77.3 | 138.1 | -177.5 | -43.4 | -38.7 | 0 | 0 | 0 | 112.7 | ||||
| 76 | T | 32.4 | Very low | 37 | Very low | 133 Ų | 133 | 157.2 Ų | 157.2 | 82% | 0.816 | 78% | 0.784 | S | S | * | * | cis | -135 | 131 | 29.8 | 40.8 | 0 | 0 | 0 | 0 | 116.4 | R78 | T76-R78 PolarHBondContact O-N 2.92Š| ||
| 77 | R | 33.3 | Very low | 36.9 | Very low | 218 Ų | 218 | 155.6 Ų | 155.6 | 82% | 0.823 | 78% | 0.777 | S | S | * | * | trans | 30.8 | 84.3 | 136.8 | -164.2 | -179.6 | -175.2 | -101.8 | 11 | 120 | ||||
| 78 | R | 42.9 | Very low | 37.1 | Very low | 209 Ų | 209 | 158.6 Ų | 158.6 | 79% | 0.789 | 78% | 0.777 | S | S | * | * | trans | 47.8 | 103.9 | 148.4 | -63.9 | -166 | -61.7 | -144 | 1.6 | 118.7 | T76 | T76-R78 PolarHBondContact O-N 2.92Š| ||
| 79 | E | 30.7 | Very low | 37.3 | Very low | 195 Ų | 195 | 158.2 Ų | 158.2 | 91% | 0.911 | 78% | 0.778 | S | S | * | * | -120 | 161.5 | 127.9 | -69.5 | -163.3 | 140.6 | 0 | 0 | 109.3 | |||||
| 80 | Y | 35 | Very low | 37.5 | Very low | 219 Ų | 219 | 157.2 Ų | 157.2 | 86% | 0.859 | 77% | 0.768 | S | S | * | * | trans | -147 | 82.7 | -165.6 | -144.4 | -84.8 | 0 | 0 | 0 | 111.3 | ||||
| 81 | S | 35.3 | Very low | 38.1 | Very low | 104 Ų | 104 | 158.4 Ų | 158.4 | 73% | 0.727 | 77% | 0.773 | S | S | * | * | trans | -161.4 | 130.6 | 169 | -85.5 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 82 | N | 32.8 | Very low | 38.3 | Very low | 148 Ų | 148 | 161.2 Ų | 161.2 | 79% | 0.791 | 77% | 0.773 | S | S | * | * | trans | 51.5 | 78.9 | 141 | -48.4 | -26.9 | 0 | 0 | 0 | 118.6 | E84 | N82-E84 PolarHBondContact O-N 3.42Š| ||
| 83 | F | 32.7 | Very low | 39 | Very low | 206 Ų | 206 | 162.1 Ų | 162.1 | 90% | 0.904 | 77% | 0.774 | S | S | * | * | trans | -76 | 101.1 | 142.5 | -81.6 | -78 | 0 | 0 | 0 | 108.7 | ||||
| 84 | E | 39.5 | Very low | 39.3 | Very low | 182 Ų | 182 | 160.9 Ų | 160.9 | 85% | 0.85 | 77% | 0.774 | S | S | * | * | trans | -68 | 135 | 171.8 | -170.6 | 161.8 | -178.9 | 0 | 0 | 109.9 | N82 P86 | N82-E84 PolarHBondContact O-N 3.42Å; E84-P86 WeakPolarHBondContact O-CD 3.44Å | ||
| 85 | K | 44.5 | Very low | 39.7 | Very low | 127 Ų | 127 | 163 Ų | 163 | 55% | 0.552 | 78% | 0.784 | S | S | * | * | trans | -103.5 | 108.2 | -174.8 | -68.9 | 178.2 | -179.1 | 177.1 | 0 | 109.6 | W87 Q88 | K85-W87 PolarHBondContact O-N 3.23Å; K85-Q88 PolarHBondContact O-N 2.92Å | ||
| 86 | P | 45 | Very low | 40.5 | Very low | 94 Ų | 94 | 166.1 Ų | 166.1 | 61% | 0.61 | 79% | 0.79 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -57.7 | -25.6 | -173.4 | -27.6 | 35.3 | 0 | 0 | 0 | 115 | E84 | E84-P86 WeakPolarHBondContact O-CD 3.44Š|
| 87 | W | 40.5 | Very low | 40.8 | Very low | 207 Ų | 207 | 165.3 Ų | 165.3 | 78% | 0.784 | 79% | 0.79 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -88.7 | 9.5 | -172.6 | 41.2 | 87.5 | 0 | 0 | 0 | 115.9 | K85 | K85-W87 PolarHBondContact O-N 3.23Š|
| 88 | Q | 44.8 | Very low | 41.5 | Very low | 148 Ų | 148 | 164.1 Ų | 164.1 | 69% | 0.692 | 79% | 0.791 | S | S | * | * | trans | -105.9 | 48.3 | 175.4 | -69.1 | -156.6 | -65.1 | 0 | 0 | 114.4 | K85 T90 | K85-Q88 PolarHBondContact O-N 2.92Å; Q88-T90 PolarHBondContact O-N 2.9Å; Q88-T90 VanDerWaalsContact O-N 3.08Å | ||
| 89 | I | 38.3 | Very low | 41.9 | Very low | 152 Ų | 152 | 158.6 Ų | 158.6 | 78% | 0.779 | 78% | 0.784 | S | S | * | * | trans | -78.5 | 88.6 | 174.3 | -51.5 | 177.8 | 0 | 0 | 0 | 110.3 | ||||
| 90 | T | 40.6 | Very low | 42.3 | Very low | 93 Ų | 93 | 156.1 Ų | 156.1 | 57% | 0.571 | 78% | 0.777 | S | S | * | * | trans | -81.7 | 124.7 | 171 | 67.6 | 0 | 0 | 0 | 0 | 110.9 | Q88 K92 | Q88-T90 PolarHBondContact O-N 2.9Å; Q88-T90 VanDerWaalsContact O-N 3.08Å; T90-K92 PolarHBondContact O-N 3.35Å | ||
| 91 | P | 43.8 | Very low | 42.3 | Very low | 129 Ų | 129 | 152.7 Ų | 152.7 | 84% | 0.838 | 77% | 0.773 | S | S | * | * | trans | -73.8 | 90.5 | 179.8 | 29.1 | -34.7 | 0 | 0 | 0 | 111.5 | ||||
| 92 | K | 47.1 | Very low | 42.6 | Very low | 180 Ų | 180 | 152.3 Ų | 152.3 | 78% | 0.783 | 78% | 0.776 | S | S | * | * | P | Polyproline II helix | trans | -90.7 | 125.5 | 173.3 | -72 | -170.6 | 179.1 | 177.2 | 0 | 111.2 | T90 | T90-K92 PolarHBondContact O-N 3.35Š|
| 93 | K | 49.8 | Very low | 42.7 | Very low | 195 Ų | 195 | 150.5 Ų | 150.5 | 85% | 0.848 | 77% | 0.77 | S | S | * | * | P | Polyproline II helix | trans | -55.3 | 126.6 | -170.9 | -56.1 | 177.1 | -176.9 | -178.2 | 0 | 111.7 | K95 | K93-K95 PolarHBondContact O-N 3.14Š|
| 94 | P | 42.8 | Very low | 42.8 | Very low | 130 Ų | 130 | 146.6 Ų | 146.6 | 84% | 0.844 | 77% | 0.768 | S | S | * | * | P | Polyproline II helix | trans | -66.9 | 128.2 | 177.1 | 26.8 | -33.4 | 0 | 0 | 0 | 110.8 | ||
| 95 | K | 48.9 | Very low | 42.5 | Very low | 204 Ų | 204 | 142.3 Ų | 142.3 | 89% | 0.887 | 76% | 0.759 | S | S | * | * | P | Polyproline II helix | trans | -80 | 144.9 | 165.9 | -78.1 | -175.6 | 175.6 | 179.3 | 0 | 109.3 | K93 S97 | K93-K95 PolarHBondContact O-N 3.14Å; K95-S97 PolarHBondContact O-N 3.33Å |
| 96 | K | 50.9 | Low | 42.2 | Very low | 216 Ų | 216 | 144.2 Ų | 144.2 | 94% | 0.939 | 77% | 0.773 | S | S | * | * | P | Polyproline II helix | trans | -60.4 | 122.9 | -172.7 | -58.2 | -175.2 | 179.1 | -173.2 | 0 | 111.6 | ||
| 97 | S | 38.8 | Very low | 41.9 | Very low | 116 Ų | 116 | 145 Ų | 145 | 81% | 0.811 | 78% | 0.781 | S | S | * | * | P | Polyproline II helix | trans | -96.8 | 157.2 | 156.7 | -168 | 0 | 0 | 0 | 0 | 109.5 | K95 | K95-S97 PolarHBondContact O-N 3.33Š|
| 98 | K | 47.1 | Very low | 42.3 | Very low | 192 Ų | 192 | 140.6 Ų | 140.6 | 84% | 0.835 | 78% | 0.779 | S | S | * | * | trans | -141.1 | 106.3 | -175 | -179.6 | -169 | 168.4 | -178.2 | 0 | 111.6 | ||||
| 99 | S | 50.4 | Low | 42.5 | Very low | 94 Ų | 94 | 139.4 Ų | 139.4 | 66% | 0.657 | 78% | 0.784 | S | S | * | * | trans | -169.1 | 108.9 | 158.7 | 50 | 0 | 0 | 0 | 0 | 105.2 | ||||
| 100 | D | 39.6 | Very low | 42.1 | Very low | 143 Ų | 143 | 137.8 Ų | 137.8 | 77% | 0.765 | 79% | 0.786 | S | S | * | * | 65 | 133.1 | 93.3 | -60.8 | -44.7 | 0 | 0 | 0 | 113.1 | |||||
| 101 | L | 36 | Very low | 42.5 | Very low | 147 Ų | 147 | 138.8 Ų | 138.8 | 77% | 0.77 | 79% | 0.794 | S | S | * | * | cis | 172.2 | 90.6 | -21.9 | 169.7 | 68.9 | 0 | 0 | 0 | 104.2 | V103 | L101-V103 HydrophobicContact CD1-CG2 3.67Å; L101-V103 HydrophobicContact CG-CG2 4.21Å | ||
| 102 | A | 40.7 | Very low | 41.9 | Very low | 96 Ų | 96 | 141.4 Ų | 141.4 | 79% | 0.793 | 80% | 0.795 | S | S | * | * | trans | -163 | 93 | 164.8 | 0 | 0 | 0 | 0 | 0 | 105.8 | ||||
| 103 | V | 34.8 | Very low | 41.4 | Very low | 109 Ų | 109 | 138.3 Ų | 138.3 | 66% | 0.661 | 80% | 0.796 | S | S | * | * | 60 | 65.3 | 59.5 | -162.3 | 0 | 0 | 0 | 0 | 112.4 | L101 | L101-V103 HydrophobicContact CD1-CG2 3.67Å; L101-V103 HydrophobicContact CG-CG2 4.21Å | |||
| 104 | S | 35.5 | Very low | 40.7 | Very low | 124 Ų | 124 | 137.7 Ų | 137.7 | 87% | 0.867 | 79% | 0.793 | S | S | * | * | trans | -118.4 | 63 | 143.4 | -73.2 | 0 | 0 | 0 | 0 | 108.5 | I106 | S104-I106 PolarHBondContact O-N 3.18Š| ||
| 105 | S | 33.2 | Very low | 40.3 | Very low | 92 Ų | 92 | 136.5 Ų | 136.5 | 64% | 0.643 | 79% | 0.789 | S | S | * | * | trans | -78.3 | 103.9 | 176.5 | 51.5 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 106 | I | 38.7 | Very low | 39.5 | Very low | 167 Ų | 167 | 135 Ų | 135 | 86% | 0.856 | 79% | 0.789 | S | S | * | * | trans | -70.2 | 128.1 | 157.7 | -56 | 176.5 | 0 | 0 | 0 | 106.7 | S104 | S104-I106 PolarHBondContact O-N 3.18Š| ||
| 107 | S | 38 | Very low | 39.3 | Very low | 110 Ų | 110 | 129.8 Ų | 129.8 | 77% | 0.769 | 78% | 0.778 | S | S | * | * | trans | -70.4 | 143.2 | -164.4 | -47.4 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 108 | P | 49.5 | Very low | 39 | Very low | 115 Ų | 115 | 134.1 Ų | 134.1 | 75% | 0.747 | 78% | 0.776 | S | S | * | * | -109.4 | 170 | 125.6 | 36.3 | -33.2 | 0 | 0 | 0 | 110.2 | |||||
| 109 | P | 47.9 | Very low | 38.6 | Very low | 123 Ų | 123 | 129.6 Ų | 129.6 | 80% | 0.799 | 77% | 0.769 | S | S | * | * | cis | -129.3 | 179.7 | 3.7 | 42.5 | -28.4 | 0 | 0 | 0 | 114.5 | ||||
| 110 | S | 29.4 | Very low | 37.9 | Very low | 118 Ų | 118 | 131.7 Ų | 131.7 | 83% | 0.825 | 78% | 0.777 | S | S | * | * | trans | -152.5 | 140 | 134.2 | -163.7 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 111 | P | 49.8 | Very low | 37.5 | Very low | 114 Ų | 114 | 133.2 Ų | 133.2 | 74% | 0.74 | 78% | 0.78 | S | S | * | * | trans | -119 | 118.4 | -169.9 | 37.2 | -23.3 | 0 | 0 | 0 | 115.3 | ||||
| 112 | E | 30.2 | Very low | 37.8 | Very low | 185 Ų | 185 | 131.4 Ų | 131.4 | 86% | 0.864 | 78% | 0.778 | S | S | * | * | trans | -158.2 | 130.4 | 152.9 | -109.9 | 170.5 | 159.6 | 0 | 0 | 107.1 | ||||
| 113 | S | 36.8 | Very low | 37.6 | Very low | 114 Ų | 114 | 131.9 Ų | 131.9 | 80% | 0.797 | 77% | 0.773 | S | S | * | * | cis | -155.7 | -177.8 | 46.2 | 52.2 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 114 | K | 36.6 | Very low | 37.5 | Very low | 182 Ų | 182 | 131.2 Ų | 131.2 | 79% | 0.791 | 77% | 0.773 | S | S | * | * | trans | -78 | 143.5 | -175 | -55.3 | 121.2 | -177.2 | 171 | 0 | 110.4 | ||||
| 115 | S | 33.2 | Very low | 37.8 | Very low | 106 Ų | 106 | 135.8 Ų | 135.8 | 74% | 0.741 | 77% | 0.772 | S | S | * | * | 177 | 140.5 | 69.9 | 43.7 | 0 | 0 | 0 | 0 | 115.1 | |||||
| 116 | L | 32.9 | Very low | 38 | Very low | 172 Ų | 172 | 136.2 Ų | 136.2 | 90% | 0.901 | 77% | 0.767 | S | S | * | * | trans | 61.8 | 156.4 | 149.2 | -64.1 | 173.6 | 0 | 0 | 0 | 122.3 | ||||
| 117 | P | 45.1 | Very low | 38.2 | Very low | 107 Ų | 107 | 139.3 Ų | 139.3 | 70% | 0.695 | 77% | 0.768 | S | S | * | * | trans | -123.6 | 159.9 | -165.9 | 42.1 | -28.1 | 0 | 0 | 0 | 116.4 | ||||
| 118 | R | 34.4 | Very low | 38.4 | Very low | 206 Ų | 206 | 142.9 Ų | 142.9 | 78% | 0.777 | 77% | 0.765 | S | S | * | * | trans | -174.1 | 109.1 | 140.7 | -103.8 | -171.9 | -179.2 | 94.3 | -5.3 | 108 | ||||
| 119 | S | 37.7 | Very low | 38.6 | Very low | 98 Ų | 98 | 146.7 Ų | 146.7 | 69% | 0.685 | 77% | 0.772 | S | S | * | * | 67.4 | 90.7 | 95.1 | 72.6 | 0 | 0 | 0 | 0 | 114 | |||||
| 120 | V | 35.9 | Very low | 38.7 | Very low | 138 Ų | 138 | 143.5 Ų | 143.5 | 84% | 0.836 | 75% | 0.753 | S | S | * | * | trans | -92 | 120 | 148.7 | 176.9 | 0 | 0 | 0 | 0 | 105.7 | C122 | V120-C122 PolarHBondContact O-N 2.81Š| ||
| 121 | E | 31.6 | Very low | 40.1 | Very low | 175 Ų | 175 | 147.6 Ų | 147.6 | 82% | 0.818 | 75% | 0.75 | S | S | * | * | trans | -82.6 | 102.4 | -179.4 | -165.7 | 152.8 | 145 | 0 | 0 | 109.6 | P123 | E121-P123 WeakPolarHBondContact O-CD 3.47Š| ||
| 122 | C | 40.8 | Very low | 40.6 | Very low | 108 Ų | 108 | 146.7 Ų | 146.7 | 73% | 0.73 | 74% | 0.739 | S | S | * | * | P | Polyproline II helix | trans | -65 | 124.1 | 166.1 | -61.2 | 0 | 0 | 0 | 0 | 107.9 | V120 S124 | V120-C122 PolarHBondContact O-N 2.81Å; C122-S124 PolarHBondContact O-N 3Å; C122-S124 VanDerWaalsContact O-N 3.1Å |
| 123 | P | 37 | Very low | 42.3 | Very low | 106 Ų | 106 | 145.4 Ų | 145.4 | 69% | 0.688 | 73% | 0.731 | S | S | * | * | P | Polyproline II helix | trans | -54.4 | 121.7 | 178 | -27.1 | 35.3 | 0 | 0 | 0 | 110.5 | E121 W125 | E121-P123 WeakPolarHBondContact O-CD 3.47Å; P123-W125 VanDerWaalsContact O-CD1 3.3Å; P123-W125 PolarHBondContact O-N 2.97Å |
| 124 | S | 32.8 | Very low | 44.4 | Very low | 96 Ų | 96 | 146 Ų | 146 | 67% | 0.671 | 73% | 0.725 | S | S | * | * | P | Polyproline II helix | trans | -67 | 118.5 | 172.8 | 58.7 | 0 | 0 | 0 | 0 | 108.6 | C122 D126 | C122-S124 PolarHBondContact O-N 3Å; C122-S124 VanDerWaalsContact O-N 3.1Å; S124-D126 PolarHBondContact O-N 2.88Å |
| 125 | W | 42 | Very low | 46.5 | Very low | 219 Ų | 219 | 143.4 Ų | 143.4 | 83% | 0.83 | 72% | 0.716 | S | S | * | * | trans | -74.2 | 84.3 | 175.5 | -74.4 | 67.3 | 0 | 0 | 0 | 108.2 | P123 W127 | P123-W125 VanDerWaalsContact O-CD1 3.3Å; P123-W125 PolarHBondContact O-N 2.97Å; W125-W127 PolarHBondContact O-N 3.02Å | ||
| 126 | D | 37.1 | Very low | 48.8 | Very low | 101 Ų | 101 | 143.2 Ų | 143.2 | 54% | 0.54 | 71% | 0.706 | S | S | . | * | trans | -58.6 | 93 | 172.4 | -103.3 | 10 | 0 | 0 | 0 | 109.4 | S124 R128 | S124-D126 PolarHBondContact O-N 2.88Å; D126-R128 PolarHBondContact O-N 3.26Å; D126-R128 IonicContact OD2-CZ 3.81Å; D126-R128 IonicContact OD2-NH1 2.68Å; D126-R128 PolarHBondContact OD2-NH1 3.21Å; D126-R128 IonicContact OD2-NH2 2.76Å; D126-R128 PolarHBondContact OD2-NH2 2.9Å | ||
| 127 | W | 42.8 | Very low | 51 | Low | 232 Ų | 232 | 138 Ų | 138 | 88% | 0.879 | 68% | 0.684 | S | S | * | * | trans | -69.5 | 69.2 | 166 | -65.8 | 95.7 | 0 | 0 | 0 | 109.7 | W125 | W125-W127 PolarHBondContact O-N 3.02Š| ||
| 128 | R | 43.4 | Very low | 52.9 | Low | 186 Ų | 186 | 137.8 Ų | 137.8 | 70% | 0.702 | 67% | 0.673 | S | S | * | * | trans | -62.4 | 134.3 | 164 | -103.7 | -176.5 | -75.8 | -68.7 | -2.3 | 108.1 | D126 S130 | D126-R128 PolarHBondContact O-N 3.26Å; D126-R128 IonicContact OD2-CZ 3.81Å; D126-R128 IonicContact OD2-NH1 2.68Å; D126-R128 PolarHBondContact OD2-NH1 3.21Å; D126-R128 IonicContact OD2-NH2 2.76Å; D126-R128 PolarHBondContact OD2-NH2 2.9Å; R128-S130 PolarHBondContact O-N 3.12Å | ||
| 129 | E | 53.8 | Low | 55.4 | Low | 195 Ų | 195 | 132.8 Ų | 132.8 | 91% | 0.911 | 66% | 0.661 | S | S | * | * | trans | -70.9 | 95.7 | -174.8 | -70 | 163.4 | 122.7 | 0 | 0 | 110.2 | ||||
| 130 | S | 50.4 | Low | 57.7 | Low | 56 Ų | 56 | 133.5 Ų | 133.5 | 39% | 0.392 | 66% | 0.657 | S | S | . | * | trans | -56.3 | 129.1 | 178.9 | -91.3 | 0 | 0 | 0 | 0 | 113 | R128 D132 | R128-S130 PolarHBondContact O-N 3.12Å; S130-D132 WeakPolarHBondContact CB-OD1 3.36Å; S130-D132 WeakPolarHBondContact CB-OD2 3.43Å; S130-D132 PolarHBondContact O-N 3.48Å; S130-D132 VanDerWaalsContact OG-CG 3.24Å; S130-D132 PolarHBondContact OG-OD1 3.13Å; S130-D132 PolarHBondContact OG-OD2 2.92Å | ||
| 131 | R | 58 | Low | 60.1 | Low | 204 Ų | 204 | 133 Ų | 133 | 77% | 0.77 | 65% | 0.645 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -68.4 | -15.8 | 168 | -83.9 | 173.8 | -85.3 | -90.9 | -2.1 | 112.4 | F133 D134 | R131-F133 PolarHBondContact O-N 2.87Å; R131-D134 PolarHBondContact O-N 2.94Å |
| 132 | D | 59.6 | Low | 62.6 | Low | 94 Ų | 94 | 128.7 Ų | 128.7 | 50% | 0.503 | 63% | 0.625 | S | S | . | * | H | α-helix | trans | -57 | -23.1 | -174.8 | -26.3 | -10.2 | 0 | 0 | 0 | 112.4 | S130 E135 L136 | S130-D132 WeakPolarHBondContact CB-OD1 3.36Å; S130-D132 WeakPolarHBondContact CB-OD2 3.43Å; S130-D132 PolarHBondContact O-N 3.48Å; S130-D132 VanDerWaalsContact OG-CG 3.24Å; S130-D132 PolarHBondContact OG-OD1 3.13Å; S130-D132 PolarHBondContact OG-OD2 2.92Å; D132-E135 PolarHBondContact O-N 3.37Å; D132-L136 WeakPolarHBondContact O-CB 3.45Å; D132-L136 PolarHBondContact O-N 3.02Å |
| 133 | F | 67.3 | Low | 64.4 | Low | 159 Ų | 159 | 126.6 Ų | 126.6 | 70% | 0.697 | 61% | 0.611 | S | S | * | * | H | α-helix | trans | -65.4 | -35.9 | 171.6 | -81 | -78.3 | 0 | 0 | 0 | 113.6 | R131 S137 | R131-F133 PolarHBondContact O-N 2.87Å; F133-S137 VanDerWaalsContact O-CB 3.22Å; F133-S137 WeakPolarHBondContact O-CB 3.42Å; F133-S137 PolarHBondContact O-N 3.39Å |
| 134 | D | 79.4 | Confident | 66.7 | Low | 125 Ų | 125 | 128.6 Ų | 128.6 | 67% | 0.668 | 61% | 0.609 | S | S | * | * | H | α-helix | trans | -72.8 | -36.6 | 177.1 | -74.9 | -36.2 | 0 | 0 | 0 | 110.9 | R131 S137 H138 | R131-D134 PolarHBondContact O-N 2.94Å; D134-S137 WeakPolarHBondContact O-CB 3.25Å; D134-S137 PolarHBondContact O-N 3.39Å; D134-H138 WeakPolarHBondContact O-CB 3.41Å; D134-H138 PolarHBondContact O-N 2.96Å |
| 135 | E | 80.8 | Confident | 69.4 | Low | 129 Ų | 129 | 129.6 Ų | 129.6 | 60% | 0.603 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -65.6 | -46.3 | 174 | -64.2 | -176.3 | -171.8 | 0 | 0 | 111.5 | D132 S137 H138 I139 | D132-E135 PolarHBondContact O-N 3.37Å; E135-S137 VanDerWaalsContact C-N 3.29Å; E135-S137 PolarHBondContact O-N 3.43Å; E135-H138 WeakPolarHBondContact O-CB 3.22Å; E135-H138 PolarHBondContact O-N 3.07Å; E135-H138 VanDerWaalsContact O-N 3.13Å; E135-I139 WeakPolarHBondContact O-CG1 3.45Å; E135-I139 PolarHBondContact O-N 3.48Å |
| 136 | L | 81.7 | Confident | 71.6 | Confident | 101 Ų | 101 | 125.1 Ų | 125.1 | 53% | 0.529 | 59% | 0.593 | S | S | . | * | H | α-helix | trans | -63.2 | -36.8 | 175.4 | -164.3 | 73 | 0 | 0 | 0 | 111.8 | D132 I139 L140 | D132-L136 WeakPolarHBondContact O-CB 3.45Å; D132-L136 PolarHBondContact O-N 3.02Å; L136-I139 PolarHBondContact O-N 3.36Å; L136-L140 HydrophobicContact CG-CD1 4.42Å; L136-L140 WeakPolarHBondContact O-CB 3.38Å; L136-L140 VanDerWaalsContact O-CG 3.29Å; L136-L140 WeakPolarHBondContact O-CG 3.41Å; L136-L140 PolarHBondContact O-N 2.98Å |
| 137 | S | 78.5 | Confident | 74 | Confident | 62 Ų | 62 | 122.1 Ų | 122.1 | 43% | 0.434 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -63.6 | -41.9 | 172.6 | -168.6 | 0 | 0 | 0 | 0 | 111.8 | F133 D134 E135 L140 Q141 | F133-S137 VanDerWaalsContact O-CB 3.22Å; F133-S137 WeakPolarHBondContact O-CB 3.42Å; F133-S137 PolarHBondContact O-N 3.39Å; D134-S137 WeakPolarHBondContact O-CB 3.25Å; D134-S137 PolarHBondContact O-N 3.39Å; E135-S137 VanDerWaalsContact C-N 3.29Å; E135-S137 PolarHBondContact O-N 3.43Å; S137-L140 PolarHBondContact O-N 3.3Å; S137-Q141 WeakPolarHBondContact O-CB 3.33Å; S137-Q141 PolarHBondContact O-N 3.29Å |
| 138 | H | 85.6 | Confident | 76.2 | Confident | 103 Ų | 103 | 117.5 Ų | 117.5 | 48% | 0.477 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -60.1 | -50.5 | 174.8 | -163 | -94 | 0 | 0 | 0 | 111.1 | D134 E135 L140 Q141 E142 | D134-H138 WeakPolarHBondContact O-CB 3.41Å; D134-H138 PolarHBondContact O-N 2.96Å; E135-H138 WeakPolarHBondContact O-CB 3.22Å; E135-H138 PolarHBondContact O-N 3.07Å; E135-H138 VanDerWaalsContact O-N 3.13Å; H138-L140 VanDerWaalsContact C-N 3.34Å; H138-L140 PolarHBondContact O-N 3.48Å; H138-Q141 CarbonylContact O-C 3.6Å; H138-Q141 WeakPolarHBondContact O-CA 3.3Å; H138-Q141 PolarHBondContact O-N 2.61Å; H138-E142 IonicContact CE1-OE1 2.69Å; H138-E142 PolarHBondContact CE1-OE1 2.92Å; H138-E142 VanDerWaalsContact CE1-OE1 3.26Å; H138-E142 IonicContact CE1-OE2 3.83Å; H138-E142 PolarHBondContact CE1-OE2 3.46Å; H138-E142 VanDerWaalsContact ND1-CD 3.27Å; H138-E142 IonicContact ND1-OE1 2.64Å; H138-E142 IonicContact ND1-OE2 3.26Å; H138-E142 PolarHBondContact ND1-OE2 3.27Å; H138-E142 WeakPolarHBondContact O-CG 3.46Å; H138-E142 PolarHBondContact O-N 2.92Å |
| 139 | I | 86.9 | Confident | 78.3 | Confident | 101 Ų | 101 | 111.4 Ų | 111.4 | 52% | 0.518 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -59.7 | -42.1 | 178.3 | -66.3 | 162.3 | 0 | 0 | 0 | 111.5 | E135 L136 Q141 E142 S143 | E135-I139 WeakPolarHBondContact O-CG1 3.45Å; E135-I139 PolarHBondContact O-N 3.48Å; L136-I139 PolarHBondContact O-N 3.36Å; I139-Q141 VanDerWaalsContact C-N 3.31Å; I139-Q141 PolarHBondContact O-N 3.48Å; I139-E142 PolarHBondContact O-N 2.81Å; I139-S143 WeakPolarHBondContact O-CB 3.47Å; I139-S143 PolarHBondContact O-N 2.95Å; I139-S143 PolarHBondContact O-OG 3.3Å |
| 140 | L | 86.7 | Confident | 79.9 | Confident | 114 Ų | 114 | 107.4 Ų | 107.4 | 60% | 0.597 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -66.2 | -31 | 174.3 | -75.5 | 168.5 | 0 | 0 | 0 | 112.8 | L136 S137 H138 S143 K144 | L136-L140 HydrophobicContact CG-CD1 4.42Å; L136-L140 WeakPolarHBondContact O-CB 3.38Å; L136-L140 VanDerWaalsContact O-CG 3.29Å; L136-L140 WeakPolarHBondContact O-CG 3.41Å; L136-L140 PolarHBondContact O-N 2.98Å; S137-L140 PolarHBondContact O-N 3.3Å; H138-L140 VanDerWaalsContact C-N 3.34Å; H138-L140 PolarHBondContact O-N 3.48Å; L140-S143 WeakPolarHBondContact CA-OG 3.49Å; L140-S143 PolarHBondContact O-OG 2.99Å; L140-K144 WeakPolarHBondContact O-CB 3.46Å; L140-K144 PolarHBondContact O-N 3.49Å |
| 141 | Q | 85.5 | Confident | 81.5 | Confident | 127 Ų | 127 | 109.5 Ų | 109.5 | 59% | 0.593 | 55% | 0.55 | S | S | * | . | H | α-helix | trans | -80.9 | -28.4 | 175.5 | -171.2 | 155.2 | -18.8 | 0 | 0 | 112.6 | S137 H138 I139 K145 | S137-Q141 WeakPolarHBondContact O-CB 3.33Å; S137-Q141 PolarHBondContact O-N 3.29Å; H138-Q141 CarbonylContact O-C 3.6Å; H138-Q141 WeakPolarHBondContact O-CA 3.3Å; H138-Q141 PolarHBondContact O-N 2.61Å; I139-Q141 VanDerWaalsContact C-N 3.31Å; I139-Q141 PolarHBondContact O-N 3.48Å; Q141-K145 WeakPolarHBondContact O-CG 3.39Å; Q141-K145 PolarHBondContact O-N 3.49Å |
