| 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 | 28.5 | Very low | 32.9 | Very low | 204 Ų | 204 | 117.6 Ų | 117.6 | 100% | 1.005 | 61% | 0.613 | S | S | * | * | 0 | 40.6 | 0 | -153.8 | 169.5 | -81.6 | 0 | 0 | 107.2 | |||||
| 2 | D | 29.4 | Very low | 33 | Very low | 122 Ų | 122 | 118.8 Ų | 118.8 | 65% | 0.652 | 61% | 0.613 | S | S | * | * | trans | -145.5 | 54.1 | -149.5 | -56.8 | -67.1 | 0 | 0 | 0 | 110.8 | ||||
| 3 | V | 32.1 | Very low | 33.6 | Very low | 107 Ų | 107 | 114.8 Ų | 114.8 | 65% | 0.648 | 59% | 0.589 | S | S | * | * | S | Bend | trans | -131.1 | -35.8 | 168.7 | -179.2 | 0 | 0 | 0 | 0 | 109.3 | Q7 | V3-Q7 PolarHBondContact O-N 3.28Š|
| 4 | T | 33.3 | Very low | 34.5 | Very low | 101 Ų | 101 | 113.7 Ų | 113.7 | 62% | 0.62 | 59% | 0.585 | S | S | * | * | H | α-helix | trans | -67.5 | -33.4 | 175.3 | 38.2 | 0 | 0 | 0 | 0 | 113.8 | F8 | T4-F8 VanDerWaalsContact O-CB 3.32Å; T4-F8 WeakPolarHBondContact O-CB 3.23Å; T4-F8 PolarHBondContact O-N 3.44Å |
| 5 | I | 35.2 | Very low | 35.2 | Very low | 98 Ų | 98 | 111.9 Ų | 111.9 | 50% | 0.503 | 59% | 0.594 | S | S | . | * | H | α-helix | trans | -72.7 | -39 | 178.6 | -64.5 | 171.2 | 0 | 0 | 0 | 111 | Q7 F8 I9 | I5-Q7 PolarHBondContact O-N 3.49Å; I5-F8 PolarHBondContact O-N 3.47Å; I5-I9 HydrophobicContact CG2-CD1 3.62Å; I5-I9 HydrophobicContact CG2-CG1 4.24Å; I5-I9 VanDerWaalsContact O-CB 3.27Å; I5-I9 WeakPolarHBondContact O-CB 3.31Å; I5-I9 WeakPolarHBondContact O-CG1 3.42Å; I5-I9 PolarHBondContact O-N 3.32Å |
| 6 | S | 32.2 | Very low | 36.4 | Very low | 68 Ų | 68 | 110.1 Ų | 110.1 | 48% | 0.476 | 58% | 0.584 | S | S | . | * | H | α-helix | trans | -67.3 | -34.9 | 177.2 | -50.7 | 0 | 0 | 0 | 0 | 112.8 | L10 | S6-L10 PolarHBondContact O-N 2.94Å; S6-L10 VanDerWaalsContact O-N 3.09Å |
| 7 | Q | 32.4 | Very low | 38 | Very low | 127 Ų | 127 | 104.4 Ų | 104.4 | 59% | 0.593 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -72.3 | -41.5 | 174.2 | -105.6 | 172.2 | -46.1 | 0 | 0 | 112.6 | V3 I5 I9 L10 E11 | V3-Q7 PolarHBondContact O-N 3.28Å; I5-Q7 PolarHBondContact O-N 3.49Å; Q7-I9 VanDerWaalsContact C-N 3.33Å; Q7-I9 PolarHBondContact O-N 2.51Å; Q7-L10 PolarHBondContact O-N 3.43Å; Q7-E11 PolarHBondContact O-N 3.23Å |
| 8 | F | 29.9 | Very low | 38.9 | Very low | 130 Ų | 130 | 102.5 Ų | 102.5 | 57% | 0.57 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -65.9 | -37.3 | 176.1 | -150 | -90.2 | 0 | 0 | 0 | 111.6 | T4 I5 E12 | T4-F8 VanDerWaalsContact O-CB 3.32Å; T4-F8 WeakPolarHBondContact O-CB 3.23Å; T4-F8 PolarHBondContact O-N 3.44Å; I5-F8 PolarHBondContact O-N 3.47Å; F8-E12 WeakPolarHBondContact O-CB 3.48Å; F8-E12 PolarHBondContact O-N 3.19Å; F8-E12 VanDerWaalsContact O-N 3.11Å |
| 9 | I | 35.6 | Very low | 39.8 | Very low | 81 Ų | 81 | 101.5 Ų | 101.5 | 42% | 0.415 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -65.5 | -39.5 | 173 | -72.1 | 173.5 | 0 | 0 | 0 | 110.9 | I5 Q7 F13 | I5-I9 HydrophobicContact CG2-CD1 3.62Å; I5-I9 HydrophobicContact CG2-CG1 4.24Å; I5-I9 VanDerWaalsContact O-CB 3.27Å; I5-I9 WeakPolarHBondContact O-CB 3.31Å; I5-I9 WeakPolarHBondContact O-CG1 3.42Å; I5-I9 PolarHBondContact O-N 3.32Å; Q7-I9 VanDerWaalsContact C-N 3.33Å; Q7-I9 PolarHBondContact O-N 2.51Å; I9-F13 HydrophobicContact CG2-CD2 3.62Å; I9-F13 HydrophobicContact CG2-CE2 3.34Å; I9-F13 HydrophobicContact CG2-CG 4.41Å; I9-F13 HydrophobicContact CG2-CZ 3.9Å; I9-F13 WeakPolarHBondContact O-CB 3.22Å; I9-F13 WeakPolarHBondContact O-CD2 3.15Å; I9-F13 WeakPolarHBondContact O-CG 3.12Å; I9-F13 PolarHBondContact O-N 3.47Å |
| 10 | L | 37.7 | Very low | 40.6 | Very low | 117 Ų | 117 | 97.8 Ų | 97.8 | 61% | 0.613 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -68 | -40 | 177 | -110.5 | 123.7 | 0 | 0 | 0 | 113.1 | S6 Q7 F13 D14 | S6-L10 PolarHBondContact O-N 2.94Å; S6-L10 VanDerWaalsContact O-N 3.09Å; Q7-L10 PolarHBondContact O-N 3.43Å; L10-F13 PolarHBondContact O-N 3.15Å; L10-D14 PolarHBondContact O-N 3.33Å |
| 11 | E | 35.6 | Very low | 41.3 | Very low | 139 Ų | 139 | 94.8 Ų | 94.8 | 65% | 0.65 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -67.8 | -33.8 | 177.2 | -79.2 | -179.4 | 158 | 0 | 0 | 112.7 | Q7 | Q7-E11 PolarHBondContact O-N 3.23Å |
| 12 | E | 33.7 | Very low | 42.4 | Very low | 132 Ų | 132 | 91.2 Ų | 91.2 | 62% | 0.617 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -85.1 | -18.3 | 177.5 | -147.7 | 156.8 | -162.9 | 0 | 0 | 112.4 | F8 | F8-E12 WeakPolarHBondContact O-CB 3.48Å; F8-E12 PolarHBondContact O-N 3.19Å; F8-E12 VanDerWaalsContact O-N 3.11Å |
| 13 | F | 41.6 | Very low | 43.5 | Very low | 67 Ų | 67 | 88.1 Ų | 88.1 | 29% | 0.294 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -78.6 | -33 | 176.2 | -99.1 | -126.4 | 0 | 0 | 0 | 114.5 | I9 L10 A15 L20 L23 | I9-F13 HydrophobicContact CG2-CD2 3.62Å; I9-F13 HydrophobicContact CG2-CE2 3.34Å; I9-F13 HydrophobicContact CG2-CG 4.41Å; I9-F13 HydrophobicContact CG2-CZ 3.9Å; I9-F13 WeakPolarHBondContact O-CB 3.22Å; I9-F13 WeakPolarHBondContact O-CD2 3.15Å; I9-F13 WeakPolarHBondContact O-CG 3.12Å; I9-F13 PolarHBondContact O-N 3.47Å; L10-F13 PolarHBondContact O-N 3.15Å; F13-A15 PolarHBondContact O-N 3.07Å; F13-L20 HydrophobicContact CD1-CD1 3.98Å; F13-L20 HydrophobicContact CD1-CG 4.29Å; F13-L23 HydrophobicContact CD1-CD1 4.48Å; F13-L23 HydrophobicContact CE1-CD1 3.34Å; F13-L23 HydrophobicContact CE2-CD1 3.79Å; F13-L23 HydrophobicContact CZ-CD1 2.96Å; F13-L23 HydrophobicContact CZ-CG 4.44Å |
| 14 | D | 45.7 | Very low | 44.6 | Very low | 99 Ų | 99 | 87 Ų | 87 | 53% | 0.529 | 46% | 0.461 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -71.4 | -15.4 | 179.4 | -100.9 | -15.7 | 0 | 0 | 0 | 112.7 | L10 | L10-D14 PolarHBondContact O-N 3.33Š|
| 15 | A | 45.6 | Very low | 45.4 | Very low | 87 Ų | 87 | 86.3 Ų | 86.3 | 72% | 0.719 | 45% | 0.45 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -82.1 | -19.6 | -177.5 | 0 | 0 | 0 | 0 | 0 | 114.4 | F13 | F13-A15 PolarHBondContact O-N 3.07Š|
| 16 | N | 54.8 | Low | 46 | Very low | 83 Ų | 83 | 85.3 Ų | 85.3 | 44% | 0.444 | 45% | 0.449 | S | S | . | . | trans | -142.4 | 87.5 | -172.2 | -148.4 | 12.2 | 0 | 0 | 0 | 112.2 | S18 L19 | N16-S18 VanDerWaalsContact CG-OG 3.31Å; N16-S18 PolarHBondContact O-N 3.47Å; N16-S18 PolarHBondContact OD1-OG 3.35Å; N16-L19 HydrophobicContact CB-CB 4.29Å; N16-L19 WeakPolarHBondContact O-CB 3.29Å; N16-L19 PolarHBondContact O-N 3.07Å | ||
| 17 | C | 63 | Low | 46.7 | Very low | 12 Ų | 12 | 89.3 Ų | 89.3 | 8% | 0.081 | 46% | 0.458 | C | S | . | . | H | α-helix | trans | -57.5 | -21.6 | -176.2 | -153.1 | 0 | 0 | 0 | 0 | 113.8 | D21 T47 C53 | C17-D21 PolarHBondContact O-N 2.86Å; C17-T47 WeakPolarHBondContact CB-OG1 3.33Å; C17-C53 WeakPolarHBondContact CA-SG 3.26Å; C17-C53 HydrophobicContact CB-CB 3.79Å; C17-C53 WeakPolarHBondContact CB-SG 3.18Å; C17-C53 WeakPolarHBondContact SG-CA 3.47Å; C17-C53 WeakPolarHBondContact SG-CB 3.25Å; C17-C53 CovalentContact SG-SG 2.03Å; C17-C53 PolarHBondContact SG-SG 3.3Å |
| 18 | S | 53.5 | Low | 47.4 | Very low | 71 Ų | 71 | 87.6 Ų | 87.6 | 50% | 0.497 | 45% | 0.452 | S | S | . | . | H | α-helix | trans | -71.4 | -29.4 | 173.4 | 50 | 0 | 0 | 0 | 0 | 114 | N16 H22 | N16-S18 VanDerWaalsContact CG-OG 3.31Å; N16-S18 PolarHBondContact O-N 3.47Å; N16-S18 PolarHBondContact OD1-OG 3.35Å; S18-H22 PolarHBondContact O-N 3.33Å; S18-H22 VanDerWaalsContact O-N 3.15Å |
| 19 | L | 57.3 | Low | 48 | Very low | 83 Ų | 83 | 89.5 Ų | 89.5 | 44% | 0.435 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -77 | -30.5 | 179.7 | -148.8 | 148 | 0 | 0 | 0 | 110.9 | N16 H22 L23 | N16-L19 HydrophobicContact CB-CB 4.29Å; N16-L19 WeakPolarHBondContact O-CB 3.29Å; N16-L19 PolarHBondContact O-N 3.07Å; L19-H22 PolarHBondContact O-N 3.21Å; L19-L23 HydrophobicContact CD2-CD1 3.71Å; L19-L23 HydrophobicContact CD2-CG 4.29Å; L19-L23 WeakPolarHBondContact O-CB 3.5Å; L19-L23 WeakPolarHBondContact O-CG 3.19Å; L19-L23 PolarHBondContact O-N 2.94Å |
| 20 | L | 56 | Low | 48.3 | Very low | 28 Ų | 28 | 90.1 Ų | 90.1 | 15% | 0.147 | 47% | 0.474 | C | S | . | . | H | α-helix | trans | -72.1 | -37.5 | 174.9 | -149 | 143.6 | 0 | 0 | 0 | 111.8 | F13 Q24 P55 | F13-L20 HydrophobicContact CD1-CD1 3.98Å; F13-L20 HydrophobicContact CD1-CG 4.29Å; L20-Q24 WeakPolarHBondContact O-CB 3.25Å; L20-Q24 PolarHBondContact O-N 3.23Å; L20-P55 HydrophobicContact CD2-CB 4.38Å |
| 21 | D | 54.2 | Low | 48.2 | Very low | 34 Ų | 34 | 86.6 Ų | 86.6 | 18% | 0.182 | 46% | 0.459 | C | S | . | . | H | α-helix | trans | -64.7 | -41.9 | 171.2 | -151 | 32.3 | 0 | 0 | 0 | 110.5 | C17 L23 Q24 E25 A45 R56 | C17-D21 PolarHBondContact O-N 2.86Å; D21-L23 PolarHBondContact O-N 3.18Å; D21-Q24 PolarHBondContact O-N 3.44Å; D21-E25 PolarHBondContact O-N 2.89Å; D21-A45 HydrophobicContact CB-CB 4.33Å; D21-R56 IonicContact OD1-CZ 3.69Å; D21-R56 IonicContact OD1-NE 3.63Å; D21-R56 IonicContact OD1-NH2 2.62Å; D21-R56 IonicContact OD2-CZ 2.7Å; D21-R56 IonicContact OD2-NE 2.9Å; D21-R56 IonicContact OD2-NH2 3.59Å; D21-R56 PolarHBondContact OD2-NH2 2.92Å |
| 22 | H | 52.3 | Low | 48.4 | Very low | 129 Ų | 129 | 86.3 Ų | 86.3 | 60% | 0.597 | 47% | 0.473 | S | S | * | . | H | α-helix | trans | -67.6 | -36.5 | 178.4 | -121.2 | -11.1 | 0 | 0 | 0 | 113.7 | S18 L19 E25 T26 | S18-H22 PolarHBondContact O-N 3.33Å; S18-H22 VanDerWaalsContact O-N 3.15Å; L19-H22 PolarHBondContact O-N 3.21Å; H22-E25 IonicContact ND1-OE2 3.97Å; H22-E25 PolarHBondContact O-N 2.99Å; H22-T26 PolarHBondContact O-N 3.45Å; H22-T26 PolarHBondContact O-OG1 3.49Å |
| 23 | L | 52.2 | Low | 48.6 | Very low | 57 Ų | 57 | 85.6 Ų | 85.6 | 30% | 0.298 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -74.6 | -32.4 | 176 | -80.1 | 170.4 | 0 | 0 | 0 | 113.2 | F13 L19 D21 E25 T26 F27 | F13-L23 HydrophobicContact CD1-CD1 4.48Å; F13-L23 HydrophobicContact CE1-CD1 3.34Å; F13-L23 HydrophobicContact CE2-CD1 3.79Å; F13-L23 HydrophobicContact CZ-CD1 2.96Å; F13-L23 HydrophobicContact CZ-CG 4.44Å; L19-L23 HydrophobicContact CD2-CD1 3.71Å; L19-L23 HydrophobicContact CD2-CG 4.29Å; L19-L23 WeakPolarHBondContact O-CB 3.5Å; L19-L23 WeakPolarHBondContact O-CG 3.19Å; L19-L23 PolarHBondContact O-N 2.94Å; D21-L23 PolarHBondContact O-N 3.18Å; L23-E25 VanDerWaalsContact C-N 3.31Å; L23-T26 WeakPolarHBondContact CA-OG1 2.94Å; L23-T26 PolarHBondContact O-N 2.86Å; L23-F27 WeakPolarHBondContact O-CB 3.25Å; L23-F27 PolarHBondContact O-N 3.34Å |
| 24 | Q | 54.2 | Low | 48.3 | Very low | 84 Ų | 84 | 87.9 Ų | 87.9 | 39% | 0.393 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -64.5 | -40.5 | 171 | -165 | 144.4 | -31.9 | 0 | 0 | 110.3 | L20 D21 I28 | L20-Q24 WeakPolarHBondContact O-CB 3.25Å; L20-Q24 PolarHBondContact O-N 3.23Å; D21-Q24 PolarHBondContact O-N 3.44Å; Q24-I28 HydrophobicContact CG-CD1 4.11Å; Q24-I28 WeakPolarHBondContact O-CB 3.46Å; Q24-I28 WeakPolarHBondContact O-CD1 3.44Å; Q24-I28 WeakPolarHBondContact O-CG1 3.49Å; Q24-I28 PolarHBondContact O-N 3.15Å; Q24-I28 VanDerWaalsContact O-N 3.16Å |
| 25 | E | 50 | Low | 48 | Very low | 87 Ų | 87 | 92.6 Ų | 92.6 | 41% | 0.407 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -62.1 | -41.8 | 171.6 | -74.4 | 178.4 | 172.5 | 0 | 0 | 112.8 | D21 H22 L23 I28 E29 R56 | D21-E25 PolarHBondContact O-N 2.89Å; H22-E25 IonicContact ND1-OE2 3.97Å; H22-E25 PolarHBondContact O-N 2.99Å; L23-E25 VanDerWaalsContact C-N 3.31Å; E25-I28 PolarHBondContact O-N 3.5Å; E25-E29 PolarHBondContact O-N 3.32Å; E25-R56 IonicContact OE1-CZ 3.57Å; E25-R56 IonicContact OE1-NH1 2.78Å; E25-R56 PolarHBondContact OE1-NH1 2.7Å; E25-R56 IonicContact OE1-NH2 3.58Å; E25-R56 PolarHBondContact OE1-NH2 2.87Å |
| 26 | T | 47.8 | Very low | 48 | Very low | 76 Ų | 76 | 95 Ų | 95 | 47% | 0.466 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -75.5 | -30.8 | 179.3 | 13.9 | 0 | 0 | 0 | 0 | 114.1 | H22 L23 I28 E29 S30 | H22-T26 PolarHBondContact O-N 3.45Å; H22-T26 PolarHBondContact O-OG1 3.49Å; L23-T26 WeakPolarHBondContact CA-OG1 2.94Å; L23-T26 PolarHBondContact O-N 2.86Å; T26-I28 VanDerWaalsContact C-N 3.34Å; T26-E29 PolarHBondContact O-N 3.11Å; T26-S30 PolarHBondContact O-N 3.05Å |
| 27 | F | 46.6 | Very low | 47.6 | Very low | 153 Ų | 153 | 92.8 Ų | 92.8 | 67% | 0.671 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -69.9 | -32.6 | 173.3 | -110.1 | -91.7 | 0 | 0 | 0 | 112.2 | L23 E29 S30 S31 | L23-F27 WeakPolarHBondContact O-CB 3.25Å; L23-F27 PolarHBondContact O-N 3.34Å; F27-E29 VanDerWaalsContact C-N 3.35Å; F27-S30 PolarHBondContact O-N 3.46Å; F27-S30 PolarHBondContact O-OG 3.1Å; F27-S31 PolarHBondContact O-N 3.42Å; F27-S31 PolarHBondContact O-OG 3.14Å; F27-S31 VanDerWaalsContact O-OG 3.07Å |
| 28 | I | 48.3 | Very low | 47.1 | Very low | 91 Ų | 91 | 95.8 Ų | 95.8 | 47% | 0.467 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -69.4 | -33 | 175.8 | -67.9 | 164.2 | 0 | 0 | 0 | 111.1 | Q24 E25 T26 | Q24-I28 HydrophobicContact CG-CD1 4.11Å; Q24-I28 WeakPolarHBondContact O-CB 3.46Å; Q24-I28 WeakPolarHBondContact O-CD1 3.44Å; Q24-I28 WeakPolarHBondContact O-CG1 3.49Å; Q24-I28 PolarHBondContact O-N 3.15Å; Q24-I28 VanDerWaalsContact O-N 3.16Å; E25-I28 PolarHBondContact O-N 3.5Å; T26-I28 VanDerWaalsContact C-N 3.34Å |
| 29 | E | 42.4 | Very low | 47.3 | Very low | 170 Ų | 170 | 100.8 Ų | 100.8 | 79% | 0.794 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -72.9 | -25.5 | 176.2 | -98.4 | -177.9 | 161.3 | 0 | 0 | 114.4 | E25 T26 F27 | E25-E29 PolarHBondContact O-N 3.32Å; T26-E29 PolarHBondContact O-N 3.11Å; F27-E29 VanDerWaalsContact C-N 3.35Å |
| 30 | S | 42.6 | Very low | 48 | Very low | 93 Ų | 93 | 98.8 Ų | 98.8 | 65% | 0.65 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -93.7 | -11.6 | -175.5 | 65.2 | 0 | 0 | 0 | 0 | 114.9 | T26 F27 | T26-S30 PolarHBondContact O-N 3.05Å; F27-S30 PolarHBondContact O-N 3.46Å; F27-S30 PolarHBondContact O-OG 3.1Å |
| 31 | S | 35 | Very low | 49.2 | Very low | 44 Ų | 44 | 101 Ų | 101 | 31% | 0.308 | 56% | 0.555 | S | S | . | * | S | Bend | trans | -110.5 | 122.4 | 177.6 | 58.2 | 0 | 0 | 0 | 0 | 109.4 | F27 I33 | F27-S31 PolarHBondContact O-N 3.42Å; F27-S31 PolarHBondContact O-OG 3.14Å; F27-S31 VanDerWaalsContact O-OG 3.07Å; S31-I33 PolarHBondContact O-N 3.29Å |
| 32 | S | 38.8 | Very low | 50.6 | Low | 133 Ų | 133 | 104.2 Ų | 104.2 | 93% | 0.93 | 57% | 0.565 | S | S | * | * | trans | -71.3 | 49 | 175 | 42.1 | 0 | 0 | 0 | 0 | 112 | ||||
| 33 | I | 38.8 | Very low | 52.2 | Low | 117 Ų | 117 | 98.1 Ų | 98.1 | 60% | 0.6 | 54% | 0.537 | S | S | * | . | trans | -89.4 | 135.7 | 172.7 | -59.9 | 175.2 | 0 | 0 | 0 | 106.2 | S31 F35 | S31-I33 PolarHBondContact O-N 3.29Å; I33-F35 PolarHBondContact O-N 3.08Å | ||
| 34 | P | 35.8 | Very low | 53.8 | Low | 114 Ų | 114 | 99.8 Ų | 99.8 | 74% | 0.74 | 55% | 0.546 | S | S | * | . | trans | -52.3 | 135.3 | 176.5 | -17.8 | 28.6 | 0 | 0 | 0 | 108.6 | L36 | P34-L36 PolarHBondContact O-N 2.97Š| ||
| 35 | F | 39 | Very low | 55.2 | Low | 198 Ų | 198 | 97.1 Ų | 97.1 | 87% | 0.868 | 54% | 0.538 | S | S | * | . | trans | -31.9 | 108.4 | 172.2 | -88.1 | -97.8 | 0 | 0 | 0 | 110.1 | I33 G37 | I33-F35 PolarHBondContact O-N 3.08Å; F35-G37 PolarHBondContact O-N 3.4Å | ||
| 36 | L | 45.9 | Very low | 56.8 | Low | 138 Ų | 138 | 95.2 Ų | 95.2 | 72% | 0.723 | 53% | 0.533 | S | S | * | . | trans | -71.7 | 57.7 | 147.9 | -109.9 | 156.3 | 0 | 0 | 0 | 105.8 | P34 F38 | P34-L36 PolarHBondContact O-N 2.97Å; L36-F38 PolarHBondContact O-N 3.29Å | ||
| 37 | G | 45.3 | Very low | 58.5 | Low | 36 Ų | 36 | 95.4 Ų | 95.4 | 37% | 0.371 | 53% | 0.534 | S | S | . | . | trans | -60.9 | 119 | 162.5 | 0 | 0 | 0 | 0 | 0 | 104 | F35 D39 | F35-G37 PolarHBondContact O-N 3.4Å; G37-D39 PolarHBondContact O-N 2.8Å | ||
| 38 | F | 52.2 | Low | 60.2 | Low | 76 Ų | 76 | 89.3 Ų | 89.3 | 33% | 0.333 | 51% | 0.508 | S | S | . | . | trans | -64.1 | 86.4 | 168.9 | -66.2 | -84.8 | 0 | 0 | 0 | 106.9 | L36 G40 Y42 R56 | L36-F38 PolarHBondContact O-N 3.29Å; F38-G40 PolarHBondContact O-N 3.49Å; F38-Y42 HydrophobicContact CB-CD1 4.1Å; F38-R56 HydrophobicContact CE2-CG 4.45Å; F38-R56 HydrophobicContact CZ-CG 4.46Å | ||
| 39 | D | 59.5 | Low | 61.6 | Low | 175 Ų | 175 | 94.6 Ų | 94.6 | 94% | 0.936 | 53% | 0.531 | S | S | * | . | trans | -74.7 | 74.3 | 169.3 | -85.1 | -21.6 | 0 | 0 | 0 | 107.3 | G37 | G37-D39 PolarHBondContact O-N 2.8Š| ||
| 40 | G | 70.4 | Confident | 63.1 | Low | 42 Ų | 42 | 89.1 Ų | 89.1 | 43% | 0.433 | 51% | 0.507 | S | S | . | . | S | Bend | trans | 155.3 | 174.4 | -178.5 | 0 | 0 | 0 | 0 | 0 | 114.3 | F38 | F38-G40 PolarHBondContact O-N 3.49Š|
| 41 | P | 81.6 | Confident | 64.6 | Low | 74 Ų | 74 | 86.8 Ų | 86.8 | 48% | 0.481 | 50% | 0.497 | S | S | . | . | trans | -60.3 | 143.1 | 172.1 | 24.8 | -30.5 | 0 | 0 | 0 | 110.6 | A59 | P41-A59 HydrophobicContact CB-CB 4.2Å; P41-A59 HydrophobicContact CG-CB 3.82Å; P41-A59 WeakPolarHBondContact O-CB 3.37Å; P41-A59 PolarHBondContact O-N 3.19Å | ||
| 42 | Y | 84.1 | Confident | 66.9 | Low | 101 Ų | 101 | 85.3 Ų | 85.3 | 40% | 0.396 | 49% | 0.487 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -139.5 | 155.4 | 179.6 | 61.6 | -90.5 | 0 | 0 | 0 | 110.4 | F38 N44 R56 T57 | F38-Y42 HydrophobicContact CB-CD1 4.1Å; Y42-N44 VanDerWaalsContact CE2-OD1 3.24Å; Y42-N44 WeakPolarHBondContact CE2-OD1 3.36Å; Y42-R56 HydrophobicContact CD2-CG 3.83Å; Y42-R56 HydrophobicContact CE2-CG 4.34Å; Y42-T57 CarbonylContact C-O 3.43Å; Y42-T57 WeakPolarHBondContact CA-O 3.38Å; Y42-T57 WeakPolarHBondContact CB-O 3.46Å |
| 43 | C | 86 | Confident | 69 | Low | 1 Ų | 1 | 79.1 Ų | 79.1 | 1% | 0.007 | 44% | 0.443 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -93.1 | 129.6 | 174 | -65.1 | 0 | 0 | 0 | 0 | 110.6 | R56 T57 C86 G90 T91 W92 | C43-R56 WeakPolarHBondContact O-CA 3.26Å; C43-R56 WeakPolarHBondContact O-CG 3.03Å; C43-T57 PolarHBondContact N-O 3.29Å; C43-T57 PolarHBondContact O-N 2.75Å; C43-T57 VanDerWaalsContact O-N 3.09Å; C43-C86 HydrophobicContact CB-CB 3.9Å; C43-C86 WeakPolarHBondContact CB-SG 3.44Å; C43-C86 PolarHBondContact N-SG 3.46Å; C43-C86 VanDerWaalsContact SG-CA 3.5Å; C43-C86 WeakPolarHBondContact SG-CB 3.38Å; C43-C86 CovalentContact SG-SG 2.03Å; C43-C86 PolarHBondContact SG-SG 2.98Å; C43-G90 VanDerWaalsContact SG-C 3.57Å; C43-T91 PolarHBondContact SG-O 2.98Å; C43-W92 HydrophobicContact CB-CD2 3.71Å; C43-W92 HydrophobicContact CB-CE3 4.2Å; C43-W92 HydrophobicContact CB-CG 4.14Å; C43-W92 HydrophobicContact CB-CH2 4.18Å; C43-W92 HydrophobicContact CB-CZ2 3.66Å; C43-W92 HydrophobicContact CB-CZ3 4.43Å |
| 44 | N | 85.7 | Confident | 71.2 | Confident | 93 Ų | 93 | 73.6 Ų | 73.6 | 50% | 0.497 | 42% | 0.415 | S | S | . | . | P | Polyproline II helix | trans | -67.9 | 154.2 | 177.4 | -77.1 | -26 | 0 | 0 | 0 | 112.7 | Y42 T46 W92 | Y42-N44 VanDerWaalsContact CE2-OD1 3.24Å; Y42-N44 WeakPolarHBondContact CE2-OD1 3.36Å; N44-T46 PolarHBondContact O-N 2.9Å; N44-W92 PolarHBondContact O-NE1 2.9Å |
| 45 | A | 83.3 | Confident | 73.5 | Confident | 27 Ų | 27 | 69 Ų | 69 | 22% | 0.223 | 39% | 0.385 | C | S | . | . | P | Polyproline II helix | trans | -61.2 | 129.9 | 172.7 | 0 | 0 | 0 | 0 | 0 | 110.7 | D21 W54 | D21-A45 HydrophobicContact CB-CB 4.33Å; A45-W54 CarbonylContact C-O 3.31Å; A45-W54 WeakPolarHBondContact CA-O 3.37Å |
| 46 | T | 84.4 | Confident | 75.6 | Confident | 47 Ų | 47 | 62.4 Ų | 62.4 | 29% | 0.288 | 35% | 0.354 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -144.2 | 143.9 | -178.8 | 56 | 0 | 0 | 0 | 0 | 111.6 | N44 W54 R84 W92 | N44-T46 PolarHBondContact O-N 2.9Å; T46-W54 PolarHBondContact N-O 3.03Å; T46-W54 WeakPolarHBondContact O-CB 3.33Å; T46-W54 PolarHBondContact O-N 3.06Å; T46-R84 PolarHBondContact OG1-NH1 2.98Å; T46-W92 PolarHBondContact OG1-NE1 3.32Å |
| 47 | T | 82.2 | Confident | 77.4 | Confident | 81 Ų | 81 | 56.1 Ų | 56.1 | 50% | 0.497 | 32% | 0.322 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -92 | 137.3 | 167.8 | -47.3 | 0 | 0 | 0 | 0 | 109.2 | C17 | C17-T47 WeakPolarHBondContact CB-OG1 3.33Å |
| 48 | D | 82.6 | Confident | 79.4 | Confident | 25 Ų | 25 | 55.7 Ų | 55.7 | 13% | 0.134 | 31% | 0.313 | C | S | . | . | trans | -85.3 | -179 | 174.4 | 70.4 | 17.1 | 0 | 0 | 0 | 113.2 | I50 G51 T52 W54 I96 Y98 | D48-I50 PolarHBondContact O-N 3.45Å; D48-I50 WeakPolarHBondContact OD1-CA 3.39Å; D48-I50 PolarHBondContact OD1-N 2.95Å; D48-G51 PolarHBondContact O-N 2.91Å; D48-G51 PolarHBondContact OD1-N 3.44Å; D48-T52 PolarHBondContact N-O 2.87Å; D48-T52 VanDerWaalsContact N-O 3.11Å; D48-T52 PolarHBondContact OD1-N 3.31Å; D48-T52 WeakPolarHBondContact OD2-CB 3.46Å; D48-W54 PolarHBondContact OD2-NE1 3.34Å; D48-I96 HydrophobicContact CB-CD1 3.71Å; D48-Y98 PolarHBondContact OD2-OH 2.91Å | ||
| 49 | Q | 78.4 | Confident | 81 | Confident | 202 Ų | 202 | 53.5 Ų | 53.5 | 94% | 0.944 | 31% | 0.309 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -68.4 | -13.8 | -178.6 | -63.9 | -178.9 | 2.6 | 0 | 0 | 113.9 | ||
| 50 | I | 73.8 | Confident | 82.2 | Confident | 55 Ų | 55 | 47.7 Ų | 47.7 | 28% | 0.282 | 29% | 0.29 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -97.2 | -12.5 | -177.9 | -63.1 | 175.3 | 0 | 0 | 0 | 110.3 | D48 P68 F71 Y98 | D48-I50 PolarHBondContact O-N 3.45Å; D48-I50 WeakPolarHBondContact OD1-CA 3.39Å; D48-I50 PolarHBondContact OD1-N 2.95Å; I50-P68 HydrophobicContact CG2-CB 4.34Å; I50-P68 HydrophobicContact CG2-CG 3.87Å; I50-F71 HydrophobicContact CB-CD2 4.15Å; I50-F71 HydrophobicContact CB-CE2 4.03Å; I50-F71 HydrophobicContact CD1-CZ 4.47Å; I50-F71 HydrophobicContact CG1-CD2 4.19Å; I50-F71 HydrophobicContact CG1-CE2 3.69Å; I50-F71 HydrophobicContact CG1-CZ 3.91Å; I50-F71 HydrophobicContact CG2-CB 4.36Å; I50-F71 HydrophobicContact CG2-CD2 3.53Å; I50-F71 HydrophobicContact CG2-CE2 3.93Å; I50-F71 HydrophobicContact CG2-CG 3.99Å; I50-Y98 HydrophobicContact CD1-CD2 4.34Å; I50-Y98 HydrophobicContact CD1-CE2 3.98Å |
| 51 | G | 74.3 | Confident | 83 | Confident | 44 Ų | 44 | 50.9 Ų | 50.9 | 45% | 0.454 | 29% | 0.293 | S | S | . | . | S | Bend | trans | 97.5 | 5.7 | -179.2 | 0 | 0 | 0 | 0 | 0 | 113.8 | D48 | D48-G51 PolarHBondContact O-N 2.91Å; D48-G51 PolarHBondContact OD1-N 3.44Å |
| 52 | T | 82.1 | Confident | 83.3 | Confident | 13 Ų | 13 | 52.8 Ų | 52.8 | 8% | 0.08 | 30% | 0.299 | C | S | . | . | P | Polyproline II helix | trans | -77.4 | 128 | 178.7 | -50.1 | 0 | 0 | 0 | 0 | 110.2 | D48 W54 R65 Y98 | D48-T52 PolarHBondContact N-O 2.87Å; D48-T52 VanDerWaalsContact N-O 3.11Å; D48-T52 PolarHBondContact OD1-N 3.31Å; D48-T52 WeakPolarHBondContact OD2-CB 3.46Å; T52-W54 HydrophobicContact CG2-CZ2 4.21Å; T52-R65 HydrophobicContact CG2-CB 4.17Å; T52-Y98 VanDerWaalsContact CB-OH 3.3Å; T52-Y98 WeakPolarHBondContact CB-OH 3.38Å; T52-Y98 PolarHBondContact OG1-OH 3.36Å |
| 53 | C | 84.3 | Confident | 83.5 | Confident | 3 Ų | 3 | 48.9 Ų | 48.9 | 2% | 0.02 | 29% | 0.286 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -85.1 | 119.9 | 178.9 | 174.8 | 0 | 0 | 0 | 0 | 112.7 | C17 R65 | C17-C53 WeakPolarHBondContact CA-SG 3.26Å; C17-C53 HydrophobicContact CB-CB 3.79Å; C17-C53 WeakPolarHBondContact CB-SG 3.18Å; C17-C53 WeakPolarHBondContact SG-CA 3.47Å; C17-C53 WeakPolarHBondContact SG-CB 3.25Å; C17-C53 CovalentContact SG-SG 2.03Å; C17-C53 PolarHBondContact SG-SG 3.3Å; C53-R65 PolarHBondContact O-NE 2.99Å |
| 54 | W | 84.3 | Confident | 83.6 | Confident | 0 Ų | 0 | 54.2 Ų | 54.2 | 0% | 0 | 31% | 0.31 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -101.2 | 118.7 | 174.2 | -61 | 91.3 | 0 | 0 | 0 | 109.9 | A45 T46 D48 T52 V63 R65 A82 R84 W92 I96 | A45-W54 CarbonylContact C-O 3.31Å; A45-W54 WeakPolarHBondContact CA-O 3.37Å; T46-W54 PolarHBondContact N-O 3.03Å; T46-W54 WeakPolarHBondContact O-CB 3.33Å; T46-W54 PolarHBondContact O-N 3.06Å; D48-W54 PolarHBondContact OD2-NE1 3.34Å; T52-W54 HydrophobicContact CG2-CZ2 4.21Å; W54-V63 HydrophobicContact CE3-CB 4.26Å; W54-V63 HydrophobicContact CE3-CG1 4.08Å; W54-V63 HydrophobicContact CZ3-CB 4.21Å; W54-V63 HydrophobicContact CZ3-CG1 4.14Å; W54-R65 HydrophobicContact CE3-CG 4.11Å; W54-R65 HydrophobicContact CH2-CB 4.26Å; W54-R65 HydrophobicContact CH2-CG 4.37Å; W54-R65 HydrophobicContact CZ3-CB 4.27Å; W54-R65 HydrophobicContact CZ3-CG 3.94Å; W54-A82 HydrophobicContact CH2-CB 4.32Å; W54-R84 HydrophobicContact CD2-CB 3.82Å; W54-R84 VanDerWaalsContact CD2-CD 3.48Å; W54-R84 HydrophobicContact CD2-CG 4.32Å; W54-R84 HydrophobicContact CE3-CB 3.45Å; W54-R84 VanDerWaalsContact CE3-CB 3.45Å; W54-R84 HydrophobicContact CE3-CG 4.34Å; W54-R84 VanDerWaalsContact CG-NH1 3.34Å; W54-R84 HydrophobicContact CH2-CB 3.53Å; W54-R84 HydrophobicContact CZ2-CB 3.88Å; W54-R84 HydrophobicContact CZ3-CB 3.29Å; W54-W92 HydrophobicContact CB-CH2 4.15Å; W54-W92 HydrophobicContact CB-CZ2 4.04Å; W54-I96 HydrophobicContact CH2-CG2 4.11Å; W54-I96 HydrophobicContact CZ2-CG2 3.51Å |
| 55 | P | 84.8 | Confident | 83.6 | Confident | 17 Ų | 17 | 52.5 Ų | 52.5 | 11% | 0.11 | 30% | 0.297 | C | S | . | . | P | Polyproline II helix | trans | -77.1 | 168.5 | -176.7 | 33.7 | -33.9 | 0 | 0 | 0 | 111.7 | L20 T57 V63 W92 | L20-P55 HydrophobicContact CD2-CB 4.38Å; P55-T57 PolarHBondContact O-N 3.04Å; P55-T57 PolarHBondContact O-OG1 3.23Å; P55-V63 HydrophobicContact CG-CG1 4.26Å; P55-W92 WeakPolarHBondContact O-CZ2 3.34Å |
| 56 | R | 83.1 | Confident | 83.6 | Confident | 61 Ų | 61 | 54.4 Ų | 54.4 | 23% | 0.23 | 31% | 0.307 | C | S | . | . | P | Polyproline II helix | trans | -60.8 | 130.8 | 173.5 | -168 | -179.9 | -65.1 | 170.8 | 5.5 | 110.4 | D21 E25 F38 Y42 C43 | D21-R56 IonicContact OD1-CZ 3.69Å; D21-R56 IonicContact OD1-NE 3.63Å; D21-R56 IonicContact OD1-NH2 2.62Å; D21-R56 IonicContact OD2-CZ 2.7Å; D21-R56 IonicContact OD2-NE 2.9Å; D21-R56 IonicContact OD2-NH2 3.59Å; D21-R56 PolarHBondContact OD2-NH2 2.92Å; E25-R56 IonicContact OE1-CZ 3.57Å; E25-R56 IonicContact OE1-NH1 2.78Å; E25-R56 PolarHBondContact OE1-NH1 2.7Å; E25-R56 IonicContact OE1-NH2 3.58Å; E25-R56 PolarHBondContact OE1-NH2 2.87Å; F38-R56 HydrophobicContact CE2-CG 4.45Å; F38-R56 HydrophobicContact CZ-CG 4.46Å; Y42-R56 HydrophobicContact CD2-CG 3.83Å; Y42-R56 HydrophobicContact CE2-CG 4.34Å; C43-R56 WeakPolarHBondContact O-CA 3.26Å; C43-R56 WeakPolarHBondContact O-CG 3.03Å |
| 57 | T | 83.9 | Confident | 83.6 | Confident | 6 Ų | 6 | 52.3 Ų | 52.3 | 4% | 0.037 | 30% | 0.295 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -140.5 | 143.4 | -168.7 | -54.7 | 0 | 0 | 0 | 0 | 111.1 | Y42 C43 P55 E61 V63 C86 W92 | Y42-T57 CarbonylContact C-O 3.43Å; Y42-T57 WeakPolarHBondContact CA-O 3.38Å; Y42-T57 WeakPolarHBondContact CB-O 3.46Å; C43-T57 PolarHBondContact N-O 3.29Å; C43-T57 PolarHBondContact O-N 2.75Å; C43-T57 VanDerWaalsContact O-N 3.09Å; P55-T57 PolarHBondContact O-N 3.04Å; P55-T57 PolarHBondContact O-OG1 3.23Å; T57-E61 HydrophobicContact CG2-CB 3.76Å; T57-V63 HydrophobicContact CG2-CG2 3.28Å; T57-V63 WeakPolarHBondContact OG1-CG2 3.38Å; T57-C86 HydrophobicContact CG2-CB 4.14Å; T57-W92 WeakPolarHBondContact OG1-CH2 3.35Å |
| 58 | S | 85.9 | Confident | 83.7 | Confident | 27 Ų | 27 | 49.7 Ų | 49.7 | 19% | 0.189 | 28% | 0.279 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -70.7 | 153.2 | 177.8 | 77.3 | 0 | 0 | 0 | 0 | 112 | G60 E61 C86 | S58-G60 PolarHBondContact O-N 3.35Å; S58-E61 PolarHBondContact O-N 2.93Å; S58-E61 VanDerWaalsContact OG-CG 3.26Å; S58-E61 WeakPolarHBondContact OG-CG 3.21Å; S58-E61 PolarHBondContact OG-OE1 3.43Å; S58-E61 PolarHBondContact OG-OE2 2.96Å; S58-C86 WeakPolarHBondContact O-CB 3.36Å; S58-C86 PolarHBondContact O-SG 2.91Å |
| 59 | A | 87.1 | Confident | 83.5 | Confident | 30 Ų | 30 | 52.5 Ų | 52.5 | 25% | 0.248 | 29% | 0.291 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -65.4 | 131.6 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.2 | P41 L87 | P41-A59 HydrophobicContact CB-CB 4.2Å; P41-A59 HydrophobicContact CG-CB 3.82Å; P41-A59 WeakPolarHBondContact O-CB 3.37Å; P41-A59 PolarHBondContact O-N 3.19Å; A59-L87 WeakPolarHBondContact CB-O 3.22Å |
| 60 | G | 84.6 | Confident | 83.2 | Confident | 52 Ų | 52 | 48.7 Ų | 48.7 | 54% | 0.536 | 27% | 0.272 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 93.7 | -2.4 | -178.5 | 0 | 0 | 0 | 0 | 0 | 114.8 | S58 C86 | S58-G60 PolarHBondContact O-N 3.35Å; G60-C86 VanDerWaalsContact CA-O 3.29Å; G60-C86 WeakPolarHBondContact CA-O 3.25Å; G60-C86 PolarHBondContact N-O 2.96Å |
| 61 | E | 86.3 | Confident | 83.3 | Confident | 109 Ų | 109 | 49 Ų | 49 | 51% | 0.509 | 27% | 0.271 | S | S | . | . | P | Polyproline II helix | trans | -92.1 | 146.3 | 178.7 | -80.2 | 179.9 | -164.3 | 0 | 0 | 113.6 | T57 S58 C86 | T57-E61 HydrophobicContact CG2-CB 3.76Å; S58-E61 PolarHBondContact O-N 2.93Å; S58-E61 VanDerWaalsContact OG-CG 3.26Å; S58-E61 WeakPolarHBondContact OG-CG 3.21Å; S58-E61 PolarHBondContact OG-OE1 3.43Å; S58-E61 PolarHBondContact OG-OE2 2.96Å; E61-C86 PolarHBondContact O-N 3.31Å |
| 62 | L | 88.2 | Confident | 83 | Confident | 114 Ų | 114 | 53.5 Ų | 53.5 | 60% | 0.597 | 29% | 0.285 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -101 | 122.5 | 171.7 | -173.2 | 75.2 | 0 | 0 | 0 | 109.3 | Y83 E85 | L62-Y83 HydrophobicContact CD2-CD1 4.03Å; L62-Y83 HydrophobicContact CG-CD1 4.44Å; L62-E85 HydrophobicContact CD1-CB 3.92Å |
| 63 | V | 88.9 | Confident | 82.1 | Confident | 20 Ų | 20 | 55.6 Ų | 55.6 | 12% | 0.121 | 31% | 0.309 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -102.1 | 139.4 | 179.6 | -178 | 0 | 0 | 0 | 0 | 109.9 | W54 P55 T57 Y83 R84 W92 | W54-V63 HydrophobicContact CE3-CB 4.26Å; W54-V63 HydrophobicContact CE3-CG1 4.08Å; W54-V63 HydrophobicContact CZ3-CB 4.21Å; W54-V63 HydrophobicContact CZ3-CG1 4.14Å; P55-V63 HydrophobicContact CG-CG1 4.26Å; T57-V63 HydrophobicContact CG2-CG2 3.28Å; T57-V63 WeakPolarHBondContact OG1-CG2 3.38Å; V63-Y83 VanDerWaalsContact O-CA 3.3Å; V63-Y83 WeakPolarHBondContact O-CA 3.35Å; V63-R84 PolarHBondContact N-O 3.43Å; V63-R84 PolarHBondContact O-N 2.96Å; V63-W92 HydrophobicContact CG2-CH2 4.44Å |
| 64 | E | 87.7 | Confident | 81.4 | Confident | 112 Ų | 112 | 58.4 Ų | 58.4 | 52% | 0.523 | 32% | 0.323 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -110.6 | 141.8 | 171.1 | 62.7 | 177 | -179.9 | 0 | 0 | 112.1 | N81 A82 Y83 | E64-N81 HydrophobicContact CB-CB 4.23Å; E64-N81 PolarHBondContact OE2-ND2 3.42Å; E64-A82 WeakPolarHBondContact CA-O 3.37Å; E64-Y83 HydrophobicContact CB-CD1 3.93Å; E64-Y83 HydrophobicContact CB-CE1 3.93Å |
| 65 | R | 84.7 | Confident | 81.2 | Confident | 58 Ų | 58 | 62.9 Ų | 62.9 | 22% | 0.219 | 34% | 0.342 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -135.9 | 147.5 | 172.7 | -74.9 | -61.6 | -157.4 | -171.8 | 0.2 | 109.4 | T52 C53 W54 N81 A82 | T52-R65 HydrophobicContact CG2-CB 4.17Å; C53-R65 PolarHBondContact O-NE 2.99Å; W54-R65 HydrophobicContact CE3-CG 4.11Å; W54-R65 HydrophobicContact CH2-CB 4.26Å; W54-R65 HydrophobicContact CH2-CG 4.37Å; W54-R65 HydrophobicContact CZ3-CB 4.27Å; W54-R65 HydrophobicContact CZ3-CG 3.94Å; R65-N81 CarbonylContact O-C 3.52Å; R65-N81 WeakPolarHBondContact O-CA 3.48Å; R65-N81 WeakPolarHBondContact O-CB 3.4Å; R65-A82 PolarHBondContact N-O 3.38Å; R65-A82 PolarHBondContact O-N 3.35Å |
| 66 | P | 83.3 | Confident | 80.8 | Confident | 66 Ų | 66 | 64.2 Ų | 64.2 | 43% | 0.429 | 35% | 0.346 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -59.4 | 148.5 | 172.6 | 27.1 | -34 | 0 | 0 | 0 | 110.5 | ||
| 67 | C | 86 | Confident | 80.6 | Confident | 4 Ų | 4 | 64.2 Ų | 64.2 | 3% | 0.027 | 35% | 0.35 | C | S | . | . | P | Polyproline II helix | trans | -60.3 | 145 | 173.8 | -65.3 | 0 | 0 | 0 | 0 | 110.8 | R80 C101 | C67-R80 PolarHBondContact N-O 3.27Å; C67-R80 VanDerWaalsContact SG-C 3.56Å; C67-R80 PolarHBondContact SG-O 3.39Å; C67-C101 HydrophobicContact CB-CB 3.79Å; C67-C101 WeakPolarHBondContact CB-SG 3.44Å; C67-C101 WeakPolarHBondContact SG-CA 3.47Å; C67-C101 WeakPolarHBondContact SG-CB 3.38Å; C67-C101 CovalentContact SG-SG 2.03Å; C67-C101 PolarHBondContact SG-SG 3.25Å |
| 68 | P | 83.4 | Confident | 80.5 | Confident | 26 Ų | 26 | 67.3 Ų | 67.3 | 17% | 0.169 | 37% | 0.369 | C | S | . | . | P | Polyproline II helix | trans | -61.9 | 139.8 | -179.7 | 25.8 | -35 | 0 | 0 | 0 | 110.9 | I50 F70 Y76 | I50-P68 HydrophobicContact CG2-CB 4.34Å; I50-P68 HydrophobicContact CG2-CG 3.87Å; P68-F70 PolarHBondContact O-N 3.2Å; P68-Y76 WeakPolarHBondContact O-CB 3.34Å |
| 69 | E | 77.8 | Confident | 80.3 | Confident | 83 Ų | 83 | 71.6 Ų | 71.6 | 39% | 0.388 | 39% | 0.394 | S | S | . | . | S | Bend | trans | -67 | -39.9 | -178.6 | -166.9 | -177.2 | 177.7 | 0 | 0 | 111.8 | K75 Y76 T78 | E69-K75 WeakPolarHBondContact O-CA 3.42Å; E69-K75 VanDerWaalsContact OE1-CE 3.22Å; E69-K75 WeakPolarHBondContact OE1-CE 3.32Å; E69-K75 IonicContact OE1-NZ 3.11Å; E69-K75 PolarHBondContact OE1-NZ 2.89Å; E69-Y76 PolarHBondContact O-N 3.48Å; E69-T78 HydrophobicContact CB-CG2 3.96Å; E69-T78 HydrophobicContact CG-CG2 4.12Å |
| 70 | F | 72.3 | Confident | 80.1 | Confident | 123 Ų | 123 | 76.3 Ų | 76.3 | 54% | 0.539 | 41% | 0.406 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -133.2 | 130.3 | -179.9 | -68.5 | -82.9 | 0 | 0 | 0 | 111.8 | P68 I74 K75 | P68-F70 PolarHBondContact O-N 3.2Å; F70-I74 WeakPolarHBondContact CA-O 3.43Å; F70-K75 HydrophobicContact CD1-CB 4.26Å; F70-K75 HydrophobicContact CE1-CB 3.9Å; F70-K75 HydrophobicContact CE1-CD 4.22Å; F70-K75 HydrophobicContact CE1-CG 4.02Å; F70-K75 HydrophobicContact CZ-CD 4.04Å; F70-K75 HydrophobicContact CZ-CG 4.19Å |
| 71 | F | 76.8 | Confident | 80.3 | Confident | 62 Ų | 62 | 75.9 Ų | 75.9 | 27% | 0.272 | 39% | 0.391 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -136.5 | 127.8 | 168 | -179.8 | -115.7 | 0 | 0 | 0 | 109.6 | I50 G73 I74 Y76 | I50-F71 HydrophobicContact CB-CD2 4.15Å; I50-F71 HydrophobicContact CB-CE2 4.03Å; I50-F71 HydrophobicContact CD1-CZ 4.47Å; I50-F71 HydrophobicContact CG1-CD2 4.19Å; I50-F71 HydrophobicContact CG1-CE2 3.69Å; I50-F71 HydrophobicContact CG1-CZ 3.91Å; I50-F71 HydrophobicContact CG2-CB 4.36Å; I50-F71 HydrophobicContact CG2-CD2 3.53Å; I50-F71 HydrophobicContact CG2-CE2 3.93Å; I50-F71 HydrophobicContact CG2-CG 3.99Å; F71-G73 PolarHBondContact O-N 2.97Å; F71-G73 VanDerWaalsContact O-N 3.12Å; F71-I74 PolarHBondContact N-O 3.47Å; F71-I74 PolarHBondContact O-N 3.42Å; F71-Y76 HydrophobicContact CB-CD2 4.37Å; F71-Y76 HydrophobicContact CB-CE2 3.88Å |
