| 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 | 32.5 | Very low | 40.1 | Very low | 165 Ų | 165 | 102.1 Ų | 102.1 | 81% | 0.813 | 53% | 0.53 | S | S | * | . | 0 | 83.6 | 0 | -69.1 | -162.3 | 152 | 0 | 0 | 109.9 | S23 K27 | M1-S23 CarbonylContact C-O 3.53Å; M1-S23 WeakPolarHBondContact CA-O 3.27Å; M1-S23 WeakPolarHBondContact CA-OG 3.13Å; M1-S23 WeakPolarHBondContact CB-O 3.05Å; M1-S23 WeakPolarHBondContact CG-O 2.97Å; M1-S23 WeakPolarHBondContact CG-OG 3.15Å; M1-S23 PolarHBondContact N-OG 3.1Å; M1-S23 VanDerWaalsContact N-OG 3.08Å; M1-K27 WeakPolarHBondContact O-CD 3.32Å; M1-K27 WeakPolarHBondContact O-CE 3.45Å; M1-K27 PolarHBondContact O-NZ 3.29Å | |||
| 2 | S | 36.8 | Very low | 40.5 | Very low | 7 Ų | 7 | 104.4 Ų | 104.4 | 5% | 0.049 | 54% | 0.54 | C | S | . | . | trans | 150.4 | 0.9 | 161.2 | 65.6 | 0 | 0 | 0 | 0 | 125.5 | C4 E24 K27 K31 | S2-C4 PolarHBondContact O-N 3.46Å; S2-C4 VanDerWaalsContact O-N 3.14Å; S2-E24 WeakPolarHBondContact CA-OE1 2.9Å; S2-E24 VanDerWaalsContact CB-CG 3.43Å; S2-E24 WeakPolarHBondContact CB-O 3.38Å; S2-E24 WeakPolarHBondContact CB-OE2 2.81Å; S2-E24 PolarHBondContact N-OE1 3.42Å; S2-E24 WeakPolarHBondContact OG-CA 3.08Å; S2-E24 PolarHBondContact OG-O 3.46Å; S2-K27 WeakPolarHBondContact OG-CB 3.25Å; S2-K27 PolarHBondContact OG-N 3.3Å; S2-K31 PolarHBondContact O-NZ 3.48Å | ||
| 3 | D | 35.1 | Very low | 40.8 | Very low | 116 Ų | 116 | 101.7 Ų | 101.7 | 62% | 0.62 | 52% | 0.523 | S | S | * | . | trans | -83.3 | 80.3 | 176 | -67.6 | -40.5 | 0 | 0 | 0 | 115.3 | I5 C20 E24 K31 | D3-I5 PolarHBondContact O-N 3.1Å; D3-C20 PolarHBondContact O-SG 2.71Å; D3-C20 VanDerWaalsContact O-SG 3.4Å; D3-E24 WeakPolarHBondContact CA-OE2 3.48Å; D3-E24 PolarHBondContact N-OE1 3.26Å; D3-E24 PolarHBondContact N-OE2 3.37Å; D3-K31 IonicContact OD1-NZ 3.5Å | ||
| 4 | C | 43.1 | Very low | 40.8 | Very low | 20 Ų | 20 | 108.9 Ų | 108.9 | 14% | 0.135 | 54% | 0.542 | C | S | . | . | trans | -63.4 | 112.1 | 165.2 | -45.2 | 0 | 0 | 0 | 0 | 110.3 | S2 C20 E24 C28 K31 | S2-C4 PolarHBondContact O-N 3.46Å; S2-C4 VanDerWaalsContact O-N 3.14Å; C4-C20 VanDerWaalsContact CA-SG 3.5Å; C4-E24 PolarHBondContact N-OE2 2.89Å; C4-C28 HydrophobicContact CB-CB 4.41Å; C4-C28 WeakPolarHBondContact CB-SG 2.88Å; C4-C28 WeakPolarHBondContact SG-CA 3.34Å; C4-C28 WeakPolarHBondContact SG-CB 3.45Å; C4-C28 CovalentContact SG-SG 2.04Å; C4-C28 PolarHBondContact SG-SG 3.42Å; C4-K31 HydrophobicContact CB-CB 4.5Å; C4-K31 HydrophobicContact CB-CD 3.62Å; C4-K31 PolarHBondContact O-NZ 3.08Å | ||
| 5 | I | 42 | Very low | 40.7 | Very low | 103 Ų | 103 | 112.5 Ų | 112.5 | 53% | 0.528 | 55% | 0.553 | S | S | . | * | trans | -104.5 | 126 | 174.9 | -58.1 | 164.1 | 0 | 0 | 0 | 108.1 | D3 I16 | D3-I5 PolarHBondContact O-N 3.1Å; I5-I16 HydrophobicContact CB-CD1 3.97Å; I5-I16 HydrophobicContact CB-CG2 3.57Å; I5-I16 HydrophobicContact CG2-CD1 3.4Å; I5-I16 HydrophobicContact CG2-CG2 4.08Å; I5-I16 WeakPolarHBondContact O-CG2 3.44Å | ||
| 6 | F | 44 | Very low | 41.3 | Very low | 135 Ų | 135 | 107.3 Ų | 107.3 | 59% | 0.592 | 53% | 0.528 | S | S | * | . | trans | -87.4 | 118.4 | 170.1 | -111.2 | -97.3 | 0 | 0 | 0 | 107 | L35 | F6-L35 HydrophobicContact CD1-CD2 3.78Å; F6-L35 HydrophobicContact CD2-CD2 4.11Å; F6-L35 HydrophobicContact CE1-CD2 3.06Å; F6-L35 HydrophobicContact CE2-CD2 3.44Å; F6-L35 VanDerWaalsContact CE2-CD2 3.44Å; F6-L35 HydrophobicContact CG-CD2 4.28Å; F6-L35 HydrophobicContact CZ-CD2 2.9Å; F6-L35 HydrophobicContact CZ-CG 4.32Å | ||
| 7 | E | 40 | Very low | 41.7 | Very low | 50 Ų | 50 | 106.5 Ų | 106.5 | 23% | 0.234 | 53% | 0.525 | C | S | . | . | trans | -103.7 | 141 | 145.8 | -80.6 | 167.2 | 150.5 | 0 | 0 | 104.3 | M12 H13 I16 | E7-M12 HydrophobicContact CG-CB 4.46Å; E7-M12 WeakPolarHBondContact OE1-CB 3.15Å; E7-M12 WeakPolarHBondContact OE2-CB 3.09Å; E7-H13 VanDerWaalsContact C-CD2 3.42Å; E7-H13 WeakPolarHBondContact CB-CD2 3.42Å; E7-H13 PolarHBondContact O-CE1 2.81Å; E7-H13 PolarHBondContact O-ND1 3.36Å; E7-H13 PolarHBondContact O-NE2 3.4Å; E7-H13 WeakPolarHBondContact OE2-CA 3.29Å; E7-H13 PolarHBondContact OE2-N 2.96Å; E7-H13 VanDerWaalsContact OE2-N 3.1Å; E7-I16 HydrophobicContact CG-CD1 3.76Å; E7-I16 WeakPolarHBondContact OE2-CD1 3.36Å; E7-I16 VanDerWaalsContact OE2-CG1 3.32Å; E7-I16 WeakPolarHBondContact OE2-CG1 3.04Å | ||
| 8 | S | 42.2 | Very low | 41.8 | Very low | 68 Ų | 68 | 107.1 Ų | 107.1 | 48% | 0.476 | 53% | 0.531 | S | S | . | . | cis | 78.8 | 102.3 | 40 | 169 | 0 | 0 | 0 | 0 | 114.2 | N10 H13 | S8-N10 PolarHBondContact O-N 2.73Å; S8-H13 VanDerWaalsContact C-CD2 3.46Å; S8-H13 WeakPolarHBondContact CA-NE2 3.32Å; S8-H13 PolarHBondContact N-NE2 3.43Å; S8-H13 PolarHBondContact O-CD2 2.67Å; S8-H13 PolarHBondContact O-NE2 2.96Å | ||
| 9 | P | 39.5 | Very low | 41.9 | Very low | 122 Ų | 122 | 111 Ų | 111 | 79% | 0.792 | 54% | 0.54 | S | S | * | . | S | Bend | trans | -65.3 | 81.5 | -175.7 | 31.9 | -34.6 | 0 | 0 | 0 | 110.2 | ||
| 10 | N | 40.9 | Very low | 42.2 | Very low | 122 Ų | 122 | 106.9 Ų | 106.9 | 65% | 0.652 | 52% | 0.523 | S | S | * | . | S | Bend | trans | -175.9 | 89.6 | -178.3 | -93.1 | -29.6 | 0 | 0 | 0 | 108.7 | S8 M12 | S8-N10 PolarHBondContact O-N 2.73Å; N10-M12 VanDerWaalsContact C-N 3.29Å; N10-M12 PolarHBondContact O-N 3.17Å |
| 11 | F | 45.7 | Very low | 42.4 | Very low | 215 Ų | 215 | 107.8 Ų | 107.8 | 94% | 0.943 | 53% | 0.529 | S | S | * | . | S | Bend | trans | 47.8 | -11.1 | 156.4 | -80.3 | -87.2 | 0 | 0 | 0 | 123.6 | ||
| 12 | M | 44.8 | Very low | 43.1 | Very low | 130 Ų | 130 | 110.2 Ų | 110.2 | 64% | 0.64 | 53% | 0.531 | S | S | * | . | trans | -100.4 | -14.9 | 179.9 | -70.1 | -74.3 | -127.4 | 0 | 0 | 114.1 | E7 N10 Y14 K15 | E7-M12 HydrophobicContact CG-CB 4.46Å; E7-M12 WeakPolarHBondContact OE1-CB 3.15Å; E7-M12 WeakPolarHBondContact OE2-CB 3.09Å; N10-M12 VanDerWaalsContact C-N 3.29Å; N10-M12 PolarHBondContact O-N 3.17Å; M12-Y14 PolarHBondContact O-N 3.39Å; M12-K15 PolarHBondContact O-N 2.99Å; M12-K15 VanDerWaalsContact O-N 3.17Å | ||