| 142 | E | 84.2 | Confident | 82.9 | Confident | 85 Ų | 85 | 103.2 Ų | 103.2 | 40% | 0.397 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -79 | -44.3 | 176.7 | -71.8 | -166.5 | 123.8 | 0 | 0 | 113.5 | H138 I139 K144 K145 L146 | H138-E142 IonicContact CE1-OE1 2.69Å; H138-E142 PolarHBondContact CE1-OE1 2.92Å; H138-E142 VanDerWaalsContact CE1-OE1 3.26Å; H138-E142 IonicContact CE1-OE2 3.83Å; H138-E142 PolarHBondContact CE1-OE2 3.46Å; H138-E142 VanDerWaalsContact ND1-CD 3.27Å; H138-E142 IonicContact ND1-OE1 2.64Å; H138-E142 IonicContact ND1-OE2 3.26Å; H138-E142 PolarHBondContact ND1-OE2 3.27Å; H138-E142 WeakPolarHBondContact O-CG 3.46Å; H138-E142 PolarHBondContact O-N 2.92Å; I139-E142 PolarHBondContact O-N 2.81Å; E142-K144 PolarHBondContact O-N 3.19Å; E142-K145 HydrophobicContact CG-CD 4.35Å; E142-K145 CarbonylContact O-C 3.59Å; E142-K145 WeakPolarHBondContact O-CA 3.37Å; E142-K145 WeakPolarHBondContact O-CB 3.47Å; E142-K145 PolarHBondContact O-N 3.01Å; E142-K145 IonicContact OE1-NZ 2.87Å; E142-L146 PolarHBondContact O-N 3.46Å |
| 143 | S | 80 | Confident | 84.2 | Confident | 63 Ų | 63 | 103.2 Ų | 103.2 | 44% | 0.441 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -55.2 | -34.8 | 168.2 | 51.8 | 0 | 0 | 0 | 0 | 111.6 | I139 L140 L146 G147 | I139-S143 WeakPolarHBondContact O-CB 3.47Å; I139-S143 PolarHBondContact O-N 2.95Å; I139-S143 PolarHBondContact O-OG 3.3Å; L140-S143 WeakPolarHBondContact CA-OG 3.49Å; L140-S143 PolarHBondContact O-OG 2.99Å; S143-L146 PolarHBondContact O-N 3.39Å; S143-G147 PolarHBondContact O-N 3.35Å |
| 144 | K | 84.7 | Confident | 85.1 | Confident | 148 Ų | 148 | 99.1 Ų | 99.1 | 64% | 0.643 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -72.4 | -21.5 | 172 | -168.6 | 172.4 | -174.6 | 173.2 | 0 | 114.8 | L140 E142 K148 | L140-K144 WeakPolarHBondContact O-CB 3.46Å; L140-K144 PolarHBondContact O-N 3.49Å; E142-K144 PolarHBondContact O-N 3.19Å; K144-K148 WeakPolarHBondContact O-CG 3.44Å |
| 145 | K | 89.6 | Confident | 85.2 | Confident | 118 Ų | 118 | 99.3 Ų | 99.3 | 51% | 0.513 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -75.4 | -47.9 | 166.2 | -62.6 | 166.1 | -162.2 | 165.9 | 0 | 109.7 | Q141 E142 G147 K148 A149 | Q141-K145 WeakPolarHBondContact O-CG 3.39Å; Q141-K145 PolarHBondContact O-N 3.49Å; E142-K145 HydrophobicContact CG-CD 4.35Å; E142-K145 CarbonylContact O-C 3.59Å; E142-K145 WeakPolarHBondContact O-CA 3.37Å; E142-K145 WeakPolarHBondContact O-CB 3.47Å; E142-K145 PolarHBondContact O-N 3.01Å; E142-K145 IonicContact OE1-NZ 2.87Å; K145-G147 PolarHBondContact O-N 3.45Å; K145-K148 WeakPolarHBondContact O-CB 3.33Å; K145-K148 PolarHBondContact O-N 3.32Å; K145-A149 PolarHBondContact O-N 3.47Å; K145-A149 VanDerWaalsContact O-N 3.07Å |
| 146 | L | 87.4 | Confident | 85 | Confident | 124 Ų | 124 | 95.9 Ų | 95.9 | 65% | 0.649 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -60.4 | -44.7 | -179 | -178.8 | 61.1 | 0 | 0 | 0 | 112 | E142 S143 K148 A149 L150 | E142-L146 PolarHBondContact O-N 3.46Å; S143-L146 PolarHBondContact O-N 3.39Å; L146-K148 VanDerWaalsContact C-N 3.28Å; L146-K148 PolarHBondContact O-N 3.25Å; L146-A149 WeakPolarHBondContact O-CB 3.31Å; L146-A149 PolarHBondContact O-N 3.41Å; L146-L150 PolarHBondContact O-N 3.16Å |
| 147 | G | 88 | Confident | 84.6 | Confident | 38 Ų | 38 | 95.3 Ų | 95.3 | 39% | 0.392 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -56.7 | -40.1 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.9 | S143 K145 L150 E151 | S143-G147 PolarHBondContact O-N 3.35Å; K145-G147 PolarHBondContact O-N 3.45Å; G147-L150 PolarHBondContact O-N 2.93Å; G147-E151 VanDerWaalsContact O-CB 3.31Å; G147-E151 WeakPolarHBondContact O-CB 3.25Å; G147-E151 PolarHBondContact O-N 2.79Å |
| 148 | K | 88.9 | Confident | 84.1 | Confident | 135 Ų | 135 | 95 Ų | 95 | 59% | 0.587 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -69 | -36.4 | 174.7 | -69.7 | 177.9 | 175.9 | -172.2 | 0 | 113 | K144 K145 L146 S152 | K144-K148 WeakPolarHBondContact O-CG 3.44Å; K145-K148 WeakPolarHBondContact O-CB 3.33Å; K145-K148 PolarHBondContact O-N 3.32Å; L146-K148 VanDerWaalsContact C-N 3.28Å; L146-K148 PolarHBondContact O-N 3.25Å; K148-S152 VanDerWaalsContact O-CB 3.31Å; K148-S152 WeakPolarHBondContact O-CB 3.43Å; K148-S152 PolarHBondContact O-N 3.2Å |
| 149 | A | 87.5 | Confident | 82.9 | Confident | 58 Ų | 58 | 95.5 Ų | 95.5 | 48% | 0.479 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -65.1 | -42.3 | 174.8 | 0 | 0 | 0 | 0 | 0 | 110.8 | K145 L146 S152 L153 | K145-A149 PolarHBondContact O-N 3.47Å; K145-A149 VanDerWaalsContact O-N 3.07Å; L146-A149 WeakPolarHBondContact O-CB 3.31Å; L146-A149 PolarHBondContact O-N 3.41Å; A149-S152 WeakPolarHBondContact O-CB 3.3Å; A149-S152 PolarHBondContact O-N 2.91Å; A149-L153 WeakPolarHBondContact O-CB 3.36Å; A149-L153 PolarHBondContact O-N 3.35Å |
| 150 | L | 87.3 | Confident | 81.5 | Confident | 112 Ų | 112 | 94.1 Ų | 94.1 | 59% | 0.586 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -65.6 | -42.3 | 175 | -175 | 62.2 | 0 | 0 | 0 | 112.3 | L146 G147 S152 L153 S154 | L146-L150 PolarHBondContact O-N 3.16Å; G147-L150 PolarHBondContact O-N 2.93Å; L150-S152 VanDerWaalsContact C-N 3.28Å; L150-S152 PolarHBondContact O-N 3.33Å; L150-L153 PolarHBondContact O-N 2.96Å; L150-S154 VanDerWaalsContact O-CB 3.31Å; L150-S154 WeakPolarHBondContact O-CB 3.3Å; L150-S154 PolarHBondContact O-N 3Å |
| 151 | E | 84.9 | Confident | 80.1 | Confident | 100 Ų | 100 | 93.9 Ų | 93.9 | 47% | 0.467 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -65.9 | -30.5 | 174.7 | -157.6 | -161.9 | 140.5 | 0 | 0 | 111.9 | G147 R155 | G147-E151 VanDerWaalsContact O-CB 3.31Å; G147-E151 WeakPolarHBondContact O-CB 3.25Å; G147-E151 PolarHBondContact O-N 2.79Å; E151-R155 VanDerWaalsContact CG-NH2 3.35Å; E151-R155 WeakPolarHBondContact O-CB 3.26Å; E151-R155 WeakPolarHBondContact O-CG 3.48Å; E151-R155 PolarHBondContact O-N 2.88Å; E151-R155 PolarHBondContact O-NE 3.43Å; E151-R155 IonicContact OE1-CZ 2.69Å; E151-R155 IonicContact OE1-NH1 3.14Å; E151-R155 PolarHBondContact OE1-NH1 3.37Å; E151-R155 IonicContact OE1-NH2 2.67Å; E151-R155 PolarHBondContact OE1-NH2 3.1Å; E151-R155 IonicContact OE2-NH2 2.67Å |
| 152 | S | 87.4 | Confident | 78.8 | Confident | 72 Ų | 72 | 95.1 Ų | 95.1 | 50% | 0.503 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -73.3 | -41.8 | 171.4 | -165.7 | 0 | 0 | 0 | 0 | 112.1 | K148 A149 L150 R155 S156 | K148-S152 VanDerWaalsContact O-CB 3.31Å; K148-S152 WeakPolarHBondContact O-CB 3.43Å; K148-S152 PolarHBondContact O-N 3.2Å; A149-S152 WeakPolarHBondContact O-CB 3.3Å; A149-S152 PolarHBondContact O-N 2.91Å; L150-S152 VanDerWaalsContact C-N 3.28Å; L150-S152 PolarHBondContact O-N 3.33Å; S152-R155 PolarHBondContact O-N 3.33Å; S152-S156 PolarHBondContact O-N 3.37Å; S152-S156 PolarHBondContact O-OG 3.38Å |
| 153 | L | 86.9 | Confident | 77.4 | Confident | 93 Ų | 93 | 95.9 Ų | 95.9 | 49% | 0.487 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -64.3 | -47.9 | 177 | 178.7 | 60.8 | 0 | 0 | 0 | 110.8 | A149 L150 R155 S156 I157 | A149-L153 WeakPolarHBondContact O-CB 3.36Å; A149-L153 PolarHBondContact O-N 3.35Å; L150-L153 PolarHBondContact O-N 2.96Å; L153-R155 VanDerWaalsContact C-N 3.32Å; L153-R155 PolarHBondContact O-N 3.05Å; L153-S156 WeakPolarHBondContact CA-OG 3.44Å; L153-S156 PolarHBondContact O-N 3.48Å; L153-S156 PolarHBondContact O-OG 2.86Å; L153-I157 HydrophobicContact CD1-CD1 4.12Å; L153-I157 HydrophobicContact CD1-CG1 4.35Å; L153-I157 HydrophobicContact CG-CD1 3.95Å; L153-I157 WeakPolarHBondContact O-CG1 3.48Å; L153-I157 PolarHBondContact O-N 3.4Å |
| 154 | S | 85.1 | Confident | 76.1 | Confident | 74 Ų | 74 | 98.8 Ų | 98.8 | 52% | 0.517 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -56.8 | -43.6 | 175 | 175.8 | 0 | 0 | 0 | 0 | 111.9 | L150 I157 A158 | L150-S154 VanDerWaalsContact O-CB 3.31Å; L150-S154 WeakPolarHBondContact O-CB 3.3Å; L150-S154 PolarHBondContact O-N 3Å; S154-I157 PolarHBondContact O-N 3.19Å; S154-A158 PolarHBondContact O-N 3.39Å |
| 155 | R | 81.4 | Confident | 74.7 | Confident | 129 Ų | 129 | 99 Ų | 99 | 49% | 0.487 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -62.8 | -40.9 | 171.3 | -83.9 | -174.5 | -76.9 | -107.6 | -1.9 | 113.2 | E151 S152 L153 A158 I159 | E151-R155 VanDerWaalsContact CG-NH2 3.35Å; E151-R155 WeakPolarHBondContact O-CB 3.26Å; E151-R155 WeakPolarHBondContact O-CG 3.48Å; E151-R155 PolarHBondContact O-N 2.88Å; E151-R155 PolarHBondContact O-NE 3.43Å; E151-R155 IonicContact OE1-CZ 2.69Å; E151-R155 IonicContact OE1-NH1 3.14Å; E151-R155 PolarHBondContact OE1-NH1 3.37Å; E151-R155 IonicContact OE1-NH2 2.67Å; E151-R155 PolarHBondContact OE1-NH2 3.1Å; E151-R155 IonicContact OE2-NH2 2.67Å; S152-R155 PolarHBondContact O-N 3.33Å; L153-R155 VanDerWaalsContact C-N 3.32Å; L153-R155 PolarHBondContact O-N 3.05Å; R155-A158 PolarHBondContact O-N 3.12Å; R155-I159 WeakPolarHBondContact O-CD1 3.11Å; R155-I159 VanDerWaalsContact O-CG1 3.24Å; R155-I159 WeakPolarHBondContact O-CG1 3.31Å; R155-I159 PolarHBondContact O-N 3.36Å; R155-I159 VanDerWaalsContact O-N 3.1Å |
| 156 | S | 76.3 | Confident | 72.7 | Confident | 57 Ų | 57 | 100.9 Ų | 100.9 | 40% | 0.399 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -66.7 | -36.3 | 177.7 | 61.2 | 0 | 0 | 0 | 0 | 113.1 | S152 L153 I159 S160 | S152-S156 PolarHBondContact O-N 3.37Å; S152-S156 PolarHBondContact O-OG 3.38Å; L153-S156 WeakPolarHBondContact CA-OG 3.44Å; L153-S156 PolarHBondContact O-N 3.48Å; L153-S156 PolarHBondContact O-OG 2.86Å; S156-I159 PolarHBondContact O-N 2.88Å; S156-S160 PolarHBondContact O-N 2.87Å; S156-S160 PolarHBondContact O-OG 3.17Å |
| 157 | I | 74.1 | Confident | 70.6 | Confident | 89 Ų | 89 | 101 Ų | 101 | 46% | 0.456 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -65.3 | -48.1 | 175.5 | -67.1 | 164.5 | 0 | 0 | 0 | 110 | L153 S154 I159 S160 D161 | L153-I157 HydrophobicContact CD1-CD1 4.12Å; L153-I157 HydrophobicContact CD1-CG1 4.35Å; L153-I157 HydrophobicContact CG-CD1 3.95Å; L153-I157 WeakPolarHBondContact O-CG1 3.48Å; L153-I157 PolarHBondContact O-N 3.4Å; S154-I157 PolarHBondContact O-N 3.19Å; I157-I159 PolarHBondContact O-N 2.87Å; I157-S160 WeakPolarHBondContact O-CB 3.27Å; I157-S160 PolarHBondContact O-N 3.21Å; I157-D161 PolarHBondContact O-N 3.33Å |
| 158 | A | 67.5 | Low | 68.8 | Low | 56 Ų | 56 | 106.5 Ų | 106.5 | 46% | 0.463 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -59.5 | -31.6 | 176.9 | 0 | 0 | 0 | 0 | 0 | 113.5 | S154 R155 | S154-A158 PolarHBondContact O-N 3.39Å; R155-A158 PolarHBondContact O-N 3.12Å |
| 159 | I | 60.7 | Low | 66.8 | Low | 113 Ų | 113 | 102.7 Ų | 102.7 | 58% | 0.579 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -78.6 | -31.3 | 175.2 | -67 | 165.1 | 0 | 0 | 0 | 111.6 | R155 S156 I157 L163 | R155-I159 WeakPolarHBondContact O-CD1 3.11Å; R155-I159 VanDerWaalsContact O-CG1 3.24Å; R155-I159 WeakPolarHBondContact O-CG1 3.31Å; R155-I159 PolarHBondContact O-N 3.36Å; R155-I159 VanDerWaalsContact O-N 3.1Å; S156-I159 PolarHBondContact O-N 2.88Å; I157-I159 PolarHBondContact O-N 2.87Å; I159-L163 PolarHBondContact O-N 3.22Å |
| 160 | S | 57.4 | Low | 64.7 | Low | 71 Ų | 71 | 109.4 Ų | 109.4 | 50% | 0.497 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -66.9 | -39.1 | 172.3 | -78.3 | 0 | 0 | 0 | 0 | 112.5 | S156 I157 E162 L163 D164 | S156-S160 PolarHBondContact O-N 2.87Å; S156-S160 PolarHBondContact O-OG 3.17Å; I157-S160 WeakPolarHBondContact O-CB 3.27Å; I157-S160 PolarHBondContact O-N 3.21Å; S160-E162 PolarHBondContact O-N 3.4Å; S160-L163 WeakPolarHBondContact O-CB 3.43Å; S160-L163 PolarHBondContact O-N 3.19Å; S160-D164 PolarHBondContact O-N 2.85Å |
| 161 | D | 57.8 | Low | 62.9 | Low | 110 Ų | 110 | 111.5 Ų | 111.5 | 59% | 0.588 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -62.9 | -39 | 177.6 | -72.8 | -14.6 | 0 | 0 | 0 | 112.2 | I157 L163 Q165 | I157-D161 PolarHBondContact O-N 3.33Å; D161-L163 VanDerWaalsContact C-N 3.29Å; D161-L163 PolarHBondContact O-N 3.38Å; D161-Q165 PolarHBondContact O-N 2.88Å |
| 162 | E | 57.3 | Low | 60.6 | Low | 152 Ų | 152 | 111.4 Ų | 111.4 | 71% | 0.71 | 60% | 0.603 | S | S | * | * | H | α-helix | trans | -66.1 | -29.9 | 172 | -76.4 | -165.4 | 129.7 | 0 | 0 | 112.8 | S160 | S160-E162 PolarHBondContact O-N 3.4Å |
| 163 | L | 55.8 | Low | 58.9 | Low | 101 Ų | 101 | 114.2 Ų | 114.2 | 53% | 0.529 | 62% | 0.617 | S | S | . | * | H | α-helix | trans | -75.4 | -41.6 | 179.2 | -171.1 | 62.3 | 0 | 0 | 0 | 112.2 | I159 S160 D161 Q165 H166 F167 | I159-L163 PolarHBondContact O-N 3.22Å; S160-L163 WeakPolarHBondContact O-CB 3.43Å; S160-L163 PolarHBondContact O-N 3.19Å; D161-L163 VanDerWaalsContact C-N 3.29Å; D161-L163 PolarHBondContact O-N 3.38Å; L163-Q165 VanDerWaalsContact C-N 3.28Å; L163-Q165 PolarHBondContact O-N 3.38Å; L163-H166 CarbonylContact O-C 3.54Å; L163-H166 WeakPolarHBondContact O-CA 3.41Å; L163-H166 WeakPolarHBondContact O-CB 3.48Å; L163-H166 PolarHBondContact O-N 3.01Å; L163-F167 HydrophobicContact CD1-CD2 4Å; L163-F167 HydrophobicContact CD1-CE2 3.92Å; L163-F167 HydrophobicContact CG-CD2 4.17Å; L163-F167 HydrophobicContact CG-CE2 4.42Å; L163-F167 PolarHBondContact O-N 3.48Å |
| 164 | D | 51.6 | Low | 56.9 | Low | 124 Ų | 124 | 118.5 Ų | 118.5 | 66% | 0.663 | 64% | 0.635 | S | S | * | * | H | α-helix | trans | -64 | -34.7 | 176.7 | -111.7 | 21.1 | 0 | 0 | 0 | 111.5 | S160 H166 F167 | S160-D164 PolarHBondContact O-N 2.85Å; D164-H166 PolarHBondContact O-N 2.94Å; D164-F167 PolarHBondContact O-N 2.92Å |
| 165 | Q | 56 | Low | 55.1 | Low | 152 Ų | 152 | 125.4 Ų | 125.4 | 71% | 0.71 | 65% | 0.65 | S | S | * | * | H | α-helix | trans | -58.5 | -27.3 | 171.1 | -155.5 | 93.1 | 132.8 | 0 | 0 | 112.9 | D161 L163 | D161-Q165 PolarHBondContact O-N 2.88Å; L163-Q165 VanDerWaalsContact C-N 3.28Å; L163-Q165 PolarHBondContact O-N 3.38Å |
| 166 | H | 47.1 | Very low | 53.3 | Low | 159 Ų | 159 | 125.4 Ų | 125.4 | 74% | 0.736 | 67% | 0.666 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -94.5 | -2.5 | 179 | -154.7 | -63 | 0 | 0 | 0 | 113.5 | L163 D164 | L163-H166 CarbonylContact O-C 3.54Å; L163-H166 WeakPolarHBondContact O-CA 3.41Å; L163-H166 WeakPolarHBondContact O-CB 3.48Å; L163-H166 PolarHBondContact O-N 3.01Å; D164-H166 PolarHBondContact O-N 2.94Å |
| 167 | F | 43.9 | Very low | 52 | Low | 126 Ų | 126 | 133.8 Ų | 133.8 | 55% | 0.553 | 69% | 0.689 | S | S | * | * | trans | -116 | 16.9 | -176 | -94.1 | -82 | 0 | 0 | 0 | 115.6 | L163 D164 G169 | L163-F167 HydrophobicContact CD1-CD2 4Å; L163-F167 HydrophobicContact CD1-CE2 3.92Å; L163-F167 HydrophobicContact CG-CD2 4.17Å; L163-F167 HydrophobicContact CG-CE2 4.42Å; L163-F167 PolarHBondContact O-N 3.48Å; D164-F167 PolarHBondContact O-N 2.92Å; F167-G169 PolarHBondContact O-N 3.34Å | ||
| 168 | L | 50.4 | Low | 50.8 | Low | 154 Ų | 154 | 135.6 Ų | 135.6 | 81% | 0.806 | 70% | 0.704 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62.5 | 32.2 | 174 | -77.7 | 165.7 | 0 | 0 | 0 | 116 | ||
| 169 | G | 46.3 | Very low | 49.9 | Very low | 55 Ų | 55 | 139.5 Ų | 139.5 | 57% | 0.567 | 72% | 0.722 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -134.1 | -19 | -178.5 | 0 | 0 | 0 | 0 | 0 | 116.8 | F167 | F167-G169 PolarHBondContact O-N 3.34Š|
| 170 | Y | 43.8 | Very low | 49.3 | Very low | 198 Ų | 198 | 136.6 Ų | 136.6 | 78% | 0.776 | 72% | 0.72 | S | S | * | * | S | Bend | trans | -140.9 | 97.1 | -170.6 | -66.3 | -73.1 | 0 | 0 | 0 | 115.3 | ||
| 171 | N | 48.5 | Very low | 48.6 | Very low | 157 Ų | 157 | 141.6 Ų | 141.6 | 84% | 0.84 | 74% | 0.735 | S | S | * | * | trans | 16.5 | 98.5 | 155.4 | -58.2 | -58.1 | 0 | 0 | 0 | 119 | ||||
| 172 | A | 36.8 | Very low | 48.1 | Very low | 97 Ų | 97 | 147.9 Ų | 147.9 | 80% | 0.802 | 75% | 0.751 | S | S | * | * | trans | -107.2 | 68.7 | 170 | 0 | 0 | 0 | 0 | 0 | 112.8 | Q174 | A172-Q174 VanDerWaalsContact C-N 3.31Å; A172-Q174 PolarHBondContact O-N 2.92Å | ||
| 173 | V | 52.1 | Low | 47.8 | Very low | 131 Ų | 131 | 146.5 Ų | 146.5 | 79% | 0.794 | 75% | 0.752 | S | S | * | * | trans | -83.4 | 74.8 | 172.7 | -173 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 174 | Q | 46.2 | Very low | 47.6 | Very low | 184 Ų | 184 | 145 Ų | 145 | 86% | 0.86 | 76% | 0.761 | S | S | * | * | trans | -133.5 | 92.1 | 170.3 | -68.9 | -164.8 | 77.4 | 0 | 0 | 110.6 | A172 | A172-Q174 VanDerWaalsContact C-N 3.31Å; A172-Q174 PolarHBondContact O-N 2.92Å | ||
| 175 | R | 46.8 | Very low | 47.1 | Very low | 219 Ų | 219 | 149.6 Ų | 149.6 | 83% | 0.826 | 77% | 0.769 | S | S | * | * | trans | -69 | 148.6 | 166.2 | -69.8 | -177 | 173 | 109.7 | -4 | 109.8 | R177 | R175-R177 PolarHBondContact O-N 3.34Š| ||
| 176 | P | 43.2 | Very low | 46.8 | Very low | 128 Ų | 128 | 149.5 Ų | 149.5 | 83% | 0.831 | 77% | 0.769 | S | S | * | * | trans | -54.5 | 128.8 | 165.5 | -22.7 | 33.5 | 0 | 0 | 0 | 110.3 | V178 | P176-V178 PolarHBondContact O-N 3.22Š| ||
| 177 | R | 48 | Very low | 47.2 | Very low | 234 Ų | 234 | 150.2 Ų | 150.2 | 88% | 0.883 | 78% | 0.778 | S | S | * | * | trans | -85 | 105.1 | 172.8 | -73.4 | -176.3 | 176.4 | -121.1 | 2.3 | 109.2 | R175 | R175-R177 PolarHBondContact O-N 3.34Š| ||
| 178 | V | 49.9 | Very low | 47.8 | Very low | 126 Ų | 126 | 149.5 Ų | 149.5 | 76% | 0.764 | 78% | 0.784 | S | S | * | * | trans | -65.4 | 130.1 | 157.9 | 177.6 | 0 | 0 | 0 | 0 | 107.4 | P176 | P176-V178 PolarHBondContact O-N 3.22Š| ||
| 179 | V | 47.8 | Very low | 47.9 | Very low | 139 Ų | 139 | 148.2 Ų | 148.2 | 84% | 0.842 | 78% | 0.778 | S | S | * | * | trans | -118.5 | 104.4 | 175.3 | 178.1 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 180 | G | 49.1 | Very low | 48.5 | Very low | 52 Ų | 52 | 150.2 Ų | 150.2 | 54% | 0.536 | 79% | 0.789 | S | S | . | * | trans | 174.4 | 132.8 | -179.3 | 0 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 181 | E | 43.3 | Very low | 49.7 | Very low | 175 Ų | 175 | 144.4 Ų | 144.4 | 82% | 0.818 | 77% | 0.771 | S | S | * | * | trans | -93.9 | 108.1 | 177.9 | -167.3 | 179.5 | 157 | 0 | 0 | 108.6 | V183 | E181-V183 VanDerWaalsContact C-N 3.27Å; E181-V183 HydrophobicContact CB-CG2 4.49Å; E181-V183 HydrophobicContact CG-CG2 3.82Å; E181-V183 PolarHBondContact O-N 3.08Å | ||
| 182 | W | 46.5 | Very low | 50.4 | Low | 243 Ų | 243 | 142.1 Ų | 142.1 | 92% | 0.92 | 77% | 0.765 | S | S | * | * | trans | -80 | 76.5 | 177.3 | -72.3 | 91.5 | 0 | 0 | 0 | 110.2 | G184 | W182-G184 PolarHBondContact O-N 3.32Š| ||
| 183 | V | 50.3 | Low | 51.1 | Low | 123 Ų | 123 | 142.7 Ų | 142.7 | 75% | 0.745 | 75% | 0.754 | S | S | * | * | trans | -75.1 | 118.7 | 171.3 | -176.7 | 0 | 0 | 0 | 0 | 109 | E181 | E181-V183 VanDerWaalsContact C-N 3.27Å; E181-V183 HydrophobicContact CB-CG2 4.49Å; E181-V183 HydrophobicContact CG-CG2 3.82Å; E181-V183 PolarHBondContact O-N 3.08Å | ||
| 184 | G | 51.3 | Low | 51.4 | Low | 69 Ų | 69 | 138.7 Ų | 138.7 | 71% | 0.711 | 74% | 0.735 | S | S | * | * | trans | 124.8 | 66.6 | 164.8 | 0 | 0 | 0 | 0 | 0 | 117.4 | W182 | W182-G184 PolarHBondContact O-N 3.32Š| ||
| 185 | R | 41.8 | Very low | 52 | Low | 221 Ų | 221 | 132.6 Ų | 132.6 | 83% | 0.834 | 72% | 0.716 | S | S | * | * | trans | -144.5 | 153.3 | 135.4 | -85.1 | -140.3 | -87.5 | -94.6 | 13.5 | 108.3 | ||||
| 186 | E | 50.8 | Low | 52.5 | Low | 150 Ų | 150 | 129.1 Ų | 129.1 | 70% | 0.701 | 71% | 0.709 | S | S | * | * | trans | -87.7 | 151.7 | 162.8 | 70.2 | 162.1 | -103.6 | 0 | 0 | 110.1 | T188 | E186-T188 PolarHBondContact O-N 2.96Å; E186-T188 VanDerWaalsContact OE1-CB 3.24Å; E186-T188 WeakPolarHBondContact OE1-CB 3.04Å; E186-T188 PolarHBondContact OE1-OG1 3.18Å | ||
| 187 | D | 55.6 | Low | 53 | Low | 174 Ų | 174 | 130.6 Ų | 130.6 | 93% | 0.93 | 71% | 0.707 | S | S | * | * | S | Bend | trans | -80.5 | 38.6 | -171.7 | -60 | -64.1 | 0 | 0 | 0 | 113.4 | ||
| 188 | T | 56.4 | Low | 53.3 | Low | 110 Ų | 110 | 126.4 Ų | 126.4 | 68% | 0.675 | 70% | 0.701 | S | S | * | * | trans | -130.4 | 26.1 | -173.7 | -25.2 | 0 | 0 | 0 | 0 | 114.3 | E186 | E186-T188 PolarHBondContact O-N 2.96Å; E186-T188 VanDerWaalsContact OE1-CB 3.24Å; E186-T188 WeakPolarHBondContact OE1-CB 3.04Å; E186-T188 PolarHBondContact OE1-OG1 3.18Å | ||
| 189 | D | 52.6 | Low | 53.2 | Low | 128 Ų | 128 | 126.6 Ų | 126.6 | 68% | 0.684 | 69% | 0.694 | S | S | * | * | trans | -107.4 | 103.3 | 165.5 | -170.5 | 9.1 | 0 | 0 | 0 | 110 | D191 | D189-D191 PolarHBondContact O-N 2.67Š| ||
| 190 | A | 58.9 | Low | 53.2 | Low | 96 Ų | 96 | 124.8 Ų | 124.8 | 79% | 0.793 | 69% | 0.685 | S | S | * | * | trans | -99.2 | 55.4 | -172 | 0 | 0 | 0 | 0 | 0 | 111.9 | P192 | A190-P192 VanDerWaalsContact O-CD 3.29Å; A190-P192 WeakPolarHBondContact O-CD 3.41Å | ||
| 191 | D | 68.8 | Low | 53 | Low | 76 Ų | 76 | 128.3 Ų | 128.3 | 41% | 0.406 | 70% | 0.698 | S | S | . | * | trans | -57.6 | 114.9 | 169.2 | 171.5 | 22.2 | 0 | 0 | 0 | 110.2 | D189 L193 A194 | D189-D191 PolarHBondContact O-N 2.67Å; D191-L193 PolarHBondContact O-N 3.03Å; D191-L193 VanDerWaalsContact OD1-CB 3.29Å; D191-L193 WeakPolarHBondContact OD1-CB 3.48Å; D191-L193 PolarHBondContact OD1-N 3.48Å; D191-A194 HydrophobicContact CB-CB 4.14Å; D191-A194 PolarHBondContact O-N 3.06Å; D191-A194 WeakPolarHBondContact OD2-CB 3.21Å; D191-A194 PolarHBondContact OD2-N 2.9Å; D191-A194 VanDerWaalsContact OD2-N 3.12Å | ||
