| 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 | 31.6 | Very low | 30.4 | Very low | 246 Ų | 246 | 148.9 Ų | 148.9 | 100% | 1.212 | 83% | 0.828 | S | S | * | * | 0 | 92.9 | 0 | -160.7 | 166.5 | -173.5 | 0 | 0 | 105.1 | I3 | M1-I3 PolarHBondContact O-N 3.26Š| |||
| 2 | A | 25.3 | Very low | 30.3 | Very low | 99 Ų | 99 | 142.1 Ų | 142.1 | 82% | 0.818 | 82% | 0.816 | S | S | * | * | trans | -77.8 | 119.8 | -171.7 | 0 | 0 | 0 | 0 | 0 | 108.3 | N4 | A2-N4 PolarHBondContact O-N 3.44Š| ||
| 3 | I | 30.7 | Very low | 30.4 | Very low | 132 Ų | 132 | 143.2 Ų | 143.2 | 68% | 0.677 | 82% | 0.815 | S | S | * | * | trans | -68.9 | 125.9 | 167.7 | -62.2 | 173.5 | 0 | 0 | 0 | 105.7 | M1 T5 | M1-I3 PolarHBondContact O-N 3.26Å; I3-T5 PolarHBondContact O-N 2.92Å; I3-T5 VanDerWaalsContact O-N 3.1Å | ||
| 4 | N | 29.2 | Very low | 30.4 | Very low | 142 Ų | 142 | 139.1 Ų | 139.1 | 76% | 0.759 | 82% | 0.82 | S | S | * | * | trans | -43.5 | 113.4 | -177.6 | -102.1 | -7 | 0 | 0 | 0 | 112.2 | A2 D6 | A2-N4 PolarHBondContact O-N 3.44Å; N4-D6 VanDerWaalsContact C-N 3.27Å; N4-D6 PolarHBondContact O-N 2.87Å | ||
| 5 | T | 32.8 | Very low | 30.7 | Very low | 130 Ų | 130 | 131.7 Ų | 131.7 | 80% | 0.798 | 79% | 0.786 | S | S | * | * | trans | -90.3 | 55.6 | 169.3 | 47.1 | 0 | 0 | 0 | 0 | 109.9 | I3 | I3-T5 PolarHBondContact O-N 2.92Å; I3-T5 VanDerWaalsContact O-N 3.1Å | ||
| 6 | D | 30.4 | Very low | 31.5 | Very low | 134 Ų | 134 | 125.9 Ų | 125.9 | 72% | 0.717 | 75% | 0.753 | S | S | * | * | trans | -123.8 | 67.1 | 173.2 | -66.6 | -35.9 | 0 | 0 | 0 | 108.6 | N4 | N4-D6 VanDerWaalsContact C-N 3.27Å; N4-D6 PolarHBondContact O-N 2.87Å | ||
| 7 | A | 30.6 | Very low | 32.2 | Very low | 101 Ų | 101 | 124.1 Ų | 124.1 | 84% | 0.835 | 75% | 0.748 | S | S | * | * | trans | -92.1 | 94.6 | 157.3 | 0 | 0 | 0 | 0 | 0 | 106.3 | ||||
| 8 | E | 30.6 | Very low | 33.3 | Very low | 188 Ų | 188 | 120.5 Ų | 120.5 | 88% | 0.879 | 72% | 0.724 | S | S | * | * | trans | -55.6 | 139.4 | 174.7 | -80.7 | -174 | 129.7 | 0 | 0 | 111.4 | W10 | E8-W10 PolarHBondContact O-N 3.34Š| ||
| 9 | D | 33 | Very low | 34.2 | Very low | 144 Ų | 144 | 114.6 Ų | 114.6 | 77% | 0.77 | 69% | 0.689 | S | S | * | * | trans | -60.2 | 115.6 | -168.4 | -166 | 6.2 | 0 | 0 | 0 | 112.9 | G11 | D9-G11 PolarHBondContact OD1-N 3.07Š| ||
| 10 | W | 33.1 | Very low | 35.1 | Very low | 257 Ų | 257 | 109 Ų | 109 | 97% | 0.973 | 66% | 0.656 | S | S | * | * | trans | -125.7 | 84.9 | 152.3 | -88 | 81.4 | 0 | 0 | 0 | 108.6 | E8 | E8-W10 PolarHBondContact O-N 3.34Š| ||
| 11 | G | 26.6 | Very low | 35.9 | Very low | 65 Ų | 65 | 109 Ų | 109 | 67% | 0.67 | 65% | 0.649 | S | S | * | * | S | Bend | trans | 57.8 | 83.1 | 133 | 0 | 0 | 0 | 0 | 0 | 117.3 | D9 | D9-G11 PolarHBondContact OD1-N 3.07Š|
| 12 | G | 30.2 | Very low | 37.1 | Very low | 67 Ų | 67 | 99.4 Ų | 99.4 | 69% | 0.691 | 60% | 0.599 | S | S | * | * | trans | 78.8 | 91.5 | 146 | 0 | 0 | 0 | 0 | 0 | 117.1 | ||||
| 13 | I | 31.1 | Very low | 38.5 | Very low | 156 Ų | 156 | 95 Ų | 95 | 80% | 0.8 | 56% | 0.562 | S | S | * | * | trans | 175.3 | 103.5 | 135 | -83.1 | 148.2 | 0 | 0 | 0 | 106.4 | G15 | I13-G15 PolarHBondContact O-N 3.12Š| ||
| 14 | G | 31 | Very low | 39.7 | Very low | 86 Ų | 86 | 93.3 Ų | 93.3 | 89% | 0.887 | 55% | 0.547 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -71.8 | 34.3 | 172.7 | 0 | 0 | 0 | 0 | 0 | 114.5 | ||
| 15 | G | 35 | Very low | 40.9 | Very low | 29 Ų | 29 | 90.1 Ų | 90.1 | 30% | 0.299 | 53% | 0.53 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -104.4 | -9 | -167.2 | 0 | 0 | 0 | 0 | 0 | 116.8 | I13 S19 | I13-G15 PolarHBondContact O-N 3.12Å; G15-S19 PolarHBondContact O-OG 3.2Å |
| 16 | S | 42.5 | Very low | 41.7 | Very low | 38 Ų | 38 | 85.3 Ų | 85.3 | 27% | 0.266 | 50% | 0.499 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -93.8 | -22.6 | -161.9 | 72.2 | 0 | 0 | 0 | 0 | 116.9 | R115 K120 | S16-R115 PolarHBondContact O-NH2 2.78Å; S16-K120 VanDerWaalsContact OG-CE 3.27Å; S16-K120 WeakPolarHBondContact OG-CE 3.25Å; S16-K120 PolarHBondContact OG-NZ 2.96Å |
| 17 | S | 44 | Very low | 42.8 | Very low | 95 Ų | 95 | 79.8 Ų | 79.8 | 66% | 0.664 | 47% | 0.469 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -83.1 | -44.9 | 175.4 | -162.7 | 0 | 0 | 0 | 0 | 110.2 | S19 G20 E21 | S17-S19 VanDerWaalsContact C-N 3.3Å; S17-S19 PolarHBondContact O-N 3.45Å; S17-G20 PolarHBondContact O-N 3.38Å; S17-E21 PolarHBondContact O-N 3.48Å |
| 18 | D | 52.4 | Low | 43.6 | Very low | 60 Ų | 60 | 75.7 Ų | 75.7 | 32% | 0.321 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -62.9 | -32.5 | -176.1 | -164.3 | -1.9 | 0 | 0 | 0 | 112.6 | G20 E21 R22 | D18-G20 PolarHBondContact O-N 3.01Å; D18-E21 PolarHBondContact O-N 3.23Å; D18-R22 VanDerWaalsContact O-CB 3.28Å; D18-R22 WeakPolarHBondContact O-CB 3.49Å; D18-R22 VanDerWaalsContact O-CD 3.25Å; D18-R22 WeakPolarHBondContact O-CD 3.49Å; D18-R22 WeakPolarHBondContact O-CG 3.48Å; D18-R22 PolarHBondContact O-N 2.99Å; D18-R22 WeakPolarHBondContact OD1-CG 3.21Å; D18-R22 IonicContact OD1-CZ 3.69Å; D18-R22 IonicContact OD1-NE 2.8Å; D18-R22 PolarHBondContact OD1-NE 2.96Å; D18-R22 IonicContact OD1-NH2 3.81Å; D18-R22 IonicContact OD2-CZ 3.22Å; D18-R22 IonicContact OD2-NE 3.16Å; D18-R22 PolarHBondContact OD2-NE 3.07Å; D18-R22 VanDerWaalsContact OD2-NE 3.16Å; D18-R22 IonicContact OD2-NH2 2.63Å; D18-R22 PolarHBondContact OD2-NH2 3.1Å |
| 19 | S | 49.3 | Very low | 44.1 | Very low | 8 Ų | 8 | 70.8 Ų | 70.8 | 6% | 0.056 | 42% | 0.419 | C | S | . | . | H | α-helix | trans | -67.9 | -36 | -179 | -60 | 0 | 0 | 0 | 0 | 114.6 | G15 S17 A23 R349 | G15-S19 PolarHBondContact O-OG 3.2Å; S17-S19 VanDerWaalsContact C-N 3.3Å; S17-S19 PolarHBondContact O-N 3.45Å; S19-A23 PolarHBondContact O-N 3.47Å; S19-R349 VanDerWaalsContact CB-CG 3.47Å |
| 20 | G | 51.7 | Low | 44.3 | Very low | 2 Ų | 2 | 67.7 Ų | 67.7 | 2% | 0.021 | 41% | 0.408 | C | S | . | . | H | α-helix | trans | -72.9 | -43.3 | 175.5 | 0 | 0 | 0 | 0 | 0 | 111.4 | S17 D18 R22 A23 W24 E112 | S17-G20 PolarHBondContact O-N 3.38Å; D18-G20 PolarHBondContact O-N 3.01Å; G20-R22 VanDerWaalsContact C-N 3.33Å; G20-R22 PolarHBondContact O-N 3.05Å; G20-A23 PolarHBondContact O-N 3.31Å; G20-W24 WeakPolarHBondContact O-CB 3.27Å; G20-W24 PolarHBondContact O-N 3.33Å; G20-E112 VanDerWaalsContact CA-OE1 3.28Å; G20-E112 WeakPolarHBondContact CA-OE1 3.45Å |
| 21 | E | 53.7 | Low | 44.3 | Very low | 109 Ų | 109 | 59.8 Ų | 59.8 | 51% | 0.509 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -61.4 | -39.7 | 175.3 | -157.3 | 174.2 | 170.3 | 0 | 0 | 111.9 | S17 D18 W24 L25 | S17-E21 PolarHBondContact O-N 3.48Å; D18-E21 PolarHBondContact O-N 3.23Å; E21-W24 PolarHBondContact O-N 3.38Å; E21-L25 WeakPolarHBondContact O-CB 3.29Å; E21-L25 VanDerWaalsContact O-CG 3.24Å; E21-L25 WeakPolarHBondContact O-CG 3.29Å; E21-L25 PolarHBondContact O-N 3.22Å |
| 22 | R | 56.5 | Low | 44.3 | Very low | 46 Ų | 46 | 64.4 Ų | 64.4 | 17% | 0.174 | 40% | 0.398 | C | S | . | . | H | α-helix | trans | -63.7 | -46.8 | 172.6 | -71.9 | 162.6 | -168.9 | -158.4 | -3.7 | 112.6 | D18 G20 W24 L25 L26 E353 V355 | D18-R22 VanDerWaalsContact O-CB 3.28Å; D18-R22 WeakPolarHBondContact O-CB 3.49Å; D18-R22 VanDerWaalsContact O-CD 3.25Å; D18-R22 WeakPolarHBondContact O-CD 3.49Å; D18-R22 WeakPolarHBondContact O-CG 3.48Å; D18-R22 PolarHBondContact O-N 2.99Å; D18-R22 WeakPolarHBondContact OD1-CG 3.21Å; D18-R22 IonicContact OD1-CZ 3.69Å; D18-R22 IonicContact OD1-NE 2.8Å; D18-R22 PolarHBondContact OD1-NE 2.96Å; D18-R22 IonicContact OD1-NH2 3.81Å; D18-R22 IonicContact OD2-CZ 3.22Å; D18-R22 IonicContact OD2-NE 3.16Å; D18-R22 PolarHBondContact OD2-NE 3.07Å; D18-R22 VanDerWaalsContact OD2-NE 3.16Å; D18-R22 IonicContact OD2-NH2 2.63Å; D18-R22 PolarHBondContact OD2-NH2 3.1Å; G20-R22 VanDerWaalsContact C-N 3.33Å; G20-R22 PolarHBondContact O-N 3.05Å; R22-W24 VanDerWaalsContact C-N 3.31Å; R22-W24 PolarHBondContact O-N 3.35Å; R22-L25 PolarHBondContact O-N 3.42Å; R22-L26 VanDerWaalsContact O-CG 3.24Å; R22-L26 WeakPolarHBondContact O-CG 3.29Å; R22-L26 PolarHBondContact O-N 3.08Å; R22-E353 PolarHBondContact NH1-O 3.22Å; R22-V355 HydrophobicContact CG-CG2 4.23Å; R22-V355 VanDerWaalsContact NH2-CG2 3.3Å |
| 23 | A | 53.2 | Low | 44.3 | Very low | 5 Ų | 5 | 66.6 Ų | 66.6 | 4% | 0.041 | 40% | 0.402 | C | S | . | . | H | α-helix | trans | -62.4 | -42.5 | 178.2 | 0 | 0 | 0 | 0 | 0 | 110.9 | S19 G20 L26 Q27 L348 | S19-A23 PolarHBondContact O-N 3.47Å; G20-A23 PolarHBondContact O-N 3.31Å; A23-L26 PolarHBondContact O-N 2.87Å; A23-Q27 WeakPolarHBondContact O-CB 3.45Å; A23-Q27 VanDerWaalsContact O-CG 3.27Å; A23-Q27 WeakPolarHBondContact O-CG 3.02Å; A23-Q27 PolarHBondContact O-N 3.38Å; A23-Q27 PolarHBondContact O-OE1 3.12Å; A23-L348 HydrophobicContact CB-CD1 4.13Å |
| 24 | W | 56.8 | Low | 44.3 | Very low | 97 Ų | 97 | 63.9 Ų | 63.9 | 37% | 0.367 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -59.8 | -51.1 | 172.6 | 174.9 | 77.3 | 0 | 0 | 0 | 111.6 | G20 E21 R22 L26 Q27 S28 | G20-W24 WeakPolarHBondContact O-CB 3.27Å; G20-W24 PolarHBondContact O-N 3.33Å; E21-W24 PolarHBondContact O-N 3.38Å; R22-W24 VanDerWaalsContact C-N 3.31Å; R22-W24 PolarHBondContact O-N 3.35Å; W24-L26 PolarHBondContact O-N 3.33Å; W24-Q27 CarbonylContact O-C 3.59Å; W24-Q27 PolarHBondContact O-N 3.1Å; W24-Q27 VanDerWaalsContact O-N 3.09Å; W24-S28 WeakPolarHBondContact O-CA 3.48Å; W24-S28 VanDerWaalsContact O-CB 3.27Å; W24-S28 WeakPolarHBondContact O-CB 3.2Å; W24-S28 PolarHBondContact O-N 2.84Å |
| 25 | L | 55 | Low | 44.2 | Very low | 76 Ų | 76 | 70.7 Ų | 70.7 | 40% | 0.398 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -54.2 | -53.4 | 178 | -77.7 | 168.8 | 0 | 0 | 0 | 110.1 | E21 R22 Q27 S28 V31 | E21-L25 WeakPolarHBondContact O-CB 3.29Å; E21-L25 VanDerWaalsContact O-CG 3.24Å; E21-L25 WeakPolarHBondContact O-CG 3.29Å; E21-L25 PolarHBondContact O-N 3.22Å; R22-L25 PolarHBondContact O-N 3.42Å; L25-Q27 PolarHBondContact O-N 2.94Å; L25-S28 PolarHBondContact O-N 3.22Å; L25-S28 VanDerWaalsContact O-N 3.15Å; L25-S28 PolarHBondContact O-OG 3.43Å; L25-V31 WeakPolarHBondContact O-CG2 3.42Å |
| 26 | L | 50 | Low | 43.7 | Very low | 28 Ų | 28 | 78.2 Ų | 78.2 | 15% | 0.147 | 43% | 0.429 | C | S | . | . | H | α-helix | trans | -60.1 | -22.8 | -178.4 | -66 | -179.6 | 0 | 0 | 0 | 114.2 | R22 A23 W24 L348 V359 E362 R366 | R22-L26 VanDerWaalsContact O-CG 3.24Å; R22-L26 WeakPolarHBondContact O-CG 3.29Å; R22-L26 PolarHBondContact O-N 3.08Å; A23-L26 PolarHBondContact O-N 2.87Å; W24-L26 PolarHBondContact O-N 3.33Å; L26-L348 HydrophobicContact CD1-CD1 4.27Å; L26-V359 HydrophobicContact CD2-CG2 4.06Å; L26-E362 HydrophobicContact CB-CG 4.24Å; L26-E362 HydrophobicContact CD1-CG 4.15Å; L26-E362 HydrophobicContact CD2-CB 4.42Å; L26-E362 HydrophobicContact CD2-CG 3.65Å; L26-E362 HydrophobicContact CG-CG 4.21Å; L26-R366 PolarHBondContact O-NH2 3.45Å |
| 27 | Q | 52.3 | Low | 43.2 | Very low | 18 Ų | 18 | 81.6 Ų | 81.6 | 8% | 0.084 | 45% | 0.45 | C | S | . | . | H | α-helix | trans | -108.2 | -12.2 | -177.4 | -65.5 | 161.1 | 13 | 0 | 0 | 113.2 | A23 W24 L25 F337 A341 E344 | A23-Q27 WeakPolarHBondContact O-CB 3.45Å; A23-Q27 VanDerWaalsContact O-CG 3.27Å; A23-Q27 WeakPolarHBondContact O-CG 3.02Å; A23-Q27 PolarHBondContact O-N 3.38Å; A23-Q27 PolarHBondContact O-OE1 3.12Å; W24-Q27 CarbonylContact O-C 3.59Å; W24-Q27 PolarHBondContact O-N 3.1Å; W24-Q27 VanDerWaalsContact O-N 3.09Å; L25-Q27 PolarHBondContact O-N 2.94Å; Q27-F337 HydrophobicContact CB-CZ 4.29Å; Q27-F337 WeakPolarHBondContact O-CZ 3.25Å; Q27-A341 PolarHBondContact NE2-O 2.88Å; Q27-A341 PolarHBondContact OE1-O 2.92Å; Q27-E344 VanDerWaalsContact NE2-CG 3.29Å |
| 28 | S | 47.7 | Very low | 42.7 | Very low | 16 Ų | 16 | 86.6 Ų | 86.6 | 11% | 0.112 | 46% | 0.463 | C | S | . | . | trans | -64.7 | 135.2 | 179.4 | 69.1 | 0 | 0 | 0 | 0 | 109.3 | W24 L25 S30 V31 | W24-S28 WeakPolarHBondContact O-CA 3.48Å; W24-S28 VanDerWaalsContact O-CB 3.27Å; W24-S28 WeakPolarHBondContact O-CB 3.2Å; W24-S28 PolarHBondContact O-N 2.84Å; L25-S28 PolarHBondContact O-N 3.22Å; L25-S28 VanDerWaalsContact O-N 3.15Å; L25-S28 PolarHBondContact O-OG 3.43Å; S28-S30 PolarHBondContact O-N 3.46Å; S28-V31 WeakPolarHBondContact OG-CG2 3.28Å | ||
| 29 | P | 41 | Very low | 41.7 | Very low | 84 Ų | 84 | 88.1 Ų | 88.1 | 55% | 0.545 | 48% | 0.484 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -64.6 | 2.7 | 177.3 | -21.4 | 32.3 | 0 | 0 | 0 | 114.8 | ||
| 30 | S | 37.7 | Very low | 41 | Very low | 79 Ų | 79 | 97.2 Ų | 97.2 | 55% | 0.552 | 53% | 0.526 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -127.7 | 17.8 | -163.6 | 53.2 | 0 | 0 | 0 | 0 | 114.9 | S28 D32 | S28-S30 PolarHBondContact O-N 3.46Å; S30-D32 PolarHBondContact O-N 3.46Å |
| 31 | V | 32.5 | Very low | 40.2 | Very low | 91 Ų | 91 | 106.7 Ų | 106.7 | 55% | 0.552 | 57% | 0.569 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77.6 | 63.7 | 174.3 | -165.5 | 0 | 0 | 0 | 0 | 111.6 | L25 S28 | L25-V31 WeakPolarHBondContact O-CG2 3.42Å; S28-V31 WeakPolarHBondContact OG-CG2 3.28Å |
| 32 | D | 26.2 | Very low | 39.5 | Very low | 163 Ų | 163 | 105.1 Ų | 105.1 | 87% | 0.872 | 58% | 0.582 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -142.9 | 25.1 | 160.1 | -96.6 | -23.4 | 0 | 0 | 0 | 111.7 | S30 | S30-D32 PolarHBondContact O-N 3.46Š|
| 33 | S | 30.5 | Very low | 39.1 | Very low | 112 Ų | 112 | 107.5 Ų | 107.5 | 78% | 0.783 | 61% | 0.606 | S | S | * | * | trans | -135.3 | 72.6 | 171.8 | -72.3 | 0 | 0 | 0 | 0 | 111.8 | R35 | S33-R35 PolarHBondContact O-N 2.63Š| ||
| 34 | A | 30.4 | Very low | 39.6 | Very low | 99 Ų | 99 | 119.3 Ų | 119.3 | 82% | 0.818 | 65% | 0.65 | S | S | * | * | trans | -68.4 | 111.3 | 150.9 | 0 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 35 | R | 29.1 | Very low | 40.3 | Very low | 230 Ų | 230 | 116.1 Ų | 116.1 | 87% | 0.868 | 65% | 0.647 | S | S | * | * | trans | 60.7 | 97.6 | 161.4 | -57.4 | -179.1 | -172.5 | 176.1 | 2.4 | 117.1 | S33 | S33-R35 PolarHBondContact O-N 2.63Š| ||
| 36 | H | 24.8 | Very low | 41.6 | Very low | 186 Ų | 186 | 114.4 Ų | 114.4 | 86% | 0.861 | 64% | 0.64 | S | S | * | * | trans | -145.4 | 139.1 | 139.4 | -112.5 | -85.1 | 0 | 0 | 0 | 109.8 | ||||
| 37 | P | 31.4 | Very low | 43.5 | Very low | 110 Ų | 110 | 116 Ų | 116 | 71% | 0.714 | 65% | 0.653 | S | S | * | * | trans | -75.6 | 137.5 | -175.2 | 2 | 15.2 | 0 | 0 | 0 | 110.9 | A39 | P37-A39 PolarHBondContact O-N 3.16Š| ||
| 38 | E | 34.6 | Very low | 45.3 | Very low | 200 Ų | 200 | 117 Ų | 117 | 94% | 0.935 | 66% | 0.664 | S | S | * | * | S | Bend | trans | 25.1 | 79.5 | 152.1 | -61.3 | -176.8 | 151.2 | 0 | 0 | 117.8 | ||
| 39 | A | 32.4 | Very low | 47.2 | Very low | 92 Ų | 92 | 121.9 Ų | 121.9 | 76% | 0.76 | 69% | 0.688 | S | S | * | * | trans | -171.1 | 133.8 | 147.2 | 0 | 0 | 0 | 0 | 0 | 109.8 | P37 | P37-A39 PolarHBondContact O-N 3.16Š| ||
| 40 | E | 32.8 | Very low | 49.4 | Very low | 198 Ų | 198 | 118.7 Ų | 118.7 | 93% | 0.925 | 67% | 0.671 | S | S | * | * | trans | 94.5 | 57.1 | 177.5 | -54.3 | -153.1 | 157.7 | 0 | 0 | 119.3 | ||||
| 41 | E | 36.7 | Very low | 51.8 | Low | 201 Ų | 201 | 115 Ų | 115 | 94% | 0.939 | 65% | 0.645 | S | S | * | * | trans | -96.1 | 18.6 | 165.3 | -89.1 | -165.1 | 147.9 | 0 | 0 | 114.8 | S43 | E41-S43 PolarHBondContact O-N 2.8Š| ||
| 42 | G | 37.6 | Very low | 54.6 | Low | 76 Ų | 76 | 111 Ų | 111 | 78% | 0.784 | 62% | 0.621 | S | S | * | * | S | Bend | trans | -78.4 | -13 | -168.6 | 0 | 0 | 0 | 0 | 0 | 118.4 | ||
| 43 | S | 47.5 | Very low | 57.5 | Low | 97 Ų | 97 | 107.7 Ų | 107.7 | 68% | 0.678 | 60% | 0.599 | S | S | * | * | S | Bend | trans | -136.5 | -22 | -158.9 | -178 | 0 | 0 | 0 | 0 | 117.8 | E41 | E41-S43 PolarHBondContact O-N 2.8Š|
| 44 | R | 63.7 | Low | 60.2 | Low | 253 Ų | 253 | 103.1 Ų | 103.1 | 96% | 0.955 | 57% | 0.565 | S | S | * | * | trans | -90.2 | -7.1 | -163.7 | -81.3 | 179.1 | 135.7 | 154.7 | -5.8 | 117.9 | ||||
| 45 | G | 72.8 | Confident | 63 | Low | 29 Ų | 29 | 98.6 Ų | 98.6 | 30% | 0.299 | 53% | 0.528 | S | S | . | . | S | Bend | trans | -80.8 | 157.8 | -179.9 | 0 | 0 | 0 | 0 | 0 | 114.7 | S263 K265 | G45-S263 CarbonylContact C-O 3.56Å; G45-S263 WeakPolarHBondContact CA-O 3.46Å; G45-K265 WeakPolarHBondContact O-CE 3.44Å; G45-K265 WeakPolarHBondContact O-CG 3.29Å |
| 46 | V | 82.9 | Confident | 66 | Low | 41 Ų | 41 | 87.7 Ų | 87.7 | 25% | 0.248 | 49% | 0.487 | C | S | . | . | B | Isolated β-bridge | trans | -70.2 | 134.9 | 171.9 | -177.1 | 0 | 0 | 0 | 0 | 109.8 | A51 I54 S263 M264 K265 | V46-A51 HydrophobicContact CG1-CB 4.3Å; V46-I54 HydrophobicContact CG1-CD1 3.97Å; V46-I54 HydrophobicContact CG2-CD1 4.4Å; V46-S263 PolarHBondContact N-O 3.16Å; V46-M264 WeakPolarHBondContact O-CA 3.18Å; V46-K265 PolarHBondContact O-N 3.35Å |
| 47 | S | 89.8 | Confident | 68.9 | Low | 61 Ų | 61 | 79 Ų | 79 | 43% | 0.427 | 45% | 0.446 | S | S | . | . | P | Polyproline II helix | trans | -69.1 | 158.8 | 175 | 66.6 | 0 | 0 | 0 | 0 | 111.2 | L49 G50 A51 | S47-L49 VanDerWaalsContact C-N 3.27Å; S47-L49 PolarHBondContact O-N 2.91Å; S47-G50 WeakPolarHBondContact O-CA 3.43Å; S47-G50 PolarHBondContact O-N 2.82Å; S47-G50 PolarHBondContact OG-N 3.27Å; S47-G50 VanDerWaalsContact OG-N 3.11Å; S47-A51 PolarHBondContact O-N 3.43Å |
| 48 | A | 89.6 | Confident | 71.5 | Confident | 39 Ų | 39 | 75.3 Ų | 75.3 | 32% | 0.322 | 43% | 0.425 | S | S | . | . | H | α-helix | trans | -56.5 | -41.7 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | A51 V52 V275 | A48-A51 WeakPolarHBondContact O-CB 3.44Å; A48-A51 PolarHBondContact O-N 2.96Å; A48-V52 WeakPolarHBondContact O-CG2 3.45Å; A48-V52 PolarHBondContact O-N 3.01Å; A48-V275 HydrophobicContact CB-CG2 3.94Å; A48-V275 WeakPolarHBondContact O-CG2 3.49Å |
| 49 | L | 88.1 | Confident | 74.1 | Confident | 118 Ų | 118 | 66 Ų | 66 | 62% | 0.618 | 38% | 0.383 | S | S | * | . | H | α-helix | trans | -63.8 | -41.7 | 174.3 | -69 | 174.3 | 0 | 0 | 0 | 112.3 | S47 A51 V52 F53 | S47-L49 VanDerWaalsContact C-N 3.27Å; S47-L49 PolarHBondContact O-N 2.91Å; L49-A51 VanDerWaalsContact C-N 3.29Å; L49-A51 PolarHBondContact O-N 3.39Å; L49-V52 WeakPolarHBondContact O-CB 3.2Å; L49-V52 PolarHBondContact O-N 3.36Å; L49-F53 WeakPolarHBondContact O-CD2 3.42Å; L49-F53 PolarHBondContact O-N 3.23Å |
| 50 | G | 86.4 | Confident | 76.7 | Confident | 18 Ų | 18 | 61.6 Ų | 61.6 | 19% | 0.186 | 35% | 0.347 | C | S | . | . | H | α-helix | trans | -61.5 | -39.1 | 174.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | S47 V52 F53 I54 | S47-G50 WeakPolarHBondContact O-CA 3.43Å; S47-G50 PolarHBondContact O-N 2.82Å; S47-G50 PolarHBondContact OG-N 3.27Å; S47-G50 VanDerWaalsContact OG-N 3.11Å; G50-V52 VanDerWaalsContact C-N 3.34Å; G50-F53 PolarHBondContact O-N 3.39Å; G50-I54 WeakPolarHBondContact O-CG1 3.39Å; G50-I54 PolarHBondContact O-N 3.45Å; G50-I54 VanDerWaalsContact O-N 3.09Å |
| 51 | A | 88.7 | Confident | 78.7 | Confident | 0 Ų | 0 | 52.5 Ų | 52.5 | 0% | 0 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -65.6 | -36.7 | 175.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | V46 S47 A48 L49 I54 V55 V260 M264 V275 | V46-A51 HydrophobicContact CG1-CB 4.3Å; S47-A51 PolarHBondContact O-N 3.43Å; A48-A51 WeakPolarHBondContact O-CB 3.44Å; A48-A51 PolarHBondContact O-N 2.96Å; L49-A51 VanDerWaalsContact C-N 3.29Å; L49-A51 PolarHBondContact O-N 3.39Å; A51-I54 PolarHBondContact O-N 3.16Å; A51-V55 WeakPolarHBondContact O-CG2 3.28Å; A51-V55 PolarHBondContact O-N 3.32Å; A51-V260 HydrophobicContact CB-CG1 4.13Å; A51-M264 HydrophobicContact CB-CG 4.05Å; A51-M264 HydrophobicContact CB-SD 3.96Å; A51-V275 HydrophobicContact CB-CG1 3.82Å; A51-V275 HydrophobicContact CB-CG2 4.21Å |
| 52 | V | 91.2 | Very high | 80.6 | Confident | 8 Ų | 8 | 43 Ų | 43 | 5% | 0.048 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -57.3 | -50.9 | 171.9 | 171.4 | 0 | 0 | 0 | 0 | 110.3 | A48 L49 G50 I54 V55 V56 V275 C278 S279 I282 | A48-V52 WeakPolarHBondContact O-CG2 3.45Å; A48-V52 PolarHBondContact O-N 3.01Å; L49-V52 WeakPolarHBondContact O-CB 3.2Å; L49-V52 PolarHBondContact O-N 3.36Å; G50-V52 VanDerWaalsContact C-N 3.34Å; V52-I54 VanDerWaalsContact C-N 3.28Å; V52-I54 PolarHBondContact O-N 2.96Å; V52-V55 PolarHBondContact O-N 2.9Å; V52-V56 HydrophobicContact CG1-CG2 3.99Å; V52-V56 WeakPolarHBondContact O-CB 3.39Å; V52-V56 WeakPolarHBondContact O-CG2 3.23Å; V52-V56 PolarHBondContact O-N 2.72Å; V52-V275 HydrophobicContact CG2-CB 4.22Å; V52-V275 HydrophobicContact CG2-CG1 4.01Å; V52-V275 HydrophobicContact CG2-CG2 4.22Å; V52-C278 HydrophobicContact CG2-CB 4.34Å; V52-S279 WeakPolarHBondContact CA-OG 3.16Å; V52-S279 PolarHBondContact O-OG 2.72Å; V52-I282 HydrophobicContact CG1-CD1 3.96Å |
| 53 | F | 87.6 | Confident | 82.8 | Confident | 94 Ų | 94 | 39.5 Ų | 39.5 | 41% | 0.412 | 23% | 0.226 | S | C | . | . | H | α-helix | trans | -60.3 | -37.2 | 178.6 | -75.6 | -74.2 | 0 | 0 | 0 | 113.2 | L49 G50 N57 V204 | L49-F53 WeakPolarHBondContact O-CD2 3.42Å; L49-F53 PolarHBondContact O-N 3.23Å; G50-F53 PolarHBondContact O-N 3.39Å; F53-N57 WeakPolarHBondContact O-CB 3.42Å; F53-N57 PolarHBondContact O-N 3.31Å; F53-V204 HydrophobicContact CD1-CB 4.33Å; F53-V204 HydrophobicContact CD1-CG1 4.33Å; F53-V204 HydrophobicContact CD1-CG2 4.25Å; F53-V204 HydrophobicContact CE1-CG1 4.35Å |
| 54 | I | 86.4 | Confident | 84.9 | Confident | 15 Ų | 15 | 34.9 Ų | 34.9 | 8% | 0.077 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -69 | -43.6 | 177.9 | -62.8 | 167.4 | 0 | 0 | 0 | 111 | V46 G50 A51 V52 N57 A58 V260 | V46-I54 HydrophobicContact CG1-CD1 3.97Å; V46-I54 HydrophobicContact CG2-CD1 4.4Å; G50-I54 WeakPolarHBondContact O-CG1 3.39Å; G50-I54 PolarHBondContact O-N 3.45Å; G50-I54 VanDerWaalsContact O-N 3.09Å; A51-I54 PolarHBondContact O-N 3.16Å; V52-I54 VanDerWaalsContact C-N 3.28Å; V52-I54 PolarHBondContact O-N 2.96Å; I54-N57 PolarHBondContact O-N 2.63Å; I54-A58 WeakPolarHBondContact O-CB 3.37Å; I54-A58 PolarHBondContact O-N 2.87Å; I54-V260 HydrophobicContact CG2-CG1 4.38Å; I54-V260 HydrophobicContact CG2-CG2 3.55Å |
| 55 | V | 89.8 | Confident | 86.3 | Confident | 4 Ų | 4 | 22.9 Ų | 22.9 | 2% | 0.024 | 15% | 0.148 | C | C | . | . | H | α-helix | trans | -67.2 | -43.2 | 177.6 | 174.9 | 0 | 0 | 0 | 0 | 111 | A51 V52 A58 A59 V260 W272 V275 M280 | A51-V55 WeakPolarHBondContact O-CG2 3.28Å; A51-V55 PolarHBondContact O-N 3.32Å; V52-V55 PolarHBondContact O-N 2.9Å; V55-A58 PolarHBondContact O-N 3.48Å; V55-A59 PolarHBondContact O-N 2.79Å; V55-V260 HydrophobicContact CG2-CG1 3.98Å; V55-W272 HydrophobicContact CG2-CH2 4.27Å; V55-W272 HydrophobicContact CG2-CZ3 4.46Å; V55-V275 HydrophobicContact CG2-CG1 4.23Å; V55-M280 HydrophobicContact CG1-CE 3.62Å |
| 56 | V | 90.5 | Very high | 87.3 | Confident | 1 Ų | 1 | 21.5 Ų | 21.5 | 1% | 0.006 | 13% | 0.134 | C | C | . | . | H | α-helix | trans | -60.7 | -45.7 | 175.1 | 175.3 | 0 | 0 | 0 | 0 | 110.2 | V52 A58 A59 L60 V204 I282 | V52-V56 HydrophobicContact CG1-CG2 3.99Å; V52-V56 WeakPolarHBondContact O-CB 3.39Å; V52-V56 WeakPolarHBondContact O-CG2 3.23Å; V52-V56 PolarHBondContact O-N 2.72Å; V56-A58 VanDerWaalsContact C-N 3.3Å; V56-A58 PolarHBondContact O-N 3.26Å; V56-A59 PolarHBondContact O-N 3.49Å; V56-A59 VanDerWaalsContact O-N 3.16Å; V56-L60 HydrophobicContact CG1-CD1 3.31Å; V56-L60 HydrophobicContact CG1-CG 3.74Å; V56-L60 WeakPolarHBondContact O-CB 3.28Å; V56-L60 WeakPolarHBondContact O-CG 3.46Å; V56-L60 PolarHBondContact O-N 3.45Å; V56-V204 HydrophobicContact CB-CG2 4.15Å; V56-V204 HydrophobicContact CG1-CG1 4.19Å; V56-V204 HydrophobicContact CG1-CG2 3.66Å; V56-I282 HydrophobicContact CG1-CG2 4.06Å; V56-I282 HydrophobicContact CG2-CB 4.24Å; V56-I282 HydrophobicContact CG2-CD1 4.24Å; V56-I282 HydrophobicContact CG2-CG2 4.27Å |
| 57 | N | 86.5 | Confident | 87.8 | Confident | 3 Ų | 3 | 19.6 Ų | 19.6 | 2% | 0.016 | 12% | 0.122 | C | C | . | . | H | α-helix | trans | -62.5 | -36.8 | 176 | -179.8 | 75 | 0 | 0 | 0 | 112.8 | F53 I54 A59 S200 S203 V204 | F53-N57 WeakPolarHBondContact O-CB 3.42Å; F53-N57 PolarHBondContact O-N 3.31Å; I54-N57 PolarHBondContact O-N 2.63Å; N57-A59 VanDerWaalsContact C-N 3.27Å; N57-A59 PolarHBondContact O-N 3.47Å; N57-S200 PolarHBondContact ND2-OG 3.26Å; N57-S203 WeakPolarHBondContact OD1-CB 3.27Å; N57-S203 PolarHBondContact OD1-OG 2.91Å; N57-V204 HydrophobicContact CB-CG2 4.37Å |
| 58 | A | 86.2 | Confident | 88.1 | Confident | 33 Ų | 33 | 16.7 Ų | 16.7 | 27% | 0.273 | 10% | 0.102 | S | C | . | . | H | α-helix | trans | -66.7 | -30.2 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | I54 V55 V56 C253 | I54-A58 WeakPolarHBondContact O-CB 3.37Å; I54-A58 PolarHBondContact O-N 2.87Å; V55-A58 PolarHBondContact O-N 3.48Å; V56-A58 VanDerWaalsContact C-N 3.3Å; V56-A58 PolarHBondContact O-N 3.26Å; A58-C253 HydrophobicContact CB-CB 3.88Å |
| 59 | A | 89.6 | Confident | 88.2 | Confident | 5 Ų | 5 | 14.9 Ų | 14.9 | 4% | 0.041 | 9% | 0.087 | C | C | . | . | H | α-helix | trans | -83.7 | -58.1 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | V55 V56 N57 G61 C253 M280 Y287 | V55-A59 PolarHBondContact O-N 2.79Å; V56-A59 PolarHBondContact O-N 3.49Å; V56-A59 VanDerWaalsContact O-N 3.16Å; N57-A59 VanDerWaalsContact C-N 3.27Å; N57-A59 PolarHBondContact O-N 3.47Å; A59-G61 PolarHBondContact O-N 2.81Å; A59-C253 HydrophobicContact CB-CB 4.27Å; A59-M280 HydrophobicContact CB-CE 4.49Å; A59-Y287 PolarHBondContact O-OH 2.67Å |
| 60 | L | 85.6 | Confident | 88.4 | Confident | 0 Ų | 0 | 9.3 Ų | 9.3 | 0% | 0 | 6% | 0.058 | C | C | . | . | S | Bend | trans | -66.9 | 15.8 | -170.6 | -70 | -171.2 | 0 | 0 | 0 | 116.5 | V56 T207 C283 V286 Y287 | V56-L60 HydrophobicContact CG1-CD1 3.31Å; V56-L60 HydrophobicContact CG1-CG 3.74Å; V56-L60 WeakPolarHBondContact O-CB 3.28Å; V56-L60 WeakPolarHBondContact O-CG 3.46Å; V56-L60 PolarHBondContact O-N 3.45Å; L60-T207 HydrophobicContact CB-CG2 4Å; L60-T207 WeakPolarHBondContact CD1-OG1 3.31Å; L60-T207 WeakPolarHBondContact O-CG2 3.24Å; L60-C283 HydrophobicContact CD2-CB 4.04Å; L60-V286 HydrophobicContact CD1-CB 4.42Å; L60-V286 HydrophobicContact CD1-CG1 4.15Å; L60-V286 HydrophobicContact CD1-CG2 4.2Å; L60-V286 HydrophobicContact CD2-CB 3.92Å; L60-V286 HydrophobicContact CD2-CG1 3.45Å; L60-V286 VanDerWaalsContact CD2-CG1 3.45Å; L60-V286 HydrophobicContact CG-CG1 4.45Å; L60-Y287 VanDerWaalsContact CA-OH 3.32Å; L60-Y287 WeakPolarHBondContact CA-OH 3.33Å; L60-Y287 HydrophobicContact CD2-CD1 4.25Å; L60-Y287 HydrophobicContact CD2-CE1 3.63Å; L60-Y287 HydrophobicContact CD2-CE2 4.15Å; L60-Y287 PolarHBondContact N-OH 3.02Å |
| 61 | G | 75.1 | Confident | 88.8 | Confident | 7 Ų | 7 | 8.5 Ų | 8.5 | 7% | 0.072 | 5% | 0.05 | C | C | . | . | S | Bend | trans | -62.9 | -149.2 | -179.1 | 0 | 0 | 0 | 0 | 0 | 114 | A59 G63 L64 | A59-G61 PolarHBondContact O-N 2.81Å; G61-G63 PolarHBondContact O-N 2.9Å; G61-L64 PolarHBondContact O-N 2.91Å |
| 62 | A | 77.9 | Confident | 88.9 | Confident | 1 Ų | 1 | 9.4 Ų | 9.4 | 1% | 0.008 | 6% | 0.056 | C | C | . | . | G | 310 helix | trans | -53.3 | -25 | 178.7 | 0 | 0 | 0 | 0 | 0 | 114.6 | L64 L65 N66 F141 V144 V328 | A62-L64 PolarHBondContact O-N 3.48Å; A62-L64 VanDerWaalsContact O-N 3.14Å; A62-L65 WeakPolarHBondContact O-CB 3.25Å; A62-L65 PolarHBondContact O-N 3.27Å; A62-N66 PolarHBondContact O-OD1 3.39Å; A62-F141 HydrophobicContact CB-CD1 4.13Å; A62-F141 HydrophobicContact CB-CE1 3.99Å; A62-V144 HydrophobicContact CB-CG1 4.49Å; A62-V144 HydrophobicContact CB-CG2 3.93Å; A62-V328 HydrophobicContact CB-CG2 3.98Å |
| 63 | G | 83.9 | Confident | 88.8 | Confident | 3 Ų | 3 | 11.8 Ų | 11.8 | 3% | 0.031 | 7% | 0.067 | C | C | . | . | G | 310 helix | trans | -61.5 | -19.7 | -178.5 | 0 | 0 | 0 | 0 | 0 | 115.3 | G61 L65 N66 F67 | G61-G63 PolarHBondContact O-N 2.9Å; G63-L65 PolarHBondContact O-N 2.96Å; G63-N66 PolarHBondContact O-N 3.49Å; G63-F67 VanDerWaalsContact O-CD2 3.22Å; G63-F67 WeakPolarHBondContact O-CD2 3.41Å; G63-F67 WeakPolarHBondContact O-CE2 3.48Å |
| 64 | L | 91.7 | Very high | 88.9 | Confident | 0 Ų | 0 | 7.3 Ų | 7.3 | 0% | 0 | 5% | 0.047 | C | C | . | . | G | 310 helix | trans | -54.5 | -39.9 | 172.7 | 174.7 | 61.5 | 0 | 0 | 0 | 112.5 | G61 A62 N66 F67 T207 V210 V286 Y287 T290 | G61-L64 PolarHBondContact O-N 2.91Å; A62-L64 PolarHBondContact O-N 3.48Å; A62-L64 VanDerWaalsContact O-N 3.14Å; L64-N66 PolarHBondContact O-N 3.41Å; L64-N66 VanDerWaalsContact O-N 3.17Å; L64-F67 PolarHBondContact O-N 3.33Å; L64-T207 HydrophobicContact CD2-CG2 4.4Å; L64-V210 HydrophobicContact CD2-CB 4.38Å; L64-V210 HydrophobicContact CD2-CG1 4.14Å; L64-V286 HydrophobicContact CD1-CG1 3.55Å; L64-V286 HydrophobicContact CD2-CG1 4.09Å; L64-V286 HydrophobicContact CG-CG1 4.46Å; L64-Y287 HydrophobicContact CB-CD1 4.35Å; L64-Y287 HydrophobicContact CB-CE1 3.87Å; L64-Y287 HydrophobicContact CD1-CD1 3.42Å; L64-Y287 VanDerWaalsContact CD1-CD1 3.42Å; L64-Y287 HydrophobicContact CD1-CE1 3.77Å; L64-Y287 HydrophobicContact CG-CE1 4.45Å; L64-T290 HydrophobicContact CD1-CG2 3.93Å; L64-T290 WeakPolarHBondContact CD1-OG1 3.26Å; L64-T290 HydrophobicContact CG-CG2 4.23Å |
| 65 | L | 92.2 | Very high | 89 | Confident | 0 Ų | 0 | 7 Ų | 7 | 0% | 0 | 5% | 0.049 | C | C | . | . | G | 310 helix | trans | -67.5 | -19.7 | -171 | -56.5 | 175.4 | 0 | 0 | 0 | 112.7 | A62 G63 V144 V210 D305 V306 L307 I324 | A62-L65 WeakPolarHBondContact O-CB 3.25Å; A62-L65 PolarHBondContact O-N 3.27Å; G63-L65 PolarHBondContact O-N 2.96Å; L65-V144 HydrophobicContact CD1-CG1 4.17Å; L65-V210 HydrophobicContact CD2-CG1 4.25Å; L65-D305 WeakPolarHBondContact CD1-OD2 3.41Å; L65-V306 HydrophobicContact CD2-CG1 4.34Å; L65-V306 PolarHBondContact O-N 3.48Å; L65-L307 HydrophobicContact CD2-CD1 3.72Å; L65-L307 HydrophobicContact CD2-CG 3.86Å; L65-I324 HydrophobicContact CD1-CD1 4.33Å; L65-I324 HydrophobicContact CD1-CG1 4.35Å; L65-I324 HydrophobicContact CD1-CG2 3.78Å; L65-I324 HydrophobicContact CD2-CD1 3.92Å; L65-I324 HydrophobicContact CD2-CG1 4.08Å; L65-I324 HydrophobicContact CG-CD1 4.33Å |
| 66 | N | 93.4 | Very high | 88.9 | Confident | 1 Ų | 1 | 7 Ų | 7 | 1% | 0.005 | 5% | 0.05 | C | C | . | . | G | 310 helix | trans | -95.9 | -7.8 | -174 | -55.8 | 75.6 | 0 | 0 | 0 | 113.9 | A62 G63 L64 A69 A70 T246 Q304 I391 | A62-N66 PolarHBondContact O-OD1 3.39Å; G63-N66 PolarHBondContact O-N 3.49Å; L64-N66 PolarHBondContact O-N 3.41Å; L64-N66 VanDerWaalsContact O-N 3.17Å; N66-A69 PolarHBondContact O-N 2.91Å; N66-A70 PolarHBondContact O-N 3.01Å; N66-T246 HydrophobicContact CB-CG2 3.44Å; N66-T246 VanDerWaalsContact CB-CG2 3.44Å; N66-Q304 WeakPolarHBondContact CA-O 3.21Å; N66-Q304 PolarHBondContact ND2-O 3.18Å; N66-I391 WeakPolarHBondContact ND2-CD1 3.23Å |
| 67 | F | 94.6 | Very high | 89 | Confident | 0 Ų | 0 | 8.8 Ų | 8.8 | 0% | 0 | 6% | 0.06 | C | C | . | . | H | α-helix | trans | -60.7 | -41.8 | -178.9 | -86.7 | -100.9 | 0 | 0 | 0 | 113.7 | G63 L64 A69 A70 F71 I247 F251 Y287 | G63-F67 VanDerWaalsContact O-CD2 3.22Å; G63-F67 WeakPolarHBondContact O-CD2 3.41Å; G63-F67 WeakPolarHBondContact O-CE2 3.48Å; L64-F67 PolarHBondContact O-N 3.33Å; F67-A69 VanDerWaalsContact C-N 3.34Å; F67-A69 PolarHBondContact O-N 3.44Å; F67-A70 WeakPolarHBondContact O-CB 3.39Å; F67-A70 PolarHBondContact O-N 2.75Å; F67-F71 HydrophobicContact CD1-CE1 4.26Å; F67-F71 VanDerWaalsContact O-CD1 3.29Å; F67-F71 WeakPolarHBondContact O-CD1 3.33Å; F67-F71 PolarHBondContact O-N 3.07Å; F67-I247 HydrophobicContact CE1-CG1 4.41Å; F67-F251 HydrophobicContact CE1-CD2 4.35Å; F67-F251 AromaticContact CE1-CE2 3.83Å; F67-F251 HydrophobicContact CE1-CE2 3.83Å; F67-F251 AromaticContact CZ-CD2 3.84Å; F67-F251 HydrophobicContact CZ-CD2 3.84Å; F67-F251 AromaticContact CZ-CE2 3.69Å; F67-F251 HydrophobicContact CZ-CE2 3.69Å; F67-Y287 HydrophobicContact CD1-CD1 4.35Å; F67-Y287 HydrophobicContact CD1-CG 4.09Å; F67-Y287 AromaticContact CD2-CD1 3.48Å; F67-Y287 HydrophobicContact CD2-CD1 3.48Å; F67-Y287 VanDerWaalsContact CD2-CD1 3.48Å; F67-Y287 AromaticContact CD2-CE1 3.94Å; F67-Y287 HydrophobicContact CD2-CE1 3.94Å; F67-Y287 AromaticContact CD2-CG 4Å; F67-Y287 HydrophobicContact CD2-CG 4Å; F67-Y287 HydrophobicContact CE1-CD1 4.15Å; F67-Y287 AromaticContact CE1-CD2 3.96Å; F67-Y287 HydrophobicContact CE1-CD2 3.96Å; F67-Y287 AromaticContact CE1-CG 3.64Å; F67-Y287 HydrophobicContact CE1-CG 3.64Å; F67-Y287 AromaticContact CE2-CD1 3.23Å; F67-Y287 HydrophobicContact CE2-CD1 3.23Å; F67-Y287 AromaticContact CE2-CD2 3.92Å; F67-Y287 HydrophobicContact CE2-CD2 3.92Å; F67-Y287 AromaticContact CE2-CE1 3.41Å; F67-Y287 HydrophobicContact CE2-CE1 3.41Å; F67-Y287 VanDerWaalsContact CE2-CE1 3.41Å; F67-Y287 AromaticContact CE2-CE2 3.98Å; F67-Y287 HydrophobicContact CE2-CE2 3.98Å; F67-Y287 AromaticContact CE2-CG 3.54Å; F67-Y287 HydrophobicContact CE2-CG 3.54Å; F67-Y287 AromaticContact CE2-CZ 3.75Å; F67-Y287 HydrophobicContact CG-CD1 4.04Å; F67-Y287 HydrophobicContact CG-CG 4.25Å; F67-Y287 AromaticContact CZ-CD1 3.61Å; F67-Y287 HydrophobicContact CZ-CD1 3.61Å; F67-Y287 AromaticContact CZ-CD2 3.43Å; F67-Y287 HydrophobicContact CZ-CD2 3.43Å; F67-Y287 VanDerWaalsContact CZ-CD2 3.43Å; F67-Y287 AromaticContact CZ-CE1 3.99Å; F67-Y287 HydrophobicContact CZ-CE1 3.99Å; F67-Y287 AromaticContact CZ-CE2 3.74Å; F67-Y287 HydrophobicContact CZ-CE2 3.74Å; F67-Y287 AromaticContact CZ-CG 3.34Å; F67-Y287 HydrophobicContact CZ-CG 3.34Å |
| 68 | P | 94.8 | Very high | 89.2 | Confident | 0 Ų | 0 | 16.1 Ų | 16.1 | 0% | 0 | 10% | 0.096 | C | C | . | . | H | α-helix | trans | -57.4 | -45.2 | 173.4 | -31.5 | 41.5 | 0 | 0 | 0 | 113 | F71 S72 T290 V302 V306 | P68-F71 PolarHBondContact O-N 2.94Å; P68-S72 PolarHBondContact O-N 3.46Å; P68-T290 HydrophobicContact CG-CG2 4.26Å; P68-T290 WeakPolarHBondContact CG-O 3.24Å; P68-V302 HydrophobicContact CB-CG1 4.48Å; P68-V302 HydrophobicContact CB-CG2 3.67Å; P68-V306 HydrophobicContact CB-CB 4.32Å; P68-V306 HydrophobicContact CB-CG2 4.11Å; P68-V306 HydrophobicContact CG-CB 3.85Å; P68-V306 HydrophobicContact CG-CG1 4.33Å; P68-V306 HydrophobicContact CG-CG2 3.78Å |
| 69 | A | 92.4 | Very high | 89.5 | Confident | 2 Ų | 2 | 15.5 Ų | 15.5 | 2% | 0.017 | 9% | 0.091 | C | C | . | . | H | α-helix | trans | -65.1 | -38 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | N66 F67 F71 S72 M73 V302 | N66-A69 PolarHBondContact O-N 2.91Å; F67-A69 VanDerWaalsContact C-N 3.34Å; F67-A69 PolarHBondContact O-N 3.44Å; A69-F71 VanDerWaalsContact C-N 3.3Å; A69-F71 PolarHBondContact O-N 3.28Å; A69-S72 WeakPolarHBondContact O-CB 3.48Å; A69-S72 PolarHBondContact O-N 3.5Å; A69-M73 WeakPolarHBondContact O-CB 3.32Å; A69-M73 WeakPolarHBondContact O-CG 3.36Å; A69-M73 PolarHBondContact O-N 3.41Å; A69-V302 HydrophobicContact CB-CG1 4.12Å |
| 70 | A | 92.9 | Very high | 89.6 | Confident | 1 Ų | 1 | 15.3 Ų | 15.3 | 1% | 0.008 | 9% | 0.089 | C | C | . | . | H | α-helix | trans | -62.2 | -37.5 | 173.5 | 0 | 0 | 0 | 0 | 0 | 112.2 | N66 F67 M73 A74 A243 T246 I247 | N66-A70 PolarHBondContact O-N 3.01Å; F67-A70 WeakPolarHBondContact O-CB 3.39Å; F67-A70 PolarHBondContact O-N 2.75Å; A70-M73 HydrophobicContact CB-CE 4.48Å; A70-M73 PolarHBondContact O-N 2.83Å; A70-A74 VanDerWaalsContact O-CB 3.31Å; A70-A74 WeakPolarHBondContact O-CB 3.32Å; A70-A74 PolarHBondContact O-N 3.12Å; A70-A243 VanDerWaalsContact O-CB 3.29Å; A70-A243 WeakPolarHBondContact O-CB 3.44Å; A70-T246 HydrophobicContact CB-CG2 3.89Å; A70-I247 HydrophobicContact CB-CG1 4.26Å |
| 71 | F | 93.3 | Very high | 90.1 | Very high | 0 Ų | 0 | 17 Ų | 17 | 0% | 0 | 10% | 0.1 | C | C | . | . | H | α-helix | trans | -71.2 | -38.4 | 177.9 | -78.9 | 25.9 | 0 | 0 | 0 | 111 | F67 P68 A69 A74 G75 G76 V81 V292 F295 | F67-F71 HydrophobicContact CD1-CE1 4.26Å; F67-F71 VanDerWaalsContact O-CD1 3.29Å; F67-F71 WeakPolarHBondContact O-CD1 3.33Å; F67-F71 PolarHBondContact O-N 3.07Å; P68-F71 PolarHBondContact O-N 2.94Å; A69-F71 VanDerWaalsContact C-N 3.3Å; A69-F71 PolarHBondContact O-N 3.28Å; F71-A74 PolarHBondContact O-N 3.26Å; F71-G75 PolarHBondContact O-N 3.33Å; F71-G76 WeakPolarHBondContact O-CA 3.26Å; F71-G76 PolarHBondContact O-N 3Å; F71-V81 HydrophobicContact CE2-CG2 3.8Å; F71-V81 HydrophobicContact CZ-CG2 4.03Å; F71-V292 HydrophobicContact CE2-CG2 3.86Å; F71-F295 HydrophobicContact CB-CB 4.07Å; F71-F295 HydrophobicContact CB-CD2 4.31Å; F71-F295 HydrophobicContact CB-CG 4.12Å |
| 72 | S | 90.9 | Very high | 91 | Very high | 19 Ų | 19 | 23 Ų | 23 | 13% | 0.133 | 13% | 0.127 | C | C | . | . | H | α-helix | trans | -58 | -51.4 | 169.8 | 178.8 | 0 | 0 | 0 | 0 | 111.2 | P68 A69 A74 G75 S300 | P68-S72 PolarHBondContact O-N 3.46Å; A69-S72 WeakPolarHBondContact O-CB 3.48Å; A69-S72 PolarHBondContact O-N 3.5Å; S72-A74 VanDerWaalsContact C-N 3.28Å; S72-A74 PolarHBondContact O-N 3.44Å; S72-G75 PolarHBondContact O-N 2.9Å; S72-G75 VanDerWaalsContact O-N 3.08Å; S72-S300 WeakPolarHBondContact OG-CA 3.38Å |
| 73 | M | 89.1 | Confident | 91.7 | Very high | 58 Ų | 58 | 23.3 Ų | 23.3 | 29% | 0.286 | 13% | 0.129 | S | C | . | . | H | α-helix | trans | -61.2 | -34 | 177.3 | -72.1 | -173.1 | -68.6 | 0 | 0 | 113.1 | A69 A70 G75 A239 A243 | A69-M73 WeakPolarHBondContact O-CB 3.32Å; A69-M73 WeakPolarHBondContact O-CG 3.36Å; A69-M73 PolarHBondContact O-N 3.41Å; A70-M73 HydrophobicContact CB-CE 4.48Å; A70-M73 PolarHBondContact O-N 2.83Å; M73-G75 PolarHBondContact O-N 2.79Å; M73-A239 CarbonylContact O-C 3.56Å; M73-A239 VanDerWaalsContact O-CB 3.28Å; M73-A239 WeakPolarHBondContact O-CB 3.45Å; M73-A243 HydrophobicContact CB-CB 4.11Å |
| 74 | A | 90.2 | Very high | 92.2 | Very high | 0 Ų | 0 | 23.2 Ų | 23.2 | 0% | 0 | 13% | 0.127 | C | C | . | . | H | α-helix | trans | -73.5 | -11.2 | 178.8 | 0 | 0 | 0 | 0 | 0 | 113.7 | A70 F71 S72 A79 A243 | A70-A74 VanDerWaalsContact O-CB 3.31Å; A70-A74 WeakPolarHBondContact O-CB 3.32Å; A70-A74 PolarHBondContact O-N 3.12Å; F71-A74 PolarHBondContact O-N 3.26Å; S72-A74 VanDerWaalsContact C-N 3.28Å; S72-A74 PolarHBondContact O-N 3.44Å; A74-A79 HydrophobicContact CB-CB 4.17Å; A74-A79 VanDerWaalsContact O-CB 3.26Å; A74-A79 WeakPolarHBondContact O-CB 3.41Å; A74-A243 HydrophobicContact CB-CB 3.86Å |
| 75 | G | 87.4 | Confident | 92.4 | Very high | 10 Ų | 10 | 27.2 Ų | 27.2 | 10% | 0.103 | 15% | 0.147 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 91.5 | 24.6 | -175.3 | 0 | 0 | 0 | 0 | 0 | 114.1 | F71 S72 M73 T233 | F71-G75 PolarHBondContact O-N 3.33Å; S72-G75 PolarHBondContact O-N 2.9Å; S72-G75 VanDerWaalsContact O-N 3.08Å; M73-G75 PolarHBondContact O-N 2.79Å; G75-T233 VanDerWaalsContact CA-O 3.22Å; G75-T233 WeakPolarHBondContact CA-O 3.43Å |
| 76 | G | 89.4 | Confident | 92.5 | Very high | 4 Ų | 4 | 31.5 Ų | 31.5 | 4% | 0.041 | 17% | 0.166 | C | C | . | . | S | Bend | trans | 117.5 | -179.6 | 169.1 | 0 | 0 | 0 | 0 | 0 | 115.3 | F71 M78 A79 G80 | F71-G76 WeakPolarHBondContact O-CA 3.26Å; F71-G76 PolarHBondContact O-N 3Å; G76-M78 PolarHBondContact O-N 3.44Å; G76-A79 PolarHBondContact O-N 3.37Å; G76-G80 PolarHBondContact O-N 3.3Å |
| 77 | V | 91.1 | Very high | 92.5 | Very high | 38 Ų | 38 | 31.5 Ų | 31.5 | 23% | 0.23 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -54.5 | -49.3 | -173.4 | 174.5 | 0 | 0 | 0 | 0 | 113.1 | A79 G80 V81 V292 F295 L296 | V77-A79 PolarHBondContact O-N 3.19Å; V77-G80 PolarHBondContact O-N 3.12Å; V77-V81 HydrophobicContact CG1-CG2 4.13Å; V77-V81 WeakPolarHBondContact O-CB 3.43Å; V77-V81 WeakPolarHBondContact O-CG2 3.32Å; V77-V81 PolarHBondContact O-N 3.17Å; V77-V292 HydrophobicContact CG1-CG1 4.14Å; V77-V292 HydrophobicContact CG1-CG2 3.85Å; V77-V292 HydrophobicContact CG2-CG1 4.41Å; V77-F295 HydrophobicContact CG2-CD1 3.48Å; V77-F295 VanDerWaalsContact CG2-CD1 3.48Å; V77-F295 HydrophobicContact CG2-CE1 4.03Å; V77-F295 HydrophobicContact CG2-CG 4.49Å; V77-L296 HydrophobicContact CG2-CD2 3.87Å; V77-L296 HydrophobicContact CG2-CG 4Å |
| 78 | M | 91.3 | Very high | 92.5 | Very high | 157 Ų | 157 | 32.2 Ų | 32.2 | 77% | 0.773 | 17% | 0.17 | S | C | * | . | H | α-helix | trans | -64.5 | -43.1 | -174.7 | -175.4 | 132.8 | 60.3 | 0 | 0 | 111.7 | G76 M82 | G76-M78 PolarHBondContact O-N 3.44Å; M78-M82 WeakPolarHBondContact O-CB 3.27Å; M78-M82 WeakPolarHBondContact O-CG 3.48Å; M78-M82 PolarHBondContact O-N 2.89Å |
| 79 | A | 92 | Very high | 92.5 | Very high | 20 Ų | 20 | 37.2 Ų | 37.2 | 17% | 0.165 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -65.2 | -44.5 | 176.1 | 0 | 0 | 0 | 0 | 0 | 111.4 | A74 G76 V77 M82 L83 A235 V240 | A74-A79 HydrophobicContact CB-CB 4.17Å; A74-A79 VanDerWaalsContact O-CB 3.26Å; A74-A79 WeakPolarHBondContact O-CB 3.41Å; G76-A79 PolarHBondContact O-N 3.37Å; V77-A79 PolarHBondContact O-N 3.19Å; A79-M82 PolarHBondContact O-N 3.4Å; A79-L83 WeakPolarHBondContact O-CB 3.22Å; A79-L83 PolarHBondContact O-N 2.98Å; A79-A235 HydrophobicContact CB-CB 4.25Å; A79-V240 HydrophobicContact CB-CG2 4.36Å |
| 80 | G | 92.9 | Very high | 92.7 | Very high | 0 Ų | 0 | 37.9 Ų | 37.9 | 0% | 0 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -60.1 | -48.5 | 177.5 | 0 | 0 | 0 | 0 | 0 | 113.4 | G76 V77 L83 Q84 | G76-G80 PolarHBondContact O-N 3.3Å; V77-G80 PolarHBondContact O-N 3.12Å; G80-L83 PolarHBondContact O-N 3.32Å; G80-Q84 WeakPolarHBondContact O-CB 3.4Å; G80-Q84 PolarHBondContact O-N 2.89Å |
