| 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 | 40 | Very low | 58.2 | Low | 241 Ų | 241 | 191.4 Ų | 191.4 | 100% | 1.187 | 89% | 0.887 | S | S | * | * | 0 | 128.6 | 0 | -105.4 | -178.4 | 177.4 | 0 | 0 | 109 | |||||
| 2 | R | 43.5 | Very low | 58.3 | Low | 239 Ų | 239 | 194.3 Ų | 194.3 | 90% | 0.902 | 88% | 0.884 | S | S | * | * | trans | 61.9 | 99 | 165.4 | -61.7 | -172.8 | -179.3 | -179.1 | 0.9 | 119.7 | ||||
| 3 | I | 49.4 | Very low | 58 | Low | 168 Ų | 168 | 187.4 Ų | 187.4 | 86% | 0.862 | 88% | 0.882 | S | S | * | * | trans | -74.6 | 130.3 | 155.1 | -61.2 | 161.2 | 0 | 0 | 0 | 107.9 | ||||
| 4 | T | 65.5 | Low | 57.7 | Low | 132 Ų | 132 | 184.1 Ų | 184.1 | 81% | 0.81 | 87% | 0.873 | S | S | * | * | trans | -118 | 108.8 | 162.9 | 51.7 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 5 | G | 58 | Low | 57.2 | Low | 67 Ų | 67 | 179.1 Ų | 179.1 | 69% | 0.691 | 87% | 0.866 | S | S | * | * | trans | -67 | 137.9 | -175.4 | 0 | 0 | 0 | 0 | 0 | 113 | T7 | G5-T7 PolarHBondContact O-N 3.49Š| ||
| 6 | K | 68.8 | Low | 57 | Low | 189 Ų | 189 | 178.1 Ų | 178.1 | 82% | 0.822 | 86% | 0.86 | S | S | * | * | trans | -74.5 | 112.7 | 168.9 | -69.8 | 173.2 | 179.8 | 176.9 | 0 | 108.4 | F8 | K6-F8 PolarHBondContact O-N 2.84Š| ||
| 7 | T | 62.3 | Low | 56.6 | Low | 141 Ų | 141 | 170.9 Ų | 170.9 | 87% | 0.865 | 83% | 0.832 | S | S | * | * | trans | -66.3 | 104.3 | 170.5 | 42.9 | 0 | 0 | 0 | 0 | 110 | G5 R9 | G5-T7 PolarHBondContact O-N 3.49Å; T7-R9 PolarHBondContact O-N 3.21Å | ||
| 8 | F | 62.5 | Low | 56.7 | Low | 190 Ų | 190 | 170.6 Ų | 170.6 | 83% | 0.833 | 83% | 0.828 | S | S | * | * | trans | -76.7 | 115.3 | 165 | -76.4 | -83.1 | 0 | 0 | 0 | 109 | K6 R10 | K6-F8 PolarHBondContact O-N 2.84Å; F8-R10 PolarHBondContact O-N 2.74Å | ||
| 9 | R | 68.2 | Low | 56.9 | Low | 250 Ų | 250 | 169.6 Ų | 169.6 | 94% | 0.943 | 82% | 0.822 | S | S | * | * | trans | -64.1 | 100.7 | 171.3 | -138.5 | 179.2 | -161.5 | 169.8 | 3.3 | 107.6 | T7 R11 | T7-R9 PolarHBondContact O-N 3.21Å; R9-R11 PolarHBondContact O-N 3.12Å | ||
| 10 | R | 64.3 | Low | 57.2 | Low | 243 Ų | 243 | 165.1 Ų | 165.1 | 92% | 0.917 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -63.6 | 119.3 | 169.6 | -104.1 | -179.5 | 163.6 | 156.2 | -4.7 | 108.2 | F8 | F8-R10 PolarHBondContact O-N 2.74Š|
| 11 | R | 57.4 | Low | 57.8 | Low | 245 Ų | 245 | 162.6 Ų | 162.6 | 93% | 0.925 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -61.7 | 136.8 | 166.6 | -77.5 | -177.6 | -166 | 146 | 3.3 | 108.5 | R9 | R9-R11 PolarHBondContact O-N 3.12Š|
| 12 | R | 60.3 | Low | 59.4 | Low | 227 Ų | 227 | 157.7 Ų | 157.7 | 86% | 0.857 | 76% | 0.764 | S | S | * | * | P | Polyproline II helix | trans | -65.2 | 137 | 165.7 | -72.7 | -173.2 | 176.2 | -174.3 | -1.3 | 107.8 | D14 | R12-D14 PolarHBondContact O-N 2.95Š|
| 13 | A | 53.8 | Low | 61 | Low | 104 Ų | 104 | 152.3 Ų | 152.3 | 86% | 0.86 | 75% | 0.748 | S | S | * | * | trans | -74.1 | 99.6 | 161.5 | 0 | 0 | 0 | 0 | 0 | 105.6 | ||||
| 14 | D | 53.6 | Low | 62.6 | Low | 141 Ų | 141 | 146.8 Ų | 146.8 | 75% | 0.754 | 73% | 0.725 | S | S | * | * | trans | -73.4 | 138.8 | 163.1 | -91.3 | -34.9 | 0 | 0 | 0 | 107.9 | R12 E16 | R12-D14 PolarHBondContact O-N 2.95Å; D14-E16 PolarHBondContact O-N 3.09Å | ||
| 15 | S | 50.3 | Low | 63.6 | Low | 109 Ų | 109 | 145 Ų | 145 | 76% | 0.762 | 71% | 0.707 | S | S | * | * | trans | -60.2 | 117.8 | -177.8 | -177.4 | 0 | 0 | 0 | 0 | 109.5 | S17 | S15-S17 PolarHBondContact O-N 2.98Š| ||
| 16 | E | 54 | Low | 65 | Low | 164 Ų | 164 | 146.8 Ų | 146.8 | 77% | 0.766 | 70% | 0.698 | S | S | * | * | trans | -50.2 | 100.3 | 169.7 | -84 | 160.9 | 158.9 | 0 | 0 | 109.4 | D14 | D14-E16 PolarHBondContact O-N 3.09Š| ||
| 17 | S | 50 | Low | 66 | Low | 55 Ų | 55 | 141.2 Ų | 141.2 | 39% | 0.385 | 68% | 0.679 | S | S | . | * | trans | -81.9 | 139.9 | 156.2 | -178.3 | 0 | 0 | 0 | 0 | 106.5 | S15 E19 D20 | S15-S17 PolarHBondContact O-N 2.98Å; S17-E19 PolarHBondContact O-N 3.25Å; S17-D20 PolarHBondContact N-OD2 2.97Å; S17-D20 WeakPolarHBondContact O-CB 3.22Å; S17-D20 PolarHBondContact O-N 3.33Å | ||
| 18 | E | 59.7 | Low | 67.3 | Low | 165 Ų | 165 | 141.6 Ų | 141.6 | 77% | 0.771 | 67% | 0.665 | S | S | * | * | H | α-helix | trans | -56.4 | -16.7 | 176.9 | -66.7 | -178.3 | 167.2 | 0 | 0 | 112.8 | ||
| 19 | E | 59.8 | Low | 68.7 | Low | 152 Ų | 152 | 137.2 Ų | 137.2 | 71% | 0.71 | 65% | 0.65 | S | S | * | * | H | α-helix | trans | -69.8 | -32 | 171.5 | -64.5 | -178.4 | 167.2 | 0 | 0 | 113 | S17 Q22 E23 | S17-E19 PolarHBondContact O-N 3.25Å; E19-Q22 PolarHBondContact O-N 3.35Å; E19-E23 PolarHBondContact O-N 3.12Å |
| 20 | D | 62.1 | Low | 69.9 | Low | 79 Ų | 79 | 130.6 Ų | 130.6 | 42% | 0.422 | 63% | 0.628 | S | S | . | * | H | α-helix | trans | -71.5 | -31.9 | 179.2 | -65.7 | -48.3 | 0 | 0 | 0 | 111.9 | S17 S24 | S17-D20 PolarHBondContact N-OD2 2.97Å; S17-D20 WeakPolarHBondContact O-CB 3.22Å; S17-D20 PolarHBondContact O-N 3.33Å; D20-S24 VanDerWaalsContact O-CB 3.29Å; D20-S24 WeakPolarHBondContact O-CB 3.27Å; D20-S24 PolarHBondContact O-N 3.49Å |
| 21 | E | 70.2 | Confident | 71.3 | Confident | 113 Ų | 113 | 124.4 Ų | 124.4 | 53% | 0.528 | 61% | 0.612 | S | S | . | * | H | α-helix | trans | -66.3 | -42.1 | 176.6 | -74.5 | -169.2 | 169.6 | 0 | 0 | 111.2 | S24 E25 | E21-S24 PolarHBondContact O-N 2.94Å; E21-S24 PolarHBondContact O-OG 2.8Å; E21-E25 PolarHBondContact O-N 3.37Å |
| 22 | Q | 74.1 | Confident | 73 | Confident | 139 Ų | 139 | 118.4 Ų | 118.4 | 65% | 0.65 | 60% | 0.595 | S | S | * | * | H | α-helix | trans | -65.2 | -43.7 | 176.7 | -66.4 | -177.7 | 4.4 | 0 | 0 | 111.5 | E19 S24 E25 E26 | E19-Q22 PolarHBondContact O-N 3.35Å; Q22-S24 VanDerWaalsContact C-N 3.26Å; Q22-S24 PolarHBondContact O-N 3.12Å; Q22-E25 PolarHBondContact O-N 3.26Å; Q22-E26 PolarHBondContact O-N 3.48Å |
| 23 | E | 77.7 | Confident | 74.5 | Confident | 125 Ų | 125 | 113.4 Ų | 113.4 | 58% | 0.584 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -63.1 | -35.4 | 175 | -167.5 | 173.1 | -172.6 | 0 | 0 | 111.2 | E19 E26 V27 | E19-E23 PolarHBondContact O-N 3.12Å; E23-E26 PolarHBondContact O-N 3.03Å; E23-V27 WeakPolarHBondContact O-CB 3.45Å; E23-V27 WeakPolarHBondContact O-CG2 3.15Å; E23-V27 PolarHBondContact O-N 3.46Å |
| 24 | S | 83 | Confident | 76.4 | Confident | 52 Ų | 52 | 111.8 Ų | 111.8 | 36% | 0.364 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -67 | -39.4 | 177.8 | 82.3 | 0 | 0 | 0 | 0 | 113.4 | D20 E21 Q22 V27 R28 | D20-S24 VanDerWaalsContact O-CB 3.29Å; D20-S24 WeakPolarHBondContact O-CB 3.27Å; D20-S24 PolarHBondContact O-N 3.49Å; E21-S24 PolarHBondContact O-N 2.94Å; E21-S24 PolarHBondContact O-OG 2.8Å; Q22-S24 VanDerWaalsContact C-N 3.26Å; Q22-S24 PolarHBondContact O-N 3.12Å; S24-V27 PolarHBondContact O-N 3.47Å; S24-R28 WeakPolarHBondContact O-CG 3.32Å; S24-R28 PolarHBondContact O-N 3.31Å |
| 25 | E | 85.8 | Confident | 78.3 | Confident | 94 Ų | 94 | 113.4 Ų | 113.4 | 44% | 0.439 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -71 | -40.5 | 176 | -72.3 | -63.5 | 132.5 | 0 | 0 | 111 | E21 Q22 V27 R28 L29 | E21-E25 PolarHBondContact O-N 3.37Å; Q22-E25 PolarHBondContact O-N 3.26Å; E25-V27 VanDerWaalsContact C-N 3.32Å; E25-V27 PolarHBondContact O-N 2.87Å; E25-R28 PolarHBondContact O-N 3.41Å; E25-R28 IonicContact OE1-CZ 2.87Å; E25-R28 IonicContact OE1-NH1 3.57Å; E25-R28 PolarHBondContact OE1-NH1 2.86Å; E25-L29 WeakPolarHBondContact O-CG 3.36Å; E25-L29 PolarHBondContact O-N 3.27Å |
| 26 | E | 86.7 | Confident | 80.3 | Confident | 106 Ų | 106 | 114.3 Ų | 114.3 | 50% | 0.495 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -60.1 | -40.5 | 172.1 | -76.8 | -166.8 | -163.6 | 0 | 0 | 112.9 | Q22 E23 K30 | Q22-E26 PolarHBondContact O-N 3.48Å; E23-E26 PolarHBondContact O-N 3.03Å; E26-K30 WeakPolarHBondContact O-CB 3.38Å; E26-K30 VanDerWaalsContact O-CG 3.3Å; E26-K30 WeakPolarHBondContact O-CG 3.14Å; E26-K30 PolarHBondContact O-N 3.19Å; E26-K30 IonicContact OE2-NZ 3.5Å; E26-K30 PolarHBondContact OE2-NZ 2.84Å |
| 27 | V | 90 | Very high | 82.1 | Confident | 72 Ų | 72 | 109.9 Ų | 109.9 | 44% | 0.436 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -68 | -37.9 | 177.6 | 169.6 | 0 | 0 | 0 | 0 | 111.1 | E23 S24 E25 L31 | E23-V27 WeakPolarHBondContact O-CB 3.45Å; E23-V27 WeakPolarHBondContact O-CG2 3.15Å; E23-V27 PolarHBondContact O-N 3.46Å; S24-V27 PolarHBondContact O-N 3.47Å; E25-V27 VanDerWaalsContact C-N 3.32Å; E25-V27 PolarHBondContact O-N 2.87Å; V27-L31 HydrophobicContact CG1-CD1 4.38Å; V27-L31 WeakPolarHBondContact O-CB 3.49Å; V27-L31 PolarHBondContact O-N 3.39Å |
| 28 | R | 90.8 | Very high | 84 | Confident | 148 Ų | 148 | 113 Ų | 113 | 56% | 0.558 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -63.5 | -47.2 | 173.7 | -78.6 | 176.5 | 173.8 | 170.9 | -0.4 | 111.7 | S24 E25 K30 L31 E32 | S24-R28 WeakPolarHBondContact O-CG 3.32Å; S24-R28 PolarHBondContact O-N 3.31Å; E25-R28 PolarHBondContact O-N 3.41Å; E25-R28 IonicContact OE1-CZ 2.87Å; E25-R28 IonicContact OE1-NH1 3.57Å; E25-R28 PolarHBondContact OE1-NH1 2.86Å; R28-K30 PolarHBondContact O-N 2.92Å; R28-L31 WeakPolarHBondContact O-CB 3.26Å; R28-L31 PolarHBondContact O-N 3.4Å; R28-L31 VanDerWaalsContact O-N 3.11Å; R28-E32 WeakPolarHBondContact O-CG 3.27Å; R28-E32 PolarHBondContact O-N 3.4Å |
| 29 | L | 91.5 | Very high | 85.5 | Confident | 98 Ų | 98 | 108.8 Ų | 108.8 | 51% | 0.513 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -58.8 | -47.2 | 176.9 | -71 | 170.6 | 0 | 0 | 0 | 111.4 | E25 L31 E32 E33 | E25-L29 WeakPolarHBondContact O-CG 3.36Å; E25-L29 PolarHBondContact O-N 3.27Å; L29-L31 VanDerWaalsContact C-N 3.3Å; L29-L31 PolarHBondContact O-N 3.44Å; L29-E32 PolarHBondContact O-N 3.26Å; L29-E33 WeakPolarHBondContact O-CG 3.25Å; L29-E33 PolarHBondContact O-N 3.11Å |
| 30 | K | 92.6 | Very high | 86.9 | Confident | 111 Ų | 111 | 108.8 Ų | 108.8 | 48% | 0.483 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -60.6 | -36.9 | 175.1 | -72.6 | 165.4 | -175.3 | 151.1 | 0 | 112.3 | E26 R28 T34 | E26-K30 WeakPolarHBondContact O-CB 3.38Å; E26-K30 VanDerWaalsContact O-CG 3.3Å; E26-K30 WeakPolarHBondContact O-CG 3.14Å; E26-K30 PolarHBondContact O-N 3.19Å; E26-K30 IonicContact OE2-NZ 3.5Å; E26-K30 PolarHBondContact OE2-NZ 2.84Å; R28-K30 PolarHBondContact O-N 2.92Å; K30-T34 WeakPolarHBondContact O-CG2 3.46Å; K30-T34 PolarHBondContact O-N 3.41Å; K30-T34 PolarHBondContact O-OG1 3.34Å; K30-T34 VanDerWaalsContact O-OG1 3.11Å |
| 31 | L | 93.7 | Very high | 88.2 | Confident | 113 Ų | 113 | 114.3 Ų | 114.3 | 59% | 0.592 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -68.2 | -39.9 | 175.1 | -95.4 | 166.4 | 0 | 0 | 0 | 112.5 | V27 R28 L29 T34 R35 | V27-L31 HydrophobicContact CG1-CD1 4.38Å; V27-L31 WeakPolarHBondContact O-CB 3.49Å; V27-L31 PolarHBondContact O-N 3.39Å; R28-L31 WeakPolarHBondContact O-CB 3.26Å; R28-L31 PolarHBondContact O-N 3.4Å; R28-L31 VanDerWaalsContact O-N 3.11Å; L29-L31 VanDerWaalsContact C-N 3.3Å; L29-L31 PolarHBondContact O-N 3.44Å; L31-T34 WeakPolarHBondContact CA-OG1 3.4Å; L31-T34 PolarHBondContact O-OG1 2.8Å; L31-R35 WeakPolarHBondContact O-CB 3.47Å; L31-R35 PolarHBondContact O-N 2.89Å |
| 32 | E | 93.1 | Very high | 89 | Confident | 119 Ų | 119 | 115.7 Ų | 115.7 | 56% | 0.556 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -66.1 | -47.1 | 175.8 | -72.5 | -179 | 175.5 | 0 | 0 | 111.2 | R28 L29 T34 R35 E36 | R28-E32 WeakPolarHBondContact O-CG 3.27Å; R28-E32 PolarHBondContact O-N 3.4Å; L29-E32 PolarHBondContact O-N 3.26Å; E32-T34 VanDerWaalsContact C-N 3.34Å; E32-T34 PolarHBondContact O-N 3.18Å; E32-R35 WeakPolarHBondContact O-CB 3.31Å; E32-R35 PolarHBondContact O-N 3.01Å; E32-R35 VanDerWaalsContact O-N 3.09Å; E32-E36 WeakPolarHBondContact O-CG 3.27Å; E32-E36 PolarHBondContact O-N 2.9Å |
| 33 | E | 92.8 | Very high | 89.5 | Confident | 123 Ų | 123 | 119.6 Ų | 119.6 | 58% | 0.575 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -55.6 | -46.2 | 174 | -73.9 | 178.4 | 178 | 0 | 0 | 111.8 | L29 R35 E36 V37 | L29-E33 WeakPolarHBondContact O-CG 3.25Å; L29-E33 PolarHBondContact O-N 3.11Å; E33-R35 VanDerWaalsContact C-N 3.33Å; E33-R35 PolarHBondContact O-N 2.86Å; E33-E36 PolarHBondContact O-N 3.37Å; E33-V37 WeakPolarHBondContact O-CG2 3.36Å; E33-V37 PolarHBondContact O-N 3.15Å |
| 34 | T | 92.8 | Very high | 89.6 | Confident | 70 Ų | 70 | 119.6 Ų | 119.6 | 43% | 0.429 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -66.7 | -33.9 | 178.3 | 57.1 | 0 | 0 | 0 | 0 | 112.7 | K30 L31 E32 V37 Q38 | K30-T34 WeakPolarHBondContact O-CG2 3.46Å; K30-T34 PolarHBondContact O-N 3.41Å; K30-T34 PolarHBondContact O-OG1 3.34Å; K30-T34 VanDerWaalsContact O-OG1 3.11Å; L31-T34 WeakPolarHBondContact CA-OG1 3.4Å; L31-T34 PolarHBondContact O-OG1 2.8Å; E32-T34 VanDerWaalsContact C-N 3.34Å; E32-T34 PolarHBondContact O-N 3.18Å; T34-V37 PolarHBondContact O-N 3.34Å; T34-Q38 WeakPolarHBondContact O-CG 3.46Å; T34-Q38 PolarHBondContact O-N 3Å |
| 35 | R | 93.5 | Very high | 89.4 | Confident | 174 Ų | 174 | 123.7 Ų | 123.7 | 66% | 0.657 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -68.9 | -37.8 | 175.9 | -168.3 | 178.5 | -176.7 | -176.2 | -0.5 | 111.6 | L31 E32 E33 Q38 N39 | L31-R35 WeakPolarHBondContact O-CB 3.47Å; L31-R35 PolarHBondContact O-N 2.89Å; E32-R35 WeakPolarHBondContact O-CB 3.31Å; E32-R35 PolarHBondContact O-N 3.01Å; E32-R35 VanDerWaalsContact O-N 3.09Å; E33-R35 VanDerWaalsContact C-N 3.33Å; E33-R35 PolarHBondContact O-N 2.86Å; R35-Q38 PolarHBondContact O-N 3.42Å; R35-N39 PolarHBondContact O-N 3.43Å; R35-N39 PolarHBondContact O-ND2 3.48Å |
| 36 | E | 91.8 | Very high | 89.1 | Confident | 129 Ų | 129 | 122.1 Ų | 122.1 | 60% | 0.603 | 59% | 0.593 | S | S | * | * | H | α-helix | trans | -64 | -45.5 | 173.1 | -71.9 | -175 | 174.5 | 0 | 0 | 111.8 | E32 E33 Q38 N39 L40 | E32-E36 WeakPolarHBondContact O-CG 3.27Å; E32-E36 PolarHBondContact O-N 2.9Å; E33-E36 PolarHBondContact O-N 3.37Å; E36-Q38 VanDerWaalsContact C-N 3.29Å; E36-Q38 PolarHBondContact O-N 3.33Å; E36-N39 PolarHBondContact O-N 3.08Å; E36-N39 VanDerWaalsContact O-N 3.11Å; E36-L40 WeakPolarHBondContact O-CG 3.28Å; E36-L40 PolarHBondContact O-N 2.72Å |
| 37 | V | 92 | Very high | 88.5 | Confident | 70 Ų | 70 | 121.9 Ų | 121.9 | 42% | 0.424 | 60% | 0.599 | S | S | . | * | H | α-helix | trans | -60.3 | -38.6 | 174.5 | 174.1 | 0 | 0 | 0 | 0 | 111.6 | E33 T34 L40 R41 | E33-V37 WeakPolarHBondContact O-CG2 3.36Å; E33-V37 PolarHBondContact O-N 3.15Å; T34-V37 PolarHBondContact O-N 3.34Å; V37-L40 PolarHBondContact O-N 3.22Å; V37-R41 WeakPolarHBondContact O-CG 3.47Å; V37-R41 PolarHBondContact O-N 3.02Å |
