| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 39.2 | Very low | 36.2 | Very low | 248 Ų | 248 | 143.9 Ų | 143.9 | 100% | 1.222 | 75% | 0.751 | S | S | * | * | 0 | 61.6 | 0 | -74.1 | 176.8 | 171.8 | 0 | 0 | 108.3 | |||||
| 2 | E | 37.1 | Very low | 36.4 | Very low | 198 Ų | 198 | 147.6 Ų | 147.6 | 93% | 0.925 | 76% | 0.757 | S | S | * | * | trans | -112.6 | 100.8 | -176.9 | -66.3 | 175.6 | 160.1 | 0 | 0 | 106 | ||||
| 3 | G | 33.7 | Very low | 36.2 | Very low | 43 Ų | 43 | 143.5 Ų | 143.5 | 44% | 0.443 | 76% | 0.759 | S | S | . | * | trans | -172.6 | 0 | -175.3 | 0 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 4 | W | 33.3 | Very low | 36.2 | Very low | 243 Ų | 243 | 143.8 Ų | 143.8 | 92% | 0.92 | 76% | 0.761 | S | S | * | * | S | Bend | trans | -114.8 | 5.1 | -178.4 | -75.3 | 71.7 | 0 | 0 | 0 | 114.1 | ||
| 5 | S | 40 | Very low | 36.1 | Very low | 101 Ų | 101 | 139.8 Ų | 139.8 | 71% | 0.706 | 77% | 0.768 | S | S | * | * | S | Bend | trans | -94.2 | -6.9 | 176.4 | 53.1 | 0 | 0 | 0 | 0 | 114.5 | ||
| 6 | S | 35.7 | Very low | 35.9 | Very low | 77 Ų | 77 | 135.3 Ų | 135.3 | 54% | 0.538 | 76% | 0.764 | S | S | . | * | S | Bend | trans | -95.5 | -5.9 | -174.8 | 55.6 | 0 | 0 | 0 | 0 | 115.2 | S9 | S6-S9 PolarHBondContact O-OG 3.26Å; S6-S9 VanDerWaalsContact O-OG 3.11Å |
| 7 | L | 38 | Very low | 36.2 | Very low | 136 Ų | 136 | 134.4 Ų | 134.4 | 71% | 0.712 | 76% | 0.755 | S | S | * | * | S | Bend | trans | -89.9 | -9.8 | 179.3 | -84.3 | 157.7 | 0 | 0 | 0 | 114 | ||
| 8 | S | 41.1 | Very low | 36.5 | Very low | 105 Ų | 105 | 133.5 Ų | 133.5 | 73% | 0.734 | 75% | 0.748 | S | S | * | * | S | Bend | trans | -93.5 | -2.2 | 174.7 | 59.8 | 0 | 0 | 0 | 0 | 114 | ||
| 9 | S | 33.9 | Very low | 37 | Very low | 84 Ų | 84 | 131.8 Ų | 131.8 | 59% | 0.587 | 75% | 0.745 | S | S | * | * | trans | -95.9 | 4.7 | -177.7 | 56.4 | 0 | 0 | 0 | 0 | 114.9 | S6 R11 | S6-S9 PolarHBondContact O-OG 3.26Å; S6-S9 VanDerWaalsContact O-OG 3.11Å; S9-R11 PolarHBondContact O-N 3.47Å | ||
| 10 | I | 34.3 | Very low | 37.6 | Very low | 120 Ų | 120 | 127.3 Ų | 127.3 | 62% | 0.615 | 73% | 0.729 | S | S | * | * | trans | -75 | 68.4 | 163.4 | -52.1 | 179.5 | 0 | 0 | 0 | 108 | F12 | I10-F12 HydrophobicContact CG2-CD2 4.39Å; I10-F12 HydrophobicContact CG2-CE2 4.12Å; I10-F12 PolarHBondContact O-N 3.34Å | ||
| 11 | R | 31.3 | Very low | 38.4 | Very low | 228 Ų | 228 | 123.7 Ų | 123.7 | 86% | 0.86 | 71% | 0.708 | S | S | * | * | trans | -65.9 | 106.9 | 162 | -77.7 | -174.4 | -165.8 | 173.7 | 4.9 | 106.6 | S9 A13 | S9-R11 PolarHBondContact O-N 3.47Å; R11-A13 PolarHBondContact O-N 3.25Å | ||
| 12 | F | 38.8 | Very low | 39.3 | Very low | 188 Ų | 188 | 118.5 Ų | 118.5 | 83% | 0.825 | 68% | 0.681 | S | S | * | * | trans | -58.8 | 106.2 | 162.8 | -81.3 | -88.1 | 0 | 0 | 0 | 108.7 | I10 N14 | I10-F12 HydrophobicContact CG2-CD2 4.39Å; I10-F12 HydrophobicContact CG2-CE2 4.12Å; I10-F12 PolarHBondContact O-N 3.34Å; F12-N14 PolarHBondContact O-N 3.12Å; F12-N14 VanDerWaalsContact O-N 3.13Å | ||
| 13 | A | 34.3 | Very low | 40.7 | Very low | 94 Ų | 94 | 113.1 Ų | 113.1 | 78% | 0.777 | 66% | 0.661 | S | S | * | * | trans | -66.6 | 98.6 | 164.2 | 0 | 0 | 0 | 0 | 0 | 108.4 | R11 | R11-A13 PolarHBondContact O-N 3.25Š| ||
| 14 | N | 36.6 | Very low | 42.2 | Very low | 148 Ų | 148 | 112.5 Ų | 112.5 | 79% | 0.791 | 65% | 0.651 | S | S | * | * | trans | -153.7 | 85.1 | 158.2 | -103 | -12.5 | 0 | 0 | 0 | 109.3 | F12 G16 | F12-N14 PolarHBondContact O-N 3.12Å; F12-N14 VanDerWaalsContact O-N 3.13Å; N14-G16 VanDerWaalsContact C-N 3.3Å; N14-G16 PolarHBondContact O-N 3.48Å | ||
| 15 | G | 34.7 | Very low | 43.8 | Very low | 84 Ų | 84 | 102.9 Ų | 102.9 | 87% | 0.866 | 62% | 0.618 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79.5 | 55.6 | -176.1 | 0 | 0 | 0 | 0 | 0 | 115 | ||
| 16 | G | 32.7 | Very low | 45.6 | Very low | 68 Ų | 68 | 101.3 Ų | 101.3 | 70% | 0.701 | 61% | 0.607 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -132.6 | -4.5 | -179.7 | 0 | 0 | 0 | 0 | 0 | 117 | N14 | N14-G16 VanDerWaalsContact C-N 3.3Å; N14-G16 PolarHBondContact O-N 3.48Å |
| 17 | I | 40.3 | Very low | 47.9 | Very low | 119 Ų | 119 | 102 Ų | 102 | 61% | 0.61 | 61% | 0.608 | S | S | * | * | trans | -116.4 | 27.4 | -172.4 | -52.8 | 169.9 | 0 | 0 | 0 | 111.8 | N21 | I17-N21 VanDerWaalsContact O-CB 3.29Å; I17-N21 WeakPolarHBondContact O-CB 3.32Å; I17-N21 VanDerWaalsContact O-CG 3.28Å; I17-N21 PolarHBondContact O-ND2 3.01Å | ||
| 18 | L | 41.3 | Very low | 50.2 | Low | 119 Ų | 119 | 95.8 Ų | 95.8 | 62% | 0.623 | 58% | 0.576 | S | S | * | * | H | α-helix | trans | -80.8 | -36.8 | -173.1 | -84.7 | 154 | 0 | 0 | 0 | 114.5 | N21 E22 | L18-N21 PolarHBondContact O-N 3.5Å; L18-E22 PolarHBondContact O-N 3.44Å |
| 19 | S | 46.5 | Very low | 52.3 | Low | 101 Ų | 101 | 92.8 Ų | 92.8 | 71% | 0.706 | 55% | 0.55 | S | S | * | . | H | α-helix | trans | -75.3 | -33 | -175.1 | 56.3 | 0 | 0 | 0 | 0 | 114.7 | ||
| 20 | G | 50.2 | Low | 54.8 | Low | 41 Ų | 41 | 93.6 Ų | 93.6 | 42% | 0.423 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -78.2 | -25.6 | 172.9 | 0 | 0 | 0 | 0 | 0 | 113.5 | T23 S24 | G20-T23 PolarHBondContact O-OG1 3.32Å; G20-T23 VanDerWaalsContact O-OG1 3.08Å; G20-S24 PolarHBondContact O-N 3.09Å; G20-S24 PolarHBondContact O-OG 3.32Å |
| 21 | N | 53.6 | Low | 57.3 | Low | 52 Ų | 52 | 90.8 Ų | 90.8 | 28% | 0.278 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -75.7 | -39.6 | 178.4 | -86.5 | -1.6 | 0 | 0 | 0 | 112.1 | I17 L18 T23 S24 V25 | I17-N21 VanDerWaalsContact O-CB 3.29Å; I17-N21 WeakPolarHBondContact O-CB 3.32Å; I17-N21 VanDerWaalsContact O-CG 3.28Å; I17-N21 PolarHBondContact O-ND2 3.01Å; L18-N21 PolarHBondContact O-N 3.5Å; N21-T23 VanDerWaalsContact C-N 3.33Å; N21-T23 PolarHBondContact O-N 2.99Å; N21-S24 WeakPolarHBondContact CA-OG 3.39Å; N21-S24 PolarHBondContact O-N 3.08Å; N21-S24 PolarHBondContact O-OG 3.02Å; N21-V25 WeakPolarHBondContact O-CB 3.46Å; N21-V25 WeakPolarHBondContact O-CG2 3.34Å; N21-V25 PolarHBondContact O-N 3.37Å |
| 22 | E | 58.5 | Low | 59.9 | Low | 140 Ų | 140 | 80.8 Ų | 80.8 | 65% | 0.654 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -63.3 | -39.4 | 178.4 | -72.2 | -176.5 | 163.6 | 0 | 0 | 112.8 | L18 S26 | L18-E22 PolarHBondContact O-N 3.44Å; E22-S26 WeakPolarHBondContact O-CB 3.44Å; E22-S26 PolarHBondContact O-N 3.38Å; E22-S26 PolarHBondContact O-OG 3.31Å |
| 23 | T | 66.9 | Low | 62 | Low | 84 Ų | 84 | 73.1 Ų | 73.1 | 52% | 0.515 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -70.1 | -38.4 | 177.2 | 56.1 | 0 | 0 | 0 | 0 | 112.2 | G20 N21 S26 V27 | G20-T23 PolarHBondContact O-OG1 3.32Å; G20-T23 VanDerWaalsContact O-OG1 3.08Å; N21-T23 VanDerWaalsContact C-N 3.33Å; N21-T23 PolarHBondContact O-N 2.99Å; T23-S26 PolarHBondContact O-N 3.13Å; T23-S26 PolarHBondContact O-OG 3.05Å; T23-V27 VanDerWaalsContact O-CG2 3.3Å; T23-V27 WeakPolarHBondContact O-CG2 3.38Å; T23-V27 PolarHBondContact O-N 3.45Å |
| 24 | S | 63.4 | Low | 64.4 | Low | 31 Ų | 31 | 69.9 Ų | 69.9 | 22% | 0.217 | 44% | 0.438 | C | S | . | . | H | α-helix | trans | -71.6 | -38.2 | 175.7 | 51.7 | 0 | 0 | 0 | 0 | 112.8 | G20 N21 S26 V27 C28 P255 | G20-S24 PolarHBondContact O-N 3.09Å; G20-S24 PolarHBondContact O-OG 3.32Å; N21-S24 WeakPolarHBondContact CA-OG 3.39Å; N21-S24 PolarHBondContact O-N 3.08Å; N21-S24 PolarHBondContact O-OG 3.02Å; S24-S26 VanDerWaalsContact C-N 3.29Å; S24-S26 PolarHBondContact O-N 2.79Å; S24-V27 PolarHBondContact O-N 2.9Å; S24-C28 PolarHBondContact O-N 2.98Å; S24-P255 VanDerWaalsContact OG-CG 3.23Å; S24-P255 WeakPolarHBondContact OG-CG 3.21Å |
| 25 | V | 68.7 | Low | 66.7 | Low | 40 Ų | 40 | 65.9 Ų | 65.9 | 24% | 0.242 | 42% | 0.415 | C | S | . | . | H | α-helix | trans | -53.3 | -50.5 | 168.1 | 174.1 | 0 | 0 | 0 | 0 | 109.4 | N21 V27 C28 K29 P255 | N21-V25 WeakPolarHBondContact O-CB 3.46Å; N21-V25 WeakPolarHBondContact O-CG2 3.34Å; N21-V25 PolarHBondContact O-N 3.37Å; V25-V27 PolarHBondContact O-N 3.45Å; V25-C28 PolarHBondContact O-N 3.33Å; V25-K29 WeakPolarHBondContact O-CB 3.4Å; V25-K29 PolarHBondContact O-N 3.29Å; V25-P255 HydrophobicContact CB-CB 4.03Å; V25-P255 HydrophobicContact CG2-CB 3.29Å; V25-P255 HydrophobicContact CG2-CG 3.81Å |
| 26 | S | 77.1 | Confident | 68.9 | Low | 68 Ų | 68 | 66.8 Ų | 66.8 | 48% | 0.476 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -65 | -41 | -174.7 | 72 | 0 | 0 | 0 | 0 | 112.2 | E22 T23 S24 L30 | E22-S26 WeakPolarHBondContact O-CB 3.44Å; E22-S26 PolarHBondContact O-N 3.38Å; E22-S26 PolarHBondContact O-OG 3.31Å; T23-S26 PolarHBondContact O-N 3.13Å; T23-S26 PolarHBondContact O-OG 3.05Å; S24-S26 VanDerWaalsContact C-N 3.29Å; S24-S26 PolarHBondContact O-N 2.79Å; S26-L30 WeakPolarHBondContact O-CB 3.47Å; S26-L30 PolarHBondContact O-N 3.06Å |
| 27 | V | 84.8 | Confident | 70.6 | Confident | 93 Ų | 93 | 70 Ų | 70 | 56% | 0.564 | 41% | 0.407 | S | S | * | . | H | α-helix | trans | -65.8 | -47.7 | 177.2 | 174 | 0 | 0 | 0 | 0 | 112 | T23 S24 V25 K29 L30 | T23-V27 VanDerWaalsContact O-CG2 3.3Å; T23-V27 WeakPolarHBondContact O-CG2 3.38Å; T23-V27 PolarHBondContact O-N 3.45Å; S24-V27 PolarHBondContact O-N 2.9Å; V25-V27 PolarHBondContact O-N 3.45Å; V27-K29 VanDerWaalsContact C-N 3.32Å; V27-K29 PolarHBondContact O-N 2.88Å; V27-L30 VanDerWaalsContact O-CB 3.28Å; V27-L30 WeakPolarHBondContact O-CB 3.13Å; V27-L30 PolarHBondContact O-N 3.12Å |
| 28 | C | 86.1 | Confident | 71.8 | Confident | 5 Ų | 5 | 69 Ų | 69 | 3% | 0.034 | 41% | 0.41 | C | S | . | . | H | α-helix | trans | -67.7 | -35.7 | -179.9 | -67.9 | 0 | 0 | 0 | 0 | 112.2 | S24 V25 L30 V31 L258 C259 | S24-C28 PolarHBondContact O-N 2.98Å; V25-C28 PolarHBondContact O-N 3.33Å; C28-L30 VanDerWaalsContact C-N 3.31Å; C28-V31 PolarHBondContact O-N 2.95Å; C28-L258 HydrophobicContact CB-CB 3.76Å; C28-C259 WeakPolarHBondContact CA-SG 3.39Å; C28-C259 HydrophobicContact CB-CB 4.02Å; C28-C259 WeakPolarHBondContact CB-SG 3.49Å; C28-C259 WeakPolarHBondContact SG-CB 3.41Å; C28-C259 CovalentContact SG-SG 2.03Å; C28-C259 PolarHBondContact SG-SG 3.23Å |
| 29 | K | 85 | Confident | 73 | Confident | 42 Ų | 42 | 68 Ų | 68 | 18% | 0.183 | 41% | 0.405 | C | S | . | . | H | α-helix | trans | -66.9 | -33.5 | 175.3 | -168 | 176.3 | -173.1 | 175.1 | 0 | 112 | V25 V27 V31 F32 T33 R178 I186 | V25-K29 WeakPolarHBondContact O-CB 3.4Å; V25-K29 PolarHBondContact O-N 3.29Å; V27-K29 VanDerWaalsContact C-N 3.32Å; V27-K29 PolarHBondContact O-N 2.88Å; K29-V31 PolarHBondContact O-N 2.89Å; K29-F32 PolarHBondContact O-N 3.44Å; K29-T33 HydrophobicContact CG-CG2 4.06Å; K29-T33 PolarHBondContact O-N 3.01Å; K29-T33 PolarHBondContact O-OG1 3.44Å; K29-R178 PolarHBondContact NZ-O 3.23Å; K29-I186 HydrophobicContact CD-CD1 4.16Å; K29-I186 HydrophobicContact CG-CD1 3.52Å |
| 30 | L | 85.9 | Confident | 74.4 | Confident | 101 Ų | 101 | 64.2 Ų | 64.2 | 53% | 0.529 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -57.2 | -31.2 | 177.5 | -171.7 | 66.2 | 0 | 0 | 0 | 112.7 | S26 V27 C28 F32 T33 S34 | S26-L30 WeakPolarHBondContact O-CB 3.47Å; S26-L30 PolarHBondContact O-N 3.06Å; V27-L30 VanDerWaalsContact O-CB 3.28Å; V27-L30 WeakPolarHBondContact O-CB 3.13Å; V27-L30 PolarHBondContact O-N 3.12Å; C28-L30 VanDerWaalsContact C-N 3.31Å; L30-F32 PolarHBondContact O-N 2.95Å; L30-T33 WeakPolarHBondContact CA-OG1 3.44Å; L30-T33 PolarHBondContact O-N 3.33Å; L30-S34 WeakPolarHBondContact O-CA 3.19Å; L30-S34 WeakPolarHBondContact O-CB 3.4Å; L30-S34 PolarHBondContact O-N 3.28Å; L30-S34 PolarHBondContact O-OG 3.32Å |
| 31 | V | 86.6 | Confident | 75.9 | Confident | 60 Ų | 60 | 63.5 Ų | 63.5 | 36% | 0.364 | 37% | 0.366 | S | S | . | . | H | α-helix | trans | -57.7 | -38.2 | 175.8 | 178.7 | 0 | 0 | 0 | 0 | 111.3 | C28 K29 W44 A262 | C28-V31 PolarHBondContact O-N 2.95Å; K29-V31 PolarHBondContact O-N 2.89Å; V31-W44 HydrophobicContact CG1-CE3 4.1Å; V31-W44 HydrophobicContact CG1-CZ3 3.96Å; V31-A262 HydrophobicContact CG1-CB 4.02Å |
| 32 | F | 85.8 | Confident | 77.4 | Confident | 19 Ų | 19 | 61.4 Ų | 61.4 | 8% | 0.083 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -88.7 | -27 | -179.7 | -60.5 | -79.8 | 0 | 0 | 0 | 113.4 | K29 L30 W44 I186 L258 A262 L265 | K29-F32 PolarHBondContact O-N 3.44Å; L30-F32 PolarHBondContact O-N 2.95Å; F32-W44 HydrophobicContact CD1-CD2 4.19Å; F32-W44 HydrophobicContact CD1-CE3 4.49Å; F32-W44 HydrophobicContact CD1-CZ2 4.43Å; F32-W44 HydrophobicContact CE1-CH2 4.16Å; F32-W44 AromaticContact CE1-CZ2 3.98Å; F32-W44 HydrophobicContact CE1-CZ2 3.98Å; F32-W44 HydrophobicContact CE1-CZ3 4.49Å; F32-I186 HydrophobicContact CB-CD1 4.36Å; F32-I186 HydrophobicContact CB-CG1 4.26Å; F32-I186 HydrophobicContact CB-CG2 4.17Å; F32-I186 HydrophobicContact CG-CG2 4.3Å; F32-L258 HydrophobicContact CE2-CB 4.46Å; F32-A262 HydrophobicContact CE1-CB 4.37Å; F32-A262 HydrophobicContact CE2-CB 4.24Å; F32-A262 HydrophobicContact CZ-CB 3.72Å; F32-L265 HydrophobicContact CE1-CD1 4.29Å |
| 33 | T | 83.6 | Confident | 78.9 | Confident | 27 Ų | 27 | 57.4 Ų | 57.4 | 17% | 0.166 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -105.2 | -3.6 | -174 | 64.8 | 0 | 0 | 0 | 0 | 114.6 | K29 L30 E35 I184 I186 | K29-T33 HydrophobicContact CG-CG2 4.06Å; K29-T33 PolarHBondContact O-N 3.01Å; K29-T33 PolarHBondContact O-OG1 3.44Å; L30-T33 WeakPolarHBondContact CA-OG1 3.44Å; L30-T33 PolarHBondContact O-N 3.33Å; T33-E35 PolarHBondContact O-N 3.49Å; T33-I184 HydrophobicContact CG2-CG2 3.76Å; T33-I186 HydrophobicContact CG2-CD1 3.57Å; T33-I186 HydrophobicContact CG2-CG1 3.79Å |
| 34 | S | 84.9 | Confident | 80 | Confident | 25 Ų | 25 | 54.2 Ų | 54.2 | 18% | 0.175 | 32% | 0.316 | C | S | . | . | trans | -64.1 | 131.3 | 179.5 | 51.5 | 0 | 0 | 0 | 0 | 110.9 | L30 R42 I43 | L30-S34 WeakPolarHBondContact O-CA 3.19Å; L30-S34 WeakPolarHBondContact O-CB 3.4Å; L30-S34 PolarHBondContact O-N 3.28Å; L30-S34 PolarHBondContact O-OG 3.32Å; S34-R42 CarbonylContact O-C 3.52Å; S34-R42 WeakPolarHBondContact O-CA 3.49Å; S34-I43 PolarHBondContact O-N 3.14Å | ||
| 35 | E | 84.5 | Confident | 81.2 | Confident | 65 Ų | 65 | 52.7 Ų | 52.7 | 30% | 0.304 | 31% | 0.305 | S | S | . | . | B | Isolated β-bridge | trans | -116.9 | 153.6 | -179.3 | -64 | -178.6 | 154.7 | 0 | 0 | 110.2 | T33 V41 I184 | T33-E35 PolarHBondContact O-N 3.49Å; E35-V41 WeakPolarHBondContact CA-O 3.47Å; E35-I184 HydrophobicContact CG-CD1 4.18Å; E35-I184 WeakPolarHBondContact OE1-CD1 3.3Å; E35-I184 WeakPolarHBondContact OE1-CG1 3.4Å |
| 36 | F | 80.7 | Confident | 82.3 | Confident | 103 Ų | 103 | 52 Ų | 52 | 45% | 0.452 | 30% | 0.304 | S | S | . | . | trans | -71.5 | 133.7 | 165.4 | -72.4 | -78.5 | 0 | 0 | 0 | 109.6 | S38 N39 V41 I43 A46 | F36-S38 PolarHBondContact O-N 2.86Å; F36-N39 CarbonylContact O-C 3.53Å; F36-N39 PolarHBondContact O-N 2.98Å; F36-V41 HydrophobicContact CD2-CB 4.37Å; F36-V41 HydrophobicContact CD2-CG1 4.31Å; F36-V41 PolarHBondContact N-O 3.31Å; F36-I43 HydrophobicContact CD2-CG1 4.05Å; F36-I43 HydrophobicContact CE1-CG1 4.43Å; F36-I43 HydrophobicContact CE2-CB 4.38Å; F36-I43 HydrophobicContact CE2-CG1 3.85Å; F36-I43 HydrophobicContact CG-CG1 4.43Å; F36-I43 HydrophobicContact CZ-CG1 4.05Å; F36-A46 HydrophobicContact CE2-CB 3.95Å | ||
| 37 | S | 68.7 | Low | 83.1 | Confident | 135 Ų | 135 | 51.9 Ų | 51.9 | 94% | 0.944 | 30% | 0.297 | S | S | * | . | S | Bend | trans | -63.8 | -20 | -170.8 | 77.8 | 0 | 0 | 0 | 0 | 114.8 | ||
| 38 | S | 65.6 | Low | 83.5 | Confident | 97 Ų | 97 | 47.4 Ų | 47.4 | 68% | 0.678 | 27% | 0.27 | S | S | * | . | S | Bend | trans | -92.3 | -34 | -175 | 84.2 | 0 | 0 | 0 | 0 | 113.7 | F36 | F36-S38 PolarHBondContact O-N 2.86Š|
| 39 | N | 66.3 | Low | 83.8 | Confident | 99 Ų | 99 | 50.2 Ų | 50.2 | 53% | 0.529 | 28% | 0.282 | S | S | . | . | S | Bend | trans | -136.5 | 128 | -176.3 | -56 | -1.3 | 0 | 0 | 0 | 104 | F36 V41 | F36-N39 CarbonylContact O-C 3.53Å; F36-N39 PolarHBondContact O-N 2.98Å; N39-V41 HydrophobicContact CB-CG2 4.01Å; N39-V41 PolarHBondContact O-N 3.3Å |
| 40 | S | 75.8 | Confident | 84.3 | Confident | 22 Ų | 22 | 53.8 Ų | 53.8 | 15% | 0.154 | 30% | 0.302 | C | S | . | . | trans | -58.9 | 31.4 | -178.3 | -39.2 | 0 | 0 | 0 | 0 | 115.4 | S103 R183 | S40-S103 WeakPolarHBondContact O-CB 2.92Å; S40-R183 PolarHBondContact OG-NH1 2.85Å | ||
| 41 | V | 82.2 | Confident | 84.8 | Confident | 25 Ų | 25 | 51 Ų | 51 | 15% | 0.152 | 29% | 0.29 | C | S | . | . | trans | -80.1 | 123.2 | 178.3 | 176 | 0 | 0 | 0 | 0 | 108.3 | E35 F36 N39 M100 | E35-V41 WeakPolarHBondContact CA-O 3.47Å; F36-V41 HydrophobicContact CD2-CB 4.37Å; F36-V41 HydrophobicContact CD2-CG1 4.31Å; F36-V41 PolarHBondContact N-O 3.31Å; N39-V41 HydrophobicContact CB-CG2 4.01Å; N39-V41 PolarHBondContact O-N 3.3Å; V41-M100 HydrophobicContact CG1-CB 4.5Å; V41-M100 HydrophobicContact CG1-CG 3.88Å | ||
| 42 | R | 84.8 | Confident | 85.2 | Confident | 8 Ų | 8 | 48.2 Ų | 48.2 | 3% | 0.03 | 27% | 0.273 | C | S | . | . | B | Isolated β-bridge | trans | -66.3 | 132.6 | 174.5 | -62.4 | -174.9 | -62.8 | -143.4 | -15.5 | 110.9 | S34 W44 D45 A46 E113 V185 | S34-R42 CarbonylContact O-C 3.52Å; S34-R42 WeakPolarHBondContact O-CA 3.49Å; R42-W44 PolarHBondContact O-N 3.11Å; R42-D45 IonicContact CZ-OD2 3.46Å; R42-D45 IonicContact NE-OD2 2.73Å; R42-D45 PolarHBondContact NE-OD2 3.36Å; R42-D45 IonicContact NH2-OD1 3.43Å; R42-D45 IonicContact NH2-OD2 3.76Å; R42-D45 PolarHBondContact NH2-OD2 3.39Å; R42-D45 PolarHBondContact O-N 3.28Å; R42-A46 PolarHBondContact O-N 2.86Å; R42-E113 IonicContact CZ-OE1 2.77Å; R42-E113 IonicContact CZ-OE2 3.93Å; R42-E113 IonicContact NH1-OE1 3.4Å; R42-E113 IonicContact NH1-OE2 3.79Å; R42-E113 PolarHBondContact NH1-OE2 2.79Å; R42-E113 IonicContact NH2-OE1 2.71Å; R42-E113 IonicContact NH2-OE2 3.15Å; R42-E113 PolarHBondContact NH2-OE2 3.03Å; R42-V185 PolarHBondContact NH1-O 2.92Å |
| 43 | I | 88.6 | Confident | 85.7 | Confident | 57 Ų | 57 | 49.2 Ų | 49.2 | 29% | 0.292 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -58.5 | -38.6 | 173.5 | -60.4 | -179.1 | 0 | 0 | 0 | 109.7 | S34 F36 D45 A46 I47 | S34-I43 PolarHBondContact O-N 3.14Å; F36-I43 HydrophobicContact CD2-CG1 4.05Å; F36-I43 HydrophobicContact CE1-CG1 4.43Å; F36-I43 HydrophobicContact CE2-CB 4.38Å; F36-I43 HydrophobicContact CE2-CG1 3.85Å; F36-I43 HydrophobicContact CG-CG1 4.43Å; F36-I43 HydrophobicContact CZ-CG1 4.05Å; I43-D45 VanDerWaalsContact C-N 3.34Å; I43-D45 PolarHBondContact O-N 3.17Å; I43-A46 WeakPolarHBondContact O-CB 3.24Å; I43-A46 PolarHBondContact O-N 3.15Å; I43-A46 VanDerWaalsContact O-N 3.08Å; I43-I47 HydrophobicContact CG2-CG2 4.01Å; I43-I47 WeakPolarHBondContact O-CG2 3.24Å; I43-I47 PolarHBondContact O-N 3.23Å |
| 44 | W | 90.1 | Very high | 86.3 | Confident | 16 Ų | 16 | 52.4 Ų | 52.4 | 6% | 0.061 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -55.5 | -42.8 | 177.8 | -171.7 | -104.3 | 0 | 0 | 0 | 113.8 | V31 F32 R42 I47 I48 W117 A262 L265 | V31-W44 HydrophobicContact CG1-CE3 4.1Å; V31-W44 HydrophobicContact CG1-CZ3 3.96Å; F32-W44 HydrophobicContact CD1-CD2 4.19Å; F32-W44 HydrophobicContact CD1-CE3 4.49Å; F32-W44 HydrophobicContact CD1-CZ2 4.43Å; F32-W44 HydrophobicContact CE1-CH2 4.16Å; F32-W44 AromaticContact CE1-CZ2 3.98Å; F32-W44 HydrophobicContact CE1-CZ2 3.98Å; F32-W44 HydrophobicContact CE1-CZ3 4.49Å; R42-W44 PolarHBondContact O-N 3.11Å; W44-I47 HydrophobicContact CD2-CD1 4.39Å; W44-I47 HydrophobicContact CE3-CD1 3.67Å; W44-I47 HydrophobicContact CZ3-CD1 3.96Å; W44-I47 WeakPolarHBondContact O-CG1 3.34Å; W44-I48 HydrophobicContact CD2-CD1 4.37Å; W44-I48 HydrophobicContact CG-CD1 4.5Å; W44-I48 HydrophobicContact CZ2-CD1 4.02Å; W44-I48 WeakPolarHBondContact O-CG1 3.33Å; W44-I48 PolarHBondContact O-N 2.7Å; W44-W117 AromaticContact NE1-CH2 3.86Å; W44-W117 AromaticContact NE1-CZ2 3.97Å; W44-A262 HydrophobicContact CH2-CB 4.16Å; W44-A262 WeakPolarHBondContact CH2-O 3.32Å; W44-A262 HydrophobicContact CZ3-CB 4.22Å; W44-L265 HydrophobicContact CZ2-CB 4.26Å |
| 45 | D | 90.5 | Very high | 86.9 | Confident | 0 Ų | 0 | 52.1 Ų | 52.1 | 0% | 0 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -70.2 | -36.8 | 177 | -73.4 | -46.5 | 0 | 0 | 0 | 111.6 | R42 I43 I48 F49 R95 M100 | R42-D45 IonicContact CZ-OD2 3.46Å; R42-D45 IonicContact NE-OD2 2.73Å; R42-D45 PolarHBondContact NE-OD2 3.36Å; R42-D45 IonicContact NH2-OD1 3.43Å; R42-D45 IonicContact NH2-OD2 3.76Å; R42-D45 PolarHBondContact NH2-OD2 3.39Å; R42-D45 PolarHBondContact O-N 3.28Å; I43-D45 VanDerWaalsContact C-N 3.34Å; I43-D45 PolarHBondContact O-N 3.17Å; D45-I48 PolarHBondContact O-N 3.43Å; D45-F49 WeakPolarHBondContact O-CB 3.28Å; D45-F49 PolarHBondContact O-N 3.1Å; D45-R95 IonicContact OD1-CZ 3.98Å; D45-R95 IonicContact OD1-NH1 2.79Å; D45-R95 PolarHBondContact OD1-NH1 2.95Å; D45-R95 IonicContact OD1-NH2 3.03Å; D45-R95 PolarHBondContact OD1-NH2 2.93Å; D45-M100 HydrophobicContact CB-CE 4.09Å; D45-M100 HydrophobicContact CB-CG 4.44Å; D45-M100 WeakPolarHBondContact O-CE 3.44Å |
| 46 | A | 90.6 | Very high | 87.5 | Confident | 26 Ų | 26 | 50.2 Ų | 50.2 | 22% | 0.215 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -65.8 | -43.8 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112.7 | F36 R42 I43 I48 F49 L50 M100 | F36-A46 HydrophobicContact CE2-CB 3.95Å; R42-A46 PolarHBondContact O-N 2.86Å; I43-A46 WeakPolarHBondContact O-CB 3.24Å; I43-A46 PolarHBondContact O-N 3.15Å; I43-A46 VanDerWaalsContact O-N 3.08Å; A46-I48 VanDerWaalsContact C-N 3.3Å; A46-I48 PolarHBondContact O-N 2.81Å; A46-F49 PolarHBondContact O-N 3.17Å; A46-L50 PolarHBondContact O-N 3.42Å; A46-L50 VanDerWaalsContact O-N 3.12Å; A46-M100 VanDerWaalsContact CA-CE 3.44Å; A46-M100 HydrophobicContact CB-CE 4.06Å |
| 47 | I | 93 | Very high | 88.2 | Confident | 64 Ų | 64 | 49.1 Ų | 49.1 | 33% | 0.328 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -68.5 | -28.6 | 179.6 | 65.4 | 171.8 | 0 | 0 | 0 | 112.6 | I43 W44 P51 Y266 | I43-I47 HydrophobicContact CG2-CG2 4.01Å; I43-I47 WeakPolarHBondContact O-CG2 3.24Å; I43-I47 PolarHBondContact O-N 3.23Å; W44-I47 HydrophobicContact CD2-CD1 4.39Å; W44-I47 HydrophobicContact CE3-CD1 3.67Å; W44-I47 HydrophobicContact CZ3-CD1 3.96Å; W44-I47 WeakPolarHBondContact O-CG1 3.34Å; I47-P51 WeakPolarHBondContact O-CD 3.44Å; I47-P51 WeakPolarHBondContact O-CG 2.98Å; I47-Y266 HydrophobicContact CB-CE2 4.16Å; I47-Y266 HydrophobicContact CD1-CD2 3.91Å; I47-Y266 HydrophobicContact CD1-CE2 3.97Å; I47-Y266 HydrophobicContact CG1-CD2 4.23Å; I47-Y266 HydrophobicContact CG1-CE2 3.98Å |
| 48 | I | 93.3 | Very high | 89.5 | Confident | 0 Ų | 0 | 46.4 Ų | 46.4 | 0% | 0 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -80.1 | -39.2 | 173.7 | -68.6 | 175 | 0 | 0 | 0 | 110.3 | W44 D45 A46 P51 N52 W117 Y266 Y269 T270 | W44-I48 HydrophobicContact CD2-CD1 4.37Å; W44-I48 HydrophobicContact CG-CD1 4.5Å; W44-I48 HydrophobicContact CZ2-CD1 4.02Å; W44-I48 WeakPolarHBondContact O-CG1 3.33Å; W44-I48 PolarHBondContact O-N 2.7Å; D45-I48 PolarHBondContact O-N 3.43Å; A46-I48 VanDerWaalsContact C-N 3.3Å; A46-I48 PolarHBondContact O-N 2.81Å; I48-P51 WeakPolarHBondContact O-CD 3.2Å; I48-P51 WeakPolarHBondContact O-CG 3.45Å; I48-N52 PolarHBondContact O-ND2 2.9Å; I48-W117 HydrophobicContact CD1-CH2 4.1Å; I48-Y266 HydrophobicContact CG1-CD2 4.17Å; I48-Y266 HydrophobicContact CG1-CE2 4.49Å; I48-Y269 HydrophobicContact CD1-CD2 4.42Å; I48-T270 HydrophobicContact CB-CG2 4.46Å; I48-T270 HydrophobicContact CG1-CG2 4.28Å; I48-T270 HydrophobicContact CG2-CG2 4.43Å |
| 49 | F | 94 | Very high | 90.8 | Very high | 63 Ų | 63 | 41.8 Ų | 41.8 | 28% | 0.276 | 23% | 0.228 | S | C | . | . | H | α-helix | trans | -60 | -49.3 | -178.8 | 176.9 | -109.1 | 0 | 0 | 0 | 112.3 | D45 A46 N52 V53 V93 A97 M100 | D45-F49 WeakPolarHBondContact O-CB 3.28Å; D45-F49 PolarHBondContact O-N 3.1Å; A46-F49 PolarHBondContact O-N 3.17Å; F49-N52 PolarHBondContact O-N 3.31Å; F49-V53 HydrophobicContact CD1-CG2 4.04Å; F49-V53 HydrophobicContact CD2-CG2 3.66Å; F49-V53 HydrophobicContact CE1-CG2 3.76Å; F49-V53 HydrophobicContact CE2-CG2 3.37Å; F49-V53 HydrophobicContact CG-CG2 4.01Å; F49-V53 HydrophobicContact CZ-CG2 3.43Å; F49-V53 VanDerWaalsContact CZ-CG2 3.43Å; F49-V53 WeakPolarHBondContact O-CG2 3.42Å; F49-V53 PolarHBondContact O-N 3.12Å; F49-V93 HydrophobicContact CD2-CG1 4.37Å; F49-V93 HydrophobicContact CE2-CG1 3.86Å; F49-A97 HydrophobicContact CE2-CB 4.33Å; F49-M100 HydrophobicContact CB-CE 3.58Å; F49-M100 HydrophobicContact CD1-CE 4.08Å; F49-M100 HydrophobicContact CD2-CE 4.48Å; F49-M100 HydrophobicContact CG-CE 3.83Å |
| 50 | L | 94.2 | Very high | 92 | Very high | 117 Ų | 117 | 40.9 Ų | 40.9 | 61% | 0.613 | 22% | 0.222 | S | C | * | . | H | α-helix | trans | -54.5 | -56.6 | -174 | -176.3 | 65.8 | 0 | 0 | 0 | 114 | A46 N52 V53 V54 | A46-L50 PolarHBondContact O-N 3.42Å; A46-L50 VanDerWaalsContact O-N 3.12Å; L50-N52 VanDerWaalsContact C-N 3.29Å; L50-N52 PolarHBondContact O-N 3.07Å; L50-V53 PolarHBondContact O-N 3.27Å; L50-V54 WeakPolarHBondContact O-CG2 3.45Å; L50-V54 PolarHBondContact O-N 2.82Å; L50-V54 VanDerWaalsContact O-N 3.09Å |
| 51 | P | 96.3 | Very high | 92.8 | Very high | 43 Ų | 43 | 44 Ų | 44 | 28% | 0.279 | 25% | 0.245 | S | C | . | . | H | α-helix | trans | -64.2 | -33.9 | 179.5 | 25 | -34.3 | 0 | 0 | 0 | 112.6 | I47 I48 F55 T270 | I47-P51 WeakPolarHBondContact O-CD 3.44Å; I47-P51 WeakPolarHBondContact O-CG 2.98Å; I48-P51 WeakPolarHBondContact O-CD 3.2Å; I48-P51 WeakPolarHBondContact O-CG 3.45Å; P51-F55 WeakPolarHBondContact O-CB 3.49Å; P51-F55 PolarHBondContact O-N 3.17Å; P51-T270 HydrophobicContact CG-CG2 3.56Å |
| 52 | N | 95.8 | Very high | 93 | Very high | 1 Ų | 1 | 45.4 Ų | 45.4 | 1% | 0.005 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -70.6 | -37.7 | 178.9 | -80.5 | -75.5 | 0 | 0 | 0 | 112.5 | I48 F49 L50 F55 L56 N92 V93 Y269 | I48-N52 PolarHBondContact O-ND2 2.9Å; F49-N52 PolarHBondContact O-N 3.31Å; L50-N52 VanDerWaalsContact C-N 3.29Å; L50-N52 PolarHBondContact O-N 3.07Å; N52-F55 PolarHBondContact O-N 3.28Å; N52-L56 VanDerWaalsContact O-CB 3.3Å; N52-L56 WeakPolarHBondContact O-CB 3.48Å; N52-L56 PolarHBondContact O-N 2.95Å; N52-N92 PolarHBondContact ND2-ND2 3.46Å; N52-N92 VanDerWaalsContact ND2-ND2 3.15Å; N52-N92 PolarHBondContact OD1-ND2 3.47Å; N52-V93 HydrophobicContact CB-CG2 3.92Å; N52-Y269 PolarHBondContact ND2-O 3.35Å |
| 53 | V | 96.5 | Very high | 93.1 | Very high | 41 Ų | 41 | 46.6 Ų | 46.6 | 25% | 0.248 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -65.5 | -46.9 | 173.6 | 169.6 | 0 | 0 | 0 | 0 | 110.7 | F49 L50 F55 L56 V57 V93 | F49-V53 HydrophobicContact CD1-CG2 4.04Å; F49-V53 HydrophobicContact CD2-CG2 3.66Å; F49-V53 HydrophobicContact CE1-CG2 3.76Å; F49-V53 HydrophobicContact CE2-CG2 3.37Å; F49-V53 HydrophobicContact CG-CG2 4.01Å; F49-V53 HydrophobicContact CZ-CG2 3.43Å; F49-V53 VanDerWaalsContact CZ-CG2 3.43Å; F49-V53 WeakPolarHBondContact O-CG2 3.42Å; F49-V53 PolarHBondContact O-N 3.12Å; L50-V53 PolarHBondContact O-N 3.27Å; V53-F55 PolarHBondContact O-N 3.29Å; V53-L56 PolarHBondContact O-N 3.31Å; V53-L56 VanDerWaalsContact O-N 3.14Å; V53-V57 HydrophobicContact CG1-CG2 4.25Å; V53-V57 WeakPolarHBondContact O-CB 3.48Å; V53-V57 WeakPolarHBondContact O-CG2 3.42Å; V53-V57 PolarHBondContact O-N 2.73Å; V53-V93 HydrophobicContact CG2-CG1 3.88Å; V53-V93 HydrophobicContact CG2-CG2 3.95Å |
| 54 | V | 96.8 | Very high | 93 | Very high | 93 Ų | 93 | 48.4 Ų | 48.4 | 56% | 0.564 | 27% | 0.273 | S | S | * | . | H | α-helix | trans | -56.3 | -44.6 | 176.9 | 171.7 | 0 | 0 | 0 | 0 | 110.3 | L50 F58 | L50-V54 WeakPolarHBondContact O-CG2 3.45Å; L50-V54 PolarHBondContact O-N 2.82Å; L50-V54 VanDerWaalsContact O-N 3.09Å; V54-F58 WeakPolarHBondContact O-CB 3.41Å; V54-F58 PolarHBondContact O-N 3.48Å |
| 55 | F | 96.8 | Very high | 92.6 | Very high | 20 Ų | 20 | 53.8 Ų | 53.8 | 9% | 0.088 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -67.4 | -40.1 | 177 | -177.9 | -110 | 0 | 0 | 0 | 113.1 | P51 N52 V53 F58 L59 V85 A89 V273 P274 Y277 | P51-F55 WeakPolarHBondContact O-CB 3.49Å; P51-F55 PolarHBondContact O-N 3.17Å; N52-F55 PolarHBondContact O-N 3.28Å; V53-F55 PolarHBondContact O-N 3.29Å; F55-F58 HydrophobicContact CD2-CD1 4.15Å; F55-F58 HydrophobicContact CE2-CD1 4.14Å; F55-F58 HydrophobicContact CE2-CE1 4.41Å; F55-F58 WeakPolarHBondContact O-CB 3.29Å; F55-F58 PolarHBondContact O-N 2.98Å; F55-L59 HydrophobicContact CD1-CD1 4.12Å; F55-L59 HydrophobicContact CD1-CG 4.43Å; F55-L59 HydrophobicContact CE1-CD1 3.55Å; F55-L59 HydrophobicContact CE1-CD2 4.39Å; F55-L59 HydrophobicContact CE1-CG 3.98Å; F55-L59 HydrophobicContact CE2-CD2 4.36Å; F55-L59 HydrophobicContact CE2-CG 4.42Å; F55-L59 HydrophobicContact CZ-CD1 3.95Å; F55-L59 HydrophobicContact CZ-CD2 3.93Å; F55-L59 HydrophobicContact CZ-CG 3.97Å; F55-L59 WeakPolarHBondContact O-CG 3.43Å; F55-L59 PolarHBondContact O-N 3.05Å; F55-V85 HydrophobicContact CE1-CG1 4.12Å; F55-V85 HydrophobicContact CZ-CG1 4.1Å; F55-A89 HydrophobicContact CD1-CB 4.14Å; F55-A89 HydrophobicContact CE1-CB 4.25Å; F55-V273 HydrophobicContact CD1-CG1 4.5Å; F55-V273 HydrophobicContact CE1-CB 4.33Å; F55-V273 HydrophobicContact CE1-CG1 3.7Å; F55-V273 HydrophobicContact CZ-CG1 4.45Å; F55-P274 HydrophobicContact CB-CG 4.39Å; F55-P274 HydrophobicContact CD1-CG 4.06Å; F55-P274 HydrophobicContact CD2-CB 4.06Å; F55-P274 HydrophobicContact CD2-CG 3.88Å; F55-P274 HydrophobicContact CE1-CG 4.33Å; F55-P274 HydrophobicContact CE2-CB 4Å; F55-P274 HydrophobicContact CE2-CG 4.15Å; F55-P274 HydrophobicContact CG-CG 3.83Å; F55-P274 HydrophobicContact CZ-CB 4.39Å; F55-P274 HydrophobicContact CZ-CG 4.37Å; F55-Y277 HydrophobicContact CE2-CD1 4.34Å; F55-Y277 HydrophobicContact CE2-CG 4.14Å; F55-Y277 HydrophobicContact CZ-CG 4.1Å |
