| 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 | 35.2 | Very low | 46.2 | Very low | 239 Ų | 239 | 127 Ų | 127 | 100% | 1.177 | 72% | 0.718 | S | S | * | * | 0 | 113.5 | 0 | -80 | -178.8 | 178.3 | 0 | 0 | 106.1 | S3 | M1-S3 PolarHBondContact O-N 3.37Š| |||
| 2 | D | 31.5 | Very low | 48.4 | Very low | 165 Ų | 165 | 129.2 Ų | 129.2 | 88% | 0.882 | 73% | 0.726 | S | S | * | * | trans | -60.3 | 121.3 | -175.9 | -70.3 | -53.9 | 0 | 0 | 0 | 110.6 | N4 | D2-N4 PolarHBondContact O-N 3.49Š| ||
| 3 | S | 27.9 | Very low | 49.6 | Very low | 110 Ų | 110 | 121.9 Ų | 121.9 | 77% | 0.769 | 69% | 0.687 | S | S | * | * | trans | -50.2 | 123.7 | 175.5 | -48.9 | 0 | 0 | 0 | 0 | 109.6 | M1 N5 | M1-S3 PolarHBondContact O-N 3.37Å; S3-N5 PolarHBondContact O-N 3.14Å | ||
| 4 | N | 39.6 | Very low | 50.9 | Low | 134 Ų | 134 | 117 Ų | 117 | 72% | 0.717 | 67% | 0.665 | S | S | * | * | trans | -40.8 | 110.3 | 173.5 | -86.4 | -16.4 | 0 | 0 | 0 | 110.5 | D2 L6 | D2-N4 PolarHBondContact O-N 3.49Å; N4-L6 HydrophobicContact CB-CG 4.38Å; N4-L6 PolarHBondContact O-N 3.08Å | ||
| 5 | N | 42 | Very low | 52.2 | Low | 164 Ų | 164 | 115.9 Ų | 115.9 | 88% | 0.877 | 67% | 0.667 | S | S | * | * | trans | -72.2 | 29.3 | 171.6 | -105.8 | -19.8 | 0 | 0 | 0 | 112 | S3 G7 | S3-N5 PolarHBondContact O-N 3.14Å; N5-G7 PolarHBondContact O-N 3.3Å | ||
| 6 | L | 45.4 | Very low | 53.1 | Low | 43 Ų | 43 | 113.6 Ų | 113.6 | 23% | 0.225 | 66% | 0.659 | C | S | . | * | trans | -71.1 | 89.8 | 160.7 | -64.3 | 178.8 | 0 | 0 | 0 | 105.3 | N4 K8 H21 Y25 | N4-L6 HydrophobicContact CB-CG 4.38Å; N4-L6 PolarHBondContact O-N 3.08Å; L6-K8 PolarHBondContact O-N 3.21Å; L6-H21 WeakPolarHBondContact CD2-NE2 3.38Å; L6-Y25 HydrophobicContact CD2-CD2 3.98Å; L6-Y25 HydrophobicContact CD2-CE2 4.47Å; L6-Y25 HydrophobicContact CD2-CG 4.2Å | ||
| 7 | G | 50.4 | Low | 53.5 | Low | 64 Ų | 64 | 112.8 Ų | 112.8 | 66% | 0.66 | 65% | 0.647 | S | S | * | * | trans | -41.8 | 129.9 | 173.4 | 0 | 0 | 0 | 0 | 0 | 109.2 | N5 L9 | N5-G7 PolarHBondContact O-N 3.3Å; G7-L9 PolarHBondContact O-N 3.07Å | ||
| 8 | K | 57 | Low | 54 | Low | 205 Ų | 205 | 109.6 Ų | 109.6 | 89% | 0.891 | 63% | 0.63 | S | S | * | * | trans | -33.7 | 106.9 | -169.7 | -65.4 | 176.8 | -179.7 | 178.5 | 0 | 111.2 | L6 | L6-K8 PolarHBondContact O-N 3.21Š| ||
| 9 | L | 57.6 | Low | 54.7 | Low | 57 Ų | 57 | 110.6 Ų | 110.6 | 30% | 0.298 | 63% | 0.627 | S | S | . | * | trans | -56 | 141 | 171.3 | -69.4 | 172.9 | 0 | 0 | 0 | 108 | G7 T13 V18 | G7-L9 PolarHBondContact O-N 3.07Å; L9-T13 HydrophobicContact CB-CG2 4.36Å; L9-T13 HydrophobicContact CD1-CG2 4.39Å; L9-V18 HydrophobicContact CD1-CB 4.25Å; L9-V18 HydrophobicContact CD1-CG1 4.1Å; L9-V18 HydrophobicContact CD1-CG2 3.81Å | ||
| 10 | P | 62.2 | Low | 55.1 | Low | 85 Ų | 85 | 107.1 Ų | 107.1 | 55% | 0.552 | 61% | 0.606 | S | S | * | * | trans | -49.1 | 143.5 | 177.1 | -27.4 | 32.9 | 0 | 0 | 0 | 111.3 | N12 T13 | P10-N12 PolarHBondContact O-N 3.38Å; P10-T13 VanDerWaalsContact CD-OG1 3.29Å; P10-T13 WeakPolarHBondContact CD-OG1 3.3Å; P10-T13 VanDerWaalsContact O-CB 3.28Å; P10-T13 WeakPolarHBondContact O-CB 3.48Å; P10-T13 PolarHBondContact O-N 2.96Å; P10-T13 PolarHBondContact O-OG1 2.74Å | ||
