| 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 | 45.6 | Very low | 47 | Very low | 239 Ų | 239 | 156.5 Ų | 156.5 | 100% | 1.177 | 80% | 0.8 | S | S | * | * | 0 | 101.9 | 0 | -68.7 | -70.8 | 176.9 | 0 | 0 | 108 | |||||
| 2 | S | 43 | Very low | 47.1 | Very low | 133 Ų | 133 | 156.2 Ų | 156.2 | 93% | 0.93 | 79% | 0.793 | S | S | * | * | trans | -172.3 | 135.1 | 141.5 | -101.4 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 3 | R | 44.3 | Very low | 47 | Very low | 215 Ų | 215 | 148.8 Ų | 148.8 | 81% | 0.811 | 77% | 0.77 | S | S | * | * | trans | -59 | 141.1 | -160.4 | -78.5 | 168.2 | 167.7 | 176 | -4.2 | 115.1 | ||||
| 4 | R | 55.8 | Low | 46.8 | Very low | 245 Ų | 245 | 147.1 Ų | 147.1 | 93% | 0.925 | 76% | 0.763 | S | S | * | * | trans | -67.6 | 129 | 146.1 | -74.5 | 172.7 | 170 | 165.3 | -4.6 | 108.1 | ||||
| 5 | E | 46.2 | Very low | 47 | Very low | 165 Ų | 165 | 141.9 Ų | 141.9 | 77% | 0.771 | 75% | 0.745 | S | S | * | * | trans | -129.2 | 92.9 | 156 | -71.6 | -174.8 | 139.9 | 0 | 0 | 106.7 | N7 | E5-N7 PolarHBondContact O-N 3.15Š| ||
| 6 | G | 42.7 | Very low | 47.2 | Very low | 65 Ų | 65 | 137.1 Ų | 137.1 | 67% | 0.67 | 73% | 0.726 | S | S | * | * | trans | -77.8 | 111.2 | 165.7 | 0 | 0 | 0 | 0 | 0 | 107.4 | L8 | G6-L8 PolarHBondContact O-N 3.46Å; G6-L8 VanDerWaalsContact O-N 3.13Å | ||
| 7 | N | 45.3 | Very low | 47.7 | Very low | 128 Ų | 128 | 135.1 Ų | 135.1 | 68% | 0.684 | 72% | 0.72 | S | S | * | * | trans | -65.3 | 103.1 | 168.1 | -163.5 | 34.9 | 0 | 0 | 0 | 107.5 | E5 E9 | E5-N7 PolarHBondContact O-N 3.15Å; N7-E9 VanDerWaalsContact C-N 3.27Å; N7-E9 PolarHBondContact ND2-OE2 3.49Å; N7-E9 PolarHBondContact O-N 3.29Å; N7-E9 VanDerWaalsContact O-N 3.13Å | ||
| 8 | L | 48 | Very low | 48.3 | Very low | 162 Ų | 162 | 132.7 Ų | 132.7 | 85% | 0.848 | 72% | 0.716 | S | S | * | * | trans | -76.6 | 87.8 | 163.8 | -85.9 | 102.3 | 0 | 0 | 0 | 107 | G6 D10 | G6-L8 PolarHBondContact O-N 3.46Å; G6-L8 VanDerWaalsContact O-N 3.13Å; L8-D10 PolarHBondContact O-N 2.88Å | ||
| 9 | E | 50 | Low | 49.3 | Very low | 150 Ų | 150 | 131.5 Ų | 131.5 | 70% | 0.701 | 71% | 0.708 | S | S | * | * | trans | -66.6 | 119.3 | 158.4 | -85.4 | 157.6 | 83.5 | 0 | 0 | 107.8 | N7 P11 | N7-E9 VanDerWaalsContact C-N 3.27Å; N7-E9 PolarHBondContact ND2-OE2 3.49Å; N7-E9 PolarHBondContact O-N 3.29Å; N7-E9 VanDerWaalsContact O-N 3.13Å; E9-P11 WeakPolarHBondContact O-CD 3.45Å | ||
| 10 | D | 44.9 | Very low | 50.4 | Low | 123 Ų | 123 | 130.8 Ų | 130.8 | 66% | 0.658 | 70% | 0.704 | S | S | * | * | trans | -70.6 | 107.7 | 177 | -103.2 | -49.4 | 0 | 0 | 0 | 110.1 | L8 Q12 | L8-D10 PolarHBondContact O-N 2.88Å; D10-Q12 PolarHBondContact O-N 3.25Å | ||
| 11 | P | 51.3 | Low | 51.8 | Low | 96 Ų | 96 | 128.4 Ų | 128.4 | 62% | 0.623 | 70% | 0.695 | S | S | * | * | H | α-helix | trans | -70 | -4.5 | 179.4 | 29.3 | -34.8 | 0 | 0 | 0 | 113.6 | E9 S15 | E9-P11 WeakPolarHBondContact O-CD 3.45Å; P11-S15 PolarHBondContact O-OG 3.3Å; P11-S15 VanDerWaalsContact O-OG 3.04Å |
| 12 | Q | 48.2 | Very low | 53.6 | Low | 153 Ų | 153 | 123.1 Ų | 123.1 | 72% | 0.715 | 67% | 0.667 | S | S | * | * | H | α-helix | trans | -81.2 | -27.9 | -175.9 | -164.6 | 160.2 | -87.9 | 0 | 0 | 112.8 | D10 S16 | D10-Q12 PolarHBondContact O-N 3.25Å; Q12-S16 PolarHBondContact O-N 3.45Å; Q12-S16 PolarHBondContact O-OG 3.21Å |
| 13 | A | 46.2 | Very low | 55.7 | Low | 60 Ų | 60 | 118.1 Ų | 118.1 | 50% | 0.496 | 63% | 0.63 | S | S | . | * | H | α-helix | trans | -71.7 | -46.3 | 177.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | S15 S16 V17 | A13-S15 PolarHBondContact O-N 2.94Å; A13-S16 PolarHBondContact O-N 3.04Å; A13-V17 WeakPolarHBondContact O-CG2 3.4Å; A13-V17 PolarHBondContact O-N 3.21Å |
| 14 | D | 44.3 | Very low | 57.8 | Low | 125 Ų | 125 | 112.1 Ų | 112.1 | 67% | 0.668 | 61% | 0.611 | S | S | * | * | H | α-helix | trans | -68 | -33.3 | -179.4 | -74.3 | -31.9 | 0 | 0 | 0 | 113.1 | S16 V17 S18 | D14-S16 VanDerWaalsContact C-N 3.32Å; D14-S16 PolarHBondContact O-N 3.49Å; D14-V17 PolarHBondContact O-N 2.77Å; D14-S18 PolarHBondContact O-N 2.86Å |
| 15 | S | 50.1 | Low | 59.5 | Low | 70 Ų | 70 | 103 Ų | 103 | 49% | 0.49 | 59% | 0.589 | S | S | . | * | H | α-helix | trans | -65.5 | -35.3 | 174.2 | -63.1 | 0 | 0 | 0 | 0 | 112.3 | P11 A13 L19 | P11-S15 PolarHBondContact O-OG 3.3Å; P11-S15 VanDerWaalsContact O-OG 3.04Å; A13-S15 PolarHBondContact O-N 2.94Å; S15-L19 VanDerWaalsContact O-CD1 3.27Å; S15-L19 WeakPolarHBondContact O-CD1 3.49Å; S15-L19 WeakPolarHBondContact O-CG 3.47Å; S15-L19 PolarHBondContact O-N 3.47Å |
| 16 | S | 50.1 | Low | 61.7 | Low | 65 Ų | 65 | 97.3 Ų | 97.3 | 46% | 0.455 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -72.9 | -32.5 | -178.8 | -59.8 | 0 | 0 | 0 | 0 | 112 | Q12 A13 D14 | Q12-S16 PolarHBondContact O-N 3.45Å; Q12-S16 PolarHBondContact O-OG 3.21Å; A13-S16 PolarHBondContact O-N 3.04Å; D14-S16 VanDerWaalsContact C-N 3.32Å; D14-S16 PolarHBondContact O-N 3.49Å |
| 17 | V | 54.6 | Low | 64.1 | Low | 103 Ų | 103 | 94.9 Ų | 94.9 | 62% | 0.624 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -71.8 | -32.3 | 178.5 | 176.7 | 0 | 0 | 0 | 0 | 112 | A13 D14 P21 | A13-V17 WeakPolarHBondContact O-CG2 3.4Å; A13-V17 PolarHBondContact O-N 3.21Å; D14-V17 PolarHBondContact O-N 2.77Å; V17-P21 VanDerWaalsContact O-CD 3.25Å; V17-P21 WeakPolarHBondContact O-CD 3.32Å |
| 18 | S | 60 | Low | 66.4 | Low | 92 Ų | 92 | 95.6 Ų | 95.6 | 64% | 0.643 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -77.2 | -25.9 | 177.6 | -163.3 | 0 | 0 | 0 | 0 | 113.7 | D14 | D14-S18 PolarHBondContact O-N 2.86Å |
| 19 | L | 65.9 | Low | 68.7 | Low | 109 Ų | 109 | 94.7 Ų | 94.7 | 57% | 0.571 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -77.3 | -31.5 | -176.2 | -73.3 | 165.9 | 0 | 0 | 0 | 113.8 | S15 H22 L23 | S15-L19 VanDerWaalsContact O-CD1 3.27Å; S15-L19 WeakPolarHBondContact O-CD1 3.49Å; S15-L19 WeakPolarHBondContact O-CG 3.47Å; S15-L19 PolarHBondContact O-N 3.47Å; L19-H22 PolarHBondContact O-N 3.44Å; L19-L23 WeakPolarHBondContact O-CB 3.5Å; L19-L23 PolarHBondContact O-N 3.38Å |
| 20 | L | 71.8 | Confident | 70.9 | Confident | 118 Ų | 118 | 87.8 Ų | 87.8 | 62% | 0.618 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -64.5 | -50.1 | -176.3 | -79.7 | 165.5 | 0 | 0 | 0 | 113.2 | H22 L23 E24 | L20-H22 VanDerWaalsContact C-N 3.3Å; L20-H22 PolarHBondContact O-N 3.02Å; L20-L23 PolarHBondContact O-N 3.18Å; L20-E24 PolarHBondContact O-N 3.07Å |
| 21 | P | 79.9 | Confident | 73.4 | Confident | 81 Ų | 81 | 84 Ų | 84 | 53% | 0.526 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -63.2 | -35.2 | 176.1 | -22.6 | 33.6 | 0 | 0 | 0 | 113 | V17 A25 | V17-P21 VanDerWaalsContact O-CD 3.25Å; V17-P21 WeakPolarHBondContact O-CD 3.32Å; P21-A25 WeakPolarHBondContact O-CB 3.42Å; P21-A25 PolarHBondContact O-N 3.44Å |
| 22 | H | 83.7 | Confident | 75.6 | Confident | 127 Ų | 127 | 83 Ų | 83 | 59% | 0.588 | 46% | 0.459 | S | S | * | . | H | α-helix | trans | -67.7 | -42.7 | 178 | -176.3 | 71.6 | 0 | 0 | 0 | 111.8 | L19 L20 A25 K26 | L19-H22 PolarHBondContact O-N 3.44Å; L20-H22 VanDerWaalsContact C-N 3.3Å; L20-H22 PolarHBondContact O-N 3.02Å; H22-A25 PolarHBondContact O-N 3.49Å; H22-K26 WeakPolarHBondContact O-CB 3.38Å; H22-K26 PolarHBondContact O-N 3.11Å |
| 23 | L | 86.6 | Confident | 77.9 | Confident | 29 Ų | 29 | 78.7 Ų | 78.7 | 15% | 0.152 | 44% | 0.44 | C | S | . | . | H | α-helix | trans | -63.5 | -44.9 | 175.2 | 177.9 | 59.3 | 0 | 0 | 0 | 111.3 | L19 L20 A25 K26 I27 L139 A142 L143 | L19-L23 WeakPolarHBondContact O-CB 3.5Å; L19-L23 PolarHBondContact O-N 3.38Å; L20-L23 PolarHBondContact O-N 3.18Å; L23-A25 PolarHBondContact O-N 2.97Å; L23-K26 WeakPolarHBondContact O-CB 3.45Å; L23-K26 PolarHBondContact O-N 3.1Å; L23-K26 VanDerWaalsContact O-N 3.14Å; L23-I27 HydrophobicContact CD1-CD1 4.31Å; L23-I27 HydrophobicContact CD1-CG1 4.36Å; L23-I27 HydrophobicContact CG-CD1 4.06Å; L23-I27 VanDerWaalsContact O-CG1 3.31Å; L23-I27 WeakPolarHBondContact O-CG1 3.09Å; L23-I27 PolarHBondContact O-N 3.43Å; L23-L139 HydrophobicContact CD1-CD2 4.02Å; L23-A142 HydrophobicContact CD1-CB 3.87Å; L23-L143 HydrophobicContact CD2-CD2 3.88Å |
| 24 | E | 89.3 | Confident | 80.4 | Confident | 89 Ų | 89 | 75.9 Ų | 75.9 | 42% | 0.416 | 42% | 0.417 | S | S | . | . | H | α-helix | trans | -60.3 | -45 | 177 | -165.7 | -169.1 | 153.1 | 0 | 0 | 111.7 | L20 K26 I27 R28 | L20-E24 PolarHBondContact O-N 3.07Å; E24-K26 VanDerWaalsContact C-N 3.28Å; E24-K26 PolarHBondContact O-N 3.18Å; E24-I27 PolarHBondContact O-N 3.33Å; E24-R28 WeakPolarHBondContact O-CG 3.39Å; E24-R28 PolarHBondContact O-N 3.07Å; E24-R28 IonicContact OE1-CZ 2.84Å; E24-R28 VanDerWaalsContact OE1-CZ 3.26Å; E24-R28 IonicContact OE1-NE 3.15Å; E24-R28 PolarHBondContact OE1-NE 2.86Å; E24-R28 IonicContact OE1-NH2 3.21Å; E24-R28 PolarHBondContact OE1-NH2 3.28Å |
| 25 | A | 90.2 | Very high | 83 | Confident | 54 Ų | 54 | 73.3 Ų | 73.3 | 45% | 0.446 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -58.6 | -41 | 174.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | P21 H22 L23 R28 Q29 | P21-A25 WeakPolarHBondContact O-CB 3.42Å; P21-A25 PolarHBondContact O-N 3.44Å; H22-A25 PolarHBondContact O-N 3.49Å; L23-A25 PolarHBondContact O-N 2.97Å; A25-R28 PolarHBondContact O-N 3.47Å; A25-Q29 WeakPolarHBondContact O-CB 3.48Å; A25-Q29 PolarHBondContact O-N 3.3Å |
| 26 | K | 92.2 | Very high | 85.3 | Confident | 44 Ų | 44 | 73.3 Ų | 73.3 | 19% | 0.191 | 40% | 0.395 | C | S | . | . | H | α-helix | trans | -66.8 | -38.4 | 176.8 | -165.1 | 173.1 | -177.3 | -71.2 | 0 | 112.3 | H22 L23 E24 T30 A135 A138 L139 | H22-K26 WeakPolarHBondContact O-CB 3.38Å; H22-K26 PolarHBondContact O-N 3.11Å; L23-K26 WeakPolarHBondContact O-CB 3.45Å; L23-K26 PolarHBondContact O-N 3.1Å; L23-K26 VanDerWaalsContact O-N 3.14Å; E24-K26 VanDerWaalsContact C-N 3.28Å; E24-K26 PolarHBondContact O-N 3.18Å; K26-T30 WeakPolarHBondContact O-CB 3.41Å; K26-T30 PolarHBondContact O-N 3.31Å; K26-T30 PolarHBondContact O-OG1 2.97Å; K26-A135 PolarHBondContact NZ-O 2.8Å; K26-A138 VanDerWaalsContact NZ-C 3.29Å; K26-L139 HydrophobicContact CB-CD2 3.97Å; K26-L139 HydrophobicContact CD-CD2 3.99Å; K26-L139 HydrophobicContact CG-CD2 3.69Å; K26-L139 HydrophobicContact CG-CG 4.42Å |
| 27 | I | 92.8 | Very high | 87.6 | Confident | 14 Ų | 14 | 70.4 Ų | 70.4 | 7% | 0.072 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -63.5 | -49.1 | 174.5 | -64.2 | 164.9 | 0 | 0 | 0 | 109.3 | L23 E24 Q29 T30 H31 L139 L195 L196 | L23-I27 HydrophobicContact CD1-CD1 4.31Å; L23-I27 HydrophobicContact CD1-CG1 4.36Å; L23-I27 HydrophobicContact CG-CD1 4.06Å; L23-I27 VanDerWaalsContact O-CG1 3.31Å; L23-I27 WeakPolarHBondContact O-CG1 3.09Å; L23-I27 PolarHBondContact O-N 3.43Å; E24-I27 PolarHBondContact O-N 3.33Å; I27-Q29 PolarHBondContact O-N 3.25Å; I27-T30 PolarHBondContact O-N 3.26Å; I27-H31 WeakPolarHBondContact O-CB 3.38Å; I27-H31 PolarHBondContact O-N 3.47Å; I27-L139 HydrophobicContact CG1-CD1 4.41Å; I27-L139 HydrophobicContact CG1-CD2 3.7Å; I27-L195 HydrophobicContact CD1-CB 4.46Å; I27-L195 HydrophobicContact CD1-CD1 4.44Å; I27-L195 HydrophobicContact CG1-CD1 4.5Å; I27-L195 HydrophobicContact CG2-CB 3.88Å; I27-L195 HydrophobicContact CG2-CD1 4.38Å; I27-L196 HydrophobicContact CB-CD2 4.1Å; I27-L196 HydrophobicContact CG2-CD2 3.5Å; I27-L196 HydrophobicContact CG2-CG 3.78Å |
| 28 | R | 95.3 | Very high | 89.6 | Confident | 144 Ų | 144 | 66.4 Ų | 66.4 | 54% | 0.543 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -57.4 | -48 | 177.4 | -71.6 | 178.4 | -176.3 | -117.3 | 4.4 | 111.7 | E24 A25 T30 H31 S32 L196 | E24-R28 WeakPolarHBondContact O-CG 3.39Å; E24-R28 PolarHBondContact O-N 3.07Å; E24-R28 IonicContact OE1-CZ 2.84Å; E24-R28 VanDerWaalsContact OE1-CZ 3.26Å; E24-R28 IonicContact OE1-NE 3.15Å; E24-R28 PolarHBondContact OE1-NE 2.86Å; E24-R28 IonicContact OE1-NH2 3.21Å; E24-R28 PolarHBondContact OE1-NH2 3.28Å; A25-R28 PolarHBondContact O-N 3.47Å; R28-T30 PolarHBondContact O-N 3.15Å; R28-H31 PolarHBondContact O-N 3.47Å; R28-S32 PolarHBondContact O-N 3.12Å; R28-S32 PolarHBondContact O-OG 3.46Å; R28-L196 HydrophobicContact CB-CD2 4.33Å; R28-L196 HydrophobicContact CG-CD1 4.42Å; R28-L196 HydrophobicContact CG-CD2 3.41Å; R28-L196 VanDerWaalsContact CG-CD2 3.41Å |
| 29 | Q | 95.5 | Very high | 91.4 | Very high | 142 Ų | 142 | 66.9 Ų | 66.9 | 66% | 0.664 | 34% | 0.341 | S | S | * | . | H | α-helix | trans | -59.6 | -46.6 | 178 | -176.1 | -175.6 | 14.5 | 0 | 0 | 111.8 | A25 I27 S32 L33 | A25-Q29 WeakPolarHBondContact O-CB 3.48Å; A25-Q29 PolarHBondContact O-N 3.3Å; I27-Q29 PolarHBondContact O-N 3.25Å; Q29-S32 PolarHBondContact O-N 2.86Å; Q29-L33 PolarHBondContact O-N 2.91Å |
| 30 | T | 96.6 | Very high | 93 | Very high | 5 Ų | 5 | 66.1 Ų | 66.1 | 3% | 0.031 | 33% | 0.331 | C | S | . | . | H | α-helix | trans | -67.1 | -39.3 | -178.7 | -50.5 | 0 | 0 | 0 | 0 | 111 | K26 I27 R28 L33 A34 L132 A135 V136 L139 L192 | K26-T30 WeakPolarHBondContact O-CB 3.41Å; K26-T30 PolarHBondContact O-N 3.31Å; K26-T30 PolarHBondContact O-OG1 2.97Å; I27-T30 PolarHBondContact O-N 3.26Å; R28-T30 PolarHBondContact O-N 3.15Å; T30-L33 PolarHBondContact O-N 2.96Å; T30-A34 PolarHBondContact O-N 3.16Å; T30-L132 HydrophobicContact CG2-CD1 3.86Å; T30-A135 HydrophobicContact CG2-CB 3.81Å; T30-V136 HydrophobicContact CG2-CG2 4.21Å; T30-L139 HydrophobicContact CG2-CD1 3.83Å; T30-L192 HydrophobicContact CG2-CD1 3.82Å; T30-L192 HydrophobicContact CG2-CD2 4.28Å |
| 31 | H | 97.5 | Very high | 94.2 | Very high | 45 Ų | 45 | 60.5 Ų | 60.5 | 21% | 0.208 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -62.3 | -47 | 173.6 | 175.9 | -92.6 | 0 | 0 | 0 | 112 | I27 R28 L33 A34 H35 E189 L192 G193 L196 | I27-H31 WeakPolarHBondContact O-CB 3.38Å; I27-H31 PolarHBondContact O-N 3.47Å; R28-H31 PolarHBondContact O-N 3.47Å; H31-L33 VanDerWaalsContact C-N 3.29Å; H31-L33 PolarHBondContact O-N 2.9Å; H31-A34 PolarHBondContact O-N 2.71Å; H31-H35 WeakPolarHBondContact O-CB 3.39Å; H31-H35 PolarHBondContact O-N 3.4Å; H31-E189 PolarHBondContact CD2-O 3.36Å; H31-L192 HydrophobicContact CB-CB 4.07Å; H31-G193 PolarHBondContact CD2-N 3.13Å; H31-L196 HydrophobicContact CB-CD1 3.85Å |
| 32 | S | 97.3 | Very high | 95.1 | Very high | 74 Ų | 74 | 61 Ų | 61 | 52% | 0.517 | 30% | 0.297 | S | S | . | . | H | α-helix | trans | -60.6 | -38.8 | 176.5 | -66.5 | 0 | 0 | 0 | 0 | 112.4 | R28 Q29 L36 | R28-S32 PolarHBondContact O-N 3.12Å; R28-S32 PolarHBondContact O-OG 3.46Å; Q29-S32 PolarHBondContact O-N 2.86Å; S32-L36 PolarHBondContact O-N 2.81Å; S32-L36 VanDerWaalsContact O-N 3.08Å |
| 33 | L | 97.1 | Very high | 95.7 | Very high | 63 Ų | 63 | 58.8 Ų | 58.8 | 33% | 0.33 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -62.3 | -51.4 | 172.3 | 177.2 | 62 | 0 | 0 | 0 | 110.7 | Q29 T30 H31 H35 L36 L37 L132 | Q29-L33 PolarHBondContact O-N 2.91Å; T30-L33 PolarHBondContact O-N 2.96Å; H31-L33 VanDerWaalsContact C-N 3.29Å; H31-L33 PolarHBondContact O-N 2.9Å; L33-H35 VanDerWaalsContact C-N 3.32Å; L33-H35 PolarHBondContact O-N 3.06Å; L33-L36 WeakPolarHBondContact O-CB 3.42Å; L33-L36 PolarHBondContact O-N 3.02Å; L33-L36 VanDerWaalsContact O-N 3.15Å; L33-L37 HydrophobicContact CD1-CD1 4.02Å; L33-L37 HydrophobicContact CD1-CD2 4.3Å; L33-L37 HydrophobicContact CD1-CG 3.98Å; L33-L37 HydrophobicContact CG-CD1 4.01Å; L33-L37 HydrophobicContact CG-CG 4.31Å; L33-L37 VanDerWaalsContact O-CG 3.28Å; L33-L37 WeakPolarHBondContact O-CG 3.47Å; L33-L37 PolarHBondContact O-N 3.19Å; L33-L132 HydrophobicContact CD2-CD1 4.08Å; L33-L132 HydrophobicContact CG-CD1 4.22Å |