| 56 | L | 96.3 | Very high | 92.2 | Very high | 24 Ų | 24 | 54.1 Ų | 54.1 | 13% | 0.126 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -64.9 | -44.5 | 177.2 | -177.6 | 63.9 | 0 | 0 | 0 | 111.6 | N52 V53 F58 L59 I60 Y86 A89 V93 | N52-L56 VanDerWaalsContact O-CB 3.3Å; N52-L56 WeakPolarHBondContact O-CB 3.48Å; N52-L56 PolarHBondContact O-N 2.95Å; V53-L56 PolarHBondContact O-N 3.31Å; V53-L56 VanDerWaalsContact O-N 3.14Å; L56-F58 VanDerWaalsContact C-N 3.29Å; L56-F58 PolarHBondContact O-N 3.41Å; L56-L59 WeakPolarHBondContact O-CB 3.4Å; L56-L59 PolarHBondContact O-N 3.44Å; L56-L59 VanDerWaalsContact O-N 3.14Å; L56-I60 HydrophobicContact CD1-CD1 4.48Å; L56-I60 HydrophobicContact CG-CD1 4.06Å; L56-I60 WeakPolarHBondContact O-CG1 3.43Å; L56-I60 PolarHBondContact O-N 3.25Å; L56-Y86 HydrophobicContact CD1-CD2 4.48Å; L56-Y86 HydrophobicContact CD1-CE2 4.22Å; L56-A89 HydrophobicContact CD1-CB 4.07Å; L56-V93 HydrophobicContact CB-CG2 4.21Å; L56-V93 HydrophobicContact CD2-CB 4.04Å; L56-V93 HydrophobicContact CD2-CG1 4.18Å; L56-V93 HydrophobicContact CD2-CG2 3.82Å |
| 57 | V | 96.4 | Very high | 91.8 | Very high | 81 Ų | 81 | 60.5 Ų | 60.5 | 49% | 0.491 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -58.2 | -45.2 | 173.7 | 171 | 0 | 0 | 0 | 0 | 109.9 | V53 L59 I60 S61 | V53-V57 HydrophobicContact CG1-CG2 4.25Å; V53-V57 WeakPolarHBondContact O-CB 3.48Å; V53-V57 WeakPolarHBondContact O-CG2 3.42Å; V53-V57 PolarHBondContact O-N 2.73Å; V57-L59 VanDerWaalsContact C-N 3.34Å; V57-L59 PolarHBondContact O-N 2.92Å; V57-I60 PolarHBondContact O-N 3.01Å; V57-S61 PolarHBondContact O-N 3.06Å; V57-S61 PolarHBondContact O-OG 3Å; V57-S61 VanDerWaalsContact O-OG 3.06Å |
| 58 | F | 94.7 | Very high | 91.2 | Very high | 77 Ų | 77 | 60.4 Ų | 60.4 | 34% | 0.338 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -57.2 | -43.7 | 174.6 | 166 | -94 | 0 | 0 | 0 | 112.8 | V54 F55 L56 S61 K62 Y277 | V54-F58 WeakPolarHBondContact O-CB 3.41Å; V54-F58 PolarHBondContact O-N 3.48Å; F55-F58 HydrophobicContact CD2-CD1 4.15Å; F55-F58 HydrophobicContact CE2-CD1 4.14Å; F55-F58 HydrophobicContact CE2-CE1 4.41Å; F55-F58 WeakPolarHBondContact O-CB 3.29Å; F55-F58 PolarHBondContact O-N 2.98Å; L56-F58 VanDerWaalsContact C-N 3.29Å; L56-F58 PolarHBondContact O-N 3.41Å; F58-S61 PolarHBondContact O-N 3.21Å; F58-K62 HydrophobicContact CE2-CG 4.21Å; F58-K62 HydrophobicContact CZ-CG 4.2Å; F58-K62 WeakPolarHBondContact O-CG 3.42Å; F58-K62 PolarHBondContact O-N 2.84Å; F58-Y277 HydrophobicContact CE1-CD1 4.18Å; F58-Y277 AromaticContact CE1-CE1 3.54Å; F58-Y277 HydrophobicContact CE1-CE1 3.54Å; F58-Y277 HydrophobicContact CE1-CE2 4.09Å; F58-Y277 AromaticContact CE1-CZ 3.5Å; F58-Y277 VanDerWaalsContact CE1-CZ 3.5Å; F58-Y277 AromaticContact CZ-CE1 3.78Å; F58-Y277 HydrophobicContact CZ-CE1 3.78Å; F58-Y277 AromaticContact CZ-CZ 3.75Å; F58-Y277 WeakPolarHBondContact CZ-OH 3.27Å |
| 59 | L | 93 | Very high | 90.3 | Very high | 0 Ų | 0 | 62 Ų | 62 | 0% | 0 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -63.2 | -44.2 | 175.5 | -70.3 | 178.9 | 0 | 0 | 0 | 111.9 | F55 L56 V57 S61 K62 L63 Y82 V85 Y86 A89 Y277 | F55-L59 HydrophobicContact CD1-CD1 4.12Å; F55-L59 HydrophobicContact CD1-CG 4.43Å; F55-L59 HydrophobicContact CE1-CD1 3.55Å; F55-L59 HydrophobicContact CE1-CD2 4.39Å; F55-L59 HydrophobicContact CE1-CG 3.98Å; F55-L59 HydrophobicContact CE2-CD2 4.36Å; F55-L59 HydrophobicContact CE2-CG 4.42Å; F55-L59 HydrophobicContact CZ-CD1 3.95Å; F55-L59 HydrophobicContact CZ-CD2 3.93Å; F55-L59 HydrophobicContact CZ-CG 3.97Å; F55-L59 WeakPolarHBondContact O-CG 3.43Å; F55-L59 PolarHBondContact O-N 3.05Å; L56-L59 WeakPolarHBondContact O-CB 3.4Å; L56-L59 PolarHBondContact O-N 3.44Å; L56-L59 VanDerWaalsContact O-N 3.14Å; V57-L59 VanDerWaalsContact C-N 3.34Å; V57-L59 PolarHBondContact O-N 2.92Å; L59-S61 PolarHBondContact O-N 3.08Å; L59-K62 CarbonylContact O-C 3.56Å; L59-K62 PolarHBondContact O-N 3.13Å; L59-K62 VanDerWaalsContact O-N 3.12Å; L59-L63 PolarHBondContact O-N 3.38Å; L59-Y82 HydrophobicContact CD2-CE2 4.4Å; L59-Y82 PolarHBondContact O-OH 3.44Å; L59-V85 HydrophobicContact CD1-CG1 3.86Å; L59-V85 HydrophobicContact CD2-CG1 4.28Å; L59-Y86 HydrophobicContact CB-CD2 4.43Å; L59-A89 HydrophobicContact CD1-CB 4.05Å; L59-Y277 HydrophobicContact CD2-CD2 3.79Å; L59-Y277 HydrophobicContact CD2-CE2 3.96Å |
| 60 | I | 93.3 | Very high | 89.3 | Confident | 80 Ų | 80 | 60.9 Ų | 60.9 | 41% | 0.41 | 33% | 0.326 | S | S | . | . | H | α-helix | trans | -61.6 | -44.7 | 178.2 | -67.1 | 165.8 | 0 | 0 | 0 | 110.5 | L56 V57 K62 L63 Y86 | L56-I60 HydrophobicContact CD1-CD1 4.48Å; L56-I60 HydrophobicContact CG-CD1 4.06Å; L56-I60 WeakPolarHBondContact O-CG1 3.43Å; L56-I60 PolarHBondContact O-N 3.25Å; V57-I60 PolarHBondContact O-N 3.01Å; I60-K62 PolarHBondContact O-N 3.16Å; I60-L63 WeakPolarHBondContact O-CB 3.41Å; I60-L63 PolarHBondContact O-N 2.89Å; I60-Y86 HydrophobicContact CG1-CE2 4.04Å |
| 61 | S | 91.6 | Very high | 88.5 | Confident | 89 Ų | 89 | 63.6 Ų | 63.6 | 62% | 0.622 | 34% | 0.336 | S | S | * | . | H | α-helix | trans | -61.6 | -27.7 | 176.5 | -57.4 | 0 | 0 | 0 | 0 | 112.9 | V57 F58 L59 | V57-S61 PolarHBondContact O-N 3.06Å; V57-S61 PolarHBondContact O-OG 3Å; V57-S61 VanDerWaalsContact O-OG 3.06Å; F58-S61 PolarHBondContact O-N 3.21Å; L59-S61 PolarHBondContact O-N 3.08Å |
| 62 | K | 86.9 | Confident | 87.3 | Confident | 54 Ų | 54 | 64.9 Ų | 64.9 | 24% | 0.235 | 36% | 0.356 | C | S | . | . | H | α-helix | trans | -89.9 | -8.5 | 176 | -65.5 | -64.6 | -176.1 | -174.3 | 0 | 113.5 | F58 L59 I60 S64 R65 I66 | F58-K62 HydrophobicContact CE2-CG 4.21Å; F58-K62 HydrophobicContact CZ-CG 4.2Å; F58-K62 WeakPolarHBondContact O-CG 3.42Å; F58-K62 PolarHBondContact O-N 2.84Å; L59-K62 CarbonylContact O-C 3.56Å; L59-K62 PolarHBondContact O-N 3.13Å; L59-K62 VanDerWaalsContact O-N 3.12Å; I60-K62 PolarHBondContact O-N 3.16Å; K62-S64 VanDerWaalsContact C-N 3.34Å; K62-S64 PolarHBondContact O-N 2.86Å; K62-R65 PolarHBondContact O-N 3.22Å; K62-I66 HydrophobicContact CB-CD1 3.9Å; K62-I66 HydrophobicContact CB-CG1 4.45Å; K62-I66 WeakPolarHBondContact O-CB 3.13Å; K62-I66 VanDerWaalsContact O-CG1 3.31Å; K62-I66 WeakPolarHBondContact O-CG1 3.32Å; K62-I66 PolarHBondContact O-N 3.1Å |
| 63 | L | 86.7 | Confident | 86.2 | Confident | 33 Ų | 33 | 66.9 Ų | 66.9 | 17% | 0.173 | 37% | 0.369 | C | S | . | . | H | α-helix | trans | -56.9 | -45.1 | -174.8 | -177.3 | 66.2 | 0 | 0 | 0 | 112.2 | L59 I60 R65 I66 R67 Y82 | L59-L63 PolarHBondContact O-N 3.38Å; I60-L63 WeakPolarHBondContact O-CB 3.41Å; I60-L63 PolarHBondContact O-N 2.89Å; L63-R65 PolarHBondContact O-N 3.29Å; L63-I66 PolarHBondContact O-N 3.36Å; L63-R67 HydrophobicContact CD1-CG 4.41Å; L63-R67 WeakPolarHBondContact O-CB 3.31Å; L63-R67 VanDerWaalsContact O-CG 3.31Å; L63-R67 WeakPolarHBondContact O-CG 3.46Å; L63-R67 PolarHBondContact O-N 3.08Å; L63-Y82 WeakPolarHBondContact CA-OH 3.05Å; L63-Y82 HydrophobicContact CD1-CE1 3.66Å; L63-Y82 WeakPolarHBondContact CD1-OH 3.33Å |
| 64 | S | 85.6 | Confident | 84.9 | Confident | 94 Ų | 94 | 77 Ų | 77 | 66% | 0.657 | 40% | 0.402 | S | S | * | . | H | α-helix | trans | -62.9 | -42.9 | -179.9 | -51.3 | 0 | 0 | 0 | 0 | 112.3 | K62 R67 A68 | K62-S64 VanDerWaalsContact C-N 3.34Å; K62-S64 PolarHBondContact O-N 2.86Å; S64-R67 PolarHBondContact O-N 3.4Å; S64-A68 PolarHBondContact O-N 3.13Å; S64-A68 VanDerWaalsContact O-N 3.16Å |
| 65 | R | 82.5 | Confident | 83.8 | Confident | 129 Ų | 129 | 74.4 Ų | 74.4 | 49% | 0.487 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -65.5 | -43.2 | 177.4 | -173.5 | -178.1 | -65.4 | -158.7 | -4.6 | 111.3 | K62 L63 K69 | K62-R65 PolarHBondContact O-N 3.22Å; L63-R65 PolarHBondContact O-N 3.29Å; R65-K69 WeakPolarHBondContact O-CB 3.32Å; R65-K69 PolarHBondContact O-N 2.94Å; R65-K69 VanDerWaalsContact O-N 3.1Å |
| 66 | I | 81.5 | Confident | 83.1 | Confident | 7 Ų | 7 | 74.8 Ų | 74.8 | 4% | 0.036 | 39% | 0.393 | C | S | . | . | H | α-helix | trans | -66.4 | -42.5 | -179.5 | -70.1 | 171.9 | 0 | 0 | 0 | 110.1 | K62 L63 K69 L70 Y82 V285 | K62-I66 HydrophobicContact CB-CD1 3.9Å; K62-I66 HydrophobicContact CB-CG1 4.45Å; K62-I66 WeakPolarHBondContact O-CB 3.13Å; K62-I66 VanDerWaalsContact O-CG1 3.31Å; K62-I66 WeakPolarHBondContact O-CG1 3.32Å; K62-I66 PolarHBondContact O-N 3.1Å; L63-I66 PolarHBondContact O-N 3.36Å; I66-K69 PolarHBondContact O-N 3.34Å; I66-L70 HydrophobicContact CG2-CD1 3.59Å; I66-L70 WeakPolarHBondContact O-CB 3.4Å; I66-L70 WeakPolarHBondContact O-CD1 3.39Å; I66-L70 PolarHBondContact O-N 3.16Å; I66-Y82 HydrophobicContact CB-CE2 4.42Å; I66-Y82 HydrophobicContact CD1-CD2 3.69Å; I66-Y82 HydrophobicContact CD1-CE2 3.2Å; I66-Y82 HydrophobicContact CG1-CE2 4.36Å; I66-Y82 HydrophobicContact CG2-CD1 4Å; I66-Y82 HydrophobicContact CG2-CD2 3.93Å; I66-Y82 HydrophobicContact CG2-CE1 4.03Å; I66-Y82 HydrophobicContact CG2-CE2 3.99Å; I66-Y82 HydrophobicContact CG2-CG 3.93Å; I66-V285 HydrophobicContact CD1-CG2 4.29Å; I66-V285 HydrophobicContact CG1-CG2 4.23Å |
| 67 | R | 82.3 | Confident | 82.4 | Confident | 160 Ų | 160 | 74.5 Ų | 74.5 | 60% | 0.604 | 39% | 0.392 | S | S | * | . | H | α-helix | trans | -56.7 | -52.3 | 175 | -78 | 179.5 | 179.6 | -176.6 | 0.6 | 112.2 | L63 S64 K69 L70 E71 | L63-R67 HydrophobicContact CD1-CG 4.41Å; L63-R67 WeakPolarHBondContact O-CB 3.31Å; L63-R67 VanDerWaalsContact O-CG 3.31Å; L63-R67 WeakPolarHBondContact O-CG 3.46Å; L63-R67 PolarHBondContact O-N 3.08Å; S64-R67 PolarHBondContact O-N 3.4Å; R67-K69 VanDerWaalsContact C-N 3.25Å; R67-K69 PolarHBondContact O-N 3.19Å; R67-L70 WeakPolarHBondContact O-CB 3.43Å; R67-L70 PolarHBondContact O-N 3.48Å; R67-L70 VanDerWaalsContact O-N 3.08Å; R67-E71 PolarHBondContact O-N 2.97Å; R67-E71 VanDerWaalsContact O-N 3.13Å |
| 68 | A | 81.3 | Confident | 81.8 | Confident | 63 Ų | 63 | 74.4 Ų | 74.4 | 52% | 0.521 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -57.3 | -39.9 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.2 | S64 | S64-A68 PolarHBondContact O-N 3.13Å; S64-A68 VanDerWaalsContact O-N 3.16Å |
| 69 | K | 74.1 | Confident | 81.3 | Confident | 34 Ų | 34 | 74.2 Ų | 74.2 | 15% | 0.148 | 39% | 0.386 | C | S | . | . | H | α-helix | trans | -70.5 | -32.3 | 177.7 | -163.7 | 176.1 | -176.3 | 119.8 | 0 | 113.6 | R65 I66 R67 G72 T73 F284 E288 | R65-K69 WeakPolarHBondContact O-CB 3.32Å; R65-K69 PolarHBondContact O-N 2.94Å; R65-K69 VanDerWaalsContact O-N 3.1Å; I66-K69 PolarHBondContact O-N 3.34Å; R67-K69 VanDerWaalsContact C-N 3.25Å; R67-K69 PolarHBondContact O-N 3.19Å; K69-G72 PolarHBondContact O-N 3.47Å; K69-T73 WeakPolarHBondContact O-CB 3.45Å; K69-T73 PolarHBondContact O-N 3.2Å; K69-T73 VanDerWaalsContact O-N 3.16Å; K69-T73 PolarHBondContact O-OG1 2.72Å; K69-F284 HydrophobicContact CB-CE1 4.14Å; K69-F284 HydrophobicContact CB-CZ 4.26Å; K69-F284 HydrophobicContact CD-CD1 3.72Å; K69-F284 HydrophobicContact CD-CD2 4.35Å; K69-F284 HydrophobicContact CD-CE1 3.35Å; K69-F284 HydrophobicContact CD-CE2 4.01Å; K69-F284 HydrophobicContact CD-CG 4.22Å; K69-F284 HydrophobicContact CD-CZ 3.51Å; K69-F284 WeakPolarHBondContact CE-O 3.45Å; K69-F284 HydrophobicContact CG-CE1 3.68Å; K69-F284 HydrophobicContact CG-CE2 4.22Å; K69-F284 HydrophobicContact CG-CZ 3.5Å; K69-F284 VanDerWaalsContact CG-CZ 3.5Å; K69-F284 PolarHBondContact NZ-O 3.37Å; K69-E288 VanDerWaalsContact CD-OE1 3.24Å; K69-E288 WeakPolarHBondContact CD-OE1 3.39Å; K69-E288 IonicContact NZ-OE1 2.81Å; K69-E288 PolarHBondContact NZ-OE1 3.32Å |
| 70 | L | 73.5 | Confident | 81 | Confident | 39 Ų | 39 | 75.2 Ų | 75.2 | 20% | 0.204 | 39% | 0.392 | C | S | . | . | H | α-helix | trans | -71 | -34.1 | 178.5 | -101.3 | 69.9 | 0 | 0 | 0 | 112.3 | I66 R67 G72 T73 L79 F284 | I66-L70 HydrophobicContact CG2-CD1 3.59Å; I66-L70 WeakPolarHBondContact O-CB 3.4Å; I66-L70 WeakPolarHBondContact O-CD1 3.39Å; I66-L70 PolarHBondContact O-N 3.16Å; R67-L70 WeakPolarHBondContact O-CB 3.43Å; R67-L70 PolarHBondContact O-N 3.48Å; R67-L70 VanDerWaalsContact O-N 3.08Å; L70-G72 PolarHBondContact O-N 3.31Å; L70-T73 PolarHBondContact O-N 2.94Å; L70-T73 VanDerWaalsContact O-N 3.13Å; L70-L79 HydrophobicContact CD2-CB 3.71Å; L70-L79 HydrophobicContact CD2-CD1 3.26Å; L70-L79 HydrophobicContact CD2-CG 3.97Å; L70-L79 HydrophobicContact CG-CB 4.43Å; L70-F284 HydrophobicContact CD1-CE1 3.77Å; L70-F284 HydrophobicContact CD1-CZ 4.2Å |
| 71 | E | 76.6 | Confident | 80.8 | Confident | 174 Ų | 174 | 71.7 Ų | 71.7 | 81% | 0.813 | 37% | 0.373 | S | S | * | . | H | α-helix | trans | -59.8 | -36.2 | 173.5 | -70.4 | 177 | 171.1 | 0 | 0 | 111.5 | R67 | R67-E71 PolarHBondContact O-N 2.97Å; R67-E71 VanDerWaalsContact O-N 3.13Å |
| 72 | G | 71.1 | Confident | 80.7 | Confident | 69 Ų | 69 | 68 Ų | 68 | 71% | 0.711 | 35% | 0.346 | S | S | * | . | H | α-helix | trans | -81.5 | -17.5 | 175 | 0 | 0 | 0 | 0 | 0 | 115.2 | K69 L70 | K69-G72 PolarHBondContact O-N 3.47Å; L70-G72 PolarHBondContact O-N 3.31Å |
| 73 | T | 73 | Confident | 80.9 | Confident | 43 Ų | 43 | 69.1 Ų | 69.1 | 26% | 0.264 | 35% | 0.354 | S | S | . | . | trans | -98 | 117 | -171.2 | -64 | 0 | 0 | 0 | 0 | 112 | K69 L70 S75 Y78 F284 | K69-T73 WeakPolarHBondContact O-CB 3.45Å; K69-T73 PolarHBondContact O-N 3.2Å; K69-T73 VanDerWaalsContact O-N 3.16Å; K69-T73 PolarHBondContact O-OG1 2.72Å; L70-T73 PolarHBondContact O-N 2.94Å; L70-T73 VanDerWaalsContact O-N 3.13Å; T73-S75 VanDerWaalsContact C-N 3.3Å; T73-S75 PolarHBondContact O-N 3.32Å; T73-Y78 HydrophobicContact CG2-CD2 4.35Å; T73-F284 HydrophobicContact CG2-CE2 3.87Å; T73-F284 HydrophobicContact CG2-CZ 4.03Å; T73-F284 WeakPolarHBondContact OG1-CE2 3.35Å; T73-F284 VanDerWaalsContact OG1-CZ 3.27Å; T73-F284 WeakPolarHBondContact OG1-CZ 3.31Å | ||
| 74 | R | 68.7 | Low | 81.2 | Confident | 253 Ų | 253 | 69.1 Ų | 69.1 | 96% | 0.955 | 35% | 0.354 | S | S | * | . | trans | -74.6 | -10.9 | 176.6 | -71.2 | -176 | 177.2 | 165.9 | 0.1 | 114.9 | P76 | R74-P76 WeakPolarHBondContact O-CD 3.3Š| ||
| 75 | S | 74.2 | Confident | 81.6 | Confident | 40 Ų | 40 | 64.7 Ų | 64.7 | 28% | 0.28 | 32% | 0.323 | S | S | . | . | trans | -84.9 | 111.7 | -177.1 | -179.6 | 0 | 0 | 0 | 0 | 112.1 | T73 V77 | T73-S75 VanDerWaalsContact C-N 3.3Å; T73-S75 PolarHBondContact O-N 3.32Å; S75-V77 PolarHBondContact O-N 2.9Å | ||
| 76 | P | 80.8 | Confident | 82.1 | Confident | 27 Ų | 27 | 62.3 Ų | 62.3 | 18% | 0.175 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -66.1 | -18.1 | 179.7 | 25.1 | -33.4 | 0 | 0 | 0 | 114 | R74 Y78 L79 T80 K144 I147 | R74-P76 WeakPolarHBondContact O-CD 3.3Å; P76-Y78 PolarHBondContact O-N 3.27Å; P76-L79 PolarHBondContact O-N 3.4Å; P76-T80 PolarHBondContact O-N 3.15Å; P76-T80 PolarHBondContact O-OG1 2.84Å; P76-T80 VanDerWaalsContact O-OG1 3.12Å; P76-K144 HydrophobicContact CB-CG 4.21Å; P76-K144 HydrophobicContact CG-CG 3.83Å; P76-I147 HydrophobicContact CB-CD1 3.77Å; P76-I147 HydrophobicContact CG-CD1 3.5Å; P76-I147 VanDerWaalsContact CG-CD1 3.5Å |
| 77 | V | 82.8 | Confident | 82.7 | Confident | 18 Ų | 18 | 64.9 Ų | 64.9 | 11% | 0.109 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -61.7 | -45.9 | -175.4 | 179.7 | 0 | 0 | 0 | 0 | 111.7 | S75 L79 T80 F81 F134 I147 | S75-V77 PolarHBondContact O-N 2.9Å; V77-L79 VanDerWaalsContact C-N 3.35Å; V77-L79 PolarHBondContact O-N 3Å; V77-T80 PolarHBondContact O-N 3.46Å; V77-F81 HydrophobicContact CG1-CD2 3.74Å; V77-F81 HydrophobicContact CG1-CE2 3.63Å; V77-F81 WeakPolarHBondContact O-CD2 2.93Å; V77-F81 PolarHBondContact O-N 3.49Å; V77-F134 HydrophobicContact CG1-CD1 4.21Å; V77-F134 HydrophobicContact CG1-CE1 4.07Å; V77-F134 HydrophobicContact CG2-CE1 4.28Å; V77-I147 HydrophobicContact CB-CD1 4.37Å; V77-I147 HydrophobicContact CG2-CD1 3.58Å; V77-I147 HydrophobicContact CG2-CG1 4.23Å |
| 78 | Y | 82.6 | Confident | 83.2 | Confident | 79 Ų | 79 | 57.4 Ų | 57.4 | 31% | 0.31 | 30% | 0.3 | S | S | . | . | H | α-helix | trans | -64.2 | -40.2 | -179 | -69.7 | -72.7 | 0 | 0 | 0 | 112.3 | T73 P76 F81 Y82 L281 F284 | T73-Y78 HydrophobicContact CG2-CD2 4.35Å; P76-Y78 PolarHBondContact O-N 3.27Å; Y78-F81 PolarHBondContact O-N 3.49Å; Y78-Y82 WeakPolarHBondContact O-CB 3.42Å; Y78-Y82 PolarHBondContact O-N 2.95Å; Y78-L281 HydrophobicContact CD1-CD2 4.45Å; Y78-F284 HydrophobicContact CD1-CB 3.93Å; Y78-F284 HydrophobicContact CD1-CD2 4.02Å; Y78-F284 AromaticContact CD1-CG 3.92Å; Y78-F284 HydrophobicContact CD1-CG 3.92Å; Y78-F284 HydrophobicContact CD2-CD2 4.07Å; Y78-F284 HydrophobicContact CD2-CE2 4.11Å; Y78-F284 HydrophobicContact CE1-CB 3.86Å; Y78-F284 HydrophobicContact CE1-CD2 4.08Å; Y78-F284 HydrophobicContact CE1-CG 4.16Å; Y78-F284 HydrophobicContact CE2-CD2 4.13Å; Y78-F284 HydrophobicContact CE2-CE2 4.44Å; Y78-F284 HydrophobicContact CG-CD2 4.01Å; Y78-F284 HydrophobicContact CG-CE2 4.23Å; Y78-F284 HydrophobicContact CG-CG 4.22Å |
| 79 | L | 85 | Confident | 83.9 | Confident | 73 Ų | 73 | 54.4 Ų | 54.4 | 38% | 0.382 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -62 | -45 | 174.8 | 170.6 | 63 | 0 | 0 | 0 | 110.9 | L70 P76 V77 Y82 I83 | L70-L79 HydrophobicContact CD2-CB 3.71Å; L70-L79 HydrophobicContact CD2-CD1 3.26Å; L70-L79 HydrophobicContact CD2-CG 3.97Å; L70-L79 HydrophobicContact CG-CB 4.43Å; P76-L79 PolarHBondContact O-N 3.4Å; V77-L79 VanDerWaalsContact C-N 3.35Å; V77-L79 PolarHBondContact O-N 3Å; L79-Y82 PolarHBondContact O-N 3.46Å; L79-I83 HydrophobicContact CD1-CD1 3.56Å; L79-I83 HydrophobicContact CD1-CG1 3.88Å; L79-I83 HydrophobicContact CG-CD1 3.94Å; L79-I83 WeakPolarHBondContact O-CG1 3.36Å; L79-I83 PolarHBondContact O-N 3.38Å |
| 80 | T | 87.8 | Confident | 84.9 | Confident | 22 Ų | 22 | 54.6 Ų | 54.6 | 14% | 0.135 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -58.8 | -50.7 | 177.6 | -60.7 | 0 | 0 | 0 | 0 | 111.5 | P76 V77 Y82 I83 L84 I147 L151 | P76-T80 PolarHBondContact O-N 3.15Å; P76-T80 PolarHBondContact O-OG1 2.84Å; P76-T80 VanDerWaalsContact O-OG1 3.12Å; V77-T80 PolarHBondContact O-N 3.46Å; T80-Y82 VanDerWaalsContact C-N 3.34Å; T80-Y82 PolarHBondContact O-N 3.28Å; T80-I83 PolarHBondContact O-N 3.2Å; T80-L84 HydrophobicContact CG2-CD1 3.76Å; T80-L84 HydrophobicContact CG2-CG 4.43Å; T80-L84 WeakPolarHBondContact O-CB 3.4Å; T80-L84 WeakPolarHBondContact O-CD1 3.44Å; T80-L84 VanDerWaalsContact O-CG 3.22Å; T80-L84 WeakPolarHBondContact O-CG 3.43Å; T80-L84 PolarHBondContact O-N 3.37Å; T80-I147 HydrophobicContact CG2-CG2 4.1Å; T80-L151 HydrophobicContact CG2-CD1 4.2Å; T80-L151 HydrophobicContact CG2-CD2 4.01Å; T80-L151 HydrophobicContact CG2-CG 4.5Å |
| 81 | F | 88.5 | Confident | 85.9 | Confident | 5 Ų | 5 | 54 Ų | 54 | 2% | 0.022 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -61.3 | -41.9 | 177.5 | -83 | -65.4 | 0 | 0 | 0 | 112.9 | V77 Y78 L84 V85 I130 V131 F134 V276 F280 L281 | V77-F81 HydrophobicContact CG1-CD2 3.74Å; V77-F81 HydrophobicContact CG1-CE2 3.63Å; V77-F81 WeakPolarHBondContact O-CD2 2.93Å; V77-F81 PolarHBondContact O-N 3.49Å; Y78-F81 PolarHBondContact O-N 3.49Å; F81-L84 PolarHBondContact O-N 2.84Å; F81-V85 VanDerWaalsContact O-CB 3.3Å; F81-V85 WeakPolarHBondContact O-CB 3.34Å; F81-V85 VanDerWaalsContact O-CG2 3.27Å; F81-V85 WeakPolarHBondContact O-CG2 3.48Å; F81-V85 PolarHBondContact O-N 2.77Å; F81-I130 HydrophobicContact CE1-CG2 4.2Å; F81-V131 HydrophobicContact CE1-CG2 3.8Å; F81-F134 HydrophobicContact CE1-CD2 4.36Å; F81-F134 HydrophobicContact CE2-CB 4.07Å; F81-F134 HydrophobicContact CE2-CD1 4.26Å; F81-F134 HydrophobicContact CE2-CD2 4.1Å; F81-F134 AromaticContact CE2-CG 3.89Å; F81-F134 HydrophobicContact CE2-CG 3.89Å; F81-F134 HydrophobicContact CZ-CB 3.53Å; F81-F134 HydrophobicContact CZ-CD1 4.44Å; F81-F134 AromaticContact CZ-CD2 3.66Å; F81-F134 HydrophobicContact CZ-CD2 3.66Å; F81-F134 AromaticContact CZ-CG 3.63Å; F81-F134 HydrophobicContact CZ-CG 3.63Å; F81-V276 HydrophobicContact CD1-CG1 4.5Å; F81-F280 HydrophobicContact CE2-CD1 4.28Å; F81-F280 HydrophobicContact CZ-CD1 4.2Å; F81-F280 HydrophobicContact CZ-CE1 4.32Å; F81-F280 HydrophobicContact CZ-CG 4.46Å; F81-L281 HydrophobicContact CB-CD2 4.07Å; F81-L281 HydrophobicContact CB-CG 4.41Å |
| 82 | Y | 89.7 | Confident | 86.7 | Confident | 13 Ų | 13 | 45.7 Ų | 45.7 | 5% | 0.051 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -61.9 | -48.2 | 178.6 | -178.3 | -102.7 | 0 | 0 | 0 | 112 | L59 L63 I66 Y78 L79 T80 L84 V85 Y86 L281 | L59-Y82 HydrophobicContact CD2-CE2 4.4Å; L59-Y82 PolarHBondContact O-OH 3.44Å; L63-Y82 WeakPolarHBondContact CA-OH 3.05Å; L63-Y82 HydrophobicContact CD1-CE1 3.66Å; L63-Y82 WeakPolarHBondContact CD1-OH 3.33Å; I66-Y82 HydrophobicContact CB-CE2 4.42Å; I66-Y82 HydrophobicContact CD1-CD2 3.69Å; I66-Y82 HydrophobicContact CD1-CE2 3.2Å; I66-Y82 HydrophobicContact CG1-CE2 4.36Å; I66-Y82 HydrophobicContact CG2-CD1 4Å; I66-Y82 HydrophobicContact CG2-CD2 3.93Å; I66-Y82 HydrophobicContact CG2-CE1 4.03Å; I66-Y82 HydrophobicContact CG2-CE2 3.99Å; I66-Y82 HydrophobicContact CG2-CG 3.93Å; Y78-Y82 WeakPolarHBondContact O-CB 3.42Å; Y78-Y82 PolarHBondContact O-N 2.95Å; L79-Y82 PolarHBondContact O-N 3.46Å; T80-Y82 VanDerWaalsContact C-N 3.34Å; T80-Y82 PolarHBondContact O-N 3.28Å; Y82-L84 VanDerWaalsContact C-N 3.34Å; Y82-L84 PolarHBondContact O-N 3.49Å; Y82-V85 PolarHBondContact O-N 3.39Å; Y82-Y86 VanDerWaalsContact O-CB 3.27Å; Y82-Y86 WeakPolarHBondContact O-CB 3.29Å; Y82-Y86 PolarHBondContact O-N 2.92Å; Y82-L281 HydrophobicContact CD2-CD1 4.26Å |
| 83 | I | 91.3 | Very high | 87.8 | Confident | 77 Ų | 77 | 43.5 Ų | 43.5 | 40% | 0.395 | 21% | 0.212 | S | C | . | . | H | α-helix | trans | -58.5 | -47.1 | 176.3 | -72.7 | 173.7 | 0 | 0 | 0 | 110.4 | L79 T80 Y86 I87 | L79-I83 HydrophobicContact CD1-CD1 3.56Å; L79-I83 HydrophobicContact CD1-CG1 3.88Å; L79-I83 HydrophobicContact CG-CD1 3.94Å; L79-I83 WeakPolarHBondContact O-CG1 3.36Å; L79-I83 PolarHBondContact O-N 3.38Å; T80-I83 PolarHBondContact O-N 3.2Å; I83-Y86 PolarHBondContact O-N 2.89Å; I83-I87 HydrophobicContact CG2-CD1 3.54Å; I83-I87 HydrophobicContact CG2-CG1 4.2Å; I83-I87 WeakPolarHBondContact O-CB 3.43Å; I83-I87 VanDerWaalsContact O-CG1 3.29Å; I83-I87 WeakPolarHBondContact O-CG1 3.19Å; I83-I87 PolarHBondContact O-N 3.36Å |
| 84 | L | 91.7 | Very high | 88.8 | Confident | 33 Ų | 33 | 46.5 Ų | 46.5 | 17% | 0.173 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -66.7 | -41.4 | -176.7 | -68.2 | 165.7 | 0 | 0 | 0 | 112.6 | T80 F81 Y82 Y86 I87 S88 L127 I130 L151 | T80-L84 HydrophobicContact CG2-CD1 3.76Å; T80-L84 HydrophobicContact CG2-CG 4.43Å; T80-L84 WeakPolarHBondContact O-CB 3.4Å; T80-L84 WeakPolarHBondContact O-CD1 3.44Å; T80-L84 VanDerWaalsContact O-CG 3.22Å; T80-L84 WeakPolarHBondContact O-CG 3.43Å; T80-L84 PolarHBondContact O-N 3.37Å; F81-L84 PolarHBondContact O-N 2.84Å; Y82-L84 VanDerWaalsContact C-N 3.34Å; Y82-L84 PolarHBondContact O-N 3.49Å; L84-Y86 VanDerWaalsContact C-N 3.34Å; L84-I87 PolarHBondContact O-N 3.32Å; L84-S88 VanDerWaalsContact O-CB 3.26Å; L84-S88 WeakPolarHBondContact O-CB 3.37Å; L84-S88 PolarHBondContact O-N 2.84Å; L84-S88 PolarHBondContact O-OG 3.26Å; L84-L127 HydrophobicContact CB-CD1 3.89Å; L84-L127 HydrophobicContact CD1-CD1 4.46Å; L84-I130 HydrophobicContact CD1-CB 4.48Å; L84-I130 HydrophobicContact CD1-CD1 3.59Å; L84-I130 HydrophobicContact CD1-CG2 3.79Å; L84-I130 HydrophobicContact CD2-CD1 4Å; L84-I130 HydrophobicContact CG-CD1 4.45Å; L84-L151 HydrophobicContact CD1-CD2 4.15Å |
| 85 | V | 93.6 | Very high | 89.9 | Confident | 0 Ų | 0 | 34.7 Ų | 34.7 | 0% | 0 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -61.7 | -44.4 | 174.1 | 162.1 | 0 | 0 | 0 | 0 | 110.3 | F55 L59 F81 Y82 S88 A89 L127 V273 V276 L281 | F55-V85 HydrophobicContact CE1-CG1 4.12Å; F55-V85 HydrophobicContact CZ-CG1 4.1Å; L59-V85 HydrophobicContact CD1-CG1 3.86Å; L59-V85 HydrophobicContact CD2-CG1 4.28Å; F81-V85 VanDerWaalsContact O-CB 3.3Å; F81-V85 WeakPolarHBondContact O-CB 3.34Å; F81-V85 VanDerWaalsContact O-CG2 3.27Å; F81-V85 WeakPolarHBondContact O-CG2 3.48Å; F81-V85 PolarHBondContact O-N 2.77Å; Y82-V85 PolarHBondContact O-N 3.39Å; V85-S88 PolarHBondContact O-N 3.47Å; V85-A89 WeakPolarHBondContact O-CB 3.4Å; V85-A89 PolarHBondContact O-N 3.43Å; V85-L127 HydrophobicContact CG2-CD2 4.35Å; V85-V273 HydrophobicContact CB-CG1 4.34Å; V85-V273 HydrophobicContact CG1-CG1 3.81Å; V85-V273 HydrophobicContact CG2-CG1 4.47Å; V85-V276 HydrophobicContact CG2-CB 4.23Å; V85-V276 HydrophobicContact CG2-CG1 3.71Å; V85-L281 HydrophobicContact CB-CD1 4.32Å; V85-L281 HydrophobicContact CG1-CD1 4.47Å; V85-L281 HydrophobicContact CG2-CD1 4.15Å |
| 86 | Y | 93.8 | Very high | 90.7 | Very high | 79 Ų | 79 | 32.8 Ų | 32.8 | 31% | 0.31 | 17% | 0.168 | S | C | . | . | H | α-helix | trans | -63.2 | -48.4 | 177.4 | -175.9 | -91.3 | 0 | 0 | 0 | 112 | L56 L59 I60 Y82 I83 L84 S88 A89 S90 | L56-Y86 HydrophobicContact CD1-CD2 4.48Å; L56-Y86 HydrophobicContact CD1-CE2 4.22Å; L59-Y86 HydrophobicContact CB-CD2 4.43Å; I60-Y86 HydrophobicContact CG1-CE2 4.04Å; Y82-Y86 VanDerWaalsContact O-CB 3.27Å; Y82-Y86 WeakPolarHBondContact O-CB 3.29Å; Y82-Y86 PolarHBondContact O-N 2.92Å; I83-Y86 PolarHBondContact O-N 2.89Å; L84-Y86 VanDerWaalsContact C-N 3.34Å; Y86-S88 PolarHBondContact O-N 3.07Å; Y86-A89 PolarHBondContact O-N 2.8Å; Y86-S90 WeakPolarHBondContact O-CB 3.34Å; Y86-S90 PolarHBondContact O-N 3.22Å; Y86-S90 PolarHBondContact O-OG 3.1Å |
| 87 | I | 94 | Very high | 91.2 | Very high | 61 Ų | 61 | 32.9 Ų | 32.9 | 31% | 0.313 | 17% | 0.171 | S | C | . | . | H | α-helix | trans | -59.1 | -49.2 | 176.6 | -70.7 | 172.3 | 0 | 0 | 0 | 109.9 | I83 L84 A89 S90 V91 F123 | I83-I87 HydrophobicContact CG2-CD1 3.54Å; I83-I87 HydrophobicContact CG2-CG1 4.2Å; I83-I87 WeakPolarHBondContact O-CB 3.43Å; I83-I87 VanDerWaalsContact O-CG1 3.29Å; I83-I87 WeakPolarHBondContact O-CG1 3.19Å; I83-I87 PolarHBondContact O-N 3.36Å; L84-I87 PolarHBondContact O-N 3.32Å; I87-A89 PolarHBondContact O-N 3.03Å; I87-S90 WeakPolarHBondContact CA-OG 3.46Å; I87-S90 PolarHBondContact O-N 3.48Å; I87-S90 VanDerWaalsContact O-N 3.15Å; I87-S90 PolarHBondContact O-OG 3.37Å; I87-V91 HydrophobicContact CG2-CG2 4.19Å; I87-V91 WeakPolarHBondContact O-CG2 3.48Å; I87-V91 PolarHBondContact O-N 3.23Å; I87-F123 HydrophobicContact CG2-CD1 4.01Å; I87-F123 HydrophobicContact CG2-CE1 4.04Å |
| 88 | S | 93.7 | Very high | 91.6 | Very high | 3 Ų | 3 | 34 Ų | 34 | 2% | 0.021 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -61.4 | -43.2 | -178.7 | -59 | 0 | 0 | 0 | 0 | 112.2 | L84 V85 Y86 N92 | L84-S88 VanDerWaalsContact O-CB 3.26Å; L84-S88 WeakPolarHBondContact O-CB 3.37Å; L84-S88 PolarHBondContact O-N 2.84Å; L84-S88 PolarHBondContact O-OG 3.26Å; V85-S88 PolarHBondContact O-N 3.47Å; Y86-S88 PolarHBondContact O-N 3.07Å; S88-N92 WeakPolarHBondContact O-CB 3.21Å; S88-N92 PolarHBondContact O-N 2.97Å |
| 89 | A | 94.7 | Very high | 91.7 | Very high | 0 Ų | 0 | 30.3 Ų | 30.3 | 0% | 0 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -63.1 | -43.8 | 174.6 | 0 | 0 | 0 | 0 | 0 | 111.5 | F55 L56 L59 V85 Y86 I87 N92 V93 V273 | F55-A89 HydrophobicContact CD1-CB 4.14Å; F55-A89 HydrophobicContact CE1-CB 4.25Å; L56-A89 HydrophobicContact CD1-CB 4.07Å; L59-A89 HydrophobicContact CD1-CB 4.05Å; V85-A89 WeakPolarHBondContact O-CB 3.4Å; V85-A89 PolarHBondContact O-N 3.43Å; Y86-A89 PolarHBondContact O-N 2.8Å; I87-A89 PolarHBondContact O-N 3.03Å; A89-N92 PolarHBondContact O-N 2.97Å; A89-V93 WeakPolarHBondContact O-CG2 3.45Å; A89-V93 PolarHBondContact O-N 3.23Å; A89-V273 HydrophobicContact CB-CG1 4.41Å |
| 90 | S | 94.9 | Very high | 91.8 | Very high | 39 Ų | 39 | 28.6 Ų | 28.6 | 27% | 0.273 | 16% | 0.155 | S | C | . | . | H | α-helix | trans | -64.3 | -42.7 | 179.4 | 72.2 | 0 | 0 | 0 | 0 | 112.6 | Y86 I87 N92 V93 L94 | Y86-S90 WeakPolarHBondContact O-CB 3.34Å; Y86-S90 PolarHBondContact O-N 3.22Å; Y86-S90 PolarHBondContact O-OG 3.1Å; I87-S90 WeakPolarHBondContact CA-OG 3.46Å; I87-S90 PolarHBondContact O-N 3.48Å; I87-S90 VanDerWaalsContact O-N 3.15Å; I87-S90 PolarHBondContact O-OG 3.37Å; S90-N92 VanDerWaalsContact C-N 3.32Å; S90-N92 PolarHBondContact O-N 3.01Å; S90-V93 PolarHBondContact O-N 3.45Å; S90-L94 VanDerWaalsContact O-CB 3.23Å; S90-L94 WeakPolarHBondContact O-CB 3.38Å; S90-L94 PolarHBondContact O-N 3.31Å |