| 11 | P | 59.7 | Low | 55.4 | Low | 131 Ų | 131 | 105.8 Ų | 105.8 | 85% | 0.851 | 60% | 0.595 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -60.2 | -18.8 | -177.2 | 22.8 | -32.9 | 0 | 0 | 0 | 113.7 | ||
| 12 | N | 72.2 | Confident | 56.7 | Low | 153 Ų | 153 | 96.4 Ų | 96.4 | 82% | 0.818 | 55% | 0.553 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -94.4 | 10.4 | 178 | -61.2 | -13.6 | 0 | 0 | 0 | 113.5 | P10 S14 | P10-N12 PolarHBondContact O-N 3.38Å; N12-S14 PolarHBondContact O-N 3.17Å |
| 13 | T | 64.2 | Low | 58.3 | Low | 35 Ų | 35 | 91.2 Ų | 91.2 | 22% | 0.215 | 52% | 0.523 | C | S | . | . | trans | -69.3 | 119.3 | 178.7 | -51.1 | 0 | 0 | 0 | 0 | 109.1 | L9 P10 E17 V18 | L9-T13 HydrophobicContact CB-CG2 4.36Å; L9-T13 HydrophobicContact CD1-CG2 4.39Å; P10-T13 VanDerWaalsContact CD-OG1 3.29Å; P10-T13 WeakPolarHBondContact CD-OG1 3.3Å; P10-T13 VanDerWaalsContact O-CB 3.28Å; P10-T13 WeakPolarHBondContact O-CB 3.48Å; P10-T13 PolarHBondContact O-N 2.96Å; P10-T13 PolarHBondContact O-OG1 2.74Å; T13-E17 HydrophobicContact CG2-CB 3.44Å; T13-E17 VanDerWaalsContact CG2-CB 3.44Å; T13-V18 HydrophobicContact CG2-CG2 3.85Å | ||
| 14 | S | 68.3 | Low | 59.9 | Low | 53 Ų | 53 | 89.3 Ų | 89.3 | 37% | 0.371 | 51% | 0.509 | S | S | . | . | trans | -65.1 | 154.9 | 175 | 66.3 | 0 | 0 | 0 | 0 | 111.2 | N12 C16 E17 V18 | N12-S14 PolarHBondContact O-N 3.17Å; S14-C16 PolarHBondContact O-N 3.46Å; S14-C16 VanDerWaalsContact O-N 3.14Å; S14-E17 WeakPolarHBondContact CB-OE2 3.22Å; S14-E17 PolarHBondContact N-OE2 3.36Å; S14-E17 PolarHBondContact O-N 3.16Å; S14-E17 VanDerWaalsContact OG-CG 3.28Å; S14-E17 WeakPolarHBondContact OG-CG 3.44Å; S14-E17 PolarHBondContact OG-N 3.25Å; S14-E17 PolarHBondContact OG-OE2 3.21Å; S14-V18 WeakPolarHBondContact O-CG2 3.31Å; S14-V18 PolarHBondContact O-N 3.4Å | ||
| 15 | S | 69.3 | Low | 60.9 | Low | 101 Ų | 101 | 87.8 Ų | 87.8 | 71% | 0.706 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -57 | -29.7 | 175.2 | 55.8 | 0 | 0 | 0 | 0 | 113.2 | K19 | S15-K19 PolarHBondContact O-N 3Å; S15-K19 VanDerWaalsContact O-N 3.12Å |
| 16 | C | 67.6 | Low | 61.8 | Low | 78 Ų | 78 | 84.5 Ų | 84.5 | 53% | 0.527 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -66.5 | -46.4 | 174.3 | -66.5 | 0 | 0 | 0 | 0 | 111.3 | S14 V18 K19 D20 | S14-C16 PolarHBondContact O-N 3.46Å; S14-C16 VanDerWaalsContact O-N 3.14Å; C16-V18 VanDerWaalsContact C-N 3.33Å; C16-V18 PolarHBondContact O-N 3.37Å; C16-K19 PolarHBondContact O-N 3.48Å; C16-D20 VanDerWaalsContact O-CG 3.32Å; C16-D20 PolarHBondContact O-N 2.88Å |
| 17 | E | 60 | Low | 62.4 | Low | 100 Ų | 100 | 84.7 Ų | 84.7 | 47% | 0.467 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -65.1 | -36.5 | 177.7 | -71.6 | 164.4 | 135 | 0 | 0 | 112.3 | T13 S14 K19 D20 H21 | T13-E17 HydrophobicContact CG2-CB 3.44Å; T13-E17 VanDerWaalsContact CG2-CB 3.44Å; S14-E17 WeakPolarHBondContact CB-OE2 3.22Å; S14-E17 PolarHBondContact N-OE2 3.36Å; S14-E17 PolarHBondContact O-N 3.16Å; S14-E17 VanDerWaalsContact OG-CG 3.28Å; S14-E17 WeakPolarHBondContact OG-CG 3.44Å; S14-E17 PolarHBondContact OG-N 3.25Å; S14-E17 PolarHBondContact OG-OE2 3.21Å; E17-K19 VanDerWaalsContact C-N 3.34Å; E17-D20 PolarHBondContact O-N 3.47Å; E17-H21 VanDerWaalsContact O-CB 3.27Å; E17-H21 WeakPolarHBondContact O-CB 3.48Å; E17-H21 PolarHBondContact O-N 3.4Å |