| 13 | H | 43.9 | Very low | 43.6 | Very low | 69 Ų | 69 | 112 Ų | 112 | 32% | 0.319 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -49.3 | -31.1 | -173.7 | -98.7 | -115.7 | 0 | 0 | 0 | 116.9 | E7 S8 K15 I17 | E7-H13 VanDerWaalsContact C-CD2 3.42Å; E7-H13 WeakPolarHBondContact CB-CD2 3.42Å; E7-H13 PolarHBondContact O-CE1 2.81Å; E7-H13 PolarHBondContact O-ND1 3.36Å; E7-H13 PolarHBondContact O-NE2 3.4Å; E7-H13 WeakPolarHBondContact OE2-CA 3.29Å; E7-H13 PolarHBondContact OE2-N 2.96Å; E7-H13 VanDerWaalsContact OE2-N 3.1Å; S8-H13 VanDerWaalsContact C-CD2 3.46Å; S8-H13 WeakPolarHBondContact CA-NE2 3.32Å; S8-H13 PolarHBondContact N-NE2 3.43Å; S8-H13 PolarHBondContact O-CD2 2.67Å; S8-H13 PolarHBondContact O-NE2 2.96Å; H13-K15 VanDerWaalsContact C-N 3.27Å; H13-K15 PolarHBondContact O-N 2.71Å; H13-I17 VanDerWaalsContact O-CD1 3.27Å; H13-I17 WeakPolarHBondContact O-CD1 2.85Å; H13-I17 VanDerWaalsContact O-CG1 3.32Å; H13-I17 WeakPolarHBondContact O-CG1 3.13Å |
| 14 | Y | 41.3 | Very low | 44.5 | Very low | 202 Ų | 202 | 107.4 Ų | 107.4 | 79% | 0.792 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -71.7 | -25.7 | -172.7 | -121.4 | -86.8 | 0 | 0 | 0 | 112.4 | M12 | M12-Y14 PolarHBondContact O-N 3.39Å |
| 15 | K | 39.4 | Very low | 44.9 | Very low | 163 Ų | 163 | 111.9 Ų | 111.9 | 71% | 0.709 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -82.5 | -26.5 | -176.9 | -154.6 | 173.8 | -176 | -179.7 | 0 | 112.4 | M12 H13 Y19 | M12-K15 PolarHBondContact O-N 2.99Å; M12-K15 VanDerWaalsContact O-N 3.17Å; H13-K15 VanDerWaalsContact C-N 3.27Å; H13-K15 PolarHBondContact O-N 2.71Å; K15-Y19 WeakPolarHBondContact O-CD2 3.47Å |
| 16 | I | 49 | Very low | 45.4 | Very low | 30 Ų | 30 | 112.1 Ų | 112.1 | 15% | 0.154 | 55% | 0.551 | C | S | . | * | H | α-helix | trans | -82.8 | -32 | -174.7 | -61.5 | -160.9 | 0 | 0 | 0 | 112.8 | I5 E7 N18 Y19 | I5-I16 HydrophobicContact CB-CD1 3.97Å; I5-I16 HydrophobicContact CB-CG2 3.57Å; I5-I16 HydrophobicContact CG2-CD1 3.4Å; I5-I16 HydrophobicContact CG2-CG2 4.08Å; I5-I16 WeakPolarHBondContact O-CG2 3.44Å; E7-I16 HydrophobicContact CG-CD1 3.76Å; E7-I16 WeakPolarHBondContact OE2-CD1 3.36Å; E7-I16 VanDerWaalsContact OE2-CG1 3.32Å; E7-I16 WeakPolarHBondContact OE2-CG1 3.04Å; I16-N18 VanDerWaalsContact C-N 3.3Å; I16-N18 PolarHBondContact O-N 2.59Å; I16-Y19 PolarHBondContact O-N 2.04Å |
| 17 | I | 49.2 | Very low | 45.6 | Very low | 93 Ų | 93 | 111.4 Ų | 111.4 | 48% | 0.477 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -61.5 | -36.3 | -178.5 | -65.6 | 163.5 | 0 | 0 | 0 | 112.1 | H13 | H13-I17 VanDerWaalsContact O-CD1 3.27Å; H13-I17 WeakPolarHBondContact O-CD1 2.85Å; H13-I17 VanDerWaalsContact O-CG1 3.32Å; H13-I17 WeakPolarHBondContact O-CG1 3.13Å |
| 18 | N | 43.4 | Very low | 46 | Very low | 117 Ų | 117 | 110.3 Ų | 110.3 | 63% | 0.626 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -78.7 | -23.7 | -178.4 | -82 | -16.3 | 0 | 0 | 0 | 114.3 | I16 | I16-N18 VanDerWaalsContact C-N 3.3Å; I16-N18 PolarHBondContact O-N 2.59Å |
| 19 | Y | 43.3 | Very low | 46.5 | Very low | 182 Ų | 182 | 111 Ų | 111 | 71% | 0.714 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -79.3 | -29.9 | -179.8 | -87.4 | -90.9 | 0 | 0 | 0 | 112.9 | K15 I16 | K15-Y19 WeakPolarHBondContact O-CD2 3.47Å; I16-Y19 PolarHBondContact O-N 2.04Å |
| 20 | C | 47.5 | Very low | 47.2 | Very low | 28 Ų | 28 | 109 Ų | 109 | 19% | 0.189 | 53% | 0.532 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -79.8 | -12.9 | 175.7 | -66 | 0 | 0 | 0 | 0 | 114 | D3 C4 Y22 E24 | D3-C20 PolarHBondContact O-SG 2.71Å; D3-C20 VanDerWaalsContact O-SG 3.4Å; C4-C20 VanDerWaalsContact CA-SG 3.5Å; C20-Y22 VanDerWaalsContact C-N 3.32Å; C20-Y22 PolarHBondContact O-N 3.23Å; C20-E24 VanDerWaalsContact O-CB 3.25Å; C20-E24 WeakPolarHBondContact O-CB 3.21Å; C20-E24 PolarHBondContact SG-OE2 3.46Å |
| 21 | L | 47.8 | Very low | 47.7 | Very low | 127 Ų | 127 | 106.8 Ų | 106.8 | 67% | 0.665 | 52% | 0.517 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -75.1 | -21.5 | 179.7 | -107.3 | 142.5 | 0 | 0 | 0 | 113.2 | ||
| 22 | Y | 46.2 | Very low | 48.4 | Very low | 216 Ų | 216 | 100.9 Ų | 100.9 | 85% | 0.847 | 49% | 0.494 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -104.1 | -8.6 | -166.7 | -128.8 | -91.7 | 0 | 0 | 0 | 116 | C20 | C20-Y22 VanDerWaalsContact C-N 3.32Å; C20-Y22 PolarHBondContact O-N 3.23Å |
| 23 | S | 48.4 | Very low | 48.8 | Very low | 43 Ų | 43 | 101.3 Ų | 101.3 | 30% | 0.301 | 50% | 0.496 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -136.7 | -5.4 | -170.4 | -149 | 0 | 0 | 0 | 0 | 112.9 | M1 | M1-S23 CarbonylContact C-O 3.53Å; M1-S23 WeakPolarHBondContact CA-O 3.27Å; M1-S23 WeakPolarHBondContact CA-OG 3.13Å; M1-S23 WeakPolarHBondContact CB-O 3.05Å; M1-S23 WeakPolarHBondContact CG-O 2.97Å; M1-S23 WeakPolarHBondContact CG-OG 3.15Å; M1-S23 PolarHBondContact N-OG 3.1Å; M1-S23 VanDerWaalsContact N-OG 3.08Å |
| 24 | E | 52.2 | Low | 49.8 | Very low | 21 Ų | 21 | 102.1 Ų | 102.1 | 10% | 0.098 | 50% | 0.502 | C | S | . | . | trans | -131.2 | 3.6 | -136.9 | -64.6 | -131.4 | 148.7 | 0 | 0 | 120.3 | S2 D3 C4 C20 V26 K27 C28 | S2-E24 WeakPolarHBondContact CA-OE1 2.9Å; S2-E24 VanDerWaalsContact CB-CG 3.43Å; S2-E24 WeakPolarHBondContact CB-O 3.38Å; S2-E24 WeakPolarHBondContact CB-OE2 2.81Å; S2-E24 PolarHBondContact N-OE1 3.42Å; S2-E24 WeakPolarHBondContact OG-CA 3.08Å; S2-E24 PolarHBondContact OG-O 3.46Å; D3-E24 WeakPolarHBondContact CA-OE2 3.48Å; D3-E24 PolarHBondContact N-OE1 3.26Å; D3-E24 PolarHBondContact N-OE2 3.37Å; C4-E24 PolarHBondContact N-OE2 2.89Å; C20-E24 VanDerWaalsContact O-CB 3.25Å; C20-E24 WeakPolarHBondContact O-CB 3.21Å; C20-E24 PolarHBondContact SG-OE2 3.46Å; E24-V26 PolarHBondContact O-N 2.88Å; E24-V26 VanDerWaalsContact O-N 3.1Å; E24-K27 PolarHBondContact O-N 2.86Å; E24-C28 PolarHBondContact O-N 2.78Å | ||
