| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 39.9 | Very low | 43.2 | Very low | 239 Ų | 239 | 126.2 Ų | 126.2 | 100% | 1.177 | 82% | 0.82 | S | S | * | * | 0 | 92.9 | 0 | -70.6 | 148.8 | 161.3 | 0 | 0 | 107.1 | |||||
| 2 | N | 38.7 | Very low | 44 | Very low | 172 Ų | 172 | 122.8 Ų | 122.8 | 92% | 0.92 | 80% | 0.802 | S | S | * | * | trans | -106.8 | 113 | 175.9 | -78.8 | 23.5 | 0 | 0 | 0 | 107.8 | ||||
| 3 | G | 38.8 | Very low | 44.1 | Very low | 66 Ų | 66 | 123.2 Ų | 123.2 | 68% | 0.68 | 79% | 0.793 | S | S | * | * | trans | -99.1 | 148 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 4 | N | 43.9 | Very low | 44.8 | Very low | 161 Ų | 161 | 121.3 Ų | 121.3 | 86% | 0.861 | 78% | 0.779 | S | S | * | * | trans | 56.3 | 131.1 | 138.5 | -93.6 | 55.8 | 0 | 0 | 0 | 118.9 | ||||
| 5 | S | 41.4 | Very low | 45.2 | Very low | 101 Ų | 101 | 122.4 Ų | 122.4 | 71% | 0.706 | 78% | 0.776 | S | S | * | * | cis | -159.6 | 136.2 | 29.5 | -58.9 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 6 | A | 47.1 | Very low | 45.3 | Very low | 103 Ų | 103 | 124.7 Ų | 124.7 | 85% | 0.851 | 77% | 0.774 | S | S | * | * | trans | -71.8 | 125.2 | 168.4 | 0 | 0 | 0 | 0 | 0 | 109.5 | G8 | A6-G8 PolarHBondContact O-N 2.94Š| ||
| 7 | G | 38.3 | Very low | 45.8 | Very low | 74 Ų | 74 | 124.1 Ų | 124.1 | 76% | 0.763 | 77% | 0.769 | S | S | * | * | trans | -62.8 | 112.1 | 173.5 | 0 | 0 | 0 | 0 | 0 | 111 | S9 | G7-S9 PolarHBondContact O-N 3.23Å; G7-S9 VanDerWaalsContact O-N 3.13Å | ||
| 8 | G | 41.7 | Very low | 46.5 | Very low | 71 Ų | 71 | 129.4 Ų | 129.4 | 73% | 0.732 | 77% | 0.773 | S | S | * | * | trans | -70.9 | 95.9 | 162.6 | 0 | 0 | 0 | 0 | 0 | 109.2 | A6 N10 | A6-G8 PolarHBondContact O-N 2.94Å; G8-N10 PolarHBondContact O-N 3.45Å; G8-N10 VanDerWaalsContact O-N 3.12Å | ||
| 9 | S | 47.5 | Very low | 47.5 | Very low | 115 Ų | 115 | 135.1 Ų | 135.1 | 80% | 0.804 | 78% | 0.779 | S | S | * | * | trans | -65.9 | 108.9 | 168.6 | -71.5 | 0 | 0 | 0 | 0 | 109.3 | G7 N11 | G7-S9 PolarHBondContact O-N 3.23Å; G7-S9 VanDerWaalsContact O-N 3.13Å; S9-N11 PolarHBondContact O-N 3.27Å | ||
| 10 | N | 46.9 | Very low | 48.9 | Very low | 145 Ų | 145 | 139.1 Ų | 139.1 | 78% | 0.775 | 78% | 0.782 | S | S | * | * | trans | -49.7 | 98.7 | 168.8 | -77.6 | -44.8 | 0 | 0 | 0 | 111 | G8 S12 | G8-N10 PolarHBondContact O-N 3.45Å; G8-N10 VanDerWaalsContact O-N 3.12Å; N10-S12 VanDerWaalsContact C-N 3.25Å; N10-S12 PolarHBondContact O-N 3.34Å | ||
| 11 | N | 51.7 | Low | 50.5 | Low | 141 Ų | 141 | 143.6 Ų | 143.6 | 75% | 0.754 | 79% | 0.787 | S | S | * | * | trans | -93.2 | 53.8 | 175 | -130.7 | -1.3 | 0 | 0 | 0 | 110 | S9 | S9-N11 PolarHBondContact O-N 3.27Š| ||
| 12 | S | 51.7 | Low | 52.6 | Low | 86 Ų | 86 | 137.3 Ų | 137.3 | 60% | 0.601 | 76% | 0.762 | S | S | * | * | trans | -119.7 | 10.2 | -179.6 | 53.7 | 0 | 0 | 0 | 0 | 113.5 | N10 | N10-S12 VanDerWaalsContact C-N 3.25Å; N10-S12 PolarHBondContact O-N 3.34Å | ||
| 13 | N | 45.8 | Very low | 55.2 | Low | 128 Ų | 128 | 133.3 Ų | 133.3 | 68% | 0.684 | 75% | 0.753 | S | S | * | * | S | Bend | trans | -115.3 | -1.2 | -175.7 | -116.7 | -21.7 | 0 | 0 | 0 | 114.9 | ||
| 14 | T | 53.9 | Low | 57.9 | Low | 96 Ų | 96 | 133 Ų | 133 | 59% | 0.589 | 73% | 0.733 | S | S | * | * | S | Bend | trans | -92.6 | -21.5 | -178.1 | 50.1 | 0 | 0 | 0 | 0 | 113.6 | ||
| 15 | D | 51.6 | Low | 60.5 | Low | 138 Ų | 138 | 128.9 Ų | 128.9 | 74% | 0.738 | 71% | 0.714 | S | S | * | * | S | Bend | trans | -86.4 | -19 | 177.5 | -87.2 | -54.5 | 0 | 0 | 0 | 114.3 | V17 | D15-V17 PolarHBondContact O-N 2.98Š|
| 16 | Q | 46.7 | Very low | 63.1 | Low | 159 Ų | 159 | 134.2 Ų | 134.2 | 74% | 0.743 | 72% | 0.718 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77.6 | -4.1 | 175.1 | -68.3 | -67 | -7.2 | 0 | 0 | 113.2 | R18 | Q16-R18 PolarHBondContact O-N 3.43Š|
| 17 | V | 53.2 | Low | 65.5 | Low | 115 Ų | 115 | 136.9 Ų | 136.9 | 70% | 0.697 | 71% | 0.713 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -85.7 | 14.2 | 176.9 | -164.3 | 0 | 0 | 0 | 0 | 111.8 | D15 R19 | D15-V17 PolarHBondContact O-N 2.98Å; V17-R19 PolarHBondContact O-N 3.34Å |
| 18 | R | 57.7 | Low | 68.3 | Low | 220 Ų | 220 | 134.9 Ų | 134.9 | 83% | 0.83 | 68% | 0.684 | S | S | * | * | S | Bend | trans | -68.6 | 102 | 160.1 | -90.1 | 179.4 | 165.8 | 178.6 | -0.6 | 107.7 | Q16 Y20 | Q16-R18 PolarHBondContact O-N 3.43Å; R18-Y20 PolarHBondContact O-N 3.19Å; R18-Y20 VanDerWaalsContact O-N 3.07Å |
| 19 | R | 65.3 | Low | 71 | Confident | 237 Ų | 237 | 133.7 Ų | 133.7 | 89% | 0.894 | 66% | 0.66 | S | S | * | * | trans | -37.3 | 120 | 174.8 | -65.2 | -177.2 | -158.5 | 155.1 | 5.9 | 109.8 | V17 R21 | V17-R19 PolarHBondContact O-N 3.34Å; R19-R21 PolarHBondContact O-N 2.98Å | ||
| 20 | Y | 76.2 | Confident | 73.4 | Confident | 214 Ų | 214 | 129.9 Ų | 129.9 | 84% | 0.839 | 64% | 0.64 | S | S | * | * | trans | -50.5 | 125.2 | 178.1 | -172.2 | -97.3 | 0 | 0 | 0 | 109.3 | R18 T22 | R18-Y20 PolarHBondContact O-N 3.19Å; R18-Y20 VanDerWaalsContact O-N 3.07Å; Y20-T22 PolarHBondContact O-N 3.37Å | ||
| 21 | R | 81.9 | Confident | 75.9 | Confident | 234 Ų | 234 | 127.4 Ų | 127.4 | 88% | 0.883 | 62% | 0.62 | S | S | * | * | trans | -83.2 | 110.3 | 179.1 | -70.4 | -172.6 | 178.3 | -145.7 | 1.4 | 108.3 | R19 A23 | R19-R21 PolarHBondContact O-N 2.98Å; R21-A23 PolarHBondContact O-N 2.95Å | ||
| 22 | T | 85.3 | Confident | 78.1 | Confident | 107 Ų | 107 | 120.7 Ų | 120.7 | 66% | 0.656 | 58% | 0.584 | S | S | * | * | P | Polyproline II helix | trans | -71.1 | 127.1 | 169.5 | -46.3 | 0 | 0 | 0 | 0 | 109.5 | Y20 | Y20-T22 PolarHBondContact O-N 3.37Š|
| 23 | A | 92.4 | Very high | 80.3 | Confident | 88 Ų | 88 | 119.5 Ų | 119.5 | 73% | 0.727 | 57% | 0.569 | S | S | * | * | P | Polyproline II helix | trans | -85.1 | 141.2 | 170.9 | 0 | 0 | 0 | 0 | 0 | 110.1 | R21 | R21-A23 PolarHBondContact O-N 2.95Š|
| 24 | F | 96.1 | Very high | 82.8 | Confident | 59 Ų | 59 | 120.2 Ų | 120.2 | 26% | 0.259 | 57% | 0.565 | S | S | . | * | P | Polyproline II helix | trans | -83.3 | 145.5 | 172.9 | -58 | -52 | 0 | 0 | 0 | 110.6 | Q28 I29 L56 T60 W64 | F24-Q28 HydrophobicContact CB-CB 4.28Å; F24-I29 HydrophobicContact CB-CD1 4.19Å; F24-I29 HydrophobicContact CB-CG1 3.78Å; F24-L56 HydrophobicContact CD1-CD1 3.84Å; F24-L56 HydrophobicContact CD1-CD2 4.03Å; F24-L56 HydrophobicContact CE1-CD1 3.87Å; F24-L56 HydrophobicContact CE1-CD2 3.9Å; F24-T60 HydrophobicContact CE1-CG2 3.4Å; F24-T60 VanDerWaalsContact CE1-CG2 3.4Å; F24-T60 HydrophobicContact CZ-CG2 3.3Å; F24-W64 AromaticContact CD2-CD1 3.7Å; F24-W64 AromaticContact CE2-CD1 3.51Å; F24-W64 HydrophobicContact CE2-CG 4.43Å |
| 25 | T | 97.4 | Very high | 84.9 | Confident | 75 Ų | 75 | 116.1 Ų | 116.1 | 46% | 0.46 | 54% | 0.54 | S | S | . | . | P | Polyproline II helix | trans | -69.4 | 160.9 | 172.6 | 72.5 | 0 | 0 | 0 | 0 | 110.7 | E27 Q28 I29 | T25-E27 VanDerWaalsContact C-N 3.26Å; T25-E27 PolarHBondContact O-N 3.04Å; T25-Q28 PolarHBondContact O-N 2.95Å; T25-Q28 VanDerWaalsContact OG1-CG 3.28Å; T25-Q28 WeakPolarHBondContact OG1-CG 3.28Å; T25-Q28 PolarHBondContact OG1-N 3.39Å; T25-I29 WeakPolarHBondContact O-CG1 3.35Å; T25-I29 PolarHBondContact O-N 2.82Å |
| 26 | R | 97.1 | Very high | 87.1 | Confident | 213 Ų | 213 | 109.8 Ų | 109.8 | 80% | 0.804 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -58.1 | -40.3 | 177.1 | -176.5 | 59.6 | 139.5 | 173.7 | -6 | 112.1 | I29 G30 | R26-I29 PolarHBondContact O-N 3.46Å; R26-G30 PolarHBondContact O-N 2.83Å |
| 27 | E | 97.4 | Very high | 89.5 | Confident | 160 Ų | 160 | 110.4 Ų | 110.4 | 75% | 0.748 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -64.2 | -46.5 | 177.9 | -171.4 | -169.8 | 168 | 0 | 0 | 111.7 | T25 I29 G30 R31 | T25-E27 VanDerWaalsContact C-N 3.26Å; T25-E27 PolarHBondContact O-N 3.04Å; E27-I29 VanDerWaalsContact C-N 3.32Å; E27-I29 PolarHBondContact O-N 2.97Å; E27-G30 PolarHBondContact O-N 3.4Å; E27-R31 PolarHBondContact O-N 3.04Å |
| 28 | Q | 97.8 | Very high | 91.6 | Very high | 32 Ų | 32 | 111.6 Ų | 111.6 | 15% | 0.15 | 49% | 0.494 | C | S | . | . | H | α-helix | trans | -58 | -46.1 | 176.3 | -74 | 172.8 | -27.3 | 0 | 0 | 111.2 | F24 T25 R31 L32 L54 L56 | F24-Q28 HydrophobicContact CB-CB 4.28Å; T25-Q28 PolarHBondContact O-N 2.95Å; T25-Q28 VanDerWaalsContact OG1-CG 3.28Å; T25-Q28 WeakPolarHBondContact OG1-CG 3.28Å; T25-Q28 PolarHBondContact OG1-N 3.39Å; Q28-R31 PolarHBondContact O-N 3.49Å; Q28-L32 WeakPolarHBondContact O-CB 3.35Å; Q28-L32 WeakPolarHBondContact O-CD1 3.33Å; Q28-L32 VanDerWaalsContact O-CG 3.23Å; Q28-L32 WeakPolarHBondContact O-CG 3.41Å; Q28-L32 PolarHBondContact O-N 3.43Å; Q28-L54 HydrophobicContact CG-CB 4.35Å; Q28-L54 HydrophobicContact CG-CD2 4.26Å; Q28-L54 PolarHBondContact NE2-O 3.06Å; Q28-L56 HydrophobicContact CG-CD1 4.46Å |
| 29 | I | 97.8 | Very high | 93.4 | Very high | 45 Ų | 45 | 105 Ų | 105 | 23% | 0.231 | 47% | 0.473 | C | S | . | . | H | α-helix | trans | -61.2 | -47.6 | 176.7 | -64.8 | 165.9 | 0 | 0 | 0 | 110.5 | F24 T25 R26 E27 R31 L32 E33 | F24-I29 HydrophobicContact CB-CD1 4.19Å; F24-I29 HydrophobicContact CB-CG1 3.78Å; T25-I29 WeakPolarHBondContact O-CG1 3.35Å; T25-I29 PolarHBondContact O-N 2.82Å; R26-I29 PolarHBondContact O-N 3.46Å; E27-I29 VanDerWaalsContact C-N 3.32Å; E27-I29 PolarHBondContact O-N 2.97Å; I29-R31 VanDerWaalsContact C-N 3.31Å; I29-R31 PolarHBondContact O-N 3.06Å; I29-L32 PolarHBondContact O-N 3.18Å; I29-E33 HydrophobicContact CG2-CG 4.07Å; I29-E33 WeakPolarHBondContact O-CB 3.23Å; I29-E33 WeakPolarHBondContact O-CG 3.48Å; I29-E33 PolarHBondContact O-N 3.04Å |
| 30 | G | 98.2 | Very high | 94.9 | Very high | 36 Ų | 36 | 96.6 Ų | 96.6 | 37% | 0.371 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -59.7 | -40.1 | -179.2 | 0 | 0 | 0 | 0 | 0 | 112.8 | R26 E27 K34 | R26-G30 PolarHBondContact O-N 2.83Å; E27-G30 PolarHBondContact O-N 3.4Å; G30-K34 WeakPolarHBondContact O-CB 3.42Å; G30-K34 PolarHBondContact O-N 3.07Å |
| 31 | R | 97.9 | Very high | 96 | Very high | 93 Ų | 93 | 93.8 Ų | 93.8 | 35% | 0.351 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -67.2 | -42.7 | 176.1 | -160.3 | 75.3 | -178.7 | 81.9 | -2.7 | 112 | E27 Q28 I29 K34 E35 L54 | E27-R31 PolarHBondContact O-N 3.04Å; Q28-R31 PolarHBondContact O-N 3.49Å; I29-R31 VanDerWaalsContact C-N 3.31Å; I29-R31 PolarHBondContact O-N 3.06Å; R31-K34 PolarHBondContact O-N 3.18Å; R31-E35 IonicContact CZ-OE1 3.79Å; R31-E35 IonicContact NH1-OE1 2.83Å; R31-E35 PolarHBondContact NH1-OE1 3.46Å; R31-E35 IonicContact NH2-OE1 3.97Å; R31-E35 WeakPolarHBondContact O-CG 3.37Å; R31-E35 PolarHBondContact O-N 3.07Å; R31-L54 HydrophobicContact CB-CD1 4.23Å; R31-L54 HydrophobicContact CB-CD2 3.8Å; R31-L54 HydrophobicContact CG-CD1 4.49Å; R31-L54 HydrophobicContact CG-CD2 4Å |
| 32 | L | 98.3 | Very high | 96.7 | Very high | 0 Ų | 0 | 83.6 Ų | 83.6 | 0% | 0 | 40% | 0.398 | C | S | . | . | H | α-helix | trans | -65 | -40.8 | 177.2 | -70.8 | 168.2 | 0 | 0 | 0 | 112.1 | Q28 I29 E35 F36 L54 I61 W64 F65 | Q28-L32 WeakPolarHBondContact O-CB 3.35Å; Q28-L32 WeakPolarHBondContact O-CD1 3.33Å; Q28-L32 VanDerWaalsContact O-CG 3.23Å; Q28-L32 WeakPolarHBondContact O-CG 3.41Å; Q28-L32 PolarHBondContact O-N 3.43Å; I29-L32 PolarHBondContact O-N 3.18Å; L32-E35 PolarHBondContact O-N 3.45Å; L32-F36 WeakPolarHBondContact O-CB 3.42Å; L32-F36 PolarHBondContact O-N 2.96Å; L32-L54 HydrophobicContact CD1-CD1 4.33Å; L32-L54 HydrophobicContact CD2-CD1 3.85Å; L32-L54 HydrophobicContact CG-CD1 3.72Å; L32-I61 HydrophobicContact CD2-CD1 3.74Å; L32-I61 HydrophobicContact CD2-CG2 4.28Å; L32-W64 HydrophobicContact CB-CD2 3.98Å; L32-W64 HydrophobicContact CB-CE3 3.89Å; L32-W64 HydrophobicContact CB-CH2 3.56Å; L32-W64 HydrophobicContact CB-CZ2 3.63Å; L32-W64 HydrophobicContact CB-CZ3 3.69Å; L32-W64 HydrophobicContact CD1-CD2 3.8Å; L32-W64 HydrophobicContact CD1-CE3 4.38Å; L32-W64 HydrophobicContact CD1-CG 3.84Å; L32-W64 HydrophobicContact CD1-CZ2 4.45Å; L32-W64 HydrophobicContact CD2-CE3 4.33Å; L32-W64 HydrophobicContact CG-CD2 4.32Å; L32-W64 HydrophobicContact CG-CE3 4.44Å; L32-F65 HydrophobicContact CD2-CE2 3.98Å |