| 38 | Q | 91.1 | Very high | 87.9 | Confident | 120 Ų | 120 | 120.3 Ų | 120.3 | 56% | 0.561 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -66.1 | -40.4 | 174.2 | -74.7 | 178.9 | 25.8 | 0 | 0 | 112.4 | T34 R35 E36 R41 K42 | T34-Q38 WeakPolarHBondContact O-CG 3.46Å; T34-Q38 PolarHBondContact O-N 3Å; R35-Q38 PolarHBondContact O-N 3.42Å; E36-Q38 VanDerWaalsContact C-N 3.29Å; E36-Q38 PolarHBondContact O-N 3.33Å; Q38-R41 PolarHBondContact O-N 3.37Å; Q38-K42 PolarHBondContact O-N 3.47Å |
| 39 | N | 90.1 | Very high | 87.2 | Confident | 78 Ų | 78 | 117.2 Ų | 117.2 | 42% | 0.417 | 60% | 0.597 | S | S | . | * | H | α-helix | trans | -64.7 | -39 | 176.6 | -74.1 | -24.5 | 0 | 0 | 0 | 111.9 | R35 E36 R41 K42 | R35-N39 PolarHBondContact O-N 3.43Å; R35-N39 PolarHBondContact O-ND2 3.48Å; E36-N39 PolarHBondContact O-N 3.08Å; E36-N39 VanDerWaalsContact O-N 3.11Å; N39-R41 PolarHBondContact O-N 2.93Å; N39-K42 WeakPolarHBondContact O-CB 3.41Å; N39-K42 PolarHBondContact O-N 2.65Å; N39-K42 VanDerWaalsContact O-N 3.15Å; N39-K42 PolarHBondContact OD1-NZ 2.7Å |
| 40 | L | 88.7 | Confident | 86.5 | Confident | 151 Ų | 151 | 115.2 Ų | 115.2 | 79% | 0.791 | 59% | 0.594 | S | S | * | * | H | α-helix | trans | -63.9 | -26.2 | 173.7 | -71.3 | 167.3 | 0 | 0 | 0 | 113.1 | E36 V37 | E36-L40 WeakPolarHBondContact O-CG 3.28Å; E36-L40 PolarHBondContact O-N 2.72Å; V37-L40 PolarHBondContact O-N 3.22Å |
| 41 | R | 89.8 | Confident | 85.8 | Confident | 196 Ų | 196 | 110.5 Ų | 110.5 | 74% | 0.74 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -81.9 | -18.3 | 175.2 | -70.6 | 174.9 | -176.7 | -170 | 2.4 | 113.7 | V37 Q38 N39 R43 | V37-R41 WeakPolarHBondContact O-CG 3.47Å; V37-R41 PolarHBondContact O-N 3.02Å; Q38-R41 PolarHBondContact O-N 3.37Å; N39-R41 PolarHBondContact O-N 2.93Å; R41-R43 PolarHBondContact O-N 3.06Å |
| 42 | K | 87.1 | Confident | 85 | Confident | 141 Ų | 141 | 111.1 Ų | 111.1 | 61% | 0.613 | 58% | 0.58 | S | S | * | * | S | Bend | trans | -65.7 | 120.5 | 177.8 | -71.9 | 175.3 | -178.5 | 164.7 | 0 | 108.4 | Q38 N39 | Q38-K42 PolarHBondContact O-N 3.47Å; N39-K42 WeakPolarHBondContact O-CB 3.41Å; N39-K42 PolarHBondContact O-N 2.65Å; N39-K42 VanDerWaalsContact O-N 3.15Å; N39-K42 PolarHBondContact OD1-NZ 2.7Å |
| 43 | R | 84.2 | Confident | 84.2 | Confident | 221 Ų | 221 | 112.9 Ų | 112.9 | 83% | 0.834 | 59% | 0.592 | S | S | * | * | P | Polyproline II helix | trans | -67.1 | 138.3 | 173.4 | -58.2 | -179.5 | 78.8 | -172.3 | 3.7 | 107.7 | R41 N45 | R41-R43 PolarHBondContact O-N 3.06Å; R43-N45 PolarHBondContact O-N 3.28Å |
| 44 | P | 81.5 | Confident | 83.7 | Confident | 125 Ų | 125 | 111.4 Ų | 111.4 | 81% | 0.812 | 59% | 0.591 | S | S | * | * | P | Polyproline II helix | trans | -60.4 | 132.7 | 171.6 | 25.7 | -32.6 | 0 | 0 | 0 | 108.8 | G46 | P44-G46 PolarHBondContact O-N 2.85Š|
| 45 | N | 78.8 | Confident | 82.8 | Confident | 139 Ų | 139 | 111.6 Ų | 111.6 | 74% | 0.743 | 61% | 0.607 | S | S | * | * | P | Polyproline II helix | trans | -61.1 | 126 | 170.3 | -71.4 | 1 | 0 | 0 | 0 | 107.6 | R43 | R43-N45 PolarHBondContact O-N 3.28Š|
| 46 | G | 78 | Confident | 82 | Confident | 61 Ų | 61 | 110.1 Ų | 110.1 | 63% | 0.629 | 61% | 0.608 | S | S | * | * | P | Polyproline II helix | trans | -71 | 165.5 | 174.4 | 0 | 0 | 0 | 0 | 0 | 111.2 | P44 | P44-G46 PolarHBondContact O-N 2.85Š|
| 47 | V | 75.7 | Confident | 80.8 | Confident | 101 Ų | 101 | 113.6 Ų | 113.6 | 61% | 0.612 | 62% | 0.621 | S | S | * | * | P | Polyproline II helix | trans | -73.8 | 133.5 | 170.3 | -172.6 | 0 | 0 | 0 | 0 | 108.3 | A51 L52 | V47-A51 HydrophobicContact CG1-CB 3.77Å; V47-L52 HydrophobicContact CB-CD2 4.17Å; V47-L52 HydrophobicContact CB-CG 4.12Å; V47-L52 HydrophobicContact CG1-CD2 3.95Å; V47-L52 HydrophobicContact CG1-CG 3.84Å |
| 48 | S | 76.3 | Confident | 79.3 | Confident | 39 Ų | 39 | 113.8 Ų | 113.8 | 27% | 0.273 | 62% | 0.622 | S | S | . | * | P | Polyproline II helix | trans | -62.9 | 146 | 177.4 | 86 | 0 | 0 | 0 | 0 | 110.6 | A50 A51 L52 | S48-A50 PolarHBondContact O-N 2.86Å; S48-A51 PolarHBondContact O-N 2.89Å; S48-A51 WeakPolarHBondContact OG-CB 3.38Å; S48-A51 PolarHBondContact OG-N 2.81Å; S48-L52 PolarHBondContact O-N 3.34Å |
| 49 | A | 76.7 | Confident | 78 | Confident | 83 Ų | 83 | 115.5 Ų | 115.5 | 69% | 0.686 | 63% | 0.63 | S | S | * | * | H | α-helix | trans | -58.1 | -31.5 | 178.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | L52 L53 | A49-L52 PolarHBondContact O-N 3.05Å; A49-L53 WeakPolarHBondContact O-CB 3.5Å; A49-L53 PolarHBondContact O-N 3.09Å |
| 50 | A | 76.4 | Confident | 76.5 | Confident | 55 Ų | 55 | 117.7 Ų | 117.7 | 46% | 0.455 | 64% | 0.638 | S | S | . | * | H | α-helix | trans | -68.4 | -42.6 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112.2 | S48 L52 L53 V54 | S48-A50 PolarHBondContact O-N 2.86Å; A50-L52 VanDerWaalsContact C-N 3.3Å; A50-L52 PolarHBondContact O-N 2.7Å; A50-L53 PolarHBondContact O-N 3.39Å; A50-V54 WeakPolarHBondContact O-CG2 3.29Å; A50-V54 PolarHBondContact O-N 2.8Å |
| 51 | A | 76.9 | Confident | 74.8 | Confident | 13 Ų | 13 | 117.9 Ų | 117.9 | 11% | 0.107 | 64% | 0.635 | C | S | . | * | H | α-helix | trans | -66.5 | -33.4 | 175.3 | 0 | 0 | 0 | 0 | 0 | 111.9 | V47 S48 G55 | V47-A51 HydrophobicContact CG1-CB 3.77Å; S48-A51 PolarHBondContact O-N 2.89Å; S48-A51 WeakPolarHBondContact OG-CB 3.38Å; S48-A51 PolarHBondContact OG-N 2.81Å; A51-G55 PolarHBondContact O-N 3.5Å |
| 52 | L | 77.5 | Confident | 72.8 | Confident | 126 Ų | 126 | 114.3 Ų | 114.3 | 66% | 0.66 | 63% | 0.634 | S | S | * | * | H | α-helix | trans | -66.8 | -38 | 171.7 | -73.6 | 174.6 | 0 | 0 | 0 | 112.7 | V47 S48 A49 A50 | V47-L52 HydrophobicContact CB-CD2 4.17Å; V47-L52 HydrophobicContact CB-CG 4.12Å; V47-L52 HydrophobicContact CG1-CD2 3.95Å; V47-L52 HydrophobicContact CG1-CG 3.84Å; S48-L52 PolarHBondContact O-N 3.34Å; A49-L52 PolarHBondContact O-N 3.05Å; A50-L52 VanDerWaalsContact C-N 3.3Å; A50-L52 PolarHBondContact O-N 2.7Å |
| 53 | L | 77.5 | Confident | 71.1 | Confident | 155 Ų | 155 | 113 Ų | 113 | 81% | 0.812 | 64% | 0.638 | S | S | * | * | H | α-helix | trans | -71.6 | -39.8 | 179.1 | -173.3 | 69.3 | 0 | 0 | 0 | 112.4 | A49 A50 | A49-L53 WeakPolarHBondContact O-CB 3.5Å; A49-L53 PolarHBondContact O-N 3.09Å; A50-L53 PolarHBondContact O-N 3.39Å |
| 54 | V | 82.1 | Confident | 69.8 | Low | 92 Ų | 92 | 109 Ų | 109 | 56% | 0.558 | 63% | 0.633 | S | S | * | * | H | α-helix | trans | -84.6 | -25.7 | -176.3 | 178.4 | 0 | 0 | 0 | 0 | 112.3 | A50 E56 | A50-V54 WeakPolarHBondContact O-CG2 3.29Å; A50-V54 PolarHBondContact O-N 2.8Å; V54-E56 HydrophobicContact CG1-CB 3.93Å; V54-E56 PolarHBondContact O-N 2.87Å |
| 55 | G | 73.4 | Confident | 68.4 | Low | 74 Ų | 74 | 107.6 Ų | 107.6 | 76% | 0.763 | 62% | 0.622 | S | S | * | * | S | Bend | trans | 74.2 | 6.6 | -174.7 | 0 | 0 | 0 | 0 | 0 | 114 | A51 | A51-G55 PolarHBondContact O-N 3.5Š|
| 56 | E | 76.1 | Confident | 67.6 | Low | 143 Ų | 143 | 105.7 Ų | 105.7 | 67% | 0.668 | 61% | 0.612 | S | S | * | * | S | Bend | trans | -118.3 | 147.7 | 178.1 | -165.3 | 173.6 | 178.6 | 0 | 0 | 110.4 | V54 V58 | V54-E56 HydrophobicContact CG1-CB 3.93Å; V54-E56 PolarHBondContact O-N 2.87Å; E56-V58 VanDerWaalsContact C-N 3.28Å; E56-V58 PolarHBondContact O-N 2.7Å |
| 57 | K | 67 | Low | 67.3 | Low | 203 Ų | 203 | 104.1 Ų | 104.1 | 88% | 0.883 | 59% | 0.589 | S | S | * | * | trans | -69 | 87.3 | 174.4 | -70.3 | -176.9 | -179 | 178.5 | 0 | 109.3 | Q59 | K57-Q59 PolarHBondContact O-N 3.35Š| ||
| 58 | V | 61.2 | Low | 67.1 | Low | 74 Ų | 74 | 101.7 Ų | 101.7 | 45% | 0.448 | 58% | 0.575 | S | S | . | * | trans | -63.7 | 118.5 | 167.1 | -176.1 | 0 | 0 | 0 | 0 | 107.1 | E56 E60 | E56-V58 VanDerWaalsContact C-N 3.28Å; E56-V58 PolarHBondContact O-N 2.7Å; V58-E60 PolarHBondContact O-N 2.98Å | ||
| 59 | Q | 62.4 | Low | 67.2 | Low | 155 Ų | 155 | 105.4 Ų | 105.4 | 72% | 0.724 | 59% | 0.587 | S | S | * | * | trans | -53.9 | 127.6 | 170.7 | -78.2 | 179.2 | -23.6 | 0 | 0 | 108.1 | K57 E61 | K57-Q59 PolarHBondContact O-N 3.35Å; Q59-E61 PolarHBondContact O-N 2.74Å | ||
| 60 | E | 59 | Low | 66.9 | Low | 124 Ų | 124 | 104.4 Ų | 104.4 | 58% | 0.579 | 57% | 0.568 | S | S | * | * | S | Bend | trans | -63.9 | 3.5 | 179.8 | -70.7 | -176.4 | 149.1 | 0 | 0 | 113.6 | V58 T62 | V58-E60 PolarHBondContact O-N 2.98Å; E60-T62 PolarHBondContact O-N 2.88Å |
| 61 | E | 53.1 | Low | 67 | Low | 156 Ų | 156 | 109.7 Ų | 109.7 | 73% | 0.729 | 59% | 0.585 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.6 | 107.6 | 176.8 | -64.6 | -166.1 | 167.3 | 0 | 0 | 109.2 | Q59 | Q59-E61 PolarHBondContact O-N 2.74Š|
| 62 | T | 48.9 | Very low | 66.9 | Low | 120 Ų | 120 | 113.2 Ų | 113.2 | 74% | 0.736 | 61% | 0.614 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 82.8 | 53.3 | -174.2 | 78.7 | 0 | 0 | 0 | 0 | 114.4 | E60 L64 | E60-T62 PolarHBondContact O-N 2.88Å; T62-L64 PolarHBondContact O-N 2.81Å |
| 63 | T | 51.3 | Low | 66.7 | Low | 113 Ų | 113 | 112 Ų | 112 | 69% | 0.693 | 61% | 0.612 | S | S | * | * | trans | -59.1 | 92.7 | 135.9 | 43.1 | 0 | 0 | 0 | 0 | 106.3 | V65 | T63-V65 PolarHBondContact O-N 3.37Š| ||
| 64 | L | 55.3 | Low | 66.5 | Low | 138 Ų | 138 | 107.1 Ų | 107.1 | 72% | 0.723 | 60% | 0.599 | S | S | * | * | trans | -41.5 | 92.3 | 167.8 | -69.7 | 148.1 | 0 | 0 | 0 | 106.5 | T62 D66 | T62-L64 PolarHBondContact O-N 2.81Å; L64-D66 PolarHBondContact O-N 3.49Å | ||
| 65 | V | 53.8 | Low | 66.4 | Low | 96 Ų | 96 | 105.4 Ų | 105.4 | 58% | 0.582 | 60% | 0.6 | S | S | * | * | trans | -63.5 | 92 | 155.2 | -178.2 | 0 | 0 | 0 | 0 | 101.9 | T63 D67 | T63-V65 PolarHBondContact O-N 3.37Å; V65-D67 HydrophobicContact CG1-CB 3.66Å; V65-D67 PolarHBondContact O-N 2.93Å | ||
| 66 | D | 61.6 | Low | 66.4 | Low | 99 Ų | 99 | 110 Ų | 110 | 53% | 0.529 | 60% | 0.604 | S | S | . | * | trans | -74.5 | 63.6 | -178.9 | -142.4 | 32.2 | 0 | 0 | 0 | 106.4 | L64 P68 R85 | L64-D66 PolarHBondContact O-N 3.49Å; D66-P68 WeakPolarHBondContact O-CD 3.06Å; D66-R85 IonicContact OD1-CZ 2.65Å; D66-R85 IonicContact OD1-NH1 2.8Å; D66-R85 PolarHBondContact OD1-NH1 3.43Å; D66-R85 IonicContact OD1-NH2 3.97Å; D66-R85 IonicContact OD2-CZ 2.97Å; D66-R85 IonicContact OD2-NH1 2.7Å; D66-R85 PolarHBondContact OD2-NH1 3.06Å; D66-R85 IonicContact OD2-NH2 2.7Å; D66-R85 PolarHBondContact OD2-NH2 3.39Å | ||
| 67 | D | 70.8 | Confident | 66.3 | Low | 27 Ų | 27 | 105.3 Ų | 105.3 | 14% | 0.144 | 59% | 0.585 | C | S | . | * | trans | -112.7 | 74 | -179 | -177.2 | 12.4 | 0 | 0 | 0 | 107.1 | V65 F69 Q70 M71 A72 T73 | V65-D67 HydrophobicContact CG1-CB 3.66Å; V65-D67 PolarHBondContact O-N 2.93Å; D67-F69 PolarHBondContact O-N 2.93Å; D67-Q70 VanDerWaalsContact CG-N 3.31Å; D67-Q70 PolarHBondContact O-N 3.1Å; D67-Q70 WeakPolarHBondContact OD1-CA 3.4Å; D67-Q70 PolarHBondContact OD1-N 3.02Å; D67-Q70 WeakPolarHBondContact OD2-CA 3.05Å; D67-M71 PolarHBondContact OD1-N 2.78Å; D67-M71 PolarHBondContact OD2-N 2.75Å; D67-A72 PolarHBondContact OD2-N 2.73Å; D67-T73 PolarHBondContact OD2-N 3.2Å | ||
| 68 | P | 72.4 | Confident | 66.8 | Low | 50 Ų | 50 | 99.7 Ų | 99.7 | 33% | 0.325 | 56% | 0.564 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -57.5 | -21.1 | 179.9 | 20.6 | -31.1 | 0 | 0 | 0 | 112.5 | D66 L82 | D66-P68 WeakPolarHBondContact O-CD 3.06Å; P68-L82 HydrophobicContact CB-CD1 3.67Å |
| 69 | F | 77.8 | Confident | 67.5 | Low | 117 Ų | 117 | 102.7 Ų | 102.7 | 51% | 0.513 | 58% | 0.575 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -103.4 | 3.8 | -179.2 | -63.6 | -73.9 | 0 | 0 | 0 | 113.5 | D67 M71 V77 L82 | D67-F69 PolarHBondContact O-N 2.93Å; F69-M71 HydrophobicContact CB-CG 3.96Å; F69-M71 PolarHBondContact O-N 2.99Å; F69-M71 VanDerWaalsContact O-N 3.1Å; F69-V77 VanDerWaalsContact O-CG2 3.29Å; F69-V77 WeakPolarHBondContact O-CG2 3.34Å; F69-L82 HydrophobicContact CE1-CD2 3.73Å; F69-L82 HydrophobicContact CZ-CD1 4.47Å; F69-L82 HydrophobicContact CZ-CD2 3.88Å |
| 70 | Q | 70.9 | Confident | 68.2 | Low | 62 Ų | 62 | 104.1 Ų | 104.1 | 29% | 0.29 | 58% | 0.579 | S | S | . | * | trans | 48.2 | 33.5 | -176.2 | -62.9 | 179.9 | 21.4 | 0 | 0 | 113.5 | D67 A72 G74 G75 M76 | D67-Q70 VanDerWaalsContact CG-N 3.31Å; D67-Q70 PolarHBondContact O-N 3.1Å; D67-Q70 WeakPolarHBondContact OD1-CA 3.4Å; D67-Q70 PolarHBondContact OD1-N 3.02Å; D67-Q70 WeakPolarHBondContact OD2-CA 3.05Å; Q70-A72 VanDerWaalsContact C-N 3.33Å; Q70-A72 PolarHBondContact O-N 2.74Å; Q70-G74 VanDerWaalsContact O-CA 3.23Å; Q70-G74 WeakPolarHBondContact O-CA 3.39Å; Q70-G74 PolarHBondContact O-N 3.23Å; Q70-G75 PolarHBondContact OE1-O 3.24Å; Q70-M76 PolarHBondContact NE2-O 3.05Å; Q70-M76 VanDerWaalsContact OE1-N 3.12Å; Q70-M76 PolarHBondContact OE1-O 3.03Å | ||
| 71 | M | 77.7 | Confident | 68.8 | Low | 167 Ų | 167 | 105 Ų | 105 | 82% | 0.823 | 58% | 0.581 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -63.4 | -33.3 | 176.7 | -72.3 | -173.5 | 54.1 | 0 | 0 | 113.8 | D67 F69 | D67-M71 PolarHBondContact OD1-N 2.78Å; D67-M71 PolarHBondContact OD2-N 2.75Å; F69-M71 HydrophobicContact CB-CG 3.96Å; F69-M71 PolarHBondContact O-N 2.99Å; F69-M71 VanDerWaalsContact O-N 3.1Å |
| 72 | A | 74.5 | Confident | 69.5 | Low | 86 Ų | 86 | 100.6 Ų | 100.6 | 71% | 0.711 | 56% | 0.562 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -96.3 | -41.2 | 179.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | D67 Q70 | D67-A72 PolarHBondContact OD2-N 2.73Å; Q70-A72 VanDerWaalsContact C-N 3.33Å; Q70-A72 PolarHBondContact O-N 2.74Å |
| 73 | T | 73.9 | Confident | 70.6 | Confident | 101 Ų | 101 | 103.5 Ų | 103.5 | 62% | 0.62 | 57% | 0.565 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.1 | -26.2 | -177.4 | -42 | 0 | 0 | 0 | 0 | 112.6 | D67 | D67-T73 PolarHBondContact OD2-N 3.2Š|
| 74 | G | 74.3 | Confident | 71.3 | Confident | 53 Ų | 53 | 105.2 Ų | 105.2 | 55% | 0.546 | 57% | 0.565 | S | S | . | * | trans | 69.1 | 129.2 | -172.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | Q70 | Q70-G74 VanDerWaalsContact O-CA 3.23Å; Q70-G74 WeakPolarHBondContact O-CA 3.39Å; Q70-G74 PolarHBondContact O-N 3.23Å | ||
| 75 | G | 78.8 | Confident | 71.6 | Confident | 56 Ų | 56 | 104.9 Ų | 104.9 | 58% | 0.577 | 55% | 0.554 | S | S | * | * | S | Bend | trans | 150.3 | -169.1 | 172.4 | 0 | 0 | 0 | 0 | 0 | 113.3 | Q70 | Q70-G75 PolarHBondContact OE1-O 3.24Š|
