| 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 | 34.5 | Very low | 32.1 | Very low | 220 Ų | 220 | 126.1 Ų | 126.1 | 100% | 1.084 | 85% | 0.851 | S | S | * | * | 0 | 100.7 | 0 | -73.3 | 167.8 | 172.5 | 0 | 0 | 106.9 | |||||
| 2 | N | 26.1 | Very low | 32.3 | Very low | 158 Ų | 158 | 124.9 Ų | 124.9 | 85% | 0.845 | 86% | 0.857 | S | S | * | * | trans | -66 | 130.8 | 170.5 | -92.3 | -3.1 | 0 | 0 | 0 | 108.1 | ||||
| 3 | V | 35.1 | Very low | 32.5 | Very low | 152 Ų | 152 | 124 Ų | 124 | 92% | 0.921 | 85% | 0.852 | S | S | * | * | trans | -104 | 99.4 | 167 | -179.8 | 0 | 0 | 0 | 0 | 106 | ||||
| 4 | S | 37 | Very low | 33 | Very low | 103 Ų | 103 | 128.1 Ų | 128.1 | 72% | 0.72 | 85% | 0.852 | S | S | * | * | trans | -147.5 | 112 | 170.4 | 46.5 | 0 | 0 | 0 | 0 | 107.1 | ||||
| 5 | G | 28.2 | Very low | 33.5 | Very low | 71 Ų | 71 | 128.1 Ų | 128.1 | 73% | 0.732 | 85% | 0.846 | S | S | * | * | trans | 142.3 | 78.4 | 173.7 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 6 | C | 32.9 | Very low | 33.3 | Very low | 135 Ų | 135 | 125 Ų | 125 | 91% | 0.912 | 84% | 0.844 | S | S | * | * | trans | -77.7 | 143 | 150.9 | -77.1 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 7 | P | 34.9 | Very low | 33.5 | Very low | 125 Ų | 125 | 122.6 Ų | 122.6 | 81% | 0.812 | 85% | 0.846 | S | S | * | * | trans | -132.1 | 136.8 | 141.5 | 29.3 | -13.8 | 0 | 0 | 0 | 112.6 | ||||
| 8 | G | 28.1 | Very low | 33.5 | Very low | 77 Ų | 77 | 119.7 Ų | 119.7 | 79% | 0.794 | 84% | 0.839 | S | S | * | * | trans | 85.7 | 99.5 | 140.9 | 0 | 0 | 0 | 0 | 0 | 117.5 | ||||
| 9 | A | 38.7 | Very low | 33.9 | Very low | 116 Ų | 116 | 117.7 Ų | 117.7 | 96% | 0.959 | 84% | 0.839 | S | S | * | * | trans | -61.6 | 131.5 | 155.8 | 0 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 10 | G | 29.4 | Very low | 34.3 | Very low | 71 Ų | 71 | 114.3 Ų | 114.3 | 73% | 0.732 | 82% | 0.823 | S | S | * | * | trans | -169.6 | 103 | 173.3 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 11 | N | 27.9 | Very low | 35.1 | Very low | 159 Ų | 159 | 119.8 Ų | 119.8 | 85% | 0.85 | 83% | 0.825 | S | S | * | * | trans | 60.8 | 87 | 165 | -68.5 | -3.9 | 0 | 0 | 0 | 119.1 | S13 | N11-S13 PolarHBondContact O-N 3.06Š| ||
| 12 | A | 35.2 | Very low | 36.5 | Very low | 112 Ų | 112 | 114.9 Ų | 114.9 | 93% | 0.926 | 80% | 0.799 | S | S | * | * | trans | -77.5 | 95.9 | 152.6 | 0 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 13 | S | 34.9 | Very low | 38.6 | Very low | 113 Ų | 113 | 110.9 Ų | 110.9 | 79% | 0.79 | 78% | 0.782 | S | S | * | * | trans | -92.3 | 121 | 158 | 41.9 | 0 | 0 | 0 | 0 | 109.1 | N11 | N11-S13 PolarHBondContact O-N 3.06Š| ||
| 14 | Q | 38.9 | Very low | 40.3 | Very low | 182 Ų | 182 | 107.7 Ų | 107.7 | 85% | 0.85 | 76% | 0.757 | S | S | * | * | trans | -64.7 | 141.7 | -176.4 | -94.1 | -167.2 | 1.6 | 0 | 0 | 114.7 | ||||
| 15 | V | 40.9 | Very low | 42 | Very low | 127 Ų | 127 | 105.3 Ų | 105.3 | 77% | 0.77 | 74% | 0.743 | S | S | * | * | trans | 68 | 109.1 | 133.2 | -175.1 | 0 | 0 | 0 | 0 | 118.8 | ||||
| 16 | G | 30.1 | Very low | 44.6 | Very low | 79 Ų | 79 | 105.4 Ų | 105.4 | 81% | 0.814 | 73% | 0.73 | S | S | * | * | trans | -135.2 | 106.1 | 145.4 | 0 | 0 | 0 | 0 | 0 | 108.2 | G18 | G16-G18 PolarHBondContact O-N 3.18Š| ||
| 17 | G | 37.3 | Very low | 47.2 | Very low | 84 Ų | 84 | 103.3 Ų | 103.3 | 87% | 0.866 | 71% | 0.709 | S | S | * | * | trans | -62.9 | 126.2 | -177.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 18 | G | 32.3 | Very low | 49.7 | Very low | 70 Ų | 70 | 97.8 Ų | 97.8 | 72% | 0.722 | 67% | 0.673 | S | S | * | * | trans | -136.1 | 98 | 162.1 | 0 | 0 | 0 | 0 | 0 | 107.3 | G16 G20 | G16-G18 PolarHBondContact O-N 3.18Å; G18-G20 PolarHBondContact O-N 2.87Å | ||
| 19 | G | 42.3 | Very low | 52.6 | Low | 82 Ų | 82 | 95.8 Ų | 95.8 | 85% | 0.845 | 65% | 0.645 | S | S | * | * | trans | -66.4 | 72.3 | 167.6 | 0 | 0 | 0 | 0 | 0 | 109.5 | W21 | G19-W21 PolarHBondContact O-N 3.49Š| ||
| 20 | G | 41.8 | Very low | 55.1 | Low | 50 Ų | 50 | 95.6 Ų | 95.6 | 52% | 0.515 | 63% | 0.628 | S | S | . | * | trans | -71.4 | 111.4 | 172.2 | 0 | 0 | 0 | 0 | 0 | 107.8 | G18 H22 | G18-G20 PolarHBondContact O-N 2.87Å; G20-H22 PolarHBondContact O-CD2 2.86Å; G20-H22 PolarHBondContact O-N 3.15Å | ||
| 21 | W | 50.9 | Low | 58.2 | Low | 230 Ų | 230 | 95.4 Ų | 95.4 | 87% | 0.871 | 61% | 0.609 | S | S | * | * | trans | -53.3 | 113.6 | 163.7 | -66.2 | 81.3 | 0 | 0 | 0 | 107.4 | G19 P23 | G19-W21 PolarHBondContact O-N 3.49Å; W21-P23 WeakPolarHBondContact O-CD 3.24Å | ||
| 22 | H | 63.1 | Low | 61.3 | Low | 116 Ų | 116 | 88 Ų | 88 | 54% | 0.537 | 57% | 0.57 | S | S | . | * | trans | -78.9 | 97.9 | 169.7 | -79.8 | -79.7 | 0 | 0 | 0 | 106.6 | G20 E24 A25 | G20-H22 PolarHBondContact O-CD2 2.86Å; G20-H22 PolarHBondContact O-N 3.15Å; H22-E24 VanDerWaalsContact C-OE2 3.24Å; H22-E24 WeakPolarHBondContact CA-OE2 3.41Å; H22-E24 VanDerWaalsContact CB-CD 3.47Å; H22-E24 HydrophobicContact CB-CG 4.08Å; H22-E24 WeakPolarHBondContact CB-OE1 3.49Å; H22-E24 IonicContact CE1-OE1 3.01Å; H22-E24 IonicContact CG-OE1 3.71Å; H22-E24 IonicContact ND1-OE1 2.76Å; H22-E24 PolarHBondContact ND1-OE1 3.02Å; H22-E24 PolarHBondContact O-N 2.81Å; H22-A25 HydrophobicContact CB-CB 4.29Å; H22-A25 WeakPolarHBondContact O-CB 3.31Å; H22-A25 PolarHBondContact O-N 3.17Å | ||
| 23 | P | 70.5 | Confident | 64.1 | Low | 74 Ų | 74 | 85.3 Ų | 85.3 | 48% | 0.481 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -55.5 | -27.7 | -176.2 | 24 | -35.4 | 0 | 0 | 0 | 112.2 | W21 A25 V26 I27 | W21-P23 WeakPolarHBondContact O-CD 3.24Å; P23-A25 VanDerWaalsContact C-N 3.28Å; P23-A25 PolarHBondContact O-N 3.48Å; P23-V26 PolarHBondContact O-N 3.22Å; P23-I27 HydrophobicContact CB-CD1 3.84Å; P23-I27 VanDerWaalsContact O-CB 3.28Å; P23-I27 WeakPolarHBondContact O-CB 3.12Å; P23-I27 WeakPolarHBondContact O-CG1 3.2Å; P23-I27 PolarHBondContact O-N 3.49Å |
| 24 | E | 71.3 | Confident | 67 | Low | 86 Ų | 86 | 84.5 Ų | 84.5 | 40% | 0.402 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -56.1 | -37.1 | 172.2 | 60.6 | -87.9 | -151.4 | 0 | 0 | 113.5 | H22 V26 V28 | H22-E24 VanDerWaalsContact C-OE2 3.24Å; H22-E24 WeakPolarHBondContact CA-OE2 3.41Å; H22-E24 VanDerWaalsContact CB-CD 3.47Å; H22-E24 HydrophobicContact CB-CG 4.08Å; H22-E24 WeakPolarHBondContact CB-OE1 3.49Å; H22-E24 IonicContact CE1-OE1 3.01Å; H22-E24 IonicContact CG-OE1 3.71Å; H22-E24 IonicContact ND1-OE1 2.76Å; H22-E24 PolarHBondContact ND1-OE1 3.02Å; H22-E24 PolarHBondContact O-N 2.81Å; E24-V26 PolarHBondContact O-N 2.83Å; E24-V28 VanDerWaalsContact O-CB 3.24Å; E24-V28 WeakPolarHBondContact O-CB 3.28Å; E24-V28 WeakPolarHBondContact O-CG2 3.5Å; E24-V28 PolarHBondContact O-N 2.94Å |
| 25 | A | 72.9 | Confident | 69.7 | Low | 52 Ų | 52 | 76.5 Ų | 76.5 | 43% | 0.43 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -72 | -18.4 | -178.2 | 0 | 0 | 0 | 0 | 0 | 112.9 | H22 P23 P29 | H22-A25 HydrophobicContact CB-CB 4.29Å; H22-A25 WeakPolarHBondContact O-CB 3.31Å; H22-A25 PolarHBondContact O-N 3.17Å; P23-A25 VanDerWaalsContact C-N 3.28Å; P23-A25 PolarHBondContact O-N 3.48Å; A25-P29 WeakPolarHBondContact O-CD 3.36Å; A25-P29 WeakPolarHBondContact O-CG 3.45Å |
| 26 | V | 82.4 | Confident | 72.3 | Confident | 74 Ų | 74 | 74.1 Ų | 74.1 | 45% | 0.448 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -105.8 | -43.2 | 178.5 | -178.7 | 0 | 0 | 0 | 0 | 111.4 | P23 E24 P29 L30 | P23-V26 PolarHBondContact O-N 3.22Å; E24-V26 PolarHBondContact O-N 2.83Å; V26-P29 WeakPolarHBondContact O-CD 3.44Å; V26-L30 HydrophobicContact CG1-CD1 3.93Å; V26-L30 WeakPolarHBondContact O-CD1 3.41Å; V26-L30 WeakPolarHBondContact O-CG 3.4Å; V26-L30 PolarHBondContact O-N 3.23Å |
| 27 | I | 87.6 | Confident | 75.5 | Confident | 91 Ų | 91 | 75.5 Ų | 75.5 | 47% | 0.467 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -69.2 | -44.7 | -175.9 | -65.9 | 171 | 0 | 0 | 0 | 111 | P23 L30 L31 | P23-I27 HydrophobicContact CB-CD1 3.84Å; P23-I27 VanDerWaalsContact O-CB 3.28Å; P23-I27 WeakPolarHBondContact O-CB 3.12Å; P23-I27 WeakPolarHBondContact O-CG1 3.2Å; P23-I27 PolarHBondContact O-N 3.49Å; I27-L30 PolarHBondContact O-N 3.23Å; I27-L31 HydrophobicContact CG2-CD1 3.77Å; I27-L31 HydrophobicContact CG2-CG 4.23Å; I27-L31 WeakPolarHBondContact O-CG 3.33Å; I27-L31 PolarHBondContact O-N 3.43Å |
| 28 | V | 87.1 | Confident | 78.3 | Confident | 9 Ų | 9 | 74 Ų | 74 | 6% | 0.055 | 44% | 0.438 | C | S | . | . | H | α-helix | trans | -62.7 | -46.1 | -175 | 176.5 | 0 | 0 | 0 | 0 | 111.8 | E24 L30 L31 F32 Y86 I275 | E24-V28 VanDerWaalsContact O-CB 3.24Å; E24-V28 WeakPolarHBondContact O-CB 3.28Å; E24-V28 WeakPolarHBondContact O-CG2 3.5Å; E24-V28 PolarHBondContact O-N 2.94Å; V28-L30 PolarHBondContact O-N 3.29Å; V28-L31 PolarHBondContact O-N 2.99Å; V28-F32 HydrophobicContact CG1-CD2 3.66Å; V28-F32 HydrophobicContact CG1-CE2 3.41Å; V28-F32 VanDerWaalsContact CG1-CE2 3.41Å; V28-F32 VanDerWaalsContact O-CD2 3.24Å; V28-F32 WeakPolarHBondContact O-CD2 3.22Å; V28-F32 PolarHBondContact O-N 3.4Å; V28-Y86 HydrophobicContact CG1-CD2 3.98Å; V28-Y86 HydrophobicContact CG1-CG 3.91Å; V28-I275 HydrophobicContact CG1-CG2 4.2Å; V28-I275 HydrophobicContact CG2-CG2 3.75Å |
| 29 | P | 88.3 | Confident | 81.3 | Confident | 34 Ų | 34 | 70.7 Ų | 70.7 | 22% | 0.221 | 40% | 0.404 | C | S | . | . | H | α-helix | trans | -65.7 | -37.7 | 177 | -25.8 | 39.5 | 0 | 0 | 0 | 113.3 | A25 V26 L31 F32 A33 T87 | A25-P29 WeakPolarHBondContact O-CD 3.36Å; A25-P29 WeakPolarHBondContact O-CG 3.45Å; V26-P29 WeakPolarHBondContact O-CD 3.44Å; P29-L31 VanDerWaalsContact C-N 3.32Å; P29-L31 PolarHBondContact O-N 3.28Å; P29-F32 PolarHBondContact O-N 3.38Å; P29-A33 VanDerWaalsContact O-CB 3.31Å; P29-A33 WeakPolarHBondContact O-CB 3.4Å; P29-A33 PolarHBondContact O-N 2.82Å; P29-T87 HydrophobicContact CB-CG2 4.03Å; P29-T87 HydrophobicContact CG-CG2 3.1Å |
| 30 | L | 91.8 | Very high | 83.8 | Confident | 113 Ų | 113 | 68.2 Ų | 68.2 | 59% | 0.592 | 37% | 0.373 | S | S | * | . | H | α-helix | trans | -62.2 | -40.6 | 175.6 | -72.2 | 173.8 | 0 | 0 | 0 | 111.5 | V26 I27 V28 A33 L34 | V26-L30 HydrophobicContact CG1-CD1 3.93Å; V26-L30 WeakPolarHBondContact O-CD1 3.41Å; V26-L30 WeakPolarHBondContact O-CG 3.4Å; V26-L30 PolarHBondContact O-N 3.23Å; I27-L30 PolarHBondContact O-N 3.23Å; V28-L30 PolarHBondContact O-N 3.29Å; L30-A33 PolarHBondContact O-N 3.17Å; L30-L34 WeakPolarHBondContact O-CB 3.3Å; L30-L34 PolarHBondContact O-N 3.16Å |
| 31 | L | 93.8 | Very high | 86.4 | Confident | 66 Ų | 66 | 69.6 Ų | 69.6 | 35% | 0.346 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -66.9 | -42 | 175.6 | -68.4 | 174.7 | 0 | 0 | 0 | 111.9 | I27 V28 P29 L34 I35 L279 | I27-L31 HydrophobicContact CG2-CD1 3.77Å; I27-L31 HydrophobicContact CG2-CG 4.23Å; I27-L31 WeakPolarHBondContact O-CG 3.33Å; I27-L31 PolarHBondContact O-N 3.43Å; V28-L31 PolarHBondContact O-N 2.99Å; P29-L31 VanDerWaalsContact C-N 3.32Å; P29-L31 PolarHBondContact O-N 3.28Å; L31-L34 PolarHBondContact O-N 3.02Å; L31-I35 VanDerWaalsContact O-CG1 3.31Å; L31-I35 WeakPolarHBondContact O-CG1 3.49Å; L31-I35 PolarHBondContact O-N 2.77Å; L31-L279 HydrophobicContact CB-CD1 4.41Å; L31-L279 HydrophobicContact CB-CD2 3.99Å; L31-L279 HydrophobicContact CD1-CD1 3.71Å |
| 32 | F | 93.8 | Very high | 88.4 | Confident | 3 Ų | 3 | 59.2 Ų | 59.2 | 1% | 0.013 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -64.6 | -38.4 | 173.4 | -79.3 | -60.7 | 0 | 0 | 0 | 112.7 | V28 P29 L34 I35 F36 V79 Q82 A83 Y86 L279 Y282 | V28-F32 HydrophobicContact CG1-CD2 3.66Å; V28-F32 HydrophobicContact CG1-CE2 3.41Å; V28-F32 VanDerWaalsContact CG1-CE2 3.41Å; V28-F32 VanDerWaalsContact O-CD2 3.24Å; V28-F32 WeakPolarHBondContact O-CD2 3.22Å; V28-F32 PolarHBondContact O-N 3.4Å; P29-F32 PolarHBondContact O-N 3.38Å; F32-L34 VanDerWaalsContact C-N 3.33Å; F32-I35 HydrophobicContact CD1-CD1 4.41Å; F32-I35 PolarHBondContact O-N 3.11Å; F32-F36 WeakPolarHBondContact O-CB 3.41Å; F32-F36 PolarHBondContact O-N 2.98Å; F32-V79 HydrophobicContact CB-CG1 4.28Å; F32-V79 HydrophobicContact CD1-CG1 3.94Å; F32-Q82 HydrophobicContact CE1-CG 4.28Å; F32-Q82 HydrophobicContact CZ-CG 4.03Å; F32-A83 HydrophobicContact CB-CB 3.81Å; F32-A83 HydrophobicContact CD2-CB 3.91Å; F32-A83 HydrophobicContact CG-CB 3.96Å; F32-Y86 HydrophobicContact CD2-CD2 4.46Å; F32-Y86 AromaticContact CE2-CD2 3.46Å; F32-Y86 HydrophobicContact CE2-CD2 3.46Å; F32-Y86 VanDerWaalsContact CE2-CD2 3.46Å; F32-Y86 AromaticContact CE2-CE2 3.65Å; F32-Y86 HydrophobicContact CE2-CE2 3.65Å; F32-Y86 HydrophobicContact CZ-CD2 4.01Å; F32-Y86 AromaticContact CZ-CE2 3.7Å; F32-Y86 HydrophobicContact CZ-CE2 3.7Å; F32-L279 HydrophobicContact CD1-CD2 3.97Å; F32-L279 HydrophobicContact CD2-CD2 4.02Å; F32-L279 HydrophobicContact CE1-CD2 3.7Å; F32-L279 HydrophobicContact CE2-CD2 3.74Å; F32-L279 HydrophobicContact CG-CD2 4.12Å; F32-L279 HydrophobicContact CZ-CD2 3.58Å; F32-L279 HydrophobicContact CZ-CG 4.34Å; F32-Y282 HydrophobicContact CD1-CD2 4.36Å; F32-Y282 AromaticContact CE1-CD2 3.56Å; F32-Y282 HydrophobicContact CE1-CD2 3.56Å; F32-Y282 AromaticContact CE1-CE2 3.99Å; F32-Y282 HydrophobicContact CE1-CE2 3.99Å; F32-Y282 HydrophobicContact CE1-CG 4.43Å; F32-Y282 HydrophobicContact CZ-CD2 4.47Å |
| 33 | A | 94.2 | Very high | 89.9 | Confident | 57 Ų | 57 | 53.8 Ų | 53.8 | 47% | 0.471 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -63.5 | -39.9 | 174.6 | 0 | 0 | 0 | 0 | 0 | 111.5 | P29 L30 F36 L37 | P29-A33 VanDerWaalsContact O-CB 3.31Å; P29-A33 WeakPolarHBondContact O-CB 3.4Å; P29-A33 PolarHBondContact O-N 2.82Å; L30-A33 PolarHBondContact O-N 3.17Å; A33-F36 PolarHBondContact O-N 3Å; A33-L37 WeakPolarHBondContact O-CB 3.13Å; A33-L37 PolarHBondContact O-N 3.33Å |
| 34 | L | 95.5 | Very high | 91.1 | Very high | 96 Ų | 96 | 53.6 Ų | 53.6 | 50% | 0.503 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -63.7 | -46.6 | 173.9 | -178.8 | 64.8 | 0 | 0 | 0 | 111.6 | L30 L31 F32 F36 L37 V38 | L30-L34 WeakPolarHBondContact O-CB 3.3Å; L30-L34 PolarHBondContact O-N 3.16Å; L31-L34 PolarHBondContact O-N 3.02Å; F32-L34 VanDerWaalsContact C-N 3.33Å; L34-F36 VanDerWaalsContact C-N 3.29Å; L34-F36 PolarHBondContact O-N 3.45Å; L34-L37 PolarHBondContact O-N 3.48Å; L34-V38 HydrophobicContact CD1-CG2 3.76Å; L34-V38 HydrophobicContact CG-CG2 4.26Å; L34-V38 WeakPolarHBondContact O-CB 3.28Å; L34-V38 VanDerWaalsContact O-CG2 3.31Å; L34-V38 WeakPolarHBondContact O-CG2 3.34Å; L34-V38 PolarHBondContact O-N 3.14Å |
| 35 | I | 95.6 | Very high | 92.1 | Very high | 14 Ų | 14 | 51 Ų | 51 | 7% | 0.072 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -57.4 | -45.4 | 174.5 | -71.1 | 167.2 | 0 | 0 | 0 | 110 | L31 F32 G39 V79 L279 A283 C286 | L31-I35 VanDerWaalsContact O-CG1 3.31Å; L31-I35 WeakPolarHBondContact O-CG1 3.49Å; L31-I35 PolarHBondContact O-N 2.77Å; F32-I35 HydrophobicContact CD1-CD1 4.41Å; F32-I35 PolarHBondContact O-N 3.11Å; I35-G39 WeakPolarHBondContact O-CA 3.45Å; I35-G39 PolarHBondContact O-N 3.26Å; I35-V79 HydrophobicContact CG2-CG1 4.46Å; I35-V79 HydrophobicContact CG2-CG2 4.37Å; I35-L279 HydrophobicContact CD1-CD2 4.09Å; I35-A283 HydrophobicContact CD1-CB 4.46Å; I35-C286 PolarHBondContact O-SG 3.45Å |
| 36 | F | 96.5 | Very high | 93 | Very high | 76 Ų | 76 | 48.6 Ų | 48.6 | 33% | 0.333 | 28% | 0.277 | S | S | . | . | H | α-helix | trans | -61.5 | -47.5 | 179.2 | -177.3 | -92.4 | 0 | 0 | 0 | 112.3 | F32 A33 L34 T40 I75 L76 V79 P80 | F32-F36 WeakPolarHBondContact O-CB 3.41Å; F32-F36 PolarHBondContact O-N 2.98Å; A33-F36 PolarHBondContact O-N 3Å; L34-F36 VanDerWaalsContact C-N 3.29Å; L34-F36 PolarHBondContact O-N 3.45Å; F36-T40 WeakPolarHBondContact O-CB 3.28Å; F36-T40 PolarHBondContact O-N 2.93Å; F36-T40 PolarHBondContact O-OG1 3.18Å; F36-I75 HydrophobicContact CD2-CG2 3.77Å; F36-I75 WeakPolarHBondContact CD2-O 3.27Å; F36-I75 HydrophobicContact CE2-CG2 4.29Å; F36-I75 HydrophobicContact CG-CG2 4.34Å; F36-L76 HydrophobicContact CE2-CD2 3.97Å; F36-L76 HydrophobicContact CZ-CD2 3.96Å; F36-V79 HydrophobicContact CB-CG1 4.24Å; F36-P80 HydrophobicContact CD2-CG 3.98Å; F36-P80 HydrophobicContact CE2-CG 3.79Å |
| 37 | L | 96.4 | Very high | 93.4 | Very high | 109 Ų | 109 | 46.4 Ų | 46.4 | 57% | 0.571 | 26% | 0.262 | S | S | * | . | H | α-helix | trans | -65.9 | -54.7 | -179.1 | -179.8 | 64.8 | 0 | 0 | 0 | 111.6 | A33 L34 G39 T40 V41 | A33-L37 WeakPolarHBondContact O-CB 3.13Å; A33-L37 PolarHBondContact O-N 3.33Å; L34-L37 PolarHBondContact O-N 3.48Å; L37-G39 VanDerWaalsContact C-N 3.34Å; L37-G39 PolarHBondContact O-N 2.96Å; L37-T40 PolarHBondContact O-N 3.37Å; L37-V41 HydrophobicContact CD1-CG2 4.16Å; L37-V41 WeakPolarHBondContact O-CB 3.5Å; L37-V41 VanDerWaalsContact O-CG2 3.28Å; L37-V41 WeakPolarHBondContact O-CG2 3.22Å; L37-V41 PolarHBondContact O-N 3.36Å |
| 38 | V | 95.4 | Very high | 93.6 | Very high | 52 Ų | 52 | 43.1 Ų | 43.1 | 32% | 0.315 | 25% | 0.249 | S | C | . | . | H | α-helix | trans | -63.8 | -43.9 | -177.8 | 175.6 | 0 | 0 | 0 | 0 | 110.3 | L34 G42 C286 I290 | L34-V38 HydrophobicContact CD1-CG2 3.76Å; L34-V38 HydrophobicContact CG-CG2 4.26Å; L34-V38 WeakPolarHBondContact O-CB 3.28Å; L34-V38 VanDerWaalsContact O-CG2 3.31Å; L34-V38 WeakPolarHBondContact O-CG2 3.34Å; L34-V38 PolarHBondContact O-N 3.14Å; V38-G42 WeakPolarHBondContact O-CA 3.49Å; V38-G42 PolarHBondContact O-N 2.9Å; V38-C286 HydrophobicContact CB-CB 4.5Å; V38-C286 HydrophobicContact CG1-CB 3.96Å; V38-I290 HydrophobicContact CG1-CD1 4.21Å |
| 39 | G | 95.3 | Very high | 93.7 | Very high | 0 Ų | 0 | 43.1 Ų | 43.1 | 0% | 0 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -62.8 | -48.9 | 179.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | I35 L37 N43 I75 C286 | I35-G39 WeakPolarHBondContact O-CA 3.45Å; I35-G39 PolarHBondContact O-N 3.26Å; L37-G39 VanDerWaalsContact C-N 3.34Å; L37-G39 PolarHBondContact O-N 2.96Å; G39-N43 WeakPolarHBondContact O-CB 3.35Å; G39-N43 PolarHBondContact O-N 3.49Å; G39-N43 PolarHBondContact O-ND2 3.15Å; G39-I75 VanDerWaalsContact C-CD1 3.5Å; G39-I75 VanDerWaalsContact CA-CD1 3.41Å; G39-C286 VanDerWaalsContact CA-SG 3.56Å; G39-C286 PolarHBondContact N-SG 2.73Å |
| 40 | T | 96.1 | Very high | 93.7 | Very high | 30 Ų | 30 | 41.5 Ų | 41.5 | 18% | 0.184 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -63.4 | -54.5 | 179.5 | -57.9 | 0 | 0 | 0 | 0 | 110.5 | F36 L37 G42 N43 T44 L72 I75 L76 | F36-T40 WeakPolarHBondContact O-CB 3.28Å; F36-T40 PolarHBondContact O-N 2.93Å; F36-T40 PolarHBondContact O-OG1 3.18Å; L37-T40 PolarHBondContact O-N 3.37Å; T40-G42 PolarHBondContact O-N 2.93Å; T40-N43 PolarHBondContact O-N 3.48Å; T40-T44 VanDerWaalsContact O-CB 3.25Å; T40-T44 WeakPolarHBondContact O-CB 3.38Å; T40-T44 PolarHBondContact O-N 3.21Å; T40-T44 PolarHBondContact O-OG1 3.22Å; T40-L72 HydrophobicContact CG2-CD2 4.46Å; T40-I75 WeakPolarHBondContact OG1-CG2 3.22Å; T40-L76 HydrophobicContact CG2-CD2 4.21Å |
| 41 | V | 95.4 | Very high | 93.4 | Very high | 79 Ų | 79 | 41.2 Ų | 41.2 | 48% | 0.479 | 24% | 0.237 | S | C | . | . | H | α-helix | trans | -59.1 | -47.9 | -178.9 | 173 | 0 | 0 | 0 | 0 | 111 | L37 L45 | L37-V41 HydrophobicContact CD1-CG2 4.16Å; L37-V41 WeakPolarHBondContact O-CB 3.5Å; L37-V41 VanDerWaalsContact O-CG2 3.28Å; L37-V41 WeakPolarHBondContact O-CG2 3.22Å; L37-V41 PolarHBondContact O-N 3.36Å; V41-L45 HydrophobicContact CG1-CD1 3.95Å; V41-L45 WeakPolarHBondContact O-CB 3.48Å; V41-L45 WeakPolarHBondContact O-CG 3.45Å; V41-L45 PolarHBondContact O-N 3.3Å |
| 42 | G | 93.8 | Very high | 92.9 | Very high | 12 Ų | 12 | 47 Ų | 47 | 12% | 0.124 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -61.5 | -52.6 | -178 | 0 | 0 | 0 | 0 | 0 | 112.6 | V38 T40 L45 V46 | V38-G42 WeakPolarHBondContact O-CA 3.49Å; V38-G42 PolarHBondContact O-N 2.9Å; T40-G42 PolarHBondContact O-N 2.93Å; G42-L45 PolarHBondContact O-N 3.04Å; G42-V46 WeakPolarHBondContact O-CG2 3.25Å; G42-V46 PolarHBondContact O-N 3.35Å |
| 43 | N | 94.9 | Very high | 91.9 | Very high | 2 Ų | 2 | 49 Ų | 49 | 1% | 0.011 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -71.5 | -35.9 | -176.5 | -71.5 | -67.7 | 0 | 0 | 0 | 112 | G39 T40 L45 V46 L47 L72 S285 P289 | G39-N43 WeakPolarHBondContact O-CB 3.35Å; G39-N43 PolarHBondContact O-N 3.49Å; G39-N43 PolarHBondContact O-ND2 3.15Å; T40-N43 PolarHBondContact O-N 3.48Å; N43-L45 VanDerWaalsContact C-N 3.32Å; N43-L45 PolarHBondContact O-N 3.3Å; N43-V46 WeakPolarHBondContact O-CB 3.44Å; N43-V46 PolarHBondContact O-N 3.48Å; N43-L47 WeakPolarHBondContact O-CG 3.38Å; N43-L47 PolarHBondContact O-N 3.3Å; N43-L72 HydrophobicContact CB-CD1 4.33Å; N43-L72 HydrophobicContact CB-CD2 3.8Å; N43-L72 HydrophobicContact CB-CG 3.67Å; N43-S285 PolarHBondContact ND2-O 3.33Å; N43-P289 HydrophobicContact CB-CG 4.4Å; N43-P289 WeakPolarHBondContact OD1-CG 3.49Å |
| 44 | T | 94.8 | Very high | 90.5 | Very high | 70 Ų | 70 | 49 Ų | 49 | 43% | 0.429 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -60.9 | -41.4 | 171.5 | -59.8 | 0 | 0 | 0 | 0 | 111.6 | T40 L47 A48 | T40-T44 VanDerWaalsContact O-CB 3.25Å; T40-T44 WeakPolarHBondContact O-CB 3.38Å; T40-T44 PolarHBondContact O-N 3.21Å; T40-T44 PolarHBondContact O-OG1 3.22Å; T44-L47 PolarHBondContact O-N 3.05Å; T44-A48 VanDerWaalsContact O-CB 3.3Å; T44-A48 WeakPolarHBondContact O-CB 3.42Å; T44-A48 PolarHBondContact O-N 3.17Å |
| 45 | L | 92.3 | Very high | 89.1 | Confident | 33 Ų | 33 | 47.9 Ų | 47.9 | 17% | 0.173 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -62.8 | -42.1 | 174.8 | -76.3 | 172.7 | 0 | 0 | 0 | 112 | V41 G42 N43 A48 V49 F303 I306 | V41-L45 HydrophobicContact CG1-CD1 3.95Å; V41-L45 WeakPolarHBondContact O-CB 3.48Å; V41-L45 WeakPolarHBondContact O-CG 3.45Å; V41-L45 PolarHBondContact O-N 3.3Å; G42-L45 PolarHBondContact O-N 3.04Å; N43-L45 VanDerWaalsContact C-N 3.32Å; N43-L45 PolarHBondContact O-N 3.3Å; L45-A48 PolarHBondContact O-N 3.28Å; L45-V49 WeakPolarHBondContact O-CG2 3.27Å; L45-V49 PolarHBondContact O-N 3.38Å; L45-F303 HydrophobicContact CB-CD1 3.84Å; L45-F303 HydrophobicContact CB-CE1 3.75Å; L45-I306 HydrophobicContact CD2-CB 4.33Å; L45-I306 HydrophobicContact CD2-CG2 3.75Å |
| 46 | V | 91.3 | Very high | 87.5 | Confident | 1 Ų | 1 | 48.6 Ų | 48.6 | 1% | 0.006 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -57.7 | -50.7 | 176.1 | 171.2 | 0 | 0 | 0 | 0 | 110.6 | G42 N43 A48 V49 L50 I64 P289 Y292 F299 F303 | G42-V46 WeakPolarHBondContact O-CG2 3.25Å; G42-V46 PolarHBondContact O-N 3.35Å; N43-V46 WeakPolarHBondContact O-CB 3.44Å; N43-V46 PolarHBondContact O-N 3.48Å; V46-A48 PolarHBondContact O-N 3.49Å; V46-V49 PolarHBondContact O-N 2.94Å; V46-L50 HydrophobicContact CG1-CD1 4.21Å; V46-L50 WeakPolarHBondContact O-CG 3.43Å; V46-L50 PolarHBondContact O-N 3.43Å; V46-I64 HydrophobicContact CG1-CG2 3.78Å; V46-P289 HydrophobicContact CG2-CB 3.9Å; V46-P289 HydrophobicContact CG2-CG 4.07Å; V46-Y292 HydrophobicContact CG1-CD2 4.26Å; V46-Y292 HydrophobicContact CG1-CE2 4.31Å; V46-Y292 HydrophobicContact CG2-CD2 3.75Å; V46-Y292 HydrophobicContact CG2-CE2 4.37Å; V46-F299 HydrophobicContact CG1-CE1 4.29Å; V46-F303 HydrophobicContact CG2-CE1 4.3Å; V46-F303 HydrophobicContact CG2-CZ 3.81Å |
| 47 | L | 92.2 | Very high | 86.3 | Confident | 27 Ų | 27 | 50 Ų | 50 | 14% | 0.141 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -60.8 | -45.4 | 177.4 | -64.2 | -173.6 | 0 | 0 | 0 | 111.4 | N43 T44 V49 L50 L51 L65 V69 L72 | N43-L47 WeakPolarHBondContact O-CG 3.38Å; N43-L47 PolarHBondContact O-N 3.3Å; T44-L47 PolarHBondContact O-N 3.05Å; L47-V49 VanDerWaalsContact C-N 3.34Å; L47-V49 PolarHBondContact O-N 3Å; L47-L50 PolarHBondContact O-N 2.9Å; L47-L51 WeakPolarHBondContact O-CB 3.35Å; L47-L51 VanDerWaalsContact O-CG 3.27Å; L47-L51 WeakPolarHBondContact O-CG 3.4Å; L47-L51 PolarHBondContact O-N 2.89Å; L47-L65 HydrophobicContact CD2-CB 4.49Å; L47-L65 HydrophobicContact CD2-CD1 3.52Å; L47-L65 HydrophobicContact CD2-CG 3.9Å; L47-V69 HydrophobicContact CD1-CG2 4.28Å; L47-V69 HydrophobicContact CD2-CG2 4.32Å; L47-L72 HydrophobicContact CD1-CD1 3.46Å; L47-L72 VanDerWaalsContact CD1-CD1 3.46Å; L47-L72 HydrophobicContact CG-CD1 4.39Å |
| 48 | A | 90.8 | Very high | 85.6 | Confident | 23 Ų | 23 | 47 Ų | 47 | 19% | 0.19 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -61 | -39.5 | -179.6 | 0 | 0 | 0 | 0 | 0 | 112.8 | T44 L45 V46 R52 I306 | T44-A48 VanDerWaalsContact O-CB 3.3Å; T44-A48 WeakPolarHBondContact O-CB 3.42Å; T44-A48 PolarHBondContact O-N 3.17Å; L45-A48 PolarHBondContact O-N 3.28Å; V46-A48 PolarHBondContact O-N 3.49Å; A48-R52 WeakPolarHBondContact O-CB 3.5Å; A48-R52 VanDerWaalsContact O-CG 3.28Å; A48-R52 WeakPolarHBondContact O-CG 3.35Å; A48-R52 PolarHBondContact O-N 3.02Å; A48-I306 HydrophobicContact CB-CD1 3.74Å |
| 49 | V | 89.2 | Confident | 85.1 | Confident | 8 Ų | 8 | 44.8 Ų | 44.8 | 5% | 0.048 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -64.9 | -43.8 | 176 | 169.5 | 0 | 0 | 0 | 0 | 111.6 | L45 V46 L47 G53 F299 F303 I306 | L45-V49 WeakPolarHBondContact O-CG2 3.27Å; L45-V49 PolarHBondContact O-N 3.38Å; V46-V49 PolarHBondContact O-N 2.94Å; L47-V49 VanDerWaalsContact C-N 3.34Å; L47-V49 PolarHBondContact O-N 3Å; V49-G53 PolarHBondContact O-N 3.3Å; V49-G53 VanDerWaalsContact O-N 3.14Å; V49-F299 HydrophobicContact CB-CD1 4.3Å; V49-F299 HydrophobicContact CG1-CD1 3.89Å; V49-F299 HydrophobicContact CG1-CE1 4.21Å; V49-F303 HydrophobicContact CB-CE1 4.37Å; V49-F303 HydrophobicContact CG2-CD1 3.42Å; V49-F303 VanDerWaalsContact CG2-CD1 3.42Å; V49-F303 HydrophobicContact CG2-CE1 3.62Å; V49-I306 HydrophobicContact CB-CD1 4.49Å; V49-I306 HydrophobicContact CG2-CD1 3.55Å |
| 50 | L | 88 | Confident | 84.7 | Confident | 0 Ų | 0 | 45.1 Ų | 45.1 | 0% | 0 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -69.1 | -42 | -177.4 | -69.9 | 177.4 | 0 | 0 | 0 | 112.3 | V46 L47 Q55 N61 I64 L65 F299 | V46-L50 HydrophobicContact CG1-CD1 4.21Å; V46-L50 WeakPolarHBondContact O-CG 3.43Å; V46-L50 PolarHBondContact O-N 3.43Å; L47-L50 PolarHBondContact O-N 2.9Å; L50-Q55 PolarHBondContact O-N 3.41Å; L50-N61 HydrophobicContact CD2-CB 4.01Å; L50-I64 HydrophobicContact CD1-CB 4.14Å; L50-I64 HydrophobicContact CD1-CG2 3.8Å; L50-L65 HydrophobicContact CB-CD1 4.29Å; L50-L65 HydrophobicContact CD1-CB 4.36Å; L50-L65 HydrophobicContact CD1-CD1 4.38Å; L50-F299 HydrophobicContact CD2-CE1 3.91Å; L50-F299 HydrophobicContact CD2-CZ 3.84Å; L50-F299 HydrophobicContact CG-CE1 4.01Å; L50-F299 HydrophobicContact CG-CZ 4.29Å |
| 51 | L | 87.1 | Confident | 84.3 | Confident | 107 Ų | 107 | 45 Ų | 45 | 56% | 0.56 | 27% | 0.271 | S | S | * | . | H | α-helix | trans | -73.8 | -48.2 | -178.9 | -64.7 | 174.1 | 0 | 0 | 0 | 111.9 | L47 G53 G54 L65 | L47-L51 WeakPolarHBondContact O-CB 3.35Å; L47-L51 VanDerWaalsContact O-CG 3.27Å; L47-L51 WeakPolarHBondContact O-CG 3.4Å; L47-L51 PolarHBondContact O-N 2.89Å; L51-G53 VanDerWaalsContact C-N 3.3Å; L51-G53 PolarHBondContact O-N 3.21Å; L51-G54 PolarHBondContact O-N 3Å; L51-L65 HydrophobicContact CD2-CD1 3.96Å; L51-L65 HydrophobicContact CG-CD1 4.1Å |
| 52 | R | 83.3 | Confident | 84.1 | Confident | 187 Ų | 187 | 42.2 Ų | 42.2 | 71% | 0.706 | 25% | 0.253 | S | S | * | . | H | α-helix | trans | -69.6 | -26.9 | -179.7 | -68.7 | 178.1 | 172.3 | 178.7 | -1.9 | 113.4 | A48 G54 | A48-R52 WeakPolarHBondContact O-CB 3.5Å; A48-R52 VanDerWaalsContact O-CG 3.28Å; A48-R52 WeakPolarHBondContact O-CG 3.35Å; A48-R52 PolarHBondContact O-N 3.02Å; R52-G54 PolarHBondContact O-N 3Å |
| 53 | G | 71.3 | Confident | 84.1 | Confident | 47 Ų | 47 | 42.1 Ų | 42.1 | 49% | 0.485 | 25% | 0.249 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -76.3 | -5.3 | 178 | 0 | 0 | 0 | 0 | 0 | 114.2 | V49 L51 Q55 | V49-G53 PolarHBondContact O-N 3.3Å; V49-G53 VanDerWaalsContact O-N 3.14Å; L51-G53 VanDerWaalsContact C-N 3.3Å; L51-G53 PolarHBondContact O-N 3.21Å; G53-Q55 WeakPolarHBondContact O-CG 3.26Å; G53-Q55 PolarHBondContact O-N 3.32Å |
| 54 | G | 65.4 | Low | 83.9 | Confident | 55 Ų | 55 | 42.3 Ų | 42.3 | 57% | 0.567 | 25% | 0.25 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 61.1 | 22.8 | -170.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | L51 R52 V57 | L51-G54 PolarHBondContact O-N 3Å; R52-G54 PolarHBondContact O-N 3Å; G54-V57 WeakPolarHBondContact O-CG2 3.24Å |
| 55 | Q | 65.1 | Low | 83.8 | Confident | 74 Ų | 74 | 40.8 Ų | 40.8 | 35% | 0.346 | 24% | 0.239 | S | C | . | . | trans | -100.1 | 0.7 | -169 | -62.4 | -157 | -23.7 | 0 | 0 | 113.8 | L50 G53 V57 S58 N61 H298 | L50-Q55 PolarHBondContact O-N 3.41Å; G53-Q55 WeakPolarHBondContact O-CG 3.26Å; G53-Q55 PolarHBondContact O-N 3.32Å; Q55-V57 PolarHBondContact O-N 3.29Å; Q55-S58 PolarHBondContact O-N 2.76Å; Q55-N61 WeakPolarHBondContact O-CB 3.31Å; Q55-N61 PolarHBondContact O-ND2 3.3Å; Q55-H298 VanDerWaalsContact CD-NE2 3.29Å; Q55-H298 PolarHBondContact NE2-NE2 3.06Å; Q55-H298 PolarHBondContact OE1-CE1 3.43Å; Q55-H298 PolarHBondContact OE1-NE2 3.43Å | ||
| 56 | A | 63.4 | Low | 84 | Confident | 29 Ų | 29 | 39.8 Ų | 39.8 | 24% | 0.24 | 23% | 0.234 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -60.5 | -2.3 | 175.1 | 0 | 0 | 0 | 0 | 0 | 113.8 | L62 | A56-L62 WeakPolarHBondContact O-CD2 3.5Å; A56-L62 VanDerWaalsContact O-CG 3.28Å; A56-L62 WeakPolarHBondContact O-CG 3.49Å |
| 57 | V | 69.9 | Low | 84.1 | Confident | 105 Ų | 105 | 39.9 Ų | 39.9 | 64% | 0.636 | 23% | 0.234 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -78.6 | -18.8 | -176.9 | -154.8 | 0 | 0 | 0 | 0 | 113.3 | G54 Q55 P139 | G54-V57 WeakPolarHBondContact O-CG2 3.24Å; Q55-V57 PolarHBondContact O-N 3.29Å; V57-P139 WeakPolarHBondContact O-CG 3.5Å |
| 58 | S | 82.4 | Confident | 84.2 | Confident | 47 Ų | 47 | 38.7 Ų | 38.7 | 33% | 0.329 | 23% | 0.229 | S | C | . | . | S | Bend | trans | -86.9 | 143.1 | 178.2 | 86.3 | 0 | 0 | 0 | 0 | 112.2 | Q55 T60 N61 L62 | Q55-S58 PolarHBondContact O-N 2.76Å; S58-T60 VanDerWaalsContact C-N 3.26Å; S58-T60 PolarHBondContact O-N 2.98Å; S58-N61 WeakPolarHBondContact O-CB 3.32Å; S58-N61 PolarHBondContact O-N 2.98Å; S58-N61 WeakPolarHBondContact OG-CB 3.39Å; S58-N61 PolarHBondContact OG-N 3.2Å; S58-N61 PolarHBondContact OG-ND2 2.96Å; S58-L62 PolarHBondContact O-N 3.28Å |