| 33 | E | 98.2 | Very high | 97.3 | Very high | 61 Ų | 61 | 81 Ų | 81 | 29% | 0.285 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -63.8 | -45.8 | 175.2 | -74.4 | -178.8 | 166.9 | 0 | 0 | 111.2 | I29 E35 F36 Y37 W64 | I29-E33 HydrophobicContact CG2-CG 4.07Å; I29-E33 WeakPolarHBondContact O-CB 3.23Å; I29-E33 WeakPolarHBondContact O-CG 3.48Å; I29-E33 PolarHBondContact O-N 3.04Å; E33-E35 VanDerWaalsContact C-N 3.26Å; E33-E35 PolarHBondContact O-N 3.28Å; E33-F36 WeakPolarHBondContact O-CB 3.49Å; E33-F36 PolarHBondContact O-N 2.67Å; E33-Y37 HydrophobicContact CB-CE2 4.25Å; E33-Y37 WeakPolarHBondContact O-CD2 3.12Å; E33-Y37 PolarHBondContact O-N 3.4Å; E33-W64 HydrophobicContact CG-CH2 3.93Å; E33-W64 HydrophobicContact CG-CZ2 3.97Å |
| 34 | K | 98 | Very high | 97.5 | Very high | 142 Ų | 142 | 86 Ų | 86 | 62% | 0.617 | 39% | 0.385 | S | S | * | . | H | α-helix | trans | -54.7 | -42.7 | 175.8 | -176.5 | 174.2 | -178.9 | 174.6 | 0 | 112.2 | G30 R31 R38 | G30-K34 WeakPolarHBondContact O-CB 3.42Å; G30-K34 PolarHBondContact O-N 3.07Å; R31-K34 PolarHBondContact O-N 3.18Å; K34-R38 PolarHBondContact O-N 2.95Å |
| 35 | E | 98 | Very high | 97.6 | Very high | 11 Ų | 11 | 87.1 Ų | 87.1 | 5% | 0.051 | 40% | 0.398 | C | S | . | . | H | α-helix | trans | -70.2 | -38.7 | 175.8 | -65.6 | -58.6 | 137.1 | 0 | 0 | 112.7 | R31 L32 E33 Y37 R38 E39 R46 L50 F65 | R31-E35 IonicContact CZ-OE1 3.79Å; R31-E35 IonicContact NH1-OE1 2.83Å; R31-E35 PolarHBondContact NH1-OE1 3.46Å; R31-E35 IonicContact NH2-OE1 3.97Å; R31-E35 WeakPolarHBondContact O-CG 3.37Å; R31-E35 PolarHBondContact O-N 3.07Å; L32-E35 PolarHBondContact O-N 3.45Å; E33-E35 VanDerWaalsContact C-N 3.26Å; E33-E35 PolarHBondContact O-N 3.28Å; E35-Y37 VanDerWaalsContact C-N 3.28Å; E35-Y37 PolarHBondContact O-N 3.4Å; E35-R38 WeakPolarHBondContact O-CA 3.18Å; E35-R38 WeakPolarHBondContact O-CB 3.29Å; E35-R38 PolarHBondContact O-N 3.12Å; E35-R38 IonicContact OE2-CZ 3.68Å; E35-R38 IonicContact OE2-NH1 2.89Å; E35-R38 IonicContact OE2-NH2 3.97Å; E35-E39 PolarHBondContact O-N 3.01Å; E35-R46 IonicContact OE1-CZ 3.66Å; E35-R46 IonicContact OE1-NE 2.65Å; E35-R46 IonicContact OE1-NH2 2.79Å; E35-R46 PolarHBondContact OE1-NH2 3.34Å; E35-R46 IonicContact OE2-CZ 3.94Å; E35-R46 VanDerWaalsContact OE2-CZ 3.24Å; E35-R46 IonicContact OE2-NE 3.61Å; E35-R46 PolarHBondContact OE2-NE 2.92Å; E35-R46 IonicContact OE2-NH2 2.67Å; E35-R46 PolarHBondContact OE2-NH2 2.91Å; E35-L50 HydrophobicContact CB-CD1 4.24Å; E35-L50 HydrophobicContact CG-CD1 3.9Å; E35-L50 HydrophobicContact CG-CD2 3.64Å; E35-L50 HydrophobicContact CG-CG 4.35Å; E35-F65 HydrophobicContact CB-CZ 4.1Å |
| 36 | F | 98 | Very high | 97.6 | Very high | 5 Ų | 5 | 85.6 Ų | 85.6 | 2% | 0.022 | 38% | 0.384 | C | S | . | . | H | α-helix | trans | -61.3 | -37.1 | 177.3 | -174.6 | -96.1 | 0 | 0 | 0 | 112.7 | L32 E33 R38 E39 N40 W64 F65 R68 R69 D72 | L32-F36 WeakPolarHBondContact O-CB 3.42Å; L32-F36 PolarHBondContact O-N 2.96Å; E33-F36 WeakPolarHBondContact O-CB 3.49Å; E33-F36 PolarHBondContact O-N 2.67Å; F36-R38 PolarHBondContact O-N 3.47Å; F36-E39 WeakPolarHBondContact CA-O 3.27Å; F36-E39 CarbonylContact O-C 3.34Å; F36-N40 WeakPolarHBondContact CE1-OD1 3.42Å; F36-N40 HydrophobicContact CE2-CB 4.07Å; F36-N40 HydrophobicContact CZ-CB 4.27Å; F36-N40 WeakPolarHBondContact CZ-OD1 3.46Å; F36-W64 HydrophobicContact CB-CH2 4.38Å; F36-W64 HydrophobicContact CB-CZ3 4.19Å; F36-F65 HydrophobicContact CB-CE1 4.33Å; F36-F65 HydrophobicContact CD2-CD1 4Å; F36-F65 HydrophobicContact CD2-CE1 4.07Å; F36-R68 HydrophobicContact CD1-CG 3.83Å; F36-R68 HydrophobicContact CD2-CB 4.25Å; F36-R68 HydrophobicContact CD2-CG 3.56Å; F36-R68 HydrophobicContact CE1-CG 3.87Å; F36-R68 VanDerWaalsContact CE1-CZ 3.43Å; F36-R68 HydrophobicContact CE2-CB 4.18Å; F36-R68 HydrophobicContact CE2-CG 3.6Å; F36-R68 HydrophobicContact CG-CG 3.68Å; F36-R68 HydrophobicContact CZ-CG 3.74Å; F36-R69 HydrophobicContact CE2-CG 3.76Å; F36-R69 HydrophobicContact CZ-CG 4.25Å; F36-D72 HydrophobicContact CZ-CB 4.21Å |
| 37 | Y | 97.3 | Very high | 97.7 | Very high | 171 Ų | 171 | 78.1 Ų | 78.1 | 67% | 0.671 | 36% | 0.355 | S | S | * | . | H | α-helix | trans | -63.9 | -31.7 | 173.1 | -74.5 | -65.7 | 0 | 0 | 0 | 112.6 | E33 E35 | E33-Y37 HydrophobicContact CB-CE2 4.25Å; E33-Y37 WeakPolarHBondContact O-CD2 3.12Å; E33-Y37 PolarHBondContact O-N 3.4Å; E35-Y37 VanDerWaalsContact C-N 3.28Å; E35-Y37 PolarHBondContact O-N 3.4Å |
| 38 | R | 97.1 | Very high | 97.7 | Very high | 141 Ų | 141 | 72.8 Ų | 72.8 | 53% | 0.532 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -75.9 | -50.5 | 176.9 | -149.8 | -174.8 | 74.7 | -177.4 | 4.9 | 110.9 | K34 E35 F36 | K34-R38 PolarHBondContact O-N 2.95Å; E35-R38 WeakPolarHBondContact O-CA 3.18Å; E35-R38 WeakPolarHBondContact O-CB 3.29Å; E35-R38 PolarHBondContact O-N 3.12Å; E35-R38 IonicContact OE2-CZ 3.68Å; E35-R38 IonicContact OE2-NH1 2.89Å; E35-R38 IonicContact OE2-NH2 3.97Å; F36-R38 PolarHBondContact O-N 3.47Å |
| 39 | E | 96.3 | Very high | 97.7 | Very high | 81 Ų | 81 | 76.1 Ų | 76.1 | 38% | 0.379 | 35% | 0.351 | S | S | . | . | trans | -143 | 124.5 | -179.9 | -70.4 | 164.9 | -123.1 | 0 | 0 | 110.2 | E35 F36 Y41 | E35-E39 PolarHBondContact O-N 3.01Å; F36-E39 WeakPolarHBondContact CA-O 3.27Å; F36-E39 CarbonylContact O-C 3.34Å; E39-Y41 PolarHBondContact O-N 2.89Å | ||
| 40 | N | 96.8 | Very high | 97.8 | Very high | 61 Ų | 61 | 74.1 Ų | 74.1 | 33% | 0.326 | 34% | 0.341 | S | S | . | . | S | Bend | trans | -70.3 | -14 | -179.7 | -79.9 | -107.7 | 0 | 0 | 0 | 113.1 | F36 R69 | F36-N40 WeakPolarHBondContact CE1-OD1 3.42Å; F36-N40 HydrophobicContact CE2-CB 4.07Å; F36-N40 HydrophobicContact CZ-CB 4.27Å; F36-N40 WeakPolarHBondContact CZ-OD1 3.46Å; N40-R69 WeakPolarHBondContact O-CD 2.99Å |
| 41 | Y | 97.8 | Very high | 97.7 | Very high | 155 Ų | 155 | 73 Ų | 73 | 61% | 0.608 | 33% | 0.328 | S | S | * | . | S | Bend | trans | -127.1 | 130.1 | 179.4 | -68.3 | -96.7 | 0 | 0 | 0 | 108.9 | E39 R69 | E39-Y41 PolarHBondContact O-N 2.89Å; Y41-R69 PolarHBondContact OH-NH1 3.48Å; Y41-R69 VanDerWaalsContact OH-NH1 3.07Å |
| 42 | V | 97.4 | Very high | 97.7 | Very high | 19 Ų | 19 | 72 Ų | 72 | 12% | 0.115 | 34% | 0.34 | C | S | . | . | trans | -94.9 | 122 | -179.7 | 68 | 0 | 0 | 0 | 0 | 111.1 | R46 R47 L50 F65 | V42-R46 HydrophobicContact CG2-CB 3.89Å; V42-R46 HydrophobicContact CG2-CG 3.89Å; V42-R47 HydrophobicContact CG1-CB 4.32Å; V42-R47 HydrophobicContact CG1-CG 4.42Å; V42-R47 HydrophobicContact CG2-CB 4.03Å; V42-R47 PolarHBondContact O-NH2 3.44Å; V42-L50 HydrophobicContact CG2-CD1 4.08Å; V42-F65 HydrophobicContact CB-CD1 4.11Å; V42-F65 HydrophobicContact CB-CD2 4.31Å; V42-F65 HydrophobicContact CB-CE1 3.94Å; V42-F65 HydrophobicContact CB-CE2 4.16Å; V42-F65 HydrophobicContact CB-CG 4.29Å; V42-F65 HydrophobicContact CB-CZ 3.97Å; V42-F65 HydrophobicContact CG1-CB 4.44Å; V42-F65 HydrophobicContact CG1-CD1 4.23Å; V42-F65 HydrophobicContact CG1-CD2 3.94Å; V42-F65 HydrophobicContact CG1-CE1 4.49Å; V42-F65 HydrophobicContact CG1-CE2 4.23Å; V42-F65 HydrophobicContact CG1-CG 3.94Å; V42-F65 HydrophobicContact CG2-CZ 4.45Å | ||
| 43 | S | 97.8 | Very high | 97.7 | Very high | 54 Ų | 54 | 75.4 Ų | 75.4 | 38% | 0.378 | 37% | 0.368 | S | S | . | . | trans | -64.5 | 161.5 | 172.7 | 71.1 | 0 | 0 | 0 | 0 | 111.3 | R46 R47 | S43-R46 PolarHBondContact O-N 2.79Å; S43-R46 WeakPolarHBondContact OG-CB 3.45Å; S43-R46 PolarHBondContact OG-N 2.65Å; S43-R47 WeakPolarHBondContact O-CB 3.34Å; S43-R47 PolarHBondContact O-N 3.12Å | ||
| 44 | R | 97.8 | Very high | 97.6 | Very high | 192 Ų | 192 | 73.1 Ų | 73.1 | 73% | 0.725 | 36% | 0.357 | S | S | * | . | H | α-helix | trans | -56.9 | -53.7 | 178 | -173.1 | 175.2 | -176.9 | -177.1 | -1.1 | 113.1 | R46 R47 C48 | R44-R46 VanDerWaalsContact C-N 3.32Å; R44-R46 PolarHBondContact O-N 3.37Å; R44-R47 WeakPolarHBondContact O-CB 3.47Å; R44-R47 PolarHBondContact O-N 3.38Å; R44-R47 VanDerWaalsContact O-N 3.15Å; R44-C48 PolarHBondContact O-N 3.14Å; R44-C48 VanDerWaalsContact O-N 3.14Å; R44-C48 PolarHBondContact O-SG 3.3Å |
| 45 | P | 97.7 | Very high | 97.6 | Very high | 82 Ų | 82 | 73.3 Ų | 73.3 | 53% | 0.532 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -60.1 | -43.3 | -179.5 | 22.3 | -33.1 | 0 | 0 | 0 | 111.9 | R47 C48 E49 | P45-R47 VanDerWaalsContact C-N 3.27Å; P45-R47 PolarHBondContact O-N 3.47Å; P45-C48 WeakPolarHBondContact O-CB 3.35Å; P45-C48 PolarHBondContact O-N 3.15Å; P45-C48 VanDerWaalsContact O-N 3.15Å; P45-E49 PolarHBondContact O-N 3.19Å; P45-E49 VanDerWaalsContact O-N 3.12Å |
| 46 | R | 97.8 | Very high | 97.5 | Very high | 44 Ų | 44 | 73.8 Ų | 73.8 | 17% | 0.166 | 37% | 0.368 | C | S | . | . | H | α-helix | trans | -63.8 | -34 | 178.9 | -171.5 | 52.7 | 171.4 | 175.9 | -1.9 | 112.8 | E35 V42 S43 R44 E49 L50 | E35-R46 IonicContact OE1-CZ 3.66Å; E35-R46 IonicContact OE1-NE 2.65Å; E35-R46 IonicContact OE1-NH2 2.79Å; E35-R46 PolarHBondContact OE1-NH2 3.34Å; E35-R46 IonicContact OE2-CZ 3.94Å; E35-R46 VanDerWaalsContact OE2-CZ 3.24Å; E35-R46 IonicContact OE2-NE 3.61Å; E35-R46 PolarHBondContact OE2-NE 2.92Å; E35-R46 IonicContact OE2-NH2 2.67Å; E35-R46 PolarHBondContact OE2-NH2 2.91Å; V42-R46 HydrophobicContact CG2-CB 3.89Å; V42-R46 HydrophobicContact CG2-CG 3.89Å; S43-R46 PolarHBondContact O-N 2.79Å; S43-R46 WeakPolarHBondContact OG-CB 3.45Å; S43-R46 PolarHBondContact OG-N 2.65Å; R44-R46 VanDerWaalsContact C-N 3.32Å; R44-R46 PolarHBondContact O-N 3.37Å; R46-E49 VanDerWaalsContact CD-OE2 3.31Å; R46-E49 WeakPolarHBondContact CD-OE2 3.47Å; R46-E49 IonicContact CZ-OE2 3.37Å; R46-E49 IonicContact NE-OE2 2.9Å; R46-E49 IonicContact NH1-OE2 2.92Å; R46-E49 PolarHBondContact NH1-OE2 2.87Å; R46-E49 PolarHBondContact O-N 3.37Å; R46-L50 HydrophobicContact CG-CD1 4.28Å; R46-L50 WeakPolarHBondContact O-CG 3.31Å; R46-L50 PolarHBondContact O-N 3.07Å |
| 47 | R | 98.3 | Very high | 97.5 | Very high | 55 Ų | 55 | 77 Ų | 77 | 21% | 0.208 | 39% | 0.389 | C | S | . | . | H | α-helix | trans | -65.6 | -41.7 | 175.6 | -169.7 | -172.9 | -52.7 | 163.4 | 8.5 | 111.9 | V42 S43 R44 P45 E49 L50 A51 E58 I61 | V42-R47 HydrophobicContact CG1-CB 4.32Å; V42-R47 HydrophobicContact CG1-CG 4.42Å; V42-R47 HydrophobicContact CG2-CB 4.03Å; V42-R47 PolarHBondContact O-NH2 3.44Å; S43-R47 WeakPolarHBondContact O-CB 3.34Å; S43-R47 PolarHBondContact O-N 3.12Å; R44-R47 WeakPolarHBondContact O-CB 3.47Å; R44-R47 PolarHBondContact O-N 3.38Å; R44-R47 VanDerWaalsContact O-N 3.15Å; P45-R47 VanDerWaalsContact C-N 3.27Å; P45-R47 PolarHBondContact O-N 3.47Å; R47-E49 VanDerWaalsContact C-N 3.35Å; R47-L50 PolarHBondContact O-N 3.19Å; R47-A51 VanDerWaalsContact O-CB 3.29Å; R47-A51 WeakPolarHBondContact O-CB 3.48Å; R47-A51 PolarHBondContact O-N 3.15Å; R47-E58 WeakPolarHBondContact CD-O 3.37Å; R47-E58 HydrophobicContact CG-CB 4.14Å; R47-E58 HydrophobicContact CG-CG 4.22Å; R47-I61 HydrophobicContact CG-CB 4.05Å; R47-I61 HydrophobicContact CG-CG2 3.91Å |
| 48 | C | 98.3 | Very high | 97.5 | Very high | 49 Ų | 49 | 72.5 Ų | 72.5 | 33% | 0.331 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -61.6 | -44.3 | 176.2 | -59.4 | 0 | 0 | 0 | 0 | 110.9 | R44 P45 L50 A51 A52 E58 | R44-C48 PolarHBondContact O-N 3.14Å; R44-C48 VanDerWaalsContact O-N 3.14Å; R44-C48 PolarHBondContact O-SG 3.3Å; P45-C48 WeakPolarHBondContact O-CB 3.35Å; P45-C48 PolarHBondContact O-N 3.15Å; P45-C48 VanDerWaalsContact O-N 3.15Å; C48-L50 PolarHBondContact O-N 2.96Å; C48-A51 PolarHBondContact O-N 3.5Å; C48-A52 PolarHBondContact O-N 3.48Å; C48-E58 VanDerWaalsContact SG-CD 3.55Å; C48-E58 PolarHBondContact SG-OE1 3.36Å |
| 49 | E | 98.1 | Very high | 97.5 | Very high | 102 Ų | 102 | 70 Ų | 70 | 48% | 0.477 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -61.1 | -43.9 | 176.9 | -68.3 | 167.6 | -166.1 | 0 | 0 | 112.5 | P45 R46 R47 A52 A53 | P45-E49 PolarHBondContact O-N 3.19Å; P45-E49 VanDerWaalsContact O-N 3.12Å; R46-E49 VanDerWaalsContact CD-OE2 3.31Å; R46-E49 WeakPolarHBondContact CD-OE2 3.47Å; R46-E49 IonicContact CZ-OE2 3.37Å; R46-E49 IonicContact NE-OE2 2.9Å; R46-E49 IonicContact NH1-OE2 2.92Å; R46-E49 PolarHBondContact NH1-OE2 2.87Å; R46-E49 PolarHBondContact O-N 3.37Å; R47-E49 VanDerWaalsContact C-N 3.35Å; E49-A52 PolarHBondContact O-N 3.37Å; E49-A53 WeakPolarHBondContact O-CB 3.43Å; E49-A53 PolarHBondContact O-N 3.31Å |