| 25 | T | 51.6 | Low | 50.7 | Low | 113 Ų | 113 | 96.1 Ų | 96.1 | 69% | 0.693 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -56.6 | -38.1 | -161.4 | 53.2 | 0 | 0 | 0 | 0 | 115.8 | T29 | T25-T29 PolarHBondContact O-N 3.14Å |
| 26 | V | 52.6 | Low | 51.6 | Low | 109 Ų | 109 | 92.4 Ų | 92.4 | 66% | 0.661 | 47% | 0.474 | S | S | * | . | H | α-helix | trans | -80.1 | -40.5 | -173.8 | -174.1 | 0 | 0 | 0 | 0 | 114.1 | E24 C28 T29 | E24-V26 PolarHBondContact O-N 2.88Å; E24-V26 VanDerWaalsContact O-N 3.1Å; V26-C28 VanDerWaalsContact C-N 3.3Å; V26-T29 PolarHBondContact O-OG1 3.3Å |
| 27 | K | 49.4 | Very low | 52 | Low | 120 Ų | 120 | 98.8 Ų | 98.8 | 52% | 0.522 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -78.4 | -20.1 | 177.3 | -58.7 | 156 | 167.9 | 177.1 | 0 | 111.8 | M1 S2 E24 K31 | M1-K27 WeakPolarHBondContact O-CD 3.32Å; M1-K27 WeakPolarHBondContact O-CE 3.45Å; M1-K27 PolarHBondContact O-NZ 3.29Å; S2-K27 WeakPolarHBondContact OG-CB 3.25Å; S2-K27 PolarHBondContact OG-N 3.3Å; E24-K27 PolarHBondContact O-N 2.86Å; K27-K31 PolarHBondContact O-N 2.63Å; K27-K31 VanDerWaalsContact O-N 3.08Å |
| 28 | C | 46.8 | Very low | 52.6 | Low | 26 Ų | 26 | 101 Ų | 101 | 18% | 0.176 | 50% | 0.501 | C | S | . | . | H | α-helix | trans | -70.2 | -40.4 | 174.4 | -118 | 0 | 0 | 0 | 0 | 113.3 | C4 E24 V26 V30 K31 I32 | C4-C28 HydrophobicContact CB-CB 4.41Å; C4-C28 WeakPolarHBondContact CB-SG 2.88Å; C4-C28 WeakPolarHBondContact SG-CA 3.34Å; C4-C28 WeakPolarHBondContact SG-CB 3.45Å; C4-C28 CovalentContact SG-SG 2.04Å; C4-C28 PolarHBondContact SG-SG 3.42Å; E24-C28 PolarHBondContact O-N 2.78Å; V26-C28 VanDerWaalsContact C-N 3.3Å; C28-V30 VanDerWaalsContact C-N 3.28Å; C28-V30 PolarHBondContact O-N 2.96Å; C28-K31 PolarHBondContact O-N 2.87Å; C28-I32 WeakPolarHBondContact O-CB 2.99Å; C28-I32 WeakPolarHBondContact O-CD1 3.42Å; C28-I32 WeakPolarHBondContact O-CG1 3.28Å; C28-I32 PolarHBondContact O-N 3.19Å |
| 29 | T | 52.5 | Low | 53.2 | Low | 84 Ų | 84 | 99 Ų | 99 | 52% | 0.515 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -60.5 | -40.6 | 176 | 48.7 | 0 | 0 | 0 | 0 | 111.5 | T25 V26 M33 | T25-T29 PolarHBondContact O-N 3.14Å; V26-T29 PolarHBondContact O-OG1 3.3Å; T29-M33 WeakPolarHBondContact O-CB 3.11Å; T29-M33 PolarHBondContact O-N 3.43Å |
| 30 | V | 54.4 | Low | 53.8 | Low | 80 Ų | 80 | 92.8 Ų | 92.8 | 49% | 0.485 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -65.1 | -46.9 | 175.8 | -178.7 | 0 | 0 | 0 | 0 | 111.5 | C28 I32 M33 I34 | C28-V30 VanDerWaalsContact C-N 3.28Å; C28-V30 PolarHBondContact O-N 2.96Å; V30-I32 PolarHBondContact O-N 3.47Å; V30-M33 PolarHBondContact O-N 3.46Å; V30-I34 HydrophobicContact CG1-CD1 3.83Å; V30-I34 HydrophobicContact CG1-CG1 4.47Å; V30-I34 VanDerWaalsContact O-CG1 3.31Å; V30-I34 WeakPolarHBondContact O-CG1 3.46Å; V30-I34 PolarHBondContact O-N 2.98Å |
| 31 | K | 52.2 | Low | 54.3 | Low | 75 Ų | 75 | 95.9 Ų | 95.9 | 33% | 0.326 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -62.3 | -41.4 | 178.6 | -78.7 | 178.5 | 173.6 | 175.2 | 0 | 112.3 | S2 D3 C4 K27 C28 I34 L35 | S2-K31 PolarHBondContact O-NZ 3.48Å; D3-K31 IonicContact OD1-NZ 3.5Å; C4-K31 HydrophobicContact CB-CB 4.5Å; C4-K31 HydrophobicContact CB-CD 3.62Å; C4-K31 PolarHBondContact O-NZ 3.08Å; K27-K31 PolarHBondContact O-N 2.63Å; K27-K31 VanDerWaalsContact O-N 3.08Å; C28-K31 PolarHBondContact O-N 2.87Å; K31-I34 PolarHBondContact O-N 3.28Å; K31-L35 PolarHBondContact O-N 3.08Å |
| 32 | I | 59.9 | Low | 54.7 | Low | 91 Ų | 91 | 95.7 Ų | 95.7 | 47% | 0.467 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -63.8 | -45.4 | 176.1 | -66.2 | 164 | 0 | 0 | 0 | 110.2 | C28 V30 I34 L35 V36 | C28-I32 WeakPolarHBondContact O-CB 2.99Å; C28-I32 WeakPolarHBondContact O-CD1 3.42Å; C28-I32 WeakPolarHBondContact O-CG1 3.28Å; C28-I32 PolarHBondContact O-N 3.19Å; V30-I32 PolarHBondContact O-N 3.47Å; I32-I34 VanDerWaalsContact C-N 3.34Å; I32-I34 PolarHBondContact O-N 2.98Å; I32-L35 PolarHBondContact O-N 2.89Å; I32-V36 HydrophobicContact CG2-CG2 4.23Å; I32-V36 VanDerWaalsContact O-CG2 3.28Å; I32-V36 WeakPolarHBondContact O-CG2 3.47Å; I32-V36 PolarHBondContact O-N 3.24Å |
| 33 | M | 54.1 | Low | 55.4 | Low | 138 Ų | 138 | 88.8 Ų | 88.8 | 68% | 0.68 | 47% | 0.467 | S | S | * | . | H | α-helix | trans | -61.1 | -43.4 | 179.3 | -169.4 | -175 | -60.7 | 0 | 0 | 111.8 | T29 V30 V36 Y37 | T29-M33 WeakPolarHBondContact O-CB 3.11Å; T29-M33 PolarHBondContact O-N 3.43Å; V30-M33 PolarHBondContact O-N 3.46Å; M33-V36 PolarHBondContact O-N 3.46Å; M33-Y37 WeakPolarHBondContact O-CB 3.31Å; M33-Y37 PolarHBondContact O-N 2.97Å |
| 34 | I | 63.9 | Low | 55.9 | Low | 87 Ų | 87 | 93.2 Ų | 93.2 | 45% | 0.446 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -62.2 | -46.9 | 176.1 | -68.9 | 168.7 | 0 | 0 | 0 | 110.3 | V30 K31 I32 V36 Y37 Y38 | V30-I34 HydrophobicContact CG1-CD1 3.83Å; V30-I34 HydrophobicContact CG1-CG1 4.47Å; V30-I34 VanDerWaalsContact O-CG1 3.31Å; V30-I34 WeakPolarHBondContact O-CG1 3.46Å; V30-I34 PolarHBondContact O-N 2.98Å; K31-I34 PolarHBondContact O-N 3.28Å; I32-I34 VanDerWaalsContact C-N 3.34Å; I32-I34 PolarHBondContact O-N 2.98Å; I34-V36 PolarHBondContact O-N 2.98Å; I34-Y37 WeakPolarHBondContact O-CB 3.35Å; I34-Y37 PolarHBondContact O-N 3.02Å; I34-Y38 HydrophobicContact CG2-CD2 3.54Å; I34-Y38 HydrophobicContact CG2-CE2 3.53Å; I34-Y38 VanDerWaalsContact O-CD2 3.27Å; I34-Y38 WeakPolarHBondContact O-CD2 3.36Å; I34-Y38 PolarHBondContact O-N 2.92Å |
| 35 | L | 60.8 | Low | 56.3 | Low | 75 Ų | 75 | 98 Ų | 98 | 39% | 0.393 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -65.4 | -41.1 | -179.6 | -168.4 | 79.3 | 0 | 0 | 0 | 112.6 | F6 K31 I32 Y37 Y38 S39 | F6-L35 HydrophobicContact CD1-CD2 3.78Å; F6-L35 HydrophobicContact CD2-CD2 4.11Å; F6-L35 HydrophobicContact CE1-CD2 3.06Å; F6-L35 HydrophobicContact CE2-CD2 3.44Å; F6-L35 VanDerWaalsContact CE2-CD2 3.44Å; F6-L35 HydrophobicContact CG-CD2 4.28Å; F6-L35 HydrophobicContact CZ-CD2 2.9Å; F6-L35 HydrophobicContact CZ-CG 4.32Å; K31-L35 PolarHBondContact O-N 3.08Å; I32-L35 PolarHBondContact O-N 2.89Å; L35-Y37 VanDerWaalsContact C-N 3.26Å; L35-Y37 PolarHBondContact O-N 3.07Å; L35-Y38 PolarHBondContact O-N 3.46Å; L35-S39 WeakPolarHBondContact O-CB 3.25Å; L35-S39 PolarHBondContact O-N 2.81Å |