| 59 | T | 85.4 | Confident | 84.4 | Confident | 5 Ų | 5 | 40.8 Ų | 40.8 | 3% | 0.031 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -53.7 | -41.7 | -178.5 | 59.4 | 0 | 0 | 0 | 0 | 113.4 | N61 L62 F63 D122 R137 T138 A142 | T59-N61 VanDerWaalsContact C-N 3.35Å; T59-L62 WeakPolarHBondContact O-CB 3.47Å; T59-L62 PolarHBondContact O-N 2.88Å; T59-F63 WeakPolarHBondContact O-CD2 2.8Å; T59-F63 PolarHBondContact O-N 3.31Å; T59-F63 VanDerWaalsContact O-N 3.07Å; T59-D122 PolarHBondContact OG1-OD1 3.27Å; T59-R137 HydrophobicContact CG2-CB 3.94Å; T59-R137 VanDerWaalsContact CG2-O 3.26Å; T59-R137 WeakPolarHBondContact CG2-O 3.35Å; T59-R137 PolarHBondContact OG1-NH2 2.97Å; T59-T138 WeakPolarHBondContact CG2-O 3.36Å; T59-A142 HydrophobicContact CG2-CB 3.84Å |
| 60 | T | 85.6 | Confident | 84.8 | Confident | 7 Ų | 7 | 40.4 Ų | 40.4 | 4% | 0.043 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -67.4 | -38.3 | 178.6 | -42.4 | 0 | 0 | 0 | 0 | 111.8 | S58 L62 F63 I64 D122 R123 R137 | S58-T60 VanDerWaalsContact C-N 3.26Å; S58-T60 PolarHBondContact O-N 2.98Å; T60-L62 VanDerWaalsContact C-N 3.31Å; T60-F63 PolarHBondContact O-N 3.44Å; T60-I64 HydrophobicContact CG2-CD1 4.15Å; T60-I64 VanDerWaalsContact O-CG1 3.26Å; T60-I64 WeakPolarHBondContact O-CG1 3.49Å; T60-I64 PolarHBondContact O-N 2.91Å; T60-D122 PolarHBondContact OG1-OD2 2.85Å; T60-R123 PolarHBondContact OG1-NH2 3.44Å; T60-R137 PolarHBondContact OG1-NH2 3.33Å |
| 61 | N | 88.4 | Confident | 85.2 | Confident | 27 Ų | 27 | 40.4 Ų | 40.4 | 14% | 0.144 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -68.8 | -33.4 | 177.2 | -68.5 | -12.4 | 0 | 0 | 0 | 110.9 | L50 Q55 S58 T59 I64 L65 | L50-N61 HydrophobicContact CD2-CB 4.01Å; Q55-N61 WeakPolarHBondContact O-CB 3.31Å; Q55-N61 PolarHBondContact O-ND2 3.3Å; S58-N61 WeakPolarHBondContact O-CB 3.32Å; S58-N61 PolarHBondContact O-N 2.98Å; S58-N61 WeakPolarHBondContact OG-CB 3.39Å; S58-N61 PolarHBondContact OG-N 3.2Å; S58-N61 PolarHBondContact OG-ND2 2.96Å; T59-N61 VanDerWaalsContact C-N 3.35Å; N61-I64 PolarHBondContact O-N 3.01Å; N61-L65 VanDerWaalsContact O-CB 3.27Å; N61-L65 WeakPolarHBondContact O-CB 3.41Å; N61-L65 PolarHBondContact O-N 3.28Å |
| 62 | L | 92.4 | Very high | 85.6 | Confident | 20 Ų | 20 | 36.3 Ų | 36.3 | 11% | 0.105 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -63 | -43.7 | 170.9 | -69.2 | 172.5 | 0 | 0 | 0 | 111.9 | A56 S58 T59 T60 L65 N66 P139 A142 L143 I146 | A56-L62 WeakPolarHBondContact O-CD2 3.5Å; A56-L62 VanDerWaalsContact O-CG 3.28Å; A56-L62 WeakPolarHBondContact O-CG 3.49Å; S58-L62 PolarHBondContact O-N 3.28Å; T59-L62 WeakPolarHBondContact O-CB 3.47Å; T59-L62 PolarHBondContact O-N 2.88Å; T60-L62 VanDerWaalsContact C-N 3.31Å; L62-L65 WeakPolarHBondContact O-CB 3.4Å; L62-L65 PolarHBondContact O-N 3.38Å; L62-N66 WeakPolarHBondContact O-CB 3.46Å; L62-N66 PolarHBondContact O-N 2.92Å; L62-P139 HydrophobicContact CD1-CB 4.17Å; L62-A142 HydrophobicContact CD1-CB 3.85Å; L62-L143 HydrophobicContact CD1-CG 4.41Å; L62-I146 HydrophobicContact CB-CD1 4.04Å |
| 63 | F | 92.9 | Very high | 86.3 | Confident | 11 Ų | 11 | 29.1 Ų | 29.1 | 5% | 0.048 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -67.2 | -38.9 | 175.5 | -68.1 | -55.2 | 0 | 0 | 0 | 113 | T59 T60 L65 N66 L67 T115 A118 V119 D122 A142 A145 I146 I149 | T59-F63 WeakPolarHBondContact O-CD2 2.8Å; T59-F63 PolarHBondContact O-N 3.31Å; T59-F63 VanDerWaalsContact O-N 3.07Å; T60-F63 PolarHBondContact O-N 3.44Å; F63-L65 VanDerWaalsContact C-N 3.31Å; F63-N66 PolarHBondContact O-N 2.9Å; F63-L67 WeakPolarHBondContact O-CB 3.27Å; F63-L67 PolarHBondContact O-N 3.5Å; F63-T115 HydrophobicContact CB-CG2 4.16Å; F63-T115 VanDerWaalsContact O-CG2 3.28Å; F63-T115 WeakPolarHBondContact O-CG2 3.49Å; F63-A118 HydrophobicContact CD1-CB 4.28Å; F63-A118 HydrophobicContact CE1-CB 3.9Å; F63-A118 HydrophobicContact CZ-CB 4.1Å; F63-V119 HydrophobicContact CB-CG2 3.41Å; F63-V119 VanDerWaalsContact CB-CG2 3.41Å; F63-V119 HydrophobicContact CD2-CG2 4.36Å; F63-V119 HydrophobicContact CG-CG2 4.06Å; F63-D122 HydrophobicContact CD2-CB 4.4Å; F63-D122 HydrophobicContact CE2-CB 4.07Å; F63-A142 HydrophobicContact CE2-CB 4.48Å; F63-A142 HydrophobicContact CZ-CB 4.32Å; F63-A145 HydrophobicContact CE1-CB 4.04Å; F63-A145 HydrophobicContact CZ-CB 3.99Å; F63-I146 HydrophobicContact CD1-CD1 4.35Å; F63-I146 HydrophobicContact CD1-CG1 3.95Å; F63-I146 HydrophobicContact CE1-CG1 3.96Å; F63-I149 HydrophobicContact CD1-CD1 4.49Å; F63-I149 HydrophobicContact CE1-CD1 4.23Å |
| 64 | I | 90.8 | Very high | 87.5 | Confident | 6 Ų | 6 | 27.3 Ų | 27.3 | 3% | 0.031 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -65.2 | -38.1 | 174.4 | -65.3 | 166.4 | 0 | 0 | 0 | 110.4 | V46 L50 T60 N61 L67 G68 Y292 F299 | V46-I64 HydrophobicContact CG1-CG2 3.78Å; L50-I64 HydrophobicContact CD1-CB 4.14Å; L50-I64 HydrophobicContact CD1-CG2 3.8Å; T60-I64 HydrophobicContact CG2-CD1 4.15Å; T60-I64 VanDerWaalsContact O-CG1 3.26Å; T60-I64 WeakPolarHBondContact O-CG1 3.49Å; T60-I64 PolarHBondContact O-N 2.91Å; N61-I64 PolarHBondContact O-N 3.01Å; I64-L67 PolarHBondContact O-N 3.33Å; I64-G68 PolarHBondContact O-N 3.32Å; I64-Y292 HydrophobicContact CG2-CE2 3.76Å; I64-F299 HydrophobicContact CD1-CE2 4.41Å; I64-F299 HydrophobicContact CD1-CZ 4.33Å; I64-F299 HydrophobicContact CG2-CZ 4.27Å |
| 65 | L | 92.8 | Very high | 89 | Confident | 38 Ų | 38 | 24.7 Ų | 24.7 | 20% | 0.199 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -61.3 | -47.8 | 173.2 | -167.8 | 90.7 | 0 | 0 | 0 | 110.6 | L47 L50 L51 N61 L62 F63 L67 G68 V69 | L47-L65 HydrophobicContact CD2-CB 4.49Å; L47-L65 HydrophobicContact CD2-CD1 3.52Å; L47-L65 HydrophobicContact CD2-CG 3.9Å; L50-L65 HydrophobicContact CB-CD1 4.29Å; L50-L65 HydrophobicContact CD1-CB 4.36Å; L50-L65 HydrophobicContact CD1-CD1 4.38Å; L51-L65 HydrophobicContact CD2-CD1 3.96Å; L51-L65 HydrophobicContact CG-CD1 4.1Å; N61-L65 VanDerWaalsContact O-CB 3.27Å; N61-L65 WeakPolarHBondContact O-CB 3.41Å; N61-L65 PolarHBondContact O-N 3.28Å; L62-L65 WeakPolarHBondContact O-CB 3.4Å; L62-L65 PolarHBondContact O-N 3.38Å; F63-L65 VanDerWaalsContact C-N 3.31Å; L65-L67 VanDerWaalsContact C-N 3.32Å; L65-L67 PolarHBondContact O-N 3.48Å; L65-G68 PolarHBondContact O-N 3.24Å; L65-V69 WeakPolarHBondContact O-CG2 3.19Å; L65-V69 PolarHBondContact O-N 2.9Å |
| 66 | N | 95.5 | Very high | 90.5 | Very high | 12 Ų | 12 | 25.3 Ų | 25.3 | 6% | 0.064 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -58.1 | -44.3 | 176.8 | -171.1 | 63.1 | 0 | 0 | 0 | 111.9 | L62 F63 V69 A70 T115 I146 W150 | L62-N66 WeakPolarHBondContact O-CB 3.46Å; L62-N66 PolarHBondContact O-N 2.92Å; F63-N66 PolarHBondContact O-N 2.9Å; N66-V69 PolarHBondContact O-N 3.47Å; N66-A70 PolarHBondContact O-N 3.49Å; N66-T115 HydrophobicContact CB-CG2 4.47Å; N66-T115 PolarHBondContact ND2-OG1 3.01Å; N66-I146 HydrophobicContact CB-CD1 4.16Å; N66-I146 HydrophobicContact CB-CG1 4.22Å; N66-I146 WeakPolarHBondContact OD1-CG2 3.48Å; N66-W150 PolarHBondContact OD1-NE1 3.5Å |
| 67 | L | 93.5 | Very high | 92.1 | Very high | 2 Ų | 2 | 26.3 Ų | 26.3 | 1% | 0.01 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -61.1 | -46.1 | 176.7 | -171.4 | 63.1 | 0 | 0 | 0 | 111.2 | F63 I64 L65 V69 A70 D71 T115 L116 N288 | F63-L67 WeakPolarHBondContact O-CB 3.27Å; F63-L67 PolarHBondContact O-N 3.5Å; I64-L67 PolarHBondContact O-N 3.33Å; L65-L67 VanDerWaalsContact C-N 3.32Å; L65-L67 PolarHBondContact O-N 3.48Å; L67-V69 VanDerWaalsContact C-N 3.31Å; L67-V69 PolarHBondContact O-N 3Å; L67-A70 PolarHBondContact O-N 3.21Å; L67-D71 WeakPolarHBondContact O-CB 3.34Å; L67-D71 PolarHBondContact O-N 2.87Å; L67-T115 HydrophobicContact CB-CG2 4.01Å; L67-T115 HydrophobicContact CD1-CG2 4.5Å; L67-L116 HydrophobicContact CD2-CD2 4.04Å; L67-N288 HydrophobicContact CD2-CB 4.41Å |
| 68 | G | 94.6 | Very high | 93.3 | Very high | 2 Ų | 2 | 21.3 Ų | 21.3 | 2% | 0.021 | 13% | 0.125 | C | C | . | . | H | α-helix | trans | -63 | -34.5 | 176.7 | 0 | 0 | 0 | 0 | 0 | 113.6 | I64 L65 L72 | I64-G68 PolarHBondContact O-N 3.32Å; L65-G68 PolarHBondContact O-N 3.24Å; G68-L72 WeakPolarHBondContact O-CB 3.46Å; G68-L72 VanDerWaalsContact O-CG 3.31Å; G68-L72 WeakPolarHBondContact O-CG 3.35Å; G68-L72 PolarHBondContact O-N 3.09Å |
| 69 | V | 96.1 | Very high | 93.9 | Very high | 67 Ų | 67 | 19.1 Ų | 19.1 | 41% | 0.406 | 11% | 0.11 | S | C | . | . | H | α-helix | trans | -68.7 | -45.3 | 173.8 | 170.7 | 0 | 0 | 0 | 0 | 111.2 | L47 L65 N66 L67 L72 C73 | L47-V69 HydrophobicContact CD1-CG2 4.28Å; L47-V69 HydrophobicContact CD2-CG2 4.32Å; L65-V69 WeakPolarHBondContact O-CG2 3.19Å; L65-V69 PolarHBondContact O-N 2.9Å; N66-V69 PolarHBondContact O-N 3.47Å; L67-V69 VanDerWaalsContact C-N 3.31Å; L67-V69 PolarHBondContact O-N 3Å; V69-L72 PolarHBondContact O-N 2.97Å; V69-C73 WeakPolarHBondContact O-CB 3.45Å; V69-C73 PolarHBondContact O-N 3.17Å |
| 70 | A | 96.8 | Very high | 94.3 | Very high | 0 Ų | 0 | 21.4 Ų | 21.4 | 0% | 0 | 12% | 0.124 | C | C | . | . | H | α-helix | trans | -62.4 | -45.2 | 177 | 0 | 0 | 0 | 0 | 0 | 111.7 | N66 L67 C73 F74 A111 W150 | N66-A70 PolarHBondContact O-N 3.49Å; L67-A70 PolarHBondContact O-N 3.21Å; A70-C73 PolarHBondContact O-N 3.38Å; A70-F74 PolarHBondContact O-N 3.39Å; A70-A111 HydrophobicContact CB-CB 4.2Å; A70-W150 HydrophobicContact CB-CZ2 4.5Å |
| 71 | D | 96.1 | Very high | 94.7 | Very high | 0 Ų | 0 | 23.3 Ų | 23.3 | 0% | 0 | 13% | 0.132 | C | C | . | . | H | α-helix | trans | -63.1 | -44.5 | 177 | -78.6 | -30.4 | 0 | 0 | 0 | 111.5 | L67 F74 I75 S285 N288 | L67-D71 WeakPolarHBondContact O-CB 3.34Å; L67-D71 PolarHBondContact O-N 2.87Å; D71-F74 WeakPolarHBondContact O-CB 3.37Å; D71-F74 PolarHBondContact O-N 2.99Å; D71-I75 WeakPolarHBondContact O-CB 3.42Å; D71-I75 VanDerWaalsContact O-CD1 3.29Å; D71-I75 WeakPolarHBondContact O-CD1 3.24Å; D71-I75 WeakPolarHBondContact O-CG1 3.28Å; D71-I75 PolarHBondContact O-N 3.11Å; D71-S285 WeakPolarHBondContact OD1-CA 3.22Å; D71-S285 VanDerWaalsContact OD1-CB 3.23Å; D71-S285 WeakPolarHBondContact OD1-CB 3.26Å; D71-S285 PolarHBondContact OD1-OG 2.78Å; D71-N288 PolarHBondContact OD2-ND2 3.39Å |
| 72 | L | 96.7 | Very high | 94.8 | Very high | 21 Ų | 21 | 22.5 Ų | 22.5 | 11% | 0.11 | 13% | 0.128 | C | C | . | . | H | α-helix | trans | -64.6 | -40.7 | 175.6 | -78.3 | 174.8 | 0 | 0 | 0 | 112.5 | T40 N43 L47 G68 V69 F74 I75 L76 | T40-L72 HydrophobicContact CG2-CD2 4.46Å; N43-L72 HydrophobicContact CB-CD1 4.33Å; N43-L72 HydrophobicContact CB-CD2 3.8Å; N43-L72 HydrophobicContact CB-CG 3.67Å; L47-L72 HydrophobicContact CD1-CD1 3.46Å; L47-L72 VanDerWaalsContact CD1-CD1 3.46Å; L47-L72 HydrophobicContact CG-CD1 4.39Å; G68-L72 WeakPolarHBondContact O-CB 3.46Å; G68-L72 VanDerWaalsContact O-CG 3.31Å; G68-L72 WeakPolarHBondContact O-CG 3.35Å; G68-L72 PolarHBondContact O-N 3.09Å; V69-L72 PolarHBondContact O-N 2.97Å; L72-F74 VanDerWaalsContact C-N 3.3Å; L72-F74 PolarHBondContact O-N 2.97Å; L72-I75 PolarHBondContact O-N 3.45Å; L72-L76 VanDerWaalsContact O-CB 3.28Å; L72-L76 WeakPolarHBondContact O-CB 3.37Å; L72-L76 VanDerWaalsContact O-CG 3.24Å; L72-L76 WeakPolarHBondContact O-CG 3.31Å; L72-L76 PolarHBondContact O-N 3.03Å |
| 73 | C | 97 | Very high | 94.8 | Very high | 36 Ų | 36 | 22.4 Ų | 22.4 | 24% | 0.243 | 13% | 0.129 | C | C | . | . | H | α-helix | trans | -59.3 | -45.4 | 175.4 | -177 | 0 | 0 | 0 | 0 | 110.6 | V69 A70 C77 T108 | V69-C73 WeakPolarHBondContact O-CB 3.45Å; V69-C73 PolarHBondContact O-N 3.17Å; A70-C73 PolarHBondContact O-N 3.38Å; C73-C77 WeakPolarHBondContact O-CB 3.26Å; C73-C77 PolarHBondContact O-N 2.73Å; C73-T108 HydrophobicContact CB-CG2 3.87Å |
| 74 | F | 97.1 | Very high | 94.7 | Very high | 9 Ų | 9 | 23.2 Ų | 23.2 | 4% | 0.039 | 14% | 0.135 | C | C | . | . | H | α-helix | trans | -60.5 | -50.1 | 175.1 | 176.4 | -109.1 | 0 | 0 | 0 | 112.2 | A70 D71 L72 C78 V79 I105 T108 Y282 S285 | A70-F74 PolarHBondContact O-N 3.39Å; D71-F74 WeakPolarHBondContact O-CB 3.37Å; D71-F74 PolarHBondContact O-N 2.99Å; L72-F74 VanDerWaalsContact C-N 3.3Å; L72-F74 PolarHBondContact O-N 2.97Å; F74-C78 HydrophobicContact CD2-CB 3.92Å; F74-C78 HydrophobicContact CE2-CB 4.1Å; F74-C78 WeakPolarHBondContact O-CA 3.37Å; F74-C78 WeakPolarHBondContact O-CB 3.24Å; F74-C78 PolarHBondContact O-N 2.99Å; F74-V79 HydrophobicContact CD1-CG2 4.3Å; F74-V79 HydrophobicContact CE1-CG2 3.92Å; F74-V79 HydrophobicContact CZ-CG2 4.33Å; F74-V79 PolarHBondContact O-N 3.48Å; F74-I105 HydrophobicContact CE2-CB 4.45Å; F74-I105 HydrophobicContact CE2-CG1 4.1Å; F74-I105 HydrophobicContact CE2-CG2 4.22Å; F74-T108 HydrophobicContact CB-CG2 4.22Å; F74-T108 WeakPolarHBondContact CB-OG1 3.43Å; F74-T108 WeakPolarHBondContact CD2-OG1 3.33Å; F74-Y282 HydrophobicContact CE1-CD1 4.46Å; F74-Y282 HydrophobicContact CE1-CD2 4.17Å; F74-Y282 HydrophobicContact CE1-CG 4.02Å; F74-Y282 HydrophobicContact CE2-CE1 4.5Å; F74-Y282 HydrophobicContact CE2-CE2 4.43Å; F74-Y282 AromaticContact CZ-CD1 3.69Å; F74-Y282 HydrophobicContact CZ-CD1 3.69Å; F74-Y282 AromaticContact CZ-CD2 3.58Å; F74-Y282 HydrophobicContact CZ-CD2 3.58Å; F74-Y282 AromaticContact CZ-CE1 3.96Å; F74-Y282 HydrophobicContact CZ-CE1 3.96Å; F74-Y282 AromaticContact CZ-CE2 3.81Å; F74-Y282 HydrophobicContact CZ-CE2 3.81Å; F74-Y282 AromaticContact CZ-CG 3.54Å; F74-Y282 HydrophobicContact CZ-CG 3.54Å; F74-S285 WeakPolarHBondContact CD1-OG 3.44Å |
| 75 | I | 96.9 | Very high | 94.6 | Very high | 0 Ų | 0 | 25.9 Ų | 25.9 | 0% | 0 | 15% | 0.149 | C | C | . | . | H | α-helix | trans | -66 | -44 | -175.7 | -67.9 | 157.1 | 0 | 0 | 0 | 111.3 | F36 G39 T40 D71 L72 V79 P80 | F36-I75 HydrophobicContact CD2-CG2 3.77Å; F36-I75 WeakPolarHBondContact CD2-O 3.27Å; F36-I75 HydrophobicContact CE2-CG2 4.29Å; F36-I75 HydrophobicContact CG-CG2 4.34Å; G39-I75 VanDerWaalsContact C-CD1 3.5Å; G39-I75 VanDerWaalsContact CA-CD1 3.41Å; T40-I75 WeakPolarHBondContact OG1-CG2 3.22Å; D71-I75 WeakPolarHBondContact O-CB 3.42Å; D71-I75 VanDerWaalsContact O-CD1 3.29Å; D71-I75 WeakPolarHBondContact O-CD1 3.24Å; D71-I75 WeakPolarHBondContact O-CG1 3.28Å; D71-I75 PolarHBondContact O-N 3.11Å; L72-I75 PolarHBondContact O-N 3.45Å; I75-V79 WeakPolarHBondContact O-CB 3.18Å; I75-P80 VanDerWaalsContact O-CD 3.32Å; I75-P80 WeakPolarHBondContact O-CD 3.34Å |
| 76 | L | 96.4 | Very high | 94.2 | Very high | 87 Ų | 87 | 25.8 Ų | 25.8 | 46% | 0.455 | 15% | 0.146 | S | C | . | . | H | α-helix | trans | -77 | -41.4 | -175.9 | -64.1 | 175.1 | 0 | 0 | 0 | 112.4 | F36 T40 L72 | F36-L76 HydrophobicContact CE2-CD2 3.97Å; F36-L76 HydrophobicContact CZ-CD2 3.96Å; T40-L76 HydrophobicContact CG2-CD2 4.21Å; L72-L76 VanDerWaalsContact O-CB 3.28Å; L72-L76 WeakPolarHBondContact O-CB 3.37Å; L72-L76 VanDerWaalsContact O-CG 3.24Å; L72-L76 WeakPolarHBondContact O-CG 3.31Å; L72-L76 PolarHBondContact O-N 3.03Å |
| 77 | C | 95.9 | Very high | 93.7 | Very high | 50 Ų | 50 | 28.2 Ų | 28.2 | 34% | 0.338 | 16% | 0.162 | S | C | . | . | H | α-helix | trans | -95 | -18.1 | -171.8 | -56.6 | 0 | 0 | 0 | 0 | 113.9 | C73 F81 L104 | C73-C77 WeakPolarHBondContact O-CB 3.26Å; C73-C77 PolarHBondContact O-N 2.73Å; C77-F81 WeakPolarHBondContact O-CD2 3.28Å; C77-L104 HydrophobicContact CB-CD1 3.86Å |
| 78 | C | 95.5 | Very high | 93.4 | Very high | 0 Ų | 0 | 31.6 Ų | 31.6 | 0% | 0 | 18% | 0.179 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -117.9 | -44.5 | -172 | -49.8 | 0 | 0 | 0 | 0 | 113.5 | F74 F81 Q82 I105 | F74-C78 HydrophobicContact CD2-CB 3.92Å; F74-C78 HydrophobicContact CE2-CB 4.1Å; F74-C78 WeakPolarHBondContact O-CA 3.37Å; F74-C78 WeakPolarHBondContact O-CB 3.24Å; F74-C78 PolarHBondContact O-N 2.99Å; C78-F81 PolarHBondContact O-N 2.86Å; C78-Q82 PolarHBondContact O-N 2.95Å; C78-I105 HydrophobicContact CB-CD1 4.24Å; C78-I105 HydrophobicContact CB-CG1 3.51Å |
| 79 | V | 95.1 | Very high | 93 | Very high | 2 Ų | 2 | 38.6 Ų | 38.6 | 1% | 0.012 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -59.8 | -44.7 | -173.2 | 172.8 | 0 | 0 | 0 | 0 | 113.5 | F32 I35 F36 F74 I75 F81 Q82 A83 Y282 | F32-V79 HydrophobicContact CB-CG1 4.28Å; F32-V79 HydrophobicContact CD1-CG1 3.94Å; I35-V79 HydrophobicContact CG2-CG1 4.46Å; I35-V79 HydrophobicContact CG2-CG2 4.37Å; F36-V79 HydrophobicContact CB-CG1 4.24Å; F74-V79 HydrophobicContact CD1-CG2 4.3Å; F74-V79 HydrophobicContact CE1-CG2 3.92Å; F74-V79 HydrophobicContact CZ-CG2 4.33Å; F74-V79 PolarHBondContact O-N 3.48Å; I75-V79 WeakPolarHBondContact O-CB 3.18Å; V79-F81 PolarHBondContact O-N 3.18Å; V79-Q82 PolarHBondContact O-N 2.84Å; V79-A83 PolarHBondContact O-N 2.89Å; V79-Y282 HydrophobicContact CG2-CD2 4.38Å |
| 80 | P | 94 | Very high | 92.7 | Very high | 53 Ų | 53 | 36.5 Ų | 36.5 | 34% | 0.344 | 21% | 0.208 | S | C | . | . | H | α-helix | trans | -59.7 | -45.4 | 178.1 | -25 | 34.7 | 0 | 0 | 0 | 112.4 | F36 I75 A83 T84 | F36-P80 HydrophobicContact CD2-CG 3.98Å; F36-P80 HydrophobicContact CE2-CG 3.79Å; I75-P80 VanDerWaalsContact O-CD 3.32Å; I75-P80 WeakPolarHBondContact O-CD 3.34Å; P80-A83 WeakPolarHBondContact O-CB 3.49Å; P80-A83 PolarHBondContact O-N 2.86Å; P80-T84 WeakPolarHBondContact O-CG2 3.18Å; P80-T84 PolarHBondContact O-N 2.99Å |
| 81 | F | 93.9 | Very high | 92.5 | Very high | 46 Ų | 46 | 37.1 Ų | 37.1 | 20% | 0.202 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -67.4 | -37 | 177.9 | -63.9 | -82.1 | 0 | 0 | 0 | 111.8 | C77 C78 V79 A83 T84 I85 W91 F93 L97 V101 | C77-F81 WeakPolarHBondContact O-CD2 3.28Å; C78-F81 PolarHBondContact O-N 2.86Å; V79-F81 PolarHBondContact O-N 3.18Å; F81-A83 VanDerWaalsContact C-N 3.33Å; F81-A83 PolarHBondContact O-N 3.23Å; F81-T84 PolarHBondContact O-N 3.34Å; F81-T84 PolarHBondContact O-OG1 3.45Å; F81-I85 PolarHBondContact O-N 2.97Å; F81-W91 HydrophobicContact CB-CH2 4.3Å; F81-W91 HydrophobicContact CD1-CH2 4.28Å; F81-F93 HydrophobicContact CD1-CD1 4.19Å; F81-F93 AromaticContact CD1-CD2 4Å; F81-F93 HydrophobicContact CD1-CD2 4Å; F81-F93 HydrophobicContact CD1-CE1 4.33Å; F81-F93 HydrophobicContact CD1-CE2 4.16Å; F81-F93 HydrophobicContact CD1-CG 4.03Å; F81-F93 HydrophobicContact CD1-CZ 4.33Å; F81-F93 AromaticContact CE1-CD1 3.84Å; F81-F93 HydrophobicContact CE1-CD1 3.84Å; F81-F93 HydrophobicContact CE1-CD2 4.45Å; F81-F93 HydrophobicContact CE1-CE1 4.12Å; F81-F93 HydrophobicContact CE1-CG 4.03Å; F81-L97 HydrophobicContact CE1-CD1 4.03Å; F81-L97 HydrophobicContact CE1-CD2 4.32Å; F81-L97 HydrophobicContact CZ-CD1 4.38Å; F81-L97 HydrophobicContact CZ-CD2 4.12Å; F81-V101 HydrophobicContact CB-CB 4.5Å; F81-V101 HydrophobicContact CB-CG1 3.86Å; F81-V101 HydrophobicContact CB-CG2 3.89Å; F81-V101 HydrophobicContact CD1-CG2 4.21Å; F81-V101 HydrophobicContact CD2-CG2 3.72Å; F81-V101 HydrophobicContact CE2-CG2 4.27Å; F81-V101 HydrophobicContact CG-CG2 3.67Å |
| 82 | Q | 91.9 | Very high | 92.4 | Very high | 11 Ų | 11 | 42.1 Ų | 42.1 | 5% | 0.051 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -64.8 | -39.1 | 175 | -169.3 | 68.4 | 32.1 | 0 | 0 | 111.8 | F32 C78 V79 T84 I85 Y86 Y282 | F32-Q82 HydrophobicContact CE1-CG 4.28Å; F32-Q82 HydrophobicContact CZ-CG 4.03Å; C78-Q82 PolarHBondContact O-N 2.95Å; V79-Q82 PolarHBondContact O-N 2.84Å; Q82-T84 PolarHBondContact O-N 3.46Å; Q82-I85 WeakPolarHBondContact O-CB 3.48Å; Q82-I85 PolarHBondContact O-N 3.41Å; Q82-I85 VanDerWaalsContact O-N 3.15Å; Q82-Y86 HydrophobicContact CG-CE2 3.95Å; Q82-Y86 VanDerWaalsContact O-CD2 3.28Å; Q82-Y86 WeakPolarHBondContact O-CD2 3.36Å; Q82-Y282 HydrophobicContact CB-CE2 3.85Å; Q82-Y282 HydrophobicContact CG-CE2 3.53Å; Q82-Y282 PolarHBondContact OE1-OH 3.04Å |
| 83 | A | 91.5 | Very high | 92.3 | Very high | 17 Ų | 17 | 44.5 Ų | 44.5 | 14% | 0.14 | 25% | 0.25 | C | S | . | . | H | α-helix | trans | -57.2 | -40.2 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.1 | F32 V79 P80 F81 I85 Y86 T87 | F32-A83 HydrophobicContact CB-CB 3.81Å; F32-A83 HydrophobicContact CD2-CB 3.91Å; F32-A83 HydrophobicContact CG-CB 3.96Å; V79-A83 PolarHBondContact O-N 2.89Å; P80-A83 WeakPolarHBondContact O-CB 3.49Å; P80-A83 PolarHBondContact O-N 2.86Å; F81-A83 VanDerWaalsContact C-N 3.33Å; F81-A83 PolarHBondContact O-N 3.23Å; A83-I85 VanDerWaalsContact C-N 3.27Å; A83-I85 PolarHBondContact O-N 3.05Å; A83-Y86 PolarHBondContact O-N 3.41Å; A83-Y86 VanDerWaalsContact O-N 3.09Å; A83-T87 PolarHBondContact O-N 2.86Å |
| 84 | T | 91 | Very high | 92.2 | Very high | 29 Ų | 29 | 44 Ų | 44 | 18% | 0.178 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -65.2 | -27.1 | -179.9 | 66.5 | 0 | 0 | 0 | 0 | 114.3 | P80 F81 Q82 Y86 T87 L88 F93 | P80-T84 WeakPolarHBondContact O-CG2 3.18Å; P80-T84 PolarHBondContact O-N 2.99Å; F81-T84 PolarHBondContact O-N 3.34Å; F81-T84 PolarHBondContact O-OG1 3.45Å; Q82-T84 PolarHBondContact O-N 3.46Å; T84-Y86 PolarHBondContact O-N 2.97Å; T84-T87 WeakPolarHBondContact CA-OG1 3.41Å; T84-T87 PolarHBondContact O-N 2.97Å; T84-T87 PolarHBondContact O-OG1 3.35Å; T84-L88 HydrophobicContact CG2-CD1 4.29Å; T84-L88 WeakPolarHBondContact O-CB 3.29Å; T84-L88 PolarHBondContact O-N 2.93Å; T84-F93 HydrophobicContact CG2-CE2 4.09Å; T84-F93 HydrophobicContact CG2-CZ 3.95Å; T84-F93 VanDerWaalsContact OG1-CE2 3.31Å; T84-F93 WeakPolarHBondContact OG1-CE2 3.45Å |
| 85 | I | 87.8 | Confident | 92.1 | Very high | 61 Ų | 61 | 46.2 Ų | 46.2 | 31% | 0.313 | 27% | 0.268 | S | S | . | . | H | α-helix | trans | -64.4 | -23.1 | 176.2 | -66.9 | 172.1 | 0 | 0 | 0 | 111.6 | F81 Q82 A83 W91 | F81-I85 PolarHBondContact O-N 2.97Å; Q82-I85 WeakPolarHBondContact O-CB 3.48Å; Q82-I85 PolarHBondContact O-N 3.41Å; Q82-I85 VanDerWaalsContact O-N 3.15Å; A83-I85 VanDerWaalsContact C-N 3.27Å; A83-I85 PolarHBondContact O-N 3.05Å; I85-W91 HydrophobicContact CD1-CZ3 4.14Å; I85-W91 HydrophobicContact CG1-CE3 4.17Å; I85-W91 HydrophobicContact CG1-CZ3 4.04Å |
| 86 | Y | 84.7 | Confident | 92 | Very high | 36 Ų | 36 | 53 Ų | 53 | 14% | 0.141 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -101.7 | -8.7 | 178.8 | -58.7 | -72.2 | 0 | 0 | 0 | 113.8 | V28 F32 Q82 A83 T84 I275 | V28-Y86 HydrophobicContact CG1-CD2 3.98Å; V28-Y86 HydrophobicContact CG1-CG 3.91Å; F32-Y86 HydrophobicContact CD2-CD2 4.46Å; F32-Y86 AromaticContact CE2-CD2 3.46Å; F32-Y86 HydrophobicContact CE2-CD2 3.46Å; F32-Y86 VanDerWaalsContact CE2-CD2 3.46Å; F32-Y86 AromaticContact CE2-CE2 3.65Å; F32-Y86 HydrophobicContact CE2-CE2 3.65Å; F32-Y86 HydrophobicContact CZ-CD2 4.01Å; F32-Y86 AromaticContact CZ-CE2 3.7Å; F32-Y86 HydrophobicContact CZ-CE2 3.7Å; Q82-Y86 HydrophobicContact CG-CE2 3.95Å; Q82-Y86 VanDerWaalsContact O-CD2 3.28Å; Q82-Y86 WeakPolarHBondContact O-CD2 3.36Å; A83-Y86 PolarHBondContact O-N 3.41Å; A83-Y86 VanDerWaalsContact O-N 3.09Å; T84-Y86 PolarHBondContact O-N 2.97Å; Y86-I275 HydrophobicContact CD1-CD1 3.95Å; Y86-I275 HydrophobicContact CD1-CG1 4.07Å; Y86-I275 HydrophobicContact CE1-CD1 4.08Å; Y86-I275 HydrophobicContact CE1-CG1 3.68Å |
| 87 | T | 86.1 | Confident | 92 | Very high | 63 Ų | 63 | 51.7 Ų | 51.7 | 39% | 0.387 | 30% | 0.297 | S | S | . | . | H | α-helix | trans | -112.2 | -31.5 | -179.3 | 59 | 0 | 0 | 0 | 0 | 114.3 | P29 A83 T84 | P29-T87 HydrophobicContact CB-CG2 4.03Å; P29-T87 HydrophobicContact CG-CG2 3.1Å; A83-T87 PolarHBondContact O-N 2.86Å; T84-T87 WeakPolarHBondContact CA-OG1 3.41Å; T84-T87 PolarHBondContact O-N 2.97Å; T84-T87 PolarHBondContact O-OG1 3.35Å |
| 88 | L | 87.4 | Confident | 92 | Very high | 74 Ų | 74 | 49.3 Ų | 49.3 | 39% | 0.387 | 28% | 0.281 | S | S | . | . | S | Bend | trans | -96.1 | 143.5 | -179.6 | -57.5 | -177.7 | 0 | 0 | 0 | 109.2 | T84 G90 V92 F93 | T84-L88 HydrophobicContact CG2-CD1 4.29Å; T84-L88 WeakPolarHBondContact O-CB 3.29Å; T84-L88 PolarHBondContact O-N 2.93Å; L88-G90 PolarHBondContact O-N 3.26Å; L88-V92 HydrophobicContact CD1-CG2 3.93Å; L88-F93 HydrophobicContact CD1-CE2 4.45Å |
| 89 | D | 85.2 | Confident | 92 | Very high | 149 Ų | 149 | 52.9 Ų | 52.9 | 80% | 0.797 | 30% | 0.297 | S | S | * | . | S | Bend | trans | -67.7 | -18.5 | 176.4 | -61.3 | -46.4 | 0 | 0 | 0 | 112.7 | L172 | D89-L172 HydrophobicContact CB-CD2 4.19Š|
| 90 | G | 89.3 | Confident | 92.1 | Very high | 23 Ų | 23 | 54.3 Ų | 54.3 | 24% | 0.237 | 31% | 0.308 | C | S | . | . | S | Bend | trans | -154.2 | 164.9 | -179.2 | 0 | 0 | 0 | 0 | 0 | 114.4 | L88 V92 T173 | L88-G90 PolarHBondContact O-N 3.26Å; G90-V92 PolarHBondContact O-N 2.93Å; G90-T173 CarbonylContact C-O 3.58Å; G90-T173 VanDerWaalsContact CA-O 3.3Å; G90-T173 WeakPolarHBondContact CA-O 3.45Å |
| 91 | W | 93.5 | Very high | 92.2 | Very high | 13 Ų | 13 | 51.9 Ų | 51.9 | 5% | 0.049 | 29% | 0.293 | C | S | . | . | trans | -80.3 | 112.7 | 176.5 | -176.9 | -95.8 | 0 | 0 | 0 | 111.5 | F81 I85 F93 G94 L97 C98 T173 C175 | F81-W91 HydrophobicContact CB-CH2 4.3Å; F81-W91 HydrophobicContact CD1-CH2 4.28Å; I85-W91 HydrophobicContact CD1-CZ3 4.14Å; I85-W91 HydrophobicContact CG1-CE3 4.17Å; I85-W91 HydrophobicContact CG1-CZ3 4.04Å; W91-F93 HydrophobicContact CD2-CD2 4.14Å; W91-F93 HydrophobicContact CE3-CD2 4.05Å; W91-F93 HydrophobicContact CH2-CB 4.33Å; W91-F93 AromaticContact CH2-CD2 3.83Å; W91-F93 HydrophobicContact CH2-CD2 3.83Å; W91-F93 HydrophobicContact CH2-CG 4.45Å; W91-F93 HydrophobicContact CZ2-CB 3.62Å; W91-F93 AromaticContact CZ2-CD2 3.89Å; W91-F93 HydrophobicContact CZ2-CD2 3.89Å; W91-F93 HydrophobicContact CZ2-CG 4.19Å; W91-F93 AromaticContact CZ3-CD2 3.91Å; W91-F93 HydrophobicContact CZ3-CD2 3.91Å; W91-G94 PolarHBondContact NE1-O 3.39Å; W91-L97 HydrophobicContact CZ2-CB 3.94Å; W91-C98 HydrophobicContact CZ2-CB 4.07Å; W91-C98 VanDerWaalsContact CZ2-N 3.3Å; W91-T173 PolarHBondContact N-O 2.9Å; W91-T173 WeakPolarHBondContact O-CB 3.2Å; W91-T173 VanDerWaalsContact O-CG2 3.26Å; W91-T173 WeakPolarHBondContact O-CG2 3.09Å; W91-C175 HydrophobicContact CB-CB 4.12Å; W91-C175 HydrophobicContact CD2-CB 3.81Å; W91-C175 HydrophobicContact CE3-CB 4.16Å; W91-C175 HydrophobicContact CG-CB 3.78Å | ||
| 92 | V | 93.9 | Very high | 92.2 | Very high | 105 Ų | 105 | 50.3 Ų | 50.3 | 64% | 0.636 | 29% | 0.286 | S | S | * | . | trans | -103.6 | -5.6 | -174.8 | -60.7 | 0 | 0 | 0 | 0 | 114.7 | L88 G90 | L88-V92 HydrophobicContact CD1-CG2 3.93Å; G90-V92 PolarHBondContact O-N 2.93Å | ||
| 93 | F | 94.6 | Very high | 92.5 | Very high | 70 Ų | 70 | 51.4 Ų | 51.4 | 31% | 0.307 | 29% | 0.29 | S | S | . | . | S | Bend | trans | -91.1 | 2 | -169.8 | -56 | -75.5 | 0 | 0 | 0 | 114.7 | F81 T84 L88 W91 L97 | F81-F93 HydrophobicContact CD1-CD1 4.19Å; F81-F93 AromaticContact CD1-CD2 4Å; F81-F93 HydrophobicContact CD1-CD2 4Å; F81-F93 HydrophobicContact CD1-CE1 4.33Å; F81-F93 HydrophobicContact CD1-CE2 4.16Å; F81-F93 HydrophobicContact CD1-CG 4.03Å; F81-F93 HydrophobicContact CD1-CZ 4.33Å; F81-F93 AromaticContact CE1-CD1 3.84Å; F81-F93 HydrophobicContact CE1-CD1 3.84Å; F81-F93 HydrophobicContact CE1-CD2 4.45Å; F81-F93 HydrophobicContact CE1-CE1 4.12Å; F81-F93 HydrophobicContact CE1-CG 4.03Å; T84-F93 HydrophobicContact CG2-CE2 4.09Å; T84-F93 HydrophobicContact CG2-CZ 3.95Å; T84-F93 VanDerWaalsContact OG1-CE2 3.31Å; T84-F93 WeakPolarHBondContact OG1-CE2 3.45Å; L88-F93 HydrophobicContact CD1-CE2 4.45Å; W91-F93 HydrophobicContact CD2-CD2 4.14Å; W91-F93 HydrophobicContact CE3-CD2 4.05Å; W91-F93 HydrophobicContact CH2-CB 4.33Å; W91-F93 AromaticContact CH2-CD2 3.83Å; W91-F93 HydrophobicContact CH2-CD2 3.83Å; W91-F93 HydrophobicContact CH2-CG 4.45Å; W91-F93 HydrophobicContact CZ2-CB 3.62Å; W91-F93 AromaticContact CZ2-CD2 3.89Å; W91-F93 HydrophobicContact CZ2-CD2 3.89Å; W91-F93 HydrophobicContact CZ2-CG 4.19Å; W91-F93 AromaticContact CZ3-CD2 3.91Å; W91-F93 HydrophobicContact CZ3-CD2 3.91Å; F93-L97 HydrophobicContact CB-CB 3.85Å; F93-L97 HydrophobicContact CB-CD1 3.73Å; F93-L97 HydrophobicContact CB-CG 4.43Å; F93-L97 HydrophobicContact CD1-CD1 4.48Å; F93-L97 HydrophobicContact CG-CD1 4.47Å |
| 94 | G | 94.1 | Very high | 92.8 | Very high | 27 Ų | 27 | 52.5 Ų | 52.5 | 28% | 0.278 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | 79.2 | 171.7 | 179.4 | 0 | 0 | 0 | 0 | 0 | 114.9 | W91 L96 L97 C98 Q166 | W91-G94 PolarHBondContact NE1-O 3.39Å; G94-L96 PolarHBondContact O-N 3.28Å; G94-L97 PolarHBondContact O-N 3.21Å; G94-C98 PolarHBondContact O-N 2.94Å; G94-C98 VanDerWaalsContact O-N 3.14Å; G94-Q166 PolarHBondContact O-OE1 3.31Å |
| 95 | S | 94.6 | Very high | 93 | Very high | 54 Ų | 54 | 51.6 Ų | 51.6 | 38% | 0.378 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -67.5 | -34.9 | -170.5 | -176.1 | 0 | 0 | 0 | 0 | 112.9 | C98 K99 | S95-C98 PolarHBondContact O-N 2.86Å; S95-K99 PolarHBondContact O-N 2.87Å; S95-K99 VanDerWaalsContact O-N 3.13Å |
| 96 | L | 95.8 | Very high | 93.4 | Very high | 142 Ų | 142 | 49.7 Ų | 49.7 | 74% | 0.743 | 28% | 0.277 | S | S | * | . | H | α-helix | trans | -61.3 | -52.1 | 178.8 | 179.4 | 64.2 | 0 | 0 | 0 | 111.1 | G94 C98 K99 A100 | G94-L96 PolarHBondContact O-N 3.28Å; L96-C98 VanDerWaalsContact C-N 3.35Å; L96-C98 PolarHBondContact O-N 3.42Å; L96-K99 PolarHBondContact O-N 3.34Å; L96-A100 VanDerWaalsContact O-CB 3.29Å; L96-A100 WeakPolarHBondContact O-CB 3.48Å; L96-A100 PolarHBondContact O-N 3.31Å |
| 97 | L | 95.8 | Very high | 94 | Very high | 61 Ų | 61 | 48.6 Ų | 48.6 | 32% | 0.319 | 27% | 0.274 | S | S | . | . | H | α-helix | trans | -68.4 | -34.2 | 179.8 | -78.2 | 168.9 | 0 | 0 | 0 | 112 | F81 W91 F93 G94 K99 A100 V101 | F81-L97 HydrophobicContact CE1-CD1 4.03Å; F81-L97 HydrophobicContact CE1-CD2 4.32Å; F81-L97 HydrophobicContact CZ-CD1 4.38Å; F81-L97 HydrophobicContact CZ-CD2 4.12Å; W91-L97 HydrophobicContact CZ2-CB 3.94Å; F93-L97 HydrophobicContact CB-CB 3.85Å; F93-L97 HydrophobicContact CB-CD1 3.73Å; F93-L97 HydrophobicContact CB-CG 4.43Å; F93-L97 HydrophobicContact CD1-CD1 4.48Å; F93-L97 HydrophobicContact CG-CD1 4.47Å; G94-L97 PolarHBondContact O-N 3.21Å; L97-K99 VanDerWaalsContact C-N 3.29Å; L97-K99 PolarHBondContact O-N 2.91Å; L97-A100 PolarHBondContact O-N 3.07Å; L97-V101 HydrophobicContact CD2-CG2 4.4Å; L97-V101 VanDerWaalsContact O-CB 3.27Å; L97-V101 WeakPolarHBondContact O-CB 3.36Å; L97-V101 VanDerWaalsContact O-CG2 3.26Å; L97-V101 WeakPolarHBondContact O-CG2 3.36Å; L97-V101 PolarHBondContact O-N 2.93Å |
