| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 45.2 | Very low | 42 | Very low | 163 Ų | 163 | 115.3 Ų | 115.3 | 80% | 0.803 | 70% | 0.698 | S | S | * | * | 0 | 108.6 | 0 | -81.3 | 169.2 | 70.4 | 0 | 0 | 108.9 | L85 P87 | M1-L85 PolarHBondContact N-O 2.99Å; M1-P87 PolarHBondContact N-O 2.66Å | |||
| 2 | W | 49.3 | Very low | 41.8 | Very low | 63 Ų | 63 | 118 Ų | 118 | 24% | 0.239 | 71% | 0.705 | C | S | . | * | trans | -54.7 | 135.9 | -167 | -39.8 | 90.3 | 0 | 0 | 0 | 112.4 | Q23 L84 D279 | W2-Q23 PolarHBondContact O-NE2 3.48Å; W2-L84 WeakPolarHBondContact CZ2-O 3.42Å; W2-D279 HydrophobicContact CE3-CB 4.36Å; W2-D279 HydrophobicContact CH2-CB 4.1Å; W2-D279 HydrophobicContact CZ3-CB 3.9Å; W2-D279 WeakPolarHBondContact CZ3-OD1 3.33Å; W2-D279 WeakPolarHBondContact CZ3-OD2 3.5Å | ||
| 3 | G | 35.4 | Very low | 41.9 | Very low | 69 Ų | 69 | 119.3 Ų | 119.3 | 71% | 0.711 | 71% | 0.713 | S | S | * | * | trans | -132.3 | 130.5 | -177 | 0 | 0 | 0 | 0 | 0 | 112 | G5 | G3-G5 PolarHBondContact O-N 3.05Š| ||
| 4 | C | 46.9 | Very low | 41.9 | Very low | 84 Ų | 84 | 122.9 Ų | 122.9 | 57% | 0.568 | 72% | 0.719 | S | S | * | * | trans | -83.1 | 91.8 | 163.3 | -73.5 | 0 | 0 | 0 | 0 | 108.3 | Q23 | C4-Q23 PolarHBondContact SG-OE1 3.45Š| ||
| 5 | G | 39 | Very low | 42.3 | Very low | 75 Ų | 75 | 123.2 Ų | 123.2 | 77% | 0.773 | 71% | 0.711 | S | S | * | * | trans | -88.5 | 96.1 | 166.7 | 0 | 0 | 0 | 0 | 0 | 109.5 | G3 | G3-G5 PolarHBondContact O-N 3.05Š| ||
| 6 | W | 47.5 | Very low | 42.7 | Very low | 163 Ų | 163 | 123.1 Ų | 123.1 | 62% | 0.617 | 71% | 0.706 | S | S | * | * | trans | -93.5 | 119.8 | 164 | -98.2 | 38.5 | 0 | 0 | 0 | 109.1 | A268 | W6-A268 HydrophobicContact CH2-CB 4.29Å; W6-A268 HydrophobicContact CZ2-CB 3.69Å | ||
| 7 | F | 37.1 | Very low | 43.4 | Very low | 208 Ų | 208 | 120.2 Ų | 120.2 | 91% | 0.912 | 69% | 0.693 | S | S | * | * | trans | -71.4 | 133.6 | 168.7 | -113.4 | -93.4 | 0 | 0 | 0 | 109 | G9 | F7-G9 PolarHBondContact O-N 3.13Š| ||
| 8 | N | 39.7 | Very low | 44.3 | Very low | 174 Ų | 174 | 117.3 Ų | 117.3 | 93% | 0.93 | 69% | 0.685 | S | S | * | * | trans | -37.8 | 113.7 | -178.1 | -106.8 | -18.8 | 0 | 0 | 0 | 113.9 | ||||
| 9 | G | 34.8 | Very low | 45.3 | Very low | 57 Ų | 57 | 114.4 Ų | 114.4 | 59% | 0.588 | 67% | 0.672 | S | S | * | * | trans | -156.2 | 104.5 | 167.9 | 0 | 0 | 0 | 0 | 0 | 108.5 | F7 G11 | F7-G9 PolarHBondContact O-N 3.13Å; G9-G11 PolarHBondContact O-N 3.49Å | ||
| 10 | T | 46.8 | Very low | 46.3 | Very low | 155 Ų | 155 | 115.4 Ų | 115.4 | 95% | 0.951 | 67% | 0.669 | S | S | * | * | trans | -52.5 | 115.8 | -177.4 | 44.9 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 11 | G | 40.8 | Very low | 47.6 | Very low | 57 Ų | 57 | 115.1 Ų | 115.1 | 59% | 0.588 | 67% | 0.666 | S | S | * | * | trans | 168 | 108.6 | 168.2 | 0 | 0 | 0 | 0 | 0 | 114.7 | G9 | G9-G11 PolarHBondContact O-N 3.49Š| ||
| 12 | L | 38.8 | Very low | 48.9 | Very low | 148 Ų | 148 | 111.4 Ų | 111.4 | 78% | 0.775 | 65% | 0.648 | S | S | * | * | trans | 75 | 107.4 | 166.5 | -75 | 112.3 | 0 | 0 | 0 | 119.4 | E14 | L12-E14 VanDerWaalsContact C-N 3.32Å; L12-E14 PolarHBondContact O-N 3.01Å | ||
| 13 | V | 43.8 | Very low | 50 | Low | 135 Ų | 135 | 110.9 Ų | 110.9 | 82% | 0.818 | 65% | 0.649 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84.4 | 4.6 | 179.8 | 170.7 | 0 | 0 | 0 | 0 | 112.9 | ||
| 14 | E | 41.6 | Very low | 52 | Low | 169 Ų | 169 | 112.6 Ų | 112.6 | 79% | 0.79 | 64% | 0.641 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -94.4 | -18.2 | -175 | -112.3 | 173 | 147.4 | 0 | 0 | 115.5 | L12 | L12-E14 VanDerWaalsContact C-N 3.32Å; L12-E14 PolarHBondContact O-N 3.01Å |
| 15 | E | 47.1 | Very low | 53.6 | Low | 128 Ų | 128 | 110.3 Ų | 110.3 | 60% | 0.598 | 63% | 0.631 | S | S | * | * | S | Bend | trans | -91.9 | -1.4 | -179.5 | -72.3 | -82.9 | 140.1 | 0 | 0 | 113.6 | H269 | E15-H269 IonicContact OE2-CE1 3.63Š|
| 16 | L | 49.9 | Very low | 55.6 | Low | 121 Ų | 121 | 107.3 Ų | 107.3 | 63% | 0.634 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -72.2 | -38.5 | -171.5 | -156.1 | 67.4 | 0 | 0 | 0 | 115.8 | ||
| 17 | P | 54.5 | Low | 57.1 | Low | 75 Ų | 75 | 101.5 Ų | 101.5 | 49% | 0.487 | 58% | 0.582 | S | S | . | * | H | α-helix | trans | -74.4 | -36.6 | -176.4 | 22.5 | -24.7 | 0 | 0 | 0 | 113 | C19 Q20 D21 | P17-C19 PolarHBondContact O-N 3.17Å; P17-Q20 PolarHBondContact O-N 3.34Å; P17-D21 PolarHBondContact O-N 3.01Å |
| 18 | A | 58.4 | Low | 59.3 | Low | 67 Ų | 67 | 96.6 Ų | 96.6 | 55% | 0.554 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -65.6 | -37 | -177.4 | 0 | 0 | 0 | 0 | 0 | 113.1 | L22 | A18-L22 VanDerWaalsContact O-CB 3.24Å; A18-L22 WeakPolarHBondContact O-CB 3.48Å; A18-L22 PolarHBondContact O-N 3.22Å; A18-L22 VanDerWaalsContact O-N 3.07Å |
| 19 | C | 63.3 | Low | 61.4 | Low | 63 Ų | 63 | 92.2 Ų | 92.2 | 43% | 0.426 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -67.8 | -40 | 177.7 | -172.3 | 0 | 0 | 0 | 0 | 111.9 | P17 Q23 | P17-C19 PolarHBondContact O-N 3.17Å; C19-Q23 WeakPolarHBondContact O-CB 3.34Å; C19-Q23 PolarHBondContact O-N 3.15Å |
| 20 | Q | 66.9 | Low | 63.7 | Low | 133 Ų | 133 | 89.8 Ų | 89.8 | 62% | 0.621 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -70.4 | -41.1 | -179.2 | -160.9 | 168.9 | -2.2 | 0 | 0 | 111.8 | P17 Q23 L24 | P17-Q20 PolarHBondContact O-N 3.34Å; Q20-Q23 PolarHBondContact O-N 3.03Å; Q20-L24 WeakPolarHBondContact O-CB 3.49Å; Q20-L24 PolarHBondContact O-N 3.38Å |
| 21 | D | 73.4 | Confident | 65.5 | Low | 111 Ų | 111 | 87 Ų | 87 | 59% | 0.594 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -65.5 | -41.2 | 174.9 | -72.8 | -26.2 | 0 | 0 | 0 | 112 | P17 L24 G25 | P17-D21 PolarHBondContact O-N 3.01Å; D21-L24 PolarHBondContact O-N 3.5Å; D21-G25 PolarHBondContact O-N 2.83Å |
| 22 | L | 72.3 | Confident | 67.7 | Low | 85 Ų | 85 | 89 Ų | 89 | 45% | 0.445 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -66.2 | -40.3 | 178.1 | -170.9 | 64.2 | 0 | 0 | 0 | 112 | A18 G25 L26 F276 | A18-L22 VanDerWaalsContact O-CB 3.24Å; A18-L22 WeakPolarHBondContact O-CB 3.48Å; A18-L22 PolarHBondContact O-N 3.22Å; A18-L22 VanDerWaalsContact O-N 3.07Å; L22-G25 PolarHBondContact O-N 3.24Å; L22-L26 WeakPolarHBondContact O-CB 3.13Å; L22-L26 PolarHBondContact O-N 3.33Å; L22-F276 HydrophobicContact CD1-CE1 4.24Å; L22-F276 HydrophobicContact CD1-CE2 3.66Å; L22-F276 HydrophobicContact CD1-CZ 3.46Å; L22-F276 VanDerWaalsContact CD1-CZ 3.46Å; L22-F276 HydrophobicContact CD2-CD1 3.99Å; L22-F276 HydrophobicContact CD2-CD2 3.79Å; L22-F276 HydrophobicContact CD2-CE1 3.88Å; L22-F276 HydrophobicContact CD2-CE2 3.69Å; L22-F276 HydrophobicContact CD2-CG 3.95Å; L22-F276 HydrophobicContact CD2-CZ 3.74Å; L22-F276 HydrophobicContact CG-CD2 3.81Å; L22-F276 HydrophobicContact CG-CE1 4.28Å; L22-F276 HydrophobicContact CG-CE2 3.35Å; L22-F276 HydrophobicContact CG-CG 4.47Å; L22-F276 HydrophobicContact CG-CZ 3.62Å |
| 23 | Q | 72.7 | Confident | 69.8 | Low | 52 Ų | 52 | 82.7 Ų | 82.7 | 24% | 0.243 | 46% | 0.462 | C | S | . | . | H | α-helix | trans | -67.5 | -39.4 | 175.6 | -175.7 | -179.7 | -17.8 | 0 | 0 | 112.2 | W2 C4 C19 Q20 L26 S27 | W2-Q23 PolarHBondContact O-NE2 3.48Å; C4-Q23 PolarHBondContact SG-OE1 3.45Å; C19-Q23 WeakPolarHBondContact O-CB 3.34Å; C19-Q23 PolarHBondContact O-N 3.15Å; Q20-Q23 PolarHBondContact O-N 3.03Å; Q23-L26 PolarHBondContact O-N 3.21Å; Q23-S27 WeakPolarHBondContact O-CB 3.13Å; Q23-S27 PolarHBondContact O-N 3.38Å; Q23-S27 PolarHBondContact O-OG 3.01Å |
| 24 | L | 77.3 | Confident | 71.9 | Confident | 104 Ų | 104 | 78 Ų | 78 | 55% | 0.545 | 43% | 0.432 | S | S | . | . | H | α-helix | trans | -62.8 | -47.4 | 174 | -175.6 | 67.2 | 0 | 0 | 0 | 110.3 | Q20 D21 L26 S27 L28 | Q20-L24 WeakPolarHBondContact O-CB 3.49Å; Q20-L24 PolarHBondContact O-N 3.38Å; D21-L24 PolarHBondContact O-N 3.5Å; L24-L26 PolarHBondContact O-N 3.25Å; L24-S27 PolarHBondContact O-N 3.05Å; L24-L28 HydrophobicContact CG-CD1 4.22Å; L24-L28 WeakPolarHBondContact O-CB 3.11Å; L24-L28 VanDerWaalsContact O-CG 3.3Å; L24-L28 WeakPolarHBondContact O-CG 3.01Å; L24-L28 PolarHBondContact O-N 3.44Å |
| 25 | G | 80.3 | Confident | 74 | Confident | 36 Ų | 36 | 74.6 Ų | 74.6 | 37% | 0.371 | 42% | 0.422 | S | S | . | . | H | α-helix | trans | -56.9 | -46.3 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.9 | D21 L22 S27 L28 L29 | D21-G25 PolarHBondContact O-N 2.83Å; L22-G25 PolarHBondContact O-N 3.24Å; G25-S27 PolarHBondContact O-N 2.92Å; G25-L28 PolarHBondContact O-N 3.1Å; G25-L29 VanDerWaalsContact O-CB 3.28Å; G25-L29 WeakPolarHBondContact O-CB 3.42Å; G25-L29 PolarHBondContact O-N 3.28Å |
| 26 | L | 80.2 | Confident | 76 | Confident | 13 Ų | 13 | 72 Ų | 72 | 7% | 0.068 | 42% | 0.415 | C | S | . | . | H | α-helix | trans | -66.2 | -37.2 | 178.2 | -169.7 | 71.4 | 0 | 0 | 0 | 112.5 | L22 Q23 L24 L29 S30 F276 D279 L280 L283 | L22-L26 WeakPolarHBondContact O-CB 3.13Å; L22-L26 PolarHBondContact O-N 3.33Å; Q23-L26 PolarHBondContact O-N 3.21Å; L24-L26 PolarHBondContact O-N 3.25Å; L26-L29 PolarHBondContact O-N 2.83Å; L26-S30 VanDerWaalsContact O-CB 3.28Å; L26-S30 WeakPolarHBondContact O-CB 3.5Å; L26-S30 PolarHBondContact O-N 3.49Å; L26-S30 PolarHBondContact O-OG 3.05Å; L26-F276 HydrophobicContact CB-CE2 4.16Å; L26-F276 HydrophobicContact CD1-CE2 4.16Å; L26-F276 HydrophobicContact CD2-CD2 3.92Å; L26-F276 HydrophobicContact CD2-CE2 4.03Å; L26-F276 HydrophobicContact CG-CE2 4.35Å; L26-D279 HydrophobicContact CD2-CB 3.73Å; L26-L280 HydrophobicContact CD1-CB 4.21Å; L26-L280 HydrophobicContact CD1-CD1 4.19Å; L26-L283 HydrophobicContact CD1-CD2 4.43Å |
| 27 | S | 79.6 | Confident | 77.7 | Confident | 41 Ų | 41 | 66.7 Ų | 66.7 | 29% | 0.287 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -67.7 | -43.7 | 177 | -61.4 | 0 | 0 | 0 | 0 | 111.4 | Q23 L24 G25 L29 S30 L31 | Q23-S27 WeakPolarHBondContact O-CB 3.13Å; Q23-S27 PolarHBondContact O-N 3.38Å; Q23-S27 PolarHBondContact O-OG 3.01Å; L24-S27 PolarHBondContact O-N 3.05Å; G25-S27 PolarHBondContact O-N 2.92Å; S27-L29 VanDerWaalsContact C-N 3.35Å; S27-S30 PolarHBondContact O-N 3.01Å; S27-L31 WeakPolarHBondContact O-CB 3.48Å; S27-L31 PolarHBondContact O-N 3.43Å |
| 28 | L | 83.1 | Confident | 79.3 | Confident | 105 Ų | 105 | 64 Ų | 64 | 55% | 0.55 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -62 | -43.3 | 174 | -71 | 173.9 | 0 | 0 | 0 | 111.4 | L24 G25 L31 L32 | L24-L28 HydrophobicContact CG-CD1 4.22Å; L24-L28 WeakPolarHBondContact O-CB 3.11Å; L24-L28 VanDerWaalsContact O-CG 3.3Å; L24-L28 WeakPolarHBondContact O-CG 3.01Å; L24-L28 PolarHBondContact O-N 3.44Å; G25-L28 PolarHBondContact O-N 3.1Å; L28-L31 PolarHBondContact O-N 3.15Å; L28-L32 WeakPolarHBondContact O-CB 3.3Å; L28-L32 PolarHBondContact O-N 2.88Å |
| 29 | L | 83.6 | Confident | 80.9 | Confident | 81 Ų | 81 | 64.2 Ų | 64.2 | 42% | 0.424 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -68.9 | -38 | 179.7 | -170.6 | 63.1 | 0 | 0 | 0 | 112.2 | G25 L26 S27 L32 G33 L283 | G25-L29 VanDerWaalsContact O-CB 3.28Å; G25-L29 WeakPolarHBondContact O-CB 3.42Å; G25-L29 PolarHBondContact O-N 3.28Å; L26-L29 PolarHBondContact O-N 2.83Å; S27-L29 VanDerWaalsContact C-N 3.35Å; L29-L32 HydrophobicContact CD1-CD2 4.43Å; L29-L32 PolarHBondContact O-N 3.47Å; L29-G33 PolarHBondContact O-N 3.46Å; L29-L283 HydrophobicContact CB-CD2 4.1Å; L29-L283 HydrophobicContact CD2-CD2 3.24Å; L29-L283 HydrophobicContact CG-CD2 3.39Å |
| 30 | S | 83 | Confident | 82.2 | Confident | 7 Ų | 7 | 63.6 Ų | 63.6 | 5% | 0.049 | 36% | 0.361 | C | S | . | . | H | α-helix | trans | -66 | -41.4 | 173.5 | -60.5 | 0 | 0 | 0 | 0 | 111.6 | L26 S27 G33 L34 | L26-S30 VanDerWaalsContact O-CB 3.28Å; L26-S30 WeakPolarHBondContact O-CB 3.5Å; L26-S30 PolarHBondContact O-N 3.49Å; L26-S30 PolarHBondContact O-OG 3.05Å; S27-S30 PolarHBondContact O-N 3.01Å; S30-G33 PolarHBondContact O-N 3.43Å; S30-L34 WeakPolarHBondContact O-CB 3.29Å; S30-L34 PolarHBondContact O-N 3.14Å |
| 31 | L | 84.5 | Confident | 83.3 | Confident | 96 Ų | 96 | 57.3 Ų | 57.3 | 50% | 0.503 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -63.6 | -43.3 | 174.4 | -173.3 | 70.9 | 0 | 0 | 0 | 111.1 | S27 L28 L34 V35 | S27-L31 WeakPolarHBondContact O-CB 3.48Å; S27-L31 PolarHBondContact O-N 3.43Å; L28-L31 PolarHBondContact O-N 3.15Å; L31-L34 PolarHBondContact O-N 3.21Å; L31-V35 HydrophobicContact CD1-CG2 4.2Å; L31-V35 HydrophobicContact CG-CG2 4.29Å; L31-V35 WeakPolarHBondContact O-CB 3.26Å; L31-V35 VanDerWaalsContact O-CG2 3.31Å; L31-V35 WeakPolarHBondContact O-CG2 3.44Å; L31-V35 PolarHBondContact O-N 2.76Å |
| 32 | L | 86.9 | Confident | 84.3 | Confident | 98 Ų | 98 | 55 Ų | 55 | 51% | 0.513 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -61.9 | -45.9 | 175.1 | -178 | 66.9 | 0 | 0 | 0 | 111.3 | L28 L29 L34 V35 V36 G37 | L28-L32 WeakPolarHBondContact O-CB 3.3Å; L28-L32 PolarHBondContact O-N 2.88Å; L29-L32 HydrophobicContact CD1-CD2 4.43Å; L29-L32 PolarHBondContact O-N 3.47Å; L32-L34 VanDerWaalsContact C-N 3.26Å; L32-L34 PolarHBondContact O-N 2.6Å; L32-V35 PolarHBondContact O-N 3.41Å; L32-V36 HydrophobicContact CD1-CB 4.33Å; L32-V36 HydrophobicContact CD1-CG2 3.73Å; L32-V36 WeakPolarHBondContact O-CB 3.29Å; L32-V36 PolarHBondContact O-N 3.04Å; L32-G37 PolarHBondContact O-N 3.11Å |
| 33 | G | 84.6 | Confident | 85.2 | Confident | 17 Ų | 17 | 54.2 Ų | 54.2 | 18% | 0.175 | 32% | 0.32 | C | S | . | . | I | π-helix | trans | -59.9 | -35.9 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.6 | L29 S30 G37 V38 | L29-G33 PolarHBondContact O-N 3.46Å; S30-G33 PolarHBondContact O-N 3.43Å; G33-G37 CarbonylContact O-C 3.36Å; G33-G37 WeakPolarHBondContact O-CA 3.44Å; G33-G37 PolarHBondContact O-N 3.07Å; G33-V38 PolarHBondContact O-N 3.14Å |
| 34 | L | 86.3 | Confident | 86.2 | Confident | 37 Ų | 37 | 57.2 Ų | 57.2 | 19% | 0.194 | 33% | 0.33 | C | S | . | . | I | π-helix | trans | -74.4 | -49.1 | 177.4 | -167.3 | 113.7 | 0 | 0 | 0 | 112.7 | S30 L31 L32 V38 P39 P81 L85 | S30-L34 WeakPolarHBondContact O-CB 3.29Å; S30-L34 PolarHBondContact O-N 3.14Å; L31-L34 PolarHBondContact O-N 3.21Å; L32-L34 VanDerWaalsContact C-N 3.26Å; L32-L34 PolarHBondContact O-N 2.6Å; L34-V38 WeakPolarHBondContact O-CB 3.34Å; L34-P39 WeakPolarHBondContact O-CD 3.06Å; L34-P81 HydrophobicContact CD1-CB 4.09Å; L34-P81 HydrophobicContact CD1-CG 4.41Å; L34-L85 HydrophobicContact CD1-CD1 4.08Å; L34-L85 HydrophobicContact CD1-CD2 4.16Å; L34-L85 HydrophobicContact CD1-CG 3.8Å; L34-L85 HydrophobicContact CD2-CD1 4.5Å; L34-L85 HydrophobicContact CD2-CD2 4.23Å |
| 35 | V | 87.1 | Confident | 87 | Confident | 96 Ų | 96 | 52.3 Ų | 52.3 | 58% | 0.582 | 30% | 0.304 | S | S | * | . | I | π-helix | trans | -74.8 | -37.1 | -174.5 | 173.6 | 0 | 0 | 0 | 0 | 111.6 | L31 L32 P39 | L31-V35 HydrophobicContact CD1-CG2 4.2Å; L31-V35 HydrophobicContact CG-CG2 4.29Å; L31-V35 WeakPolarHBondContact O-CB 3.26Å; L31-V35 VanDerWaalsContact O-CG2 3.31Å; L31-V35 WeakPolarHBondContact O-CG2 3.44Å; L31-V35 PolarHBondContact O-N 2.76Å; L32-V35 PolarHBondContact O-N 3.41Å; V35-P39 WeakPolarHBondContact O-CD 3.32Å; V35-P39 WeakPolarHBondContact O-CG 3.16Å |
| 36 | V | 87.4 | Confident | 87.6 | Confident | 74 Ų | 74 | 52.2 Ų | 52.2 | 45% | 0.448 | 30% | 0.3 | S | S | . | . | I | π-helix | trans | -105 | -50.9 | -177.2 | -177.7 | 0 | 0 | 0 | 0 | 110.8 | L32 V38 P39 V40 | L32-V36 HydrophobicContact CD1-CB 4.33Å; L32-V36 HydrophobicContact CD1-CG2 3.73Å; L32-V36 WeakPolarHBondContact O-CB 3.29Å; L32-V36 PolarHBondContact O-N 3.04Å; V36-V38 PolarHBondContact O-N 3.14Å; V36-P39 WeakPolarHBondContact O-CD 3.34Å; V36-V40 HydrophobicContact CG1-CG2 4.22Å; V36-V40 VanDerWaalsContact O-CB 3.23Å; V36-V40 WeakPolarHBondContact O-CB 3.24Å; V36-V40 WeakPolarHBondContact O-CG2 3.46Å; V36-V40 PolarHBondContact O-N 3.41Å; V36-V40 VanDerWaalsContact O-N 3.17Å |
| 37 | G | 85.8 | Confident | 88.2 | Confident | 9 Ų | 9 | 54 Ų | 54 | 9% | 0.093 | 31% | 0.309 | C | S | . | . | I | π-helix | trans | -64.2 | -42.1 | -173.3 | 0 | 0 | 0 | 0 | 0 | 113.9 | L32 G33 G41 | L32-G37 PolarHBondContact O-N 3.11Å; G33-G37 CarbonylContact O-C 3.36Å; G33-G37 WeakPolarHBondContact O-CA 3.44Å; G33-G37 PolarHBondContact O-N 3.07Å; G37-G41 WeakPolarHBondContact O-CA 3.37Å; G37-G41 PolarHBondContact O-N 3.42Å |
| 38 | V | 89.5 | Confident | 88.8 | Confident | 19 Ų | 19 | 52 Ų | 52 | 12% | 0.115 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -67.1 | -51.1 | -178.9 | 172.2 | 0 | 0 | 0 | 0 | 112.4 | G33 L34 V36 V40 G41 L42 S77 A80 P81 | G33-V38 PolarHBondContact O-N 3.14Å; L34-V38 WeakPolarHBondContact O-CB 3.34Å; V36-V38 PolarHBondContact O-N 3.14Å; V38-V40 VanDerWaalsContact C-N 3.33Å; V38-V40 PolarHBondContact O-N 3.49Å; V38-G41 PolarHBondContact O-N 2.97Å; V38-L42 HydrophobicContact CG1-CD1 3.93Å; V38-L42 HydrophobicContact CG1-CG 4.4Å; V38-L42 WeakPolarHBondContact O-CB 3.38Å; V38-L42 WeakPolarHBondContact O-CG 3.39Å; V38-L42 PolarHBondContact O-N 3.44Å; V38-S77 WeakPolarHBondContact CG1-O 3.35Å; V38-A80 HydrophobicContact CG2-CB 3.54Å; V38-P81 HydrophobicContact CG1-CG 4.44Å |
| 39 | P | 91.9 | Very high | 89.3 | Confident | 71 Ų | 71 | 47.9 Ų | 47.9 | 46% | 0.461 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -61.9 | -40.1 | 177.2 | -25.7 | 36.2 | 0 | 0 | 0 | 112.9 | L34 V35 V36 C43 | L34-P39 WeakPolarHBondContact O-CD 3.06Å; V35-P39 WeakPolarHBondContact O-CD 3.32Å; V35-P39 WeakPolarHBondContact O-CG 3.16Å; V36-P39 WeakPolarHBondContact O-CD 3.34Å; P39-C43 WeakPolarHBondContact O-CB 3.49Å; P39-C43 PolarHBondContact O-N 2.81Å |
| 40 | V | 90.3 | Very high | 89.6 | Confident | 51 Ų | 51 | 48.5 Ų | 48.5 | 31% | 0.309 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -62.8 | -48.8 | 175.9 | 169 | 0 | 0 | 0 | 0 | 110.1 | V36 V38 L42 C43 Y44 F290 | V36-V40 HydrophobicContact CG1-CG2 4.22Å; V36-V40 VanDerWaalsContact O-CB 3.23Å; V36-V40 WeakPolarHBondContact O-CB 3.24Å; V36-V40 WeakPolarHBondContact O-CG2 3.46Å; V36-V40 PolarHBondContact O-N 3.41Å; V36-V40 VanDerWaalsContact O-N 3.17Å; V38-V40 VanDerWaalsContact C-N 3.33Å; V38-V40 PolarHBondContact O-N 3.49Å; V40-L42 PolarHBondContact O-N 3.16Å; V40-C43 PolarHBondContact O-N 3.3Å; V40-Y44 HydrophobicContact CB-CD2 4.42Å; V40-Y44 HydrophobicContact CG1-CD2 3.58Å; V40-Y44 HydrophobicContact CG1-CE2 3.86Å; V40-Y44 WeakPolarHBondContact O-CB 3.34Å; V40-Y44 VanDerWaalsContact O-CD2 3.3Å; V40-Y44 WeakPolarHBondContact O-CD2 2.97Å; V40-Y44 PolarHBondContact O-N 3.1Å; V40-F290 HydrophobicContact CG1-CB 4.05Å |
| 41 | G | 90.4 | Very high | 89.9 | Confident | 0 Ų | 0 | 48.1 Ų | 48.1 | 0% | 0 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -56.9 | -50.1 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | G37 V38 N45 | G37-G41 WeakPolarHBondContact O-CA 3.37Å; G37-G41 PolarHBondContact O-N 3.42Å; V38-G41 PolarHBondContact O-N 2.97Å; G41-N45 WeakPolarHBondContact O-CB 3.31Å; G41-N45 PolarHBondContact O-N 3.39Å; G41-N45 PolarHBondContact O-ND2 2.86Å |
| 42 | L | 93.1 | Very high | 90.1 | Very high | 62 Ų | 62 | 43.6 Ų | 43.6 | 33% | 0.325 | 25% | 0.252 | S | S | . | . | H | α-helix | trans | -60.1 | -51.5 | 177.7 | -73.5 | 171.3 | 0 | 0 | 0 | 112 | V38 V40 A46 L74 T78 | V38-L42 HydrophobicContact CG1-CD1 3.93Å; V38-L42 HydrophobicContact CG1-CG 4.4Å; V38-L42 WeakPolarHBondContact O-CB 3.38Å; V38-L42 WeakPolarHBondContact O-CG 3.39Å; V38-L42 PolarHBondContact O-N 3.44Å; V40-L42 PolarHBondContact O-N 3.16Å; L42-A46 WeakPolarHBondContact O-CB 3.29Å; L42-A46 PolarHBondContact O-N 3.32Å; L42-L74 HydrophobicContact CD2-CD2 4.05Å; L42-L74 WeakPolarHBondContact O-CD2 3.33Å; L42-T78 HydrophobicContact CD2-CG2 4.05Å |
| 43 | C | 92.7 | Very high | 90.1 | Very high | 70 Ų | 70 | 42.9 Ų | 42.9 | 47% | 0.473 | 25% | 0.248 | S | C | . | . | H | α-helix | trans | -62.7 | -53.7 | -176.2 | -177.2 | 0 | 0 | 0 | 0 | 111.7 | P39 V40 A46 L47 | P39-C43 WeakPolarHBondContact O-CB 3.49Å; P39-C43 PolarHBondContact O-N 2.81Å; V40-C43 PolarHBondContact O-N 3.3Å; C43-A46 PolarHBondContact O-N 3.37Å; C43-L47 WeakPolarHBondContact O-CB 3.28Å; C43-L47 VanDerWaalsContact O-CG 3.28Å; C43-L47 WeakPolarHBondContact O-CG 3.33Å; C43-L47 PolarHBondContact O-N 2.75Å |
| 44 | Y | 91.9 | Very high | 90.2 | Very high | 115 Ų | 115 | 45.4 Ų | 45.4 | 45% | 0.451 | 26% | 0.255 | S | S | . | . | H | α-helix | trans | -71.8 | -37.1 | -174.8 | -77.1 | -73 | 0 | 0 | 0 | 113.1 | V40 L47 L48 P293 | V40-Y44 HydrophobicContact CB-CD2 4.42Å; V40-Y44 HydrophobicContact CG1-CD2 3.58Å; V40-Y44 HydrophobicContact CG1-CE2 3.86Å; V40-Y44 WeakPolarHBondContact O-CB 3.34Å; V40-Y44 VanDerWaalsContact O-CD2 3.3Å; V40-Y44 WeakPolarHBondContact O-CD2 2.97Å; V40-Y44 PolarHBondContact O-N 3.1Å; Y44-L47 PolarHBondContact O-N 3.34Å; Y44-L48 WeakPolarHBondContact O-CB 3.43Å; Y44-L48 PolarHBondContact O-N 2.95Å; Y44-P293 HydrophobicContact CG-CB 4.48Å |
| 45 | N | 94.4 | Very high | 90.1 | Very high | 0 Ų | 0 | 44.1 Ų | 44.1 | 0% | 0 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -66.9 | -40.8 | 174.4 | -73.7 | -64.2 | 0 | 0 | 0 | 111.2 | G41 L47 L48 V49 A70 L74 S289 P293 | G41-N45 WeakPolarHBondContact O-CB 3.31Å; G41-N45 PolarHBondContact O-N 3.39Å; G41-N45 PolarHBondContact O-ND2 2.86Å; N45-L47 PolarHBondContact O-N 2.94Å; N45-L48 WeakPolarHBondContact O-CB 3.25Å; N45-L48 PolarHBondContact O-N 3.34Å; N45-V49 VanDerWaalsContact O-CG2 3.32Å; N45-V49 WeakPolarHBondContact O-CG2 3.39Å; N45-V49 PolarHBondContact O-N 3.42Å; N45-A70 HydrophobicContact CB-CB 4.05Å; N45-A70 WeakPolarHBondContact OD1-CA 3.26Å; N45-A70 VanDerWaalsContact OD1-CB 3.31Å; N45-A70 WeakPolarHBondContact OD1-CB 3.5Å; N45-L74 HydrophobicContact CB-CD2 3.75Å; N45-L74 HydrophobicContact CB-CG 3.78Å; N45-S289 PolarHBondContact ND2-O 2.97Å; N45-S289 PolarHBondContact ND2-OG 3.34Å; N45-P293 HydrophobicContact CB-CG 4.42Å; N45-P293 VanDerWaalsContact OD1-CG 3.23Å; N45-P293 WeakPolarHBondContact OD1-CG 3.24Å |
| 46 | A | 93.8 | Very high | 89.7 | Confident | 34 Ų | 34 | 45.2 Ų | 45.2 | 28% | 0.281 | 25% | 0.246 | S | C | . | . | H | α-helix | trans | -61.7 | -45.2 | 175.3 | 0 | 0 | 0 | 0 | 0 | 111.5 | L42 C43 L48 V49 L50 L74 | L42-A46 WeakPolarHBondContact O-CB 3.29Å; L42-A46 PolarHBondContact O-N 3.32Å; C43-A46 PolarHBondContact O-N 3.37Å; A46-L48 VanDerWaalsContact C-N 3.33Å; A46-L48 PolarHBondContact O-N 2.88Å; A46-V49 PolarHBondContact O-N 2.89Å; A46-L50 WeakPolarHBondContact O-CB 3.3Å; A46-L50 VanDerWaalsContact O-CG 3.24Å; A46-L50 WeakPolarHBondContact O-CG 3.26Å; A46-L50 PolarHBondContact O-N 2.92Å; A46-L74 HydrophobicContact CB-CD2 4.25Å |
| 47 | L | 91.8 | Very high | 89.1 | Confident | 51 Ų | 51 | 47.1 Ų | 47.1 | 27% | 0.267 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -60.9 | -40.9 | 175.8 | -73.7 | 171.6 | 0 | 0 | 0 | 112.1 | C43 Y44 N45 A51 L307 L310 | C43-L47 WeakPolarHBondContact O-CB 3.28Å; C43-L47 VanDerWaalsContact O-CG 3.28Å; C43-L47 WeakPolarHBondContact O-CG 3.33Å; C43-L47 PolarHBondContact O-N 2.75Å; Y44-L47 PolarHBondContact O-N 3.34Å; N45-L47 PolarHBondContact O-N 2.94Å; L47-A51 WeakPolarHBondContact O-CB 3.26Å; L47-A51 PolarHBondContact O-N 3.14Å; L47-L307 HydrophobicContact CB-CD1 4.33Å; L47-L307 HydrophobicContact CD2-CD1 3.81Å; L47-L307 HydrophobicContact CG-CD1 4.46Å; L47-L310 HydrophobicContact CD2-CD2 4.47Å |
| 48 | L | 92.4 | Very high | 88.7 | Confident | 0 Ų | 0 | 49.6 Ų | 49.6 | 0% | 0 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -61.4 | -48.2 | 177.4 | -172.5 | 161 | 0 | 0 | 0 | 111.2 | Y44 N45 A46 N52 F66 V67 A70 P293 Y296 | Y44-L48 WeakPolarHBondContact O-CB 3.43Å; Y44-L48 PolarHBondContact O-N 2.95Å; N45-L48 WeakPolarHBondContact O-CB 3.25Å; N45-L48 PolarHBondContact O-N 3.34Å; A46-L48 VanDerWaalsContact C-N 3.33Å; A46-L48 PolarHBondContact O-N 2.88Å; L48-N52 WeakPolarHBondContact O-CB 3.45Å; L48-N52 PolarHBondContact O-N 3.46Å; L48-N52 PolarHBondContact O-ND2 3.21Å; L48-F66 HydrophobicContact CD2-CB 4.43Å; L48-V67 HydrophobicContact CD2-CB 4.46Å; L48-V67 HydrophobicContact CD2-CG2 3.83Å; L48-A70 HydrophobicContact CB-CB 4.38Å; L48-A70 HydrophobicContact CD1-CB 4.2Å; L48-A70 HydrophobicContact CD2-CB 3.73Å; L48-A70 HydrophobicContact CG-CB 4.32Å; L48-P293 HydrophobicContact CD1-CB 4.23Å; L48-P293 HydrophobicContact CD1-CG 4.48Å; L48-Y296 HydrophobicContact CD1-CD1 3.39Å; L48-Y296 HydrophobicContact CD1-CE1 4.17Å; L48-Y296 HydrophobicContact CD1-CG 3.62Å; L48-Y296 HydrophobicContact CD2-CD1 4.44Å; L48-Y296 HydrophobicContact CD2-CE1 4.46Å; L48-Y296 HydrophobicContact CG-CD1 3.55Å; L48-Y296 HydrophobicContact CG-CE1 3.82Å; L48-Y296 HydrophobicContact CG-CG 4.19Å |
| 49 | V | 93.2 | Very high | 88.3 | Confident | 18 Ų | 18 | 49.6 Ų | 49.6 | 11% | 0.109 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -61.9 | -53.1 | 177.7 | 173.2 | 0 | 0 | 0 | 0 | 110.1 | N45 A46 A51 N52 L53 V67 A70 V71 L74 | N45-V49 VanDerWaalsContact O-CG2 3.32Å; N45-V49 WeakPolarHBondContact O-CG2 3.39Å; N45-V49 PolarHBondContact O-N 3.42Å; A46-V49 PolarHBondContact O-N 2.89Å; V49-A51 PolarHBondContact O-N 3.14Å; V49-N52 PolarHBondContact O-N 3.34Å; V49-L53 HydrophobicContact CG1-CD1 3.61Å; V49-L53 HydrophobicContact CG1-CG 4.2Å; V49-L53 WeakPolarHBondContact O-CB 3.49Å; V49-L53 VanDerWaalsContact O-CG 3.27Å; V49-L53 WeakPolarHBondContact O-CG 3.16Å; V49-L53 PolarHBondContact O-N 3.19Å; V49-V67 HydrophobicContact CG2-CG1 4.39Å; V49-A70 HydrophobicContact CG2-CB 3.86Å; V49-V71 HydrophobicContact CG2-CG2 3.92Å; V49-L74 HydrophobicContact CG2-CD1 4.48Å |
| 50 | L | 91.6 | Very high | 87.8 | Confident | 93 Ų | 93 | 49.5 Ų | 49.5 | 49% | 0.487 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -62.5 | -44 | -177.3 | -70.2 | 171.5 | 0 | 0 | 0 | 112.8 | A46 N52 L53 H54 L310 | A46-L50 WeakPolarHBondContact O-CB 3.3Å; A46-L50 VanDerWaalsContact O-CG 3.24Å; A46-L50 WeakPolarHBondContact O-CG 3.26Å; A46-L50 PolarHBondContact O-N 2.92Å; L50-N52 VanDerWaalsContact C-N 3.31Å; L50-N52 PolarHBondContact O-N 3.31Å; L50-L53 PolarHBondContact O-N 2.71Å; L50-H54 VanDerWaalsContact O-CB 3.27Å; L50-H54 WeakPolarHBondContact O-CB 3.21Å; L50-H54 PolarHBondContact O-N 3.2Å; L50-L310 HydrophobicContact CB-CD1 4.49Å; L50-L310 HydrophobicContact CB-CD2 3.74Å |