| 81 | V | 94.8 | Very high | 92.8 | Very high | 36 Ų | 36 | 37.9 Ų | 37.9 | 22% | 0.218 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -65.5 | -45.3 | 178.7 | 173.2 | 0 | 0 | 0 | 0 | 111.3 | F71 V77 L83 Q84 M85 I288 V292 | F71-V81 HydrophobicContact CE2-CG2 3.8Å; F71-V81 HydrophobicContact CZ-CG2 4.03Å; V77-V81 HydrophobicContact CG1-CG2 4.13Å; V77-V81 WeakPolarHBondContact O-CB 3.43Å; V77-V81 WeakPolarHBondContact O-CG2 3.32Å; V77-V81 PolarHBondContact O-N 3.17Å; V81-L83 VanDerWaalsContact C-N 3.32Å; V81-L83 PolarHBondContact O-N 3.43Å; V81-Q84 PolarHBondContact O-N 2.77Å; V81-M85 HydrophobicContact CG1-CG 4.36Å; V81-M85 VanDerWaalsContact O-CG 3.31Å; V81-M85 WeakPolarHBondContact O-CG 3.45Å; V81-M85 PolarHBondContact O-N 2.81Å; V81-I288 HydrophobicContact CG1-CD1 4.35Å; V81-V292 HydrophobicContact CG2-CG2 4.04Å |
| 82 | M | 94.1 | Very high | 93 | Very high | 133 Ų | 133 | 39.7 Ų | 39.7 | 66% | 0.655 | 21% | 0.207 | S | C | * | . | H | α-helix | trans | -62 | -42.5 | 177.7 | -73 | -65.8 | -118.6 | 0 | 0 | 111.6 | M78 A79 M85 F86 | M78-M82 WeakPolarHBondContact O-CB 3.27Å; M78-M82 WeakPolarHBondContact O-CG 3.48Å; M78-M82 PolarHBondContact O-N 2.89Å; A79-M82 PolarHBondContact O-N 3.4Å; M82-M85 PolarHBondContact O-N 2.72Å; M82-F86 WeakPolarHBondContact O-CB 3.44Å; M82-F86 PolarHBondContact O-N 3.44Å |
| 83 | L | 93.6 | Very high | 93.2 | Very high | 8 Ų | 8 | 40.2 Ų | 40.2 | 4% | 0.042 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -60.8 | -46.7 | 175.6 | 175.4 | 57.9 | 0 | 0 | 0 | 111.2 | A79 G80 V81 M85 F86 M87 V240 A243 M244 I247 | A79-L83 WeakPolarHBondContact O-CB 3.22Å; A79-L83 PolarHBondContact O-N 2.98Å; G80-L83 PolarHBondContact O-N 3.32Å; V81-L83 VanDerWaalsContact C-N 3.32Å; V81-L83 PolarHBondContact O-N 3.43Å; L83-M85 PolarHBondContact O-N 3.33Å; L83-F86 PolarHBondContact O-N 3.02Å; L83-M87 HydrophobicContact CD1-CE 4.1Å; L83-M87 HydrophobicContact CD1-CG 3.88Å; L83-M87 HydrophobicContact CD1-SD 4.44Å; L83-M87 HydrophobicContact CG-CG 4.32Å; L83-M87 WeakPolarHBondContact O-CB 3.35Å; L83-M87 WeakPolarHBondContact O-CG 3.24Å; L83-M87 PolarHBondContact O-N 3.24Å; L83-V240 HydrophobicContact CB-CG1 4.39Å; L83-V240 HydrophobicContact CD1-CG1 4.06Å; L83-V240 HydrophobicContact CD2-CG1 3.96Å; L83-V240 WeakPolarHBondContact CD2-O 3.4Å; L83-V240 HydrophobicContact CG-CG1 4.36Å; L83-A243 HydrophobicContact CD2-CB 4.14Å; L83-M244 HydrophobicContact CD1-CE 3.43Å; L83-M244 VanDerWaalsContact CD1-CE 3.43Å; L83-M244 HydrophobicContact CD1-CG 3.77Å; L83-M244 HydrophobicContact CD1-SD 4.28Å; L83-M244 HydrophobicContact CD2-CG 3.95Å; L83-M244 HydrophobicContact CG-CG 4.43Å; L83-I247 HydrophobicContact CB-CD1 4.37Å; L83-I247 HydrophobicContact CD2-CD1 3.48Å; L83-I247 VanDerWaalsContact CD2-CD1 3.48Å; L83-I247 HydrophobicContact CG-CD1 3.68Å |
| 84 | Q | 94.3 | Very high | 93.6 | Very high | 0 Ų | 0 | 37.4 Ų | 37.4 | 0% | 0 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -60.7 | -46 | 178.5 | -175.1 | 173 | 11.6 | 0 | 0 | 112.2 | G80 V81 F86 M87 L88 F251 L284 I288 | G80-Q84 WeakPolarHBondContact O-CB 3.4Å; G80-Q84 PolarHBondContact O-N 2.89Å; V81-Q84 PolarHBondContact O-N 2.77Å; Q84-F86 VanDerWaalsContact C-N 3.33Å; Q84-F86 PolarHBondContact O-N 2.62Å; Q84-M87 PolarHBondContact O-N 3Å; Q84-L88 WeakPolarHBondContact O-CB 3.4Å; Q84-L88 PolarHBondContact O-N 3.19Å; Q84-F251 HydrophobicContact CG-CE2 3.77Å; Q84-F251 HydrophobicContact CG-CZ 4.02Å; Q84-F251 VanDerWaalsContact NE2-CZ 3.34Å; Q84-L284 HydrophobicContact CG-CD1 3.9Å; Q84-I288 VanDerWaalsContact OE1-CG1 3.28Å |
| 85 | M | 95.1 | Very high | 93.9 | Very high | 85 Ų | 85 | 37.4 Ų | 37.4 | 42% | 0.419 | 20% | 0.197 | S | C | . | . | H | α-helix | trans | -61.6 | -41.5 | 177.2 | -70.3 | -57.5 | -63.9 | 0 | 0 | 111.9 | V81 M82 L83 L88 L284 | V81-M85 HydrophobicContact CG1-CG 4.36Å; V81-M85 VanDerWaalsContact O-CG 3.31Å; V81-M85 WeakPolarHBondContact O-CG 3.45Å; V81-M85 PolarHBondContact O-N 2.81Å; M82-M85 PolarHBondContact O-N 2.72Å; L83-M85 PolarHBondContact O-N 3.33Å; M85-L88 PolarHBondContact O-N 3.18Å; M85-L284 HydrophobicContact SD-CD1 3.88Å; M85-L284 HydrophobicContact SD-CD2 3.82Å; M85-L284 HydrophobicContact SD-CG 4.44Å |
| 86 | F | 94.3 | Very high | 94.4 | Very high | 90 Ų | 90 | 39 Ų | 39 | 40% | 0.395 | 21% | 0.205 | S | C | . | . | H | α-helix | trans | -63.7 | -47.7 | 176.1 | 174.4 | -105.9 | 0 | 0 | 0 | 111.9 | M82 L83 Q84 L88 I89 F90 L438 | M82-F86 WeakPolarHBondContact O-CB 3.44Å; M82-F86 PolarHBondContact O-N 3.44Å; L83-F86 PolarHBondContact O-N 3.02Å; Q84-F86 VanDerWaalsContact C-N 3.33Å; Q84-F86 PolarHBondContact O-N 2.62Å; F86-L88 VanDerWaalsContact C-N 3.29Å; F86-L88 PolarHBondContact O-N 3.24Å; F86-I89 PolarHBondContact O-N 3.22Å; F86-F90 HydrophobicContact CD1-CE2 4.37Å; F86-F90 HydrophobicContact CD2-CE2 4.18Å; F86-F90 HydrophobicContact CE1-CD2 4.49Å; F86-F90 AromaticContact CE1-CE2 3.86Å; F86-F90 HydrophobicContact CE1-CE2 3.86Å; F86-F90 AromaticContact CE2-CE2 3.65Å; F86-F90 HydrophobicContact CE2-CE2 3.65Å; F86-F90 HydrophobicContact CE2-CZ 4.24Å; F86-F90 HydrophobicContact CZ-CD2 4.48Å; F86-F90 AromaticContact CZ-CE2 3.47Å; F86-F90 HydrophobicContact CZ-CE2 3.47Å; F86-F90 VanDerWaalsContact CZ-CE2 3.47Å; F86-F90 HydrophobicContact CZ-CZ 4.08Å; F86-F90 WeakPolarHBondContact O-CD2 3.5Å; F86-L438 HydrophobicContact CE1-CD2 3.92Å; F86-L438 HydrophobicContact CZ-CD2 4.08Å |
| 87 | M | 94.2 | Very high | 94.7 | Very high | 1 Ų | 1 | 39.6 Ų | 39.6 | 1% | 0.005 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -62.9 | -35.6 | 178.3 | -65.7 | -78.6 | 113.6 | 0 | 0 | 111.9 | L83 Q84 I89 F90 I91 M244 I247 F403 L438 I442 | L83-M87 HydrophobicContact CD1-CE 4.1Å; L83-M87 HydrophobicContact CD1-CG 3.88Å; L83-M87 HydrophobicContact CD1-SD 4.44Å; L83-M87 HydrophobicContact CG-CG 4.32Å; L83-M87 WeakPolarHBondContact O-CB 3.35Å; L83-M87 WeakPolarHBondContact O-CG 3.24Å; L83-M87 PolarHBondContact O-N 3.24Å; Q84-M87 PolarHBondContact O-N 3Å; M87-I89 VanDerWaalsContact C-N 3.26Å; M87-I89 PolarHBondContact O-N 3.38Å; M87-F90 PolarHBondContact O-N 3.4Å; M87-F90 VanDerWaalsContact O-N 3.08Å; M87-I91 HydrophobicContact CB-CD1 4.15Å; M87-I91 WeakPolarHBondContact O-CD1 3.31Å; M87-I91 WeakPolarHBondContact O-CG1 3.06Å; M87-I91 PolarHBondContact O-N 3.49Å; M87-M244 HydrophobicContact CE-CE 3.86Å; M87-M244 HydrophobicContact CE-SD 3.84Å; M87-M244 HydrophobicContact SD-CG 4.49Å; M87-M244 HydrophobicContact SD-SD 4.39Å; M87-I247 HydrophobicContact CB-CG2 4.4Å; M87-I247 HydrophobicContact CG-CG2 4.37Å; M87-F403 HydrophobicContact CE-CE1 4.47Å; M87-F403 HydrophobicContact CE-CZ 4.01Å; M87-F403 HydrophobicContact SD-CE1 4.44Å; M87-F403 HydrophobicContact SD-CE2 4.1Å; M87-F403 HydrophobicContact SD-CZ 3.48Å; M87-F403 WeakPolarHBondContact SD-CZ 3.23Å; M87-L438 HydrophobicContact CE-CD2 4.26Å; M87-I442 HydrophobicContact CE-CD1 4.28Å |
| 88 | L | 94.8 | Very high | 94.9 | Very high | 15 Ų | 15 | 37.8 Ų | 37.8 | 8% | 0.079 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -58.4 | -36.4 | -177.8 | -166 | 69.1 | 0 | 0 | 0 | 112.9 | Q84 M85 F86 F90 I91 I92 F251 M280 L284 | Q84-L88 WeakPolarHBondContact O-CB 3.4Å; Q84-L88 PolarHBondContact O-N 3.19Å; M85-L88 PolarHBondContact O-N 3.18Å; F86-L88 VanDerWaalsContact C-N 3.29Å; F86-L88 PolarHBondContact O-N 3.24Å; L88-F90 VanDerWaalsContact C-N 3.31Å; L88-F90 PolarHBondContact O-N 2.96Å; L88-I91 PolarHBondContact O-N 3.43Å; L88-I92 HydrophobicContact CD1-CD1 4.49Å; L88-I92 HydrophobicContact CD2-CD1 4.44Å; L88-I92 HydrophobicContact CG-CD1 3.97Å; L88-I92 HydrophobicContact CG-CG1 4.48Å; L88-I92 WeakPolarHBondContact O-CG1 3.28Å; L88-I92 PolarHBondContact O-N 2.89Å; L88-F251 HydrophobicContact CD1-CD1 4.46Å; L88-F251 HydrophobicContact CD1-CE1 3.78Å; L88-F251 HydrophobicContact CD1-CZ 4.15Å; L88-M280 HydrophobicContact CD1-CB 3.94Å; L88-L284 HydrophobicContact CD2-CB 4.38Å; L88-L284 HydrophobicContact CD2-CD1 4.13Å; L88-L284 HydrophobicContact CD2-CD2 3.82Å; L88-L284 HydrophobicContact CD2-CG 4.33Å |
| 89 | I | 94.9 | Very high | 95 | Very high | 104 Ų | 104 | 30.3 Ų | 30.3 | 53% | 0.533 | 16% | 0.159 | S | C | . | . | H | α-helix | trans | -58.7 | -46.6 | 177.2 | -61.5 | 170.2 | 0 | 0 | 0 | 109.9 | F86 M87 S93 | F86-I89 PolarHBondContact O-N 3.22Å; M87-I89 VanDerWaalsContact C-N 3.26Å; M87-I89 PolarHBondContact O-N 3.38Å; I89-S93 VanDerWaalsContact O-CB 3.25Å; I89-S93 WeakPolarHBondContact O-CB 3.25Å; I89-S93 PolarHBondContact O-N 3.47Å; I89-S93 PolarHBondContact O-OG 3.18Å |
| 90 | F | 95.7 | Very high | 95.2 | Very high | 16 Ų | 16 | 33.9 Ų | 33.9 | 7% | 0.07 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -74.4 | -35.6 | -179.6 | -63.5 | -74.6 | 0 | 0 | 0 | 112.7 | F86 M87 L88 S93 G94 F403 L431 T434 M435 L438 | F86-F90 HydrophobicContact CD1-CE2 4.37Å; F86-F90 HydrophobicContact CD2-CE2 4.18Å; F86-F90 HydrophobicContact CE1-CD2 4.49Å; F86-F90 AromaticContact CE1-CE2 3.86Å; F86-F90 HydrophobicContact CE1-CE2 3.86Å; F86-F90 AromaticContact CE2-CE2 3.65Å; F86-F90 HydrophobicContact CE2-CE2 3.65Å; F86-F90 HydrophobicContact CE2-CZ 4.24Å; F86-F90 HydrophobicContact CZ-CD2 4.48Å; F86-F90 AromaticContact CZ-CE2 3.47Å; F86-F90 HydrophobicContact CZ-CE2 3.47Å; F86-F90 VanDerWaalsContact CZ-CE2 3.47Å; F86-F90 HydrophobicContact CZ-CZ 4.08Å; F86-F90 WeakPolarHBondContact O-CD2 3.5Å; M87-F90 PolarHBondContact O-N 3.4Å; M87-F90 VanDerWaalsContact O-N 3.08Å; L88-F90 VanDerWaalsContact C-N 3.31Å; L88-F90 PolarHBondContact O-N 2.96Å; F90-S93 PolarHBondContact O-N 3.33Å; F90-G94 PolarHBondContact O-N 3.44Å; F90-F403 HydrophobicContact CB-CD1 3.8Å; F90-F403 HydrophobicContact CB-CE1 3.24Å; F90-F403 HydrophobicContact CB-CZ 3.99Å; F90-F403 HydrophobicContact CD1-CD1 4.34Å; F90-F403 HydrophobicContact CD1-CE1 4.2Å; F90-F403 AromaticContact CD2-CE1 3.73Å; F90-F403 HydrophobicContact CD2-CE1 3.73Å; F90-F403 HydrophobicContact CG-CD1 4.02Å; F90-F403 AromaticContact CG-CE1 3.47Å; F90-F403 HydrophobicContact CG-CE1 3.47Å; F90-F403 VanDerWaalsContact CG-CE1 3.47Å; F90-F403 HydrophobicContact CG-CZ 4.48Å; F90-L431 HydrophobicContact CD1-CD1 4.5Å; F90-L431 HydrophobicContact CE1-CD1 4.2Å; F90-T434 HydrophobicContact CE1-CG2 4.35Å; F90-T434 HydrophobicContact CZ-CG2 4.39Å; F90-M435 HydrophobicContact CB-CE 4.33Å; F90-M435 HydrophobicContact CD1-CE 4.42Å; F90-M435 HydrophobicContact CD1-CG 3.59Å; F90-M435 HydrophobicContact CD1-SD 4.34Å; F90-M435 HydrophobicContact CE1-CG 4.01Å; F90-L438 HydrophobicContact CD2-CD2 4.3Å; F90-L438 HydrophobicContact CE2-CD2 3.95Å; F90-L438 HydrophobicContact CZ-CD2 4.12Å |
| 91 | I | 96.2 | Very high | 95.2 | Very high | 2 Ų | 2 | 34 Ų | 34 | 1% | 0.01 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -58.4 | -54 | 174.5 | -73.3 | 157.7 | 0 | 0 | 0 | 110.5 | M87 L88 S93 G94 L95 F251 H254 M280 I402 | M87-I91 HydrophobicContact CB-CD1 4.15Å; M87-I91 WeakPolarHBondContact O-CD1 3.31Å; M87-I91 WeakPolarHBondContact O-CG1 3.06Å; M87-I91 PolarHBondContact O-N 3.49Å; L88-I91 PolarHBondContact O-N 3.43Å; I91-S93 VanDerWaalsContact C-N 3.34Å; I91-S93 PolarHBondContact O-N 3.05Å; I91-G94 PolarHBondContact O-N 3.35Å; I91-L95 HydrophobicContact CG2-CD1 4.12Å; I91-L95 WeakPolarHBondContact O-CG 3.31Å; I91-L95 PolarHBondContact O-N 3.45Å; I91-L95 VanDerWaalsContact O-N 3.07Å; I91-F251 HydrophobicContact CD1-CB 3.4Å; I91-F251 VanDerWaalsContact CD1-CB 3.4Å; I91-F251 HydrophobicContact CD1-CD1 4.01Å; I91-F251 HydrophobicContact CD1-CD2 3.98Å; I91-F251 HydrophobicContact CD1-CG 3.56Å; I91-F251 HydrophobicContact CG1-CB 4.21Å; I91-H254 PolarHBondContact O-NE2 3.46Å; I91-M280 HydrophobicContact CG2-CG 4.12Å; I91-M280 HydrophobicContact CG2-SD 3.49Å; I91-M280 WeakPolarHBondContact CG2-SD 3.44Å; I91-I402 HydrophobicContact CG1-CD1 4.43Å; I91-I402 HydrophobicContact CG1-CG2 3.7Å |
| 92 | I | 96.4 | Very high | 95 | Very high | 37 Ų | 37 | 32.3 Ų | 32.3 | 19% | 0.19 | 16% | 0.159 | C | C | . | . | H | α-helix | trans | -61.8 | -45.4 | 178.9 | -67.8 | 170.4 | 0 | 0 | 0 | 110 | L88 G94 L95 V96 V276 M280 | L88-I92 HydrophobicContact CD1-CD1 4.49Å; L88-I92 HydrophobicContact CD2-CD1 4.44Å; L88-I92 HydrophobicContact CG-CD1 3.97Å; L88-I92 HydrophobicContact CG-CG1 4.48Å; L88-I92 WeakPolarHBondContact O-CG1 3.28Å; L88-I92 PolarHBondContact O-N 2.89Å; I92-G94 PolarHBondContact O-N 2.95Å; I92-L95 PolarHBondContact O-N 3.23Å; I92-V96 HydrophobicContact CG2-CG2 4.48Å; I92-V96 WeakPolarHBondContact O-CG2 3.2Å; I92-V96 PolarHBondContact O-N 2.88Å; I92-V276 HydrophobicContact CG2-CG1 4.22Å; I92-M280 HydrophobicContact CD1-CB 3.98Å; I92-M280 HydrophobicContact CD1-CG 4.48Å; I92-M280 HydrophobicContact CG1-CB 3.75Å; I92-M280 HydrophobicContact CG1-CG 3.7Å |
| 93 | S | 96 | Very high | 94.9 | Very high | 30 Ų | 30 | 30.4 Ų | 30.4 | 21% | 0.21 | 15% | 0.149 | C | C | . | . | H | α-helix | trans | -58.8 | -48.2 | 178.7 | -61.9 | 0 | 0 | 0 | 0 | 111.5 | I89 F90 I91 L95 V96 I97 | I89-S93 VanDerWaalsContact O-CB 3.25Å; I89-S93 WeakPolarHBondContact O-CB 3.25Å; I89-S93 PolarHBondContact O-N 3.47Å; I89-S93 PolarHBondContact O-OG 3.18Å; F90-S93 PolarHBondContact O-N 3.33Å; I91-S93 VanDerWaalsContact C-N 3.34Å; I91-S93 PolarHBondContact O-N 3.05Å; S93-L95 PolarHBondContact O-N 3.33Å; S93-V96 PolarHBondContact O-N 3.02Å; S93-I97 WeakPolarHBondContact O-CB 3.46Å; S93-I97 VanDerWaalsContact O-CD1 3.3Å; S93-I97 WeakPolarHBondContact O-CD1 3.36Å; S93-I97 WeakPolarHBondContact O-CG1 3.45Å; S93-I97 PolarHBondContact O-N 2.93Å |
| 94 | G | 96.8 | Very high | 94.7 | Very high | 0 Ų | 0 | 32.8 Ų | 32.8 | 0% | 0 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -59.8 | -43.3 | 178.5 | 0 | 0 | 0 | 0 | 0 | 113 | F90 I91 I92 I97 L98 | F90-G94 PolarHBondContact O-N 3.44Å; I91-G94 PolarHBondContact O-N 3.35Å; I92-G94 PolarHBondContact O-N 2.95Å; G94-I97 PolarHBondContact O-N 3.34Å; G94-L98 WeakPolarHBondContact O-CB 3.29Å; G94-L98 WeakPolarHBondContact O-CD1 3.4Å; G94-L98 VanDerWaalsContact O-CG 3.27Å; G94-L98 WeakPolarHBondContact O-CG 3.35Å; G94-L98 PolarHBondContact O-N 3.34Å |
| 95 | L | 96.8 | Very high | 94.4 | Very high | 0 Ų | 0 | 34 Ų | 34 | 0% | 0 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -64.4 | -39.5 | 176.7 | -70.2 | 169 | 0 | 0 | 0 | 112.4 | I91 I92 S93 G99 H254 C257 W272 V276 M280 | I91-L95 HydrophobicContact CG2-CD1 4.12Å; I91-L95 WeakPolarHBondContact O-CG 3.31Å; I91-L95 PolarHBondContact O-N 3.45Å; I91-L95 VanDerWaalsContact O-N 3.07Å; I92-L95 PolarHBondContact O-N 3.23Å; S93-L95 PolarHBondContact O-N 3.33Å; L95-G99 PolarHBondContact O-N 3.37Å; L95-G99 VanDerWaalsContact O-N 3.14Å; L95-H254 HydrophobicContact CD2-CB 4.22Å; L95-C257 HydrophobicContact CD2-CB 3.46Å; L95-C257 VanDerWaalsContact CD2-CB 3.46Å; L95-W272 PolarHBondContact O-NE1 2.91Å; L95-V276 HydrophobicContact CB-CB 4.38Å; L95-V276 HydrophobicContact CB-CG1 3.55Å; L95-V276 HydrophobicContact CB-CG2 3.88Å; L95-V276 HydrophobicContact CD1-CG1 3.59Å; L95-V276 HydrophobicContact CD1-CG2 4.47Å; L95-V276 HydrophobicContact CG-CG1 4.21Å; L95-M280 HydrophobicContact CD1-CE 3.79Å; L95-M280 HydrophobicContact CD1-CG 4.12Å; L95-M280 HydrophobicContact CD1-SD 4.04Å |
| 96 | V | 96.8 | Very high | 94 | Very high | 43 Ų | 43 | 36.7 Ų | 36.7 | 26% | 0.261 | 19% | 0.194 | S | C | . | . | H | α-helix | trans | -69.4 | -43.3 | 176.4 | 172.6 | 0 | 0 | 0 | 0 | 111.1 | I92 S93 L98 G99 Y100 I269 V276 | I92-V96 HydrophobicContact CG2-CG2 4.48Å; I92-V96 WeakPolarHBondContact O-CG2 3.2Å; I92-V96 PolarHBondContact O-N 2.88Å; S93-V96 PolarHBondContact O-N 3.02Å; V96-L98 PolarHBondContact O-N 3.43Å; V96-G99 PolarHBondContact O-N 3.43Å; V96-Y100 PolarHBondContact O-N 3.35Å; V96-I269 HydrophobicContact CG1-CG2 4.32Å; V96-V276 HydrophobicContact CG2-CG1 4.49Å |
| 97 | I | 96.4 | Very high | 93.6 | Very high | 16 Ų | 16 | 35.5 Ų | 35.5 | 8% | 0.082 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -59.4 | -47.5 | 177.2 | -68.7 | 158.4 | 0 | 0 | 0 | 110.5 | S93 G94 G99 Y100 C101 P406 C409 L410 M435 | S93-I97 WeakPolarHBondContact O-CB 3.46Å; S93-I97 VanDerWaalsContact O-CD1 3.3Å; S93-I97 WeakPolarHBondContact O-CD1 3.36Å; S93-I97 WeakPolarHBondContact O-CG1 3.45Å; S93-I97 PolarHBondContact O-N 2.93Å; G94-I97 PolarHBondContact O-N 3.34Å; I97-G99 VanDerWaalsContact C-N 3.32Å; I97-G99 PolarHBondContact O-N 3.23Å; I97-Y100 WeakPolarHBondContact O-CB 3.36Å; I97-Y100 PolarHBondContact O-N 2.98Å; I97-Y100 VanDerWaalsContact O-N 3.13Å; I97-C101 PolarHBondContact O-N 3.45Å; I97-C101 PolarHBondContact O-SG 3.48Å; I97-C101 VanDerWaalsContact O-SG 3.38Å; I97-P406 HydrophobicContact CB-CB 4.47Å; I97-P406 HydrophobicContact CG2-CB 4.35Å; I97-P406 WeakPolarHBondContact CG2-O 3.25Å; I97-C409 HydrophobicContact CG2-CB 4.35Å; I97-L410 HydrophobicContact CD1-CB 4.1Å; I97-L410 HydrophobicContact CD1-CD2 3.72Å; I97-L410 HydrophobicContact CD1-CG 4.38Å; I97-L410 HydrophobicContact CG1-CB 4.37Å; I97-L410 HydrophobicContact CG1-CD1 4.38Å; I97-L410 HydrophobicContact CG1-CD2 4.28Å; I97-L410 HydrophobicContact CG2-CB 3.95Å; I97-M435 HydrophobicContact CD1-SD 3.92Å |
| 98 | L | 95.6 | Very high | 93 | Very high | 0 Ų | 0 | 36.5 Ų | 36.5 | 0% | 0 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -63.1 | -38.7 | 178.3 | -72.3 | 165.8 | 0 | 0 | 0 | 112.4 | G94 V96 Y100 C101 S102 Y110 H254 V258 P406 | G94-L98 WeakPolarHBondContact O-CB 3.29Å; G94-L98 WeakPolarHBondContact O-CD1 3.4Å; G94-L98 VanDerWaalsContact O-CG 3.27Å; G94-L98 WeakPolarHBondContact O-CG 3.35Å; G94-L98 PolarHBondContact O-N 3.34Å; V96-L98 PolarHBondContact O-N 3.43Å; L98-Y100 VanDerWaalsContact C-N 3.33Å; L98-C101 PolarHBondContact O-N 3.33Å; L98-S102 VanDerWaalsContact O-CB 3.23Å; L98-S102 WeakPolarHBondContact O-CB 3.4Å; L98-S102 PolarHBondContact O-N 3.02Å; L98-Y110 HydrophobicContact CD1-CD2 3.93Å; L98-Y110 HydrophobicContact CD1-CE2 3.31Å; L98-Y110 HydrophobicContact CD2-CD2 4.18Å; L98-Y110 HydrophobicContact CD2-CE2 3.8Å; L98-Y110 HydrophobicContact CG-CE2 4.2Å; L98-H254 HydrophobicContact CD1-CB 3.96Å; L98-V258 HydrophobicContact CB-CG2 4.13Å; L98-P406 HydrophobicContact CD1-CG 3.94Å; L98-P406 HydrophobicContact CD2-CG 4.36Å; L98-P406 HydrophobicContact CG-CB 4.3Å; L98-P406 HydrophobicContact CG-CG 4.04Å |
| 99 | G | 94.3 | Very high | 92.5 | Very high | 0 Ų | 0 | 36.7 Ų | 36.7 | 0% | 0 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -62.9 | -40.3 | 172.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | L95 V96 I97 Q103 I269 | L95-G99 PolarHBondContact O-N 3.37Å; L95-G99 VanDerWaalsContact O-N 3.14Å; V96-G99 PolarHBondContact O-N 3.43Å; I97-G99 VanDerWaalsContact C-N 3.32Å; I97-G99 PolarHBondContact O-N 3.23Å; G99-Q103 PolarHBondContact O-N 3.03Å; G99-I269 WeakPolarHBondContact O-CD1 3.41Å |
| 100 | Y | 94.9 | Very high | 92.3 | Very high | 96 Ų | 96 | 31.8 Ų | 31.8 | 38% | 0.376 | 18% | 0.175 | S | C | . | . | H | α-helix | trans | -63.2 | -50.8 | 174.3 | 175.3 | -97.2 | 0 | 0 | 0 | 112.1 | V96 I97 L98 S102 Q103 A104 I269 A413 | V96-Y100 PolarHBondContact O-N 3.35Å; I97-Y100 WeakPolarHBondContact O-CB 3.36Å; I97-Y100 PolarHBondContact O-N 2.98Å; I97-Y100 VanDerWaalsContact O-N 3.13Å; L98-Y100 VanDerWaalsContact C-N 3.33Å; Y100-S102 VanDerWaalsContact C-N 3.32Å; Y100-S102 PolarHBondContact O-N 3.33Å; Y100-Q103 PolarHBondContact O-N 3.4Å; Y100-A104 WeakPolarHBondContact O-CB 3.47Å; Y100-A104 PolarHBondContact O-N 3.07Å; Y100-I269 HydrophobicContact CD2-CG1 4.36Å; Y100-A413 HydrophobicContact CE1-CB 4.43Å |
| 101 | C | 93.4 | Very high | 92 | Very high | 2 Ų | 2 | 31.9 Ų | 31.9 | 1% | 0.014 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -63.4 | -38.7 | 178.8 | -65.9 | 0 | 0 | 0 | 0 | 111.6 | I97 L98 Q103 A104 S105 V113 | I97-C101 PolarHBondContact O-N 3.45Å; I97-C101 PolarHBondContact O-SG 3.48Å; I97-C101 VanDerWaalsContact O-SG 3.38Å; L98-C101 PolarHBondContact O-N 3.33Å; C101-Q103 PolarHBondContact O-N 3.06Å; C101-A104 PolarHBondContact O-N 2.94Å; C101-S105 WeakPolarHBondContact O-CB 3.33Å; C101-S105 PolarHBondContact O-N 3.49Å; C101-S105 PolarHBondContact O-OG 3.31Å; C101-V113 HydrophobicContact CB-CG1 3.47Å; C101-V113 VanDerWaalsContact CB-CG1 3.47Å |
| 102 | S | 91.3 | Very high | 91.6 | Very high | 1 Ų | 1 | 32.6 Ų | 32.6 | 1% | 0.007 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -60 | -43.9 | 173 | 176.6 | 0 | 0 | 0 | 0 | 112.7 | L98 Y100 N106 E107 N262 | L98-S102 VanDerWaalsContact O-CB 3.23Å; L98-S102 WeakPolarHBondContact O-CB 3.4Å; L98-S102 PolarHBondContact O-N 3.02Å; Y100-S102 VanDerWaalsContact C-N 3.32Å; Y100-S102 PolarHBondContact O-N 3.33Å; S102-N106 WeakPolarHBondContact O-CA 3.38Å; S102-N106 PolarHBondContact O-N 3.01Å; S102-E107 PolarHBondContact O-N 3.08Å; S102-E107 PolarHBondContact OG-O 2.97Å; S102-N262 PolarHBondContact OG-ND2 3.44Å |
| 103 | Q | 92.2 | Very high | 91.3 | Very high | 93 Ų | 93 | 30.9 Ų | 30.9 | 44% | 0.435 | 17% | 0.17 | S | C | . | . | H | α-helix | trans | -66.4 | -39.1 | 175.6 | -170.4 | 177 | 21.2 | 0 | 0 | 112 | G99 Y100 C101 F261 K267 I269 | G99-Q103 PolarHBondContact O-N 3.03Å; Y100-Q103 PolarHBondContact O-N 3.4Å; C101-Q103 PolarHBondContact O-N 3.06Å; Q103-F261 HydrophobicContact CB-CE1 4.12Å; Q103-F261 HydrophobicContact CB-CZ 4.08Å; Q103-K267 PolarHBondContact NE2-O 2.93Å; Q103-I269 HydrophobicContact CB-CD1 4.21Å; Q103-I269 VanDerWaalsContact OE1-CD1 3.28Å |
| 104 | A | 89.4 | Confident | 91.3 | Very high | 57 Ų | 57 | 29.4 Ų | 29.4 | 47% | 0.471 | 16% | 0.16 | S | C | . | . | H | α-helix | trans | -73 | -38.3 | -177.7 | 0 | 0 | 0 | 0 | 0 | 113 | Y100 C101 | Y100-A104 WeakPolarHBondContact O-CB 3.47Å; Y100-A104 PolarHBondContact O-N 3.07Å; C101-A104 PolarHBondContact O-N 2.94Å |
| 105 | S | 87.8 | Confident | 91 | Very high | 27 Ų | 27 | 30.9 Ų | 30.9 | 19% | 0.189 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -89.1 | -9.9 | 179 | 73.8 | 0 | 0 | 0 | 0 | 113.4 | C101 E107 | C101-S105 WeakPolarHBondContact O-CB 3.33Å; C101-S105 PolarHBondContact O-N 3.49Å; C101-S105 PolarHBondContact O-OG 3.31Å; S105-E107 PolarHBondContact O-N 3.48Å; S105-E107 WeakPolarHBondContact OG-CB 3.36Å; S105-E107 WeakPolarHBondContact OG-CG 3.37Å; S105-E107 PolarHBondContact OG-N 2.76Å |
| 106 | N | 86.4 | Confident | 90.7 | Very high | 141 Ų | 141 | 33.8 Ų | 33.8 | 75% | 0.754 | 19% | 0.189 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 57.1 | 31.5 | -172.9 | -165 | 53.3 | 0 | 0 | 0 | 113.6 | S102 | S102-N106 WeakPolarHBondContact O-CA 3.38Å; S102-N106 PolarHBondContact O-N 3.01Å |
| 107 | E | 85.8 | Confident | 90.5 | Very high | 64 Ų | 64 | 33.3 Ų | 33.3 | 30% | 0.299 | 19% | 0.186 | S | C | . | . | trans | -102 | 142.5 | -179.1 | -69.1 | -63.8 | 168.4 | 0 | 0 | 112 | S102 S105 E112 V113 A116 N262 | S102-E107 PolarHBondContact O-N 3.08Å; S102-E107 PolarHBondContact OG-O 2.97Å; S105-E107 PolarHBondContact O-N 3.48Å; S105-E107 WeakPolarHBondContact OG-CB 3.36Å; S105-E107 WeakPolarHBondContact OG-CG 3.37Å; S105-E107 PolarHBondContact OG-N 2.76Å; E107-E112 HydrophobicContact CB-CB 4.11Å; E107-E112 HydrophobicContact CG-CB 4.09Å; E107-E112 WeakPolarHBondContact OE2-CB 3.35Å; E107-V113 HydrophobicContact CB-CG2 3.68Å; E107-A116 HydrophobicContact CG-CB 4.11Å; E107-N262 PolarHBondContact O-ND2 3.43Å | ||
| 108 | A | 81.3 | Confident | 90.3 | Very high | 22 Ų | 22 | 33.5 Ų | 33.5 | 18% | 0.182 | 19% | 0.189 | C | C | . | . | trans | -101.9 | -3.6 | -169.9 | 0 | 0 | 0 | 0 | 0 | 115.1 | N262 | A108-N262 HydrophobicContact CB-CB 4.45Š| ||
| 109 | T | 84.9 | Confident | 90.1 | Very high | 20 Ų | 20 | 35.1 Ų | 35.1 | 12% | 0.123 | 21% | 0.205 | C | C | . | . | S | Bend | trans | -131.9 | 154.2 | -179.7 | 66.6 | 0 | 0 | 0 | 0 | 111.6 | Q111 E112 V113 | T109-Q111 PolarHBondContact O-N 3.32Å; T109-Q111 PolarHBondContact OG1-NE2 2.91Å; T109-Q111 VanDerWaalsContact OG1-NE2 3.14Å; T109-E112 PolarHBondContact O-N 3.27Å; T109-E112 WeakPolarHBondContact OG1-CB 3.33Å; T109-E112 WeakPolarHBondContact OG1-CG 3.25Å; T109-V113 VanDerWaalsContact O-CG2 3.31Å; T109-V113 WeakPolarHBondContact O-CG2 3.47Å; T109-V113 PolarHBondContact O-N 3.39Å; T109-V113 VanDerWaalsContact O-N 3.08Å |
| 110 | Y | 89.3 | Confident | 89.8 | Confident | 1 Ų | 1 | 41 Ų | 41 | 0% | 0.004 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -56.8 | -50.9 | -176.1 | -172.9 | -75.2 | 0 | 0 | 0 | 112.3 | L98 E112 V113 V114 C126 I130 H254 V258 F401 F405 | L98-Y110 HydrophobicContact CD1-CD2 3.93Å; L98-Y110 HydrophobicContact CD1-CE2 3.31Å; L98-Y110 HydrophobicContact CD2-CD2 4.18Å; L98-Y110 HydrophobicContact CD2-CE2 3.8Å; L98-Y110 HydrophobicContact CG-CE2 4.2Å; Y110-E112 VanDerWaalsContact C-N 3.35Å; Y110-E112 PolarHBondContact O-N 2.91Å; Y110-V113 PolarHBondContact O-N 3Å; Y110-V114 HydrophobicContact CD1-CG2 3.96Å; Y110-V114 HydrophobicContact CE1-CG2 3.67Å; Y110-V114 WeakPolarHBondContact O-CG2 3.48Å; Y110-V114 PolarHBondContact O-N 3.49Å; Y110-V114 VanDerWaalsContact O-N 3.07Å; Y110-C126 WeakPolarHBondContact CD1-SG 3.17Å; Y110-C126 WeakPolarHBondContact CE1-SG 3.34Å; Y110-I130 HydrophobicContact CD1-CD1 3.74Å; Y110-I130 HydrophobicContact CE1-CD1 4.49Å; Y110-I130 HydrophobicContact CG-CD1 4.2Å; Y110-H254 WeakPolarHBondContact CD2-O 3.33Å; Y110-H254 HydrophobicContact CE2-CB 3.95Å; Y110-V258 HydrophobicContact CD2-CG2 4.46Å; Y110-F401 HydrophobicContact CE1-CD1 4.16Å; Y110-F401 VanDerWaalsContact OH-CA 3.25Å; Y110-F401 WeakPolarHBondContact OH-CA 3.25Å; Y110-F401 PolarHBondContact OH-O 3.41Å; Y110-F405 HydrophobicContact CE1-CB 4.13Å; Y110-F405 HydrophobicContact CE1-CD2 4.2Å; Y110-F405 HydrophobicContact CE1-CG 4.32Å; Y110-F405 VanDerWaalsContact OH-CB 3.29Å; Y110-F405 WeakPolarHBondContact OH-CB 3.3Å |
| 111 | Q | 89.8 | Confident | 89.6 | Confident | 18 Ų | 18 | 41.8 Ų | 41.8 | 8% | 0.084 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -63.9 | -37.6 | -177.1 | 61.3 | -79 | -0 | 0 | 0 | 113.2 | T109 V114 R115 E127 I130 V342 | T109-Q111 PolarHBondContact O-N 3.32Å; T109-Q111 PolarHBondContact OG1-NE2 2.91Å; T109-Q111 VanDerWaalsContact OG1-NE2 3.14Å; Q111-V114 PolarHBondContact O-N 2.87Å; Q111-R115 VanDerWaalsContact O-CB 3.28Å; Q111-R115 WeakPolarHBondContact O-CB 3.33Å; Q111-R115 PolarHBondContact O-N 3.21Å; Q111-E127 HydrophobicContact CB-CG 3.54Å; Q111-E127 HydrophobicContact CG-CG 3.76Å; Q111-I130 HydrophobicContact CB-CD1 4.29Å; Q111-V342 HydrophobicContact CG-CG2 4.36Å |
| 112 | E | 87.9 | Confident | 89.6 | Confident | 17 Ų | 17 | 43.2 Ų | 43.2 | 8% | 0.079 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -72.4 | -35.5 | 179.2 | -62.4 | -58.8 | 157.5 | 0 | 0 | 110.9 | G20 E107 T109 Y110 V114 R115 A116 R349 | G20-E112 VanDerWaalsContact CA-OE1 3.28Å; G20-E112 WeakPolarHBondContact CA-OE1 3.45Å; E107-E112 HydrophobicContact CB-CB 4.11Å; E107-E112 HydrophobicContact CG-CB 4.09Å; E107-E112 WeakPolarHBondContact OE2-CB 3.35Å; T109-E112 PolarHBondContact O-N 3.27Å; T109-E112 WeakPolarHBondContact OG1-CB 3.33Å; T109-E112 WeakPolarHBondContact OG1-CG 3.25Å; Y110-E112 VanDerWaalsContact C-N 3.35Å; Y110-E112 PolarHBondContact O-N 2.91Å; E112-V114 PolarHBondContact O-N 3.41Å; E112-R115 PolarHBondContact O-N 2.64Å; E112-R115 WeakPolarHBondContact OE2-CD 3.23Å; E112-A116 VanDerWaalsContact O-CB 3.26Å; E112-A116 WeakPolarHBondContact O-CB 3.29Å; E112-A116 PolarHBondContact O-N 3.02Å; E112-R349 IonicContact OE1-CZ 2.82Å; E112-R349 IonicContact OE1-NH2 3.04Å; E112-R349 PolarHBondContact OE1-NH2 3.1Å; E112-R349 IonicContact OE2-NH2 2.9Å; E112-R349 PolarHBondContact OE2-NH2 2.98Å |
| 113 | V | 91 | Very high | 89.5 | Confident | 0 Ų | 0 | 43.1 Ų | 43.1 | 0% | 0 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -59 | -48.1 | 170.8 | 172.7 | 0 | 0 | 0 | 0 | 111.3 | C101 E107 T109 Y110 R115 A116 T117 V258 | C101-V113 HydrophobicContact CB-CG1 3.47Å; C101-V113 VanDerWaalsContact CB-CG1 3.47Å; E107-V113 HydrophobicContact CB-CG2 3.68Å; T109-V113 VanDerWaalsContact O-CG2 3.31Å; T109-V113 WeakPolarHBondContact O-CG2 3.47Å; T109-V113 PolarHBondContact O-N 3.39Å; T109-V113 VanDerWaalsContact O-N 3.08Å; Y110-V113 PolarHBondContact O-N 3Å; V113-R115 VanDerWaalsContact C-N 3.32Å; V113-R115 PolarHBondContact O-N 3.49Å; V113-A116 PolarHBondContact O-N 3.44Å; V113-T117 WeakPolarHBondContact O-CB 3.36Å; V113-T117 PolarHBondContact O-N 2.94Å; V113-T117 PolarHBondContact O-OG1 3.48Å; V113-V258 HydrophobicContact CG2-CG1 3.83Å; V113-V258 HydrophobicContact CG2-CG2 4.38Å |
| 114 | V | 94.5 | Very high | 89.4 | Confident | 0 Ų | 0 | 41.2 Ų | 41.2 | 0% | 0 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -63.5 | -40.9 | 177.8 | 174.3 | 0 | 0 | 0 | 0 | 110.7 | Y110 Q111 E112 T117 C118 T122 C126 F405 | Y110-V114 HydrophobicContact CD1-CG2 3.96Å; Y110-V114 HydrophobicContact CE1-CG2 3.67Å; Y110-V114 WeakPolarHBondContact O-CG2 3.48Å; Y110-V114 PolarHBondContact O-N 3.49Å; Y110-V114 VanDerWaalsContact O-N 3.07Å; Q111-V114 PolarHBondContact O-N 2.87Å; E112-V114 PolarHBondContact O-N 3.41Å; V114-T117 PolarHBondContact O-N 2.72Å; V114-C118 HydrophobicContact CG1-CB 4.41Å; V114-C118 WeakPolarHBondContact O-CA 3.33Å; V114-C118 VanDerWaalsContact O-CB 3.24Å; V114-C118 WeakPolarHBondContact O-CB 3.33Å; V114-C118 PolarHBondContact O-N 3.01Å; V114-T122 HydrophobicContact CG1-CG2 3.76Å; V114-C126 HydrophobicContact CB-CB 4.34Å; V114-C126 HydrophobicContact CG1-CB 4.02Å; V114-F405 HydrophobicContact CG1-CD1 3.9Å; V114-F405 HydrophobicContact CG1-CE1 4.5Å; V114-F405 HydrophobicContact CG2-CB 4.05Å; V114-F405 HydrophobicContact CG2-CG 4.46Å |
| 115 | R | 91.5 | Very high | 89.7 | Confident | 31 Ų | 31 | 43.3 Ų | 43.3 | 12% | 0.117 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -65.2 | -45.4 | 178.6 | -171.9 | -180 | 179.5 | 87.1 | -10.7 | 112.5 | S16 Q111 E112 V113 T117 G119 K120 R349 | S16-R115 PolarHBondContact O-NH2 2.78Å; Q111-R115 VanDerWaalsContact O-CB 3.28Å; Q111-R115 WeakPolarHBondContact O-CB 3.33Å; Q111-R115 PolarHBondContact O-N 3.21Å; E112-R115 PolarHBondContact O-N 2.64Å; E112-R115 WeakPolarHBondContact OE2-CD 3.23Å; V113-R115 VanDerWaalsContact C-N 3.32Å; V113-R115 PolarHBondContact O-N 3.49Å; R115-T117 VanDerWaalsContact C-N 3.32Å; R115-G119 CarbonylContact O-C 3.48Å; R115-G119 WeakPolarHBondContact O-CA 3.4Å; R115-G119 PolarHBondContact O-N 3.39Å; R115-K120 PolarHBondContact NH1-O 3.16Å; R115-R349 VanDerWaalsContact CD-NH2 3.32Å; R115-R349 VanDerWaalsContact CZ-NH1 3.33Å |
| 116 | A | 89.8 | Confident | 89.9 | Confident | 60 Ų | 60 | 42 Ų | 42 | 50% | 0.496 | 24% | 0.242 | S | C | . | . | H | α-helix | trans | -65.7 | -36.9 | 179.3 | 0 | 0 | 0 | 0 | 0 | 111.6 | E107 E112 V113 | E107-A116 HydrophobicContact CG-CB 4.11Å; E112-A116 VanDerWaalsContact O-CB 3.26Å; E112-A116 WeakPolarHBondContact O-CB 3.29Å; E112-A116 PolarHBondContact O-N 3.02Å; V113-A116 PolarHBondContact O-N 3.44Å |
| 117 | T | 92.2 | Very high | 90.2 | Very high | 33 Ų | 33 | 35.4 Ų | 35.4 | 20% | 0.202 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -87.5 | -40.4 | -176 | -46.5 | 0 | 0 | 0 | 0 | 112.9 | V113 V114 R115 C409 Q412 | V113-T117 WeakPolarHBondContact O-CB 3.36Å; V113-T117 PolarHBondContact O-N 2.94Å; V113-T117 PolarHBondContact O-OG1 3.48Å; V114-T117 PolarHBondContact O-N 2.72Å; R115-T117 VanDerWaalsContact C-N 3.32Å; T117-C409 HydrophobicContact CG2-CB 4.16Å; T117-Q412 HydrophobicContact CG2-CB 4.1Å; T117-Q412 WeakPolarHBondContact O-CB 3.47Å |
| 118 | C | 92.9 | Very high | 90.5 | Very high | 21 Ų | 21 | 37 Ų | 37 | 14% | 0.142 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -112 | 3.9 | -170.9 | -57 | 0 | 0 | 0 | 0 | 113.9 | V114 T122 C409 | V114-C118 HydrophobicContact CG1-CB 4.41Å; V114-C118 WeakPolarHBondContact O-CA 3.33Å; V114-C118 VanDerWaalsContact O-CB 3.24Å; V114-C118 WeakPolarHBondContact O-CB 3.33Å; V114-C118 PolarHBondContact O-N 3.01Å; C118-T122 HydrophobicContact CB-CG2 3.75Å; C118-T122 PolarHBondContact O-OG1 2.93Å; C118-T122 VanDerWaalsContact O-OG1 3.07Å; C118-C409 VanDerWaalsContact SG-SG 3.69Å |
| 119 | G | 91.3 | Very high | 91.2 | Very high | 33 Ų | 33 | 36.6 Ų | 36.6 | 34% | 0.34 | 21% | 0.212 | S | C | . | . | trans | 87.7 | 173.2 | 178 | 0 | 0 | 0 | 0 | 0 | 115.1 | R115 V121 G123 | R115-G119 CarbonylContact O-C 3.48Å; R115-G119 WeakPolarHBondContact O-CA 3.4Å; R115-G119 PolarHBondContact O-N 3.39Å; G119-V121 PolarHBondContact O-N 3.33Å; G119-G123 PolarHBondContact O-N 2.9Å; G119-G123 VanDerWaalsContact O-N 3.08Å | ||
| 120 | K | 88.3 | Confident | 91.5 | Very high | 125 Ų | 125 | 35.7 Ų | 35.7 | 54% | 0.543 | 21% | 0.206 | S | C | . | . | H | α-helix | trans | -62.6 | -42.7 | -168.9 | -60.6 | -177.9 | -168.2 | 179.8 | 0 | 113.6 | S16 R115 G123 V124 | S16-K120 VanDerWaalsContact OG-CE 3.27Å; S16-K120 WeakPolarHBondContact OG-CE 3.25Å; S16-K120 PolarHBondContact OG-NZ 2.96Å; R115-K120 PolarHBondContact NH1-O 3.16Å; K120-G123 PolarHBondContact O-N 3.45Å; K120-V124 WeakPolarHBondContact O-CG2 3.47Å; K120-V124 PolarHBondContact O-N 3.05Å |
| 121 | V | 91.1 | Very high | 91.7 | Very high | 111 Ų | 111 | 36.3 Ų | 36.3 | 67% | 0.673 | 21% | 0.212 | S | C | * | . | H | α-helix | trans | -64.2 | -51.5 | -176.9 | 179 | 0 | 0 | 0 | 0 | 110.4 | G119 G123 V124 L125 | G119-V121 PolarHBondContact O-N 3.33Å; V121-G123 VanDerWaalsContact C-N 3.27Å; V121-G123 PolarHBondContact O-N 3.3Å; V121-V124 PolarHBondContact O-N 3.38Å; V121-V124 VanDerWaalsContact O-N 3.16Å; V121-L125 HydrophobicContact CG1-CD1 4.33Å; V121-L125 WeakPolarHBondContact O-CG 3.39Å; V121-L125 PolarHBondContact O-N 2.82Å |
| 122 | T | 92.4 | Very high | 91.9 | Very high | 32 Ų | 32 | 39.7 Ų | 39.7 | 20% | 0.196 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -59.8 | -39.2 | 177.4 | -43.7 | 0 | 0 | 0 | 0 | 111.6 | V114 C118 L125 C126 F405 L408 | V114-T122 HydrophobicContact CG1-CG2 3.76Å; C118-T122 HydrophobicContact CB-CG2 3.75Å; C118-T122 PolarHBondContact O-OG1 2.93Å; C118-T122 VanDerWaalsContact O-OG1 3.07Å; T122-L125 PolarHBondContact O-N 3.48Å; T122-C126 WeakPolarHBondContact O-CB 2.98Å; T122-C126 PolarHBondContact O-N 2.9Å; T122-F405 HydrophobicContact CG2-CD1 4.23Å; T122-F405 HydrophobicContact CG2-CE1 4.23Å; T122-L408 HydrophobicContact CG2-CD1 4.01Å |
| 123 | G | 90.6 | Very high | 92.2 | Very high | 0 Ų | 0 | 39.5 Ų | 39.5 | 0% | 0 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -59.4 | -45.8 | 174 | 0 | 0 | 0 | 0 | 0 | 113.4 | G119 K120 V121 C126 E127 | G119-G123 PolarHBondContact O-N 2.9Å; G119-G123 VanDerWaalsContact O-N 3.08Å; K120-G123 PolarHBondContact O-N 3.45Å; V121-G123 VanDerWaalsContact C-N 3.27Å; V121-G123 PolarHBondContact O-N 3.3Å; G123-C126 WeakPolarHBondContact O-CB 3.24Å; G123-C126 PolarHBondContact O-N 3.35Å; G123-E127 WeakPolarHBondContact O-CG 3.38Å; G123-E127 PolarHBondContact O-N 3.45Å |
| 124 | V | 90.1 | Very high | 92.2 | Very high | 52 Ų | 52 | 39.5 Ų | 39.5 | 32% | 0.315 | 23% | 0.228 | S | C | . | . | H | α-helix | trans | -67.1 | -39.8 | 177.7 | 174.4 | 0 | 0 | 0 | 0 | 111.6 | K120 V121 C126 E127 M128 L346 | K120-V124 WeakPolarHBondContact O-CG2 3.47Å; K120-V124 PolarHBondContact O-N 3.05Å; V121-V124 PolarHBondContact O-N 3.38Å; V121-V124 VanDerWaalsContact O-N 3.16Å; V124-C126 VanDerWaalsContact C-N 3.3Å; V124-C126 PolarHBondContact O-N 3.23Å; V124-E127 WeakPolarHBondContact O-CB 3.47Å; V124-E127 PolarHBondContact O-N 3.48Å; V124-M128 WeakPolarHBondContact O-CG 3.24Å; V124-M128 PolarHBondContact O-N 3.41Å; V124-L346 HydrophobicContact CG1-CD2 4.18Å |
| 125 | L | 93.9 | Very high | 92.2 | Very high | 101 Ų | 101 | 42 Ų | 42 | 53% | 0.529 | 24% | 0.239 | S | C | . | . | H | α-helix | trans | -62.2 | -40.5 | 174.7 | -68.6 | 176.2 | 0 | 0 | 0 | 111.6 | V121 T122 M128 A129 | V121-L125 HydrophobicContact CG1-CD1 4.33Å; V121-L125 WeakPolarHBondContact O-CG 3.39Å; V121-L125 PolarHBondContact O-N 2.82Å; T122-L125 PolarHBondContact O-N 3.48Å; L125-M128 PolarHBondContact O-N 2.89Å; L125-A129 WeakPolarHBondContact O-CB 3.3Å; L125-A129 PolarHBondContact O-N 3.32Å |
| 126 | C | 93.8 | Very high | 92.3 | Very high | 0 Ų | 0 | 40.9 Ų | 40.9 | 0% | 0 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -61.8 | -43.1 | 174 | -177.5 | 0 | 0 | 0 | 0 | 112 | Y110 V114 T122 G123 V124 A129 I130 F405 | Y110-C126 WeakPolarHBondContact CD1-SG 3.17Å; Y110-C126 WeakPolarHBondContact CE1-SG 3.34Å; V114-C126 HydrophobicContact CB-CB 4.34Å; V114-C126 HydrophobicContact CG1-CB 4.02Å; T122-C126 WeakPolarHBondContact O-CB 2.98Å; T122-C126 PolarHBondContact O-N 2.9Å; G123-C126 WeakPolarHBondContact O-CB 3.24Å; G123-C126 PolarHBondContact O-N 3.35Å; V124-C126 VanDerWaalsContact C-N 3.3Å; V124-C126 PolarHBondContact O-N 3.23Å; C126-A129 PolarHBondContact O-N 2.96Å; C126-I130 VanDerWaalsContact O-CG1 3.31Å; C126-I130 WeakPolarHBondContact O-CG1 3.17Å; C126-I130 PolarHBondContact O-N 2.89Å; C126-F405 VanDerWaalsContact CA-CZ 3.49Å; C126-F405 HydrophobicContact CB-CD1 4.17Å; C126-F405 HydrophobicContact CB-CE1 3.69Å; C126-F405 HydrophobicContact CB-CE2 4.32Å; C126-F405 HydrophobicContact CB-CZ 3.78Å |
| 127 | E | 91.4 | Very high | 92.4 | Very high | 2 Ų | 2 | 38.1 Ų | 38.1 | 1% | 0.009 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -59.2 | -51.3 | 175.4 | -76.7 | 167.9 | -159.5 | 0 | 0 | 111.3 | Q111 G123 V124 A129 I130 A131 V342 L346 R349 | Q111-E127 HydrophobicContact CB-CG 3.54Å; Q111-E127 HydrophobicContact CG-CG 3.76Å; G123-E127 WeakPolarHBondContact O-CG 3.38Å; G123-E127 PolarHBondContact O-N 3.45Å; V124-E127 WeakPolarHBondContact O-CB 3.47Å; V124-E127 PolarHBondContact O-N 3.48Å; E127-A129 VanDerWaalsContact C-N 3.3Å; E127-A129 PolarHBondContact O-N 2.87Å; E127-I130 PolarHBondContact O-N 3.3Å; E127-A131 PolarHBondContact O-N 2.94Å; E127-V342 VanDerWaalsContact C-CG1 3.48Å; E127-V342 VanDerWaalsContact CA-CG1 3.42Å; E127-V342 HydrophobicContact CB-CG1 3.44Å; E127-V342 VanDerWaalsContact CB-CG1 3.44Å; E127-V342 HydrophobicContact CG-CG1 3.8Å; E127-V342 WeakPolarHBondContact O-CG1 3.41Å; E127-L346 HydrophobicContact CB-CD1 4.2Å; E127-L346 HydrophobicContact CB-CD2 3.93Å; E127-L346 HydrophobicContact CB-CG 4.06Å; E127-L346 VanDerWaalsContact OE2-CD2 3.29Å; E127-L346 WeakPolarHBondContact OE2-CD2 3.17Å; E127-R349 IonicContact OE1-CZ 3.53Å; E127-R349 IonicContact OE1-NH1 2.72Å; E127-R349 PolarHBondContact OE1-NH1 3.48Å; E127-R349 IonicContact OE1-NH2 3.9Å; E127-R349 PolarHBondContact OE1-NH2 2.93Å; E127-R349 IonicContact OE2-CZ 2.67Å; E127-R349 IonicContact OE2-NH1 2.63Å; E127-R349 PolarHBondContact OE2-NH1 2.89Å |
| 128 | M | 92.9 | Very high | 92.5 | Very high | 99 Ų | 99 | 36.6 Ų | 36.6 | 49% | 0.488 | 21% | 0.205 | S | C | . | . | H | α-helix | trans | -58.7 | -42.9 | 177.2 | -68.4 | -174.9 | 70.3 | 0 | 0 | 112 | V124 L125 A131 I132 L346 | V124-M128 WeakPolarHBondContact O-CG 3.24Å; V124-M128 PolarHBondContact O-N 3.41Å; L125-M128 PolarHBondContact O-N 2.89Å; M128-A131 PolarHBondContact O-N 3.35Å; M128-I132 VanDerWaalsContact O-CG1 3.31Å; M128-I132 WeakPolarHBondContact O-CG1 3.44Å; M128-I132 PolarHBondContact O-N 3Å; M128-L346 HydrophobicContact CG-CD1 4.36Å |
| 129 | A | 94.6 | Very high | 92.5 | Very high | 13 Ų | 13 | 36 Ų | 36 | 11% | 0.107 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -61.7 | -46.8 | 177.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | L125 C126 E127 A131 I132 Y133 L397 F401 F405 | L125-A129 WeakPolarHBondContact O-CB 3.3Å; L125-A129 PolarHBondContact O-N 3.32Å; C126-A129 PolarHBondContact O-N 2.96Å; E127-A129 VanDerWaalsContact C-N 3.3Å; E127-A129 PolarHBondContact O-N 2.87Å; A129-A131 VanDerWaalsContact C-N 3.31Å; A129-A131 PolarHBondContact O-N 2.87Å; A129-I132 PolarHBondContact O-N 2.99Å; A129-Y133 VanDerWaalsContact O-CB 3.28Å; A129-Y133 WeakPolarHBondContact O-CB 3.33Å; A129-Y133 PolarHBondContact O-N 3.49Å; A129-L397 HydrophobicContact CB-CD2 4.45Å; A129-F401 VanDerWaalsContact C-CZ 3.49Å; A129-F401 HydrophobicContact CB-CE1 3.73Å; A129-F401 HydrophobicContact CB-CZ 3.74Å; A129-F405 HydrophobicContact CB-CE2 4.31Å; A129-F405 HydrophobicContact CB-CZ 4.4Å |
| 130 | I | 92.8 | Very high | 92.6 | Very high | 1 Ų | 1 | 34.5 Ų | 34.5 | 1% | 0.005 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -62 | -41.2 | 178.6 | -68.9 | 169.2 | 0 | 0 | 0 | 110.4 | Y110 Q111 C126 E127 Y133 T134 V255 V342 F401 | Y110-I130 HydrophobicContact CD1-CD1 3.74Å; Y110-I130 HydrophobicContact CE1-CD1 4.49Å; Y110-I130 HydrophobicContact CG-CD1 4.2Å; Q111-I130 HydrophobicContact CB-CD1 4.29Å; C126-I130 VanDerWaalsContact O-CG1 3.31Å; C126-I130 WeakPolarHBondContact O-CG1 3.17Å; C126-I130 PolarHBondContact O-N 2.89Å; E127-I130 PolarHBondContact O-N 3.3Å; I130-Y133 PolarHBondContact O-N 3.27Å; I130-T134 HydrophobicContact CG2-CG2 4.07Å; I130-T134 WeakPolarHBondContact O-CB 3.45Å; I130-T134 WeakPolarHBondContact O-CG2 3.41Å; I130-T134 PolarHBondContact O-N 3.26Å; I130-T134 PolarHBondContact O-OG1 3.18Å; I130-V255 HydrophobicContact CD1-CG1 4.5Å; I130-V255 HydrophobicContact CG1-CG1 4.38Å; I130-V255 HydrophobicContact CG1-CG2 4.36Å; I130-V255 HydrophobicContact CG2-CG1 3.84Å; I130-V342 HydrophobicContact CB-CG2 4.22Å; I130-V342 HydrophobicContact CG2-CG2 3.8Å; I130-F401 HydrophobicContact CG1-CD1 4.27Å; I130-F401 HydrophobicContact CG1-CE1 3.57Å; I130-F401 HydrophobicContact CG1-CZ 3.94Å |