| 18 | V | 61.8 | Low | 62.8 | Low | 56 Ų | 56 | 89.2 Ų | 89.2 | 34% | 0.339 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -59.9 | -47.2 | 173 | 179 | 0 | 0 | 0 | 0 | 110.2 | L9 T13 S14 C16 H21 S22 | L9-V18 HydrophobicContact CD1-CB 4.25Å; L9-V18 HydrophobicContact CD1-CG1 4.1Å; L9-V18 HydrophobicContact CD1-CG2 3.81Å; T13-V18 HydrophobicContact CG2-CG2 3.85Å; S14-V18 WeakPolarHBondContact O-CG2 3.31Å; S14-V18 PolarHBondContact O-N 3.4Å; C16-V18 VanDerWaalsContact C-N 3.33Å; C16-V18 PolarHBondContact O-N 3.37Å; V18-H21 PolarHBondContact O-N 3.16Å; V18-S22 PolarHBondContact O-N 2.88Å; V18-S22 PolarHBondContact O-OG 2.93Å |
| 19 | K | 67.2 | Low | 62.6 | Low | 129 Ų | 129 | 81.4 Ų | 81.4 | 56% | 0.561 | 45% | 0.452 | S | S | * | . | H | α-helix | trans | -63.9 | -46.6 | 179.6 | -172.7 | -177.5 | 179.4 | -173.2 | 0 | 111.7 | S15 C16 E17 H21 S22 E23 | S15-K19 PolarHBondContact O-N 3Å; S15-K19 VanDerWaalsContact O-N 3.12Å; C16-K19 PolarHBondContact O-N 3.48Å; E17-K19 VanDerWaalsContact C-N 3.34Å; K19-H21 VanDerWaalsContact C-N 3.25Å; K19-H21 PolarHBondContact O-N 3.33Å; K19-S22 PolarHBondContact O-N 3.39Å; K19-E23 WeakPolarHBondContact CE-OE1 3.49Å; K19-E23 WeakPolarHBondContact O-CG 3.44Å; K19-E23 PolarHBondContact O-N 2.94Å |
| 20 | D | 63.9 | Low | 62.5 | Low | 39 Ų | 39 | 84.1 Ų | 84.1 | 21% | 0.209 | 47% | 0.466 | C | S | . | . | H | α-helix | trans | -59.5 | -39.8 | 176.9 | -71.4 | -7.5 | 0 | 0 | 0 | 111 | C16 E17 E23 C24 F64 | C16-D20 VanDerWaalsContact O-CG 3.32Å; C16-D20 PolarHBondContact O-N 2.88Å; E17-D20 PolarHBondContact O-N 3.47Å; D20-E23 PolarHBondContact O-N 3.31Å; D20-C24 WeakPolarHBondContact O-CB 3.31Å; D20-C24 PolarHBondContact O-N 3.39Å; D20-C24 PolarHBondContact O-SG 3.23Å; D20-F64 HydrophobicContact CB-CE2 4.04Å; D20-F64 HydrophobicContact CB-CZ 4.17Å |
| 21 | H | 61.2 | Low | 62.1 | Low | 81 Ų | 81 | 82.7 Ų | 82.7 | 38% | 0.375 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -66 | -43.8 | 176.9 | -167.9 | 78 | 0 | 0 | 0 | 112.1 | L6 E17 V18 K19 C24 Y25 | L6-H21 WeakPolarHBondContact CD2-NE2 3.38Å; E17-H21 VanDerWaalsContact O-CB 3.27Å; E17-H21 WeakPolarHBondContact O-CB 3.48Å; E17-H21 PolarHBondContact O-N 3.4Å; V18-H21 PolarHBondContact O-N 3.16Å; K19-H21 VanDerWaalsContact C-N 3.25Å; K19-H21 PolarHBondContact O-N 3.33Å; H21-C24 PolarHBondContact O-N 3.44Å; H21-Y25 WeakPolarHBondContact O-CB 3.23Å; H21-Y25 PolarHBondContact O-N 2.87Å |
| 22 | S | 61.1 | Low | 61.7 | Low | 42 Ų | 42 | 81.6 Ų | 81.6 | 29% | 0.294 | 44% | 0.44 | S | S | . | . | H | α-helix | trans | -61.3 | -45.2 | 173.9 | -66.7 | 0 | 0 | 0 | 0 | 111.8 | V18 K19 C24 Y25 D26 | V18-S22 PolarHBondContact O-N 2.88Å; V18-S22 PolarHBondContact O-OG 2.93Å; K19-S22 PolarHBondContact O-N 3.39Å; S22-C24 VanDerWaalsContact C-N 3.31Å; S22-C24 PolarHBondContact O-N 2.81Å; S22-Y25 WeakPolarHBondContact O-CB 3.36Å; S22-Y25 PolarHBondContact O-N 3.48Å; S22-Y25 VanDerWaalsContact O-N 3.16Å; S22-D26 PolarHBondContact O-N 2.85Å |