| 91 | V | 94.4 | Very high | 91.7 | Very high | 26 Ų | 26 | 33 Ų | 33 | 16% | 0.158 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -64.8 | -37.7 | 176.9 | 171.7 | 0 | 0 | 0 | 0 | 110.7 | I87 L94 R95 L120 F123 | I87-V91 HydrophobicContact CG2-CG2 4.19Å; I87-V91 WeakPolarHBondContact O-CG2 3.48Å; I87-V91 PolarHBondContact O-N 3.23Å; V91-L94 PolarHBondContact O-N 2.83Å; V91-R95 VanDerWaalsContact O-CB 3.27Å; V91-R95 WeakPolarHBondContact O-CB 3.48Å; V91-R95 PolarHBondContact O-N 3.22Å; V91-L120 HydrophobicContact CG1-CB 4.49Å; V91-L120 HydrophobicContact CG1-CD1 4.1Å; V91-F123 HydrophobicContact CB-CD2 4.37Å; V91-F123 HydrophobicContact CG1-CD2 3.85Å; V91-F123 HydrophobicContact CG1-CE2 4.43Å; V91-F123 HydrophobicContact CG2-CD2 3.94Å; V91-F123 HydrophobicContact CG2-CE2 4.08Å; V91-F123 HydrophobicContact CG2-CG 4.32Å |
| 92 | N | 93.5 | Very high | 91.6 | Very high | 0 Ų | 0 | 33.2 Ų | 33.2 | 0% | 0 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -67.1 | -43.4 | 178.6 | -158.3 | 0.6 | 0 | 0 | 0 | 112.6 | N52 S88 A89 S90 S96 L120 Y269 | N52-N92 PolarHBondContact ND2-ND2 3.46Å; N52-N92 VanDerWaalsContact ND2-ND2 3.15Å; N52-N92 PolarHBondContact OD1-ND2 3.47Å; S88-N92 WeakPolarHBondContact O-CB 3.21Å; S88-N92 PolarHBondContact O-N 2.97Å; A89-N92 PolarHBondContact O-N 2.97Å; S90-N92 VanDerWaalsContact C-N 3.32Å; S90-N92 PolarHBondContact O-N 3.01Å; N92-S96 PolarHBondContact O-N 3.29Å; N92-S96 VanDerWaalsContact O-N 3.15Å; N92-S96 PolarHBondContact O-OG 3.43Å; N92-L120 HydrophobicContact CB-CD1 3.76Å; N92-L120 WeakPolarHBondContact OD1-CD2 3.11Å; N92-Y269 PolarHBondContact ND2-O 2.87Å |
| 93 | V | 95.3 | Very high | 91.1 | Very high | 22 Ų | 22 | 32.8 Ų | 32.8 | 13% | 0.133 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -63.8 | -46.8 | 173.5 | 172.3 | 0 | 0 | 0 | 0 | 110.5 | F49 N52 V53 L56 A89 S90 R95 S96 A97 | F49-V93 HydrophobicContact CD2-CG1 4.37Å; F49-V93 HydrophobicContact CE2-CG1 3.86Å; N52-V93 HydrophobicContact CB-CG2 3.92Å; V53-V93 HydrophobicContact CG2-CG1 3.88Å; V53-V93 HydrophobicContact CG2-CG2 3.95Å; L56-V93 HydrophobicContact CB-CG2 4.21Å; L56-V93 HydrophobicContact CD2-CB 4.04Å; L56-V93 HydrophobicContact CD2-CG1 4.18Å; L56-V93 HydrophobicContact CD2-CG2 3.82Å; A89-V93 WeakPolarHBondContact O-CG2 3.45Å; A89-V93 PolarHBondContact O-N 3.23Å; S90-V93 PolarHBondContact O-N 3.45Å; V93-R95 PolarHBondContact O-N 2.86Å; V93-S96 PolarHBondContact O-N 3.42Å; V93-A97 WeakPolarHBondContact O-CB 3.48Å; V93-A97 PolarHBondContact O-N 3.06Å |
| 94 | L | 93.8 | Very high | 90.4 | Very high | 107 Ų | 107 | 31.1 Ų | 31.1 | 56% | 0.56 | 18% | 0.178 | S | C | * | . | H | α-helix | trans | -60.2 | -46.7 | 178.9 | -179.5 | 63 | 0 | 0 | 0 | 111.5 | S90 V91 S96 A97 V98 | S90-L94 VanDerWaalsContact O-CB 3.23Å; S90-L94 WeakPolarHBondContact O-CB 3.38Å; S90-L94 PolarHBondContact O-N 3.31Å; V91-L94 PolarHBondContact O-N 2.83Å; L94-S96 VanDerWaalsContact C-N 3.32Å; L94-S96 PolarHBondContact O-N 3.02Å; L94-A97 PolarHBondContact O-N 2.87Å; L94-V98 HydrophobicContact CD1-CG2 3.86Å; L94-V98 HydrophobicContact CG-CG2 4.25Å; L94-V98 WeakPolarHBondContact O-CB 3.49Å; L94-V98 VanDerWaalsContact O-CG2 3.25Å; L94-V98 WeakPolarHBondContact O-CG2 3.1Å; L94-V98 PolarHBondContact O-N 3.01Å |
| 95 | R | 92 | Very high | 90 | Very high | 4 Ų | 4 | 32.1 Ų | 32.1 | 2% | 0.015 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -53.8 | -51 | 176.1 | -176.2 | -148 | 62 | 84.3 | 0.8 | 110.8 | D45 V91 V93 V98 A99 L116 W117 L120 | D45-R95 IonicContact OD1-CZ 3.98Å; D45-R95 IonicContact OD1-NH1 2.79Å; D45-R95 PolarHBondContact OD1-NH1 2.95Å; D45-R95 IonicContact OD1-NH2 3.03Å; D45-R95 PolarHBondContact OD1-NH2 2.93Å; V91-R95 VanDerWaalsContact O-CB 3.27Å; V91-R95 WeakPolarHBondContact O-CB 3.48Å; V91-R95 PolarHBondContact O-N 3.22Å; V93-R95 PolarHBondContact O-N 2.86Å; R95-V98 PolarHBondContact O-N 3.2Å; R95-A99 WeakPolarHBondContact O-CB 3.12Å; R95-A99 PolarHBondContact O-N 3.05Å; R95-L116 HydrophobicContact CG-CB 3.93Å; R95-W117 VanDerWaalsContact NH1-CE2 3.29Å; R95-L120 HydrophobicContact CG-CB 4.4Å |
| 96 | S | 91.2 | Very high | 89 | Confident | 0 Ų | 0 | 36.4 Ų | 36.4 | 0% | 0 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -66.6 | -41.7 | -176.5 | -49.7 | 0 | 0 | 0 | 0 | 111.1 | N92 V93 L94 A99 M100 | N92-S96 PolarHBondContact O-N 3.29Å; N92-S96 VanDerWaalsContact O-N 3.15Å; N92-S96 PolarHBondContact O-OG 3.43Å; V93-S96 PolarHBondContact O-N 3.42Å; L94-S96 VanDerWaalsContact C-N 3.32Å; L94-S96 PolarHBondContact O-N 3.02Å; S96-A99 PolarHBondContact O-N 3.39Å; S96-M100 VanDerWaalsContact O-CG 3.24Å; S96-M100 WeakPolarHBondContact O-CG 3.31Å; S96-M100 PolarHBondContact O-N 3.14Å |
| 97 | A | 90.7 | Very high | 88.1 | Confident | 29 Ų | 29 | 37.4 Ų | 37.4 | 24% | 0.24 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -63.5 | -45.9 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | F49 V93 L94 A99 M100 I101 | F49-A97 HydrophobicContact CE2-CB 4.33Å; V93-A97 WeakPolarHBondContact O-CB 3.48Å; V93-A97 PolarHBondContact O-N 3.06Å; L94-A97 PolarHBondContact O-N 2.87Å; A97-A99 VanDerWaalsContact C-N 3.35Å; A97-M100 PolarHBondContact O-N 3.02Å; A97-I101 WeakPolarHBondContact O-CD1 3.36Å; A97-I101 VanDerWaalsContact O-CG1 3.27Å; A97-I101 WeakPolarHBondContact O-CG1 3.48Å; A97-I101 PolarHBondContact O-N 3.19Å |
| 98 | V | 90.5 | Very high | 87.1 | Confident | 41 Ų | 41 | 40.6 Ų | 40.6 | 25% | 0.248 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -65.3 | -40.2 | 177.8 | 178.2 | 0 | 0 | 0 | 0 | 110.7 | L94 R95 M100 I101 V102 L116 | L94-V98 HydrophobicContact CD1-CG2 3.86Å; L94-V98 HydrophobicContact CG-CG2 4.25Å; L94-V98 WeakPolarHBondContact O-CB 3.49Å; L94-V98 VanDerWaalsContact O-CG2 3.25Å; L94-V98 WeakPolarHBondContact O-CG2 3.1Å; L94-V98 PolarHBondContact O-N 3.01Å; R95-V98 PolarHBondContact O-N 3.2Å; V98-M100 PolarHBondContact O-N 2.92Å; V98-I101 PolarHBondContact O-N 3.21Å; V98-V102 HydrophobicContact CG1-CG2 4.07Å; V98-V102 WeakPolarHBondContact O-CB 3.41Å; V98-V102 VanDerWaalsContact O-CG2 3.27Å; V98-V102 WeakPolarHBondContact O-CG2 3.5Å; V98-V102 PolarHBondContact O-N 3.12Å; V98-L116 HydrophobicContact CB-CD1 3.9Å; V98-L116 HydrophobicContact CG1-CD1 3.49Å; V98-L116 VanDerWaalsContact CG1-CD1 3.49Å; V98-L116 HydrophobicContact CG1-CD2 4.47Å |
| 99 | A | 86.6 | Confident | 86.2 | Confident | 2 Ų | 2 | 40.5 Ų | 40.5 | 2% | 0.017 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -58 | -48.6 | 174.4 | 0 | 0 | 0 | 0 | 0 | 111.3 | R95 S96 A97 I101 V102 S103 | R95-A99 WeakPolarHBondContact O-CB 3.12Å; R95-A99 PolarHBondContact O-N 3.05Å; S96-A99 PolarHBondContact O-N 3.39Å; A97-A99 VanDerWaalsContact C-N 3.35Å; A99-I101 VanDerWaalsContact C-N 3.32Å; A99-I101 PolarHBondContact O-N 3.18Å; A99-V102 PolarHBondContact O-N 3.49Å; A99-S103 PolarHBondContact O-N 3.46Å; A99-S103 PolarHBondContact O-OG 3.36Å |
| 100 | M | 86 | Confident | 85.6 | Confident | 38 Ų | 38 | 43.4 Ų | 43.4 | 19% | 0.187 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -59.1 | -40.6 | 176.6 | -66.8 | 174.3 | -173.6 | 0 | 0 | 112.9 | V41 D45 A46 F49 S96 A97 V98 G104 | V41-M100 HydrophobicContact CG1-CB 4.5Å; V41-M100 HydrophobicContact CG1-CG 3.88Å; D45-M100 HydrophobicContact CB-CE 4.09Å; D45-M100 HydrophobicContact CB-CG 4.44Å; D45-M100 WeakPolarHBondContact O-CE 3.44Å; A46-M100 VanDerWaalsContact CA-CE 3.44Å; A46-M100 HydrophobicContact CB-CE 4.06Å; F49-M100 HydrophobicContact CB-CE 3.58Å; F49-M100 HydrophobicContact CD1-CE 4.08Å; F49-M100 HydrophobicContact CD2-CE 4.48Å; F49-M100 HydrophobicContact CG-CE 3.83Å; S96-M100 VanDerWaalsContact O-CG 3.24Å; S96-M100 WeakPolarHBondContact O-CG 3.31Å; S96-M100 PolarHBondContact O-N 3.14Å; A97-M100 PolarHBondContact O-N 3.02Å; V98-M100 PolarHBondContact O-N 2.92Å; M100-G104 PolarHBondContact O-N 2.99Å |
| 101 | I | 86.9 | Confident | 85.1 | Confident | 115 Ų | 115 | 47.4 Ų | 47.4 | 59% | 0.59 | 27% | 0.27 | S | S | * | . | H | α-helix | trans | -66.6 | -46.6 | 178 | -67.8 | 163.2 | 0 | 0 | 0 | 110.8 | A97 V98 A99 G104 A105 | A97-I101 WeakPolarHBondContact O-CD1 3.36Å; A97-I101 VanDerWaalsContact O-CG1 3.27Å; A97-I101 WeakPolarHBondContact O-CG1 3.48Å; A97-I101 PolarHBondContact O-N 3.19Å; V98-I101 PolarHBondContact O-N 3.21Å; A99-I101 VanDerWaalsContact C-N 3.32Å; A99-I101 PolarHBondContact O-N 3.18Å; I101-G104 PolarHBondContact O-N 2.81Å; I101-A105 VanDerWaalsContact O-CB 3.3Å; I101-A105 WeakPolarHBondContact O-CB 3.43Å; I101-A105 PolarHBondContact O-N 3.49Å |
| 102 | V | 85.3 | Confident | 84.7 | Confident | 8 Ų | 8 | 49.5 Ų | 49.5 | 5% | 0.048 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -62.8 | -44.6 | -179.6 | 169 | 0 | 0 | 0 | 0 | 110.8 | V98 A99 A105 N106 L107 G109 I112 | V98-V102 HydrophobicContact CG1-CG2 4.07Å; V98-V102 WeakPolarHBondContact O-CB 3.41Å; V98-V102 VanDerWaalsContact O-CG2 3.27Å; V98-V102 WeakPolarHBondContact O-CG2 3.5Å; V98-V102 PolarHBondContact O-N 3.12Å; A99-V102 PolarHBondContact O-N 3.49Å; V102-A105 PolarHBondContact O-N 2.86Å; V102-N106 PolarHBondContact O-N 3.27Å; V102-L107 HydrophobicContact CG1-CB 4.43Å; V102-L107 PolarHBondContact O-N 2.93Å; V102-G109 VanDerWaalsContact CG1-CA 3.48Å; V102-I112 HydrophobicContact CG2-CG2 4.07Å |
| 103 | S | 79.2 | Confident | 84.3 | Confident | 5 Ų | 5 | 49.6 Ų | 49.6 | 4% | 0.035 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -67 | -38.3 | 177.4 | -44.2 | 0 | 0 | 0 | 0 | 111.7 | S40 A99 N106 E113 | S40-S103 WeakPolarHBondContact O-CB 2.92Å; A99-S103 PolarHBondContact O-N 3.46Å; A99-S103 PolarHBondContact O-OG 3.36Å; S103-N106 PolarHBondContact O-N 3.39Å; S103-E113 PolarHBondContact OG-OE1 3.39Å |
| 104 | G | 77.5 | Confident | 84 | Confident | 41 Ų | 41 | 49.2 Ų | 49.2 | 42% | 0.423 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -67.5 | -35.6 | 175.5 | 0 | 0 | 0 | 0 | 0 | 114 | M100 I101 N106 | M100-G104 PolarHBondContact O-N 2.99Å; I101-G104 PolarHBondContact O-N 2.81Å; G104-N106 PolarHBondContact O-N 3.41Å |
| 105 | A | 82.3 | Confident | 83.8 | Confident | 55 Ų | 55 | 46.5 Ų | 46.5 | 46% | 0.455 | 27% | 0.266 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -79.4 | -1.6 | 178.6 | 0 | 0 | 0 | 0 | 0 | 113.8 | I101 V102 L107 | I101-A105 VanDerWaalsContact O-CB 3.3Å; I101-A105 WeakPolarHBondContact O-CB 3.43Å; I101-A105 PolarHBondContact O-N 3.49Å; V102-A105 PolarHBondContact O-N 2.86Å; A105-L107 HydrophobicContact CB-CD1 4.05Å; A105-L107 HydrophobicContact CB-CG 3.89Å; A105-L107 PolarHBondContact O-N 3.5Å; A105-L107 VanDerWaalsContact O-N 3.13Å |
| 106 | N | 72.1 | Confident | 83.7 | Confident | 89 Ų | 89 | 48.1 Ų | 48.1 | 48% | 0.476 | 28% | 0.275 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 51.8 | 31.6 | -176.7 | -61.2 | -56.3 | 0 | 0 | 0 | 113.8 | V102 S103 G104 R183 | V102-N106 PolarHBondContact O-N 3.27Å; S103-N106 PolarHBondContact O-N 3.39Å; G104-N106 PolarHBondContact O-N 3.41Å; N106-R183 VanDerWaalsContact OD1-CZ 3.31Å; N106-R183 PolarHBondContact OD1-NH1 3.12Å |
| 107 | L | 76.2 | Confident | 83.7 | Confident | 100 Ų | 100 | 48.8 Ų | 48.8 | 52% | 0.524 | 28% | 0.278 | S | S | . | . | trans | -73.9 | 155 | 175.9 | -64 | 172.4 | 0 | 0 | 0 | 109.6 | V102 A105 G109 | V102-L107 HydrophobicContact CG1-CB 4.43Å; V102-L107 PolarHBondContact O-N 2.93Å; A105-L107 HydrophobicContact CB-CD1 4.05Å; A105-L107 HydrophobicContact CB-CG 3.89Å; A105-L107 PolarHBondContact O-N 3.5Å; A105-L107 VanDerWaalsContact O-N 3.13Å; L107-G109 PolarHBondContact O-N 3.39Å | ||
| 108 | N | 72.5 | Confident | 83.8 | Confident | 128 Ų | 128 | 48.7 Ų | 48.7 | 68% | 0.684 | 27% | 0.273 | S | S | * | . | trans | -65.2 | 78 | 168 | -90.2 | 17.3 | 0 | 0 | 0 | 109.6 | R110 | N108-R110 VanDerWaalsContact C-N 3.29Å; N108-R110 PolarHBondContact O-N 3.19Å | ||
| 109 | G | 75.4 | Confident | 83.9 | Confident | 1 Ų | 1 | 48.7 Ų | 48.7 | 1% | 0.01 | 28% | 0.278 | C | S | . | . | trans | -79.7 | -6.9 | -168 | 0 | 0 | 0 | 0 | 0 | 113.8 | V102 L107 I111 I112 E113 | V102-G109 VanDerWaalsContact CG1-CA 3.48Å; L107-G109 PolarHBondContact O-N 3.39Å; G109-I111 PolarHBondContact O-N 3.08Å; G109-I112 CarbonylContact O-C 3.49Å; G109-I112 WeakPolarHBondContact O-CA 3.46Å; G109-I112 PolarHBondContact O-N 2.9Å; G109-E113 WeakPolarHBondContact O-CB 3.29Å; G109-E113 WeakPolarHBondContact O-CG 3.21Å; G109-E113 PolarHBondContact O-N 3Å | ||
| 110 | R | 80.8 | Confident | 84.3 | Confident | 62 Ų | 62 | 48.6 Ų | 48.6 | 23% | 0.234 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -52.8 | -48.6 | -170.4 | 174.8 | 168.9 | -61 | -120.7 | 2.6 | 114.2 | N108 K114 S181 V185 | N108-R110 VanDerWaalsContact C-N 3.29Å; N108-R110 PolarHBondContact O-N 3.19Å; R110-K114 WeakPolarHBondContact O-CB 3.3Å; R110-K114 WeakPolarHBondContact O-CG 3.4Å; R110-K114 PolarHBondContact O-N 2.81Å; R110-K114 VanDerWaalsContact O-N 3.09Å; R110-S181 PolarHBondContact NH2-O 3.41Å; R110-V185 HydrophobicContact CB-CG2 3.66Å; R110-V185 HydrophobicContact CG-CG1 4.31Å; R110-V185 HydrophobicContact CG-CG2 3.74Å |
| 111 | I | 84.3 | Confident | 84.6 | Confident | 122 Ų | 122 | 47.4 Ų | 47.4 | 63% | 0.626 | 27% | 0.271 | S | S | * | . | H | α-helix | trans | -69 | -42.7 | 179.6 | -61 | 168.9 | 0 | 0 | 0 | 109.9 | G109 S115 | G109-I111 PolarHBondContact O-N 3.08Å; I111-S115 VanDerWaalsContact O-CB 3.29Å; I111-S115 WeakPolarHBondContact O-CB 3.41Å; I111-S115 PolarHBondContact O-N 3.46Å; I111-S115 PolarHBondContact O-OG 2.98Å |
| 112 | I | 86.1 | Confident | 85 | Confident | 70 Ų | 70 | 44.8 Ų | 44.8 | 36% | 0.359 | 26% | 0.255 | S | S | . | . | H | α-helix | trans | -63.7 | -48 | -179.3 | -58.9 | 172.9 | 0 | 0 | 0 | 110.6 | V102 G109 S115 L116 | V102-I112 HydrophobicContact CG2-CG2 4.07Å; G109-I112 CarbonylContact O-C 3.49Å; G109-I112 WeakPolarHBondContact O-CA 3.46Å; G109-I112 PolarHBondContact O-N 2.9Å; I112-S115 WeakPolarHBondContact CA-OG 3.48Å; I112-S115 PolarHBondContact O-N 2.84Å; I112-S115 PolarHBondContact O-OG 3.19Å; I112-L116 HydrophobicContact CG2-CD1 3.76Å; I112-L116 HydrophobicContact CG2-CG 4.31Å; I112-L116 VanDerWaalsContact O-CB 3.3Å; I112-L116 WeakPolarHBondContact O-CB 3.23Å; I112-L116 WeakPolarHBondContact O-CD1 3.47Å; I112-L116 WeakPolarHBondContact O-CG 3.44Å; I112-L116 PolarHBondContact O-N 3.31Å |
| 113 | E | 85.4 | Confident | 85.4 | Confident | 3 Ų | 3 | 47.9 Ų | 47.9 | 1% | 0.014 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -63.7 | -47.6 | 177.8 | -69.8 | -173.1 | -178.4 | 0 | 0 | 112.1 | R42 S103 G109 S115 L116 W117 | R42-E113 IonicContact CZ-OE1 2.77Å; R42-E113 IonicContact CZ-OE2 3.93Å; R42-E113 IonicContact NH1-OE1 3.4Å; R42-E113 IonicContact NH1-OE2 3.79Å; R42-E113 PolarHBondContact NH1-OE2 2.79Å; R42-E113 IonicContact NH2-OE1 2.71Å; R42-E113 IonicContact NH2-OE2 3.15Å; R42-E113 PolarHBondContact NH2-OE2 3.03Å; S103-E113 PolarHBondContact OG-OE1 3.39Å; G109-E113 WeakPolarHBondContact O-CB 3.29Å; G109-E113 WeakPolarHBondContact O-CG 3.21Å; G109-E113 PolarHBondContact O-N 3Å; E113-S115 VanDerWaalsContact C-N 3.33Å; E113-S115 PolarHBondContact O-N 2.9Å; E113-L116 PolarHBondContact O-N 2.88Å; E113-W117 VanDerWaalsContact O-CD1 3.23Å; E113-W117 PolarHBondContact O-N 2.85Å |
| 114 | K | 89.1 | Confident | 86.1 | Confident | 14 Ų | 14 | 47.7 Ų | 47.7 | 6% | 0.061 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -59.7 | -44.1 | 176.9 | -78.5 | -174 | 165.6 | -164.3 | 0 | 111.6 | R110 W117 L118 E169 F170 D173 V185 | R110-K114 WeakPolarHBondContact O-CB 3.3Å; R110-K114 WeakPolarHBondContact O-CG 3.4Å; R110-K114 PolarHBondContact O-N 2.81Å; R110-K114 VanDerWaalsContact O-N 3.09Å; K114-W117 PolarHBondContact O-N 3.17Å; K114-L118 WeakPolarHBondContact O-CB 3.39Å; K114-L118 PolarHBondContact O-N 3.36Å; K114-E169 HydrophobicContact CD-CG 4.05Å; K114-E169 VanDerWaalsContact CE-OE1 3.25Å; K114-E169 WeakPolarHBondContact CE-OE1 3.32Å; K114-E169 HydrophobicContact CG-CG 4.39Å; K114-E169 PolarHBondContact NZ-O 2.79Å; K114-E169 IonicContact NZ-OE1 3.59Å; K114-F170 HydrophobicContact CB-CE1 4.16Å; K114-F170 HydrophobicContact CB-CZ 3.93Å; K114-F170 HydrophobicContact CD-CE1 4.14Å; K114-D173 IonicContact NZ-OD1 3.5Å; K114-V185 HydrophobicContact CD-CG1 4.31Å; K114-V185 HydrophobicContact CG-CG1 3.89Å |
| 115 | S | 89.6 | Confident | 87 | Confident | 50 Ų | 50 | 46.2 Ų | 46.2 | 35% | 0.35 | 25% | 0.248 | S | C | . | . | H | α-helix | trans | -66.9 | -38.7 | 178 | 57.6 | 0 | 0 | 0 | 0 | 113.1 | I111 I112 E113 L118 A119 | I111-S115 VanDerWaalsContact O-CB 3.29Å; I111-S115 WeakPolarHBondContact O-CB 3.41Å; I111-S115 PolarHBondContact O-N 3.46Å; I111-S115 PolarHBondContact O-OG 2.98Å; I112-S115 WeakPolarHBondContact CA-OG 3.48Å; I112-S115 PolarHBondContact O-N 2.84Å; I112-S115 PolarHBondContact O-OG 3.19Å; E113-S115 VanDerWaalsContact C-N 3.33Å; E113-S115 PolarHBondContact O-N 2.9Å; S115-L118 PolarHBondContact O-N 2.87Å; S115-A119 WeakPolarHBondContact O-CB 3.18Å; S115-A119 PolarHBondContact O-N 3.41Å |
| 116 | L | 90.6 | Very high | 87.5 | Confident | 38 Ų | 38 | 44.2 Ų | 44.2 | 20% | 0.199 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -64.7 | -42 | 175.1 | -76.9 | 170.1 | 0 | 0 | 0 | 112.1 | R95 V98 I112 E113 A119 L120 | R95-L116 HydrophobicContact CG-CB 3.93Å; V98-L116 HydrophobicContact CB-CD1 3.9Å; V98-L116 HydrophobicContact CG1-CD1 3.49Å; V98-L116 VanDerWaalsContact CG1-CD1 3.49Å; V98-L116 HydrophobicContact CG1-CD2 4.47Å; I112-L116 HydrophobicContact CG2-CD1 3.76Å; I112-L116 HydrophobicContact CG2-CG 4.31Å; I112-L116 VanDerWaalsContact O-CB 3.3Å; I112-L116 WeakPolarHBondContact O-CB 3.23Å; I112-L116 WeakPolarHBondContact O-CD1 3.47Å; I112-L116 WeakPolarHBondContact O-CG 3.44Å; I112-L116 PolarHBondContact O-N 3.31Å; E113-L116 PolarHBondContact O-N 2.88Å; L116-A119 PolarHBondContact O-N 3.29Å; L116-L120 PolarHBondContact O-N 2.87Å |
| 117 | W | 91.5 | Very high | 88.6 | Confident | 13 Ų | 13 | 40 Ų | 40 | 5% | 0.049 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -62.6 | -44.1 | 173.3 | -86.3 | 110.9 | 0 | 0 | 0 | 112 | W44 I48 R95 E113 K114 L120 Q121 Y187 Y269 | W44-W117 AromaticContact NE1-CH2 3.86Å; W44-W117 AromaticContact NE1-CZ2 3.97Å; I48-W117 HydrophobicContact CD1-CH2 4.1Å; R95-W117 VanDerWaalsContact NH1-CE2 3.29Å; E113-W117 VanDerWaalsContact O-CD1 3.23Å; E113-W117 PolarHBondContact O-N 2.85Å; K114-W117 PolarHBondContact O-N 3.17Å; W117-L120 HydrophobicContact CE3-CD2 4.34Å; W117-L120 HydrophobicContact CZ3-CD2 4.17Å; W117-L120 PolarHBondContact O-N 2.66Å; W117-Q121 WeakPolarHBondContact O-CB 3.29Å; W117-Q121 PolarHBondContact O-N 3.18Å; W117-Y187 HydrophobicContact CB-CD1 4.04Å; W117-Y187 HydrophobicContact CB-CD2 3.41Å; W117-Y187 VanDerWaalsContact CB-CD2 3.41Å; W117-Y187 HydrophobicContact CB-CE1 4.19Å; W117-Y187 HydrophobicContact CB-CE2 3.58Å; W117-Y187 HydrophobicContact CB-CG 3.65Å; W117-Y187 HydrophobicContact CD2-CG 4.36Å; W117-Y187 HydrophobicContact CG-CD1 4.38Å; W117-Y187 AromaticContact CG-CD2 3.94Å; W117-Y187 HydrophobicContact CG-CD2 3.94Å; W117-Y187 AromaticContact CG-CG 3.83Å; W117-Y187 HydrophobicContact CG-CG 3.83Å; W117-Y269 HydrophobicContact CE3-CE1 4.5Å; W117-Y269 HydrophobicContact CE3-CE2 4.39Å; W117-Y269 HydrophobicContact CH2-CD2 4.25Å; W117-Y269 HydrophobicContact CH2-CE2 4.17Å; W117-Y269 HydrophobicContact CZ3-CD1 4.28Å; W117-Y269 AromaticContact CZ3-CD2 3.89Å; W117-Y269 HydrophobicContact CZ3-CD2 3.89Å; W117-Y269 AromaticContact CZ3-CE1 3.95Å; W117-Y269 HydrophobicContact CZ3-CE1 3.95Å; W117-Y269 AromaticContact CZ3-CE2 3.5Å; W117-Y269 HydrophobicContact CZ3-CE2 3.5Å; W117-Y269 VanDerWaalsContact CZ3-CE2 3.5Å; W117-Y269 HydrophobicContact CZ3-CG 4.28Å; W117-Y269 AromaticContact CZ3-CZ 3.56Å |
| 118 | L | 92.8 | Very high | 89.5 | Confident | 27 Ų | 27 | 35.3 Ų | 35.3 | 14% | 0.141 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -61.9 | -43.8 | 176.4 | -174.7 | 70.9 | 0 | 0 | 0 | 111.9 | K114 S115 Q121 F122 Q165 A166 Y187 | K114-L118 WeakPolarHBondContact O-CB 3.39Å; K114-L118 PolarHBondContact O-N 3.36Å; S115-L118 PolarHBondContact O-N 2.87Å; L118-Q121 PolarHBondContact O-N 2.85Å; L118-F122 PolarHBondContact O-N 2.92Å; L118-Q165 HydrophobicContact CD1-CB 4.23Å; L118-Q165 HydrophobicContact CD1-CG 4.36Å; L118-A166 HydrophobicContact CD1-CB 4.11Å; L118-A166 HydrophobicContact CD2-CB 3.51Å; L118-A166 HydrophobicContact CG-CB 4.47Å; L118-Y187 WeakPolarHBondContact CD1-OH 3.06Å |
| 119 | A | 92.2 | Very high | 90.5 | Very high | 42 Ų | 42 | 30 Ų | 30 | 35% | 0.347 | 16% | 0.155 | S | C | . | . | H | α-helix | trans | -62.7 | -46.9 | 176.8 | 0 | 0 | 0 | 0 | 0 | 111.4 | S115 L116 Q121 F122 F123 | S115-A119 WeakPolarHBondContact O-CB 3.18Å; S115-A119 PolarHBondContact O-N 3.41Å; L116-A119 PolarHBondContact O-N 3.29Å; A119-Q121 VanDerWaalsContact C-N 3.33Å; A119-Q121 PolarHBondContact O-N 3.04Å; A119-F122 WeakPolarHBondContact O-CB 3.25Å; A119-F122 PolarHBondContact O-N 3.16Å; A119-F123 WeakPolarHBondContact O-CD2 3.24Å; A119-F123 PolarHBondContact O-N 2.84Å |
| 120 | L | 93.7 | Very high | 91.3 | Very high | 0 Ų | 0 | 30.1 Ų | 30.1 | 0% | 0 | 16% | 0.156 | C | C | . | . | H | α-helix | trans | -56.8 | -48.9 | 174.6 | 173.9 | 63.5 | 0 | 0 | 0 | 111.1 | V91 N92 R95 L116 W117 F122 F123 L124 Y269 | V91-L120 HydrophobicContact CG1-CB 4.49Å; V91-L120 HydrophobicContact CG1-CD1 4.1Å; N92-L120 HydrophobicContact CB-CD1 3.76Å; N92-L120 WeakPolarHBondContact OD1-CD2 3.11Å; R95-L120 HydrophobicContact CG-CB 4.4Å; L116-L120 PolarHBondContact O-N 2.87Å; W117-L120 HydrophobicContact CE3-CD2 4.34Å; W117-L120 HydrophobicContact CZ3-CD2 4.17Å; W117-L120 PolarHBondContact O-N 2.66Å; L120-F122 VanDerWaalsContact C-N 3.28Å; L120-F122 PolarHBondContact O-N 3.35Å; L120-F123 PolarHBondContact O-N 3.19Å; L120-L124 HydrophobicContact CD1-CD1 3.82Å; L120-L124 HydrophobicContact CD1-CD2 4.41Å; L120-L124 HydrophobicContact CD1-CG 3.87Å; L120-L124 HydrophobicContact CD2-CD1 4.31Å; L120-L124 HydrophobicContact CG-CD1 3.88Å; L120-L124 HydrophobicContact CG-CG 4.27Å; L120-L124 WeakPolarHBondContact O-CG 3.38Å; L120-L124 PolarHBondContact O-N 3.12Å; L120-Y269 HydrophobicContact CD2-CD1 3.8Å; L120-Y269 HydrophobicContact CD2-CE1 3.91Å; L120-Y269 HydrophobicContact CG-CE1 4.37Å |
| 121 | Q | 94 | Very high | 91.8 | Very high | 12 Ų | 12 | 27.2 Ų | 27.2 | 6% | 0.056 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -59.8 | -41.4 | -178.6 | -169.8 | 68.1 | 7.1 | 0 | 0 | 111.4 | W117 L118 A119 F123 L124 F125 Y161 Y269 | W117-Q121 WeakPolarHBondContact O-CB 3.29Å; W117-Q121 PolarHBondContact O-N 3.18Å; L118-Q121 PolarHBondContact O-N 2.85Å; A119-Q121 VanDerWaalsContact C-N 3.33Å; A119-Q121 PolarHBondContact O-N 3.04Å; Q121-F123 PolarHBondContact O-N 3.48Å; Q121-L124 PolarHBondContact O-N 3.06Å; Q121-F125 WeakPolarHBondContact O-CB 3.28Å; Q121-F125 PolarHBondContact O-N 3.46Å; Q121-Y161 HydrophobicContact CG-CE1 4.06Å; Q121-Y269 PolarHBondContact OE1-OH 3.25Å |
| 122 | F | 94.4 | Very high | 92.1 | Very high | 60 Ų | 60 | 22.2 Ų | 22.2 | 26% | 0.263 | 12% | 0.119 | S | C | . | . | H | α-helix | trans | -57.4 | -46.1 | 176.1 | 170.9 | -99.3 | 0 | 0 | 0 | 112.4 | L118 A119 L120 S126 S158 | L118-F122 PolarHBondContact O-N 2.92Å; A119-F122 WeakPolarHBondContact O-CB 3.25Å; A119-F122 PolarHBondContact O-N 3.16Å; L120-F122 VanDerWaalsContact C-N 3.28Å; L120-F122 PolarHBondContact O-N 3.35Å; F122-S126 VanDerWaalsContact O-CB 3.27Å; F122-S126 WeakPolarHBondContact O-CB 2.9Å; F122-S126 PolarHBondContact O-N 2.93Å; F122-S126 PolarHBondContact O-OG 2.91Å; F122-S158 VanDerWaalsContact CE2-OG 3.29Å; F122-S158 WeakPolarHBondContact CE2-OG 3.13Å |
| 123 | F | 93 | Very high | 92.2 | Very high | 74 Ų | 74 | 20.1 Ų | 20.1 | 33% | 0.325 | 11% | 0.11 | S | C | . | . | H | α-helix | trans | -69.2 | -43.5 | 180 | -77.4 | -73.4 | 0 | 0 | 0 | 112.8 | I87 V91 A119 L120 Q121 S126 L127 | I87-F123 HydrophobicContact CG2-CD1 4.01Å; I87-F123 HydrophobicContact CG2-CE1 4.04Å; V91-F123 HydrophobicContact CB-CD2 4.37Å; V91-F123 HydrophobicContact CG1-CD2 3.85Å; V91-F123 HydrophobicContact CG1-CE2 4.43Å; V91-F123 HydrophobicContact CG2-CD2 3.94Å; V91-F123 HydrophobicContact CG2-CE2 4.08Å; V91-F123 HydrophobicContact CG2-CG 4.32Å; A119-F123 WeakPolarHBondContact O-CD2 3.24Å; A119-F123 PolarHBondContact O-N 2.84Å; L120-F123 PolarHBondContact O-N 3.19Å; Q121-F123 PolarHBondContact O-N 3.48Å; F123-S126 WeakPolarHBondContact O-CB 3.32Å; F123-S126 PolarHBondContact O-N 3.46Å; F123-L127 PolarHBondContact O-N 3.45Å |
| 124 | L | 94.9 | Very high | 92.2 | Very high | 0 Ų | 0 | 20.1 Ų | 20.1 | 0% | 0 | 11% | 0.11 | C | C | . | . | H | α-helix | trans | -64.2 | -45 | 178 | -66.3 | -178.7 | 0 | 0 | 0 | 111.3 | L120 Q121 S126 L127 E128 Y268 Y269 F272 V273 | L120-L124 HydrophobicContact CD1-CD1 3.82Å; L120-L124 HydrophobicContact CD1-CD2 4.41Å; L120-L124 HydrophobicContact CD1-CG 3.87Å; L120-L124 HydrophobicContact CD2-CD1 4.31Å; L120-L124 HydrophobicContact CG-CD1 3.88Å; L120-L124 HydrophobicContact CG-CG 4.27Å; L120-L124 WeakPolarHBondContact O-CG 3.38Å; L120-L124 PolarHBondContact O-N 3.12Å; Q121-L124 PolarHBondContact O-N 3.06Å; L124-S126 PolarHBondContact O-N 3.37Å; L124-L127 WeakPolarHBondContact O-CB 3.46Å; L124-L127 PolarHBondContact O-N 2.69Å; L124-E128 WeakPolarHBondContact O-CB 3.24Å; L124-E128 PolarHBondContact O-N 3.37Å; L124-Y268 HydrophobicContact CB-CE1 4.05Å; L124-Y268 HydrophobicContact CD1-CD1 4.38Å; L124-Y268 HydrophobicContact CD1-CE1 3.89Å; L124-Y269 HydrophobicContact CD1-CD1 3.48Å; L124-Y269 VanDerWaalsContact CD1-CD1 3.48Å; L124-Y269 HydrophobicContact CD1-CE1 3.68Å; L124-F272 HydrophobicContact CB-CE1 4.42Å; L124-F272 HydrophobicContact CD2-CD1 3.99Å; L124-F272 HydrophobicContact CD2-CE1 4.27Å; L124-V273 HydrophobicContact CD2-CG2 3.53Å |
| 125 | F | 95.1 | Very high | 91.9 | Very high | 10 Ų | 10 | 19.5 Ų | 19.5 | 4% | 0.044 | 11% | 0.107 | C | C | . | . | H | α-helix | trans | -66.8 | -36.9 | 177.3 | -169.9 | -105.6 | 0 | 0 | 0 | 112 | Q121 E128 I129 I157 Y161 L202 | Q121-F125 WeakPolarHBondContact O-CB 3.28Å; Q121-F125 PolarHBondContact O-N 3.46Å; F125-E128 WeakPolarHBondContact O-CB 3.46Å; F125-E128 PolarHBondContact O-N 3Å; F125-I129 HydrophobicContact CD1-CG1 4.17Å; F125-I129 HydrophobicContact CE1-CD1 4.14Å; F125-I129 HydrophobicContact CE1-CG1 3.82Å; F125-I129 HydrophobicContact CE2-CD1 4.22Å; F125-I129 HydrophobicContact CE2-CG1 4.47Å; F125-I129 HydrophobicContact CZ-CD1 3.8Å; F125-I129 HydrophobicContact CZ-CG1 3.99Å; F125-I129 WeakPolarHBondContact O-CG1 3.49Å; F125-I129 PolarHBondContact O-N 2.91Å; F125-I157 HydrophobicContact CE1-CG2 4.12Å; F125-Y161 AromaticContact CD1-CD1 3.88Å; F125-Y161 HydrophobicContact CD1-CD1 3.88Å; F125-Y161 AromaticContact CD1-CG 3.96Å; F125-Y161 HydrophobicContact CD1-CG 3.96Å; F125-Y161 HydrophobicContact CE1-CD1 4.09Å; F125-Y161 HydrophobicContact CE1-CD2 4.17Å; F125-Y161 AromaticContact CE1-CG 3.67Å; F125-Y161 HydrophobicContact CE1-CG 3.67Å; F125-Y161 HydrophobicContact CE2-CD2 4.43Å; F125-Y161 HydrophobicContact CG-CD1 4.11Å; F125-Y161 HydrophobicContact CG-CE1 4.44Å; F125-Y161 HydrophobicContact CG-CG 4.48Å; F125-Y161 HydrophobicContact CZ-CD2 4Å; F125-Y161 AromaticContact CZ-CG 3.98Å; F125-Y161 HydrophobicContact CZ-CG 3.98Å; F125-L202 HydrophobicContact CE2-CD1 3.86Å; F125-L202 HydrophobicContact CE2-CD2 3.96Å; F125-L202 HydrophobicContact CE2-CG 4.49Å |
| 126 | S | 94.2 | Very high | 91.6 | Very high | 14 Ų | 14 | 20.4 Ų | 20.4 | 10% | 0.098 | 11% | 0.108 | C | C | . | . | H | α-helix | trans | -58.5 | -49.1 | 170.8 | -64.8 | 0 | 0 | 0 | 0 | 111.4 | F122 F123 L124 E128 I129 I130 S158 | F122-S126 VanDerWaalsContact O-CB 3.27Å; F122-S126 WeakPolarHBondContact O-CB 2.9Å; F122-S126 PolarHBondContact O-N 2.93Å; F122-S126 PolarHBondContact O-OG 2.91Å; F123-S126 WeakPolarHBondContact O-CB 3.32Å; F123-S126 PolarHBondContact O-N 3.46Å; L124-S126 PolarHBondContact O-N 3.37Å; S126-E128 PolarHBondContact O-N 3.39Å; S126-I129 PolarHBondContact O-N 3.42Å; S126-I130 WeakPolarHBondContact O-CB 2.89Å; S126-I130 VanDerWaalsContact O-CD1 3.32Å; S126-I130 WeakPolarHBondContact O-CD1 3.42Å; S126-I130 WeakPolarHBondContact O-CG1 3.25Å; S126-I130 PolarHBondContact O-N 3.33Å; S126-S158 VanDerWaalsContact OG-CB 3.29Å; S126-S158 WeakPolarHBondContact OG-CB 3.49Å; S126-S158 PolarHBondContact OG-OG 2.99Å |