| 192 | P | 61.6 | Low | 53.1 | Low | 109 Ų | 109 | 128.3 Ų | 128.3 | 71% | 0.708 | 70% | 0.696 | S | S | * | * | H | α-helix | trans | -66.4 | -22.5 | -179.9 | 28.5 | -35.3 | 0 | 0 | 0 | 112.8 | A190 | A190-P192 VanDerWaalsContact O-CD 3.29Å; A190-P192 WeakPolarHBondContact O-CD 3.41Å |
| 193 | L | 51.5 | Low | 52.9 | Low | 110 Ų | 110 | 122.3 Ų | 122.3 | 58% | 0.576 | 69% | 0.688 | S | S | * | * | H | α-helix | trans | -76.1 | -41.5 | -178.9 | -167 | 67.9 | 0 | 0 | 0 | 111.7 | D191 A195 E196 M197 | D191-L193 PolarHBondContact O-N 3.03Å; D191-L193 VanDerWaalsContact OD1-CB 3.29Å; D191-L193 WeakPolarHBondContact OD1-CB 3.48Å; D191-L193 PolarHBondContact OD1-N 3.48Å; L193-A195 PolarHBondContact O-N 3.49Å; L193-E196 PolarHBondContact O-N 3.35Å; L193-E196 VanDerWaalsContact O-N 3.14Å; L193-M197 PolarHBondContact O-N 2.86Å |
| 194 | A | 58.9 | Low | 52.5 | Low | 46 Ų | 46 | 128.3 Ų | 128.3 | 38% | 0.38 | 70% | 0.697 | S | S | . | * | H | α-helix | trans | -57.9 | -33.1 | 174.6 | 0 | 0 | 0 | 0 | 0 | 113.1 | D191 | D191-A194 HydrophobicContact CB-CB 4.14Å; D191-A194 PolarHBondContact O-N 3.06Å; D191-A194 WeakPolarHBondContact OD2-CB 3.21Å; D191-A194 PolarHBondContact OD2-N 2.9Å; D191-A194 VanDerWaalsContact OD2-N 3.12Å |
| 195 | A | 58.2 | Low | 51.8 | Low | 57 Ų | 57 | 129 Ų | 129 | 47% | 0.471 | 70% | 0.696 | S | S | . | * | H | α-helix | trans | -67.9 | -34.7 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112.9 | L193 H199 | L193-A195 PolarHBondContact O-N 3.49Å; A195-H199 PolarHBondContact O-CE1 3.07Å; A195-H199 PolarHBondContact O-ND1 3.22Å |
| 196 | E | 57.3 | Low | 51.7 | Low | 146 Ų | 146 | 126.5 Ų | 126.5 | 68% | 0.682 | 69% | 0.692 | S | S | * | * | H | α-helix | trans | -69.4 | -46.3 | 177.7 | -170.9 | 172.2 | 174.6 | 0 | 0 | 111.1 | L193 L198 H199 | L193-E196 PolarHBondContact O-N 3.35Å; L193-E196 VanDerWaalsContact O-N 3.14Å; E196-L198 PolarHBondContact O-N 2.7Å; E196-H199 PolarHBondContact O-N 3.45Å |
| 197 | M | 54.8 | Low | 50.8 | Low | 159 Ų | 159 | 126 Ų | 126 | 78% | 0.783 | 70% | 0.699 | S | S | * | * | H | α-helix | trans | -62.8 | -16.6 | -175.3 | -67 | -164 | 72.4 | 0 | 0 | 115.2 | L193 | L193-M197 PolarHBondContact O-N 2.86Å |
| 198 | L | 53.9 | Low | 50 | Low | 146 Ų | 146 | 124.5 Ų | 124.5 | 76% | 0.764 | 69% | 0.686 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92 | -0.7 | -179.7 | -67.2 | 176.9 | 0 | 0 | 0 | 114.5 | E196 P200 | E196-L198 PolarHBondContact O-N 2.7Å; L198-P200 WeakPolarHBondContact O-CD 3.32Å |
| 199 | H | 48.7 | Very low | 48.8 | Very low | 130 Ų | 130 | 125.7 Ų | 125.7 | 60% | 0.602 | 69% | 0.693 | S | S | * | * | P | Polyproline II helix | trans | -82.3 | 117.5 | 179.2 | -76.2 | 87.2 | 0 | 0 | 0 | 112.9 | A195 E196 | A195-H199 PolarHBondContact O-CE1 3.07Å; A195-H199 PolarHBondContact O-ND1 3.22Å; E196-H199 PolarHBondContact O-N 3.45Å |
| 200 | P | 47.5 | Very low | 47.6 | Very low | 101 Ų | 101 | 123.8 Ų | 123.8 | 66% | 0.656 | 69% | 0.689 | S | S | * | * | P | Polyproline II helix | trans | -70.8 | 147.5 | 171 | -13.7 | 30.3 | 0 | 0 | 0 | 110.9 | L198 F202 | L198-P200 WeakPolarHBondContact O-CD 3.32Å; P200-F202 PolarHBondContact O-N 3.06Å; P200-F202 VanDerWaalsContact O-N 3.13Å |
| 201 | P | 45.5 | Very low | 46.1 | Very low | 126 Ų | 126 | 131.6 Ų | 131.6 | 82% | 0.818 | 70% | 0.698 | S | S | * | * | P | Polyproline II helix | trans | -63.3 | 116.9 | 179 | 25 | -33.8 | 0 | 0 | 0 | 111.5 | P203 | P201-P203 VanDerWaalsContact O-CD 3.32Å; P201-P203 WeakPolarHBondContact O-CD 3.43Å |
| 202 | F | 44.3 | Very low | 44.3 | Very low | 174 Ų | 174 | 133 Ų | 133 | 76% | 0.763 | 71% | 0.714 | S | S | * | * | P | Polyproline II helix | trans | -58.5 | 116.9 | -175.1 | -83.6 | -92.4 | 0 | 0 | 0 | 113.3 | P200 R204 | P200-F202 PolarHBondContact O-N 3.06Å; P200-F202 VanDerWaalsContact O-N 3.13Å; F202-R204 PolarHBondContact O-N 3.19Å; F202-R204 VanDerWaalsContact O-N 3.1Å |
| 203 | P | 42.2 | Very low | 42.7 | Very low | 118 Ų | 118 | 131.5 Ų | 131.5 | 77% | 0.766 | 72% | 0.718 | S | S | * | * | trans | -74.8 | 101.8 | 171.2 | 30.4 | -32.3 | 0 | 0 | 0 | 109.7 | P201 A205 | P201-P203 VanDerWaalsContact O-CD 3.32Å; P201-P203 WeakPolarHBondContact O-CD 3.43Å; P203-A205 VanDerWaalsContact C-N 3.28Å; P203-A205 PolarHBondContact O-N 3.3Å | ||
| 204 | R | 42.1 | Very low | 41.6 | Very low | 248 Ų | 248 | 134.9 Ų | 134.9 | 94% | 0.936 | 73% | 0.731 | S | S | * | * | trans | -70.9 | 77 | 179.5 | -66.8 | -168.1 | -175 | -166 | 3 | 112.6 | F202 | F202-R204 PolarHBondContact O-N 3.19Å; F202-R204 VanDerWaalsContact O-N 3.1Å | ||
| 205 | A | 36.6 | Very low | 40.1 | Very low | 84 Ų | 84 | 140.9 Ų | 140.9 | 69% | 0.694 | 76% | 0.757 | S | S | * | * | trans | -86.6 | 114 | 167.4 | 0 | 0 | 0 | 0 | 0 | 110.7 | P203 | P203-A205 VanDerWaalsContact C-N 3.28Å; P203-A205 PolarHBondContact O-N 3.3Å | ||
| 206 | K | 39.6 | Very low | 39.2 | Very low | 169 Ų | 169 | 143.5 Ų | 143.5 | 74% | 0.735 | 77% | 0.772 | S | S | * | * | trans | 30.4 | 103.6 | 154.9 | -69.9 | 164.9 | 151.1 | -94.6 | 0 | 117.9 | E208 | K206-E208 WeakPolarHBondContact CG-OE1 3.3Å; K206-E208 IonicContact NZ-OE1 2.67Å; K206-E208 PolarHBondContact NZ-OE1 2.88Å | ||
| 207 | T | 32.2 | Very low | 39 | Very low | 138 Ų | 138 | 141.8 Ų | 141.8 | 85% | 0.847 | 77% | 0.773 | S | S | * | * | trans | -115 | 116.7 | 148.7 | -51.5 | 0 | 0 | 0 | 0 | 107.9 | V209 | T207-V209 HydrophobicContact CG2-CG2 4.49Š| ||
| 208 | E | 37.6 | Very low | 37.7 | Very low | 143 Ų | 143 | 141 Ų | 141 | 67% | 0.668 | 78% | 0.777 | S | S | * | * | trans | -121.5 | 101.5 | -177.1 | 33.6 | -158.6 | 124.7 | 0 | 0 | 109.5 | K206 | K206-E208 WeakPolarHBondContact CG-OE1 3.3Å; K206-E208 IonicContact NZ-OE1 2.67Å; K206-E208 PolarHBondContact NZ-OE1 2.88Å | ||
| 209 | V | 31.1 | Very low | 36.6 | Very low | 136 Ų | 136 | 145 Ų | 145 | 82% | 0.824 | 78% | 0.782 | S | S | * | * | trans | -129.1 | 135.7 | 176.1 | 176.4 | 0 | 0 | 0 | 0 | 109.2 | T207 | T207-V209 HydrophobicContact CG2-CG2 4.49Š| ||
| 210 | C | 29.2 | Very low | 35.9 | Very low | 88 Ų | 88 | 145 Ų | 145 | 60% | 0.595 | 80% | 0.796 | S | S | * | * | trans | -82.1 | 148.9 | -163.4 | -171 | 0 | 0 | 0 | 0 | 114.2 | S212 | C210-S212 PolarHBondContact SG-OG 3.42Š| ||
| 211 | W | 27.4 | Very low | 35.7 | Very low | 259 Ų | 259 | 148.1 Ų | 148.1 | 98% | 0.981 | 81% | 0.807 | S | S | * | * | trans | -129 | 130.1 | 137.5 | -82.8 | 105.2 | 0 | 0 | 0 | 108.7 | ||||
| 212 | S | 30.2 | Very low | 35.3 | Very low | 106 Ų | 106 | 151.5 Ų | 151.5 | 74% | 0.741 | 81% | 0.808 | S | S | * | * | trans | -86.1 | 148.2 | -176.5 | -63.7 | 0 | 0 | 0 | 0 | 112.5 | C210 | C210-S212 PolarHBondContact SG-OG 3.42Š| ||
| 213 | G | 28.3 | Very low | 35.6 | Very low | 78 Ų | 78 | 152.1 Ų | 152.1 | 80% | 0.804 | 82% | 0.816 | S | S | * | * | trans | -162.9 | 96 | 169.7 | 0 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 214 | E | 27.6 | Very low | 35.2 | Very low | 180 Ų | 180 | 152.9 Ų | 152.9 | 84% | 0.841 | 81% | 0.809 | S | S | * | * | trans | -84.6 | 139.3 | -171.9 | -62.4 | 173.4 | 109.6 | 0 | 0 | 112.4 | ||||
| 215 | N | 27.5 | Very low | 35.3 | Very low | 173 Ų | 173 | 146.7 Ų | 146.7 | 93% | 0.925 | 80% | 0.799 | S | S | * | * | trans | -169.1 | 161.9 | 135.3 | -100 | -49.8 | 0 | 0 | 0 | 111.1 | ||||
| 216 | S | 39 | Very low | 36 | Very low | 111 Ų | 111 | 153.3 Ų | 153.3 | 78% | 0.776 | 81% | 0.812 | S | S | * | * | trans | -120.5 | -160.1 | -151 | -149.4 | 0 | 0 | 0 | 0 | 114 | ||||
| 217 | P | 53.3 | Low | 36.8 | Very low | 110 Ų | 110 | 149 Ų | 149 | 71% | 0.714 | 80% | 0.803 | S | S | * | * | -129.8 | 148 | -112.1 | 39.8 | -22.2 | 0 | 0 | 0 | 117.1 | |||||
| 218 | V | 28 | Very low | 37.9 | Very low | 142 Ų | 142 | 148.1 Ų | 148.1 | 86% | 0.861 | 79% | 0.788 | S | S | * | * | trans | -142.1 | 111 | 158.9 | -179.4 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 219 | R | 31.3 | Very low | 39 | Very low | 232 Ų | 232 | 143.5 Ų | 143.5 | 88% | 0.875 | 78% | 0.779 | S | S | * | * | trans | 16.8 | 111.1 | 140.7 | -173.2 | -173.5 | -168.4 | 163.9 | 3.1 | 118.9 | ||||
| 220 | S | 32.8 | Very low | 40.7 | Very low | 128 Ų | 128 | 143.3 Ų | 143.3 | 90% | 0.895 | 77% | 0.772 | S | S | * | * | trans | -158.8 | 144.5 | 132.3 | -91.7 | 0 | 0 | 0 | 0 | 114 | ||||
| 221 | L | 43.7 | Very low | 43.1 | Very low | 168 Ų | 168 | 145.7 Ų | 145.7 | 88% | 0.88 | 77% | 0.772 | S | S | * | * | trans | -95.9 | 110.9 | -176.9 | 177.8 | 89.3 | 0 | 0 | 0 | 110.3 | ||||
| 222 | K | 37.9 | Very low | 45.7 | Very low | 197 Ų | 197 | 139.8 Ų | 139.8 | 86% | 0.857 | 76% | 0.756 | S | S | * | * | trans | -154.7 | 131.7 | 157.9 | -143.7 | 169.2 | -174.7 | 177.4 | 0 | 111.6 | E224 | K222-E224 PolarHBondContact O-N 3.47Š| ||
| 223 | M | 51 | Low | 48.1 | Very low | 187 Ų | 187 | 141.1 Ų | 141.1 | 92% | 0.921 | 75% | 0.75 | S | S | * | * | trans | -80.7 | 105.1 | 172.4 | -59.8 | 175.7 | -171.5 | 0 | 0 | 108.1 | ||||
| 224 | E | 33.9 | Very low | 51 | Low | 134 Ų | 134 | 144.1 Ų | 144.1 | 63% | 0.626 | 74% | 0.743 | S | S | * | * | trans | -108.5 | 127.5 | 174.7 | -165 | 179.7 | -160.7 | 0 | 0 | 109.9 | K222 K228 | K222-E224 PolarHBondContact O-N 3.47Å; E224-K228 WeakPolarHBondContact OE1-CE 3.15Å; E224-K228 IonicContact OE1-NZ 2.77Å; E224-K228 PolarHBondContact OE1-NZ 2.88Å; E224-K228 IonicContact OE2-NZ 2.65Å; E224-K228 PolarHBondContact OE2-NZ 3.4Å | ||
| 225 | T | 42.8 | Very low | 53.9 | Low | 118 Ų | 118 | 141.2 Ų | 141.2 | 72% | 0.724 | 73% | 0.73 | S | S | * | * | trans | -70.7 | 133.6 | -177.6 | 44.2 | 0 | 0 | 0 | 0 | 111.3 | S227 | T225-S227 PolarHBondContact O-N 3.31Š| ||
| 226 | K | 52.5 | Low | 56.8 | Low | 223 Ų | 223 | 139.4 Ų | 139.4 | 97% | 0.97 | 72% | 0.715 | S | S | * | * | S | Bend | trans | -69.8 | 84.8 | 179.2 | -70.9 | -178.7 | 175.6 | -179.7 | 0 | 111.6 | ||
| 227 | S | 55.9 | Low | 59.2 | Low | 77 Ų | 77 | 139.3 Ų | 139.3 | 54% | 0.538 | 70% | 0.703 | S | S | . | * | trans | -125.4 | -11.8 | 173.3 | 60.5 | 0 | 0 | 0 | 0 | 114.4 | T225 G229 L230 | T225-S227 PolarHBondContact O-N 3.31Å; S227-G229 PolarHBondContact O-N 3.23Å; S227-L230 PolarHBondContact O-N 3.21Å | ||
| 228 | K | 55.1 | Low | 61.1 | Low | 121 Ų | 121 | 141.6 Ų | 141.6 | 53% | 0.526 | 70% | 0.701 | S | S | . | * | H | α-helix | trans | -54.4 | -52.4 | -175.1 | -69.8 | 178.5 | 173.2 | 169.7 | 0 | 113.1 | E224 L230 K231 E232 | E224-K228 WeakPolarHBondContact OE1-CE 3.15Å; E224-K228 IonicContact OE1-NZ 2.77Å; E224-K228 PolarHBondContact OE1-NZ 2.88Å; E224-K228 IonicContact OE2-NZ 2.65Å; E224-K228 PolarHBondContact OE2-NZ 3.4Å; K228-L230 VanDerWaalsContact C-N 3.31Å; K228-L230 PolarHBondContact O-N 3.39Å; K228-K231 PolarHBondContact O-N 2.99Å; K228-K231 VanDerWaalsContact O-N 3.16Å; K228-E232 WeakPolarHBondContact O-CB 3.33Å; K228-E232 PolarHBondContact O-N 2.94Å |
| 229 | G | 60.9 | Low | 64.2 | Low | 46 Ų | 46 | 142.4 Ų | 142.4 | 47% | 0.474 | 69% | 0.693 | S | S | . | * | H | α-helix | trans | -59.2 | -33 | -175.5 | 0 | 0 | 0 | 0 | 0 | 115 | S227 Q233 | S227-G229 PolarHBondContact O-N 3.23Å; G229-Q233 WeakPolarHBondContact O-CB 3.45Å; G229-Q233 PolarHBondContact O-N 2.99Å |
| 230 | L | 65.8 | Low | 67.1 | Low | 132 Ų | 132 | 135.9 Ų | 135.9 | 69% | 0.691 | 68% | 0.675 | S | S | * | * | H | α-helix | trans | -68.7 | -42.9 | 178.4 | -174.2 | 71.2 | 0 | 0 | 0 | 111.5 | S227 K228 Q234 | S227-L230 PolarHBondContact O-N 3.21Å; K228-L230 VanDerWaalsContact C-N 3.31Å; K228-L230 PolarHBondContact O-N 3.39Å; L230-Q234 WeakPolarHBondContact O-CB 3.46Å; L230-Q234 PolarHBondContact O-N 3.38Å |
| 231 | K | 80.4 | Confident | 69.8 | Low | 138 Ų | 138 | 133.6 Ų | 133.6 | 60% | 0.6 | 65% | 0.653 | S | S | * | * | H | α-helix | trans | -68.9 | -37.9 | 178.1 | -172.3 | 176 | -179.2 | 179.7 | 0 | 111.4 | K228 Q234 Q235 | K228-K231 PolarHBondContact O-N 2.99Å; K228-K231 VanDerWaalsContact O-N 3.16Å; K231-Q234 PolarHBondContact O-N 3Å; K231-Q235 WeakPolarHBondContact O-CB 3.42Å; K231-Q235 WeakPolarHBondContact O-CG 3.31Å; K231-Q235 PolarHBondContact O-N 3.26Å |
| 232 | E | 81.1 | Confident | 71.9 | Confident | 135 Ų | 135 | 127.9 Ų | 127.9 | 63% | 0.631 | 63% | 0.63 | S | S | * | * | H | α-helix | trans | -68.8 | -42.6 | 177.3 | -166.6 | 160.6 | -147.3 | 0 | 0 | 111.6 | K228 Q234 Q235 H236 | K228-E232 WeakPolarHBondContact O-CB 3.33Å; K228-E232 PolarHBondContact O-N 2.94Å; E232-Q234 PolarHBondContact O-N 3.49Å; E232-Q235 PolarHBondContact O-N 3.19Å; E232-H236 WeakPolarHBondContact O-CB 3.31Å; E232-H236 PolarHBondContact O-N 3.27Å |
| 233 | Q | 82.4 | Confident | 74 | Confident | 134 Ų | 134 | 120.7 Ų | 120.7 | 63% | 0.626 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -60.7 | -42.7 | 170.4 | -176.3 | -176.8 | 4.6 | 0 | 0 | 111.9 | G229 H236 H237 | G229-Q233 WeakPolarHBondContact O-CB 3.45Å; G229-Q233 PolarHBondContact O-N 2.99Å; Q233-H236 PolarHBondContact O-N 3.18Å; Q233-H237 WeakPolarHBondContact O-CB 3.39Å; Q233-H237 PolarHBondContact O-N 3.38Å |
| 234 | Q | 87.6 | Confident | 75.4 | Confident | 140 Ų | 140 | 117.1 Ų | 117.1 | 65% | 0.654 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -66.4 | -36.3 | 177.1 | -170.9 | 177.8 | 63.8 | 0 | 0 | 112 | L230 K231 E232 K238 | L230-Q234 WeakPolarHBondContact O-CB 3.46Å; L230-Q234 PolarHBondContact O-N 3.38Å; K231-Q234 PolarHBondContact O-N 3Å; E232-Q234 PolarHBondContact O-N 3.49Å; Q234-K238 WeakPolarHBondContact O-CB 3.2Å; Q234-K238 PolarHBondContact O-N 2.87Å |
| 235 | Q | 89.1 | Confident | 77.5 | Confident | 120 Ų | 120 | 116.9 Ų | 116.9 | 56% | 0.561 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -69.6 | -39.4 | 172.6 | -76.1 | 179.6 | -20.4 | 0 | 0 | 112.3 | K231 E232 K238 K239 | K231-Q235 WeakPolarHBondContact O-CB 3.42Å; K231-Q235 WeakPolarHBondContact O-CG 3.31Å; K231-Q235 PolarHBondContact O-N 3.26Å; E232-Q235 PolarHBondContact O-N 3.19Å; Q235-K238 PolarHBondContact O-N 3.17Å; Q235-K239 WeakPolarHBondContact O-CB 3.29Å; Q235-K239 PolarHBondContact O-N 3.27Å |
| 236 | H | 88.5 | Confident | 78.7 | Confident | 135 Ų | 135 | 115.2 Ų | 115.2 | 63% | 0.625 | 59% | 0.585 | S | S | * | * | H | α-helix | trans | -62.9 | -46.1 | 173.8 | -174.6 | -88.9 | 0 | 0 | 0 | 111.6 | E232 Q233 K239 L240 | E232-H236 WeakPolarHBondContact O-CB 3.31Å; E232-H236 PolarHBondContact O-N 3.27Å; Q233-H236 PolarHBondContact O-N 3.18Å; H236-K239 PolarHBondContact O-N 2.8Å; H236-L240 PolarHBondContact O-N 2.67Å |
| 237 | H | 89.2 | Confident | 78.9 | Confident | 109 Ų | 109 | 112.4 Ų | 112.4 | 51% | 0.505 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -61.7 | -44.9 | 175.1 | 177.7 | 55 | 0 | 0 | 0 | 111.9 | Q233 K239 L240 L241 | Q233-H237 WeakPolarHBondContact O-CB 3.39Å; Q233-H237 PolarHBondContact O-N 3.38Å; H237-K239 VanDerWaalsContact C-N 3.3Å; H237-K239 PolarHBondContact O-N 2.67Å; H237-L240 PolarHBondContact O-N 2.89Å; H237-L241 WeakPolarHBondContact O-CG 3.34Å; H237-L241 PolarHBondContact O-N 3.33Å |
| 238 | K | 93.8 | Very high | 78.9 | Confident | 158 Ų | 158 | 114.6 Ų | 114.6 | 69% | 0.687 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -59.2 | -40.1 | 172.8 | -178.7 | 176.7 | 177.3 | 178.7 | 0 | 112.1 | Q234 Q235 A242 | Q234-K238 WeakPolarHBondContact O-CB 3.2Å; Q234-K238 PolarHBondContact O-N 2.87Å; Q235-K238 PolarHBondContact O-N 3.17Å; K238-A242 WeakPolarHBondContact O-CB 3.4Å; K238-A242 PolarHBondContact O-N 3.21Å |
| 239 | K | 92.5 | Very high | 78.5 | Confident | 159 Ų | 159 | 113 Ų | 113 | 69% | 0.691 | 59% | 0.585 | S | S | * | * | H | α-helix | trans | -66.7 | -39.5 | 177.4 | -171.9 | -178.2 | 178 | -173.6 | 0 | 111.8 | Q235 H236 H237 A242 A243 | Q235-K239 WeakPolarHBondContact O-CB 3.29Å; Q235-K239 PolarHBondContact O-N 3.27Å; H236-K239 PolarHBondContact O-N 2.8Å; H237-K239 VanDerWaalsContact C-N 3.3Å; H237-K239 PolarHBondContact O-N 2.67Å; K239-A242 PolarHBondContact O-N 3.39Å; K239-A243 WeakPolarHBondContact O-CB 3.32Å; K239-A243 PolarHBondContact O-N 2.95Å |
| 240 | L | 91.8 | Very high | 78 | Confident | 94 Ų | 94 | 120.7 Ų | 120.7 | 49% | 0.492 | 61% | 0.606 | S | S | . | * | H | α-helix | trans | -63.9 | -47.8 | 175.9 | -179.3 | 62.6 | 0 | 0 | 0 | 111.5 | H236 H237 A242 A243 M244 | H236-L240 PolarHBondContact O-N 2.67Å; H237-L240 PolarHBondContact O-N 2.89Å; L240-A242 VanDerWaalsContact C-N 3.34Å; L240-A242 PolarHBondContact O-N 3.45Å; L240-A243 PolarHBondContact O-N 3.03Å; L240-A243 VanDerWaalsContact O-N 3.15Å; L240-M244 PolarHBondContact O-N 2.96Å |
| 241 | L | 89.4 | Confident | 77 | Confident | 81 Ų | 81 | 121.3 Ų | 121.3 | 42% | 0.424 | 61% | 0.61 | S | S | . | * | H | α-helix | trans | -59.3 | -44 | 175.2 | -69.6 | 174.1 | 0 | 0 | 0 | 111.9 | H237 A243 M244 L245 | H237-L241 WeakPolarHBondContact O-CG 3.34Å; H237-L241 PolarHBondContact O-N 3.33Å; L241-A243 VanDerWaalsContact C-N 3.31Å; L241-A243 PolarHBondContact O-N 3.45Å; L241-M244 PolarHBondContact O-N 3.41Å; L241-L245 WeakPolarHBondContact O-CG 3.48Å; L241-L245 PolarHBondContact O-N 3.01Å |
| 242 | A | 87.8 | Confident | 74.8 | Confident | 48 Ų | 48 | 120.7 Ų | 120.7 | 40% | 0.397 | 62% | 0.623 | S | S | . | * | H | α-helix | trans | -63.6 | -36 | 176 | 0 | 0 | 0 | 0 | 0 | 112.5 | K238 K239 L240 S246 | K238-A242 WeakPolarHBondContact O-CB 3.4Å; K238-A242 PolarHBondContact O-N 3.21Å; K239-A242 PolarHBondContact O-N 3.39Å; L240-A242 VanDerWaalsContact C-N 3.34Å; L240-A242 PolarHBondContact O-N 3.45Å; A242-S246 WeakPolarHBondContact O-CB 3.39Å; A242-S246 PolarHBondContact O-N 2.92Å; A242-S246 PolarHBondContact O-OG 2.98Å |
| 243 | A | 83.4 | Confident | 73.1 | Confident | 46 Ų | 46 | 120 Ų | 120 | 38% | 0.38 | 63% | 0.627 | S | S | . | * | H | α-helix | trans | -69.5 | -38.5 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | K239 L240 L241 S246 | K239-A243 WeakPolarHBondContact O-CB 3.32Å; K239-A243 PolarHBondContact O-N 2.95Å; L240-A243 PolarHBondContact O-N 3.03Å; L240-A243 VanDerWaalsContact O-N 3.15Å; L241-A243 VanDerWaalsContact C-N 3.31Å; L241-A243 PolarHBondContact O-N 3.45Å; A243-S246 PolarHBondContact O-N 3.06Å |
| 244 | M | 79.1 | Confident | 71.1 | Confident | 112 Ų | 112 | 120.6 Ų | 120.6 | 55% | 0.552 | 64% | 0.635 | S | S | * | * | H | α-helix | trans | -61.1 | -53.8 | 171.3 | -68.5 | 173.9 | 65 | 0 | 0 | 110.5 | L240 L241 S246 Q247 | L240-M244 PolarHBondContact O-N 2.96Å; L241-M244 PolarHBondContact O-N 3.41Å; M244-S246 PolarHBondContact O-N 2.76Å; M244-Q247 WeakPolarHBondContact O-CB 3.31Å; M244-Q247 PolarHBondContact O-N 2.99Å |
| 245 | L | 77.9 | Confident | 68.3 | Low | 128 Ų | 128 | 119.2 Ų | 119.2 | 67% | 0.67 | 64% | 0.641 | S | S | * | * | H | α-helix | trans | -63.7 | -12 | 178.8 | -65.6 | 169.4 | 0 | 0 | 0 | 114.3 | L241 | L241-L245 WeakPolarHBondContact O-CG 3.48Å; L241-L245 PolarHBondContact O-N 3.01Å |
| 246 | S | 68.7 | Low | 66.2 | Low | 83 Ų | 83 | 119.1 Ų | 119.1 | 58% | 0.58 | 65% | 0.65 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89.8 | -9.1 | 173.9 | -57.7 | 0 | 0 | 0 | 0 | 113.2 | A242 A243 M244 | A242-S246 WeakPolarHBondContact O-CB 3.39Å; A242-S246 PolarHBondContact O-N 2.92Å; A242-S246 PolarHBondContact O-OG 2.98Å; A243-S246 PolarHBondContact O-N 3.06Å; M244-S246 PolarHBondContact O-N 2.76Å |
| 247 | Q | 56.7 | Low | 63.7 | Low | 165 Ų | 165 | 117.7 Ų | 117.7 | 77% | 0.771 | 66% | 0.662 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -85.1 | -24.4 | 174.3 | -68 | 177.7 | 1.2 | 0 | 0 | 111.9 | M244 S249 | M244-Q247 WeakPolarHBondContact O-CB 3.31Å; M244-Q247 PolarHBondContact O-N 2.99Å; Q247-S249 VanDerWaalsContact C-N 3.29Å; Q247-S249 PolarHBondContact O-N 3.26Å |
| 248 | D | 55.8 | Low | 60.9 | Low | 122 Ų | 122 | 118.4 Ų | 118.4 | 65% | 0.652 | 68% | 0.679 | S | S | * | * | S | Bend | trans | -87.2 | 7.4 | 175.6 | -50.9 | -47.1 | 0 | 0 | 0 | 113.3 | F250 | D248-F250 PolarHBondContact O-N 2.68Š|
| 249 | S | 46.9 | Very low | 58.2 | Low | 89 Ų | 89 | 115.8 Ų | 115.8 | 62% | 0.622 | 68% | 0.681 | S | S | * | * | trans | -88.1 | 95 | -177.2 | -175.2 | 0 | 0 | 0 | 0 | 111.4 | Q247 D251 | Q247-S249 VanDerWaalsContact C-N 3.29Å; Q247-S249 PolarHBondContact O-N 3.26Å; S249-D251 PolarHBondContact O-N 2.83Å; S249-D251 VanDerWaalsContact O-N 3.1Å | ||
| 250 | F | 50.9 | Low | 55.9 | Low | 206 Ų | 206 | 114.4 Ų | 114.4 | 90% | 0.904 | 69% | 0.685 | S | S | * | * | trans | -58.5 | 106.5 | 174.7 | -76.3 | -104.8 | 0 | 0 | 0 | 112.6 | D248 | D248-F250 PolarHBondContact O-N 2.68Š| ||
| 251 | D | 43.8 | Very low | 53.7 | Low | 146 Ų | 146 | 115.5 Ų | 115.5 | 78% | 0.781 | 70% | 0.696 | S | S | * | * | trans | -156.3 | 85.8 | 160.5 | -148.7 | -9.4 | 0 | 0 | 0 | 111.8 | S249 | S249-D251 PolarHBondContact O-N 2.83Å; S249-D251 VanDerWaalsContact O-N 3.1Å | ||