| 23 | E | 65.5 | Low | 60.7 | Low | 56 Ų | 56 | 81 Ų | 81 | 26% | 0.262 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -62.2 | -38.6 | 176.7 | -71.6 | -173.7 | -165.1 | 0 | 0 | 111.7 | K19 D20 A27 F64 | K19-E23 WeakPolarHBondContact CE-OE1 3.49Å; K19-E23 WeakPolarHBondContact O-CG 3.44Å; K19-E23 PolarHBondContact O-N 2.94Å; D20-E23 PolarHBondContact O-N 3.31Å; E23-A27 VanDerWaalsContact O-CB 3.31Å; E23-A27 WeakPolarHBondContact O-CB 3.48Å; E23-A27 PolarHBondContact O-N 3.22Å; E23-F64 HydrophobicContact CB-CE1 4.25Å |
| 24 | C | 61.3 | Low | 59.9 | Low | 70 Ų | 70 | 83.4 Ų | 83.4 | 47% | 0.473 | 45% | 0.447 | S | S | . | . | H | α-helix | trans | -68.3 | -38 | 174.5 | -69.7 | 0 | 0 | 0 | 0 | 112.5 | D20 H21 S22 R28 | D20-C24 WeakPolarHBondContact O-CB 3.31Å; D20-C24 PolarHBondContact O-N 3.39Å; D20-C24 PolarHBondContact O-SG 3.23Å; H21-C24 PolarHBondContact O-N 3.44Å; S22-C24 VanDerWaalsContact C-N 3.31Å; S22-C24 PolarHBondContact O-N 2.81Å; C24-R28 WeakPolarHBondContact O-CB 3.41Å; C24-R28 PolarHBondContact O-N 3.14Å |
| 25 | Y | 62.1 | Low | 58.8 | Low | 101 Ų | 101 | 84.5 Ų | 84.5 | 40% | 0.396 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -64.5 | -46.6 | 175.7 | -176.7 | -94.4 | 0 | 0 | 0 | 110.8 | L6 H21 S22 A27 R28 C29 | L6-Y25 HydrophobicContact CD2-CD2 3.98Å; L6-Y25 HydrophobicContact CD2-CE2 4.47Å; L6-Y25 HydrophobicContact CD2-CG 4.2Å; H21-Y25 WeakPolarHBondContact O-CB 3.23Å; H21-Y25 PolarHBondContact O-N 2.87Å; S22-Y25 WeakPolarHBondContact O-CB 3.36Å; S22-Y25 PolarHBondContact O-N 3.48Å; S22-Y25 VanDerWaalsContact O-N 3.16Å; Y25-A27 PolarHBondContact O-N 3.13Å; Y25-R28 CarbonylContact O-C 3.58Å; Y25-R28 WeakPolarHBondContact O-CB 3.28Å; Y25-R28 PolarHBondContact O-N 2.99Å; Y25-R28 VanDerWaalsContact O-N 3.14Å; Y25-C29 WeakPolarHBondContact CE1-SG 3.11Å; Y25-C29 PolarHBondContact O-N 3.34Å; Y25-C29 PolarHBondContact O-SG 2.87Å |
| 26 | D | 59.9 | Low | 57.6 | Low | 95 Ų | 95 | 83.4 Ų | 83.4 | 51% | 0.508 | 45% | 0.452 | S | S | . | . | H | α-helix | trans | -61.3 | -44.9 | 176.2 | -70.6 | -16.1 | 0 | 0 | 0 | 111.2 | S22 R28 C29 L30 | S22-D26 PolarHBondContact O-N 2.85Å; D26-R28 VanDerWaalsContact C-N 3.3Å; D26-R28 PolarHBondContact O-N 3.17Å; D26-C29 PolarHBondContact O-N 2.84Å; D26-L30 WeakPolarHBondContact O-CB 3.4Å; D26-L30 VanDerWaalsContact O-CG 3.31Å; D26-L30 WeakPolarHBondContact O-CG 3.27Å; D26-L30 PolarHBondContact O-N 3.4Å |
| 27 | A | 58.3 | Low | 56.2 | Low | 47 Ų | 47 | 87.4 Ų | 87.4 | 39% | 0.388 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -59.6 | -40.6 | 174.3 | 0 | 0 | 0 | 0 | 0 | 111.9 | E23 Y25 L30 L31 | E23-A27 VanDerWaalsContact O-CB 3.31Å; E23-A27 WeakPolarHBondContact O-CB 3.48Å; E23-A27 PolarHBondContact O-N 3.22Å; Y25-A27 PolarHBondContact O-N 3.13Å; A27-L30 PolarHBondContact O-N 2.92Å; A27-L31 WeakPolarHBondContact O-CB 3.42Å; A27-L31 VanDerWaalsContact O-CG 3.23Å; A27-L31 WeakPolarHBondContact O-CG 3.34Å; A27-L31 PolarHBondContact O-N 3.09Å |