| 50 | L | 97.9 | Very high | 97.6 | Very high | 3 Ų | 3 | 68 Ų | 68 | 2% | 0.016 | 37% | 0.368 | C | S | . | . | H | α-helix | trans | -69.3 | -36.8 | 178.2 | -68.9 | 169.5 | 0 | 0 | 0 | 112.7 | E35 V42 R46 R47 C48 A53 L54 I61 F65 | E35-L50 HydrophobicContact CB-CD1 4.24Å; E35-L50 HydrophobicContact CG-CD1 3.9Å; E35-L50 HydrophobicContact CG-CD2 3.64Å; E35-L50 HydrophobicContact CG-CG 4.35Å; V42-L50 HydrophobicContact CG2-CD1 4.08Å; R46-L50 HydrophobicContact CG-CD1 4.28Å; R46-L50 WeakPolarHBondContact O-CG 3.31Å; R46-L50 PolarHBondContact O-N 3.07Å; R47-L50 PolarHBondContact O-N 3.19Å; C48-L50 PolarHBondContact O-N 2.96Å; L50-A53 PolarHBondContact O-N 3.19Å; L50-L54 VanDerWaalsContact O-CB 3.27Å; L50-L54 WeakPolarHBondContact O-CB 3.26Å; L50-L54 WeakPolarHBondContact O-CG 3.41Å; L50-L54 PolarHBondContact O-N 3.37Å; L50-I61 HydrophobicContact CB-CD1 4.43Å; L50-F65 HydrophobicContact CD1-CE2 4.37Å |
| 51 | A | 98 | Very high | 97.6 | Very high | 13 Ų | 13 | 65 Ų | 65 | 11% | 0.107 | 35% | 0.352 | C | S | . | . | H | α-helix | trans | -59.9 | -47.3 | 175.4 | 0 | 0 | 0 | 0 | 0 | 111 | R47 C48 N55 L56 E58 I61 | R47-A51 VanDerWaalsContact O-CB 3.29Å; R47-A51 WeakPolarHBondContact O-CB 3.48Å; R47-A51 PolarHBondContact O-N 3.15Å; C48-A51 PolarHBondContact O-N 3.5Å; A51-N55 WeakPolarHBondContact O-CA 3.44Å; A51-N55 PolarHBondContact O-N 3.46Å; A51-L56 CarbonylContact C-O 3.57Å; A51-L56 WeakPolarHBondContact CA-O 3.39Å; A51-L56 WeakPolarHBondContact CB-O 3.33Å; A51-L56 PolarHBondContact O-N 3.5Å; A51-E58 HydrophobicContact CB-CG 3.84Å; A51-I61 HydrophobicContact CB-CG1 4.37Å |
| 52 | A | 97.8 | Very high | 97.6 | Very high | 72 Ų | 72 | 62.7 Ų | 62.7 | 60% | 0.595 | 35% | 0.345 | S | S | * | . | H | α-helix | trans | -64.8 | -46.8 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | C48 E49 L54 | C48-A52 PolarHBondContact O-N 3.48Å; E49-A52 PolarHBondContact O-N 3.37Å; A52-L54 VanDerWaalsContact C-N 3.32Å; A52-L54 PolarHBondContact O-N 3.07Å |
| 53 | A | 97.3 | Very high | 97.6 | Very high | 70 Ų | 70 | 65 Ų | 65 | 58% | 0.579 | 36% | 0.359 | S | S | * | . | H | α-helix | trans | -66.3 | -31.4 | -177.7 | 0 | 0 | 0 | 0 | 0 | 113.6 | E49 L50 | E49-A53 WeakPolarHBondContact O-CB 3.43Å; E49-A53 PolarHBondContact O-N 3.31Å; L50-A53 PolarHBondContact O-N 3.19Å |
| 54 | L | 96.9 | Very high | 97.6 | Very high | 14 Ų | 14 | 63.8 Ų | 63.8 | 7% | 0.073 | 35% | 0.346 | C | S | . | . | H | α-helix | trans | -102.7 | -1.6 | -175.4 | -61.6 | -179.7 | 0 | 0 | 0 | 113.8 | Q28 R31 L32 L50 A52 L56 I61 | Q28-L54 HydrophobicContact CG-CB 4.35Å; Q28-L54 HydrophobicContact CG-CD2 4.26Å; Q28-L54 PolarHBondContact NE2-O 3.06Å; R31-L54 HydrophobicContact CB-CD1 4.23Å; R31-L54 HydrophobicContact CB-CD2 3.8Å; R31-L54 HydrophobicContact CG-CD1 4.49Å; R31-L54 HydrophobicContact CG-CD2 4Å; L32-L54 HydrophobicContact CD1-CD1 4.33Å; L32-L54 HydrophobicContact CD2-CD1 3.85Å; L32-L54 HydrophobicContact CG-CD1 3.72Å; L50-L54 VanDerWaalsContact O-CB 3.27Å; L50-L54 WeakPolarHBondContact O-CB 3.26Å; L50-L54 WeakPolarHBondContact O-CG 3.41Å; L50-L54 PolarHBondContact O-N 3.37Å; A52-L54 VanDerWaalsContact C-N 3.32Å; A52-L54 PolarHBondContact O-N 3.07Å; L54-L56 VanDerWaalsContact C-N 3.26Å; L54-L56 HydrophobicContact CB-CB 4.49Å; L54-L56 HydrophobicContact CB-CD1 4.11Å; L54-L56 HydrophobicContact CB-CG 4.13Å; L54-L56 PolarHBondContact O-N 3.28Å; L54-I61 HydrophobicContact CD1-CD1 4.34Å |
| 55 | N | 97.4 | Very high | 97.6 | Very high | 146 Ų | 146 | 55 Ų | 55 | 78% | 0.781 | 31% | 0.313 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 51.7 | 44.2 | -171.4 | -65.9 | -65.5 | 0 | 0 | 0 | 112.4 | A51 | A51-N55 WeakPolarHBondContact O-CA 3.44Å; A51-N55 PolarHBondContact O-N 3.46Å |
| 56 | L | 96.4 | Very high | 97.6 | Very high | 21 Ų | 21 | 55.9 Ų | 55.9 | 11% | 0.11 | 31% | 0.311 | C | S | . | . | trans | -120.8 | 144.6 | 179.2 | -68.2 | 178 | 0 | 0 | 0 | 110.5 | F24 Q28 A51 L54 I61 | F24-L56 HydrophobicContact CD1-CD1 3.84Å; F24-L56 HydrophobicContact CD1-CD2 4.03Å; F24-L56 HydrophobicContact CE1-CD1 3.87Å; F24-L56 HydrophobicContact CE1-CD2 3.9Å; Q28-L56 HydrophobicContact CG-CD1 4.46Å; A51-L56 CarbonylContact C-O 3.57Å; A51-L56 WeakPolarHBondContact CA-O 3.39Å; A51-L56 WeakPolarHBondContact CB-O 3.33Å; A51-L56 PolarHBondContact O-N 3.5Å; L54-L56 VanDerWaalsContact C-N 3.26Å; L54-L56 HydrophobicContact CB-CB 4.49Å; L54-L56 HydrophobicContact CB-CD1 4.11Å; L54-L56 HydrophobicContact CB-CG 4.13Å; L54-L56 PolarHBondContact O-N 3.28Å; L56-I61 HydrophobicContact CB-CD1 3.93Å; L56-I61 HydrophobicContact CB-CG1 4.39Å; L56-I61 HydrophobicContact CD1-CD1 4.02Å | ||
| 57 | P | 97.5 | Very high | 97.6 | Very high | 71 Ų | 71 | 58.6 Ų | 58.6 | 46% | 0.461 | 33% | 0.328 | S | S | . | . | trans | -59.4 | 143.5 | 172.9 | -18.1 | 26.8 | 0 | 0 | 0 | 111.8 | T59 T60 I61 | P57-T59 PolarHBondContact O-N 2.9Å; P57-T59 VanDerWaalsContact O-N 3.12Å; P57-T60 WeakPolarHBondContact CD-OG1 3.43Å; P57-T60 WeakPolarHBondContact CG-OG1 3.49Å; P57-T60 WeakPolarHBondContact O-CA 3.43Å; P57-T60 VanDerWaalsContact O-CB 3.26Å; P57-T60 WeakPolarHBondContact O-CB 3.32Å; P57-T60 PolarHBondContact O-N 2.92Å; P57-I61 PolarHBondContact O-N 3.05Å; P57-I61 VanDerWaalsContact O-N 3.07Å | ||
| 58 | E | 97.8 | Very high | 97.6 | Very high | 77 Ų | 77 | 57.3 Ų | 57.3 | 36% | 0.36 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -54.3 | -34.6 | 173.7 | -73.4 | -172.9 | -139.3 | 0 | 0 | 112.7 | R47 C48 A51 T60 I61 K62 | R47-E58 WeakPolarHBondContact CD-O 3.37Å; R47-E58 HydrophobicContact CG-CB 4.14Å; R47-E58 HydrophobicContact CG-CG 4.22Å; C48-E58 VanDerWaalsContact SG-CD 3.55Å; C48-E58 PolarHBondContact SG-OE1 3.36Å; A51-E58 HydrophobicContact CB-CG 3.84Å; E58-T60 VanDerWaalsContact C-N 3.32Å; E58-I61 PolarHBondContact O-N 3.36Å; E58-K62 WeakPolarHBondContact O-CB 3.36Å; E58-K62 PolarHBondContact O-N 3.45Å |
| 59 | T | 97.2 | Very high | 97.6 | Very high | 88 Ų | 88 | 58.4 Ų | 58.4 | 54% | 0.54 | 32% | 0.321 | S | S | . | . | H | α-helix | trans | -62.9 | -40.4 | 176.4 | 54.5 | 0 | 0 | 0 | 0 | 111.5 | P57 K62 V63 | P57-T59 PolarHBondContact O-N 2.9Å; P57-T59 VanDerWaalsContact O-N 3.12Å; T59-K62 WeakPolarHBondContact O-CB 3.42Å; T59-K62 PolarHBondContact O-N 2.79Å; T59-V63 WeakPolarHBondContact O-CG2 3.47Å; T59-V63 PolarHBondContact O-N 3.24Å |
| 60 | T | 96.9 | Very high | 97.6 | Very high | 39 Ų | 39 | 58 Ų | 58 | 24% | 0.239 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -65.8 | -43.5 | 176.3 | -57.6 | 0 | 0 | 0 | 0 | 111.2 | F24 P57 E58 K62 V63 W64 | F24-T60 HydrophobicContact CE1-CG2 3.4Å; F24-T60 VanDerWaalsContact CE1-CG2 3.4Å; F24-T60 HydrophobicContact CZ-CG2 3.3Å; P57-T60 WeakPolarHBondContact CD-OG1 3.43Å; P57-T60 WeakPolarHBondContact CG-OG1 3.49Å; P57-T60 WeakPolarHBondContact O-CA 3.43Å; P57-T60 VanDerWaalsContact O-CB 3.26Å; P57-T60 WeakPolarHBondContact O-CB 3.32Å; P57-T60 PolarHBondContact O-N 2.92Å; E58-T60 VanDerWaalsContact C-N 3.32Å; T60-K62 VanDerWaalsContact C-N 3.34Å; T60-K62 PolarHBondContact O-N 2.91Å; T60-V63 PolarHBondContact O-N 3.21Å; T60-W64 WeakPolarHBondContact O-CB 3.4Å; T60-W64 PolarHBondContact O-N 3.37Å |
| 61 | I | 97.7 | Very high | 97.4 | Very high | 0 Ų | 0 | 63.2 Ų | 63.2 | 0% | 0 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -59.4 | -46.3 | 172.8 | -55 | -67.9 | 0 | 0 | 0 | 110.2 | L32 R47 L50 A51 L54 L56 P57 E58 V63 W64 F65 | L32-I61 HydrophobicContact CD2-CD1 3.74Å; L32-I61 HydrophobicContact CD2-CG2 4.28Å; R47-I61 HydrophobicContact CG-CB 4.05Å; R47-I61 HydrophobicContact CG-CG2 3.91Å; L50-I61 HydrophobicContact CB-CD1 4.43Å; A51-I61 HydrophobicContact CB-CG1 4.37Å; L54-I61 HydrophobicContact CD1-CD1 4.34Å; L56-I61 HydrophobicContact CB-CD1 3.93Å; L56-I61 HydrophobicContact CB-CG1 4.39Å; L56-I61 HydrophobicContact CD1-CD1 4.02Å; P57-I61 PolarHBondContact O-N 3.05Å; P57-I61 VanDerWaalsContact O-N 3.07Å; E58-I61 PolarHBondContact O-N 3.36Å; I61-V63 PolarHBondContact O-N 2.89Å; I61-W64 PolarHBondContact O-N 3.27Å; I61-F65 HydrophobicContact CG2-CD2 3.94Å; I61-F65 HydrophobicContact CG2-CE2 4Å; I61-F65 WeakPolarHBondContact O-CD2 3.34Å; I61-F65 PolarHBondContact O-N 3.05Å |
| 62 | K | 97.4 | Very high | 97.3 | Very high | 106 Ų | 106 | 63.8 Ų | 63.8 | 46% | 0.461 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -58.1 | -47.6 | 178 | -174.1 | -176.7 | 72.2 | 176 | 0 | 111.9 | E58 T59 T60 F65 Q66 | E58-K62 WeakPolarHBondContact O-CB 3.36Å; E58-K62 PolarHBondContact O-N 3.45Å; T59-K62 WeakPolarHBondContact O-CB 3.42Å; T59-K62 PolarHBondContact O-N 2.79Å; T60-K62 VanDerWaalsContact C-N 3.34Å; T60-K62 PolarHBondContact O-N 2.91Å; K62-F65 PolarHBondContact O-N 3.45Å; K62-Q66 PolarHBondContact O-N 2.99Å |
| 63 | V | 97.6 | Very high | 97.1 | Very high | 67 Ų | 67 | 65.8 Ų | 65.8 | 41% | 0.406 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -65.3 | -39.9 | 178.4 | 170.9 | 0 | 0 | 0 | 0 | 110.9 | T59 T60 I61 Q66 N67 | T59-V63 WeakPolarHBondContact O-CG2 3.47Å; T59-V63 PolarHBondContact O-N 3.24Å; T60-V63 PolarHBondContact O-N 3.21Å; I61-V63 PolarHBondContact O-N 2.89Å; V63-Q66 PolarHBondContact O-N 3.24Å; V63-N67 WeakPolarHBondContact O-CB 3.33Å; V63-N67 PolarHBondContact O-N 3.44Å; V63-N67 PolarHBondContact O-ND2 3.31Å |
| 64 | W | 97.7 | Very high | 96.8 | Very high | 29 Ų | 29 | 71.2 Ų | 71.2 | 11% | 0.11 | 34% | 0.344 | C | S | . | . | H | α-helix | trans | -60.3 | -48.5 | 176.3 | -172 | 98.5 | 0 | 0 | 0 | 111.6 | F24 L32 E33 F36 T60 I61 Q66 N67 R68 | F24-W64 AromaticContact CD2-CD1 3.7Å; F24-W64 AromaticContact CE2-CD1 3.51Å; F24-W64 HydrophobicContact CE2-CG 4.43Å; L32-W64 HydrophobicContact CB-CD2 3.98Å; L32-W64 HydrophobicContact CB-CE3 3.89Å; L32-W64 HydrophobicContact CB-CH2 3.56Å; L32-W64 HydrophobicContact CB-CZ2 3.63Å; L32-W64 HydrophobicContact CB-CZ3 3.69Å; L32-W64 HydrophobicContact CD1-CD2 3.8Å; L32-W64 HydrophobicContact CD1-CE3 4.38Å; L32-W64 HydrophobicContact CD1-CG 3.84Å; L32-W64 HydrophobicContact CD1-CZ2 4.45Å; L32-W64 HydrophobicContact CD2-CE3 4.33Å; L32-W64 HydrophobicContact CG-CD2 4.32Å; L32-W64 HydrophobicContact CG-CE3 4.44Å; E33-W64 HydrophobicContact CG-CH2 3.93Å; E33-W64 HydrophobicContact CG-CZ2 3.97Å; F36-W64 HydrophobicContact CB-CH2 4.38Å; F36-W64 HydrophobicContact CB-CZ3 4.19Å; T60-W64 WeakPolarHBondContact O-CB 3.4Å; T60-W64 PolarHBondContact O-N 3.37Å; I61-W64 PolarHBondContact O-N 3.27Å; W64-Q66 VanDerWaalsContact C-N 3.3Å; W64-Q66 PolarHBondContact O-N 2.87Å; W64-N67 PolarHBondContact O-N 3.35Å; W64-R68 HydrophobicContact CD2-CB 4.47Å; W64-R68 HydrophobicContact CE3-CB 4.01Å; W64-R68 HydrophobicContact CH2-CB 4.04Å; W64-R68 HydrophobicContact CH2-CG 3.78Å; W64-R68 HydrophobicContact CZ2-CG 4.48Å; W64-R68 HydrophobicContact CZ3-CB 3.77Å; W64-R68 HydrophobicContact CZ3-CG 3.83Å; W64-R68 WeakPolarHBondContact O-CB 3.46Å; W64-R68 PolarHBondContact O-N 2.88Å |
| 65 | F | 98.4 | Very high | 96.5 | Very high | 6 Ų | 6 | 74.6 Ų | 74.6 | 3% | 0.026 | 36% | 0.36 | C | S | . | . | H | α-helix | trans | -63.1 | -35.5 | 177.3 | -90.4 | -100 | 0 | 0 | 0 | 112.3 | L32 E35 F36 V42 L50 I61 K62 R69 | L32-F65 HydrophobicContact CD2-CE2 3.98Å; E35-F65 HydrophobicContact CB-CZ 4.1Å; F36-F65 HydrophobicContact CB-CE1 4.33Å; F36-F65 HydrophobicContact CD2-CD1 4Å; F36-F65 HydrophobicContact CD2-CE1 4.07Å; V42-F65 HydrophobicContact CB-CD1 4.11Å; V42-F65 HydrophobicContact CB-CD2 4.31Å; V42-F65 HydrophobicContact CB-CE1 3.94Å; V42-F65 HydrophobicContact CB-CE2 4.16Å; V42-F65 HydrophobicContact CB-CG 4.29Å; V42-F65 HydrophobicContact CB-CZ 3.97Å; V42-F65 HydrophobicContact CG1-CB 4.44Å; V42-F65 HydrophobicContact CG1-CD1 4.23Å; V42-F65 HydrophobicContact CG1-CD2 3.94Å; V42-F65 HydrophobicContact CG1-CE1 4.49Å; V42-F65 HydrophobicContact CG1-CE2 4.23Å; V42-F65 HydrophobicContact CG1-CG 3.94Å; V42-F65 HydrophobicContact CG2-CZ 4.45Å; L50-F65 HydrophobicContact CD1-CE2 4.37Å; I61-F65 HydrophobicContact CG2-CD2 3.94Å; I61-F65 HydrophobicContact CG2-CE2 4Å; I61-F65 WeakPolarHBondContact O-CD2 3.34Å; I61-F65 PolarHBondContact O-N 3.05Å; K62-F65 PolarHBondContact O-N 3.45Å; F65-R69 WeakPolarHBondContact O-CG 3.41Å; F65-R69 PolarHBondContact O-N 3.33Å |