| 34 | A | 97.8 | Very high | 96.3 | Very high | 0 Ų | 0 | 57.6 Ų | 57.6 | 0% | 0 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -55.1 | -46.9 | 178.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | T30 H31 L36 L37 T38 L132 E189 L192 | T30-A34 PolarHBondContact O-N 3.16Å; H31-A34 PolarHBondContact O-N 2.71Å; A34-L36 PolarHBondContact O-N 3.04Å; A34-L37 PolarHBondContact O-N 3.37Å; A34-L37 VanDerWaalsContact O-N 3.14Å; A34-T38 PolarHBondContact O-N 3.29Å; A34-T38 PolarHBondContact O-OG1 3.24Å; A34-L132 HydrophobicContact CB-CD1 4.06Å; A34-L132 HydrophobicContact CB-CD2 4.06Å; A34-E189 HydrophobicContact CB-CB 3.99Å; A34-L192 HydrophobicContact CB-CD1 3.96Å |
| 35 | H | 98.1 | Very high | 96.6 | Very high | 71 Ų | 71 | 54.3 Ų | 54.3 | 33% | 0.329 | 27% | 0.265 | S | S | . | . | H | α-helix | trans | -58.5 | -43.7 | 176.7 | -178.1 | 71.6 | 0 | 0 | 0 | 113.1 | H31 L33 L37 T38 K39 E189 | H31-H35 WeakPolarHBondContact O-CB 3.39Å; H31-H35 PolarHBondContact O-N 3.4Å; L33-H35 VanDerWaalsContact C-N 3.32Å; L33-H35 PolarHBondContact O-N 3.06Å; H35-L37 VanDerWaalsContact C-N 3.35Å; H35-T38 PolarHBondContact O-N 2.97Å; H35-K39 WeakPolarHBondContact NE2-CE 3.35Å; H35-K39 PolarHBondContact NE2-NZ 3.41Å; H35-K39 PolarHBondContact O-N 2.89Å; H35-E189 HydrophobicContact CB-CG 4.26Å; H35-E189 IonicContact CE1-OE1 3.26Å; H35-E189 IonicContact CG-OE1 2.99Å; H35-E189 IonicContact ND1-OE1 2.69Å; H35-E189 PolarHBondContact ND1-OE1 2.88Å |
| 36 | L | 98.3 | Very high | 96.9 | Very high | 71 Ų | 71 | 56.4 Ų | 56.4 | 37% | 0.372 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -62.5 | -44.4 | 175.5 | -179.4 | 63.5 | 0 | 0 | 0 | 111.2 | S32 L33 A34 T38 K39 Y40 | S32-L36 PolarHBondContact O-N 2.81Å; S32-L36 VanDerWaalsContact O-N 3.08Å; L33-L36 WeakPolarHBondContact O-CB 3.42Å; L33-L36 PolarHBondContact O-N 3.02Å; L33-L36 VanDerWaalsContact O-N 3.15Å; A34-L36 PolarHBondContact O-N 3.04Å; L36-T38 PolarHBondContact O-N 3.14Å; L36-K39 WeakPolarHBondContact O-CB 3.4Å; L36-K39 PolarHBondContact O-N 3.34Å; L36-Y40 HydrophobicContact CD1-CE1 3.99Å; L36-Y40 HydrophobicContact CD1-CE2 3.97Å; L36-Y40 HydrophobicContact CD2-CE2 3.94Å; L36-Y40 HydrophobicContact CG-CD2 4.23Å; L36-Y40 HydrophobicContact CG-CE2 3.67Å; L36-Y40 PolarHBondContact O-N 3.33Å |
| 37 | L | 98.3 | Very high | 97.1 | Very high | 3 Ų | 3 | 55.6 Ų | 55.6 | 2% | 0.016 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -66.9 | -35.3 | -179.2 | -64.6 | -175.1 | 0 | 0 | 0 | 112.2 | L33 A34 H35 K39 Y40 A41 Q128 L132 L185 | L33-L37 HydrophobicContact CD1-CD1 4.02Å; L33-L37 HydrophobicContact CD1-CD2 4.3Å; L33-L37 HydrophobicContact CD1-CG 3.98Å; L33-L37 HydrophobicContact CG-CD1 4.01Å; L33-L37 HydrophobicContact CG-CG 4.31Å; L33-L37 VanDerWaalsContact O-CG 3.28Å; L33-L37 WeakPolarHBondContact O-CG 3.47Å; L33-L37 PolarHBondContact O-N 3.19Å; A34-L37 PolarHBondContact O-N 3.37Å; A34-L37 VanDerWaalsContact O-N 3.14Å; H35-L37 VanDerWaalsContact C-N 3.35Å; L37-K39 VanDerWaalsContact C-N 3.29Å; L37-K39 PolarHBondContact O-N 2.85Å; L37-Y40 HydrophobicContact CD2-CD2 4.12Å; L37-Y40 PolarHBondContact O-N 3.39Å; L37-Y40 VanDerWaalsContact O-N 3.15Å; L37-A41 WeakPolarHBondContact O-CB 3.38Å; L37-A41 PolarHBondContact O-N 3.12Å; L37-Q128 HydrophobicContact CD1-CB 3.94Å; L37-Q128 HydrophobicContact CD2-CB 3.69Å; L37-Q128 VanDerWaalsContact CD2-CD 3.41Å; L37-Q128 HydrophobicContact CD2-CG 3.58Å; L37-Q128 HydrophobicContact CG-CB 4.44Å; L37-L132 HydrophobicContact CD1-CB 3.98Å; L37-L132 HydrophobicContact CD1-CD2 4.19Å; L37-L185 HydrophobicContact CB-CD1 3.87Å; L37-L185 HydrophobicContact CB-CD2 4.01Å; L37-L185 HydrophobicContact CD1-CD2 4.3Å |
| 38 | T | 97.9 | Very high | 97.2 | Very high | 20 Ų | 20 | 55 Ų | 55 | 12% | 0.123 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -55 | -45.5 | 172.4 | -63.4 | 0 | 0 | 0 | 0 | 111.2 | A34 H35 L36 Y40 A41 E42 S186 E189 | A34-T38 PolarHBondContact O-N 3.29Å; A34-T38 PolarHBondContact O-OG1 3.24Å; H35-T38 PolarHBondContact O-N 2.97Å; L36-T38 PolarHBondContact O-N 3.14Å; T38-Y40 PolarHBondContact O-N 3.44Å; T38-A41 PolarHBondContact O-N 3.03Å; T38-E42 PolarHBondContact O-N 3.5Å; T38-S186 VanDerWaalsContact CG2-OG 3.26Å; T38-S186 WeakPolarHBondContact CG2-OG 3.31Å; T38-E189 VanDerWaalsContact CB-OE2 3.28Å; T38-E189 WeakPolarHBondContact CB-OE2 3.39Å; T38-E189 PolarHBondContact OG1-OE2 3.43Å |
| 39 | K | 97.9 | Very high | 97.2 | Very high | 102 Ų | 102 | 49.7 Ų | 49.7 | 44% | 0.443 | 24% | 0.243 | S | C | . | . | H | α-helix | trans | -64 | -41.8 | 176.9 | -64.3 | 178.1 | -175.9 | 172 | 0 | 112 | H35 L36 L37 E42 Q43 | H35-K39 WeakPolarHBondContact NE2-CE 3.35Å; H35-K39 PolarHBondContact NE2-NZ 3.41Å; H35-K39 PolarHBondContact O-N 2.89Å; L36-K39 WeakPolarHBondContact O-CB 3.4Å; L36-K39 PolarHBondContact O-N 3.34Å; L37-K39 VanDerWaalsContact C-N 3.29Å; L37-K39 PolarHBondContact O-N 2.85Å; K39-E42 PolarHBondContact O-N 3.34Å; K39-Q43 WeakPolarHBondContact O-CG 3.38Å; K39-Q43 PolarHBondContact O-N 3.08Å; K39-Q43 VanDerWaalsContact O-N 3.16Å |
| 40 | Y | 98.1 | Very high | 97.1 | Very high | 92 Ų | 92 | 50 Ų | 50 | 36% | 0.361 | 25% | 0.245 | S | C | . | . | H | α-helix | trans | -67.9 | -35.2 | 177.4 | -66.3 | -18.4 | 0 | 0 | 0 | 112.7 | L36 L37 T38 Q43 L44 | L36-Y40 HydrophobicContact CD1-CE1 3.99Å; L36-Y40 HydrophobicContact CD1-CE2 3.97Å; L36-Y40 HydrophobicContact CD2-CE2 3.94Å; L36-Y40 HydrophobicContact CG-CD2 4.23Å; L36-Y40 HydrophobicContact CG-CE2 3.67Å; L36-Y40 PolarHBondContact O-N 3.33Å; L37-Y40 HydrophobicContact CD2-CD2 4.12Å; L37-Y40 PolarHBondContact O-N 3.39Å; L37-Y40 VanDerWaalsContact O-N 3.15Å; T38-Y40 PolarHBondContact O-N 3.44Å; Y40-Q43 PolarHBondContact O-N 3.32Å; Y40-L44 WeakPolarHBondContact O-CB 3.32Å; Y40-L44 PolarHBondContact O-N 2.89Å |
| 41 | A | 98.1 | Very high | 97 | Very high | 0 Ų | 0 | 53 Ų | 53 | 0% | 0 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -66.6 | -39.2 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | L37 T38 L44 L45 Y181 R182 L185 | L37-A41 WeakPolarHBondContact O-CB 3.38Å; L37-A41 PolarHBondContact O-N 3.12Å; T38-A41 PolarHBondContact O-N 3.03Å; A41-L44 PolarHBondContact O-N 3.15Å; A41-L45 PolarHBondContact O-N 3.36Å; A41-Y181 HydrophobicContact CB-CD1 3.56Å; A41-Y181 HydrophobicContact CB-CE1 3.43Å; A41-Y181 VanDerWaalsContact CB-CE1 3.43Å; A41-R182 HydrophobicContact CB-CB 3.91Å; A41-R182 HydrophobicContact CB-CG 4.16Å; A41-L185 HydrophobicContact CB-CD1 3.61Å |
| 42 | E | 97.9 | Very high | 96.8 | Very high | 92 Ų | 92 | 51.1 Ų | 51.1 | 43% | 0.43 | 25% | 0.252 | S | S | . | . | H | α-helix | trans | -61.3 | -47.3 | 172.7 | -177 | 171.7 | -160.4 | 0 | 0 | 111.6 | T38 K39 L44 L45 Q46 | T38-E42 PolarHBondContact O-N 3.5Å; K39-E42 PolarHBondContact O-N 3.34Å; E42-L44 VanDerWaalsContact C-N 3.34Å; E42-L44 PolarHBondContact O-N 2.93Å; E42-L45 PolarHBondContact O-N 3.24Å; E42-Q46 WeakPolarHBondContact O-CG 3.48Å; E42-Q46 PolarHBondContact O-N 3.13Å |
| 43 | Q | 97.4 | Very high | 96.5 | Very high | 80 Ų | 80 | 49 Ų | 49 | 37% | 0.374 | 24% | 0.242 | S | C | . | . | H | α-helix | trans | -61.2 | -41.8 | 176.2 | -67.8 | 174.7 | 10.7 | 0 | 0 | 112.5 | K39 Y40 L45 Q46 E47 | K39-Q43 WeakPolarHBondContact O-CG 3.38Å; K39-Q43 PolarHBondContact O-N 3.08Å; K39-Q43 VanDerWaalsContact O-N 3.16Å; Y40-Q43 PolarHBondContact O-N 3.32Å; Q43-L45 VanDerWaalsContact C-N 3.35Å; Q43-Q46 PolarHBondContact O-N 3.1Å; Q43-E47 VanDerWaalsContact O-CB 3.3Å; Q43-E47 WeakPolarHBondContact O-CB 3.3Å; Q43-E47 PolarHBondContact O-N 3.28Å |
| 44 | L | 98.2 | Very high | 96.1 | Very high | 4 Ų | 4 | 52 Ų | 52 | 2% | 0.021 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -59.9 | -45.7 | 176.2 | 169.5 | 61.7 | 0 | 0 | 0 | 111.1 | Y40 A41 E42 E47 Y48 L118 R121 L122 A125 Y181 | Y40-L44 WeakPolarHBondContact O-CB 3.32Å; Y40-L44 PolarHBondContact O-N 2.89Å; A41-L44 PolarHBondContact O-N 3.15Å; E42-L44 VanDerWaalsContact C-N 3.34Å; E42-L44 PolarHBondContact O-N 2.93Å; L44-E47 PolarHBondContact O-N 2.94Å; L44-Y48 VanDerWaalsContact O-CB 3.29Å; L44-Y48 WeakPolarHBondContact O-CB 3.36Å; L44-Y48 PolarHBondContact O-N 2.73Å; L44-L118 HydrophobicContact CD1-CD1 3.67Å; L44-R121 HydrophobicContact CD1-CB 3.95Å; L44-L122 HydrophobicContact CD1-CD2 3.93Å; L44-L122 HydrophobicContact CD1-CG 4.06Å; L44-L122 HydrophobicContact CD2-CD2 4.2Å; L44-A125 HydrophobicContact CD2-CB 3.75Å; L44-Y181 HydrophobicContact CD2-CD1 4.08Å; L44-Y181 HydrophobicContact CD2-CE1 4.18Å |
| 45 | L | 96.9 | Very high | 95.9 | Very high | 20 Ų | 20 | 54 Ų | 54 | 11% | 0.105 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -64 | -44.8 | 179.3 | 180 | 64.3 | 0 | 0 | 0 | 111.7 | A41 E42 Q43 Y48 V49 L175 C178 | A41-L45 PolarHBondContact O-N 3.36Å; E42-L45 PolarHBondContact O-N 3.24Å; Q43-L45 VanDerWaalsContact C-N 3.35Å; L45-Y48 PolarHBondContact O-N 3.36Å; L45-V49 HydrophobicContact CD1-CG2 4.48Å; L45-V49 WeakPolarHBondContact O-CG2 3.48Å; L45-V49 PolarHBondContact O-N 2.83Å; L45-L175 HydrophobicContact CD1-CD1 3.72Å; L45-C178 HydrophobicContact CB-CB 4.46Å; L45-C178 HydrophobicContact CD1-CB 3.68Å |
| 46 | Q | 95.4 | Very high | 95.5 | Very high | 99 Ų | 99 | 51.4 Ų | 51.4 | 46% | 0.463 | 26% | 0.259 | S | S | . | . | H | α-helix | trans | -60.4 | -47.6 | 176.5 | -71.6 | 175.3 | 0.3 | 0 | 0 | 111.4 | E42 Q43 Y48 V49 Q50 | E42-Q46 WeakPolarHBondContact O-CG 3.48Å; E42-Q46 PolarHBondContact O-N 3.13Å; Q43-Q46 PolarHBondContact O-N 3.1Å; Q46-Y48 VanDerWaalsContact C-N 3.33Å; Q46-Y48 PolarHBondContact O-N 2.88Å; Q46-V49 PolarHBondContact O-N 3.49Å; Q46-Q50 WeakPolarHBondContact O-CG 3.32Å; Q46-Q50 PolarHBondContact O-N 3.12Å |
| 47 | E | 95.9 | Very high | 95 | Very high | 27 Ų | 27 | 50.1 Ų | 50.1 | 13% | 0.126 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -63.3 | -39.9 | 178.3 | -174.1 | 168 | 160.9 | 0 | 0 | 111.7 | Q43 L44 Q50 L51 R117 R121 | Q43-E47 VanDerWaalsContact O-CB 3.3Å; Q43-E47 WeakPolarHBondContact O-CB 3.3Å; Q43-E47 PolarHBondContact O-N 3.28Å; L44-E47 PolarHBondContact O-N 2.94Å; E47-Q50 PolarHBondContact O-N 2.92Å; E47-L51 WeakPolarHBondContact O-CB 3.12Å; E47-L51 PolarHBondContact O-N 3.38Å; E47-R117 VanDerWaalsContact CD-NE 3.28Å; E47-R117 VanDerWaalsContact OE1-CD 3.3Å; E47-R117 WeakPolarHBondContact OE1-CD 3.31Å; E47-R117 VanDerWaalsContact OE1-CG 3.22Å; E47-R117 WeakPolarHBondContact OE1-CG 3.45Å; E47-R117 IonicContact OE1-CZ 2.71Å; E47-R117 IonicContact OE1-NE 3.75Å; E47-R117 PolarHBondContact OE1-NE 3.09Å; E47-R117 IonicContact OE2-CZ 3.57Å; E47-R117 IonicContact OE2-NE 3.7Å; E47-R117 PolarHBondContact OE2-NE 2.96Å; E47-R117 IonicContact OE2-NH2 3.56Å; E47-R117 PolarHBondContact OE2-NH2 3.34Å; E47-R121 WeakPolarHBondContact OE2-CD 3.36Å; E47-R121 IonicContact OE2-CZ 3.69Å; E47-R121 IonicContact OE2-NE 3.65Å; E47-R121 PolarHBondContact OE2-NE 3.08Å |
| 48 | Y | 96.7 | Very high | 94.7 | Very high | 0 Ų | 0 | 53.5 Ų | 53.5 | 0% | 0 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -59.7 | -49.6 | 175.1 | -175.6 | -85.6 | 0 | 0 | 0 | 111.4 | L44 L45 Q46 L51 Q52 V104 Q108 L118 K171 G174 L175 | L44-Y48 VanDerWaalsContact O-CB 3.29Å; L44-Y48 WeakPolarHBondContact O-CB 3.36Å; L44-Y48 PolarHBondContact O-N 2.73Å; L45-Y48 PolarHBondContact O-N 3.36Å; Q46-Y48 VanDerWaalsContact C-N 3.33Å; Q46-Y48 PolarHBondContact O-N 2.88Å; Y48-L51 PolarHBondContact O-N 3.2Å; Y48-Q52 HydrophobicContact CD1-CG 3.95Å; Y48-Q52 HydrophobicContact CE1-CG 3.52Å; Y48-Q52 VanDerWaalsContact O-CG 3.29Å; Y48-Q52 WeakPolarHBondContact O-CG 3.49Å; Y48-Q52 PolarHBondContact O-N 3.36Å; Y48-Q52 VanDerWaalsContact O-N 3.13Å; Y48-Q52 PolarHBondContact O-NE2 3.39Å; Y48-V104 HydrophobicContact CE2-CG1 3.83Å; Y48-Q108 HydrophobicContact CE2-CG 3.9Å; Y48-Q108 PolarHBondContact OH-NE2 3.33Å; Y48-L118 HydrophobicContact CD2-CD1 4.3Å; Y48-L118 HydrophobicContact CD2-CD2 4.07Å; Y48-K171 WeakPolarHBondContact CE1-O 3.26Å; Y48-K171 WeakPolarHBondContact OH-CA 3.28Å; Y48-K171 PolarHBondContact OH-O 2.75Å; Y48-G174 VanDerWaalsContact CZ-C 3.46Å; Y48-G174 WeakPolarHBondContact OH-CA 3.48Å; Y48-L175 HydrophobicContact CD1-CB 4.34Å; Y48-L175 HydrophobicContact CD1-CD1 4.32Å; Y48-L175 HydrophobicContact CE1-CB 3.9Å |
| 49 | V | 94.9 | Very high | 94.1 | Very high | 33 Ų | 33 | 59.1 Ų | 59.1 | 20% | 0.2 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -59.8 | -48.7 | 179 | 167.4 | 0 | 0 | 0 | 0 | 111.1 | L45 Q46 L51 Q52 G53 F56 L175 | L45-V49 HydrophobicContact CD1-CG2 4.48Å; L45-V49 WeakPolarHBondContact O-CG2 3.48Å; L45-V49 PolarHBondContact O-N 2.83Å; Q46-V49 PolarHBondContact O-N 3.49Å; V49-L51 VanDerWaalsContact C-N 3.3Å; V49-L51 PolarHBondContact O-N 3.41Å; V49-Q52 PolarHBondContact O-N 3.05Å; V49-Q52 VanDerWaalsContact O-N 3.14Å; V49-G53 PolarHBondContact O-N 3.38Å; V49-F56 HydrophobicContact CG1-CB 4.47Å; V49-F56 VanDerWaalsContact CG1-O 3.24Å; V49-F56 WeakPolarHBondContact CG1-O 3.4Å; V49-L175 HydrophobicContact CG2-CD1 3.4Å; V49-L175 VanDerWaalsContact CG2-CD1 3.4Å |
| 50 | Q | 93.1 | Very high | 93.6 | Very high | 150 Ų | 150 | 59.3 Ų | 59.3 | 70% | 0.701 | 33% | 0.332 | S | S | * | . | H | α-helix | trans | -58 | -43.3 | 179.4 | -74.5 | 177.1 | 3.8 | 0 | 0 | 111.8 | Q46 E47 Q52 G53 | Q46-Q50 WeakPolarHBondContact O-CG 3.32Å; Q46-Q50 PolarHBondContact O-N 3.12Å; E47-Q50 PolarHBondContact O-N 2.92Å; Q50-Q52 VanDerWaalsContact C-N 3.33Å; Q50-Q52 PolarHBondContact O-N 3.36Å; Q50-G53 PolarHBondContact O-N 3.46Å |
| 51 | L | 93.8 | Very high | 93.2 | Very high | 67 Ų | 67 | 57.2 Ų | 57.2 | 35% | 0.351 | 33% | 0.325 | S | S | . | . | H | α-helix | trans | -69 | -30.2 | 179.8 | -167.4 | 77.7 | 0 | 0 | 0 | 112.9 | E47 Y48 V49 G53 N112 A115 L118 | E47-L51 WeakPolarHBondContact O-CB 3.12Å; E47-L51 PolarHBondContact O-N 3.38Å; Y48-L51 PolarHBondContact O-N 3.2Å; V49-L51 VanDerWaalsContact C-N 3.3Å; V49-L51 PolarHBondContact O-N 3.41Å; L51-G53 PolarHBondContact O-N 3.45Å; L51-N112 HydrophobicContact CD2-CB 3.93Å; L51-A115 HydrophobicContact CD1-CB 3.97Å; L51-A115 HydrophobicContact CD2-CB 3.36Å; L51-A115 HydrophobicContact CG-CB 4.31Å; L51-L118 HydrophobicContact CD2-CB 4.39Å; L51-L118 HydrophobicContact CD2-CD2 3.33Å; L51-L118 HydrophobicContact CD2-CG 4.47Å |
| 52 | Q | 93.3 | Very high | 92.7 | Very high | 5 Ų | 5 | 62.2 Ų | 62.2 | 2% | 0.023 | 36% | 0.36 | C | S | . | . | H | α-helix | trans | -70.4 | -23.3 | 179.9 | -64.5 | -28.5 | -66.9 | 0 | 0 | 113 | Y48 V49 Q50 F56 Q108 K171 | Y48-Q52 HydrophobicContact CD1-CG 3.95Å; Y48-Q52 HydrophobicContact CE1-CG 3.52Å; Y48-Q52 VanDerWaalsContact O-CG 3.29Å; Y48-Q52 WeakPolarHBondContact O-CG 3.49Å; Y48-Q52 PolarHBondContact O-N 3.36Å; Y48-Q52 VanDerWaalsContact O-N 3.13Å; Y48-Q52 PolarHBondContact O-NE2 3.39Å; V49-Q52 PolarHBondContact O-N 3.05Å; V49-Q52 VanDerWaalsContact O-N 3.14Å; Q50-Q52 VanDerWaalsContact C-N 3.33Å; Q50-Q52 PolarHBondContact O-N 3.36Å; Q52-F56 HydrophobicContact CB-CB 3.89Å; Q52-F56 HydrophobicContact CB-CD1 4.38Å; Q52-F56 HydrophobicContact CB-CD2 3.63Å; Q52-F56 HydrophobicContact CB-CE2 4.3Å; Q52-F56 HydrophobicContact CB-CG 3.7Å; Q52-F56 HydrophobicContact CG-CG 4.37Å; Q52-Q108 VanDerWaalsContact NE2-OE1 3.17Å; Q52-K171 HydrophobicContact CB-CD 4.34Å; Q52-K171 HydrophobicContact CG-CB 4.45Å; Q52-K171 HydrophobicContact CG-CD 4.34Å; Q52-K171 HydrophobicContact CG-CG 4.48Å; Q52-K171 PolarHBondContact O-NZ 3.14Å; Q52-K171 VanDerWaalsContact O-NZ 3.15Å; Q52-K171 VanDerWaalsContact OE1-CD 3.23Å |
| 53 | G | 90.5 | Very high | 92.1 | Very high | 31 Ų | 31 | 60.1 Ų | 60.1 | 32% | 0.32 | 36% | 0.355 | S | S | . | . | trans | 68 | -163.8 | -177.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | V49 Q50 L51 F56 G57 | V49-G53 PolarHBondContact O-N 3.38Å; Q50-G53 PolarHBondContact O-N 3.46Å; L51-G53 PolarHBondContact O-N 3.45Å; G53-F56 WeakPolarHBondContact O-CA 3.5Å; G53-F56 VanDerWaalsContact O-CB 3.3Å; G53-F56 WeakPolarHBondContact O-CB 3.43Å; G53-F56 PolarHBondContact O-N 3.13Å; G53-G57 PolarHBondContact O-N 2.65Å | ||
| 54 | D | 90.5 | Very high | 91.6 | Very high | 124 Ų | 124 | 59.5 Ų | 59.5 | 66% | 0.663 | 36% | 0.357 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -64.1 | 141.8 | 177 | -69.3 | -18.1 | 0 | 0 | 0 | 111.5 | L58 | D54-L58 WeakPolarHBondContact OD1-CD2 3.38Š|