| 51 | A | 89 | Confident | 87.4 | Confident | 0 Ų | 0 | 47.7 Ų | 47.7 | 0% | 0 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -64 | -37.3 | -178.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | L47 V49 S55 F303 K306 L310 | L47-A51 WeakPolarHBondContact O-CB 3.26Å; L47-A51 PolarHBondContact O-N 3.14Å; V49-A51 PolarHBondContact O-N 3.14Å; A51-S55 PolarHBondContact O-N 3.42Å; A51-S55 PolarHBondContact O-OG 3.17Å; A51-F303 HydrophobicContact CB-CE2 3.96Å; A51-K306 HydrophobicContact CB-CB 4.29Å; A51-L310 HydrophobicContact CB-CD2 4.34Å |
| 52 | N | 88.6 | Confident | 87.2 | Confident | 0 Ų | 0 | 48.9 Ų | 48.9 | 0% | 0 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -76.8 | -40.9 | 177 | -79.9 | -60.4 | 0 | 0 | 0 | 112.4 | L48 V49 L50 H54 S55 K56 M59 V67 Y296 K306 | L48-N52 WeakPolarHBondContact O-CB 3.45Å; L48-N52 PolarHBondContact O-N 3.46Å; L48-N52 PolarHBondContact O-ND2 3.21Å; V49-N52 PolarHBondContact O-N 3.34Å; L50-N52 VanDerWaalsContact C-N 3.31Å; L50-N52 PolarHBondContact O-N 3.31Å; N52-H54 PolarHBondContact O-N 3.35Å; N52-S55 CarbonylContact O-C 3.22Å; N52-S55 PolarHBondContact O-N 3.38Å; N52-S55 VanDerWaalsContact O-N 3.13Å; N52-K56 PolarHBondContact O-N 3.08Å; N52-M59 HydrophobicContact CB-CE 3.9Å; N52-M59 HydrophobicContact CB-CG 4.35Å; N52-M59 HydrophobicContact CB-SD 4.09Å; N52-V67 HydrophobicContact CB-CG2 3.56Å; N52-Y296 PolarHBondContact ND2-OH 3.44Å; N52-Y296 PolarHBondContact OD1-OH 3.26Å; N52-K306 PolarHBondContact OD1-NZ 3.24Å |
| 53 | L | 87.3 | Confident | 87 | Confident | 83 Ų | 83 | 46 Ų | 46 | 44% | 0.435 | 26% | 0.264 | S | S | . | . | H | α-helix | trans | -66.9 | -24.3 | 174 | -69.1 | -179.5 | 0 | 0 | 0 | 113.2 | V49 L50 K56 | V49-L53 HydrophobicContact CG1-CD1 3.61Å; V49-L53 HydrophobicContact CG1-CG 4.2Å; V49-L53 WeakPolarHBondContact O-CB 3.49Å; V49-L53 VanDerWaalsContact O-CG 3.27Å; V49-L53 WeakPolarHBondContact O-CG 3.16Å; V49-L53 PolarHBondContact O-N 3.19Å; L50-L53 PolarHBondContact O-N 2.71Å; L53-K56 WeakPolarHBondContact O-CE 3.43Å; L53-K56 VanDerWaalsContact O-CG 3.24Å; L53-K56 WeakPolarHBondContact O-CG 3.37Å |
| 54 | H | 85.4 | Confident | 86.8 | Confident | 70 Ų | 70 | 43.2 Ų | 43.2 | 32% | 0.324 | 24% | 0.244 | S | C | . | . | H | α-helix | trans | -78.8 | -31.6 | 171.9 | -178.8 | -106.1 | 0 | 0 | 0 | 112 | L50 N52 L310 K313 | L50-H54 VanDerWaalsContact O-CB 3.27Å; L50-H54 WeakPolarHBondContact O-CB 3.21Å; L50-H54 PolarHBondContact O-N 3.2Å; N52-H54 PolarHBondContact O-N 3.35Å; H54-L310 HydrophobicContact CB-CD1 4.22Å; H54-K313 WeakPolarHBondContact NE2-CD 3.07Å; H54-K313 PolarHBondContact NE2-NZ 2.88Å; H54-K313 VanDerWaalsContact NE2-NZ 3.12Å |
| 55 | S | 83.9 | Confident | 86.8 | Confident | 11 Ų | 11 | 37.8 Ų | 37.8 | 8% | 0.077 | 22% | 0.223 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -105.3 | 42.2 | 178.4 | -52.8 | 0 | 0 | 0 | 0 | 112.4 | A51 N52 A57 S58 M59 | A51-S55 PolarHBondContact O-N 3.42Å; A51-S55 PolarHBondContact O-OG 3.17Å; N52-S55 CarbonylContact O-C 3.22Å; N52-S55 PolarHBondContact O-N 3.38Å; N52-S55 VanDerWaalsContact O-N 3.13Å; S55-A57 PolarHBondContact O-N 3.06Å; S55-A57 VanDerWaalsContact O-N 3.1Å; S55-S58 PolarHBondContact O-N 3.07Å; S55-S58 PolarHBondContact O-OG 3.39Å; S55-M59 PolarHBondContact O-N 3.49Å |
| 56 | K | 79.9 | Confident | 86.6 | Confident | 119 Ų | 119 | 37.8 Ų | 37.8 | 52% | 0.517 | 22% | 0.223 | S | C | . | . | G | 310 helix | trans | -53.9 | -34.4 | -174 | -74.2 | 174.6 | -169.3 | -176.3 | 0 | 114.2 | N52 L53 S58 M59 | N52-K56 PolarHBondContact O-N 3.08Å; L53-K56 WeakPolarHBondContact O-CE 3.43Å; L53-K56 VanDerWaalsContact O-CG 3.24Å; L53-K56 WeakPolarHBondContact O-CG 3.37Å; K56-S58 VanDerWaalsContact C-N 3.28Å; K56-S58 PolarHBondContact O-N 2.84Å; K56-M59 PolarHBondContact O-N 3.4Å |
| 57 | A | 75.2 | Confident | 86.6 | Confident | 114 Ų | 114 | 37.1 Ų | 37.1 | 94% | 0.942 | 22% | 0.216 | S | C | * | . | G | 310 helix | trans | -71.3 | -20.2 | -178.3 | 0 | 0 | 0 | 0 | 0 | 113.5 | S55 | S55-A57 PolarHBondContact O-N 3.06Å; S55-A57 VanDerWaalsContact O-N 3.1Å |
| 58 | S | 77 | Confident | 86.7 | Confident | 61 Ų | 61 | 35.2 Ų | 35.2 | 43% | 0.427 | 21% | 0.206 | S | C | . | . | G | 310 helix | trans | -112 | 19.6 | 177.1 | 61 | 0 | 0 | 0 | 0 | 113 | S55 K56 | S55-S58 PolarHBondContact O-N 3.07Å; S55-S58 PolarHBondContact O-OG 3.39Å; K56-S58 VanDerWaalsContact C-N 3.28Å; K56-S58 PolarHBondContact O-N 2.84Å |
| 59 | M | 80.3 | Confident | 86.8 | Confident | 18 Ų | 18 | 35.4 Ų | 35.4 | 9% | 0.089 | 21% | 0.207 | C | C | . | . | trans | -73.6 | 130.5 | 171.7 | -76.3 | -172.8 | 79 | 0 | 0 | 110.1 | N52 S55 K56 D63 V64 V67 V141 | N52-M59 HydrophobicContact CB-CE 3.9Å; N52-M59 HydrophobicContact CB-CG 4.35Å; N52-M59 HydrophobicContact CB-SD 4.09Å; S55-M59 PolarHBondContact O-N 3.49Å; K56-M59 PolarHBondContact O-N 3.4Å; M59-D63 HydrophobicContact CB-CB 4.35Å; M59-D63 HydrophobicContact CE-CB 3.82Å; M59-D63 HydrophobicContact CG-CB 4.36Å; M59-V64 HydrophobicContact CE-CB 4.44Å; M59-V64 HydrophobicContact CE-CG2 3.85Å; M59-V67 HydrophobicContact CE-CG2 3.87Å; M59-V141 WeakPolarHBondContact O-CG2 3.41Å | ||
| 60 | T | 82.4 | Confident | 86.9 | Confident | 70 Ų | 70 | 34.5 Ų | 34.5 | 43% | 0.429 | 20% | 0.201 | S | C | . | . | trans | -91.5 | 167.5 | 168.2 | 61.1 | 0 | 0 | 0 | 0 | 109.9 | D63 V64 | T60-D63 PolarHBondContact N-OD2 3Å; T60-D63 WeakPolarHBondContact O-CB 3.19Å; T60-D63 PolarHBondContact O-N 2.91Å; T60-D63 PolarHBondContact OG1-OD1 3.33Å; T60-D63 PolarHBondContact OG1-OD2 3.26Å; T60-V64 PolarHBondContact O-N 3.37Å | ||
| 61 | M | 81.8 | Confident | 87 | Confident | 13 Ų | 13 | 32.5 Ų | 32.5 | 6% | 0.064 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -57.6 | -45.3 | 176.8 | -66.2 | -174.9 | 91.9 | 0 | 0 | 113.3 | D63 V64 Y65 D126 A139 V141 T144 | M61-D63 PolarHBondContact O-N 3.48Å; M61-V64 WeakPolarHBondContact O-CB 3.37Å; M61-V64 PolarHBondContact O-N 2.86Å; M61-Y65 PolarHBondContact O-N 3.47Å; M61-D126 HydrophobicContact CE-CB 4.16Å; M61-D126 WeakPolarHBondContact CE-OD2 3.28Å; M61-D126 HydrophobicContact SD-CB 4.5Å; M61-A139 HydrophobicContact CE-CB 4.26Å; M61-A139 WeakPolarHBondContact SD-CA 3.18Å; M61-A139 HydrophobicContact SD-CB 3.49Å; M61-A139 WeakPolarHBondContact SD-CB 3.42Å; M61-V141 HydrophobicContact CG-CG2 4.35Å; M61-T144 HydrophobicContact CE-CG2 4.43Å; M61-T144 WeakPolarHBondContact CE-OG1 3.48Å |
| 62 | P | 84.9 | Confident | 87.3 | Confident | 25 Ų | 25 | 32.6 Ų | 32.6 | 16% | 0.162 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -57.8 | -35.3 | 176.6 | -25 | 35.2 | 0 | 0 | 0 | 112.7 | V64 Y65 F66 L123 M299 | P62-V64 VanDerWaalsContact C-N 3.25Å; P62-V64 PolarHBondContact O-N 2.71Å; P62-Y65 PolarHBondContact O-N 2.99Å; P62-F66 WeakPolarHBondContact O-CD2 3.44Å; P62-F66 PolarHBondContact O-N 3.38Å; P62-L123 HydrophobicContact CB-CD1 3.81Å; P62-L123 HydrophobicContact CG-CD1 4.24Å; P62-M299 HydrophobicContact CB-CE 3.55Å |
| 63 | D | 88.5 | Confident | 87.6 | Confident | 1 Ų | 1 | 32.7 Ų | 32.7 | 1% | 0.005 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -60.5 | -35.2 | 177 | -59.1 | -33.3 | 0 | 0 | 0 | 112.3 | M59 T60 M61 V67 Y296 N300 K306 | M59-D63 HydrophobicContact CB-CB 4.35Å; M59-D63 HydrophobicContact CE-CB 3.82Å; M59-D63 HydrophobicContact CG-CB 4.36Å; T60-D63 PolarHBondContact N-OD2 3Å; T60-D63 WeakPolarHBondContact O-CB 3.19Å; T60-D63 PolarHBondContact O-N 2.91Å; T60-D63 PolarHBondContact OG1-OD1 3.33Å; T60-D63 PolarHBondContact OG1-OD2 3.26Å; M61-D63 PolarHBondContact O-N 3.48Å; D63-V67 WeakPolarHBondContact O-CB 3.45Å; D63-V67 VanDerWaalsContact O-CG2 3.23Å; D63-V67 WeakPolarHBondContact O-CG2 3.47Å; D63-V67 PolarHBondContact O-N 2.91Å; D63-Y296 VanDerWaalsContact OD1-CE2 3.27Å; D63-Y296 WeakPolarHBondContact OD1-CE2 3.23Å; D63-Y296 PolarHBondContact OD1-OH 3.21Å; D63-N300 PolarHBondContact OD1-ND2 2.9Å; D63-K306 IonicContact OD1-NZ 3.54Å; D63-K306 IonicContact OD2-NZ 2.66Å; D63-K306 PolarHBondContact OD2-NZ 3.27Å |
| 64 | V | 89.8 | Confident | 87.9 | Confident | 11 Ų | 11 | 30.8 Ų | 30.8 | 7% | 0.067 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -67.8 | -45.2 | 178.2 | -179 | 0 | 0 | 0 | 0 | 110.7 | M59 T60 M61 P62 V67 N68 V141 T144 R145 | M59-V64 HydrophobicContact CE-CB 4.44Å; M59-V64 HydrophobicContact CE-CG2 3.85Å; T60-V64 PolarHBondContact O-N 3.37Å; M61-V64 WeakPolarHBondContact O-CB 3.37Å; M61-V64 PolarHBondContact O-N 2.86Å; P62-V64 VanDerWaalsContact C-N 3.25Å; P62-V64 PolarHBondContact O-N 2.71Å; V64-V67 PolarHBondContact O-N 2.94Å; V64-N68 PolarHBondContact O-N 3.33Å; V64-V141 HydrophobicContact CG2-CG1 3.95Å; V64-T144 HydrophobicContact CB-CG2 3.76Å; V64-T144 HydrophobicContact CG1-CG2 3.69Å; V64-T144 HydrophobicContact CG2-CG2 4.48Å; V64-R145 HydrophobicContact CG1-CG 4.09Å; V64-R145 HydrophobicContact CG2-CG 4.46Å |
| 65 | Y | 91.1 | Very high | 88.3 | Confident | 1 Ų | 1 | 29.3 Ų | 29.3 | 0% | 0.004 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -63.9 | -40.5 | 176.6 | -72.5 | -61.4 | 0 | 0 | 0 | 112.3 | M61 P62 N68 M69 L122 L123 D126 T144 | M61-Y65 PolarHBondContact O-N 3.47Å; P62-Y65 PolarHBondContact O-N 2.99Å; Y65-N68 VanDerWaalsContact O-CB 3.31Å; Y65-N68 WeakPolarHBondContact O-CB 3.36Å; Y65-N68 PolarHBondContact O-N 3.03Å; Y65-N68 VanDerWaalsContact O-N 3.16Å; Y65-M69 WeakPolarHBondContact O-CG 3.45Å; Y65-M69 PolarHBondContact O-N 3.39Å; Y65-L122 HydrophobicContact CD1-CB 4.35Å; Y65-L122 HydrophobicContact CE1-CB 3.48Å; Y65-L122 VanDerWaalsContact CE1-CB 3.48Å; Y65-L122 HydrophobicContact CE1-CD1 4.07Å; Y65-L122 HydrophobicContact CE1-CG 4.44Å; Y65-L123 HydrophobicContact CD2-CB 4Å; Y65-L123 HydrophobicContact CD2-CD1 3.98Å; Y65-L123 HydrophobicContact CG-CB 4.08Å; Y65-L123 HydrophobicContact CG-CD1 4.49Å; Y65-D126 HydrophobicContact CE2-CB 4.24Å; Y65-D126 WeakPolarHBondContact CE2-OD2 3.33Å; Y65-D126 PolarHBondContact OH-OD2 2.94Å; Y65-T144 HydrophobicContact CD1-CG2 4.41Å; Y65-T144 HydrophobicContact CD2-CG2 3.94Å; Y65-T144 HydrophobicContact CE1-CG2 3.95Å; Y65-T144 HydrophobicContact CE2-CG2 3.43Å; Y65-T144 VanDerWaalsContact CE2-CG2 3.43Å; Y65-T144 HydrophobicContact CG-CG2 4.39Å; Y65-T144 VanDerWaalsContact CZ-CG2 3.42Å |
| 66 | F | 91.7 | Very high | 88.8 | Confident | 0 Ų | 0 | 28.8 Ų | 28.8 | 0% | 0 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -68.1 | -35.7 | 175.8 | -87.9 | -85.5 | 0 | 0 | 0 | 113.2 | L48 P62 N68 M69 A70 L123 T238 T292 L295 Y296 M299 | L48-F66 HydrophobicContact CD2-CB 4.43Å; P62-F66 WeakPolarHBondContact O-CD2 3.44Å; P62-F66 PolarHBondContact O-N 3.38Å; F66-N68 VanDerWaalsContact C-N 3.29Å; F66-M69 HydrophobicContact CB-CE 4.32Å; F66-M69 HydrophobicContact CD1-CE 3.64Å; F66-M69 HydrophobicContact CD2-CE 3.79Å; F66-M69 HydrophobicContact CE1-CE 3.84Å; F66-M69 HydrophobicContact CE2-CE 3.9Å; F66-M69 HydrophobicContact CG-CE 3.67Å; F66-M69 HydrophobicContact CZ-CE 3.99Å; F66-A70 WeakPolarHBondContact O-CB 3.4Å; F66-A70 PolarHBondContact O-N 3.16Å; F66-L123 HydrophobicContact CD2-CD2 4.42Å; F66-L123 HydrophobicContact CE2-CD2 3.7Å; F66-L123 HydrophobicContact CZ-CD2 4.42Å; F66-T238 HydrophobicContact CE1-CG2 4.42Å; F66-T238 HydrophobicContact CZ-CG2 3.77Å; F66-T292 HydrophobicContact CD1-CG2 4.08Å; F66-T292 HydrophobicContact CE1-CG2 4.44Å; F66-L295 HydrophobicContact CE1-CB 4.05Å; F66-L295 HydrophobicContact CZ-CB 4.4Å; F66-Y296 HydrophobicContact CB-CD2 3.53Å; F66-Y296 HydrophobicContact CB-CE2 4.01Å; F66-Y296 HydrophobicContact CB-CG 4.12Å; F66-Y296 VanDerWaalsContact CD1-CB 3.44Å; F66-Y296 AromaticContact CD1-CD2 3.81Å; F66-Y296 HydrophobicContact CD1-CD2 3.81Å; F66-Y296 AromaticContact CD1-CG 3.97Å; F66-Y296 HydrophobicContact CD1-CG 3.97Å; F66-Y296 AromaticContact CD2-CD2 3.9Å; F66-Y296 HydrophobicContact CD2-CD2 3.9Å; F66-Y296 HydrophobicContact CE1-CD2 4.45Å; F66-Y296 AromaticContact CG-CD2 3.44Å; F66-Y296 HydrophobicContact CG-CD2 3.44Å; F66-Y296 VanDerWaalsContact CG-CD2 3.44Å; F66-Y296 HydrophobicContact CG-CE2 4.28Å; F66-Y296 HydrophobicContact CG-CG 4.05Å; F66-M299 HydrophobicContact CD2-CE 3.3Å; F66-M299 HydrophobicContact CD2-SD 4.34Å; F66-M299 HydrophobicContact CE2-CE 2.96Å; F66-M299 HydrophobicContact CE2-SD 3.42Å; F66-M299 WeakPolarHBondContact CE2-SD 3.39Å; F66-M299 HydrophobicContact CG-CE 4.37Å; F66-M299 HydrophobicContact CZ-CE 3.79Å; F66-M299 HydrophobicContact CZ-SD 3.9Å |
| 67 | V | 92.9 | Very high | 89.3 | Confident | 20 Ų | 20 | 23.3 Ų | 23.3 | 12% | 0.121 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -61.7 | -41.4 | 169.2 | 167.1 | 0 | 0 | 0 | 0 | 110.4 | L48 V49 N52 M59 D63 V64 A70 V71 | L48-V67 HydrophobicContact CD2-CB 4.46Å; L48-V67 HydrophobicContact CD2-CG2 3.83Å; V49-V67 HydrophobicContact CG2-CG1 4.39Å; N52-V67 HydrophobicContact CB-CG2 3.56Å; M59-V67 HydrophobicContact CE-CG2 3.87Å; D63-V67 WeakPolarHBondContact O-CB 3.45Å; D63-V67 VanDerWaalsContact O-CG2 3.23Å; D63-V67 WeakPolarHBondContact O-CG2 3.47Å; D63-V67 PolarHBondContact O-N 2.91Å; V64-V67 PolarHBondContact O-N 2.94Å; V67-A70 PolarHBondContact O-N 3.2Å; V67-V71 WeakPolarHBondContact O-CG2 3.15Å; V67-V71 PolarHBondContact O-N 2.9Å |
| 68 | N | 93.7 | Very high | 90.1 | Very high | 12 Ų | 12 | 22 Ų | 22 | 6% | 0.064 | 13% | 0.134 | C | C | . | . | H | α-helix | trans | -62.2 | -48.8 | 178.5 | -152.6 | 42.3 | 0 | 0 | 0 | 112.3 | V64 Y65 F66 A70 V71 A72 V115 S119 W152 | V64-N68 PolarHBondContact O-N 3.33Å; Y65-N68 VanDerWaalsContact O-CB 3.31Å; Y65-N68 WeakPolarHBondContact O-CB 3.36Å; Y65-N68 PolarHBondContact O-N 3.03Å; Y65-N68 VanDerWaalsContact O-N 3.16Å; F66-N68 VanDerWaalsContact C-N 3.29Å; N68-A70 VanDerWaalsContact C-N 3.3Å; N68-A70 PolarHBondContact O-N 3.41Å; N68-V71 PolarHBondContact O-N 2.97Å; N68-A72 PolarHBondContact O-N 3.49Å; N68-A72 VanDerWaalsContact O-N 3.14Å; N68-V115 WeakPolarHBondContact ND2-CG1 3.32Å; N68-S119 PolarHBondContact ND2-OG 2.75Å; N68-W152 PolarHBondContact OD1-NE1 3.37Å |
| 69 | M | 93.9 | Very high | 90.6 | Very high | 3 Ų | 3 | 19.7 Ų | 19.7 | 2% | 0.015 | 12% | 0.116 | C | C | . | . | H | α-helix | trans | -62.7 | -36 | 174.8 | -66.7 | -176.8 | -73.3 | 0 | 0 | 111.9 | Y65 F66 A72 G73 T120 L123 T292 | Y65-M69 WeakPolarHBondContact O-CG 3.45Å; Y65-M69 PolarHBondContact O-N 3.39Å; F66-M69 HydrophobicContact CB-CE 4.32Å; F66-M69 HydrophobicContact CD1-CE 3.64Å; F66-M69 HydrophobicContact CD2-CE 3.79Å; F66-M69 HydrophobicContact CE1-CE 3.84Å; F66-M69 HydrophobicContact CE2-CE 3.9Å; F66-M69 HydrophobicContact CG-CE 3.67Å; F66-M69 HydrophobicContact CZ-CE 3.99Å; M69-A72 PolarHBondContact O-N 3.48Å; M69-G73 PolarHBondContact O-N 3.19Å; M69-T120 PolarHBondContact SD-OG1 3.29Å; M69-L123 HydrophobicContact CE-CD2 4.44Å; M69-T292 HydrophobicContact CB-CG2 3.67Å |
| 70 | A | 94.9 | Very high | 90.9 | Very high | 0 Ų | 0 | 19 Ų | 19 | 0% | 0 | 11% | 0.113 | C | C | . | . | H | α-helix | trans | -69.8 | -36.3 | 177.8 | 0 | 0 | 0 | 0 | 0 | 113 | N45 L48 V49 F66 V67 N68 G73 L74 | N45-A70 HydrophobicContact CB-CB 4.05Å; N45-A70 WeakPolarHBondContact OD1-CA 3.26Å; N45-A70 VanDerWaalsContact OD1-CB 3.31Å; N45-A70 WeakPolarHBondContact OD1-CB 3.5Å; L48-A70 HydrophobicContact CB-CB 4.38Å; L48-A70 HydrophobicContact CD1-CB 4.2Å; L48-A70 HydrophobicContact CD2-CB 3.73Å; L48-A70 HydrophobicContact CG-CB 4.32Å; V49-A70 HydrophobicContact CG2-CB 3.86Å; F66-A70 WeakPolarHBondContact O-CB 3.4Å; F66-A70 PolarHBondContact O-N 3.16Å; V67-A70 PolarHBondContact O-N 3.2Å; N68-A70 VanDerWaalsContact C-N 3.3Å; N68-A70 PolarHBondContact O-N 3.41Å; A70-G73 PolarHBondContact O-N 2.84Å; A70-L74 WeakPolarHBondContact O-CG 3.44Å; A70-L74 PolarHBondContact O-N 2.78Å |
| 71 | V | 95.3 | Very high | 91 | Very high | 51 Ų | 51 | 17.7 Ų | 17.7 | 31% | 0.309 | 11% | 0.106 | S | C | . | . | H | α-helix | trans | -63.4 | -43.8 | 172.3 | 174.1 | 0 | 0 | 0 | 0 | 110.4 | V49 V67 N68 G73 L74 V75 W152 | V49-V71 HydrophobicContact CG2-CG2 3.92Å; V67-V71 WeakPolarHBondContact O-CG2 3.15Å; V67-V71 PolarHBondContact O-N 2.9Å; N68-V71 PolarHBondContact O-N 2.97Å; V71-G73 VanDerWaalsContact C-N 3.32Å; V71-G73 PolarHBondContact O-N 2.95Å; V71-L74 WeakPolarHBondContact O-CB 3.33Å; V71-L74 PolarHBondContact O-N 3.22Å; V71-V75 PolarHBondContact O-N 3.49Å; V71-W152 HydrophobicContact CB-CZ2 4.16Å; V71-W152 HydrophobicContact CG1-CH2 4.06Å; V71-W152 HydrophobicContact CG1-CZ2 3.64Å |
| 72 | A | 94.7 | Very high | 91 | Very high | 1 Ų | 1 | 18.8 Ų | 18.8 | 1% | 0.008 | 11% | 0.114 | C | C | . | . | H | α-helix | trans | -60.8 | -40.9 | 171.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | N68 M69 L74 V75 L76 V115 | N68-A72 PolarHBondContact O-N 3.49Å; N68-A72 VanDerWaalsContact O-N 3.14Å; M69-A72 PolarHBondContact O-N 3.48Å; A72-L74 PolarHBondContact O-N 2.99Å; A72-V75 PolarHBondContact O-N 2.97Å; A72-L76 WeakPolarHBondContact O-CG 3.49Å; A72-L76 PolarHBondContact O-N 2.94Å; A72-V115 HydrophobicContact CB-CB 4.21Å; A72-V115 HydrophobicContact CB-CG1 3.94Å |
| 73 | G | 94.2 | Very high | 90.7 | Very high | 2 Ų | 2 | 18.3 Ų | 18.3 | 2% | 0.021 | 11% | 0.109 | C | C | . | . | H | α-helix | trans | -60.7 | -38.6 | 174.4 | 0 | 0 | 0 | 0 | 0 | 113.6 | M69 A70 V71 L76 S77 S289 | M69-G73 PolarHBondContact O-N 3.19Å; A70-G73 PolarHBondContact O-N 2.84Å; V71-G73 VanDerWaalsContact C-N 3.32Å; V71-G73 PolarHBondContact O-N 2.95Å; G73-L76 PolarHBondContact O-N 3.46Å; G73-S77 WeakPolarHBondContact O-CB 3.37Å; G73-S77 PolarHBondContact O-N 3.5Å; G73-S77 PolarHBondContact O-OG 3.31Å; G73-S289 PolarHBondContact O-OG 3.26Å |
| 74 | L | 94.8 | Very high | 90.1 | Very high | 43 Ų | 43 | 18.6 Ų | 18.6 | 23% | 0.225 | 11% | 0.111 | C | C | . | . | H | α-helix | trans | -60.9 | -47 | 173.4 | -72.7 | 173.6 | 0 | 0 | 0 | 111.2 | L42 N45 A46 V49 A70 V71 A72 L76 S77 T78 | L42-L74 HydrophobicContact CD2-CD2 4.05Å; L42-L74 WeakPolarHBondContact O-CD2 3.33Å; N45-L74 HydrophobicContact CB-CD2 3.75Å; N45-L74 HydrophobicContact CB-CG 3.78Å; A46-L74 HydrophobicContact CB-CD2 4.25Å; V49-L74 HydrophobicContact CG2-CD1 4.48Å; A70-L74 WeakPolarHBondContact O-CG 3.44Å; A70-L74 PolarHBondContact O-N 2.78Å; V71-L74 WeakPolarHBondContact O-CB 3.33Å; V71-L74 PolarHBondContact O-N 3.22Å; A72-L74 PolarHBondContact O-N 2.99Å; L74-L76 VanDerWaalsContact C-N 3.35Å; L74-L76 PolarHBondContact O-N 2.89Å; L74-S77 PolarHBondContact O-N 3.32Å; L74-T78 WeakPolarHBondContact O-CG2 3.45Å; L74-T78 PolarHBondContact O-N 3.41Å |
| 75 | V | 94.1 | Very high | 89.2 | Confident | 39 Ų | 39 | 21.7 Ų | 21.7 | 24% | 0.236 | 13% | 0.127 | C | C | . | . | H | α-helix | trans | -60.8 | -44.1 | 176.2 | 176.7 | 0 | 0 | 0 | 0 | 110.8 | V71 A72 S77 T78 L79 P108 S112 | V71-V75 PolarHBondContact O-N 3.49Å; A72-V75 PolarHBondContact O-N 2.97Å; V75-S77 VanDerWaalsContact C-N 3.3Å; V75-S77 PolarHBondContact O-N 3.06Å; V75-T78 PolarHBondContact O-N 3.14Å; V75-T78 PolarHBondContact O-OG1 3.32Å; V75-L79 HydrophobicContact CG1-CD1 3.87Å; V75-L79 HydrophobicContact CG1-CG 4.43Å; V75-L79 WeakPolarHBondContact O-CB 3.33Å; V75-L79 WeakPolarHBondContact O-CG 3.42Å; V75-L79 PolarHBondContact O-N 3.12Å; V75-P108 HydrophobicContact CG1-CB 3.74Å; V75-S112 WeakPolarHBondContact CB-OG 3.37Å; V75-S112 VanDerWaalsContact CG1-OG 3.25Å; V75-S112 WeakPolarHBondContact CG1-OG 3.33Å |
| 76 | L | 92.6 | Very high | 87.7 | Confident | 1 Ų | 1 | 21.9 Ų | 21.9 | 1% | 0.005 | 13% | 0.129 | C | C | . | . | H | α-helix | trans | -63.1 | -36.9 | 176.2 | -69.9 | 169 | 0 | 0 | 0 | 112.5 | A72 G73 L74 L79 A80 F109 W246 F286 | A72-L76 WeakPolarHBondContact O-CG 3.49Å; A72-L76 PolarHBondContact O-N 2.94Å; G73-L76 PolarHBondContact O-N 3.46Å; L74-L76 VanDerWaalsContact C-N 3.35Å; L74-L76 PolarHBondContact O-N 2.89Å; L76-L79 PolarHBondContact O-N 3.05Å; L76-A80 WeakPolarHBondContact O-CB 3.21Å; L76-A80 PolarHBondContact O-N 3.14Å; L76-F109 HydrophobicContact CD2-CD2 3.82Å; L76-F109 HydrophobicContact CD2-CE2 4.15Å; L76-W246 HydrophobicContact CD1-CH2 3.73Å; L76-W246 HydrophobicContact CD1-CZ2 3.54Å; L76-W246 HydrophobicContact CD2-CH2 3.98Å; L76-F286 HydrophobicContact CB-CD1 4.16Å; L76-F286 HydrophobicContact CB-CE1 4.45Å; L76-F286 HydrophobicContact CD2-CD1 4.35Å; L76-F286 HydrophobicContact CD2-CE1 4.15Å; L76-F286 WeakPolarHBondContact O-CD1 3.44Å; L76-F286 VanDerWaalsContact O-CE1 3.32Å; L76-F286 WeakPolarHBondContact O-CE1 3.13Å |
| 77 | S | 92.4 | Very high | 85.7 | Confident | 3 Ų | 3 | 25.8 Ų | 25.8 | 2% | 0.021 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -69.6 | -33.7 | 179.2 | -50.3 | 0 | 0 | 0 | 0 | 112.3 | V38 G73 L74 V75 P81 S289 | V38-S77 WeakPolarHBondContact CG1-O 3.35Å; G73-S77 WeakPolarHBondContact O-CB 3.37Å; G73-S77 PolarHBondContact O-N 3.5Å; G73-S77 PolarHBondContact O-OG 3.31Å; L74-S77 PolarHBondContact O-N 3.32Å; V75-S77 VanDerWaalsContact C-N 3.3Å; V75-S77 PolarHBondContact O-N 3.06Å; S77-P81 VanDerWaalsContact O-CD 3.3Å; S77-P81 WeakPolarHBondContact O-CD 3.37Å; S77-S289 PolarHBondContact OG-OG 3.43Å |
| 78 | T | 90.1 | Very high | 83.4 | Confident | 88 Ų | 88 | 26.3 Ų | 26.3 | 54% | 0.54 | 16% | 0.158 | S | C | . | . | H | α-helix | trans | -74.8 | -29.2 | 174.3 | 59 | 0 | 0 | 0 | 0 | 112.4 | L42 L74 V75 | L42-T78 HydrophobicContact CD2-CG2 4.05Å; L74-T78 WeakPolarHBondContact O-CG2 3.45Å; L74-T78 PolarHBondContact O-N 3.41Å; V75-T78 PolarHBondContact O-N 3.14Å; V75-T78 PolarHBondContact O-OG1 3.32Å |
| 79 | L | 88.9 | Confident | 80.9 | Confident | 11 Ų | 11 | 30.1 Ų | 30.1 | 6% | 0.058 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -78.4 | -33.5 | 176 | -69.8 | 173.9 | 0 | 0 | 0 | 113 | V75 L76 P81 V82 H83 L105 P108 F109 F286 | V75-L79 HydrophobicContact CG1-CD1 3.87Å; V75-L79 HydrophobicContact CG1-CG 4.43Å; V75-L79 WeakPolarHBondContact O-CB 3.33Å; V75-L79 WeakPolarHBondContact O-CG 3.42Å; V75-L79 PolarHBondContact O-N 3.12Å; L76-L79 PolarHBondContact O-N 3.05Å; L79-P81 VanDerWaalsContact C-N 3.35Å; L79-V82 PolarHBondContact O-N 3.48Å; L79-H83 PolarHBondContact O-CD2 2.9Å; L79-H83 VanDerWaalsContact O-CD2 3.28Å; L79-H83 PolarHBondContact O-N 2.95Å; L79-L105 HydrophobicContact CD2-CD2 3.74Å; L79-P108 HydrophobicContact CD1-CB 3.93Å; L79-P108 HydrophobicContact CD1-CG 3.82Å; L79-P108 HydrophobicContact CD2-CG 3.86Å; L79-P108 HydrophobicContact CG-CG 4.4Å; L79-F109 HydrophobicContact CD1-CB 4.06Å; L79-F286 HydrophobicContact CB-CE1 4.18Å |
| 80 | A | 86.5 | Confident | 78.5 | Confident | 3 Ų | 3 | 35.6 Ų | 35.6 | 3% | 0.025 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -47.9 | -45.7 | -175.7 | 0 | 0 | 0 | 0 | 0 | 114.2 | V38 L76 V82 H83 L84 F286 | V38-A80 HydrophobicContact CG2-CB 3.54Å; L76-A80 WeakPolarHBondContact O-CB 3.21Å; L76-A80 PolarHBondContact O-N 3.14Å; A80-V82 VanDerWaalsContact C-N 3.32Å; A80-V82 PolarHBondContact O-N 3Å; A80-H83 PolarHBondContact O-N 3.44Å; A80-L84 HydrophobicContact CB-CD1 4.13Å; A80-L84 WeakPolarHBondContact O-CB 3.36Å; A80-L84 WeakPolarHBondContact O-CG 3.33Å; A80-L84 PolarHBondContact O-N 3.39Å; A80-F286 HydrophobicContact CB-CD1 3.7Å; A80-F286 HydrophobicContact CB-CE1 3.99Å; A80-F286 HydrophobicContact CB-CG 4.08Å |
| 81 | P | 84 | Confident | 76 | Confident | 43 Ų | 43 | 43.7 Ų | 43.7 | 28% | 0.279 | 26% | 0.262 | S | S | . | . | H | α-helix | trans | -58.7 | -40.8 | 177.8 | -25.3 | 34.4 | 0 | 0 | 0 | 114.1 | L34 V38 S77 L79 L85 | L34-P81 HydrophobicContact CD1-CB 4.09Å; L34-P81 HydrophobicContact CD1-CG 4.41Å; V38-P81 HydrophobicContact CG1-CG 4.44Å; S77-P81 VanDerWaalsContact O-CD 3.3Å; S77-P81 WeakPolarHBondContact O-CD 3.37Å; L79-P81 VanDerWaalsContact C-N 3.35Å; P81-L85 VanDerWaalsContact O-CB 3.27Å; P81-L85 WeakPolarHBondContact O-CB 3.42Å; P81-L85 WeakPolarHBondContact O-CD1 3.43Å; P81-L85 VanDerWaalsContact O-CG 3.28Å; P81-L85 WeakPolarHBondContact O-CG 3.34Å; P81-L85 PolarHBondContact O-N 2.96Å |
| 82 | V | 81.6 | Confident | 73.7 | Confident | 36 Ų | 36 | 49.3 Ų | 49.3 | 22% | 0.218 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -73.3 | -39.8 | -179.2 | -171.8 | 0 | 0 | 0 | 0 | 110.7 | L79 A80 W95 L105 | L79-V82 PolarHBondContact O-N 3.48Å; A80-V82 VanDerWaalsContact C-N 3.32Å; A80-V82 PolarHBondContact O-N 3Å; V82-W95 HydrophobicContact CG1-CZ2 4.34Å; V82-W95 WeakPolarHBondContact O-CZ2 3.07Å; V82-L105 HydrophobicContact CB-CD1 4.48Å; V82-L105 HydrophobicContact CG1-CD1 3.56Å |
| 83 | H | 78.9 | Confident | 71.6 | Confident | 16 Ų | 16 | 52.8 Ų | 52.8 | 7% | 0.074 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -82.6 | -29.4 | -176.6 | -72.2 | -89 | 0 | 0 | 0 | 114.6 | L79 A80 F286 | L79-H83 PolarHBondContact O-CD2 2.9Å; L79-H83 VanDerWaalsContact O-CD2 3.28Å; L79-H83 PolarHBondContact O-N 2.95Å; A80-H83 PolarHBondContact O-N 3.44Å; H83-F286 HydrophobicContact CB-CE2 3.67Å; H83-F286 HydrophobicContact CB-CZ 3.52Å; H83-F286 AromaticContact CG-CZ 3.94Å |
| 84 | L | 76.1 | Confident | 69.4 | Low | 6 Ų | 6 | 56.7 Ų | 56.7 | 3% | 0.031 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -93.7 | -24.9 | -176.5 | -67.3 | 176.5 | 0 | 0 | 0 | 114.1 | W2 A80 G86 L283 F286 | W2-L84 WeakPolarHBondContact CZ2-O 3.42Å; A80-L84 HydrophobicContact CB-CD1 4.13Å; A80-L84 WeakPolarHBondContact O-CB 3.36Å; A80-L84 WeakPolarHBondContact O-CG 3.33Å; A80-L84 PolarHBondContact O-N 3.39Å; L84-G86 PolarHBondContact O-N 3.12Å; L84-L283 HydrophobicContact CD1-CD1 4.28Å; L84-L283 HydrophobicContact CD2-CB 4.4Å; L84-L283 HydrophobicContact CD2-CD1 4.19Å; L84-F286 HydrophobicContact CD1-CB 4.46Å; L84-F286 HydrophobicContact CD1-CD2 3.98Å; L84-F286 HydrophobicContact CD1-CG 4.34Å; L84-F286 HydrophobicContact CD2-CD2 3.77Å; L84-F286 HydrophobicContact CD2-CE2 4.13Å; L84-F286 HydrophobicContact CG-CD2 3.78Å; L84-F286 HydrophobicContact CG-CE2 4.04Å |