| 252 | S | 35.1 | Very low | 51.6 | Low | 125 Ų | 125 | 121 Ų | 121 | 87% | 0.874 | 72% | 0.72 | S | S | * | * | trans | -157.5 | 67.8 | 175 | -161.4 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 253 | V | 44.2 | Very low | 49.8 | Very low | 120 Ų | 120 | 127 Ų | 127 | 73% | 0.727 | 74% | 0.739 | S | S | * | * | trans | -84.3 | 139 | 179.8 | -79.1 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 254 | N | 40.4 | Very low | 48.3 | Very low | 147 Ų | 147 | 132.9 Ų | 132.9 | 79% | 0.786 | 76% | 0.759 | S | S | * | * | trans | 65.8 | 109.4 | 165.2 | -56.5 | -10.2 | 0 | 0 | 0 | 116.7 | ||||
| 255 | S | 30.2 | Very low | 47.1 | Very low | 111 Ų | 111 | 134.6 Ų | 134.6 | 78% | 0.776 | 77% | 0.769 | S | S | * | * | 175.5 | 168.2 | 75.6 | -61.9 | 0 | 0 | 0 | 0 | 110.5 | |||||
| 256 | P | 44.1 | Very low | 46.3 | Very low | 117 Ų | 117 | 137.1 Ų | 137.1 | 76% | 0.76 | 78% | 0.777 | S | S | * | * | cis | -130.5 | 160.3 | -47.6 | 37.9 | -23.9 | 0 | 0 | 0 | 112.7 | ||||
| 257 | A | 35.2 | Very low | 46.2 | Very low | 106 Ų | 106 | 139.2 Ų | 139.2 | 88% | 0.876 | 78% | 0.782 | S | S | * | * | trans | 49.7 | 93.8 | 158.3 | 0 | 0 | 0 | 0 | 0 | 118.9 | ||||
| 258 | S | 30.5 | Very low | 46.3 | Very low | 123 Ų | 123 | 140.5 Ų | 140.5 | 86% | 0.86 | 79% | 0.788 | S | S | * | * | trans | -130.1 | 126.2 | 142.3 | -173.9 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 259 | S | 38.3 | Very low | 46.6 | Very low | 104 Ų | 104 | 142.2 Ų | 142.2 | 73% | 0.727 | 80% | 0.797 | S | S | * | * | trans | -78.7 | 143.1 | 171.5 | 54.4 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 260 | V | 43.2 | Very low | 47.5 | Very low | 129 Ų | 129 | 146 Ų | 146 | 78% | 0.782 | 81% | 0.81 | S | S | * | * | trans | 170.2 | 127.1 | 133.5 | 147.6 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 261 | V | 45.5 | Very low | 48 | Very low | 117 Ų | 117 | 140.3 Ų | 140.3 | 71% | 0.709 | 80% | 0.801 | S | S | * | * | trans | 41 | 106.1 | 163.4 | 179.9 | 0 | 0 | 0 | 0 | 116.3 | E263 | V261-E263 HydrophobicContact CG1-CB 4.25Å; V261-E263 PolarHBondContact O-N 2.9Å | ||
| 262 | E | 46.6 | Very low | 48.7 | Very low | 198 Ų | 198 | 141.8 Ų | 141.8 | 93% | 0.925 | 81% | 0.806 | S | S | * | * | trans | -70.6 | 120.3 | 145.1 | -65.8 | -170.6 | 154 | 0 | 0 | 106.7 | ||||
| 263 | E | 49.8 | Very low | 50.1 | Low | 172 Ų | 172 | 145 Ų | 145 | 80% | 0.804 | 81% | 0.807 | S | S | * | * | trans | -87.3 | 110.1 | 173.7 | -168.7 | 161.4 | -140.5 | 0 | 0 | 107.2 | V261 I265 | V261-E263 HydrophobicContact CG1-CB 4.25Å; V261-E263 PolarHBondContact O-N 2.9Å; E263-I265 PolarHBondContact O-N 3.43Å | ||
| 264 | E | 50.5 | Low | 50.8 | Low | 171 Ų | 171 | 147.6 Ų | 147.6 | 80% | 0.799 | 82% | 0.816 | S | S | * | * | trans | -67 | 99.6 | -176.6 | -171.2 | 162.9 | -149.1 | 0 | 0 | 109.1 | E266 | E264-E266 PolarHBondContact O-N 3.28Š| ||
| 265 | I | 55.8 | Low | 52.2 | Low | 148 Ų | 148 | 148.8 Ų | 148.8 | 76% | 0.759 | 82% | 0.821 | S | S | * | * | trans | -73.3 | 83.6 | 172 | 43 | 171.8 | 0 | 0 | 0 | 109.4 | E263 D267 | E263-I265 PolarHBondContact O-N 3.43Å; I265-D267 VanDerWaalsContact C-N 3.33Å; I265-D267 PolarHBondContact O-N 2.83Å | ||
| 266 | E | 60.3 | Low | 54.2 | Low | 180 Ų | 180 | 150.6 Ų | 150.6 | 84% | 0.841 | 82% | 0.817 | S | S | * | * | trans | -82.6 | 71 | 174 | -169.3 | 176.1 | -131.9 | 0 | 0 | 109.4 | E264 | E264-E266 PolarHBondContact O-N 3.28Š| ||
| 267 | D | 65.4 | Low | 55.9 | Low | 127 Ų | 127 | 150.2 Ų | 150.2 | 68% | 0.679 | 81% | 0.809 | S | S | * | * | trans | -110.3 | 17.6 | 178.8 | 70.8 | -32.2 | 0 | 0 | 0 | 114.3 | I265 D269 | I265-D267 VanDerWaalsContact C-N 3.33Å; I265-D267 PolarHBondContact O-N 2.83Å; D267-D269 PolarHBondContact O-N 3.39Å | ||
| 268 | E | 60.3 | Low | 58.1 | Low | 193 Ų | 193 | 150.9 Ų | 150.9 | 90% | 0.902 | 80% | 0.797 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92.5 | 14.7 | -171.8 | -154.8 | 151.7 | -138 | 0 | 0 | 114.9 | ||
| 269 | D | 62.3 | Low | 60.6 | Low | 157 Ų | 157 | 149.2 Ų | 149.2 | 84% | 0.84 | 78% | 0.778 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -118.5 | -5.4 | -178 | -127.4 | 0.4 | 0 | 0 | 0 | 114.6 | D267 A271 | D267-D269 PolarHBondContact O-N 3.39Å; D269-A271 PolarHBondContact O-N 3.23Å |
| 270 | D | 65.1 | Low | 62.9 | Low | 168 Ų | 168 | 148.3 Ų | 148.3 | 90% | 0.898 | 77% | 0.766 | S | S | * | * | trans | -71.2 | 18.3 | -178.2 | -104.2 | 7.2 | 0 | 0 | 0 | 114.3 | ||||
| 271 | A | 62.2 | Low | 64.8 | Low | 87 Ų | 87 | 143.7 Ų | 143.7 | 72% | 0.719 | 74% | 0.736 | S | S | * | * | trans | -106.7 | 26.6 | -163.8 | 0 | 0 | 0 | 0 | 0 | 115.8 | D269 | D269-A271 PolarHBondContact O-N 3.23Š| ||
| 272 | M | 58.8 | Low | 66.7 | Low | 178 Ų | 178 | 144.8 Ų | 144.8 | 88% | 0.877 | 73% | 0.728 | S | S | * | * | trans | -150.8 | 85.3 | 172.9 | -86.1 | -165 | -64.3 | 0 | 0 | 115.2 | ||||
| 273 | E | 63.1 | Low | 68.3 | Low | 192 Ų | 192 | 142.4 Ų | 142.4 | 90% | 0.897 | 72% | 0.719 | S | S | * | * | trans | -155.2 | 83.4 | 151.7 | -125.9 | 169.4 | -139.3 | 0 | 0 | 112 | ||||
| 274 | L | 58.6 | Low | 70.1 | Confident | 175 Ų | 175 | 141.8 Ų | 141.8 | 92% | 0.916 | 72% | 0.715 | S | S | * | * | trans | -141.3 | 46.7 | 176.4 | -73.9 | 178.9 | 0 | 0 | 0 | 111.7 | ||||
| 275 | L | 71.2 | Confident | 71.5 | Confident | 172 Ų | 172 | 135.9 Ų | 135.9 | 90% | 0.901 | 70% | 0.701 | S | S | * | * | trans | -118.5 | 105.7 | 165.6 | -68 | 177.5 | 0 | 0 | 0 | 107.8 | ||||
| 276 | E | 70.8 | Confident | 72.6 | Confident | 149 Ų | 149 | 132 Ų | 132 | 70% | 0.696 | 68% | 0.684 | S | S | * | * | trans | -58.8 | 135.3 | 177.3 | -66.8 | 160.1 | 169.3 | 0 | 0 | 110.3 | L281 | E276-L281 HydrophobicContact CB-CD1 4.27Å; E276-L281 HydrophobicContact CB-CD2 4.35Å; E276-L281 HydrophobicContact CB-CG 4.14Å | ||
| 277 | D | 81.5 | Confident | 73.4 | Confident | 109 Ų | 109 | 129.6 Ų | 129.6 | 58% | 0.583 | 68% | 0.682 | S | S | * | * | trans | -65.6 | 141.1 | -172.9 | -118.2 | -29.1 | 0 | 0 | 0 | 111.2 | D279 D280 L281 | D277-D279 PolarHBondContact O-N 3.49Å; D277-D280 HydrophobicContact CB-CB 4.35Å; D277-D280 PolarHBondContact O-N 3.08Å; D277-L281 PolarHBondContact O-N 3.19Å | ||
| 278 | L | 80.6 | Confident | 73.6 | Confident | 120 Ų | 120 | 127.3 Ų | 127.3 | 63% | 0.628 | 69% | 0.688 | S | S | * | * | H | α-helix | trans | -62.8 | -17.7 | 177.1 | -67 | 177.2 | 0 | 0 | 0 | 112.5 | R282 L289 | L278-R282 VanDerWaalsContact O-CB 3.29Å; L278-R282 WeakPolarHBondContact O-CB 3.48Å; L278-R282 PolarHBondContact O-N 3.36Å; L278-L289 HydrophobicContact CD2-CD1 3.97Å |
| 279 | D | 82.8 | Confident | 73.9 | Confident | 87 Ų | 87 | 122.8 Ų | 122.8 | 47% | 0.465 | 67% | 0.669 | S | S | . | * | H | α-helix | trans | -81.2 | -38.8 | 174 | -85.7 | 36.6 | 0 | 0 | 0 | 111.9 | D277 R282 M283 | D277-D279 PolarHBondContact O-N 3.49Å; D279-R282 WeakPolarHBondContact O-CB 3.31Å; D279-R282 PolarHBondContact O-N 3.44Å; D279-R282 IonicContact OD1-CZ 2.62Å; D279-R282 IonicContact OD1-NH1 2.69Å; D279-R282 PolarHBondContact OD1-NH1 3.27Å; D279-R282 IonicContact OD1-NH2 3.48Å; D279-R282 PolarHBondContact OD1-NH2 2.61Å; D279-R282 IonicContact OD2-CZ 2.68Å; D279-R282 IonicContact OD2-NH1 3.84Å; D279-R282 PolarHBondContact OD2-NH1 3.36Å; D279-R282 IonicContact OD2-NH2 3.45Å; D279-R282 PolarHBondContact OD2-NH2 3.28Å; D279-M283 WeakPolarHBondContact O-CG 3.24Å; D279-M283 PolarHBondContact O-N 3.28Å |
| 280 | D | 87.4 | Confident | 73.9 | Confident | 86 Ų | 86 | 119.2 Ų | 119.2 | 46% | 0.46 | 66% | 0.662 | S | S | . | * | H | α-helix | trans | -70.9 | -47.7 | 175.5 | -75 | -24.4 | 0 | 0 | 0 | 111.4 | D277 R282 M283 E284 | D277-D280 HydrophobicContact CB-CB 4.35Å; D277-D280 PolarHBondContact O-N 3.08Å; D280-R282 PolarHBondContact O-N 3.01Å; D280-R282 VanDerWaalsContact O-N 3.13Å; D280-M283 CarbonylContact O-C 3.51Å; D280-M283 WeakPolarHBondContact O-CA 3.47Å; D280-M283 WeakPolarHBondContact O-CB 3.42Å; D280-M283 PolarHBondContact O-N 2.93Å; D280-E284 PolarHBondContact O-N 2.91Å |
| 281 | L | 81.7 | Confident | 73.7 | Confident | 32 Ų | 32 | 117.5 Ų | 117.5 | 17% | 0.168 | 66% | 0.66 | C | S | . | * | H | α-helix | trans | -55.3 | -33 | 172.5 | -70.8 | 170 | 0 | 0 | 0 | 111.9 | E276 D277 G285 V286 L289 | E276-L281 HydrophobicContact CB-CD1 4.27Å; E276-L281 HydrophobicContact CB-CD2 4.35Å; E276-L281 HydrophobicContact CB-CG 4.14Å; D277-L281 PolarHBondContact O-N 3.19Å; L281-G285 PolarHBondContact O-N 3.44Å; L281-V286 HydrophobicContact CB-CB 4.37Å; L281-V286 HydrophobicContact CB-CG2 4.5Å; L281-V286 HydrophobicContact CD2-CG2 4.34Å; L281-V286 VanDerWaalsContact O-CB 3.22Å; L281-V286 WeakPolarHBondContact O-CB 3.5Å; L281-V286 WeakPolarHBondContact O-CG2 3.49Å; L281-V286 PolarHBondContact O-N 3.43Å; L281-L289 HydrophobicContact CD1-CD1 4.22Å |
| 282 | R | 85 | Confident | 73.5 | Confident | 139 Ų | 139 | 119.1 Ų | 119.1 | 53% | 0.525 | 67% | 0.666 | S | S | . | * | H | α-helix | trans | -72.2 | -36 | 173.4 | -177.2 | -176.9 | 68.2 | -122.9 | 1.9 | 112.3 | L278 D279 D280 E284 G285 | L278-R282 VanDerWaalsContact O-CB 3.29Å; L278-R282 WeakPolarHBondContact O-CB 3.48Å; L278-R282 PolarHBondContact O-N 3.36Å; D279-R282 WeakPolarHBondContact O-CB 3.31Å; D279-R282 PolarHBondContact O-N 3.44Å; D279-R282 IonicContact OD1-CZ 2.62Å; D279-R282 IonicContact OD1-NH1 2.69Å; D279-R282 PolarHBondContact OD1-NH1 3.27Å; D279-R282 IonicContact OD1-NH2 3.48Å; D279-R282 PolarHBondContact OD1-NH2 2.61Å; D279-R282 IonicContact OD2-CZ 2.68Å; D279-R282 IonicContact OD2-NH1 3.84Å; D279-R282 PolarHBondContact OD2-NH1 3.36Å; D279-R282 IonicContact OD2-NH2 3.45Å; D279-R282 PolarHBondContact OD2-NH2 3.28Å; D280-R282 PolarHBondContact O-N 3.01Å; D280-R282 VanDerWaalsContact O-N 3.13Å; R282-E284 VanDerWaalsContact C-N 3.34Å; R282-G285 PolarHBondContact O-N 2.96Å; R282-G285 VanDerWaalsContact O-N 3.14Å |
| 283 | M | 81.1 | Confident | 73 | Confident | 149 Ų | 149 | 113.5 Ų | 113.5 | 73% | 0.734 | 65% | 0.653 | S | S | * | * | H | α-helix | trans | -69.5 | -30.6 | 173.1 | -67.3 | -152.3 | -64.1 | 0 | 0 | 112.7 | D279 D280 G285 | D279-M283 WeakPolarHBondContact O-CG 3.24Å; D279-M283 PolarHBondContact O-N 3.28Å; D280-M283 CarbonylContact O-C 3.51Å; D280-M283 WeakPolarHBondContact O-CA 3.47Å; D280-M283 WeakPolarHBondContact O-CB 3.42Å; D280-M283 PolarHBondContact O-N 2.93Å; M283-G285 PolarHBondContact O-N 3.46Å |
| 284 | E | 86.8 | Confident | 72.3 | Confident | 158 Ų | 158 | 111.8 Ų | 111.8 | 74% | 0.738 | 65% | 0.651 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72.6 | -6.3 | 169 | -63 | -162.3 | 155.5 | 0 | 0 | 113.7 | D280 R282 | D280-E284 PolarHBondContact O-N 2.91Å; R282-E284 VanDerWaalsContact C-N 3.34Å |
| 285 | G | 80.2 | Confident | 72 | Confident | 48 Ų | 48 | 112.8 Ų | 112.8 | 50% | 0.495 | 65% | 0.648 | S | S | . | * | T | Hydrogen-bonded Turn | trans | 88.3 | 14.5 | 176.1 | 0 | 0 | 0 | 0 | 0 | 115.1 | L281 R282 M283 T287 | L281-G285 PolarHBondContact O-N 3.44Å; R282-G285 PolarHBondContact O-N 2.96Å; R282-G285 VanDerWaalsContact O-N 3.14Å; M283-G285 PolarHBondContact O-N 3.46Å; G285-T287 VanDerWaalsContact C-N 3.3Å; G285-T287 PolarHBondContact O-N 2.88Å |
| 286 | V | 78.9 | Confident | 70.7 | Confident | 65 Ų | 65 | 113.8 Ų | 113.8 | 39% | 0.394 | 65% | 0.645 | S | S | . | * | trans | -72.1 | 82.4 | 177.2 | -171.9 | 0 | 0 | 0 | 0 | 110.5 | L281 L289 | L281-V286 HydrophobicContact CB-CB 4.37Å; L281-V286 HydrophobicContact CB-CG2 4.5Å; L281-V286 HydrophobicContact CD2-CG2 4.34Å; L281-V286 VanDerWaalsContact O-CB 3.22Å; L281-V286 WeakPolarHBondContact O-CB 3.5Å; L281-V286 WeakPolarHBondContact O-CG2 3.49Å; L281-V286 PolarHBondContact O-N 3.43Å; V286-L289 HydrophobicContact CG1-CD1 4.26Å; V286-L289 HydrophobicContact CG1-CD2 4.09Å; V286-L289 HydrophobicContact CG1-CG 4.05Å | ||
| 287 | T | 77.8 | Confident | 69.5 | Low | 131 Ų | 131 | 112.1 Ų | 112.1 | 80% | 0.804 | 65% | 0.65 | S | S | * | * | trans | -87.5 | 135.9 | 175.9 | 60.7 | 0 | 0 | 0 | 0 | 111.7 | G285 | G285-T287 VanDerWaalsContact C-N 3.3Å; G285-T287 PolarHBondContact O-N 2.88Å | ||
| 288 | G | 69.3 | Low | 67.9 | Low | 79 Ų | 79 | 115.6 Ų | 115.6 | 81% | 0.814 | 66% | 0.662 | S | S | * | * | trans | 108.5 | 8.2 | 172.2 | 0 | 0 | 0 | 0 | 0 | 116.6 | A290 | G288-A290 PolarHBondContact O-N 3.34Š| ||
| 289 | L | 66.9 | Low | 66.3 | Low | 97 Ų | 97 | 113 Ų | 113 | 51% | 0.508 | 66% | 0.664 | S | S | . | * | trans | -59.8 | 119.4 | 170.3 | -62.2 | 178.8 | 0 | 0 | 0 | 110.5 | L278 L281 V286 | L278-L289 HydrophobicContact CD2-CD1 3.97Å; L281-L289 HydrophobicContact CD1-CD1 4.22Å; V286-L289 HydrophobicContact CG1-CD1 4.26Å; V286-L289 HydrophobicContact CG1-CD2 4.09Å; V286-L289 HydrophobicContact CG1-CG 4.05Å | ||
| 290 | A | 63.2 | Low | 64.3 | Low | 82 Ų | 82 | 120.6 Ų | 120.6 | 68% | 0.678 | 69% | 0.687 | S | S | * | * | trans | -70.7 | 136.5 | 171.2 | 0 | 0 | 0 | 0 | 0 | 109.6 | G288 S292 | G288-A290 PolarHBondContact O-N 3.34Å; A290-S292 VanDerWaalsContact C-N 3.32Å; A290-S292 PolarHBondContact O-N 2.84Å | ||
| 291 | P | 59.4 | Low | 62.4 | Low | 133 Ų | 133 | 121.9 Ų | 121.9 | 86% | 0.864 | 70% | 0.703 | S | S | * | * | trans | -65.6 | 82.3 | 179.7 | -25.3 | 36.3 | 0 | 0 | 0 | 113.8 | G293 | P291-G293 PolarHBondContact O-N 2.72Š| ||
| 292 | S | 57.7 | Low | 60.3 | Low | 121 Ų | 121 | 125.2 Ų | 125.2 | 85% | 0.846 | 73% | 0.729 | S | S | * | * | trans | -77.4 | 46.9 | -178.5 | -172.7 | 0 | 0 | 0 | 0 | 113.1 | A290 N294 | A290-S292 VanDerWaalsContact C-N 3.32Å; A290-S292 PolarHBondContact O-N 2.84Å; S292-N294 PolarHBondContact O-N 3.22Å | ||
| 293 | G | 49.7 | Very low | 58.3 | Low | 59 Ų | 59 | 129.8 Ų | 129.8 | 61% | 0.608 | 75% | 0.748 | S | S | * | * | trans | -88.3 | 84 | -177.8 | 0 | 0 | 0 | 0 | 0 | 113.1 | P291 K295 | P291-G293 PolarHBondContact O-N 2.72Å; G293-K295 PolarHBondContact O-N 2.79Å; G293-K295 VanDerWaalsContact O-N 3.1Å | ||
| 294 | N | 47.2 | Very low | 56.1 | Low | 157 Ų | 157 | 130.5 Ų | 130.5 | 84% | 0.84 | 75% | 0.749 | S | S | * | * | trans | -74.2 | 97.3 | 168.1 | -166.1 | 47.9 | 0 | 0 | 0 | 109.4 | S292 F296 | S292-N294 PolarHBondContact O-N 3.22Å; N294-F296 PolarHBondContact O-N 3.04Å | ||
| 295 | K | 53.6 | Low | 54.1 | Low | 196 Ų | 196 | 127.9 Ų | 127.9 | 85% | 0.852 | 75% | 0.746 | S | S | * | * | trans | -69.4 | 98.7 | -167.6 | -63.9 | -171.6 | 178.8 | -173.2 | 0 | 112.7 | G293 S297 | G293-K295 PolarHBondContact O-N 2.79Å; G293-K295 VanDerWaalsContact O-N 3.1Å; K295-S297 PolarHBondContact O-N 3.17Å | ||
| 296 | F | 43.2 | Very low | 52.4 | Low | 192 Ų | 192 | 132.9 Ų | 132.9 | 84% | 0.842 | 76% | 0.756 | S | S | * | * | trans | -74 | 108.3 | 170.4 | -156.7 | -96.8 | 0 | 0 | 0 | 110.1 | N294 Q298 | N294-F296 PolarHBondContact O-N 3.04Å; F296-Q298 PolarHBondContact O-N 2.95Å; F296-Q298 VanDerWaalsContact O-N 3.16Å | ||
| 297 | S | 45.8 | Very low | 50.9 | Low | 114 Ų | 114 | 135.7 Ų | 135.7 | 80% | 0.797 | 78% | 0.776 | S | S | * | * | trans | -83.1 | 89.4 | -177.1 | 58 | 0 | 0 | 0 | 0 | 111.4 | K295 G299 | K295-S297 PolarHBondContact O-N 3.17Å; S297-G299 PolarHBondContact O-N 3.3Å | ||
| 298 | Q | 48.3 | Very low | 49.6 | Very low | 182 Ų | 182 | 137.2 Ų | 137.2 | 85% | 0.85 | 77% | 0.774 | S | S | * | * | trans | -71.2 | 126.7 | 177.4 | -165.7 | 166.5 | 2.3 | 0 | 0 | 111.3 | F296 | F296-Q298 PolarHBondContact O-N 2.95Å; F296-Q298 VanDerWaalsContact O-N 3.16Å | ||
| 299 | G | 47.2 | Very low | 49.1 | Very low | 65 Ų | 65 | 137.7 Ų | 137.7 | 67% | 0.67 | 77% | 0.77 | S | S | * | * | S | Bend | trans | 92.9 | 68.5 | 162.7 | 0 | 0 | 0 | 0 | 0 | 118 | S297 | S297-G299 PolarHBondContact O-N 3.3Š|
| 300 | R | 39.5 | Very low | 48.6 | Very low | 247 Ų | 247 | 141.9 Ų | 141.9 | 93% | 0.932 | 78% | 0.784 | S | S | * | * | -165.9 | 137.8 | 129 | -104.8 | 152.5 | -162.7 | -88 | -2.8 | 112.4 | |||||
| 301 | S | 47.7 | Very low | 48.7 | Very low | 114 Ų | 114 | 143.5 Ų | 143.5 | 80% | 0.797 | 79% | 0.785 | S | S | * | * | trans | -75.6 | 126.4 | 176.6 | 180 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 302 | S | 37.5 | Very low | 49.1 | Very low | 102 Ų | 102 | 142.8 Ų | 142.8 | 71% | 0.713 | 78% | 0.779 | S | S | * | * | trans | -147.7 | 123.9 | 156.4 | 59.7 | 0 | 0 | 0 | 0 | 107.6 | Q304 | S302-Q304 PolarHBondContact O-N 3.46Š| ||
| 303 | Y | 43.3 | Very low | 49.8 | Very low | 235 Ų | 235 | 143.4 Ų | 143.4 | 92% | 0.922 | 77% | 0.772 | S | S | * | * | trans | -57.2 | 109.8 | -178.8 | -83.8 | -101.4 | 0 | 0 | 0 | 111.2 | ||||
| 304 | Q | 35 | Very low | 50.6 | Low | 163 Ų | 163 | 148.2 Ų | 148.2 | 76% | 0.762 | 78% | 0.783 | S | S | * | * | P | Polyproline II helix | trans | -84.3 | 135.4 | 161.1 | -105.5 | -76.8 | -43.8 | 0 | 0 | 108 | S302 E306 | S302-Q304 PolarHBondContact O-N 3.46Å; Q304-E306 PolarHBondContact O-N 2.87Å |
| 305 | P | 44.8 | Very low | 52 | Low | 104 Ų | 104 | 145.9 Ų | 145.9 | 68% | 0.675 | 77% | 0.77 | S | S | * | * | P | Polyproline II helix | trans | -64.2 | 131.2 | 174.3 | 27 | -33.6 | 0 | 0 | 0 | 110.2 | ||
| 306 | E | 45.2 | Very low | 53 | Low | 153 Ų | 153 | 139.9 Ų | 139.9 | 72% | 0.715 | 75% | 0.752 | S | S | * | * | P | Polyproline II helix | trans | -47.5 | 132.4 | 177 | -174.6 | -171.6 | 153.6 | 0 | 0 | 111.8 | Q304 Q308 | Q304-E306 PolarHBondContact O-N 2.87Å; E306-Q308 VanDerWaalsContact C-N 3.28Å; E306-Q308 PolarHBondContact O-N 2.99Å |
| 307 | P | 46.6 | Very low | 54.3 | Low | 124 Ų | 124 | 135.7 Ų | 135.7 | 81% | 0.805 | 75% | 0.746 | S | S | * | * | trans | -72.6 | 84.2 | 179 | 30.3 | -34.7 | 0 | 0 | 0 | 110.1 | A309 | P307-A309 PolarHBondContact O-N 3.05Š| ||
| 308 | Q | 49.7 | Very low | 55.2 | Low | 163 Ų | 163 | 140.6 Ų | 140.6 | 76% | 0.762 | 75% | 0.747 | S | S | * | * | trans | -61.5 | 92.2 | -178.2 | -68.9 | -174.1 | -2.5 | 0 | 0 | 111.6 | E306 K310 | E306-Q308 VanDerWaalsContact C-N 3.28Å; E306-Q308 PolarHBondContact O-N 2.99Å; Q308-K310 VanDerWaalsContact C-N 3.33Å; Q308-K310 PolarHBondContact O-N 3.21Å | ||
| 309 | A | 59.4 | Low | 56.1 | Low | 89 Ų | 89 | 135.4 Ų | 135.4 | 74% | 0.736 | 73% | 0.731 | S | S | * | * | trans | -65.3 | 90.9 | 172.8 | 0 | 0 | 0 | 0 | 0 | 109.4 | P307 V311 | P307-A309 PolarHBondContact O-N 3.05Å; A309-V311 VanDerWaalsContact C-N 3.31Å; A309-V311 PolarHBondContact O-N 3.48Å | ||
| 310 | K | 57.7 | Low | 57 | Low | 185 Ų | 185 | 135.7 Ų | 135.7 | 80% | 0.804 | 73% | 0.726 | S | S | * | * | trans | -73.6 | 80.1 | -174.1 | -169.5 | 173.9 | -177.8 | 172.3 | 0 | 111.6 | Q308 T312 | Q308-K310 VanDerWaalsContact C-N 3.33Å; Q308-K310 PolarHBondContact O-N 3.21Å; K310-T312 HydrophobicContact CG-CG2 4.42Å; K310-T312 PolarHBondContact O-N 3.31Å | ||
| 311 | V | 63.3 | Low | 58 | Low | 115 Ų | 115 | 134 Ų | 134 | 70% | 0.697 | 72% | 0.72 | S | S | * | * | trans | -64.5 | 99.4 | 175.4 | -176.7 | 0 | 0 | 0 | 0 | 109.9 | A309 L313 | A309-V311 VanDerWaalsContact C-N 3.31Å; A309-V311 PolarHBondContact O-N 3.48Å; V311-L313 HydrophobicContact CG1-CD2 3.73Å; V311-L313 HydrophobicContact CG1-CG 4.11Å; V311-L313 PolarHBondContact O-N 2.91Å | ||
| 312 | T | 68.9 | Low | 58.5 | Low | 119 Ų | 119 | 136.1 Ų | 136.1 | 73% | 0.73 | 72% | 0.722 | S | S | * | * | trans | -83.5 | 89.3 | 176.7 | 51.3 | 0 | 0 | 0 | 0 | 110.9 | K310 N314 | K310-T312 HydrophobicContact CG-CG2 4.42Å; K310-T312 PolarHBondContact O-N 3.31Å; T312-N314 PolarHBondContact O-N 3.34Å | ||
| 313 | L | 71.8 | Confident | 59.3 | Low | 134 Ų | 134 | 140.4 Ų | 140.4 | 70% | 0.702 | 73% | 0.73 | S | S | * | * | trans | -69.4 | 117.4 | 175.1 | -61.5 | 179 | 0 | 0 | 0 | 111.1 | V311 I315 | V311-L313 HydrophobicContact CG1-CD2 3.73Å; V311-L313 HydrophobicContact CG1-CG 4.11Å; V311-L313 PolarHBondContact O-N 2.91Å; L313-I315 VanDerWaalsContact C-N 3.26Å; L313-I315 HydrophobicContact CB-CG1 4.21Å; L313-I315 PolarHBondContact O-N 2.8Å | ||
| 314 | N | 66.6 | Low | 59.5 | Low | 159 Ų | 159 | 132.1 Ų | 132.1 | 85% | 0.85 | 72% | 0.717 | S | S | * | * | trans | -83.7 | 62.2 | -179.9 | 56.6 | -8.4 | 0 | 0 | 0 | 112 | T312 C316 | T312-N314 PolarHBondContact O-N 3.34Å; N314-C316 PolarHBondContact O-N 2.64Å | ||
| 315 | I | 77.2 | Confident | 60.1 | Low | 109 Ų | 109 | 131.9 Ų | 131.9 | 56% | 0.559 | 72% | 0.72 | S | S | * | * | trans | -58.8 | 122.7 | -177.3 | -55.6 | 177.5 | 0 | 0 | 0 | 110.8 | L313 C319 A320 | L313-I315 VanDerWaalsContact C-N 3.26Å; L313-I315 HydrophobicContact CB-CG1 4.21Å; L313-I315 PolarHBondContact O-N 2.8Å; I315-C319 HydrophobicContact CG2-CB 3.82Å; I315-A320 HydrophobicContact CG2-CB 3.96Å | ||
| 316 | C | 74.1 | Confident | 60.2 | Low | 69 Ų | 69 | 133 Ų | 133 | 47% | 0.466 | 73% | 0.726 | S | S | . | * | trans | -56.6 | 140.2 | 174.2 | 174.3 | 0 | 0 | 0 | 0 | 111.3 | N314 R318 C319 A320 | N314-C316 PolarHBondContact O-N 2.64Å; C316-R318 PolarHBondContact O-N 3.48Å; C316-C319 HydrophobicContact CB-CB 4.41Å; C316-C319 WeakPolarHBondContact O-CA 3.37Å; C316-C319 WeakPolarHBondContact O-CB 3.39Å; C316-C319 PolarHBondContact O-N 3.48Å; C316-A320 PolarHBondContact O-N 3.32Å | ||