| 55 | P | 92.1 | Very high | 90.8 | Very high | 44 Ų | 44 | 70.7 Ų | 70.7 | 29% | 0.286 | 40% | 0.399 | S | S | . | . | T | Hydrogen-bonded Turn | cis | -86.7 | 0.2 | 4.5 | 35.7 | -37.9 | 0 | 0 | 0 | 114.8 | G57 L58 F61 F168 | P55-G57 VanDerWaalsContact C-N 3.28Å; P55-G57 PolarHBondContact O-N 3Å; P55-L58 HydrophobicContact CB-CD1 4.21Å; P55-L58 WeakPolarHBondContact O-CB 3.37Å; P55-L58 PolarHBondContact O-N 3.14Å; P55-L58 VanDerWaalsContact O-N 3.1Å; P55-F61 HydrophobicContact CB-CB 4.28Å; P55-F61 HydrophobicContact CB-CD1 4.38Å; P55-F61 HydrophobicContact CB-CD2 3.6Å; P55-F61 HydrophobicContact CB-CE2 3.94Å; P55-F61 HydrophobicContact CB-CG 3.83Å; P55-F61 HydrophobicContact CB-CZ 4.45Å; P55-F61 HydrophobicContact CG-CD1 4.4Å; P55-F61 HydrophobicContact CG-CD2 3.74Å; P55-F61 HydrophobicContact CG-CE1 4.18Å; P55-F61 HydrophobicContact CG-CE2 3.51Å; P55-F61 HydrophobicContact CG-CG 4.18Å; P55-F61 HydrophobicContact CG-CZ 3.74Å; P55-F61 WeakPolarHBondContact O-CB 3.42Å; P55-F61 WeakPolarHBondContact O-CD1 3.47Å; P55-F61 WeakPolarHBondContact O-CG 3.4Å; P55-F168 HydrophobicContact CG-CE2 4.31Å |
| 56 | F | 91.3 | Very high | 90.1 | Very high | 15 Ų | 15 | 72.2 Ų | 72.2 | 7% | 0.066 | 41% | 0.407 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -64 | -30.3 | -171 | -62.4 | -95.3 | 0 | 0 | 0 | 113.9 | V49 Q52 G53 L58 F61 F168 K171 V172 L175 | V49-F56 HydrophobicContact CG1-CB 4.47Å; V49-F56 VanDerWaalsContact CG1-O 3.24Å; V49-F56 WeakPolarHBondContact CG1-O 3.4Å; Q52-F56 HydrophobicContact CB-CB 3.89Å; Q52-F56 HydrophobicContact CB-CD1 4.38Å; Q52-F56 HydrophobicContact CB-CD2 3.63Å; Q52-F56 HydrophobicContact CB-CE2 4.3Å; Q52-F56 HydrophobicContact CB-CG 3.7Å; Q52-F56 HydrophobicContact CG-CG 4.37Å; G53-F56 WeakPolarHBondContact O-CA 3.5Å; G53-F56 VanDerWaalsContact O-CB 3.3Å; G53-F56 WeakPolarHBondContact O-CB 3.43Å; G53-F56 PolarHBondContact O-N 3.13Å; F56-L58 VanDerWaalsContact C-N 3.34Å; F56-F61 AromaticContact CD1-CE1 3.8Å; F56-F61 HydrophobicContact CD1-CE1 3.8Å; F56-F61 HydrophobicContact CE1-CE1 4.04Å; F56-F61 HydrophobicContact CE1-CZ 4.48Å; F56-F61 HydrophobicContact CG-CE1 4.15Å; F56-F168 HydrophobicContact CE2-CD2 4.1Å; F56-F168 HydrophobicContact CE2-CE2 4.03Å; F56-F168 AromaticContact CZ-CD2 3.92Å; F56-F168 HydrophobicContact CZ-CD2 3.92Å; F56-F168 AromaticContact CZ-CE2 3.77Å; F56-F168 HydrophobicContact CZ-CE2 3.77Å; F56-K171 HydrophobicContact CE1-CB 4.06Å; F56-K171 HydrophobicContact CE2-CB 3.98Å; F56-K171 HydrophobicContact CE2-CD 3.87Å; F56-K171 HydrophobicContact CZ-CB 3.46Å; F56-K171 VanDerWaalsContact CZ-CB 3.46Å; F56-K171 HydrophobicContact CZ-CD 4.24Å; F56-V172 HydrophobicContact CE1-CG2 3.87Å; F56-V172 HydrophobicContact CZ-CG2 3.94Å; F56-L175 HydrophobicContact CD1-CD2 4.12Å; F56-L175 HydrophobicContact CE1-CD2 4.5Å |
| 57 | G | 87.5 | Confident | 89.6 | Confident | 45 Ų | 45 | 73.1 Ų | 73.1 | 46% | 0.464 | 42% | 0.422 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -81.2 | -8.3 | 177.3 | 0 | 0 | 0 | 0 | 0 | 115 | G53 P55 | G53-G57 PolarHBondContact O-N 2.65Å; P55-G57 VanDerWaalsContact C-N 3.28Å; P55-G57 PolarHBondContact O-N 3Å |
| 58 | L | 90.8 | Very high | 89.2 | Confident | 74 Ų | 74 | 72.5 Ų | 72.5 | 39% | 0.387 | 42% | 0.42 | S | S | . | . | trans | -81.2 | 131.6 | -176.1 | -60.3 | 176.7 | 0 | 0 | 0 | 110.9 | D54 P55 F56 S60 F61 | D54-L58 WeakPolarHBondContact OD1-CD2 3.38Å; P55-L58 HydrophobicContact CB-CD1 4.21Å; P55-L58 WeakPolarHBondContact O-CB 3.37Å; P55-L58 PolarHBondContact O-N 3.14Å; P55-L58 VanDerWaalsContact O-N 3.1Å; F56-L58 VanDerWaalsContact C-N 3.34Å; L58-S60 PolarHBondContact O-N 3.03Å; L58-S60 VanDerWaalsContact O-N 3.16Å; L58-F61 HydrophobicContact CB-CB 4.13Å; L58-F61 WeakPolarHBondContact O-CB 3.22Å; L58-F61 PolarHBondContact O-N 3.44Å | ||
| 59 | P | 85.1 | Confident | 88.5 | Confident | 138 Ų | 138 | 74.5 Ų | 74.5 | 90% | 0.896 | 44% | 0.436 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -60 | -27.4 | 178.6 | -24 | 33 | 0 | 0 | 0 | 114.3 | ||
| 60 | S | 88.7 | Confident | 87.8 | Confident | 106 Ų | 106 | 76.1 Ų | 76.1 | 74% | 0.741 | 46% | 0.46 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -84.4 | -10.4 | 179.5 | 54.4 | 0 | 0 | 0 | 0 | 113.5 | L58 S62 | L58-S60 PolarHBondContact O-N 3.03Å; L58-S60 VanDerWaalsContact O-N 3.16Å; S60-S62 PolarHBondContact O-N 2.93Å |
| 61 | F | 89.1 | Confident | 87.7 | Confident | 47 Ų | 47 | 69.5 Ų | 69.5 | 21% | 0.206 | 43% | 0.429 | C | S | . | . | trans | -76.1 | 116.4 | -177.8 | 178.2 | -115.8 | 0 | 0 | 0 | 110.9 | P55 F56 L58 P63 F168 | P55-F61 HydrophobicContact CB-CB 4.28Å; P55-F61 HydrophobicContact CB-CD1 4.38Å; P55-F61 HydrophobicContact CB-CD2 3.6Å; P55-F61 HydrophobicContact CB-CE2 3.94Å; P55-F61 HydrophobicContact CB-CG 3.83Å; P55-F61 HydrophobicContact CB-CZ 4.45Å; P55-F61 HydrophobicContact CG-CD1 4.4Å; P55-F61 HydrophobicContact CG-CD2 3.74Å; P55-F61 HydrophobicContact CG-CE1 4.18Å; P55-F61 HydrophobicContact CG-CE2 3.51Å; P55-F61 HydrophobicContact CG-CG 4.18Å; P55-F61 HydrophobicContact CG-CZ 3.74Å; P55-F61 WeakPolarHBondContact O-CB 3.42Å; P55-F61 WeakPolarHBondContact O-CD1 3.47Å; P55-F61 WeakPolarHBondContact O-CG 3.4Å; F56-F61 AromaticContact CD1-CE1 3.8Å; F56-F61 HydrophobicContact CD1-CE1 3.8Å; F56-F61 HydrophobicContact CE1-CE1 4.04Å; F56-F61 HydrophobicContact CE1-CZ 4.48Å; F56-F61 HydrophobicContact CG-CE1 4.15Å; L58-F61 HydrophobicContact CB-CB 4.13Å; L58-F61 WeakPolarHBondContact O-CB 3.22Å; L58-F61 PolarHBondContact O-N 3.44Å; F61-P63 HydrophobicContact CD1-CB 4.44Å; F61-P63 HydrophobicContact CE1-CB 3.71Å; F61-P63 HydrophobicContact CE1-CG 4.4Å; F61-P63 HydrophobicContact CZ-CB 4.02Å; F61-P63 WeakPolarHBondContact O-CD 3.48Å; F61-F168 HydrophobicContact CE2-CZ 4.34Å; F61-F168 HydrophobicContact CZ-CE2 4.07Å; F61-F168 AromaticContact CZ-CZ 3.93Å; F61-F168 HydrophobicContact CZ-CZ 3.93Å | ||
| 62 | S | 87.6 | Confident | 87.5 | Confident | 106 Ų | 106 | 70.7 Ų | 70.7 | 74% | 0.741 | 44% | 0.443 | S | S | * | . | trans | -101.6 | 101.6 | 170.3 | -69.7 | 0 | 0 | 0 | 0 | 109 | S60 | S60-S62 PolarHBondContact O-N 2.93Š| ||
| 63 | P | 85.4 | Confident | 87.4 | Confident | 48 Ų | 48 | 72.1 Ų | 72.1 | 31% | 0.312 | 46% | 0.456 | S | S | . | . | trans | -62.8 | 146.2 | 179.9 | 26.5 | -35.8 | 0 | 0 | 0 | 110.9 | F61 R65 V172 L175 | F61-P63 HydrophobicContact CD1-CB 4.44Å; F61-P63 HydrophobicContact CE1-CB 3.71Å; F61-P63 HydrophobicContact CE1-CG 4.4Å; F61-P63 HydrophobicContact CZ-CB 4.02Å; F61-P63 WeakPolarHBondContact O-CD 3.48Å; P63-R65 PolarHBondContact O-N 3.24Å; P63-V172 HydrophobicContact CB-CG1 4.34Å; P63-L175 HydrophobicContact CB-CD2 3.82Å; P63-L175 HydrophobicContact CG-CD2 3.58Å | ||
| 64 | P | 86.8 | Confident | 87.3 | Confident | 66 Ų | 66 | 71.7 Ų | 71.7 | 43% | 0.429 | 45% | 0.447 | S | S | . | . | trans | -54.6 | 138 | 172.2 | -24.8 | 33.5 | 0 | 0 | 0 | 111.6 | L66 F168 V172 | P64-L66 PolarHBondContact O-N 3.48Å; P64-F168 HydrophobicContact CG-CE1 4.23Å; P64-V172 VanDerWaalsContact O-CG1 3.31Å; P64-V172 WeakPolarHBondContact O-CG1 3.49Å | ||
| 65 | R | 81.7 | Confident | 87.3 | Confident | 239 Ų | 239 | 68 Ų | 68 | 90% | 0.902 | 43% | 0.434 | S | S | * | . | trans | -77.5 | 90.7 | 175.1 | -66 | -168.3 | -174.9 | -158 | 2.7 | 109.7 | P63 | P63-R65 PolarHBondContact O-N 3.24Š| ||
| 66 | L | 83.1 | Confident | 87 | Confident | 53 Ų | 53 | 72 Ų | 72 | 28% | 0.277 | 46% | 0.46 | S | S | . | . | trans | -79.9 | 130.6 | 172.7 | -64.1 | 180 | 0 | 0 | 0 | 110.3 | P64 V172 | P64-L66 PolarHBondContact O-N 3.48Å; L66-V172 HydrophobicContact CD1-CB 3.76Å; L66-V172 HydrophobicContact CD1-CG1 3.53Å; L66-V172 HydrophobicContact CG-CG1 3.78Å | ||
| 67 | P | 84.6 | Confident | 86.8 | Confident | 118 Ų | 118 | 75.3 Ų | 75.3 | 77% | 0.766 | 49% | 0.485 | S | S | * | . | trans | -66.6 | 136.8 | 171.6 | 28.7 | -32.7 | 0 | 0 | 0 | 109.4 | ||||
| 68 | V | 86.5 | Confident | 86.8 | Confident | 13 Ų | 13 | 73.4 Ų | 73.4 | 8% | 0.079 | 46% | 0.464 | C | S | . | . | trans | -104.2 | 113.7 | 171.6 | -179.3 | 0 | 0 | 0 | 0 | 106.9 | G70 L71 L100 L173 R176 V177 L180 | V68-G70 PolarHBondContact O-N 3.01Å; V68-L71 HydrophobicContact CG1-CB 4.41Å; V68-L71 PolarHBondContact O-N 3.11Å; V68-L100 HydrophobicContact CG1-CD1 3.63Å; V68-L100 HydrophobicContact CG1-CD2 3.72Å; V68-L100 HydrophobicContact CG1-CG 4.28Å; V68-L173 HydrophobicContact CG2-CD1 4.04Å; V68-R176 HydrophobicContact CG2-CB 4.31Å; V68-R176 HydrophobicContact CG2-CG 3.55Å; V68-V177 HydrophobicContact CG1-CG2 4.28Å; V68-V177 HydrophobicContact CG2-CG2 4.29Å; V68-L180 HydrophobicContact CB-CD1 3.95Å; V68-L180 HydrophobicContact CG1-CD1 4.36Å; V68-L180 HydrophobicContact CG2-CD1 3.83Å | ||
| 69 | A | 82.8 | Confident | 86.6 | Confident | 43 Ų | 43 | 72.5 Ų | 72.5 | 36% | 0.355 | 47% | 0.467 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -60 | 130.2 | -177.4 | 0 | 0 | 0 | 0 | 0 | 110.8 | L71 S160 | A69-L71 VanDerWaalsContact C-N 3.27Å; A69-L71 PolarHBondContact O-N 3.38Å; A69-S160 WeakPolarHBondContact CB-O 3.4Å |
| 70 | G | 80.3 | Confident | 86.7 | Confident | 67 Ų | 67 | 69.5 Ų | 69.5 | 69% | 0.691 | 46% | 0.461 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 77.8 | 0 | 179.4 | 0 | 0 | 0 | 0 | 0 | 115.6 | V68 | V68-G70 PolarHBondContact O-N 3.01Š|
| 71 | L | 90.6 | Very high | 86.8 | Confident | 11 Ų | 11 | 66.9 Ų | 66.9 | 6% | 0.058 | 44% | 0.439 | C | S | . | . | trans | -146.9 | 119.1 | 177.5 | -170.5 | 64.3 | 0 | 0 | 0 | 112.6 | V68 A69 A93 A96 L97 L100 L180 | V68-L71 HydrophobicContact CG1-CB 4.41Å; V68-L71 PolarHBondContact O-N 3.11Å; A69-L71 VanDerWaalsContact C-N 3.27Å; A69-L71 PolarHBondContact O-N 3.38Å; L71-A93 HydrophobicContact CD1-CB 3.83Å; L71-A96 HydrophobicContact CD1-CB 4.34Å; L71-L97 HydrophobicContact CD2-CD2 3.47Å; L71-L97 VanDerWaalsContact CD2-CD2 3.47Å; L71-L97 HydrophobicContact CD2-CG 3.72Å; L71-L100 HydrophobicContact CB-CD1 3.86Å; L71-L100 HydrophobicContact CD2-CD1 3.7Å; L71-L100 HydrophobicContact CG-CD1 4.45Å; L71-L180 HydrophobicContact CD2-CB 4.16Å; L71-L180 HydrophobicContact CD2-CD1 4.18Å; L71-L180 HydrophobicContact CG-CD1 4.29Å | ||
| 72 | S | 90.2 | Very high | 86.8 | Confident | 92 Ų | 92 | 67.7 Ų | 67.7 | 64% | 0.643 | 45% | 0.448 | S | S | * | . | trans | -104.7 | 164.3 | 171.4 | -68.3 | 0 | 0 | 0 | 0 | 110.9 | W184 | S72-W184 PolarHBondContact O-NE1 3.32Š| ||
| 73 | A | 89.8 | Confident | 86.9 | Confident | 35 Ų | 35 | 64.8 Ų | 64.8 | 29% | 0.289 | 43% | 0.426 | S | S | . | . | P | Polyproline II helix | trans | -65.9 | 152.4 | 168.4 | 0 | 0 | 0 | 0 | 0 | 110 | A75 L180 E183 | A73-A75 PolarHBondContact O-N 3.11Å; A73-L180 HydrophobicContact CB-CD2 3.88Å; A73-E183 VanDerWaalsContact CB-OE2 3.25Å; A73-E183 WeakPolarHBondContact CB-OE2 3.32Å |
| 74 | P | 89.3 | Confident | 87 | Confident | 21 Ų | 21 | 67 Ų | 67 | 14% | 0.136 | 43% | 0.432 | C | S | . | . | P | Polyproline II helix | trans | -55.2 | 123.5 | 174.3 | -21.7 | 30.5 | 0 | 0 | 0 | 110.9 | W184 R187 | P74-W184 HydrophobicContact CB-CH2 4.24Å; P74-W184 HydrophobicContact CB-CZ2 4.33Å; P74-W184 HydrophobicContact CB-CZ3 4.39Å; P74-W184 HydrophobicContact CG-CD2 3.73Å; P74-W184 HydrophobicContact CG-CE3 3.92Å; P74-W184 HydrophobicContact CG-CG 4.27Å; P74-W184 HydrophobicContact CG-CH2 4.16Å; P74-W184 HydrophobicContact CG-CZ2 3.97Å; P74-W184 HydrophobicContact CG-CZ3 4.13Å; P74-R187 HydrophobicContact CB-CG 4.35Å; P74-R187 HydrophobicContact CG-CB 4.17Å; P74-R187 HydrophobicContact CG-CG 4.41Å |
| 75 | A | 89.4 | Confident | 87.2 | Confident | 47 Ų | 47 | 68 Ų | 68 | 39% | 0.388 | 43% | 0.431 | S | S | . | . | P | Polyproline II helix | trans | -65.5 | 151.3 | 179.6 | 0 | 0 | 0 | 0 | 0 | 111.3 | A73 S77 H78 | A73-A75 PolarHBondContact O-N 3.11Å; A75-S77 PolarHBondContact O-N 3.39Å; A75-H78 WeakPolarHBondContact O-CB 3.48Å; A75-H78 PolarHBondContact O-N 2.92Å |
| 76 | P | 87.4 | Confident | 87.8 | Confident | 127 Ų | 127 | 57.3 Ų | 57.3 | 83% | 0.825 | 39% | 0.391 | S | S | * | . | G | 310 helix | trans | -57.5 | -34.3 | 174.6 | -25.3 | 34.6 | 0 | 0 | 0 | 113.2 | H78 | P76-H78 PolarHBondContact O-N 2.87Š|
| 77 | S | 86.6 | Confident | 88.3 | Confident | 86 Ų | 86 | 54.8 Ų | 54.8 | 60% | 0.601 | 38% | 0.378 | S | S | * | . | G | 310 helix | trans | -66 | -14.1 | 175.8 | 53.2 | 0 | 0 | 0 | 0 | 113.9 | A75 A79 G80 | A75-S77 PolarHBondContact O-N 3.39Å; S77-A79 VanDerWaalsContact C-N 3.25Å; S77-A79 PolarHBondContact O-N 3.36Å; S77-G80 PolarHBondContact O-N 3.45Å |
| 78 | H | 87.4 | Confident | 88.8 | Confident | 5 Ų | 5 | 57.4 Ų | 57.4 | 2% | 0.023 | 37% | 0.372 | C | S | . | . | G | 310 helix | trans | -54.5 | -42.2 | -179.9 | -171.3 | -117.2 | 0 | 0 | 0 | 112.1 | A75 P76 G80 L81 R86 D90 R187 D191 | A75-H78 WeakPolarHBondContact O-CB 3.48Å; A75-H78 PolarHBondContact O-N 2.92Å; P76-H78 PolarHBondContact O-N 2.87Å; H78-G80 PolarHBondContact O-N 3.3Å; H78-L81 WeakPolarHBondContact O-CB 3.29Å; H78-L81 PolarHBondContact O-N 3.4Å; H78-L81 VanDerWaalsContact O-N 3.14Å; H78-R86 WeakPolarHBondContact NE2-CA 3.47Å; H78-R86 WeakPolarHBondContact O-CD 3.45Å; H78-R86 WeakPolarHBondContact O-CG 3.4Å; H78-D90 IonicContact CE1-OD1 3.03Å; H78-R187 VanDerWaalsContact CE1-CG 3.47Å; H78-R187 WeakPolarHBondContact CE1-CG 3.42Å; H78-R187 WeakPolarHBondContact ND1-CD 3.49Å; H78-R187 WeakPolarHBondContact ND1-CG 3.29Å; H78-R187 PolarHBondContact ND1-NE 3.15Å; H78-D191 IonicContact CE1-OD2 2.65Å; H78-D191 PolarHBondContact CE1-OD2 2.89Å; H78-D191 IonicContact ND1-OD2 3.92Å |
| 79 | A | 86.6 | Confident | 89.2 | Confident | 55 Ų | 55 | 60.6 Ų | 60.6 | 46% | 0.455 | 39% | 0.388 | S | S | . | . | G | 310 helix | trans | -64.7 | -24.3 | -178.8 | 0 | 0 | 0 | 0 | 0 | 113.7 | S77 L81 R86 | S77-A79 VanDerWaalsContact C-N 3.25Å; S77-A79 PolarHBondContact O-N 3.36Å; A79-L81 VanDerWaalsContact C-N 3.34Å; A79-R86 PolarHBondContact O-NH1 3.45Å |
| 80 | G | 87.5 | Confident | 89.8 | Confident | 74 Ų | 74 | 58.6 Ų | 58.6 | 76% | 0.763 | 37% | 0.371 | S | S | * | . | G | 310 helix | trans | -82.2 | -9.9 | 178.2 | 0 | 0 | 0 | 0 | 0 | 114.2 | S77 H78 | S77-G80 PolarHBondContact O-N 3.45Å; H78-G80 PolarHBondContact O-N 3.3Å |
| 81 | L | 89.8 | Confident | 90.5 | Very high | 52 Ų | 52 | 55.6 Ų | 55.6 | 27% | 0.272 | 34% | 0.34 | S | S | . | . | S | Bend | trans | -76.4 | 153.3 | 179.1 | -60.5 | 174.2 | 0 | 0 | 0 | 111.2 | H78 A79 E85 R86 L89 | H78-L81 WeakPolarHBondContact O-CB 3.29Å; H78-L81 PolarHBondContact O-N 3.4Å; H78-L81 VanDerWaalsContact O-N 3.14Å; A79-L81 VanDerWaalsContact C-N 3.34Å; L81-E85 HydrophobicContact CB-CB 4.35Å; L81-R86 HydrophobicContact CB-CG 3.68Å; L81-R86 WeakPolarHBondContact O-CD 3.46Å; L81-R86 PolarHBondContact O-NH1 3.32Å; L81-L89 HydrophobicContact CD1-CD1 3.47Å; L81-L89 VanDerWaalsContact CD1-CD1 3.47Å |
| 82 | P | 90.4 | Very high | 90.7 | Very high | 63 Ų | 63 | 57.9 Ų | 57.9 | 41% | 0.409 | 36% | 0.361 | S | S | . | . | trans | -55.8 | 144.6 | 168.8 | -23.5 | 33.9 | 0 | 0 | 0 | 112.1 | H84 E85 R86 | P82-H84 WeakPolarHBondContact CB-CE1 3.3Å; P82-H84 WeakPolarHBondContact CB-ND1 3.22Å; P82-H84 PolarHBondContact O-N 2.94Å; P82-H84 VanDerWaalsContact O-N 3.1Å; P82-E85 HydrophobicContact CB-CG 4.34Å; P82-E85 WeakPolarHBondContact CD-OE2 3.35Å; P82-E85 HydrophobicContact CG-CG 4.36Å; P82-E85 WeakPolarHBondContact O-CB 3.49Å; P82-E85 PolarHBondContact O-N 3.47Å; P82-R86 PolarHBondContact O-N 2.97Å | ||
| 83 | V | 89.5 | Confident | 91 | Very high | 45 Ų | 45 | 53.8 Ų | 53.8 | 27% | 0.273 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -54.6 | -36.4 | -174.9 | 67.5 | 0 | 0 | 0 | 0 | 113.7 | R86 L87 L195 | V83-R86 PolarHBondContact O-N 3.43Å; V83-L87 HydrophobicContact CG2-CD1 4.18Å; V83-L87 HydrophobicContact CG2-CG 4.46Å; V83-L87 VanDerWaalsContact O-CG 3.32Å; V83-L87 WeakPolarHBondContact O-CG 3.43Å; V83-L87 PolarHBondContact O-N 3.49Å; V83-L195 HydrophobicContact CB-CD2 4.37Å; V83-L195 HydrophobicContact CG1-CD2 3.88Å; V83-L195 HydrophobicContact CG2-CD2 3.58Å; V83-L195 HydrophobicContact CG2-CG 3.81Å |