| 127 | L | 94.2 | Very high | 91 | Very high | 1 Ų | 1 | 23.2 Ų | 23.2 | 1% | 0.005 | 12% | 0.119 | C | C | . | . | H | α-helix | trans | -59.5 | -38.7 | 176.7 | 175.6 | 57 | 0 | 0 | 0 | 111.1 | L84 V85 F123 L124 I130 V131 F272 V273 V276 | L84-L127 HydrophobicContact CB-CD1 3.89Å; L84-L127 HydrophobicContact CD1-CD1 4.46Å; V85-L127 HydrophobicContact CG2-CD2 4.35Å; F123-L127 PolarHBondContact O-N 3.45Å; L124-L127 WeakPolarHBondContact O-CB 3.46Å; L124-L127 PolarHBondContact O-N 2.69Å; L127-I130 PolarHBondContact O-N 3.43Å; L127-V131 HydrophobicContact CD1-CG2 4.09Å; L127-V131 HydrophobicContact CG-CG2 4.48Å; L127-V131 WeakPolarHBondContact O-CB 3.44Å; L127-V131 VanDerWaalsContact O-CG2 3.25Å; L127-V131 WeakPolarHBondContact O-CG2 3.3Å; L127-V131 PolarHBondContact O-N 3.33Å; L127-F272 HydrophobicContact CB-CE1 4.13Å; L127-F272 HydrophobicContact CB-CZ 4.42Å; L127-F272 HydrophobicContact CD2-CE1 3.77Å; L127-F272 HydrophobicContact CD2-CZ 4.46Å; L127-F272 HydrophobicContact CG-CE1 3.89Å; L127-F272 HydrophobicContact CG-CZ 4.15Å; L127-V273 HydrophobicContact CD2-CG1 4.48Å; L127-V273 HydrophobicContact CD2-CG2 4.44Å; L127-V276 HydrophobicContact CD1-CG1 4.29Å; L127-V276 HydrophobicContact CD2-CG2 4.4Å; L127-V276 HydrophobicContact CG-CG2 4.49Å |
| 128 | E | 95.4 | Very high | 89.9 | Confident | 0 Ų | 0 | 26 Ų | 26 | 0% | 0 | 13% | 0.134 | C | C | . | . | H | α-helix | trans | -63.6 | -50.7 | 178.6 | -169.1 | 174.3 | 162.4 | 0 | 0 | 112.8 | L124 F125 S126 I130 V131 L132 Y206 Y240 Y268 F272 | L124-E128 WeakPolarHBondContact O-CB 3.24Å; L124-E128 PolarHBondContact O-N 3.37Å; F125-E128 WeakPolarHBondContact O-CB 3.46Å; F125-E128 PolarHBondContact O-N 3Å; S126-E128 PolarHBondContact O-N 3.39Å; E128-I130 VanDerWaalsContact C-N 3.27Å; E128-I130 PolarHBondContact O-N 2.99Å; E128-V131 PolarHBondContact O-N 2.83Å; E128-L132 PolarHBondContact O-N 3.2Å; E128-Y206 WeakPolarHBondContact CG-OH 3.47Å; E128-Y206 WeakPolarHBondContact OE1-CE2 3.38Å; E128-Y206 VanDerWaalsContact OE1-CZ 3.31Å; E128-Y206 PolarHBondContact OE1-OH 3.17Å; E128-Y240 VanDerWaalsContact CD-OH 3.28Å; E128-Y240 WeakPolarHBondContact OE1-CE2 3.24Å; E128-Y240 PolarHBondContact OE1-OH 3.29Å; E128-Y240 PolarHBondContact OE2-OH 2.69Å; E128-Y268 WeakPolarHBondContact OE2-CE2 3.38Å; E128-Y268 PolarHBondContact OE2-OH 2.92Å; E128-F272 HydrophobicContact CB-CE2 3.95Å; E128-F272 HydrophobicContact CB-CZ 3.59Å; E128-F272 HydrophobicContact CG-CE2 3.92Å; E128-F272 HydrophobicContact CG-CZ 4.09Å |
| 129 | I | 94.4 | Very high | 88.5 | Confident | 16 Ų | 16 | 26.4 Ų | 26.4 | 8% | 0.082 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -62.2 | -38.6 | 176.2 | -61.7 | -55.8 | 0 | 0 | 0 | 110.7 | F125 S126 L132 V133 A154 I157 | F125-I129 HydrophobicContact CD1-CG1 4.17Å; F125-I129 HydrophobicContact CE1-CD1 4.14Å; F125-I129 HydrophobicContact CE1-CG1 3.82Å; F125-I129 HydrophobicContact CE2-CD1 4.22Å; F125-I129 HydrophobicContact CE2-CG1 4.47Å; F125-I129 HydrophobicContact CZ-CD1 3.8Å; F125-I129 HydrophobicContact CZ-CG1 3.99Å; F125-I129 WeakPolarHBondContact O-CG1 3.49Å; F125-I129 PolarHBondContact O-N 2.91Å; S126-I129 PolarHBondContact O-N 3.42Å; I129-L132 HydrophobicContact CD1-CD1 4.33Å; I129-L132 PolarHBondContact O-N 3.36Å; I129-V133 HydrophobicContact CG2-CG2 4.24Å; I129-V133 WeakPolarHBondContact O-CB 3.41Å; I129-V133 VanDerWaalsContact O-CG2 3.25Å; I129-V133 WeakPolarHBondContact O-CG2 3.5Å; I129-V133 PolarHBondContact O-N 3.35Å; I129-A154 HydrophobicContact CB-CB 4.11Å; I129-A154 HydrophobicContact CG2-CB 3.76Å; I129-I157 HydrophobicContact CD1-CG2 4.19Å; I129-I157 HydrophobicContact CG1-CG2 4.07Å; I129-I157 HydrophobicContact CG2-CD1 4.14Å |
| 130 | I | 92.3 | Very high | 87.4 | Confident | 5 Ų | 5 | 32.7 Ų | 32.7 | 3% | 0.026 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -60.4 | -49.8 | 174.6 | -70.8 | 164.5 | 0 | 0 | 0 | 110.2 | F81 L84 S126 L127 E128 L132 V133 F134 L151 A154 | F81-I130 HydrophobicContact CE1-CG2 4.2Å; L84-I130 HydrophobicContact CD1-CB 4.48Å; L84-I130 HydrophobicContact CD1-CD1 3.59Å; L84-I130 HydrophobicContact CD1-CG2 3.79Å; L84-I130 HydrophobicContact CD2-CD1 4Å; L84-I130 HydrophobicContact CG-CD1 4.45Å; S126-I130 WeakPolarHBondContact O-CB 2.89Å; S126-I130 VanDerWaalsContact O-CD1 3.32Å; S126-I130 WeakPolarHBondContact O-CD1 3.42Å; S126-I130 WeakPolarHBondContact O-CG1 3.25Å; S126-I130 PolarHBondContact O-N 3.33Å; L127-I130 PolarHBondContact O-N 3.43Å; E128-I130 VanDerWaalsContact C-N 3.27Å; E128-I130 PolarHBondContact O-N 2.99Å; I130-L132 VanDerWaalsContact C-N 3.32Å; I130-L132 PolarHBondContact O-N 3.09Å; I130-V133 PolarHBondContact O-N 2.84Å; I130-F134 HydrophobicContact CG2-CD2 3.51Å; I130-F134 HydrophobicContact CG2-CE2 3.66Å; I130-F134 WeakPolarHBondContact O-CB 2.93Å; I130-F134 VanDerWaalsContact O-CD2 3.24Å; I130-F134 WeakPolarHBondContact O-CD2 3.47Å; I130-F134 PolarHBondContact O-N 3.14Å; I130-L151 HydrophobicContact CD1-CD2 3.5Å; I130-L151 VanDerWaalsContact CD1-CD2 3.5Å; I130-L151 HydrophobicContact CG1-CD2 4.05Å; I130-A154 HydrophobicContact CD1-CB 4.22Å; I130-A154 HydrophobicContact CG1-CB 3.47Å; I130-A154 VanDerWaalsContact CG1-CB 3.47Å |
| 131 | V | 91.1 | Very high | 86.2 | Confident | 1 Ų | 1 | 33.4 Ų | 33.4 | 1% | 0.006 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -59.4 | -42.3 | 177.8 | 164.5 | 0 | 0 | 0 | 0 | 111.6 | F81 L127 E128 G135 F229 Y232 V276 F280 | F81-V131 HydrophobicContact CE1-CG2 3.8Å; L127-V131 HydrophobicContact CD1-CG2 4.09Å; L127-V131 HydrophobicContact CG-CG2 4.48Å; L127-V131 WeakPolarHBondContact O-CB 3.44Å; L127-V131 VanDerWaalsContact O-CG2 3.25Å; L127-V131 WeakPolarHBondContact O-CG2 3.3Å; L127-V131 PolarHBondContact O-N 3.33Å; E128-V131 PolarHBondContact O-N 2.83Å; V131-G135 WeakPolarHBondContact O-CA 3.34Å; V131-G135 PolarHBondContact O-N 3.45Å; V131-F229 HydrophobicContact CG1-CE2 4.38Å; V131-Y232 HydrophobicContact CG1-CE1 3.81Å; V131-V276 HydrophobicContact CG2-CB 4.48Å; V131-V276 HydrophobicContact CG2-CG1 3.72Å; V131-V276 HydrophobicContact CG2-CG2 3.87Å; V131-F280 HydrophobicContact CB-CE2 4.4Å; V131-F280 HydrophobicContact CG1-CE2 3.54Å; V131-F280 HydrophobicContact CG1-CZ 3.85Å; V131-F280 HydrophobicContact CG2-CE2 4.14Å |
| 132 | L | 90.5 | Very high | 85.1 | Confident | 16 Ų | 16 | 38.2 Ų | 38.2 | 8% | 0.084 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -62.8 | -48.9 | 175.8 | -82.7 | 173.7 | 0 | 0 | 0 | 112.1 | E128 I129 I130 G135 L136 Y206 V209 | E128-L132 PolarHBondContact O-N 3.2Å; I129-L132 HydrophobicContact CD1-CD1 4.33Å; I129-L132 PolarHBondContact O-N 3.36Å; I130-L132 VanDerWaalsContact C-N 3.32Å; I130-L132 PolarHBondContact O-N 3.09Å; L132-G135 PolarHBondContact O-N 2.93Å; L132-L136 WeakPolarHBondContact O-CB 3.39Å; L132-L136 WeakPolarHBondContact O-CG 3.26Å; L132-L136 PolarHBondContact O-N 3.5Å; L132-Y206 HydrophobicContact CD1-CE1 4.25Å; L132-Y206 HydrophobicContact CD1-CE2 4.32Å; L132-Y206 WeakPolarHBondContact CD1-OH 3.23Å; L132-Y206 HydrophobicContact CD2-CD1 3.97Å; L132-Y206 HydrophobicContact CD2-CE1 3.38Å; L132-Y206 HydrophobicContact CG-CE1 3.91Å; L132-V209 HydrophobicContact CD2-CG2 4.37Å |
| 133 | V | 88.8 | Confident | 84.6 | Confident | 27 Ų | 27 | 38.5 Ų | 38.5 | 16% | 0.164 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -62.4 | -49 | 179.4 | 168.9 | 0 | 0 | 0 | 0 | 110.2 | I129 I130 G135 L136 F137 L141 A150 | I129-V133 HydrophobicContact CG2-CG2 4.24Å; I129-V133 WeakPolarHBondContact O-CB 3.41Å; I129-V133 VanDerWaalsContact O-CG2 3.25Å; I129-V133 WeakPolarHBondContact O-CG2 3.5Å; I129-V133 PolarHBondContact O-N 3.35Å; I130-V133 PolarHBondContact O-N 2.84Å; V133-G135 PolarHBondContact O-N 3.37Å; V133-L136 PolarHBondContact O-N 2.79Å; V133-F137 HydrophobicContact CG1-CD2 4Å; V133-F137 VanDerWaalsContact O-CB 3.29Å; V133-F137 WeakPolarHBondContact O-CB 3.3Å; V133-F137 VanDerWaalsContact O-CD2 3.23Å; V133-F137 WeakPolarHBondContact O-CD2 3.27Å; V133-F137 PolarHBondContact O-N 3.44Å; V133-L141 HydrophobicContact CG1-CD1 4.11Å; V133-A150 HydrophobicContact CG1-CB 3.82Å |
| 134 | F | 85.4 | Confident | 84.1 | Confident | 3 Ų | 3 | 42.7 Ų | 42.7 | 1% | 0.013 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -64 | -42.5 | 176 | -83.4 | -75.5 | 0 | 0 | 0 | 112 | V77 F81 I130 L136 F137 L138 L141 I147 A150 | V77-F134 HydrophobicContact CG1-CD1 4.21Å; V77-F134 HydrophobicContact CG1-CE1 4.07Å; V77-F134 HydrophobicContact CG2-CE1 4.28Å; F81-F134 HydrophobicContact CE1-CD2 4.36Å; F81-F134 HydrophobicContact CE2-CB 4.07Å; F81-F134 HydrophobicContact CE2-CD1 4.26Å; F81-F134 HydrophobicContact CE2-CD2 4.1Å; F81-F134 AromaticContact CE2-CG 3.89Å; F81-F134 HydrophobicContact CE2-CG 3.89Å; F81-F134 HydrophobicContact CZ-CB 3.53Å; F81-F134 HydrophobicContact CZ-CD1 4.44Å; F81-F134 AromaticContact CZ-CD2 3.66Å; F81-F134 HydrophobicContact CZ-CD2 3.66Å; F81-F134 AromaticContact CZ-CG 3.63Å; F81-F134 HydrophobicContact CZ-CG 3.63Å; I130-F134 HydrophobicContact CG2-CD2 3.51Å; I130-F134 HydrophobicContact CG2-CE2 3.66Å; I130-F134 WeakPolarHBondContact O-CB 2.93Å; I130-F134 VanDerWaalsContact O-CD2 3.24Å; I130-F134 WeakPolarHBondContact O-CD2 3.47Å; I130-F134 PolarHBondContact O-N 3.14Å; F134-L136 VanDerWaalsContact C-N 3.31Å; F134-L136 PolarHBondContact O-N 3Å; F134-F137 PolarHBondContact O-N 2.87Å; F134-L138 WeakPolarHBondContact O-CA 3.33Å; F134-L138 WeakPolarHBondContact O-CB 3.3Å; F134-L138 VanDerWaalsContact O-CD1 3.29Å; F134-L138 WeakPolarHBondContact O-CD1 3.5Å; F134-L138 WeakPolarHBondContact O-CG 3.27Å; F134-L138 PolarHBondContact O-N 2.97Å; F134-L141 HydrophobicContact CB-CD1 4.43Å; F134-L141 HydrophobicContact CD1-CB 3.98Å; F134-L141 HydrophobicContact CD1-CD1 3.43Å; F134-L141 VanDerWaalsContact CD1-CD1 3.43Å; F134-L141 HydrophobicContact CD1-CG 4.36Å; F134-L141 HydrophobicContact CE1-CB 3.74Å; F134-L141 HydrophobicContact CE1-CD1 3.71Å; F134-L141 HydrophobicContact CE1-CG 4.3Å; F134-L141 HydrophobicContact CG-CD1 3.93Å; F134-L141 HydrophobicContact CZ-CD1 4.41Å; F134-I147 HydrophobicContact CE1-CG1 4.05Å; F134-I147 HydrophobicContact CZ-CB 4.24Å; F134-I147 HydrophobicContact CZ-CG1 3.88Å; F134-I147 HydrophobicContact CZ-CG2 4.06Å; F134-A150 HydrophobicContact CE2-CB 4.35Å; F134-A150 HydrophobicContact CZ-CB 4.47Å |
| 135 | G | 82.6 | Confident | 83.8 | Confident | 0 Ų | 0 | 46.6 Ų | 46.6 | 0% | 0 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -54 | -46.4 | 175 | 0 | 0 | 0 | 0 | 0 | 112.6 | V131 L132 V133 P224 | V131-G135 WeakPolarHBondContact O-CA 3.34Å; V131-G135 PolarHBondContact O-N 3.45Å; L132-G135 PolarHBondContact O-N 2.93Å; V133-G135 PolarHBondContact O-N 3.37Å; G135-P224 WeakPolarHBondContact O-CD 3.34Å; G135-P224 WeakPolarHBondContact O-CG 3.32Å |
| 136 | L | 81.7 | Confident | 83.3 | Confident | 69 Ų | 69 | 47.6 Ų | 47.6 | 36% | 0.361 | 25% | 0.25 | S | C | . | . | H | α-helix | trans | -80.9 | -30.5 | -177.7 | -71.9 | 174 | 0 | 0 | 0 | 113.9 | L132 V133 F134 V209 L212 | L132-L136 WeakPolarHBondContact O-CB 3.39Å; L132-L136 WeakPolarHBondContact O-CG 3.26Å; L132-L136 PolarHBondContact O-N 3.5Å; V133-L136 PolarHBondContact O-N 2.79Å; F134-L136 VanDerWaalsContact C-N 3.31Å; F134-L136 PolarHBondContact O-N 3Å; L136-V209 HydrophobicContact CD1-CG2 4.39Å; L136-V209 HydrophobicContact CD2-CG2 4Å; L136-V209 HydrophobicContact CG-CG2 4.42Å; L136-L212 HydrophobicContact CD2-CD1 3.89Å |
| 137 | F | 79.2 | Confident | 83 | Confident | 97 Ų | 97 | 47.3 Ų | 47.3 | 43% | 0.425 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -114.4 | 17.1 | -172.5 | -61.9 | -76.4 | 0 | 0 | 0 | 113.8 | V133 F134 G139 R140 L141 | V133-F137 HydrophobicContact CG1-CD2 4Å; V133-F137 VanDerWaalsContact O-CB 3.29Å; V133-F137 WeakPolarHBondContact O-CB 3.3Å; V133-F137 VanDerWaalsContact O-CD2 3.23Å; V133-F137 WeakPolarHBondContact O-CD2 3.27Å; V133-F137 PolarHBondContact O-N 3.44Å; F134-F137 PolarHBondContact O-N 2.87Å; F137-G139 VanDerWaalsContact C-N 3.28Å; F137-G139 PolarHBondContact O-N 3.15Å; F137-R140 PolarHBondContact O-N 3.39Å; F137-L141 HydrophobicContact CB-CD1 3.72Å; F137-L141 HydrophobicContact CB-CG 4Å; F137-L141 PolarHBondContact O-N 3.5Å |
| 138 | L | 67.1 | Low | 82.8 | Confident | 71 Ų | 71 | 54.2 Ų | 54.2 | 37% | 0.372 | 28% | 0.277 | S | S | . | . | G | 310 helix | trans | -43.2 | -49.1 | -172.4 | -108.5 | 137.7 | 0 | 0 | 0 | 113.2 | F134 R140 L141 P224 | F134-L138 WeakPolarHBondContact O-CA 3.33Å; F134-L138 WeakPolarHBondContact O-CB 3.3Å; F134-L138 VanDerWaalsContact O-CD1 3.29Å; F134-L138 WeakPolarHBondContact O-CD1 3.5Å; F134-L138 WeakPolarHBondContact O-CG 3.27Å; F134-L138 PolarHBondContact O-N 2.97Å; L138-R140 VanDerWaalsContact C-N 3.26Å; L138-R140 PolarHBondContact O-N 3.04Å; L138-L141 PolarHBondContact O-N 3.49Å; L138-P224 HydrophobicContact CD1-CB 4.13Å; L138-P224 HydrophobicContact CD1-CG 3.83Å |
| 139 | G | 64.9 | Low | 82.6 | Confident | 37 Ų | 37 | 62.7 Ų | 62.7 | 38% | 0.381 | 31% | 0.309 | S | S | . | . | G | 310 helix | trans | -77.5 | 3 | -178 | 0 | 0 | 0 | 0 | 0 | 116.3 | F137 | F137-G139 VanDerWaalsContact C-N 3.28Å; F137-G139 PolarHBondContact O-N 3.15Å |
| 140 | R | 68.8 | Low | 82.4 | Confident | 174 Ų | 174 | 62.2 Ų | 62.2 | 66% | 0.657 | 31% | 0.307 | S | S | * | . | G | 310 helix | trans | -113.1 | -8.8 | 175.2 | -64.2 | -175.3 | -177.7 | 174.3 | 1.2 | 113.3 | F137 L138 S146 L222 | F137-R140 PolarHBondContact O-N 3.39Å; L138-R140 VanDerWaalsContact C-N 3.26Å; L138-R140 PolarHBondContact O-N 3.04Å; R140-S146 PolarHBondContact O-OG 2.88Å; R140-L222 HydrophobicContact CG-CD1 4.39Å |
| 141 | L | 68.9 | Low | 82.4 | Confident | 14 Ų | 14 | 64.7 Ų | 64.7 | 7% | 0.073 | 32% | 0.32 | C | S | . | . | trans | -103.4 | 18.6 | -168.4 | -68.4 | 171.2 | 0 | 0 | 0 | 114.4 | V133 F134 F137 L138 S143 S146 I147 A150 | V133-L141 HydrophobicContact CG1-CD1 4.11Å; F134-L141 HydrophobicContact CB-CD1 4.43Å; F134-L141 HydrophobicContact CD1-CB 3.98Å; F134-L141 HydrophobicContact CD1-CD1 3.43Å; F134-L141 VanDerWaalsContact CD1-CD1 3.43Å; F134-L141 HydrophobicContact CD1-CG 4.36Å; F134-L141 HydrophobicContact CE1-CB 3.74Å; F134-L141 HydrophobicContact CE1-CD1 3.71Å; F134-L141 HydrophobicContact CE1-CG 4.3Å; F134-L141 HydrophobicContact CG-CD1 3.93Å; F134-L141 HydrophobicContact CZ-CD1 4.41Å; F137-L141 HydrophobicContact CB-CD1 3.72Å; F137-L141 HydrophobicContact CB-CG 4Å; F137-L141 PolarHBondContact O-N 3.5Å; L138-L141 PolarHBondContact O-N 3.49Å; L141-S143 VanDerWaalsContact C-N 3.27Å; L141-S143 PolarHBondContact O-N 3.04Å; L141-S146 VanDerWaalsContact CD2-OG 3.25Å; L141-S146 WeakPolarHBondContact CD2-OG 3.41Å; L141-I147 WeakPolarHBondContact O-CG1 3.4Å; L141-A150 HydrophobicContact CD2-CB 4.24Å | ||
| 142 | D | 71.2 | Confident | 82.5 | Confident | 114 Ų | 114 | 68.1 Ų | 68.1 | 61% | 0.61 | 34% | 0.341 | S | S | * | . | trans | -70.9 | -17.1 | -176.2 | -70.6 | -34.2 | 0 | 0 | 0 | 114.7 | ||||
| 143 | S | 82 | Confident | 82.6 | Confident | 65 Ų | 65 | 70.8 Ų | 70.8 | 46% | 0.455 | 36% | 0.358 | S | S | . | . | S | Bend | trans | -86.5 | 142.4 | 178.7 | 175 | 0 | 0 | 0 | 0 | 112.7 | L141 T145 S146 I147 | L141-S143 VanDerWaalsContact C-N 3.27Å; L141-S143 PolarHBondContact O-N 3.04Å; S143-T145 PolarHBondContact O-N 3.17Å; S143-T145 VanDerWaalsContact O-N 3.16Å; S143-T145 PolarHBondContact OG-N 2.88Å; S143-S146 WeakPolarHBondContact O-CA 3.38Å; S143-S146 VanDerWaalsContact O-CB 3.24Å; S143-S146 WeakPolarHBondContact O-CB 3.02Å; S143-S146 PolarHBondContact O-N 3.29Å; S143-I147 PolarHBondContact O-N 3.41Å |
| 144 | K | 84.5 | Confident | 82.8 | Confident | 163 Ų | 163 | 69.5 Ų | 69.5 | 71% | 0.709 | 35% | 0.35 | S | S | * | . | H | α-helix | trans | -50.5 | -38.9 | 171.8 | -68.6 | -178.9 | -179.8 | -179.2 | 0 | 112.4 | P76 S146 K148 | P76-K144 HydrophobicContact CB-CG 4.21Å; P76-K144 HydrophobicContact CG-CG 3.83Å; K144-S146 VanDerWaalsContact C-N 3.35Å; K144-K148 PolarHBondContact O-N 2.88Å |
| 145 | T | 87 | Confident | 83.2 | Confident | 82 Ų | 82 | 71.7 Ų | 71.7 | 50% | 0.503 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -67.6 | -37.6 | 178.3 | -55.2 | 0 | 0 | 0 | 0 | 111.6 | S143 K148 R149 | S143-T145 PolarHBondContact O-N 3.17Å; S143-T145 VanDerWaalsContact O-N 3.16Å; S143-T145 PolarHBondContact OG-N 2.88Å; T145-K148 PolarHBondContact O-N 3Å; T145-R149 WeakPolarHBondContact O-CG 3.3Å; T145-R149 PolarHBondContact O-N 3.38Å |
| 146 | S | 85.3 | Confident | 83.9 | Confident | 31 Ų | 31 | 76.7 Ų | 76.7 | 22% | 0.217 | 39% | 0.394 | C | S | . | . | H | α-helix | trans | -65.8 | -45.5 | 178 | -139.9 | 0 | 0 | 0 | 0 | 110.9 | R140 L141 S143 K144 K148 R149 A150 | R140-S146 PolarHBondContact O-OG 2.88Å; L141-S146 VanDerWaalsContact CD2-OG 3.25Å; L141-S146 WeakPolarHBondContact CD2-OG 3.41Å; S143-S146 WeakPolarHBondContact O-CA 3.38Å; S143-S146 VanDerWaalsContact O-CB 3.24Å; S143-S146 WeakPolarHBondContact O-CB 3.02Å; S143-S146 PolarHBondContact O-N 3.29Å; K144-S146 VanDerWaalsContact C-N 3.35Å; S146-K148 PolarHBondContact O-N 3.49Å; S146-R149 PolarHBondContact O-N 3.3Å; S146-A150 PolarHBondContact O-N 3.38Å |
| 147 | I | 88 | Confident | 84.6 | Confident | 7 Ų | 7 | 77 Ų | 77 | 4% | 0.036 | 40% | 0.395 | C | S | . | . | H | α-helix | trans | -58.4 | -48.2 | 173.9 | -62.8 | 174.3 | 0 | 0 | 0 | 110.7 | P76 V77 T80 F134 L141 S143 R149 A150 L151 | P76-I147 HydrophobicContact CB-CD1 3.77Å; P76-I147 HydrophobicContact CG-CD1 3.5Å; P76-I147 VanDerWaalsContact CG-CD1 3.5Å; V77-I147 HydrophobicContact CB-CD1 4.37Å; V77-I147 HydrophobicContact CG2-CD1 3.58Å; V77-I147 HydrophobicContact CG2-CG1 4.23Å; T80-I147 HydrophobicContact CG2-CG2 4.1Å; F134-I147 HydrophobicContact CE1-CG1 4.05Å; F134-I147 HydrophobicContact CZ-CB 4.24Å; F134-I147 HydrophobicContact CZ-CG1 3.88Å; F134-I147 HydrophobicContact CZ-CG2 4.06Å; L141-I147 WeakPolarHBondContact O-CG1 3.4Å; S143-I147 PolarHBondContact O-N 3.41Å; I147-R149 VanDerWaalsContact C-N 3.29Å; I147-R149 PolarHBondContact O-N 3.42Å; I147-A150 PolarHBondContact O-N 2.97Å; I147-A150 VanDerWaalsContact O-N 3.17Å; I147-L151 HydrophobicContact CG2-CD1 4.04Å; I147-L151 HydrophobicContact CG2-CG 4.33Å; I147-L151 WeakPolarHBondContact O-CG 3.43Å; I147-L151 PolarHBondContact O-N 3.36Å |
| 148 | K | 90.7 | Very high | 85.4 | Confident | 147 Ų | 147 | 72.3 Ų | 72.3 | 64% | 0.639 | 38% | 0.375 | S | S | * | . | H | α-helix | trans | -57.9 | -42.8 | 178 | -174.1 | 179.8 | 178.2 | -179.5 | 0 | 111.6 | K144 T145 S146 L151 V152 | K144-K148 PolarHBondContact O-N 2.88Å; T145-K148 PolarHBondContact O-N 3Å; S146-K148 PolarHBondContact O-N 3.49Å; K148-L151 PolarHBondContact O-N 3.22Å; K148-V152 VanDerWaalsContact O-CG2 3.32Å; K148-V152 WeakPolarHBondContact O-CG2 3.37Å; K148-V152 PolarHBondContact O-N 2.65Å |
| 149 | R | 90.8 | Very high | 86.8 | Confident | 177 Ų | 177 | 69.8 Ų | 69.8 | 67% | 0.668 | 37% | 0.366 | S | S | * | . | H | α-helix | trans | -63.2 | -44.9 | 176.4 | -71.5 | 175.8 | -175.6 | -152.8 | 1.9 | 111.6 | T145 S146 I147 L151 V152 V153 | T145-R149 WeakPolarHBondContact O-CG 3.3Å; T145-R149 PolarHBondContact O-N 3.38Å; S146-R149 PolarHBondContact O-N 3.3Å; I147-R149 VanDerWaalsContact C-N 3.29Å; I147-R149 PolarHBondContact O-N 3.42Å; R149-L151 VanDerWaalsContact C-N 3.33Å; R149-L151 PolarHBondContact O-N 2.86Å; R149-V152 PolarHBondContact O-N 2.91Å; R149-V153 WeakPolarHBondContact O-CG2 3.35Å; R149-V153 PolarHBondContact O-N 3.4Å |
| 150 | A | 89.7 | Confident | 88.3 | Confident | 6 Ų | 6 | 72.3 Ų | 72.3 | 5% | 0.05 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -59.6 | -43.3 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112 | V133 F134 L141 S146 I147 V153 A154 | V133-A150 HydrophobicContact CG1-CB 3.82Å; F134-A150 HydrophobicContact CE2-CB 4.35Å; F134-A150 HydrophobicContact CZ-CB 4.47Å; L141-A150 HydrophobicContact CD2-CB 4.24Å; S146-A150 PolarHBondContact O-N 3.38Å; I147-A150 PolarHBondContact O-N 2.97Å; I147-A150 VanDerWaalsContact O-N 3.17Å; A150-V153 PolarHBondContact O-N 3.4Å; A150-A154 WeakPolarHBondContact O-CB 3.34Å; A150-A154 PolarHBondContact O-N 2.93Å |
| 151 | L | 92.4 | Very high | 89.6 | Confident | 57 Ų | 57 | 65.4 Ų | 65.4 | 30% | 0.298 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -62.7 | -42.9 | 176 | -68.2 | 175.3 | 0 | 0 | 0 | 112.3 | T80 L84 I130 I147 K148 R149 A154 A155 | T80-L151 HydrophobicContact CG2-CD1 4.2Å; T80-L151 HydrophobicContact CG2-CD2 4.01Å; T80-L151 HydrophobicContact CG2-CG 4.5Å; L84-L151 HydrophobicContact CD1-CD2 4.15Å; I130-L151 HydrophobicContact CD1-CD2 3.5Å; I130-L151 VanDerWaalsContact CD1-CD2 3.5Å; I130-L151 HydrophobicContact CG1-CD2 4.05Å; I147-L151 HydrophobicContact CG2-CD1 4.04Å; I147-L151 HydrophobicContact CG2-CG 4.33Å; I147-L151 WeakPolarHBondContact O-CG 3.43Å; I147-L151 PolarHBondContact O-N 3.36Å; K148-L151 PolarHBondContact O-N 3.22Å; R149-L151 VanDerWaalsContact C-N 3.33Å; R149-L151 PolarHBondContact O-N 2.86Å; L151-A154 PolarHBondContact O-N 2.93Å; L151-A155 WeakPolarHBondContact O-CB 3.17Å; L151-A155 PolarHBondContact O-N 3.21Å |
| 152 | V | 93.6 | Very high | 90.9 | Very high | 74 Ų | 74 | 65.5 Ų | 65.5 | 45% | 0.448 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -64.9 | -45.9 | 177.4 | 170.6 | 0 | 0 | 0 | 0 | 111.1 | K148 R149 A154 A155 I156 | K148-V152 VanDerWaalsContact O-CG2 3.32Å; K148-V152 WeakPolarHBondContact O-CG2 3.37Å; K148-V152 PolarHBondContact O-N 2.65Å; R149-V152 PolarHBondContact O-N 2.91Å; V152-A154 VanDerWaalsContact C-N 3.34Å; V152-A154 PolarHBondContact O-N 3Å; V152-A155 PolarHBondContact O-N 3.46Å; V152-I156 HydrophobicContact CG1-CD1 3.91Å; V152-I156 WeakPolarHBondContact O-CG1 3.33Å; V152-I156 PolarHBondContact O-N 3.43Å |
| 153 | V | 91.8 | Very high | 92.1 | Very high | 72 Ų | 72 | 65.4 Ų | 65.4 | 44% | 0.436 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -60.5 | -45.3 | 177.1 | 170.8 | 0 | 0 | 0 | 0 | 110.7 | R149 A150 A155 I156 I157 | R149-V153 WeakPolarHBondContact O-CG2 3.35Å; R149-V153 PolarHBondContact O-N 3.4Å; A150-V153 PolarHBondContact O-N 3.4Å; V153-A155 VanDerWaalsContact C-N 3.35Å; V153-A155 PolarHBondContact O-N 2.9Å; V153-I156 PolarHBondContact O-N 3.45Å; V153-I157 HydrophobicContact CG1-CD1 3.73Å; V153-I157 HydrophobicContact CG1-CG1 4.45Å; V153-I157 WeakPolarHBondContact O-CG1 3.48Å; V153-I157 PolarHBondContact O-N 3.17Å |
| 154 | A | 93 | Very high | 92.7 | Very high | 0 Ų | 0 | 64.6 Ų | 64.6 | 0% | 0 | 34% | 0.343 | C | S | . | . | H | α-helix | trans | -62.7 | -40.3 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | I129 I130 A150 L151 V152 I157 S158 | I129-A154 HydrophobicContact CB-CB 4.11Å; I129-A154 HydrophobicContact CG2-CB 3.76Å; I130-A154 HydrophobicContact CD1-CB 4.22Å; I130-A154 HydrophobicContact CG1-CB 3.47Å; I130-A154 VanDerWaalsContact CG1-CB 3.47Å; A150-A154 WeakPolarHBondContact O-CB 3.34Å; A150-A154 PolarHBondContact O-N 2.93Å; L151-A154 PolarHBondContact O-N 2.93Å; V152-A154 VanDerWaalsContact C-N 3.34Å; V152-A154 PolarHBondContact O-N 3Å; A154-I157 PolarHBondContact O-N 3.02Å; A154-S158 VanDerWaalsContact O-CB 3.25Å; A154-S158 WeakPolarHBondContact O-CB 3.3Å; A154-S158 PolarHBondContact O-N 3.34Å; A154-S158 PolarHBondContact O-OG 3.33Å |
| 155 | A | 94.5 | Very high | 93.2 | Very high | 48 Ų | 48 | 56.9 Ų | 56.9 | 40% | 0.397 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -64.5 | -37.8 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | L151 V152 V153 S158 G159 | L151-A155 WeakPolarHBondContact O-CB 3.17Å; L151-A155 PolarHBondContact O-N 3.21Å; V152-A155 PolarHBondContact O-N 3.46Å; V153-A155 VanDerWaalsContact C-N 3.35Å; V153-A155 PolarHBondContact O-N 2.9Å; A155-S158 WeakPolarHBondContact CA-OG 3.47Å; A155-S158 PolarHBondContact O-OG 3.39Å; A155-S158 VanDerWaalsContact O-OG 3.1Å; A155-G159 WeakPolarHBondContact O-CA 3.25Å; A155-G159 PolarHBondContact O-N 3.31Å |
| 156 | I | 96.9 | Very high | 93.5 | Very high | 106 Ų | 106 | 53.9 Ų | 53.9 | 54% | 0.544 | 29% | 0.293 | S | S | . | . | H | α-helix | trans | -67.5 | -49.6 | 175.8 | -67.5 | 166.3 | 0 | 0 | 0 | 110.3 | V152 V153 S158 G159 V160 | V152-I156 HydrophobicContact CG1-CD1 3.91Å; V152-I156 WeakPolarHBondContact O-CG1 3.33Å; V152-I156 PolarHBondContact O-N 3.43Å; V153-I156 PolarHBondContact O-N 3.45Å; I156-S158 PolarHBondContact O-N 3.36Å; I156-G159 PolarHBondContact O-N 2.89Å; I156-V160 WeakPolarHBondContact O-CG2 3.4Å; I156-V160 PolarHBondContact O-N 3.5Å |
| 157 | I | 96.1 | Very high | 93.9 | Very high | 74 Ų | 74 | 56.5 Ų | 56.5 | 38% | 0.379 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -60.8 | -47.5 | -179.4 | -67.9 | 169.8 | 0 | 0 | 0 | 110.6 | F125 I129 V153 A154 G159 V160 Y161 | F125-I157 HydrophobicContact CE1-CG2 4.12Å; I129-I157 HydrophobicContact CD1-CG2 4.19Å; I129-I157 HydrophobicContact CG1-CG2 4.07Å; I129-I157 HydrophobicContact CG2-CD1 4.14Å; V153-I157 HydrophobicContact CG1-CD1 3.73Å; V153-I157 HydrophobicContact CG1-CG1 4.45Å; V153-I157 WeakPolarHBondContact O-CG1 3.48Å; V153-I157 PolarHBondContact O-N 3.17Å; A154-I157 PolarHBondContact O-N 3.02Å; I157-G159 VanDerWaalsContact C-N 3.34Å; I157-V160 PolarHBondContact O-N 3.41Å; I157-Y161 WeakPolarHBondContact O-CB 3.36Å; I157-Y161 PolarHBondContact O-N 3.01Å |
| 158 | S | 96.3 | Very high | 94.1 | Very high | 0 Ų | 0 | 59.1 Ų | 59.1 | 0% | 0 | 32% | 0.324 | C | S | . | . | H | α-helix | trans | -67.2 | -34.1 | 177.2 | 57.4 | 0 | 0 | 0 | 0 | 113.2 | F122 S126 A154 A155 I156 S162 | F122-S158 VanDerWaalsContact CE2-OG 3.29Å; F122-S158 WeakPolarHBondContact CE2-OG 3.13Å; S126-S158 VanDerWaalsContact OG-CB 3.29Å; S126-S158 WeakPolarHBondContact OG-CB 3.49Å; S126-S158 PolarHBondContact OG-OG 2.99Å; A154-S158 VanDerWaalsContact O-CB 3.25Å; A154-S158 WeakPolarHBondContact O-CB 3.3Å; A154-S158 PolarHBondContact O-N 3.34Å; A154-S158 PolarHBondContact O-OG 3.33Å; A155-S158 WeakPolarHBondContact CA-OG 3.47Å; A155-S158 PolarHBondContact O-OG 3.39Å; A155-S158 VanDerWaalsContact O-OG 3.1Å; I156-S158 PolarHBondContact O-N 3.36Å; S158-S162 WeakPolarHBondContact O-CB 3.46Å; S158-S162 PolarHBondContact O-N 2.85Å |
| 159 | G | 96.4 | Very high | 94 | Very high | 18 Ų | 18 | 52.3 Ų | 52.3 | 19% | 0.186 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -62.8 | -49.8 | 173.7 | 0 | 0 | 0 | 0 | 0 | 111.6 | A155 I156 I157 Y161 S162 I163 | A155-G159 WeakPolarHBondContact O-CA 3.25Å; A155-G159 PolarHBondContact O-N 3.31Å; I156-G159 PolarHBondContact O-N 2.89Å; I157-G159 VanDerWaalsContact C-N 3.34Å; G159-Y161 PolarHBondContact O-N 2.89Å; G159-S162 PolarHBondContact O-N 3.43Å; G159-I163 WeakPolarHBondContact O-CB 3.22Å; G159-I163 WeakPolarHBondContact O-CD1 3.45Å; G159-I163 WeakPolarHBondContact O-CG1 3.35Å; G159-I163 PolarHBondContact O-N 3.22Å |
| 160 | V | 97.3 | Very high | 93.9 | Very high | 90 Ų | 90 | 48.9 Ų | 48.9 | 55% | 0.545 | 28% | 0.284 | S | S | . | . | H | α-helix | trans | -59 | -49.1 | 175.9 | 172.3 | 0 | 0 | 0 | 0 | 110.6 | I156 I157 S162 I163 S164 | I156-V160 WeakPolarHBondContact O-CG2 3.4Å; I156-V160 PolarHBondContact O-N 3.5Å; I157-V160 PolarHBondContact O-N 3.41Å; V160-S162 PolarHBondContact O-N 3.44Å; V160-I163 PolarHBondContact O-N 3.18Å; V160-S164 WeakPolarHBondContact O-CB 3.36Å; V160-S164 PolarHBondContact O-N 2.94Å; V160-S164 PolarHBondContact O-OG 2.87Å; V160-S164 VanDerWaalsContact O-OG 3.08Å |
| 161 | Y | 96.4 | Very high | 93.7 | Very high | 29 Ų | 29 | 51.6 Ų | 51.6 | 11% | 0.114 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -56.7 | -49.1 | 177.1 | 176.2 | -89 | 0 | 0 | 0 | 112 | Q121 F125 I157 G159 S164 Q165 F194 | Q121-Y161 HydrophobicContact CG-CE1 4.06Å; F125-Y161 AromaticContact CD1-CD1 3.88Å; F125-Y161 HydrophobicContact CD1-CD1 3.88Å; F125-Y161 AromaticContact CD1-CG 3.96Å; F125-Y161 HydrophobicContact CD1-CG 3.96Å; F125-Y161 HydrophobicContact CE1-CD1 4.09Å; F125-Y161 HydrophobicContact CE1-CD2 4.17Å; F125-Y161 AromaticContact CE1-CG 3.67Å; F125-Y161 HydrophobicContact CE1-CG 3.67Å; F125-Y161 HydrophobicContact CE2-CD2 4.43Å; F125-Y161 HydrophobicContact CG-CD1 4.11Å; F125-Y161 HydrophobicContact CG-CE1 4.44Å; F125-Y161 HydrophobicContact CG-CG 4.48Å; F125-Y161 HydrophobicContact CZ-CD2 4Å; F125-Y161 AromaticContact CZ-CG 3.98Å; F125-Y161 HydrophobicContact CZ-CG 3.98Å; I157-Y161 WeakPolarHBondContact O-CB 3.36Å; I157-Y161 PolarHBondContact O-N 3.01Å; G159-Y161 PolarHBondContact O-N 2.89Å; Y161-S164 PolarHBondContact O-N 3.38Å; Y161-Q165 WeakPolarHBondContact O-CB 3.34Å; Y161-Q165 PolarHBondContact O-N 3.29Å; Y161-Q165 PolarHBondContact OH-OE1 3.48Å; Y161-F194 HydrophobicContact CD2-CE1 4.45Å; Y161-F194 AromaticContact CD2-CZ 3.93Å; Y161-F194 HydrophobicContact CD2-CZ 3.93Å; Y161-F194 AromaticContact CE2-CE1 3.74Å; Y161-F194 HydrophobicContact CE2-CE1 3.74Å; Y161-F194 AromaticContact CE2-CZ 3.67Å; Y161-F194 HydrophobicContact CE2-CZ 3.67Å; Y161-F194 AromaticContact CZ-CE1 3.83Å |
| 162 | S | 95.8 | Very high | 92.9 | Very high | 16 Ų | 16 | 52.8 Ų | 52.8 | 11% | 0.112 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -65.4 | -41.5 | -178.8 | -174.7 | 0 | 0 | 0 | 0 | 112 | S158 G159 V160 Q165 A166 | S158-S162 WeakPolarHBondContact O-CB 3.46Å; S158-S162 PolarHBondContact O-N 2.85Å; G159-S162 PolarHBondContact O-N 3.43Å; V160-S162 PolarHBondContact O-N 3.44Å; S162-Q165 PolarHBondContact O-N 3.15Å; S162-A166 VanDerWaalsContact O-CB 3.3Å; S162-A166 WeakPolarHBondContact O-CB 2.92Å; S162-A166 PolarHBondContact O-N 3.49Å |