| 85 | L | 71.4 | Confident | 67.3 | Low | 77 Ų | 77 | 59 Ų | 59 | 40% | 0.403 | 33% | 0.332 | S | S | . | . | S | Bend | trans | -72.9 | -18.8 | 173.5 | -70 | 169.1 | 0 | 0 | 0 | 111.6 | M1 L34 P81 | M1-L85 PolarHBondContact N-O 2.99Å; L34-L85 HydrophobicContact CD1-CD1 4.08Å; L34-L85 HydrophobicContact CD1-CD2 4.16Å; L34-L85 HydrophobicContact CD1-CG 3.8Å; L34-L85 HydrophobicContact CD2-CD1 4.5Å; L34-L85 HydrophobicContact CD2-CD2 4.23Å; P81-L85 VanDerWaalsContact O-CB 3.27Å; P81-L85 WeakPolarHBondContact O-CB 3.42Å; P81-L85 WeakPolarHBondContact O-CD1 3.43Å; P81-L85 VanDerWaalsContact O-CG 3.28Å; P81-L85 WeakPolarHBondContact O-CG 3.34Å; P81-L85 PolarHBondContact O-N 2.96Å |
| 86 | G | 58.4 | Low | 65.2 | Low | 5 Ų | 5 | 61.8 Ų | 61.8 | 5% | 0.052 | 35% | 0.353 | C | S | . | . | trans | 53.2 | -177.6 | -171.9 | 0 | 0 | 0 | 0 | 0 | 111 | L84 P88 W95 | L84-G86 PolarHBondContact O-N 3.12Å; G86-P88 WeakPolarHBondContact O-CD 3.4Å; G86-P88 VanDerWaalsContact O-N 3.12Å; G86-W95 WeakPolarHBondContact O-CZ2 3.39Å | ||
| 87 | P | 50.4 | Low | 63.1 | Low | 82 Ų | 82 | 63.8 Ų | 63.8 | 53% | 0.532 | 37% | 0.37 | S | S | . | . | trans | -66.6 | 114.8 | 171.9 | -1.3 | 13.6 | 0 | 0 | 0 | 108.1 | M1 W95 | M1-P87 PolarHBondContact N-O 2.66Å; P87-W95 HydrophobicContact CB-CD2 4.14Å; P87-W95 HydrophobicContact CB-CE3 4Å; P87-W95 HydrophobicContact CB-CZ3 4.34Å; P87-W95 HydrophobicContact CG-CE3 3.95Å; P87-W95 HydrophobicContact CG-CH2 4.3Å; P87-W95 HydrophobicContact CG-CZ3 3.84Å | ||
| 88 | P | 43.6 | Very low | 61.3 | Low | 30 Ų | 30 | 66.3 Ų | 66.3 | 20% | 0.195 | 40% | 0.396 | C | S | . | . | trans | -95.4 | 99 | 166.8 | 16.6 | 6.4 | 0 | 0 | 0 | 104.7 | G86 S90 | G86-P88 WeakPolarHBondContact O-CD 3.4Å; G86-P88 VanDerWaalsContact O-N 3.12Å; P88-S90 PolarHBondContact O-N 3.12Å | ||
| 89 | S | 42.1 | Very low | 59.9 | Low | 92 Ų | 92 | 64.9 Ų | 64.9 | 64% | 0.643 | 40% | 0.399 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 41.5 | 73.5 | 162.5 | 55.1 | 0 | 0 | 0 | 0 | 114.7 | Q91 | S89-Q91 WeakPolarHBondContact O-CB 3.43Å; S89-Q91 WeakPolarHBondContact O-CG 3.05Å; S89-Q91 PolarHBondContact O-N 3.45Å |
| 90 | S | 42.8 | Very low | 58.8 | Low | 118 Ų | 118 | 72.3 Ų | 72.3 | 83% | 0.825 | 43% | 0.433 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 45.9 | 9.2 | 157.6 | 64.7 | 0 | 0 | 0 | 0 | 120.9 | P88 | P88-S90 PolarHBondContact O-N 3.12Š|
| 91 | Q | 42.8 | Very low | 57.9 | Low | 170 Ų | 170 | 74.3 Ų | 74.3 | 79% | 0.794 | 45% | 0.445 | S | S | * | . | trans | -110.5 | -4.8 | -169.8 | -72.4 | -171.2 | 11.5 | 0 | 0 | 114.2 | S89 | S89-Q91 WeakPolarHBondContact O-CB 3.43Å; S89-Q91 WeakPolarHBondContact O-CG 3.05Å; S89-Q91 PolarHBondContact O-N 3.45Å | ||
| 92 | W | 48.2 | Very low | 57.2 | Low | 170 Ų | 170 | 77 Ų | 77 | 64% | 0.644 | 45% | 0.454 | S | S | * | . | S | Bend | trans | -101.3 | 121.5 | 175.1 | -83.4 | 68.3 | 0 | 0 | 0 | 110.8 | L94 W95 | W92-L94 PolarHBondContact O-N 3.44Å; W92-L94 VanDerWaalsContact O-N 3.07Å; W92-W95 PolarHBondContact O-N 2.89Å |
| 93 | A | 49.2 | Very low | 56.5 | Low | 73 Ų | 73 | 75.9 Ų | 75.9 | 60% | 0.603 | 45% | 0.447 | S | S | * | . | H | α-helix | trans | -57 | -25.2 | -174.1 | 0 | 0 | 0 | 0 | 0 | 114.9 | W95 S96 A97 | A93-W95 PolarHBondContact O-N 3.21Å; A93-S96 WeakPolarHBondContact CA-OG 3.41Å; A93-S96 PolarHBondContact O-N 3.43Å; A93-S96 PolarHBondContact O-OG 2.94Å; A93-A97 PolarHBondContact O-N 2.78Å; A93-A97 VanDerWaalsContact O-N 3.09Å |
| 94 | L | 49.1 | Very low | 56.3 | Low | 85 Ų | 85 | 77.8 Ų | 77.8 | 45% | 0.445 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -65.4 | -25.7 | 173.9 | -91 | 104.2 | 0 | 0 | 0 | 113.6 | W92 V101 | W92-L94 PolarHBondContact O-N 3.44Å; W92-L94 VanDerWaalsContact O-N 3.07Å; L94-V101 HydrophobicContact CD2-CG1 4.42Å |
| 95 | W | 50.6 | Low | 56.5 | Low | 91 Ų | 91 | 79.1 Ų | 79.1 | 35% | 0.345 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -95.6 | -13.2 | 179.1 | -61.3 | 94.6 | 0 | 0 | 0 | 112.8 | V82 G86 P87 W92 A93 | V82-W95 HydrophobicContact CG1-CZ2 4.34Å; V82-W95 WeakPolarHBondContact O-CZ2 3.07Å; G86-W95 WeakPolarHBondContact O-CZ2 3.39Å; P87-W95 HydrophobicContact CB-CD2 4.14Å; P87-W95 HydrophobicContact CB-CE3 4Å; P87-W95 HydrophobicContact CB-CZ3 4.34Å; P87-W95 HydrophobicContact CG-CE3 3.95Å; P87-W95 HydrophobicContact CG-CH2 4.3Å; P87-W95 HydrophobicContact CG-CZ3 3.84Å; W92-W95 PolarHBondContact O-N 2.89Å; A93-W95 PolarHBondContact O-N 3.21Å |
| 96 | S | 50.3 | Low | 56.9 | Low | 97 Ų | 97 | 77.8 Ų | 77.8 | 68% | 0.678 | 46% | 0.464 | S | S | * | . | H | α-helix | trans | -88 | -19 | 168.4 | 69.2 | 0 | 0 | 0 | 0 | 112.6 | A93 | A93-S96 WeakPolarHBondContact CA-OG 3.41Å; A93-S96 PolarHBondContact O-N 3.43Å; A93-S96 PolarHBondContact O-OG 2.94Å |
| 97 | A | 48.3 | Very low | 58.1 | Low | 43 Ų | 43 | 79.6 Ų | 79.6 | 36% | 0.355 | 47% | 0.472 | S | S | . | . | S | Bend | trans | -70.5 | 125.4 | 167.3 | 0 | 0 | 0 | 0 | 0 | 108.2 | A93 V101 | A93-A97 PolarHBondContact O-N 2.78Å; A93-A97 VanDerWaalsContact O-N 3.09Å; A97-V101 HydrophobicContact CB-CB 4.21Å; A97-V101 HydrophobicContact CB-CG2 3.48Å; A97-V101 VanDerWaalsContact CB-CG2 3.48Å |
| 98 | G | 55 | Low | 59.8 | Low | 56 Ų | 56 | 77.5 Ų | 77.5 | 58% | 0.577 | 46% | 0.459 | S | S | * | . | trans | -60.3 | -167.4 | -166.1 | 0 | 0 | 0 | 0 | 0 | 116.6 | E100 V101 | G98-E100 PolarHBondContact O-N 3.37Å; G98-V101 PolarHBondContact O-N 2.96Å; G98-V101 VanDerWaalsContact O-N 3.1Å | ||
| 99 | G | 60.6 | Low | 62 | Low | 58 Ų | 58 | 76.3 Ų | 76.3 | 60% | 0.598 | 45% | 0.451 | S | S | * | . | H | α-helix | trans | -52.9 | -21.3 | -174.6 | 0 | 0 | 0 | 0 | 0 | 115.8 | H102 V103 | G99-H102 PolarHBondContact O-N 2.89Å; G99-V103 WeakPolarHBondContact O-CG2 3.42Å; G99-V103 PolarHBondContact O-N 3.25Å; G99-V103 VanDerWaalsContact O-N 3.16Å |
| 100 | E | 64.6 | Low | 64.1 | Low | 167 Ų | 167 | 72.8 Ų | 72.8 | 78% | 0.78 | 42% | 0.424 | S | S | * | . | H | α-helix | trans | -63.2 | -39.4 | 177.4 | -59.8 | -175.8 | 169.3 | 0 | 0 | 113.6 | G98 V103 A104 | G98-E100 PolarHBondContact O-N 3.37Å; E100-V103 PolarHBondContact O-N 2.94Å; E100-A104 WeakPolarHBondContact O-CB 3.44Å; E100-A104 PolarHBondContact O-N 2.86Å |
| 101 | V | 68.6 | Low | 66.3 | Low | 45 Ų | 45 | 67.3 Ų | 67.3 | 27% | 0.273 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -70.6 | -38.4 | -179.6 | 173.4 | 0 | 0 | 0 | 0 | 110.9 | L94 A97 G98 V103 A104 L105 | L94-V101 HydrophobicContact CD2-CG1 4.42Å; A97-V101 HydrophobicContact CB-CB 4.21Å; A97-V101 HydrophobicContact CB-CG2 3.48Å; A97-V101 VanDerWaalsContact CB-CG2 3.48Å; G98-V101 PolarHBondContact O-N 2.96Å; G98-V101 VanDerWaalsContact O-N 3.1Å; V101-V103 VanDerWaalsContact C-N 3.32Å; V101-V103 PolarHBondContact O-N 3.47Å; V101-A104 PolarHBondContact O-N 3.27Å; V101-L105 HydrophobicContact CG1-CD1 3.98Å; V101-L105 WeakPolarHBondContact O-CD1 3.3Å; V101-L105 VanDerWaalsContact O-CG 3.29Å; V101-L105 WeakPolarHBondContact O-CG 3.45Å; V101-L105 PolarHBondContact O-N 3.48Å |
| 102 | H | 68.4 | Low | 68.7 | Low | 99 Ų | 99 | 59.2 Ų | 59.2 | 46% | 0.458 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -62 | -43.1 | 175.1 | -169.4 | 69.5 | 0 | 0 | 0 | 111.4 | G99 L105 Q106 | G99-H102 PolarHBondContact O-N 2.89Å; H102-L105 PolarHBondContact O-N 3.42Å; H102-Q106 PolarHBondContact O-N 2.87Å; H102-Q106 VanDerWaalsContact O-N 3.08Å |
| 103 | V | 67.2 | Low | 70.7 | Confident | 14 Ų | 14 | 51.2 Ų | 51.2 | 9% | 0.085 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -63 | -45.7 | 175.3 | 167.7 | 0 | 0 | 0 | 0 | 111.2 | G99 E100 V101 L105 Q106 I107 L163 Y166 I167 | G99-V103 WeakPolarHBondContact O-CG2 3.42Å; G99-V103 PolarHBondContact O-N 3.25Å; G99-V103 VanDerWaalsContact O-N 3.16Å; E100-V103 PolarHBondContact O-N 2.94Å; V101-V103 VanDerWaalsContact C-N 3.32Å; V101-V103 PolarHBondContact O-N 3.47Å; V103-L105 PolarHBondContact O-N 3.48Å; V103-Q106 PolarHBondContact O-N 3.44Å; V103-Q106 VanDerWaalsContact O-N 3.12Å; V103-I107 WeakPolarHBondContact O-CG1 3.49Å; V103-I107 PolarHBondContact O-N 3.41Å; V103-L163 HydrophobicContact CG1-CB 4.38Å; V103-L163 HydrophobicContact CG1-CD1 4.4Å; V103-L163 HydrophobicContact CG1-CD2 3.65Å; V103-L163 HydrophobicContact CG1-CG 4.35Å; V103-Y166 HydrophobicContact CG2-CD1 3.69Å; V103-Y166 HydrophobicContact CG2-CE1 3.55Å; V103-I167 HydrophobicContact CG1-CD1 4.17Å; V103-I167 HydrophobicContact CG1-CG1 4.4Å |
| 104 | A | 74.9 | Confident | 72.7 | Confident | 56 Ų | 56 | 48 Ų | 48 | 46% | 0.463 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -61.8 | -30.4 | 178.8 | 0 | 0 | 0 | 0 | 0 | 113.4 | E100 V101 P108 | E100-A104 WeakPolarHBondContact O-CB 3.44Å; E100-A104 PolarHBondContact O-N 2.86Å; V101-A104 PolarHBondContact O-N 3.27Å; A104-P108 WeakPolarHBondContact O-CD 3.44Å |
| 105 | L | 80.4 | Confident | 74.8 | Confident | 33 Ų | 33 | 44 Ų | 44 | 17% | 0.173 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -81 | -28 | 175.6 | -69 | 165.3 | 0 | 0 | 0 | 112.9 | L79 V82 V101 H102 V103 P108 | L79-L105 HydrophobicContact CD2-CD2 3.74Å; V82-L105 HydrophobicContact CB-CD1 4.48Å; V82-L105 HydrophobicContact CG1-CD1 3.56Å; V101-L105 HydrophobicContact CG1-CD1 3.98Å; V101-L105 WeakPolarHBondContact O-CD1 3.3Å; V101-L105 VanDerWaalsContact O-CG 3.29Å; V101-L105 WeakPolarHBondContact O-CG 3.45Å; V101-L105 PolarHBondContact O-N 3.48Å; H102-L105 PolarHBondContact O-N 3.42Å; V103-L105 PolarHBondContact O-N 3.48Å; L105-P108 VanDerWaalsContact O-CD 3.27Å; L105-P108 WeakPolarHBondContact O-CD 3.33Å; L105-P108 VanDerWaalsContact O-CG 3.31Å; L105-P108 WeakPolarHBondContact O-CG 3.22Å |
| 106 | Q | 79.8 | Confident | 76.7 | Confident | 50 Ų | 50 | 39.8 Ų | 39.8 | 23% | 0.234 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -70.7 | -31.8 | 177.6 | -167.8 | 63.2 | 34.5 | 0 | 0 | 112.5 | H102 V103 F109 N110 | H102-Q106 PolarHBondContact O-N 2.87Å; H102-Q106 VanDerWaalsContact O-N 3.08Å; V103-Q106 PolarHBondContact O-N 3.44Å; V103-Q106 VanDerWaalsContact O-N 3.12Å; Q106-F109 PolarHBondContact O-N 3.32Å; Q106-N110 PolarHBondContact NE2-OD1 3.05Å; Q106-N110 PolarHBondContact O-N 3.48Å |
| 107 | I | 82.3 | Confident | 78.7 | Confident | 42 Ų | 42 | 35.2 Ų | 35.2 | 22% | 0.215 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -56.7 | -60.2 | 177.5 | -23.4 | -162.6 | 0 | 0 | 0 | 111.9 | V103 F109 N110 V111 L163 | V103-I107 WeakPolarHBondContact O-CG1 3.49Å; V103-I107 PolarHBondContact O-N 3.41Å; I107-F109 PolarHBondContact O-N 2.74Å; I107-N110 PolarHBondContact O-N 3.22Å; I107-N110 VanDerWaalsContact O-N 3.16Å; I107-V111 HydrophobicContact CG2-CG2 4.31Å; I107-V111 VanDerWaalsContact O-CG2 3.26Å; I107-V111 WeakPolarHBondContact O-CG2 3.3Å; I107-V111 PolarHBondContact O-N 3.28Å; I107-L163 HydrophobicContact CB-CD1 3.75Å; I107-L163 HydrophobicContact CD1-CD1 3.26Å; I107-L163 HydrophobicContact CG1-CD1 3.16Å; I107-L163 HydrophobicContact CG2-CD1 3.68Å |
| 108 | P | 87.6 | Confident | 80.8 | Confident | 39 Ų | 39 | 35.9 Ų | 35.9 | 25% | 0.253 | 22% | 0.217 | S | C | . | . | H | α-helix | trans | -64.9 | -26.8 | -176.4 | 28.4 | -37.6 | 0 | 0 | 0 | 112.3 | V75 L79 A104 L105 S112 | V75-P108 HydrophobicContact CG1-CB 3.74Å; L79-P108 HydrophobicContact CD1-CB 3.93Å; L79-P108 HydrophobicContact CD1-CG 3.82Å; L79-P108 HydrophobicContact CD2-CG 3.86Å; L79-P108 HydrophobicContact CG-CG 4.4Å; A104-P108 WeakPolarHBondContact O-CD 3.44Å; L105-P108 VanDerWaalsContact O-CD 3.27Å; L105-P108 WeakPolarHBondContact O-CD 3.33Å; L105-P108 VanDerWaalsContact O-CG 3.31Å; L105-P108 WeakPolarHBondContact O-CG 3.22Å; P108-S112 VanDerWaalsContact O-CB 3.26Å; P108-S112 WeakPolarHBondContact O-CB 3.44Å; P108-S112 PolarHBondContact O-N 3.17Å; P108-S112 PolarHBondContact O-OG 3.45Å |
| 109 | F | 88.6 | Confident | 82.6 | Confident | 4 Ų | 4 | 33.2 Ų | 33.2 | 2% | 0.018 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -63.9 | -52.1 | 171.4 | 179.5 | -90.4 | 0 | 0 | 0 | 111.5 | L76 L79 Q106 I107 V111 S112 S113 W246 H249 A285 F286 | L76-F109 HydrophobicContact CD2-CD2 3.82Å; L76-F109 HydrophobicContact CD2-CE2 4.15Å; L79-F109 HydrophobicContact CD1-CB 4.06Å; Q106-F109 PolarHBondContact O-N 3.32Å; I107-F109 PolarHBondContact O-N 2.74Å; F109-V111 PolarHBondContact O-N 2.76Å; F109-S112 PolarHBondContact O-N 3.41Å; F109-S113 PolarHBondContact O-N 3.29Å; F109-W246 HydrophobicContact CE1-CZ3 4.47Å; F109-W246 HydrophobicContact CE2-CZ3 4.44Å; F109-W246 AromaticContact CZ-CZ3 3.99Å; F109-W246 HydrophobicContact CZ-CZ3 3.99Å; F109-H249 AromaticContact CE1-CE1 3.63Å; F109-H249 AromaticContact CE1-NE2 3.44Å; F109-H249 WeakPolarHBondContact CE1-NE2 3.23Å; F109-H249 AromaticContact CZ-CE1 3.92Å; F109-A285 HydrophobicContact CE2-CB 4.49Å; F109-A285 HydrophobicContact CZ-CB 4.24Å; F109-F286 HydrophobicContact CD2-CE1 4.14Å; F109-F286 AromaticContact CD2-CZ 3.91Å; F109-F286 HydrophobicContact CD2-CZ 3.91Å; F109-F286 HydrophobicContact CE2-CE1 4.19Å; F109-F286 HydrophobicContact CE2-CE2 4.28Å; F109-F286 AromaticContact CE2-CZ 3.86Å; F109-F286 HydrophobicContact CE2-CZ 3.86Å |
| 110 | N | 87.2 | Confident | 84.1 | Confident | 18 Ų | 18 | 30.5 Ų | 30.5 | 10% | 0.096 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -62.1 | -44.1 | 178.7 | -71.6 | -10.1 | 0 | 0 | 0 | 111.6 | Q106 I107 S112 S113 L114 | Q106-N110 PolarHBondContact NE2-OD1 3.05Å; Q106-N110 PolarHBondContact O-N 3.48Å; I107-N110 PolarHBondContact O-N 3.22Å; I107-N110 VanDerWaalsContact O-N 3.16Å; N110-S112 VanDerWaalsContact C-N 3.34Å; N110-S112 PolarHBondContact O-N 3.06Å; N110-S113 WeakPolarHBondContact O-CB 3.3Å; N110-S113 PolarHBondContact O-N 3.08Å; N110-L114 WeakPolarHBondContact O-CG 3.26Å; N110-L114 PolarHBondContact O-N 2.95Å |
| 111 | V | 89.6 | Confident | 85.4 | Confident | 4 Ų | 4 | 22.7 Ų | 22.7 | 2% | 0.024 | 13% | 0.125 | C | C | . | . | H | α-helix | trans | -58.5 | -47.4 | 176.2 | 174 | 0 | 0 | 0 | 0 | 110.6 | I107 F109 S113 L114 V115 W152 A155 L156 S159 | I107-V111 HydrophobicContact CG2-CG2 4.31Å; I107-V111 VanDerWaalsContact O-CG2 3.26Å; I107-V111 WeakPolarHBondContact O-CG2 3.3Å; I107-V111 PolarHBondContact O-N 3.28Å; F109-V111 PolarHBondContact O-N 2.76Å; V111-S113 VanDerWaalsContact C-N 3.31Å; V111-S113 PolarHBondContact O-N 2.67Å; V111-L114 PolarHBondContact O-N 3.44Å; V111-V115 HydrophobicContact CG1-CG2 4.23Å; V111-V115 WeakPolarHBondContact O-CB 3.24Å; V111-V115 VanDerWaalsContact O-CG2 3.24Å; V111-V115 WeakPolarHBondContact O-CG2 3.2Å; V111-V115 PolarHBondContact O-N 3.4Å; V111-W152 HydrophobicContact CG1-CE3 3.64Å; V111-W152 HydrophobicContact CG1-CZ3 3.47Å; V111-W152 VanDerWaalsContact CG1-CZ3 3.47Å; V111-A155 HydrophobicContact CG1-CB 3.99Å; V111-L156 HydrophobicContact CG1-CD2 4.48Å; V111-L156 HydrophobicContact CG1-CG 4.42Å; V111-L156 HydrophobicContact CG2-CD2 3.97Å; V111-L156 HydrophobicContact CG2-CG 4.37Å; V111-S159 WeakPolarHBondContact CG2-OG 3.23Å |
| 112 | S | 92.3 | Very high | 86.5 | Confident | 0 Ų | 0 | 22.3 Ų | 22.3 | 0% | 0 | 12% | 0.121 | C | C | . | . | H | α-helix | trans | -63.5 | -38 | -179.6 | -59.7 | 0 | 0 | 0 | 0 | 112.2 | V75 P108 F109 N110 A116 | V75-S112 WeakPolarHBondContact CB-OG 3.37Å; V75-S112 VanDerWaalsContact CG1-OG 3.25Å; V75-S112 WeakPolarHBondContact CG1-OG 3.33Å; P108-S112 VanDerWaalsContact O-CB 3.26Å; P108-S112 WeakPolarHBondContact O-CB 3.44Å; P108-S112 PolarHBondContact O-N 3.17Å; P108-S112 PolarHBondContact O-OG 3.45Å; F109-S112 PolarHBondContact O-N 3.41Å; N110-S112 VanDerWaalsContact C-N 3.34Å; N110-S112 PolarHBondContact O-N 3.06Å; S112-A116 WeakPolarHBondContact O-CB 3.37Å; S112-A116 PolarHBondContact O-N 3.3Å |
| 113 | S | 90.8 | Very high | 87.5 | Confident | 2 Ų | 2 | 17.8 Ų | 17.8 | 1% | 0.014 | 10% | 0.1 | C | C | . | . | H | α-helix | trans | -60.4 | -52.9 | 173.4 | -170.8 | 0 | 0 | 0 | 0 | 111.3 | F109 N110 V111 V115 A116 M117 W246 Y250 | F109-S113 PolarHBondContact O-N 3.29Å; N110-S113 WeakPolarHBondContact O-CB 3.3Å; N110-S113 PolarHBondContact O-N 3.08Å; V111-S113 VanDerWaalsContact C-N 3.31Å; V111-S113 PolarHBondContact O-N 2.67Å; S113-V115 VanDerWaalsContact C-N 3.34Å; S113-V115 PolarHBondContact O-N 3.4Å; S113-A116 PolarHBondContact O-N 3.06Å; S113-M117 WeakPolarHBondContact O-CG 3.45Å; S113-M117 PolarHBondContact O-N 2.91Å; S113-W246 VanDerWaalsContact CB-CZ3 3.43Å; S113-W246 VanDerWaalsContact OG-CZ3 3.25Å; S113-W246 WeakPolarHBondContact OG-CZ3 3.45Å; S113-Y250 WeakPolarHBondContact OG-CE2 3.31Å; S113-Y250 PolarHBondContact OG-OH 2.8Å |
| 114 | L | 90.4 | Very high | 88.5 | Confident | 5 Ų | 5 | 17.1 Ų | 17.1 | 3% | 0.026 | 10% | 0.096 | C | C | . | . | H | α-helix | trans | -57.7 | -47.8 | 178.6 | -67 | 174.9 | 0 | 0 | 0 | 111.3 | N110 V111 A116 M117 Y118 A155 T158 | N110-L114 WeakPolarHBondContact O-CG 3.26Å; N110-L114 PolarHBondContact O-N 2.95Å; V111-L114 PolarHBondContact O-N 3.44Å; L114-A116 VanDerWaalsContact C-N 3.34Å; L114-A116 PolarHBondContact O-N 2.99Å; L114-M117 PolarHBondContact O-N 3.27Å; L114-Y118 HydrophobicContact CB-CD2 4.47Å; L114-Y118 HydrophobicContact CD2-CE2 4.25Å; L114-Y118 WeakPolarHBondContact O-CB 3.47Å; L114-Y118 VanDerWaalsContact O-CD2 3.3Å; L114-Y118 WeakPolarHBondContact O-CD2 3.28Å; L114-Y118 PolarHBondContact O-N 2.73Å; L114-A155 HydrophobicContact CB-CB 3.8Å; L114-A155 HydrophobicContact CD1-CB 3.91Å; L114-T158 HydrophobicContact CD1-CG2 4.42Å |
| 115 | V | 92.6 | Very high | 89.1 | Confident | 0 Ų | 0 | 16.6 Ų | 16.6 | 0% | 0 | 9% | 0.085 | C | C | . | . | H | α-helix | trans | -59.1 | -44.4 | 178.7 | 171.2 | 0 | 0 | 0 | 0 | 111.1 | N68 A72 V111 S113 S119 V151 W152 A155 | N68-V115 WeakPolarHBondContact ND2-CG1 3.32Å; A72-V115 HydrophobicContact CB-CB 4.21Å; A72-V115 HydrophobicContact CB-CG1 3.94Å; V111-V115 HydrophobicContact CG1-CG2 4.23Å; V111-V115 WeakPolarHBondContact O-CB 3.24Å; V111-V115 VanDerWaalsContact O-CG2 3.24Å; V111-V115 WeakPolarHBondContact O-CG2 3.2Å; V111-V115 PolarHBondContact O-N 3.4Å; S113-V115 VanDerWaalsContact C-N 3.34Å; S113-V115 PolarHBondContact O-N 3.4Å; V115-S119 WeakPolarHBondContact O-CB 3.19Å; V115-S119 PolarHBondContact O-N 3.02Å; V115-S119 PolarHBondContact O-OG 3Å; V115-V151 HydrophobicContact CG2-CG1 4.26Å; V115-W152 HydrophobicContact CB-CZ2 4.35Å; V115-W152 HydrophobicContact CG1-CZ2 3.8Å; V115-W152 HydrophobicContact CG2-CD2 3.68Å; V115-W152 HydrophobicContact CG2-CE3 3.87Å; V115-W152 HydrophobicContact CG2-CG 4.18Å; V115-W152 HydrophobicContact CG2-CH2 4.19Å; V115-W152 HydrophobicContact CG2-CZ2 4.01Å; V115-W152 HydrophobicContact CG2-CZ3 4.13Å; V115-A155 HydrophobicContact CG2-CB 4.16Å |
| 116 | A | 92.3 | Very high | 89.3 | Confident | 4 Ų | 4 | 16.2 Ų | 16.2 | 3% | 0.033 | 8% | 0.084 | C | C | . | . | H | α-helix | trans | -63.5 | -47.4 | 178.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | S112 S113 L114 T120 W246 | S112-A116 WeakPolarHBondContact O-CB 3.37Å; S112-A116 PolarHBondContact O-N 3.3Å; S113-A116 PolarHBondContact O-N 3.06Å; L114-A116 VanDerWaalsContact C-N 3.34Å; L114-A116 PolarHBondContact O-N 2.99Å; A116-T120 WeakPolarHBondContact O-CB 3.3Å; A116-T120 PolarHBondContact O-N 3.45Å; A116-T120 PolarHBondContact O-OG1 3.4Å; A116-W246 HydrophobicContact CB-CZ2 4.44Å |
| 117 | M | 92.3 | Very high | 89.4 | Confident | 0 Ų | 0 | 15 Ų | 15 | 0% | 0 | 8% | 0.078 | C | C | . | . | H | α-helix | trans | -66.2 | -49.1 | -177.5 | -64.6 | -60.2 | -70.4 | 0 | 0 | 112.1 | S113 L114 T120 A121 Y196 P199 F243 W246 Y250 | S113-M117 WeakPolarHBondContact O-CG 3.45Å; S113-M117 PolarHBondContact O-N 2.91Å; L114-M117 PolarHBondContact O-N 3.27Å; M117-T120 PolarHBondContact O-N 3.16Å; M117-A121 PolarHBondContact O-N 3.08Å; M117-Y196 HydrophobicContact CE-CD2 3.62Å; M117-Y196 HydrophobicContact CE-CE2 4Å; M117-P199 HydrophobicContact CB-CB 4.2Å; M117-P199 HydrophobicContact CB-CG 4.04Å; M117-F243 HydrophobicContact CE-CD1 3.25Å; M117-F243 HydrophobicContact CE-CD2 4.43Å; M117-F243 HydrophobicContact CE-CE1 3.09Å; M117-F243 HydrophobicContact CE-CE2 4.35Å; M117-F243 HydrophobicContact CE-CG 3.94Å; M117-F243 HydrophobicContact CE-CZ 3.72Å; M117-F243 HydrophobicContact SD-CE1 4.47Å; M117-W246 HydrophobicContact CE-CB 4.46Å; M117-W246 HydrophobicContact SD-CB 3.64Å; M117-W246 HydrophobicContact SD-CG 3.75Å; M117-Y250 HydrophobicContact CG-CE2 4.31Å |
| 118 | Y | 92 | Very high | 89.3 | Confident | 58 Ų | 58 | 15.7 Ų | 15.7 | 23% | 0.227 | 8% | 0.078 | C | C | . | . | H | α-helix | trans | -67.3 | -38.2 | 178.2 | -83.3 | -80.3 | 0 | 0 | 0 | 112.3 | L114 T120 A121 L122 I194 V198 | L114-Y118 HydrophobicContact CB-CD2 4.47Å; L114-Y118 HydrophobicContact CD2-CE2 4.25Å; L114-Y118 WeakPolarHBondContact O-CB 3.47Å; L114-Y118 VanDerWaalsContact O-CD2 3.3Å; L114-Y118 WeakPolarHBondContact O-CD2 3.28Å; L114-Y118 PolarHBondContact O-N 2.73Å; Y118-T120 VanDerWaalsContact C-N 3.29Å; Y118-T120 PolarHBondContact O-N 3Å; Y118-A121 PolarHBondContact O-N 3.12Å; Y118-L122 VanDerWaalsContact O-CB 3.3Å; Y118-L122 WeakPolarHBondContact O-CB 3.48Å; Y118-L122 VanDerWaalsContact O-CG 3.23Å; Y118-L122 WeakPolarHBondContact O-CG 3.41Å; Y118-L122 PolarHBondContact O-N 3.47Å; Y118-I194 HydrophobicContact CE2-CG2 4.45Å; Y118-I194 WeakPolarHBondContact CE2-O 3.49Å; Y118-I194 WeakPolarHBondContact OH-CG2 3.4Å; Y118-I194 PolarHBondContact OH-O 3.44Å; Y118-V198 HydrophobicContact CE1-CG1 4.36Å |
| 119 | S | 92.5 | Very high | 88.8 | Confident | 0 Ų | 0 | 16.3 Ų | 16.3 | 0% | 0 | 8% | 0.079 | C | C | . | . | H | α-helix | trans | -62.6 | -38.7 | 175.3 | -59.8 | 0 | 0 | 0 | 0 | 111.8 | N68 V115 L123 | N68-S119 PolarHBondContact ND2-OG 2.75Å; V115-S119 WeakPolarHBondContact O-CB 3.19Å; V115-S119 PolarHBondContact O-N 3.02Å; V115-S119 PolarHBondContact O-OG 3Å; S119-L123 WeakPolarHBondContact O-CB 3.42Å; S119-L123 PolarHBondContact O-N 3.38Å |
| 120 | T | 91.8 | Very high | 88.1 | Confident | 0 Ų | 0 | 20.7 Ų | 20.7 | 0% | 0 | 10% | 0.099 | C | C | . | . | H | α-helix | trans | -68.2 | -41.9 | 177.2 | -56.6 | 0 | 0 | 0 | 0 | 111.7 | M69 A116 M117 Y118 S124 V239 Q242 F243 | M69-T120 PolarHBondContact SD-OG1 3.29Å; A116-T120 WeakPolarHBondContact O-CB 3.3Å; A116-T120 PolarHBondContact O-N 3.45Å; A116-T120 PolarHBondContact O-OG1 3.4Å; M117-T120 PolarHBondContact O-N 3.16Å; Y118-T120 VanDerWaalsContact C-N 3.29Å; Y118-T120 PolarHBondContact O-N 3Å; T120-S124 PolarHBondContact O-N 3.16Å; T120-S124 PolarHBondContact O-OG 2.9Å; T120-V239 HydrophobicContact CG2-CB 4.26Å; T120-V239 HydrophobicContact CG2-CG1 4.49Å; T120-V239 HydrophobicContact CG2-CG2 3.93Å; T120-Q242 HydrophobicContact CG2-CB 4.06Å; T120-Q242 HydrophobicContact CG2-CG 4.33Å; T120-F243 HydrophobicContact CG2-CD2 4.15Å; T120-F243 HydrophobicContact CG2-CE2 3.83Å |
| 121 | A | 91.8 | Very high | 87.3 | Confident | 3 Ų | 3 | 24 Ų | 24 | 3% | 0.025 | 11% | 0.11 | C | C | . | . | H | α-helix | trans | -65.5 | -46.4 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112 | M117 Y118 S124 L125 P199 A202 A203 | M117-A121 PolarHBondContact O-N 3.08Å; Y118-A121 PolarHBondContact O-N 3.12Å; A121-S124 WeakPolarHBondContact O-CB 3.35Å; A121-S124 PolarHBondContact O-N 3.36Å; A121-S124 VanDerWaalsContact O-N 3.14Å; A121-L125 PolarHBondContact O-N 3.13Å; A121-L125 VanDerWaalsContact O-N 3.07Å; A121-P199 HydrophobicContact CB-CB 3.99Å; A121-P199 WeakPolarHBondContact CB-O 3.49Å; A121-A202 HydrophobicContact CB-CB 4.33Å; A121-A203 HydrophobicContact CB-CB 4.22Å |
| 122 | L | 91.1 | Very high | 86.3 | Confident | 37 Ų | 37 | 25.5 Ų | 25.5 | 19% | 0.194 | 12% | 0.124 | C | C | . | . | H | α-helix | trans | -66.2 | -39.9 | 178 | -71.1 | 168.4 | 0 | 0 | 0 | 112.2 | Y65 Y118 S124 L125 D126 V147 V151 | Y65-L122 HydrophobicContact CD1-CB 4.35Å; Y65-L122 HydrophobicContact CE1-CB 3.48Å; Y65-L122 VanDerWaalsContact CE1-CB 3.48Å; Y65-L122 HydrophobicContact CE1-CD1 4.07Å; Y65-L122 HydrophobicContact CE1-CG 4.44Å; Y118-L122 VanDerWaalsContact O-CB 3.3Å; Y118-L122 WeakPolarHBondContact O-CB 3.48Å; Y118-L122 VanDerWaalsContact O-CG 3.23Å; Y118-L122 WeakPolarHBondContact O-CG 3.41Å; Y118-L122 PolarHBondContact O-N 3.47Å; L122-S124 PolarHBondContact O-N 3.48Å; L122-L125 PolarHBondContact O-N 3.31Å; L122-L125 VanDerWaalsContact O-N 3.16Å; L122-D126 WeakPolarHBondContact O-CB 3.35Å; L122-D126 PolarHBondContact O-N 2.93Å; L122-V147 HydrophobicContact CD1-CG1 3.6Å; L122-V147 HydrophobicContact CD2-CG1 4.41Å; L122-V151 HydrophobicContact CD1-CG2 3.82Å |
| 123 | L | 90.2 | Very high | 85.1 | Confident | 4 Ų | 4 | 30 Ų | 30 | 2% | 0.021 | 15% | 0.147 | C | C | . | . | H | α-helix | trans | -53.6 | -40.8 | 171.1 | 173.7 | 67.8 | 0 | 0 | 0 | 111.4 | P62 Y65 F66 M69 S119 H127 L235 T238 | P62-L123 HydrophobicContact CB-CD1 3.81Å; P62-L123 HydrophobicContact CG-CD1 4.24Å; Y65-L123 HydrophobicContact CD2-CB 4Å; Y65-L123 HydrophobicContact CD2-CD1 3.98Å; Y65-L123 HydrophobicContact CG-CB 4.08Å; Y65-L123 HydrophobicContact CG-CD1 4.49Å; F66-L123 HydrophobicContact CD2-CD2 4.42Å; F66-L123 HydrophobicContact CE2-CD2 3.7Å; F66-L123 HydrophobicContact CZ-CD2 4.42Å; M69-L123 HydrophobicContact CE-CD2 4.44Å; S119-L123 WeakPolarHBondContact O-CB 3.42Å; S119-L123 PolarHBondContact O-N 3.38Å; L123-H127 VanDerWaalsContact O-CB 3.26Å; L123-H127 WeakPolarHBondContact O-CB 3.45Å; L123-H127 PolarHBondContact O-N 3.35Å; L123-L235 HydrophobicContact CD2-CD1 3.92Å; L123-L235 HydrophobicContact CG-CD1 3.78Å; L123-T238 HydrophobicContact CD2-CG2 4.35Å |
| 124 | S | 89.1 | Confident | 83.5 | Confident | 0 Ų | 0 | 34.7 Ų | 34.7 | 0% | 0 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -69.2 | -41.9 | 179.4 | -52.2 | 0 | 0 | 0 | 0 | 112.2 | T120 A121 L122 Y128 V239 | T120-S124 PolarHBondContact O-N 3.16Å; T120-S124 PolarHBondContact O-OG 2.9Å; A121-S124 WeakPolarHBondContact O-CB 3.35Å; A121-S124 PolarHBondContact O-N 3.36Å; A121-S124 VanDerWaalsContact O-N 3.14Å; L122-S124 PolarHBondContact O-N 3.48Å; S124-Y128 PolarHBondContact O-N 2.71Å; S124-V239 WeakPolarHBondContact OG-CG2 3.45Å |