| 76 | M | 73.8 | Confident | 72 | Confident | 169 Ų | 169 | 103.5 Ų | 103.5 | 83% | 0.833 | 56% | 0.559 | S | S | * | * | trans | -80.3 | 120.3 | -175.3 | -165.6 | 84.8 | 159.2 | 0 | 0 | 110.8 | Q70 D78 | Q70-M76 PolarHBondContact NE2-O 3.05Å; Q70-M76 VanDerWaalsContact OE1-N 3.12Å; Q70-M76 PolarHBondContact OE1-O 3.03Å; M76-D78 PolarHBondContact O-N 3.18Å | ||
| 77 | V | 74 | Confident | 72.1 | Confident | 45 Ų | 45 | 107.4 Ų | 107.4 | 27% | 0.273 | 57% | 0.571 | S | S | . | * | trans | -70.5 | 118.4 | 175.7 | 177.7 | 0 | 0 | 0 | 0 | 110.8 | F69 M79 | F69-V77 VanDerWaalsContact O-CG2 3.29Å; F69-V77 WeakPolarHBondContact O-CG2 3.34Å; V77-M79 HydrophobicContact CG1-SD 4.03Å; V77-M79 PolarHBondContact O-N 3.22Å; V77-M79 VanDerWaalsContact O-N 3.09Å | ||
| 78 | D | 77 | Confident | 71.5 | Confident | 85 Ų | 85 | 112.9 Ų | 112.9 | 46% | 0.455 | 60% | 0.6 | S | S | . | * | trans | -77.2 | 87.6 | 172.3 | -92.1 | -18.5 | 0 | 0 | 0 | 110.7 | M76 K80 K81 L82 | M76-D78 PolarHBondContact O-N 3.18Å; D78-K80 PolarHBondContact O-N 3Å; D78-K81 HydrophobicContact CB-CB 4.35Å; D78-K81 HydrophobicContact CB-CD 3.98Å; D78-K81 HydrophobicContact CB-CG 4.21Å; D78-K81 PolarHBondContact O-N 3.46Å; D78-K81 VanDerWaalsContact O-N 3.08Å; D78-K81 WeakPolarHBondContact OD2-CE 3.24Å; D78-K81 IonicContact OD2-NZ 2.88Å; D78-K81 PolarHBondContact OD2-NZ 2.83Å; D78-L82 PolarHBondContact O-N 3.46Å | ||
| 79 | M | 76.4 | Confident | 70.9 | Confident | 137 Ų | 137 | 119.2 Ų | 119.2 | 68% | 0.675 | 62% | 0.623 | S | S | * | * | H | α-helix | trans | -56.3 | -23 | -179.6 | -66.5 | -65.3 | -80.9 | 0 | 0 | 114.3 | V77 L82 | V77-M79 HydrophobicContact CG1-SD 4.03Å; V77-M79 PolarHBondContact O-N 3.22Å; V77-M79 VanDerWaalsContact O-N 3.09Å; M79-L82 HydrophobicContact SD-CD2 4.47Å |
| 80 | K | 77 | Confident | 69.9 | Low | 185 Ų | 185 | 120 Ų | 120 | 80% | 0.804 | 64% | 0.637 | S | S | * | * | H | α-helix | trans | -69.8 | -43.4 | 176.9 | -67.9 | -176.8 | 179.8 | -179.8 | 0 | 112.3 | D78 L82 K83 | D78-K80 PolarHBondContact O-N 3Å; K80-L82 VanDerWaalsContact C-N 3.32Å; K80-L82 PolarHBondContact O-N 2.95Å; K80-K83 PolarHBondContact O-N 2.97Å |
| 81 | K | 70.9 | Confident | 69 | Low | 143 Ų | 143 | 122.2 Ų | 122.2 | 62% | 0.622 | 66% | 0.659 | S | S | * | * | H | α-helix | trans | -69.9 | -31 | -180 | -67.5 | 176.5 | -179.6 | 153.7 | 0 | 112.1 | D78 K83 | D78-K81 HydrophobicContact CB-CB 4.35Å; D78-K81 HydrophobicContact CB-CD 3.98Å; D78-K81 HydrophobicContact CB-CG 4.21Å; D78-K81 PolarHBondContact O-N 3.46Å; D78-K81 VanDerWaalsContact O-N 3.08Å; D78-K81 WeakPolarHBondContact OD2-CE 3.24Å; D78-K81 IonicContact OD2-NZ 2.88Å; D78-K81 PolarHBondContact OD2-NZ 2.83Å; K81-K83 VanDerWaalsContact C-N 3.26Å; K81-K83 PolarHBondContact O-N 3.1Å |
| 82 | L | 69.3 | Low | 67.9 | Low | 64 Ų | 64 | 123.4 Ų | 123.4 | 34% | 0.335 | 66% | 0.663 | S | S | . | * | H | α-helix | trans | -63.9 | -31.3 | 176.7 | -170.5 | 61.2 | 0 | 0 | 0 | 112.8 | P68 F69 D78 M79 K80 | P68-L82 HydrophobicContact CB-CD1 3.67Å; F69-L82 HydrophobicContact CE1-CD2 3.73Å; F69-L82 HydrophobicContact CZ-CD1 4.47Å; F69-L82 HydrophobicContact CZ-CD2 3.88Å; D78-L82 PolarHBondContact O-N 3.46Å; M79-L82 HydrophobicContact SD-CD2 4.47Å; K80-L82 VanDerWaalsContact C-N 3.32Å; K80-L82 PolarHBondContact O-N 2.95Å |
| 83 | K | 70.9 | Confident | 66.8 | Low | 181 Ų | 181 | 128.2 Ų | 128.2 | 79% | 0.787 | 67% | 0.671 | S | S | * | * | H | α-helix | trans | -83.4 | -28.4 | -174.2 | -165.8 | 173.8 | 179.1 | -179.5 | 0 | 113.9 | K80 K81 | K80-K83 PolarHBondContact O-N 2.97Å; K81-K83 VanDerWaalsContact C-N 3.26Å; K81-K83 PolarHBondContact O-N 3.1Å |
| 84 | E | 65.9 | Low | 65.8 | Low | 148 Ų | 148 | 131.5 Ų | 131.5 | 69% | 0.692 | 68% | 0.679 | S | S | * | * | H | α-helix | trans | -74.1 | -35.9 | 179.2 | -86.7 | 176.6 | 158.4 | 0 | 0 | 112.8 | G86 K87 | E84-G86 PolarHBondContact O-N 2.83Å; E84-K87 PolarHBondContact O-N 2.99Å |
| 85 | R | 62.5 | Low | 64.8 | Low | 132 Ų | 132 | 135.6 Ų | 135.6 | 50% | 0.498 | 69% | 0.688 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -64.3 | -13.3 | -174.7 | -148.9 | 170.4 | 88.8 | 168.3 | 15.9 | 115 | D66 | D66-R85 IonicContact OD1-CZ 2.65Å; D66-R85 IonicContact OD1-NH1 2.8Å; D66-R85 PolarHBondContact OD1-NH1 3.43Å; D66-R85 IonicContact OD1-NH2 3.97Å; D66-R85 IonicContact OD2-CZ 2.97Å; D66-R85 IonicContact OD2-NH1 2.7Å; D66-R85 PolarHBondContact OD2-NH1 3.06Å; D66-R85 IonicContact OD2-NH2 2.7Å; D66-R85 PolarHBondContact OD2-NH2 3.39Å |
| 86 | G | 62.7 | Low | 63.8 | Low | 66 Ų | 66 | 141 Ų | 141 | 68% | 0.68 | 70% | 0.703 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.1 | -11.3 | -179.8 | 0 | 0 | 0 | 0 | 0 | 115.5 | E84 | E84-G86 PolarHBondContact O-N 2.83Š|
| 87 | K | 62.2 | Low | 62.9 | Low | 182 Ų | 182 | 139.3 Ų | 139.3 | 79% | 0.791 | 69% | 0.693 | S | S | * | * | S | Bend | trans | -100.1 | -21.3 | -173.1 | -90.2 | -176 | 171.3 | -172.7 | 0 | 115.9 | E84 | E84-K87 PolarHBondContact O-N 2.99Š|
| 88 | D | 59.7 | Low | 62.2 | Low | 142 Ų | 142 | 143.1 Ų | 143.1 | 76% | 0.759 | 71% | 0.711 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -93.7 | 1.2 | -167.2 | -67 | -19 | 0 | 0 | 0 | 115.5 | ||
| 89 | K | 58.4 | Low | 61.4 | Low | 182 Ų | 182 | 142 Ų | 142 | 79% | 0.791 | 72% | 0.719 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92.9 | 2.7 | -173 | -68.7 | -152.4 | 174.4 | -158.8 | 0 | 116.3 | ||
| 90 | V | 56.5 | Low | 60.5 | Low | 134 Ų | 134 | 140 Ų | 140 | 81% | 0.812 | 72% | 0.715 | S | S | * | * | S | Bend | trans | -118.6 | -0.3 | -166.8 | -171.3 | 0 | 0 | 0 | 0 | 113.8 | ||
| 91 | S | 52.8 | Low | 59.7 | Low | 108 Ų | 108 | 134.5 Ų | 134.5 | 76% | 0.755 | 70% | 0.7 | S | S | * | * | S | Bend | trans | -110.9 | 1.5 | -162.1 | -161 | 0 | 0 | 0 | 0 | 118.1 | ||
| 92 | E | 53.7 | Low | 58.9 | Low | 193 Ų | 193 | 135.3 Ų | 135.3 | 90% | 0.902 | 70% | 0.704 | S | S | * | * | trans | -127.3 | 64.7 | -179.7 | -69.3 | -170.5 | 177.3 | 0 | 0 | 111.8 | ||||
| 93 | E | 51.3 | Low | 58.4 | Low | 187 Ų | 187 | 136.4 Ų | 136.4 | 87% | 0.874 | 72% | 0.717 | S | S | * | * | trans | -82.3 | 97.1 | 148.9 | -71.4 | -179.7 | 164.4 | 0 | 0 | 107.2 | ||||
| 94 | E | 53.1 | Low | 57.9 | Low | 170 Ų | 170 | 132 Ų | 132 | 79% | 0.794 | 72% | 0.715 | S | S | * | * | trans | -160.4 | 97 | 164 | -107.7 | 165.7 | -140.8 | 0 | 0 | 109.8 | L96 | E94-L96 PolarHBondContact O-N 3.27Š| ||
| 95 | D | 54.7 | Low | 57.5 | Low | 139 Ų | 139 | 133.6 Ų | 133.6 | 74% | 0.743 | 72% | 0.722 | S | S | * | * | trans | 62.8 | 35.4 | 136.6 | -59.3 | -18.8 | 0 | 0 | 0 | 120.7 | H97 | D95-H97 PolarHBondContact O-CE1 2.75Å; D95-H97 PolarHBondContact O-N 3.46Å; D95-H97 VanDerWaalsContact O-N 3.12Å; D95-H97 PolarHBondContact O-ND1 2.79Å | ||
| 96 | L | 57.9 | Low | 57.1 | Low | 169 Ų | 169 | 130.1 Ų | 130.1 | 89% | 0.885 | 72% | 0.716 | S | S | * | * | trans | -76.9 | 98.7 | 159.1 | -78.1 | 152.3 | 0 | 0 | 0 | 109.4 | E94 L98 | E94-L96 PolarHBondContact O-N 3.27Å; L96-L98 VanDerWaalsContact C-N 3.29Å; L96-L98 PolarHBondContact O-N 2.9Å | ||
| 97 | H | 55 | Low | 56.8 | Low | 134 Ų | 134 | 134.1 Ų | 134.1 | 62% | 0.62 | 72% | 0.721 | S | S | * | * | trans | -53.5 | 78.8 | 179.8 | -65 | 67.5 | 0 | 0 | 0 | 113 | D95 G99 T100 S101 | D95-H97 PolarHBondContact O-CE1 2.75Å; D95-H97 PolarHBondContact O-N 3.46Å; D95-H97 VanDerWaalsContact O-N 3.12Å; D95-H97 PolarHBondContact O-ND1 2.79Å; H97-G99 PolarHBondContact O-N 2.78Å; H97-T100 HydrophobicContact CB-CG2 4.34Å; H97-T100 PolarHBondContact O-N 3.47Å; H97-T100 PolarHBondContact O-OG1 2.7Å; H97-T100 VanDerWaalsContact O-OG1 3.09Å; H97-S101 PolarHBondContact O-OG 3.37Å | ||
| 98 | L | 59.5 | Low | 56.8 | Low | 124 Ų | 124 | 135.1 Ų | 135.1 | 65% | 0.649 | 72% | 0.72 | S | S | * | * | H | α-helix | trans | -56 | -19.5 | 178.8 | -166.7 | 66.8 | 0 | 0 | 0 | 113.2 | L96 F102 | L96-L98 VanDerWaalsContact C-N 3.29Å; L96-L98 PolarHBondContact O-N 2.9Å; L98-F102 HydrophobicContact CD1-CD2 4.4Å; L98-F102 HydrophobicContact CD1-CE2 4.11Å; L98-F102 HydrophobicContact CG-CE2 4.48Å |
| 99 | G | 58.2 | Low | 57 | Low | 62 Ų | 62 | 136.1 Ų | 136.1 | 64% | 0.639 | 71% | 0.713 | S | S | * | * | H | α-helix | trans | -75 | -23 | 175.6 | 0 | 0 | 0 | 0 | 0 | 115.3 | H97 S103 | H97-G99 PolarHBondContact O-N 2.78Å; G99-S103 PolarHBondContact O-OG 2.83Å |
| 100 | T | 59.5 | Low | 57.6 | Low | 95 Ų | 95 | 132.1 Ų | 132.1 | 58% | 0.583 | 70% | 0.701 | S | S | * | * | H | α-helix | trans | -96 | -27.1 | -179.7 | 62.9 | 0 | 0 | 0 | 0 | 112.3 | H97 S103 | H97-T100 HydrophobicContact CB-CG2 4.34Å; H97-T100 PolarHBondContact O-N 3.47Å; H97-T100 PolarHBondContact O-OG1 2.7Å; H97-T100 VanDerWaalsContact O-OG1 3.09Å; T100-S103 PolarHBondContact O-N 3.35Å |
| 101 | S | 59.3 | Low | 58.6 | Low | 70 Ų | 70 | 132.7 Ų | 132.7 | 49% | 0.49 | 69% | 0.694 | S | S | . | * | H | α-helix | trans | -68.3 | -36 | -179.8 | -37.8 | 0 | 0 | 0 | 0 | 113.2 | H97 S103 | H97-S101 PolarHBondContact O-OG 3.37Å; S101-S103 VanDerWaalsContact C-N 3.32Å; S101-S103 PolarHBondContact O-N 2.88Å |
| 102 | F | 53.8 | Low | 59.9 | Low | 159 Ų | 159 | 132.8 Ų | 132.8 | 70% | 0.697 | 69% | 0.686 | S | S | * | * | H | α-helix | trans | -76.2 | -17.3 | 177.4 | -90.2 | -84.5 | 0 | 0 | 0 | 114 | L98 | L98-F102 HydrophobicContact CD1-CD2 4.4Å; L98-F102 HydrophobicContact CD1-CE2 4.11Å; L98-F102 HydrophobicContact CG-CE2 4.48Å |
| 103 | S | 58.7 | Low | 61.4 | Low | 87 Ų | 87 | 126 Ų | 126 | 61% | 0.608 | 66% | 0.663 | S | S | * | * | H | α-helix | trans | -88.2 | -21.6 | -177.8 | -62.7 | 0 | 0 | 0 | 0 | 113 | G99 T100 S101 | G99-S103 PolarHBondContact O-OG 2.83Å; T100-S103 PolarHBondContact O-N 3.35Å; S101-S103 VanDerWaalsContact C-N 3.32Å; S101-S103 PolarHBondContact O-N 2.88Å |
| 104 | A | 61 | Low | 62.9 | Low | 90 Ų | 90 | 120 Ų | 120 | 74% | 0.744 | 64% | 0.637 | S | S | * | * | H | α-helix | trans | -81.3 | -21.8 | 179.5 | 0 | 0 | 0 | 0 | 0 | 113.2 | T106 | A104-T106 VanDerWaalsContact C-N 3.34Å; A104-T106 PolarHBondContact O-N 3.48Å |
| 105 | E | 58 | Low | 64.5 | Low | 180 Ų | 180 | 116.6 Ų | 116.6 | 84% | 0.841 | 62% | 0.622 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -99.4 | 33.8 | -179.8 | -161.6 | 158.6 | -160.1 | 0 | 0 | 112.1 | ||
| 106 | T | 53.5 | Low | 66.1 | Low | 60 Ų | 60 | 115.1 Ų | 115.1 | 37% | 0.368 | 61% | 0.612 | S | S | . | * | trans | -100.8 | 106.7 | 163.7 | 84.2 | 0 | 0 | 0 | 0 | 107.2 | A104 R108 | A104-T106 VanDerWaalsContact C-N 3.34Å; A104-T106 PolarHBondContact O-N 3.48Å; T106-R108 PolarHBondContact O-N 3.1Å | ||
| 107 | N | 56.8 | Low | 67.6 | Low | 149 Ų | 149 | 113.5 Ų | 113.5 | 80% | 0.797 | 60% | 0.598 | S | S | * | * | trans | -62.9 | 49.2 | 163.9 | -108.5 | -26 | 0 | 0 | 0 | 110.7 | R109 | N107-R109 PolarHBondContact O-N 2.81Š| ||
| 108 | R | 60.4 | Low | 69.2 | Low | 203 Ų | 203 | 113.8 Ų | 113.8 | 77% | 0.766 | 60% | 0.595 | S | S | * | * | trans | -69.7 | 111.4 | 163.6 | -78.4 | -170.5 | 173.4 | 111.6 | -3.5 | 105.3 | T106 D110 | T106-R108 PolarHBondContact O-N 3.1Å; R108-D110 PolarHBondContact O-N 3.4Å | ||
| 109 | R | 64.8 | Low | 70.6 | Confident | 164 Ų | 164 | 111.5 Ų | 111.5 | 62% | 0.619 | 58% | 0.582 | S | S | * | * | trans | -50.2 | 115.3 | 162.9 | -173.6 | -177.8 | -173.6 | 99.3 | 9 | 106.4 | N107 E111 D114 | N107-R109 PolarHBondContact O-N 2.81Å; R109-E111 VanDerWaalsContact C-N 3.27Å; R109-E111 PolarHBondContact O-N 2.86Å; R109-D114 IonicContact CZ-OD2 3.99Å; R109-D114 IonicContact NE-OD2 3.21Å; R109-D114 PolarHBondContact NE-OD2 2.87Å; R109-D114 IonicContact NH2-OD1 2.65Å; R109-D114 IonicContact NH2-OD2 2.84Å; R109-D114 PolarHBondContact NH2-OD2 2.73Å | ||
| 110 | D | 70.4 | Confident | 72 | Confident | 98 Ų | 98 | 113.8 Ų | 113.8 | 52% | 0.524 | 58% | 0.576 | S | S | . | * | trans | -73.3 | 91.4 | 174.9 | -172.3 | -13.4 | 0 | 0 | 0 | 107.1 | R108 D112 A113 D114 | R108-D110 PolarHBondContact O-N 3.4Å; D110-D112 PolarHBondContact O-N 2.99Å; D110-D112 WeakPolarHBondContact OD1-CB 3.48Å; D110-D112 PolarHBondContact OD1-N 3.39Å; D110-D112 VanDerWaalsContact OD1-N 3.12Å; D110-A113 HydrophobicContact CB-CB 3.73Å; D110-A113 PolarHBondContact O-N 2.82Å; D110-A113 VanDerWaalsContact O-N 3.12Å; D110-A113 PolarHBondContact OD1-N 3.49Å; D110-D114 PolarHBondContact O-N 3.02Å | ||
| 111 | E | 77.6 | Confident | 73.3 | Confident | 146 Ų | 146 | 111.8 Ų | 111.8 | 68% | 0.682 | 56% | 0.564 | S | S | * | * | H | α-helix | trans | -57.1 | -32.4 | 178.1 | -64.3 | -177.3 | 167 | 0 | 0 | 110.6 | R109 M115 | R109-E111 VanDerWaalsContact C-N 3.27Å; R109-E111 PolarHBondContact O-N 2.86Å; E111-M115 WeakPolarHBondContact O-CB 3.42Å; E111-M115 PolarHBondContact O-N 3.4Å |
| 112 | D | 80.5 | Confident | 74.6 | Confident | 110 Ų | 110 | 110.8 Ų | 110.8 | 59% | 0.588 | 55% | 0.552 | S | S | * | * | H | α-helix | trans | -69.9 | -41.8 | 176.3 | -75.5 | -10.8 | 0 | 0 | 0 | 110.9 | D110 D114 M115 M116 | D110-D112 PolarHBondContact O-N 2.99Å; D110-D112 WeakPolarHBondContact OD1-CB 3.48Å; D110-D112 PolarHBondContact OD1-N 3.39Å; D110-D112 VanDerWaalsContact OD1-N 3.12Å; D112-D114 PolarHBondContact O-N 3.42Å; D112-M115 PolarHBondContact O-N 3.03Å; D112-M116 VanDerWaalsContact O-CB 3.32Å; D112-M116 WeakPolarHBondContact O-CB 3.31Å; D112-M116 WeakPolarHBondContact O-CG 3.23Å; D112-M116 PolarHBondContact O-N 3.28Å |
| 113 | A | 84.8 | Confident | 76.2 | Confident | 50 Ų | 50 | 107.1 Ų | 107.1 | 41% | 0.413 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -62.3 | -42.3 | 175 | 0 | 0 | 0 | 0 | 0 | 112.4 | D110 M116 K117 | D110-A113 HydrophobicContact CB-CB 3.73Å; D110-A113 PolarHBondContact O-N 2.82Å; D110-A113 VanDerWaalsContact O-N 3.12Å; D110-A113 PolarHBondContact OD1-N 3.49Å; A113-M116 PolarHBondContact O-N 2.83Å; A113-K117 WeakPolarHBondContact O-CB 3.27Å; A113-K117 PolarHBondContact O-N 2.77Å |
| 114 | D | 82.8 | Confident | 77.4 | Confident | 60 Ų | 60 | 107.3 Ų | 107.3 | 32% | 0.321 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -67.4 | -39.7 | 175.6 | -84.4 | -22.7 | 0 | 0 | 0 | 112.3 | R109 D110 D112 K117 Y118 | R109-D114 IonicContact CZ-OD2 3.99Å; R109-D114 IonicContact NE-OD2 3.21Å; R109-D114 PolarHBondContact NE-OD2 2.87Å; R109-D114 IonicContact NH2-OD1 2.65Å; R109-D114 IonicContact NH2-OD2 2.84Å; R109-D114 PolarHBondContact NH2-OD2 2.73Å; D110-D114 PolarHBondContact O-N 3.02Å; D112-D114 PolarHBondContact O-N 3.42Å; D114-K117 PolarHBondContact O-N 2.83Å; D114-Y118 WeakPolarHBondContact O-CB 3.34Å; D114-Y118 PolarHBondContact O-N 3.02Å |