| 98 | C | 95.6 | Very high | 94.5 | Very high | 0 Ų | 0 | 45.7 Ų | 45.7 | 0% | 0 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -55.2 | -47.8 | 173.4 | 168.6 | 0 | 0 | 0 | 0 | 110.6 | W91 G94 S95 L96 H102 C175 | W91-C98 HydrophobicContact CZ2-CB 4.07Å; W91-C98 VanDerWaalsContact CZ2-N 3.3Å; G94-C98 PolarHBondContact O-N 2.94Å; G94-C98 VanDerWaalsContact O-N 3.14Å; S95-C98 PolarHBondContact O-N 2.86Å; L96-C98 VanDerWaalsContact C-N 3.35Å; L96-C98 PolarHBondContact O-N 3.42Å; C98-H102 PolarHBondContact O-CD2 2.91Å; C98-C175 VanDerWaalsContact CA-SG 3.54Å; C98-C175 HydrophobicContact CB-CB 3.85Å; C98-C175 WeakPolarHBondContact CB-SG 3.49Å; C98-C175 WeakPolarHBondContact SG-CB 3.36Å; C98-C175 CovalentContact SG-SG 2.03Å; C98-C175 PolarHBondContact SG-SG 3.3Å |
| 99 | K | 96.6 | Very high | 94.9 | Very high | 75 Ų | 75 | 42.5 Ų | 42.5 | 33% | 0.326 | 24% | 0.239 | S | C | . | . | H | α-helix | trans | -71.6 | -46.9 | 178 | -67.8 | 178.3 | 175.8 | -168.4 | 0 | 112.6 | S95 L96 L97 F103 L161 | S95-K99 PolarHBondContact O-N 2.87Å; S95-K99 VanDerWaalsContact O-N 3.13Å; L96-K99 PolarHBondContact O-N 3.34Å; L97-K99 VanDerWaalsContact C-N 3.29Å; L97-K99 PolarHBondContact O-N 2.91Å; K99-F103 WeakPolarHBondContact O-CB 3.31Å; K99-F103 PolarHBondContact O-N 2.83Å; K99-L161 HydrophobicContact CB-CD2 4.35Å; K99-L161 WeakPolarHBondContact CD-O 3.08Å; K99-L161 WeakPolarHBondContact CE-O 3.49Å |
| 100 | A | 96.2 | Very high | 95.4 | Very high | 31 Ų | 31 | 35.5 Ų | 35.5 | 26% | 0.256 | 20% | 0.202 | S | C | . | . | H | α-helix | trans | -65.5 | -45.4 | -173.9 | 0 | 0 | 0 | 0 | 0 | 112.4 | L96 L97 F103 L104 | L96-A100 VanDerWaalsContact O-CB 3.29Å; L96-A100 WeakPolarHBondContact O-CB 3.48Å; L96-A100 PolarHBondContact O-N 3.31Å; L97-A100 PolarHBondContact O-N 3.07Å; A100-F103 PolarHBondContact O-N 3.39Å; A100-L104 WeakPolarHBondContact O-CB 3.45Å; A100-L104 VanDerWaalsContact O-CG 3.26Å; A100-L104 WeakPolarHBondContact O-CG 3.31Å; A100-L104 PolarHBondContact O-N 2.6Å |
| 101 | V | 96.4 | Very high | 95.8 | Very high | 3 Ų | 3 | 34.4 Ų | 34.4 | 2% | 0.018 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -61.9 | -50.6 | 179.7 | 169.6 | 0 | 0 | 0 | 0 | 110.4 | F81 L97 F103 L104 I105 | F81-V101 HydrophobicContact CB-CB 4.5Å; F81-V101 HydrophobicContact CB-CG1 3.86Å; F81-V101 HydrophobicContact CB-CG2 3.89Å; F81-V101 HydrophobicContact CD1-CG2 4.21Å; F81-V101 HydrophobicContact CD2-CG2 3.72Å; F81-V101 HydrophobicContact CE2-CG2 4.27Å; F81-V101 HydrophobicContact CG-CG2 3.67Å; L97-V101 HydrophobicContact CD2-CG2 4.4Å; L97-V101 VanDerWaalsContact O-CB 3.27Å; L97-V101 WeakPolarHBondContact O-CB 3.36Å; L97-V101 VanDerWaalsContact O-CG2 3.26Å; L97-V101 WeakPolarHBondContact O-CG2 3.36Å; L97-V101 PolarHBondContact O-N 2.93Å; V101-F103 PolarHBondContact O-N 2.8Å; V101-L104 PolarHBondContact O-N 2.86Å; V101-I105 HydrophobicContact CG1-CD1 4.04Å; V101-I105 VanDerWaalsContact O-CG1 3.31Å; V101-I105 WeakPolarHBondContact O-CG1 3.36Å; V101-I105 PolarHBondContact O-N 2.97Å |
| 102 | H | 95.4 | Very high | 95.9 | Very high | 13 Ų | 13 | 34.1 Ų | 34.1 | 6% | 0.06 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -64.6 | -41.7 | 179.2 | -73.8 | -60.5 | 0 | 0 | 0 | 112.1 | C98 L104 I105 F106 Y164 C175 | C98-H102 PolarHBondContact O-CD2 2.91Å; H102-L104 VanDerWaalsContact C-N 3.35Å; H102-L104 PolarHBondContact O-N 3.17Å; H102-I105 WeakPolarHBondContact O-CB 3.37Å; H102-I105 PolarHBondContact O-N 2.75Å; H102-F106 WeakPolarHBondContact O-CD2 3.31Å; H102-F106 PolarHBondContact O-N 2.72Å; H102-Y164 HydrophobicContact CB-CD1 4.28Å; H102-Y164 HydrophobicContact CB-CD2 3.39Å; H102-Y164 HydrophobicContact CB-CE2 3.69Å; H102-Y164 HydrophobicContact CB-CG 3.74Å; H102-Y164 AromaticContact CD2-CD1 3.3Å; H102-Y164 WeakPolarHBondContact CD2-CD1 3.5Å; H102-Y164 AromaticContact CD2-CE1 3.67Å; H102-Y164 AromaticContact CD2-CG 3.52Å; H102-Y164 AromaticContact CE1-CE1 3.73Å; H102-Y164 AromaticContact CG-CD1 3.68Å; H102-Y164 AromaticContact CG-CD2 3.7Å; H102-Y164 AromaticContact CG-CE1 3.76Å; H102-Y164 AromaticContact CG-CE2 3.8Å; H102-Y164 AromaticContact CG-CG 3.66Å; H102-Y164 AromaticContact CG-CZ 3.82Å; H102-Y164 AromaticContact ND1-CE1 3.77Å; H102-Y164 AromaticContact ND1-CZ 3.72Å; H102-Y164 AromaticContact NE2-CD1 3.63Å; H102-Y164 AromaticContact NE2-CE1 3.67Å; H102-C175 PolarHBondContact CD2-SG 2.87Å |
| 103 | F | 97.1 | Very high | 95.9 | Very high | 33 Ų | 33 | 29.1 Ų | 29.1 | 15% | 0.145 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -56 | -47.7 | 172.4 | 168.3 | -101.3 | 0 | 0 | 0 | 112.1 | K99 A100 V101 I105 F106 L107 L154 S157 L161 | K99-F103 WeakPolarHBondContact O-CB 3.31Å; K99-F103 PolarHBondContact O-N 2.83Å; A100-F103 PolarHBondContact O-N 3.39Å; V101-F103 PolarHBondContact O-N 2.8Å; F103-I105 PolarHBondContact O-N 2.79Å; F103-F106 PolarHBondContact O-N 3.42Å; F103-L107 HydrophobicContact CE1-CD2 3.84Å; F103-L107 HydrophobicContact CZ-CD2 4.03Å; F103-L107 VanDerWaalsContact O-CB 3.3Å; F103-L107 WeakPolarHBondContact O-CB 3.5Å; F103-L107 PolarHBondContact O-N 3.17Å; F103-L154 HydrophobicContact CZ-CD2 3.84Å; F103-S157 VanDerWaalsContact CE2-OG 3.3Å; F103-S157 WeakPolarHBondContact CE2-OG 3.24Å; F103-L161 HydrophobicContact CB-CD2 3.67Å; F103-L161 HydrophobicContact CB-CG 4.18Å; F103-L161 HydrophobicContact CD1-CD2 4.42Å; F103-L161 HydrophobicContact CD2-CD1 4.22Å; F103-L161 HydrophobicContact CD2-CD2 4.08Å; F103-L161 HydrophobicContact CD2-CG 3.8Å; F103-L161 HydrophobicContact CE2-CD1 4.37Å; F103-L161 HydrophobicContact CE2-CG 4.43Å; F103-L161 HydrophobicContact CG-CD2 3.8Å; F103-L161 HydrophobicContact CG-CG 4.06Å |
| 104 | L | 97.3 | Very high | 96 | Very high | 40 Ų | 40 | 26.8 Ų | 26.8 | 21% | 0.209 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -64.7 | -36.6 | 179.2 | -73.4 | 174.3 | 0 | 0 | 0 | 112.6 | C77 A100 V101 H102 F106 L107 T108 | C77-L104 HydrophobicContact CB-CD1 3.86Å; A100-L104 WeakPolarHBondContact O-CB 3.45Å; A100-L104 VanDerWaalsContact O-CG 3.26Å; A100-L104 WeakPolarHBondContact O-CG 3.31Å; A100-L104 PolarHBondContact O-N 2.6Å; V101-L104 PolarHBondContact O-N 2.86Å; H102-L104 VanDerWaalsContact C-N 3.35Å; H102-L104 PolarHBondContact O-N 3.17Å; L104-F106 PolarHBondContact O-N 3.03Å; L104-L107 HydrophobicContact CD2-CD2 4.12Å; L104-L107 PolarHBondContact O-N 3.19Å; L104-T108 WeakPolarHBondContact O-CB 3.38Å; L104-T108 WeakPolarHBondContact O-CG2 3.3Å; L104-T108 PolarHBondContact O-N 2.95Å; L104-T108 PolarHBondContact O-OG1 3.15Å |
| 105 | I | 96 | Very high | 96 | Very high | 10 Ų | 10 | 25.5 Ų | 25.5 | 5% | 0.051 | 14% | 0.136 | C | C | . | . | H | α-helix | trans | -54.9 | -53.6 | 172.7 | -71.7 | 167.9 | 0 | 0 | 0 | 109.9 | F74 C78 V101 H102 F103 T108 M109 | F74-I105 HydrophobicContact CE2-CB 4.45Å; F74-I105 HydrophobicContact CE2-CG1 4.1Å; F74-I105 HydrophobicContact CE2-CG2 4.22Å; C78-I105 HydrophobicContact CB-CD1 4.24Å; C78-I105 HydrophobicContact CB-CG1 3.51Å; V101-I105 HydrophobicContact CG1-CD1 4.04Å; V101-I105 VanDerWaalsContact O-CG1 3.31Å; V101-I105 WeakPolarHBondContact O-CG1 3.36Å; V101-I105 PolarHBondContact O-N 2.97Å; H102-I105 WeakPolarHBondContact O-CB 3.37Å; H102-I105 PolarHBondContact O-N 2.75Å; F103-I105 PolarHBondContact O-N 2.79Å; I105-T108 PolarHBondContact O-OG1 3.4Å; I105-M109 VanDerWaalsContact O-CB 3.28Å; I105-M109 WeakPolarHBondContact O-CB 3.37Å; I105-M109 PolarHBondContact O-N 3.28Å |
| 106 | F | 96.1 | Very high | 95.9 | Very high | 22 Ų | 22 | 23.3 Ų | 23.3 | 10% | 0.096 | 12% | 0.12 | C | C | . | . | H | α-helix | trans | -71.5 | -38.5 | -178 | -66.6 | -74.4 | 0 | 0 | 0 | 111.9 | H102 F103 L104 M109 H110 Y160 Y164 T191 | H102-F106 WeakPolarHBondContact O-CD2 3.31Å; H102-F106 PolarHBondContact O-N 2.72Å; F103-F106 PolarHBondContact O-N 3.42Å; L104-F106 PolarHBondContact O-N 3.03Å; F106-M109 HydrophobicContact CB-CE 4.49Å; F106-M109 HydrophobicContact CD1-CE 3.62Å; F106-M109 HydrophobicContact CD1-SD 4.47Å; F106-M109 HydrophobicContact CE1-CE 4.4Å; F106-M109 PolarHBondContact O-N 3.33Å; F106-H110 PolarHBondContact O-N 2.88Å; F106-H110 PolarHBondContact O-ND1 3.31Å; F106-Y160 HydrophobicContact CB-CD2 3.51Å; F106-Y160 HydrophobicContact CB-CE2 3.56Å; F106-Y160 HydrophobicContact CB-CG 4.28Å; F106-Y160 HydrophobicContact CD1-CD2 4.16Å; F106-Y160 HydrophobicContact CD1-CE1 4.15Å; F106-Y160 AromaticContact CD1-CE2 3.45Å; F106-Y160 HydrophobicContact CD1-CE2 3.45Å; F106-Y160 VanDerWaalsContact CD1-CE2 3.45Å; F106-Y160 AromaticContact CD1-CZ 3.42Å; F106-Y160 VanDerWaalsContact CD1-CZ 3.42Å; F106-Y160 WeakPolarHBondContact CD1-OH 3.33Å; F106-Y160 AromaticContact CD2-CD1 3.51Å; F106-Y160 HydrophobicContact CD2-CD1 3.51Å; F106-Y160 AromaticContact CD2-CD2 3.47Å; F106-Y160 HydrophobicContact CD2-CD2 3.47Å; F106-Y160 VanDerWaalsContact CD2-CD2 3.47Å; F106-Y160 AromaticContact CD2-CE1 3.61Å; F106-Y160 HydrophobicContact CD2-CE1 3.61Å; F106-Y160 AromaticContact CD2-CE2 3.58Å; F106-Y160 HydrophobicContact CD2-CE2 3.58Å; F106-Y160 AromaticContact CD2-CG 3.41Å; F106-Y160 HydrophobicContact CD2-CG 3.41Å; F106-Y160 VanDerWaalsContact CD2-CG 3.41Å; F106-Y160 AromaticContact CD2-CZ 3.62Å; F106-Y160 AromaticContact CE1-CE1 3.93Å; F106-Y160 HydrophobicContact CE1-CE1 3.93Å; F106-Y160 HydrophobicContact CE1-CE2 4.04Å; F106-Y160 AromaticContact CE1-CZ 3.49Å; F106-Y160 VanDerWaalsContact CE1-CZ 3.49Å; F106-Y160 VanDerWaalsContact CE1-OH 3.26Å; F106-Y160 WeakPolarHBondContact CE1-OH 3.31Å; F106-Y160 AromaticContact CE2-CD1 3.56Å; F106-Y160 HydrophobicContact CE2-CD1 3.56Å; F106-Y160 HydrophobicContact CE2-CD2 4.31Å; F106-Y160 AromaticContact CE2-CE1 3.42Å; F106-Y160 HydrophobicContact CE2-CE1 3.42Å; F106-Y160 VanDerWaalsContact CE2-CE1 3.42Å; F106-Y160 HydrophobicContact CE2-CE2 4.2Å; F106-Y160 AromaticContact CE2-CG 3.99Å; F106-Y160 HydrophobicContact CE2-CG 3.99Å; F106-Y160 AromaticContact CE2-CZ 3.74Å; F106-Y160 HydrophobicContact CG-CD1 4.21Å; F106-Y160 AromaticContact CG-CD2 3.43Å; F106-Y160 HydrophobicContact CG-CD2 3.43Å; F106-Y160 VanDerWaalsContact CG-CD2 3.43Å; F106-Y160 HydrophobicContact CG-CE1 4.03Å; F106-Y160 AromaticContact CG-CE2 3.21Å; F106-Y160 HydrophobicContact CG-CE2 3.21Å; F106-Y160 AromaticContact CG-CG 3.91Å; F106-Y160 HydrophobicContact CG-CG 3.91Å; F106-Y160 AromaticContact CG-CZ 3.52Å; F106-Y160 HydrophobicContact CZ-CD1 4.21Å; F106-Y160 AromaticContact CZ-CE1 3.58Å; F106-Y160 HydrophobicContact CZ-CE1 3.58Å; F106-Y160 HydrophobicContact CZ-CE2 4.39Å; F106-Y160 AromaticContact CZ-CZ 3.67Å; F106-Y164 AromaticContact CE2-CE2 3.72Å; F106-Y164 HydrophobicContact CE2-CE2 3.72Å; F106-Y164 HydrophobicContact CZ-CE2 4.48Å; F106-T191 HydrophobicContact CD1-CG2 4.31Å; F106-T191 HydrophobicContact CE1-CG2 4.39Å |
| 107 | L | 97.7 | Very high | 95.8 | Very high | 12 Ų | 12 | 17.2 Ų | 17.2 | 6% | 0.063 | 9% | 0.091 | C | C | . | . | H | α-helix | trans | -57.9 | -51.1 | 176.9 | 177.4 | 64.3 | 0 | 0 | 0 | 111.7 | F103 L104 H110 A111 W150 L154 | F103-L107 HydrophobicContact CE1-CD2 3.84Å; F103-L107 HydrophobicContact CZ-CD2 4.03Å; F103-L107 VanDerWaalsContact O-CB 3.3Å; F103-L107 WeakPolarHBondContact O-CB 3.5Å; F103-L107 PolarHBondContact O-N 3.17Å; L104-L107 HydrophobicContact CD2-CD2 4.12Å; L104-L107 PolarHBondContact O-N 3.19Å; L107-H110 PolarHBondContact O-N 3.49Å; L107-A111 WeakPolarHBondContact O-CB 3.47Å; L107-A111 PolarHBondContact O-N 2.88Å; L107-W150 HydrophobicContact CD1-CE3 4.28Å; L107-W150 HydrophobicContact CD1-CZ3 4.35Å; L107-W150 HydrophobicContact CD2-CZ3 4.08Å; L107-W150 HydrophobicContact CG-CE3 4.44Å; L107-W150 HydrophobicContact CG-CZ3 4.02Å; L107-L154 HydrophobicContact CD1-CD2 3.75Å; L107-L154 HydrophobicContact CD1-CG 3.92Å; L107-L154 HydrophobicContact CD2-CD2 4.17Å |
| 108 | T | 96.6 | Very high | 95.6 | Very high | 2 Ų | 2 | 15.3 Ų | 15.3 | 1% | 0.012 | 8% | 0.084 | C | C | . | . | H | α-helix | trans | -70.3 | -33 | -178.3 | 54.1 | 0 | 0 | 0 | 0 | 112.4 | C73 F74 L104 I105 S112 | C73-T108 HydrophobicContact CB-CG2 3.87Å; F74-T108 HydrophobicContact CB-CG2 4.22Å; F74-T108 WeakPolarHBondContact CB-OG1 3.43Å; F74-T108 WeakPolarHBondContact CD2-OG1 3.33Å; L104-T108 WeakPolarHBondContact O-CB 3.38Å; L104-T108 WeakPolarHBondContact O-CG2 3.3Å; L104-T108 PolarHBondContact O-N 2.95Å; L104-T108 PolarHBondContact O-OG1 3.15Å; I105-T108 PolarHBondContact O-OG1 3.4Å; T108-S112 VanDerWaalsContact O-CB 3.31Å; T108-S112 WeakPolarHBondContact O-CB 3.37Å; T108-S112 PolarHBondContact O-N 2.98Å; T108-S112 PolarHBondContact O-OG 3.31Å |
| 109 | M | 95.1 | Very high | 95.4 | Very high | 8 Ų | 8 | 15.8 Ų | 15.8 | 4% | 0.039 | 9% | 0.087 | C | C | . | . | H | α-helix | trans | -60.5 | -52 | 170 | 173.6 | -170.6 | 73 | 0 | 0 | 111.7 | I105 F106 A111 S112 S113 T191 S195 W249 | I105-M109 VanDerWaalsContact O-CB 3.28Å; I105-M109 WeakPolarHBondContact O-CB 3.37Å; I105-M109 PolarHBondContact O-N 3.28Å; F106-M109 HydrophobicContact CB-CE 4.49Å; F106-M109 HydrophobicContact CD1-CE 3.62Å; F106-M109 HydrophobicContact CD1-SD 4.47Å; F106-M109 HydrophobicContact CE1-CE 4.4Å; F106-M109 PolarHBondContact O-N 3.33Å; M109-A111 VanDerWaalsContact C-N 3.34Å; M109-A111 PolarHBondContact O-N 2.87Å; M109-S112 PolarHBondContact O-N 2.93Å; M109-S113 WeakPolarHBondContact O-CB 3.3Å; M109-S113 PolarHBondContact O-N 3.23Å; M109-T191 HydrophobicContact CE-CG2 3.58Å; M109-S195 VanDerWaalsContact CE-CB 3.49Å; M109-W249 HydrophobicContact CB-CH2 3.89Å; M109-W249 HydrophobicContact CB-CZ2 4.3Å; M109-W249 HydrophobicContact CG-CE3 4.49Å; M109-W249 HydrophobicContact CG-CH2 3.31Å; M109-W249 HydrophobicContact CG-CZ2 3.75Å; M109-W249 HydrophobicContact CG-CZ3 3.74Å; M109-W249 HydrophobicContact SD-CE3 4.1Å; M109-W249 HydrophobicContact SD-CH2 3.42Å; M109-W249 WeakPolarHBondContact SD-CH2 3.42Å; M109-W249 HydrophobicContact SD-CZ2 4.38Å; M109-W249 HydrophobicContact SD-CZ3 3.25Å; M109-W249 WeakPolarHBondContact SD-CZ3 3.22Å |
| 110 | H | 96.3 | Very high | 95 | Very high | 2 Ų | 2 | 12.2 Ų | 12.2 | 1% | 0.009 | 7% | 0.071 | C | C | . | . | H | α-helix | trans | -61.3 | -44.6 | 178.4 | -72.1 | 97.7 | 0 | 0 | 0 | 110.9 | F106 L107 S112 S113 F114 | F106-H110 PolarHBondContact O-N 2.88Å; F106-H110 PolarHBondContact O-ND1 3.31Å; L107-H110 PolarHBondContact O-N 3.49Å; H110-S112 VanDerWaalsContact C-N 3.34Å; H110-S112 PolarHBondContact O-N 3.17Å; H110-S113 PolarHBondContact O-N 2.92Å; H110-F114 HydrophobicContact CB-CD2 4.32Å; H110-F114 HydrophobicContact CB-CE2 3.98Å; H110-F114 WeakPolarHBondContact O-CB 3.29Å; H110-F114 VanDerWaalsContact O-CD2 3.27Å; H110-F114 WeakPolarHBondContact O-CD2 3.43Å; H110-F114 VanDerWaalsContact O-CG 3.3Å; H110-F114 WeakPolarHBondContact O-CG 3.2Å; H110-F114 PolarHBondContact O-N 2.9Å |
| 111 | A | 97.1 | Very high | 94.7 | Very high | 0 Ų | 0 | 14.5 Ų | 14.5 | 0% | 0 | 8% | 0.078 | C | C | . | . | H | α-helix | trans | -59.6 | -45.2 | 179.1 | 0 | 0 | 0 | 0 | 0 | 111.6 | A70 L107 M109 T115 I149 W150 S153 | A70-A111 HydrophobicContact CB-CB 4.2Å; L107-A111 WeakPolarHBondContact O-CB 3.47Å; L107-A111 PolarHBondContact O-N 2.88Å; M109-A111 VanDerWaalsContact C-N 3.34Å; M109-A111 PolarHBondContact O-N 2.87Å; A111-T115 VanDerWaalsContact O-CB 3.23Å; A111-T115 WeakPolarHBondContact O-CB 3.5Å; A111-T115 PolarHBondContact O-N 3.45Å; A111-T115 PolarHBondContact O-OG1 3.33Å; A111-I149 HydrophobicContact CB-CG2 4.4Å; A111-W150 HydrophobicContact CB-CE3 4.42Å; A111-W150 HydrophobicContact CB-CH2 4.26Å; A111-W150 HydrophobicContact CB-CZ2 4.37Å; A111-W150 HydrophobicContact CB-CZ3 4.28Å; A111-S153 VanDerWaalsContact CA-OG 3.23Å; A111-S153 WeakPolarHBondContact CA-OG 3.45Å; A111-S153 PolarHBondContact N-OG 2.92Å |
| 112 | S | 95 | Very high | 94.4 | Very high | 6 Ų | 6 | 14.9 Ų | 14.9 | 4% | 0.042 | 8% | 0.08 | C | C | . | . | H | α-helix | trans | -65.7 | -44.8 | 178.7 | -59.5 | 0 | 0 | 0 | 0 | 111.9 | T108 M109 H110 T115 L116 | T108-S112 VanDerWaalsContact O-CB 3.31Å; T108-S112 WeakPolarHBondContact O-CB 3.37Å; T108-S112 PolarHBondContact O-N 2.98Å; T108-S112 PolarHBondContact O-OG 3.31Å; M109-S112 PolarHBondContact O-N 2.93Å; H110-S112 VanDerWaalsContact C-N 3.34Å; H110-S112 PolarHBondContact O-N 3.17Å; S112-T115 WeakPolarHBondContact O-CB 3.11Å; S112-T115 PolarHBondContact O-N 3.14Å; S112-L116 WeakPolarHBondContact O-CG 3.39Å; S112-L116 PolarHBondContact O-N 3.01Å |
| 113 | S | 94.8 | Very high | 93.9 | Very high | 0 Ų | 0 | 15.8 Ų | 15.8 | 0% | 0 | 8% | 0.083 | C | C | . | . | H | α-helix | trans | -64.7 | -48.2 | -179.3 | -170.5 | 0 | 0 | 0 | 0 | 112.5 | M109 H110 T115 L116 A117 S195 P199 F245 | M109-S113 WeakPolarHBondContact O-CB 3.3Å; M109-S113 PolarHBondContact O-N 3.23Å; H110-S113 PolarHBondContact O-N 2.92Å; S113-T115 VanDerWaalsContact C-N 3.3Å; S113-T115 PolarHBondContact O-N 3.35Å; S113-L116 PolarHBondContact O-N 3.43Å; S113-A117 PolarHBondContact O-N 3.31Å; S113-A117 VanDerWaalsContact O-N 3.09Å; S113-S195 WeakPolarHBondContact CB-O 3.48Å; S113-S195 PolarHBondContact OG-O 3.43Å; S113-P199 VanDerWaalsContact OG-CB 3.22Å; S113-P199 WeakPolarHBondContact OG-CB 3.32Å; S113-P199 WeakPolarHBondContact OG-CG 3.43Å; S113-F245 WeakPolarHBondContact OG-CZ 3.38Å |
| 114 | F | 95.9 | Very high | 93.4 | Very high | 22 Ų | 22 | 15.8 Ų | 15.8 | 10% | 0.096 | 8% | 0.083 | C | C | . | . | H | α-helix | trans | -65.5 | -33.4 | 175 | -62.2 | -32.4 | 0 | 0 | 0 | 112.3 | H110 A117 A118 I149 L152 F156 F194 P199 | H110-F114 HydrophobicContact CB-CD2 4.32Å; H110-F114 HydrophobicContact CB-CE2 3.98Å; H110-F114 WeakPolarHBondContact O-CB 3.29Å; H110-F114 VanDerWaalsContact O-CD2 3.27Å; H110-F114 WeakPolarHBondContact O-CD2 3.43Å; H110-F114 VanDerWaalsContact O-CG 3.3Å; H110-F114 WeakPolarHBondContact O-CG 3.2Å; H110-F114 PolarHBondContact O-N 2.9Å; F114-A117 PolarHBondContact O-N 2.96Å; F114-A118 WeakPolarHBondContact O-CB 3.39Å; F114-A118 PolarHBondContact O-N 3.35Å; F114-I149 HydrophobicContact CB-CB 4.48Å; F114-I149 HydrophobicContact CB-CG1 4.02Å; F114-I149 HydrophobicContact CB-CG2 3.99Å; F114-L152 HydrophobicContact CD2-CB 4.2Å; F114-L152 HydrophobicContact CE2-CB 3.85Å; F114-F156 AromaticContact CE2-CD2 3.97Å; F114-F156 HydrophobicContact CE2-CD2 3.97Å; F114-F156 HydrophobicContact CE2-CE2 4.35Å; F114-F156 AromaticContact CZ-CD2 3.79Å; F114-F156 HydrophobicContact CZ-CD2 3.79Å; F114-F156 AromaticContact CZ-CE2 3.94Å; F114-F156 HydrophobicContact CZ-CE2 3.94Å; F114-F194 VanDerWaalsContact CE1-O 3.29Å; F114-F194 WeakPolarHBondContact CE1-O 3.32Å; F114-P199 HydrophobicContact CD1-CG 4.4Å |
| 115 | T | 95.1 | Very high | 92.9 | Very high | 0 Ų | 0 | 15.7 Ų | 15.7 | 0% | 0 | 8% | 0.082 | C | C | . | . | H | α-helix | trans | -63.5 | -43.6 | 173.1 | -60.4 | 0 | 0 | 0 | 0 | 111.6 | F63 N66 L67 A111 S112 S113 A117 A118 V119 | F63-T115 HydrophobicContact CB-CG2 4.16Å; F63-T115 VanDerWaalsContact O-CG2 3.28Å; F63-T115 WeakPolarHBondContact O-CG2 3.49Å; N66-T115 HydrophobicContact CB-CG2 4.47Å; N66-T115 PolarHBondContact ND2-OG1 3.01Å; L67-T115 HydrophobicContact CB-CG2 4.01Å; L67-T115 HydrophobicContact CD1-CG2 4.5Å; A111-T115 VanDerWaalsContact O-CB 3.23Å; A111-T115 WeakPolarHBondContact O-CB 3.5Å; A111-T115 PolarHBondContact O-N 3.45Å; A111-T115 PolarHBondContact O-OG1 3.33Å; S112-T115 WeakPolarHBondContact O-CB 3.11Å; S112-T115 PolarHBondContact O-N 3.14Å; S113-T115 VanDerWaalsContact C-N 3.3Å; S113-T115 PolarHBondContact O-N 3.35Å; T115-A117 VanDerWaalsContact C-N 3.32Å; T115-A117 PolarHBondContact O-N 3.4Å; T115-A118 PolarHBondContact O-N 2.8Å; T115-V119 HydrophobicContact CG2-CG2 4.35Å; T115-V119 VanDerWaalsContact O-CG2 3.26Å; T115-V119 WeakPolarHBondContact O-CG2 3.47Å; T115-V119 PolarHBondContact O-N 2.92Å |
| 116 | L | 91.4 | Very high | 92.3 | Very high | 8 Ų | 8 | 15.8 Ų | 15.8 | 4% | 0.042 | 8% | 0.084 | C | C | . | . | H | α-helix | trans | -62.1 | -39.8 | 176.4 | -73.8 | 172 | 0 | 0 | 0 | 112.1 | L67 S112 S113 V119 S120 V241 F245 | L67-L116 HydrophobicContact CD2-CD2 4.04Å; S112-L116 WeakPolarHBondContact O-CG 3.39Å; S112-L116 PolarHBondContact O-N 3.01Å; S113-L116 PolarHBondContact O-N 3.43Å; L116-V119 PolarHBondContact O-N 3.17Å; L116-S120 PolarHBondContact O-N 3.34Å; L116-V241 HydrophobicContact CD2-CG1 3.63Å; L116-F245 HydrophobicContact CD1-CB 3.67Å; L116-F245 HydrophobicContact CD1-CD1 4.3Å; L116-F245 HydrophobicContact CD1-CD2 3.39Å; L116-F245 HydrophobicContact CD1-CE2 4.11Å; L116-F245 HydrophobicContact CD1-CG 3.51Å |
| 117 | A | 93.7 | Very high | 91.6 | Very high | 14 Ų | 14 | 15.9 Ų | 15.9 | 12% | 0.116 | 9% | 0.085 | C | C | . | . | H | α-helix | trans | -63.8 | -42.8 | 173.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | S113 F114 T115 V119 S120 L121 V202 L203 | S113-A117 PolarHBondContact O-N 3.31Å; S113-A117 VanDerWaalsContact O-N 3.09Å; F114-A117 PolarHBondContact O-N 2.96Å; T115-A117 VanDerWaalsContact C-N 3.32Å; T115-A117 PolarHBondContact O-N 3.4Å; A117-V119 PolarHBondContact O-N 3.32Å; A117-S120 PolarHBondContact O-N 3.21Å; A117-S120 PolarHBondContact O-OG 3.24Å; A117-L121 PolarHBondContact O-N 3.09Å; A117-V202 HydrophobicContact CB-CB 4.34Å; A117-V202 HydrophobicContact CB-CG1 4.07Å; A117-L203 VanDerWaalsContact CA-CD1 3.5Å; A117-L203 HydrophobicContact CB-CD1 4.03Å |
| 118 | A | 93.2 | Very high | 90.8 | Very high | 21 Ų | 21 | 20.3 Ų | 20.3 | 17% | 0.174 | 10% | 0.101 | C | C | . | . | H | α-helix | trans | -64.5 | -39.9 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | F63 F114 T115 L121 D122 I149 | F63-A118 HydrophobicContact CD1-CB 4.28Å; F63-A118 HydrophobicContact CE1-CB 3.9Å; F63-A118 HydrophobicContact CZ-CB 4.1Å; F114-A118 WeakPolarHBondContact O-CB 3.39Å; F114-A118 PolarHBondContact O-N 3.35Å; T115-A118 PolarHBondContact O-N 2.8Å; A118-L121 PolarHBondContact O-N 3.22Å; A118-D122 WeakPolarHBondContact O-CB 3.31Å; A118-D122 PolarHBondContact O-N 3.48Å; A118-I149 HydrophobicContact CB-CD1 3.93Å |
| 119 | V | 90.5 | Very high | 90.1 | Very high | 10 Ų | 10 | 25.2 Ų | 25.2 | 6% | 0.061 | 12% | 0.12 | C | C | . | . | H | α-helix | trans | -62.1 | -44.2 | 174.5 | 171 | 0 | 0 | 0 | 0 | 110.8 | F63 T115 L116 A117 L121 D122 R123 I238 | F63-V119 HydrophobicContact CB-CG2 3.41Å; F63-V119 VanDerWaalsContact CB-CG2 3.41Å; F63-V119 HydrophobicContact CD2-CG2 4.36Å; F63-V119 HydrophobicContact CG-CG2 4.06Å; T115-V119 HydrophobicContact CG2-CG2 4.35Å; T115-V119 VanDerWaalsContact O-CG2 3.26Å; T115-V119 WeakPolarHBondContact O-CG2 3.47Å; T115-V119 PolarHBondContact O-N 2.92Å; L116-V119 PolarHBondContact O-N 3.17Å; A117-V119 PolarHBondContact O-N 3.32Å; V119-L121 VanDerWaalsContact C-N 3.32Å; V119-L121 PolarHBondContact O-N 2.82Å; V119-D122 PolarHBondContact O-N 3.18Å; V119-R123 VanDerWaalsContact O-CG 3.32Å; V119-R123 WeakPolarHBondContact O-CG 3.05Å; V119-R123 PolarHBondContact O-N 3.15Å; V119-I238 HydrophobicContact CG1-CD1 3.98Å; V119-I238 HydrophobicContact CG1-CG1 4.2Å; V119-I238 HydrophobicContact CG1-CG2 3.86Å |
| 120 | S | 88.9 | Confident | 89.3 | Confident | 0 Ų | 0 | 28.3 Ų | 28.3 | 0% | 0 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -64.4 | -39 | 179.5 | 83.3 | 0 | 0 | 0 | 0 | 111.5 | L116 A117 R123 Y124 T206 Y207 | L116-S120 PolarHBondContact O-N 3.34Å; A117-S120 PolarHBondContact O-N 3.21Å; A117-S120 PolarHBondContact O-OG 3.24Å; S120-R123 PolarHBondContact O-N 3.4Å; S120-Y124 WeakPolarHBondContact O-CB 3.27Å; S120-Y124 PolarHBondContact O-N 3.01Å; S120-T206 WeakPolarHBondContact CB-OG1 3.23Å; S120-T206 PolarHBondContact OG-OG1 2.87Å; S120-Y207 VanDerWaalsContact CB-OH 3.32Å; S120-Y207 WeakPolarHBondContact CB-OH 3.3Å |
| 121 | L | 90.2 | Very high | 88.6 | Confident | 79 Ų | 79 | 35.4 Ų | 35.4 | 41% | 0.414 | 18% | 0.178 | S | C | . | . | H | α-helix | trans | -67.1 | -47 | 174.8 | -175.4 | 60.5 | 0 | 0 | 0 | 112.2 | A117 A118 V119 R123 Y124 L125 T206 | A117-L121 PolarHBondContact O-N 3.09Å; A118-L121 PolarHBondContact O-N 3.22Å; V119-L121 VanDerWaalsContact C-N 3.32Å; V119-L121 PolarHBondContact O-N 2.82Å; L121-R123 PolarHBondContact O-N 3.02Å; L121-Y124 HydrophobicContact CD1-CD1 4.28Å; L121-Y124 WeakPolarHBondContact O-CB 3.44Å; L121-Y124 PolarHBondContact O-N 3.21Å; L121-Y124 VanDerWaalsContact O-N 3.09Å; L121-L125 HydrophobicContact CD1-CG 4.38Å; L121-L125 HydrophobicContact CG-CD1 4.29Å; L121-L125 WeakPolarHBondContact O-CG 3.38Å; L121-L125 PolarHBondContact O-N 3.17Å; L121-T206 HydrophobicContact CD1-CG2 4.3Å |
| 122 | D | 88.8 | Confident | 87.9 | Confident | 11 Ų | 11 | 40.3 Ų | 40.3 | 6% | 0.059 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -55.8 | -40.8 | 175.5 | 170.8 | 86.7 | 0 | 0 | 0 | 111.3 | T59 T60 F63 A118 V119 A126 R137 | T59-D122 PolarHBondContact OG1-OD1 3.27Å; T60-D122 PolarHBondContact OG1-OD2 2.85Å; F63-D122 HydrophobicContact CD2-CB 4.4Å; F63-D122 HydrophobicContact CE2-CB 4.07Å; A118-D122 WeakPolarHBondContact O-CB 3.31Å; A118-D122 PolarHBondContact O-N 3.48Å; V119-D122 PolarHBondContact O-N 3.18Å; D122-A126 WeakPolarHBondContact O-CB 3.33Å; D122-A126 PolarHBondContact O-N 3.02Å; D122-A126 VanDerWaalsContact O-N 3.12Å; D122-R137 IonicContact OD1-CZ 3.62Å; D122-R137 IonicContact OD1-NE 2.75Å; D122-R137 PolarHBondContact OD1-NE 2.68Å; D122-R137 IonicContact OD1-NH2 3.64Å; D122-R137 IonicContact OD2-CZ 3.85Å; D122-R137 IonicContact OD2-NE 3.51Å; D122-R137 IonicContact OD2-NH2 3.65Å |
| 123 | R | 85.7 | Confident | 87.3 | Confident | 32 Ų | 32 | 40.5 Ų | 40.5 | 12% | 0.121 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -66.8 | -45.1 | 173.9 | -70.9 | -53.6 | 87.2 | 178.7 | -17.7 | 112.8 | T60 V119 S120 L121 L125 A126 I127 I238 | T60-R123 PolarHBondContact OG1-NH2 3.44Å; V119-R123 VanDerWaalsContact O-CG 3.32Å; V119-R123 WeakPolarHBondContact O-CG 3.05Å; V119-R123 PolarHBondContact O-N 3.15Å; S120-R123 PolarHBondContact O-N 3.4Å; L121-R123 PolarHBondContact O-N 3.02Å; R123-L125 VanDerWaalsContact C-N 3.34Å; R123-L125 PolarHBondContact O-N 3.4Å; R123-A126 PolarHBondContact O-N 2.84Å; R123-I127 WeakPolarHBondContact O-CD1 3.18Å; R123-I127 WeakPolarHBondContact O-CG1 3.26Å; R123-I127 PolarHBondContact O-N 3.37Å; R123-I238 VanDerWaalsContact CD-CD1 3.41Å; R123-I238 HydrophobicContact CG-CD1 3.43Å; R123-I238 VanDerWaalsContact CG-CD1 3.43Å; R123-I238 HydrophobicContact CG-CG2 4.13Å |
| 124 | Y | 85.7 | Confident | 86.7 | Confident | 33 Ų | 33 | 51 Ų | 51 | 13% | 0.129 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -59 | -47.6 | 178.9 | 172.4 | -114.2 | 0 | 0 | 0 | 111.1 | S120 L121 A126 I127 R128 Y129 T206 R209 | S120-Y124 WeakPolarHBondContact O-CB 3.27Å; S120-Y124 PolarHBondContact O-N 3.01Å; L121-Y124 HydrophobicContact CD1-CD1 4.28Å; L121-Y124 WeakPolarHBondContact O-CB 3.44Å; L121-Y124 PolarHBondContact O-N 3.21Å; L121-Y124 VanDerWaalsContact O-N 3.09Å; Y124-A126 PolarHBondContact O-N 3.04Å; Y124-I127 PolarHBondContact O-N 3.07Å; Y124-R128 HydrophobicContact CD2-CB 4.27Å; Y124-R128 HydrophobicContact CE2-CB 3.83Å; Y124-R128 HydrophobicContact CE2-CG 4.1Å; Y124-R128 WeakPolarHBondContact O-CB 3.32Å; Y124-R128 PolarHBondContact O-N 3.3Å; Y124-Y129 HydrophobicContact CE1-CE2 4.22Å; Y124-T206 HydrophobicContact CG-CG2 4.45Å; Y124-R209 HydrophobicContact CD2-CB 4.19Å; Y124-R209 HydrophobicContact CE2-CB 3.53Å |
| 125 | L | 86.7 | Confident | 86.2 | Confident | 38 Ų | 38 | 56.2 Ų | 56.2 | 20% | 0.199 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -59.3 | -46.1 | 177.1 | -67.4 | 175 | 0 | 0 | 0 | 111.7 | L121 R123 I127 Y129 S133 | L121-L125 HydrophobicContact CD1-CG 4.38Å; L121-L125 HydrophobicContact CG-CD1 4.29Å; L121-L125 WeakPolarHBondContact O-CG 3.38Å; L121-L125 PolarHBondContact O-N 3.17Å; R123-L125 VanDerWaalsContact C-N 3.34Å; R123-L125 PolarHBondContact O-N 3.4Å; L125-I127 PolarHBondContact O-N 3.43Å; L125-Y129 HydrophobicContact CD2-CD2 4.19Å; L125-Y129 CarbonylContact O-C 3.54Å; L125-Y129 PolarHBondContact O-N 3.28Å; L125-S133 WeakPolarHBondContact O-CB 3.47Å |
| 126 | A | 84.3 | Confident | 85.7 | Confident | 12 Ų | 12 | 59.4 Ų | 59.4 | 10% | 0.099 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -62.2 | -24.2 | 179.9 | 0 | 0 | 0 | 0 | 0 | 114.7 | D122 R123 Y124 R137 | D122-A126 WeakPolarHBondContact O-CB 3.33Å; D122-A126 PolarHBondContact O-N 3.02Å; D122-A126 VanDerWaalsContact O-N 3.12Å; R123-A126 PolarHBondContact O-N 2.84Å; Y124-A126 PolarHBondContact O-N 3.04Å; A126-R137 VanDerWaalsContact CB-NH1 3.28Å |
| 127 | I | 80.4 | Confident | 85.6 | Confident | 23 Ų | 23 | 62.5 Ų | 62.5 | 12% | 0.118 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -96.9 | -45.5 | -177.8 | -65.4 | 165.7 | 0 | 0 | 0 | 110.7 | R123 Y124 L125 T210 Y213 L214 T235 | R123-I127 WeakPolarHBondContact O-CD1 3.18Å; R123-I127 WeakPolarHBondContact O-CG1 3.26Å; R123-I127 PolarHBondContact O-N 3.37Å; Y124-I127 PolarHBondContact O-N 3.07Å; L125-I127 PolarHBondContact O-N 3.43Å; I127-T210 HydrophobicContact CD1-CG2 3.55Å; I127-T210 HydrophobicContact CG2-CG2 4.34Å; I127-Y213 HydrophobicContact CG2-CD1 3.72Å; I127-Y213 HydrophobicContact CG2-CE1 3.95Å; I127-L214 HydrophobicContact CG2-CD2 4.42Å; I127-T235 HydrophobicContact CD1-CG2 4.08Å; I127-T235 VanDerWaalsContact CD1-OG1 3.27Å; I127-T235 WeakPolarHBondContact CD1-OG1 3.24Å |
| 128 | R | 81.3 | Confident | 85.4 | Confident | 105 Ų | 105 | 63.8 Ų | 63.8 | 40% | 0.396 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -81.6 | -36.4 | -173.2 | -178.5 | 63 | -176.2 | 115.2 | -4.6 | 113.1 | Y124 P130 | Y124-R128 HydrophobicContact CD2-CB 4.27Å; Y124-R128 HydrophobicContact CE2-CB 3.83Å; Y124-R128 HydrophobicContact CE2-CG 4.1Å; Y124-R128 WeakPolarHBondContact O-CB 3.32Å; Y124-R128 PolarHBondContact O-N 3.3Å; R128-P130 WeakPolarHBondContact O-CD 3.48Å |