| 125 | L | 86.3 | Confident | 81.8 | Confident | 46 Ų | 46 | 46.6 Ų | 46.6 | 24% | 0.241 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -67.7 | -47.2 | 178.3 | -75.9 | 168 | 0 | 0 | 0 | 112.3 | A121 L122 H127 Y128 I129 A202 A206 | A121-L125 PolarHBondContact O-N 3.13Å; A121-L125 VanDerWaalsContact O-N 3.07Å; L122-L125 PolarHBondContact O-N 3.31Å; L122-L125 VanDerWaalsContact O-N 3.16Å; L125-H127 VanDerWaalsContact C-N 3.26Å; L125-H127 PolarHBondContact O-N 3.45Å; L125-Y128 WeakPolarHBondContact O-CA 3.43Å; L125-Y128 VanDerWaalsContact O-CB 3.3Å; L125-Y128 WeakPolarHBondContact O-CB 3.38Å; L125-Y128 PolarHBondContact O-N 3.46Å; L125-Y128 VanDerWaalsContact O-N 3.08Å; L125-I129 WeakPolarHBondContact O-CG1 3.38Å; L125-I129 PolarHBondContact O-N 2.88Å; L125-A202 HydrophobicContact CD1-CB 4.35Å; L125-A206 HydrophobicContact CD2-CB 3.75Å; L125-A206 HydrophobicContact CG-CB 3.98Å |
| 126 | D | 85.3 | Confident | 79.8 | Confident | 25 Ų | 25 | 49.3 Ų | 49.3 | 13% | 0.134 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -65.1 | -35.8 | -178.9 | -80.4 | 6.9 | 0 | 0 | 0 | 111.2 | M61 Y65 L122 Y128 I129 E130 | M61-D126 HydrophobicContact CE-CB 4.16Å; M61-D126 WeakPolarHBondContact CE-OD2 3.28Å; M61-D126 HydrophobicContact SD-CB 4.5Å; Y65-D126 HydrophobicContact CE2-CB 4.24Å; Y65-D126 WeakPolarHBondContact CE2-OD2 3.33Å; Y65-D126 PolarHBondContact OH-OD2 2.94Å; L122-D126 WeakPolarHBondContact O-CB 3.35Å; L122-D126 PolarHBondContact O-N 2.93Å; D126-Y128 VanDerWaalsContact C-N 3.32Å; D126-Y128 PolarHBondContact O-N 2.83Å; D126-I129 PolarHBondContact O-N 2.9Å; D126-E130 WeakPolarHBondContact O-CB 3.11Å; D126-E130 PolarHBondContact O-N 3.48Å |
| 127 | H | 80.6 | Confident | 77.7 | Confident | 24 Ų | 24 | 57.5 Ų | 57.5 | 11% | 0.111 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -66.9 | -33.5 | 174.1 | -159.5 | 68.7 | 0 | 0 | 0 | 113 | L123 L125 R131 L227 L235 | L123-H127 VanDerWaalsContact O-CB 3.26Å; L123-H127 WeakPolarHBondContact O-CB 3.45Å; L123-H127 PolarHBondContact O-N 3.35Å; L125-H127 VanDerWaalsContact C-N 3.26Å; L125-H127 PolarHBondContact O-N 3.45Å; H127-R131 PolarHBondContact O-N 2.89Å; H127-L227 WeakPolarHBondContact CE1-CD2 3.31Å; H127-L227 WeakPolarHBondContact NE2-CD2 3.34Å; H127-L235 HydrophobicContact CB-CD2 3.99Å; H127-L235 VanDerWaalsContact CD2-CD2 3.49Å; H127-L235 WeakPolarHBondContact CD2-CD2 3.34Å |
| 128 | Y | 80.6 | Confident | 75.6 | Confident | 57 Ų | 57 | 63.3 Ų | 63.3 | 22% | 0.224 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -64.5 | -48.3 | 169.2 | 166.7 | -104.5 | 0 | 0 | 0 | 111.6 | S124 L125 D126 E130 R131 A132 L209 L210 V213 | S124-Y128 PolarHBondContact O-N 2.71Å; L125-Y128 WeakPolarHBondContact O-CA 3.43Å; L125-Y128 VanDerWaalsContact O-CB 3.3Å; L125-Y128 WeakPolarHBondContact O-CB 3.38Å; L125-Y128 PolarHBondContact O-N 3.46Å; L125-Y128 VanDerWaalsContact O-N 3.08Å; D126-Y128 VanDerWaalsContact C-N 3.32Å; D126-Y128 PolarHBondContact O-N 2.83Å; Y128-E130 VanDerWaalsContact C-N 3.33Å; Y128-E130 PolarHBondContact O-N 3.4Å; Y128-R131 PolarHBondContact O-N 2.89Å; Y128-R131 VanDerWaalsContact O-N 3.08Å; Y128-A132 HydrophobicContact CD2-CB 4.38Å; Y128-A132 HydrophobicContact CE1-CB 4.23Å; Y128-A132 HydrophobicContact CE2-CB 3.79Å; Y128-A132 WeakPolarHBondContact O-CB 3.29Å; Y128-A132 PolarHBondContact O-N 3.1Å; Y128-L209 HydrophobicContact CD1-CD1 4.12Å; Y128-L209 HydrophobicContact CD2-CB 3.61Å; Y128-L209 HydrophobicContact CE1-CB 4.49Å; Y128-L209 HydrophobicContact CE1-CD1 3.74Å; Y128-L209 HydrophobicContact CE2-CB 3.47Å; Y128-L209 VanDerWaalsContact CE2-CB 3.47Å; Y128-L209 HydrophobicContact CE2-CD1 4.17Å; Y128-L209 HydrophobicContact CE2-CG 4.35Å; Y128-L209 HydrophobicContact CG-CB 4.19Å; Y128-L209 HydrophobicContact CG-CD1 4.48Å; Y128-L210 HydrophobicContact CD2-CD2 4.39Å; Y128-L210 HydrophobicContact CD2-CG 4.28Å; Y128-V213 HydrophobicContact CE2-CG2 3.87Å |
| 129 | I | 76.8 | Confident | 73.8 | Confident | 52 Ų | 52 | 61.9 Ų | 61.9 | 27% | 0.267 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -60.5 | -44.5 | -178.4 | -66.7 | 166 | 0 | 0 | 0 | 110.7 | L125 D126 R131 A132 L133 | L125-I129 WeakPolarHBondContact O-CG1 3.38Å; L125-I129 PolarHBondContact O-N 2.88Å; D126-I129 PolarHBondContact O-N 2.9Å; I129-R131 PolarHBondContact O-N 3.42Å; I129-A132 PolarHBondContact O-N 3.23Å; I129-L133 PolarHBondContact O-N 3.44Å |
| 130 | E | 75.3 | Confident | 72.3 | Confident | 95 Ų | 95 | 63.5 Ų | 63.5 | 44% | 0.444 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -58.1 | -34.8 | 177 | -169.2 | 177.2 | -168.1 | 0 | 0 | 111.9 | D126 Y128 | D126-E130 WeakPolarHBondContact O-CB 3.11Å; D126-E130 PolarHBondContact O-N 3.48Å; Y128-E130 VanDerWaalsContact C-N 3.33Å; Y128-E130 PolarHBondContact O-N 3.4Å |
| 131 | R | 69.4 | Low | 70.8 | Confident | 87 Ų | 87 | 65.3 Ų | 65.3 | 33% | 0.328 | 32% | 0.321 | S | S | . | . | H | α-helix | trans | -82.1 | -40.2 | 178.6 | -174.1 | 154.5 | -173.1 | 71.1 | 3.7 | 113.8 | H127 Y128 I129 V213 D217 | H127-R131 PolarHBondContact O-N 2.89Å; Y128-R131 PolarHBondContact O-N 2.89Å; Y128-R131 VanDerWaalsContact O-N 3.08Å; I129-R131 PolarHBondContact O-N 3.42Å; R131-V213 HydrophobicContact CG-CG1 4.1Å; R131-D217 IonicContact CZ-OD2 3.57Å; R131-D217 IonicContact NE-OD2 3.74Å; R131-D217 IonicContact NH2-OD1 3.81Å; R131-D217 IonicContact NH2-OD2 2.64Å; R131-D217 PolarHBondContact NH2-OD2 3.13Å |
| 132 | A | 69.4 | Low | 69.3 | Low | 37 Ų | 37 | 71.9 Ų | 71.9 | 31% | 0.306 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -78.3 | -29.3 | -177.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | Y128 I129 | Y128-A132 HydrophobicContact CD2-CB 4.38Å; Y128-A132 HydrophobicContact CE1-CB 4.23Å; Y128-A132 HydrophobicContact CE2-CB 3.79Å; Y128-A132 WeakPolarHBondContact O-CB 3.29Å; Y128-A132 PolarHBondContact O-N 3.1Å; I129-A132 PolarHBondContact O-N 3.23Å |
| 133 | L | 66.8 | Low | 68.2 | Low | 93 Ų | 93 | 73.3 Ų | 73.3 | 49% | 0.487 | 35% | 0.354 | S | S | . | . | S | Bend | trans | -132.2 | 71.5 | -179.4 | -73.2 | 92.9 | 0 | 0 | 0 | 111.5 | I129 R135 T136 | I129-L133 PolarHBondContact O-N 3.44Å; L133-R135 PolarHBondContact O-N 3.05Å; L133-T136 HydrophobicContact CB-CG2 3.83Å; L133-T136 HydrophobicContact CD2-CG2 3.74Å; L133-T136 HydrophobicContact CG-CG2 4.45Å; L133-T136 PolarHBondContact O-N 3.12Å; L133-T136 PolarHBondContact O-OG1 3.11Å; L133-T136 VanDerWaalsContact O-OG1 3.08Å |
| 134 | P | 56.8 | Low | 67.5 | Low | 101 Ų | 101 | 73.1 Ų | 73.1 | 66% | 0.656 | 35% | 0.353 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -60 | 122.4 | 174.5 | 24 | -31.4 | 0 | 0 | 0 | 109.6 | ||
| 135 | R | 55 | Low | 67.1 | Low | 256 Ų | 256 | 78.5 Ų | 78.5 | 97% | 0.966 | 37% | 0.373 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 91.4 | 18.4 | -176.2 | -55.8 | 175 | 167.9 | 159 | -2.2 | 118.1 | L133 | L133-R135 PolarHBondContact O-N 3.05Š|
| 136 | T | 51 | Low | 66.9 | Low | 56 Ų | 56 | 81.3 Ų | 81.3 | 34% | 0.344 | 39% | 0.385 | S | S | . | . | trans | -89.2 | 136.9 | 168.4 | 50.5 | 0 | 0 | 0 | 0 | 113.4 | L133 M138 | L133-T136 HydrophobicContact CB-CG2 3.83Å; L133-T136 HydrophobicContact CD2-CG2 3.74Å; L133-T136 HydrophobicContact CG-CG2 4.45Å; L133-T136 PolarHBondContact O-N 3.12Å; L133-T136 PolarHBondContact O-OG1 3.11Å; L133-T136 VanDerWaalsContact O-OG1 3.08Å; T136-M138 PolarHBondContact O-N 2.92Å; T136-M138 VanDerWaalsContact O-N 3.15Å | ||
| 137 | Y | 47.8 | Very low | 66.6 | Low | 176 Ų | 176 | 82.1 Ų | 82.1 | 69% | 0.69 | 39% | 0.391 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63.3 | -12.8 | 177.9 | 179.3 | -98.1 | 0 | 0 | 0 | 114.1 | A139 S140 | Y137-A139 VanDerWaalsContact C-N 3.3Å; Y137-A139 PolarHBondContact O-N 3.19Å; Y137-S140 VanDerWaalsContact O-CB 3.26Å; Y137-S140 WeakPolarHBondContact O-CB 3.41Å; Y137-S140 PolarHBondContact O-N 3.27Å |
| 138 | M | 48.2 | Very low | 66.8 | Low | 122 Ų | 122 | 81.4 Ų | 81.4 | 60% | 0.601 | 39% | 0.388 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -68.7 | -28.4 | -176.9 | -69.5 | -67.2 | 142.2 | 0 | 0 | 112.9 | T136 S140 N143 | T136-M138 PolarHBondContact O-N 2.92Å; T136-M138 VanDerWaalsContact O-N 3.15Å; M138-S140 VanDerWaalsContact C-N 3.29Å; M138-S140 PolarHBondContact O-N 3.27Å; M138-N143 PolarHBondContact O-ND2 3.22Å |
| 139 | A | 53.4 | Low | 67 | Low | 28 Ų | 28 | 80.7 Ų | 80.7 | 23% | 0.231 | 40% | 0.399 | C | S | . | . | S | Bend | trans | -90.7 | 51 | 173.6 | 0 | 0 | 0 | 0 | 0 | 111.6 | M61 Y137 | M61-A139 HydrophobicContact CE-CB 4.26Å; M61-A139 WeakPolarHBondContact SD-CA 3.18Å; M61-A139 HydrophobicContact SD-CB 3.49Å; M61-A139 WeakPolarHBondContact SD-CB 3.42Å; Y137-A139 VanDerWaalsContact C-N 3.3Å; Y137-A139 PolarHBondContact O-N 3.19Å |
| 140 | S | 62.1 | Low | 67.5 | Low | 35 Ų | 35 | 86.2 Ų | 86.2 | 25% | 0.245 | 42% | 0.421 | C | S | . | . | trans | -104.5 | 137 | 179.2 | 176.5 | 0 | 0 | 0 | 0 | 111.7 | Y137 M138 Y142 N143 T144 | Y137-S140 VanDerWaalsContact O-CB 3.26Å; Y137-S140 WeakPolarHBondContact O-CB 3.41Å; Y137-S140 PolarHBondContact O-N 3.27Å; M138-S140 VanDerWaalsContact C-N 3.29Å; M138-S140 PolarHBondContact O-N 3.27Å; S140-Y142 PolarHBondContact O-N 3.29Å; S140-Y142 PolarHBondContact OG-N 3.34Å; S140-N143 WeakPolarHBondContact O-CA 3.28Å; S140-N143 WeakPolarHBondContact O-CB 3.43Å; S140-N143 PolarHBondContact O-N 3.01Å; S140-T144 PolarHBondContact O-N 2.91Å; S140-T144 PolarHBondContact O-OG1 3.28Å; S140-T144 VanDerWaalsContact O-OG1 3.1Å | ||
| 141 | V | 59.7 | Low | 68.1 | Low | 37 Ų | 37 | 82.5 Ų | 82.5 | 22% | 0.224 | 41% | 0.405 | C | S | . | . | H | α-helix | trans | -51.4 | -31.8 | 175.9 | 177.5 | 0 | 0 | 0 | 0 | 112.3 | M59 M61 V64 R145 | M59-V141 WeakPolarHBondContact O-CG2 3.41Å; M61-V141 HydrophobicContact CG-CG2 4.35Å; V64-V141 HydrophobicContact CG2-CG1 3.95Å; V141-R145 WeakPolarHBondContact O-CG 3.04Å; V141-R145 PolarHBondContact O-N 3.38Å |
| 142 | Y | 60.1 | Low | 69.1 | Low | 142 Ų | 142 | 81.2 Ų | 81.2 | 56% | 0.557 | 40% | 0.4 | S | S | * | . | H | α-helix | trans | -67.6 | -44.8 | 176.4 | -177.2 | -95.9 | 0 | 0 | 0 | 111.8 | S140 R145 H146 | S140-Y142 PolarHBondContact O-N 3.29Å; S140-Y142 PolarHBondContact OG-N 3.34Å; Y142-R145 PolarHBondContact O-N 2.86Å; Y142-H146 AromaticContact CD1-CD2 3.83Å; Y142-H146 AromaticContact CE1-CD2 3.45Å; Y142-H146 VanDerWaalsContact CE1-CD2 3.45Å; Y142-H146 WeakPolarHBondContact CE1-CD2 3.3Å; Y142-H146 AromaticContact CE1-NE2 3.27Å; Y142-H146 VanDerWaalsContact CE1-NE2 3.27Å; Y142-H146 WeakPolarHBondContact CE1-NE2 3.47Å; Y142-H146 AromaticContact CE2-NE2 3.75Å; Y142-H146 AromaticContact CZ-CD2 3.75Å; Y142-H146 AromaticContact CZ-NE2 3.09Å; Y142-H146 PolarHBondContact O-CD2 3.47Å; Y142-H146 VanDerWaalsContact O-CD2 3.28Å; Y142-H146 PolarHBondContact O-N 2.84Å; Y142-H146 PolarHBondContact OH-NE2 2.8Å |
| 143 | N | 68.7 | Low | 69.9 | Low | 66 Ų | 66 | 81.3 Ų | 81.3 | 35% | 0.353 | 41% | 0.405 | S | S | . | . | H | α-helix | trans | -64.5 | -42.7 | 177.3 | -166.8 | 33.1 | 0 | 0 | 0 | 110.6 | M138 S140 R145 H146 V147 | M138-N143 PolarHBondContact O-ND2 3.22Å; S140-N143 WeakPolarHBondContact O-CA 3.28Å; S140-N143 WeakPolarHBondContact O-CB 3.43Å; S140-N143 PolarHBondContact O-N 3.01Å; N143-R145 VanDerWaalsContact C-N 3.29Å; N143-R145 PolarHBondContact O-N 2.94Å; N143-H146 PolarHBondContact O-N 3.31Å; N143-H146 VanDerWaalsContact O-N 3.13Å; N143-V147 WeakPolarHBondContact O-CG2 3.45Å; N143-V147 PolarHBondContact O-N 2.85Å |
| 144 | T | 75.1 | Confident | 70.8 | Confident | 1 Ų | 1 | 78.1 Ų | 78.1 | 1% | 0.006 | 39% | 0.394 | C | S | . | . | H | α-helix | trans | -57.8 | -39.3 | 177.8 | -38.4 | 0 | 0 | 0 | 0 | 112.8 | M61 V64 Y65 S140 V147 C148 | M61-T144 HydrophobicContact CE-CG2 4.43Å; M61-T144 WeakPolarHBondContact CE-OG1 3.48Å; V64-T144 HydrophobicContact CB-CG2 3.76Å; V64-T144 HydrophobicContact CG1-CG2 3.69Å; V64-T144 HydrophobicContact CG2-CG2 4.48Å; Y65-T144 HydrophobicContact CD1-CG2 4.41Å; Y65-T144 HydrophobicContact CD2-CG2 3.94Å; Y65-T144 HydrophobicContact CE1-CG2 3.95Å; Y65-T144 HydrophobicContact CE2-CG2 3.43Å; Y65-T144 VanDerWaalsContact CE2-CG2 3.43Å; Y65-T144 HydrophobicContact CG-CG2 4.39Å; Y65-T144 VanDerWaalsContact CZ-CG2 3.42Å; S140-T144 PolarHBondContact O-N 2.91Å; S140-T144 PolarHBondContact O-OG1 3.28Å; S140-T144 VanDerWaalsContact O-OG1 3.1Å; T144-V147 PolarHBondContact O-N 3.43Å; T144-C148 WeakPolarHBondContact O-CB 3.22Å; T144-C148 PolarHBondContact O-N 2.91Å; T144-C148 PolarHBondContact O-SG 3.46Å |
| 145 | R | 80 | Confident | 72.3 | Confident | 113 Ų | 113 | 73.5 Ų | 73.5 | 43% | 0.426 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -64.4 | -41.8 | 178.4 | -73.3 | 174.8 | -176 | 170.4 | 5.7 | 111.9 | V64 V141 Y142 N143 G149 | V64-R145 HydrophobicContact CG1-CG 4.09Å; V64-R145 HydrophobicContact CG2-CG 4.46Å; V141-R145 WeakPolarHBondContact O-CG 3.04Å; V141-R145 PolarHBondContact O-N 3.38Å; Y142-R145 PolarHBondContact O-N 2.86Å; N143-R145 VanDerWaalsContact C-N 3.29Å; N143-R145 PolarHBondContact O-N 2.94Å; R145-G149 PolarHBondContact O-N 3.46Å |
| 146 | H | 82.1 | Confident | 73.8 | Confident | 105 Ų | 105 | 65.7 Ų | 65.7 | 49% | 0.486 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -67.2 | -43.7 | 176.1 | -76.3 | -69 | 0 | 0 | 0 | 111.8 | Y142 N143 C148 G149 F150 | Y142-H146 AromaticContact CD1-CD2 3.83Å; Y142-H146 AromaticContact CE1-CD2 3.45Å; Y142-H146 VanDerWaalsContact CE1-CD2 3.45Å; Y142-H146 WeakPolarHBondContact CE1-CD2 3.3Å; Y142-H146 AromaticContact CE1-NE2 3.27Å; Y142-H146 VanDerWaalsContact CE1-NE2 3.27Å; Y142-H146 WeakPolarHBondContact CE1-NE2 3.47Å; Y142-H146 AromaticContact CE2-NE2 3.75Å; Y142-H146 AromaticContact CZ-CD2 3.75Å; Y142-H146 AromaticContact CZ-NE2 3.09Å; Y142-H146 PolarHBondContact O-CD2 3.47Å; Y142-H146 VanDerWaalsContact O-CD2 3.28Å; Y142-H146 PolarHBondContact O-N 2.84Å; Y142-H146 PolarHBondContact OH-NE2 2.8Å; N143-H146 PolarHBondContact O-N 3.31Å; N143-H146 VanDerWaalsContact O-N 3.13Å; H146-C148 PolarHBondContact O-N 3.23Å; H146-G149 WeakPolarHBondContact O-CA 3.45Å; H146-G149 PolarHBondContact O-N 2.77Å; H146-G149 VanDerWaalsContact O-N 3.12Å; H146-F150 PolarHBondContact O-N 3.07Å |
| 147 | V | 80.8 | Confident | 75.3 | Confident | 42 Ų | 42 | 68.4 Ų | 68.4 | 26% | 0.255 | 35% | 0.353 | S | S | . | . | H | α-helix | trans | -59.4 | -46.6 | 175.4 | 174.5 | 0 | 0 | 0 | 0 | 110.6 | L122 N143 T144 G149 F150 V151 | L122-V147 HydrophobicContact CD1-CG1 3.6Å; L122-V147 HydrophobicContact CD2-CG1 4.41Å; N143-V147 WeakPolarHBondContact O-CG2 3.45Å; N143-V147 PolarHBondContact O-N 2.85Å; T144-V147 PolarHBondContact O-N 3.43Å; V147-G149 VanDerWaalsContact C-N 3.31Å; V147-G149 PolarHBondContact O-N 2.89Å; V147-F150 WeakPolarHBondContact O-CB 3.36Å; V147-F150 PolarHBondContact O-N 2.92Å; V147-F150 VanDerWaalsContact O-N 3.16Å; V147-V151 WeakPolarHBondContact O-CG2 3.35Å; V147-V151 PolarHBondContact O-N 3.34Å |
| 148 | C | 84.2 | Confident | 76.8 | Confident | 8 Ų | 8 | 61.9 Ų | 61.9 | 5% | 0.054 | 33% | 0.331 | C | S | . | . | H | α-helix | trans | -60.3 | -40.2 | 174.6 | -72.4 | 0 | 0 | 0 | 0 | 112.1 | T144 H146 V151 W152 | T144-C148 WeakPolarHBondContact O-CB 3.22Å; T144-C148 PolarHBondContact O-N 2.91Å; T144-C148 PolarHBondContact O-SG 3.46Å; H146-C148 PolarHBondContact O-N 3.23Å; C148-V151 PolarHBondContact O-N 2.99Å; C148-W152 VanDerWaalsContact O-CD1 3.26Å; C148-W152 PolarHBondContact O-N 2.92Å |
| 149 | G | 83.9 | Confident | 78.2 | Confident | 43 Ų | 43 | 56 Ų | 56 | 44% | 0.443 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -60 | -43.1 | 173.4 | 0 | 0 | 0 | 0 | 0 | 112.9 | R145 H146 V147 W152 G153 | R145-G149 PolarHBondContact O-N 3.46Å; H146-G149 WeakPolarHBondContact O-CA 3.45Å; H146-G149 PolarHBondContact O-N 2.77Å; H146-G149 VanDerWaalsContact O-N 3.12Å; V147-G149 VanDerWaalsContact C-N 3.31Å; V147-G149 PolarHBondContact O-N 2.89Å; G149-W152 PolarHBondContact O-N 3.46Å; G149-G153 PolarHBondContact O-N 3.45Å |
| 150 | F | 87.6 | Confident | 79.2 | Confident | 168 Ų | 168 | 60 Ų | 60 | 74% | 0.737 | 32% | 0.315 | S | S | * | . | H | α-helix | trans | -64.5 | -40 | 175.1 | -175.6 | -96.1 | 0 | 0 | 0 | 112.1 | H146 V147 W152 G153 G154 | H146-F150 PolarHBondContact O-N 3.07Å; V147-F150 WeakPolarHBondContact O-CB 3.36Å; V147-F150 PolarHBondContact O-N 2.92Å; V147-F150 VanDerWaalsContact O-N 3.16Å; F150-W152 VanDerWaalsContact C-N 3.33Å; F150-W152 PolarHBondContact O-N 3.21Å; F150-G153 PolarHBondContact O-N 2.8Å; F150-G154 PolarHBondContact O-N 3.02Å |
| 151 | V | 88.5 | Confident | 79.7 | Confident | 17 Ų | 17 | 60.5 Ų | 60.5 | 10% | 0.103 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -59.5 | -43.6 | 175.3 | 171.2 | 0 | 0 | 0 | 0 | 110.9 | V115 L122 V147 C148 A155 | V115-V151 HydrophobicContact CG2-CG1 4.26Å; L122-V151 HydrophobicContact CD1-CG2 3.82Å; V147-V151 WeakPolarHBondContact O-CG2 3.35Å; V147-V151 PolarHBondContact O-N 3.34Å; C148-V151 PolarHBondContact O-N 2.99Å; V151-A155 WeakPolarHBondContact O-CB 3.28Å; V151-A155 PolarHBondContact O-N 3.46Å |
| 152 | W | 90.2 | Very high | 79.9 | Confident | 59 Ų | 59 | 60 Ų | 60 | 22% | 0.223 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -63.1 | -46.7 | 174.6 | -83.9 | 100.1 | 0 | 0 | 0 | 112.6 | N68 V71 V111 V115 C148 G149 F150 A155 L156 | N68-W152 PolarHBondContact OD1-NE1 3.37Å; V71-W152 HydrophobicContact CB-CZ2 4.16Å; V71-W152 HydrophobicContact CG1-CH2 4.06Å; V71-W152 HydrophobicContact CG1-CZ2 3.64Å; V111-W152 HydrophobicContact CG1-CE3 3.64Å; V111-W152 HydrophobicContact CG1-CZ3 3.47Å; V111-W152 VanDerWaalsContact CG1-CZ3 3.47Å; V115-W152 HydrophobicContact CB-CZ2 4.35Å; V115-W152 HydrophobicContact CG1-CZ2 3.8Å; V115-W152 HydrophobicContact CG2-CD2 3.68Å; V115-W152 HydrophobicContact CG2-CE3 3.87Å; V115-W152 HydrophobicContact CG2-CG 4.18Å; V115-W152 HydrophobicContact CG2-CH2 4.19Å; V115-W152 HydrophobicContact CG2-CZ2 4.01Å; V115-W152 HydrophobicContact CG2-CZ3 4.13Å; C148-W152 VanDerWaalsContact O-CD1 3.26Å; C148-W152 PolarHBondContact O-N 2.92Å; G149-W152 PolarHBondContact O-N 3.46Å; F150-W152 VanDerWaalsContact C-N 3.33Å; F150-W152 PolarHBondContact O-N 3.21Å; W152-A155 PolarHBondContact O-N 3.42Å; W152-L156 WeakPolarHBondContact O-CB 3.42Å; W152-L156 WeakPolarHBondContact O-CG 3.25Å; W152-L156 PolarHBondContact O-N 2.92Å |
| 153 | G | 87 | Confident | 80.2 | Confident | 40 Ų | 40 | 54 Ų | 54 | 41% | 0.412 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -60.5 | -46.9 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.4 | G149 F150 L156 L157 | G149-G153 PolarHBondContact O-N 3.45Å; F150-G153 PolarHBondContact O-N 2.8Å; G153-L156 PolarHBondContact O-N 3.24Å; G153-L157 WeakPolarHBondContact O-CB 3.32Å; G153-L157 PolarHBondContact O-N 3.08Å |
| 154 | G | 85.3 | Confident | 80 | Confident | 25 Ų | 25 | 55.2 Ų | 55.2 | 26% | 0.258 | 30% | 0.3 | S | S | . | . | H | α-helix | trans | -63.9 | -40.2 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.8 | F150 L157 T158 | F150-G154 PolarHBondContact O-N 3.02Å; G154-L157 PolarHBondContact O-N 3.43Å; G154-T158 VanDerWaalsContact O-CB 3.3Å; G154-T158 WeakPolarHBondContact O-CB 3.39Å; G154-T158 PolarHBondContact O-N 3.16Å; G154-T158 PolarHBondContact O-OG1 3.17Å |
| 155 | A | 87 | Confident | 79.4 | Confident | 4 Ų | 4 | 59.8 Ų | 59.8 | 3% | 0.033 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -65.7 | -41.9 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | V111 L114 V115 V151 W152 S159 | V111-A155 HydrophobicContact CG1-CB 3.99Å; L114-A155 HydrophobicContact CB-CB 3.8Å; L114-A155 HydrophobicContact CD1-CB 3.91Å; V115-A155 HydrophobicContact CG2-CB 4.16Å; V151-A155 WeakPolarHBondContact O-CB 3.28Å; V151-A155 PolarHBondContact O-N 3.46Å; W152-A155 PolarHBondContact O-N 3.42Å; A155-S159 VanDerWaalsContact O-CB 3.26Å; A155-S159 WeakPolarHBondContact O-CB 3.32Å; A155-S159 PolarHBondContact O-N 2.88Å; A155-S159 PolarHBondContact O-OG 3.14Å |
| 156 | L | 86.2 | Confident | 78.4 | Confident | 92 Ų | 92 | 59.6 Ų | 59.6 | 48% | 0.482 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -63.4 | -47.8 | 174.9 | -79 | 165.7 | 0 | 0 | 0 | 111.3 | V111 W152 G153 S159 F160 | V111-L156 HydrophobicContact CG1-CD2 4.48Å; V111-L156 HydrophobicContact CG1-CG 4.42Å; V111-L156 HydrophobicContact CG2-CD2 3.97Å; V111-L156 HydrophobicContact CG2-CG 4.37Å; W152-L156 WeakPolarHBondContact O-CB 3.42Å; W152-L156 WeakPolarHBondContact O-CG 3.25Å; W152-L156 PolarHBondContact O-N 2.92Å; G153-L156 PolarHBondContact O-N 3.24Å; L156-S159 PolarHBondContact O-N 2.88Å; L156-F160 WeakPolarHBondContact O-CB 2.96Å; L156-F160 PolarHBondContact O-N 3.2Å |
| 157 | L | 83.6 | Confident | 77.4 | Confident | 114 Ų | 114 | 58.3 Ų | 58.3 | 60% | 0.597 | 32% | 0.316 | S | S | * | . | H | α-helix | trans | -61.3 | -48.8 | 179.2 | -176.7 | 63.2 | 0 | 0 | 0 | 111.2 | G153 G154 S159 F160 S161 | G153-L157 WeakPolarHBondContact O-CB 3.32Å; G153-L157 PolarHBondContact O-N 3.08Å; G154-L157 PolarHBondContact O-N 3.43Å; L157-S159 PolarHBondContact O-N 2.84Å; L157-F160 PolarHBondContact O-N 3.08Å; L157-S161 WeakPolarHBondContact O-CB 3.3Å; L157-S161 PolarHBondContact O-N 3Å; L157-S161 PolarHBondContact O-OG 3.37Å; L157-S161 VanDerWaalsContact O-OG 3.13Å |
| 158 | T | 79.4 | Confident | 76.2 | Confident | 38 Ų | 38 | 59 Ų | 59 | 23% | 0.233 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -59.8 | -47.1 | 178.7 | -54.4 | 0 | 0 | 0 | 0 | 110.9 | L114 G154 F160 S161 S162 | L114-T158 HydrophobicContact CD1-CG2 4.42Å; G154-T158 VanDerWaalsContact O-CB 3.3Å; G154-T158 WeakPolarHBondContact O-CB 3.39Å; G154-T158 PolarHBondContact O-N 3.16Å; G154-T158 PolarHBondContact O-OG1 3.17Å; T158-F160 PolarHBondContact O-N 3.07Å; T158-S161 PolarHBondContact O-N 2.79Å; T158-S162 PolarHBondContact O-N 3.05Å; T158-S162 VanDerWaalsContact O-N 3.14Å; T158-S162 PolarHBondContact O-OG 3.49Å |
| 159 | S | 77.4 | Confident | 74.9 | Confident | 0 Ų | 0 | 61.3 Ų | 61.3 | 0% | 0 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -65.8 | -40.3 | 179.7 | -56.5 | 0 | 0 | 0 | 0 | 111.8 | V111 A155 L156 L157 L163 | V111-S159 WeakPolarHBondContact CG2-OG 3.23Å; A155-S159 VanDerWaalsContact O-CB 3.26Å; A155-S159 WeakPolarHBondContact O-CB 3.32Å; A155-S159 PolarHBondContact O-N 2.88Å; A155-S159 PolarHBondContact O-OG 3.14Å; L156-S159 PolarHBondContact O-N 2.88Å; L157-S159 PolarHBondContact O-N 2.84Å; S159-L163 VanDerWaalsContact O-CD1 3.24Å; S159-L163 WeakPolarHBondContact O-CD1 3.45Å; S159-L163 WeakPolarHBondContact O-CG 3.14Å; S159-L163 PolarHBondContact O-N 2.62Å |
| 160 | F | 75 | Confident | 73.4 | Confident | 110 Ų | 110 | 65.9 Ų | 65.9 | 48% | 0.482 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -66.5 | -43.3 | 178.1 | -176.6 | -105.7 | 0 | 0 | 0 | 112.2 | L156 L157 T158 S162 L163 L164 | L156-F160 WeakPolarHBondContact O-CB 2.96Å; L156-F160 PolarHBondContact O-N 3.2Å; L157-F160 PolarHBondContact O-N 3.08Å; T158-F160 PolarHBondContact O-N 3.07Å; F160-S162 PolarHBondContact O-N 3.42Å; F160-L163 PolarHBondContact O-N 3.25Å; F160-L163 VanDerWaalsContact O-N 3.14Å; F160-L164 HydrophobicContact CD1-CD1 3.98Å; F160-L164 HydrophobicContact CD1-CG 4.32Å; F160-L164 HydrophobicContact CE1-CD1 3.42Å; F160-L164 VanDerWaalsContact CE1-CD1 3.42Å; F160-L164 HydrophobicContact CE1-CD2 4.35Å; F160-L164 HydrophobicContact CE1-CG 3.9Å; F160-L164 HydrophobicContact CE2-CD2 4.46Å; F160-L164 HydrophobicContact CE2-CG 4.5Å; F160-L164 HydrophobicContact CZ-CD1 3.9Å; F160-L164 HydrophobicContact CZ-CD2 3.97Å; F160-L164 HydrophobicContact CZ-CG 3.99Å; F160-L164 PolarHBondContact O-N 3.33Å |
| 161 | S | 71.8 | Confident | 71.9 | Confident | 47 Ų | 47 | 63.2 Ų | 63.2 | 33% | 0.329 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -58.2 | -49.4 | 175.8 | -68.4 | 0 | 0 | 0 | 0 | 111.4 | L157 T158 L163 L164 F165 | L157-S161 WeakPolarHBondContact O-CB 3.3Å; L157-S161 PolarHBondContact O-N 3Å; L157-S161 PolarHBondContact O-OG 3.37Å; L157-S161 VanDerWaalsContact O-OG 3.13Å; T158-S161 PolarHBondContact O-N 2.79Å; S161-L163 PolarHBondContact O-N 3.43Å; S161-L163 VanDerWaalsContact O-N 3.12Å; S161-L164 PolarHBondContact O-N 3.32Å; S161-F165 WeakPolarHBondContact O-CD2 3.35Å; S161-F165 PolarHBondContact O-N 3.42Å |
| 162 | S | 65.2 | Low | 69.9 | Low | 27 Ų | 27 | 64.5 Ų | 64.5 | 19% | 0.189 | 36% | 0.355 | C | S | . | . | H | α-helix | trans | -55.9 | -31.4 | 177.3 | -64.2 | 0 | 0 | 0 | 0 | 113 | T158 F160 Y166 | T158-S162 PolarHBondContact O-N 3.05Å; T158-S162 VanDerWaalsContact O-N 3.14Å; T158-S162 PolarHBondContact O-OG 3.49Å; F160-S162 PolarHBondContact O-N 3.42Å; S162-Y166 PolarHBondContact O-N 2.84Å; S162-Y166 VanDerWaalsContact O-N 3.14Å |
| 163 | L | 64.6 | Low | 68 | Low | 14 Ų | 14 | 69 Ų | 69 | 7% | 0.073 | 39% | 0.389 | C | S | . | . | H | α-helix | trans | -83.7 | -37.2 | -176.8 | -67.5 | 166.5 | 0 | 0 | 0 | 113.9 | V103 I107 S159 F160 S161 F165 Y166 I167 | V103-L163 HydrophobicContact CG1-CB 4.38Å; V103-L163 HydrophobicContact CG1-CD1 4.4Å; V103-L163 HydrophobicContact CG1-CD2 3.65Å; V103-L163 HydrophobicContact CG1-CG 4.35Å; I107-L163 HydrophobicContact CB-CD1 3.75Å; I107-L163 HydrophobicContact CD1-CD1 3.26Å; I107-L163 HydrophobicContact CG1-CD1 3.16Å; I107-L163 HydrophobicContact CG2-CD1 3.68Å; S159-L163 VanDerWaalsContact O-CD1 3.24Å; S159-L163 WeakPolarHBondContact O-CD1 3.45Å; S159-L163 WeakPolarHBondContact O-CG 3.14Å; S159-L163 PolarHBondContact O-N 2.62Å; F160-L163 PolarHBondContact O-N 3.25Å; F160-L163 VanDerWaalsContact O-N 3.14Å; S161-L163 PolarHBondContact O-N 3.43Å; S161-L163 VanDerWaalsContact O-N 3.12Å; L163-F165 PolarHBondContact O-N 3.27Å; L163-Y166 PolarHBondContact O-N 2.88Å; L163-Y166 VanDerWaalsContact O-N 3.14Å; L163-I167 WeakPolarHBondContact O-CG1 3.39Å; L163-I167 PolarHBondContact O-N 2.91Å |
| 164 | L | 65.3 | Low | 66.2 | Low | 93 Ų | 93 | 76.7 Ų | 76.7 | 49% | 0.487 | 41% | 0.406 | S | S | . | . | H | α-helix | trans | -57 | -39.8 | 171.2 | -73.2 | -178.7 | 0 | 0 | 0 | 110.4 | F160 S161 C168 | F160-L164 HydrophobicContact CD1-CD1 3.98Å; F160-L164 HydrophobicContact CD1-CG 4.32Å; F160-L164 HydrophobicContact CE1-CD1 3.42Å; F160-L164 VanDerWaalsContact CE1-CD1 3.42Å; F160-L164 HydrophobicContact CE1-CD2 4.35Å; F160-L164 HydrophobicContact CE1-CG 3.9Å; F160-L164 HydrophobicContact CE2-CD2 4.46Å; F160-L164 HydrophobicContact CE2-CG 4.5Å; F160-L164 HydrophobicContact CZ-CD1 3.9Å; F160-L164 HydrophobicContact CZ-CD2 3.97Å; F160-L164 HydrophobicContact CZ-CG 3.99Å; F160-L164 PolarHBondContact O-N 3.33Å; S161-L164 PolarHBondContact O-N 3.32Å; L164-C168 VanDerWaalsContact O-CB 3.26Å; L164-C168 WeakPolarHBondContact O-CB 3.16Å; L164-C168 PolarHBondContact O-N 2.83Å; L164-C168 VanDerWaalsContact O-N 3.08Å |