| 66 | Q | 98.2 | Very high | 96 | Very high | 102 Ų | 102 | 74.6 Ų | 74.6 | 48% | 0.477 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -63.7 | -49.5 | 173.2 | -172.1 | 172.4 | 19.7 | 0 | 0 | 111.5 | K62 V63 W64 R68 R69 M70 | K62-Q66 PolarHBondContact O-N 2.99Å; V63-Q66 PolarHBondContact O-N 3.24Å; W64-Q66 VanDerWaalsContact C-N 3.3Å; W64-Q66 PolarHBondContact O-N 2.87Å; Q66-R68 VanDerWaalsContact C-N 3.33Å; Q66-R68 PolarHBondContact O-N 2.85Å; Q66-R69 PolarHBondContact O-N 3.36Å; Q66-M70 WeakPolarHBondContact O-CG 3.11Å; Q66-M70 PolarHBondContact O-N 2.65Å; Q66-M70 VanDerWaalsContact O-N 3.08Å |
| 67 | N | 97.6 | Very high | 95.3 | Very high | 100 Ų | 100 | 76.6 Ų | 76.6 | 54% | 0.535 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -62.3 | -41.1 | 177.7 | -72.2 | -21 | 0 | 0 | 0 | 111.9 | V63 W64 M70 K71 | V63-N67 WeakPolarHBondContact O-CB 3.33Å; V63-N67 PolarHBondContact O-N 3.44Å; V63-N67 PolarHBondContact O-ND2 3.31Å; W64-N67 PolarHBondContact O-N 3.35Å; N67-M70 PolarHBondContact O-N 2.92Å; N67-K71 PolarHBondContact O-N 3.47Å |
| 68 | R | 97.9 | Very high | 94 | Very high | 28 Ų | 28 | 76.7 Ų | 76.7 | 11% | 0.106 | 37% | 0.366 | C | S | . | . | H | α-helix | trans | -63.7 | -41.7 | 178.8 | -178.6 | 61.3 | -171 | 83.8 | 0.4 | 111.9 | F36 W64 Q66 K71 D72 | F36-R68 HydrophobicContact CD1-CG 3.83Å; F36-R68 HydrophobicContact CD2-CB 4.25Å; F36-R68 HydrophobicContact CD2-CG 3.56Å; F36-R68 HydrophobicContact CE1-CG 3.87Å; F36-R68 VanDerWaalsContact CE1-CZ 3.43Å; F36-R68 HydrophobicContact CE2-CB 4.18Å; F36-R68 HydrophobicContact CE2-CG 3.6Å; F36-R68 HydrophobicContact CG-CG 3.68Å; F36-R68 HydrophobicContact CZ-CG 3.74Å; W64-R68 HydrophobicContact CD2-CB 4.47Å; W64-R68 HydrophobicContact CE3-CB 4.01Å; W64-R68 HydrophobicContact CH2-CB 4.04Å; W64-R68 HydrophobicContact CH2-CG 3.78Å; W64-R68 HydrophobicContact CZ2-CG 4.48Å; W64-R68 HydrophobicContact CZ3-CB 3.77Å; W64-R68 HydrophobicContact CZ3-CG 3.83Å; W64-R68 WeakPolarHBondContact O-CB 3.46Å; W64-R68 PolarHBondContact O-N 2.88Å; Q66-R68 VanDerWaalsContact C-N 3.33Å; Q66-R68 PolarHBondContact O-N 2.85Å; R68-K71 PolarHBondContact O-N 3.36Å; R68-D72 IonicContact CZ-OD1 3.66Å; R68-D72 VanDerWaalsContact NH1-CB 3.26Å; R68-D72 IonicContact NH1-OD1 3.71Å; R68-D72 PolarHBondContact NH1-OD1 3.26Å; R68-D72 IonicContact NH2-OD1 3.97Å; R68-D72 PolarHBondContact NH2-OD1 3.3Å; R68-D72 WeakPolarHBondContact O-CB 2.95Å; R68-D72 PolarHBondContact O-N 2.84Å |
| 69 | R | 97.6 | Very high | 92.3 | Very high | 73 Ų | 73 | 81 Ų | 81 | 28% | 0.275 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -63.3 | -40.1 | 173.1 | -74.6 | -173.5 | -66.4 | 132.8 | -1.8 | 112.4 | F36 N40 Y41 F65 Q66 D72 K73 | F36-R69 HydrophobicContact CE2-CG 3.76Å; F36-R69 HydrophobicContact CZ-CG 4.25Å; N40-R69 WeakPolarHBondContact O-CD 2.99Å; Y41-R69 PolarHBondContact OH-NH1 3.48Å; Y41-R69 VanDerWaalsContact OH-NH1 3.07Å; F65-R69 WeakPolarHBondContact O-CG 3.41Å; F65-R69 PolarHBondContact O-N 3.33Å; Q66-R69 PolarHBondContact O-N 3.36Å; R69-D72 WeakPolarHBondContact O-CB 3.4Å; R69-D72 PolarHBondContact O-N 3.04Å; R69-K73 WeakPolarHBondContact O-CB 3.37Å; R69-K73 PolarHBondContact O-N 3.27Å |
| 70 | M | 97.4 | Very high | 90.6 | Very high | 92 Ų | 92 | 80.7 Ų | 80.7 | 45% | 0.453 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -64.2 | -42.8 | 175.6 | -67.6 | -52.7 | -62.9 | 0 | 0 | 111.8 | Q66 N67 D72 K73 R74 | Q66-M70 WeakPolarHBondContact O-CG 3.11Å; Q66-M70 PolarHBondContact O-N 2.65Å; Q66-M70 VanDerWaalsContact O-N 3.08Å; N67-M70 PolarHBondContact O-N 2.92Å; M70-D72 VanDerWaalsContact C-N 3.32Å; M70-D72 PolarHBondContact O-N 2.74Å; M70-K73 PolarHBondContact O-N 3.36Å; M70-R74 WeakPolarHBondContact O-CB 3.49Å; M70-R74 VanDerWaalsContact O-CG 3.31Å; M70-R74 WeakPolarHBondContact O-CG 3.23Å; M70-R74 PolarHBondContact O-N 3.09Å |
| 71 | K | 95.3 | Very high | 88.1 | Confident | 114 Ų | 114 | 87 Ų | 87 | 50% | 0.496 | 41% | 0.409 | S | S | . | . | H | α-helix | trans | -59.5 | -44.5 | 172.7 | -175.8 | -179.1 | 177.1 | -175.8 | 0 | 111.1 | N67 R68 R74 Q75 | N67-K71 PolarHBondContact O-N 3.47Å; R68-K71 PolarHBondContact O-N 3.36Å; K71-R74 CarbonylContact O-C 3.59Å; K71-R74 WeakPolarHBondContact O-CB 3.45Å; K71-R74 PolarHBondContact O-N 3.38Å; K71-Q75 HydrophobicContact CG-CG 4.43Å; K71-Q75 WeakPolarHBondContact O-CB 3.28Å; K71-Q75 VanDerWaalsContact O-CG 3.32Å; K71-Q75 WeakPolarHBondContact O-CG 3.47Å; K71-Q75 PolarHBondContact O-N 3.49Å |
| 72 | D | 95.1 | Very high | 86 | Confident | 25 Ų | 25 | 92.7 Ų | 92.7 | 13% | 0.134 | 45% | 0.447 | C | S | . | . | H | α-helix | trans | -61 | -46.9 | 178.7 | -153.6 | 69.3 | 0 | 0 | 0 | 112.6 | F36 R68 R69 M70 R74 Q75 R76 | F36-D72 HydrophobicContact CZ-CB 4.21Å; R68-D72 IonicContact CZ-OD1 3.66Å; R68-D72 VanDerWaalsContact NH1-CB 3.26Å; R68-D72 IonicContact NH1-OD1 3.71Å; R68-D72 PolarHBondContact NH1-OD1 3.26Å; R68-D72 IonicContact NH2-OD1 3.97Å; R68-D72 PolarHBondContact NH2-OD1 3.3Å; R68-D72 WeakPolarHBondContact O-CB 2.95Å; R68-D72 PolarHBondContact O-N 2.84Å; R69-D72 WeakPolarHBondContact O-CB 3.4Å; R69-D72 PolarHBondContact O-N 3.04Å; M70-D72 VanDerWaalsContact C-N 3.32Å; M70-D72 PolarHBondContact O-N 2.74Å; D72-R74 VanDerWaalsContact C-N 3.34Å; D72-R74 PolarHBondContact O-N 2.74Å; D72-Q75 PolarHBondContact O-N 2.9Å; D72-R76 WeakPolarHBondContact O-CG 3.48Å; D72-R76 PolarHBondContact O-N 2.93Å; D72-R76 IonicContact OD2-CZ 2.85Å; D72-R76 IonicContact OD2-NE 3.26Å; D72-R76 PolarHBondContact OD2-NE 2.94Å; D72-R76 IonicContact OD2-NH1 4Å; D72-R76 PolarHBondContact OD2-NH1 2.97Å; D72-R76 IonicContact OD2-NH2 3.36Å; D72-R76 PolarHBondContact OD2-NH2 3.22Å |
| 73 | K | 94.4 | Very high | 84 | Confident | 114 Ų | 114 | 94.8 Ų | 94.8 | 50% | 0.496 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -59.1 | -46.6 | 173.9 | -177.2 | 178.3 | 178.3 | 179.4 | 0 | 110.6 | R69 M70 Q75 R76 L77 | R69-K73 WeakPolarHBondContact O-CB 3.37Å; R69-K73 PolarHBondContact O-N 3.27Å; M70-K73 PolarHBondContact O-N 3.36Å; K73-Q75 VanDerWaalsContact C-N 3.33Å; K73-Q75 PolarHBondContact O-N 3.4Å; K73-R76 PolarHBondContact O-N 3.45Å; K73-L77 HydrophobicContact CD-CD1 4.42Å; K73-L77 HydrophobicContact CG-CD1 3.83Å; K73-L77 HydrophobicContact CG-CG 4.3Å; K73-L77 VanDerWaalsContact O-CB 3.28Å; K73-L77 WeakPolarHBondContact O-CB 3.11Å; K73-L77 VanDerWaalsContact O-CG 3.23Å; K73-L77 WeakPolarHBondContact O-CG 3.31Å; K73-L77 PolarHBondContact O-N 3.26Å |
| 74 | R | 90.3 | Very high | 82 | Confident | 183 Ų | 183 | 93.2 Ų | 93.2 | 69% | 0.691 | 45% | 0.449 | S | S | * | . | H | α-helix | trans | -61.8 | -38.9 | 176.9 | -75 | 176.4 | -178.6 | -175.6 | 0.1 | 112.3 | M70 K71 D72 A78 | M70-R74 WeakPolarHBondContact O-CB 3.49Å; M70-R74 VanDerWaalsContact O-CG 3.31Å; M70-R74 WeakPolarHBondContact O-CG 3.23Å; M70-R74 PolarHBondContact O-N 3.09Å; K71-R74 CarbonylContact O-C 3.59Å; K71-R74 WeakPolarHBondContact O-CB 3.45Å; K71-R74 PolarHBondContact O-N 3.38Å; D72-R74 VanDerWaalsContact C-N 3.34Å; D72-R74 PolarHBondContact O-N 2.74Å; R74-A78 WeakPolarHBondContact O-CB 3.41Å; R74-A78 PolarHBondContact O-N 3.2Å |
| 75 | Q | 90.1 | Very high | 80.1 | Confident | 85 Ų | 85 | 97 Ų | 97 | 40% | 0.397 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -67.9 | -44.5 | 177.9 | -74.7 | 174.1 | -41.2 | 0 | 0 | 111.5 | K71 D72 K73 L77 A78 M79 | K71-Q75 HydrophobicContact CG-CG 4.43Å; K71-Q75 WeakPolarHBondContact O-CB 3.28Å; K71-Q75 VanDerWaalsContact O-CG 3.32Å; K71-Q75 WeakPolarHBondContact O-CG 3.47Å; K71-Q75 PolarHBondContact O-N 3.49Å; D72-Q75 PolarHBondContact O-N 2.9Å; K73-Q75 VanDerWaalsContact C-N 3.33Å; K73-Q75 PolarHBondContact O-N 3.4Å; Q75-L77 PolarHBondContact O-N 2.82Å; Q75-A78 PolarHBondContact O-N 2.91Å; Q75-M79 PolarHBondContact O-N 3.44Å; Q75-M79 VanDerWaalsContact O-N 3.09Å |
| 76 | R | 86.9 | Confident | 78.4 | Confident | 146 Ų | 146 | 100.2 Ų | 100.2 | 55% | 0.551 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -62.7 | -42.5 | 175 | -72.6 | -174.8 | -71.2 | -145.5 | -7.8 | 112.6 | D72 K73 M79 S80 | D72-R76 WeakPolarHBondContact O-CG 3.48Å; D72-R76 PolarHBondContact O-N 2.93Å; D72-R76 IonicContact OD2-CZ 2.85Å; D72-R76 IonicContact OD2-NE 3.26Å; D72-R76 PolarHBondContact OD2-NE 2.94Å; D72-R76 IonicContact OD2-NH1 4Å; D72-R76 PolarHBondContact OD2-NH1 2.97Å; D72-R76 IonicContact OD2-NH2 3.36Å; D72-R76 PolarHBondContact OD2-NH2 3.22Å; K73-R76 PolarHBondContact O-N 3.45Å; R76-M79 PolarHBondContact O-N 2.87Å; R76-S80 PolarHBondContact O-N 3.07Å |
| 77 | L | 81.1 | Confident | 76.9 | Confident | 64 Ų | 64 | 100.3 Ų | 100.3 | 34% | 0.335 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -71.9 | -37.4 | 177.2 | -70 | -178.5 | 0 | 0 | 0 | 111.8 | K73 Q75 M79 S80 W81 | K73-L77 HydrophobicContact CD-CD1 4.42Å; K73-L77 HydrophobicContact CG-CD1 3.83Å; K73-L77 HydrophobicContact CG-CG 4.3Å; K73-L77 VanDerWaalsContact O-CB 3.28Å; K73-L77 WeakPolarHBondContact O-CB 3.11Å; K73-L77 VanDerWaalsContact O-CG 3.23Å; K73-L77 WeakPolarHBondContact O-CG 3.31Å; K73-L77 PolarHBondContact O-N 3.26Å; Q75-L77 PolarHBondContact O-N 2.82Å; L77-M79 PolarHBondContact O-N 3.08Å; L77-S80 CarbonylContact O-C 3.56Å; L77-S80 PolarHBondContact O-N 3.16Å; L77-S80 PolarHBondContact O-OG 3.48Å; L77-W81 WeakPolarHBondContact O-CB 3.46Å; L77-W81 PolarHBondContact O-N 3.16Å |
| 78 | A | 70.8 | Confident | 75.8 | Confident | 73 Ų | 73 | 99 Ų | 99 | 60% | 0.603 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -63.1 | -27.7 | 173.7 | 0 | 0 | 0 | 0 | 0 | 112 | R74 Q75 | R74-A78 WeakPolarHBondContact O-CB 3.41Å; R74-A78 PolarHBondContact O-N 3.2Å; Q75-A78 PolarHBondContact O-N 2.91Å |
| 79 | M | 61.6 | Low | 74.6 | Confident | 166 Ų | 166 | 102.9 Ų | 102.9 | 82% | 0.818 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -76.2 | -24.6 | 169.7 | -100.2 | 92.7 | 95 | 0 | 0 | 114 | Q75 R76 L77 | Q75-M79 PolarHBondContact O-N 3.44Å; Q75-M79 VanDerWaalsContact O-N 3.09Å; R76-M79 PolarHBondContact O-N 2.87Å; L77-M79 PolarHBondContact O-N 3.08Å |
| 80 | S | 61.9 | Low | 73.5 | Confident | 83 Ų | 83 | 104.6 Ų | 104.6 | 58% | 0.58 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -110.5 | -14.8 | -172.4 | 78.4 | 0 | 0 | 0 | 0 | 115 | R76 L77 | R76-S80 PolarHBondContact O-N 3.07Å; L77-S80 CarbonylContact O-C 3.56Å; L77-S80 PolarHBondContact O-N 3.16Å; L77-S80 PolarHBondContact O-OG 3.48Å |
| 81 | W | 44.3 | Very low | 72.6 | Confident | 170 Ų | 170 | 104 Ų | 104 | 64% | 0.644 | 54% | 0.539 | S | S | * | . | S | Bend | trans | -81.1 | 139.1 | 174.7 | -85.2 | 78.8 | 0 | 0 | 0 | 108.7 | L77 H83 | L77-W81 WeakPolarHBondContact O-CB 3.46Å; L77-W81 PolarHBondContact O-N 3.16Å; W81-H83 PolarHBondContact O-N 3.27Å |
| 82 | P | 53.8 | Low | 71.9 | Confident | 121 Ų | 121 | 105.5 Ų | 105.5 | 79% | 0.786 | 54% | 0.543 | S | S | * | . | trans | -71.7 | 70 | 171.2 | 31.7 | -32.9 | 0 | 0 | 0 | 108.3 | ||||
| 83 | H | 55.3 | Low | 71.2 | Confident | 149 Ų | 149 | 108.8 Ų | 108.8 | 69% | 0.69 | 56% | 0.558 | S | S | * | * | trans | -81.4 | 120.3 | 149.7 | -118.1 | -49.8 | 0 | 0 | 0 | 104.6 | W81 A85 | W81-H83 PolarHBondContact O-N 3.27Å; H83-A85 PolarHBondContact O-N 3.31Å | ||
| 84 | P | 55.9 | Low | 70.4 | Confident | 35 Ų | 35 | 107.7 Ų | 107.7 | 23% | 0.227 | 56% | 0.556 | C | S | . | * | trans | -57.8 | 117.6 | 162.6 | 28 | -31.2 | 0 | 0 | 0 | 104.6 | D86 F89 | P84-D86 PolarHBondContact O-N 2.8Å; P84-F89 HydrophobicContact CB-CB 4.03Å; P84-F89 HydrophobicContact CB-CD1 3.15Å; P84-F89 HydrophobicContact CB-CE1 3.86Å; P84-F89 HydrophobicContact CB-CG 3.89Å; P84-F89 HydrophobicContact CG-CD1 3.78Å; P84-F89 HydrophobicContact CG-CE1 4.48Å | ||