| 131 | A | 92.8 | Very high | 92.8 | Very high | 14 Ų | 14 | 29 Ų | 29 | 12% | 0.116 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -60.6 | -49 | 177.2 | 0 | 0 | 0 | 0 | 0 | 111.4 | E127 M128 A129 Y133 T134 F135 V342 V343 W373 | E127-A131 PolarHBondContact O-N 2.94Å; M128-A131 PolarHBondContact O-N 3.35Å; A129-A131 VanDerWaalsContact C-N 3.31Å; A129-A131 PolarHBondContact O-N 2.87Å; A131-Y133 PolarHBondContact O-N 3.29Å; A131-T134 PolarHBondContact O-OG1 3.43Å; A131-F135 WeakPolarHBondContact O-CB 3.32Å; A131-F135 PolarHBondContact O-N 3Å; A131-V342 HydrophobicContact CB-CG1 4.39Å; A131-V343 HydrophobicContact CB-CG2 4.43Å; A131-W373 VanDerWaalsContact O-CH2 3.29Å; A131-W373 WeakPolarHBondContact O-CH2 3.44Å |
| 132 | I | 94.1 | Very high | 93 | Very high | 89 Ų | 89 | 23.7 Ų | 23.7 | 46% | 0.456 | 13% | 0.128 | S | C | . | . | H | α-helix | trans | -64.4 | -43.7 | 179 | -62.3 | 164.6 | 0 | 0 | 0 | 111 | M128 A129 F135 G136 L397 | M128-I132 VanDerWaalsContact O-CG1 3.31Å; M128-I132 WeakPolarHBondContact O-CG1 3.44Å; M128-I132 PolarHBondContact O-N 3Å; A129-I132 PolarHBondContact O-N 2.99Å; I132-F135 PolarHBondContact O-N 2.66Å; I132-G136 PolarHBondContact O-N 3.42Å; I132-L397 HydrophobicContact CB-CD1 3.99Å; I132-L397 HydrophobicContact CG2-CD1 3.53Å |
| 133 | Y | 94 | Very high | 93 | Very high | 12 Ų | 12 | 22.2 Ų | 22.2 | 5% | 0.047 | 12% | 0.119 | C | C | . | . | H | α-helix | trans | -62.5 | -49.7 | 179.7 | 174.3 | -96.8 | 0 | 0 | 0 | 112.8 | A129 I130 A131 F135 G136 T137 F249 Q252 V255 I394 L397 A398 F401 | A129-Y133 VanDerWaalsContact O-CB 3.28Å; A129-Y133 WeakPolarHBondContact O-CB 3.33Å; A129-Y133 PolarHBondContact O-N 3.49Å; I130-Y133 PolarHBondContact O-N 3.27Å; A131-Y133 PolarHBondContact O-N 3.29Å; Y133-F135 VanDerWaalsContact C-N 3.29Å; Y133-F135 PolarHBondContact O-N 2.73Å; Y133-G136 PolarHBondContact O-N 2.94Å; Y133-T137 WeakPolarHBondContact O-CB 3.33Å; Y133-T137 PolarHBondContact O-N 2.87Å; Y133-T137 PolarHBondContact O-OG1 3.44Å; Y133-F249 HydrophobicContact CE2-CD2 4.29Å; Y133-Q252 HydrophobicContact CE1-CG 3.94Å; Y133-Q252 HydrophobicContact CE2-CG 4.19Å; Y133-Q252 VanDerWaalsContact OH-CB 3.31Å; Y133-Q252 WeakPolarHBondContact OH-CB 3.12Å; Y133-Q252 WeakPolarHBondContact OH-CG 3.29Å; Y133-V255 HydrophobicContact CD1-CG2 4.36Å; Y133-I394 HydrophobicContact CD2-CB 3.93Å; Y133-I394 WeakPolarHBondContact CD2-O 3.3Å; Y133-I394 HydrophobicContact CE2-CB 4.13Å; Y133-I394 HydrophobicContact CE2-CG1 4.47Å; Y133-L397 HydrophobicContact CD2-CB 4.26Å; Y133-A398 HydrophobicContact CE2-CB 3.98Å; Y133-F401 HydrophobicContact CD1-CE2 4.01Å; Y133-F401 AromaticContact CD2-CE2 3.91Å; Y133-F401 HydrophobicContact CD2-CE2 3.91Å; Y133-F401 HydrophobicContact CG-CD2 4.36Å; Y133-F401 AromaticContact CG-CE2 3.53Å; Y133-F401 HydrophobicContact CG-CE2 3.53Å; Y133-F401 HydrophobicContact CG-CZ 4.35Å |
| 134 | T | 92.3 | Very high | 93.1 | Very high | 1 Ų | 1 | 22.2 Ų | 22.2 | 1% | 0.006 | 12% | 0.119 | C | C | . | . | H | α-helix | trans | -65.1 | -36.3 | 179.5 | 51 | 0 | 0 | 0 | 0 | 111.1 | I130 A131 T137 C138 C338 G339 W373 | I130-T134 HydrophobicContact CG2-CG2 4.07Å; I130-T134 WeakPolarHBondContact O-CB 3.45Å; I130-T134 WeakPolarHBondContact O-CG2 3.41Å; I130-T134 PolarHBondContact O-N 3.26Å; I130-T134 PolarHBondContact O-OG1 3.18Å; A131-T134 PolarHBondContact O-OG1 3.43Å; T134-T137 PolarHBondContact O-N 2.89Å; T134-C138 PolarHBondContact O-N 3.41Å; T134-C138 PolarHBondContact O-SG 2.95Å; T134-C338 HydrophobicContact CG2-CB 4.3Å; T134-G339 WeakPolarHBondContact OG1-CA 3.38Å; T134-W373 WeakPolarHBondContact OG1-CZ2 3.29Å |
| 135 | F | 93.4 | Very high | 93.2 | Very high | 51 Ų | 51 | 19.8 Ų | 19.8 | 22% | 0.224 | 10% | 0.104 | C | C | . | . | H | α-helix | trans | -63 | -50.7 | 175.7 | -177 | -94.3 | 0 | 0 | 0 | 111.6 | A131 I132 Y133 T137 C138 I139 W373 V376 T377 L380 | A131-F135 WeakPolarHBondContact O-CB 3.32Å; A131-F135 PolarHBondContact O-N 3Å; I132-F135 PolarHBondContact O-N 2.66Å; Y133-F135 VanDerWaalsContact C-N 3.29Å; Y133-F135 PolarHBondContact O-N 2.73Å; F135-T137 VanDerWaalsContact C-N 3.33Å; F135-T137 PolarHBondContact O-N 2.89Å; F135-C138 WeakPolarHBondContact O-CB 3.41Å; F135-C138 PolarHBondContact O-N 3Å; F135-I139 HydrophobicContact CD1-CD1 3.93Å; F135-I139 HydrophobicContact CE1-CD1 3.61Å; F135-I139 HydrophobicContact CZ-CD1 4.34Å; F135-I139 PolarHBondContact O-N 3.38Å; F135-W373 VanDerWaalsContact CA-CZ2 3.42Å; F135-W373 HydrophobicContact CB-CH2 3.79Å; F135-W373 HydrophobicContact CB-CZ2 3.57Å; F135-W373 AromaticContact CD2-CD2 4Å; F135-W373 HydrophobicContact CD2-CD2 4Å; F135-W373 AromaticContact CD2-CE2 3.83Å; F135-W373 HydrophobicContact CD2-CE3 4.26Å; F135-W373 HydrophobicContact CD2-CH2 4.35Å; F135-W373 HydrophobicContact CD2-CZ2 4.08Å; F135-W373 HydrophobicContact CD2-CZ3 4.39Å; F135-W373 HydrophobicContact CG-CZ2 4.34Å; F135-V376 HydrophobicContact CE2-CB 4.39Å; F135-V376 HydrophobicContact CE2-CG1 4.1Å; F135-V376 HydrophobicContact CZ-CB 4.46Å; F135-V376 HydrophobicContact CZ-CG1 3.73Å; F135-T377 HydrophobicContact CD2-CG2 3.46Å; F135-T377 VanDerWaalsContact CD2-CG2 3.46Å; F135-T377 HydrophobicContact CE1-CG2 4.45Å; F135-T377 HydrophobicContact CE2-CG2 3.37Å; F135-T377 HydrophobicContact CG-CG2 4.07Å; F135-T377 HydrophobicContact CZ-CG2 3.91Å; F135-L380 HydrophobicContact CE1-CD1 3.67Å; F135-L380 HydrophobicContact CZ-CD1 3.64Å |
| 136 | G | 93.8 | Very high | 93.1 | Very high | 8 Ų | 8 | 15 Ų | 15 | 8% | 0.082 | 8% | 0.079 | C | C | . | . | H | α-helix | trans | -64.2 | -36.2 | 176.9 | 0 | 0 | 0 | 0 | 0 | 113 | I132 Y133 C138 I139 A140 V390 | I132-G136 PolarHBondContact O-N 3.42Å; Y133-G136 PolarHBondContact O-N 2.94Å; G136-C138 PolarHBondContact O-N 3.48Å; G136-I139 WeakPolarHBondContact O-CB 3.49Å; G136-I139 PolarHBondContact O-N 3Å; G136-A140 PolarHBondContact O-N 3.36Å; G136-V390 WeakPolarHBondContact O-CG1 3.38Å |
| 137 | T | 92.7 | Very high | 92.9 | Very high | 3 Ų | 3 | 16 Ų | 16 | 2% | 0.018 | 8% | 0.084 | C | C | . | . | H | α-helix | trans | -67.6 | -36.3 | 176.1 | -48.5 | 0 | 0 | 0 | 0 | 112 | Y133 T134 F135 I139 A140 F141 F249 L335 | Y133-T137 WeakPolarHBondContact O-CB 3.33Å; Y133-T137 PolarHBondContact O-N 2.87Å; Y133-T137 PolarHBondContact O-OG1 3.44Å; T134-T137 PolarHBondContact O-N 2.89Å; F135-T137 VanDerWaalsContact C-N 3.33Å; F135-T137 PolarHBondContact O-N 2.89Å; T137-I139 VanDerWaalsContact C-N 3.29Å; T137-I139 PolarHBondContact O-N 3.48Å; T137-A140 PolarHBondContact O-N 3.09Å; T137-F141 HydrophobicContact CG2-CD1 4.11Å; T137-F141 HydrophobicContact CG2-CE1 3.7Å; T137-F141 HydrophobicContact CG2-CE2 4.32Å; T137-F141 HydrophobicContact CG2-CZ 3.82Å; T137-F141 WeakPolarHBondContact O-CB 3.26Å; T137-F141 WeakPolarHBondContact O-CD1 3.29Å; T137-F141 WeakPolarHBondContact O-CG 3.26Å; T137-F141 PolarHBondContact O-N 3.2Å; T137-F249 HydrophobicContact CG2-CE2 3.88Å; T137-F249 HydrophobicContact CG2-CZ 4.23Å; T137-L335 VanDerWaalsContact CB-CD2 3.42Å; T137-L335 HydrophobicContact CG2-CD2 3.23Å |
| 138 | C | 93 | Very high | 93 | Very high | 0 Ų | 0 | 15.9 Ų | 15.9 | 0% | 0 | 8% | 0.084 | C | C | . | . | H | α-helix | trans | -60.3 | -38.6 | 171.5 | -75.1 | 0 | 0 | 0 | 0 | 112.1 | T134 F135 G136 F141 F142 Y332 T377 | T134-C138 PolarHBondContact O-N 3.41Å; T134-C138 PolarHBondContact O-SG 2.95Å; F135-C138 WeakPolarHBondContact O-CB 3.41Å; F135-C138 PolarHBondContact O-N 3Å; G136-C138 PolarHBondContact O-N 3.48Å; C138-F141 PolarHBondContact O-N 3.24Å; C138-F142 WeakPolarHBondContact O-CD2 3.45Å; C138-F142 PolarHBondContact O-N 3.05Å; C138-Y332 HydrophobicContact CB-CD2 4.27Å; C138-Y332 HydrophobicContact CB-CE2 3.5Å; C138-T377 HydrophobicContact CB-CG2 3.92Å |
| 139 | I | 94 | Very high | 92.9 | Very high | 10 Ų | 10 | 12.2 Ų | 12.2 | 5% | 0.051 | 7% | 0.066 | C | C | . | . | H | α-helix | trans | -63.8 | -49.7 | 174 | -63.6 | 170.1 | 0 | 0 | 0 | 110.2 | F135 G136 T137 F141 F142 I143 T377 L380 A381 I384 V390 | F135-I139 HydrophobicContact CD1-CD1 3.93Å; F135-I139 HydrophobicContact CE1-CD1 3.61Å; F135-I139 HydrophobicContact CZ-CD1 4.34Å; F135-I139 PolarHBondContact O-N 3.38Å; G136-I139 WeakPolarHBondContact O-CB 3.49Å; G136-I139 PolarHBondContact O-N 3Å; T137-I139 VanDerWaalsContact C-N 3.29Å; T137-I139 PolarHBondContact O-N 3.48Å; I139-F141 PolarHBondContact O-N 2.88Å; I139-F142 PolarHBondContact O-N 2.95Å; I139-F142 VanDerWaalsContact O-N 3.12Å; I139-I143 HydrophobicContact CG2-CD1 3.99Å; I139-I143 WeakPolarHBondContact O-CG1 3.38Å; I139-I143 PolarHBondContact O-N 3.05Å; I139-I143 VanDerWaalsContact O-N 3.08Å; I139-T377 HydrophobicContact CG1-CG2 4.04Å; I139-L380 HydrophobicContact CD1-CB 3.95Å; I139-L380 HydrophobicContact CD1-CD1 3.72Å; I139-L380 HydrophobicContact CG1-CB 4.33Å; I139-A381 HydrophobicContact CG2-CB 4.12Å; I139-I384 HydrophobicContact CG2-CD1 3.91Å; I139-V390 HydrophobicContact CG2-CG2 4.31Å |
| 140 | A | 93.1 | Very high | 92.7 | Very high | 0 Ų | 0 | 14.3 Ų | 14.3 | 0% | 0 | 8% | 0.076 | C | C | . | . | H | α-helix | trans | -56.3 | -40.4 | 177.9 | 0 | 0 | 0 | 0 | 0 | 111.8 | G136 T137 F142 I143 V144 I387 V390 | G136-A140 PolarHBondContact O-N 3.36Å; T137-A140 PolarHBondContact O-N 3.09Å; A140-F142 PolarHBondContact O-N 3.28Å; A140-I143 PolarHBondContact O-N 3.25Å; A140-V144 VanDerWaalsContact O-CG2 3.31Å; A140-V144 WeakPolarHBondContact O-CG2 3.24Å; A140-V144 PolarHBondContact O-N 3Å; A140-I387 HydrophobicContact CB-CG1 4.22Å; A140-V390 HydrophobicContact CB-CG1 4.07Å |
| 141 | F | 92.9 | Very high | 92.5 | Very high | 9 Ų | 9 | 18.1 Ų | 18.1 | 4% | 0.039 | 9% | 0.09 | C | C | . | . | H | α-helix | trans | -62.3 | -41.4 | 176.7 | -76.3 | 0.3 | 0 | 0 | 0 | 113.4 | A62 T137 C138 I139 V144 I145 V328 Y332 L335 | A62-F141 HydrophobicContact CB-CD1 4.13Å; A62-F141 HydrophobicContact CB-CE1 3.99Å; T137-F141 HydrophobicContact CG2-CD1 4.11Å; T137-F141 HydrophobicContact CG2-CE1 3.7Å; T137-F141 HydrophobicContact CG2-CE2 4.32Å; T137-F141 HydrophobicContact CG2-CZ 3.82Å; T137-F141 WeakPolarHBondContact O-CB 3.26Å; T137-F141 WeakPolarHBondContact O-CD1 3.29Å; T137-F141 WeakPolarHBondContact O-CG 3.26Å; T137-F141 PolarHBondContact O-N 3.2Å; C138-F141 PolarHBondContact O-N 3.24Å; I139-F141 PolarHBondContact O-N 2.88Å; F141-V144 PolarHBondContact O-N 3.41Å; F141-I145 WeakPolarHBondContact O-CB 3.09Å; F141-I145 VanDerWaalsContact O-CG1 3.25Å; F141-I145 WeakPolarHBondContact O-CG1 3.2Å; F141-I145 PolarHBondContact O-N 3.39Å; F141-V328 HydrophobicContact CB-CG1 3.38Å; F141-V328 HydrophobicContact CD1-CG1 3.7Å; F141-V328 HydrophobicContact CD2-CG1 3.94Å; F141-V328 HydrophobicContact CE1-CG1 4.42Å; F141-V328 HydrophobicContact CG-CG1 3.41Å; F141-V328 VanDerWaalsContact CG-CG1 3.41Å; F141-Y332 HydrophobicContact CB-CD2 3.99Å; F141-Y332 AromaticContact CD2-CD2 3.99Å; F141-Y332 HydrophobicContact CD2-CD2 3.99Å; F141-Y332 HydrophobicContact CD2-CG 4.36Å; F141-L335 HydrophobicContact CE2-CD1 4.08Å; F141-L335 HydrophobicContact CE2-CD2 4.33Å; F141-L335 HydrophobicContact CZ-CD1 4.27Å; F141-L335 HydrophobicContact CZ-CD2 4.37Å |
| 142 | F | 93.6 | Very high | 92.4 | Very high | 1 Ų | 1 | 19.5 Ų | 19.5 | 0% | 0.004 | 10% | 0.095 | C | C | . | . | H | α-helix | trans | -65.7 | -38.5 | 174.4 | -76.9 | -50.1 | 0 | 0 | 0 | 112.6 | C138 I139 A140 I145 G146 I176 A180 I184 Y332 F374 L378 A381 | C138-F142 WeakPolarHBondContact O-CD2 3.45Å; C138-F142 PolarHBondContact O-N 3.05Å; I139-F142 PolarHBondContact O-N 2.95Å; I139-F142 VanDerWaalsContact O-N 3.12Å; A140-F142 PolarHBondContact O-N 3.28Å; F142-I145 PolarHBondContact O-N 3.48Å; F142-G146 PolarHBondContact O-N 3.49Å; F142-I176 HydrophobicContact CB-CG2 4.38Å; F142-I176 HydrophobicContact CD1-CG2 4.26Å; F142-A180 HydrophobicContact CD1-CB 4.16Å; F142-A180 HydrophobicContact CE1-CB 3.39Å; F142-A180 HydrophobicContact CZ-CB 4.03Å; F142-I184 HydrophobicContact CD1-CD1 4.11Å; F142-I184 HydrophobicContact CE1-CD1 3.6Å; F142-Y332 HydrophobicContact CD2-CE2 4.12Å; F142-Y332 HydrophobicContact CE1-CE2 4.26Å; F142-Y332 AromaticContact CE2-CE2 3.61Å; F142-Y332 HydrophobicContact CE2-CE2 3.61Å; F142-Y332 AromaticContact CE2-CZ 3.84Å; F142-Y332 WeakPolarHBondContact CE2-OH 3.47Å; F142-Y332 AromaticContact CZ-CE2 3.68Å; F142-Y332 HydrophobicContact CZ-CE2 3.68Å; F142-Y332 AromaticContact CZ-CZ 3.78Å; F142-F374 HydrophobicContact CE1-CE2 4.31Å; F142-F374 HydrophobicContact CZ-CD2 4Å; F142-F374 AromaticContact CZ-CE2 3.65Å; F142-F374 HydrophobicContact CZ-CE2 3.65Å; F142-F374 HydrophobicContact CZ-CZ 4.24Å; F142-L378 HydrophobicContact CD1-CD1 4.35Å; F142-L378 HydrophobicContact CD2-CB 4.41Å; F142-L378 HydrophobicContact CE1-CD1 4.36Å; F142-L378 HydrophobicContact CE2-CB 3.97Å; F142-L378 HydrophobicContact CG-CD1 4.45Å; F142-L378 HydrophobicContact CZ-CB 4.33Å; F142-L378 HydrophobicContact CZ-CD1 4.44Å; F142-A381 HydrophobicContact CB-CB 3.41Å; F142-A381 VanDerWaalsContact CB-CB 3.41Å; F142-A381 HydrophobicContact CD2-CB 4.23Å; F142-A381 HydrophobicContact CG-CB 4.23Å |
| 143 | I | 92.6 | Very high | 92 | Very high | 0 Ų | 0 | 17.6 Ų | 17.6 | 0% | 0 | 9% | 0.085 | C | C | . | . | H | α-helix | trans | -61 | -50.6 | 175.8 | -65.5 | 169.1 | 0 | 0 | 0 | 110 | I139 A140 I145 G146 D147 A381 I384 I387 V390 | I139-I143 HydrophobicContact CG2-CD1 3.99Å; I139-I143 WeakPolarHBondContact O-CG1 3.38Å; I139-I143 PolarHBondContact O-N 3.05Å; I139-I143 VanDerWaalsContact O-N 3.08Å; A140-I143 PolarHBondContact O-N 3.25Å; I143-I145 PolarHBondContact O-N 3.31Å; I143-G146 PolarHBondContact O-N 2.81Å; I143-G146 VanDerWaalsContact O-N 3.14Å; I143-D147 VanDerWaalsContact O-CG 3.23Å; I143-D147 PolarHBondContact O-N 2.93Å; I143-A381 HydrophobicContact CG1-CB 4.22Å; I143-I384 HydrophobicContact CD1-CB 4.1Å; I143-I384 HydrophobicContact CD1-CG2 3.75Å; I143-I387 HydrophobicContact CG2-CB 3.92Å; I143-I387 HydrophobicContact CG2-CG1 4.41Å; I143-V390 HydrophobicContact CD1-CG2 4.06Å |
| 144 | V | 92.7 | Very high | 91.6 | Very high | 0 Ų | 0 | 18.4 Ų | 18.4 | 0% | 0 | 10% | 0.095 | C | C | . | . | H | α-helix | trans | -58.5 | -47.4 | 177.7 | 175.8 | 0 | 0 | 0 | 0 | 111.2 | A62 L65 A140 F141 G146 D147 Q148 I324 V328 I387 | A62-V144 HydrophobicContact CB-CG1 4.49Å; A62-V144 HydrophobicContact CB-CG2 3.93Å; L65-V144 HydrophobicContact CD1-CG1 4.17Å; A140-V144 VanDerWaalsContact O-CG2 3.31Å; A140-V144 WeakPolarHBondContact O-CG2 3.24Å; A140-V144 PolarHBondContact O-N 3Å; F141-V144 PolarHBondContact O-N 3.41Å; V144-G146 VanDerWaalsContact C-N 3.27Å; V144-G146 PolarHBondContact O-N 3.46Å; V144-D147 PolarHBondContact O-N 3.49Å; V144-Q148 HydrophobicContact CG1-CG 3.97Å; V144-Q148 WeakPolarHBondContact O-CB 3.13Å; V144-Q148 WeakPolarHBondContact O-CG 3.38Å; V144-Q148 PolarHBondContact O-N 2.9Å; V144-I324 HydrophobicContact CG1-CG2 3.73Å; V144-V328 HydrophobicContact CG1-CG2 4.04Å; V144-I387 HydrophobicContact CG2-CD1 3.26Å |
| 145 | I | 92.3 | Very high | 91.1 | Very high | 1 Ų | 1 | 19 Ų | 19 | 1% | 0.005 | 10% | 0.1 | C | C | . | . | H | α-helix | trans | -59 | -43.1 | 178.6 | -72.2 | 168.4 | 0 | 0 | 0 | 110.8 | F141 F142 I143 L149 T179 I184 V328 V329 | F141-I145 WeakPolarHBondContact O-CB 3.09Å; F141-I145 VanDerWaalsContact O-CG1 3.25Å; F141-I145 WeakPolarHBondContact O-CG1 3.2Å; F141-I145 PolarHBondContact O-N 3.39Å; F142-I145 PolarHBondContact O-N 3.48Å; I143-I145 PolarHBondContact O-N 3.31Å; I145-L149 HydrophobicContact CG2-CD1 3.56Å; I145-L149 HydrophobicContact CG2-CG 4.25Å; I145-L149 VanDerWaalsContact O-CB 3.23Å; I145-L149 WeakPolarHBondContact O-CB 3.33Å; I145-L149 WeakPolarHBondContact O-CG 3.27Å; I145-L149 PolarHBondContact O-N 3.42Å; I145-T179 HydrophobicContact CG2-CG2 4.04Å; I145-I184 HydrophobicContact CD1-CD1 3.48Å; I145-I184 VanDerWaalsContact CD1-CD1 3.48Å; I145-V328 HydrophobicContact CD1-CB 4.38Å; I145-V328 HydrophobicContact CD1-CG1 3.81Å; I145-V328 HydrophobicContact CG1-CB 4.17Å; I145-V328 HydrophobicContact CG1-CG1 3.84Å; I145-V329 HydrophobicContact CD1-CG2 3.69Å; I145-V329 HydrophobicContact CG1-CG2 4.38Å |
| 146 | G | 91.4 | Very high | 90.5 | Very high | 0 Ų | 0 | 20.8 Ų | 20.8 | 0% | 0 | 12% | 0.115 | C | C | . | . | H | α-helix | trans | -60.3 | -50 | 176.8 | 0 | 0 | 0 | 0 | 0 | 113 | F142 I143 V144 L149 D150 | F142-G146 PolarHBondContact O-N 3.49Å; I143-G146 PolarHBondContact O-N 2.81Å; I143-G146 VanDerWaalsContact O-N 3.14Å; V144-G146 VanDerWaalsContact C-N 3.27Å; V144-G146 PolarHBondContact O-N 3.46Å; G146-L149 PolarHBondContact O-N 2.86Å; G146-D150 VanDerWaalsContact O-CB 3.24Å; G146-D150 WeakPolarHBondContact O-CB 3.34Å; G146-D150 PolarHBondContact O-N 3.47Å |
| 147 | D | 91.1 | Very high | 89.6 | Confident | 21 Ų | 21 | 22.8 Ų | 22.8 | 11% | 0.112 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -64.6 | -43.2 | -177.4 | -64.6 | -10.9 | 0 | 0 | 0 | 111.4 | I143 V144 R151 R172 M308 | I143-D147 VanDerWaalsContact O-CG 3.23Å; I143-D147 PolarHBondContact O-N 2.93Å; V144-D147 PolarHBondContact O-N 3.49Å; D147-R151 WeakPolarHBondContact O-CG 3.33Å; D147-R151 PolarHBondContact O-N 2.97Å; D147-R172 IonicContact OD1-CZ 3Å; D147-R172 IonicContact OD1-NE 3.05Å; D147-R172 PolarHBondContact OD1-NE 2.84Å; D147-R172 IonicContact OD1-NH2 2.66Å; D147-R172 PolarHBondContact OD1-NH2 2.78Å; D147-M308 HydrophobicContact CB-CE 3.98Å; D147-M308 HydrophobicContact CB-SD 3.95Å |
| 148 | Q | 93.4 | Very high | 88.3 | Confident | 0 Ų | 0 | 29.4 Ų | 29.4 | 0% | 0 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -71.1 | -38.8 | -179.9 | -61.9 | -54 | -36.8 | 0 | 0 | 112.4 | V144 L152 D305 R321 I324 V325 | V144-Q148 HydrophobicContact CG1-CG 3.97Å; V144-Q148 WeakPolarHBondContact O-CB 3.13Å; V144-Q148 WeakPolarHBondContact O-CG 3.38Å; V144-Q148 PolarHBondContact O-N 2.9Å; Q148-L152 VanDerWaalsContact O-CB 3.3Å; Q148-L152 WeakPolarHBondContact O-CB 3.39Å; Q148-L152 PolarHBondContact O-N 2.82Å; Q148-D305 VanDerWaalsContact NE2-CG 3.27Å; Q148-D305 PolarHBondContact NE2-OD1 3.3Å; Q148-D305 PolarHBondContact NE2-OD2 2.91Å; Q148-R321 HydrophobicContact CB-CB 4.28Å; Q148-R321 VanDerWaalsContact OE1-CB 3.27Å; Q148-R321 VanDerWaalsContact OE1-CD 3.26Å; Q148-I324 HydrophobicContact CG-CG2 3.95Å; Q148-V325 HydrophobicContact CB-CG2 3.61Å |
| 149 | L | 91.5 | Very high | 86.5 | Confident | 23 Ų | 23 | 37.1 Ų | 37.1 | 12% | 0.12 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -70.8 | -39.6 | 176.9 | -73.1 | 175.9 | 0 | 0 | 0 | 112.4 | I145 G146 R151 L152 I153 T175 T179 V325 | I145-L149 HydrophobicContact CG2-CD1 3.56Å; I145-L149 HydrophobicContact CG2-CG 4.25Å; I145-L149 VanDerWaalsContact O-CB 3.23Å; I145-L149 WeakPolarHBondContact O-CB 3.33Å; I145-L149 WeakPolarHBondContact O-CG 3.27Å; I145-L149 PolarHBondContact O-N 3.42Å; G146-L149 PolarHBondContact O-N 2.86Å; L149-R151 VanDerWaalsContact C-N 3.33Å; L149-R151 PolarHBondContact O-N 3.01Å; L149-L152 HydrophobicContact CD2-CD2 4.37Å; L149-L152 PolarHBondContact O-N 3.1Å; L149-I153 WeakPolarHBondContact O-CB 3.15Å; L149-I153 VanDerWaalsContact O-CG1 3.27Å; L149-I153 WeakPolarHBondContact O-CG1 3.38Å; L149-I153 PolarHBondContact O-N 2.63Å; L149-T175 HydrophobicContact CB-CG2 3.73Å; L149-T175 HydrophobicContact CD1-CG2 3.63Å; L149-T175 HydrophobicContact CG-CG2 4.24Å; L149-T179 HydrophobicContact CD1-CG2 4.2Å; L149-T179 VanDerWaalsContact CD1-OG1 3.3Å; L149-T179 WeakPolarHBondContact CD1-OG1 3.46Å; L149-V325 HydrophobicContact CD2-CG1 4.23Å; L149-V325 HydrophobicContact CD2-CG2 4.11Å; L149-V325 HydrophobicContact CG-CG1 4.41Å; L149-V325 HydrophobicContact CG-CG2 4.06Å |
| 150 | D | 89.7 | Confident | 84.8 | Confident | 57 Ų | 57 | 41.4 Ų | 41.4 | 31% | 0.305 | 22% | 0.223 | S | C | . | . | H | α-helix | trans | -56.5 | -48.5 | 175.6 | -177.8 | 70.4 | 0 | 0 | 0 | 110.8 | G146 L152 I153 A154 R172 | G146-D150 VanDerWaalsContact O-CB 3.24Å; G146-D150 WeakPolarHBondContact O-CB 3.34Å; G146-D150 PolarHBondContact O-N 3.47Å; D150-L152 PolarHBondContact O-N 2.67Å; D150-I153 PolarHBondContact O-N 2.84Å; D150-A154 WeakPolarHBondContact O-CB 3.4Å; D150-A154 PolarHBondContact O-N 3.3Å; D150-R172 HydrophobicContact CB-CB 4.43Å; D150-R172 HydrophobicContact CB-CG 4.46Å |
| 151 | R | 88.9 | Confident | 82.6 | Confident | 81 Ų | 81 | 47.8 Ų | 47.8 | 31% | 0.306 | 26% | 0.257 | S | S | . | . | H | α-helix | trans | -67 | -35.1 | 175.9 | -65.5 | -59.5 | -169.7 | 175.9 | 1.5 | 113.6 | D147 L149 A154 A155 M308 | D147-R151 WeakPolarHBondContact O-CG 3.33Å; D147-R151 PolarHBondContact O-N 2.97Å; L149-R151 VanDerWaalsContact C-N 3.33Å; L149-R151 PolarHBondContact O-N 3.01Å; R151-A154 PolarHBondContact O-N 3.4Å; R151-A155 PolarHBondContact O-N 3.2Å; R151-M308 HydrophobicContact CG-CE 4Å; R151-M308 HydrophobicContact CG-SD 3.54Å; R151-M308 VanDerWaalsContact CG-SD 3.54Å |
| 152 | L | 89.3 | Confident | 80.6 | Confident | 43 Ų | 43 | 51.6 Ų | 51.6 | 23% | 0.225 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -68.3 | -40.4 | 177.5 | -173.9 | 64.2 | 0 | 0 | 0 | 111.5 | Q148 L149 D150 A155 V156 A318 A322 | Q148-L152 VanDerWaalsContact O-CB 3.3Å; Q148-L152 WeakPolarHBondContact O-CB 3.39Å; Q148-L152 PolarHBondContact O-N 2.82Å; L149-L152 HydrophobicContact CD2-CD2 4.37Å; L149-L152 PolarHBondContact O-N 3.1Å; D150-L152 PolarHBondContact O-N 2.67Å; L152-A155 WeakPolarHBondContact O-CB 2.83Å; L152-A155 PolarHBondContact O-N 3.09Å; L152-V156 WeakPolarHBondContact O-CG2 3.29Å; L152-V156 PolarHBondContact O-N 3.4Å; L152-A318 HydrophobicContact CD1-CB 3.94Å; L152-A322 HydrophobicContact CD2-CB 4.25Å |
| 153 | I | 87.4 | Confident | 78.5 | Confident | 48 Ų | 48 | 55.1 Ų | 55.1 | 25% | 0.246 | 32% | 0.324 | C | S | . | . | H | α-helix | trans | -64.7 | -43.7 | 174.5 | -68.9 | 166.5 | 0 | 0 | 0 | 109.9 | L149 D150 A155 V156 A157 T170 T175 | L149-I153 WeakPolarHBondContact O-CB 3.15Å; L149-I153 VanDerWaalsContact O-CG1 3.27Å; L149-I153 WeakPolarHBondContact O-CG1 3.38Å; L149-I153 PolarHBondContact O-N 2.63Å; D150-I153 PolarHBondContact O-N 2.84Å; I153-A155 VanDerWaalsContact C-N 3.3Å; I153-A155 PolarHBondContact O-N 3.47Å; I153-V156 PolarHBondContact O-N 3.01Å; I153-A157 VanDerWaalsContact O-CB 3.27Å; I153-A157 WeakPolarHBondContact O-CB 3.24Å; I153-A157 PolarHBondContact O-N 3.33Å; I153-T170 HydrophobicContact CG2-CG2 3.58Å; I153-T175 HydrophobicContact CD1-CG2 3.82Å |
| 154 | A | 83.7 | Confident | 76.5 | Confident | 30 Ų | 30 | 61.5 Ų | 61.5 | 25% | 0.248 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -58.6 | -40.9 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | D150 R151 V156 A157 H158 P312 | D150-A154 WeakPolarHBondContact O-CB 3.4Å; D150-A154 PolarHBondContact O-N 3.3Å; R151-A154 PolarHBondContact O-N 3.4Å; A154-V156 PolarHBondContact O-N 3.03Å; A154-A157 PolarHBondContact O-N 3.15Å; A154-H158 WeakPolarHBondContact O-CB 3.19Å; A154-H158 PolarHBondContact O-CD2 3.03Å; A154-H158 VanDerWaalsContact O-CD2 3.32Å; A154-H158 PolarHBondContact O-N 3.3Å; A154-P312 HydrophobicContact CB-CB 4.26Å |
| 155 | A | 82.8 | Confident | 74.6 | Confident | 13 Ų | 13 | 69.3 Ų | 69.3 | 11% | 0.107 | 40% | 0.402 | C | S | . | . | H | α-helix | trans | -59.3 | -46.3 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | R151 L152 I153 P312 A318 | R151-A155 PolarHBondContact O-N 3.2Å; L152-A155 WeakPolarHBondContact O-CB 2.83Å; L152-A155 PolarHBondContact O-N 3.09Å; I153-A155 VanDerWaalsContact C-N 3.3Å; I153-A155 PolarHBondContact O-N 3.47Å; A155-P312 WeakPolarHBondContact CB-O 3.48Å; A155-A318 HydrophobicContact CB-CB 4.3Å |
| 156 | V | 80.9 | Confident | 73.1 | Confident | 89 Ų | 89 | 72.6 Ų | 72.6 | 54% | 0.539 | 44% | 0.436 | S | S | . | . | H | α-helix | trans | -72.4 | -38.3 | -179.9 | 177.2 | 0 | 0 | 0 | 0 | 111.5 | L152 I153 A154 E159 T160 | L152-V156 WeakPolarHBondContact O-CG2 3.29Å; L152-V156 PolarHBondContact O-N 3.4Å; I153-V156 PolarHBondContact O-N 3.01Å; A154-V156 PolarHBondContact O-N 3.03Å; V156-E159 PolarHBondContact O-N 3.49Å; V156-T160 PolarHBondContact O-OG1 3.39Å |
| 157 | A | 75.6 | Confident | 72.1 | Confident | 49 Ų | 49 | 77.3 Ų | 77.3 | 41% | 0.405 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -67.1 | -36.9 | -179.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | I153 A154 E159 T160 D161 | I153-A157 VanDerWaalsContact O-CB 3.27Å; I153-A157 WeakPolarHBondContact O-CB 3.24Å; I153-A157 PolarHBondContact O-N 3.33Å; A154-A157 PolarHBondContact O-N 3.15Å; A157-E159 PolarHBondContact O-N 2.86Å; A157-T160 PolarHBondContact O-N 2.81Å; A157-D161 PolarHBondContact O-N 3.45Å |
| 158 | H | 64.4 | Low | 71.3 | Confident | 143 Ų | 143 | 85.1 Ų | 85.1 | 66% | 0.662 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -61.8 | -27.4 | 175.5 | -95.5 | -72.5 | 0 | 0 | 0 | 113.6 | A154 T160 | A154-H158 WeakPolarHBondContact O-CB 3.19Å; A154-H158 PolarHBondContact O-CD2 3.03Å; A154-H158 VanDerWaalsContact O-CD2 3.32Å; A154-H158 PolarHBondContact O-N 3.3Å; H158-T160 VanDerWaalsContact C-N 3.28Å |
| 159 | E | 56.4 | Low | 70.2 | Confident | 162 Ų | 162 | 90.7 Ų | 90.7 | 76% | 0.757 | 51% | 0.508 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -76 | -17.2 | 172.4 | -65.6 | -151.6 | 143.6 | 0 | 0 | 113.2 | V156 A157 | V156-E159 PolarHBondContact O-N 3.49Å; A157-E159 PolarHBondContact O-N 2.86Å |
| 160 | T | 56.9 | Low | 69.3 | Low | 99 Ų | 99 | 91.1 Ų | 91.1 | 61% | 0.607 | 51% | 0.511 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -106 | -34 | -164.5 | -39.5 | 0 | 0 | 0 | 0 | 114.3 | V156 A157 H158 | V156-T160 PolarHBondContact O-OG1 3.39Å; A157-T160 PolarHBondContact O-N 2.81Å; H158-T160 VanDerWaalsContact C-N 3.28Å |
| 161 | D | 48.3 | Very low | 69 | Low | 134 Ų | 134 | 92.3 Ų | 92.3 | 72% | 0.717 | 52% | 0.518 | S | S | * | . | trans | -173.8 | 144 | 171.2 | -106.4 | -31.9 | 0 | 0 | 0 | 115.3 | A157 S163 | A157-D161 PolarHBondContact O-N 3.45Å; D161-S163 PolarHBondContact O-N 3.4Å | ||
| 162 | G | 50.2 | Low | 68.7 | Low | 89 Ų | 89 | 90.6 Ų | 90.6 | 92% | 0.918 | 51% | 0.511 | S | S | * | . | trans | -76 | 51.2 | 172.5 | 0 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 163 | S | 49.6 | Very low | 68.5 | Low | 75 Ų | 75 | 93.6 Ų | 93.6 | 52% | 0.524 | 52% | 0.523 | S | S | . | . | trans | -102.7 | 136 | 176.9 | 67.6 | 0 | 0 | 0 | 0 | 112.2 | D161 E165 | D161-S163 PolarHBondContact O-N 3.4Å; S163-E165 PolarHBondContact O-N 2.96Å | ||
| 164 | P | 50.7 | Low | 68.5 | Low | 134 Ų | 134 | 95.1 Ų | 95.1 | 87% | 0.87 | 53% | 0.528 | S | S | * | . | S | Bend | trans | -91.1 | 4 | -165.7 | -2.7 | 24.2 | 0 | 0 | 0 | 114.8 | ||
| 165 | E | 53.2 | Low | 68.6 | Low | 164 Ų | 164 | 94.4 Ų | 94.4 | 77% | 0.766 | 52% | 0.52 | S | S | * | . | S | Bend | trans | -118.4 | 102.4 | -174.7 | -65.1 | -169.8 | 174.8 | 0 | 0 | 110.4 | S163 H167 | S163-E165 PolarHBondContact O-N 2.96Å; E165-H167 PolarHBondContact O-N 3.43Å |
| 166 | G | 60 | Low | 68.8 | Low | 70 Ų | 70 | 93.8 Ų | 93.8 | 72% | 0.722 | 52% | 0.515 | S | S | * | . | trans | -57.5 | 122.7 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111 | ||||
| 167 | H | 71 | Confident | 69.3 | Low | 100 Ų | 100 | 92.1 Ų | 92.1 | 46% | 0.463 | 51% | 0.505 | S | S | . | . | trans | -61.4 | 151.3 | 177.3 | -68.9 | -76.6 | 0 | 0 | 0 | 111.4 | E165 Y169 T170 | E165-H167 PolarHBondContact O-N 3.43Å; H167-Y169 HydrophobicContact CB-CD1 3.53Å; H167-Y169 HydrophobicContact CB-CE1 3.16Å; H167-Y169 HydrophobicContact CB-CE2 4.25Å; H167-Y169 HydrophobicContact CB-CG 4.22Å; H167-Y169 AromaticContact CD2-CE1 3.91Å; H167-Y169 AromaticContact CD2-CZ 3.74Å; H167-Y169 PolarHBondContact CD2-OH 3.41Å; H167-Y169 AromaticContact CG-CE1 3.45Å; H167-Y169 VanDerWaalsContact CG-CE1 3.45Å; H167-Y169 AromaticContact CG-CZ 3.74Å; H167-Y169 PolarHBondContact O-N 3.01Å; H167-T170 PolarHBondContact N-OG1 2.72Å; H167-T170 PolarHBondContact O-N 3.14Å; H167-T170 PolarHBondContact O-OG1 3.49Å | ||
| 168 | W | 73.5 | Confident | 70 | Confident | 185 Ų | 185 | 92.1 Ų | 92.1 | 70% | 0.701 | 50% | 0.5 | S | S | * | . | G | 310 helix | trans | -56.1 | -26.2 | -179.8 | 64.9 | -90.9 | 0 | 0 | 0 | 114.2 | T170 D171 F174 | W168-T170 VanDerWaalsContact C-N 3.32Å; W168-D171 PolarHBondContact O-N 3.26Å; W168-F174 HydrophobicContact CE3-CD2 4.45Å; W168-F174 HydrophobicContact CE3-CE1 4.46Å; W168-F174 HydrophobicContact CE3-CE2 4.33Å; W168-F174 HydrophobicContact CE3-CZ 4.33Å; W168-F174 HydrophobicContact CH2-CZ 4.18Å; W168-F174 HydrophobicContact CZ3-CD1 4.44Å; W168-F174 HydrophobicContact CZ3-CD2 4.19Å; W168-F174 AromaticContact CZ3-CE1 3.89Å; W168-F174 HydrophobicContact CZ3-CE1 3.89Å; W168-F174 AromaticContact CZ3-CE2 3.63Å; W168-F174 HydrophobicContact CZ3-CE2 3.63Å; W168-F174 AromaticContact CZ3-CZ 3.45Å; W168-F174 HydrophobicContact CZ3-CZ 3.45Å; W168-F174 VanDerWaalsContact CZ3-CZ 3.45Å |
| 169 | Y | 70.6 | Confident | 71.1 | Confident | 116 Ų | 116 | 86.5 Ų | 86.5 | 46% | 0.455 | 48% | 0.476 | S | S | . | . | G | 310 helix | trans | -80.4 | -11.8 | 179 | 63.9 | -100.3 | 0 | 0 | 0 | 113.7 | H167 F174 | H167-Y169 HydrophobicContact CB-CD1 3.53Å; H167-Y169 HydrophobicContact CB-CE1 3.16Å; H167-Y169 HydrophobicContact CB-CE2 4.25Å; H167-Y169 HydrophobicContact CB-CG 4.22Å; H167-Y169 AromaticContact CD2-CE1 3.91Å; H167-Y169 AromaticContact CD2-CZ 3.74Å; H167-Y169 PolarHBondContact CD2-OH 3.41Å; H167-Y169 AromaticContact CG-CE1 3.45Å; H167-Y169 VanDerWaalsContact CG-CE1 3.45Å; H167-Y169 AromaticContact CG-CZ 3.74Å; H167-Y169 PolarHBondContact O-N 3.01Å; Y169-F174 WeakPolarHBondContact O-CD1 3.3Å |
| 170 | T | 73.3 | Confident | 72.6 | Confident | 32 Ų | 32 | 78.8 Ų | 78.8 | 20% | 0.196 | 44% | 0.439 | C | S | . | . | G | 310 helix | trans | -94.6 | -0.5 | 173.5 | 64.7 | 0 | 0 | 0 | 0 | 112.3 | I153 H167 W168 R172 | I153-T170 HydrophobicContact CG2-CG2 3.58Å; H167-T170 PolarHBondContact N-OG1 2.72Å; H167-T170 PolarHBondContact O-N 3.14Å; H167-T170 PolarHBondContact O-OG1 3.49Å; W168-T170 VanDerWaalsContact C-N 3.32Å; T170-R172 PolarHBondContact O-N 2.9Å |
| 171 | D | 82.4 | Confident | 74.2 | Confident | 82 Ų | 82 | 77.2 Ų | 77.2 | 44% | 0.439 | 43% | 0.43 | S | S | . | . | trans | -64.2 | 125.7 | 175.3 | 179.7 | 22 | 0 | 0 | 0 | 110.4 | W168 K173 F174 T175 | W168-D171 PolarHBondContact O-N 3.26Å; D171-K173 PolarHBondContact O-N 3.32Å; D171-K173 VanDerWaalsContact O-N 3.07Å; D171-K173 PolarHBondContact OD1-N 3.28Å; D171-F174 HydrophobicContact CB-CB 4.29Å; D171-F174 WeakPolarHBondContact O-CA 3.2Å; D171-F174 WeakPolarHBondContact O-CB 3.38Å; D171-F174 PolarHBondContact O-N 3.44Å; D171-T175 PolarHBondContact O-N 2.78Å; D171-T175 PolarHBondContact O-OG1 3.26Å | ||
| 172 | R | 82.3 | Confident | 76.1 | Confident | 45 Ų | 45 | 76.7 Ų | 76.7 | 17% | 0.17 | 43% | 0.426 | C | S | . | . | H | α-helix | trans | -45.8 | -43.4 | 178.5 | 178.4 | 178.1 | 176.6 | -85.4 | 5 | 112 | D147 D150 T170 T175 I176 | D147-R172 IonicContact OD1-CZ 3Å; D147-R172 IonicContact OD1-NE 3.05Å; D147-R172 PolarHBondContact OD1-NE 2.84Å; D147-R172 IonicContact OD1-NH2 2.66Å; D147-R172 PolarHBondContact OD1-NH2 2.78Å; D150-R172 HydrophobicContact CB-CB 4.43Å; D150-R172 HydrophobicContact CB-CG 4.46Å; T170-R172 PolarHBondContact O-N 2.9Å; R172-T175 PolarHBondContact O-N 3.03Å; R172-I176 HydrophobicContact CG-CD1 3.93Å; R172-I176 WeakPolarHBondContact O-CD1 3.33Å; R172-I176 WeakPolarHBondContact O-CG1 3.47Å; R172-I176 PolarHBondContact O-N 3.36Å |
| 173 | K | 85.7 | Confident | 77.9 | Confident | 106 Ų | 106 | 75.4 Ų | 75.4 | 46% | 0.461 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -64.2 | -43.6 | -179.6 | -66.4 | -178.7 | 179.9 | 175.7 | 0 | 111.8 | D171 V177 L382 | D171-K173 PolarHBondContact O-N 3.32Å; D171-K173 VanDerWaalsContact O-N 3.07Å; D171-K173 PolarHBondContact OD1-N 3.28Å; K173-V177 VanDerWaalsContact O-CG2 3.3Å; K173-V177 WeakPolarHBondContact O-CG2 3.32Å; K173-V177 PolarHBondContact O-N 2.89Å; K173-V177 VanDerWaalsContact O-N 3.17Å; K173-L382 HydrophobicContact CB-CD2 4.03Å; K173-L382 HydrophobicContact CG-CD2 4.14Å |
| 174 | F | 86.8 | Confident | 79.8 | Confident | 80 Ų | 80 | 71.9 Ų | 71.9 | 35% | 0.351 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -64 | -46.4 | 177.5 | 178.9 | -101.4 | 0 | 0 | 0 | 111.2 | W168 Y169 D171 I176 V177 V178 | W168-F174 HydrophobicContact CE3-CD2 4.45Å; W168-F174 HydrophobicContact CE3-CE1 4.46Å; W168-F174 HydrophobicContact CE3-CE2 4.33Å; W168-F174 HydrophobicContact CE3-CZ 4.33Å; W168-F174 HydrophobicContact CH2-CZ 4.18Å; W168-F174 HydrophobicContact CZ3-CD1 4.44Å; W168-F174 HydrophobicContact CZ3-CD2 4.19Å; W168-F174 AromaticContact CZ3-CE1 3.89Å; W168-F174 HydrophobicContact CZ3-CE1 3.89Å; W168-F174 AromaticContact CZ3-CE2 3.63Å; W168-F174 HydrophobicContact CZ3-CE2 3.63Å; W168-F174 AromaticContact CZ3-CZ 3.45Å; W168-F174 HydrophobicContact CZ3-CZ 3.45Å; W168-F174 VanDerWaalsContact CZ3-CZ 3.45Å; Y169-F174 WeakPolarHBondContact O-CD1 3.3Å; D171-F174 HydrophobicContact CB-CB 4.29Å; D171-F174 WeakPolarHBondContact O-CA 3.2Å; D171-F174 WeakPolarHBondContact O-CB 3.38Å; D171-F174 PolarHBondContact O-N 3.44Å; F174-I176 PolarHBondContact O-N 2.88Å; F174-V177 PolarHBondContact O-N 3.14Å; F174-V178 HydrophobicContact CD1-CG2 4.09Å; F174-V178 HydrophobicContact CD2-CG2 4.23Å; F174-V178 HydrophobicContact CE1-CG2 3.63Å; F174-V178 HydrophobicContact CE2-CG2 3.76Å; F174-V178 HydrophobicContact CG-CG2 4.38Å; F174-V178 HydrophobicContact CZ-CG2 3.44Å; F174-V178 VanDerWaalsContact CZ-CG2 3.44Å; F174-V178 WeakPolarHBondContact O-CG2 3.33Å; F174-V178 PolarHBondContact O-N 2.97Å |
| 175 | T | 86.6 | Confident | 81.5 | Confident | 15 Ų | 15 | 66.8 Ų | 66.8 | 9% | 0.092 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -63.1 | -39.7 | -179.6 | -51.1 | 0 | 0 | 0 | 0 | 112.8 | L149 I153 D171 R172 T179 | L149-T175 HydrophobicContact CB-CG2 3.73Å; L149-T175 HydrophobicContact CD1-CG2 3.63Å; L149-T175 HydrophobicContact CG-CG2 4.24Å; I153-T175 HydrophobicContact CD1-CG2 3.82Å; D171-T175 PolarHBondContact O-N 2.78Å; D171-T175 PolarHBondContact O-OG1 3.26Å; R172-T175 PolarHBondContact O-N 3.03Å; T175-T179 WeakPolarHBondContact O-CB 3.27Å; T175-T179 PolarHBondContact O-N 3.43Å; T175-T179 PolarHBondContact O-OG1 3Å |
| 176 | I | 87.4 | Confident | 83 | Confident | 0 Ų | 0 | 62.1 Ų | 62.1 | 0% | 0 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -59.6 | -50.9 | 173 | -67.2 | 164.8 | 0 | 0 | 0 | 109.9 | F142 R172 F174 V178 T179 A180 L378 L382 | F142-I176 HydrophobicContact CB-CG2 4.38Å; F142-I176 HydrophobicContact CD1-CG2 4.26Å; R172-I176 HydrophobicContact CG-CD1 3.93Å; R172-I176 WeakPolarHBondContact O-CD1 3.33Å; R172-I176 WeakPolarHBondContact O-CG1 3.47Å; R172-I176 PolarHBondContact O-N 3.36Å; F174-I176 PolarHBondContact O-N 2.88Å; I176-V178 PolarHBondContact O-N 3.38Å; I176-T179 PolarHBondContact O-N 3.36Å; I176-A180 WeakPolarHBondContact O-CB 3.39Å; I176-A180 PolarHBondContact O-N 3.27Å; I176-L378 HydrophobicContact CG2-CD1 3.65Å; I176-L382 HydrophobicContact CB-CD2 4.23Å; I176-L382 HydrophobicContact CD1-CD2 4.16Å; I176-L382 HydrophobicContact CG2-CD2 4.2Å |
| 177 | V | 90 | Very high | 84 | Confident | 54 Ų | 54 | 61.9 Ų | 61.9 | 33% | 0.327 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -61.8 | -44.8 | -177.2 | 172 | 0 | 0 | 0 | 0 | 111.4 | K173 F174 A180 V181 L378 L382 | K173-V177 VanDerWaalsContact O-CG2 3.3Å; K173-V177 WeakPolarHBondContact O-CG2 3.32Å; K173-V177 PolarHBondContact O-N 2.89Å; K173-V177 VanDerWaalsContact O-N 3.17Å; F174-V177 PolarHBondContact O-N 3.14Å; V177-A180 PolarHBondContact O-N 3.41Å; V177-V181 HydrophobicContact CG1-CG2 4.35Å; V177-V181 WeakPolarHBondContact O-CB 3.29Å; V177-V181 VanDerWaalsContact O-CG2 3.31Å; V177-V181 WeakPolarHBondContact O-CG2 3.31Å; V177-V181 PolarHBondContact O-N 3.45Å; V177-L378 HydrophobicContact CG2-CD1 4.43Å; V177-L378 HydrophobicContact CG2-CD2 4.42Å; V177-L382 HydrophobicContact CG2-CD1 4.02Å; V177-L382 HydrophobicContact CG2-CD2 4.35Å |
| 178 | V | 90.4 | Very high | 84.4 | Confident | 50 Ų | 50 | 57.4 Ų | 57.4 | 30% | 0.303 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -62.2 | -50.7 | 179.3 | 170.4 | 0 | 0 | 0 | 0 | 111 | F174 I176 A180 V181 L182 | F174-V178 HydrophobicContact CD1-CG2 4.09Å; F174-V178 HydrophobicContact CD2-CG2 4.23Å; F174-V178 HydrophobicContact CE1-CG2 3.63Å; F174-V178 HydrophobicContact CE2-CG2 3.76Å; F174-V178 HydrophobicContact CG-CG2 4.38Å; F174-V178 HydrophobicContact CZ-CG2 3.44Å; F174-V178 VanDerWaalsContact CZ-CG2 3.44Å; F174-V178 WeakPolarHBondContact O-CG2 3.33Å; F174-V178 PolarHBondContact O-N 2.97Å; I176-V178 PolarHBondContact O-N 3.38Å; V178-A180 VanDerWaalsContact C-N 3.32Å; V178-A180 PolarHBondContact O-N 3.39Å; V178-V181 PolarHBondContact O-N 2.76Å; V178-L182 HydrophobicContact CG1-CD1 3.71Å; V178-L182 HydrophobicContact CG1-CG 4.32Å; V178-L182 VanDerWaalsContact O-CB 3.27Å; V178-L182 WeakPolarHBondContact O-CB 3.3Å; V178-L182 WeakPolarHBondContact O-CG 3.23Å; V178-L182 PolarHBondContact O-N 3.35Å |
| 179 | T | 87.5 | Confident | 84.3 | Confident | 24 Ų | 24 | 53.3 Ų | 53.3 | 15% | 0.147 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -63.1 | -40.8 | 178.8 | -57.9 | 0 | 0 | 0 | 0 | 111.4 | I145 L149 T175 I176 V183 I184 V329 | I145-T179 HydrophobicContact CG2-CG2 4.04Å; L149-T179 HydrophobicContact CD1-CG2 4.2Å; L149-T179 VanDerWaalsContact CD1-OG1 3.3Å; L149-T179 WeakPolarHBondContact CD1-OG1 3.46Å; T175-T179 WeakPolarHBondContact O-CB 3.27Å; T175-T179 PolarHBondContact O-N 3.43Å; T175-T179 PolarHBondContact O-OG1 3Å; I176-T179 PolarHBondContact O-N 3.36Å; T179-V183 HydrophobicContact CG2-CB 4.44Å; T179-V183 HydrophobicContact CG2-CG2 4.4Å; T179-V183 WeakPolarHBondContact O-CA 3.49Å; T179-V183 VanDerWaalsContact O-CB 3.26Å; T179-V183 WeakPolarHBondContact O-CB 3.44Å; T179-V183 PolarHBondContact O-N 3.02Å; T179-I184 PolarHBondContact O-N 2.78Å; T179-V329 HydrophobicContact CG2-CG2 4.42Å |
| 180 | A | 88.3 | Confident | 84.1 | Confident | 0 Ų | 0 | 51.3 Ų | 51.3 | 0% | 0 | 28% | 0.279 | C | S | . | . | I | π-helix | trans | -60.6 | -49.6 | 177.8 | 0 | 0 | 0 | 0 | 0 | 111.5 | F142 I176 V177 V178 I184 L185 F374 L378 | F142-A180 HydrophobicContact CD1-CB 4.16Å; F142-A180 HydrophobicContact CE1-CB 3.39Å; F142-A180 HydrophobicContact CZ-CB 4.03Å; I176-A180 WeakPolarHBondContact O-CB 3.39Å; I176-A180 PolarHBondContact O-N 3.27Å; V177-A180 PolarHBondContact O-N 3.41Å; V178-A180 VanDerWaalsContact C-N 3.32Å; V178-A180 PolarHBondContact O-N 3.39Å; A180-I184 WeakPolarHBondContact O-CB 3.28Å; A180-I184 PolarHBondContact O-N 3.26Å; A180-L185 WeakPolarHBondContact O-CB 3.32Å; A180-L185 PolarHBondContact O-N 2.67Å; A180-F374 HydrophobicContact CB-CE2 4.16Å; A180-F374 HydrophobicContact CB-CZ 3.65Å; A180-F374 WeakPolarHBondContact O-CZ 3.44Å; A180-L378 HydrophobicContact CB-CD1 4.01Å; A180-L378 HydrophobicContact CB-CD2 4.31Å |
| 181 | V | 90.2 | Very high | 83.3 | Confident | 66 Ų | 66 | 54.7 Ų | 54.7 | 40% | 0.4 | 29% | 0.291 | S | S | . | . | I | π-helix | trans | -76.9 | -39.2 | -174.8 | 174.3 | 0 | 0 | 0 | 0 | 112.2 | V177 V178 P186 F374 | V177-V181 HydrophobicContact CG1-CG2 4.35Å; V177-V181 WeakPolarHBondContact O-CB 3.29Å; V177-V181 VanDerWaalsContact O-CG2 3.31Å; V177-V181 WeakPolarHBondContact O-CG2 3.31Å; V177-V181 PolarHBondContact O-N 3.45Å; V178-V181 PolarHBondContact O-N 2.76Å; V181-P186 VanDerWaalsContact O-CD 3.26Å; V181-P186 WeakPolarHBondContact O-CD 3.22Å; V181-F374 HydrophobicContact CG2-CE1 4.45Å |
| 182 | L | 89.3 | Confident | 82 | Confident | 124 Ų | 124 | 56.6 Ų | 56.6 | 65% | 0.649 | 30% | 0.297 | S | S | * | . | I | π-helix | trans | -86.7 | -25.5 | -175.2 | -62.4 | -174.7 | 0 | 0 | 0 | 113.8 | V178 P186 | V178-L182 HydrophobicContact CG1-CD1 3.71Å; V178-L182 HydrophobicContact CG1-CG 4.32Å; V178-L182 VanDerWaalsContact O-CB 3.27Å; V178-L182 WeakPolarHBondContact O-CB 3.3Å; V178-L182 WeakPolarHBondContact O-CG 3.23Å; V178-L182 PolarHBondContact O-N 3.35Å; L182-P186 WeakPolarHBondContact O-CG 3.27Å |
| 183 | V | 88.2 | Confident | 80.8 | Confident | 62 Ų | 62 | 57.5 Ų | 57.5 | 38% | 0.376 | 31% | 0.305 | S | S | . | . | I | π-helix | trans | -116.5 | -57.6 | -174.6 | -168.9 | 0 | 0 | 0 | 0 | 111.1 | T179 P186 L187 V329 | T179-V183 HydrophobicContact CG2-CB 4.44Å; T179-V183 HydrophobicContact CG2-CG2 4.4Å; T179-V183 WeakPolarHBondContact O-CA 3.49Å; T179-V183 VanDerWaalsContact O-CB 3.26Å; T179-V183 WeakPolarHBondContact O-CB 3.44Å; T179-V183 PolarHBondContact O-N 3.02Å; V183-P186 WeakPolarHBondContact O-CD 3.29Å; V183-L187 HydrophobicContact CG1-CD1 3.95Å; V183-L187 WeakPolarHBondContact O-CB 3.34Å; V183-L187 WeakPolarHBondContact O-CD1 3.4Å; V183-L187 VanDerWaalsContact O-CG 3.23Å; V183-L187 WeakPolarHBondContact O-CG 3.24Å; V183-L187 PolarHBondContact O-N 3.39Å; V183-V329 HydrophobicContact CG1-CG1 3.59Å |