| 28 | R | 57.6 | Low | 55.2 | Low | 160 Ų | 160 | 88.8 Ų | 88.8 | 60% | 0.604 | 47% | 0.467 | S | S | * | . | H | α-helix | trans | -65.8 | -43.9 | 175 | -178.2 | -177.7 | 174.5 | -161.8 | -3 | 111.8 | C24 Y25 D26 L30 L31 L32 | C24-R28 WeakPolarHBondContact O-CB 3.41Å; C24-R28 PolarHBondContact O-N 3.14Å; Y25-R28 CarbonylContact O-C 3.58Å; Y25-R28 WeakPolarHBondContact O-CB 3.28Å; Y25-R28 PolarHBondContact O-N 2.99Å; Y25-R28 VanDerWaalsContact O-N 3.14Å; D26-R28 VanDerWaalsContact C-N 3.3Å; D26-R28 PolarHBondContact O-N 3.17Å; R28-L30 VanDerWaalsContact C-N 3.33Å; R28-L31 PolarHBondContact O-N 3.2Å; R28-L32 HydrophobicContact CG-CD1 4.06Å; R28-L32 HydrophobicContact CG-CG 4.44Å; R28-L32 WeakPolarHBondContact O-CB 3.42Å; R28-L32 VanDerWaalsContact O-CG 3.28Å; R28-L32 WeakPolarHBondContact O-CG 3.26Å; R28-L32 PolarHBondContact O-N 3.14Å |
| 29 | C | 54.6 | Low | 54.2 | Low | 41 Ų | 41 | 88 Ų | 88 | 28% | 0.277 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -61.9 | -42 | 176.3 | -75.5 | 0 | 0 | 0 | 0 | 111.4 | Y25 D26 L32 N33 | Y25-C29 WeakPolarHBondContact CE1-SG 3.11Å; Y25-C29 PolarHBondContact O-N 3.34Å; Y25-C29 PolarHBondContact O-SG 2.87Å; D26-C29 PolarHBondContact O-N 2.84Å; C29-L32 PolarHBondContact O-N 3.48Å; C29-N33 WeakPolarHBondContact O-CB 3.4Å; C29-N33 PolarHBondContact O-N 2.88Å |
| 30 | L | 55.3 | Low | 53 | Low | 113 Ų | 113 | 86.7 Ų | 86.7 | 59% | 0.592 | 47% | 0.466 | S | S | * | . | H | α-helix | trans | -61.3 | -45.6 | 172.3 | -72.2 | 168.6 | 0 | 0 | 0 | 111.5 | D26 A27 R28 L32 N33 I34 | D26-L30 WeakPolarHBondContact O-CB 3.4Å; D26-L30 VanDerWaalsContact O-CG 3.31Å; D26-L30 WeakPolarHBondContact O-CG 3.27Å; D26-L30 PolarHBondContact O-N 3.4Å; A27-L30 PolarHBondContact O-N 2.92Å; R28-L30 VanDerWaalsContact C-N 3.33Å; L30-L32 VanDerWaalsContact C-N 3.31Å; L30-L32 PolarHBondContact O-N 2.91Å; L30-N33 PolarHBondContact O-N 3.27Å; L30-I34 VanDerWaalsContact O-CG1 3.3Å; L30-I34 WeakPolarHBondContact O-CG1 3.21Å; L30-I34 PolarHBondContact O-N 3.03Å |
| 31 | L | 53.5 | Low | 51.8 | Low | 55 Ų | 55 | 88.4 Ų | 88.4 | 29% | 0.288 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -63.9 | -32.7 | 177.1 | -77 | 169.6 | 0 | 0 | 0 | 113.4 | A27 R28 T39 | A27-L31 WeakPolarHBondContact O-CB 3.42Å; A27-L31 VanDerWaalsContact O-CG 3.23Å; A27-L31 WeakPolarHBondContact O-CG 3.34Å; A27-L31 PolarHBondContact O-N 3.09Å; R28-L31 PolarHBondContact O-N 3.2Å; L31-T39 HydrophobicContact CB-CG2 4.34Å |
| 32 | L | 50.6 | Low | 51 | Low | 109 Ų | 109 | 87.7 Ų | 87.7 | 57% | 0.571 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -76.4 | -27.3 | 175.2 | -70.8 | 170.5 | 0 | 0 | 0 | 112.4 | R28 C29 L30 I34 | R28-L32 HydrophobicContact CG-CD1 4.06Å; R28-L32 HydrophobicContact CG-CG 4.44Å; R28-L32 WeakPolarHBondContact O-CB 3.42Å; R28-L32 VanDerWaalsContact O-CG 3.28Å; R28-L32 WeakPolarHBondContact O-CG 3.26Å; R28-L32 PolarHBondContact O-N 3.14Å; C29-L32 PolarHBondContact O-N 3.48Å; L30-L32 VanDerWaalsContact C-N 3.31Å; L30-L32 PolarHBondContact O-N 2.91Å; L32-I34 VanDerWaalsContact C-N 3.33Å |