| 72 | N | 67.2 | Low | 80.4 | Confident | 137 Ų | 137 | 70.7 Ų | 70.7 | 73% | 0.733 | 37% | 0.367 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 48.6 | 36.3 | -176.1 | -69.3 | -17.6 | 0 | 0 | 0 | 114.5 | I74 | N72-I74 VanDerWaalsContact C-N 3.32Å; N72-I74 PolarHBondContact O-N 3.41Å |
| 73 | G | 64.4 | Low | 80.5 | Confident | 57 Ų | 57 | 67.8 Ų | 67.8 | 59% | 0.588 | 35% | 0.348 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 76 | 12.5 | -179.9 | 0 | 0 | 0 | 0 | 0 | 115.4 | F71 K108 | F71-G73 PolarHBondContact O-N 2.97Å; F71-G73 VanDerWaalsContact O-N 3.12Å; G73-K108 PolarHBondContact O-NZ 3.33Å |
| 74 | I | 69.8 | Low | 80.5 | Confident | 62 Ų | 62 | 68.3 Ų | 68.3 | 32% | 0.318 | 35% | 0.348 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -109.8 | 132.7 | 176.2 | -56.3 | 173.6 | 0 | 0 | 0 | 108.7 | F70 F71 N72 Y76 P103 L105 | F70-I74 WeakPolarHBondContact CA-O 3.43Å; F71-I74 PolarHBondContact N-O 3.47Å; F71-I74 PolarHBondContact O-N 3.42Å; N72-I74 VanDerWaalsContact C-N 3.32Å; N72-I74 PolarHBondContact O-N 3.41Å; I74-Y76 HydrophobicContact CB-CE2 4.03Å; I74-Y76 HydrophobicContact CG2-CD2 4.49Å; I74-Y76 HydrophobicContact CG2-CE2 4Å; I74-Y76 WeakPolarHBondContact O-CD2 3.31Å; I74-P103 HydrophobicContact CG2-CB 3.89Å; I74-L105 HydrophobicContact CG2-CD1 4.11Å |
| 75 | K | 78.6 | Confident | 80.6 | Confident | 94 Ų | 94 | 67.4 Ų | 67.4 | 41% | 0.409 | 34% | 0.344 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -85.3 | 132.7 | 178.8 | -164.9 | 170.7 | -172.6 | 157.6 | 0 | 110.7 | E69 F70 I104 | E69-K75 WeakPolarHBondContact O-CA 3.42Å; E69-K75 VanDerWaalsContact OE1-CE 3.22Å; E69-K75 WeakPolarHBondContact OE1-CE 3.32Å; E69-K75 IonicContact OE1-NZ 3.11Å; E69-K75 PolarHBondContact OE1-NZ 2.89Å; F70-K75 HydrophobicContact CD1-CB 4.26Å; F70-K75 HydrophobicContact CE1-CB 3.9Å; F70-K75 HydrophobicContact CE1-CD 4.22Å; F70-K75 HydrophobicContact CE1-CG 4.02Å; F70-K75 HydrophobicContact CZ-CD 4.04Å; F70-K75 HydrophobicContact CZ-CG 4.19Å; K75-I104 HydrophobicContact CG-CD1 4.37Å; K75-I104 PolarHBondContact O-N 3.37Å |
| 76 | Y | 77.6 | Confident | 80.9 | Confident | 46 Ų | 46 | 64.7 Ų | 64.7 | 18% | 0.18 | 33% | 0.334 | C | S | . | . | B | Isolated β-bridge | trans | -113.3 | 159.9 | 178.8 | -72 | -104.9 | 0 | 0 | 0 | 111.5 | P68 E69 F71 I74 T78 C101 P103 | P68-Y76 WeakPolarHBondContact O-CB 3.34Å; E69-Y76 PolarHBondContact O-N 3.48Å; F71-Y76 HydrophobicContact CB-CD2 4.37Å; F71-Y76 HydrophobicContact CB-CE2 3.88Å; I74-Y76 HydrophobicContact CB-CE2 4.03Å; I74-Y76 HydrophobicContact CG2-CD2 4.49Å; I74-Y76 HydrophobicContact CG2-CE2 4Å; I74-Y76 WeakPolarHBondContact O-CD2 3.31Å; Y76-T78 PolarHBondContact O-N 3.45Å; Y76-C101 HydrophobicContact CD1-CB 4.39Å; Y76-P103 HydrophobicContact CD1-CB 4.08Å; Y76-P103 HydrophobicContact CE1-CB 3.82Å; Y76-P103 HydrophobicContact CE1-CG 4.41Å |
| 77 | N | 77.7 | Confident | 81.1 | Confident | 60 Ų | 60 | 64.5 Ų | 64.5 | 32% | 0.321 | 33% | 0.329 | S | S | . | . | trans | -78.2 | 109.4 | 177.8 | -171.6 | -13.1 | 0 | 0 | 0 | 111 | T79 E102 I104 | N77-T79 PolarHBondContact O-N 3.22Å; N77-T79 WeakPolarHBondContact OD1-CB 3.19Å; N77-T79 PolarHBondContact OD1-N 3.16Å; N77-T79 PolarHBondContact OD1-OG1 2.96Å; N77-E102 PolarHBondContact N-O 2.95Å; N77-I104 HydrophobicContact CB-CD1 4.4Å; N77-I104 HydrophobicContact CB-CG1 4.26Å | ||
| 78 | T | 81.6 | Confident | 81.2 | Confident | 71 Ų | 71 | 67.1 Ų | 67.1 | 44% | 0.436 | 36% | 0.357 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -74.7 | -6.4 | -179.9 | 54.6 | 0 | 0 | 0 | 0 | 114.1 | E69 Y76 R80 | E69-T78 HydrophobicContact CB-CG2 3.96Å; E69-T78 HydrophobicContact CG-CG2 4.12Å; Y76-T78 PolarHBondContact O-N 3.45Å; T78-R80 PolarHBondContact O-N 2.86Å |
| 79 | T | 81.5 | Confident | 81.4 | Confident | 117 Ų | 117 | 70.9 Ų | 70.9 | 72% | 0.718 | 38% | 0.375 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -74.3 | -13.5 | 176.2 | -39.4 | 0 | 0 | 0 | 0 | 112.4 | N77 | N77-T79 PolarHBondContact O-N 3.22Å; N77-T79 WeakPolarHBondContact OD1-CB 3.19Å; N77-T79 PolarHBondContact OD1-N 3.16Å; N77-T79 PolarHBondContact OD1-OG1 2.96Å |
| 80 | R | 83.8 | Confident | 81.6 | Confident | 130 Ų | 130 | 67.8 Ų | 67.8 | 49% | 0.491 | 37% | 0.365 | S | S | . | . | S | Bend | trans | -101.4 | 156.2 | 179.1 | -63.8 | -68.4 | -166.4 | 179.5 | 1.5 | 109.9 | C67 T78 Q100 | C67-R80 PolarHBondContact N-O 3.27Å; C67-R80 VanDerWaalsContact SG-C 3.56Å; C67-R80 PolarHBondContact SG-O 3.39Å; T78-R80 PolarHBondContact O-N 2.86Å; R80-Q100 HydrophobicContact CB-CB 4.17Å; R80-Q100 VanDerWaalsContact CB-O 3.22Å; R80-Q100 WeakPolarHBondContact CB-O 3.39Å; R80-Q100 WeakPolarHBondContact CG-O 3.33Å |
| 81 | N | 88.8 | Confident | 82.3 | Confident | 43 Ų | 43 | 65.1 Ų | 65.1 | 23% | 0.23 | 36% | 0.359 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -112.3 | 145.1 | -178 | -65 | -8.7 | 0 | 0 | 0 | 111.7 | E64 R65 Y83 | E64-N81 HydrophobicContact CB-CB 4.23Å; E64-N81 PolarHBondContact OE2-ND2 3.42Å; R65-N81 CarbonylContact O-C 3.52Å; R65-N81 WeakPolarHBondContact O-CA 3.48Å; R65-N81 WeakPolarHBondContact O-CB 3.4Å; N81-Y83 HydrophobicContact CB-CE2 4.46Å; N81-Y83 VanDerWaalsContact O-CE2 3.29Å; N81-Y83 WeakPolarHBondContact O-CE2 3.35Å |
| 82 | A | 88.6 | Confident | 82.9 | Confident | 0 Ų | 0 | 64 Ų | 64 | 0% | 0 | 35% | 0.353 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -96 | 150.5 | 164.5 | 0 | 0 | 0 | 0 | 0 | 110 | W54 E64 R65 N97 Y98 | W54-A82 HydrophobicContact CH2-CB 4.32Å; E64-A82 WeakPolarHBondContact CA-O 3.37Å; R65-A82 PolarHBondContact N-O 3.38Å; R65-A82 PolarHBondContact O-N 3.35Å; A82-N97 WeakPolarHBondContact CA-O 3.47Å; A82-Y98 HydrophobicContact CB-CD1 3.57Å; A82-Y98 HydrophobicContact CB-CE1 3.45Å; A82-Y98 VanDerWaalsContact CB-CE1 3.45Å; A82-Y98 HydrophobicContact CB-CG 4.34Å |
| 83 | Y | 89.8 | Confident | 83.9 | Confident | 53 Ų | 53 | 58.1 Ų | 58.1 | 21% | 0.208 | 32% | 0.324 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -123.9 | 140.6 | -175.8 | -51 | -95.9 | 0 | 0 | 0 | 112 | L62 V63 E64 N81 I96 N97 Q100 | L62-Y83 HydrophobicContact CD2-CD1 4.03Å; L62-Y83 HydrophobicContact CG-CD1 4.44Å; V63-Y83 VanDerWaalsContact O-CA 3.3Å; V63-Y83 WeakPolarHBondContact O-CA 3.35Å; E64-Y83 HydrophobicContact CB-CD1 3.93Å; E64-Y83 HydrophobicContact CB-CE1 3.93Å; N81-Y83 HydrophobicContact CB-CE2 4.46Å; N81-Y83 VanDerWaalsContact O-CE2 3.29Å; N81-Y83 WeakPolarHBondContact O-CE2 3.35Å; Y83-I96 WeakPolarHBondContact O-CG2 3.26Å; Y83-N97 PolarHBondContact N-O 3.35Å; Y83-N97 PolarHBondContact O-N 2.72Å; Y83-Q100 HydrophobicContact CE2-CG 4.41Å; Y83-Q100 PolarHBondContact OH-OE1 2.87Å; Y83-Q100 VanDerWaalsContact OH-OE1 3.13Å |
| 84 | R | 88.4 | Confident | 84.9 | Confident | 31 Ų | 31 | 61.8 Ų | 61.8 | 12% | 0.117 | 34% | 0.34 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -138.8 | 134.2 | 173.1 | -165.6 | 177.9 | -172.5 | -169.9 | -3.5 | 110.4 | T46 W54 V63 W92 I96 | T46-R84 PolarHBondContact OG1-NH1 2.98Å; W54-R84 HydrophobicContact CD2-CB 3.82Å; W54-R84 VanDerWaalsContact CD2-CD 3.48Å; W54-R84 HydrophobicContact CD2-CG 4.32Å; W54-R84 HydrophobicContact CE3-CB 3.45Å; W54-R84 VanDerWaalsContact CE3-CB 3.45Å; W54-R84 HydrophobicContact CE3-CG 4.34Å; W54-R84 VanDerWaalsContact CG-NH1 3.34Å; W54-R84 HydrophobicContact CH2-CB 3.53Å; W54-R84 HydrophobicContact CZ2-CB 3.88Å; W54-R84 HydrophobicContact CZ3-CB 3.29Å; V63-R84 PolarHBondContact N-O 3.43Å; V63-R84 PolarHBondContact O-N 2.96Å; R84-W92 HydrophobicContact CB-CZ3 4.34Å; R84-W92 HydrophobicContact CG-CE3 3.69Å; R84-W92 HydrophobicContact CG-CZ3 3.97Å; R84-W92 VanDerWaalsContact NH2-CB 3.3Å; R84-I96 HydrophobicContact CB-CG2 4.37Å; R84-I96 HydrophobicContact CG-CG1 4.07Å |
| 85 | E | 91.1 | Very high | 85.5 | Confident | 93 Ų | 93 | 67.5 Ų | 67.5 | 44% | 0.435 | 36% | 0.363 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -98.8 | 134.9 | -179.1 | -174 | -178.3 | 177.4 | 0 | 0 | 110.6 | L62 A93 | L62-E85 HydrophobicContact CD1-CB 3.92Å; E85-A93 HydrophobicContact CB-CB 4.18Å; E85-A93 WeakPolarHBondContact O-CB 3.05Å; E85-A93 PolarHBondContact O-N 3.06Å |
| 86 | C | 89.9 | Confident | 86 | Confident | 0 Ų | 0 | 64.7 Ų | 64.7 | 0% | 0 | 35% | 0.352 | C | S | . | . | B | Isolated β-bridge | trans | -89.8 | 116.2 | 164 | -177.1 | 0 | 0 | 0 | 0 | 108.6 | C43 T57 S58 G60 E61 W92 | C43-C86 HydrophobicContact CB-CB 3.9Å; C43-C86 WeakPolarHBondContact CB-SG 3.44Å; C43-C86 PolarHBondContact N-SG 3.46Å; C43-C86 VanDerWaalsContact SG-CA 3.5Å; C43-C86 WeakPolarHBondContact SG-CB 3.38Å; C43-C86 CovalentContact SG-SG 2.03Å; C43-C86 PolarHBondContact SG-SG 2.98Å; T57-C86 HydrophobicContact CG2-CB 4.14Å; S58-C86 WeakPolarHBondContact O-CB 3.36Å; S58-C86 PolarHBondContact O-SG 2.91Å; G60-C86 VanDerWaalsContact CA-O 3.29Å; G60-C86 WeakPolarHBondContact CA-O 3.25Å; G60-C86 PolarHBondContact N-O 2.96Å; E61-C86 PolarHBondContact O-N 3.31Å; C86-W92 HydrophobicContact CB-CE3 4.32Å; C86-W92 HydrophobicContact CB-CZ3 4.21Å |
| 87 | L | 89.1 | Confident | 86.4 | Confident | 62 Ų | 62 | 66.2 Ų | 66.2 | 33% | 0.325 | 36% | 0.364 | S | S | . | . | P | Polyproline II helix | trans | -68.4 | 156.1 | -177.8 | -62.1 | 171.5 | 0 | 0 | 0 | 110.7 | A59 N89 G90 T91 A93 | A59-L87 WeakPolarHBondContact CB-O 3.22Å; L87-N89 VanDerWaalsContact CB-OD1 3.28Å; L87-N89 WeakPolarHBondContact CB-OD1 2.99Å; L87-N89 PolarHBondContact O-N 2.82Å; L87-G90 PolarHBondContact O-N 2.97Å; L87-T91 VanDerWaalsContact CB-O 3.24Å; L87-T91 WeakPolarHBondContact CB-O 3.06Å; L87-T91 WeakPolarHBondContact CG-O 3.4Å; L87-T91 PolarHBondContact N-O 3.03Å; L87-A93 HydrophobicContact CD2-CB 4.5Å; L87-A93 HydrophobicContact CG-CB 4.46Å |
| 88 | G | 86.6 | Confident | 86.7 | Confident | 60 Ų | 60 | 65.8 Ų | 65.8 | 62% | 0.619 | 36% | 0.358 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -56.9 | -15 | -179.5 | 0 | 0 | 0 | 0 | 0 | 115.6 | ||
| 89 | N | 87.4 | Confident | 86.9 | Confident | 105 Ų | 105 | 66.5 Ų | 66.5 | 56% | 0.561 | 37% | 0.366 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -90.7 | 2.8 | 176.7 | 69.3 | -11.4 | 0 | 0 | 0 | 114 | L87 T91 | L87-N89 VanDerWaalsContact CB-OD1 3.28Å; L87-N89 WeakPolarHBondContact CB-OD1 2.99Å; L87-N89 PolarHBondContact O-N 2.82Å; N89-T91 PolarHBondContact ND2-OG1 3.29Å; N89-T91 WeakPolarHBondContact OD1-CB 3.19Å; N89-T91 PolarHBondContact OD1-N 3.42Å; N89-T91 PolarHBondContact OD1-OG1 3.33Å |
| 90 | G | 82.6 | Confident | 87 | Confident | 17 Ų | 17 | 64.3 Ų | 64.3 | 18% | 0.175 | 35% | 0.347 | C | S | . | . | S | Bend | trans | 79.3 | 18.5 | -176.1 | 0 | 0 | 0 | 0 | 0 | 114.3 | C43 L87 | C43-G90 VanDerWaalsContact SG-C 3.57Å; L87-G90 PolarHBondContact O-N 2.97Å |
| 91 | T | 88.2 | Confident | 86.9 | Confident | 67 Ų | 67 | 59 Ų | 59 | 41% | 0.411 | 33% | 0.33 | S | S | . | . | trans | -112 | 143.1 | 174.9 | 64.6 | 0 | 0 | 0 | 0 | 111.5 | C43 L87 N89 | C43-T91 PolarHBondContact SG-O 2.98Å; L87-T91 VanDerWaalsContact CB-O 3.24Å; L87-T91 WeakPolarHBondContact CB-O 3.06Å; L87-T91 WeakPolarHBondContact CG-O 3.4Å; L87-T91 PolarHBondContact N-O 3.03Å; N89-T91 PolarHBondContact ND2-OG1 3.29Å; N89-T91 WeakPolarHBondContact OD1-CB 3.19Å; N89-T91 PolarHBondContact OD1-N 3.42Å; N89-T91 PolarHBondContact OD1-OG1 3.33Å | ||
| 92 | W | 88 | Confident | 86.5 | Confident | 38 Ų | 38 | 63.2 Ų | 63.2 | 14% | 0.144 | 35% | 0.348 | C | S | . | . | B | Isolated β-bridge | trans | -64.9 | 140.7 | 174.7 | -73.5 | 113.2 | 0 | 0 | 0 | 111.1 | C43 N44 T46 W54 P55 T57 V63 R84 C86 S94 | C43-W92 HydrophobicContact CB-CD2 3.71Å; C43-W92 HydrophobicContact CB-CE3 4.2Å; C43-W92 HydrophobicContact CB-CG 4.14Å; C43-W92 HydrophobicContact CB-CH2 4.18Å; C43-W92 HydrophobicContact CB-CZ2 3.66Å; C43-W92 HydrophobicContact CB-CZ3 4.43Å; N44-W92 PolarHBondContact O-NE1 2.9Å; T46-W92 PolarHBondContact OG1-NE1 3.32Å; W54-W92 HydrophobicContact CB-CH2 4.15Å; W54-W92 HydrophobicContact CB-CZ2 4.04Å; P55-W92 WeakPolarHBondContact O-CZ2 3.34Å; T57-W92 WeakPolarHBondContact OG1-CH2 3.35Å; V63-W92 HydrophobicContact CG2-CH2 4.44Å; R84-W92 HydrophobicContact CB-CZ3 4.34Å; R84-W92 HydrophobicContact CG-CE3 3.69Å; R84-W92 HydrophobicContact CG-CZ3 3.97Å; R84-W92 VanDerWaalsContact NH2-CB 3.3Å; C86-W92 HydrophobicContact CB-CE3 4.32Å; C86-W92 HydrophobicContact CB-CZ3 4.21Å; W92-S94 PolarHBondContact O-N 3.25Å |
| 93 | A | 88.6 | Confident | 85.9 | Confident | 15 Ų | 15 | 65.9 Ų | 65.9 | 12% | 0.124 | 37% | 0.366 | C | S | . | . | trans | -56.4 | 138.7 | 168.2 | 0 | 0 | 0 | 0 | 0 | 110.9 | E85 L87 K95 | E85-A93 HydrophobicContact CB-CB 4.18Å; E85-A93 WeakPolarHBondContact O-CB 3.05Å; E85-A93 PolarHBondContact O-N 3.06Å; L87-A93 HydrophobicContact CD2-CB 4.5Å; L87-A93 HydrophobicContact CG-CB 4.46Å; A93-K95 PolarHBondContact O-N 3.41Å | ||
| 94 | S | 84.8 | Confident | 85.1 | Confident | 133 Ų | 133 | 67.4 Ų | 67.4 | 93% | 0.93 | 38% | 0.377 | S | S | * | . | S | Bend | trans | -64.4 | -27.8 | -177.7 | 179.9 | 0 | 0 | 0 | 0 | 113 | W92 | W92-S94 PolarHBondContact O-N 3.25Š|
| 95 | K | 83.6 | Confident | 84 | Confident | 183 Ų | 183 | 70.1 Ų | 70.1 | 80% | 0.796 | 39% | 0.393 | S | S | * | . | S | Bend | trans | -114.8 | 128.5 | -178.8 | -170.1 | 176.6 | -179.2 | -178.3 | 0 | 110.8 | A93 | A93-K95 PolarHBondContact O-N 3.41Š|
| 96 | I | 87.7 | Confident | 82.6 | Confident | 35 Ų | 35 | 69.9 Ų | 69.9 | 18% | 0.179 | 40% | 0.395 | C | S | . | . | trans | -93.7 | 138 | 173.7 | -54.5 | 167.9 | 0 | 0 | 0 | 108.6 | D48 W54 Y83 R84 Y98 | D48-I96 HydrophobicContact CB-CD1 3.71Å; W54-I96 HydrophobicContact CH2-CG2 4.11Å; W54-I96 HydrophobicContact CZ2-CG2 3.51Å; Y83-I96 WeakPolarHBondContact O-CG2 3.26Å; R84-I96 HydrophobicContact CB-CG2 4.37Å; R84-I96 HydrophobicContact CG-CG1 4.07Å; I96-Y98 HydrophobicContact CB-CD2 3.93Å; I96-Y98 HydrophobicContact CB-CE2 3.68Å; I96-Y98 HydrophobicContact CD1-CE2 4.21Å; I96-Y98 HydrophobicContact CG2-CD2 3.64Å; I96-Y98 HydrophobicContact CG2-CE2 3.25Å; I96-Y98 PolarHBondContact O-N 3.48Å | ||
| 97 | N | 86.6 | Confident | 81.2 | Confident | 78 Ų | 78 | 73 Ų | 73 | 42% | 0.417 | 41% | 0.412 | S | S | . | . | B | Isolated β-bridge | trans | -91.4 | 95.6 | -179.3 | -170.5 | -5.2 | 0 | 0 | 0 | 111.2 | A82 Y83 S99 | A82-N97 WeakPolarHBondContact CA-O 3.47Å; Y83-N97 PolarHBondContact N-O 3.35Å; Y83-N97 PolarHBondContact O-N 2.72Å; N97-S99 WeakPolarHBondContact OD1-CB 3.24Å; N97-S99 PolarHBondContact OD1-N 2.88Å; N97-S99 VanDerWaalsContact OD1-N 3.08Å; N97-S99 PolarHBondContact OD1-OG 3.47Å |
| 98 | Y | 85.2 | Confident | 79.9 | Confident | 50 Ų | 50 | 77.1 Ų | 77.1 | 20% | 0.196 | 43% | 0.427 | C | S | . | . | trans | -96.1 | 14.7 | 174.4 | -78.5 | -75.6 | 0 | 0 | 0 | 113.7 | D48 I50 T52 A82 I96 Q100 C101 | D48-Y98 PolarHBondContact OD2-OH 2.91Å; I50-Y98 HydrophobicContact CD1-CD2 4.34Å; I50-Y98 HydrophobicContact CD1-CE2 3.98Å; T52-Y98 VanDerWaalsContact CB-OH 3.3Å; T52-Y98 WeakPolarHBondContact CB-OH 3.38Å; T52-Y98 PolarHBondContact OG1-OH 3.36Å; A82-Y98 HydrophobicContact CB-CD1 3.57Å; A82-Y98 HydrophobicContact CB-CE1 3.45Å; A82-Y98 VanDerWaalsContact CB-CE1 3.45Å; A82-Y98 HydrophobicContact CB-CG 4.34Å; I96-Y98 HydrophobicContact CB-CD2 3.93Å; I96-Y98 HydrophobicContact CB-CE2 3.68Å; I96-Y98 HydrophobicContact CD1-CE2 4.21Å; I96-Y98 HydrophobicContact CG2-CD2 3.64Å; I96-Y98 HydrophobicContact CG2-CE2 3.25Å; I96-Y98 PolarHBondContact O-N 3.48Å; Y98-Q100 PolarHBondContact O-N 3.4Å; Y98-Q100 VanDerWaalsContact O-N 3.11Å; Y98-C101 HydrophobicContact CD1-CB 4.34Å; Y98-C101 WeakPolarHBondContact O-CB 3.48Å; Y98-C101 PolarHBondContact O-N 3.34Å | ||
| 99 | S | 84.3 | Confident | 78.8 | Confident | 87 Ų | 87 | 82.7 Ų | 82.7 | 61% | 0.608 | 43% | 0.429 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -61.9 | -22.8 | -172.4 | 58.5 | 0 | 0 | 0 | 0 | 114.9 | N97 | N97-S99 WeakPolarHBondContact OD1-CB 3.24Å; N97-S99 PolarHBondContact OD1-N 2.88Å; N97-S99 VanDerWaalsContact OD1-N 3.08Å; N97-S99 PolarHBondContact OD1-OG 3.47Å |
| 100 | Q | 83.6 | Confident | 77.8 | Confident | 71 Ų | 71 | 82.4 Ų | 82.4 | 33% | 0.332 | 42% | 0.423 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -90.2 | -6.6 | 177.9 | -59.9 | -167.9 | -15.6 | 0 | 0 | 113.4 | R80 Y83 Y98 E102 | R80-Q100 HydrophobicContact CB-CB 4.17Å; R80-Q100 VanDerWaalsContact CB-O 3.22Å; R80-Q100 WeakPolarHBondContact CB-O 3.39Å; R80-Q100 WeakPolarHBondContact CG-O 3.33Å; Y83-Q100 HydrophobicContact CE2-CG 4.41Å; Y83-Q100 PolarHBondContact OH-OE1 2.87Å; Y83-Q100 VanDerWaalsContact OH-OE1 3.13Å; Y98-Q100 PolarHBondContact O-N 3.4Å; Y98-Q100 VanDerWaalsContact O-N 3.11Å; Q100-E102 PolarHBondContact O-N 2.92Å; Q100-E102 VanDerWaalsContact O-N 3.17Å |
| 101 | C | 82.9 | Confident | 77.2 | Confident | 19 Ų | 19 | 84.1 Ų | 84.1 | 13% | 0.128 | 42% | 0.424 | C | S | . | . | trans | -86.1 | 88.7 | -179.1 | -59 | 0 | 0 | 0 | 0 | 110.5 | C67 Y76 Y98 | C67-C101 HydrophobicContact CB-CB 3.79Å; C67-C101 WeakPolarHBondContact CB-SG 3.44Å; C67-C101 WeakPolarHBondContact SG-CA 3.47Å; C67-C101 WeakPolarHBondContact SG-CB 3.38Å; C67-C101 CovalentContact SG-SG 2.03Å; C67-C101 PolarHBondContact SG-SG 3.25Å; Y76-C101 HydrophobicContact CD1-CB 4.39Å; Y98-C101 HydrophobicContact CD1-CB 4.34Å; Y98-C101 WeakPolarHBondContact O-CB 3.48Å; Y98-C101 PolarHBondContact O-N 3.34Å | ||
| 102 | E | 80.8 | Confident | 76.4 | Confident | 130 Ų | 130 | 83.3 Ų | 83.3 | 61% | 0.607 | 42% | 0.424 | S | S | * | . | trans | -89.6 | 136.3 | 177.7 | -67.8 | -179.1 | 168.6 | 0 | 0 | 111.6 | N77 Q100 | N77-E102 PolarHBondContact N-O 2.95Å; Q100-E102 PolarHBondContact O-N 2.92Å; Q100-E102 VanDerWaalsContact O-N 3.17Å | ||
| 103 | P | 76.2 | Confident | 76 | Confident | 57 Ų | 57 | 86.4 Ų | 86.4 | 37% | 0.37 | 44% | 0.443 | S | S | . | . | B | Isolated β-bridge | trans | -75.5 | 140.9 | 177.1 | 32.5 | -35.6 | 0 | 0 | 0 | 110.9 | I74 Y76 L105 | I74-P103 HydrophobicContact CG2-CB 3.89Å; Y76-P103 HydrophobicContact CD1-CB 4.08Å; Y76-P103 HydrophobicContact CE1-CB 3.82Å; Y76-P103 HydrophobicContact CE1-CG 4.41Å; P103-L105 HydrophobicContact CB-CD1 3.58Å; P103-L105 HydrophobicContact CG-CD1 3.76Å; P103-L105 PolarHBondContact O-N 2.76Å |
| 104 | I | 72.3 | Confident | 75.5 | Confident | 85 Ų | 85 | 88.6 Ų | 88.6 | 44% | 0.436 | 45% | 0.451 | S | S | . | . | trans | -79.9 | 73.3 | 174.6 | -52.9 | 173.5 | 0 | 0 | 0 | 107.9 | K75 N77 | K75-I104 HydrophobicContact CG-CD1 4.37Å; K75-I104 PolarHBondContact O-N 3.37Å; N77-I104 HydrophobicContact CB-CD1 4.4Å; N77-I104 HydrophobicContact CB-CG1 4.26Å | ||
| 105 | L | 64.9 | Low | 75.2 | Confident | 88 Ų | 88 | 89.2 Ų | 89.2 | 46% | 0.461 | 43% | 0.434 | S | S | . | . | trans | -86.5 | -11.8 | -175.6 | -120.2 | 83.6 | 0 | 0 | 0 | 114 | I74 P103 D107 R109 | I74-L105 HydrophobicContact CG2-CD1 4.11Å; P103-L105 HydrophobicContact CB-CD1 3.58Å; P103-L105 HydrophobicContact CG-CD1 3.76Å; P103-L105 PolarHBondContact O-N 2.76Å; L105-D107 VanDerWaalsContact C-N 3.28Å; L105-D107 PolarHBondContact O-N 3.43Å; L105-R109 PolarHBondContact O-N 3.43Å | ||
| 106 | D | 61.7 | Low | 75.1 | Confident | 87 Ų | 87 | 87 Ų | 87 | 47% | 0.465 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -69.6 | -30 | -163.7 | -150.4 | 21.4 | 0 | 0 | 0 | 112.2 | K110 | D106-K110 VanDerWaalsContact CG-NZ 3.33Å; D106-K110 WeakPolarHBondContact O-CB 3.44Å; D106-K110 VanDerWaalsContact O-CD 3.27Å; D106-K110 WeakPolarHBondContact O-CD 3.47Å; D106-K110 WeakPolarHBondContact O-CG 3.49Å; D106-K110 PolarHBondContact O-N 2.98Å; D106-K110 WeakPolarHBondContact OD1-CE 3.45Å; D106-K110 IonicContact OD1-NZ 2.76Å; D106-K110 WeakPolarHBondContact OD2-CE 3.41Å; D106-K110 IonicContact OD2-NZ 3.95Å; D106-K110 PolarHBondContact OD2-NZ 2.87Å |
| 107 | D | 61.3 | Low | 75 | Confident | 67 Ų | 67 | 88.6 Ų | 88.6 | 36% | 0.358 | 43% | 0.432 | S | S | . | . | H | α-helix | trans | -75.5 | -55.7 | -176.9 | -138.9 | 16.6 | 0 | 0 | 0 | 111.8 | L105 R109 K110 Y111 | L105-D107 VanDerWaalsContact C-N 3.28Å; L105-D107 PolarHBondContact O-N 3.43Å; D107-R109 PolarHBondContact O-N 3.01Å; D107-R109 VanDerWaalsContact O-N 3.12Å; D107-K110 PolarHBondContact O-N 2.92Å; D107-K110 VanDerWaalsContact O-N 3.11Å; D107-Y111 HydrophobicContact CB-CE2 4.33Å; D107-Y111 WeakPolarHBondContact O-CD2 3.29Å; D107-Y111 PolarHBondContact O-N 3.16Å; D107-Y111 WeakPolarHBondContact OD1-CE2 3.29Å |
| 108 | K | 60.8 | Low | 74.8 | Confident | 147 Ų | 147 | 85 Ų | 85 | 64% | 0.639 | 41% | 0.413 | S | S | * | . | H | α-helix | trans | -55.9 | -36.2 | 179.4 | -69.4 | -172.8 | -179.7 | -178.9 | 0 | 112.9 | G73 A112 | G73-K108 PolarHBondContact O-NZ 3.33Å; K108-A112 PolarHBondContact O-N 2.79Å |
| 109 | R | 64.1 | Low | 74.7 | Confident | 178 Ų | 178 | 85.5 Ų | 85.5 | 67% | 0.672 | 42% | 0.419 | S | S | * | . | H | α-helix | trans | -75.5 | -37.2 | -179.6 | -166.6 | 163.2 | 70.6 | 172.9 | 1.8 | 112.6 | L105 D107 L113 | L105-R109 PolarHBondContact O-N 3.43Å; D107-R109 PolarHBondContact O-N 3.01Å; D107-R109 VanDerWaalsContact O-N 3.12Å; R109-L113 PolarHBondContact O-N 3.23Å |
| 110 | K | 66.9 | Low | 74.8 | Confident | 98 Ų | 98 | 86.3 Ų | 86.3 | 43% | 0.426 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -63.5 | -45.2 | 173.3 | -75.6 | 168.4 | -178.9 | 167.1 | 0 | 110.7 | D106 D107 A112 L113 H114 | D106-K110 VanDerWaalsContact CG-NZ 3.33Å; D106-K110 WeakPolarHBondContact O-CB 3.44Å; D106-K110 VanDerWaalsContact O-CD 3.27Å; D106-K110 WeakPolarHBondContact O-CD 3.47Å; D106-K110 WeakPolarHBondContact O-CG 3.49Å; D106-K110 PolarHBondContact O-N 2.98Å; D106-K110 WeakPolarHBondContact OD1-CE 3.45Å; D106-K110 IonicContact OD1-NZ 2.76Å; D106-K110 WeakPolarHBondContact OD2-CE 3.41Å; D106-K110 IonicContact OD2-NZ 3.95Å; D106-K110 PolarHBondContact OD2-NZ 2.87Å; D107-K110 PolarHBondContact O-N 2.92Å; D107-K110 VanDerWaalsContact O-N 3.11Å; K110-A112 PolarHBondContact O-N 3.1Å; K110-L113 PolarHBondContact O-N 2.85Å; K110-H114 PolarHBondContact O-CD2 2.91Å; K110-H114 PolarHBondContact O-N 2.96Å |
| 111 | Y | 68.7 | Low | 75 | Confident | 53 Ų | 53 | 85.5 Ų | 85.5 | 21% | 0.208 | 41% | 0.413 | C | S | . | . | H | α-helix | trans | -57.9 | -46.3 | 175.6 | -77.4 | -67.1 | 0 | 0 | 0 | 113.6 | D107 L113 H114 Y115 D336 I340 | D107-Y111 HydrophobicContact CB-CE2 4.33Å; D107-Y111 WeakPolarHBondContact O-CD2 3.29Å; D107-Y111 PolarHBondContact O-N 3.16Å; D107-Y111 WeakPolarHBondContact OD1-CE2 3.29Å; Y111-L113 VanDerWaalsContact C-N 3.3Å; Y111-L113 PolarHBondContact O-N 2.97Å; Y111-H114 PolarHBondContact O-N 3.29Å; Y111-Y115 VanDerWaalsContact O-CB 3.29Å; Y111-Y115 WeakPolarHBondContact O-CB 3.36Å; Y111-Y115 PolarHBondContact O-N 3.34Å; Y111-D336 WeakPolarHBondContact OH-CA 2.83Å; Y111-D336 WeakPolarHBondContact OH-CB 3.27Å; Y111-D336 PolarHBondContact OH-OD1 3.39Å; Y111-I340 HydrophobicContact CD1-CD1 4.47Å; Y111-I340 HydrophobicContact CD1-CG1 4.17Å; Y111-I340 HydrophobicContact CE1-CD1 4.07Å; Y111-I340 HydrophobicContact CE1-CG1 3.82Å |
| 112 | A | 72.3 | Confident | 75.2 | Confident | 50 Ų | 50 | 85.6 Ų | 85.6 | 41% | 0.413 | 41% | 0.412 | S | S | . | . | H | α-helix | trans | -62.4 | -36.8 | 178.3 | 0 | 0 | 0 | 0 | 0 | 112.6 | K108 K110 K116 | K108-A112 PolarHBondContact O-N 2.79Å; K110-A112 PolarHBondContact O-N 3.1Å; A112-K116 VanDerWaalsContact O-CG 3.31Å; A112-K116 WeakPolarHBondContact O-CG 3.47Å; A112-K116 PolarHBondContact O-N 3.15Å; A112-K116 VanDerWaalsContact O-N 3.11Å |
| 113 | L | 78.6 | Confident | 75.6 | Confident | 104 Ų | 104 | 84.9 Ų | 84.9 | 55% | 0.545 | 40% | 0.404 | S | S | . | . | H | α-helix | trans | -68.9 | -48.2 | 175.8 | -177.8 | 64.5 | 0 | 0 | 0 | 111.5 | R109 K110 Y111 Y115 K116 I117 | R109-L113 PolarHBondContact O-N 3.23Å; K110-L113 PolarHBondContact O-N 2.85Å; Y111-L113 VanDerWaalsContact C-N 3.3Å; Y111-L113 PolarHBondContact O-N 2.97Å; L113-Y115 VanDerWaalsContact C-N 3.3Å; L113-Y115 PolarHBondContact O-N 3.39Å; L113-K116 PolarHBondContact O-N 3.24Å; L113-I117 HydrophobicContact CD1-CD1 4.36Å; L113-I117 HydrophobicContact CG-CD1 4.06Å; L113-I117 WeakPolarHBondContact O-CG1 3.36Å; L113-I117 PolarHBondContact O-N 3.11Å |
| 114 | H | 78.8 | Confident | 76.3 | Confident | 60 Ų | 60 | 86.7 Ų | 86.7 | 28% | 0.278 | 41% | 0.411 | S | S | . | . | H | α-helix | trans | -60.7 | -40.6 | 178.3 | -75.2 | -62.3 | 0 | 0 | 0 | 112 | K110 Y111 I117 A118 I340 Y344 | K110-H114 PolarHBondContact O-CD2 2.91Å; K110-H114 PolarHBondContact O-N 2.96Å; Y111-H114 PolarHBondContact O-N 3.29Å; H114-I117 PolarHBondContact O-N 2.9Å; H114-A118 WeakPolarHBondContact O-CB 3.43Å; H114-A118 PolarHBondContact O-N 3.45Å; H114-I340 HydrophobicContact CB-CG2 4.25Å; H114-Y344 WeakPolarHBondContact CA-OH 3.34Å; H114-Y344 HydrophobicContact CB-CE2 4.14Å; H114-Y344 AromaticContact ND1-CE2 3.58Å; H114-Y344 AromaticContact ND1-CZ 3.71Å; H114-Y344 PolarHBondContact ND1-OH 3.44Å; H114-Y344 PolarHBondContact O-OH 3.07Å |
| 115 | Y | 77.5 | Confident | 77.2 | Confident | 146 Ų | 146 | 82.7 Ų | 82.7 | 57% | 0.573 | 39% | 0.39 | S | S | * | . | H | α-helix | trans | -60.9 | -46.1 | 174 | -179.9 | -98.3 | 0 | 0 | 0 | 112.5 | Y111 L113 I117 A118 L119 | Y111-Y115 VanDerWaalsContact O-CB 3.29Å; Y111-Y115 WeakPolarHBondContact O-CB 3.36Å; Y111-Y115 PolarHBondContact O-N 3.34Å; L113-Y115 VanDerWaalsContact C-N 3.3Å; L113-Y115 PolarHBondContact O-N 3.39Å; Y115-I117 VanDerWaalsContact C-N 3.33Å; Y115-I117 PolarHBondContact O-N 3.16Å; Y115-A118 PolarHBondContact O-N 2.98Å; Y115-L119 PolarHBondContact O-N 3.26Å |
| 116 | K | 82.6 | Confident | 78.4 | Confident | 138 Ų | 138 | 78.7 Ų | 78.7 | 60% | 0.6 | 37% | 0.369 | S | S | * | . | H | α-helix | trans | -60.1 | -42.4 | 176.2 | -76.7 | 179 | -178.9 | -171.5 | 0 | 112.1 | A112 L113 L119 I120 | A112-K116 VanDerWaalsContact O-CG 3.31Å; A112-K116 WeakPolarHBondContact O-CG 3.47Å; A112-K116 PolarHBondContact O-N 3.15Å; A112-K116 VanDerWaalsContact O-N 3.11Å; L113-K116 PolarHBondContact O-N 3.24Å; K116-L119 PolarHBondContact O-N 3.43Å; K116-I120 WeakPolarHBondContact O-CG1 3.49Å; K116-I120 PolarHBondContact O-N 3.26Å; K116-I120 VanDerWaalsContact O-N 3.11Å |
| 117 | I | 85 | Confident | 79.8 | Confident | 68 Ų | 68 | 77 Ų | 77 | 35% | 0.349 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -65.4 | -43.7 | 176.9 | -62 | 165.2 | 0 | 0 | 0 | 110.4 | L113 H114 Y115 L119 I120 I121 Y344 | L113-I117 HydrophobicContact CD1-CD1 4.36Å; L113-I117 HydrophobicContact CG-CD1 4.06Å; L113-I117 WeakPolarHBondContact O-CG1 3.36Å; L113-I117 PolarHBondContact O-N 3.11Å; H114-I117 PolarHBondContact O-N 2.9Å; Y115-I117 VanDerWaalsContact C-N 3.33Å; Y115-I117 PolarHBondContact O-N 3.16Å; I117-L119 VanDerWaalsContact C-N 3.29Å; I117-L119 PolarHBondContact O-N 2.99Å; I117-I120 PolarHBondContact O-N 3.29Å; I117-I121 HydrophobicContact CG2-CD1 4.11Å; I117-I121 WeakPolarHBondContact O-CG1 3.48Å; I117-I121 PolarHBondContact O-N 3.02Å; I117-Y344 HydrophobicContact CB-CE1 4.19Å; I117-Y344 HydrophobicContact CG2-CE1 3.84Å |
| 118 | A | 82.4 | Confident | 81.3 | Confident | 1 Ų | 1 | 77.7 Ų | 77.7 | 1% | 0.008 | 37% | 0.366 | C | S | . | . | H | α-helix | trans | -60.3 | -38.7 | 176.5 | 0 | 0 | 0 | 0 | 0 | 111.9 | H114 Y115 I121 N122 I343 Y344 | H114-A118 WeakPolarHBondContact O-CB 3.43Å; H114-A118 PolarHBondContact O-N 3.45Å; Y115-A118 PolarHBondContact O-N 2.98Å; A118-I121 PolarHBondContact O-N 2.87Å; A118-N122 VanDerWaalsContact O-CB 3.29Å; A118-N122 WeakPolarHBondContact O-CB 3.29Å; A118-N122 PolarHBondContact O-N 3.37Å; A118-I343 HydrophobicContact CB-CG2 3.9Å; A118-Y344 HydrophobicContact CB-CD1 4.06Å; A118-Y344 HydrophobicContact CB-CE1 4Å |
| 119 | L | 83.7 | Confident | 82.8 | Confident | 62 Ų | 62 | 70.7 Ų | 70.7 | 33% | 0.325 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -62.7 | -42.1 | 174.7 | -175.3 | 65.4 | 0 | 0 | 0 | 112.2 | Y115 K116 I117 N122 Y123 | Y115-L119 PolarHBondContact O-N 3.26Å; K116-L119 PolarHBondContact O-N 3.43Å; I117-L119 VanDerWaalsContact C-N 3.29Å; I117-L119 PolarHBondContact O-N 2.99Å; L119-N122 WeakPolarHBondContact O-CB 3.42Å; L119-N122 PolarHBondContact O-N 3.38Å; L119-Y123 WeakPolarHBondContact O-CB 3.4Å; L119-Y123 PolarHBondContact O-N 2.89Å |
| 120 | I | 86.3 | Confident | 84.1 | Confident | 103 Ų | 103 | 63.2 Ų | 63.2 | 53% | 0.528 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -62.5 | -46.4 | 176.1 | -66.3 | 164.8 | 0 | 0 | 0 | 110.6 | K116 I117 N122 Y123 L124 | K116-I120 WeakPolarHBondContact O-CG1 3.49Å; K116-I120 PolarHBondContact O-N 3.26Å; K116-I120 VanDerWaalsContact O-N 3.11Å; I117-I120 PolarHBondContact O-N 3.29Å; I120-N122 VanDerWaalsContact C-N 3.3Å; I120-N122 PolarHBondContact O-N 3.15Å; I120-Y123 PolarHBondContact O-N 2.79Å; I120-L124 HydrophobicContact CG2-CD1 4.03Å; I120-L124 HydrophobicContact CG2-CG 4.46Å; I120-L124 WeakPolarHBondContact O-CG 3.36Å; I120-L124 PolarHBondContact O-N 3.46Å |
| 121 | I | 87.5 | Confident | 85.3 | Confident | 55 Ų | 55 | 60.3 Ų | 60.3 | 28% | 0.282 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -59.3 | -45.3 | 176.6 | -67 | 167.4 | 0 | 0 | 0 | 110.2 | I117 A118 Y123 L124 G125 Y344 F348 | I117-I121 HydrophobicContact CG2-CD1 4.11Å; I117-I121 WeakPolarHBondContact O-CG1 3.48Å; I117-I121 PolarHBondContact O-N 3.02Å; A118-I121 PolarHBondContact O-N 2.87Å; I121-Y123 PolarHBondContact O-N 2.97Å; I121-L124 PolarHBondContact O-N 3.47Å; I121-G125 PolarHBondContact O-N 2.91Å; I121-Y344 HydrophobicContact CD1-CD1 3.88Å; I121-Y344 HydrophobicContact CD1-CE1 3.93Å; I121-F348 HydrophobicContact CG2-CD2 4.49Å |
| 122 | N | 86.7 | Confident | 86.4 | Confident | 20 Ų | 20 | 58.4 Ų | 58.4 | 11% | 0.107 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -60.7 | -45 | 179.1 | -167.8 | 40.6 | 0 | 0 | 0 | 111.5 | A118 L119 I120 G125 H126 W168 S347 S351 | A118-N122 VanDerWaalsContact O-CB 3.29Å; A118-N122 WeakPolarHBondContact O-CB 3.29Å; A118-N122 PolarHBondContact O-N 3.37Å; L119-N122 WeakPolarHBondContact O-CB 3.42Å; L119-N122 PolarHBondContact O-N 3.38Å; I120-N122 VanDerWaalsContact C-N 3.3Å; I120-N122 PolarHBondContact O-N 3.15Å; N122-G125 PolarHBondContact O-N 3.49Å; N122-H126 PolarHBondContact O-CD2 3.29Å; N122-H126 PolarHBondContact O-N 2.95Å; N122-H126 PolarHBondContact OD1-CD2 3.47Å; N122-H126 PolarHBondContact OD1-NE2 3.02Å; N122-W168 WeakPolarHBondContact ND2-CZ2 3.42Å; N122-S347 PolarHBondContact OD1-O 3.25Å; N122-S351 WeakPolarHBondContact O-CB 3.21Å; N122-S351 WeakPolarHBondContact OD1-CB 3.44Å |
| 123 | Y | 89.3 | Confident | 87.3 | Confident | 115 Ų | 115 | 56 Ų | 56 | 45% | 0.451 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -60.4 | -51.8 | 176.8 | -176.7 | -90.6 | 0 | 0 | 0 | 112.1 | L119 I120 I121 G125 H126 C127 W168 F169 | L119-Y123 WeakPolarHBondContact O-CB 3.4Å; L119-Y123 PolarHBondContact O-N 2.89Å; I120-Y123 PolarHBondContact O-N 2.79Å; I121-Y123 PolarHBondContact O-N 2.97Å; Y123-G125 VanDerWaalsContact C-N 3.31Å; Y123-G125 PolarHBondContact O-N 3.48Å; Y123-H126 PolarHBondContact O-N 3.39Å; Y123-C127 PolarHBondContact O-N 3.11Å; Y123-C127 PolarHBondContact O-SG 3.16Å; Y123-C127 VanDerWaalsContact O-SG 3.33Å; Y123-W168 AromaticContact CD2-CH2 3.9Å; Y123-W168 HydrophobicContact CD2-CH2 3.9Å; Y123-W168 AromaticContact CD2-CZ3 3.91Å; Y123-W168 HydrophobicContact CD2-CZ3 3.91Å; Y123-W168 HydrophobicContact CG-CH2 4.41Å; Y123-F169 AromaticContact CD2-CE1 3.99Å; Y123-F169 HydrophobicContact CD2-CE1 3.99Å; Y123-F169 HydrophobicContact CE2-CD1 4.02Å; Y123-F169 AromaticContact CE2-CE1 3.59Å; Y123-F169 HydrophobicContact CE2-CE1 3.59Å |
| 124 | L | 91 | Very high | 87.9 | Confident | 96 Ų | 96 | 55.1 Ų | 55.1 | 50% | 0.503 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -59.4 | -43 | 178.2 | -69.6 | 173.5 | 0 | 0 | 0 | 111.7 | I120 I121 C127 I128 | I120-L124 HydrophobicContact CG2-CD1 4.03Å; I120-L124 HydrophobicContact CG2-CG 4.46Å; I120-L124 WeakPolarHBondContact O-CG 3.36Å; I120-L124 PolarHBondContact O-N 3.46Å; I121-L124 PolarHBondContact O-N 3.47Å; L124-C127 PolarHBondContact O-N 3.26Å; L124-I128 WeakPolarHBondContact O-CG1 3.46Å; L124-I128 PolarHBondContact O-N 2.99Å |
| 125 | G | 90.8 | Very high | 88.5 | Confident | 0 Ų | 0 | 56 Ų | 56 | 0% | 0 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -63 | -42.6 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | I121 N122 Y123 C127 I128 S129 | I121-G125 PolarHBondContact O-N 2.91Å; N122-G125 PolarHBondContact O-N 3.49Å; Y123-G125 VanDerWaalsContact C-N 3.31Å; Y123-G125 PolarHBondContact O-N 3.48Å; G125-C127 PolarHBondContact O-N 3.39Å; G125-I128 PolarHBondContact O-N 2.78Å; G125-S129 VanDerWaalsContact O-CB 3.29Å; G125-S129 WeakPolarHBondContact O-CB 3.26Å; G125-S129 PolarHBondContact O-N 3.22Å |
| 126 | H | 89.9 | Confident | 89 | Confident | 4 Ų | 4 | 49.1 Ų | 49.1 | 2% | 0.019 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -64.3 | -38.3 | 175.1 | -81.3 | -61 | 0 | 0 | 0 | 112.4 | N122 Y123 S129 V130 N165 W168 F169 | N122-H126 PolarHBondContact O-CD2 3.29Å; N122-H126 PolarHBondContact O-N 2.95Å; N122-H126 PolarHBondContact OD1-CD2 3.47Å; N122-H126 PolarHBondContact OD1-NE2 3.02Å; Y123-H126 PolarHBondContact O-N 3.39Å; H126-S129 PolarHBondContact O-N 3.38Å; H126-V130 WeakPolarHBondContact O-CG2 3.47Å; H126-V130 PolarHBondContact O-N 2.94Å; H126-N165 PolarHBondContact CE1-OD1 3.46Å; H126-N165 VanDerWaalsContact CE1-OD1 3.32Å; H126-N165 PolarHBondContact ND1-OD1 2.98Å; H126-W168 HydrophobicContact CB-CE3 3.91Å; H126-W168 HydrophobicContact CB-CZ3 3.87Å; H126-W168 AromaticContact CD2-CD2 3.54Å; H126-W168 AromaticContact CD2-CE2 3.66Å; H126-W168 AromaticContact CD2-CE3 3.59Å; H126-W168 AromaticContact CD2-CH2 3.89Å; H126-W168 AromaticContact CD2-CZ2 3.86Å; H126-W168 AromaticContact CD2-CZ3 3.75Å; H126-W168 AromaticContact CG-CE3 3.8Å; H126-W168 AromaticContact NE2-CD2 3.85Å; H126-W168 AromaticContact NE2-CE2 3.91Å; H126-F169 HydrophobicContact CB-CE2 4.07Å; H126-F169 HydrophobicContact CB-CZ 3.86Å |