| 165 | F | 61.6 | Low | 64.6 | Low | 96 Ų | 96 | 77.3 Ų | 77.3 | 42% | 0.421 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -66 | -43.5 | 174.2 | -70.4 | -63.3 | 0 | 0 | 0 | 112.7 | S161 L163 C168 S169 | S161-F165 WeakPolarHBondContact O-CD2 3.35Å; S161-F165 PolarHBondContact O-N 3.42Å; L163-F165 PolarHBondContact O-N 3.27Å; F165-C168 PolarHBondContact O-N 2.9Å; F165-S169 PolarHBondContact O-N 3.07Å |
| 166 | Y | 59.2 | Low | 62.8 | Low | 110 Ų | 110 | 84.1 Ų | 84.1 | 43% | 0.431 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -59.7 | -50.5 | 176.1 | 179.7 | -95.1 | 0 | 0 | 0 | 112.4 | V103 S162 L163 C168 S169 H170 | V103-Y166 HydrophobicContact CG2-CD1 3.69Å; V103-Y166 HydrophobicContact CG2-CE1 3.55Å; S162-Y166 PolarHBondContact O-N 2.84Å; S162-Y166 VanDerWaalsContact O-N 3.14Å; L163-Y166 PolarHBondContact O-N 2.88Å; L163-Y166 VanDerWaalsContact O-N 3.14Å; Y166-C168 VanDerWaalsContact C-N 3.31Å; Y166-C168 PolarHBondContact O-N 2.97Å; Y166-S169 PolarHBondContact O-N 3.34Å; Y166-S169 PolarHBondContact O-OG 3.4Å; Y166-H170 PolarHBondContact O-N 3.2Å |
| 167 | I | 61.2 | Low | 61 | Low | 77 Ų | 77 | 87.2 Ų | 87.2 | 40% | 0.395 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -62 | -41.1 | -179.5 | -65.3 | 167.5 | 0 | 0 | 0 | 110.8 | V103 L163 S169 H170 V171 | V103-I167 HydrophobicContact CG1-CD1 4.17Å; V103-I167 HydrophobicContact CG1-CG1 4.4Å; L163-I167 WeakPolarHBondContact O-CG1 3.39Å; L163-I167 PolarHBondContact O-N 2.91Å; I167-S169 VanDerWaalsContact C-N 3.27Å; I167-S169 PolarHBondContact O-N 2.97Å; I167-H170 PolarHBondContact O-N 2.96Å; I167-V171 HydrophobicContact CG2-CG2 4.16Å; I167-V171 WeakPolarHBondContact O-CB 3.26Å; I167-V171 PolarHBondContact O-N 2.61Å |
| 168 | C | 56.5 | Low | 59.3 | Low | 57 Ų | 57 | 84.6 Ų | 84.6 | 39% | 0.385 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -62.5 | -35.3 | 179.8 | -152.4 | 0 | 0 | 0 | 0 | 112.4 | L164 F165 Y166 C178 | L164-C168 VanDerWaalsContact O-CB 3.26Å; L164-C168 WeakPolarHBondContact O-CB 3.16Å; L164-C168 PolarHBondContact O-N 2.83Å; L164-C168 VanDerWaalsContact O-N 3.08Å; F165-C168 PolarHBondContact O-N 2.9Å; Y166-C168 VanDerWaalsContact C-N 3.31Å; Y166-C168 PolarHBondContact O-N 2.97Å; C168-C178 PolarHBondContact SG-SG 3.41Å |
| 169 | S | 55.7 | Low | 57.8 | Low | 56 Ų | 56 | 85.5 Ų | 85.5 | 39% | 0.392 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -72.4 | -33.1 | 176.1 | 73.5 | 0 | 0 | 0 | 0 | 114.2 | F165 Y166 I167 | F165-S169 PolarHBondContact O-N 3.07Å; Y166-S169 PolarHBondContact O-N 3.34Å; Y166-S169 PolarHBondContact O-OG 3.4Å; I167-S169 VanDerWaalsContact C-N 3.27Å; I167-S169 PolarHBondContact O-N 2.97Å |
| 170 | H | 52.4 | Low | 56.3 | Low | 139 Ų | 139 | 93.9 Ų | 93.9 | 64% | 0.644 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -95.6 | -24.9 | -170.4 | -165 | -68.2 | 0 | 0 | 0 | 114.1 | Y166 I167 | Y166-H170 PolarHBondContact O-N 3.2Å; I167-H170 PolarHBondContact O-N 2.96Å |
| 171 | V | 55.7 | Low | 54.8 | Low | 112 Ų | 112 | 96.6 Ų | 96.6 | 68% | 0.679 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -103.5 | -20.9 | -172.1 | 175.3 | 0 | 0 | 0 | 0 | 113.6 | I167 | I167-V171 HydrophobicContact CG2-CG2 4.16Å; I167-V171 WeakPolarHBondContact O-CB 3.26Å; I167-V171 PolarHBondContact O-N 2.61Å |
| 172 | S | 48.2 | Very low | 53.6 | Low | 45 Ų | 45 | 99 Ų | 99 | 32% | 0.315 | 52% | 0.516 | S | S | . | . | trans | -87 | 124.9 | -174.5 | -177.5 | 0 | 0 | 0 | 0 | 113 | R174 A175 | S172-R174 PolarHBondContact O-N 3.38Å; S172-R174 VanDerWaalsContact O-N 3.14Å; S172-R174 PolarHBondContact OG-N 2.9Å; S172-R174 VanDerWaalsContact OG-N 3.14Å; S172-A175 VanDerWaalsContact O-CB 3.29Å; S172-A175 WeakPolarHBondContact O-CB 3.48Å; S172-A175 PolarHBondContact O-N 3.28Å | ||
| 173 | T | 50.5 | Low | 53.2 | Low | 152 Ų | 152 | 102.8 Ų | 102.8 | 93% | 0.933 | 53% | 0.534 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -66.2 | -6.3 | 167.7 | 47.7 | 0 | 0 | 0 | 0 | 113.5 | ||
| 174 | R | 49.3 | Very low | 52.7 | Low | 203 Ų | 203 | 105.4 Ų | 105.4 | 77% | 0.766 | 56% | 0.558 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -101.4 | 30.6 | 167.3 | -59.4 | -173.6 | -169.4 | 175.6 | 3.8 | 112.2 | S172 L176 E177 | S172-R174 PolarHBondContact O-N 3.38Å; S172-R174 VanDerWaalsContact O-N 3.14Å; S172-R174 PolarHBondContact OG-N 2.9Å; S172-R174 VanDerWaalsContact OG-N 3.14Å; R174-L176 PolarHBondContact O-N 2.99Å; R174-E177 PolarHBondContact O-N 3Å; R174-E177 VanDerWaalsContact O-N 3.15Å |
| 175 | A | 50.7 | Low | 52.4 | Low | 37 Ų | 37 | 104.7 Ų | 104.7 | 31% | 0.306 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -51.3 | -28.4 | -178.6 | 0 | 0 | 0 | 0 | 0 | 114 | S172 E177 A179 | S172-A175 VanDerWaalsContact O-CB 3.29Å; S172-A175 WeakPolarHBondContact O-CB 3.48Å; S172-A175 PolarHBondContact O-N 3.28Å; A175-E177 VanDerWaalsContact C-N 3.3Å; A175-E177 PolarHBondContact O-N 3.27Å; A175-A179 WeakPolarHBondContact O-CB 3.41Å; A175-A179 PolarHBondContact O-N 3.27Å |
| 176 | L | 50 | Low | 52.4 | Low | 147 Ų | 147 | 102.1 Ų | 102.1 | 77% | 0.77 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -68.7 | -24.2 | -177.5 | -161.5 | 69.3 | 0 | 0 | 0 | 113.9 | R174 K180 | R174-L176 PolarHBondContact O-N 2.99Å; L176-K180 WeakPolarHBondContact O-CB 3.5Å |
| 177 | E | 47.7 | Very low | 52.5 | Low | 157 Ų | 157 | 97.7 Ų | 97.7 | 73% | 0.734 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -95.4 | -29.4 | 178.3 | -62.8 | -129.6 | 142 | 0 | 0 | 112.8 | R174 A175 | R174-E177 PolarHBondContact O-N 3Å; R174-E177 VanDerWaalsContact O-N 3.15Å; A175-E177 VanDerWaalsContact C-N 3.3Å; A175-E177 PolarHBondContact O-N 3.27Å |
| 178 | C | 48.2 | Very low | 52.7 | Low | 59 Ų | 59 | 96.7 Ų | 96.7 | 40% | 0.399 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -77.2 | -37.1 | 171.3 | -102.6 | 0 | 0 | 0 | 0 | 112.7 | C168 K180 M181 | C168-C178 PolarHBondContact SG-SG 3.41Å; C178-K180 PolarHBondContact O-N 3.28Å; C178-M181 PolarHBondContact O-N 3.07Å |
| 179 | A | 47.7 | Very low | 53.3 | Low | 57 Ų | 57 | 96 Ų | 96 | 47% | 0.471 | 53% | 0.528 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -67.8 | -23.5 | 172.7 | 0 | 0 | 0 | 0 | 0 | 112.5 | A175 M181 | A175-A179 WeakPolarHBondContact O-CB 3.41Å; A175-A179 PolarHBondContact O-N 3.27Å; A179-M181 VanDerWaalsContact C-N 3.29Å; A179-M181 PolarHBondContact O-N 3.47Å |
| 180 | K | 46.1 | Very low | 54 | Low | 176 Ų | 176 | 96.8 Ų | 96.8 | 77% | 0.765 | 53% | 0.531 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -75.5 | -15.6 | 175.2 | -123 | 175.5 | 177.7 | 178.2 | 0 | 113.8 | L176 C178 | L176-K180 WeakPolarHBondContact O-CB 3.5Å; C178-K180 PolarHBondContact O-N 3.28Å |
| 181 | M | 43.4 | Very low | 55 | Low | 168 Ų | 168 | 90.7 Ų | 90.7 | 83% | 0.828 | 50% | 0.503 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -107.8 | -9.4 | -172.9 | -146.9 | 160.3 | -175.7 | 0 | 0 | 114.2 | C178 A179 | C178-M181 PolarHBondContact O-N 3.07Å; A179-M181 VanDerWaalsContact C-N 3.29Å; A179-M181 PolarHBondContact O-N 3.47Å |
| 182 | Q | 47.3 | Very low | 56.1 | Low | 98 Ų | 98 | 85.8 Ų | 85.8 | 46% | 0.458 | 47% | 0.473 | S | S | . | . | S | Bend | trans | -154.4 | 112.1 | 167.5 | -145.6 | 133.3 | -9.4 | 0 | 0 | 110.9 | A184 | Q182-A184 PolarHBondContact O-N 3.29Å; Q182-A184 VanDerWaalsContact O-N 3.07Å |
| 183 | N | 55.9 | Low | 57.6 | Low | 105 Ų | 105 | 89.2 Ų | 89.2 | 56% | 0.561 | 48% | 0.483 | S | S | * | . | trans | -55.4 | 116.5 | 171.2 | -58.9 | -36.3 | 0 | 0 | 0 | 107.4 | E185 A186 A187 | N183-E185 HydrophobicContact CB-CB 4.22Å; N183-E185 PolarHBondContact O-N 2.64Å; N183-A186 HydrophobicContact CB-CB 4.11Å; N183-A186 WeakPolarHBondContact O-CA 3.15Å; N183-A186 VanDerWaalsContact O-CB 3.32Å; N183-A186 WeakPolarHBondContact O-CB 3.24Å; N183-A186 PolarHBondContact O-N 3.16Å; N183-A187 PolarHBondContact O-N 2.91Å | ||
| 184 | A | 54.3 | Low | 59.1 | Low | 69 Ų | 69 | 84.4 Ų | 84.4 | 57% | 0.57 | 45% | 0.451 | S | S | * | . | H | α-helix | trans | -51.9 | -29.9 | 172.7 | 0 | 0 | 0 | 0 | 0 | 111.2 | Q182 A186 A187 D188 | Q182-A184 PolarHBondContact O-N 3.29Å; Q182-A184 VanDerWaalsContact O-N 3.07Å; A184-A186 VanDerWaalsContact C-N 3.33Å; A184-A186 PolarHBondContact O-N 2.87Å; A184-A187 PolarHBondContact O-N 3.24Å; A184-D188 PolarHBondContact O-N 3.39Å; A184-D188 VanDerWaalsContact O-N 3.11Å |
| 185 | E | 59.1 | Low | 60.5 | Low | 78 Ų | 78 | 74.8 Ų | 74.8 | 36% | 0.364 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -55.4 | -41.1 | 169.3 | -57 | 177 | -171.2 | 0 | 0 | 113.8 | N183 A189 S261 | N183-E185 HydrophobicContact CB-CB 4.22Å; N183-E185 PolarHBondContact O-N 2.64Å; E185-A189 WeakPolarHBondContact O-CB 3.26Å; E185-A189 PolarHBondContact O-N 2.9Å; E185-S261 WeakPolarHBondContact OE1-CA 3.38Å; E185-S261 WeakPolarHBondContact OE1-CB 3.49Å; E185-S261 WeakPolarHBondContact OE2-CB 3.34Å |
| 186 | A | 60.2 | Low | 62.1 | Low | 42 Ų | 42 | 75.3 Ų | 75.3 | 35% | 0.347 | 41% | 0.409 | S | S | . | . | H | α-helix | trans | -70.3 | -34.5 | 178.9 | 0 | 0 | 0 | 0 | 0 | 111.4 | N183 A184 T190 | N183-A186 HydrophobicContact CB-CB 4.11Å; N183-A186 WeakPolarHBondContact O-CA 3.15Å; N183-A186 VanDerWaalsContact O-CB 3.32Å; N183-A186 WeakPolarHBondContact O-CB 3.24Å; N183-A186 PolarHBondContact O-N 3.16Å; A184-A186 VanDerWaalsContact C-N 3.33Å; A184-A186 PolarHBondContact O-N 2.87Å; A186-T190 WeakPolarHBondContact O-CB 3.45Å; A186-T190 PolarHBondContact O-N 3.35Å; A186-T190 PolarHBondContact O-OG1 2.97Å |
| 187 | A | 62.9 | Low | 63.8 | Low | 18 Ų | 18 | 70.6 Ų | 70.6 | 15% | 0.149 | 39% | 0.386 | C | S | . | . | H | α-helix | trans | -69.2 | -46.2 | 177.4 | 0 | 0 | 0 | 0 | 0 | 111.6 | N183 A184 T190 L191 | N183-A187 PolarHBondContact O-N 2.91Å; A184-A187 PolarHBondContact O-N 3.24Å; A187-T190 PolarHBondContact O-N 3.37Å; A187-L191 PolarHBondContact O-N 3.07Å |
| 188 | D | 65.2 | Low | 65.7 | Low | 55 Ų | 55 | 65.8 Ų | 65.8 | 29% | 0.294 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -70 | -39.1 | 177.4 | -71.2 | -18.1 | 0 | 0 | 0 | 111.8 | A184 T190 L191 V192 T257 | A184-D188 PolarHBondContact O-N 3.39Å; A184-D188 VanDerWaalsContact O-N 3.11Å; D188-T190 VanDerWaalsContact C-N 3.31Å; D188-T190 PolarHBondContact O-N 2.92Å; D188-L191 PolarHBondContact O-N 3.04Å; D188-V192 WeakPolarHBondContact O-CG2 3.31Å; D188-V192 PolarHBondContact O-N 3.28Å; D188-T257 HydrophobicContact CB-CG2 3.24Å; D188-T257 WeakPolarHBondContact OD2-CG2 3.44Å |
| 189 | A | 68.4 | Low | 67.6 | Low | 43 Ų | 43 | 63 Ų | 63 | 36% | 0.355 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -62.7 | -38.9 | 172.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | E185 L191 V192 F193 | E185-A189 WeakPolarHBondContact O-CB 3.26Å; E185-A189 PolarHBondContact O-N 2.9Å; A189-L191 VanDerWaalsContact C-N 3.34Å; A189-V192 PolarHBondContact O-N 3.31Å; A189-F193 VanDerWaalsContact O-CB 3.24Å; A189-F193 WeakPolarHBondContact O-CB 3.29Å; A189-F193 PolarHBondContact O-N 2.8Å |
| 190 | T | 71.3 | Confident | 69.6 | Low | 73 Ų | 73 | 61.3 Ų | 61.3 | 45% | 0.448 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -64.4 | -40.2 | 173.7 | -61.4 | 0 | 0 | 0 | 0 | 110.9 | A186 A187 D188 F193 I194 | A186-T190 WeakPolarHBondContact O-CB 3.45Å; A186-T190 PolarHBondContact O-N 3.35Å; A186-T190 PolarHBondContact O-OG1 2.97Å; A187-T190 PolarHBondContact O-N 3.37Å; D188-T190 VanDerWaalsContact C-N 3.31Å; D188-T190 PolarHBondContact O-N 2.92Å; T190-F193 PolarHBondContact O-N 3.26Å; T190-I194 HydrophobicContact CG2-CD1 3.51Å; T190-I194 HydrophobicContact CG2-CG1 4.11Å; T190-I194 WeakPolarHBondContact O-CB 3.27Å; T190-I194 VanDerWaalsContact O-CG1 3.31Å; T190-I194 WeakPolarHBondContact O-CG1 3Å; T190-I194 PolarHBondContact O-N 3.02Å |
| 191 | L | 72.8 | Confident | 71.7 | Confident | 10 Ų | 10 | 58 Ų | 58 | 5% | 0.052 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -67.4 | -38.5 | 177.3 | -168.6 | 144.8 | 0 | 0 | 0 | 112.4 | A187 D188 A189 G195 Y250 L253 | A187-L191 PolarHBondContact O-N 3.07Å; D188-L191 PolarHBondContact O-N 3.04Å; A189-L191 VanDerWaalsContact C-N 3.34Å; L191-G195 VanDerWaalsContact O-CA 3.23Å; L191-G195 WeakPolarHBondContact O-CA 3.37Å; L191-G195 PolarHBondContact O-N 3.33Å; L191-Y250 HydrophobicContact CD2-CE1 4.11Å; L191-L253 HydrophobicContact CD2-CD2 3.69Å |
| 192 | V | 78.3 | Confident | 73.9 | Confident | 9 Ų | 9 | 51.4 Ų | 51.4 | 6% | 0.055 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -66.2 | -42.4 | 172.2 | 172.9 | 0 | 0 | 0 | 0 | 110.8 | D188 A189 Y196 V197 Y250 L253 L254 | D188-V192 WeakPolarHBondContact O-CG2 3.31Å; D188-V192 PolarHBondContact O-N 3.28Å; A189-V192 PolarHBondContact O-N 3.31Å; V192-Y196 WeakPolarHBondContact O-CB 3.29Å; V192-Y196 PolarHBondContact O-N 2.87Å; V192-V197 PolarHBondContact O-N 2.99Å; V192-Y250 HydrophobicContact CG2-CD1 4.41Å; V192-L253 HydrophobicContact CG2-CB 4.32Å; V192-L253 HydrophobicContact CG2-CD2 3.83Å; V192-L253 HydrophobicContact CG2-CG 4.06Å; V192-L254 HydrophobicContact CG1-CB 4.39Å; V192-L254 HydrophobicContact CG1-CD1 4.39Å; V192-L254 HydrophobicContact CG2-CB 4.32Å |
| 193 | F | 80.6 | Confident | 75.9 | Confident | 118 Ų | 118 | 46.8 Ų | 46.8 | 52% | 0.518 | 28% | 0.276 | S | S | . | . | I | π-helix | trans | -64.9 | -54.8 | -179.3 | -174.3 | -99 | 0 | 0 | 0 | 111.6 | A189 T190 V197 V198 | A189-F193 VanDerWaalsContact O-CB 3.24Å; A189-F193 WeakPolarHBondContact O-CB 3.29Å; A189-F193 PolarHBondContact O-N 2.8Å; T190-F193 PolarHBondContact O-N 3.26Å; F193-V197 HydrophobicContact CD2-CB 4.06Å; F193-V197 HydrophobicContact CD2-CG1 4.11Å; F193-V197 HydrophobicContact CD2-CG2 4.39Å; F193-V197 HydrophobicContact CE2-CB 4.49Å; F193-V197 HydrophobicContact CE2-CG1 4.09Å; F193-V197 WeakPolarHBondContact O-CB 3.16Å; F193-V197 PolarHBondContact O-N 3.11Å; F193-V198 HydrophobicContact CD1-CG2 4.06Å; F193-V198 HydrophobicContact CE1-CG2 3.79Å; F193-V198 HydrophobicContact CZ-CG2 4.27Å; F193-V198 WeakPolarHBondContact O-CG2 3.35Å; F193-V198 PolarHBondContact O-N 2.83Å |
| 194 | I | 81.8 | Confident | 77.6 | Confident | 51 Ų | 51 | 46.9 Ų | 46.9 | 26% | 0.262 | 28% | 0.275 | S | S | . | . | I | π-helix | trans | -67.8 | -43.5 | 179.3 | -63.8 | 178.6 | 0 | 0 | 0 | 110.3 | Y118 T190 P199 | Y118-I194 HydrophobicContact CE2-CG2 4.45Å; Y118-I194 WeakPolarHBondContact CE2-O 3.49Å; Y118-I194 WeakPolarHBondContact OH-CG2 3.4Å; Y118-I194 PolarHBondContact OH-O 3.44Å; T190-I194 HydrophobicContact CG2-CD1 3.51Å; T190-I194 HydrophobicContact CG2-CG1 4.11Å; T190-I194 WeakPolarHBondContact O-CB 3.27Å; T190-I194 VanDerWaalsContact O-CG1 3.31Å; T190-I194 WeakPolarHBondContact O-CG1 3Å; T190-I194 PolarHBondContact O-N 3.02Å; I194-P199 WeakPolarHBondContact O-CD 3.41Å |
| 195 | G | 78.1 | Confident | 79.2 | Confident | 0 Ų | 0 | 50.5 Ų | 50.5 | 0% | 0 | 28% | 0.275 | C | S | . | . | I | π-helix | trans | -81.1 | -21.3 | -171.8 | 0 | 0 | 0 | 0 | 0 | 116 | L191 P199 Y250 | L191-G195 VanDerWaalsContact O-CA 3.23Å; L191-G195 WeakPolarHBondContact O-CA 3.37Å; L191-G195 PolarHBondContact O-N 3.33Å; G195-P199 WeakPolarHBondContact O-CG 3.4Å; G195-Y250 PolarHBondContact O-OH 3.45Å |
| 196 | Y | 85.2 | Confident | 80.5 | Confident | 48 Ų | 48 | 46.8 Ų | 46.8 | 19% | 0.188 | 26% | 0.258 | C | S | . | . | I | π-helix | trans | -130.4 | -53.2 | -177.4 | -175.5 | -100.1 | 0 | 0 | 0 | 113.4 | M117 V192 V198 P199 A200 F243 T247 Y250 | M117-Y196 HydrophobicContact CE-CD2 3.62Å; M117-Y196 HydrophobicContact CE-CE2 4Å; V192-Y196 WeakPolarHBondContact O-CB 3.29Å; V192-Y196 PolarHBondContact O-N 2.87Å; Y196-V198 PolarHBondContact O-N 3.4Å; Y196-P199 WeakPolarHBondContact O-CD 3.34Å; Y196-P199 WeakPolarHBondContact O-CG 3.34Å; Y196-A200 WeakPolarHBondContact O-CB 3.29Å; Y196-A200 PolarHBondContact O-N 2.92Å; Y196-F243 AromaticContact CE2-CD1 3.99Å; Y196-F243 HydrophobicContact CE2-CD1 3.99Å; Y196-T247 HydrophobicContact CE2-CG2 4.37Å; Y196-T247 WeakPolarHBondContact CE2-OG1 3.41Å; Y196-T247 VanDerWaalsContact OH-CG2 3.28Å; Y196-T247 WeakPolarHBondContact OH-CG2 3.31Å; Y196-T247 PolarHBondContact OH-OG1 3.09Å; Y196-Y250 AromaticContact CD2-CD2 3.54Å; Y196-Y250 HydrophobicContact CD2-CD2 3.54Å; Y196-Y250 HydrophobicContact CD2-CE2 4.17Å; Y196-Y250 HydrophobicContact CD2-CG 4.02Å; Y196-Y250 AromaticContact CG-CD2 3.92Å; Y196-Y250 HydrophobicContact CG-CD2 3.92Å; Y196-Y250 AromaticContact CG-CG 3.94Å; Y196-Y250 HydrophobicContact CG-CG 3.94Å |
| 197 | V | 86.1 | Confident | 81.8 | Confident | 49 Ų | 49 | 46.2 Ų | 46.2 | 30% | 0.297 | 25% | 0.249 | S | C | . | . | I | π-helix | trans | -63.2 | -49.5 | -172.9 | 179.8 | 0 | 0 | 0 | 0 | 111.3 | V192 F193 A200 L201 | V192-V197 PolarHBondContact O-N 2.99Å; F193-V197 HydrophobicContact CD2-CB 4.06Å; F193-V197 HydrophobicContact CD2-CG1 4.11Å; F193-V197 HydrophobicContact CD2-CG2 4.39Å; F193-V197 HydrophobicContact CE2-CB 4.49Å; F193-V197 HydrophobicContact CE2-CG1 4.09Å; F193-V197 WeakPolarHBondContact O-CB 3.16Å; F193-V197 PolarHBondContact O-N 3.11Å; V197-A200 PolarHBondContact O-N 2.88Å; V197-L201 HydrophobicContact CG1-CD1 3.79Å; V197-L201 HydrophobicContact CG1-CG 4.35Å; V197-L201 WeakPolarHBondContact O-CB 3.28Å; V197-L201 VanDerWaalsContact O-CG 3.26Å; V197-L201 WeakPolarHBondContact O-CG 3.44Å; V197-L201 PolarHBondContact O-N 3.47Å |
| 198 | V | 87.6 | Confident | 83 | Confident | 55 Ų | 55 | 48.5 Ų | 48.5 | 33% | 0.333 | 26% | 0.261 | S | S | . | . | H | α-helix | trans | -59.3 | -55.8 | 178.6 | 172.8 | 0 | 0 | 0 | 0 | 112.3 | Y118 F193 Y196 A200 L201 A202 | Y118-V198 HydrophobicContact CE1-CG1 4.36Å; F193-V198 HydrophobicContact CD1-CG2 4.06Å; F193-V198 HydrophobicContact CE1-CG2 3.79Å; F193-V198 HydrophobicContact CZ-CG2 4.27Å; F193-V198 WeakPolarHBondContact O-CG2 3.35Å; F193-V198 PolarHBondContact O-N 2.83Å; Y196-V198 PolarHBondContact O-N 3.4Å; V198-A200 VanDerWaalsContact C-N 3.3Å; V198-A200 PolarHBondContact O-N 3.46Å; V198-L201 PolarHBondContact O-N 2.99Å; V198-A202 WeakPolarHBondContact O-CB 3.33Å; V198-A202 PolarHBondContact O-N 3.22Å |
| 199 | P | 88.4 | Confident | 83.9 | Confident | 1 Ų | 1 | 47.4 Ų | 47.4 | 1% | 0.006 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -64.6 | -32.5 | 179.2 | 22 | -31.6 | 0 | 0 | 0 | 112.8 | M117 A121 I194 G195 Y196 A203 F243 | M117-P199 HydrophobicContact CB-CB 4.2Å; M117-P199 HydrophobicContact CB-CG 4.04Å; A121-P199 HydrophobicContact CB-CB 3.99Å; A121-P199 WeakPolarHBondContact CB-O 3.49Å; I194-P199 WeakPolarHBondContact O-CD 3.41Å; G195-P199 WeakPolarHBondContact O-CG 3.4Å; Y196-P199 WeakPolarHBondContact O-CD 3.34Å; Y196-P199 WeakPolarHBondContact O-CG 3.34Å; P199-A203 VanDerWaalsContact O-CB 3.3Å; P199-A203 WeakPolarHBondContact O-CB 3.44Å; P199-A203 PolarHBondContact O-N 3.23Å; P199-F243 HydrophobicContact CB-CZ 4.21Å; P199-F243 WeakPolarHBondContact O-CZ 3.03Å |
| 200 | A | 88.9 | Confident | 84.5 | Confident | 22 Ų | 22 | 45.5 Ų | 45.5 | 18% | 0.182 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -66 | -46.6 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | Y196 V197 V198 A202 A203 L204 F243 | Y196-A200 WeakPolarHBondContact O-CB 3.29Å; Y196-A200 PolarHBondContact O-N 2.92Å; V197-A200 PolarHBondContact O-N 2.88Å; V198-A200 VanDerWaalsContact C-N 3.3Å; V198-A200 PolarHBondContact O-N 3.46Å; A200-A202 VanDerWaalsContact C-N 3.35Å; A200-A203 PolarHBondContact O-N 2.64Å; A200-L204 VanDerWaalsContact O-CB 3.26Å; A200-L204 WeakPolarHBondContact O-CB 3.16Å; A200-L204 PolarHBondContact O-N 2.89Å; A200-F243 HydrophobicContact CB-CD1 3.96Å; A200-F243 HydrophobicContact CB-CE1 3.52Å; A200-F243 HydrophobicContact CB-CZ 4.47Å |
| 201 | L | 90.4 | Very high | 85 | Confident | 107 Ų | 107 | 44.5 Ų | 44.5 | 56% | 0.56 | 24% | 0.235 | S | C | * | . | H | α-helix | trans | -64 | -42.5 | 177.2 | -69.7 | 173.4 | 0 | 0 | 0 | 111.1 | V197 V198 L204 Y205 | V197-L201 HydrophobicContact CG1-CD1 3.79Å; V197-L201 HydrophobicContact CG1-CG 4.35Å; V197-L201 WeakPolarHBondContact O-CB 3.28Å; V197-L201 VanDerWaalsContact O-CG 3.26Å; V197-L201 WeakPolarHBondContact O-CG 3.44Å; V197-L201 PolarHBondContact O-N 3.47Å; V198-L201 PolarHBondContact O-N 2.99Å; L201-L204 PolarHBondContact O-N 3.38Å; L201-Y205 WeakPolarHBondContact O-CB 3.39Å; L201-Y205 PolarHBondContact O-N 2.73Å |
| 202 | A | 88.9 | Confident | 85.4 | Confident | 28 Ų | 28 | 51.1 Ų | 51.1 | 23% | 0.231 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -61 | -46.8 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | A121 L125 V198 A200 Y205 A206 | A121-A202 HydrophobicContact CB-CB 4.33Å; L125-A202 HydrophobicContact CD1-CB 4.35Å; V198-A202 WeakPolarHBondContact O-CB 3.33Å; V198-A202 PolarHBondContact O-N 3.22Å; A200-A202 VanDerWaalsContact C-N 3.35Å; A202-Y205 PolarHBondContact O-N 2.81Å; A202-A206 WeakPolarHBondContact O-CB 3.33Å; A202-A206 PolarHBondContact O-N 3.28Å |
| 203 | A | 89.8 | Confident | 85.3 | Confident | 2 Ų | 2 | 51.9 Ų | 51.9 | 2% | 0.017 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -64.1 | -45.4 | 177.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | A121 P199 A200 Y205 A206 L207 V239 F243 | A121-A203 HydrophobicContact CB-CB 4.22Å; P199-A203 VanDerWaalsContact O-CB 3.3Å; P199-A203 WeakPolarHBondContact O-CB 3.44Å; P199-A203 PolarHBondContact O-N 3.23Å; A200-A203 PolarHBondContact O-N 2.64Å; A203-Y205 PolarHBondContact O-N 2.97Å; A203-A206 PolarHBondContact O-N 3.43Å; A203-L207 WeakPolarHBondContact O-CG 3.26Å; A203-L207 PolarHBondContact O-N 3.07Å; A203-V239 HydrophobicContact CB-CG1 4.06Å; A203-F243 HydrophobicContact CB-CE2 3.81Å; A203-F243 HydrophobicContact CB-CZ 3.85Å |
| 204 | L | 90.4 | Very high | 84.8 | Confident | 106 Ų | 106 | 52.2 Ų | 52.2 | 56% | 0.555 | 26% | 0.261 | S | S | * | . | H | α-helix | trans | -60.7 | -46.1 | 177.7 | -178.5 | 66.9 | 0 | 0 | 0 | 111.2 | A200 L201 A206 L207 V208 | A200-L204 VanDerWaalsContact O-CB 3.26Å; A200-L204 WeakPolarHBondContact O-CB 3.16Å; A200-L204 PolarHBondContact O-N 2.89Å; L201-L204 PolarHBondContact O-N 3.38Å; L204-A206 PolarHBondContact O-N 2.86Å; L204-L207 PolarHBondContact O-N 2.63Å; L204-V208 WeakPolarHBondContact O-CG2 3.31Å; L204-V208 PolarHBondContact O-N 2.85Å |
| 205 | Y | 88.8 | Confident | 84.3 | Confident | 145 Ų | 145 | 59.8 Ų | 59.8 | 57% | 0.569 | 29% | 0.287 | S | S | * | . | H | α-helix | trans | -59.3 | -46.9 | 177.3 | -178.3 | -110.5 | 0 | 0 | 0 | 111.4 | L201 A202 A203 L207 V208 L209 | L201-Y205 WeakPolarHBondContact O-CB 3.39Å; L201-Y205 PolarHBondContact O-N 2.73Å; A202-Y205 PolarHBondContact O-N 2.81Å; A203-Y205 PolarHBondContact O-N 2.97Å; Y205-L207 VanDerWaalsContact C-N 3.35Å; Y205-L207 PolarHBondContact O-N 3.43Å; Y205-V208 PolarHBondContact O-N 3.37Å; Y205-L209 HydrophobicContact CD1-CD1 3.81Å; Y205-L209 HydrophobicContact CD1-CG 4.49Å; Y205-L209 HydrophobicContact CE1-CD1 3.32Å; Y205-L209 HydrophobicContact CE1-CG 4.19Å; Y205-L209 HydrophobicContact CE2-CD1 4.25Å; Y205-L209 HydrophobicContact CE2-CD2 4.4Å; Y205-L209 HydrophobicContact CE2-CG 4.28Å; Y205-L209 HydrophobicContact CG-CD1 4.46Å; Y205-L209 WeakPolarHBondContact O-CG 3.48Å; Y205-L209 PolarHBondContact O-N 3.19Å |
| 206 | A | 87.3 | Confident | 83.7 | Confident | 0 Ų | 0 | 66.6 Ų | 66.6 | 0% | 0 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -59 | -43.8 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.5 | L125 A202 A203 L204 L209 L210 | L125-A206 HydrophobicContact CD2-CB 3.75Å; L125-A206 HydrophobicContact CG-CB 3.98Å; A202-A206 WeakPolarHBondContact O-CB 3.33Å; A202-A206 PolarHBondContact O-N 3.28Å; A203-A206 PolarHBondContact O-N 3.43Å; L204-A206 PolarHBondContact O-N 2.86Å; A206-L209 PolarHBondContact O-N 3.26Å; A206-L210 WeakPolarHBondContact O-CB 3.34Å; A206-L210 WeakPolarHBondContact O-CG 3.21Å; A206-L210 PolarHBondContact O-N 3.21Å |
| 207 | L | 87.4 | Confident | 82.5 | Confident | 30 Ų | 30 | 67 Ų | 67 | 16% | 0.157 | 32% | 0.324 | C | S | . | . | H | α-helix | trans | -65.6 | -39.8 | 177.7 | -71.4 | -178.1 | 0 | 0 | 0 | 112.5 | A203 L204 Y205 L210 S211 L235 V236 V239 | A203-L207 WeakPolarHBondContact O-CG 3.26Å; A203-L207 PolarHBondContact O-N 3.07Å; L204-L207 PolarHBondContact O-N 2.63Å; Y205-L207 VanDerWaalsContact C-N 3.35Å; Y205-L207 PolarHBondContact O-N 3.43Å; L207-L210 HydrophobicContact CD2-CD1 4.3Å; L207-L210 PolarHBondContact O-N 2.83Å; L207-S211 WeakPolarHBondContact O-CB 3.38Å; L207-S211 PolarHBondContact O-N 3.4Å; L207-L235 HydrophobicContact CD2-CD2 4.45Å; L207-V236 HydrophobicContact CD2-CG2 3.93Å; L207-V239 HydrophobicContact CD1-CB 4.24Å; L207-V239 HydrophobicContact CD1-CG1 3.93Å; L207-V239 HydrophobicContact CD1-CG2 4.48Å |
| 208 | V | 87.6 | Confident | 80.8 | Confident | 66 Ų | 66 | 69.2 Ų | 69.2 | 40% | 0.4 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -61.1 | -49.1 | 174.3 | 169.5 | 0 | 0 | 0 | 0 | 109.8 | L204 Y205 L210 S211 R212 | L204-V208 WeakPolarHBondContact O-CG2 3.31Å; L204-V208 PolarHBondContact O-N 2.85Å; Y205-V208 PolarHBondContact O-N 3.37Å; V208-L210 PolarHBondContact O-N 2.9Å; V208-S211 WeakPolarHBondContact O-CB 3.35Å; V208-S211 PolarHBondContact O-N 2.91Å; V208-S211 VanDerWaalsContact O-N 3.12Å; V208-S211 PolarHBondContact O-OG 3.14Å; V208-R212 HydrophobicContact CG1-CG 4.47Å; V208-R212 WeakPolarHBondContact O-CG 3.27Å; V208-R212 PolarHBondContact O-N 3.31Å |