| 129 | Y | 82.3 | Confident | 85.3 | Confident | 106 Ų | 106 | 65.5 Ų | 65.5 | 42% | 0.416 | 31% | 0.31 | S | S | . | . | trans | -127.9 | 63.9 | -172.1 | -57.7 | -75 | 0 | 0 | 0 | 111 | Y124 L125 L131 H132 S133 | Y124-Y129 HydrophobicContact CE1-CE2 4.22Å; L125-Y129 HydrophobicContact CD2-CD2 4.19Å; L125-Y129 CarbonylContact O-C 3.54Å; L125-Y129 PolarHBondContact O-N 3.28Å; Y129-L131 VanDerWaalsContact C-N 3.29Å; Y129-L131 PolarHBondContact O-N 3.29Å; Y129-L131 VanDerWaalsContact O-N 3.17Å; Y129-H132 PolarHBondContact O-N 3.29Å; Y129-S133 WeakPolarHBondContact O-CA 3.45Å; Y129-S133 WeakPolarHBondContact O-CB 3.33Å; Y129-S133 PolarHBondContact O-N 2.93Å; Y129-S133 PolarHBondContact O-OG 3.32Å | ||
| 130 | P | 79.1 | Confident | 85.3 | Confident | 73 Ų | 73 | 75 Ų | 75 | 47% | 0.474 | 35% | 0.345 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -57.1 | -36.4 | -170.1 | 21.7 | -33.3 | 0 | 0 | 0 | 114.2 | R128 S133 | R128-P130 WeakPolarHBondContact O-CD 3.48Å; P130-S133 PolarHBondContact O-OG 2.88Å |
| 131 | L | 80.3 | Confident | 85.5 | Confident | 151 Ų | 151 | 78.7 Ų | 78.7 | 79% | 0.791 | 37% | 0.365 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -72.8 | -57.5 | 178.9 | -62.4 | 176 | 0 | 0 | 0 | 111.7 | Y129 S133 R134 | Y129-L131 VanDerWaalsContact C-N 3.29Å; Y129-L131 PolarHBondContact O-N 3.29Å; Y129-L131 VanDerWaalsContact O-N 3.17Å; L131-S133 VanDerWaalsContact C-N 3.26Å; L131-S133 PolarHBondContact O-N 3.24Å; L131-R134 VanDerWaalsContact O-CB 3.24Å; L131-R134 WeakPolarHBondContact O-CB 3.37Å; L131-R134 PolarHBondContact O-N 2.87Å |
| 132 | H | 82.3 | Confident | 85.7 | Confident | 103 Ų | 103 | 75 Ų | 75 | 48% | 0.477 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -64.5 | -30.1 | 179.3 | -167.1 | 51.5 | 0 | 0 | 0 | 113.1 | Y129 R134 E135 L136 | Y129-H132 PolarHBondContact O-N 3.29Å; H132-R134 PolarHBondContact O-N 2.94Å; H132-R134 VanDerWaalsContact O-N 3.17Å; H132-E135 IonicContact CE1-OE2 3.43Å; H132-E135 IonicContact ND1-OE2 3.87Å; H132-E135 PolarHBondContact ND1-OE2 2.7Å; H132-E135 PolarHBondContact O-N 3.32Å; H132-E135 VanDerWaalsContact O-N 3.14Å; H132-L136 WeakPolarHBondContact CD2-CD1 3.31Å; H132-L136 WeakPolarHBondContact NE2-CD1 3.26Å; H132-L136 PolarHBondContact O-N 2.82Å; H132-L136 VanDerWaalsContact O-N 3.17Å |
| 133 | S | 83.4 | Confident | 86 | Confident | 9 Ų | 9 | 79.3 Ų | 79.3 | 6% | 0.063 | 37% | 0.368 | C | S | . | . | H | α-helix | trans | -62.4 | -22.7 | 174.7 | 78.5 | 0 | 0 | 0 | 0 | 113 | L125 Y129 P130 L131 E135 R137 | L125-S133 WeakPolarHBondContact O-CB 3.47Å; Y129-S133 WeakPolarHBondContact O-CA 3.45Å; Y129-S133 WeakPolarHBondContact O-CB 3.33Å; Y129-S133 PolarHBondContact O-N 2.93Å; Y129-S133 PolarHBondContact O-OG 3.32Å; P130-S133 PolarHBondContact O-OG 2.88Å; L131-S133 VanDerWaalsContact C-N 3.26Å; L131-S133 PolarHBondContact O-N 3.24Å; S133-E135 VanDerWaalsContact C-N 3.34Å; S133-R137 WeakPolarHBondContact O-CA 3.49Å; S133-R137 WeakPolarHBondContact O-CB 3.23Å; S133-R137 WeakPolarHBondContact O-CG 3.49Å; S133-R137 PolarHBondContact O-N 3.16Å |
| 134 | R | 81.3 | Confident | 86.4 | Confident | 220 Ų | 220 | 80.6 Ų | 80.6 | 83% | 0.83 | 39% | 0.386 | S | S | * | . | H | α-helix | trans | -69.8 | -33.6 | 177.2 | -169.1 | 177.8 | 175.4 | 178.2 | -3.1 | 111.8 | L131 H132 | L131-R134 VanDerWaalsContact O-CB 3.24Å; L131-R134 WeakPolarHBondContact O-CB 3.37Å; L131-R134 PolarHBondContact O-N 2.87Å; H132-R134 PolarHBondContact O-N 2.94Å; H132-R134 VanDerWaalsContact O-N 3.17Å |
| 135 | E | 85.7 | Confident | 86.9 | Confident | 132 Ų | 132 | 80.5 Ų | 80.5 | 62% | 0.617 | 39% | 0.392 | S | S | * | . | H | α-helix | trans | -78.8 | -38 | 176.9 | -64 | 162.7 | 178.9 | 0 | 0 | 111.5 | H132 S133 T138 | H132-E135 IonicContact CE1-OE2 3.43Å; H132-E135 IonicContact ND1-OE2 3.87Å; H132-E135 PolarHBondContact ND1-OE2 2.7Å; H132-E135 PolarHBondContact O-N 3.32Å; H132-E135 VanDerWaalsContact O-N 3.14Å; S133-E135 VanDerWaalsContact C-N 3.34Å; E135-T138 VanDerWaalsContact O-CG2 3.32Å; E135-T138 WeakPolarHBondContact O-CG2 3.43Å |
| 136 | L | 84.4 | Confident | 87.5 | Confident | 68 Ų | 68 | 79.8 Ų | 79.8 | 36% | 0.356 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -78.2 | -40.4 | -179.3 | -78.8 | 156.7 | 0 | 0 | 0 | 113.2 | H132 T138 N141 | H132-L136 WeakPolarHBondContact CD2-CD1 3.31Å; H132-L136 WeakPolarHBondContact NE2-CD1 3.26Å; H132-L136 PolarHBondContact O-N 2.82Å; H132-L136 VanDerWaalsContact O-N 3.17Å; L136-T138 PolarHBondContact O-N 2.78Å; L136-N141 WeakPolarHBondContact O-CB 3.26Å; L136-N141 PolarHBondContact O-ND2 3.4Å |
| 137 | R | 88.6 | Confident | 88.1 | Confident | 72 Ų | 72 | 82.3 Ų | 82.3 | 27% | 0.272 | 41% | 0.409 | S | S | . | . | trans | -86.1 | 59.6 | -174.1 | -60.5 | 177.2 | 63.6 | -123.4 | -24.9 | 111.1 | T59 T60 D122 A126 S133 | T59-R137 HydrophobicContact CG2-CB 3.94Å; T59-R137 VanDerWaalsContact CG2-O 3.26Å; T59-R137 WeakPolarHBondContact CG2-O 3.35Å; T59-R137 PolarHBondContact OG1-NH2 2.97Å; T60-R137 PolarHBondContact OG1-NH2 3.33Å; D122-R137 IonicContact OD1-CZ 3.62Å; D122-R137 IonicContact OD1-NE 2.75Å; D122-R137 PolarHBondContact OD1-NE 2.68Å; D122-R137 IonicContact OD1-NH2 3.64Å; D122-R137 IonicContact OD2-CZ 3.85Å; D122-R137 IonicContact OD2-NE 3.51Å; D122-R137 IonicContact OD2-NH2 3.65Å; A126-R137 VanDerWaalsContact CB-NH1 3.28Å; S133-R137 WeakPolarHBondContact O-CA 3.49Å; S133-R137 WeakPolarHBondContact O-CB 3.23Å; S133-R137 WeakPolarHBondContact O-CG 3.49Å; S133-R137 PolarHBondContact O-N 3.16Å | ||
| 138 | T | 90.3 | Very high | 88.9 | Confident | 42 Ų | 42 | 86.4 Ų | 86.4 | 26% | 0.258 | 43% | 0.43 | S | S | . | . | trans | -97.7 | 153.2 | 172.4 | 64.7 | 0 | 0 | 0 | 0 | 110.8 | T59 E135 L136 R140 N141 A142 | T59-T138 WeakPolarHBondContact CG2-O 3.36Å; E135-T138 VanDerWaalsContact O-CG2 3.32Å; E135-T138 WeakPolarHBondContact O-CG2 3.43Å; L136-T138 PolarHBondContact O-N 2.78Å; T138-R140 PolarHBondContact O-N 2.94Å; T138-N141 PolarHBondContact O-N 3.4Å; T138-N141 WeakPolarHBondContact OG1-CB 3.39Å; T138-N141 PolarHBondContact OG1-N 2.98Å; T138-N141 PolarHBondContact OG1-ND2 3.44Å; T138-A142 PolarHBondContact O-N 3.37Å | ||
| 139 | P | 90.4 | Very high | 89.7 | Confident | 56 Ų | 56 | 81.9 Ų | 81.9 | 36% | 0.364 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -57.8 | -36.2 | 175.3 | -25.6 | 35 | 0 | 0 | 0 | 112.9 | V57 L62 A142 L143 | V57-P139 WeakPolarHBondContact O-CG 3.5Å; L62-P139 HydrophobicContact CD1-CB 4.17Å; P139-A142 PolarHBondContact O-N 3.22Å; P139-L143 WeakPolarHBondContact O-CB 3.3Å; P139-L143 VanDerWaalsContact O-CG 3.31Å; P139-L143 WeakPolarHBondContact O-CG 3.38Å; P139-L143 PolarHBondContact O-N 3.5Å |
| 140 | R | 91.9 | Very high | 90.5 | Very high | 210 Ų | 210 | 79.8 Ų | 79.8 | 79% | 0.792 | 41% | 0.406 | S | S | * | . | H | α-helix | trans | -61.5 | -48.9 | 177.4 | -67.3 | -175.7 | 179.4 | 177.3 | -0.6 | 111.6 | T138 A142 L143 A144 | T138-R140 PolarHBondContact O-N 2.94Å; R140-A142 VanDerWaalsContact C-N 3.31Å; R140-A142 PolarHBondContact O-N 2.83Å; R140-L143 PolarHBondContact O-N 3.4Å; R140-A144 WeakPolarHBondContact O-CB 3.29Å; R140-A144 PolarHBondContact O-N 3.46Å |
| 141 | N | 93.1 | Very high | 91.4 | Very high | 77 Ų | 77 | 78.2 Ų | 78.2 | 41% | 0.412 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -65.8 | -36.2 | 177.8 | -66.9 | -5.3 | 0 | 0 | 0 | 111.8 | L136 T138 A144 A145 | L136-N141 WeakPolarHBondContact O-CB 3.26Å; L136-N141 PolarHBondContact O-ND2 3.4Å; T138-N141 PolarHBondContact O-N 3.4Å; T138-N141 WeakPolarHBondContact OG1-CB 3.39Å; T138-N141 PolarHBondContact OG1-N 2.98Å; T138-N141 PolarHBondContact OG1-ND2 3.44Å; N141-A144 PolarHBondContact O-N 3.09Å; N141-A145 WeakPolarHBondContact O-CB 3.37Å; N141-A145 PolarHBondContact O-N 3.2Å |
| 142 | A | 93.5 | Very high | 92.2 | Very high | 3 Ų | 3 | 74 Ų | 74 | 3% | 0.025 | 38% | 0.38 | C | S | . | . | H | α-helix | trans | -65.4 | -42 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | T59 L62 F63 T138 P139 R140 A145 I146 | T59-A142 HydrophobicContact CG2-CB 3.84Å; L62-A142 HydrophobicContact CD1-CB 3.85Å; F63-A142 HydrophobicContact CE2-CB 4.48Å; F63-A142 HydrophobicContact CZ-CB 4.32Å; T138-A142 PolarHBondContact O-N 3.37Å; P139-A142 PolarHBondContact O-N 3.22Å; R140-A142 VanDerWaalsContact C-N 3.31Å; R140-A142 PolarHBondContact O-N 2.83Å; A142-A145 PolarHBondContact O-N 3.32Å; A142-I146 VanDerWaalsContact O-CG1 3.29Å; A142-I146 WeakPolarHBondContact O-CG1 3.23Å; A142-I146 PolarHBondContact O-N 3.29Å |
| 143 | L | 94.4 | Very high | 93 | Very high | 100 Ų | 100 | 69 Ų | 69 | 52% | 0.524 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -65.7 | -40.6 | 174.8 | -71.4 | 171.9 | 0 | 0 | 0 | 111.9 | L62 P139 R140 A145 I146 A147 | L62-L143 HydrophobicContact CD1-CG 4.41Å; P139-L143 WeakPolarHBondContact O-CB 3.3Å; P139-L143 VanDerWaalsContact O-CG 3.31Å; P139-L143 WeakPolarHBondContact O-CG 3.38Å; P139-L143 PolarHBondContact O-N 3.5Å; R140-L143 PolarHBondContact O-N 3.4Å; L143-A145 VanDerWaalsContact C-N 3.33Å; L143-A145 PolarHBondContact O-N 3.49Å; L143-I146 PolarHBondContact O-N 3.47Å; L143-A147 PolarHBondContact O-N 2.89Å |
| 144 | A | 96.1 | Very high | 93.7 | Very high | 59 Ų | 59 | 72.8 Ų | 72.8 | 49% | 0.488 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -61.1 | -42.2 | 172.8 | 0 | 0 | 0 | 0 | 0 | 111.7 | R140 N141 A147 L148 | R140-A144 WeakPolarHBondContact O-CB 3.29Å; R140-A144 PolarHBondContact O-N 3.46Å; N141-A144 PolarHBondContact O-N 3.09Å; A144-A147 PolarHBondContact O-N 3.19Å; A144-L148 WeakPolarHBondContact O-CB 3.41Å; A144-L148 PolarHBondContact O-N 2.94Å |
| 145 | A | 96.2 | Very high | 94.4 | Very high | 32 Ų | 32 | 67.9 Ų | 67.9 | 26% | 0.264 | 37% | 0.366 | S | S | . | . | H | α-helix | trans | -64.1 | -39.1 | 174.4 | 0 | 0 | 0 | 0 | 0 | 112.3 | F63 N141 A142 L143 L148 I149 | F63-A145 HydrophobicContact CE1-CB 4.04Å; F63-A145 HydrophobicContact CZ-CB 3.99Å; N141-A145 WeakPolarHBondContact O-CB 3.37Å; N141-A145 PolarHBondContact O-N 3.2Å; A142-A145 PolarHBondContact O-N 3.32Å; L143-A145 VanDerWaalsContact C-N 3.33Å; L143-A145 PolarHBondContact O-N 3.49Å; A145-L148 PolarHBondContact O-N 3.22Å; A145-I149 WeakPolarHBondContact O-CD1 3.34Å; A145-I149 VanDerWaalsContact O-CG1 3.23Å; A145-I149 WeakPolarHBondContact O-CG1 3.28Å; A145-I149 PolarHBondContact O-N 3.01Å |
| 146 | I | 97.5 | Very high | 94.9 | Very high | 22 Ų | 22 | 64 Ų | 64 | 11% | 0.113 | 35% | 0.347 | C | S | . | . | H | α-helix | trans | -64 | -45 | 174.2 | -71.1 | 164.3 | 0 | 0 | 0 | 110.7 | L62 F63 N66 A142 L143 L148 I149 W150 | L62-I146 HydrophobicContact CB-CD1 4.04Å; F63-I146 HydrophobicContact CD1-CD1 4.35Å; F63-I146 HydrophobicContact CD1-CG1 3.95Å; F63-I146 HydrophobicContact CE1-CG1 3.96Å; N66-I146 HydrophobicContact CB-CD1 4.16Å; N66-I146 HydrophobicContact CB-CG1 4.22Å; N66-I146 WeakPolarHBondContact OD1-CG2 3.48Å; A142-I146 VanDerWaalsContact O-CG1 3.29Å; A142-I146 WeakPolarHBondContact O-CG1 3.23Å; A142-I146 PolarHBondContact O-N 3.29Å; L143-I146 PolarHBondContact O-N 3.47Å; I146-L148 VanDerWaalsContact C-N 3.29Å; I146-L148 PolarHBondContact O-N 3.12Å; I146-I149 WeakPolarHBondContact O-CB 3.28Å; I146-I149 PolarHBondContact O-N 2.85Å; I146-I149 VanDerWaalsContact O-N 3.15Å; I146-W150 VanDerWaalsContact O-CD1 3.24Å; I146-W150 PolarHBondContact O-N 2.9Å |
| 147 | A | 97.9 | Very high | 95.4 | Very high | 65 Ų | 65 | 60.8 Ų | 60.8 | 54% | 0.537 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -59.3 | -42.3 | 175.4 | 0 | 0 | 0 | 0 | 0 | 111.5 | L143 A144 W150 G151 | L143-A147 PolarHBondContact O-N 2.89Å; A144-A147 PolarHBondContact O-N 3.19Å; A147-W150 PolarHBondContact O-N 2.9Å; A147-G151 PolarHBondContact O-N 2.93Å |
| 148 | L | 97.8 | Very high | 95.8 | Very high | 109 Ų | 109 | 58.7 Ų | 58.7 | 57% | 0.571 | 33% | 0.331 | S | S | * | . | H | α-helix | trans | -62.2 | -43.6 | 173.6 | 179.3 | 63.8 | 0 | 0 | 0 | 112 | A144 A145 I146 W150 G151 L152 | A144-L148 WeakPolarHBondContact O-CB 3.41Å; A144-L148 PolarHBondContact O-N 2.94Å; A145-L148 PolarHBondContact O-N 3.22Å; I146-L148 VanDerWaalsContact C-N 3.29Å; I146-L148 PolarHBondContact O-N 3.12Å; L148-W150 VanDerWaalsContact C-N 3.35Å; L148-W150 PolarHBondContact O-N 2.86Å; L148-G151 PolarHBondContact O-N 2.62Å; L148-L152 HydrophobicContact CD1-CD1 4.09Å; L148-L152 HydrophobicContact CD1-CG 4.03Å; L148-L152 HydrophobicContact CG-CD1 4Å; L148-L152 HydrophobicContact CG-CG 4.34Å; L148-L152 WeakPolarHBondContact O-CB 3.23Å; L148-L152 WeakPolarHBondContact O-CG 3.43Å; L148-L152 PolarHBondContact O-N 3.44Å |
| 149 | I | 98.1 | Very high | 96 | Very high | 10 Ų | 10 | 59 Ų | 59 | 5% | 0.051 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -56.5 | -49.5 | 176.3 | -75 | 161.1 | 0 | 0 | 0 | 110.3 | F63 A111 F114 A118 A145 I146 S153 | F63-I149 HydrophobicContact CD1-CD1 4.49Å; F63-I149 HydrophobicContact CE1-CD1 4.23Å; A111-I149 HydrophobicContact CB-CG2 4.4Å; F114-I149 HydrophobicContact CB-CB 4.48Å; F114-I149 HydrophobicContact CB-CG1 4.02Å; F114-I149 HydrophobicContact CB-CG2 3.99Å; A118-I149 HydrophobicContact CB-CD1 3.93Å; A145-I149 WeakPolarHBondContact O-CD1 3.34Å; A145-I149 VanDerWaalsContact O-CG1 3.23Å; A145-I149 WeakPolarHBondContact O-CG1 3.28Å; A145-I149 PolarHBondContact O-N 3.01Å; I146-I149 WeakPolarHBondContact O-CB 3.28Å; I146-I149 PolarHBondContact O-N 2.85Å; I146-I149 VanDerWaalsContact O-N 3.15Å; I149-S153 VanDerWaalsContact O-CB 3.28Å; I149-S153 WeakPolarHBondContact O-CB 3.43Å; I149-S153 PolarHBondContact O-N 3.5Å; I149-S153 PolarHBondContact O-OG 2.83Å |
| 150 | W | 98.4 | Very high | 96.2 | Very high | 63 Ų | 63 | 56.4 Ų | 56.4 | 24% | 0.239 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -66.4 | -41.1 | 178.6 | -77.1 | 101.7 | 0 | 0 | 0 | 112.2 | N66 A70 L107 A111 I146 A147 L148 S153 L154 | N66-W150 PolarHBondContact OD1-NE1 3.5Å; A70-W150 HydrophobicContact CB-CZ2 4.5Å; L107-W150 HydrophobicContact CD1-CE3 4.28Å; L107-W150 HydrophobicContact CD1-CZ3 4.35Å; L107-W150 HydrophobicContact CD2-CZ3 4.08Å; L107-W150 HydrophobicContact CG-CE3 4.44Å; L107-W150 HydrophobicContact CG-CZ3 4.02Å; A111-W150 HydrophobicContact CB-CE3 4.42Å; A111-W150 HydrophobicContact CB-CH2 4.26Å; A111-W150 HydrophobicContact CB-CZ2 4.37Å; A111-W150 HydrophobicContact CB-CZ3 4.28Å; I146-W150 VanDerWaalsContact O-CD1 3.24Å; I146-W150 PolarHBondContact O-N 2.9Å; A147-W150 PolarHBondContact O-N 2.9Å; L148-W150 VanDerWaalsContact C-N 3.35Å; L148-W150 PolarHBondContact O-N 2.86Å; W150-S153 PolarHBondContact O-N 3.41Å; W150-L154 WeakPolarHBondContact O-CB 3.44Å; W150-L154 VanDerWaalsContact O-CG 3.28Å; W150-L154 WeakPolarHBondContact O-CG 3.44Å; W150-L154 PolarHBondContact O-N 3.43Å |
| 151 | G | 98.3 | Very high | 96.3 | Very high | 39 Ų | 39 | 50.2 Ų | 50.2 | 40% | 0.402 | 30% | 0.299 | S | S | . | . | H | α-helix | trans | -58.9 | -48.1 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | A147 L148 S153 L154 L155 | A147-G151 PolarHBondContact O-N 2.93Å; L148-G151 PolarHBondContact O-N 2.62Å; G151-S153 VanDerWaalsContact C-N 3.35Å; G151-L154 PolarHBondContact O-N 3.22Å; G151-L155 WeakPolarHBondContact O-CB 3.21Å; G151-L155 PolarHBondContact O-N 2.88Å |
| 152 | L | 97.4 | Very high | 96.4 | Very high | 62 Ų | 62 | 50.1 Ų | 50.1 | 33% | 0.325 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -64.2 | -40.3 | 174.8 | -69.3 | 174.8 | 0 | 0 | 0 | 111.6 | F114 L148 L154 L155 F156 | F114-L152 HydrophobicContact CD2-CB 4.2Å; F114-L152 HydrophobicContact CE2-CB 3.85Å; L148-L152 HydrophobicContact CD1-CD1 4.09Å; L148-L152 HydrophobicContact CD1-CG 4.03Å; L148-L152 HydrophobicContact CG-CD1 4Å; L148-L152 HydrophobicContact CG-CG 4.34Å; L148-L152 WeakPolarHBondContact O-CB 3.23Å; L148-L152 WeakPolarHBondContact O-CG 3.43Å; L148-L152 PolarHBondContact O-N 3.44Å; L152-L154 VanDerWaalsContact C-N 3.34Å; L152-L154 PolarHBondContact O-N 3.29Å; L152-L155 WeakPolarHBondContact O-CB 3.4Å; L152-L155 PolarHBondContact O-N 2.95Å; L152-F156 HydrophobicContact CB-CD2 4.44Å; L152-F156 HydrophobicContact CB-CE2 4.35Å; L152-F156 HydrophobicContact CD2-CE2 4.34Å; L152-F156 WeakPolarHBondContact O-CD2 3.32Å; L152-F156 PolarHBondContact O-N 3.45Å |
| 153 | S | 98.1 | Very high | 96.5 | Very high | 0 Ų | 0 | 50.3 Ų | 50.3 | 0% | 0 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -64.3 | -40.4 | 178.6 | -56 | 0 | 0 | 0 | 0 | 111.5 | A111 I149 W150 G151 S157 | A111-S153 VanDerWaalsContact CA-OG 3.23Å; A111-S153 WeakPolarHBondContact CA-OG 3.45Å; A111-S153 PolarHBondContact N-OG 2.92Å; I149-S153 VanDerWaalsContact O-CB 3.28Å; I149-S153 WeakPolarHBondContact O-CB 3.43Å; I149-S153 PolarHBondContact O-N 3.5Å; I149-S153 PolarHBondContact O-OG 2.83Å; W150-S153 PolarHBondContact O-N 3.41Å; G151-S153 VanDerWaalsContact C-N 3.35Å; S153-S157 WeakPolarHBondContact O-CB 3.41Å; S153-S157 PolarHBondContact O-N 2.88Å; S153-S157 PolarHBondContact O-OG 3.35Å |
| 154 | L | 97.7 | Very high | 96.5 | Very high | 88 Ų | 88 | 47.1 Ų | 47.1 | 46% | 0.461 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -64.3 | -44.4 | 173.2 | -73.3 | 167.1 | 0 | 0 | 0 | 111.4 | F103 L107 W150 G151 L152 F156 S157 G158 | F103-L154 HydrophobicContact CZ-CD2 3.84Å; L107-L154 HydrophobicContact CD1-CD2 3.75Å; L107-L154 HydrophobicContact CD1-CG 3.92Å; L107-L154 HydrophobicContact CD2-CD2 4.17Å; W150-L154 WeakPolarHBondContact O-CB 3.44Å; W150-L154 VanDerWaalsContact O-CG 3.28Å; W150-L154 WeakPolarHBondContact O-CG 3.44Å; W150-L154 PolarHBondContact O-N 3.43Å; G151-L154 PolarHBondContact O-N 3.22Å; L152-L154 VanDerWaalsContact C-N 3.34Å; L152-L154 PolarHBondContact O-N 3.29Å; L154-F156 PolarHBondContact O-N 3.39Å; L154-S157 PolarHBondContact O-N 2.85Å; L154-S157 PolarHBondContact O-OG 3.48Å; L154-G158 PolarHBondContact O-N 3.33Å |
| 155 | L | 96.6 | Very high | 96.4 | Very high | 117 Ų | 117 | 51.9 Ų | 51.9 | 61% | 0.613 | 29% | 0.291 | S | S | * | . | H | α-helix | trans | -57.6 | -50.2 | 177.8 | 177.7 | 64.6 | 0 | 0 | 0 | 111.6 | G151 L152 | G151-L155 WeakPolarHBondContact O-CB 3.21Å; G151-L155 PolarHBondContact O-N 2.88Å; L152-L155 WeakPolarHBondContact O-CB 3.4Å; L152-L155 PolarHBondContact O-N 2.95Å |
| 156 | F | 95.7 | Very high | 96.3 | Very high | 50 Ų | 50 | 53 Ų | 53 | 22% | 0.219 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -76.8 | -27.5 | -178.1 | -68.1 | -61.1 | 0 | 0 | 0 | 113.5 | F114 L152 L154 M187 F194 | F114-F156 AromaticContact CE2-CD2 3.97Å; F114-F156 HydrophobicContact CE2-CD2 3.97Å; F114-F156 HydrophobicContact CE2-CE2 4.35Å; F114-F156 AromaticContact CZ-CD2 3.79Å; F114-F156 HydrophobicContact CZ-CD2 3.79Å; F114-F156 AromaticContact CZ-CE2 3.94Å; F114-F156 HydrophobicContact CZ-CE2 3.94Å; L152-F156 HydrophobicContact CB-CD2 4.44Å; L152-F156 HydrophobicContact CB-CE2 4.35Å; L152-F156 HydrophobicContact CD2-CE2 4.34Å; L152-F156 WeakPolarHBondContact O-CD2 3.32Å; L152-F156 PolarHBondContact O-N 3.45Å; L154-F156 PolarHBondContact O-N 3.39Å; F156-M187 WeakPolarHBondContact O-CE 2.97Å; F156-F194 AromaticContact CD1-CD2 3.92Å; F156-F194 HydrophobicContact CD1-CD2 3.92Å; F156-F194 HydrophobicContact CD1-CE2 4.33Å; F156-F194 HydrophobicContact CD1-CG 4.19Å; F156-F194 AromaticContact CE1-CD1 3.99Å; F156-F194 HydrophobicContact CE1-CD1 3.99Å; F156-F194 AromaticContact CE1-CD2 3.58Å; F156-F194 HydrophobicContact CE1-CD2 3.58Å; F156-F194 HydrophobicContact CE1-CE1 4.04Å; F156-F194 AromaticContact CE1-CE2 3.65Å; F156-F194 HydrophobicContact CE1-CE2 3.65Å; F156-F194 AromaticContact CE1-CG 3.78Å; F156-F194 HydrophobicContact CE1-CG 3.78Å; F156-F194 AromaticContact CE1-CZ 3.89Å; F156-F194 HydrophobicContact CE1-CZ 3.89Å; F156-F194 HydrophobicContact CE2-CD1 4.26Å; F156-F194 HydrophobicContact CE2-CG 4.37Å; F156-F194 AromaticContact CZ-CD1 3.69Å; F156-F194 HydrophobicContact CZ-CD1 3.69Å; F156-F194 HydrophobicContact CZ-CD2 4.15Å; F156-F194 AromaticContact CZ-CE1 3.82Å; F156-F194 HydrophobicContact CZ-CE1 3.82Å; F156-F194 HydrophobicContact CZ-CE2 4.28Å; F156-F194 AromaticContact CZ-CG 3.88Å; F156-F194 HydrophobicContact CZ-CG 3.88Å; F156-F194 HydrophobicContact CZ-CZ 4.12Å |
| 157 | S | 96.1 | Very high | 96.1 | Very high | 0 Ų | 0 | 53.7 Ų | 53.7 | 0% | 0 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -85.9 | -22.6 | 177.9 | 61.4 | 0 | 0 | 0 | 0 | 114 | F103 S153 L154 P159 Y160 | F103-S157 VanDerWaalsContact CE2-OG 3.3Å; F103-S157 WeakPolarHBondContact CE2-OG 3.24Å; S153-S157 WeakPolarHBondContact O-CB 3.41Å; S153-S157 PolarHBondContact O-N 2.88Å; S153-S157 PolarHBondContact O-OG 3.35Å; L154-S157 PolarHBondContact O-N 2.85Å; L154-S157 PolarHBondContact O-OG 3.48Å; S157-P159 VanDerWaalsContact C-CD 3.43Å; S157-Y160 WeakPolarHBondContact O-CB 3.4Å; S157-Y160 WeakPolarHBondContact O-CD2 3.35Å; S157-Y160 PolarHBondContact O-N 2.86Å |
| 158 | G | 95.6 | Very high | 95.8 | Very high | 29 Ų | 29 | 56.5 Ų | 56.5 | 30% | 0.299 | 30% | 0.299 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -48.2 | -44.9 | -178.3 | 0 | 0 | 0 | 0 | 0 | 115.4 | L154 Y160 L161 | L154-G158 PolarHBondContact O-N 3.33Å; G158-Y160 PolarHBondContact O-N 3.38Å; G158-L161 PolarHBondContact O-N 3Å |
| 159 | P | 95.3 | Very high | 95.3 | Very high | 48 Ų | 48 | 55.4 Ų | 55.4 | 31% | 0.312 | 29% | 0.294 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -56.5 | -25.6 | 177.6 | -27.3 | 35.9 | 0 | 0 | 0 | 114.6 | S157 L161 S162 Y163 W179 M187 | S157-P159 VanDerWaalsContact C-CD 3.43Å; P159-L161 PolarHBondContact O-N 3.29Å; P159-S162 PolarHBondContact O-N 2.99Å; P159-S162 VanDerWaalsContact O-N 3.09Å; P159-Y163 PolarHBondContact O-N 3.09Å; P159-W179 HydrophobicContact CB-CH2 3.91Å; P159-M187 HydrophobicContact CB-CE 3.82Å; P159-M187 HydrophobicContact CB-SD 3.9Å; P159-M187 HydrophobicContact CG-CE 4.1Å; P159-M187 HydrophobicContact CG-SD 4.33Å |
| 160 | Y | 94.8 | Very high | 94.6 | Very high | 2 Ų | 2 | 59.6 Ų | 59.6 | 1% | 0.008 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -65.8 | -22.4 | -178.6 | -74.9 | -70.4 | 0 | 0 | 0 | 114.4 | F106 S157 G158 S162 Y163 Y164 M187 T191 | F106-Y160 HydrophobicContact CB-CD2 3.51Å; F106-Y160 HydrophobicContact CB-CE2 3.56Å; F106-Y160 HydrophobicContact CB-CG 4.28Å; F106-Y160 HydrophobicContact CD1-CD2 4.16Å; F106-Y160 HydrophobicContact CD1-CE1 4.15Å; F106-Y160 AromaticContact CD1-CE2 3.45Å; F106-Y160 HydrophobicContact CD1-CE2 3.45Å; F106-Y160 VanDerWaalsContact CD1-CE2 3.45Å; F106-Y160 AromaticContact CD1-CZ 3.42Å; F106-Y160 VanDerWaalsContact CD1-CZ 3.42Å; F106-Y160 WeakPolarHBondContact CD1-OH 3.33Å; F106-Y160 AromaticContact CD2-CD1 3.51Å; F106-Y160 HydrophobicContact CD2-CD1 3.51Å; F106-Y160 AromaticContact CD2-CD2 3.47Å; F106-Y160 HydrophobicContact CD2-CD2 3.47Å; F106-Y160 VanDerWaalsContact CD2-CD2 3.47Å; F106-Y160 AromaticContact CD2-CE1 3.61Å; F106-Y160 HydrophobicContact CD2-CE1 3.61Å; F106-Y160 AromaticContact CD2-CE2 3.58Å; F106-Y160 HydrophobicContact CD2-CE2 3.58Å; F106-Y160 AromaticContact CD2-CG 3.41Å; F106-Y160 HydrophobicContact CD2-CG 3.41Å; F106-Y160 VanDerWaalsContact CD2-CG 3.41Å; F106-Y160 AromaticContact CD2-CZ 3.62Å; F106-Y160 AromaticContact CE1-CE1 3.93Å; F106-Y160 HydrophobicContact CE1-CE1 3.93Å; F106-Y160 HydrophobicContact CE1-CE2 4.04Å; F106-Y160 AromaticContact CE1-CZ 3.49Å; F106-Y160 VanDerWaalsContact CE1-CZ 3.49Å; F106-Y160 VanDerWaalsContact CE1-OH 3.26Å; F106-Y160 WeakPolarHBondContact CE1-OH 3.31Å; F106-Y160 AromaticContact CE2-CD1 3.56Å; F106-Y160 HydrophobicContact CE2-CD1 3.56Å; F106-Y160 HydrophobicContact CE2-CD2 4.31Å; F106-Y160 AromaticContact CE2-CE1 3.42Å; F106-Y160 HydrophobicContact CE2-CE1 3.42Å; F106-Y160 VanDerWaalsContact CE2-CE1 3.42Å; F106-Y160 HydrophobicContact CE2-CE2 4.2Å; F106-Y160 AromaticContact CE2-CG 3.99Å; F106-Y160 HydrophobicContact CE2-CG 3.99Å; F106-Y160 AromaticContact CE2-CZ 3.74Å; F106-Y160 HydrophobicContact CG-CD1 4.21Å; F106-Y160 AromaticContact CG-CD2 3.43Å; F106-Y160 HydrophobicContact CG-CD2 3.43Å; F106-Y160 VanDerWaalsContact CG-CD2 3.43Å; F106-Y160 HydrophobicContact CG-CE1 4.03Å; F106-Y160 AromaticContact CG-CE2 3.21Å; F106-Y160 HydrophobicContact CG-CE2 3.21Å; F106-Y160 AromaticContact CG-CG 3.91Å; F106-Y160 HydrophobicContact CG-CG 3.91Å; F106-Y160 AromaticContact CG-CZ 3.52Å; F106-Y160 HydrophobicContact CZ-CD1 4.21Å; F106-Y160 AromaticContact CZ-CE1 3.58Å; F106-Y160 HydrophobicContact CZ-CE1 3.58Å; F106-Y160 HydrophobicContact CZ-CE2 4.39Å; F106-Y160 AromaticContact CZ-CZ 3.67Å; S157-Y160 WeakPolarHBondContact O-CB 3.4Å; S157-Y160 WeakPolarHBondContact O-CD2 3.35Å; S157-Y160 PolarHBondContact O-N 2.86Å; G158-Y160 PolarHBondContact O-N 3.38Å; Y160-S162 PolarHBondContact O-N 3.31Å; Y160-Y163 AromaticContact CD1-CD1 3.94Å; Y160-Y163 HydrophobicContact CD1-CD1 3.94Å; Y160-Y163 HydrophobicContact CD1-CE1 4.48Å; Y160-Y163 AromaticContact CD1-CG 3.98Å; Y160-Y163 HydrophobicContact CD1-CG 3.98Å; Y160-Y163 HydrophobicContact CE1-CD1 4.2Å; Y160-Y163 HydrophobicContact CE1-CE1 4.32Å; Y160-Y163 HydrophobicContact CE1-CG 4.32Å; Y160-Y163 PolarHBondContact O-N 3.37Å; Y160-Y164 HydrophobicContact CD1-CD2 4.09Å; Y160-Y164 AromaticContact CD1-CE2 3.72Å; Y160-Y164 HydrophobicContact CD1-CE2 3.72Å; Y160-Y164 HydrophobicContact CE1-CE2 4.21Å; Y160-Y164 PolarHBondContact O-N 2.89Å; Y160-M187 HydrophobicContact CD2-CE 3.6Å; Y160-M187 HydrophobicContact CE1-CE 4.19Å; Y160-M187 HydrophobicContact CE1-CG 4.12Å; Y160-M187 HydrophobicContact CE2-CE 3.17Å; Y160-M187 HydrophobicContact CG-CE 4.28Å; Y160-T191 PolarHBondContact OH-OG1 3.47Å |
| 161 | L | 94.9 | Very high | 94.1 | Very high | 79 Ų | 79 | 64.5 Ų | 64.5 | 41% | 0.414 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -63.9 | -27.3 | 173.7 | -69.2 | 171.1 | 0 | 0 | 0 | 112.9 | K99 F103 G158 P159 | K99-L161 HydrophobicContact CB-CD2 4.35Å; K99-L161 WeakPolarHBondContact CD-O 3.08Å; K99-L161 WeakPolarHBondContact CE-O 3.49Å; F103-L161 HydrophobicContact CB-CD2 3.67Å; F103-L161 HydrophobicContact CB-CG 4.18Å; F103-L161 HydrophobicContact CD1-CD2 4.42Å; F103-L161 HydrophobicContact CD2-CD1 4.22Å; F103-L161 HydrophobicContact CD2-CD2 4.08Å; F103-L161 HydrophobicContact CD2-CG 3.8Å; F103-L161 HydrophobicContact CE2-CD1 4.37Å; F103-L161 HydrophobicContact CE2-CG 4.43Å; F103-L161 HydrophobicContact CG-CD2 3.8Å; F103-L161 HydrophobicContact CG-CG 4.06Å; G158-L161 PolarHBondContact O-N 3Å; P159-L161 PolarHBondContact O-N 3.29Å |
| 162 | S | 94.7 | Very high | 93.8 | Very high | 76 Ų | 76 | 66.5 Ų | 66.5 | 53% | 0.531 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -98.2 | -27.2 | 174.9 | 178.1 | 0 | 0 | 0 | 0 | 112.2 | P159 Y160 W179 | P159-S162 PolarHBondContact O-N 2.99Å; P159-S162 VanDerWaalsContact O-N 3.09Å; Y160-S162 PolarHBondContact O-N 3.31Å; S162-W179 VanDerWaalsContact C-NE1 3.34Å; S162-W179 PolarHBondContact O-NE1 2.95Å; S162-W179 VanDerWaalsContact O-NE1 3.11Å; S162-W179 PolarHBondContact OG-NE1 3.45Å |
| 163 | Y | 94.7 | Very high | 93.6 | Very high | 7 Ų | 7 | 65.2 Ų | 65.2 | 3% | 0.027 | 36% | 0.357 | C | S | . | . | H | α-helix | trans | -63.8 | -45.3 | -179.9 | -173.9 | -87.6 | 0 | 0 | 0 | 113 | P159 Y160 P177 A178 W179 R184 M187 D188 | P159-Y163 PolarHBondContact O-N 3.09Å; Y160-Y163 AromaticContact CD1-CD1 3.94Å; Y160-Y163 HydrophobicContact CD1-CD1 3.94Å; Y160-Y163 HydrophobicContact CD1-CE1 4.48Å; Y160-Y163 AromaticContact CD1-CG 3.98Å; Y160-Y163 HydrophobicContact CD1-CG 3.98Å; Y160-Y163 HydrophobicContact CE1-CD1 4.2Å; Y160-Y163 HydrophobicContact CE1-CE1 4.32Å; Y160-Y163 HydrophobicContact CE1-CG 4.32Å; Y160-Y163 PolarHBondContact O-N 3.37Å; Y163-P177 HydrophobicContact CD1-CB 3.99Å; Y163-P177 HydrophobicContact CD1-CG 4.37Å; Y163-P177 HydrophobicContact CE1-CB 3.34Å; Y163-P177 HydrophobicContact CE1-CG 3.55Å; Y163-P177 WeakPolarHBondContact O-CA 3.46Å; Y163-A178 PolarHBondContact O-N 3.15Å; Y163-W179 HydrophobicContact CD2-CB 4.34Å; Y163-W179 AromaticContact CD2-CD2 3.81Å; Y163-W179 HydrophobicContact CD2-CD2 3.81Å; Y163-W179 AromaticContact CD2-CE3 3.67Å; Y163-W179 HydrophobicContact CD2-CE3 3.67Å; Y163-W179 HydrophobicContact CD2-CG 4.12Å; Y163-W179 HydrophobicContact CD2-CZ3 4.29Å; Y163-W179 HydrophobicContact CE2-CE3 4.38Å; Y163-W179 HydrophobicContact CG-CD2 4.45Å; Y163-R184 HydrophobicContact CE2-CB 4.16Å; Y163-R184 HydrophobicContact CE2-CG 3.73Å; Y163-M187 HydrophobicContact CD2-CB 4.25Å; Y163-M187 HydrophobicContact CD2-CG 4.08Å; Y163-M187 HydrophobicContact CE2-CB 3.96Å; Y163-M187 HydrophobicContact CE2-CG 4.1Å; Y163-D188 PolarHBondContact OH-OD1 3.29Å; Y163-D188 VanDerWaalsContact OH-OD1 3.09Å |
| 164 | Y | 94.1 | Very high | 93.3 | Very high | 32 Ų | 32 | 67.1 Ų | 67.1 | 13% | 0.125 | 37% | 0.368 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -91.9 | 134 | 179.6 | -75.8 | -85.6 | 0 | 0 | 0 | 111.7 | H102 F106 Y160 P177 | H102-Y164 HydrophobicContact CB-CD1 4.28Å; H102-Y164 HydrophobicContact CB-CD2 3.39Å; H102-Y164 HydrophobicContact CB-CE2 3.69Å; H102-Y164 HydrophobicContact CB-CG 3.74Å; H102-Y164 AromaticContact CD2-CD1 3.3Å; H102-Y164 WeakPolarHBondContact CD2-CD1 3.5Å; H102-Y164 AromaticContact CD2-CE1 3.67Å; H102-Y164 AromaticContact CD2-CG 3.52Å; H102-Y164 AromaticContact CE1-CE1 3.73Å; H102-Y164 AromaticContact CG-CD1 3.68Å; H102-Y164 AromaticContact CG-CD2 3.7Å; H102-Y164 AromaticContact CG-CE1 3.76Å; H102-Y164 AromaticContact CG-CE2 3.8Å; H102-Y164 AromaticContact CG-CG 3.66Å; H102-Y164 AromaticContact CG-CZ 3.82Å; H102-Y164 AromaticContact ND1-CE1 3.77Å; H102-Y164 AromaticContact ND1-CZ 3.72Å; H102-Y164 AromaticContact NE2-CD1 3.63Å; H102-Y164 AromaticContact NE2-CE1 3.67Å; F106-Y164 AromaticContact CE2-CE2 3.72Å; F106-Y164 HydrophobicContact CE2-CE2 3.72Å; F106-Y164 HydrophobicContact CZ-CE2 4.48Å; Y160-Y164 HydrophobicContact CD1-CD2 4.09Å; Y160-Y164 AromaticContact CD1-CE2 3.72Å; Y160-Y164 HydrophobicContact CD1-CE2 3.72Å; Y160-Y164 HydrophobicContact CE1-CE2 4.21Å; Y160-Y164 PolarHBondContact O-N 2.89Å; Y164-P177 HydrophobicContact CD1-CG 4.47Å; Y164-P177 HydrophobicContact CE1-CG 3.86Å |