| 84 | H | 87.4 | Confident | 91.3 | Very high | 96 Ų | 96 | 52.1 Ų | 52.1 | 44% | 0.444 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -68.4 | -34.8 | 177.9 | 68.5 | -89.8 | 0 | 0 | 0 | 112.6 | P82 R88 | P82-H84 WeakPolarHBondContact CB-CE1 3.3Å; P82-H84 WeakPolarHBondContact CB-ND1 3.22Å; P82-H84 PolarHBondContact O-N 2.94Å; P82-H84 VanDerWaalsContact O-N 3.1Å; H84-R88 VanDerWaalsContact O-CG 3.31Å; H84-R88 WeakPolarHBondContact O-CG 3.45Å; H84-R88 PolarHBondContact O-N 3.41Å |
| 85 | E | 91.1 | Very high | 91.6 | Very high | 85 Ų | 85 | 54 Ų | 54 | 40% | 0.397 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -72 | -40.6 | 174.9 | -62 | -169.5 | 169.2 | 0 | 0 | 110.9 | L81 P82 R88 L89 | L81-E85 HydrophobicContact CB-CB 4.35Å; P82-E85 HydrophobicContact CB-CG 4.34Å; P82-E85 WeakPolarHBondContact CD-OE2 3.35Å; P82-E85 HydrophobicContact CG-CG 4.36Å; P82-E85 WeakPolarHBondContact O-CB 3.49Å; P82-E85 PolarHBondContact O-N 3.47Å; E85-R88 WeakPolarHBondContact O-CB 3.38Å; E85-R88 PolarHBondContact O-N 2.9Å; E85-L89 WeakPolarHBondContact O-CG 3.33Å; E85-L89 PolarHBondContact O-N 3.26Å |
| 86 | R | 93.8 | Very high | 91.9 | Very high | 16 Ų | 16 | 52.5 Ų | 52.5 | 6% | 0.06 | 32% | 0.324 | C | S | . | . | H | α-helix | trans | -58 | -50.2 | 175 | -63.3 | -168.8 | -49.9 | -121.9 | 5.4 | 111.6 | H78 A79 L81 P82 V83 R88 L89 D90 D191 Q194 | H78-R86 WeakPolarHBondContact NE2-CA 3.47Å; H78-R86 WeakPolarHBondContact O-CD 3.45Å; H78-R86 WeakPolarHBondContact O-CG 3.4Å; A79-R86 PolarHBondContact O-NH1 3.45Å; L81-R86 HydrophobicContact CB-CG 3.68Å; L81-R86 WeakPolarHBondContact O-CD 3.46Å; L81-R86 PolarHBondContact O-NH1 3.32Å; P82-R86 PolarHBondContact O-N 2.97Å; V83-R86 PolarHBondContact O-N 3.43Å; R86-R88 VanDerWaalsContact C-N 3.25Å; R86-R88 PolarHBondContact O-N 3.48Å; R86-L89 WeakPolarHBondContact O-CB 3.42Å; R86-L89 PolarHBondContact O-N 2.94Å; R86-D90 PolarHBondContact O-N 3.44Å; R86-D191 WeakPolarHBondContact CD-OD1 3.48Å; R86-D191 IonicContact CZ-OD1 3.5Å; R86-D191 IonicContact NE-OD1 2.81Å; R86-D191 PolarHBondContact NE-OD1 2.9Å; R86-D191 IonicContact NH2-OD1 2.99Å; R86-D191 PolarHBondContact NH2-OD1 3.28Å; R86-Q194 VanDerWaalsContact NH2-CD 3.28Å |
| 87 | L | 94.3 | Very high | 92.4 | Very high | 0 Ų | 0 | 46.5 Ų | 46.5 | 0% | 0 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -63.7 | -29.1 | 178.3 | -69 | 173.5 | 0 | 0 | 0 | 113.2 | V83 A91 V136 L140 D191 L192 L195 | V83-L87 HydrophobicContact CG2-CD1 4.18Å; V83-L87 HydrophobicContact CG2-CG 4.46Å; V83-L87 VanDerWaalsContact O-CG 3.32Å; V83-L87 WeakPolarHBondContact O-CG 3.43Å; V83-L87 PolarHBondContact O-N 3.49Å; L87-A91 WeakPolarHBondContact O-CB 3.41Å; L87-A91 PolarHBondContact O-N 2.99Å; L87-V136 HydrophobicContact CB-CG1 4.13Å; L87-V136 HydrophobicContact CD2-CG1 4.17Å; L87-V136 WeakPolarHBondContact O-CG1 3.39Å; L87-L140 HydrophobicContact CB-CD1 4.27Å; L87-L140 HydrophobicContact CB-CD2 3.84Å; L87-L140 HydrophobicContact CB-CG 4.1Å; L87-D191 HydrophobicContact CD2-CB 4.1Å; L87-L192 HydrophobicContact CD2-CD2 3.96Å; L87-L192 HydrophobicContact CD2-CG 4.18Å; L87-L195 HydrophobicContact CD1-CD1 3.53Å; L87-L195 HydrophobicContact CD1-CG 4.3Å |
| 88 | R | 94.3 | Very high | 92.9 | Very high | 173 Ų | 173 | 42.5 Ų | 42.5 | 65% | 0.653 | 26% | 0.257 | S | S | * | . | H | α-helix | trans | -68.5 | -41.2 | 172.6 | -75.8 | 177.9 | 78 | 169.9 | 5.7 | 111.6 | H84 E85 R86 A92 L140 | H84-R88 VanDerWaalsContact O-CG 3.31Å; H84-R88 WeakPolarHBondContact O-CG 3.45Å; H84-R88 PolarHBondContact O-N 3.41Å; E85-R88 WeakPolarHBondContact O-CB 3.38Å; E85-R88 PolarHBondContact O-N 2.9Å; R86-R88 VanDerWaalsContact C-N 3.25Å; R86-R88 PolarHBondContact O-N 3.48Å; R88-A92 WeakPolarHBondContact O-CB 3.21Å; R88-A92 PolarHBondContact O-N 3.02Å; R88-A92 VanDerWaalsContact O-N 3.07Å; R88-L140 HydrophobicContact CB-CD1 4.37Å; R88-L140 HydrophobicContact CG-CD1 3.69Å; R88-L140 HydrophobicContact CG-CD2 3.98Å; R88-L140 HydrophobicContact CG-CG 4.48Å |
| 89 | L | 94.1 | Very high | 93.3 | Very high | 80 Ų | 80 | 44.6 Ų | 44.6 | 42% | 0.419 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -67 | -41.4 | 175.4 | -66.4 | 173.2 | 0 | 0 | 0 | 111.2 | L81 E85 R86 A92 A93 | L81-L89 HydrophobicContact CD1-CD1 3.47Å; L81-L89 VanDerWaalsContact CD1-CD1 3.47Å; E85-L89 WeakPolarHBondContact O-CG 3.33Å; E85-L89 PolarHBondContact O-N 3.26Å; R86-L89 WeakPolarHBondContact O-CB 3.42Å; R86-L89 PolarHBondContact O-N 2.94Å; L89-A92 PolarHBondContact O-N 3.43Å; L89-A93 WeakPolarHBondContact O-CB 3.46Å; L89-A93 PolarHBondContact O-N 3.36Å |
| 90 | D | 95.8 | Very high | 93.7 | Very high | 0 Ų | 0 | 42.1 Ų | 42.1 | 0% | 0 | 25% | 0.25 | C | C | . | . | H | α-helix | trans | -56.3 | -51.4 | 172.8 | -71.6 | -25.8 | 0 | 0 | 0 | 111.5 | H78 R86 A92 A93 L94 T188 | H78-D90 IonicContact CE1-OD1 3.03Å; R86-D90 PolarHBondContact O-N 3.44Å; D90-A92 VanDerWaalsContact C-N 3.34Å; D90-A92 PolarHBondContact O-N 3.32Å; D90-A93 PolarHBondContact O-N 3.48Å; D90-L94 WeakPolarHBondContact O-CB 3.29Å; D90-L94 VanDerWaalsContact O-CG 3.25Å; D90-L94 WeakPolarHBondContact O-CG 3.33Å; D90-L94 PolarHBondContact O-N 2.86Å; D90-T188 HydrophobicContact CB-CG2 4.21Å; D90-T188 WeakPolarHBondContact CB-OG1 3.31Å; D90-T188 VanDerWaalsContact CG-OG1 3.31Å; D90-T188 PolarHBondContact OD1-OG1 3.39Å; D90-T188 WeakPolarHBondContact OD2-CA 3.27Å |
| 91 | A | 95.5 | Very high | 94.2 | Very high | 4 Ų | 4 | 38.6 Ų | 38.6 | 3% | 0.033 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -58.3 | -44.8 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | L87 A93 L94 A95 V136 E137 L140 | L87-A91 WeakPolarHBondContact O-CB 3.41Å; L87-A91 PolarHBondContact O-N 2.99Å; A91-A93 PolarHBondContact O-N 3.4Å; A91-L94 PolarHBondContact O-N 3.1Å; A91-A95 WeakPolarHBondContact O-CB 3.24Å; A91-A95 PolarHBondContact O-N 2.8Å; A91-V136 HydrophobicContact CB-CG1 4.1Å; A91-E137 HydrophobicContact CB-CG 3.79Å; A91-L140 HydrophobicContact CB-CD1 4.45Å |
| 92 | A | 94.6 | Very high | 94.5 | Very high | 60 Ų | 60 | 38 Ų | 38 | 50% | 0.496 | 21% | 0.21 | S | C | . | . | H | α-helix | trans | -62.7 | -42.2 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | R88 L89 D90 A95 A96 | R88-A92 WeakPolarHBondContact O-CB 3.21Å; R88-A92 PolarHBondContact O-N 3.02Å; R88-A92 VanDerWaalsContact O-N 3.07Å; L89-A92 PolarHBondContact O-N 3.43Å; D90-A92 VanDerWaalsContact C-N 3.34Å; D90-A92 PolarHBondContact O-N 3.32Å; A92-A95 PolarHBondContact O-N 2.89Å; A92-A96 PolarHBondContact O-N 2.87Å; A92-A96 VanDerWaalsContact O-N 3.11Å |
| 93 | A | 96 | Very high | 94.7 | Very high | 5 Ų | 5 | 36.9 Ų | 36.9 | 4% | 0.041 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -65.7 | -44 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | L71 L89 D90 A91 A95 A96 L97 W184 | L71-A93 HydrophobicContact CD1-CB 3.83Å; L89-A93 WeakPolarHBondContact O-CB 3.46Å; L89-A93 PolarHBondContact O-N 3.36Å; D90-A93 PolarHBondContact O-N 3.48Å; A91-A93 PolarHBondContact O-N 3.4Å; A93-A95 VanDerWaalsContact C-N 3.28Å; A93-A95 PolarHBondContact O-N 3.29Å; A93-A96 PolarHBondContact O-N 3.25Å; A93-A96 VanDerWaalsContact O-N 3.11Å; A93-L97 WeakPolarHBondContact O-CG 3.33Å; A93-L97 PolarHBondContact O-N 3.25Å; A93-L97 VanDerWaalsContact O-N 3.15Å; A93-W184 HydrophobicContact CB-CD2 3.25Å; A93-W184 VanDerWaalsContact CB-CE2 3.4Å; A93-W184 HydrophobicContact CB-CE3 3.47Å; A93-W184 VanDerWaalsContact CB-CE3 3.47Å; A93-W184 HydrophobicContact CB-CG 3.75Å; A93-W184 HydrophobicContact CB-CH2 3.96Å; A93-W184 HydrophobicContact CB-CZ2 3.78Å; A93-W184 HydrophobicContact CB-CZ3 3.82Å |
| 94 | L | 97.2 | Very high | 95 | Very high | 0 Ų | 0 | 35 Ų | 35 | 0% | 0 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -62 | -33.8 | 175.6 | -70.8 | 170 | 0 | 0 | 0 | 112.4 | D90 A91 L97 P98 L132 V136 L185 T188 | D90-L94 WeakPolarHBondContact O-CB 3.29Å; D90-L94 VanDerWaalsContact O-CG 3.25Å; D90-L94 WeakPolarHBondContact O-CG 3.33Å; D90-L94 PolarHBondContact O-N 2.86Å; A91-L94 PolarHBondContact O-N 3.1Å; L94-L97 HydrophobicContact CD2-CD1 4.23Å; L94-P98 WeakPolarHBondContact O-CD 3.44Å; L94-L132 HydrophobicContact CD1-CB 4.35Å; L94-L132 HydrophobicContact CD1-CD2 3.91Å; L94-L132 HydrophobicContact CD1-CG 3.88Å; L94-L132 HydrophobicContact CD2-CD2 4.17Å; L94-V136 HydrophobicContact CD1-CG2 4.4Å; L94-L185 HydrophobicContact CD2-CD2 3.93Å; L94-T188 HydrophobicContact CD1-CG2 4.14Å |
| 95 | A | 95.4 | Very high | 95.5 | Very high | 60 Ų | 60 | 33.9 Ų | 33.9 | 50% | 0.496 | 18% | 0.183 | S | C | . | . | H | α-helix | trans | -71.6 | -30.7 | 173.6 | 0 | 0 | 0 | 0 | 0 | 113.2 | A91 A92 A93 P98 | A91-A95 WeakPolarHBondContact O-CB 3.24Å; A91-A95 PolarHBondContact O-N 2.8Å; A92-A95 PolarHBondContact O-N 2.89Å; A93-A95 VanDerWaalsContact C-N 3.28Å; A93-A95 PolarHBondContact O-N 3.29Å; A95-P98 WeakPolarHBondContact O-CD 3.5Å |
| 96 | A | 95.8 | Very high | 95.7 | Very high | 17 Ų | 17 | 36.6 Ų | 36.6 | 14% | 0.14 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -79.1 | -22.3 | 179 | 0 | 0 | 0 | 0 | 0 | 113.8 | L71 A92 A93 P99 L100 | L71-A96 HydrophobicContact CD1-CB 4.34Å; A92-A96 PolarHBondContact O-N 2.87Å; A92-A96 VanDerWaalsContact O-N 3.11Å; A93-A96 PolarHBondContact O-N 3.25Å; A93-A96 VanDerWaalsContact O-N 3.11Å; A96-P99 WeakPolarHBondContact O-CD 3.32Å; A96-P99 WeakPolarHBondContact O-CG 3.16Å; A96-L100 WeakPolarHBondContact O-CG 3.32Å |
| 97 | L | 96.6 | Very high | 95.7 | Very high | 0 Ų | 0 | 40 Ų | 40 | 0% | 0 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -68.6 | -43.8 | -175.1 | -82.4 | 160.3 | 0 | 0 | 0 | 115.9 | L71 A93 L94 L100 L101 A129 Y181 W184 | L71-L97 HydrophobicContact CD2-CD2 3.47Å; L71-L97 VanDerWaalsContact CD2-CD2 3.47Å; L71-L97 HydrophobicContact CD2-CG 3.72Å; A93-L97 WeakPolarHBondContact O-CG 3.33Å; A93-L97 PolarHBondContact O-N 3.25Å; A93-L97 VanDerWaalsContact O-N 3.15Å; L94-L97 HydrophobicContact CD2-CD1 4.23Å; L97-L100 WeakPolarHBondContact O-CB 3.3Å; L97-L100 PolarHBondContact O-N 3.43Å; L97-L100 VanDerWaalsContact O-N 3.12Å; L97-L101 HydrophobicContact CB-CD1 4.42Å; L97-L101 WeakPolarHBondContact O-CG 3.46Å; L97-L101 PolarHBondContact O-N 2.97Å; L97-A129 HydrophobicContact CB-CB 4.11Å; L97-Y181 HydrophobicContact CD1-CD2 4.12Å; L97-Y181 HydrophobicContact CD2-CD2 4.48Å; L97-W184 HydrophobicContact CD1-CB 4.16Å |
| 98 | P | 97.5 | Very high | 95.8 | Very high | 2 Ų | 2 | 40 Ų | 40 | 1% | 0.013 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -52.5 | -51.4 | -177.3 | -25.9 | 31.2 | 0 | 0 | 0 | 115.2 | L94 A95 L100 L101 D102 A126 A129 R130 | L94-P98 WeakPolarHBondContact O-CD 3.44Å; A95-P98 WeakPolarHBondContact O-CD 3.5Å; P98-L100 VanDerWaalsContact C-N 3.25Å; P98-L100 PolarHBondContact O-N 3.39Å; P98-L101 PolarHBondContact O-N 2.96Å; P98-D102 PolarHBondContact O-N 3.3Å; P98-A126 HydrophobicContact CB-CB 4.18Å; P98-A126 WeakPolarHBondContact CG-O 3.4Å; P98-A129 HydrophobicContact CG-CB 4.21Å; P98-R130 HydrophobicContact CG-CB 4.09Å |
| 99 | P | 96 | Very high | 95.8 | Very high | 49 Ų | 49 | 33.9 Ų | 33.9 | 32% | 0.318 | 19% | 0.188 | S | C | . | . | H | α-helix | trans | -63.2 | -31.9 | 179.5 | 25 | -34.7 | 0 | 0 | 0 | 112.8 | A96 D102 V103 A159 | A96-P99 WeakPolarHBondContact O-CD 3.32Å; A96-P99 WeakPolarHBondContact O-CG 3.16Å; P99-D102 PolarHBondContact O-N 2.86Å; P99-V103 WeakPolarHBondContact O-CG2 3.48Å; P99-V103 PolarHBondContact O-N 3.44Å; P99-V103 VanDerWaalsContact O-N 3.11Å; P99-A159 HydrophobicContact CG-CB 4.28Å |
| 100 | L | 95.8 | Very high | 95.8 | Very high | 3 Ų | 3 | 36 Ų | 36 | 2% | 0.016 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -68.3 | -45.8 | 176.2 | -61.8 | 171.6 | 0 | 0 | 0 | 111.3 | V68 L71 A96 L97 P98 D102 V103 V104 A161 V177 | V68-L100 HydrophobicContact CG1-CD1 3.63Å; V68-L100 HydrophobicContact CG1-CD2 3.72Å; V68-L100 HydrophobicContact CG1-CG 4.28Å; L71-L100 HydrophobicContact CB-CD1 3.86Å; L71-L100 HydrophobicContact CD2-CD1 3.7Å; L71-L100 HydrophobicContact CG-CD1 4.45Å; A96-L100 WeakPolarHBondContact O-CG 3.32Å; L97-L100 WeakPolarHBondContact O-CB 3.3Å; L97-L100 PolarHBondContact O-N 3.43Å; L97-L100 VanDerWaalsContact O-N 3.12Å; P98-L100 VanDerWaalsContact C-N 3.25Å; P98-L100 PolarHBondContact O-N 3.39Å; L100-D102 VanDerWaalsContact C-N 3.28Å; L100-D102 PolarHBondContact O-N 2.9Å; L100-V103 WeakPolarHBondContact O-CB 3.21Å; L100-V103 PolarHBondContact O-N 2.98Å; L100-V104 WeakPolarHBondContact O-CG2 3.44Å; L100-V104 PolarHBondContact O-N 3.49Å; L100-V104 VanDerWaalsContact O-N 3.08Å; L100-A161 HydrophobicContact CD2-CB 4.08Å; L100-V177 HydrophobicContact CB-CG1 3.88Å; L100-V177 HydrophobicContact CB-CG2 4.22Å |
| 101 | L | 97.5 | Very high | 95.6 | Very high | 0 Ų | 0 | 38.6 Ų | 38.6 | 0% | 0 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -61.3 | -37.8 | 175.8 | -71.9 | 164.2 | 0 | 0 | 0 | 111.6 | L97 P98 V104 R105 L122 A125 A126 V177 Y181 | L97-L101 HydrophobicContact CB-CD1 4.42Å; L97-L101 WeakPolarHBondContact O-CG 3.46Å; L97-L101 PolarHBondContact O-N 2.97Å; P98-L101 PolarHBondContact O-N 2.96Å; L101-V104 PolarHBondContact O-N 3.45Å; L101-R105 WeakPolarHBondContact O-CB 3.47Å; L101-R105 PolarHBondContact O-N 3.35Å; L101-L122 HydrophobicContact CD2-CD2 4.15Å; L101-A125 HydrophobicContact CD1-CB 3.95Å; L101-A125 HydrophobicContact CD2-CB 4.36Å; L101-A126 HydrophobicContact CB-CB 4.01Å; L101-A126 HydrophobicContact CD1-CB 4.29Å; L101-V177 HydrophobicContact CD2-CG1 3.94Å; L101-V177 HydrophobicContact CG-CG1 4.18Å; L101-Y181 HydrophobicContact CD1-CD2 4.16Å; L101-Y181 HydrophobicContact CD1-CE2 4.49Å; L101-Y181 HydrophobicContact CD1-CG 4.42Å |
| 102 | D | 96.4 | Very high | 95.5 | Very high | 39 Ų | 39 | 40.3 Ų | 40.3 | 21% | 0.209 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -66.5 | -34.3 | 175 | -81 | -38.4 | 0 | 0 | 0 | 113.5 | P98 P99 L100 R105 R106 | P98-D102 PolarHBondContact O-N 3.3Å; P99-D102 PolarHBondContact O-N 2.86Å; L100-D102 VanDerWaalsContact C-N 3.28Å; L100-D102 PolarHBondContact O-N 2.9Å; D102-R105 IonicContact OD1-NE 3.59Å; D102-R106 WeakPolarHBondContact O-CG 3.44Å; D102-R106 PolarHBondContact O-N 2.81Å; D102-R106 PolarHBondContact O-NE 2.97Å |
| 103 | V | 94.8 | Very high | 95.4 | Very high | 40 Ų | 40 | 41.2 Ų | 41.2 | 24% | 0.242 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -64.9 | -46.6 | 172.1 | 168.3 | 0 | 0 | 0 | 0 | 110.1 | P99 L100 R105 R106 R107 A161 | P99-V103 WeakPolarHBondContact O-CG2 3.48Å; P99-V103 PolarHBondContact O-N 3.44Å; P99-V103 VanDerWaalsContact O-N 3.11Å; L100-V103 WeakPolarHBondContact O-CB 3.21Å; L100-V103 PolarHBondContact O-N 2.98Å; V103-R105 VanDerWaalsContact C-N 3.34Å; V103-R105 PolarHBondContact O-N 2.92Å; V103-R106 PolarHBondContact O-N 2.84Å; V103-R107 WeakPolarHBondContact O-CG 3.39Å; V103-R107 PolarHBondContact O-N 3.32Å; V103-A161 HydrophobicContact CG1-CB 4.22Å; V103-A161 HydrophobicContact CG2-CB 4.24Å |
| 104 | V | 95.9 | Very high | 95.4 | Very high | 5 Ų | 5 | 52.1 Ų | 52.1 | 3% | 0.03 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -61.3 | -44.2 | 177.7 | 178.6 | 0 | 0 | 0 | 0 | 111 | Y48 L100 L101 R106 R107 Q108 L122 V177 | Y48-V104 HydrophobicContact CE2-CG1 3.83Å; L100-V104 WeakPolarHBondContact O-CG2 3.44Å; L100-V104 PolarHBondContact O-N 3.49Å; L100-V104 VanDerWaalsContact O-N 3.08Å; L101-V104 PolarHBondContact O-N 3.45Å; V104-R106 PolarHBondContact O-N 3.2Å; V104-R107 PolarHBondContact O-N 3.4Å; V104-Q108 HydrophobicContact CG1-CG 4.26Å; V104-Q108 WeakPolarHBondContact O-CB 3.31Å; V104-Q108 WeakPolarHBondContact O-CG 3.25Å; V104-Q108 PolarHBondContact O-N 3.4Å; V104-L122 HydrophobicContact CG1-CD1 4.08Å; V104-L122 HydrophobicContact CG1-CD2 4.05Å; V104-V177 HydrophobicContact CG2-CB 3.83Å; V104-V177 HydrophobicContact CG2-CG1 3.96Å; V104-V177 HydrophobicContact CG2-CG2 4.02Å |