| 127 | C | 92.3 | Very high | 89.2 | Confident | 51 Ų | 51 | 45 Ų | 45 | 35% | 0.345 | 24% | 0.243 | S | C | . | . | H | α-helix | trans | -60.7 | -50.4 | 174.7 | -67.5 | 0 | 0 | 0 | 0 | 111.5 | Y123 L124 G125 S129 V130 G131 F169 | Y123-C127 PolarHBondContact O-N 3.11Å; Y123-C127 PolarHBondContact O-SG 3.16Å; Y123-C127 VanDerWaalsContact O-SG 3.33Å; L124-C127 PolarHBondContact O-N 3.26Å; G125-C127 PolarHBondContact O-N 3.39Å; C127-S129 VanDerWaalsContact C-N 3.31Å; C127-S129 PolarHBondContact O-N 3.28Å; C127-V130 PolarHBondContact O-N 3.33Å; C127-G131 PolarHBondContact O-N 3.24Å; C127-G131 VanDerWaalsContact O-N 3.08Å; C127-F169 HydrophobicContact CB-CZ 4.42Å; C127-F169 VanDerWaalsContact SG-CZ 3.55Å |
| 128 | I | 92.1 | Very high | 89.2 | Confident | 82 Ų | 82 | 46.7 Ų | 46.7 | 42% | 0.421 | 25% | 0.25 | S | S | . | . | H | α-helix | trans | -60.9 | -43.6 | 178.3 | -66.4 | 166.6 | 0 | 0 | 0 | 110.2 | L124 G125 G131 A132 F352 F355 | L124-I128 WeakPolarHBondContact O-CG1 3.46Å; L124-I128 PolarHBondContact O-N 2.99Å; G125-I128 PolarHBondContact O-N 2.78Å; I128-G131 PolarHBondContact O-N 3.08Å; I128-A132 WeakPolarHBondContact O-CB 3.49Å; I128-A132 PolarHBondContact O-N 3.04Å; I128-F352 HydrophobicContact CB-CE1 4.39Å; I128-F352 HydrophobicContact CD1-CE1 3.88Å; I128-F352 HydrophobicContact CD1-CZ 4.1Å; I128-F352 HydrophobicContact CG2-CE1 4.3Å; I128-F355 HydrophobicContact CG2-CD2 3.86Å; I128-F355 HydrophobicContact CG2-CE2 4.26Å; I128-F355 HydrophobicContact CG2-CG 4.34Å |
| 129 | S | 92.4 | Very high | 89.3 | Confident | 0 Ų | 0 | 49.3 Ų | 49.3 | 0% | 0 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -61.4 | -45.5 | 178.4 | 179 | 0 | 0 | 0 | 0 | 112.4 | G125 H126 C127 A132 L133 N165 S351 G354 F355 | G125-S129 VanDerWaalsContact O-CB 3.29Å; G125-S129 WeakPolarHBondContact O-CB 3.26Å; G125-S129 PolarHBondContact O-N 3.22Å; H126-S129 PolarHBondContact O-N 3.38Å; C127-S129 VanDerWaalsContact C-N 3.31Å; C127-S129 PolarHBondContact O-N 3.28Å; S129-A132 PolarHBondContact O-N 2.8Å; S129-L133 WeakPolarHBondContact O-CB 3.28Å; S129-L133 WeakPolarHBondContact O-CD1 3.03Å; S129-L133 WeakPolarHBondContact O-CG 3.47Å; S129-L133 PolarHBondContact O-N 3.49Å; S129-N165 PolarHBondContact OG-ND2 2.94Å; S129-S351 WeakPolarHBondContact CB-O 3.34Å; S129-G354 VanDerWaalsContact OG-C 3.27Å; S129-G354 WeakPolarHBondContact OG-CA 3.08Å; S129-F355 PolarHBondContact OG-N 3.32Å; S129-F355 VanDerWaalsContact OG-N 3.1Å |
| 130 | V | 91.6 | Very high | 89 | Confident | 22 Ų | 22 | 48 Ų | 48 | 13% | 0.133 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -64.6 | -45.5 | 179.5 | 168.6 | 0 | 0 | 0 | 0 | 110.9 | H126 C127 A132 L133 I134 N165 F169 | H126-V130 WeakPolarHBondContact O-CG2 3.47Å; H126-V130 PolarHBondContact O-N 2.94Å; C127-V130 PolarHBondContact O-N 3.33Å; V130-A132 VanDerWaalsContact C-N 3.34Å; V130-A132 PolarHBondContact O-N 2.99Å; V130-L133 PolarHBondContact O-N 3.4Å; V130-I134 HydrophobicContact CG1-CD1 3.59Å; V130-I134 HydrophobicContact CG1-CG1 4.22Å; V130-I134 VanDerWaalsContact O-CG1 3.31Å; V130-I134 WeakPolarHBondContact O-CG1 3.46Å; V130-I134 PolarHBondContact O-N 3.29Å; V130-N165 HydrophobicContact CG2-CB 3.33Å; V130-F169 HydrophobicContact CG2-CE2 3.94Å |
| 131 | G | 92.8 | Very high | 88.8 | Confident | 37 Ų | 37 | 46.5 Ų | 46.5 | 38% | 0.381 | 25% | 0.249 | S | C | . | . | H | α-helix | trans | -56.3 | -48.5 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | C127 I128 L133 I134 V135 | C127-G131 PolarHBondContact O-N 3.24Å; C127-G131 VanDerWaalsContact O-N 3.08Å; I128-G131 PolarHBondContact O-N 3.08Å; G131-L133 PolarHBondContact O-N 3.13Å; G131-I134 PolarHBondContact O-N 2.68Å; G131-V135 WeakPolarHBondContact O-CG2 3.32Å; G131-V135 PolarHBondContact O-N 3.01Å; G131-V135 VanDerWaalsContact O-N 3.17Å |
| 132 | A | 91.6 | Very high | 88.4 | Confident | 13 Ų | 13 | 48.3 Ų | 48.3 | 11% | 0.107 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -64.2 | -41 | 178.3 | 0 | 0 | 0 | 0 | 0 | 112.9 | I128 S129 V130 V135 A136 F355 S358 F363 | I128-A132 WeakPolarHBondContact O-CB 3.49Å; I128-A132 PolarHBondContact O-N 3.04Å; S129-A132 PolarHBondContact O-N 2.8Å; V130-A132 VanDerWaalsContact C-N 3.34Å; V130-A132 PolarHBondContact O-N 2.99Å; A132-V135 PolarHBondContact O-N 3.11Å; A132-A136 WeakPolarHBondContact O-CB 3.26Å; A132-A136 PolarHBondContact O-N 3.18Å; A132-F355 HydrophobicContact CB-CD2 3.79Å; A132-F355 HydrophobicContact CB-CE2 4.45Å; A132-S358 WeakPolarHBondContact CB-OG 3.37Å; A132-F363 HydrophobicContact CB-CE2 4.24Å; A132-F363 WeakPolarHBondContact O-CZ 3.25Å |
| 133 | L | 91.2 | Very high | 87.8 | Confident | 0 Ų | 0 | 48.2 Ų | 48.2 | 0% | 0 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -65.8 | -39.7 | 177.6 | -74 | 164.5 | 0 | 0 | 0 | 112.6 | S129 V130 G131 A136 F137 I158 F161 I162 | S129-L133 WeakPolarHBondContact O-CB 3.28Å; S129-L133 WeakPolarHBondContact O-CD1 3.03Å; S129-L133 WeakPolarHBondContact O-CG 3.47Å; S129-L133 PolarHBondContact O-N 3.49Å; V130-L133 PolarHBondContact O-N 3.4Å; G131-L133 PolarHBondContact O-N 3.13Å; L133-A136 PolarHBondContact O-N 3.35Å; L133-F137 VanDerWaalsContact O-CB 3.28Å; L133-F137 WeakPolarHBondContact O-CB 3.43Å; L133-F137 PolarHBondContact O-N 3.06Å; L133-I158 HydrophobicContact CD2-CG2 3.98Å; L133-F161 HydrophobicContact CD1-CB 3.71Å; L133-F161 HydrophobicContact CD2-CB 4.13Å; L133-I162 HydrophobicContact CB-CD1 4.25Å; L133-I162 HydrophobicContact CB-CG1 3.74Å; L133-I162 HydrophobicContact CD1-CG1 4.26Å |
| 134 | I | 91.1 | Very high | 86.8 | Confident | 85 Ų | 85 | 51.3 Ų | 51.3 | 44% | 0.436 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -63 | -45.9 | 176.6 | -70.1 | 169.1 | 0 | 0 | 0 | 110.1 | V130 G131 A136 F137 M138 | V130-I134 HydrophobicContact CG1-CD1 3.59Å; V130-I134 HydrophobicContact CG1-CG1 4.22Å; V130-I134 VanDerWaalsContact O-CG1 3.31Å; V130-I134 WeakPolarHBondContact O-CG1 3.46Å; V130-I134 PolarHBondContact O-N 3.29Å; G131-I134 PolarHBondContact O-N 2.68Å; I134-A136 VanDerWaalsContact C-N 3.34Å; I134-A136 PolarHBondContact O-N 2.97Å; I134-F137 PolarHBondContact O-N 2.97Å; I134-M138 HydrophobicContact CG2-CG 4.44Å; I134-M138 VanDerWaalsContact O-CG 3.3Å; I134-M138 WeakPolarHBondContact O-CG 3.33Å; I134-M138 PolarHBondContact O-N 3Å |
| 135 | V | 90.6 | Very high | 85.3 | Confident | 79 Ų | 79 | 52.6 Ų | 52.6 | 48% | 0.479 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -60.6 | -45.6 | 176.5 | 175.7 | 0 | 0 | 0 | 0 | 110.6 | G131 A132 F137 M138 L139 F363 | G131-V135 WeakPolarHBondContact O-CG2 3.32Å; G131-V135 PolarHBondContact O-N 3.01Å; G131-V135 VanDerWaalsContact O-N 3.17Å; A132-V135 PolarHBondContact O-N 3.11Å; V135-F137 PolarHBondContact O-N 3.13Å; V135-M138 PolarHBondContact O-N 2.68Å; V135-L139 HydrophobicContact CG1-CD1 4.33Å; V135-L139 WeakPolarHBondContact O-CG 3.4Å; V135-L139 PolarHBondContact O-N 3.14Å; V135-F363 HydrophobicContact CB-CE1 4.47Å; V135-F363 HydrophobicContact CB-CZ 4.13Å; V135-F363 HydrophobicContact CG1-CE1 3.89Å; V135-F363 HydrophobicContact CG1-CZ 3.96Å |
| 136 | A | 87.6 | Confident | 84.2 | Confident | 0 Ų | 0 | 54.7 Ų | 54.7 | 0% | 0 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -59.7 | -45.4 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112 | A132 L133 I134 M138 L139 F140 C362 F363 | A132-A136 WeakPolarHBondContact O-CB 3.26Å; A132-A136 PolarHBondContact O-N 3.18Å; L133-A136 PolarHBondContact O-N 3.35Å; I134-A136 VanDerWaalsContact C-N 3.34Å; I134-A136 PolarHBondContact O-N 2.97Å; A136-M138 PolarHBondContact O-N 3.23Å; A136-L139 PolarHBondContact O-N 3.48Å; A136-F140 WeakPolarHBondContact O-CD2 3.16Å; A136-F140 PolarHBondContact O-N 2.98Å; A136-C362 HydrophobicContact CB-CB 3.73Å; A136-F363 HydrophobicContact CB-CE1 4.29Å; A136-F363 HydrophobicContact CB-CZ 4.3Å |
| 137 | F | 86.8 | Confident | 83.2 | Confident | 52 Ų | 52 | 61.9 Ų | 61.9 | 23% | 0.228 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -59.4 | -45.8 | 177.4 | -172.8 | -91.1 | 0 | 0 | 0 | 111.7 | L133 I134 V135 L139 F140 L141 W155 I158 I162 | L133-F137 VanDerWaalsContact O-CB 3.28Å; L133-F137 WeakPolarHBondContact O-CB 3.43Å; L133-F137 PolarHBondContact O-N 3.06Å; I134-F137 PolarHBondContact O-N 2.97Å; V135-F137 PolarHBondContact O-N 3.13Å; F137-L139 PolarHBondContact O-N 2.88Å; F137-F140 PolarHBondContact O-N 3.37Å; F137-L141 HydrophobicContact CD1-CD1 3.75Å; F137-L141 HydrophobicContact CD1-CG 4.12Å; F137-L141 HydrophobicContact CE1-CD1 3.48Å; F137-L141 VanDerWaalsContact CE1-CD1 3.48Å; F137-L141 HydrophobicContact CE1-CD2 4.41Å; F137-L141 HydrophobicContact CE1-CG 4Å; F137-L141 HydrophobicContact CZ-CD1 4.45Å; F137-L141 WeakPolarHBondContact O-CG 3.46Å; F137-L141 PolarHBondContact O-N 3.41Å; F137-W155 AromaticContact CD2-CD1 3.87Å; F137-W155 AromaticContact CD2-NE1 3.53Å; F137-W155 AromaticContact CE2-CD1 3.68Å; F137-W155 AromaticContact CE2-NE1 2.94Å; F137-W155 HydrophobicContact CZ-CZ2 4.39Å; F137-W155 AromaticContact CZ-NE1 3.56Å; F137-I158 HydrophobicContact CB-CG2 4.5Å; F137-I158 HydrophobicContact CD2-CG2 4.4Å; F137-I162 HydrophobicContact CB-CD1 4.04Å; F137-I162 HydrophobicContact CD2-CD1 3.89Å; F137-I162 HydrophobicContact CG-CD1 4.15Å |
| 138 | M | 86.1 | Confident | 82.5 | Confident | 103 Ų | 103 | 61.9 Ų | 61.9 | 51% | 0.507 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -63.4 | -41.3 | 177.2 | -68.6 | -61 | -79.2 | 0 | 0 | 112.3 | I134 V135 A136 F140 L141 C142 | I134-M138 HydrophobicContact CG2-CG 4.44Å; I134-M138 VanDerWaalsContact O-CG 3.3Å; I134-M138 WeakPolarHBondContact O-CG 3.33Å; I134-M138 PolarHBondContact O-N 3Å; V135-M138 PolarHBondContact O-N 2.68Å; A136-M138 PolarHBondContact O-N 3.23Å; M138-F140 VanDerWaalsContact C-N 3.34Å; M138-F140 PolarHBondContact O-N 3.25Å; M138-L141 PolarHBondContact O-N 3.32Å; M138-L141 HydrophobicContact SD-CD1 4.14Å; M138-C142 PolarHBondContact O-N 3.43Å; M138-C142 PolarHBondContact O-SG 2.74Å; M138-C142 VanDerWaalsContact O-SG 3.32Å |
| 139 | L | 84 | Confident | 82 | Confident | 57 Ų | 57 | 59.8 Ų | 59.8 | 30% | 0.298 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -59.2 | -44.9 | 174.9 | -72.9 | 173.4 | 0 | 0 | 0 | 111.6 | V135 A136 F137 C142 L143 F363 | V135-L139 HydrophobicContact CG1-CD1 4.33Å; V135-L139 WeakPolarHBondContact O-CG 3.4Å; V135-L139 PolarHBondContact O-N 3.14Å; A136-L139 PolarHBondContact O-N 3.48Å; F137-L139 PolarHBondContact O-N 2.88Å; L139-C142 PolarHBondContact O-N 3.09Å; L139-L143 WeakPolarHBondContact O-CB 3.44Å; L139-L143 WeakPolarHBondContact O-CG 3.37Å; L139-L143 PolarHBondContact O-N 3.5Å; L139-L143 VanDerWaalsContact O-N 3.09Å; L139-F363 HydrophobicContact CD1-CD1 4.06Å; L139-F363 HydrophobicContact CD1-CE1 3.79Å |
| 140 | F | 78.3 | Confident | 81.5 | Confident | 34 Ų | 34 | 63.9 Ų | 63.9 | 15% | 0.149 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -65.7 | -37 | 177.1 | -76.7 | -65.5 | 0 | 0 | 0 | 113 | A136 F137 M138 L143 I158 C362 V368 | A136-F140 WeakPolarHBondContact O-CD2 3.16Å; A136-F140 PolarHBondContact O-N 2.98Å; F137-F140 PolarHBondContact O-N 3.37Å; M138-F140 VanDerWaalsContact C-N 3.34Å; M138-F140 PolarHBondContact O-N 3.25Å; F140-L143 PolarHBondContact O-N 3.42Å; F140-I158 HydrophobicContact CD2-CD1 4.02Å; F140-I158 HydrophobicContact CE2-CD1 3.61Å; F140-C362 HydrophobicContact CE2-CB 3.62Å; F140-C362 WeakPolarHBondContact CE2-SG 3.34Å; F140-C362 HydrophobicContact CZ-CB 4Å; F140-V368 HydrophobicContact CE1-CG2 3.82Å; F140-V368 HydrophobicContact CZ-CG2 4.08Å |
| 141 | L | 80.8 | Confident | 81.1 | Confident | 72 Ų | 72 | 63.6 Ų | 63.6 | 38% | 0.377 | 33% | 0.333 | S | S | . | . | H | α-helix | trans | -63.5 | -44.3 | 174.8 | -72.7 | -178 | 0 | 0 | 0 | 112.3 | F137 M138 L143 W155 | F137-L141 HydrophobicContact CD1-CD1 3.75Å; F137-L141 HydrophobicContact CD1-CG 4.12Å; F137-L141 HydrophobicContact CE1-CD1 3.48Å; F137-L141 VanDerWaalsContact CE1-CD1 3.48Å; F137-L141 HydrophobicContact CE1-CD2 4.41Å; F137-L141 HydrophobicContact CE1-CG 4Å; F137-L141 HydrophobicContact CZ-CD1 4.45Å; F137-L141 WeakPolarHBondContact O-CG 3.46Å; F137-L141 PolarHBondContact O-N 3.41Å; M138-L141 PolarHBondContact O-N 3.32Å; M138-L141 HydrophobicContact SD-CD1 4.14Å; L141-L143 VanDerWaalsContact C-N 3.28Å; L141-L143 PolarHBondContact O-N 3.25Å; L141-W155 HydrophobicContact CD2-CZ2 3.99Å |
| 142 | C | 79.6 | Confident | 80.7 | Confident | 92 Ų | 92 | 64.1 Ų | 64.1 | 62% | 0.622 | 33% | 0.326 | S | S | * | . | H | α-helix | trans | -67.5 | -29.2 | 178.9 | -67.1 | 0 | 0 | 0 | 0 | 112.7 | M138 L139 R144 | M138-C142 PolarHBondContact O-N 3.43Å; M138-C142 PolarHBondContact O-SG 2.74Å; M138-C142 VanDerWaalsContact O-SG 3.32Å; L139-C142 PolarHBondContact O-N 3.09Å; C142-R144 VanDerWaalsContact C-N 3.34Å; C142-R144 PolarHBondContact O-N 3.29Å |
| 143 | L | 73.8 | Confident | 80.6 | Confident | 19 Ų | 19 | 63.6 Ų | 63.6 | 10% | 0.099 | 32% | 0.321 | C | S | . | . | trans | -94.2 | 53.2 | -177.6 | -62.1 | 174.4 | 0 | 0 | 0 | 112.2 | L139 F140 L141 S145 I146 V368 A371 R375 | L139-L143 WeakPolarHBondContact O-CB 3.44Å; L139-L143 WeakPolarHBondContact O-CG 3.37Å; L139-L143 PolarHBondContact O-N 3.5Å; L139-L143 VanDerWaalsContact O-N 3.09Å; F140-L143 PolarHBondContact O-N 3.42Å; L141-L143 VanDerWaalsContact C-N 3.28Å; L141-L143 PolarHBondContact O-N 3.25Å; L143-S145 PolarHBondContact O-N 3.05Å; L143-I146 HydrophobicContact CB-CD1 4.33Å; L143-I146 PolarHBondContact O-N 2.97Å; L143-V368 HydrophobicContact CD1-CG1 4.08Å; L143-A371 HydrophobicContact CD1-CB 4.1Å; L143-A371 HydrophobicContact CD2-CB 3.99Å; L143-R375 HydrophobicContact CD2-CB 4.5Å | ||
| 144 | R | 67.9 | Low | 80.3 | Confident | 180 Ų | 180 | 64.5 Ų | 64.5 | 68% | 0.679 | 33% | 0.326 | S | S | * | . | G | 310 helix | trans | -50.4 | -22.6 | 179 | -175.4 | 171.3 | 179.4 | 163.5 | -0.6 | 114.7 | C142 I146 | C142-R144 VanDerWaalsContact C-N 3.34Å; C142-R144 PolarHBondContact O-N 3.29Å; R144-I146 VanDerWaalsContact C-N 3.25Å; R144-I146 PolarHBondContact O-N 2.98Å |
| 145 | S | 60.1 | Low | 80.1 | Confident | 123 Ų | 123 | 65 Ų | 65 | 86% | 0.86 | 32% | 0.322 | S | S | * | . | G | 310 helix | trans | -69.8 | -7.6 | -176.4 | -168.8 | 0 | 0 | 0 | 0 | 115.5 | L143 | L143-S145 PolarHBondContact O-N 3.05Š|
| 146 | I | 66.7 | Low | 80.1 | Confident | 44 Ų | 44 | 62.4 Ų | 62.4 | 23% | 0.226 | 31% | 0.306 | C | S | . | . | G | 310 helix | trans | -118 | 26.8 | -171.7 | -32.9 | 176.9 | 0 | 0 | 0 | 112.3 | L143 R144 C148 N151 A371 | L143-I146 HydrophobicContact CB-CD1 4.33Å; L143-I146 PolarHBondContact O-N 2.97Å; R144-I146 VanDerWaalsContact C-N 3.25Å; R144-I146 PolarHBondContact O-N 2.98Å; I146-C148 PolarHBondContact O-N 2.69Å; I146-N151 WeakPolarHBondContact CG2-ND2 3.38Å; I146-N151 PolarHBondContact O-ND2 3.28Å; I146-A371 HydrophobicContact CD1-CB 3.64Å |
| 147 | R | 70.3 | Confident | 80.2 | Confident | 155 Ų | 155 | 62.5 Ų | 62.5 | 59% | 0.585 | 31% | 0.306 | S | S | * | . | trans | -75.2 | 81.9 | -178.2 | -69.8 | -177.5 | -178.8 | 173.9 | 0.1 | 112 | ||||
| 148 | C | 77 | Confident | 80.3 | Confident | 50 Ų | 50 | 60.1 Ų | 60.1 | 34% | 0.338 | 30% | 0.296 | S | S | . | . | trans | -102.5 | 171 | 168.3 | 74.8 | 0 | 0 | 0 | 0 | 111.6 | I146 R150 N151 I152 | I146-C148 PolarHBondContact O-N 2.69Å; C148-R150 PolarHBondContact O-N 3.39Å; C148-N151 PolarHBondContact O-N 3.09Å; C148-N151 VanDerWaalsContact O-N 3.13Å; C148-N151 PolarHBondContact SG-N 3.49Å; C148-N151 VanDerWaalsContact SG-N 3.43Å; C148-I152 WeakPolarHBondContact O-CG1 3.3Å; C148-I152 PolarHBondContact O-N 3.42Å | ||
| 149 | L | 81.4 | Confident | 80.5 | Confident | 39 Ų | 39 | 56.8 Ų | 56.8 | 20% | 0.204 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -55.6 | -46.2 | 178.3 | 178.2 | 61.5 | 0 | 0 | 0 | 112.5 | N151 I152 I153 Y210 K226 F229 | L149-N151 VanDerWaalsContact C-N 3.29Å; L149-N151 PolarHBondContact O-N 3.46Å; L149-I152 WeakPolarHBondContact O-CB 3.48Å; L149-I152 PolarHBondContact O-N 3.28Å; L149-I152 VanDerWaalsContact O-N 3.13Å; L149-I153 HydrophobicContact CD1-CD1 4.47Å; L149-I153 HydrophobicContact CG-CD1 4.36Å; L149-I153 PolarHBondContact O-N 3.06Å; L149-Y210 HydrophobicContact CD2-CD2 4.38Å; L149-Y210 HydrophobicContact CD2-CE2 3.76Å; L149-Y210 HydrophobicContact CG-CE2 4.05Å; L149-K226 HydrophobicContact CD1-CB 3.71Å; L149-F229 HydrophobicContact CD1-CD2 4.49Å; L149-F229 HydrophobicContact CD2-CE2 4.46Å |
| 150 | R | 82.1 | Confident | 81 | Confident | 86 Ų | 86 | 54.1 Ų | 54.1 | 33% | 0.325 | 27% | 0.267 | S | S | . | . | H | α-helix | trans | -53.9 | -45.9 | 174.8 | 177.7 | 178.7 | 67.1 | -163.4 | 1.5 | 111.8 | C148 I152 I153 H154 Y210 E367 | C148-R150 PolarHBondContact O-N 3.39Å; R150-I152 VanDerWaalsContact C-N 3.35Å; R150-I152 PolarHBondContact O-N 3.44Å; R150-I153 PolarHBondContact O-N 3.28Å; R150-H154 WeakPolarHBondContact CG-NE2 3.38Å; R150-H154 PolarHBondContact O-CD2 3.25Å; R150-H154 PolarHBondContact O-N 3.33Å; R150-Y210 HydrophobicContact CB-CE1 3.73Å; R150-Y210 HydrophobicContact CG-CE1 3.98Å; R150-E367 IonicContact CZ-OE1 2.69Å; R150-E367 IonicContact CZ-OE2 3.74Å; R150-E367 IonicContact NH1-OE1 3.92Å; R150-E367 IonicContact NH2-OE1 2.66Å; R150-E367 PolarHBondContact NH2-OE1 3.21Å; R150-E367 IonicContact NH2-OE2 2.75Å; R150-E367 PolarHBondContact NH2-OE2 3.4Å |
| 151 | N | 82.8 | Confident | 81.6 | Confident | 16 Ų | 16 | 52.5 Ų | 52.5 | 9% | 0.086 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -72.5 | -27.9 | -178.9 | -71.7 | 10 | 0 | 0 | 0 | 112.6 | I146 C148 L149 W155 | I146-N151 WeakPolarHBondContact CG2-ND2 3.38Å; I146-N151 PolarHBondContact O-ND2 3.28Å; C148-N151 PolarHBondContact O-N 3.09Å; C148-N151 VanDerWaalsContact O-N 3.13Å; C148-N151 PolarHBondContact SG-N 3.49Å; C148-N151 VanDerWaalsContact SG-N 3.43Å; L149-N151 VanDerWaalsContact C-N 3.29Å; L149-N151 PolarHBondContact O-N 3.46Å; N151-W155 VanDerWaalsContact O-CB 3.26Å; N151-W155 WeakPolarHBondContact O-CB 3.12Å; N151-W155 PolarHBondContact O-N 2.88Å |
| 152 | I | 85.9 | Confident | 82.1 | Confident | 47 Ų | 47 | 50.4 Ų | 50.4 | 24% | 0.241 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -64.3 | -45 | 169.8 | -68 | 168.5 | 0 | 0 | 0 | 110.1 | C148 L149 R150 W155 N156 L230 | C148-I152 WeakPolarHBondContact O-CG1 3.3Å; C148-I152 PolarHBondContact O-N 3.42Å; L149-I152 WeakPolarHBondContact O-CB 3.48Å; L149-I152 PolarHBondContact O-N 3.28Å; L149-I152 VanDerWaalsContact O-N 3.13Å; R150-I152 VanDerWaalsContact C-N 3.35Å; R150-I152 PolarHBondContact O-N 3.44Å; I152-W155 PolarHBondContact O-N 3.03Å; I152-N156 PolarHBondContact O-N 3.44Å; I152-N156 PolarHBondContact O-ND2 2.98Å; I152-L230 HydrophobicContact CG2-CD1 4.26Å |
| 153 | I | 88.1 | Confident | 82.8 | Confident | 2 Ų | 2 | 48.5 Ų | 48.5 | 1% | 0.01 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -63.2 | -49.7 | 179 | -66 | 169.6 | 0 | 0 | 0 | 110.5 | L149 R150 W155 N156 L157 W203 V206 E207 Y210 F229 | L149-I153 HydrophobicContact CD1-CD1 4.47Å; L149-I153 HydrophobicContact CG-CD1 4.36Å; L149-I153 PolarHBondContact O-N 3.06Å; R150-I153 PolarHBondContact O-N 3.28Å; I153-W155 VanDerWaalsContact C-N 3.29Å; I153-W155 PolarHBondContact O-N 3.5Å; I153-N156 PolarHBondContact O-N 3.22Å; I153-L157 PolarHBondContact O-N 3.08Å; I153-W203 HydrophobicContact CG2-CE3 4.46Å; I153-W203 HydrophobicContact CG2-CZ3 4.28Å; I153-V206 HydrophobicContact CG1-CG1 4.48Å; I153-V206 HydrophobicContact CG2-CG1 4.16Å; I153-E207 HydrophobicContact CG2-CB 4.03Å; I153-E207 HydrophobicContact CG2-CG 4.44Å; I153-Y210 HydrophobicContact CD1-CD1 3.91Å; I153-Y210 HydrophobicContact CD1-CD2 3.63Å; I153-Y210 HydrophobicContact CD1-CE1 4.48Å; I153-Y210 HydrophobicContact CD1-CE2 4.25Å; I153-Y210 HydrophobicContact CD1-CG 3.45Å; I153-Y210 VanDerWaalsContact CD1-CG 3.45Å; I153-F229 HydrophobicContact CD1-CD2 4.49Å |
| 154 | H | 85.6 | Confident | 83.6 | Confident | 19 Ų | 19 | 48 Ų | 48 | 9% | 0.088 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -59.2 | -39 | 176.7 | -65.2 | -43.7 | 0 | 0 | 0 | 112.5 | R150 L157 I158 E207 Y361 | R150-H154 WeakPolarHBondContact CG-NE2 3.38Å; R150-H154 PolarHBondContact O-CD2 3.25Å; R150-H154 PolarHBondContact O-N 3.33Å; H154-L157 PolarHBondContact O-N 3.3Å; H154-I158 WeakPolarHBondContact O-CB 3.39Å; H154-I158 VanDerWaalsContact O-CG1 3.29Å; H154-I158 WeakPolarHBondContact O-CG1 3.49Å; H154-I158 PolarHBondContact O-N 2.85Å; H154-E207 IonicContact CE1-OE1 3.6Å; H154-E207 PolarHBondContact CE1-OE1 2.9Å; H154-E207 IonicContact CG-OE1 3.37Å; H154-E207 IonicContact ND1-OE1 3.86Å; H154-E207 PolarHBondContact ND1-OE1 3.08Å; H154-Y361 AromaticContact CE1-CD1 3.54Å; H154-Y361 AromaticContact CE1-CE1 3.4Å; H154-Y361 WeakPolarHBondContact CE1-CE1 3.06Å; H154-Y361 AromaticContact ND1-CD1 3.83Å; H154-Y361 AromaticContact ND1-CE1 3.88Å |
| 155 | W | 86.3 | Confident | 84.7 | Confident | 97 Ų | 97 | 39.4 Ų | 39.4 | 37% | 0.367 | 20% | 0.197 | S | C | . | . | H | α-helix | trans | -65.5 | -43.6 | 178.3 | -177.2 | 22.1 | 0 | 0 | 0 | 112.2 | F137 L141 N151 I152 I153 L157 I158 T159 | F137-W155 AromaticContact CD2-CD1 3.87Å; F137-W155 AromaticContact CD2-NE1 3.53Å; F137-W155 AromaticContact CE2-CD1 3.68Å; F137-W155 AromaticContact CE2-NE1 2.94Å; F137-W155 HydrophobicContact CZ-CZ2 4.39Å; F137-W155 AromaticContact CZ-NE1 3.56Å; L141-W155 HydrophobicContact CD2-CZ2 3.99Å; N151-W155 VanDerWaalsContact O-CB 3.26Å; N151-W155 WeakPolarHBondContact O-CB 3.12Å; N151-W155 PolarHBondContact O-N 2.88Å; I152-W155 PolarHBondContact O-N 3.03Å; I153-W155 VanDerWaalsContact C-N 3.29Å; I153-W155 PolarHBondContact O-N 3.5Å; W155-L157 VanDerWaalsContact C-N 3.34Å; W155-I158 PolarHBondContact O-N 3.38Å; W155-T159 WeakPolarHBondContact O-CB 3.44Å; W155-T159 PolarHBondContact O-N 3.46Å; W155-T159 PolarHBondContact O-OG1 3.31Å |
| 156 | N | 90.7 | Very high | 86.2 | Confident | 24 Ų | 24 | 36.4 Ų | 36.4 | 13% | 0.128 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -63 | -43.5 | 174.7 | -78.3 | -84.2 | 0 | 0 | 0 | 110.8 | I152 I153 T159 T160 W203 W234 | I152-N156 PolarHBondContact O-N 3.44Å; I152-N156 PolarHBondContact O-ND2 2.98Å; I153-N156 PolarHBondContact O-N 3.22Å; N156-T159 WeakPolarHBondContact O-CB 3.1Å; N156-T159 PolarHBondContact O-N 2.93Å; N156-T159 VanDerWaalsContact O-N 3.15Å; N156-T160 WeakPolarHBondContact O-CG2 3.34Å; N156-T160 PolarHBondContact O-N 3.12Å; N156-W203 HydrophobicContact CB-CD2 3.74Å; N156-W203 HydrophobicContact CB-CE3 3.61Å; N156-W203 HydrophobicContact CB-CH2 3.31Å; N156-W203 HydrophobicContact CB-CZ2 3.44Å; N156-W203 VanDerWaalsContact CB-CZ2 3.44Å; N156-W203 HydrophobicContact CB-CZ3 3.4Å; N156-W203 VanDerWaalsContact CG-CH2 3.43Å; N156-W234 PolarHBondContact OD1-NE1 2.98Å |
| 157 | L | 89.5 | Confident | 87.3 | Confident | 2 Ų | 2 | 35.9 Ų | 35.9 | 1% | 0.01 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -59.1 | -50.5 | 176.7 | -179.1 | 66.4 | 0 | 0 | 0 | 112.2 | I153 H154 W155 T159 T160 F161 W203 M204 E207 | I153-L157 PolarHBondContact O-N 3.08Å; H154-L157 PolarHBondContact O-N 3.3Å; W155-L157 VanDerWaalsContact C-N 3.34Å; L157-T159 VanDerWaalsContact C-N 3.25Å; L157-T159 PolarHBondContact O-N 2.88Å; L157-T160 PolarHBondContact O-N 3.16Å; L157-T160 VanDerWaalsContact O-N 3.13Å; L157-T160 PolarHBondContact O-OG1 2.92Å; L157-F161 HydrophobicContact CD1-CD2 4.18Å; L157-F161 HydrophobicContact CD1-CE2 3.63Å; L157-F161 HydrophobicContact CD1-CZ 4.44Å; L157-F161 HydrophobicContact CD2-CE2 4.27Å; L157-F161 HydrophobicContact CG-CD2 4.05Å; L157-F161 HydrophobicContact CG-CE2 3.72Å; L157-F161 VanDerWaalsContact O-CD2 3.28Å; L157-F161 WeakPolarHBondContact O-CD2 3.21Å; L157-F161 PolarHBondContact O-N 3.35Å; L157-F161 VanDerWaalsContact O-N 3.1Å; L157-W203 HydrophobicContact CD1-CB 3.81Å; L157-M204 HydrophobicContact CD1-CG 3.73Å; L157-E207 HydrophobicContact CD2-CB 4.49Å; L157-E207 WeakPolarHBondContact CD2-OE1 3.35Å; L157-E207 WeakPolarHBondContact CD2-OE2 3.16Å |
| 158 | I | 89.5 | Confident | 88.2 | Confident | 2 Ų | 2 | 29.1 Ų | 29.1 | 1% | 0.01 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -56.8 | -41.9 | 175.1 | -70.8 | 167.5 | 0 | 0 | 0 | 110.7 | L133 F137 F140 H154 W155 T160 F161 I162 V357 | L133-I158 HydrophobicContact CD2-CG2 3.98Å; F137-I158 HydrophobicContact CB-CG2 4.5Å; F137-I158 HydrophobicContact CD2-CG2 4.4Å; F140-I158 HydrophobicContact CD2-CD1 4.02Å; F140-I158 HydrophobicContact CE2-CD1 3.61Å; H154-I158 WeakPolarHBondContact O-CB 3.39Å; H154-I158 VanDerWaalsContact O-CG1 3.29Å; H154-I158 WeakPolarHBondContact O-CG1 3.49Å; H154-I158 PolarHBondContact O-N 2.85Å; W155-I158 PolarHBondContact O-N 3.38Å; I158-T160 PolarHBondContact O-N 3.26Å; I158-F161 PolarHBondContact O-N 2.97Å; I158-I162 HydrophobicContact CG2-CD1 4.02Å; I158-I162 WeakPolarHBondContact O-CG1 3.47Å; I158-I162 PolarHBondContact O-N 3.49Å; I158-V357 HydrophobicContact CG1-CG1 4.49Å |
| 159 | T | 90.9 | Very high | 88.7 | Confident | 33 Ų | 33 | 28.9 Ų | 28.9 | 20% | 0.202 | 14% | 0.138 | C | C | . | . | H | α-helix | trans | -61.4 | -43.4 | 177.3 | -57.4 | 0 | 0 | 0 | 0 | 111.5 | W155 N156 L157 F161 I162 L163 | W155-T159 WeakPolarHBondContact O-CB 3.44Å; W155-T159 PolarHBondContact O-N 3.46Å; W155-T159 PolarHBondContact O-OG1 3.31Å; N156-T159 WeakPolarHBondContact O-CB 3.1Å; N156-T159 PolarHBondContact O-N 2.93Å; N156-T159 VanDerWaalsContact O-N 3.15Å; L157-T159 VanDerWaalsContact C-N 3.25Å; L157-T159 PolarHBondContact O-N 2.88Å; T159-F161 VanDerWaalsContact C-N 3.31Å; T159-F161 PolarHBondContact O-N 3.03Å; T159-I162 PolarHBondContact O-N 3.33Å; T159-L163 HydrophobicContact CG2-CD1 3.91Å; T159-L163 HydrophobicContact CG2-CG 4.37Å; T159-L163 WeakPolarHBondContact O-CG 3.37Å; T159-L163 PolarHBondContact O-N 3.21Å |
| 160 | T | 93.1 | Very high | 89 | Confident | 0 Ų | 0 | 30.5 Ų | 30.5 | 0% | 0 | 15% | 0.146 | C | C | . | . | H | α-helix | trans | -63 | -36.3 | 175.8 | 65.5 | 0 | 0 | 0 | 0 | 112.9 | N156 L157 I158 L163 R164 T199 N200 W203 W234 | N156-T160 WeakPolarHBondContact O-CG2 3.34Å; N156-T160 PolarHBondContact O-N 3.12Å; L157-T160 PolarHBondContact O-N 3.16Å; L157-T160 VanDerWaalsContact O-N 3.13Å; L157-T160 PolarHBondContact O-OG1 2.92Å; I158-T160 PolarHBondContact O-N 3.26Å; T160-L163 PolarHBondContact O-N 3.28Å; T160-R164 WeakPolarHBondContact O-CB 3.15Å; T160-R164 PolarHBondContact O-N 3.31Å; T160-T199 HydrophobicContact CG2-CG2 3.8Å; T160-N200 PolarHBondContact OG1-ND2 3.22Å; T160-W203 HydrophobicContact CG2-CB 4.22Å; T160-W203 HydrophobicContact CG2-CG 3.82Å; T160-W234 HydrophobicContact CG2-CH2 3.88Å; T160-W234 HydrophobicContact CG2-CZ2 4.14Å; T160-W234 HydrophobicContact CG2-CZ3 4.43Å |
| 161 | F | 91.4 | Very high | 89 | Confident | 0 Ų | 0 | 26.7 Ų | 26.7 | 0% | 0 | 13% | 0.132 | C | C | . | . | H | α-helix | trans | -65.5 | -41.4 | 174.8 | -81.1 | -65.2 | 0 | 0 | 0 | 112.4 | L133 L157 I158 T159 N165 N200 M204 L321 Q353 V357 | L133-F161 HydrophobicContact CD1-CB 3.71Å; L133-F161 HydrophobicContact CD2-CB 4.13Å; L157-F161 HydrophobicContact CD1-CD2 4.18Å; L157-F161 HydrophobicContact CD1-CE2 3.63Å; L157-F161 HydrophobicContact CD1-CZ 4.44Å; L157-F161 HydrophobicContact CD2-CE2 4.27Å; L157-F161 HydrophobicContact CG-CD2 4.05Å; L157-F161 HydrophobicContact CG-CE2 3.72Å; L157-F161 VanDerWaalsContact O-CD2 3.28Å; L157-F161 WeakPolarHBondContact O-CD2 3.21Å; L157-F161 PolarHBondContact O-N 3.35Å; L157-F161 VanDerWaalsContact O-N 3.1Å; I158-F161 PolarHBondContact O-N 2.97Å; T159-F161 VanDerWaalsContact C-N 3.31Å; T159-F161 PolarHBondContact O-N 3.03Å; F161-N165 WeakPolarHBondContact O-CB 3.29Å; F161-N165 VanDerWaalsContact O-CG 3.25Å; F161-N165 PolarHBondContact O-N 2.88Å; F161-N165 PolarHBondContact O-ND2 3.26Å; F161-N200 WeakPolarHBondContact CD1-ND2 3.2Å; F161-N200 WeakPolarHBondContact CE1-ND2 3.45Å; F161-N200 WeakPolarHBondContact CE1-OD1 3.31Å; F161-N200 WeakPolarHBondContact CE2-ND2 3.21Å; F161-N200 VanDerWaalsContact CZ-ND2 3.29Å; F161-N200 WeakPolarHBondContact CZ-ND2 3.42Å; F161-M204 HydrophobicContact CZ-CG 4.35Å; F161-M204 HydrophobicContact CZ-SD 3.97Å; F161-L321 HydrophobicContact CZ-CD1 4.47Å; F161-Q353 HydrophobicContact CD1-CG 4.29Å; F161-Q353 HydrophobicContact CE1-CG 3.39Å; F161-Q353 HydrophobicContact CZ-CG 3.82Å; F161-V357 HydrophobicContact CD2-CG1 4.2Å; F161-V357 HydrophobicContact CD2-CG2 4.43Å; F161-V357 HydrophobicContact CE2-CB 4.37Å; F161-V357 HydrophobicContact CE2-CG1 4.09Å; F161-V357 HydrophobicContact CE2-CG2 3.76Å; F161-V357 HydrophobicContact CZ-CG2 4.03Å |
| 162 | I | 91.9 | Very high | 89 | Confident | 29 Ų | 29 | 29.1 Ų | 29.1 | 15% | 0.149 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -61.2 | -51.5 | 175.1 | -66.6 | 167.5 | 0 | 0 | 0 | 109.8 | L133 F137 I158 T159 R164 N165 V166 | L133-I162 HydrophobicContact CB-CD1 4.25Å; L133-I162 HydrophobicContact CB-CG1 3.74Å; L133-I162 HydrophobicContact CD1-CG1 4.26Å; F137-I162 HydrophobicContact CB-CD1 4.04Å; F137-I162 HydrophobicContact CD2-CD1 3.89Å; F137-I162 HydrophobicContact CG-CD1 4.15Å; I158-I162 HydrophobicContact CG2-CD1 4.02Å; I158-I162 WeakPolarHBondContact O-CG1 3.47Å; I158-I162 PolarHBondContact O-N 3.49Å; T159-I162 PolarHBondContact O-N 3.33Å; I162-R164 PolarHBondContact O-N 3.27Å; I162-N165 PolarHBondContact O-N 3.31Å; I162-V166 HydrophobicContact CG2-CG2 4.22Å; I162-V166 WeakPolarHBondContact O-CB 3.08Å; I162-V166 VanDerWaalsContact O-CG2 3.28Å; I162-V166 WeakPolarHBondContact O-CG2 3.47Å; I162-V166 PolarHBondContact O-N 3.25Å |
| 163 | L | 93 | Very high | 88.6 | Confident | 52 Ų | 52 | 34 Ų | 34 | 27% | 0.272 | 17% | 0.167 | S | C | . | . | H | α-helix | trans | -61.6 | -43.2 | -179 | -66.9 | 170.1 | 0 | 0 | 0 | 111.9 | T159 T160 N165 V166 M167 F196 W234 | T159-L163 HydrophobicContact CG2-CD1 3.91Å; T159-L163 HydrophobicContact CG2-CG 4.37Å; T159-L163 WeakPolarHBondContact O-CG 3.37Å; T159-L163 PolarHBondContact O-N 3.21Å; T160-L163 PolarHBondContact O-N 3.28Å; L163-N165 PolarHBondContact O-N 3.43Å; L163-V166 PolarHBondContact O-N 3.22Å; L163-M167 WeakPolarHBondContact O-CB 3.42Å; L163-M167 WeakPolarHBondContact O-CG 3.35Å; L163-M167 PolarHBondContact O-N 2.93Å; L163-F196 HydrophobicContact CB-CD1 3.68Å; L163-F196 HydrophobicContact CB-CD2 4.4Å; L163-F196 HydrophobicContact CB-CE1 3.84Å; L163-F196 HydrophobicContact CB-CE2 4.46Å; L163-F196 HydrophobicContact CB-CG 3.99Å; L163-F196 HydrophobicContact CB-CZ 4.2Å; L163-F196 HydrophobicContact CD1-CD1 4Å; L163-F196 HydrophobicContact CD1-CE1 3.52Å; L163-F196 HydrophobicContact CD1-CZ 4.14Å; L163-F196 HydrophobicContact CD2-CZ 4.4Å; L163-F196 HydrophobicContact CG-CD1 4.44Å; L163-F196 HydrophobicContact CG-CE1 4.15Å; L163-F196 HydrophobicContact CG-CZ 4.48Å; L163-W234 HydrophobicContact CD1-CH2 3.98Å; L163-W234 HydrophobicContact CD1-CZ3 4.49Å |
| 164 | R | 91.7 | Very high | 88 | Confident | 7 Ų | 7 | 35.4 Ų | 35.4 | 3% | 0.026 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -58.8 | -47.2 | 175.1 | -174.2 | -174.9 | 79.2 | 165.9 | 15.5 | 112 | T160 I162 W168 F196 V197 N200 Q350 | T160-R164 WeakPolarHBondContact O-CB 3.15Å; T160-R164 PolarHBondContact O-N 3.31Å; I162-R164 PolarHBondContact O-N 3.27Å; R164-W168 WeakPolarHBondContact O-CB 3.34Å; R164-W168 PolarHBondContact O-N 2.96Å; R164-F196 HydrophobicContact CB-CB 4.41Å; R164-V197 HydrophobicContact CG-CG2 4.03Å; R164-N200 PolarHBondContact NH1-OD1 3.46Å; R164-Q350 PolarHBondContact NH2-O 2.63Å |
| 165 | N | 90.9 | Very high | 86.7 | Confident | 0 Ų | 0 | 38.4 Ų | 38.4 | 0% | 0 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -70.1 | -40.5 | -179.4 | -72.2 | -18.8 | 0 | 0 | 0 | 112.1 | H126 S129 V130 F161 I162 L163 M167 W168 F169 | H126-N165 PolarHBondContact CE1-OD1 3.46Å; H126-N165 VanDerWaalsContact CE1-OD1 3.32Å; H126-N165 PolarHBondContact ND1-OD1 2.98Å; S129-N165 PolarHBondContact OG-ND2 2.94Å; V130-N165 HydrophobicContact CG2-CB 3.33Å; F161-N165 WeakPolarHBondContact O-CB 3.29Å; F161-N165 VanDerWaalsContact O-CG 3.25Å; F161-N165 PolarHBondContact O-N 2.88Å; F161-N165 PolarHBondContact O-ND2 3.26Å; I162-N165 PolarHBondContact O-N 3.31Å; L163-N165 PolarHBondContact O-N 3.43Å; N165-M167 VanDerWaalsContact C-N 3.32Å; N165-M167 PolarHBondContact O-N 3.43Å; N165-W168 WeakPolarHBondContact O-CB 3.39Å; N165-W168 PolarHBondContact O-N 3.26Å; N165-F169 WeakPolarHBondContact O-CD2 3.35Å; N165-F169 PolarHBondContact O-N 3.14Å |
| 166 | V | 90.9 | Very high | 85.3 | Confident | 60 Ų | 60 | 41.6 Ų | 41.6 | 36% | 0.364 | 21% | 0.209 | S | C | . | . | H | α-helix | trans | -60.2 | -45.1 | 175 | 168.6 | 0 | 0 | 0 | 0 | 110.3 | I162 L163 W168 F169 L170 | I162-V166 HydrophobicContact CG2-CG2 4.22Å; I162-V166 WeakPolarHBondContact O-CB 3.08Å; I162-V166 VanDerWaalsContact O-CG2 3.28Å; I162-V166 WeakPolarHBondContact O-CG2 3.47Å; I162-V166 PolarHBondContact O-N 3.25Å; L163-V166 PolarHBondContact O-N 3.22Å; V166-W168 VanDerWaalsContact C-N 3.32Å; V166-W168 PolarHBondContact O-N 3.27Å; V166-F169 PolarHBondContact O-N 3.35Å; V166-L170 HydrophobicContact CG1-CD1 4.25Å; V166-L170 WeakPolarHBondContact O-CG 3.45Å; V166-L170 PolarHBondContact O-N 3.39Å |
| 167 | M | 90.4 | Very high | 83.4 | Confident | 34 Ų | 34 | 46.6 Ų | 46.6 | 17% | 0.167 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -67.7 | -33.4 | 177.6 | -68.2 | -71.1 | 159.4 | 0 | 0 | 112.4 | L163 N165 L170 L171 I192 Y193 F196 | L163-M167 WeakPolarHBondContact O-CB 3.42Å; L163-M167 WeakPolarHBondContact O-CG 3.35Å; L163-M167 PolarHBondContact O-N 2.93Å; N165-M167 VanDerWaalsContact C-N 3.32Å; N165-M167 PolarHBondContact O-N 3.43Å; M167-L170 HydrophobicContact CE-CD1 3.93Å; M167-L170 PolarHBondContact O-N 3.25Å; M167-L170 HydrophobicContact SD-CD1 3.68Å; M167-L171 WeakPolarHBondContact O-CB 3.28Å; M167-L171 PolarHBondContact O-N 2.99Å; M167-I192 HydrophobicContact CE-CG2 4Å; M167-I192 HydrophobicContact CG-CG2 4.27Å; M167-I192 HydrophobicContact SD-CG2 3.63Å; M167-Y193 HydrophobicContact CB-CD2 3.99Å; M167-F196 HydrophobicContact CB-CD2 4.42Å; M167-F196 HydrophobicContact CE-CE2 3.97Å; M167-F196 HydrophobicContact CG-CD2 3.58Å; M167-F196 HydrophobicContact CG-CE2 3.82Å; M167-F196 HydrophobicContact SD-CE2 4.33Å |