| 165 | R | 94.5 | Very high | 93.2 | Very high | 159 Ų | 159 | 64.1 Ų | 64.1 | 60% | 0.6 | 35% | 0.354 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -141.1 | 144.9 | 177.2 | -168 | -179.6 | 174.9 | 172.1 | 0.8 | 110.7 | H176 A178 | R165-H176 PolarHBondContact N-O 3.48Å; R165-H176 PolarHBondContact O-N 3.41Å; R165-H176 PolarHBondContact O-ND1 3.43Å; R165-A178 HydrophobicContact CB-CB 3.71Å |
| 166 | Q | 94.4 | Very high | 92.9 | Very high | 57 Ų | 57 | 61.2 Ų | 61.2 | 27% | 0.266 | 34% | 0.337 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -81.4 | 132.1 | 166.4 | -176.8 | -179.1 | -49.2 | 0 | 0 | 110.5 | G94 T173 V174 | G94-Q166 PolarHBondContact O-OE1 3.31Å; Q166-T173 VanDerWaalsContact CD-CG2 3.47Å; Q166-T173 HydrophobicContact CG-CG2 3.48Å; Q166-T173 VanDerWaalsContact CG-CG2 3.48Å; Q166-V174 WeakPolarHBondContact CA-O 3.45Å |
| 167 | S | 92.4 | Very high | 92.8 | Very high | 35 Ų | 35 | 60.6 Ų | 60.6 | 25% | 0.245 | 34% | 0.338 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -147.4 | 164.5 | 171.5 | 64.4 | 0 | 0 | 0 | 0 | 111.7 | L169 V174 H176 | S167-L169 WeakPolarHBondContact OG-CD1 3.28Å; S167-V174 PolarHBondContact N-O 3.16Å; S167-V174 PolarHBondContact O-N 3.39Å; S167-H176 PolarHBondContact OG-CE1 3.18Å; S167-H176 PolarHBondContact OG-ND1 3.34Å |
| 168 | Q | 91.3 | Very high | 92.6 | Very high | 124 Ų | 124 | 62.9 Ų | 62.9 | 58% | 0.579 | 36% | 0.357 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -90.7 | 117.7 | 172.7 | -70.1 | -67.7 | -1.1 | 0 | 0 | 109.9 | L172 T173 | Q168-L172 WeakPolarHBondContact CA-O 3.38Å; Q168-L172 PolarHBondContact OE1-O 2.92Å; Q168-T173 PolarHBondContact NE2-OG1 3.32Å; Q168-T173 PolarHBondContact OE1-OG1 3.42Å |
| 169 | L | 87.6 | Confident | 92.6 | Very high | 87 Ų | 87 | 64.1 Ų | 64.1 | 46% | 0.455 | 35% | 0.353 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -121.7 | 120.6 | 172.6 | -92.9 | 64.4 | 0 | 0 | 0 | 108.1 | S167 N171 L172 V174 | S167-L169 WeakPolarHBondContact OG-CD1 3.28Å; L169-N171 PolarHBondContact O-N 2.95Å; L169-L172 PolarHBondContact N-O 3.06Å; L169-L172 WeakPolarHBondContact O-CB 3.49Å; L169-L172 PolarHBondContact O-N 3.31Å; L169-V174 HydrophobicContact CB-CG2 4.07Å; L169-V174 HydrophobicContact CD1-CG2 4.05Å; L169-V174 HydrophobicContact CD2-CG2 4.15Å; L169-V174 HydrophobicContact CG-CG2 4.32Å |
| 170 | A | 84.2 | Confident | 92.5 | Very high | 97 Ų | 97 | 64.1 Ų | 64.1 | 80% | 0.802 | 35% | 0.354 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 50.3 | 50 | 177.5 | 0 | 0 | 0 | 0 | 0 | 113.9 | L172 | A170-L172 PolarHBondContact O-N 3.39Š|
| 171 | N | 88.6 | Confident | 92.4 | Very high | 166 Ų | 166 | 65.5 Ų | 65.5 | 89% | 0.888 | 37% | 0.366 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 62.7 | 12.6 | -176.5 | -57.1 | -27.3 | 0 | 0 | 0 | 115.5 | L169 | L169-N171 PolarHBondContact O-N 2.95Š|
| 172 | L | 90.3 | Very high | 92.4 | Very high | 81 Ų | 81 | 66.4 Ų | 66.4 | 42% | 0.424 | 38% | 0.377 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -114.7 | 132.1 | 175.5 | -69.5 | 161.1 | 0 | 0 | 0 | 110.9 | D89 Q168 L169 A170 V174 | D89-L172 HydrophobicContact CB-CD2 4.19Å; Q168-L172 WeakPolarHBondContact CA-O 3.38Å; Q168-L172 PolarHBondContact OE1-O 2.92Å; L169-L172 PolarHBondContact N-O 3.06Å; L169-L172 WeakPolarHBondContact O-CB 3.49Å; L169-L172 PolarHBondContact O-N 3.31Å; A170-L172 PolarHBondContact O-N 3.39Å; L172-V174 HydrophobicContact CB-CG1 4.44Å; L172-V174 PolarHBondContact O-N 3.48Å |
| 173 | T | 93.3 | Very high | 92.4 | Very high | 36 Ų | 36 | 69.7 Ų | 69.7 | 22% | 0.221 | 38% | 0.377 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -76.2 | 119.8 | 172 | -53.1 | 0 | 0 | 0 | 0 | 108.5 | G90 W91 Q166 Q168 | G90-T173 CarbonylContact C-O 3.58Å; G90-T173 VanDerWaalsContact CA-O 3.3Å; G90-T173 WeakPolarHBondContact CA-O 3.45Å; W91-T173 PolarHBondContact N-O 2.9Å; W91-T173 WeakPolarHBondContact O-CB 3.2Å; W91-T173 VanDerWaalsContact O-CG2 3.26Å; W91-T173 WeakPolarHBondContact O-CG2 3.09Å; Q166-T173 VanDerWaalsContact CD-CG2 3.47Å; Q166-T173 HydrophobicContact CG-CG2 3.48Å; Q166-T173 VanDerWaalsContact CG-CG2 3.48Å; Q168-T173 PolarHBondContact NE2-OG1 3.32Å; Q168-T173 PolarHBondContact OE1-OG1 3.42Å |
| 174 | V | 93.3 | Very high | 92.3 | Very high | 39 Ų | 39 | 73.4 Ų | 73.4 | 24% | 0.236 | 39% | 0.391 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -126.4 | 142.2 | 179.9 | -62.4 | 0 | 0 | 0 | 0 | 111.6 | Q166 S167 L169 L172 | Q166-V174 WeakPolarHBondContact CA-O 3.45Å; S167-V174 PolarHBondContact N-O 3.16Å; S167-V174 PolarHBondContact O-N 3.39Å; L169-V174 HydrophobicContact CB-CG2 4.07Å; L169-V174 HydrophobicContact CD1-CG2 4.05Å; L169-V174 HydrophobicContact CD2-CG2 4.15Å; L169-V174 HydrophobicContact CG-CG2 4.32Å; L172-V174 HydrophobicContact CB-CG1 4.44Å; L172-V174 PolarHBondContact O-N 3.48Å |
| 175 | C | 94.1 | Very high | 92.4 | Very high | 25 Ų | 25 | 76.6 Ų | 76.6 | 17% | 0.169 | 40% | 0.403 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -98.1 | 114.5 | 168.6 | -179.9 | 0 | 0 | 0 | 0 | 108.2 | W91 C98 H102 | W91-C175 HydrophobicContact CB-CB 4.12Å; W91-C175 HydrophobicContact CD2-CB 3.81Å; W91-C175 HydrophobicContact CE3-CB 4.16Å; W91-C175 HydrophobicContact CG-CB 3.78Å; C98-C175 VanDerWaalsContact CA-SG 3.54Å; C98-C175 HydrophobicContact CB-CB 3.85Å; C98-C175 WeakPolarHBondContact CB-SG 3.49Å; C98-C175 WeakPolarHBondContact SG-CB 3.36Å; C98-C175 CovalentContact SG-SG 2.03Å; C98-C175 PolarHBondContact SG-SG 3.3Å; H102-C175 PolarHBondContact CD2-SG 2.87Å |
| 176 | H | 91.8 | Very high | 92.4 | Very high | 56 Ų | 56 | 71.4 Ų | 71.4 | 26% | 0.259 | 39% | 0.394 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -146.8 | 161.1 | -171.9 | 74.8 | -63.2 | 0 | 0 | 0 | 112.9 | R165 S167 A178 | R165-H176 PolarHBondContact N-O 3.48Å; R165-H176 PolarHBondContact O-N 3.41Å; R165-H176 PolarHBondContact O-ND1 3.43Å; S167-H176 PolarHBondContact OG-CE1 3.18Å; S167-H176 PolarHBondContact OG-ND1 3.34Å; H176-A178 PolarHBondContact O-N 2.86Å |
| 177 | P | 92.9 | Very high | 92.4 | Very high | 37 Ų | 37 | 69.6 Ų | 69.6 | 24% | 0.24 | 39% | 0.386 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -62.1 | 111 | 171.5 | -26.2 | 38 | 0 | 0 | 0 | 112.2 | Y163 Y164 R184 | Y163-P177 HydrophobicContact CD1-CB 3.99Å; Y163-P177 HydrophobicContact CD1-CG 4.37Å; Y163-P177 HydrophobicContact CE1-CB 3.34Å; Y163-P177 HydrophobicContact CE1-CG 3.55Å; Y163-P177 WeakPolarHBondContact O-CA 3.46Å; Y164-P177 HydrophobicContact CD1-CG 4.47Å; Y164-P177 HydrophobicContact CE1-CG 3.86Å; P177-R184 HydrophobicContact CB-CG 4.48Å |
| 178 | A | 92 | Very high | 92.5 | Very high | 48 Ų | 48 | 69 Ų | 69 | 40% | 0.397 | 38% | 0.38 | S | S | . | . | trans | -93.7 | -7.5 | -174.5 | 0 | 0 | 0 | 0 | 0 | 114.2 | Y163 R165 H176 | Y163-A178 PolarHBondContact O-N 3.15Å; R165-A178 HydrophobicContact CB-CB 3.71Å; H176-A178 PolarHBondContact O-N 2.86Å | ||
| 179 | W | 94.4 | Very high | 92.6 | Very high | 55 Ų | 55 | 65.6 Ų | 65.6 | 21% | 0.208 | 37% | 0.366 | C | S | . | . | S | Bend | trans | -71.2 | 156.3 | -178.4 | -77.5 | 14.6 | 0 | 0 | 0 | 113.1 | P159 S162 Y163 R183 R184 M187 | P159-W179 HydrophobicContact CB-CH2 3.91Å; S162-W179 VanDerWaalsContact C-NE1 3.34Å; S162-W179 PolarHBondContact O-NE1 2.95Å; S162-W179 VanDerWaalsContact O-NE1 3.11Å; S162-W179 PolarHBondContact OG-NE1 3.45Å; Y163-W179 HydrophobicContact CD2-CB 4.34Å; Y163-W179 AromaticContact CD2-CD2 3.81Å; Y163-W179 HydrophobicContact CD2-CD2 3.81Å; Y163-W179 AromaticContact CD2-CE3 3.67Å; Y163-W179 HydrophobicContact CD2-CE3 3.67Å; Y163-W179 HydrophobicContact CD2-CG 4.12Å; Y163-W179 HydrophobicContact CD2-CZ3 4.29Å; Y163-W179 HydrophobicContact CE2-CE3 4.38Å; Y163-W179 HydrophobicContact CG-CD2 4.45Å; W179-R183 HydrophobicContact CB-CB 4.21Å; W179-R183 HydrophobicContact CD2-CB 4.42Å; W179-R183 HydrophobicContact CE3-CB 3.83Å; W179-R184 HydrophobicContact CB-CG 3.74Å; W179-R184 WeakPolarHBondContact O-CD 3.42Å; W179-R184 WeakPolarHBondContact O-CG 3.28Å; W179-R184 PolarHBondContact O-NE 2.92Å; W179-M187 HydrophobicContact CZ3-CB 4.37Å |
| 180 | S | 94.8 | Very high | 93 | Very high | 49 Ų | 49 | 64.4 Ų | 64.4 | 34% | 0.343 | 36% | 0.364 | S | S | . | . | trans | -61.8 | 151.8 | 174.5 | 61.1 | 0 | 0 | 0 | 0 | 111.2 | P182 R183 R184 | S180-P182 VanDerWaalsContact C-CD 3.49Å; S180-R183 PolarHBondContact O-N 3.44Å; S180-R183 PolarHBondContact OG-NE 3.23Å; S180-R183 PolarHBondContact OG-NH2 3.3Å; S180-R184 PolarHBondContact O-N 3.22Å | ||
| 181 | A | 92.2 | Very high | 93.5 | Very high | 31 Ų | 31 | 60.2 Ų | 60.2 | 26% | 0.256 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -53.1 | -42.6 | -175.5 | 0 | 0 | 0 | 0 | 0 | 114 | R183 R184 R185 W260 | A181-R183 PolarHBondContact O-N 2.63Å; A181-R184 PolarHBondContact O-N 3.47Å; A181-R185 WeakPolarHBondContact O-CB 3.47Å; A181-R185 PolarHBondContact O-N 3.27Å; A181-W260 HydrophobicContact CB-CH2 4.45Å; A181-W260 HydrophobicContact CB-CZ3 4.4Å; A181-W260 WeakPolarHBondContact O-CH2 3.47Å |
| 182 | P | 94.1 | Very high | 93.8 | Very high | 98 Ų | 98 | 54.1 Ų | 54.1 | 64% | 0.636 | 29% | 0.294 | S | S | * | . | H | α-helix | trans | -62.9 | -40.4 | 176.4 | -23 | 34.5 | 0 | 0 | 0 | 113.3 | S180 R185 A186 | S180-P182 VanDerWaalsContact C-CD 3.49Å; P182-R185 PolarHBondContact O-N 2.94Å; P182-A186 WeakPolarHBondContact O-CB 3.3Å; P182-A186 PolarHBondContact O-N 3.46Å |
| 183 | R | 94.9 | Very high | 94.1 | Very high | 144 Ų | 144 | 53 Ų | 53 | 54% | 0.543 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -68.9 | -38 | 177.6 | -74.4 | -174.3 | -75.9 | -174.7 | -6.6 | 111.9 | W179 S180 A181 A186 M187 | W179-R183 HydrophobicContact CB-CB 4.21Å; W179-R183 HydrophobicContact CD2-CB 4.42Å; W179-R183 HydrophobicContact CE3-CB 3.83Å; S180-R183 PolarHBondContact O-N 3.44Å; S180-R183 PolarHBondContact OG-NE 3.23Å; S180-R183 PolarHBondContact OG-NH2 3.3Å; A181-R183 PolarHBondContact O-N 2.63Å; R183-A186 PolarHBondContact O-N 2.72Å; R183-M187 WeakPolarHBondContact O-CB 3.45Å; R183-M187 PolarHBondContact O-N 2.93Å |
| 184 | R | 94.2 | Very high | 94.1 | Very high | 85 Ų | 85 | 54.5 Ų | 54.5 | 32% | 0.321 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -62.1 | -47.9 | 173.8 | -72.7 | -173.2 | -80.3 | 168 | -7.1 | 111.5 | Y163 P177 W179 S180 A181 A186 M187 D188 W260 | Y163-R184 HydrophobicContact CE2-CB 4.16Å; Y163-R184 HydrophobicContact CE2-CG 3.73Å; P177-R184 HydrophobicContact CB-CG 4.48Å; W179-R184 HydrophobicContact CB-CG 3.74Å; W179-R184 WeakPolarHBondContact O-CD 3.42Å; W179-R184 WeakPolarHBondContact O-CG 3.28Å; W179-R184 PolarHBondContact O-NE 2.92Å; S180-R184 PolarHBondContact O-N 3.22Å; A181-R184 PolarHBondContact O-N 3.47Å; R184-A186 VanDerWaalsContact C-N 3.34Å; R184-A186 PolarHBondContact O-N 3.43Å; R184-M187 PolarHBondContact O-N 3.5Å; R184-D188 WeakPolarHBondContact O-CB 3.37Å; R184-D188 VanDerWaalsContact O-CG 3.23Å; R184-D188 PolarHBondContact O-N 3.48Å; R184-W260 HydrophobicContact CB-CH2 3.76Å; R184-W260 HydrophobicContact CB-CZ2 3.66Å |
| 185 | R | 94.6 | Very high | 94 | Very high | 99 Ų | 99 | 52.8 Ų | 52.8 | 37% | 0.374 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -56.3 | -47.6 | 175.3 | -173.2 | 177.7 | -179.2 | -173.4 | 4 | 112 | A181 P182 D188 L189 W260 | A181-R185 WeakPolarHBondContact O-CB 3.47Å; A181-R185 PolarHBondContact O-N 3.27Å; P182-R185 PolarHBondContact O-N 2.94Å; R185-D188 PolarHBondContact O-N 2.95Å; R185-L189 HydrophobicContact CG-CD1 4.07Å; R185-L189 WeakPolarHBondContact O-CB 3.3Å; R185-L189 VanDerWaalsContact O-CG 3.26Å; R185-L189 WeakPolarHBondContact O-CG 3.45Å; R185-L189 PolarHBondContact O-N 3.42Å; R185-W260 HydrophobicContact CB-CD2 3.74Å; R185-W260 HydrophobicContact CB-CE3 3.63Å; R185-W260 HydrophobicContact CB-CG 4.47Å; R185-W260 HydrophobicContact CB-CH2 3.88Å; R185-W260 HydrophobicContact CB-CZ2 3.98Å; R185-W260 HydrophobicContact CB-CZ3 3.7Å; R185-W260 HydrophobicContact CG-CB 4.37Å; R185-W260 HydrophobicContact CG-CD2 3.71Å; R185-W260 HydrophobicContact CG-CE3 3.77Å; R185-W260 HydrophobicContact CG-CG 3.99Å; R185-W260 HydrophobicContact CG-CZ3 4.35Å; R185-W260 VanDerWaalsContact N-CZ2 3.28Å |
| 186 | A | 95.2 | Very high | 93.9 | Very high | 50 Ų | 50 | 53 Ų | 53 | 41% | 0.413 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -59.8 | -46.6 | 177.9 | 0 | 0 | 0 | 0 | 0 | 111.4 | P182 R183 R184 L189 C190 | P182-A186 WeakPolarHBondContact O-CB 3.3Å; P182-A186 PolarHBondContact O-N 3.46Å; R183-A186 PolarHBondContact O-N 2.72Å; R184-A186 VanDerWaalsContact C-N 3.34Å; R184-A186 PolarHBondContact O-N 3.43Å; A186-L189 PolarHBondContact O-N 3.3Å; A186-C190 WeakPolarHBondContact O-CB 3.02Å; A186-C190 PolarHBondContact O-N 2.94Å; A186-C190 PolarHBondContact O-SG 3.09Å |
| 187 | M | 94.6 | Very high | 94 | Very high | 19 Ų | 19 | 54.3 Ų | 54.3 | 9% | 0.094 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -63.1 | -44.8 | 179.5 | -169 | 63.1 | -164.7 | 0 | 0 | 112.6 | F156 P159 Y160 Y163 W179 R183 R184 L189 C190 T191 | F156-M187 WeakPolarHBondContact O-CE 2.97Å; P159-M187 HydrophobicContact CB-CE 3.82Å; P159-M187 HydrophobicContact CB-SD 3.9Å; P159-M187 HydrophobicContact CG-CE 4.1Å; P159-M187 HydrophobicContact CG-SD 4.33Å; Y160-M187 HydrophobicContact CD2-CE 3.6Å; Y160-M187 HydrophobicContact CE1-CE 4.19Å; Y160-M187 HydrophobicContact CE1-CG 4.12Å; Y160-M187 HydrophobicContact CE2-CE 3.17Å; Y160-M187 HydrophobicContact CG-CE 4.28Å; Y163-M187 HydrophobicContact CD2-CB 4.25Å; Y163-M187 HydrophobicContact CD2-CG 4.08Å; Y163-M187 HydrophobicContact CE2-CB 3.96Å; Y163-M187 HydrophobicContact CE2-CG 4.1Å; W179-M187 HydrophobicContact CZ3-CB 4.37Å; R183-M187 WeakPolarHBondContact O-CB 3.45Å; R183-M187 PolarHBondContact O-N 2.93Å; R184-M187 PolarHBondContact O-N 3.5Å; M187-L189 VanDerWaalsContact C-N 3.33Å; M187-L189 PolarHBondContact O-N 3.3Å; M187-C190 PolarHBondContact O-N 3.05Å; M187-T191 WeakPolarHBondContact O-CB 3.06Å; M187-T191 PolarHBondContact O-N 3.36Å; M187-T191 PolarHBondContact O-OG1 3.37Å |
| 188 | D | 93.4 | Very high | 94 | Very high | 24 Ų | 24 | 56.3 Ų | 56.3 | 13% | 0.128 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -66.3 | -36.9 | 179.6 | -65.3 | -8.1 | 0 | 0 | 0 | 111.4 | Y163 R184 R185 T191 F192 I256 W260 | Y163-D188 PolarHBondContact OH-OD1 3.29Å; Y163-D188 VanDerWaalsContact OH-OD1 3.09Å; R184-D188 WeakPolarHBondContact O-CB 3.37Å; R184-D188 VanDerWaalsContact O-CG 3.23Å; R184-D188 PolarHBondContact O-N 3.48Å; R185-D188 PolarHBondContact O-N 2.95Å; D188-T191 PolarHBondContact O-N 2.97Å; D188-F192 PolarHBondContact O-N 2.99Å; D188-I256 HydrophobicContact CB-CG2 3.82Å; D188-W260 PolarHBondContact OD2-NE1 3.32Å |
| 189 | L | 95.2 | Very high | 94 | Very high | 52 Ų | 52 | 54.1 Ų | 54.1 | 27% | 0.272 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -67.4 | -45.8 | 173.2 | -77.5 | 176.7 | 0 | 0 | 0 | 112.6 | R185 A186 M187 T191 F192 V193 L257 F261 | R185-L189 HydrophobicContact CG-CD1 4.07Å; R185-L189 WeakPolarHBondContact O-CB 3.3Å; R185-L189 VanDerWaalsContact O-CG 3.26Å; R185-L189 WeakPolarHBondContact O-CG 3.45Å; R185-L189 PolarHBondContact O-N 3.42Å; A186-L189 PolarHBondContact O-N 3.3Å; M187-L189 VanDerWaalsContact C-N 3.33Å; M187-L189 PolarHBondContact O-N 3.3Å; L189-T191 PolarHBondContact O-N 3.22Å; L189-F192 WeakPolarHBondContact O-CB 3.42Å; L189-F192 PolarHBondContact O-N 2.99Å; L189-V193 WeakPolarHBondContact O-CG2 3.31Å; L189-V193 PolarHBondContact O-N 3.31Å; L189-L257 HydrophobicContact CD2-CD2 3.67Å; L189-F261 HydrophobicContact CD1-CE2 4.37Å; L189-F261 HydrophobicContact CD1-CZ 3.98Å; L189-F261 HydrophobicContact CD2-CE2 3.78Å; L189-F261 HydrophobicContact CD2-CZ 4.01Å; L189-F261 HydrophobicContact CG-CE2 4.43Å; L189-F261 HydrophobicContact CG-CZ 4.5Å |
| 190 | C | 95.3 | Very high | 93.9 | Very high | 61 Ų | 61 | 53.3 Ų | 53.3 | 41% | 0.412 | 28% | 0.28 | S | S | . | . | H | α-helix | trans | -56.7 | -43.6 | 174.1 | -72.7 | 0 | 0 | 0 | 0 | 110.2 | A186 M187 V193 F194 | A186-C190 WeakPolarHBondContact O-CB 3.02Å; A186-C190 PolarHBondContact O-N 2.94Å; A186-C190 PolarHBondContact O-SG 3.09Å; M187-C190 PolarHBondContact O-N 3.05Å; C190-V193 PolarHBondContact O-N 3.07Å; C190-F194 HydrophobicContact CB-CD2 4.33Å; C190-F194 HydrophobicContact CB-CE2 4.47Å; C190-F194 WeakPolarHBondContact O-CD2 3.34Å; C190-F194 PolarHBondContact O-N 3.39Å |
| 191 | T | 94.9 | Very high | 93.8 | Very high | 9 Ų | 9 | 55.6 Ų | 55.6 | 6% | 0.055 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -61.9 | -50.7 | 177.1 | -57.9 | 0 | 0 | 0 | 0 | 110.9 | F106 M109 Y160 M187 D188 L189 V193 F194 S195 | F106-T191 HydrophobicContact CD1-CG2 4.31Å; F106-T191 HydrophobicContact CE1-CG2 4.39Å; M109-T191 HydrophobicContact CE-CG2 3.58Å; Y160-T191 PolarHBondContact OH-OG1 3.47Å; M187-T191 WeakPolarHBondContact O-CB 3.06Å; M187-T191 PolarHBondContact O-N 3.36Å; M187-T191 PolarHBondContact O-OG1 3.37Å; D188-T191 PolarHBondContact O-N 2.97Å; L189-T191 PolarHBondContact O-N 3.22Å; T191-V193 VanDerWaalsContact C-N 3.27Å; T191-V193 PolarHBondContact O-N 3.41Å; T191-F194 PolarHBondContact O-N 3.03Å; T191-S195 WeakPolarHBondContact O-CA 3.16Å; T191-S195 VanDerWaalsContact O-CB 3.22Å; T191-S195 WeakPolarHBondContact O-CB 3.43Å; T191-S195 PolarHBondContact O-N 2.86Å; T191-S195 PolarHBondContact O-OG 3.14Å |
| 192 | F | 95.4 | Very high | 93.8 | Very high | 39 Ų | 39 | 56.3 Ų | 56.3 | 17% | 0.171 | 29% | 0.29 | C | S | . | . | I | π-helix | trans | -52.4 | -43.9 | 173.5 | 169.3 | -112.6 | 0 | 0 | 0 | 113.2 | D188 L189 Y196 L197 H253 L257 | D188-F192 PolarHBondContact O-N 2.99Å; L189-F192 WeakPolarHBondContact O-CB 3.42Å; L189-F192 PolarHBondContact O-N 2.99Å; F192-Y196 HydrophobicContact CD2-CD1 4.04Å; F192-Y196 AromaticContact CE2-CD1 3.59Å; F192-Y196 HydrophobicContact CE2-CD1 3.59Å; F192-Y196 HydrophobicContact CE2-CE1 4.18Å; F192-Y196 WeakPolarHBondContact O-CB 3.26Å; F192-Y196 PolarHBondContact O-N 3.37Å; F192-L197 HydrophobicContact CE1-CD2 4.46Å; F192-L197 PolarHBondContact O-N 3.37Å; F192-H253 HydrophobicContact CD2-CB 3.62Å; F192-H253 AromaticContact CD2-CG 3.71Å; F192-H253 AromaticContact CD2-ND1 3.8Å; F192-H253 HydrophobicContact CE2-CB 4.01Å; F192-L257 HydrophobicContact CD1-CD1 4.35Å; F192-L257 HydrophobicContact CD1-CD2 4.38Å; F192-L257 HydrophobicContact CD2-CD1 4.39Å; F192-L257 HydrophobicContact CE1-CD1 4.03Å; F192-L257 HydrophobicContact CE2-CD1 4.03Å; F192-L257 HydrophobicContact CZ-CD1 3.84Å |
| 193 | V | 95.2 | Very high | 93.6 | Very high | 57 Ų | 57 | 51.9 Ų | 51.9 | 35% | 0.345 | 26% | 0.26 | S | S | . | . | I | π-helix | trans | -67.2 | -52.4 | -179.3 | 171.3 | 0 | 0 | 0 | 0 | 111.4 | L189 C190 T191 L197 L198 | L189-V193 WeakPolarHBondContact O-CG2 3.31Å; L189-V193 PolarHBondContact O-N 3.31Å; C190-V193 PolarHBondContact O-N 3.07Å; T191-V193 VanDerWaalsContact C-N 3.27Å; T191-V193 PolarHBondContact O-N 3.41Å; V193-L197 PolarHBondContact O-N 3.3Å; V193-L198 WeakPolarHBondContact O-CB 3.43Å; V193-L198 PolarHBondContact O-N 2.67Å |
| 194 | F | 92.8 | Very high | 93.3 | Very high | 68 Ų | 68 | 47 Ų | 47 | 30% | 0.298 | 26% | 0.255 | S | S | . | . | I | π-helix | trans | -82.7 | -36.2 | -171.6 | -67.7 | -65.6 | 0 | 0 | 0 | 113.4 | F114 F156 C190 T191 L198 P199 | F114-F194 VanDerWaalsContact CE1-O 3.29Å; F114-F194 WeakPolarHBondContact CE1-O 3.32Å; F156-F194 AromaticContact CD1-CD2 3.92Å; F156-F194 HydrophobicContact CD1-CD2 3.92Å; F156-F194 HydrophobicContact CD1-CE2 4.33Å; F156-F194 HydrophobicContact CD1-CG 4.19Å; F156-F194 AromaticContact CE1-CD1 3.99Å; F156-F194 HydrophobicContact CE1-CD1 3.99Å; F156-F194 AromaticContact CE1-CD2 3.58Å; F156-F194 HydrophobicContact CE1-CD2 3.58Å; F156-F194 HydrophobicContact CE1-CE1 4.04Å; F156-F194 AromaticContact CE1-CE2 3.65Å; F156-F194 HydrophobicContact CE1-CE2 3.65Å; F156-F194 AromaticContact CE1-CG 3.78Å; F156-F194 HydrophobicContact CE1-CG 3.78Å; F156-F194 AromaticContact CE1-CZ 3.89Å; F156-F194 HydrophobicContact CE1-CZ 3.89Å; F156-F194 HydrophobicContact CE2-CD1 4.26Å; F156-F194 HydrophobicContact CE2-CG 4.37Å; F156-F194 AromaticContact CZ-CD1 3.69Å; F156-F194 HydrophobicContact CZ-CD1 3.69Å; F156-F194 HydrophobicContact CZ-CD2 4.15Å; F156-F194 AromaticContact CZ-CE1 3.82Å; F156-F194 HydrophobicContact CZ-CE1 3.82Å; F156-F194 HydrophobicContact CZ-CE2 4.28Å; F156-F194 AromaticContact CZ-CG 3.88Å; F156-F194 HydrophobicContact CZ-CG 3.88Å; F156-F194 HydrophobicContact CZ-CZ 4.12Å; C190-F194 HydrophobicContact CB-CD2 4.33Å; C190-F194 HydrophobicContact CB-CE2 4.47Å; C190-F194 WeakPolarHBondContact O-CD2 3.34Å; C190-F194 PolarHBondContact O-N 3.39Å; T191-F194 PolarHBondContact O-N 3.03Å; F194-L198 HydrophobicContact CD1-CD2 4.17Å; F194-P199 WeakPolarHBondContact O-CD 3.38Å; F194-P199 WeakPolarHBondContact O-CG 3.32Å |
| 195 | S | 91.3 | Very high | 93.1 | Very high | 2 Ų | 2 | 46.5 Ų | 46.5 | 1% | 0.014 | 26% | 0.259 | C | S | . | . | I | π-helix | trans | -85.3 | -21.3 | -178.8 | 81.8 | 0 | 0 | 0 | 0 | 113.4 | M109 S113 T191 H253 | M109-S195 VanDerWaalsContact CE-CB 3.49Å; S113-S195 WeakPolarHBondContact CB-O 3.48Å; S113-S195 PolarHBondContact OG-O 3.43Å; T191-S195 WeakPolarHBondContact O-CA 3.16Å; T191-S195 VanDerWaalsContact O-CB 3.22Å; T191-S195 WeakPolarHBondContact O-CB 3.43Å; T191-S195 PolarHBondContact O-N 2.86Å; T191-S195 PolarHBondContact O-OG 3.14Å; S195-H253 PolarHBondContact OG-CE1 2.89Å; S195-H253 PolarHBondContact OG-NE2 2.89Å |
| 196 | Y | 92.9 | Very high | 92.8 | Very high | 29 Ų | 29 | 42.2 Ų | 42.2 | 11% | 0.114 | 24% | 0.243 | C | C | . | . | I | π-helix | trans | -127.7 | -64.4 | -175.9 | -174.6 | -99.5 | 0 | 0 | 0 | 113.5 | F192 L198 P199 V200 F245 C246 W249 M250 H253 | F192-Y196 HydrophobicContact CD2-CD1 4.04Å; F192-Y196 AromaticContact CE2-CD1 3.59Å; F192-Y196 HydrophobicContact CE2-CD1 3.59Å; F192-Y196 HydrophobicContact CE2-CE1 4.18Å; F192-Y196 WeakPolarHBondContact O-CB 3.26Å; F192-Y196 PolarHBondContact O-N 3.37Å; Y196-L198 PolarHBondContact O-N 2.87Å; Y196-P199 WeakPolarHBondContact O-CD 3.48Å; Y196-V200 HydrophobicContact CD1-CG2 4.35Å; Y196-V200 HydrophobicContact CD2-CG2 4.01Å; Y196-V200 HydrophobicContact CE1-CG2 4.21Å; Y196-V200 HydrophobicContact CE2-CG2 3.87Å; Y196-V200 HydrophobicContact CG-CG2 4.25Å; Y196-V200 VanDerWaalsContact O-CB 3.28Å; Y196-V200 WeakPolarHBondContact O-CB 3.46Å; Y196-V200 WeakPolarHBondContact O-CG2 3.32Å; Y196-V200 PolarHBondContact O-N 3.43Å; Y196-F245 HydrophobicContact CD2-CE1 4.44Å; Y196-C246 PolarHBondContact OH-O 3.24Å; Y196-W249 HydrophobicContact CD2-CB 3.67Å; Y196-W249 HydrophobicContact CE2-CB 3.78Å; Y196-M250 WeakPolarHBondContact OH-CB 3.03Å; Y196-H253 VanDerWaalsContact CB-CD2 3.46Å; Y196-H253 WeakPolarHBondContact CB-CD2 3.08Å; Y196-H253 WeakPolarHBondContact CB-NE2 3.33Å; Y196-H253 AromaticContact CD2-CD2 3.68Å; Y196-H253 AromaticContact CG-CD2 3.52Å |
| 197 | L | 94.3 | Very high | 92.2 | Very high | 85 Ų | 85 | 40.8 Ų | 40.8 | 45% | 0.445 | 23% | 0.228 | S | C | . | . | I | π-helix | trans | -60.5 | -48.8 | -170.3 | -176.3 | 61.8 | 0 | 0 | 0 | 113.1 | F192 V193 V200 L201 | F192-L197 HydrophobicContact CE1-CD2 4.46Å; F192-L197 PolarHBondContact O-N 3.37Å; V193-L197 PolarHBondContact O-N 3.3Å; L197-V200 PolarHBondContact O-N 3.43Å; L197-L201 VanDerWaalsContact O-CB 3.31Å; L197-L201 WeakPolarHBondContact O-CB 3.27Å; L197-L201 PolarHBondContact O-N 3.47Å |
| 198 | L | 93.3 | Very high | 91.8 | Very high | 78 Ų | 78 | 42 Ų | 42 | 41% | 0.408 | 24% | 0.24 | S | C | . | . | H | α-helix | trans | -62.6 | -52.3 | 179.3 | 169.8 | 73.1 | 0 | 0 | 0 | 111.6 | V193 F194 Y196 V200 L201 V202 | V193-L198 WeakPolarHBondContact O-CB 3.43Å; V193-L198 PolarHBondContact O-N 2.67Å; F194-L198 HydrophobicContact CD1-CD2 4.17Å; Y196-L198 PolarHBondContact O-N 2.87Å; L198-V200 PolarHBondContact O-N 3.23Å; L198-L201 PolarHBondContact O-N 2.93Å; L198-V202 HydrophobicContact CD1-CG2 4.48Å; L198-V202 WeakPolarHBondContact O-CG2 3.31Å; L198-V202 PolarHBondContact O-N 3.19Å |
| 199 | P | 91.9 | Very high | 91.4 | Very high | 2 Ų | 2 | 46 Ų | 46 | 1% | 0.013 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -53.9 | -48.2 | 172.5 | -30 | 35.8 | 0 | 0 | 0 | 113.2 | S113 F114 F194 Y196 L201 V202 L203 F245 | S113-P199 VanDerWaalsContact OG-CB 3.22Å; S113-P199 WeakPolarHBondContact OG-CB 3.32Å; S113-P199 WeakPolarHBondContact OG-CG 3.43Å; F114-P199 HydrophobicContact CD1-CG 4.4Å; F194-P199 WeakPolarHBondContact O-CD 3.38Å; F194-P199 WeakPolarHBondContact O-CG 3.32Å; Y196-P199 WeakPolarHBondContact O-CD 3.48Å; P199-L201 VanDerWaalsContact C-N 3.31Å; P199-L201 PolarHBondContact O-N 3.13Å; P199-V202 PolarHBondContact O-N 3.13Å; P199-L203 WeakPolarHBondContact O-CB 3.28Å; P199-L203 WeakPolarHBondContact O-CD1 3.15Å; P199-L203 PolarHBondContact O-N 3.5Å; P199-F245 HydrophobicContact CB-CE1 4.48Å |
| 200 | V | 91.7 | Very high | 90.8 | Very high | 38 Ų | 38 | 43.7 Ų | 43.7 | 23% | 0.23 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -61.3 | -39.7 | 178.6 | 171.1 | 0 | 0 | 0 | 0 | 111.5 | Y196 L197 L198 L203 G204 F245 | Y196-V200 HydrophobicContact CD1-CG2 4.35Å; Y196-V200 HydrophobicContact CD2-CG2 4.01Å; Y196-V200 HydrophobicContact CE1-CG2 4.21Å; Y196-V200 HydrophobicContact CE2-CG2 3.87Å; Y196-V200 HydrophobicContact CG-CG2 4.25Å; Y196-V200 VanDerWaalsContact O-CB 3.28Å; Y196-V200 WeakPolarHBondContact O-CB 3.46Å; Y196-V200 WeakPolarHBondContact O-CG2 3.32Å; Y196-V200 PolarHBondContact O-N 3.43Å; L197-V200 PolarHBondContact O-N 3.43Å; L198-V200 PolarHBondContact O-N 3.23Å; V200-L203 PolarHBondContact O-N 2.91Å; V200-G204 PolarHBondContact O-N 2.94Å; V200-F245 HydrophobicContact CG2-CE1 4.35Å |
| 201 | L | 93.1 | Very high | 90 | Very high | 98 Ų | 98 | 44.2 Ų | 44.2 | 51% | 0.513 | 24% | 0.24 | S | C | . | . | H | α-helix | trans | -64.2 | -46.5 | 175.6 | -178.6 | 65.3 | 0 | 0 | 0 | 111.3 | L197 L198 P199 L203 G204 L205 | L197-L201 VanDerWaalsContact O-CB 3.31Å; L197-L201 WeakPolarHBondContact O-CB 3.27Å; L197-L201 PolarHBondContact O-N 3.47Å; L198-L201 PolarHBondContact O-N 2.93Å; P199-L201 VanDerWaalsContact C-N 3.31Å; P199-L201 PolarHBondContact O-N 3.13Å; L201-L203 PolarHBondContact O-N 2.83Å; L201-G204 PolarHBondContact O-N 3.06Å; L201-L205 HydrophobicContact CD1-CD1 3.85Å; L201-L205 HydrophobicContact CD1-CG 3.98Å; L201-L205 HydrophobicContact CG-CD1 3.85Å; L201-L205 HydrophobicContact CG-CG 4.33Å; L201-L205 VanDerWaalsContact O-CB 3.26Å; L201-L205 WeakPolarHBondContact O-CB 3.42Å; L201-L205 VanDerWaalsContact O-CG 3.22Å; L201-L205 WeakPolarHBondContact O-CG 3.44Å; L201-L205 PolarHBondContact O-N 2.71Å |
| 202 | V | 92.1 | Very high | 89.4 | Confident | 46 Ų | 46 | 50.1 Ų | 50.1 | 28% | 0.279 | 26% | 0.261 | S | S | . | . | H | α-helix | trans | -59.8 | -47.3 | 176.1 | 173.1 | 0 | 0 | 0 | 0 | 110.4 | A117 L198 P199 T206 | A117-V202 HydrophobicContact CB-CB 4.34Å; A117-V202 HydrophobicContact CB-CG1 4.07Å; L198-V202 HydrophobicContact CD1-CG2 4.48Å; L198-V202 WeakPolarHBondContact O-CG2 3.31Å; L198-V202 PolarHBondContact O-N 3.19Å; P199-V202 PolarHBondContact O-N 3.13Å; V202-T206 HydrophobicContact CG1-CG2 4.23Å; V202-T206 VanDerWaalsContact O-CB 3.3Å; V202-T206 WeakPolarHBondContact O-CB 3.43Å; V202-T206 VanDerWaalsContact O-CG2 3.24Å; V202-T206 WeakPolarHBondContact O-CG2 3.07Å; V202-T206 PolarHBondContact O-N 3.28Å; V202-T206 PolarHBondContact O-OG1 2.97Å |
| 203 | L | 89.1 | Confident | 88.6 | Confident | 4 Ų | 4 | 52.1 Ų | 52.1 | 2% | 0.021 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -56.3 | -56.3 | 175.2 | -92.5 | 56.9 | 0 | 0 | 0 | 110.7 | A117 P199 V200 L201 L205 T206 Y207 A242 F245 | A117-L203 VanDerWaalsContact CA-CD1 3.5Å; A117-L203 HydrophobicContact CB-CD1 4.03Å; P199-L203 WeakPolarHBondContact O-CB 3.28Å; P199-L203 WeakPolarHBondContact O-CD1 3.15Å; P199-L203 PolarHBondContact O-N 3.5Å; V200-L203 PolarHBondContact O-N 2.91Å; L201-L203 PolarHBondContact O-N 2.83Å; L203-L205 PolarHBondContact O-N 3.28Å; L203-T206 PolarHBondContact O-N 3.46Å; L203-T206 PolarHBondContact O-OG1 2.63Å; L203-T206 VanDerWaalsContact O-OG1 3.07Å; L203-Y207 HydrophobicContact CB-CD2 4.22Å; L203-Y207 HydrophobicContact CB-CE2 3.96Å; L203-Y207 HydrophobicContact CG-CE2 3.89Å; L203-Y207 VanDerWaalsContact O-CB 3.3Å; L203-Y207 WeakPolarHBondContact O-CB 3.05Å; L203-Y207 WeakPolarHBondContact O-CD2 3.27Å; L203-Y207 VanDerWaalsContact O-CG 3.24Å; L203-Y207 PolarHBondContact O-N 2.9Å; L203-A242 HydrophobicContact CD2-CB 3.55Å; L203-A242 HydrophobicContact CG-CB 4.06Å; L203-F245 HydrophobicContact CD2-CD1 4.37Å |
| 204 | G | 88.5 | Confident | 87.7 | Confident | 43 Ų | 43 | 51 Ų | 51 | 44% | 0.443 | 26% | 0.26 | S | S | . | . | H | α-helix | trans | -57.4 | -47.2 | -178.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | V200 L201 A208 | V200-G204 PolarHBondContact O-N 2.94Å; L201-G204 PolarHBondContact O-N 3.06Å; G204-A208 WeakPolarHBondContact O-CB 3.44Å; G204-A208 PolarHBondContact O-N 3.43Å |
| 205 | L | 90.1 | Very high | 86.7 | Confident | 74 Ų | 74 | 57.3 Ų | 57.3 | 39% | 0.387 | 28% | 0.282 | S | S | . | . | H | α-helix | trans | -67.3 | -46.6 | 179.9 | -72.3 | 178.4 | 0 | 0 | 0 | 112.7 | L201 L203 Y207 R209 | L201-L205 HydrophobicContact CD1-CD1 3.85Å; L201-L205 HydrophobicContact CD1-CG 3.98Å; L201-L205 HydrophobicContact CG-CD1 3.85Å; L201-L205 HydrophobicContact CG-CG 4.33Å; L201-L205 VanDerWaalsContact O-CB 3.26Å; L201-L205 WeakPolarHBondContact O-CB 3.42Å; L201-L205 VanDerWaalsContact O-CG 3.22Å; L201-L205 WeakPolarHBondContact O-CG 3.44Å; L201-L205 PolarHBondContact O-N 2.71Å; L203-L205 PolarHBondContact O-N 3.28Å; L205-Y207 VanDerWaalsContact C-N 3.33Å; L205-Y207 PolarHBondContact O-N 2.88Å; L205-R209 WeakPolarHBondContact O-CB 3.24Å; L205-R209 VanDerWaalsContact O-CG 3.31Å; L205-R209 WeakPolarHBondContact O-CG 3.3Å; L205-R209 PolarHBondContact O-N 3.38Å |