| 184 | I | 87.8 | Confident | 79.3 | Confident | 0 Ų | 0 | 55.9 Ų | 55.9 | 0% | 0 | 31% | 0.307 | C | S | . | . | I | π-helix | trans | -70.3 | -45 | -172 | -65 | 170.7 | 0 | 0 | 0 | 112.1 | F142 I145 T179 A180 L187 S188 V329 Y332 F374 | F142-I184 HydrophobicContact CD1-CD1 4.11Å; F142-I184 HydrophobicContact CE1-CD1 3.6Å; I145-I184 HydrophobicContact CD1-CD1 3.48Å; I145-I184 VanDerWaalsContact CD1-CD1 3.48Å; T179-I184 PolarHBondContact O-N 2.78Å; A180-I184 WeakPolarHBondContact O-CB 3.28Å; A180-I184 PolarHBondContact O-N 3.26Å; I184-L187 CarbonylContact O-C 3.33Å; I184-L187 PolarHBondContact O-N 3.03Å; I184-S188 WeakPolarHBondContact O-CB 3.31Å; I184-S188 PolarHBondContact O-N 3.39Å; I184-S188 PolarHBondContact O-OG 3.41Å; I184-V329 HydrophobicContact CD1-CG2 4.25Å; I184-V329 HydrophobicContact CG1-CG1 4.23Å; I184-V329 HydrophobicContact CG1-CG2 4.1Å; I184-Y332 HydrophobicContact CG2-CD1 3.23Å; I184-Y332 HydrophobicContact CG2-CD2 4.25Å; I184-Y332 HydrophobicContact CG2-CE1 3.57Å; I184-Y332 HydrophobicContact CG2-CG 3.63Å; I184-F374 HydrophobicContact CB-CE2 4.36Å; I184-F374 HydrophobicContact CG2-CE2 4.08Å |
| 185 | L | 86.2 | Confident | 78.1 | Confident | 28 Ų | 28 | 58.9 Ų | 58.9 | 15% | 0.147 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -62.4 | -48.5 | -177.4 | 177.8 | 66.1 | 0 | 0 | 0 | 111.7 | A180 L187 S188 I189 L371 F374 | A180-L185 WeakPolarHBondContact O-CB 3.32Å; A180-L185 PolarHBondContact O-N 2.67Å; L185-L187 VanDerWaalsContact C-N 3.28Å; L185-L187 PolarHBondContact O-N 3.39Å; L185-S188 PolarHBondContact O-N 2.9Å; L185-I189 WeakPolarHBondContact O-CG1 3.25Å; L185-I189 PolarHBondContact O-N 3.3Å; L185-L371 HydrophobicContact CD1-CD2 4.09Å; L185-L371 HydrophobicContact CD2-CD2 4.43Å; L185-F374 HydrophobicContact CB-CD2 4.45Å; L185-F374 HydrophobicContact CB-CE1 4.38Å; L185-F374 HydrophobicContact CB-CE2 3.91Å; L185-F374 HydrophobicContact CB-CZ 3.87Å; L185-F374 HydrophobicContact CD1-CD1 4.3Å; L185-F374 HydrophobicContact CD1-CD2 4.28Å; L185-F374 HydrophobicContact CD1-CG 4.16Å; L185-F374 HydrophobicContact CD2-CE1 4.47Å |
| 186 | P | 85.2 | Confident | 76.9 | Confident | 66 Ų | 66 | 59.4 Ų | 59.4 | 43% | 0.429 | 32% | 0.321 | S | S | . | . | H | α-helix | trans | -57.2 | -39 | 172.8 | -28.4 | 36.5 | 0 | 0 | 0 | 113.3 | V181 L182 V183 S188 P190 | V181-P186 VanDerWaalsContact O-CD 3.26Å; V181-P186 WeakPolarHBondContact O-CD 3.22Å; L182-P186 WeakPolarHBondContact O-CG 3.27Å; V183-P186 WeakPolarHBondContact O-CD 3.29Å; P186-S188 VanDerWaalsContact C-N 3.28Å; P186-S188 PolarHBondContact O-N 3.08Å; P186-P190 WeakPolarHBondContact O-CD 3.15Å |
| 187 | L | 81.2 | Confident | 76 | Confident | 64 Ų | 64 | 64.8 Ų | 64.8 | 34% | 0.335 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -71.3 | -20.4 | 177.4 | -71 | 171.1 | 0 | 0 | 0 | 113.6 | V183 I184 L185 P190 V329 P333 | V183-L187 HydrophobicContact CG1-CD1 3.95Å; V183-L187 WeakPolarHBondContact O-CB 3.34Å; V183-L187 WeakPolarHBondContact O-CD1 3.4Å; V183-L187 VanDerWaalsContact O-CG 3.23Å; V183-L187 WeakPolarHBondContact O-CG 3.24Å; V183-L187 PolarHBondContact O-N 3.39Å; I184-L187 CarbonylContact O-C 3.33Å; I184-L187 PolarHBondContact O-N 3.03Å; L185-L187 VanDerWaalsContact C-N 3.28Å; L185-L187 PolarHBondContact O-N 3.39Å; L187-P190 WeakPolarHBondContact O-CD 3.5Å; L187-V329 HydrophobicContact CD1-CG1 3.73Å; L187-P333 HydrophobicContact CB-CG 3.78Å; L187-P333 WeakPolarHBondContact O-CB 3.41Å |
| 188 | S | 79.3 | Confident | 75.2 | Confident | 6 Ų | 6 | 69.4 Ų | 69.4 | 4% | 0.042 | 36% | 0.357 | C | S | . | . | H | α-helix | trans | -91.6 | -9.6 | -177.9 | -57.8 | 0 | 0 | 0 | 0 | 114.1 | I184 L185 P186 | I184-S188 WeakPolarHBondContact O-CB 3.31Å; I184-S188 PolarHBondContact O-N 3.39Å; I184-S188 PolarHBondContact O-OG 3.41Å; L185-S188 PolarHBondContact O-N 2.9Å; P186-S188 VanDerWaalsContact C-N 3.28Å; P186-S188 PolarHBondContact O-N 3.08Å |
| 189 | I | 71.1 | Confident | 74.6 | Confident | 99 Ų | 99 | 67.5 Ų | 67.5 | 51% | 0.508 | 35% | 0.347 | S | S | . | . | S | Bend | trans | -79.7 | -39.8 | 179.6 | -67.4 | 165.4 | 0 | 0 | 0 | 113.6 | L185 | L185-I189 WeakPolarHBondContact O-CG1 3.25Å; L185-I189 PolarHBondContact O-N 3.3Å |
| 190 | P | 66.8 | Low | 74.1 | Confident | 74 Ų | 74 | 66.4 Ų | 66.4 | 48% | 0.481 | 34% | 0.34 | S | S | . | . | trans | -54.6 | 146.9 | -178 | -28.1 | 34.4 | 0 | 0 | 0 | 113.6 | P186 L187 | P186-P190 WeakPolarHBondContact O-CD 3.15Å; L187-P190 WeakPolarHBondContact O-CD 3.5Å | ||
| 191 | K | 56.1 | Low | 73.8 | Confident | 103 Ų | 103 | 68.1 Ų | 68.1 | 45% | 0.448 | 35% | 0.354 | S | S | . | . | S | Bend | trans | -84.6 | -17.8 | 177.9 | -56.1 | -161.4 | 169.9 | -165.7 | 0 | 112.8 | E362 | K191-E362 IonicContact NZ-OE2 3.73Å; K191-E362 PolarHBondContact NZ-OE2 2.93Å |
| 192 | E | 55.8 | Low | 73.5 | Confident | 122 Ų | 122 | 68.4 Ų | 68.4 | 57% | 0.57 | 35% | 0.353 | S | S | * | . | trans | -108.3 | 134.8 | -169.6 | -70.3 | -169.6 | -156.6 | 0 | 0 | 114 | S194 | E192-S194 PolarHBondContact O-N 3.1Å; E192-S194 PolarHBondContact OE2-OG 2.88Å | ||
| 193 | I | 56.9 | Low | 73.3 | Confident | 65 Ų | 65 | 62.6 Ų | 62.6 | 33% | 0.333 | 32% | 0.322 | S | S | . | . | trans | -78.9 | -3.7 | 173.6 | -67.5 | 169.7 | 0 | 0 | 0 | 111.5 | F195 Q196 F337 | I193-F195 VanDerWaalsContact C-N 3.3Å; I193-F195 PolarHBondContact O-N 2.9Å; I193-F195 VanDerWaalsContact O-N 3.15Å; I193-Q196 HydrophobicContact CG2-CB 3.99Å; I193-Q196 WeakPolarHBondContact O-CB 3.27Å; I193-Q196 PolarHBondContact O-N 2.92Å; I193-F337 HydrophobicContact CD1-CE1 4.35Å | ||
| 194 | S | 55.1 | Low | 73.1 | Confident | 72 Ų | 72 | 60.1 Ų | 60.1 | 50% | 0.503 | 31% | 0.308 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -59.3 | -32 | -169.1 | -52.9 | 0 | 0 | 0 | 0 | 114.8 | E192 Q196 | E192-S194 PolarHBondContact O-N 3.1Å; E192-S194 PolarHBondContact OE2-OG 2.88Å; S194-Q196 VanDerWaalsContact C-N 3.31Å |
| 195 | F | 61.4 | Low | 73.2 | Confident | 143 Ų | 143 | 66.2 Ų | 66.2 | 63% | 0.627 | 34% | 0.338 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -75.1 | -21 | 175.7 | -177.3 | -106.7 | 0 | 0 | 0 | 112.9 | I193 K197 Y198 | I193-F195 VanDerWaalsContact C-N 3.3Å; I193-F195 PolarHBondContact O-N 2.9Å; I193-F195 VanDerWaalsContact O-N 3.15Å; F195-K197 VanDerWaalsContact C-N 3.3Å; F195-K197 PolarHBondContact O-N 2.95Å; F195-Y198 PolarHBondContact O-N 3.5Å |
| 196 | Q | 61.7 | Low | 73.4 | Confident | 25 Ų | 25 | 64.9 Ų | 64.9 | 12% | 0.117 | 33% | 0.331 | C | S | . | . | H | α-helix | trans | -66.9 | -27.1 | -169.4 | -162.2 | -175.6 | -57.3 | 0 | 0 | 113.2 | I193 S194 Y198 A199 S200 I334 | I193-Q196 HydrophobicContact CG2-CB 3.99Å; I193-Q196 WeakPolarHBondContact O-CB 3.27Å; I193-Q196 PolarHBondContact O-N 2.92Å; S194-Q196 VanDerWaalsContact C-N 3.31Å; Q196-Y198 VanDerWaalsContact C-N 3.26Å; Q196-Y198 PolarHBondContact O-N 2.86Å; Q196-A199 PolarHBondContact O-N 3.49Å; Q196-S200 WeakPolarHBondContact O-CB 3.46Å; Q196-S200 PolarHBondContact O-N 2.91Å; Q196-S200 PolarHBondContact O-OG 3.42Å; Q196-I334 HydrophobicContact CG-CD1 3.8Å; Q196-I334 HydrophobicContact CG-CG1 4.11Å; Q196-I334 VanDerWaalsContact OE1-CG1 3.31Å |
| 197 | K | 67.8 | Low | 73.7 | Confident | 113 Ų | 113 | 61.7 Ų | 61.7 | 49% | 0.491 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -60.4 | -35.3 | 177.7 | 69.5 | -175.3 | -178.7 | -178.8 | 0 | 112.9 | F195 A201 | F195-K197 VanDerWaalsContact C-N 3.3Å; F195-K197 PolarHBondContact O-N 2.95Å; K197-A201 PolarHBondContact O-N 3.14Å |
| 198 | Y | 73.8 | Confident | 74.3 | Confident | 152 Ų | 152 | 63.5 Ų | 63.5 | 60% | 0.596 | 31% | 0.313 | S | S | * | . | H | α-helix | trans | -76.2 | -40.9 | 177.8 | -62.8 | -73.5 | 0 | 0 | 0 | 110.8 | F195 Q196 S200 A201 L202 | F195-Y198 PolarHBondContact O-N 3.5Å; Q196-Y198 VanDerWaalsContact C-N 3.26Å; Q196-Y198 PolarHBondContact O-N 2.86Å; Y198-S200 VanDerWaalsContact C-N 3.34Å; Y198-S200 PolarHBondContact O-N 3.13Å; Y198-A201 PolarHBondContact O-N 2.88Å; Y198-L202 PolarHBondContact O-N 3.43Å |
| 199 | A | 76.3 | Confident | 75 | Confident | 10 Ų | 10 | 66.2 Ų | 66.2 | 8% | 0.083 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -62.3 | -39.8 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | Q196 L202 S203 T330 | Q196-A199 PolarHBondContact O-N 3.49Å; A199-L202 PolarHBondContact O-N 2.84Å; A199-S203 WeakPolarHBondContact O-CB 3.43Å; A199-S203 PolarHBondContact O-N 3.31Å; A199-T330 HydrophobicContact CB-CG2 3.75Å |
| 200 | S | 77.3 | Confident | 76.1 | Confident | 0 Ų | 0 | 61.5 Ų | 61.5 | 0% | 0 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -62 | -41.9 | 175.1 | -69 | 0 | 0 | 0 | 0 | 112.3 | N57 Q196 Y198 S203 V204 | N57-S200 PolarHBondContact ND2-OG 3.26Å; Q196-S200 WeakPolarHBondContact O-CB 3.46Å; Q196-S200 PolarHBondContact O-N 2.91Å; Q196-S200 PolarHBondContact O-OG 3.42Å; Y198-S200 VanDerWaalsContact C-N 3.34Å; Y198-S200 PolarHBondContact O-N 3.13Å; S200-S203 PolarHBondContact O-N 3.21Å; S200-V204 WeakPolarHBondContact O-CB 3.45Å; S200-V204 VanDerWaalsContact O-CG2 3.25Å; S200-V204 WeakPolarHBondContact O-CG2 3.48Å; S200-V204 PolarHBondContact O-N 3.03Å |
| 201 | A | 82.4 | Confident | 77.5 | Confident | 36 Ų | 36 | 58.1 Ų | 58.1 | 30% | 0.298 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -63 | -45 | 176.8 | 0 | 0 | 0 | 0 | 0 | 111.7 | K197 Y198 V204 M205 | K197-A201 PolarHBondContact O-N 3.14Å; Y198-A201 PolarHBondContact O-N 2.88Å; A201-V204 PolarHBondContact O-N 3.28Å; A201-M205 WeakPolarHBondContact O-CG 3.43Å; A201-M205 PolarHBondContact O-N 3.43Å |
| 202 | L | 84.4 | Confident | 79.4 | Confident | 73 Ų | 73 | 57.5 Ų | 57.5 | 38% | 0.382 | 28% | 0.277 | S | S | . | . | H | α-helix | trans | -63 | -43 | 177.6 | -177.9 | 62 | 0 | 0 | 0 | 112.1 | Y198 A199 M205 G206 F323 I326 | Y198-L202 PolarHBondContact O-N 3.43Å; A199-L202 PolarHBondContact O-N 2.84Å; L202-M205 PolarHBondContact O-N 3.19Å; L202-G206 PolarHBondContact O-N 2.87Å; L202-F323 HydrophobicContact CD1-CE1 4.33Å; L202-I326 HydrophobicContact CD2-CG2 3.7Å; L202-I326 HydrophobicContact CG-CG2 4.19Å |
| 203 | S | 83.4 | Confident | 81.2 | Confident | 1 Ų | 1 | 52.1 Ų | 52.1 | 1% | 0.007 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -62 | -45.6 | 176.1 | 172.2 | 0 | 0 | 0 | 0 | 112.2 | N57 A199 S200 M205 G206 T207 C327 | N57-S203 WeakPolarHBondContact OD1-CB 3.27Å; N57-S203 PolarHBondContact OD1-OG 2.91Å; A199-S203 WeakPolarHBondContact O-CB 3.43Å; A199-S203 PolarHBondContact O-N 3.31Å; S200-S203 PolarHBondContact O-N 3.21Å; S203-M205 VanDerWaalsContact C-N 3.33Å; S203-M205 PolarHBondContact O-N 3.05Å; S203-G206 PolarHBondContact O-N 3.46Å; S203-G206 VanDerWaalsContact O-N 3.13Å; S203-T207 WeakPolarHBondContact O-CG2 3.48Å; S203-T207 PolarHBondContact O-N 3.47Å; S203-T207 PolarHBondContact O-OG1 3.23Å; S203-C327 PolarHBondContact OG-SG 3.17Å |
| 204 | V | 85.9 | Confident | 83 | Confident | 11 Ų | 11 | 49 Ų | 49 | 7% | 0.067 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -61 | -42.5 | 175.4 | 172.5 | 0 | 0 | 0 | 0 | 111.2 | F53 V56 N57 S200 A201 G206 T207 W208 | F53-V204 HydrophobicContact CD1-CB 4.33Å; F53-V204 HydrophobicContact CD1-CG1 4.33Å; F53-V204 HydrophobicContact CD1-CG2 4.25Å; F53-V204 HydrophobicContact CE1-CG1 4.35Å; V56-V204 HydrophobicContact CB-CG2 4.15Å; V56-V204 HydrophobicContact CG1-CG1 4.19Å; V56-V204 HydrophobicContact CG1-CG2 3.66Å; N57-V204 HydrophobicContact CB-CG2 4.37Å; S200-V204 WeakPolarHBondContact O-CB 3.45Å; S200-V204 VanDerWaalsContact O-CG2 3.25Å; S200-V204 WeakPolarHBondContact O-CG2 3.48Å; S200-V204 PolarHBondContact O-N 3.03Å; A201-V204 PolarHBondContact O-N 3.28Å; V204-G206 VanDerWaalsContact C-N 3.34Å; V204-G206 PolarHBondContact O-N 3.36Å; V204-T207 WeakPolarHBondContact CA-OG1 3.3Å; V204-T207 PolarHBondContact O-N 3.41Å; V204-T207 PolarHBondContact O-OG1 3.43Å; V204-W208 PolarHBondContact O-N 2.95Å; V204-W208 VanDerWaalsContact O-N 3.13Å |
| 205 | M | 89.9 | Confident | 84.9 | Confident | 127 Ų | 127 | 48.3 Ų | 48.3 | 63% | 0.626 | 23% | 0.226 | S | C | * | . | H | α-helix | trans | -60.9 | -43.2 | 173.8 | -71.3 | 175.6 | 57 | 0 | 0 | 112.3 | A201 L202 S203 W208 Y209 | A201-M205 WeakPolarHBondContact O-CG 3.43Å; A201-M205 PolarHBondContact O-N 3.43Å; L202-M205 PolarHBondContact O-N 3.19Å; S203-M205 VanDerWaalsContact C-N 3.33Å; S203-M205 PolarHBondContact O-N 3.05Å; M205-W208 PolarHBondContact O-N 3.2Å; M205-Y209 PolarHBondContact O-N 2.99Å |
| 206 | G | 90.5 | Very high | 86.4 | Confident | 0 Ų | 0 | 45 Ų | 45 | 0% | 0 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -62.1 | -42.4 | 177.8 | 0 | 0 | 0 | 0 | 0 | 113.3 | L202 S203 V204 W208 Y209 V210 F323 | L202-G206 PolarHBondContact O-N 2.87Å; S203-G206 PolarHBondContact O-N 3.46Å; S203-G206 VanDerWaalsContact O-N 3.13Å; V204-G206 VanDerWaalsContact C-N 3.34Å; V204-G206 PolarHBondContact O-N 3.36Å; G206-W208 PolarHBondContact O-N 2.79Å; G206-Y209 WeakPolarHBondContact O-CB 3.44Å; G206-Y209 PolarHBondContact O-N 3.41Å; G206-V210 VanDerWaalsContact O-CG2 3.25Å; G206-V210 WeakPolarHBondContact O-CG2 3.41Å; G206-V210 PolarHBondContact O-N 3.2Å; G206-F323 VanDerWaalsContact CA-CD1 3.48Å |
| 207 | T | 90.4 | Very high | 87.8 | Confident | 0 Ų | 0 | 44.8 Ų | 44.8 | 0% | 0 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -66.5 | -36.4 | 177.6 | 58.1 | 0 | 0 | 0 | 0 | 112.7 | L60 L64 S203 V204 V210 T211 | L60-T207 HydrophobicContact CB-CG2 4Å; L60-T207 WeakPolarHBondContact CD1-OG1 3.31Å; L60-T207 WeakPolarHBondContact O-CG2 3.24Å; L64-T207 HydrophobicContact CD2-CG2 4.4Å; S203-T207 WeakPolarHBondContact O-CG2 3.48Å; S203-T207 PolarHBondContact O-N 3.47Å; S203-T207 PolarHBondContact O-OG1 3.23Å; V204-T207 WeakPolarHBondContact CA-OG1 3.3Å; V204-T207 PolarHBondContact O-N 3.41Å; V204-T207 PolarHBondContact O-OG1 3.43Å; T207-V210 PolarHBondContact O-N 3.44Å; T207-T211 PolarHBondContact O-N 2.86Å; T207-T211 PolarHBondContact O-OG1 3.49Å |
| 208 | W | 93.6 | Very high | 88.8 | Confident | 102 Ų | 102 | 43.8 Ų | 43.8 | 39% | 0.386 | 21% | 0.21 | S | C | . | . | H | α-helix | trans | -64.5 | -42.3 | 169.7 | -90.1 | 100.1 | 0 | 0 | 0 | 112.1 | V204 M205 G206 V210 T211 I212 I282 F285 V286 | V204-W208 PolarHBondContact O-N 2.95Å; V204-W208 VanDerWaalsContact O-N 3.13Å; M205-W208 PolarHBondContact O-N 3.2Å; G206-W208 PolarHBondContact O-N 2.79Å; W208-V210 PolarHBondContact O-N 3.06Å; W208-T211 WeakPolarHBondContact O-CB 3.23Å; W208-T211 PolarHBondContact O-N 2.93Å; W208-I212 VanDerWaalsContact O-CG1 3.25Å; W208-I212 WeakPolarHBondContact O-CG1 3.14Å; W208-I212 PolarHBondContact O-N 3.09Å; W208-I282 HydrophobicContact CZ2-CG2 4.43Å; W208-F285 HydrophobicContact CH2-CB 4.44Å; W208-V286 HydrophobicContact CD2-CG2 3.88Å; W208-V286 HydrophobicContact CE3-CG2 4.33Å; W208-V286 HydrophobicContact CG-CG2 4.36Å; W208-V286 HydrophobicContact CH2-CG2 4.19Å; W208-V286 HydrophobicContact CZ2-CG2 3.72Å; W208-V286 HydrophobicContact CZ3-CG2 4.47Å |
| 209 | Y | 94.9 | Very high | 89.6 | Confident | 63 Ų | 63 | 41.3 Ų | 41.3 | 25% | 0.247 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -58.6 | -47.8 | 175.1 | 179 | -94.1 | 0 | 0 | 0 | 111.5 | M205 G206 T211 I212 V213 A316 L319 A320 F323 | M205-Y209 PolarHBondContact O-N 2.99Å; G206-Y209 WeakPolarHBondContact O-CB 3.44Å; G206-Y209 PolarHBondContact O-N 3.41Å; Y209-T211 VanDerWaalsContact C-N 3.31Å; Y209-T211 PolarHBondContact O-N 3.45Å; Y209-I212 PolarHBondContact O-N 2.97Å; Y209-V213 HydrophobicContact CD1-CG2 4.06Å; Y209-V213 HydrophobicContact CE1-CG2 3.58Å; Y209-V213 HydrophobicContact CE2-CG2 4.19Å; Y209-V213 WeakPolarHBondContact O-CG2 3.46Å; Y209-V213 PolarHBondContact O-N 3.22Å; Y209-A316 PolarHBondContact OH-O 3.01Å; Y209-L319 HydrophobicContact CE1-CB 3.76Å; Y209-L319 WeakPolarHBondContact OH-CB 3.46Å; Y209-A320 HydrophobicContact CD1-CB 4.04Å; Y209-A320 HydrophobicContact CE1-CB 3.87Å; Y209-F323 AromaticContact CD1-CD2 3.57Å; Y209-F323 HydrophobicContact CD1-CD2 3.57Å; Y209-F323 AromaticContact CD1-CE2 3.98Å; Y209-F323 HydrophobicContact CD1-CE2 3.98Å; Y209-F323 HydrophobicContact CD2-CE2 4.49Å; Y209-F323 HydrophobicContact CE1-CD2 4.13Å; Y209-F323 HydrophobicContact CE1-CE2 4.39Å; Y209-F323 AromaticContact CG-CD2 3.98Å; Y209-F323 HydrophobicContact CG-CD2 3.98Å; Y209-F323 HydrophobicContact CG-CE2 4.03Å |
| 210 | V | 94.3 | Very high | 90.1 | Very high | 0 Ų | 0 | 50.4 Ų | 50.4 | 0% | 0 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -55.4 | -47.4 | 175.4 | 172.9 | 0 | 0 | 0 | 0 | 110.9 | L64 L65 G206 T207 W208 I212 V213 V214 L307 A320 I324 | L64-V210 HydrophobicContact CD2-CB 4.38Å; L64-V210 HydrophobicContact CD2-CG1 4.14Å; L65-V210 HydrophobicContact CD2-CG1 4.25Å; G206-V210 VanDerWaalsContact O-CG2 3.25Å; G206-V210 WeakPolarHBondContact O-CG2 3.41Å; G206-V210 PolarHBondContact O-N 3.2Å; T207-V210 PolarHBondContact O-N 3.44Å; W208-V210 PolarHBondContact O-N 3.06Å; V210-I212 PolarHBondContact O-N 3.42Å; V210-V213 PolarHBondContact O-N 3.4Å; V210-V214 WeakPolarHBondContact O-CG2 3.2Å; V210-V214 PolarHBondContact O-N 3.28Å; V210-L307 HydrophobicContact CG1-CD1 4.41Å; V210-L307 HydrophobicContact CG1-CD2 4.43Å; V210-A320 HydrophobicContact CG2-CB 3.89Å; V210-I324 HydrophobicContact CG2-CD1 3.77Å; V210-I324 HydrophobicContact CG2-CG1 3.69Å |
| 211 | T | 95.2 | Very high | 90.3 | Very high | 2 Ų | 2 | 53.4 Ų | 53.4 | 1% | 0.012 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -60.1 | -45.6 | 178.2 | -55.4 | 0 | 0 | 0 | 0 | 111.7 | T207 W208 Y209 V214 I215 V286 T290 | T207-T211 PolarHBondContact O-N 2.86Å; T207-T211 PolarHBondContact O-OG1 3.49Å; W208-T211 WeakPolarHBondContact O-CB 3.23Å; W208-T211 PolarHBondContact O-N 2.93Å; Y209-T211 VanDerWaalsContact C-N 3.31Å; Y209-T211 PolarHBondContact O-N 3.45Å; T211-V214 PolarHBondContact O-N 3.18Å; T211-I215 HydrophobicContact CG2-CD1 3.87Å; T211-I215 VanDerWaalsContact O-CG1 3.28Å; T211-I215 WeakPolarHBondContact O-CG1 2.93Å; T211-I215 PolarHBondContact O-N 2.89Å; T211-V286 WeakPolarHBondContact OG1-CG1 3.42Å; T211-T290 WeakPolarHBondContact CG2-OG1 3.45Å; T211-T290 PolarHBondContact OG1-OG1 2.84Å |
| 212 | I | 95.8 | Very high | 89.8 | Confident | 90 Ų | 90 | 54.5 Ų | 54.5 | 46% | 0.462 | 26% | 0.259 | S | S | . | . | H | α-helix | trans | -62.7 | -43.9 | 178.9 | -68.8 | 163.5 | 0 | 0 | 0 | 110.4 | W208 Y209 V210 V214 I215 V216 | W208-I212 VanDerWaalsContact O-CG1 3.25Å; W208-I212 WeakPolarHBondContact O-CG1 3.14Å; W208-I212 PolarHBondContact O-N 3.09Å; Y209-I212 PolarHBondContact O-N 2.97Å; V210-I212 PolarHBondContact O-N 3.42Å; I212-V214 PolarHBondContact O-N 3.1Å; I212-I215 PolarHBondContact O-N 3.46Å; I212-V216 HydrophobicContact CG2-CG2 4.17Å; I212-V216 WeakPolarHBondContact O-CB 3.36Å; I212-V216 VanDerWaalsContact O-CG2 3.28Å; I212-V216 WeakPolarHBondContact O-CG2 3.13Å; I212-V216 PolarHBondContact O-N 2.95Å |
| 213 | V | 94.9 | Very high | 88.9 | Confident | 10 Ų | 10 | 60.6 Ų | 60.6 | 6% | 0.061 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -59.7 | -46.5 | 176.9 | 170 | 0 | 0 | 0 | 0 | 110.8 | Y209 V210 I215 V216 K217 A316 V317 A320 | Y209-V213 HydrophobicContact CD1-CG2 4.06Å; Y209-V213 HydrophobicContact CE1-CG2 3.58Å; Y209-V213 HydrophobicContact CE2-CG2 4.19Å; Y209-V213 WeakPolarHBondContact O-CG2 3.46Å; Y209-V213 PolarHBondContact O-N 3.22Å; V210-V213 PolarHBondContact O-N 3.4Å; V213-I215 VanDerWaalsContact C-N 3.35Å; V213-I215 PolarHBondContact O-N 2.71Å; V213-V216 PolarHBondContact O-N 2.84Å; V213-K217 HydrophobicContact CG1-CG 4.36Å; V213-K217 WeakPolarHBondContact O-CB 3.37Å; V213-K217 VanDerWaalsContact O-CG 3.31Å; V213-K217 WeakPolarHBondContact O-CG 3.25Å; V213-K217 PolarHBondContact O-N 3.07Å; V213-A316 HydrophobicContact CG1-CB 4.44Å; V213-A316 HydrophobicContact CG2-CB 4.34Å; V213-V317 HydrophobicContact CG1-CG2 3.98Å; V213-A320 HydrophobicContact CG2-CB 4.49Å |
| 214 | V | 94.1 | Very high | 87.9 | Confident | 0 Ų | 0 | 67.8 Ų | 67.8 | 0% | 0 | 32% | 0.321 | C | S | . | . | H | α-helix | trans | -61.3 | -42.3 | 177.7 | 172.5 | 0 | 0 | 0 | 0 | 111.6 | V210 T211 I212 Y218 T290 C293 Y310 | V210-V214 WeakPolarHBondContact O-CG2 3.2Å; V210-V214 PolarHBondContact O-N 3.28Å; T211-V214 PolarHBondContact O-N 3.18Å; I212-V214 PolarHBondContact O-N 3.1Å; V214-Y218 PolarHBondContact O-N 3.21Å; V214-Y218 VanDerWaalsContact O-N 3.12Å; V214-T290 HydrophobicContact CG1-CG2 4.43Å; V214-T290 HydrophobicContact CG2-CG2 4.4Å; V214-C293 HydrophobicContact CG1-CB 4.01Å; V214-Y310 HydrophobicContact CG2-CE2 4.27Å |
| 215 | I | 94.6 | Very high | 86.7 | Confident | 56 Ų | 56 | 68.2 Ų | 68.2 | 29% | 0.287 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -65 | -46.8 | 176.5 | -68 | 167.5 | 0 | 0 | 0 | 111.1 | T211 I212 V213 K217 Y218 I219 C293 | T211-I215 HydrophobicContact CG2-CD1 3.87Å; T211-I215 VanDerWaalsContact O-CG1 3.28Å; T211-I215 WeakPolarHBondContact O-CG1 2.93Å; T211-I215 PolarHBondContact O-N 2.89Å; I212-I215 PolarHBondContact O-N 3.46Å; V213-I215 VanDerWaalsContact C-N 3.35Å; V213-I215 PolarHBondContact O-N 2.71Å; I215-K217 VanDerWaalsContact C-N 3.33Å; I215-K217 PolarHBondContact O-N 3.44Å; I215-Y218 WeakPolarHBondContact O-CB 3.15Å; I215-Y218 PolarHBondContact O-N 2.98Å; I215-I219 HydrophobicContact CG2-CD1 3.83Å; I215-I219 WeakPolarHBondContact O-CG1 3.23Å; I215-I219 PolarHBondContact O-N 3.42Å; I215-I219 VanDerWaalsContact O-N 3.08Å; I215-C293 HydrophobicContact CG1-CB 4.25Å |
| 216 | V | 93.6 | Very high | 85.2 | Confident | 74 Ų | 74 | 68.7 Ų | 68.7 | 45% | 0.448 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -61.7 | -43.6 | -179.7 | 168.1 | 0 | 0 | 0 | 0 | 110.5 | I212 V213 Y218 I219 W220 | I212-V216 HydrophobicContact CG2-CG2 4.17Å; I212-V216 WeakPolarHBondContact O-CB 3.36Å; I212-V216 VanDerWaalsContact O-CG2 3.28Å; I212-V216 WeakPolarHBondContact O-CG2 3.13Å; I212-V216 PolarHBondContact O-N 2.95Å; V213-V216 PolarHBondContact O-N 2.84Å; V216-Y218 VanDerWaalsContact C-N 3.27Å; V216-Y218 PolarHBondContact O-N 2.98Å; V216-I219 PolarHBondContact O-N 3.2Å; V216-W220 PolarHBondContact O-N 2.93Å |
| 217 | K | 90.2 | Very high | 83.7 | Confident | 20 Ų | 20 | 71.4 Ų | 71.4 | 9% | 0.087 | 35% | 0.345 | C | S | . | . | H | α-helix | trans | -66.7 | -27.4 | 178.1 | -72.6 | -75.2 | 160.1 | 172.4 | 0 | 113.7 | V213 I215 W220 P221 D222 Y310 D314 | V213-K217 HydrophobicContact CG1-CG 4.36Å; V213-K217 WeakPolarHBondContact O-CB 3.37Å; V213-K217 VanDerWaalsContact O-CG 3.31Å; V213-K217 WeakPolarHBondContact O-CG 3.25Å; V213-K217 PolarHBondContact O-N 3.07Å; I215-K217 VanDerWaalsContact C-N 3.33Å; I215-K217 PolarHBondContact O-N 3.44Å; K217-W220 CarbonylContact O-C 3.48Å; K217-P221 VanDerWaalsContact O-CA 3.22Å; K217-P221 WeakPolarHBondContact O-CA 3.49Å; K217-D222 IonicContact NZ-OD1 2.88Å; K217-D222 PolarHBondContact NZ-OD1 3.44Å; K217-D222 IonicContact NZ-OD2 2.61Å; K217-D222 PolarHBondContact NZ-OD2 2.95Å; K217-Y310 HydrophobicContact CB-CE1 3.61Å; K217-Y310 HydrophobicContact CD-CE1 4.35Å; K217-Y310 HydrophobicContact CG-CD1 4.45Å; K217-Y310 HydrophobicContact CG-CE1 3.81Å; K217-D314 WeakPolarHBondContact CE-OD2 3.36Å; K217-D314 IonicContact NZ-OD1 3.88Å; K217-D314 IonicContact NZ-OD2 2.61Å; K217-D314 PolarHBondContact NZ-OD2 3.34Å |
| 218 | Y | 89.9 | Confident | 82 | Confident | 93 Ų | 93 | 76.1 Ų | 76.1 | 37% | 0.365 | 37% | 0.37 | S | S | . | . | H | α-helix | trans | -71.6 | -41.5 | 171.2 | 170.8 | -108.6 | 0 | 0 | 0 | 112.2 | V214 I215 V216 C293 L296 | V214-Y218 PolarHBondContact O-N 3.21Å; V214-Y218 VanDerWaalsContact O-N 3.12Å; I215-Y218 WeakPolarHBondContact O-CB 3.15Å; I215-Y218 PolarHBondContact O-N 2.98Å; V216-Y218 VanDerWaalsContact C-N 3.27Å; V216-Y218 PolarHBondContact O-N 2.98Å; Y218-C293 HydrophobicContact CD1-CB 4.22Å; Y218-C293 HydrophobicContact CG-CB 4.02Å; Y218-L296 HydrophobicContact CD2-CB 3.87Å; Y218-L296 HydrophobicContact CE1-CD1 4.35Å; Y218-L296 HydrophobicContact CE2-CB 3.36Å; Y218-L296 HydrophobicContact CE2-CD1 4.06Å; Y218-L296 HydrophobicContact CE2-CG 4.35Å |
| 219 | I | 89.9 | Confident | 80.2 | Confident | 100 Ų | 100 | 79.4 Ų | 79.4 | 51% | 0.513 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -76.5 | -40.1 | -178.1 | -60.1 | 170 | 0 | 0 | 0 | 111.4 | I215 V216 P221 | I215-I219 HydrophobicContact CG2-CD1 3.83Å; I215-I219 WeakPolarHBondContact O-CG1 3.23Å; I215-I219 PolarHBondContact O-N 3.42Å; I215-I219 VanDerWaalsContact O-N 3.08Å; V216-I219 PolarHBondContact O-N 3.2Å; I219-P221 VanDerWaalsContact C-CD 3.48Å; I219-P221 WeakPolarHBondContact O-CD 3.32Å |
| 220 | W | 87.6 | Confident | 78.1 | Confident | 200 Ų | 200 | 77.4 Ų | 77.4 | 76% | 0.758 | 39% | 0.386 | S | S | * | . | S | Bend | trans | -119.7 | 79.1 | 175.7 | -95.3 | -83.2 | 0 | 0 | 0 | 109.7 | V216 K217 | V216-W220 PolarHBondContact O-N 2.93Å; K217-W220 CarbonylContact O-C 3.48Å |
| 221 | P | 80.5 | Confident | 76.2 | Confident | 64 Ų | 64 | 82.9 Ų | 82.9 | 42% | 0.416 | 42% | 0.421 | S | S | . | . | trans | -66.7 | 142.9 | 176.4 | 25.8 | -31.8 | 0 | 0 | 0 | 110.9 | K217 I219 M225 | K217-P221 VanDerWaalsContact O-CA 3.22Å; K217-P221 WeakPolarHBondContact O-CA 3.49Å; I219-P221 VanDerWaalsContact C-CD 3.48Å; I219-P221 WeakPolarHBondContact O-CD 3.32Å; P221-M225 HydrophobicContact CB-CB 4.26Å | ||
| 222 | D | 73.1 | Confident | 74.4 | Confident | 58 Ų | 58 | 85.5 Ų | 85.5 | 31% | 0.31 | 44% | 0.443 | S | S | . | . | trans | -68.6 | 158.2 | 170.9 | -59.4 | -39.7 | 0 | 0 | 0 | 110 | K217 D224 M225 | K217-D222 IonicContact NZ-OD1 2.88Å; K217-D222 PolarHBondContact NZ-OD1 3.44Å; K217-D222 IonicContact NZ-OD2 2.61Å; K217-D222 PolarHBondContact NZ-OD2 2.95Å; D222-D224 PolarHBondContact O-N 2.7Å; D222-M225 HydrophobicContact CB-CG 4.34Å; D222-M225 PolarHBondContact O-N 3.27Å | ||
| 223 | K | 64.2 | Low | 72.7 | Confident | 202 Ų | 202 | 85.2 Ų | 85.2 | 88% | 0.878 | 45% | 0.446 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -57.7 | -22.8 | -174.6 | -70.1 | 178.7 | -179.9 | 171.9 | 0 | 114.2 | ||
| 224 | D | 62.7 | Low | 71.2 | Confident | 152 Ų | 152 | 90 Ų | 90 | 81% | 0.813 | 48% | 0.479 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -95.5 | -5.9 | -179 | -53.9 | -46.8 | 0 | 0 | 0 | 112.9 | D222 | D222-D224 PolarHBondContact O-N 2.7Š|
| 225 | M | 61.8 | Low | 70.1 | Confident | 20 Ų | 20 | 93.1 Ų | 93.1 | 10% | 0.099 | 51% | 0.506 | C | S | . | . | trans | -100 | 82.5 | 177 | -63.3 | -173.1 | 77.3 | 0 | 0 | 109.7 | P221 D222 P227 T297 F298 Y310 | P221-M225 HydrophobicContact CB-CB 4.26Å; D222-M225 HydrophobicContact CB-CG 4.34Å; D222-M225 PolarHBondContact O-N 3.27Å; M225-P227 WeakPolarHBondContact O-CD 3.35Å; M225-T297 HydrophobicContact CE-CG2 3.38Å; M225-F298 HydrophobicContact CE-CE1 3.48Å; M225-F298 VanDerWaalsContact CE-CE1 3.48Å; M225-F298 HydrophobicContact CE-CE2 4.39Å; M225-F298 HydrophobicContact CE-CZ 3.39Å; M225-Y310 HydrophobicContact CE-CD1 3.62Å; M225-Y310 HydrophobicContact CE-CE1 3.41Å; M225-Y310 VanDerWaalsContact CE-CE1 3.41Å; M225-Y310 HydrophobicContact SD-CD1 3.94Å; M225-Y310 HydrophobicContact SD-CE1 3.99Å | ||
| 226 | N | 58.3 | Low | 69.6 | Low | 137 Ų | 137 | 92.7 Ų | 92.7 | 73% | 0.733 | 51% | 0.507 | S | S | * | . | trans | -76.5 | 121.6 | 166.5 | -77.5 | -27.9 | 0 | 0 | 0 | 108.4 | D228 | N226-D228 VanDerWaalsContact C-N 3.28Å; N226-D228 PolarHBondContact O-N 2.95Å | ||
| 227 | P | 57.6 | Low | 69 | Low | 56 Ų | 56 | 99 Ų | 99 | 36% | 0.364 | 52% | 0.524 | S | S | . | . | trans | -63.5 | 97.6 | 170.4 | 24.6 | -30.2 | 0 | 0 | 0 | 107.4 | M225 H229 | M225-P227 WeakPolarHBondContact O-CD 3.35Å; P227-H229 PolarHBondContact O-N 3.2Å; P227-H229 VanDerWaalsContact O-N 3.07Å; P227-H229 PolarHBondContact O-ND1 3.42Å | ||
| 228 | D | 54.8 | Low | 68.7 | Low | 100 Ų | 100 | 102.6 Ų | 102.6 | 54% | 0.535 | 55% | 0.547 | S | S | . | . | trans | -65.2 | 116 | 177 | -144.3 | 5 | 0 | 0 | 0 | 105.5 | N226 A230 | N226-D228 VanDerWaalsContact C-N 3.28Å; N226-D228 PolarHBondContact O-N 2.95Å; D228-A230 PolarHBondContact O-N 3.17Å | ||
| 229 | H | 55.8 | Low | 68.5 | Low | 170 Ų | 170 | 99 Ų | 99 | 79% | 0.787 | 54% | 0.536 | S | S | * | . | trans | -75.3 | 51.1 | 175 | -69.1 | 59.5 | 0 | 0 | 0 | 108.4 | P227 P231 | P227-H229 PolarHBondContact O-N 3.2Å; P227-H229 VanDerWaalsContact O-N 3.07Å; P227-H229 PolarHBondContact O-ND1 3.42Å; H229-P231 WeakPolarHBondContact O-CD 3.37Å | ||
| 230 | A | 52.1 | Low | 68.4 | Low | 21 Ų | 21 | 95.3 Ų | 95.3 | 17% | 0.174 | 52% | 0.518 | C | S | . | . | P | Polyproline II helix | trans | -56.1 | 117.2 | 172.9 | 0 | 0 | 0 | 0 | 0 | 106 | D228 A232 S300 | D228-A230 PolarHBondContact O-N 3.17Å; A230-A232 PolarHBondContact O-N 3.22Å; A230-A232 VanDerWaalsContact O-N 3.15Å; A230-S300 WeakPolarHBondContact CB-OG 3.39Å |
| 231 | P | 54 | Low | 68.4 | Low | 115 Ų | 115 | 88 Ų | 88 | 75% | 0.747 | 49% | 0.492 | S | S | * | . | P | Polyproline II helix | trans | -57.7 | 128.4 | -176.3 | 21.4 | -30.4 | 0 | 0 | 0 | 107.4 | H229 T233 | H229-P231 WeakPolarHBondContact O-CD 3.37Å; P231-T233 PolarHBondContact O-N 3.46Å |
| 232 | A | 57.4 | Low | 68.6 | Low | 57 Ų | 57 | 87.9 Ų | 87.9 | 47% | 0.471 | 49% | 0.488 | S | S | . | . | P | Polyproline II helix | trans | -50.3 | 120.2 | 172 | 0 | 0 | 0 | 0 | 0 | 107.5 | A230 S234 | A230-A232 PolarHBondContact O-N 3.22Å; A230-A232 VanDerWaalsContact O-N 3.15Å; A232-S234 PolarHBondContact O-N 3.26Å |
| 233 | T | 59.7 | Low | 69.4 | Low | 85 Ų | 85 | 85.1 Ų | 85.1 | 52% | 0.521 | 47% | 0.473 | S | S | . | . | P | Polyproline II helix | trans | -51.1 | 130.7 | 170.6 | 32 | 0 | 0 | 0 | 0 | 107.4 | G75 P231 A235 | G75-T233 VanDerWaalsContact CA-O 3.22Å; G75-T233 WeakPolarHBondContact CA-O 3.43Å; P231-T233 PolarHBondContact O-N 3.46Å; T233-A235 PolarHBondContact O-N 3.49Å; T233-A235 VanDerWaalsContact O-N 3.07Å |
| 234 | S | 64 | Low | 70.7 | Confident | 109 Ų | 109 | 75.8 Ų | 75.8 | 76% | 0.762 | 43% | 0.433 | S | S | * | . | P | Polyproline II helix | trans | -51.4 | 122.4 | -174.5 | 47.4 | 0 | 0 | 0 | 0 | 109.9 | A232 S236 | A232-S234 PolarHBondContact O-N 3.26Å; S234-S236 PolarHBondContact O-N 2.98Å |
| 235 | A | 70.4 | Confident | 72 | Confident | 67 Ų | 67 | 68.8 Ų | 68.8 | 55% | 0.554 | 40% | 0.395 | S | S | * | . | trans | -57.6 | 111.4 | -179.6 | 0 | 0 | 0 | 0 | 0 | 108.8 | A79 T233 | A79-A235 HydrophobicContact CB-CB 4.25Å; T233-A235 PolarHBondContact O-N 3.49Å; T233-A235 VanDerWaalsContact O-N 3.07Å | ||
| 236 | S | 83.9 | Confident | 73.4 | Confident | 46 Ų | 46 | 68.1 Ų | 68.1 | 32% | 0.322 | 39% | 0.393 | S | S | . | . | trans | -109.8 | 151.1 | 173.3 | 63.9 | 0 | 0 | 0 | 0 | 108.9 | S234 T238 A239 V240 | S234-S236 PolarHBondContact O-N 2.98Å; S236-T238 PolarHBondContact O-N 2.93Å; S236-T238 PolarHBondContact OG-OG1 3.25Å; S236-A239 WeakPolarHBondContact O-CB 3.28Å; S236-A239 PolarHBondContact O-N 3.44Å; S236-A239 VanDerWaalsContact OG-CB 3.23Å; S236-A239 WeakPolarHBondContact OG-CB 3.44Å; S236-A239 PolarHBondContact OG-N 3.44Å; S236-V240 PolarHBondContact O-N 3.02Å; S236-V240 VanDerWaalsContact O-N 3.07Å | ||
| 237 | W | 81.8 | Confident | 75 | Confident | 208 Ų | 208 | 61.7 Ų | 61.7 | 79% | 0.788 | 36% | 0.358 | S | S | * | . | H | α-helix | trans | -55 | -38.2 | 176.5 | -69.3 | 106.3 | 0 | 0 | 0 | 111.9 | V240 F241 | W237-V240 PolarHBondContact O-N 3.43Å; W237-F241 HydrophobicContact CB-CE2 4.26Å; W237-F241 WeakPolarHBondContact O-CD2 3.45Å; W237-F241 WeakPolarHBondContact O-CG 3.3Å; W237-F241 PolarHBondContact O-N 3.31Å |
| 238 | T | 83.6 | Confident | 76.7 | Confident | 94 Ų | 94 | 59.1 Ų | 59.1 | 58% | 0.577 | 34% | 0.341 | S | S | * | . | H | α-helix | trans | -61.4 | -42 | 174.1 | 38.6 | 0 | 0 | 0 | 0 | 113.2 | S236 F241 N242 | S236-T238 PolarHBondContact O-N 2.93Å; S236-T238 PolarHBondContact OG-OG1 3.25Å; T238-F241 PolarHBondContact O-N 3.5Å; T238-N242 VanDerWaalsContact O-CG 3.27Å; T238-N242 PolarHBondContact O-N 3.29Å; T238-N242 PolarHBondContact O-ND2 3.47Å |
| 239 | A | 85.1 | Confident | 78.5 | Confident | 17 Ų | 17 | 54.9 Ų | 54.9 | 14% | 0.14 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -64.3 | -45.3 | 178 | 0 | 0 | 0 | 0 | 0 | 111.5 | M73 S236 F241 N242 A243 | M73-A239 CarbonylContact O-C 3.56Å; M73-A239 VanDerWaalsContact O-CB 3.28Å; M73-A239 WeakPolarHBondContact O-CB 3.45Å; S236-A239 WeakPolarHBondContact O-CB 3.28Å; S236-A239 PolarHBondContact O-N 3.44Å; S236-A239 VanDerWaalsContact OG-CB 3.23Å; S236-A239 WeakPolarHBondContact OG-CB 3.44Å; S236-A239 PolarHBondContact OG-N 3.44Å; A239-F241 PolarHBondContact O-N 3.22Å; A239-N242 PolarHBondContact O-N 3.43Å; A239-A243 PolarHBondContact O-N 2.98Å |
| 240 | V | 88.3 | Confident | 80.2 | Confident | 23 Ų | 23 | 46.8 Ų | 46.8 | 14% | 0.139 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -59.2 | -45 | 175.7 | 176.6 | 0 | 0 | 0 | 0 | 111.3 | A79 L83 S236 W237 N242 A243 M244 | A79-V240 HydrophobicContact CB-CG2 4.36Å; L83-V240 HydrophobicContact CB-CG1 4.39Å; L83-V240 HydrophobicContact CD1-CG1 4.06Å; L83-V240 HydrophobicContact CD2-CG1 3.96Å; L83-V240 WeakPolarHBondContact CD2-O 3.4Å; L83-V240 HydrophobicContact CG-CG1 4.36Å; S236-V240 PolarHBondContact O-N 3.02Å; S236-V240 VanDerWaalsContact O-N 3.07Å; W237-V240 PolarHBondContact O-N 3.43Å; V240-N242 VanDerWaalsContact C-N 3.34Å; V240-N242 PolarHBondContact O-N 3.13Å; V240-A243 PolarHBondContact O-N 3.35Å; V240-M244 HydrophobicContact CG1-CE 4.35Å; V240-M244 PolarHBondContact O-N 3.47Å |
| 241 | F | 87 | Confident | 82.2 | Confident | 48 Ų | 48 | 45.8 Ų | 45.8 | 21% | 0.211 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -67.3 | -32.5 | 178.9 | -69.3 | -55.4 | 0 | 0 | 0 | 113.4 | W237 T238 A239 A243 M244 P245 F441 L445 | W237-F241 HydrophobicContact CB-CE2 4.26Å; W237-F241 WeakPolarHBondContact O-CD2 3.45Å; W237-F241 WeakPolarHBondContact O-CG 3.3Å; W237-F241 PolarHBondContact O-N 3.31Å; T238-F241 PolarHBondContact O-N 3.5Å; A239-F241 PolarHBondContact O-N 3.22Å; F241-A243 VanDerWaalsContact C-N 3.28Å; F241-A243 PolarHBondContact O-N 2.84Å; F241-M244 HydrophobicContact CD1-CE 3.37Å; F241-M244 HydrophobicContact CD1-SD 3.66Å; F241-M244 HydrophobicContact CE1-CE 3.56Å; F241-M244 HydrophobicContact CE1-SD 4.24Å; F241-M244 WeakPolarHBondContact O-CB 3.41Å; F241-M244 PolarHBondContact O-N 3.44Å; F241-P245 WeakPolarHBondContact O-CD 3.21Å; F241-F441 AromaticContact CD1-CE1 3.75Å; F241-F441 HydrophobicContact CD1-CE1 3.75Å; F241-F441 HydrophobicContact CD2-CE1 4.13Å; F241-F441 HydrophobicContact CD2-CZ 4.36Å; F241-F441 HydrophobicContact CE1-CD1 4.33Å; F241-F441 AromaticContact CE1-CE1 3.64Å; F241-F441 HydrophobicContact CE1-CE1 3.64Å; F241-F441 HydrophobicContact CE2-CE1 4.03Å; F241-F441 HydrophobicContact CE2-CZ 4.25Å; F241-F441 HydrophobicContact CG-CE1 4.04Å; F241-F441 AromaticContact CZ-CE1 3.8Å; F241-F441 HydrophobicContact CZ-CE1 3.8Å; F241-F441 HydrophobicContact CZ-CZ 4.38Å; F241-L445 HydrophobicContact CB-CD2 3.39Å; F241-L445 HydrophobicContact CD2-CD2 4.45Å; F241-L445 HydrophobicContact CG-CD2 4.01Å |
| 242 | N | 85.4 | Confident | 84 | Confident | 60 Ų | 60 | 40.8 Ų | 40.8 | 32% | 0.321 | 24% | 0.239 | S | C | . | . | H | α-helix | trans | -69.3 | -24.6 | 175.6 | -73.1 | -23.3 | 0 | 0 | 0 | 113.3 | T238 A239 V240 P245 N449 | T238-N242 VanDerWaalsContact O-CG 3.27Å; T238-N242 PolarHBondContact O-N 3.29Å; T238-N242 PolarHBondContact O-ND2 3.47Å; A239-N242 PolarHBondContact O-N 3.43Å; V240-N242 VanDerWaalsContact C-N 3.34Å; V240-N242 PolarHBondContact O-N 3.13Å; N242-P245 WeakPolarHBondContact O-CD 3.36Å; N242-N449 PolarHBondContact OD1-ND2 3.26Å |
| 243 | A | 90.4 | Very high | 85.7 | Confident | 0 Ų | 0 | 38.2 Ų | 38.2 | 0% | 0 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -81.1 | -18.1 | 174.6 | 0 | 0 | 0 | 0 | 0 | 113.6 | A70 M73 A74 L83 A239 V240 F241 T246 I247 | A70-A243 VanDerWaalsContact O-CB 3.29Å; A70-A243 WeakPolarHBondContact O-CB 3.44Å; M73-A243 HydrophobicContact CB-CB 4.11Å; A74-A243 HydrophobicContact CB-CB 3.86Å; L83-A243 HydrophobicContact CD2-CB 4.14Å; A239-A243 PolarHBondContact O-N 2.98Å; V240-A243 PolarHBondContact O-N 3.35Å; F241-A243 VanDerWaalsContact C-N 3.28Å; F241-A243 PolarHBondContact O-N 2.84Å; A243-T246 PolarHBondContact O-N 2.73Å; A243-I247 PolarHBondContact O-N 2.88Å |
| 244 | M | 90.8 | Very high | 87.3 | Confident | 7 Ų | 7 | 34.1 Ų | 34.1 | 3% | 0.034 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -58.6 | -43.4 | -177.1 | -71.8 | -170.2 | -177.1 | 0 | 0 | 114.4 | L83 M87 V240 F241 T246 I247 C248 I442 | L83-M244 HydrophobicContact CD1-CE 3.43Å; L83-M244 VanDerWaalsContact CD1-CE 3.43Å; L83-M244 HydrophobicContact CD1-CG 3.77Å; L83-M244 HydrophobicContact CD1-SD 4.28Å; L83-M244 HydrophobicContact CD2-CG 3.95Å; L83-M244 HydrophobicContact CG-CG 4.43Å; M87-M244 HydrophobicContact CE-CE 3.86Å; M87-M244 HydrophobicContact CE-SD 3.84Å; M87-M244 HydrophobicContact SD-CG 4.49Å; M87-M244 HydrophobicContact SD-SD 4.39Å; V240-M244 HydrophobicContact CG1-CE 4.35Å; V240-M244 PolarHBondContact O-N 3.47Å; F241-M244 HydrophobicContact CD1-CE 3.37Å; F241-M244 HydrophobicContact CD1-SD 3.66Å; F241-M244 HydrophobicContact CE1-CE 3.56Å; F241-M244 HydrophobicContact CE1-SD 4.24Å; F241-M244 WeakPolarHBondContact O-CB 3.41Å; F241-M244 PolarHBondContact O-N 3.44Å; M244-T246 VanDerWaalsContact C-N 3.3Å; M244-T246 PolarHBondContact O-N 3.41Å; M244-I247 PolarHBondContact O-N 3.24Å; M244-C248 WeakPolarHBondContact O-CB 3.49Å; M244-C248 PolarHBondContact O-N 3.19Å; M244-C248 PolarHBondContact O-SG 3.13Å; M244-I442 HydrophobicContact CB-CG2 4.22Å; M244-I442 HydrophobicContact SD-CD1 3.52Å; M244-I442 VanDerWaalsContact SD-CD1 3.52Å; M244-I442 HydrophobicContact SD-CG1 3.66Å |
| 245 | P | 89.4 | Confident | 88.4 | Confident | 4 Ų | 4 | 29.5 Ų | 29.5 | 3% | 0.026 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -54.3 | -44.5 | 176.1 | -31.4 | 38.3 | 0 | 0 | 0 | 113.6 | F241 N242 I247 C248 F249 G395 T446 | F241-P245 WeakPolarHBondContact O-CD 3.21Å; N242-P245 WeakPolarHBondContact O-CD 3.36Å; P245-I247 VanDerWaalsContact C-N 3.35Å; P245-C248 PolarHBondContact O-N 3.42Å; P245-F249 WeakPolarHBondContact O-CB 3.49Å; P245-F249 PolarHBondContact O-N 2.85Å; P245-G395 WeakPolarHBondContact O-CA 3.48Å; P245-T446 HydrophobicContact CB-CG2 4.46Å; P245-T446 HydrophobicContact CG-CG2 3.09Å |
| 246 | T | 91.1 | Very high | 89.2 | Confident | 7 Ų | 7 | 27.1 Ų | 27.1 | 4% | 0.043 | 14% | 0.139 | C | C | . | . | H | α-helix | trans | -65.3 | -42 | -178.3 | -52.4 | 0 | 0 | 0 | 0 | 110.7 | N66 A70 A243 M244 F249 G250 I391 | N66-T246 HydrophobicContact CB-CG2 3.44Å; N66-T246 VanDerWaalsContact CB-CG2 3.44Å; A70-T246 HydrophobicContact CB-CG2 3.89Å; A243-T246 PolarHBondContact O-N 2.73Å; M244-T246 VanDerWaalsContact C-N 3.3Å; M244-T246 PolarHBondContact O-N 3.41Å; T246-F249 PolarHBondContact O-N 3.29Å; T246-G250 PolarHBondContact O-N 3.07Å; T246-I391 HydrophobicContact CG2-CG2 4.28Å |
| 247 | I | 93.4 | Very high | 89.3 | Confident | 1 Ų | 1 | 25 Ų | 25 | 1% | 0.005 | 13% | 0.125 | C | C | . | . | H | α-helix | trans | -66.6 | -41.6 | 174.6 | -63.8 | 177.8 | 0 | 0 | 0 | 110.8 | F67 A70 L83 M87 A243 M244 P245 G250 F251 | F67-I247 HydrophobicContact CE1-CG1 4.41Å; A70-I247 HydrophobicContact CB-CG1 4.26Å; L83-I247 HydrophobicContact CB-CD1 4.37Å; L83-I247 HydrophobicContact CD2-CD1 3.48Å; L83-I247 VanDerWaalsContact CD2-CD1 3.48Å; L83-I247 HydrophobicContact CG-CD1 3.68Å; M87-I247 HydrophobicContact CB-CG2 4.4Å; M87-I247 HydrophobicContact CG-CG2 4.37Å; A243-I247 PolarHBondContact O-N 2.88Å; M244-I247 PolarHBondContact O-N 3.24Å; P245-I247 VanDerWaalsContact C-N 3.35Å; I247-G250 PolarHBondContact O-N 2.93Å; I247-F251 HydrophobicContact CG2-CD2 3.8Å; I247-F251 HydrophobicContact CG2-CE2 4.13Å; I247-F251 WeakPolarHBondContact O-CD2 3.5Å; I247-F251 PolarHBondContact O-N 3.16Å |
| 248 | C | 93.2 | Very high | 89.6 | Confident | 2 Ų | 2 | 15.1 Ų | 15.1 | 1% | 0.014 | 9% | 0.087 | C | C | . | . | H | α-helix | trans | -61.5 | -44.9 | 176.5 | -70.6 | 0 | 0 | 0 | 0 | 111.3 | M244 P245 F251 Q252 A398 I402 | M244-C248 WeakPolarHBondContact O-CB 3.49Å; M244-C248 PolarHBondContact O-N 3.19Å; M244-C248 PolarHBondContact O-SG 3.13Å; P245-C248 PolarHBondContact O-N 3.42Å; C248-F251 PolarHBondContact O-N 3.1Å; C248-Q252 VanDerWaalsContact O-CB 3.31Å; C248-Q252 WeakPolarHBondContact O-CB 3.4Å; C248-Q252 PolarHBondContact O-N 3Å; C248-A398 HydrophobicContact CB-CB 3.96Å; C248-I402 HydrophobicContact CB-CD1 3.8Å; C248-I402 WeakPolarHBondContact O-CD1 3.43Å |
| 249 | F | 91.6 | Very high | 89.6 | Confident | 11 Ų | 11 | 12.9 Ų | 12.9 | 5% | 0.048 | 7% | 0.074 | C | C | . | . | H | α-helix | trans | -59.9 | -47.8 | 174.4 | 174.3 | -110.8 | 0 | 0 | 0 | 111.1 | Y133 T137 P245 T246 F251 Q252 I391 I394 | Y133-F249 HydrophobicContact CE2-CD2 4.29Å; T137-F249 HydrophobicContact CG2-CE2 3.88Å; T137-F249 HydrophobicContact CG2-CZ 4.23Å; P245-F249 WeakPolarHBondContact O-CB 3.49Å; P245-F249 PolarHBondContact O-N 2.85Å; T246-F249 PolarHBondContact O-N 3.29Å; F249-F251 PolarHBondContact O-N 3.24Å; F249-Q252 WeakPolarHBondContact O-CB 3.36Å; F249-Q252 PolarHBondContact O-N 2.91Å; F249-I391 HydrophobicContact CB-CG2 4.3Å; F249-I391 HydrophobicContact CD1-CD1 4.13Å; F249-I391 HydrophobicContact CD1-CG1 3.96Å; F249-I391 HydrophobicContact CD1-CG2 4.06Å; F249-I391 HydrophobicContact CE1-CD1 3.94Å; F249-I391 HydrophobicContact CE1-CG1 3.89Å; F249-I391 HydrophobicContact CG-CG2 4.31Å; F249-I391 HydrophobicContact CZ-CG1 4.44Å; F249-I394 HydrophobicContact CD2-CD1 3.57Å; F249-I394 HydrophobicContact CD2-CG1 3.74Å; F249-I394 HydrophobicContact CE2-CD1 3.28Å; F249-I394 HydrophobicContact CE2-CG1 4.01Å; F249-I394 HydrophobicContact CG-CD1 4.48Å; F249-I394 HydrophobicContact CG-CG1 4.47Å; F249-I394 HydrophobicContact CZ-CD1 4Å |