| 209 | L | 84.5 | Confident | 79.2 | Confident | 33 Ų | 33 | 72 Ų | 72 | 17% | 0.173 | 36% | 0.357 | C | S | . | . | H | α-helix | trans | -60.8 | -44.1 | 178.2 | -69 | 177.7 | 0 | 0 | 0 | 112.3 | Y128 Y205 A206 S211 R212 V213 | Y128-L209 HydrophobicContact CD1-CD1 4.12Å; Y128-L209 HydrophobicContact CD2-CB 3.61Å; Y128-L209 HydrophobicContact CE1-CB 4.49Å; Y128-L209 HydrophobicContact CE1-CD1 3.74Å; Y128-L209 HydrophobicContact CE2-CB 3.47Å; Y128-L209 VanDerWaalsContact CE2-CB 3.47Å; Y128-L209 HydrophobicContact CE2-CD1 4.17Å; Y128-L209 HydrophobicContact CE2-CG 4.35Å; Y128-L209 HydrophobicContact CG-CB 4.19Å; Y128-L209 HydrophobicContact CG-CD1 4.48Å; Y205-L209 HydrophobicContact CD1-CD1 3.81Å; Y205-L209 HydrophobicContact CD1-CG 4.49Å; Y205-L209 HydrophobicContact CE1-CD1 3.32Å; Y205-L209 HydrophobicContact CE1-CG 4.19Å; Y205-L209 HydrophobicContact CE2-CD1 4.25Å; Y205-L209 HydrophobicContact CE2-CD2 4.4Å; Y205-L209 HydrophobicContact CE2-CG 4.28Å; Y205-L209 HydrophobicContact CG-CD1 4.46Å; Y205-L209 WeakPolarHBondContact O-CG 3.48Å; Y205-L209 PolarHBondContact O-N 3.19Å; A206-L209 PolarHBondContact O-N 3.26Å; L209-S211 VanDerWaalsContact C-N 3.28Å; L209-S211 PolarHBondContact O-N 3.3Å; L209-R212 WeakPolarHBondContact O-CB 3.28Å; L209-R212 PolarHBondContact O-N 3.37Å; L209-R212 VanDerWaalsContact O-N 3.12Å; L209-V213 WeakPolarHBondContact O-CG2 3.49Å; L209-V213 PolarHBondContact O-N 2.89Å |
| 210 | L | 81.3 | Confident | 77.3 | Confident | 3 Ų | 3 | 79.6 Ų | 79.6 | 2% | 0.016 | 40% | 0.397 | C | S | . | . | H | α-helix | trans | -57.6 | -40.9 | 173.5 | -79.7 | 165.5 | 0 | 0 | 0 | 112.3 | Y128 A206 L207 V208 R212 R214 L235 | Y128-L210 HydrophobicContact CD2-CD2 4.39Å; Y128-L210 HydrophobicContact CD2-CG 4.28Å; A206-L210 WeakPolarHBondContact O-CB 3.34Å; A206-L210 WeakPolarHBondContact O-CG 3.21Å; A206-L210 PolarHBondContact O-N 3.21Å; L207-L210 HydrophobicContact CD2-CD1 4.3Å; L207-L210 PolarHBondContact O-N 2.83Å; V208-L210 PolarHBondContact O-N 2.9Å; L210-R212 VanDerWaalsContact C-N 3.32Å; L210-R214 WeakPolarHBondContact O-CB 2.9Å; L210-R214 PolarHBondContact O-N 2.91Å; L210-L235 HydrophobicContact CD1-CD2 3.66Å |
| 211 | S | 81.1 | Confident | 75.4 | Confident | 51 Ų | 51 | 83 Ų | 83 | 36% | 0.357 | 41% | 0.412 | S | S | . | . | H | α-helix | trans | -68.1 | -32.3 | 178.1 | 80.4 | 0 | 0 | 0 | 0 | 112.7 | L207 V208 L209 R215 | L207-S211 WeakPolarHBondContact O-CB 3.38Å; L207-S211 PolarHBondContact O-N 3.4Å; V208-S211 WeakPolarHBondContact O-CB 3.35Å; V208-S211 PolarHBondContact O-N 2.91Å; V208-S211 VanDerWaalsContact O-N 3.12Å; V208-S211 PolarHBondContact O-OG 3.14Å; L209-S211 VanDerWaalsContact C-N 3.28Å; L209-S211 PolarHBondContact O-N 3.3Å; S211-R215 WeakPolarHBondContact O-CG 2.9Å; S211-R215 PolarHBondContact O-N 3.37Å |
| 212 | R | 81.6 | Confident | 73.5 | Confident | 149 Ų | 149 | 86.6 Ų | 86.6 | 56% | 0.562 | 42% | 0.418 | S | S | * | . | H | α-helix | trans | -70.3 | -52.7 | 177.8 | -70.7 | -70.8 | -134.2 | -135.4 | 2.1 | 111.2 | V208 L209 L210 R214 R215 E216 | V208-R212 HydrophobicContact CG1-CG 4.47Å; V208-R212 WeakPolarHBondContact O-CG 3.27Å; V208-R212 PolarHBondContact O-N 3.31Å; L209-R212 WeakPolarHBondContact O-CB 3.28Å; L209-R212 PolarHBondContact O-N 3.37Å; L209-R212 VanDerWaalsContact O-N 3.12Å; L210-R212 VanDerWaalsContact C-N 3.32Å; R212-R214 PolarHBondContact O-N 3.35Å; R212-R215 WeakPolarHBondContact O-CB 3.35Å; R212-R215 PolarHBondContact O-N 2.9Å; R212-E216 PolarHBondContact O-N 3.19Å; R212-E216 VanDerWaalsContact O-N 3.11Å |
| 213 | V | 75.8 | Confident | 71.4 | Confident | 26 Ų | 26 | 92.9 Ų | 92.9 | 16% | 0.158 | 45% | 0.447 | C | S | . | . | H | α-helix | trans | -53.8 | -44.2 | 177 | 175.1 | 0 | 0 | 0 | 0 | 110.2 | Y128 R131 L209 R215 E216 D217 | Y128-V213 HydrophobicContact CE2-CG2 3.87Å; R131-V213 HydrophobicContact CG-CG1 4.1Å; L209-V213 WeakPolarHBondContact O-CG2 3.49Å; L209-V213 PolarHBondContact O-N 2.89Å; V213-R215 VanDerWaalsContact C-N 3.28Å; V213-R215 PolarHBondContact O-N 3.47Å; V213-E216 PolarHBondContact O-N 2.91Å; V213-E216 VanDerWaalsContact O-N 3.12Å; V213-D217 PolarHBondContact O-N 2.71Å |
| 214 | R | 70.4 | Confident | 69.3 | Low | 124 Ų | 124 | 97.8 Ų | 97.8 | 47% | 0.468 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -63.3 | -29 | 177.9 | -170.8 | 173.7 | 178.2 | -162.9 | -2.9 | 114.9 | L210 R212 D217 H232 | L210-R214 WeakPolarHBondContact O-CB 2.9Å; L210-R214 PolarHBondContact O-N 2.91Å; R212-R214 PolarHBondContact O-N 3.35Å; R214-D217 WeakPolarHBondContact CA-OD2 3.27Å; R214-H232 PolarHBondContact NH1-CD2 3.26Å |
| 215 | R | 69.9 | Low | 67.4 | Low | 211 Ų | 211 | 96.1 Ų | 96.1 | 80% | 0.796 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -79.1 | -27.8 | 176.5 | -79.1 | -174.4 | 171.3 | -168.4 | -0.8 | 112.1 | S211 R212 V213 | S211-R215 WeakPolarHBondContact O-CG 2.9Å; S211-R215 PolarHBondContact O-N 3.37Å; R212-R215 WeakPolarHBondContact O-CB 3.35Å; R212-R215 PolarHBondContact O-N 2.9Å; V213-R215 VanDerWaalsContact C-N 3.28Å; V213-R215 PolarHBondContact O-N 3.47Å |
| 216 | E | 67 | Low | 65.4 | Low | 143 Ų | 143 | 96.1 Ų | 96.1 | 67% | 0.668 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -83.3 | -21.7 | 179.6 | -69.3 | 171.8 | -179 | 0 | 0 | 112.4 | R212 V213 T218 | R212-E216 PolarHBondContact O-N 3.19Å; R212-E216 VanDerWaalsContact O-N 3.11Å; V213-E216 PolarHBondContact O-N 2.91Å; V213-E216 VanDerWaalsContact O-N 3.12Å; E216-T218 PolarHBondContact O-N 3.31Å |
| 217 | D | 58.9 | Low | 63.6 | Low | 55 Ų | 55 | 99 Ų | 99 | 29% | 0.294 | 50% | 0.5 | S | S | . | . | trans | -60 | 92.6 | 171.8 | -63.2 | -37.5 | 0 | 0 | 0 | 111.2 | R131 V213 R214 | R131-D217 IonicContact CZ-OD2 3.57Å; R131-D217 IonicContact NE-OD2 3.74Å; R131-D217 IonicContact NH2-OD1 3.81Å; R131-D217 IonicContact NH2-OD2 2.64Å; R131-D217 PolarHBondContact NH2-OD2 3.13Å; V213-D217 PolarHBondContact O-N 2.71Å; R214-D217 WeakPolarHBondContact CA-OD2 3.27Å | ||
| 218 | T | 51.8 | Low | 62.2 | Low | 97 Ų | 97 | 102.7 Ų | 102.7 | 60% | 0.595 | 52% | 0.516 | S | S | * | . | trans | -60.5 | 152.3 | 172.4 | 25.9 | 0 | 0 | 0 | 0 | 112.1 | E216 L220 D221 | E216-T218 PolarHBondContact O-N 3.31Å; T218-L220 PolarHBondContact O-N 3.34Å; T218-D221 PolarHBondContact O-N 3.08Å; T218-D221 VanDerWaalsContact O-N 3.11Å | ||
| 219 | P | 53.4 | Low | 61 | Low | 112 Ų | 112 | 100.5 Ų | 100.5 | 73% | 0.727 | 50% | 0.503 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -59.9 | -10.2 | -173.2 | 20.5 | -31.8 | 0 | 0 | 0 | 116.2 | ||
| 220 | L | 47.3 | Very low | 60.1 | Low | 162 Ų | 162 | 100.6 Ų | 100.6 | 85% | 0.848 | 51% | 0.507 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -80.8 | -18.4 | 176.2 | -86.8 | 101.4 | 0 | 0 | 0 | 114.7 | T218 R222 | T218-L220 PolarHBondContact O-N 3.34Å; L220-R222 PolarHBondContact O-N 3.28Å |
| 221 | D | 49.5 | Very low | 59.7 | Low | 92 Ų | 92 | 101.8 Ų | 101.8 | 49% | 0.492 | 52% | 0.517 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -89.3 | 20.6 | -179.5 | -160 | 24.1 | 0 | 0 | 0 | 112.9 | T218 D223 T224 | T218-D221 PolarHBondContact O-N 3.08Å; T218-D221 VanDerWaalsContact O-N 3.11Å; D221-D223 VanDerWaalsContact C-N 3.32Å; D221-D223 PolarHBondContact O-N 3.18Å; D221-T224 PolarHBondContact OD1-OG1 2.79Å |
| 222 | R | 51.1 | Low | 59.6 | Low | 183 Ų | 183 | 101 Ų | 101 | 69% | 0.691 | 51% | 0.508 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -80.1 | -11.5 | -172.7 | -172.2 | 162.6 | 142.5 | 144.8 | -7.5 | 113.6 | L220 | L220-R222 PolarHBondContact O-N 3.28Š|
| 223 | D | 45.5 | Very low | 59.6 | Low | 160 Ų | 160 | 101.3 Ų | 101.3 | 86% | 0.856 | 51% | 0.509 | S | S | * | . | S | Bend | trans | -95.6 | -16.9 | -176 | -82.3 | -21.8 | 0 | 0 | 0 | 114.4 | D221 G225 | D221-D223 VanDerWaalsContact C-N 3.32Å; D221-D223 PolarHBondContact O-N 3.18Å; D223-G225 PolarHBondContact O-N 2.81Å |
| 224 | T | 45.1 | Very low | 60.1 | Low | 106 Ų | 106 | 101.2 Ų | 101.2 | 65% | 0.65 | 51% | 0.507 | S | S | * | . | S | Bend | trans | -100.2 | 80.5 | -177.9 | 19.7 | 0 | 0 | 0 | 0 | 111.5 | D221 | D221-T224 PolarHBondContact OD1-OG1 2.79Š|
| 225 | G | 50.1 | Low | 60.9 | Low | 70 Ų | 70 | 95.5 Ų | 95.5 | 72% | 0.722 | 49% | 0.486 | S | S | * | . | trans | 65.7 | 55.4 | 159.5 | 0 | 0 | 0 | 0 | 0 | 114.4 | D223 L227 | D223-G225 PolarHBondContact O-N 2.81Å; G225-L227 PolarHBondContact O-N 3.37Å; G225-L227 VanDerWaalsContact O-N 3.15Å | ||
| 226 | R | 47.1 | Very low | 61.8 | Low | 145 Ų | 145 | 87.6 Ų | 87.6 | 55% | 0.547 | 46% | 0.461 | S | S | . | . | trans | -49.4 | 119.4 | 171.8 | -171 | -178.1 | -169.8 | -156.8 | 11.3 | 110.4 | E228 | R226-E228 PolarHBondContact O-N 3.14Š| ||
| 227 | L | 49.5 | Very low | 62.9 | Low | 62 Ų | 62 | 82.6 Ų | 82.6 | 33% | 0.325 | 45% | 0.445 | S | S | . | . | trans | -63.6 | 110.9 | 156.2 | -143.5 | 107.4 | 0 | 0 | 0 | 106.3 | H127 G225 A231 | H127-L227 WeakPolarHBondContact CE1-CD2 3.31Å; H127-L227 WeakPolarHBondContact NE2-CD2 3.34Å; G225-L227 PolarHBondContact O-N 3.37Å; G225-L227 VanDerWaalsContact O-N 3.15Å; L227-A231 HydrophobicContact CD2-CB 3.59Å; L227-A231 HydrophobicContact CG-CB 4.18Å | ||
| 228 | E | 57.7 | Low | 64.4 | Low | 107 Ų | 107 | 80 Ų | 80 | 50% | 0.5 | 43% | 0.431 | S | S | . | . | trans | -42.9 | 130 | 179.9 | -92.2 | -74.8 | 116.1 | 0 | 0 | 109.6 | R226 S230 A231 | R226-E228 PolarHBondContact O-N 3.14Å; E228-S230 WeakPolarHBondContact CB-OG 3.44Å; E228-S230 PolarHBondContact O-N 2.9Å; E228-A231 PolarHBondContact O-N 3.33Å | ||
| 229 | P | 61.9 | Low | 66.4 | Low | 19 Ų | 19 | 75.8 Ų | 75.8 | 12% | 0.123 | 41% | 0.405 | C | S | . | . | H | α-helix | trans | -52 | -19 | 178.6 | -24.9 | 30.8 | 0 | 0 | 0 | 113.6 | R233 | P229-R233 VanDerWaalsContact O-CG 3.29Å; P229-R233 WeakPolarHBondContact O-CG 3.37Å; P229-R233 PolarHBondContact O-N 2.82Å; P229-R233 PolarHBondContact O-NE 3.22Å |
| 230 | S | 66.3 | Low | 68.2 | Low | 36 Ų | 36 | 74.2 Ų | 74.2 | 25% | 0.252 | 40% | 0.396 | S | S | . | . | H | α-helix | trans | -67.8 | -39.6 | 172 | 59 | 0 | 0 | 0 | 0 | 113.6 | E228 R233 L234 | E228-S230 WeakPolarHBondContact CB-OG 3.44Å; E228-S230 PolarHBondContact O-N 2.9Å; S230-R233 PolarHBondContact O-N 3.23Å; S230-L234 WeakPolarHBondContact O-CB 3.21Å; S230-L234 PolarHBondContact O-N 3.44Å |
| 231 | A | 72.9 | Confident | 70.4 | Confident | 28 Ų | 28 | 68.7 Ų | 68.7 | 23% | 0.231 | 37% | 0.369 | C | S | . | . | H | α-helix | trans | -66.9 | -44.4 | -178.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | L227 E228 L234 L235 | L227-A231 HydrophobicContact CD2-CB 3.59Å; L227-A231 HydrophobicContact CG-CB 4.18Å; E228-A231 PolarHBondContact O-N 3.33Å; A231-L234 PolarHBondContact O-N 2.89Å; A231-L235 PolarHBondContact O-N 2.86Å |
| 232 | H | 78.3 | Confident | 72.4 | Confident | 35 Ų | 35 | 64.3 Ų | 64.3 | 16% | 0.162 | 35% | 0.345 | C | S | . | . | H | α-helix | trans | -65.6 | -45.4 | 174.9 | 176.5 | 77.6 | 0 | 0 | 0 | 112.4 | R214 L234 L235 V236 | R214-H232 PolarHBondContact NH1-CD2 3.26Å; H232-L234 PolarHBondContact O-N 3.43Å; H232-L235 PolarHBondContact O-N 2.67Å; H232-V236 WeakPolarHBondContact O-CG2 3.42Å; H232-V236 PolarHBondContact O-N 3.46Å |
| 233 | R | 82.3 | Confident | 74.4 | Confident | 154 Ų | 154 | 56.5 Ų | 56.5 | 58% | 0.581 | 32% | 0.316 | S | S | * | . | H | α-helix | trans | -56.4 | -37.3 | 175.3 | -79.4 | -173 | -53.8 | -113 | 1.7 | 111.4 | P229 S230 A237 | P229-R233 VanDerWaalsContact O-CG 3.29Å; P229-R233 WeakPolarHBondContact O-CG 3.37Å; P229-R233 PolarHBondContact O-N 2.82Å; P229-R233 PolarHBondContact O-NE 3.22Å; S230-R233 PolarHBondContact O-N 3.23Å; R233-A237 WeakPolarHBondContact O-CB 3.25Å; R233-A237 PolarHBondContact O-N 3.31Å |
| 234 | L | 85.4 | Confident | 76.6 | Confident | 24 Ų | 24 | 50.8 Ų | 50.8 | 13% | 0.126 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -80.5 | -30.2 | -178.3 | -173.5 | 54 | 0 | 0 | 0 | 113.7 | S230 A231 H232 A237 T238 L295 Y298 M299 | S230-L234 WeakPolarHBondContact O-CB 3.21Å; S230-L234 PolarHBondContact O-N 3.44Å; A231-L234 PolarHBondContact O-N 2.89Å; H232-L234 PolarHBondContact O-N 3.43Å; L234-A237 HydrophobicContact CD1-CB 4.26Å; L234-A237 PolarHBondContact O-N 2.86Å; L234-T238 WeakPolarHBondContact O-CB 3.46Å; L234-T238 PolarHBondContact O-N 3.38Å; L234-T238 PolarHBondContact O-OG1 3.19Å; L234-L295 HydrophobicContact CD1-CD2 4.3Å; L234-Y298 VanDerWaalsContact CD2-CB 3.43Å; L234-Y298 WeakPolarHBondContact CD2-O 3.3Å; L234-M299 HydrophobicContact CD2-CB 3.48Å; L234-M299 VanDerWaalsContact CD2-CB 3.48Å; L234-M299 HydrophobicContact CD2-CG 4.03Å; L234-M299 HydrophobicContact CG-CB 3.96Å; L234-M299 HydrophobicContact CG-CG 4.21Å |
| 235 | L | 87.9 | Confident | 78.9 | Confident | 4 Ų | 4 | 46.9 Ų | 46.9 | 2% | 0.021 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -59.6 | -51.7 | 166.3 | 177.6 | 68.6 | 0 | 0 | 0 | 109.9 | L123 H127 L207 L210 A231 H232 A237 T238 V239 | L123-L235 HydrophobicContact CD2-CD1 3.92Å; L123-L235 HydrophobicContact CG-CD1 3.78Å; H127-L235 HydrophobicContact CB-CD2 3.99Å; H127-L235 VanDerWaalsContact CD2-CD2 3.49Å; H127-L235 WeakPolarHBondContact CD2-CD2 3.34Å; L207-L235 HydrophobicContact CD2-CD2 4.45Å; L210-L235 HydrophobicContact CD1-CD2 3.66Å; A231-L235 PolarHBondContact O-N 2.86Å; H232-L235 PolarHBondContact O-N 2.67Å; L235-A237 VanDerWaalsContact C-N 3.31Å; L235-A237 PolarHBondContact O-N 3.06Å; L235-T238 WeakPolarHBondContact O-CB 3.26Å; L235-T238 PolarHBondContact O-N 3.43Å; L235-T238 VanDerWaalsContact O-N 3.07Å; L235-V239 HydrophobicContact CD1-CG2 4.49Å; L235-V239 WeakPolarHBondContact O-CG2 3.48Å; L235-V239 PolarHBondContact O-N 3.27Å |
| 236 | V | 88.8 | Confident | 80.9 | Confident | 46 Ų | 46 | 43.6 Ų | 43.6 | 28% | 0.279 | 24% | 0.236 | S | C | . | . | H | α-helix | trans | -57.1 | -46.5 | 176.5 | 174.8 | 0 | 0 | 0 | 0 | 110.5 | L207 H232 T238 V239 C240 | L207-V236 HydrophobicContact CD2-CG2 3.93Å; H232-V236 WeakPolarHBondContact O-CG2 3.42Å; H232-V236 PolarHBondContact O-N 3.46Å; V236-T238 VanDerWaalsContact C-N 3.3Å; V236-T238 PolarHBondContact O-N 2.85Å; V236-V239 PolarHBondContact O-N 3.33Å; V236-C240 WeakPolarHBondContact O-CB 3.4Å; V236-C240 PolarHBondContact O-N 3.48Å; V236-C240 PolarHBondContact O-SG 3.33Å |
| 237 | A | 90.9 | Very high | 82.9 | Confident | 38 Ų | 38 | 38.1 Ų | 38.1 | 31% | 0.314 | 22% | 0.219 | S | C | . | . | H | α-helix | trans | -60.3 | -39.8 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | R233 L234 L235 T241 | R233-A237 WeakPolarHBondContact O-CB 3.25Å; R233-A237 PolarHBondContact O-N 3.31Å; L234-A237 HydrophobicContact CD1-CB 4.26Å; L234-A237 PolarHBondContact O-N 2.86Å; L235-A237 VanDerWaalsContact C-N 3.31Å; L235-A237 PolarHBondContact O-N 3.06Å; A237-T241 WeakPolarHBondContact O-CB 3.46Å; A237-T241 PolarHBondContact O-N 3.07Å; A237-T241 PolarHBondContact O-OG1 2.99Å |
| 238 | T | 90.6 | Very high | 84.8 | Confident | 0 Ų | 0 | 37 Ų | 37 | 0% | 0 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -63.2 | -48.7 | 176.8 | -59.2 | 0 | 0 | 0 | 0 | 110.6 | F66 L123 L234 L235 V236 T241 Q242 L295 | F66-T238 HydrophobicContact CE1-CG2 4.42Å; F66-T238 HydrophobicContact CZ-CG2 3.77Å; L123-T238 HydrophobicContact CD2-CG2 4.35Å; L234-T238 WeakPolarHBondContact O-CB 3.46Å; L234-T238 PolarHBondContact O-N 3.38Å; L234-T238 PolarHBondContact O-OG1 3.19Å; L235-T238 WeakPolarHBondContact O-CB 3.26Å; L235-T238 PolarHBondContact O-N 3.43Å; L235-T238 VanDerWaalsContact O-N 3.07Å; V236-T238 VanDerWaalsContact C-N 3.3Å; V236-T238 PolarHBondContact O-N 2.85Å; T238-T241 PolarHBondContact O-N 3.3Å; T238-Q242 HydrophobicContact CG2-CG 4.44Å; T238-Q242 WeakPolarHBondContact O-CB 3.34Å; T238-Q242 VanDerWaalsContact O-CG 3.29Å; T238-Q242 WeakPolarHBondContact O-CG 3.46Å; T238-Q242 PolarHBondContact O-N 3.47Å; T238-L295 HydrophobicContact CG2-CD1 4.14Å |
| 239 | V | 92.4 | Very high | 86.3 | Confident | 9 Ų | 9 | 33 Ų | 33 | 6% | 0.055 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -61.2 | -53.9 | 177.9 | 178.6 | 0 | 0 | 0 | 0 | 110.6 | T120 S124 A203 L207 L235 V236 T241 Q242 F243 | T120-V239 HydrophobicContact CG2-CB 4.26Å; T120-V239 HydrophobicContact CG2-CG1 4.49Å; T120-V239 HydrophobicContact CG2-CG2 3.93Å; S124-V239 WeakPolarHBondContact OG-CG2 3.45Å; A203-V239 HydrophobicContact CB-CG1 4.06Å; L207-V239 HydrophobicContact CD1-CB 4.24Å; L207-V239 HydrophobicContact CD1-CG1 3.93Å; L207-V239 HydrophobicContact CD1-CG2 4.48Å; L235-V239 HydrophobicContact CD1-CG2 4.49Å; L235-V239 WeakPolarHBondContact O-CG2 3.48Å; L235-V239 PolarHBondContact O-N 3.27Å; V236-V239 PolarHBondContact O-N 3.33Å; V239-T241 VanDerWaalsContact C-N 3.27Å; V239-T241 PolarHBondContact O-N 2.88Å; V239-Q242 PolarHBondContact O-N 3.25Å; V239-F243 HydrophobicContact CG1-CD2 3.69Å; V239-F243 HydrophobicContact CG1-CE2 3.95Å; V239-F243 WeakPolarHBondContact O-CB 3.37Å; V239-F243 VanDerWaalsContact O-CD2 3.29Å; V239-F243 WeakPolarHBondContact O-CD2 3.42Å; V239-F243 PolarHBondContact O-N 3.15Å |
| 240 | C | 92.7 | Very high | 87.4 | Confident | 79 Ų | 79 | 32.3 Ų | 32.3 | 53% | 0.534 | 19% | 0.192 | S | C | . | . | H | α-helix | trans | -57.8 | -41.1 | -179.8 | -71 | 0 | 0 | 0 | 0 | 112.3 | V236 G244 | V236-C240 WeakPolarHBondContact O-CB 3.4Å; V236-C240 PolarHBondContact O-N 3.48Å; V236-C240 PolarHBondContact O-SG 3.33Å; C240-G244 WeakPolarHBondContact O-CA 3.41Å; C240-G244 PolarHBondContact O-N 3.47Å |
| 241 | T | 93.1 | Very high | 88.4 | Confident | 46 Ų | 46 | 35.2 Ų | 35.2 | 28% | 0.282 | 20% | 0.204 | S | C | . | . | H | α-helix | trans | -70.7 | -47.2 | -179 | -55.7 | 0 | 0 | 0 | 0 | 111.4 | A237 T238 V239 G244 L245 V291 L295 | A237-T241 WeakPolarHBondContact O-CB 3.46Å; A237-T241 PolarHBondContact O-N 3.07Å; A237-T241 PolarHBondContact O-OG1 2.99Å; T238-T241 PolarHBondContact O-N 3.3Å; V239-T241 VanDerWaalsContact C-N 3.27Å; V239-T241 PolarHBondContact O-N 2.88Å; T241-G244 PolarHBondContact O-N 2.69Å; T241-L245 HydrophobicContact CG2-CD1 3.92Å; T241-L245 HydrophobicContact CG2-CG 4.46Å; T241-L245 WeakPolarHBondContact O-CB 3.2Å; T241-L245 WeakPolarHBondContact O-CG 3.2Å; T241-L245 PolarHBondContact O-N 2.91Å; T241-V291 HydrophobicContact CG2-CG1 3.54Å; T241-L295 HydrophobicContact CG2-CD1 4.29Å |
| 242 | Q | 91.6 | Very high | 88.9 | Confident | 0 Ų | 0 | 35 Ų | 35 | 0% | 0 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -63.1 | -53.4 | 179 | -70.4 | -63.7 | -26.1 | 0 | 0 | 110.9 | T120 T238 V239 G244 L245 W246 T292 | T120-Q242 HydrophobicContact CG2-CB 4.06Å; T120-Q242 HydrophobicContact CG2-CG 4.33Å; T238-Q242 HydrophobicContact CG2-CG 4.44Å; T238-Q242 WeakPolarHBondContact O-CB 3.34Å; T238-Q242 VanDerWaalsContact O-CG 3.29Å; T238-Q242 WeakPolarHBondContact O-CG 3.46Å; T238-Q242 PolarHBondContact O-N 3.47Å; V239-Q242 PolarHBondContact O-N 3.25Å; Q242-G244 VanDerWaalsContact C-N 3.35Å; Q242-G244 PolarHBondContact O-N 3.28Å; Q242-L245 PolarHBondContact O-N 3.13Å; Q242-W246 PolarHBondContact O-N 3.43Å; Q242-W246 VanDerWaalsContact O-N 3.17Å; Q242-T292 PolarHBondContact NE2-OG1 3.43Å |
| 243 | F | 92.1 | Very high | 88.9 | Confident | 18 Ų | 18 | 35.2 Ų | 35.2 | 8% | 0.079 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -59.6 | -47.2 | 178.1 | -80.5 | -95.2 | 0 | 0 | 0 | 110.7 | M117 T120 Y196 P199 A200 A203 V239 L245 W246 T247 | M117-F243 HydrophobicContact CE-CD1 3.25Å; M117-F243 HydrophobicContact CE-CD2 4.43Å; M117-F243 HydrophobicContact CE-CE1 3.09Å; M117-F243 HydrophobicContact CE-CE2 4.35Å; M117-F243 HydrophobicContact CE-CG 3.94Å; M117-F243 HydrophobicContact CE-CZ 3.72Å; M117-F243 HydrophobicContact SD-CE1 4.47Å; T120-F243 HydrophobicContact CG2-CD2 4.15Å; T120-F243 HydrophobicContact CG2-CE2 3.83Å; Y196-F243 AromaticContact CE2-CD1 3.99Å; Y196-F243 HydrophobicContact CE2-CD1 3.99Å; P199-F243 HydrophobicContact CB-CZ 4.21Å; P199-F243 WeakPolarHBondContact O-CZ 3.03Å; A200-F243 HydrophobicContact CB-CD1 3.96Å; A200-F243 HydrophobicContact CB-CE1 3.52Å; A200-F243 HydrophobicContact CB-CZ 4.47Å; A203-F243 HydrophobicContact CB-CE2 3.81Å; A203-F243 HydrophobicContact CB-CZ 3.85Å; V239-F243 HydrophobicContact CG1-CD2 3.69Å; V239-F243 HydrophobicContact CG1-CE2 3.95Å; V239-F243 WeakPolarHBondContact O-CB 3.37Å; V239-F243 VanDerWaalsContact O-CD2 3.29Å; V239-F243 WeakPolarHBondContact O-CD2 3.42Å; V239-F243 PolarHBondContact O-N 3.15Å; F243-L245 VanDerWaalsContact C-N 3.27Å; F243-L245 PolarHBondContact O-N 3.07Å; F243-W246 PolarHBondContact O-N 3.29Å; F243-T247 WeakPolarHBondContact O-CB 3.42Å; F243-T247 PolarHBondContact O-N 2.82Å; F243-T247 PolarHBondContact O-OG1 2.82Å |
| 244 | G | 91.5 | Very high | 88.7 | Confident | 41 Ų | 41 | 31.1 Ų | 31.1 | 42% | 0.423 | 19% | 0.191 | S | C | . | . | H | α-helix | trans | -59.1 | -32.4 | 179.1 | 0 | 0 | 0 | 0 | 0 | 114.7 | C240 T241 Q242 P248 | C240-G244 WeakPolarHBondContact O-CA 3.41Å; C240-G244 PolarHBondContact O-N 3.47Å; T241-G244 PolarHBondContact O-N 2.69Å; Q242-G244 VanDerWaalsContact C-N 3.35Å; Q242-G244 PolarHBondContact O-N 3.28Å; G244-P248 WeakPolarHBondContact O-CD 3.49Å |
| 245 | L | 92.9 | Very high | 88.2 | Confident | 24 Ų | 24 | 31.6 Ų | 31.6 | 13% | 0.126 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -75.4 | -31.9 | 175.9 | -71.1 | 171.8 | 0 | 0 | 0 | 112.8 | T241 Q242 F243 L284 A285 V291 | T241-L245 HydrophobicContact CG2-CD1 3.92Å; T241-L245 HydrophobicContact CG2-CG 4.46Å; T241-L245 WeakPolarHBondContact O-CB 3.2Å; T241-L245 WeakPolarHBondContact O-CG 3.2Å; T241-L245 PolarHBondContact O-N 2.91Å; Q242-L245 PolarHBondContact O-N 3.13Å; F243-L245 VanDerWaalsContact C-N 3.27Å; F243-L245 PolarHBondContact O-N 3.07Å; L245-L284 HydrophobicContact CD2-CB 4.41Å; L245-L284 HydrophobicContact CD2-CD2 4.15Å; L245-L284 CarbonylContact O-C 3.51Å; L245-A285 PolarHBondContact O-N 3.12Å; L245-V291 HydrophobicContact CD1-CB 4.31Å; L245-V291 HydrophobicContact CD1-CG2 4.25Å |
| 246 | W | 92.3 | Very high | 87.5 | Confident | 0 Ų | 0 | 35.1 Ų | 35.1 | 0% | 0 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -92.9 | -26.9 | -178.6 | -71.6 | 106.9 | 0 | 0 | 0 | 114 | L76 F109 S113 A116 M117 Q242 F243 P248 H249 Y250 A285 S288 | L76-W246 HydrophobicContact CD1-CH2 3.73Å; L76-W246 HydrophobicContact CD1-CZ2 3.54Å; L76-W246 HydrophobicContact CD2-CH2 3.98Å; F109-W246 HydrophobicContact CE1-CZ3 4.47Å; F109-W246 HydrophobicContact CE2-CZ3 4.44Å; F109-W246 AromaticContact CZ-CZ3 3.99Å; F109-W246 HydrophobicContact CZ-CZ3 3.99Å; S113-W246 VanDerWaalsContact CB-CZ3 3.43Å; S113-W246 VanDerWaalsContact OG-CZ3 3.25Å; S113-W246 WeakPolarHBondContact OG-CZ3 3.45Å; A116-W246 HydrophobicContact CB-CZ2 4.44Å; M117-W246 HydrophobicContact CE-CB 4.46Å; M117-W246 HydrophobicContact SD-CB 3.64Å; M117-W246 HydrophobicContact SD-CG 3.75Å; Q242-W246 PolarHBondContact O-N 3.43Å; Q242-W246 VanDerWaalsContact O-N 3.17Å; F243-W246 PolarHBondContact O-N 3.29Å; W246-P248 VanDerWaalsContact C-CD 3.46Å; W246-H249 WeakPolarHBondContact O-CB 3.37Å; W246-H249 PolarHBondContact O-N 3.46Å; W246-Y250 HydrophobicContact CB-CD2 4.33Å; W246-Y250 HydrophobicContact CB-CE2 4.25Å; W246-Y250 WeakPolarHBondContact O-CD2 3.49Å; W246-Y250 PolarHBondContact O-N 2.99Å; W246-A285 HydrophobicContact CD2-CB 4.29Å; W246-A285 HydrophobicContact CE3-CB 3.66Å; W246-A285 HydrophobicContact CH2-CB 4.04Å; W246-A285 HydrophobicContact CZ3-CB 3.53Å; W246-S288 WeakPolarHBondContact CZ2-OG 3.02Å; W246-S288 PolarHBondContact NE1-OG 3.4Å |
| 247 | T | 89 | Confident | 86.5 | Confident | 30 Ų | 30 | 33.4 Ų | 33.4 | 18% | 0.184 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -51.4 | -47.6 | -179.7 | -59.5 | 0 | 0 | 0 | 0 | 112.7 | Y196 F243 H249 Y250 L251 | Y196-T247 HydrophobicContact CE2-CG2 4.37Å; Y196-T247 WeakPolarHBondContact CE2-OG1 3.41Å; Y196-T247 VanDerWaalsContact OH-CG2 3.28Å; Y196-T247 WeakPolarHBondContact OH-CG2 3.31Å; Y196-T247 PolarHBondContact OH-OG1 3.09Å; F243-T247 WeakPolarHBondContact O-CB 3.42Å; F243-T247 PolarHBondContact O-N 2.82Å; F243-T247 PolarHBondContact O-OG1 2.82Å; T247-H249 PolarHBondContact O-N 3.35Å; T247-Y250 PolarHBondContact O-N 3.28Å; T247-L251 HydrophobicContact CG2-CD1 3.64Å; T247-L251 HydrophobicContact CG2-CG 3.91Å; T247-L251 WeakPolarHBondContact O-CB 3.21Å; T247-L251 WeakPolarHBondContact O-CG 3.41Å; T247-L251 PolarHBondContact O-N 3.44Å |
| 248 | P | 90.1 | Very high | 85.5 | Confident | 39 Ų | 39 | 34.3 Ų | 34.3 | 25% | 0.253 | 21% | 0.209 | S | C | . | . | H | α-helix | trans | -58.7 | -35.5 | -179.3 | -25.3 | 37 | 0 | 0 | 0 | 112.3 | G244 W246 V252 L284 | G244-P248 WeakPolarHBondContact O-CD 3.49Å; W246-P248 VanDerWaalsContact C-CD 3.46Å; P248-V252 WeakPolarHBondContact O-CB 3.32Å; P248-V252 VanDerWaalsContact O-CG2 3.25Å; P248-V252 WeakPolarHBondContact O-CG2 3.18Å; P248-V252 PolarHBondContact O-N 3.09Å; P248-L284 HydrophobicContact CB-CD1 4.17Å; P248-L284 HydrophobicContact CG-CD1 3.76Å |
| 249 | H | 88.6 | Confident | 84.5 | Confident | 22 Ų | 22 | 35.7 Ų | 35.7 | 10% | 0.102 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -67.9 | -48.3 | -179.5 | -179.4 | 70 | 0 | 0 | 0 | 111.5 | F109 W246 T247 L251 V252 L253 | F109-H249 AromaticContact CE1-CE1 3.63Å; F109-H249 AromaticContact CE1-NE2 3.44Å; F109-H249 WeakPolarHBondContact CE1-NE2 3.23Å; F109-H249 AromaticContact CZ-CE1 3.92Å; W246-H249 WeakPolarHBondContact O-CB 3.37Å; W246-H249 PolarHBondContact O-N 3.46Å; T247-H249 PolarHBondContact O-N 3.35Å; H249-L251 VanDerWaalsContact C-N 3.34Å; H249-L251 PolarHBondContact O-N 3.01Å; H249-V252 PolarHBondContact O-N 3.33Å; H249-L253 WeakPolarHBondContact O-CB 3.49Å; H249-L253 PolarHBondContact O-N 3.05Å |
| 250 | Y | 86.6 | Confident | 83.2 | Confident | 5 Ų | 5 | 40.1 Ų | 40.1 | 2% | 0.02 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -67.2 | -34.1 | 177.6 | -74.3 | -73.1 | 0 | 0 | 0 | 112.8 | S113 M117 L191 V192 G195 Y196 W246 T247 L253 L254 | S113-Y250 WeakPolarHBondContact OG-CE2 3.31Å; S113-Y250 PolarHBondContact OG-OH 2.8Å; M117-Y250 HydrophobicContact CG-CE2 4.31Å; L191-Y250 HydrophobicContact CD2-CE1 4.11Å; V192-Y250 HydrophobicContact CG2-CD1 4.41Å; G195-Y250 PolarHBondContact O-OH 3.45Å; Y196-Y250 AromaticContact CD2-CD2 3.54Å; Y196-Y250 HydrophobicContact CD2-CD2 3.54Å; Y196-Y250 HydrophobicContact CD2-CE2 4.17Å; Y196-Y250 HydrophobicContact CD2-CG 4.02Å; Y196-Y250 AromaticContact CG-CD2 3.92Å; Y196-Y250 HydrophobicContact CG-CD2 3.92Å; Y196-Y250 AromaticContact CG-CG 3.94Å; Y196-Y250 HydrophobicContact CG-CG 3.94Å; W246-Y250 HydrophobicContact CB-CD2 4.33Å; W246-Y250 HydrophobicContact CB-CE2 4.25Å; W246-Y250 WeakPolarHBondContact O-CD2 3.49Å; W246-Y250 PolarHBondContact O-N 2.99Å; T247-Y250 PolarHBondContact O-N 3.28Å; Y250-L253 PolarHBondContact O-N 3.15Å; Y250-L254 WeakPolarHBondContact O-CB 3.44Å; Y250-L254 PolarHBondContact O-N 3.03Å |