| 168 | W | 88.6 | Confident | 81.6 | Confident | 13 Ų | 13 | 50.1 Ų | 50.1 | 5% | 0.049 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -60.2 | -45.7 | 170.7 | -175 | 81.5 | 0 | 0 | 0 | 111.6 | N122 Y123 H126 R164 N165 V166 L170 L171 Q172 Y193 | N122-W168 WeakPolarHBondContact ND2-CZ2 3.42Å; Y123-W168 AromaticContact CD2-CH2 3.9Å; Y123-W168 HydrophobicContact CD2-CH2 3.9Å; Y123-W168 AromaticContact CD2-CZ3 3.91Å; Y123-W168 HydrophobicContact CD2-CZ3 3.91Å; Y123-W168 HydrophobicContact CG-CH2 4.41Å; H126-W168 HydrophobicContact CB-CE3 3.91Å; H126-W168 HydrophobicContact CB-CZ3 3.87Å; H126-W168 AromaticContact CD2-CD2 3.54Å; H126-W168 AromaticContact CD2-CE2 3.66Å; H126-W168 AromaticContact CD2-CE3 3.59Å; H126-W168 AromaticContact CD2-CH2 3.89Å; H126-W168 AromaticContact CD2-CZ2 3.86Å; H126-W168 AromaticContact CD2-CZ3 3.75Å; H126-W168 AromaticContact CG-CE3 3.8Å; H126-W168 AromaticContact NE2-CD2 3.85Å; H126-W168 AromaticContact NE2-CE2 3.91Å; R164-W168 WeakPolarHBondContact O-CB 3.34Å; R164-W168 PolarHBondContact O-N 2.96Å; N165-W168 WeakPolarHBondContact O-CB 3.39Å; N165-W168 PolarHBondContact O-N 3.26Å; V166-W168 VanDerWaalsContact C-N 3.32Å; V166-W168 PolarHBondContact O-N 3.27Å; W168-L170 PolarHBondContact O-N 2.95Å; W168-L171 WeakPolarHBondContact O-CB 3.37Å; W168-L171 PolarHBondContact O-N 2.97Å; W168-Q172 HydrophobicContact CD2-CG 3.95Å; W168-Q172 HydrophobicContact CE3-CG 4.03Å; W168-Q172 HydrophobicContact CH2-CG 3.64Å; W168-Q172 HydrophobicContact CZ2-CG 3.53Å; W168-Q172 HydrophobicContact CZ3-CG 3.89Å; W168-Q172 WeakPolarHBondContact O-CG 3.42Å; W168-Q172 PolarHBondContact O-N 3.49Å; W168-Y193 HydrophobicContact CB-CE2 3.91Å; W168-Y193 HydrophobicContact CG-CE2 4.46Å |
| 169 | F | 88.7 | Confident | 80 | Confident | 45 Ų | 45 | 52.1 Ų | 52.1 | 20% | 0.197 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -62.5 | -42.4 | 175.1 | -79.2 | -67.3 | 0 | 0 | 0 | 112.7 | Y123 H126 C127 V130 N165 V166 L171 Q172 M173 | Y123-F169 AromaticContact CD2-CE1 3.99Å; Y123-F169 HydrophobicContact CD2-CE1 3.99Å; Y123-F169 HydrophobicContact CE2-CD1 4.02Å; Y123-F169 AromaticContact CE2-CE1 3.59Å; Y123-F169 HydrophobicContact CE2-CE1 3.59Å; H126-F169 HydrophobicContact CB-CE2 4.07Å; H126-F169 HydrophobicContact CB-CZ 3.86Å; C127-F169 HydrophobicContact CB-CZ 4.42Å; C127-F169 VanDerWaalsContact SG-CZ 3.55Å; V130-F169 HydrophobicContact CG2-CE2 3.94Å; N165-F169 WeakPolarHBondContact O-CD2 3.35Å; N165-F169 PolarHBondContact O-N 3.14Å; V166-F169 PolarHBondContact O-N 3.35Å; F169-L171 PolarHBondContact O-N 2.97Å; F169-Q172 PolarHBondContact O-N 2.91Å; F169-M173 PolarHBondContact O-N 3.08Å |
| 170 | L | 87.1 | Confident | 78.3 | Confident | 72 Ų | 72 | 59.6 Ų | 59.6 | 38% | 0.377 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -59.4 | -38.4 | 175.5 | -70.6 | 173.6 | 0 | 0 | 0 | 111.4 | V166 M167 W168 M173 I174 | V166-L170 HydrophobicContact CG1-CD1 4.25Å; V166-L170 WeakPolarHBondContact O-CG 3.45Å; V166-L170 PolarHBondContact O-N 3.39Å; M167-L170 HydrophobicContact CE-CD1 3.93Å; M167-L170 PolarHBondContact O-N 3.25Å; M167-L170 HydrophobicContact SD-CD1 3.68Å; W168-L170 PolarHBondContact O-N 2.95Å; L170-M173 PolarHBondContact O-N 3.46Å; L170-I174 WeakPolarHBondContact O-CG1 3.39Å |
| 171 | L | 82.9 | Confident | 76.7 | Confident | 6 Ų | 6 | 63.2 Ų | 63.2 | 3% | 0.031 | 32% | 0.321 | C | S | . | . | H | α-helix | trans | -69.7 | -38.8 | 177 | -167.7 | 60.9 | 0 | 0 | 0 | 112.4 | M167 W168 F169 M173 I174 I189 Y193 F258 | M167-L171 WeakPolarHBondContact O-CB 3.28Å; M167-L171 PolarHBondContact O-N 2.99Å; W168-L171 WeakPolarHBondContact O-CB 3.37Å; W168-L171 PolarHBondContact O-N 2.97Å; F169-L171 PolarHBondContact O-N 2.97Å; L171-M173 VanDerWaalsContact C-N 3.32Å; L171-I174 HydrophobicContact CD1-CD1 4.26Å; L171-I174 PolarHBondContact O-N 3.27Å; L171-I189 HydrophobicContact CD1-CG2 4.22Å; L171-Y193 HydrophobicContact CD2-CD1 3.84Å; L171-Y193 HydrophobicContact CD2-CD2 4.38Å; L171-Y193 HydrophobicContact CD2-CE1 4.17Å; L171-Y193 HydrophobicContact CD2-CG 3.94Å; L171-F258 HydrophobicContact CD1-CD2 3.54Å; L171-F258 HydrophobicContact CD1-CE2 3.87Å; L171-F258 HydrophobicContact CD1-CG 4.21Å; L171-F258 HydrophobicContact CD2-CD2 3.57Å; L171-F258 HydrophobicContact CD2-CE2 3.27Å; L171-F258 HydrophobicContact CD2-CZ 4.35Å; L171-F258 HydrophobicContact CG-CD2 3.58Å; L171-F258 HydrophobicContact CG-CE2 3.33Å; L171-F258 HydrophobicContact CG-CZ 4.1Å |
| 172 | Q | 81.5 | Confident | 75.5 | Confident | 68 Ų | 68 | 67.4 Ų | 67.4 | 32% | 0.318 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -70.9 | -25.5 | 174.8 | -64.4 | -54.5 | -55.8 | 0 | 0 | 113.5 | W168 F169 I174 | W168-Q172 HydrophobicContact CD2-CG 3.95Å; W168-Q172 HydrophobicContact CE3-CG 4.03Å; W168-Q172 HydrophobicContact CH2-CG 3.64Å; W168-Q172 HydrophobicContact CZ2-CG 3.53Å; W168-Q172 HydrophobicContact CZ3-CG 3.89Å; W168-Q172 WeakPolarHBondContact O-CG 3.42Å; W168-Q172 PolarHBondContact O-N 3.49Å; F169-Q172 PolarHBondContact O-N 2.91Å; Q172-I174 VanDerWaalsContact C-N 3.26Å; Q172-I174 PolarHBondContact O-N 3.42Å |
| 173 | M | 78.1 | Confident | 74.7 | Confident | 150 Ų | 150 | 69 Ų | 69 | 74% | 0.739 | 35% | 0.351 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -74.1 | -15.7 | 175.2 | -86.4 | -169 | 58.1 | 0 | 0 | 113.5 | F169 L170 L171 D175 | F169-M173 PolarHBondContact O-N 3.08Å; L170-M173 PolarHBondContact O-N 3.46Å; L171-M173 VanDerWaalsContact C-N 3.32Å; M173-D175 PolarHBondContact O-N 3.38Å |
| 174 | I | 74.9 | Confident | 74.1 | Confident | 30 Ų | 30 | 70.8 Ų | 70.8 | 15% | 0.154 | 37% | 0.365 | C | S | . | . | S | Bend | trans | -75.1 | 97.8 | 175.8 | -62.6 | 168.1 | 0 | 0 | 0 | 107.3 | L170 L171 Q172 I189 | L170-I174 WeakPolarHBondContact O-CG1 3.39Å; L171-I174 HydrophobicContact CD1-CD1 4.26Å; L171-I174 PolarHBondContact O-N 3.27Å; Q172-I174 VanDerWaalsContact C-N 3.26Å; Q172-I174 PolarHBondContact O-N 3.42Å; I174-I189 HydrophobicContact CD1-CB 4.25Å; I174-I189 HydrophobicContact CD1-CD1 3.86Å; I174-I189 HydrophobicContact CD1-CG2 4.01Å |
| 175 | D | 59.2 | Low | 73.7 | Confident | 83 Ų | 83 | 78.5 Ų | 78.5 | 44% | 0.444 | 39% | 0.394 | S | S | . | . | trans | -62 | 153.9 | 176.1 | -172.4 | 27.1 | 0 | 0 | 0 | 111.6 | M173 N177 I178 | M173-D175 PolarHBondContact O-N 3.38Å; D175-N177 PolarHBondContact O-N 3.39Å; D175-N177 VanDerWaalsContact O-N 3.13Å; D175-N177 PolarHBondContact OD2-ND2 2.68Å; D175-I178 PolarHBondContact O-N 3.1Å | ||
| 176 | H | 56.6 | Low | 73.4 | Confident | 164 Ų | 164 | 78.6 Ų | 78.6 | 76% | 0.759 | 40% | 0.395 | S | S | * | . | G | 310 helix | trans | -55.6 | -30.8 | 177.1 | -97.7 | -73.5 | 0 | 0 | 0 | 112.2 | I178 H179 | H176-I178 VanDerWaalsContact C-N 3.31Å; H176-I178 PolarHBondContact O-N 3.3Å; H176-H179 PolarHBondContact O-N 3.41Å |
| 177 | N | 50.5 | Low | 73.1 | Confident | 129 Ų | 129 | 77.1 Ų | 77.1 | 69% | 0.69 | 38% | 0.383 | S | S | * | . | G | 310 helix | trans | -74.6 | -16.2 | -179.4 | -60.4 | -54.5 | 0 | 0 | 0 | 114 | D175 | D175-N177 PolarHBondContact O-N 3.39Å; D175-N177 VanDerWaalsContact O-N 3.13Å; D175-N177 PolarHBondContact OD2-ND2 2.68Å |
| 178 | I | 52.8 | Low | 72.9 | Confident | 75 Ų | 75 | 78.8 Ų | 78.8 | 39% | 0.385 | 40% | 0.397 | S | S | . | . | G | 310 helix | trans | -91.7 | -15.2 | 179.4 | -59.5 | 178.9 | 0 | 0 | 0 | 111.6 | D175 H176 E180 S181 N182 | D175-I178 PolarHBondContact O-N 3.1Å; H176-I178 VanDerWaalsContact C-N 3.31Å; H176-I178 PolarHBondContact O-N 3.3Å; I178-E180 PolarHBondContact O-N 3.13Å; I178-S181 PolarHBondContact O-N 3.33Å; I178-N182 PolarHBondContact O-N 2.94Å |
| 179 | H | 54.4 | Low | 72.9 | Confident | 45 Ų | 45 | 78.9 Ų | 78.9 | 21% | 0.208 | 40% | 0.398 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -57.2 | -32 | 176.3 | -100 | 58.5 | 0 | 0 | 0 | 112.8 | H176 C186 C256 | H176-H179 PolarHBondContact O-N 3.41Å; H179-C186 VanDerWaalsContact CE1-SG 3.53Å; H179-C256 VanDerWaalsContact CD2-CB 3.46Å; H179-C256 WeakPolarHBondContact CD2-CB 3.34Å; H179-C256 VanDerWaalsContact NE2-CB 3.33Å; H179-C256 WeakPolarHBondContact NE2-CB 3.48Å |
| 180 | E | 55 | Low | 72.8 | Confident | 190 Ų | 190 | 76.9 Ų | 76.9 | 89% | 0.888 | 39% | 0.39 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -87.5 | -19.4 | -178.8 | -66.4 | -168 | 163.4 | 0 | 0 | 114.1 | I178 | I178-E180 PolarHBondContact O-N 3.13Š|
| 181 | S | 59.8 | Low | 72.9 | Confident | 76 Ų | 76 | 74.9 Ų | 74.9 | 53% | 0.531 | 38% | 0.381 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -97.2 | -26.6 | -172.8 | 72.4 | 0 | 0 | 0 | 0 | 115.2 | I178 | I178-S181 PolarHBondContact O-N 3.33Š|
| 182 | N | 67.5 | Low | 73.4 | Confident | 87 Ų | 87 | 78.1 Ų | 78.1 | 47% | 0.465 | 40% | 0.397 | S | S | . | . | trans | -140.4 | 62.6 | -175 | -71.9 | -74.3 | 0 | 0 | 0 | 112.3 | I178 W185 C186 | I178-N182 PolarHBondContact O-N 2.94Å; N182-W185 HydrophobicContact CB-CB 4.05Å; N182-W185 WeakPolarHBondContact O-CB 3.11Å; N182-W185 PolarHBondContact O-N 3.35Å; N182-W185 VanDerWaalsContact O-N 3.16Å; N182-C186 PolarHBondContact O-N 3.05Å | ||
| 183 | E | 73.9 | Confident | 73.9 | Confident | 64 Ų | 64 | 76.3 Ų | 76.3 | 30% | 0.299 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -51 | -47.8 | 179.7 | -161.3 | -178 | -172.1 | 0 | 0 | 115.1 | W185 C186 R187 E254 Q255 | E183-W185 VanDerWaalsContact C-N 3.3Å; E183-W185 PolarHBondContact O-N 3.24Å; E183-C186 PolarHBondContact O-N 3.33Å; E183-R187 WeakPolarHBondContact O-CG 3.48Å; E183-R187 PolarHBondContact O-N 2.81Å; E183-R187 VanDerWaalsContact O-N 3.15Å; E183-R187 IonicContact OE1-CZ 3.46Å; E183-R187 IonicContact OE1-NE 3.63Å; E183-R187 IonicContact OE1-NH2 2.89Å; E183-R187 PolarHBondContact OE1-NH2 3.44Å; E183-R187 IonicContact OE2-NH2 3.36Å; E183-E254 VanDerWaalsContact OE1-C 3.31Å; E183-Q255 PolarHBondContact OE1-N 3.35Å |
| 184 | P | 81.3 | Confident | 74.4 | Confident | 89 Ų | 89 | 69.9 Ų | 69.9 | 58% | 0.578 | 36% | 0.356 | S | S | * | . | H | α-helix | trans | -66.3 | -31.3 | -179.9 | 24.7 | -33.8 | 0 | 0 | 0 | 113 | C188 | P184-C188 WeakPolarHBondContact O-CB 3.27Å; P184-C188 PolarHBondContact O-N 2.91Å; P184-C188 PolarHBondContact O-SG 2.87Å |
| 185 | W | 82.1 | Confident | 75.3 | Confident | 168 Ų | 168 | 70.6 Ų | 70.6 | 64% | 0.636 | 36% | 0.358 | S | S | * | . | H | α-helix | trans | -67.8 | -43.5 | 178.2 | -176.5 | -108.3 | 0 | 0 | 0 | 111.5 | N182 E183 R187 C188 I189 | N182-W185 HydrophobicContact CB-CB 4.05Å; N182-W185 WeakPolarHBondContact O-CB 3.11Å; N182-W185 PolarHBondContact O-N 3.35Å; N182-W185 VanDerWaalsContact O-N 3.16Å; E183-W185 VanDerWaalsContact C-N 3.3Å; E183-W185 PolarHBondContact O-N 3.24Å; W185-R187 PolarHBondContact O-N 3.39Å; W185-C188 PolarHBondContact O-N 3.41Å; W185-I189 HydrophobicContact CD2-CD1 4.33Å; W185-I189 HydrophobicContact CG-CD1 4.45Å; W185-I189 HydrophobicContact CZ2-CD1 3.95Å; W185-I189 PolarHBondContact O-N 3.43Å |
| 186 | C | 84.6 | Confident | 77 | Confident | 3 Ų | 3 | 67.9 Ų | 67.9 | 2% | 0.02 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -63.5 | -40.7 | 177.2 | -166.6 | 0 | 0 | 0 | 0 | 111.9 | H179 N182 E183 I189 T190 C256 | H179-C186 VanDerWaalsContact CE1-SG 3.53Å; N182-C186 PolarHBondContact O-N 3.05Å; E183-C186 PolarHBondContact O-N 3.33Å; C186-I189 PolarHBondContact O-N 3.37Å; C186-T190 WeakPolarHBondContact O-CB 3.42Å; C186-T190 PolarHBondContact O-N 2.94Å; C186-T190 PolarHBondContact O-OG1 3.01Å; C186-C256 VanDerWaalsContact C-SG 3.53Å; C186-C256 HydrophobicContact CB-CB 3.72Å; C186-C256 WeakPolarHBondContact CB-SG 3.4Å; C186-C256 WeakPolarHBondContact SG-CB 3.41Å; C186-C256 CovalentContact SG-SG 2.01Å; C186-C256 PolarHBondContact SG-SG 3.39Å |
| 187 | R | 84.9 | Confident | 78.6 | Confident | 29 Ų | 29 | 60.4 Ų | 60.4 | 11% | 0.109 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -62.6 | -44.4 | 174 | -65.9 | 171.5 | -174.7 | -168.1 | -0.6 | 112.3 | E183 W185 T190 T191 N253 W257 | E183-R187 WeakPolarHBondContact O-CG 3.48Å; E183-R187 PolarHBondContact O-N 2.81Å; E183-R187 VanDerWaalsContact O-N 3.15Å; E183-R187 IonicContact OE1-CZ 3.46Å; E183-R187 IonicContact OE1-NE 3.63Å; E183-R187 IonicContact OE1-NH2 2.89Å; E183-R187 PolarHBondContact OE1-NH2 3.44Å; E183-R187 IonicContact OE2-NH2 3.36Å; W185-R187 PolarHBondContact O-N 3.39Å; R187-T190 PolarHBondContact O-N 3.11Å; R187-T191 WeakPolarHBondContact O-CB 3.32Å; R187-T191 PolarHBondContact O-N 3.43Å; R187-T191 PolarHBondContact O-OG1 2.94Å; R187-N253 VanDerWaalsContact CZ-OD1 3.25Å; R187-N253 PolarHBondContact NH1-OD1 2.88Å; R187-N253 PolarHBondContact NH2-O 3.43Å; R187-N253 PolarHBondContact NH2-OD1 2.89Å; R187-W257 HydrophobicContact CB-CD2 4.35Å; R187-W257 HydrophobicContact CB-CE3 4.21Å; R187-W257 HydrophobicContact CB-CH2 4.46Å; R187-W257 HydrophobicContact CB-CZ3 4.28Å; R187-W257 HydrophobicContact CG-CD2 4.11Å; R187-W257 HydrophobicContact CG-CE3 4.48Å; R187-W257 HydrophobicContact CG-CG 4.49Å; R187-W257 HydrophobicContact CG-CZ2 4.35Å |
| 188 | C | 87.1 | Confident | 80.6 | Confident | 68 Ų | 68 | 54.3 Ų | 54.3 | 46% | 0.459 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -60.7 | -50.5 | 176.5 | -77.3 | 0 | 0 | 0 | 0 | 111.7 | P184 W185 T190 T191 I192 | P184-C188 WeakPolarHBondContact O-CB 3.27Å; P184-C188 PolarHBondContact O-N 2.91Å; P184-C188 PolarHBondContact O-SG 2.87Å; W185-C188 PolarHBondContact O-N 3.41Å; C188-T190 VanDerWaalsContact C-N 3.33Å; C188-T190 PolarHBondContact O-N 3.44Å; C188-T191 PolarHBondContact O-N 3.13Å; C188-I192 WeakPolarHBondContact O-CB 3.29Å; C188-I192 WeakPolarHBondContact O-CD1 3.24Å; C188-I192 WeakPolarHBondContact O-CG1 3.33Å; C188-I192 PolarHBondContact O-N 2.88Å |
| 189 | I | 88.4 | Confident | 82.5 | Confident | 15 Ų | 15 | 50.8 Ų | 50.8 | 8% | 0.077 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -61.3 | -43.1 | 178.9 | -70.3 | 179.5 | 0 | 0 | 0 | 110.9 | L171 I174 W185 C186 T191 I192 Y193 | L171-I189 HydrophobicContact CD1-CG2 4.22Å; I174-I189 HydrophobicContact CD1-CB 4.25Å; I174-I189 HydrophobicContact CD1-CD1 3.86Å; I174-I189 HydrophobicContact CD1-CG2 4.01Å; W185-I189 HydrophobicContact CD2-CD1 4.33Å; W185-I189 HydrophobicContact CG-CD1 4.45Å; W185-I189 HydrophobicContact CZ2-CD1 3.95Å; W185-I189 PolarHBondContact O-N 3.43Å; C186-I189 PolarHBondContact O-N 3.37Å; I189-T191 VanDerWaalsContact C-N 3.34Å; I189-T191 PolarHBondContact O-N 3.42Å; I189-I192 PolarHBondContact O-N 2.99Å; I189-Y193 WeakPolarHBondContact O-CB 3.23Å; I189-Y193 PolarHBondContact O-N 3.35Å |
| 190 | T | 86.8 | Confident | 84.3 | Confident | 4 Ų | 4 | 48.6 Ų | 48.6 | 3% | 0.025 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -62.6 | -42 | 178.2 | -59 | 0 | 0 | 0 | 0 | 111.8 | C186 R187 C188 Y193 N194 W244 W257 | C186-T190 WeakPolarHBondContact O-CB 3.42Å; C186-T190 PolarHBondContact O-N 2.94Å; C186-T190 PolarHBondContact O-OG1 3.01Å; R187-T190 PolarHBondContact O-N 3.11Å; C188-T190 VanDerWaalsContact C-N 3.33Å; C188-T190 PolarHBondContact O-N 3.44Å; T190-Y193 PolarHBondContact O-N 3.48Å; T190-N194 PolarHBondContact O-N 3.05Å; T190-N194 PolarHBondContact O-ND2 3.31Å; T190-W244 HydrophobicContact CG2-CH2 4.48Å; T190-W257 HydrophobicContact CG2-CB 4Å; T190-W257 WeakPolarHBondContact CG2-O 3.44Å |
| 191 | T | 89.7 | Confident | 86 | Confident | 29 Ų | 29 | 39.7 Ų | 39.7 | 18% | 0.178 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -63.4 | -45.2 | 176.5 | -56.1 | 0 | 0 | 0 | 0 | 111.5 | R187 C188 I189 Y193 N194 Y195 I241 A245 W257 | R187-T191 WeakPolarHBondContact O-CB 3.32Å; R187-T191 PolarHBondContact O-N 3.43Å; R187-T191 PolarHBondContact O-OG1 2.94Å; C188-T191 PolarHBondContact O-N 3.13Å; I189-T191 VanDerWaalsContact C-N 3.34Å; I189-T191 PolarHBondContact O-N 3.42Å; T191-Y193 VanDerWaalsContact C-N 3.35Å; T191-N194 PolarHBondContact O-N 3.49Å; T191-Y195 WeakPolarHBondContact O-CB 3.28Å; T191-Y195 PolarHBondContact O-N 3.48Å; T191-I241 HydrophobicContact CG2-CG2 3.71Å; T191-A245 HydrophobicContact CG2-CB 4.08Å; T191-W257 VanDerWaalsContact OG1-CZ3 3.25Å; T191-W257 WeakPolarHBondContact OG1-CZ3 3.27Å |
| 192 | I | 92.3 | Very high | 87.6 | Confident | 74 Ų | 74 | 36.7 Ų | 36.7 | 38% | 0.379 | 18% | 0.183 | S | C | . | . | H | α-helix | trans | -63.4 | -42.6 | 177.5 | -68.8 | 166.9 | 0 | 0 | 0 | 110.5 | M167 C188 I189 Y195 F196 | M167-I192 HydrophobicContact CE-CG2 4Å; M167-I192 HydrophobicContact CG-CG2 4.27Å; M167-I192 HydrophobicContact SD-CG2 3.63Å; C188-I192 WeakPolarHBondContact O-CB 3.29Å; C188-I192 WeakPolarHBondContact O-CD1 3.24Å; C188-I192 WeakPolarHBondContact O-CG1 3.33Å; C188-I192 PolarHBondContact O-N 2.88Å; I189-I192 PolarHBondContact O-N 2.99Å; I192-Y195 WeakPolarHBondContact O-CB 3.19Å; I192-Y195 PolarHBondContact O-N 3.43Å; I192-F196 HydrophobicContact CG2-CD2 3.72Å; I192-F196 HydrophobicContact CG2-CE2 3.33Å; I192-F196 HydrophobicContact CG2-CZ 4.39Å; I192-F196 WeakPolarHBondContact O-CD2 3.46Å; I192-F196 PolarHBondContact O-N 2.72Å |
| 193 | Y | 91.3 | Very high | 88.8 | Confident | 31 Ų | 31 | 32.6 Ų | 32.6 | 12% | 0.122 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -58.2 | -51.4 | 174.4 | 171.4 | -103.2 | 0 | 0 | 0 | 111.4 | M167 W168 L171 I189 T190 T191 Y195 F196 V197 | M167-Y193 HydrophobicContact CB-CD2 3.99Å; W168-Y193 HydrophobicContact CB-CE2 3.91Å; W168-Y193 HydrophobicContact CG-CE2 4.46Å; L171-Y193 HydrophobicContact CD2-CD1 3.84Å; L171-Y193 HydrophobicContact CD2-CD2 4.38Å; L171-Y193 HydrophobicContact CD2-CE1 4.17Å; L171-Y193 HydrophobicContact CD2-CG 3.94Å; I189-Y193 WeakPolarHBondContact O-CB 3.23Å; I189-Y193 PolarHBondContact O-N 3.35Å; T190-Y193 PolarHBondContact O-N 3.48Å; T191-Y193 VanDerWaalsContact C-N 3.35Å; Y193-Y195 VanDerWaalsContact C-N 3.27Å; Y193-Y195 PolarHBondContact O-N 2.99Å; Y193-F196 PolarHBondContact O-N 2.91Å; Y193-F196 VanDerWaalsContact O-N 3.13Å; Y193-V197 HydrophobicContact CD1-CG2 4.28Å; Y193-V197 HydrophobicContact CD2-CG2 4.31Å; Y193-V197 HydrophobicContact CE1-CG2 3.81Å; Y193-V197 HydrophobicContact CE2-CG2 3.84Å; Y193-V197 WeakPolarHBondContact O-CG2 3.23Å; Y193-V197 PolarHBondContact O-N 3.31Å |
| 194 | N | 89.9 | Confident | 89.4 | Confident | 14 Ų | 14 | 30.1 Ų | 30.1 | 8% | 0.075 | 15% | 0.149 | C | C | . | . | H | α-helix | trans | -60.9 | -36.8 | 177.9 | -75.2 | -33.4 | 0 | 0 | 0 | 112.1 | T190 T191 V197 V198 I241 W244 | T190-N194 PolarHBondContact O-N 3.05Å; T190-N194 PolarHBondContact O-ND2 3.31Å; T191-N194 PolarHBondContact O-N 3.49Å; N194-V197 PolarHBondContact O-N 2.7Å; N194-V198 WeakPolarHBondContact O-CG2 3.45Å; N194-V198 PolarHBondContact O-N 3.43Å; N194-I241 HydrophobicContact CB-CD1 3.97Å; N194-W244 HydrophobicContact CB-CZ3 4.5Å; N194-W244 WeakPolarHBondContact ND2-CH2 3.41Å |
| 195 | Y | 93.8 | Very high | 89.8 | Confident | 46 Ų | 46 | 27.5 Ų | 27.5 | 18% | 0.18 | 13% | 0.129 | C | C | . | . | H | α-helix | trans | -58.6 | -48.5 | 171.8 | 171.4 | -103.2 | 0 | 0 | 0 | 113 | T191 I192 Y193 V197 V198 T199 W234 P237 C238 | T191-Y195 WeakPolarHBondContact O-CB 3.28Å; T191-Y195 PolarHBondContact O-N 3.48Å; I192-Y195 WeakPolarHBondContact O-CB 3.19Å; I192-Y195 PolarHBondContact O-N 3.43Å; Y193-Y195 VanDerWaalsContact C-N 3.27Å; Y193-Y195 PolarHBondContact O-N 2.99Å; Y195-V197 VanDerWaalsContact C-N 3.32Å; Y195-V197 PolarHBondContact O-N 3.48Å; Y195-V198 PolarHBondContact O-N 2.92Å; Y195-T199 WeakPolarHBondContact CE2-OG1 3.31Å; Y195-T199 WeakPolarHBondContact O-CB 3.36Å; Y195-T199 PolarHBondContact O-N 2.85Å; Y195-T199 PolarHBondContact O-OG1 2.89Å; Y195-W234 PolarHBondContact OH-O 3.27Å; Y195-P237 HydrophobicContact CD2-CB 4.19Å; Y195-P237 HydrophobicContact CE2-CB 3.91Å; Y195-C238 HydrophobicContact CE2-CB 4.35Å; Y195-C238 WeakPolarHBondContact CE2-SG 3.09Å |
| 196 | F | 94.4 | Very high | 90.3 | Very high | 25 Ų | 25 | 19.6 Ų | 19.6 | 11% | 0.11 | 10% | 0.099 | C | C | . | . | H | α-helix | trans | -69.2 | -30.4 | 178 | -69.5 | -59.9 | 0 | 0 | 0 | 113.1 | L163 R164 M167 I192 Y193 N200 W234 | L163-F196 HydrophobicContact CB-CD1 3.68Å; L163-F196 HydrophobicContact CB-CD2 4.4Å; L163-F196 HydrophobicContact CB-CE1 3.84Å; L163-F196 HydrophobicContact CB-CE2 4.46Å; L163-F196 HydrophobicContact CB-CG 3.99Å; L163-F196 HydrophobicContact CB-CZ 4.2Å; L163-F196 HydrophobicContact CD1-CD1 4Å; L163-F196 HydrophobicContact CD1-CE1 3.52Å; L163-F196 HydrophobicContact CD1-CZ 4.14Å; L163-F196 HydrophobicContact CD2-CZ 4.4Å; L163-F196 HydrophobicContact CG-CD1 4.44Å; L163-F196 HydrophobicContact CG-CE1 4.15Å; L163-F196 HydrophobicContact CG-CZ 4.48Å; R164-F196 HydrophobicContact CB-CB 4.41Å; M167-F196 HydrophobicContact CB-CD2 4.42Å; M167-F196 HydrophobicContact CE-CE2 3.97Å; M167-F196 HydrophobicContact CG-CD2 3.58Å; M167-F196 HydrophobicContact CG-CE2 3.82Å; M167-F196 HydrophobicContact SD-CE2 4.33Å; I192-F196 HydrophobicContact CG2-CD2 3.72Å; I192-F196 HydrophobicContact CG2-CE2 3.33Å; I192-F196 HydrophobicContact CG2-CZ 4.39Å; I192-F196 WeakPolarHBondContact O-CD2 3.46Å; I192-F196 PolarHBondContact O-N 2.72Å; Y193-F196 PolarHBondContact O-N 2.91Å; Y193-F196 VanDerWaalsContact O-N 3.13Å; F196-N200 WeakPolarHBondContact O-CB 3.3Å; F196-N200 PolarHBondContact O-N 3.39Å; F196-W234 HydrophobicContact CE1-CZ3 4.39Å |
| 197 | V | 89.8 | Confident | 90.4 | Very high | 8 Ų | 8 | 20 Ų | 20 | 5% | 0.048 | 10% | 0.101 | C | C | . | . | H | α-helix | trans | -62.6 | -53 | 171.7 | 170.9 | 0 | 0 | 0 | 0 | 110.6 | R164 Y193 N194 Y195 T199 N200 F201 | R164-V197 HydrophobicContact CG-CG2 4.03Å; Y193-V197 HydrophobicContact CD1-CG2 4.28Å; Y193-V197 HydrophobicContact CD2-CG2 4.31Å; Y193-V197 HydrophobicContact CE1-CG2 3.81Å; Y193-V197 HydrophobicContact CE2-CG2 3.84Å; Y193-V197 WeakPolarHBondContact O-CG2 3.23Å; Y193-V197 PolarHBondContact O-N 3.31Å; N194-V197 PolarHBondContact O-N 2.7Å; Y195-V197 VanDerWaalsContact C-N 3.32Å; Y195-V197 PolarHBondContact O-N 3.48Å; V197-T199 PolarHBondContact O-N 2.93Å; V197-N200 WeakPolarHBondContact O-CB 3.31Å; V197-N200 PolarHBondContact O-N 3.48Å; V197-F201 HydrophobicContact CG1-CD2 4.16Å; V197-F201 HydrophobicContact CG1-CE2 3.68Å; V197-F201 WeakPolarHBondContact O-CD2 3.29Å; V197-F201 PolarHBondContact O-N 3.49Å |
| 198 | V | 91.9 | Very high | 90.5 | Very high | 1 Ų | 1 | 19.1 Ų | 19.1 | 1% | 0.006 | 10% | 0.1 | C | C | . | . | H | α-helix | trans | -62.7 | -46.1 | 178.9 | 176.1 | 0 | 0 | 0 | 0 | 110.8 | N194 Y195 N200 F201 F202 P237 I241 Y270 V274 | N194-V198 WeakPolarHBondContact O-CG2 3.45Å; N194-V198 PolarHBondContact O-N 3.43Å; Y195-V198 PolarHBondContact O-N 2.92Å; V198-N200 VanDerWaalsContact C-N 3.25Å; V198-N200 PolarHBondContact O-N 3.48Å; V198-F201 WeakPolarHBondContact O-CA 3.46Å; V198-F201 WeakPolarHBondContact O-CB 3.19Å; V198-F201 PolarHBondContact O-N 2.97Å; V198-F202 HydrophobicContact CG1-CD2 3.7Å; V198-F202 HydrophobicContact CG1-CE2 3.66Å; V198-F202 WeakPolarHBondContact O-CD2 3.46Å; V198-F202 PolarHBondContact O-N 3.24Å; V198-P237 HydrophobicContact CB-CB 4.43Å; V198-P237 HydrophobicContact CG1-CB 3.89Å; V198-P237 HydrophobicContact CG1-CG 4.39Å; V198-I241 HydrophobicContact CB-CD1 4.41Å; V198-I241 HydrophobicContact CB-CG1 4.46Å; V198-I241 HydrophobicContact CG2-CD1 3.74Å; V198-I241 HydrophobicContact CG2-CG1 4.29Å; V198-Y270 HydrophobicContact CG2-CD2 3.9Å; V198-V274 HydrophobicContact CB-CG2 4.41Å; V198-V274 HydrophobicContact CG1-CG2 4.14Å; V198-V274 HydrophobicContact CG2-CG2 3.89Å |
| 199 | T | 94.6 | Very high | 90.6 | Very high | 0 Ų | 0 | 17.3 Ų | 17.3 | 0% | 0 | 9% | 0.088 | C | C | . | . | H | α-helix | trans | -56.2 | -40.6 | 176.7 | -61.6 | 0 | 0 | 0 | 0 | 112 | T160 Y195 V197 F201 F202 W203 W234 P237 | T160-T199 HydrophobicContact CG2-CG2 3.8Å; Y195-T199 WeakPolarHBondContact CE2-OG1 3.31Å; Y195-T199 WeakPolarHBondContact O-CB 3.36Å; Y195-T199 PolarHBondContact O-N 2.85Å; Y195-T199 PolarHBondContact O-OG1 2.89Å; V197-T199 PolarHBondContact O-N 2.93Å; T199-F201 PolarHBondContact O-N 3.34Å; T199-F202 PolarHBondContact O-N 3.49Å; T199-W203 VanDerWaalsContact O-CD1 3.3Å; T199-W203 PolarHBondContact O-N 3Å; T199-W234 HydrophobicContact CG2-CD2 4.31Å; T199-W234 HydrophobicContact CG2-CE3 3.6Å; T199-W234 HydrophobicContact CG2-CH2 4.39Å; T199-W234 HydrophobicContact CG2-CZ3 3.66Å; T199-P237 WeakPolarHBondContact OG1-CB 3.38Å |
| 200 | N | 92.1 | Very high | 90.5 | Very high | 0 Ų | 0 | 18.2 Ų | 18.2 | 0% | 0 | 9% | 0.091 | C | C | . | . | H | α-helix | trans | -61.7 | -41.2 | 175.4 | 179.5 | -113.4 | 0 | 0 | 0 | 112.2 | T160 F161 R164 F196 V197 V198 W203 M204 | T160-N200 PolarHBondContact OG1-ND2 3.22Å; F161-N200 WeakPolarHBondContact CD1-ND2 3.2Å; F161-N200 WeakPolarHBondContact CE1-ND2 3.45Å; F161-N200 WeakPolarHBondContact CE1-OD1 3.31Å; F161-N200 WeakPolarHBondContact CE2-ND2 3.21Å; F161-N200 VanDerWaalsContact CZ-ND2 3.29Å; F161-N200 WeakPolarHBondContact CZ-ND2 3.42Å; R164-N200 PolarHBondContact NH1-OD1 3.46Å; F196-N200 WeakPolarHBondContact O-CB 3.3Å; F196-N200 PolarHBondContact O-N 3.39Å; V197-N200 WeakPolarHBondContact O-CB 3.31Å; V197-N200 PolarHBondContact O-N 3.48Å; V198-N200 VanDerWaalsContact C-N 3.25Å; V198-N200 PolarHBondContact O-N 3.48Å; N200-W203 PolarHBondContact O-N 3.1Å; N200-M204 WeakPolarHBondContact O-CG 3.36Å; N200-M204 PolarHBondContact O-N 3.26Å; N200-M204 WeakPolarHBondContact OD1-CE 3.36Å |
| 201 | F | 90.3 | Very high | 90.5 | Very high | 3 Ų | 3 | 20.8 Ų | 20.8 | 1% | 0.013 | 10% | 0.104 | C | C | . | . | H | α-helix | trans | -62.8 | -44.1 | 173.5 | -72.3 | -67.3 | 0 | 0 | 0 | 113.1 | V197 V198 T199 W203 M204 F205 V274 L278 Y325 | V197-F201 HydrophobicContact CG1-CD2 4.16Å; V197-F201 HydrophobicContact CG1-CE2 3.68Å; V197-F201 WeakPolarHBondContact O-CD2 3.29Å; V197-F201 PolarHBondContact O-N 3.49Å; V198-F201 WeakPolarHBondContact O-CA 3.46Å; V198-F201 WeakPolarHBondContact O-CB 3.19Å; V198-F201 PolarHBondContact O-N 2.97Å; T199-F201 PolarHBondContact O-N 3.34Å; F201-W203 VanDerWaalsContact C-N 3.32Å; F201-W203 PolarHBondContact O-N 2.82Å; F201-M204 HydrophobicContact CB-CE 4.36Å; F201-M204 HydrophobicContact CD1-CE 3.25Å; F201-M204 HydrophobicContact CE1-CE 3.62Å; F201-M204 HydrophobicContact CG-CE 3.96Å; F201-M204 PolarHBondContact O-N 3.5Å; F201-F205 PolarHBondContact O-N 3.46Å; F201-V274 HydrophobicContact CB-CG1 4.33Å; F201-V274 HydrophobicContact CD1-CG1 4.22Å; F201-V274 HydrophobicContact CD2-CG1 3.59Å; F201-V274 HydrophobicContact CD2-CG2 4.14Å; F201-V274 HydrophobicContact CE1-CG1 4.49Å; F201-V274 HydrophobicContact CE2-CG1 3.88Å; F201-V274 HydrophobicContact CG-CG1 3.79Å; F201-V274 HydrophobicContact CZ-CG1 4.34Å; F201-L278 HydrophobicContact CD1-CD1 4.33Å; F201-L278 HydrophobicContact CD1-CD2 3.59Å; F201-L278 HydrophobicContact CD1-CG 4.17Å; F201-L278 HydrophobicContact CE1-CD1 4.14Å; F201-L278 HydrophobicContact CE1-CD2 3.87Å; F201-L278 HydrophobicContact CE1-CG 4.43Å; F201-Y325 HydrophobicContact CE1-CD2 4.13Å; F201-Y325 HydrophobicContact CE1-CG 4.12Å; F201-Y325 HydrophobicContact CE2-CD1 4.42Å; F201-Y325 HydrophobicContact CE2-CE1 4.29Å; F201-Y325 HydrophobicContact CE2-CE2 4.4Å; F201-Y325 AromaticContact CZ-CD1 3.87Å; F201-Y325 HydrophobicContact CZ-CD1 3.87Å; F201-Y325 AromaticContact CZ-CD2 3.48Å; F201-Y325 HydrophobicContact CZ-CD2 3.48Å; F201-Y325 VanDerWaalsContact CZ-CD2 3.48Å; F201-Y325 HydrophobicContact CZ-CE1 4.06Å; F201-Y325 AromaticContact CZ-CE2 3.68Å; F201-Y325 HydrophobicContact CZ-CE2 3.68Å; F201-Y325 AromaticContact CZ-CG 3.56Å; F201-Y325 HydrophobicContact CZ-CG 3.56Å; F201-Y325 AromaticContact CZ-CZ 3.96Å |
| 202 | F | 92.7 | Very high | 90.3 | Very high | 13 Ų | 13 | 21.1 Ų | 21.1 | 6% | 0.057 | 10% | 0.103 | C | C | . | . | H | α-helix | trans | -62.7 | -38.4 | 176.2 | -86.8 | -95.5 | 0 | 0 | 0 | 112.1 | V198 T199 F205 V206 I232 I236 P237 I240 V277 | V198-F202 HydrophobicContact CG1-CD2 3.7Å; V198-F202 HydrophobicContact CG1-CE2 3.66Å; V198-F202 WeakPolarHBondContact O-CD2 3.46Å; V198-F202 PolarHBondContact O-N 3.24Å; T199-F202 PolarHBondContact O-N 3.49Å; F202-F205 WeakPolarHBondContact O-CB 3.33Å; F202-F205 PolarHBondContact O-N 3.25Å; F202-V206 WeakPolarHBondContact O-CG2 3.42Å; F202-V206 PolarHBondContact O-N 3.31Å; F202-I232 HydrophobicContact CD1-CG2 4.49Å; F202-I236 HydrophobicContact CD1-CB 4.31Å; F202-I236 HydrophobicContact CD1-CG2 4.22Å; F202-I236 HydrophobicContact CE1-CB 4.01Å; F202-I236 HydrophobicContact CE1-CG2 3.43Å; F202-I236 VanDerWaalsContact CE1-CG2 3.43Å; F202-I236 HydrophobicContact CZ-CG2 3.73Å; F202-P237 HydrophobicContact CB-CG 3.99Å; F202-P237 HydrophobicContact CD2-CG 3.82Å; F202-P237 HydrophobicContact CE2-CG 4.45Å; F202-P237 HydrophobicContact CG-CG 3.86Å; F202-I240 HydrophobicContact CE2-CD1 3.93Å; F202-I240 HydrophobicContact CZ-CD1 3.73Å; F202-V277 HydrophobicContact CE1-CG2 4.06Å; F202-V277 HydrophobicContact CE2-CG2 4.33Å; F202-V277 HydrophobicContact CZ-CG2 3.95Å |
| 203 | W | 92.6 | Very high | 90 | Very high | 1 Ų | 1 | 18.6 Ų | 18.6 | 0% | 0.004 | 9% | 0.091 | C | C | . | . | H | α-helix | trans | -69 | -36 | 174.9 | -87 | 98 | 0 | 0 | 0 | 113.3 | I153 N156 L157 T160 T199 N200 F201 F205 V206 E207 L230 G233 W234 | I153-W203 HydrophobicContact CG2-CE3 4.46Å; I153-W203 HydrophobicContact CG2-CZ3 4.28Å; N156-W203 HydrophobicContact CB-CD2 3.74Å; N156-W203 HydrophobicContact CB-CE3 3.61Å; N156-W203 HydrophobicContact CB-CH2 3.31Å; N156-W203 HydrophobicContact CB-CZ2 3.44Å; N156-W203 VanDerWaalsContact CB-CZ2 3.44Å; N156-W203 HydrophobicContact CB-CZ3 3.4Å; N156-W203 VanDerWaalsContact CG-CH2 3.43Å; L157-W203 HydrophobicContact CD1-CB 3.81Å; T160-W203 HydrophobicContact CG2-CB 4.22Å; T160-W203 HydrophobicContact CG2-CG 3.82Å; T199-W203 VanDerWaalsContact O-CD1 3.3Å; T199-W203 PolarHBondContact O-N 3Å; N200-W203 PolarHBondContact O-N 3.1Å; F201-W203 VanDerWaalsContact C-N 3.32Å; F201-W203 PolarHBondContact O-N 2.82Å; W203-F205 VanDerWaalsContact C-N 3.27Å; W203-F205 PolarHBondContact O-N 3.38Å; W203-V206 HydrophobicContact CE3-CB 4.22Å; W203-V206 HydrophobicContact CE3-CG1 4.01Å; W203-V206 HydrophobicContact CZ3-CG1 3.84Å; W203-V206 PolarHBondContact O-N 3.4Å; W203-E207 WeakPolarHBondContact O-CB 3.29Å; W203-E207 PolarHBondContact O-N 3.45Å; W203-L230 HydrophobicContact CH2-CG 4.39Å; W203-G233 PolarHBondContact NE1-O 2.53Å; W203-W234 AromaticContact CE2-CD1 3.91Å; W203-W234 AromaticContact CE2-NE1 3.61Å; W203-W234 AromaticContact CZ2-CD1 3.43Å; W203-W234 VanDerWaalsContact CZ2-CD1 3.43Å; W203-W234 HydrophobicContact CZ2-CG 4.31Å; W203-W234 AromaticContact CZ2-NE1 3.25Å; W203-W234 VanDerWaalsContact CZ2-NE1 3.25Å; W203-W234 AromaticContact NE1-CD1 3.77Å; W203-W234 AromaticContact NE1-CD2 3.71Å; W203-W234 AromaticContact NE1-CE2 3.48Å; W203-W234 AromaticContact NE1-CG 3.88Å; W203-W234 AromaticContact NE1-NE1 3.52Å |
| 204 | M | 87.4 | Confident | 89.7 | Confident | 11 Ų | 11 | 18.3 Ų | 18.3 | 5% | 0.054 | 10% | 0.096 | C | C | . | . | H | α-helix | trans | -61.4 | -38.5 | 170.3 | -73.3 | -173.7 | -71.5 | 0 | 0 | 111.2 | L157 F161 N200 F201 G208 L321 Q353 | L157-M204 HydrophobicContact CD1-CG 3.73Å; F161-M204 HydrophobicContact CZ-CG 4.35Å; F161-M204 HydrophobicContact CZ-SD 3.97Å; N200-M204 WeakPolarHBondContact O-CG 3.36Å; N200-M204 PolarHBondContact O-N 3.26Å; N200-M204 WeakPolarHBondContact OD1-CE 3.36Å; F201-M204 HydrophobicContact CB-CE 4.36Å; F201-M204 HydrophobicContact CD1-CE 3.25Å; F201-M204 HydrophobicContact CE1-CE 3.62Å; F201-M204 HydrophobicContact CG-CE 3.96Å; F201-M204 PolarHBondContact O-N 3.5Å; M204-G208 PolarHBondContact O-N 2.97Å; M204-L321 HydrophobicContact SD-CB 3.74Å; M204-Q353 PolarHBondContact SD-NE2 2.85Å; M204-Q353 VanDerWaalsContact SD-NE2 3.41Å |
| 205 | F | 89.6 | Confident | 89.3 | Confident | 35 Ų | 35 | 19.8 Ų | 19.8 | 15% | 0.154 | 10% | 0.103 | C | C | . | . | H | α-helix | trans | -68.6 | -42.6 | 174.1 | 165 | -99 | 0 | 0 | 0 | 113.7 | F201 F202 W203 E207 G208 C209 I232 V277 I280 F284 | F201-F205 PolarHBondContact O-N 3.46Å; F202-F205 WeakPolarHBondContact O-CB 3.33Å; F202-F205 PolarHBondContact O-N 3.25Å; W203-F205 VanDerWaalsContact C-N 3.27Å; W203-F205 PolarHBondContact O-N 3.38Å; F205-E207 VanDerWaalsContact C-N 3.25Å; F205-E207 PolarHBondContact O-N 3.44Å; F205-G208 PolarHBondContact O-N 3.05Å; F205-C209 VanDerWaalsContact O-CB 3.26Å; F205-C209 WeakPolarHBondContact O-CB 3.35Å; F205-C209 PolarHBondContact O-N 3.45Å; F205-I232 HydrophobicContact CD1-CG2 4.36Å; F205-I232 HydrophobicContact CE1-CG2 4.26Å; F205-V277 HydrophobicContact CB-CG1 3.24Å; F205-V277 HydrophobicContact CD1-CG1 4.45Å; F205-V277 HydrophobicContact CD2-CG1 4.03Å; F205-V277 HydrophobicContact CG-CG1 3.67Å; F205-I280 HydrophobicContact CD2-CG2 4.33Å; F205-I280 HydrophobicContact CE2-CB 4.18Å; F205-I280 HydrophobicContact CE2-CG2 3.67Å; F205-F284 HydrophobicContact CD2-CE2 4.14Å; F205-F284 AromaticContact CE2-CE2 3.65Å; F205-F284 HydrophobicContact CE2-CE2 3.65Å; F205-F284 HydrophobicContact CE2-CZ 4.3Å; F205-F284 HydrophobicContact CZ-CE2 4.47Å |
| 206 | V | 91.1 | Very high | 88.9 | Confident | 1 Ų | 1 | 21.1 Ų | 21.1 | 1% | 0.006 | 12% | 0.116 | C | C | . | . | H | α-helix | trans | -57.5 | -43.3 | 175 | 164.4 | 0 | 0 | 0 | 0 | 110.5 | I153 F202 W203 Y210 F229 I232 | I153-V206 HydrophobicContact CG1-CG1 4.48Å; I153-V206 HydrophobicContact CG2-CG1 4.16Å; F202-V206 WeakPolarHBondContact O-CG2 3.42Å; F202-V206 PolarHBondContact O-N 3.31Å; W203-V206 HydrophobicContact CE3-CB 4.22Å; W203-V206 HydrophobicContact CE3-CG1 4.01Å; W203-V206 HydrophobicContact CZ3-CG1 3.84Å; W203-V206 PolarHBondContact O-N 3.4Å; V206-Y210 VanDerWaalsContact O-CB 3.28Å; V206-Y210 WeakPolarHBondContact O-CB 3.32Å; V206-Y210 PolarHBondContact O-N 3.05Å; V206-F229 HydrophobicContact CG1-CB 3.87Å; V206-F229 HydrophobicContact CG1-CD1 3.81Å; V206-F229 HydrophobicContact CG1-CG 4.17Å; V206-I232 HydrophobicContact CG2-CB 4.02Å; V206-I232 HydrophobicContact CG2-CG2 3.56Å |