| 85 | A | 57.4 | Low | 69.9 | Low | 109 Ų | 109 | 103.1 Ų | 103.1 | 90% | 0.901 | 55% | 0.549 | S | S | * | . | S | Bend | trans | -65.7 | 13.1 | -171.6 | 0 | 0 | 0 | 0 | 0 | 113.3 | H83 | H83-A85 PolarHBondContact O-N 3.31Š|
| 86 | D | 62.5 | Low | 69.1 | Low | 73 Ų | 73 | 103.8 Ų | 103.8 | 39% | 0.39 | 55% | 0.551 | S | S | . | * | trans | -131.2 | 114.1 | 178.7 | -172.4 | -0.2 | 0 | 0 | 0 | 109.1 | P84 S88 F89 Y90 | P84-D86 PolarHBondContact O-N 2.8Å; D86-S88 VanDerWaalsContact CG-CB 3.47Å; D86-S88 PolarHBondContact O-N 3.06Å; D86-S88 WeakPolarHBondContact OD1-CA 3.39Å; D86-S88 WeakPolarHBondContact OD1-CB 3.33Å; D86-S88 PolarHBondContact OD1-N 3.33Å; D86-S88 PolarHBondContact OD1-OG 3.17Å; D86-S88 WeakPolarHBondContact OD2-CB 3.45Å; D86-S88 PolarHBondContact OD2-OG 2.71Å; D86-F89 HydrophobicContact CB-CB 4.05Å; D86-F89 PolarHBondContact O-N 2.73Å; D86-Y90 PolarHBondContact O-N 3.49Å | ||
| 87 | P | 67.5 | Low | 68.6 | Low | 103 Ų | 103 | 98.2 Ų | 98.2 | 67% | 0.669 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -47.8 | -28.7 | 166.5 | -27.4 | 35.7 | 0 | 0 | 0 | 113.1 | T91 | P87-T91 WeakPolarHBondContact O-CB 3.34Å; P87-T91 PolarHBondContact O-N 2.79Å; P87-T91 PolarHBondContact O-OG1 3.13Å |
| 88 | S | 74.5 | Confident | 68.2 | Low | 74 Ų | 74 | 98.4 Ų | 98.4 | 52% | 0.517 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -71.1 | -39.8 | 176.6 | -34 | 0 | 0 | 0 | 0 | 112.4 | D86 T91 Y92 | D86-S88 VanDerWaalsContact CG-CB 3.47Å; D86-S88 PolarHBondContact O-N 3.06Å; D86-S88 WeakPolarHBondContact OD1-CA 3.39Å; D86-S88 WeakPolarHBondContact OD1-CB 3.33Å; D86-S88 PolarHBondContact OD1-N 3.33Å; D86-S88 PolarHBondContact OD1-OG 3.17Å; D86-S88 WeakPolarHBondContact OD2-CB 3.45Å; D86-S88 PolarHBondContact OD2-OG 2.71Å; S88-T91 PolarHBondContact O-N 3.04Å; S88-Y92 WeakPolarHBondContact O-CB 3.32Å; S88-Y92 PolarHBondContact O-N 2.97Å |
| 89 | F | 73.1 | Confident | 68.3 | Low | 109 Ų | 109 | 98.9 Ų | 98.9 | 48% | 0.478 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -68.9 | -38.9 | 175.9 | -177.5 | -84 | 0 | 0 | 0 | 111.7 | P84 D86 T91 Y92 M93 | P84-F89 HydrophobicContact CB-CB 4.03Å; P84-F89 HydrophobicContact CB-CD1 3.15Å; P84-F89 HydrophobicContact CB-CE1 3.86Å; P84-F89 HydrophobicContact CB-CG 3.89Å; P84-F89 HydrophobicContact CG-CD1 3.78Å; P84-F89 HydrophobicContact CG-CE1 4.48Å; D86-F89 HydrophobicContact CB-CB 4.05Å; D86-F89 PolarHBondContact O-N 2.73Å; F89-T91 VanDerWaalsContact C-N 3.32Å; F89-T91 PolarHBondContact O-N 3.21Å; F89-Y92 PolarHBondContact O-N 3.13Å; F89-M93 HydrophobicContact CE1-SD 4.21Å; F89-M93 VanDerWaalsContact O-CB 3.32Å; F89-M93 WeakPolarHBondContact O-CB 3.29Å; F89-M93 PolarHBondContact O-N 2.93Å |
| 90 | Y | 74.8 | Confident | 69 | Low | 108 Ų | 108 | 94.5 Ų | 94.5 | 42% | 0.424 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -60 | -45 | 172.4 | 178.9 | -103.3 | 0 | 0 | 0 | 111.2 | D86 M93 M94 | D86-Y90 PolarHBondContact O-N 3.49Å; Y90-M93 HydrophobicContact CD2-CE 4.39Å; Y90-M93 PolarHBondContact O-N 3.31Å; Y90-M94 HydrophobicContact CE1-CE 3.7Å; Y90-M94 HydrophobicContact CE1-SD 4.41Å; Y90-M94 VanDerWaalsContact O-CB 3.29Å; Y90-M94 WeakPolarHBondContact O-CB 3.39Å; Y90-M94 PolarHBondContact O-N 3.47Å; Y90-M94 WeakPolarHBondContact OH-CE 3.39Å |
| 91 | T | 76.9 | Confident | 69.1 | Low | 80 Ų | 80 | 93.9 Ų | 93.9 | 49% | 0.491 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -62.4 | -47.2 | 176.4 | -57.6 | 0 | 0 | 0 | 0 | 110.8 | P87 S88 F89 M93 M94 T95 | P87-T91 WeakPolarHBondContact O-CB 3.34Å; P87-T91 PolarHBondContact O-N 2.79Å; P87-T91 PolarHBondContact O-OG1 3.13Å; S88-T91 PolarHBondContact O-N 3.04Å; F89-T91 VanDerWaalsContact C-N 3.32Å; F89-T91 PolarHBondContact O-N 3.21Å; T91-M93 PolarHBondContact O-N 2.92Å; T91-M94 PolarHBondContact O-N 3.01Å; T91-T95 WeakPolarHBondContact O-CB 3.35Å; T91-T95 PolarHBondContact O-N 3.08Å; T91-T95 PolarHBondContact O-OG1 3.36Å |
| 92 | Y | 82.5 | Confident | 70.1 | Confident | 146 Ų | 146 | 89.7 Ų | 89.7 | 57% | 0.573 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -58 | -48 | 177.1 | 176.3 | -99.1 | 0 | 0 | 0 | 112 | S88 F89 M94 T95 H96 | S88-Y92 WeakPolarHBondContact O-CB 3.32Å; S88-Y92 PolarHBondContact O-N 2.97Å; F89-Y92 PolarHBondContact O-N 3.13Å; Y92-M94 VanDerWaalsContact C-N 3.34Å; Y92-M94 PolarHBondContact O-N 3.46Å; Y92-T95 PolarHBondContact O-N 3.12Å; Y92-H96 VanDerWaalsContact O-CB 3.27Å; Y92-H96 WeakPolarHBondContact O-CB 3.27Å; Y92-H96 PolarHBondContact O-N 3.45Å |
| 93 | M | 79.4 | Confident | 70.2 | Confident | 93 Ų | 93 | 87.9 Ų | 87.9 | 46% | 0.458 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -64 | -39.3 | 178 | -175.1 | 174.4 | 58 | 0 | 0 | 111.7 | F89 Y90 T91 A97 | F89-M93 HydrophobicContact CE1-SD 4.21Å; F89-M93 VanDerWaalsContact O-CB 3.32Å; F89-M93 WeakPolarHBondContact O-CB 3.29Å; F89-M93 PolarHBondContact O-N 2.93Å; Y90-M93 HydrophobicContact CD2-CE 4.39Å; Y90-M93 PolarHBondContact O-N 3.31Å; T91-M93 PolarHBondContact O-N 2.92Å; M93-A97 WeakPolarHBondContact O-CB 3.46Å; M93-A97 PolarHBondContact O-N 3.44Å |
| 94 | M | 78.6 | Confident | 70.5 | Confident | 91 Ų | 91 | 86.9 Ų | 86.9 | 45% | 0.448 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -67 | -42.9 | 176.5 | -160.9 | 100.4 | 111.6 | 0 | 0 | 111.9 | Y90 T91 Y92 A98 | Y90-M94 HydrophobicContact CE1-CE 3.7Å; Y90-M94 HydrophobicContact CE1-SD 4.41Å; Y90-M94 VanDerWaalsContact O-CB 3.29Å; Y90-M94 WeakPolarHBondContact O-CB 3.39Å; Y90-M94 PolarHBondContact O-N 3.47Å; Y90-M94 WeakPolarHBondContact OH-CE 3.39Å; T91-M94 PolarHBondContact O-N 3.01Å; Y92-M94 VanDerWaalsContact C-N 3.34Å; Y92-M94 PolarHBondContact O-N 3.46Å; M94-A98 WeakPolarHBondContact O-CB 3.32Å; M94-A98 PolarHBondContact O-N 3.22Å |
| 95 | T | 78.4 | Confident | 70.2 | Confident | 88 Ų | 88 | 93.9 Ų | 93.9 | 54% | 0.54 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -65.8 | -41.7 | 175.9 | -62 | 0 | 0 | 0 | 0 | 111.3 | T91 Y92 A98 A99 | T91-T95 WeakPolarHBondContact O-CB 3.35Å; T91-T95 PolarHBondContact O-N 3.08Å; T91-T95 PolarHBondContact O-OG1 3.36Å; Y92-T95 PolarHBondContact O-N 3.12Å; T95-A98 PolarHBondContact O-N 2.91Å; T95-A99 WeakPolarHBondContact O-CB 3.15Å; T95-A99 PolarHBondContact O-N 2.83Å |
| 96 | H | 74.8 | Confident | 70.3 | Confident | 98 Ų | 98 | 93.2 Ų | 93.2 | 45% | 0.454 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -66.7 | -41.3 | 178.8 | -160.9 | -70.8 | 0 | 0 | 0 | 111.5 | Y92 A98 A99 T100 | Y92-H96 VanDerWaalsContact O-CB 3.27Å; Y92-H96 WeakPolarHBondContact O-CB 3.27Å; Y92-H96 PolarHBondContact O-N 3.45Å; H96-A98 VanDerWaalsContact C-N 3.34Å; H96-A98 PolarHBondContact O-N 3.37Å; H96-A99 PolarHBondContact O-N 2.81Å; H96-T100 WeakPolarHBondContact O-CG2 3.41Å; H96-T100 PolarHBondContact O-N 3.45Å; H96-T100 PolarHBondContact O-OG1 3.49Å |
| 97 | A | 75.6 | Confident | 69.8 | Low | 29 Ų | 29 | 97 Ų | 97 | 24% | 0.24 | 55% | 0.551 | C | S | . | * | H | α-helix | trans | -65.7 | -35.6 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.8 | M93 L103 | M93-A97 WeakPolarHBondContact O-CB 3.46Å; M93-A97 PolarHBondContact O-N 3.44Å; A97-L103 HydrophobicContact CB-CD2 4.09Å |
| 98 | A | 71.8 | Confident | 68.9 | Low | 68 Ų | 68 | 100 Ų | 100 | 56% | 0.562 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -68.5 | -37.5 | 173 | 0 | 0 | 0 | 0 | 0 | 112.1 | M94 T95 H96 | M94-A98 WeakPolarHBondContact O-CB 3.32Å; M94-A98 PolarHBondContact O-N 3.22Å; T95-A98 PolarHBondContact O-N 2.91Å; H96-A98 VanDerWaalsContact C-N 3.34Å; H96-A98 PolarHBondContact O-N 3.37Å |
| 99 | A | 73.1 | Confident | 67.8 | Low | 83 Ų | 83 | 102.7 Ų | 102.7 | 69% | 0.686 | 57% | 0.574 | S | S | * | * | H | α-helix | trans | -72.1 | -32.9 | -180 | 0 | 0 | 0 | 0 | 0 | 113.3 | T95 H96 G101 | T95-A99 WeakPolarHBondContact O-CB 3.15Å; T95-A99 PolarHBondContact O-N 2.83Å; H96-A99 PolarHBondContact O-N 2.81Å; A99-G101 VanDerWaalsContact C-N 3.28Å; A99-G101 PolarHBondContact O-N 3.45Å |
| 100 | T | 76.4 | Confident | 66.8 | Low | 74 Ų | 74 | 105.4 Ų | 105.4 | 45% | 0.454 | 59% | 0.588 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -83.2 | -1.5 | 178.9 | 61 | 0 | 0 | 0 | 0 | 113.6 | H96 S102 | H96-T100 WeakPolarHBondContact O-CG2 3.41Å; H96-T100 PolarHBondContact O-N 3.45Å; H96-T100 PolarHBondContact O-OG1 3.49Å; T100-S102 PolarHBondContact O-N 2.87Å; T100-S102 PolarHBondContact OG1-OG 2.84Å; T100-S102 VanDerWaalsContact OG1-OG 3.04Å |
| 101 | G | 63.7 | Low | 65.7 | Low | 71 Ų | 71 | 107.6 Ų | 107.6 | 73% | 0.732 | 60% | 0.604 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 62.7 | 9.5 | 176.4 | 0 | 0 | 0 | 0 | 0 | 114.9 | A99 | A99-G101 VanDerWaalsContact C-N 3.28Å; A99-G101 PolarHBondContact O-N 3.45Å |
| 102 | S | 66.1 | Low | 64.7 | Low | 81 Ų | 81 | 107.9 Ų | 107.9 | 57% | 0.566 | 61% | 0.607 | S | S | * | * | trans | -111.5 | 67.5 | -171.6 | 65.3 | 0 | 0 | 0 | 0 | 110.4 | T100 | T100-S102 PolarHBondContact O-N 2.87Å; T100-S102 PolarHBondContact OG1-OG 2.84Å; T100-S102 VanDerWaalsContact OG1-OG 3.04Å | ||
| 103 | L | 57 | Low | 63.2 | Low | 84 Ų | 84 | 108.1 Ų | 108.1 | 44% | 0.44 | 62% | 0.617 | S | S | . | * | trans | -98.8 | 115.8 | 173.4 | -81.6 | 161.7 | 0 | 0 | 0 | 109.7 | A97 Y105 F107 | A97-L103 HydrophobicContact CB-CD2 4.09Å; L103-Y105 PolarHBondContact O-N 3.18Å; L103-Y105 VanDerWaalsContact O-N 3.1Å; L103-F107 HydrophobicContact CD1-CD2 4.42Å; L103-F107 HydrophobicContact CD1-CE2 3.91Å; L103-F107 HydrophobicContact CD2-CE2 4.03Å; L103-F107 HydrophobicContact CG-CE2 4.48Å | ||
| 104 | P | 60.7 | Low | 62.1 | Low | 127 Ų | 127 | 111.9 Ų | 111.9 | 83% | 0.825 | 63% | 0.634 | S | S | * | * | S | Bend | trans | -77.4 | 17 | 179.3 | 30.5 | -34 | 0 | 0 | 0 | 114.1 | ||
| 105 | Y | 50.3 | Low | 60.9 | Low | 182 Ų | 182 | 117.7 Ų | 117.7 | 71% | 0.714 | 65% | 0.652 | S | S | * | * | S | Bend | trans | -146.7 | 131.4 | 176.7 | -140 | -97.4 | 0 | 0 | 0 | 112.7 | L103 F107 | L103-Y105 PolarHBondContact O-N 3.18Å; L103-Y105 VanDerWaalsContact O-N 3.1Å; Y105-F107 PolarHBondContact O-N 3.49Å |
| 106 | P | 59.3 | Low | 59.5 | Low | 96 Ų | 96 | 122.7 Ų | 122.7 | 62% | 0.623 | 66% | 0.662 | S | S | * | * | trans | -73.5 | 114.6 | 175.7 | 29.8 | -31 | 0 | 0 | 0 | 109.1 | H108 | P106-H108 PolarHBondContact O-N 3.02Š| ||
| 107 | F | 50.7 | Low | 58.5 | Low | 153 Ų | 153 | 124 Ų | 124 | 67% | 0.671 | 68% | 0.68 | S | S | * | * | trans | -66.1 | 116.9 | 172.2 | -76.3 | -81.6 | 0 | 0 | 0 | 109.6 | L103 Y105 S109 | L103-F107 HydrophobicContact CD1-CD2 4.42Å; L103-F107 HydrophobicContact CD1-CE2 3.91Å; L103-F107 HydrophobicContact CD2-CE2 4.03Å; L103-F107 HydrophobicContact CG-CE2 4.48Å; Y105-F107 PolarHBondContact O-N 3.49Å; F107-S109 PolarHBondContact O-N 2.89Å | ||
| 108 | H | 48.8 | Very low | 57.4 | Low | 165 Ų | 165 | 129.2 Ų | 129.2 | 76% | 0.764 | 70% | 0.699 | S | S | * | * | trans | -66.9 | 118.9 | 167 | -79.9 | 63.6 | 0 | 0 | 0 | 108.8 | P106 H110 | P106-H108 PolarHBondContact O-N 3.02Å; H108-H110 PolarHBondContact O-N 3.01Å | ||
| 109 | S | 51.9 | Low | 56.6 | Low | 131 Ų | 131 | 132.5 Ų | 132.5 | 92% | 0.916 | 71% | 0.711 | S | S | * | * | S | Bend | trans | -71.6 | 25.6 | -170.7 | 37.8 | 0 | 0 | 0 | 0 | 115.9 | F107 | F107-S109 PolarHBondContact O-N 2.89Š|
| 110 | H | 52.9 | Low | 55.6 | Low | 165 Ų | 165 | 132.3 Ų | 132.3 | 76% | 0.764 | 72% | 0.717 | S | S | * | * | trans | -115 | 37.5 | -180 | -167.6 | -82.2 | 0 | 0 | 0 | 112.9 | H108 P112 | H108-H110 PolarHBondContact O-N 3.01Å; H110-P112 WeakPolarHBondContact O-CD 3.37Å | ||
| 111 | M | 51.6 | Low | 54.5 | Low | 154 Ų | 154 | 134.7 Ų | 134.7 | 76% | 0.759 | 73% | 0.732 | S | S | * | * | trans | -92.5 | 112.4 | 163.4 | -101.1 | -71.2 | 155.7 | 0 | 0 | 108.8 | L113 | M111-L113 HydrophobicContact CB-CD2 4.5Å; M111-L113 PolarHBondContact O-N 3.25Å | ||
| 112 | P | 55.7 | Low | 53.9 | Low | 87 Ų | 87 | 136.8 Ų | 136.8 | 57% | 0.565 | 73% | 0.73 | S | S | * | * | trans | -68.8 | 95.6 | 176.1 | -9.9 | 25.6 | 0 | 0 | 0 | 108.8 | H110 H114 | H110-P112 WeakPolarHBondContact O-CD 3.37Å; P112-H114 PolarHBondContact O-N 3.27Å | ||