| 206 | T | 88.5 | Confident | 85.9 | Confident | 9 Ų | 9 | 67.1 Ų | 67.1 | 6% | 0.055 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -64.8 | -38.9 | 180 | 52.1 | 0 | 0 | 0 | 0 | 111.3 | S120 L121 Y124 V202 L203 T210 | S120-T206 WeakPolarHBondContact CB-OG1 3.23Å; S120-T206 PolarHBondContact OG-OG1 2.87Å; L121-T206 HydrophobicContact CD1-CG2 4.3Å; Y124-T206 HydrophobicContact CG-CG2 4.45Å; V202-T206 HydrophobicContact CG1-CG2 4.23Å; V202-T206 VanDerWaalsContact O-CB 3.3Å; V202-T206 WeakPolarHBondContact O-CB 3.43Å; V202-T206 VanDerWaalsContact O-CG2 3.24Å; V202-T206 WeakPolarHBondContact O-CG2 3.07Å; V202-T206 PolarHBondContact O-N 3.28Å; V202-T206 PolarHBondContact O-OG1 2.97Å; L203-T206 PolarHBondContact O-N 3.46Å; L203-T206 PolarHBondContact O-OG1 2.63Å; L203-T206 VanDerWaalsContact O-OG1 3.07Å; T206-T210 WeakPolarHBondContact O-CB 3.34Å; T206-T210 PolarHBondContact O-N 2.93Å; T206-T210 PolarHBondContact O-OG1 3.48Å |
| 207 | Y | 83.4 | Confident | 84.6 | Confident | 20 Ų | 20 | 67.8 Ų | 67.8 | 8% | 0.078 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -75.7 | -41.5 | 177.4 | -66.1 | -39.9 | 0 | 0 | 0 | 113.9 | S120 L203 L205 R209 T210 L211 I238 L239 A242 | S120-Y207 VanDerWaalsContact CB-OH 3.32Å; S120-Y207 WeakPolarHBondContact CB-OH 3.3Å; L203-Y207 HydrophobicContact CB-CD2 4.22Å; L203-Y207 HydrophobicContact CB-CE2 3.96Å; L203-Y207 HydrophobicContact CG-CE2 3.89Å; L203-Y207 VanDerWaalsContact O-CB 3.3Å; L203-Y207 WeakPolarHBondContact O-CB 3.05Å; L203-Y207 WeakPolarHBondContact O-CD2 3.27Å; L203-Y207 VanDerWaalsContact O-CG 3.24Å; L203-Y207 PolarHBondContact O-N 2.9Å; L205-Y207 VanDerWaalsContact C-N 3.33Å; L205-Y207 PolarHBondContact O-N 2.88Å; Y207-R209 PolarHBondContact O-N 3.24Å; Y207-T210 PolarHBondContact O-N 3.2Å; Y207-T210 VanDerWaalsContact O-N 3.11Å; Y207-L211 WeakPolarHBondContact O-CB 3.19Å; Y207-L211 WeakPolarHBondContact O-CG 3.3Å; Y207-L211 PolarHBondContact O-N 2.86Å; Y207-I238 HydrophobicContact CE1-CG2 4.12Å; Y207-I238 WeakPolarHBondContact OH-CG2 3.44Å; Y207-I238 PolarHBondContact OH-O 3.48Å; Y207-L239 HydrophobicContact CD1-CD2 3.32Å; Y207-L239 HydrophobicContact CD1-CG 4.07Å; Y207-L239 HydrophobicContact CD2-CD2 3.52Å; Y207-L239 HydrophobicContact CE1-CD2 3.83Å; Y207-L239 HydrophobicContact CE1-CG 4.25Å; Y207-L239 HydrophobicContact CE2-CD2 4.02Å; Y207-L239 HydrophobicContact CG-CD2 3.15Å; Y207-L239 HydrophobicContact CG-CG 4.34Å; Y207-A242 HydrophobicContact CD2-CB 4.43Å; Y207-A242 HydrophobicContact CE2-CB 3.37Å |
| 208 | A | 85 | Confident | 82.8 | Confident | 44 Ų | 44 | 66.4 Ų | 66.4 | 36% | 0.364 | 33% | 0.325 | S | S | . | . | H | α-helix | trans | -58.8 | -39.1 | 174 | 0 | 0 | 0 | 0 | 0 | 111.1 | G204 R212 | G204-A208 WeakPolarHBondContact O-CB 3.44Å; G204-A208 PolarHBondContact O-N 3.43Å; A208-R212 WeakPolarHBondContact O-CB 3.43Å; A208-R212 VanDerWaalsContact O-CG 3.26Å; A208-R212 WeakPolarHBondContact O-CG 3.45Å; A208-R212 PolarHBondContact O-N 2.94Å; A208-R212 PolarHBondContact O-NE 2.61Å |
| 209 | R | 86 | Confident | 80.8 | Confident | 109 Ų | 109 | 68.6 Ų | 68.6 | 41% | 0.411 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -68.7 | -41.7 | 173.4 | -71.4 | -176.2 | 177.3 | 105 | -1.8 | 112.4 | Y124 L205 Y207 Y213 | Y124-R209 HydrophobicContact CD2-CB 4.19Å; Y124-R209 HydrophobicContact CE2-CB 3.53Å; L205-R209 WeakPolarHBondContact O-CB 3.24Å; L205-R209 VanDerWaalsContact O-CG 3.31Å; L205-R209 WeakPolarHBondContact O-CG 3.3Å; L205-R209 PolarHBondContact O-N 3.38Å; Y207-R209 PolarHBondContact O-N 3.24Å; R209-Y213 WeakPolarHBondContact O-CB 3.18Å; R209-Y213 PolarHBondContact O-N 2.96Å |
| 210 | T | 81.1 | Confident | 79 | Confident | 2 Ų | 2 | 73.9 Ų | 73.9 | 1% | 0.012 | 37% | 0.371 | C | S | . | . | H | α-helix | trans | -62.3 | -46.6 | 177.4 | -60.3 | 0 | 0 | 0 | 0 | 111.7 | I127 T206 Y207 Y213 L214 T235 | I127-T210 HydrophobicContact CD1-CG2 3.55Å; I127-T210 HydrophobicContact CG2-CG2 4.34Å; T206-T210 WeakPolarHBondContact O-CB 3.34Å; T206-T210 PolarHBondContact O-N 2.93Å; T206-T210 PolarHBondContact O-OG1 3.48Å; Y207-T210 PolarHBondContact O-N 3.2Å; Y207-T210 VanDerWaalsContact O-N 3.11Å; T210-Y213 PolarHBondContact O-N 3.42Å; T210-L214 HydrophobicContact CG2-CD1 4.04Å; T210-L214 WeakPolarHBondContact O-CB 3.08Å; T210-L214 VanDerWaalsContact O-CG 3.3Å; T210-L214 WeakPolarHBondContact O-CG 3.43Å; T210-L214 PolarHBondContact O-N 2.96Å; T210-T235 HydrophobicContact CG2-CG2 3.86Å |
| 211 | L | 80 | Confident | 77.1 | Confident | 73 Ų | 73 | 78.9 Ų | 78.9 | 38% | 0.382 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -63.4 | -51.8 | 177.4 | -71.9 | 168.6 | 0 | 0 | 0 | 110.2 | Y207 Y213 L214 W215 L239 | Y207-L211 WeakPolarHBondContact O-CB 3.19Å; Y207-L211 WeakPolarHBondContact O-CG 3.3Å; Y207-L211 PolarHBondContact O-N 2.86Å; L211-Y213 VanDerWaalsContact C-N 3.26Å; L211-Y213 PolarHBondContact O-N 3.48Å; L211-L214 CarbonylContact O-C 3.28Å; L211-L214 PolarHBondContact O-N 3.39Å; L211-W215 PolarHBondContact O-N 3.27Å; L211-L239 HydrophobicContact CD2-CD1 4.37Å |
| 212 | R | 82.8 | Confident | 75.2 | Confident | 133 Ų | 133 | 77.2 Ų | 77.2 | 50% | 0.502 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -54.1 | -42 | 177 | -77 | -175.7 | -68.8 | 165.5 | -7.9 | 113 | A208 W215 R216 | A208-R212 WeakPolarHBondContact O-CB 3.43Å; A208-R212 VanDerWaalsContact O-CG 3.26Å; A208-R212 WeakPolarHBondContact O-CG 3.45Å; A208-R212 PolarHBondContact O-N 2.94Å; A208-R212 PolarHBondContact O-NE 2.61Å; R212-W215 PolarHBondContact O-N 2.84Å; R212-R216 WeakPolarHBondContact O-CB 3.48Å; R212-R216 WeakPolarHBondContact O-CG 3.32Å; R212-R216 PolarHBondContact O-N 3.35Å |
| 213 | Y | 78.7 | Confident | 73.3 | Confident | 81 Ų | 81 | 79.6 Ų | 79.6 | 32% | 0.318 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -64.1 | -46.5 | 175.1 | 177.2 | -99.6 | 0 | 0 | 0 | 112 | I127 R209 T210 L211 W215 R216 A217 | I127-Y213 HydrophobicContact CG2-CD1 3.72Å; I127-Y213 HydrophobicContact CG2-CE1 3.95Å; R209-Y213 WeakPolarHBondContact O-CB 3.18Å; R209-Y213 PolarHBondContact O-N 2.96Å; T210-Y213 PolarHBondContact O-N 3.42Å; L211-Y213 VanDerWaalsContact C-N 3.26Å; L211-Y213 PolarHBondContact O-N 3.48Å; Y213-W215 PolarHBondContact O-N 3.21Å; Y213-R216 PolarHBondContact O-N 3.32Å; Y213-A217 HydrophobicContact CE1-CB 4.38Å; Y213-A217 WeakPolarHBondContact O-CB 3.47Å; Y213-A217 PolarHBondContact O-N 2.88Å |
| 214 | L | 74.4 | Confident | 71.6 | Confident | 33 Ų | 33 | 83.2 Ų | 83.2 | 17% | 0.173 | 47% | 0.465 | C | S | . | . | H | α-helix | trans | -64.3 | -28.4 | 177.8 | -73.6 | 174.3 | 0 | 0 | 0 | 113.2 | I127 T210 L211 V218 R232 | I127-L214 HydrophobicContact CG2-CD2 4.42Å; T210-L214 HydrophobicContact CG2-CD1 4.04Å; T210-L214 WeakPolarHBondContact O-CB 3.08Å; T210-L214 VanDerWaalsContact O-CG 3.3Å; T210-L214 WeakPolarHBondContact O-CG 3.43Å; T210-L214 PolarHBondContact O-N 2.96Å; L211-L214 CarbonylContact O-C 3.28Å; L211-L214 PolarHBondContact O-N 3.39Å; L214-V218 WeakPolarHBondContact O-CG2 3.2Å; L214-R232 HydrophobicContact CD2-CG 4.39Å |
| 215 | W | 73.4 | Confident | 70.4 | Confident | 201 Ų | 201 | 83.8 Ų | 83.8 | 76% | 0.761 | 46% | 0.462 | S | S | * | . | H | α-helix | trans | -79.2 | -41.2 | 176.8 | -76.1 | 56.3 | 0 | 0 | 0 | 111.4 | L211 R212 Y213 V218 | L211-W215 PolarHBondContact O-N 3.27Å; R212-W215 PolarHBondContact O-N 2.84Å; Y213-W215 PolarHBondContact O-N 3.21Å; W215-V218 PolarHBondContact O-N 3.04Å |
| 216 | R | 73.8 | Confident | 69.1 | Low | 208 Ų | 208 | 83.1 Ų | 83.1 | 79% | 0.785 | 47% | 0.473 | S | S | * | . | H | α-helix | trans | -73.7 | -30.1 | 176.9 | -70.5 | -178.4 | -179 | 174.4 | -2.4 | 114 | R212 Y213 V218 | R212-R216 WeakPolarHBondContact O-CB 3.48Å; R212-R216 WeakPolarHBondContact O-CG 3.32Å; R212-R216 PolarHBondContact O-N 3.35Å; Y213-R216 PolarHBondContact O-N 3.32Å; R216-V218 PolarHBondContact O-N 3.2Å |
| 217 | A | 66 | Low | 67.7 | Low | 42 Ų | 42 | 85.8 Ų | 85.8 | 35% | 0.347 | 50% | 0.496 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -83.5 | 6.1 | 178 | 0 | 0 | 0 | 0 | 0 | 113.1 | Y213 | Y213-A217 HydrophobicContact CE1-CB 4.38Å; Y213-A217 WeakPolarHBondContact O-CB 3.47Å; Y213-A217 PolarHBondContact O-N 2.88Å |
| 218 | V | 56.7 | Low | 66.9 | Low | 57 Ų | 57 | 91.2 Ų | 91.2 | 35% | 0.345 | 52% | 0.517 | S | S | . | . | trans | -109 | 90.8 | 176.3 | 176.3 | 0 | 0 | 0 | 0 | 108.7 | L214 W215 R216 | L214-V218 WeakPolarHBondContact O-CG2 3.2Å; W215-V218 PolarHBondContact O-N 3.04Å; R216-V218 PolarHBondContact O-N 3.2Å | ||
| 219 | D | 51.8 | Low | 66 | Low | 123 Ų | 123 | 99 Ų | 99 | 66% | 0.658 | 54% | 0.537 | S | S | * | . | trans | -73.2 | 132.5 | 141.4 | -68.6 | -48.8 | 0 | 0 | 0 | 107.8 | V221 A222 | D219-V221 PolarHBondContact O-N 2.88Å; D219-A222 PolarHBondContact O-N 3.23Å | ||
| 220 | P | 53.1 | Low | 64.9 | Low | 113 Ų | 113 | 96.5 Ų | 96.5 | 73% | 0.734 | 54% | 0.539 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -56 | -17.2 | -179.1 | -24.3 | 32.2 | 0 | 0 | 0 | 114.4 | ||
| 221 | V | 51.2 | Low | 64.3 | Low | 143 Ų | 143 | 102.1 Ų | 102.1 | 87% | 0.867 | 56% | 0.564 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87.1 | -17 | -171.4 | -173.5 | 0 | 0 | 0 | 0 | 113.1 | D219 | D219-V221 PolarHBondContact O-N 2.88Š|
| 222 | A | 53.1 | Low | 63.8 | Low | 63 Ų | 63 | 104.1 Ų | 104.1 | 52% | 0.521 | 57% | 0.566 | S | S | . | * | trans | -103 | 32.7 | -175.1 | 0 | 0 | 0 | 0 | 0 | 114.6 | D219 G224 | D219-A222 PolarHBondContact O-N 3.23Å; A222-G224 PolarHBondContact O-N 2.91Å | ||
| 223 | A | 53.6 | Low | 63.4 | Low | 97 Ų | 97 | 101.5 Ų | 101.5 | 80% | 0.802 | 56% | 0.558 | S | S | * | * | trans | -78.5 | 29 | -175.4 | 0 | 0 | 0 | 0 | 0 | 115 | ||||
| 224 | G | 53.2 | Low | 63 | Low | 79 Ų | 79 | 100.2 Ų | 100.2 | 81% | 0.814 | 56% | 0.559 | S | S | * | * | trans | -92.4 | -2 | -162.5 | 0 | 0 | 0 | 0 | 0 | 119.3 | A222 | A222-G224 PolarHBondContact O-N 2.91Š| ||
| 225 | S | 61.8 | Low | 62.8 | Low | 55 Ų | 55 | 99 Ų | 99 | 39% | 0.385 | 55% | 0.553 | S | S | . | * | trans | -119.5 | 121.1 | -176.9 | 81 | 0 | 0 | 0 | 0 | 114.9 | A227 R228 R229 | S225-A227 PolarHBondContact O-N 3.41Å; S225-A227 VanDerWaalsContact O-N 3.11Å; S225-R228 PolarHBondContact O-N 3.33Å; S225-R228 WeakPolarHBondContact OG-CG 3.2Å; S225-R229 PolarHBondContact O-N 2.94Å | ||
| 226 | G | 63.4 | Low | 63 | Low | 61 Ų | 61 | 97.7 Ų | 97.7 | 63% | 0.629 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -55.1 | -28.4 | 175.4 | 0 | 0 | 0 | 0 | 0 | 113.5 | R229 A230 | G226-R229 PolarHBondContact O-N 3.3Å; G226-A230 WeakPolarHBondContact O-CB 3.28Å; G226-A230 PolarHBondContact O-N 3.06Å |
| 227 | A | 60.5 | Low | 63.2 | Low | 65 Ų | 65 | 88.2 Ų | 88.2 | 54% | 0.537 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -64.2 | -40.4 | 173.8 | 0 | 0 | 0 | 0 | 0 | 113.1 | S225 A230 K231 | S225-A227 PolarHBondContact O-N 3.41Å; S225-A227 VanDerWaalsContact O-N 3.11Å; A227-A230 PolarHBondContact O-N 3.35Å; A227-K231 WeakPolarHBondContact O-CG 3.38Å; A227-K231 PolarHBondContact O-N 3.09Å |
| 228 | R | 65.4 | Low | 63.7 | Low | 134 Ų | 134 | 86.7 Ų | 86.7 | 51% | 0.506 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -66 | -40.2 | 174.9 | -82.2 | 178.1 | 172.7 | -166.8 | -3.3 | 111.4 | S225 K231 R232 | S225-R228 PolarHBondContact O-N 3.33Å; S225-R228 WeakPolarHBondContact OG-CG 3.2Å; R228-K231 PolarHBondContact O-N 2.83Å; R228-R232 PolarHBondContact O-N 3.34Å; R228-R232 VanDerWaalsContact O-N 3.07Å |
| 229 | R | 67.1 | Low | 64.7 | Low | 207 Ų | 207 | 86 Ų | 86 | 78% | 0.781 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -64 | -41.8 | 175.9 | -172.4 | 176 | -178.5 | 179.3 | 2.1 | 112.1 | S225 G226 K233 | S225-R229 PolarHBondContact O-N 2.94Å; G226-R229 PolarHBondContact O-N 3.3Å; R229-K233 PolarHBondContact O-N 3.3Å; R229-K233 VanDerWaalsContact O-N 3.17Å |
| 230 | A | 62.9 | Low | 66.3 | Low | 56 Ų | 56 | 82.9 Ų | 82.9 | 46% | 0.463 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -63.6 | -44.6 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | G226 A227 K233 V234 | G226-A230 WeakPolarHBondContact O-CB 3.28Å; G226-A230 PolarHBondContact O-N 3.06Å; A227-A230 PolarHBondContact O-N 3.35Å; A230-K233 PolarHBondContact O-N 3.31Å; A230-V234 PolarHBondContact O-N 3.43Å |
| 231 | K | 67.1 | Low | 67.7 | Low | 121 Ų | 121 | 77.7 Ų | 77.7 | 53% | 0.526 | 44% | 0.441 | S | S | . | . | H | α-helix | trans | -58.7 | -47.9 | 175.6 | -75.5 | -177 | 179.9 | -172.7 | 0 | 112.1 | A227 R228 K233 V234 T235 | A227-K231 WeakPolarHBondContact O-CG 3.38Å; A227-K231 PolarHBondContact O-N 3.09Å; R228-K231 PolarHBondContact O-N 2.83Å; K231-K233 VanDerWaalsContact C-N 3.26Å; K231-K233 PolarHBondContact O-N 3.32Å; K231-V234 PolarHBondContact O-N 3.39Å; K231-T235 PolarHBondContact O-N 2.97Å; K231-T235 PolarHBondContact O-OG1 3.46Å; K231-T235 VanDerWaalsContact O-OG1 3.04Å |
| 232 | R | 71 | Confident | 69 | Low | 115 Ų | 115 | 71 Ų | 71 | 43% | 0.434 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -57 | -39.4 | 176.3 | -75 | -175.1 | -171.3 | -155.9 | 0.4 | 113.1 | L214 R228 T235 R236 | L214-R232 HydrophobicContact CD2-CG 4.39Å; R228-R232 PolarHBondContact O-N 3.34Å; R228-R232 VanDerWaalsContact O-N 3.07Å; R232-T235 PolarHBondContact O-N 3.31Å; R232-R236 WeakPolarHBondContact O-CB 3.28Å; R232-R236 PolarHBondContact O-N 3.48Å |
| 233 | K | 73.3 | Confident | 70.6 | Confident | 77 Ų | 77 | 70.5 Ų | 70.5 | 34% | 0.335 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -66 | -41.9 | -179.4 | -174.5 | 171 | 177.5 | 175.8 | 0 | 112 | R229 A230 K231 R236 M237 V295 | R229-K233 PolarHBondContact O-N 3.3Å; R229-K233 VanDerWaalsContact O-N 3.17Å; A230-K233 PolarHBondContact O-N 3.31Å; K231-K233 VanDerWaalsContact C-N 3.26Å; K231-K233 PolarHBondContact O-N 3.32Å; K233-R236 PolarHBondContact O-N 3.25Å; K233-M237 PolarHBondContact O-N 3.19Å; K233-V295 WeakPolarHBondContact CE-O 3.3Å; K233-V295 PolarHBondContact NZ-O 3.46Å |
| 234 | V | 70.3 | Confident | 72.3 | Confident | 55 Ų | 55 | 68.4 Ų | 68.4 | 33% | 0.333 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -65 | -42.1 | 174.8 | 176.4 | 0 | 0 | 0 | 0 | 110.6 | A230 K231 M237 I238 | A230-V234 PolarHBondContact O-N 3.43Å; K231-V234 PolarHBondContact O-N 3.39Å; V234-M237 WeakPolarHBondContact O-CB 3.25Å; V234-M237 PolarHBondContact O-N 3Å; V234-I238 HydrophobicContact CG1-CD1 3.87Å; V234-I238 PolarHBondContact O-N 3.33Å; V234-I238 VanDerWaalsContact O-N 3.09Å |
| 235 | T | 71.1 | Confident | 74 | Confident | 7 Ų | 7 | 64.7 Ų | 64.7 | 4% | 0.043 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -60.4 | -45.4 | 174 | -51.5 | 0 | 0 | 0 | 0 | 112 | I127 T210 K231 R232 M237 I238 L239 | I127-T235 HydrophobicContact CD1-CG2 4.08Å; I127-T235 VanDerWaalsContact CD1-OG1 3.27Å; I127-T235 WeakPolarHBondContact CD1-OG1 3.24Å; T210-T235 HydrophobicContact CG2-CG2 3.86Å; K231-T235 PolarHBondContact O-N 2.97Å; K231-T235 PolarHBondContact O-OG1 3.46Å; K231-T235 VanDerWaalsContact O-OG1 3.04Å; R232-T235 PolarHBondContact O-N 3.31Å; T235-M237 VanDerWaalsContact C-N 3.31Å; T235-M237 PolarHBondContact O-N 2.84Å; T235-I238 PolarHBondContact O-N 3.25Å; T235-L239 HydrophobicContact CG2-CD1 4.18Å; T235-L239 HydrophobicContact CG2-CG 4.47Å; T235-L239 WeakPolarHBondContact O-CB 3.43Å; T235-L239 VanDerWaalsContact O-CG 3.3Å; T235-L239 WeakPolarHBondContact O-CG 3.31Å; T235-L239 PolarHBondContact O-N 2.99Å |
| 236 | R | 77.8 | Confident | 75.3 | Confident | 174 Ų | 174 | 63.5 Ų | 63.5 | 66% | 0.657 | 33% | 0.325 | S | S | * | . | H | α-helix | trans | -60.4 | -39.8 | 176.4 | -175.4 | 177.6 | 176.1 | -175.5 | -0.7 | 112.1 | R232 K233 L239 I240 | R232-R236 WeakPolarHBondContact O-CB 3.28Å; R232-R236 PolarHBondContact O-N 3.48Å; K233-R236 PolarHBondContact O-N 3.25Å; R236-L239 PolarHBondContact O-N 3.44Å; R236-I240 HydrophobicContact CG-CD1 4.18Å; R236-I240 WeakPolarHBondContact O-CD1 3.41Å; R236-I240 VanDerWaalsContact O-CG1 3.28Å; R236-I240 WeakPolarHBondContact O-CG1 3.29Å; R236-I240 PolarHBondContact O-N 3.27Å |
| 237 | M | 78.1 | Confident | 76.7 | Confident | 9 Ų | 9 | 65.7 Ų | 65.7 | 4% | 0.044 | 32% | 0.321 | C | S | . | . | H | α-helix | trans | -59.7 | -49.3 | 175.1 | -175.4 | -178.4 | 83.7 | 0 | 0 | 111.4 | K233 V234 T235 L239 I240 V241 V291 Y292 V295 | K233-M237 PolarHBondContact O-N 3.19Å; V234-M237 WeakPolarHBondContact O-CB 3.25Å; V234-M237 PolarHBondContact O-N 3Å; T235-M237 VanDerWaalsContact C-N 3.31Å; T235-M237 PolarHBondContact O-N 2.84Å; M237-L239 VanDerWaalsContact C-N 3.33Å; M237-L239 PolarHBondContact O-N 2.97Å; M237-I240 WeakPolarHBondContact O-CB 3.48Å; M237-I240 PolarHBondContact O-N 3.36Å; M237-I240 VanDerWaalsContact O-N 3.17Å; M237-V241 WeakPolarHBondContact O-CG2 3.42Å; M237-V241 PolarHBondContact O-N 3.4Å; M237-V291 HydrophobicContact CG-CG1 3.89Å; M237-Y292 HydrophobicContact CE-CD1 3.67Å; M237-Y292 HydrophobicContact CE-CE1 3.82Å; M237-Y292 HydrophobicContact CG-CD1 4.28Å; M237-Y292 HydrophobicContact SD-CD1 3.73Å; M237-Y292 HydrophobicContact SD-CE1 4.41Å; M237-V295 HydrophobicContact CB-CB 4.13Å; M237-V295 HydrophobicContact CB-CG1 3.61Å; M237-V295 HydrophobicContact CG-CB 3.88Å; M237-V295 HydrophobicContact CG-CG1 3.95Å; M237-V295 HydrophobicContact SD-CB 4.45Å |
| 238 | I | 74.9 | Confident | 78.2 | Confident | 10 Ų | 10 | 63.2 Ų | 63.2 | 5% | 0.051 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -68.5 | -34 | -177.3 | -73.2 | 165.1 | 0 | 0 | 0 | 111.5 | V119 R123 Y207 V234 T235 V241 A242 | V119-I238 HydrophobicContact CG1-CD1 3.98Å; V119-I238 HydrophobicContact CG1-CG1 4.2Å; V119-I238 HydrophobicContact CG1-CG2 3.86Å; R123-I238 VanDerWaalsContact CD-CD1 3.41Å; R123-I238 HydrophobicContact CG-CD1 3.43Å; R123-I238 VanDerWaalsContact CG-CD1 3.43Å; R123-I238 HydrophobicContact CG-CG2 4.13Å; Y207-I238 HydrophobicContact CE1-CG2 4.12Å; Y207-I238 WeakPolarHBondContact OH-CG2 3.44Å; Y207-I238 PolarHBondContact OH-O 3.48Å; V234-I238 HydrophobicContact CG1-CD1 3.87Å; V234-I238 PolarHBondContact O-N 3.33Å; V234-I238 VanDerWaalsContact O-N 3.09Å; T235-I238 PolarHBondContact O-N 3.25Å; I238-V241 PolarHBondContact O-N 3.11Å; I238-A242 VanDerWaalsContact O-CB 3.32Å; I238-A242 WeakPolarHBondContact O-CB 3.5Å; I238-A242 PolarHBondContact O-N 3.03Å |
| 239 | L | 79.1 | Confident | 79.6 | Confident | 42 Ų | 42 | 57.7 Ų | 57.7 | 22% | 0.22 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -59.6 | -44.5 | 169.1 | -76.9 | 168.7 | 0 | 0 | 0 | 112.4 | Y207 L211 T235 R236 M237 A242 A243 | Y207-L239 HydrophobicContact CD1-CD2 3.32Å; Y207-L239 HydrophobicContact CD1-CG 4.07Å; Y207-L239 HydrophobicContact CD2-CD2 3.52Å; Y207-L239 HydrophobicContact CE1-CD2 3.83Å; Y207-L239 HydrophobicContact CE1-CG 4.25Å; Y207-L239 HydrophobicContact CE2-CD2 4.02Å; Y207-L239 HydrophobicContact CG-CD2 3.15Å; Y207-L239 HydrophobicContact CG-CG 4.34Å; L211-L239 HydrophobicContact CD2-CD1 4.37Å; T235-L239 HydrophobicContact CG2-CD1 4.18Å; T235-L239 HydrophobicContact CG2-CG 4.47Å; T235-L239 WeakPolarHBondContact O-CB 3.43Å; T235-L239 VanDerWaalsContact O-CG 3.3Å; T235-L239 WeakPolarHBondContact O-CG 3.31Å; T235-L239 PolarHBondContact O-N 2.99Å; R236-L239 PolarHBondContact O-N 3.44Å; M237-L239 VanDerWaalsContact C-N 3.33Å; M237-L239 PolarHBondContact O-N 2.97Å; L239-A242 PolarHBondContact O-N 3.07Å; L239-A243 WeakPolarHBondContact O-CB 3.3Å; L239-A243 PolarHBondContact O-N 3.1Å |
| 240 | I | 84.1 | Confident | 80.8 | Confident | 58 Ų | 58 | 52.6 Ų | 52.6 | 30% | 0.297 | 27% | 0.265 | S | S | . | . | H | α-helix | trans | -64 | -47 | 178.1 | -68.9 | 163.4 | 0 | 0 | 0 | 110.1 | R236 M237 A242 A243 L244 V291 V295 | R236-I240 HydrophobicContact CG-CD1 4.18Å; R236-I240 WeakPolarHBondContact O-CD1 3.41Å; R236-I240 VanDerWaalsContact O-CG1 3.28Å; R236-I240 WeakPolarHBondContact O-CG1 3.29Å; R236-I240 PolarHBondContact O-N 3.27Å; M237-I240 WeakPolarHBondContact O-CB 3.48Å; M237-I240 PolarHBondContact O-N 3.36Å; M237-I240 VanDerWaalsContact O-N 3.17Å; I240-A242 VanDerWaalsContact C-N 3.3Å; I240-A242 PolarHBondContact O-N 2.85Å; I240-A243 PolarHBondContact O-N 3.32Å; I240-L244 HydrophobicContact CG2-CD1 3.65Å; I240-L244 HydrophobicContact CG2-CG 4.4Å; I240-L244 WeakPolarHBondContact O-CB 3.15Å; I240-L244 VanDerWaalsContact O-CG 3.28Å; I240-L244 WeakPolarHBondContact O-CG 3.26Å; I240-L244 PolarHBondContact O-N 2.79Å; I240-V291 HydrophobicContact CB-CG1 4.3Å; I240-V291 HydrophobicContact CG2-CG1 3.97Å; I240-V291 HydrophobicContact CG2-CG2 4.01Å; I240-V295 HydrophobicContact CD1-CG2 4.11Å |
| 241 | V | 81.9 | Confident | 82.3 | Confident | 4 Ų | 4 | 51.7 Ų | 51.7 | 2% | 0.024 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -56.8 | -46.3 | 176.3 | 174.2 | 0 | 0 | 0 | 0 | 110.9 | L116 M237 I238 L244 F245 N288 V291 Y292 | L116-V241 HydrophobicContact CD2-CG1 3.63Å; M237-V241 WeakPolarHBondContact O-CG2 3.42Å; M237-V241 PolarHBondContact O-N 3.4Å; I238-V241 PolarHBondContact O-N 3.11Å; V241-L244 PolarHBondContact O-N 3.49Å; V241-F245 PolarHBondContact O-N 2.93Å; V241-N288 VanDerWaalsContact CG1-OD1 3.31Å; V241-N288 WeakPolarHBondContact CG1-OD1 3.47Å; V241-V291 HydrophobicContact CG2-CB 3.81Å; V241-V291 HydrophobicContact CG2-CG1 3.49Å; V241-V291 VanDerWaalsContact CG2-CG1 3.49Å; V241-V291 HydrophobicContact CG2-CG2 4.22Å; V241-Y292 HydrophobicContact CG2-CE1 3.94Å |
| 242 | A | 79.9 | Confident | 83.6 | Confident | 3 Ų | 3 | 47 Ų | 47 | 3% | 0.025 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -64.7 | -42.5 | 179.2 | 0 | 0 | 0 | 0 | 0 | 113.6 | L203 Y207 I238 L239 I240 L244 F245 C246 | L203-A242 HydrophobicContact CD2-CB 3.55Å; L203-A242 HydrophobicContact CG-CB 4.06Å; Y207-A242 HydrophobicContact CD2-CB 4.43Å; Y207-A242 HydrophobicContact CE2-CB 3.37Å; I238-A242 VanDerWaalsContact O-CB 3.32Å; I238-A242 WeakPolarHBondContact O-CB 3.5Å; I238-A242 PolarHBondContact O-N 3.03Å; L239-A242 PolarHBondContact O-N 3.07Å; I240-A242 VanDerWaalsContact C-N 3.3Å; I240-A242 PolarHBondContact O-N 2.85Å; A242-L244 VanDerWaalsContact C-N 3.3Å; A242-L244 PolarHBondContact O-N 3Å; A242-F245 WeakPolarHBondContact O-CB 3.36Å; A242-F245 PolarHBondContact O-N 3.25Å; A242-C246 PolarHBondContact O-N 2.75Å; A242-C246 VanDerWaalsContact O-N 3.1Å; A242-C246 PolarHBondContact O-SG 2.68Å |
| 243 | A | 85.9 | Confident | 84.7 | Confident | 51 Ų | 51 | 41.7 Ų | 41.7 | 42% | 0.421 | 22% | 0.215 | S | C | . | . | H | α-helix | trans | -62.6 | -41.1 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111.2 | L239 I240 C246 L247 | L239-A243 WeakPolarHBondContact O-CB 3.3Å; L239-A243 PolarHBondContact O-N 3.1Å; I240-A243 PolarHBondContact O-N 3.32Å; A243-C246 WeakPolarHBondContact O-CB 2.97Å; A243-C246 PolarHBondContact O-N 2.94Å; A243-L247 VanDerWaalsContact O-CG 3.29Å; A243-L247 WeakPolarHBondContact O-CG 3.3Å; A243-L247 PolarHBondContact O-N 3.44Å |
| 244 | L | 88.6 | Confident | 85.7 | Confident | 53 Ų | 53 | 40.1 Ų | 40.1 | 28% | 0.277 | 22% | 0.216 | S | C | . | . | H | α-helix | trans | -67.3 | -35.9 | 177.5 | -68.9 | 166.6 | 0 | 0 | 0 | 112 | I240 V241 A242 L247 C248 V287 V291 | I240-L244 HydrophobicContact CG2-CD1 3.65Å; I240-L244 HydrophobicContact CG2-CG 4.4Å; I240-L244 WeakPolarHBondContact O-CB 3.15Å; I240-L244 VanDerWaalsContact O-CG 3.28Å; I240-L244 WeakPolarHBondContact O-CG 3.26Å; I240-L244 PolarHBondContact O-N 2.79Å; V241-L244 PolarHBondContact O-N 3.49Å; A242-L244 VanDerWaalsContact C-N 3.3Å; A242-L244 PolarHBondContact O-N 3Å; L244-L247 HydrophobicContact CD2-CD1 4.49Å; L244-L247 PolarHBondContact O-N 2.86Å; L244-C248 VanDerWaalsContact O-CB 3.31Å; L244-C248 WeakPolarHBondContact O-CB 3.46Å; L244-C248 PolarHBondContact O-N 3.38Å; L244-C248 PolarHBondContact O-SG 3.38Å; L244-V287 HydrophobicContact CB-CG1 3.79Å; L244-V287 HydrophobicContact CD1-CG1 3.35Å; L244-V287 HydrophobicContact CG-CG1 4.07Å; L244-V291 HydrophobicContact CD1-CG2 3.58Å |
| 245 | F | 89.3 | Confident | 86.7 | Confident | 2 Ų | 2 | 38.4 Ų | 38.4 | 1% | 0.009 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -56.6 | -50.4 | 169.4 | 171.3 | -94.9 | 0 | 0 | 0 | 111.5 | S113 L116 Y196 P199 V200 L203 V241 A242 L247 C248 W249 N284 | S113-F245 WeakPolarHBondContact OG-CZ 3.38Å; L116-F245 HydrophobicContact CD1-CB 3.67Å; L116-F245 HydrophobicContact CD1-CD1 4.3Å; L116-F245 HydrophobicContact CD1-CD2 3.39Å; L116-F245 HydrophobicContact CD1-CE2 4.11Å; L116-F245 HydrophobicContact CD1-CG 3.51Å; Y196-F245 HydrophobicContact CD2-CE1 4.44Å; P199-F245 HydrophobicContact CB-CE1 4.48Å; V200-F245 HydrophobicContact CG2-CE1 4.35Å; L203-F245 HydrophobicContact CD2-CD1 4.37Å; V241-F245 PolarHBondContact O-N 2.93Å; A242-F245 WeakPolarHBondContact O-CB 3.36Å; A242-F245 PolarHBondContact O-N 3.25Å; F245-L247 VanDerWaalsContact C-N 3.34Å; F245-L247 PolarHBondContact O-N 3.44Å; F245-C248 PolarHBondContact O-N 2.84Å; F245-W249 AromaticContact CD2-CD1 3.36Å; F245-W249 HydrophobicContact CD2-CG 4.38Å; F245-W249 AromaticContact CD2-NE1 3.6Å; F245-W249 AromaticContact CE2-CD1 3.3Å; F245-W249 HydrophobicContact CE2-CG 4.02Å; F245-W249 AromaticContact CE2-NE1 3.42Å; F245-W249 AromaticContact CZ-CD1 3.98Å; F245-W249 HydrophobicContact CZ-CG 4.32Å; F245-W249 WeakPolarHBondContact O-CB 3.25Å; F245-W249 VanDerWaalsContact O-CD1 3.27Å; F245-W249 PolarHBondContact O-N 2.79Å; F245-W249 VanDerWaalsContact O-N 3.07Å; F245-N284 WeakPolarHBondContact CA-OD1 3.39Å |
| 246 | C | 89.5 | Confident | 87.6 | Confident | 30 Ų | 30 | 39.8 Ų | 39.8 | 20% | 0.203 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -57.3 | -48.5 | 177.2 | -58.3 | 0 | 0 | 0 | 0 | 111.3 | Y196 A242 A243 C248 W249 M250 | Y196-C246 PolarHBondContact OH-O 3.24Å; A242-C246 PolarHBondContact O-N 2.75Å; A242-C246 VanDerWaalsContact O-N 3.1Å; A242-C246 PolarHBondContact O-SG 2.68Å; A243-C246 WeakPolarHBondContact O-CB 2.97Å; A243-C246 PolarHBondContact O-N 2.94Å; C246-C248 PolarHBondContact O-N 3.21Å; C246-W249 PolarHBondContact O-N 3.39Å; C246-M250 WeakPolarHBondContact O-CB 3.22Å; C246-M250 PolarHBondContact O-N 3.49Å |
| 247 | L | 92.1 | Very high | 88.3 | Confident | 107 Ų | 107 | 33.7 Ų | 33.7 | 56% | 0.56 | 19% | 0.192 | S | C | * | . | H | α-helix | trans | -66.3 | -35.8 | -177.5 | -68.3 | 171.8 | 0 | 0 | 0 | 113.1 | A243 L244 F245 P251 | A243-L247 VanDerWaalsContact O-CG 3.29Å; A243-L247 WeakPolarHBondContact O-CG 3.3Å; A243-L247 PolarHBondContact O-N 3.44Å; L244-L247 HydrophobicContact CD2-CD1 4.49Å; L244-L247 PolarHBondContact O-N 2.86Å; F245-L247 VanDerWaalsContact C-N 3.34Å; F245-L247 PolarHBondContact O-N 3.44Å; L247-P251 WeakPolarHBondContact O-CD 3.31Å |
| 248 | C | 93.6 | Very high | 88.9 | Confident | 13 Ų | 13 | 36.1 Ų | 36.1 | 9% | 0.088 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -74.2 | -35.7 | 179.9 | -66.5 | 0 | 0 | 0 | 0 | 112 | L244 F245 C246 V280 S281 N284 | L244-C248 VanDerWaalsContact O-CB 3.31Å; L244-C248 WeakPolarHBondContact O-CB 3.46Å; L244-C248 PolarHBondContact O-N 3.38Å; L244-C248 PolarHBondContact O-SG 3.38Å; F245-C248 PolarHBondContact O-N 2.84Å; C246-C248 PolarHBondContact O-N 3.21Å; C248-V280 HydrophobicContact CB-CG1 4.35Å; C248-V280 WeakPolarHBondContact CB-O 3.35Å; C248-S281 VanDerWaalsContact O-CA 3.3Å; C248-S281 WeakPolarHBondContact O-CA 3.3Å; C248-S281 PolarHBondContact O-N 3.23Å; C248-N284 HydrophobicContact CB-CB 3.84Å |
| 249 | W | 93.4 | Very high | 89.6 | Confident | 18 Ų | 18 | 39.3 Ų | 39.3 | 7% | 0.068 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -90.8 | -25.2 | -176.3 | -75.5 | 92.8 | 0 | 0 | 0 | 114.1 | M109 Y196 F245 C246 H252 H253 N284 | M109-W249 HydrophobicContact CB-CH2 3.89Å; M109-W249 HydrophobicContact CB-CZ2 4.3Å; M109-W249 HydrophobicContact CG-CE3 4.49Å; M109-W249 HydrophobicContact CG-CH2 3.31Å; M109-W249 HydrophobicContact CG-CZ2 3.75Å; M109-W249 HydrophobicContact CG-CZ3 3.74Å; M109-W249 HydrophobicContact SD-CE3 4.1Å; M109-W249 HydrophobicContact SD-CH2 3.42Å; M109-W249 WeakPolarHBondContact SD-CH2 3.42Å; M109-W249 HydrophobicContact SD-CZ2 4.38Å; M109-W249 HydrophobicContact SD-CZ3 3.25Å; M109-W249 WeakPolarHBondContact SD-CZ3 3.22Å; Y196-W249 HydrophobicContact CD2-CB 3.67Å; Y196-W249 HydrophobicContact CE2-CB 3.78Å; F245-W249 AromaticContact CD2-CD1 3.36Å; F245-W249 HydrophobicContact CD2-CG 4.38Å; F245-W249 AromaticContact CD2-NE1 3.6Å; F245-W249 AromaticContact CE2-CD1 3.3Å; F245-W249 HydrophobicContact CE2-CG 4.02Å; F245-W249 AromaticContact CE2-NE1 3.42Å; F245-W249 AromaticContact CZ-CD1 3.98Å; F245-W249 HydrophobicContact CZ-CG 4.32Å; F245-W249 WeakPolarHBondContact O-CB 3.25Å; F245-W249 VanDerWaalsContact O-CD1 3.27Å; F245-W249 PolarHBondContact O-N 2.79Å; F245-W249 VanDerWaalsContact O-N 3.07Å; C246-W249 PolarHBondContact O-N 3.39Å; W249-H252 PolarHBondContact O-N 2.91Å; W249-H253 AromaticContact CE3-NE2 3.83Å; W249-H253 PolarHBondContact O-CD2 3.38Å; W249-H253 PolarHBondContact O-N 3.21Å; W249-N284 PolarHBondContact NE1-ND2 3.25Å |
| 250 | M | 93.9 | Very high | 90.2 | Very high | 99 Ų | 99 | 40.3 Ų | 40.3 | 49% | 0.488 | 23% | 0.23 | S | C | . | . | H | α-helix | trans | -53.3 | -48.8 | -179.7 | -175.4 | -160.8 | 78.4 | 0 | 0 | 113.4 | Y196 C246 H252 H253 A254 | Y196-M250 WeakPolarHBondContact OH-CB 3.03Å; C246-M250 WeakPolarHBondContact O-CB 3.22Å; C246-M250 PolarHBondContact O-N 3.49Å; M250-H252 VanDerWaalsContact C-N 3.3Å; M250-H252 PolarHBondContact O-N 2.96Å; M250-H253 PolarHBondContact O-N 3.46Å; M250-A254 VanDerWaalsContact O-CB 3.24Å; M250-A254 WeakPolarHBondContact O-CB 3.38Å; M250-A254 PolarHBondContact O-N 3.45Å |
| 251 | P | 94.4 | Very high | 90.5 | Very high | 38 Ų | 38 | 43.4 Ų | 43.4 | 25% | 0.247 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -61.5 | -39.7 | -176.1 | -22.7 | 34.8 | 0 | 0 | 0 | 112.3 | L247 L255 V280 | L247-P251 WeakPolarHBondContact O-CD 3.31Å; P251-L255 WeakPolarHBondContact O-CB 3.3Å; P251-L255 WeakPolarHBondContact O-CD1 3.22Å; P251-L255 VanDerWaalsContact O-CG 3.26Å; P251-L255 WeakPolarHBondContact O-CG 3.44Å; P251-L255 PolarHBondContact O-N 3.38Å; P251-V280 HydrophobicContact CG-CG1 4.39Å |