| 317 | S | 71.4 | Confident | 59.8 | Low | 104 Ų | 104 | 133.8 Ų | 133.8 | 73% | 0.727 | 73% | 0.734 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -60.7 | -15.5 | -178.5 | 58.4 | 0 | 0 | 0 | 0 | 114.9 | ||
| 318 | R | 63.6 | Low | 59.2 | Low | 217 Ų | 217 | 133.8 Ų | 133.8 | 82% | 0.819 | 74% | 0.737 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.1 | -28.8 | 169.6 | -70.4 | -176.9 | 166.7 | -165.9 | -5.1 | 113.6 | C316 | C316-R318 PolarHBondContact O-N 3.48Š|
| 319 | C | 67.9 | Low | 58.4 | Low | 74 Ų | 74 | 133.3 Ų | 133.3 | 50% | 0.5 | 74% | 0.74 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -85.9 | -34 | -176.6 | -60 | 0 | 0 | 0 | 0 | 112.1 | I315 C316 R321 L322 | I315-C319 HydrophobicContact CG2-CB 3.82Å; C316-C319 HydrophobicContact CB-CB 4.41Å; C316-C319 WeakPolarHBondContact O-CA 3.37Å; C316-C319 WeakPolarHBondContact O-CB 3.39Å; C316-C319 PolarHBondContact O-N 3.48Å; C319-R321 PolarHBondContact O-N 2.92Å; C319-L322 PolarHBondContact O-N 3.03Å |
| 320 | A | 66.6 | Low | 57 | Low | 70 Ų | 70 | 134.4 Ų | 134.4 | 58% | 0.579 | 74% | 0.742 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -63.2 | -0.2 | 179.6 | 0 | 0 | 0 | 0 | 0 | 115.4 | I315 C316 | I315-A320 HydrophobicContact CG2-CB 3.96Å; C316-A320 PolarHBondContact O-N 3.32Å |
| 321 | R | 59.3 | Low | 55.7 | Low | 213 Ų | 213 | 136.6 Ų | 136.6 | 80% | 0.804 | 75% | 0.745 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -105.8 | 0.4 | 179.3 | -73.6 | -173.5 | 167.5 | -158.3 | -5.3 | 114.6 | C319 | C319-R321 PolarHBondContact O-N 2.92Š|
| 322 | L | 58.4 | Low | 54.2 | Low | 158 Ų | 158 | 135.5 Ų | 135.5 | 83% | 0.827 | 74% | 0.742 | S | S | * | * | S | Bend | trans | -101.3 | 11.3 | -175.7 | -70.8 | 170 | 0 | 0 | 0 | 114.1 | C319 | C319-L322 PolarHBondContact O-N 3.03Š|
| 323 | Q | 53.9 | Low | 52.4 | Low | 191 Ų | 191 | 137.8 Ų | 137.8 | 89% | 0.893 | 75% | 0.745 | S | S | * | * | S | Bend | trans | -140.4 | 40.1 | -172.4 | -153.9 | 172 | 20.6 | 0 | 0 | 112.5 | ||
| 324 | G | 48.1 | Very low | 50.6 | Low | 62 Ų | 62 | 140.2 Ų | 140.2 | 64% | 0.639 | 75% | 0.752 | S | S | * | * | trans | -122 | -22.2 | 179.6 | 0 | 0 | 0 | 0 | 0 | 116.2 | ||||
| 325 | D | 47 | Very low | 48.9 | Very low | 157 Ų | 157 | 138.7 Ų | 138.7 | 84% | 0.84 | 74% | 0.744 | S | S | * | * | S | Bend | trans | -110.7 | 62.4 | -162.6 | -63.6 | -41.7 | 0 | 0 | 0 | 114 | ||
| 326 | T | 46.8 | Very low | 46.7 | Very low | 128 Ų | 128 | 141.3 Ų | 141.3 | 79% | 0.785 | 75% | 0.754 | S | S | * | * | S | Bend | trans | -164.2 | 154.1 | 151.5 | -67.4 | 0 | 0 | 0 | 0 | 108.5 | ||
| 327 | L | 36.9 | Very low | 44.6 | Very low | 169 Ų | 169 | 149.5 Ų | 149.5 | 89% | 0.885 | 78% | 0.775 | S | S | * | * | trans | 78 | 59.1 | -177.8 | -51.6 | -175.6 | 0 | 0 | 0 | 116.8 | ||||
| 328 | S | 35 | Very low | 43 | Very low | 124 Ų | 124 | 150.3 Ų | 150.3 | 87% | 0.867 | 78% | 0.778 | S | S | * | * | trans | -120.4 | 85.5 | 158.6 | 64 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 329 | N | 32.3 | Very low | 41.2 | Very low | 154 Ų | 154 | 148.7 Ų | 148.7 | 82% | 0.824 | 78% | 0.779 | S | S | * | * | trans | -162.6 | 92 | 154.5 | -169.6 | 27.6 | 0 | 0 | 0 | 113.6 | ||||
| 330 | S | 30.7 | Very low | 39.2 | Very low | 112 Ų | 112 | 151.8 Ų | 151.8 | 78% | 0.783 | 79% | 0.789 | S | S | * | * | trans | -175.2 | 145 | 131.2 | 40.8 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 331 | R | 30.6 | Very low | 37.5 | Very low | 231 Ų | 231 | 152.4 Ų | 152.4 | 87% | 0.872 | 79% | 0.789 | S | S | * | * | trans | 71.4 | 98.7 | 155.9 | -163.6 | 162.3 | -164.3 | -148.2 | 0.7 | 118.8 | ||||
| 332 | S | 30.5 | Very low | 36 | Very low | 91 Ų | 91 | 149.7 Ų | 149.7 | 64% | 0.636 | 79% | 0.786 | S | S | * | * | trans | 40.8 | 147.4 | 137.5 | 64.6 | 0 | 0 | 0 | 0 | 120.8 | ||||
| 333 | E | 32.6 | Very low | 34.6 | Very low | 167 Ų | 167 | 150 Ų | 150 | 78% | 0.78 | 78% | 0.783 | S | S | * | * | cis | 163.4 | 159 | -1.2 | -168.6 | 161.7 | 156.9 | 0 | 0 | 103.4 | ||||
| 334 | E | 32.5 | Very low | 33.3 | Very low | 185 Ų | 185 | 145 Ų | 145 | 86% | 0.864 | 77% | 0.774 | S | S | * | * | trans | 62 | 156.5 | -179.3 | -60.5 | 171.3 | 99.1 | 0 | 0 | 117.1 | ||||
| 335 | D | 30.4 | Very low | 32.4 | Very low | 127 Ų | 127 | 148.4 Ų | 148.4 | 68% | 0.679 | 78% | 0.782 | S | S | * | * | -153.7 | 171.4 | -50.6 | -150.6 | -17.6 | 0 | 0 | 0 | 110.9 | |||||
| 336 | H | 32.6 | Very low | 33 | Very low | 164 Ų | 164 | 146.3 Ų | 146.3 | 76% | 0.759 | 78% | 0.777 | S | S | * | * | trans | 66.1 | 94.8 | 154 | -71.2 | 14.8 | 0 | 0 | 0 | 121.1 | ||||
| 337 | R | 29.3 | Very low | 32 | Very low | 241 Ų | 241 | 146.6 Ų | 146.6 | 91% | 0.909 | 77% | 0.774 | S | S | * | * | trans | 7.3 | 140.2 | 136.8 | -158.4 | 172.4 | -169 | 146 | 4.2 | 120.8 | ||||
| 338 | P | 38 | Very low | 31.6 | Very low | 121 Ų | 121 | 145.3 Ų | 145.3 | 79% | 0.786 | 77% | 0.767 | S | S | * | * | trans | -90.7 | 170.5 | -173.8 | 37.8 | -39.4 | 0 | 0 | 0 | 116.6 | ||||
| 339 | H | 26.1 | Very low | 31.1 | Very low | 184 Ų | 184 | 145.1 Ų | 145.1 | 85% | 0.852 | 77% | 0.765 | S | S | * | * | trans | -129.4 | 170.3 | 165.4 | -155.5 | -88.5 | 0 | 0 | 0 | 112.9 | ||||
| 340 | I | 25.7 | Very low | 30.9 | Very low | 138 Ų | 138 | 143 Ų | 143 | 71% | 0.708 | 76% | 0.762 | S | S | * | * | trans | -126.3 | 159 | -161.4 | -65 | 159.5 | 0 | 0 | 0 | 112.2 | ||||
| 341 | S | 29.8 | Very low | 31.6 | Very low | 83 Ų | 83 | 143.4 Ų | 143.4 | 58% | 0.58 | 76% | 0.763 | S | S | * | * | trans | 79.3 | 133.9 | 157.2 | -88 | 0 | 0 | 0 | 0 | 122.6 | ||||
| 342 | E | 28.8 | Very low | 31.9 | Very low | 156 Ų | 156 | 139 Ų | 139 | 73% | 0.729 | 76% | 0.761 | S | S | * | * | 54.1 | 152.9 | 129 | -58.4 | 168.3 | 83.3 | 0 | 0 | 120.1 | |||||
| 343 | Q | 29.2 | Very low | 32.4 | Very low | 165 Ų | 165 | 140.7 Ų | 140.7 | 77% | 0.771 | 77% | 0.77 | S | S | * | * | cis | -166.3 | 174.3 | 27.3 | -151.1 | 173.2 | 60.7 | 0 | 0 | 112.8 | ||||
| 344 | A | 25.8 | Very low | 32.1 | Very low | 86 Ų | 86 | 136.3 Ų | 136.3 | 71% | 0.711 | 77% | 0.769 | S | S | * | * | trans | 77.8 | 166.3 | 148.5 | 0 | 0 | 0 | 0 | 0 | 121.3 | ||||
| 345 | V | 30.1 | Very low | 32.1 | Very low | 133 Ų | 133 | 133.8 Ų | 133.8 | 81% | 0.806 | 77% | 0.766 | S | S | * | * | trans | -151.1 | -171.3 | -165.1 | -155.2 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 346 | P | 58.4 | Low | 32.1 | Very low | 113 Ų | 113 | 134.1 Ų | 134.1 | 73% | 0.734 | 77% | 0.768 | S | S | * | * | -82.3 | -156.2 | -103.2 | 40.2 | -23.2 | 0 | 0 | 0 | 114.7 | |||||
| 347 | D | 26.3 | Very low | 32 | Very low | 135 Ų | 135 | 132.1 Ų | 132.1 | 72% | 0.722 | 77% | 0.768 | S | S | * | * | 172.5 | 170.8 | 76.3 | -160.3 | 6.9 | 0 | 0 | 0 | 114.3 | |||||
| 348 | I | 28 | Very low | 32.2 | Very low | 142 Ų | 142 | 127.3 Ų | 127.3 | 73% | 0.728 | 77% | 0.765 | S | S | * | * | trans | 65.7 | 126.6 | 157.5 | 32 | 171.3 | 0 | 0 | 0 | 127.3 | ||||
| 349 | S | 26 | Very low | 31.8 | Very low | 119 Ų | 119 | 125.3 Ų | 125.3 | 83% | 0.832 | 76% | 0.758 | S | S | * | * | 99.1 | 152.6 | 127.4 | -77.7 | 0 | 0 | 0 | 0 | 125.3 | |||||
| 350 | S | 28.5 | Very low | 31.8 | Very low | 110 Ų | 110 | 121.9 Ų | 121.9 | 77% | 0.769 | 76% | 0.755 | S | S | * | * | trans | -120.1 | -175.1 | 179.2 | 75.3 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 351 | P | 43.9 | Very low | 32.2 | Very low | 121 Ų | 121 | 125.3 Ų | 125.3 | 79% | 0.786 | 76% | 0.759 | S | S | * | * | cis | -148.9 | -163.6 | 39.8 | 41.6 | -16.9 | 0 | 0 | 0 | 118 | ||||
| 352 | V | 36.4 | Very low | 32.4 | Very low | 137 Ų | 137 | 127.1 Ų | 127.1 | 83% | 0.83 | 76% | 0.761 | S | S | * | * | trans | -80.6 | -178.6 | 175.2 | -99.4 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 353 | P | 42.1 | Very low | 32.5 | Very low | 128 Ų | 128 | 126.1 Ų | 126.1 | 83% | 0.831 | 76% | 0.757 | S | S | * | * | cis | -153.6 | -177.7 | 27.3 | 45.8 | -23.8 | 0 | 0 | 0 | 121.8 | ||||
| 354 | G | 26.4 | Very low | 32.7 | Very low | 74 Ų | 74 | 125.4 Ų | 125.4 | 76% | 0.763 | 75% | 0.754 | S | S | * | * | trans | 93 | 161.1 | 149 | 0 | 0 | 0 | 0 | 0 | 120.1 | ||||
| 355 | V | 32.7 | Very low | 33.2 | Very low | 133 Ų | 133 | 126.3 Ų | 126.3 | 81% | 0.806 | 75% | 0.753 | S | S | * | * | cis | -163.8 | 147.9 | -10.6 | 129.1 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 356 | D | 29.5 | Very low | 33.1 | Very low | 133 Ų | 133 | 128.3 Ų | 128.3 | 71% | 0.711 | 75% | 0.754 | S | S | * | * | trans | 13.5 | 151.7 | 160 | -46.9 | -31.3 | 0 | 0 | 0 | 124.1 | ||||
| 357 | T | 31.4 | Very low | 32 | Very low | 123 Ų | 123 | 126.5 Ų | 126.5 | 76% | 0.755 | 75% | 0.748 | S | S | * | * | -179.2 | 146.5 | 65.6 | 23.4 | 0 | 0 | 0 | 0 | 116.2 | |||||
| 358 | V | 32.1 | Very low | 32.1 | Very low | 140 Ų | 140 | 127.7 Ų | 127.7 | 85% | 0.848 | 75% | 0.754 | S | S | * | * | trans | 68.7 | 144.9 | 137.7 | 171.9 | 0 | 0 | 0 | 0 | 119.6 | ||||
| 359 | A | 30.3 | Very low | 32.3 | Very low | 79 Ų | 79 | 125.8 Ų | 125.8 | 65% | 0.653 | 75% | 0.753 | S | S | * | * | cis | -152.5 | 162.6 | 15.2 | 0 | 0 | 0 | 0 | 0 | 116.1 | ||||
| 360 | S | 27.4 | Very low | 32.7 | Very low | 111 Ų | 111 | 128 Ų | 128 | 78% | 0.776 | 75% | 0.751 | S | S | * | * | trans | 56.1 | 144.7 | 140.5 | -81.8 | 0 | 0 | 0 | 0 | 122.9 | ||||
| 361 | R | 32.3 | Very low | 32.5 | Very low | 210 Ų | 210 | 128.6 Ų | 128.6 | 79% | 0.792 | 75% | 0.749 | S | S | * | * | cis | -168.3 | 147 | -7.1 | -136.3 | -172.2 | 178.3 | -141.4 | 1.2 | 111.3 | ||||
| 362 | L | 34.5 | Very low | 31.7 | Very low | 121 Ų | 121 | 129.2 Ų | 129.2 | 63% | 0.634 | 75% | 0.751 | S | S | * | * | trans | 64.7 | 150.3 | 156.4 | -74.6 | 167.9 | 0 | 0 | 0 | 118.3 | ||||
| 363 | Q | 31.3 | Very low | 31.3 | Very low | 135 Ų | 135 | 126.2 Ų | 126.2 | 63% | 0.631 | 75% | 0.748 | S | S | * | * | cis | -148.8 | 138.2 | 4.5 | -164.6 | 148.8 | -20.7 | 0 | 0 | 112.4 | ||||
| 364 | E | 33.2 | Very low | 30.6 | Very low | 151 Ų | 151 | 125 Ų | 125 | 71% | 0.706 | 74% | 0.742 | S | S | * | * | trans | 35.4 | 151.1 | 147.9 | -64.2 | 161.8 | 171.4 | 0 | 0 | 122 | ||||
| 365 | C | 36.3 | Very low | 30.6 | Very low | 104 Ų | 104 | 131.7 Ų | 131.7 | 70% | 0.703 | 75% | 0.745 | S | S | * | * | cis | -171.9 | 171.5 | -18.2 | -104.9 | 0 | 0 | 0 | 0 | 106.4 | ||||
| 366 | E | 29.1 | Very low | 30.3 | Very low | 176 Ų | 176 | 132.5 Ų | 132.5 | 82% | 0.822 | 74% | 0.739 | S | S | * | * | cis | -156.5 | 171.6 | 9.8 | -140.7 | 167.2 | 130.2 | 0 | 0 | 111.2 | ||||
| 367 | A | 34.2 | Very low | 30.8 | Very low | 75 Ų | 75 | 130 Ų | 130 | 62% | 0.62 | 74% | 0.738 | S | S | * | * | trans | 40.6 | 116.5 | 159 | 0 | 0 | 0 | 0 | 0 | 120.2 | ||||
| 368 | L | 29.4 | Very low | 30.5 | Very low | 160 Ų | 160 | 130.2 Ų | 130.2 | 84% | 0.838 | 74% | 0.739 | S | S | * | * | 64.7 | 142 | 66 | -59.3 | 169 | 0 | 0 | 0 | 113.7 | |||||
| 369 | S | 32.4 | Very low | 30.3 | Very low | 102 Ų | 102 | 135.5 Ų | 135.5 | 71% | 0.713 | 74% | 0.743 | S | S | * | * | cis | -150.8 | 179.9 | 18.2 | -154.2 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 370 | Q | 32.6 | Very low | 30.2 | Very low | 166 Ų | 166 | 140.5 Ų | 140.5 | 78% | 0.776 | 75% | 0.753 | S | S | * | * | trans | -54.2 | 168.6 | 171.4 | -53.5 | 165.1 | 9.6 | 0 | 0 | 112 | ||||
| 371 | V | 25.2 | Very low | 30.6 | Very low | 121 Ų | 121 | 140 Ų | 140 | 73% | 0.733 | 76% | 0.755 | S | S | * | * | -171.8 | 159.2 | 51.1 | 81.5 | 0 | 0 | 0 | 0 | 114.1 | |||||
| 372 | T | 27.6 | Very low | 30.6 | Very low | 134 Ų | 134 | 136 Ų | 136 | 82% | 0.822 | 75% | 0.75 | S | S | * | * | trans | 3.5 | 132.3 | 156.7 | -50.3 | 0 | 0 | 0 | 0 | 120.9 | ||||
| 373 | G | 27 | Very low | 30.5 | Very low | 75 Ų | 75 | 137.9 Ų | 137.9 | 77% | 0.773 | 76% | 0.76 | S | S | * | * | trans | -174 | 90 | 166 | 0 | 0 | 0 | 0 | 0 | 119.8 | ||||
| 374 | S | 26.8 | Very low | 30.8 | Very low | 102 Ų | 102 | 140.3 Ų | 140.3 | 71% | 0.713 | 77% | 0.768 | S | S | * | * | trans | -11.2 | 127.5 | 153.5 | 169.8 | 0 | 0 | 0 | 0 | 121.6 | ||||
| 375 | R | 28 | Very low | 30.5 | Very low | 215 Ų | 215 | 138.6 Ų | 138.6 | 81% | 0.811 | 77% | 0.773 | S | S | * | * | trans | 60.7 | 128.9 | 138.1 | -65.2 | 178.8 | 174.3 | -91.8 | -1.9 | 122.4 | ||||
| 376 | Q | 26.1 | Very low | 30.1 | Very low | 149 Ų | 149 | 138 Ų | 138 | 70% | 0.696 | 78% | 0.775 | S | S | * | * | trans | 78.6 | 133.5 | 134.1 | -171 | 162.5 | 0.6 | 0 | 0 | 118.9 | ||||
| 377 | A | 39 | Very low | 30.2 | Very low | 82 Ų | 82 | 141.5 Ų | 141.5 | 68% | 0.678 | 78% | 0.781 | S | S | * | * | trans | -79.2 | 147.2 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 378 | V | 25.1 | Very low | 29.9 | Very low | 127 Ų | 127 | 141.9 Ų | 141.9 | 77% | 0.77 | 79% | 0.792 | S | S | * | * | trans | -132.9 | 111.9 | 157.8 | 176.6 | 0 | 0 | 0 | 0 | 106.9 | E380 | V378-E380 HydrophobicContact CG1-CB 4.17Š| ||
| 379 | W | 28.9 | Very low | 29.9 | Very low | 250 Ų | 250 | 137.7 Ų | 137.7 | 95% | 0.947 | 79% | 0.787 | S | S | * | * | trans | -87.2 | 122.3 | 154.1 | -76.1 | 96.3 | 0 | 0 | 0 | 106.7 | ||||
| 380 | E | 27.2 | Very low | 29.8 | Very low | 185 Ų | 185 | 137.9 Ų | 137.9 | 86% | 0.864 | 79% | 0.789 | S | S | * | * | trans | -144.4 | 130.8 | 161.4 | -157.3 | 166.6 | -132.8 | 0 | 0 | 107.1 | V378 | V378-E380 HydrophobicContact CG1-CB 4.17Š| ||
| 381 | A | 35.7 | Very low | 29.9 | Very low | 99 Ų | 99 | 134.9 Ų | 134.9 | 82% | 0.818 | 79% | 0.786 | S | S | * | * | trans | -123.4 | 118.3 | -167.3 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 382 | D | 33.5 | Very low | 30.4 | Very low | 126 Ų | 126 | 135.9 Ų | 135.9 | 67% | 0.674 | 79% | 0.792 | S | S | * | * | trans | -155.2 | 153.4 | 136.1 | -166.3 | 11.8 | 0 | 0 | 0 | 108.7 | ||||
| 383 | L | 32.1 | Very low | 30.6 | Very low | 162 Ų | 162 | 132.6 Ų | 132.6 | 85% | 0.848 | 79% | 0.785 | S | S | * | * | 170.5 | 122.4 | 126.7 | -92 | 173.7 | 0 | 0 | 0 | 110.9 | |||||
| 384 | K | 37.2 | Very low | 31.2 | Very low | 186 Ų | 186 | 138.1 Ų | 138.1 | 81% | 0.809 | 79% | 0.791 | S | S | * | * | trans | -79 | 116.9 | 171.7 | -61.7 | 157.7 | -175.5 | 157.7 | 0 | 110.9 | ||||
| 385 | S | 27.7 | Very low | 32 | Very low | 115 Ų | 115 | 139.2 Ų | 139.2 | 80% | 0.804 | 79% | 0.793 | S | S | * | * | trans | -164 | 121.7 | 152.8 | -110.9 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 386 | A | 27.9 | Very low | 32.3 | Very low | 90 Ų | 90 | 132.5 Ų | 132.5 | 74% | 0.744 | 79% | 0.791 | S | S | * | * | 88.7 | 105.9 | 50.4 | 0 | 0 | 0 | 0 | 0 | 114.5 | |||||
| 387 | R | 31.6 | Very low | 33.2 | Very low | 250 Ų | 250 | 132.8 Ų | 132.8 | 94% | 0.943 | 80% | 0.797 | S | S | * | * | trans | 73.8 | 108.3 | 149.1 | -170.2 | -177.2 | -66.4 | -98.8 | -1.1 | 119.4 | ||||
| 388 | G | 27.3 | Very low | 33.8 | Very low | 83 Ų | 83 | 134.9 Ų | 134.9 | 86% | 0.856 | 80% | 0.796 | S | S | * | * | trans | 100.7 | 147.8 | 162.4 | 0 | 0 | 0 | 0 | 0 | 114 | ||||
| 389 | G | 29.8 | Very low | 35 | Very low | 72 Ų | 72 | 136.1 Ų | 136.1 | 74% | 0.742 | 80% | 0.797 | S | S | * | * | cis | 146.1 | 134.8 | -5 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 390 | S | 30.1 | Very low | 36.1 | Very low | 107 Ų | 107 | 126.5 Ų | 126.5 | 75% | 0.748 | 78% | 0.776 | S | S | * | * | trans | 70.7 | 129.4 | -164.4 | -168.2 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 391 | S | 34.7 | Very low | 37.4 | Very low | 102 Ų | 102 | 122.5 Ų | 122.5 | 71% | 0.713 | 76% | 0.76 | S | S | * | * | cis | 73.9 | 139.4 | 47.1 | 105.8 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 392 | V | 35.4 | Very low | 38.4 | Very low | 142 Ų | 142 | 121.3 Ų | 121.3 | 86% | 0.861 | 75% | 0.746 | S | S | * | * | cis | -155.9 | 162 | 9.9 | 83.1 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 393 | G | 31.6 | Very low | 39.6 | Very low | 65 Ų | 65 | 121.6 Ų | 121.6 | 67% | 0.67 | 75% | 0.747 | S | S | * | * | trans | 99.7 | 151.6 | 162.8 | 0 | 0 | 0 | 0 | 0 | 116 | ||||
| 394 | Q | 39.7 | Very low | 41 | Very low | 192 Ų | 192 | 120.7 Ų | 120.7 | 90% | 0.897 | 74% | 0.736 | S | S | * | * | cis | -134.4 | 152.7 | -0.5 | -77.2 | -170.6 | -12.1 | 0 | 0 | 113.7 | ||||
| 395 | T | 42.6 | Very low | 42.8 | Very low | 124 Ų | 124 | 115.2 Ų | 115.2 | 76% | 0.761 | 72% | 0.721 | S | S | * | * | trans | -30.8 | 131.6 | 170.8 | 45.5 | 0 | 0 | 0 | 0 | 117.5 | ||||
| 396 | G | 36.2 | Very low | 45.2 | Very low | 75 Ų | 75 | 116.9 Ų | 116.9 | 77% | 0.773 | 71% | 0.714 | S | S | * | * | S | Bend | trans | -166.7 | -31.1 | 167.3 | 0 | 0 | 0 | 0 | 0 | 116.1 | ||
| 397 | L | 44 | Very low | 47.8 | Very low | 154 Ų | 154 | 118.3 Ų | 118.3 | 81% | 0.806 | 71% | 0.705 | S | S | * | * | trans | -117.8 | 10.7 | -168.9 | -68.6 | 168.2 | 0 | 0 | 0 | 115.3 | L399 | L397-L399 VanDerWaalsContact C-N 3.26Å; L397-L399 PolarHBondContact O-N 3.42Å | ||
| 398 | L | 50.9 | Low | 50.3 | Low | 127 Ų | 127 | 111.4 Ų | 111.4 | 67% | 0.665 | 69% | 0.687 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.3 | 11.8 | -157.3 | -118.7 | 175.2 | 0 | 0 | 0 | 117.6 | ||
| 399 | L | 50.4 | Low | 52.9 | Low | 153 Ų | 153 | 112.6 Ų | 112.6 | 80% | 0.801 | 67% | 0.67 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -101.4 | -28.9 | -177.9 | -145.8 | 73.7 | 0 | 0 | 0 | 114.1 | L397 | L397-L399 VanDerWaalsContact C-N 3.26Å; L397-L399 PolarHBondContact O-N 3.42Å |
| 400 | G | 53.2 | Low | 55.7 | Low | 48 Ų | 48 | 113.1 Ų | 113.1 | 50% | 0.495 | 66% | 0.656 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -74.7 | -52.1 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | S402 L403 F404 | G400-S402 PolarHBondContact O-N 2.71Å; G400-S402 VanDerWaalsContact O-N 3.07Å; G400-L403 PolarHBondContact O-N 3.21Å; G400-F404 PolarHBondContact O-N 3.39Å |
| 401 | D | 54.3 | Low | 58.3 | Low | 100 Ų | 100 | 112.8 Ų | 112.8 | 54% | 0.535 | 64% | 0.644 | S | S | . | * | H | α-helix | trans | -56.3 | -30.9 | -175.3 | -57.8 | -15.9 | 0 | 0 | 0 | 113.2 | S405 | D401-S405 WeakPolarHBondContact O-CB 3.38Å; D401-S405 PolarHBondContact O-N 3.42Å; D401-S405 PolarHBondContact O-OG 3.43Å |
| 402 | S | 56.3 | Low | 60.9 | Low | 75 Ų | 75 | 109.9 Ų | 109.9 | 52% | 0.524 | 63% | 0.629 | S | S | . | * | H | α-helix | trans | -71 | -28 | -179.1 | -173.4 | 0 | 0 | 0 | 0 | 113.6 | G400 K406 | G400-S402 PolarHBondContact O-N 2.71Å; G400-S402 VanDerWaalsContact O-N 3.07Å; S402-K406 WeakPolarHBondContact O-CB 3.38Å |
| 403 | L | 59.6 | Low | 63.4 | Low | 132 Ų | 132 | 108.5 Ų | 108.5 | 69% | 0.691 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -78.7 | -50.5 | 176.2 | -66.2 | 176.2 | 0 | 0 | 0 | 109.7 | G400 S405 K406 E407 | G400-L403 PolarHBondContact O-N 3.21Å; L403-S405 PolarHBondContact O-N 3.06Å; L403-K406 PolarHBondContact O-N 2.88Å; L403-K406 VanDerWaalsContact O-N 3.09Å; L403-E407 PolarHBondContact O-N 3.19Å |
| 404 | F | 61.1 | Low | 65.9 | Low | 143 Ų | 143 | 110.6 Ų | 110.6 | 63% | 0.627 | 60% | 0.604 | S | S | * | * | H | α-helix | trans | -61.5 | -41 | 179.6 | -164.8 | -102.7 | 0 | 0 | 0 | 112.5 | G400 K406 E407 L408 | G400-F404 PolarHBondContact O-N 3.39Å; F404-K406 VanDerWaalsContact C-N 3.29Å; F404-K406 PolarHBondContact O-N 3.24Å; F404-E407 PolarHBondContact O-N 2.89Å; F404-L408 WeakPolarHBondContact O-CB 3.29Å; F404-L408 PolarHBondContact O-N 2.93Å |
| 405 | S | 73.7 | Confident | 68.3 | Low | 70 Ų | 70 | 107.3 Ų | 107.3 | 49% | 0.49 | 59% | 0.592 | S | S | . | * | H | α-helix | trans | -62 | -36.6 | 175.1 | -60.5 | 0 | 0 | 0 | 0 | 112.5 | D401 L403 E409 | D401-S405 WeakPolarHBondContact O-CB 3.38Å; D401-S405 PolarHBondContact O-N 3.42Å; D401-S405 PolarHBondContact O-OG 3.43Å; L403-S405 PolarHBondContact O-N 3.06Å; S405-E409 WeakPolarHBondContact O-CB 3.39Å; S405-E409 PolarHBondContact O-N 2.89Å |
| 406 | K | 78.9 | Confident | 70.6 | Confident | 150 Ų | 150 | 104 Ų | 104 | 65% | 0.652 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -76 | -34.3 | -178.8 | -172.8 | 172.8 | -179.4 | 179.5 | 0 | 112.2 | S402 L403 F404 N410 | S402-K406 WeakPolarHBondContact O-CB 3.38Å; L403-K406 PolarHBondContact O-N 2.88Å; L403-K406 VanDerWaalsContact O-N 3.09Å; F404-K406 VanDerWaalsContact C-N 3.29Å; F404-K406 PolarHBondContact O-N 3.24Å; K406-N410 WeakPolarHBondContact O-CB 3.29Å; K406-N410 PolarHBondContact O-N 3.42Å |
| 407 | E | 81.8 | Confident | 73 | Confident | 120 Ų | 120 | 105.8 Ų | 105.8 | 56% | 0.561 | 57% | 0.566 | S | S | * | * | H | α-helix | trans | -66.4 | -45.4 | 170.7 | -177.2 | 167.9 | -155.5 | 0 | 0 | 111.4 | L403 F404 E409 N410 M411 | L403-E407 PolarHBondContact O-N 3.19Å; F404-E407 PolarHBondContact O-N 2.89Å; E407-E409 PolarHBondContact O-N 3.14Å; E407-N410 WeakPolarHBondContact O-CB 3.29Å; E407-N410 PolarHBondContact O-N 2.94Å; E407-N410 VanDerWaalsContact O-N 3.11Å; E407-M411 PolarHBondContact O-N 3.12Å |
