| 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 | 64.9 | Low | 88.2 | Confident | 82 Ų | 82 | 97 Ų | 97 | 40% | 0.404 | 49% | 0.489 | S | S | . | . | 0 | 168.3 | 0 | -77.4 | 175.4 | 154.7 | 0 | 0 | 109.1 | L9 L818 F821 | M1-L9 HydrophobicContact CE-CD1 4.16Å; M1-L818 HydrophobicContact CE-CD2 4.09Å; M1-F821 HydrophobicContact CE-CE2 4.18Å; M1-F821 HydrophobicContact CE-CZ 4.42Å; M1-F821 HydrophobicContact SD-CZ 4.4Å | |||
| 2 | S | 88.1 | Confident | 88.7 | Confident | 51 Ų | 51 | 100.6 Ų | 100.6 | 36% | 0.357 | 50% | 0.499 | S | S | . | . | trans | -77.6 | 148.8 | 162.1 | 50.4 | 0 | 0 | 0 | 0 | 110.1 | N4 R5 W6 | S2-N4 VanDerWaalsContact C-N 3.3Å; S2-N4 PolarHBondContact O-N 2.87Å; S2-R5 PolarHBondContact O-N 3.44Å; S2-R5 WeakPolarHBondContact OG-CG 3.12Å; S2-W6 PolarHBondContact O-N 2.79Å | ||
| 3 | P | 90.1 | Very high | 89.2 | Confident | 92 Ų | 92 | 102.6 Ų | 102.6 | 60% | 0.597 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -52.9 | -46 | -178.1 | -28.8 | 36 | 0 | 0 | 0 | 112.9 | R5 W6 I7 | P3-R5 PolarHBondContact O-N 2.86Å; P3-W6 WeakPolarHBondContact O-CB 3.32Å; P3-W6 PolarHBondContact O-N 3.22Å; P3-I7 WeakPolarHBondContact O-CG1 3.35Å; P3-I7 PolarHBondContact O-N 3.39Å |
| 4 | N | 88.4 | Confident | 89.7 | Confident | 120 Ų | 120 | 101.4 Ų | 101.4 | 64% | 0.642 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -59.4 | -33.1 | -179.5 | -52.8 | 23 | 0 | 0 | 0 | 112.7 | S2 L8 | S2-N4 VanDerWaalsContact C-N 3.3Å; S2-N4 PolarHBondContact O-N 2.87Å; N4-L8 WeakPolarHBondContact O-CB 3.49Å; N4-L8 WeakPolarHBondContact O-CD1 3.41Å; N4-L8 VanDerWaalsContact O-CG 3.24Å; N4-L8 WeakPolarHBondContact O-CG 3.34Å; N4-L8 PolarHBondContact O-N 2.71Å |
| 5 | R | 83.4 | Confident | 90.2 | Very high | 116 Ų | 116 | 98.7 Ų | 98.7 | 44% | 0.438 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -73.1 | -37.4 | 175.5 | -79.3 | 179.7 | 169.5 | 136.8 | -6.5 | 112.1 | S2 P3 L9 | S2-R5 PolarHBondContact O-N 3.44Å; S2-R5 WeakPolarHBondContact OG-CG 3.12Å; P3-R5 PolarHBondContact O-N 2.86Å; R5-L9 WeakPolarHBondContact O-CB 3.21Å; R5-L9 PolarHBondContact O-N 3Å |
| 6 | W | 91.4 | Very high | 90.5 | Very high | 148 Ų | 148 | 102.1 Ų | 102.1 | 56% | 0.561 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -67.8 | -42.7 | 175 | -178.9 | 83.2 | 0 | 0 | 0 | 111.3 | S2 P3 L8 L9 L10 | S2-W6 PolarHBondContact O-N 2.79Å; P3-W6 WeakPolarHBondContact O-CB 3.32Å; P3-W6 PolarHBondContact O-N 3.22Å; W6-L8 PolarHBondContact O-N 3.23Å; W6-L9 PolarHBondContact O-N 3.12Å; W6-L10 HydrophobicContact CH2-CD2 3.79Å; W6-L10 HydrophobicContact CZ2-CD2 4.39Å; W6-L10 HydrophobicContact CZ3-CD2 3.93Å; W6-L10 WeakPolarHBondContact O-CB 3.37Å; W6-L10 PolarHBondContact O-N 2.87Å |
| 7 | I | 93.9 | Very high | 90.9 | Very high | 81 Ų | 81 | 101.2 Ų | 101.2 | 42% | 0.415 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -60.8 | -44.7 | 174.6 | -65.7 | 167.1 | 0 | 0 | 0 | 111.1 | P3 L9 L10 I11 | P3-I7 WeakPolarHBondContact O-CG1 3.35Å; P3-I7 PolarHBondContact O-N 3.39Å; I7-L9 PolarHBondContact O-N 3.01Å; I7-L10 PolarHBondContact O-N 2.96Å; I7-I11 HydrophobicContact CG2-CD1 3.81Å; I7-I11 HydrophobicContact CG2-CG1 4.44Å; I7-I11 VanDerWaalsContact O-CG1 3.3Å; I7-I11 WeakPolarHBondContact O-CG1 3.47Å; I7-I11 PolarHBondContact O-N 3.21Å |
| 8 | L | 91.6 | Very high | 91.2 | Very high | 119 Ų | 119 | 102.7 Ų | 102.7 | 62% | 0.623 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -63.6 | -38.8 | 176.3 | -75.5 | 168.3 | 0 | 0 | 0 | 112.7 | N4 W6 F12 | N4-L8 WeakPolarHBondContact O-CB 3.49Å; N4-L8 WeakPolarHBondContact O-CD1 3.41Å; N4-L8 VanDerWaalsContact O-CG 3.24Å; N4-L8 WeakPolarHBondContact O-CG 3.34Å; N4-L8 PolarHBondContact O-N 2.71Å; W6-L8 PolarHBondContact O-N 3.23Å; L8-F12 WeakPolarHBondContact O-CB 3.25Å; L8-F12 PolarHBondContact O-N 3.38Å |
| 9 | L | 90 | Very high | 91.5 | Very high | 95 Ų | 95 | 104.4 Ų | 104.4 | 50% | 0.497 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -67.1 | -39.3 | 175 | -172.5 | 152.9 | 0 | 0 | 0 | 111.6 | M1 R5 W6 I7 F12 Y13 | M1-L9 HydrophobicContact CE-CD1 4.16Å; R5-L9 WeakPolarHBondContact O-CB 3.21Å; R5-L9 PolarHBondContact O-N 3Å; W6-L9 PolarHBondContact O-N 3.12Å; I7-L9 PolarHBondContact O-N 3.01Å; L9-F12 PolarHBondContact O-N 3.2Å; L9-Y13 WeakPolarHBondContact O-CB 3.47Å; L9-Y13 PolarHBondContact O-N 2.97Å |
| 10 | L | 93.2 | Very high | 91.7 | Very high | 64 Ų | 64 | 100.3 Ų | 100.3 | 34% | 0.335 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -64.3 | -45.2 | 174.9 | -179.5 | 64.8 | 0 | 0 | 0 | 111.7 | W6 I7 F12 Y13 I14 | W6-L10 HydrophobicContact CH2-CD2 3.79Å; W6-L10 HydrophobicContact CZ2-CD2 4.39Å; W6-L10 HydrophobicContact CZ3-CD2 3.93Å; W6-L10 WeakPolarHBondContact O-CB 3.37Å; W6-L10 PolarHBondContact O-N 2.87Å; I7-L10 PolarHBondContact O-N 2.96Å; L10-F12 VanDerWaalsContact C-N 3.33Å; L10-F12 PolarHBondContact O-N 3.1Å; L10-Y13 PolarHBondContact O-N 2.93Å; L10-I14 HydrophobicContact CD1-CD1 4.11Å; L10-I14 HydrophobicContact CD1-CG1 4.41Å; L10-I14 HydrophobicContact CG-CD1 3.92Å; L10-I14 VanDerWaalsContact O-CG1 3.3Å; L10-I14 WeakPolarHBondContact O-CG1 3.29Å; L10-I14 PolarHBondContact O-N 2.69Å |
| 11 | I | 95.4 | Very high | 91.9 | Very high | 99 Ų | 99 | 98.2 Ų | 98.2 | 51% | 0.508 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -60.8 | -43.8 | 175.1 | -69.7 | 166 | 0 | 0 | 0 | 110.5 | I7 I14 S15 | I7-I11 HydrophobicContact CG2-CD1 3.81Å; I7-I11 HydrophobicContact CG2-CG1 4.44Å; I7-I11 VanDerWaalsContact O-CG1 3.3Å; I7-I11 WeakPolarHBondContact O-CG1 3.47Å; I7-I11 PolarHBondContact O-N 3.21Å; I11-I14 PolarHBondContact O-N 3Å; I11-S15 WeakPolarHBondContact O-CB 3.35Å; I11-S15 PolarHBondContact O-N 3.43Å; I11-S15 PolarHBondContact O-OG 3.24Å |
| 12 | F | 94.2 | Very high | 93.4 | Very high | 140 Ų | 140 | 96.5 Ų | 96.5 | 61% | 0.614 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -60.2 | -47.3 | 175.1 | 177.1 | -101.8 | 0 | 0 | 0 | 111.7 | L8 L9 L10 I14 S15 Y16 | L8-F12 WeakPolarHBondContact O-CB 3.25Å; L8-F12 PolarHBondContact O-N 3.38Å; L9-F12 PolarHBondContact O-N 3.2Å; L10-F12 VanDerWaalsContact C-N 3.33Å; L10-F12 PolarHBondContact O-N 3.1Å; F12-I14 PolarHBondContact O-N 3.4Å; F12-S15 PolarHBondContact O-N 2.89Å; F12-S15 PolarHBondContact O-OG 3.07Å; F12-Y16 PolarHBondContact O-N 3.37Å |
| 13 | Y | 94.8 | Very high | 93.8 | Very high | 127 Ų | 127 | 97.4 Ų | 97.4 | 50% | 0.498 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -61 | -44.7 | 177 | 178.5 | -112.9 | 0 | 0 | 0 | 112.8 | L9 L10 S15 Y16 L17 | L9-Y13 WeakPolarHBondContact O-CB 3.47Å; L9-Y13 PolarHBondContact O-N 2.97Å; L10-Y13 PolarHBondContact O-N 2.93Å; Y13-S15 VanDerWaalsContact C-N 3.33Å; Y13-S15 PolarHBondContact O-N 3.21Å; Y13-Y16 WeakPolarHBondContact O-CB 3.13Å; Y13-Y16 PolarHBondContact O-N 3.18Å; Y13-L17 HydrophobicContact CD1-CD1 4.2Å; Y13-L17 HydrophobicContact CE1-CD1 3.61Å; Y13-L17 HydrophobicContact CE1-CG 4.25Å; Y13-L17 HydrophobicContact CE2-CD1 4.42Å; Y13-L17 HydrophobicContact CE2-CD2 4.28Å; Y13-L17 HydrophobicContact CE2-CG 4.23Å; Y13-L17 PolarHBondContact O-N 3.25Å |
| 14 | I | 96.7 | Very high | 94 | Very high | 85 Ų | 85 | 100.2 Ų | 100.2 | 44% | 0.436 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -61.1 | -42.1 | 174.6 | -68.1 | 166.2 | 0 | 0 | 0 | 110.7 | L10 I11 F12 Y16 L17 M18 | L10-I14 HydrophobicContact CD1-CD1 4.11Å; L10-I14 HydrophobicContact CD1-CG1 4.41Å; L10-I14 HydrophobicContact CG-CD1 3.92Å; L10-I14 VanDerWaalsContact O-CG1 3.3Å; L10-I14 WeakPolarHBondContact O-CG1 3.29Å; L10-I14 PolarHBondContact O-N 2.69Å; I11-I14 PolarHBondContact O-N 3Å; F12-I14 PolarHBondContact O-N 3.4Å; I14-Y16 VanDerWaalsContact C-N 3.31Å; I14-Y16 PolarHBondContact O-N 3.48Å; I14-L17 PolarHBondContact O-N 2.91Å; I14-M18 HydrophobicContact CG2-CG 4.44Å; I14-M18 WeakPolarHBondContact O-CG 3.45Å; I14-M18 PolarHBondContact O-N 3.3Å |
| 15 | S | 96.2 | Very high | 94.3 | Very high | 62 Ų | 62 | 101.1 Ų | 101.1 | 43% | 0.434 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -65 | -34.1 | 176.8 | 73.6 | 0 | 0 | 0 | 0 | 113 | I11 F12 Y13 F19 | I11-S15 WeakPolarHBondContact O-CB 3.35Å; I11-S15 PolarHBondContact O-N 3.43Å; I11-S15 PolarHBondContact O-OG 3.24Å; F12-S15 PolarHBondContact O-N 2.89Å; F12-S15 PolarHBondContact O-OG 3.07Å; Y13-S15 VanDerWaalsContact C-N 3.33Å; Y13-S15 PolarHBondContact O-N 3.21Å; S15-F19 WeakPolarHBondContact O-CB 3.18Å; S15-F19 PolarHBondContact O-N 3.48Å |
| 16 | Y | 96.3 | Very high | 94.8 | Very high | 153 Ų | 153 | 103 Ų | 103 | 60% | 0.6 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -68.4 | -42.7 | 174.2 | 178.8 | -103.2 | 0 | 0 | 0 | 112 | F12 Y13 I14 F19 G20 | F12-Y16 PolarHBondContact O-N 3.37Å; Y13-Y16 WeakPolarHBondContact O-CB 3.13Å; Y13-Y16 PolarHBondContact O-N 3.18Å; I14-Y16 VanDerWaalsContact C-N 3.31Å; I14-Y16 PolarHBondContact O-N 3.48Å; Y16-F19 PolarHBondContact O-N 3.34Å; Y16-G20 PolarHBondContact O-N 3.43Å |
| 17 | L | 96.6 | Very high | 94.9 | Very high | 87 Ų | 87 | 100.7 Ų | 100.7 | 46% | 0.455 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -62.5 | -43.9 | 173 | -69.3 | -178.2 | 0 | 0 | 0 | 112.1 | Y13 I14 F19 G20 A21 | Y13-L17 HydrophobicContact CD1-CD1 4.2Å; Y13-L17 HydrophobicContact CE1-CD1 3.61Å; Y13-L17 HydrophobicContact CE1-CG 4.25Å; Y13-L17 HydrophobicContact CE2-CD1 4.42Å; Y13-L17 HydrophobicContact CE2-CD2 4.28Å; Y13-L17 HydrophobicContact CE2-CG 4.23Å; Y13-L17 PolarHBondContact O-N 3.25Å; I14-L17 PolarHBondContact O-N 2.91Å; L17-F19 VanDerWaalsContact C-N 3.31Å; L17-F19 PolarHBondContact O-N 2.91Å; L17-G20 PolarHBondContact O-N 3.41Å; L17-A21 WeakPolarHBondContact O-CB 3.48Å; L17-A21 PolarHBondContact O-N 2.93Å |
| 18 | M | 96.5 | Very high | 94.9 | Very high | 128 Ų | 128 | 101.6 Ų | 101.6 | 63% | 0.631 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -62.7 | -37.4 | 176.2 | -73.5 | -61.4 | -58.5 | 0 | 0 | 112.4 | I14 A22 | I14-M18 HydrophobicContact CG2-CG 4.44Å; I14-M18 WeakPolarHBondContact O-CG 3.45Å; I14-M18 PolarHBondContact O-N 3.3Å; M18-A22 WeakPolarHBondContact O-CB 3.47Å; M18-A22 PolarHBondContact O-N 3.32Å |
| 19 | F | 96.6 | Very high | 94.9 | Very high | 134 Ų | 134 | 98.9 Ų | 98.9 | 59% | 0.588 | 48% | 0.484 | S | S | * | . | H | α-helix | trans | -66.9 | -45.4 | 174.9 | 179.4 | -109.3 | 0 | 0 | 0 | 111.9 | S15 Y16 L17 A22 I23 | S15-F19 WeakPolarHBondContact O-CB 3.18Å; S15-F19 PolarHBondContact O-N 3.48Å; Y16-F19 PolarHBondContact O-N 3.34Å; L17-F19 VanDerWaalsContact C-N 3.31Å; L17-F19 PolarHBondContact O-N 2.91Å; F19-A22 PolarHBondContact O-N 3.01Å; F19-I23 HydrophobicContact CD1-CD1 3.98Å; F19-I23 HydrophobicContact CE1-CD1 3.56Å; F19-I23 HydrophobicContact CE2-CD1 4.32Å; F19-I23 HydrophobicContact CZ-CD1 3.75Å; F19-I23 WeakPolarHBondContact O-CG1 3.44Å; F19-I23 PolarHBondContact O-N 3.33Å; F19-I23 VanDerWaalsContact O-N 3.11Å |
| 20 | G | 96.3 | Very high | 94.9 | Very high | 22 Ų | 22 | 96 Ų | 96 | 23% | 0.227 | 48% | 0.477 | C | S | . | . | H | α-helix | trans | -61.1 | -45.4 | 173.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | Y16 L17 A22 I23 Y24 | Y16-G20 PolarHBondContact O-N 3.43Å; L17-G20 PolarHBondContact O-N 3.41Å; G20-A22 VanDerWaalsContact C-N 3.31Å; G20-A22 PolarHBondContact O-N 3.49Å; G20-I23 PolarHBondContact O-N 3.23Å; G20-I23 VanDerWaalsContact O-N 3.14Å; G20-Y24 VanDerWaalsContact O-CD2 3.24Å; G20-Y24 WeakPolarHBondContact O-CD2 3.38Å; G20-Y24 PolarHBondContact O-N 3.5Å |
| 21 | A | 96.3 | Very high | 94.8 | Very high | 57 Ų | 57 | 98.8 Ų | 98.8 | 47% | 0.471 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -60 | -39.6 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | L17 Y25 | L17-A21 WeakPolarHBondContact O-CB 3.48Å; L17-A21 PolarHBondContact O-N 2.93Å; A21-Y25 WeakPolarHBondContact O-CB 3.13Å; A21-Y25 PolarHBondContact O-N 3.3Å |
| 22 | A | 96.3 | Very high | 94.5 | Very high | 46 Ų | 46 | 97.2 Ų | 97.2 | 38% | 0.38 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -64.6 | -39 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | M18 F19 G20 H26 | M18-A22 WeakPolarHBondContact O-CB 3.47Å; M18-A22 PolarHBondContact O-N 3.32Å; F19-A22 PolarHBondContact O-N 3.01Å; G20-A22 VanDerWaalsContact C-N 3.31Å; G20-A22 PolarHBondContact O-N 3.49Å; A22-H26 WeakPolarHBondContact O-CB 3.12Å; A22-H26 PolarHBondContact O-CD2 3.44Å; A22-H26 VanDerWaalsContact O-CD2 3.23Å; A22-H26 PolarHBondContact O-N 3.48Å; A22-H26 VanDerWaalsContact O-N 3.11Å |
| 23 | I | 96.2 | Very high | 94.3 | Very high | 71 Ų | 71 | 95.9 Ų | 95.9 | 36% | 0.364 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -63.2 | -56.1 | 176.1 | -69.6 | 167.1 | 0 | 0 | 0 | 110.5 | F19 G20 Y25 H26 I27 | F19-I23 HydrophobicContact CD1-CD1 3.98Å; F19-I23 HydrophobicContact CE1-CD1 3.56Å; F19-I23 HydrophobicContact CE2-CD1 4.32Å; F19-I23 HydrophobicContact CZ-CD1 3.75Å; F19-I23 WeakPolarHBondContact O-CG1 3.44Å; F19-I23 PolarHBondContact O-N 3.33Å; F19-I23 VanDerWaalsContact O-N 3.11Å; G20-I23 PolarHBondContact O-N 3.23Å; G20-I23 VanDerWaalsContact O-N 3.14Å; I23-Y25 VanDerWaalsContact C-N 3.33Å; I23-Y25 PolarHBondContact O-N 2.82Å; I23-H26 PolarHBondContact O-N 3.46Å; I23-I27 HydrophobicContact CG2-CD1 3.77Å; I23-I27 WeakPolarHBondContact O-CG1 3.41Å; I23-I27 PolarHBondContact O-N 3.19Å; I23-I27 VanDerWaalsContact O-N 3.09Å |
| 24 | Y | 94 | Very high | 94.2 | Very high | 150 Ų | 150 | 93.6 Ų | 93.6 | 59% | 0.588 | 47% | 0.469 | S | S | * | . | H | α-helix | trans | -64.3 | -36.5 | -178.5 | -70.9 | -68.5 | 0 | 0 | 0 | 112.4 | G20 H26 I27 E28 | G20-Y24 VanDerWaalsContact O-CD2 3.24Å; G20-Y24 WeakPolarHBondContact O-CD2 3.38Å; G20-Y24 PolarHBondContact O-N 3.5Å; Y24-H26 VanDerWaalsContact C-N 3.27Å; Y24-H26 PolarHBondContact O-N 3Å; Y24-I27 PolarHBondContact O-N 3.38Å; Y24-E28 HydrophobicContact CD1-CG 4.31Å; Y24-E28 WeakPolarHBondContact O-CB 3.23Å; Y24-E28 WeakPolarHBondContact O-CG 3.34Å; Y24-E28 PolarHBondContact O-N 3.36Å |
| 25 | Y | 95.1 | Very high | 93.8 | Very high | 140 Ų | 140 | 92 Ų | 92 | 55% | 0.549 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -64.2 | -28.9 | 173.4 | 179.4 | -96.9 | 0 | 0 | 0 | 113.2 | A21 I23 H29 | A21-Y25 WeakPolarHBondContact O-CB 3.13Å; A21-Y25 PolarHBondContact O-N 3.3Å; I23-Y25 VanDerWaalsContact C-N 3.33Å; I23-Y25 PolarHBondContact O-N 2.82Å; Y25-H29 HydrophobicContact CD2-CB 4.2Å; Y25-H29 AromaticContact CD2-CD2 3.97Å; Y25-H29 HydrophobicContact CE2-CB 4.32Å; Y25-H29 AromaticContact CE2-CD2 3.24Å; Y25-H29 WeakPolarHBondContact CE2-CD2 3.36Å; Y25-H29 AromaticContact CE2-CG 3.78Å; Y25-H29 AromaticContact CZ-CD2 3.39Å; Y25-H29 WeakPolarHBondContact O-CB 3.41Å; Y25-H29 PolarHBondContact OH-CD2 3.04Å |
| 26 | H | 93.6 | Very high | 93.4 | Very high | 155 Ų | 155 | 95.6 Ų | 95.6 | 72% | 0.718 | 47% | 0.469 | S | S | * | . | H | α-helix | trans | -85.7 | -20.4 | 176.4 | -84.7 | -63.8 | 0 | 0 | 0 | 114.3 | A22 I23 Y24 | A22-H26 WeakPolarHBondContact O-CB 3.12Å; A22-H26 PolarHBondContact O-CD2 3.44Å; A22-H26 VanDerWaalsContact O-CD2 3.23Å; A22-H26 PolarHBondContact O-N 3.48Å; A22-H26 VanDerWaalsContact O-N 3.11Å; I23-H26 PolarHBondContact O-N 3.46Å; Y24-H26 VanDerWaalsContact C-N 3.27Å; Y24-H26 PolarHBondContact O-N 3Å |
| 27 | I | 93.7 | Very high | 92.9 | Very high | 99 Ų | 99 | 90.4 Ų | 90.4 | 51% | 0.508 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -91.4 | -64.9 | 176.8 | -62.4 | 171.7 | 0 | 0 | 0 | 110 | I23 Y24 H29 G30 | I23-I27 HydrophobicContact CG2-CD1 3.77Å; I23-I27 WeakPolarHBondContact O-CG1 3.41Å; I23-I27 PolarHBondContact O-N 3.19Å; I23-I27 VanDerWaalsContact O-N 3.09Å; Y24-I27 PolarHBondContact O-N 3.38Å; I27-H29 PolarHBondContact O-N 3.36Å; I27-G30 PolarHBondContact O-N 3.17Å |
| 28 | E | 93.9 | Very high | 92.5 | Very high | 101 Ų | 101 | 91.5 Ų | 91.5 | 47% | 0.472 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -71.2 | -32.5 | -168.2 | -52.4 | -53.8 | 145.9 | 0 | 0 | 113.2 | Y24 G30 E31 E32 | Y24-E28 HydrophobicContact CD1-CG 4.31Å; Y24-E28 WeakPolarHBondContact O-CB 3.23Å; Y24-E28 WeakPolarHBondContact O-CG 3.34Å; Y24-E28 PolarHBondContact O-N 3.36Å; E28-G30 PolarHBondContact O-N 2.91Å; E28-G30 VanDerWaalsContact O-N 3.15Å; E28-E31 PolarHBondContact O-N 3.2Å; E28-E32 VanDerWaalsContact O-CB 3.27Å; E28-E32 WeakPolarHBondContact O-CB 3.28Å; E28-E32 PolarHBondContact O-N 2.84Å |
| 29 | H | 92.1 | Very high | 91.8 | Very high | 62 Ų | 62 | 91 Ų | 91 | 29% | 0.287 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -73.2 | -5.3 | -175.2 | -165.8 | 47.8 | 0 | 0 | 0 | 113.7 | Y25 I27 E32 K33 | Y25-H29 HydrophobicContact CD2-CB 4.2Å; Y25-H29 AromaticContact CD2-CD2 3.97Å; Y25-H29 HydrophobicContact CE2-CB 4.32Å; Y25-H29 AromaticContact CE2-CD2 3.24Å; Y25-H29 WeakPolarHBondContact CE2-CD2 3.36Å; Y25-H29 AromaticContact CE2-CG 3.78Å; Y25-H29 AromaticContact CZ-CD2 3.39Å; Y25-H29 WeakPolarHBondContact O-CB 3.41Å; Y25-H29 PolarHBondContact OH-CD2 3.04Å; I27-H29 PolarHBondContact O-N 3.36Å; H29-E32 IonicContact CE1-OE2 3.67Å; H29-E32 PolarHBondContact CE1-OE2 3.12Å; H29-E32 IonicContact ND1-OE2 3.93Å; H29-E32 PolarHBondContact ND1-OE2 2.85Å; H29-E32 IonicContact NE2-OE2 3.92Å; H29-K33 PolarHBondContact CD2-NZ 2.61Å; H29-K33 WeakPolarHBondContact O-CG 3.43Å; H29-K33 PolarHBondContact O-NZ 3.45Å |
| 30 | G | 89.6 | Confident | 90.8 | Very high | 35 Ų | 35 | 92.4 Ų | 92.4 | 36% | 0.361 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -76 | -64.8 | 164.2 | 0 | 0 | 0 | 0 | 0 | 110.1 | I27 E28 E32 K33 I34 | I27-G30 PolarHBondContact O-N 3.17Å; E28-G30 PolarHBondContact O-N 2.91Å; E28-G30 VanDerWaalsContact O-N 3.15Å; G30-E32 VanDerWaalsContact C-N 3.34Å; G30-E32 PolarHBondContact O-N 3.44Å; G30-K33 WeakPolarHBondContact O-CB 3.16Å; G30-K33 PolarHBondContact O-N 3.15Å; G30-I34 PolarHBondContact O-N 3.12Å |
| 31 | E | 90.1 | Very high | 90.2 | Very high | 122 Ų | 122 | 98.3 Ų | 98.3 | 57% | 0.57 | 48% | 0.477 | S | S | * | . | H | α-helix | trans | -59.7 | -39 | -178.4 | -56.3 | -49.3 | 131.2 | 0 | 0 | 112.9 | E28 K33 I34 S35 | E28-E31 PolarHBondContact O-N 3.2Å; E31-K33 PolarHBondContact O-N 3.24Å; E31-I34 PolarHBondContact O-N 3.25Å; E31-I34 VanDerWaalsContact O-N 3.11Å; E31-S35 WeakPolarHBondContact O-CB 3.47Å; E31-S35 PolarHBondContact O-N 2.9Å |
| 32 | E | 90.6 | Very high | 89.3 | Confident | 66 Ų | 66 | 98 Ų | 98 | 31% | 0.308 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -55.6 | -36.7 | 175.2 | -173.4 | -163.3 | -156.7 | 0 | 0 | 112 | E28 H29 G30 R36 | E28-E32 VanDerWaalsContact O-CB 3.27Å; E28-E32 WeakPolarHBondContact O-CB 3.28Å; E28-E32 PolarHBondContact O-N 2.84Å; H29-E32 IonicContact CE1-OE2 3.67Å; H29-E32 PolarHBondContact CE1-OE2 3.12Å; H29-E32 IonicContact ND1-OE2 3.93Å; H29-E32 PolarHBondContact ND1-OE2 2.85Å; H29-E32 IonicContact NE2-OE2 3.92Å; G30-E32 VanDerWaalsContact C-N 3.34Å; G30-E32 PolarHBondContact O-N 3.44Å; E32-R36 VanDerWaalsContact O-CB 3.26Å; E32-R36 WeakPolarHBondContact O-CB 3.22Å; E32-R36 WeakPolarHBondContact O-CG 3.31Å; E32-R36 PolarHBondContact O-N 3.46Å; E32-R36 VanDerWaalsContact O-N 3.07Å; E32-R36 IonicContact OE1-CZ 3.37Å; E32-R36 IonicContact OE1-NH1 2.63Å; E32-R36 PolarHBondContact OE1-NH1 3.48Å; E32-R36 IonicContact OE1-NH2 2.66Å; E32-R36 PolarHBondContact OE1-NH2 3.5Å; E32-R36 IonicContact OE2-NH1 2.69Å |
| 33 | K | 89.8 | Confident | 88.2 | Confident | 111 Ų | 111 | 102.7 Ų | 102.7 | 48% | 0.483 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -74.9 | -39.6 | 177.6 | -68.7 | -171.8 | -168.6 | 82 | 0 | 112.2 | H29 G30 E31 A37 | H29-K33 PolarHBondContact CD2-NZ 2.61Å; H29-K33 WeakPolarHBondContact O-CG 3.43Å; H29-K33 PolarHBondContact O-NZ 3.45Å; G30-K33 WeakPolarHBondContact O-CB 3.16Å; G30-K33 PolarHBondContact O-N 3.15Å; E31-K33 PolarHBondContact O-N 3.24Å; K33-A37 VanDerWaalsContact O-CB 3.24Å; K33-A37 WeakPolarHBondContact O-CB 3.09Å; K33-A37 PolarHBondContact O-N 3.16Å |
| 34 | I | 91.3 | Very high | 87.1 | Confident | 80 Ų | 80 | 103.8 Ų | 103.8 | 41% | 0.41 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -65.9 | -54.9 | 179.3 | -63.1 | 170.4 | 0 | 0 | 0 | 108.5 | G30 E31 R36 A37 E38 | G30-I34 PolarHBondContact O-N 3.12Å; E31-I34 PolarHBondContact O-N 3.25Å; E31-I34 VanDerWaalsContact O-N 3.11Å; I34-R36 PolarHBondContact O-N 3.4Å; I34-A37 CarbonylContact O-C 3.53Å; I34-A37 WeakPolarHBondContact O-CA 3.42Å; I34-A37 WeakPolarHBondContact O-CB 3.43Å; I34-A37 PolarHBondContact O-N 2.89Å; I34-E38 WeakPolarHBondContact CG2-OE1 3.44Å; I34-E38 WeakPolarHBondContact O-CG 3.29Å; I34-E38 PolarHBondContact O-N 3.44Å |
| 35 | S | 88.9 | Confident | 86.4 | Confident | 51 Ų | 51 | 99.1 Ų | 99.1 | 36% | 0.357 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -58.5 | -42.7 | 178.6 | -172 | 0 | 0 | 0 | 0 | 112.7 | E31 A37 E38 Q39 | E31-S35 WeakPolarHBondContact O-CB 3.47Å; E31-S35 PolarHBondContact O-N 2.9Å; S35-A37 PolarHBondContact O-N 3.1Å; S35-E38 PolarHBondContact O-N 2.83Å; S35-Q39 WeakPolarHBondContact O-CB 3.28Å; S35-Q39 VanDerWaalsContact O-CG 3.23Å; S35-Q39 WeakPolarHBondContact O-CG 3.36Å; S35-Q39 PolarHBondContact O-N 3.37Å; S35-Q39 PolarHBondContact OG-NE2 3.28Å |
| 36 | R | 86.7 | Confident | 85.5 | Confident | 138 Ų | 138 | 95.2 Ų | 95.2 | 52% | 0.521 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -69.2 | -29.2 | 173.8 | -77 | -169.8 | -177.2 | 130.4 | 15.5 | 113.9 | E32 I34 R40 | E32-R36 VanDerWaalsContact O-CB 3.26Å; E32-R36 WeakPolarHBondContact O-CB 3.22Å; E32-R36 WeakPolarHBondContact O-CG 3.31Å; E32-R36 PolarHBondContact O-N 3.46Å; E32-R36 VanDerWaalsContact O-N 3.07Å; E32-R36 IonicContact OE1-CZ 3.37Å; E32-R36 IonicContact OE1-NH1 2.63Å; E32-R36 PolarHBondContact OE1-NH1 3.48Å; E32-R36 IonicContact OE1-NH2 2.66Å; E32-R36 PolarHBondContact OE1-NH2 3.5Å; E32-R36 IonicContact OE2-NH1 2.69Å; I34-R36 PolarHBondContact O-N 3.4Å; R36-R40 VanDerWaalsContact O-CB 3.28Å; R36-R40 WeakPolarHBondContact O-CB 3.47Å; R36-R40 PolarHBondContact O-N 2.77Å; R36-R40 VanDerWaalsContact O-N 3.09Å |
| 37 | A | 86.8 | Confident | 84.5 | Confident | 44 Ų | 44 | 92.3 Ų | 92.3 | 36% | 0.364 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -71.1 | -37.8 | 173.3 | 0 | 0 | 0 | 0 | 0 | 111 | K33 I34 S35 K41 | K33-A37 VanDerWaalsContact O-CB 3.24Å; K33-A37 WeakPolarHBondContact O-CB 3.09Å; K33-A37 PolarHBondContact O-N 3.16Å; I34-A37 CarbonylContact O-C 3.53Å; I34-A37 WeakPolarHBondContact O-CA 3.42Å; I34-A37 WeakPolarHBondContact O-CB 3.43Å; I34-A37 PolarHBondContact O-N 2.89Å; S35-A37 PolarHBondContact O-N 3.1Å; A37-K41 WeakPolarHBondContact O-CB 3.33Å; A37-K41 VanDerWaalsContact O-CG 3.26Å; A37-K41 WeakPolarHBondContact O-CG 3.28Å; A37-K41 PolarHBondContact O-N 3.35Å |
| 38 | E | 89.3 | Confident | 83.5 | Confident | 109 Ų | 109 | 93.7 Ų | 93.7 | 51% | 0.509 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -69 | -47.9 | 175.2 | -71.7 | 168.2 | 173.9 | 0 | 0 | 112.1 | I34 S35 R40 K41 A42 | I34-E38 WeakPolarHBondContact CG2-OE1 3.44Å; I34-E38 WeakPolarHBondContact O-CG 3.29Å; I34-E38 PolarHBondContact O-N 3.44Å; S35-E38 PolarHBondContact O-N 2.83Å; E38-R40 VanDerWaalsContact C-N 3.26Å; E38-R40 PolarHBondContact O-N 3.11Å; E38-K41 WeakPolarHBondContact O-CB 3.32Å; E38-K41 PolarHBondContact O-N 3.12Å; E38-K41 VanDerWaalsContact O-N 3.1Å; E38-A42 WeakPolarHBondContact O-CB 3.45Å; E38-A42 PolarHBondContact O-N 3.38Å |
| 39 | Q | 80.6 | Confident | 82.4 | Confident | 119 Ų | 119 | 93.1 Ų | 93.1 | 56% | 0.556 | 46% | 0.463 | S | S | * | . | H | α-helix | trans | -55.5 | -41.9 | 172.3 | -72.9 | 168.6 | 3.1 | 0 | 0 | 111.6 | S35 Q43 | S35-Q39 WeakPolarHBondContact O-CB 3.28Å; S35-Q39 VanDerWaalsContact O-CG 3.23Å; S35-Q39 WeakPolarHBondContact O-CG 3.36Å; S35-Q39 PolarHBondContact O-N 3.37Å; S35-Q39 PolarHBondContact OG-NE2 3.28Å; Q39-Q43 WeakPolarHBondContact O-CB 3.2Å; Q39-Q43 PolarHBondContact O-N 3.15Å |
| 40 | R | 76.5 | Confident | 81.3 | Confident | 163 Ų | 163 | 92.1 Ų | 92.1 | 62% | 0.615 | 46% | 0.459 | S | S | * | . | H | α-helix | trans | -67.7 | -41.1 | 175.4 | -173.4 | -178.6 | -61.5 | 161 | 3.6 | 112.5 | R36 E38 Q43 I44 | R36-R40 VanDerWaalsContact O-CB 3.28Å; R36-R40 WeakPolarHBondContact O-CB 3.47Å; R36-R40 PolarHBondContact O-N 2.77Å; R36-R40 VanDerWaalsContact O-N 3.09Å; E38-R40 VanDerWaalsContact C-N 3.26Å; E38-R40 PolarHBondContact O-N 3.11Å; R40-Q43 PolarHBondContact O-N 2.9Å; R40-I44 HydrophobicContact CG-CD1 3.89Å; R40-I44 HydrophobicContact CG-CG1 4.44Å; R40-I44 WeakPolarHBondContact O-CB 3.39Å; R40-I44 VanDerWaalsContact O-CG1 3.26Å; R40-I44 WeakPolarHBondContact O-CG1 3.37Å; R40-I44 PolarHBondContact O-N 3.06Å |
| 41 | K | 82.7 | Confident | 80.2 | Confident | 145 Ų | 145 | 96.1 Ų | 96.1 | 63% | 0.63 | 47% | 0.472 | S | S | * | . | H | α-helix | trans | -60.7 | -46.7 | 174.4 | -76.7 | 168.5 | 179 | -179.6 | 0 | 111 | A37 E38 I44 A45 | A37-K41 WeakPolarHBondContact O-CB 3.33Å; A37-K41 VanDerWaalsContact O-CG 3.26Å; A37-K41 WeakPolarHBondContact O-CG 3.28Å; A37-K41 PolarHBondContact O-N 3.35Å; E38-K41 WeakPolarHBondContact O-CB 3.32Å; E38-K41 PolarHBondContact O-N 3.12Å; E38-K41 VanDerWaalsContact O-N 3.1Å; K41-I44 PolarHBondContact O-N 3.45Å; K41-A45 WeakPolarHBondContact O-CB 3.25Å; K41-A45 PolarHBondContact O-N 3.24Å |
| 42 | A | 78.4 | Confident | 79.2 | Confident | 50 Ų | 50 | 97.9 Ų | 97.9 | 41% | 0.413 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -61 | -45.1 | 176.8 | 0 | 0 | 0 | 0 | 0 | 111.4 | E38 I44 A45 I46 | E38-A42 WeakPolarHBondContact O-CB 3.45Å; E38-A42 PolarHBondContact O-N 3.38Å; A42-I44 PolarHBondContact O-N 3.45Å; A42-A45 PolarHBondContact O-N 3.08Å; A42-I46 WeakPolarHBondContact O-CB 3.28Å; A42-I46 WeakPolarHBondContact O-CD1 3.22Å; A42-I46 VanDerWaalsContact O-CG1 3.24Å; A42-I46 WeakPolarHBondContact O-CG1 3.32Å; A42-I46 PolarHBondContact O-N 3.15Å |
| 43 | Q | 73.4 | Confident | 78.1 | Confident | 145 Ų | 145 | 97.5 Ų | 97.5 | 68% | 0.678 | 48% | 0.478 | S | S | * | . | H | α-helix | trans | -63.9 | -37.8 | 176.4 | -170.8 | 176.6 | 20.2 | 0 | 0 | 112.8 | Q39 R40 N47 | Q39-Q43 WeakPolarHBondContact O-CB 3.2Å; Q39-Q43 PolarHBondContact O-N 3.15Å; R40-Q43 PolarHBondContact O-N 2.9Å; Q43-N47 VanDerWaalsContact O-CB 3.28Å; Q43-N47 WeakPolarHBondContact O-CB 3.44Å; Q43-N47 PolarHBondContact O-N 3.23Å; Q43-N47 VanDerWaalsContact O-N 3.07Å |
| 44 | I | 71.9 | Confident | 76.9 | Confident | 94 Ų | 94 | 94.4 Ų | 94.4 | 48% | 0.482 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -66.3 | -49 | 174 | -70.5 | 167.3 | 0 | 0 | 0 | 110.1 | R40 K41 A42 I46 N47 E48 | R40-I44 HydrophobicContact CG-CD1 3.89Å; R40-I44 HydrophobicContact CG-CG1 4.44Å; R40-I44 WeakPolarHBondContact O-CB 3.39Å; R40-I44 VanDerWaalsContact O-CG1 3.26Å; R40-I44 WeakPolarHBondContact O-CG1 3.37Å; R40-I44 PolarHBondContact O-N 3.06Å; K41-I44 PolarHBondContact O-N 3.45Å; A42-I44 PolarHBondContact O-N 3.45Å; I44-I46 PolarHBondContact O-N 2.89Å; I44-N47 CarbonylContact O-C 3.56Å; I44-N47 PolarHBondContact O-N 2.92Å; I44-N47 VanDerWaalsContact O-N 3.09Å; I44-E48 VanDerWaalsContact O-CB 3.26Å; I44-E48 WeakPolarHBondContact O-CB 3.32Å; I44-E48 PolarHBondContact O-N 3.01Å |
| 45 | A | 80.1 | Confident | 75.6 | Confident | 52 Ų | 52 | 93.3 Ų | 93.3 | 43% | 0.43 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -61.7 | -39.5 | 179.9 | 0 | 0 | 0 | 0 | 0 | 112.8 | K41 A42 E48 Y49 | K41-A45 WeakPolarHBondContact O-CB 3.25Å; K41-A45 PolarHBondContact O-N 3.24Å; A42-A45 PolarHBondContact O-N 3.08Å; A45-E48 PolarHBondContact O-N 2.94Å; A45-Y49 VanDerWaalsContact O-CB 3.24Å; A45-Y49 WeakPolarHBondContact O-CB 3.37Å; A45-Y49 PolarHBondContact O-N 3.26Å |
| 46 | I | 75.9 | Confident | 74.4 | Confident | 59 Ų | 59 | 99.1 Ų | 99.1 | 30% | 0.303 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -63.7 | -43.2 | 172.9 | -69.4 | 164 | 0 | 0 | 0 | 110.5 | A42 I44 L50 | A42-I46 WeakPolarHBondContact O-CB 3.28Å; A42-I46 WeakPolarHBondContact O-CD1 3.22Å; A42-I46 VanDerWaalsContact O-CG1 3.24Å; A42-I46 WeakPolarHBondContact O-CG1 3.32Å; A42-I46 PolarHBondContact O-N 3.15Å; I44-I46 PolarHBondContact O-N 2.89Å; I46-L50 HydrophobicContact CG2-CD1 3.94Å; I46-L50 VanDerWaalsContact O-CB 3.3Å; I46-L50 WeakPolarHBondContact O-CB 3.46Å; I46-L50 WeakPolarHBondContact O-CG 3.2Å; I46-L50 PolarHBondContact O-N 2.91Å |
| 47 | N | 71.6 | Confident | 73.1 | Confident | 94 Ų | 94 | 97 Ų | 97 | 50% | 0.503 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -71.1 | -32.1 | 178.9 | -174 | 88.6 | 0 | 0 | 0 | 112.9 | Q43 I44 L51 | Q43-N47 VanDerWaalsContact O-CB 3.28Å; Q43-N47 WeakPolarHBondContact O-CB 3.44Å; Q43-N47 PolarHBondContact O-N 3.23Å; Q43-N47 VanDerWaalsContact O-N 3.07Å; I44-N47 CarbonylContact O-C 3.56Å; I44-N47 PolarHBondContact O-N 2.92Å; I44-N47 VanDerWaalsContact O-N 3.09Å; N47-L51 WeakPolarHBondContact ND2-CD1 3.29Å; N47-L51 WeakPolarHBondContact O-CB 3.24Å; N47-L51 WeakPolarHBondContact O-CG 3.47Å; N47-L51 PolarHBondContact O-N 2.92Å |
| 48 | E | 73.9 | Confident | 72.1 | Confident | 127 Ų | 127 | 100.5 Ų | 100.5 | 59% | 0.593 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -70.2 | -48.2 | 175.4 | -172.4 | 165.1 | -154.3 | 0 | 0 | 110.4 | I44 A45 L50 L51 E52 | I44-E48 VanDerWaalsContact O-CB 3.26Å; I44-E48 WeakPolarHBondContact O-CB 3.32Å; I44-E48 PolarHBondContact O-N 3.01Å; A45-E48 PolarHBondContact O-N 2.94Å; E48-L50 PolarHBondContact O-N 3.44Å; E48-L51 PolarHBondContact O-N 3.03Å; E48-L51 VanDerWaalsContact O-N 3.13Å; E48-E52 PolarHBondContact O-N 3.11Å |
| 49 | Y | 71 | Confident | 70.9 | Confident | 89 Ų | 89 | 99.4 Ų | 99.4 | 35% | 0.349 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -59.8 | -42 | 172.3 | -179.2 | -118.9 | 0 | 0 | 0 | 112.6 | A45 E52 E53 I65 I69 | A45-Y49 VanDerWaalsContact O-CB 3.24Å; A45-Y49 WeakPolarHBondContact O-CB 3.37Å; A45-Y49 PolarHBondContact O-N 3.26Å; Y49-E52 PolarHBondContact O-N 3.39Å; Y49-E53 WeakPolarHBondContact O-CB 3.23Å; Y49-E53 PolarHBondContact O-N 3.27Å; Y49-I65 HydrophobicContact CE1-CG2 4.2Å; Y49-I69 HydrophobicContact CD1-CD1 4.44Å |
| 50 | L | 68.3 | Low | 70.1 | Confident | 41 Ų | 41 | 98.6 Ų | 98.6 | 22% | 0.215 | 51% | 0.514 | C | S | . | . | H | α-helix | trans | -62.6 | -41.1 | 173 | -77.9 | 168.8 | 0 | 0 | 0 | 112 | I46 E48 L54 I65 L66 I69 | I46-L50 HydrophobicContact CG2-CD1 3.94Å; I46-L50 VanDerWaalsContact O-CB 3.3Å; I46-L50 WeakPolarHBondContact O-CB 3.46Å; I46-L50 WeakPolarHBondContact O-CG 3.2Å; I46-L50 PolarHBondContact O-N 2.91Å; E48-L50 PolarHBondContact O-N 3.44Å; L50-L54 HydrophobicContact CB-CD1 4.37Å; L50-L54 HydrophobicContact CD2-CD1 3.57Å; L50-L54 WeakPolarHBondContact O-CB 3.29Å; L50-L54 VanDerWaalsContact O-CD1 3.28Å; L50-L54 WeakPolarHBondContact O-CD1 3.23Å; L50-L54 PolarHBondContact O-N 3.29Å; L50-I65 HydrophobicContact CD2-CG2 4.02Å; L50-L66 HydrophobicContact CD2-CD2 4.13Å; L50-I69 HydrophobicContact CD1-CD1 4.4Å; L50-I69 HydrophobicContact CD2-CD1 3.57Å; L50-I69 HydrophobicContact CG-CD1 3.92Å |
| 51 | L | 65.6 | Low | 69.6 | Low | 119 Ų | 119 | 92.7 Ų | 92.7 | 62% | 0.623 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -70.5 | -35.5 | 179.1 | -76.8 | 169.1 | 0 | 0 | 0 | 112.9 | N47 E48 G55 | N47-L51 WeakPolarHBondContact ND2-CD1 3.29Å; N47-L51 WeakPolarHBondContact O-CB 3.24Å; N47-L51 WeakPolarHBondContact O-CG 3.47Å; N47-L51 PolarHBondContact O-N 2.92Å; E48-L51 PolarHBondContact O-N 3.03Å; E48-L51 VanDerWaalsContact O-N 3.13Å; L51-G55 PolarHBondContact O-N 3.49Å |
| 52 | E | 69.9 | Low | 68.7 | Low | 160 Ų | 160 | 88.8 Ų | 88.8 | 75% | 0.748 | 48% | 0.48 | S | S | * | . | H | α-helix | trans | -67.3 | -46 | 175.3 | -174.6 | 172.3 | -158.6 | 0 | 0 | 111.5 | E48 Y49 | E48-E52 PolarHBondContact O-N 3.11Å; Y49-E52 PolarHBondContact O-N 3.39Å |
| 53 | E | 68.4 | Low | 68 | Low | 57 Ų | 57 | 91.1 Ų | 91.1 | 27% | 0.266 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -88.5 | -28.3 | -172.1 | -164.1 | 76.5 | -121.4 | 0 | 0 | 113.6 | Y49 K57 I65 | Y49-E53 WeakPolarHBondContact O-CB 3.23Å; Y49-E53 PolarHBondContact O-N 3.27Å; E53-K57 WeakPolarHBondContact O-CD 3.2Å; E53-K57 IonicContact OE1-NZ 3.44Å; E53-K57 PolarHBondContact OE1-NZ 3.3Å; E53-I65 HydrophobicContact CB-CD1 4Å; E53-I65 HydrophobicContact CG-CD1 3.3Å; E53-I65 HydrophobicContact CG-CG1 3.76Å |
| 54 | L | 63.8 | Low | 67.9 | Low | 46 Ų | 46 | 88.3 Ų | 88.3 | 24% | 0.241 | 47% | 0.473 | C | S | . | . | H | α-helix | trans | -89.1 | -10.7 | 175.4 | -76.7 | 74.5 | 0 | 0 | 0 | 113.8 | L50 D56 K57 Q62 I65 | L50-L54 HydrophobicContact CB-CD1 4.37Å; L50-L54 HydrophobicContact CD2-CD1 3.57Å; L50-L54 WeakPolarHBondContact O-CB 3.29Å; L50-L54 VanDerWaalsContact O-CD1 3.28Å; L50-L54 WeakPolarHBondContact O-CD1 3.23Å; L50-L54 PolarHBondContact O-N 3.29Å; L54-D56 VanDerWaalsContact C-N 3.25Å; L54-D56 PolarHBondContact O-N 3.19Å; L54-D56 VanDerWaalsContact O-N 3.12Å; L54-K57 PolarHBondContact O-N 2.84Å; L54-Q62 HydrophobicContact CD2-CB 4.15Å; L54-Q62 HydrophobicContact CD2-CG 3.9Å; L54-Q62 HydrophobicContact CG-CB 4.45Å; L54-Q62 HydrophobicContact CG-CG 3.99Å; L54-I65 HydrophobicContact CD1-CB 4.47Å; L54-I65 HydrophobicContact CD1-CD1 3.71Å; L54-I65 HydrophobicContact CD1-CG2 4.06Å; L54-I65 HydrophobicContact CG-CD1 4.4Å |
| 55 | G | 63.9 | Low | 67.8 | Low | 58 Ų | 58 | 84.2 Ų | 84.2 | 60% | 0.598 | 45% | 0.452 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -53 | -37.5 | -171.3 | 0 | 0 | 0 | 0 | 0 | 115.1 | L51 | L51-G55 PolarHBondContact O-N 3.49Š|
| 56 | D | 63.4 | Low | 67.1 | Low | 172 Ų | 172 | 83.4 Ų | 83.4 | 92% | 0.92 | 44% | 0.44 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -122.5 | 8.8 | -176.3 | -77 | -45.4 | 0 | 0 | 0 | 114.1 | L54 | L54-D56 VanDerWaalsContact C-N 3.25Å; L54-D56 PolarHBondContact O-N 3.19Å; L54-D56 VanDerWaalsContact O-N 3.12Å |
| 57 | K | 58.8 | Low | 66.7 | Low | 94 Ų | 94 | 86.2 Ų | 86.2 | 41% | 0.409 | 45% | 0.452 | S | S | . | . | trans | -114.6 | 145.9 | -162.6 | -67.2 | -167.5 | -176.1 | 174.6 | 0 | 117 | E53 L54 T61 Q62 | E53-K57 WeakPolarHBondContact O-CD 3.2Å; E53-K57 IonicContact OE1-NZ 3.44Å; E53-K57 PolarHBondContact OE1-NZ 3.3Å; L54-K57 PolarHBondContact O-N 2.84Å; K57-T61 HydrophobicContact CD-CG2 4.16Å; K57-Q62 PolarHBondContact O-NE2 3.14Å | ||
| 58 | N | 67.5 | Low | 66.4 | Low | 117 Ų | 117 | 88.6 Ų | 88.6 | 63% | 0.626 | 45% | 0.454 | S | S | * | . | trans | -73.6 | 160 | -175.7 | -161.9 | 7.4 | 0 | 0 | 0 | 112.2 | T60 T61 | N58-T60 VanDerWaalsContact C-N 3.3Å; N58-T60 PolarHBondContact O-N 2.94Å; N58-T60 VanDerWaalsContact O-N 3.12Å; N58-T61 PolarHBondContact O-N 3.47Å; N58-T61 PolarHBondContact O-OG1 3.3Å | ||
| 59 | T | 62.2 | Low | 66.2 | Low | 87 Ų | 87 | 83.2 Ų | 83.2 | 53% | 0.534 | 43% | 0.429 | S | S | . | . | H | α-helix | trans | -52.8 | -40 | -169.5 | 47.3 | 0 | 0 | 0 | 0 | 114.5 | T61 Q62 D63 | T59-T61 PolarHBondContact O-N 2.82Å; T59-Q62 VanDerWaalsContact O-CB 3.29Å; T59-Q62 WeakPolarHBondContact O-CB 3.3Å; T59-Q62 PolarHBondContact O-N 2.77Å; T59-D63 PolarHBondContact O-N 3.41Å |
| 60 | T | 63.8 | Low | 66 | Low | 102 Ų | 102 | 79.9 Ų | 79.9 | 63% | 0.626 | 42% | 0.418 | S | S | * | . | H | α-helix | trans | -62.4 | -27.5 | -179.9 | 53.9 | 0 | 0 | 0 | 0 | 114.2 | N58 | N58-T60 VanDerWaalsContact C-N 3.3Å; N58-T60 PolarHBondContact O-N 2.94Å; N58-T60 VanDerWaalsContact O-N 3.12Å |
| 61 | T | 67 | Low | 66 | Low | 38 Ų | 38 | 83 Ų | 83 | 23% | 0.233 | 44% | 0.435 | C | S | . | . | H | α-helix | trans | -80.7 | -28.6 | 175.1 | -9.7 | 0 | 0 | 0 | 0 | 111.2 | K57 N58 T59 D63 E64 I65 | K57-T61 HydrophobicContact CD-CG2 4.16Å; N58-T61 PolarHBondContact O-N 3.47Å; N58-T61 PolarHBondContact O-OG1 3.3Å; T59-T61 PolarHBondContact O-N 2.82Å; T61-D63 VanDerWaalsContact C-N 3.33Å; T61-D63 PolarHBondContact O-N 2.99Å; T61-E64 PolarHBondContact O-N 3.44Å; T61-I65 WeakPolarHBondContact O-CD1 3.24Å; T61-I65 WeakPolarHBondContact O-CG1 3.49Å; T61-I65 PolarHBondContact O-N 3.05Å |
| 62 | Q | 63.2 | Low | 65.9 | Low | 64 Ų | 64 | 86.9 Ų | 86.9 | 30% | 0.299 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -61.4 | -44.2 | 173.7 | -47.5 | -168.5 | -14.2 | 0 | 0 | 110.4 | L54 K57 T59 E64 I65 L66 | L54-Q62 HydrophobicContact CD2-CB 4.15Å; L54-Q62 HydrophobicContact CD2-CG 3.9Å; L54-Q62 HydrophobicContact CG-CB 4.45Å; L54-Q62 HydrophobicContact CG-CG 3.99Å; K57-Q62 PolarHBondContact O-NE2 3.14Å; T59-Q62 VanDerWaalsContact O-CB 3.29Å; T59-Q62 WeakPolarHBondContact O-CB 3.3Å; T59-Q62 PolarHBondContact O-N 2.77Å; Q62-E64 PolarHBondContact O-N 3.33Å; Q62-I65 PolarHBondContact O-N 2.86Å; Q62-L66 HydrophobicContact CB-CD1 4.4Å; Q62-L66 WeakPolarHBondContact O-CB 3.42Å; Q62-L66 VanDerWaalsContact O-CD1 3.25Å; Q62-L66 WeakPolarHBondContact O-CD1 3.25Å; Q62-L66 WeakPolarHBondContact O-CG 3.39Å; Q62-L66 PolarHBondContact O-N 3.43Å |
| 63 | D | 63.9 | Low | 65.5 | Low | 98 Ų | 98 | 81.4 Ų | 81.4 | 52% | 0.524 | 42% | 0.422 | S | S | . | . | H | α-helix | trans | -60.5 | -43.4 | 175.9 | -66.1 | -38.8 | 0 | 0 | 0 | 112.5 | T59 T61 I65 L66 Q67 | T59-D63 PolarHBondContact O-N 3.41Å; T61-D63 VanDerWaalsContact C-N 3.33Å; T61-D63 PolarHBondContact O-N 2.99Å; D63-I65 PolarHBondContact O-N 2.77Å; D63-L66 PolarHBondContact O-N 3.29Å; D63-Q67 WeakPolarHBondContact O-CB 3.42Å; D63-Q67 PolarHBondContact O-N 2.93Å |
| 64 | E | 70.9 | Confident | 64.9 | Low | 87 Ų | 87 | 86.2 Ų | 86.2 | 41% | 0.407 | 45% | 0.449 | S | S | . | . | H | α-helix | trans | -63.2 | -41.7 | 176.6 | -164.7 | -163.5 | 147.7 | 0 | 0 | 112.1 | T61 Q62 Q67 R68 | T61-E64 PolarHBondContact O-N 3.44Å; Q62-E64 PolarHBondContact O-N 3.33Å; E64-Q67 PolarHBondContact O-N 3.38Å; E64-R68 WeakPolarHBondContact O-CG 3.38Å; E64-R68 PolarHBondContact O-N 3.45Å; E64-R68 IonicContact OE1-CZ 2.87Å; E64-R68 IonicContact OE1-NE 3.87Å; E64-R68 PolarHBondContact OE1-NE 3.04Å; E64-R68 IonicContact OE1-NH2 3.78Å; E64-R68 PolarHBondContact OE1-NH2 3.46Å |
| 65 | I | 70 | Confident | 64.4 | Low | 8 Ų | 8 | 91.1 Ų | 91.1 | 4% | 0.041 | 47% | 0.469 | C | S | . | . | H | α-helix | trans | -65.7 | -44.2 | 179.1 | -64 | 155.7 | 0 | 0 | 0 | 110.3 | Y49 L50 E53 L54 T61 Q62 D63 Q67 R68 I69 | Y49-I65 HydrophobicContact CE1-CG2 4.2Å; L50-I65 HydrophobicContact CD2-CG2 4.02Å; E53-I65 HydrophobicContact CB-CD1 4Å; E53-I65 HydrophobicContact CG-CD1 3.3Å; E53-I65 HydrophobicContact CG-CG1 3.76Å; L54-I65 HydrophobicContact CD1-CB 4.47Å; L54-I65 HydrophobicContact CD1-CD1 3.71Å; L54-I65 HydrophobicContact CD1-CG2 4.06Å; L54-I65 HydrophobicContact CG-CD1 4.4Å; T61-I65 WeakPolarHBondContact O-CD1 3.24Å; T61-I65 WeakPolarHBondContact O-CG1 3.49Å; T61-I65 PolarHBondContact O-N 3.05Å; Q62-I65 PolarHBondContact O-N 2.86Å; D63-I65 PolarHBondContact O-N 2.77Å; I65-Q67 VanDerWaalsContact C-N 3.29Å; I65-Q67 PolarHBondContact O-N 2.83Å; I65-R68 PolarHBondContact O-N 3.48Å; I65-I69 HydrophobicContact CG2-CD1 3.86Å; I65-I69 VanDerWaalsContact O-CG1 3.29Å; I65-I69 WeakPolarHBondContact O-CG1 3.5Å; I65-I69 PolarHBondContact O-N 2.89Å |
| 66 | L | 66.7 | Low | 63.8 | Low | 34 Ų | 34 | 91.7 Ų | 91.7 | 18% | 0.178 | 46% | 0.462 | C | S | . | . | H | α-helix | trans | -69.7 | -29.2 | 179.8 | -63.9 | 160.4 | 0 | 0 | 0 | 111.5 | L50 Q62 D63 S70 T78 | L50-L66 HydrophobicContact CD2-CD2 4.13Å; Q62-L66 HydrophobicContact CB-CD1 4.4Å; Q62-L66 WeakPolarHBondContact O-CB 3.42Å; Q62-L66 VanDerWaalsContact O-CD1 3.25Å; Q62-L66 WeakPolarHBondContact O-CD1 3.25Å; Q62-L66 WeakPolarHBondContact O-CG 3.39Å; Q62-L66 PolarHBondContact O-N 3.43Å; D63-L66 PolarHBondContact O-N 3.29Å; L66-S70 WeakPolarHBondContact O-CB 3.39Å; L66-S70 PolarHBondContact O-N 2.85Å; L66-T78 HydrophobicContact CB-CG2 3.55Å; L66-T78 WeakPolarHBondContact CB-OG1 3.2Å; L66-T78 HydrophobicContact CD1-CG2 3.71Å; L66-T78 HydrophobicContact CD2-CG2 4.13Å; L66-T78 HydrophobicContact CG-CG2 3.98Å |
| 67 | Q | 65.8 | Low | 63.4 | Low | 118 Ų | 118 | 87.3 Ų | 87.3 | 55% | 0.551 | 44% | 0.441 | S | S | * | . | H | α-helix | trans | -67.2 | -44.7 | 167.1 | -171.6 | 173.7 | 3.4 | 0 | 0 | 112.3 | D63 E64 I65 I69 S70 D71 | D63-Q67 WeakPolarHBondContact O-CB 3.42Å; D63-Q67 PolarHBondContact O-N 2.93Å; E64-Q67 PolarHBondContact O-N 3.38Å; I65-Q67 VanDerWaalsContact C-N 3.29Å; I65-Q67 PolarHBondContact O-N 2.83Å; Q67-I69 VanDerWaalsContact C-N 3.29Å; Q67-I69 PolarHBondContact O-N 2.58Å; Q67-S70 WeakPolarHBondContact O-CB 3.32Å; Q67-S70 PolarHBondContact O-N 2.91Å; Q67-D71 VanDerWaalsContact O-CG 3.28Å; Q67-D71 PolarHBondContact O-N 3.05Å |
| 68 | R | 67.3 | Low | 62.9 | Low | 145 Ų | 145 | 85.1 Ų | 85.1 | 55% | 0.547 | 44% | 0.436 | S | S | . | . | H | α-helix | trans | -63.6 | -33.7 | 173.6 | -68.9 | -172.3 | -168.1 | -159.4 | 7.5 | 112.9 | E64 I65 D71 Y72 | E64-R68 WeakPolarHBondContact O-CG 3.38Å; E64-R68 PolarHBondContact O-N 3.45Å; E64-R68 IonicContact OE1-CZ 2.87Å; E64-R68 IonicContact OE1-NE 3.87Å; E64-R68 PolarHBondContact OE1-NE 3.04Å; E64-R68 IonicContact OE1-NH2 3.78Å; E64-R68 PolarHBondContact OE1-NH2 3.46Å; I65-R68 PolarHBondContact O-N 3.48Å; R68-D71 PolarHBondContact O-N 3.39Å; R68-Y72 WeakPolarHBondContact O-CB 3.42Å; R68-Y72 PolarHBondContact O-N 3.47Å |
| 69 | I | 69.3 | Low | 61.8 | Low | 13 Ų | 13 | 86.3 Ų | 86.3 | 7% | 0.067 | 44% | 0.441 | C | S | . | . | H | α-helix | trans | -71.6 | -35.4 | 174.9 | -67.4 | 166.8 | 0 | 0 | 0 | 110.9 | Y49 L50 I65 Q67 C73 V77 | Y49-I69 HydrophobicContact CD1-CD1 4.44Å; L50-I69 HydrophobicContact CD1-CD1 4.4Å; L50-I69 HydrophobicContact CD2-CD1 3.57Å; L50-I69 HydrophobicContact CG-CD1 3.92Å; I65-I69 HydrophobicContact CG2-CD1 3.86Å; I65-I69 VanDerWaalsContact O-CG1 3.29Å; I65-I69 WeakPolarHBondContact O-CG1 3.5Å; I65-I69 PolarHBondContact O-N 2.89Å; Q67-I69 VanDerWaalsContact C-N 3.29Å; Q67-I69 PolarHBondContact O-N 2.58Å; I69-C73 VanDerWaalsContact O-CB 3.32Å; I69-C73 WeakPolarHBondContact O-CB 3.45Å; I69-C73 PolarHBondContact O-N 3.02Å; I69-C73 VanDerWaalsContact O-N 3.08Å; I69-C73 PolarHBondContact O-SG 2.91Å; I69-V77 HydrophobicContact CG2-CB 4.15Å; I69-V77 HydrophobicContact CG2-CG1 4.23Å; I69-V77 HydrophobicContact CG2-CG2 3.88Å |
| 70 | S | 66.3 | Low | 60.9 | Low | 19 Ų | 19 | 86.6 Ų | 86.6 | 13% | 0.133 | 45% | 0.445 | C | S | . | . | H | α-helix | trans | -53.9 | -53.7 | 167.7 | 154.4 | 0 | 0 | 0 | 0 | 111.1 | L66 Q67 Y72 C73 D74 K75 P76 | L66-S70 WeakPolarHBondContact O-CB 3.39Å; L66-S70 PolarHBondContact O-N 2.85Å; Q67-S70 WeakPolarHBondContact O-CB 3.32Å; Q67-S70 PolarHBondContact O-N 2.91Å; S70-Y72 VanDerWaalsContact C-N 3.35Å; S70-Y72 PolarHBondContact O-N 3.13Å; S70-C73 PolarHBondContact O-N 2.99Å; S70-D74 PolarHBondContact O-N 3.37Å; S70-K75 WeakPolarHBondContact CA-O 3.44Å; S70-K75 PolarHBondContact O-N 3.1Å; S70-P76 WeakPolarHBondContact OG-CA 3.44Å |
| 71 | D | 67.3 | Low | 60 | Low | 107 Ų | 107 | 84.8 Ų | 84.8 | 57% | 0.572 | 44% | 0.435 | S | S | * | . | H | α-helix | trans | -68.5 | -33.6 | -175.4 | -61.4 | -8.4 | 0 | 0 | 0 | 111.9 | Q67 R68 | Q67-D71 VanDerWaalsContact O-CG 3.28Å; Q67-D71 PolarHBondContact O-N 3.05Å; R68-D71 PolarHBondContact O-N 3.39Å |
| 72 | Y | 64.5 | Low | 58.7 | Low | 201 Ų | 201 | 87.9 Ų | 87.9 | 79% | 0.788 | 45% | 0.454 | S | S | * | . | H | α-helix | trans | -75 | -23.3 | 175.8 | -172.5 | -98.7 | 0 | 0 | 0 | 114 | R68 S70 | R68-Y72 WeakPolarHBondContact O-CB 3.42Å; R68-Y72 PolarHBondContact O-N 3.47Å; S70-Y72 VanDerWaalsContact C-N 3.35Å; S70-Y72 PolarHBondContact O-N 3.13Å |
| 73 | C | 61.4 | Low | 57.9 | Low | 44 Ų | 44 | 94 Ų | 94 | 30% | 0.297 | 48% | 0.475 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -93.7 | 0.5 | -178.9 | -67.9 | 0 | 0 | 0 | 0 | 114.4 | I69 S70 K75 | I69-C73 VanDerWaalsContact O-CB 3.32Å; I69-C73 WeakPolarHBondContact O-CB 3.45Å; I69-C73 PolarHBondContact O-N 3.02Å; I69-C73 VanDerWaalsContact O-N 3.08Å; I69-C73 PolarHBondContact O-SG 2.91Å; S70-C73 PolarHBondContact O-N 2.99Å; C73-K75 HydrophobicContact CB-CB 4.24Å; C73-K75 WeakPolarHBondContact O-CB 3.38Å; C73-K75 WeakPolarHBondContact O-CG 3.31Å; C73-K75 PolarHBondContact O-N 3.28Å |
| 74 | D | 55.5 | Low | 57.1 | Low | 158 Ų | 158 | 96.1 Ų | 96.1 | 85% | 0.845 | 49% | 0.487 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 50.6 | 20.9 | -164.1 | -71 | -48.4 | 0 | 0 | 0 | 113.1 | S70 | S70-D74 PolarHBondContact O-N 3.37Š|
| 75 | K | 53.2 | Low | 56.2 | Low | 149 Ų | 149 | 98 Ų | 98 | 65% | 0.648 | 50% | 0.5 | S | S | * | . | S | Bend | trans | -153.7 | 119.9 | -165.9 | -72.3 | 174 | -172.8 | 158.7 | 0 | 109.9 | S70 C73 V77 | S70-K75 WeakPolarHBondContact CA-O 3.44Å; S70-K75 PolarHBondContact O-N 3.1Å; C73-K75 HydrophobicContact CB-CB 4.24Å; C73-K75 WeakPolarHBondContact O-CB 3.38Å; C73-K75 WeakPolarHBondContact O-CG 3.31Å; C73-K75 PolarHBondContact O-N 3.28Å; K75-V77 PolarHBondContact O-N 3.43Å; K75-V77 VanDerWaalsContact O-N 3.11Å |
| 76 | P | 51.6 | Low | 55.5 | Low | 70 Ų | 70 | 101.1 Ų | 101.1 | 46% | 0.455 | 52% | 0.519 | S | S | . | . | trans | -64.6 | 116.2 | -177.7 | 19.9 | -27.3 | 0 | 0 | 0 | 112.2 | S70 L79 | S70-P76 WeakPolarHBondContact OG-CA 3.44Å; P76-L79 WeakPolarHBondContact CB-O 3.36Å | ||
| 77 | V | 56.1 | Low | 55.3 | Low | 80 Ų | 80 | 103.1 Ų | 103.1 | 49% | 0.485 | 53% | 0.534 | S | S | . | . | S | Bend | trans | -85.2 | -26 | 177.5 | 172.1 | 0 | 0 | 0 | 0 | 111.6 | I69 K75 | I69-V77 HydrophobicContact CG2-CB 4.15Å; I69-V77 HydrophobicContact CG2-CG1 4.23Å; I69-V77 HydrophobicContact CG2-CG2 3.88Å; K75-V77 PolarHBondContact O-N 3.43Å; K75-V77 VanDerWaalsContact O-N 3.11Å |
| 78 | T | 46.9 | Very low | 55.6 | Low | 48 Ų | 48 | 106.7 Ų | 106.7 | 29% | 0.294 | 54% | 0.544 | S | S | . | . | S | Bend | trans | -132.2 | 142.5 | 168.6 | 44.4 | 0 | 0 | 0 | 0 | 111.6 | L66 | L66-T78 HydrophobicContact CB-CG2 3.55Å; L66-T78 WeakPolarHBondContact CB-OG1 3.2Å; L66-T78 HydrophobicContact CD1-CG2 3.71Å; L66-T78 HydrophobicContact CD2-CG2 4.13Å; L66-T78 HydrophobicContact CG-CG2 3.98Å |
| 79 | L | 44.2 | Very low | 56 | Low | 142 Ų | 142 | 104.1 Ų | 104.1 | 74% | 0.743 | 54% | 0.544 | S | S | * | . | S | Bend | trans | 60.3 | 129.6 | -169.8 | -62.5 | 144 | 0 | 0 | 0 | 111.6 | P76 | P76-L79 WeakPolarHBondContact CB-O 3.36Š|
| 80 | P | 44.5 | Very low | 56.7 | Low | 94 Ų | 94 | 108.9 Ų | 108.9 | 61% | 0.61 | 56% | 0.562 | S | S | * | * | trans | -58.6 | 151.2 | 161.1 | 29.5 | -33.7 | 0 | 0 | 0 | 108.1 | ||||
| 81 | P | 43.7 | Very low | 57.6 | Low | 63 Ų | 63 | 110.8 Ų | 110.8 | 41% | 0.409 | 57% | 0.573 | S | S | . | * | S | Bend | trans | -57.7 | 149.1 | 168.1 | 31 | -33.1 | 0 | 0 | 0 | 107.7 | Y83 T86 | P81-Y83 PolarHBondContact O-N 3.1Å; P81-T86 HydrophobicContact CG-CG2 3.65Å |
| 82 | T | 41.4 | Very low | 58.4 | Low | 104 Ų | 104 | 114.3 Ų | 114.3 | 64% | 0.638 | 58% | 0.583 | S | S | * | * | trans | -39.1 | 125.8 | -172.1 | -48 | 0 | 0 | 0 | 0 | 110.7 | D84 D85 | T82-D84 PolarHBondContact O-N 3.49Å; T82-D85 PolarHBondContact O-N 3.26Å | ||
| 83 | Y | 46.5 | Very low | 59.4 | Low | 191 Ų | 191 | 106.2 Ų | 106.2 | 75% | 0.749 | 55% | 0.551 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -54.8 | -21.2 | -154.2 | -165.5 | -99 | 0 | 0 | 0 | 115.4 | P81 | P81-Y83 PolarHBondContact O-N 3.1Š|
| 84 | D | 45.5 | Very low | 60.6 | Low | 144 Ų | 144 | 105.7 Ų | 105.7 | 77% | 0.77 | 55% | 0.545 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -78.9 | -20.4 | 177.7 | -56.7 | -59.7 | 0 | 0 | 0 | 115 | T82 | T82-D84 PolarHBondContact O-N 3.49Š|
| 85 | D | 51.9 | Low | 62.2 | Low | 127 Ų | 127 | 99.9 Ų | 99.9 | 68% | 0.679 | 52% | 0.519 | S | S | * | . | S | Bend | trans | -86.3 | -14.3 | -173.6 | -82.3 | -44.8 | 0 | 0 | 0 | 114.7 | T82 P87 | T82-D85 PolarHBondContact O-N 3.26Å; D85-P87 WeakPolarHBondContact O-CD 3.34Å |
| 86 | T | 55.7 | Low | 64 | Low | 72 Ų | 72 | 97.7 Ų | 97.7 | 44% | 0.442 | 51% | 0.509 | S | S | . | . | S | Bend | trans | -80 | 117.5 | 175.1 | 63.2 | 0 | 0 | 0 | 0 | 111.2 | P81 Y88 | P81-T86 HydrophobicContact CG-CG2 3.65Å; T86-Y88 PolarHBondContact O-N 2.89Å |
| 87 | P | 63.2 | Low | 65.8 | Low | 77 Ų | 77 | 95 Ų | 95 | 50% | 0.5 | 49% | 0.491 | S | S | . | . | P | Polyproline II helix | trans | -68.5 | 129.5 | -179 | 28.5 | -35.8 | 0 | 0 | 0 | 111 | D85 T89 A229 | D85-P87 WeakPolarHBondContact O-CD 3.34Å; P87-T89 PolarHBondContact O-N 2.86Å; P87-T89 VanDerWaalsContact O-N 3.12Å; P87-A229 HydrophobicContact CB-CB 4.18Å; P87-A229 HydrophobicContact CG-CB 3.85Å |