| 105 | R | 97.1 | Very high | 95.3 | Very high | 73 Ų | 73 | 52.9 Ų | 52.9 | 28% | 0.275 | 27% | 0.265 | S | S | . | . | H | α-helix | trans | -57.3 | -48.7 | 176.6 | -171.1 | -178.3 | 69.4 | 102.8 | 11.5 | 111.9 | L101 D102 V103 R107 Q108 A109 L119 L122 E123 | L101-R105 WeakPolarHBondContact O-CB 3.47Å; L101-R105 PolarHBondContact O-N 3.35Å; D102-R105 IonicContact OD1-NE 3.59Å; V103-R105 VanDerWaalsContact C-N 3.34Å; V103-R105 PolarHBondContact O-N 2.92Å; R105-R107 PolarHBondContact O-N 2.84Å; R105-Q108 PolarHBondContact O-N 2.94Å; R105-A109 PolarHBondContact O-N 2.99Å; R105-L119 WeakPolarHBondContact CD-O 3.33Å; R105-L119 HydrophobicContact CG-CB 4.44Å; R105-L119 HydrophobicContact CG-CD2 4.19Å; R105-L119 WeakPolarHBondContact O-CD2 3.43Å; R105-L122 HydrophobicContact CB-CB 3.94Å; R105-L122 HydrophobicContact CB-CD1 4.18Å; R105-L122 HydrophobicContact CG-CB 4.14Å; R105-E123 IonicContact CZ-OE2 3.61Å; R105-E123 IonicContact NH1-OE2 3.44Å; R105-E123 PolarHBondContact NH1-OE2 3.37Å |
| 106 | R | 95.9 | Very high | 95.3 | Very high | 143 Ų | 143 | 54.9 Ų | 54.9 | 54% | 0.54 | 26% | 0.264 | S | S | . | . | H | α-helix | trans | -60.2 | -44.6 | 178.2 | -78 | -177.7 | -89.7 | -164.5 | -4.2 | 112 | D102 V103 V104 Q108 A109 E110 | D102-R106 WeakPolarHBondContact O-CG 3.44Å; D102-R106 PolarHBondContact O-N 2.81Å; D102-R106 PolarHBondContact O-NE 2.97Å; V103-R106 PolarHBondContact O-N 2.84Å; V104-R106 PolarHBondContact O-N 3.2Å; R106-Q108 PolarHBondContact O-N 3.05Å; R106-A109 WeakPolarHBondContact O-CB 3.39Å; R106-A109 PolarHBondContact O-N 3.04Å; R106-E110 PolarHBondContact O-N 3.07Å |
| 107 | R | 93.9 | Very high | 95.4 | Very high | 87 Ų | 87 | 61.3 Ų | 61.3 | 33% | 0.328 | 29% | 0.285 | S | S | . | . | H | α-helix | trans | -63.6 | -40.7 | 175.5 | -67.9 | -58.2 | -171.3 | -168.5 | 2.1 | 112.9 | V103 V104 R105 A109 E110 L111 | V103-R107 WeakPolarHBondContact O-CG 3.39Å; V103-R107 PolarHBondContact O-N 3.32Å; V104-R107 PolarHBondContact O-N 3.4Å; R105-R107 PolarHBondContact O-N 2.84Å; R107-A109 VanDerWaalsContact C-N 3.28Å; R107-A109 PolarHBondContact O-N 2.83Å; R107-E110 WeakPolarHBondContact CD-OE2 3.5Å; R107-E110 IonicContact CZ-OE2 3.9Å; R107-E110 IonicContact NH1-OE1 3.78Å; R107-E110 IonicContact NH1-OE2 2.88Å; R107-E110 PolarHBondContact NH1-OE2 3.38Å; R107-E110 WeakPolarHBondContact O-CB 3.38Å; R107-E110 PolarHBondContact O-N 3.36Å; R107-L111 WeakPolarHBondContact O-CB 3.46Å; R107-L111 WeakPolarHBondContact O-CG 3.25Å; R107-L111 PolarHBondContact O-N 2.86Å |
| 108 | Q | 95.2 | Very high | 95.4 | Very high | 1 Ų | 1 | 61.4 Ų | 61.4 | 1% | 0.005 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -68.9 | -28.4 | 176.6 | -71.1 | -63.5 | -43.9 | 0 | 0 | 112.2 | Y48 Q52 V104 R105 R106 E110 N112 L118 L119 L122 | Y48-Q108 HydrophobicContact CE2-CG 3.9Å; Y48-Q108 PolarHBondContact OH-NE2 3.33Å; Q52-Q108 VanDerWaalsContact NE2-OE1 3.17Å; V104-Q108 HydrophobicContact CG1-CG 4.26Å; V104-Q108 WeakPolarHBondContact O-CB 3.31Å; V104-Q108 WeakPolarHBondContact O-CG 3.25Å; V104-Q108 PolarHBondContact O-N 3.4Å; R105-Q108 PolarHBondContact O-N 2.94Å; R106-Q108 PolarHBondContact O-N 3.05Å; Q108-E110 VanDerWaalsContact C-N 3.33Å; Q108-N112 CarbonylContact O-C 3.58Å; Q108-N112 VanDerWaalsContact O-C 3.24Å; Q108-N112 VanDerWaalsContact O-CA 3.3Å; Q108-N112 WeakPolarHBondContact O-CA 3.38Å; Q108-N112 PolarHBondContact O-N 3.47Å; Q108-N112 PolarHBondContact OE1-ND2 2.88Å; Q108-L118 HydrophobicContact CB-CD2 4.47Å; Q108-L118 HydrophobicContact CG-CD2 4.15Å; Q108-L119 HydrophobicContact CB-CD2 3.71Å; Q108-L122 HydrophobicContact CB-CD1 4.42Å; Q108-L122 HydrophobicContact CG-CD1 4.28Å |
| 109 | A | 95.5 | Very high | 95.4 | Very high | 43 Ų | 43 | 62.2 Ų | 62.2 | 36% | 0.355 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -67.5 | -35.4 | 173 | 0 | 0 | 0 | 0 | 0 | 111.8 | R105 R106 R107 P113 L119 | R105-A109 PolarHBondContact O-N 2.99Å; R106-A109 WeakPolarHBondContact O-CB 3.39Å; R106-A109 PolarHBondContact O-N 3.04Å; R107-A109 VanDerWaalsContact C-N 3.28Å; R107-A109 PolarHBondContact O-N 2.83Å; A109-P113 WeakPolarHBondContact O-CA 3.49Å; A109-P113 WeakPolarHBondContact O-CB 3.34Å; A109-L119 HydrophobicContact CB-CD1 4.03Å; A109-L119 HydrophobicContact CB-CD2 4.1Å |
| 110 | E | 94 | Very high | 95.5 | Very high | 125 Ų | 125 | 67.9 Ų | 67.9 | 58% | 0.584 | 31% | 0.305 | S | S | * | . | H | α-helix | trans | -70.5 | -46.2 | 173.5 | -66.1 | 166.6 | -174 | 0 | 0 | 111.8 | R106 R107 Q108 | R106-E110 PolarHBondContact O-N 3.07Å; R107-E110 WeakPolarHBondContact CD-OE2 3.5Å; R107-E110 IonicContact CZ-OE2 3.9Å; R107-E110 IonicContact NH1-OE1 3.78Å; R107-E110 IonicContact NH1-OE2 2.88Å; R107-E110 PolarHBondContact NH1-OE2 3.38Å; R107-E110 WeakPolarHBondContact O-CB 3.38Å; R107-E110 PolarHBondContact O-N 3.36Å; Q108-E110 VanDerWaalsContact C-N 3.33Å |
| 111 | L | 91.9 | Very high | 95.6 | Very high | 55 Ų | 55 | 70.7 Ų | 70.7 | 29% | 0.288 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -80 | -38.5 | -174.1 | -66.1 | 175.7 | 0 | 0 | 0 | 113.4 | R107 V167 K171 | R107-L111 WeakPolarHBondContact O-CB 3.46Å; R107-L111 WeakPolarHBondContact O-CG 3.25Å; R107-L111 PolarHBondContact O-N 2.86Å; L111-V167 HydrophobicContact CD1-CG1 4.38Å; L111-V167 HydrophobicContact CD2-CB 4.4Å; L111-V167 HydrophobicContact CD2-CG1 3.84Å; L111-V167 HydrophobicContact CD2-CG2 4Å; L111-K171 HydrophobicContact CD1-CG 4.29Å |
| 112 | N | 92.9 | Very high | 95.7 | Very high | 40 Ų | 40 | 70.7 Ų | 70.7 | 21% | 0.214 | 32% | 0.315 | C | S | . | . | trans | -135.9 | 62.7 | -171.6 | -62.7 | -61.5 | 0 | 0 | 0 | 110.6 | L51 Q108 R114 A115 | L51-N112 HydrophobicContact CD2-CB 3.93Å; Q108-N112 CarbonylContact O-C 3.58Å; Q108-N112 VanDerWaalsContact O-C 3.24Å; Q108-N112 VanDerWaalsContact O-CA 3.3Å; Q108-N112 WeakPolarHBondContact O-CA 3.38Å; Q108-N112 PolarHBondContact O-N 3.47Å; Q108-N112 PolarHBondContact OE1-ND2 2.88Å; N112-R114 PolarHBondContact O-N 3.47Å; N112-A115 HydrophobicContact CB-CB 3.91Å; N112-A115 VanDerWaalsContact O-CB 3.32Å; N112-A115 WeakPolarHBondContact O-CB 3.44Å; N112-A115 PolarHBondContact O-N 2.89Å | ||
| 113 | P | 93 | Very high | 95.8 | Very high | 78 Ų | 78 | 72 Ų | 72 | 51% | 0.506 | 32% | 0.32 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -60.4 | -22.8 | -173.6 | 22.7 | -34.3 | 0 | 0 | 0 | 114 | A109 Q116 | A109-P113 WeakPolarHBondContact O-CA 3.49Å; A109-P113 WeakPolarHBondContact O-CB 3.34Å; P113-Q116 PolarHBondContact O-NE2 3.43Å |
| 114 | R | 94.8 | Very high | 95.9 | Very high | 235 Ų | 235 | 73 Ų | 73 | 89% | 0.887 | 32% | 0.324 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -82.5 | -11.3 | 177.4 | -63.7 | -178.1 | -178.9 | 159.8 | 0.2 | 113.4 | N112 Q116 | N112-R114 PolarHBondContact O-N 3.47Å; R114-Q116 PolarHBondContact O-N 3.39Å |
| 115 | A | 95.3 | Very high | 96.1 | Very high | 15 Ų | 15 | 72.9 Ų | 72.9 | 12% | 0.124 | 32% | 0.324 | C | S | . | . | trans | -80.7 | 51.9 | -179 | 0 | 0 | 0 | 0 | 0 | 112.7 | L51 N112 R117 L118 L119 | L51-A115 HydrophobicContact CD1-CB 3.97Å; L51-A115 HydrophobicContact CD2-CB 3.36Å; L51-A115 HydrophobicContact CG-CB 4.31Å; N112-A115 HydrophobicContact CB-CB 3.91Å; N112-A115 VanDerWaalsContact O-CB 3.32Å; N112-A115 WeakPolarHBondContact O-CB 3.44Å; N112-A115 PolarHBondContact O-N 2.89Å; A115-R117 PolarHBondContact O-N 3.07Å; A115-R117 VanDerWaalsContact O-N 3.14Å; A115-L118 HydrophobicContact CB-CB 4.26Å; A115-L118 PolarHBondContact O-N 3.25Å; A115-L119 WeakPolarHBondContact O-CG 3.39Å; A115-L119 PolarHBondContact O-N 3.24Å; A115-L119 VanDerWaalsContact O-N 3.12Å | ||
| 116 | Q | 96.1 | Very high | 96.1 | Very high | 102 Ų | 102 | 69.6 Ų | 69.6 | 48% | 0.477 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -55.2 | -36 | -173.9 | -67.3 | -65.9 | -40.8 | 0 | 0 | 113.1 | P113 R114 L119 R120 | P113-Q116 PolarHBondContact O-NE2 3.43Å; R114-Q116 PolarHBondContact O-N 3.39Å; Q116-L119 PolarHBondContact O-N 3.26Å; Q116-R120 WeakPolarHBondContact O-CG 3.42Å; Q116-R120 PolarHBondContact O-N 2.98Å |
| 117 | R | 96.8 | Very high | 96.2 | Very high | 153 Ų | 153 | 68.3 Ų | 68.3 | 58% | 0.577 | 31% | 0.307 | S | S | * | . | H | α-helix | trans | -64 | -46.2 | 177 | -174.3 | -178.5 | 144.1 | 166.4 | -3.9 | 112.1 | E47 A115 R120 R121 | E47-R117 VanDerWaalsContact CD-NE 3.28Å; E47-R117 VanDerWaalsContact OE1-CD 3.3Å; E47-R117 WeakPolarHBondContact OE1-CD 3.31Å; E47-R117 VanDerWaalsContact OE1-CG 3.22Å; E47-R117 WeakPolarHBondContact OE1-CG 3.45Å; E47-R117 IonicContact OE1-CZ 2.71Å; E47-R117 IonicContact OE1-NE 3.75Å; E47-R117 PolarHBondContact OE1-NE 3.09Å; E47-R117 IonicContact OE2-CZ 3.57Å; E47-R117 IonicContact OE2-NE 3.7Å; E47-R117 PolarHBondContact OE2-NE 2.96Å; E47-R117 IonicContact OE2-NH2 3.56Å; E47-R117 PolarHBondContact OE2-NH2 3.34Å; A115-R117 PolarHBondContact O-N 3.07Å; A115-R117 VanDerWaalsContact O-N 3.14Å; R117-R120 PolarHBondContact O-N 3.22Å; R117-R121 VanDerWaalsContact NH2-NH2 3.17Å; R117-R121 WeakPolarHBondContact O-CG 3.01Å; R117-R121 PolarHBondContact O-N 2.91Å |
| 118 | L | 97.3 | Very high | 96.5 | Very high | 2 Ų | 2 | 66.5 Ų | 66.5 | 1% | 0.01 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -62.5 | -44.4 | 176.6 | 177.2 | 64.4 | 0 | 0 | 0 | 111.1 | L44 Y48 L51 Q108 A115 R120 R121 L122 | L44-L118 HydrophobicContact CD1-CD1 3.67Å; Y48-L118 HydrophobicContact CD2-CD1 4.3Å; Y48-L118 HydrophobicContact CD2-CD2 4.07Å; L51-L118 HydrophobicContact CD2-CB 4.39Å; L51-L118 HydrophobicContact CD2-CD2 3.33Å; L51-L118 HydrophobicContact CD2-CG 4.47Å; Q108-L118 HydrophobicContact CB-CD2 4.47Å; Q108-L118 HydrophobicContact CG-CD2 4.15Å; A115-L118 HydrophobicContact CB-CB 4.26Å; A115-L118 PolarHBondContact O-N 3.25Å; L118-R120 VanDerWaalsContact C-N 3.32Å; L118-R120 PolarHBondContact O-N 2.89Å; L118-R121 PolarHBondContact O-N 3.47Å; L118-L122 HydrophobicContact CD1-CD1 4.22Å; L118-L122 HydrophobicContact CD1-CG 4.24Å; L118-L122 HydrophobicContact CG-CD1 3.96Å; L118-L122 HydrophobicContact CG-CG 4.43Å; L118-L122 WeakPolarHBondContact O-CG 3.28Å; L118-L122 PolarHBondContact O-N 3.08Å |
| 119 | L | 97.8 | Very high | 96.6 | Very high | 19 Ų | 19 | 66.5 Ų | 66.5 | 10% | 0.099 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -59.8 | -43.4 | 179.8 | -60.7 | -179.8 | 0 | 0 | 0 | 111.8 | R105 Q108 A109 A115 Q116 L122 E123 | R105-L119 WeakPolarHBondContact CD-O 3.33Å; R105-L119 HydrophobicContact CG-CB 4.44Å; R105-L119 HydrophobicContact CG-CD2 4.19Å; R105-L119 WeakPolarHBondContact O-CD2 3.43Å; Q108-L119 HydrophobicContact CB-CD2 3.71Å; A109-L119 HydrophobicContact CB-CD1 4.03Å; A109-L119 HydrophobicContact CB-CD2 4.1Å; A115-L119 WeakPolarHBondContact O-CG 3.39Å; A115-L119 PolarHBondContact O-N 3.24Å; A115-L119 VanDerWaalsContact O-N 3.12Å; Q116-L119 PolarHBondContact O-N 3.26Å; L119-L122 PolarHBondContact O-N 3.04Å; L119-E123 PolarHBondContact O-N 3.16Å; L119-E123 VanDerWaalsContact O-N 3.16Å |
| 120 | R | 98.1 | Very high | 96.7 | Very high | 167 Ų | 167 | 70.9 Ų | 70.9 | 63% | 0.63 | 31% | 0.309 | S | S | * | . | H | α-helix | trans | -63.1 | -46.1 | 174.7 | -71.1 | 175.5 | -170.9 | -174 | 1.8 | 111.7 | Q116 R117 L118 L122 E123 D124 | Q116-R120 WeakPolarHBondContact O-CG 3.42Å; Q116-R120 PolarHBondContact O-N 2.98Å; R117-R120 PolarHBondContact O-N 3.22Å; L118-R120 VanDerWaalsContact C-N 3.32Å; L118-R120 PolarHBondContact O-N 2.89Å; R120-L122 VanDerWaalsContact C-N 3.33Å; R120-L122 PolarHBondContact O-N 3.29Å; R120-E123 WeakPolarHBondContact O-CB 3.49Å; R120-E123 PolarHBondContact O-N 3.18Å; R120-E123 VanDerWaalsContact O-N 3.12Å; R120-D124 PolarHBondContact O-N 2.81Å |
| 121 | R | 97.9 | Very high | 96.9 | Very high | 63 Ų | 63 | 67.6 Ų | 67.6 | 24% | 0.238 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -62 | -37.5 | 178.6 | -74.4 | -178.1 | 174.3 | -111.3 | 2.6 | 113.1 | L44 E47 R117 L118 E123 D124 A125 | L44-R121 HydrophobicContact CD1-CB 3.95Å; E47-R121 WeakPolarHBondContact OE2-CD 3.36Å; E47-R121 IonicContact OE2-CZ 3.69Å; E47-R121 IonicContact OE2-NE 3.65Å; E47-R121 PolarHBondContact OE2-NE 3.08Å; R117-R121 VanDerWaalsContact NH2-NH2 3.17Å; R117-R121 WeakPolarHBondContact O-CG 3.01Å; R117-R121 PolarHBondContact O-N 2.91Å; L118-R121 PolarHBondContact O-N 3.47Å; R121-E123 VanDerWaalsContact C-N 3.33Å; R121-D124 PolarHBondContact O-N 3.15Å; R121-A125 VanDerWaalsContact O-CB 3.29Å; R121-A125 WeakPolarHBondContact O-CB 3.31Å; R121-A125 PolarHBondContact O-N 3.14Å |
| 122 | L | 98.4 | Very high | 97.2 | Very high | 0 Ų | 0 | 65 Ų | 65 | 0% | 0 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -65.4 | -38.9 | 174.9 | -73.7 | 165.9 | 0 | 0 | 0 | 111.6 | L44 L101 V104 R105 Q108 L118 L119 R120 A126 | L44-L122 HydrophobicContact CD1-CD2 3.93Å; L44-L122 HydrophobicContact CD1-CG 4.06Å; L44-L122 HydrophobicContact CD2-CD2 4.2Å; L101-L122 HydrophobicContact CD2-CD2 4.15Å; V104-L122 HydrophobicContact CG1-CD1 4.08Å; V104-L122 HydrophobicContact CG1-CD2 4.05Å; R105-L122 HydrophobicContact CB-CB 3.94Å; R105-L122 HydrophobicContact CB-CD1 4.18Å; R105-L122 HydrophobicContact CG-CB 4.14Å; Q108-L122 HydrophobicContact CB-CD1 4.42Å; Q108-L122 HydrophobicContact CG-CD1 4.28Å; L118-L122 HydrophobicContact CD1-CD1 4.22Å; L118-L122 HydrophobicContact CD1-CG 4.24Å; L118-L122 HydrophobicContact CG-CD1 3.96Å; L118-L122 HydrophobicContact CG-CG 4.43Å; L118-L122 WeakPolarHBondContact O-CG 3.28Å; L118-L122 PolarHBondContact O-N 3.08Å; L119-L122 PolarHBondContact O-N 3.04Å; R120-L122 VanDerWaalsContact C-N 3.33Å; R120-L122 PolarHBondContact O-N 3.29Å; L122-A126 PolarHBondContact O-N 3.25Å; L122-A126 VanDerWaalsContact O-N 3.09Å |
| 123 | E | 98.4 | Very high | 97.4 | Very high | 66 Ų | 66 | 63.3 Ų | 63.3 | 31% | 0.308 | 28% | 0.282 | S | S | . | . | H | α-helix | trans | -68.4 | -43.2 | 175.9 | -157 | -177 | 127.4 | 0 | 0 | 112.2 | R105 L119 R120 R121 A125 A126 R127 | R105-E123 IonicContact CZ-OE2 3.61Å; R105-E123 IonicContact NH1-OE2 3.44Å; R105-E123 PolarHBondContact NH1-OE2 3.37Å; L119-E123 PolarHBondContact O-N 3.16Å; L119-E123 VanDerWaalsContact O-N 3.16Å; R120-E123 WeakPolarHBondContact O-CB 3.49Å; R120-E123 PolarHBondContact O-N 3.18Å; R120-E123 VanDerWaalsContact O-N 3.12Å; R121-E123 VanDerWaalsContact C-N 3.33Å; E123-A125 VanDerWaalsContact C-N 3.35Å; E123-A126 PolarHBondContact O-N 3.17Å; E123-R127 PolarHBondContact O-N 3.32Å; E123-R127 VanDerWaalsContact O-N 3.1Å; E123-R127 IonicContact OE1-CZ 2.73Å; E123-R127 IonicContact OE1-NH1 3.7Å; E123-R127 PolarHBondContact OE1-NH1 3.5Å; E123-R127 IonicContact OE1-NH2 3.49Å |
| 124 | D | 98.5 | Very high | 97.5 | Very high | 62 Ų | 62 | 62.3 Ų | 62.3 | 33% | 0.332 | 28% | 0.28 | S | S | . | . | H | α-helix | trans | -59.5 | -45.9 | 173.2 | -72.5 | -36.4 | 0 | 0 | 0 | 110.9 | R120 R121 A126 R127 Q128 | R120-D124 PolarHBondContact O-N 2.81Å; R121-D124 PolarHBondContact O-N 3.15Å; D124-A126 VanDerWaalsContact C-N 3.3Å; D124-A126 PolarHBondContact O-N 3.45Å; D124-R127 WeakPolarHBondContact O-CB 3.3Å; D124-R127 PolarHBondContact O-N 3.38Å; D124-R127 VanDerWaalsContact O-N 3.13Å; D124-R127 IonicContact OD1-CZ 3.73Å; D124-R127 IonicContact OD1-NE 2.96Å; D124-R127 IonicContact OD1-NH2 2.71Å; D124-R127 PolarHBondContact OD1-NH2 3.16Å; D124-Q128 WeakPolarHBondContact O-CB 3.37Å; D124-Q128 WeakPolarHBondContact O-CG 3.5Å; D124-Q128 PolarHBondContact O-N 3.43Å |