| 33 | N | 51.5 | Low | 50 | Low | 141 Ų | 141 | 87 Ų | 87 | 75% | 0.754 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -79 | -17.9 | 172.3 | -78.8 | -21 | 0 | 0 | 0 | 112.9 | C29 L30 | C29-N33 WeakPolarHBondContact O-CB 3.4Å; C29-N33 PolarHBondContact O-N 2.88Å; L30-N33 PolarHBondContact O-N 3.27Å |
| 34 | I | 47.8 | Very low | 48.7 | Very low | 84 Ų | 84 | 94.7 Ų | 94.7 | 43% | 0.431 | 51% | 0.513 | S | S | . | . | S | Bend | trans | -86.8 | 126.9 | 169.3 | -62.2 | 162.8 | 0 | 0 | 0 | 107 | L30 L32 F38 | L30-I34 VanDerWaalsContact O-CG1 3.3Å; L30-I34 WeakPolarHBondContact O-CG1 3.21Å; L30-I34 PolarHBondContact O-N 3.03Å; L32-I34 VanDerWaalsContact C-N 3.33Å; I34-F38 HydrophobicContact CG2-CB 3.93Å; I34-F38 HydrophobicContact CG2-CD2 4.29Å; I34-F38 HydrophobicContact CG2-CG 4.22Å |
| 35 | S | 45.1 | Very low | 48 | Very low | 76 Ų | 76 | 98.2 Ų | 98.2 | 53% | 0.531 | 52% | 0.522 | S | S | . | . | trans | -29 | 135.1 | 179.3 | 177.7 | 0 | 0 | 0 | 0 | 114.2 | H37 F38 | S35-H37 PolarHBondContact O-N 3.45Å; S35-F38 PolarHBondContact O-N 3.14Å | ||
| 36 | A | 43 | Very low | 47.1 | Very low | 78 Ų | 78 | 95.8 Ų | 95.8 | 65% | 0.645 | 52% | 0.524 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -48.8 | -13.7 | -176.6 | 0 | 0 | 0 | 0 | 0 | 115.6 | T39 | A36-T39 WeakPolarHBondContact CA-OG1 3.2Å; A36-T39 PolarHBondContact O-OG1 3.45Å |
| 37 | H | 39.1 | Very low | 46.2 | Very low | 163 Ų | 163 | 98.6 Ų | 98.6 | 76% | 0.755 | 53% | 0.528 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -77.9 | -17.8 | 176.8 | -65.5 | -64.4 | 0 | 0 | 0 | 114.7 | S35 | S35-H37 PolarHBondContact O-N 3.45Š|
| 38 | F | 39.7 | Very low | 45.5 | Very low | 129 Ų | 129 | 98.6 Ų | 98.6 | 57% | 0.566 | 53% | 0.532 | S | S | * | . | S | Bend | trans | -95.6 | -16 | 176.7 | -92.2 | -89.1 | 0 | 0 | 0 | 113.9 | I34 S35 T40 T42 | I34-F38 HydrophobicContact CG2-CB 3.93Å; I34-F38 HydrophobicContact CG2-CD2 4.29Å; I34-F38 HydrophobicContact CG2-CG 4.22Å; S35-F38 PolarHBondContact O-N 3.14Å; F38-T40 VanDerWaalsContact C-N 3.33Å; F38-T40 PolarHBondContact O-N 3.31Å; F38-T42 PolarHBondContact O-OG1 2.91Å |
| 39 | T | 40.8 | Very low | 44.8 | Very low | 39 Ų | 39 | 94.3 Ų | 94.3 | 24% | 0.239 | 52% | 0.521 | C | S | . | . | H | α-helix | trans | -78.8 | -14.8 | -168.7 | -9 | 0 | 0 | 0 | 0 | 113.5 | L31 A36 G43 | L31-T39 HydrophobicContact CB-CG2 4.34Å; A36-T39 WeakPolarHBondContact CA-OG1 3.2Å; A36-T39 PolarHBondContact O-OG1 3.45Å; T39-G43 WeakPolarHBondContact O-CA 3.43Å; T39-G43 PolarHBondContact O-N 3.12Å; T39-G43 VanDerWaalsContact O-N 3.09Å |
| 40 | T | 40.3 | Very low | 44.2 | Very low | 102 Ų | 102 | 99.4 Ų | 99.4 | 63% | 0.626 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -80.4 | -29 | -174.7 | 32.9 | 0 | 0 | 0 | 0 | 114.3 | F38 | F38-T40 VanDerWaalsContact C-N 3.33Å; F38-T40 PolarHBondContact O-N 3.31Å |
| 41 | A | 39.4 | Very low | 43.6 | Very low | 74 Ų | 74 | 101.2 Ų | 101.2 | 61% | 0.612 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -83.8 | -46.4 | 179.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||