| 88 | Y | 71.6 | Confident | 67.5 | Low | 193 Ų | 193 | 93 Ų | 93 | 76% | 0.757 | 48% | 0.476 | S | S | * | . | P | Polyproline II helix | trans | -55.4 | 117.9 | 177.6 | -64.3 | -61.2 | 0 | 0 | 0 | 112.1 | T86 W90 T91 | T86-Y88 PolarHBondContact O-N 2.89Å; Y88-W90 PolarHBondContact O-N 3.32Å; Y88-T91 WeakPolarHBondContact O-CG2 3.31Å |
| 89 | T | 75.1 | Confident | 69.7 | Low | 90 Ų | 90 | 91.9 Ų | 91.9 | 55% | 0.552 | 47% | 0.471 | S | S | * | . | S | Bend | trans | -62.8 | -27 | 178.6 | 52.6 | 0 | 0 | 0 | 0 | 113.2 | P87 T91 H94 | P87-T89 PolarHBondContact O-N 2.86Å; P87-T89 VanDerWaalsContact O-N 3.12Å; T89-T91 PolarHBondContact O-N 3.11Å; T89-H94 VanDerWaalsContact O-CB 3.23Å; T89-H94 WeakPolarHBondContact O-CB 3.38Å; T89-H94 PolarHBondContact O-CD2 3.13Å |
| 90 | W | 83.9 | Confident | 71.9 | Confident | 113 Ų | 113 | 86.3 Ų | 86.3 | 43% | 0.428 | 44% | 0.441 | S | S | . | . | trans | -95.5 | 56.4 | 177.5 | -69.7 | 98.1 | 0 | 0 | 0 | 112.8 | Y88 A95 F98 I111 | Y88-W90 PolarHBondContact O-N 3.32Å; W90-A95 HydrophobicContact CE3-CB 4.25Å; W90-F98 HydrophobicContact CH2-CD1 4.05Å; W90-F98 HydrophobicContact CH2-CD2 4.33Å; W90-F98 HydrophobicContact CH2-CE1 4.3Å; W90-F98 HydrophobicContact CH2-CG 4.07Å; W90-F98 HydrophobicContact CZ3-CB 4.26Å; W90-F98 AromaticContact CZ3-CD1 3.93Å; W90-F98 HydrophobicContact CZ3-CD1 3.93Å; W90-F98 HydrophobicContact CZ3-CG 4.02Å; W90-I111 HydrophobicContact CD2-CG2 4.15Å; W90-I111 HydrophobicContact CE3-CG2 4.17Å; W90-I111 HydrophobicContact CH2-CG2 3.46Å; W90-I111 VanDerWaalsContact CH2-CG2 3.46Å; W90-I111 HydrophobicContact CZ2-CG2 3.41Å; W90-I111 VanDerWaalsContact CZ2-CG2 3.41Å; W90-I111 HydrophobicContact CZ3-CG2 3.84Å | ||
| 91 | T | 85.3 | Confident | 74.2 | Confident | 60 Ų | 60 | 82.1 Ų | 82.1 | 37% | 0.368 | 41% | 0.414 | S | S | . | . | trans | -65.6 | 160 | 164.3 | 72.1 | 0 | 0 | 0 | 0 | 110.7 | Y88 T89 Y93 H94 A95 | Y88-T91 WeakPolarHBondContact O-CG2 3.31Å; T89-T91 PolarHBondContact O-N 3.11Å; T91-Y93 PolarHBondContact O-N 3.21Å; T91-H94 PolarHBondContact O-N 3.28Å; T91-H94 VanDerWaalsContact O-N 3.12Å; T91-H94 PolarHBondContact OG1-CD2 3.38Å; T91-H94 PolarHBondContact OG1-N 3.15Å; T91-H94 VanDerWaalsContact OG1-N 3.15Å; T91-A95 WeakPolarHBondContact O-CB 3.41Å; T91-A95 PolarHBondContact O-N 2.87Å | ||
| 92 | F | 85.8 | Confident | 76.6 | Confident | 180 Ų | 180 | 80.1 Ų | 80.1 | 79% | 0.789 | 40% | 0.4 | S | S | * | . | H | α-helix | trans | -56.2 | -37.3 | 174.8 | 179.3 | -97.6 | 0 | 0 | 0 | 112.5 | A95 F96 | F92-A95 PolarHBondContact O-N 3Å; F92-F96 WeakPolarHBondContact O-CB 3.4Å; F92-F96 PolarHBondContact O-N 3.35Å |
| 93 | Y | 85.2 | Confident | 79 | Confident | 31 Ų | 31 | 75.8 Ų | 75.8 | 12% | 0.122 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -65.1 | -47.5 | 175.1 | 178 | -90.3 | 0 | 0 | 0 | 111.8 | T91 A95 F96 F97 F227 Q243 I247 | T91-Y93 PolarHBondContact O-N 3.21Å; Y93-A95 VanDerWaalsContact C-N 3.33Å; Y93-A95 PolarHBondContact O-N 3.45Å; Y93-F96 PolarHBondContact O-N 3.24Å; Y93-F97 HydrophobicContact CE1-CB 4.33Å; Y93-F97 WeakPolarHBondContact O-CB 3.38Å; Y93-F97 PolarHBondContact O-N 3.37Å; Y93-F227 HydrophobicContact CD1-CD2 4.22Å; Y93-F227 HydrophobicContact CD1-CE2 4.49Å; Y93-F227 HydrophobicContact CE1-CD1 4.44Å; Y93-F227 AromaticContact CE1-CD2 3.55Å; Y93-F227 HydrophobicContact CE1-CD2 3.55Å; Y93-F227 HydrophobicContact CE1-CE1 4.33Å; Y93-F227 AromaticContact CE1-CE2 3.43Å; Y93-F227 HydrophobicContact CE1-CE2 3.43Å; Y93-F227 VanDerWaalsContact CE1-CE2 3.43Å; Y93-F227 HydrophobicContact CE1-CG 4.08Å; Y93-F227 AromaticContact CE1-CZ 3.85Å; Y93-F227 HydrophobicContact CE1-CZ 3.85Å; Y93-F227 AromaticContact CZ-CE2 3.96Å; Y93-F227 AromaticContact CZ-CZ 3.93Å; Y93-F227 WeakPolarHBondContact OH-CZ 3.41Å; Y93-Q243 HydrophobicContact CD2-CB 4.18Å; Y93-Q243 HydrophobicContact CD2-CG 4.15Å; Y93-Q243 HydrophobicContact CE1-CG 4.11Å; Y93-Q243 HydrophobicContact CE2-CB 3.53Å; Y93-Q243 HydrophobicContact CE2-CG 3.71Å; Y93-Q243 PolarHBondContact OH-O 2.82Å; Y93-I247 HydrophobicContact CE2-CD1 3.64Å |
| 94 | H | 85.1 | Confident | 81.2 | Confident | 34 Ų | 34 | 66.8 Ų | 66.8 | 16% | 0.157 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -63.8 | -37.8 | 177 | -68.5 | -51.3 | 0 | 0 | 0 | 112.1 | T89 T91 F97 F98 I111 F227 | T89-H94 VanDerWaalsContact O-CB 3.23Å; T89-H94 WeakPolarHBondContact O-CB 3.38Å; T89-H94 PolarHBondContact O-CD2 3.13Å; T91-H94 PolarHBondContact O-N 3.28Å; T91-H94 VanDerWaalsContact O-N 3.12Å; T91-H94 PolarHBondContact OG1-CD2 3.38Å; T91-H94 PolarHBondContact OG1-N 3.15Å; T91-H94 VanDerWaalsContact OG1-N 3.15Å; H94-F97 PolarHBondContact O-N 3.32Å; H94-F98 WeakPolarHBondContact O-CB 3.27Å; H94-F98 PolarHBondContact O-N 3.44Å; H94-I111 HydrophobicContact CB-CD1 3.94Å; H94-F227 AromaticContact CE1-CD2 3.97Å |
| 95 | A | 90.4 | Very high | 83.4 | Confident | 36 Ų | 36 | 64 Ų | 64 | 30% | 0.298 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -65.2 | -40.4 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | W90 T91 F92 Y93 A99 | W90-A95 HydrophobicContact CE3-CB 4.25Å; T91-A95 WeakPolarHBondContact O-CB 3.41Å; T91-A95 PolarHBondContact O-N 2.87Å; F92-A95 PolarHBondContact O-N 3Å; Y93-A95 VanDerWaalsContact C-N 3.33Å; Y93-A95 PolarHBondContact O-N 3.45Å; A95-A99 WeakPolarHBondContact O-CB 3.42Å; A95-A99 PolarHBondContact O-N 3.37Å |
| 96 | F | 90.5 | Very high | 85.4 | Confident | 102 Ų | 102 | 58.3 Ų | 58.3 | 45% | 0.447 | 30% | 0.297 | S | S | . | . | H | α-helix | trans | -65.5 | -45.9 | 173.5 | -179.2 | -88.5 | 0 | 0 | 0 | 111.7 | F92 Y93 F98 A99 F100 I247 | F92-F96 WeakPolarHBondContact O-CB 3.4Å; F92-F96 PolarHBondContact O-N 3.35Å; Y93-F96 PolarHBondContact O-N 3.24Å; F96-F98 VanDerWaalsContact C-N 3.34Å; F96-F98 PolarHBondContact O-N 3.03Å; F96-A99 PolarHBondContact O-N 2.83Å; F96-F100 HydrophobicContact CE1-CB 4.5Å; F96-F100 VanDerWaalsContact O-CB 3.25Å; F96-F100 WeakPolarHBondContact O-CB 3.42Å; F96-F100 PolarHBondContact O-N 3.3Å; F96-I247 HydrophobicContact CD1-CD1 4.03Å; F96-I247 HydrophobicContact CE1-CD1 3.88Å; F96-I247 HydrophobicContact CE1-CG2 4.37Å |
| 97 | F | 89.4 | Confident | 87 | Confident | 15 Ų | 15 | 57 Ų | 57 | 7% | 0.066 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -63.9 | -38 | 177.6 | -171.9 | -99.9 | 0 | 0 | 0 | 111.8 | Y93 H94 F100 T101 Y108 V224 V246 I247 | Y93-F97 HydrophobicContact CE1-CB 4.33Å; Y93-F97 WeakPolarHBondContact O-CB 3.38Å; Y93-F97 PolarHBondContact O-N 3.37Å; H94-F97 PolarHBondContact O-N 3.32Å; F97-F100 PolarHBondContact O-N 3.05Å; F97-T101 HydrophobicContact CD1-CG2 4.2Å; F97-T101 HydrophobicContact CE1-CG2 3.95Å; F97-T101 HydrophobicContact CE2-CG2 4.49Å; F97-T101 HydrophobicContact CZ-CG2 4.12Å; F97-T101 WeakPolarHBondContact O-CB 3.27Å; F97-T101 VanDerWaalsContact O-CG2 3.28Å; F97-T101 WeakPolarHBondContact O-CG2 3.34Å; F97-T101 PolarHBondContact O-N 3.45Å; F97-T101 PolarHBondContact O-OG1 2.85Å; F97-Y108 AromaticContact CE1-CD2 3.92Å; F97-Y108 HydrophobicContact CE1-CD2 3.92Å; F97-Y108 AromaticContact CE1-CE2 3.71Å; F97-Y108 HydrophobicContact CE1-CE2 3.71Å; F97-Y108 HydrophobicContact CZ-CD2 4.34Å; F97-Y108 AromaticContact CZ-CE2 3.66Å; F97-Y108 HydrophobicContact CZ-CE2 3.66Å; F97-V224 HydrophobicContact CE1-CG1 3.96Å; F97-V224 HydrophobicContact CZ-CG1 4.43Å; F97-V246 HydrophobicContact CE2-CG1 4.24Å; F97-I247 HydrophobicContact CD2-CG1 4.49Å |
| 98 | F | 91.1 | Very high | 88.3 | Confident | 38 Ų | 38 | 53.8 Ų | 53.8 | 17% | 0.167 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -61.4 | -52.7 | 170.7 | 171.1 | -98.2 | 0 | 0 | 0 | 111.7 | W90 H94 F96 F100 T101 V102 I111 P113 M122 | W90-F98 HydrophobicContact CH2-CD1 4.05Å; W90-F98 HydrophobicContact CH2-CD2 4.33Å; W90-F98 HydrophobicContact CH2-CE1 4.3Å; W90-F98 HydrophobicContact CH2-CG 4.07Å; W90-F98 HydrophobicContact CZ3-CB 4.26Å; W90-F98 AromaticContact CZ3-CD1 3.93Å; W90-F98 HydrophobicContact CZ3-CD1 3.93Å; W90-F98 HydrophobicContact CZ3-CG 4.02Å; H94-F98 WeakPolarHBondContact O-CB 3.27Å; H94-F98 PolarHBondContact O-N 3.44Å; F96-F98 VanDerWaalsContact C-N 3.34Å; F96-F98 PolarHBondContact O-N 3.03Å; F98-F100 VanDerWaalsContact C-N 3.26Å; F98-F100 PolarHBondContact O-N 3.17Å; F98-T101 WeakPolarHBondContact CA-OG1 3.38Å; F98-T101 PolarHBondContact O-N 3.4Å; F98-T101 PolarHBondContact O-OG1 3.09Å; F98-T101 VanDerWaalsContact O-OG1 3.06Å; F98-V102 HydrophobicContact CD2-CG2 4.41Å; F98-V102 HydrophobicContact CE1-CG2 4.08Å; F98-V102 HydrophobicContact CE2-CG2 3.89Å; F98-V102 HydrophobicContact CZ-CG2 3.69Å; F98-V102 WeakPolarHBondContact O-CG2 3.38Å; F98-V102 PolarHBondContact O-N 3.33Å; F98-I111 HydrophobicContact CD2-CG2 4.5Å; F98-I111 WeakPolarHBondContact CD2-O 3.38Å; F98-I111 WeakPolarHBondContact CE2-O 3.35Å; F98-P113 HydrophobicContact CZ-CG 4.22Å; F98-M122 HydrophobicContact CE1-CG 4.4Å; F98-M122 HydrophobicContact CZ-CG 4.02Å |
| 99 | A | 92.9 | Very high | 89 | Confident | 24 Ų | 24 | 46.9 Ų | 46.9 | 20% | 0.198 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -59.3 | -39.4 | 178.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | A95 F96 C103 Y125 | A95-A99 WeakPolarHBondContact O-CB 3.42Å; A95-A99 PolarHBondContact O-N 3.37Å; F96-A99 PolarHBondContact O-N 2.83Å; A99-C103 PolarHBondContact O-N 2.89Å; A99-C103 PolarHBondContact O-SG 3.05Å; A99-Y125 HydrophobicContact CB-CE1 3.89Å; A99-Y125 WeakPolarHBondContact O-CE1 3.04Å |
| 100 | F | 91.6 | Very high | 89.4 | Confident | 24 Ų | 24 | 46.9 Ų | 46.9 | 11% | 0.105 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -67.6 | -43 | 176.2 | -179.1 | -123.2 | 0 | 0 | 0 | 113.1 | F96 F97 F98 V102 C103 S104 I247 F250 I251 | F96-F100 HydrophobicContact CE1-CB 4.5Å; F96-F100 VanDerWaalsContact O-CB 3.25Å; F96-F100 WeakPolarHBondContact O-CB 3.42Å; F96-F100 PolarHBondContact O-N 3.3Å; F97-F100 PolarHBondContact O-N 3.05Å; F98-F100 VanDerWaalsContact C-N 3.26Å; F98-F100 PolarHBondContact O-N 3.17Å; F100-V102 VanDerWaalsContact C-N 3.35Å; F100-C103 PolarHBondContact O-N 2.78Å; F100-C103 VanDerWaalsContact O-N 3.17Å; F100-S104 PolarHBondContact O-N 3.25Å; F100-S104 PolarHBondContact O-OG 3.09Å; F100-I247 HydrophobicContact CE1-CG2 4.27Å; F100-F250 HydrophobicContact CD1-CD1 4.43Å; F100-F250 AromaticContact CE1-CD1 3.25Å; F100-F250 HydrophobicContact CE1-CD1 3.25Å; F100-F250 AromaticContact CE1-CE1 3.63Å; F100-F250 HydrophobicContact CE1-CE1 3.63Å; F100-F250 HydrophobicContact CE1-CG 4.08Å; F100-F250 AromaticContact CZ-CD1 3.39Å; F100-F250 HydrophobicContact CZ-CD1 3.39Å; F100-F250 AromaticContact CZ-CE1 3.65Å; F100-F250 HydrophobicContact CZ-CE1 3.65Å; F100-I251 HydrophobicContact CE1-CG1 4.31Å; F100-I251 HydrophobicContact CE2-CD1 4.38Å; F100-I251 HydrophobicContact CE2-CG1 3.94Å; F100-I251 HydrophobicContact CZ-CD1 4.14Å; F100-I251 HydrophobicContact CZ-CG1 3.41Å; F100-I251 VanDerWaalsContact CZ-CG1 3.41Å |
| 101 | T | 92 | Very high | 89.5 | Confident | 7 Ų | 7 | 42.9 Ų | 42.9 | 4% | 0.043 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -72.1 | -25.8 | 178.4 | 50.4 | 0 | 0 | 0 | 0 | 113.5 | F97 F98 S104 T105 V106 G107 Y108 | F97-T101 HydrophobicContact CD1-CG2 4.2Å; F97-T101 HydrophobicContact CE1-CG2 3.95Å; F97-T101 HydrophobicContact CE2-CG2 4.49Å; F97-T101 HydrophobicContact CZ-CG2 4.12Å; F97-T101 WeakPolarHBondContact O-CB 3.27Å; F97-T101 VanDerWaalsContact O-CG2 3.28Å; F97-T101 WeakPolarHBondContact O-CG2 3.34Å; F97-T101 PolarHBondContact O-N 3.45Å; F97-T101 PolarHBondContact O-OG1 2.85Å; F98-T101 WeakPolarHBondContact CA-OG1 3.38Å; F98-T101 PolarHBondContact O-N 3.4Å; F98-T101 PolarHBondContact O-OG1 3.09Å; F98-T101 VanDerWaalsContact O-OG1 3.06Å; T101-S104 WeakPolarHBondContact CA-OG 3.22Å; T101-S104 PolarHBondContact O-OG 3.5Å; T101-T105 PolarHBondContact O-N 3.19Å; T101-V106 PolarHBondContact O-N 2.93Å; T101-V106 VanDerWaalsContact O-N 3.09Å; T101-G107 PolarHBondContact O-N 3.06Å; T101-Y108 HydrophobicContact CG2-CD2 3.77Å; T101-Y108 HydrophobicContact CG2-CE2 3.65Å |
| 102 | V | 93.7 | Very high | 89.7 | Confident | 20 Ų | 20 | 43.1 Ų | 43.1 | 12% | 0.121 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -66.1 | -48 | 164.4 | 168.8 | 0 | 0 | 0 | 0 | 110.6 | F98 F100 S104 T105 M122 Y125 | F98-V102 HydrophobicContact CD2-CG2 4.41Å; F98-V102 HydrophobicContact CE1-CG2 4.08Å; F98-V102 HydrophobicContact CE2-CG2 3.89Å; F98-V102 HydrophobicContact CZ-CG2 3.69Å; F98-V102 WeakPolarHBondContact O-CG2 3.38Å; F98-V102 PolarHBondContact O-N 3.33Å; F100-V102 VanDerWaalsContact C-N 3.35Å; V102-S104 VanDerWaalsContact C-N 3.31Å; V102-S104 PolarHBondContact O-N 3.01Å; V102-T105 PolarHBondContact O-N 3.21Å; V102-M122 HydrophobicContact CG1-CG 4.4Å; V102-M122 HydrophobicContact CG2-CG 4.29Å; V102-Y125 HydrophobicContact CG1-CD1 4.23Å |
| 103 | C | 93.4 | Very high | 89.9 | Confident | 13 Ų | 13 | 35.2 Ų | 35.2 | 9% | 0.088 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -66.3 | -29.2 | 178.7 | -70.9 | 0 | 0 | 0 | 0 | 113.9 | A99 F100 T105 Y125 N133 | A99-C103 PolarHBondContact O-N 2.89Å; A99-C103 PolarHBondContact O-SG 3.05Å; F100-C103 PolarHBondContact O-N 2.78Å; F100-C103 VanDerWaalsContact O-N 3.17Å; C103-T105 VanDerWaalsContact C-N 3.33Å; C103-Y125 WeakPolarHBondContact SG-CE1 3.23Å; C103-Y125 PolarHBondContact SG-OH 3.46Å; C103-N133 HydrophobicContact CB-CB 4.29Å; C103-N133 WeakPolarHBondContact O-CB 3.42Å; C103-N133 PolarHBondContact O-ND2 3.27Å |
| 104 | S | 91.3 | Very high | 90.2 | Very high | 2 Ų | 2 | 38.8 Ų | 38.8 | 1% | 0.014 | 24% | 0.243 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -89.3 | 2.8 | 177.6 | 65.2 | 0 | 0 | 0 | 0 | 113.8 | F100 T101 V102 V106 N133 F250 | F100-S104 PolarHBondContact O-N 3.25Å; F100-S104 PolarHBondContact O-OG 3.09Å; T101-S104 WeakPolarHBondContact CA-OG 3.22Å; T101-S104 PolarHBondContact O-OG 3.5Å; V102-S104 VanDerWaalsContact C-N 3.31Å; V102-S104 PolarHBondContact O-N 3.01Å; S104-V106 PolarHBondContact O-N 3.4Å; S104-N133 VanDerWaalsContact CA-ND2 3.34Å; S104-N133 WeakPolarHBondContact CA-ND2 3.48Å; S104-N133 PolarHBondContact N-ND2 3.1Å; S104-F250 WeakPolarHBondContact OG-CZ 3.12Å |
| 105 | T | 93.3 | Very high | 90.6 | Very high | 85 Ų | 85 | 41 Ų | 41 | 52% | 0.521 | 26% | 0.259 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 57.6 | 22.3 | -178.6 | 57.1 | 0 | 0 | 0 | 0 | 114.9 | T101 V102 C103 I130 | T101-T105 PolarHBondContact O-N 3.19Å; V102-T105 PolarHBondContact O-N 3.21Å; C103-T105 VanDerWaalsContact C-N 3.33Å; T105-I130 HydrophobicContact CG2-CD1 3.65Å; T105-I130 HydrophobicContact CG2-CG1 3.75Å; T105-I130 HydrophobicContact CG2-CG2 3.97Å |
| 106 | V | 92.3 | Very high | 90.7 | Very high | 8 Ų | 8 | 46.9 Ų | 46.9 | 5% | 0.048 | 28% | 0.278 | C | S | . | . | trans | -89 | -39.9 | 176 | -178 | 0 | 0 | 0 | 0 | 111.6 | T101 S104 Y108 T217 F250 | T101-V106 PolarHBondContact O-N 2.93Å; T101-V106 VanDerWaalsContact O-N 3.09Å; S104-V106 PolarHBondContact O-N 3.4Å; V106-Y108 HydrophobicContact CG1-CD1 4.2Å; V106-Y108 HydrophobicContact CG1-CD2 4.47Å; V106-Y108 HydrophobicContact CG1-CE1 3.92Å; V106-Y108 HydrophobicContact CG1-CE2 4.19Å; V106-Y108 HydrophobicContact CG1-CG 4.49Å; V106-Y108 PolarHBondContact O-N 3.31Å; V106-T217 HydrophobicContact CG2-CG2 3.6Å; V106-F250 HydrophobicContact CB-CZ 4.38Å; V106-F250 HydrophobicContact CG2-CE2 3.89Å; V106-F250 HydrophobicContact CG2-CZ 3.52Å | ||
| 107 | G | 90.5 | Very high | 90.9 | Very high | 44 Ų | 44 | 44.8 Ų | 44.8 | 45% | 0.454 | 28% | 0.28 | S | S | . | . | trans | 43.2 | 55.3 | 164.9 | 0 | 0 | 0 | 0 | 0 | 116.6 | T101 G109 | T101-G107 PolarHBondContact O-N 3.06Å; G107-G109 PolarHBondContact O-N 3.29Å | ||
| 108 | Y | 89.4 | Confident | 91.1 | Very high | 10 Ų | 10 | 45 Ų | 45 | 4% | 0.039 | 29% | 0.286 | C | S | . | . | trans | -47.6 | -16.6 | -174.6 | -64.1 | -72.8 | 0 | 0 | 0 | 117.1 | F97 T101 V106 N110 Y210 T214 G219 G221 V224 | F97-Y108 AromaticContact CE1-CD2 3.92Å; F97-Y108 HydrophobicContact CE1-CD2 3.92Å; F97-Y108 AromaticContact CE1-CE2 3.71Å; F97-Y108 HydrophobicContact CE1-CE2 3.71Å; F97-Y108 HydrophobicContact CZ-CD2 4.34Å; F97-Y108 AromaticContact CZ-CE2 3.66Å; F97-Y108 HydrophobicContact CZ-CE2 3.66Å; T101-Y108 HydrophobicContact CG2-CD2 3.77Å; T101-Y108 HydrophobicContact CG2-CE2 3.65Å; V106-Y108 HydrophobicContact CG1-CD1 4.2Å; V106-Y108 HydrophobicContact CG1-CD2 4.47Å; V106-Y108 HydrophobicContact CG1-CE1 3.92Å; V106-Y108 HydrophobicContact CG1-CE2 4.19Å; V106-Y108 HydrophobicContact CG1-CG 4.49Å; V106-Y108 PolarHBondContact O-N 3.31Å; Y108-N110 PolarHBondContact O-N 3.2Å; Y108-Y210 HydrophobicContact CE1-CE2 4.13Å; Y108-Y210 PolarHBondContact OH-OH 3.11Å; Y108-Y210 VanDerWaalsContact OH-OH 3.04Å; Y108-T214 WeakPolarHBondContact OH-CB 3.15Å; Y108-T214 WeakPolarHBondContact OH-CG2 2.97Å; Y108-T214 PolarHBondContact OH-OG1 2.92Å; Y108-G219 WeakPolarHBondContact CA-O 3.48Å; Y108-G221 WeakPolarHBondContact O-CA 3.36Å; Y108-V224 HydrophobicContact CD1-CG2 3.95Å; Y108-V224 HydrophobicContact CD2-CG2 4.34Å; Y108-V224 HydrophobicContact CE1-CG2 4.42Å; Y108-V224 HydrophobicContact CG-CG2 3.88Å | ||
| 109 | G | 86.4 | Confident | 91.3 | Very high | 49 Ų | 49 | 49.2 Ų | 49.2 | 51% | 0.505 | 30% | 0.301 | S | S | . | . | S | Bend | trans | 74.1 | -21.3 | 175.3 | 0 | 0 | 0 | 0 | 0 | 115.7 | G107 I111 | G107-G109 PolarHBondContact O-N 3.29Å; G109-I111 PolarHBondContact O-N 2.87Å; G109-I111 VanDerWaalsContact O-N 3.14Å |
| 110 | N | 84.3 | Confident | 91.5 | Very high | 89 Ų | 89 | 52.2 Ų | 52.2 | 48% | 0.476 | 31% | 0.312 | S | S | . | . | S | Bend | trans | -53.1 | -32.5 | 176.4 | 74 | -39.2 | 0 | 0 | 0 | 113.4 | Y108 V224 | Y108-N110 PolarHBondContact O-N 3.2Å; N110-V224 HydrophobicContact CB-CG2 4.43Å |
| 111 | I | 86.2 | Confident | 91.7 | Very high | 29 Ų | 29 | 56.7 Ų | 56.7 | 15% | 0.149 | 34% | 0.336 | C | S | . | . | S | Bend | trans | -124.4 | 125.8 | 169.2 | -60.1 | 178.8 | 0 | 0 | 0 | 107.6 | W90 H94 F98 G109 | W90-I111 HydrophobicContact CD2-CG2 4.15Å; W90-I111 HydrophobicContact CE3-CG2 4.17Å; W90-I111 HydrophobicContact CH2-CG2 3.46Å; W90-I111 VanDerWaalsContact CH2-CG2 3.46Å; W90-I111 HydrophobicContact CZ2-CG2 3.41Å; W90-I111 VanDerWaalsContact CZ2-CG2 3.41Å; W90-I111 HydrophobicContact CZ3-CG2 3.84Å; H94-I111 HydrophobicContact CB-CD1 3.94Å; F98-I111 HydrophobicContact CD2-CG2 4.5Å; F98-I111 WeakPolarHBondContact CD2-O 3.38Å; F98-I111 WeakPolarHBondContact CE2-O 3.35Å; G109-I111 PolarHBondContact O-N 2.87Å; G109-I111 VanDerWaalsContact O-N 3.14Å |
| 112 | S | 89 | Confident | 91.8 | Very high | 65 Ų | 65 | 59 Ų | 59 | 46% | 0.455 | 35% | 0.347 | S | S | . | . | trans | -148.1 | 149.8 | 178.9 | 63.6 | 0 | 0 | 0 | 0 | 112.2 | T114 | S112-T114 PolarHBondContact O-N 2.77Š| ||
| 113 | P | 90.9 | Very high | 91.9 | Very high | 15 Ų | 15 | 62.1 Ų | 62.1 | 10% | 0.097 | 36% | 0.362 | C | S | . | . | trans | -69.1 | 115.8 | -176.9 | 25.4 | -33.3 | 0 | 0 | 0 | 111.1 | F98 R119 M122 | F98-P113 HydrophobicContact CZ-CG 4.22Å; P113-R119 HydrophobicContact CB-CG 4.23Å; P113-R119 HydrophobicContact CG-CG 4Å; P113-R119 VanDerWaalsContact O-CG 3.31Å; P113-R119 WeakPolarHBondContact O-CG 3.28Å; P113-R119 PolarHBondContact O-NE 3.28Å; P113-M122 HydrophobicContact CG-CB 4.28Å; P113-M122 HydrophobicContact CG-CE 4.38Å | ||
| 114 | T | 90.1 | Very high | 92 | Very high | 105 Ų | 105 | 64.4 Ų | 64.4 | 64% | 0.644 | 38% | 0.382 | S | S | * | . | trans | -74.6 | -36.3 | 174.7 | 51.6 | 0 | 0 | 0 | 0 | 111.9 | S112 | S112-T114 PolarHBondContact O-N 2.77Š| ||
| 115 | T | 93.6 | Very high | 92.3 | Very high | 82 Ų | 82 | 69.3 Ų | 69.3 | 50% | 0.503 | 40% | 0.401 | S | S | . | . | S | Bend | trans | -75 | 145.4 | -176.7 | 66.7 | 0 | 0 | 0 | 0 | 112.8 | A117 G118 R119 | T115-A117 PolarHBondContact O-N 2.76Å; T115-G118 PolarHBondContact O-N 3.33Å; T115-G118 PolarHBondContact OG1-N 2.84Å; T115-G118 VanDerWaalsContact OG1-N 3.11Å; T115-R119 WeakPolarHBondContact O-CG 3.44Å; T115-R119 PolarHBondContact O-N 2.9Å |
| 116 | F | 93.9 | Very high | 92.3 | Very high | 158 Ų | 158 | 66.4 Ų | 66.4 | 69% | 0.693 | 38% | 0.384 | S | S | * | . | H | α-helix | trans | -57.9 | -46.5 | 175.6 | 177.8 | -98.6 | 0 | 0 | 0 | 112 | G118 R119 M120 | F116-G118 PolarHBondContact O-N 3.39Å; F116-R119 PolarHBondContact O-N 3.04Å; F116-M120 HydrophobicContact CD1-CG 4.21Å; F116-M120 HydrophobicContact CD2-CE 4.45Å; F116-M120 HydrophobicContact CE1-CG 3.75Å; F116-M120 HydrophobicContact CE2-CE 3.96Å; F116-M120 HydrophobicContact CE2-CG 4.19Å; F116-M120 HydrophobicContact CE2-SD 4.22Å; F116-M120 HydrophobicContact CZ-CE 4.31Å; F116-M120 HydrophobicContact CZ-CG 3.73Å; F116-M120 HydrophobicContact CZ-SD 3.95Å; F116-M120 WeakPolarHBondContact O-CG 3.21Å; F116-M120 PolarHBondContact O-N 3.07Å |
| 117 | A | 94.8 | Very high | 92.5 | Very high | 59 Ų | 59 | 70.8 Ų | 70.8 | 49% | 0.488 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -59.6 | -44.6 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | T115 R119 M120 I121 | T115-A117 PolarHBondContact O-N 2.76Å; A117-R119 VanDerWaalsContact C-N 3.31Å; A117-R119 PolarHBondContact O-N 3.2Å; A117-M120 PolarHBondContact O-N 2.87Å; A117-I121 WeakPolarHBondContact O-CB 3.4Å; A117-I121 VanDerWaalsContact O-CG1 3.28Å; A117-I121 WeakPolarHBondContact O-CG1 3.27Å; A117-I121 PolarHBondContact O-N 3.41Å |
| 118 | G | 93.6 | Very high | 92.8 | Very high | 20 Ų | 20 | 74.3 Ų | 74.3 | 21% | 0.206 | 42% | 0.418 | C | S | . | . | H | α-helix | trans | -61 | -38 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.9 | T115 F116 M122 | T115-G118 PolarHBondContact O-N 3.33Å; T115-G118 PolarHBondContact OG1-N 2.84Å; T115-G118 VanDerWaalsContact OG1-N 3.11Å; F116-G118 PolarHBondContact O-N 3.39Å; G118-M122 WeakPolarHBondContact O-CB 3.37Å; G118-M122 PolarHBondContact O-N 3.45Å |
| 119 | R | 94.7 | Very high | 93 | Very high | 126 Ų | 126 | 74.3 Ų | 74.3 | 48% | 0.475 | 42% | 0.42 | S | S | . | . | H | α-helix | trans | -65.7 | -45.5 | 174.4 | -68.7 | 169.7 | -177 | -176.9 | -0.4 | 112.1 | P113 T115 F116 A117 M122 I123 | P113-R119 HydrophobicContact CB-CG 4.23Å; P113-R119 HydrophobicContact CG-CG 4Å; P113-R119 VanDerWaalsContact O-CG 3.31Å; P113-R119 WeakPolarHBondContact O-CG 3.28Å; P113-R119 PolarHBondContact O-NE 3.28Å; T115-R119 WeakPolarHBondContact O-CG 3.44Å; T115-R119 PolarHBondContact O-N 2.9Å; F116-R119 PolarHBondContact O-N 3.04Å; A117-R119 VanDerWaalsContact C-N 3.31Å; A117-R119 PolarHBondContact O-N 3.2Å; R119-M122 PolarHBondContact O-N 2.92Å; R119-I123 WeakPolarHBondContact O-CG1 3.41Å; R119-I123 PolarHBondContact O-N 3.45Å |
| 120 | M | 96.6 | Very high | 93.4 | Very high | 87 Ų | 87 | 75.3 Ų | 75.3 | 43% | 0.429 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -64.7 | -42.5 | 178.2 | -65.1 | -57.7 | 103.8 | 0 | 0 | 112.1 | F116 A117 I123 A124 | F116-M120 HydrophobicContact CD1-CG 4.21Å; F116-M120 HydrophobicContact CD2-CE 4.45Å; F116-M120 HydrophobicContact CE1-CG 3.75Å; F116-M120 HydrophobicContact CE2-CE 3.96Å; F116-M120 HydrophobicContact CE2-CG 4.19Å; F116-M120 HydrophobicContact CE2-SD 4.22Å; F116-M120 HydrophobicContact CZ-CE 4.31Å; F116-M120 HydrophobicContact CZ-CG 3.73Å; F116-M120 HydrophobicContact CZ-SD 3.95Å; F116-M120 WeakPolarHBondContact O-CG 3.21Å; F116-M120 PolarHBondContact O-N 3.07Å; A117-M120 PolarHBondContact O-N 2.87Å; M120-I123 HydrophobicContact CE-CD1 3.84Å; M120-I123 PolarHBondContact O-N 3.41Å; M120-A124 PolarHBondContact O-N 3.09Å; M120-A124 VanDerWaalsContact O-N 3.11Å |
| 121 | I | 95.6 | Very high | 94 | Very high | 117 Ų | 117 | 74.7 Ų | 74.7 | 60% | 0.6 | 41% | 0.414 | S | S | * | . | H | α-helix | trans | -63.8 | -43.6 | 175.5 | -68 | 165.8 | 0 | 0 | 0 | 110.7 | A117 I123 A124 Y125 | A117-I121 WeakPolarHBondContact O-CB 3.4Å; A117-I121 VanDerWaalsContact O-CG1 3.28Å; A117-I121 WeakPolarHBondContact O-CG1 3.27Å; A117-I121 PolarHBondContact O-N 3.41Å; I121-I123 VanDerWaalsContact C-N 3.35Å; I121-I123 PolarHBondContact O-N 2.75Å; I121-A124 PolarHBondContact O-N 3.3Å; I121-Y125 WeakPolarHBondContact O-CB 3.5Å; I121-Y125 PolarHBondContact O-N 3.22Å |
| 122 | M | 94.8 | Very high | 94.4 | Very high | 56 Ų | 56 | 77.7 Ų | 77.7 | 28% | 0.276 | 43% | 0.434 | S | S | . | . | H | α-helix | trans | -59.9 | -41.8 | 176.7 | 175.7 | -83.5 | -68.8 | 0 | 0 | 112.2 | F98 V102 P113 G118 R119 Y125 S126 | F98-M122 HydrophobicContact CE1-CG 4.4Å; F98-M122 HydrophobicContact CZ-CG 4.02Å; V102-M122 HydrophobicContact CG1-CG 4.4Å; V102-M122 HydrophobicContact CG2-CG 4.29Å; P113-M122 HydrophobicContact CG-CB 4.28Å; P113-M122 HydrophobicContact CG-CE 4.38Å; G118-M122 WeakPolarHBondContact O-CB 3.37Å; G118-M122 PolarHBondContact O-N 3.45Å; R119-M122 PolarHBondContact O-N 2.92Å; M122-Y125 PolarHBondContact O-N 3.31Å; M122-S126 WeakPolarHBondContact O-CB 3.36Å; M122-S126 PolarHBondContact O-N 2.78Å |
| 123 | I | 95.7 | Very high | 94.5 | Very high | 85 Ų | 85 | 75.2 Ų | 75.2 | 44% | 0.436 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -60.5 | -54.2 | 175 | -68.9 | 163.9 | 0 | 0 | 0 | 110.2 | R119 M120 I121 Y125 S126 V127 | R119-I123 WeakPolarHBondContact O-CG1 3.41Å; R119-I123 PolarHBondContact O-N 3.45Å; M120-I123 HydrophobicContact CE-CD1 3.84Å; M120-I123 PolarHBondContact O-N 3.41Å; I121-I123 VanDerWaalsContact C-N 3.35Å; I121-I123 PolarHBondContact O-N 2.75Å; I123-Y125 VanDerWaalsContact C-N 3.28Å; I123-Y125 PolarHBondContact O-N 3.39Å; I123-S126 PolarHBondContact O-N 3.13Å; I123-S126 VanDerWaalsContact O-N 3.15Å; I123-S126 PolarHBondContact O-OG 3.01Å; I123-V127 WeakPolarHBondContact O-CG2 3.26Å; I123-V127 PolarHBondContact O-N 3.38Å |
| 124 | A | 95.9 | Very high | 94.6 | Very high | 62 Ų | 62 | 76.3 Ų | 76.3 | 51% | 0.512 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -59.9 | -38.5 | -179.4 | 0 | 0 | 0 | 0 | 0 | 112.7 | M120 I121 | M120-A124 PolarHBondContact O-N 3.09Å; M120-A124 VanDerWaalsContact O-N 3.11Å; I121-A124 PolarHBondContact O-N 3.3Å |
| 125 | Y | 95.8 | Very high | 94.7 | Very high | 105 Ų | 105 | 77.3 Ų | 77.3 | 41% | 0.412 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -65.2 | -44.7 | 174.7 | 177.3 | -105.4 | 0 | 0 | 0 | 112.1 | A99 V102 C103 I121 M122 I123 V127 I128 G129 | A99-Y125 HydrophobicContact CB-CE1 3.89Å; A99-Y125 WeakPolarHBondContact O-CE1 3.04Å; V102-Y125 HydrophobicContact CG1-CD1 4.23Å; C103-Y125 WeakPolarHBondContact SG-CE1 3.23Å; C103-Y125 PolarHBondContact SG-OH 3.46Å; I121-Y125 WeakPolarHBondContact O-CB 3.5Å; I121-Y125 PolarHBondContact O-N 3.22Å; M122-Y125 PolarHBondContact O-N 3.31Å; I123-Y125 VanDerWaalsContact C-N 3.28Å; I123-Y125 PolarHBondContact O-N 3.39Å; Y125-V127 VanDerWaalsContact C-N 3.32Å; Y125-V127 PolarHBondContact O-N 3.31Å; Y125-I128 PolarHBondContact O-N 3.19Å; Y125-G129 PolarHBondContact O-N 3.27Å |
| 126 | S | 95.3 | Very high | 94.7 | Very high | 23 Ų | 23 | 77.3 Ų | 77.3 | 16% | 0.161 | 43% | 0.426 | C | S | . | . | H | α-helix | trans | -61.1 | -38 | -179.6 | 76.7 | 0 | 0 | 0 | 0 | 113 | M122 I123 I128 G129 I130 | M122-S126 WeakPolarHBondContact O-CB 3.36Å; M122-S126 PolarHBondContact O-N 2.78Å; I123-S126 PolarHBondContact O-N 3.13Å; I123-S126 VanDerWaalsContact O-N 3.15Å; I123-S126 PolarHBondContact O-OG 3.01Å; S126-I128 PolarHBondContact O-N 2.69Å; S126-G129 PolarHBondContact O-N 3.27Å; S126-I130 WeakPolarHBondContact O-CB 3.37Å; S126-I130 VanDerWaalsContact O-CG1 3.3Å; S126-I130 WeakPolarHBondContact O-CG1 3.48Å; S126-I130 PolarHBondContact O-N 2.86Å |
| 127 | V | 95.9 | Very high | 94.6 | Very high | 100 Ų | 100 | 70.4 Ų | 70.4 | 61% | 0.606 | 40% | 0.396 | S | S | * | . | H | α-helix | trans | -61.7 | -31.3 | -179.9 | 170.1 | 0 | 0 | 0 | 0 | 112.4 | I123 Y125 P131 | I123-V127 WeakPolarHBondContact O-CG2 3.26Å; I123-V127 PolarHBondContact O-N 3.38Å; Y125-V127 VanDerWaalsContact C-N 3.32Å; Y125-V127 PolarHBondContact O-N 3.31Å; V127-P131 VanDerWaalsContact O-CD 3.26Å; V127-P131 WeakPolarHBondContact O-CD 3.4Å; V127-P131 WeakPolarHBondContact O-CG 3.44Å |
| 128 | I | 95.9 | Very high | 94.4 | Very high | 119 Ų | 119 | 70 Ų | 70 | 61% | 0.61 | 39% | 0.393 | S | S | * | . | H | α-helix | trans | -94.3 | -40.9 | 177.2 | -57.4 | 176 | 0 | 0 | 0 | 110.7 | Y125 S126 P131 V132 | Y125-I128 PolarHBondContact O-N 3.19Å; S126-I128 PolarHBondContact O-N 2.69Å; I128-P131 WeakPolarHBondContact O-CD 3.24Å; I128-V132 HydrophobicContact CG2-CG2 4.44Å; I128-V132 VanDerWaalsContact O-CG2 3.31Å; I128-V132 WeakPolarHBondContact O-CG2 3.49Å; I128-V132 PolarHBondContact O-N 3.47Å |
| 129 | G | 94.8 | Very high | 94.3 | Very high | 9 Ų | 9 | 71.2 Ų | 71.2 | 9% | 0.093 | 41% | 0.405 | C | S | . | . | H | α-helix | trans | -64.8 | -44.5 | -175.4 | 0 | 0 | 0 | 0 | 0 | 113.7 | Y125 S126 V132 N133 | Y125-G129 PolarHBondContact O-N 3.27Å; S126-G129 PolarHBondContact O-N 3.27Å; G129-V132 PolarHBondContact O-N 3.21Å; G129-N133 WeakPolarHBondContact O-CB 3.14Å; G129-N133 PolarHBondContact O-N 2.98Å |
| 130 | I | 94.8 | Very high | 94.2 | Very high | 70 Ų | 70 | 66.5 Ų | 66.5 | 36% | 0.359 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -63 | -47.9 | -177.6 | -64 | 166.5 | 0 | 0 | 0 | 111.5 | T105 S126 V132 N133 G134 | T105-I130 HydrophobicContact CG2-CD1 3.65Å; T105-I130 HydrophobicContact CG2-CG1 3.75Å; T105-I130 HydrophobicContact CG2-CG2 3.97Å; S126-I130 WeakPolarHBondContact O-CB 3.37Å; S126-I130 VanDerWaalsContact O-CG1 3.3Å; S126-I130 WeakPolarHBondContact O-CG1 3.48Å; S126-I130 PolarHBondContact O-N 2.86Å; I130-V132 PolarHBondContact O-N 2.76Å; I130-N133 PolarHBondContact O-N 3.15Å; I130-G134 PolarHBondContact O-N 3Å |
| 131 | P | 95.6 | Very high | 94 | Very high | 77 Ų | 77 | 62.5 Ų | 62.5 | 50% | 0.5 | 37% | 0.37 | S | S | . | . | H | α-helix | trans | -58.5 | -42.8 | 171.7 | -27.7 | 35.6 | 0 | 0 | 0 | 114.5 | V127 I128 G134 I135 | V127-P131 VanDerWaalsContact O-CD 3.26Å; V127-P131 WeakPolarHBondContact O-CD 3.4Å; V127-P131 WeakPolarHBondContact O-CG 3.44Å; I128-P131 WeakPolarHBondContact O-CD 3.24Å; P131-G134 PolarHBondContact O-N 3.44Å; P131-I135 WeakPolarHBondContact O-CG1 3.45Å; P131-I135 PolarHBondContact O-N 3.05Å |
| 132 | V | 94.6 | Very high | 93.7 | Very high | 92 Ų | 92 | 61.6 Ų | 61.6 | 56% | 0.558 | 36% | 0.363 | S | S | * | . | H | α-helix | trans | -63.5 | -43.9 | 179.4 | 169.2 | 0 | 0 | 0 | 0 | 110.9 | I128 G129 I130 I135 L136 | I128-V132 HydrophobicContact CG2-CG2 4.44Å; I128-V132 VanDerWaalsContact O-CG2 3.31Å; I128-V132 WeakPolarHBondContact O-CG2 3.49Å; I128-V132 PolarHBondContact O-N 3.47Å; G129-V132 PolarHBondContact O-N 3.21Å; I130-V132 PolarHBondContact O-N 2.76Å; V132-I135 PolarHBondContact O-N 3.42Å; V132-L136 PolarHBondContact O-N 3.41Å; V132-L136 VanDerWaalsContact O-N 3.1Å |
| 133 | N | 92.6 | Very high | 93.5 | Very high | 12 Ų | 12 | 65.7 Ų | 65.7 | 6% | 0.064 | 38% | 0.377 | C | S | . | . | H | α-helix | trans | -70 | -35.9 | 178.6 | -147.9 | 20.1 | 0 | 0 | 0 | 111.7 | C103 S104 G129 I130 I135 L136 F137 | C103-N133 HydrophobicContact CB-CB 4.29Å; C103-N133 WeakPolarHBondContact O-CB 3.42Å; C103-N133 PolarHBondContact O-ND2 3.27Å; S104-N133 VanDerWaalsContact CA-ND2 3.34Å; S104-N133 WeakPolarHBondContact CA-ND2 3.48Å; S104-N133 PolarHBondContact N-ND2 3.1Å; G129-N133 WeakPolarHBondContact O-CB 3.14Å; G129-N133 PolarHBondContact O-N 2.98Å; I130-N133 PolarHBondContact O-N 3.15Å; N133-I135 VanDerWaalsContact C-N 3.32Å; N133-I135 PolarHBondContact O-N 2.95Å; N133-L136 WeakPolarHBondContact O-CB 3.26Å; N133-L136 PolarHBondContact O-N 2.88Å; N133-L136 VanDerWaalsContact O-N 3.15Å; N133-F137 HydrophobicContact CB-CE2 4.13Å; N133-F137 VanDerWaalsContact CG-CZ 3.5Å; N133-F137 VanDerWaalsContact ND2-CE2 3.27Å; N133-F137 WeakPolarHBondContact ND2-CE2 3.5Å; N133-F137 WeakPolarHBondContact ND2-CZ 3.37Å; N133-F137 WeakPolarHBondContact O-CD2 3.42Å; N133-F137 WeakPolarHBondContact O-CG 3.3Å; N133-F137 PolarHBondContact O-N 2.92Å; N133-F137 VanDerWaalsContact OD1-CZ 3.27Å; N133-F137 WeakPolarHBondContact OD1-CZ 3.31Å |
| 134 | G | 91.6 | Very high | 93.2 | Very high | 39 Ų | 39 | 63 Ų | 63 | 40% | 0.402 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -59.5 | -39.2 | 171.2 | 0 | 0 | 0 | 0 | 0 | 113.2 | I130 P131 A138 | I130-G134 PolarHBondContact O-N 3Å; P131-G134 PolarHBondContact O-N 3.44Å; G134-A138 VanDerWaalsContact O-CB 3.32Å; G134-A138 WeakPolarHBondContact O-CB 3.28Å; G134-A138 PolarHBondContact O-N 3.3Å |
| 135 | I | 93 | Very high | 92.8 | Very high | 126 Ų | 126 | 60.4 Ų | 60.4 | 65% | 0.646 | 34% | 0.341 | S | S | * | . | H | α-helix | trans | -66.3 | -41.5 | 173.3 | -66.9 | 163.8 | 0 | 0 | 0 | 110.9 | P131 V132 N133 A138 G139 | P131-I135 WeakPolarHBondContact O-CG1 3.45Å; P131-I135 PolarHBondContact O-N 3.05Å; V132-I135 PolarHBondContact O-N 3.42Å; N133-I135 VanDerWaalsContact C-N 3.32Å; N133-I135 PolarHBondContact O-N 2.95Å; I135-A138 PolarHBondContact O-N 3.37Å; I135-G139 PolarHBondContact O-N 2.89Å |
| 136 | L | 93.1 | Very high | 92.5 | Very high | 81 Ų | 81 | 62.8 Ų | 62.8 | 42% | 0.424 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -60.1 | -49.7 | 175.6 | 178.4 | 63.4 | 0 | 0 | 0 | 111.5 | V132 N133 A138 G139 L140 | V132-L136 PolarHBondContact O-N 3.41Å; V132-L136 VanDerWaalsContact O-N 3.1Å; N133-L136 WeakPolarHBondContact O-CB 3.26Å; N133-L136 PolarHBondContact O-N 2.88Å; N133-L136 VanDerWaalsContact O-N 3.15Å; L136-A138 PolarHBondContact O-N 3.39Å; L136-G139 PolarHBondContact O-N 2.9Å; L136-L140 HydrophobicContact CD1-CD1 4.18Å; L136-L140 HydrophobicContact CD1-CG 4.45Å; L136-L140 HydrophobicContact CG-CD1 4.02Å; L136-L140 WeakPolarHBondContact O-CG 3.38Å; L136-L140 PolarHBondContact O-N 2.81Å |
| 137 | F | 91.8 | Very high | 92.1 | Very high | 14 Ų | 14 | 64 Ų | 64 | 6% | 0.061 | 36% | 0.356 | C | S | . | . | H | α-helix | trans | -69.3 | -31.6 | 179.5 | -58.1 | -44.7 | 0 | 0 | 0 | 113.2 | N133 L140 G141 L254 V258 | N133-F137 HydrophobicContact CB-CE2 4.13Å; N133-F137 VanDerWaalsContact CG-CZ 3.5Å; N133-F137 VanDerWaalsContact ND2-CE2 3.27Å; N133-F137 WeakPolarHBondContact ND2-CE2 3.5Å; N133-F137 WeakPolarHBondContact ND2-CZ 3.37Å; N133-F137 WeakPolarHBondContact O-CD2 3.42Å; N133-F137 WeakPolarHBondContact O-CG 3.3Å; N133-F137 PolarHBondContact O-N 2.92Å; N133-F137 VanDerWaalsContact OD1-CZ 3.27Å; N133-F137 WeakPolarHBondContact OD1-CZ 3.31Å; F137-L140 HydrophobicContact CD1-CD1 4.21Å; F137-G141 PolarHBondContact O-N 3.23Å; F137-L254 HydrophobicContact CD1-CB 4.23Å; F137-L254 HydrophobicContact CD1-CG 4.17Å; F137-L254 HydrophobicContact CD2-CD2 4.11Å; F137-L254 HydrophobicContact CD2-CG 3.92Å; F137-L254 HydrophobicContact CE1-CB 3.95Å; F137-L254 HydrophobicContact CE1-CD2 4.16Å; F137-L254 HydrophobicContact CE1-CG 4Å; F137-L254 HydrophobicContact CE2-CD2 3.41Å; F137-L254 VanDerWaalsContact CE2-CD2 3.41Å; F137-L254 HydrophobicContact CE2-CG 3.71Å; F137-L254 HydrophobicContact CG-CG 4.16Å; F137-L254 HydrophobicContact CZ-CB 4.11Å; F137-L254 HydrophobicContact CZ-CD2 3.46Å; F137-L254 VanDerWaalsContact CZ-CD2 3.46Å; F137-L254 HydrophobicContact CZ-CG 3.77Å; F137-V258 HydrophobicContact CB-CB 4.45Å; F137-V258 HydrophobicContact CB-CG2 3.88Å |
| 138 | A | 90.3 | Very high | 91.6 | Very high | 51 Ų | 51 | 61.1 Ų | 61.1 | 42% | 0.421 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -63.2 | -44.1 | 170.2 | 0 | 0 | 0 | 0 | 0 | 111.6 | G134 I135 L136 G141 E142 | G134-A138 VanDerWaalsContact O-CB 3.32Å; G134-A138 WeakPolarHBondContact O-CB 3.28Å; G134-A138 PolarHBondContact O-N 3.3Å; I135-A138 PolarHBondContact O-N 3.37Å; L136-A138 PolarHBondContact O-N 3.39Å; A138-G141 PolarHBondContact O-N 3.48Å; A138-E142 PolarHBondContact O-N 2.95Å |
| 139 | G | 93.1 | Very high | 91 | Very high | 44 Ų | 44 | 58.8 Ų | 58.8 | 45% | 0.454 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -63.2 | -43.9 | 175.3 | 0 | 0 | 0 | 0 | 0 | 113.2 | I135 L136 E142 Y143 | I135-G139 PolarHBondContact O-N 2.89Å; L136-G139 PolarHBondContact O-N 2.9Å; G139-E142 PolarHBondContact O-N 3.24Å; G139-Y143 WeakPolarHBondContact O-CB 3.36Å; G139-Y143 PolarHBondContact O-N 3.49Å |
| 140 | L | 92.4 | Very high | 90.6 | Very high | 28 Ų | 28 | 60.2 Ų | 60.2 | 15% | 0.147 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -64.9 | -43.6 | 174.7 | -73.3 | 167.9 | 0 | 0 | 0 | 111.9 | L136 F137 E142 Y143 F144 I251 | L136-L140 HydrophobicContact CD1-CD1 4.18Å; L136-L140 HydrophobicContact CD1-CG 4.45Å; L136-L140 HydrophobicContact CG-CD1 4.02Å; L136-L140 WeakPolarHBondContact O-CG 3.38Å; L136-L140 PolarHBondContact O-N 2.81Å; F137-L140 HydrophobicContact CD1-CD1 4.21Å; L140-E142 VanDerWaalsContact C-N 3.34Å; L140-E142 PolarHBondContact O-N 2.88Å; L140-Y143 WeakPolarHBondContact O-CB 3.46Å; L140-Y143 PolarHBondContact O-N 3.48Å; L140-Y143 VanDerWaalsContact O-N 3.1Å; L140-F144 HydrophobicContact CB-CD2 4.44Å; L140-F144 HydrophobicContact CB-CE2 4.01Å; L140-F144 HydrophobicContact CD2-CZ 4.46Å; L140-F144 WeakPolarHBondContact O-CD2 3.35Å; L140-F144 WeakPolarHBondContact O-CG 3.32Å; L140-F144 PolarHBondContact O-N 3.44Å; L140-I251 HydrophobicContact CD1-CG2 3.6Å |
| 141 | G | 91.1 | Very high | 90.1 | Very high | 3 Ų | 3 | 61.8 Ų | 61.8 | 3% | 0.031 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -61.6 | -40.3 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | F137 A138 G145 G255 M259 | F137-G141 PolarHBondContact O-N 3.23Å; A138-G141 PolarHBondContact O-N 3.48Å; G141-G145 PolarHBondContact O-N 3.18Å; G141-G255 VanDerWaalsContact CA-O 3.28Å; G141-G255 WeakPolarHBondContact CA-O 3.22Å; G141-M259 WeakPolarHBondContact O-CG 3.39Å |
| 142 | E | 89.9 | Confident | 89.5 | Confident | 98 Ų | 98 | 61.1 Ų | 61.1 | 46% | 0.458 | 33% | 0.329 | S | S | . | . | H | α-helix | trans | -64.8 | -41.3 | 170.1 | -83 | -150.5 | -140.1 | 0 | 0 | 112.9 | A138 G139 L140 G145 R146 | A138-E142 PolarHBondContact O-N 2.95Å; G139-E142 PolarHBondContact O-N 3.24Å; L140-E142 VanDerWaalsContact C-N 3.34Å; L140-E142 PolarHBondContact O-N 2.88Å; E142-G145 PolarHBondContact O-N 2.83Å; E142-R146 WeakPolarHBondContact O-CB 3.28Å; E142-R146 WeakPolarHBondContact O-CD 3.1Å; E142-R146 WeakPolarHBondContact O-CG 3.44Å; E142-R146 PolarHBondContact O-N 3.04Å; E142-R146 IonicContact OE2-CZ 3.75Å; E142-R146 IonicContact OE2-NE 3.35Å; E142-R146 PolarHBondContact OE2-NE 3.28Å; E142-R146 IonicContact OE2-NH2 2.69Å; E142-R146 PolarHBondContact OE2-NH2 3.37Å |
| 143 | Y | 91.5 | Very high | 88.9 | Confident | 142 Ų | 142 | 62.9 Ų | 62.9 | 56% | 0.557 | 33% | 0.325 | S | S | * | . | H | α-helix | trans | -62.2 | -47.8 | 177.3 | 175.4 | -100.2 | 0 | 0 | 0 | 111.9 | G139 L140 R146 T147 | G139-Y143 WeakPolarHBondContact O-CB 3.36Å; G139-Y143 PolarHBondContact O-N 3.49Å; L140-Y143 WeakPolarHBondContact O-CB 3.46Å; L140-Y143 PolarHBondContact O-N 3.48Å; L140-Y143 VanDerWaalsContact O-N 3.1Å; Y143-R146 PolarHBondContact O-N 2.75Å; Y143-T147 VanDerWaalsContact O-CB 3.28Å; Y143-T147 WeakPolarHBondContact O-CB 3.43Å; Y143-T147 PolarHBondContact O-N 2.95Å; Y143-T147 PolarHBondContact O-OG1 3.1Å |
| 144 | F | 89.6 | Confident | 88.6 | Confident | 27 Ų | 27 | 71.4 Ų | 71.4 | 12% | 0.118 | 36% | 0.357 | C | S | . | . | H | α-helix | trans | -63.2 | -42.4 | 175.2 | -62.9 | -48 | 0 | 0 | 0 | 111.5 | L140 T147 F148 F252 M259 | L140-F144 HydrophobicContact CB-CD2 4.44Å; L140-F144 HydrophobicContact CB-CE2 4.01Å; L140-F144 HydrophobicContact CD2-CZ 4.46Å; L140-F144 WeakPolarHBondContact O-CD2 3.35Å; L140-F144 WeakPolarHBondContact O-CG 3.32Å; L140-F144 PolarHBondContact O-N 3.44Å; F144-T147 PolarHBondContact O-N 3.42Å; F144-F148 WeakPolarHBondContact O-CB 3.39Å; F144-F148 PolarHBondContact O-N 3.31Å; F144-F252 AromaticContact CE1-CD1 3.9Å; F144-F252 HydrophobicContact CE1-CD1 3.9Å; F144-F252 HydrophobicContact CE1-CE1 4.33Å; F144-F252 WeakPolarHBondContact CE2-O 3.16Å; F144-F252 HydrophobicContact CZ-CB 4.06Å; F144-F252 AromaticContact CZ-CD1 3.57Å; F144-F252 HydrophobicContact CZ-CD1 3.57Å; F144-F252 HydrophobicContact CZ-CE1 4.25Å; F144-F252 AromaticContact CZ-CG 3.97Å; F144-F252 HydrophobicContact CZ-CG 3.97Å; F144-M259 HydrophobicContact CB-CB 4.28Å; F144-M259 HydrophobicContact CB-CG 4.08Å; F144-M259 HydrophobicContact CB-SD 3.73Å |
| 145 | G | 87.1 | Confident | 88.2 | Confident | 8 Ų | 8 | 76 Ų | 76 | 8% | 0.082 | 36% | 0.363 | C | S | . | . | H | α-helix | trans | -60.8 | -47.9 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.8 | G141 E142 T147 F148 E149 | G141-G145 PolarHBondContact O-N 3.18Å; E142-G145 PolarHBondContact O-N 2.83Å; G145-T147 VanDerWaalsContact C-N 3.31Å; G145-T147 PolarHBondContact O-N 3.17Å; G145-F148 PolarHBondContact O-N 3.48Å; G145-E149 WeakPolarHBondContact O-CG 3.39Å; G145-E149 PolarHBondContact O-N 3.42Å |
| 146 | R | 88.1 | Confident | 87.6 | Confident | 156 Ų | 156 | 73.2 Ų | 73.2 | 59% | 0.589 | 35% | 0.346 | S | S | * | . | H | α-helix | trans | -61.5 | -38.9 | 175.5 | -68.1 | 165.6 | -171.5 | -155.5 | 7.1 | 111.8 | E142 Y143 A150 | E142-R146 WeakPolarHBondContact O-CB 3.28Å; E142-R146 WeakPolarHBondContact O-CD 3.1Å; E142-R146 WeakPolarHBondContact O-CG 3.44Å; E142-R146 PolarHBondContact O-N 3.04Å; E142-R146 IonicContact OE2-CZ 3.75Å; E142-R146 IonicContact OE2-NE 3.35Å; E142-R146 PolarHBondContact OE2-NE 3.28Å; E142-R146 IonicContact OE2-NH2 2.69Å; E142-R146 PolarHBondContact OE2-NH2 3.37Å; Y143-R146 PolarHBondContact O-N 2.75Å; R146-A150 WeakPolarHBondContact O-CB 3.34Å; R146-A150 PolarHBondContact O-N 3.24Å |
| 147 | T | 88.6 | Confident | 87 | Confident | 48 Ų | 48 | 76.8 Ų | 76.8 | 29% | 0.294 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -69.4 | -47.1 | 178.8 | -60 | 0 | 0 | 0 | 0 | 111.5 | Y143 F144 G145 A150 I151 | Y143-T147 VanDerWaalsContact O-CB 3.28Å; Y143-T147 WeakPolarHBondContact O-CB 3.43Å; Y143-T147 PolarHBondContact O-N 2.95Å; Y143-T147 PolarHBondContact O-OG1 3.1Å; F144-T147 PolarHBondContact O-N 3.42Å; G145-T147 VanDerWaalsContact C-N 3.31Å; G145-T147 PolarHBondContact O-N 3.17Å; T147-A150 WeakPolarHBondContact O-CB 3.4Å; T147-A150 PolarHBondContact O-N 3.16Å; T147-A150 VanDerWaalsContact O-N 3.09Å; T147-I151 HydrophobicContact CG2-CD1 3.96Å; T147-I151 WeakPolarHBondContact O-CG1 3.48Å; T147-I151 PolarHBondContact O-N 3.16Å |
| 148 | F | 84.9 | Confident | 86.6 | Confident | 40 Ų | 40 | 83.4 Ų | 83.4 | 18% | 0.175 | 38% | 0.384 | C | S | . | . | H | α-helix | trans | -60.1 | -46.2 | 174.7 | 177.8 | -97.8 | 0 | 0 | 0 | 111.4 | F144 G145 A150 I151 Y152 I179 A180 F263 | F144-F148 WeakPolarHBondContact O-CB 3.39Å; F144-F148 PolarHBondContact O-N 3.31Å; G145-F148 PolarHBondContact O-N 3.48Å; F148-A150 VanDerWaalsContact C-N 3.29Å; F148-A150 PolarHBondContact O-N 2.88Å; F148-I151 PolarHBondContact O-N 2.83Å; F148-Y152 VanDerWaalsContact O-CB 3.28Å; F148-Y152 WeakPolarHBondContact O-CB 3.35Å; F148-Y152 PolarHBondContact O-N 2.85Å; F148-I179 HydrophobicContact CZ-CG2 4.18Å; F148-A180 HydrophobicContact CD1-CB 4.33Å; F148-A180 HydrophobicContact CE1-CB 3.76Å; F148-A180 HydrophobicContact CE2-CB 4.1Å; F148-A180 VanDerWaalsContact CZ-CA 3.43Å; F148-A180 HydrophobicContact CZ-CB 3.63Å; F148-F263 HydrophobicContact CD1-CZ 4.48Å |
| 149 | E | 83.2 | Confident | 86 | Confident | 70 Ų | 70 | 84.3 Ų | 84.3 | 33% | 0.327 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -60.4 | -37.7 | 173 | -72.9 | -177.2 | -169.3 | 0 | 0 | 112.3 | G145 R153 | G145-E149 WeakPolarHBondContact O-CG 3.39Å; G145-E149 PolarHBondContact O-N 3.42Å; E149-R153 VanDerWaalsContact O-CB 3.22Å; E149-R153 WeakPolarHBondContact O-CB 3.09Å; E149-R153 WeakPolarHBondContact O-CG 3.44Å; E149-R153 PolarHBondContact O-N 2.79Å; E149-R153 PolarHBondContact O-NE 3.38Å; E149-R153 IonicContact OE2-CZ 3.21Å; E149-R153 VanDerWaalsContact OE2-CZ 3.24Å; E149-R153 IonicContact OE2-NH1 3.3Å; E149-R153 PolarHBondContact OE2-NH1 3.25Å; E149-R153 IonicContact OE2-NH2 2.61Å; E149-R153 PolarHBondContact OE2-NH2 2.91Å |
| 150 | A | 85.8 | Confident | 85.1 | Confident | 39 Ų | 39 | 86.2 Ų | 86.2 | 32% | 0.322 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -67.2 | -42.6 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112 | R146 T147 F148 R153 R154 | R146-A150 WeakPolarHBondContact O-CB 3.34Å; R146-A150 PolarHBondContact O-N 3.24Å; T147-A150 WeakPolarHBondContact O-CB 3.4Å; T147-A150 PolarHBondContact O-N 3.16Å; T147-A150 VanDerWaalsContact O-N 3.09Å; F148-A150 VanDerWaalsContact C-N 3.29Å; F148-A150 PolarHBondContact O-N 2.88Å; A150-R153 PolarHBondContact O-N 3.21Å; A150-R154 WeakPolarHBondContact O-CB 3.25Å; A150-R154 WeakPolarHBondContact O-CG 3.18Å; A150-R154 PolarHBondContact O-N 2.61Å |
| 151 | I | 85.4 | Confident | 84.5 | Confident | 102 Ų | 102 | 89.3 Ų | 89.3 | 52% | 0.523 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -63 | -49.4 | 174 | -68 | 165.9 | 0 | 0 | 0 | 110.1 | T147 F148 R153 R154 Y155 | T147-I151 HydrophobicContact CG2-CD1 3.96Å; T147-I151 WeakPolarHBondContact O-CG1 3.48Å; T147-I151 PolarHBondContact O-N 3.16Å; F148-I151 PolarHBondContact O-N 2.83Å; I151-R153 PolarHBondContact O-N 3.02Å; I151-R154 CarbonylContact O-C 3.58Å; I151-R154 WeakPolarHBondContact O-CB 3.05Å; I151-R154 PolarHBondContact O-N 2.87Å; I151-R154 VanDerWaalsContact O-N 3.08Å; I151-Y155 PolarHBondContact O-N 3.35Å |
| 152 | Y | 83 | Confident | 83.9 | Confident | 63 Ų | 63 | 93.3 Ų | 93.3 | 25% | 0.247 | 42% | 0.424 | C | S | . | . | H | α-helix | trans | -61.3 | -40.7 | 177.8 | 179.6 | -107.3 | 0 | 0 | 0 | 112.3 | F148 Y155 K156 L171 | F148-Y152 VanDerWaalsContact O-CB 3.28Å; F148-Y152 WeakPolarHBondContact O-CB 3.35Å; F148-Y152 PolarHBondContact O-N 2.85Å; Y152-Y155 PolarHBondContact O-N 3.12Å; Y152-K156 VanDerWaalsContact O-CB 3.29Å; Y152-K156 WeakPolarHBondContact O-CB 3.33Å; Y152-K156 PolarHBondContact O-N 3.2Å; Y152-L171 WeakPolarHBondContact OH-CD1 3.39Å |
| 153 | R | 82.2 | Confident | 83.1 | Confident | 129 Ų | 129 | 92 Ų | 92 | 49% | 0.487 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -63.6 | -39.1 | 171.9 | -77.7 | -179.1 | -72.1 | -116.4 | -0.3 | 112.3 | E149 A150 I151 K157 | E149-R153 VanDerWaalsContact O-CB 3.22Å; E149-R153 WeakPolarHBondContact O-CB 3.09Å; E149-R153 WeakPolarHBondContact O-CG 3.44Å; E149-R153 PolarHBondContact O-N 2.79Å; E149-R153 PolarHBondContact O-NE 3.38Å; E149-R153 IonicContact OE2-CZ 3.21Å; E149-R153 VanDerWaalsContact OE2-CZ 3.24Å; E149-R153 IonicContact OE2-NH1 3.3Å; E149-R153 PolarHBondContact OE2-NH1 3.25Å; E149-R153 IonicContact OE2-NH2 2.61Å; E149-R153 PolarHBondContact OE2-NH2 2.91Å; A150-R153 PolarHBondContact O-N 3.21Å; I151-R153 PolarHBondContact O-N 3.02Å; R153-K157 WeakPolarHBondContact O-CB 3.5Å; R153-K157 VanDerWaalsContact O-CG 3.31Å; R153-K157 WeakPolarHBondContact O-CG 3.12Å; R153-K157 PolarHBondContact O-N 2.91Å |
| 154 | R | 85.3 | Confident | 81.8 | Confident | 192 Ų | 192 | 93.7 Ų | 93.7 | 73% | 0.725 | 44% | 0.436 | S | S | * | . | H | α-helix | trans | -66.1 | -48.7 | 174.6 | -76.8 | 176.1 | 178.8 | -171.6 | 0.4 | 111.5 | A150 I151 K156 K157 Y158 | A150-R154 WeakPolarHBondContact O-CB 3.25Å; A150-R154 WeakPolarHBondContact O-CG 3.18Å; A150-R154 PolarHBondContact O-N 2.61Å; I151-R154 CarbonylContact O-C 3.58Å; I151-R154 WeakPolarHBondContact O-CB 3.05Å; I151-R154 PolarHBondContact O-N 2.87Å; I151-R154 VanDerWaalsContact O-N 3.08Å; R154-K156 PolarHBondContact O-N 2.85Å; R154-K157 PolarHBondContact O-N 3.4Å; R154-Y158 WeakPolarHBondContact O-CB 3.44Å; R154-Y158 PolarHBondContact O-N 3.45Å |
| 155 | Y | 82.8 | Confident | 80.8 | Confident | 134 Ų | 134 | 100.1 Ų | 100.1 | 53% | 0.525 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -58.2 | -46.6 | 176.4 | 176.6 | -96.5 | 0 | 0 | 0 | 111.9 | I151 Y152 K157 Y158 K159 | I151-Y155 PolarHBondContact O-N 3.35Å; Y152-Y155 PolarHBondContact O-N 3.12Å; Y155-K157 PolarHBondContact O-N 3.28Å; Y155-Y158 PolarHBondContact O-N 2.8Å; Y155-K159 PolarHBondContact O-N 2.94Å |