| 125 | A | 98.5 | Very high | 97.6 | Very high | 2 Ų | 2 | 52.2 Ų | 52.2 | 2% | 0.017 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -58.8 | -40.9 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | L44 L101 R121 E123 R127 Q128 A129 Y181 | L44-A125 HydrophobicContact CD2-CB 3.75Å; L101-A125 HydrophobicContact CD1-CB 3.95Å; L101-A125 HydrophobicContact CD2-CB 4.36Å; R121-A125 VanDerWaalsContact O-CB 3.29Å; R121-A125 WeakPolarHBondContact O-CB 3.31Å; R121-A125 PolarHBondContact O-N 3.14Å; E123-A125 VanDerWaalsContact C-N 3.35Å; A125-R127 VanDerWaalsContact C-N 3.35Å; A125-R127 PolarHBondContact O-N 2.94Å; A125-Q128 PolarHBondContact O-N 3.5Å; A125-A129 WeakPolarHBondContact O-CB 3.5Å; A125-A129 PolarHBondContact O-N 2.97Å; A125-Y181 HydrophobicContact CB-CD1 4.27Å; A125-Y181 HydrophobicContact CB-CE1 3.63Å; A125-Y181 HydrophobicContact CB-CE2 4.41Å |
| 126 | A | 98.2 | Very high | 97.7 | Very high | 3 Ų | 3 | 51.5 Ų | 51.5 | 3% | 0.025 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -64.2 | -39.4 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112 | P98 L101 L122 E123 D124 R130 | P98-A126 HydrophobicContact CB-CB 4.18Å; P98-A126 WeakPolarHBondContact CG-O 3.4Å; L101-A126 HydrophobicContact CB-CB 4.01Å; L101-A126 HydrophobicContact CD1-CB 4.29Å; L122-A126 PolarHBondContact O-N 3.25Å; L122-A126 VanDerWaalsContact O-N 3.09Å; E123-A126 PolarHBondContact O-N 3.17Å; D124-A126 VanDerWaalsContact C-N 3.3Å; D124-A126 PolarHBondContact O-N 3.45Å; A126-R130 PolarHBondContact O-N 3.04Å |
| 127 | R | 98.4 | Very high | 97.6 | Very high | 116 Ų | 116 | 50.6 Ų | 50.6 | 44% | 0.438 | 24% | 0.237 | S | C | . | . | H | α-helix | trans | -67.1 | -45.2 | 173.7 | -74 | -171.8 | -76.2 | -93.5 | 1.7 | 112.2 | E123 D124 A125 R130 A131 | E123-R127 PolarHBondContact O-N 3.32Å; E123-R127 VanDerWaalsContact O-N 3.1Å; E123-R127 IonicContact OE1-CZ 2.73Å; E123-R127 IonicContact OE1-NH1 3.7Å; E123-R127 PolarHBondContact OE1-NH1 3.5Å; E123-R127 IonicContact OE1-NH2 3.49Å; D124-R127 WeakPolarHBondContact O-CB 3.3Å; D124-R127 PolarHBondContact O-N 3.38Å; D124-R127 VanDerWaalsContact O-N 3.13Å; D124-R127 IonicContact OD1-CZ 3.73Å; D124-R127 IonicContact OD1-NE 2.96Å; D124-R127 IonicContact OD1-NH2 2.71Å; D124-R127 PolarHBondContact OD1-NH2 3.16Å; A125-R127 VanDerWaalsContact C-N 3.35Å; A125-R127 PolarHBondContact O-N 2.94Å; R127-R130 PolarHBondContact O-N 3.23Å; R127-A131 WeakPolarHBondContact O-CB 3.46Å; R127-A131 PolarHBondContact O-N 3.37Å |
| 128 | Q | 98.4 | Very high | 97.3 | Very high | 50 Ų | 50 | 45.3 Ų | 45.3 | 23% | 0.234 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -63.4 | -44.6 | -178.5 | -73.8 | 167.8 | -8.6 | 0 | 0 | 111.7 | L37 D124 A125 R130 A131 L132 Y181 | L37-Q128 HydrophobicContact CD1-CB 3.94Å; L37-Q128 HydrophobicContact CD2-CB 3.69Å; L37-Q128 VanDerWaalsContact CD2-CD 3.41Å; L37-Q128 HydrophobicContact CD2-CG 3.58Å; L37-Q128 HydrophobicContact CG-CB 4.44Å; D124-Q128 WeakPolarHBondContact O-CB 3.37Å; D124-Q128 WeakPolarHBondContact O-CG 3.5Å; D124-Q128 PolarHBondContact O-N 3.43Å; A125-Q128 PolarHBondContact O-N 3.5Å; Q128-R130 VanDerWaalsContact C-N 3.34Å; Q128-R130 PolarHBondContact O-N 2.98Å; Q128-A131 PolarHBondContact O-N 3.18Å; Q128-L132 PolarHBondContact O-N 3.24Å; Q128-Y181 PolarHBondContact OE1-OH 3.43Å |
| 129 | A | 98.1 | Very high | 97.1 | Very high | 0 Ų | 0 | 45.2 Ų | 45.2 | 0% | 0 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -57 | -47 | 174.6 | 0 | 0 | 0 | 0 | 0 | 111.5 | L97 P98 A125 L132 G133 Y181 | L97-A129 HydrophobicContact CB-CB 4.11Å; P98-A129 HydrophobicContact CG-CB 4.21Å; A125-A129 WeakPolarHBondContact O-CB 3.5Å; A125-A129 PolarHBondContact O-N 2.97Å; A129-L132 PolarHBondContact O-N 2.98Å; A129-G133 PolarHBondContact O-N 2.95Å; A129-Y181 HydrophobicContact CB-CD2 4.44Å; A129-Y181 HydrophobicContact CB-CE2 3.96Å |
| 130 | R | 98.1 | Very high | 96.7 | Very high | 135 Ų | 135 | 45.9 Ų | 45.9 | 51% | 0.509 | 23% | 0.229 | S | C | . | . | H | α-helix | trans | -62.3 | -44.8 | 177.5 | -172.6 | -178.8 | -67.2 | 104.6 | -3.3 | 112 | P98 A126 R127 Q128 G133 A134 | P98-R130 HydrophobicContact CG-CB 4.09Å; A126-R130 PolarHBondContact O-N 3.04Å; R127-R130 PolarHBondContact O-N 3.23Å; Q128-R130 VanDerWaalsContact C-N 3.34Å; Q128-R130 PolarHBondContact O-N 2.98Å; R130-G133 PolarHBondContact O-N 2.86Å; R130-A134 WeakPolarHBondContact O-CB 3.03Å; R130-A134 PolarHBondContact O-N 2.91Å |
| 131 | A | 97.8 | Very high | 96.3 | Very high | 57 Ų | 57 | 39.8 Ų | 39.8 | 47% | 0.471 | 21% | 0.214 | S | C | . | . | H | α-helix | trans | -64.3 | -44.6 | -179.9 | 0 | 0 | 0 | 0 | 0 | 112 | R127 Q128 A134 A135 | R127-A131 WeakPolarHBondContact O-CB 3.46Å; R127-A131 PolarHBondContact O-N 3.37Å; Q128-A131 PolarHBondContact O-N 3.18Å; A131-A134 PolarHBondContact O-N 3.15Å; A131-A135 PolarHBondContact O-N 3.21Å |
| 132 | L | 98.3 | Very high | 95.7 | Very high | 0 Ų | 0 | 38.6 Ų | 38.6 | 0% | 0 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -65.7 | -43.7 | 176.1 | -177.2 | 65.9 | 0 | 0 | 0 | 111.4 | T30 L33 A34 L37 L94 Q128 A129 A134 A135 V136 L185 T188 | T30-L132 HydrophobicContact CG2-CD1 3.86Å; L33-L132 HydrophobicContact CD2-CD1 4.08Å; L33-L132 HydrophobicContact CG-CD1 4.22Å; A34-L132 HydrophobicContact CB-CD1 4.06Å; A34-L132 HydrophobicContact CB-CD2 4.06Å; L37-L132 HydrophobicContact CD1-CB 3.98Å; L37-L132 HydrophobicContact CD1-CD2 4.19Å; L94-L132 HydrophobicContact CD1-CB 4.35Å; L94-L132 HydrophobicContact CD1-CD2 3.91Å; L94-L132 HydrophobicContact CD1-CG 3.88Å; L94-L132 HydrophobicContact CD2-CD2 4.17Å; Q128-L132 PolarHBondContact O-N 3.24Å; A129-L132 PolarHBondContact O-N 2.98Å; L132-A134 VanDerWaalsContact C-N 3.34Å; L132-A134 PolarHBondContact O-N 3.47Å; L132-A135 WeakPolarHBondContact O-CB 3.42Å; L132-A135 PolarHBondContact O-N 3.05Å; L132-A135 VanDerWaalsContact O-N 3.08Å; L132-V136 HydrophobicContact CD1-CG2 4.45Å; L132-V136 HydrophobicContact CG-CG2 4.43Å; L132-V136 WeakPolarHBondContact O-CG2 3.47Å; L132-V136 PolarHBondContact O-N 3.41Å; L132-L185 HydrophobicContact CD2-CD2 3.34Å; L132-T188 HydrophobicContact CD2-CG2 4.24Å |
| 133 | G | 96.9 | Very high | 95 | Very high | 4 Ų | 4 | 41 Ų | 41 | 4% | 0.041 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -56 | -47.9 | 176.3 | 0 | 0 | 0 | 0 | 0 | 111.9 | A129 R130 A135 V136 E137 | A129-G133 PolarHBondContact O-N 2.95Å; R130-G133 PolarHBondContact O-N 2.86Å; G133-A135 VanDerWaalsContact C-N 3.32Å; G133-A135 PolarHBondContact O-N 3.4Å; G133-V136 PolarHBondContact O-N 3.03Å; G133-E137 WeakPolarHBondContact O-CG 3.42Å; G133-E137 PolarHBondContact O-N 2.85Å |
| 134 | A | 96 | Very high | 94 | Very high | 57 Ų | 57 | 39.6 Ų | 39.6 | 47% | 0.471 | 23% | 0.234 | S | C | . | . | H | α-helix | trans | -61.5 | -38.2 | 175 | 0 | 0 | 0 | 0 | 0 | 112.7 | R130 A131 L132 E137 A138 | R130-A134 WeakPolarHBondContact O-CB 3.03Å; R130-A134 PolarHBondContact O-N 2.91Å; A131-A134 PolarHBondContact O-N 3.15Å; L132-A134 VanDerWaalsContact C-N 3.34Å; L132-A134 PolarHBondContact O-N 3.47Å; A134-E137 PolarHBondContact O-N 3.08Å; A134-A138 WeakPolarHBondContact O-CB 3.2Å; A134-A138 PolarHBondContact O-N 2.94Å |
| 135 | A | 96.6 | Very high | 92.1 | Very high | 23 Ų | 23 | 40.4 Ų | 40.4 | 19% | 0.19 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -64.7 | -41.7 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | K26 T30 A131 L132 G133 A138 L139 | K26-A135 PolarHBondContact NZ-O 2.8Å; T30-A135 HydrophobicContact CG2-CB 3.81Å; A131-A135 PolarHBondContact O-N 3.21Å; L132-A135 WeakPolarHBondContact O-CB 3.42Å; L132-A135 PolarHBondContact O-N 3.05Å; L132-A135 VanDerWaalsContact O-N 3.08Å; G133-A135 VanDerWaalsContact C-N 3.32Å; G133-A135 PolarHBondContact O-N 3.4Å; A135-A138 PolarHBondContact O-N 3.34Å; A135-L139 PolarHBondContact O-N 2.93Å |
| 136 | V | 96 | Very high | 90.2 | Very high | 0 Ų | 0 | 44.1 Ų | 44.1 | 0% | 0 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -66.1 | -44.2 | 175.3 | 174.9 | 0 | 0 | 0 | 0 | 111.2 | T30 L87 A91 L94 L132 G133 A138 L139 L140 T188 | T30-V136 HydrophobicContact CG2-CG2 4.21Å; L87-V136 HydrophobicContact CB-CG1 4.13Å; L87-V136 HydrophobicContact CD2-CG1 4.17Å; L87-V136 WeakPolarHBondContact O-CG1 3.39Å; A91-V136 HydrophobicContact CB-CG1 4.1Å; L94-V136 HydrophobicContact CD1-CG2 4.4Å; L132-V136 HydrophobicContact CD1-CG2 4.45Å; L132-V136 HydrophobicContact CG-CG2 4.43Å; L132-V136 WeakPolarHBondContact O-CG2 3.47Å; L132-V136 PolarHBondContact O-N 3.41Å; G133-V136 PolarHBondContact O-N 3.03Å; V136-A138 VanDerWaalsContact C-N 3.29Å; V136-A138 PolarHBondContact O-N 2.88Å; V136-L139 WeakPolarHBondContact O-CB 3.49Å; V136-L139 PolarHBondContact O-N 2.84Å; V136-L140 HydrophobicContact CG1-CD1 4.37Å; V136-L140 PolarHBondContact O-N 3.49Å; V136-T188 HydrophobicContact CG2-CG2 3.82Å |
| 137 | E | 94.1 | Very high | 88.1 | Confident | 83 Ų | 83 | 50.9 Ų | 50.9 | 39% | 0.388 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -60.2 | -40.6 | 174.3 | -74.5 | -171.2 | -178.2 | 0 | 0 | 112.3 | A91 G133 A134 L139 L140 A141 | A91-E137 HydrophobicContact CB-CG 3.79Å; G133-E137 WeakPolarHBondContact O-CG 3.42Å; G133-E137 PolarHBondContact O-N 2.85Å; A134-E137 PolarHBondContact O-N 3.08Å; E137-L139 VanDerWaalsContact C-N 3.29Å; E137-L139 PolarHBondContact O-N 3.14Å; E137-L140 WeakPolarHBondContact O-CB 3.21Å; E137-L140 PolarHBondContact O-N 3.45Å; E137-A141 WeakPolarHBondContact O-CB 3.3Å; E137-A141 PolarHBondContact O-N 3.07Å |
| 138 | A | 92.2 | Very high | 85.6 | Confident | 42 Ų | 42 | 56.3 Ų | 56.3 | 35% | 0.347 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -67.5 | -30.7 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112 | K26 A134 A135 V136 A142 | K26-A138 VanDerWaalsContact NZ-C 3.29Å; A134-A138 WeakPolarHBondContact O-CB 3.2Å; A134-A138 PolarHBondContact O-N 2.94Å; A135-A138 PolarHBondContact O-N 3.34Å; V136-A138 VanDerWaalsContact C-N 3.29Å; V136-A138 PolarHBondContact O-N 2.88Å; A138-A142 WeakPolarHBondContact O-CB 3.44Å; A138-A142 PolarHBondContact O-N 3.25Å; A138-A142 VanDerWaalsContact O-N 3.08Å |
| 139 | L | 92.3 | Very high | 83.2 | Confident | 0 Ų | 0 | 57.1 Ų | 57.1 | 0% | 0 | 36% | 0.358 | C | S | . | . | H | α-helix | trans | -68.5 | -46.5 | 170.9 | -78.7 | 176.3 | 0 | 0 | 0 | 111.4 | L23 K26 I27 T30 A135 V136 E137 A141 A142 L143 L192 | L23-L139 HydrophobicContact CD1-CD2 4.02Å; K26-L139 HydrophobicContact CB-CD2 3.97Å; K26-L139 HydrophobicContact CD-CD2 3.99Å; K26-L139 HydrophobicContact CG-CD2 3.69Å; K26-L139 HydrophobicContact CG-CG 4.42Å; I27-L139 HydrophobicContact CG1-CD1 4.41Å; I27-L139 HydrophobicContact CG1-CD2 3.7Å; T30-L139 HydrophobicContact CG2-CD1 3.83Å; A135-L139 PolarHBondContact O-N 2.93Å; V136-L139 WeakPolarHBondContact O-CB 3.49Å; V136-L139 PolarHBondContact O-N 2.84Å; E137-L139 VanDerWaalsContact C-N 3.29Å; E137-L139 PolarHBondContact O-N 3.14Å; L139-A141 VanDerWaalsContact C-N 3.27Å; L139-A141 PolarHBondContact O-N 3.36Å; L139-A142 PolarHBondContact O-N 2.98Å; L139-A142 VanDerWaalsContact O-N 3.14Å; L139-L143 WeakPolarHBondContact O-CB 3.47Å; L139-L143 VanDerWaalsContact O-CG 3.3Å; L139-L143 WeakPolarHBondContact O-CG 3.48Å; L139-L143 PolarHBondContact O-N 3.37Å; L139-L192 HydrophobicContact CD1-CD2 3.61Å |
| 140 | L | 90.1 | Very high | 80.6 | Confident | 34 Ų | 34 | 64 Ų | 64 | 18% | 0.178 | 40% | 0.402 | C | S | . | . | H | α-helix | trans | -57.2 | -41.8 | 174.5 | -78 | 166.7 | 0 | 0 | 0 | 111.8 | L87 R88 A91 V136 E137 L143 G144 | L87-L140 HydrophobicContact CB-CD1 4.27Å; L87-L140 HydrophobicContact CB-CD2 3.84Å; L87-L140 HydrophobicContact CB-CG 4.1Å; R88-L140 HydrophobicContact CB-CD1 4.37Å; R88-L140 HydrophobicContact CG-CD1 3.69Å; R88-L140 HydrophobicContact CG-CD2 3.98Å; R88-L140 HydrophobicContact CG-CG 4.48Å; A91-L140 HydrophobicContact CB-CD1 4.45Å; V136-L140 HydrophobicContact CG1-CD1 4.37Å; V136-L140 PolarHBondContact O-N 3.49Å; E137-L140 WeakPolarHBondContact O-CB 3.21Å; E137-L140 PolarHBondContact O-N 3.45Å; L140-L143 PolarHBondContact O-N 2.88Å; L140-G144 PolarHBondContact O-N 2.71Å |
| 141 | A | 88.4 | Confident | 78.2 | Confident | 38 Ų | 38 | 65.6 Ų | 65.6 | 31% | 0.314 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -63.9 | -42.8 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | E137 L139 G144 A145 | E137-A141 WeakPolarHBondContact O-CB 3.3Å; E137-A141 PolarHBondContact O-N 3.07Å; L139-A141 VanDerWaalsContact C-N 3.27Å; L139-A141 PolarHBondContact O-N 3.36Å; A141-G144 PolarHBondContact O-N 2.95Å; A141-A145 WeakPolarHBondContact O-CB 3.43Å; A141-A145 PolarHBondContact O-N 2.69Å |
| 142 | A | 86.3 | Confident | 75.6 | Confident | 38 Ų | 38 | 67.1 Ų | 67.1 | 31% | 0.314 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -66.7 | -42 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | L23 A138 L139 A146 | L23-A142 HydrophobicContact CD1-CB 3.87Å; A138-A142 WeakPolarHBondContact O-CB 3.44Å; A138-A142 PolarHBondContact O-N 3.25Å; A138-A142 VanDerWaalsContact O-N 3.08Å; L139-A142 PolarHBondContact O-N 2.98Å; L139-A142 VanDerWaalsContact O-N 3.14Å; A142-A146 WeakPolarHBondContact O-CB 3.38Å; A142-A146 PolarHBondContact O-N 2.97Å |
| 143 | L | 83.2 | Confident | 72.6 | Confident | 51 Ų | 51 | 76.2 Ų | 76.2 | 27% | 0.267 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -64.7 | -38.1 | 174.5 | -69.9 | 167.6 | 0 | 0 | 0 | 112 | L23 L139 L140 L195 | L23-L143 HydrophobicContact CD2-CD2 3.88Å; L139-L143 WeakPolarHBondContact O-CB 3.47Å; L139-L143 VanDerWaalsContact O-CG 3.3Å; L139-L143 WeakPolarHBondContact O-CG 3.48Å; L139-L143 PolarHBondContact O-N 3.37Å; L140-L143 PolarHBondContact O-N 2.88Å; L143-L195 HydrophobicContact CD1-CD1 4.23Å |
| 144 | G | 77.6 | Confident | 70.1 | Confident | 36 Ų | 36 | 80.3 Ų | 80.3 | 37% | 0.371 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -73.4 | -40.6 | 176.6 | 0 | 0 | 0 | 0 | 0 | 113.3 | L140 A141 A146 N147 R148 | L140-G144 PolarHBondContact O-N 2.71Å; A141-G144 PolarHBondContact O-N 2.95Å; G144-A146 PolarHBondContact O-N 3.15Å; G144-N147 CarbonylContact O-C 3.24Å; G144-N147 WeakPolarHBondContact O-CA 3.46Å; G144-N147 PolarHBondContact O-N 3.16Å; G144-R148 PolarHBondContact O-N 2.86Å |
| 145 | A | 59.2 | Low | 67.4 | Low | 80 Ų | 80 | 83.5 Ų | 83.5 | 66% | 0.661 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -63.1 | -31.3 | 174.1 | 0 | 0 | 0 | 0 | 0 | 112 | A141 N147 | A141-A145 WeakPolarHBondContact O-CB 3.43Å; A141-A145 PolarHBondContact O-N 2.69Å; A145-N147 PolarHBondContact O-N 3.35Å |
| 146 | A | 57.2 | Low | 64.6 | Low | 79 Ų | 79 | 89 Ų | 89 | 65% | 0.653 | 54% | 0.537 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -67.6 | -16 | 169.3 | 0 | 0 | 0 | 0 | 0 | 113.5 | A142 G144 | A142-A146 WeakPolarHBondContact O-CB 3.38Å; A142-A146 PolarHBondContact O-N 2.97Å; G144-A146 PolarHBondContact O-N 3.15Å |
| 147 | N | 55.6 | Low | 62.3 | Low | 145 Ų | 145 | 93.7 Ų | 93.7 | 78% | 0.775 | 58% | 0.576 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -113 | -24.5 | -174 | -113.1 | 1.7 | 0 | 0 | 0 | 116.1 | G144 A145 | G144-N147 CarbonylContact O-C 3.24Å; G144-N147 WeakPolarHBondContact O-CA 3.46Å; G144-N147 PolarHBondContact O-N 3.16Å; A145-N147 PolarHBondContact O-N 3.35Å |
| 148 | R | 46.3 | Very low | 60 | Low | 230 Ų | 230 | 96.1 Ų | 96.1 | 87% | 0.868 | 60% | 0.597 | S | S | * | * | trans | 164.5 | 162.9 | 158 | -102.2 | 178.1 | -173.5 | 148.1 | 2.9 | 112.4 | G144 | G144-R148 PolarHBondContact O-N 2.86Š| ||
| 149 | G | 46.2 | Very low | 57.8 | Low | 68 Ų | 68 | 95.3 Ų | 95.3 | 70% | 0.701 | 59% | 0.59 | S | S | * | * | trans | -63.3 | -158.6 | -172.7 | 0 | 0 | 0 | 0 | 0 | 119.6 | ||||
| 150 | P | 44.9 | Very low | 55.7 | Low | 143 Ų | 143 | 99.7 Ų | 99.7 | 93% | 0.929 | 62% | 0.62 | S | S | * | * | P | Polyproline II helix | -74.4 | 151.4 | -115.9 | 29.5 | -35.1 | 0 | 0 | 0 | 116.4 | |||
| 151 | R | 46.9 | Very low | 53.8 | Low | 169 Ų | 169 | 99.3 Ų | 99.3 | 64% | 0.638 | 62% | 0.622 | S | S | * | * | P | Polyproline II helix | trans | -85.1 | 139.1 | -157 | 177.5 | 173.5 | -179.7 | 167.1 | -1.5 | 113.9 | ||