| 115 | M | 87.6 | Confident | 78.5 | Confident | 99 Ų | 99 | 109.1 Ų | 109.1 | 49% | 0.488 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -65.3 | -40.7 | 176.2 | -169.8 | -178.5 | -19.1 | 0 | 0 | 111 | E111 D112 Y118 I119 | E111-M115 WeakPolarHBondContact O-CB 3.42Å; E111-M115 PolarHBondContact O-N 3.4Å; D112-M115 PolarHBondContact O-N 3.03Å; M115-Y118 WeakPolarHBondContact O-CB 3.3Å; M115-Y118 PolarHBondContact O-N 3.29Å; M115-I119 HydrophobicContact CG-CD1 4.24Å; M115-I119 VanDerWaalsContact O-CG1 3.26Å; M115-I119 WeakPolarHBondContact O-CG1 3.47Å; M115-I119 PolarHBondContact O-N 2.96Å |
| 116 | M | 88.4 | Confident | 79.6 | Confident | 109 Ų | 109 | 110.6 Ų | 110.6 | 54% | 0.537 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -63.9 | -44.4 | 174 | -72.4 | -65.6 | -75.4 | 0 | 0 | 111.3 | D112 A113 Y118 I119 E120 | D112-M116 VanDerWaalsContact O-CB 3.32Å; D112-M116 WeakPolarHBondContact O-CB 3.31Å; D112-M116 WeakPolarHBondContact O-CG 3.23Å; D112-M116 PolarHBondContact O-N 3.28Å; A113-M116 PolarHBondContact O-N 2.83Å; M116-Y118 VanDerWaalsContact C-N 3.32Å; M116-Y118 PolarHBondContact O-N 2.95Å; M116-I119 PolarHBondContact O-N 3.39Å; M116-I119 HydrophobicContact SD-CD1 4.43Å; M116-E120 WeakPolarHBondContact O-CG 3.38Å; M116-E120 PolarHBondContact O-N 3.26Å |
| 117 | K | 88.6 | Confident | 80.9 | Confident | 135 Ų | 135 | 115.4 Ų | 115.4 | 59% | 0.587 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -59.5 | -42 | 172.9 | -176 | -178.5 | 177.9 | -178.8 | 0 | 111.7 | A113 D114 E120 T121 | A113-K117 WeakPolarHBondContact O-CB 3.27Å; A113-K117 PolarHBondContact O-N 2.77Å; D114-K117 PolarHBondContact O-N 2.83Å; K117-E120 PolarHBondContact O-N 2.85Å; K117-T121 VanDerWaalsContact O-CG2 3.31Å; K117-T121 WeakPolarHBondContact O-CG2 3.18Å; K117-T121 PolarHBondContact O-N 2.79Å; K117-T121 PolarHBondContact O-OG1 3.45Å |
| 118 | Y | 89.1 | Confident | 81.5 | Confident | 140 Ų | 140 | 110.9 Ų | 110.9 | 55% | 0.549 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -62.4 | -47.7 | 175.6 | 177.9 | -104 | 0 | 0 | 0 | 111.6 | D114 M115 M116 E120 T121 E122 | D114-Y118 WeakPolarHBondContact O-CB 3.34Å; D114-Y118 PolarHBondContact O-N 3.02Å; M115-Y118 WeakPolarHBondContact O-CB 3.3Å; M115-Y118 PolarHBondContact O-N 3.29Å; M116-Y118 VanDerWaalsContact C-N 3.32Å; M116-Y118 PolarHBondContact O-N 2.95Å; Y118-E120 VanDerWaalsContact C-N 3.32Å; Y118-E120 PolarHBondContact O-N 3.39Å; Y118-T121 PolarHBondContact O-N 2.99Å; Y118-T121 PolarHBondContact O-OG1 2.84Å; Y118-E122 HydrophobicContact CD1-CG 4.29Å; Y118-E122 HydrophobicContact CD2-CG 4.19Å; Y118-E122 HydrophobicContact CE1-CG 3.8Å; Y118-E122 HydrophobicContact CE2-CG 3.68Å; Y118-E122 HydrophobicContact CG-CG 4.47Å; Y118-E122 VanDerWaalsContact CZ-CG 3.47Å; Y118-E122 WeakPolarHBondContact O-CG 3.43Å; Y118-E122 PolarHBondContact O-N 3.21Å |
| 119 | I | 88.3 | Confident | 81.7 | Confident | 76 Ų | 76 | 106.3 Ų | 106.3 | 39% | 0.39 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -58.3 | -44.4 | 176.3 | -69.2 | 163.7 | 0 | 0 | 0 | 110.5 | M115 M116 E122 L123 | M115-I119 HydrophobicContact CG-CD1 4.24Å; M115-I119 VanDerWaalsContact O-CG1 3.26Å; M115-I119 WeakPolarHBondContact O-CG1 3.47Å; M115-I119 PolarHBondContact O-N 2.96Å; M116-I119 PolarHBondContact O-N 3.39Å; M116-I119 HydrophobicContact SD-CD1 4.43Å; I119-E122 PolarHBondContact O-N 3.31Å; I119-L123 HydrophobicContact CG2-CD1 3.73Å; I119-L123 HydrophobicContact CG2-CG 4.21Å; I119-L123 VanDerWaalsContact O-CB 3.27Å; I119-L123 WeakPolarHBondContact O-CB 3.4Å; I119-L123 VanDerWaalsContact O-CG 3.25Å; I119-L123 WeakPolarHBondContact O-CG 3.32Å; I119-L123 PolarHBondContact O-N 3.32Å |
| 120 | E | 87.9 | Confident | 81.4 | Confident | 109 Ų | 109 | 103.3 Ų | 103.3 | 51% | 0.509 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -62 | -44.8 | 176.1 | -74.5 | 179.1 | -174.5 | 0 | 0 | 112.5 | M116 K117 Y118 L123 K124 | M116-E120 WeakPolarHBondContact O-CG 3.38Å; M116-E120 PolarHBondContact O-N 3.26Å; K117-E120 PolarHBondContact O-N 2.85Å; Y118-E120 VanDerWaalsContact C-N 3.32Å; Y118-E120 PolarHBondContact O-N 3.39Å; E120-L123 PolarHBondContact O-N 3.36Å; E120-K124 WeakPolarHBondContact O-CB 3.49Å; E120-K124 VanDerWaalsContact O-CG 3.27Å; E120-K124 WeakPolarHBondContact O-CG 3.39Å; E120-K124 PolarHBondContact O-N 2.95Å |
| 121 | T | 86.9 | Confident | 80.8 | Confident | 53 Ų | 53 | 105.7 Ų | 105.7 | 33% | 0.325 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -65 | -42 | 177.9 | 60.7 | 0 | 0 | 0 | 0 | 111.7 | K117 Y118 K124 K125 | K117-T121 VanDerWaalsContact O-CG2 3.31Å; K117-T121 WeakPolarHBondContact O-CG2 3.18Å; K117-T121 PolarHBondContact O-N 2.79Å; K117-T121 PolarHBondContact O-OG1 3.45Å; Y118-T121 PolarHBondContact O-N 2.99Å; Y118-T121 PolarHBondContact O-OG1 2.84Å; T121-K124 PolarHBondContact O-N 3.42Å; T121-K125 VanDerWaalsContact O-CG 3.28Å; T121-K125 WeakPolarHBondContact O-CG 3.37Å; T121-K125 PolarHBondContact O-N 3.41Å |
| 122 | E | 87.4 | Confident | 79.6 | Confident | 50 Ų | 50 | 105.6 Ų | 105.6 | 23% | 0.234 | 52% | 0.519 | C | S | . | . | H | α-helix | trans | -68.1 | -38.2 | 176.1 | -69.9 | -59.8 | 131.2 | 0 | 0 | 112.4 | Y118 I119 K125 R126 | Y118-E122 HydrophobicContact CD1-CG 4.29Å; Y118-E122 HydrophobicContact CD2-CG 4.19Å; Y118-E122 HydrophobicContact CE1-CG 3.8Å; Y118-E122 HydrophobicContact CE2-CG 3.68Å; Y118-E122 HydrophobicContact CG-CG 4.47Å; Y118-E122 VanDerWaalsContact CZ-CG 3.47Å; Y118-E122 WeakPolarHBondContact O-CG 3.43Å; Y118-E122 PolarHBondContact O-N 3.21Å; I119-E122 PolarHBondContact O-N 3.31Å; E122-K125 PolarHBondContact O-N 2.85Å; E122-K125 WeakPolarHBondContact OE1-CD 2.95Å; E122-K125 IonicContact OE1-NZ 3.9Å; E122-K125 PolarHBondContact OE1-NZ 2.65Å; E122-R126 WeakPolarHBondContact O-CB 3.36Å; E122-R126 WeakPolarHBondContact O-CG 3.46Å; E122-R126 PolarHBondContact O-N 3.17Å |
| 123 | L | 86.4 | Confident | 78.1 | Confident | 81 Ų | 81 | 108.9 Ų | 108.9 | 42% | 0.424 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -64.9 | -40 | 172.4 | -76.8 | 172.5 | 0 | 0 | 0 | 111.5 | I119 E120 R126 K127 | I119-L123 HydrophobicContact CG2-CD1 3.73Å; I119-L123 HydrophobicContact CG2-CG 4.21Å; I119-L123 VanDerWaalsContact O-CB 3.27Å; I119-L123 WeakPolarHBondContact O-CB 3.4Å; I119-L123 VanDerWaalsContact O-CG 3.25Å; I119-L123 WeakPolarHBondContact O-CG 3.32Å; I119-L123 PolarHBondContact O-N 3.32Å; E120-L123 PolarHBondContact O-N 3.36Å; L123-R126 PolarHBondContact O-N 3.42Å; L123-K127 VanDerWaalsContact O-CB 3.27Å; L123-K127 WeakPolarHBondContact O-CB 3.36Å; L123-K127 WeakPolarHBondContact O-CG 3.45Å; L123-K127 PolarHBondContact O-N 2.89Å |
| 124 | K | 84.1 | Confident | 76.2 | Confident | 92 Ų | 92 | 112.5 Ų | 112.5 | 40% | 0.4 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -63.2 | -44.4 | 173.9 | -77.7 | 176.1 | 179.3 | -176 | 0 | 111.5 | E120 T121 K127 G128 I129 | E120-K124 WeakPolarHBondContact O-CB 3.49Å; E120-K124 VanDerWaalsContact O-CG 3.27Å; E120-K124 WeakPolarHBondContact O-CG 3.39Å; E120-K124 PolarHBondContact O-N 2.95Å; T121-K124 PolarHBondContact O-N 3.42Å; K124-K127 CarbonylContact O-C 3.56Å; K124-K127 PolarHBondContact O-N 3.07Å; K124-G128 PolarHBondContact O-N 3.12Å; K124-I129 PolarHBondContact O-N 3.38Å; K124-I129 VanDerWaalsContact O-N 3.11Å |
| 125 | K | 84.2 | Confident | 74.6 | Confident | 128 Ų | 128 | 118.4 Ų | 118.4 | 56% | 0.557 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -58.1 | -47.4 | 173.4 | -73.3 | 174 | -171.3 | 172.3 | 0 | 111.7 | T121 E122 G128 | T121-K125 VanDerWaalsContact O-CG 3.28Å; T121-K125 WeakPolarHBondContact O-CG 3.37Å; T121-K125 PolarHBondContact O-N 3.41Å; E122-K125 PolarHBondContact O-N 2.85Å; E122-K125 WeakPolarHBondContact OE1-CD 2.95Å; E122-K125 IonicContact OE1-NZ 3.9Å; E122-K125 PolarHBondContact OE1-NZ 2.65Å; K125-G128 PolarHBondContact O-N 3.45Å; K125-G128 VanDerWaalsContact O-N 3.15Å |
| 126 | R | 81.5 | Confident | 72.7 | Confident | 211 Ų | 211 | 121.8 Ų | 121.8 | 80% | 0.796 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -67.1 | -32.7 | 177 | -74.6 | -179.8 | 178.7 | 177.8 | 1.1 | 113.5 | E122 L123 G128 | E122-R126 WeakPolarHBondContact O-CB 3.36Å; E122-R126 WeakPolarHBondContact O-CG 3.46Å; E122-R126 PolarHBondContact O-N 3.17Å; L123-R126 PolarHBondContact O-N 3.42Å; R126-G128 PolarHBondContact O-N 3.02Å |
| 127 | K | 81.4 | Confident | 71.2 | Confident | 160 Ų | 160 | 120.8 Ų | 120.8 | 70% | 0.696 | 59% | 0.586 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76.1 | -1 | 173.6 | -74.5 | 175.9 | 179.1 | -177.8 | 0 | 113.2 | L123 K124 I129 | L123-K127 VanDerWaalsContact O-CB 3.27Å; L123-K127 WeakPolarHBondContact O-CB 3.36Å; L123-K127 WeakPolarHBondContact O-CG 3.45Å; L123-K127 PolarHBondContact O-N 2.89Å; K124-K127 CarbonylContact O-C 3.56Å; K124-K127 PolarHBondContact O-N 3.07Å; K127-I129 PolarHBondContact O-N 2.89Å |
| 128 | G | 68.8 | Low | 70 | Confident | 55 Ų | 55 | 122.9 Ų | 122.9 | 57% | 0.567 | 60% | 0.595 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 73.3 | 12.2 | 176.9 | 0 | 0 | 0 | 0 | 0 | 114.4 | K124 K125 R126 V130 | K124-G128 PolarHBondContact O-N 3.12Å; K125-G128 PolarHBondContact O-N 3.45Å; K125-G128 VanDerWaalsContact O-N 3.15Å; R126-G128 PolarHBondContact O-N 3.02Å; G128-V130 PolarHBondContact O-N 3.4Å |
| 129 | I | 65.2 | Low | 68.7 | Low | 107 Ų | 107 | 122.5 Ų | 122.5 | 55% | 0.549 | 61% | 0.61 | S | S | . | * | trans | -84.8 | 76.6 | 170.4 | -54.1 | 170.9 | 0 | 0 | 0 | 105.7 | K124 K127 E131 | K124-I129 PolarHBondContact O-N 3.38Å; K124-I129 VanDerWaalsContact O-N 3.11Å; K127-I129 PolarHBondContact O-N 2.89Å; I129-E131 VanDerWaalsContact C-N 3.32Å; I129-E131 PolarHBondContact O-N 3.22Å | ||
| 130 | V | 58.3 | Low | 67.6 | Low | 101 Ų | 101 | 124.3 Ų | 124.3 | 61% | 0.612 | 62% | 0.615 | S | S | * | * | trans | -74.8 | 94.1 | 172.5 | -169 | 0 | 0 | 0 | 0 | 105.9 | G128 Q132 | G128-V130 PolarHBondContact O-N 3.4Å; V130-Q132 HydrophobicContact CG1-CB 4.45Å; V130-Q132 HydrophobicContact CG1-CG 3.74Å; V130-Q132 PolarHBondContact O-N 3.26Å | ||
| 131 | E | 57.9 | Low | 67 | Low | 148 Ų | 148 | 123.8 Ų | 123.8 | 69% | 0.692 | 62% | 0.615 | S | S | * | * | trans | -64 | 82.6 | 151.7 | -81.9 | 174 | 162.9 | 0 | 0 | 105.8 | I129 E133 | I129-E131 VanDerWaalsContact C-N 3.32Å; I129-E131 PolarHBondContact O-N 3.22Å; E131-E133 PolarHBondContact O-N 2.91Å | ||
| 132 | Q | 50.9 | Low | 66.5 | Low | 144 Ų | 144 | 124.9 Ų | 124.9 | 67% | 0.673 | 63% | 0.63 | S | S | * | * | trans | -62.4 | 90.6 | 153.5 | -89.5 | 173.7 | 8 | 0 | 0 | 103.9 | V130 E134 | V130-Q132 HydrophobicContact CG1-CB 4.45Å; V130-Q132 HydrophobicContact CG1-CG 3.74Å; V130-Q132 PolarHBondContact O-N 3.26Å; Q132-E134 HydrophobicContact CB-CG 4.18Å; Q132-E134 PolarHBondContact O-N 3.37Å | ||
| 133 | E | 50 | Low | 66 | Low | 178 Ų | 178 | 128.8 Ų | 128.8 | 83% | 0.832 | 65% | 0.648 | S | S | * | * | trans | -59.4 | 82.3 | 147.1 | -74.5 | -170.5 | 161 | 0 | 0 | 105.5 | E131 Q135 | E131-E133 PolarHBondContact O-N 2.91Å; E133-Q135 PolarHBondContact O-N 3.21Å | ||
| 134 | E | 44.9 | Very low | 65.5 | Low | 127 Ų | 127 | 129.2 Ų | 129.2 | 59% | 0.593 | 65% | 0.651 | S | S | * | * | trans | -56.5 | 96.2 | 166.1 | -74.4 | -174.6 | 156 | 0 | 0 | 105.6 | Q132 K136 | Q132-E134 HydrophobicContact CB-CG 4.18Å; Q132-E134 PolarHBondContact O-N 3.37Å; E134-K136 HydrophobicContact CB-CG 4.21Å; E134-K136 PolarHBondContact O-N 3.49Å; E134-K136 VanDerWaalsContact OE2-CE 3.31Å; E134-K136 WeakPolarHBondContact OE2-CE 3.31Å | ||
| 135 | Q | 48.2 | Very low | 65.2 | Low | 184 Ų | 184 | 128.2 Ų | 128.2 | 86% | 0.86 | 66% | 0.655 | S | S | * | * | trans | -57.2 | 90.1 | 153.4 | -67.3 | -177.9 | 4.7 | 0 | 0 | 105.6 | E133 A137 | E133-Q135 PolarHBondContact O-N 3.21Å; Q135-A137 PolarHBondContact O-N 3.29Å | ||
| 136 | K | 49.1 | Very low | 65 | Low | 170 Ų | 170 | 129.1 Ų | 129.1 | 74% | 0.739 | 67% | 0.665 | S | S | * | * | trans | -67.5 | 72.3 | 170.1 | -69.3 | -175.1 | 180 | -179.7 | 0 | 107.8 | E134 K138 | E134-K136 HydrophobicContact CB-CG 4.21Å; E134-K136 PolarHBondContact O-N 3.49Å; E134-K136 VanDerWaalsContact OE2-CE 3.31Å; E134-K136 WeakPolarHBondContact OE2-CE 3.31Å; K136-K138 VanDerWaalsContact C-N 3.34Å; K136-K138 PolarHBondContact O-N 2.98Å | ||
| 137 | A | 55.8 | Low | 65 | Low | 88 Ų | 88 | 128.4 Ų | 128.4 | 73% | 0.727 | 66% | 0.664 | S | S | * | * | trans | -67.7 | 99.1 | 164.8 | 0 | 0 | 0 | 0 | 0 | 106.2 | Q135 | Q135-A137 PolarHBondContact O-N 3.29Š| ||
| 138 | K | 64.2 | Low | 64.9 | Low | 179 Ų | 179 | 124.2 Ų | 124.2 | 78% | 0.778 | 65% | 0.646 | S | S | * | * | P | Polyproline II helix | trans | -51.5 | 139.9 | 168.2 | -64.7 | 179.6 | 179.9 | 178.3 | 0 | 108.2 | K136 K140 | K136-K138 VanDerWaalsContact C-N 3.34Å; K136-K138 PolarHBondContact O-N 2.98Å; K138-K140 PolarHBondContact O-N 3.15Å |
| 139 | P | 62.1 | Low | 65.4 | Low | 131 Ų | 131 | 126.5 Ų | 126.5 | 85% | 0.851 | 65% | 0.645 | S | S | * | * | P | Polyproline II helix | trans | -59.4 | 116.3 | 174.7 | 26 | -32.7 | 0 | 0 | 0 | 107.8 | ||
| 140 | K | 64.7 | Low | 66.2 | Low | 115 Ų | 115 | 124.7 Ų | 124.7 | 50% | 0.5 | 64% | 0.64 | S | S | . | * | P | Polyproline II helix | trans | -69.5 | 140.3 | 178.7 | -68.2 | 178.5 | -175 | -179.9 | 0 | 108.9 | K138 D144 E148 | K138-K140 PolarHBondContact O-N 3.15Å; K140-D144 HydrophobicContact CB-CB 4.22Å; K140-E148 WeakPolarHBondContact CD-OE1 3.4Å; K140-E148 WeakPolarHBondContact CE-OE1 3.25Å; K140-E148 IonicContact NZ-OE1 2.67Å; K140-E148 PolarHBondContact NZ-OE1 2.94Å; K140-E148 IonicContact NZ-OE2 3.18Å; K140-E148 PolarHBondContact NZ-OE2 3.25Å |
| 141 | N | 75.8 | Confident | 67.1 | Low | 97 Ų | 97 | 127.7 Ų | 127.7 | 52% | 0.519 | 65% | 0.648 | S | S | . | * | P | Polyproline II helix | trans | -62.1 | 149.5 | 174.6 | -169.1 | 16.5 | 0 | 0 | 0 | 109.2 | E143 D144 C145 | N141-E143 PolarHBondContact O-N 3.35Å; N141-D144 WeakPolarHBondContact O-CB 3.48Å; N141-D144 PolarHBondContact O-N 2.86Å; N141-C145 PolarHBondContact O-N 2.88Å |
| 142 | A | 75.4 | Confident | 67.9 | Low | 76 Ų | 76 | 127.5 Ų | 127.5 | 63% | 0.628 | 65% | 0.652 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -58.5 | -27 | -176.5 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||