| 163 | I | 95.7 | Very high | 91.8 | Very high | 111 Ų | 111 | 52.9 Ų | 52.9 | 57% | 0.569 | 32% | 0.32 | S | S | * | . | H | α-helix | trans | -63.6 | -46.6 | 176.2 | -68.8 | 164.4 | 0 | 0 | 0 | 110.4 | G159 V160 Q165 A166 C167 | G159-I163 WeakPolarHBondContact O-CB 3.22Å; G159-I163 WeakPolarHBondContact O-CD1 3.45Å; G159-I163 WeakPolarHBondContact O-CG1 3.35Å; G159-I163 PolarHBondContact O-N 3.22Å; V160-I163 PolarHBondContact O-N 3.18Å; I163-Q165 VanDerWaalsContact C-N 3.31Å; I163-Q165 PolarHBondContact O-N 3.07Å; I163-A166 WeakPolarHBondContact O-CB 3.4Å; I163-A166 PolarHBondContact O-N 2.82Å; I163-C167 PolarHBondContact O-N 3.48Å; I163-C167 PolarHBondContact O-SG 3.23Å; I163-C167 VanDerWaalsContact O-SG 3.32Å |
| 164 | S | 95.3 | Very high | 90.9 | Very high | 49 Ų | 49 | 50.9 Ų | 50.9 | 34% | 0.343 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -58.4 | -44.8 | 175.8 | -62.9 | 0 | 0 | 0 | 0 | 111.7 | V160 Y161 A166 C167 L168 | V160-S164 WeakPolarHBondContact O-CB 3.36Å; V160-S164 PolarHBondContact O-N 2.94Å; V160-S164 PolarHBondContact O-OG 2.87Å; V160-S164 VanDerWaalsContact O-OG 3.08Å; Y161-S164 PolarHBondContact O-N 3.38Å; S164-A166 PolarHBondContact O-N 3.02Å; S164-C167 PolarHBondContact O-N 2.78Å; S164-L168 WeakPolarHBondContact O-CG 3.37Å; S164-L168 PolarHBondContact O-N 3Å |
| 165 | Q | 94.4 | Very high | 89.9 | Confident | 0 Ų | 0 | 56 Ų | 56 | 0% | 0 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -63 | -42 | 176.7 | -166.6 | 174.7 | -74.8 | 0 | 0 | 111.6 | L118 Y161 S162 I163 L168 E169 Y187 F194 | L118-Q165 HydrophobicContact CD1-CB 4.23Å; L118-Q165 HydrophobicContact CD1-CG 4.36Å; Y161-Q165 WeakPolarHBondContact O-CB 3.34Å; Y161-Q165 PolarHBondContact O-N 3.29Å; Y161-Q165 PolarHBondContact OH-OE1 3.48Å; S162-Q165 PolarHBondContact O-N 3.15Å; I163-Q165 VanDerWaalsContact C-N 3.31Å; I163-Q165 PolarHBondContact O-N 3.07Å; Q165-L168 PolarHBondContact O-N 2.75Å; Q165-E169 VanDerWaalsContact O-CB 3.24Å; Q165-E169 WeakPolarHBondContact O-CB 3.35Å; Q165-E169 PolarHBondContact O-N 2.87Å; Q165-Y187 PolarHBondContact NE2-OH 3.46Å; Q165-F194 HydrophobicContact CB-CE1 3.86Å; Q165-F194 HydrophobicContact CB-CZ 4.1Å; Q165-F194 HydrophobicContact CG-CD1 4.49Å; Q165-F194 HydrophobicContact CG-CE1 3.99Å |
| 166 | A | 93.3 | Very high | 88.9 | Confident | 20 Ų | 20 | 56.3 Ų | 56.3 | 17% | 0.165 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -62.5 | -46.9 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | L118 S162 I163 S164 L168 E169 F170 | L118-A166 HydrophobicContact CD1-CB 4.11Å; L118-A166 HydrophobicContact CD2-CB 3.51Å; L118-A166 HydrophobicContact CG-CB 4.47Å; S162-A166 VanDerWaalsContact O-CB 3.3Å; S162-A166 WeakPolarHBondContact O-CB 2.92Å; S162-A166 PolarHBondContact O-N 3.49Å; I163-A166 WeakPolarHBondContact O-CB 3.4Å; I163-A166 PolarHBondContact O-N 2.82Å; S164-A166 PolarHBondContact O-N 3.02Å; A166-L168 PolarHBondContact O-N 3.3Å; A166-E169 PolarHBondContact O-N 3.3Å; A166-F170 VanDerWaalsContact O-CD2 3.28Å; A166-F170 WeakPolarHBondContact O-CD2 3.13Å; A166-F170 PolarHBondContact O-N 3.47Å |
| 167 | C | 93.7 | Very high | 87.9 | Confident | 85 Ų | 85 | 51.9 Ų | 51.9 | 57% | 0.574 | 31% | 0.306 | S | S | * | . | H | α-helix | trans | -56.8 | -41 | 178.6 | -72.1 | 0 | 0 | 0 | 0 | 111.8 | I163 S164 G171 | I163-C167 PolarHBondContact O-N 3.48Å; I163-C167 PolarHBondContact O-SG 3.23Å; I163-C167 VanDerWaalsContact O-SG 3.32Å; S164-C167 PolarHBondContact O-N 2.78Å; C167-G171 WeakPolarHBondContact O-CA 3.35Å; C167-G171 PolarHBondContact O-N 3.41Å |
| 168 | L | 91.9 | Very high | 86.5 | Confident | 63 Ų | 63 | 55 Ų | 55 | 33% | 0.33 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -76.3 | -40 | 179.1 | -64 | 175.1 | 0 | 0 | 0 | 112.6 | S164 Q165 A166 F170 G171 T172 G190 F194 | S164-L168 WeakPolarHBondContact O-CG 3.37Å; S164-L168 PolarHBondContact O-N 3Å; Q165-L168 PolarHBondContact O-N 2.75Å; A166-L168 PolarHBondContact O-N 3.3Å; L168-F170 VanDerWaalsContact C-N 3.31Å; L168-F170 PolarHBondContact O-N 2.93Å; L168-G171 PolarHBondContact O-N 2.85Å; L168-T172 PolarHBondContact O-N 3.32Å; L168-T172 VanDerWaalsContact O-O 3.1Å; L168-T172 PolarHBondContact O-OG1 3.06Å; L168-G190 VanDerWaalsContact CB-O 3.29Å; L168-G190 WeakPolarHBondContact CB-O 3.43Å; L168-G190 WeakPolarHBondContact CD1-O 3.34Å; L168-F194 HydrophobicContact CD1-CB 3.55Å; L168-F194 HydrophobicContact CD1-CD2 3.61Å; L168-F194 HydrophobicContact CD1-CG 3.71Å |
| 169 | E | 88.6 | Confident | 84.8 | Confident | 3 Ų | 3 | 55.9 Ų | 55.9 | 1% | 0.014 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -66.2 | -31.3 | -178.8 | -171.6 | 66.6 | -147.6 | 0 | 0 | 113.3 | K114 Q165 A166 Y187 S188 H189 G190 | K114-E169 HydrophobicContact CD-CG 4.05Å; K114-E169 VanDerWaalsContact CE-OE1 3.25Å; K114-E169 WeakPolarHBondContact CE-OE1 3.32Å; K114-E169 HydrophobicContact CG-CG 4.39Å; K114-E169 PolarHBondContact NZ-O 2.79Å; K114-E169 IonicContact NZ-OE1 3.59Å; Q165-E169 VanDerWaalsContact O-CB 3.24Å; Q165-E169 WeakPolarHBondContact O-CB 3.35Å; Q165-E169 PolarHBondContact O-N 2.87Å; A166-E169 PolarHBondContact O-N 3.3Å; E169-Y187 HydrophobicContact CG-CD2 4.28Å; E169-Y187 HydrophobicContact CG-CE2 3.75Å; E169-S188 PolarHBondContact OE1-N 3.43Å; E169-S188 VanDerWaalsContact OE1-N 3.13Å; E169-S188 WeakPolarHBondContact OE2-CA 3.48Å; E169-S188 VanDerWaalsContact OE2-CB 3.27Å; E169-S188 WeakPolarHBondContact OE2-CB 3.47Å; E169-S188 PolarHBondContact OE2-N 3.09Å; E169-H189 PolarHBondContact OE2-N 3Å; E169-G190 PolarHBondContact OE2-N 3Å |
| 170 | F | 89.1 | Confident | 83 | Confident | 106 Ų | 106 | 64.4 Ų | 64.4 | 47% | 0.465 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -97.5 | -24.3 | 176.9 | -70.3 | -73.4 | 0 | 0 | 0 | 113.5 | K114 A166 L168 | K114-F170 HydrophobicContact CB-CE1 4.16Å; K114-F170 HydrophobicContact CB-CZ 3.93Å; K114-F170 HydrophobicContact CD-CE1 4.14Å; A166-F170 VanDerWaalsContact O-CD2 3.28Å; A166-F170 WeakPolarHBondContact O-CD2 3.13Å; A166-F170 PolarHBondContact O-N 3.47Å; L168-F170 VanDerWaalsContact C-N 3.31Å; L168-F170 PolarHBondContact O-N 2.93Å |
| 171 | G | 84.3 | Confident | 81.1 | Confident | 62 Ų | 62 | 62.3 Ų | 62.3 | 64% | 0.639 | 34% | 0.343 | S | S | * | . | H | α-helix | trans | -88.9 | -32.9 | -177.2 | 0 | 0 | 0 | 0 | 0 | 114.6 | C167 L168 | C167-G171 WeakPolarHBondContact O-CA 3.35Å; C167-G171 PolarHBondContact O-N 3.41Å; L168-G171 PolarHBondContact O-N 2.85Å |
| 172 | T | 75.9 | Confident | 79.3 | Confident | 83 Ų | 83 | 66.9 Ų | 66.9 | 51% | 0.509 | 37% | 0.365 | S | S | . | . | trans | -135.1 | 112.4 | -174.9 | 51.8 | 0 | 0 | 0 | 0 | 111.1 | L168 D174 | L168-T172 PolarHBondContact O-N 3.32Å; L168-T172 VanDerWaalsContact O-O 3.1Å; L168-T172 PolarHBondContact O-OG1 3.06Å; T172-D174 PolarHBondContact O-N 3.42Å | ||
| 173 | D | 70.4 | Confident | 77.4 | Confident | 76 Ų | 76 | 71.6 Ų | 71.6 | 41% | 0.406 | 38% | 0.381 | S | S | . | . | trans | -79.8 | 110.4 | 170.5 | -77.1 | -26.7 | 0 | 0 | 0 | 109.8 | K114 | K114-D173 IonicContact NZ-OD1 3.5Š| ||
| 174 | D | 73.7 | Confident | 75.9 | Confident | 29 Ų | 29 | 67.4 Ų | 67.4 | 16% | 0.155 | 36% | 0.359 | C | S | . | . | trans | -68.8 | 135.8 | 171.6 | -169.9 | -28.8 | 0 | 0 | 0 | 110 | T172 Y176 F177 R178 S192 | T172-D174 PolarHBondContact O-N 3.42Å; D174-Y176 VanDerWaalsContact C-N 3.27Å; D174-Y176 PolarHBondContact O-N 3.41Å; D174-Y176 WeakPolarHBondContact OD1-CD2 3.41Å; D174-Y176 PolarHBondContact OD1-N 3.4Å; D174-F177 HydrophobicContact CB-CD2 3.88Å; D174-F177 PolarHBondContact O-N 3.15Å; D174-R178 PolarHBondContact O-N 2.89Å; D174-R178 VanDerWaalsContact O-N 3.11Å; D174-S192 WeakPolarHBondContact OD2-CB 3.26Å; D174-S192 PolarHBondContact OD2-N 2.84Å; D174-S192 PolarHBondContact OD2-OG 3.33Å | ||
| 175 | V | 71.9 | Confident | 74.8 | Confident | 109 Ų | 109 | 65.5 Ų | 65.5 | 66% | 0.661 | 35% | 0.345 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -61 | -35.9 | -171.2 | -178.2 | 0 | 0 | 0 | 0 | 111.7 | F177 | V175-F177 VanDerWaalsContact C-N 3.33Å; V175-F177 PolarHBondContact O-N 3.31Å |
| 176 | Y | 72.9 | Confident | 74.1 | Confident | 54 Ų | 54 | 66.1 Ų | 66.1 | 21% | 0.212 | 35% | 0.349 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -71.9 | -27.3 | -178.5 | -62 | -72.3 | 0 | 0 | 0 | 113.4 | D174 L250 A253 | D174-Y176 VanDerWaalsContact C-N 3.27Å; D174-Y176 PolarHBondContact O-N 3.41Å; D174-Y176 WeakPolarHBondContact OD1-CD2 3.41Å; D174-Y176 PolarHBondContact OD1-N 3.4Å; Y176-L250 HydrophobicContact CD1-CD2 4.44Å; Y176-L250 HydrophobicContact CD2-CD2 4.45Å; Y176-L250 WeakPolarHBondContact CE2-O 3.35Å; Y176-L250 HydrophobicContact CG-CD2 4.16Å; Y176-A253 WeakPolarHBondContact OH-CA 3.47Å; Y176-A253 WeakPolarHBondContact OH-CB 3.39Å |
| 177 | F | 75.4 | Confident | 73.5 | Confident | 12 Ų | 12 | 65.7 Ų | 65.7 | 5% | 0.053 | 34% | 0.343 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -98.8 | -7 | -177.7 | -60 | -87.2 | 0 | 0 | 0 | 112.5 | D174 V175 T179 I186 S188 L250 L258 L261 | D174-F177 HydrophobicContact CB-CD2 3.88Å; D174-F177 PolarHBondContact O-N 3.15Å; V175-F177 VanDerWaalsContact C-N 3.33Å; V175-F177 PolarHBondContact O-N 3.31Å; F177-T179 PolarHBondContact O-N 2.7Å; F177-I186 HydrophobicContact CD1-CG2 3.83Å; F177-S188 WeakPolarHBondContact CD2-OG 3.22Å; F177-S188 WeakPolarHBondContact CG-OG 3.47Å; F177-L250 HydrophobicContact CE2-CD1 4.17Å; F177-L250 HydrophobicContact CZ-CD1 3.93Å; F177-L258 HydrophobicContact CD1-CD2 4.12Å; F177-L258 HydrophobicContact CE1-CD2 3.57Å; F177-L258 HydrophobicContact CZ-CD2 3.83Å; F177-L261 HydrophobicContact CE1-CD2 4.22Å; F177-L261 HydrophobicContact CZ-CD2 4.09Å |
| 178 | R | 67.2 | Low | 73 | Confident | 139 Ų | 139 | 61.9 Ų | 61.9 | 53% | 0.525 | 32% | 0.317 | S | S | . | . | trans | -69.5 | 116.8 | 177.5 | -178.3 | 177.2 | -79.5 | 171.1 | -3.3 | 110.6 | K29 D174 | K29-R178 PolarHBondContact NZ-O 3.23Å; D174-R178 PolarHBondContact O-N 2.89Å; D174-R178 VanDerWaalsContact O-N 3.11Å | ||
| 179 | T | 61.7 | Low | 72.8 | Confident | 19 Ų | 19 | 59.4 Ų | 59.4 | 12% | 0.117 | 30% | 0.304 | C | S | . | . | trans | -100.1 | 137.2 | 167.9 | -58.5 | 0 | 0 | 0 | 0 | 110.4 | F177 S181 I184 I186 | F177-T179 PolarHBondContact O-N 2.7Å; T179-S181 VanDerWaalsContact C-N 3.3Å; T179-S181 WeakPolarHBondContact CG2-OG 3.32Å; T179-I184 WeakPolarHBondContact CB-O 3.34Å; T179-I184 HydrophobicContact CG2-CB 4.26Å; T179-I184 VanDerWaalsContact CG2-O 3.31Å; T179-I184 WeakPolarHBondContact CG2-O 3.33Å; T179-I186 WeakPolarHBondContact OG1-CD1 3.17Å | ||
| 180 | E | 57.6 | Low | 72.7 | Confident | 198 Ų | 198 | 59.5 Ų | 59.5 | 93% | 0.925 | 31% | 0.306 | S | S | * | . | S | Bend | trans | -70.3 | -27.6 | -179.8 | -167.3 | 154.1 | -158.7 | 0 | 0 | 112.2 | ||
| 181 | S | 58.2 | Low | 72.7 | Confident | 45 Ų | 45 | 54.8 Ų | 54.8 | 32% | 0.315 | 29% | 0.287 | S | S | . | . | S | Bend | trans | -77.1 | 134.6 | 172.7 | 73.9 | 0 | 0 | 0 | 0 | 111.9 | R110 T179 R183 I184 | R110-S181 PolarHBondContact NH2-O 3.41Å; T179-S181 VanDerWaalsContact C-N 3.3Å; T179-S181 WeakPolarHBondContact CG2-OG 3.32Å; S181-R183 PolarHBondContact O-N 3.32Å; S181-I184 WeakPolarHBondContact OG-CB 3.5Å; S181-I184 PolarHBondContact OG-N 2.69Å |
| 182 | Q | 59 | Low | 73 | Confident | 125 Ų | 125 | 52.3 Ų | 52.3 | 58% | 0.584 | 26% | 0.26 | S | S | * | . | S | Bend | trans | -69.1 | -17 | 169.2 | -67.7 | -135 | -27.8 | 0 | 0 | 112.8 | ||
| 183 | R | 55.8 | Low | 73.8 | Confident | 116 Ų | 116 | 53.7 Ų | 53.7 | 44% | 0.438 | 26% | 0.264 | S | S | . | . | S | Bend | trans | -80.2 | -40.8 | -176.4 | -166.6 | -172.8 | -65.2 | -163.7 | -2 | 113.3 | S40 N106 S181 | S40-R183 PolarHBondContact OG-NH1 2.85Å; N106-R183 VanDerWaalsContact OD1-CZ 3.31Å; N106-R183 PolarHBondContact OD1-NH1 3.12Å; S181-R183 PolarHBondContact O-N 3.32Å |
| 184 | I | 63.9 | Low | 74.9 | Confident | 23 Ų | 23 | 51.9 Ų | 51.9 | 12% | 0.118 | 25% | 0.252 | C | S | . | . | trans | -108 | 110.4 | -173.7 | -53.3 | 173.4 | 0 | 0 | 0 | 109.1 | T33 E35 T179 S181 | T33-I184 HydrophobicContact CG2-CG2 3.76Å; E35-I184 HydrophobicContact CG-CD1 4.18Å; E35-I184 WeakPolarHBondContact OE1-CD1 3.3Å; E35-I184 WeakPolarHBondContact OE1-CG1 3.4Å; T179-I184 WeakPolarHBondContact CB-O 3.34Å; T179-I184 HydrophobicContact CG2-CB 4.26Å; T179-I184 VanDerWaalsContact CG2-O 3.31Å; T179-I184 WeakPolarHBondContact CG2-O 3.33Å; S181-I184 WeakPolarHBondContact OG-CB 3.5Å; S181-I184 PolarHBondContact OG-N 2.69Å | ||
| 185 | V | 72.1 | Confident | 75.9 | Confident | 8 Ų | 8 | 50.7 Ų | 50.7 | 5% | 0.048 | 25% | 0.246 | C | C | . | . | trans | -108.8 | 123.2 | -179.6 | -174.9 | 0 | 0 | 0 | 0 | 110 | R42 R110 K114 | R42-V185 PolarHBondContact NH1-O 2.92Å; R110-V185 HydrophobicContact CB-CG2 3.66Å; R110-V185 HydrophobicContact CG-CG1 4.31Å; R110-V185 HydrophobicContact CG-CG2 3.74Å; K114-V185 HydrophobicContact CD-CG1 4.31Å; K114-V185 HydrophobicContact CG-CG1 3.89Å | ||
| 186 | I | 80.6 | Confident | 77 | Confident | 13 Ų | 13 | 47.3 Ų | 47.3 | 7% | 0.067 | 22% | 0.224 | C | C | . | . | trans | -91 | 126.9 | 172.1 | -52 | 173.8 | 0 | 0 | 0 | 106.7 | K29 F32 T33 F177 T179 S188 | K29-I186 HydrophobicContact CD-CD1 4.16Å; K29-I186 HydrophobicContact CG-CD1 3.52Å; F32-I186 HydrophobicContact CB-CD1 4.36Å; F32-I186 HydrophobicContact CB-CG1 4.26Å; F32-I186 HydrophobicContact CB-CG2 4.17Å; F32-I186 HydrophobicContact CG-CG2 4.3Å; T33-I186 HydrophobicContact CG2-CD1 3.57Å; T33-I186 HydrophobicContact CG2-CG1 3.79Å; F177-I186 HydrophobicContact CD1-CG2 3.83Å; T179-I186 WeakPolarHBondContact OG1-CD1 3.17Å; I186-S188 PolarHBondContact O-N 2.9Å | ||
| 187 | Y | 80.6 | Confident | 78.2 | Confident | 11 Ų | 11 | 48.4 Ų | 48.4 | 4% | 0.043 | 24% | 0.236 | C | C | . | . | trans | -73.5 | 123.8 | 176.2 | -166.5 | -110.8 | 0 | 0 | 0 | 109.8 | W117 L118 Q165 E169 H189 | W117-Y187 HydrophobicContact CB-CD1 4.04Å; W117-Y187 HydrophobicContact CB-CD2 3.41Å; W117-Y187 VanDerWaalsContact CB-CD2 3.41Å; W117-Y187 HydrophobicContact CB-CE1 4.19Å; W117-Y187 HydrophobicContact CB-CE2 3.58Å; W117-Y187 HydrophobicContact CB-CG 3.65Å; W117-Y187 HydrophobicContact CD2-CG 4.36Å; W117-Y187 HydrophobicContact CG-CD1 4.38Å; W117-Y187 AromaticContact CG-CD2 3.94Å; W117-Y187 HydrophobicContact CG-CD2 3.94Å; W117-Y187 AromaticContact CG-CG 3.83Å; W117-Y187 HydrophobicContact CG-CG 3.83Å; L118-Y187 WeakPolarHBondContact CD1-OH 3.06Å; Q165-Y187 PolarHBondContact NE2-OH 3.46Å; E169-Y187 HydrophobicContact CG-CD2 4.28Å; E169-Y187 HydrophobicContact CG-CE2 3.75Å; Y187-H189 VanDerWaalsContact C-N 3.33Å; Y187-H189 HydrophobicContact CD1-CB 4.38Å; Y187-H189 AromaticContact CD1-CD2 3.86Å; Y187-H189 AromaticContact CD1-CE1 3.83Å; Y187-H189 AromaticContact CD1-CG 3.74Å; Y187-H189 AromaticContact CD1-ND1 3.73Å; Y187-H189 AromaticContact CD1-NE2 3.91Å; Y187-H189 HydrophobicContact CE1-CB 4.33Å; Y187-H189 AromaticContact CE1-ND1 3.87Å; Y187-H189 PolarHBondContact O-CD2 3.21Å | ||
| 188 | S | 82.4 | Confident | 79.2 | Confident | 6 Ų | 6 | 48.5 Ų | 48.5 | 4% | 0.042 | 24% | 0.238 | C | C | . | . | trans | -86.1 | -5.6 | -174.9 | -168.5 | 0 | 0 | 0 | 0 | 113.1 | E169 F177 I186 G190 G191 | E169-S188 PolarHBondContact OE1-N 3.43Å; E169-S188 VanDerWaalsContact OE1-N 3.13Å; E169-S188 WeakPolarHBondContact OE2-CA 3.48Å; E169-S188 VanDerWaalsContact OE2-CB 3.27Å; E169-S188 WeakPolarHBondContact OE2-CB 3.47Å; E169-S188 PolarHBondContact OE2-N 3.09Å; F177-S188 WeakPolarHBondContact CD2-OG 3.22Å; F177-S188 WeakPolarHBondContact CG-OG 3.47Å; I186-S188 PolarHBondContact O-N 2.9Å; S188-G190 PolarHBondContact O-N 3.05Å; S188-G191 PolarHBondContact O-N 3.31Å; S188-G191 WeakPolarHBondContact OG-CA 3.45Å; S188-G191 PolarHBondContact OG-N 2.82Å | ||
| 189 | H | 87.8 | Confident | 80.6 | Confident | 10 Ų | 10 | 41.9 Ų | 41.9 | 5% | 0.046 | 21% | 0.213 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 54.1 | 33.3 | -172.9 | -58.6 | -96.4 | 0 | 0 | 0 | 112.8 | E169 Y187 G191 F194 L195 L265 Y269 | E169-H189 PolarHBondContact OE2-N 3Å; Y187-H189 VanDerWaalsContact C-N 3.33Å; Y187-H189 HydrophobicContact CD1-CB 4.38Å; Y187-H189 AromaticContact CD1-CD2 3.86Å; Y187-H189 AromaticContact CD1-CE1 3.83Å; Y187-H189 AromaticContact CD1-CG 3.74Å; Y187-H189 AromaticContact CD1-ND1 3.73Å; Y187-H189 AromaticContact CD1-NE2 3.91Å; Y187-H189 HydrophobicContact CE1-CB 4.33Å; Y187-H189 AromaticContact CE1-ND1 3.87Å; Y187-H189 PolarHBondContact O-CD2 3.21Å; H189-G191 VanDerWaalsContact C-N 3.34Å; H189-F194 WeakPolarHBondContact O-CD1 3.29Å; H189-L195 HydrophobicContact CB-CD1 4.15Å; H189-L265 VanDerWaalsContact CE1-CD2 3.47Å; H189-L265 WeakPolarHBondContact CE1-CD2 3.49Å; H189-L265 VanDerWaalsContact NE2-CD1 3.33Å; H189-L265 WeakPolarHBondContact NE2-CD1 3.44Å; H189-Y269 PolarHBondContact CE1-OH 3.01Å |
| 190 | G | 86.4 | Confident | 82.4 | Confident | 5 Ų | 5 | 43 Ų | 43 | 5% | 0.052 | 22% | 0.224 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 79.4 | 11 | -175.3 | 0 | 0 | 0 | 0 | 0 | 114.8 | L168 E169 S188 F194 | L168-G190 VanDerWaalsContact CB-O 3.29Å; L168-G190 WeakPolarHBondContact CB-O 3.43Å; L168-G190 WeakPolarHBondContact CD1-O 3.34Å; E169-G190 PolarHBondContact OE2-N 3Å; S188-G190 PolarHBondContact O-N 3.05Å; G190-F194 WeakPolarHBondContact O-CB 3.45Å |
| 191 | G | 89 | Confident | 84.3 | Confident | 7 Ų | 7 | 39 Ų | 39 | 7% | 0.072 | 21% | 0.208 | C | C | . | . | trans | 94.7 | 160.1 | 177.3 | 0 | 0 | 0 | 0 | 0 | 114 | S188 H189 L193 F194 L195 | S188-G191 PolarHBondContact O-N 3.31Å; S188-G191 WeakPolarHBondContact OG-CA 3.45Å; S188-G191 PolarHBondContact OG-N 2.82Å; H189-G191 VanDerWaalsContact C-N 3.34Å; G191-L193 VanDerWaalsContact C-N 3.33Å; G191-L193 PolarHBondContact O-N 3.45Å; G191-F194 PolarHBondContact O-N 3.4Å; G191-L195 WeakPolarHBondContact O-CB 3.45Å; G191-L195 PolarHBondContact O-N 3.22Å | ||
| 192 | S | 90.6 | Very high | 86.1 | Confident | 11 Ų | 11 | 37.7 Ų | 37.7 | 8% | 0.077 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -55.8 | -41.4 | -175.7 | 48.8 | 0 | 0 | 0 | 0 | 113.9 | D174 L196 | D174-S192 WeakPolarHBondContact OD2-CB 3.26Å; D174-S192 PolarHBondContact OD2-N 2.84Å; D174-S192 PolarHBondContact OD2-OG 3.33Å; S192-L196 WeakPolarHBondContact O-CB 3.19Å; S192-L196 PolarHBondContact O-N 2.98Å |
| 193 | L | 91.9 | Very high | 88 | Confident | 111 Ų | 111 | 32.1 Ų | 32.1 | 58% | 0.581 | 17% | 0.173 | S | C | * | . | H | α-helix | trans | -68.9 | -46.2 | 179.7 | -176.2 | 65.7 | 0 | 0 | 0 | 112.8 | G191 L195 L196 V197 L251 | G191-L193 VanDerWaalsContact C-N 3.33Å; G191-L193 PolarHBondContact O-N 3.45Å; L193-L195 VanDerWaalsContact C-N 3.31Å; L193-L195 PolarHBondContact O-N 2.61Å; L193-L196 WeakPolarHBondContact O-CB 3.45Å; L193-L196 PolarHBondContact O-N 3.28Å; L193-V197 WeakPolarHBondContact O-CG2 3.42Å; L193-V197 PolarHBondContact O-N 3.32Å; L193-L251 HydrophobicContact CB-CD2 4.33Å; L193-L251 HydrophobicContact CD1-CD1 4.25Å |
| 194 | F | 94.4 | Very high | 89.9 | Confident | 39 Ų | 39 | 31.2 Ų | 31.2 | 17% | 0.171 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -63.9 | -42.5 | 177.9 | 178.6 | -95.1 | 0 | 0 | 0 | 110.8 | Y161 Q165 L168 H189 G190 G191 L196 V197 S198 | Y161-F194 HydrophobicContact CD2-CE1 4.45Å; Y161-F194 AromaticContact CD2-CZ 3.93Å; Y161-F194 HydrophobicContact CD2-CZ 3.93Å; Y161-F194 AromaticContact CE2-CE1 3.74Å; Y161-F194 HydrophobicContact CE2-CE1 3.74Å; Y161-F194 AromaticContact CE2-CZ 3.67Å; Y161-F194 HydrophobicContact CE2-CZ 3.67Å; Y161-F194 AromaticContact CZ-CE1 3.83Å; Q165-F194 HydrophobicContact CB-CE1 3.86Å; Q165-F194 HydrophobicContact CB-CZ 4.1Å; Q165-F194 HydrophobicContact CG-CD1 4.49Å; Q165-F194 HydrophobicContact CG-CE1 3.99Å; L168-F194 HydrophobicContact CD1-CB 3.55Å; L168-F194 HydrophobicContact CD1-CD2 3.61Å; L168-F194 HydrophobicContact CD1-CG 3.71Å; H189-F194 WeakPolarHBondContact O-CD1 3.29Å; G190-F194 WeakPolarHBondContact O-CB 3.45Å; G191-F194 PolarHBondContact O-N 3.4Å; F194-L196 VanDerWaalsContact C-N 3.33Å; F194-L196 PolarHBondContact O-N 3.46Å; F194-V197 PolarHBondContact O-N 3.46Å; F194-S198 WeakPolarHBondContact O-CB 3.37Å; F194-S198 PolarHBondContact O-N 3.35Å; F194-S198 PolarHBondContact O-OG 3.15Å |
| 195 | L | 93.6 | Very high | 91.4 | Very high | 4 Ų | 4 | 32 Ų | 32 | 2% | 0.021 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -60 | -42 | 174.8 | -175.7 | 61.7 | 0 | 0 | 0 | 111.4 | H189 G191 L193 S198 S199 S247 L261 | H189-L195 HydrophobicContact CB-CD1 4.15Å; G191-L195 WeakPolarHBondContact O-CB 3.45Å; G191-L195 PolarHBondContact O-N 3.22Å; L193-L195 VanDerWaalsContact C-N 3.31Å; L193-L195 PolarHBondContact O-N 2.61Å; L195-S198 PolarHBondContact O-OG 3.26Å; L195-S199 WeakPolarHBondContact O-CB 3.34Å; L195-S199 PolarHBondContact O-N 2.96Å; L195-S199 PolarHBondContact O-OG 3.15Å; L195-S247 VanDerWaalsContact CD2-OG 3.28Å; L195-S247 WeakPolarHBondContact CD2-OG 3.24Å; L195-S247 VanDerWaalsContact CG-OG 3.24Å; L195-S247 WeakPolarHBondContact CG-OG 3.28Å; L195-L261 HydrophobicContact CD2-CD1 3.8Å; L195-L261 HydrophobicContact CD2-CD2 3.77Å; L195-L261 HydrophobicContact CD2-CG 4.46Å |
| 196 | L | 96.4 | Very high | 92.5 | Very high | 37 Ų | 37 | 31.7 Ų | 31.7 | 19% | 0.194 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -60.1 | -53.8 | 175.2 | 177.2 | 63.9 | 0 | 0 | 0 | 111.7 | S192 L193 F194 S199 A200 V244 T248 L251 | S192-L196 WeakPolarHBondContact O-CB 3.19Å; S192-L196 PolarHBondContact O-N 2.98Å; L193-L196 WeakPolarHBondContact O-CB 3.45Å; L193-L196 PolarHBondContact O-N 3.28Å; F194-L196 VanDerWaalsContact C-N 3.33Å; F194-L196 PolarHBondContact O-N 3.46Å; L196-S199 PolarHBondContact O-OG 2.88Å; L196-S199 VanDerWaalsContact O-OG 3.09Å; L196-A200 WeakPolarHBondContact O-CB 3.38Å; L196-A200 PolarHBondContact O-N 3.29Å; L196-V244 HydrophobicContact CD1-CB 4.35Å; L196-V244 HydrophobicContact CD1-CG1 3.85Å; L196-T248 WeakPolarHBondContact CD1-OG1 3.34Å; L196-L251 HydrophobicContact CB-CD1 4.25Å; L196-L251 HydrophobicContact CD2-CD1 3.49Å; L196-L251 VanDerWaalsContact CD2-CD1 3.49Å; L196-L251 HydrophobicContact CG-CD1 4.46Å |
| 197 | V | 97.3 | Very high | 93.2 | Very high | 78 Ų | 78 | 34.4 Ų | 34.4 | 47% | 0.473 | 20% | 0.198 | S | C | . | . | H | α-helix | trans | -64.1 | -47.1 | -174.7 | 174.6 | 0 | 0 | 0 | 0 | 110.8 | L193 F194 A200 L201 | L193-V197 WeakPolarHBondContact O-CG2 3.42Å; L193-V197 PolarHBondContact O-N 3.32Å; F194-V197 PolarHBondContact O-N 3.46Å; V197-A200 PolarHBondContact O-N 3.03Å; V197-L201 HydrophobicContact CG1-CD1 4.21Å; V197-L201 VanDerWaalsContact O-CG 3.32Å; V197-L201 WeakPolarHBondContact O-CG 3.3Å; V197-L201 PolarHBondContact O-N 2.97Å |
| 198 | S | 96.4 | Very high | 93.8 | Very high | 13 Ų | 13 | 37.2 Ų | 37.2 | 9% | 0.091 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -65.3 | -45.7 | 179.5 | 56.1 | 0 | 0 | 0 | 0 | 112.5 | F194 L195 A200 L201 L202 | F194-S198 WeakPolarHBondContact O-CB 3.37Å; F194-S198 PolarHBondContact O-N 3.35Å; F194-S198 PolarHBondContact O-OG 3.15Å; L195-S198 PolarHBondContact O-OG 3.26Å; S198-A200 VanDerWaalsContact C-N 3.33Å; S198-A200 PolarHBondContact O-N 3.05Å; S198-L201 PolarHBondContact O-N 3.1Å; S198-L202 WeakPolarHBondContact O-CG 3.34Å; S198-L202 PolarHBondContact O-N 3.25Å |
| 199 | S | 97.5 | Very high | 94.1 | Very high | 0 Ų | 0 | 37.2 Ų | 37.2 | 0% | 0 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -64.5 | -36.6 | 176.9 | 61.7 | 0 | 0 | 0 | 0 | 112.2 | L195 L196 L202 A203 V244 | L195-S199 WeakPolarHBondContact O-CB 3.34Å; L195-S199 PolarHBondContact O-N 2.96Å; L195-S199 PolarHBondContact O-OG 3.15Å; L196-S199 PolarHBondContact O-OG 2.88Å; L196-S199 VanDerWaalsContact O-OG 3.09Å; S199-L202 PolarHBondContact O-N 2.9Å; S199-A203 WeakPolarHBondContact O-CB 3.37Å; S199-A203 PolarHBondContact O-N 2.89Å; S199-V244 WeakPolarHBondContact OG-CG2 3.38Å |
| 200 | A | 98 | Very high | 94.2 | Very high | 42 Ų | 42 | 38 Ų | 38 | 35% | 0.347 | 23% | 0.225 | S | C | . | . | H | α-helix | trans | -64.4 | -43.1 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | L196 V197 S198 A203 L204 V244 | L196-A200 WeakPolarHBondContact O-CB 3.38Å; L196-A200 PolarHBondContact O-N 3.29Å; V197-A200 PolarHBondContact O-N 3.03Å; S198-A200 VanDerWaalsContact C-N 3.33Å; S198-A200 PolarHBondContact O-N 3.05Å; A200-A203 PolarHBondContact O-N 3.46Å; A200-L204 WeakPolarHBondContact O-CB 3.21Å; A200-L204 PolarHBondContact O-N 2.92Å; A200-V244 HydrophobicContact CB-CG2 3.96Å |
| 201 | L | 97.5 | Very high | 94.4 | Very high | 114 Ų | 114 | 41.2 Ų | 41.2 | 60% | 0.597 | 24% | 0.24 | S | C | * | . | H | α-helix | trans | -63.5 | -44 | 176.4 | -71.3 | 173.2 | 0 | 0 | 0 | 111.9 | V197 S198 L204 A205 | V197-L201 HydrophobicContact CG1-CD1 4.21Å; V197-L201 VanDerWaalsContact O-CG 3.32Å; V197-L201 WeakPolarHBondContact O-CG 3.3Å; V197-L201 PolarHBondContact O-N 2.97Å; S198-L201 PolarHBondContact O-N 3.1Å; L201-L204 PolarHBondContact O-N 3.26Å; L201-A205 WeakPolarHBondContact O-CB 3.47Å; L201-A205 PolarHBondContact O-N 2.66Å |
| 202 | L | 97.1 | Very high | 94.1 | Very high | 18 Ų | 18 | 42.6 Ų | 42.6 | 9% | 0.094 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -68.4 | -43.7 | 177.4 | -68.5 | 167.4 | 0 | 0 | 0 | 111.6 | F125 S198 S199 L204 A205 Y206 Y240 | F125-L202 HydrophobicContact CE2-CD1 3.86Å; F125-L202 HydrophobicContact CE2-CD2 3.96Å; F125-L202 HydrophobicContact CE2-CG 4.49Å; S198-L202 WeakPolarHBondContact O-CG 3.34Å; S198-L202 PolarHBondContact O-N 3.25Å; S199-L202 PolarHBondContact O-N 2.9Å; L202-L204 VanDerWaalsContact C-N 3.3Å; L202-L204 PolarHBondContact O-N 2.03Å; L202-A205 WeakPolarHBondContact O-CB 3.32Å; L202-A205 PolarHBondContact O-N 3.02Å; L202-A205 VanDerWaalsContact O-N 3.15Å; L202-Y206 HydrophobicContact CB-CE2 4.48Å; L202-Y206 WeakPolarHBondContact O-CD2 3.17Å; L202-Y206 PolarHBondContact O-N 3.14Å; L202-Y240 HydrophobicContact CB-CD1 3.99Å; L202-Y240 HydrophobicContact CB-CD2 3.86Å; L202-Y240 HydrophobicContact CB-CE1 4.06Å; L202-Y240 HydrophobicContact CB-CE2 3.94Å; L202-Y240 HydrophobicContact CB-CG 3.91Å; L202-Y240 HydrophobicContact CD1-CD1 4.16Å; L202-Y240 HydrophobicContact CD1-CE1 3.49Å; L202-Y240 VanDerWaalsContact CD1-CE1 3.49Å; L202-Y240 HydrophobicContact CD1-CE2 4.25Å; L202-Y240 HydrophobicContact CG-CE1 4.42Å |
| 203 | A | 97.7 | Very high | 93.6 | Very high | 8 Ų | 8 | 44 Ų | 44 | 7% | 0.066 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -55.4 | -47 | 173.9 | 0 | 0 | 0 | 0 | 0 | 110.9 | S199 A200 A205 Y206 M207 F237 | S199-A203 WeakPolarHBondContact O-CB 3.37Å; S199-A203 PolarHBondContact O-N 2.89Å; A200-A203 PolarHBondContact O-N 3.46Å; A203-A205 PolarHBondContact O-N 3.45Å; A203-Y206 PolarHBondContact O-N 2.96Å; A203-M207 WeakPolarHBondContact O-CB 3.4Å; A203-M207 PolarHBondContact O-N 2.68Å; A203-F237 HydrophobicContact CB-CD2 4.19Å; A203-F237 HydrophobicContact CB-CE2 4.37Å; A203-F237 VanDerWaalsContact O-CD2 3.29Å; A203-F237 WeakPolarHBondContact O-CD2 3.49Å |
| 204 | L | 96.9 | Very high | 93.1 | Very high | 97 Ų | 97 | 45.4 Ų | 45.4 | 51% | 0.508 | 26% | 0.262 | S | S | . | . | H | α-helix | trans | -62.6 | -43.7 | 177.3 | -175 | 64.2 | 0 | 0 | 0 | 111.6 | A200 L201 L202 Y206 M207 C208 | A200-L204 WeakPolarHBondContact O-CB 3.21Å; A200-L204 PolarHBondContact O-N 2.92Å; L201-L204 PolarHBondContact O-N 3.26Å; L202-L204 VanDerWaalsContact C-N 3.3Å; L202-L204 PolarHBondContact O-N 2.03Å; L204-Y206 PolarHBondContact O-N 3.47Å; L204-M207 PolarHBondContact O-N 2.87Å; L204-C208 WeakPolarHBondContact O-CB 3.41Å; L204-C208 PolarHBondContact O-N 3.43Å; L204-C208 PolarHBondContact O-SG 3.44Å |
| 205 | A | 95 | Very high | 92.4 | Very high | 41 Ų | 41 | 47.5 Ų | 47.5 | 34% | 0.339 | 27% | 0.274 | S | S | . | . | H | α-helix | trans | -58.8 | -48.3 | 176.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | L201 L202 A203 C208 V209 | L201-A205 WeakPolarHBondContact O-CB 3.47Å; L201-A205 PolarHBondContact O-N 2.66Å; L202-A205 WeakPolarHBondContact O-CB 3.32Å; L202-A205 PolarHBondContact O-N 3.02Å; L202-A205 VanDerWaalsContact O-N 3.15Å; A203-A205 PolarHBondContact O-N 3.45Å; A205-C208 WeakPolarHBondContact O-CB 3.42Å; A205-C208 PolarHBondContact O-N 3.23Å; A205-V209 VanDerWaalsContact O-CG2 3.3Å; A205-V209 WeakPolarHBondContact O-CG2 3.13Å; A205-V209 PolarHBondContact O-N 2.92Å; A205-V209 VanDerWaalsContact O-N 3.08Å |