| 42 | T | 45.4 | Very low | 43 | Very low | 67 Ų | 67 | 101.5 Ų | 101.5 | 41% | 0.411 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -78.4 | -30.1 | 179.6 | 29.8 | 0 | 0 | 0 | 0 | 113.3 | F38 A46 | F38-T42 PolarHBondContact O-OG1 2.91Å; T42-A46 VanDerWaalsContact O-CB 3.26Å; T42-A46 WeakPolarHBondContact O-CB 3.42Å; T42-A46 PolarHBondContact O-N 2.94Å; T42-A46 VanDerWaalsContact O-N 3.13Å |
| 43 | G | 39.1 | Very low | 42.6 | Very low | 28 Ų | 28 | 102.4 Ų | 102.4 | 29% | 0.289 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -71.5 | -36.7 | 179.3 | 0 | 0 | 0 | 0 | 0 | 113.9 | T39 Y47 | T39-G43 WeakPolarHBondContact O-CA 3.43Å; T39-G43 PolarHBondContact O-N 3.12Å; T39-G43 VanDerWaalsContact O-N 3.09Å; G43-Y47 WeakPolarHBondContact O-CB 3.45Å; G43-Y47 PolarHBondContact O-N 3.25Å |
| 44 | R | 38.9 | Very low | 42.2 | Very low | 216 Ų | 216 | 98.9 Ų | 98.9 | 82% | 0.815 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -69.3 | -38.8 | 179.7 | -106.1 | -178.1 | 177.7 | 177.8 | 0.3 | 112.5 | G48 | R44-G48 PolarHBondContact O-N 2.94Å |
| 45 | E | 45.1 | Very low | 41.7 | Very low | 144 Ų | 144 | 101.6 Ų | 101.6 | 67% | 0.673 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -71.2 | -46.6 | 176 | -68 | -172 | 158.1 | 0 | 0 | 110.9 | Y47 G48 L49 | E45-Y47 PolarHBondContact O-N 2.85Å; E45-G48 PolarHBondContact O-N 3.27Å; E45-L49 WeakPolarHBondContact O-CB 3.46Å; E45-L49 WeakPolarHBondContact O-CD1 3.47Å; E45-L49 WeakPolarHBondContact O-CG 3.28Å; E45-L49 PolarHBondContact O-N 3.39Å; E45-L49 VanDerWaalsContact O-N 3.11Å |
| 46 | A | 43.6 | Very low | 41.5 | Very low | 51 Ų | 51 | 102.8 Ų | 102.8 | 42% | 0.421 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -62.4 | -38.7 | 178 | 0 | 0 | 0 | 0 | 0 | 113.2 | T42 L50 | T42-A46 VanDerWaalsContact O-CB 3.26Å; T42-A46 WeakPolarHBondContact O-CB 3.42Å; T42-A46 PolarHBondContact O-N 2.94Å; T42-A46 VanDerWaalsContact O-N 3.13Å; A46-L50 WeakPolarHBondContact O-CG 3.28Å; A46-L50 PolarHBondContact O-N 3.23Å |
| 47 | Y | 41.3 | Very low | 41.4 | Very low | 154 Ų | 154 | 106.3 Ų | 106.3 | 60% | 0.604 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -78.9 | -30.9 | -179.6 | -153.5 | -95.6 | 0 | 0 | 0 | 113 | G43 E45 L49 K51 | G43-Y47 WeakPolarHBondContact O-CB 3.45Å; G43-Y47 PolarHBondContact O-N 3.25Å; E45-Y47 PolarHBondContact O-N 2.85Å; Y47-L49 VanDerWaalsContact C-N 3.31Å; Y47-K51 HydrophobicContact CE1-CD 4.16Å; Y47-K51 PolarHBondContact O-N 3.28Å |
| 48 | G | 43.9 | Very low | 41.4 | Very low | 46 Ų | 46 | 106.6 Ų | 106.6 | 47% | 0.474 | 58% | 0.576 | S | S | . | * | H | α-helix | trans | -66.8 | -33.2 | 171.8 | 0 | 0 | 0 | 0 | 0 | 112.8 | R44 E45 T52 | R44-G48 PolarHBondContact O-N 2.94Å; E45-G48 PolarHBondContact O-N 3.27Å; G48-T52 PolarHBondContact O-OG1 3.11Å; G48-T52 VanDerWaalsContact O-OG1 3.1Å |