| 156 | K | 80 | Confident | 79.7 | Confident | 68 Ų | 68 | 102 Ų | 102 | 30% | 0.296 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -61 | -43.7 | 176.1 | -177.2 | 172.9 | 178.4 | 174.4 | 0 | 112 | Y152 R154 M160 | Y152-K156 VanDerWaalsContact O-CB 3.29Å; Y152-K156 WeakPolarHBondContact O-CB 3.33Å; Y152-K156 PolarHBondContact O-N 3.2Å; R154-K156 PolarHBondContact O-N 2.85Å; K156-M160 HydrophobicContact CG-SD 3.91Å; K156-M160 WeakPolarHBondContact O-CB 3.36Å; K156-M160 VanDerWaalsContact O-CG 3.23Å; K156-M160 WeakPolarHBondContact O-CG 3.36Å; K156-M160 PolarHBondContact O-N 2.72Å |
| 157 | K | 81.9 | Confident | 78.4 | Confident | 156 Ų | 156 | 100.3 Ų | 100.3 | 68% | 0.678 | 48% | 0.477 | S | S | * | . | H | α-helix | trans | -61.8 | -45.6 | 174.7 | -79.3 | -178.7 | 174.9 | -167 | 0 | 112.1 | R153 R154 Y155 M160 S161 | R153-K157 WeakPolarHBondContact O-CB 3.5Å; R153-K157 VanDerWaalsContact O-CG 3.31Å; R153-K157 WeakPolarHBondContact O-CG 3.12Å; R153-K157 PolarHBondContact O-N 2.91Å; R154-K157 PolarHBondContact O-N 3.4Å; Y155-K157 PolarHBondContact O-N 3.28Å; K157-M160 PolarHBondContact O-N 3.31Å; K157-S161 PolarHBondContact O-N 3.39Å; K157-S161 PolarHBondContact O-OG 2.96Å |
| 158 | Y | 81.7 | Confident | 77.1 | Confident | 154 Ų | 154 | 100.3 Ų | 100.3 | 60% | 0.604 | 48% | 0.478 | S | S | * | . | H | α-helix | trans | -58.5 | -51.1 | 177.3 | 179.7 | -100.8 | 0 | 0 | 0 | 111 | R154 Y155 M160 S161 T162 | R154-Y158 WeakPolarHBondContact O-CB 3.44Å; R154-Y158 PolarHBondContact O-N 3.45Å; Y155-Y158 PolarHBondContact O-N 2.8Å; Y158-M160 VanDerWaalsContact C-N 3.33Å; Y158-M160 PolarHBondContact O-N 3.5Å; Y158-S161 WeakPolarHBondContact CA-OG 3.29Å; Y158-S161 WeakPolarHBondContact O-CA 3.5Å; Y158-S161 PolarHBondContact O-N 3.48Å; Y158-S161 PolarHBondContact O-OG 3.3Å; Y158-T162 HydrophobicContact CD1-CG2 4.29Å; Y158-T162 HydrophobicContact CD2-CG2 4.41Å; Y158-T162 HydrophobicContact CE1-CG2 3.83Å; Y158-T162 HydrophobicContact CE2-CG2 3.98Å; Y158-T162 PolarHBondContact O-N 2.9Å; Y158-T162 PolarHBondContact O-OG1 3.32Å |
| 159 | K | 78.6 | Confident | 75.9 | Confident | 69 Ų | 69 | 101.8 Ų | 101.8 | 30% | 0.3 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -61.6 | -39 | 178.3 | -169.4 | 163.8 | -175.9 | 167.5 | 0 | 112.8 | Y155 S161 T162 D163 Y166 | Y155-K159 PolarHBondContact O-N 2.94Å; K159-S161 VanDerWaalsContact C-N 3.28Å; K159-S161 PolarHBondContact O-N 3.09Å; K159-T162 WeakPolarHBondContact CA-OG1 3.28Å; K159-T162 PolarHBondContact O-N 3.1Å; K159-T162 PolarHBondContact O-OG1 2.83Å; K159-D163 WeakPolarHBondContact O-CB 3.37Å; K159-D163 PolarHBondContact O-N 2.83Å; K159-Y166 HydrophobicContact CB-CD1 4.45Å; K159-Y166 HydrophobicContact CB-CE1 4.46Å; K159-Y166 HydrophobicContact CD-CD2 4.01Å; K159-Y166 HydrophobicContact CD-CE1 4.37Å; K159-Y166 HydrophobicContact CD-CE2 3.83Å; K159-Y166 HydrophobicContact CD-CG 4.38Å; K159-Y166 HydrophobicContact CG-CD1 4.07Å; K159-Y166 HydrophobicContact CG-CD2 4.14Å; K159-Y166 HydrophobicContact CG-CE1 4.26Å; K159-Y166 HydrophobicContact CG-CE2 4.34Å; K159-Y166 HydrophobicContact CG-CG 4.01Å |
| 160 | M | 74.8 | Confident | 74.7 | Confident | 84 Ų | 84 | 106.8 Ų | 106.8 | 41% | 0.414 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -64.4 | -27.2 | 172.1 | -75.4 | 173.9 | 141.7 | 0 | 0 | 113.8 | K156 K157 Y158 Y166 P168 | K156-M160 HydrophobicContact CG-SD 3.91Å; K156-M160 WeakPolarHBondContact O-CB 3.36Å; K156-M160 VanDerWaalsContact O-CG 3.23Å; K156-M160 WeakPolarHBondContact O-CG 3.36Å; K156-M160 PolarHBondContact O-N 2.72Å; K157-M160 PolarHBondContact O-N 3.31Å; Y158-M160 VanDerWaalsContact C-N 3.33Å; Y158-M160 PolarHBondContact O-N 3.5Å; M160-Y166 HydrophobicContact CG-CD1 3.67Å; M160-Y166 HydrophobicContact CG-CE1 4.15Å; M160-P168 HydrophobicContact CE-CB 3.97Å; M160-P168 HydrophobicContact CE-CG 3.67Å |
| 161 | S | 79 | Confident | 73.4 | Confident | 94 Ų | 94 | 107.6 Ų | 107.6 | 66% | 0.657 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -86 | -27.9 | 176.1 | 59.4 | 0 | 0 | 0 | 0 | 114.1 | K157 Y158 K159 | K157-S161 PolarHBondContact O-N 3.39Å; K157-S161 PolarHBondContact O-OG 2.96Å; Y158-S161 WeakPolarHBondContact CA-OG 3.29Å; Y158-S161 WeakPolarHBondContact O-CA 3.5Å; Y158-S161 PolarHBondContact O-N 3.48Å; Y158-S161 PolarHBondContact O-OG 3.3Å; K159-S161 VanDerWaalsContact C-N 3.28Å; K159-S161 PolarHBondContact O-N 3.09Å |
| 162 | T | 78.3 | Confident | 72.4 | Confident | 86 Ų | 86 | 104 Ų | 104 | 53% | 0.528 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -85.5 | -28.2 | 177.6 | 54.2 | 0 | 0 | 0 | 0 | 113.4 | Y158 K159 | Y158-T162 HydrophobicContact CD1-CG2 4.29Å; Y158-T162 HydrophobicContact CD2-CG2 4.41Å; Y158-T162 HydrophobicContact CE1-CG2 3.83Å; Y158-T162 HydrophobicContact CE2-CG2 3.98Å; Y158-T162 PolarHBondContact O-N 2.9Å; Y158-T162 PolarHBondContact O-OG1 3.32Å; K159-T162 WeakPolarHBondContact CA-OG1 3.28Å; K159-T162 PolarHBondContact O-N 3.1Å; K159-T162 PolarHBondContact O-OG1 2.83Å |
| 163 | D | 73.6 | Confident | 71.7 | Confident | 72 Ų | 72 | 103.8 Ų | 103.8 | 39% | 0.385 | 51% | 0.505 | S | S | . | . | trans | -128.4 | 93.8 | -171.8 | -176.9 | 0.3 | 0 | 0 | 0 | 109.7 | K159 H165 Y166 | K159-D163 WeakPolarHBondContact O-CB 3.37Å; K159-D163 PolarHBondContact O-N 2.83Å; D163-H165 PolarHBondContact O-N 2.95Å; D163-H165 VanDerWaalsContact O-N 3.1Å; D163-H165 PolarHBondContact OD1-N 2.99Å; D163-Y166 WeakPolarHBondContact O-CB 3.33Å; D163-Y166 PolarHBondContact O-N 2.98Å | ||
| 164 | M | 63.3 | Low | 71.2 | Confident | 177 Ų | 177 | 103.2 Ų | 103.2 | 87% | 0.872 | 51% | 0.51 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -66.5 | -11.1 | -174.3 | -162.2 | 169.3 | 72.5 | 0 | 0 | 113.6 | ||
| 165 | H | 68.7 | Low | 70.6 | Confident | 162 Ų | 162 | 96.9 Ų | 96.9 | 75% | 0.75 | 49% | 0.493 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -102.6 | 7.9 | 173.4 | -72.9 | 80.3 | 0 | 0 | 0 | 112.9 | D163 V167 | D163-H165 PolarHBondContact O-N 2.95Å; D163-H165 VanDerWaalsContact O-N 3.1Å; D163-H165 PolarHBondContact OD1-N 2.99Å; H165-V167 VanDerWaalsContact C-N 3.3Å; H165-V167 PolarHBondContact O-N 2.6Å |
| 166 | Y | 65 | Low | 70.2 | Confident | 47 Ų | 47 | 92.5 Ų | 92.5 | 18% | 0.184 | 48% | 0.48 | C | S | . | . | trans | -71.1 | 81.6 | 177.8 | -178 | -111 | 0 | 0 | 0 | 112.4 | K159 M160 D163 P168 | K159-Y166 HydrophobicContact CB-CD1 4.45Å; K159-Y166 HydrophobicContact CB-CE1 4.46Å; K159-Y166 HydrophobicContact CD-CD2 4.01Å; K159-Y166 HydrophobicContact CD-CE1 4.37Å; K159-Y166 HydrophobicContact CD-CE2 3.83Å; K159-Y166 HydrophobicContact CD-CG 4.38Å; K159-Y166 HydrophobicContact CG-CD1 4.07Å; K159-Y166 HydrophobicContact CG-CD2 4.14Å; K159-Y166 HydrophobicContact CG-CE1 4.26Å; K159-Y166 HydrophobicContact CG-CE2 4.34Å; K159-Y166 HydrophobicContact CG-CG 4.01Å; M160-Y166 HydrophobicContact CG-CD1 3.67Å; M160-Y166 HydrophobicContact CG-CE1 4.15Å; D163-Y166 WeakPolarHBondContact O-CB 3.33Å; D163-Y166 PolarHBondContact O-N 2.98Å; Y166-P168 HydrophobicContact CE1-CB 4.33Å; Y166-P168 WeakPolarHBondContact O-CD 3.36Å | ||
| 167 | V | 61.4 | Low | 70.1 | Confident | 121 Ų | 121 | 90.7 Ų | 90.7 | 73% | 0.733 | 48% | 0.475 | S | S | * | . | P | Polyproline II helix | trans | -60.3 | 117.9 | 160.8 | -178.2 | 0 | 0 | 0 | 0 | 107.2 | H165 P169 | H165-V167 VanDerWaalsContact C-N 3.3Å; H165-V167 PolarHBondContact O-N 2.6Å; V167-P169 VanDerWaalsContact O-CD 3.24Å; V167-P169 WeakPolarHBondContact O-CD 3.23Å |
| 168 | P | 59.7 | Low | 70 | Confident | 48 Ų | 48 | 86.7 Ų | 86.7 | 31% | 0.312 | 46% | 0.463 | S | S | . | . | P | Polyproline II helix | trans | -68.5 | 118.4 | 178.8 | 27.8 | -33.4 | 0 | 0 | 0 | 108.7 | M160 Y166 | M160-P168 HydrophobicContact CE-CB 3.97Å; M160-P168 HydrophobicContact CE-CG 3.67Å; Y166-P168 HydrophobicContact CE1-CB 4.33Å; Y166-P168 WeakPolarHBondContact O-CD 3.36Å |
| 169 | P | 59.7 | Low | 70 | Confident | 71 Ų | 71 | 82.4 Ų | 82.4 | 46% | 0.461 | 45% | 0.45 | S | S | . | . | P | Polyproline II helix | trans | -57.2 | 145.3 | 175.7 | 20.3 | -29.3 | 0 | 0 | 0 | 110 | V167 L171 | V167-P169 VanDerWaalsContact O-CD 3.24Å; V167-P169 WeakPolarHBondContact O-CD 3.23Å; P169-L171 HydrophobicContact CB-CG 4.3Å; P169-L171 HydrophobicContact CG-CD1 4.28Å; P169-L171 HydrophobicContact CG-CD2 4.19Å; P169-L171 HydrophobicContact CG-CG 3.97Å; P169-L171 PolarHBondContact O-N 2.95Å |
| 170 | Q | 59.1 | Low | 70 | Confident | 175 Ų | 175 | 79.3 Ų | 79.3 | 82% | 0.818 | 44% | 0.438 | S | S | * | . | trans | -72.8 | 61.9 | 172.9 | -68.9 | -159.2 | 36 | 0 | 0 | 110.7 | G172 | Q170-G172 PolarHBondContact O-N 3.3Š| ||
| 171 | L | 58.1 | Low | 70.5 | Confident | 56 Ų | 56 | 78.5 Ų | 78.5 | 29% | 0.293 | 43% | 0.434 | S | S | . | . | trans | -48.2 | 124 | -176.1 | -71.5 | 160.6 | 0 | 0 | 0 | 109.9 | Y152 P169 T175 T176 | Y152-L171 WeakPolarHBondContact OH-CD1 3.39Å; P169-L171 HydrophobicContact CB-CG 4.3Å; P169-L171 HydrophobicContact CG-CD1 4.28Å; P169-L171 HydrophobicContact CG-CD2 4.19Å; P169-L171 HydrophobicContact CG-CG 3.97Å; P169-L171 PolarHBondContact O-N 2.95Å; L171-T175 HydrophobicContact CD2-CG2 3.63Å; L171-T176 HydrophobicContact CB-CG2 4.41Å | ||
| 172 | G | 65.3 | Low | 70.8 | Confident | 27 Ų | 27 | 79.1 Ų | 79.1 | 28% | 0.278 | 43% | 0.429 | S | S | . | . | trans | -59.7 | 151.3 | 173.3 | 0 | 0 | 0 | 0 | 0 | 109.5 | Q170 I174 T175 T176 | Q170-G172 PolarHBondContact O-N 3.3Å; G172-I174 PolarHBondContact O-N 2.66Å; G172-T175 PolarHBondContact N-OG1 3.47Å; G172-T175 WeakPolarHBondContact O-CA 3.26Å; G172-T175 WeakPolarHBondContact O-CB 3.46Å; G172-T175 PolarHBondContact O-N 3.3Å; G172-T175 PolarHBondContact O-OG1 3.27Å; G172-T176 PolarHBondContact O-N 3.43Å; G172-T176 VanDerWaalsContact O-N 3.09Å | ||
| 173 | L | 67.7 | Low | 71.2 | Confident | 58 Ų | 58 | 78.1 Ų | 78.1 | 30% | 0.304 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -58.7 | -36.7 | 176.6 | -159.5 | 166.3 | 0 | 0 | 0 | 110.1 | T175 T176 V177 | L173-T175 VanDerWaalsContact C-N 3.32Å; L173-T175 PolarHBondContact O-N 2.95Å; L173-T176 WeakPolarHBondContact CA-OG1 3.15Å; L173-T176 PolarHBondContact O-N 2.96Å; L173-T176 PolarHBondContact O-OG1 2.94Å; L173-V177 HydrophobicContact CD2-CG2 3.75Å; L173-V177 WeakPolarHBondContact O-CG2 3.46Å; L173-V177 PolarHBondContact O-N 3.04Å |
| 174 | I | 70.5 | Confident | 71.7 | Confident | 117 Ų | 117 | 74.9 Ų | 74.9 | 60% | 0.6 | 41% | 0.407 | S | S | * | . | H | α-helix | trans | -49.6 | -50 | 168 | -58.2 | 172.4 | 0 | 0 | 0 | 111.3 | G172 T176 V177 V178 | G172-I174 PolarHBondContact O-N 2.66Å; I174-T176 VanDerWaalsContact C-N 3.33Å; I174-T176 PolarHBondContact O-N 2.91Å; I174-V177 PolarHBondContact O-N 3.15Å; I174-V177 VanDerWaalsContact O-N 3.14Å; I174-V178 WeakPolarHBondContact O-CG2 3.4Å; I174-V178 PolarHBondContact O-N 3.42Å |
| 175 | T | 74.7 | Confident | 72.9 | Confident | 59 Ų | 59 | 69.8 Ų | 69.8 | 36% | 0.362 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -63.8 | -37.5 | 178.9 | -32.5 | 0 | 0 | 0 | 0 | 111.9 | L171 G172 L173 V177 V178 I179 | L171-T175 HydrophobicContact CD2-CG2 3.63Å; G172-T175 PolarHBondContact N-OG1 3.47Å; G172-T175 WeakPolarHBondContact O-CA 3.26Å; G172-T175 WeakPolarHBondContact O-CB 3.46Å; G172-T175 PolarHBondContact O-N 3.3Å; G172-T175 PolarHBondContact O-OG1 3.27Å; L173-T175 VanDerWaalsContact C-N 3.32Å; L173-T175 PolarHBondContact O-N 2.95Å; T175-V177 VanDerWaalsContact C-N 3.35Å; T175-V178 PolarHBondContact O-N 2.85Å; T175-I179 HydrophobicContact CG2-CD1 4.18Å; T175-I179 WeakPolarHBondContact O-CB 3.26Å; T175-I179 WeakPolarHBondContact O-CD1 3.42Å; T175-I179 WeakPolarHBondContact O-CG1 3.5Å; T175-I179 PolarHBondContact O-N 2.98Å |
| 176 | T | 73.4 | Confident | 73.9 | Confident | 41 Ų | 41 | 64.3 Ų | 64.3 | 25% | 0.252 | 37% | 0.366 | S | S | . | . | H | α-helix | trans | -68.3 | -31.3 | 174.1 | 57.8 | 0 | 0 | 0 | 0 | 113.3 | L171 G172 L173 I174 A180 | L171-T176 HydrophobicContact CB-CG2 4.41Å; G172-T176 PolarHBondContact O-N 3.43Å; G172-T176 VanDerWaalsContact O-N 3.09Å; L173-T176 WeakPolarHBondContact CA-OG1 3.15Å; L173-T176 PolarHBondContact O-N 2.96Å; L173-T176 PolarHBondContact O-OG1 2.94Å; I174-T176 VanDerWaalsContact C-N 3.33Å; I174-T176 PolarHBondContact O-N 2.91Å; T176-A180 WeakPolarHBondContact O-CB 3.26Å; T176-A180 PolarHBondContact O-N 3.39Å |
| 177 | V | 77.2 | Confident | 75.1 | Confident | 30 Ų | 30 | 66.6 Ų | 66.6 | 18% | 0.182 | 38% | 0.381 | C | S | . | . | H | α-helix | trans | -71.4 | -41.1 | 173.4 | 170.4 | 0 | 0 | 0 | 0 | 111.1 | L173 I174 T175 A180 L181 F263 I264 | L173-V177 HydrophobicContact CD2-CG2 3.75Å; L173-V177 WeakPolarHBondContact O-CG2 3.46Å; L173-V177 PolarHBondContact O-N 3.04Å; I174-V177 PolarHBondContact O-N 3.15Å; I174-V177 VanDerWaalsContact O-N 3.14Å; T175-V177 VanDerWaalsContact C-N 3.35Å; V177-A180 WeakPolarHBondContact O-CB 3.16Å; V177-A180 PolarHBondContact O-N 3.49Å; V177-L181 WeakPolarHBondContact O-CB 3.45Å; V177-L181 PolarHBondContact O-N 3.14Å; V177-F263 HydrophobicContact CG2-CB 4.41Å; V177-I264 HydrophobicContact CG1-CG1 4.3Å |
| 178 | V | 81 | Confident | 76.5 | Confident | 73 Ų | 73 | 61.7 Ų | 61.7 | 44% | 0.442 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -63.6 | -43.8 | 174.9 | 172.5 | 0 | 0 | 0 | 0 | 111.2 | I174 T175 A180 L181 I182 | I174-V178 WeakPolarHBondContact O-CG2 3.4Å; I174-V178 PolarHBondContact O-N 3.42Å; T175-V178 PolarHBondContact O-N 2.85Å; V178-A180 VanDerWaalsContact C-N 3.26Å; V178-A180 PolarHBondContact O-N 3.48Å; V178-L181 PolarHBondContact O-N 3.27Å; V178-I182 HydrophobicContact CG1-CD1 4.02Å; V178-I182 WeakPolarHBondContact O-CD1 3.46Å; V178-I182 WeakPolarHBondContact O-CG1 3.48Å; V178-I182 PolarHBondContact O-N 2.95Å |
| 179 | I | 81.3 | Confident | 78.1 | Confident | 64 Ų | 64 | 60.9 Ų | 60.9 | 33% | 0.328 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -64.9 | -30.1 | 176 | -65.5 | 164.2 | 0 | 0 | 0 | 111.5 | F148 T175 P183 | F148-I179 HydrophobicContact CZ-CG2 4.18Å; T175-I179 HydrophobicContact CG2-CD1 4.18Å; T175-I179 WeakPolarHBondContact O-CB 3.26Å; T175-I179 WeakPolarHBondContact O-CD1 3.42Å; T175-I179 WeakPolarHBondContact O-CG1 3.5Å; T175-I179 PolarHBondContact O-N 2.98Å; I179-P183 WeakPolarHBondContact O-CD 3.28Å |
| 180 | A | 78.6 | Confident | 79.7 | Confident | 4 Ų | 4 | 60.9 Ų | 60.9 | 3% | 0.033 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -71.9 | -44.5 | 171.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | F148 T176 V177 V178 I182 P183 Y256 M259 | F148-A180 HydrophobicContact CD1-CB 4.33Å; F148-A180 HydrophobicContact CE1-CB 3.76Å; F148-A180 HydrophobicContact CE2-CB 4.1Å; F148-A180 VanDerWaalsContact CZ-CA 3.43Å; F148-A180 HydrophobicContact CZ-CB 3.63Å; T176-A180 WeakPolarHBondContact O-CB 3.26Å; T176-A180 PolarHBondContact O-N 3.39Å; V177-A180 WeakPolarHBondContact O-CB 3.16Å; V177-A180 PolarHBondContact O-N 3.49Å; V178-A180 VanDerWaalsContact C-N 3.26Å; V178-A180 PolarHBondContact O-N 3.48Å; A180-I182 PolarHBondContact O-N 2.84Å; A180-P183 VanDerWaalsContact O-CD 3.27Å; A180-P183 WeakPolarHBondContact O-CD 3.46Å; A180-P183 WeakPolarHBondContact O-CG 3.39Å; A180-Y256 PolarHBondContact O-OH 3.23Å; A180-M259 HydrophobicContact CB-CE 4.44Å |
| 181 | L | 84.6 | Confident | 81.2 | Confident | 66 Ų | 66 | 57 Ų | 57 | 35% | 0.346 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -61.2 | -43.7 | -174.8 | -178.7 | 63.3 | 0 | 0 | 0 | 113.3 | V177 V178 G184 I185 I260 | V177-L181 WeakPolarHBondContact O-CB 3.45Å; V177-L181 PolarHBondContact O-N 3.14Å; V178-L181 PolarHBondContact O-N 3.27Å; L181-G184 WeakPolarHBondContact O-CA 3.42Å; L181-G184 PolarHBondContact O-N 3.41Å; L181-G184 VanDerWaalsContact O-N 3.1Å; L181-I185 HydrophobicContact CD1-CD1 4.09Å; L181-I185 HydrophobicContact CD1-CG1 4.17Å; L181-I185 HydrophobicContact CD2-CD1 4.24Å; L181-I185 HydrophobicContact CG-CD1 3.79Å; L181-I185 HydrophobicContact CG-CG1 4.27Å; L181-I185 PolarHBondContact O-N 3.36Å; L181-I260 HydrophobicContact CD1-CD1 3.63Å |
| 182 | I | 86 | Confident | 82.9 | Confident | 108 Ų | 108 | 54.3 Ų | 54.3 | 55% | 0.554 | 31% | 0.309 | S | S | * | . | H | α-helix | trans | -53.6 | -57.4 | -174.5 | -68.9 | 161.6 | 0 | 0 | 0 | 113.8 | V178 A180 G184 I185 A186 | V178-I182 HydrophobicContact CG1-CD1 4.02Å; V178-I182 WeakPolarHBondContact O-CD1 3.46Å; V178-I182 WeakPolarHBondContact O-CG1 3.48Å; V178-I182 PolarHBondContact O-N 2.95Å; A180-I182 PolarHBondContact O-N 2.84Å; I182-G184 PolarHBondContact O-N 2.93Å; I182-I185 PolarHBondContact O-N 3.09Å; I182-A186 PolarHBondContact O-N 3.45Å |
| 183 | P | 85.4 | Confident | 84.2 | Confident | 65 Ų | 65 | 53 Ų | 53 | 42% | 0.422 | 30% | 0.295 | S | S | . | . | H | α-helix | trans | -63.2 | -26.9 | 178.5 | 25.3 | -35.3 | 0 | 0 | 0 | 112.7 | I179 A180 L187 | I179-P183 WeakPolarHBondContact O-CD 3.28Å; A180-P183 VanDerWaalsContact O-CD 3.27Å; A180-P183 WeakPolarHBondContact O-CD 3.46Å; A180-P183 WeakPolarHBondContact O-CG 3.39Å; P183-L187 VanDerWaalsContact O-CB 3.28Å; P183-L187 WeakPolarHBondContact O-CB 3.38Å; P183-L187 PolarHBondContact O-N 3.22Å |
| 184 | G | 85.9 | Confident | 85.4 | Confident | 3 Ų | 3 | 59 Ų | 59 | 3% | 0.031 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -64.3 | -49.3 | 173 | 0 | 0 | 0 | 0 | 0 | 113.6 | L181 I182 A186 L187 F188 Y256 | L181-G184 WeakPolarHBondContact O-CA 3.42Å; L181-G184 PolarHBondContact O-N 3.41Å; L181-G184 VanDerWaalsContact O-N 3.1Å; I182-G184 PolarHBondContact O-N 2.93Å; G184-A186 VanDerWaalsContact C-N 3.28Å; G184-A186 PolarHBondContact O-N 3.22Å; G184-L187 PolarHBondContact O-N 2.97Å; G184-F188 WeakPolarHBondContact O-CB 3.27Å; G184-F188 PolarHBondContact O-N 2.92Å; G184-Y256 WeakPolarHBondContact CA-OH 3.32Å |
| 185 | I | 88.6 | Confident | 86.3 | Confident | 70 Ų | 70 | 54.6 Ų | 54.6 | 36% | 0.359 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -58.7 | -43.9 | 176.2 | -67.2 | 172.9 | 0 | 0 | 0 | 109.9 | L181 I182 L189 L190 | L181-I185 HydrophobicContact CD1-CD1 4.09Å; L181-I185 HydrophobicContact CD1-CG1 4.17Å; L181-I185 HydrophobicContact CD2-CD1 4.24Å; L181-I185 HydrophobicContact CG-CD1 3.79Å; L181-I185 HydrophobicContact CG-CG1 4.27Å; L181-I185 PolarHBondContact O-N 3.36Å; I182-I185 PolarHBondContact O-N 3.09Å; I185-L189 HydrophobicContact CG1-CD1 4.45Å; I185-L189 HydrophobicContact CG2-CD1 4.41Å; I185-L189 WeakPolarHBondContact O-CA 3.18Å; I185-L189 WeakPolarHBondContact O-CB 3.43Å; I185-L189 PolarHBondContact O-N 2.86Å; I185-L189 VanDerWaalsContact O-N 3.12Å; I185-L190 HydrophobicContact CG2-CD1 4.47Å; I185-L190 HydrophobicContact CG2-CG 4.31Å; I185-L190 PolarHBondContact O-N 2.92Å |
| 186 | A | 89.1 | Confident | 87.1 | Confident | 48 Ų | 48 | 51.8 Ų | 51.8 | 40% | 0.397 | 28% | 0.275 | S | S | . | . | I | π-helix | trans | -62.2 | -48.3 | 178 | 0 | 0 | 0 | 0 | 0 | 113.1 | I182 G184 L191 | I182-A186 PolarHBondContact O-N 3.45Å; G184-A186 VanDerWaalsContact C-N 3.28Å; G184-A186 PolarHBondContact O-N 3.22Å; A186-L191 WeakPolarHBondContact O-CB 3.37Å; A186-L191 PolarHBondContact O-N 2.77Å |
| 187 | L | 89.9 | Confident | 87.9 | Confident | 95 Ų | 95 | 52 Ų | 52 | 50% | 0.497 | 28% | 0.276 | S | S | . | . | I | π-helix | trans | -83.9 | -33.1 | -171.5 | -167.8 | 147.7 | 0 | 0 | 0 | 113.7 | P183 G184 P192 | P183-L187 VanDerWaalsContact O-CB 3.28Å; P183-L187 WeakPolarHBondContact O-CB 3.38Å; P183-L187 PolarHBondContact O-N 3.22Å; G184-L187 PolarHBondContact O-N 2.97Å; L187-P192 WeakPolarHBondContact O-CD 3.33Å |
| 188 | F | 90.6 | Very high | 88.4 | Confident | 18 Ų | 18 | 58.5 Ų | 58.5 | 8% | 0.079 | 30% | 0.299 | C | S | . | . | I | π-helix | trans | -107 | -12.9 | -173.8 | -67.6 | -65.2 | 0 | 0 | 0 | 115.1 | G184 P192 W249 F252 S253 Y256 | G184-F188 WeakPolarHBondContact O-CB 3.27Å; G184-F188 PolarHBondContact O-N 2.92Å; F188-P192 VanDerWaalsContact O-CG 3.27Å; F188-P192 WeakPolarHBondContact O-CG 3.35Å; F188-W249 PolarHBondContact O-NE1 2.7Å; F188-F252 HydrophobicContact CE1-CB 3.68Å; F188-F252 HydrophobicContact CZ-CB 4.1Å; F188-S253 VanDerWaalsContact CD1-CA 3.48Å; F188-Y256 AromaticContact CD2-CD1 3.38Å; F188-Y256 HydrophobicContact CD2-CD1 3.38Å; F188-Y256 HydrophobicContact CD2-CD2 4.16Å; F188-Y256 HydrophobicContact CD2-CE1 4.01Å; F188-Y256 AromaticContact CD2-CG 3.49Å; F188-Y256 HydrophobicContact CD2-CG 3.49Å; F188-Y256 VanDerWaalsContact CD2-CG 3.49Å; F188-Y256 VanDerWaalsContact CE2-CB 3.45Å; F188-Y256 AromaticContact CE2-CD1 3.74Å; F188-Y256 HydrophobicContact CE2-CD1 3.74Å; F188-Y256 AromaticContact CE2-CD2 3.67Å; F188-Y256 HydrophobicContact CE2-CD2 3.67Å; F188-Y256 HydrophobicContact CE2-CE1 4.49Å; F188-Y256 HydrophobicContact CE2-CE2 4.42Å; F188-Y256 AromaticContact CE2-CG 3.3Å; F188-Y256 HydrophobicContact CE2-CG 3.3Å; F188-Y256 HydrophobicContact CG-CD1 4.28Å; F188-Y256 HydrophobicContact CZ-CG 4.23Å |
| 189 | L | 92.7 | Very high | 88.5 | Confident | 30 Ų | 30 | 58.1 Ų | 58.1 | 16% | 0.157 | 29% | 0.292 | C | S | . | . | I | π-helix | trans | -115.5 | -59 | 172.1 | -57.4 | 176.3 | 0 | 0 | 0 | 111.5 | I185 P192 S193 Y212 T215 | I185-L189 HydrophobicContact CG1-CD1 4.45Å; I185-L189 HydrophobicContact CG2-CD1 4.41Å; I185-L189 WeakPolarHBondContact O-CA 3.18Å; I185-L189 WeakPolarHBondContact O-CB 3.43Å; I185-L189 PolarHBondContact O-N 2.86Å; I185-L189 VanDerWaalsContact O-N 3.12Å; L189-P192 WeakPolarHBondContact O-CD 3.31Å; L189-P192 WeakPolarHBondContact O-CG 3.34Å; L189-S193 WeakPolarHBondContact O-CB 3.31Å; L189-S193 PolarHBondContact O-N 3.4Å; L189-S193 PolarHBondContact O-OG 2.66Å; L189-Y212 HydrophobicContact CD1-CD2 4.33Å; L189-T215 HydrophobicContact CD2-CG2 4.21Å |
| 190 | L | 93.4 | Very high | 88.6 | Confident | 72 Ų | 72 | 55.7 Ų | 55.7 | 38% | 0.377 | 28% | 0.279 | S | S | . | . | I | π-helix | trans | -69.7 | -49.2 | -171.1 | -55 | -178.8 | 0 | 0 | 0 | 113.3 | I185 S193 W194 L208 | I185-L190 HydrophobicContact CG2-CD1 4.47Å; I185-L190 HydrophobicContact CG2-CG 4.31Å; I185-L190 PolarHBondContact O-N 2.92Å; L190-S193 WeakPolarHBondContact O-CB 3.44Å; L190-S193 PolarHBondContact O-N 2.85Å; L190-W194 PolarHBondContact O-N 3.08Å; L190-L208 HydrophobicContact CD2-CD1 3.74Å |
| 191 | L | 92.3 | Very high | 88.9 | Confident | 92 Ų | 92 | 61.9 Ų | 61.9 | 48% | 0.482 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -56.6 | -53.5 | 178 | -171.1 | 165 | 0 | 0 | 0 | 113.1 | A186 S193 W194 V195 | A186-L191 WeakPolarHBondContact O-CB 3.37Å; A186-L191 PolarHBondContact O-N 2.77Å; L191-S193 VanDerWaalsContact C-N 3.3Å; L191-S193 PolarHBondContact O-N 2.77Å; L191-W194 WeakPolarHBondContact O-CB 3.24Å; L191-W194 PolarHBondContact O-N 3.03Å; L191-V195 HydrophobicContact CD2-CG2 4.34Å; L191-V195 PolarHBondContact O-N 3.41Å |
| 192 | P | 92 | Very high | 89.1 | Confident | 0 Ų | 0 | 60.4 Ų | 60.4 | 0% | 0 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -66.3 | -30.4 | 179.3 | 27.2 | -36.6 | 0 | 0 | 0 | 112.6 | L187 F188 L189 W194 V195 F196 W249 | L187-P192 WeakPolarHBondContact O-CD 3.33Å; F188-P192 VanDerWaalsContact O-CG 3.27Å; F188-P192 WeakPolarHBondContact O-CG 3.35Å; L189-P192 WeakPolarHBondContact O-CD 3.31Å; L189-P192 WeakPolarHBondContact O-CG 3.34Å; P192-W194 PolarHBondContact O-N 3.48Å; P192-V195 WeakPolarHBondContact O-CA 3.42Å; P192-V195 WeakPolarHBondContact O-CB 3.22Å; P192-V195 PolarHBondContact O-N 2.85Å; P192-F196 HydrophobicContact CB-CD2 4.25Å; P192-F196 HydrophobicContact CB-CE2 3.85Å; P192-F196 WeakPolarHBondContact O-CD2 3.48Å; P192-F196 PolarHBondContact O-N 2.81Å; P192-W249 HydrophobicContact CB-CD2 4.24Å; P192-W249 HydrophobicContact CB-CG 4.37Å; P192-W249 HydrophobicContact CB-CZ2 4.23Å; P192-W249 HydrophobicContact CG-CZ2 4.15Å |
| 193 | S | 93.5 | Very high | 89.5 | Confident | 0 Ų | 0 | 58.7 Ų | 58.7 | 0% | 0 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -57.9 | -38.2 | 174.1 | -58.4 | 0 | 0 | 0 | 0 | 112.5 | L189 L190 L191 T197 Y204 S207 L208 S211 | L189-S193 WeakPolarHBondContact O-CB 3.31Å; L189-S193 PolarHBondContact O-N 3.4Å; L189-S193 PolarHBondContact O-OG 2.66Å; L190-S193 WeakPolarHBondContact O-CB 3.44Å; L190-S193 PolarHBondContact O-N 2.85Å; L191-S193 VanDerWaalsContact C-N 3.3Å; L191-S193 PolarHBondContact O-N 2.77Å; S193-T197 PolarHBondContact O-N 2.82Å; S193-T197 VanDerWaalsContact O-N 3.1Å; S193-T197 PolarHBondContact O-OG1 2.92Å; S193-Y204 VanDerWaalsContact CB-CE2 3.45Å; S193-S207 WeakPolarHBondContact O-CB 3.46Å; S193-L208 WeakPolarHBondContact OG-CA 3.49Å; S193-S211 PolarHBondContact OG-OG 3.43Å |
| 194 | W | 92.3 | Very high | 89.9 | Confident | 185 Ų | 185 | 60.4 Ų | 60.4 | 70% | 0.701 | 30% | 0.296 | S | S | * | . | H | α-helix | trans | -67.3 | -38.9 | 175.1 | 179.9 | 73.2 | 0 | 0 | 0 | 112 | L190 L191 P192 T197 Y198 Y204 | L190-W194 PolarHBondContact O-N 3.08Å; L191-W194 WeakPolarHBondContact O-CB 3.24Å; L191-W194 PolarHBondContact O-N 3.03Å; P192-W194 PolarHBondContact O-N 3.48Å; W194-T197 PolarHBondContact O-N 3.25Å; W194-Y198 PolarHBondContact O-N 3.07Å; W194-Y204 HydrophobicContact CB-CE2 4.44Å |
| 195 | V | 90.7 | Very high | 90.3 | Very high | 23 Ų | 23 | 64.2 Ų | 64.2 | 14% | 0.139 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -64.5 | -45.7 | 174.9 | -178.7 | 0 | 0 | 0 | 0 | 111.2 | L191 P192 T197 Y198 F199 Y242 F245 | L191-V195 HydrophobicContact CD2-CG2 4.34Å; L191-V195 PolarHBondContact O-N 3.41Å; P192-V195 WeakPolarHBondContact O-CA 3.42Å; P192-V195 WeakPolarHBondContact O-CB 3.22Å; P192-V195 PolarHBondContact O-N 2.85Å; V195-T197 VanDerWaalsContact C-N 3.35Å; V195-T197 PolarHBondContact O-N 3.1Å; V195-Y198 PolarHBondContact O-N 3.35Å; V195-Y198 VanDerWaalsContact O-N 3.1Å; V195-F199 HydrophobicContact CG1-CD2 3.66Å; V195-F199 HydrophobicContact CG1-CE2 3.9Å; V195-F199 WeakPolarHBondContact O-CD2 3.43Å; V195-F199 PolarHBondContact O-N 2.99Å; V195-Y242 HydrophobicContact CG1-CD2 4.46Å; V195-Y242 HydrophobicContact CG1-CE2 4.4Å; V195-F245 HydrophobicContact CB-CE1 4.23Å; V195-F245 HydrophobicContact CG1-CD1 4.28Å; V195-F245 HydrophobicContact CG1-CE1 3.79Å; V195-F245 HydrophobicContact CG1-CZ 4.38Å; V195-F245 HydrophobicContact CG2-CE1 4.43Å; V195-F245 HydrophobicContact CG2-CZ 4.25Å |
| 196 | F | 90.3 | Very high | 90.5 | Very high | 0 Ų | 0 | 62.8 Ų | 62.8 | 0% | 0 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -63.4 | -37.5 | 178.4 | -69.5 | -55.6 | 0 | 0 | 0 | 112.9 | P192 Y198 F199 E200 Y210 S211 P225 Y242 V246 W249 | P192-F196 HydrophobicContact CB-CD2 4.25Å; P192-F196 HydrophobicContact CB-CE2 3.85Å; P192-F196 WeakPolarHBondContact O-CD2 3.48Å; P192-F196 PolarHBondContact O-N 2.81Å; F196-Y198 VanDerWaalsContact C-N 3.27Å; F196-Y198 PolarHBondContact O-N 2.98Å; F196-F199 PolarHBondContact O-N 3.29Å; F196-E200 HydrophobicContact CD1-CG 4.44Å; F196-E200 WeakPolarHBondContact O-CB 3.26Å; F196-E200 PolarHBondContact O-N 3.3Å; F196-Y210 HydrophobicContact CD1-CE1 4.3Å; F196-Y210 AromaticContact CD2-CD1 3.89Å; F196-Y210 HydrophobicContact CD2-CD1 3.89Å; F196-Y210 HydrophobicContact CD2-CE1 4.05Å; F196-Y210 AromaticContact CE1-CE1 3.93Å; F196-Y210 HydrophobicContact CE1-CE1 3.93Å; F196-Y210 AromaticContact CE2-CD1 3.91Å; F196-Y210 HydrophobicContact CE2-CD1 3.91Å; F196-Y210 AromaticContact CE2-CE1 3.64Å; F196-Y210 HydrophobicContact CE2-CE1 3.64Å; F196-Y210 HydrophobicContact CG-CD1 4.24Å; F196-Y210 HydrophobicContact CG-CE1 4.4Å; F196-Y210 HydrophobicContact CZ-CD1 4.29Å; F196-Y210 AromaticContact CZ-CE1 3.61Å; F196-Y210 HydrophobicContact CZ-CE1 3.61Å; F196-S211 WeakPolarHBondContact CD2-OG 3.19Å; F196-P225 HydrophobicContact CD1-CG 4.41Å; F196-P225 HydrophobicContact CE1-CG 3.94Å; F196-Y242 HydrophobicContact CD1-CE2 4.17Å; F196-Y242 VanDerWaalsContact CD1-OH 3.25Å; F196-Y242 WeakPolarHBondContact CD1-OH 3.12Å; F196-Y242 HydrophobicContact CE1-CE2 4.02Å; F196-Y242 WeakPolarHBondContact CE1-OH 3.24Å; F196-V246 HydrophobicContact CE1-CG2 3.77Å; F196-V246 HydrophobicContact CZ-CG2 4.16Å; F196-W249 HydrophobicContact CE2-CE3 4.15Å; F196-W249 AromaticContact CE2-CH2 3.75Å; F196-W249 HydrophobicContact CE2-CH2 3.75Å; F196-W249 HydrophobicContact CE2-CZ2 4.23Å; F196-W249 AromaticContact CE2-CZ3 3.72Å; F196-W249 HydrophobicContact CE2-CZ3 3.72Å; F196-W249 AromaticContact CZ-CE3 3.81Å; F196-W249 HydrophobicContact CZ-CE3 3.81Å; F196-W249 HydrophobicContact CZ-CH2 4.06Å; F196-W249 AromaticContact CZ-CZ3 3.53Å; F196-W249 HydrophobicContact CZ-CZ3 3.53Å |
| 197 | T | 90.4 | Very high | 90.7 | Very high | 45 Ų | 45 | 60.5 Ų | 60.5 | 28% | 0.276 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -63.3 | -31.5 | 173 | -77.3 | 0 | 0 | 0 | 0 | 113.1 | S193 W194 V195 N201 W202 Y204 S207 | S193-T197 PolarHBondContact O-N 2.82Å; S193-T197 VanDerWaalsContact O-N 3.1Å; S193-T197 PolarHBondContact O-OG1 2.92Å; W194-T197 PolarHBondContact O-N 3.25Å; V195-T197 VanDerWaalsContact C-N 3.35Å; V195-T197 PolarHBondContact O-N 3.1Å; T197-N201 WeakPolarHBondContact O-CA 3.34Å; T197-W202 VanDerWaalsContact CA-O 3.32Å; T197-W202 WeakPolarHBondContact CA-O 3.28Å; T197-W202 VanDerWaalsContact CB-O 3.28Å; T197-W202 WeakPolarHBondContact CB-O 3.32Å; T197-W202 WeakPolarHBondContact CG2-O 3.27Å; T197-W202 PolarHBondContact OG1-O 3.02Å; T197-Y204 VanDerWaalsContact OG1-CA 3.31Å; T197-Y204 WeakPolarHBondContact OG1-CA 3.33Å; T197-Y204 PolarHBondContact OG1-N 3.25Å; T197-S207 PolarHBondContact N-OG 3.45Å; T197-S207 PolarHBondContact OG1-OG 3.47Å |
| 198 | Y | 87.1 | Confident | 91 | Very high | 168 Ų | 168 | 59 Ų | 59 | 66% | 0.659 | 29% | 0.288 | S | S | * | . | H | α-helix | trans | -77.4 | -43.6 | 176.1 | -178.1 | -101.8 | 0 | 0 | 0 | 113.2 | W194 V195 F196 | W194-Y198 PolarHBondContact O-N 3.07Å; V195-Y198 PolarHBondContact O-N 3.35Å; V195-Y198 VanDerWaalsContact O-N 3.1Å; F196-Y198 VanDerWaalsContact C-N 3.27Å; F196-Y198 PolarHBondContact O-N 2.98Å |
| 199 | F | 83.7 | Confident | 91.2 | Very high | 65 Ų | 65 | 62.1 Ų | 62.1 | 29% | 0.285 | 30% | 0.3 | S | S | . | . | H | α-helix | trans | -83.9 | -41.4 | -175.7 | -79.4 | -82.1 | 0 | 0 | 0 | 114.1 | V195 F196 Y242 | V195-F199 HydrophobicContact CG1-CD2 3.66Å; V195-F199 HydrophobicContact CG1-CE2 3.9Å; V195-F199 WeakPolarHBondContact O-CD2 3.43Å; V195-F199 PolarHBondContact O-N 2.99Å; F196-F199 PolarHBondContact O-N 3.29Å; F199-Y242 HydrophobicContact CB-CD1 4.41Å; F199-Y242 HydrophobicContact CB-CD2 4.15Å; F199-Y242 HydrophobicContact CB-CE1 4.07Å; F199-Y242 HydrophobicContact CB-CE2 3.81Å; F199-Y242 HydrophobicContact CB-CG 4.44Å; F199-Y242 HydrophobicContact CD1-CD1 4.19Å; F199-Y242 HydrophobicContact CD1-CD2 4.16Å; F199-Y242 AromaticContact CD1-CG 3.92Å; F199-Y242 HydrophobicContact CD1-CG 3.92Å; F199-Y242 AromaticContact CD2-CD2 3.71Å; F199-Y242 HydrophobicContact CD2-CD2 3.71Å; F199-Y242 AromaticContact CD2-CE2 3.99Å; F199-Y242 HydrophobicContact CD2-CE2 3.99Å; F199-Y242 HydrophobicContact CD2-CG 4.3Å; F199-Y242 HydrophobicContact CE1-CG 4.23Å; F199-Y242 HydrophobicContact CE2-CD2 4.13Å; F199-Y242 HydrophobicContact CG-CD1 4.32Å; F199-Y242 AromaticContact CG-CD2 3.73Å; F199-Y242 HydrophobicContact CG-CD2 3.73Å; F199-Y242 HydrophobicContact CG-CE1 4.45Å; F199-Y242 AromaticContact CG-CE2 3.91Å; F199-Y242 HydrophobicContact CG-CE2 3.91Å; F199-Y242 AromaticContact CG-CG 3.96Å; F199-Y242 HydrophobicContact CG-CG 3.96Å |
| 200 | E | 84 | Confident | 91.2 | Very high | 12 Ų | 12 | 60.8 Ų | 60.8 | 6% | 0.056 | 29% | 0.292 | C | S | . | . | S | Bend | trans | -94.5 | -3.5 | -176.6 | -55 | -67 | 158.1 | 0 | 0 | 113 | F196 W202 P225 T226 Q231 Y242 | F196-E200 HydrophobicContact CD1-CG 4.44Å; F196-E200 WeakPolarHBondContact O-CB 3.26Å; F196-E200 PolarHBondContact O-N 3.3Å; E200-W202 HydrophobicContact CB-CD2 3.6Å; E200-W202 HydrophobicContact CB-CE3 4.11Å; E200-W202 HydrophobicContact CB-CG 3.82Å; E200-W202 HydrophobicContact CB-CH2 4.5Å; E200-W202 HydrophobicContact CB-CZ2 4.04Å; E200-W202 HydrophobicContact CG-CD2 4.24Å; E200-W202 HydrophobicContact CG-CE3 4.33Å; E200-W202 HydrophobicContact CG-CH2 4.16Å; E200-W202 HydrophobicContact CG-CZ2 4.06Å; E200-W202 HydrophobicContact CG-CZ3 4.29Å; E200-W202 VanDerWaalsContact O-CD1 3.23Å; E200-W202 PolarHBondContact O-N 2.85Å; E200-W202 VanDerWaalsContact O-N 3.13Å; E200-P225 VanDerWaalsContact OE1-CA 3.23Å; E200-P225 WeakPolarHBondContact OE1-CA 3.36Å; E200-P225 VanDerWaalsContact OE1-CB 3.29Å; E200-P225 WeakPolarHBondContact OE1-CB 3.29Å; E200-T226 PolarHBondContact OE1-N 2.87Å; E200-T226 PolarHBondContact OE2-N 2.84Å; E200-Q231 PolarHBondContact OE2-NE2 3.2Å; E200-Y242 WeakPolarHBondContact CG-OH 3.41Å; E200-Y242 VanDerWaalsContact OE1-CE1 3.31Å; E200-Y242 WeakPolarHBondContact OE1-CE1 3.24Å; E200-Y242 PolarHBondContact OE1-OH 3.34Å |
| 201 | N | 85.1 | Confident | 91.2 | Very high | 135 Ų | 135 | 57.3 Ų | 57.3 | 72% | 0.722 | 27% | 0.274 | S | S | * | . | trans | 57.9 | 15.7 | -173 | -62.1 | -87.8 | 0 | 0 | 0 | 114.8 | T197 | T197-N201 WeakPolarHBondContact O-CA 3.34Š| ||
| 202 | W | 89.2 | Confident | 91.2 | Very high | 35 Ų | 35 | 58.6 Ų | 58.6 | 13% | 0.133 | 27% | 0.274 | C | S | . | . | trans | -72.8 | 142.8 | 178.2 | -60.9 | -15.7 | 0 | 0 | 0 | 111.9 | T197 E200 I206 Y210 Y223 | T197-W202 VanDerWaalsContact CA-O 3.32Å; T197-W202 WeakPolarHBondContact CA-O 3.28Å; T197-W202 VanDerWaalsContact CB-O 3.28Å; T197-W202 WeakPolarHBondContact CB-O 3.32Å; T197-W202 WeakPolarHBondContact CG2-O 3.27Å; T197-W202 PolarHBondContact OG1-O 3.02Å; E200-W202 HydrophobicContact CB-CD2 3.6Å; E200-W202 HydrophobicContact CB-CE3 4.11Å; E200-W202 HydrophobicContact CB-CG 3.82Å; E200-W202 HydrophobicContact CB-CH2 4.5Å; E200-W202 HydrophobicContact CB-CZ2 4.04Å; E200-W202 HydrophobicContact CG-CD2 4.24Å; E200-W202 HydrophobicContact CG-CE3 4.33Å; E200-W202 HydrophobicContact CG-CH2 4.16Å; E200-W202 HydrophobicContact CG-CZ2 4.06Å; E200-W202 HydrophobicContact CG-CZ3 4.29Å; E200-W202 VanDerWaalsContact O-CD1 3.23Å; E200-W202 PolarHBondContact O-N 2.85Å; E200-W202 VanDerWaalsContact O-N 3.13Å; W202-I206 HydrophobicContact CB-CB 4.36Å; W202-I206 HydrophobicContact CB-CG2 4.08Å; W202-I206 HydrophobicContact CD2-CG2 4.16Å; W202-I206 HydrophobicContact CE3-CG2 4.17Å; W202-I206 HydrophobicContact CG-CG2 4.15Å; W202-Y210 HydrophobicContact CH2-CG 4.42Å; W202-Y210 AromaticContact CZ3-CD1 3.92Å; W202-Y210 HydrophobicContact CZ3-CD1 3.92Å; W202-Y210 HydrophobicContact CZ3-CD2 4.26Å; W202-Y210 AromaticContact CZ3-CG 3.74Å; W202-Y210 HydrophobicContact CZ3-CG 3.74Å; W202-Y223 HydrophobicContact CD2-CD1 4.37Å; W202-Y223 HydrophobicContact CZ2-CD1 4.29Å | ||
| 203 | P | 92.8 | Very high | 91.3 | Very high | 71 Ų | 71 | 58.8 Ų | 58.8 | 46% | 0.461 | 28% | 0.275 | S | S | . | . | trans | -61.8 | 144.9 | 171.4 | 28.3 | -35 | 0 | 0 | 0 | 110.4 | S205 I206 S207 | P203-S205 PolarHBondContact O-N 2.96Å; P203-I206 HydrophobicContact CG-CB 4.16Å; P203-I206 HydrophobicContact CG-CD1 3.65Å; P203-I206 HydrophobicContact CG-CG1 3.94Å; P203-I206 WeakPolarHBondContact O-CA 3.24Å; P203-I206 WeakPolarHBondContact O-CB 3.28Å; P203-I206 PolarHBondContact O-N 3.32Å; P203-S207 PolarHBondContact O-N 3.27Å; P203-S207 VanDerWaalsContact O-N 3.13Å | ||
| 204 | Y | 94.4 | Very high | 91.3 | Very high | 101 Ų | 101 | 58.8 Ų | 58.8 | 40% | 0.396 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -56.1 | -28.2 | -170.2 | -178.5 | -97 | 0 | 0 | 0 | 114.7 | S193 W194 T197 L208 | S193-Y204 VanDerWaalsContact CB-CE2 3.45Å; W194-Y204 HydrophobicContact CB-CE2 4.44Å; T197-Y204 VanDerWaalsContact OG1-CA 3.31Å; T197-Y204 WeakPolarHBondContact OG1-CA 3.33Å; T197-Y204 PolarHBondContact OG1-N 3.25Å; Y204-L208 HydrophobicContact CE1-CD1 3.86Å; Y204-L208 VanDerWaalsContact O-CB 3.26Å; Y204-L208 WeakPolarHBondContact O-CB 3.45Å; Y204-L208 PolarHBondContact O-N 2.91Å |
| 205 | S | 94 | Very high | 91.2 | Very high | 84 Ų | 84 | 50.7 Ų | 50.7 | 59% | 0.587 | 25% | 0.246 | S | C | * | . | H | α-helix | trans | -60.8 | -44.9 | 171.5 | 45.5 | 0 | 0 | 0 | 0 | 112.9 | P203 L208 Y209 | P203-S205 PolarHBondContact O-N 2.96Å; S205-L208 PolarHBondContact O-N 3.49Å; S205-Y209 WeakPolarHBondContact O-CB 3.44Å; S205-Y209 PolarHBondContact O-N 3.22Å |
| 206 | I | 93.1 | Very high | 91.3 | Very high | 40 Ų | 40 | 51.3 Ų | 51.3 | 21% | 0.205 | 25% | 0.25 | C | C | . | . | H | α-helix | trans | -70.1 | -43.3 | 177.2 | -69 | 178.8 | 0 | 0 | 0 | 110.1 | W202 P203 L208 Y209 Y210 Y223 | W202-I206 HydrophobicContact CB-CB 4.36Å; W202-I206 HydrophobicContact CB-CG2 4.08Å; W202-I206 HydrophobicContact CD2-CG2 4.16Å; W202-I206 HydrophobicContact CE3-CG2 4.17Å; W202-I206 HydrophobicContact CG-CG2 4.15Å; P203-I206 HydrophobicContact CG-CB 4.16Å; P203-I206 HydrophobicContact CG-CD1 3.65Å; P203-I206 HydrophobicContact CG-CG1 3.94Å; P203-I206 WeakPolarHBondContact O-CA 3.24Å; P203-I206 WeakPolarHBondContact O-CB 3.28Å; P203-I206 PolarHBondContact O-N 3.32Å; I206-L208 VanDerWaalsContact C-N 3.26Å; I206-L208 PolarHBondContact O-N 2.81Å; I206-Y209 PolarHBondContact O-N 3.46Å; I206-Y210 WeakPolarHBondContact O-CB 3.42Å; I206-Y210 PolarHBondContact O-N 3.18Å; I206-Y223 HydrophobicContact CD1-CE1 4.04Å; I206-Y223 HydrophobicContact CG2-CD1 3.42Å; I206-Y223 VanDerWaalsContact CG2-CD1 3.42Å; I206-Y223 HydrophobicContact CG2-CD2 4.05Å; I206-Y223 HydrophobicContact CG2-CE1 3.43Å; I206-Y223 VanDerWaalsContact CG2-CE1 3.43Å; I206-Y223 HydrophobicContact CG2-CE2 4.05Å; I206-Y223 HydrophobicContact CG2-CG 3.76Å |
| 207 | S | 94.1 | Very high | 91.4 | Very high | 0 Ų | 0 | 53.5 Ų | 53.5 | 0% | 0 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -58.7 | -36.5 | 174.9 | -59.7 | 0 | 0 | 0 | 0 | 113.2 | S193 T197 P203 S211 | S193-S207 WeakPolarHBondContact O-CB 3.46Å; T197-S207 PolarHBondContact N-OG 3.45Å; T197-S207 PolarHBondContact OG1-OG 3.47Å; P203-S207 PolarHBondContact O-N 3.27Å; P203-S207 VanDerWaalsContact O-N 3.13Å; S207-S211 VanDerWaalsContact O-CB 3.29Å; S207-S211 WeakPolarHBondContact O-CB 3.36Å; S207-S211 PolarHBondContact O-N 2.81Å; S207-S211 PolarHBondContact O-OG 2.71Å |
| 208 | L | 94.7 | Very high | 91.5 | Very high | 62 Ų | 62 | 55.1 Ų | 55.1 | 33% | 0.325 | 27% | 0.269 | S | S | . | . | H | α-helix | trans | -76 | -41.3 | 177.1 | -172.7 | 152.5 | 0 | 0 | 0 | 112.5 | L190 S193 Y204 S205 I206 S211 Y212 | L190-L208 HydrophobicContact CD2-CD1 3.74Å; S193-L208 WeakPolarHBondContact OG-CA 3.49Å; Y204-L208 HydrophobicContact CE1-CD1 3.86Å; Y204-L208 VanDerWaalsContact O-CB 3.26Å; Y204-L208 WeakPolarHBondContact O-CB 3.45Å; Y204-L208 PolarHBondContact O-N 2.91Å; S205-L208 PolarHBondContact O-N 3.49Å; I206-L208 VanDerWaalsContact C-N 3.26Å; I206-L208 PolarHBondContact O-N 2.81Å; L208-S211 PolarHBondContact O-N 2.87Å; L208-Y212 WeakPolarHBondContact O-CB 3.2Å; L208-Y212 PolarHBondContact O-N 2.97Å |
| 209 | Y | 94.5 | Very high | 91.8 | Very high | 84 Ų | 84 | 47.4 Ų | 47.4 | 33% | 0.329 | 24% | 0.241 | S | C | . | . | H | α-helix | trans | -57.5 | -51.1 | 170.3 | 168.3 | -95.9 | 0 | 0 | 0 | 111.1 | S205 I206 S211 Y212 V213 F220 D222 Y223 | S205-Y209 WeakPolarHBondContact O-CB 3.44Å; S205-Y209 PolarHBondContact O-N 3.22Å; I206-Y209 PolarHBondContact O-N 3.46Å; Y209-S211 PolarHBondContact O-N 2.95Å; Y209-Y212 PolarHBondContact O-N 3.37Å; Y209-V213 HydrophobicContact CD1-CG2 4.44Å; Y209-V213 HydrophobicContact CD2-CG2 4.02Å; Y209-V213 HydrophobicContact CE1-CG2 4.15Å; Y209-V213 HydrophobicContact CE2-CG2 3.72Å; Y209-V213 HydrophobicContact CG-CG2 4.39Å; Y209-V213 WeakPolarHBondContact O-CB 3.32Å; Y209-V213 WeakPolarHBondContact O-CG2 3.29Å; Y209-V213 PolarHBondContact O-N 3.29Å; Y209-F220 VanDerWaalsContact OH-CD2 3.24Å; Y209-F220 WeakPolarHBondContact OH-CD2 3.27Å; Y209-D222 WeakPolarHBondContact CE1-OD2 3.43Å; Y209-D222 VanDerWaalsContact CZ-OD2 3.3Å; Y209-D222 PolarHBondContact OH-OD2 3.22Å; Y209-Y223 HydrophobicContact CD1-CD2 4.09Å; Y209-Y223 AromaticContact CE1-CD2 3.91Å; Y209-Y223 HydrophobicContact CE1-CD2 3.91Å; Y209-Y223 HydrophobicContact CE1-CE2 4.32Å |
| 210 | Y | 93.3 | Very high | 92 | Very high | 2 Ų | 2 | 50.4 Ų | 50.4 | 1% | 0.008 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -56.5 | -50.1 | 174.9 | 169.1 | -102.4 | 0 | 0 | 0 | 111.7 | Y108 F196 W202 I206 Y212 V213 T214 Y223 P225 W249 | Y108-Y210 HydrophobicContact CE1-CE2 4.13Å; Y108-Y210 PolarHBondContact OH-OH 3.11Å; Y108-Y210 VanDerWaalsContact OH-OH 3.04Å; F196-Y210 HydrophobicContact CD1-CE1 4.3Å; F196-Y210 AromaticContact CD2-CD1 3.89Å; F196-Y210 HydrophobicContact CD2-CD1 3.89Å; F196-Y210 HydrophobicContact CD2-CE1 4.05Å; F196-Y210 AromaticContact CE1-CE1 3.93Å; F196-Y210 HydrophobicContact CE1-CE1 3.93Å; F196-Y210 AromaticContact CE2-CD1 3.91Å; F196-Y210 HydrophobicContact CE2-CD1 3.91Å; F196-Y210 AromaticContact CE2-CE1 3.64Å; F196-Y210 HydrophobicContact CE2-CE1 3.64Å; F196-Y210 HydrophobicContact CG-CD1 4.24Å; F196-Y210 HydrophobicContact CG-CE1 4.4Å; F196-Y210 HydrophobicContact CZ-CD1 4.29Å; F196-Y210 AromaticContact CZ-CE1 3.61Å; F196-Y210 HydrophobicContact CZ-CE1 3.61Å; W202-Y210 HydrophobicContact CH2-CG 4.42Å; W202-Y210 AromaticContact CZ3-CD1 3.92Å; W202-Y210 HydrophobicContact CZ3-CD1 3.92Å; W202-Y210 HydrophobicContact CZ3-CD2 4.26Å; W202-Y210 AromaticContact CZ3-CG 3.74Å; W202-Y210 HydrophobicContact CZ3-CG 3.74Å; I206-Y210 WeakPolarHBondContact O-CB 3.42Å; I206-Y210 PolarHBondContact O-N 3.18Å; Y210-Y212 PolarHBondContact O-N 3.29Å; Y210-V213 PolarHBondContact O-N 3.39Å; Y210-T214 WeakPolarHBondContact CD2-OG1 3.44Å; Y210-T214 WeakPolarHBondContact CE2-OG1 3.49Å; Y210-T214 VanDerWaalsContact CZ-OG1 3.24Å; Y210-T214 WeakPolarHBondContact O-CB 3.4Å; Y210-T214 PolarHBondContact O-N 3.1Å; Y210-T214 PolarHBondContact O-OG1 3.1Å; Y210-Y223 WeakPolarHBondContact CD2-O 3.47Å; Y210-Y223 WeakPolarHBondContact CE2-O 3.23Å; Y210-P225 HydrophobicContact CE1-CG 3.94Å; Y210-P225 HydrophobicContact CE2-CG 4.44Å; Y210-P225 VanDerWaalsContact OH-CD 3.23Å; Y210-P225 WeakPolarHBondContact OH-CD 3.48Å; Y210-P225 WeakPolarHBondContact OH-CG 3.21Å; Y210-W249 HydrophobicContact CE1-CH2 4.12Å; Y210-W249 HydrophobicContact CE1-CZ3 4.15Å |
| 211 | S | 93.6 | Very high | 92.2 | Very high | 0 Ų | 0 | 50.7 Ų | 50.7 | 0% | 0 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -58.4 | -37.8 | 179.7 | -63.5 | 0 | 0 | 0 | 0 | 112 | S193 F196 S207 L208 Y209 T215 | S193-S211 PolarHBondContact OG-OG 3.43Å; F196-S211 WeakPolarHBondContact CD2-OG 3.19Å; S207-S211 VanDerWaalsContact O-CB 3.29Å; S207-S211 WeakPolarHBondContact O-CB 3.36Å; S207-S211 PolarHBondContact O-N 2.81Å; S207-S211 PolarHBondContact O-OG 2.71Å; L208-S211 PolarHBondContact O-N 2.87Å; Y209-S211 PolarHBondContact O-N 2.95Å; S211-T215 WeakPolarHBondContact O-CB 3.46Å; S211-T215 PolarHBondContact O-N 3Å; S211-T215 PolarHBondContact O-OG1 3.33Å |
| 212 | Y | 93.2 | Very high | 92.4 | Very high | 118 Ų | 118 | 48 Ų | 48 | 46% | 0.463 | 25% | 0.246 | S | C | . | . | H | α-helix | trans | -71.7 | -55.3 | 176.4 | 176.4 | -96.5 | 0 | 0 | 0 | 112.7 | L189 L208 Y209 Y210 T214 T215 T216 I218 | L189-Y212 HydrophobicContact CD1-CD2 4.33Å; L208-Y212 WeakPolarHBondContact O-CB 3.2Å; L208-Y212 PolarHBondContact O-N 2.97Å; Y209-Y212 PolarHBondContact O-N 3.37Å; Y210-Y212 PolarHBondContact O-N 3.29Å; Y212-T214 PolarHBondContact O-N 3.47Å; Y212-T215 PolarHBondContact O-N 3.46Å; Y212-T216 HydrophobicContact CD2-CG2 3.92Å; Y212-T216 HydrophobicContact CE1-CG2 4.33Å; Y212-T216 HydrophobicContact CE2-CG2 3.6Å; Y212-T216 HydrophobicContact CG-CG2 4.42Å; Y212-T216 WeakPolarHBondContact O-CB 3.48Å; Y212-T216 WeakPolarHBondContact O-CG2 3.37Å; Y212-T216 PolarHBondContact O-N 2.91Å; Y212-T216 PolarHBondContact O-OG1 2.74Å; Y212-I218 HydrophobicContact CE1-CD1 4.24Å |
| 213 | V | 93.6 | Very high | 92.4 | Very high | 5 Ų | 5 | 50.3 Ų | 50.3 | 3% | 0.03 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -56.8 | -37.1 | 179.9 | 167 | 0 | 0 | 0 | 0 | 111.5 | Y209 Y210 I218 G219 F220 | Y209-V213 HydrophobicContact CD1-CG2 4.44Å; Y209-V213 HydrophobicContact CD2-CG2 4.02Å; Y209-V213 HydrophobicContact CE1-CG2 4.15Å; Y209-V213 HydrophobicContact CE2-CG2 3.72Å; Y209-V213 HydrophobicContact CG-CG2 4.39Å; Y209-V213 WeakPolarHBondContact O-CB 3.32Å; Y209-V213 WeakPolarHBondContact O-CG2 3.29Å; Y209-V213 PolarHBondContact O-N 3.29Å; Y210-V213 PolarHBondContact O-N 3.39Å; V213-I218 HydrophobicContact CG1-CB 4.13Å; V213-I218 HydrophobicContact CG1-CG2 4.3Å; V213-I218 PolarHBondContact O-N 2.98Å; V213-G219 PolarHBondContact O-N 2.68Å; V213-G219 VanDerWaalsContact O-N 3.16Å; V213-F220 HydrophobicContact CG1-CB 4.27Å; V213-F220 HydrophobicContact CG1-CD2 3.73Å; V213-F220 HydrophobicContact CG1-CG 4.25Å; V213-F220 HydrophobicContact CG2-CD2 3.89Å; V213-F220 HydrophobicContact CG2-CE2 4.14Å |
| 214 | T | 92.5 | Very high | 92.1 | Very high | 0 Ų | 0 | 47.5 Ų | 47.5 | 0% | 0 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -71.1 | -52.6 | 175.4 | -68.9 | 0 | 0 | 0 | 0 | 112.2 | Y108 Y210 Y212 T216 T217 W249 F250 | Y108-T214 WeakPolarHBondContact OH-CB 3.15Å; Y108-T214 WeakPolarHBondContact OH-CG2 2.97Å; Y108-T214 PolarHBondContact OH-OG1 2.92Å; Y210-T214 WeakPolarHBondContact CD2-OG1 3.44Å; Y210-T214 WeakPolarHBondContact CE2-OG1 3.49Å; Y210-T214 VanDerWaalsContact CZ-OG1 3.24Å; Y210-T214 WeakPolarHBondContact O-CB 3.4Å; Y210-T214 PolarHBondContact O-N 3.1Å; Y210-T214 PolarHBondContact O-OG1 3.1Å; Y212-T214 PolarHBondContact O-N 3.47Å; T214-T216 VanDerWaalsContact C-N 3.31Å; T214-T216 PolarHBondContact O-N 2.99Å; T214-T217 PolarHBondContact O-N 2.7Å; T214-W249 HydrophobicContact CG2-CH2 3.51Å; T214-W249 HydrophobicContact CG2-CZ3 3.77Å; T214-F250 HydrophobicContact CG2-CD2 3.4Å; T214-F250 HydrophobicContact CG2-CE2 3.65Å |
| 215 | T | 91.3 | Very high | 91.5 | Very high | 14 Ų | 14 | 42.9 Ų | 42.9 | 9% | 0.086 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -62.8 | -36.6 | -179.6 | -69.5 | 0 | 0 | 0 | 0 | 112.6 | L189 S211 Y212 T217 S253 L257 | L189-T215 HydrophobicContact CD2-CG2 4.21Å; S211-T215 WeakPolarHBondContact O-CB 3.46Å; S211-T215 PolarHBondContact O-N 3Å; S211-T215 PolarHBondContact O-OG1 3.33Å; Y212-T215 PolarHBondContact O-N 3.46Å; T215-T217 PolarHBondContact O-N 2.81Å; T215-S253 WeakPolarHBondContact CB-OG 3.33Å; T215-S253 WeakPolarHBondContact CG2-OG 3.42Å; T215-S253 PolarHBondContact OG1-OG 3.39Å; T215-L257 WeakPolarHBondContact O-CD1 3.36Å |
| 216 | T | 91.5 | Very high | 90.2 | Very high | 36 Ų | 36 | 42.7 Ų | 42.7 | 22% | 0.221 | 22% | 0.215 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -84 | 6.2 | -179.3 | 55.7 | 0 | 0 | 0 | 0 | 114.3 | Y212 T214 I218 | Y212-T216 HydrophobicContact CD2-CG2 3.92Å; Y212-T216 HydrophobicContact CE1-CG2 4.33Å; Y212-T216 HydrophobicContact CE2-CG2 3.6Å; Y212-T216 HydrophobicContact CG-CG2 4.42Å; Y212-T216 WeakPolarHBondContact O-CB 3.48Å; Y212-T216 WeakPolarHBondContact O-CG2 3.37Å; Y212-T216 PolarHBondContact O-N 2.91Å; Y212-T216 PolarHBondContact O-OG1 2.74Å; T214-T216 VanDerWaalsContact C-N 3.31Å; T214-T216 PolarHBondContact O-N 2.99Å; T216-I218 PolarHBondContact O-N 1.99Å; T216-I218 VanDerWaalsContact OG1-CD1 3.31Å; T216-I218 WeakPolarHBondContact OG1-CD1 3.43Å; T216-I218 WeakPolarHBondContact OG1-CG1 3.5Å |
| 217 | T | 92.8 | Very high | 88.8 | Confident | 47 Ų | 47 | 41.7 Ų | 41.7 | 29% | 0.288 | 21% | 0.209 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 52.4 | 37.7 | -178.2 | 69.8 | 0 | 0 | 0 | 0 | 114 | V106 T214 T215 L254 | V106-T217 HydrophobicContact CG2-CG2 3.6Å; T214-T217 PolarHBondContact O-N 2.7Å; T215-T217 PolarHBondContact O-N 2.81Å; T217-L254 HydrophobicContact CG2-CD1 3.48Å; T217-L254 VanDerWaalsContact CG2-CD1 3.48Å; T217-L254 HydrophobicContact CG2-CD2 3.79Å; T217-L254 HydrophobicContact CG2-CG 4.3Å |
| 218 | I | 93.6 | Very high | 86.9 | Confident | 78 Ų | 78 | 43 Ų | 43 | 40% | 0.4 | 22% | 0.222 | S | C | . | . | trans | -85.9 | -42.3 | 173 | -63.5 | 173.4 | 0 | 0 | 0 | 110.1 | Y212 V213 T216 F220 | Y212-I218 HydrophobicContact CE1-CD1 4.24Å; V213-I218 HydrophobicContact CG1-CB 4.13Å; V213-I218 HydrophobicContact CG1-CG2 4.3Å; V213-I218 PolarHBondContact O-N 2.98Å; T216-I218 PolarHBondContact O-N 1.99Å; T216-I218 VanDerWaalsContact OG1-CD1 3.31Å; T216-I218 WeakPolarHBondContact OG1-CD1 3.43Å; T216-I218 WeakPolarHBondContact OG1-CG1 3.5Å; I218-F220 HydrophobicContact CG2-CD1 4.03Å; I218-F220 HydrophobicContact CG2-CD2 3.87Å; I218-F220 HydrophobicContact CG2-CE1 3.68Å; I218-F220 HydrophobicContact CG2-CE2 3.52Å; I218-F220 HydrophobicContact CG2-CG 4.12Å; I218-F220 HydrophobicContact CG2-CZ 3.42Å; I218-F220 VanDerWaalsContact CG2-CZ 3.42Å; I218-F220 PolarHBondContact O-N 2.86Å | ||