| 206 | Y | 95.8 | Very high | 91.2 | Very high | 0 Ų | 0 | 53 Ų | 53 | 0% | 0 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -70.6 | -33.2 | 178.3 | -74.9 | -67.9 | 0 | 0 | 0 | 113.7 | E128 L132 L202 A203 L204 V209 S210 C233 L236 Y240 | E128-Y206 WeakPolarHBondContact CG-OH 3.47Å; E128-Y206 WeakPolarHBondContact OE1-CE2 3.38Å; E128-Y206 VanDerWaalsContact OE1-CZ 3.31Å; E128-Y206 PolarHBondContact OE1-OH 3.17Å; L132-Y206 HydrophobicContact CD1-CE1 4.25Å; L132-Y206 HydrophobicContact CD1-CE2 4.32Å; L132-Y206 WeakPolarHBondContact CD1-OH 3.23Å; L132-Y206 HydrophobicContact CD2-CD1 3.97Å; L132-Y206 HydrophobicContact CD2-CE1 3.38Å; L132-Y206 HydrophobicContact CG-CE1 3.91Å; L202-Y206 HydrophobicContact CB-CE2 4.48Å; L202-Y206 WeakPolarHBondContact O-CD2 3.17Å; L202-Y206 PolarHBondContact O-N 3.14Å; A203-Y206 PolarHBondContact O-N 2.96Å; L204-Y206 PolarHBondContact O-N 3.47Å; Y206-V209 PolarHBondContact O-N 3.41Å; Y206-S210 VanDerWaalsContact O-CB 3.3Å; Y206-S210 WeakPolarHBondContact O-CB 3.42Å; Y206-S210 PolarHBondContact O-N 2.72Å; Y206-S210 PolarHBondContact O-OG 3.36Å; Y206-C233 HydrophobicContact CD1-CB 4Å; Y206-L236 HydrophobicContact CD1-CB 4.07Å; Y206-L236 HydrophobicContact CD1-CD1 4.3Å; Y206-L236 HydrophobicContact CD2-CB 4Å; Y206-L236 HydrophobicContact CE1-CB 4.11Å; Y206-L236 HydrophobicContact CE1-CD1 3.53Å; Y206-L236 HydrophobicContact CE1-CG 4.46Å; Y206-L236 HydrophobicContact CE2-CB 4.09Å; Y206-L236 HydrophobicContact CE2-CD1 4.05Å; Y206-L236 HydrophobicContact CG-CB 4.02Å; Y206-L236 WeakPolarHBondContact OH-CD1 3.2Å; Y206-Y240 AromaticContact CD2-CD2 3.81Å; Y206-Y240 HydrophobicContact CD2-CD2 3.81Å; Y206-Y240 AromaticContact CD2-CE2 3.99Å; Y206-Y240 HydrophobicContact CD2-CE2 3.99Å; Y206-Y240 AromaticContact CE2-CD2 3.95Å; Y206-Y240 HydrophobicContact CE2-CD2 3.95Å; Y206-Y240 AromaticContact CE2-CE2 3.62Å; Y206-Y240 HydrophobicContact CE2-CE2 3.62Å |
| 207 | M | 95.2 | Very high | 89.3 | Confident | 70 Ų | 70 | 57.6 Ų | 57.6 | 35% | 0.345 | 33% | 0.331 | S | S | . | . | H | α-helix | trans | -60 | -50.2 | 172.2 | -173.7 | -163.7 | -66.3 | 0 | 0 | 109.7 | A203 L204 V209 S210 I211 F237 | A203-M207 WeakPolarHBondContact O-CB 3.4Å; A203-M207 PolarHBondContact O-N 2.68Å; L204-M207 PolarHBondContact O-N 2.87Å; M207-V209 PolarHBondContact O-N 3.45Å; M207-S210 PolarHBondContact O-N 3.02Å; M207-S210 VanDerWaalsContact O-N 3.15Å; M207-I211 HydrophobicContact CG-CD1 3.69Å; M207-I211 HydrophobicContact CG-CG1 4.46Å; M207-I211 VanDerWaalsContact O-CG1 3.32Å; M207-I211 WeakPolarHBondContact O-CG1 3.46Å; M207-I211 PolarHBondContact O-N 3.24Å; M207-I211 HydrophobicContact SD-CD1 4.25Å; M207-F237 HydrophobicContact CB-CD2 3.79Å; M207-F237 HydrophobicContact CB-CE2 3.83Å; M207-F237 HydrophobicContact CB-CG 4.4Å; M207-F237 HydrophobicContact CB-CZ 4.46Å; M207-F237 HydrophobicContact CE-CD2 4.42Å; M207-F237 HydrophobicContact CE-CE2 3.38Å; M207-F237 HydrophobicContact CE-CZ 3.57Å; M207-F237 HydrophobicContact CG-CD2 4.49Å; M207-F237 HydrophobicContact CG-CE2 4.15Å; M207-F237 HydrophobicContact CG-CZ 4.32Å |
| 208 | C | 92.1 | Very high | 87.5 | Confident | 70 Ų | 70 | 58.9 Ų | 58.9 | 47% | 0.473 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -53.8 | -52.5 | 175.8 | -73 | 0 | 0 | 0 | 0 | 110.8 | L204 A205 S210 I211 L212 | L204-C208 WeakPolarHBondContact O-CB 3.41Å; L204-C208 PolarHBondContact O-N 3.43Å; L204-C208 PolarHBondContact O-SG 3.44Å; A205-C208 WeakPolarHBondContact O-CB 3.42Å; A205-C208 PolarHBondContact O-N 3.23Å; C208-S210 VanDerWaalsContact C-N 3.29Å; C208-S210 PolarHBondContact O-N 3.18Å; C208-I211 PolarHBondContact O-N 3.35Å; C208-L212 WeakPolarHBondContact O-CG 3.29Å; C208-L212 PolarHBondContact O-N 3.27Å |
| 209 | V | 90.3 | Very high | 85.5 | Confident | 7 Ų | 7 | 70 Ų | 70 | 4% | 0.042 | 37% | 0.372 | C | S | . | . | H | α-helix | trans | -58.3 | -39.4 | 179.1 | 178.2 | 0 | 0 | 0 | 0 | 112.4 | L132 L136 A205 Y206 M207 L212 F229 C233 | L132-V209 HydrophobicContact CD2-CG2 4.37Å; L136-V209 HydrophobicContact CD1-CG2 4.39Å; L136-V209 HydrophobicContact CD2-CG2 4Å; L136-V209 HydrophobicContact CG-CG2 4.42Å; A205-V209 VanDerWaalsContact O-CG2 3.3Å; A205-V209 WeakPolarHBondContact O-CG2 3.13Å; A205-V209 PolarHBondContact O-N 2.92Å; A205-V209 VanDerWaalsContact O-N 3.08Å; Y206-V209 PolarHBondContact O-N 3.41Å; M207-V209 PolarHBondContact O-N 3.45Å; V209-L212 WeakPolarHBondContact O-CB 3.12Å; V209-F229 HydrophobicContact CG1-CE1 3.65Å; V209-F229 HydrophobicContact CG1-CZ 4.12Å; V209-C233 HydrophobicContact CG1-CB 4.13Å; V209-C233 VanDerWaalsContact CG1-SG 3.57Å |
| 210 | S | 89.5 | Confident | 83.7 | Confident | 26 Ų | 26 | 75.2 Ų | 75.2 | 18% | 0.182 | 40% | 0.399 | C | S | . | . | H | α-helix | trans | -74.1 | -28.2 | -178.5 | -56.4 | 0 | 0 | 0 | 0 | 113 | Y206 M207 C208 P213 C233 A234 | Y206-S210 VanDerWaalsContact O-CB 3.3Å; Y206-S210 WeakPolarHBondContact O-CB 3.42Å; Y206-S210 PolarHBondContact O-N 2.72Å; Y206-S210 PolarHBondContact O-OG 3.36Å; M207-S210 PolarHBondContact O-N 3.02Å; M207-S210 VanDerWaalsContact O-N 3.15Å; C208-S210 VanDerWaalsContact C-N 3.29Å; C208-S210 PolarHBondContact O-N 3.18Å; S210-P213 VanDerWaalsContact O-CD 3.24Å; S210-P213 WeakPolarHBondContact O-CD 3.34Å; S210-P213 WeakPolarHBondContact O-CG 3.34Å; S210-C233 WeakPolarHBondContact OG-CB 3.28Å; S210-A234 PolarHBondContact OG-N 2.87Å |
| 211 | I | 89.2 | Confident | 81.7 | Confident | 73 Ų | 73 | 77.2 Ų | 77.2 | 37% | 0.374 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -84 | -25.5 | 176 | -64.5 | 169.8 | 0 | 0 | 0 | 111.5 | M207 C208 P213 L214 I215 | M207-I211 HydrophobicContact CG-CD1 3.69Å; M207-I211 HydrophobicContact CG-CG1 4.46Å; M207-I211 VanDerWaalsContact O-CG1 3.32Å; M207-I211 WeakPolarHBondContact O-CG1 3.46Å; M207-I211 PolarHBondContact O-N 3.24Å; M207-I211 HydrophobicContact SD-CD1 4.25Å; C208-I211 PolarHBondContact O-N 3.35Å; I211-P213 VanDerWaalsContact C-N 3.32Å; I211-P213 VanDerWaalsContact O-N 3.12Å; I211-L214 WeakPolarHBondContact O-CA 3.33Å; I211-L214 VanDerWaalsContact O-CB 3.28Å; I211-L214 WeakPolarHBondContact O-CB 3.29Å; I211-L214 PolarHBondContact O-N 2.98Å; I211-I215 HydrophobicContact CG2-CD1 4.07Å; I211-I215 HydrophobicContact CG2-CG1 4.04Å; I211-I215 PolarHBondContact O-N 3.3Å |
| 212 | L | 84.7 | Confident | 79.9 | Confident | 36 Ų | 36 | 76.8 Ų | 76.8 | 19% | 0.188 | 40% | 0.401 | C | S | . | . | G | 310 helix | trans | -44.5 | -43.3 | 177.3 | -71.5 | 178.7 | 0 | 0 | 0 | 115.6 | L136 C208 V209 L214 I215 L221 M223 | L136-L212 HydrophobicContact CD2-CD1 3.89Å; C208-L212 WeakPolarHBondContact O-CG 3.29Å; C208-L212 PolarHBondContact O-N 3.27Å; V209-L212 WeakPolarHBondContact O-CB 3.12Å; L212-L214 PolarHBondContact O-N 3.19Å; L212-I215 PolarHBondContact O-N 2.8Å; L212-L221 HydrophobicContact CD1-CD1 4.4Å; L212-L221 HydrophobicContact CD2-CD1 3.84Å; L212-M223 HydrophobicContact CB-CE 3.22Å; L212-M223 HydrophobicContact CB-SD 4.39Å; L212-M223 HydrophobicContact CD1-CE 3.77Å; L212-M223 HydrophobicContact CG-CE 4.11Å |
| 213 | P | 79.5 | Confident | 78 | Confident | 40 Ų | 40 | 78 Ų | 78 | 26% | 0.26 | 41% | 0.407 | S | S | . | . | G | 310 helix | trans | -66 | -20.8 | 178 | 27 | -36 | 0 | 0 | 0 | 113.4 | S210 I211 Q218 Y230 | S210-P213 VanDerWaalsContact O-CD 3.24Å; S210-P213 WeakPolarHBondContact O-CD 3.34Å; S210-P213 WeakPolarHBondContact O-CG 3.34Å; I211-P213 VanDerWaalsContact C-N 3.32Å; I211-P213 VanDerWaalsContact O-N 3.12Å; P213-Q218 PolarHBondContact O-NE2 3.22Å; P213-Y230 HydrophobicContact CB-CD1 4.41Å; P213-Y230 HydrophobicContact CB-CE1 4.11Å; P213-Y230 HydrophobicContact CG-CD1 3.69Å; P213-Y230 HydrophobicContact CG-CE1 3.78Å; P213-Y230 HydrophobicContact CG-CG 4.15Å |
| 214 | L | 81 | Confident | 76.5 | Confident | 141 Ų | 141 | 78.3 Ų | 78.3 | 74% | 0.738 | 41% | 0.408 | S | S | * | . | G | 310 helix | trans | -81.3 | -22.6 | 176.4 | -54.5 | 177.1 | 0 | 0 | 0 | 112.2 | I211 L212 | I211-L214 WeakPolarHBondContact O-CA 3.33Å; I211-L214 VanDerWaalsContact O-CB 3.28Å; I211-L214 WeakPolarHBondContact O-CB 3.29Å; I211-L214 PolarHBondContact O-N 2.98Å; L212-L214 PolarHBondContact O-N 3.19Å |
| 215 | I | 80.7 | Confident | 74.9 | Confident | 83 Ų | 83 | 85.5 Ų | 85.5 | 43% | 0.426 | 43% | 0.428 | S | S | . | . | S | Bend | trans | -83.9 | 127.5 | -178.2 | -53.5 | 174.4 | 0 | 0 | 0 | 108.8 | I211 L212 F217 Q218 | I211-I215 HydrophobicContact CG2-CD1 4.07Å; I211-I215 HydrophobicContact CG2-CG1 4.04Å; I211-I215 PolarHBondContact O-N 3.3Å; L212-I215 PolarHBondContact O-N 2.8Å; I215-F217 HydrophobicContact CG2-CB 3.93Å; I215-F217 PolarHBondContact O-N 3.34Å; I215-Q218 WeakPolarHBondContact O-CG 3.25Å |
| 216 | S | 66.8 | Low | 74 | Confident | 118 Ų | 118 | 88.6 Ų | 88.6 | 83% | 0.825 | 44% | 0.435 | S | S | * | . | G | 310 helix | trans | -61.6 | -4.7 | 179.8 | -48.9 | 0 | 0 | 0 | 0 | 115.2 | Q218 | S216-Q218 PolarHBondContact O-N 3.02Å; S216-Q218 VanDerWaalsContact O-N 3.1Å |
| 217 | F | 57.8 | Low | 73.4 | Confident | 135 Ų | 135 | 97.7 Ų | 97.7 | 59% | 0.592 | 47% | 0.474 | S | S | * | . | G | 310 helix | trans | -75.3 | 11.2 | 178.9 | -133.4 | -107.6 | 0 | 0 | 0 | 113.9 | I215 R219 I220 | I215-F217 HydrophobicContact CG2-CB 3.93Å; I215-F217 PolarHBondContact O-N 3.34Å; F217-R219 PolarHBondContact O-N 3.3Å; F217-I220 HydrophobicContact CD1-CB 3.95Å; F217-I220 HydrophobicContact CD1-CD1 3.72Å; F217-I220 HydrophobicContact CD1-CG1 4.32Å; F217-I220 HydrophobicContact CD1-CG2 4.47Å; F217-I220 HydrophobicContact CE1-CB 3.99Å; F217-I220 HydrophobicContact CE1-CD1 3.08Å; F217-I220 HydrophobicContact CE1-CG1 4.06Å; F217-I220 HydrophobicContact CE1-CG2 4.24Å; F217-I220 HydrophobicContact CE2-CD1 4.17Å; F217-I220 HydrophobicContact CZ-CD1 3.34Å; F217-I220 PolarHBondContact O-N 3.08Å; F217-I220 VanDerWaalsContact O-N 3.07Å |
| 218 | Q | 58.3 | Low | 72.9 | Confident | 105 Ų | 105 | 96.1 Ų | 96.1 | 49% | 0.491 | 48% | 0.476 | S | S | . | . | G | 310 helix | trans | -49.8 | -25.6 | 177.6 | -59.9 | -170.4 | -18 | 0 | 0 | 113.9 | P213 I215 S216 I220 M223 | P213-Q218 PolarHBondContact O-NE2 3.22Å; I215-Q218 WeakPolarHBondContact O-CG 3.25Å; S216-Q218 PolarHBondContact O-N 3.02Å; S216-Q218 VanDerWaalsContact O-N 3.1Å; Q218-I220 VanDerWaalsContact C-N 3.26Å; Q218-I220 PolarHBondContact O-N 2.85Å; Q218-M223 HydrophobicContact CG-SD 4.17Å |
| 219 | R | 55.5 | Low | 72.8 | Confident | 245 Ų | 245 | 93.1 Ų | 93.1 | 93% | 0.925 | 46% | 0.455 | S | S | * | . | G | 310 helix | trans | -65.5 | -23.2 | 179.7 | -82.1 | -171 | -98.7 | -159.9 | -4.7 | 114.4 | F217 | F217-R219 PolarHBondContact O-N 3.3Š|
| 220 | I | 58.2 | Low | 72.7 | Confident | 111 Ų | 111 | 94.6 Ų | 94.6 | 57% | 0.569 | 46% | 0.46 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -97.9 | -27.2 | -175.4 | -72.1 | 163.8 | 0 | 0 | 0 | 112.5 | F217 Q218 | F217-I220 HydrophobicContact CD1-CB 3.95Å; F217-I220 HydrophobicContact CD1-CD1 3.72Å; F217-I220 HydrophobicContact CD1-CG1 4.32Å; F217-I220 HydrophobicContact CD1-CG2 4.47Å; F217-I220 HydrophobicContact CE1-CB 3.99Å; F217-I220 HydrophobicContact CE1-CD1 3.08Å; F217-I220 HydrophobicContact CE1-CG1 4.06Å; F217-I220 HydrophobicContact CE1-CG2 4.24Å; F217-I220 HydrophobicContact CE2-CD1 4.17Å; F217-I220 HydrophobicContact CZ-CD1 3.34Å; F217-I220 PolarHBondContact O-N 3.08Å; F217-I220 VanDerWaalsContact O-N 3.07Å; Q218-I220 VanDerWaalsContact C-N 3.26Å; Q218-I220 PolarHBondContact O-N 2.85Å |
| 221 | L | 58.1 | Low | 72.8 | Confident | 83 Ų | 83 | 99.5 Ų | 99.5 | 44% | 0.435 | 48% | 0.483 | S | S | . | . | S | Bend | trans | -103 | 122.8 | 178.7 | -63.4 | 172.9 | 0 | 0 | 0 | 109.4 | L212 M223 | L212-L221 HydrophobicContact CD1-CD1 4.4Å; L212-L221 HydrophobicContact CD2-CD1 3.84Å; L221-M223 WeakPolarHBondContact O-CG 3.38Å; L221-M223 PolarHBondContact O-N 3.03Å |
| 222 | L | 59.3 | Low | 73 | Confident | 105 Ų | 105 | 96.7 Ų | 96.7 | 55% | 0.55 | 47% | 0.468 | S | S | . | . | trans | -64.4 | 81.6 | 171.9 | -76.3 | 148.2 | 0 | 0 | 0 | 109.1 | R140 | R140-L222 HydrophobicContact CG-CD1 4.39Š| ||
| 223 | M | 57.5 | Low | 73.4 | Confident | 43 Ų | 43 | 95 Ų | 95 | 21% | 0.212 | 46% | 0.459 | C | S | . | . | trans | -67 | 139.4 | -173.2 | -75.7 | -129.2 | 94.8 | 0 | 0 | 111.6 | L212 Q218 L221 R225 Y230 | L212-M223 HydrophobicContact CB-CE 3.22Å; L212-M223 HydrophobicContact CB-SD 4.39Å; L212-M223 HydrophobicContact CD1-CE 3.77Å; L212-M223 HydrophobicContact CG-CE 4.11Å; Q218-M223 HydrophobicContact CG-SD 4.17Å; L221-M223 WeakPolarHBondContact O-CG 3.38Å; L221-M223 PolarHBondContact O-N 3.03Å; M223-R225 PolarHBondContact O-N 2.79Å; M223-Y230 WeakPolarHBondContact CB-OH 3.24Å; M223-Y230 HydrophobicContact CE-CE1 3.66Å; M223-Y230 WeakPolarHBondContact CE-OH 3.44Å; M223-Y230 PolarHBondContact SD-OH 2.85Å | ||
| 224 | P | 65.5 | Low | 74.1 | Confident | 15 Ų | 15 | 95 Ų | 95 | 10% | 0.097 | 46% | 0.462 | C | S | . | . | trans | -56.7 | 110 | 167 | -28.4 | 38.5 | 0 | 0 | 0 | 110.8 | G135 L138 K226 F229 Y230 | G135-P224 WeakPolarHBondContact O-CD 3.34Å; G135-P224 WeakPolarHBondContact O-CG 3.32Å; L138-P224 HydrophobicContact CD1-CB 4.13Å; L138-P224 HydrophobicContact CD1-CG 3.83Å; P224-K226 PolarHBondContact O-N 2.82Å; P224-F229 HydrophobicContact CB-CB 4.11Å; P224-F229 HydrophobicContact CB-CD1 3.65Å; P224-F229 HydrophobicContact CB-CE1 4.33Å; P224-F229 HydrophobicContact CB-CG 3.98Å; P224-F229 HydrophobicContact CG-CD1 3.57Å; P224-F229 HydrophobicContact CG-CE1 3.73Å; P224-F229 HydrophobicContact CG-CG 4.21Å; P224-F229 HydrophobicContact CG-CZ 4.49Å; P224-Y230 WeakPolarHBondContact O-CE2 3.33Å; P224-Y230 PolarHBondContact O-OH 2.98Å | ||
| 225 | R | 63.8 | Low | 74.9 | Confident | 248 Ų | 248 | 91.3 Ų | 91.3 | 94% | 0.936 | 44% | 0.441 | S | S | * | . | trans | -63.8 | -14.5 | -177.6 | -169.1 | 171.5 | 165.2 | 149.4 | -3.1 | 113.7 | M223 | M223-R225 PolarHBondContact O-N 2.79Š| ||
| 226 | K | 75.6 | Confident | 75.7 | Confident | 107 Ų | 107 | 87.4 Ų | 87.4 | 47% | 0.465 | 42% | 0.421 | S | S | . | . | trans | -88.9 | 116.9 | -175.7 | -65.4 | -172.9 | -178.3 | 177.3 | 0 | 111.4 | P224 G228 F229 | P224-K226 PolarHBondContact O-N 2.82Å; K226-G228 PolarHBondContact O-N 3.15Å; K226-F229 WeakPolarHBondContact O-CB 3.3Å; K226-F229 PolarHBondContact O-N 3.39Å | ||
| 227 | K | 82.7 | Confident | 77.1 | Confident | 190 Ų | 190 | 85.1 Ų | 85.1 | 83% | 0.826 | 40% | 0.396 | S | S | * | . | H | α-helix | trans | -49.6 | -33.6 | 172.3 | -64.6 | -175.9 | 179.5 | -178.2 | 0 | 113.4 | F229 Y230 L231 | K227-F229 VanDerWaalsContact C-N 3.25Å; K227-F229 PolarHBondContact O-N 3.28Å; K227-Y230 PolarHBondContact O-N 3.46Å; K227-L231 PolarHBondContact O-N 3.33Å; K227-L231 VanDerWaalsContact O-N 3.17Å |
| 228 | G | 85.6 | Confident | 79 | Confident | 37 Ų | 37 | 81.1 Ų | 81.1 | 38% | 0.381 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -60 | -30.5 | 178.4 | 0 | 0 | 0 | 0 | 0 | 114.2 | K226 Y232 T279 | K226-G228 PolarHBondContact O-N 3.15Å; G228-Y232 WeakPolarHBondContact O-CB 3.01Å; G228-Y232 PolarHBondContact O-N 3.48Å; G228-T279 WeakPolarHBondContact O-CG2 3.36Å |
| 229 | F | 88.6 | Confident | 80.9 | Confident | 7 Ų | 7 | 76.5 Ų | 76.5 | 3% | 0.031 | 37% | 0.366 | C | S | . | . | H | α-helix | trans | -67 | -45.8 | 177.1 | 177.1 | -103.7 | 0 | 0 | 0 | 111.6 | V131 V209 P224 K226 K227 L231 Y232 C233 F280 | V131-F229 HydrophobicContact CG1-CE2 4.38Å; V209-F229 HydrophobicContact CG1-CE1 3.65Å; V209-F229 HydrophobicContact CG1-CZ 4.12Å; P224-F229 HydrophobicContact CB-CB 4.11Å; P224-F229 HydrophobicContact CB-CD1 3.65Å; P224-F229 HydrophobicContact CB-CE1 4.33Å; P224-F229 HydrophobicContact CB-CG 3.98Å; P224-F229 HydrophobicContact CG-CD1 3.57Å; P224-F229 HydrophobicContact CG-CE1 3.73Å; P224-F229 HydrophobicContact CG-CG 4.21Å; P224-F229 HydrophobicContact CG-CZ 4.49Å; K226-F229 WeakPolarHBondContact O-CB 3.3Å; K226-F229 PolarHBondContact O-N 3.39Å; K227-F229 VanDerWaalsContact C-N 3.25Å; K227-F229 PolarHBondContact O-N 3.28Å; F229-L231 PolarHBondContact O-N 3.02Å; F229-Y232 WeakPolarHBondContact O-CB 3.11Å; F229-Y232 PolarHBondContact O-N 2.81Å; F229-C233 VanDerWaalsContact CZ-SG 3.54Å; F229-C233 PolarHBondContact O-N 3.32Å; F229-C233 PolarHBondContact O-SG 3.27Å; F229-C233 VanDerWaalsContact O-SG 3.38Å; F229-F280 HydrophobicContact CD2-CE1 4.4Å; F229-F280 HydrophobicContact CD2-CE2 4.23Å; F229-F280 AromaticContact CD2-CZ 3.6Å; F229-F280 HydrophobicContact CD2-CZ 3.6Å; F229-F280 HydrophobicContact CE2-CE2 4.49Å; F229-F280 AromaticContact CE2-CZ 3.77Å; F229-F280 HydrophobicContact CE2-CZ 3.77Å |
| 230 | Y | 89.6 | Confident | 82.9 | Confident | 38 Ų | 38 | 65.1 Ų | 65.1 | 15% | 0.149 | 32% | 0.324 | C | S | . | . | H | α-helix | trans | -66.7 | -37.2 | 177.7 | -58.3 | -75.9 | 0 | 0 | 0 | 112.5 | P213 M223 P224 K227 Y232 C233 A234 | P213-Y230 HydrophobicContact CB-CD1 4.41Å; P213-Y230 HydrophobicContact CB-CE1 4.11Å; P213-Y230 HydrophobicContact CG-CD1 3.69Å; P213-Y230 HydrophobicContact CG-CE1 3.78Å; P213-Y230 HydrophobicContact CG-CG 4.15Å; M223-Y230 WeakPolarHBondContact CB-OH 3.24Å; M223-Y230 HydrophobicContact CE-CE1 3.66Å; M223-Y230 WeakPolarHBondContact CE-OH 3.44Å; M223-Y230 PolarHBondContact SD-OH 2.85Å; P224-Y230 WeakPolarHBondContact O-CE2 3.33Å; P224-Y230 PolarHBondContact O-OH 2.98Å; K227-Y230 PolarHBondContact O-N 3.46Å; Y230-Y232 VanDerWaalsContact C-N 3.28Å; Y230-Y232 PolarHBondContact O-N 3.43Å; Y230-C233 PolarHBondContact O-N 2.89Å; Y230-A234 WeakPolarHBondContact O-CB 3.28Å; Y230-A234 PolarHBondContact O-N 2.99Å |
| 231 | L | 91.2 | Very high | 84.8 | Confident | 130 Ų | 130 | 60.8 Ų | 60.8 | 68% | 0.681 | 31% | 0.306 | S | S | * | . | H | α-helix | trans | -62.1 | -39.1 | 174.1 | -176.9 | 62.1 | 0 | 0 | 0 | 111.4 | K227 F229 A234 F235 | K227-L231 PolarHBondContact O-N 3.33Å; K227-L231 VanDerWaalsContact O-N 3.17Å; F229-L231 PolarHBondContact O-N 3.02Å; L231-A234 PolarHBondContact O-N 3.46Å; L231-F235 WeakPolarHBondContact O-CB 3.45Å; L231-F235 PolarHBondContact O-N 3.02Å |
| 232 | Y | 93 | Very high | 86.7 | Confident | 13 Ų | 13 | 59.9 Ų | 59.9 | 5% | 0.051 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -65.9 | -43.2 | 174 | 168.4 | -93.8 | 0 | 0 | 0 | 112.6 | V131 G228 F229 Y230 A234 F235 L236 F272 V276 T279 | V131-Y232 HydrophobicContact CG1-CE1 3.81Å; G228-Y232 WeakPolarHBondContact O-CB 3.01Å; G228-Y232 PolarHBondContact O-N 3.48Å; F229-Y232 WeakPolarHBondContact O-CB 3.11Å; F229-Y232 PolarHBondContact O-N 2.81Å; Y230-Y232 VanDerWaalsContact C-N 3.28Å; Y230-Y232 PolarHBondContact O-N 3.43Å; Y232-A234 VanDerWaalsContact C-N 3.34Å; Y232-A234 PolarHBondContact O-N 3.23Å; Y232-F235 WeakPolarHBondContact O-CB 3.1Å; Y232-F235 PolarHBondContact O-N 3.37Å; Y232-L236 HydrophobicContact CD1-CD1 4.31Å; Y232-L236 HydrophobicContact CE1-CD1 3.56Å; Y232-L236 HydrophobicContact CE1-CG 4.39Å; Y232-L236 HydrophobicContact CE2-CD1 4.2Å; Y232-L236 HydrophobicContact CE2-CG 4.44Å; Y232-L236 PolarHBondContact O-N 3.41Å; Y232-F272 VanDerWaalsContact OH-CD2 3.32Å; Y232-F272 WeakPolarHBondContact OH-CD2 3.47Å; Y232-F272 WeakPolarHBondContact OH-CE2 3.48Å; Y232-V276 HydrophobicContact CE2-CG2 4.21Å; Y232-V276 VanDerWaalsContact OH-CG2 3.28Å; Y232-V276 WeakPolarHBondContact OH-CG2 3.27Å; Y232-T279 HydrophobicContact CD2-CG2 4.29Å; Y232-T279 HydrophobicContact CG-CG2 3.98Å |
| 233 | C | 94 | Very high | 88.5 | Confident | 0 Ų | 0 | 55.5 Ų | 55.5 | 0% | 0 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -63.2 | -39.9 | 174.2 | -66.9 | 0 | 0 | 0 | 0 | 112.2 | Y206 V209 S210 F229 Y230 F235 L236 F237 | Y206-C233 HydrophobicContact CD1-CB 4Å; V209-C233 HydrophobicContact CG1-CB 4.13Å; V209-C233 VanDerWaalsContact CG1-SG 3.57Å; S210-C233 WeakPolarHBondContact OG-CB 3.28Å; F229-C233 VanDerWaalsContact CZ-SG 3.54Å; F229-C233 PolarHBondContact O-N 3.32Å; F229-C233 PolarHBondContact O-SG 3.27Å; F229-C233 VanDerWaalsContact O-SG 3.38Å; Y230-C233 PolarHBondContact O-N 2.89Å; C233-F235 VanDerWaalsContact C-N 3.32Å; C233-F235 PolarHBondContact O-N 3.18Å; C233-L236 PolarHBondContact O-N 2.85Å; C233-F237 WeakPolarHBondContact O-CB 3.47Å; C233-F237 PolarHBondContact O-N 2.86Å |
| 234 | A | 94.5 | Very high | 90.5 | Very high | 40 Ų | 40 | 55.2 Ų | 55.2 | 33% | 0.331 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -64.3 | -38.8 | 175.4 | 0 | 0 | 0 | 0 | 0 | 111.7 | S210 Y230 L231 Y232 F237 A238 | S210-A234 PolarHBondContact OG-N 2.87Å; Y230-A234 WeakPolarHBondContact O-CB 3.28Å; Y230-A234 PolarHBondContact O-N 2.99Å; L231-A234 PolarHBondContact O-N 3.46Å; Y232-A234 VanDerWaalsContact C-N 3.34Å; Y232-A234 PolarHBondContact O-N 3.23Å; A234-F237 PolarHBondContact O-N 3.28Å; A234-A238 PolarHBondContact O-N 3.45Å |
| 235 | F | 96.3 | Very high | 92 | Very high | 65 Ų | 65 | 58.9 Ų | 58.9 | 29% | 0.285 | 30% | 0.297 | S | S | . | . | H | α-helix | trans | -61.4 | -48 | 172.8 | 171.5 | -103 | 0 | 0 | 0 | 111.7 | L231 Y232 C233 A238 L239 M267 C271 | L231-F235 WeakPolarHBondContact O-CB 3.45Å; L231-F235 PolarHBondContact O-N 3.02Å; Y232-F235 WeakPolarHBondContact O-CB 3.1Å; Y232-F235 PolarHBondContact O-N 3.37Å; C233-F235 VanDerWaalsContact C-N 3.32Å; C233-F235 PolarHBondContact O-N 3.18Å; F235-A238 WeakPolarHBondContact O-CB 3.12Å; F235-A238 PolarHBondContact O-N 3.33Å; F235-L239 HydrophobicContact CD1-CD1 4.34Å; F235-L239 HydrophobicContact CD1-CG 4.5Å; F235-L239 HydrophobicContact CE1-CD1 3.6Å; F235-L239 HydrophobicContact CE1-CG 4.11Å; F235-L239 HydrophobicContact CE2-CD1 4.42Å; F235-L239 HydrophobicContact CE2-CD2 4.05Å; F235-L239 HydrophobicContact CE2-CG 4.28Å; F235-L239 HydrophobicContact CZ-CD1 3.66Å; F235-L239 HydrophobicContact CZ-CD2 4.06Å; F235-L239 HydrophobicContact CZ-CG 4Å; F235-L239 WeakPolarHBondContact O-CG 3.27Å; F235-L239 PolarHBondContact O-N 3.49Å; F235-M267 HydrophobicContact CE2-CE 3.86Å; F235-M267 HydrophobicContact CZ-CB 4.2Å; F235-M267 HydrophobicContact CZ-CE 3.84Å; F235-C271 HydrophobicContact CZ-CB 4.29Å |
| 236 | L | 97.1 | Very high | 93.5 | Very high | 0 Ų | 0 | 47.1 Ų | 47.1 | 0% | 0 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -65.2 | -39.2 | 176.9 | -71.6 | -176.3 | 0 | 0 | 0 | 112.8 | Y206 Y232 C233 A238 L239 Y240 Y268 F272 | Y206-L236 HydrophobicContact CD1-CB 4.07Å; Y206-L236 HydrophobicContact CD1-CD1 4.3Å; Y206-L236 HydrophobicContact CD2-CB 4Å; Y206-L236 HydrophobicContact CE1-CB 4.11Å; Y206-L236 HydrophobicContact CE1-CD1 3.53Å; Y206-L236 HydrophobicContact CE1-CG 4.46Å; Y206-L236 HydrophobicContact CE2-CB 4.09Å; Y206-L236 HydrophobicContact CE2-CD1 4.05Å; Y206-L236 HydrophobicContact CG-CB 4.02Å; Y206-L236 WeakPolarHBondContact OH-CD1 3.2Å; Y232-L236 HydrophobicContact CD1-CD1 4.31Å; Y232-L236 HydrophobicContact CE1-CD1 3.56Å; Y232-L236 HydrophobicContact CE1-CG 4.39Å; Y232-L236 HydrophobicContact CE2-CD1 4.2Å; Y232-L236 HydrophobicContact CE2-CG 4.44Å; Y232-L236 PolarHBondContact O-N 3.41Å; C233-L236 PolarHBondContact O-N 2.85Å; L236-A238 VanDerWaalsContact C-N 3.29Å; L236-A238 PolarHBondContact O-N 3.24Å; L236-L239 HydrophobicContact CD2-CD1 4.31Å; L236-L239 PolarHBondContact O-N 2.97Å; L236-Y240 HydrophobicContact CB-CD2 4.43Å; L236-Y240 HydrophobicContact CB-CE2 4.44Å; L236-Y240 WeakPolarHBondContact O-CD2 3.36Å; L236-Y240 PolarHBondContact O-N 3.23Å; L236-Y268 HydrophobicContact CD2-CD2 4.4Å; L236-F272 HydrophobicContact CD1-CD2 4.41Å; L236-F272 HydrophobicContact CD1-CE2 4.26Å; L236-F272 HydrophobicContact CD2-CD2 4.14Å |
| 237 | F | 97.4 | Very high | 94.5 | Very high | 70 Ų | 70 | 42 Ų | 42 | 31% | 0.307 | 23% | 0.23 | S | C | . | . | H | α-helix | trans | -55.5 | -45.5 | 171.5 | 167.6 | -115.6 | 0 | 0 | 0 | 111.4 | A203 M207 C233 A234 Y240 G241 | A203-F237 HydrophobicContact CB-CD2 4.19Å; A203-F237 HydrophobicContact CB-CE2 4.37Å; A203-F237 VanDerWaalsContact O-CD2 3.29Å; A203-F237 WeakPolarHBondContact O-CD2 3.49Å; M207-F237 HydrophobicContact CB-CD2 3.79Å; M207-F237 HydrophobicContact CB-CE2 3.83Å; M207-F237 HydrophobicContact CB-CG 4.4Å; M207-F237 HydrophobicContact CB-CZ 4.46Å; M207-F237 HydrophobicContact CE-CD2 4.42Å; M207-F237 HydrophobicContact CE-CE2 3.38Å; M207-F237 HydrophobicContact CE-CZ 3.57Å; M207-F237 HydrophobicContact CG-CD2 4.49Å; M207-F237 HydrophobicContact CG-CE2 4.15Å; M207-F237 HydrophobicContact CG-CZ 4.32Å; C233-F237 WeakPolarHBondContact O-CB 3.47Å; C233-F237 PolarHBondContact O-N 2.86Å; A234-F237 PolarHBondContact O-N 3.28Å; F237-Y240 PolarHBondContact O-N 2.97Å; F237-G241 PolarHBondContact O-N 3.29Å |
| 238 | A | 97.9 | Very high | 95.1 | Very high | 51 Ų | 51 | 35.6 Ų | 35.6 | 42% | 0.421 | 21% | 0.207 | S | C | . | . | H | α-helix | trans | -63.4 | -41.6 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | A234 F235 L236 G241 L242 | A234-A238 PolarHBondContact O-N 3.45Å; F235-A238 WeakPolarHBondContact O-CB 3.12Å; F235-A238 PolarHBondContact O-N 3.33Å; L236-A238 VanDerWaalsContact C-N 3.29Å; L236-A238 PolarHBondContact O-N 3.24Å; A238-G241 PolarHBondContact O-N 2.93Å; A238-L242 WeakPolarHBondContact O-CG 3.45Å; A238-L242 PolarHBondContact O-N 3.45Å |
| 239 | L | 97.9 | Very high | 95.5 | Very high | 8 Ų | 8 | 35.8 Ų | 35.8 | 4% | 0.042 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -62.9 | -47.8 | 176.7 | -63.8 | -164.5 | 0 | 0 | 0 | 112 | F235 L236 G241 L242 Q243 P264 M267 | F235-L239 HydrophobicContact CD1-CD1 4.34Å; F235-L239 HydrophobicContact CD1-CG 4.5Å; F235-L239 HydrophobicContact CE1-CD1 3.6Å; F235-L239 HydrophobicContact CE1-CG 4.11Å; F235-L239 HydrophobicContact CE2-CD1 4.42Å; F235-L239 HydrophobicContact CE2-CD2 4.05Å; F235-L239 HydrophobicContact CE2-CG 4.28Å; F235-L239 HydrophobicContact CZ-CD1 3.66Å; F235-L239 HydrophobicContact CZ-CD2 4.06Å; F235-L239 HydrophobicContact CZ-CG 4Å; F235-L239 WeakPolarHBondContact O-CG 3.27Å; F235-L239 PolarHBondContact O-N 3.49Å; L236-L239 HydrophobicContact CD2-CD1 4.31Å; L236-L239 PolarHBondContact O-N 2.97Å; L239-G241 VanDerWaalsContact C-N 3.34Å; L239-L242 PolarHBondContact O-N 2.99Å; L239-Q243 WeakPolarHBondContact O-CG 3.33Å; L239-Q243 PolarHBondContact O-N 3.01Å; L239-P264 HydrophobicContact CB-CB 4.11Å; L239-P264 HydrophobicContact CD2-CB 4.21Å; L239-P264 WeakPolarHBondContact O-CB 3.16Å; L239-M267 HydrophobicContact CD1-CB 3.93Å; L239-M267 HydrophobicContact CD2-CB 3.8Å; L239-M267 HydrophobicContact CD2-CG 4.37Å |
| 240 | Y | 98.2 | Very high | 95.6 | Very high | 7 Ų | 7 | 35.6 Ų | 35.6 | 3% | 0.027 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -68.7 | -33.4 | 177.7 | -73.6 | -62.7 | 0 | 0 | 0 | 112.3 | E128 L202 Y206 L236 F237 L242 Q243 V244 Y268 | E128-Y240 VanDerWaalsContact CD-OH 3.28Å; E128-Y240 WeakPolarHBondContact OE1-CE2 3.24Å; E128-Y240 PolarHBondContact OE1-OH 3.29Å; E128-Y240 PolarHBondContact OE2-OH 2.69Å; L202-Y240 HydrophobicContact CB-CD1 3.99Å; L202-Y240 HydrophobicContact CB-CD2 3.86Å; L202-Y240 HydrophobicContact CB-CE1 4.06Å; L202-Y240 HydrophobicContact CB-CE2 3.94Å; L202-Y240 HydrophobicContact CB-CG 3.91Å; L202-Y240 HydrophobicContact CD1-CD1 4.16Å; L202-Y240 HydrophobicContact CD1-CE1 3.49Å; L202-Y240 VanDerWaalsContact CD1-CE1 3.49Å; L202-Y240 HydrophobicContact CD1-CE2 4.25Å; L202-Y240 HydrophobicContact CG-CE1 4.42Å; Y206-Y240 AromaticContact CD2-CD2 3.81Å; Y206-Y240 HydrophobicContact CD2-CD2 3.81Å; Y206-Y240 AromaticContact CD2-CE2 3.99Å; Y206-Y240 HydrophobicContact CD2-CE2 3.99Å; Y206-Y240 AromaticContact CE2-CD2 3.95Å; Y206-Y240 HydrophobicContact CE2-CD2 3.95Å; Y206-Y240 AromaticContact CE2-CE2 3.62Å; Y206-Y240 HydrophobicContact CE2-CE2 3.62Å; L236-Y240 HydrophobicContact CB-CD2 4.43Å; L236-Y240 HydrophobicContact CB-CE2 4.44Å; L236-Y240 WeakPolarHBondContact O-CD2 3.36Å; L236-Y240 PolarHBondContact O-N 3.23Å; F237-Y240 PolarHBondContact O-N 2.97Å; Y240-L242 VanDerWaalsContact C-N 3.35Å; Y240-L242 PolarHBondContact O-N 3.44Å; Y240-Q243 WeakPolarHBondContact O-CB 3.23Å; Y240-Q243 PolarHBondContact O-N 2.88Å; Y240-V244 WeakPolarHBondContact O-CG2 3.45Å; Y240-V244 PolarHBondContact O-N 3.31Å; Y240-Y268 WeakPolarHBondContact OH-CE2 3.39Å |
| 241 | G | 98.1 | Very high | 95.7 | Very high | 20 Ų | 20 | 37.5 Ų | 37.5 | 21% | 0.206 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -60.3 | -42.9 | 171.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | F237 A238 L239 Q243 V244 I245 | F237-G241 PolarHBondContact O-N 3.29Å; A238-G241 PolarHBondContact O-N 2.93Å; L239-G241 VanDerWaalsContact C-N 3.34Å; G241-Q243 VanDerWaalsContact C-N 3.34Å; G241-Q243 PolarHBondContact O-N 3.34Å; G241-V244 PolarHBondContact O-N 2.92Å; G241-I245 WeakPolarHBondContact O-CG1 3.49Å; G241-I245 PolarHBondContact O-N 3.43Å |
| 242 | L | 97.8 | Very high | 95.8 | Very high | 64 Ų | 64 | 37.3 Ų | 37.3 | 34% | 0.335 | 21% | 0.21 | S | C | . | . | H | α-helix | trans | -64.1 | -37.4 | 173 | -73.4 | 171.6 | 0 | 0 | 0 | 112.3 | A238 L239 Y240 I245 A246 I260 P264 | A238-L242 WeakPolarHBondContact O-CG 3.45Å; A238-L242 PolarHBondContact O-N 3.45Å; L239-L242 PolarHBondContact O-N 2.99Å; Y240-L242 VanDerWaalsContact C-N 3.35Å; Y240-L242 PolarHBondContact O-N 3.44Å; L242-I245 PolarHBondContact O-N 3.25Å; L242-A246 VanDerWaalsContact O-CB 3.3Å; L242-A246 WeakPolarHBondContact O-CB 3.39Å; L242-A246 PolarHBondContact O-N 3.46Å; L242-I260 HydrophobicContact CD2-CG2 4.42Å; L242-P264 HydrophobicContact CB-CB 4.16Å; L242-P264 HydrophobicContact CB-CG 3.94Å |