| 113 | L | 51.3 | Low | 53.1 | Low | 150 Ų | 150 | 137.3 Ų | 137.3 | 79% | 0.785 | 74% | 0.74 | S | S | * | * | G | 310 helix | trans | -73.6 | 20.7 | 172.7 | -65.2 | -162.6 | 0 | 0 | 0 | 113.2 | M111 Y115 | M111-L113 HydrophobicContact CB-CD2 4.5Å; M111-L113 PolarHBondContact O-N 3.25Å; L113-Y115 VanDerWaalsContact C-N 3.32Å; L113-Y115 PolarHBondContact O-N 3.49Å |
| 114 | H | 55.9 | Low | 52.6 | Low | 173 Ų | 173 | 137.4 Ų | 137.4 | 80% | 0.801 | 75% | 0.753 | S | S | * | * | G | 310 helix | trans | -83.5 | -3.4 | -177.8 | -70.7 | -71.9 | 0 | 0 | 0 | 114 | P112 | P112-H114 PolarHBondContact O-N 3.27Š|
| 115 | Y | 52.4 | Low | 51.9 | Low | 213 Ų | 213 | 134.7 Ų | 134.7 | 84% | 0.835 | 74% | 0.741 | S | S | * | * | G | 310 helix | trans | -92.8 | -3.1 | -176.2 | -122.9 | -90.5 | 0 | 0 | 0 | 115.1 | L113 | L113-Y115 VanDerWaalsContact C-N 3.32Å; L113-Y115 PolarHBondContact O-N 3.49Å |
| 116 | Y | 48.8 | Very low | 51.8 | Low | 193 Ų | 193 | 129.7 Ų | 129.7 | 76% | 0.757 | 74% | 0.737 | S | S | * | * | trans | -128.5 | 85.8 | 175.9 | -83.8 | -86.6 | 0 | 0 | 0 | 111.6 | H118 | Y116-H118 VanDerWaalsContact C-N 3.34Å; Y116-H118 PolarHBondContact O-N 3Å | ||
| 117 | P | 55 | Low | 51.1 | Low | 126 Ų | 126 | 128.6 Ų | 128.6 | 82% | 0.818 | 74% | 0.736 | S | S | * | * | trans | -93.2 | 56.1 | 175.5 | 37 | -32.5 | 0 | 0 | 0 | 111.8 | ||||
| 118 | H | 51.3 | Low | 50.9 | Low | 138 Ų | 138 | 124.1 Ų | 124.1 | 64% | 0.639 | 73% | 0.727 | S | S | * | * | S | Bend | trans | -142.4 | 136.9 | 158.7 | 93.4 | -57 | 0 | 0 | 0 | 107.8 | Y116 | Y116-H118 VanDerWaalsContact C-N 3.34Å; Y116-H118 PolarHBondContact O-N 3Å |
| 119 | V | 55.4 | Low | 50.7 | Low | 136 Ų | 136 | 120.6 Ų | 120.6 | 82% | 0.824 | 73% | 0.727 | S | S | * | * | trans | 87.7 | 26.7 | -163.5 | -37.1 | 0 | 0 | 0 | 0 | 116.3 | V121 | V119-V121 VanDerWaalsContact C-N 3.33Å; V119-V121 PolarHBondContact O-N 3.35Å | ||
| 120 | G | 53.2 | Low | 50.5 | Low | 79 Ų | 79 | 118.6 Ų | 118.6 | 81% | 0.814 | 72% | 0.718 | S | S | * | * | trans | -91.9 | 49.4 | 162.6 | 0 | 0 | 0 | 0 | 0 | 113 | ||||
| 121 | V | 52.9 | Low | 50.5 | Low | 124 Ų | 124 | 115.5 Ų | 115.5 | 75% | 0.752 | 71% | 0.711 | S | S | * | * | trans | -123.5 | 112.3 | 168.4 | 179.8 | 0 | 0 | 0 | 0 | 106.4 | V119 | V119-V121 VanDerWaalsContact C-N 3.33Å; V119-V121 PolarHBondContact O-N 3.35Å | ||
| 122 | T | 51.8 | Low | 50.2 | Low | 115 Ų | 115 | 112.6 Ų | 112.6 | 71% | 0.706 | 72% | 0.721 | S | S | * | * | S | Bend | trans | 135.4 | -9.9 | 158.6 | 61.9 | 0 | 0 | 0 | 0 | 116.6 | ||
| 123 | A | 48.6 | Very low | 49.7 | Very low | 93 Ų | 93 | 112.1 Ų | 112.1 | 77% | 0.769 | 72% | 0.724 | S | S | * | * | H | α-helix | trans | -83.6 | -35.5 | 172.5 | 0 | 0 | 0 | 0 | 0 | 113.3 | ||
| 124 | A | 47 | Very low | 49.3 | Very low | 86 Ų | 86 | 110 Ų | 110 | 71% | 0.711 | 73% | 0.729 | S | S | * | * | H | α-helix | trans | -78.4 | -18.1 | 178.5 | 0 | 0 | 0 | 0 | 0 | 113.7 | ||
| 125 | A | 46.3 | Very low | 49 | Very low | 69 Ų | 69 | 107.4 Ų | 107.4 | 57% | 0.57 | 73% | 0.73 | S | S | * | * | H | α-helix | trans | -76.3 | -29.4 | 178.4 | 0 | 0 | 0 | 0 | 0 | 112.6 | A128 | A125-A128 PolarHBondContact O-N 2.91Å |
| 126 | A | 46.3 | Very low | 48.9 | Very low | 78 Ų | 78 | 101.4 Ų | 101.4 | 65% | 0.645 | 72% | 0.719 | S | S | * | * | H | α-helix | trans | -71.9 | -29 | 178.5 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||
| 127 | A | 45.9 | Very low | 49.2 | Very low | 72 Ų | 72 | 97.8 Ų | 97.8 | 60% | 0.595 | 72% | 0.719 | S | S | * | * | H | α-helix | trans | -79.6 | -24.7 | 177 | 0 | 0 | 0 | 0 | 0 | 113.4 | A129 | A127-A129 VanDerWaalsContact C-N 3.34Å |
| 128 | A | 46.4 | Very low | 48.9 | Very low | 59 Ų | 59 | 100.4 Ų | 100.4 | 49% | 0.488 | 72% | 0.718 | S | S | . | * | H | α-helix | trans | -79.8 | -12.2 | 179.3 | 0 | 0 | 0 | 0 | 0 | 113.9 | A125 A130 T131 | A125-A128 PolarHBondContact O-N 2.91Å; A128-A130 VanDerWaalsContact C-N 3.31Å; A128-T131 VanDerWaalsContact O-O 3.12Å |
| 129 | A | 44 | Very low | 48.6 | Very low | 91 Ų | 91 | 98 Ų | 98 | 75% | 0.752 | 72% | 0.721 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77.6 | -14.4 | 176.2 | 0 | 0 | 0 | 0 | 0 | 113.5 | A127 | A127-A129 VanDerWaalsContact C-N 3.34Š|
| 130 | A | 48.6 | Very low | 48.6 | Very low | 89 Ų | 89 | 97.6 Ų | 97.6 | 74% | 0.736 | 72% | 0.72 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -91.9 | -15 | -178.5 | 0 | 0 | 0 | 0 | 0 | 114 | A128 | A128-A130 VanDerWaalsContact C-N 3.31Š|
| 131 | T | 53 | Low | 48.3 | Very low | 100 Ų | 100 | 98.4 Ų | 98.4 | 61% | 0.613 | 71% | 0.713 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -131.3 | 107.5 | 174.1 | 42.2 | 0 | 0 | 0 | 0 | 107.3 | A128 A133 | A128-T131 VanDerWaalsContact O-O 3.12Å; T131-A133 PolarHBondContact O-N 3.06Å |
| 132 | G | 45.4 | Very low | 48.3 | Very low | 93 Ų | 93 | 99.8 Ų | 99.8 | 96% | 0.959 | 72% | 0.715 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62.3 | 70.3 | -174.9 | 0 | 0 | 0 | 0 | 0 | 114.3 | ||
| 133 | A | 43.8 | Very low | 48.7 | Very low | 77 Ų | 77 | 104.3 Ų | 104.3 | 64% | 0.636 | 72% | 0.719 | S | S | * | * | trans | -109.5 | 105.7 | 172.5 | 0 | 0 | 0 | 0 | 0 | 107.9 | T131 S135 | T131-A133 PolarHBondContact O-N 3.06Å; A133-S135 PolarHBondContact O-N 2.9Å | ||
| 134 | A | 42.7 | Very low | 48.7 | Very low | 107 Ų | 107 | 104.3 Ų | 104.3 | 88% | 0.884 | 71% | 0.711 | S | S | * | * | trans | -55.5 | 119.8 | 175.4 | 0 | 0 | 0 | 0 | 0 | 110.5 | S136 | A134-S136 PolarHBondContact O-N 2.66Š| ||
| 135 | S | 49.7 | Very low | 49 | Very low | 117 Ų | 117 | 107.9 Ų | 107.9 | 82% | 0.818 | 72% | 0.717 | S | S | * | * | trans | -77.5 | 106.5 | 173.2 | 44.7 | 0 | 0 | 0 | 0 | 109.9 | A133 | A133-S135 PolarHBondContact O-N 2.9Š| ||
| 136 | S | 51.7 | Low | 49.1 | Very low | 87 Ų | 87 | 110.2 Ų | 110.2 | 61% | 0.608 | 72% | 0.72 | S | S | * | * | trans | -71.8 | 130 | 161.9 | 175.1 | 0 | 0 | 0 | 0 | 109.2 | A134 F138 | A134-S136 PolarHBondContact O-N 2.66Å; S136-F138 PolarHBondContact O-N 3.23Å; S136-F138 VanDerWaalsContact O-N 3.16Å | ||
| 137 | P | 53.4 | Low | 49.4 | Very low | 118 Ų | 118 | 111.3 Ų | 111.3 | 77% | 0.766 | 72% | 0.719 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76.8 | 6.8 | -174.4 | 28.9 | -33.5 | 0 | 0 | 0 | 115.3 | ||
| 138 | F | 49.3 | Very low | 49.4 | Very low | 181 Ų | 181 | 116.2 Ų | 116.2 | 79% | 0.794 | 73% | 0.727 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -128.3 | 24.5 | -176 | -84.5 | -79.8 | 0 | 0 | 0 | 115.8 | S136 T140 | S136-F138 PolarHBondContact O-N 3.23Å; S136-F138 VanDerWaalsContact O-N 3.16Å; F138-T140 PolarHBondContact O-N 3.31Å; F138-T140 VanDerWaalsContact O-N 3.16Å |
| 139 | A | 44.9 | Very low | 49.4 | Very low | 86 Ų | 86 | 122.6 Ų | 122.6 | 71% | 0.711 | 74% | 0.739 | S | S | * | * | trans | -87.7 | 76.2 | 172.8 | 0 | 0 | 0 | 0 | 0 | 111.7 | S141 | A139-S141 PolarHBondContact O-N 3.3Š| ||
| 140 | T | 55.3 | Low | 49.6 | Very low | 128 Ų | 128 | 121.6 Ų | 121.6 | 79% | 0.785 | 73% | 0.73 | S | S | * | * | trans | -70.7 | 83.1 | 162.4 | -49 | 0 | 0 | 0 | 0 | 108.2 | F138 I142 | F138-T140 PolarHBondContact O-N 3.31Å; F138-T140 VanDerWaalsContact O-N 3.16Å; T140-I142 PolarHBondContact O-N 2.9Å; T140-I142 VanDerWaalsContact O-N 3.08Å | ||
| 141 | S | 48.3 | Very low | 49.6 | Very low | 96 Ų | 96 | 124 Ų | 124 | 67% | 0.671 | 73% | 0.73 | S | S | * | * | trans | -67.4 | 107.3 | 169 | -175 | 0 | 0 | 0 | 0 | 108.3 | A139 R143 | A139-S141 PolarHBondContact O-N 3.3Å; S141-R143 PolarHBondContact O-N 3.49Å; S141-R143 VanDerWaalsContact O-N 3.13Å | ||
| 142 | I | 52.6 | Low | 49.1 | Very low | 154 Ų | 154 | 123.2 Ų | 123.2 | 79% | 0.79 | 73% | 0.728 | S | S | * | * | P | Polyproline II helix | trans | -53.3 | 116.5 | 169.5 | -60.4 | 178.3 | 0 | 0 | 0 | 106.8 | T140 | T140-I142 PolarHBondContact O-N 2.9Å; T140-I142 VanDerWaalsContact O-N 3.08Å |
| 143 | R | 60.4 | Low | 49.1 | Very low | 210 Ų | 210 | 125.8 Ų | 125.8 | 79% | 0.792 | 72% | 0.715 | S | S | * | * | P | Polyproline II helix | trans | -60.7 | 135.5 | -177.8 | -69.4 | -79.9 | 160.5 | 170.4 | -6.2 | 109.9 | S141 L145 | S141-R143 PolarHBondContact O-N 3.49Å; S141-R143 VanDerWaalsContact O-N 3.13Å; R143-L145 PolarHBondContact O-N 3.46Å |
| 144 | P | 48.2 | Very low | 49.3 | Very low | 92 Ų | 92 | 127.6 Ų | 127.6 | 60% | 0.597 | 72% | 0.72 | S | S | * | * | P | Polyproline II helix | trans | -61.2 | 135.8 | 168.8 | -17.8 | 30 | 0 | 0 | 0 | 109.7 | D146 | P144-D146 PolarHBondContact O-N 3.04Š|
| 145 | L | 52.9 | Low | 49.2 | Very low | 162 Ų | 162 | 133.2 Ų | 133.2 | 85% | 0.848 | 72% | 0.72 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -68.6 | 22.6 | -178 | -143 | 78.4 | 0 | 0 | 0 | 113.8 | R143 | R143-L145 PolarHBondContact O-N 3.46Š|
| 146 | D | 48.8 | Very low | 49 | Very low | 117 Ų | 117 | 133.2 Ų | 133.2 | 63% | 0.626 | 72% | 0.72 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -90.2 | -14.6 | -176.4 | -96.5 | -46.7 | 0 | 0 | 0 | 113.7 | P144 F148 R149 | P144-D146 PolarHBondContact O-N 3.04Å; D146-F148 PolarHBondContact O-N 3.29Å; D146-R149 PolarHBondContact O-N 3.41Å |
| 147 | T | 52.4 | Low | 48.5 | Very low | 102 Ų | 102 | 138.3 Ų | 138.3 | 63% | 0.626 | 73% | 0.726 | S | S | * | * | H | α-helix | trans | -68.2 | -24.3 | 177.7 | -46.2 | 0 | 0 | 0 | 0 | 112.6 | R149 | T147-R149 VanDerWaalsContact C-N 3.34Å |
| 148 | F | 44.7 | Very low | 48 | Very low | 175 Ų | 175 | 137.8 Ų | 137.8 | 77% | 0.768 | 72% | 0.723 | S | S | * | * | H | α-helix | trans | -73.1 | -25.4 | 176 | -102.6 | -86.6 | 0 | 0 | 0 | 113.2 | D146 | D146-F148 PolarHBondContact O-N 3.29Å |
| 149 | R | 47.8 | Very low | 47.7 | Very low | 193 Ų | 193 | 135.1 Ų | 135.1 | 73% | 0.728 | 71% | 0.713 | S | S | * | * | H | α-helix | trans | -81.7 | -23.4 | -178.3 | -156.3 | 173.2 | -159.7 | -164.7 | 3.4 | 113.3 | D146 T147 L151 S152 | D146-R149 PolarHBondContact O-N 3.41Å; T147-R149 VanDerWaalsContact C-N 3.34Å; R149-L151 PolarHBondContact O-N 3.2Å; R149-S152 PolarHBondContact O-OG 2.99Å |
| 150 | A | 48 | Very low | 48 | Very low | 70 Ų | 70 | 138.3 Ų | 138.3 | 58% | 0.579 | 72% | 0.717 | S | S | * | * | H | α-helix | trans | -69.6 | -22.7 | 172.9 | 0 | 0 | 0 | 0 | 0 | 112.8 | H153 | A150-H153 PolarHBondContact O-ND1 3.07Å |
| 151 | L | 48.8 | Very low | 47.8 | Very low | 139 Ų | 139 | 138.9 Ų | 138.9 | 73% | 0.728 | 72% | 0.715 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -88.9 | -6.3 | -178.9 | -81 | 149.8 | 0 | 0 | 0 | 114.4 | R149 H153 | R149-L151 PolarHBondContact O-N 3.2Å; L151-H153 VanDerWaalsContact C-N 3.35Å; L151-H153 PolarHBondContact O-N 2.97Å |
| 152 | S | 42.5 | Very low | 47.7 | Very low | 83 Ų | 83 | 139 Ų | 139 | 58% | 0.58 | 71% | 0.714 | S | S | * | * | trans | -95 | 25.3 | -179.6 | 71.6 | 0 | 0 | 0 | 0 | 114 | R149 P154 | R149-S152 PolarHBondContact O-OG 2.99Å; S152-P154 WeakPolarHBondContact O-CD 3.43Å | ||
| 153 | H | 44.5 | Very low | 47.4 | Very low | 147 Ų | 147 | 137 Ų | 137 | 68% | 0.681 | 71% | 0.714 | S | S | * | * | S | Bend | trans | -74.8 | 119.5 | 163.7 | -68.7 | 86.2 | 0 | 0 | 0 | 107.9 | A150 L151 Y155 | A150-H153 PolarHBondContact O-ND1 3.07Å; L151-H153 VanDerWaalsContact C-N 3.35Å; L151-H153 PolarHBondContact O-N 2.97Å; H153-Y155 PolarHBondContact O-N 3.33Å; H153-Y155 VanDerWaalsContact O-N 3.07Å |
| 154 | P | 47.9 | Very low | 46.5 | Very low | 115 Ų | 115 | 135 Ų | 135 | 75% | 0.747 | 71% | 0.712 | S | S | * | * | trans | -61.8 | 118.5 | 172 | 26.8 | -30.5 | 0 | 0 | 0 | 106.9 | S152 S156 | S152-P154 WeakPolarHBondContact O-CD 3.43Å; P154-S156 PolarHBondContact O-N 3.2Å | ||
| 155 | Y | 40.6 | Very low | 46.3 | Very low | 226 Ų | 226 | 141.8 Ų | 141.8 | 89% | 0.886 | 73% | 0.725 | S | S | * | * | trans | -14.9 | 99.4 | 170.6 | -87.7 | -96.9 | 0 | 0 | 0 | 113.8 | H153 R157 | H153-Y155 PolarHBondContact O-N 3.33Å; H153-Y155 VanDerWaalsContact O-N 3.07Å; Y155-R157 PolarHBondContact O-N 2.99Å | ||