| 250 | G | 92.4 | Very high | 89.7 | Confident | 0 Ų | 0 | 12.7 Ų | 12.7 | 0% | 0 | 7% | 0.071 | C | C | . | . | H | α-helix | trans | -62.5 | -36.7 | 178.4 | 0 | 0 | 0 | 0 | 0 | 114.1 | T246 I247 Y287 | T246-G250 PolarHBondContact O-N 3.07Å; I247-G250 PolarHBondContact O-N 2.93Å; G250-Y287 PolarHBondContact O-OH 3.36Å |
| 251 | F | 92.8 | Very high | 89.7 | Confident | 0 Ų | 0 | 11.7 Ų | 11.7 | 0% | 0 | 7% | 0.065 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -91.6 | 3.1 | 177.7 | -82.7 | -81.2 | 0 | 0 | 0 | 114.4 | F67 Q84 L88 I91 I247 C248 F249 C253 M280 C283 Y287 | F67-F251 HydrophobicContact CE1-CD2 4.35Å; F67-F251 AromaticContact CE1-CE2 3.83Å; F67-F251 HydrophobicContact CE1-CE2 3.83Å; F67-F251 AromaticContact CZ-CD2 3.84Å; F67-F251 HydrophobicContact CZ-CD2 3.84Å; F67-F251 AromaticContact CZ-CE2 3.69Å; F67-F251 HydrophobicContact CZ-CE2 3.69Å; Q84-F251 HydrophobicContact CG-CE2 3.77Å; Q84-F251 HydrophobicContact CG-CZ 4.02Å; Q84-F251 VanDerWaalsContact NE2-CZ 3.34Å; L88-F251 HydrophobicContact CD1-CD1 4.46Å; L88-F251 HydrophobicContact CD1-CE1 3.78Å; L88-F251 HydrophobicContact CD1-CZ 4.15Å; I91-F251 HydrophobicContact CD1-CB 3.4Å; I91-F251 VanDerWaalsContact CD1-CB 3.4Å; I91-F251 HydrophobicContact CD1-CD1 4.01Å; I91-F251 HydrophobicContact CD1-CD2 3.98Å; I91-F251 HydrophobicContact CD1-CG 3.56Å; I91-F251 HydrophobicContact CG1-CB 4.21Å; I247-F251 HydrophobicContact CG2-CD2 3.8Å; I247-F251 HydrophobicContact CG2-CE2 4.13Å; I247-F251 WeakPolarHBondContact O-CD2 3.5Å; I247-F251 PolarHBondContact O-N 3.16Å; C248-F251 PolarHBondContact O-N 3.1Å; F249-F251 PolarHBondContact O-N 3.24Å; F251-C253 PolarHBondContact O-N 3.36Å; F251-M280 HydrophobicContact CD1-SD 4.14Å; F251-C283 HydrophobicContact CD1-CB 4.48Å; F251-C283 HydrophobicContact CE1-CB 3.96Å; F251-Y287 HydrophobicContact CD1-CD2 4.18Å; F251-Y287 AromaticContact CD1-CE2 3.81Å; F251-Y287 HydrophobicContact CD1-CE2 3.81Å; F251-Y287 HydrophobicContact CD2-CD2 4.08Å; F251-Y287 HydrophobicContact CD2-CE2 4.01Å; F251-Y287 AromaticContact CE1-CD2 3.62Å; F251-Y287 HydrophobicContact CE1-CD2 3.62Å; F251-Y287 AromaticContact CE1-CE2 3.71Å; F251-Y287 HydrophobicContact CE1-CE2 3.71Å; F251-Y287 AromaticContact CE2-CD2 3.5Å; F251-Y287 HydrophobicContact CE2-CD2 3.5Å; F251-Y287 VanDerWaalsContact CE2-CD2 3.5Å; F251-Y287 AromaticContact CE2-CE2 3.9Å; F251-Y287 HydrophobicContact CE2-CE2 3.9Å; F251-Y287 HydrophobicContact CE2-CG 4.45Å; F251-Y287 HydrophobicContact CG-CD2 4.42Å; F251-Y287 AromaticContact CG-CE2 3.99Å; F251-Y287 HydrophobicContact CG-CE2 3.99Å; F251-Y287 AromaticContact CZ-CD2 3.3Å; F251-Y287 HydrophobicContact CZ-CD2 3.3Å; F251-Y287 AromaticContact CZ-CE2 3.81Å; F251-Y287 HydrophobicContact CZ-CE2 3.81Å; F251-Y287 HydrophobicContact CZ-CG 4.4Å |
| 252 | Q | 92.6 | Very high | 89.6 | Confident | 10 Ų | 10 | 10.9 Ų | 10.9 | 5% | 0.047 | 6% | 0.063 | C | C | . | . | trans | -70.7 | 103.7 | -174.7 | -176.7 | 57 | -95.4 | 0 | 0 | 111.3 | Y133 C248 F249 H254 A398 | Y133-Q252 HydrophobicContact CE1-CG 3.94Å; Y133-Q252 HydrophobicContact CE2-CG 4.19Å; Y133-Q252 VanDerWaalsContact OH-CB 3.31Å; Y133-Q252 WeakPolarHBondContact OH-CB 3.12Å; Y133-Q252 WeakPolarHBondContact OH-CG 3.29Å; C248-Q252 VanDerWaalsContact O-CB 3.31Å; C248-Q252 WeakPolarHBondContact O-CB 3.4Å; C248-Q252 PolarHBondContact O-N 3Å; F249-Q252 WeakPolarHBondContact O-CB 3.36Å; F249-Q252 PolarHBondContact O-N 2.91Å; Q252-H254 VanDerWaalsContact OE1-CB 3.26Å; Q252-H254 PolarHBondContact OE1-ND1 3.39Å; Q252-A398 HydrophobicContact CB-CB 4.15Å; Q252-A398 HydrophobicContact CG-CB 4.22Å; Q252-A398 PolarHBondContact NE2-O 3.23Å | ||
| 253 | C | 92.5 | Very high | 89.5 | Confident | 3 Ų | 3 | 10.1 Ų | 10.1 | 2% | 0.02 | 6% | 0.062 | C | C | . | . | trans | -130 | 0.4 | 171 | 59.1 | 0 | 0 | 0 | 0 | 112.5 | A58 A59 F251 V255 S256 C257 M280 | A58-C253 HydrophobicContact CB-CB 3.88Å; A59-C253 HydrophobicContact CB-CB 4.27Å; F251-C253 PolarHBondContact O-N 3.36Å; C253-V255 PolarHBondContact O-N 3.43Å; C253-S256 PolarHBondContact O-N 3Å; C253-C257 PolarHBondContact O-N 3.3Å; C253-C257 VanDerWaalsContact O-N 3.13Å; C253-M280 WeakPolarHBondContact SG-CE 3.31Å | ||
| 254 | H | 93.3 | Very high | 89.3 | Confident | 0 Ų | 0 | 10.5 Ų | 10.5 | 0% | 0 | 6% | 0.064 | C | C | . | . | H | α-helix | trans | -65.1 | -39 | -173 | -60.2 | 58.7 | 0 | 0 | 0 | 112 | I91 L95 L98 Y110 Q252 S256 C257 F401 | I91-H254 PolarHBondContact O-NE2 3.46Å; L95-H254 HydrophobicContact CD2-CB 4.22Å; L98-H254 HydrophobicContact CD1-CB 3.96Å; Y110-H254 WeakPolarHBondContact CD2-O 3.33Å; Y110-H254 HydrophobicContact CE2-CB 3.95Å; Q252-H254 VanDerWaalsContact OE1-CB 3.26Å; Q252-H254 PolarHBondContact OE1-ND1 3.39Å; H254-S256 PolarHBondContact O-N 3.25Å; H254-S256 VanDerWaalsContact O-N 3.16Å; H254-C257 WeakPolarHBondContact O-CB 3.35Å; H254-C257 PolarHBondContact O-N 3.36Å; H254-C257 PolarHBondContact O-SG 2.78Å; H254-F401 HydrophobicContact CB-CB 4.37Å |
| 255 | V | 88.6 | Confident | 89 | Confident | 11 Ų | 11 | 16.5 Ų | 16.5 | 7% | 0.067 | 9% | 0.09 | C | C | . | . | H | α-helix | trans | -55.3 | -36.7 | 177.4 | 177.9 | 0 | 0 | 0 | 0 | 111.6 | I130 Y133 C253 C338 F401 | I130-V255 HydrophobicContact CD1-CG1 4.5Å; I130-V255 HydrophobicContact CG1-CG1 4.38Å; I130-V255 HydrophobicContact CG1-CG2 4.36Å; I130-V255 HydrophobicContact CG2-CG1 3.84Å; Y133-V255 HydrophobicContact CD1-CG2 4.36Å; C253-V255 PolarHBondContact O-N 3.43Å; V255-C338 HydrophobicContact CG1-CB 4.43Å; V255-F401 HydrophobicContact CG2-CB 4.44Å; V255-F401 HydrophobicContact CG2-CD1 4.36Å; V255-F401 HydrophobicContact CG2-CD2 3.8Å; V255-F401 HydrophobicContact CG2-CE2 4.16Å; V255-F401 HydrophobicContact CG2-CG 3.95Å |
| 256 | S | 85.3 | Confident | 88.9 | Confident | 18 Ų | 18 | 25.1 Ų | 25.1 | 13% | 0.126 | 12% | 0.122 | C | C | . | . | H | α-helix | trans | -91.6 | -9.3 | -179.7 | -57.1 | 0 | 0 | 0 | 0 | 113.3 | C253 H254 P259 V260 | C253-S256 PolarHBondContact O-N 3Å; H254-S256 PolarHBondContact O-N 3.25Å; H254-S256 VanDerWaalsContact O-N 3.16Å; S256-P259 WeakPolarHBondContact O-CD 3.5Å; S256-V260 WeakPolarHBondContact O-CG2 3.17Å; S256-V260 PolarHBondContact O-N 2.81Å |
| 257 | C | 87.3 | Confident | 88.6 | Confident | 2 Ų | 2 | 30.4 Ų | 30.4 | 1% | 0.014 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -72.3 | -36.9 | -168.1 | 84.3 | 0 | 0 | 0 | 0 | 113.3 | L95 C253 H254 V260 F261 W272 | L95-C257 HydrophobicContact CD2-CB 3.46Å; L95-C257 VanDerWaalsContact CD2-CB 3.46Å; C253-C257 PolarHBondContact O-N 3.3Å; C253-C257 VanDerWaalsContact O-N 3.13Å; H254-C257 WeakPolarHBondContact O-CB 3.35Å; H254-C257 PolarHBondContact O-N 3.36Å; H254-C257 PolarHBondContact O-SG 2.78Å; C257-V260 PolarHBondContact O-N 3.3Å; C257-F261 WeakPolarHBondContact O-CB 3.31Å; C257-F261 PolarHBondContact O-N 2.91Å; C257-W272 HydrophobicContact CB-CH2 4.01Å; C257-W272 HydrophobicContact CB-CZ2 3.84Å; C257-W272 VanDerWaalsContact O-CH2 3.24Å; C257-W272 WeakPolarHBondContact O-CH2 3.41Å |
| 258 | V | 88.6 | Confident | 88.6 | Confident | 0 Ų | 0 | 31.4 Ų | 31.4 | 0% | 0 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -67.3 | -47 | -179.4 | 176.3 | 0 | 0 | 0 | 0 | 111.9 | L98 Y110 V113 V260 F261 N262 | L98-V258 HydrophobicContact CB-CG2 4.13Å; Y110-V258 HydrophobicContact CD2-CG2 4.46Å; V113-V258 HydrophobicContact CG2-CG1 3.83Å; V113-V258 HydrophobicContact CG2-CG2 4.38Å; V258-V260 VanDerWaalsContact C-N 3.29Å; V258-V260 PolarHBondContact O-N 3.19Å; V258-F261 PolarHBondContact O-N 3.25Å; V258-N262 PolarHBondContact O-N 2.93Å; V258-N262 PolarHBondContact O-ND2 3.22Å |
| 259 | P | 83.6 | Confident | 88.6 | Confident | 47 Ų | 47 | 33.3 Ų | 33.3 | 31% | 0.305 | 16% | 0.162 | S | C | . | . | H | α-helix | trans | -57.1 | -40.6 | 170 | -27.5 | 34.9 | 0 | 0 | 0 | 113.2 | S256 N262 S263 | S256-P259 WeakPolarHBondContact O-CD 3.5Å; P259-N262 PolarHBondContact O-N 3.29Å; P259-S263 WeakPolarHBondContact O-CB 3.31Å; P259-S263 PolarHBondContact O-N 3.26Å |
| 260 | V | 85.8 | Confident | 88.7 | Confident | 13 Ų | 13 | 42 Ų | 42 | 8% | 0.079 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -65.5 | -45.5 | 178.9 | 176.3 | 0 | 0 | 0 | 0 | 111.3 | A51 I54 V55 S256 C257 V258 N262 S263 M264 W272 | A51-V260 HydrophobicContact CB-CG1 4.13Å; I54-V260 HydrophobicContact CG2-CG1 4.38Å; I54-V260 HydrophobicContact CG2-CG2 3.55Å; V55-V260 HydrophobicContact CG2-CG1 3.98Å; S256-V260 WeakPolarHBondContact O-CG2 3.17Å; S256-V260 PolarHBondContact O-N 2.81Å; C257-V260 PolarHBondContact O-N 3.3Å; V258-V260 VanDerWaalsContact C-N 3.29Å; V258-V260 PolarHBondContact O-N 3.19Å; V260-N262 VanDerWaalsContact C-N 3.29Å; V260-N262 PolarHBondContact O-N 3.35Å; V260-S263 PolarHBondContact O-N 3.26Å; V260-S263 VanDerWaalsContact O-N 3.11Å; V260-S263 PolarHBondContact O-OG 2.97Å; V260-M264 WeakPolarHBondContact O-CG 3.4Å; V260-M264 PolarHBondContact O-N 2.97Å; V260-W272 HydrophobicContact CB-CH2 4.45Å; V260-W272 HydrophobicContact CG1-CH2 4.42Å; V260-W272 HydrophobicContact CG1-CZ3 4.1Å |
| 261 | F | 88.8 | Confident | 88.7 | Confident | 2 Ų | 2 | 43.4 Ų | 43.4 | 1% | 0.009 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -54.7 | -45.8 | 174.4 | 172.8 | -107.2 | 0 | 0 | 0 | 111.7 | Q103 C257 V258 S263 M264 K267 I269 W272 | Q103-F261 HydrophobicContact CB-CE1 4.12Å; Q103-F261 HydrophobicContact CB-CZ 4.08Å; C257-F261 WeakPolarHBondContact O-CB 3.31Å; C257-F261 PolarHBondContact O-N 2.91Å; V258-F261 PolarHBondContact O-N 3.25Å; F261-S263 VanDerWaalsContact C-N 3.29Å; F261-S263 PolarHBondContact O-N 3.44Å; F261-M264 HydrophobicContact CD2-CE 3.92Å; F261-M264 HydrophobicContact CE2-CE 4.24Å; F261-M264 WeakPolarHBondContact O-CB 3.44Å; F261-M264 PolarHBondContact O-N 3.47Å; F261-K267 HydrophobicContact CZ-CB 4.34Å; F261-I269 HydrophobicContact CE2-CD1 4.36Å; F261-I269 HydrophobicContact CZ-CD1 4.18Å; F261-W272 HydrophobicContact CB-CD2 4.06Å; F261-W272 HydrophobicContact CB-CE3 3.91Å; F261-W272 HydrophobicContact CB-CH2 4.03Å; F261-W272 HydrophobicContact CB-CZ2 4.17Å; F261-W272 HydrophobicContact CB-CZ3 3.9Å; F261-W272 HydrophobicContact CD2-CB 3.68Å; F261-W272 AromaticContact CD2-CD2 3.55Å; F261-W272 HydrophobicContact CD2-CD2 3.55Å; F261-W272 AromaticContact CD2-CE3 3.79Å; F261-W272 HydrophobicContact CD2-CE3 3.79Å; F261-W272 AromaticContact CD2-CG 3.51Å; F261-W272 HydrophobicContact CD2-CG 3.51Å; F261-W272 HydrophobicContact CE2-CB 3.73Å; F261-W272 HydrophobicContact CE2-CD2 4.45Å; F261-W272 AromaticContact CE2-CG 3.95Å; F261-W272 HydrophobicContact CE2-CG 3.95Å; F261-W272 HydrophobicContact CG-CD2 4.21Å; F261-W272 HydrophobicContact CG-CE3 4.35Å; F261-W272 HydrophobicContact CG-CG 4.48Å |
| 262 | N | 85.3 | Confident | 88.9 | Confident | 31 Ų | 31 | 43.4 Ų | 43.4 | 17% | 0.166 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -72.8 | -18.5 | 179.9 | -79.3 | -76 | 0 | 0 | 0 | 114.3 | S102 E107 A108 V258 P259 V260 K267 | S102-N262 PolarHBondContact OG-ND2 3.44Å; E107-N262 PolarHBondContact O-ND2 3.43Å; A108-N262 HydrophobicContact CB-CB 4.45Å; V258-N262 PolarHBondContact O-N 2.93Å; V258-N262 PolarHBondContact O-ND2 3.22Å; P259-N262 PolarHBondContact O-N 3.29Å; V260-N262 VanDerWaalsContact C-N 3.29Å; V260-N262 PolarHBondContact O-N 3.35Å; N262-K267 WeakPolarHBondContact O-CE 3.24Å; N262-K267 PolarHBondContact O-NZ 3.4Å |
| 263 | S | 83.3 | Confident | 89 | Confident | 43 Ų | 43 | 43.7 Ų | 43.7 | 30% | 0.301 | 22% | 0.215 | S | C | . | . | H | α-helix | trans | -81.8 | -12.6 | 173.9 | 77.7 | 0 | 0 | 0 | 0 | 113.5 | G45 V46 P259 V260 F261 | G45-S263 CarbonylContact C-O 3.56Å; G45-S263 WeakPolarHBondContact CA-O 3.46Å; V46-S263 PolarHBondContact N-O 3.16Å; P259-S263 WeakPolarHBondContact O-CB 3.31Å; P259-S263 PolarHBondContact O-N 3.26Å; V260-S263 PolarHBondContact O-N 3.26Å; V260-S263 VanDerWaalsContact O-N 3.11Å; V260-S263 PolarHBondContact O-OG 2.97Å; F261-S263 VanDerWaalsContact C-N 3.29Å; F261-S263 PolarHBondContact O-N 3.44Å |
| 264 | M | 85.4 | Confident | 89.2 | Confident | 9 Ų | 9 | 49.2 Ų | 49.2 | 4% | 0.044 | 24% | 0.239 | C | C | . | . | B | Isolated β-bridge | trans | -70.6 | 145.9 | -176.3 | -61.8 | -160.9 | -45.2 | 0 | 0 | 112.6 | V46 A51 V260 F261 R266 W272 V275 | V46-M264 WeakPolarHBondContact O-CA 3.18Å; A51-M264 HydrophobicContact CB-CG 4.05Å; A51-M264 HydrophobicContact CB-SD 3.96Å; V260-M264 WeakPolarHBondContact O-CG 3.4Å; V260-M264 PolarHBondContact O-N 2.97Å; F261-M264 HydrophobicContact CD2-CE 3.92Å; F261-M264 HydrophobicContact CE2-CE 4.24Å; F261-M264 WeakPolarHBondContact O-CB 3.44Å; F261-M264 PolarHBondContact O-N 3.47Å; M264-R266 WeakPolarHBondContact CE-O 3.48Å; M264-R266 PolarHBondContact O-N 3.07Å; M264-W272 HydrophobicContact CE-CB 4.1Å; M264-W272 HydrophobicContact CE-CE3 4.06Å; M264-W272 HydrophobicContact SD-CE3 3.84Å; M264-W272 HydrophobicContact SD-CZ3 4.35Å; M264-V275 HydrophobicContact SD-CG2 4.1Å |
| 265 | K | 85.7 | Confident | 89.3 | Confident | 133 Ų | 133 | 49.2 Ų | 49.2 | 58% | 0.578 | 24% | 0.239 | S | C | * | . | S | Bend | trans | -54.7 | -36.9 | 173.2 | -68.5 | -170 | 178.4 | -166.6 | 0 | 113.3 | G45 V46 | G45-K265 WeakPolarHBondContact O-CE 3.44Å; G45-K265 WeakPolarHBondContact O-CG 3.29Å; V46-K265 PolarHBondContact O-N 3.35Å |
| 266 | R | 86.3 | Confident | 89.7 | Confident | 185 Ų | 185 | 48.7 Ų | 48.7 | 70% | 0.698 | 24% | 0.236 | S | C | * | . | S | Bend | trans | -123.3 | 95.6 | 180 | -172.5 | 178.1 | -178.1 | 177 | 3.9 | 110.2 | M264 A268 P271 | M264-R266 WeakPolarHBondContact CE-O 3.48Å; M264-R266 PolarHBondContact O-N 3.07Å; R266-A268 VanDerWaalsContact C-N 3.3Å; R266-A268 HydrophobicContact CG-CB 4.31Å; R266-A268 PolarHBondContact O-N 3.02Å; R266-P271 HydrophobicContact CB-CG 4.49Å; R266-P271 HydrophobicContact CG-CG 4.24Å |
| 267 | K | 86.1 | Confident | 90.2 | Very high | 117 Ų | 117 | 50.5 Ų | 50.5 | 51% | 0.509 | 25% | 0.246 | S | C | . | . | trans | -75.2 | 75.7 | 179.2 | -52.7 | -178.7 | -165.2 | -174.4 | 0 | 111.2 | Q103 F261 N262 | Q103-K267 PolarHBondContact NE2-O 2.93Å; F261-K267 HydrophobicContact CZ-CB 4.34Å; N262-K267 WeakPolarHBondContact O-CE 3.24Å; N262-K267 PolarHBondContact O-NZ 3.4Å | ||
| 268 | A | 91.7 | Very high | 90.6 | Very high | 22 Ų | 22 | 52.3 Ų | 52.3 | 18% | 0.182 | 26% | 0.258 | C | S | . | . | trans | -140.8 | 151.9 | 179.2 | 0 | 0 | 0 | 0 | 0 | 111.4 | R266 K270 P271 W272 | R266-A268 VanDerWaalsContact C-N 3.3Å; R266-A268 HydrophobicContact CG-CB 4.31Å; R266-A268 PolarHBondContact O-N 3.02Å; A268-K270 PolarHBondContact O-N 3.35Å; A268-P271 HydrophobicContact CB-CG 3.94Å; A268-P271 WeakPolarHBondContact O-CD 3.33Å; A268-P271 VanDerWaalsContact O-CG 3.25Å; A268-P271 WeakPolarHBondContact O-CG 3.5Å; A268-W272 WeakPolarHBondContact O-CB 3.29Å; A268-W272 PolarHBondContact O-N 3.07Å; A268-W272 VanDerWaalsContact O-N 3.14Å | ||
| 269 | I | 93 | Very high | 91 | Very high | 43 Ų | 43 | 52.3 Ų | 52.3 | 22% | 0.221 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -65.2 | -35.9 | -175.2 | -53.3 | -46.2 | 0 | 0 | 0 | 113.2 | V96 G99 Y100 Q103 F261 W272 G273 | V96-I269 HydrophobicContact CG1-CG2 4.32Å; G99-I269 WeakPolarHBondContact O-CD1 3.41Å; Y100-I269 HydrophobicContact CD2-CG1 4.36Å; Q103-I269 HydrophobicContact CB-CD1 4.21Å; Q103-I269 VanDerWaalsContact OE1-CD1 3.28Å; F261-I269 HydrophobicContact CE2-CD1 4.36Å; F261-I269 HydrophobicContact CZ-CD1 4.18Å; I269-W272 PolarHBondContact O-N 3.49Å; I269-G273 PolarHBondContact O-N 3.38Å |
| 270 | K | 93.6 | Very high | 91.5 | Very high | 192 Ų | 192 | 50 Ų | 50 | 84% | 0.835 | 24% | 0.244 | S | C | * | . | H | α-helix | trans | -59.4 | -56.7 | 179 | -70.5 | -173.1 | 177.7 | -177 | 0 | 113 | A268 W272 G273 F274 | A268-K270 PolarHBondContact O-N 3.35Å; K270-W272 VanDerWaalsContact C-N 3.3Å; K270-W272 PolarHBondContact O-N 3.3Å; K270-G273 PolarHBondContact O-N 3.45Å; K270-F274 PolarHBondContact O-N 3.08Å |
| 271 | P | 94.2 | Very high | 92 | Very high | 31 Ų | 31 | 53 Ų | 53 | 20% | 0.201 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -64.7 | -34.3 | 175.9 | 24.1 | -32.7 | 0 | 0 | 0 | 112.3 | R266 A268 F274 V275 | R266-P271 HydrophobicContact CB-CG 4.49Å; R266-P271 HydrophobicContact CG-CG 4.24Å; A268-P271 HydrophobicContact CB-CG 3.94Å; A268-P271 WeakPolarHBondContact O-CD 3.33Å; A268-P271 VanDerWaalsContact O-CG 3.25Å; A268-P271 WeakPolarHBondContact O-CG 3.5Å; P271-F274 WeakPolarHBondContact O-CB 3.35Å; P271-F274 PolarHBondContact O-N 3.25Å; P271-V275 WeakPolarHBondContact O-CG2 3.38Å; P271-V275 PolarHBondContact O-N 3.35Å |
| 272 | W | 95.7 | Very high | 92.2 | Very high | 0 Ų | 0 | 55.3 Ų | 55.3 | 0% | 0 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -62.5 | -45.3 | 175.6 | 179.5 | -117.2 | 0 | 0 | 0 | 113.1 | V55 L95 C257 V260 F261 M264 A268 I269 K270 F274 V275 V276 | V55-W272 HydrophobicContact CG2-CH2 4.27Å; V55-W272 HydrophobicContact CG2-CZ3 4.46Å; L95-W272 PolarHBondContact O-NE1 2.91Å; C257-W272 HydrophobicContact CB-CH2 4.01Å; C257-W272 HydrophobicContact CB-CZ2 3.84Å; C257-W272 VanDerWaalsContact O-CH2 3.24Å; C257-W272 WeakPolarHBondContact O-CH2 3.41Å; V260-W272 HydrophobicContact CB-CH2 4.45Å; V260-W272 HydrophobicContact CG1-CH2 4.42Å; V260-W272 HydrophobicContact CG1-CZ3 4.1Å; F261-W272 HydrophobicContact CB-CD2 4.06Å; F261-W272 HydrophobicContact CB-CE3 3.91Å; F261-W272 HydrophobicContact CB-CH2 4.03Å; F261-W272 HydrophobicContact CB-CZ2 4.17Å; F261-W272 HydrophobicContact CB-CZ3 3.9Å; F261-W272 HydrophobicContact CD2-CB 3.68Å; F261-W272 AromaticContact CD2-CD2 3.55Å; F261-W272 HydrophobicContact CD2-CD2 3.55Å; F261-W272 AromaticContact CD2-CE3 3.79Å; F261-W272 HydrophobicContact CD2-CE3 3.79Å; F261-W272 AromaticContact CD2-CG 3.51Å; F261-W272 HydrophobicContact CD2-CG 3.51Å; F261-W272 HydrophobicContact CE2-CB 3.73Å; F261-W272 HydrophobicContact CE2-CD2 4.45Å; F261-W272 AromaticContact CE2-CG 3.95Å; F261-W272 HydrophobicContact CE2-CG 3.95Å; F261-W272 HydrophobicContact CG-CD2 4.21Å; F261-W272 HydrophobicContact CG-CE3 4.35Å; F261-W272 HydrophobicContact CG-CG 4.48Å; M264-W272 HydrophobicContact CE-CB 4.1Å; M264-W272 HydrophobicContact CE-CE3 4.06Å; M264-W272 HydrophobicContact SD-CE3 3.84Å; M264-W272 HydrophobicContact SD-CZ3 4.35Å; A268-W272 WeakPolarHBondContact O-CB 3.29Å; A268-W272 PolarHBondContact O-N 3.07Å; A268-W272 VanDerWaalsContact O-N 3.14Å; I269-W272 PolarHBondContact O-N 3.49Å; K270-W272 VanDerWaalsContact C-N 3.3Å; K270-W272 PolarHBondContact O-N 3.3Å; W272-F274 VanDerWaalsContact C-N 3.28Å; W272-F274 PolarHBondContact O-N 3.34Å; W272-V275 HydrophobicContact CE3-CB 4.41Å; W272-V275 HydrophobicContact CE3-CG1 4.35Å; W272-V275 HydrophobicContact CZ3-CG1 4.23Å; W272-V275 WeakPolarHBondContact O-CB 3.37Å; W272-V275 PolarHBondContact O-N 2.91Å; W272-V275 VanDerWaalsContact O-N 3.11Å; W272-V276 HydrophobicContact CD2-CG2 3.88Å; W272-V276 VanDerWaalsContact CE2-CG2 3.42Å; W272-V276 HydrophobicContact CE3-CG2 4.38Å; W272-V276 HydrophobicContact CG-CG2 4.4Å; W272-V276 HydrophobicContact CH2-CG2 4.11Å; W272-V276 HydrophobicContact CZ2-CG2 3.56Å; W272-V276 HydrophobicContact CZ3-CG2 4.48Å; W272-V276 WeakPolarHBondContact O-CG2 3.28Å; W272-V276 PolarHBondContact O-N 3.02Å |
| 273 | G | 95.9 | Very high | 92.7 | Very high | 16 Ų | 16 | 53.8 Ų | 53.8 | 17% | 0.165 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -59.7 | -38.7 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | I269 K270 T277 | I269-G273 PolarHBondContact O-N 3.38Å; K270-G273 PolarHBondContact O-N 3.45Å; G273-T277 VanDerWaalsContact O-CB 3.24Å; G273-T277 WeakPolarHBondContact O-CB 3.48Å; G273-T277 PolarHBondContact O-N 3.34Å; G273-T277 PolarHBondContact O-OG1 2.94Å |
| 274 | F | 95.7 | Very high | 93.2 | Very high | 119 Ų | 119 | 52.7 Ų | 52.7 | 52% | 0.522 | 25% | 0.253 | S | S | . | . | H | α-helix | trans | -62.6 | -48.6 | 171.6 | 173.9 | -96.5 | 0 | 0 | 0 | 112 | K270 P271 W272 V276 T277 C278 | K270-F274 PolarHBondContact O-N 3.08Å; P271-F274 WeakPolarHBondContact O-CB 3.35Å; P271-F274 PolarHBondContact O-N 3.25Å; W272-F274 VanDerWaalsContact C-N 3.28Å; W272-F274 PolarHBondContact O-N 3.34Å; F274-V276 PolarHBondContact O-N 3.43Å; F274-T277 PolarHBondContact O-N 3.06Å; F274-C278 WeakPolarHBondContact O-CB 3.26Å; F274-C278 PolarHBondContact O-N 3.38Å |
| 275 | V | 95.9 | Very high | 93.7 | Very high | 0 Ų | 0 | 58.6 Ų | 58.6 | 0% | 0 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -57.1 | -51.7 | 179.2 | 168.6 | 0 | 0 | 0 | 0 | 110.9 | A48 A51 V52 V55 M264 P271 W272 S279 | A48-V275 HydrophobicContact CB-CG2 3.94Å; A48-V275 WeakPolarHBondContact O-CG2 3.49Å; A51-V275 HydrophobicContact CB-CG1 3.82Å; A51-V275 HydrophobicContact CB-CG2 4.21Å; V52-V275 HydrophobicContact CG2-CB 4.22Å; V52-V275 HydrophobicContact CG2-CG1 4.01Å; V52-V275 HydrophobicContact CG2-CG2 4.22Å; V55-V275 HydrophobicContact CG2-CG1 4.23Å; M264-V275 HydrophobicContact SD-CG2 4.1Å; P271-V275 WeakPolarHBondContact O-CG2 3.38Å; P271-V275 PolarHBondContact O-N 3.35Å; W272-V275 HydrophobicContact CE3-CB 4.41Å; W272-V275 HydrophobicContact CE3-CG1 4.35Å; W272-V275 HydrophobicContact CZ3-CG1 4.23Å; W272-V275 WeakPolarHBondContact O-CB 3.37Å; W272-V275 PolarHBondContact O-N 2.91Å; W272-V275 VanDerWaalsContact O-N 3.11Å; V275-S279 VanDerWaalsContact O-CB 3.29Å; V275-S279 WeakPolarHBondContact O-CB 3.2Å; V275-S279 PolarHBondContact O-N 3.43Å; V275-S279 PolarHBondContact O-OG 3.48Å |
| 276 | V | 96.6 | Very high | 94.1 | Very high | 0 Ų | 0 | 52.2 Ų | 52.2 | 0% | 0 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -61.3 | -50.5 | 179.9 | 166.7 | 0 | 0 | 0 | 0 | 111 | I92 L95 V96 W272 F274 C278 S279 M280 | I92-V276 HydrophobicContact CG2-CG1 4.22Å; L95-V276 HydrophobicContact CB-CB 4.38Å; L95-V276 HydrophobicContact CB-CG1 3.55Å; L95-V276 HydrophobicContact CB-CG2 3.88Å; L95-V276 HydrophobicContact CD1-CG1 3.59Å; L95-V276 HydrophobicContact CD1-CG2 4.47Å; L95-V276 HydrophobicContact CG-CG1 4.21Å; V96-V276 HydrophobicContact CG2-CG1 4.49Å; W272-V276 HydrophobicContact CD2-CG2 3.88Å; W272-V276 VanDerWaalsContact CE2-CG2 3.42Å; W272-V276 HydrophobicContact CE3-CG2 4.38Å; W272-V276 HydrophobicContact CG-CG2 4.4Å; W272-V276 HydrophobicContact CH2-CG2 4.11Å; W272-V276 HydrophobicContact CZ2-CG2 3.56Å; W272-V276 HydrophobicContact CZ3-CG2 4.48Å; W272-V276 WeakPolarHBondContact O-CG2 3.28Å; W272-V276 PolarHBondContact O-N 3.02Å; F274-V276 PolarHBondContact O-N 3.43Å; V276-C278 PolarHBondContact O-N 2.7Å; V276-S279 PolarHBondContact O-N 3.07Å; V276-M280 HydrophobicContact CG1-CG 4.36Å; V276-M280 WeakPolarHBondContact O-CB 3.47Å; V276-M280 VanDerWaalsContact O-CG 3.28Å; V276-M280 WeakPolarHBondContact O-CG 3.38Å; V276-M280 PolarHBondContact O-N 2.94Å |
| 277 | T | 96.2 | Very high | 94.6 | Very high | 56 Ų | 56 | 43.4 Ų | 43.4 | 34% | 0.344 | 22% | 0.217 | S | C | . | . | H | α-helix | trans | -63.5 | -46.4 | -176.5 | -55.3 | 0 | 0 | 0 | 0 | 111.3 | G273 F274 S279 M280 I281 | G273-T277 VanDerWaalsContact O-CB 3.24Å; G273-T277 WeakPolarHBondContact O-CB 3.48Å; G273-T277 PolarHBondContact O-N 3.34Å; G273-T277 PolarHBondContact O-OG1 2.94Å; F274-T277 PolarHBondContact O-N 3.06Å; T277-S279 VanDerWaalsContact C-N 3.35Å; T277-S279 PolarHBondContact O-N 2.75Å; T277-M280 PolarHBondContact O-N 2.95Å; T277-I281 HydrophobicContact CG2-CD1 3.91Å; T277-I281 VanDerWaalsContact O-CG1 3.28Å; T277-I281 WeakPolarHBondContact O-CG1 3.37Å; T277-I281 PolarHBondContact O-N 3.25Å |
| 278 | C | 96.1 | Very high | 95 | Very high | 39 Ų | 39 | 40 Ų | 40 | 26% | 0.264 | 20% | 0.204 | S | C | . | . | H | α-helix | trans | -61 | -44.2 | 177 | -177.4 | 0 | 0 | 0 | 0 | 111.4 | V52 F274 V276 M280 I281 I282 | V52-C278 HydrophobicContact CG2-CB 4.34Å; F274-C278 WeakPolarHBondContact O-CB 3.26Å; F274-C278 PolarHBondContact O-N 3.38Å; V276-C278 PolarHBondContact O-N 2.7Å; C278-M280 PolarHBondContact O-N 3.08Å; C278-I281 PolarHBondContact O-N 2.96Å; C278-I282 WeakPolarHBondContact O-CG1 3.46Å; C278-I282 PolarHBondContact O-N 2.85Å |
| 279 | S | 95.4 | Very high | 95.2 | Very high | 0 Ų | 0 | 39.7 Ų | 39.7 | 0% | 0 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -61.1 | -46.4 | 177.8 | -55.5 | 0 | 0 | 0 | 0 | 112 | V52 V275 V276 T277 I281 I282 C283 | V52-S279 WeakPolarHBondContact CA-OG 3.16Å; V52-S279 PolarHBondContact O-OG 2.72Å; V275-S279 VanDerWaalsContact O-CB 3.29Å; V275-S279 WeakPolarHBondContact O-CB 3.2Å; V275-S279 PolarHBondContact O-N 3.43Å; V275-S279 PolarHBondContact O-OG 3.48Å; V276-S279 PolarHBondContact O-N 3.07Å; T277-S279 VanDerWaalsContact C-N 3.35Å; T277-S279 PolarHBondContact O-N 2.75Å; S279-I281 PolarHBondContact O-N 3.45Å; S279-I282 PolarHBondContact O-N 2.94Å; S279-C283 PolarHBondContact O-N 3.12Å; S279-C283 PolarHBondContact O-SG 3.28Å |
| 280 | M | 95.6 | Very high | 95.3 | Very high | 0 Ų | 0 | 37.7 Ų | 37.7 | 0% | 0 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -68.4 | -33.1 | -178.7 | -68.2 | -53.2 | 115.9 | 0 | 0 | 112.5 | V55 A59 L88 I91 I92 L95 F251 C253 V276 T277 C278 C283 L284 | V55-M280 HydrophobicContact CG1-CE 3.62Å; A59-M280 HydrophobicContact CB-CE 4.49Å; L88-M280 HydrophobicContact CD1-CB 3.94Å; I91-M280 HydrophobicContact CG2-CG 4.12Å; I91-M280 HydrophobicContact CG2-SD 3.49Å; I91-M280 WeakPolarHBondContact CG2-SD 3.44Å; I92-M280 HydrophobicContact CD1-CB 3.98Å; I92-M280 HydrophobicContact CD1-CG 4.48Å; I92-M280 HydrophobicContact CG1-CB 3.75Å; I92-M280 HydrophobicContact CG1-CG 3.7Å; L95-M280 HydrophobicContact CD1-CE 3.79Å; L95-M280 HydrophobicContact CD1-CG 4.12Å; L95-M280 HydrophobicContact CD1-SD 4.04Å; F251-M280 HydrophobicContact CD1-SD 4.14Å; C253-M280 WeakPolarHBondContact SG-CE 3.31Å; V276-M280 HydrophobicContact CG1-CG 4.36Å; V276-M280 WeakPolarHBondContact O-CB 3.47Å; V276-M280 VanDerWaalsContact O-CG 3.28Å; V276-M280 WeakPolarHBondContact O-CG 3.38Å; V276-M280 PolarHBondContact O-N 2.94Å; T277-M280 PolarHBondContact O-N 2.95Å; C278-M280 PolarHBondContact O-N 3.08Å; M280-C283 PolarHBondContact O-N 3.49Å; M280-L284 VanDerWaalsContact O-CB 3.31Å; M280-L284 WeakPolarHBondContact O-CB 3.25Å; M280-L284 PolarHBondContact O-N 3.16Å |
| 281 | I | 94.9 | Very high | 95.4 | Very high | 75 Ų | 75 | 28.5 Ų | 28.5 | 39% | 0.385 | 15% | 0.153 | S | C | . | . | H | α-helix | trans | -65.7 | -43.7 | 172.1 | -70.4 | 168.7 | 0 | 0 | 0 | 111.1 | T277 C278 S279 C283 L284 F285 | T277-I281 HydrophobicContact CG2-CD1 3.91Å; T277-I281 VanDerWaalsContact O-CG1 3.28Å; T277-I281 WeakPolarHBondContact O-CG1 3.37Å; T277-I281 PolarHBondContact O-N 3.25Å; C278-I281 PolarHBondContact O-N 2.96Å; S279-I281 PolarHBondContact O-N 3.45Å; I281-C283 VanDerWaalsContact C-N 3.33Å; I281-C283 PolarHBondContact O-N 2.97Å; I281-L284 WeakPolarHBondContact O-CB 3.3Å; I281-L284 PolarHBondContact O-N 2.91Å; I281-F285 HydrophobicContact CG2-CD2 3.93Å; I281-F285 HydrophobicContact CG2-CE2 3.62Å; I281-F285 VanDerWaalsContact O-CD2 3.22Å; I281-F285 WeakPolarHBondContact O-CD2 3.33Å; I281-F285 PolarHBondContact O-N 3.21Å |
| 282 | I | 94.4 | Very high | 95.4 | Very high | 50 Ų | 50 | 28.5 Ų | 28.5 | 26% | 0.256 | 15% | 0.152 | S | C | . | . | H | α-helix | trans | -60.1 | -46.8 | 175.7 | -67.5 | 165.3 | 0 | 0 | 0 | 110.1 | V52 V56 W208 C278 S279 L284 F285 V286 | V52-I282 HydrophobicContact CG1-CD1 3.96Å; V56-I282 HydrophobicContact CG1-CG2 4.06Å; V56-I282 HydrophobicContact CG2-CB 4.24Å; V56-I282 HydrophobicContact CG2-CD1 4.24Å; V56-I282 HydrophobicContact CG2-CG2 4.27Å; W208-I282 HydrophobicContact CZ2-CG2 4.43Å; C278-I282 WeakPolarHBondContact O-CG1 3.46Å; C278-I282 PolarHBondContact O-N 2.85Å; S279-I282 PolarHBondContact O-N 2.94Å; I282-L284 VanDerWaalsContact C-N 3.32Å; I282-L284 PolarHBondContact O-N 3.42Å; I282-F285 PolarHBondContact O-N 2.7Å; I282-V286 PolarHBondContact O-N 3.11Å |
| 283 | C | 95.1 | Very high | 95.4 | Very high | 0 Ų | 0 | 29.2 Ų | 29.2 | 0% | 0 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -61.8 | -40.8 | 178 | -61.3 | 0 | 0 | 0 | 0 | 111.8 | L60 F251 S279 M280 I281 F285 V286 Y287 | L60-C283 HydrophobicContact CD2-CB 4.04Å; F251-C283 HydrophobicContact CD1-CB 4.48Å; F251-C283 HydrophobicContact CE1-CB 3.96Å; S279-C283 PolarHBondContact O-N 3.12Å; S279-C283 PolarHBondContact O-SG 3.28Å; M280-C283 PolarHBondContact O-N 3.49Å; I281-C283 VanDerWaalsContact C-N 3.33Å; I281-C283 PolarHBondContact O-N 2.97Å; C283-F285 PolarHBondContact O-N 3.28Å; C283-V286 PolarHBondContact O-N 2.91Å; C283-Y287 HydrophobicContact CB-CD2 4.08Å; C283-Y287 HydrophobicContact CB-CE2 3.89Å; C283-Y287 VanDerWaalsContact O-CB 3.29Å; C283-Y287 WeakPolarHBondContact O-CB 3.48Å; C283-Y287 WeakPolarHBondContact O-CD2 3.15Å; C283-Y287 VanDerWaalsContact O-CG 3.23Å; C283-Y287 PolarHBondContact O-N 3.4Å |
| 284 | L | 94.6 | Very high | 95.2 | Very high | 20 Ų | 20 | 28.5 Ų | 28.5 | 11% | 0.105 | 15% | 0.149 | C | C | . | . | H | α-helix | trans | -56.2 | -49.1 | 177.4 | 179.8 | 68.5 | 0 | 0 | 0 | 111.9 | Q84 M85 L88 M280 I281 I282 Y287 I288 | Q84-L284 HydrophobicContact CG-CD1 3.9Å; M85-L284 HydrophobicContact SD-CD1 3.88Å; M85-L284 HydrophobicContact SD-CD2 3.82Å; M85-L284 HydrophobicContact SD-CG 4.44Å; L88-L284 HydrophobicContact CD2-CB 4.38Å; L88-L284 HydrophobicContact CD2-CD1 4.13Å; L88-L284 HydrophobicContact CD2-CD2 3.82Å; L88-L284 HydrophobicContact CD2-CG 4.33Å; M280-L284 VanDerWaalsContact O-CB 3.31Å; M280-L284 WeakPolarHBondContact O-CB 3.25Å; M280-L284 PolarHBondContact O-N 3.16Å; I281-L284 WeakPolarHBondContact O-CB 3.3Å; I281-L284 PolarHBondContact O-N 2.91Å; I282-L284 VanDerWaalsContact C-N 3.32Å; I282-L284 PolarHBondContact O-N 3.42Å; L284-Y287 PolarHBondContact O-N 2.8Å; L284-I288 HydrophobicContact CD1-CD1 3.6Å; L284-I288 HydrophobicContact CD1-CG1 4.02Å; L284-I288 HydrophobicContact CD2-CD1 4.5Å; L284-I288 HydrophobicContact CG-CD1 3.83Å; L284-I288 HydrophobicContact CG-CG1 4.41Å; L284-I288 WeakPolarHBondContact O-CB 3.09Å; L284-I288 WeakPolarHBondContact O-CG1 3.38Å; L284-I288 PolarHBondContact O-N 3.32Å |
| 285 | F | 94.5 | Very high | 95.1 | Very high | 132 Ų | 132 | 23.7 Ų | 23.7 | 58% | 0.579 | 13% | 0.128 | S | C | * | . | H | α-helix | trans | -63.6 | -43.4 | -179.9 | -78.6 | -66.5 | 0 | 0 | 0 | 112.4 | W208 I281 I282 C283 G289 | W208-F285 HydrophobicContact CH2-CB 4.44Å; I281-F285 HydrophobicContact CG2-CD2 3.93Å; I281-F285 HydrophobicContact CG2-CE2 3.62Å; I281-F285 VanDerWaalsContact O-CD2 3.22Å; I281-F285 WeakPolarHBondContact O-CD2 3.33Å; I281-F285 PolarHBondContact O-N 3.21Å; I282-F285 PolarHBondContact O-N 2.7Å; C283-F285 PolarHBondContact O-N 3.28Å; F285-G289 PolarHBondContact O-N 3.21Å |
| 286 | V | 95.5 | Very high | 94.8 | Very high | 0 Ų | 0 | 26.8 Ų | 26.8 | 0% | 0 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -61.7 | -45.7 | 178.1 | 162 | 0 | 0 | 0 | 0 | 111.2 | L60 L64 W208 T211 I282 C283 T290 | L60-V286 HydrophobicContact CD1-CB 4.42Å; L60-V286 HydrophobicContact CD1-CG1 4.15Å; L60-V286 HydrophobicContact CD1-CG2 4.2Å; L60-V286 HydrophobicContact CD2-CB 3.92Å; L60-V286 HydrophobicContact CD2-CG1 3.45Å; L60-V286 VanDerWaalsContact CD2-CG1 3.45Å; L60-V286 HydrophobicContact CG-CG1 4.45Å; L64-V286 HydrophobicContact CD1-CG1 3.55Å; L64-V286 HydrophobicContact CD2-CG1 4.09Å; L64-V286 HydrophobicContact CG-CG1 4.46Å; W208-V286 HydrophobicContact CD2-CG2 3.88Å; W208-V286 HydrophobicContact CE3-CG2 4.33Å; W208-V286 HydrophobicContact CG-CG2 4.36Å; W208-V286 HydrophobicContact CH2-CG2 4.19Å; W208-V286 HydrophobicContact CZ2-CG2 3.72Å; W208-V286 HydrophobicContact CZ3-CG2 4.47Å; T211-V286 WeakPolarHBondContact OG1-CG1 3.42Å; I282-V286 PolarHBondContact O-N 3.11Å; C283-V286 PolarHBondContact O-N 2.91Å; V286-T290 WeakPolarHBondContact O-CB 3.39Å; V286-T290 PolarHBondContact O-N 2.93Å; V286-T290 PolarHBondContact O-OG1 2.76Å |
| 287 | Y | 95.8 | Very high | 94.5 | Very high | 0 Ų | 0 | 27.2 Ų | 27.2 | 0% | 0 | 15% | 0.147 | C | C | . | . | H | α-helix | trans | -72.9 | -39.6 | -179.6 | -70.8 | -33.5 | 0 | 0 | 0 | 114.1 | A59 L60 L64 F67 G250 F251 C283 L284 G291 | A59-Y287 PolarHBondContact O-OH 2.67Å; L60-Y287 VanDerWaalsContact CA-OH 3.32Å; L60-Y287 WeakPolarHBondContact CA-OH 3.33Å; L60-Y287 HydrophobicContact CD2-CD1 4.25Å; L60-Y287 HydrophobicContact CD2-CE1 3.63Å; L60-Y287 HydrophobicContact CD2-CE2 4.15Å; L60-Y287 PolarHBondContact N-OH 3.02Å; L64-Y287 HydrophobicContact CB-CD1 4.35Å; L64-Y287 HydrophobicContact CB-CE1 3.87Å; L64-Y287 HydrophobicContact CD1-CD1 3.42Å; L64-Y287 VanDerWaalsContact CD1-CD1 3.42Å; L64-Y287 HydrophobicContact CD1-CE1 3.77Å; L64-Y287 HydrophobicContact CG-CE1 4.45Å; F67-Y287 HydrophobicContact CD1-CD1 4.35Å; F67-Y287 HydrophobicContact CD1-CG 4.09Å; F67-Y287 AromaticContact CD2-CD1 3.48Å; F67-Y287 HydrophobicContact CD2-CD1 3.48Å; F67-Y287 VanDerWaalsContact CD2-CD1 3.48Å; F67-Y287 AromaticContact CD2-CE1 3.94Å; F67-Y287 HydrophobicContact CD2-CE1 3.94Å; F67-Y287 AromaticContact CD2-CG 4Å; F67-Y287 HydrophobicContact CD2-CG 4Å; F67-Y287 HydrophobicContact CE1-CD1 4.15Å; F67-Y287 AromaticContact CE1-CD2 3.96Å; F67-Y287 HydrophobicContact CE1-CD2 3.96Å; F67-Y287 AromaticContact CE1-CG 3.64Å; F67-Y287 HydrophobicContact CE1-CG 3.64Å; F67-Y287 AromaticContact CE2-CD1 3.23Å; F67-Y287 HydrophobicContact CE2-CD1 3.23Å; F67-Y287 AromaticContact CE2-CD2 3.92Å; F67-Y287 HydrophobicContact CE2-CD2 3.92Å; F67-Y287 AromaticContact CE2-CE1 3.41Å; F67-Y287 HydrophobicContact CE2-CE1 3.41Å; F67-Y287 VanDerWaalsContact CE2-CE1 3.41Å; F67-Y287 AromaticContact CE2-CE2 3.98Å; F67-Y287 HydrophobicContact CE2-CE2 3.98Å; F67-Y287 AromaticContact CE2-CG 3.54Å; F67-Y287 HydrophobicContact CE2-CG 3.54Å; F67-Y287 AromaticContact CE2-CZ 3.75Å; F67-Y287 HydrophobicContact CG-CD1 4.04Å; F67-Y287 HydrophobicContact CG-CG 4.25Å; F67-Y287 AromaticContact CZ-CD1 3.61Å; F67-Y287 HydrophobicContact CZ-CD1 3.61Å; F67-Y287 AromaticContact CZ-CD2 3.43Å; F67-Y287 HydrophobicContact CZ-CD2 3.43Å; F67-Y287 VanDerWaalsContact CZ-CD2 3.43Å; F67-Y287 AromaticContact CZ-CE1 3.99Å; F67-Y287 HydrophobicContact CZ-CE1 3.99Å; F67-Y287 AromaticContact CZ-CE2 3.74Å; F67-Y287 HydrophobicContact CZ-CE2 3.74Å; F67-Y287 AromaticContact CZ-CG 3.34Å; F67-Y287 HydrophobicContact CZ-CG 3.34Å; G250-Y287 PolarHBondContact O-OH 3.36Å; F251-Y287 HydrophobicContact CD1-CD2 4.18Å; F251-Y287 AromaticContact CD1-CE2 3.81Å; F251-Y287 HydrophobicContact CD1-CE2 3.81Å; F251-Y287 HydrophobicContact CD2-CD2 4.08Å; F251-Y287 HydrophobicContact CD2-CE2 4.01Å; F251-Y287 AromaticContact CE1-CD2 3.62Å; F251-Y287 HydrophobicContact CE1-CD2 3.62Å; F251-Y287 AromaticContact CE1-CE2 3.71Å; F251-Y287 HydrophobicContact CE1-CE2 3.71Å; F251-Y287 AromaticContact CE2-CD2 3.5Å; F251-Y287 HydrophobicContact CE2-CD2 3.5Å; F251-Y287 VanDerWaalsContact CE2-CD2 3.5Å; F251-Y287 AromaticContact CE2-CE2 3.9Å; F251-Y287 HydrophobicContact CE2-CE2 3.9Å; F251-Y287 HydrophobicContact CE2-CG 4.45Å; F251-Y287 HydrophobicContact CG-CD2 4.42Å; F251-Y287 AromaticContact CG-CE2 3.99Å; F251-Y287 HydrophobicContact CG-CE2 3.99Å; F251-Y287 AromaticContact CZ-CD2 3.3Å; F251-Y287 HydrophobicContact CZ-CD2 3.3Å; F251-Y287 AromaticContact CZ-CE2 3.81Å; F251-Y287 HydrophobicContact CZ-CE2 3.81Å; F251-Y287 HydrophobicContact CZ-CG 4.4Å; C283-Y287 HydrophobicContact CB-CD2 4.08Å; C283-Y287 HydrophobicContact CB-CE2 3.89Å; C283-Y287 VanDerWaalsContact O-CB 3.29Å; C283-Y287 WeakPolarHBondContact O-CB 3.48Å; C283-Y287 WeakPolarHBondContact O-CD2 3.15Å; C283-Y287 VanDerWaalsContact O-CG 3.23Å; C283-Y287 PolarHBondContact O-N 3.4Å; L284-Y287 PolarHBondContact O-N 2.8Å; Y287-G291 WeakPolarHBondContact O-CA 3.47Å; Y287-G291 PolarHBondContact O-N 2.88Å |
| 288 | I | 95.4 | Very high | 94.1 | Very high | 46 Ų | 46 | 25.9 Ų | 25.9 | 24% | 0.236 | 14% | 0.137 | C | C | . | . | H | α-helix | trans | -64.5 | -47.3 | 172.8 | -73.1 | 179.4 | 0 | 0 | 0 | 109.4 | V81 Q84 L284 T290 G291 V292 | V81-I288 HydrophobicContact CG1-CD1 4.35Å; Q84-I288 VanDerWaalsContact OE1-CG1 3.28Å; L284-I288 HydrophobicContact CD1-CD1 3.6Å; L284-I288 HydrophobicContact CD1-CG1 4.02Å; L284-I288 HydrophobicContact CD2-CD1 4.5Å; L284-I288 HydrophobicContact CG-CD1 3.83Å; L284-I288 HydrophobicContact CG-CG1 4.41Å; L284-I288 WeakPolarHBondContact O-CB 3.09Å; L284-I288 WeakPolarHBondContact O-CG1 3.38Å; L284-I288 PolarHBondContact O-N 3.32Å; I288-T290 PolarHBondContact O-N 3.41Å; I288-G291 PolarHBondContact O-N 3.46Å; I288-V292 HydrophobicContact CG2-CG2 3.83Å; I288-V292 VanDerWaalsContact O-CB 3.24Å; I288-V292 WeakPolarHBondContact O-CB 3.44Å; I288-V292 WeakPolarHBondContact O-CG2 3.49Å; I288-V292 PolarHBondContact O-N 3.05Å |
| 289 | G | 95.3 | Very high | 93.7 | Very high | 15 Ų | 15 | 24.3 Ų | 24.3 | 16% | 0.155 | 13% | 0.127 | C | C | . | . | H | α-helix | trans | -56.8 | -51 | 179.9 | 0 | 0 | 0 | 0 | 0 | 111.8 | F285 C293 | F285-G289 PolarHBondContact O-N 3.21Å; G289-C293 VanDerWaalsContact O-CB 3.31Å; G289-C293 WeakPolarHBondContact O-CB 3.41Å; G289-C293 PolarHBondContact O-N 3.4Å; G289-C293 VanDerWaalsContact O-N 3.16Å |
| 290 | T | 95.9 | Very high | 93.2 | Very high | 0 Ų | 0 | 27 Ų | 27 | 0% | 0 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -67.6 | -47 | 178.8 | -57.9 | 0 | 0 | 0 | 0 | 111.8 | L64 P68 T211 V214 V286 I288 G294 V306 | L64-T290 HydrophobicContact CD1-CG2 3.93Å; L64-T290 WeakPolarHBondContact CD1-OG1 3.26Å; L64-T290 HydrophobicContact CG-CG2 4.23Å; P68-T290 HydrophobicContact CG-CG2 4.26Å; P68-T290 WeakPolarHBondContact CG-O 3.24Å; T211-T290 WeakPolarHBondContact CG2-OG1 3.45Å; T211-T290 PolarHBondContact OG1-OG1 2.84Å; V214-T290 HydrophobicContact CG1-CG2 4.43Å; V214-T290 HydrophobicContact CG2-CG2 4.4Å; V286-T290 WeakPolarHBondContact O-CB 3.39Å; V286-T290 PolarHBondContact O-N 2.93Å; V286-T290 PolarHBondContact O-OG1 2.76Å; I288-T290 PolarHBondContact O-N 3.41Å; T290-G294 WeakPolarHBondContact O-CA 3.48Å; T290-G294 PolarHBondContact O-N 3.23Å; T290-V306 HydrophobicContact CG2-CG1 4.44Å |
| 291 | G | 95.3 | Very high | 92.8 | Very high | 0 Ų | 0 | 32 Ų | 32 | 0% | 0 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -62.3 | -47 | -178.1 | 0 | 0 | 0 | 0 | 0 | 113.4 | Y287 I288 F295 | Y287-G291 WeakPolarHBondContact O-CA 3.47Å; Y287-G291 PolarHBondContact O-N 2.88Å; I288-G291 PolarHBondContact O-N 3.46Å; G291-F295 WeakPolarHBondContact O-CB 3.32Å; G291-F295 PolarHBondContact O-N 3.16Å |
| 292 | V | 94.3 | Very high | 92.6 | Very high | 31 Ų | 31 | 29 Ų | 29 | 19% | 0.188 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -67.3 | -56.6 | 179.2 | 176.2 | 0 | 0 | 0 | 0 | 110.6 | F71 V77 V81 I288 F295 L296 | F71-V292 HydrophobicContact CE2-CG2 3.86Å; V77-V292 HydrophobicContact CG1-CG1 4.14Å; V77-V292 HydrophobicContact CG1-CG2 3.85Å; V77-V292 HydrophobicContact CG2-CG1 4.41Å; V81-V292 HydrophobicContact CG2-CG2 4.04Å; I288-V292 HydrophobicContact CG2-CG2 3.83Å; I288-V292 VanDerWaalsContact O-CB 3.24Å; I288-V292 WeakPolarHBondContact O-CB 3.44Å; I288-V292 WeakPolarHBondContact O-CG2 3.49Å; I288-V292 PolarHBondContact O-N 3.05Å; V292-F295 PolarHBondContact O-N 2.86Å; V292-L296 HydrophobicContact CG1-CD1 3.72Å; V292-L296 HydrophobicContact CG1-CG 4.37Å; V292-L296 WeakPolarHBondContact O-CB 3.49Å; V292-L296 VanDerWaalsContact O-CG 3.25Å; V292-L296 WeakPolarHBondContact O-CG 3.15Å; V292-L296 PolarHBondContact O-N 3.35Å |
| 293 | C | 94.3 | Very high | 92.4 | Very high | 15 Ų | 15 | 30.4 Ų | 30.4 | 10% | 0.101 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -67.2 | -40.3 | -175.3 | -70.2 | 0 | 0 | 0 | 0 | 111.9 | V214 I215 Y218 G289 L296 T297 | V214-C293 HydrophobicContact CG1-CB 4.01Å; I215-C293 HydrophobicContact CG1-CB 4.25Å; Y218-C293 HydrophobicContact CD1-CB 4.22Å; Y218-C293 HydrophobicContact CG-CB 4.02Å; G289-C293 VanDerWaalsContact O-CB 3.31Å; G289-C293 WeakPolarHBondContact O-CB 3.41Å; G289-C293 PolarHBondContact O-N 3.4Å; G289-C293 VanDerWaalsContact O-N 3.16Å; C293-L296 PolarHBondContact O-N 3.22Å; C293-T297 WeakPolarHBondContact O-CB 3.25Å; C293-T297 PolarHBondContact O-N 2.62Å; C293-T297 PolarHBondContact O-OG1 3.26Å |
| 294 | G | 93.5 | Very high | 92.2 | Very high | 0 Ų | 0 | 33.1 Ų | 33.1 | 0% | 0 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -63.2 | -45 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | T290 T297 F298 | T290-G294 WeakPolarHBondContact O-CA 3.48Å; T290-G294 PolarHBondContact O-N 3.23Å; G294-T297 PolarHBondContact O-N 3.38Å; G294-F298 WeakPolarHBondContact O-CD2 3.49Å; G294-F298 PolarHBondContact O-N 3.14Å; G294-F298 VanDerWaalsContact O-N 3.17Å |