| 207 | E | 88.1 | Confident | 88.2 | Confident | 13 Ų | 13 | 24.6 Ų | 24.6 | 6% | 0.061 | 13% | 0.134 | C | C | . | . | H | α-helix | trans | -63.2 | -47.6 | 175.1 | -176.3 | 177 | -118.9 | 0 | 0 | 112.3 | I153 H154 L157 W203 F205 C209 Y210 L211 Y361 | I153-E207 HydrophobicContact CG2-CB 4.03Å; I153-E207 HydrophobicContact CG2-CG 4.44Å; H154-E207 IonicContact CE1-OE1 3.6Å; H154-E207 PolarHBondContact CE1-OE1 2.9Å; H154-E207 IonicContact CG-OE1 3.37Å; H154-E207 IonicContact ND1-OE1 3.86Å; H154-E207 PolarHBondContact ND1-OE1 3.08Å; L157-E207 HydrophobicContact CD2-CB 4.49Å; L157-E207 WeakPolarHBondContact CD2-OE1 3.35Å; L157-E207 WeakPolarHBondContact CD2-OE2 3.16Å; W203-E207 WeakPolarHBondContact O-CB 3.29Å; W203-E207 PolarHBondContact O-N 3.45Å; F205-E207 VanDerWaalsContact C-N 3.25Å; F205-E207 PolarHBondContact O-N 3.44Å; E207-C209 PolarHBondContact O-N 3.42Å; E207-Y210 PolarHBondContact O-N 3.17Å; E207-L211 WeakPolarHBondContact O-CB 3.28Å; E207-L211 PolarHBondContact O-N 3.42Å; E207-Y361 VanDerWaalsContact CD-CZ 3.44Å; E207-Y361 PolarHBondContact OE1-OH 2.94Å; E207-Y361 PolarHBondContact OE2-OH 3.11Å |
| 208 | G | 87.1 | Confident | 87.3 | Confident | 9 Ų | 9 | 29 Ų | 29 | 9% | 0.093 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -60.4 | -44.8 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | M204 F205 L211 H212 | M204-G208 PolarHBondContact O-N 2.97Å; F205-G208 PolarHBondContact O-N 3.05Å; G208-L211 PolarHBondContact O-N 2.92Å; G208-H212 WeakPolarHBondContact O-CB 3.44Å; G208-H212 PolarHBondContact O-N 3.24Å |
| 209 | C | 88.3 | Confident | 86.1 | Confident | 31 Ų | 31 | 38.3 Ų | 38.3 | 21% | 0.209 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -62.8 | -44 | 176.4 | -177.5 | 0 | 0 | 0 | 0 | 111.8 | F205 E207 T213 F284 | F205-C209 VanDerWaalsContact O-CB 3.26Å; F205-C209 WeakPolarHBondContact O-CB 3.35Å; F205-C209 PolarHBondContact O-N 3.45Å; E207-C209 PolarHBondContact O-N 3.42Å; C209-T213 VanDerWaalsContact O-CB 3.32Å; C209-T213 WeakPolarHBondContact O-CB 3.43Å; C209-T213 PolarHBondContact O-N 3.38Å; C209-T213 PolarHBondContact O-OG1 3.4Å; C209-F284 HydrophobicContact CB-CD2 4.47Å; C209-F284 HydrophobicContact CB-CE2 3.82Å |
| 210 | Y | 87.7 | Confident | 84.8 | Confident | 34 Ų | 34 | 40.3 Ų | 40.3 | 13% | 0.133 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -61.3 | -48.2 | 175.9 | 172.8 | -102.5 | 0 | 0 | 0 | 111.6 | L149 R150 I153 V206 E207 T213 A214 F229 | L149-Y210 HydrophobicContact CD2-CD2 4.38Å; L149-Y210 HydrophobicContact CD2-CE2 3.76Å; L149-Y210 HydrophobicContact CG-CE2 4.05Å; R150-Y210 HydrophobicContact CB-CE1 3.73Å; R150-Y210 HydrophobicContact CG-CE1 3.98Å; I153-Y210 HydrophobicContact CD1-CD1 3.91Å; I153-Y210 HydrophobicContact CD1-CD2 3.63Å; I153-Y210 HydrophobicContact CD1-CE1 4.48Å; I153-Y210 HydrophobicContact CD1-CE2 4.25Å; I153-Y210 HydrophobicContact CD1-CG 3.45Å; I153-Y210 VanDerWaalsContact CD1-CG 3.45Å; V206-Y210 VanDerWaalsContact O-CB 3.28Å; V206-Y210 WeakPolarHBondContact O-CB 3.32Å; V206-Y210 PolarHBondContact O-N 3.05Å; E207-Y210 PolarHBondContact O-N 3.17Å; Y210-T213 PolarHBondContact O-N 3Å; Y210-A214 WeakPolarHBondContact O-CB 3.36Å; Y210-A214 PolarHBondContact O-N 3.19Å; Y210-F229 HydrophobicContact CD2-CZ 4.44Å |
| 211 | L | 85.1 | Confident | 83.7 | Confident | 57 Ų | 57 | 41.4 Ų | 41.4 | 30% | 0.298 | 22% | 0.218 | S | C | . | . | H | α-helix | trans | -63.5 | -44.9 | 179.9 | -176.6 | 62.4 | 0 | 0 | 0 | 111.7 | E207 G208 T213 A214 I215 I288 L318 | E207-L211 WeakPolarHBondContact O-CB 3.28Å; E207-L211 PolarHBondContact O-N 3.42Å; G208-L211 PolarHBondContact O-N 2.92Å; L211-T213 VanDerWaalsContact C-N 3.35Å; L211-T213 PolarHBondContact O-N 3.32Å; L211-A214 PolarHBondContact O-N 3Å; L211-I215 HydrophobicContact CD1-CD1 3.9Å; L211-I215 HydrophobicContact CD1-CG1 4.39Å; L211-I215 HydrophobicContact CG-CD1 3.97Å; L211-I215 WeakPolarHBondContact O-CG1 3.41Å; L211-I215 PolarHBondContact O-N 3.38Å; L211-I288 HydrophobicContact CB-CD1 4.23Å; L211-I288 HydrophobicContact CD2-CD1 3.98Å; L211-I288 HydrophobicContact CD2-CG2 4.47Å; L211-I288 HydrophobicContact CG-CD1 3.96Å; L211-L318 HydrophobicContact CD2-CD2 4.27Å |
| 212 | H | 85.3 | Confident | 82.6 | Confident | 36 Ų | 36 | 48.3 Ų | 48.3 | 17% | 0.167 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -58.2 | -48.3 | 175.8 | 179.2 | -94.1 | 0 | 0 | 0 | 111.1 | G208 A214 I215 V216 F284 I288 | G208-H212 WeakPolarHBondContact O-CB 3.44Å; G208-H212 PolarHBondContact O-N 3.24Å; H212-A214 PolarHBondContact O-N 3.04Å; H212-I215 PolarHBondContact O-N 3.17Å; H212-V216 WeakPolarHBondContact O-CB 3.3Å; H212-V216 WeakPolarHBondContact O-CG2 3.3Å; H212-V216 PolarHBondContact O-N 2.85Å; H212-F284 HydrophobicContact CB-CB 4.33Å; H212-F284 HydrophobicContact CB-CD1 4.32Å; H212-F284 HydrophobicContact CB-CG 4.24Å; H212-F284 AromaticContact CG-CD1 3.96Å; H212-I288 HydrophobicContact CB-CD1 4.04Å; H212-I288 HydrophobicContact CB-CG1 4.19Å |
| 213 | T | 86.3 | Confident | 81.5 | Confident | 21 Ų | 21 | 55.6 Ų | 55.6 | 13% | 0.129 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -64 | -41.8 | 179.6 | -56.8 | 0 | 0 | 0 | 0 | 111.9 | C209 Y210 L211 I215 V216 M217 L224 | C209-T213 VanDerWaalsContact O-CB 3.32Å; C209-T213 WeakPolarHBondContact O-CB 3.43Å; C209-T213 PolarHBondContact O-N 3.38Å; C209-T213 PolarHBondContact O-OG1 3.4Å; Y210-T213 PolarHBondContact O-N 3Å; L211-T213 VanDerWaalsContact C-N 3.35Å; L211-T213 PolarHBondContact O-N 3.32Å; T213-I215 VanDerWaalsContact C-N 3.31Å; T213-I215 PolarHBondContact O-N 3.44Å; T213-V216 PolarHBondContact O-N 3.14Å; T213-M217 HydrophobicContact CG2-CB 4.48Å; T213-M217 HydrophobicContact CG2-CE 3.86Å; T213-M217 CarbonylContact O-C 3.57Å; T213-M217 WeakPolarHBondContact O-CA 3.19Å; T213-M217 PolarHBondContact O-N 3.37Å; T213-L224 HydrophobicContact CG2-CD1 3.94Å |
| 214 | A | 84.9 | Confident | 80.7 | Confident | 26 Ų | 26 | 58.3 Ų | 58.3 | 22% | 0.215 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -64.2 | -34.9 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | Y210 L211 H212 T218 T221 | Y210-A214 WeakPolarHBondContact O-CB 3.36Å; Y210-A214 PolarHBondContact O-N 3.19Å; L211-A214 PolarHBondContact O-N 3Å; H212-A214 PolarHBondContact O-N 3.04Å; A214-T218 VanDerWaalsContact O-CG2 3.26Å; A214-T218 WeakPolarHBondContact O-CG2 3.31Å; A214-T221 HydrophobicContact CB-CG2 3.93Å |
| 215 | I | 82.9 | Confident | 80.5 | Confident | 45 Ų | 45 | 67.5 Ų | 67.5 | 23% | 0.231 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -77.7 | -40.6 | 179.3 | -70 | 171.9 | 0 | 0 | 0 | 111.8 | L211 H212 T213 I288 I291 | L211-I215 HydrophobicContact CD1-CD1 3.9Å; L211-I215 HydrophobicContact CD1-CG1 4.39Å; L211-I215 HydrophobicContact CG-CD1 3.97Å; L211-I215 WeakPolarHBondContact O-CG1 3.41Å; L211-I215 PolarHBondContact O-N 3.38Å; H212-I215 PolarHBondContact O-N 3.17Å; T213-I215 VanDerWaalsContact C-N 3.31Å; T213-I215 PolarHBondContact O-N 3.44Å; I215-I288 HydrophobicContact CD1-CB 4.5Å; I215-I288 HydrophobicContact CD1-CG1 4.26Å; I215-I288 HydrophobicContact CD1-CG2 3.72Å; I215-I291 HydrophobicContact CG2-CB 4.1Å; I215-I291 HydrophobicContact CG2-CD1 4.21Å; I215-I291 HydrophobicContact CG2-CG2 3.55Å |
| 216 | V | 85.3 | Confident | 80.2 | Confident | 74 Ų | 74 | 71.4 Ų | 71.4 | 45% | 0.448 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -81.4 | -44.6 | -177.1 | 176.3 | 0 | 0 | 0 | 0 | 111.8 | H212 T213 I291 | H212-V216 WeakPolarHBondContact O-CB 3.3Å; H212-V216 WeakPolarHBondContact O-CG2 3.3Å; H212-V216 PolarHBondContact O-N 2.85Å; T213-V216 PolarHBondContact O-N 3.14Å; V216-I291 HydrophobicContact CG2-CD1 3.58Å |
| 217 | M | 78.9 | Confident | 80 | Confident | 98 Ų | 98 | 80.6 Ų | 80.6 | 48% | 0.483 | 39% | 0.386 | S | S | . | . | trans | -118.9 | 60.6 | -172.3 | -61.7 | -160.7 | -73.2 | 0 | 0 | 111.3 | T213 Y219 S220 | T213-M217 HydrophobicContact CG2-CB 4.48Å; T213-M217 HydrophobicContact CG2-CE 3.86Å; T213-M217 CarbonylContact O-C 3.57Å; T213-M217 WeakPolarHBondContact O-CA 3.19Å; T213-M217 PolarHBondContact O-N 3.37Å; M217-Y219 PolarHBondContact O-N 3.45Å; M217-S220 PolarHBondContact O-N 2.99Å | ||
| 218 | T | 70.9 | Confident | 80.1 | Confident | 100 Ų | 100 | 83.7 Ų | 83.7 | 61% | 0.613 | 41% | 0.406 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -51.6 | -20.7 | -175.2 | 45.5 | 0 | 0 | 0 | 0 | 115.5 | A214 | A214-T218 VanDerWaalsContact O-CG2 3.26Å; A214-T218 WeakPolarHBondContact O-CG2 3.31Å |
| 219 | Y | 66.1 | Low | 80.2 | Confident | 197 Ų | 197 | 84 Ų | 84 | 77% | 0.773 | 41% | 0.405 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -98.8 | -13.5 | 178.7 | -168.5 | -103.1 | 0 | 0 | 0 | 114.2 | M217 | M217-Y219 PolarHBondContact O-N 3.45Š|
| 220 | S | 67.9 | Low | 80.3 | Confident | 42 Ų | 42 | 84.8 Ų | 84.8 | 29% | 0.294 | 41% | 0.407 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -94.8 | -10.6 | -173.9 | -166.7 | 0 | 0 | 0 | 0 | 114 | M217 D222 K223 | M217-S220 PolarHBondContact O-N 2.99Å; S220-D222 VanDerWaalsContact C-N 3.27Å; S220-D222 PolarHBondContact O-N 3.48Å; S220-K223 PolarHBondContact O-N 3.43Å |
| 221 | T | 69.3 | Low | 80.5 | Confident | 23 Ų | 23 | 89.1 Ų | 89.1 | 14% | 0.141 | 43% | 0.427 | C | S | . | . | G | 310 helix | trans | -65.5 | -28.8 | -176 | 47.4 | 0 | 0 | 0 | 0 | 113.5 | A214 K223 L224 | A214-T221 HydrophobicContact CB-CG2 3.93Å; T221-K223 PolarHBondContact O-N 2.99Å; T221-L224 HydrophobicContact CG2-CD1 4.5Å; T221-L224 WeakPolarHBondContact O-CB 3.47Å; T221-L224 PolarHBondContact O-N 3.3Å |
| 222 | D | 67.1 | Low | 80.9 | Confident | 148 Ų | 148 | 88.3 Ų | 88.3 | 79% | 0.791 | 42% | 0.422 | S | S | * | . | G | 310 helix | trans | -72.4 | -20.8 | -179.4 | -64.2 | -26.1 | 0 | 0 | 0 | 112.8 | S220 | S220-D222 VanDerWaalsContact C-N 3.27Å; S220-D222 PolarHBondContact O-N 3.48Å |
| 223 | K | 69.7 | Low | 81.3 | Confident | 165 Ų | 165 | 86.6 Ų | 86.6 | 72% | 0.717 | 41% | 0.414 | S | S | * | . | G | 310 helix | trans | -83.9 | -11.5 | 175.6 | -62.2 | -173.1 | -179.8 | -179.2 | 0 | 112.8 | S220 T221 R225 | S220-K223 PolarHBondContact O-N 3.43Å; T221-K223 PolarHBondContact O-N 2.99Å; K223-R225 PolarHBondContact O-N 3.5Å |
| 224 | L | 75.8 | Confident | 81.6 | Confident | 59 Ų | 59 | 88.2 Ų | 88.2 | 31% | 0.309 | 42% | 0.418 | S | S | . | . | S | Bend | trans | -77.4 | 119.5 | -176.7 | -62.7 | 173.6 | 0 | 0 | 0 | 110.7 | T213 T221 K226 F229 | T213-L224 HydrophobicContact CG2-CD1 3.94Å; T221-L224 HydrophobicContact CG2-CD1 4.5Å; T221-L224 WeakPolarHBondContact O-CB 3.47Å; T221-L224 PolarHBondContact O-N 3.3Å; L224-K226 PolarHBondContact O-N 2.99Å; L224-F229 HydrophobicContact CB-CE2 4.01Å; L224-F229 HydrophobicContact CB-CZ 4.49Å; L224-F229 HydrophobicContact CD1-CE2 4.27Å; L224-F229 HydrophobicContact CD1-CZ 4.02Å |
| 225 | R | 83.1 | Confident | 82 | Confident | 203 Ų | 203 | 89.7 Ų | 89.7 | 77% | 0.766 | 43% | 0.426 | S | S | * | . | trans | -73 | 117 | 178.5 | -66.9 | -179.3 | -178.5 | -178.7 | 0.8 | 109.9 | K223 W227 V228 | K223-R225 PolarHBondContact O-N 3.5Å; R225-W227 PolarHBondContact O-N 3.38Å; R225-V228 HydrophobicContact CB-CG2 4.15Å; R225-V228 WeakPolarHBondContact O-CB 3.49Å; R225-V228 PolarHBondContact O-N 3.47Å | ||
| 226 | K | 83.4 | Confident | 82.5 | Confident | 118 Ų | 118 | 90.3 Ų | 90.3 | 51% | 0.513 | 43% | 0.429 | S | S | . | . | H | α-helix | trans | -47.2 | -36.5 | 176.1 | 64.3 | -176.4 | 176.9 | -179.7 | 0 | 114.2 | L149 L224 V228 F229 L230 | L149-K226 HydrophobicContact CD1-CB 3.71Å; L224-K226 PolarHBondContact O-N 2.99Å; K226-V228 VanDerWaalsContact C-N 3.26Å; K226-V228 PolarHBondContact O-N 3.39Å; K226-F229 PolarHBondContact O-N 3.46Å; K226-L230 WeakPolarHBondContact O-CD1 3.26Å; K226-L230 PolarHBondContact O-N 3Å |
| 227 | W | 86.8 | Confident | 83 | Confident | 193 Ų | 193 | 86.8 Ų | 86.8 | 73% | 0.731 | 41% | 0.408 | S | S | * | . | H | α-helix | trans | -59.6 | -31.6 | 179.5 | -88.4 | 110.6 | 0 | 0 | 0 | 113.8 | R225 L230 F231 | R225-W227 PolarHBondContact O-N 3.38Å; W227-L230 PolarHBondContact O-N 3.3Å; W227-F231 WeakPolarHBondContact O-CB 3.39Å; W227-F231 PolarHBondContact O-N 3.28Å |
| 228 | V | 90.1 | Very high | 83.7 | Confident | 79 Ų | 79 | 84.3 Ų | 84.3 | 48% | 0.479 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -64.5 | -44.6 | 179.1 | 176.3 | 0 | 0 | 0 | 0 | 110.5 | R225 K226 L230 F231 I232 | R225-V228 HydrophobicContact CB-CG2 4.15Å; R225-V228 WeakPolarHBondContact O-CB 3.49Å; R225-V228 PolarHBondContact O-N 3.47Å; K226-V228 VanDerWaalsContact C-N 3.26Å; K226-V228 PolarHBondContact O-N 3.39Å; V228-L230 PolarHBondContact O-N 3.01Å; V228-F231 PolarHBondContact O-N 3.23Å; V228-I232 HydrophobicContact CG1-CD1 3.91Å; V228-I232 VanDerWaalsContact O-CG1 3.31Å; V228-I232 WeakPolarHBondContact O-CG1 3.31Å; V228-I232 PolarHBondContact O-N 3.5Å |
| 229 | F | 89.9 | Confident | 84.8 | Confident | 15 Ų | 15 | 83.2 Ų | 83.2 | 7% | 0.066 | 39% | 0.394 | C | S | . | . | H | α-helix | trans | -65.9 | -38.6 | 177.9 | -65.8 | -62.6 | 0 | 0 | 0 | 112.7 | L149 I153 V206 Y210 L224 K226 F231 I232 G233 | L149-F229 HydrophobicContact CD1-CD2 4.49Å; L149-F229 HydrophobicContact CD2-CE2 4.46Å; I153-F229 HydrophobicContact CD1-CD2 4.49Å; V206-F229 HydrophobicContact CG1-CB 3.87Å; V206-F229 HydrophobicContact CG1-CD1 3.81Å; V206-F229 HydrophobicContact CG1-CG 4.17Å; Y210-F229 HydrophobicContact CD2-CZ 4.44Å; L224-F229 HydrophobicContact CB-CE2 4.01Å; L224-F229 HydrophobicContact CB-CZ 4.49Å; L224-F229 HydrophobicContact CD1-CE2 4.27Å; L224-F229 HydrophobicContact CD1-CZ 4.02Å; K226-F229 PolarHBondContact O-N 3.46Å; F229-F231 VanDerWaalsContact C-N 3.33Å; F229-I232 PolarHBondContact O-N 3.25Å; F229-G233 PolarHBondContact O-N 3.46Å |
| 230 | L | 90.2 | Very high | 86.1 | Confident | 47 Ų | 47 | 75.1 Ų | 75.1 | 25% | 0.246 | 36% | 0.364 | C | S | . | . | H | α-helix | trans | -63.9 | -40.6 | 175.2 | -86.3 | 79.4 | 0 | 0 | 0 | 111.5 | I152 W203 K226 W227 V228 G233 W234 | I152-L230 HydrophobicContact CG2-CD1 4.26Å; W203-L230 HydrophobicContact CH2-CG 4.39Å; K226-L230 WeakPolarHBondContact O-CD1 3.26Å; K226-L230 PolarHBondContact O-N 3Å; W227-L230 PolarHBondContact O-N 3.3Å; V228-L230 PolarHBondContact O-N 3.01Å; L230-G233 PolarHBondContact O-N 2.91Å; L230-W234 PolarHBondContact O-N 3.35Å |
| 231 | F | 92.6 | Very high | 87.3 | Confident | 125 Ų | 125 | 73.3 Ų | 73.3 | 55% | 0.548 | 35% | 0.351 | S | S | . | . | H | α-helix | trans | -64.4 | -45.3 | 176.8 | -176.9 | -95.8 | 0 | 0 | 0 | 111.7 | W227 V228 F229 G233 C235 I236 | W227-F231 WeakPolarHBondContact O-CB 3.39Å; W227-F231 PolarHBondContact O-N 3.28Å; V228-F231 PolarHBondContact O-N 3.23Å; F229-F231 VanDerWaalsContact C-N 3.33Å; F231-G233 VanDerWaalsContact C-N 3.34Å; F231-G233 PolarHBondContact O-N 3.03Å; F231-C235 HydrophobicContact CD2-CB 3.55Å; F231-C235 VanDerWaalsContact CD2-SG 3.55Å; F231-C235 HydrophobicContact CE2-CB 3.56Å; F231-C235 HydrophobicContact CG-CB 4.08Å; F231-C235 HydrophobicContact CZ-CB 4.1Å; F231-C235 WeakPolarHBondContact O-CA 3.16Å; F231-C235 VanDerWaalsContact O-CB 3.22Å; F231-C235 WeakPolarHBondContact O-CB 3.43Å; F231-C235 PolarHBondContact O-N 2.93Å; F231-I236 HydrophobicContact CE1-CG1 4.46Å; F231-I236 PolarHBondContact O-N 2.9Å |
| 232 | I | 92.9 | Very high | 88.4 | Confident | 40 Ų | 40 | 76.9 Ų | 76.9 | 21% | 0.205 | 37% | 0.368 | C | S | . | . | H | α-helix | trans | -60.9 | -45.1 | 177.5 | -67.3 | 166.5 | 0 | 0 | 0 | 111 | F202 F205 V206 V228 F229 I236 | F202-I232 HydrophobicContact CD1-CG2 4.49Å; F205-I232 HydrophobicContact CD1-CG2 4.36Å; F205-I232 HydrophobicContact CE1-CG2 4.26Å; V206-I232 HydrophobicContact CG2-CB 4.02Å; V206-I232 HydrophobicContact CG2-CG2 3.56Å; V228-I232 HydrophobicContact CG1-CD1 3.91Å; V228-I232 VanDerWaalsContact O-CG1 3.31Å; V228-I232 WeakPolarHBondContact O-CG1 3.31Å; V228-I232 PolarHBondContact O-N 3.5Å; F229-I232 PolarHBondContact O-N 3.25Å; I232-I236 HydrophobicContact CB-CD1 4.15Å; I232-I236 HydrophobicContact CG1-CD1 4.07Å; I232-I236 HydrophobicContact CG2-CD1 4.08Å |
| 233 | G | 92.3 | Very high | 89.6 | Confident | 0 Ų | 0 | 72.1 Ų | 72.1 | 0% | 0 | 35% | 0.35 | C | S | . | . | H | α-helix | trans | -70.6 | -41.7 | -175.9 | 0 | 0 | 0 | 0 | 0 | 114.1 | W203 F229 L230 F231 P237 | W203-G233 PolarHBondContact NE1-O 2.53Å; F229-G233 PolarHBondContact O-N 3.46Å; L230-G233 PolarHBondContact O-N 2.91Å; F231-G233 VanDerWaalsContact C-N 3.34Å; F231-G233 PolarHBondContact O-N 3.03Å; G233-P237 WeakPolarHBondContact O-CG 3.47Å |
| 234 | W | 94.3 | Very high | 90.6 | Very high | 56 Ų | 56 | 64.5 Ų | 64.5 | 21% | 0.212 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -103.4 | -37.1 | -173.5 | -68.8 | 111.8 | 0 | 0 | 0 | 114.3 | N156 T160 L163 Y195 F196 T199 W203 L230 C238 | N156-W234 PolarHBondContact OD1-NE1 2.98Å; T160-W234 HydrophobicContact CG2-CH2 3.88Å; T160-W234 HydrophobicContact CG2-CZ2 4.14Å; T160-W234 HydrophobicContact CG2-CZ3 4.43Å; L163-W234 HydrophobicContact CD1-CH2 3.98Å; L163-W234 HydrophobicContact CD1-CZ3 4.49Å; Y195-W234 PolarHBondContact OH-O 3.27Å; F196-W234 HydrophobicContact CE1-CZ3 4.39Å; T199-W234 HydrophobicContact CG2-CD2 4.31Å; T199-W234 HydrophobicContact CG2-CE3 3.6Å; T199-W234 HydrophobicContact CG2-CH2 4.39Å; T199-W234 HydrophobicContact CG2-CZ3 3.66Å; W203-W234 AromaticContact CE2-CD1 3.91Å; W203-W234 AromaticContact CE2-NE1 3.61Å; W203-W234 AromaticContact CZ2-CD1 3.43Å; W203-W234 VanDerWaalsContact CZ2-CD1 3.43Å; W203-W234 HydrophobicContact CZ2-CG 4.31Å; W203-W234 AromaticContact CZ2-NE1 3.25Å; W203-W234 VanDerWaalsContact CZ2-NE1 3.25Å; W203-W234 AromaticContact NE1-CD1 3.77Å; W203-W234 AromaticContact NE1-CD2 3.71Å; W203-W234 AromaticContact NE1-CE2 3.48Å; W203-W234 AromaticContact NE1-CG 3.88Å; W203-W234 AromaticContact NE1-NE1 3.52Å; L230-W234 PolarHBondContact O-N 3.35Å; W234-C238 PolarHBondContact O-SG 2.78Å |
| 235 | C | 93.3 | Very high | 91.2 | Very high | 57 Ų | 57 | 62.3 Ų | 62.3 | 39% | 0.385 | 31% | 0.307 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -88.3 | -32.3 | -169.8 | -57.4 | 0 | 0 | 0 | 0 | 113.2 | F231 P239 | F231-C235 HydrophobicContact CD2-CB 3.55Å; F231-C235 VanDerWaalsContact CD2-SG 3.55Å; F231-C235 HydrophobicContact CE2-CB 3.56Å; F231-C235 HydrophobicContact CG-CB 4.08Å; F231-C235 HydrophobicContact CZ-CB 4.1Å; F231-C235 WeakPolarHBondContact O-CA 3.16Å; F231-C235 VanDerWaalsContact O-CB 3.22Å; F231-C235 WeakPolarHBondContact O-CB 3.43Å; F231-C235 PolarHBondContact O-N 2.93Å; C235-P239 WeakPolarHBondContact O-CD 3.48Å |
| 236 | I | 93.4 | Very high | 91.5 | Very high | 58 Ų | 58 | 57.6 Ų | 57.6 | 30% | 0.297 | 30% | 0.296 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -68.9 | -38.5 | 179.3 | -59.7 | -179.6 | 0 | 0 | 0 | 113.2 | F202 F231 I232 C238 P239 I240 | F202-I236 HydrophobicContact CD1-CB 4.31Å; F202-I236 HydrophobicContact CD1-CG2 4.22Å; F202-I236 HydrophobicContact CE1-CB 4.01Å; F202-I236 HydrophobicContact CE1-CG2 3.43Å; F202-I236 VanDerWaalsContact CE1-CG2 3.43Å; F202-I236 HydrophobicContact CZ-CG2 3.73Å; F231-I236 HydrophobicContact CE1-CG1 4.46Å; F231-I236 PolarHBondContact O-N 2.9Å; I232-I236 HydrophobicContact CB-CD1 4.15Å; I232-I236 HydrophobicContact CG1-CD1 4.07Å; I232-I236 HydrophobicContact CG2-CD1 4.08Å; I236-C238 VanDerWaalsContact C-N 3.31Å; I236-C238 PolarHBondContact O-N 3.15Å; I236-P239 WeakPolarHBondContact O-CD 3.43Å; I236-P239 VanDerWaalsContact O-CG 3.3Å; I236-P239 WeakPolarHBondContact O-CG 3.5Å; I236-I240 HydrophobicContact CG2-CD1 4.15Å |
| 237 | P | 94.8 | Very high | 91.6 | Very high | 0 Ų | 0 | 52.5 Ų | 52.5 | 0% | 0 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -61.8 | -32.3 | 175.4 | -27.6 | 36.4 | 0 | 0 | 0 | 114.8 | Y195 V198 T199 F202 G233 I240 I241 | Y195-P237 HydrophobicContact CD2-CB 4.19Å; Y195-P237 HydrophobicContact CE2-CB 3.91Å; V198-P237 HydrophobicContact CB-CB 4.43Å; V198-P237 HydrophobicContact CG1-CB 3.89Å; V198-P237 HydrophobicContact CG1-CG 4.39Å; T199-P237 WeakPolarHBondContact OG1-CB 3.38Å; F202-P237 HydrophobicContact CB-CG 3.99Å; F202-P237 HydrophobicContact CD2-CG 3.82Å; F202-P237 HydrophobicContact CE2-CG 4.45Å; F202-P237 HydrophobicContact CG-CG 3.86Å; G233-P237 WeakPolarHBondContact O-CG 3.47Å; P237-I240 PolarHBondContact O-N 2.98Å; P237-I241 PolarHBondContact O-N 3.47Å; P237-I241 VanDerWaalsContact O-N 3.14Å |
| 238 | C | 93.9 | Very high | 91.5 | Very high | 46 Ų | 46 | 43.9 Ų | 43.9 | 31% | 0.311 | 24% | 0.244 | S | C | . | . | H | α-helix | trans | -54.8 | -59.3 | -178.3 | -71.7 | 0 | 0 | 0 | 0 | 113.6 | Y195 W234 I236 I240 I241 I242 | Y195-C238 HydrophobicContact CE2-CB 4.35Å; Y195-C238 WeakPolarHBondContact CE2-SG 3.09Å; W234-C238 PolarHBondContact O-SG 2.78Å; I236-C238 VanDerWaalsContact C-N 3.31Å; I236-C238 PolarHBondContact O-N 3.15Å; C238-I240 VanDerWaalsContact C-N 3.28Å; C238-I240 PolarHBondContact O-N 3.4Å; C238-I241 PolarHBondContact O-N 3.24Å; C238-I242 VanDerWaalsContact O-CG1 3.27Å; C238-I242 WeakPolarHBondContact O-CG1 2.97Å; C238-I242 PolarHBondContact O-N 3Å |
| 239 | P | 94.3 | Very high | 91.2 | Very high | 76 Ų | 76 | 44.2 Ų | 44.2 | 49% | 0.494 | 24% | 0.243 | S | C | . | . | H | α-helix | trans | -63.1 | -32.7 | -178.2 | 24.9 | -35.5 | 0 | 0 | 0 | 112.9 | C235 I236 I242 A243 | C235-P239 WeakPolarHBondContact O-CD 3.48Å; I236-P239 WeakPolarHBondContact O-CD 3.43Å; I236-P239 VanDerWaalsContact O-CG 3.3Å; I236-P239 WeakPolarHBondContact O-CG 3.5Å; P239-I242 PolarHBondContact O-N 3.32Å; P239-A243 WeakPolarHBondContact O-CB 3.21Å; P239-A243 PolarHBondContact O-N 2.92Å |
| 240 | I | 93.8 | Very high | 90.8 | Very high | 27 Ų | 27 | 52.9 Ų | 52.9 | 14% | 0.138 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -61.8 | -46.6 | 177.6 | -61.9 | 170.5 | 0 | 0 | 0 | 110.2 | F202 I236 P237 C238 W244 P273 | F202-I240 HydrophobicContact CE2-CD1 3.93Å; F202-I240 HydrophobicContact CZ-CD1 3.73Å; I236-I240 HydrophobicContact CG2-CD1 4.15Å; P237-I240 PolarHBondContact O-N 2.98Å; C238-I240 VanDerWaalsContact C-N 3.28Å; C238-I240 PolarHBondContact O-N 3.4Å; I240-W244 PolarHBondContact O-N 2.87Å; I240-W244 VanDerWaalsContact O-N 3.1Å; I240-P273 HydrophobicContact CD1-CB 3.91Å; I240-P273 HydrophobicContact CD1-CG 4.28Å; I240-P273 HydrophobicContact CG2-CG 4.24Å |
| 241 | I | 93.4 | Very high | 90.1 | Very high | 5 Ų | 5 | 58.4 Ų | 58.4 | 3% | 0.026 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -74.9 | -35.6 | -178.9 | -67.4 | -69.7 | 0 | 0 | 0 | 112.1 | T191 N194 V198 P237 C238 A243 W244 A245 Y270 | T191-I241 HydrophobicContact CG2-CG2 3.71Å; N194-I241 HydrophobicContact CB-CD1 3.97Å; V198-I241 HydrophobicContact CB-CD1 4.41Å; V198-I241 HydrophobicContact CB-CG1 4.46Å; V198-I241 HydrophobicContact CG2-CD1 3.74Å; V198-I241 HydrophobicContact CG2-CG1 4.29Å; P237-I241 PolarHBondContact O-N 3.47Å; P237-I241 VanDerWaalsContact O-N 3.14Å; C238-I241 PolarHBondContact O-N 3.24Å; I241-A243 VanDerWaalsContact C-N 3.33Å; I241-W244 PolarHBondContact O-N 3.21Å; I241-A245 WeakPolarHBondContact O-CB 3.25Å; I241-A245 PolarHBondContact O-N 2.95Å; I241-Y270 HydrophobicContact CD1-CG 4.39Å |
| 242 | I | 91.9 | Very high | 88.9 | Confident | 98 Ų | 98 | 54.6 Ų | 54.6 | 50% | 0.503 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -61.1 | -45.2 | 173.9 | -69.2 | 165.7 | 0 | 0 | 0 | 110 | C238 P239 W244 A245 I246 | C238-I242 VanDerWaalsContact O-CG1 3.27Å; C238-I242 WeakPolarHBondContact O-CG1 2.97Å; C238-I242 PolarHBondContact O-N 3Å; P239-I242 PolarHBondContact O-N 3.32Å; I242-W244 VanDerWaalsContact C-N 3.35Å; I242-W244 PolarHBondContact O-N 3.48Å; I242-A245 PolarHBondContact O-N 3.34Å; I242-I246 HydrophobicContact CG2-CD1 3.78Å; I242-I246 HydrophobicContact CG2-CG1 4.45Å; I242-I246 VanDerWaalsContact O-CG1 3.27Å; I242-I246 WeakPolarHBondContact O-CG1 3.39Å; I242-I246 PolarHBondContact O-N 3.02Å |
| 243 | A | 91.9 | Very high | 87.8 | Confident | 48 Ų | 48 | 57 Ų | 57 | 40% | 0.397 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -60.7 | -43.3 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | P239 I241 G247 I269 | P239-A243 WeakPolarHBondContact O-CB 3.21Å; P239-A243 PolarHBondContact O-N 2.92Å; I241-A243 VanDerWaalsContact C-N 3.33Å; A243-G247 PolarHBondContact O-N 3.4Å; A243-I269 HydrophobicContact CB-CG2 4.29Å |
| 244 | W | 90.5 | Very high | 86.4 | Confident | 4 Ų | 4 | 65.5 Ų | 65.5 | 2% | 0.015 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -63 | -44.7 | 174.7 | 171.3 | 78.9 | 0 | 0 | 0 | 112.6 | T190 N194 I240 I241 I242 I246 G247 K248 W257 D267 I269 Y270 | T190-W244 HydrophobicContact CG2-CH2 4.48Å; N194-W244 HydrophobicContact CB-CZ3 4.5Å; N194-W244 WeakPolarHBondContact ND2-CH2 3.41Å; I240-W244 PolarHBondContact O-N 2.87Å; I240-W244 VanDerWaalsContact O-N 3.1Å; I241-W244 PolarHBondContact O-N 3.21Å; I242-W244 VanDerWaalsContact C-N 3.35Å; I242-W244 PolarHBondContact O-N 3.48Å; W244-I246 PolarHBondContact O-N 2.94Å; W244-G247 PolarHBondContact O-N 2.7Å; W244-K248 HydrophobicContact CD2-CG 4.26Å; W244-K248 HydrophobicContact CH2-CG 4.39Å; W244-K248 HydrophobicContact CZ2-CD 4.38Å; W244-K248 HydrophobicContact CZ2-CG 3.79Å; W244-K248 PolarHBondContact O-N 3.09Å; W244-W257 HydrophobicContact CH2-CB 4.41Å; W244-W257 HydrophobicContact CH2-CD2 4.49Å; W244-W257 AromaticContact CH2-CE3 3.83Å; W244-W257 HydrophobicContact CH2-CE3 3.83Å; W244-W257 AromaticContact CZ3-CE3 3.98Å; W244-W257 HydrophobicContact CZ3-CE3 3.98Å; W244-W257 HydrophobicContact CZ3-CZ3 4.24Å; W244-D267 PolarHBondContact NE1-OD1 3.35Å; W244-I269 HydrophobicContact CB-CB 4.36Å; W244-I269 HydrophobicContact CB-CG2 4.08Å; W244-Y270 HydrophobicContact CB-CD1 4.41Å; W244-Y270 AromaticContact CD1-CD1 3.46Å; W244-Y270 VanDerWaalsContact CD1-CD1 3.46Å; W244-Y270 AromaticContact CD1-CE1 3.92Å; W244-Y270 HydrophobicContact CD2-CD1 4.12Å; W244-Y270 HydrophobicContact CD2-CE1 4.47Å; W244-Y270 AromaticContact CE2-CE1 3.96Å; W244-Y270 AromaticContact CG-CD1 3.73Å; W244-Y270 HydrophobicContact CG-CD1 3.73Å; W244-Y270 HydrophobicContact CG-CE1 4.42Å; W244-Y270 AromaticContact NE1-CD1 3.6Å; W244-Y270 AromaticContact NE1-CE1 3.56Å |
| 245 | A | 88.7 | Confident | 85.2 | Confident | 14 Ų | 14 | 70 Ų | 70 | 12% | 0.116 | 36% | 0.356 | C | S | . | . | H | α-helix | trans | -64 | -39.9 | 179.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | T191 I241 I242 K248 L249 W257 | T191-A245 HydrophobicContact CG2-CB 4.08Å; I241-A245 WeakPolarHBondContact O-CB 3.25Å; I241-A245 PolarHBondContact O-N 2.95Å; I242-A245 PolarHBondContact O-N 3.34Å; A245-K248 PolarHBondContact O-N 3.4Å; A245-L249 WeakPolarHBondContact O-CG 3.38Å; A245-L249 PolarHBondContact O-N 3.44Å; A245-W257 HydrophobicContact CB-CH2 4.37Å; A245-W257 HydrophobicContact CB-CZ3 4.15Å |
| 246 | I | 88.6 | Confident | 84.3 | Confident | 104 Ų | 104 | 68 Ų | 68 | 53% | 0.533 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -62.9 | -44.8 | 173.2 | -67.5 | 166.3 | 0 | 0 | 0 | 110.5 | I242 W244 K248 L249 Y250 | I242-I246 HydrophobicContact CG2-CD1 3.78Å; I242-I246 HydrophobicContact CG2-CG1 4.45Å; I242-I246 VanDerWaalsContact O-CG1 3.27Å; I242-I246 WeakPolarHBondContact O-CG1 3.39Å; I242-I246 PolarHBondContact O-N 3.02Å; W244-I246 PolarHBondContact O-N 2.94Å; I246-K248 PolarHBondContact O-N 3.21Å; I246-L249 PolarHBondContact O-N 2.89Å; I246-Y250 PolarHBondContact O-N 3.23Å; I246-Y250 VanDerWaalsContact O-N 3.16Å |
| 247 | G | 86.5 | Confident | 83.3 | Confident | 10 Ų | 10 | 66.6 Ų | 66.6 | 10% | 0.103 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -58.4 | -47.3 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | A243 W244 L249 Y250 Y251 | A243-G247 PolarHBondContact O-N 3.4Å; W244-G247 PolarHBondContact O-N 2.7Å; G247-L249 PolarHBondContact O-N 3.2Å; G247-Y250 PolarHBondContact O-N 3.01Å; G247-Y251 VanDerWaalsContact O-CD2 3.26Å; G247-Y251 WeakPolarHBondContact O-CD2 3.36Å; G247-Y251 PolarHBondContact O-N 3.33Å; G247-Y251 VanDerWaalsContact O-N 3.11Å |
| 248 | K | 83.8 | Confident | 81.7 | Confident | 13 Ų | 13 | 71 Ų | 71 | 6% | 0.057 | 35% | 0.352 | C | S | . | . | H | α-helix | trans | -62.9 | -39.5 | 177.3 | -79.6 | -74.3 | -177.7 | 171.9 | 0 | 112.8 | W244 A245 I246 Y250 E252 W257 I266 D267 | W244-K248 HydrophobicContact CD2-CG 4.26Å; W244-K248 HydrophobicContact CH2-CG 4.39Å; W244-K248 HydrophobicContact CZ2-CD 4.38Å; W244-K248 HydrophobicContact CZ2-CG 3.79Å; W244-K248 PolarHBondContact O-N 3.09Å; A245-K248 PolarHBondContact O-N 3.4Å; I246-K248 PolarHBondContact O-N 3.21Å; K248-Y250 VanDerWaalsContact C-N 3.28Å; K248-Y250 PolarHBondContact O-N 2.89Å; K248-E252 WeakPolarHBondContact CD-OE2 3.38Å; K248-E252 IonicContact NZ-OE2 3.85Å; K248-E252 PolarHBondContact NZ-OE2 2.88Å; K248-E252 CarbonylContact O-C 3.49Å; K248-E252 VanDerWaalsContact O-C 3.31Å; K248-E252 WeakPolarHBondContact O-CA 3.19Å; K248-E252 PolarHBondContact O-N 3.31Å; K248-E252 VanDerWaalsContact O-O 3.11Å; K248-W257 HydrophobicContact CB-CD2 3.95Å; K248-W257 HydrophobicContact CB-CE3 4.32Å; K248-W257 HydrophobicContact CB-CG 4.5Å; K248-W257 HydrophobicContact CB-CH2 4.09Å; K248-W257 HydrophobicContact CB-CZ2 3.68Å; K248-W257 HydrophobicContact CB-CZ3 4.37Å; K248-W257 HydrophobicContact CG-CD2 4.46Å; K248-I266 HydrophobicContact CD-CG2 4.07Å; K248-I266 HydrophobicContact CG-CG2 3.92Å; K248-D267 WeakPolarHBondContact CE-OD1 3.29Å; K248-D267 IonicContact NZ-OD1 3.63Å; K248-D267 PolarHBondContact NZ-OD1 3.01Å; K248-D267 IonicContact NZ-OD2 3.49Å |
| 249 | L | 83.4 | Confident | 80 | Confident | 85 Ų | 85 | 71.5 Ų | 71.5 | 45% | 0.445 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -61.4 | -35.3 | 175.3 | -75.3 | 166.6 | 0 | 0 | 0 | 113.1 | A245 I246 G247 W257 | A245-L249 WeakPolarHBondContact O-CG 3.38Å; A245-L249 PolarHBondContact O-N 3.44Å; I246-L249 PolarHBondContact O-N 2.89Å; G247-L249 PolarHBondContact O-N 3.2Å; L249-W257 HydrophobicContact CB-CZ2 4.44Å; L249-W257 HydrophobicContact CD1-CH2 4.43Å; L249-W257 HydrophobicContact CD2-CH2 3.88Å; L249-W257 HydrophobicContact CD2-CZ2 3.62Å; L249-W257 HydrophobicContact CG-CH2 3.67Å; L249-W257 HydrophobicContact CG-CZ2 3.66Å |
| 250 | Y | 82.6 | Confident | 78 | Confident | 197 Ų | 197 | 73.1 Ų | 73.1 | 77% | 0.773 | 36% | 0.364 | S | S | * | . | H | α-helix | trans | -82.4 | -37.7 | -175.3 | -160.4 | -96.2 | 0 | 0 | 0 | 113 | I246 G247 K248 | I246-Y250 PolarHBondContact O-N 3.23Å; I246-Y250 VanDerWaalsContact O-N 3.16Å; G247-Y250 PolarHBondContact O-N 3.01Å; K248-Y250 VanDerWaalsContact C-N 3.28Å; K248-Y250 PolarHBondContact O-N 2.89Å |
| 251 | Y | 75.3 | Confident | 76 | Confident | 163 Ų | 163 | 77.8 Ų | 77.8 | 64% | 0.639 | 39% | 0.385 | S | S | * | . | H | α-helix | trans | -98.5 | -24.4 | -174.2 | -67.4 | -75.4 | 0 | 0 | 0 | 114.1 | G247 I266 | G247-Y251 VanDerWaalsContact O-CD2 3.26Å; G247-Y251 WeakPolarHBondContact O-CD2 3.36Å; G247-Y251 PolarHBondContact O-N 3.33Å; G247-Y251 VanDerWaalsContact O-N 3.11Å; Y251-I266 HydrophobicContact CD2-CD1 3.52Å; Y251-I266 HydrophobicContact CD2-CG1 4.3Å; Y251-I266 HydrophobicContact CE2-CD1 3.95Å; Y251-I266 HydrophobicContact CG-CD1 4.07Å |
| 252 | E | 68.3 | Low | 73.6 | Confident | 46 Ų | 46 | 83.6 Ų | 83.6 | 22% | 0.215 | 42% | 0.423 | C | S | . | . | trans | -144.1 | 77.9 | -172.4 | -59.9 | -167.4 | 128.7 | 0 | 0 | 111.9 | K248 W257 K264 | K248-E252 WeakPolarHBondContact CD-OE2 3.38Å; K248-E252 IonicContact NZ-OE2 3.85Å; K248-E252 PolarHBondContact NZ-OE2 2.88Å; K248-E252 CarbonylContact O-C 3.49Å; K248-E252 VanDerWaalsContact O-C 3.31Å; K248-E252 WeakPolarHBondContact O-CA 3.19Å; K248-E252 PolarHBondContact O-N 3.31Å; K248-E252 VanDerWaalsContact O-O 3.11Å; E252-W257 PolarHBondContact O-NE1 3.36Å; E252-K264 WeakPolarHBondContact OE1-CD 3.45Å; E252-K264 WeakPolarHBondContact OE1-CE 3.34Å; E252-K264 IonicContact OE1-NZ 2.68Å; E252-K264 PolarHBondContact OE1-NZ 3.39Å | ||
| 253 | N | 68.6 | Low | 71.5 | Confident | 90 Ų | 90 | 82.4 Ų | 82.4 | 48% | 0.481 | 44% | 0.435 | S | S | . | . | trans | -102.4 | 15.6 | -173 | -166.4 | 44.2 | 0 | 0 | 0 | 114.6 | R187 | R187-N253 VanDerWaalsContact CZ-OD1 3.25Å; R187-N253 PolarHBondContact NH1-OD1 2.88Å; R187-N253 PolarHBondContact NH2-O 3.43Å; R187-N253 PolarHBondContact NH2-OD1 2.89Å | ||
| 254 | E | 62.6 | Low | 69.9 | Low | 179 Ų | 179 | 84.2 Ų | 84.2 | 84% | 0.836 | 43% | 0.434 | S | S | * | . | S | Bend | trans | -107.2 | -20.4 | -168 | -64.9 | -102.9 | 149.3 | 0 | 0 | 114.4 | E183 | E183-E254 VanDerWaalsContact OE1-C 3.31Š|
| 255 | Q | 68.9 | Low | 68.9 | Low | 151 Ų | 151 | 94.3 Ų | 94.3 | 71% | 0.706 | 47% | 0.473 | S | S | * | . | S | Bend | trans | -140.1 | 166.9 | 179.7 | -66.4 | -158.2 | -20.1 | 0 | 0 | 112 | E183 | E183-Q255 PolarHBondContact OE1-N 3.35Š|
| 256 | C | 74.5 | Confident | 68.3 | Low | 13 Ų | 13 | 95 Ų | 95 | 9% | 0.088 | 48% | 0.475 | C | S | . | . | trans | -60.3 | 141.2 | 168.5 | -176.2 | 0 | 0 | 0 | 0 | 110.6 | H179 C186 F258 | H179-C256 VanDerWaalsContact CD2-CB 3.46Å; H179-C256 WeakPolarHBondContact CD2-CB 3.34Å; H179-C256 VanDerWaalsContact NE2-CB 3.33Å; H179-C256 WeakPolarHBondContact NE2-CB 3.48Å; C186-C256 VanDerWaalsContact C-SG 3.53Å; C186-C256 HydrophobicContact CB-CB 3.72Å; C186-C256 WeakPolarHBondContact CB-SG 3.4Å; C186-C256 WeakPolarHBondContact SG-CB 3.41Å; C186-C256 CovalentContact SG-SG 2.01Å; C186-C256 PolarHBondContact SG-SG 3.39Å; C256-F258 PolarHBondContact O-N 3.3Å | ||