| 156 | S | 45.2 | Very low | 45.7 | Very low | 116 Ų | 116 | 141.9 Ų | 141.9 | 81% | 0.811 | 72% | 0.721 | S | S | * | * | trans | -74 | 90.8 | 158.3 | -65.1 | 0 | 0 | 0 | 0 | 106.7 | P154 P158 | P154-S156 PolarHBondContact O-N 3.2Å; S156-P158 WeakPolarHBondContact O-CD 3.39Å | ||
| 157 | R | 41.8 | Very low | 45.3 | Very low | 194 Ų | 194 | 142.4 Ų | 142.4 | 73% | 0.732 | 73% | 0.731 | S | S | * | * | trans | -53.8 | 119.4 | 169.9 | 177.7 | -177.9 | 166.4 | 144 | 2.9 | 108.2 | Y155 E159 | Y155-R157 PolarHBondContact O-N 2.99Å; R157-E159 IonicContact CZ-OE1 3.24Å; R157-E159 IonicContact NE-OE1 3.29Å; R157-E159 PolarHBondContact NE-OE1 3.05Å; R157-E159 PolarHBondContact O-N 3.27Å | ||
| 158 | P | 43.1 | Very low | 44.7 | Very low | 108 Ų | 108 | 140.9 Ų | 140.9 | 70% | 0.701 | 74% | 0.735 | S | S | * | * | trans | -67.3 | 109.3 | 168.9 | -10.2 | 25.1 | 0 | 0 | 0 | 106.9 | S156 L160 | S156-P158 WeakPolarHBondContact O-CD 3.39Å; P158-L160 PolarHBondContact O-N 2.87Å | ||
| 159 | E | 43.8 | Very low | 44.7 | Very low | 125 Ų | 125 | 140.9 Ų | 140.9 | 58% | 0.584 | 74% | 0.742 | S | S | * | * | trans | -62.3 | 92.5 | 162.5 | -76.8 | -67.4 | 120.8 | 0 | 0 | 107 | R157 L161 | R157-E159 IonicContact CZ-OE1 3.24Å; R157-E159 IonicContact NE-OE1 3.29Å; R157-E159 PolarHBondContact NE-OE1 3.05Å; R157-E159 PolarHBondContact O-N 3.27Å; E159-L161 PolarHBondContact O-N 3.1Å | ||
| 160 | L | 50.1 | Low | 44.5 | Very low | 153 Ų | 153 | 141.7 Ų | 141.7 | 80% | 0.801 | 75% | 0.747 | S | S | * | * | trans | -67.5 | 78.8 | 156.5 | -67.2 | -180 | 0 | 0 | 0 | 106.6 | P158 C162 | P158-L160 PolarHBondContact O-N 2.87Å; L160-C162 PolarHBondContact O-N 3.29Å | ||
| 161 | L | 50.8 | Low | 43.9 | Very low | 140 Ų | 140 | 147.5 Ų | 147.5 | 73% | 0.733 | 76% | 0.762 | S | S | * | * | trans | -63.5 | 76.8 | 154.5 | -77.2 | 167.4 | 0 | 0 | 0 | 106.6 | E159 S163 | E159-L161 PolarHBondContact O-N 3.1Å; L161-S163 PolarHBondContact O-N 2.79Å | ||
| 162 | C | 46.9 | Very low | 43.2 | Very low | 97 Ų | 97 | 145.7 Ų | 145.7 | 66% | 0.655 | 76% | 0.761 | S | S | * | * | trans | -58 | 101.1 | 147.3 | 52.1 | 0 | 0 | 0 | 0 | 105.5 | L160 F164 | L160-C162 PolarHBondContact O-N 3.29Å; C162-F164 HydrophobicContact CB-CD2 4.5Å; C162-F164 PolarHBondContact O-N 2.96Å | ||
| 163 | S | 47.2 | Very low | 43.4 | Very low | 114 Ų | 114 | 147.5 Ų | 147.5 | 80% | 0.797 | 77% | 0.771 | S | S | * | * | trans | -64.2 | 65.9 | 160.3 | -66.7 | 0 | 0 | 0 | 0 | 108.6 | L161 R165 | L161-S163 PolarHBondContact O-N 2.79Å; S163-R165 PolarHBondContact O-N 2.84Å | ||
| 164 | F | 39.8 | Very low | 43.1 | Very low | 168 Ų | 168 | 145.5 Ų | 145.5 | 74% | 0.737 | 78% | 0.78 | S | S | * | * | trans | -72.3 | 90.5 | 159.2 | -117.5 | -92.7 | 0 | 0 | 0 | 105.1 | C162 H166 | C162-F164 HydrophobicContact CB-CD2 4.5Å; C162-F164 PolarHBondContact O-N 2.96Å; F164-H166 PolarHBondContact O-N 2.73Å | ||
| 165 | R | 45.6 | Very low | 42.4 | Very low | 233 Ų | 233 | 143.4 Ų | 143.4 | 88% | 0.879 | 78% | 0.779 | S | S | * | * | trans | -56.3 | 107.8 | 163.2 | -83.3 | -156.8 | -168.4 | -114.3 | 9.2 | 107 | S163 | S163-R165 PolarHBondContact O-N 2.84Š| ||
| 166 | H | 40.4 | Very low | 42.2 | Very low | 165 Ų | 165 | 140.1 Ų | 140.1 | 76% | 0.764 | 78% | 0.776 | S | S | * | * | trans | -62.5 | 131.7 | 156.9 | -68.1 | -79.1 | 0 | 0 | 0 | 107.8 | F164 G168 | F164-H166 PolarHBondContact O-N 2.73Å; H166-G168 VanDerWaalsContact C-N 3.3Å; H166-G168 PolarHBondContact O-N 2.96Å | ||
| 167 | P | 40.2 | Very low | 41.8 | Very low | 127 Ų | 127 | 141.1 Ų | 141.1 | 83% | 0.825 | 77% | 0.772 | S | S | * | * | trans | -70.3 | 95.6 | 164.7 | 27.6 | -28.2 | 0 | 0 | 0 | 107.5 | L169 | P167-L169 PolarHBondContact O-N 3.05Š| ||
| 168 | G | 38.9 | Very low | 41.5 | Very low | 70 Ų | 70 | 137.2 Ų | 137.2 | 72% | 0.722 | 77% | 0.774 | S | S | * | * | trans | -69.8 | 116.5 | 167 | 0 | 0 | 0 | 0 | 0 | 109.3 | H166 Y170 | H166-G168 VanDerWaalsContact C-N 3.3Å; H166-G168 PolarHBondContact O-N 2.96Å; G168-Y170 VanDerWaalsContact C-N 3.3Å; G168-Y170 PolarHBondContact O-N 2.95Å | ||
| 169 | L | 45.2 | Very low | 41.2 | Very low | 176 Ų | 176 | 137.6 Ų | 137.6 | 92% | 0.921 | 78% | 0.78 | S | S | * | * | S | Bend | trans | -66.9 | 83.4 | 167.7 | -69.2 | 168.3 | 0 | 0 | 0 | 109.8 | P167 | P167-L169 PolarHBondContact O-N 3.05Š|
| 170 | Y | 42.9 | Very low | 40.8 | Very low | 209 Ų | 209 | 136.6 Ų | 136.6 | 82% | 0.82 | 79% | 0.793 | S | S | * | * | trans | -178.3 | 106.1 | 146.7 | -142.2 | -105.7 | 0 | 0 | 0 | 110.5 | G168 | G168-Y170 VanDerWaalsContact C-N 3.3Å; G168-Y170 PolarHBondContact O-N 2.95Å | ||
| 171 | Q | 36.8 | Very low | 39.9 | Very low | 192 Ų | 192 | 134 Ų | 134 | 90% | 0.897 | 79% | 0.794 | S | S | * | * | trans | -158.9 | 111.8 | 150.7 | -153.6 | 90.6 | 35.8 | 0 | 0 | 109.2 | ||||
| 172 | S | 32.3 | Very low | 39.2 | Very low | 102 Ų | 102 | 132.2 Ų | 132.2 | 71% | 0.713 | 80% | 0.799 | S | S | * | * | trans | -91.5 | 160.9 | 169.1 | -145.8 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 173 | P | 48.3 | Very low | 38.7 | Very low | 120 Ų | 120 | 133.1 Ų | 133.1 | 78% | 0.779 | 81% | 0.806 | S | S | * | * | trans | -96.1 | 154.7 | -139.2 | 37.1 | -37.3 | 0 | 0 | 0 | 114.3 | ||||
| 174 | A | 37.8 | Very low | 37.9 | Very low | 106 Ų | 106 | 132.4 Ų | 132.4 | 88% | 0.876 | 81% | 0.808 | S | S | * | * | trans | -160.7 | 129.2 | 150.9 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 175 | G | 33.8 | Very low | 37.5 | Very low | 70 Ų | 70 | 129.2 Ų | 129.2 | 72% | 0.722 | 81% | 0.812 | S | S | * | * | trans | 90.2 | 86.4 | 138.1 | 0 | 0 | 0 | 0 | 0 | 119.5 | ||||
| 176 | L | 36.3 | Very low | 36.8 | Very low | 158 Ų | 158 | 123 Ų | 123 | 83% | 0.827 | 81% | 0.811 | S | S | * | * | 47.4 | 111.6 | 113.5 | -70.5 | 179.8 | 0 | 0 | 0 | 119.9 | |||||
| 177 | N | 36.7 | Very low | 36.4 | Very low | 137 Ų | 137 | 120.2 Ų | 120.2 | 73% | 0.733 | 82% | 0.816 | S | S | * | * | 119.5 | 131.7 | 126.4 | -54.6 | -14.1 | 0 | 0 | 0 | 119.6 | |||||
| 178 | S | 35.7 | Very low | 35.9 | Very low | 111 Ų | 111 | 118.6 Ų | 118.6 | 78% | 0.776 | 81% | 0.814 | S | S | * | * | trans | 99.8 | 83.6 | 146.5 | -56.8 | 0 | 0 | 0 | 0 | 120.3 | ||||
| 179 | S | 36.3 | Very low | 35.4 | Very low | 116 Ų | 116 | 120.3 Ų | 120.3 | 81% | 0.811 | 82% | 0.821 | S | S | * | * | 24.9 | 126.7 | 120 | 59.5 | 0 | 0 | 0 | 0 | 121.9 | |||||
| 180 | A | 34.5 | Very low | 34.8 | Very low | 104 Ų | 104 | 116.4 Ų | 116.4 | 86% | 0.86 | 81% | 0.814 | S | S | * | * | trans | 151.1 | 142.1 | 130.4 | 0 | 0 | 0 | 0 | 0 | 109 | ||||
| 181 | A | 31.8 | Very low | 34.1 | Very low | 99 Ų | 99 | 111 Ų | 111 | 82% | 0.818 | 81% | 0.813 | S | S | * | * | cis | -168.6 | 135.6 | -14.2 | 0 | 0 | 0 | 0 | 0 | 104.8 | ||||
| 182 | A | 36.3 | Very low | 33.7 | Very low | 103 Ų | 103 | 106.8 Ų | 106.8 | 85% | 0.851 | 81% | 0.811 | S | S | * | * | trans | -169.7 | 101.8 | 153.6 | 0 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 183 | S | 35.7 | Very low | 33.6 | Very low | 115 Ų | 115 | 107.3 Ų | 107.3 | 80% | 0.804 | 82% | 0.821 | S | S | * | * | trans | -52.9 | 128.9 | 161.6 | 43.6 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 184 | A | 31.7 | Very low | 32.8 | Very low | 100 Ų | 100 | 105.6 Ų | 105.6 | 83% | 0.826 | 82% | 0.817 | S | S | * | * | 85.6 | 110.9 | 74.5 | 0 | 0 | 0 | 0 | 0 | 114.8 | |||||
| 185 | A | 30.7 | Very low | 32.5 | Very low | 100 Ų | 100 | 106.8 Ų | 106.8 | 83% | 0.826 | 81% | 0.813 | S | S | * | * | trans | 178.9 | 95.6 | 141.8 | 0 | 0 | 0 | 0 | 0 | 106.7 | ||||
| 186 | A | 31.2 | Very low | 32.5 | Very low | 103 Ų | 103 | 108.8 Ų | 108.8 | 85% | 0.851 | 82% | 0.816 | S | S | * | * | 86.3 | 133.8 | 64.8 | 0 | 0 | 0 | 0 | 0 | 114.6 | |||||
| 187 | A | 30.6 | Very low | 32.4 | Very low | 107 Ų | 107 | 105.7 Ų | 105.7 | 88% | 0.884 | 81% | 0.813 | S | S | * | * | trans | 85.6 | 127.4 | 170.2 | 0 | 0 | 0 | 0 | 0 | 117 | ||||
| 188 | A | 30.7 | Very low | 32.8 | Very low | 93 Ų | 93 | 104.6 Ų | 104.6 | 77% | 0.769 | 81% | 0.813 | S | S | * | * | cis | -164.5 | 149.6 | 1.7 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 189 | A | 29.1 | Very low | 32.8 | Very low | 106 Ų | 106 | 104.7 Ų | 104.7 | 88% | 0.876 | 81% | 0.814 | S | S | * | * | trans | 30.5 | 139 | 144.4 | 0 | 0 | 0 | 0 | 0 | 121.1 | ||||
| 190 | A | 30.8 | Very low | 32.9 | Very low | 93 Ų | 93 | 103.5 Ų | 103.5 | 77% | 0.769 | 81% | 0.811 | S | S | * | * | cis | -154.6 | 130.4 | 32.6 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 191 | A | 29.6 | Very low | 33.6 | Very low | 97 Ų | 97 | 104.5 Ų | 104.5 | 80% | 0.802 | 81% | 0.812 | S | S | * | * | 53.2 | 95.8 | 108.1 | 0 | 0 | 0 | 0 | 0 | 115 | |||||
| 192 | A | 28.5 | Very low | 34.5 | Very low | 103 Ų | 103 | 103.2 Ų | 103.2 | 85% | 0.851 | 81% | 0.808 | S | S | * | * | 71.3 | 95.8 | 68.3 | 0 | 0 | 0 | 0 | 0 | 114 | |||||
| 193 | A | 29.4 | Very low | 35.4 | Very low | 112 Ų | 112 | 104.3 Ų | 104.3 | 93% | 0.926 | 81% | 0.807 | S | S | * | * | trans | -84.3 | 126.2 | 157 | 0 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 194 | A | 32.2 | Very low | 36.3 | Very low | 85 Ų | 85 | 103.3 Ų | 103.3 | 70% | 0.702 | 80% | 0.799 | S | S | * | * | trans | -111.2 | 127.1 | 178.7 | 0 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 195 | V | 31.9 | Very low | 37.9 | Very low | 130 Ų | 130 | 104.7 Ų | 104.7 | 79% | 0.788 | 80% | 0.803 | S | S | * | * | trans | 64.6 | 117 | 133.5 | -169.7 | 0 | 0 | 0 | 0 | 115.9 | ||||
| 196 | S | 32.1 | Very low | 38.7 | Very low | 112 Ų | 112 | 103.2 Ų | 103.2 | 78% | 0.783 | 79% | 0.785 | S | S | * | * | -165 | 136.3 | 82.8 | -59.9 | 0 | 0 | 0 | 0 | 112.2 | |||||
| 197 | A | 36 | Very low | 39.9 | Very low | 93 Ų | 93 | 106.5 Ų | 106.5 | 77% | 0.769 | 79% | 0.788 | S | S | * | * | trans | -80.1 | 167.2 | 156.5 | 0 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 198 | P | 44.9 | Very low | 41 | Very low | 114 Ų | 114 | 106.7 Ų | 106.7 | 74% | 0.74 | 78% | 0.783 | S | S | * | * | -152.2 | 172.5 | 51 | 42.5 | -20.7 | 0 | 0 | 0 | 118.2 | |||||
| 199 | S | 34.2 | Very low | 42 | Very low | 113 Ų | 113 | 105.1 Ų | 105.1 | 79% | 0.79 | 77% | 0.765 | S | S | * | * | trans | 82.1 | 123.6 | 146.2 | -54.1 | 0 | 0 | 0 | 0 | 122.2 | ||||
| 200 | A | 38.4 | Very low | 42.8 | Very low | 91 Ų | 91 | 108.4 Ų | 108.4 | 75% | 0.752 | 76% | 0.762 | S | S | * | * | trans | 89.2 | 121 | 137.1 | 0 | 0 | 0 | 0 | 0 | 120.9 | ||||
| 201 | S | 49.9 | Very low | 43.5 | Very low | 126 Ų | 126 | 109.6 Ų | 109.6 | 88% | 0.881 | 77% | 0.765 | S | S | * | * | trans | 57.5 | 93.9 | 152.2 | 58.6 | 0 | 0 | 0 | 0 | 118.6 | ||||
| 202 | G | 49.6 | Very low | 44.7 | Very low | 71 Ų | 71 | 110.7 Ų | 110.7 | 73% | 0.732 | 77% | 0.766 | S | S | * | * | trans | -122.1 | 142.9 | 164.2 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 203 | P | 55.1 | Low | 45.6 | Very low | 127 Ų | 127 | 110.6 Ų | 110.6 | 83% | 0.825 | 76% | 0.76 | S | S | * | * | trans | -76.3 | 159.1 | -173.3 | 31.1 | -34.6 | 0 | 0 | 0 | 113.9 | ||||
| 204 | C | 54.9 | Low | 46.3 | Very low | 93 Ų | 93 | 115.1 Ų | 115.1 | 63% | 0.628 | 76% | 0.761 | S | S | * | * | trans | -54.2 | 136.9 | -175.1 | 53.6 | 0 | 0 | 0 | 0 | 115 | C209 | C204-C209 VanDerWaalsContact SG-SG 3.7Š| ||
| 205 | S | 65 | Low | 46.8 | Very low | 130 Ų | 130 | 115.7 Ų | 115.7 | 91% | 0.909 | 77% | 0.766 | S | S | * | * | trans | -101.6 | 62.9 | 174.9 | -67.2 | 0 | 0 | 0 | 0 | 112 | ||||
| 206 | C | 48.5 | Very low | 47.1 | Very low | 68 Ų | 68 | 114 Ų | 114 | 46% | 0.459 | 77% | 0.766 | S | S | . | * | trans | -113.6 | 140.9 | 165.2 | 60.7 | 0 | 0 | 0 | 0 | 110.1 | S208 C209 | C206-S208 PolarHBondContact O-N 2.98Å; C206-C209 PolarHBondContact O-N 3.39Å; C206-C209 VanDerWaalsContact SG-SG 3.65Å | ||
| 207 | L | 57.2 | Low | 47.3 | Very low | 173 Ų | 173 | 114.6 Ų | 114.6 | 91% | 0.906 | 77% | 0.77 | S | S | * | * | G | 310 helix | trans | -63.2 | -0.9 | -175.1 | -86.2 | 90.5 | 0 | 0 | 0 | 114.7 | ||