| 252 | H | 93.7 | Very high | 90.7 | Very high | 23 Ų | 23 | 45.3 Ų | 45.3 | 11% | 0.106 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -63.3 | -50.3 | 179 | 177.2 | 74 | 0 | 0 | 0 | 111.3 | W249 M250 L255 I256 H278 | W249-H252 PolarHBondContact O-N 2.91Å; M250-H252 VanDerWaalsContact C-N 3.3Å; M250-H252 PolarHBondContact O-N 2.96Å; H252-L255 PolarHBondContact O-N 3.06Å; H252-I256 VanDerWaalsContact NE2-CD1 3.35Å; H252-I256 WeakPolarHBondContact NE2-CD1 3.45Å; H252-I256 WeakPolarHBondContact O-CG1 3.43Å; H252-I256 PolarHBondContact O-N 2.88Å; H252-I256 VanDerWaalsContact O-N 3.14Å; H252-H278 AromaticContact CE1-CD2 3.7Å; H252-H278 AromaticContact CE1-NE2 3.35Å; H252-H278 PolarHBondContact CE1-NE2 2.97Å; H252-H278 VanDerWaalsContact CE1-NE2 3.35Å; H252-H278 AromaticContact ND1-CD2 3.69Å; H252-H278 AromaticContact ND1-NE2 3.56Å |
| 253 | H | 93.9 | Very high | 90.7 | Very high | 3 Ų | 3 | 53.8 Ų | 53.8 | 1% | 0.014 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -68.1 | -38.8 | 179.2 | -74 | -60.8 | 0 | 0 | 0 | 113 | F192 S195 Y196 W249 M250 L255 I256 L257 | F192-H253 HydrophobicContact CD2-CB 3.62Å; F192-H253 AromaticContact CD2-CG 3.71Å; F192-H253 AromaticContact CD2-ND1 3.8Å; F192-H253 HydrophobicContact CE2-CB 4.01Å; S195-H253 PolarHBondContact OG-CE1 2.89Å; S195-H253 PolarHBondContact OG-NE2 2.89Å; Y196-H253 VanDerWaalsContact CB-CD2 3.46Å; Y196-H253 WeakPolarHBondContact CB-CD2 3.08Å; Y196-H253 WeakPolarHBondContact CB-NE2 3.33Å; Y196-H253 AromaticContact CD2-CD2 3.68Å; Y196-H253 AromaticContact CG-CD2 3.52Å; W249-H253 AromaticContact CE3-NE2 3.83Å; W249-H253 PolarHBondContact O-CD2 3.38Å; W249-H253 PolarHBondContact O-N 3.21Å; M250-H253 PolarHBondContact O-N 3.46Å; H253-L255 VanDerWaalsContact C-N 3.32Å; H253-L255 PolarHBondContact O-N 2.03Å; H253-I256 PolarHBondContact O-N 2.78Å; H253-L257 WeakPolarHBondContact O-CG 3.33Å; H253-L257 PolarHBondContact O-N 3.02Å |
| 254 | A | 93.2 | Very high | 90.4 | Very high | 43 Ų | 43 | 53.8 Ų | 53.8 | 36% | 0.355 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -59.2 | -44.4 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.1 | M250 L257 C258 | M250-A254 VanDerWaalsContact O-CB 3.24Å; M250-A254 WeakPolarHBondContact O-CB 3.38Å; M250-A254 PolarHBondContact O-N 3.45Å; A254-L257 PolarHBondContact O-N 3.43Å; A254-C258 PolarHBondContact O-N 3Å; A254-C258 PolarHBondContact O-SG 3.06Å |
| 255 | L | 92.3 | Very high | 90.2 | Very high | 20 Ų | 20 | 54 Ų | 54 | 11% | 0.105 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -65.8 | -40.5 | 178 | -72.8 | 168.4 | 0 | 0 | 0 | 112.9 | P251 H252 H253 L257 C258 V259 F264 L273 S277 | P251-L255 WeakPolarHBondContact O-CB 3.3Å; P251-L255 WeakPolarHBondContact O-CD1 3.22Å; P251-L255 VanDerWaalsContact O-CG 3.26Å; P251-L255 WeakPolarHBondContact O-CG 3.44Å; P251-L255 PolarHBondContact O-N 3.38Å; H252-L255 PolarHBondContact O-N 3.06Å; H253-L255 VanDerWaalsContact C-N 3.32Å; H253-L255 PolarHBondContact O-N 2.03Å; L255-L257 VanDerWaalsContact C-N 3.29Å; L255-L257 PolarHBondContact O-N 3.46Å; L255-C258 PolarHBondContact O-N 2.74Å; L255-V259 VanDerWaalsContact O-CG2 3.3Å; L255-V259 WeakPolarHBondContact O-CG2 3.26Å; L255-V259 PolarHBondContact O-N 2.78Å; L255-F264 HydrophobicContact CD2-CE2 3.51Å; L255-F264 HydrophobicContact CD2-CZ 3.85Å; L255-L273 HydrophobicContact CD1-CG 3.97Å; L255-L273 HydrophobicContact CD2-CD2 3.62Å; L255-L273 HydrophobicContact CD2-CG 3.83Å; L255-L273 HydrophobicContact CG-CG 4.5Å; L255-S277 VanDerWaalsContact CD1-OG 3.25Å; L255-S277 WeakPolarHBondContact CD1-OG 3.4Å |
| 256 | I | 90.7 | Very high | 89.8 | Confident | 36 Ų | 36 | 62.4 Ų | 62.4 | 19% | 0.185 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -58.5 | -44.6 | 174 | -73.9 | 171.9 | 0 | 0 | 0 | 110.5 | D188 H252 H253 V259 W260 | D188-I256 HydrophobicContact CB-CG2 3.82Å; H252-I256 VanDerWaalsContact NE2-CD1 3.35Å; H252-I256 WeakPolarHBondContact NE2-CD1 3.45Å; H252-I256 WeakPolarHBondContact O-CG1 3.43Å; H252-I256 PolarHBondContact O-N 2.88Å; H252-I256 VanDerWaalsContact O-N 3.14Å; H253-I256 PolarHBondContact O-N 2.78Å; I256-V259 PolarHBondContact O-N 3.24Å; I256-W260 PolarHBondContact O-N 3.31Å; I256-W260 VanDerWaalsContact O-N 3.12Å |
| 257 | L | 91.9 | Very high | 89.8 | Confident | 45 Ų | 45 | 64.1 Ų | 64.1 | 24% | 0.236 | 35% | 0.35 | C | S | . | . | H | α-helix | trans | -65.3 | -41.5 | 176.5 | -65.9 | 174.6 | 0 | 0 | 0 | 111.8 | L189 F192 H253 A254 L255 V259 W260 F261 | L189-L257 HydrophobicContact CD2-CD2 3.67Å; F192-L257 HydrophobicContact CD1-CD1 4.35Å; F192-L257 HydrophobicContact CD1-CD2 4.38Å; F192-L257 HydrophobicContact CD2-CD1 4.39Å; F192-L257 HydrophobicContact CE1-CD1 4.03Å; F192-L257 HydrophobicContact CE2-CD1 4.03Å; F192-L257 HydrophobicContact CZ-CD1 3.84Å; H253-L257 WeakPolarHBondContact O-CG 3.33Å; H253-L257 PolarHBondContact O-N 3.02Å; A254-L257 PolarHBondContact O-N 3.43Å; L255-L257 VanDerWaalsContact C-N 3.29Å; L255-L257 PolarHBondContact O-N 3.46Å; L257-V259 VanDerWaalsContact C-N 3.3Å; L257-V259 PolarHBondContact O-N 3.07Å; L257-W260 PolarHBondContact O-N 3.11Å; L257-F261 HydrophobicContact CD2-CD2 4.24Å; L257-F261 HydrophobicContact CD2-CE2 3.94Å; L257-F261 WeakPolarHBondContact O-CB 3.29Å; L257-F261 WeakPolarHBondContact O-CD2 3.15Å; L257-F261 PolarHBondContact O-N 3.09Å |
| 258 | C | 91.6 | Very high | 89.4 | Confident | 60 Ų | 60 | 70 Ų | 70 | 41% | 0.405 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -61.7 | -36.5 | 174.8 | -69.4 | 0 | 0 | 0 | 0 | 112.6 | A254 L255 G262 F264 | A254-C258 PolarHBondContact O-N 3Å; A254-C258 PolarHBondContact O-SG 3.06Å; L255-C258 PolarHBondContact O-N 2.74Å; C258-G262 CarbonylContact O-C 3.49Å; C258-G262 VanDerWaalsContact O-C 3.28Å; C258-G262 WeakPolarHBondContact O-CA 3.41Å; C258-G262 PolarHBondContact O-N 3.33Å; C258-F264 HydrophobicContact CB-CD2 4.33Å |
| 259 | V | 89.1 | Confident | 89.1 | Confident | 78 Ų | 78 | 72.7 Ų | 72.7 | 47% | 0.473 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -66.7 | -38.1 | 175.8 | 167.8 | 0 | 0 | 0 | 0 | 111.6 | L255 I256 L257 F264 | L255-V259 VanDerWaalsContact O-CG2 3.3Å; L255-V259 WeakPolarHBondContact O-CG2 3.26Å; L255-V259 PolarHBondContact O-N 2.78Å; I256-V259 PolarHBondContact O-N 3.24Å; L257-V259 VanDerWaalsContact C-N 3.3Å; L257-V259 PolarHBondContact O-N 3.07Å; V259-F264 HydrophobicContact CG2-CB 4.1Å; V259-F264 HydrophobicContact CG2-CD1 3.69Å; V259-F264 HydrophobicContact CG2-CD2 4.46Å; V259-F264 HydrophobicContact CG2-CE1 4.18Å; V259-F264 HydrophobicContact CG2-CG 3.83Å |
| 260 | W | 90.6 | Very high | 88.8 | Confident | 63 Ų | 63 | 72.9 Ų | 72.9 | 24% | 0.239 | 39% | 0.391 | C | S | . | . | H | α-helix | trans | -84.9 | -32.1 | -176.8 | -76.7 | 118.4 | 0 | 0 | 0 | 115 | A181 R184 R185 D188 I256 L257 | A181-W260 HydrophobicContact CB-CH2 4.45Å; A181-W260 HydrophobicContact CB-CZ3 4.4Å; A181-W260 WeakPolarHBondContact O-CH2 3.47Å; R184-W260 HydrophobicContact CB-CH2 3.76Å; R184-W260 HydrophobicContact CB-CZ2 3.66Å; R185-W260 HydrophobicContact CB-CD2 3.74Å; R185-W260 HydrophobicContact CB-CE3 3.63Å; R185-W260 HydrophobicContact CB-CG 4.47Å; R185-W260 HydrophobicContact CB-CH2 3.88Å; R185-W260 HydrophobicContact CB-CZ2 3.98Å; R185-W260 HydrophobicContact CB-CZ3 3.7Å; R185-W260 HydrophobicContact CG-CB 4.37Å; R185-W260 HydrophobicContact CG-CD2 3.71Å; R185-W260 HydrophobicContact CG-CE3 3.77Å; R185-W260 HydrophobicContact CG-CG 3.99Å; R185-W260 HydrophobicContact CG-CZ3 4.35Å; R185-W260 VanDerWaalsContact N-CZ2 3.28Å; D188-W260 PolarHBondContact OD2-NE1 3.32Å; I256-W260 PolarHBondContact O-N 3.31Å; I256-W260 VanDerWaalsContact O-N 3.12Å; L257-W260 PolarHBondContact O-N 3.11Å |
| 261 | F | 91.1 | Very high | 88.4 | Confident | 122 Ų | 122 | 73.1 Ų | 73.1 | 54% | 0.535 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -121.1 | -13.5 | -171.5 | -62.4 | -94.5 | 0 | 0 | 0 | 113.8 | L189 L257 | L189-F261 HydrophobicContact CD1-CE2 4.37Å; L189-F261 HydrophobicContact CD1-CZ 3.98Å; L189-F261 HydrophobicContact CD2-CE2 3.78Å; L189-F261 HydrophobicContact CD2-CZ 4.01Å; L189-F261 HydrophobicContact CG-CE2 4.43Å; L189-F261 HydrophobicContact CG-CZ 4.5Å; L257-F261 HydrophobicContact CD2-CD2 4.24Å; L257-F261 HydrophobicContact CD2-CE2 3.94Å; L257-F261 WeakPolarHBondContact O-CB 3.29Å; L257-F261 WeakPolarHBondContact O-CD2 3.15Å; L257-F261 PolarHBondContact O-N 3.09Å |
| 262 | G | 85.6 | Confident | 88.1 | Confident | 45 Ų | 45 | 73.5 Ų | 73.5 | 46% | 0.464 | 39% | 0.393 | S | S | . | . | S | Bend | trans | -113.7 | -173 | -177.5 | 0 | 0 | 0 | 0 | 0 | 113 | C258 | C258-G262 CarbonylContact O-C 3.49Å; C258-G262 VanDerWaalsContact O-C 3.28Å; C258-G262 WeakPolarHBondContact O-CA 3.41Å; C258-G262 PolarHBondContact O-N 3.33Å |
| 263 | H | 79.7 | Confident | 87.9 | Confident | 181 Ų | 181 | 76.5 Ų | 76.5 | 84% | 0.838 | 41% | 0.41 | S | S | * | . | trans | -98.5 | 105 | 173.3 | -158.4 | 82.7 | 0 | 0 | 0 | 109.3 | P265 | H263-P265 WeakPolarHBondContact O-CD 3.01Š| ||
| 264 | F | 80.9 | Confident | 87.7 | Confident | 50 Ų | 50 | 81.9 Ų | 81.9 | 22% | 0.219 | 43% | 0.43 | C | S | . | . | trans | -117.9 | 87.9 | -177.8 | -160.2 | -97.6 | 0 | 0 | 0 | 110.5 | L255 C258 V259 T270 | L255-F264 HydrophobicContact CD2-CE2 3.51Å; L255-F264 HydrophobicContact CD2-CZ 3.85Å; C258-F264 HydrophobicContact CB-CD2 4.33Å; V259-F264 HydrophobicContact CG2-CB 4.1Å; V259-F264 HydrophobicContact CG2-CD1 3.69Å; V259-F264 HydrophobicContact CG2-CD2 4.46Å; V259-F264 HydrophobicContact CG2-CE1 4.18Å; V259-F264 HydrophobicContact CG2-CG 3.83Å; F264-T270 HydrophobicContact CD2-CG2 4.5Å; F264-T270 HydrophobicContact CE1-CG2 4.26Å; F264-T270 HydrophobicContact CE2-CG2 4.1Å; F264-T270 VanDerWaalsContact CZ-CB 3.49Å; F264-T270 HydrophobicContact CZ-CG2 4Å | ||
| 265 | P | 84.9 | Confident | 87.5 | Confident | 59 Ų | 59 | 80.3 Ų | 80.3 | 38% | 0.383 | 42% | 0.416 | S | S | . | . | trans | -68.6 | 145.8 | -178.2 | 29.6 | -35 | 0 | 0 | 0 | 110.4 | H263 T267 T270 | H263-P265 WeakPolarHBondContact O-CD 3.01Å; P265-T267 HydrophobicContact CB-CG2 4.08Å; P265-T267 HydrophobicContact CG-CG2 4.18Å; P265-T267 PolarHBondContact O-N 3.26Å; P265-T270 HydrophobicContact CG-CG2 4.38Å; P265-T270 VanDerWaalsContact O-CB 3.31Å; P265-T270 WeakPolarHBondContact O-CB 3.33Å; P265-T270 VanDerWaalsContact O-CG2 3.31Å; P265-T270 WeakPolarHBondContact O-CG2 3.5Å; P265-T270 PolarHBondContact O-OG1 3Å | ||
| 266 | L | 80.1 | Confident | 87.5 | Confident | 178 Ų | 178 | 83.9 Ų | 83.9 | 93% | 0.932 | 43% | 0.434 | S | S | * | . | trans | -80.1 | 82.9 | 173.3 | -87.8 | 76.8 | 0 | 0 | 0 | 109.8 | ||||
| 267 | T | 88.7 | Confident | 87.6 | Confident | 66 Ų | 66 | 82.4 Ų | 82.4 | 41% | 0.405 | 43% | 0.427 | S | S | . | . | trans | -109.8 | 166 | 172.8 | 69.2 | 0 | 0 | 0 | 0 | 109.9 | P265 A269 T270 Y271 | P265-T267 HydrophobicContact CB-CG2 4.08Å; P265-T267 HydrophobicContact CG-CG2 4.18Å; P265-T267 PolarHBondContact O-N 3.26Å; T267-A269 PolarHBondContact O-N 3.05Å; T267-T270 PolarHBondContact N-OG1 3.34Å; T267-T270 PolarHBondContact O-N 3Å; T267-T270 PolarHBondContact O-OG1 2.76Å; T267-T270 PolarHBondContact OG1-N 2.76Å; T267-T270 PolarHBondContact OG1-OG1 2.85Å; T267-Y271 WeakPolarHBondContact O-CB 3.42Å; T267-Y271 PolarHBondContact O-N 2.77Å | ||
| 268 | R | 84.8 | Confident | 87.6 | Confident | 229 Ų | 229 | 81.9 Ų | 81.9 | 86% | 0.864 | 42% | 0.423 | S | S | * | . | H | α-helix | trans | -56.5 | -38.3 | 174.2 | -67 | -175.1 | -175.5 | 174.8 | 0.9 | 111.8 | A272 | R268-A272 WeakPolarHBondContact O-CB 3.47Å; R268-A272 PolarHBondContact O-N 3.48Å |
| 269 | A | 86.8 | Confident | 87.7 | Confident | 71 Ų | 71 | 79.6 Ų | 79.6 | 59% | 0.587 | 41% | 0.407 | S | S | * | . | H | α-helix | trans | -66.1 | -45 | 179.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | T267 A272 L273 | T267-A269 PolarHBondContact O-N 3.05Å; A269-A272 PolarHBondContact O-N 3.28Å; A269-L273 WeakPolarHBondContact O-CB 3.43Å; A269-L273 PolarHBondContact O-N 3.14Å |
| 270 | T | 87.3 | Confident | 87.9 | Confident | 21 Ų | 21 | 78.8 Ų | 78.8 | 13% | 0.129 | 40% | 0.402 | C | S | . | . | H | α-helix | trans | -71.4 | -32.2 | 179.6 | 56.7 | 0 | 0 | 0 | 0 | 112.4 | F264 P265 T267 R274 | F264-T270 HydrophobicContact CD2-CG2 4.5Å; F264-T270 HydrophobicContact CE1-CG2 4.26Å; F264-T270 HydrophobicContact CE2-CG2 4.1Å; F264-T270 VanDerWaalsContact CZ-CB 3.49Å; F264-T270 HydrophobicContact CZ-CG2 4Å; P265-T270 HydrophobicContact CG-CG2 4.38Å; P265-T270 VanDerWaalsContact O-CB 3.31Å; P265-T270 WeakPolarHBondContact O-CB 3.33Å; P265-T270 VanDerWaalsContact O-CG2 3.31Å; P265-T270 WeakPolarHBondContact O-CG2 3.5Å; P265-T270 PolarHBondContact O-OG1 3Å; T267-T270 PolarHBondContact N-OG1 3.34Å; T267-T270 PolarHBondContact O-N 3Å; T267-T270 PolarHBondContact O-OG1 2.76Å; T267-T270 PolarHBondContact OG1-N 2.76Å; T267-T270 PolarHBondContact OG1-OG1 2.85Å; T270-R274 WeakPolarHBondContact O-CB 3.47Å; T270-R274 PolarHBondContact O-N 3.41Å |
| 271 | Y | 85.9 | Confident | 88.1 | Confident | 105 Ų | 105 | 75.9 Ų | 75.9 | 41% | 0.412 | 39% | 0.391 | S | S | . | . | H | α-helix | trans | -64.5 | -47.4 | 170.5 | -176.9 | -97.6 | 0 | 0 | 0 | 111.8 | T267 L273 R274 I275 | T267-Y271 WeakPolarHBondContact O-CB 3.42Å; T267-Y271 PolarHBondContact O-N 2.77Å; Y271-L273 PolarHBondContact O-N 3.27Å; Y271-R274 VanDerWaalsContact CE2-NH2 3.27Å; Y271-R274 WeakPolarHBondContact O-CB 3.2Å; Y271-R274 PolarHBondContact O-N 3.37Å; Y271-I275 HydrophobicContact CD1-CD1 3.8Å; Y271-I275 HydrophobicContact CD1-CG1 4.49Å; Y271-I275 HydrophobicContact CE1-CD1 3.24Å; Y271-I275 HydrophobicContact CE1-CG1 4.17Å; Y271-I275 PolarHBondContact O-N 3.41Å |
| 272 | A | 88 | Confident | 88.2 | Confident | 45 Ų | 45 | 70.6 Ų | 70.6 | 37% | 0.372 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -60.4 | -43.8 | 175.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | R268 A269 R274 I275 L276 | R268-A272 WeakPolarHBondContact O-CB 3.47Å; R268-A272 PolarHBondContact O-N 3.48Å; A269-A272 PolarHBondContact O-N 3.28Å; A272-R274 VanDerWaalsContact C-N 3.29Å; A272-R274 PolarHBondContact O-N 2.71Å; A272-I275 PolarHBondContact O-N 3.33Å; A272-I275 VanDerWaalsContact O-N 3.14Å; A272-L276 WeakPolarHBondContact O-CB 3.48Å; A272-L276 WeakPolarHBondContact O-CG 3.24Å; A272-L276 PolarHBondContact O-N 3.3Å |
| 273 | L | 89.8 | Confident | 88.6 | Confident | 87 Ų | 87 | 69.9 Ų | 69.9 | 46% | 0.455 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -59.8 | -40 | 175.8 | -176.6 | 59.9 | 0 | 0 | 0 | 111.9 | L255 A269 Y271 L276 S277 | L255-L273 HydrophobicContact CD1-CG 3.97Å; L255-L273 HydrophobicContact CD2-CD2 3.62Å; L255-L273 HydrophobicContact CD2-CG 3.83Å; L255-L273 HydrophobicContact CG-CG 4.5Å; A269-L273 WeakPolarHBondContact O-CB 3.43Å; A269-L273 PolarHBondContact O-N 3.14Å; Y271-L273 PolarHBondContact O-N 3.27Å; L273-L276 PolarHBondContact O-N 2.85Å; L273-S277 WeakPolarHBondContact O-CB 3.2Å; L273-S277 PolarHBondContact O-N 3.34Å |
| 274 | R | 89.3 | Confident | 89.2 | Confident | 116 Ų | 116 | 61.4 Ų | 61.4 | 44% | 0.438 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -62.1 | -46.3 | 173.7 | -170.2 | 178.9 | 72.1 | 173 | 5 | 111.2 | T270 Y271 A272 S277 H278 | T270-R274 WeakPolarHBondContact O-CB 3.47Å; T270-R274 PolarHBondContact O-N 3.41Å; Y271-R274 VanDerWaalsContact CE2-NH2 3.27Å; Y271-R274 WeakPolarHBondContact O-CB 3.2Å; Y271-R274 PolarHBondContact O-N 3.37Å; A272-R274 VanDerWaalsContact C-N 3.29Å; A272-R274 PolarHBondContact O-N 2.71Å; R274-S277 PolarHBondContact O-N 3.43Å; R274-S277 PolarHBondContact O-OG 2.94Å; R274-H278 PolarHBondContact O-N 3.35Å; R274-H278 PolarHBondContact O-ND1 3.14Å |
| 275 | I | 89.2 | Confident | 89.7 | Confident | 10 Ų | 10 | 59.3 Ų | 59.3 | 5% | 0.051 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -61.5 | -49.9 | 177 | -67.3 | 177.9 | 0 | 0 | 0 | 110.9 | V28 Y86 Y271 A272 S277 H278 L279 | V28-I275 HydrophobicContact CG1-CG2 4.2Å; V28-I275 HydrophobicContact CG2-CG2 3.75Å; Y86-I275 HydrophobicContact CD1-CD1 3.95Å; Y86-I275 HydrophobicContact CD1-CG1 4.07Å; Y86-I275 HydrophobicContact CE1-CD1 4.08Å; Y86-I275 HydrophobicContact CE1-CG1 3.68Å; Y271-I275 HydrophobicContact CD1-CD1 3.8Å; Y271-I275 HydrophobicContact CD1-CG1 4.49Å; Y271-I275 HydrophobicContact CE1-CD1 3.24Å; Y271-I275 HydrophobicContact CE1-CG1 4.17Å; Y271-I275 PolarHBondContact O-N 3.41Å; A272-I275 PolarHBondContact O-N 3.33Å; A272-I275 VanDerWaalsContact O-N 3.14Å; I275-S277 VanDerWaalsContact C-N 3.26Å; I275-S277 PolarHBondContact O-N 3.2Å; I275-H278 WeakPolarHBondContact O-CB 3.25Å; I275-H278 PolarHBondContact O-N 3.33Å; I275-L279 HydrophobicContact CG2-CD1 3.82Å; I275-L279 HydrophobicContact CG2-CG 4.3Å; I275-L279 PolarHBondContact O-N 3.34Å |
| 276 | L | 91.6 | Very high | 90 | Very high | 95 Ų | 95 | 57 Ų | 57 | 50% | 0.497 | 30% | 0.295 | S | S | . | . | H | α-helix | trans | -57.7 | -39.8 | 179.8 | -71.8 | 171.9 | 0 | 0 | 0 | 111.8 | A272 L273 H278 L279 V280 | A272-L276 WeakPolarHBondContact O-CB 3.48Å; A272-L276 WeakPolarHBondContact O-CG 3.24Å; A272-L276 PolarHBondContact O-N 3.3Å; L273-L276 PolarHBondContact O-N 2.85Å; L276-H278 VanDerWaalsContact C-N 3.33Å; L276-H278 PolarHBondContact O-N 3.19Å; L276-L279 HydrophobicContact CD2-CD1 4.47Å; L276-L279 PolarHBondContact O-N 3.49Å; L276-V280 WeakPolarHBondContact O-CB 3.45Å; L276-V280 VanDerWaalsContact O-CG2 3.25Å; L276-V280 WeakPolarHBondContact O-CG2 3.44Å; L276-V280 PolarHBondContact O-N 3.33Å |
| 277 | S | 93.7 | Very high | 90.4 | Very high | 4 Ų | 4 | 49.8 Ų | 49.8 | 3% | 0.028 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -64.3 | -36 | 176.8 | 75.1 | 0 | 0 | 0 | 0 | 113.7 | L255 L273 R274 I275 S281 | L255-S277 VanDerWaalsContact CD1-OG 3.25Å; L255-S277 WeakPolarHBondContact CD1-OG 3.4Å; L273-S277 WeakPolarHBondContact O-CB 3.2Å; L273-S277 PolarHBondContact O-N 3.34Å; R274-S277 PolarHBondContact O-N 3.43Å; R274-S277 PolarHBondContact O-OG 2.94Å; I275-S277 VanDerWaalsContact C-N 3.26Å; I275-S277 PolarHBondContact O-N 3.2Å; S277-S281 PolarHBondContact O-N 2.91Å; S277-S281 PolarHBondContact O-OG 3.42Å |
| 278 | H | 91.6 | Very high | 90.3 | Very high | 35 Ų | 35 | 46.7 Ų | 46.7 | 16% | 0.162 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -70.4 | -43 | 174.5 | -72.1 | 94.4 | 0 | 0 | 0 | 110.8 | H252 R274 I275 L276 V280 S281 Y282 | H252-H278 AromaticContact CE1-CD2 3.7Å; H252-H278 AromaticContact CE1-NE2 3.35Å; H252-H278 PolarHBondContact CE1-NE2 2.97Å; H252-H278 VanDerWaalsContact CE1-NE2 3.35Å; H252-H278 AromaticContact ND1-CD2 3.69Å; H252-H278 AromaticContact ND1-NE2 3.56Å; R274-H278 PolarHBondContact O-N 3.35Å; R274-H278 PolarHBondContact O-ND1 3.14Å; I275-H278 WeakPolarHBondContact O-CB 3.25Å; I275-H278 PolarHBondContact O-N 3.33Å; L276-H278 VanDerWaalsContact C-N 3.33Å; L276-H278 PolarHBondContact O-N 3.19Å; H278-V280 VanDerWaalsContact C-N 3.31Å; H278-V280 PolarHBondContact O-N 2.92Å; H278-S281 PolarHBondContact O-N 3.4Å; H278-S281 PolarHBondContact O-OG 2.88Å; H278-Y282 WeakPolarHBondContact O-CB 3.46Å; H278-Y282 WeakPolarHBondContact O-CD1 3.36Å; H278-Y282 VanDerWaalsContact O-CG 3.22Å; H278-Y282 PolarHBondContact O-N 2.9Å |
| 279 | L | 92.9 | Very high | 90.4 | Very high | 12 Ų | 12 | 36 Ų | 36 | 6% | 0.063 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -59.7 | -43.7 | 176.7 | -73.1 | 168.3 | 0 | 0 | 0 | 111.5 | L31 F32 I35 I275 L276 Y282 A283 | L31-L279 HydrophobicContact CB-CD1 4.41Å; L31-L279 HydrophobicContact CB-CD2 3.99Å; L31-L279 HydrophobicContact CD1-CD1 3.71Å; F32-L279 HydrophobicContact CD1-CD2 3.97Å; F32-L279 HydrophobicContact CD2-CD2 4.02Å; F32-L279 HydrophobicContact CE1-CD2 3.7Å; F32-L279 HydrophobicContact CE2-CD2 3.74Å; F32-L279 HydrophobicContact CG-CD2 4.12Å; F32-L279 HydrophobicContact CZ-CD2 3.58Å; F32-L279 HydrophobicContact CZ-CG 4.34Å; I35-L279 HydrophobicContact CD1-CD2 4.09Å; I275-L279 HydrophobicContact CG2-CD1 3.82Å; I275-L279 HydrophobicContact CG2-CG 4.3Å; I275-L279 PolarHBondContact O-N 3.34Å; L276-L279 HydrophobicContact CD2-CD1 4.47Å; L276-L279 PolarHBondContact O-N 3.49Å; L279-Y282 PolarHBondContact O-N 3.39Å; L279-A283 WeakPolarHBondContact O-CB 3.14Å; L279-A283 PolarHBondContact O-N 3.09Å |
| 280 | V | 94.4 | Very high | 90.4 | Very high | 61 Ų | 61 | 36.5 Ų | 36.5 | 37% | 0.37 | 19% | 0.191 | S | C | . | . | H | α-helix | trans | -66.1 | -42.3 | 178.4 | 171.1 | 0 | 0 | 0 | 0 | 111.4 | C248 P251 L276 H278 Y282 A283 | C248-V280 HydrophobicContact CB-CG1 4.35Å; C248-V280 WeakPolarHBondContact CB-O 3.35Å; P251-V280 HydrophobicContact CG-CG1 4.39Å; L276-V280 WeakPolarHBondContact O-CB 3.45Å; L276-V280 VanDerWaalsContact O-CG2 3.25Å; L276-V280 WeakPolarHBondContact O-CG2 3.44Å; L276-V280 PolarHBondContact O-N 3.33Å; H278-V280 VanDerWaalsContact C-N 3.31Å; H278-V280 PolarHBondContact O-N 2.92Å; V280-Y282 VanDerWaalsContact C-N 3.3Å; V280-Y282 PolarHBondContact O-N 2.87Å; V280-A283 PolarHBondContact O-N 3.46Å |
| 281 | S | 94.2 | Very high | 90.3 | Very high | 1 Ų | 1 | 35.9 Ų | 35.9 | 1% | 0.007 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -66.6 | -33.2 | 176 | 64.7 | 0 | 0 | 0 | 0 | 112.3 | C248 S277 H278 N284 | C248-S281 VanDerWaalsContact O-CA 3.3Å; C248-S281 WeakPolarHBondContact O-CA 3.3Å; C248-S281 PolarHBondContact O-N 3.23Å; S277-S281 PolarHBondContact O-N 2.91Å; S277-S281 PolarHBondContact O-OG 3.42Å; H278-S281 PolarHBondContact O-N 3.4Å; H278-S281 PolarHBondContact O-OG 2.88Å; S281-N284 WeakPolarHBondContact O-CB 3.31Å; S281-N284 PolarHBondContact O-N 2.9Å |
| 282 | Y | 93.4 | Very high | 90.2 | Very high | 12 Ų | 12 | 31.4 Ų | 31.4 | 5% | 0.047 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -76.9 | -32.9 | 179.9 | -73.8 | 26.4 | 0 | 0 | 0 | 111.7 | F32 F74 V79 Q82 H278 L279 V280 N284 S285 | F32-Y282 HydrophobicContact CD1-CD2 4.36Å; F32-Y282 AromaticContact CE1-CD2 3.56Å; F32-Y282 HydrophobicContact CE1-CD2 3.56Å; F32-Y282 AromaticContact CE1-CE2 3.99Å; F32-Y282 HydrophobicContact CE1-CE2 3.99Å; F32-Y282 HydrophobicContact CE1-CG 4.43Å; F32-Y282 HydrophobicContact CZ-CD2 4.47Å; F74-Y282 HydrophobicContact CE1-CD1 4.46Å; F74-Y282 HydrophobicContact CE1-CD2 4.17Å; F74-Y282 HydrophobicContact CE1-CG 4.02Å; F74-Y282 HydrophobicContact CE2-CE1 4.5Å; F74-Y282 HydrophobicContact CE2-CE2 4.43Å; F74-Y282 AromaticContact CZ-CD1 3.69Å; F74-Y282 HydrophobicContact CZ-CD1 3.69Å; F74-Y282 AromaticContact CZ-CD2 3.58Å; F74-Y282 HydrophobicContact CZ-CD2 3.58Å; F74-Y282 AromaticContact CZ-CE1 3.96Å; F74-Y282 HydrophobicContact CZ-CE1 3.96Å; F74-Y282 AromaticContact CZ-CE2 3.81Å; F74-Y282 HydrophobicContact CZ-CE2 3.81Å; F74-Y282 AromaticContact CZ-CG 3.54Å; F74-Y282 HydrophobicContact CZ-CG 3.54Å; V79-Y282 HydrophobicContact CG2-CD2 4.38Å; Q82-Y282 HydrophobicContact CB-CE2 3.85Å; Q82-Y282 HydrophobicContact CG-CE2 3.53Å; Q82-Y282 PolarHBondContact OE1-OH 3.04Å; H278-Y282 WeakPolarHBondContact O-CB 3.46Å; H278-Y282 WeakPolarHBondContact O-CD1 3.36Å; H278-Y282 VanDerWaalsContact O-CG 3.22Å; H278-Y282 PolarHBondContact O-N 2.9Å; L279-Y282 PolarHBondContact O-N 3.39Å; V280-Y282 VanDerWaalsContact C-N 3.3Å; V280-Y282 PolarHBondContact O-N 2.87Å; Y282-N284 PolarHBondContact O-N 3.38Å; Y282-N284 VanDerWaalsContact O-N 3.16Å; Y282-S285 PolarHBondContact O-N 3.2Å |
| 283 | A | 93.1 | Very high | 90 | Very high | 30 Ų | 30 | 30.7 Ų | 30.7 | 25% | 0.248 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -60.7 | -20.4 | 172.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | I35 L279 V280 S285 C286 V287 | I35-A283 HydrophobicContact CD1-CB 4.46Å; L279-A283 WeakPolarHBondContact O-CB 3.14Å; L279-A283 PolarHBondContact O-N 3.09Å; V280-A283 PolarHBondContact O-N 3.46Å; A283-S285 PolarHBondContact O-N 2.91Å; A283-C286 WeakPolarHBondContact O-CA 3.48Å; A283-C286 VanDerWaalsContact O-CB 3.3Å; A283-C286 WeakPolarHBondContact O-CB 3.15Å; A283-C286 PolarHBondContact O-N 3.34Å; A283-V287 WeakPolarHBondContact O-CG2 3.28Å; A283-V287 PolarHBondContact O-N 3.36Å |
| 284 | N | 92.6 | Very high | 89.6 | Confident | 2 Ų | 2 | 32.4 Ų | 32.4 | 1% | 0.011 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -49.4 | -42 | 174.2 | -178.9 | 68.2 | 0 | 0 | 0 | 112.7 | F245 C248 W249 S281 Y282 C286 V287 | F245-N284 WeakPolarHBondContact CA-OD1 3.39Å; C248-N284 HydrophobicContact CB-CB 3.84Å; W249-N284 PolarHBondContact NE1-ND2 3.25Å; S281-N284 WeakPolarHBondContact O-CB 3.31Å; S281-N284 PolarHBondContact O-N 2.9Å; Y282-N284 PolarHBondContact O-N 3.38Å; Y282-N284 VanDerWaalsContact O-N 3.16Å; N284-C286 PolarHBondContact O-N 3.24Å; N284-V287 PolarHBondContact O-N 2.91Å; N284-V287 VanDerWaalsContact O-N 3.15Å |
| 285 | S | 91.5 | Very high | 88.9 | Confident | 7 Ų | 7 | 28.3 Ų | 28.3 | 5% | 0.049 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -67.2 | -19.4 | 178.9 | -64.5 | 0 | 0 | 0 | 0 | 113.5 | N43 D71 F74 Y282 A283 | N43-S285 PolarHBondContact ND2-O 3.33Å; D71-S285 WeakPolarHBondContact OD1-CA 3.22Å; D71-S285 VanDerWaalsContact OD1-CB 3.23Å; D71-S285 WeakPolarHBondContact OD1-CB 3.26Å; D71-S285 PolarHBondContact OD1-OG 2.78Å; F74-S285 WeakPolarHBondContact CD1-OG 3.44Å; Y282-S285 PolarHBondContact O-N 3.2Å; A283-S285 PolarHBondContact O-N 2.91Å |
| 286 | C | 91.6 | Very high | 88.3 | Confident | 9 Ų | 9 | 28.9 Ų | 28.9 | 6% | 0.061 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -87.2 | -25.8 | 174.8 | -59.6 | 0 | 0 | 0 | 0 | 112.7 | I35 V38 G39 A283 N284 P289 I290 | I35-C286 PolarHBondContact O-SG 3.45Å; V38-C286 HydrophobicContact CB-CB 4.5Å; V38-C286 HydrophobicContact CG1-CB 3.96Å; G39-C286 VanDerWaalsContact CA-SG 3.56Å; G39-C286 PolarHBondContact N-SG 2.73Å; A283-C286 WeakPolarHBondContact O-CA 3.48Å; A283-C286 VanDerWaalsContact O-CB 3.3Å; A283-C286 WeakPolarHBondContact O-CB 3.15Å; A283-C286 PolarHBondContact O-N 3.34Å; N284-C286 PolarHBondContact O-N 3.24Å; C286-P289 WeakPolarHBondContact O-CD 3.39Å; C286-I290 WeakPolarHBondContact O-CD1 3.13Å; C286-I290 WeakPolarHBondContact O-CG1 3.48Å |
| 287 | V | 88.4 | Confident | 87.6 | Confident | 27 Ų | 27 | 31.1 Ų | 31.1 | 16% | 0.164 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -70.1 | -35.8 | -174.4 | 171.6 | 0 | 0 | 0 | 0 | 111.5 | L244 A283 N284 I290 V291 | L244-V287 HydrophobicContact CB-CG1 3.79Å; L244-V287 HydrophobicContact CD1-CG1 3.35Å; L244-V287 HydrophobicContact CG-CG1 4.07Å; A283-V287 WeakPolarHBondContact O-CG2 3.28Å; A283-V287 PolarHBondContact O-N 3.36Å; N284-V287 PolarHBondContact O-N 2.91Å; N284-V287 VanDerWaalsContact O-N 3.15Å; V287-I290 WeakPolarHBondContact O-CB 3.35Å; V287-I290 PolarHBondContact O-N 2.91Å; V287-V291 HydrophobicContact CG1-CG2 3.86Å; V287-V291 WeakPolarHBondContact O-CG2 3.34Å; V287-V291 PolarHBondContact O-N 2.86Å |
| 288 | N | 86.6 | Confident | 86.8 | Confident | 1 Ų | 1 | 34.6 Ų | 34.6 | 1% | 0.005 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -56.8 | -54.8 | -175.5 | -57.9 | -36.4 | 0 | 0 | 0 | 112.4 | L67 D71 V241 I290 V291 Y292 | L67-N288 HydrophobicContact CD2-CB 4.41Å; D71-N288 PolarHBondContact OD2-ND2 3.39Å; V241-N288 VanDerWaalsContact CG1-OD1 3.31Å; V241-N288 WeakPolarHBondContact CG1-OD1 3.47Å; N288-I290 VanDerWaalsContact C-N 3.33Å; N288-I290 PolarHBondContact O-N 3.23Å; N288-V291 PolarHBondContact O-N 3.37Å; N288-Y292 HydrophobicContact CB-CE2 4.2Å; N288-Y292 VanDerWaalsContact O-CD2 3.24Å; N288-Y292 WeakPolarHBondContact O-CD2 3.45Å; N288-Y292 PolarHBondContact O-N 3.22Å; N288-Y292 VanDerWaalsContact O-N 3.09Å |
| 289 | P | 86.6 | Confident | 86.3 | Confident | 6 Ų | 6 | 33.2 Ų | 33.2 | 4% | 0.039 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -58.7 | -38.5 | 174.8 | -25 | 33.9 | 0 | 0 | 0 | 114.6 | N43 V46 C286 Y292 A293 | N43-P289 HydrophobicContact CB-CG 4.4Å; N43-P289 WeakPolarHBondContact OD1-CG 3.49Å; V46-P289 HydrophobicContact CG2-CB 3.9Å; V46-P289 HydrophobicContact CG2-CG 4.07Å; C286-P289 WeakPolarHBondContact O-CD 3.39Å; P289-Y292 PolarHBondContact O-N 2.89Å; P289-A293 WeakPolarHBondContact O-CB 3.48Å; P289-A293 PolarHBondContact O-N 2.87Å |
| 290 | I | 86.8 | Confident | 85.9 | Confident | 80 Ų | 80 | 37.4 Ų | 37.4 | 41% | 0.41 | 20% | 0.196 | S | C | . | . | H | α-helix | trans | -62.1 | -47.3 | 179.9 | -65.3 | 169.7 | 0 | 0 | 0 | 109.7 | V38 C286 V287 N288 Y292 A293 L294 | V38-I290 HydrophobicContact CG1-CD1 4.21Å; C286-I290 WeakPolarHBondContact O-CD1 3.13Å; C286-I290 WeakPolarHBondContact O-CG1 3.48Å; V287-I290 WeakPolarHBondContact O-CB 3.35Å; V287-I290 PolarHBondContact O-N 2.91Å; N288-I290 VanDerWaalsContact C-N 3.33Å; N288-I290 PolarHBondContact O-N 3.23Å; I290-Y292 VanDerWaalsContact C-N 3.3Å; I290-Y292 PolarHBondContact O-N 2.86Å; I290-A293 PolarHBondContact O-N 2.95Å; I290-L294 HydrophobicContact CG2-CD1 3.8Å; I290-L294 HydrophobicContact CG2-CG 4.36Å; I290-L294 VanDerWaalsContact O-CG 3.31Å; I290-L294 WeakPolarHBondContact O-CG 3.26Å; I290-L294 PolarHBondContact O-N 3.38Å |
| 291 | V | 85.4 | Confident | 85.4 | Confident | 8 Ų | 8 | 41.4 Ų | 41.4 | 5% | 0.048 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -61.4 | -41.7 | 177 | 177.2 | 0 | 0 | 0 | 0 | 110.8 | M237 I240 V241 L244 V287 N288 A293 L294 V295 | M237-V291 HydrophobicContact CG-CG1 3.89Å; I240-V291 HydrophobicContact CB-CG1 4.3Å; I240-V291 HydrophobicContact CG2-CG1 3.97Å; I240-V291 HydrophobicContact CG2-CG2 4.01Å; V241-V291 HydrophobicContact CG2-CB 3.81Å; V241-V291 HydrophobicContact CG2-CG1 3.49Å; V241-V291 VanDerWaalsContact CG2-CG1 3.49Å; V241-V291 HydrophobicContact CG2-CG2 4.22Å; L244-V291 HydrophobicContact CD1-CG2 3.58Å; V287-V291 HydrophobicContact CG1-CG2 3.86Å; V287-V291 WeakPolarHBondContact O-CG2 3.34Å; V287-V291 PolarHBondContact O-N 2.86Å; N288-V291 PolarHBondContact O-N 3.37Å; V291-A293 PolarHBondContact O-N 2.89Å; V291-L294 PolarHBondContact O-N 3.19Å; V291-V295 HydrophobicContact CG1-CG2 4.01Å; V291-V295 VanDerWaalsContact O-CB 3.3Å; V291-V295 WeakPolarHBondContact O-CB 3.44Å; V291-V295 WeakPolarHBondContact O-CG2 3.39Å; V291-V295 PolarHBondContact O-N 2.98Å |