| 257 | W | 72.1 | Confident | 67.7 | Low | 29 Ų | 29 | 90.9 Ų | 90.9 | 11% | 0.11 | 45% | 0.454 | C | S | . | . | S | Bend | trans | -73.5 | 24.9 | -178.9 | -54 | -27.3 | 0 | 0 | 0 | 114 | R187 T190 T191 W244 A245 K248 L249 E252 | R187-W257 HydrophobicContact CB-CD2 4.35Å; R187-W257 HydrophobicContact CB-CE3 4.21Å; R187-W257 HydrophobicContact CB-CH2 4.46Å; R187-W257 HydrophobicContact CB-CZ3 4.28Å; R187-W257 HydrophobicContact CG-CD2 4.11Å; R187-W257 HydrophobicContact CG-CE3 4.48Å; R187-W257 HydrophobicContact CG-CG 4.49Å; R187-W257 HydrophobicContact CG-CZ2 4.35Å; T190-W257 HydrophobicContact CG2-CB 4Å; T190-W257 WeakPolarHBondContact CG2-O 3.44Å; T191-W257 VanDerWaalsContact OG1-CZ3 3.25Å; T191-W257 WeakPolarHBondContact OG1-CZ3 3.27Å; W244-W257 HydrophobicContact CH2-CB 4.41Å; W244-W257 HydrophobicContact CH2-CD2 4.49Å; W244-W257 AromaticContact CH2-CE3 3.83Å; W244-W257 HydrophobicContact CH2-CE3 3.83Å; W244-W257 AromaticContact CZ3-CE3 3.98Å; W244-W257 HydrophobicContact CZ3-CE3 3.98Å; W244-W257 HydrophobicContact CZ3-CZ3 4.24Å; A245-W257 HydrophobicContact CB-CH2 4.37Å; A245-W257 HydrophobicContact CB-CZ3 4.15Å; K248-W257 HydrophobicContact CB-CD2 3.95Å; K248-W257 HydrophobicContact CB-CE3 4.32Å; K248-W257 HydrophobicContact CB-CG 4.5Å; K248-W257 HydrophobicContact CB-CH2 4.09Å; K248-W257 HydrophobicContact CB-CZ2 3.68Å; K248-W257 HydrophobicContact CB-CZ3 4.37Å; K248-W257 HydrophobicContact CG-CD2 4.46Å; L249-W257 HydrophobicContact CB-CZ2 4.44Å; L249-W257 HydrophobicContact CD1-CH2 4.43Å; L249-W257 HydrophobicContact CD2-CH2 3.88Å; L249-W257 HydrophobicContact CD2-CZ2 3.62Å; L249-W257 HydrophobicContact CG-CH2 3.67Å; L249-W257 HydrophobicContact CG-CZ2 3.66Å; E252-W257 PolarHBondContact O-NE1 3.36Å |
| 258 | F | 62.5 | Low | 67.6 | Low | 94 Ų | 94 | 97.3 Ų | 97.3 | 41% | 0.412 | 48% | 0.476 | S | S | . | . | trans | -98.2 | 105.4 | -177.4 | -173.4 | -109.9 | 0 | 0 | 0 | 110.9 | L171 C256 | L171-F258 HydrophobicContact CD1-CD2 3.54Å; L171-F258 HydrophobicContact CD1-CE2 3.87Å; L171-F258 HydrophobicContact CD1-CG 4.21Å; L171-F258 HydrophobicContact CD2-CD2 3.57Å; L171-F258 HydrophobicContact CD2-CE2 3.27Å; L171-F258 HydrophobicContact CD2-CZ 4.35Å; L171-F258 HydrophobicContact CG-CD2 3.58Å; L171-F258 HydrophobicContact CG-CE2 3.33Å; L171-F258 HydrophobicContact CG-CZ 4.1Å; C256-F258 PolarHBondContact O-N 3.3Å | ||
| 259 | G | 56.9 | Low | 67.7 | Low | 55 Ų | 55 | 100 Ų | 100 | 57% | 0.567 | 49% | 0.49 | S | S | * | . | S | Bend | trans | 139.7 | 113.1 | -177.1 | 0 | 0 | 0 | 0 | 0 | 109.4 | E261 | G259-E261 PolarHBondContact O-N 3.35Å; G259-E261 VanDerWaalsContact O-N 3.16Å |
| 260 | K | 53 | Low | 67.9 | Low | 111 Ų | 111 | 96.7 Ų | 96.7 | 48% | 0.483 | 47% | 0.472 | S | S | . | . | trans | -82.4 | 88.4 | 173 | -68.1 | -173.5 | -176.9 | -177.6 | 0 | 107.6 | P262 | K260-P262 VanDerWaalsContact O-CD 3.29Å; K260-P262 WeakPolarHBondContact O-CD 3.17Å | ||
| 261 | E | 52.4 | Low | 68 | Low | 124 Ų | 124 | 89.2 Ų | 89.2 | 58% | 0.579 | 44% | 0.444 | S | S | * | . | trans | -70 | 115.7 | 162.1 | -68.8 | -175.1 | 153.3 | 0 | 0 | 107.7 | G259 G263 K264 | G259-E261 PolarHBondContact O-N 3.35Å; G259-E261 VanDerWaalsContact O-N 3.16Å; E261-G263 PolarHBondContact O-N 3.41Å; E261-K264 WeakPolarHBondContact OE2-CE 3.42Å; E261-K264 IonicContact OE2-NZ 3.73Å; E261-K264 PolarHBondContact OE2-NZ 3.43Å | ||
| 262 | P | 43 | Very low | 68.5 | Low | 128 Ų | 128 | 82.2 Ų | 82.2 | 83% | 0.831 | 42% | 0.421 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -65.7 | 120.6 | 179.8 | 26.2 | -31.3 | 0 | 0 | 0 | 109.3 | K260 | K260-P262 VanDerWaalsContact O-CD 3.29Å; K260-P262 WeakPolarHBondContact O-CD 3.17Å |
| 263 | G | 46.8 | Very low | 69.6 | Low | 72 Ų | 72 | 82 Ų | 82 | 74% | 0.742 | 42% | 0.424 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 129.5 | -0.4 | 167.5 | 0 | 0 | 0 | 0 | 0 | 117.7 | E261 | E261-G263 PolarHBondContact O-N 3.41Š|
| 264 | K | 59.7 | Low | 70.5 | Confident | 87 Ų | 87 | 78.1 Ų | 78.1 | 38% | 0.378 | 40% | 0.404 | S | S | . | . | trans | -91.5 | 123.3 | 177.8 | -62.6 | -170 | -179.8 | 157.5 | 0 | 112.2 | E252 E261 I266 D267 | E252-K264 WeakPolarHBondContact OE1-CD 3.45Å; E252-K264 WeakPolarHBondContact OE1-CE 3.34Å; E252-K264 IonicContact OE1-NZ 2.68Å; E252-K264 PolarHBondContact OE1-NZ 3.39Å; E261-K264 WeakPolarHBondContact OE2-CE 3.42Å; E261-K264 IonicContact OE2-NZ 3.73Å; E261-K264 PolarHBondContact OE2-NZ 3.43Å; K264-I266 PolarHBondContact O-N 3.19Å; K264-D267 PolarHBondContact O-N 2.95Å | ||
| 265 | Y | 68.6 | Low | 71.6 | Confident | 216 Ų | 216 | 71 Ų | 71 | 85% | 0.847 | 37% | 0.371 | S | S | * | . | G | 310 helix | trans | -52.9 | -26.1 | -176.1 | -63.2 | -80.7 | 0 | 0 | 0 | 114.8 | D267 Y268 | Y265-D267 VanDerWaalsContact C-N 3.34Å; Y265-D267 PolarHBondContact O-N 2.91Å; Y265-Y268 WeakPolarHBondContact O-CB 3.23Å; Y265-Y268 PolarHBondContact O-N 3.24Å |
| 266 | I | 76.2 | Confident | 72.6 | Confident | 29 Ų | 29 | 68.7 Ų | 68.7 | 15% | 0.149 | 36% | 0.363 | C | S | . | . | G | 310 helix | trans | -66.1 | -33.6 | -175.6 | -54.2 | -57.1 | 0 | 0 | 0 | 112.5 | K248 Y251 K264 Y268 I269 | K248-I266 HydrophobicContact CD-CG2 4.07Å; K248-I266 HydrophobicContact CG-CG2 3.92Å; Y251-I266 HydrophobicContact CD2-CD1 3.52Å; Y251-I266 HydrophobicContact CD2-CG1 4.3Å; Y251-I266 HydrophobicContact CE2-CD1 3.95Å; Y251-I266 HydrophobicContact CG-CD1 4.07Å; K264-I266 PolarHBondContact O-N 3.19Å; I266-Y268 PolarHBondContact O-N 3.18Å; I266-I269 HydrophobicContact CG2-CD1 4.25Å; I266-I269 WeakPolarHBondContact O-CB 3.38Å; I266-I269 VanDerWaalsContact O-CG1 3.32Å; I266-I269 WeakPolarHBondContact O-CG1 3.37Å; I266-I269 PolarHBondContact O-N 3Å |
| 267 | D | 76.6 | Confident | 73.3 | Confident | 16 Ų | 16 | 68.7 Ų | 68.7 | 9% | 0.086 | 36% | 0.362 | C | S | . | . | G | 310 helix | trans | -72.6 | -15.8 | -178.8 | -68.5 | -30.9 | 0 | 0 | 0 | 113 | W244 K248 K264 Y265 I269 Y270 Q271 | W244-D267 PolarHBondContact NE1-OD1 3.35Å; K248-D267 WeakPolarHBondContact CE-OD1 3.29Å; K248-D267 IonicContact NZ-OD1 3.63Å; K248-D267 PolarHBondContact NZ-OD1 3.01Å; K248-D267 IonicContact NZ-OD2 3.49Å; K264-D267 PolarHBondContact O-N 2.95Å; Y265-D267 VanDerWaalsContact C-N 3.34Å; Y265-D267 PolarHBondContact O-N 2.91Å; D267-I269 PolarHBondContact O-N 3.02Å; D267-Y270 HydrophobicContact CB-CE1 4.11Å; D267-Y270 WeakPolarHBondContact O-CD1 3.42Å; D267-Y270 WeakPolarHBondContact O-CE1 3.48Å; D267-Q271 WeakPolarHBondContact O-CB 3.37Å; D267-Q271 WeakPolarHBondContact O-CG 3.32Å; D267-Q271 PolarHBondContact O-N 3.27Å |
| 268 | Y | 83.6 | Confident | 73.9 | Confident | 146 Ų | 146 | 67.6 Ų | 67.6 | 57% | 0.573 | 36% | 0.359 | S | S | * | . | H | α-helix | trans | -66.1 | -22.3 | 175.2 | -162.9 | -102.6 | 0 | 0 | 0 | 112.9 | Y265 I266 Y270 Q271 G272 I275 | Y265-Y268 WeakPolarHBondContact O-CB 3.23Å; Y265-Y268 PolarHBondContact O-N 3.24Å; I266-Y268 PolarHBondContact O-N 3.18Å; Y268-Y270 VanDerWaalsContact C-N 3.34Å; Y268-Y270 PolarHBondContact O-N 2.97Å; Y268-Q271 PolarHBondContact O-N 3.11Å; Y268-G272 PolarHBondContact O-N 3.33Å; Y268-I275 HydrophobicContact CE2-CD1 4.43Å |
| 269 | I | 86.8 | Confident | 75 | Confident | 68 Ų | 68 | 67.4 Ų | 67.4 | 35% | 0.349 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -56.4 | -45.4 | -178.7 | -65.3 | 172.6 | 0 | 0 | 0 | 111.8 | A243 W244 I266 D267 P273 | A243-I269 HydrophobicContact CB-CG2 4.29Å; W244-I269 HydrophobicContact CB-CB 4.36Å; W244-I269 HydrophobicContact CB-CG2 4.08Å; I266-I269 HydrophobicContact CG2-CD1 4.25Å; I266-I269 WeakPolarHBondContact O-CB 3.38Å; I266-I269 VanDerWaalsContact O-CG1 3.32Å; I266-I269 WeakPolarHBondContact O-CG1 3.37Å; I266-I269 PolarHBondContact O-N 3Å; D267-I269 PolarHBondContact O-N 3.02Å; I269-P273 WeakPolarHBondContact O-CD 3.46Å |
| 270 | Y | 85.9 | Confident | 76.5 | Confident | 16 Ų | 16 | 67.5 Ų | 67.5 | 6% | 0.063 | 35% | 0.348 | C | S | . | . | H | α-helix | trans | -94.1 | -28.2 | 176.7 | 78.4 | -89.9 | 0 | 0 | 0 | 112.7 | V198 I241 W244 D267 Y268 V274 | V198-Y270 HydrophobicContact CG2-CD2 3.9Å; I241-Y270 HydrophobicContact CD1-CG 4.39Å; W244-Y270 HydrophobicContact CB-CD1 4.41Å; W244-Y270 AromaticContact CD1-CD1 3.46Å; W244-Y270 VanDerWaalsContact CD1-CD1 3.46Å; W244-Y270 AromaticContact CD1-CE1 3.92Å; W244-Y270 HydrophobicContact CD2-CD1 4.12Å; W244-Y270 HydrophobicContact CD2-CE1 4.47Å; W244-Y270 AromaticContact CE2-CE1 3.96Å; W244-Y270 AromaticContact CG-CD1 3.73Å; W244-Y270 HydrophobicContact CG-CD1 3.73Å; W244-Y270 HydrophobicContact CG-CE1 4.42Å; W244-Y270 AromaticContact NE1-CD1 3.6Å; W244-Y270 AromaticContact NE1-CE1 3.56Å; D267-Y270 HydrophobicContact CB-CE1 4.11Å; D267-Y270 WeakPolarHBondContact O-CD1 3.42Å; D267-Y270 WeakPolarHBondContact O-CE1 3.48Å; Y268-Y270 VanDerWaalsContact C-N 3.34Å; Y268-Y270 PolarHBondContact O-N 2.97Å; Y270-V274 WeakPolarHBondContact O-CG2 3.2Å; Y270-V274 PolarHBondContact O-N 3.36Å |
| 271 | Q | 85.3 | Confident | 78 | Confident | 41 Ų | 41 | 62.7 Ų | 62.7 | 19% | 0.192 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -67.2 | -42.1 | 179.7 | -70.2 | 176.1 | 6.1 | 0 | 0 | 112.1 | D267 Y268 V274 I275 | D267-Q271 WeakPolarHBondContact O-CB 3.37Å; D267-Q271 WeakPolarHBondContact O-CG 3.32Å; D267-Q271 PolarHBondContact O-N 3.27Å; Y268-Q271 PolarHBondContact O-N 3.11Å; Q271-V274 WeakPolarHBondContact O-CB 3.33Å; Q271-V274 PolarHBondContact O-N 3.28Å; Q271-V274 VanDerWaalsContact O-N 3.14Å; Q271-I275 HydrophobicContact CB-CD1 4.37Å; Q271-I275 VanDerWaalsContact O-CD1 3.3Å; Q271-I275 WeakPolarHBondContact O-CD1 3.22Å; Q271-I275 WeakPolarHBondContact O-CG1 3.3Å; Q271-I275 PolarHBondContact O-N 3.38Å |
| 272 | G | 87.2 | Confident | 79.4 | Confident | 16 Ų | 16 | 61.9 Ų | 61.9 | 17% | 0.165 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -52.4 | -56.2 | 178.8 | 0 | 0 | 0 | 0 | 0 | 113.3 | Y268 V274 I275 L276 | Y268-G272 PolarHBondContact O-N 3.33Å; G272-V274 VanDerWaalsContact C-N 3.32Å; G272-V274 PolarHBondContact O-N 3.34Å; G272-I275 PolarHBondContact O-N 2.89Å; G272-L276 PolarHBondContact O-N 3.45Å |
| 273 | P | 90.3 | Very high | 81.4 | Confident | 41 Ų | 41 | 59.4 Ų | 59.4 | 27% | 0.266 | 31% | 0.305 | S | S | . | . | H | α-helix | trans | -58.5 | -39.6 | 175.1 | -27.3 | 35.3 | 0 | 0 | 0 | 113.8 | I240 I269 L276 V277 | I240-P273 HydrophobicContact CD1-CB 3.91Å; I240-P273 HydrophobicContact CD1-CG 4.28Å; I240-P273 HydrophobicContact CG2-CG 4.24Å; I269-P273 WeakPolarHBondContact O-CD 3.46Å; P273-L276 PolarHBondContact O-N 2.88Å; P273-V277 WeakPolarHBondContact O-CB 3.2Å; P273-V277 VanDerWaalsContact O-CG2 3.26Å; P273-V277 WeakPolarHBondContact O-CG2 3.2Å; P273-V277 PolarHBondContact O-N 2.93Å |
| 274 | V | 88.1 | Confident | 83.2 | Confident | 9 Ų | 9 | 57.6 Ų | 57.6 | 6% | 0.055 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -61.2 | -46.5 | 175.7 | 169 | 0 | 0 | 0 | 0 | 110.4 | V198 F201 Y270 Q271 G272 L276 V277 L278 | V198-V274 HydrophobicContact CB-CG2 4.41Å; V198-V274 HydrophobicContact CG1-CG2 4.14Å; V198-V274 HydrophobicContact CG2-CG2 3.89Å; F201-V274 HydrophobicContact CB-CG1 4.33Å; F201-V274 HydrophobicContact CD1-CG1 4.22Å; F201-V274 HydrophobicContact CD2-CG1 3.59Å; F201-V274 HydrophobicContact CD2-CG2 4.14Å; F201-V274 HydrophobicContact CE1-CG1 4.49Å; F201-V274 HydrophobicContact CE2-CG1 3.88Å; F201-V274 HydrophobicContact CG-CG1 3.79Å; F201-V274 HydrophobicContact CZ-CG1 4.34Å; Y270-V274 WeakPolarHBondContact O-CG2 3.2Å; Y270-V274 PolarHBondContact O-N 3.36Å; Q271-V274 WeakPolarHBondContact O-CB 3.33Å; Q271-V274 PolarHBondContact O-N 3.28Å; Q271-V274 VanDerWaalsContact O-N 3.14Å; G272-V274 VanDerWaalsContact C-N 3.32Å; G272-V274 PolarHBondContact O-N 3.34Å; V274-L276 PolarHBondContact O-N 2.9Å; V274-V277 PolarHBondContact O-N 3.46Å; V274-L278 HydrophobicContact CG1-CD1 3.88Å; V274-L278 HydrophobicContact CG1-CG 4.25Å; V274-L278 WeakPolarHBondContact O-CB 3.42Å; V274-L278 WeakPolarHBondContact O-CG 3.37Å; V274-L278 PolarHBondContact O-N 3.31Å |
| 275 | I | 85.7 | Confident | 84.1 | Confident | 28 Ų | 28 | 54.2 Ų | 54.2 | 14% | 0.144 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -60.2 | -46.2 | 178.6 | -64.1 | 153.4 | 0 | 0 | 0 | 110.9 | Y268 Q271 G272 V277 L278 L279 M326 F329 | Y268-I275 HydrophobicContact CE2-CD1 4.43Å; Q271-I275 HydrophobicContact CB-CD1 4.37Å; Q271-I275 VanDerWaalsContact O-CD1 3.3Å; Q271-I275 WeakPolarHBondContact O-CD1 3.22Å; Q271-I275 WeakPolarHBondContact O-CG1 3.3Å; Q271-I275 PolarHBondContact O-N 3.38Å; G272-I275 PolarHBondContact O-N 2.89Å; I275-V277 VanDerWaalsContact C-N 3.31Å; I275-V277 PolarHBondContact O-N 2.71Å; I275-L278 WeakPolarHBondContact O-CB 3.16Å; I275-L278 PolarHBondContact O-N 3.47Å; I275-L278 VanDerWaalsContact O-N 3.16Å; I275-L279 HydrophobicContact CG2-CD1 4.03Å; I275-L279 HydrophobicContact CG2-CG 4.31Å; I275-L279 WeakPolarHBondContact O-CG 3.21Å; I275-L279 PolarHBondContact O-N 3.27Å; I275-M326 HydrophobicContact CB-CE 4.22Å; I275-M326 HydrophobicContact CG1-CE 4.12Å; I275-M326 HydrophobicContact CG2-CE 3.91Å; I275-F329 HydrophobicContact CD1-CD2 4.2Å; I275-F329 HydrophobicContact CD1-CE1 3.99Å; I275-F329 HydrophobicContact CD1-CE2 3.23Å; I275-F329 HydrophobicContact CD1-CZ 3.12Å; I275-F329 HydrophobicContact CG1-CD2 4.2Å; I275-F329 HydrophobicContact CG1-CE2 3.52Å; I275-F329 HydrophobicContact CG1-CZ 3.98Å |
| 276 | L | 88.8 | Confident | 84.8 | Confident | 104 Ų | 104 | 50.3 Ų | 50.3 | 55% | 0.545 | 25% | 0.251 | S | S | . | . | H | α-helix | trans | -56.7 | -47.2 | 177.3 | 177.4 | 62.7 | 0 | 0 | 0 | 111.5 | G272 P273 V274 L278 L279 I280 | G272-L276 PolarHBondContact O-N 3.45Å; P273-L276 PolarHBondContact O-N 2.88Å; V274-L276 PolarHBondContact O-N 2.9Å; L276-L278 VanDerWaalsContact C-N 3.31Å; L276-L278 PolarHBondContact O-N 2.85Å; L276-L279 PolarHBondContact O-N 3.41Å; L276-I280 HydrophobicContact CD1-CD1 4.18Å; L276-I280 HydrophobicContact CD1-CG1 4.5Å; L276-I280 HydrophobicContact CG-CD1 4.08Å; L276-I280 VanDerWaalsContact O-CG1 3.29Å; L276-I280 WeakPolarHBondContact O-CG1 3.42Å; L276-I280 PolarHBondContact O-N 3Å |
| 277 | V | 89.1 | Confident | 85.1 | Confident | 12 Ų | 12 | 51.2 Ų | 51.2 | 7% | 0.073 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -62.7 | -39.4 | 178.6 | 171.3 | 0 | 0 | 0 | 0 | 111.5 | F202 F205 P273 V274 I275 I280 N281 | F202-V277 HydrophobicContact CE1-CG2 4.06Å; F202-V277 HydrophobicContact CE2-CG2 4.33Å; F202-V277 HydrophobicContact CZ-CG2 3.95Å; F205-V277 HydrophobicContact CB-CG1 3.24Å; F205-V277 HydrophobicContact CD1-CG1 4.45Å; F205-V277 HydrophobicContact CD2-CG1 4.03Å; F205-V277 HydrophobicContact CG-CG1 3.67Å; P273-V277 WeakPolarHBondContact O-CB 3.2Å; P273-V277 VanDerWaalsContact O-CG2 3.26Å; P273-V277 WeakPolarHBondContact O-CG2 3.2Å; P273-V277 PolarHBondContact O-N 2.93Å; V274-V277 PolarHBondContact O-N 3.46Å; I275-V277 VanDerWaalsContact C-N 3.31Å; I275-V277 PolarHBondContact O-N 2.71Å; V277-I280 PolarHBondContact O-N 2.93Å; V277-N281 WeakPolarHBondContact O-CB 3.37Å; V277-N281 PolarHBondContact O-N 3.34Å |
| 278 | L | 84.8 | Confident | 85.4 | Confident | 7 Ų | 7 | 50.7 Ų | 50.7 | 4% | 0.037 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -64.4 | -43.9 | 175.7 | -71.6 | 179.6 | 0 | 0 | 0 | 112.6 | F201 V274 I275 L276 I280 N281 F282 G322 M326 | F201-L278 HydrophobicContact CD1-CD1 4.33Å; F201-L278 HydrophobicContact CD1-CD2 3.59Å; F201-L278 HydrophobicContact CD1-CG 4.17Å; F201-L278 HydrophobicContact CE1-CD1 4.14Å; F201-L278 HydrophobicContact CE1-CD2 3.87Å; F201-L278 HydrophobicContact CE1-CG 4.43Å; V274-L278 HydrophobicContact CG1-CD1 3.88Å; V274-L278 HydrophobicContact CG1-CG 4.25Å; V274-L278 WeakPolarHBondContact O-CB 3.42Å; V274-L278 WeakPolarHBondContact O-CG 3.37Å; V274-L278 PolarHBondContact O-N 3.31Å; I275-L278 WeakPolarHBondContact O-CB 3.16Å; I275-L278 PolarHBondContact O-N 3.47Å; I275-L278 VanDerWaalsContact O-N 3.16Å; L276-L278 VanDerWaalsContact C-N 3.31Å; L276-L278 PolarHBondContact O-N 2.85Å; L278-I280 PolarHBondContact O-N 3.13Å; L278-N281 PolarHBondContact O-N 3.32Å; L278-F282 PolarHBondContact O-N 3.03Å; L278-G322 WeakPolarHBondContact CD2-O 3.38Å; L278-M326 HydrophobicContact CB-CE 3.74Å; L278-M326 HydrophobicContact CB-CG 4.35Å; L278-M326 HydrophobicContact CB-SD 3.91Å; L278-M326 HydrophobicContact CD1-CE 3.47Å; L278-M326 VanDerWaalsContact CD1-CE 3.47Å; L278-M326 HydrophobicContact CG-CE 4.24Å |
| 279 | L | 85.3 | Confident | 85.1 | Confident | 89 Ų | 89 | 45.4 Ų | 45.4 | 47% | 0.466 | 24% | 0.235 | S | C | . | . | H | α-helix | trans | -61.4 | -43.8 | 176 | -70.6 | 173 | 0 | 0 | 0 | 111.4 | I275 L276 N281 F282 V283 M326 | I275-L279 HydrophobicContact CG2-CD1 4.03Å; I275-L279 HydrophobicContact CG2-CG 4.31Å; I275-L279 WeakPolarHBondContact O-CG 3.21Å; I275-L279 PolarHBondContact O-N 3.27Å; L276-L279 PolarHBondContact O-N 3.41Å; L279-N281 VanDerWaalsContact C-N 3.35Å; L279-N281 PolarHBondContact O-N 2.8Å; L279-F282 WeakPolarHBondContact O-CB 3.38Å; L279-F282 PolarHBondContact O-N 3.32Å; L279-V283 WeakPolarHBondContact O-CG2 2.99Å; L279-V283 PolarHBondContact O-N 3.12Å; L279-V283 VanDerWaalsContact O-N 3.11Å; L279-M326 HydrophobicContact CD2-SD 3.95Å; L279-M326 HydrophobicContact CG-SD 4.23Å |
| 280 | I | 88.3 | Confident | 84.9 | Confident | 58 Ų | 58 | 50.1 Ų | 50.1 | 30% | 0.297 | 25% | 0.249 | S | C | . | . | H | α-helix | trans | -64.4 | -41.8 | 177.2 | -61.3 | 162.7 | 0 | 0 | 0 | 110.8 | F205 L276 V277 L278 F282 V283 F284 | F205-I280 HydrophobicContact CD2-CG2 4.33Å; F205-I280 HydrophobicContact CE2-CB 4.18Å; F205-I280 HydrophobicContact CE2-CG2 3.67Å; L276-I280 HydrophobicContact CD1-CD1 4.18Å; L276-I280 HydrophobicContact CD1-CG1 4.5Å; L276-I280 HydrophobicContact CG-CD1 4.08Å; L276-I280 VanDerWaalsContact O-CG1 3.29Å; L276-I280 WeakPolarHBondContact O-CG1 3.42Å; L276-I280 PolarHBondContact O-N 3Å; V277-I280 PolarHBondContact O-N 2.93Å; L278-I280 PolarHBondContact O-N 3.13Å; I280-F282 VanDerWaalsContact C-N 3.28Å; I280-F282 PolarHBondContact O-N 3.03Å; I280-V283 WeakPolarHBondContact O-CB 3.33Å; I280-V283 PolarHBondContact O-N 3.47Å; I280-V283 VanDerWaalsContact O-N 3.16Å; I280-F284 HydrophobicContact CG2-CD2 4.18Å; I280-F284 HydrophobicContact CG2-CE1 3.97Å; I280-F284 HydrophobicContact CG2-CE2 3.59Å; I280-F284 HydrophobicContact CG2-CZ 3.47Å; I280-F284 VanDerWaalsContact CG2-CZ 3.47Å; I280-F284 WeakPolarHBondContact O-CG 3.2Å; I280-F284 PolarHBondContact O-N 2.93Å |
| 281 | N | 84.4 | Confident | 84.7 | Confident | 10 Ų | 10 | 51.7 Ų | 51.7 | 5% | 0.053 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -63.1 | -36.1 | 176.9 | -165.7 | 21.9 | 0 | 0 | 0 | 112.1 | V277 L278 L279 F284 L285 | V277-N281 WeakPolarHBondContact O-CB 3.37Å; V277-N281 PolarHBondContact O-N 3.34Å; L278-N281 PolarHBondContact O-N 3.32Å; L279-N281 VanDerWaalsContact C-N 3.35Å; L279-N281 PolarHBondContact O-N 2.8Å; N281-F284 PolarHBondContact O-N 3.49Å; N281-L285 PolarHBondContact O-N 3.25Å |
| 282 | F | 82.6 | Confident | 84.1 | Confident | 106 Ų | 106 | 51.7 Ų | 51.7 | 47% | 0.465 | 26% | 0.259 | S | S | . | . | H | α-helix | trans | -62.1 | -42 | 173.1 | -178.7 | -99.8 | 0 | 0 | 0 | 112.2 | L278 L279 I280 L285 F286 I323 | L278-F282 PolarHBondContact O-N 3.03Å; L279-F282 WeakPolarHBondContact O-CB 3.38Å; L279-F282 PolarHBondContact O-N 3.32Å; I280-F282 VanDerWaalsContact C-N 3.28Å; I280-F282 PolarHBondContact O-N 3.03Å; F282-L285 WeakPolarHBondContact O-CB 3.37Å; F282-L285 PolarHBondContact O-N 3.11Å; F282-F286 PolarHBondContact O-N 3.44Å; F282-I323 HydrophobicContact CD2-CD1 3.75Å; F282-I323 HydrophobicContact CD2-CG1 4.06Å; F282-I323 HydrophobicContact CE2-CD1 4.07Å |
| 283 | V | 85.4 | Confident | 83.4 | Confident | 77 Ų | 77 | 53.3 Ų | 53.3 | 47% | 0.467 | 26% | 0.263 | S | S | . | . | H | α-helix | trans | -62.6 | -43.1 | 174.2 | 174.9 | 0 | 0 | 0 | 0 | 111.2 | L279 I280 F286 N287 | L279-V283 WeakPolarHBondContact O-CG2 2.99Å; L279-V283 PolarHBondContact O-N 3.12Å; L279-V283 VanDerWaalsContact O-N 3.11Å; I280-V283 WeakPolarHBondContact O-CB 3.33Å; I280-V283 PolarHBondContact O-N 3.47Å; I280-V283 VanDerWaalsContact O-N 3.16Å; V283-F286 PolarHBondContact O-N 3.24Å; V283-N287 PolarHBondContact O-N 3.43Å; V283-N287 VanDerWaalsContact O-N 3.08Å |
| 284 | F | 84.6 | Confident | 82.6 | Confident | 33 Ų | 33 | 55.8 Ų | 55.8 | 15% | 0.145 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -61.9 | -44.6 | 175.6 | -65.9 | -22.9 | 0 | 0 | 0 | 112.3 | F205 C209 H212 I280 N281 F286 N287 I288 | F205-F284 HydrophobicContact CD2-CE2 4.14Å; F205-F284 AromaticContact CE2-CE2 3.65Å; F205-F284 HydrophobicContact CE2-CE2 3.65Å; F205-F284 HydrophobicContact CE2-CZ 4.3Å; F205-F284 HydrophobicContact CZ-CE2 4.47Å; C209-F284 HydrophobicContact CB-CD2 4.47Å; C209-F284 HydrophobicContact CB-CE2 3.82Å; H212-F284 HydrophobicContact CB-CB 4.33Å; H212-F284 HydrophobicContact CB-CD1 4.32Å; H212-F284 HydrophobicContact CB-CG 4.24Å; H212-F284 AromaticContact CG-CD1 3.96Å; I280-F284 HydrophobicContact CG2-CD2 4.18Å; I280-F284 HydrophobicContact CG2-CE1 3.97Å; I280-F284 HydrophobicContact CG2-CE2 3.59Å; I280-F284 HydrophobicContact CG2-CZ 3.47Å; I280-F284 VanDerWaalsContact CG2-CZ 3.47Å; I280-F284 WeakPolarHBondContact O-CG 3.2Å; I280-F284 PolarHBondContact O-N 2.93Å; N281-F284 PolarHBondContact O-N 3.49Å; F284-F286 VanDerWaalsContact C-N 3.32Å; F284-F286 PolarHBondContact O-N 2.94Å; F284-N287 PolarHBondContact O-N 3.2Å; F284-I288 HydrophobicContact CB-CD1 4.47Å; F284-I288 WeakPolarHBondContact O-CB 3.17Å; F284-I288 WeakPolarHBondContact O-CD1 3.46Å; F284-I288 WeakPolarHBondContact O-CG1 3.41Å; F284-I288 PolarHBondContact O-N 3.41Å |
| 285 | L | 79.1 | Confident | 81.8 | Confident | 17 Ų | 17 | 61.6 Ų | 61.6 | 9% | 0.089 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -52.6 | -52.5 | 174.3 | 167.5 | 57.3 | 0 | 0 | 0 | 110.6 | N281 F282 N287 I288 V289 P319 I323 | N281-L285 PolarHBondContact O-N 3.25Å; F282-L285 WeakPolarHBondContact O-CB 3.37Å; F282-L285 PolarHBondContact O-N 3.11Å; L285-N287 VanDerWaalsContact C-N 3.34Å; L285-N287 PolarHBondContact O-N 3.18Å; L285-I288 PolarHBondContact O-N 3.21Å; L285-V289 HydrophobicContact CD1-CG2 3.56Å; L285-V289 HydrophobicContact CG-CG2 4.45Å; L285-V289 WeakPolarHBondContact O-CB 3.28Å; L285-V289 VanDerWaalsContact O-CG2 3.31Å; L285-V289 WeakPolarHBondContact O-CG2 3.31Å; L285-V289 PolarHBondContact O-N 3.01Å; L285-P319 HydrophobicContact CB-CB 3.67Å; L285-P319 HydrophobicContact CB-CG 3.6Å; L285-P319 HydrophobicContact CD1-CB 4.18Å; L285-P319 HydrophobicContact CD1-CG 3.38Å; L285-P319 HydrophobicContact CD2-CB 3.86Å; L285-P319 HydrophobicContact CD2-CG 4.01Å; L285-P319 HydrophobicContact CG-CB 4.04Å; L285-P319 HydrophobicContact CG-CG 3.77Å; L285-I323 HydrophobicContact CD2-CD1 3.83Å |
| 286 | F | 81.8 | Confident | 80.7 | Confident | 134 Ų | 134 | 62.2 Ų | 62.2 | 59% | 0.588 | 31% | 0.305 | S | S | * | . | H | α-helix | trans | -58.3 | -46.5 | -177.8 | -179.3 | -99 | 0 | 0 | 0 | 111.7 | F282 V283 F284 V289 R290 | F282-F286 PolarHBondContact O-N 3.44Å; V283-F286 PolarHBondContact O-N 3.24Å; F284-F286 VanDerWaalsContact C-N 3.32Å; F284-F286 PolarHBondContact O-N 2.94Å; F286-V289 PolarHBondContact O-N 3.45Å; F286-R290 WeakPolarHBondContact O-CB 3.12Å; F286-R290 PolarHBondContact O-N 3.28Å |
| 287 | N | 84.2 | Confident | 79.6 | Confident | 48 Ų | 48 | 66.9 Ų | 66.9 | 26% | 0.257 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -64.5 | -44.3 | 178.4 | -73.1 | -19.9 | 0 | 0 | 0 | 112.7 | V283 F284 L285 R290 I291 | V283-N287 PolarHBondContact O-N 3.43Å; V283-N287 VanDerWaalsContact O-N 3.08Å; F284-N287 PolarHBondContact O-N 3.2Å; L285-N287 VanDerWaalsContact C-N 3.34Å; L285-N287 PolarHBondContact O-N 3.18Å; N287-R290 WeakPolarHBondContact O-CB 3.27Å; N287-R290 PolarHBondContact O-N 3.38Å; N287-I291 WeakPolarHBondContact O-CG1 3.29Å; N287-I291 PolarHBondContact O-N 3.11Å |
| 288 | I | 82.1 | Confident | 78.6 | Confident | 5 Ų | 5 | 70.4 Ų | 70.4 | 3% | 0.026 | 35% | 0.346 | C | S | . | . | H | α-helix | trans | -59.9 | -48.4 | 177.4 | -71.6 | 163.9 | 0 | 0 | 0 | 110.1 | L211 H212 I215 F284 L285 R290 I291 L292 L315 | L211-I288 HydrophobicContact CB-CD1 4.23Å; L211-I288 HydrophobicContact CD2-CD1 3.98Å; L211-I288 HydrophobicContact CD2-CG2 4.47Å; L211-I288 HydrophobicContact CG-CD1 3.96Å; H212-I288 HydrophobicContact CB-CD1 4.04Å; H212-I288 HydrophobicContact CB-CG1 4.19Å; I215-I288 HydrophobicContact CD1-CB 4.5Å; I215-I288 HydrophobicContact CD1-CG1 4.26Å; I215-I288 HydrophobicContact CD1-CG2 3.72Å; F284-I288 HydrophobicContact CB-CD1 4.47Å; F284-I288 WeakPolarHBondContact O-CB 3.17Å; F284-I288 WeakPolarHBondContact O-CD1 3.46Å; F284-I288 WeakPolarHBondContact O-CG1 3.41Å; F284-I288 PolarHBondContact O-N 3.41Å; L285-I288 PolarHBondContact O-N 3.21Å; I288-R290 VanDerWaalsContact C-N 3.33Å; I288-R290 PolarHBondContact O-N 3.48Å; I288-I291 PolarHBondContact O-N 2.86Å; I288-L292 VanDerWaalsContact O-CB 3.25Å; I288-L292 WeakPolarHBondContact O-CB 3.45Å; I288-L292 PolarHBondContact O-N 3.49Å; I288-L315 HydrophobicContact CG2-CD2 3.74Å |
| 289 | V | 77.1 | Confident | 77.6 | Confident | 34 Ų | 34 | 73 Ų | 73 | 21% | 0.206 | 36% | 0.364 | C | S | . | . | H | α-helix | trans | -60.3 | -44.6 | 178.2 | 170.9 | 0 | 0 | 0 | 0 | 110.5 | L285 F286 I291 L292 M293 V316 | L285-V289 HydrophobicContact CD1-CG2 3.56Å; L285-V289 HydrophobicContact CG-CG2 4.45Å; L285-V289 WeakPolarHBondContact O-CB 3.28Å; L285-V289 VanDerWaalsContact O-CG2 3.31Å; L285-V289 WeakPolarHBondContact O-CG2 3.31Å; L285-V289 PolarHBondContact O-N 3.01Å; F286-V289 PolarHBondContact O-N 3.45Å; V289-I291 PolarHBondContact O-N 2.9Å; V289-L292 PolarHBondContact O-N 3.43Å; V289-M293 HydrophobicContact CG1-CG 4.11Å; V289-M293 VanDerWaalsContact O-CB 3.29Å; V289-M293 WeakPolarHBondContact O-CB 3.39Å; V289-M293 WeakPolarHBondContact O-CG 3.35Å; V289-M293 PolarHBondContact O-N 3.09Å; V289-V316 HydrophobicContact CG2-CG2 4.05Å |
| 290 | R | 82.3 | Confident | 76.3 | Confident | 168 Ų | 168 | 74.8 Ų | 74.8 | 63% | 0.634 | 38% | 0.379 | S | S | * | . | H | α-helix | trans | -56.9 | -51.5 | 176.8 | -177.9 | -173.2 | 178.4 | -167.3 | 1.2 | 111.7 | F286 N287 I288 T294 | F286-R290 WeakPolarHBondContact O-CB 3.12Å; F286-R290 PolarHBondContact O-N 3.28Å; N287-R290 WeakPolarHBondContact O-CB 3.27Å; N287-R290 PolarHBondContact O-N 3.38Å; I288-R290 VanDerWaalsContact C-N 3.33Å; I288-R290 PolarHBondContact O-N 3.48Å; R290-T294 WeakPolarHBondContact O-CB 3.01Å; R290-T294 PolarHBondContact O-N 3.22Å; R290-T294 VanDerWaalsContact O-N 3.07Å; R290-T294 PolarHBondContact O-OG1 3.28Å |
| 291 | I | 81.4 | Confident | 74.9 | Confident | 49 Ų | 49 | 76.6 Ų | 76.6 | 25% | 0.251 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -65.4 | -46.1 | -178.2 | -65.1 | 166.3 | 0 | 0 | 0 | 110.5 | I215 V216 N287 I288 V289 T294 K295 | I215-I291 HydrophobicContact CG2-CB 4.1Å; I215-I291 HydrophobicContact CG2-CD1 4.21Å; I215-I291 HydrophobicContact CG2-CG2 3.55Å; V216-I291 HydrophobicContact CG2-CD1 3.58Å; N287-I291 WeakPolarHBondContact O-CG1 3.29Å; N287-I291 PolarHBondContact O-N 3.11Å; I288-I291 PolarHBondContact O-N 2.86Å; V289-I291 PolarHBondContact O-N 2.9Å; I291-T294 WeakPolarHBondContact O-CB 3.27Å; I291-T294 PolarHBondContact O-N 3.5Å; I291-K295 PolarHBondContact O-N 3.28Å |
| 292 | L | 73.6 | Confident | 73.5 | Confident | 40 Ų | 40 | 81.2 Ų | 81.2 | 21% | 0.209 | 43% | 0.426 | C | S | . | . | H | α-helix | trans | -61.4 | -47.1 | 179.9 | -179.3 | 67.7 | 0 | 0 | 0 | 111.5 | I288 V289 T294 K295 L296 L315 | I288-L292 VanDerWaalsContact O-CB 3.25Å; I288-L292 WeakPolarHBondContact O-CB 3.45Å; I288-L292 PolarHBondContact O-N 3.49Å; V289-L292 PolarHBondContact O-N 3.43Å; L292-T294 VanDerWaalsContact C-N 3.25Å; L292-T294 PolarHBondContact O-N 3Å; L292-K295 PolarHBondContact O-N 3.41Å; L292-L296 HydrophobicContact CD1-CD1 4.13Å; L292-L296 HydrophobicContact CD1-CG 4.22Å; L292-L296 HydrophobicContact CD2-CD1 4.28Å; L292-L296 HydrophobicContact CG-CD1 3.72Å; L292-L296 HydrophobicContact CG-CG 4.26Å; L292-L296 VanDerWaalsContact O-CB 3.25Å; L292-L296 WeakPolarHBondContact O-CB 3.38Å; L292-L296 WeakPolarHBondContact O-CD1 3.45Å; L292-L296 WeakPolarHBondContact O-CG 3.32Å; L292-L296 PolarHBondContact O-N 3.22Å; L292-L315 HydrophobicContact CD2-CB 4.27Å; L292-L315 HydrophobicContact CD2-CD1 3.49Å; L292-L315 VanDerWaalsContact CD2-CD1 3.49Å; L292-L315 HydrophobicContact CD2-CD2 3.51Å; L292-L315 HydrophobicContact CD2-CG 3.92Å |
| 293 | M | 71.5 | Confident | 72.2 | Confident | 50 Ų | 50 | 84.5 Ų | 84.5 | 25% | 0.246 | 44% | 0.443 | C | S | . | . | H | α-helix | trans | -59.3 | -39 | 176.6 | -73.8 | -63.4 | 142.1 | 0 | 0 | 111.9 | V289 L296 R297 K312 | V289-M293 HydrophobicContact CG1-CG 4.11Å; V289-M293 VanDerWaalsContact O-CB 3.29Å; V289-M293 WeakPolarHBondContact O-CB 3.39Å; V289-M293 WeakPolarHBondContact O-CG 3.35Å; V289-M293 PolarHBondContact O-N 3.09Å; M293-L296 HydrophobicContact CE-CD1 4.41Å; M293-R297 PolarHBondContact O-N 2.99Å; M293-R297 VanDerWaalsContact O-N 3.07Å; M293-K312 HydrophobicContact CE-CB 3.67Å; M293-K312 HydrophobicContact CE-CD 3.57Å; M293-K312 HydrophobicContact CE-CG 3.38Å; M293-K312 HydrophobicContact SD-CD 3.97Å; M293-K312 HydrophobicContact SD-CG 4.43Å |
| 294 | T | 74.8 | Confident | 70.8 | Confident | 93 Ų | 93 | 82.3 Ų | 82.3 | 57% | 0.571 | 43% | 0.43 | S | S | * | . | H | α-helix | trans | -66.1 | -48.8 | 178.4 | -54.5 | 0 | 0 | 0 | 0 | 111.1 | R290 I291 L292 L296 R297 A298 | R290-T294 WeakPolarHBondContact O-CB 3.01Å; R290-T294 PolarHBondContact O-N 3.22Å; R290-T294 VanDerWaalsContact O-N 3.07Å; R290-T294 PolarHBondContact O-OG1 3.28Å; I291-T294 WeakPolarHBondContact O-CB 3.27Å; I291-T294 PolarHBondContact O-N 3.5Å; L292-T294 VanDerWaalsContact C-N 3.25Å; L292-T294 PolarHBondContact O-N 3Å; T294-L296 PolarHBondContact O-N 3.27Å; T294-R297 PolarHBondContact O-N 3.26Å; T294-R297 VanDerWaalsContact O-N 3.15Å; T294-A298 PolarHBondContact O-N 3.14Å |
| 295 | K | 69.9 | Low | 69.4 | Low | 132 Ų | 132 | 85.7 Ų | 85.7 | 57% | 0.574 | 45% | 0.449 | S | S | * | . | H | α-helix | trans | -63.7 | -40.3 | 176.7 | -73.2 | -161.5 | 174.5 | -177 | 0 | 112.5 | I291 L292 R297 A298 | I291-K295 PolarHBondContact O-N 3.28Å; L292-K295 PolarHBondContact O-N 3.41Å; K295-R297 PolarHBondContact O-N 3.27Å; K295-A298 PolarHBondContact O-N 3.26Å |
| 296 | L | 64.1 | Low | 68.3 | Low | 40 Ų | 40 | 92.9 Ų | 92.9 | 21% | 0.209 | 48% | 0.481 | C | S | . | . | H | α-helix | trans | -59.7 | -35.7 | 175.2 | -78 | 169.1 | 0 | 0 | 0 | 111.2 | L292 M293 T294 A298 S299 R308 | L292-L296 HydrophobicContact CD1-CD1 4.13Å; L292-L296 HydrophobicContact CD1-CG 4.22Å; L292-L296 HydrophobicContact CD2-CD1 4.28Å; L292-L296 HydrophobicContact CG-CD1 3.72Å; L292-L296 HydrophobicContact CG-CG 4.26Å; L292-L296 VanDerWaalsContact O-CB 3.25Å; L292-L296 WeakPolarHBondContact O-CB 3.38Å; L292-L296 WeakPolarHBondContact O-CD1 3.45Å; L292-L296 WeakPolarHBondContact O-CG 3.32Å; L292-L296 PolarHBondContact O-N 3.22Å; M293-L296 HydrophobicContact CE-CD1 4.41Å; T294-L296 PolarHBondContact O-N 3.27Å; L296-A298 VanDerWaalsContact C-N 3.32Å; L296-A298 PolarHBondContact O-N 3.1Å; L296-S299 PolarHBondContact O-N 3.39Å; L296-R308 HydrophobicContact CD1-CG 4.48Å; L296-R308 HydrophobicContact CD2-CG 4.24Å; L296-R308 PolarHBondContact O-NE 3.18Å; L296-R308 PolarHBondContact O-NH1 3.39Å; L296-R308 PolarHBondContact O-NH2 3.33Å |
| 297 | R | 65 | Low | 66.9 | Low | 203 Ų | 203 | 94.8 Ų | 94.8 | 77% | 0.766 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -71.7 | -25.4 | -178.1 | -169.6 | 177.1 | -180 | 178.9 | -0.1 | 113.4 | M293 T294 K295 S299 | M293-R297 PolarHBondContact O-N 2.99Å; M293-R297 VanDerWaalsContact O-N 3.07Å; T294-R297 PolarHBondContact O-N 3.26Å; T294-R297 VanDerWaalsContact O-N 3.15Å; K295-R297 PolarHBondContact O-N 3.27Å; R297-S299 VanDerWaalsContact C-N 3.29Å |
| 298 | A | 68.3 | Low | 65.7 | Low | 86 Ų | 86 | 95.8 Ų | 95.8 | 71% | 0.711 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -75.4 | -15.5 | 175.1 | 0 | 0 | 0 | 0 | 0 | 113.7 | T294 K295 L296 | T294-A298 PolarHBondContact O-N 3.14Å; K295-A298 PolarHBondContact O-N 3.26Å; L296-A298 VanDerWaalsContact C-N 3.32Å; L296-A298 PolarHBondContact O-N 3.1Å |
| 299 | S | 63 | Low | 64.3 | Low | 60 Ų | 60 | 103.1 Ų | 103.1 | 42% | 0.42 | 52% | 0.518 | S | S | . | . | trans | -100.2 | 104.1 | 179.7 | 155 | 0 | 0 | 0 | 0 | 110.1 | L296 R297 | L296-S299 PolarHBondContact O-N 3.39Å; R297-S299 VanDerWaalsContact C-N 3.29Å | ||
| 300 | T | 57.9 | Low | 63 | Low | 127 Ų | 127 | 104.2 Ų | 104.2 | 78% | 0.779 | 53% | 0.53 | S | S | * | . | trans | -103.4 | 103 | -179.3 | 28.9 | 0 | 0 | 0 | 0 | 112 | ||||
| 301 | T | 59.6 | Low | 61.6 | Low | 96 Ų | 96 | 98.3 Ų | 98.3 | 59% | 0.589 | 51% | 0.513 | S | S | * | . | trans | -148.2 | 140 | 163.2 | -3.3 | 0 | 0 | 0 | 0 | 109.8 | E303 T304 | T301-E303 VanDerWaalsContact C-N 3.35Å; T301-E303 PolarHBondContact O-N 3.32Å; T301-T304 VanDerWaalsContact O-CB 3.23Å; T301-T304 WeakPolarHBondContact O-CB 3.29Å; T301-T304 VanDerWaalsContact O-CG2 3.31Å; T301-T304 WeakPolarHBondContact O-CG2 3.22Å; T301-T304 PolarHBondContact O-N 2.96Å; T301-T304 PolarHBondContact O-OG1 2.95Å | ||
| 302 | S | 55 | Low | 60.1 | Low | 107 Ų | 107 | 101.5 Ų | 101.5 | 75% | 0.748 | 53% | 0.525 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -64.2 | -24.7 | -164.7 | 47.5 | 0 | 0 | 0 | 0 | 116.3 | T304 | S302-T304 VanDerWaalsContact C-N 3.28Å; S302-T304 PolarHBondContact O-N 3.48Å |
| 303 | E | 55.2 | Low | 59.1 | Low | 175 Ų | 175 | 102.5 Ų | 102.5 | 82% | 0.818 | 54% | 0.54 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -72.3 | -17.8 | 171.2 | -67.2 | -157.6 | 143.5 | 0 | 0 | 113.9 | T301 I305 | T301-E303 VanDerWaalsContact C-N 3.35Å; T301-E303 PolarHBondContact O-N 3.32Å; E303-I305 PolarHBondContact O-N 3.16Å |