| 208 | S | 51.9 | Low | 47.3 | Very low | 111 Ų | 111 | 115.2 Ų | 115.2 | 78% | 0.776 | 78% | 0.775 | S | S | * | * | G | 310 helix | trans | -82.2 | -9.2 | 176.3 | -61.1 | 0 | 0 | 0 | 0 | 114.2 | C206 | C206-S208 PolarHBondContact O-N 2.98Š|
| 209 | C | 52.8 | Low | 46.9 | Very low | 59 Ų | 59 | 118.8 Ų | 118.8 | 40% | 0.399 | 79% | 0.787 | S | S | . | * | G | 310 helix | trans | -95.5 | -4 | -175.5 | -49.5 | 0 | 0 | 0 | 0 | 114.3 | C204 C206 | C204-C209 VanDerWaalsContact SG-SG 3.7Å; C206-C209 PolarHBondContact O-N 3.39Å; C206-C209 VanDerWaalsContact SG-SG 3.65Å |
| 210 | H | 45.5 | Very low | 47 | Very low | 176 Ų | 176 | 117.1 Ų | 117.1 | 82% | 0.815 | 79% | 0.788 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92.7 | 8.7 | -170.6 | -110.1 | 88.7 | 0 | 0 | 0 | 115.4 | ||
| 211 | S | 46.5 | Very low | 46.8 | Very low | 118 Ų | 118 | 117.9 Ų | 117.9 | 83% | 0.825 | 79% | 0.788 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -106 | 3 | -179.2 | -78.6 | 0 | 0 | 0 | 0 | 115.9 | ||
| 212 | S | 54.2 | Low | 46.1 | Very low | 119 Ų | 119 | 123 Ų | 123 | 83% | 0.832 | 79% | 0.787 | S | S | * | * | S | Bend | trans | -130.7 | 22.8 | -171 | -52.1 | 0 | 0 | 0 | 0 | 116 | ||
| 213 | S | 48 | Very low | 45.3 | Very low | 102 Ų | 102 | 125.2 Ų | 125.2 | 71% | 0.713 | 79% | 0.792 | S | S | * | * | trans | -148.5 | 68 | 179.8 | 37.6 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 214 | Q | 43.5 | Very low | 44.6 | Very low | 206 Ų | 206 | 124.1 Ų | 124.1 | 96% | 0.963 | 79% | 0.794 | S | S | * | * | trans | -128.4 | 87.7 | 151.1 | -91.4 | -177 | 73.2 | 0 | 0 | 108.7 | ||||
| 215 | A | 41.8 | Very low | 43.7 | Very low | 97 Ų | 97 | 123.4 Ų | 123.4 | 80% | 0.802 | 80% | 0.802 | S | S | * | * | trans | -147.8 | 136.4 | 157.7 | 0 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 216 | A | 38.4 | Very low | 42.5 | Very low | 94 Ų | 94 | 121.6 Ų | 121.6 | 78% | 0.777 | 80% | 0.795 | S | S | * | * | trans | 81.6 | 97 | 174 | 0 | 0 | 0 | 0 | 0 | 117.3 | ||||
| 217 | S | 36.5 | Very low | 42.4 | Very low | 126 Ų | 126 | 125.1 Ų | 125.1 | 88% | 0.881 | 81% | 0.809 | S | S | * | * | 171.1 | 106.9 | 104.9 | -70.6 | 0 | 0 | 0 | 0 | 110.2 | |||||
| 218 | A | 36.3 | Very low | 41.3 | Very low | 105 Ų | 105 | 126.4 Ų | 126.4 | 87% | 0.868 | 81% | 0.808 | S | S | * | * | trans | -146.3 | 104.6 | 160.8 | 0 | 0 | 0 | 0 | 0 | 109 | ||||
| 219 | L | 37.2 | Very low | 40.8 | Very low | 189 Ų | 189 | 127.4 Ų | 127.4 | 99% | 0.99 | 81% | 0.81 | S | S | * | * | trans | -77.7 | 126.7 | 161.5 | -122.2 | 83.8 | 0 | 0 | 0 | 107.4 | ||||
| 220 | G | 34.9 | Very low | 39.8 | Very low | 79 Ų | 79 | 130.7 Ų | 130.7 | 81% | 0.814 | 83% | 0.831 | S | S | * | * | trans | 179.7 | 117.6 | 175 | 0 | 0 | 0 | 0 | 0 | 112 | ||||
| 221 | S | 35.7 | Very low | 39.3 | Very low | 107 Ų | 107 | 129 Ų | 129 | 75% | 0.748 | 83% | 0.834 | S | S | * | * | trans | -77.8 | 148.2 | -163.7 | -174.3 | 0 | 0 | 0 | 0 | 115.8 | ||||
| 222 | R | 34.2 | Very low | 38.9 | Very low | 232 Ų | 232 | 127.7 Ų | 127.7 | 88% | 0.875 | 83% | 0.83 | S | S | * | * | trans | 91.4 | 106 | 146.4 | -84.3 | 165.2 | 161.7 | -130.9 | -10.2 | 123.1 | ||||
| 223 | S | 33.6 | Very low | 38 | Very low | 119 Ų | 119 | 127.6 Ų | 127.6 | 83% | 0.832 | 83% | 0.829 | S | S | * | * | 99.4 | 126.6 | 113.9 | -148.9 | 0 | 0 | 0 | 0 | 121.7 | |||||
| 224 | A | 39.1 | Very low | 37.5 | Very low | 104 Ų | 104 | 128.8 Ų | 128.8 | 86% | 0.86 | 83% | 0.833 | S | S | * | * | trans | 89.5 | 116.1 | 152.4 | 0 | 0 | 0 | 0 | 0 | 120.5 | ||||
| 225 | G | 36.5 | Very low | 37.1 | Very low | 77 Ų | 77 | 126.6 Ų | 126.6 | 79% | 0.794 | 82% | 0.823 | S | S | * | * | trans | 127.4 | 96 | 137.5 | 0 | 0 | 0 | 0 | 0 | 119.1 | ||||
| 226 | A | 40.4 | Very low | 36.7 | Very low | 92 Ų | 92 | 132 Ų | 132 | 76% | 0.76 | 82% | 0.822 | S | S | * | * | trans | 64.2 | 107.1 | 143.9 | 0 | 0 | 0 | 0 | 0 | 122.4 | ||||
| 227 | D | 47 | Very low | 36.6 | Very low | 142 Ų | 142 | 131 Ų | 131 | 76% | 0.759 | 81% | 0.81 | S | S | * | * | 34 | 120.2 | 125.2 | -47.3 | -41.5 | 0 | 0 | 0 | 121.4 | |||||
| 228 | F | 33.9 | Very low | 36.6 | Very low | 200 Ų | 200 | 133 Ų | 133 | 88% | 0.877 | 81% | 0.805 | S | S | * | * | 177.3 | 146.3 | 99.2 | -107.5 | -88.4 | 0 | 0 | 0 | 112 | |||||
| 229 | T | 40.8 | Very low | 36.9 | Very low | 133 Ų | 133 | 132.9 Ų | 132.9 | 82% | 0.816 | 80% | 0.798 | S | S | * | * | trans | -74.3 | 143.9 | -167.1 | 20.8 | 0 | 0 | 0 | 0 | 115.7 | ||||
| 230 | C | 31.7 | Very low | 37 | Very low | 127 Ų | 127 | 129.7 Ų | 129.7 | 86% | 0.858 | 79% | 0.791 | S | S | * | * | trans | -123.1 | 112.2 | 160.4 | -176.9 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 231 | T | 35.3 | Very low | 37.3 | Very low | 140 Ų | 140 | 135.9 Ų | 135.9 | 86% | 0.859 | 80% | 0.796 | S | S | * | * | trans | -63.8 | 132 | 172 | 29.3 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 232 | A | 38.1 | Very low | 38 | Very low | 92 Ų | 92 | 138.5 Ų | 138.5 | 76% | 0.76 | 80% | 0.801 | S | S | * | * | trans | -116 | 133.8 | 165.2 | 0 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 233 | S | 35.1 | Very low | 39.3 | Very low | 116 Ų | 116 | 132.7 Ų | 132.7 | 81% | 0.811 | 79% | 0.793 | S | S | * | * | trans | -154.5 | 127.9 | 161 | -85 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 234 | T | 37.7 | Very low | 39.5 | Very low | 128 Ų | 128 | 137.4 Ų | 137.4 | 79% | 0.785 | 79% | 0.794 | S | S | * | * | trans | 88.1 | 94.6 | 149.4 | -36.7 | 0 | 0 | 0 | 0 | 116.5 | ||||
| 235 | Q | 35.2 | Very low | 39.7 | Very low | 160 Ų | 160 | 136.9 Ų | 136.9 | 75% | 0.748 | 78% | 0.784 | S | S | * | * | 78.4 | 132.1 | 76.3 | -92.4 | -153.7 | 17.6 | 0 | 0 | 116.7 | |||||
| 236 | R | 33.7 | Very low | 40.1 | Very low | 211 Ų | 211 | 138 Ų | 138 | 80% | 0.796 | 79% | 0.786 | S | S | * | * | trans | 69.6 | 146.1 | 148.9 | -75.4 | -175.3 | 149.5 | -112.2 | 0.3 | 117.3 | ||||
| 237 | S | 35.6 | Very low | 40.2 | Very low | 73 Ų | 73 | 138.6 Ų | 138.6 | 51% | 0.51 | 79% | 0.791 | S | S | . | * | cis | -175.4 | 146.7 | -10 | -96 | 0 | 0 | 0 | 0 | 105.9 | ||||
| 238 | E | 36.3 | Very low | 40.1 | Very low | 166 Ų | 166 | 137.9 Ų | 137.9 | 78% | 0.776 | 79% | 0.791 | S | S | * | * | trans | 56 | 108.9 | 139.6 | -62.2 | -169.5 | 115.6 | 0 | 0 | 119.4 | ||||
| 239 | S | 42.1 | Very low | 40.5 | Very low | 103 Ų | 103 | 136.1 Ų | 136.1 | 72% | 0.72 | 79% | 0.79 | S | S | * | * | 76.4 | 110.1 | 89.9 | 88.4 | 0 | 0 | 0 | 0 | 113.8 | |||||
| 240 | S | 40.1 | Very low | 40.4 | Very low | 123 Ų | 123 | 134.4 Ų | 134.4 | 86% | 0.86 | 78% | 0.784 | S | S | * | * | trans | -169.3 | 96.4 | 150.5 | -86.8 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 241 | F | 42.2 | Very low | 40.8 | Very low | 209 Ų | 209 | 137.8 Ų | 137.8 | 92% | 0.917 | 78% | 0.784 | S | S | * | * | trans | -75.2 | 125 | 151.4 | -111.4 | -97 | 0 | 0 | 0 | 107 | ||||
| 242 | L | 49.8 | Very low | 41.1 | Very low | 162 Ų | 162 | 137.5 Ų | 137.5 | 85% | 0.848 | 78% | 0.782 | S | S | * | * | trans | -138.3 | 134.6 | 150.5 | -81.8 | -179.3 | 0 | 0 | 0 | 110.8 | ||||
| 243 | P | 60.6 | Low | 41.1 | Very low | 109 Ų | 109 | 138.1 Ų | 138.1 | 71% | 0.708 | 78% | 0.781 | S | S | * | * | trans | -95.7 | 138.8 | 172.4 | 35.7 | -28.1 | 0 | 0 | 0 | 110.7 | ||||
| 244 | Y | 37.6 | Very low | 41.8 | Very low | 219 Ų | 219 | 139 Ų | 139 | 86% | 0.859 | 78% | 0.781 | S | S | * | * | trans | -170.3 | 120.2 | 144.8 | -144 | -112.7 | 0 | 0 | 0 | 113.9 | ||||
| 245 | S | 43.4 | Very low | 42.3 | Very low | 92 Ų | 92 | 138.9 Ų | 138.9 | 64% | 0.643 | 78% | 0.783 | S | S | * | * | trans | 34.7 | 149.3 | 130.6 | -38.6 | 0 | 0 | 0 | 0 | 124.4 | ||||
| 246 | A | 45 | Very low | 42.4 | Very low | 101 Ų | 101 | 136.3 Ų | 136.3 | 84% | 0.835 | 78% | 0.782 | S | S | * | * | trans | -66.4 | 157.9 | -173.6 | 0 | 0 | 0 | 0 | 0 | 117.2 | ||||
| 247 | A | 42.6 | Very low | 43.2 | Very low | 104 Ų | 104 | 131.5 Ų | 131.5 | 86% | 0.86 | 78% | 0.778 | S | S | * | * | trans | -145.4 | 138 | 148.8 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 248 | V | 44.3 | Very low | 43.3 | Very low | 127 Ų | 127 | 134.8 Ų | 134.8 | 77% | 0.77 | 79% | 0.79 | S | S | * | * | trans | -74.6 | 150.7 | 179.6 | 167.7 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 249 | L | 42.3 | Very low | 43.5 | Very low | 164 Ų | 164 | 135.9 Ų | 135.9 | 86% | 0.859 | 80% | 0.795 | S | S | * | * | trans | 161.7 | 146.6 | 140.7 | -104.8 | 82.6 | 0 | 0 | 0 | 106.4 | ||||
| 250 | S | 38.8 | Very low | 43.3 | Very low | 97 Ų | 97 | 141 Ų | 141 | 68% | 0.678 | 80% | 0.799 | S | S | * | * | cis | -179.8 | 126.7 | -20.3 | -96.7 | 0 | 0 | 0 | 0 | 105.5 | ||||
| 251 | K | 41.5 | Very low | 43.4 | Very low | 197 Ų | 197 | 143.9 Ų | 143.9 | 86% | 0.857 | 80% | 0.799 | S | S | * | * | trans | 60.3 | 110.4 | 136.7 | -163.8 | 173.6 | -178 | 179.3 | 0 | 120.4 | ||||
| 252 | T | 40.1 | Very low | 43.4 | Very low | 134 Ų | 134 | 141.5 Ų | 141.5 | 82% | 0.822 | 79% | 0.79 | S | S | * | * | trans | -157 | 97.7 | 134.6 | 35.7 | 0 | 0 | 0 | 0 | 109 | ||||
| 253 | S | 40 | Very low | 43 | Very low | 106 Ų | 106 | 139.3 Ų | 139.3 | 74% | 0.741 | 79% | 0.789 | S | S | * | * | 76.3 | 98 | 110.4 | 73.9 | 0 | 0 | 0 | 0 | 115.9 | |||||
| 254 | V | 49.4 | Very low | 42 | Very low | 135 Ų | 135 | 139.2 Ų | 139.2 | 82% | 0.818 | 79% | 0.79 | S | S | * | * | trans | -69 | 144.7 | 154.9 | 174.7 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 255 | P | 46.8 | Very low | 42.3 | Very low | 125 Ų | 125 | 137 Ų | 137 | 81% | 0.812 | 79% | 0.793 | S | S | * | * | -138.8 | 140.7 | 121.4 | 34.9 | -21.1 | 0 | 0 | 0 | 113.9 | |||||
| 256 | S | 38.1 | Very low | 42.3 | Very low | 106 Ų | 106 | 140.7 Ų | 140.7 | 74% | 0.741 | 81% | 0.805 | S | S | * | * | trans | -156 | 158.1 | 157.6 | -159.2 | 0 | 0 | 0 | 0 | 105.4 | ||||
| 257 | P | 51 | Low | 42.2 | Very low | 110 Ų | 110 | 151 Ų | 151 | 71% | 0.714 | 82% | 0.822 | S | S | * | * | cis | -128.7 | -159.8 | -3 | 33.6 | -11.2 | 0 | 0 | 0 | 111.9 | ||||
| 258 | D | 37.4 | Very low | 42.2 | Very low | 142 Ų | 142 | 153.3 Ų | 153.3 | 76% | 0.759 | 82% | 0.821 | S | S | * | * | trans | 103 | 97.7 | 166.9 | -97.8 | -56.6 | 0 | 0 | 0 | 118.2 | ||||
| 259 | Q | 40.7 | Very low | 42.1 | Very low | 189 Ų | 189 | 154.7 Ų | 154.7 | 88% | 0.883 | 82% | 0.823 | S | S | * | * | -166.3 | 100.4 | 122.6 | -102.7 | 173.2 | 55.9 | 0 | 0 | 111.4 | |||||
| 260 | R | 37.1 | Very low | 42.1 | Very low | 211 Ų | 211 | 154.2 Ų | 154.2 | 80% | 0.796 | 82% | 0.821 | S | S | * | * | 15.7 | 110.9 | 127.5 | -165.6 | 179.5 | -157.7 | 157.4 | 3.9 | 117.5 | |||||
| 261 | E | 42.1 | Very low | 42.3 | Very low | 183 Ų | 183 | 157.5 Ų | 157.5 | 86% | 0.855 | 83% | 0.83 | S | S | * | * | trans | -147.9 | 107.4 | 138.8 | -138 | 178.6 | 128.2 | 0 | 0 | 110.1 | ||||
| 262 | E | 42 | Very low | 42.3 | Very low | 158 Ų | 158 | 155.1 Ų | 155.1 | 74% | 0.738 | 83% | 0.828 | S | S | * | * | trans | -64.3 | 123.9 | 161.7 | -82.5 | 171.9 | 79.8 | 0 | 0 | 108.3 | ||||
| 263 | S | 41.3 | Very low | 42.5 | Very low | 117 Ų | 117 | 156.5 Ų | 156.5 | 82% | 0.818 | 83% | 0.828 | S | S | * | * | trans | -116.2 | 103.9 | 161.5 | 31.6 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 264 | S | 41.3 | Very low | 42.7 | Very low | 106 Ų | 106 | 160.1 Ų | 160.1 | 74% | 0.741 | 84% | 0.835 | S | S | * | * | trans | -61.3 | 150.2 | 177.5 | -61.3 | 0 | 0 | 0 | 0 | 113 | ||||
| 265 | L | 42.2 | Very low | 42.2 | Very low | 174 Ų | 174 | 162 Ų | 162 | 91% | 0.911 | 84% | 0.836 | S | S | * | * | trans | -46.8 | 132.4 | 169.1 | -71.8 | 92.1 | 0 | 0 | 0 | 112.8 | ||||
| 266 | N | 43.4 | Very low | 41.8 | Very low | 169 Ų | 169 | 165.1 Ų | 165.1 | 90% | 0.904 | 84% | 0.838 | S | S | * | * | trans | -158.5 | 99.3 | 140.5 | -140.6 | 8.6 | 0 | 0 | 0 | 110.6 | ||||
| 267 | R | 44.6 | Very low | 42.1 | Very low | 316 Ų | 316 | 170.5 Ų | 170.5 | 100% | 1.192 | 85% | 0.847 | S | S | * | * | 179.8 | 0 | 128.1 | -159.5 | 170.6 | -160.7 | 174.3 | 4.9 | 111 |
Retrieved 267 of 267 residues in 264 ms
(Link to these results)