| 251 | L | 85.8 | Confident | 81.8 | Confident | 98 Ų | 98 | 39 Ų | 39 | 51% | 0.513 | 23% | 0.232 | S | C | . | . | H | α-helix | trans | -67.1 | -42.8 | 174.5 | -73.6 | -179.4 | 0 | 0 | 0 | 112.2 | T247 H249 L253 L254 G255 | T247-L251 HydrophobicContact CG2-CD1 3.64Å; T247-L251 HydrophobicContact CG2-CG 3.91Å; T247-L251 WeakPolarHBondContact O-CB 3.21Å; T247-L251 WeakPolarHBondContact O-CG 3.41Å; T247-L251 PolarHBondContact O-N 3.44Å; H249-L251 VanDerWaalsContact C-N 3.34Å; H249-L251 PolarHBondContact O-N 3.01Å; L251-L253 VanDerWaalsContact C-N 3.33Å; L251-L254 PolarHBondContact O-N 3.29Å; L251-G255 PolarHBondContact O-N 3.43Å |
| 252 | V | 84.1 | Confident | 80.4 | Confident | 24 Ų | 24 | 45.6 Ų | 45.6 | 15% | 0.145 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -65.2 | -40.2 | 175.9 | 171.6 | 0 | 0 | 0 | 0 | 110.8 | P248 H249 G255 H256 L274 A277 K278 | P248-V252 WeakPolarHBondContact O-CB 3.32Å; P248-V252 VanDerWaalsContact O-CG2 3.25Å; P248-V252 WeakPolarHBondContact O-CG2 3.18Å; P248-V252 PolarHBondContact O-N 3.09Å; H249-V252 PolarHBondContact O-N 3.33Å; V252-G255 PolarHBondContact O-N 3.48Å; V252-H256 WeakPolarHBondContact O-CB 3.45Å; V252-H256 PolarHBondContact O-N 2.97Å; V252-L274 HydrophobicContact CG1-CD1 4.46Å; V252-A277 HydrophobicContact CG2-CB 3.88Å; V252-K278 HydrophobicContact CG1-CB 3.9Å; V252-K278 HydrophobicContact CG1-CG 4.34Å |
| 253 | L | 78.8 | Confident | 78.7 | Confident | 39 Ų | 39 | 48.7 Ų | 48.7 | 20% | 0.204 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -60.3 | -46.5 | 175 | -175 | 63.5 | 0 | 0 | 0 | 111.3 | L191 V192 H249 Y250 L251 H256 T257 | L191-L253 HydrophobicContact CD2-CD2 3.69Å; V192-L253 HydrophobicContact CG2-CB 4.32Å; V192-L253 HydrophobicContact CG2-CD2 3.83Å; V192-L253 HydrophobicContact CG2-CG 4.06Å; H249-L253 WeakPolarHBondContact O-CB 3.49Å; H249-L253 PolarHBondContact O-N 3.05Å; Y250-L253 PolarHBondContact O-N 3.15Å; L251-L253 VanDerWaalsContact C-N 3.33Å; L253-H256 PolarHBondContact O-N 2.79Å; L253-T257 WeakPolarHBondContact O-CG2 3.32Å; L253-T257 PolarHBondContact O-N 2.95Å; L253-T257 VanDerWaalsContact O-N 3.14Å |
| 254 | L | 78.5 | Confident | 77.1 | Confident | 67 Ų | 67 | 53.8 Ų | 53.8 | 35% | 0.351 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -65.1 | -40.1 | 176.3 | -175.3 | 65.6 | 0 | 0 | 0 | 112.6 | V192 Y250 L251 H256 T257 V258 | V192-L254 HydrophobicContact CG1-CB 4.39Å; V192-L254 HydrophobicContact CG1-CD1 4.39Å; V192-L254 HydrophobicContact CG2-CB 4.32Å; Y250-L254 WeakPolarHBondContact O-CB 3.44Å; Y250-L254 PolarHBondContact O-N 3.03Å; L251-L254 PolarHBondContact O-N 3.29Å; L254-H256 VanDerWaalsContact C-N 3.32Å; L254-H256 PolarHBondContact O-N 3.37Å; L254-T257 PolarHBondContact O-N 3.11Å; L254-T257 PolarHBondContact O-OG1 3.42Å; L254-V258 HydrophobicContact CD1-CG2 4.43Å; L254-V258 VanDerWaalsContact O-CG2 3.3Å; L254-V258 WeakPolarHBondContact O-CG2 3.49Å; L254-V258 PolarHBondContact O-N 3.09Å |
| 255 | G | 74.6 | Confident | 75.4 | Confident | 35 Ų | 35 | 57.1 Ų | 57.1 | 36% | 0.361 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -63 | -41.2 | 177 | 0 | 0 | 0 | 0 | 0 | 111.8 | L251 V252 L259 | L251-G255 PolarHBondContact O-N 3.43Å; V252-G255 PolarHBondContact O-N 3.48Å; G255-L259 VanDerWaalsContact O-CB 3.29Å; G255-L259 WeakPolarHBondContact O-CB 3.43Å; G255-L259 PolarHBondContact O-N 2.87Å |
| 256 | H | 73.6 | Confident | 73.8 | Confident | 78 Ų | 78 | 58.9 Ų | 58.9 | 36% | 0.361 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -63.3 | -42.2 | 176.7 | -174.5 | -94.4 | 0 | 0 | 0 | 112 | V252 L253 L254 L259 I260 | V252-H256 WeakPolarHBondContact O-CB 3.45Å; V252-H256 PolarHBondContact O-N 2.97Å; L253-H256 PolarHBondContact O-N 2.79Å; L254-H256 VanDerWaalsContact C-N 3.32Å; L254-H256 PolarHBondContact O-N 3.37Å; H256-L259 PolarHBondContact O-N 3.46Å; H256-I260 WeakPolarHBondContact CE1-CD1 3.49Å; H256-I260 WeakPolarHBondContact ND1-CD1 3.23Å; H256-I260 WeakPolarHBondContact O-CG1 3.2Å; H256-I260 PolarHBondContact O-N 3.36Å; H256-I260 VanDerWaalsContact O-N 3.15Å |
| 257 | T | 67.9 | Low | 72.5 | Confident | 9 Ų | 9 | 64.9 Ų | 64.9 | 6% | 0.055 | 37% | 0.366 | C | S | . | . | H | α-helix | trans | -68.7 | -42 | 179.1 | 57.4 | 0 | 0 | 0 | 0 | 112.7 | D188 L253 L254 L259 I260 S261 | D188-T257 HydrophobicContact CB-CG2 3.24Å; D188-T257 WeakPolarHBondContact OD2-CG2 3.44Å; L253-T257 WeakPolarHBondContact O-CG2 3.32Å; L253-T257 PolarHBondContact O-N 2.95Å; L253-T257 VanDerWaalsContact O-N 3.14Å; L254-T257 PolarHBondContact O-N 3.11Å; L254-T257 PolarHBondContact O-OG1 3.42Å; T257-L259 VanDerWaalsContact C-N 3.31Å; T257-L259 PolarHBondContact O-N 2.84Å; T257-I260 PolarHBondContact O-N 3.24Å; T257-S261 WeakPolarHBondContact O-CB 3.35Å; T257-S261 PolarHBondContact O-N 3.25Å; T257-S261 PolarHBondContact O-OG 3.29Å |
| 258 | V | 69.7 | Low | 71.3 | Confident | 58 Ų | 58 | 66 Ų | 66 | 35% | 0.352 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -66.4 | -34.7 | 177.3 | 173 | 0 | 0 | 0 | 0 | 111.7 | L254 S261 R262 | L254-V258 HydrophobicContact CD1-CG2 4.43Å; L254-V258 VanDerWaalsContact O-CG2 3.3Å; L254-V258 WeakPolarHBondContact O-CG2 3.49Å; L254-V258 PolarHBondContact O-N 3.09Å; V258-S261 WeakPolarHBondContact CA-OG 3.27Å; V258-S261 PolarHBondContact O-OG 2.97Å; V258-R262 WeakPolarHBondContact O-CB 3.34Å; V258-R262 WeakPolarHBondContact O-CG 3.12Å; V258-R262 PolarHBondContact O-N 3.23Å |
| 259 | L | 69.4 | Low | 70.1 | Confident | 28 Ų | 28 | 69.7 Ų | 69.7 | 15% | 0.147 | 39% | 0.392 | C | S | . | . | H | α-helix | trans | -69.6 | -41.2 | 178.8 | -169.5 | 66.1 | 0 | 0 | 0 | 111.6 | G255 H256 T257 Q264 V266 Y270 L274 | G255-L259 VanDerWaalsContact O-CB 3.29Å; G255-L259 WeakPolarHBondContact O-CB 3.43Å; G255-L259 PolarHBondContact O-N 2.87Å; H256-L259 PolarHBondContact O-N 3.46Å; T257-L259 VanDerWaalsContact C-N 3.31Å; T257-L259 PolarHBondContact O-N 2.84Å; L259-Q264 HydrophobicContact CD1-CB 4.48Å; L259-V266 HydrophobicContact CD1-CG2 4.23Å; L259-V266 HydrophobicContact CD2-CG1 4.16Å; L259-V266 HydrophobicContact CD2-CG2 3.57Å; L259-V266 HydrophobicContact CG-CG2 3.86Å; L259-Y270 HydrophobicContact CD1-CE1 4.22Å; L259-Y270 HydrophobicContact CD2-CD1 4.11Å; L259-Y270 HydrophobicContact CD2-CE1 3.83Å; L259-L274 HydrophobicContact CD2-CD2 4.23Å |
| 260 | I | 65.1 | Low | 69.1 | Low | 103 Ų | 103 | 74.5 Ų | 74.5 | 53% | 0.528 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -63.3 | -44.3 | 174.2 | -69.5 | 171 | 0 | 0 | 0 | 110.5 | H256 T257 R262 G263 | H256-I260 WeakPolarHBondContact CE1-CD1 3.49Å; H256-I260 WeakPolarHBondContact ND1-CD1 3.23Å; H256-I260 WeakPolarHBondContact O-CG1 3.2Å; H256-I260 PolarHBondContact O-N 3.36Å; H256-I260 VanDerWaalsContact O-N 3.15Å; T257-I260 PolarHBondContact O-N 3.24Å; I260-R262 VanDerWaalsContact C-N 3.29Å; I260-R262 PolarHBondContact O-N 2.89Å; I260-G263 PolarHBondContact O-N 2.81Å |
| 261 | S | 63.2 | Low | 68.3 | Low | 56 Ų | 56 | 78.1 Ų | 78.1 | 39% | 0.392 | 43% | 0.429 | S | S | . | . | H | α-helix | trans | -68.1 | -27.1 | -176.5 | 73.4 | 0 | 0 | 0 | 0 | 114.5 | E185 T257 V258 G263 | E185-S261 WeakPolarHBondContact OE1-CA 3.38Å; E185-S261 WeakPolarHBondContact OE1-CB 3.49Å; E185-S261 WeakPolarHBondContact OE2-CB 3.34Å; T257-S261 WeakPolarHBondContact O-CB 3.35Å; T257-S261 PolarHBondContact O-N 3.25Å; T257-S261 PolarHBondContact O-OG 3.29Å; V258-S261 WeakPolarHBondContact CA-OG 3.27Å; V258-S261 PolarHBondContact O-OG 2.97Å; S261-G263 VanDerWaalsContact C-N 3.34Å |
| 262 | R | 62.7 | Low | 67.4 | Low | 183 Ų | 183 | 75.3 Ų | 75.3 | 69% | 0.691 | 42% | 0.424 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -83.8 | -7.2 | 178.3 | -72.6 | -176.2 | 175.9 | -166 | -0.5 | 114 | V258 I260 Q264 | V258-R262 WeakPolarHBondContact O-CB 3.34Å; V258-R262 WeakPolarHBondContact O-CG 3.12Å; V258-R262 PolarHBondContact O-N 3.23Å; I260-R262 VanDerWaalsContact C-N 3.29Å; I260-R262 PolarHBondContact O-N 2.89Å; R262-Q264 PolarHBondContact O-N 2.68Å |
| 263 | G | 57.2 | Low | 66.9 | Low | 66 Ų | 66 | 78.8 Ų | 78.8 | 68% | 0.68 | 44% | 0.441 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 56.4 | 23 | -179.7 | 0 | 0 | 0 | 0 | 0 | 113.9 | I260 S261 | I260-G263 PolarHBondContact O-N 2.81Å; S261-G263 VanDerWaalsContact C-N 3.34Å |
| 264 | Q | 57.1 | Low | 66.8 | Low | 124 Ų | 124 | 78.3 Ų | 78.3 | 58% | 0.579 | 44% | 0.439 | S | S | * | . | trans | -73.6 | 133.3 | -176.9 | -112.4 | -154.5 | -67.5 | 0 | 0 | 109.8 | L259 R262 V266 | L259-Q264 HydrophobicContact CD1-CB 4.48Å; R262-Q264 PolarHBondContact O-N 2.68Å; Q264-V266 PolarHBondContact O-N 2.77Å; Q264-V266 VanDerWaalsContact O-N 3.13Å | ||
| 265 | P | 55.8 | Low | 66.5 | Low | 112 Ų | 112 | 79.7 Ų | 79.7 | 73% | 0.727 | 44% | 0.443 | S | S | * | . | trans | -61.3 | 119.2 | 168.4 | 25.2 | -30.8 | 0 | 0 | 0 | 108.2 | D267 | P265-D267 PolarHBondContact O-N 2.68Š| ||
| 266 | V | 59.3 | Low | 66.7 | Low | 60 Ų | 60 | 80.2 Ų | 80.2 | 36% | 0.364 | 44% | 0.436 | S | S | . | . | trans | -83.7 | 112.9 | -177.8 | -173.6 | 0 | 0 | 0 | 0 | 107.9 | L259 Q264 Y270 L271 | L259-V266 HydrophobicContact CD1-CG2 4.23Å; L259-V266 HydrophobicContact CD2-CG1 4.16Å; L259-V266 HydrophobicContact CD2-CG2 3.57Å; L259-V266 HydrophobicContact CG-CG2 3.86Å; Q264-V266 PolarHBondContact O-N 2.77Å; Q264-V266 VanDerWaalsContact O-N 3.13Å; V266-Y270 HydrophobicContact CG1-CD1 3.84Å; V266-Y270 HydrophobicContact CG1-CG 4.38Å; V266-L271 HydrophobicContact CG1-CB 4.15Å; V266-L271 HydrophobicContact CG1-CD1 4.47Å | ||
| 267 | D | 65.9 | Low | 67.2 | Low | 126 Ų | 126 | 78 Ų | 78 | 67% | 0.674 | 43% | 0.431 | S | S | * | . | trans | -56.8 | 143.4 | 172.9 | -73.1 | -35.7 | 0 | 0 | 0 | 110.6 | P265 H269 Y270 L271 | P265-D267 PolarHBondContact O-N 2.68Å; D267-H269 PolarHBondContact O-N 3.29Å; D267-H269 VanDerWaalsContact O-N 3.1Å; D267-Y270 WeakPolarHBondContact O-CA 3.49Å; D267-Y270 WeakPolarHBondContact O-CB 3.3Å; D267-Y270 PolarHBondContact O-N 3.38Å; D267-L271 PolarHBondContact O-N 3.44Å | ||
| 268 | A | 63.8 | Low | 67.8 | Low | 54 Ų | 54 | 81.9 Ų | 81.9 | 45% | 0.446 | 45% | 0.447 | S | S | . | . | H | α-helix | trans | -57.1 | -30.3 | -177.8 | 0 | 0 | 0 | 0 | 0 | 113 | W6 G272 | W6-A268 HydrophobicContact CH2-CB 4.29Å; W6-A268 HydrophobicContact CZ2-CB 3.69Å; A268-G272 PolarHBondContact O-N 2.87Å |
| 269 | H | 64 | Low | 68.3 | Low | 117 Ų | 117 | 80.1 Ų | 80.1 | 54% | 0.542 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -68 | -42.6 | 173.7 | -174.5 | 83.1 | 0 | 0 | 0 | 112.2 | E15 D267 L271 G272 L273 | E15-H269 IonicContact OE2-CE1 3.63Å; D267-H269 PolarHBondContact O-N 3.29Å; D267-H269 VanDerWaalsContact O-N 3.1Å; H269-L271 VanDerWaalsContact C-N 3.31Å; H269-L271 PolarHBondContact O-N 3.22Å; H269-G272 PolarHBondContact O-N 3.16Å; H269-L273 PolarHBondContact O-N 2.93Å; H269-L273 VanDerWaalsContact O-N 3.16Å |
| 270 | Y | 68 | Low | 69 | Low | 122 Ų | 122 | 81.5 Ų | 81.5 | 48% | 0.478 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -67.1 | -34.7 | 178.4 | -160.4 | -92.9 | 0 | 0 | 0 | 111.8 | L259 V266 D267 L273 L274 | L259-Y270 HydrophobicContact CD1-CE1 4.22Å; L259-Y270 HydrophobicContact CD2-CD1 4.11Å; L259-Y270 HydrophobicContact CD2-CE1 3.83Å; V266-Y270 HydrophobicContact CG1-CD1 3.84Å; V266-Y270 HydrophobicContact CG1-CG 4.38Å; D267-Y270 WeakPolarHBondContact O-CA 3.49Å; D267-Y270 WeakPolarHBondContact O-CB 3.3Å; D267-Y270 PolarHBondContact O-N 3.38Å; Y270-L273 PolarHBondContact O-N 3.01Å; Y270-L274 WeakPolarHBondContact O-CB 3.08Å; Y270-L274 PolarHBondContact O-N 2.94Å |
| 271 | L | 69.4 | Low | 70.2 | Confident | 81 Ų | 81 | 76.6 Ų | 76.6 | 42% | 0.424 | 42% | 0.418 | S | S | . | . | H | α-helix | trans | -64.8 | -41.9 | 175.2 | -168.7 | 65.2 | 0 | 0 | 0 | 111.9 | V266 D267 H269 L274 H275 | V266-L271 HydrophobicContact CG1-CB 4.15Å; V266-L271 HydrophobicContact CG1-CD1 4.47Å; D267-L271 PolarHBondContact O-N 3.44Å; H269-L271 VanDerWaalsContact C-N 3.31Å; H269-L271 PolarHBondContact O-N 3.22Å; L271-L274 PolarHBondContact O-N 3.26Å; L271-H275 PolarHBondContact O-N 3.17Å; L271-H275 VanDerWaalsContact O-N 3.1Å; L271-H275 PolarHBondContact O-ND1 2.87Å |
| 272 | G | 67.5 | Low | 71.3 | Confident | 39 Ų | 39 | 75.9 Ų | 75.9 | 40% | 0.402 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -62.6 | -45.9 | 176 | 0 | 0 | 0 | 0 | 0 | 112.5 | A268 H269 L274 H275 F276 | A268-G272 PolarHBondContact O-N 2.87Å; H269-G272 PolarHBondContact O-N 3.16Å; G272-L274 VanDerWaalsContact C-N 3.34Å; G272-L274 PolarHBondContact O-N 3.2Å; G272-H275 PolarHBondContact O-N 2.95Å; G272-F276 PolarHBondContact O-N 3.33Å |
| 273 | L | 74.3 | Confident | 72.5 | Confident | 97 Ų | 97 | 67.5 Ų | 67.5 | 51% | 0.508 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -62.5 | -39.6 | 176.7 | -176.1 | 62.8 | 0 | 0 | 0 | 112.3 | H269 Y270 F276 A277 | H269-L273 PolarHBondContact O-N 2.93Å; H269-L273 VanDerWaalsContact O-N 3.16Å; Y270-L273 PolarHBondContact O-N 3.01Å; L273-F276 PolarHBondContact O-N 2.87Å; L273-A277 VanDerWaalsContact O-CB 3.29Å; L273-A277 WeakPolarHBondContact O-CB 3.23Å; L273-A277 PolarHBondContact O-N 3.05Å |
| 274 | L | 75 | Confident | 74.1 | Confident | 29 Ų | 29 | 66.9 Ų | 66.9 | 15% | 0.152 | 36% | 0.357 | C | S | . | . | H | α-helix | trans | -65.7 | -40.1 | 178.1 | -171.5 | 68.4 | 0 | 0 | 0 | 112.2 | V252 L259 Y270 L271 G272 A277 K278 | V252-L274 HydrophobicContact CG1-CD1 4.46Å; L259-L274 HydrophobicContact CD2-CD2 4.23Å; Y270-L274 WeakPolarHBondContact O-CB 3.08Å; Y270-L274 PolarHBondContact O-N 2.94Å; L271-L274 PolarHBondContact O-N 3.26Å; G272-L274 VanDerWaalsContact C-N 3.34Å; G272-L274 PolarHBondContact O-N 3.2Å; L274-A277 PolarHBondContact O-N 3.26Å; L274-K278 VanDerWaalsContact O-CB 3.3Å; L274-K278 WeakPolarHBondContact O-CB 3.43Å; L274-K278 PolarHBondContact O-N 3.4Å |
| 275 | H | 74 | Confident | 75.7 | Confident | 96 Ų | 96 | 61 Ų | 61 | 44% | 0.444 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -64 | -48.2 | 173.8 | -76.2 | 93.5 | 0 | 0 | 0 | 111.2 | L271 G272 A277 K278 D279 | L271-H275 PolarHBondContact O-N 3.17Å; L271-H275 VanDerWaalsContact O-N 3.1Å; L271-H275 PolarHBondContact O-ND1 2.87Å; G272-H275 PolarHBondContact O-N 2.95Å; H275-A277 VanDerWaalsContact C-N 3.34Å; H275-A277 PolarHBondContact O-N 2.91Å; H275-K278 WeakPolarHBondContact O-CB 3.35Å; H275-K278 PolarHBondContact O-N 2.83Å; H275-K278 VanDerWaalsContact O-N 3.16Å; H275-D279 VanDerWaalsContact O-CG 3.23Å; H275-D279 PolarHBondContact O-N 3.26Å |
| 276 | F | 77.9 | Confident | 77.4 | Confident | 47 Ų | 47 | 56.2 Ų | 56.2 | 21% | 0.206 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -56.5 | -47.5 | 175.3 | 174.2 | -98.3 | 0 | 0 | 0 | 112 | L22 L26 G272 L273 K278 D279 L280 | L22-F276 HydrophobicContact CD1-CE1 4.24Å; L22-F276 HydrophobicContact CD1-CE2 3.66Å; L22-F276 HydrophobicContact CD1-CZ 3.46Å; L22-F276 VanDerWaalsContact CD1-CZ 3.46Å; L22-F276 HydrophobicContact CD2-CD1 3.99Å; L22-F276 HydrophobicContact CD2-CD2 3.79Å; L22-F276 HydrophobicContact CD2-CE1 3.88Å; L22-F276 HydrophobicContact CD2-CE2 3.69Å; L22-F276 HydrophobicContact CD2-CG 3.95Å; L22-F276 HydrophobicContact CD2-CZ 3.74Å; L22-F276 HydrophobicContact CG-CD2 3.81Å; L22-F276 HydrophobicContact CG-CE1 4.28Å; L22-F276 HydrophobicContact CG-CE2 3.35Å; L22-F276 HydrophobicContact CG-CG 4.47Å; L22-F276 HydrophobicContact CG-CZ 3.62Å; L26-F276 HydrophobicContact CB-CE2 4.16Å; L26-F276 HydrophobicContact CD1-CE2 4.16Å; L26-F276 HydrophobicContact CD2-CD2 3.92Å; L26-F276 HydrophobicContact CD2-CE2 4.03Å; L26-F276 HydrophobicContact CG-CE2 4.35Å; G272-F276 PolarHBondContact O-N 3.33Å; L273-F276 PolarHBondContact O-N 2.87Å; F276-K278 VanDerWaalsContact C-N 3.33Å; F276-K278 PolarHBondContact O-N 3.04Å; F276-D279 PolarHBondContact O-N 3.47Å; F276-L280 HydrophobicContact CE1-CD2 3.97Å; F276-L280 HydrophobicContact CZ-CB 4.46Å; F276-L280 HydrophobicContact CZ-CD2 4.1Å; F276-L280 WeakPolarHBondContact O-CB 3.44Å; F276-L280 PolarHBondContact O-N 3.1Å |
| 277 | A | 83.2 | Confident | 78.9 | Confident | 31 Ų | 31 | 54.3 Ų | 54.3 | 26% | 0.256 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -61.2 | -41.5 | 177.8 | 0 | 0 | 0 | 0 | 0 | 111.7 | V252 L273 L274 H275 D279 S281 | V252-A277 HydrophobicContact CG2-CB 3.88Å; L273-A277 VanDerWaalsContact O-CB 3.29Å; L273-A277 WeakPolarHBondContact O-CB 3.23Å; L273-A277 PolarHBondContact O-N 3.05Å; L274-A277 PolarHBondContact O-N 3.26Å; H275-A277 VanDerWaalsContact C-N 3.34Å; H275-A277 PolarHBondContact O-N 2.91Å; A277-D279 VanDerWaalsContact C-N 3.34Å; A277-D279 PolarHBondContact O-N 3.38Å; A277-S281 WeakPolarHBondContact O-CB 3.45Å; A277-S281 PolarHBondContact O-N 3.26Å; A277-S281 PolarHBondContact O-OG 3.06Å |
| 278 | K | 81.4 | Confident | 80.2 | Confident | 91 Ų | 91 | 48.5 Ų | 48.5 | 40% | 0.396 | 26% | 0.256 | S | S | . | . | H | α-helix | trans | -59.9 | -43.9 | 175 | -174.7 | 177.5 | -177.2 | 173.7 | 0 | 111.6 | V252 L274 H275 F276 S281 K282 | V252-K278 HydrophobicContact CG1-CB 3.9Å; V252-K278 HydrophobicContact CG1-CG 4.34Å; L274-K278 VanDerWaalsContact O-CB 3.3Å; L274-K278 WeakPolarHBondContact O-CB 3.43Å; L274-K278 PolarHBondContact O-N 3.4Å; H275-K278 WeakPolarHBondContact O-CB 3.35Å; H275-K278 PolarHBondContact O-N 2.83Å; H275-K278 VanDerWaalsContact O-N 3.16Å; F276-K278 VanDerWaalsContact C-N 3.33Å; F276-K278 PolarHBondContact O-N 3.04Å; K278-S281 PolarHBondContact O-N 3.27Å; K278-S281 PolarHBondContact O-OG 2.83Å; K278-K282 WeakPolarHBondContact O-CG 3.27Å; K278-K282 PolarHBondContact O-N 3.41Å; K278-K282 VanDerWaalsContact O-N 3.08Å |
| 279 | D | 79.9 | Confident | 81.5 | Confident | 20 Ų | 20 | 46 Ų | 46 | 11% | 0.107 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -75.3 | -41.9 | -175.7 | -62.6 | -27.2 | 0 | 0 | 0 | 112 | W2 L26 H275 F276 A277 S281 K282 L283 | W2-D279 HydrophobicContact CE3-CB 4.36Å; W2-D279 HydrophobicContact CH2-CB 4.1Å; W2-D279 HydrophobicContact CZ3-CB 3.9Å; W2-D279 WeakPolarHBondContact CZ3-OD1 3.33Å; W2-D279 WeakPolarHBondContact CZ3-OD2 3.5Å; L26-D279 HydrophobicContact CD2-CB 3.73Å; H275-D279 VanDerWaalsContact O-CG 3.23Å; H275-D279 PolarHBondContact O-N 3.26Å; F276-D279 PolarHBondContact O-N 3.47Å; A277-D279 VanDerWaalsContact C-N 3.34Å; A277-D279 PolarHBondContact O-N 3.38Å; D279-S281 VanDerWaalsContact C-N 3.29Å; D279-S281 PolarHBondContact O-N 2.96Å; D279-K282 PolarHBondContact O-N 2.68Å; D279-K282 IonicContact OD1-NZ 3.95Å; D279-L283 PolarHBondContact O-N 3.02Å |
| 280 | L | 85.4 | Confident | 82.7 | Confident | 57 Ų | 57 | 43.8 Ų | 43.8 | 30% | 0.298 | 22% | 0.224 | S | C | . | . | H | α-helix | trans | -58.8 | -42.1 | 170.1 | -178.6 | 61.2 | 0 | 0 | 0 | 111.3 | L26 F276 K282 L283 L284 | L26-L280 HydrophobicContact CD1-CB 4.21Å; L26-L280 HydrophobicContact CD1-CD1 4.19Å; F276-L280 HydrophobicContact CE1-CD2 3.97Å; F276-L280 HydrophobicContact CZ-CB 4.46Å; F276-L280 HydrophobicContact CZ-CD2 4.1Å; F276-L280 WeakPolarHBondContact O-CB 3.44Å; F276-L280 PolarHBondContact O-N 3.1Å; L280-K282 PolarHBondContact O-N 3.39Å; L280-L283 PolarHBondContact O-N 3.37Å; L280-L284 HydrophobicContact CG-CD1 4.28Å; L280-L284 WeakPolarHBondContact O-CG 3.49Å; L280-L284 PolarHBondContact O-N 3.25Å |
| 281 | S | 89.3 | Confident | 83.8 | Confident | 1 Ų | 1 | 39.2 Ų | 39.2 | 1% | 0.007 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -63.5 | -39.5 | 179.2 | 79.2 | 0 | 0 | 0 | 0 | 113 | A277 K278 D279 L284 A285 | A277-S281 WeakPolarHBondContact O-CB 3.45Å; A277-S281 PolarHBondContact O-N 3.26Å; A277-S281 PolarHBondContact O-OG 3.06Å; K278-S281 PolarHBondContact O-N 3.27Å; K278-S281 PolarHBondContact O-OG 2.83Å; D279-S281 VanDerWaalsContact C-N 3.29Å; D279-S281 PolarHBondContact O-N 2.96Å; S281-L284 PolarHBondContact O-N 3.17Å; S281-A285 WeakPolarHBondContact O-CB 3.19Å; S281-A285 PolarHBondContact O-N 3.41Å |
| 282 | K | 86.1 | Confident | 84.9 | Confident | 40 Ų | 40 | 35.5 Ų | 35.5 | 17% | 0.174 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -65.4 | -43.8 | 175.8 | -74.8 | 171.1 | -179.7 | 171.1 | 0 | 111 | K278 D279 L280 L284 A285 F286 | K278-K282 WeakPolarHBondContact O-CG 3.27Å; K278-K282 PolarHBondContact O-N 3.41Å; K278-K282 VanDerWaalsContact O-N 3.08Å; D279-K282 PolarHBondContact O-N 2.68Å; D279-K282 IonicContact OD1-NZ 3.95Å; L280-K282 PolarHBondContact O-N 3.39Å; K282-L284 VanDerWaalsContact C-N 3.32Å; K282-L284 PolarHBondContact O-N 3.01Å; K282-A285 WeakPolarHBondContact O-CB 3.21Å; K282-A285 PolarHBondContact O-N 2.92Å; K282-F286 HydrophobicContact CB-CD2 4.5Å; K282-F286 HydrophobicContact CB-CE2 4.34Å; K282-F286 WeakPolarHBondContact O-CD2 3.34Å; K282-F286 PolarHBondContact O-N 3.28Å |
| 283 | L | 88.1 | Confident | 85.9 | Confident | 7 Ų | 7 | 33.9 Ų | 33.9 | 4% | 0.037 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -60.2 | -43 | 177.6 | -179.9 | 75.2 | 0 | 0 | 0 | 111.8 | L26 L29 L84 D279 L280 F286 S287 | L26-L283 HydrophobicContact CD1-CD2 4.43Å; L29-L283 HydrophobicContact CB-CD2 4.1Å; L29-L283 HydrophobicContact CD2-CD2 3.24Å; L29-L283 HydrophobicContact CG-CD2 3.39Å; L84-L283 HydrophobicContact CD1-CD1 4.28Å; L84-L283 HydrophobicContact CD2-CB 4.4Å; L84-L283 HydrophobicContact CD2-CD1 4.19Å; D279-L283 PolarHBondContact O-N 3.02Å; L280-L283 PolarHBondContact O-N 3.37Å; L283-F286 PolarHBondContact O-N 3.15Å; L283-S287 PolarHBondContact O-N 2.91Å; L283-S287 PolarHBondContact O-OG 2.97Å |
| 284 | L | 90.7 | Very high | 86.6 | Confident | 53 Ų | 53 | 33.4 Ų | 33.4 | 28% | 0.277 | 17% | 0.17 | S | C | . | . | H | α-helix | trans | -63.4 | -43.5 | 174.3 | -69.6 | 172.6 | 0 | 0 | 0 | 111.4 | L245 P248 L280 S281 K282 F286 S287 S288 | L245-L284 HydrophobicContact CD2-CB 4.41Å; L245-L284 HydrophobicContact CD2-CD2 4.15Å; L245-L284 CarbonylContact O-C 3.51Å; P248-L284 HydrophobicContact CB-CD1 4.17Å; P248-L284 HydrophobicContact CG-CD1 3.76Å; L280-L284 HydrophobicContact CG-CD1 4.28Å; L280-L284 WeakPolarHBondContact O-CG 3.49Å; L280-L284 PolarHBondContact O-N 3.25Å; S281-L284 PolarHBondContact O-N 3.17Å; K282-L284 VanDerWaalsContact C-N 3.32Å; K282-L284 PolarHBondContact O-N 3.01Å; L284-F286 PolarHBondContact O-N 2.93Å; L284-S287 VanDerWaalsContact O-CB 3.28Å; L284-S287 WeakPolarHBondContact O-CB 3.35Å; L284-S287 PolarHBondContact O-N 3.46Å; L284-S288 PolarHBondContact O-N 3.04Å |
| 285 | A | 91.7 | Very high | 87.2 | Confident | 0 Ų | 0 | 32.7 Ų | 32.7 | 0% | 0 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -58.7 | -46.2 | 175 | 0 | 0 | 0 | 0 | 0 | 112.4 | F109 L245 W246 S281 K282 S287 S288 | F109-A285 HydrophobicContact CE2-CB 4.49Å; F109-A285 HydrophobicContact CZ-CB 4.24Å; L245-A285 PolarHBondContact O-N 3.12Å; W246-A285 HydrophobicContact CD2-CB 4.29Å; W246-A285 HydrophobicContact CE3-CB 3.66Å; W246-A285 HydrophobicContact CH2-CB 4.04Å; W246-A285 HydrophobicContact CZ3-CB 3.53Å; S281-A285 WeakPolarHBondContact O-CB 3.19Å; S281-A285 PolarHBondContact O-N 3.41Å; K282-A285 WeakPolarHBondContact O-CB 3.21Å; K282-A285 PolarHBondContact O-N 2.92Å; A285-S287 PolarHBondContact O-N 3.5Å; A285-S288 VanDerWaalsContact O-CB 3.28Å; A285-S288 WeakPolarHBondContact O-CB 3.32Å; A285-S288 PolarHBondContact O-N 2.98Å; A285-S288 PolarHBondContact O-OG 3.41Å |
| 286 | F | 90.9 | Very high | 87.9 | Confident | 12 Ų | 12 | 28.1 Ų | 28.1 | 5% | 0.053 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -64.3 | -28.5 | 175.3 | -74.5 | -62.5 | 0 | 0 | 0 | 112.9 | L76 L79 A80 H83 L84 F109 K282 L283 L284 S288 S289 | L76-F286 HydrophobicContact CB-CD1 4.16Å; L76-F286 HydrophobicContact CB-CE1 4.45Å; L76-F286 HydrophobicContact CD2-CD1 4.35Å; L76-F286 HydrophobicContact CD2-CE1 4.15Å; L76-F286 WeakPolarHBondContact O-CD1 3.44Å; L76-F286 VanDerWaalsContact O-CE1 3.32Å; L76-F286 WeakPolarHBondContact O-CE1 3.13Å; L79-F286 HydrophobicContact CB-CE1 4.18Å; A80-F286 HydrophobicContact CB-CD1 3.7Å; A80-F286 HydrophobicContact CB-CE1 3.99Å; A80-F286 HydrophobicContact CB-CG 4.08Å; H83-F286 HydrophobicContact CB-CE2 3.67Å; H83-F286 HydrophobicContact CB-CZ 3.52Å; H83-F286 AromaticContact CG-CZ 3.94Å; L84-F286 HydrophobicContact CD1-CB 4.46Å; L84-F286 HydrophobicContact CD1-CD2 3.98Å; L84-F286 HydrophobicContact CD1-CG 4.34Å; L84-F286 HydrophobicContact CD2-CD2 3.77Å; L84-F286 HydrophobicContact CD2-CE2 4.13Å; L84-F286 HydrophobicContact CG-CD2 3.78Å; L84-F286 HydrophobicContact CG-CE2 4.04Å; F109-F286 HydrophobicContact CD2-CE1 4.14Å; F109-F286 AromaticContact CD2-CZ 3.91Å; F109-F286 HydrophobicContact CD2-CZ 3.91Å; F109-F286 HydrophobicContact CE2-CE1 4.19Å; F109-F286 HydrophobicContact CE2-CE2 4.28Å; F109-F286 AromaticContact CE2-CZ 3.86Å; F109-F286 HydrophobicContact CE2-CZ 3.86Å; K282-F286 HydrophobicContact CB-CD2 4.5Å; K282-F286 HydrophobicContact CB-CE2 4.34Å; K282-F286 WeakPolarHBondContact O-CD2 3.34Å; K282-F286 PolarHBondContact O-N 3.28Å; L283-F286 PolarHBondContact O-N 3.15Å; L284-F286 PolarHBondContact O-N 2.93Å; F286-S288 PolarHBondContact O-N 2.95Å; F286-S289 VanDerWaalsContact O-CB 3.31Å; F286-S289 WeakPolarHBondContact O-CB 3.39Å; F286-S289 PolarHBondContact O-N 3.29Å; F286-S289 VanDerWaalsContact O-N 3.13Å |
| 287 | S | 90.8 | Very high | 88.3 | Confident | 21 Ų | 21 | 32.8 Ų | 32.8 | 15% | 0.147 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -64.5 | -25 | 177.6 | -59.4 | 0 | 0 | 0 | 0 | 113.2 | L283 L284 A285 S289 F290 V291 | L283-S287 PolarHBondContact O-N 2.91Å; L283-S287 PolarHBondContact O-OG 2.97Å; L284-S287 VanDerWaalsContact O-CB 3.28Å; L284-S287 WeakPolarHBondContact O-CB 3.35Å; L284-S287 PolarHBondContact O-N 3.46Å; A285-S287 PolarHBondContact O-N 3.5Å; S287-S289 PolarHBondContact O-N 2.94Å; S287-S289 VanDerWaalsContact O-N 3.14Å; S287-F290 PolarHBondContact O-N 2.84Å; S287-F290 WeakPolarHBondContact OG-CZ 3.19Å; S287-V291 VanDerWaalsContact O-CG2 3.28Å; S287-V291 WeakPolarHBondContact O-CG2 3.46Å; S287-V291 PolarHBondContact O-N 2.66Å |