| 219 | G | 91.9 | Very high | 84.7 | Confident | 6 Ų | 6 | 41.9 Ų | 41.9 | 6% | 0.062 | 22% | 0.222 | C | C | . | . | trans | 60.8 | 42.3 | 164.3 | 0 | 0 | 0 | 0 | 0 | 116.7 | Y108 V213 G221 | Y108-G219 WeakPolarHBondContact CA-O 3.48Å; V213-G219 PolarHBondContact O-N 2.68Å; V213-G219 VanDerWaalsContact O-N 3.16Å; G219-G221 PolarHBondContact O-N 3.06Å | ||
| 220 | F | 89.8 | Confident | 82.6 | Confident | 128 Ų | 128 | 45.6 Ų | 45.6 | 56% | 0.561 | 25% | 0.248 | S | C | * | . | trans | -56.9 | -31.5 | -178.5 | -67 | -55 | 0 | 0 | 0 | 114.9 | Y209 V213 I218 D222 | Y209-F220 VanDerWaalsContact OH-CD2 3.24Å; Y209-F220 WeakPolarHBondContact OH-CD2 3.27Å; V213-F220 HydrophobicContact CG1-CB 4.27Å; V213-F220 HydrophobicContact CG1-CD2 3.73Å; V213-F220 HydrophobicContact CG1-CG 4.25Å; V213-F220 HydrophobicContact CG2-CD2 3.89Å; V213-F220 HydrophobicContact CG2-CE2 4.14Å; I218-F220 HydrophobicContact CG2-CD1 4.03Å; I218-F220 HydrophobicContact CG2-CD2 3.87Å; I218-F220 HydrophobicContact CG2-CE1 3.68Å; I218-F220 HydrophobicContact CG2-CE2 3.52Å; I218-F220 HydrophobicContact CG2-CG 4.12Å; I218-F220 HydrophobicContact CG2-CZ 3.42Å; I218-F220 VanDerWaalsContact CG2-CZ 3.42Å; I218-F220 PolarHBondContact O-N 2.86Å; F220-D222 PolarHBondContact O-N 3.21Å | ||
| 221 | G | 88.1 | Confident | 80.8 | Confident | 18 Ų | 18 | 47.4 Ų | 47.4 | 19% | 0.186 | 26% | 0.256 | C | S | . | . | trans | 76.5 | 5.8 | 175.7 | 0 | 0 | 0 | 0 | 0 | 115.5 | Y108 G219 Y223 | Y108-G221 WeakPolarHBondContact O-CA 3.36Å; G219-G221 PolarHBondContact O-N 3.06Å; G221-Y223 VanDerWaalsContact C-N 3.33Å | ||
| 222 | D | 88.5 | Confident | 78.8 | Confident | 80 Ų | 80 | 52.3 Ų | 52.3 | 43% | 0.428 | 29% | 0.288 | S | S | . | . | S | Bend | trans | -59.9 | -41.1 | 166.5 | 50.6 | -2.9 | 0 | 0 | 0 | 112.2 | Y209 F220 | Y209-D222 WeakPolarHBondContact CE1-OD2 3.43Å; Y209-D222 VanDerWaalsContact CZ-OD2 3.3Å; Y209-D222 PolarHBondContact OH-OD2 3.22Å; F220-D222 PolarHBondContact O-N 3.21Å |
| 223 | Y | 88.8 | Confident | 77.1 | Confident | 82 Ų | 82 | 53.5 Ų | 53.5 | 32% | 0.322 | 30% | 0.295 | S | S | . | . | S | Bend | trans | -120 | 125.9 | 169.2 | -61.7 | -84.9 | 0 | 0 | 0 | 110 | W202 I206 Y209 Y210 G221 | W202-Y223 HydrophobicContact CD2-CD1 4.37Å; W202-Y223 HydrophobicContact CZ2-CD1 4.29Å; I206-Y223 HydrophobicContact CD1-CE1 4.04Å; I206-Y223 HydrophobicContact CG2-CD1 3.42Å; I206-Y223 VanDerWaalsContact CG2-CD1 3.42Å; I206-Y223 HydrophobicContact CG2-CD2 4.05Å; I206-Y223 HydrophobicContact CG2-CE1 3.43Å; I206-Y223 VanDerWaalsContact CG2-CE1 3.43Å; I206-Y223 HydrophobicContact CG2-CE2 4.05Å; I206-Y223 HydrophobicContact CG2-CG 3.76Å; Y209-Y223 HydrophobicContact CD1-CD2 4.09Å; Y209-Y223 AromaticContact CE1-CD2 3.91Å; Y209-Y223 HydrophobicContact CE1-CD2 3.91Å; Y209-Y223 HydrophobicContact CE1-CE2 4.32Å; Y210-Y223 WeakPolarHBondContact CD2-O 3.47Å; Y210-Y223 WeakPolarHBondContact CE2-O 3.23Å; G221-Y223 VanDerWaalsContact C-N 3.33Å |
| 224 | V | 87 | Confident | 75.2 | Confident | 13 Ų | 13 | 60.7 Ų | 60.7 | 8% | 0.079 | 33% | 0.329 | C | S | . | . | trans | -140.7 | 135.7 | 172.4 | -176.3 | 0 | 0 | 0 | 0 | 107.5 | F97 Y108 N110 T226 | F97-V224 HydrophobicContact CE1-CG1 3.96Å; F97-V224 HydrophobicContact CZ-CG1 4.43Å; Y108-V224 HydrophobicContact CD1-CG2 3.95Å; Y108-V224 HydrophobicContact CD2-CG2 4.34Å; Y108-V224 HydrophobicContact CE1-CG2 4.42Å; Y108-V224 HydrophobicContact CG-CG2 3.88Å; N110-V224 HydrophobicContact CB-CG2 4.43Å; V224-T226 PolarHBondContact O-N 3.36Å; V224-T226 PolarHBondContact O-OG1 3.37Å | ||
| 225 | P | 81.5 | Confident | 73.4 | Confident | 4 Ų | 4 | 67.1 Ų | 67.1 | 3% | 0.026 | 36% | 0.357 | C | S | . | . | trans | -46.3 | 115.3 | 175.8 | -36.1 | 40 | 0 | 0 | 0 | 111.4 | F196 E200 Y210 F227 V246 | F196-P225 HydrophobicContact CD1-CG 4.41Å; F196-P225 HydrophobicContact CE1-CG 3.94Å; E200-P225 VanDerWaalsContact OE1-CA 3.23Å; E200-P225 WeakPolarHBondContact OE1-CA 3.36Å; E200-P225 VanDerWaalsContact OE1-CB 3.29Å; E200-P225 WeakPolarHBondContact OE1-CB 3.29Å; Y210-P225 HydrophobicContact CE1-CG 3.94Å; Y210-P225 HydrophobicContact CE2-CG 4.44Å; Y210-P225 VanDerWaalsContact OH-CD 3.23Å; Y210-P225 WeakPolarHBondContact OH-CD 3.48Å; Y210-P225 WeakPolarHBondContact OH-CG 3.21Å; P225-F227 HydrophobicContact CB-CE1 4.32Å; P225-F227 HydrophobicContact CB-CE2 3.66Å; P225-F227 HydrophobicContact CB-CZ 3.55Å; P225-F227 WeakPolarHBondContact O-CD2 3.5Å; P225-F227 WeakPolarHBondContact O-CE2 3.36Å; P225-F227 PolarHBondContact O-N 2.78Å; P225-V246 HydrophobicContact CG-CG1 4.45Å | ||
| 226 | T | 66 | Low | 72.2 | Confident | 80 Ų | 80 | 68.4 Ų | 68.4 | 49% | 0.491 | 37% | 0.373 | S | S | . | . | trans | -99 | 82.6 | -163 | -66 | 0 | 0 | 0 | 0 | 109.1 | E200 V224 G228 Q231 | E200-T226 PolarHBondContact OE1-N 2.87Å; E200-T226 PolarHBondContact OE2-N 2.84Å; V224-T226 PolarHBondContact O-N 3.36Å; V224-T226 PolarHBondContact O-OG1 3.37Å; T226-G228 PolarHBondContact O-N 3.4Å; T226-Q231 PolarHBondContact O-NE2 2.96Å; T226-Q231 VanDerWaalsContact O-NE2 3.15Å; T226-Q231 PolarHBondContact O-OE1 2.89Å | ||
| 227 | F | 64.4 | Low | 71.3 | Confident | 19 Ų | 19 | 69.3 Ų | 69.3 | 8% | 0.083 | 39% | 0.39 | C | S | . | . | trans | -67.9 | 30.8 | 175.6 | -48 | -78.5 | 0 | 0 | 0 | 113.8 | Y93 H94 P225 F239 Y242 Q243 | Y93-F227 HydrophobicContact CD1-CD2 4.22Å; Y93-F227 HydrophobicContact CD1-CE2 4.49Å; Y93-F227 HydrophobicContact CE1-CD1 4.44Å; Y93-F227 AromaticContact CE1-CD2 3.55Å; Y93-F227 HydrophobicContact CE1-CD2 3.55Å; Y93-F227 HydrophobicContact CE1-CE1 4.33Å; Y93-F227 AromaticContact CE1-CE2 3.43Å; Y93-F227 HydrophobicContact CE1-CE2 3.43Å; Y93-F227 VanDerWaalsContact CE1-CE2 3.43Å; Y93-F227 HydrophobicContact CE1-CG 4.08Å; Y93-F227 AromaticContact CE1-CZ 3.85Å; Y93-F227 HydrophobicContact CE1-CZ 3.85Å; Y93-F227 AromaticContact CZ-CE2 3.96Å; Y93-F227 AromaticContact CZ-CZ 3.93Å; Y93-F227 WeakPolarHBondContact OH-CZ 3.41Å; H94-F227 AromaticContact CE1-CD2 3.97Å; P225-F227 HydrophobicContact CB-CE1 4.32Å; P225-F227 HydrophobicContact CB-CE2 3.66Å; P225-F227 HydrophobicContact CB-CZ 3.55Å; P225-F227 WeakPolarHBondContact O-CD2 3.5Å; P225-F227 WeakPolarHBondContact O-CE2 3.36Å; P225-F227 PolarHBondContact O-N 2.78Å; F227-F239 HydrophobicContact CB-CE1 4.39Å; F227-F239 HydrophobicContact CB-CE2 4.49Å; F227-F239 HydrophobicContact CB-CZ 3.69Å; F227-F239 HydrophobicContact CD1-CE1 4.37Å; F227-F239 HydrophobicContact CD1-CE2 4.03Å; F227-F239 AromaticContact CD1-CZ 3.78Å; F227-F239 HydrophobicContact CD1-CZ 3.78Å; F227-F239 HydrophobicContact CG-CZ 4.24Å; F227-Y242 HydrophobicContact CD1-CE1 4.36Å; F227-Y242 AromaticContact CE1-CD1 3.84Å; F227-Y242 HydrophobicContact CE1-CD1 3.84Å; F227-Y242 AromaticContact CE1-CE1 3.62Å; F227-Y242 HydrophobicContact CE1-CE1 3.62Å; F227-Y242 HydrophobicContact CZ-CE1 4.32Å; F227-Q243 HydrophobicContact CD1-CG 3.53Å; F227-Q243 HydrophobicContact CE1-CB 4.4Å; F227-Q243 HydrophobicContact CE1-CG 3.39Å; F227-Q243 HydrophobicContact CG-CG 4.4Å; F227-Q243 HydrophobicContact CZ-CG 4.17Å | ||
| 228 | G | 54 | Low | 70.5 | Confident | 27 Ų | 27 | 75.1 Ų | 75.1 | 28% | 0.278 | 41% | 0.406 | S | S | . | . | trans | -78.2 | 167.5 | -174.3 | 0 | 0 | 0 | 0 | 0 | 113.8 | T226 N230 Q231 | T226-G228 PolarHBondContact O-N 3.4Å; G228-N230 VanDerWaalsContact C-N 3.26Å; G228-N230 PolarHBondContact O-N 3.28Å; G228-Q231 PolarHBondContact O-N 3.15Å | ||
| 229 | A | 49.8 | Very low | 69.7 | Low | 39 Ų | 39 | 73.7 Ų | 73.7 | 32% | 0.322 | 40% | 0.397 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -64.1 | -27.5 | -173.6 | 0 | 0 | 0 | 0 | 0 | 114.4 | P87 Q231 | P87-A229 HydrophobicContact CB-CB 4.18Å; P87-A229 HydrophobicContact CG-CB 3.85Å; A229-Q231 VanDerWaalsContact C-N 3.33Å; A229-Q231 PolarHBondContact O-N 3.06Å |
| 230 | N | 49.2 | Very low | 69.2 | Low | 162 Ų | 162 | 76.8 Ų | 76.8 | 87% | 0.866 | 42% | 0.415 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -79.2 | -10.7 | -173.9 | -56.2 | 31.4 | 0 | 0 | 0 | 113.7 | G228 | G228-N230 VanDerWaalsContact C-N 3.26Å; G228-N230 PolarHBondContact O-N 3.28Å |
| 231 | Q | 56.8 | Low | 69 | Low | 40 Ų | 40 | 74.7 Ų | 74.7 | 19% | 0.187 | 41% | 0.413 | C | S | . | . | S | Bend | trans | -73.1 | 127.4 | 167.2 | -76.7 | -174.1 | -3.5 | 0 | 0 | 108.7 | E200 T226 G228 A229 K233 | E200-Q231 PolarHBondContact OE2-NE2 3.2Å; T226-Q231 PolarHBondContact O-NE2 2.96Å; T226-Q231 VanDerWaalsContact O-NE2 3.15Å; T226-Q231 PolarHBondContact O-OE1 2.89Å; G228-Q231 PolarHBondContact O-N 3.15Å; A229-Q231 VanDerWaalsContact C-N 3.33Å; A229-Q231 PolarHBondContact O-N 3.06Å; Q231-K233 PolarHBondContact O-N 3.22Å; Q231-K233 VanDerWaalsContact O-N 3.1Å |
| 232 | P | 51.5 | Low | 68.9 | Low | 102 Ų | 102 | 74.1 Ų | 74.1 | 66% | 0.662 | 41% | 0.405 | S | S | * | . | trans | -67 | 114 | -173.9 | 28.1 | -35.5 | 0 | 0 | 0 | 110.3 | E234 | P232-E234 HydrophobicContact CB-CG 4.01Å; P232-E234 PolarHBondContact O-N 3.46Å | ||
| 233 | K | 56.2 | Low | 68.7 | Low | 144 Ų | 144 | 71.7 Ų | 71.7 | 63% | 0.626 | 39% | 0.391 | S | S | * | . | G | 310 helix | trans | -75.6 | 21.2 | -172.3 | -61.6 | 175.3 | -173.7 | 163.1 | 0 | 114.3 | Q231 F235 G236 | Q231-K233 PolarHBondContact O-N 3.22Å; Q231-K233 VanDerWaalsContact O-N 3.1Å; K233-F235 PolarHBondContact O-N 2.96Å; K233-G236 PolarHBondContact O-N 3.02Å |
| 234 | E | 54.3 | Low | 68.7 | Low | 155 Ų | 155 | 72.6 Ų | 72.6 | 72% | 0.724 | 40% | 0.4 | S | S | * | . | G | 310 helix | trans | -42 | -36.7 | 176.9 | -59.9 | -75.8 | 121.6 | 0 | 0 | 112.8 | P232 | P232-E234 HydrophobicContact CB-CG 4.01Å; P232-E234 PolarHBondContact O-N 3.46Å |
| 235 | F | 53.7 | Low | 68.9 | Low | 135 Ų | 135 | 75.1 Ų | 75.1 | 59% | 0.592 | 41% | 0.41 | S | S | * | . | G | 310 helix | trans | -119.5 | 49.5 | -173.4 | -63.8 | -67.6 | 0 | 0 | 0 | 112.8 | K233 G237 W238 F239 | K233-F235 PolarHBondContact O-N 2.96Å; F235-G237 PolarHBondContact O-N 3.16Å; F235-W238 HydrophobicContact CB-CB 4.04Å; F235-W238 HydrophobicContact CB-CG 4.33Å; F235-W238 AromaticContact CD1-CD1 3.92Å; F235-W238 WeakPolarHBondContact O-CA 3.47Å; F235-W238 PolarHBondContact O-N 3.3Å; F235-F239 PolarHBondContact O-N 3.41Å |
| 236 | G | 66.5 | Low | 69.4 | Low | 41 Ų | 41 | 75 Ų | 75 | 42% | 0.423 | 41% | 0.409 | S | S | . | . | H | α-helix | trans | -47.4 | -35.7 | -175.6 | 0 | 0 | 0 | 0 | 0 | 116 | K233 V240 | K233-G236 PolarHBondContact O-N 3.02Å; G236-V240 PolarHBondContact O-N 3.34Å |
| 237 | G | 72.4 | Confident | 70.5 | Confident | 56 Ų | 56 | 72.3 Ų | 72.3 | 58% | 0.577 | 39% | 0.392 | S | S | * | . | H | α-helix | trans | -69.5 | -43 | 173.4 | 0 | 0 | 0 | 0 | 0 | 114 | F235 F239 V240 V241 | F235-G237 PolarHBondContact O-N 3.16Å; G237-F239 VanDerWaalsContact C-N 3.31Å; G237-F239 PolarHBondContact O-N 2.95Å; G237-V240 PolarHBondContact O-N 3.25Å; G237-V241 PolarHBondContact O-N 3.21Å |
| 238 | W | 76 | Confident | 71.9 | Confident | 169 Ų | 169 | 74.6 Ų | 74.6 | 64% | 0.64 | 41% | 0.407 | S | S | * | . | H | α-helix | trans | -69.4 | -29.9 | 177.4 | -63.6 | 98.5 | 0 | 0 | 0 | 112.3 | F235 V240 V241 Y242 | F235-W238 HydrophobicContact CB-CB 4.04Å; F235-W238 HydrophobicContact CB-CG 4.33Å; F235-W238 AromaticContact CD1-CD1 3.92Å; F235-W238 WeakPolarHBondContact O-CA 3.47Å; F235-W238 PolarHBondContact O-N 3.3Å; W238-V240 VanDerWaalsContact C-N 3.35Å; W238-V241 CarbonylContact O-C 3.59Å; W238-V241 WeakPolarHBondContact O-CB 3.38Å; W238-V241 PolarHBondContact O-N 3.19Å; W238-Y242 WeakPolarHBondContact O-CB 3.48Å; W238-Y242 PolarHBondContact O-N 3.1Å |
| 239 | F | 77.1 | Confident | 73.7 | Confident | 47 Ų | 47 | 74 Ų | 74 | 21% | 0.206 | 40% | 0.396 | C | S | . | . | H | α-helix | trans | -62.3 | -39.4 | 172.6 | -174.4 | -103 | 0 | 0 | 0 | 112.2 | F227 F235 G237 Y242 Q243 | F227-F239 HydrophobicContact CB-CE1 4.39Å; F227-F239 HydrophobicContact CB-CE2 4.49Å; F227-F239 HydrophobicContact CB-CZ 3.69Å; F227-F239 HydrophobicContact CD1-CE1 4.37Å; F227-F239 HydrophobicContact CD1-CE2 4.03Å; F227-F239 AromaticContact CD1-CZ 3.78Å; F227-F239 HydrophobicContact CD1-CZ 3.78Å; F227-F239 HydrophobicContact CG-CZ 4.24Å; F235-F239 PolarHBondContact O-N 3.41Å; G237-F239 VanDerWaalsContact C-N 3.31Å; G237-F239 PolarHBondContact O-N 2.95Å; F239-Y242 PolarHBondContact O-N 3.06Å; F239-Q243 WeakPolarHBondContact O-CG 3.48Å; F239-Q243 PolarHBondContact O-N 3.3Å |
| 240 | V | 81.1 | Confident | 75.7 | Confident | 71 Ų | 71 | 72.4 Ų | 72.4 | 43% | 0.43 | 38% | 0.382 | S | S | . | . | H | α-helix | trans | -68 | -38.4 | 172.4 | 176.7 | 0 | 0 | 0 | 0 | 111.4 | G236 G237 W238 Y242 Q243 I244 | G236-V240 PolarHBondContact O-N 3.34Å; G237-V240 PolarHBondContact O-N 3.25Å; W238-V240 VanDerWaalsContact C-N 3.35Å; V240-Y242 VanDerWaalsContact C-N 3.32Å; V240-Y242 PolarHBondContact O-N 3.46Å; V240-Q243 PolarHBondContact O-N 3.21Å; V240-I244 HydrophobicContact CG1-CD1 4Å; V240-I244 WeakPolarHBondContact O-CG1 3.19Å; V240-I244 PolarHBondContact O-N 3.45Å |
| 241 | V | 85.3 | Confident | 77.8 | Confident | 85 Ų | 85 | 66.5 Ų | 66.5 | 52% | 0.515 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -62.1 | -40.5 | 172.8 | 175.1 | 0 | 0 | 0 | 0 | 111.1 | G237 W238 I244 F245 | G237-V241 PolarHBondContact O-N 3.21Å; W238-V241 CarbonylContact O-C 3.59Å; W238-V241 WeakPolarHBondContact O-CB 3.38Å; W238-V241 PolarHBondContact O-N 3.19Å; V241-I244 PolarHBondContact O-N 2.99Å; V241-F245 VanDerWaalsContact O-CB 3.28Å; V241-F245 WeakPolarHBondContact O-CB 3.38Å; V241-F245 PolarHBondContact O-N 3.02Å |
| 242 | Y | 86.7 | Confident | 79.5 | Confident | 5 Ų | 5 | 69 Ų | 69 | 2% | 0.02 | 36% | 0.36 | C | S | . | . | H | α-helix | trans | -64.7 | -46.7 | 174.9 | 171.5 | -115.3 | 0 | 0 | 0 | 112.1 | V195 F196 F199 E200 F227 W238 F239 V240 I244 F245 V246 | V195-Y242 HydrophobicContact CG1-CD2 4.46Å; V195-Y242 HydrophobicContact CG1-CE2 4.4Å; F196-Y242 HydrophobicContact CD1-CE2 4.17Å; F196-Y242 VanDerWaalsContact CD1-OH 3.25Å; F196-Y242 WeakPolarHBondContact CD1-OH 3.12Å; F196-Y242 HydrophobicContact CE1-CE2 4.02Å; F196-Y242 WeakPolarHBondContact CE1-OH 3.24Å; F199-Y242 HydrophobicContact CB-CD1 4.41Å; F199-Y242 HydrophobicContact CB-CD2 4.15Å; F199-Y242 HydrophobicContact CB-CE1 4.07Å; F199-Y242 HydrophobicContact CB-CE2 3.81Å; F199-Y242 HydrophobicContact CB-CG 4.44Å; F199-Y242 HydrophobicContact CD1-CD1 4.19Å; F199-Y242 HydrophobicContact CD1-CD2 4.16Å; F199-Y242 AromaticContact CD1-CG 3.92Å; F199-Y242 HydrophobicContact CD1-CG 3.92Å; F199-Y242 AromaticContact CD2-CD2 3.71Å; F199-Y242 HydrophobicContact CD2-CD2 3.71Å; F199-Y242 AromaticContact CD2-CE2 3.99Å; F199-Y242 HydrophobicContact CD2-CE2 3.99Å; F199-Y242 HydrophobicContact CD2-CG 4.3Å; F199-Y242 HydrophobicContact CE1-CG 4.23Å; F199-Y242 HydrophobicContact CE2-CD2 4.13Å; F199-Y242 HydrophobicContact CG-CD1 4.32Å; F199-Y242 AromaticContact CG-CD2 3.73Å; F199-Y242 HydrophobicContact CG-CD2 3.73Å; F199-Y242 HydrophobicContact CG-CE1 4.45Å; F199-Y242 AromaticContact CG-CE2 3.91Å; F199-Y242 HydrophobicContact CG-CE2 3.91Å; F199-Y242 AromaticContact CG-CG 3.96Å; F199-Y242 HydrophobicContact CG-CG 3.96Å; E200-Y242 WeakPolarHBondContact CG-OH 3.41Å; E200-Y242 VanDerWaalsContact OE1-CE1 3.31Å; E200-Y242 WeakPolarHBondContact OE1-CE1 3.24Å; E200-Y242 PolarHBondContact OE1-OH 3.34Å; F227-Y242 HydrophobicContact CD1-CE1 4.36Å; F227-Y242 AromaticContact CE1-CD1 3.84Å; F227-Y242 HydrophobicContact CE1-CD1 3.84Å; F227-Y242 AromaticContact CE1-CE1 3.62Å; F227-Y242 HydrophobicContact CE1-CE1 3.62Å; F227-Y242 HydrophobicContact CZ-CE1 4.32Å; W238-Y242 WeakPolarHBondContact O-CB 3.48Å; W238-Y242 PolarHBondContact O-N 3.1Å; F239-Y242 PolarHBondContact O-N 3.06Å; V240-Y242 VanDerWaalsContact C-N 3.32Å; V240-Y242 PolarHBondContact O-N 3.46Å; Y242-I244 VanDerWaalsContact C-N 3.34Å; Y242-I244 PolarHBondContact O-N 3.44Å; Y242-F245 HydrophobicContact CD2-CD1 4.38Å; Y242-F245 WeakPolarHBondContact O-CB 3.37Å; Y242-F245 PolarHBondContact O-N 3.36Å; Y242-F245 VanDerWaalsContact O-N 3.1Å; Y242-V246 HydrophobicContact CD2-CG2 4.14Å; Y242-V246 HydrophobicContact CE1-CG2 4.43Å; Y242-V246 HydrophobicContact CE2-CG2 3.69Å; Y242-V246 WeakPolarHBondContact O-CG2 3.49Å; Y242-V246 PolarHBondContact O-N 3.4Å |
| 243 | Q | 85.3 | Confident | 81.4 | Confident | 30 Ų | 30 | 64.1 Ų | 64.1 | 14% | 0.14 | 33% | 0.329 | C | S | . | . | H | α-helix | trans | -53.7 | -47.2 | 172.8 | -83.4 | -177.6 | -12.2 | 0 | 0 | 112.6 | Y93 F227 F239 V240 V246 I247 | Y93-Q243 HydrophobicContact CD2-CB 4.18Å; Y93-Q243 HydrophobicContact CD2-CG 4.15Å; Y93-Q243 HydrophobicContact CE1-CG 4.11Å; Y93-Q243 HydrophobicContact CE2-CB 3.53Å; Y93-Q243 HydrophobicContact CE2-CG 3.71Å; Y93-Q243 PolarHBondContact OH-O 2.82Å; F227-Q243 HydrophobicContact CD1-CG 3.53Å; F227-Q243 HydrophobicContact CE1-CB 4.4Å; F227-Q243 HydrophobicContact CE1-CG 3.39Å; F227-Q243 HydrophobicContact CG-CG 4.4Å; F227-Q243 HydrophobicContact CZ-CG 4.17Å; F239-Q243 WeakPolarHBondContact O-CG 3.48Å; F239-Q243 PolarHBondContact O-N 3.3Å; V240-Q243 PolarHBondContact O-N 3.21Å; Q243-V246 PolarHBondContact O-N 3.15Å; Q243-I247 PolarHBondContact O-N 3.01Å |
| 244 | I | 88.4 | Confident | 83.1 | Confident | 100 Ų | 100 | 57.8 Ų | 57.8 | 51% | 0.513 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -65.9 | -42.2 | 176 | -66.2 | 166.3 | 0 | 0 | 0 | 110.7 | V240 V241 Y242 V246 I247 V248 | V240-I244 HydrophobicContact CG1-CD1 4Å; V240-I244 WeakPolarHBondContact O-CG1 3.19Å; V240-I244 PolarHBondContact O-N 3.45Å; V241-I244 PolarHBondContact O-N 2.99Å; Y242-I244 VanDerWaalsContact C-N 3.34Å; Y242-I244 PolarHBondContact O-N 3.44Å; I244-V246 PolarHBondContact O-N 2.87Å; I244-I247 PolarHBondContact O-N 2.97Å; I244-V248 HydrophobicContact CG2-CG2 4.11Å; I244-V248 WeakPolarHBondContact O-CB 3.36Å; I244-V248 VanDerWaalsContact O-CG2 3.32Å; I244-V248 WeakPolarHBondContact O-CG2 3.18Å; I244-V248 PolarHBondContact O-N 3.03Å |
| 245 | F | 91.1 | Very high | 84.9 | Confident | 67 Ų | 67 | 50.4 Ų | 50.4 | 29% | 0.294 | 27% | 0.268 | S | S | . | . | H | α-helix | trans | -58.2 | -44.9 | 177.1 | 167.5 | -95.2 | 0 | 0 | 0 | 112 | V195 V241 Y242 I247 V248 W249 | V195-F245 HydrophobicContact CB-CE1 4.23Å; V195-F245 HydrophobicContact CG1-CD1 4.28Å; V195-F245 HydrophobicContact CG1-CE1 3.79Å; V195-F245 HydrophobicContact CG1-CZ 4.38Å; V195-F245 HydrophobicContact CG2-CE1 4.43Å; V195-F245 HydrophobicContact CG2-CZ 4.25Å; V241-F245 VanDerWaalsContact O-CB 3.28Å; V241-F245 WeakPolarHBondContact O-CB 3.38Å; V241-F245 PolarHBondContact O-N 3.02Å; Y242-F245 HydrophobicContact CD2-CD1 4.38Å; Y242-F245 WeakPolarHBondContact O-CB 3.37Å; Y242-F245 PolarHBondContact O-N 3.36Å; Y242-F245 VanDerWaalsContact O-N 3.1Å; F245-I247 PolarHBondContact O-N 3.45Å; F245-V248 PolarHBondContact O-N 3.39Å; F245-W249 HydrophobicContact CE1-CB 4.45Å; F245-W249 HydrophobicContact CE2-CB 4.41Å; F245-W249 HydrophobicContact CZ-CB 4.25Å; F245-W249 VanDerWaalsContact O-CB 3.24Å; F245-W249 WeakPolarHBondContact O-CB 3.42Å; F245-W249 PolarHBondContact O-N 2.91Å |
| 246 | V | 91 | Very high | 86.6 | Confident | 1 Ų | 1 | 45 Ų | 45 | 1% | 0.006 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -59.4 | -46.8 | 178.7 | 173.5 | 0 | 0 | 0 | 0 | 111 | F97 F196 P225 Y242 Q243 I244 F250 | F97-V246 HydrophobicContact CE2-CG1 4.24Å; F196-V246 HydrophobicContact CE1-CG2 3.77Å; F196-V246 HydrophobicContact CZ-CG2 4.16Å; P225-V246 HydrophobicContact CG-CG1 4.45Å; Y242-V246 HydrophobicContact CD2-CG2 4.14Å; Y242-V246 HydrophobicContact CE1-CG2 4.43Å; Y242-V246 HydrophobicContact CE2-CG2 3.69Å; Y242-V246 WeakPolarHBondContact O-CG2 3.49Å; Y242-V246 PolarHBondContact O-N 3.4Å; Q243-V246 PolarHBondContact O-N 3.15Å; I244-V246 PolarHBondContact O-N 2.87Å; V246-F250 WeakPolarHBondContact O-CB 3.48Å; V246-F250 PolarHBondContact O-N 3.45Å |
| 247 | I | 90.7 | Very high | 87.8 | Confident | 24 Ų | 24 | 44.7 Ų | 44.7 | 12% | 0.123 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -63.2 | -46.6 | 177.6 | -65 | 161.9 | 0 | 0 | 0 | 110.9 | Y93 F96 F97 F100 Q243 I244 F245 F250 I251 | Y93-I247 HydrophobicContact CE2-CD1 3.64Å; F96-I247 HydrophobicContact CD1-CD1 4.03Å; F96-I247 HydrophobicContact CE1-CD1 3.88Å; F96-I247 HydrophobicContact CE1-CG2 4.37Å; F97-I247 HydrophobicContact CD2-CG1 4.49Å; F100-I247 HydrophobicContact CE1-CG2 4.27Å; Q243-I247 PolarHBondContact O-N 3.01Å; I244-I247 PolarHBondContact O-N 2.97Å; F245-I247 PolarHBondContact O-N 3.45Å; I247-F250 PolarHBondContact O-N 2.83Å; I247-I251 HydrophobicContact CG2-CD1 3.91Å; I247-I251 VanDerWaalsContact O-CG1 3.29Å; I247-I251 WeakPolarHBondContact O-CG1 3.03Å; I247-I251 PolarHBondContact O-N 3.14Å |
| 248 | V | 92.2 | Very high | 88.6 | Confident | 66 Ų | 66 | 43.8 Ų | 43.8 | 40% | 0.4 | 22% | 0.215 | S | C | . | . | H | α-helix | trans | -67.5 | -47 | -178 | 171.4 | 0 | 0 | 0 | 0 | 111.9 | I244 F245 F250 I251 F252 | I244-V248 HydrophobicContact CG2-CG2 4.11Å; I244-V248 WeakPolarHBondContact O-CB 3.36Å; I244-V248 VanDerWaalsContact O-CG2 3.32Å; I244-V248 WeakPolarHBondContact O-CG2 3.18Å; I244-V248 PolarHBondContact O-N 3.03Å; F245-V248 PolarHBondContact O-N 3.39Å; V248-F250 VanDerWaalsContact C-N 3.29Å; V248-F250 PolarHBondContact O-N 2.91Å; V248-I251 PolarHBondContact O-N 3.41Å; V248-F252 HydrophobicContact CG1-CD2 4.05Å; V248-F252 HydrophobicContact CG1-CE2 3.98Å; V248-F252 VanDerWaalsContact O-CD2 3.23Å; V248-F252 WeakPolarHBondContact O-CD2 3.24Å; V248-F252 PolarHBondContact O-N 3.42Å |
| 249 | W | 93.5 | Very high | 89.3 | Confident | 15 Ų | 15 | 35.9 Ų | 35.9 | 6% | 0.057 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -53.3 | -49.5 | 173.5 | 156.8 | 67 | 0 | 0 | 0 | 110.2 | F188 P192 F196 Y210 T214 F245 I251 F252 S253 | F188-W249 PolarHBondContact O-NE1 2.7Å; P192-W249 HydrophobicContact CB-CD2 4.24Å; P192-W249 HydrophobicContact CB-CG 4.37Å; P192-W249 HydrophobicContact CB-CZ2 4.23Å; P192-W249 HydrophobicContact CG-CZ2 4.15Å; F196-W249 HydrophobicContact CE2-CE3 4.15Å; F196-W249 AromaticContact CE2-CH2 3.75Å; F196-W249 HydrophobicContact CE2-CH2 3.75Å; F196-W249 HydrophobicContact CE2-CZ2 4.23Å; F196-W249 AromaticContact CE2-CZ3 3.72Å; F196-W249 HydrophobicContact CE2-CZ3 3.72Å; F196-W249 AromaticContact CZ-CE3 3.81Å; F196-W249 HydrophobicContact CZ-CE3 3.81Å; F196-W249 HydrophobicContact CZ-CH2 4.06Å; F196-W249 AromaticContact CZ-CZ3 3.53Å; F196-W249 HydrophobicContact CZ-CZ3 3.53Å; Y210-W249 HydrophobicContact CE1-CH2 4.12Å; Y210-W249 HydrophobicContact CE1-CZ3 4.15Å; T214-W249 HydrophobicContact CG2-CH2 3.51Å; T214-W249 HydrophobicContact CG2-CZ3 3.77Å; F245-W249 HydrophobicContact CE1-CB 4.45Å; F245-W249 HydrophobicContact CE2-CB 4.41Å; F245-W249 HydrophobicContact CZ-CB 4.25Å; F245-W249 VanDerWaalsContact O-CB 3.24Å; F245-W249 WeakPolarHBondContact O-CB 3.42Å; F245-W249 PolarHBondContact O-N 2.91Å; W249-I251 PolarHBondContact O-N 3.35Å; W249-F252 PolarHBondContact O-N 3.36Å; W249-S253 WeakPolarHBondContact O-CB 3.43Å; W249-S253 PolarHBondContact O-N 3.14Å |
| 250 | F | 91.6 | Very high | 89.8 | Confident | 6 Ų | 6 | 35.1 Ų | 35.1 | 3% | 0.026 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -62 | -45.2 | -178.6 | 179.2 | -79.4 | 0 | 0 | 0 | 112.3 | F100 S104 V106 T214 V246 I247 V248 F252 S253 L254 | F100-F250 HydrophobicContact CD1-CD1 4.43Å; F100-F250 AromaticContact CE1-CD1 3.25Å; F100-F250 HydrophobicContact CE1-CD1 3.25Å; F100-F250 AromaticContact CE1-CE1 3.63Å; F100-F250 HydrophobicContact CE1-CE1 3.63Å; F100-F250 HydrophobicContact CE1-CG 4.08Å; F100-F250 AromaticContact CZ-CD1 3.39Å; F100-F250 HydrophobicContact CZ-CD1 3.39Å; F100-F250 AromaticContact CZ-CE1 3.65Å; F100-F250 HydrophobicContact CZ-CE1 3.65Å; S104-F250 WeakPolarHBondContact OG-CZ 3.12Å; V106-F250 HydrophobicContact CB-CZ 4.38Å; V106-F250 HydrophobicContact CG2-CE2 3.89Å; V106-F250 HydrophobicContact CG2-CZ 3.52Å; T214-F250 HydrophobicContact CG2-CD2 3.4Å; T214-F250 HydrophobicContact CG2-CE2 3.65Å; V246-F250 WeakPolarHBondContact O-CB 3.48Å; V246-F250 PolarHBondContact O-N 3.45Å; I247-F250 PolarHBondContact O-N 2.83Å; V248-F250 VanDerWaalsContact C-N 3.29Å; V248-F250 PolarHBondContact O-N 2.91Å; F250-F252 VanDerWaalsContact C-N 3.32Å; F250-F252 PolarHBondContact O-N 3.06Å; F250-S253 PolarHBondContact O-N 3.06Å; F250-L254 HydrophobicContact CE1-CD2 3.84Å; F250-L254 HydrophobicContact CZ-CD2 3.92Å; F250-L254 WeakPolarHBondContact O-CB 3.21Å; F250-L254 PolarHBondContact O-N 3.09Å |
| 251 | I | 92.1 | Very high | 90.1 | Very high | 38 Ų | 38 | 36.6 Ų | 36.6 | 20% | 0.195 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -57 | -46.7 | 175.8 | -70.3 | 167.8 | 0 | 0 | 0 | 110.8 | F100 L140 I247 V248 W249 G255 | F100-I251 HydrophobicContact CE1-CG1 4.31Å; F100-I251 HydrophobicContact CE2-CD1 4.38Å; F100-I251 HydrophobicContact CE2-CG1 3.94Å; F100-I251 HydrophobicContact CZ-CD1 4.14Å; F100-I251 HydrophobicContact CZ-CG1 3.41Å; F100-I251 VanDerWaalsContact CZ-CG1 3.41Å; L140-I251 HydrophobicContact CD1-CG2 3.6Å; I247-I251 HydrophobicContact CG2-CD1 3.91Å; I247-I251 VanDerWaalsContact O-CG1 3.29Å; I247-I251 WeakPolarHBondContact O-CG1 3.03Å; I247-I251 PolarHBondContact O-N 3.14Å; V248-I251 PolarHBondContact O-N 3.41Å; W249-I251 PolarHBondContact O-N 3.35Å; I251-G255 PolarHBondContact O-N 2.9Å; I251-G255 VanDerWaalsContact O-N 3.09Å |
| 252 | F | 92.4 | Very high | 90.1 | Very high | 91 Ų | 91 | 35.1 Ų | 35.1 | 40% | 0.399 | 18% | 0.178 | S | C | . | . | H | α-helix | trans | -70 | -39.4 | -179.5 | -80.8 | -123.2 | 0 | 0 | 0 | 111.4 | F144 F188 V248 W249 F250 G255 Y256 | F144-F252 AromaticContact CE1-CD1 3.9Å; F144-F252 HydrophobicContact CE1-CD1 3.9Å; F144-F252 HydrophobicContact CE1-CE1 4.33Å; F144-F252 WeakPolarHBondContact CE2-O 3.16Å; F144-F252 HydrophobicContact CZ-CB 4.06Å; F144-F252 AromaticContact CZ-CD1 3.57Å; F144-F252 HydrophobicContact CZ-CD1 3.57Å; F144-F252 HydrophobicContact CZ-CE1 4.25Å; F144-F252 AromaticContact CZ-CG 3.97Å; F144-F252 HydrophobicContact CZ-CG 3.97Å; F188-F252 HydrophobicContact CE1-CB 3.68Å; F188-F252 HydrophobicContact CZ-CB 4.1Å; V248-F252 HydrophobicContact CG1-CD2 4.05Å; V248-F252 HydrophobicContact CG1-CE2 3.98Å; V248-F252 VanDerWaalsContact O-CD2 3.23Å; V248-F252 WeakPolarHBondContact O-CD2 3.24Å; V248-F252 PolarHBondContact O-N 3.42Å; W249-F252 PolarHBondContact O-N 3.36Å; F250-F252 VanDerWaalsContact C-N 3.32Å; F250-F252 PolarHBondContact O-N 3.06Å; F252-G255 PolarHBondContact O-N 2.97Å; F252-Y256 VanDerWaalsContact O-CB 3.25Å; F252-Y256 WeakPolarHBondContact O-CB 3.47Å; F252-Y256 PolarHBondContact O-N 3.32Å |
| 253 | S | 92.8 | Very high | 89.9 | Confident | 1 Ų | 1 | 36.4 Ų | 36.4 | 1% | 0.007 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -63.5 | -44.6 | 179 | -164.6 | 0 | 0 | 0 | 0 | 111.8 | F188 T215 W249 F250 Y256 L257 | F188-S253 VanDerWaalsContact CD1-CA 3.48Å; T215-S253 WeakPolarHBondContact CB-OG 3.33Å; T215-S253 WeakPolarHBondContact CG2-OG 3.42Å; T215-S253 PolarHBondContact OG1-OG 3.39Å; W249-S253 WeakPolarHBondContact O-CB 3.43Å; W249-S253 PolarHBondContact O-N 3.14Å; F250-S253 PolarHBondContact O-N 3.06Å; S253-Y256 CarbonylContact O-C 3.53Å; S253-Y256 WeakPolarHBondContact O-CA 3.08Å; S253-Y256 WeakPolarHBondContact O-CB 3.36Å; S253-Y256 PolarHBondContact O-N 2.87Å; S253-Y256 VanDerWaalsContact O-N 3.16Å; S253-L257 PolarHBondContact O-N 3.11Å |
| 254 | L | 91 | Very high | 89.8 | Confident | 11 Ų | 11 | 38.2 Ų | 38.2 | 6% | 0.058 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -72.9 | -37.3 | 179.2 | -171.9 | 43.9 | 0 | 0 | 0 | 112.2 | F137 T217 F250 Y256 L257 V258 | F137-L254 HydrophobicContact CD1-CB 4.23Å; F137-L254 HydrophobicContact CD1-CG 4.17Å; F137-L254 HydrophobicContact CD2-CD2 4.11Å; F137-L254 HydrophobicContact CD2-CG 3.92Å; F137-L254 HydrophobicContact CE1-CB 3.95Å; F137-L254 HydrophobicContact CE1-CD2 4.16Å; F137-L254 HydrophobicContact CE1-CG 4Å; F137-L254 HydrophobicContact CE2-CD2 3.41Å; F137-L254 VanDerWaalsContact CE2-CD2 3.41Å; F137-L254 HydrophobicContact CE2-CG 3.71Å; F137-L254 HydrophobicContact CG-CG 4.16Å; F137-L254 HydrophobicContact CZ-CB 4.11Å; F137-L254 HydrophobicContact CZ-CD2 3.46Å; F137-L254 VanDerWaalsContact CZ-CD2 3.46Å; F137-L254 HydrophobicContact CZ-CG 3.77Å; T217-L254 HydrophobicContact CG2-CD1 3.48Å; T217-L254 VanDerWaalsContact CG2-CD1 3.48Å; T217-L254 HydrophobicContact CG2-CD2 3.79Å; T217-L254 HydrophobicContact CG2-CG 4.3Å; F250-L254 HydrophobicContact CE1-CD2 3.84Å; F250-L254 HydrophobicContact CZ-CD2 3.92Å; F250-L254 WeakPolarHBondContact O-CB 3.21Å; F250-L254 PolarHBondContact O-N 3.09Å; L254-Y256 PolarHBondContact O-N 3.31Å; L254-L257 HydrophobicContact CD1-CB 4.35Å; L254-L257 HydrophobicContact CD1-CD2 4.46Å; L254-L257 PolarHBondContact O-N 3.09Å; L254-V258 PolarHBondContact O-N 3.47Å |
| 255 | G | 91.7 | Very high | 89.6 | Confident | 0 Ų | 0 | 36.6 Ų | 36.6 | 0% | 0 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -60.4 | -33.7 | 167.1 | 0 | 0 | 0 | 0 | 0 | 113 | G141 I251 F252 V258 M259 | G141-G255 VanDerWaalsContact CA-O 3.28Å; G141-G255 WeakPolarHBondContact CA-O 3.22Å; I251-G255 PolarHBondContact O-N 2.9Å; I251-G255 VanDerWaalsContact O-N 3.09Å; F252-G255 PolarHBondContact O-N 2.97Å; G255-V258 PolarHBondContact O-N 2.81Å; G255-M259 PolarHBondContact O-N 3.47Å |
| 256 | Y | 90.9 | Very high | 89.1 | Confident | 22 Ų | 22 | 39.8 Ų | 39.8 | 9% | 0.086 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -75.3 | -34.5 | 175.4 | 179.9 | -97 | 0 | 0 | 0 | 113.1 | A180 G184 F188 F252 S253 L254 V258 M259 I260 | A180-Y256 PolarHBondContact O-OH 3.23Å; G184-Y256 WeakPolarHBondContact CA-OH 3.32Å; F188-Y256 AromaticContact CD2-CD1 3.38Å; F188-Y256 HydrophobicContact CD2-CD1 3.38Å; F188-Y256 HydrophobicContact CD2-CD2 4.16Å; F188-Y256 HydrophobicContact CD2-CE1 4.01Å; F188-Y256 AromaticContact CD2-CG 3.49Å; F188-Y256 HydrophobicContact CD2-CG 3.49Å; F188-Y256 VanDerWaalsContact CD2-CG 3.49Å; F188-Y256 VanDerWaalsContact CE2-CB 3.45Å; F188-Y256 AromaticContact CE2-CD1 3.74Å; F188-Y256 HydrophobicContact CE2-CD1 3.74Å; F188-Y256 AromaticContact CE2-CD2 3.67Å; F188-Y256 HydrophobicContact CE2-CD2 3.67Å; F188-Y256 HydrophobicContact CE2-CE1 4.49Å; F188-Y256 HydrophobicContact CE2-CE2 4.42Å; F188-Y256 AromaticContact CE2-CG 3.3Å; F188-Y256 HydrophobicContact CE2-CG 3.3Å; F188-Y256 HydrophobicContact CG-CD1 4.28Å; F188-Y256 HydrophobicContact CZ-CG 4.23Å; F252-Y256 VanDerWaalsContact O-CB 3.25Å; F252-Y256 WeakPolarHBondContact O-CB 3.47Å; F252-Y256 PolarHBondContact O-N 3.32Å; S253-Y256 CarbonylContact O-C 3.53Å; S253-Y256 WeakPolarHBondContact O-CA 3.08Å; S253-Y256 WeakPolarHBondContact O-CB 3.36Å; S253-Y256 PolarHBondContact O-N 2.87Å; S253-Y256 VanDerWaalsContact O-N 3.16Å; L254-Y256 PolarHBondContact O-N 3.31Å; Y256-V258 VanDerWaalsContact C-N 3.32Å; Y256-V258 PolarHBondContact O-N 3.27Å; Y256-M259 HydrophobicContact CD2-CE 3.93Å; Y256-M259 HydrophobicContact CD2-SD 4.16Å; Y256-M259 HydrophobicContact CE2-CE 3.29Å; Y256-M259 HydrophobicContact CE2-SD 3.97Å; Y256-M259 WeakPolarHBondContact O-CA 3.46Å; Y256-M259 VanDerWaalsContact O-CB 3.27Å; Y256-M259 WeakPolarHBondContact O-CB 3.49Å; Y256-M259 PolarHBondContact O-N 3.36Å; Y256-M259 VanDerWaalsContact O-N 3.15Å; Y256-I260 HydrophobicContact CD1-CD1 4.06Å; Y256-I260 HydrophobicContact CE1-CD1 3.27Å; Y256-I260 HydrophobicContact CE1-CG1 3.89Å; Y256-I260 PolarHBondContact O-N 3.34Å |
| 257 | L | 90.3 | Very high | 88.3 | Confident | 33 Ų | 33 | 40.2 Ų | 40.2 | 17% | 0.173 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -60 | -43.5 | 168.4 | -176.8 | 152.3 | 0 | 0 | 0 | 110.7 | T215 S253 L254 M259 I260 M261 | T215-L257 WeakPolarHBondContact O-CD1 3.36Å; S253-L257 PolarHBondContact O-N 3.11Å; L254-L257 HydrophobicContact CD1-CB 4.35Å; L254-L257 HydrophobicContact CD1-CD2 4.46Å; L254-L257 PolarHBondContact O-N 3.09Å; L257-M259 VanDerWaalsContact C-N 3.3Å; L257-M259 PolarHBondContact O-N 2.95Å; L257-I260 PolarHBondContact O-N 2.92Å; L257-I260 VanDerWaalsContact O-N 3.14Å; L257-M261 HydrophobicContact CD2-CE 4.32Å; L257-M261 HydrophobicContact CD2-CG 3.76Å; L257-M261 HydrophobicContact CG-CG 4.49Å; L257-M261 WeakPolarHBondContact O-CG 3.44Å; L257-M261 PolarHBondContact O-N 3.39Å |
| 258 | V | 90.2 | Very high | 87.4 | Confident | 38 Ų | 38 | 43.4 Ų | 43.4 | 23% | 0.23 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -63.4 | -35.3 | 174.2 | 172.6 | 0 | 0 | 0 | 0 | 111.7 | F137 L254 G255 Y256 T262 | F137-V258 HydrophobicContact CB-CB 4.45Å; F137-V258 HydrophobicContact CB-CG2 3.88Å; L254-V258 PolarHBondContact O-N 3.47Å; G255-V258 PolarHBondContact O-N 2.81Å; Y256-V258 VanDerWaalsContact C-N 3.32Å; Y256-V258 PolarHBondContact O-N 3.27Å; V258-T262 HydrophobicContact CG1-CG2 4.44Å; V258-T262 WeakPolarHBondContact O-CB 3.43Å; V258-T262 WeakPolarHBondContact O-CG2 3.42Å; V258-T262 PolarHBondContact O-N 3.12Å; V258-T262 PolarHBondContact O-OG1 2.98Å |
| 259 | M | 89.6 | Confident | 86.4 | Confident | 2 Ų | 2 | 42.9 Ų | 42.9 | 1% | 0.01 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -59.9 | -48.9 | 169.6 | -165.8 | -148.1 | 69.6 | 0 | 0 | 111.4 | G141 F144 A180 G255 Y256 L257 T262 F263 | G141-M259 WeakPolarHBondContact O-CG 3.39Å; F144-M259 HydrophobicContact CB-CB 4.28Å; F144-M259 HydrophobicContact CB-CG 4.08Å; F144-M259 HydrophobicContact CB-SD 3.73Å; A180-M259 HydrophobicContact CB-CE 4.44Å; G255-M259 PolarHBondContact O-N 3.47Å; Y256-M259 HydrophobicContact CD2-CE 3.93Å; Y256-M259 HydrophobicContact CD2-SD 4.16Å; Y256-M259 HydrophobicContact CE2-CE 3.29Å; Y256-M259 HydrophobicContact CE2-SD 3.97Å; Y256-M259 WeakPolarHBondContact O-CA 3.46Å; Y256-M259 VanDerWaalsContact O-CB 3.27Å; Y256-M259 WeakPolarHBondContact O-CB 3.49Å; Y256-M259 PolarHBondContact O-N 3.36Å; Y256-M259 VanDerWaalsContact O-N 3.15Å; L257-M259 VanDerWaalsContact C-N 3.3Å; L257-M259 PolarHBondContact O-N 2.95Å; M259-T262 PolarHBondContact O-N 3.34Å; M259-T262 PolarHBondContact O-OG1 2.95Å; M259-F263 HydrophobicContact CE-CD2 3.9Å; M259-F263 HydrophobicContact CE-CE2 4.05Å; M259-F263 HydrophobicContact CG-CD2 3.84Å; M259-F263 HydrophobicContact CG-CE2 3.77Å; M259-F263 VanDerWaalsContact O-CD2 3.29Å; M259-F263 WeakPolarHBondContact O-CD2 3.5Å; M259-F263 PolarHBondContact O-N 3.34Å; M259-F263 HydrophobicContact SD-CD2 4.21Å; M259-F263 HydrophobicContact SD-CE2 3.87Å |
| 260 | I | 88.6 | Confident | 85.6 | Confident | 32 Ų | 32 | 43.2 Ų | 43.2 | 16% | 0.164 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -60 | -50.3 | 176.8 | -74.8 | 173.9 | 0 | 0 | 0 | 111.1 | L181 Y256 L257 T262 F263 I264 | L181-I260 HydrophobicContact CD1-CD1 3.63Å; Y256-I260 HydrophobicContact CD1-CD1 4.06Å; Y256-I260 HydrophobicContact CE1-CD1 3.27Å; Y256-I260 HydrophobicContact CE1-CG1 3.89Å; Y256-I260 PolarHBondContact O-N 3.34Å; L257-I260 PolarHBondContact O-N 2.92Å; L257-I260 VanDerWaalsContact O-N 3.14Å; I260-T262 VanDerWaalsContact C-N 3.3Å; I260-T262 PolarHBondContact O-N 2.74Å; I260-F263 CarbonylContact O-C 3.6Å; I260-F263 PolarHBondContact O-N 2.85Å; I260-F263 VanDerWaalsContact O-N 3.1Å; I260-I264 HydrophobicContact CG2-CD1 3.54Å; I260-I264 HydrophobicContact CG2-CG1 4.14Å; I260-I264 WeakPolarHBondContact O-CG1 3.42Å; I260-I264 PolarHBondContact O-N 3.32Å |
| 261 | M | 86.6 | Confident | 84.6 | Confident | 102 Ų | 102 | 50 Ų | 50 | 50% | 0.502 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -61.7 | -37.5 | -177.3 | -71.6 | -62.7 | -174 | 0 | 0 | 112.1 | L257 T265 | L257-M261 HydrophobicContact CD2-CE 4.32Å; L257-M261 HydrophobicContact CD2-CG 3.76Å; L257-M261 HydrophobicContact CG-CG 4.49Å; L257-M261 WeakPolarHBondContact O-CG 3.44Å; L257-M261 PolarHBondContact O-N 3.39Å; M261-T265 VanDerWaalsContact O-CB 3.32Å; M261-T265 WeakPolarHBondContact O-CB 3.4Å; M261-T265 PolarHBondContact O-N 3.44Å; M261-T265 PolarHBondContact O-OG1 3.19Å |
| 262 | T | 85.6 | Confident | 83.5 | Confident | 54 Ų | 54 | 54.1 Ų | 54.1 | 33% | 0.331 | 26% | 0.264 | S | S | . | . | H | α-helix | trans | -71.4 | -35.4 | 174.1 | 54.4 | 0 | 0 | 0 | 0 | 112.7 | V258 M259 I260 R266 | V258-T262 HydrophobicContact CG1-CG2 4.44Å; V258-T262 WeakPolarHBondContact O-CB 3.43Å; V258-T262 WeakPolarHBondContact O-CG2 3.42Å; V258-T262 PolarHBondContact O-N 3.12Å; V258-T262 PolarHBondContact O-OG1 2.98Å; M259-T262 PolarHBondContact O-N 3.34Å; M259-T262 PolarHBondContact O-OG1 2.95Å; I260-T262 VanDerWaalsContact C-N 3.3Å; I260-T262 PolarHBondContact O-N 2.74Å; T262-R266 WeakPolarHBondContact O-CB 3.42Å; T262-R266 WeakPolarHBondContact O-CD 3.35Å; T262-R266 WeakPolarHBondContact O-CG 3.46Å; T262-R266 PolarHBondContact O-N 3.44Å |
| 263 | F | 82.7 | Confident | 82.3 | Confident | 31 Ų | 31 | 52.5 Ų | 52.5 | 14% | 0.136 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -66.3 | -42.6 | 171 | -89.8 | -66.7 | 0 | 0 | 0 | 112.9 | F148 V177 M259 I260 R266 G267 | F148-F263 HydrophobicContact CD1-CZ 4.48Å; V177-F263 HydrophobicContact CG2-CB 4.41Å; M259-F263 HydrophobicContact CE-CD2 3.9Å; M259-F263 HydrophobicContact CE-CE2 4.05Å; M259-F263 HydrophobicContact CG-CD2 3.84Å; M259-F263 HydrophobicContact CG-CE2 3.77Å; M259-F263 VanDerWaalsContact O-CD2 3.29Å; M259-F263 WeakPolarHBondContact O-CD2 3.5Å; M259-F263 PolarHBondContact O-N 3.34Å; M259-F263 HydrophobicContact SD-CD2 4.21Å; M259-F263 HydrophobicContact SD-CE2 3.87Å; I260-F263 CarbonylContact O-C 3.6Å; I260-F263 PolarHBondContact O-N 2.85Å; I260-F263 VanDerWaalsContact O-N 3.1Å; F263-R266 PolarHBondContact O-N 2.98Å; F263-G267 PolarHBondContact O-N 3.33Å |
| 264 | I | 84 | Confident | 81.2 | Confident | 68 Ų | 68 | 53.9 Ų | 53.9 | 35% | 0.349 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -61.4 | -47.3 | 174.5 | -69.2 | 173.7 | 0 | 0 | 0 | 109.7 | V177 I260 R266 G267 L268 | V177-I264 HydrophobicContact CG1-CG1 4.3Å; I260-I264 HydrophobicContact CG2-CD1 3.54Å; I260-I264 HydrophobicContact CG2-CG1 4.14Å; I260-I264 WeakPolarHBondContact O-CG1 3.42Å; I260-I264 PolarHBondContact O-N 3.32Å; I264-R266 PolarHBondContact O-N 3.02Å; I264-G267 CarbonylContact O-C 3.59Å; I264-G267 WeakPolarHBondContact O-CA 3.3Å; I264-G267 PolarHBondContact O-N 2.88Å; I264-L268 HydrophobicContact CG2-CD1 3.89Å; I264-L268 HydrophobicContact CG2-CG 4.25Å; I264-L268 WeakPolarHBondContact O-CG 3.44Å; I264-L268 PolarHBondContact O-N 3.33Å |
| 265 | T | 83.6 | Confident | 80.5 | Confident | 67 Ų | 67 | 60.4 Ų | 60.4 | 41% | 0.411 | 30% | 0.295 | S | S | . | . | H | α-helix | trans | -59.5 | -46.9 | 178.3 | -59.1 | 0 | 0 | 0 | 0 | 111.7 | M261 G267 L268 Q269 | M261-T265 VanDerWaalsContact O-CB 3.32Å; M261-T265 WeakPolarHBondContact O-CB 3.4Å; M261-T265 PolarHBondContact O-N 3.44Å; M261-T265 PolarHBondContact O-OG1 3.19Å; T265-G267 VanDerWaalsContact C-N 3.25Å; T265-G267 PolarHBondContact O-N 3.24Å; T265-L268 PolarHBondContact O-N 3.43Å; T265-Q269 WeakPolarHBondContact O-CB 3.39Å; T265-Q269 WeakPolarHBondContact O-CG 3.5Å; T265-Q269 PolarHBondContact O-N 3.44Å |
| 266 | R | 79.8 | Confident | 79.6 | Confident | 133 Ų | 133 | 64.9 Ų | 64.9 | 50% | 0.502 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -62.1 | -32.5 | 173.7 | -71.5 | 168.8 | -177.4 | -173.5 | 3 | 112.3 | T262 F263 I264 S270 | T262-R266 WeakPolarHBondContact O-CB 3.42Å; T262-R266 WeakPolarHBondContact O-CD 3.35Å; T262-R266 WeakPolarHBondContact O-CG 3.46Å; T262-R266 PolarHBondContact O-N 3.44Å; F263-R266 PolarHBondContact O-N 2.98Å; I264-R266 PolarHBondContact O-N 3.02Å; R266-S270 PolarHBondContact O-N 3.11Å |
| 267 | G | 74.9 | Confident | 78.9 | Confident | 11 Ų | 11 | 68.4 Ų | 68.4 | 11% | 0.113 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -68.5 | -47.7 | 175.5 | 0 | 0 | 0 | 0 | 0 | 113.3 | F263 I264 T265 Q269 S270 | F263-G267 PolarHBondContact O-N 3.33Å; I264-G267 CarbonylContact O-C 3.59Å; I264-G267 WeakPolarHBondContact O-CA 3.3Å; I264-G267 PolarHBondContact O-N 2.88Å; T265-G267 VanDerWaalsContact C-N 3.25Å; T265-G267 PolarHBondContact O-N 3.24Å; G267-Q269 VanDerWaalsContact C-N 3.31Å; G267-Q269 PolarHBondContact O-N 3.2Å; G267-S270 VanDerWaalsContact O-CB 3.22Å; G267-S270 WeakPolarHBondContact O-CB 3.38Å; G267-S270 PolarHBondContact O-N 3.23Å; G267-S270 VanDerWaalsContact O-N 3.12Å; G267-S270 PolarHBondContact O-OG 2.85Å |
| 268 | L | 71.6 | Confident | 78.5 | Confident | 91 Ų | 91 | 73.2 Ų | 73.2 | 48% | 0.476 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -62.8 | -38.1 | 175.7 | -66.3 | 172.2 | 0 | 0 | 0 | 111.5 | I264 T265 S270 L273 L818 | I264-L268 HydrophobicContact CG2-CD1 3.89Å; I264-L268 HydrophobicContact CG2-CG 4.25Å; I264-L268 WeakPolarHBondContact O-CG 3.44Å; I264-L268 PolarHBondContact O-N 3.33Å; T265-L268 PolarHBondContact O-N 3.43Å; L268-S270 PolarHBondContact O-N 2.76Å; L268-L273 HydrophobicContact CD2-CD2 3.86Å; L268-L818 HydrophobicContact CB-CD1 3.83Å |
| 269 | Q | 70.1 | Confident | 77.9 | Confident | 55 Ų | 55 | 75.5 Ų | 75.5 | 26% | 0.257 | 37% | 0.366 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -72.7 | -3.6 | 174.8 | -73 | 175.5 | -17.9 | 0 | 0 | 114.8 | T265 G267 L818 | T265-Q269 WeakPolarHBondContact O-CB 3.39Å; T265-Q269 WeakPolarHBondContact O-CG 3.5Å; T265-Q269 PolarHBondContact O-N 3.44Å; G267-Q269 VanDerWaalsContact C-N 3.31Å; G267-Q269 PolarHBondContact O-N 3.2Å; Q269-L818 HydrophobicContact CG-CB 3.83Å; Q269-L818 PolarHBondContact NE2-O 3.44Å |
| 270 | S | 77.8 | Confident | 77.4 | Confident | 21 Ų | 21 | 80.7 Ų | 80.7 | 15% | 0.147 | 39% | 0.393 | C | S | . | . | trans | -74.3 | 139 | -170.3 | 74.2 | 0 | 0 | 0 | 0 | 113.8 | R266 G267 L268 K272 L273 A274 | R266-S270 PolarHBondContact O-N 3.11Å; G267-S270 VanDerWaalsContact O-CB 3.22Å; G267-S270 WeakPolarHBondContact O-CB 3.38Å; G267-S270 PolarHBondContact O-N 3.23Å; G267-S270 VanDerWaalsContact O-N 3.12Å; G267-S270 PolarHBondContact O-OG 2.85Å; L268-S270 PolarHBondContact O-N 2.76Å; S270-K272 PolarHBondContact O-N 3.22Å; S270-K272 VanDerWaalsContact O-N 3.13Å; S270-L273 PolarHBondContact O-N 3.01Å; S270-L273 PolarHBondContact OG-N 3.29Å; S270-A274 PolarHBondContact O-N 2.93Å | ||
| 271 | K | 70.9 | Confident | 77 | Confident | 149 Ų | 149 | 81.3 Ų | 81.3 | 65% | 0.648 | 40% | 0.4 | S | S | * | . | H | α-helix | trans | -56.2 | -30.7 | 176.8 | -67.7 | -164.7 | 176.2 | -164.8 | 0 | 113 | Y275 | K271-Y275 WeakPolarHBondContact O-CB 3.49Å; K271-Y275 PolarHBondContact O-N 2.89Å |
| 272 | K | 67.8 | Low | 76.8 | Confident | 124 Ų | 124 | 79.3 Ų | 79.3 | 54% | 0.539 | 40% | 0.396 | S | S | . | . | H | α-helix | trans | -67.7 | -41.9 | 175 | -72.9 | -163.9 | 174.4 | -166.9 | 0 | 112 | S270 Y275 L276 | S270-K272 PolarHBondContact O-N 3.22Å; S270-K272 VanDerWaalsContact O-N 3.13Å; K272-Y275 PolarHBondContact O-N 3.4Å; K272-L276 WeakPolarHBondContact O-CG 3.24Å; K272-L276 PolarHBondContact O-N 3.25Å; K272-L276 VanDerWaalsContact O-N 3.12Å |
| 273 | L | 67.4 | Low | 76.9 | Confident | 57 Ų | 57 | 81.3 Ų | 81.3 | 30% | 0.298 | 41% | 0.405 | S | S | . | . | H | α-helix | trans | -70.3 | -40.2 | 175.6 | -168.4 | 71.2 | 0 | 0 | 0 | 111.5 | L268 S270 Y275 L276 E277 | L268-L273 HydrophobicContact CD2-CD2 3.86Å; S270-L273 PolarHBondContact O-N 3.01Å; S270-L273 PolarHBondContact OG-N 3.29Å; L273-Y275 VanDerWaalsContact C-N 3.28Å; L273-Y275 PolarHBondContact O-N 3.05Å; L273-L276 CarbonylContact O-C 3.58Å; L273-L276 PolarHBondContact O-N 2.87Å; L273-L276 VanDerWaalsContact O-N 3.11Å; L273-E277 PolarHBondContact O-N 3.02Å |
| 274 | A | 70.2 | Confident | 76.8 | Confident | 30 Ų | 30 | 84.6 Ų | 84.6 | 25% | 0.248 | 42% | 0.424 | C | S | . | . | H | α-helix | trans | -60.5 | -36.5 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.6 | S270 Q278 P816 | S270-A274 PolarHBondContact O-N 2.93Å; A274-Q278 WeakPolarHBondContact O-CB 3.43Å; A274-Q278 PolarHBondContact O-N 3.47Å; A274-P816 HydrophobicContact CB-CB 4.29Å |
| 275 | Y | 76.7 | Confident | 76.9 | Confident | 148 Ų | 148 | 87.4 Ų | 87.4 | 58% | 0.58 | 43% | 0.433 | S | S | * | . | H | α-helix | trans | -66.1 | -42.7 | 172.1 | 179.5 | -92.4 | 0 | 0 | 0 | 112.2 | K271 K272 L273 Q278 Q279 | K271-Y275 WeakPolarHBondContact O-CB 3.49Å; K271-Y275 PolarHBondContact O-N 2.89Å; K272-Y275 PolarHBondContact O-N 3.4Å; L273-Y275 VanDerWaalsContact C-N 3.28Å; L273-Y275 PolarHBondContact O-N 3.05Å; Y275-Q278 WeakPolarHBondContact O-CB 3.4Å; Y275-Q278 PolarHBondContact O-N 3.49Å; Y275-Q279 WeakPolarHBondContact O-CB 3.3Å; Y275-Q279 PolarHBondContact O-N 2.88Å |
| 276 | L | 73 | Confident | 76.9 | Confident | 95 Ų | 95 | 87 Ų | 87 | 50% | 0.497 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -66.1 | -38.9 | 175.4 | -69.8 | 169.7 | 0 | 0 | 0 | 112.3 | K272 L273 Q279 L280 | K272-L276 WeakPolarHBondContact O-CG 3.24Å; K272-L276 PolarHBondContact O-N 3.25Å; K272-L276 VanDerWaalsContact O-N 3.12Å; L273-L276 CarbonylContact O-C 3.58Å; L273-L276 PolarHBondContact O-N 2.87Å; L273-L276 VanDerWaalsContact O-N 3.11Å; L276-Q279 PolarHBondContact O-N 3.28Å; L276-L280 VanDerWaalsContact O-CB 3.28Å; L276-L280 WeakPolarHBondContact O-CB 3.35Å; L276-L280 PolarHBondContact O-N 3.48Å |
| 277 | E | 75.2 | Confident | 77 | Confident | 95 Ų | 95 | 84.2 Ų | 84.2 | 44% | 0.444 | 43% | 0.434 | S | S | . | . | H | α-helix | trans | -59.8 | -46.9 | 171.1 | -173.9 | -161.9 | 151.7 | 0 | 0 | 110.2 | L273 Q279 L280 S281 | L273-E277 PolarHBondContact O-N 3.02Å; E277-Q279 PolarHBondContact O-N 3.2Å; E277-L280 PolarHBondContact O-N 2.93Å; E277-S281 VanDerWaalsContact O-CB 3.26Å; E277-S281 WeakPolarHBondContact O-CB 3.49Å; E277-S281 PolarHBondContact O-N 3.01Å; E277-S281 PolarHBondContact O-OG 3.43Å |
| 278 | Q | 81.3 | Confident | 77.5 | Confident | 134 Ų | 134 | 88.7 Ų | 88.7 | 63% | 0.626 | 45% | 0.452 | S | S | * | . | H | α-helix | trans | -59.7 | -48.1 | 177.1 | -176 | 173.3 | -10.8 | 0 | 0 | 111.2 | A274 Y275 S281 S282 | A274-Q278 WeakPolarHBondContact O-CB 3.43Å; A274-Q278 PolarHBondContact O-N 3.47Å; Y275-Q278 WeakPolarHBondContact O-CB 3.4Å; Y275-Q278 PolarHBondContact O-N 3.49Å; Q278-S281 PolarHBondContact O-N 3.13Å; Q278-S281 PolarHBondContact O-OG 3.12Å; Q278-S282 PolarHBondContact O-N 2.99Å; Q278-S282 PolarHBondContact O-OG 2.98Å |
| 279 | Q | 79.1 | Confident | 78.2 | Confident | 86 Ų | 86 | 89.5 Ų | 89.5 | 40% | 0.402 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -64.9 | -41 | 179.1 | -169.9 | 176.8 | 4.2 | 0 | 0 | 112.6 | Y275 L276 E277 S282 N283 | Y275-Q279 WeakPolarHBondContact O-CB 3.3Å; Y275-Q279 PolarHBondContact O-N 2.88Å; L276-Q279 PolarHBondContact O-N 3.28Å; E277-Q279 PolarHBondContact O-N 3.2Å; Q279-S282 WeakPolarHBondContact CA-OG 3.28Å; Q279-S282 PolarHBondContact O-OG 2.91Å; Q279-N283 WeakPolarHBondContact O-CB 3.38Å; Q279-N283 VanDerWaalsContact O-CG 3.27Å; Q279-N283 PolarHBondContact O-N 3.5Å; Q279-N283 PolarHBondContact O-ND2 3.43Å |
| 280 | L | 79.2 | Confident | 79 | Confident | 112 Ų | 112 | 96.2 Ų | 96.2 | 59% | 0.586 | 48% | 0.48 | S | S | * | . | H | α-helix | trans | -62.8 | -44.5 | 172.6 | -168.5 | 83.2 | 0 | 0 | 0 | 110.6 | L276 E277 S282 N283 L284 | L276-L280 VanDerWaalsContact O-CB 3.28Å; L276-L280 WeakPolarHBondContact O-CB 3.35Å; L276-L280 PolarHBondContact O-N 3.48Å; E277-L280 PolarHBondContact O-N 2.93Å; L280-S282 PolarHBondContact O-N 2.7Å; L280-N283 PolarHBondContact O-N 3.45Å; L280-L284 HydrophobicContact CD2-CD1 4.21Å; L280-L284 HydrophobicContact CG-CD1 4.05Å; L280-L284 WeakPolarHBondContact O-CB 3.49Å; L280-L284 WeakPolarHBondContact O-CG 3.32Å; L280-L284 PolarHBondContact O-N 2.91Å |
| 281 | S | 80.4 | Confident | 79.3 | Confident | 44 Ų | 44 | 100.4 Ų | 100.4 | 31% | 0.308 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -67.9 | -33.7 | -179.2 | 82.6 | 0 | 0 | 0 | 0 | 113.1 | E277 Q278 K285 | E277-S281 VanDerWaalsContact O-CB 3.26Å; E277-S281 WeakPolarHBondContact O-CB 3.49Å; E277-S281 PolarHBondContact O-N 3.01Å; E277-S281 PolarHBondContact O-OG 3.43Å; Q278-S281 PolarHBondContact O-N 3.13Å; Q278-S281 PolarHBondContact O-OG 3.12Å; S281-K285 WeakPolarHBondContact O-CB 3.26Å; S281-K285 WeakPolarHBondContact O-CD 3.42Å; S281-K285 VanDerWaalsContact O-CG 3.23Å; S281-K285 WeakPolarHBondContact O-CG 3.43Å; S281-K285 PolarHBondContact O-N 3.19Å |