| 408 | L | 84.6 | Confident | 75.2 | Confident | 105 Ų | 105 | 103.2 Ų | 103.2 | 55% | 0.55 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -63.1 | -40.4 | 176.1 | -171.2 | 64.7 | 0 | 0 | 0 | 112.3 | F404 N410 M411 G412 | F404-L408 WeakPolarHBondContact O-CB 3.29Å; F404-L408 PolarHBondContact O-N 2.93Å; L408-N410 VanDerWaalsContact C-N 3.31Å; L408-N410 PolarHBondContact O-N 3.08Å; L408-M411 PolarHBondContact O-N 3.17Å; L408-G412 PolarHBondContact O-N 3.2Å |
| 409 | E | 83.2 | Confident | 77 | Confident | 109 Ų | 109 | 104 Ų | 104 | 51% | 0.509 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -65.3 | -34.3 | 173.2 | -161 | -162 | 157.9 | 0 | 0 | 111.9 | S405 E407 K413 | S405-E409 WeakPolarHBondContact O-CB 3.39Å; S405-E409 PolarHBondContact O-N 2.89Å; E407-E409 PolarHBondContact O-N 3.14Å; E409-K413 WeakPolarHBondContact O-CD 3.43Å; E409-K413 VanDerWaalsContact O-CG 3.31Å; E409-K413 WeakPolarHBondContact O-CG 3.24Å; E409-K413 PolarHBondContact O-N 2.9Å; E409-K413 VanDerWaalsContact O-N 3.07Å; E409-K413 WeakPolarHBondContact OE1-CE 3.06Å; E409-K413 IonicContact OE1-NZ 3.19Å; E409-K413 PolarHBondContact OE1-NZ 2.82Å; E409-K413 IonicContact OE2-NZ 3.33Å |
| 410 | N | 87.3 | Confident | 78.8 | Confident | 83 Ų | 83 | 102.6 Ų | 102.6 | 44% | 0.444 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -69.2 | -45 | 175.7 | -171.7 | 61.4 | 0 | 0 | 0 | 111.9 | K406 E407 L408 G412 K413 Q414 | K406-N410 WeakPolarHBondContact O-CB 3.29Å; K406-N410 PolarHBondContact O-N 3.42Å; E407-N410 WeakPolarHBondContact O-CB 3.29Å; E407-N410 PolarHBondContact O-N 2.94Å; E407-N410 VanDerWaalsContact O-N 3.11Å; L408-N410 VanDerWaalsContact C-N 3.31Å; L408-N410 PolarHBondContact O-N 3.08Å; N410-G412 VanDerWaalsContact C-N 3.34Å; N410-G412 PolarHBondContact O-N 3.41Å; N410-K413 WeakPolarHBondContact O-CB 3.37Å; N410-K413 PolarHBondContact O-N 2.9Å; N410-Q414 PolarHBondContact O-N 3.1Å |
| 411 | M | 85.1 | Confident | 80.4 | Confident | 100 Ų | 100 | 103.5 Ų | 103.5 | 49% | 0.493 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -63.3 | -38.8 | 173.4 | -69.4 | -143.1 | -66.4 | 0 | 0 | 112 | E407 L408 K413 Q414 L415 | E407-M411 PolarHBondContact O-N 3.12Å; L408-M411 PolarHBondContact O-N 3.17Å; M411-K413 VanDerWaalsContact C-N 3.3Å; M411-K413 PolarHBondContact O-N 3.03Å; M411-Q414 PolarHBondContact O-N 3.22Å; M411-L415 WeakPolarHBondContact O-CG 3.42Å; M411-L415 PolarHBondContact O-N 3.35Å |
| 412 | G | 88.9 | Confident | 81.9 | Confident | 40 Ų | 40 | 104.5 Ų | 104.5 | 41% | 0.412 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -59.5 | -38.5 | 173.1 | 0 | 0 | 0 | 0 | 0 | 113.1 | L408 N410 A416 | L408-G412 PolarHBondContact O-N 3.2Å; N410-G412 VanDerWaalsContact C-N 3.34Å; N410-G412 PolarHBondContact O-N 3.41Å; G412-A416 WeakPolarHBondContact O-CB 3.31Å; G412-A416 PolarHBondContact O-N 3.48Å; G412-A416 VanDerWaalsContact O-N 3.08Å |
| 413 | K | 89.1 | Confident | 83.1 | Confident | 114 Ų | 114 | 103.5 Ų | 103.5 | 50% | 0.496 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -68.9 | -42.3 | 174.1 | -72.7 | 162.7 | -173.6 | 165.6 | 0 | 112.4 | E409 N410 M411 A416 E417 | E409-K413 WeakPolarHBondContact O-CD 3.43Å; E409-K413 VanDerWaalsContact O-CG 3.31Å; E409-K413 WeakPolarHBondContact O-CG 3.24Å; E409-K413 PolarHBondContact O-N 2.9Å; E409-K413 VanDerWaalsContact O-N 3.07Å; E409-K413 WeakPolarHBondContact OE1-CE 3.06Å; E409-K413 IonicContact OE1-NZ 3.19Å; E409-K413 PolarHBondContact OE1-NZ 2.82Å; E409-K413 IonicContact OE2-NZ 3.33Å; N410-K413 WeakPolarHBondContact O-CB 3.37Å; N410-K413 PolarHBondContact O-N 2.9Å; M411-K413 VanDerWaalsContact C-N 3.3Å; M411-K413 PolarHBondContact O-N 3.03Å; K413-A416 PolarHBondContact O-N 3.38Å; K413-E417 PolarHBondContact O-N 2.93Å |
| 414 | Q | 82.4 | Confident | 83.8 | Confident | 108 Ų | 108 | 102.4 Ų | 102.4 | 51% | 0.505 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -62.9 | -42.1 | 176.2 | -72.6 | 179.3 | -17.2 | 0 | 0 | 111.9 | N410 M411 E417 V418 | N410-Q414 PolarHBondContact O-N 3.1Å; M411-Q414 PolarHBondContact O-N 3.22Å; Q414-E417 PolarHBondContact O-N 3.02Å; Q414-V418 WeakPolarHBondContact O-CG2 3.42Å; Q414-V418 PolarHBondContact O-N 3.31Å |
| 415 | L | 90.7 | Very high | 84.3 | Confident | 123 Ų | 123 | 101.3 Ų | 101.3 | 64% | 0.644 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -62.7 | -42.9 | 174.3 | -73.8 | 169.2 | 0 | 0 | 0 | 112 | M411 E417 V418 E419 | M411-L415 WeakPolarHBondContact O-CG 3.42Å; M411-L415 PolarHBondContact O-N 3.35Å; L415-E417 VanDerWaalsContact C-N 3.29Å; L415-E417 PolarHBondContact O-N 2.99Å; L415-V418 PolarHBondContact O-N 2.78Å; L415-E419 WeakPolarHBondContact O-CB 3.5Å; L415-E419 PolarHBondContact O-N 3.08Å |
| 416 | A | 90.1 | Very high | 84.1 | Confident | 54 Ų | 54 | 100.6 Ų | 100.6 | 45% | 0.446 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -65.6 | -30.1 | 175.3 | 0 | 0 | 0 | 0 | 0 | 113.1 | G412 K413 K420 | G412-A416 WeakPolarHBondContact O-CB 3.31Å; G412-A416 PolarHBondContact O-N 3.48Å; G412-A416 VanDerWaalsContact O-N 3.08Å; K413-A416 PolarHBondContact O-N 3.38Å; A416-K420 WeakPolarHBondContact O-CB 3.48Å; A416-K420 PolarHBondContact O-N 3.14Å |
| 417 | E | 88.6 | Confident | 83.5 | Confident | 114 Ų | 114 | 98.6 Ų | 98.6 | 53% | 0.533 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -73.5 | -41.1 | 173.4 | -173.8 | 145.6 | -124.2 | 0 | 0 | 112 | K413 Q414 L415 K420 D421 | K413-E417 PolarHBondContact O-N 2.93Å; Q414-E417 PolarHBondContact O-N 3.02Å; L415-E417 VanDerWaalsContact C-N 3.29Å; L415-E417 PolarHBondContact O-N 2.99Å; E417-K420 PolarHBondContact O-N 3.46Å; E417-D421 WeakPolarHBondContact O-CB 3.35Å; E417-D421 PolarHBondContact O-N 2.96Å |
| 418 | V | 90.1 | Very high | 82.4 | Confident | 100 Ų | 100 | 97 Ų | 97 | 61% | 0.606 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -63 | -43.5 | 173 | 170.6 | 0 | 0 | 0 | 0 | 111.7 | Q414 L415 D421 L422 | Q414-V418 WeakPolarHBondContact O-CG2 3.42Å; Q414-V418 PolarHBondContact O-N 3.31Å; L415-V418 PolarHBondContact O-N 2.78Å; V418-D421 PolarHBondContact O-N 3.05Å; V418-L422 WeakPolarHBondContact O-CB 3.46Å; V418-L422 PolarHBondContact O-N 3Å |
| 419 | E | 87.9 | Confident | 81.1 | Confident | 144 Ų | 144 | 94 Ų | 94 | 67% | 0.673 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -64 | -42 | 175.8 | -174.9 | 177.3 | -162.4 | 0 | 0 | 111.7 | L415 D421 L422 A423 | L415-E419 WeakPolarHBondContact O-CB 3.5Å; L415-E419 PolarHBondContact O-N 3.08Å; E419-D421 VanDerWaalsContact C-N 3.32Å; E419-D421 PolarHBondContact O-N 2.99Å; E419-L422 PolarHBondContact O-N 3.29Å; E419-A423 WeakPolarHBondContact O-CB 3.37Å; E419-A423 PolarHBondContact O-N 3.29Å |
| 420 | K | 88.9 | Confident | 79.8 | Confident | 123 Ų | 123 | 95 Ų | 95 | 54% | 0.535 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -62 | -37.1 | 175 | 177.7 | -175.8 | 178.3 | -170.3 | 0 | 112.3 | A416 E417 A423 K424 | A416-K420 WeakPolarHBondContact O-CB 3.48Å; A416-K420 PolarHBondContact O-N 3.14Å; E417-K420 PolarHBondContact O-N 3.46Å; K420-A423 PolarHBondContact O-N 3.27Å; K420-K424 WeakPolarHBondContact O-CG 3.47Å; K420-K424 PolarHBondContact O-N 3.08Å |
| 421 | D | 86.5 | Confident | 77.8 | Confident | 66 Ų | 66 | 98.7 Ų | 98.7 | 35% | 0.353 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -79.6 | -32.7 | 178.7 | -80.1 | 25.3 | 0 | 0 | 0 | 112.4 | E417 V418 E419 A423 K424 L425 | E417-D421 WeakPolarHBondContact O-CB 3.35Å; E417-D421 PolarHBondContact O-N 2.96Å; V418-D421 PolarHBondContact O-N 3.05Å; E419-D421 VanDerWaalsContact C-N 3.32Å; E419-D421 PolarHBondContact O-N 2.99Å; D421-A423 VanDerWaalsContact C-N 3.3Å; D421-A423 PolarHBondContact O-N 3.13Å; D421-K424 PolarHBondContact O-N 3.36Å; D421-K424 WeakPolarHBondContact OD1-CD 3.26Å; D421-K424 WeakPolarHBondContact OD1-CE 3.49Å; D421-K424 IonicContact OD1-NZ 3.85Å; D421-K424 PolarHBondContact OD1-NZ 3.14Å; D421-K424 IonicContact OD2-NZ 3.12Å; D421-K424 PolarHBondContact OD2-NZ 3.26Å; D421-L425 WeakPolarHBondContact O-CG 3.43Å; D421-L425 PolarHBondContact O-N 3.48Å |
| 422 | L | 85.6 | Confident | 75.9 | Confident | 121 Ų | 121 | 99.4 Ų | 99.4 | 63% | 0.634 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -60.3 | -40.5 | 166 | -168.5 | 70.3 | 0 | 0 | 0 | 111.2 | V418 E419 L425 A426 | V418-L422 WeakPolarHBondContact O-CB 3.46Å; V418-L422 PolarHBondContact O-N 3Å; E419-L422 PolarHBondContact O-N 3.29Å; L422-L425 PolarHBondContact O-N 2.83Å; L422-A426 WeakPolarHBondContact O-CB 3.46Å; L422-A426 PolarHBondContact O-N 3.28Å |
| 423 | A | 81.4 | Confident | 73.7 | Confident | 55 Ų | 55 | 101.8 Ų | 101.8 | 46% | 0.455 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -66.6 | -40.5 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.8 | E419 K420 D421 L425 A426 E427 | E419-A423 WeakPolarHBondContact O-CB 3.37Å; E419-A423 PolarHBondContact O-N 3.29Å; K420-A423 PolarHBondContact O-N 3.27Å; D421-A423 VanDerWaalsContact C-N 3.3Å; D421-A423 PolarHBondContact O-N 3.13Å; A423-L425 VanDerWaalsContact C-N 3.35Å; A423-L425 PolarHBondContact O-N 2.94Å; A423-A426 PolarHBondContact O-N 3.15Å; A423-E427 PolarHBondContact O-N 3.04Å; A423-E427 VanDerWaalsContact O-N 3.07Å |
| 424 | K | 74.2 | Confident | 71.4 | Confident | 108 Ų | 108 | 108.2 Ų | 108.2 | 47% | 0.47 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -57.7 | -46.8 | 171 | -69.4 | 171.3 | -166.8 | 165.3 | 0 | 111.1 | K420 D421 A426 E427 V428 | K420-K424 WeakPolarHBondContact O-CG 3.47Å; K420-K424 PolarHBondContact O-N 3.08Å; D421-K424 PolarHBondContact O-N 3.36Å; D421-K424 WeakPolarHBondContact OD1-CD 3.26Å; D421-K424 WeakPolarHBondContact OD1-CE 3.49Å; D421-K424 IonicContact OD1-NZ 3.85Å; D421-K424 PolarHBondContact OD1-NZ 3.14Å; D421-K424 IonicContact OD2-NZ 3.12Å; D421-K424 PolarHBondContact OD2-NZ 3.26Å; K424-A426 VanDerWaalsContact C-N 3.32Å; K424-A426 PolarHBondContact O-N 3.42Å; K424-E427 PolarHBondContact O-N 3.45Å; K424-V428 WeakPolarHBondContact O-CG2 3.33Å; K424-V428 PolarHBondContact O-N 3.45Å |
| 425 | L | 70.9 | Confident | 69 | Low | 121 Ų | 121 | 109 Ų | 109 | 63% | 0.634 | 59% | 0.59 | S | S | * | * | H | α-helix | trans | -63.3 | -37.5 | 178.3 | -72.1 | 168.6 | 0 | 0 | 0 | 111.9 | D421 L422 A423 V428 G429 | D421-L425 WeakPolarHBondContact O-CG 3.43Å; D421-L425 PolarHBondContact O-N 3.48Å; L422-L425 PolarHBondContact O-N 2.83Å; A423-L425 VanDerWaalsContact C-N 3.35Å; A423-L425 PolarHBondContact O-N 2.94Å; L425-V428 PolarHBondContact O-N 3.3Å; L425-G429 PolarHBondContact O-N 3.06Å |
| 426 | A | 70.8 | Confident | 66.7 | Low | 54 Ų | 54 | 108.6 Ų | 108.6 | 45% | 0.446 | 59% | 0.593 | S | S | . | * | H | α-helix | trans | -65.3 | -37 | 175.6 | 0 | 0 | 0 | 0 | 0 | 113.2 | L422 A423 K424 G429 K430 | L422-A426 WeakPolarHBondContact O-CB 3.46Å; L422-A426 PolarHBondContact O-N 3.28Å; A423-A426 PolarHBondContact O-N 3.15Å; K424-A426 VanDerWaalsContact C-N 3.32Å; K424-A426 PolarHBondContact O-N 3.42Å; A426-G429 PolarHBondContact O-N 3.29Å; A426-K430 WeakPolarHBondContact O-CG 3.32Å; A426-K430 PolarHBondContact O-N 3.36Å |
| 427 | E | 64.9 | Low | 64 | Low | 109 Ų | 109 | 113.7 Ų | 113.7 | 51% | 0.509 | 61% | 0.612 | S | S | . | * | H | α-helix | trans | -73.3 | -40 | 173.6 | -68.7 | -54.1 | 133.1 | 0 | 0 | 112.5 | A423 K424 G429 K430 M431 | A423-E427 PolarHBondContact O-N 3.04Å; A423-E427 VanDerWaalsContact O-N 3.07Å; K424-E427 PolarHBondContact O-N 3.45Å; E427-G429 PolarHBondContact O-N 2.99Å; E427-K430 PolarHBondContact O-N 2.98Å; E427-K430 IonicContact OE1-NZ 3.43Å; E427-K430 PolarHBondContact OE1-NZ 3Å; E427-K430 WeakPolarHBondContact OE2-CD 3.45Å; E427-K430 IonicContact OE2-NZ 3.51Å; E427-M431 PolarHBondContact O-N 3.32Å |
| 428 | V | 59 | Low | 61.3 | Low | 87 Ų | 87 | 115.6 Ų | 115.6 | 53% | 0.527 | 63% | 0.626 | S | S | . | * | H | α-helix | trans | -58.7 | -35.9 | 171.4 | 171.4 | 0 | 0 | 0 | 0 | 111.1 | K424 L425 K430 M431 | K424-V428 WeakPolarHBondContact O-CG2 3.33Å; K424-V428 PolarHBondContact O-N 3.45Å; L425-V428 PolarHBondContact O-N 3.3Å; V428-K430 VanDerWaalsContact C-N 3.31Å; V428-K430 PolarHBondContact O-N 3.45Å; V428-M431 VanDerWaalsContact O-CG 3.25Å; V428-M431 WeakPolarHBondContact O-CG 3.33Å |
| 429 | G | 57 | Low | 59.6 | Low | 41 Ų | 41 | 115.1 Ų | 115.1 | 42% | 0.423 | 63% | 0.625 | S | S | . | * | H | α-helix | trans | -67.4 | -21.7 | 173.7 | 0 | 0 | 0 | 0 | 0 | 115.3 | L425 A426 E427 T432 | L425-G429 PolarHBondContact O-N 3.06Å; A426-G429 PolarHBondContact O-N 3.29Å; E427-G429 PolarHBondContact O-N 2.99Å; G429-T432 PolarHBondContact O-OG1 3.17Å |
| 430 | K | 55.5 | Low | 57 | Low | 129 Ų | 129 | 117.2 Ų | 117.2 | 56% | 0.561 | 64% | 0.635 | S | S | * | * | H | α-helix | trans | -81.2 | -33.9 | 178.6 | -73.1 | 169 | -173.5 | 172.1 | 0 | 112.7 | A426 E427 V428 T432 S433 | A426-K430 WeakPolarHBondContact O-CG 3.32Å; A426-K430 PolarHBondContact O-N 3.36Å; E427-K430 PolarHBondContact O-N 2.98Å; E427-K430 IonicContact OE1-NZ 3.43Å; E427-K430 PolarHBondContact OE1-NZ 3Å; E427-K430 WeakPolarHBondContact OE2-CD 3.45Å; E427-K430 IonicContact OE2-NZ 3.51Å; V428-K430 VanDerWaalsContact C-N 3.31Å; V428-K430 PolarHBondContact O-N 3.45Å; K430-T432 VanDerWaalsContact C-N 3.29Å; K430-T432 PolarHBondContact O-N 3.22Å; K430-S433 PolarHBondContact O-N 2.85Å |
| 431 | M | 45.3 | Very low | 54.1 | Low | 161 Ų | 161 | 114.8 Ų | 114.8 | 79% | 0.793 | 64% | 0.644 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76.7 | -6.5 | -174.8 | 52.9 | -169.9 | -70.3 | 0 | 0 | 115.1 | E427 V428 | E427-M431 PolarHBondContact O-N 3.32Å; V428-M431 VanDerWaalsContact O-CG 3.25Å; V428-M431 WeakPolarHBondContact O-CG 3.33Å |
| 432 | T | 46 | Very low | 51.6 | Low | 115 Ų | 115 | 117 Ų | 117 | 71% | 0.706 | 67% | 0.665 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87.1 | -11.8 | 169.7 | 52.2 | 0 | 0 | 0 | 0 | 113.7 | G429 K430 R434 | G429-T432 PolarHBondContact O-OG1 3.17Å; K430-T432 VanDerWaalsContact C-N 3.29Å; K430-T432 PolarHBondContact O-N 3.22Å; T432-R434 PolarHBondContact O-N 3.48Å |
| 433 | S | 42.5 | Very low | 49.1 | Very low | 91 Ų | 91 | 118.2 Ų | 118.2 | 64% | 0.636 | 67% | 0.671 | S | S | * | * | S | Bend | trans | -93.2 | 44.1 | -167.5 | -67.2 | 0 | 0 | 0 | 0 | 115 | K430 | K430-S433 PolarHBondContact O-N 2.85Š|
| 434 | R | 41 | Very low | 46.7 | Very low | 249 Ų | 249 | 122.3 Ų | 122.3 | 94% | 0.94 | 69% | 0.685 | S | S | * | * | trans | -161.2 | 70.2 | 170.9 | -116.9 | 168.2 | -163.3 | -144.9 | 3.1 | 115.9 | T432 | T432-R434 PolarHBondContact O-N 3.48Š| ||
| 435 | S | 32.9 | Very low | 44.6 | Very low | 123 Ų | 123 | 124.8 Ų | 124.8 | 86% | 0.86 | 70% | 0.698 | S | S | * | * | trans | -147.3 | 152 | 153.8 | -166.1 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 436 | T | 40.7 | Very low | 43 | Very low | 115 Ų | 115 | 124.6 Ų | 124.6 | 71% | 0.706 | 70% | 0.701 | S | S | * | * | trans | -114.3 | 141 | -163.6 | 50.6 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 437 | N | 33.3 | Very low | 41.3 | Very low | 161 Ų | 161 | 127.8 Ų | 127.8 | 86% | 0.861 | 72% | 0.718 | S | S | * | * | trans | 91.1 | 135.4 | 157.6 | -53.7 | -29.9 | 0 | 0 | 0 | 119 | ||||
| 438 | N | 31.9 | Very low | 40 | Very low | 155 Ų | 155 | 129 Ų | 129 | 83% | 0.829 | 73% | 0.727 | S | S | * | * | trans | -77.3 | 177.1 | 175.8 | -114.9 | -25.8 | 0 | 0 | 0 | 111.8 | ||||
| 439 | P | 54.8 | Low | 38.5 | Very low | 89 Ų | 89 | 134.3 Ų | 134.3 | 58% | 0.578 | 74% | 0.738 | S | S | * | * | cis | -135.8 | 178.9 | -10.5 | 28 | -4.7 | 0 | 0 | 0 | 115.5 | ||||
| 440 | H | 33.9 | Very low | 37 | Very low | 189 Ų | 189 | 140.6 Ų | 140.6 | 88% | 0.875 | 76% | 0.755 | S | S | * | * | trans | 73.6 | 107.3 | 162.4 | -57.5 | -65.6 | 0 | 0 | 0 | 120.3 | ||||
| 441 | G | 27.9 | Very low | 35.6 | Very low | 71 Ų | 71 | 145.1 Ų | 145.1 | 73% | 0.732 | 77% | 0.769 | S | S | * | * | trans | -167.3 | 132.3 | 154.2 | 0 | 0 | 0 | 0 | 0 | 106.8 | ||||
| 442 | S | 33.5 | Very low | 34.7 | Very low | 113 Ų | 113 | 143.4 Ų | 143.4 | 79% | 0.79 | 77% | 0.768 | S | S | * | * | cis | 69.7 | 128.6 | 14.8 | -151 | 0 | 0 | 0 | 0 | 115.9 | ||||
| 443 | L | 33.3 | Very low | 33.9 | Very low | 146 Ų | 146 | 144.6 Ų | 144.6 | 76% | 0.764 | 77% | 0.769 | S | S | * | * | trans | 72 | 105.1 | 170.5 | -60.9 | 168.5 | 0 | 0 | 0 | 119.4 | ||||
| 444 | L | 31.7 | Very low | 34.1 | Very low | 141 Ų | 141 | 145.5 Ų | 145.5 | 74% | 0.738 | 77% | 0.773 | S | S | * | * | 51.4 | 124.6 | 127 | -53.7 | 176.3 | 0 | 0 | 0 | 121.5 | |||||
| 445 | H | 29.4 | Very low | 33.6 | Very low | 161 Ų | 161 | 139.7 Ų | 139.7 | 75% | 0.745 | 76% | 0.76 | S | S | * | * | trans | 45.5 | 118.4 | 139.2 | -68.8 | -82.3 | 0 | 0 | 0 | 121.8 | ||||
| 446 | T | 37.1 | Very low | 33.5 | Very low | 116 Ų | 116 | 139.4 Ų | 139.4 | 71% | 0.712 | 75% | 0.754 | S | S | * | * | 18.7 | 132.6 | 129.9 | -14.4 | 0 | 0 | 0 | 0 | 119.7 | |||||
| 447 | P | 35 | Very low | 33.1 | Very low | 122 Ų | 122 | 141.1 Ų | 141.1 | 79% | 0.792 | 76% | 0.758 | S | S | * | * | -129.6 | 153.5 | 124.5 | 37 | -30.2 | 0 | 0 | 0 | 114.5 | |||||
| 448 | L | 38.1 | Very low | 33.9 | Very low | 133 Ų | 133 | 138.1 Ų | 138.1 | 70% | 0.696 | 75% | 0.747 | S | S | * | * | trans | -66.3 | 162.9 | 168.6 | -71.2 | 62.9 | 0 | 0 | 0 | 111.2 | ||||
| 449 | R | 27.2 | Very low | 33.8 | Very low | 200 Ų | 200 | 138.6 Ų | 138.6 | 76% | 0.755 | 75% | 0.749 | S | S | * | * | -179.7 | 110.2 | 110.3 | -87.9 | -52 | 171 | 176.9 | -5.4 | 115.4 | |||||
| 450 | H | 27.1 | Very low | 32.6 | Very low | 172 Ų | 172 | 139.7 Ų | 139.7 | 80% | 0.796 | 75% | 0.754 | S | S | * | * | trans | 77.7 | 154.9 | 130.3 | -82.8 | -130 | 0 | 0 | 0 | 124.8 | ||||
| 451 | R | 25.1 | Very low | 32.4 | Very low | 225 Ų | 225 | 135.5 Ų | 135.5 | 85% | 0.849 | 75% | 0.746 | S | S | * | * | trans | 81.7 | 134.6 | 162.7 | -96 | -170 | 163.6 | 159.5 | -4.3 | 117.7 | ||||
| 452 | T | 27.4 | Very low | 32.6 | Very low | 125 Ų | 125 | 139 Ų | 139 | 77% | 0.767 | 75% | 0.747 | S | S | * | * | cis | -151.8 | 167.1 | -1.2 | -30.1 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 453 | L | 28.5 | Very low | 32.4 | Very low | 139 Ų | 139 | 140.3 Ų | 140.3 | 73% | 0.728 | 74% | 0.744 | S | S | * | * | trans | -75 | 170.3 | 173.5 | -83.4 | 162.3 | 0 | 0 | 0 | 114.4 | ||||
| 454 | P | 46.7 | Very low | 32.2 | Very low | 111 Ų | 111 | 139 Ų | 139 | 72% | 0.721 | 75% | 0.747 | S | S | * | * | -116.2 | 144.1 | 82.7 | -2.1 | 24.1 | 0 | 0 | 0 | 113.3 | |||||
| 455 | D | 30.8 | Very low | 31.8 | Very low | 126 Ų | 126 | 143.6 Ų | 143.6 | 67% | 0.674 | 76% | 0.755 | S | S | * | * | 76.9 | 136.2 | 72.7 | -63.9 | -47.4 | 0 | 0 | 0 | 113.8 | |||||
| 456 | T | 29.4 | Very low | 32.8 | Very low | 117 Ų | 117 | 140.2 Ų | 140.2 | 72% | 0.718 | 75% | 0.747 | S | S | * | * | cis | -144.8 | 133 | 28.6 | 52.9 | 0 | 0 | 0 | 0 | 116.7 | ||||
| 457 | L | 33.3 | Very low | 32.3 | Very low | 151 Ų | 151 | 143.4 Ų | 143.4 | 79% | 0.791 | 75% | 0.753 | S | S | * | * | 59.2 | 159.4 | 121.4 | -56.9 | -177.7 | 0 | 0 | 0 | 123.9 | |||||
| 458 | P | 48.9 | Very low | 32 | Very low | 99 Ų | 99 | 142.8 Ų | 142.8 | 64% | 0.643 | 75% | 0.752 | S | S | * | * | cis | -144.1 | 158.6 | -29.4 | 36 | -16.7 | 0 | 0 | 0 | 118.8 | ||||
| 459 | L | 31.5 | Very low | 32.9 | Very low | 164 Ų | 164 | 142.2 Ų | 142.2 | 86% | 0.859 | 76% | 0.756 | S | S | * | * | trans | 67.1 | 157.7 | 148.4 | -68.8 | 164.3 | 0 | 0 | 0 | 119.7 | ||||
| 460 | T | 29 | Very low | 33 | Very low | 113 Ų | 113 | 137.9 Ų | 137.9 | 69% | 0.693 | 76% | 0.763 | S | S | * | * | cis | -144 | 146.7 | 15.2 | 46 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 461 | S | 30.3 | Very low | 33 | Very low | 101 Ų | 101 | 133.3 Ų | 133.3 | 71% | 0.706 | 76% | 0.763 | S | S | * | * | trans | 65.7 | 153.3 | 139.3 | -60.5 | 0 | 0 | 0 | 0 | 123.6 | ||||
| 462 | L | 32 | Very low | 33.2 | Very low | 143 Ų | 143 | 126.2 Ų | 126.2 | 75% | 0.749 | 76% | 0.76 | S | S | * | * | cis | -166.8 | 145.4 | -17.9 | -101.5 | 174.1 | 0 | 0 | 0 | 112.4 | ||||
| 463 | I | 29.1 | Very low | 33.6 | Very low | 141 Ų | 141 | 128.6 Ų | 128.6 | 72% | 0.723 | 77% | 0.767 | S | S | * | * | trans | 60 | 120.6 | 149.2 | -50.2 | 156.4 | 0 | 0 | 0 | 122.3 | ||||
| 464 | S | 28.4 | Very low | 33.8 | Very low | 119 Ų | 119 | 127.7 Ų | 127.7 | 83% | 0.832 | 77% | 0.772 | S | S | * | * | 169.5 | 148.5 | 123.3 | -78.1 | 0 | 0 | 0 | 0 | 117.5 | |||||
| 465 | R | 24.4 | Very low | 32.9 | Very low | 238 Ų | 238 | 125.2 Ų | 125.2 | 90% | 0.898 | 77% | 0.766 | S | S | * | * | trans | -159.5 | 175.3 | 168.5 | -134.3 | -155.4 | 156.8 | -162.1 | -2.7 | 106.1 | ||||