| 36 | V | 59.4 | Low | 56.9 | Low | 85 Ų | 85 | 98 Ų | 98 | 52% | 0.515 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -60.9 | -39.7 | 175.2 | 172.3 | 0 | 0 | 0 | 0 | 110.3 | I32 M33 I34 S40 | I32-V36 HydrophobicContact CG2-CG2 4.23Å; I32-V36 VanDerWaalsContact O-CG2 3.28Å; I32-V36 WeakPolarHBondContact O-CG2 3.47Å; I32-V36 PolarHBondContact O-N 3.24Å; M33-V36 PolarHBondContact O-N 3.46Å; I34-V36 PolarHBondContact O-N 2.98Å; V36-S40 VanDerWaalsContact O-CB 3.25Å; V36-S40 WeakPolarHBondContact O-CB 3.32Å; V36-S40 PolarHBondContact O-N 2.88Å; V36-S40 PolarHBondContact O-OG 2.79Å |
| 37 | Y | 57.2 | Low | 57.8 | Low | 164 Ų | 164 | 97.7 Ų | 97.7 | 64% | 0.643 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -64.5 | -44.6 | 174.9 | -166.7 | -96.1 | 0 | 0 | 0 | 111.9 | M33 I34 L35 S40 F41 | M33-Y37 WeakPolarHBondContact O-CB 3.31Å; M33-Y37 PolarHBondContact O-N 2.97Å; I34-Y37 WeakPolarHBondContact O-CB 3.35Å; I34-Y37 PolarHBondContact O-N 3.02Å; L35-Y37 VanDerWaalsContact C-N 3.26Å; L35-Y37 PolarHBondContact O-N 3.07Å; Y37-S40 PolarHBondContact O-N 3.4Å; Y37-F41 VanDerWaalsContact O-CB 3.29Å; Y37-F41 WeakPolarHBondContact O-CB 3.42Å; Y37-F41 PolarHBondContact O-N 3.3Å |
| 38 | Y | 60.5 | Low | 58.7 | Low | 141 Ų | 141 | 99 Ų | 99 | 55% | 0.553 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -63.9 | -44.1 | 175.9 | -88.4 | -75.8 | 0 | 0 | 0 | 112.7 | I34 L35 S40 F41 M42 | I34-Y38 HydrophobicContact CG2-CD2 3.54Å; I34-Y38 HydrophobicContact CG2-CE2 3.53Å; I34-Y38 VanDerWaalsContact O-CD2 3.27Å; I34-Y38 WeakPolarHBondContact O-CD2 3.36Å; I34-Y38 PolarHBondContact O-N 2.92Å; L35-Y38 PolarHBondContact O-N 3.46Å; Y38-S40 VanDerWaalsContact C-N 3.32Å; Y38-S40 PolarHBondContact O-N 3.2Å; Y38-F41 PolarHBondContact O-N 3.36Å; Y38-M42 WeakPolarHBondContact O-CB 3.43Å; Y38-M42 VanDerWaalsContact O-CG 3.3Å; Y38-M42 WeakPolarHBondContact O-CG 3.36Å; Y38-M42 PolarHBondContact O-N 2.84Å |
| 39 | S | 57 | Low | 59.8 | Low | 73 Ų | 73 | 100.7 Ų | 100.7 | 51% | 0.51 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -63.2 | -39.9 | 176.4 | -171.7 | 0 | 0 | 0 | 0 | 111.4 | L35 T43 | L35-S39 WeakPolarHBondContact O-CB 3.25Å; L35-S39 PolarHBondContact O-N 2.81Å; S39-T43 WeakPolarHBondContact O-CB 3.29Å; S39-T43 WeakPolarHBondContact O-CG2 3.31Å; S39-T43 PolarHBondContact O-N 3.22Å; S39-T43 VanDerWaalsContact O-N 3.07Å; S39-T43 PolarHBondContact O-OG1 2.88Å |
| 40 | S | 55.9 | Low | 60.8 | Low | 52 Ų | 52 | 104 Ų | 104 | 36% | 0.364 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -70.4 | -33.7 | 177 | -59.8 | 0 | 0 | 0 | 0 | 112.6 | V36 Y37 Y38 T43 K44 | V36-S40 VanDerWaalsContact O-CB 3.25Å; V36-S40 WeakPolarHBondContact O-CB 3.32Å; V36-S40 PolarHBondContact O-N 2.88Å; V36-S40 PolarHBondContact O-OG 2.79Å; Y37-S40 PolarHBondContact O-N 3.4Å; Y38-S40 VanDerWaalsContact C-N 3.32Å; Y38-S40 PolarHBondContact O-N 3.2Å; S40-T43 WeakPolarHBondContact CA-OG1 3.34Å; S40-T43 PolarHBondContact O-OG1 3.42Å; S40-K44 WeakPolarHBondContact O-CG 3.27Å; S40-K44 PolarHBondContact O-N 2.77Å |
| 41 | F | 57.5 | Low | 61.7 | Low | 93 Ų | 93 | 104.4 Ų | 104.4 | 41% | 0.408 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -69.8 | -51.1 | 175.2 | -169.1 | -96.4 | 0 | 0 | 0 | 110.2 | Y37 Y38 T43 K44 F45 | Y37-F41 VanDerWaalsContact O-CB 3.29Å; Y37-F41 WeakPolarHBondContact O-CB 3.42Å; Y37-F41 PolarHBondContact O-N 3.3Å; Y38-F41 PolarHBondContact O-N 3.36Å; F41-T43 VanDerWaalsContact C-N 3.3Å; F41-T43 PolarHBondContact O-N 3.37Å; F41-K44 PolarHBondContact O-N 3.39Å; F41-K44 VanDerWaalsContact O-N 3.12Å; F41-F45 AromaticContact CD1-CD2 3.67Å; F41-F45 HydrophobicContact CD1-CD2 3.67Å; F41-F45 AromaticContact CD1-CE2 3.7Å; F41-F45 HydrophobicContact CD1-CE2 3.7Å; F41-F45 HydrophobicContact CD2-CD2 4.34Å; F41-F45 AromaticContact CD2-CE2 3.81Å; F41-F45 HydrophobicContact CD2-CE2 3.81Å; F41-F45 AromaticContact CE1-CD2 3.53Å; F41-F45 HydrophobicContact CE1-CD2 3.53Å; F41-F45 AromaticContact CE1-CE2 3.2Å; F41-F45 HydrophobicContact CE1-CE2 3.2Å; F41-F45 HydrophobicContact CE1-CG 4.5Å; F41-F45 AromaticContact CE1-CZ 3.88Å; F41-F45 HydrophobicContact CE1-CZ 3.88Å; F41-F45 HydrophobicContact CE2-CD2 4.24Å; F41-F45 AromaticContact CE2-CE2 3.34Å; F41-F45 HydrophobicContact CE2-CE2 3.34Å; F41-F45 HydrophobicContact CE2-CZ 4.05Å; F41-F45 HydrophobicContact CG-CD2 4.1Å; F41-F45 HydrophobicContact CG-CE2 4Å; F41-F45 AromaticContact CZ-CD2 3.85Å; F41-F45 HydrophobicContact CZ-CD2 3.85Å; F41-F45 AromaticContact CZ-CE2 3.01Å; F41-F45 HydrophobicContact CZ-CE2 3.01Å; F41-F45 AromaticContact CZ-CZ 3.49Å; F41-F45 HydrophobicContact CZ-CZ 3.49Å; F41-F45 VanDerWaalsContact CZ-CZ 3.49Å; F41-F45 WeakPolarHBondContact O-CD2 3.44Å; F41-F45 PolarHBondContact O-N 3.29Å; F41-F45 VanDerWaalsContact O-N 3.09Å |
| 42 | M | 56.7 | Low | 62.7 | Low | 124 Ų | 124 | 107.2 Ų | 107.2 | 61% | 0.611 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -58.6 | -39.8 | 179.6 | -72.7 | -64 | -173.4 | 0 | 0 | 112.6 | Y38 N46 | Y38-M42 WeakPolarHBondContact O-CB 3.43Å; Y38-M42 VanDerWaalsContact O-CG 3.3Å; Y38-M42 WeakPolarHBondContact O-CG 3.36Å; Y38-M42 PolarHBondContact O-N 2.84Å; M42-N46 WeakPolarHBondContact O-CB 3.42Å; M42-N46 PolarHBondContact O-N 2.87Å |