| 295 | F | 91.9 | Very high | 92.2 | Very high | 19 Ų | 19 | 32.4 Ų | 32.4 | 8% | 0.083 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -66.4 | -42 | 177.2 | 175.3 | -97.7 | 0 | 0 | 0 | 112.2 | F71 V77 G291 V292 T297 F298 G299 | F71-F295 HydrophobicContact CB-CB 4.07Å; F71-F295 HydrophobicContact CB-CD2 4.31Å; F71-F295 HydrophobicContact CB-CG 4.12Å; V77-F295 HydrophobicContact CG2-CD1 3.48Å; V77-F295 VanDerWaalsContact CG2-CD1 3.48Å; V77-F295 HydrophobicContact CG2-CE1 4.03Å; V77-F295 HydrophobicContact CG2-CG 4.49Å; G291-F295 WeakPolarHBondContact O-CB 3.32Å; G291-F295 PolarHBondContact O-N 3.16Å; V292-F295 PolarHBondContact O-N 2.86Å; F295-T297 PolarHBondContact O-N 2.92Å; F295-F298 PolarHBondContact O-N 2.94Å; F295-G299 WeakPolarHBondContact O-CA 3.43Å; F295-G299 PolarHBondContact O-N 3.41Å |
| 296 | L | 90.3 | Very high | 92.1 | Very high | 64 Ų | 64 | 26.1 Ų | 26.1 | 34% | 0.335 | 15% | 0.147 | S | C | . | . | H | α-helix | trans | -67.8 | -23 | 178.3 | -68.6 | 175.3 | 0 | 0 | 0 | 112.8 | V77 Y218 V292 C293 | V77-L296 HydrophobicContact CG2-CD2 3.87Å; V77-L296 HydrophobicContact CG2-CG 4Å; Y218-L296 HydrophobicContact CD2-CB 3.87Å; Y218-L296 HydrophobicContact CE1-CD1 4.35Å; Y218-L296 HydrophobicContact CE2-CB 3.36Å; Y218-L296 HydrophobicContact CE2-CD1 4.06Å; Y218-L296 HydrophobicContact CE2-CG 4.35Å; V292-L296 HydrophobicContact CG1-CD1 3.72Å; V292-L296 HydrophobicContact CG1-CG 4.37Å; V292-L296 WeakPolarHBondContact O-CB 3.49Å; V292-L296 VanDerWaalsContact O-CG 3.25Å; V292-L296 WeakPolarHBondContact O-CG 3.15Å; V292-L296 PolarHBondContact O-N 3.35Å; C293-L296 PolarHBondContact O-N 3.22Å |
| 297 | T | 89.6 | Confident | 92 | Very high | 9 Ų | 9 | 26.1 Ų | 26.1 | 6% | 0.055 | 15% | 0.147 | C | C | . | . | H | α-helix | trans | -77.5 | -44.9 | 176.5 | -56.8 | 0 | 0 | 0 | 0 | 112 | M225 C293 G294 F295 | M225-T297 HydrophobicContact CE-CG2 3.38Å; C293-T297 WeakPolarHBondContact O-CB 3.25Å; C293-T297 PolarHBondContact O-N 2.62Å; C293-T297 PolarHBondContact O-OG1 3.26Å; G294-T297 PolarHBondContact O-N 3.38Å; F295-T297 PolarHBondContact O-N 2.92Å |
| 298 | F | 88.9 | Confident | 91.8 | Very high | 29 Ų | 29 | 27.8 Ų | 27.8 | 13% | 0.127 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -110.8 | -12.2 | -170.4 | -60.7 | -69.4 | 0 | 0 | 0 | 114.8 | M225 G294 F295 S300 N301 V302 V306 S309 Y310 | M225-F298 HydrophobicContact CE-CE1 3.48Å; M225-F298 VanDerWaalsContact CE-CE1 3.48Å; M225-F298 HydrophobicContact CE-CE2 4.39Å; M225-F298 HydrophobicContact CE-CZ 3.39Å; G294-F298 WeakPolarHBondContact O-CD2 3.49Å; G294-F298 PolarHBondContact O-N 3.14Å; G294-F298 VanDerWaalsContact O-N 3.17Å; F295-F298 PolarHBondContact O-N 2.94Å; F298-S300 PolarHBondContact O-N 2.86Å; F298-N301 PolarHBondContact O-N 3.31Å; F298-N301 VanDerWaalsContact O-N 3.16Å; F298-V302 HydrophobicContact CB-CB 3.75Å; F298-V302 HydrophobicContact CB-CG2 4.08Å; F298-V302 HydrophobicContact CD2-CG2 4.1Å; F298-V302 HydrophobicContact CG-CG2 4.43Å; F298-V306 HydrophobicContact CD2-CG2 4.11Å; F298-V306 HydrophobicContact CE2-CG2 3.92Å; F298-S309 VanDerWaalsContact CE1-O 3.23Å; F298-S309 WeakPolarHBondContact CE1-O 3.45Å; F298-Y310 HydrophobicContact CE2-CD2 4Å; F298-Y310 HydrophobicContact CE2-CE1 4.15Å; F298-Y310 AromaticContact CE2-CE2 3.51Å; F298-Y310 HydrophobicContact CE2-CE2 3.51Å; F298-Y310 AromaticContact CE2-CZ 3.57Å; F298-Y310 AromaticContact CZ-CD1 3.89Å; F298-Y310 HydrophobicContact CZ-CD1 3.89Å; F298-Y310 AromaticContact CZ-CD2 3.81Å; F298-Y310 HydrophobicContact CZ-CD2 3.81Å; F298-Y310 AromaticContact CZ-CE1 3.76Å; F298-Y310 HydrophobicContact CZ-CE1 3.76Å; F298-Y310 AromaticContact CZ-CE2 3.71Å; F298-Y310 HydrophobicContact CZ-CE2 3.71Å; F298-Y310 AromaticContact CZ-CG 3.91Å; F298-Y310 HydrophobicContact CZ-CG 3.91Å; F298-Y310 AromaticContact CZ-CZ 3.66Å |
| 299 | G | 86.6 | Confident | 91.6 | Very high | 5 Ų | 5 | 26.8 Ų | 26.8 | 5% | 0.052 | 15% | 0.152 | C | C | . | . | G | 310 helix | trans | 57.1 | -133.7 | -178.2 | 0 | 0 | 0 | 0 | 0 | 112.9 | F295 N301 | F295-G299 WeakPolarHBondContact O-CA 3.43Å; F295-G299 PolarHBondContact O-N 3.41Å; G299-N301 PolarHBondContact O-N 2.99Å |
| 300 | S | 85.1 | Confident | 91.4 | Very high | 57 Ų | 57 | 26.2 Ų | 26.2 | 40% | 0.399 | 15% | 0.145 | S | C | . | . | G | 310 helix | trans | -70.9 | -16 | 178.5 | 58.4 | 0 | 0 | 0 | 0 | 114.3 | S72 A230 F298 V302 | S72-S300 WeakPolarHBondContact OG-CA 3.38Å; A230-S300 WeakPolarHBondContact CB-OG 3.39Å; F298-S300 PolarHBondContact O-N 2.86Å; S300-V302 VanDerWaalsContact C-N 3.3Å |
| 301 | N | 87.6 | Confident | 90.9 | Very high | 105 Ų | 105 | 28.5 Ų | 28.5 | 56% | 0.561 | 16% | 0.16 | S | C | * | . | G | 310 helix | trans | -89.5 | 4.5 | -175.3 | -62.1 | -32.6 | 0 | 0 | 0 | 112.9 | F298 G299 N303 | F298-N301 PolarHBondContact O-N 3.31Å; F298-N301 VanDerWaalsContact O-N 3.16Å; G299-N301 PolarHBondContact O-N 2.99Å; N301-N303 PolarHBondContact O-N 3.43Å |
| 302 | V | 90.2 | Very high | 90.2 | Very high | 13 Ų | 13 | 29.8 Ų | 29.8 | 8% | 0.079 | 17% | 0.169 | C | C | . | . | trans | -62.4 | 130.6 | 178.5 | 69.7 | 0 | 0 | 0 | 0 | 111 | P68 A69 F298 S300 V306 | P68-V302 HydrophobicContact CB-CG1 4.48Å; P68-V302 HydrophobicContact CB-CG2 3.67Å; A69-V302 HydrophobicContact CB-CG1 4.12Å; F298-V302 HydrophobicContact CB-CB 3.75Å; F298-V302 HydrophobicContact CB-CG2 4.08Å; F298-V302 HydrophobicContact CD2-CG2 4.1Å; F298-V302 HydrophobicContact CG-CG2 4.43Å; S300-V302 VanDerWaalsContact C-N 3.3Å; V302-V306 HydrophobicContact CG2-CG2 4.14Å | ||
| 303 | N | 91.6 | Very high | 89.6 | Confident | 79 Ų | 79 | 33.5 Ų | 33.5 | 42% | 0.422 | 19% | 0.187 | S | C | . | . | trans | -67.8 | 158.5 | 172.8 | -70 | -69.1 | 0 | 0 | 0 | 110.7 | N301 D305 M308 S309 | N301-N303 PolarHBondContact O-N 3.43Å; N303-D305 WeakPolarHBondContact CB-O 3.31Å; N303-D305 CarbonylContact O-C 3.58Å; N303-D305 PolarHBondContact O-N 3.41Å; N303-D305 VanDerWaalsContact O-N 3.16Å; N303-M308 HydrophobicContact CB-CB 4.25Å; N303-M308 PolarHBondContact ND2-O 2.92Å; N303-S309 WeakPolarHBondContact CB-OG 3.39Å; N303-S309 PolarHBondContact N-OG 3.21Å; N303-S309 PolarHBondContact ND2-OG 2.87Å; N303-S309 VanDerWaalsContact ND2-OG 3.1Å | ||
| 304 | Q | 91.3 | Very high | 89.2 | Confident | 57 Ų | 57 | 33.9 Ų | 33.9 | 27% | 0.266 | 19% | 0.188 | S | C | . | . | S | Bend | trans | -56.1 | -32.1 | 174.4 | -68.3 | -62.4 | -33.2 | 0 | 0 | 112 | N66 I387 | N66-Q304 WeakPolarHBondContact CA-O 3.21Å; N66-Q304 PolarHBondContact ND2-O 3.18Å; Q304-I387 HydrophobicContact CB-CG2 3.95Å |
| 305 | D | 93.4 | Very high | 89 | Confident | 4 Ų | 4 | 39.4 Ų | 39.4 | 2% | 0.021 | 22% | 0.217 | C | C | . | . | S | Bend | trans | -104.6 | 113.1 | 165.9 | -175.3 | -32.9 | 0 | 0 | 0 | 109.1 | L65 Q148 N303 L307 M308 | L65-D305 WeakPolarHBondContact CD1-OD2 3.41Å; Q148-D305 VanDerWaalsContact NE2-CG 3.27Å; Q148-D305 PolarHBondContact NE2-OD1 3.3Å; Q148-D305 PolarHBondContact NE2-OD2 2.91Å; N303-D305 WeakPolarHBondContact CB-O 3.31Å; N303-D305 CarbonylContact O-C 3.58Å; N303-D305 PolarHBondContact O-N 3.41Å; N303-D305 VanDerWaalsContact O-N 3.16Å; D305-L307 PolarHBondContact O-N 2.96Å; D305-L307 WeakPolarHBondContact OD1-CB 3Å; D305-L307 PolarHBondContact OD1-N 3.48Å; D305-M308 HydrophobicContact CB-CB 4.37Å; D305-M308 HydrophobicContact CB-CG 3.82Å; D305-M308 WeakPolarHBondContact O-CB 3.38Å; D305-M308 PolarHBondContact O-N 3.29Å |
| 306 | V | 93.6 | Very high | 89 | Confident | 0 Ų | 0 | 40 Ų | 40 | 0% | 0 | 23% | 0.225 | C | C | . | . | G | 310 helix | trans | -59.2 | -32.8 | -177.2 | 70.6 | 0 | 0 | 0 | 0 | 113 | L65 P68 T290 F298 V302 M308 S309 Y310 | L65-V306 HydrophobicContact CD2-CG1 4.34Å; L65-V306 PolarHBondContact O-N 3.48Å; P68-V306 HydrophobicContact CB-CB 4.32Å; P68-V306 HydrophobicContact CB-CG2 4.11Å; P68-V306 HydrophobicContact CG-CB 3.85Å; P68-V306 HydrophobicContact CG-CG1 4.33Å; P68-V306 HydrophobicContact CG-CG2 3.78Å; T290-V306 HydrophobicContact CG2-CG1 4.44Å; F298-V306 HydrophobicContact CD2-CG2 4.11Å; F298-V306 HydrophobicContact CE2-CG2 3.92Å; V302-V306 HydrophobicContact CG2-CG2 4.14Å; V306-M308 PolarHBondContact O-N 3.36Å; V306-S309 VanDerWaalsContact O-CB 3.3Å; V306-S309 WeakPolarHBondContact O-CB 3.43Å; V306-S309 PolarHBondContact O-N 3.33Å; V306-S309 PolarHBondContact O-OG 2.88Å; V306-Y310 HydrophobicContact CG2-CE2 4.1Å; V306-Y310 WeakPolarHBondContact O-CD2 3.45Å |
| 307 | L | 93.2 | Very high | 89.1 | Confident | 0 Ų | 0 | 37 Ų | 37 | 0% | 0 | 21% | 0.209 | C | C | . | . | G | 310 helix | trans | -69.4 | -17.8 | -179.5 | -67.1 | 179.2 | 0 | 0 | 0 | 112.8 | L65 V210 D305 S309 Y310 V317 A320 R321 I324 | L65-L307 HydrophobicContact CD2-CD1 3.72Å; L65-L307 HydrophobicContact CD2-CG 3.86Å; V210-L307 HydrophobicContact CG1-CD1 4.41Å; V210-L307 HydrophobicContact CG1-CD2 4.43Å; D305-L307 PolarHBondContact O-N 2.96Å; D305-L307 WeakPolarHBondContact OD1-CB 3Å; D305-L307 PolarHBondContact OD1-N 3.48Å; L307-S309 VanDerWaalsContact C-N 3.29Å; L307-Y310 HydrophobicContact CD2-CD2 4.41Å; L307-V317 HydrophobicContact CD2-CG1 4.31Å; L307-A320 HydrophobicContact CD2-CB 4.27Å; L307-R321 HydrophobicContact CD1-CG 4.38Å; L307-R321 PolarHBondContact O-NH2 2.91Å; L307-R321 VanDerWaalsContact O-NH2 3.1Å; L307-I324 HydrophobicContact CD1-CG1 3.79Å |
| 308 | M | 91.3 | Very high | 89.2 | Confident | 35 Ų | 35 | 37.1 Ų | 37.1 | 17% | 0.172 | 21% | 0.212 | C | C | . | . | G | 310 helix | trans | -79.2 | -12.9 | 172 | -62.5 | -62.4 | -79.1 | 0 | 0 | 113.1 | D147 R151 N303 D305 V306 | D147-M308 HydrophobicContact CB-CE 3.98Å; D147-M308 HydrophobicContact CB-SD 3.95Å; R151-M308 HydrophobicContact CG-CE 4Å; R151-M308 HydrophobicContact CG-SD 3.54Å; R151-M308 VanDerWaalsContact CG-SD 3.54Å; N303-M308 HydrophobicContact CB-CB 4.25Å; N303-M308 PolarHBondContact ND2-O 2.92Å; D305-M308 HydrophobicContact CB-CB 4.37Å; D305-M308 HydrophobicContact CB-CG 3.82Å; D305-M308 WeakPolarHBondContact O-CB 3.38Å; D305-M308 PolarHBondContact O-N 3.29Å; V306-M308 PolarHBondContact O-N 3.36Å |
| 309 | S | 90.9 | Very high | 89.4 | Confident | 25 Ų | 25 | 39.9 Ų | 39.9 | 18% | 0.175 | 23% | 0.227 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -85.8 | -17.8 | 175.2 | -47.2 | 0 | 0 | 0 | 0 | 112.5 | F298 N303 V306 L307 | F298-S309 VanDerWaalsContact CE1-O 3.23Å; F298-S309 WeakPolarHBondContact CE1-O 3.45Å; N303-S309 WeakPolarHBondContact CB-OG 3.39Å; N303-S309 PolarHBondContact N-OG 3.21Å; N303-S309 PolarHBondContact ND2-OG 2.87Å; N303-S309 VanDerWaalsContact ND2-OG 3.1Å; V306-S309 VanDerWaalsContact O-CB 3.3Å; V306-S309 WeakPolarHBondContact O-CB 3.43Å; V306-S309 PolarHBondContact O-N 3.33Å; V306-S309 PolarHBondContact O-OG 2.88Å; L307-S309 VanDerWaalsContact C-N 3.29Å |
| 310 | Y | 90.3 | Very high | 89.7 | Confident | 4 Ų | 4 | 39.7 Ų | 39.7 | 2% | 0.016 | 23% | 0.225 | C | C | . | . | S | Bend | trans | -84.9 | 147.9 | 173.6 | -70.2 | -84.5 | 0 | 0 | 0 | 111.1 | V214 K217 M225 F298 V306 L307 V317 R321 | V214-Y310 HydrophobicContact CG2-CE2 4.27Å; K217-Y310 HydrophobicContact CB-CE1 3.61Å; K217-Y310 HydrophobicContact CD-CE1 4.35Å; K217-Y310 HydrophobicContact CG-CD1 4.45Å; K217-Y310 HydrophobicContact CG-CE1 3.81Å; M225-Y310 HydrophobicContact CE-CD1 3.62Å; M225-Y310 HydrophobicContact CE-CE1 3.41Å; M225-Y310 VanDerWaalsContact CE-CE1 3.41Å; M225-Y310 HydrophobicContact SD-CD1 3.94Å; M225-Y310 HydrophobicContact SD-CE1 3.99Å; F298-Y310 HydrophobicContact CE2-CD2 4Å; F298-Y310 HydrophobicContact CE2-CE1 4.15Å; F298-Y310 AromaticContact CE2-CE2 3.51Å; F298-Y310 HydrophobicContact CE2-CE2 3.51Å; F298-Y310 AromaticContact CE2-CZ 3.57Å; F298-Y310 AromaticContact CZ-CD1 3.89Å; F298-Y310 HydrophobicContact CZ-CD1 3.89Å; F298-Y310 AromaticContact CZ-CD2 3.81Å; F298-Y310 HydrophobicContact CZ-CD2 3.81Å; F298-Y310 AromaticContact CZ-CE1 3.76Å; F298-Y310 HydrophobicContact CZ-CE1 3.76Å; F298-Y310 AromaticContact CZ-CE2 3.71Å; F298-Y310 HydrophobicContact CZ-CE2 3.71Å; F298-Y310 AromaticContact CZ-CG 3.91Å; F298-Y310 HydrophobicContact CZ-CG 3.91Å; F298-Y310 AromaticContact CZ-CZ 3.66Å; V306-Y310 HydrophobicContact CG2-CE2 4.1Å; V306-Y310 WeakPolarHBondContact O-CD2 3.45Å; L307-Y310 HydrophobicContact CD2-CD2 4.41Å; Y310-V317 HydrophobicContact CD1-CG2 3.97Å; Y310-V317 HydrophobicContact CG-CG1 4.26Å; Y310-V317 HydrophobicContact CG-CG2 3.94Å; Y310-R321 PolarHBondContact O-NH2 3.42Å |
| 311 | P | 86.2 | Confident | 90.2 | Very high | 47 Ų | 47 | 37 Ų | 37 | 31% | 0.305 | 21% | 0.206 | S | C | . | . | trans | -67.6 | 159 | 178 | 34.6 | -38.8 | 0 | 0 | 0 | 111.1 | D313 R321 | P311-D313 WeakPolarHBondContact CB-OD1 3.22Å; P311-D313 WeakPolarHBondContact CG-OD1 3.45Å; P311-R321 PolarHBondContact O-NH2 3.26Å | ||
| 312 | P | 81.3 | Confident | 90.4 | Very high | 28 Ų | 28 | 33.3 Ų | 33.3 | 18% | 0.182 | 19% | 0.19 | C | C | . | . | S | Bend | trans | -74.9 | -27.9 | -173.7 | 27.6 | -32.8 | 0 | 0 | 0 | 114.2 | A154 A155 D314 R321 | A154-P312 HydrophobicContact CB-CB 4.26Å; A155-P312 WeakPolarHBondContact CB-O 3.48Å; P312-D314 VanDerWaalsContact C-N 3.34Å; P312-D314 PolarHBondContact O-N 2.7Å; P312-R321 PolarHBondContact O-NH1 3.42Å |
| 313 | D | 81.4 | Confident | 90.5 | Very high | 109 Ų | 109 | 35.4 Ų | 35.4 | 58% | 0.583 | 20% | 0.198 | S | C | * | . | S | Bend | trans | -74.2 | -13.8 | -170.5 | 59.6 | -37.3 | 0 | 0 | 0 | 115.3 | P311 I315 | P311-D313 WeakPolarHBondContact CB-OD1 3.22Å; P311-D313 WeakPolarHBondContact CG-OD1 3.45Å; D313-I315 PolarHBondContact O-N 2.78Å |
| 314 | D | 85.8 | Confident | 90.5 | Very high | 23 Ų | 23 | 31.7 Ų | 31.7 | 12% | 0.123 | 18% | 0.178 | C | C | . | . | trans | -77.3 | 115.7 | 178.9 | -179 | -6.7 | 0 | 0 | 0 | 112.6 | K217 P312 A316 V317 A318 | K217-D314 WeakPolarHBondContact CE-OD2 3.36Å; K217-D314 IonicContact NZ-OD1 3.88Å; K217-D314 IonicContact NZ-OD2 2.61Å; K217-D314 PolarHBondContact NZ-OD2 3.34Å; P312-D314 VanDerWaalsContact C-N 3.34Å; P312-D314 PolarHBondContact O-N 2.7Å; D314-A316 VanDerWaalsContact C-N 3.32Å; D314-A316 PolarHBondContact O-N 3.11Å; D314-A316 WeakPolarHBondContact OD1-CB 3.45Å; D314-A316 PolarHBondContact OD1-N 3Å; D314-V317 HydrophobicContact CB-CB 4.05Å; D314-V317 HydrophobicContact CB-CG2 4.06Å; D314-V317 PolarHBondContact O-N 3.45Å; D314-V317 VanDerWaalsContact OD2-CG2 3.24Å; D314-V317 WeakPolarHBondContact OD2-CG2 3.2Å; D314-A318 WeakPolarHBondContact O-CB 3.35Å; D314-A318 PolarHBondContact O-N 3.3Å | ||
| 315 | I | 88.8 | Confident | 90.6 | Very high | 116 Ų | 116 | 29.7 Ų | 29.7 | 60% | 0.595 | 17% | 0.17 | S | C | * | . | H | α-helix | trans | -57.8 | -40.3 | 179.4 | -59.8 | 172.6 | 0 | 0 | 0 | 112.3 | D313 A318 L319 | D313-I315 PolarHBondContact O-N 2.78Å; I315-A318 PolarHBondContact O-N 3.35Å; I315-L319 HydrophobicContact CG2-CD1 4.4Å; I315-L319 WeakPolarHBondContact O-CG 3.31Å; I315-L319 PolarHBondContact O-N 3.33Å |
| 316 | A | 91.8 | Very high | 90.3 | Very high | 32 Ų | 32 | 32.7 Ų | 32.7 | 26% | 0.264 | 19% | 0.186 | S | C | . | . | H | α-helix | trans | -67.9 | -41 | -178.6 | 0 | 0 | 0 | 0 | 0 | 110.9 | Y209 V213 D314 A320 | Y209-A316 PolarHBondContact OH-O 3.01Å; V213-A316 HydrophobicContact CG1-CB 4.44Å; V213-A316 HydrophobicContact CG2-CB 4.34Å; D314-A316 VanDerWaalsContact C-N 3.32Å; D314-A316 PolarHBondContact O-N 3.11Å; D314-A316 WeakPolarHBondContact OD1-CB 3.45Å; D314-A316 PolarHBondContact OD1-N 3Å; A316-A320 PolarHBondContact O-N 2.84Å; A316-A320 VanDerWaalsContact O-N 3.07Å |
| 317 | V | 92.3 | Very high | 90.1 | Very high | 0 Ų | 0 | 32.7 Ų | 32.7 | 0% | 0 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -67.2 | -43.1 | 174 | 175.8 | 0 | 0 | 0 | 0 | 110.1 | V213 L307 Y310 D314 L319 A320 R321 | V213-V317 HydrophobicContact CG1-CG2 3.98Å; L307-V317 HydrophobicContact CD2-CG1 4.31Å; Y310-V317 HydrophobicContact CD1-CG2 3.97Å; Y310-V317 HydrophobicContact CG-CG1 4.26Å; Y310-V317 HydrophobicContact CG-CG2 3.94Å; D314-V317 HydrophobicContact CB-CB 4.05Å; D314-V317 HydrophobicContact CB-CG2 4.06Å; D314-V317 PolarHBondContact O-N 3.45Å; D314-V317 VanDerWaalsContact OD2-CG2 3.24Å; D314-V317 WeakPolarHBondContact OD2-CG2 3.2Å; V317-L319 VanDerWaalsContact C-N 3.33Å; V317-L319 PolarHBondContact O-N 3.08Å; V317-A320 CarbonylContact O-C 3.55Å; V317-A320 WeakPolarHBondContact O-CA 3.29Å; V317-A320 VanDerWaalsContact O-CB 3.26Å; V317-A320 WeakPolarHBondContact O-CB 3.25Å; V317-A320 PolarHBondContact O-N 3.34Å; V317-R321 HydrophobicContact CG1-CG 4.4Å; V317-R321 VanDerWaalsContact O-CG 3.28Å; V317-R321 WeakPolarHBondContact O-CG 3.28Å; V317-R321 PolarHBondContact O-N 2.91Å |
| 318 | A | 92.1 | Very high | 90 | Very high | 12 Ų | 12 | 32.7 Ų | 32.7 | 10% | 0.099 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -57.6 | -43.1 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.4 | L152 A155 D314 I315 A320 R321 A322 | L152-A318 HydrophobicContact CD1-CB 3.94Å; A155-A318 HydrophobicContact CB-CB 4.3Å; D314-A318 WeakPolarHBondContact O-CB 3.35Å; D314-A318 PolarHBondContact O-N 3.3Å; I315-A318 PolarHBondContact O-N 3.35Å; A318-A320 VanDerWaalsContact C-N 3.31Å; A318-A320 PolarHBondContact O-N 3.32Å; A318-R321 WeakPolarHBondContact O-CB 3.44Å; A318-R321 PolarHBondContact O-N 3.42Å; A318-A322 PolarHBondContact O-N 3.26Å |
| 319 | L | 92.6 | Very high | 89.8 | Confident | 87 Ų | 87 | 31.6 Ų | 31.6 | 46% | 0.455 | 18% | 0.181 | S | C | . | . | H | α-helix | trans | -62.2 | -38.3 | 171.8 | -73.2 | 175 | 0 | 0 | 0 | 111.9 | Y209 I315 V317 R321 A322 F323 | Y209-L319 HydrophobicContact CE1-CB 3.76Å; Y209-L319 WeakPolarHBondContact OH-CB 3.46Å; I315-L319 HydrophobicContact CG2-CD1 4.4Å; I315-L319 WeakPolarHBondContact O-CG 3.31Å; I315-L319 PolarHBondContact O-N 3.33Å; V317-L319 VanDerWaalsContact C-N 3.33Å; V317-L319 PolarHBondContact O-N 3.08Å; L319-R321 VanDerWaalsContact C-N 3.35Å; L319-A322 PolarHBondContact O-N 3.45Å; L319-F323 VanDerWaalsContact O-CD2 3.24Å; L319-F323 WeakPolarHBondContact O-CD2 3.43Å; L319-F323 PolarHBondContact O-N 2.96Å |
| 320 | A | 93.9 | Very high | 89.4 | Confident | 0 Ų | 0 | 31.7 Ų | 31.7 | 0% | 0 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -63.8 | -41.6 | 176.5 | 0 | 0 | 0 | 0 | 0 | 111 | Y209 V210 V213 L307 A316 V317 A318 A322 F323 I324 | Y209-A320 HydrophobicContact CD1-CB 4.04Å; Y209-A320 HydrophobicContact CE1-CB 3.87Å; V210-A320 HydrophobicContact CG2-CB 3.89Å; V213-A320 HydrophobicContact CG2-CB 4.49Å; L307-A320 HydrophobicContact CD2-CB 4.27Å; A316-A320 PolarHBondContact O-N 2.84Å; A316-A320 VanDerWaalsContact O-N 3.07Å; V317-A320 CarbonylContact O-C 3.55Å; V317-A320 WeakPolarHBondContact O-CA 3.29Å; V317-A320 VanDerWaalsContact O-CB 3.26Å; V317-A320 WeakPolarHBondContact O-CB 3.25Å; V317-A320 PolarHBondContact O-N 3.34Å; A318-A320 VanDerWaalsContact C-N 3.31Å; A318-A320 PolarHBondContact O-N 3.32Å; A320-A322 PolarHBondContact O-N 3.45Å; A320-F323 PolarHBondContact O-N 2.88Å; A320-I324 WeakPolarHBondContact O-CG1 3.24Å; A320-I324 PolarHBondContact O-N 2.99Å |
| 321 | R | 94.1 | Very high | 89.1 | Confident | 0 Ų | 0 | 31.7 Ų | 31.7 | 0% | 0 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -58.7 | -46.1 | 173.2 | -55.3 | -161.5 | 178.6 | 107.1 | 0.5 | 111.2 | Q148 L307 Y310 P311 P312 V317 A318 L319 F323 I324 V325 | Q148-R321 HydrophobicContact CB-CB 4.28Å; Q148-R321 VanDerWaalsContact OE1-CB 3.27Å; Q148-R321 VanDerWaalsContact OE1-CD 3.26Å; L307-R321 HydrophobicContact CD1-CG 4.38Å; L307-R321 PolarHBondContact O-NH2 2.91Å; L307-R321 VanDerWaalsContact O-NH2 3.1Å; Y310-R321 PolarHBondContact O-NH2 3.42Å; P311-R321 PolarHBondContact O-NH2 3.26Å; P312-R321 PolarHBondContact O-NH1 3.42Å; V317-R321 HydrophobicContact CG1-CG 4.4Å; V317-R321 VanDerWaalsContact O-CG 3.28Å; V317-R321 WeakPolarHBondContact O-CG 3.28Å; V317-R321 PolarHBondContact O-N 2.91Å; A318-R321 WeakPolarHBondContact O-CB 3.44Å; A318-R321 PolarHBondContact O-N 3.42Å; L319-R321 VanDerWaalsContact C-N 3.35Å; R321-F323 PolarHBondContact O-N 3.31Å; R321-I324 PolarHBondContact O-N 3.5Å; R321-V325 WeakPolarHBondContact O-CG2 3.5Å; R321-V325 PolarHBondContact O-N 2.9Å |
| 322 | A | 92.5 | Very high | 89.2 | Confident | 29 Ų | 29 | 29.4 Ų | 29.4 | 24% | 0.24 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -60.9 | -42.4 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | L152 A318 L319 A320 I324 V325 I326 | L152-A322 HydrophobicContact CD2-CB 4.25Å; A318-A322 PolarHBondContact O-N 3.26Å; L319-A322 PolarHBondContact O-N 3.45Å; A320-A322 PolarHBondContact O-N 3.45Å; A322-I324 PolarHBondContact O-N 3.22Å; A322-V325 PolarHBondContact O-N 3.46Å; A322-I326 WeakPolarHBondContact O-CG1 3.39Å; A322-I326 PolarHBondContact O-N 3.43Å |
| 323 | F | 92.3 | Very high | 89.2 | Confident | 56 Ų | 56 | 29.3 Ų | 29.3 | 25% | 0.246 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -63.1 | -39.7 | 174.9 | -85.2 | -64.3 | 0 | 0 | 0 | 112.9 | L202 G206 Y209 L319 A320 R321 I326 C327 | L202-F323 HydrophobicContact CD1-CE1 4.33Å; G206-F323 VanDerWaalsContact CA-CD1 3.48Å; Y209-F323 AromaticContact CD1-CD2 3.57Å; Y209-F323 HydrophobicContact CD1-CD2 3.57Å; Y209-F323 AromaticContact CD1-CE2 3.98Å; Y209-F323 HydrophobicContact CD1-CE2 3.98Å; Y209-F323 HydrophobicContact CD2-CE2 4.49Å; Y209-F323 HydrophobicContact CE1-CD2 4.13Å; Y209-F323 HydrophobicContact CE1-CE2 4.39Å; Y209-F323 AromaticContact CG-CD2 3.98Å; Y209-F323 HydrophobicContact CG-CD2 3.98Å; Y209-F323 HydrophobicContact CG-CE2 4.03Å; L319-F323 VanDerWaalsContact O-CD2 3.24Å; L319-F323 WeakPolarHBondContact O-CD2 3.43Å; L319-F323 PolarHBondContact O-N 2.96Å; A320-F323 PolarHBondContact O-N 2.88Å; R321-F323 PolarHBondContact O-N 3.31Å; F323-I326 PolarHBondContact O-N 2.92Å; F323-C327 WeakPolarHBondContact O-CB 3.45Å; F323-C327 PolarHBondContact O-N 3.04Å |
| 324 | I | 92.3 | Very high | 89.1 | Confident | 1 Ų | 1 | 25 Ų | 25 | 1% | 0.005 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -63.2 | -43.9 | 174.1 | -71.2 | -61.9 | 0 | 0 | 0 | 111.2 | L65 V144 Q148 V210 L307 A320 R321 A322 I326 C327 V328 | L65-I324 HydrophobicContact CD1-CD1 4.33Å; L65-I324 HydrophobicContact CD1-CG1 4.35Å; L65-I324 HydrophobicContact CD1-CG2 3.78Å; L65-I324 HydrophobicContact CD2-CD1 3.92Å; L65-I324 HydrophobicContact CD2-CG1 4.08Å; L65-I324 HydrophobicContact CG-CD1 4.33Å; V144-I324 HydrophobicContact CG1-CG2 3.73Å; Q148-I324 HydrophobicContact CG-CG2 3.95Å; V210-I324 HydrophobicContact CG2-CD1 3.77Å; V210-I324 HydrophobicContact CG2-CG1 3.69Å; L307-I324 HydrophobicContact CD1-CG1 3.79Å; A320-I324 WeakPolarHBondContact O-CG1 3.24Å; A320-I324 PolarHBondContact O-N 2.99Å; R321-I324 PolarHBondContact O-N 3.5Å; A322-I324 PolarHBondContact O-N 3.22Å; I324-I326 VanDerWaalsContact C-N 3.3Å; I324-I326 PolarHBondContact O-N 3.19Å; I324-C327 WeakPolarHBondContact O-CB 3.4Å; I324-C327 PolarHBondContact O-N 3.5Å; I324-V328 HydrophobicContact CG2-CG2 4.24Å; I324-V328 WeakPolarHBondContact O-CG2 3.22Å; I324-V328 PolarHBondContact O-N 3.26Å |
| 325 | V | 91.9 | Very high | 88.9 | Confident | 16 Ų | 16 | 25.1 Ų | 25.1 | 10% | 0.097 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -57.4 | -46.8 | 176 | 172.9 | 0 | 0 | 0 | 0 | 110.3 | Q148 L149 R321 A322 C327 V328 V329 | Q148-V325 HydrophobicContact CB-CG2 3.61Å; L149-V325 HydrophobicContact CD2-CG1 4.23Å; L149-V325 HydrophobicContact CD2-CG2 4.11Å; L149-V325 HydrophobicContact CG-CG1 4.41Å; L149-V325 HydrophobicContact CG-CG2 4.06Å; R321-V325 WeakPolarHBondContact O-CG2 3.5Å; R321-V325 PolarHBondContact O-N 2.9Å; A322-V325 PolarHBondContact O-N 3.46Å; V325-C327 PolarHBondContact O-N 2.99Å; V325-V328 PolarHBondContact O-N 3.43Å; V325-V329 HydrophobicContact CG1-CG2 4.17Å; V325-V329 VanDerWaalsContact O-CB 3.29Å; V325-V329 WeakPolarHBondContact O-CB 3.33Å; V325-V329 WeakPolarHBondContact O-CG2 3.31Å; V325-V329 PolarHBondContact O-N 3.07Å |
| 326 | I | 88.6 | Confident | 88.7 | Confident | 67 Ų | 67 | 19.7 Ų | 19.7 | 34% | 0.344 | 12% | 0.115 | S | C | . | . | H | α-helix | trans | -61.4 | -45.3 | 177.1 | -66 | 166.8 | 0 | 0 | 0 | 111.2 | L202 A322 F323 I324 V328 T330 | L202-I326 HydrophobicContact CD2-CG2 3.7Å; L202-I326 HydrophobicContact CG-CG2 4.19Å; A322-I326 WeakPolarHBondContact O-CG1 3.39Å; A322-I326 PolarHBondContact O-N 3.43Å; F323-I326 PolarHBondContact O-N 2.92Å; I324-I326 VanDerWaalsContact C-N 3.3Å; I324-I326 PolarHBondContact O-N 3.19Å; I326-V328 PolarHBondContact O-N 2.91Å; I326-T330 HydrophobicContact CG2-CG2 4.43Å; I326-T330 WeakPolarHBondContact O-CB 3.4Å; I326-T330 VanDerWaalsContact O-CG2 3.24Å; I326-T330 WeakPolarHBondContact O-CG2 3.2Å; I326-T330 PolarHBondContact O-N 3.05Å; I326-T330 PolarHBondContact O-OG1 2.92Å |
| 327 | C | 88.5 | Confident | 88.1 | Confident | 0 Ų | 0 | 19.8 Ų | 19.8 | 0% | 0 | 11% | 0.109 | C | C | . | . | H | α-helix | trans | -56.7 | -47.9 | 176.9 | 170.8 | 0 | 0 | 0 | 0 | 111.8 | S203 F323 I324 V325 T330 S331 | S203-C327 PolarHBondContact OG-SG 3.17Å; F323-C327 WeakPolarHBondContact O-CB 3.45Å; F323-C327 PolarHBondContact O-N 3.04Å; I324-C327 WeakPolarHBondContact O-CB 3.4Å; I324-C327 PolarHBondContact O-N 3.5Å; V325-C327 PolarHBondContact O-N 2.99Å; C327-T330 PolarHBondContact O-N 3.44Å; C327-T330 PolarHBondContact O-OG1 3.4Å; C327-S331 VanDerWaalsContact O-CB 3.3Å; C327-S331 WeakPolarHBondContact O-CB 3.33Å; C327-S331 PolarHBondContact O-N 3.01Å; C327-S331 PolarHBondContact O-OG 3.27Å |
| 328 | V | 90.1 | Very high | 87.5 | Confident | 0 Ų | 0 | 20.7 Ų | 20.7 | 0% | 0 | 12% | 0.115 | C | C | . | . | H | α-helix | trans | -72.6 | -42.6 | -177.3 | 177.5 | 0 | 0 | 0 | 0 | 111.5 | A62 F141 V144 I145 I324 V325 I326 T330 S331 Y332 | A62-V328 HydrophobicContact CB-CG2 3.98Å; F141-V328 HydrophobicContact CB-CG1 3.38Å; F141-V328 HydrophobicContact CD1-CG1 3.7Å; F141-V328 HydrophobicContact CD2-CG1 3.94Å; F141-V328 HydrophobicContact CE1-CG1 4.42Å; F141-V328 HydrophobicContact CG-CG1 3.41Å; F141-V328 VanDerWaalsContact CG-CG1 3.41Å; V144-V328 HydrophobicContact CG1-CG2 4.04Å; I145-V328 HydrophobicContact CD1-CB 4.38Å; I145-V328 HydrophobicContact CD1-CG1 3.81Å; I145-V328 HydrophobicContact CG1-CB 4.17Å; I145-V328 HydrophobicContact CG1-CG1 3.84Å; I324-V328 HydrophobicContact CG2-CG2 4.24Å; I324-V328 WeakPolarHBondContact O-CG2 3.22Å; I324-V328 PolarHBondContact O-N 3.26Å; V325-V328 PolarHBondContact O-N 3.43Å; I326-V328 PolarHBondContact O-N 2.91Å; V328-T330 VanDerWaalsContact C-N 3.27Å; V328-T330 PolarHBondContact O-N 3.46Å; V328-S331 PolarHBondContact O-N 2.97Å; V328-S331 VanDerWaalsContact O-N 3.14Å; V328-Y332 PolarHBondContact O-N 3.43Å |
| 329 | V | 87.6 | Confident | 87.2 | Confident | 11 Ų | 11 | 20.1 Ų | 20.1 | 7% | 0.067 | 11% | 0.111 | C | C | . | . | H | α-helix | trans | -59.2 | -39.2 | 175.3 | 165.7 | 0 | 0 | 0 | 0 | 111.4 | I145 T179 V183 I184 L187 V325 P333 | I145-V329 HydrophobicContact CD1-CG2 3.69Å; I145-V329 HydrophobicContact CG1-CG2 4.38Å; T179-V329 HydrophobicContact CG2-CG2 4.42Å; V183-V329 HydrophobicContact CG1-CG1 3.59Å; I184-V329 HydrophobicContact CD1-CG2 4.25Å; I184-V329 HydrophobicContact CG1-CG1 4.23Å; I184-V329 HydrophobicContact CG1-CG2 4.1Å; L187-V329 HydrophobicContact CD1-CG1 3.73Å; V325-V329 HydrophobicContact CG1-CG2 4.17Å; V325-V329 VanDerWaalsContact O-CB 3.29Å; V325-V329 WeakPolarHBondContact O-CB 3.33Å; V325-V329 WeakPolarHBondContact O-CG2 3.31Å; V325-V329 PolarHBondContact O-N 3.07Å; V329-P333 WeakPolarHBondContact O-CD 3.26Å |
| 330 | T | 82.7 | Confident | 86.7 | Confident | 27 Ų | 27 | 16.4 Ų | 16.4 | 17% | 0.166 | 9% | 0.091 | C | C | . | . | H | α-helix | trans | -77.8 | -24.2 | 178.3 | 54.1 | 0 | 0 | 0 | 0 | 113.3 | A199 I326 C327 V328 | A199-T330 HydrophobicContact CB-CG2 3.75Å; I326-T330 HydrophobicContact CG2-CG2 4.43Å; I326-T330 WeakPolarHBondContact O-CB 3.4Å; I326-T330 VanDerWaalsContact O-CG2 3.24Å; I326-T330 WeakPolarHBondContact O-CG2 3.2Å; I326-T330 PolarHBondContact O-N 3.05Å; I326-T330 PolarHBondContact O-OG1 2.92Å; C327-T330 PolarHBondContact O-N 3.44Å; C327-T330 PolarHBondContact O-OG1 3.4Å; V328-T330 VanDerWaalsContact C-N 3.27Å; V328-T330 PolarHBondContact O-N 3.46Å |
| 331 | S | 84.1 | Confident | 85.9 | Confident | 4 Ų | 4 | 16.8 Ų | 16.8 | 3% | 0.028 | 9% | 0.094 | C | C | . | . | H | α-helix | trans | -84.8 | -28.8 | 178.3 | -61.3 | 0 | 0 | 0 | 0 | 113.3 | C327 V328 I334 L335 | C327-S331 VanDerWaalsContact O-CB 3.3Å; C327-S331 WeakPolarHBondContact O-CB 3.33Å; C327-S331 PolarHBondContact O-N 3.01Å; C327-S331 PolarHBondContact O-OG 3.27Å; V328-S331 PolarHBondContact O-N 2.97Å; V328-S331 VanDerWaalsContact O-N 3.14Å; S331-I334 WeakPolarHBondContact O-CB 3.42Å; S331-I334 WeakPolarHBondContact O-CG1 3.38Å; S331-I334 PolarHBondContact O-N 2.88Å; S331-L335 WeakPolarHBondContact O-CD1 3.4Å; S331-L335 PolarHBondContact O-N 3.38Å |
| 332 | Y | 87.9 | Confident | 85.3 | Confident | 0 Ų | 0 | 16.9 Ų | 16.9 | 0% | 0 | 9% | 0.094 | C | C | . | . | H | α-helix | trans | -55.1 | -48.9 | -178.9 | -175 | -73.9 | 0 | 0 | 0 | 113.8 | C138 F141 F142 I184 V328 I334 L335 H336 F374 T377 | C138-Y332 HydrophobicContact CB-CD2 4.27Å; C138-Y332 HydrophobicContact CB-CE2 3.5Å; F141-Y332 HydrophobicContact CB-CD2 3.99Å; F141-Y332 AromaticContact CD2-CD2 3.99Å; F141-Y332 HydrophobicContact CD2-CD2 3.99Å; F141-Y332 HydrophobicContact CD2-CG 4.36Å; F142-Y332 HydrophobicContact CD2-CE2 4.12Å; F142-Y332 HydrophobicContact CE1-CE2 4.26Å; F142-Y332 AromaticContact CE2-CE2 3.61Å; F142-Y332 HydrophobicContact CE2-CE2 3.61Å; F142-Y332 AromaticContact CE2-CZ 3.84Å; F142-Y332 WeakPolarHBondContact CE2-OH 3.47Å; F142-Y332 AromaticContact CZ-CE2 3.68Å; F142-Y332 HydrophobicContact CZ-CE2 3.68Å; F142-Y332 AromaticContact CZ-CZ 3.78Å; I184-Y332 HydrophobicContact CG2-CD1 3.23Å; I184-Y332 HydrophobicContact CG2-CD2 4.25Å; I184-Y332 HydrophobicContact CG2-CE1 3.57Å; I184-Y332 HydrophobicContact CG2-CG 3.63Å; V328-Y332 PolarHBondContact O-N 3.43Å; Y332-I334 PolarHBondContact O-N 2.84Å; Y332-I334 VanDerWaalsContact O-N 3.16Å; Y332-L335 PolarHBondContact O-N 3.21Å; Y332-H336 HydrophobicContact CD1-CB 4.13Å; Y332-H336 HydrophobicContact CE1-CB 3.92Å; Y332-H336 VanDerWaalsContact O-CB 3.3Å; Y332-H336 WeakPolarHBondContact O-CB 3.46Å; Y332-H336 PolarHBondContact O-N 3.34Å; Y332-F374 HydrophobicContact CE1-CD2 4.37Å; Y332-T377 PolarHBondContact OH-OG1 3.41Å |
| 333 | P | 82.2 | Confident | 85 | Confident | 25 Ų | 25 | 17.5 Ų | 17.5 | 16% | 0.162 | 10% | 0.095 | C | C | . | . | H | α-helix | trans | -58.4 | -32 | -179.3 | -27.2 | 36.2 | 0 | 0 | 0 | 113.6 | L187 V329 F337 | L187-P333 HydrophobicContact CB-CG 3.78Å; L187-P333 WeakPolarHBondContact O-CB 3.41Å; V329-P333 WeakPolarHBondContact O-CD 3.26Å; P333-F337 WeakPolarHBondContact O-CB 3.26Å; P333-F337 PolarHBondContact O-N 2.82Å |
| 334 | I | 78.5 | Confident | 84.5 | Confident | 18 Ų | 18 | 15.1 Ų | 15.1 | 9% | 0.092 | 9% | 0.085 | C | C | . | . | H | α-helix | trans | -66.7 | -53.1 | -178.9 | -40.4 | 174.9 | 0 | 0 | 0 | 109.7 | Q196 S331 Y332 H336 F337 C338 | Q196-I334 HydrophobicContact CG-CD1 3.8Å; Q196-I334 HydrophobicContact CG-CG1 4.11Å; Q196-I334 VanDerWaalsContact OE1-CG1 3.31Å; S331-I334 WeakPolarHBondContact O-CB 3.42Å; S331-I334 WeakPolarHBondContact O-CG1 3.38Å; S331-I334 PolarHBondContact O-N 2.88Å; Y332-I334 PolarHBondContact O-N 2.84Å; Y332-I334 VanDerWaalsContact O-N 3.16Å; I334-H336 VanDerWaalsContact C-N 3.33Å; I334-H336 PolarHBondContact O-N 3.01Å; I334-F337 WeakPolarHBondContact O-CB 3.45Å; I334-F337 PolarHBondContact O-N 2.91Å; I334-C338 PolarHBondContact O-N 3.29Å; I334-C338 PolarHBondContact O-SG 3.27Å |
| 335 | L | 82.3 | Confident | 83.8 | Confident | 26 Ų | 26 | 15.3 Ų | 15.3 | 14% | 0.136 | 9% | 0.086 | C | C | . | . | H | α-helix | trans | -66.6 | -39.7 | 179.9 | -84.7 | 83.1 | 0 | 0 | 0 | 111.1 | T137 F141 S331 Y332 F337 C338 G339 | T137-L335 VanDerWaalsContact CB-CD2 3.42Å; T137-L335 HydrophobicContact CG2-CD2 3.23Å; F141-L335 HydrophobicContact CE2-CD1 4.08Å; F141-L335 HydrophobicContact CE2-CD2 4.33Å; F141-L335 HydrophobicContact CZ-CD1 4.27Å; F141-L335 HydrophobicContact CZ-CD2 4.37Å; S331-L335 WeakPolarHBondContact O-CD1 3.4Å; S331-L335 PolarHBondContact O-N 3.38Å; Y332-L335 PolarHBondContact O-N 3.21Å; L335-F337 VanDerWaalsContact C-N 3.3Å; L335-F337 PolarHBondContact O-N 3.22Å; L335-C338 PolarHBondContact O-N 3.43Å; L335-G339 PolarHBondContact O-N 2.93Å |
| 336 | H | 84.6 | Confident | 83.3 | Confident | 2 Ų | 2 | 16.7 Ų | 16.7 | 1% | 0.009 | 9% | 0.093 | C | C | . | . | H | α-helix | trans | -60.9 | -40.3 | 174.4 | -177.1 | -77.9 | 0 | 0 | 0 | 111.6 | Y332 I334 G339 R340 T370 W373 | Y332-H336 HydrophobicContact CD1-CB 4.13Å; Y332-H336 HydrophobicContact CE1-CB 3.92Å; Y332-H336 VanDerWaalsContact O-CB 3.3Å; Y332-H336 WeakPolarHBondContact O-CB 3.46Å; Y332-H336 PolarHBondContact O-N 3.34Å; I334-H336 VanDerWaalsContact C-N 3.33Å; I334-H336 PolarHBondContact O-N 3.01Å; H336-G339 PolarHBondContact O-N 3.43Å; H336-R340 WeakPolarHBondContact O-CB 3.48Å; H336-R340 PolarHBondContact O-N 2.91Å; H336-T370 PolarHBondContact CE1-OG1 3.33Å; H336-W373 AromaticContact CD2-CD1 3.34Å; H336-W373 AromaticContact CD2-CG 3.95Å; H336-W373 AromaticContact CD2-NE1 3.8Å; H336-W373 AromaticContact NE2-CD1 3.59Å; H336-W373 AromaticContact NE2-CG 3.75Å |
| 337 | F | 79.5 | Confident | 83 | Confident | 35 Ų | 35 | 19.2 Ų | 19.2 | 15% | 0.154 | 10% | 0.099 | C | C | . | . | H | α-helix | trans | -61 | -47.5 | 174.1 | 175.4 | -87 | 0 | 0 | 0 | 111.5 | Q27 I193 P333 I334 L335 R340 A341 | Q27-F337 HydrophobicContact CB-CZ 4.29Å; Q27-F337 WeakPolarHBondContact O-CZ 3.25Å; I193-F337 HydrophobicContact CD1-CE1 4.35Å; P333-F337 WeakPolarHBondContact O-CB 3.26Å; P333-F337 PolarHBondContact O-N 2.82Å; I334-F337 WeakPolarHBondContact O-CB 3.45Å; I334-F337 PolarHBondContact O-N 2.91Å; L335-F337 VanDerWaalsContact C-N 3.3Å; L335-F337 PolarHBondContact O-N 3.22Å; F337-R340 VanDerWaalsContact CD2-NH2 3.25Å; F337-A341 VanDerWaalsContact O-CB 3.3Å; F337-A341 WeakPolarHBondContact O-CB 3.46Å; F337-A341 PolarHBondContact O-N 3.42Å |
| 338 | C | 79.8 | Confident | 82.4 | Confident | 18 Ų | 18 | 19.5 Ų | 19.5 | 12% | 0.122 | 10% | 0.1 | C | C | . | . | H | α-helix | trans | -63.2 | -40.4 | 176.6 | -67.9 | 0 | 0 | 0 | 0 | 112.7 | T134 V255 I334 L335 A341 V342 | T134-C338 HydrophobicContact CG2-CB 4.3Å; V255-C338 HydrophobicContact CG1-CB 4.43Å; I334-C338 PolarHBondContact O-N 3.29Å; I334-C338 PolarHBondContact O-SG 3.27Å; L335-C338 PolarHBondContact O-N 3.43Å; C338-A341 WeakPolarHBondContact O-CB 3.27Å; C338-A341 PolarHBondContact O-N 3.34Å; C338-V342 WeakPolarHBondContact O-CG2 3.23Å; C338-V342 PolarHBondContact O-N 2.9Å |
| 339 | G | 84.5 | Confident | 81.7 | Confident | 0 Ų | 0 | 21.7 Ų | 21.7 | 0% | 0 | 11% | 0.108 | C | C | . | . | H | α-helix | trans | -64.7 | -49.5 | 177 | 0 | 0 | 0 | 0 | 0 | 111.8 | T134 L335 H336 A341 V342 V343 | T134-G339 WeakPolarHBondContact OG1-CA 3.38Å; L335-G339 PolarHBondContact O-N 2.93Å; H336-G339 PolarHBondContact O-N 3.43Å; G339-A341 PolarHBondContact O-N 2.96Å; G339-V342 PolarHBondContact O-N 3.14Å; G339-V343 WeakPolarHBondContact O-CG2 3.47Å; G339-V343 PolarHBondContact O-N 3.01Å |
| 340 | R | 81.9 | Confident | 81.2 | Confident | 10 Ų | 10 | 30 Ų | 30 | 4% | 0.038 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -56.5 | -39.3 | 173.2 | -177.1 | -178.6 | 67.6 | -163.6 | -4.6 | 111.3 | H336 F337 V342 V343 E344 R366 Q369 T370 | H336-R340 WeakPolarHBondContact O-CB 3.48Å; H336-R340 PolarHBondContact O-N 2.91Å; F337-R340 VanDerWaalsContact CD2-NH2 3.25Å; R340-V342 VanDerWaalsContact C-N 3.25Å; R340-V342 PolarHBondContact O-N 3.47Å; R340-V343 PolarHBondContact O-N 3.14Å; R340-E344 VanDerWaalsContact O-CB 3.25Å; R340-E344 WeakPolarHBondContact O-CB 3.21Å; R340-E344 PolarHBondContact O-N 2.98Å; R340-R366 VanDerWaalsContact NH1-CG 3.31Å; R340-Q369 HydrophobicContact CG-CB 4.46Å; R340-T370 PolarHBondContact NH1-OG1 3.44Å |
| 341 | A | 78 | Confident | 80.7 | Confident | 8 Ų | 8 | 32.4 Ų | 32.4 | 7% | 0.066 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -55.7 | -46.5 | -177.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | Q27 F337 C338 G339 G345 | Q27-A341 PolarHBondContact NE2-O 2.88Å; Q27-A341 PolarHBondContact OE1-O 2.92Å; F337-A341 VanDerWaalsContact O-CB 3.3Å; F337-A341 WeakPolarHBondContact O-CB 3.46Å; F337-A341 PolarHBondContact O-N 3.42Å; C338-A341 WeakPolarHBondContact O-CB 3.27Å; C338-A341 PolarHBondContact O-N 3.34Å; G339-A341 PolarHBondContact O-N 2.96Å; A341-G345 PolarHBondContact O-N 3.15Å |
| 342 | V | 82.3 | Confident | 79.7 | Confident | 2 Ų | 2 | 35.1 Ų | 35.1 | 1% | 0.012 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -76.7 | -40.9 | -177.5 | 174.5 | 0 | 0 | 0 | 0 | 112.6 | Q111 E127 I130 A131 C338 G339 R340 E344 G345 L346 | Q111-V342 HydrophobicContact CG-CG2 4.36Å; E127-V342 VanDerWaalsContact C-CG1 3.48Å; E127-V342 VanDerWaalsContact CA-CG1 3.42Å; E127-V342 HydrophobicContact CB-CG1 3.44Å; E127-V342 VanDerWaalsContact CB-CG1 3.44Å; E127-V342 HydrophobicContact CG-CG1 3.8Å; E127-V342 WeakPolarHBondContact O-CG1 3.41Å; I130-V342 HydrophobicContact CB-CG2 4.22Å; I130-V342 HydrophobicContact CG2-CG2 3.8Å; A131-V342 HydrophobicContact CB-CG1 4.39Å; C338-V342 WeakPolarHBondContact O-CG2 3.23Å; C338-V342 PolarHBondContact O-N 2.9Å; G339-V342 PolarHBondContact O-N 3.14Å; R340-V342 VanDerWaalsContact C-N 3.25Å; R340-V342 PolarHBondContact O-N 3.47Å; V342-E344 VanDerWaalsContact C-N 3.27Å; V342-E344 PolarHBondContact O-N 3.48Å; V342-G345 PolarHBondContact O-N 2.69Å; V342-L346 HydrophobicContact CG1-CD1 4.22Å; V342-L346 WeakPolarHBondContact O-CG 3.24Å; V342-L346 PolarHBondContact O-N 2.88Å |
| 343 | V | 85.6 | Confident | 78.3 | Confident | 41 Ų | 41 | 37.5 Ų | 37.5 | 25% | 0.248 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -58.5 | -43.2 | 175 | 170.7 | 0 | 0 | 0 | 0 | 111.2 | A131 G339 R340 L346 W347 W373 | A131-V343 HydrophobicContact CB-CG2 4.43Å; G339-V343 WeakPolarHBondContact O-CG2 3.47Å; G339-V343 PolarHBondContact O-N 3.01Å; R340-V343 PolarHBondContact O-N 3.14Å; V343-L346 PolarHBondContact O-N 3.35Å; V343-W347 VanDerWaalsContact O-CB 3.29Å; V343-W347 WeakPolarHBondContact O-CB 3.37Å; V343-W347 PolarHBondContact O-N 3.06Å; V343-W373 HydrophobicContact CG2-CE3 4.1Å; V343-W373 HydrophobicContact CG2-CH2 4.35Å; V343-W373 HydrophobicContact CG2-CZ3 3.46Å; V343-W373 VanDerWaalsContact CG2-CZ3 3.46Å |
| 344 | E | 82 | Confident | 76.9 | Confident | 7 Ų | 7 | 43.5 Ų | 43.5 | 3% | 0.033 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -63.3 | -43.2 | 177 | 177 | 67.6 | -177.2 | 0 | 0 | 111.6 | Q27 R340 V342 W347 L348 R365 Q369 | Q27-E344 VanDerWaalsContact NE2-CG 3.29Å; R340-E344 VanDerWaalsContact O-CB 3.25Å; R340-E344 WeakPolarHBondContact O-CB 3.21Å; R340-E344 PolarHBondContact O-N 2.98Å; V342-E344 VanDerWaalsContact C-N 3.27Å; V342-E344 PolarHBondContact O-N 3.48Å; E344-W347 PolarHBondContact O-N 3.49Å; E344-L348 HydrophobicContact CG-CD1 4.18Å; E344-L348 WeakPolarHBondContact O-CB 3.19Å; E344-L348 VanDerWaalsContact O-CG 3.29Å; E344-L348 WeakPolarHBondContact O-CG 3.29Å; E344-L348 PolarHBondContact O-N 2.62Å; E344-R365 IonicContact OE1-CZ 2.63Å; E344-R365 IonicContact OE1-NE 2.62Å; E344-R365 PolarHBondContact OE1-NE 3.35Å; E344-R365 IonicContact OE1-NH2 3.85Å; E344-R365 PolarHBondContact OE1-NH2 3.12Å; E344-R365 WeakPolarHBondContact OE2-CD 3.13Å; E344-R365 IonicContact OE2-CZ 3.31Å; E344-R365 IonicContact OE2-NE 2.99Å; E344-R365 PolarHBondContact OE2-NE 3.17Å; E344-Q369 PolarHBondContact OE2-NE2 3.43Å; E344-Q369 PolarHBondContact OE2-OE1 2.88Å |
| 345 | G | 77.9 | Confident | 75.9 | Confident | 4 Ų | 4 | 45.7 Ų | 45.7 | 4% | 0.041 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -60 | -45.7 | 174.4 | 0 | 0 | 0 | 0 | 0 | 112.8 | A341 V342 R349 | A341-G345 PolarHBondContact O-N 3.15Å; V342-G345 PolarHBondContact O-N 2.69Å; G345-R349 WeakPolarHBondContact O-CB 3.01Å; G345-R349 WeakPolarHBondContact O-CD 3.33Å; G345-R349 WeakPolarHBondContact O-CG 3.34Å; G345-R349 PolarHBondContact O-N 3.42Å; G345-R349 VanDerWaalsContact O-N 3.1Å |
| 346 | L | 81.7 | Confident | 74.5 | Confident | 46 Ų | 46 | 52.3 Ų | 52.3 | 24% | 0.241 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -61.7 | -44.7 | 175.5 | -73 | 170.3 | 0 | 0 | 0 | 111.7 | V124 E127 M128 V342 V343 R349 F350 | V124-L346 HydrophobicContact CG1-CD2 4.18Å; E127-L346 HydrophobicContact CB-CD1 4.2Å; E127-L346 HydrophobicContact CB-CD2 3.93Å; E127-L346 HydrophobicContact CB-CG 4.06Å; E127-L346 VanDerWaalsContact OE2-CD2 3.29Å; E127-L346 WeakPolarHBondContact OE2-CD2 3.17Å; M128-L346 HydrophobicContact CG-CD1 4.36Å; V342-L346 HydrophobicContact CG1-CD1 4.22Å; V342-L346 WeakPolarHBondContact O-CG 3.24Å; V342-L346 PolarHBondContact O-N 2.88Å; V343-L346 PolarHBondContact O-N 3.35Å; L346-R349 PolarHBondContact O-N 2.79Å; L346-F350 WeakPolarHBondContact O-CB 3.3Å; L346-F350 PolarHBondContact O-N 3.06Å |
| 347 | W | 81.2 | Confident | 73.3 | Confident | 120 Ų | 120 | 54.9 Ų | 54.9 | 46% | 0.455 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -61.7 | -48.1 | 179.7 | -177.4 | -89.1 | 0 | 0 | 0 | 112.1 | V343 E344 R349 F350 Q351 | V343-W347 VanDerWaalsContact O-CB 3.29Å; V343-W347 WeakPolarHBondContact O-CB 3.37Å; V343-W347 PolarHBondContact O-N 3.06Å; E344-W347 PolarHBondContact O-N 3.49Å; W347-R349 VanDerWaalsContact C-N 3.32Å; W347-R349 PolarHBondContact O-N 3.02Å; W347-F350 PolarHBondContact O-N 3.22Å; W347-Q351 HydrophobicContact CZ2-CG 4.3Å; W347-Q351 PolarHBondContact O-N 3.16Å |