| 288 | S | 92.3 | Very high | 88.3 | Confident | 3 Ų | 3 | 38.6 Ų | 38.6 | 2% | 0.021 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -55.6 | -31.6 | 173.6 | 71.4 | 0 | 0 | 0 | 0 | 112.8 | W246 L284 A285 F286 T292 | W246-S288 WeakPolarHBondContact CZ2-OG 3.02Å; W246-S288 PolarHBondContact NE1-OG 3.4Å; L284-S288 PolarHBondContact O-N 3.04Å; A285-S288 VanDerWaalsContact O-CB 3.28Å; A285-S288 WeakPolarHBondContact O-CB 3.32Å; A285-S288 PolarHBondContact O-N 2.98Å; A285-S288 PolarHBondContact O-OG 3.41Å; F286-S288 PolarHBondContact O-N 2.95Å; S288-T292 WeakPolarHBondContact O-CB 3.5Å; S288-T292 PolarHBondContact O-N 3.49Å; S288-T292 VanDerWaalsContact O-N 3.09Å; S288-T292 PolarHBondContact O-OG1 3Å |
| 289 | S | 92.1 | Very high | 88.3 | Confident | 3 Ų | 3 | 36.1 Ų | 36.1 | 2% | 0.021 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -60.5 | -52.4 | 179.8 | 173.6 | 0 | 0 | 0 | 0 | 112.1 | N45 G73 S77 F286 S287 P293 | N45-S289 PolarHBondContact ND2-O 2.97Å; N45-S289 PolarHBondContact ND2-OG 3.34Å; G73-S289 PolarHBondContact O-OG 3.26Å; S77-S289 PolarHBondContact OG-OG 3.43Å; F286-S289 VanDerWaalsContact O-CB 3.31Å; F286-S289 WeakPolarHBondContact O-CB 3.39Å; F286-S289 PolarHBondContact O-N 3.29Å; F286-S289 VanDerWaalsContact O-N 3.13Å; S287-S289 PolarHBondContact O-N 2.94Å; S287-S289 VanDerWaalsContact O-N 3.14Å; S289-P293 WeakPolarHBondContact O-CD 3.32Å |
| 290 | F | 89.6 | Confident | 88.3 | Confident | 69 Ų | 69 | 36.1 Ų | 36.1 | 30% | 0.303 | 17% | 0.168 | S | C | . | . | H | α-helix | trans | -81.5 | -19.9 | -176.7 | 60.6 | -107.6 | 0 | 0 | 0 | 113.2 | V40 S287 | V40-F290 HydrophobicContact CG1-CB 4.05Å; S287-F290 PolarHBondContact O-N 2.84Å; S287-F290 WeakPolarHBondContact OG-CZ 3.19Å |
| 291 | V | 91.3 | Very high | 87.9 | Confident | 26 Ų | 26 | 41 Ų | 41 | 16% | 0.158 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -77.4 | -32 | 176.7 | 176.5 | 0 | 0 | 0 | 0 | 112 | T241 L245 S287 L294 L295 | T241-V291 HydrophobicContact CG2-CG1 3.54Å; L245-V291 HydrophobicContact CD1-CB 4.31Å; L245-V291 HydrophobicContact CD1-CG2 4.25Å; S287-V291 VanDerWaalsContact O-CG2 3.28Å; S287-V291 WeakPolarHBondContact O-CG2 3.46Å; S287-V291 PolarHBondContact O-N 2.66Å; V291-L294 WeakPolarHBondContact O-CB 3.47Å; V291-L294 PolarHBondContact O-N 3.1Å; V291-L294 VanDerWaalsContact O-N 3.11Å; V291-L295 HydrophobicContact CG1-CD1 3.82Å; V291-L295 HydrophobicContact CG1-CG 4.02Å; V291-L295 WeakPolarHBondContact O-CG 3.45Å; V291-L295 PolarHBondContact O-N 2.98Å |
| 292 | T | 91.4 | Very high | 87.2 | Confident | 3 Ų | 3 | 43.6 Ų | 43.6 | 2% | 0.018 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -56 | -49.4 | -177.9 | -62.6 | 0 | 0 | 0 | 0 | 113.5 | F66 M69 Q242 S288 L294 L295 Y296 | F66-T292 HydrophobicContact CD1-CG2 4.08Å; F66-T292 HydrophobicContact CE1-CG2 4.44Å; M69-T292 HydrophobicContact CB-CG2 3.67Å; Q242-T292 PolarHBondContact NE2-OG1 3.43Å; S288-T292 WeakPolarHBondContact O-CB 3.5Å; S288-T292 PolarHBondContact O-N 3.49Å; S288-T292 VanDerWaalsContact O-N 3.09Å; S288-T292 PolarHBondContact O-OG1 3Å; T292-L294 VanDerWaalsContact C-N 3.29Å; T292-L294 PolarHBondContact O-N 2.97Å; T292-L295 PolarHBondContact O-N 2.59Å; T292-Y296 PolarHBondContact O-N 2.93Å |
| 293 | P | 87.9 | Confident | 86.8 | Confident | 5 Ų | 5 | 42.4 Ų | 42.4 | 3% | 0.032 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -65.5 | -30.1 | 176.8 | -23.8 | 35.1 | 0 | 0 | 0 | 114.3 | Y44 N45 L48 S289 Y296 R297 | Y44-P293 HydrophobicContact CG-CB 4.48Å; N45-P293 HydrophobicContact CB-CG 4.42Å; N45-P293 VanDerWaalsContact OD1-CG 3.23Å; N45-P293 WeakPolarHBondContact OD1-CG 3.24Å; L48-P293 HydrophobicContact CD1-CB 4.23Å; L48-P293 HydrophobicContact CD1-CG 4.48Å; S289-P293 WeakPolarHBondContact O-CD 3.32Å; P293-Y296 PolarHBondContact O-N 3.4Å; P293-R297 WeakPolarHBondContact O-CB 3.28Å; P293-R297 PolarHBondContact O-N 3.38Å |
| 294 | L | 88.8 | Confident | 86.4 | Confident | 88 Ų | 88 | 44.9 Ų | 44.9 | 46% | 0.461 | 22% | 0.219 | S | C | . | . | H | α-helix | trans | -66.2 | -47.1 | 176.4 | -176.2 | 66.1 | 0 | 0 | 0 | 110.3 | V291 T292 Y296 R297 Y298 | V291-L294 WeakPolarHBondContact O-CB 3.47Å; V291-L294 PolarHBondContact O-N 3.1Å; V291-L294 VanDerWaalsContact O-N 3.11Å; T292-L294 VanDerWaalsContact C-N 3.29Å; T292-L294 PolarHBondContact O-N 2.97Å; L294-Y296 VanDerWaalsContact C-N 3.32Å; L294-Y296 PolarHBondContact O-N 3.44Å; L294-R297 PolarHBondContact O-N 3.37Å; L294-Y298 HydrophobicContact CD1-CD2 4.31Å; L294-Y298 HydrophobicContact CD1-CE2 3.59Å; L294-Y298 HydrophobicContact CD2-CE2 4.48Å; L294-Y298 HydrophobicContact CG-CD2 4.2Å; L294-Y298 HydrophobicContact CG-CE2 3.75Å; L294-Y298 WeakPolarHBondContact O-CD2 3.13Å; L294-Y298 PolarHBondContact O-N 3.22Å |
| 295 | L | 88.5 | Confident | 85.9 | Confident | 14 Ų | 14 | 43.5 Ų | 43.5 | 7% | 0.073 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -58.3 | -44.7 | 174 | -67.9 | 168.4 | 0 | 0 | 0 | 111.1 | F66 L234 T238 T241 V291 T292 R297 Y298 M299 | F66-L295 HydrophobicContact CE1-CB 4.05Å; F66-L295 HydrophobicContact CZ-CB 4.4Å; L234-L295 HydrophobicContact CD1-CD2 4.3Å; T238-L295 HydrophobicContact CG2-CD1 4.14Å; T241-L295 HydrophobicContact CG2-CD1 4.29Å; V291-L295 HydrophobicContact CG1-CD1 3.82Å; V291-L295 HydrophobicContact CG1-CG 4.02Å; V291-L295 WeakPolarHBondContact O-CG 3.45Å; V291-L295 PolarHBondContact O-N 2.98Å; T292-L295 PolarHBondContact O-N 2.59Å; L295-R297 PolarHBondContact O-N 3.08Å; L295-Y298 PolarHBondContact O-N 2.88Å; L295-M299 WeakPolarHBondContact O-CB 3.34Å; L295-M299 PolarHBondContact O-N 3.05Å; L295-M299 VanDerWaalsContact O-N 3.09Å |
| 296 | Y | 88.1 | Confident | 85.4 | Confident | 0 Ų | 0 | 43.5 Ų | 43.5 | 0% | 0 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -60.1 | -43.9 | 177.3 | -177.1 | -121.3 | 0 | 0 | 0 | 113 | L48 N52 D63 F66 T292 P293 L294 Y298 M299 N300 F303 | L48-Y296 HydrophobicContact CD1-CD1 3.39Å; L48-Y296 HydrophobicContact CD1-CE1 4.17Å; L48-Y296 HydrophobicContact CD1-CG 3.62Å; L48-Y296 HydrophobicContact CD2-CD1 4.44Å; L48-Y296 HydrophobicContact CD2-CE1 4.46Å; L48-Y296 HydrophobicContact CG-CD1 3.55Å; L48-Y296 HydrophobicContact CG-CE1 3.82Å; L48-Y296 HydrophobicContact CG-CG 4.19Å; N52-Y296 PolarHBondContact ND2-OH 3.44Å; N52-Y296 PolarHBondContact OD1-OH 3.26Å; D63-Y296 VanDerWaalsContact OD1-CE2 3.27Å; D63-Y296 WeakPolarHBondContact OD1-CE2 3.23Å; D63-Y296 PolarHBondContact OD1-OH 3.21Å; F66-Y296 HydrophobicContact CB-CD2 3.53Å; F66-Y296 HydrophobicContact CB-CE2 4.01Å; F66-Y296 HydrophobicContact CB-CG 4.12Å; F66-Y296 VanDerWaalsContact CD1-CB 3.44Å; F66-Y296 AromaticContact CD1-CD2 3.81Å; F66-Y296 HydrophobicContact CD1-CD2 3.81Å; F66-Y296 AromaticContact CD1-CG 3.97Å; F66-Y296 HydrophobicContact CD1-CG 3.97Å; F66-Y296 AromaticContact CD2-CD2 3.9Å; F66-Y296 HydrophobicContact CD2-CD2 3.9Å; F66-Y296 HydrophobicContact CE1-CD2 4.45Å; F66-Y296 AromaticContact CG-CD2 3.44Å; F66-Y296 HydrophobicContact CG-CD2 3.44Å; F66-Y296 VanDerWaalsContact CG-CD2 3.44Å; F66-Y296 HydrophobicContact CG-CE2 4.28Å; F66-Y296 HydrophobicContact CG-CG 4.05Å; T292-Y296 PolarHBondContact O-N 2.93Å; P293-Y296 PolarHBondContact O-N 3.4Å; L294-Y296 VanDerWaalsContact C-N 3.32Å; L294-Y296 PolarHBondContact O-N 3.44Å; Y296-Y298 VanDerWaalsContact C-N 3.29Å; Y296-Y298 PolarHBondContact O-N 3.36Å; Y296-M299 HydrophobicContact CD2-CE 4.34Å; Y296-M299 PolarHBondContact O-N 3.45Å; Y296-N300 HydrophobicContact CD2-CB 4.24Å; Y296-N300 HydrophobicContact CE2-CB 3.67Å; Y296-N300 PolarHBondContact O-N 2.87Å; Y296-N300 PolarHBondContact OH-ND2 3.45Å; Y296-N300 VanDerWaalsContact OH-ND2 3.15Å; Y296-F303 HydrophobicContact CD1-CB 4.46Å; Y296-F303 HydrophobicContact CD1-CD1 4.26Å; Y296-F303 AromaticContact CD1-CD2 3.94Å; Y296-F303 HydrophobicContact CD1-CD2 3.94Å; Y296-F303 HydrophobicContact CD1-CE1 4.48Å; Y296-F303 HydrophobicContact CD1-CE2 4.14Å; Y296-F303 AromaticContact CD1-CG 3.97Å; Y296-F303 HydrophobicContact CD1-CG 3.97Å; Y296-F303 HydrophobicContact CD1-CZ 4.4Å; Y296-F303 HydrophobicContact CE1-CB 3.96Å; Y296-F303 HydrophobicContact CE1-CD1 4.34Å; Y296-F303 AromaticContact CE1-CD2 3.27Å; Y296-F303 HydrophobicContact CE1-CD2 3.27Å; Y296-F303 AromaticContact CE1-CE2 3.71Å; Y296-F303 HydrophobicContact CE1-CE2 3.71Å; Y296-F303 AromaticContact CE1-CG 3.6Å; Y296-F303 HydrophobicContact CE1-CG 3.6Å; Y296-F303 HydrophobicContact CE1-CZ 4.4Å |
| 297 | R | 87.4 | Confident | 84.9 | Confident | 145 Ų | 145 | 44.8 Ų | 44.8 | 55% | 0.547 | 22% | 0.224 | S | C | . | . | H | α-helix | trans | -59.4 | -41 | 179.3 | 175.2 | -179.8 | 172 | 173.7 | -2.2 | 111.8 | P293 L294 L295 M299 F303 | P293-R297 WeakPolarHBondContact O-CB 3.28Å; P293-R297 PolarHBondContact O-N 3.38Å; L294-R297 PolarHBondContact O-N 3.37Å; L295-R297 PolarHBondContact O-N 3.08Å; R297-M299 VanDerWaalsContact C-N 3.27Å; R297-F303 HydrophobicContact CB-CD1 4.26Å; R297-F303 HydrophobicContact CG-CD1 4.48Å |
| 298 | Y | 83.6 | Confident | 84.6 | Confident | 152 Ų | 152 | 51.3 Ų | 51.3 | 60% | 0.596 | 25% | 0.246 | S | C | * | . | H | α-helix | trans | -70.3 | -28.3 | 176.7 | -71.5 | -64.4 | 0 | 0 | 0 | 111.9 | L234 L294 L295 Y296 | L234-Y298 VanDerWaalsContact CD2-CB 3.43Å; L234-Y298 WeakPolarHBondContact CD2-O 3.3Å; L294-Y298 HydrophobicContact CD1-CD2 4.31Å; L294-Y298 HydrophobicContact CD1-CE2 3.59Å; L294-Y298 HydrophobicContact CD2-CE2 4.48Å; L294-Y298 HydrophobicContact CG-CD2 4.2Å; L294-Y298 HydrophobicContact CG-CE2 3.75Å; L294-Y298 WeakPolarHBondContact O-CD2 3.13Å; L294-Y298 PolarHBondContact O-N 3.22Å; L295-Y298 PolarHBondContact O-N 2.88Å; Y296-Y298 VanDerWaalsContact C-N 3.29Å; Y296-Y298 PolarHBondContact O-N 3.36Å |
| 299 | M | 81.3 | Confident | 84.1 | Confident | 40 Ų | 40 | 56.7 Ų | 56.7 | 20% | 0.197 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -88 | -39.3 | -170.8 | -163.9 | -170.3 | 66.5 | 0 | 0 | 111.9 | P62 F66 L234 L295 Y296 R297 | P62-M299 HydrophobicContact CB-CE 3.55Å; F66-M299 HydrophobicContact CD2-CE 3.3Å; F66-M299 HydrophobicContact CD2-SD 4.34Å; F66-M299 HydrophobicContact CE2-CE 2.96Å; F66-M299 HydrophobicContact CE2-SD 3.42Å; F66-M299 WeakPolarHBondContact CE2-SD 3.39Å; F66-M299 HydrophobicContact CG-CE 4.37Å; F66-M299 HydrophobicContact CZ-CE 3.79Å; F66-M299 HydrophobicContact CZ-SD 3.9Å; L234-M299 HydrophobicContact CD2-CB 3.48Å; L234-M299 VanDerWaalsContact CD2-CB 3.48Å; L234-M299 HydrophobicContact CD2-CG 4.03Å; L234-M299 HydrophobicContact CG-CB 3.96Å; L234-M299 HydrophobicContact CG-CG 4.21Å; L295-M299 WeakPolarHBondContact O-CB 3.34Å; L295-M299 PolarHBondContact O-N 3.05Å; L295-M299 VanDerWaalsContact O-N 3.09Å; Y296-M299 HydrophobicContact CD2-CE 4.34Å; Y296-M299 PolarHBondContact O-N 3.45Å; R297-M299 VanDerWaalsContact C-N 3.27Å |
| 300 | N | 80.1 | Confident | 83.8 | Confident | 19 Ų | 19 | 57.6 Ų | 57.6 | 10% | 0.102 | 27% | 0.27 | C | S | . | . | trans | -105.4 | 95 | 175.9 | -166.4 | -12.1 | 0 | 0 | 0 | 110.8 | D63 Y296 S302 F303 K306 | D63-N300 PolarHBondContact OD1-ND2 2.9Å; Y296-N300 HydrophobicContact CD2-CB 4.24Å; Y296-N300 HydrophobicContact CE2-CB 3.67Å; Y296-N300 PolarHBondContact O-N 2.87Å; Y296-N300 PolarHBondContact OH-ND2 3.45Å; Y296-N300 VanDerWaalsContact OH-ND2 3.15Å; N300-S302 PolarHBondContact ND2-OG 2.99Å; N300-S302 PolarHBondContact O-N 3.18Å; N300-S302 VanDerWaalsContact O-N 3.1Å; N300-S302 WeakPolarHBondContact OD1-CA 3.24Å; N300-S302 WeakPolarHBondContact OD1-CB 3.19Å; N300-S302 PolarHBondContact OD1-N 3.13Å; N300-S302 PolarHBondContact OD1-OG 2.86Å; N300-F303 HydrophobicContact CB-CB 4.29Å; N300-F303 WeakPolarHBondContact O-CB 3.27Å; N300-F303 PolarHBondContact O-N 2.87Å; N300-K306 PolarHBondContact ND2-NZ 3.1Å | ||
| 301 | Q | 75.6 | Confident | 83.5 | Confident | 160 Ų | 160 | 60.2 Ų | 60.2 | 75% | 0.748 | 29% | 0.285 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -60.7 | -19.7 | 174.9 | -62.3 | -173.8 | 8.4 | 0 | 0 | 113.2 | F303 P304 | Q301-F303 VanDerWaalsContact C-N 3.33Å; Q301-P304 WeakPolarHBondContact O-CD 3.24Å |
| 302 | S | 74.4 | Confident | 83 | Confident | 56 Ų | 56 | 67 Ų | 67 | 39% | 0.392 | 31% | 0.312 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -82 | -9.8 | 176.1 | 80.7 | 0 | 0 | 0 | 0 | 113.7 | N300 G305 K306 | N300-S302 PolarHBondContact ND2-OG 2.99Å; N300-S302 PolarHBondContact O-N 3.18Å; N300-S302 VanDerWaalsContact O-N 3.1Å; N300-S302 WeakPolarHBondContact OD1-CA 3.24Å; N300-S302 WeakPolarHBondContact OD1-CB 3.19Å; N300-S302 PolarHBondContact OD1-N 3.13Å; N300-S302 PolarHBondContact OD1-OG 2.86Å; S302-G305 WeakPolarHBondContact O-CA 3.27Å; S302-G305 PolarHBondContact O-N 3.04Å; S302-K306 PolarHBondContact O-N 3.36Å; S302-K306 VanDerWaalsContact O-N 3.08Å |
| 303 | F | 78 | Confident | 82.2 | Confident | 14 Ų | 14 | 73.9 Ų | 73.9 | 6% | 0.061 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -57.3 | -45.8 | -177.4 | 174.7 | -120.9 | 0 | 0 | 0 | 113.8 | A51 Y296 R297 N300 Q301 G305 K306 L307 | A51-F303 HydrophobicContact CB-CE2 3.96Å; Y296-F303 HydrophobicContact CD1-CB 4.46Å; Y296-F303 HydrophobicContact CD1-CD1 4.26Å; Y296-F303 AromaticContact CD1-CD2 3.94Å; Y296-F303 HydrophobicContact CD1-CD2 3.94Å; Y296-F303 HydrophobicContact CD1-CE1 4.48Å; Y296-F303 HydrophobicContact CD1-CE2 4.14Å; Y296-F303 AromaticContact CD1-CG 3.97Å; Y296-F303 HydrophobicContact CD1-CG 3.97Å; Y296-F303 HydrophobicContact CD1-CZ 4.4Å; Y296-F303 HydrophobicContact CE1-CB 3.96Å; Y296-F303 HydrophobicContact CE1-CD1 4.34Å; Y296-F303 AromaticContact CE1-CD2 3.27Å; Y296-F303 HydrophobicContact CE1-CD2 3.27Å; Y296-F303 AromaticContact CE1-CE2 3.71Å; Y296-F303 HydrophobicContact CE1-CE2 3.71Å; Y296-F303 AromaticContact CE1-CG 3.6Å; Y296-F303 HydrophobicContact CE1-CG 3.6Å; Y296-F303 HydrophobicContact CE1-CZ 4.4Å; R297-F303 HydrophobicContact CB-CD1 4.26Å; R297-F303 HydrophobicContact CG-CD1 4.48Å; N300-F303 HydrophobicContact CB-CB 4.29Å; N300-F303 WeakPolarHBondContact O-CB 3.27Å; N300-F303 PolarHBondContact O-N 2.87Å; Q301-F303 VanDerWaalsContact C-N 3.33Å; F303-G305 PolarHBondContact O-N 3.41Å; F303-K306 WeakPolarHBondContact O-CB 3.45Å; F303-K306 PolarHBondContact O-N 3.4Å; F303-L307 PolarHBondContact O-N 3.18Å |
| 304 | P | 80.9 | Confident | 81.6 | Confident | 60 Ų | 60 | 79.1 Ų | 79.1 | 39% | 0.39 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -58.8 | -31 | 175.8 | -24 | 35 | 0 | 0 | 0 | 113 | Q301 R308 | Q301-P304 WeakPolarHBondContact O-CD 3.24Å; P304-R308 WeakPolarHBondContact O-CB 3.48Å; P304-R308 PolarHBondContact O-N 3.1Å |
| 305 | G | 79 | Confident | 80.3 | Confident | 23 Ų | 23 | 80.8 Ų | 80.8 | 24% | 0.237 | 39% | 0.385 | C | S | . | . | H | α-helix | trans | -69.2 | -44.1 | 173.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | S302 F303 R308 R309 | S302-G305 WeakPolarHBondContact O-CA 3.27Å; S302-G305 PolarHBondContact O-N 3.04Å; F303-G305 PolarHBondContact O-N 3.41Å; G305-R308 PolarHBondContact O-N 3.11Å; G305-R309 WeakPolarHBondContact O-CG 3.36Å; G305-R309 PolarHBondContact O-N 2.99Å; G305-R309 VanDerWaalsContact O-N 3.1Å |
| 306 | K | 81.6 | Confident | 78.7 | Confident | 1 Ų | 1 | 85.7 Ų | 85.7 | 0% | 0.004 | 42% | 0.419 | C | S | . | . | H | α-helix | trans | -60.5 | -44.2 | 173.7 | -67.5 | 176.1 | 179 | 178.3 | 0 | 111.3 | A51 N52 D63 N300 S302 F303 R309 L310 | A51-K306 HydrophobicContact CB-CB 4.29Å; N52-K306 PolarHBondContact OD1-NZ 3.24Å; D63-K306 IonicContact OD1-NZ 3.54Å; D63-K306 IonicContact OD2-NZ 2.66Å; D63-K306 PolarHBondContact OD2-NZ 3.27Å; N300-K306 PolarHBondContact ND2-NZ 3.1Å; S302-K306 PolarHBondContact O-N 3.36Å; S302-K306 VanDerWaalsContact O-N 3.08Å; F303-K306 WeakPolarHBondContact O-CB 3.45Å; F303-K306 PolarHBondContact O-N 3.4Å; K306-R309 VanDerWaalsContact CG-NH2 3.28Å; K306-R309 PolarHBondContact O-N 3.01Å; K306-L310 PolarHBondContact O-N 3.42Å; K306-L310 VanDerWaalsContact O-N 3.11Å |
| 307 | L | 81.2 | Confident | 76.9 | Confident | 39 Ų | 39 | 89.2 Ų | 89.2 | 20% | 0.204 | 46% | 0.455 | C | S | . | . | H | α-helix | trans | -63.8 | -43.5 | 177.9 | -177 | 60.8 | 0 | 0 | 0 | 112 | L47 F303 R309 L310 M311 | L47-L307 HydrophobicContact CB-CD1 4.33Å; L47-L307 HydrophobicContact CD2-CD1 3.81Å; L47-L307 HydrophobicContact CG-CD1 4.46Å; F303-L307 PolarHBondContact O-N 3.18Å; L307-R309 VanDerWaalsContact C-N 3.29Å; L307-R309 PolarHBondContact O-N 3.1Å; L307-L310 HydrophobicContact CD1-CD2 4.35Å; L307-L310 WeakPolarHBondContact O-CB 3.36Å; L307-L310 PolarHBondContact O-N 2.9Å; L307-L310 VanDerWaalsContact O-N 3.1Å; L307-M311 HydrophobicContact CG-SD 4.4Å; L307-M311 WeakPolarHBondContact O-CG 3.23Å; L307-M311 PolarHBondContact O-N 3.36Å |
| 308 | R | 83.3 | Confident | 75.3 | Confident | 157 Ų | 157 | 89.5 Ų | 89.5 | 59% | 0.592 | 47% | 0.468 | S | S | * | . | H | α-helix | trans | -60.8 | -38.6 | 176.1 | -164.7 | -173.7 | -40.8 | -173.3 | 6.8 | 112.3 | P304 G305 L310 M311 K312 | P304-R308 WeakPolarHBondContact O-CB 3.48Å; P304-R308 PolarHBondContact O-N 3.1Å; G305-R308 PolarHBondContact O-N 3.11Å; R308-L310 VanDerWaalsContact C-N 3.33Å; R308-M311 PolarHBondContact O-N 3.12Å; R308-K312 WeakPolarHBondContact O-CB 3.35Å; R308-K312 WeakPolarHBondContact O-CG 3.49Å; R308-K312 PolarHBondContact O-N 3.29Å |
| 309 | R | 83 | Confident | 73.4 | Confident | 117 Ų | 117 | 93.7 Ų | 93.7 | 44% | 0.442 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -64.7 | -36.7 | 174.7 | -74.6 | -171.6 | -69.4 | -97.9 | 3.6 | 112.3 | G305 K306 L307 | G305-R309 WeakPolarHBondContact O-CG 3.36Å; G305-R309 PolarHBondContact O-N 2.99Å; G305-R309 VanDerWaalsContact O-N 3.1Å; K306-R309 VanDerWaalsContact CG-NH2 3.28Å; K306-R309 PolarHBondContact O-N 3.01Å; L307-R309 VanDerWaalsContact C-N 3.29Å; L307-R309 PolarHBondContact O-N 3.1Å |
| 310 | L | 84.6 | Confident | 71.4 | Confident | 21 Ų | 21 | 100 Ų | 100 | 11% | 0.11 | 51% | 0.511 | C | S | . | . | H | α-helix | trans | -65.5 | -50.2 | 173.2 | 177.7 | 68 | 0 | 0 | 0 | 110.7 | L47 L50 A51 H54 K306 L307 R308 K312 K313 L314 | L47-L310 HydrophobicContact CD2-CD2 4.47Å; L50-L310 HydrophobicContact CB-CD1 4.49Å; L50-L310 HydrophobicContact CB-CD2 3.74Å; A51-L310 HydrophobicContact CB-CD2 4.34Å; H54-L310 HydrophobicContact CB-CD1 4.22Å; K306-L310 PolarHBondContact O-N 3.42Å; K306-L310 VanDerWaalsContact O-N 3.11Å; L307-L310 HydrophobicContact CD1-CD2 4.35Å; L307-L310 WeakPolarHBondContact O-CB 3.36Å; L307-L310 PolarHBondContact O-N 2.9Å; L307-L310 VanDerWaalsContact O-N 3.1Å; R308-L310 VanDerWaalsContact C-N 3.33Å; L310-K312 VanDerWaalsContact C-N 3.33Å; L310-K312 PolarHBondContact O-N 3.46Å; L310-K313 PolarHBondContact O-N 3.07Å; L310-K313 VanDerWaalsContact O-N 3.07Å; L310-L314 PolarHBondContact O-N 3.07Å |
| 311 | M | 83.3 | Confident | 69.9 | Low | 125 Ų | 125 | 105 Ų | 105 | 62% | 0.616 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -60.7 | -38.6 | -179.1 | -69.9 | 179.4 | 74.6 | 0 | 0 | 113.2 | L307 R308 K313 L314 | L307-M311 HydrophobicContact CG-SD 4.4Å; L307-M311 WeakPolarHBondContact O-CG 3.23Å; L307-M311 PolarHBondContact O-N 3.36Å; R308-M311 PolarHBondContact O-N 3.12Å; M311-K313 PolarHBondContact O-N 3.23Å; M311-L314 PolarHBondContact O-N 3.35Å |
| 312 | K | 82.1 | Confident | 68 | Low | 169 Ų | 169 | 102.6 Ų | 102.6 | 74% | 0.735 | 55% | 0.547 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -64.1 | -19.8 | 176.9 | -78.5 | -178.5 | 174.2 | -166.6 | 0 | 114.2 | R308 L310 | R308-K312 WeakPolarHBondContact O-CB 3.35Å; R308-K312 WeakPolarHBondContact O-CG 3.49Å; R308-K312 PolarHBondContact O-N 3.29Å; L310-K312 VanDerWaalsContact C-N 3.33Å; L310-K312 PolarHBondContact O-N 3.46Å |
| 313 | K | 74 | Confident | 66.5 | Low | 147 Ų | 147 | 105.1 Ų | 105.1 | 64% | 0.639 | 56% | 0.562 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -108.4 | -13.4 | -177.2 | -82.2 | -172.1 | 179.2 | -170 | 0 | 113.8 | H54 L310 M311 P315 | H54-K313 WeakPolarHBondContact NE2-CD 3.07Å; H54-K313 PolarHBondContact NE2-NZ 2.88Å; H54-K313 VanDerWaalsContact NE2-NZ 3.12Å; L310-K313 PolarHBondContact O-N 3.07Å; L310-K313 VanDerWaalsContact O-N 3.07Å; M311-K313 PolarHBondContact O-N 3.23Å; K313-P315 WeakPolarHBondContact O-CD 3.33Å; K313-P315 VanDerWaalsContact O-N 3.16Å |
| 314 | L | 75.8 | Confident | 64.7 | Low | 115 Ų | 115 | 112.2 Ų | 112.2 | 60% | 0.602 | 60% | 0.601 | S | S | * | * | S | Bend | trans | -59.8 | 120.1 | 162.2 | -122.3 | 71.5 | 0 | 0 | 0 | 105.2 | L310 M311 C316 | L310-L314 PolarHBondContact O-N 3.07Å; M311-L314 PolarHBondContact O-N 3.35Å; L314-C316 VanDerWaalsContact C-N 3.31Å; L314-C316 PolarHBondContact O-N 2.78Å |
| 315 | P | 61.8 | Low | 62.7 | Low | 122 Ų | 122 | 118 Ų | 118 | 79% | 0.792 | 62% | 0.622 | S | S | * | * | trans | -58.9 | 104.9 | 175.5 | 23 | -29.8 | 0 | 0 | 0 | 106 | K313 G317 | K313-P315 WeakPolarHBondContact O-CD 3.33Å; K313-P315 VanDerWaalsContact O-N 3.16Å; P315-G317 VanDerWaalsContact C-N 3.33Å; P315-G317 PolarHBondContact O-N 2.93Å | ||
| 316 | C | 53.4 | Low | 61 | Low | 117 Ų | 117 | 124.1 Ų | 124.1 | 79% | 0.791 | 65% | 0.648 | S | S | * | * | trans | -57.7 | 108.7 | 163.2 | -72.2 | 0 | 0 | 0 | 0 | 104.4 | L314 D318 | L314-C316 VanDerWaalsContact C-N 3.31Å; L314-C316 PolarHBondContact O-N 2.78Å; C316-D318 PolarHBondContact O-N 3.15Å; C316-D318 VanDerWaalsContact O-N 3.15Å | ||
| 317 | G | 51.1 | Low | 58.8 | Low | 74 Ų | 74 | 135.6 Ų | 135.6 | 76% | 0.763 | 69% | 0.691 | S | S | * | * | trans | -49.1 | 124.5 | 167.4 | 0 | 0 | 0 | 0 | 0 | 107.9 | P315 | P315-G317 VanDerWaalsContact C-N 3.33Å; P315-G317 PolarHBondContact O-N 2.93Å | ||
| 318 | D | 54.4 | Low | 56.9 | Low | 152 Ų | 152 | 139.4 Ų | 139.4 | 81% | 0.813 | 72% | 0.716 | S | S | * | * | trans | 5.3 | 120.6 | -178.2 | -83.2 | -41.3 | 0 | 0 | 0 | 118.5 | C316 | C316-D318 PolarHBondContact O-N 3.15Å; C316-D318 VanDerWaalsContact O-N 3.15Å | ||
| 319 | R | 43.2 | Very low | 54.8 | Low | 239 Ų | 239 | 140.5 Ų | 140.5 | 90% | 0.902 | 73% | 0.728 | S | S | * | * | trans | -155.2 | 98.1 | 133.2 | -111.7 | 164 | 176.8 | -161.8 | -3.5 | 112.7 | ||||
| 320 | H | 39.1 | Very low | 52.7 | Low | 172 Ų | 172 | 143.6 Ų | 143.6 | 80% | 0.796 | 75% | 0.747 | S | S | * | * | trans | 66.3 | 102.1 | 146.1 | -80.3 | 56.4 | 0 | 0 | 0 | 118.4 | S322 | H320-S322 PolarHBondContact O-N 3.42Š| ||
| 321 | C | 47.7 | Very low | 50.6 | Low | 126 Ų | 126 | 148.5 Ų | 148.5 | 85% | 0.851 | 78% | 0.778 | S | S | * | * | P | Polyproline II helix | trans | -47.5 | 126.8 | 139.5 | -62.1 | 0 | 0 | 0 | 0 | 109.5 | ||
| 322 | S | 35.9 | Very low | 48.5 | Very low | 108 Ų | 108 | 151.1 Ų | 151.1 | 76% | 0.755 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -99.8 | 127.5 | 152.7 | -152.2 | 0 | 0 | 0 | 0 | 106.4 | H320 D324 | H320-S322 PolarHBondContact O-N 3.42Å; S322-D324 PolarHBondContact O-N 3.29Å |
| 323 | P | 44 | Very low | 46.4 | Very low | 109 Ų | 109 | 150.9 Ų | 150.9 | 71% | 0.708 | 82% | 0.823 | S | S | * | * | P | Polyproline II helix | trans | -70.5 | 118.7 | 172.4 | 28.8 | -28.2 | 0 | 0 | 0 | 107.2 | H325 | P323-H325 PolarHBondContact O-N 3.18Š|
| 324 | D | 38.9 | Very low | 45 | Very low | 164 Ų | 164 | 151.1 Ų | 151.1 | 88% | 0.877 | 83% | 0.832 | S | S | * | * | P | Polyproline II helix | trans | -55.6 | 118.2 | 171.6 | -92.1 | -35.1 | 0 | 0 | 0 | 108.9 | S322 I326 | S322-D324 PolarHBondContact O-N 3.29Å; D324-I326 PolarHBondContact O-N 3.06Å |
| 325 | H | 39.3 | Very low | 43.4 | Very low | 181 Ų | 181 | 153 Ų | 153 | 84% | 0.838 | 84% | 0.844 | S | S | * | * | P | Polyproline II helix | trans | -58 | 118.8 | 170.6 | -96.2 | -82.1 | 0 | 0 | 0 | 109 | P323 R327 | P323-H325 PolarHBondContact O-N 3.18Å; H325-R327 PolarHBondContact O-N 2.95Å |
| 326 | I | 44.1 | Very low | 42.4 | Very low | 151 Ų | 151 | 154.7 Ų | 154.7 | 77% | 0.774 | 85% | 0.847 | S | S | * | * | trans | -47.9 | 105.8 | 161.9 | -63.6 | 173.2 | 0 | 0 | 0 | 108.1 | D324 V328 | D324-I326 PolarHBondContact O-N 3.06Å; I326-V328 HydrophobicContact CG2-CG2 3.98Å; I326-V328 PolarHBondContact O-N 3.17Å | ||
| 327 | R | 35.4 | Very low | 41.7 | Very low | 242 Ų | 242 | 156.9 Ų | 156.9 | 91% | 0.913 | 85% | 0.851 | S | S | * | * | trans | -87.6 | 96 | 163.5 | -129.2 | -171.8 | -137.7 | -154.1 | 5.7 | 107.1 | H325 Q329 | H325-R327 PolarHBondContact O-N 2.95Å; R327-Q329 PolarHBondContact O-N 3.39Å; R327-Q329 VanDerWaalsContact O-N 3.17Å | ||
| 328 | V | 41.6 | Very low | 41.1 | Very low | 119 Ų | 119 | 162.1 Ų | 162.1 | 72% | 0.721 | 86% | 0.856 | S | S | * | * | trans | -54.4 | 115.5 | 165.6 | 174.6 | 0 | 0 | 0 | 0 | 107.8 | I326 Q330 | I326-V328 HydrophobicContact CG2-CG2 3.98Å; I326-V328 PolarHBondContact O-N 3.17Å; V328-Q330 PolarHBondContact O-N 3.21Å | ||
| 329 | Q | 37.5 | Very low | 40.3 | Very low | 181 Ų | 181 | 162.8 Ų | 162.8 | 85% | 0.846 | 86% | 0.859 | S | S | * | * | trans | -76.9 | 105.8 | 171.5 | -166.5 | 152.2 | -22.7 | 0 | 0 | 107.4 | R327 V331 | R327-Q329 PolarHBondContact O-N 3.39Å; R327-Q329 VanDerWaalsContact O-N 3.17Å; Q329-V331 PolarHBondContact O-N 3.29Å | ||
| 330 | Q | 40 | Very low | 40.1 | Very low | 181 Ų | 181 | 157.4 Ų | 157.4 | 85% | 0.846 | 86% | 0.856 | S | S | * | * | trans | -62.4 | 115.7 | 166.3 | -93.6 | 177 | -33.9 | 0 | 0 | 108.5 | V328 | V328-Q330 PolarHBondContact O-N 3.21Š| ||
| 331 | V | 39.8 | Very low | 40.1 | Very low | 125 Ų | 125 | 156.2 Ų | 156.2 | 76% | 0.758 | 86% | 0.86 | S | S | * | * | trans | -69.1 | 122.7 | 166 | 174.2 | 0 | 0 | 0 | 0 | 107.7 | Q329 | Q329-V331 PolarHBondContact O-N 3.29Š| ||
| 332 | L | 40.1 | Very low | 39.5 | Very low | 180 Ų | 180 | 158.8 Ų | 158.8 | 94% | 0.942 | 86% | 0.861 | S | S | * | * | trans | -127.2 | 93.4 | 157 | -150.4 | 106.9 | 0 | 0 | 0 | 107.5 | ||||
| 333 | A | 37.5 | Very low | 39.8 | Very low | 164 Ų | 164 | 163.4 Ų | 163.4 | 100% | 1.355 | 87% | 0.871 | S | S | * | * | trans | -159.1 | 0 | 155.4 | 0 | 0 | 0 | 0 | 0 | 107 |
Retrieved 333 of 333 residues in 335.1 ms
(Link to these results)