| 43 | T | 59.5 | Low | 63.3 | Low | 71 Ų | 71 | 107 Ų | 107 | 44% | 0.436 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -66 | -40.4 | 177 | 44.6 | 0 | 0 | 0 | 0 | 112.5 | S39 S40 F41 N46 I47 | S39-T43 WeakPolarHBondContact O-CB 3.29Å; S39-T43 WeakPolarHBondContact O-CG2 3.31Å; S39-T43 PolarHBondContact O-N 3.22Å; S39-T43 VanDerWaalsContact O-N 3.07Å; S39-T43 PolarHBondContact O-OG1 2.88Å; S40-T43 WeakPolarHBondContact CA-OG1 3.34Å; S40-T43 PolarHBondContact O-OG1 3.42Å; F41-T43 VanDerWaalsContact C-N 3.3Å; F41-T43 PolarHBondContact O-N 3.37Å; T43-N46 PolarHBondContact O-N 3.29Å; T43-I47 WeakPolarHBondContact O-CD1 3.15Å; T43-I47 VanDerWaalsContact O-CG1 3.27Å; T43-I47 WeakPolarHBondContact O-CG1 3.27Å; T43-I47 PolarHBondContact O-N 3.16Å; T43-I47 VanDerWaalsContact O-N 3.07Å |
| 44 | K | 59.4 | Low | 64.3 | Low | 136 Ų | 136 | 104.5 Ų | 104.5 | 59% | 0.591 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -62.8 | -46.9 | 175.7 | -73.9 | 178.5 | -178.3 | -178 | 0 | 112.1 | S40 F41 N46 I47 F48 | S40-K44 WeakPolarHBondContact O-CG 3.27Å; S40-K44 PolarHBondContact O-N 2.77Å; F41-K44 PolarHBondContact O-N 3.39Å; F41-K44 VanDerWaalsContact O-N 3.12Å; K44-N46 VanDerWaalsContact C-N 3.31Å; K44-N46 PolarHBondContact O-N 2.91Å; K44-I47 PolarHBondContact O-N 3.09Å; K44-F48 WeakPolarHBondContact O-CD2 3.3Å; K44-F48 PolarHBondContact O-N 3.01Å; K44-F48 VanDerWaalsContact O-N 3.16Å |
| 45 | F | 60.6 | Low | 64.8 | Low | 121 Ų | 121 | 106.4 Ų | 106.4 | 53% | 0.531 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -63 | -38.4 | 177.9 | -83 | -90.7 | 0 | 0 | 0 | 112.4 | F41 F48 S49 | F41-F45 AromaticContact CD1-CD2 3.67Å; F41-F45 HydrophobicContact CD1-CD2 3.67Å; F41-F45 AromaticContact CD1-CE2 3.7Å; F41-F45 HydrophobicContact CD1-CE2 3.7Å; F41-F45 HydrophobicContact CD2-CD2 4.34Å; F41-F45 AromaticContact CD2-CE2 3.81Å; F41-F45 HydrophobicContact CD2-CE2 3.81Å; F41-F45 AromaticContact CE1-CD2 3.53Å; F41-F45 HydrophobicContact CE1-CD2 3.53Å; F41-F45 AromaticContact CE1-CE2 3.2Å; F41-F45 HydrophobicContact CE1-CE2 3.2Å; F41-F45 HydrophobicContact CE1-CG 4.5Å; F41-F45 AromaticContact CE1-CZ 3.88Å; F41-F45 HydrophobicContact CE1-CZ 3.88Å; F41-F45 HydrophobicContact CE2-CD2 4.24Å; F41-F45 AromaticContact CE2-CE2 3.34Å; F41-F45 HydrophobicContact CE2-CE2 3.34Å; F41-F45 HydrophobicContact CE2-CZ 4.05Å; F41-F45 HydrophobicContact CG-CD2 4.1Å; F41-F45 HydrophobicContact CG-CE2 4Å; F41-F45 AromaticContact CZ-CD2 3.85Å; F41-F45 HydrophobicContact CZ-CD2 3.85Å; F41-F45 AromaticContact CZ-CE2 3.01Å; F41-F45 HydrophobicContact CZ-CE2 3.01Å; F41-F45 AromaticContact CZ-CZ 3.49Å; F41-F45 HydrophobicContact CZ-CZ 3.49Å; F41-F45 VanDerWaalsContact CZ-CZ 3.49Å; F41-F45 WeakPolarHBondContact O-CD2 3.44Å; F41-F45 PolarHBondContact O-N 3.29Å; F41-F45 VanDerWaalsContact O-N 3.09Å; F45-F48 PolarHBondContact O-N 3.36Å; F45-S49 WeakPolarHBondContact O-CB 3.37Å; F45-S49 PolarHBondContact O-N 2.92Å |
| 46 | N | 64.6 | Low | 65.4 | Low | 113 Ų | 113 | 108 Ų | 108 | 60% | 0.604 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -65.9 | -39.8 | 178.7 | -161.5 | 15.2 | 0 | 0 | 0 | 111.8 | M42 T43 K44 S49 Y50 | M42-N46 WeakPolarHBondContact O-CB 3.42Å; M42-N46 PolarHBondContact O-N 2.87Å; T43-N46 PolarHBondContact O-N 3.29Å; K44-N46 VanDerWaalsContact C-N 3.31Å; K44-N46 PolarHBondContact O-N 2.91Å; N46-S49 PolarHBondContact O-N 3.32Å; N46-Y50 VanDerWaalsContact O-CB 3.31Å; N46-Y50 WeakPolarHBondContact O-CB 3.36Å; N46-Y50 PolarHBondContact O-N 3.07Å |
| 47 | I | 70.3 | Confident | 66.1 | Low | 102 Ų | 102 | 113 Ų | 113 | 52% | 0.523 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -64 | -44.7 | 176.8 | -66.7 | 161.3 | 0 | 0 | 0 | 111.1 | T43 K44 Y50 L51 | T43-I47 WeakPolarHBondContact O-CD1 3.15Å; T43-I47 VanDerWaalsContact O-CG1 3.27Å; T43-I47 WeakPolarHBondContact O-CG1 3.27Å; T43-I47 PolarHBondContact O-N 3.16Å; T43-I47 VanDerWaalsContact O-N 3.07Å; K44-I47 PolarHBondContact O-N 3.09Å; I47-Y50 PolarHBondContact O-N 2.93Å; I47-L51 HydrophobicContact CG2-CD1 3.87Å; I47-L51 HydrophobicContact CG2-CG 4.43Å; I47-L51 WeakPolarHBondContact O-CB 3.43Å; I47-L51 WeakPolarHBondContact O-CG 3.44Å; I47-L51 PolarHBondContact O-N 3.12Å |
| 48 | F | 68.9 | Low | 66.9 | Low | 147 Ų | 147 | 107.2 Ų | 107.2 | 65% | 0.645 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -63.4 | -41.7 | 176.6 | -78.1 | -69 | 0 | 0 | 0 | 112.2 | K44 F45 L51 F52 | K44-F48 WeakPolarHBondContact O-CD2 3.3Å; K44-F48 PolarHBondContact O-N 3.01Å; K44-F48 VanDerWaalsContact O-N 3.16Å; F45-F48 PolarHBondContact O-N 3.36Å; F48-L51 PolarHBondContact O-N 3.31Å; F48-F52 WeakPolarHBondContact O-CB 3.33Å; F48-F52 PolarHBondContact O-N 3.48Å |
| 49 | S | 70.5 | Confident | 67.5 | Low | 63 Ų | 63 | 102 Ų | 102 | 44% | 0.441 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -63.4 | -43 | 176.5 | -173.1 | 0 | 0 | 0 | 0 | 111.6 | F45 N46 F52 L53 | F45-S49 WeakPolarHBondContact O-CB 3.37Å; F45-S49 PolarHBondContact O-N 2.92Å; N46-S49 PolarHBondContact O-N 3.32Å; S49-F52 PolarHBondContact O-N 3.38Å; S49-L53 WeakPolarHBondContact O-CB 3.33Å; S49-L53 WeakPolarHBondContact O-CG 3.48Å; S49-L53 PolarHBondContact O-N 3.32Å |
| 50 | Y | 72.4 | Confident | 68.1 | Low | 153 Ų | 153 | 103 Ų | 103 | 60% | 0.6 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -66.2 | -43 | 178.5 | -167.5 | -104.5 | 0 | 0 | 0 | 112.3 | N46 I47 L53 I54 | N46-Y50 VanDerWaalsContact O-CB 3.31Å; N46-Y50 WeakPolarHBondContact O-CB 3.36Å; N46-Y50 PolarHBondContact O-N 3.07Å; I47-Y50 PolarHBondContact O-N 2.93Å; Y50-L53 PolarHBondContact O-N 2.92Å; Y50-I54 HydrophobicContact CD1-CD1 3.53Å; Y50-I54 HydrophobicContact CD1-CG1 4.41Å; Y50-I54 HydrophobicContact CE1-CD1 3.24Å; Y50-I54 HydrophobicContact CE1-CG1 4.21Å; Y50-I54 HydrophobicContact CG-CD1 4.43Å; Y50-I54 WeakPolarHBondContact O-CG1 3.35Å; Y50-I54 PolarHBondContact O-N 3.41Å |
| 51 | L | 73.7 | Confident | 68.9 | Low | 88 Ų | 88 | 106 Ų | 106 | 46% | 0.461 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -62.9 | -42.4 | 174.5 | -75.9 | 168.6 | 0 | 0 | 0 | 112 | I47 F48 L53 I54 L55 | I47-L51 HydrophobicContact CG2-CD1 3.87Å; I47-L51 HydrophobicContact CG2-CG 4.43Å; I47-L51 WeakPolarHBondContact O-CB 3.43Å; I47-L51 WeakPolarHBondContact O-CG 3.44Å; I47-L51 PolarHBondContact O-N 3.12Å; F48-L51 PolarHBondContact O-N 3.31Å; L51-L53 VanDerWaalsContact C-N 3.35Å; L51-I54 PolarHBondContact O-N 2.96Å; L51-L55 WeakPolarHBondContact O-CB 3.44Å; L51-L55 WeakPolarHBondContact O-CG 3.45Å; L51-L55 PolarHBondContact O-N 2.92Å |