| 348 | L | 77.1 | Confident | 72.4 | Confident | 5 Ų | 5 | 53.4 Ų | 53.4 | 3% | 0.026 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -62.2 | -39.8 | 178.7 | -72 | 173.9 | 0 | 0 | 0 | 112 | A23 L26 E344 F350 Q351 G352 C358 | A23-L348 HydrophobicContact CB-CD1 4.13Å; L26-L348 HydrophobicContact CD1-CD1 4.27Å; E344-L348 HydrophobicContact CG-CD1 4.18Å; E344-L348 WeakPolarHBondContact O-CB 3.19Å; E344-L348 VanDerWaalsContact O-CG 3.29Å; E344-L348 WeakPolarHBondContact O-CG 3.29Å; E344-L348 PolarHBondContact O-N 2.62Å; L348-F350 VanDerWaalsContact C-N 3.34Å; L348-Q351 PolarHBondContact O-N 3.18Å; L348-G352 PolarHBondContact O-N 3.14Å; L348-G352 VanDerWaalsContact O-N 3.07Å; L348-C358 HydrophobicContact CD2-CB 4.15Å; L348-C358 WeakPolarHBondContact CD2-SG 3.39Å |
| 349 | R | 74.1 | Confident | 71.6 | Confident | 47 Ų | 47 | 56.5 Ų | 56.5 | 18% | 0.177 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -66.8 | -35.1 | 176.6 | -72.6 | 170.3 | -179.2 | -172.3 | 7 | 112.7 | S19 E112 R115 E127 G345 L346 W347 | S19-R349 VanDerWaalsContact CB-CG 3.47Å; E112-R349 IonicContact OE1-CZ 2.82Å; E112-R349 IonicContact OE1-NH2 3.04Å; E112-R349 PolarHBondContact OE1-NH2 3.1Å; E112-R349 IonicContact OE2-NH2 2.9Å; E112-R349 PolarHBondContact OE2-NH2 2.98Å; R115-R349 VanDerWaalsContact CD-NH2 3.32Å; R115-R349 VanDerWaalsContact CZ-NH1 3.33Å; E127-R349 IonicContact OE1-CZ 3.53Å; E127-R349 IonicContact OE1-NH1 2.72Å; E127-R349 PolarHBondContact OE1-NH1 3.48Å; E127-R349 IonicContact OE1-NH2 3.9Å; E127-R349 PolarHBondContact OE1-NH2 2.93Å; E127-R349 IonicContact OE2-CZ 2.67Å; E127-R349 IonicContact OE2-NH1 2.63Å; E127-R349 PolarHBondContact OE2-NH1 2.89Å; G345-R349 WeakPolarHBondContact O-CB 3.01Å; G345-R349 WeakPolarHBondContact O-CD 3.33Å; G345-R349 WeakPolarHBondContact O-CG 3.34Å; G345-R349 PolarHBondContact O-N 3.42Å; G345-R349 VanDerWaalsContact O-N 3.1Å; L346-R349 PolarHBondContact O-N 2.79Å; W347-R349 VanDerWaalsContact C-N 3.32Å; W347-R349 PolarHBondContact O-N 3.02Å |
| 350 | F | 78.3 | Confident | 70.6 | Confident | 184 Ų | 184 | 66.1 Ų | 66.1 | 81% | 0.807 | 33% | 0.327 | S | S | * | . | H | α-helix | trans | -72.4 | -39.2 | 177.3 | -169.5 | -97.3 | 0 | 0 | 0 | 112.3 | L346 W347 L348 | L346-F350 WeakPolarHBondContact O-CB 3.3Å; L346-F350 PolarHBondContact O-N 3.06Å; W347-F350 PolarHBondContact O-N 3.22Å; L348-F350 VanDerWaalsContact C-N 3.34Å |
| 351 | Q | 72.1 | Confident | 69.9 | Low | 78 Ų | 78 | 72 Ų | 72 | 36% | 0.364 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -83.2 | -25.3 | -176.4 | -70.5 | -159.3 | -51.7 | 0 | 0 | 114.8 | W347 L348 E353 | W347-Q351 HydrophobicContact CZ2-CG 4.3Å; W347-Q351 PolarHBondContact O-N 3.16Å; L348-Q351 PolarHBondContact O-N 3.18Å; Q351-E353 HydrophobicContact CB-CG 4.11Å; Q351-E353 PolarHBondContact O-N 3.32Å; Q351-E353 VanDerWaalsContact O-N 3.12Å |
| 352 | G | 63.3 | Low | 69.7 | Low | 61 Ų | 61 | 72.6 Ų | 72.6 | 63% | 0.629 | 35% | 0.35 | S | S | * | . | trans | 60.4 | 21.2 | 179.9 | 0 | 0 | 0 | 0 | 0 | 114.9 | L348 | L348-G352 PolarHBondContact O-N 3.14Å; L348-G352 VanDerWaalsContact O-N 3.07Å | ||
| 353 | E | 58.3 | Low | 69.3 | Low | 50 Ų | 50 | 81.3 Ų | 81.3 | 23% | 0.234 | 38% | 0.383 | C | S | . | . | trans | -68.9 | 156.9 | -175.1 | -78.8 | -173.3 | 176 | 0 | 0 | 113.3 | R22 Q351 | R22-E353 PolarHBondContact NH1-O 3.22Å; Q351-E353 HydrophobicContact CB-CG 4.11Å; Q351-E353 PolarHBondContact O-N 3.32Å; Q351-E353 VanDerWaalsContact O-N 3.12Å | ||
| 354 | Q | 52.3 | Low | 68.9 | Low | 151 Ų | 151 | 89.4 Ų | 89.4 | 71% | 0.706 | 41% | 0.409 | S | S | * | . | trans | -71.7 | 144.2 | 175.4 | -66.1 | -127.7 | -8.2 | 0 | 0 | 112.6 | E356 V357 C358 | Q354-E356 VanDerWaalsContact C-N 3.34Å; Q354-E356 PolarHBondContact O-N 3.4Å; Q354-V357 PolarHBondContact O-N 2.78Å; Q354-C358 PolarHBondContact O-N 3.22Å | ||
| 355 | V | 56.7 | Low | 68.8 | Low | 64 Ų | 64 | 90.4 Ų | 90.4 | 39% | 0.388 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -51.8 | -44.8 | -173.2 | -174.7 | 0 | 0 | 0 | 0 | 113.3 | R22 V357 C358 V359 | R22-V355 HydrophobicContact CG-CG2 4.23Å; R22-V355 VanDerWaalsContact NH2-CG2 3.3Å; V355-V357 VanDerWaalsContact C-N 3.34Å; V355-V357 PolarHBondContact O-N 3.4Å; V355-C358 WeakPolarHBondContact O-CB 3.33Å; V355-C358 PolarHBondContact O-N 2.93Å; V355-C358 VanDerWaalsContact O-N 3.12Å; V355-V359 HydrophobicContact CG1-CG2 4.29Å; V355-V359 WeakPolarHBondContact O-CG2 2.95Å; V355-V359 PolarHBondContact O-N 2.9Å |
| 356 | E | 53.9 | Low | 68.7 | Low | 166 Ų | 166 | 91 Ų | 91 | 78% | 0.776 | 41% | 0.414 | S | S | * | . | H | α-helix | trans | -64.1 | -35.8 | -174.8 | -103.8 | 169.3 | 143.1 | 0 | 0 | 113.4 | Q354 R360 | Q354-E356 VanDerWaalsContact C-N 3.34Å; Q354-E356 PolarHBondContact O-N 3.4Å; E356-R360 PolarHBondContact O-N 2.82Å |
| 357 | V | 60 | Low | 68.7 | Low | 56 Ų | 56 | 92.4 Ų | 92.4 | 34% | 0.339 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -72.1 | -36.5 | 175.8 | -177.6 | 0 | 0 | 0 | 0 | 110.3 | Q354 V355 R360 R361 | Q354-V357 PolarHBondContact O-N 2.78Å; V355-V357 VanDerWaalsContact C-N 3.34Å; V355-V357 PolarHBondContact O-N 3.4Å; V357-R360 PolarHBondContact O-N 2.91Å; V357-R361 PolarHBondContact O-N 3.24Å |
| 358 | C | 60.3 | Low | 69 | Low | 3 Ų | 3 | 92 Ų | 92 | 2% | 0.02 | 43% | 0.427 | C | S | . | . | H | α-helix | trans | -63.9 | -39.7 | 177.2 | -69.9 | 0 | 0 | 0 | 0 | 112.9 | L348 Q354 V355 E362 R365 | L348-C358 HydrophobicContact CD2-CB 4.15Å; L348-C358 WeakPolarHBondContact CD2-SG 3.39Å; Q354-C358 PolarHBondContact O-N 3.22Å; V355-C358 WeakPolarHBondContact O-CB 3.33Å; V355-C358 PolarHBondContact O-N 2.93Å; V355-C358 VanDerWaalsContact O-N 3.12Å; C358-E362 WeakPolarHBondContact O-CA 2.94Å; C358-E362 WeakPolarHBondContact O-CB 3.14Å; C358-E362 PolarHBondContact O-N 2.86Å; C358-R365 PolarHBondContact O-NH2 3.44Å |
| 359 | V | 62.5 | Low | 69.4 | Low | 83 Ų | 83 | 93.2 Ų | 93.2 | 50% | 0.503 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -68.9 | -41.4 | 177.7 | 176.2 | 0 | 0 | 0 | 0 | 111.4 | L26 V355 R361 E362 | L26-V359 HydrophobicContact CD2-CG2 4.06Å; V355-V359 HydrophobicContact CG1-CG2 4.29Å; V355-V359 WeakPolarHBondContact O-CG2 2.95Å; V355-V359 PolarHBondContact O-N 2.9Å; V359-R361 PolarHBondContact O-N 3.26Å; V359-E362 WeakPolarHBondContact O-CB 3.35Å; V359-E362 PolarHBondContact O-N 3.43Å |
| 360 | R | 62.6 | Low | 69.9 | Low | 203 Ų | 203 | 91.2 Ų | 91.2 | 77% | 0.766 | 43% | 0.426 | S | S | * | . | H | α-helix | trans | -67.4 | -34.1 | 179.8 | -169 | 173.5 | 68.2 | 156.9 | -1.1 | 113.1 | E356 V357 | E356-R360 PolarHBondContact O-N 2.82Å; V357-R360 PolarHBondContact O-N 2.91Å |
| 361 | R | 68.7 | Low | 70.4 | Confident | 134 Ų | 134 | 86.1 Ų | 86.1 | 51% | 0.506 | 41% | 0.406 | S | S | . | . | H | α-helix | trans | -91.4 | -10.1 | 178.8 | -72.7 | -179.1 | 172.7 | 175.9 | -1.9 | 114.1 | V357 V359 R363 R364 R365 | V357-R361 PolarHBondContact O-N 3.24Å; V359-R361 PolarHBondContact O-N 3.26Å; R361-R363 PolarHBondContact O-N 3.09Å; R361-R364 PolarHBondContact O-N 3.3Å; R361-R364 VanDerWaalsContact O-N 3.12Å; R361-R365 WeakPolarHBondContact O-CB 3.44Å; R361-R365 PolarHBondContact O-N 3.3Å |
| 362 | E | 73 | Confident | 71.4 | Confident | 19 Ų | 19 | 86.2 Ų | 86.2 | 9% | 0.089 | 41% | 0.412 | C | S | . | . | H | α-helix | trans | -42.4 | -60 | -178.9 | -170.8 | -69.1 | 114.3 | 0 | 0 | 112.5 | L26 K191 C358 V359 R364 R365 R366 | L26-E362 HydrophobicContact CB-CG 4.24Å; L26-E362 HydrophobicContact CD1-CG 4.15Å; L26-E362 HydrophobicContact CD2-CB 4.42Å; L26-E362 HydrophobicContact CD2-CG 3.65Å; L26-E362 HydrophobicContact CG-CG 4.21Å; K191-E362 IonicContact NZ-OE2 3.73Å; K191-E362 PolarHBondContact NZ-OE2 2.93Å; C358-E362 WeakPolarHBondContact O-CA 2.94Å; C358-E362 WeakPolarHBondContact O-CB 3.14Å; C358-E362 PolarHBondContact O-N 2.86Å; V359-E362 WeakPolarHBondContact O-CB 3.35Å; V359-E362 PolarHBondContact O-N 3.43Å; E362-R364 VanDerWaalsContact C-N 3.33Å; E362-R364 PolarHBondContact O-N 3.02Å; E362-R365 PolarHBondContact O-N 3.44Å; E362-R366 VanDerWaalsContact O-CB 3.26Å; E362-R366 WeakPolarHBondContact O-CB 3.39Å; E362-R366 PolarHBondContact O-N 3.26Å; E362-R366 IonicContact OE1-CZ 3.3Å; E362-R366 IonicContact OE1-NE 3.77Å; E362-R366 PolarHBondContact OE1-NE 3.04Å; E362-R366 IonicContact OE1-NH2 3.73Å; E362-R366 PolarHBondContact OE1-NH2 3.28Å; E362-R366 IonicContact OE2-CZ 3.19Å; E362-R366 IonicContact OE2-NE 2.82Å; E362-R366 IonicContact OE2-NH2 2.72Å; E362-R366 PolarHBondContact OE2-NH2 3.39Å |
| 363 | R | 73.3 | Confident | 72.7 | Confident | 185 Ų | 185 | 84.7 Ų | 84.7 | 70% | 0.698 | 39% | 0.387 | S | S | * | . | H | α-helix | trans | -60.5 | -41.5 | -175.8 | -171.9 | 179.5 | -177.3 | -144.2 | 1 | 112.3 | R361 I367 | R361-R363 PolarHBondContact O-N 3.09Å; R363-I367 HydrophobicContact CG-CD1 4.04Å; R363-I367 WeakPolarHBondContact O-CD1 3.5Å; R363-I367 VanDerWaalsContact O-CG1 3.24Å; R363-I367 WeakPolarHBondContact O-CG1 3.45Å; R363-I367 PolarHBondContact O-N 2.96Å |
| 364 | R | 78.3 | Confident | 74.3 | Confident | 212 Ų | 212 | 82.6 Ų | 82.6 | 80% | 0.8 | 38% | 0.377 | S | S | * | . | H | α-helix | trans | -70.6 | -42 | -179.6 | -170.8 | 177.1 | -179.9 | -176 | -0.5 | 111.2 | R361 E362 I367 L368 | R361-R364 PolarHBondContact O-N 3.3Å; R361-R364 VanDerWaalsContact O-N 3.12Å; E362-R364 VanDerWaalsContact C-N 3.33Å; E362-R364 PolarHBondContact O-N 3.02Å; R364-I367 PolarHBondContact O-N 2.98Å; R364-L368 VanDerWaalsContact O-CB 3.32Å; R364-L368 WeakPolarHBondContact O-CB 3.5Å; R364-L368 PolarHBondContact O-N 3.04Å |
| 365 | R | 78.4 | Confident | 76.3 | Confident | 27 Ų | 27 | 79 Ų | 79 | 10% | 0.102 | 37% | 0.366 | C | S | . | . | H | α-helix | trans | -64.2 | -44.7 | 176.2 | -178.1 | 169.1 | 61.6 | -122.7 | -10.7 | 111.1 | E344 C358 R361 E362 I367 L368 Q369 | E344-R365 IonicContact OE1-CZ 2.63Å; E344-R365 IonicContact OE1-NE 2.62Å; E344-R365 PolarHBondContact OE1-NE 3.35Å; E344-R365 IonicContact OE1-NH2 3.85Å; E344-R365 PolarHBondContact OE1-NH2 3.12Å; E344-R365 WeakPolarHBondContact OE2-CD 3.13Å; E344-R365 IonicContact OE2-CZ 3.31Å; E344-R365 IonicContact OE2-NE 2.99Å; E344-R365 PolarHBondContact OE2-NE 3.17Å; C358-R365 PolarHBondContact O-NH2 3.44Å; R361-R365 WeakPolarHBondContact O-CB 3.44Å; R361-R365 PolarHBondContact O-N 3.3Å; E362-R365 PolarHBondContact O-N 3.44Å; R365-I367 PolarHBondContact O-N 3.37Å; R365-L368 PolarHBondContact O-N 2.84Å; R365-Q369 HydrophobicContact CG-CG 4.34Å; R365-Q369 WeakPolarHBondContact O-CB 3.35Å; R365-Q369 VanDerWaalsContact O-CG 3.32Å; R365-Q369 WeakPolarHBondContact O-CG 3.5Å; R365-Q369 PolarHBondContact O-N 3.42Å |
| 366 | R | 77.4 | Confident | 78.1 | Confident | 16 Ų | 16 | 79 Ų | 79 | 6% | 0.06 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -57 | -50.5 | 174.9 | -174.3 | -167 | -61.7 | -127.3 | 0.1 | 111.8 | L26 R340 E362 T370 | L26-R366 PolarHBondContact O-NH2 3.45Å; R340-R366 VanDerWaalsContact NH1-CG 3.31Å; E362-R366 VanDerWaalsContact O-CB 3.26Å; E362-R366 WeakPolarHBondContact O-CB 3.39Å; E362-R366 PolarHBondContact O-N 3.26Å; E362-R366 IonicContact OE1-CZ 3.3Å; E362-R366 IonicContact OE1-NE 3.77Å; E362-R366 PolarHBondContact OE1-NE 3.04Å; E362-R366 IonicContact OE1-NH2 3.73Å; E362-R366 PolarHBondContact OE1-NH2 3.28Å; E362-R366 IonicContact OE2-CZ 3.19Å; E362-R366 IonicContact OE2-NE 2.82Å; E362-R366 IonicContact OE2-NH2 2.72Å; E362-R366 PolarHBondContact OE2-NH2 3.39Å; R366-T370 WeakPolarHBondContact O-CB 3.33Å; R366-T370 PolarHBondContact O-N 3.28Å; R366-T370 PolarHBondContact O-OG1 2.63Å; R366-T370 VanDerWaalsContact O-OG1 3.1Å |
| 367 | I | 81.9 | Confident | 80 | Confident | 77 Ų | 77 | 71 Ų | 71 | 40% | 0.395 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -63.1 | -44.6 | 179.2 | -69.2 | 167.2 | 0 | 0 | 0 | 110.3 | R363 R364 R365 T370 L371 | R363-I367 HydrophobicContact CG-CD1 4.04Å; R363-I367 WeakPolarHBondContact O-CD1 3.5Å; R363-I367 VanDerWaalsContact O-CG1 3.24Å; R363-I367 WeakPolarHBondContact O-CG1 3.45Å; R363-I367 PolarHBondContact O-N 2.96Å; R364-I367 PolarHBondContact O-N 2.98Å; R365-I367 PolarHBondContact O-N 3.37Å; I367-T370 PolarHBondContact O-N 3.16Å; I367-L371 HydrophobicContact CG2-CD1 3.72Å; I367-L371 HydrophobicContact CG2-CG 4.25Å; I367-L371 WeakPolarHBondContact O-CB 3.32Å; I367-L371 VanDerWaalsContact O-CG 3.29Å; I367-L371 WeakPolarHBondContact O-CG 3.19Å; I367-L371 PolarHBondContact O-N 3.47Å |
| 368 | L | 86.8 | Confident | 81.6 | Confident | 111 Ų | 111 | 69.2 Ų | 69.2 | 58% | 0.581 | 32% | 0.316 | S | S | * | . | H | α-helix | trans | -62.1 | -49 | 179.1 | -177.9 | 66.2 | 0 | 0 | 0 | 111.8 | R364 R365 T370 L371 V372 | R364-L368 VanDerWaalsContact O-CB 3.32Å; R364-L368 WeakPolarHBondContact O-CB 3.5Å; R364-L368 PolarHBondContact O-N 3.04Å; R365-L368 PolarHBondContact O-N 2.84Å; L368-T370 VanDerWaalsContact C-N 3.35Å; L368-T370 PolarHBondContact O-N 2.86Å; L368-L371 PolarHBondContact O-N 2.8Å; L368-V372 HydrophobicContact CD1-CG2 4Å; L368-V372 HydrophobicContact CG-CG2 4.3Å; L368-V372 WeakPolarHBondContact O-CB 3.41Å; L368-V372 VanDerWaalsContact O-CG2 3.26Å; L368-V372 WeakPolarHBondContact O-CG2 3.21Å; L368-V372 PolarHBondContact O-N 3.48Å |
| 369 | Q | 85.3 | Confident | 83.2 | Confident | 31 Ų | 31 | 72.2 Ų | 72.2 | 15% | 0.145 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -59.2 | -46.1 | 176.7 | -75.2 | 167.6 | -12.5 | 0 | 0 | 111.2 | R340 E344 R365 L371 W373 | R340-Q369 HydrophobicContact CG-CB 4.46Å; E344-Q369 PolarHBondContact OE2-NE2 3.43Å; E344-Q369 PolarHBondContact OE2-OE1 2.88Å; R365-Q369 HydrophobicContact CG-CG 4.34Å; R365-Q369 WeakPolarHBondContact O-CB 3.35Å; R365-Q369 VanDerWaalsContact O-CG 3.32Å; R365-Q369 WeakPolarHBondContact O-CG 3.5Å; R365-Q369 PolarHBondContact O-N 3.42Å; Q369-L371 PolarHBondContact O-N 2.89Å; Q369-W373 WeakPolarHBondContact O-CB 3.49Å; Q369-W373 PolarHBondContact O-N 3.48Å |
| 370 | T | 85.1 | Confident | 84.6 | Confident | 5 Ų | 5 | 71.4 Ų | 71.4 | 3% | 0.031 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -59.1 | -47.6 | 176.5 | -70.8 | 0 | 0 | 0 | 0 | 111.6 | H336 R340 R366 I367 L368 F374 | H336-T370 PolarHBondContact CE1-OG1 3.33Å; R340-T370 PolarHBondContact NH1-OG1 3.44Å; R366-T370 WeakPolarHBondContact O-CB 3.33Å; R366-T370 PolarHBondContact O-N 3.28Å; R366-T370 PolarHBondContact O-OG1 2.63Å; R366-T370 VanDerWaalsContact O-OG1 3.1Å; I367-T370 PolarHBondContact O-N 3.16Å; L368-T370 VanDerWaalsContact C-N 3.35Å; L368-T370 PolarHBondContact O-N 2.86Å; T370-F374 WeakPolarHBondContact O-CB 3.45Å; T370-F374 PolarHBondContact O-N 2.99Å |
| 371 | L | 88.8 | Confident | 86 | Confident | 76 Ų | 76 | 61.7 Ų | 61.7 | 40% | 0.398 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -67.9 | -44.9 | -178.4 | -72.2 | 174 | 0 | 0 | 0 | 112.1 | L185 I367 L368 Q369 F374 V375 | L185-L371 HydrophobicContact CD1-CD2 4.09Å; L185-L371 HydrophobicContact CD2-CD2 4.43Å; I367-L371 HydrophobicContact CG2-CD1 3.72Å; I367-L371 HydrophobicContact CG2-CG 4.25Å; I367-L371 WeakPolarHBondContact O-CB 3.32Å; I367-L371 VanDerWaalsContact O-CG 3.29Å; I367-L371 WeakPolarHBondContact O-CG 3.19Å; I367-L371 PolarHBondContact O-N 3.47Å; L368-L371 PolarHBondContact O-N 2.8Å; Q369-L371 PolarHBondContact O-N 2.89Å; L371-F374 PolarHBondContact O-N 3.49Å; L371-V375 WeakPolarHBondContact O-CB 3.34Å; L371-V375 VanDerWaalsContact O-CG2 3.23Å; L371-V375 WeakPolarHBondContact O-CG2 3.48Å; L371-V375 PolarHBondContact O-N 3.06Å |
| 372 | V | 91.8 | Very high | 87 | Confident | 80 Ų | 80 | 57.1 Ų | 57.1 | 49% | 0.485 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -62.8 | -48.8 | 178.5 | 171.3 | 0 | 0 | 0 | 0 | 110.1 | L368 F374 V375 V376 | L368-V372 HydrophobicContact CD1-CG2 4Å; L368-V372 HydrophobicContact CG-CG2 4.3Å; L368-V372 WeakPolarHBondContact O-CB 3.41Å; L368-V372 VanDerWaalsContact O-CG2 3.26Å; L368-V372 WeakPolarHBondContact O-CG2 3.21Å; L368-V372 PolarHBondContact O-N 3.48Å; V372-F374 PolarHBondContact O-N 3.45Å; V372-V375 PolarHBondContact O-N 2.96Å; V372-V376 HydrophobicContact CG1-CG2 4.32Å; V372-V376 WeakPolarHBondContact O-CB 3.41Å; V372-V376 WeakPolarHBondContact O-CG2 3.34Å; V372-V376 PolarHBondContact O-N 3.01Å |
| 373 | W | 92 | Very high | 87.8 | Confident | 30 Ų | 30 | 63.7 Ų | 63.7 | 11% | 0.114 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -57.1 | -51.6 | 177.6 | -173 | -70.7 | 0 | 0 | 0 | 111.2 | A131 T134 F135 H336 V343 Q369 V375 V376 T377 | A131-W373 VanDerWaalsContact O-CH2 3.29Å; A131-W373 WeakPolarHBondContact O-CH2 3.44Å; T134-W373 WeakPolarHBondContact OG1-CZ2 3.29Å; F135-W373 VanDerWaalsContact CA-CZ2 3.42Å; F135-W373 HydrophobicContact CB-CH2 3.79Å; F135-W373 HydrophobicContact CB-CZ2 3.57Å; F135-W373 AromaticContact CD2-CD2 4Å; F135-W373 HydrophobicContact CD2-CD2 4Å; F135-W373 AromaticContact CD2-CE2 3.83Å; F135-W373 HydrophobicContact CD2-CE3 4.26Å; F135-W373 HydrophobicContact CD2-CH2 4.35Å; F135-W373 HydrophobicContact CD2-CZ2 4.08Å; F135-W373 HydrophobicContact CD2-CZ3 4.39Å; F135-W373 HydrophobicContact CG-CZ2 4.34Å; H336-W373 AromaticContact CD2-CD1 3.34Å; H336-W373 AromaticContact CD2-CG 3.95Å; H336-W373 AromaticContact CD2-NE1 3.8Å; H336-W373 AromaticContact NE2-CD1 3.59Å; H336-W373 AromaticContact NE2-CG 3.75Å; V343-W373 HydrophobicContact CG2-CE3 4.1Å; V343-W373 HydrophobicContact CG2-CH2 4.35Å; V343-W373 HydrophobicContact CG2-CZ3 3.46Å; V343-W373 VanDerWaalsContact CG2-CZ3 3.46Å; Q369-W373 WeakPolarHBondContact O-CB 3.49Å; Q369-W373 PolarHBondContact O-N 3.48Å; W373-V375 PolarHBondContact O-N 3.46Å; W373-V376 PolarHBondContact O-N 3.5Å; W373-T377 WeakPolarHBondContact O-CG2 3.37Å; W373-T377 PolarHBondContact O-N 2.98Å; W373-T377 PolarHBondContact O-OG1 3.38Å |
| 374 | F | 91.9 | Very high | 88.4 | Confident | 5 Ų | 5 | 57.1 Ų | 57.1 | 2% | 0.022 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -59.9 | -46.2 | -180 | 175.3 | -87.6 | 0 | 0 | 0 | 113.1 | F142 A180 V181 I184 L185 Y332 T370 L371 V372 T377 L378 | F142-F374 HydrophobicContact CE1-CE2 4.31Å; F142-F374 HydrophobicContact CZ-CD2 4Å; F142-F374 AromaticContact CZ-CE2 3.65Å; F142-F374 HydrophobicContact CZ-CE2 3.65Å; F142-F374 HydrophobicContact CZ-CZ 4.24Å; A180-F374 HydrophobicContact CB-CE2 4.16Å; A180-F374 HydrophobicContact CB-CZ 3.65Å; A180-F374 WeakPolarHBondContact O-CZ 3.44Å; V181-F374 HydrophobicContact CG2-CE1 4.45Å; I184-F374 HydrophobicContact CB-CE2 4.36Å; I184-F374 HydrophobicContact CG2-CE2 4.08Å; L185-F374 HydrophobicContact CB-CD2 4.45Å; L185-F374 HydrophobicContact CB-CE1 4.38Å; L185-F374 HydrophobicContact CB-CE2 3.91Å; L185-F374 HydrophobicContact CB-CZ 3.87Å; L185-F374 HydrophobicContact CD1-CD1 4.3Å; L185-F374 HydrophobicContact CD1-CD2 4.28Å; L185-F374 HydrophobicContact CD1-CG 4.16Å; L185-F374 HydrophobicContact CD2-CE1 4.47Å; Y332-F374 HydrophobicContact CE1-CD2 4.37Å; T370-F374 WeakPolarHBondContact O-CB 3.45Å; T370-F374 PolarHBondContact O-N 2.99Å; L371-F374 PolarHBondContact O-N 3.49Å; V372-F374 PolarHBondContact O-N 3.45Å; F374-T377 PolarHBondContact O-OG1 3.37Å; F374-T377 VanDerWaalsContact O-OG1 3.09Å; F374-L378 HydrophobicContact CE1-CD2 4.04Å; F374-L378 HydrophobicContact CZ-CD2 4.42Å; F374-L378 WeakPolarHBondContact O-CB 3.21Å; F374-L378 PolarHBondContact O-N 3.27Å |
| 375 | V | 93.7 | Very high | 88.2 | Confident | 77 Ų | 77 | 51.7 Ų | 51.7 | 47% | 0.467 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -65.8 | -43.8 | -179.1 | 169.5 | 0 | 0 | 0 | 0 | 110.4 | L371 V372 W373 L378 V379 | L371-V375 WeakPolarHBondContact O-CB 3.34Å; L371-V375 VanDerWaalsContact O-CG2 3.23Å; L371-V375 WeakPolarHBondContact O-CG2 3.48Å; L371-V375 PolarHBondContact O-N 3.06Å; V372-V375 PolarHBondContact O-N 2.96Å; W373-V375 PolarHBondContact O-N 3.46Å; V375-L378 PolarHBondContact O-N 2.9Å; V375-V379 HydrophobicContact CG1-CG2 4.35Å; V375-V379 WeakPolarHBondContact O-CB 3.39Å; V375-V379 VanDerWaalsContact O-CG2 3.25Å; V375-V379 WeakPolarHBondContact O-CG2 3.29Å; V375-V379 PolarHBondContact O-N 3.15Å |
| 376 | V | 94.7 | Very high | 88.2 | Confident | 62 Ų | 62 | 53.2 Ų | 53.2 | 38% | 0.376 | 29% | 0.285 | S | S | . | . | H | α-helix | trans | -67.2 | -44.6 | -179 | -179.9 | 0 | 0 | 0 | 0 | 110.8 | F135 V372 W373 L378 V379 L380 | F135-V376 HydrophobicContact CE2-CB 4.39Å; F135-V376 HydrophobicContact CE2-CG1 4.1Å; F135-V376 HydrophobicContact CZ-CB 4.46Å; F135-V376 HydrophobicContact CZ-CG1 3.73Å; V372-V376 HydrophobicContact CG1-CG2 4.32Å; V372-V376 WeakPolarHBondContact O-CB 3.41Å; V372-V376 WeakPolarHBondContact O-CG2 3.34Å; V372-V376 PolarHBondContact O-N 3.01Å; W373-V376 PolarHBondContact O-N 3.5Å; V376-L378 VanDerWaalsContact C-N 3.34Å; V376-L378 PolarHBondContact O-N 2.81Å; V376-V379 PolarHBondContact O-N 3.48Å; V376-L380 HydrophobicContact CG1-CD1 4.07Å; V376-L380 HydrophobicContact CG1-CG 4.48Å; V376-L380 WeakPolarHBondContact O-CG 3.36Å; V376-L380 PolarHBondContact O-N 2.92Å |
| 377 | T | 94.1 | Very high | 88.6 | Confident | 0 Ų | 0 | 52.8 Ų | 52.8 | 0% | 0 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -64.5 | -38.8 | 177.5 | 53.5 | 0 | 0 | 0 | 0 | 112.1 | F135 C138 I139 Y332 W373 F374 A381 | F135-T377 HydrophobicContact CD2-CG2 3.46Å; F135-T377 VanDerWaalsContact CD2-CG2 3.46Å; F135-T377 HydrophobicContact CE1-CG2 4.45Å; F135-T377 HydrophobicContact CE2-CG2 3.37Å; F135-T377 HydrophobicContact CG-CG2 4.07Å; F135-T377 HydrophobicContact CZ-CG2 3.91Å; C138-T377 HydrophobicContact CB-CG2 3.92Å; I139-T377 HydrophobicContact CG1-CG2 4.04Å; Y332-T377 PolarHBondContact OH-OG1 3.41Å; W373-T377 WeakPolarHBondContact O-CG2 3.37Å; W373-T377 PolarHBondContact O-N 2.98Å; W373-T377 PolarHBondContact O-OG1 3.38Å; F374-T377 PolarHBondContact O-OG1 3.37Å; F374-T377 VanDerWaalsContact O-OG1 3.09Å; T377-A381 WeakPolarHBondContact O-CB 3.36Å; T377-A381 PolarHBondContact O-N 3.25Å |
| 378 | L | 93.6 | Very high | 88.8 | Confident | 17 Ų | 17 | 49.7 Ų | 49.7 | 9% | 0.089 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -62.2 | -50.4 | 175.2 | 176.7 | 60.9 | 0 | 0 | 0 | 111.3 | F142 I176 V177 A180 F374 V375 V376 L380 A381 L382 | F142-L378 HydrophobicContact CD1-CD1 4.35Å; F142-L378 HydrophobicContact CD2-CB 4.41Å; F142-L378 HydrophobicContact CE1-CD1 4.36Å; F142-L378 HydrophobicContact CE2-CB 3.97Å; F142-L378 HydrophobicContact CG-CD1 4.45Å; F142-L378 HydrophobicContact CZ-CB 4.33Å; F142-L378 HydrophobicContact CZ-CD1 4.44Å; I176-L378 HydrophobicContact CG2-CD1 3.65Å; V177-L378 HydrophobicContact CG2-CD1 4.43Å; V177-L378 HydrophobicContact CG2-CD2 4.42Å; A180-L378 HydrophobicContact CB-CD1 4.01Å; A180-L378 HydrophobicContact CB-CD2 4.31Å; F374-L378 HydrophobicContact CE1-CD2 4.04Å; F374-L378 HydrophobicContact CZ-CD2 4.42Å; F374-L378 WeakPolarHBondContact O-CB 3.21Å; F374-L378 PolarHBondContact O-N 3.27Å; V375-L378 PolarHBondContact O-N 2.9Å; V376-L378 VanDerWaalsContact C-N 3.34Å; V376-L378 PolarHBondContact O-N 2.81Å; L378-L380 VanDerWaalsContact C-N 3.34Å; L378-L380 PolarHBondContact O-N 3.47Å; L378-A381 PolarHBondContact O-N 2.85Å; L378-L382 WeakPolarHBondContact O-CG 3.11Å; L378-L382 PolarHBondContact O-N 3Å; L378-L382 VanDerWaalsContact O-N 3.1Å |
| 379 | V | 93.9 | Very high | 88.7 | Confident | 67 Ų | 67 | 50.3 Ų | 50.3 | 41% | 0.406 | 27% | 0.265 | S | S | . | . | H | α-helix | trans | -59 | -46.6 | 179.6 | 170.1 | 0 | 0 | 0 | 0 | 110.6 | V375 V376 A381 L382 F383 | V375-V379 HydrophobicContact CG1-CG2 4.35Å; V375-V379 WeakPolarHBondContact O-CB 3.39Å; V375-V379 VanDerWaalsContact O-CG2 3.25Å; V375-V379 WeakPolarHBondContact O-CG2 3.29Å; V375-V379 PolarHBondContact O-N 3.15Å; V376-V379 PolarHBondContact O-N 3.48Å; V379-A381 VanDerWaalsContact C-N 3.35Å; V379-A381 PolarHBondContact O-N 3.18Å; V379-L382 WeakPolarHBondContact O-CB 3.31Å; V379-L382 PolarHBondContact O-N 3.06Å; V379-F383 HydrophobicContact CG1-CD2 4.11Å; V379-F383 HydrophobicContact CG1-CE2 3.84Å; V379-F383 WeakPolarHBondContact O-CD2 3.35Å |
| 380 | L | 92.6 | Very high | 88.8 | Confident | 65 Ų | 65 | 49.5 Ų | 49.5 | 34% | 0.34 | 26% | 0.262 | S | S | . | . | H | α-helix | trans | -61 | -42.5 | 177.4 | -70.3 | 173.9 | 0 | 0 | 0 | 112.1 | F135 I139 V376 L378 L382 F383 I384 | F135-L380 HydrophobicContact CE1-CD1 3.67Å; F135-L380 HydrophobicContact CZ-CD1 3.64Å; I139-L380 HydrophobicContact CD1-CB 3.95Å; I139-L380 HydrophobicContact CD1-CD1 3.72Å; I139-L380 HydrophobicContact CG1-CB 4.33Å; V376-L380 HydrophobicContact CG1-CD1 4.07Å; V376-L380 HydrophobicContact CG1-CG 4.48Å; V376-L380 WeakPolarHBondContact O-CG 3.36Å; V376-L380 PolarHBondContact O-N 2.92Å; L378-L380 VanDerWaalsContact C-N 3.34Å; L378-L380 PolarHBondContact O-N 3.47Å; L380-L382 PolarHBondContact O-N 3.38Å; L380-F383 PolarHBondContact O-N 3.36Å; L380-F383 VanDerWaalsContact O-N 3.07Å; L380-I384 HydrophobicContact CB-CD1 4.23Å; L380-I384 VanDerWaalsContact O-CG1 3.32Å; L380-I384 WeakPolarHBondContact O-CG1 3.12Å; L380-I384 PolarHBondContact O-N 3.45Å |
| 381 | A | 91.6 | Very high | 88.9 | Confident | 0 Ų | 0 | 49.3 Ų | 49.3 | 0% | 0 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -63.7 | -25.9 | 177.6 | 0 | 0 | 0 | 0 | 0 | 113.7 | I139 F142 I143 T377 L378 V379 F383 | I139-A381 HydrophobicContact CG2-CB 4.12Å; F142-A381 HydrophobicContact CB-CB 3.41Å; F142-A381 VanDerWaalsContact CB-CB 3.41Å; F142-A381 HydrophobicContact CD2-CB 4.23Å; F142-A381 HydrophobicContact CG-CB 4.23Å; I143-A381 HydrophobicContact CG1-CB 4.22Å; T377-A381 WeakPolarHBondContact O-CB 3.36Å; T377-A381 PolarHBondContact O-N 3.25Å; L378-A381 PolarHBondContact O-N 2.85Å; V379-A381 VanDerWaalsContact C-N 3.35Å; V379-A381 PolarHBondContact O-N 3.18Å; A381-F383 VanDerWaalsContact C-N 3.31Å |
| 382 | L | 89.5 | Confident | 88.7 | Confident | 37 Ų | 37 | 47 Ų | 47 | 19% | 0.194 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -73.9 | -21.6 | 174.9 | -65.6 | 175.1 | 0 | 0 | 0 | 113.3 | K173 I176 V177 L378 V379 L380 | K173-L382 HydrophobicContact CB-CD2 4.03Å; K173-L382 HydrophobicContact CG-CD2 4.14Å; I176-L382 HydrophobicContact CB-CD2 4.23Å; I176-L382 HydrophobicContact CD1-CD2 4.16Å; I176-L382 HydrophobicContact CG2-CD2 4.2Å; V177-L382 HydrophobicContact CG2-CD1 4.02Å; V177-L382 HydrophobicContact CG2-CD2 4.35Å; L378-L382 WeakPolarHBondContact O-CG 3.11Å; L378-L382 PolarHBondContact O-N 3Å; L378-L382 VanDerWaalsContact O-N 3.1Å; V379-L382 WeakPolarHBondContact O-CB 3.31Å; V379-L382 PolarHBondContact O-N 3.06Å; L380-L382 PolarHBondContact O-N 3.38Å |
| 383 | F | 88.6 | Confident | 88.4 | Confident | 158 Ų | 158 | 47.2 Ų | 47.2 | 69% | 0.693 | 25% | 0.25 | S | C | * | . | H | α-helix | trans | -102.8 | -21.3 | -179.8 | -69.8 | -70 | 0 | 0 | 0 | 113.7 | V379 L380 A381 P385 | V379-F383 HydrophobicContact CG1-CD2 4.11Å; V379-F383 HydrophobicContact CG1-CE2 3.84Å; V379-F383 WeakPolarHBondContact O-CD2 3.35Å; L380-F383 PolarHBondContact O-N 3.36Å; L380-F383 VanDerWaalsContact O-N 3.07Å; A381-F383 VanDerWaalsContact C-N 3.31Å; F383-P385 VanDerWaalsContact O-CD 3.28Å; F383-P385 WeakPolarHBondContact O-CD 3.2Å |
| 384 | I | 86 | Confident | 88.4 | Confident | 47 Ų | 47 | 46 Ų | 46 | 24% | 0.241 | 25% | 0.245 | C | C | . | . | trans | -89.6 | 111.9 | 178.3 | -63 | 165.1 | 0 | 0 | 0 | 108.8 | I139 I143 L380 V390 | I139-I384 HydrophobicContact CG2-CD1 3.91Å; I143-I384 HydrophobicContact CD1-CB 4.1Å; I143-I384 HydrophobicContact CD1-CG2 3.75Å; L380-I384 HydrophobicContact CB-CD1 4.23Å; L380-I384 VanDerWaalsContact O-CG1 3.32Å; L380-I384 WeakPolarHBondContact O-CG1 3.12Å; L380-I384 PolarHBondContact O-N 3.45Å; I384-V390 HydrophobicContact CG2-CG2 3.9Å | ||
| 385 | P | 73.8 | Confident | 88.3 | Confident | 97 Ų | 97 | 45.7 Ų | 45.7 | 63% | 0.63 | 24% | 0.244 | S | C | * | . | trans | -84.9 | -16.9 | -177.2 | 33.7 | -35.3 | 0 | 0 | 0 | 113.3 | F383 | F383-P385 VanDerWaalsContact O-CD 3.28Å; F383-P385 WeakPolarHBondContact O-CD 3.2Å | ||
| 386 | D | 80.3 | Confident | 88.2 | Confident | 59 Ų | 59 | 42 Ų | 42 | 32% | 0.316 | 22% | 0.222 | S | C | . | . | trans | -123 | 117.6 | -169.4 | -169.9 | -16.6 | 0 | 0 | 0 | 111.5 | G388 R389 | D386-G388 VanDerWaalsContact C-N 3.28Å; D386-G388 PolarHBondContact O-N 3.36Å; D386-G388 WeakPolarHBondContact OD1-CA 3.28Å; D386-G388 PolarHBondContact OD1-N 3.48Å; D386-R389 IonicContact OD2-NH1 2.72Å | ||
| 387 | I | 85.5 | Confident | 88.1 | Confident | 7 Ų | 7 | 40 Ų | 40 | 4% | 0.036 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -66.6 | -29.3 | 175.6 | -161.9 | -176.8 | 0 | 0 | 0 | 112.5 | A140 I143 V144 Q304 R389 V390 I391 | A140-I387 HydrophobicContact CB-CG1 4.22Å; I143-I387 HydrophobicContact CG2-CB 3.92Å; I143-I387 HydrophobicContact CG2-CG1 4.41Å; V144-I387 HydrophobicContact CG2-CD1 3.26Å; Q304-I387 HydrophobicContact CB-CG2 3.95Å; I387-R389 PolarHBondContact O-N 3.22Å; I387-V390 WeakPolarHBondContact O-CB 3.33Å; I387-V390 PolarHBondContact O-N 3.24Å; I387-V390 VanDerWaalsContact O-N 3.13Å; I387-I391 HydrophobicContact CD1-CD1 3.83Å; I387-I391 HydrophobicContact CG1-CD1 3.71Å; I387-I391 HydrophobicContact CG1-CG1 4.15Å; I387-I391 HydrophobicContact CG2-CD1 4.41Å; I387-I391 WeakPolarHBondContact O-CG1 3.35Å; I387-I391 PolarHBondContact O-N 2.79Å |
| 388 | G | 85 | Confident | 88.1 | Confident | 12 Ų | 12 | 40 Ų | 40 | 12% | 0.124 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -60.5 | -42 | -177.3 | 0 | 0 | 0 | 0 | 0 | 112.8 | D386 V390 I391 S392 | D386-G388 VanDerWaalsContact C-N 3.28Å; D386-G388 PolarHBondContact O-N 3.36Å; D386-G388 WeakPolarHBondContact OD1-CA 3.28Å; D386-G388 PolarHBondContact OD1-N 3.48Å; G388-V390 VanDerWaalsContact C-N 3.31Å; G388-V390 PolarHBondContact O-N 3.29Å; G388-I391 PolarHBondContact O-N 2.94Å; G388-S392 PolarHBondContact O-N 3.46Å |
| 389 | R | 84.4 | Confident | 88.1 | Confident | 124 Ų | 124 | 39.1 Ų | 39.1 | 47% | 0.468 | 20% | 0.204 | S | C | . | . | H | α-helix | trans | -61.5 | -39.7 | 175 | -67.8 | -169.4 | -179.5 | 90.1 | -3.7 | 112.4 | D386 I387 S392 D454 | D386-R389 IonicContact OD2-NH1 2.72Å; I387-R389 PolarHBondContact O-N 3.22Å; R389-S392 PolarHBondContact O-OG 3.3Å; R389-D454 IonicContact NE-OD1 2.81Å |
| 390 | V | 87.9 | Confident | 88.1 | Confident | 14 Ų | 14 | 36.6 Ų | 36.6 | 9% | 0.085 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -67.5 | -44.4 | 177.5 | -175.5 | 0 | 0 | 0 | 0 | 109.6 | G136 I139 A140 I143 I384 I387 G388 L393 I394 | G136-V390 WeakPolarHBondContact O-CG1 3.38Å; I139-V390 HydrophobicContact CG2-CG2 4.31Å; A140-V390 HydrophobicContact CB-CG1 4.07Å; I143-V390 HydrophobicContact CD1-CG2 4.06Å; I384-V390 HydrophobicContact CG2-CG2 3.9Å; I387-V390 WeakPolarHBondContact O-CB 3.33Å; I387-V390 PolarHBondContact O-N 3.24Å; I387-V390 VanDerWaalsContact O-N 3.13Å; G388-V390 VanDerWaalsContact C-N 3.31Å; G388-V390 PolarHBondContact O-N 3.29Å; V390-L393 PolarHBondContact O-N 3.43Å; V390-I394 HydrophobicContact CG1-CD1 4.16Å; V390-I394 HydrophobicContact CG1-CG2 4.48Å; V390-I394 VanDerWaalsContact O-CG1 3.3Å; V390-I394 WeakPolarHBondContact O-CG1 3.48Å; V390-I394 PolarHBondContact O-N 2.88Å |
| 391 | I | 87.1 | Confident | 88.3 | Confident | 1 Ų | 1 | 33.5 Ų | 33.5 | 1% | 0.005 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -65.4 | -38.9 | -179 | -71.1 | 172.3 | 0 | 0 | 0 | 112.4 | N66 T246 F249 I387 G388 L393 G395 | N66-I391 WeakPolarHBondContact ND2-CD1 3.23Å; T246-I391 HydrophobicContact CG2-CG2 4.28Å; F249-I391 HydrophobicContact CB-CG2 4.3Å; F249-I391 HydrophobicContact CD1-CD1 4.13Å; F249-I391 HydrophobicContact CD1-CG1 3.96Å; F249-I391 HydrophobicContact CD1-CG2 4.06Å; F249-I391 HydrophobicContact CE1-CD1 3.94Å; F249-I391 HydrophobicContact CE1-CG1 3.89Å; F249-I391 HydrophobicContact CG-CG2 4.31Å; F249-I391 HydrophobicContact CZ-CG1 4.44Å; I387-I391 HydrophobicContact CD1-CD1 3.83Å; I387-I391 HydrophobicContact CG1-CD1 3.71Å; I387-I391 HydrophobicContact CG1-CG1 4.15Å; I387-I391 HydrophobicContact CG2-CD1 4.41Å; I387-I391 WeakPolarHBondContact O-CG1 3.35Å; I387-I391 PolarHBondContact O-N 2.79Å; G388-I391 PolarHBondContact O-N 2.94Å; I391-L393 VanDerWaalsContact C-N 3.31Å; I391-L393 PolarHBondContact O-N 2.95Å; I391-G395 VanDerWaalsContact O-CA 3.29Å; I391-G395 WeakPolarHBondContact O-CA 3.5Å; I391-G395 PolarHBondContact O-N 3.44Å |
| 392 | S | 84.6 | Confident | 88.4 | Confident | 28 Ų | 28 | 33.5 Ų | 33.5 | 20% | 0.196 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -62.4 | -41.2 | 178.4 | 69.6 | 0 | 0 | 0 | 0 | 111.4 | G388 R389 G396 S450 | G388-S392 PolarHBondContact O-N 3.46Å; R389-S392 PolarHBondContact O-OG 3.3Å; S392-G396 PolarHBondContact O-N 3.24Å; S392-S450 WeakPolarHBondContact CB-OG 2.81Å; S392-S450 PolarHBondContact OG-OG 3.23Å |
| 393 | L | 86.2 | Confident | 88.7 | Confident | 85 Ų | 85 | 31.8 Ų | 31.8 | 45% | 0.445 | 16% | 0.164 | S | C | . | . | H | α-helix | trans | -69.2 | -54.7 | 177.2 | -178.1 | 66.6 | 0 | 0 | 0 | 112.3 | V390 I391 G395 G396 L397 | V390-L393 PolarHBondContact O-N 3.43Å; I391-L393 VanDerWaalsContact C-N 3.31Å; I391-L393 PolarHBondContact O-N 2.95Å; L393-G395 VanDerWaalsContact C-N 3.32Å; L393-G395 PolarHBondContact O-N 3.21Å; L393-G396 PolarHBondContact O-N 3.18Å; L393-L397 PolarHBondContact O-N 3.01Å |
| 394 | I | 91.5 | Very high | 89.1 | Confident | 3 Ų | 3 | 25.3 Ų | 25.3 | 2% | 0.015 | 14% | 0.138 | C | C | . | . | H | α-helix | trans | -72.9 | -25.4 | -177.2 | 69 | -172.9 | 0 | 0 | 0 | 112.5 | Y133 F249 V390 G396 L397 A398 | Y133-I394 HydrophobicContact CD2-CB 3.93Å; Y133-I394 WeakPolarHBondContact CD2-O 3.3Å; Y133-I394 HydrophobicContact CE2-CB 4.13Å; Y133-I394 HydrophobicContact CE2-CG1 4.47Å; F249-I394 HydrophobicContact CD2-CD1 3.57Å; F249-I394 HydrophobicContact CD2-CG1 3.74Å; F249-I394 HydrophobicContact CE2-CD1 3.28Å; F249-I394 HydrophobicContact CE2-CG1 4.01Å; F249-I394 HydrophobicContact CG-CD1 4.48Å; F249-I394 HydrophobicContact CG-CG1 4.47Å; F249-I394 HydrophobicContact CZ-CD1 4Å; V390-I394 HydrophobicContact CG1-CD1 4.16Å; V390-I394 HydrophobicContact CG1-CG2 4.48Å; V390-I394 VanDerWaalsContact O-CG1 3.3Å; V390-I394 WeakPolarHBondContact O-CG1 3.48Å; V390-I394 PolarHBondContact O-N 2.88Å; I394-G396 VanDerWaalsContact C-N 3.35Å; I394-L397 CarbonylContact O-C 3.42Å; I394-L397 WeakPolarHBondContact O-CB 3.38Å; I394-L397 PolarHBondContact O-N 3.28Å; I394-A398 WeakPolarHBondContact O-CB 3.21Å; I394-A398 PolarHBondContact O-N 3.35Å |
| 395 | G | 89.8 | Confident | 89.7 | Confident | 0 Ų | 0 | 23.9 Ų | 23.9 | 0% | 0 | 13% | 0.129 | C | C | . | . | H | α-helix | trans | -67.6 | -34.6 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | P245 I391 L393 A398 A399 | P245-G395 WeakPolarHBondContact O-CA 3.48Å; I391-G395 VanDerWaalsContact O-CA 3.29Å; I391-G395 WeakPolarHBondContact O-CA 3.5Å; I391-G395 PolarHBondContact O-N 3.44Å; L393-G395 VanDerWaalsContact C-N 3.32Å; L393-G395 PolarHBondContact O-N 3.21Å; G395-A398 WeakPolarHBondContact O-CB 3.24Å; G395-A398 PolarHBondContact O-N 3.22Å; G395-A399 PolarHBondContact O-N 3.44Å; G395-A399 VanDerWaalsContact O-N 3.08Å |
| 396 | G | 90.7 | Very high | 90.7 | Very high | 0 Ų | 0 | 19.2 Ų | 19.2 | 0% | 0 | 10% | 0.099 | C | C | . | . | H | α-helix | trans | -60.4 | -48 | 167.7 | 0 | 0 | 0 | 0 | 0 | 111.6 | S392 L393 I394 A398 A399 C400 F443 T446 | S392-G396 PolarHBondContact O-N 3.24Å; L393-G396 PolarHBondContact O-N 3.18Å; I394-G396 VanDerWaalsContact C-N 3.35Å; G396-A398 VanDerWaalsContact C-N 3.28Å; G396-A398 PolarHBondContact O-N 2.96Å; G396-A399 WeakPolarHBondContact O-CB 3.3Å; G396-A399 PolarHBondContact O-N 2.93Å; G396-A399 VanDerWaalsContact O-N 3.16Å; G396-C400 PolarHBondContact O-N 3.32Å; G396-F443 WeakPolarHBondContact O-CD2 3.25Å; G396-T446 WeakPolarHBondContact CA-OG1 3.04Å |
| 397 | L | 93.3 | Very high | 91.5 | Very high | 18 Ų | 18 | 16.4 Ų | 16.4 | 9% | 0.094 | 8% | 0.084 | C | C | . | . | H | α-helix | trans | -62.8 | -34.8 | 174.4 | -69.8 | 172.6 | 0 | 0 | 0 | 112.3 | A129 I132 Y133 L393 I394 A399 C400 F401 F443 | A129-L397 HydrophobicContact CB-CD2 4.45Å; I132-L397 HydrophobicContact CB-CD1 3.99Å; I132-L397 HydrophobicContact CG2-CD1 3.53Å; Y133-L397 HydrophobicContact CD2-CB 4.26Å; L393-L397 PolarHBondContact O-N 3.01Å; I394-L397 CarbonylContact O-C 3.42Å; I394-L397 WeakPolarHBondContact O-CB 3.38Å; I394-L397 PolarHBondContact O-N 3.28Å; L397-A399 VanDerWaalsContact C-N 3.27Å; L397-A399 PolarHBondContact O-N 2.93Å; L397-C400 VanDerWaalsContact O-CB 3.29Å; L397-C400 WeakPolarHBondContact O-CB 3.42Å; L397-C400 PolarHBondContact O-N 3.49Å; L397-F401 HydrophobicContact CB-CE2 4.34Å; L397-F401 VanDerWaalsContact O-CD2 3.28Å; L397-F401 WeakPolarHBondContact O-CD2 3.49Å; L397-F401 WeakPolarHBondContact O-CE2 3.35Å; L397-F401 PolarHBondContact O-N 2.76Å; L397-F443 HydrophobicContact CD2-CE2 3.74Å; L397-F443 HydrophobicContact CD2-CZ 4.44Å; L397-F443 HydrophobicContact CG-CE2 4.35Å |
| 398 | A | 93.8 | Very high | 92.1 | Very high | 0 Ų | 0 | 18.1 Ų | 18.1 | 0% | 0 | 9% | 0.093 | C | C | . | . | H | α-helix | trans | -60.6 | -38.7 | 175.2 | 0 | 0 | 0 | 0 | 0 | 111.6 | Y133 C248 Q252 I394 G395 G396 C400 F401 I402 | Y133-A398 HydrophobicContact CE2-CB 3.98Å; C248-A398 HydrophobicContact CB-CB 3.96Å; Q252-A398 HydrophobicContact CB-CB 4.15Å; Q252-A398 HydrophobicContact CG-CB 4.22Å; Q252-A398 PolarHBondContact NE2-O 3.23Å; I394-A398 WeakPolarHBondContact O-CB 3.21Å; I394-A398 PolarHBondContact O-N 3.35Å; G395-A398 WeakPolarHBondContact O-CB 3.24Å; G395-A398 PolarHBondContact O-N 3.22Å; G396-A398 VanDerWaalsContact C-N 3.28Å; G396-A398 PolarHBondContact O-N 2.96Å; A398-C400 PolarHBondContact O-N 2.8Å; A398-F401 PolarHBondContact O-N 3.39Å; A398-F401 VanDerWaalsContact O-N 3.1Å; A398-I402 VanDerWaalsContact O-CG1 3.31Å; A398-I402 WeakPolarHBondContact O-CG1 3.45Å; A398-I402 PolarHBondContact O-N 3.18Å |
| 399 | A | 93.6 | Very high | 92.6 | Very high | 0 Ų | 0 | 17.6 Ų | 17.6 | 0% | 0 | 9% | 0.088 | C | C | . | . | H | α-helix | trans | -59.8 | -35.8 | 173.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | G395 G396 L397 F401 I402 F403 I442 | G395-A399 PolarHBondContact O-N 3.44Å; G395-A399 VanDerWaalsContact O-N 3.08Å; G396-A399 WeakPolarHBondContact O-CB 3.3Å; G396-A399 PolarHBondContact O-N 2.93Å; G396-A399 VanDerWaalsContact O-N 3.16Å; L397-A399 VanDerWaalsContact C-N 3.27Å; L397-A399 PolarHBondContact O-N 2.93Å; A399-F401 VanDerWaalsContact C-N 3.34Å; A399-F401 PolarHBondContact O-N 3.13Å; A399-I402 PolarHBondContact O-N 3.11Å; A399-F403 HydrophobicContact CB-CD2 4.1Å; A399-F403 VanDerWaalsContact O-CB 3.29Å; A399-F403 WeakPolarHBondContact O-CB 3.37Å; A399-F403 VanDerWaalsContact O-CD2 3.27Å; A399-F403 WeakPolarHBondContact O-CD2 3.32Å; A399-F403 PolarHBondContact O-N 3.34Å; A399-I442 HydrophobicContact CB-CB 4.06Å; A399-I442 HydrophobicContact CB-CG2 3.57Å |
| 400 | C | 95.1 | Very high | 93.1 | Very high | 14 Ų | 14 | 12.2 Ų | 12.2 | 10% | 0.095 | 7% | 0.068 | C | C | . | . | I | π-helix | trans | -61.1 | -41 | 174 | -65.7 | 0 | 0 | 0 | 0 | 112.6 | G396 L397 A398 V404 F405 F443 | G396-C400 PolarHBondContact O-N 3.32Å; L397-C400 VanDerWaalsContact O-CB 3.29Å; L397-C400 WeakPolarHBondContact O-CB 3.42Å; L397-C400 PolarHBondContact O-N 3.49Å; A398-C400 PolarHBondContact O-N 2.8Å; C400-V404 HydrophobicContact CB-CB 4.4Å; C400-V404 HydrophobicContact CB-CG2 4.45Å; C400-V404 WeakPolarHBondContact O-CB 3.35Å; C400-V404 PolarHBondContact O-N 2.91Å; C400-F405 HydrophobicContact CB-CD2 4.35Å; C400-F405 HydrophobicContact CB-CE2 4.01Å; C400-F405 WeakPolarHBondContact O-CD2 3.33Å; C400-F405 PolarHBondContact O-N 3.42Å; C400-F443 VanDerWaalsContact SG-CG 3.53Å |
| 401 | F | 95 | Very high | 93.4 | Very high | 0 Ų | 0 | 13.4 Ų | 13.4 | 0% | 0 | 7% | 0.073 | C | C | . | . | I | π-helix | trans | -76.6 | -27.2 | 179.9 | -47.8 | -58.9 | 0 | 0 | 0 | 114.3 | Y110 A129 I130 Y133 H254 V255 L397 A398 A399 F405 P406 | Y110-F401 HydrophobicContact CE1-CD1 4.16Å; Y110-F401 VanDerWaalsContact OH-CA 3.25Å; Y110-F401 WeakPolarHBondContact OH-CA 3.25Å; Y110-F401 PolarHBondContact OH-O 3.41Å; A129-F401 VanDerWaalsContact C-CZ 3.49Å; A129-F401 HydrophobicContact CB-CE1 3.73Å; A129-F401 HydrophobicContact CB-CZ 3.74Å; I130-F401 HydrophobicContact CG1-CD1 4.27Å; I130-F401 HydrophobicContact CG1-CE1 3.57Å; I130-F401 HydrophobicContact CG1-CZ 3.94Å; Y133-F401 HydrophobicContact CD1-CE2 4.01Å; Y133-F401 AromaticContact CD2-CE2 3.91Å; Y133-F401 HydrophobicContact CD2-CE2 3.91Å; Y133-F401 HydrophobicContact CG-CD2 4.36Å; Y133-F401 AromaticContact CG-CE2 3.53Å; Y133-F401 HydrophobicContact CG-CE2 3.53Å; Y133-F401 HydrophobicContact CG-CZ 4.35Å; H254-F401 HydrophobicContact CB-CB 4.37Å; V255-F401 HydrophobicContact CG2-CB 4.44Å; V255-F401 HydrophobicContact CG2-CD1 4.36Å; V255-F401 HydrophobicContact CG2-CD2 3.8Å; V255-F401 HydrophobicContact CG2-CE2 4.16Å; V255-F401 HydrophobicContact CG2-CG 3.95Å; L397-F401 HydrophobicContact CB-CE2 4.34Å; L397-F401 VanDerWaalsContact O-CD2 3.28Å; L397-F401 WeakPolarHBondContact O-CD2 3.49Å; L397-F401 WeakPolarHBondContact O-CE2 3.35Å; L397-F401 PolarHBondContact O-N 2.76Å; A398-F401 PolarHBondContact O-N 3.39Å; A398-F401 VanDerWaalsContact O-N 3.1Å; A399-F401 VanDerWaalsContact C-N 3.34Å; A399-F401 PolarHBondContact O-N 3.13Å; F401-F405 AromaticContact CD1-CD2 3.66Å; F401-F405 HydrophobicContact CD1-CD2 3.66Å; F401-F405 AromaticContact CD1-CE2 3.72Å; F401-F405 HydrophobicContact CD1-CE2 3.72Å; F401-F405 HydrophobicContact CE1-CD2 4.18Å; F401-F405 AromaticContact CE1-CE2 3.75Å; F401-F405 HydrophobicContact CE1-CE2 3.75Å; F401-P406 VanDerWaalsContact O-CD 3.23Å; F401-P406 WeakPolarHBondContact O-CD 3.39Å; F401-P406 WeakPolarHBondContact O-CG 3.47Å |