| 143 | E | 78.1 | Confident | 69.3 | Low | 133 Ų | 133 | 125.3 Ų | 125.3 | 62% | 0.621 | 64% | 0.643 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71.4 | -33.4 | 175.1 | -63.3 | 175.1 | -178.7 | 0 | 0 | 112.8 | N141 C145 L146 Y147 | N141-E143 PolarHBondContact O-N 3.35Å; E143-C145 VanDerWaalsContact C-N 3.33Å; E143-L146 PolarHBondContact O-N 2.94Å; E143-Y147 VanDerWaalsContact O-CD2 3.31Å; E143-Y147 WeakPolarHBondContact O-CD2 3.1Å |
| 144 | D | 75.9 | Confident | 70.4 | Confident | 90 Ų | 90 | 122.3 Ų | 122.3 | 48% | 0.481 | 63% | 0.625 | S | S | . | * | G | 310 helix | trans | -71.8 | -30.5 | 178.5 | -73.1 | -25.9 | 0 | 0 | 0 | 111.7 | K140 N141 L146 Y147 | K140-D144 HydrophobicContact CB-CB 4.22Å; N141-D144 WeakPolarHBondContact O-CB 3.48Å; N141-D144 PolarHBondContact O-N 2.86Å; D144-L146 PolarHBondContact O-N 3.38Å; D144-Y147 PolarHBondContact O-N 3.37Å |
| 145 | C | 76.4 | Confident | 71.6 | Confident | 71 Ų | 71 | 122.6 Ų | 122.6 | 48% | 0.48 | 64% | 0.635 | S | S | . | * | G | 310 helix | trans | -62.5 | -27.7 | 176.3 | -67.4 | 0 | 0 | 0 | 0 | 112.8 | N141 E143 Y147 E148 | N141-C145 PolarHBondContact O-N 2.88Å; E143-C145 VanDerWaalsContact C-N 3.33Å; C145-Y147 VanDerWaalsContact C-N 3.32Å; C145-E148 PolarHBondContact O-N 3.11Å |
| 146 | L | 80.9 | Confident | 72.3 | Confident | 147 Ų | 147 | 118.1 Ų | 118.1 | 77% | 0.77 | 62% | 0.624 | S | S | * | * | G | 310 helix | trans | -73.6 | -23.5 | 179.2 | -70.6 | 164.4 | 0 | 0 | 0 | 112.8 | E143 D144 | E143-L146 PolarHBondContact O-N 2.94Å; D144-L146 PolarHBondContact O-N 3.38Å |
| 147 | Y | 81 | Confident | 72.8 | Confident | 196 Ų | 196 | 115.6 Ų | 115.6 | 77% | 0.769 | 63% | 0.627 | S | S | * | * | G | 310 helix | trans | -96.7 | 3.2 | 178.2 | -63.7 | -75.1 | 0 | 0 | 0 | 113.2 | E143 D144 C145 L149 | E143-Y147 VanDerWaalsContact O-CD2 3.31Å; E143-Y147 WeakPolarHBondContact O-CD2 3.1Å; D144-Y147 PolarHBondContact O-N 3.37Å; C145-Y147 VanDerWaalsContact C-N 3.32Å; Y147-L149 PolarHBondContact O-N 3.2Å |
| 148 | E | 79.3 | Confident | 72.9 | Confident | 71 Ų | 71 | 114.8 Ų | 114.8 | 33% | 0.332 | 62% | 0.62 | S | S | . | * | trans | -72.4 | 115.4 | 176.3 | -69 | -155.8 | -152.5 | 0 | 0 | 111.5 | K140 C145 R154 | K140-E148 WeakPolarHBondContact CD-OE1 3.4Å; K140-E148 WeakPolarHBondContact CE-OE1 3.25Å; K140-E148 IonicContact NZ-OE1 2.67Å; K140-E148 PolarHBondContact NZ-OE1 2.94Å; K140-E148 IonicContact NZ-OE2 3.18Å; K140-E148 PolarHBondContact NZ-OE2 3.25Å; C145-E148 PolarHBondContact O-N 3.11Å; E148-R154 IonicContact OE2-CZ 3.59Å; E148-R154 IonicContact OE2-NH2 3.56Å; E148-R154 PolarHBondContact OE2-NH2 3.22Å | ||
| 149 | L | 79.8 | Confident | 72.5 | Confident | 103 Ų | 103 | 115.7 Ų | 115.7 | 54% | 0.539 | 62% | 0.624 | S | S | . | * | trans | -66.4 | 133.8 | 171.4 | -71.5 | 168.5 | 0 | 0 | 0 | 110.5 | Y147 I153 R154 | Y147-L149 PolarHBondContact O-N 3.2Å; L149-I153 HydrophobicContact CD2-CG2 4.5Å; L149-R154 HydrophobicContact CB-CG 4.3Å | ||
| 150 | P | 82 | Confident | 72.2 | Confident | 70 Ų | 70 | 118.5 Ų | 118.5 | 46% | 0.455 | 62% | 0.623 | S | S | . | * | trans | -50.9 | 144.3 | 171.1 | -29.7 | 37.2 | 0 | 0 | 0 | 112.6 | N152 I153 R154 | P150-N152 WeakPolarHBondContact CB-OD1 3.34Å; P150-N152 PolarHBondContact O-N 3.44Å; P150-N152 VanDerWaalsContact O-N 3.12Å; P150-I153 HydrophobicContact CB-CD1 4.49Å; P150-I153 HydrophobicContact CG-CD1 4.44Å; P150-I153 CarbonylContact O-C 3.57Å; P150-I153 PolarHBondContact O-N 3.36Å; P150-R154 PolarHBondContact O-N 3.15Å | ||
| 151 | E | 76.5 | Confident | 71.7 | Confident | 164 Ų | 164 | 116.2 Ų | 116.2 | 77% | 0.766 | 62% | 0.619 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -57.8 | -31.4 | -174.2 | -67.4 | -162.3 | 153.2 | 0 | 0 | 113.9 | I153 R154 | E151-I153 PolarHBondContact O-N 3.18Å; E151-R154 PolarHBondContact O-N 3.32Å |
| 152 | N | 75.5 | Confident | 71.1 | Confident | 144 Ų | 144 | 120 Ų | 120 | 77% | 0.77 | 63% | 0.633 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.4 | -12.3 | 176.6 | 63.1 | -31.1 | 0 | 0 | 0 | 114.2 | P150 | P150-N152 WeakPolarHBondContact CB-OD1 3.34Å; P150-N152 PolarHBondContact O-N 3.44Å; P150-N152 VanDerWaalsContact O-N 3.12Å |
| 153 | I | 78.9 | Confident | 70.5 | Confident | 98 Ų | 98 | 122.7 Ų | 122.7 | 50% | 0.503 | 63% | 0.633 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -114 | -9.6 | 177.2 | -56.3 | 168.4 | 0 | 0 | 0 | 110.8 | L149 P150 E151 V155 | L149-I153 HydrophobicContact CD2-CG2 4.5Å; P150-I153 HydrophobicContact CB-CD1 4.49Å; P150-I153 HydrophobicContact CG-CD1 4.44Å; P150-I153 CarbonylContact O-C 3.57Å; P150-I153 PolarHBondContact O-N 3.36Å; E151-I153 PolarHBondContact O-N 3.18Å; I153-V155 VanDerWaalsContact C-N 3.31Å; I153-V155 PolarHBondContact O-N 3.49Å |
| 154 | R | 74.9 | Confident | 69.6 | Low | 115 Ų | 115 | 122.2 Ų | 122.2 | 43% | 0.434 | 63% | 0.632 | S | S | . | * | trans | -62.9 | 91.8 | 170.4 | -99.3 | -179.5 | -174.1 | 152.7 | 10 | 109.6 | E148 L149 P150 E151 S156 | E148-R154 IonicContact OE2-CZ 3.59Å; E148-R154 IonicContact OE2-NH2 3.56Å; E148-R154 PolarHBondContact OE2-NH2 3.22Å; L149-R154 HydrophobicContact CB-CG 4.3Å; P150-R154 PolarHBondContact O-N 3.15Å; E151-R154 PolarHBondContact O-N 3.32Å; R154-S156 VanDerWaalsContact C-N 3.31Å; R154-S156 PolarHBondContact O-N 2.93Å | ||
| 155 | V | 69 | Low | 69.1 | Low | 133 Ų | 133 | 124.1 Ų | 124.1 | 81% | 0.806 | 64% | 0.642 | S | S | * | * | trans | -70.2 | 95.1 | 165.4 | -171.1 | 0 | 0 | 0 | 0 | 106.2 | I153 S157 | I153-V155 VanDerWaalsContact C-N 3.31Å; I153-V155 PolarHBondContact O-N 3.49Å; V155-S157 VanDerWaalsContact C-N 3.32Å; V155-S157 PolarHBondContact O-N 2.85Å | ||
| 156 | S | 62.1 | Low | 68.9 | Low | 90 Ų | 90 | 122.8 Ų | 122.8 | 63% | 0.629 | 63% | 0.633 | S | S | * | * | trans | -60.3 | 95.5 | 171.7 | 31.6 | 0 | 0 | 0 | 0 | 109.2 | R154 A158 | R154-S156 VanDerWaalsContact C-N 3.31Å; R154-S156 PolarHBondContact O-N 2.93Å; S156-A158 PolarHBondContact O-N 3.4Å | ||
| 157 | S | 60.1 | Low | 68.3 | Low | 117 Ų | 117 | 119 Ų | 119 | 82% | 0.818 | 61% | 0.614 | S | S | * | * | trans | -70.2 | -2.6 | 167.9 | 61.4 | 0 | 0 | 0 | 0 | 112.4 | V155 K159 | V155-S157 VanDerWaalsContact C-N 3.32Å; V155-S157 PolarHBondContact O-N 2.85Å; S157-K159 VanDerWaalsContact C-N 3.33Å; S157-K159 PolarHBondContact O-N 3.17Å | ||
| 158 | A | 58.3 | Low | 68 | Low | 70 Ų | 70 | 113.9 Ų | 113.9 | 58% | 0.579 | 60% | 0.597 | S | S | * | * | S | Bend | trans | -74.5 | 83.5 | 173.6 | 0 | 0 | 0 | 0 | 0 | 110.5 | S156 K160 | S156-A158 PolarHBondContact O-N 3.4Å; A158-K160 VanDerWaalsContact C-N 3.26Å; A158-K160 PolarHBondContact O-N 3.2Å |
| 159 | K | 56.3 | Low | 68 | Low | 198 Ų | 198 | 116.9 Ų | 116.9 | 86% | 0.861 | 61% | 0.612 | S | S | * | * | trans | 40 | 43.2 | 135.3 | -55.4 | -178.8 | 179.6 | -179.8 | 0 | 116.8 | S157 T161 | S157-K159 VanDerWaalsContact C-N 3.33Å; S157-K159 PolarHBondContact O-N 3.17Å; K159-T161 PolarHBondContact O-N 2.76Å | ||
| 160 | K | 54.8 | Low | 67.6 | Low | 191 Ų | 191 | 118.7 Ų | 118.7 | 83% | 0.83 | 62% | 0.622 | S | S | * | * | S | Bend | trans | -74.5 | 70.9 | 152.6 | -69.9 | -173.5 | 180 | 178.7 | 0 | 106.3 | A158 E162 | A158-K160 VanDerWaalsContact C-N 3.26Å; A158-K160 PolarHBondContact O-N 3.2Å; K160-E162 PolarHBondContact O-N 3.17Å |
| 161 | T | 55.9 | Low | 67.3 | Low | 66 Ų | 66 | 119.9 Ų | 119.9 | 41% | 0.405 | 63% | 0.632 | S | S | . | * | trans | 26.6 | 88.2 | 162.9 | 47.4 | 0 | 0 | 0 | 0 | 114.3 | K159 E163 M164 | K159-T161 PolarHBondContact O-N 2.76Å; T161-E163 PolarHBondContact O-N 2.93Å; T161-M164 PolarHBondContact O-N 2.9Å; T161-M164 WeakPolarHBondContact OG1-CB 3.36Å; T161-M164 VanDerWaalsContact OG1-CG 3.24Å; T161-M164 WeakPolarHBondContact OG1-CG 3.45Å | ||
| 162 | E | 62.2 | Low | 67.3 | Low | 176 Ų | 176 | 113.7 Ų | 113.7 | 82% | 0.822 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -47.3 | -27.6 | 160.6 | -173.1 | 174.9 | 179 | 0 | 0 | 111 | K160 M164 L165 S166 | K160-E162 PolarHBondContact O-N 3.17Å; E162-M164 PolarHBondContact O-N 3.33Å; E162-L165 PolarHBondContact O-N 2.82Å; E162-S166 WeakPolarHBondContact O-CB 3.28Å; E162-S166 PolarHBondContact O-N 3.34Å; E162-S166 PolarHBondContact O-OG 3.49Å |
| 163 | E | 63.1 | Low | 67.3 | Low | 134 Ų | 134 | 112.6 Ų | 112.6 | 63% | 0.626 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -64.6 | -27.3 | 172.3 | -162.6 | 170.7 | -164.7 | 0 | 0 | 115.7 | T161 S166 N167 | T161-E163 PolarHBondContact O-N 2.93Å; E163-S166 VanDerWaalsContact CA-OG 3.3Å; E163-S166 WeakPolarHBondContact CA-OG 3.38Å; E163-S166 PolarHBondContact O-OG 3.05Å; E163-N167 PolarHBondContact O-N 3.43Å; E163-N167 PolarHBondContact O-ND2 2.93Å; E163-N167 VanDerWaalsContact O-ND2 3.1Å |
| 164 | M | 59.6 | Low | 67.2 | Low | 122 Ų | 122 | 112.7 Ų | 112.7 | 60% | 0.601 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -82.4 | -30.2 | 174.3 | -71.5 | -151.7 | 112.8 | 0 | 0 | 112.6 | T161 E162 | T161-M164 PolarHBondContact O-N 2.9Å; T161-M164 WeakPolarHBondContact OG1-CB 3.36Å; T161-M164 VanDerWaalsContact OG1-CG 3.24Å; T161-M164 WeakPolarHBondContact OG1-CG 3.45Å; E162-M164 PolarHBondContact O-N 3.33Å |
| 165 | L | 64.7 | Low | 67.4 | Low | 130 Ų | 130 | 116 Ų | 116 | 68% | 0.681 | 63% | 0.632 | S | S | * | * | H | α-helix | trans | -78.3 | -33.3 | 172 | -131.6 | 85.9 | 0 | 0 | 0 | 111.4 | E162 Q168 M169 | E162-L165 PolarHBondContact O-N 2.82Å; L165-Q168 WeakPolarHBondContact O-CB 3.45Å; L165-Q168 PolarHBondContact O-N 3.43Å; L165-M169 VanDerWaalsContact O-CG 3.32Å; L165-M169 WeakPolarHBondContact O-CG 3.39Å; L165-M169 PolarHBondContact O-N 3.09Å |
| 166 | S | 71.8 | Confident | 68.1 | Low | 43 Ų | 43 | 115.4 Ų | 115.4 | 30% | 0.301 | 63% | 0.629 | S | S | . | * | H | α-helix | trans | -64 | -42.5 | 179 | 70.2 | 0 | 0 | 0 | 0 | 111.5 | E162 E163 Q168 M169 L170 | E162-S166 WeakPolarHBondContact O-CB 3.28Å; E162-S166 PolarHBondContact O-N 3.34Å; E162-S166 PolarHBondContact O-OG 3.49Å; E163-S166 VanDerWaalsContact CA-OG 3.3Å; E163-S166 WeakPolarHBondContact CA-OG 3.38Å; E163-S166 PolarHBondContact O-OG 3.05Å; S166-Q168 VanDerWaalsContact C-N 3.3Å; S166-Q168 PolarHBondContact O-N 3.02Å; S166-M169 CarbonylContact O-C 3.56Å; S166-M169 WeakPolarHBondContact O-CB 3.41Å; S166-M169 PolarHBondContact O-N 3Å; S166-M169 VanDerWaalsContact O-N 3.1Å; S166-L170 WeakPolarHBondContact O-CB 3.48Å; S166-L170 VanDerWaalsContact O-CG 3.27Å; S166-L170 WeakPolarHBondContact O-CG 3.34Å; S166-L170 PolarHBondContact O-N 3.35Å |
| 167 | N | 69.5 | Low | 69.3 | Low | 67 Ų | 67 | 118 Ų | 118 | 36% | 0.358 | 64% | 0.636 | S | S | . | * | H | α-helix | trans | -62.8 | -37.8 | 176.6 | -72.3 | -28.7 | 0 | 0 | 0 | 111.8 | E163 M169 L170 S171 | E163-N167 PolarHBondContact O-N 3.43Å; E163-N167 PolarHBondContact O-ND2 2.93Å; E163-N167 VanDerWaalsContact O-ND2 3.1Å; N167-M169 VanDerWaalsContact C-N 3.31Å; N167-M169 PolarHBondContact O-N 3.03Å; N167-L170 PolarHBondContact O-N 3.33Å; N167-S171 WeakPolarHBondContact O-CB 3.38Å; N167-S171 PolarHBondContact O-N 3.4Å; N167-S171 PolarHBondContact O-OG 2.85Å; N167-S171 VanDerWaalsContact O-OG 3.06Å |
| 168 | Q | 74.8 | Confident | 70.5 | Confident | 89 Ų | 89 | 118.8 Ų | 118.8 | 42% | 0.416 | 63% | 0.63 | S | S | . | * | H | α-helix | trans | -64.9 | -33.7 | 173.8 | -176.1 | 63.3 | 50.6 | 0 | 0 | 112.7 | L165 S166 S171 G172 | L165-Q168 WeakPolarHBondContact O-CB 3.45Å; L165-Q168 PolarHBondContact O-N 3.43Å; S166-Q168 VanDerWaalsContact C-N 3.3Å; S166-Q168 PolarHBondContact O-N 3.02Å; Q168-S171 PolarHBondContact O-OG 3.09Å; Q168-G172 CarbonylContact O-C 3.45Å |
| 169 | M | 78.5 | Confident | 72.1 | Confident | 134 Ų | 134 | 116.8 Ų | 116.8 | 66% | 0.66 | 62% | 0.616 | S | S | * | * | H | α-helix | trans | -76.1 | -34.8 | 174.7 | -67.6 | -67.2 | -65.9 | 0 | 0 | 111.9 | L165 S166 N167 | L165-M169 VanDerWaalsContact O-CG 3.32Å; L165-M169 WeakPolarHBondContact O-CG 3.39Å; L165-M169 PolarHBondContact O-N 3.09Å; S166-M169 CarbonylContact O-C 3.56Å; S166-M169 WeakPolarHBondContact O-CB 3.41Å; S166-M169 PolarHBondContact O-N 3Å; S166-M169 VanDerWaalsContact O-N 3.1Å; N167-M169 VanDerWaalsContact C-N 3.31Å; N167-M169 PolarHBondContact O-N 3.03Å |
| 170 | L | 71.4 | Confident | 73.7 | Confident | 142 Ų | 142 | 113.4 Ų | 113.4 | 74% | 0.743 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -76.1 | -35.2 | 178.5 | -71.9 | 171.1 | 0 | 0 | 0 | 112.8 | S166 N167 G172 | S166-L170 WeakPolarHBondContact O-CB 3.48Å; S166-L170 VanDerWaalsContact O-CG 3.27Å; S166-L170 WeakPolarHBondContact O-CG 3.34Å; S166-L170 PolarHBondContact O-N 3.35Å; N167-L170 PolarHBondContact O-N 3.33Å; L170-G172 PolarHBondContact O-N 3.36Å |
| 171 | S | 74.9 | Confident | 75.6 | Confident | 94 Ų | 94 | 110.7 Ų | 110.7 | 66% | 0.657 | 60% | 0.601 | S | S | * | * | S | Bend | trans | -77 | -5.4 | 176.6 | 65.9 | 0 | 0 | 0 | 0 | 113.7 | N167 Q168 | N167-S171 WeakPolarHBondContact O-CB 3.38Å; N167-S171 PolarHBondContact O-N 3.4Å; N167-S171 PolarHBondContact O-OG 2.85Å; N167-S171 VanDerWaalsContact O-OG 3.06Å; Q168-S171 PolarHBondContact O-OG 3.09Å |
| 172 | G | 77.4 | Confident | 77.5 | Confident | 35 Ų | 35 | 109.1 Ų | 109.1 | 36% | 0.361 | 60% | 0.595 | S | S | . | * | trans | 79.5 | 149.5 | -167.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | Q168 L170 P174 | Q168-G172 CarbonylContact O-C 3.45Å; L170-G172 PolarHBondContact O-N 3.36Å; G172-P174 WeakPolarHBondContact O-CD 3.5Å | ||
| 173 | I | 74.6 | Confident | 79 | Confident | 120 Ų | 120 | 107.8 Ų | 107.8 | 62% | 0.615 | 59% | 0.586 | S | S | * | * | trans | -71.4 | 126.3 | 171.1 | -59.8 | 171.4 | 0 | 0 | 0 | 107 | E175 | I173-E175 WeakPolarHBondContact O-CG 3.36Å; I173-E175 PolarHBondContact O-N 3.33Å | ||
| 174 | P | 78.3 | Confident | 80.5 | Confident | 100 Ų | 100 | 105.2 Ų | 105.2 | 65% | 0.649 | 58% | 0.576 | S | S | * | * | trans | -55.3 | 105 | 169.3 | -25.9 | 33 | 0 | 0 | 0 | 108.9 | G172 V176 | G172-P174 WeakPolarHBondContact O-CD 3.5Å; P174-V176 PolarHBondContact O-N 3.3Å | ||
| 175 | E | 78.8 | Confident | 82.3 | Confident | 184 Ų | 184 | 107 Ų | 107 | 86% | 0.86 | 58% | 0.58 | S | S | * | * | trans | -73.2 | 125 | -179.9 | -61.1 | -174 | -171.9 | 0 | 0 | 108.3 | I173 | I173-E175 WeakPolarHBondContact O-CG 3.36Å; I173-E175 PolarHBondContact O-N 3.33Å | ||
| 176 | V | 83.8 | Confident | 83.7 | Confident | 122 Ų | 122 | 105.7 Ų | 105.7 | 74% | 0.739 | 57% | 0.574 | S | S | * | * | trans | -83.5 | 112.6 | 160 | 178.8 | 0 | 0 | 0 | 0 | 105.8 | P174 L178 | P174-V176 PolarHBondContact O-N 3.3Å; V176-L178 HydrophobicContact CG1-CD2 4.29Å; V176-L178 PolarHBondContact O-N 2.89Å | ||