| 243 | Q | 97.3 | Very high | 95.5 | Very high | 12 Ų | 12 | 39.1 Ų | 39.1 | 6% | 0.056 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -64.9 | -40.4 | 174.2 | -69 | 177.1 | 19 | 0 | 0 | 112 | L239 Y240 G241 I245 A246 S247 L261 P264 | L239-Q243 WeakPolarHBondContact O-CG 3.33Å; L239-Q243 PolarHBondContact O-N 3.01Å; Y240-Q243 WeakPolarHBondContact O-CB 3.23Å; Y240-Q243 PolarHBondContact O-N 2.88Å; G241-Q243 VanDerWaalsContact C-N 3.34Å; G241-Q243 PolarHBondContact O-N 3.34Å; Q243-I245 PolarHBondContact O-N 3.08Å; Q243-A246 PolarHBondContact O-N 3.22Å; Q243-S247 WeakPolarHBondContact O-CB 3.25Å; Q243-S247 PolarHBondContact O-N 3.32Å; Q243-S247 PolarHBondContact O-OG 3.41Å; Q243-L261 HydrophobicContact CG-CD1 4.02Å; Q243-P264 HydrophobicContact CG-CB 3.95Å; Q243-P264 HydrophobicContact CG-CG 3.76Å |
| 244 | V | 98.1 | Very high | 95.3 | Very high | 37 Ų | 37 | 41.8 Ų | 41.8 | 22% | 0.224 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -60 | -47.2 | 174.3 | 169.1 | 0 | 0 | 0 | 0 | 110.7 | L196 S199 A200 Y240 G241 T248 | L196-V244 HydrophobicContact CD1-CB 4.35Å; L196-V244 HydrophobicContact CD1-CG1 3.85Å; S199-V244 WeakPolarHBondContact OG-CG2 3.38Å; A200-V244 HydrophobicContact CB-CG2 3.96Å; Y240-V244 WeakPolarHBondContact O-CG2 3.45Å; Y240-V244 PolarHBondContact O-N 3.31Å; G241-V244 PolarHBondContact O-N 2.92Å; V244-T248 VanDerWaalsContact O-CB 3.3Å; V244-T248 WeakPolarHBondContact O-CB 3.32Å; V244-T248 PolarHBondContact O-N 2.86Å; V244-T248 PolarHBondContact O-OG1 3.38Å |
| 245 | I | 97.6 | Very high | 94.8 | Very high | 93 Ų | 93 | 40 Ų | 40 | 48% | 0.477 | 23% | 0.226 | S | C | . | . | H | α-helix | trans | -60.9 | -47.5 | 177.4 | -65.8 | 165.1 | 0 | 0 | 0 | 110.3 | G241 L242 Q243 T248 L249 | G241-I245 WeakPolarHBondContact O-CG1 3.49Å; G241-I245 PolarHBondContact O-N 3.43Å; L242-I245 PolarHBondContact O-N 3.25Å; Q243-I245 PolarHBondContact O-N 3.08Å; I245-T248 PolarHBondContact O-N 2.94Å; I245-L249 HydrophobicContact CG2-CD1 4.17Å; I245-L249 WeakPolarHBondContact O-CG 3.42Å; I245-L249 PolarHBondContact O-N 3.49Å |
| 246 | A | 95.6 | Very high | 94.4 | Very high | 0 Ų | 0 | 39.1 Ų | 39.1 | 0% | 0 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -59.7 | -50.7 | 179.2 | 0 | 0 | 0 | 0 | 0 | 112.5 | L242 Q243 T248 L249 L250 G257 I260 L261 | L242-A246 VanDerWaalsContact O-CB 3.3Å; L242-A246 WeakPolarHBondContact O-CB 3.39Å; L242-A246 PolarHBondContact O-N 3.46Å; Q243-A246 PolarHBondContact O-N 3.22Å; A246-T248 VanDerWaalsContact C-N 3.34Å; A246-T248 PolarHBondContact O-N 2.78Å; A246-L249 WeakPolarHBondContact O-CB 3.34Å; A246-L249 PolarHBondContact O-N 2.91Å; A246-L250 WeakPolarHBondContact O-CG 3.46Å; A246-L250 PolarHBondContact O-N 3.44Å; A246-G257 WeakPolarHBondContact CB-O 3.46Å; A246-I260 HydrophobicContact CB-CB 4.14Å; A246-I260 HydrophobicContact CB-CG2 3.98Å; A246-L261 HydrophobicContact CB-CB 3.85Å; A246-L261 HydrophobicContact CB-CD1 4.32Å |
| 247 | S | 95.2 | Very high | 94.2 | Very high | 0 Ų | 0 | 39.1 Ų | 39.1 | 0% | 0 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -66.1 | -35.6 | 179.6 | -65.8 | 0 | 0 | 0 | 0 | 112.8 | L195 Q243 L249 L250 L251 | L195-S247 VanDerWaalsContact CD2-OG 3.28Å; L195-S247 WeakPolarHBondContact CD2-OG 3.24Å; L195-S247 VanDerWaalsContact CG-OG 3.24Å; L195-S247 WeakPolarHBondContact CG-OG 3.28Å; Q243-S247 WeakPolarHBondContact O-CB 3.25Å; Q243-S247 PolarHBondContact O-N 3.32Å; Q243-S247 PolarHBondContact O-OG 3.41Å; S247-L249 VanDerWaalsContact C-N 3.34Å; S247-L250 PolarHBondContact O-N 2.85Å; S247-L251 WeakPolarHBondContact O-CG 3.23Å; S247-L251 PolarHBondContact O-N 3.48Å |
| 248 | T | 95.8 | Very high | 93.8 | Very high | 56 Ų | 56 | 35.8 Ų | 35.8 | 34% | 0.344 | 21% | 0.214 | S | C | . | . | H | α-helix | trans | -61.5 | -44.6 | 173.4 | -57.4 | 0 | 0 | 0 | 0 | 110.4 | L196 V244 I245 A246 L250 L251 L252 | L196-T248 WeakPolarHBondContact CD1-OG1 3.34Å; V244-T248 VanDerWaalsContact O-CB 3.3Å; V244-T248 WeakPolarHBondContact O-CB 3.32Å; V244-T248 PolarHBondContact O-N 2.86Å; V244-T248 PolarHBondContact O-OG1 3.38Å; I245-T248 PolarHBondContact O-N 2.94Å; A246-T248 VanDerWaalsContact C-N 3.34Å; A246-T248 PolarHBondContact O-N 2.78Å; T248-L250 VanDerWaalsContact C-N 3.34Å; T248-L250 PolarHBondContact O-N 2.84Å; T248-L251 PolarHBondContact O-N 2.92Å; T248-L252 HydrophobicContact CG2-CD1 4.24Å; T248-L252 WeakPolarHBondContact O-CG 3.14Å; T248-L252 PolarHBondContact O-N 3.47Å |
| 249 | L | 94.1 | Very high | 93.5 | Very high | 41 Ų | 41 | 35.7 Ų | 35.7 | 22% | 0.215 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -62.2 | -40 | 175.9 | -73 | 169.9 | 0 | 0 | 0 | 112.4 | I245 A246 S247 L252 A253 N254 I260 | I245-L249 HydrophobicContact CG2-CD1 4.17Å; I245-L249 WeakPolarHBondContact O-CG 3.42Å; I245-L249 PolarHBondContact O-N 3.49Å; A246-L249 WeakPolarHBondContact O-CB 3.34Å; A246-L249 PolarHBondContact O-N 2.91Å; S247-L249 VanDerWaalsContact C-N 3.34Å; L249-L252 CarbonylContact O-C 3.52Å; L249-L252 PolarHBondContact O-N 3.04Å; L249-A253 PolarHBondContact O-N 3.24Å; L249-N254 HydrophobicContact CB-CB 4.3Å; L249-N254 HydrophobicContact CD2-CB 4.24Å; L249-N254 WeakPolarHBondContact O-CB 3.45Å; L249-N254 PolarHBondContact O-N 3.47Å; L249-I260 HydrophobicContact CD1-CD1 3.43Å; L249-I260 VanDerWaalsContact CD1-CD1 3.43Å |
| 250 | L | 91.6 | Very high | 93.4 | Very high | 2 Ų | 2 | 37.6 Ų | 37.6 | 1% | 0.01 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -63.4 | -40.8 | 175.7 | -67.1 | 174.1 | 0 | 0 | 0 | 112.3 | Y176 F177 A246 S247 T248 L252 A253 L258 | Y176-L250 HydrophobicContact CD1-CD2 4.44Å; Y176-L250 HydrophobicContact CD2-CD2 4.45Å; Y176-L250 WeakPolarHBondContact CE2-O 3.35Å; Y176-L250 HydrophobicContact CG-CD2 4.16Å; F177-L250 HydrophobicContact CE2-CD1 4.17Å; F177-L250 HydrophobicContact CZ-CD1 3.93Å; A246-L250 WeakPolarHBondContact O-CG 3.46Å; A246-L250 PolarHBondContact O-N 3.44Å; S247-L250 PolarHBondContact O-N 2.85Å; T248-L250 VanDerWaalsContact C-N 3.34Å; T248-L250 PolarHBondContact O-N 2.84Å; L250-L252 VanDerWaalsContact C-N 3.29Å; L250-L252 PolarHBondContact O-N 3.36Å; L250-A253 PolarHBondContact O-N 3.46Å; L250-L258 HydrophobicContact CD1-CD2 4.43Å; L250-L258 HydrophobicContact CD2-CD2 4.34Å; L250-L258 HydrophobicContact CD2-CG 3.91Å |
| 251 | L | 91.7 | Very high | 93.2 | Very high | 79 Ų | 79 | 37.3 Ų | 37.3 | 41% | 0.414 | 22% | 0.218 | S | C | . | . | H | α-helix | trans | -68 | -29.1 | 175.7 | -71.2 | 168.7 | 0 | 0 | 0 | 112.7 | L193 L196 S247 T248 A253 | L193-L251 HydrophobicContact CB-CD2 4.33Å; L193-L251 HydrophobicContact CD1-CD1 4.25Å; L196-L251 HydrophobicContact CB-CD1 4.25Å; L196-L251 HydrophobicContact CD2-CD1 3.49Å; L196-L251 VanDerWaalsContact CD2-CD1 3.49Å; L196-L251 HydrophobicContact CG-CD1 4.46Å; S247-L251 WeakPolarHBondContact O-CG 3.23Å; S247-L251 PolarHBondContact O-N 3.48Å; T248-L251 PolarHBondContact O-N 2.92Å; L251-A253 PolarHBondContact O-N 2.82Å |
| 252 | L | 92.8 | Very high | 93 | Very high | 126 Ų | 126 | 36.8 Ų | 36.8 | 66% | 0.66 | 21% | 0.212 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -81.3 | 12.1 | 171.1 | -64.8 | 177 | 0 | 0 | 0 | 113.4 | T248 L249 L250 N254 | T248-L252 HydrophobicContact CG2-CD1 4.24Å; T248-L252 WeakPolarHBondContact O-CG 3.14Å; T248-L252 PolarHBondContact O-N 3.47Å; L249-L252 CarbonylContact O-C 3.52Å; L249-L252 PolarHBondContact O-N 3.04Å; L250-L252 VanDerWaalsContact C-N 3.29Å; L250-L252 PolarHBondContact O-N 3.36Å; L252-N254 PolarHBondContact O-N 2.93Å |
| 253 | A | 87.6 | Confident | 92.8 | Very high | 50 Ų | 50 | 38.7 Ų | 38.7 | 41% | 0.413 | 22% | 0.221 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 57.8 | 29.5 | -177.9 | 0 | 0 | 0 | 0 | 0 | 115.5 | Y176 L249 L250 L251 | Y176-A253 WeakPolarHBondContact OH-CA 3.47Å; Y176-A253 WeakPolarHBondContact OH-CB 3.39Å; L249-A253 PolarHBondContact O-N 3.24Å; L250-A253 PolarHBondContact O-N 3.46Å; L251-A253 PolarHBondContact O-N 2.82Å |
| 254 | N | 88.1 | Confident | 92.8 | Very high | 57 Ų | 57 | 38.1 Ų | 38.1 | 31% | 0.305 | 22% | 0.218 | S | C | . | . | trans | -97.7 | 113.5 | 172.1 | -170.5 | -28.1 | 0 | 0 | 0 | 110.4 | L249 L252 S256 G257 | L249-N254 HydrophobicContact CB-CB 4.3Å; L249-N254 HydrophobicContact CD2-CB 4.24Å; L249-N254 WeakPolarHBondContact O-CB 3.45Å; L249-N254 PolarHBondContact O-N 3.47Å; L252-N254 PolarHBondContact O-N 2.93Å; N254-S256 PolarHBondContact O-N 3.42Å; N254-S256 WeakPolarHBondContact OD1-CB 3.16Å; N254-S256 PolarHBondContact OD1-N 3.02Å; N254-S256 PolarHBondContact OD1-OG 3.44Å; N254-G257 PolarHBondContact O-N 3.44Å | ||
| 255 | P | 84.1 | Confident | 92.7 | Very high | 1 Ų | 1 | 36.6 Ų | 36.6 | 1% | 0.006 | 21% | 0.209 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -68.1 | -17.1 | -176.6 | 30.4 | -38.4 | 0 | 0 | 0 | 114.5 | S24 V25 G257 L258 | S24-P255 VanDerWaalsContact OG-CG 3.23Å; S24-P255 WeakPolarHBondContact OG-CG 3.21Å; V25-P255 HydrophobicContact CB-CB 4.03Å; V25-P255 HydrophobicContact CG2-CB 3.29Å; V25-P255 HydrophobicContact CG2-CG 3.81Å; P255-G257 PolarHBondContact O-N 3.17Å; P255-L258 PolarHBondContact O-N 2.71Å |
| 256 | S | 89.6 | Confident | 92.6 | Very high | 47 Ų | 47 | 35.7 Ų | 35.7 | 33% | 0.329 | 20% | 0.2 | S | C | . | . | H | α-helix | trans | -57.5 | -22.1 | 174.8 | -49.6 | 0 | 0 | 0 | 0 | 112.4 | N254 L258 C259 I260 | N254-S256 PolarHBondContact O-N 3.42Å; N254-S256 WeakPolarHBondContact OD1-CB 3.16Å; N254-S256 PolarHBondContact OD1-N 3.02Å; N254-S256 PolarHBondContact OD1-OG 3.44Å; S256-L258 PolarHBondContact O-N 2.96Å; S256-C259 WeakPolarHBondContact O-CB 3.09Å; S256-C259 PolarHBondContact O-N 3.36Å; S256-C259 VanDerWaalsContact O-N 3.15Å; S256-I260 PolarHBondContact O-N 3.07Å; S256-I260 VanDerWaalsContact O-N 3.15Å |
| 257 | G | 91.4 | Very high | 92.6 | Very high | 0 Ų | 0 | 38.3 Ų | 38.3 | 0% | 0 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -55.7 | -35.5 | 173.4 | 0 | 0 | 0 | 0 | 0 | 113.2 | A246 N254 P255 I260 L261 | A246-G257 WeakPolarHBondContact CB-O 3.46Å; N254-G257 PolarHBondContact O-N 3.44Å; P255-G257 PolarHBondContact O-N 3.17Å; G257-I260 PolarHBondContact O-N 2.97Å; G257-L261 VanDerWaalsContact O-CB 3.28Å; G257-L261 WeakPolarHBondContact O-CB 3.39Å; G257-L261 PolarHBondContact O-N 3.46Å |
| 258 | L | 90.4 | Very high | 92.7 | Very high | 1 Ų | 1 | 38.6 Ų | 38.6 | 1% | 0.005 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -64 | -42.2 | 176.6 | -76.4 | 175.4 | 0 | 0 | 0 | 111.9 | C28 F32 F177 L250 P255 S256 L261 A262 | C28-L258 HydrophobicContact CB-CB 3.76Å; F32-L258 HydrophobicContact CE2-CB 4.46Å; F177-L258 HydrophobicContact CD1-CD2 4.12Å; F177-L258 HydrophobicContact CE1-CD2 3.57Å; F177-L258 HydrophobicContact CZ-CD2 3.83Å; L250-L258 HydrophobicContact CD1-CD2 4.43Å; L250-L258 HydrophobicContact CD2-CD2 4.34Å; L250-L258 HydrophobicContact CD2-CG 3.91Å; P255-L258 PolarHBondContact O-N 2.71Å; S256-L258 PolarHBondContact O-N 2.96Å; L258-L261 PolarHBondContact O-N 2.96Å; L258-A262 PolarHBondContact O-N 3.29Å; L258-A262 VanDerWaalsContact O-N 3.14Å |
| 259 | C | 91.5 | Very high | 92.7 | Very high | 48 Ų | 48 | 36 Ų | 36 | 32% | 0.324 | 20% | 0.198 | S | C | . | . | H | α-helix | trans | -62.8 | -45.1 | 176.7 | -80.2 | 0 | 0 | 0 | 0 | 111.3 | C28 S256 L261 A262 | C28-C259 WeakPolarHBondContact CA-SG 3.39Å; C28-C259 HydrophobicContact CB-CB 4.02Å; C28-C259 WeakPolarHBondContact CB-SG 3.49Å; C28-C259 WeakPolarHBondContact SG-CB 3.41Å; C28-C259 CovalentContact SG-SG 2.03Å; C28-C259 PolarHBondContact SG-SG 3.23Å; S256-C259 WeakPolarHBondContact O-CB 3.09Å; S256-C259 PolarHBondContact O-N 3.36Å; S256-C259 VanDerWaalsContact O-N 3.15Å; C259-L261 VanDerWaalsContact C-N 3.29Å; C259-L261 PolarHBondContact O-N 2.95Å; C259-A262 WeakPolarHBondContact O-CB 3.49Å; C259-A262 PolarHBondContact O-N 2.96Å |
| 260 | I | 94.1 | Very high | 92.8 | Very high | 49 Ų | 49 | 34.4 Ų | 34.4 | 25% | 0.251 | 19% | 0.19 | S | C | . | . | H | α-helix | trans | -64.8 | -38.5 | 178.3 | -64.6 | 167.2 | 0 | 0 | 0 | 110.2 | L242 A246 L249 S256 G257 A262 I263 P264 | L242-I260 HydrophobicContact CD2-CG2 4.42Å; A246-I260 HydrophobicContact CB-CB 4.14Å; A246-I260 HydrophobicContact CB-CG2 3.98Å; L249-I260 HydrophobicContact CD1-CD1 3.43Å; L249-I260 VanDerWaalsContact CD1-CD1 3.43Å; S256-I260 PolarHBondContact O-N 3.07Å; S256-I260 VanDerWaalsContact O-N 3.15Å; G257-I260 PolarHBondContact O-N 2.97Å; I260-A262 VanDerWaalsContact C-N 3.31Å; I260-A262 PolarHBondContact O-N 3.35Å; I260-I263 PolarHBondContact O-N 3.39Å; I260-P264 WeakPolarHBondContact O-CD 3.36Å |
| 261 | L | 94.4 | Very high | 93 | Very high | 0 Ų | 0 | 36.6 Ų | 36.6 | 0% | 0 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -64.3 | -32.1 | 179.5 | -174.8 | 58.8 | 0 | 0 | 0 | 113.2 | F177 L195 Q243 A246 G257 L258 C259 I263 P264 L265 | F177-L261 HydrophobicContact CE1-CD2 4.22Å; F177-L261 HydrophobicContact CZ-CD2 4.09Å; L195-L261 HydrophobicContact CD2-CD1 3.8Å; L195-L261 HydrophobicContact CD2-CD2 3.77Å; L195-L261 HydrophobicContact CD2-CG 4.46Å; Q243-L261 HydrophobicContact CG-CD1 4.02Å; A246-L261 HydrophobicContact CB-CB 3.85Å; A246-L261 HydrophobicContact CB-CD1 4.32Å; G257-L261 VanDerWaalsContact O-CB 3.28Å; G257-L261 WeakPolarHBondContact O-CB 3.39Å; G257-L261 PolarHBondContact O-N 3.46Å; L258-L261 PolarHBondContact O-N 2.96Å; C259-L261 VanDerWaalsContact C-N 3.29Å; C259-L261 PolarHBondContact O-N 2.95Å; L261-I263 VanDerWaalsContact C-N 3.28Å; L261-I263 PolarHBondContact O-N 3.42Å; L261-P264 WeakPolarHBondContact O-CD 3.12Å; L261-P264 WeakPolarHBondContact O-CG 3.3Å; L261-L265 HydrophobicContact CD1-CD1 4.11Å; L261-L265 HydrophobicContact CD1-CD2 4.41Å; L261-L265 HydrophobicContact CD1-CG 3.96Å; L261-L265 HydrophobicContact CD2-CD1 4.13Å; L261-L265 HydrophobicContact CG-CD1 3.66Å; L261-L265 HydrophobicContact CG-CG 4.01Å; L261-L265 WeakPolarHBondContact O-CB 3.37Å; L261-L265 VanDerWaalsContact O-CG 3.24Å; L261-L265 WeakPolarHBondContact O-CG 3.36Å; L261-L265 PolarHBondContact O-N 3.46Å |
| 262 | A | 93.4 | Very high | 93.2 | Very high | 9 Ų | 9 | 32.8 Ų | 32.8 | 7% | 0.074 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -57.9 | -40.3 | 179.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | V31 F32 W44 L258 C259 I260 L265 Y266 | V31-A262 HydrophobicContact CG1-CB 4.02Å; F32-A262 HydrophobicContact CE1-CB 4.37Å; F32-A262 HydrophobicContact CE2-CB 4.24Å; F32-A262 HydrophobicContact CZ-CB 3.72Å; W44-A262 HydrophobicContact CH2-CB 4.16Å; W44-A262 WeakPolarHBondContact CH2-O 3.32Å; W44-A262 HydrophobicContact CZ3-CB 4.22Å; L258-A262 PolarHBondContact O-N 3.29Å; L258-A262 VanDerWaalsContact O-N 3.14Å; C259-A262 WeakPolarHBondContact O-CB 3.49Å; C259-A262 PolarHBondContact O-N 2.96Å; I260-A262 VanDerWaalsContact C-N 3.31Å; I260-A262 PolarHBondContact O-N 3.35Å; A262-L265 PolarHBondContact O-N 3.44Å; A262-Y266 VanDerWaalsContact O-CB 3.3Å; A262-Y266 WeakPolarHBondContact O-CB 3.49Å; A262-Y266 PolarHBondContact O-N 2.85Å |
| 263 | I | 95.1 | Very high | 93.3 | Very high | 104 Ų | 104 | 26.9 Ų | 26.9 | 53% | 0.533 | 15% | 0.154 | S | C | . | . | H | α-helix | trans | -61.8 | -59 | -176.9 | -57.5 | 171.5 | 0 | 0 | 0 | 112.2 | I260 L261 L265 Y266 M267 | I260-I263 PolarHBondContact O-N 3.39Å; L261-I263 VanDerWaalsContact C-N 3.28Å; L261-I263 PolarHBondContact O-N 3.42Å; I263-L265 VanDerWaalsContact C-N 3.3Å; I263-L265 PolarHBondContact O-N 2.73Å; I263-Y266 PolarHBondContact O-N 2.77Å; I263-M267 WeakPolarHBondContact O-CB 3.27Å; I263-M267 VanDerWaalsContact O-CG 3.3Å; I263-M267 WeakPolarHBondContact O-CG 3.21Å; I263-M267 PolarHBondContact O-N 2.71Å |
| 264 | P | 97 | Very high | 93.7 | Very high | 0 Ų | 0 | 25.9 Ų | 25.9 | 0% | 0 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -66.6 | -30.8 | -179.4 | 28.8 | -36 | 0 | 0 | 0 | 112.8 | L239 L242 Q243 I260 L261 Y268 | L239-P264 HydrophobicContact CB-CB 4.11Å; L239-P264 HydrophobicContact CD2-CB 4.21Å; L239-P264 WeakPolarHBondContact O-CB 3.16Å; L242-P264 HydrophobicContact CB-CB 4.16Å; L242-P264 HydrophobicContact CB-CG 3.94Å; Q243-P264 HydrophobicContact CG-CB 3.95Å; Q243-P264 HydrophobicContact CG-CG 3.76Å; I260-P264 WeakPolarHBondContact O-CD 3.36Å; L261-P264 WeakPolarHBondContact O-CD 3.12Å; L261-P264 WeakPolarHBondContact O-CG 3.3Å; P264-Y268 WeakPolarHBondContact O-CB 3.13Å; P264-Y268 PolarHBondContact O-N 2.61Å |
| 265 | L | 95.4 | Very high | 94 | Very high | 5 Ų | 5 | 23.9 Ų | 23.9 | 3% | 0.026 | 14% | 0.136 | C | C | . | . | H | α-helix | trans | -64.9 | -48.9 | 173.8 | -71 | -178 | 0 | 0 | 0 | 111.4 | F32 W44 H189 L261 A262 I263 M267 Y268 Y269 | F32-L265 HydrophobicContact CE1-CD1 4.29Å; W44-L265 HydrophobicContact CZ2-CB 4.26Å; H189-L265 VanDerWaalsContact CE1-CD2 3.47Å; H189-L265 WeakPolarHBondContact CE1-CD2 3.49Å; H189-L265 VanDerWaalsContact NE2-CD1 3.33Å; H189-L265 WeakPolarHBondContact NE2-CD1 3.44Å; L261-L265 HydrophobicContact CD1-CD1 4.11Å; L261-L265 HydrophobicContact CD1-CD2 4.41Å; L261-L265 HydrophobicContact CD1-CG 3.96Å; L261-L265 HydrophobicContact CD2-CD1 4.13Å; L261-L265 HydrophobicContact CG-CD1 3.66Å; L261-L265 HydrophobicContact CG-CG 4.01Å; L261-L265 WeakPolarHBondContact O-CB 3.37Å; L261-L265 VanDerWaalsContact O-CG 3.24Å; L261-L265 WeakPolarHBondContact O-CG 3.36Å; L261-L265 PolarHBondContact O-N 3.46Å; A262-L265 PolarHBondContact O-N 3.44Å; I263-L265 VanDerWaalsContact C-N 3.3Å; I263-L265 PolarHBondContact O-N 2.73Å; L265-M267 VanDerWaalsContact C-N 3.34Å; L265-M267 PolarHBondContact O-N 2.89Å; L265-Y268 PolarHBondContact O-N 2.92Å; L265-Y269 HydrophobicContact CB-CD2 4.32Å; L265-Y269 HydrophobicContact CB-CE2 4.26Å; L265-Y269 HydrophobicContact CD2-CE2 4.04Å; L265-Y269 WeakPolarHBondContact O-CD2 3.27Å; L265-Y269 PolarHBondContact O-N 2.94Å |
| 266 | Y | 95.7 | Very high | 94.4 | Very high | 74 Ų | 74 | 23.9 Ų | 23.9 | 29% | 0.29 | 14% | 0.136 | S | C | . | . | H | α-helix | trans | -57.1 | -49.5 | 176.5 | 176.4 | -102 | 0 | 0 | 0 | 111.1 | I47 I48 A262 I263 Y268 Y269 T270 | I47-Y266 HydrophobicContact CB-CE2 4.16Å; I47-Y266 HydrophobicContact CD1-CD2 3.91Å; I47-Y266 HydrophobicContact CD1-CE2 3.97Å; I47-Y266 HydrophobicContact CG1-CD2 4.23Å; I47-Y266 HydrophobicContact CG1-CE2 3.98Å; I48-Y266 HydrophobicContact CG1-CD2 4.17Å; I48-Y266 HydrophobicContact CG1-CE2 4.49Å; A262-Y266 VanDerWaalsContact O-CB 3.3Å; A262-Y266 WeakPolarHBondContact O-CB 3.49Å; A262-Y266 PolarHBondContact O-N 2.85Å; I263-Y266 PolarHBondContact O-N 2.77Å; Y266-Y268 VanDerWaalsContact C-N 3.34Å; Y266-Y268 PolarHBondContact O-N 3.48Å; Y266-Y269 PolarHBondContact O-N 3.28Å; Y266-T270 HydrophobicContact CD2-CG2 4.01Å; Y266-T270 HydrophobicContact CE2-CG2 3.66Å; Y266-T270 WeakPolarHBondContact O-CB 3.4Å; Y266-T270 WeakPolarHBondContact O-CG2 3.42Å; Y266-T270 PolarHBondContact O-N 3.01Å; Y266-T270 PolarHBondContact O-OG1 3.48Å |
| 267 | M | 96.9 | Very high | 94.5 | Very high | 56 Ų | 56 | 22.2 Ų | 22.2 | 28% | 0.276 | 12% | 0.123 | S | C | . | . | H | α-helix | trans | -63.2 | -39.5 | 179.8 | -68.7 | -58.5 | -67.3 | 0 | 0 | 112.1 | F235 L239 I263 L265 C271 | F235-M267 HydrophobicContact CE2-CE 3.86Å; F235-M267 HydrophobicContact CZ-CB 4.2Å; F235-M267 HydrophobicContact CZ-CE 3.84Å; L239-M267 HydrophobicContact CD1-CB 3.93Å; L239-M267 HydrophobicContact CD2-CB 3.8Å; L239-M267 HydrophobicContact CD2-CG 4.37Å; I263-M267 WeakPolarHBondContact O-CB 3.27Å; I263-M267 VanDerWaalsContact O-CG 3.3Å; I263-M267 WeakPolarHBondContact O-CG 3.21Å; I263-M267 PolarHBondContact O-N 2.71Å; L265-M267 VanDerWaalsContact C-N 3.34Å; L265-M267 PolarHBondContact O-N 2.89Å; M267-C271 HydrophobicContact CE-CB 4.38Å; M267-C271 WeakPolarHBondContact O-CA 3.29Å; M267-C271 VanDerWaalsContact O-CB 3.23Å; M267-C271 WeakPolarHBondContact O-CB 3.48Å; M267-C271 PolarHBondContact O-N 3.44Å |
| 268 | Y | 96.8 | Very high | 94.5 | Very high | 5 Ų | 5 | 26.7 Ų | 26.7 | 2% | 0.02 | 15% | 0.146 | C | C | . | . | H | α-helix | trans | -63.9 | -53.2 | 175.5 | -176 | -99.3 | 0 | 0 | 0 | 110.8 | L124 E128 L236 Y240 P264 L265 Y266 T270 F272 | L124-Y268 HydrophobicContact CB-CE1 4.05Å; L124-Y268 HydrophobicContact CD1-CD1 4.38Å; L124-Y268 HydrophobicContact CD1-CE1 3.89Å; E128-Y268 WeakPolarHBondContact OE2-CE2 3.38Å; E128-Y268 PolarHBondContact OE2-OH 2.92Å; L236-Y268 HydrophobicContact CD2-CD2 4.4Å; Y240-Y268 WeakPolarHBondContact OH-CE2 3.39Å; P264-Y268 WeakPolarHBondContact O-CB 3.13Å; P264-Y268 PolarHBondContact O-N 2.61Å; L265-Y268 PolarHBondContact O-N 2.92Å; Y266-Y268 VanDerWaalsContact C-N 3.34Å; Y266-Y268 PolarHBondContact O-N 3.48Å; Y268-T270 PolarHBondContact O-N 3.32Å; Y268-F272 HydrophobicContact CD2-CB 4.27Å; Y268-F272 HydrophobicContact CD2-CD2 4.28Å; Y268-F272 HydrophobicContact CD2-CG 4.4Å; Y268-F272 HydrophobicContact CE2-CB 4.48Å; Y268-F272 AromaticContact CE2-CD2 3.87Å; Y268-F272 HydrophobicContact CE2-CD2 3.87Å; Y268-F272 HydrophobicContact CE2-CE2 4.26Å; Y268-F272 HydrophobicContact CE2-CG 4.13Å; Y268-F272 WeakPolarHBondContact O-CB 3.4Å; Y268-F272 PolarHBondContact O-N 3.06Å |
| 269 | Y | 95.5 | Very high | 94.4 | Very high | 3 Ų | 3 | 27.7 Ų | 27.7 | 1% | 0.012 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -70 | -14.3 | -176.7 | -68.7 | -56.7 | 0 | 0 | 0 | 114.9 | I48 N52 N92 W117 L120 Q121 L124 H189 L265 Y266 | I48-Y269 HydrophobicContact CD1-CD2 4.42Å; N52-Y269 PolarHBondContact ND2-O 3.35Å; N92-Y269 PolarHBondContact ND2-O 2.87Å; W117-Y269 HydrophobicContact CE3-CE1 4.5Å; W117-Y269 HydrophobicContact CE3-CE2 4.39Å; W117-Y269 HydrophobicContact CH2-CD2 4.25Å; W117-Y269 HydrophobicContact CH2-CE2 4.17Å; W117-Y269 HydrophobicContact CZ3-CD1 4.28Å; W117-Y269 AromaticContact CZ3-CD2 3.89Å; W117-Y269 HydrophobicContact CZ3-CD2 3.89Å; W117-Y269 AromaticContact CZ3-CE1 3.95Å; W117-Y269 HydrophobicContact CZ3-CE1 3.95Å; W117-Y269 AromaticContact CZ3-CE2 3.5Å; W117-Y269 HydrophobicContact CZ3-CE2 3.5Å; W117-Y269 VanDerWaalsContact CZ3-CE2 3.5Å; W117-Y269 HydrophobicContact CZ3-CG 4.28Å; W117-Y269 AromaticContact CZ3-CZ 3.56Å; L120-Y269 HydrophobicContact CD2-CD1 3.8Å; L120-Y269 HydrophobicContact CD2-CE1 3.91Å; L120-Y269 HydrophobicContact CG-CE1 4.37Å; Q121-Y269 PolarHBondContact OE1-OH 3.25Å; L124-Y269 HydrophobicContact CD1-CD1 3.48Å; L124-Y269 VanDerWaalsContact CD1-CD1 3.48Å; L124-Y269 HydrophobicContact CD1-CE1 3.68Å; H189-Y269 PolarHBondContact CE1-OH 3.01Å; L265-Y269 HydrophobicContact CB-CD2 4.32Å; L265-Y269 HydrophobicContact CB-CE2 4.26Å; L265-Y269 HydrophobicContact CD2-CE2 4.04Å; L265-Y269 WeakPolarHBondContact O-CD2 3.27Å; L265-Y269 PolarHBondContact O-N 2.94Å; Y266-Y269 PolarHBondContact O-N 3.28Å |
| 270 | T | 95.9 | Very high | 94.1 | Very high | 7 Ų | 7 | 26.5 Ų | 26.5 | 4% | 0.043 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -110.9 | -41.5 | -179.8 | 59.8 | 0 | 0 | 0 | 0 | 113.1 | I48 P51 Y266 Y268 P274 | I48-T270 HydrophobicContact CB-CG2 4.46Å; I48-T270 HydrophobicContact CG1-CG2 4.28Å; I48-T270 HydrophobicContact CG2-CG2 4.43Å; P51-T270 HydrophobicContact CG-CG2 3.56Å; Y266-T270 HydrophobicContact CD2-CG2 4.01Å; Y266-T270 HydrophobicContact CE2-CG2 3.66Å; Y266-T270 WeakPolarHBondContact O-CB 3.4Å; Y266-T270 WeakPolarHBondContact O-CG2 3.42Å; Y266-T270 PolarHBondContact O-N 3.01Å; Y266-T270 PolarHBondContact O-OG1 3.48Å; Y268-T270 PolarHBondContact O-N 3.32Å; T270-P274 VanDerWaalsContact O-CD 3.26Å; T270-P274 WeakPolarHBondContact O-CD 3.16Å; T270-P274 VanDerWaalsContact O-CG 3.3Å; T270-P274 WeakPolarHBondContact O-CG 3.47Å |
| 271 | C | 95.9 | Very high | 93.7 | Very high | 47 Ų | 47 | 24.4 Ų | 24.4 | 32% | 0.318 | 13% | 0.131 | S | C | . | . | H | α-helix | trans | -100.7 | -16.5 | -172.5 | -59.9 | 0 | 0 | 0 | 0 | 114.1 | F235 M267 G275 | F235-C271 HydrophobicContact CZ-CB 4.29Å; M267-C271 HydrophobicContact CE-CB 4.38Å; M267-C271 WeakPolarHBondContact O-CA 3.29Å; M267-C271 VanDerWaalsContact O-CB 3.23Å; M267-C271 WeakPolarHBondContact O-CB 3.48Å; M267-C271 PolarHBondContact O-N 3.44Å; C271-G275 PolarHBondContact O-N 2.98Å |
| 272 | F | 95.8 | Very high | 93.1 | Very high | 0 Ų | 0 | 31.4 Ų | 31.4 | 0% | 0 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -58.8 | -56.6 | -178 | 172.1 | -103.8 | 0 | 0 | 0 | 112.4 | L124 L127 E128 Y232 L236 Y268 G275 V276 | L124-F272 HydrophobicContact CB-CE1 4.42Å; L124-F272 HydrophobicContact CD2-CD1 3.99Å; L124-F272 HydrophobicContact CD2-CE1 4.27Å; L127-F272 HydrophobicContact CB-CE1 4.13Å; L127-F272 HydrophobicContact CB-CZ 4.42Å; L127-F272 HydrophobicContact CD2-CE1 3.77Å; L127-F272 HydrophobicContact CD2-CZ 4.46Å; L127-F272 HydrophobicContact CG-CE1 3.89Å; L127-F272 HydrophobicContact CG-CZ 4.15Å; E128-F272 HydrophobicContact CB-CE2 3.95Å; E128-F272 HydrophobicContact CB-CZ 3.59Å; E128-F272 HydrophobicContact CG-CE2 3.92Å; E128-F272 HydrophobicContact CG-CZ 4.09Å; Y232-F272 VanDerWaalsContact OH-CD2 3.32Å; Y232-F272 WeakPolarHBondContact OH-CD2 3.47Å; Y232-F272 WeakPolarHBondContact OH-CE2 3.48Å; L236-F272 HydrophobicContact CD1-CD2 4.41Å; L236-F272 HydrophobicContact CD1-CE2 4.26Å; L236-F272 HydrophobicContact CD2-CD2 4.14Å; Y268-F272 HydrophobicContact CD2-CB 4.27Å; Y268-F272 HydrophobicContact CD2-CD2 4.28Å; Y268-F272 HydrophobicContact CD2-CG 4.4Å; Y268-F272 HydrophobicContact CE2-CB 4.48Å; Y268-F272 AromaticContact CE2-CD2 3.87Å; Y268-F272 HydrophobicContact CE2-CD2 3.87Å; Y268-F272 HydrophobicContact CE2-CE2 4.26Å; Y268-F272 HydrophobicContact CE2-CG 4.13Å; Y268-F272 WeakPolarHBondContact O-CB 3.4Å; Y268-F272 PolarHBondContact O-N 3.06Å; F272-G275 WeakPolarHBondContact O-CA 3.41Å; F272-G275 PolarHBondContact O-N 3.04Å; F272-G275 VanDerWaalsContact O-N 3.1Å; F272-V276 HydrophobicContact CE1-CG2 4.42Å; F272-V276 HydrophobicContact CE2-CG2 4.36Å; F272-V276 HydrophobicContact CZ-CG2 4.18Å; F272-V276 WeakPolarHBondContact O-CG2 3.38Å; F272-V276 PolarHBondContact O-N 3.06Å |
| 273 | V | 95.6 | Very high | 92.2 | Very high | 2 Ų | 2 | 32.1 Ų | 32.1 | 1% | 0.012 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -64.9 | -45.4 | -176.9 | -172.3 | 0 | 0 | 0 | 0 | 111.7 | F55 V85 A89 L124 L127 G275 V276 Y277 | F55-V273 HydrophobicContact CD1-CG1 4.5Å; F55-V273 HydrophobicContact CE1-CB 4.33Å; F55-V273 HydrophobicContact CE1-CG1 3.7Å; F55-V273 HydrophobicContact CZ-CG1 4.45Å; V85-V273 HydrophobicContact CB-CG1 4.34Å; V85-V273 HydrophobicContact CG1-CG1 3.81Å; V85-V273 HydrophobicContact CG2-CG1 4.47Å; A89-V273 HydrophobicContact CB-CG1 4.41Å; L124-V273 HydrophobicContact CD2-CG2 3.53Å; L127-V273 HydrophobicContact CD2-CG1 4.48Å; L127-V273 HydrophobicContact CD2-CG2 4.44Å; V273-G275 VanDerWaalsContact C-N 3.27Å; V273-G275 PolarHBondContact O-N 3.33Å; V273-V276 PolarHBondContact O-N 2.82Å; V273-Y277 PolarHBondContact O-N 3.23Å |
| 274 | P | 95 | Very high | 91.1 | Very high | 29 Ų | 29 | 28.2 Ų | 28.2 | 19% | 0.188 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -57.3 | -38.7 | 169.8 | -26.2 | 35 | 0 | 0 | 0 | 113.3 | F55 T270 V276 Y277 L278 | F55-P274 HydrophobicContact CB-CG 4.39Å; F55-P274 HydrophobicContact CD1-CG 4.06Å; F55-P274 HydrophobicContact CD2-CB 4.06Å; F55-P274 HydrophobicContact CD2-CG 3.88Å; F55-P274 HydrophobicContact CE1-CG 4.33Å; F55-P274 HydrophobicContact CE2-CB 4Å; F55-P274 HydrophobicContact CE2-CG 4.15Å; F55-P274 HydrophobicContact CG-CG 3.83Å; F55-P274 HydrophobicContact CZ-CB 4.39Å; F55-P274 HydrophobicContact CZ-CG 4.37Å; T270-P274 VanDerWaalsContact O-CD 3.26Å; T270-P274 WeakPolarHBondContact O-CD 3.16Å; T270-P274 VanDerWaalsContact O-CG 3.3Å; T270-P274 WeakPolarHBondContact O-CG 3.47Å; P274-V276 PolarHBondContact O-N 2.98Å; P274-Y277 WeakPolarHBondContact O-CB 3.29Å; P274-Y277 PolarHBondContact O-N 3.27Å; P274-L278 WeakPolarHBondContact O-CB 3.47Å; P274-L278 VanDerWaalsContact O-CG 3.29Å; P274-L278 WeakPolarHBondContact O-CG 3.46Å; P274-L278 PolarHBondContact O-N 3.39Å |
| 275 | G | 93.9 | Very high | 89.7 | Confident | 15 Ų | 15 | 29 Ų | 29 | 16% | 0.155 | 15% | 0.149 | C | C | . | . | H | α-helix | trans | -59.4 | -43.9 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | C271 F272 V273 L278 T279 | C271-G275 PolarHBondContact O-N 2.98Å; F272-G275 WeakPolarHBondContact O-CA 3.41Å; F272-G275 PolarHBondContact O-N 3.04Å; F272-G275 VanDerWaalsContact O-N 3.1Å; V273-G275 VanDerWaalsContact C-N 3.27Å; V273-G275 PolarHBondContact O-N 3.33Å; G275-L278 PolarHBondContact O-N 3.41Å; G275-T279 WeakPolarHBondContact O-CB 3.19Å; G275-T279 WeakPolarHBondContact O-CG2 3.4Å; G275-T279 PolarHBondContact O-N 3.37Å; G275-T279 PolarHBondContact O-OG1 3.38Å |