| 466 | P | 48.8 | Very low | 33.1 | Very low | 89 Ų | 89 | 129 Ų | 129 | 58% | 0.578 | 78% | 0.777 | S | S | * | * | cis | -144.5 | -159.4 | 6.1 | 43.4 | -20.6 | 0 | 0 | 0 | 117 | ||||
| 467 | Q | 27.3 | Very low | 33.2 | Very low | 183 Ų | 183 | 129.2 Ų | 129.2 | 86% | 0.855 | 78% | 0.784 | S | S | * | * | trans | 92.6 | 161 | 152 | -81.4 | 170.9 | -6 | 0 | 0 | 122.6 | ||||
| 468 | S | 29.1 | Very low | 33.1 | Very low | 109 Ų | 109 | 128 Ų | 128 | 76% | 0.762 | 79% | 0.786 | S | S | * | * | trans | -168.3 | -167 | -170.1 | 64.1 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 469 | P | 56.4 | Low | 32.1 | Very low | 121 Ų | 121 | 126 Ų | 126 | 79% | 0.786 | 78% | 0.784 | S | S | * | * | cis | -131.8 | 174.5 | -26.5 | 40.8 | -25.7 | 0 | 0 | 0 | 114.3 | ||||
| 470 | A | 29.4 | Very low | 32.1 | Very low | 109 Ų | 109 | 127 Ų | 127 | 90% | 0.901 | 79% | 0.788 | S | S | * | * | trans | -171.2 | 159.3 | 159 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 471 | G | 27.3 | Very low | 32.1 | Very low | 77 Ų | 77 | 124.8 Ų | 124.8 | 79% | 0.794 | 79% | 0.788 | S | S | * | * | cis | 161.2 | 133.8 | -14 | 0 | 0 | 0 | 0 | 0 | 115.2 | ||||
| 472 | G | 28.6 | Very low | 32.1 | Very low | 75 Ų | 75 | 128.3 Ų | 128.3 | 77% | 0.773 | 80% | 0.798 | S | S | * | * | trans | 77.2 | 169 | 167 | 0 | 0 | 0 | 0 | 0 | 117.2 | ||||
| 473 | L | 36.6 | Very low | 32.7 | Very low | 175 Ų | 175 | 126.9 Ų | 126.9 | 92% | 0.916 | 80% | 0.797 | S | S | * | * | cis | -163.8 | 162.5 | -16.5 | -86.6 | -178.2 | 0 | 0 | 0 | 105.9 | ||||
| 474 | S | 32.4 | Very low | 32.8 | Very low | 121 Ų | 121 | 127.5 Ų | 127.5 | 85% | 0.846 | 80% | 0.801 | S | S | * | * | cis | -142.5 | -155.9 | -2.4 | -154.7 | 0 | 0 | 0 | 0 | 107 | ||||
| 475 | G | 28.7 | Very low | 32.8 | Very low | 58 Ų | 58 | 129.6 Ų | 129.6 | 60% | 0.598 | 80% | 0.802 | S | S | * | * | cis | -166.3 | -169.1 | 2.9 | 0 | 0 | 0 | 0 | 0 | 110 | ||||
| 476 | K | 34.3 | Very low | 33.1 | Very low | 205 Ų | 205 | 123 Ų | 123 | 89% | 0.891 | 79% | 0.792 | S | S | * | * | trans | -155.6 | 168 | -166.8 | -63.4 | -176.1 | -179.2 | 177.1 | 0 | 117.6 | ||||
| 477 | S | 31.5 | Very low | 32.8 | Very low | 123 Ų | 123 | 124.7 Ų | 124.7 | 86% | 0.86 | 80% | 0.803 | S | S | * | * | trans | 82 | 150.5 | 159.1 | 81.9 | 0 | 0 | 0 | 0 | 116.9 | ||||
| 478 | C | 31.6 | Very low | 32.9 | Very low | 124 Ų | 124 | 125.2 Ų | 125.2 | 84% | 0.838 | 80% | 0.803 | S | S | * | * | cis | -147 | -173.2 | 0.2 | 74.4 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 479 | G | 28.4 | Very low | 34 | Very low | 59 Ų | 59 | 125.2 Ų | 125.2 | 61% | 0.608 | 80% | 0.8 | S | S | * | * | cis | 159.4 | 163.2 | 0.1 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 480 | I | 31.5 | Very low | 32.8 | Very low | 185 Ų | 185 | 125.9 Ų | 125.9 | 95% | 0.949 | 80% | 0.802 | S | S | * | * | trans | 70.7 | 147.2 | 173.3 | -49.1 | 155.6 | 0 | 0 | 0 | 114 | ||||
| 481 | G | 27.6 | Very low | 32.9 | Very low | 66 Ų | 66 | 125.5 Ų | 125.5 | 68% | 0.68 | 79% | 0.793 | S | S | * | * | cis | -178.3 | 163.4 | -6.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 482 | L | 29.7 | Very low | 33.2 | Very low | 174 Ų | 174 | 128.8 Ų | 128.8 | 91% | 0.911 | 79% | 0.791 | S | S | * | * | trans | -94.8 | -177.4 | 179.5 | -60.1 | 174.1 | 0 | 0 | 0 | 111.1 | ||||
| 483 | P | 45.2 | Very low | 33.3 | Very low | 113 Ų | 113 | 129.7 Ų | 129.7 | 73% | 0.734 | 79% | 0.786 | S | S | * | * | cis | -142.9 | 174.2 | 4.3 | 44.4 | -25.6 | 0 | 0 | 0 | 118.6 | ||||
| 484 | L | 31.2 | Very low | 33.1 | Very low | 154 Ų | 154 | 129.4 Ų | 129.4 | 81% | 0.806 | 78% | 0.782 | S | S | * | * | trans | 30.9 | 128.6 | 136.9 | -168.7 | 72.1 | 0 | 0 | 0 | 122 | ||||
| 485 | L | 29.4 | Very low | 32.8 | Very low | 163 Ų | 163 | 128 Ų | 128 | 85% | 0.853 | 77% | 0.772 | S | S | * | * | -179 | 161 | 123.1 | -99.4 | 168.4 | 0 | 0 | 0 | 114.8 | |||||
| 486 | S | 30.2 | Very low | 33 | Very low | 99 Ų | 99 | 133.3 Ų | 133.3 | 69% | 0.692 | 78% | 0.784 | S | S | * | * | trans | -128 | 160.1 | 168 | 74 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 487 | P | 41.7 | Very low | 32.9 | Very low | 125 Ų | 125 | 128.6 Ų | 128.6 | 81% | 0.812 | 78% | 0.776 | S | S | * | * | -152.9 | -167.2 | 65.9 | 41 | -18.6 | 0 | 0 | 0 | 116.5 | |||||
| 488 | K | 30.5 | Very low | 33 | Very low | 194 Ų | 194 | 131.8 Ų | 131.8 | 84% | 0.843 | 78% | 0.78 | S | S | * | * | trans | -87.6 | 178 | 164.5 | -101.5 | 166.9 | 179.2 | 169 | 0 | 110.2 | ||||
| 489 | P | 51.4 | Low | 32.8 | Very low | 109 Ų | 109 | 128.8 Ų | 128.8 | 71% | 0.708 | 77% | 0.77 | S | S | * | * | cis | -150.9 | -172.8 | 32.5 | 40.8 | -17.7 | 0 | 0 | 0 | 119 | ||||
| 490 | T | 32.5 | Very low | 33.2 | Very low | 136 Ų | 136 | 136.9 Ų | 136.9 | 83% | 0.834 | 78% | 0.783 | S | S | * | * | trans | 66.1 | 156.6 | 163.3 | 15.2 | 0 | 0 | 0 | 0 | 116.7 | ||||
| 491 | S | 29.9 | Very low | 33.3 | Very low | 101 Ų | 101 | 133.3 Ų | 133.3 | 71% | 0.706 | 77% | 0.77 | S | S | * | * | cis | -153.3 | 173.1 | -6.7 | 70.1 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 492 | L | 35 | Very low | 34.9 | Very low | 145 Ų | 145 | 135.5 Ų | 135.5 | 76% | 0.759 | 77% | 0.771 | S | S | * | * | cis | -139.7 | -122.1 | -4.5 | -139.3 | 172.8 | 0 | 0 | 0 | 105.8 | ||||
| 493 | S | 30.6 | Very low | 34.7 | Very low | 95 Ų | 95 | 133.2 Ų | 133.2 | 66% | 0.664 | 77% | 0.77 | S | S | * | * | cis | -171.2 | 136.7 | -35.5 | 37.5 | 0 | 0 | 0 | 0 | 105.6 | ||||
| 494 | M | 31.3 | Very low | 33.9 | Very low | 168 Ų | 168 | 135.4 Ų | 135.4 | 83% | 0.828 | 78% | 0.776 | S | S | * | * | cis | -134.4 | -131.3 | -9.7 | -85.9 | -77.2 | -157 | 0 | 0 | 106.2 | ||||
| 495 | S | 27.6 | Very low | 34.6 | Very low | 92 Ų | 92 | 133.8 Ų | 133.8 | 64% | 0.643 | 78% | 0.775 | S | S | * | * | cis | -163.6 | 121.8 | -6.4 | 50.5 | 0 | 0 | 0 | 0 | 112 | ||||
| 496 | M | 31.9 | Very low | 34.5 | Very low | 170 Ų | 170 | 129.3 Ų | 129.3 | 84% | 0.837 | 77% | 0.767 | S | S | * | * | trans | 62.1 | 152.8 | 160.3 | -47.6 | -47.8 | 143.2 | 0 | 0 | 118.5 | ||||
| 497 | S | 33.1 | Very low | 34.5 | Very low | 105 Ų | 105 | 130.5 Ų | 130.5 | 73% | 0.734 | 78% | 0.776 | S | S | * | * | cis | 177.8 | 150.2 | -23.9 | 55.3 | 0 | 0 | 0 | 0 | 106.1 | ||||
| 498 | M | 32.6 | Very low | 33.9 | Very low | 190 Ų | 190 | 135.3 Ų | 135.3 | 94% | 0.936 | 78% | 0.778 | S | S | * | * | cis | -160.5 | 176 | -5.3 | -107.4 | -67 | -161.8 | 0 | 0 | 104.9 | ||||
| 499 | G | 27.7 | Very low | 33.9 | Very low | 62 Ų | 62 | 131 Ų | 131 | 64% | 0.639 | 77% | 0.767 | S | S | * | * | cis | -180 | 163.2 | -0.6 | 0 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 500 | R | 35.6 | Very low | 32.9 | Very low | 229 Ų | 229 | 133.8 Ų | 133.8 | 86% | 0.864 | 77% | 0.771 | S | S | * | * | trans | -157.7 | 155.8 | -171.1 | -155.2 | -166.7 | 169.2 | -147 | -0.6 | 114 | ||||
| 501 | T | 33.7 | Very low | 32.9 | Very low | 110 Ų | 110 | 133.3 Ų | 133.3 | 68% | 0.675 | 77% | 0.768 | S | S | * | * | trans | 71.5 | 177.2 | 163.6 | 71.3 | 0 | 0 | 0 | 0 | 117.4 | ||||
| 502 | P | 61 | Low | 33.4 | Very low | 111 Ų | 111 | 133.9 Ų | 133.9 | 72% | 0.721 | 77% | 0.769 | S | S | * | * | -137.2 | -179.9 | -57 | 36.9 | -19.9 | 0 | 0 | 0 | 114.6 | |||||
| 503 | S | 25.8 | Very low | 33.1 | Very low | 126 Ų | 126 | 138.5 Ų | 138.5 | 88% | 0.881 | 78% | 0.777 | S | S | * | * | trans | 176.9 | 173 | 140.2 | 38.3 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 504 | N | 29.6 | Very low | 33.4 | Very low | 159 Ų | 159 | 140.3 Ų | 140.3 | 85% | 0.85 | 78% | 0.784 | S | S | * | * | trans | -120.6 | -171.6 | -178.2 | -128.5 | -14.9 | 0 | 0 | 0 | 108.6 | ||||
| 505 | P | 46.3 | Very low | 34.2 | Very low | 121 Ų | 121 | 137.7 Ų | 137.7 | 79% | 0.786 | 78% | 0.779 | S | S | * | * | cis | -129.9 | -176.6 | 4.2 | 42.5 | -24.3 | 0 | 0 | 0 | 115.3 | ||||
| 506 | G | 26.2 | Very low | 34.2 | Very low | 68 Ų | 68 | 139 Ų | 139 | 70% | 0.701 | 79% | 0.789 | S | S | * | * | trans | -114 | -171.7 | -176.4 | 0 | 0 | 0 | 0 | 0 | 116.9 | ||||
| 507 | S | 31.2 | Very low | 34.4 | Very low | 124 Ų | 124 | 142.1 Ų | 142.1 | 87% | 0.867 | 79% | 0.791 | S | S | * | * | trans | -173 | 136.3 | 166 | -88 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 508 | R | 29.2 | Very low | 35 | Very low | 227 Ų | 227 | 141.7 Ų | 141.7 | 86% | 0.857 | 79% | 0.786 | S | S | * | * | trans | 55.1 | 140.1 | 147.7 | -116.8 | 174.9 | -176.7 | -162.1 | 0.5 | 118.7 | ||||
| 509 | T | 28.8 | Very low | 34.9 | Very low | 102 Ų | 102 | 140.3 Ų | 140.3 | 63% | 0.626 | 78% | 0.782 | S | S | * | * | cis | -164 | 127.8 | 43.8 | -54.6 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 510 | Q | 30.4 | Very low | 35.4 | Very low | 169 Ų | 169 | 143.3 Ų | 143.3 | 79% | 0.79 | 79% | 0.788 | S | S | * | * | trans | 50 | 137 | 149 | -58.8 | 175.1 | 56.8 | 0 | 0 | 123.5 | ||||
| 511 | T | 34 | Very low | 36 | Very low | 125 Ų | 125 | 137.5 Ų | 137.5 | 77% | 0.767 | 78% | 0.78 | S | S | * | * | trans | -97.4 | 173.1 | 153 | 57.7 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 512 | P | 40 | Very low | 35.8 | Very low | 113 Ų | 113 | 139.8 Ų | 139.8 | 73% | 0.734 | 79% | 0.788 | S | S | * | * | -153.6 | 143 | 101.3 | 37.4 | -19.1 | 0 | 0 | 0 | 118.2 | |||||
| 513 | R | 29.2 | Very low | 34.5 | Very low | 243 Ų | 243 | 139.4 Ų | 139.4 | 92% | 0.917 | 79% | 0.788 | S | S | * | * | trans | 54.3 | 139.1 | 132 | -61.5 | -177.4 | 174.1 | 174.5 | -2.3 | 123.5 | ||||
| 514 | T | 35.9 | Very low | 35.1 | Very low | 132 Ų | 132 | 141 Ų | 141 | 81% | 0.81 | 79% | 0.785 | S | S | * | * | trans | -80.9 | -174.1 | 152.5 | 55.5 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 515 | P | 48.2 | Very low | 35.5 | Very low | 113 Ų | 113 | 140.6 Ų | 140.6 | 73% | 0.734 | 78% | 0.783 | S | S | * | * | cis | -131.7 | 176.1 | -6.9 | 42.9 | -28.2 | 0 | 0 | 0 | 114.7 | ||||
| 516 | S | 26.9 | Very low | 34.9 | Very low | 121 Ų | 121 | 140.4 Ų | 140.4 | 85% | 0.846 | 78% | 0.779 | S | S | * | * | trans | 174.1 | 144 | 137.8 | 53.3 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 517 | R | 37.1 | Very low | 35 | Very low | 234 Ų | 234 | 147.9 Ų | 147.9 | 88% | 0.883 | 79% | 0.787 | S | S | * | * | trans | -98.1 | 163.8 | 155.7 | -151.3 | 167.1 | 176.8 | -105.8 | 0.5 | 105.7 | ||||
| 518 | P | 45.3 | Very low | 34.9 | Very low | 96 Ų | 96 | 146.9 Ų | 146.9 | 62% | 0.623 | 78% | 0.78 | S | S | * | * | cis | -155.9 | -163.8 | 30.7 | 43.9 | -19.9 | 0 | 0 | 0 | 118.7 | ||||
| 519 | L | 31.3 | Very low | 34.9 | Very low | 161 Ų | 161 | 140.1 Ų | 140.1 | 84% | 0.843 | 77% | 0.767 | S | S | * | * | trans | 81.2 | 124.4 | 156.6 | -67.6 | 168 | 0 | 0 | 0 | 121.3 | ||||
| 520 | T | 38.3 | Very low | 35 | Very low | 125 Ų | 125 | 145 Ų | 145 | 77% | 0.767 | 78% | 0.78 | S | S | * | * | trans | -76.1 | 163 | 155.5 | 32.8 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 521 | P | 47.6 | Very low | 35.2 | Very low | 108 Ų | 108 | 143.8 Ų | 143.8 | 70% | 0.701 | 78% | 0.779 | S | S | * | * | -158.4 | -170.5 | 67.6 | 43.5 | -20.5 | 0 | 0 | 0 | 119.2 | |||||
| 522 | N | 28.6 | Very low | 35.5 | Very low | 157 Ų | 157 | 143.8 Ų | 143.8 | 84% | 0.84 | 78% | 0.781 | S | S | * | * | trans | 96.2 | 153.4 | 157.4 | -64.4 | -19.5 | 0 | 0 | 0 | 120.3 | ||||
| 523 | S | 34.4 | Very low | 34.8 | Very low | 104 Ų | 104 | 142 Ų | 142 | 73% | 0.727 | 78% | 0.783 | S | S | * | * | trans | -137.7 | -147.2 | -168.3 | 64.3 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 524 | L | 39.1 | Very low | 34.8 | Very low | 158 Ų | 158 | 135.1 Ų | 135.1 | 83% | 0.827 | 78% | 0.778 | S | S | * | * | trans | 76.2 | 144.6 | -170.4 | -42.4 | 175.3 | 0 | 0 | 0 | 112 | ||||
| 525 | L | 38.4 | Very low | 34.4 | Very low | 151 Ų | 151 | 136.4 Ų | 136.4 | 79% | 0.791 | 78% | 0.775 | S | S | * | * | cis | -138.5 | 149.2 | 18.4 | -76.6 | 165.4 | 0 | 0 | 0 | 114.8 | ||||
| 526 | T | 32.1 | Very low | 33.7 | Very low | 117 Ų | 117 | 137.9 Ų | 137.9 | 72% | 0.718 | 77% | 0.77 | S | S | * | * | trans | -17.2 | 155.7 | 146 | 59.7 | 0 | 0 | 0 | 0 | 119.2 | ||||
| 527 | R | 29.4 | Very low | 33.9 | Very low | 226 Ų | 226 | 139.1 Ų | 139.1 | 85% | 0.853 | 76% | 0.762 | S | S | * | * | cis | -156.5 | 167.7 | 49.6 | -79.7 | 177.5 | 151.6 | -128.4 | 2.8 | 110.7 | ||||
| 528 | S | 28.1 | Very low | 33.7 | Very low | 103 Ų | 103 | 133.8 Ų | 133.8 | 72% | 0.72 | 76% | 0.755 | S | S | * | * | cis | 79.7 | 133.1 | 29.2 | -179.3 | 0 | 0 | 0 | 0 | 116.1 | ||||
| 529 | S | 29.7 | Very low | 33.1 | Very low | 84 Ų | 84 | 134.8 Ų | 134.8 | 59% | 0.587 | 76% | 0.76 | S | S | * | * | cis | -172.7 | 174 | -15.7 | -173.7 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 530 | F | 31.6 | Very low | 33.1 | Very low | 204 Ų | 204 | 134.3 Ų | 134.3 | 90% | 0.895 | 75% | 0.751 | S | S | * | * | trans | 81.3 | 167.8 | 161.5 | -65 | -67.7 | 0 | 0 | 0 | 121.9 | ||||
| 531 | N | 34.6 | Very low | 32.8 | Very low | 144 Ų | 144 | 137 Ų | 137 | 77% | 0.77 | 75% | 0.747 | S | S | * | * | trans | -135.6 | 148.8 | -156.7 | -166.8 | -8.4 | 0 | 0 | 0 | 108.8 | ||||
| 532 | P | 39.3 | Very low | 32.1 | Very low | 126 Ų | 126 | 142.5 Ų | 142.5 | 82% | 0.818 | 75% | 0.754 | S | S | * | * | -158.6 | 179.8 | 105.8 | 41.2 | -22.6 | 0 | 0 | 0 | 116.3 | |||||
| 533 | G | 26.4 | Very low | 32.3 | Very low | 75 Ų | 75 | 139.6 Ų | 139.6 | 77% | 0.773 | 75% | 0.746 | S | S | * | * | trans | 130.4 | 81.2 | 140.3 | 0 | 0 | 0 | 0 | 0 | 121.6 | ||||
| 534 | A | 28.4 | Very low | 32.3 | Very low | 99 Ų | 99 | 146.1 Ų | 146.1 | 82% | 0.818 | 76% | 0.755 | S | S | * | * | trans | -3.4 | 130.5 | 152.3 | 0 | 0 | 0 | 0 | 0 | 124.8 | ||||
| 535 | H | 28.7 | Very low | 32 | Very low | 159 Ų | 159 | 144 Ų | 144 | 74% | 0.736 | 75% | 0.753 | S | S | * | * | 86.2 | 135.9 | 122.3 | -158.5 | 38.6 | 0 | 0 | 0 | 123 | |||||
| 536 | K | 33 | Very low | 32.1 | Very low | 144 Ų | 144 | 148 Ų | 148 | 63% | 0.626 | 76% | 0.758 | S | S | * | * | trans | 74.1 | 148 | 169.1 | -55.8 | -174.6 | 176.9 | -61.3 | 0 | 117.1 | ||||
| 537 | E | 30.6 | Very low | 32.2 | Very low | 146 Ų | 146 | 148.4 Ų | 148.4 | 68% | 0.682 | 76% | 0.763 | S | S | * | * | cis | -154.1 | 152.4 | -12.4 | -122.8 | 152.9 | -143.9 | 0 | 0 | 112.5 | ||||
| 538 | V | 32.9 | Very low | 32.4 | Very low | 123 Ų | 123 | 144.3 Ų | 144.3 | 75% | 0.745 | 76% | 0.762 | S | S | * | * | trans | 16.3 | 122.9 | 146.7 | 177.1 | 0 | 0 | 0 | 0 | 118 | ||||
| 539 | T | 32.8 | Very low | 32.8 | Very low | 116 Ų | 116 | 145.5 Ų | 145.5 | 71% | 0.712 | 77% | 0.765 | S | S | * | * | -175.1 | 178.5 | 76 | -16.3 | 0 | 0 | 0 | 0 | 109.3 | |||||
| 540 | F | 32 | Very low | 33.3 | Very low | 151 Ų | 151 | 147.9 Ų | 147.9 | 66% | 0.662 | 78% | 0.779 | S | S | * | * | cis | -162.7 | 160.1 | -5.8 | -147.7 | -3.8 | 0 | 0 | 0 | 110.6 | ||||
| 541 | R | 32.2 | Very low | 33.3 | Very low | 181 Ų | 181 | 144.8 Ų | 144.8 | 68% | 0.683 | 78% | 0.777 | S | S | * | * | trans | 64.2 | 146 | 160.4 | -54.6 | -61.8 | 167.8 | 142.2 | -0.5 | 117.5 | ||||
| 542 | R | 32.3 | Very low | 33.1 | Very low | 224 Ų | 224 | 143.6 Ų | 143.6 | 85% | 0.845 | 78% | 0.779 | S | S | * | * | cis | -150.1 | 164.6 | -13.3 | -160.6 | 173.4 | -173.4 | 160.9 | 0.6 | 108.7 | ||||
| 543 | S | 32.4 | Very low | 32.8 | Very low | 97 Ų | 97 | 146.1 Ų | 146.1 | 68% | 0.678 | 78% | 0.781 | S | S | * | * | trans | -124 | 151.3 | -159.9 | -25.2 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 544 | R | 33.9 | Very low | 34 | Very low | 240 Ų | 240 | 147.9 Ų | 147.9 | 91% | 0.906 | 78% | 0.778 | S | S | * | * | trans | 67.2 | 161 | 151.7 | -66.4 | 178.4 | -176.1 | -144.2 | 1 | 116.4 | ||||
| 545 | S | 33.7 | Very low | 34.1 | Very low | 114 Ų | 114 | 149 Ų | 149 | 80% | 0.797 | 78% | 0.777 | S | S | * | * | cis | -159.9 | 179.6 | -2 | 24.5 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 546 | R | 39.2 | Very low | 34.4 | Very low | 235 Ų | 235 | 149.3 Ų | 149.3 | 89% | 0.887 | 78% | 0.784 | S | S | * | * | trans | -61.8 | 162 | 173.6 | -53.2 | 174.6 | 178.6 | -138.6 | 2.9 | 114.6 | ||||
| 547 | P | 34.4 | Very low | 35 | Very low | 126 Ų | 126 | 147.2 Ų | 147.2 | 82% | 0.818 | 78% | 0.784 | S | S | * | * | trans | -106.8 | 176.6 | 152.8 | 38.1 | -29.8 | 0 | 0 | 0 | 113.7 | ||||
| 548 | V | 34 | Very low | 35.2 | Very low | 139 Ų | 139 | 151 Ų | 151 | 84% | 0.842 | 79% | 0.792 | S | S | * | * | trans | -137.1 | 166.3 | -177.1 | 173.3 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 549 | T | 35.8 | Very low | 35.8 | Very low | 129 Ų | 129 | 149.8 Ų | 149.8 | 79% | 0.791 | 79% | 0.787 | S | S | * | * | trans | -70.8 | 155.1 | -176.8 | 48.7 | 0 | 0 | 0 | 0 | 116.6 | ||||
| 550 | P | 40.6 | Very low | 35.6 | Very low | 133 Ų | 133 | 152.3 Ų | 152.3 | 86% | 0.864 | 80% | 0.795 | S | S | * | * | trans | -121.8 | -173.9 | 147.6 | 37.9 | -26 | 0 | 0 | 0 | 113 | ||||
| 551 | T | 31.9 | Very low | 35.8 | Very low | 140 Ų | 140 | 152.4 Ų | 152.4 | 86% | 0.859 | 80% | 0.802 | S | S | * | * | trans | -137.3 | 149.2 | -165.1 | -172.7 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 552 | S | 29.6 | Very low | 36 | Very low | 118 Ų | 118 | 150.1 Ų | 150.1 | 83% | 0.825 | 81% | 0.808 | S | S | * | * | trans | -173.6 | 162.4 | 155.6 | 53 | 0 | 0 | 0 | 0 | 113 | ||||
| 553 | Q | 33.6 | Very low | 36.3 | Very low | 180 Ų | 180 | 145.2 Ų | 145.2 | 84% | 0.841 | 81% | 0.806 | S | S | * | * | trans | -108.9 | -167.4 | -176.8 | -64.3 | -178.4 | -22.2 | 0 | 0 | 112 | ||||
| 554 | P | 51.4 | Low | 36.7 | Very low | 111 Ų | 111 | 146.2 Ų | 146.2 | 72% | 0.721 | 81% | 0.809 | S | S | * | * | -120.8 | 178.2 | -65.2 | 36.5 | -22.3 | 0 | 0 | 0 | 112.1 | |||||
| 555 | P | 31.4 | Very low | 36.8 | Very low | 124 Ų | 124 | 138.7 Ų | 138.7 | 81% | 0.805 | 81% | 0.807 | S | S | * | * | -148.4 | 163 | 110.2 | 38.1 | -22.6 | 0 | 0 | 0 | 116.5 | |||||
| 556 | L | 34.9 | Very low | 37 | Very low | 165 Ų | 165 | 140 Ų | 140 | 86% | 0.864 | 81% | 0.805 | S | S | * | * | trans | -115 | 168.5 | 165.6 | -85.1 | 169.5 | 0 | 0 | 0 | 108.5 | ||||
| 557 | P | 45.8 | Very low | 36.6 | Very low | 99 Ų | 99 | 133.5 Ų | 133.5 | 64% | 0.643 | 80% | 0.795 | S | S | * | * | cis | -145.8 | 166.1 | 22.5 | 42.4 | -23 | 0 | 0 | 0 | 119.7 | ||||
| 558 | R | 35.1 | Very low | 36.6 | Very low | 226 Ų | 226 | 132.7 Ų | 132.7 | 85% | 0.853 | 79% | 0.788 | S | S | * | * | trans | 73.4 | 165.2 | 140.2 | -81.7 | 175.8 | -165.4 | 167 | 4.6 | 119.9 | ||||
| 559 | P | 44.8 | Very low | 37 | Very low | 97 Ų | 97 | 131.2 Ų | 131.2 | 63% | 0.63 | 78% | 0.779 | S | S | * | * | -148.2 | 138.2 | -63.9 | 38.4 | -17.5 | 0 | 0 | 0 | 116.8 | |||||
| 560 | L | 28.3 | Very low | 37.3 | Very low | 169 Ų | 169 | 132.2 Ų | 132.2 | 89% | 0.885 | 78% | 0.78 | S | S | * | * | trans | -147 | 116.7 | 152.6 | -71.7 | 178.2 | 0 | 0 | 0 | 107.9 | ||||
| 561 | L | 36 | Very low | 37.3 | Very low | 153 Ų | 153 | 130 Ų | 130 | 80% | 0.801 | 77% | 0.767 | S | S | * | * | 76.8 | 56.5 | 59.4 | -70.3 | 176.8 | 0 | 0 | 0 | 116.2 | |||||
| 562 | T | 37.1 | Very low | 38 | Very low | 134 Ų | 134 | 126.3 Ų | 126.3 | 82% | 0.822 | 74% | 0.742 | S | S | * | * | trans | -169.1 | 131.7 | 137 | 5 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 563 | P | 37.9 | Very low | 39 | Very low | 121 Ų | 121 | 122.9 Ų | 122.9 | 79% | 0.786 | 73% | 0.725 | S | S | * | * | P | Polyproline II helix | trans | -97.4 | 122 | 166.7 | 33.4 | -27.4 | 0 | 0 | 0 | 111.6 | ||
| 564 | P | 41.3 | Very low | 39.8 | Very low | 117 Ų | 117 | 117.9 Ų | 117.9 | 76% | 0.76 | 71% | 0.714 | S | S | * | * | P | Polyproline II helix | trans | -63.9 | 156.5 | 161.2 | -20.7 | 34.3 | 0 | 0 | 0 | 111.7 | ||
| 565 | G | 36.7 | Very low | 39.8 | Very low | 83 Ų | 83 | 115.7 Ų | 115.7 | 86% | 0.856 | 70% | 0.702 | S | S | * | * | P | Polyproline II helix | trans | -65.9 | 149 | -175.8 | 0 | 0 | 0 | 0 | 0 | 114.2 | ||
| 566 | L | 36.3 | Very low | 40.7 | Very low | 142 Ų | 142 | 114 Ų | 114 | 74% | 0.743 | 69% | 0.685 | S | S | * | * | P | Polyproline II helix | trans | -98.3 | 124.6 | -178.5 | -70.1 | 168.2 | 0 | 0 | 0 | 111.8 | L572 | L566-L572 HydrophobicContact CD1-CD2 3.99Å; L566-L572 HydrophobicContact CD2-CD2 4.33Å |
| 567 | S | 31.8 | Very low | 41.7 | Very low | 98 Ų | 98 | 114 Ų | 114 | 69% | 0.685 | 67% | 0.674 | S | S | * | * | trans | -105.3 | 160.7 | 153.8 | 61.4 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 568 | T | 33.6 | Very low | 42.2 | Very low | 108 Ų | 108 | 112.8 Ų | 112.8 | 66% | 0.663 | 67% | 0.672 | S | S | * | * | trans | 62.6 | 117.9 | 176.9 | 68.7 | 0 | 0 | 0 | 0 | 116 | ||||
| 569 | T | 43.5 | Very low | 43.2 | Very low | 108 Ų | 108 | 111.5 Ų | 111.5 | 66% | 0.663 | 67% | 0.669 | S | S | * | * | S | Bend | trans | -79.3 | -25.3 | -174.5 | 39.4 | 0 | 0 | 0 | 0 | 114.5 | S571 L572 | T569-S571 VanDerWaalsContact C-N 3.3Å; T569-S571 PolarHBondContact O-N 3.1Å; T569-L572 PolarHBondContact O-N 3.33Å |