| 282 | S | 81.8 | Confident | 79.7 | Confident | 61 Ų | 61 | 100.9 Ų | 100.9 | 43% | 0.427 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -70.6 | -40.3 | 172.8 | 51.3 | 0 | 0 | 0 | 0 | 111.5 | Q278 Q279 L280 K285 A286 | Q278-S282 PolarHBondContact O-N 2.99Å; Q278-S282 PolarHBondContact O-OG 2.98Å; Q279-S282 WeakPolarHBondContact CA-OG 3.28Å; Q279-S282 PolarHBondContact O-OG 2.91Å; L280-S282 PolarHBondContact O-N 2.7Å; S282-K285 PolarHBondContact O-N 3.04Å; S282-A286 WeakPolarHBondContact O-CB 3.36Å; S282-A286 PolarHBondContact O-N 3.49Å |
| 283 | N | 87.3 | Confident | 80.4 | Confident | 95 Ų | 95 | 97.2 Ų | 97.2 | 51% | 0.508 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -64.4 | -44.9 | 175.3 | -73.9 | -22.6 | 0 | 0 | 0 | 111.7 | Q279 L280 K285 A286 T287 | Q279-N283 WeakPolarHBondContact O-CB 3.38Å; Q279-N283 VanDerWaalsContact O-CG 3.27Å; Q279-N283 PolarHBondContact O-N 3.5Å; Q279-N283 PolarHBondContact O-ND2 3.43Å; L280-N283 PolarHBondContact O-N 3.45Å; N283-K285 PolarHBondContact O-N 3.27Å; N283-A286 PolarHBondContact O-N 3.03Å; N283-T287 PolarHBondContact O-N 3.04Å; N283-T287 PolarHBondContact O-OG1 3.29Å |
| 284 | L | 81.8 | Confident | 81.1 | Confident | 101 Ų | 101 | 95.6 Ų | 95.6 | 53% | 0.529 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -64.2 | -37.5 | 176 | -74.7 | 171 | 0 | 0 | 0 | 112.6 | L280 T287 Q288 | L280-L284 HydrophobicContact CD2-CD1 4.21Å; L280-L284 HydrophobicContact CG-CD1 4.05Å; L280-L284 WeakPolarHBondContact O-CB 3.49Å; L280-L284 WeakPolarHBondContact O-CG 3.32Å; L280-L284 PolarHBondContact O-N 2.91Å; L284-T287 WeakPolarHBondContact CA-OG1 3.39Å; L284-T287 PolarHBondContact O-OG1 3.01Å; L284-T287 VanDerWaalsContact O-OG1 3.09Å; L284-Q288 WeakPolarHBondContact O-CB 3.31Å; L284-Q288 PolarHBondContact O-N 3.25Å |
| 285 | K | 85.9 | Confident | 81.8 | Confident | 127 Ų | 127 | 97.8 Ų | 97.8 | 55% | 0.552 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -67.2 | -37.9 | 171.9 | -75.4 | 170.1 | -178.9 | 176.3 | 0 | 112.1 | S281 S282 N283 N289 | S281-K285 WeakPolarHBondContact O-CB 3.26Å; S281-K285 WeakPolarHBondContact O-CD 3.42Å; S281-K285 VanDerWaalsContact O-CG 3.23Å; S281-K285 WeakPolarHBondContact O-CG 3.43Å; S281-K285 PolarHBondContact O-N 3.19Å; S282-K285 PolarHBondContact O-N 3.04Å; N283-K285 PolarHBondContact O-N 3.27Å; K285-N289 VanDerWaalsContact O-CB 3.25Å; K285-N289 WeakPolarHBondContact O-CB 3.42Å; K285-N289 PolarHBondContact O-N 2.87Å; K285-N289 PolarHBondContact O-OD1 3.29Å |
| 286 | A | 82.3 | Confident | 82.3 | Confident | 59 Ų | 59 | 94.7 Ų | 94.7 | 49% | 0.488 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -66.9 | -42.5 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112 | S282 N283 R290 | S282-A286 WeakPolarHBondContact O-CB 3.36Å; S282-A286 PolarHBondContact O-N 3.49Å; N283-A286 PolarHBondContact O-N 3.03Å; A286-R290 VanDerWaalsContact O-CB 3.28Å; A286-R290 WeakPolarHBondContact O-CB 3.43Å; A286-R290 PolarHBondContact O-N 3.35Å |
| 287 | T | 81.6 | Confident | 82.9 | Confident | 73 Ų | 73 | 96.3 Ų | 96.3 | 45% | 0.448 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -68.9 | -42.9 | 174.7 | 56.5 | 0 | 0 | 0 | 0 | 111.6 | N283 L284 R290 I291 | N283-T287 PolarHBondContact O-N 3.04Å; N283-T287 PolarHBondContact O-OG1 3.29Å; L284-T287 WeakPolarHBondContact CA-OG1 3.39Å; L284-T287 PolarHBondContact O-OG1 3.01Å; L284-T287 VanDerWaalsContact O-OG1 3.09Å; T287-R290 PolarHBondContact O-N 2.78Å; T287-I291 WeakPolarHBondContact O-CB 3.39Å; T287-I291 WeakPolarHBondContact O-CD1 3.47Å; T287-I291 VanDerWaalsContact O-CG1 3.25Å; T287-I291 WeakPolarHBondContact O-CG1 3.37Å; T287-I291 PolarHBondContact O-N 3.3Å |
| 288 | Q | 85.4 | Confident | 83.3 | Confident | 105 Ų | 105 | 96.6 Ų | 96.6 | 49% | 0.491 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -56.2 | -53 | 173.2 | -179.1 | 178.9 | -5 | 0 | 0 | 111 | L284 R290 I291 W292 | L284-Q288 WeakPolarHBondContact O-CB 3.31Å; L284-Q288 PolarHBondContact O-N 3.25Å; Q288-R290 VanDerWaalsContact C-N 3.3Å; Q288-R290 PolarHBondContact O-N 2.84Å; Q288-I291 PolarHBondContact O-N 2.94Å; Q288-W292 VanDerWaalsContact O-CD1 3.29Å; Q288-W292 PolarHBondContact O-N 3.11Å |
| 289 | N | 87.1 | Confident | 83.6 | Confident | 108 Ų | 108 | 94.5 Ų | 94.5 | 58% | 0.578 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -61 | -38.9 | 179.4 | -71.3 | -3.7 | 0 | 0 | 0 | 111.7 | K285 S293 | K285-N289 VanDerWaalsContact O-CB 3.25Å; K285-N289 WeakPolarHBondContact O-CB 3.42Å; K285-N289 PolarHBondContact O-N 2.87Å; K285-N289 PolarHBondContact O-OD1 3.29Å; N289-S293 VanDerWaalsContact O-CB 3.24Å; N289-S293 WeakPolarHBondContact O-CB 3.37Å; N289-S293 PolarHBondContact O-N 3.06Å; N289-S293 PolarHBondContact O-OG 2.87Å |
| 290 | R | 86.6 | Confident | 83.9 | Confident | 197 Ų | 197 | 91.9 Ų | 91.9 | 74% | 0.743 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -62.6 | -47.2 | 174.7 | -174 | 173.6 | 178 | 171.7 | -2 | 111.7 | A286 T287 Q288 S293 G294 | A286-R290 VanDerWaalsContact O-CB 3.28Å; A286-R290 WeakPolarHBondContact O-CB 3.43Å; A286-R290 PolarHBondContact O-N 3.35Å; T287-R290 PolarHBondContact O-N 2.78Å; Q288-R290 VanDerWaalsContact C-N 3.3Å; Q288-R290 PolarHBondContact O-N 2.84Å; R290-S293 PolarHBondContact O-N 3.43Å; R290-S293 PolarHBondContact O-OG 3.07Å; R290-G294 PolarHBondContact O-N 3.4Å |
| 291 | I | 84.2 | Confident | 84 | Confident | 108 Ų | 108 | 93.5 Ų | 93.5 | 55% | 0.554 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -62.2 | -49.8 | 178.2 | -68.8 | 162.4 | 0 | 0 | 0 | 110.6 | T287 Q288 S293 G294 V295 | T287-I291 WeakPolarHBondContact O-CB 3.39Å; T287-I291 WeakPolarHBondContact O-CD1 3.47Å; T287-I291 VanDerWaalsContact O-CG1 3.25Å; T287-I291 WeakPolarHBondContact O-CG1 3.37Å; T287-I291 PolarHBondContact O-N 3.3Å; Q288-I291 PolarHBondContact O-N 2.94Å; I291-S293 VanDerWaalsContact C-N 3.29Å; I291-S293 PolarHBondContact O-N 3.45Å; I291-G294 WeakPolarHBondContact O-CA 3.49Å; I291-G294 PolarHBondContact O-N 3.34Å; I291-V295 HydrophobicContact CG2-CG2 4.39Å; I291-V295 WeakPolarHBondContact O-CG2 3.38Å; I291-V295 PolarHBondContact O-N 3.42Å |
| 292 | W | 78.7 | Confident | 84 | Confident | 160 Ų | 160 | 96.8 Ų | 96.8 | 61% | 0.606 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -61.9 | -35.3 | 176.6 | -82.9 | 86.2 | 0 | 0 | 0 | 112.3 | Q288 G294 T296 | Q288-W292 VanDerWaalsContact O-CD1 3.29Å; Q288-W292 PolarHBondContact O-N 3.11Å; W292-G294 VanDerWaalsContact C-N 3.28Å; W292-G294 PolarHBondContact O-N 3.32Å; W292-T296 WeakPolarHBondContact O-CB 3.47Å; W292-T296 WeakPolarHBondContact O-CG2 3.43Å; W292-T296 PolarHBondContact O-N 2.93Å; W292-T296 PolarHBondContact O-OG1 3.45Å |
| 293 | S | 82.6 | Confident | 84.1 | Confident | 47 Ų | 47 | 103.4 Ų | 103.4 | 33% | 0.329 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -70.6 | -20.5 | 173 | 83 | 0 | 0 | 0 | 0 | 114.1 | N289 R290 I291 K297 | N289-S293 VanDerWaalsContact O-CB 3.24Å; N289-S293 WeakPolarHBondContact O-CB 3.37Å; N289-S293 PolarHBondContact O-N 3.06Å; N289-S293 PolarHBondContact O-OG 2.87Å; R290-S293 PolarHBondContact O-N 3.43Å; R290-S293 PolarHBondContact O-OG 3.07Å; I291-S293 VanDerWaalsContact C-N 3.29Å; I291-S293 PolarHBondContact O-N 3.45Å; S293-K297 WeakPolarHBondContact O-CD 3.25Å; S293-K297 WeakPolarHBondContact O-CE 3.48Å; S293-K297 WeakPolarHBondContact O-CG 3.32Å |
| 294 | G | 83.4 | Confident | 83.9 | Confident | 23 Ų | 23 | 106.4 Ų | 106.4 | 24% | 0.237 | 52% | 0.524 | C | S | . | . | H | α-helix | trans | -76.1 | -62.9 | 168.7 | 0 | 0 | 0 | 0 | 0 | 109.9 | R290 I291 W292 T296 K297 D298 | R290-G294 PolarHBondContact O-N 3.4Å; I291-G294 WeakPolarHBondContact O-CA 3.49Å; I291-G294 PolarHBondContact O-N 3.34Å; W292-G294 VanDerWaalsContact C-N 3.28Å; W292-G294 PolarHBondContact O-N 3.32Å; G294-T296 PolarHBondContact O-N 3.42Å; G294-T296 VanDerWaalsContact O-N 3.09Å; G294-K297 CarbonylContact O-C 3.47Å; G294-K297 WeakPolarHBondContact O-CA 3.33Å; G294-K297 WeakPolarHBondContact O-CB 3.38Å; G294-K297 PolarHBondContact O-N 3.05Å; G294-D298 VanDerWaalsContact O-CG 3.25Å; G294-D298 PolarHBondContact O-N 3.27Å |
| 295 | V | 84.9 | Confident | 83.6 | Confident | 75 Ų | 75 | 107.2 Ų | 107.2 | 46% | 0.455 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -51.7 | -40.4 | -178.4 | 175.8 | 0 | 0 | 0 | 0 | 112.5 | I291 D298 V299 | I291-V295 HydrophobicContact CG2-CG2 4.39Å; I291-V295 WeakPolarHBondContact O-CG2 3.38Å; I291-V295 PolarHBondContact O-N 3.42Å; V295-D298 PolarHBondContact O-N 3.08Å; V295-V299 HydrophobicContact CG1-CG2 4.4Å; V295-V299 WeakPolarHBondContact O-CB 3.38Å; V295-V299 VanDerWaalsContact O-CG2 3.25Å; V295-V299 WeakPolarHBondContact O-CG2 3.49Å; V295-V299 PolarHBondContact O-N 2.82Å |
| 296 | T | 86.9 | Confident | 83.1 | Confident | 84 Ų | 84 | 107.3 Ų | 107.3 | 52% | 0.515 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -69.9 | -33.1 | 176.7 | 49.6 | 0 | 0 | 0 | 0 | 113.7 | W292 G294 G300 | W292-T296 WeakPolarHBondContact O-CB 3.47Å; W292-T296 WeakPolarHBondContact O-CG2 3.43Å; W292-T296 PolarHBondContact O-N 2.93Å; W292-T296 PolarHBondContact O-OG1 3.45Å; G294-T296 PolarHBondContact O-N 3.42Å; G294-T296 VanDerWaalsContact O-N 3.09Å; T296-G300 PolarHBondContact O-N 3.42Å |
| 297 | K | 85.5 | Confident | 82.9 | Confident | 129 Ų | 129 | 109.3 Ų | 109.3 | 56% | 0.561 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -69 | -44.7 | 170.1 | -72 | 169.6 | -169.4 | 167.3 | 0 | 110.8 | S293 G294 V299 G300 Y301 | S293-K297 WeakPolarHBondContact O-CD 3.25Å; S293-K297 WeakPolarHBondContact O-CE 3.48Å; S293-K297 WeakPolarHBondContact O-CG 3.32Å; G294-K297 CarbonylContact O-C 3.47Å; G294-K297 WeakPolarHBondContact O-CA 3.33Å; G294-K297 WeakPolarHBondContact O-CB 3.38Å; G294-K297 PolarHBondContact O-N 3.05Å; K297-V299 PolarHBondContact O-N 2.91Å; K297-G300 CarbonylContact O-C 3.57Å; K297-G300 VanDerWaalsContact O-CA 3.31Å; K297-G300 WeakPolarHBondContact O-CA 3.36Å; K297-G300 PolarHBondContact O-N 2.83Å; K297-Y301 VanDerWaalsContact O-CD2 3.28Å; K297-Y301 WeakPolarHBondContact O-CD2 3.43Å; K297-Y301 PolarHBondContact O-N 2.92Å |
| 298 | D | 84.4 | Confident | 82.8 | Confident | 100 Ų | 100 | 111.2 Ų | 111.2 | 54% | 0.535 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -63.8 | -43.8 | -178.1 | -57.2 | -31.3 | 0 | 0 | 0 | 111 | G294 V295 G300 Y301 L302 | G294-D298 VanDerWaalsContact O-CG 3.25Å; G294-D298 PolarHBondContact O-N 3.27Å; V295-D298 PolarHBondContact O-N 3.08Å; D298-G300 VanDerWaalsContact C-N 3.29Å; D298-G300 PolarHBondContact O-N 2.84Å; D298-Y301 PolarHBondContact O-N 3.49Å; D298-L302 WeakPolarHBondContact O-CB 3.23Å; D298-L302 PolarHBondContact O-N 3.21Å |
| 299 | V | 86.3 | Confident | 81.8 | Confident | 91 Ų | 91 | 112.4 Ų | 112.4 | 55% | 0.552 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -62.2 | -35.7 | 170 | 170 | 0 | 0 | 0 | 0 | 111.7 | V295 K297 R303 | V295-V299 HydrophobicContact CG1-CG2 4.4Å; V295-V299 WeakPolarHBondContact O-CB 3.38Å; V295-V299 VanDerWaalsContact O-CG2 3.25Å; V295-V299 WeakPolarHBondContact O-CG2 3.49Å; V295-V299 PolarHBondContact O-N 2.82Å; K297-V299 PolarHBondContact O-N 2.91Å; V299-R303 VanDerWaalsContact O-CB 3.28Å; V299-R303 WeakPolarHBondContact O-CB 3.42Å; V299-R303 PolarHBondContact O-N 3.24Å |
| 300 | G | 85.1 | Confident | 80.7 | Confident | 31 Ų | 31 | 116.9 Ų | 116.9 | 32% | 0.32 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -64.9 | -43.5 | 173.4 | 0 | 0 | 0 | 0 | 0 | 113.6 | T296 K297 D298 R303 R304 | T296-G300 PolarHBondContact O-N 3.42Å; K297-G300 CarbonylContact O-C 3.57Å; K297-G300 VanDerWaalsContact O-CA 3.31Å; K297-G300 WeakPolarHBondContact O-CA 3.36Å; K297-G300 PolarHBondContact O-N 2.83Å; D298-G300 VanDerWaalsContact C-N 3.29Å; D298-G300 PolarHBondContact O-N 2.84Å; G300-R303 PolarHBondContact O-N 3.29Å; G300-R304 WeakPolarHBondContact O-CG 3.17Å; G300-R304 PolarHBondContact O-N 3.48Å |
| 301 | Y | 82.9 | Confident | 79.6 | Confident | 146 Ų | 146 | 113.4 Ų | 113.4 | 57% | 0.573 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -65.8 | -44.3 | 173 | -84.4 | -74.4 | 0 | 0 | 0 | 111.4 | K297 D298 R303 R304 M305 | K297-Y301 VanDerWaalsContact O-CD2 3.28Å; K297-Y301 WeakPolarHBondContact O-CD2 3.43Å; K297-Y301 PolarHBondContact O-N 2.92Å; D298-Y301 PolarHBondContact O-N 3.49Å; Y301-R303 VanDerWaalsContact C-N 3.29Å; Y301-R303 PolarHBondContact O-N 3.44Å; Y301-R304 PolarHBondContact O-N 3.34Å; Y301-R304 VanDerWaalsContact O-N 3.15Å; Y301-M305 PolarHBondContact O-N 3.37Å |
| 302 | L | 79.5 | Confident | 77.9 | Confident | 113 Ų | 113 | 113.9 Ų | 113.9 | 59% | 0.592 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -59.6 | -42.2 | 176 | -157.4 | 77.6 | 0 | 0 | 0 | 110.8 | D298 M305 L306 | D298-L302 WeakPolarHBondContact O-CB 3.23Å; D298-L302 PolarHBondContact O-N 3.21Å; L302-M305 HydrophobicContact CD1-CE 4.47Å; L302-L306 VanDerWaalsContact O-CB 3.28Å; L302-L306 WeakPolarHBondContact O-CB 3.25Å; L302-L306 PolarHBondContact O-N 3.14Å |
| 303 | R | 83.1 | Confident | 76.4 | Confident | 199 Ų | 199 | 115.2 Ų | 115.2 | 75% | 0.751 | 57% | 0.566 | S | S | * | * | H | α-helix | trans | -66.3 | -36 | 175.5 | -172.1 | 175.8 | -179.2 | -175.8 | 0.3 | 112.9 | V299 G300 Y301 N307 | V299-R303 VanDerWaalsContact O-CB 3.28Å; V299-R303 WeakPolarHBondContact O-CB 3.42Å; V299-R303 PolarHBondContact O-N 3.24Å; G300-R303 PolarHBondContact O-N 3.29Å; Y301-R303 VanDerWaalsContact C-N 3.29Å; Y301-R303 PolarHBondContact O-N 3.44Å; R303-N307 WeakPolarHBondContact O-CB 3.25Å; R303-N307 PolarHBondContact O-N 3.05Å; R303-N307 VanDerWaalsContact O-N 3.16Å |
| 304 | R | 83.8 | Confident | 74.4 | Confident | 159 Ų | 159 | 117.9 Ų | 117.9 | 60% | 0.6 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -66.7 | -52.2 | 172.9 | -78.3 | 178.9 | 176.5 | 156.5 | -1.5 | 111.5 | G300 Y301 L306 N307 E308 | G300-R304 WeakPolarHBondContact O-CG 3.17Å; G300-R304 PolarHBondContact O-N 3.48Å; Y301-R304 PolarHBondContact O-N 3.34Å; Y301-R304 VanDerWaalsContact O-N 3.15Å; R304-L306 VanDerWaalsContact C-N 3.3Å; R304-L306 PolarHBondContact O-N 2.93Å; R304-N307 WeakPolarHBondContact O-CB 3.48Å; R304-N307 PolarHBondContact O-N 3.31Å; R304-E308 WeakPolarHBondContact O-CG 3.49Å; R304-E308 PolarHBondContact O-N 3.37Å |
| 305 | M | 76 | Confident | 71.9 | Confident | 117 Ų | 117 | 126 Ų | 126 | 58% | 0.576 | 61% | 0.609 | S | S | * | * | H | α-helix | trans | -57.7 | -42.2 | 176.3 | -70.7 | -155.1 | -58.7 | 0 | 0 | 111.9 | Y301 L302 N307 E308 L309 | Y301-M305 PolarHBondContact O-N 3.37Å; L302-M305 HydrophobicContact CD1-CE 4.47Å; M305-N307 VanDerWaalsContact C-N 3.27Å; M305-N307 PolarHBondContact O-N 3.22Å; M305-E308 PolarHBondContact O-N 3.27Å; M305-L309 WeakPolarHBondContact O-CB 3.44Å; M305-L309 PolarHBondContact O-N 3.47Å |
| 306 | L | 74.3 | Confident | 69.2 | Low | 130 Ų | 130 | 131.6 Ų | 131.6 | 68% | 0.681 | 63% | 0.627 | S | S | * | * | H | α-helix | trans | -60.9 | -38.4 | 176.8 | -157.3 | 82.3 | 0 | 0 | 0 | 111.8 | L302 R304 Y310 | L302-L306 VanDerWaalsContact O-CB 3.28Å; L302-L306 WeakPolarHBondContact O-CB 3.25Å; L302-L306 PolarHBondContact O-N 3.14Å; R304-L306 VanDerWaalsContact C-N 3.3Å; R304-L306 PolarHBondContact O-N 2.93Å; L306-Y310 WeakPolarHBondContact O-CB 3.28Å; L306-Y310 PolarHBondContact O-N 3.39Å |
| 307 | N | 78.2 | Confident | 66.4 | Low | 101 Ų | 101 | 133.8 Ų | 133.8 | 54% | 0.54 | 65% | 0.645 | S | S | . | * | H | α-helix | trans | -73.1 | -41.6 | 178.6 | -159.7 | 54.4 | 0 | 0 | 0 | 112 | R303 R304 M305 Y310 I311 | R303-N307 WeakPolarHBondContact O-CB 3.25Å; R303-N307 PolarHBondContact O-N 3.05Å; R303-N307 VanDerWaalsContact O-N 3.16Å; R304-N307 WeakPolarHBondContact O-CB 3.48Å; R304-N307 PolarHBondContact O-N 3.31Å; M305-N307 VanDerWaalsContact C-N 3.27Å; M305-N307 PolarHBondContact O-N 3.22Å; N307-Y310 WeakPolarHBondContact O-CB 3.48Å; N307-Y310 PolarHBondContact O-N 3.08Å; N307-I311 WeakPolarHBondContact O-CD1 3.47Å; N307-I311 VanDerWaalsContact O-CG1 3.28Å; N307-I311 WeakPolarHBondContact O-CG1 3.3Å; N307-I311 PolarHBondContact O-N 3.24Å |
| 308 | E | 79.4 | Confident | 63.6 | Low | 113 Ų | 113 | 138.1 Ų | 138.1 | 53% | 0.528 | 66% | 0.657 | S | S | . | * | H | α-helix | trans | -63.9 | -41.2 | 174.3 | -72.6 | 165.5 | -153.7 | 0 | 0 | 111.7 | R304 M305 Y310 I311 L312 | R304-E308 WeakPolarHBondContact O-CG 3.49Å; R304-E308 PolarHBondContact O-N 3.37Å; M305-E308 PolarHBondContact O-N 3.27Å; E308-Y310 VanDerWaalsContact C-N 3.32Å; E308-Y310 PolarHBondContact O-N 3.39Å; E308-I311 CarbonylContact O-C 3.6Å; E308-I311 PolarHBondContact O-N 3.34Å; E308-I311 VanDerWaalsContact O-N 3.14Å; E308-L312 WeakPolarHBondContact O-CB 3.47Å; E308-L312 WeakPolarHBondContact O-CG 3.46Å; E308-L312 PolarHBondContact O-N 3Å |
| 309 | L | 65.4 | Low | 61 | Low | 129 Ų | 129 | 142.6 Ų | 142.6 | 68% | 0.675 | 67% | 0.672 | S | S | * | * | H | α-helix | trans | -67.4 | -33.5 | 175.3 | -152.3 | 165.7 | 0 | 0 | 0 | 111.2 | M305 I311 L312 | M305-L309 WeakPolarHBondContact O-CB 3.44Å; M305-L309 PolarHBondContact O-N 3.47Å; L309-I311 VanDerWaalsContact C-N 3.32Å; L309-L312 PolarHBondContact O-N 2.85Å |
| 310 | Y | 62.9 | Low | 58.3 | Low | 202 Ų | 202 | 142 Ų | 142 | 79% | 0.792 | 68% | 0.684 | S | S | * | * | H | α-helix | trans | -68.1 | -29.5 | 171.5 | -155.8 | -96 | 0 | 0 | 0 | 113 | L306 N307 E308 | L306-Y310 WeakPolarHBondContact O-CB 3.28Å; L306-Y310 PolarHBondContact O-N 3.39Å; N307-Y310 WeakPolarHBondContact O-CB 3.48Å; N307-Y310 PolarHBondContact O-N 3.08Å; E308-Y310 VanDerWaalsContact C-N 3.32Å; E308-Y310 PolarHBondContact O-N 3.39Å |
| 311 | I | 64.2 | Low | 55.7 | Low | 125 Ų | 125 | 148.1 Ų | 148.1 | 64% | 0.641 | 71% | 0.71 | S | S | * | * | H | α-helix | trans | -80.7 | -32.4 | 175 | -68.3 | 162.4 | 0 | 0 | 0 | 111.5 | N307 E308 L309 K313 | N307-I311 WeakPolarHBondContact O-CD1 3.47Å; N307-I311 VanDerWaalsContact O-CG1 3.28Å; N307-I311 WeakPolarHBondContact O-CG1 3.3Å; N307-I311 PolarHBondContact O-N 3.24Å; E308-I311 CarbonylContact O-C 3.6Å; E308-I311 PolarHBondContact O-N 3.34Å; E308-I311 VanDerWaalsContact O-N 3.14Å; L309-I311 VanDerWaalsContact C-N 3.32Å; I311-K313 PolarHBondContact O-N 3.13Å |
| 312 | L | 48.9 | Very low | 53.1 | Low | 118 Ų | 118 | 153.2 Ų | 153.2 | 62% | 0.618 | 73% | 0.728 | S | S | * | * | trans | -73 | 56 | 178.3 | -78.1 | 168.1 | 0 | 0 | 0 | 113.4 | E308 L309 V314 | E308-L312 WeakPolarHBondContact O-CB 3.47Å; E308-L312 WeakPolarHBondContact O-CG 3.46Å; E308-L312 PolarHBondContact O-N 3Å; L309-L312 PolarHBondContact O-N 2.85Å; L312-V314 HydrophobicContact CD2-CG2 4.41Å; L312-V314 PolarHBondContact O-N 3.01Å | ||
| 313 | K | 47 | Very low | 50.7 | Low | 187 Ų | 187 | 157.5 Ų | 157.5 | 81% | 0.813 | 74% | 0.742 | S | S | * | * | trans | -78.3 | 60.5 | 172.4 | -159.9 | 165.6 | -170.4 | 166 | 0 | 111.2 | I311 K315 | I311-K313 PolarHBondContact O-N 3.13Å; K313-K315 PolarHBondContact O-N 3.12Å | ||
| 314 | V | 39.8 | Very low | 48.1 | Very low | 104 Ų | 104 | 157.6 Ų | 157.6 | 63% | 0.63 | 75% | 0.748 | S | S | * | * | trans | -56.1 | 123.6 | -173 | 178.7 | 0 | 0 | 0 | 0 | 111.4 | L312 F316 | L312-V314 HydrophobicContact CD2-CG2 4.41Å; L312-V314 PolarHBondContact O-N 3.01Å; V314-F316 HydrophobicContact CG1-CD2 4.25Å | ||
| 315 | K | 32.5 | Very low | 45.8 | Very low | 194 Ų | 194 | 155.6 Ų | 155.6 | 84% | 0.843 | 76% | 0.755 | S | S | * | * | trans | -105.1 | 114.4 | 168.4 | -73.1 | -177.3 | 177.7 | 177.5 | 0 | 109.9 | K313 | K313-K315 PolarHBondContact O-N 3.12Š| ||
| 316 | F | 26.4 | Very low | 43.6 | Very low | 191 Ų | 191 | 159 Ų | 159 | 84% | 0.838 | 77% | 0.767 | S | S | * | * | trans | -74.5 | 137.6 | 169.2 | -102.3 | -96.2 | 0 | 0 | 0 | 111.3 | V314 | V314-F316 HydrophobicContact CG1-CD2 4.25Š| ||
| 317 | C | 29.4 | Very low | 41.5 | Very low | 130 Ų | 130 | 159.5 Ų | 159.5 | 88% | 0.878 | 77% | 0.77 | S | S | * | * | trans | -146 | 134.8 | 166.2 | -85.9 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 318 | R | 26 | Very low | 39.1 | Very low | 220 Ų | 220 | 163.7 Ų | 163.7 | 83% | 0.83 | 78% | 0.784 | S | S | * | * | trans | -141.3 | 119.3 | -178.7 | -168.5 | -179.6 | -162.6 | -161.8 | 6.3 | 113.4 | ||||
| 319 | K | 30.4 | Very low | 36.7 | Very low | 195 Ų | 195 | 162.4 Ų | 162.4 | 85% | 0.848 | 79% | 0.793 | S | S | * | * | trans | 60.9 | 145.5 | 164.2 | -72 | -175.4 | 172.1 | -172.6 | 0 | 118.3 | ||||
| 320 | G | 29.9 | Very low | 34.9 | Very low | 78 Ų | 78 | 166 Ų | 166 | 80% | 0.804 | 80% | 0.803 | S | S | * | * | trans | 175 | 58.8 | 174.2 | 0 | 0 | 0 | 0 | 0 | 115.3 | R322 | G320-R322 PolarHBondContact O-N 3.32Š| ||
| 321 | N | 29.1 | Very low | 33.4 | Very low | 160 Ų | 160 | 162.5 Ų | 162.5 | 86% | 0.856 | 80% | 0.802 | S | S | * | * | trans | -69.6 | 124.4 | 172 | -94.3 | -8.7 | 0 | 0 | 0 | 111.2 | ||||
| 322 | R | 28.2 | Very low | 31.8 | Very low | 253 Ų | 253 | 164 Ų | 164 | 96% | 0.955 | 81% | 0.807 | S | S | * | * | trans | -172.8 | 150 | 133 | -100.8 | 153.6 | -170.1 | -161.8 | 1.6 | 112.6 | G320 | G320-R322 PolarHBondContact O-N 3.32Š| ||
| 323 | K | 30.6 | Very low | 30.8 | Very low | 203 Ų | 203 | 165 Ų | 165 | 88% | 0.883 | 81% | 0.809 | S | S | * | * | trans | -79.1 | 160.3 | -177 | -47.8 | 173.1 | -177 | 179.3 | 0 | 111.5 | ||||
| 324 | K | 28.1 | Very low | 29.9 | Very low | 201 Ų | 201 | 164.1 Ų | 164.1 | 87% | 0.874 | 81% | 0.805 | S | S | * | * | trans | -166.6 | 161.8 | 135.9 | -89.6 | -111.1 | 177.7 | 176.9 | 0 | 109.9 | ||||
| 325 | P | 35.3 | Very low | 29.4 | Very low | 117 Ų | 117 | 168.9 Ų | 168.9 | 76% | 0.76 | 82% | 0.817 | S | S | * | * | trans | -91.7 | 173.6 | -156.7 | 36.1 | -37.6 | 0 | 0 | 0 | 115.5 | ||||
| 326 | K | 28.9 | Very low | 29.5 | Very low | 188 Ų | 188 | 168.6 Ų | 168.6 | 82% | 0.817 | 82% | 0.816 | S | S | * | * | trans | -57.6 | 140.6 | 168 | -52.1 | 175.2 | -178.9 | 178.8 | 0 | 110.9 | ||||
| 327 | N | 30.8 | Very low | 29.5 | Very low | 140 Ų | 140 | 164.9 Ų | 164.9 | 75% | 0.749 | 81% | 0.813 | S | S | * | * | 176.1 | 155.9 | 103 | -96.4 | -27.6 | 0 | 0 | 0 | 115.4 | |||||
| 328 | K | 28.5 | Very low | 29.7 | Very low | 189 Ų | 189 | 163.7 Ų | 163.7 | 82% | 0.822 | 81% | 0.806 | S | S | * | * | trans | 61.9 | 102.4 | 155.7 | -70.3 | 176.8 | 179.5 | -176.4 | 0 | 119.8 | ||||
| 329 | A | 28.9 | Very low | 29.9 | Very low | 87 Ų | 87 | 163.2 Ų | 163.2 | 72% | 0.719 | 81% | 0.805 | S | S | * | * | 60.9 | 127.8 | 117 | 0 | 0 | 0 | 0 | 0 | 121.9 | |||||
| 330 | K | 27.8 | Very low | 29.8 | Very low | 204 Ų | 204 | 164.3 Ų | 164.3 | 89% | 0.887 | 81% | 0.805 | S | S | * | * | trans | 58.8 | 137.3 | 157 | -54.3 | -178.6 | -179.8 | -176.5 | 0 | 114.9 | ||||
| 331 | T | 31.1 | Very low | 29.9 | Very low | 128 Ų | 128 | 166 Ų | 166 | 79% | 0.785 | 80% | 0.795 | S | S | * | * | cis | -152.5 | -178 | 42.1 | -63.7 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 332 | E | 30 | Very low | 29.9 | Very low | 158 Ų | 158 | 162.6 Ų | 162.6 | 74% | 0.738 | 79% | 0.788 | S | S | * | * | trans | -67.6 | 176.6 | -174.3 | -49.4 | 162.9 | 83 | 0 | 0 | 117.2 | ||||
| 333 | Q | 27.4 | Very low | 30.2 | Very low | 139 Ų | 139 | 160.4 Ų | 160.4 | 65% | 0.65 | 78% | 0.781 | S | S | * | * | trans | 77.1 | 147.5 | 156.4 | -63.3 | -165.8 | 26.2 | 0 | 0 | 121 | ||||
| 334 | K | 29.1 | Very low | 30.3 | Very low | 168 Ų | 168 | 157 Ų | 157 | 73% | 0.73 | 78% | 0.778 | S | S | * | * | trans | 51.5 | 104.5 | 148.1 | -77.3 | 168.4 | -179.7 | 145.6 | 0 | 116.7 | ||||
| 335 | K | 28.7 | Very low | 30.7 | Very low | 203 Ų | 203 | 154.8 Ų | 154.8 | 88% | 0.883 | 78% | 0.775 | S | S | * | * | -169.8 | 165.6 | 71.8 | -100.7 | 164.5 | -176.9 | 176.7 | 0 | 113.1 | |||||
| 336 | K | 34.2 | Very low | 30.8 | Very low | 189 Ų | 189 | 155.5 Ų | 155.5 | 82% | 0.822 | 78% | 0.779 | S | S | * | * | trans | -70 | 145.1 | 168.1 | -57.2 | 172.5 | -178.3 | 174.6 | 0 | 110.7 | ||||
| 337 | S | 28.4 | Very low | 31.5 | Very low | 113 Ų | 113 | 157.6 Ų | 157.6 | 79% | 0.79 | 78% | 0.782 | S | S | * | * | trans | -153.4 | 123.3 | 142.5 | -168.3 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 338 | S | 31.9 | Very low | 32.3 | Very low | 105 Ų | 105 | 155.3 Ų | 155.3 | 73% | 0.734 | 78% | 0.777 | S | S | * | * | trans | -102.6 | 127.3 | 169.2 | -176.5 | 0 | 0 | 0 | 0 | 107.6 | ||||
| 339 | R | 29.9 | Very low | 33.2 | Very low | 210 Ų | 210 | 154.9 Ų | 154.9 | 79% | 0.792 | 78% | 0.784 | S | S | * | * | trans | -111.8 | 91.9 | -179 | -168.2 | 179.2 | -64.9 | 173.5 | -0 | 110.2 | I341 | R339-I341 HydrophobicContact CG-CG1 4.32Š| ||
| 340 | Y | 29.3 | Very low | 34.1 | Very low | 217 Ų | 217 | 155.4 Ų | 155.4 | 85% | 0.851 | 78% | 0.782 | S | S | * | * | trans | -63 | 146.6 | 153.3 | -88.1 | -97.9 | 0 | 0 | 0 | 108.9 | ||||
| 341 | I | 31.2 | Very low | 34.8 | Very low | 115 Ų | 115 | 151 Ų | 151 | 59% | 0.59 | 78% | 0.776 | S | S | * | * | trans | -119.4 | 116.5 | 168 | -64.6 | 178.1 | 0 | 0 | 0 | 106.1 | R339 Y343 | R339-I341 HydrophobicContact CG-CG1 4.32Å; I341-Y343 HydrophobicContact CG2-CD2 4.23Å; I341-Y343 HydrophobicContact CG2-CE2 3.7Å | ||
| 342 | A | 29.1 | Very low | 35.8 | Very low | 87 Ų | 87 | 150.2 Ų | 150.2 | 72% | 0.719 | 77% | 0.773 | S | S | * | * | trans | -81.6 | 147.2 | 169.4 | 0 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 343 | Y | 35 | Very low | 36.3 | Very low | 208 Ų | 208 | 149.2 Ų | 149.2 | 82% | 0.816 | 77% | 0.773 | S | S | * | * | trans | -121.4 | 95.9 | 165.6 | -78.6 | -72.6 | 0 | 0 | 0 | 108.8 | I341 | I341-Y343 HydrophobicContact CG2-CD2 4.23Å; I341-Y343 HydrophobicContact CG2-CE2 3.7Å | ||
| 344 | T | 33.3 | Very low | 37.3 | Very low | 132 Ų | 132 | 149.4 Ų | 149.4 | 81% | 0.81 | 78% | 0.777 | S | S | * | * | P | Polyproline II helix | trans | -71.1 | 134.9 | 163.1 | 40.9 | 0 | 0 | 0 | 0 | 108.9 | ||
| 345 | L | 35.3 | Very low | 38.3 | Very low | 154 Ų | 154 | 145.9 Ų | 145.9 | 81% | 0.806 | 77% | 0.774 | S | S | * | * | P | Polyproline II helix | trans | -77.5 | 140.2 | 163.2 | -82.3 | 75.8 | 0 | 0 | 0 | 108.3 | R347 | L345-R347 PolarHBondContact O-N 3.48Š|
| 346 | P | 37.9 | Very low | 39.1 | Very low | 131 Ų | 131 | 144 Ų | 144 | 85% | 0.851 | 77% | 0.77 | S | S | * | * | P | Polyproline II helix | trans | -66.8 | 129.6 | 174.6 | 28 | -33.4 | 0 | 0 | 0 | 110.4 | ||
| 347 | R | 44 | Very low | 39.4 | Very low | 232 Ų | 232 | 144.7 Ų | 144.7 | 88% | 0.875 | 77% | 0.769 | S | S | * | * | P | Polyproline II helix | trans | -88.2 | 160.4 | 165.2 | -81.7 | 178.7 | 162.8 | 160.1 | -6.6 | 110.1 | L345 | L345-R347 PolarHBondContact O-N 3.48Š|
| 348 | S | 47.4 | Very low | 39.9 | Very low | 92 Ų | 92 | 150.4 Ų | 150.4 | 64% | 0.643 | 77% | 0.773 | S | S | * | * | P | Polyproline II helix | trans | -66.8 | 150.4 | 175.2 | 51.8 | 0 | 0 | 0 | 0 | 112.3 | S350 | S348-S350 PolarHBondContact O-N 3.13Å; S348-S350 PolarHBondContact OG-OG 3.02Å |
| 349 | N | 46.4 | Very low | 40.6 | Very low | 180 Ų | 180 | 152.2 Ų | 152.2 | 96% | 0.963 | 78% | 0.779 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.3 | 41.1 | -172.6 | -62.1 | -9 | 0 | 0 | 0 | 114.7 | ||
| 350 | S | 48.8 | Very low | 41.1 | Very low | 99 Ų | 99 | 150.9 Ų | 150.9 | 69% | 0.692 | 78% | 0.782 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -129.1 | 10.6 | -169 | 52.3 | 0 | 0 | 0 | 0 | 115.4 | S348 | S348-S350 PolarHBondContact O-N 3.13Å; S348-S350 PolarHBondContact OG-OG 3.02Å |
| 351 | C | 42 | Very low | 41.7 | Very low | 111 Ų | 111 | 146.6 Ų | 146.6 | 75% | 0.75 | 78% | 0.781 | S | S | * | * | trans | -156 | 130.8 | 173.1 | -167.8 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 352 | P | 51.8 | Low | 42 | Very low | 111 Ų | 111 | 145.7 Ų | 145.7 | 72% | 0.721 | 79% | 0.791 | S | S | * | * | trans | -82.3 | 155.5 | 173.8 | 33.9 | -34.4 | 0 | 0 | 0 | 112.7 | ||||
| 353 | D | 42.2 | Very low | 42.6 | Very low | 138 Ų | 138 | 147.4 Ų | 147.4 | 74% | 0.738 | 79% | 0.794 | S | S | * | * | trans | -104.7 | 145.8 | 178.5 | -167.7 | -0.8 | 0 | 0 | 0 | 111.3 | ||||
| 354 | L | 46.9 | Very low | 42.6 | Very low | 143 Ų | 143 | 145.5 Ų | 145.5 | 75% | 0.749 | 80% | 0.796 | S | S | * | * | trans | -119.7 | 23.4 | -164.9 | -97.1 | 137.2 | 0 | 0 | 0 | 113.5 | M356 | L354-M356 PolarHBondContact O-N 3.41Š| ||
| 355 | S | 51.6 | Low | 42.8 | Very low | 93 Ų | 93 | 144 Ų | 144 | 65% | 0.65 | 79% | 0.789 | S | S | * | * | G | 310 helix | trans | -72 | 14.7 | -176.3 | 52.6 | 0 | 0 | 0 | 0 | 116.3 | Y357 | S355-Y357 PolarHBondContact O-N 2.94Å; S355-Y357 VanDerWaalsContact O-N 3.1Å |
| 356 | M | 44.3 | Very low | 42.6 | Very low | 164 Ų | 164 | 142.7 Ų | 142.7 | 81% | 0.808 | 79% | 0.793 | S | S | * | * | G | 310 helix | trans | -61.6 | -19.1 | -174.3 | -173.6 | 174.6 | -75.9 | 0 | 0 | 115.2 | L354 | L354-M356 PolarHBondContact O-N 3.41Š|
| 357 | Y | 41.3 | Very low | 42.4 | Very low | 203 Ų | 203 | 148 Ų | 148 | 80% | 0.796 | 80% | 0.796 | S | S | * | * | G | 310 helix | trans | -109.6 | 35.9 | -165.8 | -65.9 | -76.1 | 0 | 0 | 0 | 115.6 | S355 | S355-Y357 PolarHBondContact O-N 2.94Å; S355-Y357 VanDerWaalsContact O-N 3.1Å |
| 358 | R | 38.9 | Very low | 42.1 | Very low | 234 Ų | 234 | 146.6 Ų | 146.6 | 88% | 0.883 | 80% | 0.796 | S | S | * | * | trans | -127.1 | 115.9 | 175.1 | -130.9 | 176.3 | -157 | 166.9 | 9.2 | 113.7 | ||||
| 359 | V | 46.5 | Very low | 41.4 | Very low | 142 Ų | 142 | 153.9 Ų | 153.9 | 86% | 0.861 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -96.7 | 137.3 | 178.8 | -178.5 | 0 | 0 | 0 | 0 | 110.1 | ||
| 360 | E | 40.2 | Very low | 40.8 | Very low | 182 Ų | 182 | 148.6 Ų | 148.6 | 85% | 0.85 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -100.2 | 133.1 | 177 | -63.8 | -168.9 | 149.8 | 0 | 0 | 112.3 | ||
| 361 | P | 40.8 | Very low | 40.1 | Very low | 128 Ų | 128 | 153.4 Ų | 153.4 | 83% | 0.831 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -83.5 | 158 | 174.5 | 32.7 | -33.9 | 0 | 0 | 0 | 113.8 | ||
| 362 | A | 38.9 | Very low | 39.6 | Very low | 96 Ų | 96 | 153.4 Ų | 153.4 | 79% | 0.793 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -84.5 | 158.1 | -162.8 | 0 | 0 | 0 | 0 | 0 | 116.5 | ||
| 363 | P | 40.3 | Very low | 38.9 | Very low | 122 Ų | 122 | 154.6 Ų | 154.6 | 79% | 0.792 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -97.5 | 144.8 | -170.5 | 36.7 | -35.7 | 0 | 0 | 0 | 116.3 | ||
| 364 | I | 35.5 | Very low | 38.5 | Very low | 168 Ų | 168 | 153.4 Ų | 153.4 | 86% | 0.862 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -94.1 | 138.9 | 176.9 | -57.1 | 175.3 | 0 | 0 | 0 | 111 | ||
| 365 | P | 38.6 | Very low | 37.8 | Very low | 102 Ų | 102 | 151.3 Ų | 151.3 | 66% | 0.662 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -89.9 | 157.1 | -175.4 | 35.1 | -36.1 | 0 | 0 | 0 | 115.1 | ||
| 366 | S | 31 | Very low | 36.9 | Very low | 125 Ų | 125 | 154 Ų | 154 | 87% | 0.874 | 82% | 0.817 | S | S | * | * | trans | -105.6 | 157.9 | 176 | 57 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 367 | R | 32 | Very low | 36.3 | Very low | 242 Ų | 242 | 155.3 Ų | 155.3 | 91% | 0.913 | 82% | 0.824 | S | S | * | * | trans | -109.5 | 158.6 | -179.4 | -149 | 178 | -166.8 | -164.5 | 5.4 | 111.2 | ||||
| 368 | K | 38.8 | Very low | 36 | Very low | 203 Ų | 203 | 151.2 Ų | 151.2 | 88% | 0.883 | 82% | 0.82 | S | S | * | * | trans | -126.4 | 152.5 | 178.5 | -72.1 | -170.6 | 174.6 | -171.1 | 0 | 112.9 | ||||
| 369 | R | 33.4 | Very low | 35.7 | Very low | 245 Ų | 245 | 145.4 Ų | 145.4 | 93% | 0.925 | 82% | 0.821 | S | S | * | * | trans | -153.3 | 164.2 | 157.2 | -79.7 | -166.3 | -178.7 | -152.1 | 3 | 107 | ||||
| 370 | A | 33.1 | Very low | 35.1 | Very low | 69 Ų | 69 | 143.7 Ų | 143.7 | 57% | 0.57 | 82% | 0.822 | S | S | * | * | cis | -165.7 | 166.4 | -34.2 | 0 | 0 | 0 | 0 | 0 | 107.6 | ||||
| 371 | F | 33.8 | Very low | 34.8 | Very low | 201 Ų | 201 | 143.7 Ų | 143.7 | 88% | 0.882 | 82% | 0.822 | S | S | * | * | trans | 61.2 | 92.4 | 171 | -57.5 | -70.2 | 0 | 0 | 0 | 118.2 | ||||
| 372 | S | 31.4 | Very low | 34.3 | Very low | 111 Ų | 111 | 149 Ų | 149 | 78% | 0.776 | 83% | 0.826 | S | S | * | * | trans | -127.1 | 131.4 | 145.6 | 57.2 | 0 | 0 | 0 | 0 | 106.9 | ||||
| 373 | V | 37.1 | Very low | 33.9 | Very low | 136 Ų | 136 | 153.8 Ų | 153.8 | 82% | 0.824 | 83% | 0.832 | S | S | * | * | trans | -122.9 | 118.6 | 173.6 | -179.3 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 374 | C | 33.2 | Very low | 33.7 | Very low | 113 Ų | 113 | 153.1 Ų | 153.1 | 76% | 0.764 | 84% | 0.836 | S | S | * | * | P | Polyproline II helix | trans | -98.2 | 142.8 | 166.9 | -59.7 | 0 | 0 | 0 | 0 | 108.2 | ||
| 375 | A | 32.4 | Very low | 33.6 | Very low | 99 Ų | 99 | 148.5 Ų | 148.5 | 82% | 0.818 | 83% | 0.831 | S | S | * | * | P | Polyproline II helix | trans | -80.3 | 143.8 | 166.4 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||
| 376 | D | 33.3 | Very low | 33.2 | Very low | 149 Ų | 149 | 152.2 Ų | 152.2 | 80% | 0.797 | 84% | 0.841 | S | S | * | * | P | Polyproline II helix | trans | -79.1 | 124.1 | -170.1 | -85 | -53 | 0 | 0 | 0 | 114.4 | V378 | D376-V378 HydrophobicContact CB-CG2 4.15Å; D376-V378 PolarHBondContact O-N 3.48Å |
| 377 | M | 31.4 | Very low | 33.3 | Very low | 191 Ų | 191 | 152.9 Ų | 152.9 | 94% | 0.941 | 84% | 0.84 | S | S | * | * | trans | -81.6 | 82.4 | 165.5 | -74.2 | -176.2 | 63.6 | 0 | 0 | 111 | ||||
| 378 | V | 35.5 | Very low | 33.5 | Very low | 118 Ų | 118 | 150 Ų | 150 | 72% | 0.715 | 84% | 0.836 | S | S | * | * | trans | -124.9 | -21.6 | 177.7 | 177.7 | 0 | 0 | 0 | 0 | 113.7 | D376 | D376-V378 HydrophobicContact CB-CG2 4.15Å; D376-V378 PolarHBondContact O-N 3.48Å | ||
| 379 | A | 32.2 | Very low | 33.3 | Very low | 111 Ų | 111 | 144.3 Ų | 144.3 | 92% | 0.917 | 83% | 0.827 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80 | -17.4 | -171.3 | 0 | 0 | 0 | 0 | 0 | 115.9 | ||
| 380 | A | 33.5 | Very low | 33.6 | Very low | 106 Ų | 106 | 140 Ų | 140 | 88% | 0.876 | 82% | 0.823 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -109.4 | 24.7 | -164.8 | 0 | 0 | 0 | 0 | 0 | 115.1 | ||
| 381 | Q | 34.1 | Very low | 33.8 | Very low | 183 Ų | 183 | 141 Ų | 141 | 86% | 0.855 | 83% | 0.825 | S | S | * | * | trans | -123.7 | 64 | -179.7 | -162.2 | 159.9 | 3.4 | 0 | 0 | 113.4 | ||||
| 382 | R | 31.7 | Very low | 34.4 | Very low | 239 Ų | 239 | 139 Ų | 139 | 90% | 0.902 | 82% | 0.824 | S | S | * | * | trans | -135.7 | 92.2 | 159.2 | -75.5 | -173.8 | 179.5 | 172.8 | 0.6 | 109.5 | ||||
| 383 | E | 30.3 | Very low | 35.4 | Very low | 196 Ų | 196 | 138.4 Ų | 138.4 | 92% | 0.916 | 82% | 0.816 | S | S | * | * | trans | 173.7 | -174.4 | 136 | -95.5 | 165.7 | -155.9 | 0 | 0 | 110.3 | ||||
| 384 | A | 36 | Very low | 35.9 | Very low | 108 Ų | 108 | 137.5 Ų | 137.5 | 89% | 0.893 | 80% | 0.803 | S | S | * | * | trans | -39.8 | 157.7 | -172.1 | 0 | 0 | 0 | 0 | 0 | 116.5 | ||||
| 385 | G | 32.1 | Very low | 36.7 | Very low | 72 Ų | 72 | 138.6 Ų | 138.6 | 74% | 0.742 | 80% | 0.8 | S | S | * | * | cis | 161.3 | 148.5 | 8.9 | 0 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 386 | M | 31.7 | Very low | 37.7 | Very low | 179 Ų | 179 | 139 Ų | 139 | 88% | 0.882 | 80% | 0.797 | S | S | * | * | trans | -94.1 | 117.9 | -161.4 | -176.9 | -174.4 | 71.7 | 0 | 0 | 113.9 | ||||
| 387 | V | 33.3 | Very low | 38.7 | Very low | 140 Ų | 140 | 139 Ų | 139 | 85% | 0.848 | 79% | 0.789 | S | S | * | * | trans | -140.2 | 138.6 | 165.1 | -175.5 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 388 | H | 35.2 | Very low | 39.6 | Very low | 180 Ų | 180 | 136 Ų | 136 | 83% | 0.833 | 78% | 0.777 | S | S | * | * | trans | -112.4 | 124.3 | 170.5 | -91.8 | -76.9 | 0 | 0 | 0 | 110.1 | ||||
| 389 | A | 35.5 | Very low | 40.3 | Very low | 84 Ų | 84 | 134.1 Ų | 134.1 | 69% | 0.694 | 76% | 0.763 | S | S | * | * | 160.5 | 133.2 | 128.6 | 0 | 0 | 0 | 0 | 0 | 114.2 | |||||
| 390 | N | 39 | Very low | 41.5 | Very low | 155 Ų | 155 | 138.7 Ų | 138.7 | 83% | 0.829 | 76% | 0.756 | S | S | * | * | trans | 46 | 109.2 | 143.5 | -54.5 | -4.3 | 0 | 0 | 0 | 121.1 | ||||
| 391 | S | 37.1 | Very low | 42.4 | Very low | 90 Ų | 90 | 141.2 Ų | 141.2 | 63% | 0.629 | 75% | 0.75 | S | S | * | * | -172.1 | 153.9 | 129.5 | 24.1 | 0 | 0 | 0 | 0 | 112.1 | T393 | S391-T393 WeakPolarHBondContact CB-OG1 3.45Å; S391-T393 PolarHBondContact O-N 2.92Å; S391-T393 PolarHBondContact OG-OG1 3.45Å; S391-T393 VanDerWaalsContact OG-OG1 3.12Å | |||
| 392 | D | 46.4 | Very low | 43.3 | Very low | 159 Ų | 159 | 139.6 Ų | 139.6 | 85% | 0.85 | 74% | 0.74 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74.5 | 38.2 | 176.2 | -65.5 | -69.7 | 0 | 0 | 0 | 113.4 | ||
| 393 | T | 52.8 | Low | 44.4 | Very low | 98 Ų | 98 | 132.4 Ų | 132.4 | 60% | 0.601 | 72% | 0.723 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -118 | 7.6 | -171.2 | 43 | 0 | 0 | 0 | 0 | 114.1 | S391 | S391-T393 WeakPolarHBondContact CB-OG1 3.45Å; S391-T393 PolarHBondContact O-N 2.92Å; S391-T393 PolarHBondContact OG-OG1 3.45Å; S391-T393 VanDerWaalsContact OG-OG1 3.12Å |
| 394 | E | 47 | Very low | 45.5 | Very low | 118 Ų | 118 | 129 Ų | 129 | 55% | 0.551 | 71% | 0.705 | S | S | * | * | trans | -99.2 | -4.3 | 173.4 | -66.5 | -102.5 | 115.6 | 0 | 0 | 113.2 | S396 K397 | E394-S396 PolarHBondContact O-N 3.47Å; E394-K397 WeakPolarHBondContact O-CB 3.47Å; E394-K397 PolarHBondContact O-N 3.08Å; E394-K397 WeakPolarHBondContact OE1-CD 3.24Å; E394-K397 VanDerWaalsContact OE1-CE 3.29Å; E394-K397 WeakPolarHBondContact OE1-CE 3.33Å; E394-K397 IonicContact OE1-NZ 2.65Å; E394-K397 PolarHBondContact OE1-NZ 2.96Å | ||
| 395 | L | 50.4 | Low | 46.3 | Very low | 135 Ų | 135 | 130.5 Ų | 130.5 | 71% | 0.707 | 69% | 0.694 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -66.4 | -8.2 | -179.7 | -109.5 | 164.9 | 0 | 0 | 0 | 114.3 | L398 | L395-L398 HydrophobicContact CD2-CD1 4.5Š|
| 396 | S | 52.8 | Low | 47.3 | Very low | 107 Ų | 107 | 133.2 Ų | 133.2 | 75% | 0.748 | 70% | 0.696 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87 | -6.4 | 170.1 | 51.8 | 0 | 0 | 0 | 0 | 114.2 | E394 | E394-S396 PolarHBondContact O-N 3.47Š|
| 397 | K | 55.4 | Low | 48.3 | Very low | 149 Ų | 149 | 128 Ų | 128 | 65% | 0.648 | 68% | 0.681 | S | S | * | * | S | Bend | trans | -99.7 | -1.4 | 179.4 | -63 | -177.2 | 179.2 | 175 | 0 | 114.1 | E394 D399 | E394-K397 WeakPolarHBondContact O-CB 3.47Å; E394-K397 PolarHBondContact O-N 3.08Å; E394-K397 WeakPolarHBondContact OE1-CD 3.24Å; E394-K397 VanDerWaalsContact OE1-CE 3.29Å; E394-K397 WeakPolarHBondContact OE1-CE 3.33Å; E394-K397 IonicContact OE1-NZ 2.65Å; E394-K397 PolarHBondContact OE1-NZ 2.96Å; K397-D399 PolarHBondContact O-N 2.79Å |
| 398 | L | 49.9 | Very low | 49.3 | Very low | 128 Ų | 128 | 127.8 Ų | 127.8 | 67% | 0.67 | 67% | 0.671 | S | S | * | * | S | Bend | trans | -85.4 | 106.4 | 173.8 | -90.6 | 167.4 | 0 | 0 | 0 | 110.5 | L395 R400 | L395-L398 HydrophobicContact CD2-CD1 4.5Å; L398-R400 PolarHBondContact O-N 3.01Å |
| 399 | D | 49.7 | Very low | 50 | Low | 80 Ų | 80 | 122.5 Ų | 122.5 | 43% | 0.428 | 66% | 0.658 | S | S | . | * | trans | -67.3 | 111.6 | 179.8 | -168.2 | 5.6 | 0 | 0 | 0 | 111 | K397 E401 K402 T403 | K397-D399 PolarHBondContact O-N 2.79Å; D399-E401 PolarHBondContact O-N 3.42Å; D399-K402 IonicContact OD2-NZ 3.77Å; D399-K402 PolarHBondContact OD2-NZ 2.93Å; D399-T403 PolarHBondContact O-OG1 3.27Å | ||
| 400 | R | 57.2 | Low | 50.8 | Low | 206 Ų | 206 | 128 Ų | 128 | 78% | 0.777 | 66% | 0.663 | S | S | * | * | S | Bend | trans | -79.7 | -23.6 | -158.7 | -161.4 | 175.5 | -177.9 | 111.6 | -1.8 | 113.5 | L398 F404 | L398-R400 PolarHBondContact O-N 3.01Å; R400-F404 WeakPolarHBondContact O-CD2 3.37Å |
| 401 | E | 52.6 | Low | 51.3 | Low | 160 Ų | 160 | 129.4 Ų | 129.4 | 75% | 0.748 | 66% | 0.657 | S | S | * | * | S | Bend | trans | -79.3 | -49.3 | -174.2 | -62.5 | -179.8 | 160.1 | 0 | 0 | 111.2 | D399 T403 F404 | D399-E401 PolarHBondContact O-N 3.42Å; E401-T403 PolarHBondContact O-N 3.38Å; E401-F404 PolarHBondContact O-N 2.88Å |
| 402 | K | 53 | Low | 51.9 | Low | 149 Ų | 149 | 132.3 Ų | 132.3 | 65% | 0.648 | 66% | 0.66 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -60.8 | -11.5 | 178.9 | -62.7 | -174.4 | -178.8 | 67.8 | 0 | 115.1 | D399 | D399-K402 IonicContact OD2-NZ 3.77Å; D399-K402 PolarHBondContact OD2-NZ 2.93Å |
| 403 | T | 54.1 | Low | 52.1 | Low | 87 Ų | 87 | 129.1 Ų | 129.1 | 53% | 0.534 | 65% | 0.647 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -86.8 | -14.8 | 178.3 | -53.6 | 0 | 0 | 0 | 0 | 112.5 | D399 E401 | D399-T403 PolarHBondContact O-OG1 3.27Å; E401-T403 PolarHBondContact O-N 3.38Å |
| 404 | F | 54.5 | Low | 52.2 | Low | 126 Ų | 126 | 128.6 Ų | 128.6 | 55% | 0.553 | 64% | 0.643 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -131.3 | 0.3 | -168.4 | -69 | -72.2 | 0 | 0 | 0 | 116.8 | R400 E401 T406 A407 | R400-F404 WeakPolarHBondContact O-CD2 3.37Å; E401-F404 PolarHBondContact O-N 2.88Å; F404-T406 PolarHBondContact O-N 3.46Å; F404-A407 WeakPolarHBondContact O-CB 3.49Å; F404-A407 PolarHBondContact O-N 3.05Å |
| 405 | E | 51.7 | Low | 52.4 | Low | 139 Ų | 139 | 127.7 Ų | 127.7 | 65% | 0.65 | 64% | 0.642 | S | S | * | * | G | 310 helix | trans | -50.9 | -35.8 | -178.8 | -70.5 | 177.8 | 102.9 | 0 | 0 | 114.4 | A407 E408 | E405-A407 PolarHBondContact O-N 2.97Å; E405-E408 PolarHBondContact O-N 2.69Å |
| 406 | T | 53.3 | Low | 52.5 | Low | 129 Ų | 129 | 127 Ų | 127 | 79% | 0.791 | 64% | 0.639 | S | S | * | * | G | 310 helix | trans | -68 | -11.6 | 178.5 | 38.3 | 0 | 0 | 0 | 0 | 114.6 | F404 | F404-T406 PolarHBondContact O-N 3.46Š|
| 407 | A | 54.1 | Low | 52.3 | Low | 69 Ų | 69 | 127.8 Ų | 127.8 | 57% | 0.57 | 63% | 0.634 | S | S | * | * | G | 310 helix | trans | -81.5 | -22.9 | 174.1 | 0 | 0 | 0 | 0 | 0 | 113.3 | F404 E405 | F404-A407 WeakPolarHBondContact O-CB 3.49Å; F404-A407 PolarHBondContact O-N 3.05Å; E405-A407 PolarHBondContact O-N 2.97Å |
| 408 | E | 53 | Low | 52.5 | Low | 135 Ų | 135 | 123.3 Ų | 123.3 | 63% | 0.631 | 62% | 0.624 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87.5 | -30.3 | -174.8 | -57.2 | -148.8 | 128 | 0 | 0 | 112.9 | E405 Y410 R411 | E405-E408 PolarHBondContact O-N 2.69Å; E408-Y410 PolarHBondContact O-N 3.39Å; E408-Y410 VanDerWaalsContact O-N 3.15Å; E408-R411 WeakPolarHBondContact O-CB 3.43Å; E408-R411 PolarHBondContact O-N 3.49Å |
| 409 | A | 51.4 | Low | 52.8 | Low | 69 Ų | 69 | 124 Ų | 124 | 57% | 0.57 | 62% | 0.622 | S | S | * | * | G | 310 helix | trans | -56.5 | -31.9 | 177.4 | 0 | 0 | 0 | 0 | 0 | 113.4 | R411 | A409-R411 VanDerWaalsContact C-N 3.26Å; A409-R411 PolarHBondContact O-N 3.2Å |
| 410 | Y | 50.9 | Low | 53.1 | Low | 201 Ų | 201 | 124.3 Ų | 124.3 | 79% | 0.788 | 63% | 0.627 | S | S | * | * | G | 310 helix | trans | -75.1 | -8.3 | -179.6 | -123 | -88.3 | 0 | 0 | 0 | 114.5 | E408 | E408-Y410 PolarHBondContact O-N 3.39Å; E408-Y410 VanDerWaalsContact O-N 3.15Å |
| 411 | R | 51 | Low | 53.4 | Low | 184 Ų | 184 | 118.8 Ų | 118.8 | 69% | 0.694 | 62% | 0.616 | S | S | * | * | G | 310 helix | trans | -87.8 | -21.3 | 178.5 | -99.1 | 177.2 | 165.8 | 159.2 | -4.7 | 114.4 | E408 A409 T414 | E408-R411 WeakPolarHBondContact O-CB 3.43Å; E408-R411 PolarHBondContact O-N 3.49Å; A409-R411 VanDerWaalsContact C-N 3.26Å; A409-R411 PolarHBondContact O-N 3.2Å; R411-T414 PolarHBondContact O-OG1 3.42Å |
| 412 | Q | 49.5 | Very low | 54 | Low | 150 Ų | 150 | 116.8 Ų | 116.8 | 70% | 0.701 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -85.6 | -22.7 | -172.1 | -66.4 | -174 | -4.8 | 0 | 0 | 113.8 | ||
| 413 | T | 50.4 | Low | 53.9 | Low | 93 Ų | 93 | 112.5 Ų | 112.5 | 57% | 0.571 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -72.3 | -31.1 | -179.9 | 52.8 | 0 | 0 | 0 | 0 | 112.9 | ||
| 414 | T | 54.9 | Low | 53.6 | Low | 86 Ų | 86 | 114.6 Ų | 114.6 | 53% | 0.528 | 61% | 0.61 | S | S | . | * | H | α-helix | trans | -70.5 | -37.8 | 177.3 | 43.8 | 0 | 0 | 0 | 0 | 112.9 | R411 L416 L417 A418 | R411-T414 PolarHBondContact O-OG1 3.42Å; T414-L416 VanDerWaalsContact C-N 3.33Å; T414-L416 PolarHBondContact O-N 3.43Å; T414-L417 PolarHBondContact O-N 3.41Å; T414-A418 PolarHBondContact O-N 3.01Å |
| 415 | D | 50.2 | Low | 53.6 | Low | 99 Ų | 99 | 112.5 Ų | 112.5 | 53% | 0.529 | 62% | 0.615 | S | S | . | * | H | α-helix | trans | -71.2 | -27.2 | -176.9 | -79.1 | 18 | 0 | 0 | 0 | 113.2 | K419 | D415-K419 WeakPolarHBondContact O-CG 3.32Å; D415-K419 PolarHBondContact O-N 2.89Å |
| 416 | L | 52.1 | Low | 53.7 | Low | 121 Ų | 121 | 111.2 Ų | 111.2 | 63% | 0.634 | 62% | 0.617 | S | S | * | * | H | α-helix | trans | -69.1 | -44.6 | 173.4 | -103.7 | 164.6 | 0 | 0 | 0 | 111.5 | T414 A418 K419 V420 | T414-L416 VanDerWaalsContact C-N 3.33Å; T414-L416 PolarHBondContact O-N 3.43Å; L416-A418 VanDerWaalsContact C-N 3.34Å; L416-A418 PolarHBondContact O-N 3.49Å; L416-K419 PolarHBondContact O-N 2.87Å; L416-V420 PolarHBondContact O-N 2.88Å |
| 417 | L | 50.3 | Low | 53.3 | Low | 123 Ų | 123 | 110.8 Ų | 110.8 | 64% | 0.644 | 61% | 0.614 | S | S | * | * | H | α-helix | trans | -65.3 | -38.5 | -179.9 | -166.2 | 145.7 | 0 | 0 | 0 | 111.5 | T414 K419 V421 | T414-L417 PolarHBondContact O-N 3.41Å; L417-K419 VanDerWaalsContact C-N 3.31Å; L417-K419 PolarHBondContact O-N 3.09Å; L417-V421 HydrophobicContact CD2-CG2 4.47Å; L417-V421 WeakPolarHBondContact O-CG2 3.35Å; L417-V421 PolarHBondContact O-N 3.28Å |
| 418 | A | 59.4 | Low | 53 | Low | 55 Ų | 55 | 116.7 Ų | 116.7 | 46% | 0.455 | 63% | 0.627 | S | S | . | * | H | α-helix | trans | -61.4 | -35.1 | 173.5 | 0 | 0 | 0 | 0 | 0 | 113.4 | T414 L416 N422 | T414-A418 PolarHBondContact O-N 3.01Å; L416-A418 VanDerWaalsContact C-N 3.34Å; L416-A418 PolarHBondContact O-N 3.49Å; A418-N422 PolarHBondContact O-N 3.5Å |
| 419 | K | 55.1 | Low | 52.9 | Low | 143 Ų | 143 | 115.2 Ų | 115.2 | 62% | 0.622 | 63% | 0.629 | S | S | * | * | H | α-helix | trans | -75.3 | -38 | -179.6 | -74.4 | 171.1 | -177.5 | 172 | 0 | 113.2 | D415 L416 L417 N422 A423 | D415-K419 WeakPolarHBondContact O-CG 3.32Å; D415-K419 PolarHBondContact O-N 2.89Å; L416-K419 PolarHBondContact O-N 2.87Å; L417-K419 VanDerWaalsContact C-N 3.31Å; L417-K419 PolarHBondContact O-N 3.09Å; K419-N422 PolarHBondContact O-N 3.1Å; K419-A423 PolarHBondContact O-N 3.19Å |
| 420 | V | 56.8 | Low | 52.6 | Low | 86 Ų | 86 | 117.6 Ų | 117.6 | 52% | 0.521 | 64% | 0.639 | S | S | . | * | H | α-helix | trans | -64.5 | -41.5 | 175.9 | 176 | 0 | 0 | 0 | 0 | 111.2 | L416 A423 L424 | L416-V420 PolarHBondContact O-N 2.88Å; V420-A423 PolarHBondContact O-N 3.13Å; V420-L424 HydrophobicContact CG1-CD1 4.48Å; V420-L424 PolarHBondContact O-N 3.48Å |
| 421 | V | 62.3 | Low | 52.4 | Low | 90 Ų | 90 | 113 Ų | 113 | 55% | 0.545 | 63% | 0.634 | S | S | . | * | H | α-helix | trans | -64.3 | -40.8 | 176.7 | 174.1 | 0 | 0 | 0 | 0 | 111.6 | L417 A423 A425 | L417-V421 HydrophobicContact CD2-CG2 4.47Å; L417-V421 WeakPolarHBondContact O-CG2 3.35Å; L417-V421 PolarHBondContact O-N 3.28Å; V421-A423 VanDerWaalsContact C-N 3.35Å; V421-A423 PolarHBondContact O-N 3.13Å; V421-A425 PolarHBondContact O-N 3.32Å |
| 422 | N | 65 | Low | 51.9 | Low | 119 Ų | 119 | 109.4 Ų | 109.4 | 64% | 0.636 | 64% | 0.643 | S | S | * | * | H | α-helix | trans | -64.9 | -34 | 174.4 | -94.4 | -2.6 | 0 | 0 | 0 | 113.4 | A418 K419 A425 T426 | A418-N422 PolarHBondContact O-N 3.5Å; K419-N422 PolarHBondContact O-N 3.1Å; N422-A425 PolarHBondContact O-N 3.5Å; N422-T426 WeakPolarHBondContact O-CG2 3.49Å |
| 423 | A | 50.9 | Low | 51.3 | Low | 58 Ų | 58 | 110.5 Ų | 110.5 | 48% | 0.479 | 65% | 0.648 | S | S | . | * | H | α-helix | trans | -66.3 | -47.9 | 177.1 | 0 | 0 | 0 | 0 | 0 | 111.6 | K419 V420 V421 A425 T426 | K419-A423 PolarHBondContact O-N 3.19Å; V420-A423 PolarHBondContact O-N 3.13Å; V421-A423 VanDerWaalsContact C-N 3.35Å; V421-A423 PolarHBondContact O-N 3.13Å; A423-A425 PolarHBondContact O-N 3.29Å; A423-T426 PolarHBondContact O-N 2.77Å; A423-T426 VanDerWaalsContact O-N 3.08Å; A423-T426 PolarHBondContact O-OG1 3.06Å |