| 276 | V | 93.1 | Very high | 88.3 | Confident | 0 Ų | 0 | 32.9 Ų | 32.9 | 0% | 0 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -62 | -43.9 | 174 | 177.7 | 0 | 0 | 0 | 0 | 111.1 | F81 V85 L127 V131 Y232 F272 V273 P274 L278 T279 F280 | F81-V276 HydrophobicContact CD1-CG1 4.5Å; V85-V276 HydrophobicContact CG2-CB 4.23Å; V85-V276 HydrophobicContact CG2-CG1 3.71Å; L127-V276 HydrophobicContact CD1-CG1 4.29Å; L127-V276 HydrophobicContact CD2-CG2 4.4Å; L127-V276 HydrophobicContact CG-CG2 4.49Å; V131-V276 HydrophobicContact CG2-CB 4.48Å; V131-V276 HydrophobicContact CG2-CG1 3.72Å; V131-V276 HydrophobicContact CG2-CG2 3.87Å; Y232-V276 HydrophobicContact CE2-CG2 4.21Å; Y232-V276 VanDerWaalsContact OH-CG2 3.28Å; Y232-V276 WeakPolarHBondContact OH-CG2 3.27Å; F272-V276 HydrophobicContact CE1-CG2 4.42Å; F272-V276 HydrophobicContact CE2-CG2 4.36Å; F272-V276 HydrophobicContact CZ-CG2 4.18Å; F272-V276 WeakPolarHBondContact O-CG2 3.38Å; F272-V276 PolarHBondContact O-N 3.06Å; V273-V276 PolarHBondContact O-N 2.82Å; P274-V276 PolarHBondContact O-N 2.98Å; V276-L278 PolarHBondContact O-N 3.08Å; V276-T279 WeakPolarHBondContact CA-OG1 3.48Å; V276-T279 PolarHBondContact O-N 2.99Å; V276-T279 PolarHBondContact O-OG1 3.28Å; V276-F280 HydrophobicContact CG1-CD2 4.01Å; V276-F280 WeakPolarHBondContact O-CD2 3.27Å; V276-F280 PolarHBondContact O-N 3.45Å |
| 277 | Y | 92.4 | Very high | 86.5 | Confident | 13 Ų | 13 | 32.8 Ų | 32.8 | 5% | 0.051 | 18% | 0.18 | C | C | . | . | I | π-helix | trans | -60 | -46.1 | 175.6 | 174.4 | -88.5 | 0 | 0 | 0 | 112 | F55 F58 L59 V273 P274 T279 L281 R282 | F55-Y277 HydrophobicContact CE2-CD1 4.34Å; F55-Y277 HydrophobicContact CE2-CG 4.14Å; F55-Y277 HydrophobicContact CZ-CG 4.1Å; F58-Y277 HydrophobicContact CE1-CD1 4.18Å; F58-Y277 AromaticContact CE1-CE1 3.54Å; F58-Y277 HydrophobicContact CE1-CE1 3.54Å; F58-Y277 HydrophobicContact CE1-CE2 4.09Å; F58-Y277 AromaticContact CE1-CZ 3.5Å; F58-Y277 VanDerWaalsContact CE1-CZ 3.5Å; F58-Y277 AromaticContact CZ-CE1 3.78Å; F58-Y277 HydrophobicContact CZ-CE1 3.78Å; F58-Y277 AromaticContact CZ-CZ 3.75Å; F58-Y277 WeakPolarHBondContact CZ-OH 3.27Å; L59-Y277 HydrophobicContact CD2-CD2 3.79Å; L59-Y277 HydrophobicContact CD2-CE2 3.96Å; V273-Y277 PolarHBondContact O-N 3.23Å; P274-Y277 WeakPolarHBondContact O-CB 3.29Å; P274-Y277 PolarHBondContact O-N 3.27Å; Y277-T279 VanDerWaalsContact C-N 3.33Å; Y277-T279 PolarHBondContact O-N 2.91Å; Y277-L281 HydrophobicContact CD2-CB 3.7Å; Y277-L281 HydrophobicContact CD2-CD1 3.77Å; Y277-L281 HydrophobicContact CD2-CG 4.39Å; Y277-L281 HydrophobicContact CE2-CB 3.92Å; Y277-L281 HydrophobicContact CE2-CD1 4.43Å; Y277-L281 HydrophobicContact CG-CB 4.31Å; Y277-L281 CarbonylContact O-C 3.58Å; Y277-L281 WeakPolarHBondContact O-CA 3.44Å; Y277-L281 WeakPolarHBondContact O-CB 3.24Å; Y277-L281 PolarHBondContact O-N 3.5Å; Y277-R282 HydrophobicContact CE1-CB 4.48Å; Y277-R282 PolarHBondContact O-N 3.41Å |
| 278 | L | 90.8 | Very high | 84.5 | Confident | 93 Ų | 93 | 33.6 Ų | 33.6 | 49% | 0.487 | 18% | 0.183 | S | C | . | . | I | π-helix | trans | -65.7 | -35.2 | -178.5 | -71.2 | 174.4 | 0 | 0 | 0 | 112.8 | P274 G275 V276 R282 | P274-L278 WeakPolarHBondContact O-CB 3.47Å; P274-L278 VanDerWaalsContact O-CG 3.29Å; P274-L278 WeakPolarHBondContact O-CG 3.46Å; P274-L278 PolarHBondContact O-N 3.39Å; G275-L278 PolarHBondContact O-N 3.41Å; V276-L278 PolarHBondContact O-N 3.08Å; L278-R282 WeakPolarHBondContact O-CB 3.3Å |
| 279 | T | 88.4 | Confident | 82.2 | Confident | 22 Ų | 22 | 36.1 Ų | 36.1 | 14% | 0.135 | 21% | 0.211 | C | C | . | . | I | π-helix | trans | -79.2 | -43.1 | -178.5 | 46.9 | 0 | 0 | 0 | 0 | 112.9 | G228 Y232 G275 V276 Y277 | G228-T279 WeakPolarHBondContact O-CG2 3.36Å; Y232-T279 HydrophobicContact CD2-CG2 4.29Å; Y232-T279 HydrophobicContact CG-CG2 3.98Å; G275-T279 WeakPolarHBondContact O-CB 3.19Å; G275-T279 WeakPolarHBondContact O-CG2 3.4Å; G275-T279 PolarHBondContact O-N 3.37Å; G275-T279 PolarHBondContact O-OG1 3.38Å; V276-T279 WeakPolarHBondContact CA-OG1 3.48Å; V276-T279 PolarHBondContact O-N 2.99Å; V276-T279 PolarHBondContact O-OG1 3.28Å; Y277-T279 VanDerWaalsContact C-N 3.33Å; Y277-T279 PolarHBondContact O-N 2.91Å |
| 280 | F | 85.2 | Confident | 80 | Confident | 24 Ų | 24 | 39.2 Ų | 39.2 | 11% | 0.105 | 23% | 0.233 | C | C | . | . | I | π-helix | trans | -103.3 | -44.1 | -172.6 | -65.8 | -82 | 0 | 0 | 0 | 114 | F81 V131 F229 V276 | F81-F280 HydrophobicContact CE2-CD1 4.28Å; F81-F280 HydrophobicContact CZ-CD1 4.2Å; F81-F280 HydrophobicContact CZ-CE1 4.32Å; F81-F280 HydrophobicContact CZ-CG 4.46Å; V131-F280 HydrophobicContact CB-CE2 4.4Å; V131-F280 HydrophobicContact CG1-CE2 3.54Å; V131-F280 HydrophobicContact CG1-CZ 3.85Å; V131-F280 HydrophobicContact CG2-CE2 4.14Å; F229-F280 HydrophobicContact CD2-CE1 4.4Å; F229-F280 HydrophobicContact CD2-CE2 4.23Å; F229-F280 AromaticContact CD2-CZ 3.6Å; F229-F280 HydrophobicContact CD2-CZ 3.6Å; F229-F280 HydrophobicContact CE2-CE2 4.49Å; F229-F280 AromaticContact CE2-CZ 3.77Å; F229-F280 HydrophobicContact CE2-CZ 3.77Å; V276-F280 HydrophobicContact CG1-CD2 4.01Å; V276-F280 WeakPolarHBondContact O-CD2 3.27Å; V276-F280 PolarHBondContact O-N 3.45Å |
| 281 | L | 85 | Confident | 77.8 | Confident | 5 Ų | 5 | 45.5 Ų | 45.5 | 3% | 0.026 | 26% | 0.262 | C | S | . | . | I | π-helix | trans | -95.4 | -30.4 | -168.3 | -66 | 171 | 0 | 0 | 0 | 113.8 | Y78 F81 Y82 V85 Y277 G283 F284 V285 | Y78-L281 HydrophobicContact CD1-CD2 4.45Å; F81-L281 HydrophobicContact CB-CD2 4.07Å; F81-L281 HydrophobicContact CB-CG 4.41Å; Y82-L281 HydrophobicContact CD2-CD1 4.26Å; V85-L281 HydrophobicContact CB-CD1 4.32Å; V85-L281 HydrophobicContact CG1-CD1 4.47Å; V85-L281 HydrophobicContact CG2-CD1 4.15Å; Y277-L281 HydrophobicContact CD2-CB 3.7Å; Y277-L281 HydrophobicContact CD2-CD1 3.77Å; Y277-L281 HydrophobicContact CD2-CG 4.39Å; Y277-L281 HydrophobicContact CE2-CB 3.92Å; Y277-L281 HydrophobicContact CE2-CD1 4.43Å; Y277-L281 HydrophobicContact CG-CB 4.31Å; Y277-L281 CarbonylContact O-C 3.58Å; Y277-L281 WeakPolarHBondContact O-CA 3.44Å; Y277-L281 WeakPolarHBondContact O-CB 3.24Å; Y277-L281 PolarHBondContact O-N 3.5Å; L281-G283 VanDerWaalsContact C-N 3.3Å; L281-G283 PolarHBondContact O-N 3.32Å; L281-F284 WeakPolarHBondContact O-CB 3.25Å; L281-F284 PolarHBondContact O-N 3.2Å; L281-F284 VanDerWaalsContact O-N 3.08Å; L281-V285 PolarHBondContact O-N 2.82Å |
| 282 | R | 83.4 | Confident | 75.8 | Confident | 147 Ų | 147 | 49.2 Ų | 49.2 | 56% | 0.555 | 28% | 0.278 | S | S | * | . | H | α-helix | trans | -53.3 | -46.5 | -177.5 | 179.1 | 178.4 | 174.5 | 173.8 | 0.1 | 112.4 | Y277 L278 F284 V285 T286 | Y277-R282 HydrophobicContact CE1-CB 4.48Å; Y277-R282 PolarHBondContact O-N 3.41Å; L278-R282 WeakPolarHBondContact O-CB 3.3Å; R282-F284 VanDerWaalsContact C-N 3.31Å; R282-F284 PolarHBondContact O-N 3.33Å; R282-V285 PolarHBondContact O-N 2.94Å; R282-T286 HydrophobicContact CG-CG2 4.38Å; R282-T286 WeakPolarHBondContact O-CG2 3.18Å; R282-T286 PolarHBondContact O-N 2.85Å; R282-T286 VanDerWaalsContact O-N 3.11Å; R282-T286 PolarHBondContact O-OG1 3.26Å; R282-T286 VanDerWaalsContact O-OG1 3.14Å |
| 283 | G | 74 | Confident | 73.7 | Confident | 23 Ų | 23 | 55.3 Ų | 55.3 | 24% | 0.237 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -60.5 | -40 | -179.7 | 0 | 0 | 0 | 0 | 0 | 112.7 | L281 V285 T286 T287 | L281-G283 VanDerWaalsContact C-N 3.3Å; L281-G283 PolarHBondContact O-N 3.32Å; G283-V285 VanDerWaalsContact C-N 3.32Å; G283-V285 PolarHBondContact O-N 2.92Å; G283-T286 WeakPolarHBondContact CA-OG1 3.38Å; G283-T286 PolarHBondContact O-N 2.66Å; G283-T286 PolarHBondContact O-OG1 3.2Å; G283-T287 PolarHBondContact O-N 3.13Å; G283-T287 PolarHBondContact O-OG1 3.31Å |
| 284 | F | 70.9 | Confident | 71.7 | Confident | 22 Ų | 22 | 62.4 Ų | 62.4 | 10% | 0.096 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -63.4 | -39.3 | 177.5 | -176.9 | -108.1 | 0 | 0 | 0 | 111.4 | K69 L70 T73 Y78 L281 R282 | K69-F284 HydrophobicContact CB-CE1 4.14Å; K69-F284 HydrophobicContact CB-CZ 4.26Å; K69-F284 HydrophobicContact CD-CD1 3.72Å; K69-F284 HydrophobicContact CD-CD2 4.35Å; K69-F284 HydrophobicContact CD-CE1 3.35Å; K69-F284 HydrophobicContact CD-CE2 4.01Å; K69-F284 HydrophobicContact CD-CG 4.22Å; K69-F284 HydrophobicContact CD-CZ 3.51Å; K69-F284 WeakPolarHBondContact CE-O 3.45Å; K69-F284 HydrophobicContact CG-CE1 3.68Å; K69-F284 HydrophobicContact CG-CE2 4.22Å; K69-F284 HydrophobicContact CG-CZ 3.5Å; K69-F284 VanDerWaalsContact CG-CZ 3.5Å; K69-F284 PolarHBondContact NZ-O 3.37Å; L70-F284 HydrophobicContact CD1-CE1 3.77Å; L70-F284 HydrophobicContact CD1-CZ 4.2Å; T73-F284 HydrophobicContact CG2-CE2 3.87Å; T73-F284 HydrophobicContact CG2-CZ 4.03Å; T73-F284 WeakPolarHBondContact OG1-CE2 3.35Å; T73-F284 VanDerWaalsContact OG1-CZ 3.27Å; T73-F284 WeakPolarHBondContact OG1-CZ 3.31Å; Y78-F284 HydrophobicContact CD1-CB 3.93Å; Y78-F284 HydrophobicContact CD1-CD2 4.02Å; Y78-F284 AromaticContact CD1-CG 3.92Å; Y78-F284 HydrophobicContact CD1-CG 3.92Å; Y78-F284 HydrophobicContact CD2-CD2 4.07Å; Y78-F284 HydrophobicContact CD2-CE2 4.11Å; Y78-F284 HydrophobicContact CE1-CB 3.86Å; Y78-F284 HydrophobicContact CE1-CD2 4.08Å; Y78-F284 HydrophobicContact CE1-CG 4.16Å; Y78-F284 HydrophobicContact CE2-CD2 4.13Å; Y78-F284 HydrophobicContact CE2-CE2 4.44Å; Y78-F284 HydrophobicContact CG-CD2 4.01Å; Y78-F284 HydrophobicContact CG-CE2 4.23Å; Y78-F284 HydrophobicContact CG-CG 4.22Å; L281-F284 WeakPolarHBondContact O-CB 3.25Å; L281-F284 PolarHBondContact O-N 3.2Å; L281-F284 VanDerWaalsContact O-N 3.08Å; R282-F284 VanDerWaalsContact C-N 3.31Å; R282-F284 PolarHBondContact O-N 3.33Å |
| 285 | V | 68.3 | Low | 69.7 | Low | 16 Ų | 16 | 64.5 Ų | 64.5 | 10% | 0.097 | 36% | 0.356 | C | S | . | . | H | α-helix | trans | -72.1 | -29 | 178.8 | -179 | 0 | 0 | 0 | 0 | 112.6 | I66 L281 R282 G283 | I66-V285 HydrophobicContact CD1-CG2 4.29Å; I66-V285 HydrophobicContact CG1-CG2 4.23Å; L281-V285 PolarHBondContact O-N 2.82Å; R282-V285 PolarHBondContact O-N 2.94Å; G283-V285 VanDerWaalsContact C-N 3.32Å; G283-V285 PolarHBondContact O-N 2.92Å |
| 286 | T | 66.1 | Low | 67.7 | Low | 88 Ų | 88 | 70.5 Ų | 70.5 | 54% | 0.54 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -89.7 | -26.7 | -173.7 | 51.8 | 0 | 0 | 0 | 0 | 115.7 | R282 G283 E288 G289 | R282-T286 HydrophobicContact CG-CG2 4.38Å; R282-T286 WeakPolarHBondContact O-CG2 3.18Å; R282-T286 PolarHBondContact O-N 2.85Å; R282-T286 VanDerWaalsContact O-N 3.11Å; R282-T286 PolarHBondContact O-OG1 3.26Å; R282-T286 VanDerWaalsContact O-OG1 3.14Å; G283-T286 WeakPolarHBondContact CA-OG1 3.38Å; G283-T286 PolarHBondContact O-N 2.66Å; G283-T286 PolarHBondContact O-OG1 3.2Å; T286-E288 PolarHBondContact O-N 2.88Å; T286-G289 PolarHBondContact O-N 3.47Å |
| 287 | T | 58.1 | Low | 65.9 | Low | 71 Ų | 71 | 72.7 Ų | 72.7 | 44% | 0.436 | 39% | 0.391 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -62.7 | -11.6 | -171.6 | -52.8 | 0 | 0 | 0 | 0 | 115 | G283 G289 S290 | G283-T287 PolarHBondContact O-N 3.13Å; G283-T287 PolarHBondContact O-OG1 3.31Å; T287-G289 VanDerWaalsContact C-N 3.29Å; T287-G289 PolarHBondContact O-N 2.92Å; T287-S290 PolarHBondContact O-N 3.43Å |
| 288 | E | 54 | Low | 64.4 | Low | 73 Ų | 73 | 78.3 Ų | 78.3 | 34% | 0.341 | 42% | 0.417 | S | S | . | . | H | α-helix | trans | -64.6 | -25.4 | 176.6 | -91.1 | 161.3 | -138.3 | 0 | 0 | 115 | K69 T286 S290 | K69-E288 VanDerWaalsContact CD-OE1 3.24Å; K69-E288 WeakPolarHBondContact CD-OE1 3.39Å; K69-E288 IonicContact NZ-OE1 2.81Å; K69-E288 PolarHBondContact NZ-OE1 3.32Å; T286-E288 PolarHBondContact O-N 2.88Å; E288-S290 VanDerWaalsContact C-N 3.25Å; E288-S290 PolarHBondContact O-N 2.93Å |
| 289 | G | 49.2 | Very low | 63.1 | Low | 58 Ų | 58 | 78.9 Ų | 78.9 | 60% | 0.598 | 42% | 0.417 | S | S | * | . | H | α-helix | trans | -68.4 | -23.4 | -178.8 | 0 | 0 | 0 | 0 | 0 | 114.1 | T286 T287 | T286-G289 PolarHBondContact O-N 3.47Å; T287-G289 VanDerWaalsContact C-N 3.29Å; T287-G289 PolarHBondContact O-N 2.92Å |
| 290 | S | 48.5 | Very low | 61.9 | Low | 68 Ų | 68 | 84 Ų | 84 | 48% | 0.476 | 44% | 0.438 | S | S | . | . | H | α-helix | trans | -101 | -39.1 | -173.1 | -165.7 | 0 | 0 | 0 | 0 | 113.1 | T287 E288 L293 F294 | T287-S290 PolarHBondContact O-N 3.43Å; E288-S290 VanDerWaalsContact C-N 3.25Å; E288-S290 PolarHBondContact O-N 2.93Å; S290-L293 PolarHBondContact O-N 3.42Å; S290-F294 WeakPolarHBondContact O-CD2 3.18Å; S290-F294 PolarHBondContact O-N 3.09Å |
| 291 | E | 50.5 | Low | 61 | Low | 139 Ų | 139 | 88.1 Ų | 88.1 | 65% | 0.65 | 46% | 0.461 | S | S | * | . | H | α-helix | trans | -73.7 | -30.9 | -176.6 | -72.7 | -173.2 | 172.9 | 0 | 0 | 113.1 | F294 S295 | E291-F294 PolarHBondContact O-N 3.24Å; E291-S295 WeakPolarHBondContact O-CB 3.39Å; E291-S295 PolarHBondContact O-N 3.02Å |
| 292 | L | 53.5 | Low | 59.8 | Low | 125 Ų | 125 | 94.1 Ų | 94.1 | 65% | 0.654 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -66.2 | -36.6 | 175.3 | -93.5 | 160.2 | 0 | 0 | 0 | 112.4 | Y296 | L292-Y296 WeakPolarHBondContact O-CB 3.2Å; L292-Y296 PolarHBondContact O-N 3.22Å |
| 293 | L | 52.2 | Low | 58.9 | Low | 129 Ų | 129 | 92.8 Ų | 92.8 | 68% | 0.675 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -68.9 | -38.9 | 174.6 | -80.4 | 168.2 | 0 | 0 | 0 | 111.8 | S290 S297 | S290-L293 PolarHBondContact O-N 3.42Å; L293-S297 WeakPolarHBondContact O-CB 3.47Å; L293-S297 PolarHBondContact O-N 2.72Å; L293-S297 PolarHBondContact O-OG 3.46Å |
| 294 | F | 53.2 | Low | 58.2 | Low | 150 Ų | 150 | 93 Ų | 93 | 66% | 0.658 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -72.1 | -36.7 | 177.8 | -92.2 | -79.6 | 0 | 0 | 0 | 113.5 | S290 E291 S297 H298 | S290-F294 WeakPolarHBondContact O-CD2 3.18Å; S290-F294 PolarHBondContact O-N 3.09Å; E291-F294 PolarHBondContact O-N 3.24Å; F294-S297 WeakPolarHBondContact CA-OG 3.4Å; F294-S297 PolarHBondContact O-OG 3.35Å; F294-H298 WeakPolarHBondContact O-CB 3.29Å; F294-H298 PolarHBondContact O-N 3.38Å |
| 295 | S | 54.1 | Low | 57.8 | Low | 73 Ų | 73 | 96.7 Ų | 96.7 | 51% | 0.51 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -69.8 | -40.3 | 174.4 | -174 | 0 | 0 | 0 | 0 | 111.3 | E291 H298 Q299 | E291-S295 WeakPolarHBondContact O-CB 3.39Å; E291-S295 PolarHBondContact O-N 3.02Å; S295-H298 PolarHBondContact O-N 3.42Å; S295-Q299 PolarHBondContact O-N 3.26Å |
| 296 | Y | 51.3 | Low | 57.3 | Low | 141 Ų | 141 | 98.7 Ų | 98.7 | 55% | 0.553 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -69.4 | -34.4 | 176.7 | -160.9 | -104.5 | 0 | 0 | 0 | 112.6 | L292 Q299 K300 | L292-Y296 WeakPolarHBondContact O-CB 3.2Å; L292-Y296 PolarHBondContact O-N 3.22Å; Y296-Q299 PolarHBondContact O-N 3.38Å; Y296-K300 HydrophobicContact CD1-CD 4.37Å; Y296-K300 HydrophobicContact CE1-CD 4.23Å; Y296-K300 VanDerWaalsContact CE1-CE 3.48Å; Y296-K300 HydrophobicContact CE1-CG 4.44Å; Y296-K300 PolarHBondContact O-N 3.4Å |
| 297 | S | 56.1 | Low | 56.9 | Low | 46 Ų | 46 | 99.1 Ų | 99.1 | 32% | 0.322 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -65.2 | -43.5 | 171.3 | 63.6 | 0 | 0 | 0 | 0 | 111.1 | L293 F294 Q299 K300 D301 | L293-S297 WeakPolarHBondContact O-CB 3.47Å; L293-S297 PolarHBondContact O-N 2.72Å; L293-S297 PolarHBondContact O-OG 3.46Å; F294-S297 WeakPolarHBondContact CA-OG 3.4Å; F294-S297 PolarHBondContact O-OG 3.35Å; S297-Q299 VanDerWaalsContact C-N 3.29Å; S297-Q299 PolarHBondContact O-N 2.83Å; S297-K300 PolarHBondContact O-N 2.87Å; S297-K300 VanDerWaalsContact O-N 3.12Å; S297-D301 PolarHBondContact O-N 3.31Å |
| 298 | H | 60.2 | Low | 57.1 | Low | 132 Ų | 132 | 101 Ų | 101 | 61% | 0.611 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -65.5 | -31 | 177.4 | -158.8 | -60.9 | 0 | 0 | 0 | 112.9 | F294 S295 F302 | F294-H298 WeakPolarHBondContact O-CB 3.29Å; F294-H298 PolarHBondContact O-N 3.38Å; S295-H298 PolarHBondContact O-N 3.42Å; H298-F302 WeakPolarHBondContact O-CB 3.43Å; H298-F302 PolarHBondContact O-N 3.19Å |
| 299 | Q | 63.9 | Low | 57 | Low | 104 Ų | 104 | 103.3 Ų | 103.3 | 49% | 0.486 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -69.8 | -42 | 170.5 | -99.9 | -177.2 | -21.1 | 0 | 0 | 112.3 | S295 Y296 S297 D301 F302 F303 | S295-Q299 PolarHBondContact O-N 3.26Å; Y296-Q299 PolarHBondContact O-N 3.38Å; S297-Q299 VanDerWaalsContact C-N 3.29Å; S297-Q299 PolarHBondContact O-N 2.83Å; Q299-D301 VanDerWaalsContact C-N 3.3Å; Q299-D301 PolarHBondContact O-N 2.98Å; Q299-F302 PolarHBondContact O-N 3.17Å; Q299-F303 HydrophobicContact CB-CD2 4.48Å; Q299-F303 HydrophobicContact CG-CE2 4.24Å; Q299-F303 WeakPolarHBondContact O-CD2 3.49Å; Q299-F303 PolarHBondContact O-N 2.8Å |
| 300 | K | 63.3 | Low | 57 | Low | 130 Ų | 130 | 106.7 Ų | 106.7 | 57% | 0.565 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -61 | -40.1 | 174.5 | -83.6 | -176.4 | 171.9 | 174.2 | 0 | 112.1 | Y296 S297 G304 | Y296-K300 HydrophobicContact CD1-CD 4.37Å; Y296-K300 HydrophobicContact CE1-CD 4.23Å; Y296-K300 VanDerWaalsContact CE1-CE 3.48Å; Y296-K300 HydrophobicContact CE1-CG 4.44Å; Y296-K300 PolarHBondContact O-N 3.4Å; S297-K300 PolarHBondContact O-N 2.87Å; S297-K300 VanDerWaalsContact O-N 3.12Å; K300-G304 WeakPolarHBondContact O-CA 3.3Å; K300-G304 PolarHBondContact O-N 3.46Å |
| 301 | D | 64.7 | Low | 57.1 | Low | 111 Ų | 111 | 107 Ų | 107 | 59% | 0.594 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -66.7 | -42.4 | 177.1 | -61 | -24.7 | 0 | 0 | 0 | 110.5 | S297 Q299 G304 D305 | S297-D301 PolarHBondContact O-N 3.31Å; Q299-D301 VanDerWaalsContact C-N 3.3Å; Q299-D301 PolarHBondContact O-N 2.98Å; D301-G304 PolarHBondContact O-N 3.11Å; D301-D305 PolarHBondContact O-N 3.17Å |
| 302 | F | 61 | Low | 56.9 | Low | 131 Ų | 131 | 106 Ų | 106 | 58% | 0.575 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -64.5 | -42.7 | 178.2 | -163.1 | -90.2 | 0 | 0 | 0 | 113 | H298 Q299 V306 | H298-F302 WeakPolarHBondContact O-CB 3.43Å; H298-F302 PolarHBondContact O-N 3.19Å; Q299-F302 PolarHBondContact O-N 3.17Å; F302-V306 HydrophobicContact CD1-CG2 4.45Å; F302-V306 HydrophobicContact CE1-CG2 4.35Å; F302-V306 WeakPolarHBondContact O-CG2 3.39Å; F302-V306 PolarHBondContact O-N 3.36Å |
| 303 | F | 63.2 | Low | 56.5 | Low | 118 Ų | 118 | 105.9 Ų | 105.9 | 52% | 0.518 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -78.7 | -26.6 | 176.7 | -70.5 | -67.8 | 0 | 0 | 0 | 113.2 | Q299 N307 | Q299-F303 HydrophobicContact CB-CD2 4.48Å; Q299-F303 HydrophobicContact CG-CE2 4.24Å; Q299-F303 WeakPolarHBondContact O-CD2 3.49Å; Q299-F303 PolarHBondContact O-N 2.8Å; F303-N307 PolarHBondContact O-N 2.99Å; F303-N307 VanDerWaalsContact O-N 3.13Å; F303-N307 PolarHBondContact O-ND2 3.13Å |
| 304 | G | 61.1 | Low | 55.7 | Low | 29 Ų | 29 | 107.8 Ų | 107.8 | 30% | 0.299 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -62.2 | -49 | 171.9 | 0 | 0 | 0 | 0 | 0 | 111.1 | K300 D301 V306 N307 D308 | K300-G304 WeakPolarHBondContact O-CA 3.3Å; K300-G304 PolarHBondContact O-N 3.46Å; D301-G304 PolarHBondContact O-N 3.11Å; G304-V306 PolarHBondContact O-N 2.99Å; G304-N307 PolarHBondContact O-N 3.38Å; G304-D308 PolarHBondContact O-N 3.46Å; G304-D308 VanDerWaalsContact O-N 3.12Å |
| 305 | D | 60.7 | Low | 54.7 | Low | 98 Ų | 98 | 105.1 Ų | 105.1 | 52% | 0.524 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -64.9 | -38.4 | 179.4 | -132.4 | 8.3 | 0 | 0 | 0 | 112 | D301 D308 H309 | D301-D305 PolarHBondContact O-N 3.17Å; D305-D308 PolarHBondContact O-N 2.96Å; D305-H309 PolarHBondContact O-CD2 3.05Å; D305-H309 VanDerWaalsContact O-CG 3.29Å; D305-H309 PolarHBondContact O-N 3.28Å; D305-H309 VanDerWaalsContact O-N 3.09Å; D305-H309 IonicContact OD1-NE2 3.9Å |
| 306 | V | 59.2 | Low | 54.1 | Low | 59 Ų | 59 | 107.7 Ų | 107.7 | 36% | 0.358 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -66.6 | -41.9 | 178.4 | 173.4 | 0 | 0 | 0 | 0 | 111.9 | F302 G304 H309 E310 | F302-V306 HydrophobicContact CD1-CG2 4.45Å; F302-V306 HydrophobicContact CE1-CG2 4.35Å; F302-V306 WeakPolarHBondContact O-CG2 3.39Å; F302-V306 PolarHBondContact O-N 3.36Å; G304-V306 PolarHBondContact O-N 2.99Å; V306-H309 PolarHBondContact O-N 3.3Å; V306-E310 PolarHBondContact O-N 2.95Å |
| 307 | N | 57.6 | Low | 53.4 | Low | 97 Ų | 97 | 105.3 Ų | 105.3 | 52% | 0.519 | 58% | 0.577 | S | S | . | * | H | α-helix | trans | -69.3 | -35.7 | 179 | -73.4 | -23.1 | 0 | 0 | 0 | 112.3 | F303 G304 H309 E310 A311 | F303-N307 PolarHBondContact O-N 2.99Å; F303-N307 VanDerWaalsContact O-N 3.13Å; F303-N307 PolarHBondContact O-ND2 3.13Å; G304-N307 PolarHBondContact O-N 3.38Å; N307-H309 VanDerWaalsContact C-N 3.3Å; N307-H309 PolarHBondContact O-N 2.83Å; N307-E310 PolarHBondContact O-N 2.81Å; N307-A311 WeakPolarHBondContact O-CB 3.39Å; N307-A311 PolarHBondContact O-N 3.35Å |
| 308 | D | 61.3 | Low | 52.3 | Low | 110 Ų | 110 | 114.1 Ų | 114.1 | 59% | 0.588 | 60% | 0.603 | S | S | * | * | H | α-helix | trans | -68 | -32.7 | 175.9 | -71.4 | -21.1 | 0 | 0 | 0 | 111.3 | G304 D305 V312 | G304-D308 PolarHBondContact O-N 3.46Å; G304-D308 VanDerWaalsContact O-N 3.12Å; D305-D308 PolarHBondContact O-N 2.96Å; D308-V312 VanDerWaalsContact O-CG2 3.32Å; D308-V312 WeakPolarHBondContact O-CG2 3.28Å; D308-V312 PolarHBondContact O-N 3.36Å |
| 309 | H | 52.9 | Low | 50.9 | Low | 122 Ų | 122 | 115 Ų | 115 | 57% | 0.565 | 61% | 0.611 | S | S | * | * | H | α-helix | trans | -73.9 | -37.2 | 173.9 | -69.8 | -34.9 | 0 | 0 | 0 | 113.8 | D305 V306 N307 V313 | D305-H309 PolarHBondContact O-CD2 3.05Å; D305-H309 VanDerWaalsContact O-CG 3.29Å; D305-H309 PolarHBondContact O-N 3.28Å; D305-H309 VanDerWaalsContact O-N 3.09Å; D305-H309 IonicContact OD1-NE2 3.9Å; V306-H309 PolarHBondContact O-N 3.3Å; N307-H309 VanDerWaalsContact C-N 3.3Å; N307-H309 PolarHBondContact O-N 2.83Å; H309-V313 WeakPolarHBondContact O-CG2 3.47Å |
| 310 | E | 47.6 | Very low | 49.4 | Very low | 128 Ų | 128 | 114.1 Ų | 114.1 | 60% | 0.598 | 62% | 0.621 | S | S | * | * | H | α-helix | trans | -72.5 | -34.5 | 176.3 | -71.8 | -170.8 | 131.3 | 0 | 0 | 112.4 | V306 N307 V312 V313 | V306-E310 PolarHBondContact O-N 2.95Å; N307-E310 PolarHBondContact O-N 2.81Å; E310-V312 VanDerWaalsContact C-N 3.26Å; E310-V312 PolarHBondContact O-N 2.67Å; E310-V313 PolarHBondContact O-N 3.13Å |
| 311 | A | 51.1 | Low | 47.8 | Very low | 75 Ų | 75 | 116.1 Ų | 116.1 | 62% | 0.62 | 63% | 0.632 | S | S | * | * | H | α-helix | trans | -65.8 | -27.2 | 176.5 | 0 | 0 | 0 | 0 | 0 | 113.2 | N307 | N307-A311 WeakPolarHBondContact O-CB 3.39Å; N307-A311 PolarHBondContact O-N 3.35Å |
| 312 | V | 47.4 | Very low | 46.4 | Very low | 119 Ų | 119 | 120.1 Ų | 120.1 | 72% | 0.721 | 65% | 0.649 | S | S | * | * | H | α-helix | trans | -80.5 | -22.2 | 177.8 | 174.7 | 0 | 0 | 0 | 0 | 112.5 | D308 E310 | D308-V312 VanDerWaalsContact O-CG2 3.32Å; D308-V312 WeakPolarHBondContact O-CG2 3.28Å; D308-V312 PolarHBondContact O-N 3.36Å; E310-V312 VanDerWaalsContact C-N 3.26Å; E310-V312 PolarHBondContact O-N 2.67Å |
| 313 | V | 45.1 | Very low | 44.9 | Very low | 122 Ų | 122 | 121.6 Ų | 121.6 | 74% | 0.739 | 66% | 0.658 | S | S | * | * | H | α-helix | trans | -87.2 | -13.4 | -176.3 | 178.1 | 0 | 0 | 0 | 0 | 113 | H309 E310 | H309-V313 WeakPolarHBondContact O-CG2 3.47Å; E310-V313 PolarHBondContact O-N 3.13Å |
| 314 | Q | 33.9 | Very low | 43.3 | Very low | 168 Ų | 168 | 121.1 Ų | 121.1 | 79% | 0.785 | 67% | 0.669 | S | S | * | * | trans | -104.3 | 72.4 | 176.4 | -77.3 | 178.9 | -18.4 | 0 | 0 | 113 | ||||
| 315 | S | 33.1 | Very low | 41.9 | Very low | 95 Ų | 95 | 128.4 Ų | 128.4 | 66% | 0.664 | 70% | 0.695 | S | S | * | * | trans | -125.9 | 82.6 | 154.3 | 162.1 | 0 | 0 | 0 | 0 | 110 | S317 | S315-S317 PolarHBondContact O-N 3.11Š| ||
| 316 | P | 41.1 | Very low | 40.4 | Very low | 126 Ų | 126 | 133.1 Ų | 133.1 | 82% | 0.818 | 71% | 0.711 | S | S | * | * | trans | -86 | 89.8 | 172.7 | 33.2 | -28.1 | 0 | 0 | 0 | 109.4 | ||||
| 317 | S | 36.9 | Very low | 39.1 | Very low | 92 Ų | 92 | 135 Ų | 135 | 64% | 0.643 | 73% | 0.725 | S | S | * | * | trans | -156.2 | 93.3 | 163.9 | 57.5 | 0 | 0 | 0 | 0 | 112.4 | S315 | S315-S317 PolarHBondContact O-N 3.11Š| ||
| 318 | R | 32.3 | Very low | 37.8 | Very low | 231 Ų | 231 | 136.3 Ų | 136.3 | 87% | 0.872 | 74% | 0.737 | S | S | * | * | trans | 166.4 | 94.8 | 140 | -93.3 | -179.7 | -137.7 | -157.6 | 4.8 | 108.6 | ||||
| 319 | I | 30.7 | Very low | 36.2 | Very low | 151 Ų | 151 | 137 Ų | 137 | 77% | 0.774 | 74% | 0.74 | S | S | * | * | 83.1 | 112.1 | 97.2 | -71.9 | 170.8 | 0 | 0 | 0 | 111.6 | |||||
| 320 | A | 32.6 | Very low | 35.4 | Very low | 84 Ų | 84 | 140.4 Ų | 140.4 | 69% | 0.694 | 75% | 0.753 | S | S | * | * | trans | -9.9 | 119.8 | 149.8 | 0 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 321 | H | 30.6 | Very low | 34.8 | Very low | 173 Ų | 173 | 141.9 Ų | 141.9 | 80% | 0.801 | 76% | 0.764 | S | S | * | * | trans | 175.2 | 85.7 | 138.6 | -99.2 | -71.3 | 0 | 0 | 0 | 107.9 | ||||
| 322 | M | 35.6 | Very low | 33.7 | Very low | 195 Ų | 195 | 145.7 Ų | 145.7 | 96% | 0.961 | 78% | 0.775 | S | S | * | * | trans | -155 | 80.3 | 147.1 | -141.8 | 155.4 | 165.2 | 0 | 0 | 108.4 | ||||
| 323 | E | 28 | Very low | 33.5 | Very low | 162 Ų | 162 | 144.1 Ų | 144.1 | 76% | 0.757 | 77% | 0.767 | S | S | * | * | trans | -57.5 | 150.4 | 156.9 | -92.7 | 170.9 | 111.8 | 0 | 0 | 110.8 | ||||
| 324 | S | 30.8 | Very low | 32.7 | Very low | 107 Ų | 107 | 145.4 Ų | 145.4 | 75% | 0.748 | 77% | 0.77 | S | S | * | * | trans | 61.7 | 103.3 | 142.5 | 71.6 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 325 | Q | 30.8 | Very low | 32.6 | Very low | 182 Ų | 182 | 146.3 Ų | 146.3 | 85% | 0.85 | 77% | 0.774 | S | S | * | * | trans | -167.6 | 95.8 | 130.9 | -106.8 | 172.3 | 5.5 | 0 | 0 | 108 | ||||
| 326 | F | 29.5 | Very low | 32.8 | Very low | 197 Ų | 197 | 146.6 Ų | 146.6 | 86% | 0.864 | 77% | 0.773 | S | S | * | * | -176.4 | 134 | 113.1 | -112.4 | -94.8 | 0 | 0 | 0 | 110.5 | |||||
| 327 | P | 33.1 | Very low | 32.3 | Very low | 99 Ų | 99 | 146.8 Ų | 146.8 | 64% | 0.643 | 77% | 0.772 | S | S | * | * | trans | -93.1 | 156.8 | -174.4 | 37.7 | -32.6 | 0 | 0 | 0 | 111.2 | ||||
| 328 | T | 29.9 | Very low | 32.1 | Very low | 125 Ų | 125 | 148 Ų | 148 | 77% | 0.767 | 78% | 0.78 | S | S | * | * | 166.1 | 117.3 | 129.2 | 39.1 | 0 | 0 | 0 | 0 | 108.1 | |||||
| 329 | L | 27.9 | Very low | 32 | Very low | 125 Ų | 125 | 141.1 Ų | 141.1 | 65% | 0.654 | 77% | 0.773 | S | S | * | * | 80.5 | 100 | 103.5 | -148.1 | 155.9 | 0 | 0 | 0 | 108.2 | |||||
| 330 | F | 36.1 | Very low | 32.1 | Very low | 193 Ų | 193 | 141.3 Ų | 141.3 | 85% | 0.846 | 78% | 0.776 | S | S | * | * | -153.7 | 151.7 | 90.1 | -84.8 | -83.4 | 0 | 0 | 0 | 113.4 | |||||
| 331 | L | 33.6 | Very low | 31.9 | Very low | 158 Ų | 158 | 144 Ų | 144 | 83% | 0.827 | 78% | 0.783 | S | S | * | * | trans | -58.9 | 134.1 | -172.9 | -72.1 | 137.5 | 0 | 0 | 0 | 115.9 | ||||
| 332 | N | 28.1 | Very low | 32.1 | Very low | 156 Ų | 156 | 144.9 Ų | 144.9 | 83% | 0.834 | 81% | 0.809 | S | S | * | * | 32.8 | 154.2 | 122.9 | -120.4 | 29 | 0 | 0 | 0 | 122.4 | |||||
| 333 | P | 43.9 | Very low | 31.9 | Very low | 86 Ų | 86 | 142.4 Ų | 142.4 | 56% | 0.558 | 80% | 0.801 | S | S | * | * | trans | -94.5 | -174.2 | -159.4 | 42.4 | -37.3 | 0 | 0 | 0 | 113.2 | ||||
| 334 | D | 29 | Very low | 32.1 | Very low | 149 Ų | 149 | 141.3 Ų | 141.3 | 80% | 0.797 | 80% | 0.804 | S | S | * | * | trans | 90.3 | 106 | 167.6 | -51.2 | -34.1 | 0 | 0 | 0 | 114.4 | ||||
| 335 | E | 31.3 | Very low | 32.2 | Very low | 187 Ų | 187 | 143.2 Ų | 143.2 | 87% | 0.874 | 81% | 0.807 | S | S | * | * | 179.5 | 141.4 | 99.9 | -152.1 | 159.4 | 142.4 | 0 | 0 | 111.5 | |||||
| 336 | P | 36.9 | Very low | 32.3 | Very low | 101 Ų | 101 | 140.9 Ų | 140.9 | 66% | 0.656 | 80% | 0.804 | S | S | * | * | trans | -97 | 158.2 | -177 | 38.2 | -33.2 | 0 | 0 | 0 | 113.8 | ||||
| 337 | T | 29.9 | Very low | 32.5 | Very low | 130 Ų | 130 | 137.4 Ų | 137.4 | 80% | 0.798 | 80% | 0.8 | S | S | * | * | trans | 45.7 | 112.8 | 145.8 | 53 | 0 | 0 | 0 | 0 | 120.8 | ||||
| 338 | S | 33.2 | Very low | 32.4 | Very low | 116 Ų | 116 | 140 Ų | 140 | 81% | 0.811 | 81% | 0.811 | S | S | * | * | trans | 152.9 | 122.8 | 130.5 | 55.2 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 339 | A | 30.8 | Very low | 32.6 | Very low | 87 Ų | 87 | 141.1 Ų | 141.1 | 72% | 0.719 | 81% | 0.814 | S | S | * | * | 63.1 | 89.2 | 58.2 | 0 | 0 | 0 | 0 | 0 | 113.7 | |||||
| 340 | N | 32.7 | Very low | 33 | Very low | 155 Ų | 155 | 142.3 Ų | 142.3 | 83% | 0.829 | 83% | 0.826 | S | S | * | * | trans | 162 | 117.9 | 140.1 | -82.7 | -15.2 | 0 | 0 | 0 | 106.9 | ||||
| 341 | V | 29.2 | Very low | 32.7 | Very low | 141 Ų | 141 | 138.1 Ų | 138.1 | 86% | 0.855 | 82% | 0.824 | S | S | * | * | 51.3 | 88.6 | 62 | -167.8 | 0 | 0 | 0 | 0 | 112.8 | |||||
| 342 | S | 34 | Very low | 32.6 | Very low | 191 Ų | 191 | 136.3 Ų | 136.3 | 100% | 1.336 | 82% | 0.824 | S | S | * | * | -163.1 | 0 | 129.3 | 60.2 | 0 | 0 | 0 | 0 | 108.7 |
Retrieved 342 of 342 residues in 64.8 ms
(Link to these results)