| 152 | A | 42.5 | Very low | 51.9 | Low | 90 Ų | 90 | 101 Ų | 101 | 74% | 0.744 | 64% | 0.636 | S | S | * | * | P | Polyproline II helix | trans | -82.8 | 141.2 | 163.9 | 0 | 0 | 0 | 0 | 0 | 111.2 | ||
| 153 | E | 36 | Very low | 50.3 | Low | 191 Ų | 191 | 104 Ų | 104 | 89% | 0.893 | 66% | 0.655 | S | S | * | * | P | Polyproline II helix | trans | -69.9 | 142.3 | 178.5 | -75.1 | -144 | 133.7 | 0 | 0 | 112.9 | ||
| 154 | P | 44.3 | Very low | 49.3 | Very low | 89 Ų | 89 | 102.6 Ų | 102.6 | 58% | 0.578 | 65% | 0.651 | S | S | * | * | P | Polyproline II helix | trans | -88.8 | 152.6 | 174.9 | 34.4 | -30.5 | 0 | 0 | 0 | 112.4 | ||
| 155 | P | 39.2 | Very low | 48.8 | Very low | 125 Ų | 125 | 104.9 Ų | 104.9 | 81% | 0.812 | 67% | 0.666 | S | S | * | * | P | Polyproline II helix | trans | -79.8 | 145.3 | 178.8 | 32.4 | -32.8 | 0 | 0 | 0 | 112.1 | A157 | P155-A157 PolarHBondContact O-N 2.92Š|
| 156 | T | 38.5 | Very low | 49.9 | Very low | 139 Ų | 139 | 103.5 Ų | 103.5 | 85% | 0.853 | 66% | 0.66 | S | S | * | * | trans | -77.8 | 106.8 | 175.5 | -24.1 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 157 | A | 47.5 | Very low | 51.4 | Low | 98 Ų | 98 | 103.8 Ų | 103.8 | 81% | 0.81 | 65% | 0.653 | S | S | * | * | trans | -92 | 113.1 | 169.9 | 0 | 0 | 0 | 0 | 0 | 110 | P155 A159 | P155-A157 PolarHBondContact O-N 2.92Å; A157-A159 PolarHBondContact O-N 3.46Å | ||
| 158 | T | 44.5 | Very low | 53.1 | Low | 134 Ų | 134 | 101.1 Ų | 101.1 | 82% | 0.822 | 63% | 0.634 | S | S | * | * | trans | -81.8 | 108 | 169.4 | 38.8 | 0 | 0 | 0 | 0 | 110 | S160 | T158-S160 PolarHBondContact O-N 3.38Š| ||
| 159 | A | 47.4 | Very low | 55.2 | Low | 25 Ų | 25 | 92.3 Ų | 92.3 | 21% | 0.207 | 61% | 0.607 | C | S | . | * | trans | -73.7 | 118.9 | 167.3 | 0 | 0 | 0 | 0 | 0 | 109.5 | P99 A157 | P99-A159 HydrophobicContact CG-CB 4.28Å; A157-A159 PolarHBondContact O-N 3.46Å | ||
| 160 | S | 47.9 | Very low | 57.3 | Low | 91 Ų | 91 | 89.5 Ų | 89.5 | 64% | 0.636 | 58% | 0.578 | S | S | * | * | trans | -113.9 | 113.9 | 173.7 | 173 | 0 | 0 | 0 | 0 | 109 | A69 T158 A162 | A69-S160 WeakPolarHBondContact CB-O 3.4Å; T158-S160 PolarHBondContact O-N 3.38Å; S160-A162 PolarHBondContact O-N 3.25Å | ||
| 161 | A | 49.3 | Very low | 59.7 | Low | 26 Ų | 26 | 84.8 Ų | 84.8 | 22% | 0.215 | 54% | 0.542 | C | S | . | . | trans | -67.3 | 125.8 | 172.5 | 0 | 0 | 0 | 0 | 0 | 109.8 | L100 V103 S163 | L100-A161 HydrophobicContact CD2-CB 4.08Å; V103-A161 HydrophobicContact CG1-CB 4.22Å; V103-A161 HydrophobicContact CG2-CB 4.24Å; A161-S163 PolarHBondContact O-N 2.99Å | ||
| 162 | A | 49.8 | Very low | 61.9 | Low | 75 Ų | 75 | 76.8 Ų | 76.8 | 62% | 0.62 | 51% | 0.513 | S | S | * | . | trans | -58.7 | 137 | 168.2 | 0 | 0 | 0 | 0 | 0 | 109.5 | S160 A164 | S160-A162 PolarHBondContact O-N 3.25Å; A162-A164 PolarHBondContact O-N 3.35Å | ||
| 163 | S | 52.8 | Low | 64.4 | Low | 100 Ų | 100 | 73.3 Ų | 73.3 | 70% | 0.699 | 48% | 0.481 | S | S | * | . | trans | -59.8 | 107.8 | 177.5 | 172.2 | 0 | 0 | 0 | 0 | 110.2 | A161 A165 | A161-S163 PolarHBondContact O-N 2.99Å; S163-A165 PolarHBondContact O-N 3.37Å; S163-A165 VanDerWaalsContact O-N 3.15Å | ||
| 164 | A | 60.8 | Low | 67.2 | Low | 22 Ų | 22 | 64.2 Ų | 64.2 | 18% | 0.182 | 44% | 0.439 | C | S | . | . | trans | -70.2 | 105.1 | 166.1 | 0 | 0 | 0 | 0 | 0 | 108.2 | A162 G166 P169 A170 L173 | A162-A164 PolarHBondContact O-N 3.35Å; A164-G166 PolarHBondContact O-N 2.89Å; A164-P169 HydrophobicContact CB-CB 4.12Å; A164-A170 HydrophobicContact CB-CB 4.4Å; A164-L173 HydrophobicContact CB-CD2 4.16Å | ||
| 165 | A | 67.9 | Low | 69.6 | Low | 84 Ų | 84 | 61.2 Ų | 61.2 | 69% | 0.694 | 42% | 0.418 | S | S | * | . | trans | -75.9 | 121.3 | 173.8 | 0 | 0 | 0 | 0 | 0 | 109.7 | S163 P169 | S163-A165 PolarHBondContact O-N 3.37Å; S163-A165 VanDerWaalsContact O-N 3.15Å; A165-P169 WeakPolarHBondContact O-CG 3.5Å | ||
| 166 | G | 82.1 | Confident | 72.3 | Confident | 51 Ų | 51 | 59 Ų | 59 | 53% | 0.526 | 39% | 0.393 | S | S | . | . | S | Bend | trans | 96.9 | 158.2 | 176.7 | 0 | 0 | 0 | 0 | 0 | 115.1 | A164 A170 | A164-G166 PolarHBondContact O-N 2.89Å; G166-A170 WeakPolarHBondContact O-CB 3.39Å; G166-A170 PolarHBondContact O-N 3.38Å |
| 167 | V | 89.9 | Confident | 75.1 | Confident | 84 Ų | 84 | 52.5 Ų | 52.5 | 51% | 0.509 | 35% | 0.353 | S | S | . | . | H | α-helix | trans | -64.4 | -49 | -172.7 | 177.9 | 0 | 0 | 0 | 0 | 112 | L111 A170 K171 | L111-V167 HydrophobicContact CD1-CG1 4.38Å; L111-V167 HydrophobicContact CD2-CB 4.4Å; L111-V167 HydrophobicContact CD2-CG1 3.84Å; L111-V167 HydrophobicContact CD2-CG2 4Å; V167-A170 PolarHBondContact O-N 3.08Å; V167-K171 HydrophobicContact CG1-CD 4.43Å; V167-K171 HydrophobicContact CG1-CG 4.48Å; V167-K171 WeakPolarHBondContact O-CG 3.21Å; V167-K171 PolarHBondContact O-N 3.4Å |
| 168 | F | 90.9 | Very high | 77.4 | Confident | 89 Ų | 89 | 47.8 Ų | 47.8 | 39% | 0.39 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -64.8 | -49.1 | -176.5 | 177.1 | -95.7 | 0 | 0 | 0 | 112.8 | P55 F56 F61 P64 A170 K171 V172 | P55-F168 HydrophobicContact CG-CE2 4.31Å; F56-F168 HydrophobicContact CE2-CD2 4.1Å; F56-F168 HydrophobicContact CE2-CE2 4.03Å; F56-F168 AromaticContact CZ-CD2 3.92Å; F56-F168 HydrophobicContact CZ-CD2 3.92Å; F56-F168 AromaticContact CZ-CE2 3.77Å; F56-F168 HydrophobicContact CZ-CE2 3.77Å; F61-F168 HydrophobicContact CE2-CZ 4.34Å; F61-F168 HydrophobicContact CZ-CE2 4.07Å; F61-F168 AromaticContact CZ-CZ 3.93Å; F61-F168 HydrophobicContact CZ-CZ 3.93Å; P64-F168 HydrophobicContact CG-CE1 4.23Å; F168-A170 VanDerWaalsContact C-N 3.28Å; F168-A170 PolarHBondContact O-N 2.9Å; F168-K171 WeakPolarHBondContact O-CB 3.36Å; F168-K171 PolarHBondContact O-N 3.44Å; F168-K171 VanDerWaalsContact O-N 3.1Å; F168-V172 HydrophobicContact CD1-CG2 4.17Å; F168-V172 HydrophobicContact CE1-CG2 3.78Å; F168-V172 HydrophobicContact CE2-CG2 4.21Å; F168-V172 HydrophobicContact CZ-CG2 3.81Å; F168-V172 WeakPolarHBondContact O-CG2 3.49Å; F168-V172 PolarHBondContact O-N 3.23Å |
| 169 | P | 90.1 | Very high | 79.9 | Confident | 45 Ų | 45 | 41.8 Ų | 41.8 | 29% | 0.292 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -58.1 | -36.3 | 172.9 | -28.6 | 38.4 | 0 | 0 | 0 | 113.7 | A164 A165 V172 L173 | A164-P169 HydrophobicContact CB-CB 4.12Å; A165-P169 WeakPolarHBondContact O-CG 3.5Å; P169-V172 PolarHBondContact O-N 3.18Å; P169-L173 WeakPolarHBondContact O-CB 3.36Å; P169-L173 PolarHBondContact O-N 3.15Å |
| 170 | A | 90.8 | Very high | 82.2 | Confident | 10 Ų | 10 | 40.6 Ų | 40.6 | 8% | 0.083 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -65 | -40.1 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | A164 G166 V167 F168 L173 G174 | A164-A170 HydrophobicContact CB-CB 4.4Å; G166-A170 WeakPolarHBondContact O-CB 3.39Å; G166-A170 PolarHBondContact O-N 3.38Å; V167-A170 PolarHBondContact O-N 3.08Å; F168-A170 VanDerWaalsContact C-N 3.28Å; F168-A170 PolarHBondContact O-N 2.9Å; A170-L173 PolarHBondContact O-N 3.48Å; A170-G174 PolarHBondContact O-N 2.87Å; A170-G174 VanDerWaalsContact O-N 3.07Å |
| 171 | K | 94.4 | Very high | 84.6 | Confident | 43 Ų | 43 | 36.3 Ų | 36.3 | 19% | 0.187 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -64.2 | -43.8 | 174 | -69.3 | -171.3 | 170.6 | -170.9 | 0 | 112 | Y48 Q52 F56 L111 V167 F168 G174 L175 | Y48-K171 WeakPolarHBondContact CE1-O 3.26Å; Y48-K171 WeakPolarHBondContact OH-CA 3.28Å; Y48-K171 PolarHBondContact OH-O 2.75Å; Q52-K171 HydrophobicContact CB-CD 4.34Å; Q52-K171 HydrophobicContact CG-CB 4.45Å; Q52-K171 HydrophobicContact CG-CD 4.34Å; Q52-K171 HydrophobicContact CG-CG 4.48Å; Q52-K171 PolarHBondContact O-NZ 3.14Å; Q52-K171 VanDerWaalsContact O-NZ 3.15Å; Q52-K171 VanDerWaalsContact OE1-CD 3.23Å; F56-K171 HydrophobicContact CE1-CB 4.06Å; F56-K171 HydrophobicContact CE2-CB 3.98Å; F56-K171 HydrophobicContact CE2-CD 3.87Å; F56-K171 HydrophobicContact CZ-CB 3.46Å; F56-K171 VanDerWaalsContact CZ-CB 3.46Å; F56-K171 HydrophobicContact CZ-CD 4.24Å; L111-K171 HydrophobicContact CD1-CG 4.29Å; V167-K171 HydrophobicContact CG1-CD 4.43Å; V167-K171 HydrophobicContact CG1-CG 4.48Å; V167-K171 WeakPolarHBondContact O-CG 3.21Å; V167-K171 PolarHBondContact O-N 3.4Å; F168-K171 WeakPolarHBondContact O-CB 3.36Å; F168-K171 PolarHBondContact O-N 3.44Å; F168-K171 VanDerWaalsContact O-N 3.1Å; K171-G174 PolarHBondContact O-N 3.36Å; K171-L175 PolarHBondContact O-N 2.73Å |
| 172 | V | 94.4 | Very high | 87 | Confident | 2 Ų | 2 | 39.1 Ų | 39.1 | 1% | 0.012 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -64 | -40.3 | 176.4 | 176.5 | 0 | 0 | 0 | 0 | 111.3 | F56 P63 P64 L66 F168 P169 G174 L175 R176 | F56-V172 HydrophobicContact CE1-CG2 3.87Å; F56-V172 HydrophobicContact CZ-CG2 3.94Å; P63-V172 HydrophobicContact CB-CG1 4.34Å; P64-V172 VanDerWaalsContact O-CG1 3.31Å; P64-V172 WeakPolarHBondContact O-CG1 3.49Å; L66-V172 HydrophobicContact CD1-CB 3.76Å; L66-V172 HydrophobicContact CD1-CG1 3.53Å; L66-V172 HydrophobicContact CG-CG1 3.78Å; F168-V172 HydrophobicContact CD1-CG2 4.17Å; F168-V172 HydrophobicContact CE1-CG2 3.78Å; F168-V172 HydrophobicContact CE2-CG2 4.21Å; F168-V172 HydrophobicContact CZ-CG2 3.81Å; F168-V172 WeakPolarHBondContact O-CG2 3.49Å; F168-V172 PolarHBondContact O-N 3.23Å; P169-V172 PolarHBondContact O-N 3.18Å; V172-G174 PolarHBondContact O-N 3.1Å; V172-L175 WeakPolarHBondContact O-CB 3.36Å; V172-L175 PolarHBondContact O-N 2.9Å; V172-R176 WeakPolarHBondContact O-CB 3.49Å; V172-R176 PolarHBondContact O-N 3.04Å |
| 173 | L | 93.1 | Very high | 89.2 | Confident | 17 Ų | 17 | 38.5 Ų | 38.5 | 9% | 0.089 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -58.9 | -48.3 | 174.6 | 176.2 | 64.8 | 0 | 0 | 0 | 111.1 | V68 A164 P169 A170 L175 R176 V177 | V68-L173 HydrophobicContact CG2-CD1 4.04Å; A164-L173 HydrophobicContact CB-CD2 4.16Å; P169-L173 WeakPolarHBondContact O-CB 3.36Å; P169-L173 PolarHBondContact O-N 3.15Å; A170-L173 PolarHBondContact O-N 3.48Å; L173-L175 VanDerWaalsContact C-N 3.33Å; L173-L175 PolarHBondContact O-N 3.48Å; L173-R176 PolarHBondContact O-N 3.21Å; L173-R176 VanDerWaalsContact O-N 3.15Å; L173-V177 HydrophobicContact CD1-CG2 4.14Å; L173-V177 HydrophobicContact CG-CG2 4.46Å; L173-V177 WeakPolarHBondContact O-CG2 3.43Å; L173-V177 PolarHBondContact O-N 3.25Å |
| 174 | G | 95.3 | Very high | 91.4 | Very high | 0 Ų | 0 | 34.7 Ų | 34.7 | 0% | 0 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -64.6 | -36.8 | 178.9 | 0 | 0 | 0 | 0 | 0 | 113.2 | Y48 A170 K171 V172 R176 V177 C178 | Y48-G174 VanDerWaalsContact CZ-C 3.46Å; Y48-G174 WeakPolarHBondContact OH-CA 3.48Å; A170-G174 PolarHBondContact O-N 2.87Å; A170-G174 VanDerWaalsContact O-N 3.07Å; K171-G174 PolarHBondContact O-N 3.36Å; V172-G174 PolarHBondContact O-N 3.1Å; G174-R176 VanDerWaalsContact C-N 3.32Å; G174-R176 PolarHBondContact O-N 3.45Å; G174-V177 PolarHBondContact O-N 2.92Å; G174-C178 WeakPolarHBondContact O-CB 3.35Å; G174-C178 PolarHBondContact O-N 3.16Å; G174-C178 PolarHBondContact O-SG 3.49Å |
| 175 | L | 95.6 | Very high | 93.1 | Very high | 26 Ų | 26 | 33.6 Ų | 33.6 | 14% | 0.136 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -59.3 | -46.6 | 171.6 | -179.3 | 70.9 | 0 | 0 | 0 | 110.9 | L45 Y48 V49 F56 P63 K171 V172 L173 C178 G179 | L45-L175 HydrophobicContact CD1-CD1 3.72Å; Y48-L175 HydrophobicContact CD1-CB 4.34Å; Y48-L175 HydrophobicContact CD1-CD1 4.32Å; Y48-L175 HydrophobicContact CE1-CB 3.9Å; V49-L175 HydrophobicContact CG2-CD1 3.4Å; V49-L175 VanDerWaalsContact CG2-CD1 3.4Å; F56-L175 HydrophobicContact CD1-CD2 4.12Å; F56-L175 HydrophobicContact CE1-CD2 4.5Å; P63-L175 HydrophobicContact CB-CD2 3.82Å; P63-L175 HydrophobicContact CG-CD2 3.58Å; K171-L175 PolarHBondContact O-N 2.73Å; V172-L175 WeakPolarHBondContact O-CB 3.36Å; V172-L175 PolarHBondContact O-N 2.9Å; L173-L175 VanDerWaalsContact C-N 3.33Å; L173-L175 PolarHBondContact O-N 3.48Å; L175-C178 PolarHBondContact O-N 3.38Å; L175-G179 PolarHBondContact O-N 3.04Å |
| 176 | R | 95.3 | Very high | 94.5 | Very high | 78 Ų | 78 | 32.1 Ų | 32.1 | 29% | 0.294 | 17% | 0.174 | S | C | . | . | H | α-helix | trans | -63.8 | -44 | -179.1 | -177.2 | 58.9 | 175.9 | 165.4 | 5.2 | 111.9 | V68 V172 L173 G174 G179 L180 | V68-R176 HydrophobicContact CG2-CB 4.31Å; V68-R176 HydrophobicContact CG2-CG 3.55Å; V172-R176 WeakPolarHBondContact O-CB 3.49Å; V172-R176 PolarHBondContact O-N 3.04Å; L173-R176 PolarHBondContact O-N 3.21Å; L173-R176 VanDerWaalsContact O-N 3.15Å; G174-R176 VanDerWaalsContact C-N 3.32Å; G174-R176 PolarHBondContact O-N 3.45Å; R176-G179 PolarHBondContact O-N 3.43Å; R176-L180 HydrophobicContact CG-CD1 4.25Å; R176-L180 WeakPolarHBondContact O-CG 3.33Å; R176-L180 PolarHBondContact O-N 3.37Å |
| 177 | V | 96.6 | Very high | 95.2 | Very high | 2 Ų | 2 | 33.7 Ų | 33.7 | 1% | 0.012 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -65.6 | -44.5 | 178.3 | 171.1 | 0 | 0 | 0 | 0 | 111.3 | V68 L100 L101 V104 L173 G174 G179 L180 Y181 | V68-V177 HydrophobicContact CG1-CG2 4.28Å; V68-V177 HydrophobicContact CG2-CG2 4.29Å; L100-V177 HydrophobicContact CB-CG1 3.88Å; L100-V177 HydrophobicContact CB-CG2 4.22Å; L101-V177 HydrophobicContact CD2-CG1 3.94Å; L101-V177 HydrophobicContact CG-CG1 4.18Å; V104-V177 HydrophobicContact CG2-CB 3.83Å; V104-V177 HydrophobicContact CG2-CG1 3.96Å; V104-V177 HydrophobicContact CG2-CG2 4.02Å; L173-V177 HydrophobicContact CD1-CG2 4.14Å; L173-V177 HydrophobicContact CG-CG2 4.46Å; L173-V177 WeakPolarHBondContact O-CG2 3.43Å; L173-V177 PolarHBondContact O-N 3.25Å; G174-V177 PolarHBondContact O-N 2.92Å; V177-G179 VanDerWaalsContact C-N 3.28Å; V177-G179 PolarHBondContact O-N 3.42Å; V177-L180 PolarHBondContact O-N 3.34Å; V177-Y181 WeakPolarHBondContact O-CB 3.43Å; V177-Y181 PolarHBondContact O-N 3.2Å |
| 178 | C | 97.3 | Very high | 95.6 | Very high | 0 Ų | 0 | 29.7 Ų | 29.7 | 0% | 0 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -61.3 | -37.9 | 174.5 | -69.5 | 0 | 0 | 0 | 0 | 111.9 | L45 G174 L175 R182 | L45-C178 HydrophobicContact CB-CB 4.46Å; L45-C178 HydrophobicContact CD1-CB 3.68Å; G174-C178 WeakPolarHBondContact O-CB 3.35Å; G174-C178 PolarHBondContact O-N 3.16Å; G174-C178 PolarHBondContact O-SG 3.49Å; L175-C178 PolarHBondContact O-N 3.38Å; C178-R182 PolarHBondContact O-N 2.93Å |
| 179 | G | 96.4 | Very high | 95.9 | Very high | 8 Ų | 8 | 27.2 Ų | 27.2 | 8% | 0.082 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -63.6 | -48.5 | 173.9 | 0 | 0 | 0 | 0 | 0 | 112.7 | L175 R176 V177 Y181 R182 E183 | L175-G179 PolarHBondContact O-N 3.04Å; R176-G179 PolarHBondContact O-N 3.43Å; V177-G179 VanDerWaalsContact C-N 3.28Å; V177-G179 PolarHBondContact O-N 3.42Å; G179-Y181 VanDerWaalsContact C-N 3.34Å; G179-Y181 PolarHBondContact O-N 3.46Å; G179-R182 PolarHBondContact O-N 3.42Å; G179-E183 WeakPolarHBondContact O-CG 2.98Å; G179-E183 PolarHBondContact O-N 3.42Å |
| 180 | L | 96.8 | Very high | 96.1 | Very high | 0 Ų | 0 | 26.9 Ų | 26.9 | 0% | 0 | 14% | 0.135 | C | C | . | . | H | α-helix | trans | -61.4 | -40.9 | 176.8 | -73.4 | 171.6 | 0 | 0 | 0 | 112 | V68 L71 A73 R176 V177 R182 E183 W184 | V68-L180 HydrophobicContact CB-CD1 3.95Å; V68-L180 HydrophobicContact CG1-CD1 4.36Å; V68-L180 HydrophobicContact CG2-CD1 3.83Å; L71-L180 HydrophobicContact CD2-CB 4.16Å; L71-L180 HydrophobicContact CD2-CD1 4.18Å; L71-L180 HydrophobicContact CG-CD1 4.29Å; A73-L180 HydrophobicContact CB-CD2 3.88Å; R176-L180 HydrophobicContact CG-CD1 4.25Å; R176-L180 WeakPolarHBondContact O-CG 3.33Å; R176-L180 PolarHBondContact O-N 3.37Å; V177-L180 PolarHBondContact O-N 3.34Å; L180-R182 VanDerWaalsContact C-N 3.35Å; L180-R182 PolarHBondContact O-N 3.05Å; L180-E183 PolarHBondContact O-N 2.88Å; L180-W184 WeakPolarHBondContact O-CB 3.38Å; L180-W184 VanDerWaalsContact O-CD1 3.29Å; L180-W184 PolarHBondContact O-N 3.14Å |