| 292 | Y | 83.4 | Confident | 84.8 | Confident | 11 Ų | 11 | 42.2 Ų | 42.2 | 4% | 0.043 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -62.8 | -42.3 | 176.5 | -57.5 | -26.1 | 0 | 0 | 0 | 112.2 | V46 I64 M237 V241 N288 P289 I290 S296 F299 | V46-Y292 HydrophobicContact CG1-CD2 4.26Å; V46-Y292 HydrophobicContact CG1-CE2 4.31Å; V46-Y292 HydrophobicContact CG2-CD2 3.75Å; V46-Y292 HydrophobicContact CG2-CE2 4.37Å; I64-Y292 HydrophobicContact CG2-CE2 3.76Å; M237-Y292 HydrophobicContact CE-CD1 3.67Å; M237-Y292 HydrophobicContact CE-CE1 3.82Å; M237-Y292 HydrophobicContact CG-CD1 4.28Å; M237-Y292 HydrophobicContact SD-CD1 3.73Å; M237-Y292 HydrophobicContact SD-CE1 4.41Å; V241-Y292 HydrophobicContact CG2-CE1 3.94Å; N288-Y292 HydrophobicContact CB-CE2 4.2Å; N288-Y292 VanDerWaalsContact O-CD2 3.24Å; N288-Y292 WeakPolarHBondContact O-CD2 3.45Å; N288-Y292 PolarHBondContact O-N 3.22Å; N288-Y292 VanDerWaalsContact O-N 3.09Å; P289-Y292 PolarHBondContact O-N 2.89Å; I290-Y292 VanDerWaalsContact C-N 3.3Å; I290-Y292 PolarHBondContact O-N 2.86Å; Y292-S296 WeakPolarHBondContact O-CA 3.47Å; Y292-S296 VanDerWaalsContact O-CB 3.27Å; Y292-S296 WeakPolarHBondContact O-CB 3.39Å; Y292-S296 PolarHBondContact O-N 3.43Å; Y292-F299 HydrophobicContact CG-CD2 4.39Å; Y292-F299 HydrophobicContact CG-CE2 4.48Å |
| 293 | A | 83.3 | Confident | 84.5 | Confident | 30 Ų | 30 | 42.7 Ų | 42.7 | 25% | 0.248 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -62.9 | -45 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.7 | P289 I290 V291 R300 F303 | P289-A293 WeakPolarHBondContact O-CB 3.48Å; P289-A293 PolarHBondContact O-N 2.87Å; I290-A293 PolarHBondContact O-N 2.95Å; V291-A293 PolarHBondContact O-N 2.89Å; A293-R300 PolarHBondContact O-NE 3.31Å; A293-F303 HydrophobicContact CB-CD2 3.87Å; A293-F303 HydrophobicContact CB-CE2 3.73Å |
| 294 | L | 81.6 | Confident | 84.1 | Confident | 124 Ų | 124 | 48.5 Ų | 48.5 | 65% | 0.649 | 23% | 0.234 | S | C | * | . | H | α-helix | trans | -74.8 | -48.2 | -176.4 | -64.9 | 176.6 | 0 | 0 | 0 | 111.3 | I290 V291 R300 | I290-L294 HydrophobicContact CG2-CD1 3.8Å; I290-L294 HydrophobicContact CG2-CG 4.36Å; I290-L294 VanDerWaalsContact O-CG 3.31Å; I290-L294 WeakPolarHBondContact O-CG 3.26Å; I290-L294 PolarHBondContact O-N 3.38Å; V291-L294 PolarHBondContact O-N 3.19Å; L294-R300 PolarHBondContact O-NH2 3.31Å |
| 295 | V | 74.9 | Confident | 83.8 | Confident | 29 Ų | 29 | 56.7 Ų | 56.7 | 18% | 0.176 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -89.3 | -41.4 | -168.7 | -172.4 | 0 | 0 | 0 | 0 | 111.7 | K233 M237 I240 V291 K297 | K233-V295 WeakPolarHBondContact CE-O 3.3Å; K233-V295 PolarHBondContact NZ-O 3.46Å; M237-V295 HydrophobicContact CB-CB 4.13Å; M237-V295 HydrophobicContact CB-CG1 3.61Å; M237-V295 HydrophobicContact CG-CB 3.88Å; M237-V295 HydrophobicContact CG-CG1 3.95Å; M237-V295 HydrophobicContact SD-CB 4.45Å; I240-V295 HydrophobicContact CD1-CG2 4.11Å; V291-V295 HydrophobicContact CG1-CG2 4.01Å; V291-V295 VanDerWaalsContact O-CB 3.3Å; V291-V295 WeakPolarHBondContact O-CB 3.44Å; V291-V295 WeakPolarHBondContact O-CG2 3.39Å; V291-V295 PolarHBondContact O-N 2.98Å; V295-K297 PolarHBondContact O-N 3.01Å |
| 296 | S | 76.8 | Confident | 83.5 | Confident | 22 Ų | 22 | 57.1 Ų | 57.1 | 15% | 0.154 | 27% | 0.271 | C | S | . | . | trans | -87.3 | 116.2 | -176.2 | -178.4 | 0 | 0 | 0 | 0 | 112.8 | Y292 H298 F299 R300 | Y292-S296 WeakPolarHBondContact O-CA 3.47Å; Y292-S296 VanDerWaalsContact O-CB 3.27Å; Y292-S296 WeakPolarHBondContact O-CB 3.39Å; Y292-S296 PolarHBondContact O-N 3.43Å; S296-H298 PolarHBondContact O-N 2.87Å; S296-H298 PolarHBondContact OG-N 3.23Å; S296-F299 WeakPolarHBondContact OG-CD2 3.48Å; S296-F299 PolarHBondContact OG-N 3.25Å; S296-R300 WeakPolarHBondContact O-CB 3.36Å; S296-R300 PolarHBondContact O-N 3.26Å | ||
| 297 | K | 77.5 | Confident | 83.2 | Confident | 143 Ų | 143 | 59 Ų | 59 | 62% | 0.622 | 28% | 0.284 | S | S | * | . | H | α-helix | trans | -60.8 | -31.5 | 173 | -78.7 | -178.6 | 178.5 | -171.6 | 0 | 111.7 | V295 K301 | V295-K297 PolarHBondContact O-N 3.01Å; K297-K301 WeakPolarHBondContact O-CG 3.49Å; K297-K301 PolarHBondContact O-N 3.01Å; K297-K301 VanDerWaalsContact O-N 3.17Å |
| 298 | H | 76.8 | Confident | 83 | Confident | 76 Ų | 76 | 60.4 Ų | 60.4 | 35% | 0.352 | 30% | 0.299 | S | S | . | . | H | α-helix | trans | -70.8 | -54.7 | -179.3 | 169.2 | -82.2 | 0 | 0 | 0 | 110.8 | Q55 S296 R300 K301 G302 | Q55-H298 VanDerWaalsContact CD-NE2 3.29Å; Q55-H298 PolarHBondContact NE2-NE2 3.06Å; Q55-H298 PolarHBondContact OE1-CE1 3.43Å; Q55-H298 PolarHBondContact OE1-NE2 3.43Å; S296-H298 PolarHBondContact O-N 2.87Å; S296-H298 PolarHBondContact OG-N 3.23Å; H298-R300 VanDerWaalsContact C-N 3.28Å; H298-R300 PolarHBondContact O-N 2.87Å; H298-K301 PolarHBondContact O-N 2.8Å; H298-G302 PolarHBondContact O-N 2.96Å |
| 299 | F | 80.8 | Confident | 82.7 | Confident | 7 Ų | 7 | 63 Ų | 63 | 3% | 0.031 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -58.9 | -40.8 | 177 | -78.1 | -73.8 | 0 | 0 | 0 | 111.4 | V46 V49 L50 I64 Y292 S296 K301 G302 F303 | V46-F299 HydrophobicContact CG1-CE1 4.29Å; V49-F299 HydrophobicContact CB-CD1 4.3Å; V49-F299 HydrophobicContact CG1-CD1 3.89Å; V49-F299 HydrophobicContact CG1-CE1 4.21Å; L50-F299 HydrophobicContact CD2-CE1 3.91Å; L50-F299 HydrophobicContact CD2-CZ 3.84Å; L50-F299 HydrophobicContact CG-CE1 4.01Å; L50-F299 HydrophobicContact CG-CZ 4.29Å; I64-F299 HydrophobicContact CD1-CE2 4.41Å; I64-F299 HydrophobicContact CD1-CZ 4.33Å; I64-F299 HydrophobicContact CG2-CZ 4.27Å; Y292-F299 HydrophobicContact CG-CD2 4.39Å; Y292-F299 HydrophobicContact CG-CE2 4.48Å; S296-F299 WeakPolarHBondContact OG-CD2 3.48Å; S296-F299 PolarHBondContact OG-N 3.25Å; F299-K301 VanDerWaalsContact C-N 3.33Å; F299-K301 PolarHBondContact O-N 3.36Å; F299-G302 CarbonylContact O-C 3.49Å; F299-G302 WeakPolarHBondContact O-CA 3.26Å; F299-G302 PolarHBondContact O-N 3.48Å; F299-G302 VanDerWaalsContact O-N 3.11Å; F299-F303 HydrophobicContact CB-CE2 4.03Å; F299-F303 HydrophobicContact CB-CZ 4.07Å; F299-F303 HydrophobicContact CD1-CE1 4.24Å; F299-F303 HydrophobicContact CD1-CZ 4.06Å; F299-F303 HydrophobicContact CG-CZ 4.45Å; F299-F303 WeakPolarHBondContact O-CB 3.37Å; F299-F303 WeakPolarHBondContact O-CD2 3.46Å; F299-F303 VanDerWaalsContact O-CG 3.22Å; F299-F303 WeakPolarHBondContact O-CG 3.34Å; F299-F303 PolarHBondContact O-N 2.78Å |
| 300 | R | 84.1 | Confident | 82.4 | Confident | 100 Ų | 100 | 69 Ų | 69 | 38% | 0.377 | 36% | 0.356 | S | S | . | . | H | α-helix | trans | -61.1 | -36.1 | 175.7 | -160.6 | -167.8 | -43 | 172.4 | 1 | 114.1 | A293 L294 S296 H298 R304 | A293-R300 PolarHBondContact O-NE 3.31Å; L294-R300 PolarHBondContact O-NH2 3.31Å; S296-R300 WeakPolarHBondContact O-CB 3.36Å; S296-R300 PolarHBondContact O-N 3.26Å; H298-R300 VanDerWaalsContact C-N 3.28Å; H298-R300 PolarHBondContact O-N 2.87Å; R300-R304 WeakPolarHBondContact O-CB 3.48Å; R300-R304 WeakPolarHBondContact O-CG 3.32Å; R300-R304 PolarHBondContact O-N 3.12Å; R300-R304 VanDerWaalsContact O-N 3.15Å; R300-R304 PolarHBondContact O-NE 3.05Å |
| 301 | K | 84.1 | Confident | 82 | Confident | 145 Ų | 145 | 72.6 Ų | 72.6 | 63% | 0.63 | 38% | 0.376 | S | S | * | . | H | α-helix | trans | -69.7 | -42.9 | 173.5 | -78.5 | -178 | 178.3 | -170.6 | 0 | 110.5 | K297 H298 F299 R304 K305 | K297-K301 WeakPolarHBondContact O-CG 3.49Å; K297-K301 PolarHBondContact O-N 3.01Å; K297-K301 VanDerWaalsContact O-N 3.17Å; H298-K301 PolarHBondContact O-N 2.8Å; F299-K301 VanDerWaalsContact C-N 3.33Å; F299-K301 PolarHBondContact O-N 3.36Å; K301-R304 PolarHBondContact O-N 2.9Å; K301-K305 PolarHBondContact O-N 3.45Å |
| 302 | G | 82.3 | Confident | 81 | Confident | 17 Ų | 17 | 74.2 Ų | 74.2 | 18% | 0.175 | 39% | 0.394 | C | S | . | . | H | α-helix | trans | -58.8 | -52 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | H298 F299 R304 K305 I306 | H298-G302 PolarHBondContact O-N 2.96Å; F299-G302 CarbonylContact O-C 3.49Å; F299-G302 WeakPolarHBondContact O-CA 3.26Å; F299-G302 PolarHBondContact O-N 3.48Å; F299-G302 VanDerWaalsContact O-N 3.11Å; G302-R304 PolarHBondContact O-N 3.33Å; G302-K305 PolarHBondContact O-N 3.2Å; G302-K305 VanDerWaalsContact O-N 3.16Å; G302-I306 WeakPolarHBondContact O-CG1 3.31Å; G302-I306 PolarHBondContact O-N 3.41Å |
| 303 | F | 85.8 | Confident | 79.4 | Confident | 22 Ų | 22 | 85.2 Ų | 85.2 | 10% | 0.096 | 44% | 0.436 | C | S | . | . | H | α-helix | trans | -57.5 | -48.7 | 177.3 | -62.9 | -21.8 | 0 | 0 | 0 | 111.5 | L45 V46 V49 A293 F299 K305 I306 C307 | L45-F303 HydrophobicContact CB-CD1 3.84Å; L45-F303 HydrophobicContact CB-CE1 3.75Å; V46-F303 HydrophobicContact CG2-CE1 4.3Å; V46-F303 HydrophobicContact CG2-CZ 3.81Å; V49-F303 HydrophobicContact CB-CE1 4.37Å; V49-F303 HydrophobicContact CG2-CD1 3.42Å; V49-F303 VanDerWaalsContact CG2-CD1 3.42Å; V49-F303 HydrophobicContact CG2-CE1 3.62Å; A293-F303 HydrophobicContact CB-CD2 3.87Å; A293-F303 HydrophobicContact CB-CE2 3.73Å; F299-F303 HydrophobicContact CB-CE2 4.03Å; F299-F303 HydrophobicContact CB-CZ 4.07Å; F299-F303 HydrophobicContact CD1-CE1 4.24Å; F299-F303 HydrophobicContact CD1-CZ 4.06Å; F299-F303 HydrophobicContact CG-CZ 4.45Å; F299-F303 WeakPolarHBondContact O-CB 3.37Å; F299-F303 WeakPolarHBondContact O-CD2 3.46Å; F299-F303 VanDerWaalsContact O-CG 3.22Å; F299-F303 WeakPolarHBondContact O-CG 3.34Å; F299-F303 PolarHBondContact O-N 2.78Å; F303-K305 VanDerWaalsContact C-N 3.32Å; F303-K305 PolarHBondContact O-N 2.98Å; F303-I306 PolarHBondContact O-N 3.43Å; F303-C307 WeakPolarHBondContact O-CB 3.31Å; F303-C307 PolarHBondContact O-N 2.98Å; F303-C307 PolarHBondContact O-SG 3.49Å |
| 304 | R | 85.9 | Confident | 77.6 | Confident | 152 Ų | 152 | 88 Ų | 88 | 57% | 0.574 | 46% | 0.458 | S | S | * | . | H | α-helix | trans | -59.5 | -39.4 | 176.6 | -77.8 | -175 | -65.8 | 163.6 | 0.1 | 113.1 | R300 K301 G302 A308 | R300-R304 WeakPolarHBondContact O-CB 3.48Å; R300-R304 WeakPolarHBondContact O-CG 3.32Å; R300-R304 PolarHBondContact O-N 3.12Å; R300-R304 VanDerWaalsContact O-N 3.15Å; R300-R304 PolarHBondContact O-NE 3.05Å; K301-R304 PolarHBondContact O-N 2.9Å; G302-R304 PolarHBondContact O-N 3.33Å; R304-A308 WeakPolarHBondContact O-CB 3.38Å; R304-A308 PolarHBondContact O-N 2.9Å |
| 305 | K | 86.2 | Confident | 76 | Confident | 174 Ų | 174 | 88 Ų | 88 | 76% | 0.757 | 47% | 0.465 | S | S | * | . | H | α-helix | trans | -65.2 | -41 | 177.3 | -172.3 | 177.6 | -179.3 | -179.2 | 0 | 111.6 | K301 G302 F303 G309 | K301-K305 PolarHBondContact O-N 3.45Å; G302-K305 PolarHBondContact O-N 3.2Å; G302-K305 VanDerWaalsContact O-N 3.16Å; F303-K305 VanDerWaalsContact C-N 3.32Å; F303-K305 PolarHBondContact O-N 2.98Å; K305-G309 PolarHBondContact O-N 3.3Å |
| 306 | I | 85.6 | Confident | 74.5 | Confident | 16 Ų | 16 | 98.7 Ų | 98.7 | 8% | 0.082 | 50% | 0.503 | C | S | . | . | H | α-helix | trans | -68.5 | -49.2 | 177.6 | -65.1 | 172.3 | 0 | 0 | 0 | 110.3 | L45 A48 V49 G302 F303 A308 G309 L310 | L45-I306 HydrophobicContact CD2-CB 4.33Å; L45-I306 HydrophobicContact CD2-CG2 3.75Å; A48-I306 HydrophobicContact CB-CD1 3.74Å; V49-I306 HydrophobicContact CB-CD1 4.49Å; V49-I306 HydrophobicContact CG2-CD1 3.55Å; G302-I306 WeakPolarHBondContact O-CG1 3.31Å; G302-I306 PolarHBondContact O-N 3.41Å; F303-I306 PolarHBondContact O-N 3.43Å; I306-A308 VanDerWaalsContact C-N 3.34Å; I306-A308 PolarHBondContact O-N 3.27Å; I306-G309 PolarHBondContact O-N 3Å; I306-G309 VanDerWaalsContact O-N 3.17Å; I306-L310 HydrophobicContact CG2-CD1 3.87Å; I306-L310 HydrophobicContact CG2-CG 4.42Å; I306-L310 WeakPolarHBondContact O-CG 3.2Å; I306-L310 PolarHBondContact O-N 3.28Å |
| 307 | C | 84.4 | Confident | 73.1 | Confident | 48 Ų | 48 | 109 Ų | 109 | 32% | 0.324 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -61.6 | -41.3 | 177.7 | -61.9 | 0 | 0 | 0 | 0 | 111.8 | F303 G309 L310 L311 | F303-C307 WeakPolarHBondContact O-CB 3.31Å; F303-C307 PolarHBondContact O-N 2.98Å; F303-C307 PolarHBondContact O-SG 3.49Å; C307-G309 VanDerWaalsContact C-N 3.35Å; C307-G309 PolarHBondContact O-N 3.46Å; C307-L310 PolarHBondContact O-N 2.96Å; C307-L311 HydrophobicContact CB-CD1 4.32Å; C307-L311 VanDerWaalsContact O-CB 3.24Å; C307-L311 WeakPolarHBondContact O-CB 3.48Å; C307-L311 WeakPolarHBondContact O-CD1 3.47Å; C307-L311 VanDerWaalsContact O-CG 3.31Å; C307-L311 WeakPolarHBondContact O-CG 3.12Å; C307-L311 PolarHBondContact O-N 3.05Å |
| 308 | A | 85 | Confident | 71.7 | Confident | 58 Ų | 58 | 106.9 Ų | 106.9 | 48% | 0.479 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -63.3 | -39.7 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | R304 I306 L310 L311 G312 | R304-A308 WeakPolarHBondContact O-CB 3.38Å; R304-A308 PolarHBondContact O-N 2.9Å; I306-A308 VanDerWaalsContact C-N 3.34Å; I306-A308 PolarHBondContact O-N 3.27Å; A308-L310 VanDerWaalsContact C-N 3.31Å; A308-L310 PolarHBondContact O-N 3.31Å; A308-L311 PolarHBondContact O-N 2.94Å; A308-G312 CarbonylContact O-C 3.56Å; A308-G312 WeakPolarHBondContact O-CA 3.42Å; A308-G312 PolarHBondContact O-N 2.57Å; A308-G312 VanDerWaalsContact O-O 3.12Å |
| 309 | G | 80.6 | Confident | 70 | Confident | 55 Ų | 55 | 108.9 Ų | 108.9 | 57% | 0.567 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -68.5 | -27 | 174.5 | 0 | 0 | 0 | 0 | 0 | 114.1 | K305 I306 C307 | K305-G309 PolarHBondContact O-N 3.3Å; I306-G309 PolarHBondContact O-N 3Å; I306-G309 VanDerWaalsContact O-N 3.17Å; C307-G309 VanDerWaalsContact C-N 3.35Å; C307-G309 PolarHBondContact O-N 3.46Å |
| 310 | L | 78.8 | Confident | 68.1 | Low | 131 Ų | 131 | 111.5 Ų | 111.5 | 69% | 0.686 | 60% | 0.599 | S | S | * | * | H | α-helix | trans | -82.1 | -36 | 174.6 | -68.7 | 169.4 | 0 | 0 | 0 | 112.5 | I306 C307 A308 | I306-L310 HydrophobicContact CG2-CD1 3.87Å; I306-L310 HydrophobicContact CG2-CG 4.42Å; I306-L310 WeakPolarHBondContact O-CG 3.2Å; I306-L310 PolarHBondContact O-N 3.28Å; C307-L310 PolarHBondContact O-N 2.96Å; A308-L310 VanDerWaalsContact C-N 3.31Å; A308-L310 PolarHBondContact O-N 3.31Å |
| 311 | L | 78.4 | Confident | 66 | Low | 156 Ų | 156 | 118.4 Ų | 118.4 | 82% | 0.817 | 63% | 0.625 | S | S | * | * | H | α-helix | trans | -91.6 | -10.8 | -177.6 | -67.8 | 162.6 | 0 | 0 | 0 | 113.3 | C307 A308 | C307-L311 HydrophobicContact CB-CD1 4.32Å; C307-L311 VanDerWaalsContact O-CB 3.24Å; C307-L311 WeakPolarHBondContact O-CB 3.48Å; C307-L311 WeakPolarHBondContact O-CD1 3.47Å; C307-L311 VanDerWaalsContact O-CG 3.31Å; C307-L311 WeakPolarHBondContact O-CG 3.12Å; C307-L311 PolarHBondContact O-N 3.05Å; A308-L311 PolarHBondContact O-N 2.94Å |
| 312 | G | 64.2 | Low | 64.2 | Low | 42 Ų | 42 | 117.7 Ų | 117.7 | 43% | 0.433 | 63% | 0.632 | S | S | . | * | S | Bend | trans | -165.8 | 105.6 | -172.7 | 0 | 0 | 0 | 0 | 0 | 116.6 | A308 | A308-G312 CarbonylContact O-C 3.56Å; A308-G312 WeakPolarHBondContact O-CA 3.42Å; A308-G312 PolarHBondContact O-N 2.57Å; A308-G312 VanDerWaalsContact O-O 3.12Å |
| 313 | R | 51.1 | Low | 62.2 | Low | 243 Ų | 243 | 122.5 Ų | 122.5 | 92% | 0.917 | 66% | 0.662 | S | S | * | * | trans | 67.7 | 124.9 | 152.8 | -70.6 | 177.6 | 169.5 | 163.6 | -2.9 | 119.2 | ||||
| 314 | A | 45.8 | Very low | 59.9 | Low | 88 Ų | 88 | 125.5 Ų | 125.5 | 73% | 0.727 | 69% | 0.691 | S | S | * | * | trans | -42.1 | 141.1 | 156.2 | 0 | 0 | 0 | 0 | 0 | 110.9 | R316 | A314-R316 PolarHBondContact O-N 2.88Å; A314-R316 VanDerWaalsContact O-N 3.15Å | ||
| 315 | P | 46.8 | Very low | 57.9 | Low | 123 Ų | 123 | 123.5 Ų | 123.5 | 80% | 0.799 | 71% | 0.707 | S | S | * | * | trans | -63.4 | 123.4 | 174.2 | 24.2 | -25.7 | 0 | 0 | 0 | 107.7 | R317 | P315-R317 VanDerWaalsContact C-N 3.34Å; P315-R317 PolarHBondContact O-N 3.21Å | ||
| 316 | R | 43.4 | Very low | 55.6 | Low | 255 Ų | 255 | 119.8 Ų | 119.8 | 96% | 0.962 | 71% | 0.709 | S | S | * | * | trans | -50.9 | 106.8 | 157.6 | -97 | -179.4 | 162.4 | 179.1 | -6 | 106.8 | A314 | A314-R316 PolarHBondContact O-N 2.88Å; A314-R316 VanDerWaalsContact O-N 3.15Å | ||
| 317 | R | 47.4 | Very low | 53.3 | Low | 238 Ų | 238 | 125.1 Ų | 125.1 | 90% | 0.898 | 74% | 0.744 | S | S | * | * | trans | -60.9 | 140 | 165.6 | -116.1 | 176.3 | 174.3 | 176.2 | -2.6 | 107.9 | P315 | P315-R317 VanDerWaalsContact C-N 3.34Å; P315-R317 PolarHBondContact O-N 3.21Å | ||
| 318 | A | 48.9 | Very low | 50.9 | Low | 98 Ų | 98 | 126.1 Ų | 126.1 | 81% | 0.81 | 76% | 0.763 | S | S | * | * | trans | 60.6 | 102.1 | 159.3 | 0 | 0 | 0 | 0 | 0 | 117.8 | ||||
| 319 | S | 40.8 | Very low | 48.4 | Very low | 119 Ų | 119 | 129.5 Ų | 129.5 | 83% | 0.832 | 78% | 0.778 | S | S | * | * | -112.3 | 99.1 | 126.7 | -169 | 0 | 0 | 0 | 0 | 105.6 | R321 | S319-R321 PolarHBondContact O-N 3.4Š| |||
| 320 | G | 41.2 | Very low | 46.3 | Very low | 62 Ų | 62 | 135.5 Ų | 135.5 | 64% | 0.639 | 79% | 0.791 | S | S | * | * | trans | -55.8 | 120.2 | 167.2 | 0 | 0 | 0 | 0 | 0 | 107.9 | V322 | G320-V322 PolarHBondContact O-N 2.88Š| ||
| 321 | R | 39.7 | Very low | 43.9 | Very low | 245 Ų | 245 | 134.8 Ų | 134.8 | 93% | 0.925 | 80% | 0.797 | S | S | * | * | trans | -74.1 | 87.7 | 156.7 | -80.1 | -176.9 | -178.5 | 170.6 | -1.2 | 106.1 | S319 | S319-R321 PolarHBondContact O-N 3.4Š| ||
| 322 | V | 47 | Very low | 41.6 | Very low | 129 Ų | 129 | 131 Ų | 131 | 78% | 0.782 | 80% | 0.795 | S | S | * | * | trans | -90.5 | 100.6 | 151.4 | 178.5 | 0 | 0 | 0 | 0 | 105.1 | G320 | G320-V322 PolarHBondContact O-N 2.88Š| ||
| 323 | C | 39.1 | Very low | 39.9 | Very low | 118 Ų | 118 | 134.3 Ų | 134.3 | 80% | 0.797 | 81% | 0.812 | S | S | * | * | trans | -116.7 | 89.3 | 150.3 | -66 | 0 | 0 | 0 | 0 | 103.4 | ||||
| 324 | A | 37.4 | Very low | 38.8 | Very low | 86 Ų | 86 | 128.6 Ų | 128.6 | 71% | 0.711 | 80% | 0.804 | S | S | * | * | 55.3 | 84.4 | 95.6 | 0 | 0 | 0 | 0 | 0 | 110.7 | |||||
| 325 | A | 43.8 | Very low | 38.3 | Very low | 109 Ų | 109 | 132.3 Ų | 132.3 | 90% | 0.901 | 81% | 0.811 | S | S | * | * | trans | -68.3 | 127.2 | 157 | 0 | 0 | 0 | 0 | 0 | 107.4 | ||||
| 326 | A | 37.8 | Very low | 37.6 | Very low | 96 Ų | 96 | 133.2 Ų | 133.2 | 79% | 0.793 | 80% | 0.804 | S | S | * | * | trans | -111.8 | 149.4 | 167.5 | 0 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 327 | P | 38.7 | Very low | 37 | Very low | 128 Ų | 128 | 130.1 Ų | 130.1 | 83% | 0.831 | 79% | 0.792 | S | S | * | * | trans | -104.9 | 155.1 | -154.4 | 19 | 1.1 | 0 | 0 | 0 | 113.9 | ||||
| 328 | G | 33.2 | Very low | 36.1 | Very low | 70 Ų | 70 | 126 Ų | 126 | 72% | 0.722 | 78% | 0.783 | S | S | * | * | trans | 70.1 | 152.7 | 158.3 | 0 | 0 | 0 | 0 | 0 | 115.3 | ||||
| 329 | T | 32.7 | Very low | 35.1 | Very low | 129 Ų | 129 | 126 Ų | 126 | 79% | 0.791 | 78% | 0.778 | S | S | * | * | cis | -167.8 | 136.3 | 20.8 | 27.3 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 330 | H | 35.2 | Very low | 34.5 | Very low | 181 Ų | 181 | 126.1 Ų | 126.1 | 84% | 0.838 | 77% | 0.773 | S | S | * | * | trans | 38.2 | 141.1 | 139.5 | -66 | -82.5 | 0 | 0 | 0 | 121 | ||||
| 331 | S | 29.5 | Very low | 33.9 | Very low | 115 Ų | 115 | 129.6 Ų | 129.6 | 80% | 0.804 | 78% | 0.777 | S | S | * | * | cis | -165.8 | 136.5 | 44.9 | -127.5 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 332 | G | 28.9 | Very low | 33.3 | Very low | 76 Ų | 76 | 124.8 Ų | 124.8 | 78% | 0.784 | 77% | 0.769 | S | S | * | * | 109.5 | 126.4 | 89.6 | 0 | 0 | 0 | 0 | 0 | 108.2 | |||||
| 333 | S | 28.6 | Very low | 32.4 | Very low | 112 Ų | 112 | 122.8 Ų | 122.8 | 78% | 0.783 | 76% | 0.761 | S | S | * | * | -161.8 | 129.3 | 61.8 | 53.8 | 0 | 0 | 0 | 0 | 111.3 | |||||
| 334 | V | 29.9 | Very low | 31.8 | Very low | 124 Ų | 124 | 125 Ų | 125 | 75% | 0.752 | 76% | 0.759 | S | S | * | * | 65.5 | 107.6 | 103.3 | -175.4 | 0 | 0 | 0 | 0 | 115.4 | |||||
| 335 | L | 34.2 | Very low | 31.3 | Very low | 166 Ų | 166 | 127 Ų | 127 | 87% | 0.869 | 76% | 0.762 | S | S | * | * | -162.5 | 113.5 | 119.4 | -101.8 | 160.9 | 0 | 0 | 0 | 110.2 | |||||
| 336 | E | 33.1 | Very low | 30.5 | Very low | 141 Ų | 141 | 127.2 Ų | 127.2 | 66% | 0.659 | 76% | 0.757 | S | S | * | * | trans | -38.8 | 159.7 | 156.6 | -90.8 | 169.7 | 99.9 | 0 | 0 | 113.8 | ||||
| 337 | R | 28.8 | Very low | 30 | Very low | 191 Ų | 191 | 131.5 Ų | 131.5 | 72% | 0.721 | 76% | 0.76 | S | S | * | * | cis | -170 | 132.5 | 37.9 | -128.1 | -177.5 | 168 | 112.7 | -3.3 | 107 | ||||
| 338 | E | 29.7 | Very low | 29.4 | Very low | 151 Ų | 151 | 129.7 Ų | 129.7 | 71% | 0.706 | 76% | 0.757 | S | S | * | * | 87.8 | 101.7 | 101.8 | -163.1 | 176 | 145.5 | 0 | 0 | 113.1 | |||||
| 339 | S | 28.1 | Very low | 29.2 | Very low | 99 Ų | 99 | 130.6 Ų | 130.6 | 69% | 0.692 | 76% | 0.757 | S | S | * | * | 98 | 143 | 91.9 | -136.4 | 0 | 0 | 0 | 0 | 109.4 | |||||
| 340 | T | 28.6 | Very low | 28.9 | Very low | 120 Ų | 120 | 131.9 Ų | 131.9 | 74% | 0.736 | 76% | 0.759 | S | S | * | * | cis | -171.3 | 127.3 | 37.1 | 2.7 | 0 | 0 | 0 | 0 | 103.5 | ||||
| 341 | D | 27.3 | Very low | 28.4 | Very low | 136 Ų | 136 | 127 Ų | 127 | 73% | 0.727 | 75% | 0.75 | S | S | * | * | 75.8 | 128.3 | 82.7 | -134.2 | 2.8 | 0 | 0 | 0 | 117.1 | |||||
| 342 | L | 27.7 | Very low | 28.2 | Very low | 144 Ų | 144 | 129.6 Ų | 129.6 | 75% | 0.754 | 75% | 0.754 | S | S | * | * | trans | 63.4 | 140.9 | 154.5 | -74.1 | 143.4 | 0 | 0 | 0 | 119.4 | ||||
| 343 | S | 27.3 | Very low | 28.3 | Very low | 86 Ų | 86 | 134.1 Ų | 134.1 | 60% | 0.601 | 75% | 0.754 | S | S | * | * | cis | 179.1 | 171.4 | 15.9 | 49.3 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 344 | H | 27.8 | Very low | 28.5 | Very low | 166 Ų | 166 | 134.3 Ų | 134.3 | 77% | 0.769 | 75% | 0.753 | S | S | * | * | trans | 73.8 | 111 | 153.6 | -76.1 | -73 | 0 | 0 | 0 | 120.5 | ||||
| 345 | V | 26.7 | Very low | 28.5 | Very low | 128 Ų | 128 | 134 Ų | 134 | 78% | 0.776 | 76% | 0.755 | S | S | * | * | 83 | 110.2 | 81.9 | 170.9 | 0 | 0 | 0 | 0 | 114.3 | |||||
| 346 | S | 26.5 | Very low | 28.5 | Very low | 112 Ų | 112 | 132.1 Ų | 132.1 | 78% | 0.783 | 75% | 0.753 | S | S | * | * | 139.7 | 128.2 | 124 | -157.8 | 0 | 0 | 0 | 0 | 114.7 | |||||
| 347 | E | 27.5 | Very low | 28.2 | Very low | 186 Ų | 186 | 128.8 Ų | 128.8 | 87% | 0.869 | 76% | 0.757 | S | S | * | * | trans | -49.7 | 142.4 | 151.7 | -115.1 | 160.2 | 113.3 | 0 | 0 | 112.1 | ||||
| 348 | A | 27 | Very low | 28.2 | Very low | 91 Ų | 91 | 124.4 Ų | 124.4 | 75% | 0.752 | 76% | 0.761 | S | S | * | * | 165.7 | 130.5 | 122.1 | 0 | 0 | 0 | 0 | 0 | 112.8 | |||||
| 349 | A | 27.9 | Very low | 28.1 | Very low | 88 Ų | 88 | 122.9 Ų | 122.9 | 73% | 0.727 | 77% | 0.767 | S | S | * | * | trans | 59.5 | 118.2 | 133.7 | 0 | 0 | 0 | 0 | 0 | 121.5 | ||||
| 350 | D | 25.9 | Very low | 28.1 | Very low | 156 Ų | 156 | 127 Ų | 127 | 83% | 0.834 | 78% | 0.776 | S | S | * | * | 54.2 | 119.1 | 126.3 | -73.9 | -31.8 | 0 | 0 | 0 | 121.4 | |||||
| 351 | A | 25.7 | Very low | 28.8 | Very low | 79 Ų | 79 | 126.5 Ų | 126.5 | 65% | 0.653 | 77% | 0.774 | S | S | * | * | trans | 56.1 | 113.4 | 132.2 | 0 | 0 | 0 | 0 | 0 | 118 | ||||
| 352 | L | 25.2 | Very low | 28.8 | Very low | 170 Ų | 170 | 125.1 Ų | 125.1 | 89% | 0.89 | 77% | 0.774 | S | S | * | * | -179.1 | 128 | 104.3 | -109.6 | 95.7 | 0 | 0 | 0 | 110.1 | |||||
| 353 | H | 30.5 | Very low | 28.8 | Very low | 170 Ų | 170 | 124.3 Ų | 124.3 | 79% | 0.787 | 78% | 0.775 | S | S | * | * | trans | -50.1 | 159.6 | 152.9 | -92.4 | -75.5 | 0 | 0 | 0 | 110.7 | ||||
| 354 | P | 33.6 | Very low | 28.9 | Very low | 116 Ų | 116 | 128.6 Ų | 128.6 | 75% | 0.753 | 79% | 0.79 | S | S | * | * | cis | -153.1 | 163.6 | 49.1 | 37.1 | -14 | 0 | 0 | 0 | 118.4 | ||||
| 355 | C | 29.1 | Very low | 29.1 | Very low | 117 Ų | 117 | 128.4 Ų | 128.4 | 79% | 0.791 | 79% | 0.79 | S | S | * | * | trans | -66.7 | 148.5 | 154.8 | -67.4 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 356 | P | 34.4 | Very low | 29.9 | Very low | 127 Ų | 127 | 128.2 Ų | 128.2 | 83% | 0.825 | 79% | 0.791 | S | S | * | * | -143.1 | 156.5 | 114.9 | 35.2 | -20.4 | 0 | 0 | 0 | 110 | |||||
| 357 | G | 27.2 | Very low | 30 | Very low | 72 Ų | 72 | 125.4 Ų | 125.4 | 74% | 0.742 | 78% | 0.78 | S | S | * | * | cis | 158.6 | 167 | 13.9 | 0 | 0 | 0 | 0 | 0 | 106.7 | ||||
| 358 | A | 28.2 | Very low | 30.9 | Very low | 98 Ų | 98 | 123 Ų | 123 | 81% | 0.81 | 78% | 0.78 | S | S | * | * | trans | 96.2 | 130.7 | 156.3 | 0 | 0 | 0 | 0 | 0 | 122.1 | ||||
| 359 | S | 28.5 | Very low | 31.1 | Very low | 119 Ų | 119 | 122 Ų | 122 | 83% | 0.832 | 78% | 0.779 | S | S | * | * | trans | 89.3 | 104.9 | 143.3 | 55.5 | 0 | 0 | 0 | 0 | 122.3 | ||||
| 360 | Q | 28.7 | Very low | 32.2 | Very low | 187 Ų | 187 | 123.7 Ų | 123.7 | 87% | 0.874 | 78% | 0.782 | S | S | * | * | trans | -72.7 | -178.7 | 144 | -89.2 | -176.8 | -10.4 | 0 | 0 | 111 | ||||
| 361 | P | 43.4 | Very low | 32.4 | Very low | 108 Ų | 108 | 120.4 Ų | 120.4 | 70% | 0.701 | 77% | 0.772 | S | S | * | * | cis | -143.6 | -169.5 | 9.4 | 27 | 0.5 | 0 | 0 | 0 | 117.3 | ||||
| 362 | C | 25.3 | Very low | 32.6 | Very low | 108 Ų | 108 | 126.1 Ų | 126.1 | 73% | 0.73 | 78% | 0.776 | S | S | * | * | trans | 96.5 | 97.1 | 154.2 | -63.7 | 0 | 0 | 0 | 0 | 118.8 | ||||
| 363 | T | 28.8 | Very low | 32.8 | Very low | 126 Ų | 126 | 127.1 Ų | 127.1 | 77% | 0.773 | 77% | 0.768 | S | S | * | * | 76.4 | 119.5 | 81 | 55.2 | 0 | 0 | 0 | 0 | 117.1 | |||||
| 364 | L | 28.3 | Very low | 32.8 | Very low | 177 Ų | 177 | 121.9 Ų | 121.9 | 93% | 0.927 | 76% | 0.761 | S | S | * | * | 178.4 | 121.2 | 126.5 | -99.3 | 143.3 | 0 | 0 | 0 | 113.3 | |||||
| 365 | E | 32.5 | Very low | 33.4 | Very low | 162 Ų | 162 | 122.1 Ų | 122.1 | 76% | 0.757 | 76% | 0.762 | S | S | * | * | trans | -79 | 165.4 | 161.8 | -104.2 | -94.5 | 142.9 | 0 | 0 | 109.7 | G367 | E365-G367 PolarHBondContact OE2-N 3.32Š| ||
| 366 | P | 43.8 | Very low | 33.5 | Very low | 123 Ų | 123 | 126.5 Ų | 126.5 | 80% | 0.799 | 77% | 0.768 | S | S | * | * | -152.5 | 161.4 | 70.2 | 35.2 | -11.9 | 0 | 0 | 0 | 118.9 | |||||
| 367 | G | 29.7 | Very low | 33.4 | Very low | 54 Ų | 54 | 125.7 Ų | 125.7 | 56% | 0.557 | 77% | 0.772 | S | S | * | * | trans | -63.6 | -168.6 | 169 | 0 | 0 | 0 | 0 | 0 | 116.6 | E365 | E365-G367 PolarHBondContact OE2-N 3.32Š| ||
| 368 | P | 45.2 | Very low | 33.5 | Very low | 135 Ų | 135 | 125.9 Ų | 125.9 | 88% | 0.877 | 77% | 0.774 | S | S | * | * | -148.7 | 170 | 65.7 | 36 | -14.1 | 0 | 0 | 0 | 117.7 | |||||
| 369 | G | 31.3 | Very low | 33.6 | Very low | 70 Ų | 70 | 129 Ų | 129 | 72% | 0.722 | 78% | 0.777 | S | S | * | * | trans | -89.7 | -151.2 | 163.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 370 | P | 50.3 | Low | 33.7 | Very low | 123 Ų | 123 | 129.2 Ų | 129.2 | 80% | 0.799 | 78% | 0.779 | S | S | * | * | cis | -136.1 | -179.1 | -0.6 | 34.8 | -10.6 | 0 | 0 | 0 | 114.4 | ||||
| 371 | S | 30.5 | Very low | 33.7 | Very low | 87 Ų | 87 | 127.6 Ų | 127.6 | 61% | 0.608 | 77% | 0.774 | S | S | * | * | 152.3 | 160 | 82.5 | 51.6 | 0 | 0 | 0 | 0 | 114.6 | |||||
| 372 | W | 29.6 | Very low | 33 | Very low | 199 Ų | 199 | 130.2 Ų | 130.2 | 75% | 0.754 | 78% | 0.781 | S | S | * | * | trans | 91.5 | 133.6 | 158.3 | -59.4 | 113.2 | 0 | 0 | 0 | 119.2 | ||||
| 373 | R | 30.2 | Very low | 33.3 | Very low | 191 Ų | 191 | 131 Ų | 131 | 72% | 0.721 | 78% | 0.783 | S | S | * | * | cis | -168.1 | 140.9 | 6.7 | -158 | 172.2 | -64.3 | -108.4 | 4.7 | 109.3 | ||||
| 374 | G | 30.5 | Very low | 33.3 | Very low | 61 Ų | 61 | 131.1 Ų | 131.1 | 63% | 0.629 | 78% | 0.783 | S | S | * | * | trans | -96.5 | 175.5 | 158.8 | 0 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 375 | P | 45.9 | Very low | 33.5 | Very low | 121 Ų | 121 | 130 Ų | 130 | 79% | 0.786 | 78% | 0.778 | S | S | * | * | -157.8 | 159 | 92.8 | 37.5 | -16.7 | 0 | 0 | 0 | 119.1 | |||||
| 376 | K | 31.1 | Very low | 33.5 | Very low | 209 Ų | 209 | 128.2 Ų | 128.2 | 91% | 0.909 | 78% | 0.778 | S | S | * | * | trans | 88.8 | 136.8 | 138.1 | -80.7 | 171.6 | -175.5 | -173 | 0 | 122.6 | ||||
| 377 | A | 33.3 | Very low | 33.4 | Very low | 109 Ų | 109 | 132 Ų | 132 | 90% | 0.901 | 80% | 0.8 | S | S | * | * | trans | -93.8 | 165.3 | -174.6 | 0 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 378 | G | 27.6 | Very low | 33.6 | Very low | 76 Ų | 76 | 136 Ų | 136 | 78% | 0.784 | 81% | 0.812 | S | S | * | * | trans | -163 | 116.8 | 162.8 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 379 | N | 30.6 | Very low | 33 | Very low | 163 Ų | 163 | 136 Ų | 136 | 87% | 0.872 | 81% | 0.808 | S | S | * | * | trans | -55.8 | 146.7 | 169.2 | -84.6 | -12.1 | 0 | 0 | 0 | 111.9 | ||||
| 380 | S | 30.1 | Very low | 33.1 | Very low | 125 Ų | 125 | 139.7 Ų | 139.7 | 87% | 0.874 | 81% | 0.813 | S | S | * | * | trans | -171.5 | 133.2 | 133.4 | -78.7 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 381 | I | 30 | Very low | 32.1 | Very low | 153 Ų | 153 | 140.6 Ų | 140.6 | 79% | 0.785 | 81% | 0.814 | S | S | * | * | trans | -72.7 | 141 | 171.4 | -67.4 | 164.1 | 0 | 0 | 0 | 109.2 | ||||
| 382 | L | 28.3 | Very low | 32.2 | Very low | 162 Ų | 162 | 144 Ų | 144 | 85% | 0.848 | 83% | 0.827 | S | S | * | * | trans | -165.4 | 120.6 | 136.5 | -128.7 | 98.2 | 0 | 0 | 0 | 112.1 | ||||
| 383 | T | 31.6 | Very low | 32.3 | Very low | 125 Ų | 125 | 140.3 Ų | 140.3 | 77% | 0.767 | 83% | 0.832 | S | S | * | * | trans | -70.6 | 141.4 | 160.9 | 41.4 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 384 | V | 29.8 | Very low | 32.5 | Very low | 128 Ų | 128 | 136.7 Ų | 136.7 | 78% | 0.776 | 84% | 0.84 | S | S | * | * | trans | -154.8 | 125.5 | 144.7 | 179.7 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 385 | D | 30.7 | Very low | 32.6 | Very low | 154 Ų | 154 | 142.5 Ų | 142.5 | 82% | 0.824 | 86% | 0.856 | S | S | * | * | trans | -56.8 | 145.5 | 165 | -89.7 | -51.1 | 0 | 0 | 0 | 113.8 | ||||
| 386 | V | 34.4 | Very low | 31.5 | Very low | 125 Ų | 125 | 144.3 Ų | 144.3 | 76% | 0.758 | 86% | 0.862 | S | S | * | * | trans | -144.5 | 98.9 | 154.5 | -176.4 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 387 | T | 41.2 | Very low | 31.6 | Very low | 203 Ų | 203 | 138.5 Ų | 138.5 | 100% | 1.245 | 86% | 0.857 | S | S | * | * | trans | 43.4 | 0 | 138.4 | 64.1 | 0 | 0 | 0 | 0 | 121.6 |
Retrieved 387 of 387 residues in 221.9 ms
(Link to these results)