| 424 | L | 48.8 | Very low | 50.8 | Low | 132 Ų | 132 | 113.9 Ų | 113.9 | 69% | 0.691 | 66% | 0.658 | S | S | * | * | H | α-helix | trans | -59 | -31.6 | 177.3 | -89.9 | 159 | 0 | 0 | 0 | 113.1 | V420 T426 | V420-L424 HydrophobicContact CG1-CD1 4.48Å; V420-L424 PolarHBondContact O-N 3.48Å; L424-T426 PolarHBondContact O-N 2.87Å |
| 425 | A | 54.4 | Low | 50 | Low | 81 Ų | 81 | 117.6 Ų | 117.6 | 67% | 0.669 | 67% | 0.669 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.1 | -3.6 | 177.9 | 0 | 0 | 0 | 0 | 0 | 114.9 | V421 N422 A423 | V421-A425 PolarHBondContact O-N 3.32Å; N422-A425 PolarHBondContact O-N 3.5Å; A423-A425 PolarHBondContact O-N 3.29Å |
| 426 | T | 53.8 | Low | 49.3 | Very low | 113 Ų | 113 | 119.9 Ų | 119.9 | 69% | 0.693 | 68% | 0.681 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -105.6 | -6 | -176.7 | 61.3 | 0 | 0 | 0 | 0 | 115.2 | N422 A423 L424 K428 | N422-T426 WeakPolarHBondContact O-CG2 3.49Å; A423-T426 PolarHBondContact O-N 2.77Å; A423-T426 VanDerWaalsContact O-N 3.08Å; A423-T426 PolarHBondContact O-OG1 3.06Å; L424-T426 PolarHBondContact O-N 2.87Å; T426-K428 PolarHBondContact O-N 3.23Å |
| 427 | V | 44.9 | Very low | 49.1 | Very low | 119 Ų | 119 | 119.6 Ų | 119.6 | 72% | 0.721 | 70% | 0.696 | S | S | * | * | trans | -76.8 | 108.8 | 173.4 | -178.3 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 428 | K | 47.7 | Very low | 48.9 | Very low | 194 Ų | 194 | 117.6 Ų | 117.6 | 84% | 0.843 | 70% | 0.697 | S | S | * | * | P | Polyproline II helix | trans | -86.4 | 123 | 179 | -163.5 | -177.7 | -175.8 | -172.6 | 0 | 109.3 | T426 | T426-K428 PolarHBondContact O-N 3.23Š|
| 429 | P | 50 | Low | 48.5 | Very low | 104 Ų | 104 | 122.8 Ų | 122.8 | 68% | 0.675 | 72% | 0.717 | S | S | * | * | P | Polyproline II helix | trans | -65.3 | 151.7 | 170.1 | 28.5 | -33.9 | 0 | 0 | 0 | 110.4 | ||
| 430 | P | 45.9 | Very low | 47.9 | Very low | 119 Ų | 119 | 127.4 Ų | 127.4 | 77% | 0.773 | 73% | 0.732 | S | S | * | * | P | Polyproline II helix | trans | -64.2 | 157.2 | 174.4 | 28.4 | -34.6 | 0 | 0 | 0 | 111.5 | ||
| 431 | P | 45.9 | Very low | 47.4 | Very low | 105 Ų | 105 | 126.9 Ų | 126.9 | 68% | 0.682 | 74% | 0.743 | S | S | * | * | P | Polyproline II helix | trans | -67.3 | 155.2 | 175 | 30.9 | -35.4 | 0 | 0 | 0 | 111.4 | E433 | P431-E433 PolarHBondContact O-N 3.17Š|
| 432 | A | 42.3 | Very low | 46.5 | Very low | 108 Ų | 108 | 124.2 Ų | 124.2 | 89% | 0.893 | 73% | 0.734 | S | S | * | * | trans | -81.3 | 101.6 | 172.1 | 0 | 0 | 0 | 0 | 0 | 110 | ||||
| 433 | E | 36.3 | Very low | 45.6 | Very low | 173 Ų | 173 | 128.2 Ų | 128.2 | 81% | 0.808 | 74% | 0.742 | S | S | * | * | trans | -91.6 | 172.5 | 158.8 | -67.8 | -178.7 | 174.9 | 0 | 0 | 109.3 | P431 | P431-E433 PolarHBondContact O-N 3.17Š| ||
| 434 | Q | 39.6 | Very low | 45.3 | Very low | 164 Ų | 164 | 133 Ų | 133 | 77% | 0.766 | 75% | 0.754 | S | S | * | * | trans | -81.6 | 152.9 | -161.8 | -68.6 | 153.6 | -115.4 | 0 | 0 | 114.3 | ||||
| 435 | E | 38.6 | Very low | 45.7 | Very low | 163 Ų | 163 | 130 Ų | 130 | 76% | 0.762 | 76% | 0.755 | S | S | * | * | trans | 63.2 | 135.4 | 164.6 | -66.6 | 134.1 | -129.1 | 0 | 0 | 114.3 | ||||
| 436 | D | 35 | Very low | 45.5 | Very low | 148 Ų | 148 | 132.2 Ų | 132.2 | 79% | 0.791 | 75% | 0.75 | S | S | * | * | cis | -138.3 | 155.5 | 27.6 | -88.4 | -53.1 | 0 | 0 | 0 | 114.1 | A438 | D436-A438 VanDerWaalsContact C-N 3.33Å; D436-A438 PolarHBondContact O-N 3.05Å | ||
| 437 | A | 47.4 | Very low | 45.7 | Very low | 114 Ų | 114 | 129.4 Ų | 129.4 | 94% | 0.942 | 74% | 0.735 | S | S | * | * | S | Bend | trans | -88.2 | 49.3 | 176.7 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||
| 438 | A | 47.6 | Very low | 46 | Very low | 81 Ų | 81 | 129.1 Ų | 129.1 | 67% | 0.669 | 73% | 0.729 | S | S | * | * | trans | -148.9 | 13.2 | -169.1 | 0 | 0 | 0 | 0 | 0 | 119.4 | D436 | D436-A438 VanDerWaalsContact C-N 3.33Å; D436-A438 PolarHBondContact O-N 3.05Å | ||
| 439 | L | 50.2 | Low | 46.3 | Very low | 165 Ų | 165 | 124 Ų | 124 | 86% | 0.864 | 72% | 0.717 | S | S | * | * | S | Bend | trans | -154 | 69 | 179.2 | -146.6 | 75.5 | 0 | 0 | 0 | 118.5 | ||
| 440 | Y | 41.9 | Very low | 46.6 | Very low | 240 Ų | 240 | 124 Ų | 124 | 94% | 0.941 | 71% | 0.709 | S | S | * | * | trans | -168.6 | 122.4 | 136.9 | -125.6 | -95.2 | 0 | 0 | 0 | 110 | ||||
| 441 | G | 46.3 | Very low | 47.1 | Very low | 74 Ų | 74 | 121.9 Ų | 121.9 | 76% | 0.763 | 69% | 0.69 | S | S | * | * | P | Polyproline II helix | trans | -84.5 | 120.6 | -174.5 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||
| 442 | G | 43.4 | Very low | 47.5 | Very low | 34 Ų | 34 | 122.2 Ų | 122.2 | 35% | 0.351 | 69% | 0.686 | S | S | . | * | P | Polyproline II helix | trans | -64.4 | 150.2 | 163.9 | 0 | 0 | 0 | 0 | 0 | 111.5 | H444 G445 | G442-H444 PolarHBondContact O-N 3.29Å; G442-G445 PolarHBondContact O-N 3.3Å |
| 443 | Y | 46.2 | Very low | 48.2 | Very low | 203 Ų | 203 | 120.2 Ų | 120.2 | 80% | 0.796 | 67% | 0.669 | S | S | * | * | G | 310 helix | trans | -64.4 | 127.3 | -177.9 | -150.4 | -99.4 | 0 | 0 | 0 | 109.9 | G445 | Y443-G445 VanDerWaalsContact C-N 3.3Å; Y443-G445 PolarHBondContact O-N 2.96Å |
| 444 | H | 45.4 | Very low | 49.1 | Very low | 158 Ų | 158 | 115.4 Ų | 115.4 | 73% | 0.731 | 65% | 0.654 | S | S | * | * | G | 310 helix | trans | 62.6 | 18.8 | -168.2 | -60.6 | -67.8 | 0 | 0 | 0 | 117.1 | G442 F446 | G442-H444 PolarHBondContact O-N 3.29Å; H444-F446 WeakPolarHBondContact O-CD2 3.25Å; H444-F446 PolarHBondContact O-N 2.66Å; H444-F446 VanDerWaalsContact O-N 3.14Å |
| 445 | G | 56.9 | Low | 49.7 | Very low | 70 Ų | 70 | 114.5 Ų | 114.5 | 72% | 0.722 | 65% | 0.65 | S | S | * | * | G | 310 helix | trans | 75.2 | 2.1 | 163 | 0 | 0 | 0 | 0 | 0 | 116.5 | G442 Y443 | G442-G445 PolarHBondContact O-N 3.3Å; Y443-G445 VanDerWaalsContact C-N 3.3Å; Y443-G445 PolarHBondContact O-N 2.96Å |
| 446 | F | 50.2 | Low | 49.9 | Very low | 128 Ų | 128 | 118.3 Ų | 118.3 | 56% | 0.561 | 66% | 0.658 | S | S | * | * | trans | -88 | 154.6 | 164.7 | -65.5 | -79.2 | 0 | 0 | 0 | 110.4 | H444 I451 | H444-F446 WeakPolarHBondContact O-CD2 3.25Å; H444-F446 PolarHBondContact O-N 2.66Å; H444-F446 VanDerWaalsContact O-N 3.14Å; F446-I451 HydrophobicContact CB-CG1 4.38Å | ||
| 447 | S | 57.3 | Low | 50.2 | Low | 53 Ų | 53 | 114.8 Ų | 114.8 | 37% | 0.371 | 65% | 0.645 | S | S | . | * | trans | -83.2 | 148 | 172.4 | 59.7 | 0 | 0 | 0 | 0 | 111.4 | S449 Q450 I451 | S447-S449 PolarHBondContact O-N 3.12Å; S447-S449 PolarHBondContact OG-OG 3.42Å; S447-Q450 WeakPolarHBondContact O-CA 3.35Å; S447-Q450 WeakPolarHBondContact O-CB 3.39Å; S447-Q450 PolarHBondContact O-N 3.37Å; S447-Q450 WeakPolarHBondContact OG-CG 3.17Å; S447-Q450 PolarHBondContact OG-OE1 3.37Å; S447-I451 PolarHBondContact O-N 3.1Å; S447-I451 VanDerWaalsContact O-N 3.17Å | ||
| 448 | D | 50.9 | Low | 49.3 | Very low | 114 Ų | 114 | 118.6 Ų | 118.6 | 61% | 0.61 | 64% | 0.64 | S | S | * | * | H | α-helix | trans | -55.5 | -29.1 | -179.7 | -67.8 | -12.7 | 0 | 0 | 0 | 113 | I451 L452 | D448-I451 PolarHBondContact O-N 3.24Å; D448-L452 WeakPolarHBondContact O-CB 3.2Å; D448-L452 VanDerWaalsContact O-CG 3.3Å; D448-L452 WeakPolarHBondContact O-CG 3.37Å; D448-L452 PolarHBondContact O-N 3.36Å |
| 449 | S | 54.7 | Low | 48.6 | Very low | 85 Ų | 85 | 120.6 Ų | 120.6 | 59% | 0.594 | 65% | 0.649 | S | S | * | * | H | α-helix | trans | -69.8 | -30.5 | 175 | 59.2 | 0 | 0 | 0 | 0 | 113.4 | S447 A453 | S447-S449 PolarHBondContact O-N 3.12Å; S447-S449 PolarHBondContact OG-OG 3.42Å; S449-A453 VanDerWaalsContact O-CB 3.25Å; S449-A453 WeakPolarHBondContact O-CB 3.39Å; S449-A453 PolarHBondContact O-N 3.39Å |
| 450 | Q | 56 | Low | 47.6 | Very low | 105 Ų | 105 | 118.3 Ų | 118.3 | 49% | 0.491 | 64% | 0.643 | S | S | . | * | H | α-helix | trans | -74.7 | -38.2 | 172.1 | -69.2 | 167.1 | -63 | 0 | 0 | 111.5 | S447 A453 S454 | S447-Q450 WeakPolarHBondContact O-CA 3.35Å; S447-Q450 WeakPolarHBondContact O-CB 3.39Å; S447-Q450 PolarHBondContact O-N 3.37Å; S447-Q450 WeakPolarHBondContact OG-CG 3.17Å; S447-Q450 PolarHBondContact OG-OE1 3.37Å; Q450-A453 PolarHBondContact O-N 3.08Å; Q450-S454 PolarHBondContact O-N 3.18Å; Q450-S454 VanDerWaalsContact O-N 3.1Å |
| 451 | I | 56.3 | Low | 47.1 | Very low | 74 Ų | 74 | 112.9 Ų | 112.9 | 38% | 0.379 | 63% | 0.634 | S | S | . | * | H | α-helix | trans | -60 | -54 | 174.6 | -60.2 | 175.3 | 0 | 0 | 0 | 109.1 | F446 S447 D448 A453 S454 | F446-I451 HydrophobicContact CB-CG1 4.38Å; S447-I451 PolarHBondContact O-N 3.1Å; S447-I451 VanDerWaalsContact O-N 3.17Å; D448-I451 PolarHBondContact O-N 3.24Å; I451-A453 VanDerWaalsContact C-N 3.29Å; I451-A453 PolarHBondContact O-N 3.41Å; I451-S454 PolarHBondContact O-N 2.86Å; I451-S454 VanDerWaalsContact O-N 3.12Å; I451-S454 PolarHBondContact O-OG 3.35Å |
| 452 | L | 55.7 | Low | 46.4 | Very low | 113 Ų | 113 | 115.4 Ų | 115.4 | 59% | 0.592 | 63% | 0.63 | S | S | * | * | H | α-helix | trans | -62 | -30.6 | 176.6 | -69.3 | 168.9 | 0 | 0 | 0 | 113.8 | D448 | D448-L452 WeakPolarHBondContact O-CB 3.2Å; D448-L452 VanDerWaalsContact O-CG 3.3Å; D448-L452 WeakPolarHBondContact O-CG 3.37Å; D448-L452 PolarHBondContact O-N 3.36Å |
| 453 | A | 55.5 | Low | 45.7 | Very low | 65 Ų | 65 | 120.9 Ų | 120.9 | 54% | 0.537 | 65% | 0.646 | S | S | . | * | H | α-helix | trans | -69.6 | -32.6 | 175.5 | 0 | 0 | 0 | 0 | 0 | 113 | S449 Q450 I451 | S449-A453 VanDerWaalsContact O-CB 3.25Å; S449-A453 WeakPolarHBondContact O-CB 3.39Å; S449-A453 PolarHBondContact O-N 3.39Å; Q450-A453 PolarHBondContact O-N 3.08Å; I451-A453 VanDerWaalsContact C-N 3.29Å; I451-A453 PolarHBondContact O-N 3.41Å |
| 454 | S | 55.3 | Low | 45 | Very low | 73 Ų | 73 | 119 Ų | 119 | 51% | 0.51 | 64% | 0.643 | S | S | . | * | H | α-helix | trans | -69.1 | -33.2 | 179.7 | 70.3 | 0 | 0 | 0 | 0 | 113.6 | Q450 I451 W456 S457 | Q450-S454 PolarHBondContact O-N 3.18Å; Q450-S454 VanDerWaalsContact O-N 3.1Å; I451-S454 PolarHBondContact O-N 2.86Å; I451-S454 VanDerWaalsContact O-N 3.12Å; I451-S454 PolarHBondContact O-OG 3.35Å; S454-W456 PolarHBondContact O-N 3.26Å; S454-S457 PolarHBondContact O-N 2.96Å; S454-S457 PolarHBondContact O-OG 3.2Å |
| 455 | E | 52.4 | Low | 44.2 | Very low | 144 Ų | 144 | 117.6 Ų | 117.6 | 67% | 0.673 | 65% | 0.645 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67.5 | -16.9 | -178.5 | -64.6 | -165.5 | 149.8 | 0 | 0 | 114.1 | ||
| 456 | W | 44 | Very low | 42.9 | Very low | 243 Ų | 243 | 119.4 Ų | 119.4 | 92% | 0.92 | 65% | 0.647 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -106 | 9.8 | -175 | -77.7 | 12.6 | 0 | 0 | 0 | 114.5 | S454 | S454-W456 PolarHBondContact O-N 3.26Š|
| 457 | S | 40.1 | Very low | 42.5 | Very low | 74 Ų | 74 | 118.2 Ų | 118.2 | 52% | 0.517 | 65% | 0.652 | S | S | . | * | S | Bend | trans | -114.1 | 128.4 | 176.8 | 63.9 | 0 | 0 | 0 | 0 | 113.3 | S454 | S454-S457 PolarHBondContact O-N 2.96Å; S454-S457 PolarHBondContact O-OG 3.2Å |
| 458 | F | 29.9 | Very low | 41.1 | Very low | 194 Ų | 194 | 127.3 Ų | 127.3 | 85% | 0.851 | 68% | 0.679 | S | S | * | * | trans | 74.2 | 122.6 | 178.4 | -67.9 | -84.7 | 0 | 0 | 0 | 119.6 | ||||
| 459 | S | 32 | Very low | 40.7 | Very low | 123 Ų | 123 | 133.4 Ų | 133.4 | 86% | 0.86 | 69% | 0.693 | S | S | * | * | -154.1 | 114.9 | 123.5 | 42.8 | 0 | 0 | 0 | 0 | 111.5 | |||||
| 460 | T | 29.6 | Very low | 39.5 | Very low | 118 Ų | 118 | 135.5 Ų | 135.5 | 72% | 0.724 | 70% | 0.704 | S | S | * | * | trans | -137.2 | 143.3 | 162 | 48.4 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 461 | V | 31.2 | Very low | 38.2 | Very low | 126 Ų | 126 | 142.7 Ų | 142.7 | 76% | 0.764 | 73% | 0.727 | S | S | * | * | S | Bend | trans | 85.5 | 120 | 177.5 | -170.5 | 0 | 0 | 0 | 0 | 115.9 | ||
| 462 | N | 31.2 | Very low | 37.5 | Very low | 127 Ų | 127 | 143.6 Ų | 143.6 | 68% | 0.679 | 75% | 0.746 | S | S | * | * | trans | 60 | 115.6 | 158.9 | -68.3 | 25.1 | 0 | 0 | 0 | 120 | ||||
| 463 | E | 28.7 | Very low | 36.4 | Very low | 148 Ų | 148 | 150.2 Ų | 150.2 | 69% | 0.692 | 76% | 0.763 | S | S | * | * | 76.9 | 139.2 | 93.9 | -72.1 | -173.8 | 146.1 | 0 | 0 | 114.1 | |||||
| 464 | F | 31 | Very low | 35.2 | Very low | 164 Ų | 164 | 151 Ų | 151 | 72% | 0.719 | 77% | 0.77 | S | S | * | * | cis | -150.9 | 169.7 | 14 | -128.6 | -66.3 | 0 | 0 | 0 | 111.2 | ||||
| 465 | T | 29.5 | Very low | 34.2 | Very low | 128 Ų | 128 | 153.6 Ų | 153.6 | 79% | 0.785 | 79% | 0.786 | S | S | * | * | trans | 64.4 | 117.7 | 159 | 52.8 | 0 | 0 | 0 | 0 | 121.2 | ||||
| 466 | S | 29.8 | Very low | 33.4 | Very low | 108 Ų | 108 | 150.9 Ų | 150.9 | 76% | 0.755 | 78% | 0.783 | S | S | * | * | trans | -89.8 | -178.6 | 146.4 | 70.4 | 0 | 0 | 0 | 0 | 109 | ||||
| 467 | P | 42.5 | Very low | 33.1 | Very low | 104 Ų | 104 | 146.3 Ų | 146.3 | 68% | 0.675 | 78% | 0.777 | S | S | * | * | cis | -145.6 | 163.9 | 10.8 | 40.5 | -21 | 0 | 0 | 0 | 118.4 | ||||
| 468 | R | 27.8 | Very low | 32.8 | Very low | 244 Ų | 244 | 151.2 Ų | 151.2 | 92% | 0.921 | 79% | 0.789 | S | S | * | * | 168.1 | 161.2 | 122.4 | -94.4 | 170.7 | 174.2 | -176.5 | -0.9 | 114.1 | |||||
| 469 | R | 41.2 | Very low | 32.9 | Very low | 242 Ų | 242 | 148.8 Ų | 148.8 | 91% | 0.913 | 79% | 0.785 | S | S | * | * | trans | -103.5 | 146.6 | 169.4 | -59.5 | 178.9 | 179.8 | -176.5 | -0.9 | 111.4 | ||||
| 470 | P | 30.3 | Very low | 32.8 | Very low | 128 Ų | 128 | 149.1 Ų | 149.1 | 83% | 0.831 | 78% | 0.776 | S | S | * | * | trans | -96.3 | 179.6 | 151.3 | 34.8 | -28.9 | 0 | 0 | 0 | 112.3 | ||||
| 471 | R | 29.3 | Very low | 32.8 | Very low | 256 Ų | 256 | 152.1 Ų | 152.1 | 97% | 0.966 | 78% | 0.782 | S | S | * | * | trans | -146.1 | 149.1 | -172.5 | -145.4 | -179.6 | -163.5 | 163.8 | 3.2 | 112.4 | ||||
| 472 | A | 40.9 | Very low | 33.1 | Very low | 94 Ų | 94 | 150.1 Ų | 150.1 | 78% | 0.777 | 78% | 0.779 | S | S | * | * | trans | -61.7 | 164.7 | -166.1 | 0 | 0 | 0 | 0 | 0 | 119.8 | ||||
| 473 | R | 32.4 | Very low | 33.7 | Very low | 251 Ų | 251 | 149.3 Ų | 149.3 | 95% | 0.947 | 78% | 0.781 | S | S | * | * | trans | -174.5 | 172.5 | 157.9 | -94.9 | 158.8 | -166.7 | -152.6 | 4.2 | 109.1 | ||||
| 474 | A | 30.1 | Very low | 33.7 | Very low | 83 Ų | 83 | 152.6 Ų | 152.6 | 69% | 0.686 | 79% | 0.787 | S | S | * | * | -177.8 | 151.1 | -54.1 | 0 | 0 | 0 | 0 | 0 | 110.8 | |||||
| 475 | C | 33.5 | Very low | 33.7 | Very low | 126 Ų | 126 | 155.3 Ų | 155.3 | 85% | 0.851 | 79% | 0.792 | S | S | * | * | trans | 69.8 | 168.3 | 164.3 | -60.6 | 0 | 0 | 0 | 0 | 118.8 | ||||
| 476 | S | 35.6 | Very low | 33.6 | Very low | 88 Ų | 88 | 156.6 Ų | 156.6 | 62% | 0.615 | 79% | 0.79 | S | S | * | * | cis | 177.7 | 139.5 | -44 | 59.2 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 477 | D | 38.9 | Very low | 33.7 | Very low | 147 Ų | 147 | 156.3 Ų | 156.3 | 79% | 0.786 | 79% | 0.787 | S | S | * | * | trans | 61.1 | 152.1 | 143.1 | -51.7 | -18.8 | 0 | 0 | 0 | 122.6 | ||||
| 478 | F | 34.2 | Very low | 33.2 | Very low | 177 Ų | 177 | 158.1 Ų | 158.1 | 78% | 0.776 | 79% | 0.787 | S | S | * | * | cis | -171.1 | 149.7 | -29.4 | -145.5 | -84.5 | 0 | 0 | 0 | 111.3 | ||||
| 479 | N | 30.4 | Very low | 33.4 | Very low | 142 Ų | 142 | 156.4 Ų | 156.4 | 76% | 0.759 | 78% | 0.78 | S | S | * | * | trans | 172.2 | 141.9 | 157.9 | -94.3 | -9.9 | 0 | 0 | 0 | 110.3 | ||||
| 480 | L | 30.5 | Very low | 33.3 | Very low | 130 Ų | 130 | 149.9 Ų | 149.9 | 68% | 0.681 | 77% | 0.769 | S | S | * | * | cis | 84.7 | 132.8 | 36.9 | -68.1 | 170.1 | 0 | 0 | 0 | 114.1 | ||||
| 481 | E | 30.1 | Very low | 33.2 | Very low | 182 Ų | 182 | 151 Ų | 151 | 85% | 0.85 | 77% | 0.767 | S | S | * | * | cis | -152.3 | -175.5 | 5.3 | -156.2 | 163.5 | -154.5 | 0 | 0 | 112.7 | ||||
| 482 | A | 38.2 | Very low | 33.2 | Very low | 84 Ų | 84 | 149.6 Ų | 149.6 | 69% | 0.694 | 76% | 0.762 | S | S | * | * | trans | -144.7 | 178.6 | -166 | 0 | 0 | 0 | 0 | 0 | 115.7 | ||||
| 483 | P | 43.6 | Very low | 32.7 | Very low | 110 Ų | 110 | 150.2 Ų | 150.2 | 71% | 0.714 | 76% | 0.761 | S | S | * | * | trans | -122.8 | 171.2 | 143.9 | 27.5 | -10 | 0 | 0 | 0 | 111.3 | ||||
| 484 | R | 29 | Very low | 32.6 | Very low | 217 Ų | 217 | 143.7 Ų | 143.7 | 82% | 0.819 | 75% | 0.754 | S | S | * | * | cis | -167.4 | 178.3 | -20.8 | -99.5 | 168.1 | -168.7 | 168.4 | 3.8 | 104.8 | ||||
| 485 | W | 30.4 | Very low | 33 | Very low | 220 Ų | 220 | 148.2 Ų | 148.2 | 83% | 0.833 | 76% | 0.76 | S | S | * | * | cis | -158.1 | -162.4 | 12.8 | -139.3 | 159.8 | 0 | 0 | 0 | 109.9 | ||||
| 486 | Q | 28.1 | Very low | 33.1 | Very low | 156 Ų | 156 | 148.5 Ų | 148.5 | 73% | 0.729 | 75% | 0.753 | S | S | * | * | trans | 43.6 | 99.5 | 157.7 | -72.8 | -175.3 | -10.7 | 0 | 0 | 121.8 | ||||
| 487 | S | 31.7 | Very low | 33 | Very low | 101 Ų | 101 | 151.2 Ų | 151.2 | 71% | 0.706 | 76% | 0.756 | S | S | * | * | 34.2 | 139.8 | 115.8 | 52.3 | 0 | 0 | 0 | 0 | 121.8 | |||||
| 488 | E | 30.4 | Very low | 32.9 | Very low | 143 Ų | 143 | 154.6 Ų | 154.6 | 67% | 0.668 | 76% | 0.758 | S | S | * | * | cis | -166.1 | 138.1 | 4.3 | -114.8 | -163.1 | 150.4 | 0 | 0 | 115 | ||||
| 489 | R | 33.7 | Very low | 33.1 | Very low | 208 Ų | 208 | 150.6 Ų | 150.6 | 79% | 0.785 | 75% | 0.748 | S | S | * | * | trans | 62.6 | -176.6 | 149 | -46 | -166.2 | -159.5 | -136.9 | 1.9 | 120.2 | ||||
| 490 | P | 37.5 | Very low | 33.6 | Very low | 104 Ų | 104 | 156.3 Ų | 156.3 | 68% | 0.675 | 76% | 0.759 | S | S | * | * | -141.9 | 170 | -84.6 | 45.6 | -28.7 | 0 | 0 | 0 | 119.7 | |||||
| 491 | L | 30.1 | Very low | 34.3 | Very low | 152 Ų | 152 | 155.5 Ų | 155.5 | 80% | 0.796 | 77% | 0.765 | S | S | * | * | trans | 68.6 | 149.2 | 162.2 | -93.4 | 67.1 | 0 | 0 | 0 | 118.1 | ||||
| 492 | R | 29.1 | Very low | 34.7 | Very low | 226 Ų | 226 | 149.1 Ų | 149.1 | 85% | 0.853 | 75% | 0.748 | S | S | * | * | cis | -149.3 | 157 | 14.4 | -146.9 | 177 | -161.1 | -173.3 | 5.5 | 112.7 | ||||
| 493 | S | 29.8 | Very low | 35.2 | Very low | 107 Ų | 107 | 151.6 Ų | 151.6 | 75% | 0.748 | 75% | 0.749 | S | S | * | * | trans | -78.5 | 161.3 | 173 | 43.2 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 494 | S | 29.6 | Very low | 35.7 | Very low | 114 Ų | 114 | 152.4 Ų | 152.4 | 80% | 0.797 | 75% | 0.748 | S | S | * | * | cis | 96.3 | 153 | 26 | -155.5 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 495 | H | 39.3 | Very low | 36.9 | Very low | 179 Ų | 179 | 149.4 Ų | 149.4 | 83% | 0.829 | 74% | 0.743 | S | S | * | * | trans | -81.7 | 169.9 | -162 | -77.8 | -99.3 | 0 | 0 | 0 | 116.3 | ||||
| 496 | N | 36.1 | Very low | 38.1 | Very low | 132 Ų | 132 | 146 Ų | 146 | 71% | 0.706 | 74% | 0.737 | S | S | * | * | trans | -168.1 | 157.4 | 146.9 | -106 | 17.5 | 0 | 0 | 0 | 108.3 | ||||
| 497 | E | 32.8 | Very low | 39.3 | Very low | 145 Ų | 145 | 142.4 Ų | 142.4 | 68% | 0.678 | 72% | 0.721 | S | S | * | * | cis | -161.3 | 140.7 | -13.1 | -130.5 | 165.3 | -150.3 | 0 | 0 | 107.2 | ||||
| 498 | W | 37.1 | Very low | 40.5 | Very low | 218 Ų | 218 | 143.8 Ų | 143.8 | 83% | 0.826 | 72% | 0.717 | S | S | * | * | trans | -92.8 | 108 | 179 | -106.2 | 44.3 | 0 | 0 | 0 | 111.7 | I507 | W498-I507 HydrophobicContact CH2-CD1 4.26Å; W498-I507 HydrophobicContact CH2-CG1 4.3Å; W498-I507 HydrophobicContact CZ2-CD1 4.35Å; W498-I507 HydrophobicContact CZ2-CG1 4.06Å | ||
| 499 | T | 38.9 | Very low | 41.8 | Very low | 92 Ų | 92 | 142.6 Ų | 142.6 | 56% | 0.564 | 71% | 0.711 | S | S | * | * | trans | -116.7 | 146 | 171.6 | 51.9 | 0 | 0 | 0 | 0 | 111.3 | S501 G502 | T499-S501 PolarHBondContact O-N 2.87Å; T499-G502 PolarHBondContact O-N 2.87Å | ||
| 500 | W | 39.4 | Very low | 43 | Very low | 262 Ų | 262 | 134.7 Ų | 134.7 | 99% | 0.992 | 69% | 0.69 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74.7 | 36.5 | -175.6 | -87.8 | 62.8 | 0 | 0 | 0 | 114.3 | ||
| 501 | S | 46.1 | Very low | 44 | Very low | 114 Ų | 114 | 136.7 Ų | 136.7 | 80% | 0.797 | 69% | 0.688 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -147.9 | 18.5 | 175.1 | 57.8 | 0 | 0 | 0 | 0 | 113 | T499 | T499-S501 PolarHBondContact O-N 2.87Š|
| 502 | G | 38.9 | Very low | 45.6 | Very low | 48 Ų | 48 | 134 Ų | 134 | 50% | 0.495 | 68% | 0.675 | S | S | . | * | S | Bend | trans | -94.3 | 168.7 | 175.5 | 0 | 0 | 0 | 0 | 0 | 114.1 | T499 | T499-G502 PolarHBondContact O-N 2.87Š|
| 503 | D | 47.1 | Very low | 47 | Very low | 136 Ų | 136 | 129.7 Ų | 129.7 | 73% | 0.727 | 66% | 0.664 | S | S | * | * | trans | -69 | 129.8 | -165.8 | -73.6 | -63.8 | 0 | 0 | 0 | 115.9 | Q505 | D503-Q505 PolarHBondContact O-N 3.22Å; D503-Q505 VanDerWaalsContact O-N 3.11Å | ||
| 504 | N | 54.6 | Low | 48 | Very low | 127 Ų | 127 | 133.9 Ų | 133.9 | 68% | 0.679 | 66% | 0.663 | S | S | * | * | H | α-helix | trans | -60.5 | -21.9 | 178.1 | -69.4 | -71.5 | 0 | 0 | 0 | 114.2 | I507 Q508 | N504-I507 PolarHBondContact O-N 3.43Å; N504-Q508 PolarHBondContact O-N 3.26Å; N504-Q508 VanDerWaalsContact O-N 3.09Å |
| 505 | Q | 55.4 | Low | 48.8 | Very low | 154 Ų | 154 | 135.5 Ų | 135.5 | 72% | 0.72 | 65% | 0.653 | S | S | * | * | H | α-helix | trans | -64.9 | -46.6 | -174 | -70.3 | -175 | -16.1 | 0 | 0 | 112.4 | D503 I507 Q508 E509 | D503-Q505 PolarHBondContact O-N 3.22Å; D503-Q505 VanDerWaalsContact O-N 3.11Å; Q505-I507 VanDerWaalsContact C-N 3.31Å; Q505-I507 PolarHBondContact O-N 3.38Å; Q505-Q508 PolarHBondContact O-N 3.38Å; Q505-Q508 VanDerWaalsContact O-N 3.17Å; Q505-E509 WeakPolarHBondContact O-CG 3.36Å; Q505-E509 PolarHBondContact O-N 3.19Å |
| 506 | Q | 53.8 | Low | 49.3 | Very low | 149 Ų | 149 | 134.3 Ų | 134.3 | 70% | 0.696 | 65% | 0.646 | S | S | * | * | H | α-helix | trans | -62.9 | -36.8 | 177.9 | -79.3 | -171.6 | -18.8 | 0 | 0 | 112.7 | Q508 E509 A510 | Q506-Q508 VanDerWaalsContact C-N 3.32Å; Q506-Q508 PolarHBondContact O-N 3.28Å; Q506-E509 PolarHBondContact O-N 3.14Å; Q506-A510 WeakPolarHBondContact O-CB 3.28Å; Q506-A510 PolarHBondContact O-N 2.95Å |
| 507 | I | 53.6 | Low | 49.7 | Very low | 79 Ų | 79 | 129.9 Ų | 129.9 | 41% | 0.405 | 63% | 0.632 | S | S | . | * | H | α-helix | trans | -64.6 | -41.2 | 177 | -59 | 177.5 | 0 | 0 | 0 | 110.1 | W498 N504 Q505 A510 F511 | W498-I507 HydrophobicContact CH2-CD1 4.26Å; W498-I507 HydrophobicContact CH2-CG1 4.3Å; W498-I507 HydrophobicContact CZ2-CD1 4.35Å; W498-I507 HydrophobicContact CZ2-CG1 4.06Å; N504-I507 PolarHBondContact O-N 3.43Å; Q505-I507 VanDerWaalsContact C-N 3.31Å; Q505-I507 PolarHBondContact O-N 3.38Å; I507-A510 PolarHBondContact O-N 3.4Å; I507-F511 PolarHBondContact O-N 3.43Å |
| 508 | Q | 56.8 | Low | 50.4 | Low | 131 Ų | 131 | 129.5 Ų | 129.5 | 61% | 0.612 | 63% | 0.63 | S | S | * | * | H | α-helix | trans | -73.9 | -33.5 | -180 | -161.9 | 148.8 | 6.9 | 0 | 0 | 112.6 | N504 Q505 Q506 F511 N512 | N504-Q508 PolarHBondContact O-N 3.26Å; N504-Q508 VanDerWaalsContact O-N 3.09Å; Q505-Q508 PolarHBondContact O-N 3.38Å; Q505-Q508 VanDerWaalsContact O-N 3.17Å; Q506-Q508 VanDerWaalsContact C-N 3.32Å; Q506-Q508 PolarHBondContact O-N 3.28Å; Q508-F511 PolarHBondContact O-N 3.32Å; Q508-N512 WeakPolarHBondContact O-CB 3.49Å; Q508-N512 VanDerWaalsContact O-CG 3.3Å; Q508-N512 PolarHBondContact O-N 3.02Å; Q508-N512 PolarHBondContact O-ND2 3.46Å |
| 509 | E | 57.9 | Low | 50.8 | Low | 118 Ų | 118 | 125.6 Ų | 125.6 | 55% | 0.551 | 62% | 0.621 | S | S | * | * | H | α-helix | trans | -65 | -45.2 | 168.7 | -72.1 | -170.1 | 151 | 0 | 0 | 112.2 | Q505 Q506 F511 N512 Q513 | Q505-E509 WeakPolarHBondContact O-CG 3.36Å; Q505-E509 PolarHBondContact O-N 3.19Å; Q506-E509 PolarHBondContact O-N 3.14Å; E509-F511 VanDerWaalsContact C-N 3.27Å; E509-F511 PolarHBondContact O-N 3.21Å; E509-N512 PolarHBondContact O-N 3.01Å; E509-Q513 WeakPolarHBondContact O-CG 3.31Å; E509-Q513 PolarHBondContact O-N 3.14Å |
| 510 | A | 59.2 | Low | 51 | Low | 41 Ų | 41 | 131.1 Ų | 131.1 | 34% | 0.339 | 63% | 0.631 | S | S | . | * | H | α-helix | trans | -60.4 | -36.4 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | Q506 I507 Q513 R514 | Q506-A510 WeakPolarHBondContact O-CB 3.28Å; Q506-A510 PolarHBondContact O-N 2.95Å; I507-A510 PolarHBondContact O-N 3.4Å; A510-Q513 PolarHBondContact O-N 2.94Å; A510-R514 WeakPolarHBondContact O-CG 3.28Å; A510-R514 PolarHBondContact O-N 3.32Å; A510-R514 VanDerWaalsContact O-N 3.12Å |
| 511 | F | 57.5 | Low | 51.2 | Low | 147 Ų | 147 | 121.8 Ų | 121.8 | 65% | 0.645 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -67.8 | -44.4 | 174.5 | -146.6 | -83.3 | 0 | 0 | 0 | 111.9 | I507 Q508 E509 Q513 R514 Y515 | I507-F511 PolarHBondContact O-N 3.43Å; Q508-F511 PolarHBondContact O-N 3.32Å; E509-F511 VanDerWaalsContact C-N 3.27Å; E509-F511 PolarHBondContact O-N 3.21Å; F511-Q513 VanDerWaalsContact C-N 3.3Å; F511-Q513 PolarHBondContact O-N 3.46Å; F511-R514 PolarHBondContact O-N 3.05Å; F511-Y515 PolarHBondContact O-N 3.45Å |
| 512 | N | 63.8 | Low | 51 | Low | 95 Ų | 95 | 123.3 Ų | 123.3 | 51% | 0.508 | 61% | 0.609 | S | S | . | * | H | α-helix | trans | -62.7 | -34.6 | 174.9 | -75.3 | -31 | 0 | 0 | 0 | 112.7 | Q508 E509 K516 | Q508-N512 WeakPolarHBondContact O-CB 3.49Å; Q508-N512 VanDerWaalsContact O-CG 3.3Å; Q508-N512 PolarHBondContact O-N 3.02Å; Q508-N512 PolarHBondContact O-ND2 3.46Å; E509-N512 PolarHBondContact O-N 3.01Å; N512-K516 WeakPolarHBondContact O-CG 3.5Å; N512-K516 PolarHBondContact O-N 3.3Å |
| 513 | Q | 59.2 | Low | 51 | Low | 135 Ų | 135 | 124.1 Ų | 124.1 | 63% | 0.631 | 62% | 0.617 | S | S | * | * | H | α-helix | trans | -67.8 | -43.6 | 175.1 | -72.8 | 176.6 | 22.8 | 0 | 0 | 111.8 | E509 A510 F511 Y515 K516 G517 | E509-Q513 WeakPolarHBondContact O-CG 3.31Å; E509-Q513 PolarHBondContact O-N 3.14Å; A510-Q513 PolarHBondContact O-N 2.94Å; F511-Q513 VanDerWaalsContact C-N 3.3Å; F511-Q513 PolarHBondContact O-N 3.46Å; Q513-Y515 VanDerWaalsContact C-N 3.34Å; Q513-Y515 PolarHBondContact O-N 3.06Å; Q513-K516 PolarHBondContact O-N 3.12Å; Q513-G517 PolarHBondContact O-N 2.85Å |
| 514 | R | 50.3 | Low | 50.5 | Low | 195 Ų | 195 | 121.5 Ų | 121.5 | 74% | 0.736 | 61% | 0.614 | S | S | * | * | H | α-helix | trans | -59.7 | -43.9 | 173.5 | -69.1 | -179.5 | -163.5 | -137.1 | 3.9 | 111.8 | A510 F511 K516 G517 Q518 | A510-R514 WeakPolarHBondContact O-CG 3.28Å; A510-R514 PolarHBondContact O-N 3.32Å; A510-R514 VanDerWaalsContact O-N 3.12Å; F511-R514 PolarHBondContact O-N 3.05Å; R514-K516 PolarHBondContact O-N 3.41Å; R514-G517 PolarHBondContact O-N 3.48Å; R514-G517 VanDerWaalsContact O-N 3.14Å; R514-Q518 PolarHBondContact O-N 3.18Å |
| 515 | Y | 47.7 | Very low | 49.6 | Very low | 148 Ų | 148 | 119.4 Ų | 119.4 | 58% | 0.58 | 62% | 0.615 | S | S | * | * | H | α-helix | trans | -63.5 | -39.7 | 178.7 | -154.4 | -95.1 | 0 | 0 | 0 | 112.6 | F511 Q513 Q518 Q519 | F511-Y515 PolarHBondContact O-N 3.45Å; Q513-Y515 VanDerWaalsContact C-N 3.34Å; Q513-Y515 PolarHBondContact O-N 3.06Å; Y515-Q518 PolarHBondContact O-N 3.02Å; Y515-Q519 PolarHBondContact O-N 3.02Å |
| 516 | K | 48.3 | Very low | 48.6 | Very low | 154 Ų | 154 | 120 Ų | 120 | 67% | 0.67 | 62% | 0.623 | S | S | * | * | H | α-helix | trans | -66.9 | -33.4 | 172.1 | -77.4 | -179.3 | 175.8 | 179.4 | 0 | 113.3 | N512 Q513 R514 | N512-K516 WeakPolarHBondContact O-CG 3.5Å; N512-K516 PolarHBondContact O-N 3.3Å; Q513-K516 PolarHBondContact O-N 3.12Å; R514-K516 PolarHBondContact O-N 3.41Å |
| 517 | G | 46 | Very low | 47.4 | Very low | 40 Ų | 40 | 117.7 Ų | 117.7 | 41% | 0.412 | 62% | 0.623 | S | S | . | * | H | α-helix | trans | -64.4 | -45.5 | 173.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | Q513 R514 Q519 R520 A521 | Q513-G517 PolarHBondContact O-N 2.85Å; R514-G517 PolarHBondContact O-N 3.48Å; R514-G517 VanDerWaalsContact O-N 3.14Å; G517-Q519 VanDerWaalsContact C-N 3.33Å; G517-Q519 PolarHBondContact O-N 3.47Å; G517-R520 PolarHBondContact O-N 3.34Å; G517-A521 PolarHBondContact O-N 3.44Å |
| 518 | Q | 47.1 | Very low | 46.3 | Very low | 137 Ų | 137 | 120.4 Ų | 120.4 | 64% | 0.64 | 64% | 0.644 | S | S | * | * | H | α-helix | trans | -67 | -31 | -175.9 | -155.8 | 165.9 | 14.7 | 0 | 0 | 113.2 | R514 Y515 | R514-Q518 PolarHBondContact O-N 3.18Å; Y515-Q518 PolarHBondContact O-N 3.02Å |
| 519 | Q | 44.4 | Very low | 44.9 | Very low | 136 Ų | 136 | 123.4 Ų | 123.4 | 64% | 0.636 | 66% | 0.66 | S | S | * | * | H | α-helix | trans | -70.7 | -26.7 | 171 | -72.4 | -171.2 | -21.5 | 0 | 0 | 113.8 | Y515 G517 | Y515-Q519 PolarHBondContact O-N 3.02Å; G517-Q519 VanDerWaalsContact C-N 3.33Å; G517-Q519 PolarHBondContact O-N 3.47Å |
| 520 | R | 43.9 | Very low | 43.6 | Very low | 208 Ų | 208 | 122.8 Ų | 122.8 | 79% | 0.785 | 66% | 0.664 | S | S | * | * | H | α-helix | trans | -76.3 | -33 | 175.9 | -76.3 | -178.7 | 167.1 | -177.3 | -5.7 | 112.7 | G517 G523 | G517-R520 PolarHBondContact O-N 3.34Å; R520-G523 PolarHBondContact O-N 3.2Å |
| 521 | A | 44 | Very low | 42 | Very low | 66 Ų | 66 | 128.9 Ų | 128.9 | 55% | 0.545 | 69% | 0.685 | S | S | . | * | H | α-helix | trans | -61.8 | -46 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | G517 G523 A524 | G517-A521 PolarHBondContact O-N 3.44Å; A521-G523 PolarHBondContact O-N 3.09Å; A521-A524 PolarHBondContact O-N 3.5Å |
| 522 | N | 42.3 | Very low | 40.5 | Very low | 146 Ų | 146 | 129.4 Ų | 129.4 | 78% | 0.781 | 69% | 0.694 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76.2 | -4.1 | -178.2 | -71.2 | 12.4 | 0 | 0 | 0 | 114.4 | ||
| 523 | G | 39.1 | Very low | 38.8 | Very low | 64 Ų | 64 | 132.9 Ų | 132.9 | 66% | 0.66 | 71% | 0.707 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92.8 | -9.2 | 174.6 | 0 | 0 | 0 | 0 | 0 | 114.5 | R520 A521 | R520-G523 PolarHBondContact O-N 3.2Å; A521-G523 PolarHBondContact O-N 3.09Å |
| 524 | A | 35 | Very low | 38.2 | Very low | 81 Ų | 81 | 130.6 Ų | 130.6 | 67% | 0.669 | 70% | 0.704 | S | S | * | * | S | Bend | trans | -105.6 | 24 | -166.5 | 0 | 0 | 0 | 0 | 0 | 114.3 | A521 | A521-A524 PolarHBondContact O-N 3.5Š|
| 525 | A | 36.7 | Very low | 37.1 | Very low | 83 Ų | 83 | 129 Ų | 129 | 69% | 0.686 | 71% | 0.71 | S | S | * | * | S | Bend | trans | -115 | 22.5 | -172.7 | 0 | 0 | 0 | 0 | 0 | 114.2 | ||
| 526 | N | 33.9 | Very low | 36.2 | Very low | 167 Ų | 167 | 125.8 Ų | 125.8 | 89% | 0.893 | 71% | 0.714 | S | S | * | * | S | Bend | trans | -158.4 | 47.6 | -176.5 | -109 | -24.9 | 0 | 0 | 0 | 114.2 | ||
| 527 | S | 29.2 | Very low | 35.1 | Very low | 101 Ų | 101 | 126.3 Ų | 126.3 | 71% | 0.706 | 72% | 0.724 | S | S | * | * | trans | -161.9 | 63.7 | 176.1 | 65.7 | 0 | 0 | 0 | 0 | 116.5 | ||||
| 528 | T | 29.1 | Very low | 34.2 | Very low | 136 Ų | 136 | 133.1 Ų | 133.1 | 83% | 0.834 | 75% | 0.745 | S | S | * | * | trans | -150.1 | 90.5 | 161.5 | -9.7 | 0 | 0 | 0 | 0 | 113.8 | V530 | T528-V530 HydrophobicContact CG2-CG2 4.39Š| ||
| 529 | M | 28.4 | Very low | 33.3 | Very low | 193 Ų | 193 | 134.6 Ų | 134.6 | 95% | 0.951 | 75% | 0.751 | S | S | * | * | trans | -144.7 | 146.7 | 148.4 | -148 | 178.3 | -69.9 | 0 | 0 | 107 | ||||
| 530 | V | 29.6 | Very low | 32.3 | Very low | 105 Ų | 105 | 135.6 Ų | 135.6 | 64% | 0.636 | 76% | 0.756 | S | S | * | * | trans | -137.2 | 137.2 | -146.4 | 171.4 | 0 | 0 | 0 | 0 | 112.5 | T528 | T528-V530 HydrophobicContact CG2-CG2 4.39Š| ||
| 531 | H | 26 | Very low | 31.6 | Very low | 169 Ų | 169 | 132.5 Ų | 132.5 | 78% | 0.782 | 75% | 0.754 | S | S | * | * | trans | 66.9 | 141.3 | 171.3 | -99 | -87.7 | 0 | 0 | 0 | 115 | ||||
| 532 | L | 26.5 | Very low | 30.8 | Very low | 158 Ų | 158 | 137.7 Ų | 137.7 | 83% | 0.827 | 77% | 0.765 | S | S | * | * | cis | -147.7 | 173 | 29 | -99 | 151.5 | 0 | 0 | 0 | 112.9 | ||||
| 533 | E | 28 | Very low | 30.3 | Very low | 168 Ų | 168 | 140.3 Ų | 140.3 | 79% | 0.785 | 77% | 0.769 | S | S | * | * | trans | -154.8 | 159.3 | 169.3 | -140.1 | -111.1 | 142.9 | 0 | 0 | 106.3 | ||||
| 534 | P | 47.7 | Very low | 29.7 | Very low | 87 Ų | 87 | 147 Ų | 147 | 57% | 0.565 | 78% | 0.783 | S | S | * | * | cis | -116.5 | -176.8 | 4.4 | 43.3 | -31.4 | 0 | 0 | 0 | 113.4 | ||||
| 535 | D | 27 | Very low | 29.3 | Very low | 161 Ų | 161 | 148.4 Ų | 148.4 | 86% | 0.861 | 79% | 0.788 | S | S | * | * | -176.1 | 168.7 | 111.2 | -109.4 | -28.5 | 0 | 0 | 0 | 113 | |||||
| 536 | A | 27.5 | Very low | 29.7 | Very low | 81 Ų | 81 | 150.3 Ų | 150.3 | 67% | 0.669 | 79% | 0.793 | S | S | * | * | trans | -125.9 | 170.7 | -168.1 | 0 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 537 | L | 26 | Very low | 29.5 | Very low | 166 Ų | 166 | 146 Ų | 146 | 87% | 0.869 | 79% | 0.789 | S | S | * | * | trans | 58.2 | 115 | 178.5 | -76.2 | 89.7 | 0 | 0 | 0 | 116.8 | ||||
| 538 | E | 26.7 | Very low | 29.6 | Very low | 183 Ų | 183 | 146.4 Ų | 146.4 | 86% | 0.855 | 80% | 0.798 | S | S | * | * | -147.3 | 111.7 | 107.1 | -136 | 175.7 | -158.3 | 0 | 0 | 111.2 | |||||
| 539 | E | 28.5 | Very low | 29.6 | Very low | 167 Ų | 167 | 143 Ų | 143 | 78% | 0.78 | 79% | 0.791 | S | S | * | * | trans | -92.6 | 144.3 | 159.7 | -168.6 | -175.9 | -170.1 | 0 | 0 | 107.3 | ||||
| 540 | Q | 24.1 | Very low | 29.8 | Very low | 158 Ų | 158 | 145.8 Ų | 145.8 | 74% | 0.738 | 79% | 0.79 | S | S | * | * | trans | 75 | 103.3 | 178 | -42.2 | 179.6 | 15.9 | 0 | 0 | 117 | ||||
| 541 | L | 28.3 | Very low | 29.9 | Very low | 143 Ų | 143 | 146.8 Ų | 146.8 | 75% | 0.749 | 80% | 0.797 | S | S | * | * | -160.1 | 113.2 | 118.7 | -107.1 | 166.4 | 0 | 0 | 0 | 114.8 | |||||
| 542 | K | 28 | Very low | 30.1 | Very low | 175 Ų | 175 | 147.1 Ų | 147.1 | 76% | 0.761 | 80% | 0.796 | S | S | * | * | trans | 32.8 | 113 | 151 | -69.8 | 169.2 | -168.9 | 164.1 | 0 | 121.6 | ||||
| 543 | K | 30.7 | Very low | 30.2 | Very low | 201 Ų | 201 | 147.4 Ų | 147.4 | 87% | 0.874 | 79% | 0.79 | S | S | * | * | 47.5 | 118.7 | 119.5 | -63.5 | -178.3 | 175.6 | -176.9 | 0 | 119.9 | |||||
| 544 | Q | 27.3 | Very low | 30.2 | Very low | 203 Ų | 203 | 148.4 Ų | 148.4 | 95% | 0.949 | 79% | 0.792 | S | S | * | * | -150.7 | 171.2 | 120.6 | -111.6 | 174.3 | 25.4 | 0 | 0 | 111.7 | |||||
| 545 | S | 26 | Very low | 29.3 | Very low | 112 Ų | 112 | 148.9 Ų | 148.9 | 78% | 0.783 | 80% | 0.798 | S | S | * | * | trans | -165.7 | 174.5 | -170.1 | -133.5 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 546 | P | 45.8 | Very low | 29.5 | Very low | 122 Ų | 122 | 149.4 Ų | 149.4 | 79% | 0.792 | 80% | 0.797 | S | S | * | * | cis | -144.1 | 178.8 | 12.2 | 42.9 | -23.9 | 0 | 0 | 0 | 118.1 | ||||
| 547 | G | 29.7 | Very low | 30.6 | Very low | 78 Ų | 78 | 150.2 Ų | 150.2 | 80% | 0.804 | 80% | 0.796 | S | S | * | * | trans | 90.6 | 156.8 | 150.5 | 0 | 0 | 0 | 0 | 0 | 117.4 | ||||
| 548 | A | 30.3 | Very low | 30.9 | Very low | 109 Ų | 109 | 150 Ų | 150 | 90% | 0.901 | 80% | 0.796 | S | S | * | * | cis | -164 | 156.4 | -19.3 | 0 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 549 | G | 30.1 | Very low | 31.2 | Very low | 65 Ų | 65 | 144.8 Ų | 144.8 | 67% | 0.67 | 79% | 0.791 | S | S | * | * | cis | 171 | 173.7 | -4.1 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 550 | R | 31.7 | Very low | 31.5 | Very low | 250 Ų | 250 | 144.2 Ų | 144.2 | 94% | 0.943 | 79% | 0.792 | S | S | * | * | trans | 68.2 | 148.1 | -179.9 | -57.4 | -177.9 | 176.3 | 175.5 | -0.3 | 115.1 | ||||
| 551 | V | 31.6 | Very low | 32.1 | Very low | 127 Ų | 127 | 147.8 Ų | 147.8 | 77% | 0.77 | 80% | 0.799 | S | S | * | * | cis | -151.2 | 161 | -11.9 | 119.7 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 552 | K | 29.9 | Very low | 32.3 | Very low | 175 Ų | 175 | 151.4 Ų | 151.4 | 76% | 0.761 | 80% | 0.803 | S | S | * | * | trans | -37.1 | 161.5 | 165.3 | -58.3 | 167 | -173.9 | 171.9 | 0 | 114.7 | ||||
| 553 | K | 29.1 | Very low | 32.7 | Very low | 165 Ų | 165 | 149.6 Ų | 149.6 | 72% | 0.717 | 80% | 0.8 | S | S | * | * | cis | -178.7 | 165.2 | -8.7 | -106.8 | -177.6 | 176.7 | -169.9 | 0 | 107.5 | ||||
| 554 | F | 28.1 | Very low | 32.9 | Very low | 188 Ų | 188 | 149.1 Ų | 149.1 | 83% | 0.825 | 80% | 0.799 | S | S | * | * | trans | 64.1 | 173.9 | 154.3 | -83.1 | -140.9 | 0 | 0 | 0 | 115.6 | ||||
| 555 | S | 28.1 | Very low | 33.7 | Very low | 97 Ų | 97 | 144.5 Ų | 144.5 | 68% | 0.678 | 79% | 0.786 | S | S | * | * | cis | -170.6 | 154.5 | -37.3 | 177.8 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 556 | M | 31.9 | Very low | 34.1 | Very low | 172 Ų | 172 | 148.8 Ų | 148.8 | 85% | 0.847 | 79% | 0.791 | S | S | * | * | trans | -39.2 | 167 | 159 | -84.5 | 175.1 | 146.3 | 0 | 0 | 116.6 | ||||
| 557 | P | 50.9 | Low | 33.2 | Very low | 99 Ų | 99 | 152.4 Ų | 152.4 | 64% | 0.643 | 80% | 0.798 | S | S | * | * | cis | -144.5 | -163.9 | -19.5 | 38.6 | -17.4 | 0 | 0 | 0 | 115.1 | ||||
| 558 | D | 31.4 | Very low | 33.3 | Very low | 162 Ų | 162 | 157.9 Ų | 157.9 | 87% | 0.866 | 80% | 0.799 | S | S | * | * | trans | 66.8 | 132.9 | 147.7 | -71.6 | -7.9 | 0 | 0 | 0 | 123.4 | ||||
| 559 | G | 34.8 | Very low | 33.2 | Very low | 73 Ų | 73 | 162.8 Ų | 162.8 | 75% | 0.753 | 80% | 0.8 | S | S | * | * | 130.7 | 9.3 | 113.9 | 0 | 0 | 0 | 0 | 0 | 123 | |||||
| 560 | L | 32.9 | Very low | 33.2 | Very low | 155 Ų | 155 | 170.7 Ų | 170.7 | 81% | 0.812 | 81% | 0.81 | S | S | * | * | trans | -156.5 | 128 | 176.6 | -96.6 | 161.4 | 0 | 0 | 0 | 109.1 | ||||
| 561 | R | 36.6 | Very low | 33.2 | Very low | 233 Ų | 233 | 164.7 Ų | 164.7 | 88% | 0.879 | 80% | 0.803 | S | S | * | * | cis | -142.1 | 144.6 | 30.4 | -58.7 | 132.2 | 179.7 | -174.6 | -0.7 | 107.8 | ||||
| 562 | R | 34.5 | Very low | 33 | Very low | 219 Ų | 219 | 164 Ų | 164 | 83% | 0.826 | 80% | 0.804 | S | S | * | * | cis | 73.6 | 125.5 | 36.4 | -136 | -176.7 | -157.3 | -169.9 | 8.3 | 114 | ||||
| 563 | L | 36.2 | Very low | 33.1 | Very low | 136 Ų | 136 | 164.2 Ų | 164.2 | 71% | 0.712 | 81% | 0.808 | S | S | * | * | trans | 92.7 | 85.5 | 162.6 | -52.3 | 171.5 | 0 | 0 | 0 | 120.6 | ||||
| 564 | F | 33.8 | Very low | 33.1 | Very low | 191 Ų | 191 | 164.4 Ų | 164.4 | 84% | 0.838 | 82% | 0.816 | S | S | * | * | trans | 62.8 | -175 | 142.6 | -55.7 | -68.2 | 0 | 0 | 0 | 118.2 | ||||
| 565 | P | 45 | Very low | 33.2 | Very low | 106 Ų | 106 | 162.4 Ų | 162.4 | 69% | 0.688 | 81% | 0.813 | S | S | * | * | -128.5 | 178.6 | -77 | 40.6 | -27 | 0 | 0 | 0 | 114.7 | |||||
| 566 | F | 32.9 | Very low | 33.5 | Very low | 203 Ų | 203 | 163.7 Ų | 163.7 | 89% | 0.89 | 81% | 0.809 | S | S | * | * | trans | 19.7 | 117 | 161.2 | -74 | -75.1 | 0 | 0 | 0 | 119.8 | ||||
| 567 | Q | 28.5 | Very low | 33.5 | Very low | 198 Ų | 198 | 165.4 Ų | 165.4 | 93% | 0.925 | 81% | 0.806 | S | S | * | * | -156.2 | 152.7 | 126 | -117.6 | 176.7 | 27.3 | 0 | 0 | 114 | |||||
| 568 | K | 31.8 | Very low | 32.6 | Very low | 192 Ų | 192 | 170.2 Ų | 170.2 | 84% | 0.835 | 82% | 0.817 | S | S | * | * | trans | -94.3 | 138.3 | 164.9 | -63.5 | 172.4 | 178.6 | 173.9 | 0 | 108.4 | ||||
| 569 | K | 28 | Very low | 32.5 | Very low | 212 Ų | 212 | 169.8 Ų | 169.8 | 92% | 0.922 | 81% | 0.814 | S | S | * | * | -170.7 | 179 | 121.3 | -105.7 | 171.4 | -178.6 | -176.7 | 0 | 111.9 | |||||
| 570 | R | 29.1 | Very low | 32.3 | Very low | 231 Ų | 231 | 170.7 Ų | 170.7 | 87% | 0.872 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -81.9 | 159.4 | -167 | -68.8 | 175.6 | 176.6 | 166.5 | -3.3 | 112.2 | ||
| 571 | P | 31.6 | Very low | 32 | Very low | 125 Ų | 125 | 169.1 Ų | 169.1 | 81% | 0.812 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -67.9 | 145.5 | 168.1 | 30.7 | -35.9 | 0 | 0 | 0 | 111.3 | ||
| 572 | S | 28.4 | Very low | 31.6 | Very low | 111 Ų | 111 | 164 Ų | 164 | 78% | 0.776 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -85.9 | 154.9 | 148.4 | 49.4 | 0 | 0 | 0 | 0 | 109.1 | ||
| 573 | Q | 32.3 | Very low | 31.5 | Very low | 181 Ų | 181 | 158 Ų | 158 | 85% | 0.846 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -73.9 | 155 | 166.2 | -65.1 | 156.1 | -78.9 | 0 | 0 | 109.3 | ||
| 574 | D | 27.9 | Very low | 31.2 | Very low | 168 Ų | 168 | 157.7 Ų | 157.7 | 90% | 0.898 | 79% | 0.794 | S | S | * | * | trans | -144.9 | 159.1 | 137.6 | -104.9 | -42.4 | 0 | 0 | 0 | 109.3 | ||||
| 575 | L | 31.5 | Very low | 31.8 | Very low | 146 Ų | 146 | 153.9 Ų | 153.9 | 76% | 0.764 | 79% | 0.789 | S | S | * | * | trans | -125.1 | -179.2 | -163.9 | -154.6 | 76.1 | 0 | 0 | 0 | 111.1 | ||||
| 576 | E | 33.3 | Very low | 31.2 | Very low | 125 Ų | 125 | 157.7 Ų | 157.7 | 58% | 0.584 | 80% | 0.797 | S | S | * | * | trans | 76.2 | 114.7 | 166.9 | -54.6 | -91.4 | 99.7 | 0 | 0 | 114.8 | ||||
| 577 | R | 33.3 | Very low | 31.1 | Very low | 208 Ų | 208 | 151 Ų | 151 | 79% | 0.785 | 79% | 0.786 | S | S | * | * | 83.8 | 134.2 | 55.2 | -77.6 | -169 | -169.4 | 150.2 | -14.7 | 114.2 | |||||
| 578 | K | 31.3 | Very low | 31.1 | Very low | 199 Ų | 199 | 147.8 Ų | 147.8 | 87% | 0.865 | 78% | 0.78 | S | S | * | * | trans | 166.8 | 148.7 | 154.4 | -100.6 | 166.2 | -174.4 | 178 | 0 | 108.5 | ||||
| 579 | L | 29.2 | Very low | 31.1 | Very low | 154 Ų | 154 | 145.9 Ų | 145.9 | 81% | 0.806 | 78% | 0.777 | S | S | * | * | cis | -146.4 | 170.9 | -2 | -86.8 | 174.5 | 0 | 0 | 0 | 106.3 | ||||
| 580 | S | 29.8 | Very low | 31.1 | Very low | 92 Ų | 92 | 140.5 Ų | 140.5 | 64% | 0.643 | 77% | 0.766 | S | S | * | * | cis | -167.9 | -134.8 | -19.5 | 57.8 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 581 | V | 26.6 | Very low | 31.1 | Very low | 121 Ų | 121 | 137.4 Ų | 137.4 | 73% | 0.733 | 76% | 0.761 | S | S | * | * | trans | 69.9 | 108.8 | 172.5 | -166 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 582 | V | 29 | Very low | 30.9 | Very low | 125 Ų | 125 | 139.6 Ų | 139.6 | 76% | 0.758 | 76% | 0.761 | S | S | * | * | cis | 94 | 127.2 | 33.3 | 174.6 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 583 | S | 32.5 | Very low | 30.9 | Very low | 95 Ų | 95 | 138.7 Ų | 138.7 | 66% | 0.664 | 76% | 0.76 | S | S | * | * | cis | -176.2 | 152.2 | -10.9 | 54.5 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 584 | V | 29.3 | Very low | 30.5 | Very low | 128 Ų | 128 | 141.8 Ų | 141.8 | 78% | 0.776 | 76% | 0.764 | S | S | * | * | trans | 69.3 | 149.4 | 145.5 | 164.3 | 0 | 0 | 0 | 0 | 118.7 | ||||
| 585 | P | 47 | Very low | 30.6 | Very low | 111 Ų | 111 | 138.7 Ų | 138.7 | 72% | 0.721 | 76% | 0.756 | S | S | * | * | cis | -115.3 | -173.4 | 11 | 24.6 | -0 | 0 | 0 | 0 | 114.7 | ||||
| 586 | E | 32.6 | Very low | 31.7 | Very low | 186 Ų | 186 | 136.8 Ų | 136.8 | 87% | 0.869 | 75% | 0.752 | S | S | * | * | cis | 88.1 | 141.9 | 15.3 | -162.7 | 164.8 | -135.6 | 0 | 0 | 116.6 | ||||
| 587 | G | 30.7 | Very low | 31.5 | Very low | 63 Ų | 63 | 137.8 Ų | 137.8 | 65% | 0.649 | 76% | 0.76 | S | S | * | * | cis | -130.6 | -124.9 | -0.1 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 588 | V | 28.5 | Very low | 31.3 | Very low | 131 Ų | 131 | 133.6 Ų | 133.6 | 79% | 0.794 | 75% | 0.753 | S | S | * | * | cis | -159 | 120.6 | 1.1 | 179.1 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 589 | I | 30.6 | Very low | 31.3 | Very low | 152 Ų | 152 | 133.3 Ų | 133.3 | 78% | 0.779 | 75% | 0.748 | S | S | * | * | trans | 45.1 | 110.4 | 141.5 | -51.7 | 177.9 | 0 | 0 | 0 | 125.6 | ||||
| 590 | S | 29.6 | Very low | 31.3 | Very low | 98 Ų | 98 | 135.5 Ų | 135.5 | 69% | 0.685 | 75% | 0.747 | S | S | * | * | trans | 46.2 | 137 | 132.8 | 92 | 0 | 0 | 0 | 0 | 128.1 | ||||
| 591 | Q | 27.9 | Very low | 31.2 | Very low | 167 Ų | 167 | 135.2 Ų | 135.2 | 78% | 0.78 | 75% | 0.745 | S | S | * | * | 177 | 160.5 | 127.4 | -96.5 | 175.1 | 71.1 | 0 | 0 | 109.1 | |||||
| 592 | Q | 27.7 | Very low | 31.3 | Very low | 171 Ų | 171 | 136.1 Ų | 136.1 | 80% | 0.799 | 75% | 0.746 | S | S | * | * | cis | -150.7 | 175.3 | 8.1 | -128.1 | 172.7 | 51.6 | 0 | 0 | 109.7 | ||||
| 593 | A | 27.5 | Very low | 31.3 | Very low | 92 Ų | 92 | 136.3 Ų | 136.3 | 76% | 0.76 | 75% | 0.748 | S | S | * | * | trans | -155.8 | 153 | -177.5 | 0 | 0 | 0 | 0 | 0 | 115.7 | ||||
| 594 | R | 25.7 | Very low | 31.2 | Very low | 246 Ų | 246 | 138 Ų | 138 | 93% | 0.928 | 75% | 0.754 | S | S | * | * | trans | 163.9 | 158.8 | 160.4 | -94.6 | 154.9 | -172.5 | -158.1 | 1.8 | 110.9 | ||||
| 595 | S | 29.5 | Very low | 31.1 | Very low | 103 Ų | 103 | 138.6 Ų | 138.6 | 72% | 0.72 | 76% | 0.758 | S | S | * | * | cis | -170 | -165.2 | -20.4 | 57.5 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 596 | P | 53.2 | Low | 30.3 | Very low | 105 Ų | 105 | 138.3 Ų | 138.3 | 68% | 0.682 | 77% | 0.765 | S | S | * | * | -139.1 | -167.1 | -109.3 | 40.1 | -16.5 | 0 | 0 | 0 | 118.6 | |||||
| 597 | L | 31 | Very low | 30.1 | Very low | 147 Ų | 147 | 133.8 Ų | 133.8 | 77% | 0.77 | 76% | 0.76 | S | S | * | * | trans | 72.3 | 155.1 | 171.4 | -86.6 | 62.8 | 0 | 0 | 0 | 116.4 | ||||
| 598 | D | 27.9 | Very low | 30 | Very low | 119 Ų | 119 | 135.8 Ų | 135.8 | 64% | 0.636 | 76% | 0.764 | S | S | * | * | cis | -150.9 | 140.7 | 5.4 | -108.9 | -27.6 | 0 | 0 | 0 | 110 | ||||
| 599 | Y | 31.7 | Very low | 30.1 | Very low | 194 Ų | 194 | 134.6 Ų | 134.6 | 76% | 0.761 | 76% | 0.761 | S | S | * | * | 89.8 | 147.7 | 89.1 | -119 | -82.8 | 0 | 0 | 0 | 118.8 | |||||
| 600 | Y | 28.9 | Very low | 29.9 | Very low | 199 Ų | 199 | 136.3 Ų | 136.3 | 78% | 0.78 | 77% | 0.765 | S | S | * | * | trans | 65.5 | 126.9 | -175.2 | -71.8 | -96.7 | 0 | 0 | 0 | 116 | ||||
| 601 | S | 28.6 | Very low | 29.9 | Very low | 87 Ų | 87 | 136.3 Ų | 136.3 | 61% | 0.608 | 77% | 0.765 | S | S | * | * | 69.8 | 138.2 | 57.1 | 115.7 | 0 | 0 | 0 | 0 | 113.6 | |||||
| 602 | N | 28 | Very low | 29.9 | Very low | 139 Ų | 139 | 138.1 Ų | 138.1 | 74% | 0.743 | 77% | 0.767 | S | S | * | * | -161.6 | 170.6 | 50.4 | -142.5 | -9.1 | 0 | 0 | 0 | 114.5 | |||||
| 603 | T | 29.4 | Very low | 30 | Very low | 129 Ų | 129 | 137.1 Ų | 137.1 | 79% | 0.791 | 77% | 0.766 | S | S | * | * | trans | -115.6 | 145.7 | 165.3 | 48.6 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 604 | V | 29.3 | Very low | 30 | Very low | 132 Ų | 132 | 143.8 Ų | 143.8 | 80% | 0.8 | 77% | 0.772 | S | S | * | * | trans | -145.5 | 129.7 | 171.8 | -177.9 | 0 | 0 | 0 | 0 | 105.2 | ||||
| 605 | T | 28.3 | Very low | 30.6 | Very low | 139 Ų | 139 | 140.1 Ų | 140.1 | 85% | 0.853 | 77% | 0.77 | S | S | * | * | cis | -124.8 | 162.9 | 48.5 | 45 | 0 | 0 | 0 | 0 | 115.5 | ||||
| 606 | A | 30.6 | Very low | 30.6 | Very low | 106 Ų | 106 | 139.1 Ų | 139.1 | 88% | 0.876 | 78% | 0.776 | S | S | * | * | trans | -140.8 | 157.6 | 174.1 | 0 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 607 | A | 27.8 | Very low | 29.9 | Very low | 91 Ų | 91 | 146.1 Ų | 146.1 | 75% | 0.752 | 79% | 0.789 | S | S | * | * | trans | -145.4 | 125.7 | 168.1 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 608 | S | 28.9 | Very low | 29.8 | Very low | 105 Ų | 105 | 142.8 Ų | 142.8 | 73% | 0.734 | 79% | 0.79 | S | S | * | * | trans | 35.2 | 102.4 | 160.1 | 54 | 0 | 0 | 0 | 0 | 119.1 | ||||
| 609 | S | 28.9 | Very low | 31 | Very low | 105 Ų | 105 | 142.4 Ų | 142.4 | 73% | 0.734 | 79% | 0.794 | S | S | * | * | 63.4 | 100.2 | 80.8 | 72 | 0 | 0 | 0 | 0 | 114.5 | |||||
| 610 | Q | 27.3 | Very low | 32.2 | Very low | 188 Ų | 188 | 138.8 Ų | 138.8 | 88% | 0.879 | 79% | 0.794 | S | S | * | * | 59.6 | 119.6 | 86.6 | -74.2 | -162 | 4.3 | 0 | 0 | 116.6 | |||||
| 611 | S | 28.7 | Very low | 33.8 | Very low | 98 Ų | 98 | 134.1 Ų | 134.1 | 69% | 0.685 | 79% | 0.788 | S | S | * | * | 162.7 | 170.2 | 104.4 | 55.1 | 0 | 0 | 0 | 0 | 114.6 | |||||
| 612 | Y | 29.3 | Very low | 34.8 | Very low | 205 Ų | 205 | 135.3 Ų | 135.3 | 80% | 0.804 | 79% | 0.794 | S | S | * | * | trans | 69.7 | 88.9 | 167 | -71.2 | -82.2 | 0 | 0 | 0 | 123.2 | ||||
| 613 | L | 28.7 | Very low | 34.9 | Very low | 151 Ų | 151 | 137.5 Ų | 137.5 | 79% | 0.791 | 80% | 0.797 | S | S | * | * | 57.3 | 131.6 | 109.5 | -94 | 165.8 | 0 | 0 | 0 | 124 | |||||
| 614 | R | 28.4 | Very low | 34.8 | Very low | 232 Ų | 232 | 139.7 Ų | 139.7 | 88% | 0.875 | 80% | 0.798 | S | S | * | * | 110.7 | 131.1 | 129.7 | -159.1 | 173.2 | -171.9 | 164.3 | 2.5 | 118 | |||||
| 615 | N | 38.5 | Very low | 34.8 | Very low | 169 Ų | 169 | 137.7 Ų | 137.7 | 90% | 0.904 | 79% | 0.791 | S | S | * | * | trans | -71 | 136.8 | 172.5 | -71.1 | -19.6 | 0 | 0 | 0 | 112.2 | ||||
| 616 | G | 30 | Very low | 34.8 | Very low | 81 Ų | 81 | 138.3 Ų | 138.3 | 84% | 0.835 | 79% | 0.789 | S | S | * | * | trans | -156.8 | 142.2 | 167.6 | 0 | 0 | 0 | 0 | 0 | 110 | ||||