| 52 | F | 73.7 | Confident | 69.5 | Low | 134 Ų | 134 | 107.7 Ų | 107.7 | 59% | 0.588 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -62.3 | -42.7 | 175.5 | -177.5 | -96.2 | 0 | 0 | 0 | 111.4 | F48 S49 L55 H56 | F48-F52 WeakPolarHBondContact O-CB 3.33Å; F48-F52 PolarHBondContact O-N 3.48Å; S49-F52 PolarHBondContact O-N 3.38Å; F52-L55 PolarHBondContact O-N 2.84Å; F52-H56 HydrophobicContact CE1-CB 4.42Å; F52-H56 WeakPolarHBondContact O-CB 3.36Å; F52-H56 PolarHBondContact O-N 2.78Å |
| 53 | L | 73.3 | Confident | 70.2 | Confident | 86 Ų | 86 | 105.6 Ų | 105.6 | 45% | 0.45 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -64.3 | -39.4 | 176 | -75.1 | 171.7 | 0 | 0 | 0 | 112.4 | S49 Y50 L51 R57 | S49-L53 WeakPolarHBondContact O-CB 3.33Å; S49-L53 WeakPolarHBondContact O-CG 3.48Å; S49-L53 PolarHBondContact O-N 3.32Å; Y50-L53 PolarHBondContact O-N 2.92Å; L51-L53 VanDerWaalsContact C-N 3.35Å; L53-R57 WeakPolarHBondContact O-CB 3.16Å; L53-R57 VanDerWaalsContact O-CG 3.23Å; L53-R57 WeakPolarHBondContact O-CG 3.23Å; L53-R57 PolarHBondContact O-N 2.97Å |
| 54 | I | 74.4 | Confident | 70.5 | Confident | 87 Ų | 87 | 106.9 Ų | 106.9 | 45% | 0.446 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -65.5 | -46.5 | 175.7 | -70.5 | 167.5 | 0 | 0 | 0 | 110.7 | Y50 L51 G58 | Y50-I54 HydrophobicContact CD1-CD1 3.53Å; Y50-I54 HydrophobicContact CD1-CG1 4.41Å; Y50-I54 HydrophobicContact CE1-CD1 3.24Å; Y50-I54 HydrophobicContact CE1-CG1 4.21Å; Y50-I54 HydrophobicContact CG-CD1 4.43Å; Y50-I54 WeakPolarHBondContact O-CG1 3.35Å; Y50-I54 PolarHBondContact O-N 3.41Å; L51-I54 PolarHBondContact O-N 2.96Å; I54-G58 WeakPolarHBondContact O-CA 3.41Å; I54-G58 PolarHBondContact O-N 2.96Å |
| 55 | L | 73.6 | Confident | 71.2 | Confident | 127 Ų | 127 | 104.6 Ų | 104.6 | 67% | 0.665 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -64.9 | -42.7 | 178.8 | -76.8 | 167.7 | 0 | 0 | 0 | 111.6 | L51 F52 G59 | L51-L55 WeakPolarHBondContact O-CB 3.44Å; L51-L55 WeakPolarHBondContact O-CG 3.45Å; L51-L55 PolarHBondContact O-N 2.92Å; F52-L55 PolarHBondContact O-N 2.84Å; L55-G59 WeakPolarHBondContact O-CA 3.48Å; L55-G59 PolarHBondContact O-N 3.4Å |
| 56 | H | 74.8 | Confident | 71.5 | Confident | 109 Ų | 109 | 106.1 Ų | 106.1 | 51% | 0.505 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -69.6 | -42.4 | 179 | -167.3 | -78.6 | 0 | 0 | 0 | 111.3 | F52 L60 | F52-H56 HydrophobicContact CE1-CB 4.42Å; F52-H56 WeakPolarHBondContact O-CB 3.36Å; F52-H56 PolarHBondContact O-N 2.78Å; H56-L60 WeakPolarHBondContact O-CB 3.33Å; H56-L60 PolarHBondContact O-N 3.04Å |
| 57 | R | 73.1 | Confident | 71.5 | Confident | 190 Ų | 190 | 105.7 Ų | 105.7 | 72% | 0.717 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -67.8 | -44.2 | 176 | -75.4 | -177.3 | 171 | -163.5 | -1.5 | 112 | L53 L61 | L53-R57 WeakPolarHBondContact O-CB 3.16Å; L53-R57 VanDerWaalsContact O-CG 3.23Å; L53-R57 WeakPolarHBondContact O-CG 3.23Å; L53-R57 PolarHBondContact O-N 2.97Å; R57-L61 WeakPolarHBondContact O-CB 3.28Å; R57-L61 PolarHBondContact O-N 3.35Å |
| 58 | G | 74.5 | Confident | 71.1 | Confident | 41 Ų | 41 | 104.1 Ų | 104.1 | 42% | 0.423 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -67 | -44.4 | 178.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | I54 L61 L62 | I54-G58 WeakPolarHBondContact O-CA 3.41Å; I54-G58 PolarHBondContact O-N 2.96Å; G58-L61 PolarHBondContact O-N 2.78Å; G58-L62 PolarHBondContact O-N 2.8Å |
| 59 | G | 72.1 | Confident | 70.8 | Confident | 33 Ų | 33 | 101.2 Ų | 101.2 | 34% | 0.34 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -64.2 | -43.8 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | L55 L61 L62 V63 | L55-G59 WeakPolarHBondContact O-CA 3.48Å; L55-G59 PolarHBondContact O-N 3.4Å; G59-L61 VanDerWaalsContact C-N 3.32Å; G59-L61 PolarHBondContact O-N 3.38Å; G59-L62 PolarHBondContact O-N 2.92Å; G59-V63 WeakPolarHBondContact O-CG2 3.18Å; G59-V63 PolarHBondContact O-N 3.42Å |
| 60 | L | 71.4 | Confident | 70.2 | Confident | 93 Ų | 93 | 103 Ų | 103 | 49% | 0.487 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -61.9 | -40.4 | 175.2 | -174.7 | 71.4 | 0 | 0 | 0 | 111.5 | H56 V63 L64 | H56-L60 WeakPolarHBondContact O-CB 3.33Å; H56-L60 PolarHBondContact O-N 3.04Å; L60-V63 PolarHBondContact O-N 2.88Å; L60-L64 HydrophobicContact CG-CD1 4.15Å; L60-L64 WeakPolarHBondContact O-CB 3.04Å; L60-L64 PolarHBondContact O-N 2.85Å |
| 61 | L | 71.1 | Confident | 69.3 | Low | 116 Ų | 116 | 98.4 Ų | 98.4 | 61% | 0.607 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -63.3 | -43.8 | 175.5 | -169.9 | 73.7 | 0 | 0 | 0 | 111.2 | R57 G58 G59 V63 L64 V65 | R57-L61 WeakPolarHBondContact O-CB 3.28Å; R57-L61 PolarHBondContact O-N 3.35Å; G58-L61 PolarHBondContact O-N 2.78Å; G59-L61 VanDerWaalsContact C-N 3.32Å; G59-L61 PolarHBondContact O-N 3.38Å; L61-V63 PolarHBondContact O-N 3.29Å; L61-L64 PolarHBondContact O-N 3.49Å; L61-V65 VanDerWaalsContact O-CG2 3.28Å; L61-V65 WeakPolarHBondContact O-CG2 3.33Å; L61-V65 PolarHBondContact O-N 3.41Å |
| 62 | L | 70.9 | Confident | 68.3 | Low | 127 Ų | 127 | 98.4 Ų | 98.4 | 67% | 0.665 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -61.7 | -44.1 | 177.1 | -172.6 | 70.7 | 0 | 0 | 0 | 111.5 | G58 G59 V65 Y66 | G58-L62 PolarHBondContact O-N 2.8Å; G59-L62 PolarHBondContact O-N 2.92Å; L62-V65 PolarHBondContact O-N 2.92Å; L62-Y66 WeakPolarHBondContact O-CB 3.33Å; L62-Y66 PolarHBondContact O-N 3.23Å |
| 63 | V | 70.2 | Confident | 67.4 | Low | 81 Ų | 81 | 97.4 Ų | 97.4 | 49% | 0.491 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -64.5 | -42.4 | 176.1 | 173.7 | 0 | 0 | 0 | 0 | 110.9 | G59 L60 L61 Y66 M67 | G59-V63 WeakPolarHBondContact O-CG2 3.18Å; G59-V63 PolarHBondContact O-N 3.42Å; L60-V63 PolarHBondContact O-N 2.88Å; L61-V63 PolarHBondContact O-N 3.29Å; V63-Y66 PolarHBondContact O-N 3.44Å; V63-M67 HydrophobicContact CG1-CG 4.23Å; V63-M67 WeakPolarHBondContact O-CB 3.26Å; V63-M67 VanDerWaalsContact O-CG 3.23Å; V63-M67 WeakPolarHBondContact O-CG 3.49Å; V63-M67 PolarHBondContact O-N 2.89Å |