| 177 | D | 86.5 | Confident | 84.8 | Confident | 145 Ų | 145 | 107.9 Ų | 107.9 | 78% | 0.775 | 58% | 0.581 | S | S | * | * | trans | -65.8 | 103.5 | 177.2 | -173.9 | 8.7 | 0 | 0 | 0 | 109.5 | G179 | D177-G179 PolarHBondContact O-N 3.49Å; D177-G179 WeakPolarHBondContact OD1-CA 3.36Å; D177-G179 PolarHBondContact OD1-N 3.29Å | ||
| 178 | L | 85.8 | Confident | 86.1 | Confident | 133 Ų | 133 | 108.7 Ų | 108.7 | 70% | 0.696 | 59% | 0.585 | S | S | * | * | trans | -76.6 | -5 | 175.8 | -59.2 | 178.7 | 0 | 0 | 0 | 112 | V176 A182 | V176-L178 HydrophobicContact CG1-CD2 4.29Å; V176-L178 PolarHBondContact O-N 2.89Å; L178-A182 HydrophobicContact CB-CB 4.05Å; L178-A182 WeakPolarHBondContact O-CB 3.45Å | ||
| 179 | G | 90.5 | Very high | 87.1 | Confident | 27 Ų | 27 | 108.1 Ų | 108.1 | 28% | 0.278 | 59% | 0.59 | S | S | . | * | trans | 81.4 | 153.7 | -176.1 | 0 | 0 | 0 | 0 | 0 | 113.3 | D177 D181 A182 K183 | D177-G179 PolarHBondContact O-N 3.49Å; D177-G179 WeakPolarHBondContact OD1-CA 3.36Å; D177-G179 PolarHBondContact OD1-N 3.29Å; G179-D181 PolarHBondContact O-N 2.79Å; G179-A182 PolarHBondContact O-N 2.79Å; G179-K183 PolarHBondContact O-N 3.5Å | ||
| 180 | I | 91.4 | Very high | 88 | Confident | 127 Ų | 127 | 106.1 Ų | 106.1 | 65% | 0.651 | 59% | 0.586 | S | S | * | * | H | α-helix | trans | -61.6 | -34.3 | 178 | -62.2 | 173.4 | 0 | 0 | 0 | 110.8 | A182 K183 I184 | I180-A182 PolarHBondContact O-N 2.97Å; I180-K183 WeakPolarHBondContact O-CB 3.27Å; I180-K183 PolarHBondContact O-N 3.3Å; I180-K183 VanDerWaalsContact O-N 3.17Å; I180-I184 HydrophobicContact CG2-CD1 3.68Å; I180-I184 HydrophobicContact CG2-CG1 4.08Å; I180-I184 WeakPolarHBondContact O-CG1 3.34Å; I180-I184 PolarHBondContact O-N 3.11Å |
| 181 | D | 94.7 | Very high | 89.2 | Confident | 135 Ų | 135 | 105.3 Ų | 105.3 | 72% | 0.722 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -62.6 | -40 | -179.9 | -63.3 | -35.6 | 0 | 0 | 0 | 112.5 | G179 K183 I184 K185 | G179-D181 PolarHBondContact O-N 2.79Å; D181-K183 VanDerWaalsContact C-N 3.35Å; D181-I184 PolarHBondContact O-N 3.34Å; D181-K185 WeakPolarHBondContact O-CB 3.49Å; D181-K185 PolarHBondContact O-N 3.25Å |
| 182 | A | 94.6 | Very high | 90.2 | Very high | 33 Ų | 33 | 106 Ų | 106 | 27% | 0.273 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -65.9 | -40.2 | 175.5 | 0 | 0 | 0 | 0 | 0 | 111.3 | L178 G179 I180 K185 N186 | L178-A182 HydrophobicContact CB-CB 4.05Å; L178-A182 WeakPolarHBondContact O-CB 3.45Å; G179-A182 PolarHBondContact O-N 2.79Å; I180-A182 PolarHBondContact O-N 2.97Å; A182-K185 PolarHBondContact O-N 3.49Å; A182-N186 VanDerWaalsContact O-CG 3.3Å; A182-N186 PolarHBondContact O-N 2.9Å; A182-N186 PolarHBondContact O-ND2 3.1Å |
| 183 | K | 93.8 | Very high | 91 | Very high | 148 Ų | 148 | 107.2 Ų | 107.2 | 64% | 0.643 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -62.5 | -46.3 | 175 | -168.3 | 173.7 | -171.1 | 171.3 | 0 | 111.5 | G179 I180 D181 N186 I187 | G179-K183 PolarHBondContact O-N 3.5Å; I180-K183 WeakPolarHBondContact O-CB 3.27Å; I180-K183 PolarHBondContact O-N 3.3Å; I180-K183 VanDerWaalsContact O-N 3.17Å; D181-K183 VanDerWaalsContact C-N 3.35Å; K183-N186 PolarHBondContact O-N 2.88Å; K183-I187 HydrophobicContact CG-CD1 4.16Å; K183-I187 VanDerWaalsContact O-CG1 3.25Å; K183-I187 WeakPolarHBondContact O-CG1 3.42Å; K183-I187 PolarHBondContact O-N 2.88Å |
| 184 | I | 94.9 | Very high | 92 | Very high | 80 Ų | 80 | 108.2 Ų | 108.2 | 41% | 0.41 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -61.9 | -44.9 | 176.7 | -69.3 | 172.2 | 0 | 0 | 0 | 110.6 | I180 D181 N186 I187 I188 | I180-I184 HydrophobicContact CG2-CD1 3.68Å; I180-I184 HydrophobicContact CG2-CG1 4.08Å; I180-I184 WeakPolarHBondContact O-CG1 3.34Å; I180-I184 PolarHBondContact O-N 3.11Å; D181-I184 PolarHBondContact O-N 3.34Å; I184-N186 VanDerWaalsContact C-N 3.32Å; I184-N186 PolarHBondContact O-N 3.11Å; I184-I187 WeakPolarHBondContact O-CB 3.21Å; I184-I187 PolarHBondContact O-N 3.18Å; I184-I187 VanDerWaalsContact O-N 3.15Å; I184-I188 HydrophobicContact CG2-CD1 3.67Å; I184-I188 HydrophobicContact CG2-CG1 4.24Å; I184-I188 WeakPolarHBondContact O-CG1 3.39Å; I184-I188 PolarHBondContact O-N 2.99Å |
| 185 | K | 97 | Very high | 92.8 | Very high | 159 Ų | 159 | 106.1 Ų | 106.1 | 69% | 0.691 | 57% | 0.572 | S | S | * | * | H | α-helix | trans | -59.7 | -41.7 | 178.2 | -173.6 | 178.8 | 179.5 | -178.8 | 0 | 112.3 | D181 A182 S189 | D181-K185 WeakPolarHBondContact O-CB 3.49Å; D181-K185 PolarHBondContact O-N 3.25Å; A182-K185 PolarHBondContact O-N 3.49Å; K185-S189 WeakPolarHBondContact O-CB 3.4Å; K185-S189 PolarHBondContact O-N 3.03Å |
| 186 | N | 94.9 | Very high | 93.5 | Very high | 103 Ų | 103 | 106.7 Ų | 106.7 | 55% | 0.551 | 57% | 0.566 | S | S | * | * | H | α-helix | trans | -65.2 | -43 | 175.2 | -70.4 | -17 | 0 | 0 | 0 | 111.3 | A182 K183 I184 S189 T190 | A182-N186 VanDerWaalsContact O-CG 3.3Å; A182-N186 PolarHBondContact O-N 2.9Å; A182-N186 PolarHBondContact O-ND2 3.1Å; K183-N186 PolarHBondContact O-N 2.88Å; I184-N186 VanDerWaalsContact C-N 3.32Å; I184-N186 PolarHBondContact O-N 3.11Å; N186-S189 PolarHBondContact O-N 2.98Å; N186-T190 VanDerWaalsContact O-CG2 3.28Å; N186-T190 WeakPolarHBondContact O-CG2 3.38Å; N186-T190 PolarHBondContact O-N 3.31Å; N186-T190 PolarHBondContact O-OG1 3.33Å |
| 187 | I | 94.6 | Very high | 93.8 | Very high | 89 Ų | 89 | 105.3 Ų | 105.3 | 46% | 0.456 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -58.7 | -51.3 | 175.9 | -68.7 | 163.8 | 0 | 0 | 0 | 110.3 | K183 I184 S189 T190 E191 | K183-I187 HydrophobicContact CG-CD1 4.16Å; K183-I187 VanDerWaalsContact O-CG1 3.25Å; K183-I187 WeakPolarHBondContact O-CG1 3.42Å; K183-I187 PolarHBondContact O-N 2.88Å; I184-I187 WeakPolarHBondContact O-CB 3.21Å; I184-I187 PolarHBondContact O-N 3.18Å; I184-I187 VanDerWaalsContact O-N 3.15Å; I187-S189 VanDerWaalsContact C-N 3.35Å; I187-S189 PolarHBondContact O-N 3.47Å; I187-T190 PolarHBondContact O-N 3Å; I187-T190 PolarHBondContact O-OG1 2.92Å; I187-E191 WeakPolarHBondContact O-CB 3.46Å; I187-E191 PolarHBondContact O-N 2.94Å |
| 188 | I | 96.1 | Very high | 94 | Very high | 84 Ų | 84 | 102 Ų | 102 | 43% | 0.431 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -58.6 | -47 | 178.5 | -65.9 | 168.4 | 0 | 0 | 0 | 110.5 | I184 T190 E191 D192 | I184-I188 HydrophobicContact CG2-CD1 3.67Å; I184-I188 HydrophobicContact CG2-CG1 4.24Å; I184-I188 WeakPolarHBondContact O-CG1 3.39Å; I184-I188 PolarHBondContact O-N 2.99Å; I188-T190 VanDerWaalsContact C-N 3.31Å; I188-T190 PolarHBondContact O-N 3.24Å; I188-E191 PolarHBondContact O-N 3.15Å; I188-E191 VanDerWaalsContact O-N 3.17Å; I188-D192 WeakPolarHBondContact O-CB 3.44Å; I188-D192 PolarHBondContact O-N 2.89Å |
| 189 | S | 96.4 | Very high | 94.1 | Very high | 76 Ų | 76 | 97.9 Ų | 97.9 | 53% | 0.531 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -61.1 | -39.5 | 179.6 | -176.3 | 0 | 0 | 0 | 0 | 112.6 | K185 N186 I187 A193 | K185-S189 WeakPolarHBondContact O-CB 3.4Å; K185-S189 PolarHBondContact O-N 3.03Å; N186-S189 PolarHBondContact O-N 2.98Å; I187-S189 VanDerWaalsContact C-N 3.35Å; I187-S189 PolarHBondContact O-N 3.47Å; S189-A193 WeakPolarHBondContact O-CB 3.3Å; S189-A193 PolarHBondContact O-N 2.97Å; S189-A193 VanDerWaalsContact O-N 3.1Å |
| 190 | T | 96.9 | Very high | 94 | Very high | 93 Ų | 93 | 101 Ų | 101 | 57% | 0.571 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -71.3 | -35.7 | 176.4 | 59.8 | 0 | 0 | 0 | 0 | 112.4 | N186 I187 I188 K194 | N186-T190 VanDerWaalsContact O-CG2 3.28Å; N186-T190 WeakPolarHBondContact O-CG2 3.38Å; N186-T190 PolarHBondContact O-N 3.31Å; N186-T190 PolarHBondContact O-OG1 3.33Å; I187-T190 PolarHBondContact O-N 3Å; I187-T190 PolarHBondContact O-OG1 2.92Å; I188-T190 VanDerWaalsContact C-N 3.31Å; I188-T190 PolarHBondContact O-N 3.24Å; T190-K194 VanDerWaalsContact O-CB 3.27Å; T190-K194 WeakPolarHBondContact O-CB 3.44Å; T190-K194 PolarHBondContact O-N 3.35Å |
| 191 | E | 96.5 | Very high | 93.7 | Very high | 125 Ų | 125 | 99.8 Ų | 99.8 | 58% | 0.584 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -69.8 | -44 | 177.3 | -173.6 | 171.2 | -159.7 | 0 | 0 | 111.5 | I187 I188 A193 K194 A195 | I187-E191 WeakPolarHBondContact O-CB 3.46Å; I187-E191 PolarHBondContact O-N 2.94Å; I188-E191 PolarHBondContact O-N 3.15Å; I188-E191 VanDerWaalsContact O-N 3.17Å; E191-A193 PolarHBondContact O-N 3.24Å; E191-K194 WeakPolarHBondContact O-CB 3.16Å; E191-K194 PolarHBondContact O-N 3.34Å; E191-A195 WeakPolarHBondContact O-CB 3.25Å; E191-A195 PolarHBondContact O-N 3.47Å |
| 192 | D | 95.9 | Very high | 93 | Very high | 108 Ų | 108 | 99.2 Ų | 99.2 | 58% | 0.578 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -61.5 | -44.3 | 174.8 | -80.4 | -14.1 | 0 | 0 | 0 | 111.4 | I188 K194 A195 R196 | I188-D192 WeakPolarHBondContact O-CB 3.44Å; I188-D192 PolarHBondContact O-N 2.89Å; D192-K194 VanDerWaalsContact C-N 3.35Å; D192-K194 PolarHBondContact O-N 3.13Å; D192-A195 PolarHBondContact O-N 3.38Å; D192-R196 WeakPolarHBondContact O-CB 3.48Å; D192-R196 PolarHBondContact O-N 3.32Å |
| 193 | A | 95.1 | Very high | 92 | Very high | 60 Ų | 60 | 101.5 Ų | 101.5 | 50% | 0.496 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -62.2 | -42.5 | 175.8 | 0 | 0 | 0 | 0 | 0 | 111.7 | S189 E191 R196 L197 | S189-A193 WeakPolarHBondContact O-CB 3.3Å; S189-A193 PolarHBondContact O-N 2.97Å; S189-A193 VanDerWaalsContact O-N 3.1Å; E191-A193 PolarHBondContact O-N 3.24Å; A193-R196 PolarHBondContact O-N 3.47Å; A193-L197 WeakPolarHBondContact O-CB 3.49Å; A193-L197 PolarHBondContact O-N 2.88Å |
| 194 | K | 96.4 | Very high | 90.8 | Very high | 142 Ų | 142 | 100 Ų | 100 | 62% | 0.617 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -64.1 | -43.2 | 175.4 | -177.4 | -178.6 | 178.8 | -178 | 0 | 111.8 | T190 E191 D192 L197 L198 | T190-K194 VanDerWaalsContact O-CB 3.27Å; T190-K194 WeakPolarHBondContact O-CB 3.44Å; T190-K194 PolarHBondContact O-N 3.35Å; E191-K194 WeakPolarHBondContact O-CB 3.16Å; E191-K194 PolarHBondContact O-N 3.34Å; D192-K194 VanDerWaalsContact C-N 3.35Å; D192-K194 PolarHBondContact O-N 3.13Å; K194-L197 PolarHBondContact O-N 2.95Å; K194-L198 HydrophobicContact CG-CD1 4.3Å; K194-L198 WeakPolarHBondContact O-CB 3.38Å; K194-L198 WeakPolarHBondContact O-CG 3.43Å; K194-L198 PolarHBondContact O-N 3.03Å |
| 195 | A | 93.4 | Very high | 89.2 | Confident | 55 Ų | 55 | 104.4 Ų | 104.4 | 46% | 0.455 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -63.7 | -42.7 | 177.7 | 0 | 0 | 0 | 0 | 0 | 111.4 | E191 D192 L198 A199 | E191-A195 WeakPolarHBondContact O-CB 3.25Å; E191-A195 PolarHBondContact O-N 3.47Å; D192-A195 PolarHBondContact O-N 3.38Å; A195-L198 PolarHBondContact O-N 3.48Å; A195-A199 WeakPolarHBondContact O-CB 3.37Å; A195-A199 PolarHBondContact O-N 3.39Å |
| 196 | R | 93.3 | Very high | 87.5 | Confident | 197 Ų | 197 | 104.1 Ų | 104.1 | 74% | 0.743 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -62.4 | -44.6 | 175.2 | -173.1 | 176.1 | 179.1 | 169 | 0.3 | 112 | D192 A193 A199 E200 | D192-R196 WeakPolarHBondContact O-CB 3.48Å; D192-R196 PolarHBondContact O-N 3.32Å; A193-R196 PolarHBondContact O-N 3.47Å; R196-A199 PolarHBondContact O-N 2.95Å; R196-E200 WeakPolarHBondContact O-CB 3.47Å; R196-E200 PolarHBondContact O-N 3.23Å |
| 197 | L | 90.7 | Very high | 85.6 | Confident | 92 Ų | 92 | 105.4 Ų | 105.4 | 48% | 0.482 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -62.6 | -42.6 | 176.8 | -178.8 | 157.6 | 0 | 0 | 0 | 111.5 | A193 K194 E200 Q201 | A193-L197 WeakPolarHBondContact O-CB 3.49Å; A193-L197 PolarHBondContact O-N 2.88Å; K194-L197 PolarHBondContact O-N 2.95Å; L197-E200 PolarHBondContact O-N 3.46Å; L197-Q201 HydrophobicContact CD2-CG 4.26Å; L197-Q201 WeakPolarHBondContact O-CG 3.33Å; L197-Q201 PolarHBondContact O-N 3.02Å |
| 198 | L | 90.2 | Very high | 83.6 | Confident | 77 Ų | 77 | 104.1 Ų | 104.1 | 40% | 0.403 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -66 | -39.2 | 175.6 | -74.2 | 173 | 0 | 0 | 0 | 112.3 | K194 A195 Q201 Q202 | K194-L198 HydrophobicContact CG-CD1 4.3Å; K194-L198 WeakPolarHBondContact O-CB 3.38Å; K194-L198 WeakPolarHBondContact O-CG 3.43Å; K194-L198 PolarHBondContact O-N 3.03Å; A195-L198 PolarHBondContact O-N 3.48Å; L198-Q201 PolarHBondContact O-N 3.37Å; L198-Q202 WeakPolarHBondContact O-CB 3.39Å; L198-Q202 VanDerWaalsContact O-CG 3.29Å; L198-Q202 WeakPolarHBondContact O-CG 3.2Å; L198-Q202 PolarHBondContact O-N 3.33Å |
| 199 | A | 89.5 | Confident | 81.5 | Confident | 45 Ų | 45 | 106.7 Ų | 106.7 | 37% | 0.372 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -64.7 | -43.1 | 174.5 | 0 | 0 | 0 | 0 | 0 | 111.3 | A195 R196 Q202 N203 | A195-A199 WeakPolarHBondContact O-CB 3.37Å; A195-A199 PolarHBondContact O-N 3.39Å; R196-A199 PolarHBondContact O-N 2.95Å; A199-Q202 PolarHBondContact O-N 3.38Å; A199-N203 WeakPolarHBondContact O-CB 3.3Å; A199-N203 PolarHBondContact O-N 2.98Å; A199-N203 PolarHBondContact O-ND2 3.45Å |
| 200 | E | 87.1 | Confident | 79.5 | Confident | 94 Ų | 94 | 107.8 Ų | 107.8 | 44% | 0.439 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -63.6 | -40.8 | 175.3 | -167.1 | -173.3 | 153 | 0 | 0 | 111.5 | R196 L197 Q202 N203 K204 | R196-E200 WeakPolarHBondContact O-CB 3.47Å; R196-E200 PolarHBondContact O-N 3.23Å; L197-E200 PolarHBondContact O-N 3.46Å; E200-Q202 VanDerWaalsContact C-N 3.35Å; E200-Q202 PolarHBondContact O-N 3.47Å; E200-N203 PolarHBondContact O-N 3.34Å; E200-K204 HydrophobicContact CG-CD 4.39Å; E200-K204 WeakPolarHBondContact O-CB 3.4Å; E200-K204 VanDerWaalsContact O-CG 3.26Å; E200-K204 WeakPolarHBondContact O-CG 3.29Å; E200-K204 PolarHBondContact O-N 2.7Å; E200-K204 WeakPolarHBondContact OE1-CE 3.48Å; E200-K204 IonicContact OE1-NZ 2.7Å; E200-K204 PolarHBondContact OE1-NZ 3.24Å |
| 201 | Q | 84.9 | Confident | 77.5 | Confident | 101 Ų | 101 | 109.4 Ų | 109.4 | 47% | 0.472 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -64.1 | -37.8 | 173.6 | -74.9 | -174.2 | 18 | 0 | 0 | 112.7 | L197 L198 K205 | L197-Q201 HydrophobicContact CD2-CG 4.26Å; L197-Q201 WeakPolarHBondContact O-CG 3.33Å; L197-Q201 PolarHBondContact O-N 3.02Å; L198-Q201 PolarHBondContact O-N 3.37Å; Q201-K205 WeakPolarHBondContact O-CG 3.43Å; Q201-K205 PolarHBondContact O-N 2.95Å |