| 617 | R | 37.8 | Very low | 34.7 | Very low | 253 Ų | 253 | 137 Ų | 137 | 96% | 0.955 | 79% | 0.786 | S | S | * | * | trans | -119.2 | 126.9 | -172 | -172.2 | -174.5 | -170.7 | -168 | 4.3 | 110.1 | ||||
| 618 | G | 29.1 | Very low | 34.9 | Very low | 77 Ų | 77 | 138.2 Ų | 138.2 | 79% | 0.794 | 79% | 0.788 | S | S | * | * | trans | -136.7 | 118.5 | -177.6 | 0 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 619 | P | 53 | Low | 34.9 | Very low | 110 Ų | 110 | 140 Ų | 140 | 71% | 0.714 | 79% | 0.789 | S | S | * | * | trans | -119.6 | -158.4 | 164.6 | 43.9 | -30.6 | 0 | 0 | 0 | 109.5 | ||||
| 620 | P | 56 | Low | 35.2 | Very low | 118 Ų | 118 | 139.8 Ų | 139.8 | 77% | 0.766 | 79% | 0.794 | S | S | * | * | cis | -126.6 | -107.8 | -6.5 | 24.1 | 4.2 | 0 | 0 | 0 | 116.1 | ||||
| 621 | P | 62.9 | Low | 35.1 | Very low | 101 Ų | 101 | 135.6 Ų | 135.6 | 66% | 0.656 | 79% | 0.785 | S | S | * | * | trans | -122.8 | -140.2 | -137.8 | 46.9 | -24.3 | 0 | 0 | 0 | 111.8 | ||||
| 622 | P | 50.8 | Low | 35.1 | Very low | 113 Ų | 113 | 134.9 Ų | 134.9 | 73% | 0.734 | 79% | 0.793 | S | S | * | * | cis | -92.8 | -167.7 | 7.8 | 44 | -40.3 | 0 | 0 | 0 | 112.1 | ||||
| 623 | F | 28.9 | Very low | 35.1 | Very low | 184 Ų | 184 | 128.7 Ų | 128.7 | 81% | 0.807 | 79% | 0.791 | S | S | * | * | cis | 87.8 | 133.9 | 7.8 | -98.4 | -84 | 0 | 0 | 0 | 120.6 | ||||
| 624 | E | 26.8 | Very low | 35 | Very low | 175 Ų | 175 | 125.3 Ų | 125.3 | 82% | 0.818 | 79% | 0.794 | S | S | * | * | trans | 58.3 | 162.8 | 170.3 | -44.5 | -160.8 | 154 | 0 | 0 | 117.3 | ||||
| 625 | S | 31.2 | Very low | 34.9 | Very low | 91 Ų | 91 | 117.8 Ų | 117.8 | 64% | 0.636 | 79% | 0.788 | S | S | * | * | cis | -154.4 | 157.7 | 10.8 | 77.5 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 626 | N | 28.2 | Very low | 34.5 | Very low | 152 Ų | 152 | 117.3 Ų | 117.3 | 81% | 0.813 | 79% | 0.785 | S | S | * | * | trans | 46.4 | 126.3 | 138.8 | -58.3 | -23.3 | 0 | 0 | 0 | 124.2 | ||||
| 627 | G | 28.6 | Very low | 34.5 | Very low | 79 Ų | 79 | 119.3 Ų | 119.3 | 81% | 0.814 | 78% | 0.78 | S | S | * | * | trans | 90.6 | 143.2 | 142.8 | 0 | 0 | 0 | 0 | 0 | 117.1 | ||||
| 628 | S | 30.8 | Very low | 34 | Very low | 115 Ų | 115 | 114.5 Ų | 114.5 | 80% | 0.804 | 77% | 0.774 | S | S | * | * | cis | -155.9 | -170.2 | -3.1 | 63.9 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 629 | L | 29.8 | Very low | 34 | Very low | 143 Ų | 143 | 119 Ų | 119 | 75% | 0.749 | 78% | 0.776 | S | S | * | * | trans | -49.4 | 153.9 | -174.9 | -64.9 | 75.5 | 0 | 0 | 0 | 113.4 | ||||
| 630 | A | 33.8 | Very low | 32.6 | Very low | 101 Ų | 101 | 117.3 Ų | 117.3 | 84% | 0.835 | 78% | 0.779 | S | S | * | * | cis | -96.2 | 137.9 | 23.3 | 0 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 631 | S | 26.5 | Very low | 31.1 | Very low | 99 Ų | 99 | 120.9 Ų | 120.9 | 69% | 0.692 | 78% | 0.783 | S | S | * | * | cis | 75.2 | 96.2 | 18.7 | -160.4 | 0 | 0 | 0 | 0 | 116.5 | ||||
| 632 | G | 28.9 | Very low | 29.4 | Very low | 83 Ų | 83 | 124.2 Ų | 124.2 | 86% | 0.856 | 79% | 0.789 | S | S | * | * | trans | 148 | 101.4 | 170.5 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 633 | G | 27.6 | Very low | 28.4 | Very low | 75 Ų | 75 | 127.5 Ų | 127.5 | 77% | 0.773 | 80% | 0.797 | S | S | * | * | cis | 159.8 | 134.7 | -4.9 | 0 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 634 | G | 28.4 | Very low | 28.5 | Very low | 81 Ų | 81 | 127.6 Ų | 127.6 | 84% | 0.835 | 80% | 0.8 | S | S | * | * | trans | 80.3 | 132.8 | -175.3 | 0 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 635 | G | 25.2 | Very low | 28.9 | Very low | 73 Ų | 73 | 124.5 Ų | 124.5 | 75% | 0.753 | 79% | 0.789 | S | S | * | * | cis | 103.3 | 120.7 | -6 | 0 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 636 | L | 29.4 | Very low | 28.8 | Very low | 160 Ų | 160 | 124 Ų | 124 | 84% | 0.838 | 80% | 0.798 | S | S | * | * | trans | 63.8 | 90 | 156.7 | -68.9 | 160.3 | 0 | 0 | 0 | 119 | ||||
| 637 | T | 30.9 | Very low | 29.1 | Very low | 122 Ų | 122 | 120.7 Ų | 120.7 | 75% | 0.748 | 79% | 0.792 | S | S | * | * | 54.2 | 120.5 | 121.6 | 57.2 | 0 | 0 | 0 | 0 | 121.2 | |||||
| 638 | N | 28 | Very low | 29.3 | Very low | 152 Ų | 152 | 122.2 Ų | 122.2 | 81% | 0.813 | 79% | 0.786 | S | S | * | * | trans | 95.6 | 141.9 | 136.4 | -151.7 | 25.4 | 0 | 0 | 0 | 118.7 | ||||
| 639 | M | 29.1 | Very low | 30 | Very low | 171 Ų | 171 | 122.2 Ų | 122.2 | 84% | 0.842 | 78% | 0.783 | S | S | * | * | trans | 60.4 | 107.8 | 166.5 | -65.9 | -68.1 | -80.5 | 0 | 0 | 119.9 | ||||
| 640 | G | 23.8 | Very low | 30.8 | Very low | 75 Ų | 75 | 120.6 Ų | 120.6 | 77% | 0.773 | 78% | 0.781 | S | S | * | * | trans | 132.2 | 157.5 | 157.6 | 0 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 641 | F | 24.2 | Very low | 30.9 | Very low | 193 Ų | 193 | 121.5 Ų | 121.5 | 85% | 0.846 | 78% | 0.782 | S | S | * | * | cis | -164.4 | -179.6 | -28 | -155.6 | -107.7 | 0 | 0 | 0 | 106.8 | ||||
| 642 | Q | 27 | Very low | 31.3 | Very low | 171 Ų | 171 | 120.9 Ų | 120.9 | 80% | 0.799 | 78% | 0.782 | S | S | * | * | trans | 61.4 | 117.4 | 164.8 | -100.2 | 155.3 | -37.9 | 0 | 0 | 119.9 | ||||
| 643 | M | 29.2 | Very low | 31.4 | Very low | 183 Ų | 183 | 125.6 Ų | 125.6 | 90% | 0.901 | 79% | 0.787 | S | S | * | * | trans | -87 | 151 | 140 | -84.7 | 173 | 132.8 | 0 | 0 | 109.1 | ||||
| 644 | E | 30.4 | Very low | 31.5 | Very low | 186 Ų | 186 | 125.6 Ų | 125.6 | 87% | 0.869 | 79% | 0.787 | S | S | * | * | trans | -132.5 | 109.5 | 149.2 | -150.7 | 167 | -157.8 | 0 | 0 | 102.1 | ||||
| 645 | D | 36.3 | Very low | 31.5 | Very low | 109 Ų | 109 | 125.8 Ų | 125.8 | 58% | 0.583 | 79% | 0.788 | S | S | * | * | 51.3 | 143.9 | 67.7 | -95.9 | -26.9 | 0 | 0 | 0 | 113.5 | A647 T648 | D645-A647 WeakPolarHBondContact OD1-CA 3.43Å; D645-A647 PolarHBondContact OD1-N 3.17Å; D645-T648 PolarHBondContact OD1-N 3.4Å | |||
| 646 | G | 28.1 | Very low | 31.8 | Very low | 80 Ų | 80 | 126.4 Ų | 126.4 | 83% | 0.825 | 80% | 0.795 | S | S | * | * | S | Bend | cis | -84 | 161.3 | 4.3 | 0 | 0 | 0 | 0 | 0 | 116.1 | ||
| 647 | A | 34.4 | Very low | 32.4 | Very low | 83 Ų | 83 | 123.2 Ų | 123.2 | 69% | 0.686 | 79% | 0.792 | S | S | * | * | S | Bend | cis | -152.8 | 99.8 | 0.6 | 0 | 0 | 0 | 0 | 0 | 114.7 | D645 | D645-A647 WeakPolarHBondContact OD1-CA 3.43Å; D645-A647 PolarHBondContact OD1-N 3.17Å |
| 648 | T | 33.8 | Very low | 32.4 | Very low | 111 Ų | 111 | 128.8 Ų | 128.8 | 68% | 0.681 | 80% | 0.801 | S | S | * | * | trans | 72.7 | 174.4 | 143.2 | 81.3 | 0 | 0 | 0 | 0 | 117.6 | D645 | D645-T648 PolarHBondContact OD1-N 3.4Š| ||
| 649 | P | 44.3 | Very low | 32.5 | Very low | 115 Ų | 115 | 128.8 Ų | 128.8 | 75% | 0.747 | 80% | 0.796 | S | S | * | * | -139.7 | -157.4 | -110.7 | 37.4 | -11.9 | 0 | 0 | 0 | 114.8 | |||||
| 650 | P | 47.7 | Very low | 32.4 | Very low | 110 Ų | 110 | 131 Ų | 131 | 71% | 0.714 | 80% | 0.795 | S | S | * | * | cis | -132 | 170.1 | -29.1 | 21.7 | 1.9 | 0 | 0 | 0 | 117.1 | ||||
| 651 | S | 34.6 | Very low | 32.6 | Very low | 120 Ų | 120 | 137.4 Ų | 137.4 | 84% | 0.839 | 80% | 0.801 | S | S | * | * | trans | 74.6 | 149.3 | 148.6 | 74.3 | 0 | 0 | 0 | 0 | 122.2 | ||||
| 652 | A | 35.7 | Very low | 33.1 | Very low | 85 Ų | 85 | 132.7 Ų | 132.7 | 70% | 0.702 | 80% | 0.798 | S | S | * | * | cis | -169.6 | 147 | -23.9 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 653 | L | 31.9 | Very low | 33.3 | Very low | 183 Ų | 183 | 129.5 Ų | 129.5 | 96% | 0.958 | 80% | 0.801 | S | S | * | * | trans | 57.2 | 145.7 | 160.2 | -59.7 | 166.7 | 0 | 0 | 0 | 120.2 | ||||
| 654 | G | 29.5 | Very low | 33.5 | Very low | 75 Ų | 75 | 126.1 Ų | 126.1 | 77% | 0.773 | 80% | 0.802 | S | S | * | * | cis | 165.6 | 146.6 | -11.6 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 655 | G | 29 | Very low | 33.4 | Very low | 84 Ų | 84 | 121 Ų | 121 | 87% | 0.866 | 80% | 0.799 | S | S | * | * | trans | 103.2 | 127.2 | 153.7 | 0 | 0 | 0 | 0 | 0 | 121.7 | ||||
| 656 | G | 30.3 | Very low | 33.4 | Very low | 87 Ų | 87 | 125.2 Ų | 125.2 | 90% | 0.897 | 81% | 0.812 | S | S | * | * | trans | 90.3 | 140.1 | 146.4 | 0 | 0 | 0 | 0 | 0 | 119.6 | ||||
| 657 | A | 43.1 | Very low | 33.7 | Very low | 92 Ų | 92 | 132.6 Ų | 132.6 | 76% | 0.76 | 82% | 0.815 | S | S | * | * | trans | -143.8 | 119.7 | 174.3 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 658 | Y | 29.9 | Very low | 33.5 | Very low | 239 Ų | 239 | 138.1 Ų | 138.1 | 94% | 0.937 | 82% | 0.818 | S | S | * | * | trans | -155.4 | 172.1 | 167.5 | -103.2 | -70.9 | 0 | 0 | 0 | 112.4 | ||||
| 659 | Q | 29.6 | Very low | 33.4 | Very low | 152 Ų | 152 | 141.7 Ų | 141.7 | 71% | 0.71 | 82% | 0.819 | S | S | * | * | trans | -74.1 | 154 | -166.4 | -59.6 | 179.2 | -7.8 | 0 | 0 | 116.8 | ||||
| 660 | R | 27.5 | Very low | 32.8 | Very low | 218 Ų | 218 | 142 Ų | 142 | 82% | 0.823 | 81% | 0.81 | S | S | * | * | trans | 79.9 | 154.3 | 134 | -95.2 | 176.4 | 174.9 | 178.2 | 1.1 | 121.9 | ||||
| 661 | K | 29 | Very low | 32.1 | Very low | 209 Ų | 209 | 140.6 Ų | 140.6 | 91% | 0.909 | 80% | 0.804 | S | S | * | * | trans | 81.4 | 168.5 | 156.8 | -84.2 | -177.4 | 174.8 | -179.1 | 0 | 117.5 | ||||
| 662 | A | 34.4 | Very low | 32.1 | Very low | 95 Ų | 95 | 141.9 Ų | 141.9 | 79% | 0.785 | 80% | 0.799 | S | S | * | * | trans | -147.9 | 166.8 | -159.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 663 | A | 31.5 | Very low | 31.8 | Very low | 104 Ų | 104 | 148.1 Ų | 148.1 | 86% | 0.86 | 81% | 0.807 | S | S | * | * | trans | 89.7 | 143.9 | 161.8 | 0 | 0 | 0 | 0 | 0 | 120 | ||||
| 664 | A | 32.5 | Very low | 32 | Very low | 112 Ų | 112 | 144.8 Ų | 144.8 | 93% | 0.926 | 79% | 0.794 | S | S | * | * | trans | 99.7 | 112.5 | 162.5 | 0 | 0 | 0 | 0 | 0 | 117.9 | ||||
| 665 | G | 28.6 | Very low | 32 | Very low | 77 Ų | 77 | 150 Ų | 150 | 79% | 0.794 | 80% | 0.798 | S | S | * | * | trans | -164.3 | 146.2 | 171.5 | 0 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 666 | K | 35.1 | Very low | 32.1 | Very low | 198 Ų | 198 | 153.2 Ų | 153.2 | 86% | 0.861 | 80% | 0.795 | S | S | * | * | trans | -168.2 | 154.7 | -171.1 | -153.9 | 167 | -178.5 | 173 | 0 | 113.7 | ||||
| 667 | R | 34.6 | Very low | 31.9 | Very low | 236 Ų | 236 | 158.4 Ų | 158.4 | 89% | 0.891 | 80% | 0.796 | S | S | * | * | trans | 76.4 | 153.9 | 175.4 | -51.4 | 172.4 | 167.2 | 176.7 | -4.9 | 113.4 | ||||
| 668 | R | 30.3 | Very low | 31.4 | Very low | 198 Ų | 198 | 158.2 Ų | 158.2 | 75% | 0.747 | 80% | 0.795 | S | S | * | * | cis | -124.2 | -153.1 | -5.9 | -138.1 | -163.7 | 143.8 | 158.8 | -5.8 | 107.9 | E670 | R668-E670 IonicContact CZ-OE1 3.5Å; R668-E670 IonicContact NE-OE1 2.68Å; R668-E670 PolarHBondContact NE-OE1 2.87Å; R668-E670 IonicContact NH2-OE1 3.88Å; R668-E670 PolarHBondContact NH2-OE1 3.29Å; R668-E670 IonicContact NH2-OE2 2.71Å | ||
| 669 | R | 32.6 | Very low | 32 | Very low | 186 Ų | 186 | 152.3 Ų | 152.3 | 70% | 0.702 | 79% | 0.786 | S | S | * | * | cis | -136.6 | -125.2 | -3.5 | -166.4 | -151.7 | 165.1 | 156.1 | -4.3 | 110.5 | ||||
| 670 | E | 30.5 | Very low | 32 | Very low | 121 Ų | 121 | 150.3 Ų | 150.3 | 57% | 0.565 | 79% | 0.789 | S | S | * | * | trans | -150.1 | 177.7 | -167.5 | -63.7 | 138 | -134.4 | 0 | 0 | 105.6 | R668 | R668-E670 IonicContact CZ-OE1 3.5Å; R668-E670 IonicContact NE-OE1 2.68Å; R668-E670 PolarHBondContact NE-OE1 2.87Å; R668-E670 IonicContact NH2-OE1 3.88Å; R668-E670 PolarHBondContact NH2-OE1 3.29Å; R668-E670 IonicContact NH2-OE2 2.71Å | ||
| 671 | S | 33.2 | Very low | 32.2 | Very low | 82 Ų | 82 | 144 Ų | 144 | 57% | 0.573 | 78% | 0.783 | S | S | * | * | cis | -173.9 | 144.1 | 34.6 | 50.4 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 672 | I | 34.8 | Very low | 32.3 | Very low | 146 Ų | 146 | 145.2 Ų | 145.2 | 75% | 0.749 | 78% | 0.782 | S | S | * | * | trans | 55.1 | 116.5 | 141 | -48.4 | 158.6 | 0 | 0 | 0 | 121.2 | ||||
| 673 | Y | 30.6 | Very low | 32.1 | Very low | 217 Ų | 217 | 151.9 Ų | 151.9 | 85% | 0.851 | 79% | 0.786 | S | S | * | * | -170.9 | 170.8 | 107.5 | -123.4 | -82.6 | 0 | 0 | 0 | 113 | |||||
| 674 | T | 35.9 | Very low | 32 | Very low | 113 Ų | 113 | 150.3 Ų | 150.3 | 69% | 0.693 | 78% | 0.78 | S | S | * | * | trans | -121.7 | 156.8 | -170.9 | 55.5 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 675 | Q | 29.3 | Very low | 31.9 | Very low | 184 Ų | 184 | 150.4 Ų | 150.4 | 86% | 0.86 | 77% | 0.774 | S | S | * | * | trans | -165.1 | 157.9 | 133.5 | -158.4 | 136.9 | -25.5 | 0 | 0 | 113 | ||||
| 676 | N | 30.7 | Very low | 32 | Very low | 152 Ų | 152 | 155.8 Ų | 155.8 | 81% | 0.813 | 78% | 0.781 | S | S | * | * | trans | -119.4 | 154.5 | 174.9 | -86.9 | -29 | 0 | 0 | 0 | 111.1 | ||||
| 677 | Q | 26.3 | Very low | 31.7 | Very low | 195 Ų | 195 | 157.1 Ų | 157.1 | 91% | 0.911 | 78% | 0.782 | S | S | * | * | trans | -172.8 | 164.9 | 131.1 | -107.5 | 174.7 | 16.5 | 0 | 0 | 113.4 | ||||
| 678 | A | 32.3 | Very low | 32.7 | Very low | 88 Ų | 88 | 151.2 Ų | 151.2 | 73% | 0.727 | 77% | 0.774 | S | S | * | * | trans | -136.3 | 169.7 | 167.9 | 0 | 0 | 0 | 0 | 0 | 108 | ||||
| 679 | P | 42 | Very low | 33.6 | Very low | 116 Ų | 116 | 146.4 Ų | 146.4 | 75% | 0.753 | 77% | 0.769 | S | S | * | * | -160 | 176.6 | 104 | 43.2 | -24.3 | 0 | 0 | 0 | 117.6 | |||||
| 680 | S | 30.4 | Very low | 33.6 | Very low | 110 Ų | 110 | 144 Ų | 144 | 77% | 0.769 | 78% | 0.775 | S | S | * | * | trans | 24.3 | 170 | 139.9 | 68.1 | 0 | 0 | 0 | 0 | 124.8 | ||||
| 681 | A | 30.7 | Very low | 33.7 | Very low | 84 Ų | 84 | 141.8 Ų | 141.8 | 69% | 0.694 | 78% | 0.778 | S | S | * | * | cis | 171.6 | 166 | -34.8 | 0 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 682 | R | 31.7 | Very low | 33.7 | Very low | 236 Ų | 236 | 147 Ų | 147 | 89% | 0.891 | 79% | 0.792 | S | S | * | * | trans | 68.4 | 170 | 162.1 | -68.2 | -174.9 | 174.9 | -157 | 0.9 | 118.5 | ||||
| 683 | R | 31.3 | Very low | 33.5 | Very low | 234 Ų | 234 | 143.5 Ų | 143.5 | 88% | 0.883 | 79% | 0.785 | S | S | * | * | cis | 179.3 | 137.3 | -38.7 | -173 | -173.5 | -154.4 | -147 | 9.2 | 110.6 | ||||
| 684 | G | 29 | Very low | 33.6 | Very low | 71 Ų | 71 | 141.4 Ų | 141.4 | 73% | 0.732 | 79% | 0.788 | S | S | * | * | trans | 148.4 | 161.5 | 155.3 | 0 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 685 | S | 29.6 | Very low | 33.4 | Very low | 115 Ų | 115 | 139.5 Ų | 139.5 | 80% | 0.804 | 78% | 0.784 | S | S | * | * | cis | 148.3 | 111.8 | -38.7 | 171 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 686 | M | 31.4 | Very low | 33.5 | Very low | 190 Ų | 190 | 138.8 Ų | 138.8 | 94% | 0.936 | 78% | 0.781 | S | S | * | * | trans | -170.8 | 165.3 | 146.7 | -107.6 | 164.8 | -172.4 | 0 | 0 | 114 | ||||
| 687 | Y | 28 | Very low | 33.6 | Very low | 225 Ų | 225 | 137.7 Ų | 137.7 | 88% | 0.882 | 77% | 0.772 | S | S | * | * | trans | -150.7 | -175.3 | -173.3 | -103 | -88.3 | 0 | 0 | 0 | 106.9 | ||||
| 688 | P | 56.9 | Low | 33.8 | Very low | 112 Ų | 112 | 135.2 Ų | 135.2 | 73% | 0.727 | 76% | 0.761 | S | S | * | * | cis | -122.3 | -125.3 | -2.4 | 26.8 | 1.2 | 0 | 0 | 0 | 110.5 | ||||
| 689 | P | 47.5 | Very low | 33.8 | Very low | 97 Ų | 97 | 137.1 Ų | 137.1 | 63% | 0.63 | 76% | 0.756 | S | S | * | * | cis | -140.6 | 158.1 | -23.5 | 41.4 | -22.4 | 0 | 0 | 0 | 119 | ||||
| 690 | T | 32.8 | Very low | 33.1 | Very low | 137 Ų | 137 | 141.9 Ų | 141.9 | 84% | 0.84 | 76% | 0.759 | S | S | * | * | trans | 51.2 | 152.2 | 140.9 | 57.2 | 0 | 0 | 0 | 0 | 124.6 | ||||
| 691 | A | 32.6 | Very low | 33 | Very low | 74 Ų | 74 | 148.2 Ų | 148.2 | 61% | 0.612 | 77% | 0.766 | S | S | * | * | cis | -177 | 170.5 | -20.8 | 0 | 0 | 0 | 0 | 0 | 113 | ||||
| 692 | H | 32.8 | Very low | 32.9 | Very low | 190 Ų | 190 | 147.7 Ų | 147.7 | 88% | 0.88 | 77% | 0.769 | S | S | * | * | trans | 67.5 | 159.6 | 164.9 | -72 | -89.1 | 0 | 0 | 0 | 120.2 | ||||
| 693 | A | 32.2 | Very low | 32.8 | Very low | 73 Ų | 73 | 142 Ų | 142 | 60% | 0.603 | 77% | 0.765 | S | S | * | * | cis | -174.2 | 174.9 | -30.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 694 | L | 31.3 | Very low | 32.9 | Very low | 173 Ų | 173 | 138.5 Ų | 138.5 | 91% | 0.906 | 76% | 0.763 | S | S | * | * | trans | 73.4 | 155.1 | 165.6 | -60.9 | 170.2 | 0 | 0 | 0 | 118.2 | ||||
| 695 | A | 31.5 | Very low | 32.9 | Very low | 74 Ų | 74 | 138.8 Ų | 138.8 | 61% | 0.612 | 76% | 0.759 | S | S | * | * | cis | -171.1 | 159.1 | -20.6 | 0 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 696 | Q | 33.1 | Very low | 33.1 | Very low | 169 Ų | 169 | 139.4 Ų | 139.4 | 79% | 0.79 | 76% | 0.758 | S | S | * | * | trans | 63.8 | 160.4 | 154 | -70.7 | -176.5 | 8.4 | 0 | 0 | 119.7 | ||||
| 697 | M | 31.2 | Very low | 33 | Very low | 129 Ų | 129 | 136.4 Ų | 136.4 | 64% | 0.635 | 76% | 0.755 | S | S | * | * | cis | -158.8 | 147.4 | -10.7 | -121.3 | -164.6 | -167.2 | 0 | 0 | 112.9 | ||||
| 698 | Q | 32.3 | Very low | 33 | Very low | 143 Ų | 143 | 129.2 Ų | 129.2 | 67% | 0.668 | 75% | 0.75 | S | S | * | * | trans | 52.4 | 144.4 | 137.3 | -74 | -177 | 16.4 | 0 | 0 | 123.1 | ||||
| 699 | M | 31.8 | Very low | 31.7 | Very low | 128 Ų | 128 | 130.4 Ų | 130.4 | 63% | 0.631 | 76% | 0.761 | S | S | * | * | cis | -137.3 | -141.9 | -7 | -63 | -157.5 | 176.1 | 0 | 0 | 109.7 | ||||
| 700 | R | 27.6 | Very low | 30.8 | Very low | 216 Ų | 216 | 129.3 Ų | 129.3 | 82% | 0.815 | 77% | 0.767 | S | S | * | * | cis | -154.6 | -146 | 2.3 | -140.3 | 158.3 | -145.6 | -154.8 | 4.1 | 114.3 | ||||
| 701 | R | 28.3 | Very low | 30.8 | Very low | 242 Ų | 242 | 128.9 Ų | 128.9 | 91% | 0.913 | 77% | 0.77 | S | S | * | * | trans | -99.3 | 165.9 | -167.4 | -65.5 | 170.6 | 170.2 | 179.5 | -5.6 | 113.7 | ||||
| 702 | G | 27.8 | Very low | 30.7 | Very low | 73 Ų | 73 | 129.6 Ų | 129.6 | 75% | 0.753 | 78% | 0.775 | S | S | * | * | cis | 152.3 | 136.9 | -12.2 | 0 | 0 | 0 | 0 | 0 | 117.1 | ||||
| 703 | S | 29.8 | Very low | 30.8 | Very low | 116 Ų | 116 | 125 Ų | 125 | 81% | 0.811 | 77% | 0.771 | S | S | * | * | trans | 52.1 | 113.7 | 138.6 | -176.3 | 0 | 0 | 0 | 0 | 124.5 | ||||
| 704 | L | 32.5 | Very low | 30.7 | Very low | 161 Ų | 161 | 130.3 Ų | 130.3 | 84% | 0.843 | 79% | 0.785 | S | S | * | * | trans | -172.9 | 146.2 | 136.5 | -124.6 | 62.4 | 0 | 0 | 0 | 107 | ||||
| 705 | A | 30.9 | Very low | 30.7 | Very low | 78 Ų | 78 | 126.6 Ų | 126.6 | 65% | 0.645 | 78% | 0.779 | S | S | * | * | cis | 70.5 | 133.8 | 28.5 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 706 | T | 32.2 | Very low | 30.7 | Very low | 128 Ų | 128 | 127.3 Ų | 127.3 | 79% | 0.785 | 79% | 0.785 | S | S | * | * | cis | -152.9 | 170.7 | 21.5 | 53.8 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 707 | S | 30.8 | Very low | 30.6 | Very low | 126 Ų | 126 | 125.9 Ų | 125.9 | 88% | 0.881 | 79% | 0.788 | S | S | * | * | trans | 40.3 | 147.1 | 138.1 | -160.6 | 0 | 0 | 0 | 0 | 123.9 | ||||
| 708 | G | 28.1 | Very low | 30.6 | Very low | 74 Ų | 74 | 124.6 Ų | 124.6 | 76% | 0.763 | 80% | 0.798 | S | S | * | * | trans | 158.5 | 110.6 | 149.4 | 0 | 0 | 0 | 0 | 0 | 117.9 | ||||
| 709 | S | 28.7 | Very low | 30.6 | Very low | 137 Ų | 137 | 122.2 Ų | 122.2 | 96% | 0.958 | 80% | 0.803 | S | S | * | * | trans | -91.8 | 155.3 | 168.1 | 179.9 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 710 | G | 28.4 | Very low | 30.6 | Very low | 74 Ų | 74 | 128.2 Ų | 128.2 | 76% | 0.763 | 82% | 0.818 | S | S | * | * | trans | 178.9 | 156.4 | 173 | 0 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 711 | S | 32.1 | Very low | 30.8 | Very low | 128 Ų | 128 | 129.8 Ų | 129.8 | 90% | 0.895 | 82% | 0.824 | S | S | * | * | trans | -154.5 | 164.7 | -176.2 | -169.3 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 712 | A | 32.3 | Very low | 31.1 | Very low | 89 Ų | 89 | 122 Ų | 122 | 74% | 0.736 | 82% | 0.819 | S | S | * | * | trans | 80.2 | 113.5 | 159.6 | 0 | 0 | 0 | 0 | 0 | 122.6 | ||||
| 713 | A | 33.1 | Very low | 31.1 | Very low | 94 Ų | 94 | 124.5 Ų | 124.5 | 78% | 0.777 | 83% | 0.825 | S | S | * | * | 48.6 | 137.5 | 126.2 | 0 | 0 | 0 | 0 | 0 | 124.6 | |||||
| 714 | M | 31.8 | Very low | 31.2 | Very low | 184 Ų | 184 | 125.9 Ų | 125.9 | 91% | 0.906 | 82% | 0.823 | S | S | * | * | 175.3 | 163.2 | 115.6 | -100.7 | -61.6 | -158.6 | 0 | 0 | 116.1 | |||||
| 715 | A | 30.2 | Very low | 31 | Very low | 95 Ų | 95 | 127.2 Ų | 127.2 | 79% | 0.785 | 82% | 0.822 | S | S | * | * | trans | 66.8 | 161 | 157.8 | 0 | 0 | 0 | 0 | 0 | 119.2 | ||||
| 716 | A | 32.2 | Very low | 32 | Very low | 89 Ų | 89 | 129.1 Ų | 129.1 | 74% | 0.736 | 83% | 0.828 | S | S | * | * | cis | -177.9 | 172.1 | -19.7 | 0 | 0 | 0 | 0 | 0 | 109 | ||||
| 717 | V | 30.2 | Very low | 31.7 | Very low | 139 Ų | 139 | 128.2 Ų | 128.2 | 84% | 0.842 | 83% | 0.833 | S | S | * | * | cis | -168.7 | 162 | -22.8 | 139.6 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 718 | A | 31.5 | Very low | 31.6 | Very low | 102 Ų | 102 | 128.6 Ų | 128.6 | 84% | 0.843 | 83% | 0.83 | S | S | * | * | trans | 77.7 | 168 | 160.8 | 0 | 0 | 0 | 0 | 0 | 122.2 | ||||
| 719 | A | 32.3 | Very low | 31.6 | Very low | 94 Ų | 94 | 129.4 Ų | 129.4 | 78% | 0.777 | 83% | 0.83 | S | S | * | * | trans | -162.3 | 162.8 | -170.4 | 0 | 0 | 0 | 0 | 0 | 114 | ||||
| 720 | R | 32.1 | Very low | 31.5 | Very low | 254 Ų | 254 | 129.2 Ų | 129.2 | 96% | 0.958 | 83% | 0.828 | S | S | * | * | trans | -170.3 | 168.4 | 156.9 | -109.5 | 161.9 | -164.7 | -127.2 | 3 | 116.4 | ||||
| 721 | R | 32.4 | Very low | 31.6 | Very low | 248 Ų | 248 | 130.1 Ų | 130.1 | 94% | 0.936 | 83% | 0.829 | S | S | * | * | trans | -79.3 | 174 | -179.1 | -53.6 | 169.4 | 177.9 | -179.9 | -3.7 | 112.1 | ||||
| 722 | G | 33 | Very low | 31.3 | Very low | 78 Ų | 78 | 129.5 Ų | 129.5 | 80% | 0.804 | 82% | 0.824 | S | S | * | * | cis | 131.9 | 128.5 | -2.3 | 0 | 0 | 0 | 0 | 0 | 114 | ||||
| 723 | S | 27.9 | Very low | 31.2 | Very low | 126 Ų | 126 | 130.1 Ų | 130.1 | 88% | 0.881 | 82% | 0.823 | S | S | * | * | trans | -158.1 | 179.4 | 176 | 71.1 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 724 | L | 32.7 | Very low | 30.9 | Very low | 145 Ų | 145 | 132.8 Ų | 132.8 | 76% | 0.759 | 82% | 0.824 | S | S | * | * | trans | -146.9 | 129.9 | -164.2 | -74.9 | 161.6 | 0 | 0 | 0 | 115.2 | ||||
| 725 | F | 28.6 | Very low | 30.8 | Very low | 190 Ų | 190 | 130 Ų | 130 | 83% | 0.833 | 82% | 0.818 | S | S | * | * | trans | 55.1 | 168.5 | 154.2 | -65.7 | -61.3 | 0 | 0 | 0 | 120.9 | ||||
| 726 | P | 51.2 | Low | 30.6 | Very low | 118 Ų | 118 | 131.3 Ų | 131.3 | 77% | 0.766 | 82% | 0.821 | S | S | * | * | cis | -133.5 | 155.6 | -46.7 | 37.5 | -23 | 0 | 0 | 0 | 114.1 | ||||
| 727 | A | 27.1 | Very low | 30.8 | Very low | 108 Ų | 108 | 131.9 Ų | 131.9 | 89% | 0.893 | 83% | 0.825 | S | S | * | * | trans | -162.6 | 170.9 | 162.3 | 0 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 728 | T | 28.6 | Very low | 30.9 | Very low | 135 Ų | 135 | 130.5 Ų | 130.5 | 83% | 0.828 | 82% | 0.819 | S | S | * | * | trans | -103 | 147.4 | -165.2 | 49.4 | 0 | 0 | 0 | 0 | 116.9 | ||||
| 729 | A | 27 | Very low | 30.6 | Very low | 91 Ų | 91 | 137.3 Ų | 137.3 | 75% | 0.752 | 82% | 0.823 | S | S | * | * | trans | 80.3 | 158.6 | 140.2 | 0 | 0 | 0 | 0 | 0 | 122.4 | ||||
| 730 | S | 27.3 | Very low | 31 | Very low | 132 Ų | 132 | 144.6 Ų | 144.6 | 92% | 0.923 | 83% | 0.83 | S | S | * | * | trans | 72.3 | 164.3 | 178 | 77.1 | 0 | 0 | 0 | 0 | 116.8 | ||||
| 731 | A | 29.9 | Very low | 30.8 | Very low | 94 Ų | 94 | 137.9 Ų | 137.9 | 78% | 0.777 | 82% | 0.822 | S | S | * | * | trans | -140.6 | 146.8 | -154.1 | 0 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 732 | S | 27.1 | Very low | 30.8 | Very low | 114 Ų | 114 | 130.5 Ų | 130.5 | 80% | 0.797 | 81% | 0.809 | S | S | * | * | trans | -173.2 | 148.6 | 138.1 | 34.6 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 733 | S | 28.6 | Very low | 31.3 | Very low | 102 Ų | 102 | 134 Ų | 134 | 71% | 0.713 | 81% | 0.808 | S | S | * | * | trans | 13.3 | 146 | 154.4 | 57.7 | 0 | 0 | 0 | 0 | 124.6 | ||||
| 734 | L | 27.8 | Very low | 31.8 | Very low | 151 Ų | 151 | 137 Ų | 137 | 79% | 0.791 | 81% | 0.805 | S | S | * | * | trans | 86.8 | 108.6 | 147.1 | -101.5 | 74.9 | 0 | 0 | 0 | 121.3 | ||||
| 735 | T | 29.9 | Very low | 31.9 | Very low | 126 Ų | 126 | 134.5 Ų | 134.5 | 77% | 0.773 | 80% | 0.8 | S | S | * | * | trans | 44.2 | 101.7 | 131.9 | 56.9 | 0 | 0 | 0 | 0 | 120.8 | ||||
| 736 | S | 25.8 | Very low | 32.2 | Very low | 122 Ų | 122 | 131.9 Ų | 131.9 | 85% | 0.853 | 80% | 0.799 | S | S | * | * | trans | -154.1 | 157.3 | 132.5 | 59.1 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 737 | A | 35.2 | Very low | 31.4 | Very low | 100 Ų | 100 | 132.7 Ų | 132.7 | 83% | 0.826 | 80% | 0.802 | S | S | * | * | trans | -100.9 | 142 | 179.1 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 738 | P | 33.4 | Very low | 32.2 | Very low | 110 Ų | 110 | 130.3 Ų | 130.3 | 71% | 0.714 | 78% | 0.779 | S | S | * | * | trans | -140 | 135.7 | 140.6 | 35.2 | -21.2 | 0 | 0 | 0 | 115.3 | ||||
| 739 | R | 25.4 | Very low | 32.8 | Very low | 245 Ų | 245 | 131.2 Ų | 131.2 | 93% | 0.925 | 77% | 0.773 | S | S | * | * | trans | 50.6 | 130.6 | 137.9 | -58 | -176.1 | 177.9 | -153 | -3 | 120.5 | ||||
| 740 | R | 40.5 | Very low | 33.5 | Very low | 247 Ų | 247 | 134.7 Ų | 134.7 | 93% | 0.932 | 77% | 0.772 | S | S | * | * | trans | -48.8 | 140.5 | 169 | -81.3 | -179.1 | 162.5 | -159.3 | -3.7 | 113.9 | ||||
| 741 | S | 28.4 | Very low | 34.3 | Very low | 113 Ų | 113 | 133 Ų | 133 | 79% | 0.79 | 75% | 0.752 | S | S | * | * | trans | -120.4 | -176.4 | 151.4 | 62.2 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 742 | S | 31.3 | Very low | 35.2 | Very low | 94 Ų | 94 | 134.1 Ų | 134.1 | 66% | 0.657 | 74% | 0.743 | S | S | * | * | trans | -80.6 | 144.7 | -164.2 | 46.6 | 0 | 0 | 0 | 0 | 115.7 | F744 | S742-F744 PolarHBondContact O-N 3.35Š| ||
| 743 | I | 44.4 | Very low | 35.8 | Very low | 152 Ų | 152 | 132.5 Ų | 132.5 | 78% | 0.779 | 73% | 0.725 | S | S | * | * | S | Bend | trans | -65.4 | -0.9 | -173 | -71 | 169.8 | 0 | 0 | 0 | 115.6 | ||
| 744 | F | 37.6 | Very low | 36.5 | Very low | 189 Ų | 189 | 132 Ų | 132 | 83% | 0.829 | 72% | 0.718 | S | S | * | * | trans | -131.4 | 75.6 | -178 | -80.1 | -75.3 | 0 | 0 | 0 | 114 | S742 | S742-F744 PolarHBondContact O-N 3.35Š| ||
| 745 | S | 35.3 | Very low | 37.1 | Very low | 92 Ų | 92 | 131 Ų | 131 | 64% | 0.643 | 71% | 0.713 | S | S | * | * | S | Bend | trans | -159.7 | 139.5 | 153.3 | 57.5 | 0 | 0 | 0 | 0 | 111.3 | ||
| 746 | V | 34.1 | Very low | 37.9 | Very low | 135 Ų | 135 | 132.5 Ų | 132.5 | 82% | 0.818 | 71% | 0.711 | S | S | * | * | trans | 64.5 | 96.3 | 173.6 | -166.6 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 747 | T | 35.9 | Very low | 38.7 | Very low | 134 Ų | 134 | 133.9 Ų | 133.9 | 82% | 0.822 | 70% | 0.704 | S | S | * | * | trans | -68.3 | 125.4 | 156.3 | 45.9 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 748 | S | 42 | Very low | 39.6 | Very low | 58 Ų | 58 | 133.5 Ų | 133.5 | 41% | 0.406 | 69% | 0.691 | S | S | . | * | trans | -87.1 | 146.1 | 174.8 | -169.9 | 0 | 0 | 0 | 0 | 110.6 | K750 D751 | S748-K750 PolarHBondContact O-N 2.68Å; S748-D751 PolarHBondContact N-OD2 2.76Å; S748-D751 PolarHBondContact O-N 2.97Å | ||
| 749 | E | 42.9 | Very low | 40.9 | Very low | 154 Ų | 154 | 132.1 Ų | 132.1 | 72% | 0.72 | 68% | 0.681 | S | S | * | * | H | α-helix | trans | -56.9 | -22.5 | 172.7 | -67.1 | 174.9 | 116.1 | 0 | 0 | 112.6 | D751 M752 N753 | E749-D751 VanDerWaalsContact C-N 3.33Å; E749-D751 PolarHBondContact O-N 3.44Å; E749-M752 PolarHBondContact O-N 3.02Å; E749-N753 PolarHBondContact O-N 2.99Å; E749-N753 PolarHBondContact O-ND2 3.41Å |
| 750 | K | 41.1 | Very low | 42.2 | Very low | 164 Ų | 164 | 126.8 Ų | 126.8 | 71% | 0.713 | 67% | 0.67 | S | S | * | * | H | α-helix | trans | -61.7 | -36.9 | 173.3 | -70.8 | -173.2 | 174.6 | -177.1 | 0 | 113.1 | S748 M752 N753 V754 | S748-K750 PolarHBondContact O-N 2.68Å; K750-M752 VanDerWaalsContact C-N 3.31Å; K750-M752 PolarHBondContact O-N 2.93Å; K750-N753 PolarHBondContact O-N 3.37Å; K750-V754 PolarHBondContact O-N 3.47Å |
| 751 | D | 43.1 | Very low | 42.6 | Very low | 97 Ų | 97 | 117.3 Ų | 117.3 | 52% | 0.519 | 64% | 0.644 | S | S | . | * | H | α-helix | trans | -71.8 | -29.8 | -178.7 | -55.1 | -42 | 0 | 0 | 0 | 111.6 | S748 E749 V754 L755 | S748-D751 PolarHBondContact N-OD2 2.76Å; S748-D751 PolarHBondContact O-N 2.97Å; E749-D751 VanDerWaalsContact C-N 3.33Å; E749-D751 PolarHBondContact O-N 3.44Å; D751-V754 PolarHBondContact O-N 3.36Å; D751-L755 PolarHBondContact O-N 2.82Å |
| 752 | M | 49.1 | Very low | 43.4 | Very low | 118 Ų | 118 | 115.4 Ų | 115.4 | 58% | 0.581 | 63% | 0.625 | S | S | * | * | H | α-helix | trans | -70 | -39.8 | 175.6 | -164.7 | 161.3 | 67.3 | 0 | 0 | 111.6 | E749 K750 V754 L755 E756 | E749-M752 PolarHBondContact O-N 3.02Å; K750-M752 VanDerWaalsContact C-N 3.31Å; K750-M752 PolarHBondContact O-N 2.93Å; M752-V754 VanDerWaalsContact C-N 3.28Å; M752-V754 PolarHBondContact O-N 3.45Å; M752-L755 PolarHBondContact O-N 3.3Å; M752-E756 PolarHBondContact O-N 2.91Å |
| 753 | N | 39.7 | Very low | 44.7 | Very low | 80 Ų | 80 | 116.3 Ų | 116.3 | 43% | 0.428 | 62% | 0.621 | S | S | . | * | H | α-helix | trans | -65.6 | -27.9 | 174.3 | -77.6 | -94.7 | 0 | 0 | 0 | 113 | E749 K750 Q757 | E749-N753 PolarHBondContact O-N 2.99Å; E749-N753 PolarHBondContact O-ND2 3.41Å; K750-N753 PolarHBondContact O-N 3.37Å; N753-Q757 WeakPolarHBondContact O-CG 3.39Å; N753-Q757 PolarHBondContact O-N 3.46Å |
| 754 | V | 44.1 | Very low | 45.2 | Very low | 92 Ų | 92 | 113.8 Ų | 113.8 | 56% | 0.558 | 61% | 0.609 | S | S | * | * | H | α-helix | trans | -67.3 | -41.1 | 173.9 | 172.4 | 0 | 0 | 0 | 0 | 110.9 | K750 D751 M752 E756 Q757 T758 | K750-V754 PolarHBondContact O-N 3.47Å; D751-V754 PolarHBondContact O-N 3.36Å; M752-V754 VanDerWaalsContact C-N 3.28Å; M752-V754 PolarHBondContact O-N 3.45Å; V754-E756 PolarHBondContact O-N 2.98Å; V754-Q757 PolarHBondContact O-N 3.05Å; V754-Q757 VanDerWaalsContact O-N 3.13Å; V754-T758 PolarHBondContact O-N 3.37Å |
| 755 | L | 40.4 | Very low | 46 | Very low | 130 Ų | 130 | 111.9 Ų | 111.9 | 68% | 0.681 | 60% | 0.596 | S | S | * | * | H | α-helix | trans | -66 | -34.4 | 178.1 | -73.8 | 164 | 0 | 0 | 0 | 113.1 | D751 M752 Q757 T758 | D751-L755 PolarHBondContact O-N 2.82Å; M752-L755 PolarHBondContact O-N 3.3Å; L755-Q757 PolarHBondContact O-N 2.9Å; L755-T758 PolarHBondContact O-OG1 3.11Å; L755-T758 VanDerWaalsContact O-OG1 3.1Å |
| 756 | E | 46.3 | Very low | 47 | Very low | 157 Ų | 157 | 110 Ų | 110 | 73% | 0.734 | 59% | 0.586 | S | S | * | * | H | α-helix | trans | -70.1 | -15 | 174.4 | -67 | -171.6 | 162.5 | 0 | 0 | 113.3 | M752 V754 | M752-E756 PolarHBondContact O-N 2.91Å; V754-E756 PolarHBondContact O-N 2.98Å |
| 757 | Q | 42.2 | Very low | 47.8 | Very low | 150 Ų | 150 | 109 Ų | 109 | 70% | 0.701 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -110.5 | -1.5 | -178.1 | -64.4 | -175.6 | 10.7 | 0 | 0 | 114.3 | N753 V754 L755 T759 | N753-Q757 WeakPolarHBondContact O-CG 3.39Å; N753-Q757 PolarHBondContact O-N 3.46Å; V754-Q757 PolarHBondContact O-N 3.05Å; V754-Q757 VanDerWaalsContact O-N 3.13Å; L755-Q757 PolarHBondContact O-N 2.9Å; Q757-T759 PolarHBondContact O-N 2.84Å |
| 758 | T | 53.8 | Low | 48.9 | Very low | 92 Ų | 92 | 108.8 Ų | 108.8 | 56% | 0.564 | 57% | 0.565 | S | S | * | * | trans | -70.3 | 97.1 | 175.3 | 48.6 | 0 | 0 | 0 | 0 | 111.7 | V754 L755 | V754-T758 PolarHBondContact O-N 3.37Å; L755-T758 PolarHBondContact O-OG1 3.11Å; L755-T758 VanDerWaalsContact O-OG1 3.1Å | ||
| 759 | T | 62.4 | Low | 49.9 | Very low | 82 Ų | 82 | 109.8 Ų | 109.8 | 50% | 0.503 | 57% | 0.569 | S | S | . | * | trans | -74.1 | 156.8 | 173.8 | 74.6 | 0 | 0 | 0 | 0 | 112 | Q757 A761 D762 L763 | Q757-T759 PolarHBondContact O-N 2.84Å; T759-A761 PolarHBondContact O-N 2.9Å; T759-A761 VanDerWaalsContact O-N 3.08Å; T759-D762 PolarHBondContact O-N 3.4Å; T759-L763 PolarHBondContact O-N 2.87Å | ||
| 760 | I | 51.1 | Low | 50.9 | Low | 133 Ų | 133 | 107.2 Ų | 107.2 | 68% | 0.682 | 56% | 0.563 | S | S | * | * | H | α-helix | trans | -56.4 | -28.6 | 179.6 | -63 | 171.8 | 0 | 0 | 0 | 112.1 | D762 L763 I764 | I760-D762 VanDerWaalsContact C-N 3.34Å; I760-D762 PolarHBondContact O-N 3.04Å; I760-L763 WeakPolarHBondContact O-CB 3.28Å; I760-L763 PolarHBondContact O-N 3.09Å; I760-I764 HydrophobicContact CG2-CD1 3.95Å; I760-I764 HydrophobicContact CG2-CG1 4.44Å; I760-I764 WeakPolarHBondContact O-CG1 3.35Å; I760-I764 PolarHBondContact O-N 2.82Å |
| 761 | A | 49.3 | Very low | 51.3 | Low | 47 Ų | 47 | 105.8 Ų | 105.8 | 39% | 0.388 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -62.4 | -37.1 | 177.5 | 0 | 0 | 0 | 0 | 0 | 113.1 | T759 I764 R765 | T759-A761 PolarHBondContact O-N 2.9Å; T759-A761 VanDerWaalsContact O-N 3.08Å; A761-I764 PolarHBondContact O-N 3.3Å; A761-R765 WeakPolarHBondContact O-CG 3.45Å; A761-R765 PolarHBondContact O-N 2.82Å |
| 762 | D | 46.1 | Very low | 52.3 | Low | 73 Ų | 73 | 104.5 Ų | 104.5 | 39% | 0.39 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -80.6 | -27.5 | 178.9 | -69.5 | -53.8 | 0 | 0 | 0 | 112.6 | T759 I760 I764 R765 A766 | T759-D762 PolarHBondContact O-N 3.4Å; I760-D762 VanDerWaalsContact C-N 3.34Å; I760-D762 PolarHBondContact O-N 3.04Å; D762-I764 VanDerWaalsContact C-N 3.33Å; D762-R765 PolarHBondContact O-N 2.98Å; D762-R765 WeakPolarHBondContact OD1-CD 3.2Å; D762-R765 IonicContact OD1-CZ 2.7Å; D762-R765 IonicContact OD1-NE 2.77Å; D762-R765 IonicContact OD1-NH1 1.99Å; D762-R765 PolarHBondContact OD1-NH1 3.45Å; D762-R765 IonicContact OD2-NH1 2.98Å; D762-A766 WeakPolarHBondContact O-CB 3.48Å; D762-A766 PolarHBondContact O-N 3.43Å |
| 763 | L | 58.7 | Low | 52.3 | Low | 113 Ų | 113 | 104.3 Ų | 104.3 | 59% | 0.592 | 55% | 0.552 | S | S | * | * | H | α-helix | trans | -61.4 | -42.7 | 166.8 | -170.3 | 78.6 | 0 | 0 | 0 | 111.2 | T759 I760 A766 L767 | T759-L763 PolarHBondContact O-N 2.87Å; I760-L763 WeakPolarHBondContact O-CB 3.28Å; I760-L763 PolarHBondContact O-N 3.09Å; L763-A766 PolarHBondContact O-N 3.5Å; L763-L767 HydrophobicContact CG-CD1 4.43Å; L763-L767 PolarHBondContact O-N 2.9Å |
| 764 | I | 55.1 | Low | 53.3 | Low | 100 Ų | 100 | 103.2 Ų | 103.2 | 51% | 0.513 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -65.2 | -45.8 | 177.3 | -68.8 | 166.7 | 0 | 0 | 0 | 110.7 | I760 A761 D762 A766 L767 E768 | I760-I764 HydrophobicContact CG2-CD1 3.95Å; I760-I764 HydrophobicContact CG2-CG1 4.44Å; I760-I764 WeakPolarHBondContact O-CG1 3.35Å; I760-I764 PolarHBondContact O-N 2.82Å; A761-I764 PolarHBondContact O-N 3.3Å; D762-I764 VanDerWaalsContact C-N 3.33Å; I764-A766 VanDerWaalsContact C-N 3.34Å; I764-A766 PolarHBondContact O-N 3.31Å; I764-L767 PolarHBondContact O-N 3.39Å; I764-E768 WeakPolarHBondContact O-CB 3.28Å; I764-E768 PolarHBondContact O-N 2.78Å |
| 765 | R | 53.8 | Low | 54.4 | Low | 148 Ų | 148 | 101.8 Ų | 101.8 | 56% | 0.558 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -59.8 | -41.1 | 174 | -70.8 | 168.8 | -177.1 | 154.8 | -0.1 | 112.3 | A761 D762 E768 V769 | A761-R765 WeakPolarHBondContact O-CG 3.45Å; A761-R765 PolarHBondContact O-N 2.82Å; D762-R765 PolarHBondContact O-N 2.98Å; D762-R765 WeakPolarHBondContact OD1-CD 3.2Å; D762-R765 IonicContact OD1-CZ 2.7Å; D762-R765 IonicContact OD1-NE 2.77Å; D762-R765 IonicContact OD1-NH1 1.99Å; D762-R765 PolarHBondContact OD1-NH1 3.45Å; D762-R765 IonicContact OD2-NH1 2.98Å; R765-E768 PolarHBondContact O-N 2.85Å; R765-V769 WeakPolarHBondContact O-CG2 3.43Å; R765-V769 PolarHBondContact O-N 2.97Å |
| 766 | A | 56.7 | Low | 55.1 | Low | 53 Ų | 53 | 99.9 Ų | 99.9 | 44% | 0.438 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -63.7 | -41.7 | 177.3 | 0 | 0 | 0 | 0 | 0 | 111.9 | D762 L763 I764 V769 V770 | D762-A766 WeakPolarHBondContact O-CB 3.48Å; D762-A766 PolarHBondContact O-N 3.43Å; L763-A766 PolarHBondContact O-N 3.5Å; I764-A766 VanDerWaalsContact C-N 3.34Å; I764-A766 PolarHBondContact O-N 3.31Å; A766-V769 PolarHBondContact O-N 3Å; A766-V770 WeakPolarHBondContact O-CG2 3.45Å; A766-V770 PolarHBondContact O-N 2.76Å |
| 767 | L | 50.6 | Low | 55.6 | Low | 113 Ų | 113 | 96.9 Ų | 96.9 | 59% | 0.592 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -64.6 | -40 | 174 | -78.9 | 163 | 0 | 0 | 0 | 112.4 | L763 I764 V770 H771 | L763-L767 HydrophobicContact CG-CD1 4.43Å; L763-L767 PolarHBondContact O-N 2.9Å; I764-L767 PolarHBondContact O-N 3.39Å; L767-V770 PolarHBondContact O-N 3.25Å; L767-H771 WeakPolarHBondContact O-CB 3.38Å; L767-H771 PolarHBondContact O-N 3.08Å |
| 768 | E | 58.4 | Low | 56.6 | Low | 130 Ų | 130 | 96.5 Ų | 96.5 | 61% | 0.607 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -64.5 | -40.5 | 175.5 | -170 | 177.8 | -159.6 | 0 | 0 | 112.1 | I764 R765 H771 T772 | I764-E768 WeakPolarHBondContact O-CB 3.28Å; I764-E768 PolarHBondContact O-N 2.78Å; R765-E768 PolarHBondContact O-N 2.85Å; E768-H771 PolarHBondContact O-N 3.24Å; E768-T772 WeakPolarHBondContact O-CB 3.44Å; E768-T772 WeakPolarHBondContact O-CG2 3.37Å; E768-T772 PolarHBondContact O-N 3.26Å; E768-T772 PolarHBondContact O-OG1 2.87Å |
| 769 | V | 63.2 | Low | 56.3 | Low | 80 Ų | 80 | 98.2 Ų | 98.2 | 49% | 0.485 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -67 | -43.1 | 174.9 | 170.8 | 0 | 0 | 0 | 0 | 111.9 | R765 A766 T772 H773 | R765-V769 WeakPolarHBondContact O-CG2 3.43Å; R765-V769 PolarHBondContact O-N 2.97Å; A766-V769 PolarHBondContact O-N 3Å; V769-T772 WeakPolarHBondContact CA-OG1 3.32Å; V769-T772 PolarHBondContact O-N 3.19Å; V769-T772 PolarHBondContact O-OG1 3.31Å; V769-T772 VanDerWaalsContact O-OG1 3.08Å; V769-H773 PolarHBondContact O-CD2 3.23Å; V769-H773 PolarHBondContact O-N 3.38Å |
| 770 | V | 63.8 | Low | 55.5 | Low | 100 Ų | 100 | 101 Ų | 101 | 61% | 0.606 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -64.4 | -41.1 | 175.7 | 169.3 | 0 | 0 | 0 | 0 | 111.4 | A766 L767 A774 | A766-V770 WeakPolarHBondContact O-CG2 3.45Å; A766-V770 PolarHBondContact O-N 2.76Å; L767-V770 PolarHBondContact O-N 3.25Å; V770-A774 PolarHBondContact O-N 3.23Å; V770-A774 VanDerWaalsContact O-N 3.13Å |
| 771 | H | 50.7 | Low | 55.4 | Low | 133 Ų | 133 | 101.5 Ų | 101.5 | 62% | 0.616 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -68.5 | -36.2 | 178.1 | -167 | -56.3 | 0 | 0 | 0 | 112.4 | L767 E768 V775 | L767-H771 WeakPolarHBondContact O-CB 3.38Å; L767-H771 PolarHBondContact O-N 3.08Å; E768-H771 PolarHBondContact O-N 3.24Å; H771-V775 WeakPolarHBondContact O-CG2 3.47Å; H771-V775 PolarHBondContact O-N 3.48Å |
| 772 | T | 62.5 | Low | 55.1 | Low | 71 Ų | 71 | 102.5 Ų | 102.5 | 44% | 0.436 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -72.3 | -36.1 | 177 | 44.2 | 0 | 0 | 0 | 0 | 112.6 | E768 V769 V775 L776 | E768-T772 WeakPolarHBondContact O-CB 3.44Å; E768-T772 WeakPolarHBondContact O-CG2 3.37Å; E768-T772 PolarHBondContact O-N 3.26Å; E768-T772 PolarHBondContact O-OG1 2.87Å; V769-T772 WeakPolarHBondContact CA-OG1 3.32Å; V769-T772 PolarHBondContact O-N 3.19Å; V769-T772 PolarHBondContact O-OG1 3.31Å; V769-T772 VanDerWaalsContact O-OG1 3.08Å; T772-V775 PolarHBondContact O-N 3.47Å; T772-L776 WeakPolarHBondContact O-CG 3.5Å; T772-L776 PolarHBondContact O-N 3.16Å; T772-L776 VanDerWaalsContact O-N 3.12Å |
| 773 | H | 49.2 | Very low | 54.9 | Low | 113 Ų | 113 | 102.5 Ų | 102.5 | 52% | 0.523 | 55% | 0.55 | S | S | . | . | H | α-helix | trans | -62.3 | -46 | 171.4 | -94.3 | -84.3 | 0 | 0 | 0 | 112.8 | V769 V775 L776 D777 | V769-H773 PolarHBondContact O-CD2 3.23Å; V769-H773 PolarHBondContact O-N 3.38Å; H773-V775 VanDerWaalsContact C-N 3.29Å; H773-V775 PolarHBondContact O-N 3.15Å; H773-L776 PolarHBondContact O-N 3.36Å; H773-L776 VanDerWaalsContact O-N 3.13Å; H773-D777 PolarHBondContact O-N 3.04Å |
| 774 | A | 61.9 | Low | 54.1 | Low | 58 Ų | 58 | 100.9 Ų | 100.9 | 48% | 0.479 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -59.5 | -38.6 | 179.2 | 0 | 0 | 0 | 0 | 0 | 113 | V770 E778 | V770-A774 PolarHBondContact O-N 3.23Å; V770-A774 VanDerWaalsContact O-N 3.13Å; A774-E778 PolarHBondContact O-N 2.84Å |
| 775 | V | 66 | Low | 53.6 | Low | 62 Ų | 62 | 100.2 Ų | 100.2 | 38% | 0.376 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -71.1 | -34.3 | 177 | 171.7 | 0 | 0 | 0 | 0 | 112.1 | H771 T772 H773 Q779 | H771-V775 WeakPolarHBondContact O-CG2 3.47Å; H771-V775 PolarHBondContact O-N 3.48Å; T772-V775 PolarHBondContact O-N 3.47Å; H773-V775 VanDerWaalsContact C-N 3.29Å; H773-V775 PolarHBondContact O-N 3.15Å; V775-Q779 PolarHBondContact O-N 2.86Å; V775-Q779 VanDerWaalsContact O-N 3.08Å |
| 776 | L | 56 | Low | 52.9 | Low | 89 Ų | 89 | 96.2 Ų | 96.2 | 47% | 0.466 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -68.5 | -44.1 | 175.9 | -75.1 | 167.9 | 0 | 0 | 0 | 111.9 | T772 H773 E778 Q779 Q780 | T772-L776 WeakPolarHBondContact O-CG 3.5Å; T772-L776 PolarHBondContact O-N 3.16Å; T772-L776 VanDerWaalsContact O-N 3.12Å; H773-L776 PolarHBondContact O-N 3.36Å; H773-L776 VanDerWaalsContact O-N 3.13Å; L776-E778 VanDerWaalsContact C-N 3.3Å; L776-E778 PolarHBondContact O-N 3.36Å; L776-Q779 PolarHBondContact O-N 2.98Å; L776-Q780 WeakPolarHBondContact O-CB 3.47Å; L776-Q780 PolarHBondContact O-N 3.43Å |
| 777 | D | 56.8 | Low | 51.9 | Low | 94 Ų | 94 | 97.2 Ų | 97.2 | 50% | 0.503 | 58% | 0.583 | S | S | . | * | H | α-helix | trans | -61 | -38.6 | 176.1 | -76.1 | -26.5 | 0 | 0 | 0 | 111.9 | H773 Q780 Q781 | H773-D777 PolarHBondContact O-N 3.04Å; D777-Q780 PolarHBondContact O-N 3.02Å; D777-Q781 VanDerWaalsContact O-CG 3.31Å; D777-Q781 WeakPolarHBondContact O-CG 3.29Å; D777-Q781 PolarHBondContact O-N 3.34Å |
| 778 | E | 63.1 | Low | 51.3 | Low | 142 Ų | 142 | 96.4 Ų | 96.4 | 66% | 0.664 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -66.8 | -39.4 | 176.1 | -165.6 | 171.8 | -145.9 | 0 | 0 | 111.9 | A774 L776 A782 | A774-E778 PolarHBondContact O-N 2.84Å; L776-E778 VanDerWaalsContact C-N 3.3Å; L776-E778 PolarHBondContact O-N 3.36Å; E778-A782 WeakPolarHBondContact O-CB 3.46Å; E778-A782 PolarHBondContact O-N 3.25Å |
| 779 | Q | 47.9 | Very low | 50.2 | Low | 129 Ų | 129 | 95 Ų | 95 | 60% | 0.603 | 60% | 0.603 | S | S | * | * | H | α-helix | trans | -66.3 | -39.2 | 171.4 | -75.7 | -167.3 | -33.6 | 0 | 0 | 112.9 | V775 L776 Q781 A782 A783 | V775-Q779 PolarHBondContact O-N 2.86Å; V775-Q779 VanDerWaalsContact O-N 3.08Å; L776-Q779 PolarHBondContact O-N 2.98Å; Q779-Q781 VanDerWaalsContact C-N 3.34Å; Q779-Q781 PolarHBondContact O-N 2.81Å; Q779-A782 PolarHBondContact O-N 3.29Å; Q779-A783 PolarHBondContact O-N 3.2Å |
| 780 | Q | 45.5 | Very low | 48.6 | Very low | 141 Ų | 141 | 95.4 Ų | 95.4 | 66% | 0.659 | 62% | 0.623 | S | S | * | * | H | α-helix | trans | -65.1 | -39.4 | 179.7 | -154.3 | 108.2 | -9 | 0 | 0 | 111.1 | L776 D777 A783 A784 | L776-Q780 WeakPolarHBondContact O-CB 3.47Å; L776-Q780 PolarHBondContact O-N 3.43Å; D777-Q780 PolarHBondContact O-N 3.02Å; Q780-A783 PolarHBondContact O-N 3.38Å; Q780-A784 PolarHBondContact O-N 3.17Å; Q780-A784 VanDerWaalsContact O-N 3.13Å |
| 781 | Q | 47.6 | Very low | 47 | Very low | 142 Ų | 142 | 94.6 Ų | 94.6 | 66% | 0.664 | 64% | 0.635 | S | S | * | * | H | α-helix | trans | -69.8 | -38.1 | 174.7 | -69.9 | 174 | 29.1 | 0 | 0 | 112.3 | D777 Q779 A784 A785 | D777-Q781 VanDerWaalsContact O-CG 3.31Å; D777-Q781 WeakPolarHBondContact O-CG 3.29Å; D777-Q781 PolarHBondContact O-N 3.34Å; Q779-Q781 VanDerWaalsContact C-N 3.34Å; Q779-Q781 PolarHBondContact O-N 2.81Å; Q781-A784 PolarHBondContact O-N 3.06Å; Q781-A785 PolarHBondContact O-N 3.4Å |
| 782 | A | 43.9 | Very low | 45.9 | Very low | 69 Ų | 69 | 92.4 Ų | 92.4 | 57% | 0.57 | 65% | 0.649 | S | S | * | * | H | α-helix | trans | -63.5 | -39.8 | 173.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | E778 Q779 A785 G786 | E778-A782 WeakPolarHBondContact O-CB 3.46Å; E778-A782 PolarHBondContact O-N 3.25Å; Q779-A782 PolarHBondContact O-N 3.29Å; A782-A785 PolarHBondContact O-N 3.46Å; A782-G786 PolarHBondContact O-N 3.34Å |
| 783 | A | 42.2 | Very low | 44.3 | Very low | 72 Ų | 72 | 92.5 Ų | 92.5 | 60% | 0.595 | 66% | 0.663 | S | S | * | * | H | α-helix | trans | -64.6 | -41.4 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | Q779 Q780 A785 G786 | Q779-A783 PolarHBondContact O-N 3.2Å; Q780-A783 PolarHBondContact O-N 3.38Å; A783-A785 VanDerWaalsContact C-N 3.28Å; A783-A785 PolarHBondContact O-N 3.2Å; A783-G786 PolarHBondContact O-N 3.27Å; A783-G786 VanDerWaalsContact O-N 3.14Å |
| 784 | A | 42.1 | Very low | 43.4 | Very low | 80 Ų | 80 | 95.4 Ų | 95.4 | 66% | 0.661 | 68% | 0.681 | S | S | * | * | H | α-helix | trans | -61.5 | -33.5 | 177.1 | 0 | 0 | 0 | 0 | 0 | 113.1 | Q780 Q781 G786 | Q780-A784 PolarHBondContact O-N 3.17Å; Q780-A784 VanDerWaalsContact O-N 3.13Å; Q781-A784 PolarHBondContact O-N 3.06Å; A784-G786 VanDerWaalsContact C-N 3.34Å |
| 785 | A | 43.6 | Very low | 41.8 | Very low | 85 Ų | 85 | 98.5 Ų | 98.5 | 70% | 0.702 | 70% | 0.699 | S | S | * | * | H | α-helix | trans | -73.6 | -21.9 | 176.6 | 0 | 0 | 0 | 0 | 0 | 113.9 | Q781 A782 A783 | Q781-A785 PolarHBondContact O-N 3.4Å; A782-A785 PolarHBondContact O-N 3.46Å; A783-A785 VanDerWaalsContact C-N 3.28Å; A783-A785 PolarHBondContact O-N 3.2Å |
| 786 | G | 38.7 | Very low | 40.1 | Very low | 65 Ų | 65 | 107.8 Ų | 107.8 | 67% | 0.67 | 73% | 0.727 | S | S | * | * | H | α-helix | trans | -82.9 | -17.1 | -177.7 | 0 | 0 | 0 | 0 | 0 | 115.4 | A782 A783 A784 A788 | A782-G786 PolarHBondContact O-N 3.34Å; A783-G786 PolarHBondContact O-N 3.27Å; A783-G786 VanDerWaalsContact O-N 3.14Å; A784-G786 VanDerWaalsContact C-N 3.34Å; G786-A788 PolarHBondContact O-N 3.02Å |
| 787 | G | 35.7 | Very low | 38.8 | Very low | 74 Ų | 74 | 107.5 Ų | 107.5 | 76% | 0.763 | 75% | 0.745 | S | S | * | * | S | Bend | trans | -80.4 | -2.8 | -170 | 0 | 0 | 0 | 0 | 0 | 116.8 | ||
| 788 | A | 37.4 | Very low | 37.7 | Very low | 96 Ų | 96 | 108.8 Ų | 108.8 | 79% | 0.793 | 76% | 0.762 | S | S | * | * | S | Bend | trans | -115 | 36 | -162.5 | 0 | 0 | 0 | 0 | 0 | 115.3 | G786 | G786-A788 PolarHBondContact O-N 3.02Š|
| 789 | A | 37.3 | Very low | 36.1 | Very low | 101 Ų | 101 | 114 Ų | 114 | 84% | 0.835 | 78% | 0.775 | S | S | * | * | trans | -149.3 | 88.2 | 176.9 | 0 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 790 | G | 28.9 | Very low | 35.5 | Very low | 88 Ų | 88 | 117.8 Ų | 117.8 | 91% | 0.907 | 79% | 0.79 | S | S | * | * | trans | -173.7 | 92 | 176 | 0 | 0 | 0 | 0 | 0 | 116.5 | ||||
| 791 | G | 29.1 | Very low | 34.8 | Very low | 83 Ų | 83 | 120.2 Ų | 120.2 | 86% | 0.856 | 80% | 0.802 | S | S | * | * | trans | 125.7 | 143.8 | 157.7 | 0 | 0 | 0 | 0 | 0 | 117.3 | ||||
| 792 | G | 28.9 | Very low | 33.9 | Very low | 87 Ų | 87 | 125.2 Ų | 125.2 | 90% | 0.897 | 81% | 0.814 | S | S | * | * | trans | 92.1 | 107.3 | 164.4 | 0 | 0 | 0 | 0 | 0 | 115.9 | ||||
| 793 | G | 27.8 | Very low | 33.3 | Very low | 72 Ų | 72 | 132 Ų | 132 | 74% | 0.742 | 83% | 0.831 | S | S | * | * | trans | -121.3 | -178 | -176 | 0 | 0 | 0 | 0 | 0 | 116.2 | ||||
| 794 | I | 30.2 | Very low | 32.9 | Very low | 175 Ų | 175 | 137.5 Ų | 137.5 | 90% | 0.897 | 85% | 0.847 | S | S | * | * | trans | 72.6 | 107.6 | 163 | -48.9 | 175.7 | 0 | 0 | 0 | 117.6 | ||||
| 795 | S | 28.2 | Very low | 32.6 | Very low | 122 Ų | 122 | 137.3 Ų | 137.3 | 85% | 0.853 | 85% | 0.852 | S | S | * | * | -167 | 164.2 | 125.7 | 49.8 | 0 | 0 | 0 | 0 | 111.6 | |||||
| 796 | R | 31.1 | Very low | 32.1 | Very low | 258 Ų | 258 | 141.1 Ų | 141.1 | 97% | 0.974 | 86% | 0.861 | S | S | * | * | trans | -87 | 141.2 | 179.1 | -76 | 172.1 | 163.2 | 168.1 | -7.1 | 111.1 | ||||
| 797 | G | 28 | Very low | 32 | Very low | 82 Ų | 82 | 142.6 Ų | 142.6 | 85% | 0.845 | 87% | 0.867 | S | S | * | * | trans | -168.8 | 122.4 | 164.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 798 | S | 34 | Very low | 31.8 | Very low | 122 Ų | 122 | 142.6 Ų | 142.6 | 85% | 0.853 | 87% | 0.867 | S | S | * | * | trans | -99.9 | 128 | 179.5 | 54.4 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 799 | R | 29.3 | Very low | 31.7 | Very low | 250 Ų | 250 | 146.1 Ų | 146.1 | 94% | 0.943 | 87% | 0.871 | S | S | * | * | trans | -153.9 | 127.1 | 156.1 | -118.4 | 170.1 | -174 | 173.9 | 2 | 111.5 | ||||