| 304 | T | 56.2 | Low | 57.9 | Low | 31 Ų | 31 | 102.7 Ų | 102.7 | 19% | 0.19 | 54% | 0.544 | C | S | . | . | H | α-helix | trans | -70.1 | -15 | -178.2 | 66.4 | 0 | 0 | 0 | 0 | 113.5 | T301 S302 R308 | T301-T304 VanDerWaalsContact O-CB 3.23Å; T301-T304 WeakPolarHBondContact O-CB 3.29Å; T301-T304 VanDerWaalsContact O-CG2 3.31Å; T301-T304 WeakPolarHBondContact O-CG2 3.22Å; T301-T304 PolarHBondContact O-N 2.96Å; T301-T304 PolarHBondContact O-OG1 2.95Å; S302-T304 VanDerWaalsContact C-N 3.28Å; S302-T304 PolarHBondContact O-N 3.48Å; T304-R308 WeakPolarHBondContact O-CB 3.06Å; T304-R308 WeakPolarHBondContact O-CD 3.43Å; T304-R308 WeakPolarHBondContact O-CG 3.32Å; T304-R308 PolarHBondContact O-N 2.89Å |
| 305 | I | 56.3 | Low | 57 | Low | 105 Ų | 105 | 100.4 Ų | 100.4 | 54% | 0.538 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -76.6 | -36.5 | -174.6 | -63.4 | 171 | 0 | 0 | 0 | 112 | E303 | E303-I305 PolarHBondContact O-N 3.16Å |
| 306 | Q | 54.8 | Low | 56.1 | Low | 167 Ų | 167 | 96.7 Ų | 96.7 | 78% | 0.78 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -80 | -36.3 | 176.1 | -152.4 | 171.2 | 20.9 | 0 | 0 | 110.9 | K309 A310 | Q306-K309 PolarHBondContact O-N 3.01Å; Q306-A310 PolarHBondContact O-N 3.36Å |
| 307 | Y | 53.5 | Low | 55.6 | Low | 175 Ų | 175 | 97.7 Ų | 97.7 | 69% | 0.686 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -66.6 | -35.4 | 174.6 | -148.2 | -98.2 | 0 | 0 | 0 | 112.6 | K309 V311 | Y307-K309 VanDerWaalsContact C-N 3.33Å; Y307-K309 PolarHBondContact O-N 3.34Å; Y307-V311 HydrophobicContact CD1-CG2 3.72Å; Y307-V311 HydrophobicContact CE1-CG2 3.72Å; Y307-V311 WeakPolarHBondContact O-CB 2.97Å; Y307-V311 VanDerWaalsContact O-CG2 3.26Å; Y307-V311 WeakPolarHBondContact O-CG2 3.35Å; Y307-V311 PolarHBondContact O-N 2.9Å |
| 308 | R | 58.6 | Low | 55.2 | Low | 68 Ų | 68 | 89.9 Ų | 89.9 | 26% | 0.257 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -64.1 | -30.6 | 171.7 | -88.2 | 162 | 154.5 | -149.7 | -55.8 | 113.9 | L296 T304 K312 | L296-R308 HydrophobicContact CD1-CG 4.48Å; L296-R308 HydrophobicContact CD2-CG 4.24Å; L296-R308 PolarHBondContact O-NE 3.18Å; L296-R308 PolarHBondContact O-NH1 3.39Å; L296-R308 PolarHBondContact O-NH2 3.33Å; T304-R308 WeakPolarHBondContact O-CB 3.06Å; T304-R308 WeakPolarHBondContact O-CD 3.43Å; T304-R308 WeakPolarHBondContact O-CG 3.32Å; T304-R308 PolarHBondContact O-N 2.89Å; R308-K312 WeakPolarHBondContact O-CB 3.29Å; R308-K312 PolarHBondContact O-N 2.88Å; R308-K312 VanDerWaalsContact O-N 3.15Å |
| 309 | K | 51.6 | Low | 54.4 | Low | 159 Ų | 159 | 86.5 Ų | 86.5 | 69% | 0.691 | 47% | 0.465 | S | S | * | . | H | α-helix | trans | -74.7 | -36.5 | -180 | -73.4 | -179.8 | 179 | -177.5 | 0 | 112 | Q306 Y307 A313 | Q306-K309 PolarHBondContact O-N 3.01Å; Y307-K309 VanDerWaalsContact C-N 3.33Å; Y307-K309 PolarHBondContact O-N 3.34Å; K309-A313 PolarHBondContact O-N 3.29Å |
| 310 | A | 49.5 | Very low | 53.8 | Low | 57 Ų | 57 | 86.2 Ų | 86.2 | 47% | 0.471 | 46% | 0.459 | S | S | . | . | H | α-helix | trans | -78.8 | -45.7 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.9 | Q306 K312 A313 T314 | Q306-A310 PolarHBondContact O-N 3.36Å; A310-K312 VanDerWaalsContact C-N 3.26Å; A310-K312 PolarHBondContact O-N 3.36Å; A310-A313 PolarHBondContact O-N 2.89Å; A310-A313 VanDerWaalsContact O-N 3.14Å; A310-T314 WeakPolarHBondContact O-CB 3.47Å; A310-T314 PolarHBondContact O-N 3.13Å; A310-T314 PolarHBondContact O-OG1 2.93Å; A310-T314 VanDerWaalsContact O-OG1 3.05Å |
| 311 | V | 53 | Low | 53.7 | Low | 45 Ų | 45 | 81 Ų | 81 | 27% | 0.273 | 43% | 0.426 | S | S | . | . | H | α-helix | trans | -65.6 | -29.6 | 178.1 | 174.1 | 0 | 0 | 0 | 0 | 111.9 | Y307 L315 | Y307-V311 HydrophobicContact CD1-CG2 3.72Å; Y307-V311 HydrophobicContact CE1-CG2 3.72Å; Y307-V311 WeakPolarHBondContact O-CB 2.97Å; Y307-V311 VanDerWaalsContact O-CG2 3.26Å; Y307-V311 WeakPolarHBondContact O-CG2 3.35Å; Y307-V311 PolarHBondContact O-N 2.9Å; V311-L315 VanDerWaalsContact O-CB 3.25Å; V311-L315 WeakPolarHBondContact O-CB 3.11Å; V311-L315 PolarHBondContact O-N 3.34Å; V311-L315 VanDerWaalsContact O-N 3.11Å |
| 312 | K | 50.2 | Low | 53.6 | Low | 115 Ų | 115 | 76.5 Ų | 76.5 | 50% | 0.5 | 40% | 0.399 | S | S | . | . | H | α-helix | trans | -69.2 | -34.6 | 171.9 | -179.7 | 167.3 | -174.9 | -174.4 | 0 | 113.6 | M293 R308 A310 V316 | M293-K312 HydrophobicContact CE-CB 3.67Å; M293-K312 HydrophobicContact CE-CD 3.57Å; M293-K312 HydrophobicContact CE-CG 3.38Å; M293-K312 HydrophobicContact SD-CD 3.97Å; M293-K312 HydrophobicContact SD-CG 4.43Å; R308-K312 WeakPolarHBondContact O-CB 3.29Å; R308-K312 PolarHBondContact O-N 2.88Å; R308-K312 VanDerWaalsContact O-N 3.15Å; A310-K312 VanDerWaalsContact C-N 3.26Å; A310-K312 PolarHBondContact O-N 3.36Å; K312-V316 WeakPolarHBondContact O-CB 3.22Å; K312-V316 WeakPolarHBondContact O-CG2 3.36Å |
| 313 | A | 52 | Low | 53.8 | Low | 62 Ų | 62 | 73.2 Ų | 73.2 | 51% | 0.512 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -78.4 | -36.7 | 177.7 | 0 | 0 | 0 | 0 | 0 | 111.7 | K309 A310 L317 | K309-A313 PolarHBondContact O-N 3.29Å; A310-A313 PolarHBondContact O-N 2.89Å; A310-A313 VanDerWaalsContact O-N 3.14Å; A313-L317 PolarHBondContact O-N 2.82Å |
| 314 | T | 47.8 | Very low | 54.1 | Low | 54 Ų | 54 | 65.1 Ų | 65.1 | 33% | 0.331 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -78.4 | -32.5 | -176.5 | -59.3 | 0 | 0 | 0 | 0 | 114.4 | A310 V316 F360 | A310-T314 WeakPolarHBondContact O-CB 3.47Å; A310-T314 PolarHBondContact O-N 3.13Å; A310-T314 PolarHBondContact O-OG1 2.93Å; A310-T314 VanDerWaalsContact O-OG1 3.05Å; T314-V316 VanDerWaalsContact C-N 3.35Å; T314-F360 HydrophobicContact CG2-CD1 3.17Å; T314-F360 HydrophobicContact CG2-CE1 3.33Å; T314-F360 HydrophobicContact CG2-CG 4.02Å; T314-F360 HydrophobicContact CG2-CZ 4.28Å |
| 315 | L | 54.8 | Low | 54.4 | Low | 44 Ų | 44 | 65.4 Ų | 65.4 | 23% | 0.23 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -82.7 | -16.9 | 177.5 | -150 | 133.3 | 0 | 0 | 0 | 112.6 | I288 L292 V311 | I288-L315 HydrophobicContact CG2-CD2 3.74Å; L292-L315 HydrophobicContact CD2-CB 4.27Å; L292-L315 HydrophobicContact CD2-CD1 3.49Å; L292-L315 VanDerWaalsContact CD2-CD1 3.49Å; L292-L315 HydrophobicContact CD2-CD2 3.51Å; L292-L315 HydrophobicContact CD2-CG 3.92Å; V311-L315 VanDerWaalsContact O-CB 3.25Å; V311-L315 WeakPolarHBondContact O-CB 3.11Å; V311-L315 PolarHBondContact O-N 3.34Å; V311-L315 VanDerWaalsContact O-N 3.11Å |
| 316 | V | 51.1 | Low | 54.4 | Low | 54 Ų | 54 | 62.2 Ų | 62.2 | 33% | 0.327 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -81.3 | -29.5 | 172.3 | 167 | 0 | 0 | 0 | 0 | 111.8 | V289 K312 T314 L318 P319 L320 | V289-V316 HydrophobicContact CG2-CG2 4.05Å; K312-V316 WeakPolarHBondContact O-CB 3.22Å; K312-V316 WeakPolarHBondContact O-CG2 3.36Å; T314-V316 VanDerWaalsContact C-N 3.35Å; V316-L318 PolarHBondContact O-N 3.01Å; V316-P319 WeakPolarHBondContact O-CD 3.04Å; V316-L320 HydrophobicContact CG1-CD1 4.14Å; V316-L320 WeakPolarHBondContact O-CD1 3.31Å |
| 317 | L | 53.3 | Low | 54.6 | Low | 62 Ų | 62 | 56.9 Ų | 56.9 | 33% | 0.325 | 29% | 0.293 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -73.5 | -13.4 | 176.9 | -142.5 | 86 | 0 | 0 | 0 | 114.3 | A313 L320 F356 F360 | A313-L317 PolarHBondContact O-N 2.82Å; L317-L320 HydrophobicContact CD1-CD1 3.93Å; L317-L320 HydrophobicContact CG-CD1 4.5Å; L317-F356 HydrophobicContact CD2-CB 4.33Å; L317-F356 HydrophobicContact CD2-CD1 4.39Å; L317-F356 HydrophobicContact CD2-CG 4.26Å; L317-F360 HydrophobicContact CD2-CD2 4.28Å; L317-F360 HydrophobicContact CD2-CE2 3.42Å; L317-F360 VanDerWaalsContact CD2-CE2 3.42Å; L317-F360 HydrophobicContact CD2-CZ 4.06Å |
| 318 | L | 57.7 | Low | 54.7 | Low | 38 Ų | 38 | 53.3 Ų | 53.3 | 20% | 0.199 | 28% | 0.281 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -70.3 | -39.6 | -174.2 | -128.2 | 73.9 | 0 | 0 | 0 | 113.4 | L211 V316 F360 Y361 | L211-L318 HydrophobicContact CD2-CD2 4.27Å; V316-L318 PolarHBondContact O-N 3.01Å; L318-F360 HydrophobicContact CD1-CB 4.39Å; L318-Y361 HydrophobicContact CD1-CE1 4.01Å; L318-Y361 HydrophobicContact CD1-CE2 3.99Å; L318-Y361 HydrophobicContact CD2-CE1 3.74Å; L318-Y361 WeakPolarHBondContact CD2-OH 3.43Å; L318-Y361 HydrophobicContact CG-CE1 4.06Å; L318-Y361 HydrophobicContact CG-CE2 4.04Å; L318-Y361 VanDerWaalsContact CG-CZ 3.45Å; L318-Y361 WeakPolarHBondContact CG-OH 3.35Å |
| 319 | P | 50.5 | Low | 54.4 | Low | 15 Ų | 15 | 55.2 Ų | 55.2 | 10% | 0.097 | 29% | 0.291 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -97.2 | -5.8 | 176.3 | -13.4 | 37.3 | 0 | 0 | 0 | 113.2 | L285 V316 L321 G322 | L285-P319 HydrophobicContact CB-CB 3.67Å; L285-P319 HydrophobicContact CB-CG 3.6Å; L285-P319 HydrophobicContact CD1-CB 4.18Å; L285-P319 HydrophobicContact CD1-CG 3.38Å; L285-P319 HydrophobicContact CD2-CB 3.86Å; L285-P319 HydrophobicContact CD2-CG 4.01Å; L285-P319 HydrophobicContact CG-CB 4.04Å; L285-P319 HydrophobicContact CG-CG 3.77Å; V316-P319 WeakPolarHBondContact O-CD 3.04Å; P319-L321 PolarHBondContact O-N 3.17Å; P319-G322 PolarHBondContact O-N 2.03Å; P319-G322 VanDerWaalsContact O-N 3.08Å |
| 320 | L | 51.5 | Low | 54.6 | Low | 55 Ų | 55 | 52.4 Ų | 52.4 | 29% | 0.288 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -62 | -13.7 | 179.9 | -102.4 | 160.9 | 0 | 0 | 0 | 113.8 | V316 L317 G322 I323 T324 | V316-L320 HydrophobicContact CG1-CD1 4.14Å; V316-L320 WeakPolarHBondContact O-CD1 3.31Å; L317-L320 HydrophobicContact CD1-CD1 3.93Å; L317-L320 HydrophobicContact CG-CD1 4.5Å; L320-G322 VanDerWaalsContact C-N 3.26Å; L320-G322 PolarHBondContact O-N 3.22Å; L320-I323 HydrophobicContact CD2-CB 4.02Å; L320-I323 HydrophobicContact CD2-CD1 4.05Å; L320-I323 HydrophobicContact CD2-CG2 4.1Å; L320-I323 HydrophobicContact CG-CD1 4.07Å; L320-I323 PolarHBondContact O-N 2.89Å; L320-T324 WeakPolarHBondContact O-CG2 3.41Å; L320-T324 PolarHBondContact O-N 2.89Å |
| 321 | L | 56 | Low | 54.6 | Low | 16 Ų | 16 | 56.3 Ų | 56.3 | 8% | 0.084 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -78.2 | -11.2 | 177 | -69.3 | -178.7 | 0 | 0 | 0 | 114.6 | F161 M204 P319 Q353 V357 | F161-L321 HydrophobicContact CZ-CD1 4.47Å; M204-L321 HydrophobicContact SD-CB 3.74Å; P319-L321 PolarHBondContact O-N 3.17Å; L321-Q353 HydrophobicContact CB-CG 4.16Å; L321-Q353 HydrophobicContact CD1-CG 3.67Å; L321-Q353 HydrophobicContact CD2-CB 3.54Å; L321-Q353 HydrophobicContact CD2-CG 3.31Å; L321-Q353 HydrophobicContact CG-CG 3.83Å; L321-Q353 PolarHBondContact O-NE2 3.48Å; L321-V357 HydrophobicContact CD1-CG2 3.2Å |
| 322 | G | 57.4 | Low | 54.8 | Low | 3 Ų | 3 | 55.8 Ų | 55.8 | 3% | 0.031 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -95.8 | -26 | 164.1 | 0 | 0 | 0 | 0 | 0 | 114.2 | L278 P319 L320 Y325 | L278-G322 WeakPolarHBondContact CD2-O 3.38Å; P319-G322 PolarHBondContact O-N 2.03Å; P319-G322 VanDerWaalsContact O-N 3.08Å; L320-G322 VanDerWaalsContact C-N 3.26Å; L320-G322 PolarHBondContact O-N 3.22Å; G322-Y325 PolarHBondContact O-N 2.94Å |
| 323 | I | 59 | Low | 55 | Low | 38 Ų | 38 | 52 Ų | 52 | 20% | 0.195 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -73.3 | -32.8 | -176 | -62.5 | 177.3 | 0 | 0 | 0 | 111.5 | F282 L285 L320 Y325 M326 L327 | F282-I323 HydrophobicContact CD2-CD1 3.75Å; F282-I323 HydrophobicContact CD2-CG1 4.06Å; F282-I323 HydrophobicContact CE2-CD1 4.07Å; L285-I323 HydrophobicContact CD2-CD1 3.83Å; L320-I323 HydrophobicContact CD2-CB 4.02Å; L320-I323 HydrophobicContact CD2-CD1 4.05Å; L320-I323 HydrophobicContact CD2-CG2 4.1Å; L320-I323 HydrophobicContact CG-CD1 4.07Å; L320-I323 PolarHBondContact O-N 2.89Å; I323-Y325 PolarHBondContact O-N 3.36Å; I323-M326 WeakPolarHBondContact O-CA 2.97Å; I323-M326 VanDerWaalsContact O-CB 3.31Å; I323-M326 WeakPolarHBondContact O-CB 3.34Å; I323-M326 PolarHBondContact O-N 3.11Å; I323-L327 PolarHBondContact O-N 2.95Å |
| 324 | T | 61.9 | Low | 55.4 | Low | 4 Ų | 4 | 58 Ų | 58 | 3% | 0.025 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -60.8 | -33.2 | 177.3 | 54.2 | 0 | 0 | 0 | 0 | 112.7 | L320 L327 L349 | L320-T324 WeakPolarHBondContact O-CG2 3.41Å; L320-T324 PolarHBondContact O-N 2.89Å; T324-L327 WeakPolarHBondContact O-CB 3.15Å; T324-L327 PolarHBondContact O-N 3.35Å; T324-L349 HydrophobicContact CG2-CB 3.68Å; T324-L349 HydrophobicContact CG2-CD1 3.28Å; T324-L349 HydrophobicContact CG2-CG 4.11Å |
| 325 | Y | 62.1 | Low | 56.4 | Low | 38 Ų | 38 | 60.5 Ų | 60.5 | 15% | 0.149 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -73.8 | -25.3 | 172.7 | -106.7 | -100.1 | 0 | 0 | 0 | 113.3 | F201 G322 I323 L327 F328 Q350 | F201-Y325 HydrophobicContact CE1-CD2 4.13Å; F201-Y325 HydrophobicContact CE1-CG 4.12Å; F201-Y325 HydrophobicContact CE2-CD1 4.42Å; F201-Y325 HydrophobicContact CE2-CE1 4.29Å; F201-Y325 HydrophobicContact CE2-CE2 4.4Å; F201-Y325 AromaticContact CZ-CD1 3.87Å; F201-Y325 HydrophobicContact CZ-CD1 3.87Å; F201-Y325 AromaticContact CZ-CD2 3.48Å; F201-Y325 HydrophobicContact CZ-CD2 3.48Å; F201-Y325 VanDerWaalsContact CZ-CD2 3.48Å; F201-Y325 HydrophobicContact CZ-CE1 4.06Å; F201-Y325 AromaticContact CZ-CE2 3.68Å; F201-Y325 HydrophobicContact CZ-CE2 3.68Å; F201-Y325 AromaticContact CZ-CG 3.56Å; F201-Y325 HydrophobicContact CZ-CG 3.56Å; F201-Y325 AromaticContact CZ-CZ 3.96Å; G322-Y325 PolarHBondContact O-N 2.94Å; I323-Y325 PolarHBondContact O-N 3.36Å; Y325-L327 PolarHBondContact O-N 3.2Å; Y325-F328 VanDerWaalsContact O-CB 3.28Å; Y325-F328 WeakPolarHBondContact O-CB 3.4Å; Y325-F328 PolarHBondContact O-N 3.5Å; Y325-Q350 HydrophobicContact CE2-CG 4.5Å; Y325-Q350 PolarHBondContact OH-NE2 3.08Å |
| 326 | M | 56.6 | Low | 57.1 | Low | 37 Ų | 37 | 61.8 Ų | 61.8 | 18% | 0.182 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -69.2 | -26.3 | 171.5 | -61.6 | -75.4 | 82.1 | 0 | 0 | 111.7 | I275 L278 L279 I323 F328 F329 | I275-M326 HydrophobicContact CB-CE 4.22Å; I275-M326 HydrophobicContact CG1-CE 4.12Å; I275-M326 HydrophobicContact CG2-CE 3.91Å; L278-M326 HydrophobicContact CB-CE 3.74Å; L278-M326 HydrophobicContact CB-CG 4.35Å; L278-M326 HydrophobicContact CB-SD 3.91Å; L278-M326 HydrophobicContact CD1-CE 3.47Å; L278-M326 VanDerWaalsContact CD1-CE 3.47Å; L278-M326 HydrophobicContact CG-CE 4.24Å; L279-M326 HydrophobicContact CD2-SD 3.95Å; L279-M326 HydrophobicContact CG-SD 4.23Å; I323-M326 WeakPolarHBondContact O-CA 2.97Å; I323-M326 VanDerWaalsContact O-CB 3.31Å; I323-M326 WeakPolarHBondContact O-CB 3.34Å; I323-M326 PolarHBondContact O-N 3.11Å; M326-F328 PolarHBondContact O-N 3.36Å; M326-F329 PolarHBondContact O-N 3.21Å; M326-F329 VanDerWaalsContact O-N 3.08Å |
| 327 | L | 58.8 | Low | 58.1 | Low | 56 Ų | 56 | 65.4 Ų | 65.4 | 29% | 0.293 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -62.9 | -27.8 | 174.1 | -60.5 | 174 | 0 | 0 | 0 | 111.1 | I323 T324 Y325 F329 V330 F342 F345 | I323-L327 PolarHBondContact O-N 2.95Å; T324-L327 WeakPolarHBondContact O-CB 3.15Å; T324-L327 PolarHBondContact O-N 3.35Å; Y325-L327 PolarHBondContact O-N 3.2Å; L327-F329 PolarHBondContact O-N 2.96Å; L327-F329 VanDerWaalsContact O-N 3.17Å; L327-V330 PolarHBondContact O-N 2.92Å; L327-V330 VanDerWaalsContact O-N 3.12Å; L327-F342 VanDerWaalsContact C-CE2 3.4Å; L327-F342 VanDerWaalsContact C-CZ 3.49Å; L327-F342 HydrophobicContact CB-CE2 3.6Å; L327-F342 HydrophobicContact CB-CZ 4.17Å; L327-F342 WeakPolarHBondContact O-CE2 3.36Å; L327-F342 WeakPolarHBondContact O-CZ 3.44Å; L327-F345 HydrophobicContact CD1-CD1 4.02Å; L327-F345 HydrophobicContact CD1-CE1 3.72Å |
| 328 | F | 55.3 | Low | 59.1 | Low | 100 Ų | 100 | 65 Ų | 65 | 44% | 0.439 | 35% | 0.346 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -61.3 | -22.6 | 174.1 | -167.8 | -96 | 0 | 0 | 0 | 113.7 | Y325 M326 F342 | Y325-F328 VanDerWaalsContact O-CB 3.28Å; Y325-F328 WeakPolarHBondContact O-CB 3.4Å; Y325-F328 PolarHBondContact O-N 3.5Å; M326-F328 PolarHBondContact O-N 3.36Å; F328-F342 HydrophobicContact CB-CZ 4.43Å; F328-F342 HydrophobicContact CD2-CE1 4.49Å |
| 329 | F | 51.7 | Low | 59.8 | Low | 107 Ų | 107 | 66.4 Ų | 66.4 | 47% | 0.469 | 35% | 0.351 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -92.2 | -20.9 | 176.8 | -86.1 | -83.3 | 0 | 0 | 0 | 113.8 | I275 M326 L327 N331 | I275-F329 HydrophobicContact CD1-CD2 4.2Å; I275-F329 HydrophobicContact CD1-CE1 3.99Å; I275-F329 HydrophobicContact CD1-CE2 3.23Å; I275-F329 HydrophobicContact CD1-CZ 3.12Å; I275-F329 HydrophobicContact CG1-CD2 4.2Å; I275-F329 HydrophobicContact CG1-CE2 3.52Å; I275-F329 HydrophobicContact CG1-CZ 3.98Å; M326-F329 PolarHBondContact O-N 3.21Å; M326-F329 VanDerWaalsContact O-N 3.08Å; L327-F329 PolarHBondContact O-N 2.96Å; L327-F329 VanDerWaalsContact O-N 3.17Å; F329-N331 PolarHBondContact O-N 2.75Å |
| 330 | V | 56.8 | Low | 61 | Low | 101 Ų | 101 | 67.2 Ų | 67.2 | 61% | 0.612 | 35% | 0.354 | S | S | * | . | S | Bend | trans | -76.3 | 90.3 | 169.8 | -176.9 | 0 | 0 | 0 | 0 | 105.2 | L327 P332 | L327-V330 PolarHBondContact O-N 2.92Å; L327-V330 VanDerWaalsContact O-N 3.12Å; V330-P332 WeakPolarHBondContact O-CD 3.43Å |
| 331 | N | 49.6 | Very low | 62.3 | Low | 139 Ų | 139 | 68.9 Ų | 68.9 | 74% | 0.743 | 37% | 0.366 | S | S | * | . | trans | -44.8 | 114.6 | 179.6 | -162.5 | 25.1 | 0 | 0 | 0 | 108.1 | F329 G333 | F329-N331 PolarHBondContact O-N 2.75Å; N331-G333 PolarHBondContact O-N 3.48Å | ||
| 332 | P | 56.7 | Low | 63.2 | Low | 33 Ų | 33 | 70.1 Ų | 70.1 | 21% | 0.214 | 37% | 0.371 | C | S | . | . | trans | -58.9 | 129.8 | 166.5 | 26.9 | -30.8 | 0 | 0 | 0 | 104.8 | V330 Q339 | V330-P332 WeakPolarHBondContact O-CD 3.43Å; P332-Q339 HydrophobicContact CB-CG 3.83Å; P332-Q339 HydrophobicContact CG-CG 3.89Å | ||
| 333 | G | 54.8 | Low | 64.1 | Low | 35 Ų | 35 | 73 Ų | 73 | 36% | 0.361 | 39% | 0.386 | S | S | . | . | trans | -53.7 | 176.8 | 178.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | N331 D335 Q339 | N331-G333 PolarHBondContact O-N 3.48Å; G333-D335 PolarHBondContact O-N 3.46Å; G333-Q339 PolarHBondContact O-NE2 3.19Å | ||
| 334 | E | 59.6 | Low | 65.2 | Low | 189 Ų | 189 | 73.9 Ų | 73.9 | 88% | 0.883 | 39% | 0.387 | S | S | * | . | S | Bend | trans | -60.8 | -3.8 | 175.6 | -65.1 | 176.3 | 174.2 | 0 | 0 | 113.1 | D336 | E334-D336 PolarHBondContact O-N 3.26Š|
| 335 | D | 69.1 | Low | 66 | Low | 106 Ų | 106 | 78.8 Ų | 78.8 | 57% | 0.567 | 41% | 0.408 | S | S | * | . | trans | -72.4 | 120.5 | 177.3 | -54.9 | -45.4 | 0 | 0 | 0 | 113.3 | G333 I337 S338 Q339 | G333-D335 PolarHBondContact O-N 3.46Å; D335-I337 VanDerWaalsContact C-N 3.3Å; D335-I337 PolarHBondContact O-N 3.11Å; D335-S338 WeakPolarHBondContact O-CB 3.36Å; D335-S338 PolarHBondContact O-N 3.07Å; D335-S338 VanDerWaalsContact O-N 3.14Å; D335-Q339 PolarHBondContact O-N 2.96Å | ||
| 336 | D | 69.3 | Low | 66.7 | Low | 71 Ų | 71 | 78.2 Ų | 78.2 | 38% | 0.38 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -54.7 | -41.7 | 178.5 | -58.8 | -41.9 | 0 | 0 | 0 | 113.6 | Y111 E334 S338 Q339 I340 | Y111-D336 WeakPolarHBondContact OH-CA 2.83Å; Y111-D336 WeakPolarHBondContact OH-CB 3.27Å; Y111-D336 PolarHBondContact OH-OD1 3.39Å; E334-D336 PolarHBondContact O-N 3.26Å; D336-S338 PolarHBondContact O-N 3.29Å; D336-Q339 PolarHBondContact O-N 2.86Å; D336-I340 WeakPolarHBondContact O-CD1 3.44Å; D336-I340 VanDerWaalsContact O-CG1 3.27Å; D336-I340 WeakPolarHBondContact O-CG1 3.33Å; D336-I340 PolarHBondContact O-N 3.47Å; D336-I340 VanDerWaalsContact O-N 3.08Å |
| 337 | I | 73.4 | Confident | 67.9 | Low | 131 Ų | 131 | 77.4 Ų | 77.4 | 67% | 0.672 | 41% | 0.405 | S | S | * | . | H | α-helix | trans | -66.1 | -40.4 | -178.1 | -59.8 | 173.8 | 0 | 0 | 0 | 110.8 | D335 I340 V341 | D335-I337 VanDerWaalsContact C-N 3.3Å; D335-I337 PolarHBondContact O-N 3.11Å; I337-I340 PolarHBondContact O-N 3.46Å; I337-V341 HydrophobicContact CG2-CG2 4.34Å; I337-V341 WeakPolarHBondContact O-CG2 3.14Å; I337-V341 PolarHBondContact O-N 3.33Å |
| 338 | S | 73.4 | Confident | 69.1 | Low | 54 Ų | 54 | 78.7 Ų | 78.7 | 38% | 0.378 | 41% | 0.409 | S | S | . | . | H | α-helix | trans | -65.1 | -41.4 | -179.6 | -67.4 | 0 | 0 | 0 | 0 | 110.7 | D335 D336 F342 | D335-S338 WeakPolarHBondContact O-CB 3.36Å; D335-S338 PolarHBondContact O-N 3.07Å; D335-S338 VanDerWaalsContact O-N 3.14Å; D336-S338 PolarHBondContact O-N 3.29Å; S338-F342 WeakPolarHBondContact O-CB 3.42Å; S338-F342 PolarHBondContact O-N 2.81Å |
| 339 | Q | 73.2 | Confident | 70.3 | Confident | 67 Ų | 67 | 75.6 Ų | 75.6 | 31% | 0.313 | 40% | 0.396 | S | S | . | . | H | α-helix | trans | -64.4 | -43.3 | 175.7 | -64.6 | -176.8 | 21.4 | 0 | 0 | 111.9 | P332 G333 D335 D336 F342 I343 | P332-Q339 HydrophobicContact CB-CG 3.83Å; P332-Q339 HydrophobicContact CG-CG 3.89Å; G333-Q339 PolarHBondContact O-NE2 3.19Å; D335-Q339 PolarHBondContact O-N 2.96Å; D336-Q339 PolarHBondContact O-N 2.86Å; Q339-F342 WeakPolarHBondContact O-CB 3.48Å; Q339-F342 PolarHBondContact O-N 3.02Å; Q339-I343 WeakPolarHBondContact O-CD1 3.35Å; Q339-I343 VanDerWaalsContact O-CG1 3.25Å; Q339-I343 WeakPolarHBondContact O-CG1 3.11Å; Q339-I343 PolarHBondContact O-N 2.66Å |
| 340 | I | 75.5 | Confident | 71.6 | Confident | 31 Ų | 31 | 71.8 Ų | 71.8 | 16% | 0.159 | 38% | 0.38 | C | S | . | . | H | α-helix | trans | -63.9 | -49.6 | 179.4 | -67.2 | 165 | 0 | 0 | 0 | 110.9 | Y111 H114 D336 I337 F342 I343 Y344 | Y111-I340 HydrophobicContact CD1-CD1 4.47Å; Y111-I340 HydrophobicContact CD1-CG1 4.17Å; Y111-I340 HydrophobicContact CE1-CD1 4.07Å; Y111-I340 HydrophobicContact CE1-CG1 3.82Å; H114-I340 HydrophobicContact CB-CG2 4.25Å; D336-I340 WeakPolarHBondContact O-CD1 3.44Å; D336-I340 VanDerWaalsContact O-CG1 3.27Å; D336-I340 WeakPolarHBondContact O-CG1 3.33Å; D336-I340 PolarHBondContact O-N 3.47Å; D336-I340 VanDerWaalsContact O-N 3.08Å; I337-I340 PolarHBondContact O-N 3.46Å; I340-F342 VanDerWaalsContact C-N 3.27Å; I340-F342 PolarHBondContact O-N 2.94Å; I340-I343 PolarHBondContact O-N 2.97Å; I340-Y344 HydrophobicContact CG2-CD2 3.75Å; I340-Y344 HydrophobicContact CG2-CE2 3.53Å; I340-Y344 WeakPolarHBondContact O-CD2 3.3Å; I340-Y344 PolarHBondContact O-N 2.96Å; I340-Y344 VanDerWaalsContact O-N 3.11Å |
| 341 | V | 77.7 | Confident | 73.1 | Confident | 90 Ų | 90 | 67 Ų | 67 | 55% | 0.545 | 35% | 0.351 | S | S | . | . | H | α-helix | trans | -60.4 | -41.7 | 178.1 | 172 | 0 | 0 | 0 | 0 | 110.8 | I337 Y344 F345 | I337-V341 HydrophobicContact CG2-CG2 4.34Å; I337-V341 WeakPolarHBondContact O-CG2 3.14Å; I337-V341 PolarHBondContact O-N 3.33Å; V341-Y344 PolarHBondContact O-N 3.5Å; V341-F345 WeakPolarHBondContact O-CB 3.39Å; V341-F345 PolarHBondContact O-N 3.3Å |
| 342 | F | 76.1 | Confident | 74.8 | Confident | 43 Ų | 43 | 61.9 Ų | 61.9 | 19% | 0.189 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -57.8 | -49 | 176.9 | -180 | -89.4 | 0 | 0 | 0 | 112.2 | L327 F328 S338 Q339 I340 Y344 F345 N346 | L327-F342 VanDerWaalsContact C-CE2 3.4Å; L327-F342 VanDerWaalsContact C-CZ 3.49Å; L327-F342 HydrophobicContact CB-CE2 3.6Å; L327-F342 HydrophobicContact CB-CZ 4.17Å; L327-F342 WeakPolarHBondContact O-CE2 3.36Å; L327-F342 WeakPolarHBondContact O-CZ 3.44Å; F328-F342 HydrophobicContact CB-CZ 4.43Å; F328-F342 HydrophobicContact CD2-CE1 4.49Å; S338-F342 WeakPolarHBondContact O-CB 3.42Å; S338-F342 PolarHBondContact O-N 2.81Å; Q339-F342 WeakPolarHBondContact O-CB 3.48Å; Q339-F342 PolarHBondContact O-N 3.02Å; I340-F342 VanDerWaalsContact C-N 3.27Å; I340-F342 PolarHBondContact O-N 2.94Å; F342-Y344 PolarHBondContact O-N 2.98Å; F342-F345 PolarHBondContact O-N 2.89Å; F342-N346 HydrophobicContact CE1-CB 4.43Å; F342-N346 VanDerWaalsContact O-CB 3.24Å; F342-N346 WeakPolarHBondContact O-CB 3.17Å; F342-N346 PolarHBondContact O-N 2.69Å |
| 343 | I | 76.3 | Confident | 76.2 | Confident | 64 Ų | 64 | 60.3 Ų | 60.3 | 33% | 0.328 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -59.7 | -49.3 | 179.1 | -69.4 | 163 | 0 | 0 | 0 | 110.2 | A118 Q339 I340 F345 N346 S347 | A118-I343 HydrophobicContact CB-CG2 3.9Å; Q339-I343 WeakPolarHBondContact O-CD1 3.35Å; Q339-I343 VanDerWaalsContact O-CG1 3.25Å; Q339-I343 WeakPolarHBondContact O-CG1 3.11Å; Q339-I343 PolarHBondContact O-N 2.66Å; I340-I343 PolarHBondContact O-N 2.97Å; I343-F345 PolarHBondContact O-N 2.98Å; I343-N346 PolarHBondContact O-N 2.85Å; I343-S347 VanDerWaalsContact O-CB 3.31Å; I343-S347 WeakPolarHBondContact O-CB 3.35Å; I343-S347 PolarHBondContact O-N 2.91Å; I343-S347 PolarHBondContact O-OG 2.74Å |
| 344 | Y | 81.3 | Confident | 77.7 | Confident | 55 Ų | 55 | 58.6 Ų | 58.6 | 22% | 0.216 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -60.6 | -47.6 | 179.4 | -81 | -65.2 | 0 | 0 | 0 | 113 | H114 I117 A118 I121 I340 V341 F342 S347 F348 | H114-Y344 WeakPolarHBondContact CA-OH 3.34Å; H114-Y344 HydrophobicContact CB-CE2 4.14Å; H114-Y344 AromaticContact ND1-CE2 3.58Å; H114-Y344 AromaticContact ND1-CZ 3.71Å; H114-Y344 PolarHBondContact ND1-OH 3.44Å; H114-Y344 PolarHBondContact O-OH 3.07Å; I117-Y344 HydrophobicContact CB-CE1 4.19Å; I117-Y344 HydrophobicContact CG2-CE1 3.84Å; A118-Y344 HydrophobicContact CB-CD1 4.06Å; A118-Y344 HydrophobicContact CB-CE1 4Å; I121-Y344 HydrophobicContact CD1-CD1 3.88Å; I121-Y344 HydrophobicContact CD1-CE1 3.93Å; I340-Y344 HydrophobicContact CG2-CD2 3.75Å; I340-Y344 HydrophobicContact CG2-CE2 3.53Å; I340-Y344 WeakPolarHBondContact O-CD2 3.3Å; I340-Y344 PolarHBondContact O-N 2.96Å; I340-Y344 VanDerWaalsContact O-N 3.11Å; V341-Y344 PolarHBondContact O-N 3.5Å; F342-Y344 PolarHBondContact O-N 2.98Å; Y344-S347 PolarHBondContact O-N 3.46Å; Y344-F348 WeakPolarHBondContact O-CB 3.43Å; Y344-F348 PolarHBondContact O-N 3.43Å |
| 345 | F | 78.8 | Confident | 79.1 | Confident | 107 Ų | 107 | 52.6 Ų | 52.6 | 47% | 0.469 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -63.8 | -44.1 | -178.9 | -173.8 | -105.5 | 0 | 0 | 0 | 111.4 | L327 V341 F342 I343 F348 L349 | L327-F345 HydrophobicContact CD1-CD1 4.02Å; L327-F345 HydrophobicContact CD1-CE1 3.72Å; V341-F345 WeakPolarHBondContact O-CB 3.39Å; V341-F345 PolarHBondContact O-N 3.3Å; F342-F345 PolarHBondContact O-N 2.89Å; I343-F345 PolarHBondContact O-N 2.98Å; F345-F348 PolarHBondContact O-N 2.74Å; F345-L349 HydrophobicContact CD1-CD1 3.75Å; F345-L349 HydrophobicContact CD2-CD1 4.36Å; F345-L349 HydrophobicContact CE1-CD1 3.21Å; F345-L349 HydrophobicContact CE1-CG 4.31Å; F345-L349 HydrophobicContact CE2-CD1 3.89Å; F345-L349 HydrophobicContact CE2-CG 4.4Å; F345-L349 HydrophobicContact CG-CD1 4.32Å; F345-L349 HydrophobicContact CZ-CD1 3.31Å; F345-L349 HydrophobicContact CZ-CG 4.28Å; F345-L349 WeakPolarHBondContact O-CG 3.33Å; F345-L349 PolarHBondContact O-N 3.45Å |
| 346 | N | 76.9 | Confident | 79.8 | Confident | 27 Ų | 27 | 49.9 Ų | 49.9 | 14% | 0.144 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -65 | -46.1 | 177.3 | -174.5 | 49.4 | 0 | 0 | 0 | 111.7 | F342 I343 F348 L349 Q350 | F342-N346 HydrophobicContact CE1-CB 4.43Å; F342-N346 VanDerWaalsContact O-CB 3.24Å; F342-N346 WeakPolarHBondContact O-CB 3.17Å; F342-N346 PolarHBondContact O-N 2.69Å; I343-N346 PolarHBondContact O-N 2.85Å; N346-F348 VanDerWaalsContact C-N 3.33Å; N346-F348 PolarHBondContact O-N 2.92Å; N346-L349 PolarHBondContact O-N 3.04Å; N346-Q350 WeakPolarHBondContact O-CB 3.21Å; N346-Q350 PolarHBondContact O-N 3.48Å |
| 347 | S | 81.3 | Confident | 80.5 | Confident | 20 Ų | 20 | 46.8 Ų | 46.8 | 14% | 0.14 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -59.2 | -43.1 | 176.1 | -67.3 | 0 | 0 | 0 | 0 | 112.2 | N122 I343 Y344 S351 | N122-S347 PolarHBondContact OD1-O 3.25Å; I343-S347 VanDerWaalsContact O-CB 3.31Å; I343-S347 WeakPolarHBondContact O-CB 3.35Å; I343-S347 PolarHBondContact O-N 2.91Å; I343-S347 PolarHBondContact O-OG 2.74Å; Y344-S347 PolarHBondContact O-N 3.46Å; S347-S351 VanDerWaalsContact O-CB 3.3Å; S347-S351 WeakPolarHBondContact O-CB 3.45Å; S347-S351 PolarHBondContact O-N 3.37Å; S347-S351 VanDerWaalsContact O-N 3.13Å; S347-S351 PolarHBondContact O-OG 2.81Å |
| 348 | F | 83.7 | Confident | 81 | Confident | 83 Ų | 83 | 40.5 Ų | 40.5 | 36% | 0.364 | 20% | 0.201 | S | C | . | . | H | α-helix | trans | -63.6 | -52.3 | 176.3 | 177.2 | -98.2 | 0 | 0 | 0 | 111.4 | I121 Y344 F345 N346 Q350 S351 F352 F356 | I121-F348 HydrophobicContact CG2-CD2 4.49Å; Y344-F348 WeakPolarHBondContact O-CB 3.43Å; Y344-F348 PolarHBondContact O-N 3.43Å; F345-F348 PolarHBondContact O-N 2.74Å; N346-F348 VanDerWaalsContact C-N 3.33Å; N346-F348 PolarHBondContact O-N 2.92Å; F348-Q350 PolarHBondContact O-N 2.96Å; F348-S351 PolarHBondContact O-N 3.5Å; F348-S351 PolarHBondContact O-OG 3.32Å; F348-F352 AromaticContact CD2-CD2 3.51Å; F348-F352 HydrophobicContact CD2-CD2 3.51Å; F348-F352 AromaticContact CD2-CE2 3.58Å; F348-F352 HydrophobicContact CD2-CE2 3.58Å; F348-F352 AromaticContact CE2-CD2 3.47Å; F348-F352 HydrophobicContact CE2-CD2 3.47Å; F348-F352 VanDerWaalsContact CE2-CD2 3.47Å; F348-F352 AromaticContact CE2-CE2 3.52Å; F348-F352 HydrophobicContact CE2-CE2 3.52Å; F348-F352 HydrophobicContact CE2-CG 4.13Å; F348-F352 HydrophobicContact CE2-CZ 4.19Å; F348-F352 HydrophobicContact CG-CD2 4.18Å; F348-F352 HydrophobicContact CZ-CD2 4.12Å; F348-F352 HydrophobicContact CZ-CE2 4.5Å; F348-F352 HydrophobicContact CZ-CG 4.38Å; F348-F352 VanDerWaalsContact O-CD2 3.31Å; F348-F352 WeakPolarHBondContact O-CD2 3.49Å; F348-F352 PolarHBondContact O-N 3.42Å; F348-F356 HydrophobicContact CE1-CZ 4.43Å; F348-F356 HydrophobicContact CZ-CZ 4.47Å |
| 349 | L | 81 | Confident | 81.5 | Confident | 34 Ų | 34 | 39.3 Ų | 39.3 | 18% | 0.178 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -67.7 | -37.8 | -175.9 | -67.6 | -178.4 | 0 | 0 | 0 | 112.9 | T324 F345 N346 Q353 | T324-L349 HydrophobicContact CG2-CB 3.68Å; T324-L349 HydrophobicContact CG2-CD1 3.28Å; T324-L349 HydrophobicContact CG2-CG 4.11Å; F345-L349 HydrophobicContact CD1-CD1 3.75Å; F345-L349 HydrophobicContact CD2-CD1 4.36Å; F345-L349 HydrophobicContact CE1-CD1 3.21Å; F345-L349 HydrophobicContact CE1-CG 4.31Å; F345-L349 HydrophobicContact CE2-CD1 3.89Å; F345-L349 HydrophobicContact CE2-CG 4.4Å; F345-L349 HydrophobicContact CG-CD1 4.32Å; F345-L349 HydrophobicContact CZ-CD1 3.31Å; F345-L349 HydrophobicContact CZ-CG 4.28Å; F345-L349 WeakPolarHBondContact O-CG 3.33Å; F345-L349 PolarHBondContact O-N 3.45Å; N346-L349 PolarHBondContact O-N 3.04Å; L349-Q353 WeakPolarHBondContact O-CA 3.42Å; L349-Q353 VanDerWaalsContact O-CB 3.23Å; L349-Q353 WeakPolarHBondContact O-CB 3.48Å; L349-Q353 PolarHBondContact O-N 2.95Å |
| 350 | Q | 80.1 | Confident | 81.8 | Confident | 28 Ų | 28 | 38.4 Ų | 38.4 | 13% | 0.131 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -68.8 | -36.9 | 179.4 | -171.4 | 174.5 | -3.8 | 0 | 0 | 112.4 | R164 Y325 N346 F348 Q353 | R164-Q350 PolarHBondContact NH2-O 2.63Å; Y325-Q350 HydrophobicContact CE2-CG 4.5Å; Y325-Q350 PolarHBondContact OH-NE2 3.08Å; N346-Q350 WeakPolarHBondContact O-CB 3.21Å; N346-Q350 PolarHBondContact O-N 3.48Å; F348-Q350 PolarHBondContact O-N 2.96Å; Q350-Q353 WeakPolarHBondContact O-CB 3.17Å |
| 351 | S | 87.1 | Confident | 81.8 | Confident | 0 Ų | 0 | 38.1 Ų | 38.1 | 0% | 0 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -73.3 | -44 | 177.9 | 55.4 | 0 | 0 | 0 | 0 | 113 | N122 S129 S347 F348 Q353 | N122-S351 WeakPolarHBondContact O-CB 3.21Å; N122-S351 WeakPolarHBondContact OD1-CB 3.44Å; S129-S351 WeakPolarHBondContact CB-O 3.34Å; S347-S351 VanDerWaalsContact O-CB 3.3Å; S347-S351 WeakPolarHBondContact O-CB 3.45Å; S347-S351 PolarHBondContact O-N 3.37Å; S347-S351 VanDerWaalsContact O-N 3.13Å; S347-S351 PolarHBondContact O-OG 2.81Å; F348-S351 PolarHBondContact O-N 3.5Å; F348-S351 PolarHBondContact O-OG 3.32Å; S351-Q353 VanDerWaalsContact C-N 3.31Å; S351-Q353 PolarHBondContact O-N 3.43Å |
| 352 | F | 86.3 | Confident | 81.9 | Confident | 31 Ų | 31 | 33.9 Ų | 33.9 | 14% | 0.136 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -84.2 | -3.9 | -179.7 | -73.7 | -88.5 | 0 | 0 | 0 | 114 | I128 F348 G354 F355 F356 | I128-F352 HydrophobicContact CB-CE1 4.39Å; I128-F352 HydrophobicContact CD1-CE1 3.88Å; I128-F352 HydrophobicContact CD1-CZ 4.1Å; I128-F352 HydrophobicContact CG2-CE1 4.3Å; F348-F352 AromaticContact CD2-CD2 3.51Å; F348-F352 HydrophobicContact CD2-CD2 3.51Å; F348-F352 AromaticContact CD2-CE2 3.58Å; F348-F352 HydrophobicContact CD2-CE2 3.58Å; F348-F352 AromaticContact CE2-CD2 3.47Å; F348-F352 HydrophobicContact CE2-CD2 3.47Å; F348-F352 VanDerWaalsContact CE2-CD2 3.47Å; F348-F352 AromaticContact CE2-CE2 3.52Å; F348-F352 HydrophobicContact CE2-CE2 3.52Å; F348-F352 HydrophobicContact CE2-CG 4.13Å; F348-F352 HydrophobicContact CE2-CZ 4.19Å; F348-F352 HydrophobicContact CG-CD2 4.18Å; F348-F352 HydrophobicContact CZ-CD2 4.12Å; F348-F352 HydrophobicContact CZ-CE2 4.5Å; F348-F352 HydrophobicContact CZ-CG 4.38Å; F348-F352 VanDerWaalsContact O-CD2 3.31Å; F348-F352 WeakPolarHBondContact O-CD2 3.49Å; F348-F352 PolarHBondContact O-N 3.42Å; F352-G354 PolarHBondContact O-N 2.71Å; F352-F355 HydrophobicContact CD1-CB 4.42Å; F352-F355 HydrophobicContact CD1-CD1 4.24Å; F352-F355 HydrophobicContact CD1-CG 4.48Å; F352-F355 WeakPolarHBondContact O-CA 3.43Å; F352-F355 VanDerWaalsContact O-CB 3.3Å; F352-F355 WeakPolarHBondContact O-CB 3.47Å; F352-F355 PolarHBondContact O-N 3.43Å; F352-F356 HydrophobicContact CB-CD2 4.07Å; F352-F356 HydrophobicContact CB-CE2 3.54Å; F352-F356 HydrophobicContact CB-CZ 4.1Å; F352-F356 WeakPolarHBondContact O-CD2 3.4Å; F352-F356 PolarHBondContact O-N 3.04Å |
| 353 | Q | 85.3 | Confident | 82.2 | Confident | 0 Ų | 0 | 34.9 Ų | 34.9 | 0% | 0 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -49.2 | -53.1 | 179.2 | 163.8 | 166.7 | 26.1 | 0 | 0 | 113 | F161 M204 L321 L349 Q350 S351 F355 F356 V357 | F161-Q353 HydrophobicContact CD1-CG 4.29Å; F161-Q353 HydrophobicContact CE1-CG 3.39Å; F161-Q353 HydrophobicContact CZ-CG 3.82Å; M204-Q353 PolarHBondContact SD-NE2 2.85Å; M204-Q353 VanDerWaalsContact SD-NE2 3.41Å; L321-Q353 HydrophobicContact CB-CG 4.16Å; L321-Q353 HydrophobicContact CD1-CG 3.67Å; L321-Q353 HydrophobicContact CD2-CB 3.54Å; L321-Q353 HydrophobicContact CD2-CG 3.31Å; L321-Q353 HydrophobicContact CG-CG 3.83Å; L321-Q353 PolarHBondContact O-NE2 3.48Å; L349-Q353 WeakPolarHBondContact O-CA 3.42Å; L349-Q353 VanDerWaalsContact O-CB 3.23Å; L349-Q353 WeakPolarHBondContact O-CB 3.48Å; L349-Q353 PolarHBondContact O-N 2.95Å; Q350-Q353 WeakPolarHBondContact O-CB 3.17Å; S351-Q353 VanDerWaalsContact C-N 3.31Å; S351-Q353 PolarHBondContact O-N 3.43Å; Q353-F355 VanDerWaalsContact C-N 3.31Å; Q353-F355 PolarHBondContact O-N 3.46Å; Q353-F356 PolarHBondContact O-N 3.3Å; Q353-V357 WeakPolarHBondContact O-CG2 3.43Å; Q353-V357 PolarHBondContact O-N 3.29Å; Q353-V357 VanDerWaalsContact O-N 3.09Å |