| 402 | I | 95.7 | Very high | 93.6 | Very high | 0 Ų | 0 | 17.6 Ų | 17.6 | 0% | 0 | 9% | 0.093 | C | C | . | . | I | π-helix | trans | -79.9 | -42.5 | 178.3 | -65.1 | 166 | 0 | 0 | 0 | 110.6 | I91 C248 A398 A399 M435 | I91-I402 HydrophobicContact CG1-CD1 4.43Å; I91-I402 HydrophobicContact CG1-CG2 3.7Å; C248-I402 HydrophobicContact CB-CD1 3.8Å; C248-I402 WeakPolarHBondContact O-CD1 3.43Å; A398-I402 VanDerWaalsContact O-CG1 3.31Å; A398-I402 WeakPolarHBondContact O-CG1 3.45Å; A398-I402 PolarHBondContact O-N 3.18Å; A399-I402 PolarHBondContact O-N 3.11Å; I402-M435 VanDerWaalsContact O-CE 3.31Å; I402-M435 WeakPolarHBondContact O-CE 3.26Å |
| 403 | F | 95.9 | Very high | 93.8 | Very high | 0 Ų | 0 | 17 Ų | 17 | 0% | 0 | 9% | 0.09 | C | C | . | . | I | π-helix | trans | -111.3 | -59.4 | -167.7 | -62.5 | -86.4 | 0 | 0 | 0 | 112.7 | M87 F90 A399 G407 M435 L438 G439 I442 | M87-F403 HydrophobicContact CE-CE1 4.47Å; M87-F403 HydrophobicContact CE-CZ 4.01Å; M87-F403 HydrophobicContact SD-CE1 4.44Å; M87-F403 HydrophobicContact SD-CE2 4.1Å; M87-F403 HydrophobicContact SD-CZ 3.48Å; M87-F403 WeakPolarHBondContact SD-CZ 3.23Å; F90-F403 HydrophobicContact CB-CD1 3.8Å; F90-F403 HydrophobicContact CB-CE1 3.24Å; F90-F403 HydrophobicContact CB-CZ 3.99Å; F90-F403 HydrophobicContact CD1-CD1 4.34Å; F90-F403 HydrophobicContact CD1-CE1 4.2Å; F90-F403 AromaticContact CD2-CE1 3.73Å; F90-F403 HydrophobicContact CD2-CE1 3.73Å; F90-F403 HydrophobicContact CG-CD1 4.02Å; F90-F403 AromaticContact CG-CE1 3.47Å; F90-F403 HydrophobicContact CG-CE1 3.47Å; F90-F403 VanDerWaalsContact CG-CE1 3.47Å; F90-F403 HydrophobicContact CG-CZ 4.48Å; A399-F403 HydrophobicContact CB-CD2 4.1Å; A399-F403 VanDerWaalsContact O-CB 3.29Å; A399-F403 WeakPolarHBondContact O-CB 3.37Å; A399-F403 VanDerWaalsContact O-CD2 3.27Å; A399-F403 WeakPolarHBondContact O-CD2 3.32Å; A399-F403 PolarHBondContact O-N 3.34Å; F403-G407 WeakPolarHBondContact O-CA 3.33Å; F403-G407 PolarHBondContact O-N 2.84Å; F403-M435 WeakPolarHBondContact CB-O 3.24Å; F403-L438 HydrophobicContact CD1-CD2 4.1Å; F403-L438 HydrophobicContact CD1-CG 4.47Å; F403-L438 HydrophobicContact CE1-CD2 3.77Å; F403-L438 HydrophobicContact CE1-CG 4.45Å; F403-G439 VanDerWaalsContact CB-CA 3.47Å; F403-I442 HydrophobicContact CE2-CD1 4.22Å; F403-I442 HydrophobicContact CZ-CD1 4.45Å |
| 404 | V | 96.9 | Very high | 93.9 | Very high | 23 Ų | 23 | 14.5 Ų | 14.5 | 14% | 0.139 | 8% | 0.075 | C | C | . | . | I | π-helix | trans | -66.9 | -58.7 | -167.6 | -179.7 | 0 | 0 | 0 | 0 | 111.8 | C400 G407 L408 | C400-V404 HydrophobicContact CB-CB 4.4Å; C400-V404 HydrophobicContact CB-CG2 4.45Å; C400-V404 WeakPolarHBondContact O-CB 3.35Å; C400-V404 PolarHBondContact O-N 2.91Å; V404-G407 PolarHBondContact O-N 3.02Å; V404-L408 HydrophobicContact CG1-CD1 4.04Å; V404-L408 HydrophobicContact CG1-CG 4.47Å; V404-L408 WeakPolarHBondContact O-CG 3.33Å; V404-L408 PolarHBondContact O-N 2.8Å |
| 405 | F | 96.7 | Very high | 93.7 | Very high | 16 Ų | 16 | 18.8 Ų | 18.8 | 7% | 0.07 | 10% | 0.098 | C | C | . | . | H | α-helix | trans | -66.2 | -44.4 | -175.4 | -64.4 | -63.2 | 0 | 0 | 0 | 112.9 | Y110 V114 T122 C126 A129 C400 F401 G407 L408 C409 | Y110-F405 HydrophobicContact CE1-CB 4.13Å; Y110-F405 HydrophobicContact CE1-CD2 4.2Å; Y110-F405 HydrophobicContact CE1-CG 4.32Å; Y110-F405 VanDerWaalsContact OH-CB 3.29Å; Y110-F405 WeakPolarHBondContact OH-CB 3.3Å; V114-F405 HydrophobicContact CG1-CD1 3.9Å; V114-F405 HydrophobicContact CG1-CE1 4.5Å; V114-F405 HydrophobicContact CG2-CB 4.05Å; V114-F405 HydrophobicContact CG2-CG 4.46Å; T122-F405 HydrophobicContact CG2-CD1 4.23Å; T122-F405 HydrophobicContact CG2-CE1 4.23Å; C126-F405 VanDerWaalsContact CA-CZ 3.49Å; C126-F405 HydrophobicContact CB-CD1 4.17Å; C126-F405 HydrophobicContact CB-CE1 3.69Å; C126-F405 HydrophobicContact CB-CE2 4.32Å; C126-F405 HydrophobicContact CB-CZ 3.78Å; A129-F405 HydrophobicContact CB-CE2 4.31Å; A129-F405 HydrophobicContact CB-CZ 4.4Å; C400-F405 HydrophobicContact CB-CD2 4.35Å; C400-F405 HydrophobicContact CB-CE2 4.01Å; C400-F405 WeakPolarHBondContact O-CD2 3.33Å; C400-F405 PolarHBondContact O-N 3.42Å; F401-F405 AromaticContact CD1-CD2 3.66Å; F401-F405 HydrophobicContact CD1-CD2 3.66Å; F401-F405 AromaticContact CD1-CE2 3.72Å; F401-F405 HydrophobicContact CD1-CE2 3.72Å; F401-F405 HydrophobicContact CE1-CD2 4.18Å; F401-F405 AromaticContact CE1-CE2 3.75Å; F401-F405 HydrophobicContact CE1-CE2 3.75Å; F405-G407 VanDerWaalsContact C-N 3.33Å; F405-G407 PolarHBondContact O-N 3.19Å; F405-L408 PolarHBondContact O-N 3.15Å; F405-C409 WeakPolarHBondContact O-CB 3.4Å; F405-C409 PolarHBondContact O-N 3.01Å; F405-C409 PolarHBondContact O-SG 3.17Å |
| 406 | P | 96.8 | Very high | 93.5 | Very high | 0 Ų | 0 | 23 Ų | 23 | 0% | 0 | 13% | 0.127 | C | C | . | . | H | α-helix | trans | -63.3 | -38.7 | 173.8 | -22.7 | 35.9 | 0 | 0 | 0 | 112.4 | I97 L98 F401 C409 L410 M435 | I97-P406 HydrophobicContact CB-CB 4.47Å; I97-P406 HydrophobicContact CG2-CB 4.35Å; I97-P406 WeakPolarHBondContact CG2-O 3.25Å; L98-P406 HydrophobicContact CD1-CG 3.94Å; L98-P406 HydrophobicContact CD2-CG 4.36Å; L98-P406 HydrophobicContact CG-CB 4.3Å; L98-P406 HydrophobicContact CG-CG 4.04Å; F401-P406 VanDerWaalsContact O-CD 3.23Å; F401-P406 WeakPolarHBondContact O-CD 3.39Å; F401-P406 WeakPolarHBondContact O-CG 3.47Å; P406-C409 PolarHBondContact O-N 3.47Å; P406-L410 WeakPolarHBondContact O-CB 3.5Å; P406-L410 PolarHBondContact O-N 3.31Å; P406-M435 HydrophobicContact CB-CE 4.35Å |
| 407 | G | 96.8 | Very high | 93.1 | Very high | 0 Ų | 0 | 26.6 Ų | 26.6 | 0% | 0 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -60.6 | -45 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | F403 V404 F405 L410 M411 | F403-G407 WeakPolarHBondContact O-CA 3.33Å; F403-G407 PolarHBondContact O-N 2.84Å; V404-G407 PolarHBondContact O-N 3.02Å; F405-G407 VanDerWaalsContact C-N 3.33Å; F405-G407 PolarHBondContact O-N 3.19Å; G407-L410 PolarHBondContact O-N 3.32Å; G407-M411 VanDerWaalsContact O-CG 3.3Å; G407-M411 WeakPolarHBondContact O-CG 3.2Å; G407-M411 PolarHBondContact O-N 3.02Å |
| 408 | L | 96.6 | Very high | 91.8 | Very high | 43 Ų | 43 | 33 Ų | 33 | 23% | 0.225 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -61.7 | -46.1 | 173.9 | -71.3 | 174.6 | 0 | 0 | 0 | 111.6 | T122 V404 F405 L410 M411 Q412 V436 | T122-L408 HydrophobicContact CG2-CD1 4.01Å; V404-L408 HydrophobicContact CG1-CD1 4.04Å; V404-L408 HydrophobicContact CG1-CG 4.47Å; V404-L408 WeakPolarHBondContact O-CG 3.33Å; V404-L408 PolarHBondContact O-N 2.8Å; F405-L408 PolarHBondContact O-N 3.15Å; L408-L410 VanDerWaalsContact C-N 3.32Å; L408-L410 PolarHBondContact O-N 2.74Å; L408-M411 PolarHBondContact O-N 3.39Å; L408-Q412 WeakPolarHBondContact O-CB 3.41Å; L408-Q412 WeakPolarHBondContact O-CG 3.4Å; L408-Q412 PolarHBondContact O-N 2.85Å; L408-V436 HydrophobicContact CD2-CG1 4.36Å; L408-V436 HydrophobicContact CD2-CG2 3.92Å; L408-V436 HydrophobicContact CG-CG2 3.88Å |
| 409 | C | 95.6 | Very high | 90.6 | Very high | 0 Ų | 0 | 39.2 Ų | 39.2 | 0% | 0 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -59 | -43.2 | 176.8 | -73.3 | 0 | 0 | 0 | 0 | 111.8 | I97 T117 C118 F405 P406 A413 | I97-C409 HydrophobicContact CG2-CB 4.35Å; T117-C409 HydrophobicContact CG2-CB 4.16Å; C118-C409 VanDerWaalsContact SG-SG 3.69Å; F405-C409 WeakPolarHBondContact O-CB 3.4Å; F405-C409 PolarHBondContact O-N 3.01Å; F405-C409 PolarHBondContact O-SG 3.17Å; P406-C409 PolarHBondContact O-N 3.47Å; C409-A413 WeakPolarHBondContact O-CB 3.38Å; C409-A413 PolarHBondContact O-N 3.4Å |
| 410 | L | 95.3 | Very high | 89.3 | Confident | 11 Ų | 11 | 46.1 Ų | 46.1 | 6% | 0.058 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -64.1 | -45.3 | 177 | -179.1 | 60 | 0 | 0 | 0 | 111.8 | I97 P406 G407 L408 K414 L428 L431 | I97-L410 HydrophobicContact CD1-CB 4.1Å; I97-L410 HydrophobicContact CD1-CD2 3.72Å; I97-L410 HydrophobicContact CD1-CG 4.38Å; I97-L410 HydrophobicContact CG1-CB 4.37Å; I97-L410 HydrophobicContact CG1-CD1 4.38Å; I97-L410 HydrophobicContact CG1-CD2 4.28Å; I97-L410 HydrophobicContact CG2-CB 3.95Å; P406-L410 WeakPolarHBondContact O-CB 3.5Å; P406-L410 PolarHBondContact O-N 3.31Å; G407-L410 PolarHBondContact O-N 3.32Å; L408-L410 VanDerWaalsContact C-N 3.32Å; L408-L410 PolarHBondContact O-N 2.74Å; L410-K414 HydrophobicContact CD1-CG 4.13Å; L410-K414 WeakPolarHBondContact O-CB 3.31Å; L410-K414 WeakPolarHBondContact O-CG 3.17Å; L410-K414 PolarHBondContact O-N 3.43Å; L410-L428 HydrophobicContact CD1-CB 4.41Å; L410-L428 VanDerWaalsContact CD2-O 3.24Å; L410-L428 WeakPolarHBondContact CD2-O 3.27Å; L410-L431 HydrophobicContact CD2-CB 4.35Å; L410-L431 HydrophobicContact CD2-CD2 4.12Å; L410-L431 HydrophobicContact CD2-CG 4.24Å |
| 411 | M | 93.7 | Very high | 88.4 | Confident | 40 Ų | 40 | 53.5 Ų | 53.5 | 20% | 0.197 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -60.5 | -49.6 | 178 | -73.4 | 175.1 | 63.4 | 0 | 0 | 111.2 | G407 L408 K414 L415 V433 V436 | G407-M411 VanDerWaalsContact O-CG 3.3Å; G407-M411 WeakPolarHBondContact O-CG 3.2Å; G407-M411 PolarHBondContact O-N 3.02Å; L408-M411 PolarHBondContact O-N 3.39Å; M411-K414 PolarHBondContact O-N 2.99Å; M411-L415 VanDerWaalsContact O-CB 3.29Å; M411-L415 WeakPolarHBondContact O-CB 3.22Å; M411-L415 WeakPolarHBondContact O-CD1 3.25Å; M411-L415 WeakPolarHBondContact O-CG 3.41Å; M411-L415 PolarHBondContact O-N 3.36Å; M411-V433 HydrophobicContact CE-CG2 3.71Å; M411-V433 HydrophobicContact CG-CG2 4.44Å; M411-V433 HydrophobicContact SD-CB 4.47Å; M411-V433 HydrophobicContact SD-CG2 3.82Å; M411-V436 HydrophobicContact SD-CG2 4Å |
| 412 | Q | 91.8 | Very high | 87.9 | Confident | 89 Ų | 89 | 57.2 Ų | 57.2 | 42% | 0.416 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -65.8 | -44.2 | -179.1 | -67.6 | -62.4 | -18.5 | 0 | 0 | 111.7 | T117 L408 K414 L415 S416 | T117-Q412 HydrophobicContact CG2-CB 4.1Å; T117-Q412 WeakPolarHBondContact O-CB 3.47Å; L408-Q412 WeakPolarHBondContact O-CB 3.41Å; L408-Q412 WeakPolarHBondContact O-CG 3.4Å; L408-Q412 PolarHBondContact O-N 2.85Å; Q412-K414 VanDerWaalsContact C-N 3.29Å; Q412-K414 PolarHBondContact O-N 2.68Å; Q412-L415 PolarHBondContact O-N 3.46Å; Q412-S416 WeakPolarHBondContact O-CB 3.42Å; Q412-S416 PolarHBondContact O-N 3.16Å; Q412-S416 PolarHBondContact O-OG 2.84Å |
| 413 | A | 89.1 | Confident | 87.3 | Confident | 16 Ų | 16 | 63.1 Ų | 63.1 | 13% | 0.132 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -56.4 | -44.9 | 175.3 | 0 | 0 | 0 | 0 | 0 | 111.2 | Y100 C409 S416 | Y100-A413 HydrophobicContact CE1-CB 4.43Å; C409-A413 WeakPolarHBondContact O-CB 3.38Å; C409-A413 PolarHBondContact O-N 3.4Å; A413-S416 PolarHBondContact O-OG 3.07Å |
| 414 | K | 89.1 | Confident | 86.8 | Confident | 32 Ų | 32 | 66.6 Ų | 66.6 | 14% | 0.139 | 36% | 0.362 | C | S | . | . | H | α-helix | trans | -77.1 | -35.1 | -179.1 | -70.3 | -65.4 | 170.7 | -162.9 | 0 | 114.6 | L410 M411 Q412 S416 E417 W425 L428 V429 | L410-K414 HydrophobicContact CD1-CG 4.13Å; L410-K414 WeakPolarHBondContact O-CB 3.31Å; L410-K414 WeakPolarHBondContact O-CG 3.17Å; L410-K414 PolarHBondContact O-N 3.43Å; M411-K414 PolarHBondContact O-N 2.99Å; Q412-K414 VanDerWaalsContact C-N 3.29Å; Q412-K414 PolarHBondContact O-N 2.68Å; K414-S416 PolarHBondContact O-N 3.17Å; K414-E417 WeakPolarHBondContact CD-OE2 3.24Å; K414-E417 IonicContact NZ-OE1 3.9Å; K414-E417 PolarHBondContact NZ-OE1 2.9Å; K414-E417 IonicContact NZ-OE2 2.84Å; K414-E417 PolarHBondContact NZ-OE2 3.49Å; K414-E417 PolarHBondContact O-N 2.89Å; K414-W425 PolarHBondContact O-NE1 3.24Å; K414-L428 HydrophobicContact CD-CD1 4.34Å; K414-L428 VanDerWaalsContact CE-CD1 3.47Å; K414-L428 HydrophobicContact CG-CB 4.23Å; K414-V429 HydrophobicContact CB-CG2 3.84Å |
| 415 | L | 87.4 | Confident | 86.5 | Confident | 93 Ų | 93 | 66.5 Ų | 66.5 | 49% | 0.487 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -69.8 | -23.4 | 175.7 | -71.3 | 167.5 | 0 | 0 | 0 | 112.3 | M411 Q412 E417 W425 | M411-L415 VanDerWaalsContact O-CB 3.29Å; M411-L415 WeakPolarHBondContact O-CB 3.22Å; M411-L415 WeakPolarHBondContact O-CD1 3.25Å; M411-L415 WeakPolarHBondContact O-CG 3.41Å; M411-L415 PolarHBondContact O-N 3.36Å; Q412-L415 PolarHBondContact O-N 3.46Å; L415-E417 VanDerWaalsContact C-N 3.33Å; L415-W425 HydrophobicContact CD2-CH2 4.22Å; L415-W425 HydrophobicContact CD2-CZ2 3.99Å |
| 416 | S | 84.4 | Confident | 86.2 | Confident | 88 Ų | 88 | 70.2 Ų | 70.2 | 62% | 0.615 | 38% | 0.376 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -76.7 | -15.4 | 173.9 | 77.3 | 0 | 0 | 0 | 0 | 114.3 | Q412 A413 K414 T418 | Q412-S416 WeakPolarHBondContact O-CB 3.42Å; Q412-S416 PolarHBondContact O-N 3.16Å; Q412-S416 PolarHBondContact O-OG 2.84Å; A413-S416 PolarHBondContact O-OG 3.07Å; K414-S416 PolarHBondContact O-N 3.17Å; S416-T418 PolarHBondContact O-N 2.76Å |
| 417 | E | 82.3 | Confident | 85.9 | Confident | 75 Ų | 75 | 76.1 Ų | 76.1 | 35% | 0.35 | 41% | 0.407 | S | S | . | . | trans | -71.3 | 117.4 | 176.4 | -70.5 | 176.5 | 177.6 | 0 | 0 | 109.8 | K414 L415 D419 | K414-E417 WeakPolarHBondContact CD-OE2 3.24Å; K414-E417 IonicContact NZ-OE1 3.9Å; K414-E417 PolarHBondContact NZ-OE1 2.9Å; K414-E417 IonicContact NZ-OE2 2.84Å; K414-E417 PolarHBondContact NZ-OE2 3.49Å; K414-E417 PolarHBondContact O-N 2.89Å; L415-E417 VanDerWaalsContact C-N 3.33Å; E417-D419 VanDerWaalsContact C-N 3.3Å | ||
| 418 | T | 67.4 | Low | 85.7 | Confident | 153 Ų | 153 | 78.4 Ų | 78.4 | 94% | 0.939 | 42% | 0.419 | S | S | * | . | trans | -81.4 | -5.2 | 179.7 | 14.4 | 0 | 0 | 0 | 0 | 114.2 | S416 | S416-T418 PolarHBondContact O-N 2.76Š| ||
| 419 | D | 68.1 | Low | 85.5 | Confident | 130 Ų | 130 | 77.5 Ų | 77.5 | 70% | 0.695 | 42% | 0.415 | S | S | * | . | S | Bend | trans | -89.8 | 170 | -170.7 | -144.3 | -11.9 | 0 | 0 | 0 | 113.3 | E417 R421 | E417-D419 VanDerWaalsContact C-N 3.3Å; D419-R421 PolarHBondContact O-N 3.17Å |
| 420 | I | 64.8 | Low | 85.4 | Confident | 145 Ų | 145 | 81.6 Ų | 81.6 | 74% | 0.744 | 44% | 0.44 | S | S | * | . | trans | -50.3 | 120.6 | -173.9 | -61.2 | 165.9 | 0 | 0 | 0 | 111.4 | T422 | I420-T422 PolarHBondContact O-N 3.24Š| ||
| 421 | R | 77.9 | Confident | 85.4 | Confident | 169 Ų | 169 | 83.3 Ų | 83.3 | 64% | 0.638 | 45% | 0.449 | S | S | * | . | trans | -67.6 | 92.6 | 179.9 | -65.2 | 179.1 | -177.9 | 169 | 0.1 | 111 | D419 W425 | D419-R421 PolarHBondContact O-N 3.17Å; R421-W425 HydrophobicContact CB-CD2 4.35Å; R421-W425 HydrophobicContact CB-CE3 4.13Å; R421-W425 HydrophobicContact CG-CD2 4.1Å; R421-W425 HydrophobicContact CG-CE3 4.05Å; R421-W425 HydrophobicContact CG-CZ3 4.3Å | ||
| 422 | T | 82.9 | Confident | 85.5 | Confident | 79 Ų | 79 | 81.4 Ų | 81.4 | 49% | 0.485 | 44% | 0.44 | S | S | . | . | trans | -74.3 | 164.2 | 174.2 | 60 | 0 | 0 | 0 | 0 | 111.7 | I420 S424 W425 H426 | I420-T422 PolarHBondContact O-N 3.24Å; T422-S424 PolarHBondContact O-N 2.85Å; T422-W425 VanDerWaalsContact O-CB 3.27Å; T422-W425 WeakPolarHBondContact O-CB 3.41Å; T422-W425 PolarHBondContact O-N 3.25Å; T422-W425 PolarHBondContact OG1-N 3.35Å; T422-H426 PolarHBondContact O-N 3.32Å | ||
| 423 | T | 84.5 | Confident | 85.7 | Confident | 124 Ų | 124 | 80.2 Ų | 80.2 | 76% | 0.761 | 44% | 0.438 | S | S | * | . | H | α-helix | trans | -56.3 | -33.6 | 173.5 | -46.5 | 0 | 0 | 0 | 0 | 112.6 | W425 H426 L427 | T423-W425 VanDerWaalsContact C-N 3.34Å; T423-H426 PolarHBondContact O-N 3.49Å; T423-L427 PolarHBondContact O-N 3.46Å; T423-L427 VanDerWaalsContact O-N 3.09Å |
| 424 | S | 85.8 | Confident | 86.1 | Confident | 72 Ų | 72 | 82.1 Ų | 82.1 | 50% | 0.503 | 45% | 0.449 | S | S | . | . | H | α-helix | trans | -64.5 | -37.7 | 175.3 | -175.7 | 0 | 0 | 0 | 0 | 112.2 | T422 L427 L428 | T422-S424 PolarHBondContact O-N 2.85Å; S424-L427 PolarHBondContact O-N 3.39Å; S424-L428 WeakPolarHBondContact O-CG 3.27Å; S424-L428 PolarHBondContact O-N 3.22Å |
| 425 | W | 90.4 | Very high | 86.4 | Confident | 22 Ų | 22 | 80.6 Ų | 80.6 | 8% | 0.083 | 44% | 0.442 | C | S | . | . | H | α-helix | trans | -60.7 | -48.6 | 174.9 | -178.4 | 96.4 | 0 | 0 | 0 | 111.2 | K414 L415 R421 T422 T423 L427 L428 V429 | K414-W425 PolarHBondContact O-NE1 3.24Å; L415-W425 HydrophobicContact CD2-CH2 4.22Å; L415-W425 HydrophobicContact CD2-CZ2 3.99Å; R421-W425 HydrophobicContact CB-CD2 4.35Å; R421-W425 HydrophobicContact CB-CE3 4.13Å; R421-W425 HydrophobicContact CG-CD2 4.1Å; R421-W425 HydrophobicContact CG-CE3 4.05Å; R421-W425 HydrophobicContact CG-CZ3 4.3Å; T422-W425 VanDerWaalsContact O-CB 3.27Å; T422-W425 WeakPolarHBondContact O-CB 3.41Å; T422-W425 PolarHBondContact O-N 3.25Å; T422-W425 PolarHBondContact OG1-N 3.35Å; T423-W425 VanDerWaalsContact C-N 3.34Å; W425-L427 VanDerWaalsContact C-N 3.32Å; W425-L427 PolarHBondContact O-N 3.02Å; W425-L428 PolarHBondContact O-N 3.3Å; W425-V429 HydrophobicContact CD2-CG2 4.01Å; W425-V429 HydrophobicContact CE3-CG2 4.16Å; W425-V429 HydrophobicContact CH2-CG2 3.91Å; W425-V429 HydrophobicContact CZ2-CG2 3.78Å; W425-V429 HydrophobicContact CZ3-CG2 4.1Å; W425-V429 WeakPolarHBondContact O-CG2 3.47Å; W425-V429 PolarHBondContact O-N 3.49Å |
| 426 | H | 88.8 | Confident | 86.9 | Confident | 94 Ų | 94 | 77.7 Ų | 77.7 | 44% | 0.435 | 43% | 0.428 | S | S | . | . | H | α-helix | trans | -60 | -42.2 | 177.9 | -74.9 | -72.6 | 0 | 0 | 0 | 112 | T422 T423 L428 V429 V430 | T422-H426 PolarHBondContact O-N 3.32Å; T423-H426 PolarHBondContact O-N 3.49Å; H426-L428 PolarHBondContact O-N 3.5Å; H426-V429 PolarHBondContact O-N 3.03Å; H426-V430 WeakPolarHBondContact O-CB 3.5Å; H426-V430 VanDerWaalsContact O-CG2 3.26Å; H426-V430 WeakPolarHBondContact O-CG2 3.42Å; H426-V430 PolarHBondContact O-N 3.05Å |
| 427 | L | 91.1 | Very high | 87.4 | Confident | 123 Ų | 123 | 77.4 Ų | 77.4 | 64% | 0.644 | 42% | 0.423 | S | S | * | . | H | α-helix | trans | -61 | -43.9 | 177.7 | -175.9 | 67.7 | 0 | 0 | 0 | 112.2 | T423 S424 W425 V430 L431 | T423-L427 PolarHBondContact O-N 3.46Å; T423-L427 VanDerWaalsContact O-N 3.09Å; S424-L427 PolarHBondContact O-N 3.39Å; W425-L427 VanDerWaalsContact C-N 3.32Å; W425-L427 PolarHBondContact O-N 3.02Å; L427-V430 PolarHBondContact O-N 2.81Å; L427-L431 WeakPolarHBondContact O-CB 3.36Å; L427-L431 PolarHBondContact O-N 3.35Å |
| 428 | L | 92.1 | Very high | 87.9 | Confident | 49 Ų | 49 | 75.1 Ų | 75.1 | 26% | 0.257 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -70.1 | -36.6 | -179.8 | -69.8 | 172.4 | 0 | 0 | 0 | 112.5 | L410 K414 S424 W425 H426 L431 G432 | L410-L428 HydrophobicContact CD1-CB 4.41Å; L410-L428 VanDerWaalsContact CD2-O 3.24Å; L410-L428 WeakPolarHBondContact CD2-O 3.27Å; K414-L428 HydrophobicContact CD-CD1 4.34Å; K414-L428 VanDerWaalsContact CE-CD1 3.47Å; K414-L428 HydrophobicContact CG-CB 4.23Å; S424-L428 WeakPolarHBondContact O-CG 3.27Å; S424-L428 PolarHBondContact O-N 3.22Å; W425-L428 PolarHBondContact O-N 3.3Å; H426-L428 PolarHBondContact O-N 3.5Å; L428-L431 HydrophobicContact CD2-CD2 4.5Å; L428-L431 PolarHBondContact O-N 3.39Å; L428-G432 PolarHBondContact O-N 3.48Å |
| 429 | V | 92.7 | Very high | 89.2 | Confident | 23 Ų | 23 | 67.9 Ų | 67.9 | 14% | 0.139 | 37% | 0.368 | C | S | . | . | H | α-helix | trans | -65.9 | -44.3 | 173.2 | 173.9 | 0 | 0 | 0 | 0 | 110.8 | K414 W425 H426 L431 G432 V433 | K414-V429 HydrophobicContact CB-CG2 3.84Å; W425-V429 HydrophobicContact CD2-CG2 4.01Å; W425-V429 HydrophobicContact CE3-CG2 4.16Å; W425-V429 HydrophobicContact CH2-CG2 3.91Å; W425-V429 HydrophobicContact CZ2-CG2 3.78Å; W425-V429 HydrophobicContact CZ3-CG2 4.1Å; W425-V429 WeakPolarHBondContact O-CG2 3.47Å; W425-V429 PolarHBondContact O-N 3.49Å; H426-V429 PolarHBondContact O-N 3.03Å; V429-L431 VanDerWaalsContact C-N 3.32Å; V429-L431 PolarHBondContact O-N 3.1Å; V429-G432 PolarHBondContact O-N 3.27Å; V429-V433 HydrophobicContact CG1-CG2 4.49Å; V429-V433 WeakPolarHBondContact O-CG2 3.45Å; V429-V433 PolarHBondContact O-N 3.03Å |
| 430 | V | 94.5 | Very high | 90.5 | Very high | 87 Ų | 87 | 64.1 Ų | 64.1 | 53% | 0.527 | 36% | 0.355 | S | S | . | . | H | α-helix | trans | -61.4 | -40.8 | 175.8 | 169.1 | 0 | 0 | 0 | 0 | 111.3 | H426 L427 V433 T434 | H426-V430 WeakPolarHBondContact O-CB 3.5Å; H426-V430 VanDerWaalsContact O-CG2 3.26Å; H426-V430 WeakPolarHBondContact O-CG2 3.42Å; H426-V430 PolarHBondContact O-N 3.05Å; L427-V430 PolarHBondContact O-N 2.81Å; V430-V433 PolarHBondContact O-N 3.27Å; V430-T434 WeakPolarHBondContact O-CB 3.37Å; V430-T434 PolarHBondContact O-N 2.95Å; V430-T434 PolarHBondContact O-OG1 3.37Å |
| 431 | L | 95.4 | Very high | 91.8 | Very high | 47 Ų | 47 | 62.1 Ų | 62.1 | 25% | 0.246 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -59.6 | -47.7 | 173.3 | 178.6 | 63.4 | 0 | 0 | 0 | 111.1 | F90 L410 L427 L428 V429 V433 T434 M435 | F90-L431 HydrophobicContact CD1-CD1 4.5Å; F90-L431 HydrophobicContact CE1-CD1 4.2Å; L410-L431 HydrophobicContact CD2-CB 4.35Å; L410-L431 HydrophobicContact CD2-CD2 4.12Å; L410-L431 HydrophobicContact CD2-CG 4.24Å; L427-L431 WeakPolarHBondContact O-CB 3.36Å; L427-L431 PolarHBondContact O-N 3.35Å; L428-L431 HydrophobicContact CD2-CD2 4.5Å; L428-L431 PolarHBondContact O-N 3.39Å; V429-L431 VanDerWaalsContact C-N 3.32Å; V429-L431 PolarHBondContact O-N 3.1Å; L431-V433 PolarHBondContact O-N 2.86Å; L431-T434 PolarHBondContact O-N 3.07Å; L431-M435 HydrophobicContact CD1-CG 4.39Å; L431-M435 HydrophobicContact CD1-SD 4.47Å; L431-M435 HydrophobicContact CG-SD 4.32Å; L431-M435 WeakPolarHBondContact O-CG 3.28Å; L431-M435 PolarHBondContact O-N 2.92Å |
| 432 | G | 95.6 | Very high | 92.4 | Very high | 0 Ų | 0 | 54.2 Ų | 54.2 | 0% | 0 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -58.9 | -47.6 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | L428 V429 T434 M435 V436 | L428-G432 PolarHBondContact O-N 3.48Å; V429-G432 PolarHBondContact O-N 3.27Å; G432-T434 VanDerWaalsContact C-N 3.34Å; G432-T434 PolarHBondContact O-N 3Å; G432-M435 PolarHBondContact O-N 3.34Å; G432-V436 WeakPolarHBondContact O-CG2 3.24Å; G432-V436 PolarHBondContact O-N 3.49Å |
| 433 | V | 96.4 | Very high | 92.9 | Very high | 63 Ų | 63 | 53.9 Ų | 53.9 | 38% | 0.382 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -60 | -44.9 | 175.9 | 172.4 | 0 | 0 | 0 | 0 | 111 | M411 V429 V430 L431 M435 V436 T437 | M411-V433 HydrophobicContact CE-CG2 3.71Å; M411-V433 HydrophobicContact CG-CG2 4.44Å; M411-V433 HydrophobicContact SD-CB 4.47Å; M411-V433 HydrophobicContact SD-CG2 3.82Å; V429-V433 HydrophobicContact CG1-CG2 4.49Å; V429-V433 WeakPolarHBondContact O-CG2 3.45Å; V429-V433 PolarHBondContact O-N 3.03Å; V430-V433 PolarHBondContact O-N 3.27Å; L431-V433 PolarHBondContact O-N 2.86Å; V433-M435 VanDerWaalsContact C-N 3.34Å; V433-M435 PolarHBondContact O-N 3.29Å; V433-V436 PolarHBondContact O-N 3.45Å; V433-T437 HydrophobicContact CG1-CG2 4.28Å; V433-T437 WeakPolarHBondContact O-CG2 3.37Å; V433-T437 PolarHBondContact O-N 2.95Å; V433-T437 PolarHBondContact O-OG1 3.49Å; V433-T437 VanDerWaalsContact O-OG1 3.07Å |
| 434 | T | 96 | Very high | 93.2 | Very high | 57 Ų | 57 | 49.4 Ų | 49.4 | 35% | 0.35 | 28% | 0.282 | S | S | . | . | H | α-helix | trans | -62.8 | -40.7 | 178.8 | -56.5 | 0 | 0 | 0 | 0 | 111.6 | F90 V430 L431 G432 T437 L438 | F90-T434 HydrophobicContact CE1-CG2 4.35Å; F90-T434 HydrophobicContact CZ-CG2 4.39Å; V430-T434 WeakPolarHBondContact O-CB 3.37Å; V430-T434 PolarHBondContact O-N 2.95Å; V430-T434 PolarHBondContact O-OG1 3.37Å; L431-T434 PolarHBondContact O-N 3.07Å; G432-T434 VanDerWaalsContact C-N 3.34Å; G432-T434 PolarHBondContact O-N 3Å; T434-T437 PolarHBondContact O-OG1 3.37Å; T434-T437 VanDerWaalsContact O-OG1 3.12Å; T434-L438 WeakPolarHBondContact O-CB 3.37Å; T434-L438 PolarHBondContact O-N 3.13Å |
| 435 | M | 96.3 | Very high | 93.3 | Very high | 0 Ų | 0 | 48.7 Ų | 48.7 | 0% | 0 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -62.6 | -47.8 | 175 | -73.5 | -176.4 | 83.6 | 0 | 0 | 110.9 | F90 I97 I402 F403 P406 L431 G432 V433 T437 G439 | F90-M435 HydrophobicContact CB-CE 4.33Å; F90-M435 HydrophobicContact CD1-CE 4.42Å; F90-M435 HydrophobicContact CD1-CG 3.59Å; F90-M435 HydrophobicContact CD1-SD 4.34Å; F90-M435 HydrophobicContact CE1-CG 4.01Å; I97-M435 HydrophobicContact CD1-SD 3.92Å; I402-M435 VanDerWaalsContact O-CE 3.31Å; I402-M435 WeakPolarHBondContact O-CE 3.26Å; F403-M435 WeakPolarHBondContact CB-O 3.24Å; P406-M435 HydrophobicContact CB-CE 4.35Å; L431-M435 HydrophobicContact CD1-CG 4.39Å; L431-M435 HydrophobicContact CD1-SD 4.47Å; L431-M435 HydrophobicContact CG-SD 4.32Å; L431-M435 WeakPolarHBondContact O-CG 3.28Å; L431-M435 PolarHBondContact O-N 2.92Å; G432-M435 PolarHBondContact O-N 3.34Å; V433-M435 VanDerWaalsContact C-N 3.34Å; V433-M435 PolarHBondContact O-N 3.29Å; M435-T437 PolarHBondContact O-N 2.92Å; M435-G439 PolarHBondContact O-N 3.47Å |
| 436 | V | 97.1 | Very high | 93 | Very high | 31 Ų | 31 | 47.9 Ų | 47.9 | 19% | 0.188 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -62.9 | -45.8 | -179.7 | 175.5 | 0 | 0 | 0 | 0 | 111.7 | L408 M411 G432 V433 G439 A440 | L408-V436 HydrophobicContact CD2-CG1 4.36Å; L408-V436 HydrophobicContact CD2-CG2 3.92Å; L408-V436 HydrophobicContact CG-CG2 3.88Å; M411-V436 HydrophobicContact SD-CG2 4Å; G432-V436 WeakPolarHBondContact O-CG2 3.24Å; G432-V436 PolarHBondContact O-N 3.49Å; V433-V436 PolarHBondContact O-N 3.45Å; V436-G439 PolarHBondContact O-N 3.47Å; V436-A440 VanDerWaalsContact O-CB 3.24Å; V436-A440 WeakPolarHBondContact O-CB 3.41Å; V436-A440 PolarHBondContact O-N 3.18Å |
| 437 | T | 95.8 | Very high | 92.9 | Very high | 83 Ų | 83 | 44.8 Ų | 44.8 | 51% | 0.509 | 26% | 0.257 | S | S | . | . | H | α-helix | trans | -66.6 | -45.4 | -178.6 | 54.7 | 0 | 0 | 0 | 0 | 111.9 | V433 T434 M435 F441 | V433-T437 HydrophobicContact CG1-CG2 4.28Å; V433-T437 WeakPolarHBondContact O-CG2 3.37Å; V433-T437 PolarHBondContact O-N 2.95Å; V433-T437 PolarHBondContact O-OG1 3.49Å; V433-T437 VanDerWaalsContact O-OG1 3.07Å; T434-T437 PolarHBondContact O-OG1 3.37Å; T434-T437 VanDerWaalsContact O-OG1 3.12Å; M435-T437 PolarHBondContact O-N 2.92Å; T437-F441 VanDerWaalsContact O-CB 3.32Å; T437-F441 WeakPolarHBondContact O-CB 3.38Å; T437-F441 PolarHBondContact O-N 3Å |
| 438 | L | 93.5 | Very high | 92.7 | Very high | 27 Ų | 27 | 42.5 Ų | 42.5 | 14% | 0.141 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -63.5 | -45.6 | 176.9 | -177.9 | 62.7 | 0 | 0 | 0 | 111.1 | F86 M87 F90 F403 T434 F441 I442 | F86-L438 HydrophobicContact CE1-CD2 3.92Å; F86-L438 HydrophobicContact CZ-CD2 4.08Å; M87-L438 HydrophobicContact CE-CD2 4.26Å; F90-L438 HydrophobicContact CD2-CD2 4.3Å; F90-L438 HydrophobicContact CE2-CD2 3.95Å; F90-L438 HydrophobicContact CZ-CD2 4.12Å; F403-L438 HydrophobicContact CD1-CD2 4.1Å; F403-L438 HydrophobicContact CD1-CG 4.47Å; F403-L438 HydrophobicContact CE1-CD2 3.77Å; F403-L438 HydrophobicContact CE1-CG 4.45Å; T434-L438 WeakPolarHBondContact O-CB 3.37Å; T434-L438 PolarHBondContact O-N 3.13Å; L438-F441 PolarHBondContact O-N 2.99Å; L438-I442 HydrophobicContact CD1-CD1 4Å; L438-I442 HydrophobicContact CD1-CG1 4.3Å; L438-I442 HydrophobicContact CG-CD1 3.82Å; L438-I442 HydrophobicContact CG-CG1 4.49Å; L438-I442 VanDerWaalsContact O-CG1 3.24Å; L438-I442 WeakPolarHBondContact O-CG1 3.31Å; L438-I442 PolarHBondContact O-N 3.48Å |
| 439 | G | 93.8 | Very high | 92.3 | Very high | 0 Ų | 0 | 42 Ų | 42 | 0% | 0 | 25% | 0.25 | C | C | . | . | H | α-helix | trans | -61.7 | -45.5 | 178.3 | 0 | 0 | 0 | 0 | 0 | 113 | F403 M435 V436 F441 I442 F443 | F403-G439 VanDerWaalsContact CB-CA 3.47Å; M435-G439 PolarHBondContact O-N 3.47Å; V436-G439 PolarHBondContact O-N 3.47Å; G439-F441 VanDerWaalsContact C-N 3.34Å; G439-I442 PolarHBondContact O-N 3.34Å; G439-F443 WeakPolarHBondContact O-CB 3.46Å; G439-F443 PolarHBondContact O-N 3.31Å |
| 440 | A | 94.3 | Very high | 91.8 | Very high | 52 Ų | 52 | 41.4 Ų | 41.4 | 43% | 0.43 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -64.4 | -39.4 | 176.9 | 0 | 0 | 0 | 0 | 0 | 111.8 | V436 G444 | V436-A440 VanDerWaalsContact O-CB 3.24Å; V436-A440 WeakPolarHBondContact O-CB 3.41Å; V436-A440 PolarHBondContact O-N 3.18Å; A440-G444 PolarHBondContact O-N 3.44Å |
| 441 | F | 92.8 | Very high | 91.2 | Very high | 103 Ų | 103 | 42 Ų | 42 | 45% | 0.452 | 25% | 0.246 | S | C | . | . | H | α-helix | trans | -63 | -49.5 | 174.8 | 175.4 | -101.4 | 0 | 0 | 0 | 111.8 | F241 T437 L438 G439 G444 L445 | F241-F441 AromaticContact CD1-CE1 3.75Å; F241-F441 HydrophobicContact CD1-CE1 3.75Å; F241-F441 HydrophobicContact CD2-CE1 4.13Å; F241-F441 HydrophobicContact CD2-CZ 4.36Å; F241-F441 HydrophobicContact CE1-CD1 4.33Å; F241-F441 AromaticContact CE1-CE1 3.64Å; F241-F441 HydrophobicContact CE1-CE1 3.64Å; F241-F441 HydrophobicContact CE2-CE1 4.03Å; F241-F441 HydrophobicContact CE2-CZ 4.25Å; F241-F441 HydrophobicContact CG-CE1 4.04Å; F241-F441 AromaticContact CZ-CE1 3.8Å; F241-F441 HydrophobicContact CZ-CE1 3.8Å; F241-F441 HydrophobicContact CZ-CZ 4.38Å; T437-F441 VanDerWaalsContact O-CB 3.32Å; T437-F441 WeakPolarHBondContact O-CB 3.38Å; T437-F441 PolarHBondContact O-N 3Å; L438-F441 PolarHBondContact O-N 2.99Å; G439-F441 VanDerWaalsContact C-N 3.34Å; F441-G444 PolarHBondContact O-N 2.9Å; F441-L445 HydrophobicContact CE1-CD2 4.15Å; F441-L445 HydrophobicContact CZ-CD2 4.15Å; F441-L445 VanDerWaalsContact O-CB 3.25Å; F441-L445 WeakPolarHBondContact O-CB 3.48Å; F441-L445 PolarHBondContact O-N 3.17Å |
| 442 | I | 91.1 | Very high | 90.7 | Very high | 2 Ų | 2 | 47 Ų | 47 | 1% | 0.01 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -60.2 | -49.8 | 178.2 | -66 | 167 | 0 | 0 | 0 | 109.8 | M87 M244 A399 F403 L438 G439 G444 L445 T446 | M87-I442 HydrophobicContact CE-CD1 4.28Å; M244-I442 HydrophobicContact CB-CG2 4.22Å; M244-I442 HydrophobicContact SD-CD1 3.52Å; M244-I442 VanDerWaalsContact SD-CD1 3.52Å; M244-I442 HydrophobicContact SD-CG1 3.66Å; A399-I442 HydrophobicContact CB-CB 4.06Å; A399-I442 HydrophobicContact CB-CG2 3.57Å; F403-I442 HydrophobicContact CE2-CD1 4.22Å; F403-I442 HydrophobicContact CZ-CD1 4.45Å; L438-I442 HydrophobicContact CD1-CD1 4Å; L438-I442 HydrophobicContact CD1-CG1 4.3Å; L438-I442 HydrophobicContact CG-CD1 3.82Å; L438-I442 HydrophobicContact CG-CG1 4.49Å; L438-I442 VanDerWaalsContact O-CG1 3.24Å; L438-I442 WeakPolarHBondContact O-CG1 3.31Å; L438-I442 PolarHBondContact O-N 3.48Å; G439-I442 PolarHBondContact O-N 3.34Å; I442-G444 PolarHBondContact O-N 3.28Å; I442-L445 PolarHBondContact O-N 2.89Å; I442-T446 HydrophobicContact CG2-CG2 4.11Å; I442-T446 VanDerWaalsContact O-CB 3.24Å; I442-T446 WeakPolarHBondContact O-CB 3.47Å; I442-T446 WeakPolarHBondContact O-CG2 3.28Å; I442-T446 PolarHBondContact O-N 2.97Å; I442-T446 PolarHBondContact O-OG1 3.25Å |
| 443 | F | 92.2 | Very high | 89.7 | Confident | 72 Ų | 72 | 51.4 Ų | 51.4 | 32% | 0.316 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -58 | -48.4 | 178.5 | 174.1 | -108.9 | 0 | 0 | 0 | 112.3 | G396 L397 C400 G439 T446 T447 | G396-F443 WeakPolarHBondContact O-CD2 3.25Å; L397-F443 HydrophobicContact CD2-CE2 3.74Å; L397-F443 HydrophobicContact CD2-CZ 4.44Å; L397-F443 HydrophobicContact CG-CE2 4.35Å; C400-F443 VanDerWaalsContact SG-CG 3.53Å; G439-F443 WeakPolarHBondContact O-CB 3.46Å; G439-F443 PolarHBondContact O-N 3.31Å; F443-T446 PolarHBondContact O-N 3.37Å; F443-T446 PolarHBondContact O-OG1 3.37Å; F443-T447 WeakPolarHBondContact CE2-OG1 3.35Å; F443-T447 VanDerWaalsContact O-CB 3.25Å; F443-T447 WeakPolarHBondContact O-CB 3.49Å; F443-T447 PolarHBondContact O-N 3.21Å; F443-T447 PolarHBondContact O-OG1 3.12Å |
| 444 | G | 91.8 | Very high | 88.7 | Confident | 30 Ų | 30 | 52.8 Ų | 52.8 | 31% | 0.309 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -63.5 | -47.7 | -179.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | A440 F441 I442 T446 S448 | A440-G444 PolarHBondContact O-N 3.44Å; F441-G444 PolarHBondContact O-N 2.9Å; I442-G444 PolarHBondContact O-N 3.28Å; G444-T446 VanDerWaalsContact C-N 3.34Å; G444-T446 PolarHBondContact O-N 2.89Å; G444-S448 VanDerWaalsContact O-CB 3.25Å; G444-S448 WeakPolarHBondContact O-CB 3.21Å; G444-S448 PolarHBondContact O-N 3.45Å; G444-S448 PolarHBondContact O-OG 2.95Å |
| 445 | L | 87.9 | Confident | 87.8 | Confident | 57 Ų | 57 | 55.5 Ų | 55.5 | 30% | 0.298 | 31% | 0.305 | S | S | . | . | H | α-helix | trans | -60.5 | -45.3 | 179.1 | 179 | 68.5 | 0 | 0 | 0 | 111.6 | F241 F441 I442 S448 N449 | F241-L445 HydrophobicContact CB-CD2 3.39Å; F241-L445 HydrophobicContact CD2-CD2 4.45Å; F241-L445 HydrophobicContact CG-CD2 4.01Å; F441-L445 HydrophobicContact CE1-CD2 4.15Å; F441-L445 HydrophobicContact CZ-CD2 4.15Å; F441-L445 VanDerWaalsContact O-CB 3.25Å; F441-L445 WeakPolarHBondContact O-CB 3.48Å; F441-L445 PolarHBondContact O-N 3.17Å; I442-L445 PolarHBondContact O-N 2.89Å; L445-S448 PolarHBondContact O-N 2.97Å; L445-N449 WeakPolarHBondContact O-CB 3.4Å; L445-N449 PolarHBondContact O-N 3.04Å |
| 446 | T | 84.8 | Confident | 86.9 | Confident | 5 Ų | 5 | 59.6 Ų | 59.6 | 3% | 0.031 | 33% | 0.329 | C | S | . | . | H | α-helix | trans | -79 | -37.3 | -169 | 57.9 | 0 | 0 | 0 | 0 | 111.6 | P245 G396 I442 F443 G444 N449 S450 | P245-T446 HydrophobicContact CB-CG2 4.46Å; P245-T446 HydrophobicContact CG-CG2 3.09Å; G396-T446 WeakPolarHBondContact CA-OG1 3.04Å; I442-T446 HydrophobicContact CG2-CG2 4.11Å; I442-T446 VanDerWaalsContact O-CB 3.24Å; I442-T446 WeakPolarHBondContact O-CB 3.47Å; I442-T446 WeakPolarHBondContact O-CG2 3.28Å; I442-T446 PolarHBondContact O-N 2.97Å; I442-T446 PolarHBondContact O-OG1 3.25Å; F443-T446 PolarHBondContact O-N 3.37Å; F443-T446 PolarHBondContact O-OG1 3.37Å; G444-T446 VanDerWaalsContact C-N 3.34Å; G444-T446 PolarHBondContact O-N 2.89Å; T446-N449 PolarHBondContact O-N 2.93Å; T446-S450 WeakPolarHBondContact O-CB 3.42Å; T446-S450 PolarHBondContact O-N 3.43Å; T446-S450 PolarHBondContact O-OG 3.34Å |
| 447 | T | 85.2 | Confident | 84.8 | Confident | 29 Ų | 29 | 66.2 Ų | 66.2 | 18% | 0.178 | 36% | 0.364 | C | S | . | . | H | α-helix | trans | -62.7 | -45.7 | 169.5 | -53.3 | 0 | 0 | 0 | 0 | 110.5 | F443 N449 S450 I451 | F443-T447 WeakPolarHBondContact CE2-OG1 3.35Å; F443-T447 VanDerWaalsContact O-CB 3.25Å; F443-T447 WeakPolarHBondContact O-CB 3.49Å; F443-T447 PolarHBondContact O-N 3.21Å; F443-T447 PolarHBondContact O-OG1 3.12Å; T447-N449 PolarHBondContact O-N 3.3Å; T447-S450 PolarHBondContact O-N 2.88Å; T447-I451 HydrophobicContact CG2-CD1 3.91Å; T447-I451 VanDerWaalsContact O-CG1 3.27Å; T447-I451 WeakPolarHBondContact O-CG1 3.47Å; T447-I451 PolarHBondContact O-N 2.93Å |
| 448 | S | 87.9 | Confident | 84.3 | Confident | 76 Ų | 76 | 65.4 Ų | 65.4 | 53% | 0.531 | 36% | 0.356 | S | S | . | . | H | α-helix | trans | -63.8 | -42.7 | 179.1 | -57.4 | 0 | 0 | 0 | 0 | 112 | G444 L445 I451 Y452 | G444-S448 VanDerWaalsContact O-CB 3.25Å; G444-S448 WeakPolarHBondContact O-CB 3.21Å; G444-S448 PolarHBondContact O-N 3.45Å; G444-S448 PolarHBondContact O-OG 2.95Å; L445-S448 PolarHBondContact O-N 2.97Å; S448-I451 PolarHBondContact O-N 2.87Å; S448-Y452 WeakPolarHBondContact O-CB 3.39Å; S448-Y452 PolarHBondContact O-N 3.24Å |
| 449 | N | 83.9 | Confident | 83.8 | Confident | 39 Ų | 39 | 67.4 Ų | 67.4 | 21% | 0.209 | 37% | 0.368 | C | S | . | . | H | α-helix | trans | -67.1 | -40.8 | 178.8 | -167.3 | 15.2 | 0 | 0 | 0 | 111.6 | N242 L445 T446 T447 Y452 Q453 | N242-N449 PolarHBondContact OD1-ND2 3.26Å; L445-N449 WeakPolarHBondContact O-CB 3.4Å; L445-N449 PolarHBondContact O-N 3.04Å; T446-N449 PolarHBondContact O-N 2.93Å; T447-N449 PolarHBondContact O-N 3.3Å; N449-Y452 PolarHBondContact O-N 2.91Å; N449-Q453 WeakPolarHBondContact O-CG 3.4Å; N449-Q453 PolarHBondContact O-N 2.99Å |
| 450 | S | 80.8 | Confident | 83.2 | Confident | 10 Ų | 10 | 71.2 Ų | 71.2 | 7% | 0.07 | 39% | 0.388 | C | S | . | . | H | α-helix | trans | -61.3 | -47 | 176.2 | -56.6 | 0 | 0 | 0 | 0 | 111.2 | S392 T446 T447 Y452 Q453 D454 | S392-S450 WeakPolarHBondContact CB-OG 2.81Å; S392-S450 PolarHBondContact OG-OG 3.23Å; T446-S450 WeakPolarHBondContact O-CB 3.42Å; T446-S450 PolarHBondContact O-N 3.43Å; T446-S450 PolarHBondContact O-OG 3.34Å; T447-S450 PolarHBondContact O-N 2.88Å; S450-Y452 VanDerWaalsContact C-N 3.33Å; S450-Y452 PolarHBondContact O-N 3.29Å; S450-Q453 PolarHBondContact O-N 3.35Å; S450-D454 PolarHBondContact O-N 2.88Å |
| 451 | I | 82.8 | Confident | 82.6 | Confident | 100 Ų | 100 | 72.3 Ų | 72.3 | 51% | 0.513 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -61.8 | -43 | 176.4 | -65.8 | 166.2 | 0 | 0 | 0 | 110.8 | T447 S448 Q453 D454 V455 | T447-I451 HydrophobicContact CG2-CD1 3.91Å; T447-I451 VanDerWaalsContact O-CG1 3.27Å; T447-I451 WeakPolarHBondContact O-CG1 3.47Å; T447-I451 PolarHBondContact O-N 2.93Å; S448-I451 PolarHBondContact O-N 2.87Å; I451-Q453 PolarHBondContact O-N 2.61Å; I451-D454 PolarHBondContact O-N 3.45Å; I451-V455 HydrophobicContact CG2-CG2 4.15Å; I451-V455 WeakPolarHBondContact O-CB 3.22Å; I451-V455 VanDerWaalsContact O-CG2 3.23Å; I451-V455 WeakPolarHBondContact O-CG2 3.4Å; I451-V455 PolarHBondContact O-N 3.28Å |
| 452 | Y | 84.3 | Confident | 82 | Confident | 150 Ų | 150 | 70.4 Ų | 70.4 | 59% | 0.588 | 38% | 0.382 | S | S | * | . | H | α-helix | trans | -61.4 | -44.9 | 178.9 | 179.7 | -96.3 | 0 | 0 | 0 | 111.8 | S448 N449 S450 D454 V455 V456 | S448-Y452 WeakPolarHBondContact O-CB 3.39Å; S448-Y452 PolarHBondContact O-N 3.24Å; N449-Y452 PolarHBondContact O-N 2.91Å; S450-Y452 VanDerWaalsContact C-N 3.33Å; S450-Y452 PolarHBondContact O-N 3.29Å; Y452-D454 VanDerWaalsContact C-N 3.32Å; Y452-D454 PolarHBondContact O-N 2.83Å; Y452-V455 PolarHBondContact O-N 2.8Å; Y452-V456 HydrophobicContact CD1-CG2 4.42Å; Y452-V456 HydrophobicContact CD2-CG2 3.99Å; Y452-V456 HydrophobicContact CE1-CG2 4.13Å; Y452-V456 HydrophobicContact CE2-CG2 3.68Å; Y452-V456 HydrophobicContact CG-CG2 4.36Å; Y452-V456 WeakPolarHBondContact O-CB 3.28Å; Y452-V456 VanDerWaalsContact O-CG2 3.29Å; Y452-V456 WeakPolarHBondContact O-CG2 3.43Å; Y452-V456 PolarHBondContact O-N 3.18Å |
| 453 | Q | 74.9 | Confident | 81.4 | Confident | 94 Ų | 94 | 74.9 Ų | 74.9 | 44% | 0.439 | 41% | 0.406 | S | S | . | . | H | α-helix | trans | -64.3 | -35.9 | 178.3 | -73.1 | -178.6 | -3.8 | 0 | 0 | 112.8 | N449 S450 I451 N457 | N449-Q453 WeakPolarHBondContact O-CG 3.4Å; N449-Q453 PolarHBondContact O-N 2.99Å; S450-Q453 PolarHBondContact O-N 3.35Å; I451-Q453 PolarHBondContact O-N 2.61Å; Q453-N457 WeakPolarHBondContact O-CB 3.4Å; Q453-N457 PolarHBondContact O-N 3.08Å; Q453-N457 PolarHBondContact O-ND2 2.61Å |
| 454 | D | 75.4 | Confident | 80.6 | Confident | 92 Ų | 92 | 75.1 Ų | 75.1 | 49% | 0.492 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -79 | -22.3 | 178.5 | -73.3 | -20.8 | 0 | 0 | 0 | 113.7 | R389 S450 I451 Y452 | R389-D454 IonicContact NE-OD1 2.81Å; S450-D454 PolarHBondContact O-N 2.88Å; I451-D454 PolarHBondContact O-N 3.45Å; Y452-D454 VanDerWaalsContact C-N 3.32Å; Y452-D454 PolarHBondContact O-N 2.83Å |
| 455 | V | 78.3 | Confident | 79.7 | Confident | 114 Ų | 114 | 78.6 Ų | 78.6 | 69% | 0.691 | 42% | 0.421 | S | S | * | . | H | α-helix | trans | -87.4 | -32.5 | 177.5 | 170.3 | 0 | 0 | 0 | 0 | 111.7 | I451 Y452 | I451-V455 HydrophobicContact CG2-CG2 4.15Å; I451-V455 WeakPolarHBondContact O-CB 3.22Å; I451-V455 VanDerWaalsContact O-CG2 3.23Å; I451-V455 WeakPolarHBondContact O-CG2 3.4Å; I451-V455 PolarHBondContact O-N 3.28Å; Y452-V455 PolarHBondContact O-N 2.8Å |
| 456 | V | 76.2 | Confident | 79 | Confident | 85 Ų | 85 | 80.4 Ų | 80.4 | 52% | 0.515 | 43% | 0.431 | S | S | . | . | H | α-helix | trans | -90.5 | -27.9 | -174.5 | 175.8 | 0 | 0 | 0 | 0 | 112.8 | Y452 | Y452-V456 HydrophobicContact CD1-CG2 4.42Å; Y452-V456 HydrophobicContact CD2-CG2 3.99Å; Y452-V456 HydrophobicContact CE1-CG2 4.13Å; Y452-V456 HydrophobicContact CE2-CG2 3.68Å; Y452-V456 HydrophobicContact CG-CG2 4.36Å; Y452-V456 WeakPolarHBondContact O-CB 3.28Å; Y452-V456 VanDerWaalsContact O-CG2 3.29Å; Y452-V456 WeakPolarHBondContact O-CG2 3.43Å; Y452-V456 PolarHBondContact O-N 3.18Å |
| 457 | N | 53.8 | Low | 78.5 | Confident | 171 Ų | 171 | 87.3 Ų | 87.3 | 91% | 0.914 | 47% | 0.467 | S | S | * | . | trans | -105.7 | 0 | 175.3 | -55.6 | -59.4 | 0 | 0 | 0 | 110.8 | Q453 | Q453-N457 WeakPolarHBondContact O-CB 3.4Å; Q453-N457 PolarHBondContact O-N 3.08Å; Q453-N457 PolarHBondContact O-ND2 2.61Å |
Retrieved 457 of 457 residues in 605.8 ms
(Link to these results)