| 800 | K | 35.7 | Very low | 31.7 | Very low | 209 Ų | 209 | 148.6 Ų | 148.6 | 91% | 0.909 | 87% | 0.865 | S | S | * | * | trans | -75.4 | 133.9 | 165.2 | -64.7 | 175.4 | 179.7 | 175.3 | 0 | 107.9 | ||||
| 801 | Q | 31 | Very low | 32.2 | Very low | 193 Ų | 193 | 149.2 Ų | 149.2 | 90% | 0.902 | 85% | 0.854 | S | S | * | * | trans | -126.6 | 151.3 | 156.6 | -103.9 | -172.1 | -11.7 | 0 | 0 | 110.5 | ||||
| 802 | R | 29 | Very low | 32.5 | Very low | 247 Ų | 247 | 151 Ų | 151 | 93% | 0.932 | 85% | 0.85 | S | S | * | * | trans | -78.3 | 129.8 | -168.4 | -68.8 | 171.8 | 169.8 | 162.3 | -6.2 | 110.2 | M804 | R802-M804 PolarHBondContact O-N 3.14Å; R802-M804 VanDerWaalsContact O-N 3.08Å | ||
| 803 | K | 31.6 | Very low | 33 | Very low | 212 Ų | 212 | 153.5 Ų | 153.5 | 92% | 0.922 | 84% | 0.838 | S | S | * | * | trans | -79.2 | 89.9 | 172.9 | -166.5 | 173.8 | -173.6 | 177.9 | 0 | 109.4 | ||||
| 804 | M | 32.4 | Very low | 33.4 | Very low | 187 Ų | 187 | 157.7 Ų | 157.7 | 92% | 0.921 | 84% | 0.843 | S | S | * | * | trans | -66.5 | 130.4 | 172.2 | -145.1 | 162.5 | -172.6 | 0 | 0 | 108.6 | R802 | R802-M804 PolarHBondContact O-N 3.14Å; R802-M804 VanDerWaalsContact O-N 3.08Å | ||
| 805 | G | 36.6 | Very low | 33.9 | Very low | 76 Ų | 76 | 153.8 Ų | 153.8 | 78% | 0.784 | 83% | 0.829 | S | S | * | * | trans | -75.4 | 140.3 | -177.5 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 806 | N | 32.1 | Very low | 34.9 | Very low | 164 Ų | 164 | 150.1 Ų | 150.1 | 88% | 0.877 | 80% | 0.803 | S | S | * | * | trans | -131.8 | 102.8 | 168.8 | -159.5 | 5.5 | 0 | 0 | 0 | 109 | G808 | N806-G808 PolarHBondContact O-N 2.85Š| ||
| 807 | A | 38.4 | Very low | 35.7 | Very low | 97 Ų | 97 | 140.4 Ų | 140.4 | 80% | 0.802 | 77% | 0.769 | S | S | * | * | trans | -93.2 | 89.1 | -177.5 | 0 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 808 | G | 30.6 | Very low | 36.4 | Very low | 73 Ų | 73 | 138.8 Ų | 138.8 | 75% | 0.753 | 74% | 0.741 | S | S | * | * | P | Polyproline II helix | trans | -78.7 | 126.9 | 170.5 | 0 | 0 | 0 | 0 | 0 | 111 | N806 E810 | N806-G808 PolarHBondContact O-N 2.85Å; G808-E810 PolarHBondContact O-N 3.48Å |
| 809 | L | 36 | Very low | 37 | Very low | 171 Ų | 171 | 135.6 Ų | 135.6 | 90% | 0.895 | 72% | 0.719 | S | S | * | * | P | Polyproline II helix | trans | -76.1 | 116.1 | -178.4 | -70.5 | 137.3 | 0 | 0 | 0 | 111.5 | ||
| 810 | E | 36 | Very low | 37.7 | Very low | 152 Ų | 152 | 129.8 Ų | 129.8 | 71% | 0.71 | 71% | 0.706 | S | S | * | * | P | Polyproline II helix | trans | -73.9 | 134.3 | 158 | -135.8 | -164.6 | 158.1 | 0 | 0 | 108.5 | G808 | G808-E810 PolarHBondContact O-N 3.48Š|
| 811 | P | 39.4 | Very low | 38.3 | Very low | 102 Ų | 102 | 126.6 Ų | 126.6 | 66% | 0.662 | 69% | 0.692 | S | S | * | * | P | Polyproline II helix | trans | -68.4 | 142.1 | 172.1 | 28.5 | -34.4 | 0 | 0 | 0 | 110.5 | Q813 | P811-Q813 PolarHBondContact O-N 2.88Š|
| 812 | P | 36.5 | Very low | 38.8 | Very low | 121 Ų | 121 | 120.2 Ų | 120.2 | 79% | 0.786 | 67% | 0.673 | S | S | * | * | P | Polyproline II helix | trans | -63.9 | 126 | -176.4 | 25.2 | -34 | 0 | 0 | 0 | 111.7 | L814 | P812-L814 PolarHBondContact O-N 3.42Š|
| 813 | Q | 39.8 | Very low | 39.3 | Very low | 138 Ų | 138 | 111.2 Ų | 111.2 | 65% | 0.645 | 66% | 0.656 | S | S | * | * | trans | -66.4 | 104.8 | 178.5 | -65.3 | -174.4 | 18.4 | 0 | 0 | 110.8 | P811 | P811-Q813 PolarHBondContact O-N 2.88Š| ||
| 814 | L | 34.7 | Very low | 39.7 | Very low | 160 Ų | 160 | 106.3 Ų | 106.3 | 84% | 0.838 | 64% | 0.64 | S | S | * | * | P | Polyproline II helix | trans | -65 | 140.9 | 171.1 | -68.6 | 172.1 | 0 | 0 | 0 | 110.6 | P812 | P812-L814 PolarHBondContact O-N 3.42Š|
| 815 | P | 42.1 | Very low | 40.2 | Very low | 94 Ų | 94 | 105.6 Ų | 105.6 | 61% | 0.61 | 64% | 0.635 | S | S | * | * | P | Polyproline II helix | trans | -69.9 | 150.8 | -179.4 | 29.1 | -35.1 | 0 | 0 | 0 | 112.2 | ||
| 816 | P | 47.7 | Very low | 40.7 | Very low | 45 Ų | 45 | 106.1 Ų | 106.1 | 29% | 0.292 | 62% | 0.623 | S | S | . | * | P | Polyproline II helix | trans | -66.9 | 150.4 | -179.6 | 28.5 | -35 | 0 | 0 | 0 | 112.3 | A274 L818 S819 | A274-P816 HydrophobicContact CB-CB 4.29Å; P816-L818 PolarHBondContact O-N 3.1Å; P816-S819 PolarHBondContact O-N 3.01Å; P816-S819 PolarHBondContact O-OG 3.33Å |
| 817 | I | 47.8 | Very low | 41.2 | Very low | 53 Ų | 53 | 106.5 Ų | 106.5 | 27% | 0.272 | 61% | 0.612 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -56.1 | -25.1 | -165.4 | -60.3 | 149.5 | 0 | 0 | 0 | 114.2 | ||
| 818 | L | 44.5 | Very low | 41.3 | Very low | 48 Ų | 48 | 106.8 Ų | 106.8 | 25% | 0.251 | 60% | 0.604 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -96.2 | 2.2 | -176 | -65.4 | 173 | 0 | 0 | 0 | 114.7 | M1 L268 Q269 P816 L820 F821 | M1-L818 HydrophobicContact CE-CD2 4.09Å; L268-L818 HydrophobicContact CB-CD1 3.83Å; Q269-L818 HydrophobicContact CG-CB 3.83Å; Q269-L818 PolarHBondContact NE2-O 3.44Å; P816-L818 PolarHBondContact O-N 3.1Å; L818-L820 PolarHBondContact O-N 3.06Å; L818-F821 HydrophobicContact CD2-CD2 4.36Å; L818-F821 HydrophobicContact CD2-CE2 4.1Å |
| 819 | S | 46.1 | Very low | 41.9 | Very low | 55 Ų | 55 | 109.3 Ų | 109.3 | 39% | 0.385 | 60% | 0.599 | S | S | . | * | G | 310 helix | trans | -70 | -8.5 | 173.1 | 72.4 | 0 | 0 | 0 | 0 | 113.5 | P816 F821 | P816-S819 PolarHBondContact O-N 3.01Å; P816-S819 PolarHBondContact O-OG 3.33Å; S819-F821 PolarHBondContact O-N 2.79Å |
| 820 | L | 42.6 | Very low | 42.3 | Very low | 128 Ų | 128 | 108.2 Ų | 108.2 | 67% | 0.67 | 59% | 0.59 | S | S | * | * | G | 310 helix | trans | -78.6 | 2.5 | -177.8 | -109.2 | 169.5 | 0 | 0 | 0 | 114.9 | L818 | L818-L820 PolarHBondContact O-N 3.06Š|
| 821 | F | 48.3 | Very low | 42.5 | Very low | 142 Ų | 142 | 104.1 Ų | 104.1 | 62% | 0.623 | 58% | 0.581 | S | S | * | * | G | 310 helix | trans | -109.7 | 7.5 | 177.7 | -64.1 | -75.6 | 0 | 0 | 0 | 113.6 | M1 L818 S819 | M1-F821 HydrophobicContact CE-CE2 4.18Å; M1-F821 HydrophobicContact CE-CZ 4.42Å; M1-F821 HydrophobicContact SD-CZ 4.4Å; L818-F821 HydrophobicContact CD2-CD2 4.36Å; L818-F821 HydrophobicContact CD2-CE2 4.1Å; S819-F821 PolarHBondContact O-N 2.79Å |
| 822 | A | 42.3 | Very low | 42.4 | Very low | 60 Ų | 60 | 102.2 Ų | 102.2 | 50% | 0.496 | 57% | 0.574 | S | S | . | * | S | Bend | trans | -99.1 | 122.1 | 174.1 | 0 | 0 | 0 | 0 | 0 | 110.4 | ||
| 823 | G | 40.5 | Very low | 42.5 | Very low | 57 Ų | 57 | 99.3 Ų | 99.3 | 59% | 0.588 | 56% | 0.56 | S | S | * | * | trans | -66.1 | 149.3 | 179.4 | 0 | 0 | 0 | 0 | 0 | 113.8 | Q825 T826 | G823-Q825 PolarHBondContact O-N 3.15Å; G823-T826 PolarHBondContact O-OG1 3.34Å | ||
| 824 | D | 39.1 | Very low | 42.5 | Very low | 110 Ų | 110 | 96.1 Ų | 96.1 | 59% | 0.588 | 56% | 0.558 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -63.6 | -11.2 | -167.8 | -103.7 | -40.4 | 0 | 0 | 0 | 115.8 | T826 R827 | D824-T826 PolarHBondContact O-N 3.2Å; D824-R827 PolarHBondContact O-N 3.17Å; D824-R827 VanDerWaalsContact O-N 3.15Å; D824-R827 WeakPolarHBondContact OD1-CD 3.33Å; D824-R827 IonicContact OD1-CZ 3.24Å; D824-R827 IonicContact OD1-NE 3.05Å; D824-R827 IonicContact OD1-NH1 2.93Å; D824-R827 PolarHBondContact OD1-NH1 2.91Å |
| 825 | Q | 43.6 | Very low | 42.5 | Very low | 172 Ų | 172 | 95.7 Ų | 95.7 | 80% | 0.804 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -59.5 | -17.7 | 179.5 | -67.6 | -166.6 | -0.3 | 0 | 0 | 114.2 | G823 T828 | G823-Q825 PolarHBondContact O-N 3.15Å; Q825-T828 PolarHBondContact O-OG1 3.06Å |
| 826 | T | 45.9 | Very low | 42.4 | Very low | 86 Ų | 86 | 101.4 Ų | 101.4 | 53% | 0.528 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -78.7 | -26.2 | 178.7 | 53.3 | 0 | 0 | 0 | 0 | 114 | G823 D824 Q830 | G823-T826 PolarHBondContact O-OG1 3.34Å; D824-T826 PolarHBondContact O-N 3.2Å; T826-Q830 PolarHBondContact O-N 3.23Å |
| 827 | R | 43.6 | Very low | 41.8 | Very low | 173 Ų | 173 | 106.5 Ų | 106.5 | 65% | 0.653 | 59% | 0.59 | S | S | * | * | H | α-helix | trans | -70.2 | -39.4 | -176.3 | -91.4 | 162.7 | 153.7 | 174.3 | -5.7 | 113.4 | D824 L829 Q830 A831 | D824-R827 PolarHBondContact O-N 3.17Å; D824-R827 VanDerWaalsContact O-N 3.15Å; D824-R827 WeakPolarHBondContact OD1-CD 3.33Å; D824-R827 IonicContact OD1-CZ 3.24Å; D824-R827 IonicContact OD1-NE 3.05Å; D824-R827 IonicContact OD1-NH1 2.93Å; D824-R827 PolarHBondContact OD1-NH1 2.91Å; R827-L829 VanDerWaalsContact C-N 3.33Å; R827-L829 PolarHBondContact O-N 3.03Å; R827-Q830 PolarHBondContact O-N 3.32Å; R827-A831 PolarHBondContact O-N 3.44Å |
| 828 | T | 40.8 | Very low | 41.4 | Very low | 102 Ų | 102 | 115.4 Ų | 115.4 | 63% | 0.626 | 62% | 0.622 | S | S | * | * | H | α-helix | trans | -65.7 | -36.8 | 179.6 | 53.6 | 0 | 0 | 0 | 0 | 111.9 | Q825 A832 | Q825-T828 PolarHBondContact O-OG1 3.06Å; T828-A832 PolarHBondContact O-N 3.06Å |
| 829 | L | 42.5 | Very low | 40.8 | Very low | 127 Ų | 127 | 117.1 Ų | 117.1 | 67% | 0.665 | 64% | 0.643 | S | S | * | * | H | α-helix | trans | -69.7 | -37.9 | 176.8 | -71.1 | 172.3 | 0 | 0 | 0 | 112.9 | R827 A832 A833 | R827-L829 VanDerWaalsContact C-N 3.33Å; R827-L829 PolarHBondContact O-N 3.03Å; L829-A832 PolarHBondContact O-N 2.95Å; L829-A833 PolarHBondContact O-N 3.49Å; L829-A833 VanDerWaalsContact O-N 3.1Å |
| 830 | Q | 44.5 | Very low | 40 | Very low | 148 Ų | 148 | 126 Ų | 126 | 69% | 0.692 | 67% | 0.668 | S | S | * | * | H | α-helix | trans | -68.2 | -38.2 | 175.7 | -85.3 | -173.5 | -31.9 | 0 | 0 | 112.8 | T826 R827 A832 A833 A834 | T826-Q830 PolarHBondContact O-N 3.23Å; R827-Q830 PolarHBondContact O-N 3.32Å; Q830-A832 VanDerWaalsContact C-N 3.32Å; Q830-A832 PolarHBondContact O-N 2.92Å; Q830-A833 PolarHBondContact O-N 2.63Å; Q830-A834 PolarHBondContact O-N 2.65Å |
| 831 | A | 40.5 | Very low | 39.5 | Very low | 65 Ų | 65 | 130.1 Ų | 130.1 | 54% | 0.537 | 68% | 0.675 | S | S | . | * | H | α-helix | trans | -61 | -40.6 | 173.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | R827 A833 | R827-A831 PolarHBondContact O-N 3.44Å; A831-A833 VanDerWaalsContact C-N 3.33Å; A831-A833 PolarHBondContact O-N 2.93Å |
| 832 | A | 37.5 | Very low | 38.6 | Very low | 62 Ų | 62 | 128.7 Ų | 128.7 | 51% | 0.512 | 68% | 0.683 | S | S | . | * | H | α-helix | trans | -69 | -27.1 | 176.2 | 0 | 0 | 0 | 0 | 0 | 113.8 | T828 L829 Q830 | T828-A832 PolarHBondContact O-N 3.06Å; L829-A832 PolarHBondContact O-N 2.95Å; Q830-A832 VanDerWaalsContact C-N 3.32Å; Q830-A832 PolarHBondContact O-N 2.92Å |
| 833 | A | 38.9 | Very low | 38.2 | Very low | 60 Ų | 60 | 131.4 Ų | 131.4 | 50% | 0.496 | 69% | 0.693 | S | S | . | * | H | α-helix | trans | -76.6 | -36.2 | 179.5 | 0 | 0 | 0 | 0 | 0 | 113.2 | L829 Q830 A831 N835 R836 | L829-A833 PolarHBondContact O-N 3.49Å; L829-A833 VanDerWaalsContact O-N 3.1Å; Q830-A833 PolarHBondContact O-N 2.63Å; A831-A833 VanDerWaalsContact C-N 3.33Å; A831-A833 PolarHBondContact O-N 2.93Å; A833-N835 VanDerWaalsContact C-N 3.3Å; A833-N835 PolarHBondContact O-N 3.12Å; A833-R836 PolarHBondContact O-N 3.46Å |
| 834 | A | 38 | Very low | 37.7 | Very low | 72 Ų | 72 | 136.9 Ų | 136.9 | 60% | 0.595 | 71% | 0.707 | S | S | * | * | H | α-helix | trans | -59.7 | -38.9 | -179.1 | 0 | 0 | 0 | 0 | 0 | 112.7 | Q830 R836 | Q830-A834 PolarHBondContact O-N 2.65Å; A834-R836 PolarHBondContact O-N 3.17Å |
| 835 | N | 36.4 | Very low | 37.2 | Very low | 151 Ų | 151 | 138.6 Ų | 138.6 | 81% | 0.807 | 72% | 0.721 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77.5 | 16.9 | -178.1 | -71.7 | -13.6 | 0 | 0 | 0 | 114.7 | A833 | A833-N835 VanDerWaalsContact C-N 3.3Å; A833-N835 PolarHBondContact O-N 3.12Å |
| 836 | R | 39.2 | Very low | 36.5 | Very low | 213 Ų | 213 | 133.5 Ų | 133.5 | 80% | 0.804 | 72% | 0.715 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -117.4 | 5.3 | -179.8 | -82.5 | -171.5 | 168.6 | -173.5 | -1.7 | 116.2 | A833 A834 | A833-R836 PolarHBondContact O-N 3.46Å; A834-R836 PolarHBondContact O-N 3.17Å |
| 837 | L | 35.8 | Very low | 35.7 | Very low | 152 Ų | 152 | 137.8 Ų | 137.8 | 80% | 0.796 | 73% | 0.732 | S | S | * | * | S | Bend | trans | -111.9 | 15.3 | -177.1 | -69.1 | 176.9 | 0 | 0 | 0 | 115.9 | ||
| 838 | Y | 38.4 | Very low | 35.1 | Very low | 240 Ų | 240 | 134 Ų | 134 | 94% | 0.941 | 73% | 0.733 | S | S | * | * | S | Bend | trans | -126.4 | 58.1 | 170.6 | -88.6 | -79.7 | 0 | 0 | 0 | 112.9 | ||
| 839 | A | 32.4 | Very low | 35.2 | Very low | 85 Ų | 85 | 135 Ų | 135 | 70% | 0.702 | 74% | 0.741 | S | S | * | * | trans | -155.2 | 136.7 | 163.6 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 840 | R | 29.9 | Very low | 34.7 | Very low | 240 Ų | 240 | 135.4 Ų | 135.4 | 91% | 0.906 | 75% | 0.749 | S | S | * | * | trans | 70.6 | 140.2 | 179.6 | -58.6 | -177.4 | 170.2 | -157.3 | -3.8 | 114.6 | ||||
| 841 | R | 30.3 | Very low | 33.9 | Very low | 216 Ų | 216 | 132.2 Ų | 132.2 | 82% | 0.815 | 76% | 0.755 | S | S | * | * | cis | -152.8 | 134.9 | -3.5 | -154.2 | 178.6 | -179.5 | -177 | -1 | 111 | ||||
| 842 | S | 30.6 | Very low | 33.3 | Very low | 112 Ų | 112 | 132.9 Ų | 132.9 | 78% | 0.783 | 77% | 0.768 | S | S | * | * | trans | -132.5 | 126.4 | 155.9 | 52.7 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 843 | T | 33.3 | Very low | 32.8 | Very low | 116 Ų | 116 | 134.9 Ų | 134.9 | 71% | 0.712 | 79% | 0.785 | S | S | * | * | trans | 172.8 | 121.4 | 162.8 | 16 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 844 | I | 30.8 | Very low | 32.4 | Very low | 173 Ų | 173 | 136.2 Ų | 136.2 | 89% | 0.887 | 80% | 0.796 | S | S | * | * | trans | -136.4 | 119.6 | 169 | -63 | 173.7 | 0 | 0 | 0 | 105.9 | ||||
| 845 | V | 28.4 | Very low | 31.9 | Very low | 145 Ų | 145 | 139.8 Ų | 139.8 | 88% | 0.879 | 81% | 0.811 | S | S | * | * | trans | -151.5 | 138.8 | 172.5 | -174.8 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 846 | G | 28 | Very low | 31.5 | Very low | 65 Ų | 65 | 137 Ų | 137 | 67% | 0.67 | 81% | 0.809 | S | S | * | * | trans | 106.8 | 142.7 | 162.8 | 0 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 847 | I | 30 | Very low | 31.8 | Very low | 176 Ų | 176 | 132.5 Ų | 132.5 | 90% | 0.903 | 81% | 0.807 | S | S | * | * | cis | -143.5 | 156.6 | -3 | -54.4 | -179.9 | 0 | 0 | 0 | 109 | ||||
| 848 | S | 31 | Very low | 31.5 | Very low | 95 Ų | 95 | 129.8 Ų | 129.8 | 66% | 0.664 | 81% | 0.807 | S | S | * | * | trans | -76.6 | 175.5 | 174.5 | -175.8 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 849 | P | 43.6 | Very low | 31 | Very low | 122 Ų | 122 | 122.3 Ų | 122.3 | 79% | 0.792 | 79% | 0.794 | S | S | * | * | -138.7 | 167.8 | 103.1 | 39.4 | -28.9 | 0 | 0 | 0 | 116.2 | |||||
| 850 | T | 30.1 | Very low | 31 | Very low | 136 Ų | 136 | 130 Ų | 130 | 83% | 0.834 | 81% | 0.805 | S | S | * | * | trans | -68.7 | 162.6 | 168.4 | 48.8 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 851 | G | 27.8 | Very low | 31 | Very low | 80 Ų | 80 | 122.9 Ų | 122.9 | 83% | 0.825 | 79% | 0.792 | S | S | * | * | cis | 147.7 | 145.4 | -1 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 852 | G | 27.8 | Very low | 30.9 | Very low | 79 Ų | 79 | 120 Ų | 120 | 81% | 0.814 | 79% | 0.793 | S | S | * | * | trans | 163 | 126.6 | 173.8 | 0 | 0 | 0 | 0 | 0 | 118.3 | ||||
| 853 | A | 28.8 | Very low | 30.9 | Very low | 105 Ų | 105 | 121.8 Ų | 121.8 | 87% | 0.868 | 79% | 0.792 | S | S | * | * | trans | 59 | 114.5 | 149.6 | 0 | 0 | 0 | 0 | 0 | 123.6 | ||||
| 854 | A | 28.9 | Very low | 30.9 | Very low | 87 Ų | 87 | 124.6 Ų | 124.6 | 72% | 0.719 | 80% | 0.797 | S | S | * | * | 91.3 | 137.9 | 123.8 | 0 | 0 | 0 | 0 | 0 | 123.6 | |||||
| 855 | T | 29 | Very low | 32.2 | Very low | 147 Ų | 147 | 121.9 Ų | 121.9 | 90% | 0.902 | 79% | 0.791 | S | S | * | * | trans | 71.6 | 143.1 | 161.4 | 56.1 | 0 | 0 | 0 | 0 | 121.3 | ||||
| 856 | A | 26.6 | Very low | 33.9 | Very low | 94 Ų | 94 | 120.2 Ų | 120.2 | 78% | 0.777 | 78% | 0.783 | S | S | * | * | trans | -131.7 | -172.8 | 170.8 | 0 | 0 | 0 | 0 | 0 | 106.8 | ||||
| 857 | P | 46.6 | Very low | 34.9 | Very low | 117 Ų | 117 | 123.3 Ų | 123.3 | 76% | 0.76 | 79% | 0.792 | S | S | * | * | cis | -137.2 | -167.2 | -0.2 | 43.1 | -24.7 | 0 | 0 | 0 | 114.7 | ||||
| 858 | A | 28.4 | Very low | 34.9 | Very low | 96 Ų | 96 | 120.2 Ų | 120.2 | 79% | 0.793 | 79% | 0.786 | S | S | * | * | trans | 68.6 | 161.4 | 153.1 | 0 | 0 | 0 | 0 | 0 | 120 | ||||
| 859 | A | 29.4 | Very low | 34.9 | Very low | 82 Ų | 82 | 125.7 Ų | 125.7 | 68% | 0.678 | 79% | 0.793 | S | S | * | * | cis | -171.6 | 152.1 | -33.8 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 860 | R | 30.6 | Very low | 34.7 | Very low | 246 Ų | 246 | 125.5 Ų | 125.5 | 93% | 0.928 | 79% | 0.79 | S | S | * | * | trans | 63.8 | 162.3 | 154.1 | -74.6 | 174.8 | 176 | 167.9 | -2.3 | 117.9 | ||||
| 861 | S | 30 | Very low | 34.8 | Very low | 91 Ų | 91 | 125.3 Ų | 125.3 | 64% | 0.636 | 78% | 0.78 | S | S | * | * | cis | -174 | 145.1 | -20.6 | 52.5 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 862 | L | 28.4 | Very low | 35 | Very low | 157 Ų | 157 | 131.6 Ų | 131.6 | 82% | 0.822 | 78% | 0.779 | S | S | * | * | trans | 73.5 | 141.9 | 145 | -64.4 | 161.7 | 0 | 0 | 0 | 124.9 | ||||
| 863 | L | 31.5 | Very low | 35 | Very low | 148 Ų | 148 | 131.9 Ų | 131.9 | 78% | 0.775 | 77% | 0.773 | S | S | * | * | trans | 63.4 | 104 | 148.9 | -91.9 | 71.5 | 0 | 0 | 0 | 125.8 | ||||
| 864 | E | 33 | Very low | 35.2 | Very low | 175 Ų | 175 | 130.9 Ų | 130.9 | 82% | 0.818 | 77% | 0.765 | S | S | * | * | 28.6 | 150.6 | 96.8 | -152.7 | 165.7 | -167.5 | 0 | 0 | 122.1 | |||||
| 865 | P | 59.2 | Low | 35.3 | Very low | 116 Ų | 116 | 132.9 Ų | 132.9 | 75% | 0.753 | 76% | 0.763 | S | S | * | * | cis | -133.3 | -126.4 | -27.9 | 43.3 | -21.9 | 0 | 0 | 0 | 117.5 | ||||
| 866 | P | 64.1 | Low | 35.4 | Very low | 111 Ų | 111 | 134 Ų | 134 | 72% | 0.721 | 76% | 0.758 | S | S | * | * | trans | -121.6 | -167.2 | -147.6 | 43.3 | -19.4 | 0 | 0 | 0 | 116.6 | ||||
| 867 | P | 48.7 | Very low | 35.6 | Very low | 130 Ų | 130 | 134.1 Ų | 134.1 | 84% | 0.844 | 75% | 0.754 | S | S | * | * | -154.9 | -129.8 | 87.1 | 42.2 | -18.1 | 0 | 0 | 0 | 116.8 | |||||
| 868 | S | 29 | Very low | 34.8 | Very low | 111 Ų | 111 | 136.7 Ų | 136.7 | 78% | 0.776 | 76% | 0.755 | S | S | * | * | trans | -160.1 | 163.2 | -150.6 | 60.4 | 0 | 0 | 0 | 0 | 120.7 | ||||
| 869 | Y | 31.8 | Very low | 34.9 | Very low | 210 Ų | 210 | 139 Ų | 139 | 82% | 0.824 | 75% | 0.753 | S | S | * | * | trans | 103.2 | 168.4 | 141.4 | -156.1 | -106.6 | 0 | 0 | 0 | 123.1 | ||||
| 870 | T | 39 | Very low | 34.8 | Very low | 118 Ų | 118 | 141.3 Ų | 141.3 | 72% | 0.724 | 76% | 0.759 | S | S | * | * | trans | 91.5 | 143.7 | 177.1 | 69.6 | 0 | 0 | 0 | 0 | 117.2 | ||||
| 871 | E | 33.1 | Very low | 34.8 | Very low | 132 Ų | 132 | 134.9 Ų | 134.9 | 62% | 0.617 | 76% | 0.758 | S | S | * | * | cis | -152.2 | -172.1 | -1.6 | -138.3 | -166.2 | 170 | 0 | 0 | 108.9 | ||||
| 872 | R | 31.2 | Very low | 34.9 | Very low | 212 Ų | 212 | 133.9 Ų | 133.9 | 80% | 0.8 | 76% | 0.763 | S | S | * | * | cis | -152.5 | -165.9 | -1.1 | -147.4 | 165.8 | -171.2 | 127.7 | -3.5 | 105.6 | ||||
| 873 | A | 28.3 | Very low | 35.9 | Very low | 84 Ų | 84 | 132.2 Ų | 132.2 | 69% | 0.694 | 76% | 0.761 | S | S | * | * | cis | -155 | 173.5 | -2.7 | 0 | 0 | 0 | 0 | 0 | 106.1 | ||||
| 874 | A | 32.4 | Very low | 35.9 | Very low | 84 Ų | 84 | 130.1 Ų | 130.1 | 69% | 0.694 | 76% | 0.759 | S | S | * | * | cis | 81.2 | 131 | 22.2 | 0 | 0 | 0 | 0 | 0 | 116.9 | ||||
| 875 | N | 32 | Very low | 35.8 | Very low | 130 Ų | 130 | 129.1 Ų | 129.1 | 70% | 0.695 | 76% | 0.759 | S | S | * | * | cis | -169.7 | 149.7 | -11.8 | -117 | -2.8 | 0 | 0 | 0 | 114.8 | ||||
| 876 | Q | 31 | Very low | 34.6 | Very low | 169 Ų | 169 | 128 Ų | 128 | 79% | 0.79 | 76% | 0.76 | S | S | * | * | trans | 60.2 | 160.5 | 143.9 | -70.5 | 168.8 | -6.3 | 0 | 0 | 120.9 | ||||
| 877 | S | 29.8 | Very low | 33.5 | Very low | 98 Ų | 98 | 128.6 Ų | 128.6 | 69% | 0.685 | 76% | 0.764 | S | S | * | * | cis | -170.7 | 158.2 | -12.9 | 47.8 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 878 | Q | 29 | Very low | 32.7 | Very low | 170 Ų | 170 | 128.9 Ų | 128.9 | 79% | 0.794 | 76% | 0.763 | S | S | * | * | trans | 80.7 | 133.8 | 146.2 | -85.6 | -175.1 | -7.5 | 0 | 0 | 126.4 | ||||
| 879 | I | 30.5 | Very low | 32.9 | Very low | 146 Ų | 146 | 130 Ų | 130 | 75% | 0.749 | 77% | 0.765 | S | S | * | * | trans | 89.5 | 161.5 | 140.3 | -68.2 | 167.2 | 0 | 0 | 0 | 121 | ||||
| 880 | T | 28.7 | Very low | 32.9 | Very low | 130 Ų | 130 | 127.2 Ų | 127.2 | 80% | 0.798 | 76% | 0.759 | S | S | * | * | trans | -100 | 149.4 | -140.3 | 50.1 | 0 | 0 | 0 | 0 | 119.4 | ||||
| 881 | A | 29.7 | Very low | 32.7 | Very low | 110 Ų | 110 | 125.5 Ų | 125.5 | 91% | 0.909 | 75% | 0.752 | S | S | * | * | trans | -171.2 | 165.7 | 133.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 882 | G | 31.6 | Very low | 32.9 | Very low | 71 Ų | 71 | 127.2 Ų | 127.2 | 73% | 0.732 | 76% | 0.757 | S | S | * | * | trans | -123.2 | -164.3 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 883 | P | 49.8 | Very low | 32.9 | Very low | 122 Ų | 122 | 124.9 Ų | 124.9 | 79% | 0.792 | 75% | 0.753 | S | S | * | * | cis | -141.2 | -176.6 | 19.6 | 43.8 | -25.8 | 0 | 0 | 0 | 118.1 | ||||
| 884 | S | 32 | Very low | 33.2 | Very low | 103 Ų | 103 | 130.2 Ų | 130.2 | 72% | 0.72 | 76% | 0.755 | S | S | * | * | trans | 108.9 | 120.2 | 148.5 | 77.1 | 0 | 0 | 0 | 0 | 121.9 | ||||
| 885 | N | 30.1 | Very low | 33.3 | Very low | 154 Ų | 154 | 136 Ų | 136 | 82% | 0.824 | 76% | 0.759 | S | S | * | * | trans | 67.1 | 77.7 | 142.6 | -58.2 | -2.1 | 0 | 0 | 0 | 123 | ||||
| 886 | A | 34.4 | Very low | 33.5 | Very low | 93 Ų | 93 | 139.5 Ų | 139.5 | 77% | 0.769 | 76% | 0.763 | S | S | * | * | 40.8 | 157.9 | 116.4 | 0 | 0 | 0 | 0 | 0 | 123.6 | |||||
| 887 | P | 42.3 | Very low | 33.5 | Very low | 124 Ų | 124 | 140.1 Ų | 140.1 | 81% | 0.805 | 76% | 0.763 | S | S | * | * | cis | -120.7 | 170.6 | -8.5 | 36.3 | -19.9 | 0 | 0 | 0 | 114.8 | ||||
| 888 | T | 30.2 | Very low | 33.6 | Very low | 135 Ų | 135 | 140.3 Ų | 140.3 | 83% | 0.828 | 77% | 0.765 | S | S | * | * | trans | -155.4 | -180 | -163.3 | -17.6 | 0 | 0 | 0 | 0 | 116 | ||||
| 889 | V | 33.8 | Very low | 33.6 | Very low | 134 Ų | 134 | 138.9 Ų | 138.9 | 81% | 0.812 | 77% | 0.767 | S | S | * | * | trans | 75.3 | 117.5 | 178.8 | -172.7 | 0 | 0 | 0 | 0 | 115.2 | ||||
| 890 | Q | 31.5 | Very low | 33.5 | Very low | 153 Ų | 153 | 142.9 Ų | 142.9 | 72% | 0.715 | 77% | 0.773 | S | S | * | * | cis | 96.3 | 33.1 | 2.5 | -92 | -69.3 | 1.3 | 0 | 0 | 122.2 | ||||
| 891 | S | 36.1 | Very low | 34.8 | Very low | 81 Ų | 81 | 141.8 Ų | 141.8 | 57% | 0.566 | 77% | 0.768 | S | S | * | * | trans | 68.2 | 152 | 147.3 | 76.2 | 0 | 0 | 0 | 0 | 122.2 | ||||
| 892 | K | 36.7 | Very low | 34.8 | Very low | 169 Ų | 169 | 144 Ų | 144 | 74% | 0.735 | 77% | 0.77 | S | S | * | * | trans | 136.3 | 141.6 | 133.5 | -77.7 | 146.6 | -174.5 | 160.5 | 0 | 119.7 | ||||
| 893 | F | 30.9 | Very low | 34.7 | Very low | 162 Ų | 162 | 144.8 Ų | 144.8 | 71% | 0.711 | 77% | 0.77 | S | S | * | * | trans | 66 | 130.7 | 147.2 | -86.2 | -132 | 0 | 0 | 0 | 120.9 | ||||
| 894 | R | 34.8 | Very low | 33.9 | Very low | 196 Ų | 196 | 146 Ų | 146 | 74% | 0.74 | 77% | 0.769 | S | S | * | * | 76.5 | 129.3 | 66.3 | -116 | -174.5 | 179.6 | -161.4 | 2.3 | 112.6 | |||||
| 895 | R | 34.3 | Very low | 34 | Very low | 205 Ų | 205 | 148.5 Ų | 148.5 | 77% | 0.774 | 77% | 0.769 | S | S | * | * | cis | -158.7 | 144.7 | 31.4 | -47.2 | 171.2 | -173.5 | -173.7 | 1.4 | 115.3 | ||||
| 896 | R | 36.8 | Very low | 33.9 | Very low | 204 Ų | 204 | 148.4 Ų | 148.4 | 77% | 0.77 | 77% | 0.767 | S | S | * | * | trans | 57.8 | 151.3 | 135.8 | -66.8 | -178.9 | 174.7 | -91.8 | 1.8 | 125.3 | ||||
| 897 | F | 31.3 | Very low | 34.5 | Very low | 183 Ų | 183 | 149.3 Ų | 149.3 | 80% | 0.803 | 77% | 0.765 | S | S | * | * | trans | 78.2 | 144.7 | 163.7 | -59.3 | -67.9 | 0 | 0 | 0 | 117 | ||||
| 898 | S | 30.2 | Very low | 34.5 | Very low | 102 Ų | 102 | 149.5 Ų | 149.5 | 71% | 0.713 | 77% | 0.766 | S | S | * | * | cis | -164.3 | 146.1 | -6.3 | 44.6 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 899 | V | 31 | Very low | 34.5 | Very low | 140 Ų | 140 | 146.5 Ų | 146.5 | 85% | 0.848 | 76% | 0.763 | S | S | * | * | trans | 63.8 | 124.5 | 149 | -179.1 | 0 | 0 | 0 | 0 | 122.8 | ||||
| 900 | R | 27.1 | Very low | 34.4 | Very low | 230 Ų | 230 | 149.8 Ų | 149.8 | 87% | 0.868 | 77% | 0.769 | S | S | * | * | trans | -32.3 | -179.7 | 157.1 | -72.3 | -178.8 | 172.1 | 176 | -2.4 | 119.4 | ||||
| 901 | P | 56.9 | Low | 34.2 | Very low | 107 Ų | 107 | 146.7 Ų | 146.7 | 70% | 0.695 | 77% | 0.77 | S | S | * | * | cis | -145.4 | 163.8 | -44.9 | 41.2 | -24.2 | 0 | 0 | 0 | 115.9 | ||||
| 902 | T | 28.6 | Very low | 34.7 | Very low | 155 Ų | 155 | 148.5 Ų | 148.5 | 95% | 0.951 | 78% | 0.78 | S | S | * | * | trans | -166.6 | 172.6 | 153.6 | 14.3 | 0 | 0 | 0 | 0 | 112 | ||||
| 903 | A | 30.4 | Very low | 35.5 | Very low | 88 Ų | 88 | 145.6 Ų | 145.6 | 73% | 0.727 | 78% | 0.778 | S | S | * | * | trans | -149.8 | 153.5 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 904 | L | 33.2 | Very low | 36.1 | Very low | 148 Ų | 148 | 144 Ų | 144 | 78% | 0.775 | 78% | 0.784 | S | S | * | * | trans | 167.1 | 141.6 | 141.2 | -90.5 | 160.5 | 0 | 0 | 0 | 113.2 | ||||
| 905 | Q | 32.6 | Very low | 36 | Very low | 156 Ų | 156 | 138 Ų | 138 | 73% | 0.729 | 78% | 0.783 | S | S | * | * | trans | 49.5 | 123.3 | 150.7 | -77.6 | 152.8 | -15.8 | 0 | 0 | 121.5 | ||||
| 906 | I | 29.8 | Very low | 35.9 | Very low | 151 Ų | 151 | 133.3 Ų | 133.3 | 77% | 0.774 | 79% | 0.788 | S | S | * | * | 79.9 | 138.5 | 65.2 | -76.9 | 174.2 | 0 | 0 | 0 | 113.1 | |||||
| 907 | P | 46.3 | Very low | 35.6 | Very low | 113 Ų | 113 | 128.8 Ų | 128.8 | 73% | 0.734 | 79% | 0.788 | S | S | * | * | cis | -126.8 | -134.7 | -24.4 | 39.1 | -17.3 | 0 | 0 | 0 | 109.1 | ||||
| 908 | P | 42.5 | Very low | 35.6 | Very low | 127 Ų | 127 | 126.8 Ų | 126.8 | 83% | 0.825 | 79% | 0.785 | S | S | * | * | cis | -119.7 | -167 | -31.3 | 38.7 | -20.2 | 0 | 0 | 0 | 113.4 | ||||
| 909 | G | 29.9 | Very low | 35.8 | Very low | 73 Ų | 73 | 128.9 Ų | 128.9 | 75% | 0.753 | 79% | 0.785 | S | S | * | * | trans | -126 | -174.5 | -175.6 | 0 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 910 | Q | 32 | Very low | 35.7 | Very low | 202 Ų | 202 | 128.4 Ų | 128.4 | 94% | 0.944 | 77% | 0.774 | S | S | * | * | trans | -147.2 | 167.9 | 179.6 | -86.3 | 179.4 | -19 | 0 | 0 | 112.3 | ||||
| 911 | A | 27.6 | Very low | 35.9 | Very low | 88 Ų | 88 | 125.3 Ų | 125.3 | 73% | 0.727 | 77% | 0.769 | S | S | * | * | trans | -131.5 | -154.5 | 172.3 | 0 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 912 | P | 46.4 | Very low | 34.6 | Very low | 120 Ų | 120 | 124.5 Ų | 124.5 | 78% | 0.779 | 77% | 0.766 | S | S | * | * | cis | -129 | -104.3 | -13 | 22.4 | 4.2 | 0 | 0 | 0 | 118.1 | ||||
| 913 | P | 54 | Low | 34.7 | Very low | 108 Ų | 108 | 122.1 Ų | 122.1 | 70% | 0.701 | 76% | 0.756 | S | S | * | * | -121.5 | -152.8 | -124.4 | 44.3 | -24.3 | 0 | 0 | 0 | 112.8 | |||||
| 914 | P | 43.5 | Very low | 34.8 | Very low | 128 Ų | 128 | 126.4 Ų | 126.4 | 83% | 0.831 | 76% | 0.76 | S | S | * | * | cis | -138.5 | -167.8 | -3 | 44.3 | -24.8 | 0 | 0 | 0 | 116.7 | ||||
| 915 | G | 30.9 | Very low | 34.8 | Very low | 70 Ų | 70 | 125 Ų | 125 | 72% | 0.722 | 76% | 0.758 | S | S | * | * | trans | 132.1 | 75.9 | 161.3 | 0 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 916 | A | 34 | Very low | 34.8 | Very low | 106 Ų | 106 | 121.3 Ų | 121.3 | 88% | 0.876 | 76% | 0.755 | S | S | * | * | 67.6 | 129.6 | 80.2 | 0 | 0 | 0 | 0 | 0 | 113.2 | |||||
| 917 | S | 30 | Very low | 34.8 | Very low | 110 Ų | 110 | 121.3 Ų | 121.3 | 77% | 0.769 | 76% | 0.755 | S | S | * | * | cis | -151.4 | 172.7 | 34.8 | 53.8 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 918 | L | 31.8 | Very low | 34.1 | Very low | 141 Ų | 141 | 122.1 Ų | 122.1 | 74% | 0.738 | 75% | 0.749 | S | S | * | * | cis | -162.7 | 148.6 | -12.6 | -114.8 | 170.4 | 0 | 0 | 0 | 111.1 | ||||
| 919 | M | 33.3 | Very low | 33.5 | Very low | 146 Ų | 146 | 125.1 Ų | 125.1 | 72% | 0.719 | 74% | 0.744 | S | S | * | * | trans | 62.1 | 148.9 | 148.5 | -94.2 | 164.6 | 171.8 | 0 | 0 | 121.6 | ||||
| 920 | E | 29.8 | Very low | 33.6 | Very low | 130 Ų | 130 | 131.7 Ų | 131.7 | 61% | 0.607 | 75% | 0.746 | S | S | * | * | cis | -154.9 | 139 | -0 | -161.6 | 152.4 | -159.5 | 0 | 0 | 115.1 | ||||
| 921 | Q | 31.3 | Very low | 33.3 | Very low | 164 Ų | 164 | 128.1 Ų | 128.1 | 77% | 0.766 | 73% | 0.733 | S | S | * | * | trans | 50.3 | 155.6 | 150.4 | -71.6 | -175.6 | 59.4 | 0 | 0 | 122.9 | ||||
| 922 | S | 29.3 | Very low | 33.3 | Very low | 91 Ų | 91 | 128.4 Ų | 128.4 | 64% | 0.636 | 73% | 0.73 | S | S | * | * | cis | -155.6 | 161.5 | 0.2 | 38.6 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 923 | S | 30.9 | Very low | 32.4 | Very low | 105 Ų | 105 | 130.8 Ų | 130.8 | 73% | 0.734 | 74% | 0.735 | S | S | * | * | trans | 59.2 | 129.8 | 161 | 43 | 0 | 0 | 0 | 0 | 119.9 | ||||
| 924 | Q | 32.3 | Very low | 31.4 | Very low | 177 Ų | 177 | 137 Ų | 137 | 83% | 0.827 | 74% | 0.744 | S | S | * | * | cis | 73.9 | 138.4 | 38.6 | -58.8 | -166.3 | 8.6 | 0 | 0 | 113.8 | ||||
| 925 | T | 32.9 | Very low | 31.1 | Very low | 119 Ų | 119 | 136.7 Ų | 136.7 | 73% | 0.73 | 74% | 0.742 | S | S | * | * | cis | -163.2 | 158.8 | 5.8 | 2.2 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 926 | A | 31.6 | Very low | 31.1 | Very low | 79 Ų | 79 | 138.3 Ų | 138.3 | 65% | 0.653 | 74% | 0.743 | S | S | * | * | trans | 71.7 | 122.1 | 133.3 | 0 | 0 | 0 | 0 | 0 | 124.8 | ||||
| 927 | L | 29.9 | Very low | 31.9 | Very low | 150 Ų | 150 | 138.3 Ų | 138.3 | 79% | 0.785 | 73% | 0.734 | S | S | * | * | 83.1 | 118.9 | 129.5 | -66.5 | 170.8 | 0 | 0 | 0 | 123.6 | |||||
| 928 | Q | 32.4 | Very low | 31.8 | Very low | 131 Ų | 131 | 141.1 Ų | 141.1 | 61% | 0.612 | 74% | 0.739 | S | S | * | * | 94.7 | 110.2 | 126.7 | -80.1 | -171.5 | 43.4 | 0 | 0 | 123.7 | |||||
| 929 | R | 30.3 | Very low | 31.6 | Very low | 190 Ų | 190 | 138.7 Ų | 138.7 | 72% | 0.717 | 74% | 0.74 | S | S | * | * | 97.7 | 106.8 | 108.7 | -168.7 | -166.8 | -66 | -149.2 | 0.1 | 119.5 | |||||
| 930 | R | 30.3 | Very low | 31.5 | Very low | 211 Ų | 211 | 141.9 Ų | 141.9 | 80% | 0.796 | 74% | 0.744 | S | S | * | * | trans | 84.7 | 132.7 | 142.5 | -81 | -179.1 | 170.5 | -131.6 | -0.7 | 122.1 | ||||
| 931 | L | 27.3 | Very low | 31.4 | Very low | 127 Ų | 127 | 141.8 Ų | 141.8 | 67% | 0.665 | 74% | 0.743 | S | S | * | * | trans | 70.4 | 97.8 | 133.1 | -68.7 | 172 | 0 | 0 | 0 | 121.8 | ||||
| 932 | S | 27.5 | Very low | 31.3 | Very low | 94 Ų | 94 | 140.6 Ų | 140.6 | 66% | 0.657 | 74% | 0.742 | S | S | * | * | 77.1 | 153.2 | 113.9 | 75.8 | 0 | 0 | 0 | 0 | 122.3 | |||||
| 933 | L | 28 | Very low | 31.3 | Very low | 170 Ų | 170 | 141.1 Ų | 141.1 | 89% | 0.89 | 75% | 0.745 | S | S | * | * | trans | 83.9 | 130.8 | 162.8 | -57.9 | 174.3 | 0 | 0 | 0 | 119.5 | ||||
| 934 | R | 32 | Very low | 32.3 | Very low | 238 Ų | 238 | 141.4 Ų | 141.4 | 90% | 0.898 | 75% | 0.745 | S | S | * | * | trans | -66.8 | 164.2 | 157.3 | -95.2 | 177.3 | 172.2 | 170.2 | -3.1 | 110 | ||||
| 935 | P | 37.7 | Very low | 32.1 | Very low | 122 Ų | 122 | 140.2 Ų | 140.2 | 79% | 0.792 | 75% | 0.749 | S | S | * | * | cis | -147.1 | -169.5 | 39.1 | 42.2 | -20.9 | 0 | 0 | 0 | 117.2 | ||||
| 936 | S | 31.5 | Very low | 32.1 | Very low | 104 Ų | 104 | 140 Ų | 140 | 73% | 0.727 | 75% | 0.753 | S | S | * | * | trans | -90.8 | -173.6 | 161.7 | 59.3 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 937 | P | 49.6 | Very low | 33.3 | Very low | 106 Ų | 106 | 141.7 Ų | 141.7 | 69% | 0.688 | 76% | 0.757 | S | S | * | * | cis | -142.7 | -171.1 | 2.5 | 42.8 | -22.5 | 0 | 0 | 0 | 117.3 | ||||
| 938 | L | 28.1 | Very low | 34.3 | Very low | 168 Ų | 168 | 140.8 Ų | 140.8 | 88% | 0.88 | 76% | 0.76 | S | S | * | * | trans | 69 | 109.3 | 144.9 | -85.8 | 164.3 | 0 | 0 | 0 | 124.5 | ||||
| 939 | A | 27.7 | Very low | 34.4 | Very low | 91 Ų | 91 | 138.3 Ų | 138.3 | 75% | 0.752 | 77% | 0.77 | S | S | * | * | trans | -171.7 | 142.9 | 139.5 | 0 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 940 | R | 32 | Very low | 34.5 | Very low | 212 Ų | 212 | 133.2 Ų | 133.2 | 80% | 0.8 | 78% | 0.776 | S | S | * | * | cis | 77.1 | 121.9 | 43 | -160.9 | 170.7 | -173 | 147.9 | 17.8 | 111.1 | ||||
| 941 | E | 27.6 | Very low | 34.7 | Very low | 129 Ų | 129 | 129.4 Ų | 129.4 | 60% | 0.603 | 78% | 0.782 | S | S | * | * | cis | -158.2 | 165.8 | 13 | -134.7 | 156.5 | -169.5 | 0 | 0 | 113.8 | ||||
| 942 | L | 29.1 | Very low | 35 | Very low | 139 Ų | 139 | 126.8 Ų | 126.8 | 73% | 0.728 | 79% | 0.786 | S | S | * | * | trans | 36.4 | 106.6 | 148.4 | -75 | 163.5 | 0 | 0 | 0 | 124.5 | ||||
| 943 | S | 28.2 | Very low | 35.3 | Very low | 102 Ų | 102 | 128.1 Ų | 128.1 | 71% | 0.713 | 80% | 0.796 | S | S | * | * | 59.1 | 178.9 | 121.8 | 70.5 | 0 | 0 | 0 | 0 | 122.2 | |||||
| 944 | P | 52.2 | Low | 35.5 | Very low | 111 Ų | 111 | 124.9 Ų | 124.9 | 72% | 0.721 | 79% | 0.793 | S | S | * | * | -132.2 | 170.9 | -72.9 | 41.3 | -25.9 | 0 | 0 | 0 | 114.5 | |||||
| 945 | T | 27.7 | Very low | 35.5 | Very low | 151 Ų | 151 | 121.5 Ų | 121.5 | 93% | 0.926 | 79% | 0.792 | S | S | * | * | trans | -163.6 | 168.5 | 155.3 | -3.6 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 946 | S | 32.6 | Very low | 36.2 | Very low | 115 Ų | 115 | 121.1 Ų | 121.1 | 80% | 0.804 | 79% | 0.789 | S | S | * | * | trans | -144 | -162.9 | -163.6 | 73.2 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 947 | P | 57.4 | Low | 36.2 | Very low | 114 Ų | 114 | 121 Ų | 121 | 74% | 0.74 | 79% | 0.794 | S | S | * | * | trans | -129.8 | -173.1 | -130.7 | 40.4 | -19.1 | 0 | 0 | 0 | 116.7 | ||||
| 948 | P | 51.1 | Low | 35.2 | Very low | 131 Ų | 131 | 119 Ų | 119 | 85% | 0.851 | 79% | 0.794 | S | S | * | * | trans | -132.7 | 166 | 149.2 | 38.4 | -25.9 | 0 | 0 | 0 | 113.2 | ||||
| 949 | G | 34.8 | Very low | 35.4 | Very low | 80 Ų | 80 | 115.8 Ų | 115.8 | 83% | 0.825 | 79% | 0.791 | S | S | * | * | cis | 158.2 | 143.8 | -9.6 | 0 | 0 | 0 | 0 | 0 | 114 | ||||
| 950 | G | 33.2 | Very low | 35.6 | Very low | 82 Ų | 82 | 118.8 Ų | 118.8 | 85% | 0.845 | 79% | 0.793 | S | S | * | * | trans | 106 | 147.3 | 168.7 | 0 | 0 | 0 | 0 | 0 | 116.6 | ||||
| 951 | S | 34.5 | Very low | 35.5 | Very low | 131 Ų | 131 | 116.1 Ų | 116.1 | 92% | 0.916 | 80% | 0.795 | S | S | * | * | cis | -159.1 | 153.3 | -3.8 | 54.9 | 0 | 0 | 0 | 0 | 114 | ||||
| 952 | G | 32.9 | Very low | 35.7 | Very low | 73 Ų | 73 | 118.1 Ų | 118.1 | 75% | 0.753 | 80% | 0.804 | S | S | * | * | trans | 104 | 167.9 | 173.8 | 0 | 0 | 0 | 0 | 0 | 115.8 | ||||
| 953 | S | 34.2 | Very low | 35.6 | Very low | 122 Ų | 122 | 117.3 Ų | 117.3 | 85% | 0.853 | 81% | 0.81 | S | S | * | * | cis | -170.2 | 158.9 | -17.4 | 47.4 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 954 | A | 31.8 | Very low | 35.6 | Very low | 101 Ų | 101 | 116.5 Ų | 116.5 | 84% | 0.835 | 82% | 0.817 | S | S | * | * | trans | 64.5 | 145.2 | 165.5 | 0 | 0 | 0 | 0 | 0 | 121.1 | ||||
| 955 | L | 32.1 | Very low | 34.3 | Very low | 167 Ų | 167 | 114.4 Ų | 114.4 | 87% | 0.874 | 82% | 0.816 | S | S | * | * | trans | -155.6 | 177.6 | -170.3 | -93.2 | 171.5 | 0 | 0 | 0 | 107.9 | ||||
| 956 | P | 52.3 | Low | 34.3 | Very low | 114 Ų | 114 | 113.5 Ų | 113.5 | 74% | 0.74 | 81% | 0.811 | S | S | * | * | cis | -144.6 | 170.6 | 22.8 | 43.8 | -24.4 | 0 | 0 | 0 | 119.8 | ||||
| 957 | A | 32 | Very low | 34.2 | Very low | 101 Ų | 101 | 113.3 Ų | 113.3 | 84% | 0.835 | 81% | 0.809 | S | S | * | * | trans | 38.9 | 149.7 | 140 | 0 | 0 | 0 | 0 | 0 | 123.1 | ||||
| 958 | G | 28.8 | Very low | 32.9 | Very low | 65 Ų | 65 | 112 Ų | 112 | 67% | 0.67 | 81% | 0.808 | S | S | * | * | cis | -162.3 | 154.1 | 0.1 | 0 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 959 | A | 31.1 | Very low | 32 | Very low | 100 Ų | 100 | 113.7 Ų | 113.7 | 83% | 0.826 | 80% | 0.804 | S | S | * | * | 71.4 | 139.3 | 83.6 | 0 | 0 | 0 | 0 | 0 | 112.7 | |||||
| 960 | I | 32 | Very low | 31.6 | Very low | 154 Ų | 154 | 119.6 Ų | 119.6 | 79% | 0.79 | 80% | 0.802 | S | S | * | * | cis | -147.6 | 145.6 | 17.6 | -57.3 | 160.9 | 0 | 0 | 0 | 108.7 | ||||
| 961 | D | 29.8 | Very low | 31.4 | Very low | 157 Ų | 157 | 123.1 Ų | 123.1 | 84% | 0.84 | 80% | 0.8 | S | S | * | * | 177.7 | 162.4 | 116.6 | -123.6 | -40.1 | 0 | 0 | 0 | 115.1 | |||||
| 962 | E | 31.4 | Very low | 31.2 | Very low | 170 Ų | 170 | 124 Ų | 124 | 79% | 0.794 | 79% | 0.794 | S | S | * | * | trans | -117.9 | 160.7 | -172.2 | -71 | -162.5 | 115.4 | 0 | 0 | 115.9 | ||||
| 963 | S | 28.2 | Very low | 31.9 | Very low | 123 Ų | 123 | 126.7 Ų | 126.7 | 86% | 0.86 | 80% | 0.798 | S | S | * | * | trans | 81.5 | 150.1 | 144.6 | 83.2 | 0 | 0 | 0 | 0 | 120.9 | ||||
| 964 | G | 27.1 | Very low | 31.9 | Very low | 84 Ų | 84 | 127.6 Ų | 127.6 | 87% | 0.866 | 79% | 0.793 | S | S | * | * | trans | 82.6 | 134.9 | 168.3 | 0 | 0 | 0 | 0 | 0 | 116 | ||||
| 965 | G | 25.9 | Very low | 32.6 | Very low | 67 Ų | 67 | 128.7 Ų | 128.7 | 69% | 0.691 | 79% | 0.791 | S | S | * | * | cis | 160 | 137.5 | -7.5 | 0 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 966 | T | 27.9 | Very low | 32.7 | Very low | 133 Ų | 133 | 125.3 Ų | 125.3 | 82% | 0.816 | 79% | 0.787 | S | S | * | * | trans | 48 | 99 | 157.2 | 50.7 | 0 | 0 | 0 | 0 | 120.1 | ||||
| 967 | S | 30.6 | Very low | 31.7 | Very low | 111 Ų | 111 | 123.3 Ų | 123.3 | 78% | 0.776 | 79% | 0.787 | S | S | * | * | 32.4 | 132.8 | 122.8 | 62.1 | 0 | 0 | 0 | 0 | 121.5 | |||||
| 968 | A | 30.2 | Very low | 31.6 | Very low | 85 Ų | 85 | 125.6 Ų | 125.6 | 70% | 0.702 | 79% | 0.791 | S | S | * | * | 172.6 | 144.8 | 103 | 0 | 0 | 0 | 0 | 0 | 116.2 | |||||
| 969 | Q | 30.3 | Very low | 31.8 | Very low | 167 Ų | 167 | 133.1 Ų | 133.1 | 78% | 0.78 | 80% | 0.799 | S | S | * | * | trans | 69 | 138 | 141.2 | -77.4 | -174.4 | 49 | 0 | 0 | 124.3 | ||||
| 970 | R | 28.3 | Very low | 32.4 | Very low | 205 Ų | 205 | 133.8 Ų | 133.8 | 77% | 0.774 | 80% | 0.795 | S | S | * | * | trans | 88.3 | 113.4 | 138.7 | -82.7 | -179.1 | 175.9 | -152 | -3.4 | 122.8 | ||||
| 971 | L | 28.5 | Very low | 32.4 | Very low | 156 Ų | 156 | 130.3 Ų | 130.3 | 82% | 0.817 | 78% | 0.784 | S | S | * | * | 97.4 | 143.8 | 129.6 | -68.4 | 167.1 | 0 | 0 | 0 | 121.3 | |||||
| 972 | L | 30.9 | Very low | 32.4 | Very low | 148 Ų | 148 | 128.9 Ų | 128.9 | 78% | 0.775 | 78% | 0.782 | S | S | * | * | trans | -89.3 | 166.7 | 177.3 | -60.3 | 160.9 | 0 | 0 | 0 | 110.2 | ||||
| 973 | P | 46.8 | Very low | 32.4 | Very low | 130 Ų | 130 | 125.7 Ų | 125.7 | 84% | 0.844 | 78% | 0.778 | S | S | * | * | -140.7 | 168.1 | 86.2 | 34.2 | -17.3 | 0 | 0 | 0 | 116.4 | |||||
| 974 | L | 33 | Very low | 32.4 | Very low | 142 Ų | 142 | 125.1 Ų | 125.1 | 74% | 0.743 | 77% | 0.774 | S | S | * | * | trans | -94 | 166.7 | 170.4 | -70 | 156.8 | 0 | 0 | 0 | 110.4 | ||||
| 975 | P | 47.2 | Very low | 32.5 | Very low | 124 Ų | 124 | 127 Ų | 127 | 81% | 0.805 | 77% | 0.769 | S | S | * | * | -119.1 | 148.4 | 79.6 | -1.8 | 24.2 | 0 | 0 | 0 | 112.3 | |||||
| 976 | A | 34 | Very low | 32.7 | Very low | 95 Ų | 95 | 132.5 Ų | 132.5 | 79% | 0.785 | 78% | 0.777 | S | S | * | * | 68.1 | 129 | 53.8 | 0 | 0 | 0 | 0 | 0 | 113.5 | |||||
| 977 | G | 31.6 | Very low | 33 | Very low | 72 Ų | 72 | 130.7 Ų | 130.7 | 74% | 0.742 | 77% | 0.769 | S | S | * | * | cis | -167.9 | -174.7 | -2.5 | 0 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 978 | T | 30.5 | Very low | 33.4 | Very low | 149 Ų | 149 | 131.4 Ų | 131.4 | 91% | 0.914 | 77% | 0.771 | S | S | * | * | cis | -151.1 | 164.2 | 9.6 | 47.7 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 979 | R | 33.6 | Very low | 33.3 | Very low | 223 Ų | 223 | 135.2 Ų | 135.2 | 84% | 0.842 | 78% | 0.779 | S | S | * | * | trans | -140.6 | 160.3 | 172.2 | -145.3 | -174.2 | -171.6 | 174.2 | 4.8 | 109.1 | ||||
| 980 | P | 42.1 | Very low | 33.3 | Very low | 115 Ų | 115 | 132.4 Ų | 132.4 | 75% | 0.747 | 78% | 0.778 | S | S | * | * | -128.8 | 140.7 | 107.9 | 4 | 17.5 | 0 | 0 | 0 | 111.4 | |||||
| 981 | S | 31.7 | Very low | 33.4 | Very low | 80 Ų | 80 | 133.4 Ų | 133.4 | 56% | 0.559 | 78% | 0.781 | S | S | * | * | cis | 78.6 | 149.6 | 41.5 | 93.7 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 982 | T | 31 | Very low | 33.7 | Very low | 128 Ų | 128 | 133.3 Ų | 133.3 | 79% | 0.785 | 78% | 0.78 | S | S | * | * | cis | -163.7 | 178.3 | -4.6 | 2.2 | 0 | 0 | 0 | 0 | 106.7 | ||||
| 983 | S | 30.2 | Very low | 33.6 | Very low | 102 Ų | 102 | 132.1 Ų | 132.1 | 71% | 0.713 | 78% | 0.779 | S | S | * | * | cis | -174 | 159.2 | 0.9 | 35.3 | 0 | 0 | 0 | 0 | 106.5 | ||||
| 984 | S | 28.8 | Very low | 32.6 | Very low | 111 Ų | 111 | 135.1 Ų | 135.1 | 78% | 0.776 | 78% | 0.781 | S | S | * | * | cis | -170.4 | 170.5 | -12.6 | 49.4 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 985 | T | 30.2 | Very low | 32.5 | Very low | 125 Ų | 125 | 135.4 Ų | 135.4 | 77% | 0.767 | 78% | 0.782 | S | S | * | * | trans | -64.2 | 136.2 | 170.3 | 40.3 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 986 | H | 30.1 | Very low | 31.6 | Very low | 182 Ų | 182 | 134.1 Ų | 134.1 | 84% | 0.843 | 78% | 0.776 | S | S | * | * | -171.1 | 144 | 116.4 | -122 | -87.2 | 0 | 0 | 0 | 113.5 | |||||
| 987 | S | 33.5 | Very low | 31.4 | Very low | 95 Ų | 95 | 138.4 Ų | 138.4 | 66% | 0.664 | 78% | 0.78 | S | S | * | * | trans | -100 | 160.2 | 157.2 | 69.8 | 0 | 0 | 0 | 0 | 108 | ||||
| 988 | P | 38 | Very low | 31.4 | Very low | 125 Ų | 125 | 138.5 Ų | 138.5 | 81% | 0.812 | 77% | 0.774 | S | S | * | * | -148.4 | -174.8 | 62.4 | 39.6 | -18.5 | 0 | 0 | 0 | 115.6 | |||||
| 989 | L | 28.7 | Very low | 31.3 | Very low | 166 Ų | 166 | 139.2 Ų | 139.2 | 87% | 0.869 | 77% | 0.767 | S | S | * | * | trans | -75.1 | 133.4 | 170.2 | -70.5 | 158.3 | 0 | 0 | 0 | 111.8 | ||||
| 990 | S | 30 | Very low | 31.3 | Very low | 108 Ų | 108 | 138.1 Ų | 138.1 | 76% | 0.755 | 76% | 0.763 | S | S | * | * | 169.5 | 150.6 | 107.9 | 54.3 | 0 | 0 | 0 | 0 | 114.7 | |||||
| 991 | R | 31.7 | Very low | 30.8 | Very low | 226 Ų | 226 | 141.2 Ų | 141.2 | 85% | 0.853 | 76% | 0.764 | S | S | * | * | trans | 41.4 | 103 | 158.3 | -64.6 | 177.8 | -178.2 | 172 | 2.1 | 118.5 | ||||
| 992 | I | 33 | Very low | 30.9 | Very low | 154 Ų | 154 | 141.9 Ų | 141.9 | 79% | 0.79 | 77% | 0.769 | S | S | * | * | 79.7 | 109.7 | 74.3 | -69.9 | 168.6 | 0 | 0 | 0 | 114.1 | |||||
| 993 | V | 29.8 | Very low | 30.8 | Very low | 123 Ų | 123 | 141.6 Ų | 141.6 | 75% | 0.745 | 77% | 0.772 | S | S | * | * | trans | 70 | 104.4 | 151.5 | 173.5 | 0 | 0 | 0 | 0 | 119.3 | ||||
| 994 | Q | 26.9 | Very low | 30.9 | Very low | 192 Ų | 192 | 145.3 Ų | 145.3 | 90% | 0.897 | 78% | 0.781 | S | S | * | * | -161.2 | -175 | 111 | -112.9 | 175.3 | 21.2 | 0 | 0 | 113.3 | |||||
| 995 | I | 29 | Very low | 32.2 | Very low | 148 Ų | 148 | 145.1 Ų | 145.1 | 76% | 0.759 | 78% | 0.777 | S | S | * | * | trans | -132.5 | 132.9 | -152.2 | -68.9 | 168.9 | 0 | 0 | 0 | 113.3 | ||||
| 996 | S | 29 | Very low | 32.4 | Very low | 97 Ų | 97 | 144.8 Ų | 144.8 | 68% | 0.678 | 78% | 0.779 | S | S | * | * | trans | 74.3 | 158.5 | 152.6 | 75.9 | 0 | 0 | 0 | 0 | 122.5 | ||||
| 997 | Q | 29.6 | Very low | 32.5 | Very low | 185 Ų | 185 | 140.4 Ų | 140.4 | 86% | 0.864 | 78% | 0.775 | S | S | * | * | trans | 89.6 | 144.1 | 167.1 | -57.3 | -170.1 | 38.5 | 0 | 0 | 117.5 | ||||
| 998 | A | 31.1 | Very low | 32.2 | Very low | 75 Ų | 75 | 140 Ų | 140 | 62% | 0.62 | 78% | 0.778 | S | S | * | * | cis | -170.6 | 176.8 | -21.4 | 0 | 0 | 0 | 0 | 0 | 110 | ||||
| 999 | Q | 29.1 | Very low | 32.1 | Very low | 163 Ų | 163 | 138.1 Ų | 138.1 | 76% | 0.762 | 77% | 0.772 | S | S | * | * | trans | 69.4 | 136.6 | 176.1 | -48.4 | -69.2 | -9.3 | 0 | 0 | 114.5 | ||||
| 1000 | R | 33.4 | Very low | 32.2 | Very low | 201 Ų | 201 | 137.2 Ų | 137.2 | 76% | 0.758 | 77% | 0.774 | S | S | * | * | cis | 101.3 | 114.8 | 21.7 | -82.2 | -168.7 | 164.4 | -166.1 | 0.7 | 115 | ||||
| 1001 | K | 32.6 | Very low | 32.2 | Very low | 179 Ų | 179 | 134.9 Ų | 134.9 | 78% | 0.778 | 77% | 0.767 | S | S | * | * | trans | 67 | 161.4 | 133.4 | -72.6 | -163.7 | 173.9 | -162.7 | 0 | 119.6 | ||||
| 1002 | S | 32.8 | Very low | 32 | Very low | 95 Ų | 95 | 130.3 Ų | 130.3 | 66% | 0.664 | 77% | 0.769 | S | S | * | * | cis | 178 | 138.9 | -31.6 | 57 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 1003 | S | 28.6 | Very low | 31.8 | Very low | 122 Ų | 122 | 128.8 Ų | 128.8 | 85% | 0.853 | 77% | 0.773 | S | S | * | * | trans | -179.9 | 166.2 | 154.2 | 47.5 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 1004 | M | 33.2 | Very low | 31.7 | Very low | 179 Ų | 179 | 126.9 Ų | 126.9 | 88% | 0.882 | 78% | 0.778 | S | S | * | * | -155.7 | -171.5 | -58 | -127.7 | -157.5 | 154.2 | 0 | 0 | 109.4 | |||||
| 1005 | P | 56.2 | Low | 32 | Very low | 108 Ų | 108 | 122.5 Ų | 122.5 | 70% | 0.701 | 77% | 0.774 | S | S | * | * | trans | -133 | -157 | -137 | 45.2 | -23.6 | 0 | 0 | 0 | 114.8 | ||||
| 1006 | S | 33.9 | Very low | 32.9 | Very low | 117 Ų | 117 | 121.2 Ų | 121.2 | 82% | 0.818 | 78% | 0.776 | S | S | * | * | trans | 144.4 | 147.2 | 143.5 | -168.3 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 1007 | A | 31.8 | Very low | 32.9 | Very low | 91 Ų | 91 | 120.6 Ų | 120.6 | 75% | 0.752 | 78% | 0.776 | S | S | * | * | cis | -102.1 | -157.7 | -1.1 | 0 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 1008 | A | 28 | Very low | 32.9 | Very low | 87 Ų | 87 | 119.2 Ų | 119.2 | 72% | 0.719 | 77% | 0.77 | S | S | * | * | cis | -149.5 | 167 | 0.2 | 0 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 1009 | A | 35.6 | Very low | 33 | Very low | 84 Ų | 84 | 127.4 Ų | 127.4 | 69% | 0.694 | 79% | 0.792 | S | S | * | * | cis | 72.7 | 131 | 25.8 | 0 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 1010 | T | 30.7 | Very low | 33.2 | Very low | 147 Ų | 147 | 125.7 Ų | 125.7 | 90% | 0.902 | 79% | 0.793 | S | S | * | * | cis | -162.8 | 160.2 | -8.6 | 10.2 | 0 | 0 | 0 | 0 | 108 | ||||
| 1011 | G | 29.5 | Very low | 33.2 | Very low | 59 Ų | 59 | 121.7 Ų | 121.7 | 61% | 0.608 | 80% | 0.795 | S | S | * | * | cis | 156.2 | 165.4 | -3 | 0 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 1012 | S | 28.8 | Very low | 33.2 | Very low | 130 Ų | 130 | 118.5 Ų | 118.5 | 91% | 0.909 | 80% | 0.796 | S | S | * | * | trans | 72 | 146.5 | 177.6 | 87.2 | 0 | 0 | 0 | 0 | 116.2 | ||||
| 1013 | S | 28.3 | Very low | 33.3 | Very low | 123 Ų | 123 | 119.9 Ų | 119.9 | 86% | 0.86 | 80% | 0.804 | S | S | * | * | cis | -152.5 | 163.7 | -10.4 | 58.8 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 1014 | G | 28.1 | Very low | 33.6 | Very low | 83 Ų | 83 | 119.8 Ų | 119.8 | 86% | 0.856 | 80% | 0.801 | S | S | * | * | trans | 135.7 | 120.7 | 171.6 | 0 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 1015 | A | 31.8 | Very low | 33.6 | Very low | 99 Ų | 99 | 115.8 Ų | 115.8 | 82% | 0.818 | 80% | 0.795 | S | S | * | * | trans | -140 | 179.6 | 173 | 0 | 0 | 0 | 0 | 0 | 107.1 | ||||
| 1016 | P | 49.3 | Very low | 32 | Very low | 122 Ų | 122 | 116.4 Ų | 116.4 | 79% | 0.792 | 80% | 0.802 | S | S | * | * | cis | -136.2 | -152.3 | 5.7 | 43.8 | -24 | 0 | 0 | 0 | 113.7 | ||||
| 1017 | A | 28.8 | Very low | 31.8 | Very low | 84 Ų | 84 | 116.3 Ų | 116.3 | 69% | 0.694 | 80% | 0.801 | S | S | * | * | trans | 72.5 | 125.3 | -179.1 | 0 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 1018 | E | 30.1 | Very low | 31.8 | Very low | 156 Ų | 156 | 118.4 Ų | 118.4 | 73% | 0.729 | 81% | 0.805 | S | S | * | * | 73.4 | 126.9 | 51.9 | -66.7 | -156.9 | 129.3 | 0 | 0 | 113.2 | |||||
| 1019 | K | 32.9 | Very low | 32.2 | Very low | 247 Ų | 247 | 121.3 Ų | 121.3 | 100% | 1.074 | 81% | 0.812 | S | S | * | * | cis | -155.7 | 0 | -3 | -138.9 | 167.9 | -171.5 | 152.6 | 0 | 112.7 |
Retrieved 1,019 of 1,019 residues in 266.4 ms
(Link to these results)