| 202 | Q | 81 | Confident | 75.4 | Confident | 122 Ų | 122 | 112.3 Ų | 112.3 | 57% | 0.57 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -70.1 | -36.8 | 175.7 | -73.8 | 179.1 | 41 | 0 | 0 | 112.1 | L198 A199 E200 K205 | L198-Q202 WeakPolarHBondContact O-CB 3.39Å; L198-Q202 VanDerWaalsContact O-CG 3.29Å; L198-Q202 WeakPolarHBondContact O-CG 3.2Å; L198-Q202 PolarHBondContact O-N 3.33Å; A199-Q202 PolarHBondContact O-N 3.38Å; E200-Q202 VanDerWaalsContact C-N 3.35Å; E200-Q202 PolarHBondContact O-N 3.47Å; Q202-K205 PolarHBondContact O-N 3.04Å |
| 203 | N | 74.5 | Confident | 73.3 | Confident | 82 Ų | 82 | 112.4 Ų | 112.4 | 44% | 0.439 | 58% | 0.579 | S | S | . | * | H | α-helix | trans | -72.5 | -37.8 | 176.1 | -67 | -15.4 | 0 | 0 | 0 | 111 | A199 E200 K205 K206 D207 | A199-N203 WeakPolarHBondContact O-CB 3.3Å; A199-N203 PolarHBondContact O-N 2.98Å; A199-N203 PolarHBondContact O-ND2 3.45Å; E200-N203 PolarHBondContact O-N 3.34Å; N203-K205 PolarHBondContact O-N 3.38Å; N203-K206 CarbonylContact O-C 3.53Å; N203-K206 WeakPolarHBondContact O-CA 3.29Å; N203-K206 PolarHBondContact O-N 3.4Å; N203-D207 WeakPolarHBondContact O-CB 3.36Å; N203-D207 PolarHBondContact O-N 3.41Å |
| 204 | K | 67.4 | Low | 71.7 | Confident | 117 Ų | 117 | 115 Ų | 115 | 51% | 0.509 | 59% | 0.591 | S | S | . | * | H | α-helix | trans | -58.2 | -33.2 | 171 | -77.7 | 174.3 | -179.2 | 170.5 | 0 | 112.3 | E200 K206 S208 | E200-K204 HydrophobicContact CG-CD 4.39Å; E200-K204 WeakPolarHBondContact O-CB 3.4Å; E200-K204 VanDerWaalsContact O-CG 3.26Å; E200-K204 WeakPolarHBondContact O-CG 3.29Å; E200-K204 PolarHBondContact O-N 2.7Å; E200-K204 WeakPolarHBondContact OE1-CE 3.48Å; E200-K204 IonicContact OE1-NZ 2.7Å; E200-K204 PolarHBondContact OE1-NZ 3.24Å; K204-K206 PolarHBondContact O-N 3.38Å; K204-S208 WeakPolarHBondContact O-CA 3.4Å; K204-S208 WeakPolarHBondContact O-CB 3.47Å; K204-S208 PolarHBondContact O-N 3.09Å; K204-S208 PolarHBondContact O-OG 3.45Å |
| 205 | K | 62.1 | Low | 69.9 | Low | 171 Ų | 171 | 113.4 Ų | 113.4 | 74% | 0.743 | 59% | 0.593 | S | S | * | * | H | α-helix | trans | -70.6 | -16.2 | 173.3 | -69.2 | 178.1 | -177.4 | -176 | 0 | 114.1 | Q201 Q202 N203 | Q201-K205 WeakPolarHBondContact O-CG 3.43Å; Q201-K205 PolarHBondContact O-N 2.95Å; Q202-K205 PolarHBondContact O-N 3.04Å; N203-K205 PolarHBondContact O-N 3.38Å |
| 206 | K | 60.1 | Low | 68.3 | Low | 154 Ų | 154 | 115.2 Ų | 115.2 | 67% | 0.67 | 60% | 0.595 | S | S | * | * | H | α-helix | trans | -102.3 | -34.2 | 178.4 | -65.4 | 180 | -179.4 | 176.9 | 0 | 112.2 | N203 K204 | N203-K206 CarbonylContact O-C 3.53Å; N203-K206 WeakPolarHBondContact O-CA 3.29Å; N203-K206 PolarHBondContact O-N 3.4Å; K204-K206 PolarHBondContact O-N 3.38Å |
| 207 | D | 56.5 | Low | 66.5 | Low | 129 Ų | 129 | 114.7 Ų | 114.7 | 69% | 0.69 | 60% | 0.603 | S | S | * | * | H | α-helix | trans | -97.2 | -4.7 | -180 | -65.9 | -25.5 | 0 | 0 | 0 | 112.5 | N203 E209 | N203-D207 WeakPolarHBondContact O-CB 3.36Å; N203-D207 PolarHBondContact O-N 3.41Å; D207-E209 PolarHBondContact O-N 3.4Å; D207-E209 VanDerWaalsContact O-N 3.09Å |
| 208 | S | 51.6 | Low | 65 | Low | 62 Ų | 62 | 114.5 Ų | 114.5 | 43% | 0.434 | 62% | 0.615 | S | S | . | * | trans | -78.5 | 33.9 | 165.1 | 78.3 | 0 | 0 | 0 | 0 | 112.6 | K204 T210 | K204-S208 WeakPolarHBondContact O-CA 3.4Å; K204-S208 WeakPolarHBondContact O-CB 3.47Å; K204-S208 PolarHBondContact O-N 3.09Å; K204-S208 PolarHBondContact O-OG 3.45Å; S208-T210 PolarHBondContact O-N 2.89Å | ||
| 209 | E | 51.8 | Low | 63.3 | Low | 139 Ų | 139 | 114.4 Ų | 114.4 | 65% | 0.65 | 62% | 0.618 | S | S | * | * | trans | -73.5 | 49.9 | 148.3 | -149.1 | 93.5 | -132.8 | 0 | 0 | 107.8 | D207 S211 T215 | D207-E209 PolarHBondContact O-N 3.4Å; D207-E209 VanDerWaalsContact O-N 3.09Å; E209-S211 PolarHBondContact O-N 2.83Å; E209-T215 PolarHBondContact OE1-OG1 3.3Å; E209-T215 VanDerWaalsContact OE1-OG1 3.09Å | ||
| 210 | T | 54.3 | Low | 61.7 | Low | 98 Ų | 98 | 119.4 Ų | 119.4 | 60% | 0.601 | 64% | 0.638 | S | S | * | * | trans | -70.8 | 118.2 | 168.1 | 52.4 | 0 | 0 | 0 | 0 | 106 | S208 F212 | S208-T210 PolarHBondContact O-N 2.89Å; T210-F212 PolarHBondContact O-N 3.23Å | ||
| 211 | S | 55.2 | Low | 59.8 | Low | 127 Ų | 127 | 124.3 Ų | 124.3 | 89% | 0.888 | 65% | 0.654 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -59.8 | 30.3 | -164.1 | 62 | 0 | 0 | 0 | 0 | 117.7 | E209 | E209-S211 PolarHBondContact O-N 2.83Š|
| 212 | F | 51.8 | Low | 58.5 | Low | 186 Ų | 186 | 124.3 Ų | 124.3 | 82% | 0.816 | 66% | 0.66 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -136.7 | -6.6 | -173.2 | -161.7 | -107 | 0 | 0 | 0 | 115.4 | T210 | T210-F212 PolarHBondContact O-N 3.23Š|
| 213 | V | 51.7 | Low | 57.3 | Low | 110 Ų | 110 | 127.5 Ų | 127.5 | 67% | 0.667 | 68% | 0.675 | S | S | * | * | S | Bend | trans | -136.8 | 108.3 | 177.7 | -173.1 | 0 | 0 | 0 | 0 | 110.6 | T215 | V213-T215 PolarHBondContact O-N 3.39Š|
| 214 | P | 61.9 | Low | 56.4 | Low | 116 Ų | 116 | 131.1 Ų | 131.1 | 75% | 0.753 | 69% | 0.689 | S | S | * | * | trans | -60.2 | 126.7 | -176.6 | -27.7 | 36.1 | 0 | 0 | 0 | 114.4 | N216 | P214-N216 PolarHBondContact O-N 2.94Š| ||
| 215 | T | 58.4 | Low | 55.9 | Low | 107 Ų | 107 | 132.4 Ų | 132.4 | 66% | 0.656 | 70% | 0.702 | S | S | * | * | S | Bend | trans | -72.1 | 18.3 | -179.2 | 40.5 | 0 | 0 | 0 | 0 | 114.6 | E209 V213 | E209-T215 PolarHBondContact OE1-OG1 3.3Å; E209-T215 VanDerWaalsContact OE1-OG1 3.09Å; V213-T215 PolarHBondContact O-N 3.39Å |
| 216 | N | 60.9 | Low | 55.5 | Low | 93 Ų | 93 | 134.3 Ų | 134.3 | 50% | 0.497 | 70% | 0.704 | S | S | . | * | trans | -129.4 | 99.7 | 178.7 | -168.5 | -8.8 | 0 | 0 | 0 | 110.7 | P214 A218 V219 | P214-N216 PolarHBondContact O-N 2.94Å; N216-A218 PolarHBondContact O-N 2.89Å; N216-A218 WeakPolarHBondContact OD1-CA 3.36Å; N216-A218 WeakPolarHBondContact OD1-CB 3.06Å; N216-A218 PolarHBondContact OD1-N 3.39Å; N216-V219 HydrophobicContact CB-CG2 3.67Å; N216-V219 VanDerWaalsContact CG-CG2 3.45Å; N216-V219 WeakPolarHBondContact O-CG2 3.26Å | ||
| 217 | M | 55.7 | Low | 55.3 | Low | 187 Ų | 187 | 134.8 Ų | 134.8 | 92% | 0.921 | 71% | 0.707 | S | S | * | * | G | 310 helix | trans | -69.8 | -10.6 | 172.9 | -70.4 | -163.1 | 166.4 | 0 | 0 | 113.2 | V219 | M217-V219 PolarHBondContact O-N 3.42Š|
| 218 | A | 58.7 | Low | 54.9 | Low | 88 Ų | 88 | 137.6 Ų | 137.6 | 73% | 0.727 | 71% | 0.709 | S | S | * | * | G | 310 helix | trans | -81.1 | 1.9 | -179.4 | 0 | 0 | 0 | 0 | 0 | 113.9 | N216 | N216-A218 PolarHBondContact O-N 2.89Å; N216-A218 WeakPolarHBondContact OD1-CA 3.36Å; N216-A218 WeakPolarHBondContact OD1-CB 3.06Å; N216-A218 PolarHBondContact OD1-N 3.39Å |
| 219 | V | 55.2 | Low | 54.9 | Low | 75 Ų | 75 | 143.4 Ų | 143.4 | 46% | 0.455 | 73% | 0.729 | S | S | . | * | G | 310 helix | trans | -103.8 | 0.4 | 178.2 | -139.4 | 0 | 0 | 0 | 0 | 112.7 | N216 M217 Y221 | N216-V219 HydrophobicContact CB-CG2 3.67Å; N216-V219 VanDerWaalsContact CG-CG2 3.45Å; N216-V219 WeakPolarHBondContact O-CG2 3.26Å; M217-V219 PolarHBondContact O-N 3.42Å; V219-Y221 HydrophobicContact CG1-CE2 4.07Å; V219-Y221 WeakPolarHBondContact O-CD2 3.44Å; V219-Y221 WeakPolarHBondContact O-CE2 2.94Å; V219-Y221 PolarHBondContact O-N 2.86Å |
| 220 | N | 54.3 | Low | 54.8 | Low | 149 Ų | 149 | 146 Ų | 146 | 80% | 0.797 | 74% | 0.741 | S | S | * | * | S | Bend | trans | -91.9 | 84.8 | 171.9 | -148.6 | 4.4 | 0 | 0 | 0 | 109.3 | V222 | N220-V222 PolarHBondContact O-N 2.89Š|
| 221 | Y | 47 | Very low | 54.4 | Low | 197 Ų | 197 | 149.8 Ų | 149.8 | 77% | 0.773 | 75% | 0.752 | S | S | * | * | trans | -55.1 | 91.4 | -179 | -62.9 | -90.7 | 0 | 0 | 0 | 112.9 | V219 | V219-Y221 HydrophobicContact CG1-CE2 4.07Å; V219-Y221 WeakPolarHBondContact O-CD2 3.44Å; V219-Y221 WeakPolarHBondContact O-CE2 2.94Å; V219-Y221 PolarHBondContact O-N 2.86Å | ||
| 222 | V | 57.8 | Low | 54.1 | Low | 101 Ų | 101 | 151.2 Ų | 151.2 | 61% | 0.612 | 75% | 0.748 | S | S | * | * | trans | -146.4 | 95.8 | 145.9 | -160.2 | 0 | 0 | 0 | 0 | 109.2 | N220 H224 | N220-V222 PolarHBondContact O-N 2.89Å; V222-H224 VanDerWaalsContact C-N 3.31Å; V222-H224 WeakPolarHBondContact CG1-CE1 3.47Å; V222-H224 VanDerWaalsContact CG1-ND1 3.3Å; V222-H224 WeakPolarHBondContact CG1-ND1 3.38Å; V222-H224 PolarHBondContact O-N 3.34Å | ||
| 223 | Q | 55.9 | Low | 53.8 | Low | 189 Ų | 189 | 149.5 Ų | 149.5 | 88% | 0.883 | 75% | 0.748 | S | S | * | * | trans | -65.7 | 82.5 | 175.1 | -71.5 | 177.8 | -29.7 | 0 | 0 | 111 | N225 | Q223-N225 PolarHBondContact O-N 3.29Å; Q223-N225 VanDerWaalsContact O-N 3.13Å | ||
| 224 | H | 55.1 | Low | 53.8 | Low | 158 Ų | 158 | 148.4 Ų | 148.4 | 73% | 0.731 | 75% | 0.751 | S | S | * | * | trans | -84.7 | 51.2 | 170.5 | -73.9 | 98.9 | 0 | 0 | 0 | 111.8 | V222 | V222-H224 VanDerWaalsContact C-N 3.31Å; V222-H224 WeakPolarHBondContact CG1-CE1 3.47Å; V222-H224 VanDerWaalsContact CG1-ND1 3.3Å; V222-H224 WeakPolarHBondContact CG1-ND1 3.38Å; V222-H224 PolarHBondContact O-N 3.34Å | ||
| 225 | N | 57.3 | Low | 53.1 | Low | 144 Ų | 144 | 148.5 Ų | 148.5 | 77% | 0.77 | 75% | 0.751 | S | S | * | * | trans | -129.1 | 30.8 | 170 | -78.9 | -21.5 | 0 | 0 | 0 | 111.3 | Q223 F227 | Q223-N225 PolarHBondContact O-N 3.29Å; Q223-N225 VanDerWaalsContact O-N 3.13Å; N225-F227 VanDerWaalsContact C-N 3.3Å; N225-F227 PolarHBondContact O-N 2.91Å | ||
| 226 | R | 54.1 | Low | 52.9 | Low | 211 Ų | 211 | 150.7 Ų | 150.7 | 80% | 0.796 | 76% | 0.757 | S | S | * | * | S | Bend | trans | -79.4 | -4.9 | -178.3 | -166.4 | 164.7 | -178.5 | -103.8 | -0.8 | 114.1 | ||
| 227 | F | 55.4 | Low | 52.5 | Low | 165 Ų | 165 | 156.2 Ų | 156.2 | 72% | 0.724 | 77% | 0.771 | S | S | * | * | S | Bend | trans | -138.5 | 4.9 | -167.7 | -83.6 | -79.4 | 0 | 0 | 0 | 117.6 | N225 | N225-F227 VanDerWaalsContact C-N 3.3Å; N225-F227 PolarHBondContact O-N 2.91Å |
| 228 | Y | 48.8 | Very low | 52.5 | Low | 188 Ų | 188 | 158.3 Ų | 158.3 | 74% | 0.737 | 77% | 0.769 | S | S | * | * | trans | -129.5 | 91.2 | 179.2 | -62.1 | -75 | 0 | 0 | 0 | 111.1 | ||||
| 229 | H | 51 | Low | 52.1 | Low | 184 Ų | 184 | 161 Ų | 161 | 85% | 0.852 | 77% | 0.771 | S | S | * | * | 168.4 | 98.6 | 117.2 | -84.9 | -58.5 | 0 | 0 | 0 | 109.8 | |||||
| 230 | E | 51.3 | Low | 52.2 | Low | 194 Ų | 194 | 166.6 Ų | 166.6 | 91% | 0.907 | 79% | 0.789 | S | S | * | * | trans | -54.5 | 143.1 | 162.9 | -156 | 160.7 | -161 | 0 | 0 | 110.6 | ||||
| 231 | E | 44.1 | Very low | 52.2 | Low | 177 Ų | 177 | 167.1 Ų | 167.1 | 83% | 0.827 | 79% | 0.787 | S | S | * | * | trans | -59.7 | 141.9 | -170.1 | -49.6 | -179.3 | 154.9 | 0 | 0 | 112.9 | ||||
| 232 | L | 50.6 | Low | 53 | Low | 156 Ų | 156 | 165.7 Ų | 165.7 | 82% | 0.817 | 79% | 0.787 | S | S | * | * | trans | -164.2 | 97.5 | 137.4 | -78.8 | -165.4 | 0 | 0 | 0 | 109.6 | ||||
| 233 | N | 44.2 | Very low | 53.3 | Low | 151 Ų | 151 | 167 Ų | 167 | 81% | 0.807 | 80% | 0.798 | S | S | * | * | trans | 67 | 95.9 | 148.2 | -57.1 | -39.5 | 0 | 0 | 0 | 119.7 | ||||
| 234 | A | 52 | Low | 53.7 | Low | 87 Ų | 87 | 166.5 Ų | 166.5 | 72% | 0.719 | 79% | 0.793 | S | S | * | * | 147.5 | 130.3 | 117.8 | 0 | 0 | 0 | 0 | 0 | 113.3 | I236 | A234-I236 PolarHBondContact O-N 2.83Š| |||
| 235 | P | 46.8 | Very low | 54.1 | Low | 118 Ų | 118 | 163.6 Ų | 163.6 | 77% | 0.766 | 80% | 0.796 | S | S | * | * | trans | -82.5 | 102 | 175.2 | 32.6 | -29.8 | 0 | 0 | 0 | 110.2 | R237 | P235-R237 VanDerWaalsContact C-N 3.28Å; P235-R237 PolarHBondContact O-N 3.2Å | ||
| 236 | I | 53.9 | Low | 54.7 | Low | 152 Ų | 152 | 167.7 Ų | 167.7 | 78% | 0.779 | 80% | 0.801 | S | S | * | * | trans | -73.9 | 89.7 | 164.5 | -64 | 170.3 | 0 | 0 | 0 | 107.5 | A234 R238 | A234-I236 PolarHBondContact O-N 2.83Å; I236-R238 HydrophobicContact CG2-CG 4.38Å; I236-R238 PolarHBondContact O-N 2.93Å | ||
| 237 | R | 54.3 | Low | 55.3 | Low | 209 Ų | 209 | 163.8 Ų | 163.8 | 79% | 0.789 | 80% | 0.803 | S | S | * | * | trans | -64.3 | 100.9 | 166.7 | -71.6 | -161 | 172.3 | -161.8 | -0.2 | 109.1 | P235 N239 | P235-R237 VanDerWaalsContact C-N 3.28Å; P235-R237 PolarHBondContact O-N 3.2Å; R237-N239 VanDerWaalsContact C-N 3.28Å; R237-N239 PolarHBondContact O-N 3.47Å | ||
| 238 | R | 55.5 | Low | 55.6 | Low | 232 Ų | 232 | 163.6 Ų | 163.6 | 88% | 0.875 | 81% | 0.808 | S | S | * | * | trans | -74.4 | 85.4 | 163 | -72.1 | -179.1 | 169.5 | 164.8 | -1.6 | 108.2 | I236 K240 | I236-R238 HydrophobicContact CG2-CG 4.38Å; I236-R238 PolarHBondContact O-N 2.93Å; R238-K240 VanDerWaalsContact C-N 3.33Å; R238-K240 PolarHBondContact O-N 3Å | ||
| 239 | N | 49.8 | Very low | 56.3 | Low | 144 Ų | 144 | 164.9 Ų | 164.9 | 77% | 0.77 | 81% | 0.812 | S | S | * | * | trans | -65.3 | 97.5 | 162.4 | -80.1 | -22.1 | 0 | 0 | 0 | 107.8 | R237 E241 | R237-N239 VanDerWaalsContact C-N 3.28Å; R237-N239 PolarHBondContact O-N 3.47Å; N239-E241 PolarHBondContact O-N 3.07Å | ||
| 240 | K | 56.6 | Low | 56.4 | Low | 193 Ų | 193 | 163.6 Ų | 163.6 | 84% | 0.839 | 82% | 0.816 | S | S | * | * | trans | -87.5 | 87.2 | 164.3 | -164.6 | 167.4 | -175.7 | -178.4 | 0 | 105.6 | R238 E242 | R238-K240 VanDerWaalsContact C-N 3.33Å; R238-K240 PolarHBondContact O-N 3Å; K240-E242 PolarHBondContact O-N 3.18Å | ||
| 241 | E | 54.5 | Low | 56.9 | Low | 159 Ų | 159 | 157.2 Ų | 157.2 | 74% | 0.743 | 80% | 0.803 | S | S | * | * | trans | -66 | 113.2 | 176.2 | -158.1 | 177.5 | -174.8 | 0 | 0 | 107.8 | N239 | N239-E241 PolarHBondContact O-N 3.07Š| ||
| 242 | E | 65.1 | Low | 57.3 | Low | 167 Ų | 167 | 154.8 Ų | 154.8 | 78% | 0.78 | 80% | 0.796 | S | S | * | * | trans | -65.1 | 138.8 | 173.8 | -66.7 | -176.4 | 159.3 | 0 | 0 | 109.4 | K240 K244 | K240-E242 PolarHBondContact O-N 3.18Å; E242-K244 PolarHBondContact O-N 2.62Å; E242-K244 VanDerWaalsContact O-N 3.08Å | ||
| 243 | P | 63 | Low | 57.3 | Low | 130 Ų | 130 | 153.9 Ų | 153.9 | 84% | 0.844 | 80% | 0.797 | S | S | * | * | trans | -64.7 | 115.1 | -179.7 | 26.1 | -32.1 | 0 | 0 | 0 | 109.7 | A245 | P243-A245 PolarHBondContact O-N 3.34Š| ||
| 244 | K | 64.1 | Low | 57.8 | Low | 177 Ų | 177 | 155.2 Ų | 155.2 | 77% | 0.77 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -59.3 | 121.7 | 173.7 | -68.7 | 174.4 | -177.8 | 165.8 | 0 | 109.6 | E242 | E242-K244 PolarHBondContact O-N 2.62Å; E242-K244 VanDerWaalsContact O-N 3.08Å |
| 245 | A | 64.6 | Low | 58.3 | Low | 97 Ų | 97 | 160.9 Ų | 160.9 | 80% | 0.802 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -60.2 | 133.7 | 171.8 | 0 | 0 | 0 | 0 | 0 | 110.3 | P243 | P243-A245 PolarHBondContact O-N 3.34Š|
| 246 | R | 69.5 | Low | 58.7 | Low | 230 Ų | 230 | 161.2 Ų | 161.2 | 87% | 0.868 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -72 | 139.1 | 175.7 | -61.3 | -179.2 | -177.1 | -164.8 | 1.1 | 109.3 | L248 | R246-L248 PolarHBondContact O-N 3.38Š|