| 64 | L | 67.8 | Low | 66.2 | Low | 97 Ų | 97 | 97.4 Ų | 97.4 | 51% | 0.508 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -60.6 | -46.4 | 175.6 | -97.1 | 156.5 | 0 | 0 | 0 | 111.9 | L60 L61 M67 S68 | L60-L64 HydrophobicContact CG-CD1 4.15Å; L60-L64 WeakPolarHBondContact O-CB 3.04Å; L60-L64 PolarHBondContact O-N 2.85Å; L61-L64 PolarHBondContact O-N 3.49Å; L64-M67 PolarHBondContact O-N 2.92Å; L64-S68 VanDerWaalsContact O-CB 3.26Å; L64-S68 WeakPolarHBondContact O-CB 3.43Å; L64-S68 PolarHBondContact O-N 2.94Å; L64-S68 PolarHBondContact O-OG 3.42Å |
| 65 | V | 72.4 | Confident | 64.9 | Low | 89 Ų | 89 | 102.3 Ų | 102.3 | 54% | 0.539 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -64 | -43.3 | 178.4 | 171.8 | 0 | 0 | 0 | 0 | 110.6 | L61 L62 S68 A69 | L61-V65 VanDerWaalsContact O-CG2 3.28Å; L61-V65 WeakPolarHBondContact O-CG2 3.33Å; L61-V65 PolarHBondContact O-N 3.41Å; L62-V65 PolarHBondContact O-N 2.92Å; V65-S68 PolarHBondContact O-N 2.65Å; V65-A69 WeakPolarHBondContact O-CB 3.23Å; V65-A69 PolarHBondContact O-N 3.13Å |
| 66 | Y | 68.2 | Low | 63.8 | Low | 152 Ų | 152 | 102.1 Ų | 102.1 | 60% | 0.596 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -61.6 | -49.1 | 176.7 | -173.6 | -104.5 | 0 | 0 | 0 | 111.7 | L62 V63 S68 A69 L70 | L62-Y66 WeakPolarHBondContact O-CB 3.33Å; L62-Y66 PolarHBondContact O-N 3.23Å; V63-Y66 PolarHBondContact O-N 3.44Å; Y66-S68 VanDerWaalsContact C-N 3.3Å; Y66-S68 PolarHBondContact O-N 3.06Å; Y66-A69 PolarHBondContact O-N 3Å; Y66-A69 VanDerWaalsContact O-N 3.13Å; Y66-L70 HydrophobicContact CD1-CD1 3.41Å; Y66-L70 VanDerWaalsContact CD1-CD1 3.41Å; Y66-L70 HydrophobicContact CD2-CD1 4.03Å; Y66-L70 HydrophobicContact CE1-CD1 3.06Å; Y66-L70 HydrophobicContact CE2-CD1 3.72Å; Y66-L70 HydrophobicContact CG-CD1 3.89Å; Y66-L70 WeakPolarHBondContact O-CD1 3.23Å; Y66-L70 PolarHBondContact O-N 3.39Å |
| 67 | M | 64.1 | Low | 62.6 | Low | 105 Ų | 105 | 108.6 Ų | 108.6 | 52% | 0.517 | 58% | 0.582 | S | S | . | * | H | α-helix | trans | -64.7 | -34.3 | 177.7 | -67.5 | -62.3 | 174.1 | 0 | 0 | 112.3 | V63 L64 A69 L70 V71 | V63-M67 HydrophobicContact CG1-CG 4.23Å; V63-M67 WeakPolarHBondContact O-CB 3.26Å; V63-M67 VanDerWaalsContact O-CG 3.23Å; V63-M67 WeakPolarHBondContact O-CG 3.49Å; V63-M67 PolarHBondContact O-N 2.89Å; L64-M67 PolarHBondContact O-N 2.92Å; M67-A69 VanDerWaalsContact C-N 3.3Å; M67-A69 PolarHBondContact O-N 3.48Å; M67-L70 PolarHBondContact O-N 3.33Å; M67-V71 WeakPolarHBondContact O-CG2 3.39Å; M67-V71 PolarHBondContact O-N 2.85Å; M67-V71 VanDerWaalsContact O-N 3.07Å |
| 68 | S | 61.4 | Low | 61.3 | Low | 69 Ų | 69 | 103 Ų | 103 | 48% | 0.483 | 58% | 0.584 | S | S | . | * | H | α-helix | trans | -68.8 | -28.8 | 175.3 | -56.9 | 0 | 0 | 0 | 0 | 112.7 | L64 V65 Y66 | L64-S68 VanDerWaalsContact O-CB 3.26Å; L64-S68 WeakPolarHBondContact O-CB 3.43Å; L64-S68 PolarHBondContact O-N 2.94Å; L64-S68 PolarHBondContact O-OG 3.42Å; V65-S68 PolarHBondContact O-N 2.65Å; Y66-S68 VanDerWaalsContact C-N 3.3Å; Y66-S68 PolarHBondContact O-N 3.06Å |
| 69 | A | 62.9 | Low | 59.8 | Low | 86 Ų | 86 | 104.1 Ų | 104.1 | 71% | 0.711 | 60% | 0.595 | S | S | * | * | H | α-helix | trans | -80.9 | -29.6 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.8 | V65 Y66 M67 | V65-A69 WeakPolarHBondContact O-CB 3.23Å; V65-A69 PolarHBondContact O-N 3.13Å; Y66-A69 PolarHBondContact O-N 3Å; Y66-A69 VanDerWaalsContact O-N 3.13Å; M67-A69 VanDerWaalsContact C-N 3.3Å; M67-A69 PolarHBondContact O-N 3.48Å |
| 70 | L | 58.9 | Low | 58.5 | Low | 100 Ų | 100 | 107.4 Ų | 107.4 | 52% | 0.524 | 62% | 0.619 | S | S | . | * | H | α-helix | trans | -83 | -26.7 | 179 | -89.5 | 137.1 | 0 | 0 | 0 | 114 | Y66 M67 P72 | Y66-L70 HydrophobicContact CD1-CD1 3.41Å; Y66-L70 VanDerWaalsContact CD1-CD1 3.41Å; Y66-L70 HydrophobicContact CD2-CD1 4.03Å; Y66-L70 HydrophobicContact CE1-CD1 3.06Å; Y66-L70 HydrophobicContact CE2-CD1 3.72Å; Y66-L70 HydrophobicContact CG-CD1 3.89Å; Y66-L70 WeakPolarHBondContact O-CD1 3.23Å; Y66-L70 PolarHBondContact O-N 3.39Å; M67-L70 PolarHBondContact O-N 3.33Å; L70-P72 WeakPolarHBondContact O-CD 3.46Å |
| 71 | V | 53.7 | Low | 57.1 | Low | 57 Ų | 57 | 110 Ų | 110 | 35% | 0.345 | 63% | 0.633 | S | S | . | * | S | Bend | trans | -105.8 | 107.3 | -179.6 | -175 | 0 | 0 | 0 | 0 | 109.2 | M67 S73 | M67-V71 WeakPolarHBondContact O-CG2 3.39Å; M67-V71 PolarHBondContact O-N 2.85Å; M67-V71 VanDerWaalsContact O-N 3.07Å; V71-S73 PolarHBondContact O-N 3.38Å |
| 72 | P | 52 | Low | 55.6 | Low | 88 Ų | 88 | 115.7 Ų | 115.7 | 57% | 0.571 | 65% | 0.646 | S | S | * | * | trans | -55.9 | 137.7 | 171.8 | 22.1 | -30 | 0 | 0 | 0 | 109.3 | L70 S74 Y75 | L70-P72 WeakPolarHBondContact O-CD 3.46Å; P72-S74 PolarHBondContact O-N 3.45Å; P72-S74 PolarHBondContact O-OG 2.87Å; P72-Y75 PolarHBondContact O-N 3.3Å | ||
| 73 | S | 54.8 | Low | 53.9 | Low | 112 Ų | 112 | 121 Ų | 121 | 78% | 0.783 | 66% | 0.659 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -51.9 | -0.8 | -171.3 | 56.9 | 0 | 0 | 0 | 0 | 116.8 | V71 | V71-S73 PolarHBondContact O-N 3.38Š|
| 74 | S | 47.8 | Very low | 52.1 | Low | 86 Ų | 86 | 121.1 Ų | 121.1 | 60% | 0.601 | 67% | 0.669 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76.2 | -14.1 | 179.1 | 50.3 | 0 | 0 | 0 | 0 | 115.1 | P72 | P72-S74 PolarHBondContact O-N 3.45Å; P72-S74 PolarHBondContact O-OG 2.87Å |
| 75 | Y | 46.7 | Very low | 50.6 | Low | 190 Ų | 190 | 122.1 Ų | 122.1 | 75% | 0.745 | 68% | 0.684 | S | S | * | * | S | Bend | trans | -112.3 | -7.7 | -177.6 | -68.7 | -81.7 | 0 | 0 | 0 | 115.7 | P72 R77 | P72-Y75 PolarHBondContact O-N 3.3Å; Y75-R77 PolarHBondContact O-N 3.43Å |