| 354 | G | 87.2 | Confident | 82.3 | Confident | 0 Ų | 0 | 36.4 Ų | 36.4 | 0% | 0 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -68.1 | -30.5 | -179.7 | 0 | 0 | 0 | 0 | 0 | 113.1 | S129 F352 V357 S358 | S129-G354 VanDerWaalsContact OG-C 3.27Å; S129-G354 WeakPolarHBondContact OG-CA 3.08Å; F352-G354 PolarHBondContact O-N 2.71Å; G354-V357 PolarHBondContact O-N 2.89Å; G354-S358 PolarHBondContact O-N 3.05Å; G354-S358 PolarHBondContact O-OG 3.5Å |
| 355 | F | 88.2 | Confident | 82.2 | Confident | 62 Ų | 62 | 35.4 Ų | 35.4 | 27% | 0.272 | 17% | 0.168 | S | C | . | . | H | α-helix | trans | -61.2 | -52.3 | 172.2 | 169.8 | -101.1 | 0 | 0 | 0 | 110.5 | I128 S129 A132 F352 Q353 V357 S358 V359 | I128-F355 HydrophobicContact CG2-CD2 3.86Å; I128-F355 HydrophobicContact CG2-CE2 4.26Å; I128-F355 HydrophobicContact CG2-CG 4.34Å; S129-F355 PolarHBondContact OG-N 3.32Å; S129-F355 VanDerWaalsContact OG-N 3.1Å; A132-F355 HydrophobicContact CB-CD2 3.79Å; A132-F355 HydrophobicContact CB-CE2 4.45Å; F352-F355 HydrophobicContact CD1-CB 4.42Å; F352-F355 HydrophobicContact CD1-CD1 4.24Å; F352-F355 HydrophobicContact CD1-CG 4.48Å; F352-F355 WeakPolarHBondContact O-CA 3.43Å; F352-F355 VanDerWaalsContact O-CB 3.3Å; F352-F355 WeakPolarHBondContact O-CB 3.47Å; F352-F355 PolarHBondContact O-N 3.43Å; Q353-F355 VanDerWaalsContact C-N 3.31Å; Q353-F355 PolarHBondContact O-N 3.46Å; F355-V357 VanDerWaalsContact C-N 3.33Å; F355-V357 PolarHBondContact O-N 3.16Å; F355-S358 PolarHBondContact O-N 3.01Å; F355-S358 VanDerWaalsContact O-N 3.14Å; F355-S358 PolarHBondContact O-OG 2.95Å; F355-V359 HydrophobicContact CD1-CG2 4.42Å; F355-V359 HydrophobicContact CD2-CG2 4.2Å; F355-V359 HydrophobicContact CE1-CG2 4.03Å; F355-V359 HydrophobicContact CE2-CG2 3.78Å; F355-V359 HydrophobicContact CZ-CG2 3.69Å; F355-V359 WeakPolarHBondContact O-CG2 3.26Å; F355-V359 PolarHBondContact O-N 3.44Å |
| 356 | F | 84.5 | Confident | 82.2 | Confident | 50 Ų | 50 | 32.8 Ų | 32.8 | 22% | 0.219 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -58.8 | -44 | 178.3 | -64.6 | -54.6 | 0 | 0 | 0 | 112 | L317 F348 F352 Q353 S358 V359 F360 | L317-F356 HydrophobicContact CD2-CB 4.33Å; L317-F356 HydrophobicContact CD2-CD1 4.39Å; L317-F356 HydrophobicContact CD2-CG 4.26Å; F348-F356 HydrophobicContact CE1-CZ 4.43Å; F348-F356 HydrophobicContact CZ-CZ 4.47Å; F352-F356 HydrophobicContact CB-CD2 4.07Å; F352-F356 HydrophobicContact CB-CE2 3.54Å; F352-F356 HydrophobicContact CB-CZ 4.1Å; F352-F356 WeakPolarHBondContact O-CD2 3.4Å; F352-F356 PolarHBondContact O-N 3.04Å; Q353-F356 PolarHBondContact O-N 3.3Å; F356-S358 PolarHBondContact O-N 3.39Å; F356-V359 PolarHBondContact O-N 3.01Å; F356-F360 HydrophobicContact CB-CD2 4.29Å; F356-F360 HydrophobicContact CB-CE2 4.19Å; F356-F360 HydrophobicContact CD1-CE2 4.37Å; F356-F360 WeakPolarHBondContact O-CD2 3.33Å; F356-F360 PolarHBondContact O-N 2.86Å |
| 357 | V | 83 | Confident | 82.3 | Confident | 5 Ų | 5 | 35.7 Ų | 35.7 | 3% | 0.03 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -55 | -49.8 | 174.6 | 172.2 | 0 | 0 | 0 | 0 | 111.1 | I158 F161 L321 Q353 G354 F355 V359 F360 Y361 | I158-V357 HydrophobicContact CG1-CG1 4.49Å; F161-V357 HydrophobicContact CD2-CG1 4.2Å; F161-V357 HydrophobicContact CD2-CG2 4.43Å; F161-V357 HydrophobicContact CE2-CB 4.37Å; F161-V357 HydrophobicContact CE2-CG1 4.09Å; F161-V357 HydrophobicContact CE2-CG2 3.76Å; F161-V357 HydrophobicContact CZ-CG2 4.03Å; L321-V357 HydrophobicContact CD1-CG2 3.2Å; Q353-V357 WeakPolarHBondContact O-CG2 3.43Å; Q353-V357 PolarHBondContact O-N 3.29Å; Q353-V357 VanDerWaalsContact O-N 3.09Å; G354-V357 PolarHBondContact O-N 2.89Å; F355-V357 VanDerWaalsContact C-N 3.33Å; F355-V357 PolarHBondContact O-N 3.16Å; V357-V359 VanDerWaalsContact C-N 3.35Å; V357-V359 PolarHBondContact O-N 3.45Å; V357-F360 PolarHBondContact O-N 3.19Å; V357-Y361 HydrophobicContact CB-CD2 4.37Å; V357-Y361 HydrophobicContact CG1-CD2 3.68Å; V357-Y361 HydrophobicContact CG1-CE2 4.21Å; V357-Y361 WeakPolarHBondContact O-CB 3.45Å; V357-Y361 WeakPolarHBondContact O-CD2 3.2Å; V357-Y361 PolarHBondContact O-N 3.32Å |
| 358 | S | 84.8 | Confident | 82.3 | Confident | 0 Ų | 0 | 35 Ų | 35 | 0% | 0 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -62.9 | -40.3 | -179.3 | 72.4 | 0 | 0 | 0 | 0 | 112.6 | A132 G354 F355 F356 C362 F363 | A132-S358 WeakPolarHBondContact CB-OG 3.37Å; G354-S358 PolarHBondContact O-N 3.05Å; G354-S358 PolarHBondContact O-OG 3.5Å; F355-S358 PolarHBondContact O-N 3.01Å; F355-S358 VanDerWaalsContact O-N 3.14Å; F355-S358 PolarHBondContact O-OG 2.95Å; F356-S358 PolarHBondContact O-N 3.39Å; S358-C362 WeakPolarHBondContact O-CA 3.45Å; S358-C362 WeakPolarHBondContact O-CB 3.47Å; S358-C362 PolarHBondContact O-N 3.22Å; S358-F363 PolarHBondContact O-N 3.45Å; S358-F363 VanDerWaalsContact O-N 3.1Å |
| 359 | V | 83.4 | Confident | 82.3 | Confident | 29 Ų | 29 | 37.8 Ų | 37.8 | 18% | 0.176 | 19% | 0.187 | C | C | . | . | I | π-helix | trans | -64.2 | -49.6 | 178.8 | 171.3 | 0 | 0 | 0 | 0 | 110.5 | F355 F356 V357 F363 L364 | F355-V359 HydrophobicContact CD1-CG2 4.42Å; F355-V359 HydrophobicContact CD2-CG2 4.2Å; F355-V359 HydrophobicContact CE1-CG2 4.03Å; F355-V359 HydrophobicContact CE2-CG2 3.78Å; F355-V359 HydrophobicContact CZ-CG2 3.69Å; F355-V359 WeakPolarHBondContact O-CG2 3.26Å; F355-V359 PolarHBondContact O-N 3.44Å; F356-V359 PolarHBondContact O-N 3.01Å; V357-V359 VanDerWaalsContact C-N 3.35Å; V357-V359 PolarHBondContact O-N 3.45Å; V359-F363 HydrophobicContact CB-CD2 4.48Å; V359-F363 HydrophobicContact CG2-CD2 4.01Å; V359-F363 PolarHBondContact O-N 3.16Å; V359-L364 HydrophobicContact CG1-CD1 3.67Å; V359-L364 HydrophobicContact CG1-CG 3.88Å; V359-L364 WeakPolarHBondContact O-CB 3.26Å; V359-L364 WeakPolarHBondContact O-CG 3.3Å; V359-L364 PolarHBondContact O-N 3.37Å |
| 360 | F | 79 | Confident | 82.4 | Confident | 47 Ų | 47 | 39.9 Ų | 39.9 | 21% | 0.206 | 20% | 0.204 | C | C | . | . | I | π-helix | trans | -75.5 | -45.7 | -175 | -68.7 | -59.5 | 0 | 0 | 0 | 113.3 | T314 L317 L318 F356 V357 L364 | T314-F360 HydrophobicContact CG2-CD1 3.17Å; T314-F360 HydrophobicContact CG2-CE1 3.33Å; T314-F360 HydrophobicContact CG2-CG 4.02Å; T314-F360 HydrophobicContact CG2-CZ 4.28Å; L317-F360 HydrophobicContact CD2-CD2 4.28Å; L317-F360 HydrophobicContact CD2-CE2 3.42Å; L317-F360 VanDerWaalsContact CD2-CE2 3.42Å; L317-F360 HydrophobicContact CD2-CZ 4.06Å; L318-F360 HydrophobicContact CD1-CB 4.39Å; F356-F360 HydrophobicContact CB-CD2 4.29Å; F356-F360 HydrophobicContact CB-CE2 4.19Å; F356-F360 HydrophobicContact CD1-CE2 4.37Å; F356-F360 WeakPolarHBondContact O-CD2 3.33Å; F356-F360 PolarHBondContact O-N 2.86Å; V357-F360 PolarHBondContact O-N 3.19Å; F360-L364 HydrophobicContact CD1-CD1 3.71Å; F360-L364 HydrophobicContact CE1-CD1 3.81Å |
| 361 | Y | 75.6 | Confident | 82.6 | Confident | 26 Ų | 26 | 39.6 Ų | 39.6 | 10% | 0.102 | 21% | 0.207 | C | C | . | . | I | π-helix | trans | -82.8 | -27 | -175.2 | -71.7 | -63.8 | 0 | 0 | 0 | 114 | H154 E207 L318 V357 N365 | H154-Y361 AromaticContact CE1-CD1 3.54Å; H154-Y361 AromaticContact CE1-CE1 3.4Å; H154-Y361 WeakPolarHBondContact CE1-CE1 3.06Å; H154-Y361 AromaticContact ND1-CD1 3.83Å; H154-Y361 AromaticContact ND1-CE1 3.88Å; E207-Y361 VanDerWaalsContact CD-CZ 3.44Å; E207-Y361 PolarHBondContact OE1-OH 2.94Å; E207-Y361 PolarHBondContact OE2-OH 3.11Å; L318-Y361 HydrophobicContact CD1-CE1 4.01Å; L318-Y361 HydrophobicContact CD1-CE2 3.99Å; L318-Y361 HydrophobicContact CD2-CE1 3.74Å; L318-Y361 WeakPolarHBondContact CD2-OH 3.43Å; L318-Y361 HydrophobicContact CG-CE1 4.06Å; L318-Y361 HydrophobicContact CG-CE2 4.04Å; L318-Y361 VanDerWaalsContact CG-CZ 3.45Å; L318-Y361 WeakPolarHBondContact CG-OH 3.35Å; V357-Y361 HydrophobicContact CB-CD2 4.37Å; V357-Y361 HydrophobicContact CG1-CD2 3.68Å; V357-Y361 HydrophobicContact CG1-CE2 4.21Å; V357-Y361 WeakPolarHBondContact O-CB 3.45Å; V357-Y361 WeakPolarHBondContact O-CD2 3.2Å; V357-Y361 PolarHBondContact O-N 3.32Å; Y361-N365 VanDerWaalsContact O-CB 3.26Å; Y361-N365 WeakPolarHBondContact O-CB 3.46Å; Y361-N365 PolarHBondContact O-ND2 3.49Å; Y361-N365 VanDerWaalsContact O-ND2 3.16Å |
| 362 | C | 80.8 | Confident | 82.4 | Confident | 0 Ų | 0 | 41.2 Ų | 41.2 | 0% | 0 | 22% | 0.22 | C | C | . | . | I | π-helix | trans | -108.8 | -65 | -179.3 | -164.7 | 0 | 0 | 0 | 0 | 112.3 | A136 F140 S358 N365 V368 | A136-C362 HydrophobicContact CB-CB 3.73Å; F140-C362 HydrophobicContact CE2-CB 3.62Å; F140-C362 WeakPolarHBondContact CE2-SG 3.34Å; F140-C362 HydrophobicContact CZ-CB 4Å; S358-C362 WeakPolarHBondContact O-CA 3.45Å; S358-C362 WeakPolarHBondContact O-CB 3.47Å; S358-C362 PolarHBondContact O-N 3.22Å; C362-N365 WeakPolarHBondContact O-CB 3.45Å; C362-N365 PolarHBondContact O-N 3.32Å; C362-V368 WeakPolarHBondContact O-CB 3.49Å |
| 363 | F | 82.8 | Confident | 82.4 | Confident | 65 Ų | 65 | 47 Ų | 47 | 29% | 0.285 | 24% | 0.241 | S | C | . | . | I | π-helix | trans | -73 | -37.1 | -166.1 | -58.1 | -36.3 | 0 | 0 | 0 | 114.2 | A132 V135 A136 L139 S358 V359 R369 | A132-F363 HydrophobicContact CB-CE2 4.24Å; A132-F363 WeakPolarHBondContact O-CZ 3.25Å; V135-F363 HydrophobicContact CB-CE1 4.47Å; V135-F363 HydrophobicContact CB-CZ 4.13Å; V135-F363 HydrophobicContact CG1-CE1 3.89Å; V135-F363 HydrophobicContact CG1-CZ 3.96Å; A136-F363 HydrophobicContact CB-CE1 4.29Å; A136-F363 HydrophobicContact CB-CZ 4.3Å; L139-F363 HydrophobicContact CD1-CD1 4.06Å; L139-F363 HydrophobicContact CD1-CE1 3.79Å; S358-F363 PolarHBondContact O-N 3.45Å; S358-F363 VanDerWaalsContact O-N 3.1Å; V359-F363 HydrophobicContact CB-CD2 4.48Å; V359-F363 HydrophobicContact CG2-CD2 4.01Å; V359-F363 PolarHBondContact O-N 3.16Å; F363-R369 WeakPolarHBondContact O-CD 3.47Å; F363-R369 WeakPolarHBondContact O-CG 3.02Å |
| 364 | L | 78.1 | Confident | 82.4 | Confident | 95 Ų | 95 | 53.5 Ų | 53.5 | 50% | 0.497 | 27% | 0.27 | S | S | . | . | S | Bend | trans | -87.9 | -7.7 | 177.5 | -64.4 | -179.6 | 0 | 0 | 0 | 112.7 | V359 F360 G366 | V359-L364 HydrophobicContact CG1-CD1 3.67Å; V359-L364 HydrophobicContact CG1-CG 3.88Å; V359-L364 WeakPolarHBondContact O-CB 3.26Å; V359-L364 WeakPolarHBondContact O-CG 3.3Å; V359-L364 PolarHBondContact O-N 3.37Å; F360-L364 HydrophobicContact CD1-CD1 3.71Å; F360-L364 HydrophobicContact CE1-CD1 3.81Å; L364-G366 PolarHBondContact O-N 3.4Å |
| 365 | N | 78.8 | Confident | 82.2 | Confident | 35 Ų | 35 | 59.8 Ų | 59.8 | 19% | 0.187 | 29% | 0.293 | C | S | . | . | trans | -69.6 | 117.5 | -179.4 | -171.5 | -31.3 | 0 | 0 | 0 | 110.8 | Y361 C362 E367 V368 R369 | Y361-N365 VanDerWaalsContact O-CB 3.26Å; Y361-N365 WeakPolarHBondContact O-CB 3.46Å; Y361-N365 PolarHBondContact O-ND2 3.49Å; Y361-N365 VanDerWaalsContact O-ND2 3.16Å; C362-N365 WeakPolarHBondContact O-CB 3.45Å; C362-N365 PolarHBondContact O-N 3.32Å; N365-E367 VanDerWaalsContact C-N 3.27Å; N365-E367 PolarHBondContact O-N 2.88Å; N365-E367 WeakPolarHBondContact OD1-CB 3.33Å; N365-E367 PolarHBondContact OD1-N 2.03Å; N365-V368 HydrophobicContact CB-CB 4.16Å; N365-V368 HydrophobicContact CB-CG2 3.91Å; N365-V368 PolarHBondContact O-N 2.96Å; N365-R369 WeakPolarHBondContact O-CG 3.46Å; N365-R369 PolarHBondContact O-N 3.27Å | ||
| 366 | G | 77.9 | Confident | 82.1 | Confident | 51 Ų | 51 | 63.7 Ų | 63.7 | 53% | 0.526 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -58.8 | -35.5 | -177.8 | 0 | 0 | 0 | 0 | 0 | 113.6 | L364 S370 | L364-G366 PolarHBondContact O-N 3.4Å; G366-S370 VanDerWaalsContact O-CB 3.25Å; G366-S370 WeakPolarHBondContact O-CB 3.43Å; G366-S370 PolarHBondContact O-N 2.91Å |
| 367 | E | 80.1 | Confident | 82.2 | Confident | 88 Ų | 88 | 65.6 Ų | 65.6 | 41% | 0.411 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -65.7 | -46.3 | 177.3 | -64.4 | 178.8 | -172 | 0 | 0 | 111 | R150 N365 S370 A371 | R150-E367 IonicContact CZ-OE1 2.69Å; R150-E367 IonicContact CZ-OE2 3.74Å; R150-E367 IonicContact NH1-OE1 3.92Å; R150-E367 IonicContact NH2-OE1 2.66Å; R150-E367 PolarHBondContact NH2-OE1 3.21Å; R150-E367 IonicContact NH2-OE2 2.75Å; R150-E367 PolarHBondContact NH2-OE2 3.4Å; N365-E367 VanDerWaalsContact C-N 3.27Å; N365-E367 PolarHBondContact O-N 2.88Å; N365-E367 WeakPolarHBondContact OD1-CB 3.33Å; N365-E367 PolarHBondContact OD1-N 2.03Å; E367-S370 PolarHBondContact O-N 2.87Å; E367-A371 WeakPolarHBondContact O-CB 3.29Å; E367-A371 PolarHBondContact O-N 2.88Å |
| 368 | V | 80.8 | Confident | 82.3 | Confident | 6 Ų | 6 | 71.7 Ų | 71.7 | 4% | 0.036 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -65.5 | -46.1 | 179.4 | 179.6 | 0 | 0 | 0 | 0 | 110.5 | F140 L143 C362 N365 S370 A371 A372 | F140-V368 HydrophobicContact CE1-CG2 3.82Å; F140-V368 HydrophobicContact CZ-CG2 4.08Å; L143-V368 HydrophobicContact CD1-CG1 4.08Å; C362-V368 WeakPolarHBondContact O-CB 3.49Å; N365-V368 HydrophobicContact CB-CB 4.16Å; N365-V368 HydrophobicContact CB-CG2 3.91Å; N365-V368 PolarHBondContact O-N 2.96Å; V368-S370 VanDerWaalsContact C-N 3.35Å; V368-S370 PolarHBondContact O-N 3.25Å; V368-A371 PolarHBondContact O-N 2.5Å; V368-A372 VanDerWaalsContact O-CB 3.29Å; V368-A372 WeakPolarHBondContact O-CB 3.02Å; V368-A372 PolarHBondContact O-N 2.81Å |
| 369 | R | 83.6 | Confident | 82.3 | Confident | 141 Ų | 141 | 77.2 Ų | 77.2 | 53% | 0.532 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -59.9 | -43.7 | 177.1 | -70.2 | 176 | 74.6 | -176.6 | 2.5 | 112 | F363 N365 R373 | F363-R369 WeakPolarHBondContact O-CD 3.47Å; F363-R369 WeakPolarHBondContact O-CG 3.02Å; N365-R369 WeakPolarHBondContact O-CG 3.46Å; N365-R369 PolarHBondContact O-N 3.27Å; R369-R373 WeakPolarHBondContact O-CB 3.04Å; R369-R373 PolarHBondContact O-N 3.28Å |
| 370 | S | 83.5 | Confident | 82.5 | Confident | 78 Ų | 78 | 79.7 Ų | 79.7 | 55% | 0.545 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -64.3 | -45.4 | 177.7 | -176.5 | 0 | 0 | 0 | 0 | 111.7 | G366 E367 V368 R373 K374 | G366-S370 VanDerWaalsContact O-CB 3.25Å; G366-S370 WeakPolarHBondContact O-CB 3.43Å; G366-S370 PolarHBondContact O-N 2.91Å; E367-S370 PolarHBondContact O-N 2.87Å; V368-S370 VanDerWaalsContact C-N 3.35Å; V368-S370 PolarHBondContact O-N 3.25Å; S370-R373 PolarHBondContact O-N 2.99Å; S370-K374 PolarHBondContact O-N 2.01Å |
| 371 | A | 84 | Confident | 82.7 | Confident | 23 Ų | 23 | 82 Ų | 82 | 19% | 0.19 | 38% | 0.383 | C | S | . | . | H | α-helix | trans | -65.7 | -40.9 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112.8 | L143 I146 E367 V368 K374 R375 | L143-A371 HydrophobicContact CD1-CB 4.1Å; L143-A371 HydrophobicContact CD2-CB 3.99Å; I146-A371 HydrophobicContact CD1-CB 3.64Å; E367-A371 WeakPolarHBondContact O-CB 3.29Å; E367-A371 PolarHBondContact O-N 2.88Å; V368-A371 PolarHBondContact O-N 2.5Å; A371-K374 PolarHBondContact O-N 3.48Å; A371-R375 PolarHBondContact O-N 3.11Å |
| 372 | A | 83.5 | Confident | 82.9 | Confident | 33 Ų | 33 | 85.4 Ų | 85.4 | 27% | 0.273 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -61.2 | -46.9 | 174.2 | 0 | 0 | 0 | 0 | 0 | 111.2 | V368 K374 R375 W376 | V368-A372 VanDerWaalsContact O-CB 3.29Å; V368-A372 WeakPolarHBondContact O-CB 3.02Å; V368-A372 PolarHBondContact O-N 2.81Å; A372-K374 PolarHBondContact O-N 3.15Å; A372-R375 PolarHBondContact O-N 2.86Å; A372-R375 VanDerWaalsContact O-N 3.15Å; A372-W376 WeakPolarHBondContact O-CB 3.37Å; A372-W376 PolarHBondContact O-N 3.12Å |
| 373 | R | 85.8 | Confident | 82.8 | Confident | 154 Ų | 154 | 89.7 Ų | 89.7 | 58% | 0.581 | 42% | 0.42 | S | S | * | . | H | α-helix | trans | -58.9 | -45 | 175.9 | -171.3 | -174 | -59 | -83.9 | 2.2 | 111.9 | R369 S370 R375 W376 H377 | R369-R373 WeakPolarHBondContact O-CB 3.04Å; R369-R373 PolarHBondContact O-N 3.28Å; S370-R373 PolarHBondContact O-N 2.99Å; R373-R375 VanDerWaalsContact C-N 3.3Å; R373-R375 PolarHBondContact O-N 3.34Å; R373-W376 WeakPolarHBondContact O-CB 3.36Å; R373-W376 PolarHBondContact O-N 3.3Å; R373-H377 PolarHBondContact O-CD2 2.87Å; R373-H377 PolarHBondContact O-N 2.93Å |
| 374 | K | 85.5 | Confident | 82.5 | Confident | 136 Ų | 136 | 88.9 Ų | 88.9 | 59% | 0.591 | 42% | 0.422 | S | S | * | . | H | α-helix | trans | -63.7 | -34.3 | 176.9 | -171 | 173.9 | -174.9 | 174.4 | 0 | 112.6 | S370 A371 A372 R378 | S370-K374 PolarHBondContact O-N 2.01Å; A371-K374 PolarHBondContact O-N 3.48Å; A372-K374 PolarHBondContact O-N 3.15Å; K374-R378 WeakPolarHBondContact O-CG 3.41Å; K374-R378 PolarHBondContact O-N 3.47Å; K374-R378 PolarHBondContact O-NE 3.2Å |
| 375 | R | 83.4 | Confident | 82.3 | Confident | 132 Ų | 132 | 89 Ų | 89 | 50% | 0.498 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -72.1 | -40.2 | 175.1 | -171.4 | 66 | 174.6 | 108.1 | -5.4 | 111.5 | L143 A371 A372 R373 R378 W379 | L143-R375 HydrophobicContact CD2-CB 4.5Å; A371-R375 PolarHBondContact O-N 3.11Å; A372-R375 PolarHBondContact O-N 2.86Å; A372-R375 VanDerWaalsContact O-N 3.15Å; R373-R375 VanDerWaalsContact C-N 3.3Å; R373-R375 PolarHBondContact O-N 3.34Å; R375-R378 PolarHBondContact O-N 3.41Å; R375-W379 PolarHBondContact O-N 3.44Å |
| 376 | W | 85.8 | Confident | 81.9 | Confident | 143 Ų | 143 | 95 Ų | 95 | 54% | 0.542 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -61 | -49.7 | 177.2 | -173.6 | -96.8 | 0 | 0 | 0 | 111.8 | A372 R373 R378 W379 Q380 | A372-W376 WeakPolarHBondContact O-CB 3.37Å; A372-W376 PolarHBondContact O-N 3.12Å; R373-W376 WeakPolarHBondContact O-CB 3.36Å; R373-W376 PolarHBondContact O-N 3.3Å; W376-R378 PolarHBondContact O-N 3.21Å; W376-W379 HydrophobicContact CH2-CZ3 4.18Å; W376-W379 HydrophobicContact CZ2-CZ3 4.3Å; W376-W379 WeakPolarHBondContact O-CB 3.41Å; W376-W379 PolarHBondContact O-N 3.03Å; W376-W379 VanDerWaalsContact O-N 3.11Å; W376-Q380 VanDerWaalsContact NE1-CD 3.29Å; W376-Q380 WeakPolarHBondContact O-CG 3.48Å; W376-Q380 PolarHBondContact O-N 3.23Å |
| 377 | H | 86.9 | Confident | 81.4 | Confident | 90 Ų | 90 | 96.3 Ų | 96.3 | 42% | 0.417 | 44% | 0.44 | S | S | . | . | H | α-helix | trans | -58.5 | -46.1 | 175.8 | -71.7 | -53.4 | 0 | 0 | 0 | 112.2 | R373 W379 Q380 D381 | R373-H377 PolarHBondContact O-CD2 2.87Å; R373-H377 PolarHBondContact O-N 2.93Å; H377-W379 VanDerWaalsContact C-N 3.28Å; H377-W379 PolarHBondContact O-N 3.13Å; H377-Q380 PolarHBondContact ND1-OE1 3.16Å; H377-Q380 WeakPolarHBondContact O-CB 3.39Å; H377-Q380 PolarHBondContact O-N 3.33Å; H377-Q380 VanDerWaalsContact O-N 3.16Å; H377-D381 VanDerWaalsContact O-CG 3.28Å; H377-D381 PolarHBondContact O-N 2.94Å |
| 378 | R | 84.8 | Confident | 80.7 | Confident | 133 Ų | 133 | 100.7 Ų | 100.7 | 50% | 0.502 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -61 | -34.8 | 175.6 | -74.8 | -175.3 | -69.1 | -172.5 | 2.3 | 113.5 | K374 R375 W376 H382 | K374-R378 WeakPolarHBondContact O-CG 3.41Å; K374-R378 PolarHBondContact O-N 3.47Å; K374-R378 PolarHBondContact O-NE 3.2Å; R375-R378 PolarHBondContact O-N 3.41Å; W376-R378 PolarHBondContact O-N 3.21Å; R378-H382 WeakPolarHBondContact O-CB 3.02Å; R378-H382 PolarHBondContact O-N 2.81Å; R378-H382 VanDerWaalsContact O-N 3.16Å |
| 379 | W | 84.9 | Confident | 79.9 | Confident | 117 Ų | 117 | 104.2 Ų | 104.2 | 44% | 0.443 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -69.6 | -44.2 | 175.6 | 176.6 | 84.9 | 0 | 0 | 0 | 111.1 | R375 W376 H377 D381 H382 H383 | R375-W379 PolarHBondContact O-N 3.44Å; W376-W379 HydrophobicContact CH2-CZ3 4.18Å; W376-W379 HydrophobicContact CZ2-CZ3 4.3Å; W376-W379 WeakPolarHBondContact O-CB 3.41Å; W376-W379 PolarHBondContact O-N 3.03Å; W376-W379 VanDerWaalsContact O-N 3.11Å; H377-W379 VanDerWaalsContact C-N 3.28Å; H377-W379 PolarHBondContact O-N 3.13Å; W379-D381 PolarHBondContact O-N 2.75Å; W379-H382 PolarHBondContact O-N 2.82Å; W379-H383 AromaticContact CH2-CD2 3.8Å; W379-H383 AromaticContact CZ2-CD2 3.69Å; W379-H383 WeakPolarHBondContact O-CB 3.34Å; W379-H383 PolarHBondContact O-N 3.37Å |
| 380 | Q | 86.6 | Confident | 79 | Confident | 81 Ų | 81 | 100.1 Ų | 100.1 | 38% | 0.379 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -58 | -46.6 | 174.2 | -72.2 | -179.7 | -36.7 | 0 | 0 | 111.6 | W376 H377 H382 H383 S384 | W376-Q380 VanDerWaalsContact NE1-CD 3.29Å; W376-Q380 WeakPolarHBondContact O-CG 3.48Å; W376-Q380 PolarHBondContact O-N 3.23Å; H377-Q380 PolarHBondContact ND1-OE1 3.16Å; H377-Q380 WeakPolarHBondContact O-CB 3.39Å; H377-Q380 PolarHBondContact O-N 3.33Å; H377-Q380 VanDerWaalsContact O-N 3.16Å; Q380-H382 PolarHBondContact O-N 3.49Å; Q380-H383 PolarHBondContact O-N 3.15Å; Q380-S384 WeakPolarHBondContact O-CB 3.16Å; Q380-S384 PolarHBondContact O-N 2.88Å |
| 381 | D | 84.1 | Confident | 77.9 | Confident | 94 Ų | 94 | 105.2 Ų | 105.2 | 50% | 0.503 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -59.3 | -48.5 | 178.5 | -67 | -23.4 | 0 | 0 | 0 | 111.1 | H377 W379 H383 S384 L385 | H377-D381 VanDerWaalsContact O-CG 3.28Å; H377-D381 PolarHBondContact O-N 2.94Å; W379-D381 PolarHBondContact O-N 2.75Å; D381-H383 VanDerWaalsContact C-N 3.32Å; D381-H383 PolarHBondContact O-N 2.78Å; D381-S384 PolarHBondContact O-N 3.39Å; D381-S384 PolarHBondContact O-OG 3Å; D381-L385 WeakPolarHBondContact O-CG 3.34Å; D381-L385 PolarHBondContact O-N 2.89Å |
| 382 | H | 79.1 | Confident | 76.8 | Confident | 98 Ų | 98 | 107.3 Ų | 107.3 | 45% | 0.454 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -64.5 | -35 | 178.6 | -172.7 | -98.6 | 0 | 0 | 0 | 112.8 | R378 W379 Q380 R386 | R378-H382 WeakPolarHBondContact O-CB 3.02Å; R378-H382 PolarHBondContact O-N 2.81Å; R378-H382 VanDerWaalsContact O-N 3.16Å; W379-H382 PolarHBondContact O-N 2.82Å; Q380-H382 PolarHBondContact O-N 3.49Å; H382-R386 PolarHBondContact CE1-NE 3.41Å; H382-R386 PolarHBondContact O-N 3.06Å |
| 383 | H | 78.8 | Confident | 75.6 | Confident | 91 Ų | 91 | 112.8 Ų | 112.8 | 42% | 0.421 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -71.6 | -39.5 | 176.2 | -138 | 28.9 | 0 | 0 | 0 | 111.7 | W379 Q380 D381 L385 R386 V387 | W379-H383 AromaticContact CH2-CD2 3.8Å; W379-H383 AromaticContact CZ2-CD2 3.69Å; W379-H383 WeakPolarHBondContact O-CB 3.34Å; W379-H383 PolarHBondContact O-N 3.37Å; Q380-H383 PolarHBondContact O-N 3.15Å; D381-H383 VanDerWaalsContact C-N 3.32Å; D381-H383 PolarHBondContact O-N 2.78Å; H383-L385 VanDerWaalsContact C-N 3.33Å; H383-L385 PolarHBondContact O-N 2.92Å; H383-R386 PolarHBondContact O-N 3.47Å; H383-V387 WeakPolarHBondContact O-CG2 3.46Å; H383-V387 PolarHBondContact O-N 3.09Å |
| 384 | S | 76.2 | Confident | 74.2 | Confident | 48 Ų | 48 | 109.5 Ų | 109.5 | 34% | 0.336 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -62.3 | -39.5 | 174.1 | 80.5 | 0 | 0 | 0 | 0 | 112.1 | Q380 D381 V387 R388 | Q380-S384 WeakPolarHBondContact O-CB 3.16Å; Q380-S384 PolarHBondContact O-N 2.88Å; D381-S384 PolarHBondContact O-N 3.39Å; D381-S384 PolarHBondContact O-OG 3Å; S384-V387 PolarHBondContact O-N 2.77Å; S384-R388 WeakPolarHBondContact O-CG 3.04Å; S384-R388 PolarHBondContact O-N 3.38Å |
| 385 | L | 73.3 | Confident | 72.7 | Confident | 97 Ų | 97 | 108.4 Ų | 108.4 | 51% | 0.508 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -66.3 | -44.2 | 174.8 | -73.5 | 166.7 | 0 | 0 | 0 | 111.5 | D381 H383 V387 R388 V389 | D381-L385 WeakPolarHBondContact O-CG 3.34Å; D381-L385 PolarHBondContact O-N 2.89Å; H383-L385 VanDerWaalsContact C-N 3.33Å; H383-L385 PolarHBondContact O-N 2.92Å; L385-V387 VanDerWaalsContact C-N 3.34Å; L385-V387 PolarHBondContact O-N 2.75Å; L385-R388 PolarHBondContact O-N 2.71Å; L385-V389 WeakPolarHBondContact O-CB 3.4Å; L385-V389 VanDerWaalsContact O-CG2 3.29Å; L385-V389 WeakPolarHBondContact O-CG2 3.24Å; L385-V389 PolarHBondContact O-N 2.99Å |
| 386 | R | 70.6 | Confident | 71 | Confident | 162 Ų | 162 | 107.5 Ų | 107.5 | 61% | 0.611 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -60.3 | -41.7 | 175.1 | -81 | -169.3 | -178.4 | -172.5 | 0.6 | 112.5 | H382 H383 V389 A390 | H382-R386 PolarHBondContact CE1-NE 3.41Å; H382-R386 PolarHBondContact O-N 3.06Å; H383-R386 PolarHBondContact O-N 3.47Å; R386-V389 PolarHBondContact O-N 3.44Å; R386-A390 VanDerWaalsContact O-CB 3.29Å; R386-A390 WeakPolarHBondContact O-CB 3.06Å; R386-A390 PolarHBondContact O-N 2.96Å |
| 387 | V | 68.4 | Low | 69.6 | Low | 77 Ų | 77 | 107.1 Ų | 107.1 | 47% | 0.467 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -66.7 | -40 | 177.1 | 173.2 | 0 | 0 | 0 | 0 | 111.3 | H383 S384 L385 R391 | H383-V387 WeakPolarHBondContact O-CG2 3.46Å; H383-V387 PolarHBondContact O-N 3.09Å; S384-V387 PolarHBondContact O-N 2.77Å; L385-V387 VanDerWaalsContact C-N 3.34Å; L385-V387 PolarHBondContact O-N 2.75Å; V387-R391 PolarHBondContact O-N 2.03Å |
| 388 | R | 65.1 | Low | 67.7 | Low | 180 Ų | 180 | 107 Ų | 107 | 68% | 0.679 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -64.5 | -44 | 174.8 | -74.8 | 178.9 | -174.2 | -173.2 | 3 | 112.3 | S384 L385 R391 A392 | S384-R388 WeakPolarHBondContact O-CG 3.04Å; S384-R388 PolarHBondContact O-N 3.38Å; L385-R388 PolarHBondContact O-N 2.71Å; R388-R391 PolarHBondContact O-N 3.45Å; R388-A392 WeakPolarHBondContact O-CB 3.47Å; R388-A392 PolarHBondContact O-N 3.4Å |
| 389 | V | 65 | Low | 65.9 | Low | 81 Ų | 81 | 106.3 Ų | 106.3 | 49% | 0.491 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -66.3 | -42.1 | 177.5 | 172.2 | 0 | 0 | 0 | 0 | 111.1 | L385 R386 R391 A392 M393 | L385-V389 WeakPolarHBondContact O-CB 3.4Å; L385-V389 VanDerWaalsContact O-CG2 3.29Å; L385-V389 WeakPolarHBondContact O-CG2 3.24Å; L385-V389 PolarHBondContact O-N 2.99Å; R386-V389 PolarHBondContact O-N 3.44Å; V389-R391 PolarHBondContact O-N 3.5Å; V389-A392 PolarHBondContact O-N 3.34Å; V389-M393 HydrophobicContact CG1-CE 3.86Å; V389-M393 HydrophobicContact CG1-SD 4.2Å; V389-M393 WeakPolarHBondContact O-CG 3.28Å; V389-M393 PolarHBondContact O-N 2.96Å |
| 390 | A | 63.5 | Low | 64.1 | Low | 55 Ų | 55 | 106.2 Ų | 106.2 | 46% | 0.455 | 58% | 0.576 | S | S | . | * | H | α-helix | trans | -61.8 | -41 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | R386 M393 S394 | R386-A390 VanDerWaalsContact O-CB 3.29Å; R386-A390 WeakPolarHBondContact O-CB 3.06Å; R386-A390 PolarHBondContact O-N 2.96Å; A390-M393 PolarHBondContact O-N 2.95Å; A390-S394 PolarHBondContact O-N 2.62Å; A390-S394 VanDerWaalsContact O-N 3.15Å; A390-S394 PolarHBondContact O-OG 3.25Å |
| 391 | R | 60.2 | Low | 62.1 | Low | 184 Ų | 184 | 113.3 Ų | 113.3 | 69% | 0.694 | 60% | 0.6 | S | S | * | * | H | α-helix | trans | -66.4 | -38.5 | 173.4 | -89.1 | -173.7 | -178.7 | 162.5 | 1.3 | 113.2 | V387 R388 V389 M393 S394 I395 | V387-R391 PolarHBondContact O-N 2.03Å; R388-R391 PolarHBondContact O-N 3.45Å; V389-R391 PolarHBondContact O-N 3.5Å; R391-M393 VanDerWaalsContact C-N 3.34Å; R391-S394 WeakPolarHBondContact CA-OG 3.35Å; R391-S394 PolarHBondContact O-N 2.8Å; R391-S394 PolarHBondContact O-OG 3.22Å; R391-I395 PolarHBondContact O-N 3.44Å |
| 392 | A | 61 | Low | 60.2 | Low | 68 Ų | 68 | 115.1 Ų | 115.1 | 56% | 0.562 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -67.1 | -35.5 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112 | R388 V389 | R388-A392 WeakPolarHBondContact O-CB 3.47Å; R388-A392 PolarHBondContact O-N 3.4Å; V389-A392 PolarHBondContact O-N 3.34Å |
| 393 | M | 59 | Low | 58.4 | Low | 148 Ų | 148 | 114.8 Ų | 114.8 | 73% | 0.729 | 62% | 0.617 | S | S | * | * | H | α-helix | trans | -77.8 | -17.9 | 176.3 | -67.1 | -173.9 | -54.2 | 0 | 0 | 113.9 | V389 A390 R391 | V389-M393 HydrophobicContact CG1-CE 3.86Å; V389-M393 HydrophobicContact CG1-SD 4.2Å; V389-M393 WeakPolarHBondContact O-CG 3.28Å; V389-M393 PolarHBondContact O-N 2.96Å; A390-M393 PolarHBondContact O-N 2.95Å; R391-M393 VanDerWaalsContact C-N 3.34Å |
| 394 | S | 56.2 | Low | 56.8 | Low | 84 Ų | 84 | 119.9 Ų | 119.9 | 59% | 0.587 | 64% | 0.638 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -90.4 | -3.9 | 176.5 | 63.5 | 0 | 0 | 0 | 0 | 114.3 | A390 R391 P396 | A390-S394 PolarHBondContact O-N 2.62Å; A390-S394 VanDerWaalsContact O-N 3.15Å; A390-S394 PolarHBondContact O-OG 3.25Å; R391-S394 WeakPolarHBondContact CA-OG 3.35Å; R391-S394 PolarHBondContact O-N 2.8Å; R391-S394 PolarHBondContact O-OG 3.22Å; S394-P396 WeakPolarHBondContact O-CD 3.24Å |
| 395 | I | 53 | Low | 55.1 | Low | 114 Ų | 114 | 126.1 Ų | 126.1 | 59% | 0.585 | 66% | 0.662 | S | S | * | * | S | Bend | trans | -77.4 | 117.3 | 170.2 | -65.3 | 168.1 | 0 | 0 | 0 | 106.6 | R391 T397 | R391-I395 PolarHBondContact O-N 3.44Å; I395-T397 PolarHBondContact O-N 2.92Å |
| 396 | P | 47.9 | Very low | 53.4 | Low | 113 Ų | 113 | 126.3 Ų | 126.3 | 73% | 0.734 | 67% | 0.671 | S | S | * | * | trans | -64.1 | 113.5 | 170.8 | 0.4 | 12.2 | 0 | 0 | 0 | 106.8 | S394 S398 | S394-P396 WeakPolarHBondContact O-CD 3.24Å; P396-S398 PolarHBondContact O-N 2.92Å | ||
| 397 | T | 57.8 | Low | 52.1 | Low | 134 Ų | 134 | 127.1 Ų | 127.1 | 82% | 0.822 | 69% | 0.685 | S | S | * | * | trans | -66.4 | 80.9 | 161.8 | 49.3 | 0 | 0 | 0 | 0 | 107.2 | I395 P399 | I395-T397 PolarHBondContact O-N 2.92Å; T397-P399 WeakPolarHBondContact O-CD 3.44Å | ||
| 398 | S | 45.8 | Very low | 50.8 | Low | 88 Ų | 88 | 131.8 Ų | 131.8 | 62% | 0.615 | 70% | 0.699 | S | S | * | * | trans | -66.3 | 119.3 | 167.4 | -176.1 | 0 | 0 | 0 | 0 | 107.3 | P396 T400 | P396-S398 PolarHBondContact O-N 2.92Å; S398-T400 VanDerWaalsContact C-N 3.27Å; S398-T400 PolarHBondContact O-N 2.85Å | ||
| 399 | P | 48.2 | Very low | 49.7 | Very low | 118 Ų | 118 | 132.5 Ų | 132.5 | 77% | 0.766 | 71% | 0.711 | S | S | * | * | trans | -78.1 | 85.6 | 172.9 | 31.9 | -28 | 0 | 0 | 0 | 107 | T397 R401 | T397-P399 WeakPolarHBondContact O-CD 3.44Å; P399-R401 PolarHBondContact O-N 3.3Å | ||
| 400 | T | 47.4 | Very low | 48.6 | Very low | 115 Ų | 115 | 135.2 Ų | 135.2 | 71% | 0.706 | 73% | 0.727 | S | S | * | * | trans | -68.6 | 88.5 | 161.1 | 43 | 0 | 0 | 0 | 0 | 107.5 | S398 I402 | S398-T400 VanDerWaalsContact C-N 3.27Å; S398-T400 PolarHBondContact O-N 2.85Å; T400-I402 VanDerWaalsContact C-N 3.27Å; T400-I402 PolarHBondContact O-N 2.93Å | ||
| 401 | R | 43.4 | Very low | 47.4 | Very low | 231 Ų | 231 | 137.5 Ų | 137.5 | 87% | 0.872 | 75% | 0.746 | S | S | * | * | trans | -57.3 | 90.8 | 163.2 | -175.9 | -165.6 | -95.5 | -149.1 | -2.4 | 107.3 | P399 S403 | P399-R401 PolarHBondContact O-N 3.3Å; R401-S403 VanDerWaalsContact C-N 3.32Å; R401-S403 PolarHBondContact O-N 2.98Å | ||
| 402 | I | 45 | Very low | 46.7 | Very low | 132 Ų | 132 | 133.1 Ų | 133.1 | 68% | 0.677 | 75% | 0.749 | S | S | * | * | trans | -73.4 | 96.2 | 165.8 | -59.4 | 177.7 | 0 | 0 | 0 | 106.1 | T400 F404 | T400-I402 VanDerWaalsContact C-N 3.27Å; T400-I402 PolarHBondContact O-N 2.93Å; I402-F404 HydrophobicContact CG2-CD2 3.76Å; I402-F404 HydrophobicContact CG2-CE2 3.8Å; I402-F404 PolarHBondContact O-N 2.95Å; I402-F404 VanDerWaalsContact O-N 3.1Å | ||
| 403 | S | 41.3 | Very low | 45.5 | Very low | 91 Ų | 91 | 140.4 Ų | 140.4 | 64% | 0.636 | 79% | 0.787 | S | S | * | * | trans | -64.3 | 96.7 | 169.3 | 154.3 | 0 | 0 | 0 | 0 | 109.3 | R401 H405 | R401-S403 VanDerWaalsContact C-N 3.32Å; R401-S403 PolarHBondContact O-N 2.98Å; S403-H405 PolarHBondContact O-N 2.62Å | ||
| 404 | F | 45.3 | Very low | 44.8 | Very low | 198 Ų | 198 | 140.1 Ų | 140.1 | 87% | 0.868 | 79% | 0.79 | S | S | * | * | trans | -86.7 | 89.6 | 158.6 | -93.6 | -86.2 | 0 | 0 | 0 | 108.4 | I402 | I402-F404 HydrophobicContact CG2-CD2 3.76Å; I402-F404 HydrophobicContact CG2-CE2 3.8Å; I402-F404 PolarHBondContact O-N 2.95Å; I402-F404 VanDerWaalsContact O-N 3.1Å | ||
| 405 | H | 40.2 | Very low | 44.2 | Very low | 179 Ų | 179 | 143 Ų | 143 | 83% | 0.829 | 80% | 0.8 | S | S | * | * | trans | -124.6 | 126.1 | 163 | -113.4 | -80.5 | 0 | 0 | 0 | 108.9 | S403 | S403-H405 PolarHBondContact O-N 2.62Š| ||
| 406 | S | 37 | Very low | 43.7 | Very low | 101 Ų | 101 | 144.6 Ų | 144.6 | 71% | 0.706 | 81% | 0.812 | S | S | * | * | trans | 86.1 | 90 | 161.3 | -152.5 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 407 | I | 42.8 | Very low | 43.5 | Very low | 178 Ų | 178 | 146.5 Ų | 146.5 | 91% | 0.913 | 82% | 0.817 | S | S | * | * | -128.9 | 126.3 | 129 | -62.3 | -176.3 | 0 | 0 | 0 | 107.5 | |||||
| 408 | K | 40.8 | Very low | 42.6 | Very low | 175 Ų | 175 | 147.3 Ų | 147.3 | 76% | 0.761 | 82% | 0.816 | S | S | * | * | trans | -60.2 | 143.7 | -166.6 | -74.2 | 168.3 | 167.2 | 177.8 | 0 | 114.5 | T410 | K408-T410 PolarHBondContact O-N 3.47Š| ||
| 409 | Q | 43.3 | Very low | 42.3 | Very low | 196 Ų | 196 | 151.2 Ų | 151.2 | 92% | 0.916 | 83% | 0.83 | S | S | * | * | trans | -59.2 | 121.2 | 147 | -77.3 | 171.8 | -42.3 | 0 | 0 | 109.7 | ||||
| 410 | T | 41.2 | Very low | 41.9 | Very low | 137 Ų | 137 | 153.6 Ų | 153.6 | 84% | 0.84 | 83% | 0.834 | S | S | * | * | trans | -143.2 | 95.9 | 146.3 | -25.8 | 0 | 0 | 0 | 0 | 107.7 | K408 | K408-T410 PolarHBondContact O-N 3.47Š| ||
| 411 | A | 38.9 | Very low | 41.5 | Very low | 103 Ų | 103 | 156.5 Ų | 156.5 | 85% | 0.851 | 84% | 0.844 | S | S | * | * | trans | -146.2 | 95.9 | 164.8 | 0 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 412 | A | 44.3 | Very low | 41.3 | Very low | 92 Ų | 92 | 150.3 Ų | 150.3 | 76% | 0.76 | 84% | 0.842 | S | S | * | * | trans | -170.4 | 116.2 | 148.5 | 0 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 413 | V | 36.1 | Very low | 41 | Very low | 222 Ų | 222 | 152 Ų | 152 | 100% | 1.345 | 86% | 0.857 | S | S | * | * | trans | 52.1 | 0 | 144.4 | -168.4 | 0 | 0 | 0 | 0 | 119 |
Retrieved 413 of 413 residues in 236.8 ms
(Link to these results)