| 570 | D | 42.5 | Very low | 44.3 | Very low | 151 Ų | 151 | 109.8 Ų | 109.8 | 81% | 0.807 | 65% | 0.654 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74.5 | -15.8 | -163.8 | -58.5 | -24 | 0 | 0 | 0 | 114.6 | ||
| 571 | S | 40.8 | Very low | 46.5 | Very low | 85 Ų | 85 | 104.3 Ų | 104.3 | 59% | 0.594 | 63% | 0.63 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -83.9 | -14.7 | 175.4 | -68.4 | 0 | 0 | 0 | 0 | 114 | T569 G573 A574 S575 | T569-S571 VanDerWaalsContact C-N 3.3Å; T569-S571 PolarHBondContact O-N 3.1Å; S571-G573 PolarHBondContact O-N 2.92Å; S571-A574 PolarHBondContact O-N 3.18Å; S571-S575 PolarHBondContact O-N 3.41Å |
| 572 | L | 46.3 | Very low | 48.1 | Very low | 64 Ų | 64 | 102.8 Ų | 102.8 | 34% | 0.335 | 62% | 0.619 | S | S | . | * | H | α-helix | trans | -71.4 | -33.5 | -172 | -67.9 | 172.7 | 0 | 0 | 0 | 113.3 | L566 T569 A574 S575 L576 | L566-L572 HydrophobicContact CD1-CD2 3.99Å; L566-L572 HydrophobicContact CD2-CD2 4.33Å; T569-L572 PolarHBondContact O-N 3.33Å; L572-A574 PolarHBondContact O-N 2.97Å; L572-S575 PolarHBondContact O-N 3.06Å; L572-L576 PolarHBondContact O-N 3.35Å |
| 573 | G | 49.1 | Very low | 49.8 | Very low | 45 Ų | 45 | 102.7 Ų | 102.7 | 46% | 0.464 | 61% | 0.613 | S | S | . | * | H | α-helix | trans | -65.9 | -23.4 | 177.9 | 0 | 0 | 0 | 0 | 0 | 114.3 | S571 | S571-G573 PolarHBondContact O-N 2.92Å |
| 574 | A | 51.7 | Low | 51.7 | Low | 75 Ų | 75 | 102 Ų | 102 | 62% | 0.62 | 60% | 0.599 | S | S | * | * | H | α-helix | trans | -81.7 | -41.4 | 172.2 | 0 | 0 | 0 | 0 | 0 | 111.8 | S571 L572 | S571-A574 PolarHBondContact O-N 3.18Å; L572-A574 PolarHBondContact O-N 2.97Å |
| 575 | S | 51.7 | Low | 53.7 | Low | 66 Ų | 66 | 98.5 Ų | 98.5 | 46% | 0.462 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -71.2 | -42.8 | -175.9 | -167.8 | 0 | 0 | 0 | 0 | 113.2 | S571 L572 R577 A578 | S571-S575 PolarHBondContact O-N 3.41Å; L572-S575 PolarHBondContact O-N 3.06Å; S575-R577 VanDerWaalsContact C-N 3.33Å; S575-R577 PolarHBondContact O-N 3.29Å; S575-A578 WeakPolarHBondContact O-CB 3.39Å; S575-A578 PolarHBondContact O-N 3.05Å; S575-A578 VanDerWaalsContact O-N 3.08Å |
| 576 | L | 49.7 | Very low | 55.5 | Low | 88 Ų | 88 | 100.3 Ų | 100.3 | 46% | 0.461 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -64.2 | -34.6 | -178.6 | -84.2 | 159.6 | 0 | 0 | 0 | 113.3 | L572 A578 Y579 L580 | L572-L576 PolarHBondContact O-N 3.35Å; L576-A578 PolarHBondContact O-N 3.39Å; L576-Y579 PolarHBondContact O-N 3Å; L576-L580 HydrophobicContact CD2-CD1 4.1Å; L576-L580 PolarHBondContact O-N 3.13Å |
| 577 | R | 55.7 | Low | 57.5 | Low | 166 Ų | 166 | 99.6 Ų | 99.6 | 63% | 0.626 | 55% | 0.547 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -71.3 | -3.3 | 175.7 | -66.9 | -157 | -60.6 | 165.4 | 0.9 | 114.5 | S575 F585 | S575-R577 VanDerWaalsContact C-N 3.33Å; S575-R577 PolarHBondContact O-N 3.29Å; R577-F585 HydrophobicContact CG-CD2 4.02Å; R577-F585 HydrophobicContact CG-CE2 3.98Å; R577-F585 HydrophobicContact CG-CG 4.33Å; R577-F585 HydrophobicContact CG-CZ 4.26Å |
| 578 | A | 56.5 | Low | 59.5 | Low | 73 Ų | 73 | 100.6 Ų | 100.6 | 60% | 0.603 | 54% | 0.541 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -91.1 | -10.2 | 173 | 0 | 0 | 0 | 0 | 0 | 113.6 | S575 L576 | S575-A578 WeakPolarHBondContact O-CB 3.39Å; S575-A578 PolarHBondContact O-N 3.05Å; S575-A578 VanDerWaalsContact O-N 3.08Å; L576-A578 PolarHBondContact O-N 3.39Å |
| 579 | Y | 56.7 | Low | 61.4 | Low | 198 Ų | 198 | 98.2 Ų | 98.2 | 78% | 0.776 | 52% | 0.524 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -132.9 | -11.8 | -170.5 | -69.2 | -74.6 | 0 | 0 | 0 | 115.8 | L576 | L576-Y579 PolarHBondContact O-N 3Š|
| 580 | L | 67.7 | Low | 62.7 | Low | 61 Ų | 61 | 98.4 Ų | 98.4 | 32% | 0.319 | 52% | 0.517 | S | S | . | . | S | Bend | trans | -111 | 150.1 | 173 | -61.5 | 177.7 | 0 | 0 | 0 | 109.9 | L576 E584 | L576-L580 HydrophobicContact CD2-CD1 4.1Å; L576-L580 PolarHBondContact O-N 3.13Å; L580-E584 HydrophobicContact CB-CB 4.31Å |
| 581 | S | 73.1 | Confident | 63.8 | Low | 54 Ų | 54 | 94.3 Ų | 94.3 | 38% | 0.378 | 51% | 0.505 | S | S | . | . | trans | -64.7 | 157.6 | 166.5 | 64.6 | 0 | 0 | 0 | 0 | 110.9 | D583 E584 F585 | S581-D583 VanDerWaalsContact C-N 3.26Å; S581-D583 PolarHBondContact O-N 2.8Å; S581-E584 VanDerWaalsContact CB-OE2 3.29Å; S581-E584 WeakPolarHBondContact CB-OE2 3.47Å; S581-E584 PolarHBondContact N-OE2 3.44Å; S581-E584 PolarHBondContact O-N 3.03Å; S581-E584 WeakPolarHBondContact OG-CB 3.35Å; S581-E584 VanDerWaalsContact OG-CD 3.25Å; S581-E584 WeakPolarHBondContact OG-CG 3.37Å; S581-E584 PolarHBondContact OG-N 3.35Å; S581-E584 PolarHBondContact OG-OE2 2.65Å; S581-F585 PolarHBondContact O-N 3.02Å | ||
| 582 | E | 70.6 | Confident | 64.9 | Low | 122 Ų | 122 | 96.3 Ų | 96.3 | 57% | 0.57 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -63 | -35.6 | -179 | -177.6 | 153.8 | -157.6 | 0 | 0 | 111.5 | F585 Y586 | E582-F585 PolarHBondContact O-N 2.92Å; E582-Y586 HydrophobicContact CG-CD2 3.85Å; E582-Y586 HydrophobicContact CG-CE2 3.42Å; E582-Y586 VanDerWaalsContact CG-CE2 3.42Å; E582-Y586 WeakPolarHBondContact O-CD2 3.36Å; E582-Y586 PolarHBondContact O-N 3.21Å; E582-Y586 PolarHBondContact OE1-OH 2.98Å |
| 583 | D | 73.6 | Confident | 65.5 | Low | 131 Ų | 131 | 102.4 Ų | 102.4 | 70% | 0.701 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -66.1 | -45.5 | 174.1 | -59.5 | -52.3 | 0 | 0 | 0 | 112.5 | S581 F585 Y586 Q587 | S581-D583 VanDerWaalsContact C-N 3.26Å; S581-D583 PolarHBondContact O-N 2.8Å; D583-F585 VanDerWaalsContact C-N 3.31Å; D583-F585 PolarHBondContact O-N 2.94Å; D583-Y586 PolarHBondContact O-N 3.44Å; D583-Q587 WeakPolarHBondContact O-CB 3.37Å; D583-Q587 PolarHBondContact O-N 3.23Å |
| 584 | E | 76.4 | Confident | 65.8 | Low | 106 Ų | 106 | 106.3 Ų | 106.3 | 50% | 0.495 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -61.4 | -39.3 | 174.2 | -74.6 | 166.1 | 126.5 | 0 | 0 | 111.7 | L580 S581 Q587 Q588 | L580-E584 HydrophobicContact CB-CB 4.31Å; S581-E584 VanDerWaalsContact CB-OE2 3.29Å; S581-E584 WeakPolarHBondContact CB-OE2 3.47Å; S581-E584 PolarHBondContact N-OE2 3.44Å; S581-E584 PolarHBondContact O-N 3.03Å; S581-E584 WeakPolarHBondContact OG-CB 3.35Å; S581-E584 VanDerWaalsContact OG-CD 3.25Å; S581-E584 WeakPolarHBondContact OG-CG 3.37Å; S581-E584 PolarHBondContact OG-N 3.35Å; S581-E584 PolarHBondContact OG-OE2 2.65Å; E584-Q587 PolarHBondContact O-N 2.72Å; E584-Q588 WeakPolarHBondContact O-CB 3.34Å; E584-Q588 PolarHBondContact O-N 3.1Å |
| 585 | F | 83.4 | Confident | 65.7 | Low | 45 Ų | 45 | 108.1 Ų | 108.1 | 20% | 0.197 | 54% | 0.537 | C | S | . | . | H | α-helix | trans | -62.4 | -45.3 | 175.4 | 176.7 | -97 | 0 | 0 | 0 | 111.5 | R577 S581 E582 D583 Q588 L589 | R577-F585 HydrophobicContact CG-CD2 4.02Å; R577-F585 HydrophobicContact CG-CE2 3.98Å; R577-F585 HydrophobicContact CG-CG 4.33Å; R577-F585 HydrophobicContact CG-CZ 4.26Å; S581-F585 PolarHBondContact O-N 3.02Å; E582-F585 PolarHBondContact O-N 2.92Å; D583-F585 VanDerWaalsContact C-N 3.31Å; D583-F585 PolarHBondContact O-N 2.94Å; F585-Q588 PolarHBondContact O-N 3.43Å; F585-L589 HydrophobicContact CZ-CD1 4.25Å; F585-L589 WeakPolarHBondContact O-CB 3.42Å; F585-L589 PolarHBondContact O-N 2.99Å |
| 586 | Y | 75.4 | Confident | 65.3 | Low | 120 Ų | 120 | 116.7 Ų | 116.7 | 47% | 0.471 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -67.1 | -36.2 | 174.8 | -74.7 | -59.4 | 0 | 0 | 0 | 112.8 | E582 D583 L589 Q590 | E582-Y586 HydrophobicContact CG-CD2 3.85Å; E582-Y586 HydrophobicContact CG-CE2 3.42Å; E582-Y586 VanDerWaalsContact CG-CE2 3.42Å; E582-Y586 WeakPolarHBondContact O-CD2 3.36Å; E582-Y586 PolarHBondContact O-N 3.21Å; E582-Y586 PolarHBondContact OE1-OH 2.98Å; D583-Y586 PolarHBondContact O-N 3.44Å; Y586-L589 PolarHBondContact O-N 3.45Å; Y586-Q590 WeakPolarHBondContact O-CG 3.47Å; Y586-Q590 PolarHBondContact O-N 2.88Å |
| 587 | Q | 77.8 | Confident | 65 | Low | 127 Ų | 127 | 121 Ų | 121 | 59% | 0.593 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -63.6 | -44.8 | 175.5 | -160.7 | 82.1 | 96.4 | 0 | 0 | 111.3 | D583 E584 L589 Q590 A591 | D583-Q587 WeakPolarHBondContact O-CB 3.37Å; D583-Q587 PolarHBondContact O-N 3.23Å; E584-Q587 PolarHBondContact O-N 2.72Å; Q587-L589 VanDerWaalsContact C-N 3.33Å; Q587-L589 PolarHBondContact O-N 2.9Å; Q587-Q590 PolarHBondContact O-N 3.19Å; Q587-A591 PolarHBondContact O-N 2.93Å |
| 588 | Q | 73.1 | Confident | 64.4 | Low | 119 Ų | 119 | 119.5 Ų | 119.5 | 56% | 0.556 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -60.3 | -42.3 | 173.4 | -162.2 | 83 | -9 | 0 | 0 | 111.1 | E584 F585 Q590 A591 I592 | E584-Q588 WeakPolarHBondContact O-CB 3.34Å; E584-Q588 PolarHBondContact O-N 3.1Å; F585-Q588 PolarHBondContact O-N 3.43Å; Q588-Q590 VanDerWaalsContact C-N 3.35Å; Q588-Q590 PolarHBondContact O-N 3.15Å; Q588-A591 PolarHBondContact O-N 2.82Å; Q588-I592 HydrophobicContact CG-CD1 4.24Å; Q588-I592 WeakPolarHBondContact O-CD1 3.48Å; Q588-I592 VanDerWaalsContact O-CG1 3.31Å; Q588-I592 WeakPolarHBondContact O-CG1 3.4Å; Q588-I592 PolarHBondContact O-N 3.16Å |
| 589 | L | 74.7 | Confident | 63.6 | Low | 58 Ų | 58 | 120.9 Ų | 120.9 | 30% | 0.304 | 58% | 0.583 | S | S | . | * | H | α-helix | trans | -67.6 | -33 | 178.2 | -142.3 | 76.7 | 0 | 0 | 0 | 112.6 | F585 Y586 Q587 R593 | F585-L589 HydrophobicContact CZ-CD1 4.25Å; F585-L589 WeakPolarHBondContact O-CB 3.42Å; F585-L589 PolarHBondContact O-N 2.99Å; Y586-L589 PolarHBondContact O-N 3.45Å; Q587-L589 VanDerWaalsContact C-N 3.33Å; Q587-L589 PolarHBondContact O-N 2.9Å; L589-R593 WeakPolarHBondContact O-CB 3.35Å; L589-R593 WeakPolarHBondContact O-CG 3.18Å; L589-R593 PolarHBondContact O-N 3.39Å |
| 590 | Q | 71.2 | Confident | 62.6 | Low | 112 Ų | 112 | 115.7 Ų | 115.7 | 52% | 0.523 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -71.7 | -36.9 | 172.5 | -77.6 | -178.7 | -16.1 | 0 | 0 | 112.3 | Y586 Q587 Q588 R593 Q594 | Y586-Q590 WeakPolarHBondContact O-CG 3.47Å; Y586-Q590 PolarHBondContact O-N 2.88Å; Q587-Q590 PolarHBondContact O-N 3.19Å; Q588-Q590 VanDerWaalsContact C-N 3.35Å; Q588-Q590 PolarHBondContact O-N 3.15Å; Q590-R593 CarbonylContact O-C 3.6Å; Q590-R593 PolarHBondContact O-N 2.95Å; Q590-Q594 PolarHBondContact O-N 3.41Å; Q590-Q594 PolarHBondContact O-NE2 3.33Å |
| 591 | A | 64.9 | Low | 61.6 | Low | 66 Ų | 66 | 120.4 Ų | 120.4 | 55% | 0.545 | 60% | 0.601 | S | S | . | * | H | α-helix | trans | -63.9 | -41 | 174 | 0 | 0 | 0 | 0 | 0 | 111.8 | Q587 Q588 R593 Q594 | Q587-A591 PolarHBondContact O-N 2.93Å; Q588-A591 PolarHBondContact O-N 2.82Å; A591-R593 PolarHBondContact O-N 3.49Å; A591-Q594 WeakPolarHBondContact O-CG 3.44Å; A591-Q594 PolarHBondContact O-N 2.85Å |
| 592 | I | 63.6 | Low | 60.3 | Low | 126 Ų | 126 | 123.8 Ų | 123.8 | 65% | 0.646 | 62% | 0.619 | S | S | * | * | H | α-helix | trans | -70.9 | -20.1 | 175.8 | -64.6 | 163 | 0 | 0 | 0 | 112.2 | Q588 | Q588-I592 HydrophobicContact CG-CD1 4.24Å; Q588-I592 WeakPolarHBondContact O-CD1 3.48Å; Q588-I592 VanDerWaalsContact O-CG1 3.31Å; Q588-I592 WeakPolarHBondContact O-CG1 3.4Å; Q588-I592 PolarHBondContact O-N 3.16Å |
| 593 | R | 60.1 | Low | 58.9 | Low | 193 Ų | 193 | 124.7 Ų | 124.7 | 73% | 0.728 | 63% | 0.628 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -96.3 | 8.3 | 178.7 | -76.8 | 177.7 | 173 | -159.3 | -1.5 | 114.7 | L589 Q590 A591 | L589-R593 WeakPolarHBondContact O-CB 3.35Å; L589-R593 WeakPolarHBondContact O-CG 3.18Å; L589-R593 PolarHBondContact O-N 3.39Å; Q590-R593 CarbonylContact O-C 3.6Å; Q590-R593 PolarHBondContact O-N 2.95Å; A591-R593 PolarHBondContact O-N 3.49Å |
| 594 | Q | 54.3 | Low | 57.7 | Low | 127 Ų | 127 | 123.3 Ų | 123.3 | 59% | 0.593 | 63% | 0.629 | S | S | * | * | S | Bend | trans | -63.2 | 135 | 169.5 | -63.2 | -52.3 | -64.2 | 0 | 0 | 109.6 | Q590 A591 W596 | Q590-Q594 PolarHBondContact O-N 3.41Å; Q590-Q594 PolarHBondContact O-NE2 3.33Å; A591-Q594 WeakPolarHBondContact O-CG 3.44Å; A591-Q594 PolarHBondContact O-N 2.85Å; Q594-W596 PolarHBondContact O-N 3.28Å |
| 595 | P | 50.3 | Low | 55.9 | Low | 113 Ų | 113 | 125.4 Ų | 125.4 | 73% | 0.734 | 64% | 0.644 | S | S | * | * | trans | -56.8 | 135.4 | 171.3 | -23.4 | 34 | 0 | 0 | 0 | 110.1 | H597 | P595-H597 PolarHBondContact O-N 2.83Š| ||
| 596 | W | 43.3 | Very low | 53.8 | Low | 245 Ų | 245 | 130.8 Ų | 130.8 | 93% | 0.928 | 67% | 0.673 | S | S | * | * | trans | -62.6 | 108.2 | 171.9 | -67.7 | 93.1 | 0 | 0 | 0 | 108.5 | Q594 I598 | Q594-W596 PolarHBondContact O-N 3.28Å; W596-I598 PolarHBondContact O-N 2.91Å | ||
| 597 | H | 43.6 | Very low | 52 | Low | 179 Ų | 179 | 132.3 Ų | 132.3 | 83% | 0.829 | 69% | 0.686 | S | S | * | * | trans | -71.3 | 102.8 | 175.1 | -147.7 | -59.6 | 0 | 0 | 0 | 107.9 | P595 | P595-H597 PolarHBondContact O-N 2.83Š| ||
| 598 | I | 42 | Very low | 50 | Low | 135 Ų | 135 | 133.8 Ų | 133.8 | 69% | 0.692 | 69% | 0.693 | S | S | * | * | trans | -59.3 | 132.3 | 172.1 | -54.8 | 176.9 | 0 | 0 | 0 | 106.9 | W596 S600 | W596-I598 PolarHBondContact O-N 2.91Å; I598-S600 PolarHBondContact O-N 3.41Å | ||
| 599 | P | 40.4 | Very low | 48.5 | Very low | 102 Ų | 102 | 133 Ų | 133 | 66% | 0.662 | 70% | 0.698 | S | S | * | * | trans | -63.5 | 123.7 | 167.4 | -19 | 32.3 | 0 | 0 | 0 | 108.9 | D601 | P599-D601 PolarHBondContact O-N 3.38Š| ||
| 600 | S | 35.8 | Very low | 46.9 | Very low | 88 Ų | 88 | 136 Ų | 136 | 62% | 0.615 | 72% | 0.721 | S | S | * | * | trans | -75.1 | 77.9 | 174.4 | -56.9 | 0 | 0 | 0 | 0 | 110 | I598 T602 | I598-S600 PolarHBondContact O-N 3.41Å; S600-T602 PolarHBondContact O-N 2.86Å | ||
| 601 | D | 46.3 | Very low | 45.2 | Very low | 160 Ų | 160 | 139.1 Ų | 139.1 | 86% | 0.856 | 74% | 0.735 | S | S | * | * | trans | -72.2 | 59.6 | 169.3 | -85.5 | -18.7 | 0 | 0 | 0 | 110.4 | P599 | P599-D601 PolarHBondContact O-N 3.38Š| ||
| 602 | T | 46.5 | Very low | 43.7 | Very low | 125 Ų | 125 | 144.9 Ų | 144.9 | 77% | 0.767 | 75% | 0.751 | S | S | * | * | trans | -140.7 | 41.9 | 173.3 | 61 | 0 | 0 | 0 | 0 | 110.3 | S600 | S600-T602 PolarHBondContact O-N 2.86Š| ||
| 603 | D | 40.5 | Very low | 42.2 | Very low | 142 Ų | 142 | 146.3 Ų | 146.3 | 76% | 0.759 | 76% | 0.76 | S | S | * | * | S | Bend | trans | -134.1 | 106.9 | 171.1 | -106.7 | -45.1 | 0 | 0 | 0 | 111 | ||
| 604 | S | 47.3 | Very low | 41 | Very low | 102 Ų | 102 | 145.7 Ų | 145.7 | 71% | 0.713 | 76% | 0.763 | S | S | * | * | trans | 55.1 | 87.4 | 151.6 | -54.7 | 0 | 0 | 0 | 0 | 119.2 | ||||
| 605 | D | 40.2 | Very low | 39.9 | Very low | 150 Ų | 150 | 145.7 Ų | 145.7 | 80% | 0.802 | 78% | 0.777 | S | S | * | * | trans | -134 | 51 | 142.7 | -143.5 | -10.9 | 0 | 0 | 0 | 111.2 | M607 | D605-M607 PolarHBondContact O-N 3.02Å; D605-M607 WeakPolarHBondContact OD1-CG 3.03Å | ||
| 606 | I | 38.1 | Very low | 38.9 | Very low | 158 Ų | 158 | 145.9 Ų | 145.9 | 81% | 0.81 | 78% | 0.781 | S | S | * | * | trans | -76 | 80.1 | 165.8 | -175.6 | 167.1 | 0 | 0 | 0 | 108.3 | E608 | I606-E608 VanDerWaalsContact C-N 3.27Å; I606-E608 PolarHBondContact O-N 3.22Å | ||
| 607 | M | 37.9 | Very low | 38.5 | Very low | 151 Ų | 151 | 139.4 Ų | 139.4 | 74% | 0.744 | 77% | 0.773 | S | S | * | * | trans | -66.5 | 87.5 | 173.8 | -87.8 | -132.5 | 67.7 | 0 | 0 | 110.8 | D605 | D605-M607 PolarHBondContact O-N 3.02Å; D605-M607 WeakPolarHBondContact OD1-CG 3.03Å | ||
| 608 | E | 35.7 | Very low | 38 | Very low | 158 Ų | 158 | 141.9 Ų | 141.9 | 74% | 0.738 | 78% | 0.775 | S | S | * | * | P | Polyproline II helix | trans | -52.6 | 123.4 | 165.6 | -166.4 | 173.6 | 141.3 | 0 | 0 | 109.3 | I606 | I606-E608 VanDerWaalsContact C-N 3.27Å; I606-E608 PolarHBondContact O-N 3.22Å |
| 609 | P | 41.9 | Very low | 37.6 | Very low | 103 Ų | 103 | 142.4 Ų | 142.4 | 67% | 0.669 | 78% | 0.779 | S | S | * | * | P | Polyproline II helix | trans | -68.2 | 135.8 | -176.5 | 27.5 | -33.8 | 0 | 0 | 0 | 109.9 | E611 | P609-E611 PolarHBondContact O-N 2.84Å; P609-E611 VanDerWaalsContact O-N 3.15Å |
| 610 | P | 40.5 | Very low | 37.3 | Very low | 120 Ų | 120 | 141.2 Ų | 141.2 | 78% | 0.779 | 78% | 0.778 | S | S | * | * | P | Polyproline II helix | trans | -66.1 | 117.6 | -171.8 | 25.6 | -34.4 | 0 | 0 | 0 | 111.5 | Q612 | P610-Q612 PolarHBondContact O-N 2.69Š|
| 611 | E | 35 | Very low | 37.1 | Very low | 178 Ų | 178 | 143.5 Ų | 143.5 | 83% | 0.832 | 78% | 0.783 | S | S | * | * | P | Polyproline II helix | trans | -61.9 | 131.9 | 174.9 | -64.5 | -146.6 | 124.2 | 0 | 0 | 111.1 | P609 D613 | P609-E611 PolarHBondContact O-N 2.84Å; P609-E611 VanDerWaalsContact O-N 3.15Å; E611-D613 VanDerWaalsContact C-N 3.27Å; E611-D613 PolarHBondContact O-N 3.35Å |
| 612 | Q | 35.3 | Very low | 36.7 | Very low | 188 Ų | 188 | 144.1 Ų | 144.1 | 88% | 0.879 | 78% | 0.778 | S | S | * | * | trans | -75 | 80.9 | 171.2 | -74.7 | -168.4 | -28.5 | 0 | 0 | 110.1 | P610 K614 | P610-Q612 PolarHBondContact O-N 2.69Å; Q612-K614 PolarHBondContact O-N 2.65Å | ||
| 613 | D | 30.4 | Very low | 36.4 | Very low | 156 Ų | 156 | 149.1 Ų | 149.1 | 83% | 0.834 | 78% | 0.783 | S | S | * | * | trans | -64.4 | 128.5 | -179.6 | -163 | 4.1 | 0 | 0 | 0 | 111.2 | E611 S615 | E611-D613 VanDerWaalsContact C-N 3.27Å; E611-D613 PolarHBondContact O-N 3.35Å; D613-S615 PolarHBondContact O-N 3.49Å | ||
| 614 | K | 34.9 | Very low | 36.2 | Very low | 180 Ų | 180 | 147.2 Ų | 147.2 | 78% | 0.783 | 78% | 0.781 | S | S | * | * | trans | -86.8 | 97.6 | -168.6 | -73.8 | 166.6 | -176.8 | 158.2 | 0 | 108.9 | Q612 S616 | Q612-K614 PolarHBondContact O-N 2.65Å; K614-S616 PolarHBondContact O-N 2.77Å | ||
| 615 | S | 31.7 | Very low | 35.9 | Very low | 126 Ų | 126 | 148.4 Ų | 148.4 | 88% | 0.881 | 78% | 0.784 | S | S | * | * | trans | -53.5 | 95.1 | -179.7 | 62.5 | 0 | 0 | 0 | 0 | 112.9 | D613 | D613-S615 PolarHBondContact O-N 3.49Š| ||
| 616 | S | 28.8 | Very low | 35.7 | Very low | 117 Ų | 117 | 150.4 Ų | 150.4 | 82% | 0.818 | 79% | 0.785 | S | S | * | * | trans | -124 | 90.7 | 174.2 | 72.7 | 0 | 0 | 0 | 0 | 111.4 | K614 | K614-S616 PolarHBondContact O-N 2.77Š| ||
| 617 | S | 35.2 | Very low | 35.7 | Very low | 109 Ų | 109 | 147.8 Ų | 147.8 | 76% | 0.762 | 78% | 0.781 | S | S | * | * | trans | -135 | 107 | 169.2 | 61.7 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 618 | R | 34.4 | Very low | 35.8 | Very low | 232 Ų | 232 | 144 Ų | 144 | 88% | 0.875 | 78% | 0.78 | S | S | * | * | trans | 24.1 | 133.1 | 134.2 | -60.3 | -174.3 | -172.5 | 161.2 | 2.2 | 117.4 | ||||
| 619 | D | 32.5 | Very low | 35.9 | Very low | 145 Ų | 145 | 148.2 Ų | 148.2 | 78% | 0.775 | 81% | 0.807 | S | S | * | * | cis | -168.1 | -175.2 | 8.2 | -134.5 | -63.4 | 0 | 0 | 0 | 112.4 | ||||
| 620 | A | 33.4 | Very low | 35.6 | Very low | 77 Ų | 77 | 150.5 Ų | 150.5 | 64% | 0.636 | 81% | 0.814 | S | S | * | * | trans | 67.6 | 79.6 | 151.9 | 0 | 0 | 0 | 0 | 0 | 120.8 | ||||
| 621 | N | 32.1 | Very low | 35.3 | Very low | 136 Ų | 136 | 152.1 Ų | 152.1 | 73% | 0.727 | 82% | 0.816 | S | S | * | * | 47 | 109.3 | 105.6 | -175.7 | 19.6 | 0 | 0 | 0 | 119.8 | |||||
| 622 | K | 37.4 | Very low | 35.3 | Very low | 173 Ų | 173 | 150.7 Ų | 150.7 | 75% | 0.752 | 82% | 0.815 | S | S | * | * | 178.7 | 146.3 | 116 | -98.5 | 158.1 | -165.8 | 171 | 0 | 116.1 | |||||
| 623 | R | 41.3 | Very low | 35.3 | Very low | 230 Ų | 230 | 148.5 Ų | 148.5 | 87% | 0.868 | 81% | 0.811 | S | S | * | * | trans | 72.7 | 125.9 | 165.7 | -67.7 | 168.4 | 178.9 | 171.1 | -1.4 | 114.7 | ||||
| 624 | S | 35.6 | Very low | 35.6 | Very low | 103 Ų | 103 | 148 Ų | 148 | 72% | 0.72 | 81% | 0.81 | S | S | * | * | 71.8 | 126.7 | 69.1 | -157.8 | 0 | 0 | 0 | 0 | 110.9 | |||||
| 625 | V | 40.6 | Very low | 35.7 | Very low | 127 Ų | 127 | 145.9 Ų | 145.9 | 77% | 0.77 | 81% | 0.812 | S | S | * | * | cis | -147.4 | 140.5 | 39.4 | -141.6 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 626 | F | 37 | Very low | 36 | Very low | 191 Ų | 191 | 147.3 Ų | 147.3 | 84% | 0.838 | 81% | 0.807 | S | S | * | * | trans | 24 | 149.1 | 136 | -147 | -100.7 | 0 | 0 | 0 | 123.2 | ||||
| 627 | S | 37.7 | Very low | 36.5 | Very low | 103 Ų | 103 | 149.6 Ų | 149.6 | 72% | 0.72 | 81% | 0.806 | S | S | * | * | trans | 68.1 | 143.3 | 177.6 | -63.3 | 0 | 0 | 0 | 0 | 117.1 | ||||
| 628 | G | 40.2 | Very low | 36.6 | Very low | 71 Ų | 71 | 153 Ų | 153 | 73% | 0.732 | 81% | 0.809 | S | S | * | * | cis | 122 | 90.6 | -9.4 | 0 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 629 | L | 37.4 | Very low | 36.8 | Very low | 248 Ų | 248 | 145.8 Ų | 145.8 | 100% | 1.298 | 80% | 0.803 | S | S | * | * | trans | -160.7 | 0 | 151.5 | -109.5 | 167.7 | 0 | 0 | 0 | 108.5 |
Retrieved 629 of 629 residues in 176 ms
(Link to these results)