| 247 | P | 67.1 | Low | 58.8 | Low | 129 Ų | 129 | 162 Ų | 162 | 84% | 0.838 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -66.7 | 124.1 | 177.7 | 26 | -31.9 | 0 | 0 | 0 | 110.6 | ||
| 248 | L | 60 | Low | 59.1 | Low | 161 Ų | 161 | 157.7 Ų | 157.7 | 84% | 0.843 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -63.6 | 126.5 | 171.6 | -80.9 | 144.2 | 0 | 0 | 0 | 109.9 | R246 | R246-L248 PolarHBondContact O-N 3.38Š|
| 249 | R | 64.1 | Low | 59.1 | Low | 216 Ų | 216 | 155.8 Ų | 155.8 | 82% | 0.815 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -87.2 | 136.2 | 171.2 | -164.2 | 176.1 | -179 | 118.1 | -1.9 | 108.2 | G251 | R249-G251 PolarHBondContact O-N 3.49Š|
| 250 | V | 54.2 | Low | 59.2 | Low | 156 Ų | 156 | 160 Ų | 160 | 95% | 0.945 | 81% | 0.814 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -63.6 | 106 | 178.8 | -179.1 | 0 | 0 | 0 | 0 | 108.6 | ||
| 251 | G | 61.6 | Low | 59 | Low | 61 Ų | 61 | 155.6 Ų | 155.6 | 63% | 0.629 | 81% | 0.808 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 148.9 | -15.2 | 179 | 0 | 0 | 0 | 0 | 0 | 116.1 | R249 T253 | R249-G251 PolarHBondContact O-N 3.49Å; G251-T253 PolarHBondContact O-N 3.26Å; G251-T253 VanDerWaalsContact O-N 3.15Å |
| 252 | D | 52.2 | Low | 59.1 | Low | 125 Ų | 125 | 153.5 Ų | 153.5 | 67% | 0.668 | 81% | 0.808 | S | S | * | * | trans | -86 | 89.4 | -177 | -63.9 | -27.7 | 0 | 0 | 0 | 111.3 | E254 | D252-E254 VanDerWaalsContact C-N 3.31Å; D252-E254 PolarHBondContact O-N 2.78Å | ||
| 253 | T | 49.7 | Very low | 58.5 | Low | 137 Ų | 137 | 151.3 Ų | 151.3 | 84% | 0.84 | 81% | 0.808 | S | S | * | * | trans | -89 | 54 | 175.7 | 56.6 | 0 | 0 | 0 | 0 | 112 | G251 | G251-T253 PolarHBondContact O-N 3.26Å; G251-T253 VanDerWaalsContact O-N 3.15Å | ||
| 254 | E | 55.8 | Low | 57.8 | Low | 180 Ų | 180 | 152 Ų | 152 | 84% | 0.841 | 81% | 0.805 | S | S | * | * | S | Bend | trans | -140.3 | 122 | 166.3 | -68.6 | -167.7 | 170.8 | 0 | 0 | 109.5 | D252 | D252-E254 VanDerWaalsContact C-N 3.31Å; D252-E254 PolarHBondContact O-N 2.78Å |
| 255 | K | 61 | Low | 57.2 | Low | 205 Ų | 205 | 155.3 Ų | 155.3 | 89% | 0.891 | 81% | 0.812 | S | S | * | * | trans | -55.9 | 129 | 179.7 | -91.9 | 171.6 | 174.4 | 173.8 | 0 | 109.9 | E257 | K255-E257 PolarHBondContact O-N 2.67Š| ||
| 256 | P | 55.4 | Low | 56.7 | Low | 125 Ų | 125 | 159.7 Ų | 159.7 | 81% | 0.812 | 81% | 0.813 | S | S | * | * | trans | -69.8 | 115.8 | 171.4 | 27.8 | -29 | 0 | 0 | 0 | 108.2 | ||||
| 257 | E | 56.9 | Low | 56.1 | Low | 170 Ų | 170 | 159.4 Ų | 159.4 | 79% | 0.794 | 81% | 0.812 | S | S | * | * | trans | -55.1 | 142.1 | 167.1 | -80.9 | -149.2 | 151.8 | 0 | 0 | 109.7 | K255 E259 | K255-E257 PolarHBondContact O-N 2.67Å; E257-E259 PolarHBondContact O-N 2.95Å; E257-E259 VanDerWaalsContact O-N 3.14Å | ||
| 258 | P | 61 | Low | 55.7 | Low | 117 Ų | 117 | 157.2 Ų | 157.2 | 76% | 0.76 | 80% | 0.798 | S | S | * | * | trans | -62 | 121.4 | 178.4 | 26 | -32 | 0 | 0 | 0 | 109.2 | R260 | P258-R260 PolarHBondContact O-N 2.88Š| ||
| 259 | E | 54 | Low | 55.7 | Low | 192 Ų | 192 | 155.1 Ų | 155.1 | 90% | 0.897 | 80% | 0.804 | S | S | * | * | trans | -47 | 114.1 | 174.2 | -71.4 | -168.7 | 156.8 | 0 | 0 | 109.5 | E257 S261 | E257-E259 PolarHBondContact O-N 2.95Å; E257-E259 VanDerWaalsContact O-N 3.14Å; E259-S261 PolarHBondContact O-N 3.35Å | ||
| 260 | R | 52.1 | Low | 55.5 | Low | 233 Ų | 233 | 151.1 Ų | 151.1 | 88% | 0.879 | 80% | 0.799 | S | S | * | * | trans | -54.6 | 113 | 171.6 | -78.7 | 178.4 | 176.4 | -178.6 | -0.9 | 107.8 | P258 | P258-R260 PolarHBondContact O-N 2.88Š| ||
| 261 | S | 52.4 | Low | 55.6 | Low | 101 Ų | 101 | 150.3 Ų | 150.3 | 71% | 0.706 | 79% | 0.785 | S | S | * | * | trans | -40.8 | 138.7 | 166.3 | 53.2 | 0 | 0 | 0 | 0 | 110.6 | E259 | E259-S261 PolarHBondContact O-N 3.35Š| ||
| 262 | P | 57.2 | Low | 55.1 | Low | 115 Ų | 115 | 155.1 Ų | 155.1 | 75% | 0.747 | 79% | 0.788 | S | S | * | * | trans | -55.5 | 134.9 | -173.7 | -1.6 | 4 | 0 | 0 | 0 | 109 | N264 | P262-N264 PolarHBondContact O-N 2.81Š| ||
| 263 | P | 52.4 | Low | 55.9 | Low | 121 Ų | 121 | 152.8 Ų | 152.8 | 79% | 0.786 | 79% | 0.787 | S | S | * | * | trans | -55.5 | 117.3 | -173.9 | 22.4 | -31.8 | 0 | 0 | 0 | 108.2 | R265 | P263-R265 PolarHBondContact O-N 3Å; P263-R265 VanDerWaalsContact O-N 3.07Å | ||
| 264 | N | 47.7 | Very low | 57 | Low | 144 Ų | 144 | 151.8 Ų | 151.8 | 77% | 0.77 | 78% | 0.78 | S | S | * | * | trans | -41.3 | 118.6 | 173.5 | -156.7 | -5 | 0 | 0 | 0 | 107.4 | P262 K266 | P262-N264 PolarHBondContact O-N 2.81Å; N264-K266 PolarHBondContact O-N 2.75Å | ||
| 265 | R | 53.3 | Low | 58.1 | Low | 246 Ų | 246 | 149 Ų | 149 | 93% | 0.928 | 77% | 0.771 | S | S | * | * | trans | -56.7 | 78.5 | -172.8 | -76.8 | 178.1 | 173.3 | 151.1 | -0.7 | 110.6 | P263 R267 | P263-R265 PolarHBondContact O-N 3Å; P263-R265 VanDerWaalsContact O-N 3.07Å; R265-R267 PolarHBondContact O-N 3.25Å | ||
| 266 | K | 52.9 | Low | 58.9 | Low | 189 Ų | 189 | 144.1 Ų | 144.1 | 82% | 0.822 | 76% | 0.755 | S | S | * | * | trans | -76 | 117.7 | 167.4 | -72.2 | -160.8 | 175.9 | -173.4 | 0 | 105.6 | N264 | N264-K266 PolarHBondContact O-N 2.75Š| ||
| 267 | R | 57.5 | Low | 59.9 | Low | 224 Ų | 224 | 145.1 Ų | 145.1 | 85% | 0.845 | 74% | 0.744 | S | S | * | * | trans | -45.3 | 130.7 | 174.2 | -66.7 | 175.5 | 173.4 | 171.7 | -4.6 | 108.6 | R265 A269 | R265-R267 PolarHBondContact O-N 3.25Å; R267-A269 PolarHBondContact O-N 3.28Å | ||
| 268 | P | 59.1 | Low | 61.2 | Low | 84 Ų | 84 | 141.9 Ų | 141.9 | 55% | 0.545 | 73% | 0.728 | S | S | . | * | trans | -58.1 | 136.2 | 172.3 | 24.9 | -30.8 | 0 | 0 | 0 | 108.4 | N270 | P268-N270 PolarHBondContact O-N 3.09Š| ||
| 269 | A | 60.2 | Low | 62.2 | Low | 116 Ų | 116 | 143.3 Ų | 143.3 | 96% | 0.959 | 72% | 0.719 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -68.9 | 21.9 | -171.5 | 0 | 0 | 0 | 0 | 0 | 114.6 | R267 | R267-A269 PolarHBondContact O-N 3.28Š|
| 270 | N | 58.9 | Low | 63.5 | Low | 132 Ų | 132 | 140.9 Ų | 140.9 | 71% | 0.706 | 71% | 0.708 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -140.4 | 15.2 | -168.1 | -149.7 | 8.1 | 0 | 0 | 0 | 114.6 | P268 K272 | P268-N270 PolarHBondContact O-N 3.09Å; N270-K272 PolarHBondContact O-N 3Å |
| 271 | E | 55.5 | Low | 64.9 | Low | 139 Ų | 139 | 136.2 Ų | 136.2 | 65% | 0.65 | 69% | 0.694 | S | S | * | * | trans | -87.4 | 101.2 | 179.5 | -96.9 | 171.9 | 179.2 | 0 | 0 | 112.3 | ||||
| 272 | K | 52.3 | Low | 66.3 | Low | 162 Ų | 162 | 137.4 Ų | 137.4 | 70% | 0.704 | 69% | 0.687 | S | S | * | * | trans | -65.6 | 140.8 | 166.6 | -61.1 | 165.7 | -178.1 | 178.4 | 0 | 109.1 | N270 | N270-K272 PolarHBondContact O-N 3Š| ||
| 273 | A | 69.1 | Low | 67.7 | Low | 77 Ų | 77 | 138.2 Ų | 138.2 | 64% | 0.636 | 68% | 0.679 | S | S | * | * | trans | 46.9 | 123.3 | 171.2 | 0 | 0 | 0 | 0 | 0 | 117.9 | D275 D276 | A273-D275 PolarHBondContact O-N 2.99Å; A273-D276 PolarHBondContact O-N 2.95Å | ||
| 274 | T | 72.2 | Confident | 69.2 | Low | 115 Ų | 115 | 140.6 Ų | 140.6 | 71% | 0.706 | 68% | 0.677 | S | S | * | * | H | α-helix | trans | -50.3 | -19.9 | 172.9 | 11.8 | 0 | 0 | 0 | 0 | 115 | Y277 H278 | T274-Y277 PolarHBondContact O-N 2.72Å; T274-H278 PolarHBondContact O-CD2 2.99Å; T274-H278 PolarHBondContact O-N 3.02Å |
| 275 | D | 79 | Confident | 70.7 | Confident | 121 Ų | 121 | 139.8 Ų | 139.8 | 65% | 0.647 | 67% | 0.67 | S | S | * | * | H | α-helix | trans | -67.7 | -39.8 | -177 | -160.6 | 34.2 | 0 | 0 | 0 | 113.1 | A273 Y277 H278 Y279 | A273-D275 PolarHBondContact O-N 2.99Å; D275-Y277 VanDerWaalsContact C-N 3.3Å; D275-Y277 PolarHBondContact O-N 2.97Å; D275-H278 PolarHBondContact O-N 3.26Å; D275-H278 VanDerWaalsContact O-N 3.09Å; D275-Y279 WeakPolarHBondContact O-CB 3.12Å; D275-Y279 PolarHBondContact O-N 3.37Å |
| 276 | D | 77.4 | Confident | 71.9 | Confident | 103 Ų | 103 | 131.9 Ų | 131.9 | 55% | 0.551 | 65% | 0.646 | S | S | * | * | H | α-helix | trans | -63.3 | -36.8 | 178.3 | -87.1 | -16.5 | 0 | 0 | 0 | 111.9 | A273 H278 Y279 E280 | A273-D276 PolarHBondContact O-N 2.95Å; D276-H278 PolarHBondContact O-N 3.05Å; D276-Y279 PolarHBondContact O-N 2.9Å; D276-E280 PolarHBondContact O-N 3.29Å |
| 277 | Y | 77.5 | Confident | 73 | Confident | 147 Ų | 147 | 133.2 Ų | 133.2 | 58% | 0.576 | 65% | 0.646 | S | S | * | * | H | α-helix | trans | -62.1 | -42.3 | 174.2 | 172.3 | -97.2 | 0 | 0 | 0 | 112 | T274 D275 K281 | T274-Y277 PolarHBondContact O-N 2.72Å; D275-Y277 VanDerWaalsContact C-N 3.3Å; D275-Y277 PolarHBondContact O-N 2.97Å; Y277-K281 WeakPolarHBondContact O-CB 3.3Å; Y277-K281 PolarHBondContact O-N 3.34Å; Y277-K281 VanDerWaalsContact O-N 3.13Å |
| 278 | H | 82.8 | Confident | 73.4 | Confident | 101 Ų | 101 | 133.2 Ų | 133.2 | 47% | 0.468 | 65% | 0.646 | S | S | . | * | H | α-helix | trans | -72.8 | -37 | 179.1 | -70.8 | -60.7 | 0 | 0 | 0 | 111.8 | T274 D275 D276 K281 F282 | T274-H278 PolarHBondContact O-CD2 2.99Å; T274-H278 PolarHBondContact O-N 3.02Å; D275-H278 PolarHBondContact O-N 3.26Å; D275-H278 VanDerWaalsContact O-N 3.09Å; D276-H278 PolarHBondContact O-N 3.05Å; H278-K281 PolarHBondContact O-N 3.03Å; H278-F282 PolarHBondContact O-N 3.36Å |
| 279 | Y | 82 | Confident | 73 | Confident | 148 Ų | 148 | 142.4 Ų | 142.4 | 58% | 0.58 | 67% | 0.672 | S | S | * | * | H | α-helix | trans | -62.7 | -46 | 174.6 | -175.7 | -112.6 | 0 | 0 | 0 | 112.2 | D275 D276 K281 F282 K283 | D275-Y279 WeakPolarHBondContact O-CB 3.12Å; D275-Y279 PolarHBondContact O-N 3.37Å; D276-Y279 PolarHBondContact O-N 2.9Å; Y279-K281 PolarHBondContact O-N 3.09Å; Y279-F282 PolarHBondContact O-N 3.14Å; Y279-K283 WeakPolarHBondContact O-CB 3.11Å; Y279-K283 PolarHBondContact O-N 2.9Å |
| 280 | E | 81.6 | Confident | 73.6 | Confident | 140 Ų | 140 | 143.8 Ų | 143.8 | 65% | 0.654 | 66% | 0.657 | S | S | * | * | H | α-helix | trans | -63.5 | -40.4 | 174.7 | -78.5 | -138.5 | 143.8 | 0 | 0 | 112.6 | D276 F282 K283 K284 | D276-E280 PolarHBondContact O-N 3.29Å; E280-F282 VanDerWaalsContact C-N 3.33Å; E280-F282 PolarHBondContact O-N 3.17Å; E280-K283 PolarHBondContact O-N 3.19Å; E280-K284 VanDerWaalsContact O-CB 3.3Å; E280-K284 WeakPolarHBondContact O-CB 3.42Å; E280-K284 PolarHBondContact O-N 3.08Å |
| 281 | K | 82 | Confident | 74.4 | Confident | 135 Ų | 135 | 144.4 Ų | 144.4 | 59% | 0.587 | 66% | 0.655 | S | S | * | * | H | α-helix | trans | -60.4 | -44.1 | 176.4 | -172.6 | -173.8 | 177.4 | -170 | 0 | 111.1 | Y277 H278 Y279 K284 M285 | Y277-K281 WeakPolarHBondContact O-CB 3.3Å; Y277-K281 PolarHBondContact O-N 3.34Å; Y277-K281 VanDerWaalsContact O-N 3.13Å; H278-K281 PolarHBondContact O-N 3.03Å; Y279-K281 PolarHBondContact O-N 3.09Å; K281-K284 PolarHBondContact O-N 3.26Å; K281-M285 PolarHBondContact O-N 3.32Å; K281-M285 VanDerWaalsContact O-N 3.09Å |
| 282 | F | 82 | Confident | 75.4 | Confident | 126 Ų | 126 | 144.7 Ų | 144.7 | 55% | 0.553 | 66% | 0.655 | S | S | * | * | H | α-helix | trans | -62.8 | -48 | 175.7 | 176.9 | -98.7 | 0 | 0 | 0 | 111.7 | H278 Y279 E280 K284 M285 N286 | H278-F282 PolarHBondContact O-N 3.36Å; Y279-F282 PolarHBondContact O-N 3.14Å; E280-F282 VanDerWaalsContact C-N 3.33Å; E280-F282 PolarHBondContact O-N 3.17Å; F282-K284 VanDerWaalsContact C-N 3.29Å; F282-K284 PolarHBondContact O-N 3.43Å; F282-M285 PolarHBondContact O-N 3.13Å; F282-N286 WeakPolarHBondContact CE1-ND2 3.46Å; F282-N286 VanDerWaalsContact CE2-ND2 3.25Å; F282-N286 WeakPolarHBondContact CE2-ND2 3.33Å; F282-N286 WeakPolarHBondContact CZ-ND2 3.1Å; F282-N286 PolarHBondContact O-N 2.86Å; F282-N286 VanDerWaalsContact O-N 3.15Å; F282-N286 PolarHBondContact O-ND2 3.02Å |
| 283 | K | 86.2 | Confident | 76.8 | Confident | 133 Ų | 133 | 143.6 Ų | 143.6 | 58% | 0.578 | 65% | 0.652 | S | S | * | * | H | α-helix | trans | -59.7 | -39.2 | 177.7 | -171.8 | 178.5 | 177.9 | 176.4 | 0 | 112.3 | Y279 E280 R287 | Y279-K283 WeakPolarHBondContact O-CB 3.11Å; Y279-K283 PolarHBondContact O-N 2.9Å; E280-K283 PolarHBondContact O-N 3.19Å; K283-R287 PolarHBondContact O-N 3.3Å |
| 284 | K | 84.3 | Confident | 77.3 | Confident | 171 Ų | 171 | 147.8 Ų | 147.8 | 74% | 0.743 | 65% | 0.653 | S | S | * | * | H | α-helix | trans | -72 | -32.9 | -179.8 | -161.7 | 171 | -171.6 | 168.2 | 0 | 112.8 | E280 K281 F282 | E280-K284 VanDerWaalsContact O-CB 3.3Å; E280-K284 WeakPolarHBondContact O-CB 3.42Å; E280-K284 PolarHBondContact O-N 3.08Å; K281-K284 PolarHBondContact O-N 3.26Å; F282-K284 VanDerWaalsContact C-N 3.29Å; F282-K284 PolarHBondContact O-N 3.43Å |
| 285 | M | 79.4 | Confident | 77.6 | Confident | 127 Ų | 127 | 150 Ų | 150 | 63% | 0.626 | 65% | 0.649 | S | S | * | * | H | α-helix | trans | -68.3 | -40.1 | 175.3 | -168.7 | 173.1 | 74.1 | 0 | 0 | 111.6 | K281 F282 R287 | K281-M285 PolarHBondContact O-N 3.32Å; K281-M285 VanDerWaalsContact O-N 3.09Å; F282-M285 PolarHBondContact O-N 3.13Å; M285-R287 VanDerWaalsContact C-N 3.29Å; M285-R287 PolarHBondContact O-N 3.15Å |
| 286 | N | 78.2 | Confident | 77.5 | Confident | 80 Ų | 80 | 152.1 Ų | 152.1 | 43% | 0.428 | 65% | 0.65 | S | S | . | * | H | α-helix | trans | -79.2 | -6.3 | 179.8 | -69.5 | -58.2 | 0 | 0 | 0 | 114.4 | F282 R288 | F282-N286 WeakPolarHBondContact CE1-ND2 3.46Å; F282-N286 VanDerWaalsContact CE2-ND2 3.25Å; F282-N286 WeakPolarHBondContact CE2-ND2 3.33Å; F282-N286 WeakPolarHBondContact CZ-ND2 3.1Å; F282-N286 PolarHBondContact O-N 2.86Å; F282-N286 VanDerWaalsContact O-N 3.15Å; F282-N286 PolarHBondContact O-ND2 3.02Å; N286-R288 PolarHBondContact O-N 3.3Å |
| 287 | R | 74.9 | Confident | 77.5 | Confident | 217 Ų | 217 | 155.8 Ų | 155.8 | 82% | 0.819 | 66% | 0.657 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -83.3 | 6.4 | 176.4 | -156.4 | 159.7 | 103.4 | 151.8 | 2.6 | 113.8 | K283 M285 | K283-R287 PolarHBondContact O-N 3.3Å; M285-R287 VanDerWaalsContact C-N 3.29Å; M285-R287 PolarHBondContact O-N 3.15Å |
| 288 | R | 66.1 | Low | 77.5 | Confident | 224 Ų | 224 | 156.6 Ų | 156.6 | 85% | 0.845 | 66% | 0.664 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -113 | 22 | 177.9 | -73.2 | -142.2 | -164.9 | -104.5 | 8.2 | 113.7 | N286 | N286-R288 PolarHBondContact O-N 3.3Š|
| 289 | Y | 51.1 | Low | 77.1 | Confident | 277 Ų | 277 | 161.6 Ų | 161.6 | 100% | 1.086 | 68% | 0.682 | S | S | * | * | trans | -131.5 | 0 | 164.5 | -70.7 | -75.9 | 0 | 0 | 0 | 109.3 |
Retrieved 289 of 289 residues in 123.3 ms
(Link to these results)