| 181 | Y | 98.1 | Very high | 96.3 | Very high | 1 Ų | 1 | 26.4 Ų | 26.4 | 0% | 0.004 | 13% | 0.131 | C | C | . | . | H | α-helix | trans | -55.3 | -50.6 | 174.3 | 173.9 | -122.7 | 0 | 0 | 0 | 111.2 | A41 L44 L97 L101 A125 Q128 A129 V177 G179 L185 | A41-Y181 HydrophobicContact CB-CD1 3.56Å; A41-Y181 HydrophobicContact CB-CE1 3.43Å; A41-Y181 VanDerWaalsContact CB-CE1 3.43Å; L44-Y181 HydrophobicContact CD2-CD1 4.08Å; L44-Y181 HydrophobicContact CD2-CE1 4.18Å; L97-Y181 HydrophobicContact CD1-CD2 4.12Å; L97-Y181 HydrophobicContact CD2-CD2 4.48Å; L101-Y181 HydrophobicContact CD1-CD2 4.16Å; L101-Y181 HydrophobicContact CD1-CE2 4.49Å; L101-Y181 HydrophobicContact CD1-CG 4.42Å; A125-Y181 HydrophobicContact CB-CD1 4.27Å; A125-Y181 HydrophobicContact CB-CE1 3.63Å; A125-Y181 HydrophobicContact CB-CE2 4.41Å; Q128-Y181 PolarHBondContact OE1-OH 3.43Å; A129-Y181 HydrophobicContact CB-CD2 4.44Å; A129-Y181 HydrophobicContact CB-CE2 3.96Å; V177-Y181 WeakPolarHBondContact O-CB 3.43Å; V177-Y181 PolarHBondContact O-N 3.2Å; G179-Y181 VanDerWaalsContact C-N 3.34Å; G179-Y181 PolarHBondContact O-N 3.46Å; Y181-L185 HydrophobicContact CD1-CD1 4.2Å; Y181-L185 HydrophobicContact CD2-CD1 3.9Å; Y181-L185 HydrophobicContact CD2-CG 4.21Å; Y181-L185 HydrophobicContact CE1-CD1 3.71Å; Y181-L185 HydrophobicContact CE2-CD1 3.35Å; Y181-L185 HydrophobicContact CE2-CD2 4.3Å; Y181-L185 HydrophobicContact CE2-CG 3.9Å; Y181-L185 HydrophobicContact CG-CD1 4.3Å; Y181-L185 VanDerWaalsContact O-CG 3.31Å; Y181-L185 WeakPolarHBondContact O-CG 3.42Å; Y181-L185 PolarHBondContact O-N 3.42Å; Y181-L185 VanDerWaalsContact O-N 3.08Å |
| 182 | R | 97.9 | Very high | 96.3 | Very high | 85 Ų | 85 | 24.4 Ų | 24.4 | 32% | 0.321 | 12% | 0.122 | S | C | . | . | H | α-helix | trans | -62.5 | -47.6 | 177.2 | -175.2 | -167.7 | 65.8 | -174 | -3.6 | 112.1 | A41 C178 G179 L180 W184 L185 S186 | A41-R182 HydrophobicContact CB-CB 3.91Å; A41-R182 HydrophobicContact CB-CG 4.16Å; C178-R182 PolarHBondContact O-N 2.93Å; G179-R182 PolarHBondContact O-N 3.42Å; L180-R182 VanDerWaalsContact C-N 3.35Å; L180-R182 PolarHBondContact O-N 3.05Å; R182-W184 PolarHBondContact O-N 3.45Å; R182-L185 PolarHBondContact O-N 2.87Å; R182-S186 PolarHBondContact O-N 3.42Å; R182-S186 PolarHBondContact O-OG 3.12Å |
| 183 | E | 97.3 | Very high | 96.2 | Very high | 62 Ų | 62 | 25.2 Ų | 25.2 | 29% | 0.29 | 13% | 0.131 | S | C | . | . | H | α-helix | trans | -58.7 | -45 | -178.4 | -75.6 | 170.4 | -158.8 | 0 | 0 | 112.1 | A73 G179 L180 R187 | A73-E183 VanDerWaalsContact CB-OE2 3.25Å; A73-E183 WeakPolarHBondContact CB-OE2 3.32Å; G179-E183 WeakPolarHBondContact O-CG 2.98Å; G179-E183 PolarHBondContact O-N 3.42Å; L180-E183 PolarHBondContact O-N 2.88Å; E183-R187 WeakPolarHBondContact O-CB 3.5Å; E183-R187 PolarHBondContact O-N 3.34Å |
| 184 | W | 97.8 | Very high | 96.1 | Very high | 19 Ų | 19 | 29.1 Ų | 29.1 | 7% | 0.072 | 15% | 0.149 | C | C | . | . | H | α-helix | trans | -69.2 | -38.8 | 177.8 | -81 | 107.8 | 0 | 0 | 0 | 112.5 | S72 P74 A93 L97 L180 R182 R187 T188 | S72-W184 PolarHBondContact O-NE1 3.32Å; P74-W184 HydrophobicContact CB-CH2 4.24Å; P74-W184 HydrophobicContact CB-CZ2 4.33Å; P74-W184 HydrophobicContact CB-CZ3 4.39Å; P74-W184 HydrophobicContact CG-CD2 3.73Å; P74-W184 HydrophobicContact CG-CE3 3.92Å; P74-W184 HydrophobicContact CG-CG 4.27Å; P74-W184 HydrophobicContact CG-CH2 4.16Å; P74-W184 HydrophobicContact CG-CZ2 3.97Å; P74-W184 HydrophobicContact CG-CZ3 4.13Å; A93-W184 HydrophobicContact CB-CD2 3.25Å; A93-W184 VanDerWaalsContact CB-CE2 3.4Å; A93-W184 HydrophobicContact CB-CE3 3.47Å; A93-W184 VanDerWaalsContact CB-CE3 3.47Å; A93-W184 HydrophobicContact CB-CG 3.75Å; A93-W184 HydrophobicContact CB-CH2 3.96Å; A93-W184 HydrophobicContact CB-CZ2 3.78Å; A93-W184 HydrophobicContact CB-CZ3 3.82Å; L97-W184 HydrophobicContact CD1-CB 4.16Å; L180-W184 WeakPolarHBondContact O-CB 3.38Å; L180-W184 VanDerWaalsContact O-CD1 3.29Å; L180-W184 PolarHBondContact O-N 3.14Å; R182-W184 PolarHBondContact O-N 3.45Å; W184-R187 PolarHBondContact O-N 3.38Å; W184-T188 WeakPolarHBondContact O-CB 3.19Å; W184-T188 PolarHBondContact O-N 3.37Å; W184-T188 PolarHBondContact O-OG1 2.9Å |
| 185 | L | 98.1 | Very high | 95.7 | Very high | 0 Ų | 0 | 30.7 Ų | 30.7 | 0% | 0 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -61.8 | -47.1 | 174.1 | -74 | 175.9 | 0 | 0 | 0 | 112.7 | L37 A41 L94 L132 Y181 R182 R187 T188 E189 | L37-L185 HydrophobicContact CB-CD1 3.87Å; L37-L185 HydrophobicContact CB-CD2 4.01Å; L37-L185 HydrophobicContact CD1-CD2 4.3Å; A41-L185 HydrophobicContact CB-CD1 3.61Å; L94-L185 HydrophobicContact CD2-CD2 3.93Å; L132-L185 HydrophobicContact CD2-CD2 3.34Å; Y181-L185 HydrophobicContact CD1-CD1 4.2Å; Y181-L185 HydrophobicContact CD2-CD1 3.9Å; Y181-L185 HydrophobicContact CD2-CG 4.21Å; Y181-L185 HydrophobicContact CE1-CD1 3.71Å; Y181-L185 HydrophobicContact CE2-CD1 3.35Å; Y181-L185 HydrophobicContact CE2-CD2 4.3Å; Y181-L185 HydrophobicContact CE2-CG 3.9Å; Y181-L185 HydrophobicContact CG-CD1 4.3Å; Y181-L185 VanDerWaalsContact O-CG 3.31Å; Y181-L185 WeakPolarHBondContact O-CG 3.42Å; Y181-L185 PolarHBondContact O-N 3.42Å; Y181-L185 VanDerWaalsContact O-N 3.08Å; R182-L185 PolarHBondContact O-N 2.87Å; L185-R187 PolarHBondContact O-N 2.99Å; L185-T188 PolarHBondContact O-N 2.98Å; L185-E189 WeakPolarHBondContact O-CB 3.46Å; L185-E189 PolarHBondContact O-N 3.18Å |
| 186 | S | 97.3 | Very high | 95.2 | Very high | 52 Ų | 52 | 32.3 Ų | 32.3 | 36% | 0.364 | 17% | 0.166 | S | C | . | . | H | α-helix | trans | -61.9 | -35.9 | 176 | -60.7 | 0 | 0 | 0 | 0 | 112 | T38 R182 G190 | T38-S186 VanDerWaalsContact CG2-OG 3.26Å; T38-S186 WeakPolarHBondContact CG2-OG 3.31Å; R182-S186 PolarHBondContact O-N 3.42Å; R182-S186 PolarHBondContact O-OG 3.12Å; S186-G190 PolarHBondContact O-N 3.17Å; S186-G190 VanDerWaalsContact O-N 3.12Å |
| 187 | R | 96.4 | Very high | 94.4 | Very high | 85 Ų | 85 | 33 Ų | 33 | 32% | 0.321 | 19% | 0.188 | S | C | . | . | H | α-helix | trans | -65.7 | -52.4 | 176.1 | -179.7 | 60.9 | 76.3 | -160.4 | -0.3 | 111.3 | P74 H78 E183 W184 L185 E189 G190 D191 | P74-R187 HydrophobicContact CB-CG 4.35Å; P74-R187 HydrophobicContact CG-CB 4.17Å; P74-R187 HydrophobicContact CG-CG 4.41Å; H78-R187 VanDerWaalsContact CE1-CG 3.47Å; H78-R187 WeakPolarHBondContact CE1-CG 3.42Å; H78-R187 WeakPolarHBondContact ND1-CD 3.49Å; H78-R187 WeakPolarHBondContact ND1-CG 3.29Å; H78-R187 PolarHBondContact ND1-NE 3.15Å; E183-R187 WeakPolarHBondContact O-CB 3.5Å; E183-R187 PolarHBondContact O-N 3.34Å; W184-R187 PolarHBondContact O-N 3.38Å; L185-R187 PolarHBondContact O-N 2.99Å; R187-E189 VanDerWaalsContact C-N 3.29Å; R187-E189 PolarHBondContact O-N 3.32Å; R187-G190 PolarHBondContact O-N 3Å; R187-G190 VanDerWaalsContact O-N 3.07Å; R187-D191 VanDerWaalsContact CD-OD2 3.31Å; R187-D191 WeakPolarHBondContact CD-OD2 3.35Å; R187-D191 WeakPolarHBondContact CG-OD2 3.15Å; R187-D191 PolarHBondContact O-N 3.44Å |
| 188 | T | 97.1 | Very high | 92.9 | Very high | 0 Ų | 0 | 35.8 Ų | 35.8 | 0% | 0 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -58.5 | -41.2 | 178.5 | -56 | 0 | 0 | 0 | 0 | 111.8 | D90 L94 L132 V136 W184 L185 D191 L192 | D90-T188 HydrophobicContact CB-CG2 4.21Å; D90-T188 WeakPolarHBondContact CB-OG1 3.31Å; D90-T188 VanDerWaalsContact CG-OG1 3.31Å; D90-T188 PolarHBondContact OD1-OG1 3.39Å; D90-T188 WeakPolarHBondContact OD2-CA 3.27Å; L94-T188 HydrophobicContact CD1-CG2 4.14Å; L132-T188 HydrophobicContact CD2-CG2 4.24Å; V136-T188 HydrophobicContact CG2-CG2 3.82Å; W184-T188 WeakPolarHBondContact O-CB 3.19Å; W184-T188 PolarHBondContact O-N 3.37Å; W184-T188 PolarHBondContact O-OG1 2.9Å; L185-T188 PolarHBondContact O-N 2.98Å; T188-D191 PolarHBondContact O-N 3.33Å; T188-L192 HydrophobicContact CG2-CD1 3.85Å; T188-L192 HydrophobicContact CG2-CG 4.32Å; T188-L192 WeakPolarHBondContact O-CB 3.37Å; T188-L192 WeakPolarHBondContact O-CD1 3.45Å; T188-L192 WeakPolarHBondContact O-CG 3.1Å; T188-L192 PolarHBondContact O-N 3.35Å |
| 189 | E | 97.3 | Very high | 90.5 | Very high | 36 Ų | 36 | 38.1 Ų | 38.1 | 17% | 0.168 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -56 | -50.8 | 172.9 | -180 | -170 | 167.5 | 0 | 0 | 111.4 | H31 A34 H35 T38 L185 R187 D191 L192 G193 | H31-E189 PolarHBondContact CD2-O 3.36Å; A34-E189 HydrophobicContact CB-CB 3.99Å; H35-E189 HydrophobicContact CB-CG 4.26Å; H35-E189 IonicContact CE1-OE1 3.26Å; H35-E189 IonicContact CG-OE1 2.99Å; H35-E189 IonicContact ND1-OE1 2.69Å; H35-E189 PolarHBondContact ND1-OE1 2.88Å; T38-E189 VanDerWaalsContact CB-OE2 3.28Å; T38-E189 WeakPolarHBondContact CB-OE2 3.39Å; T38-E189 PolarHBondContact OG1-OE2 3.43Å; L185-E189 WeakPolarHBondContact O-CB 3.46Å; L185-E189 PolarHBondContact O-N 3.18Å; R187-E189 VanDerWaalsContact C-N 3.29Å; R187-E189 PolarHBondContact O-N 3.32Å; E189-D191 VanDerWaalsContact C-N 3.33Å; E189-D191 PolarHBondContact O-N 3.5Å; E189-L192 PolarHBondContact O-N 3.45Å; E189-G193 PolarHBondContact O-N 3.42Å |
| 190 | G | 95.2 | Very high | 87.6 | Confident | 38 Ų | 38 | 44 Ų | 44 | 39% | 0.392 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -63.2 | -37.2 | 179 | 0 | 0 | 0 | 0 | 0 | 113.5 | S186 R187 G193 Q194 | S186-G190 PolarHBondContact O-N 3.17Å; S186-G190 VanDerWaalsContact O-N 3.12Å; R187-G190 PolarHBondContact O-N 3Å; R187-G190 VanDerWaalsContact O-N 3.07Å; G190-G193 PolarHBondContact O-N 2.71Å; G190-Q194 WeakPolarHBondContact O-CG 3.43Å; G190-Q194 PolarHBondContact O-N 2.9Å; G190-Q194 VanDerWaalsContact O-N 3.16Å |
| 191 | D | 94.5 | Very high | 84.5 | Confident | 1 Ų | 1 | 52.2 Ų | 52.2 | 1% | 0.005 | 35% | 0.346 | C | S | . | . | H | α-helix | trans | -71.5 | -37.7 | 178.4 | -74.7 | -42.3 | 0 | 0 | 0 | 112.4 | H78 R86 L87 R187 T188 E189 Q194 L195 | H78-D191 IonicContact CE1-OD2 2.65Å; H78-D191 PolarHBondContact CE1-OD2 2.89Å; H78-D191 IonicContact ND1-OD2 3.92Å; R86-D191 WeakPolarHBondContact CD-OD1 3.48Å; R86-D191 IonicContact CZ-OD1 3.5Å; R86-D191 IonicContact NE-OD1 2.81Å; R86-D191 PolarHBondContact NE-OD1 2.9Å; R86-D191 IonicContact NH2-OD1 2.99Å; R86-D191 PolarHBondContact NH2-OD1 3.28Å; L87-D191 HydrophobicContact CD2-CB 4.1Å; R187-D191 VanDerWaalsContact CD-OD2 3.31Å; R187-D191 WeakPolarHBondContact CD-OD2 3.35Å; R187-D191 WeakPolarHBondContact CG-OD2 3.15Å; R187-D191 PolarHBondContact O-N 3.44Å; T188-D191 PolarHBondContact O-N 3.33Å; E189-D191 VanDerWaalsContact C-N 3.33Å; E189-D191 PolarHBondContact O-N 3.5Å; D191-Q194 PolarHBondContact O-N 3.17Å; D191-L195 PolarHBondContact O-N 3.07Å |
| 192 | L | 94.4 | Very high | 83.9 | Confident | 0 Ų | 0 | 54.8 Ų | 54.8 | 0% | 0 | 36% | 0.363 | C | S | . | . | H | α-helix | trans | -67.1 | -36.2 | 170.3 | -69.1 | 167.6 | 0 | 0 | 0 | 112.1 | T30 H31 A34 L87 L139 T188 E189 Q194 L195 L196 | T30-L192 HydrophobicContact CG2-CD1 3.82Å; T30-L192 HydrophobicContact CG2-CD2 4.28Å; H31-L192 HydrophobicContact CB-CB 4.07Å; A34-L192 HydrophobicContact CB-CD1 3.96Å; L87-L192 HydrophobicContact CD2-CD2 3.96Å; L87-L192 HydrophobicContact CD2-CG 4.18Å; L139-L192 HydrophobicContact CD1-CD2 3.61Å; T188-L192 HydrophobicContact CG2-CD1 3.85Å; T188-L192 HydrophobicContact CG2-CG 4.32Å; T188-L192 WeakPolarHBondContact O-CB 3.37Å; T188-L192 WeakPolarHBondContact O-CD1 3.45Å; T188-L192 WeakPolarHBondContact O-CG 3.1Å; T188-L192 PolarHBondContact O-N 3.35Å; E189-L192 PolarHBondContact O-N 3.45Å; L192-Q194 VanDerWaalsContact C-N 3.29Å; L192-Q194 PolarHBondContact O-N 3.47Å; L192-L195 WeakPolarHBondContact O-CB 3.48Å; L192-L195 PolarHBondContact O-N 3.19Å; L192-L196 PolarHBondContact O-N 3.13Å |
| 193 | G | 93.3 | Very high | 83.1 | Confident | 20 Ų | 20 | 53.2 Ų | 53.2 | 21% | 0.206 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -63.3 | -35.2 | 177 | 0 | 0 | 0 | 0 | 0 | 112.5 | H31 E189 G190 L195 L196 A197 | H31-G193 PolarHBondContact CD2-N 3.13Å; E189-G193 PolarHBondContact O-N 3.42Å; G190-G193 PolarHBondContact O-N 2.71Å; G193-L195 VanDerWaalsContact C-N 3.34Å; G193-L195 PolarHBondContact O-N 2.69Å; G193-L196 WeakPolarHBondContact O-CB 3.25Å; G193-L196 PolarHBondContact O-N 2.99Å; G193-A197 PolarHBondContact O-N 2.82Å; G193-A197 VanDerWaalsContact O-N 3.07Å |
| 194 | Q | 90 | Very high | 82.3 | Confident | 99 Ų | 99 | 52.7 Ų | 52.7 | 46% | 0.463 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -66.7 | -33.6 | 174.2 | -73 | 176.6 | 54.9 | 0 | 0 | 112.8 | R86 G190 D191 L192 L196 A197 G198 | R86-Q194 VanDerWaalsContact NH2-CD 3.28Å; G190-Q194 WeakPolarHBondContact O-CG 3.43Å; G190-Q194 PolarHBondContact O-N 2.9Å; G190-Q194 VanDerWaalsContact O-N 3.16Å; D191-Q194 PolarHBondContact O-N 3.17Å; L192-Q194 VanDerWaalsContact C-N 3.29Å; L192-Q194 PolarHBondContact O-N 3.47Å; Q194-L196 VanDerWaalsContact C-N 3.27Å; Q194-L196 PolarHBondContact O-N 3.3Å; Q194-A197 PolarHBondContact O-N 3.46Å; Q194-G198 PolarHBondContact O-N 3.07Å |
| 195 | L | 87.5 | Confident | 81.4 | Confident | 33 Ų | 33 | 54.6 Ų | 54.6 | 17% | 0.173 | 39% | 0.387 | C | S | . | . | H | α-helix | trans | -64.1 | -33.7 | 172.4 | -73 | -178.1 | 0 | 0 | 0 | 112.3 | I27 V83 L87 L143 D191 L192 G193 | I27-L195 HydrophobicContact CD1-CB 4.46Å; I27-L195 HydrophobicContact CD1-CD1 4.44Å; I27-L195 HydrophobicContact CG1-CD1 4.5Å; I27-L195 HydrophobicContact CG2-CB 3.88Å; I27-L195 HydrophobicContact CG2-CD1 4.38Å; V83-L195 HydrophobicContact CB-CD2 4.37Å; V83-L195 HydrophobicContact CG1-CD2 3.88Å; V83-L195 HydrophobicContact CG2-CD2 3.58Å; V83-L195 HydrophobicContact CG2-CG 3.81Å; L87-L195 HydrophobicContact CD1-CD1 3.53Å; L87-L195 HydrophobicContact CD1-CG 4.3Å; L143-L195 HydrophobicContact CD1-CD1 4.23Å; D191-L195 PolarHBondContact O-N 3.07Å; L192-L195 WeakPolarHBondContact O-CB 3.48Å; L192-L195 PolarHBondContact O-N 3.19Å; G193-L195 VanDerWaalsContact C-N 3.34Å; G193-L195 PolarHBondContact O-N 2.69Å |
| 196 | L | 85.4 | Confident | 80.4 | Confident | 59 Ų | 59 | 58.1 Ų | 58.1 | 31% | 0.309 | 41% | 0.411 | S | S | . | . | H | α-helix | trans | -72.9 | -36.5 | 176.1 | -66.1 | 175 | 0 | 0 | 0 | 112.4 | I27 R28 H31 L192 G193 Q194 G198 | I27-L196 HydrophobicContact CB-CD2 4.1Å; I27-L196 HydrophobicContact CG2-CD2 3.5Å; I27-L196 HydrophobicContact CG2-CG 3.78Å; R28-L196 HydrophobicContact CB-CD2 4.33Å; R28-L196 HydrophobicContact CG-CD1 4.42Å; R28-L196 HydrophobicContact CG-CD2 3.41Å; R28-L196 VanDerWaalsContact CG-CD2 3.41Å; H31-L196 HydrophobicContact CB-CD1 3.85Å; L192-L196 PolarHBondContact O-N 3.13Å; G193-L196 WeakPolarHBondContact O-CB 3.25Å; G193-L196 PolarHBondContact O-N 2.99Å; Q194-L196 VanDerWaalsContact C-N 3.27Å; Q194-L196 PolarHBondContact O-N 3.3Å; L196-G198 VanDerWaalsContact C-N 3.34Å |
| 197 | A | 78.6 | Confident | 79.3 | Confident | 92 Ų | 92 | 58.5 Ų | 58.5 | 76% | 0.76 | 41% | 0.414 | S | S | * | . | H | α-helix | trans | -75.7 | -21.5 | 179.3 | 0 | 0 | 0 | 0 | 0 | 113.4 | G193 Q194 | G193-A197 PolarHBondContact O-N 2.82Å; G193-A197 VanDerWaalsContact O-N 3.07Å; Q194-A197 PolarHBondContact O-N 3.46Å |
| 198 | G | 63.4 | Low | 78 | Confident | 61 Ų | 61 | 56.6 Ų | 56.6 | 63% | 0.629 | 42% | 0.421 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -96.8 | 21.7 | 179.8 | 0 | 0 | 0 | 0 | 0 | 115.5 | Q194 L196 | Q194-G198 PolarHBondContact O-N 3.07Å; L196-G198 VanDerWaalsContact C-N 3.34Å |
| 199 | G | 46.8 | Very low | 76.6 | Confident | 49 Ų | 49 | 60.9 Ų | 60.9 | 51% | 0.505 | 45% | 0.453 | S | S | . | . | trans | -54.3 | 150.1 | 171.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | A201 | G199-A201 PolarHBondContact O-N 3.33Š| ||
| 200 | P | 36.3 | Very low | 74.8 | Confident | 131 Ų | 131 | 63 Ų | 63 | 85% | 0.851 | 48% | 0.477 | S | S | * | . | trans | -57.9 | 130 | -161.4 | 25.2 | -33.6 | 0 | 0 | 0 | 111.8 | ||||
| 201 | A | 32.7 | Very low | 73 | Confident | 173 Ų | 173 | 65.3 Ų | 65.3 | 100% | 1.43 | 49% | 0.485 | S | S | * | . | trans | -74.9 | 0 | 162.1 | 0 | 0 | 0 | 0 | 0 | 110.4 | G199 | G199-A201 PolarHBondContact O-N 3.33Š|
Retrieved 201 of 201 residues in 62.9 ms
(Link to these results)