| 76 | L | 50.9 | Low | 49.3 | Very low | 124 Ų | 124 | 125.3 Ų | 125.3 | 65% | 0.649 | 70% | 0.696 | S | S | * | * | G | 310 helix | trans | -79.5 | 4.7 | -175.7 | -81.5 | 160.4 | 0 | 0 | 0 | 114.6 | G78 | L76-G78 VanDerWaalsContact C-N 3.28Å; L76-G78 PolarHBondContact O-N 3.49Å |
| 77 | R | 49.9 | Very low | 47.9 | Very low | 244 Ų | 244 | 123.3 Ų | 123.3 | 92% | 0.921 | 70% | 0.702 | S | S | * | * | G | 310 helix | trans | -83.8 | 10.8 | -175.5 | -146 | 177.5 | -176.5 | -153.5 | -0 | 114.7 | Y75 | Y75-R77 PolarHBondContact O-N 3.43Š|
| 78 | G | 45.2 | Very low | 46.6 | Very low | 73 Ų | 73 | 125 Ų | 125 | 75% | 0.753 | 71% | 0.712 | S | S | * | * | G | 310 helix | trans | -108.5 | -5.1 | -167.4 | 0 | 0 | 0 | 0 | 0 | 118.2 | L76 | L76-G78 VanDerWaalsContact C-N 3.28Å; L76-G78 PolarHBondContact O-N 3.49Å |
| 79 | G | 43.4 | Very low | 45.8 | Very low | 64 Ų | 64 | 128.6 Ų | 128.6 | 66% | 0.66 | 72% | 0.724 | S | S | * | * | trans | -110.8 | -2.6 | -166.9 | 0 | 0 | 0 | 0 | 0 | 117.4 | L81 | G79-L81 PolarHBondContact O-N 2.71Å; G79-L81 VanDerWaalsContact O-N 3.09Å | ||
| 80 | A | 45 | Very low | 44.5 | Very low | 102 Ų | 102 | 132.5 Ų | 132.5 | 84% | 0.843 | 73% | 0.727 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77 | 10.5 | -167.4 | 0 | 0 | 0 | 0 | 0 | 115.9 | ||
| 81 | L | 41.4 | Very low | 43.7 | Very low | 149 Ų | 149 | 135.2 Ų | 135.2 | 78% | 0.78 | 74% | 0.741 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -129 | 2.5 | -165.4 | -86.2 | 159.4 | 0 | 0 | 0 | 116.4 | G79 | G79-L81 PolarHBondContact O-N 2.71Å; G79-L81 VanDerWaalsContact O-N 3.09Å |
| 82 | W | 39.8 | Very low | 42.9 | Very low | 235 Ų | 235 | 135 Ų | 135 | 89% | 0.89 | 75% | 0.751 | S | S | * | * | S | Bend | trans | -112.7 | 3 | -166.5 | -82.9 | 56.8 | 0 | 0 | 0 | 117.2 | ||
| 83 | Y | 35.9 | Very low | 42.4 | Very low | 237 Ų | 237 | 138.7 Ų | 138.7 | 93% | 0.929 | 76% | 0.764 | S | S | * | * | trans | -113.6 | 45.9 | 165.1 | -69.4 | -79.8 | 0 | 0 | 0 | 111.5 | S85 | Y83-S85 PolarHBondContact O-N 3.07Š| ||
| 84 | A | 31.3 | Very low | 42 | Very low | 84 Ų | 84 | 140.7 Ų | 140.7 | 69% | 0.694 | 76% | 0.763 | S | S | * | * | trans | -77.5 | 98.6 | 156.2 | 0 | 0 | 0 | 0 | 0 | 107.3 | ||||
| 85 | S | 37.4 | Very low | 41.5 | Very low | 118 Ų | 118 | 142.4 Ų | 142.4 | 83% | 0.825 | 77% | 0.772 | S | S | * | * | trans | 164.4 | 68.4 | 153 | -73.8 | 0 | 0 | 0 | 0 | 110.9 | Y83 | Y83-S85 PolarHBondContact O-N 3.07Š| ||
| 86 | I | 43.9 | Very low | 41.6 | Very low | 157 Ų | 157 | 138.9 Ų | 138.9 | 81% | 0.805 | 77% | 0.77 | S | S | * | * | S | Bend | trans | -129.2 | 119.4 | 157.4 | -57.2 | 178 | 0 | 0 | 0 | 106.1 | ||
| 87 | P | 39 | Very low | 41.2 | Very low | 109 Ų | 109 | 138.8 Ų | 138.8 | 71% | 0.708 | 78% | 0.775 | S | S | * | * | trans | -69.6 | 136.5 | -160.4 | 29.7 | -35.9 | 0 | 0 | 0 | 110.7 | I89 | P87-I89 PolarHBondContact O-N 3.35Š| ||
| 88 | I | 38 | Very low | 40.8 | Very low | 142 Ų | 142 | 138.7 Ų | 138.7 | 73% | 0.728 | 78% | 0.775 | S | S | * | * | trans | -58.1 | 100.1 | 168.6 | -59.1 | 159.6 | 0 | 0 | 0 | 107.3 | H90 | I88-H90 HydrophobicContact CG2-CB 4.37Å; I88-H90 WeakPolarHBondContact CG2-CD2 3.49Å; I88-H90 PolarHBondContact O-N 3.09Å | ||
| 89 | I | 44.7 | Very low | 40.4 | Very low | 143 Ų | 143 | 140.6 Ų | 140.6 | 73% | 0.733 | 77% | 0.774 | S | S | * | * | trans | -75.4 | 81.7 | 163.2 | -62.9 | 174.1 | 0 | 0 | 0 | 106.1 | P87 L91 | P87-I89 PolarHBondContact O-N 3.35Å; I89-L91 HydrophobicContact CG2-CB 4.37Å; I89-L91 PolarHBondContact O-N 3.2Å | ||
| 90 | H | 34.7 | Very low | 40.4 | Very low | 169 Ų | 169 | 149.5 Ų | 149.5 | 78% | 0.782 | 81% | 0.805 | S | S | * | * | trans | -65 | 82.1 | 155.6 | -101 | -73 | 0 | 0 | 0 | 108.3 | I88 | I88-H90 HydrophobicContact CG2-CB 4.37Å; I88-H90 WeakPolarHBondContact CG2-CD2 3.49Å; I88-H90 PolarHBondContact O-N 3.09Å | ||
| 91 | L | 42.1 | Very low | 40.1 | Very low | 156 Ų | 156 | 151.9 Ų | 151.9 | 82% | 0.817 | 80% | 0.803 | S | S | * | * | trans | -133.7 | 100.9 | 150.6 | -105.1 | 96.9 | 0 | 0 | 0 | 103.6 | I89 | I89-L91 HydrophobicContact CG2-CB 4.37Å; I89-L91 PolarHBondContact O-N 3.2Å | ||
| 92 | G | 37.9 | Very low | 40.1 | Very low | 53 Ų | 53 | 152 Ų | 152 | 55% | 0.546 | 80% | 0.804 | S | S | . | * | cis | 126.3 | 128.8 | 36.9 | 0 | 0 | 0 | 0 | 0 | 105.5 | ||||
| 93 | I | 41.5 | Very low | 40.1 | Very low | 165 Ų | 165 | 147.4 Ų | 147.4 | 85% | 0.846 | 80% | 0.799 | S | S | * | * | trans | 76.8 | 113.2 | 157.3 | -39.7 | 145.2 | 0 | 0 | 0 | 113.1 | ||||
| 94 | M | 46 | Very low | 40.3 | Very low | 154 Ų | 154 | 142.1 Ų | 142.1 | 76% | 0.759 | 79% | 0.792 | S | S | * | * | cis | -168.1 | 146.2 | 4.3 | -127.4 | 165.9 | -178 | 0 | 0 | 106.5 | ||||
| 95 | P | 36.9 | Very low | 40.9 | Very low | 123 Ų | 123 | 145.8 Ų | 145.8 | 80% | 0.799 | 80% | 0.798 | S | S | * | * | trans | -81.7 | 131.3 | 164.3 | 33.1 | -27.3 | 0 | 0 | 0 | 108.6 | ||||
| 96 | T | 49.6 | Very low | 41.1 | Very low | 115 Ų | 115 | 147.6 Ų | 147.6 | 71% | 0.706 | 80% | 0.796 | S | S | * | * | trans | -129.4 | 95.5 | 171.1 | 60.7 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 97 | T | 40.7 | Very low | 40.9 | Very low | 122 Ų | 122 | 146.9 Ų | 146.9 | 75% | 0.748 | 80% | 0.795 | S | S | * | * | 73 | 113.4 | 104.9 | 54.5 | 0 | 0 | 0 | 0 | 115.3 | |||||
| 98 | R | 42.5 | Very low | 41.1 | Very low | 242 Ų | 242 | 149.8 Ų | 149.8 | 91% | 0.913 | 80% | 0.802 | S | S | * | * | 179.3 | 157.9 | 116.2 | -94.9 | 175.2 | -169 | -164.5 | 4.1 | 112.4 | |||||
| 99 | P | 36.7 | Very low | 41.3 | Very low | 114 Ų | 114 | 150.5 Ų | 150.5 | 74% | 0.74 | 81% | 0.808 | S | S | * | * | trans | -101 | 157 | -140.8 | 38.8 | -34.6 | 0 | 0 | 0 | 113.9 | ||||
| 100 | L | 42.5 | Very low | 41 | Very low | 250 Ų | 250 | 151.2 Ų | 151.2 | 100% | 1.309 | 82% | 0.815 | S | S | * | * | trans | -163.2 | 0 | 131.4 | -97.9 | 162.7 | 0 | 0 | 0 | 108.4 |
Retrieved 100 of 100 residues in 15.9 ms
(Link to these results)