| 49 | L | 42.2 | Very low | 41.3 | Very low | 71 Ų | 71 | 105 Ų | 105 | 37% | 0.372 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -77.8 | -31.1 | 178.7 | -72.1 | 162.4 | 0 | 0 | 0 | 113.6 | E45 Y47 K51 T52 W63 | E45-L49 WeakPolarHBondContact O-CB 3.46Å; E45-L49 WeakPolarHBondContact O-CD1 3.47Å; E45-L49 WeakPolarHBondContact O-CG 3.28Å; E45-L49 PolarHBondContact O-N 3.39Å; E45-L49 VanDerWaalsContact O-N 3.11Å; Y47-L49 VanDerWaalsContact C-N 3.31Å; L49-K51 VanDerWaalsContact C-N 3.34Å; L49-T52 PolarHBondContact O-OG1 3.39Å; L49-W63 HydrophobicContact CD1-CE3 4.1Å; L49-W63 HydrophobicContact CD1-CH2 3.89Å; L49-W63 HydrophobicContact CD1-CZ3 3.28Å; L49-W63 HydrophobicContact CD2-CH2 3.25Å; L49-W63 HydrophobicContact CD2-CZ2 4.05Å; L49-W63 HydrophobicContact CD2-CZ3 3.59Å; L49-W63 HydrophobicContact CG-CH2 4.21Å; L49-W63 HydrophobicContact CG-CZ3 4.06Å |
| 50 | L | 42 | Very low | 41.3 | Very low | 148 Ų | 148 | 107.3 Ų | 107.3 | 78% | 0.775 | 59% | 0.593 | S | S | * | * | H | α-helix | trans | -75.3 | -21.9 | 174.7 | -77.6 | 165 | 0 | 0 | 0 | 113.4 | A46 | A46-L50 WeakPolarHBondContact O-CG 3.28Å; A46-L50 PolarHBondContact O-N 3.23Å |
| 51 | K | 42.5 | Very low | 41.4 | Very low | 151 Ų | 151 | 108.5 Ų | 108.5 | 66% | 0.657 | 60% | 0.595 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -94.3 | 6.3 | 179.7 | -87.8 | -164.8 | 175 | -173.1 | 0 | 114.4 | Y47 L49 P53 | Y47-K51 HydrophobicContact CE1-CD 4.16Å; Y47-K51 PolarHBondContact O-N 3.28Å; L49-K51 VanDerWaalsContact C-N 3.34Å; K51-P53 WeakPolarHBondContact O-CD 3.01Å |
| 52 | T | 42.1 | Very low | 41.5 | Very low | 60 Ų | 60 | 111.3 Ų | 111.3 | 37% | 0.368 | 60% | 0.599 | S | S | . | * | trans | -88.9 | 105.7 | 175.6 | -19.4 | 0 | 0 | 0 | 0 | 110 | G48 L49 A54 | G48-T52 PolarHBondContact O-OG1 3.11Å; G48-T52 VanDerWaalsContact O-OG1 3.1Å; L49-T52 PolarHBondContact O-OG1 3.39Å; T52-A54 HydrophobicContact CG2-CB 3.68Å; T52-A54 PolarHBondContact O-N 3.04Å | ||
| 53 | P | 41 | Very low | 41.3 | Very low | 129 Ų | 129 | 113.9 Ų | 113.9 | 84% | 0.838 | 60% | 0.601 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67.6 | 16.4 | 171.8 | 28.7 | -35.6 | 0 | 0 | 0 | 113.4 | K51 | K51-P53 WeakPolarHBondContact O-CD 3.01Š|
| 54 | A | 42.9 | Very low | 41.3 | Very low | 67 Ų | 67 | 115 Ų | 115 | 55% | 0.554 | 60% | 0.598 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -93.7 | 2.9 | -166.2 | 0 | 0 | 0 | 0 | 0 | 115 | T52 | T52-A54 HydrophobicContact CG2-CB 3.68Å; T52-A54 PolarHBondContact O-N 3.04Å |
| 55 | Y | 38.6 | Very low | 41.4 | Very low | 140 Ų | 140 | 110.5 Ų | 110.5 | 55% | 0.549 | 59% | 0.59 | S | S | . | * | trans | -111.5 | 63.6 | 179.9 | -61.4 | -71.8 | 0 | 0 | 0 | 111.4 | N57 | Y55-N57 VanDerWaalsContact C-N 3.3Å; Y55-N57 PolarHBondContact O-N 3.38Å | ||
| 56 | S | 39.9 | Very low | 41.2 | Very low | 102 Ų | 102 | 111.9 Ų | 111.9 | 71% | 0.713 | 59% | 0.594 | S | S | * | * | S | Bend | trans | -76.6 | -8.1 | -179.8 | 60.3 | 0 | 0 | 0 | 0 | 114.8 | ||
| 57 | N | 42 | Very low | 41 | Very low | 152 Ų | 152 | 115.1 Ų | 115.1 | 81% | 0.813 | 60% | 0.604 | S | S | * | * | S | Bend | trans | -155.3 | 20.6 | -170.2 | -84.3 | -37.3 | 0 | 0 | 0 | 115.6 | Y55 | Y55-N57 VanDerWaalsContact C-N 3.3Å; Y55-N57 PolarHBondContact O-N 3.38Å |
| 58 | K | 37.7 | Very low | 40.9 | Very low | 169 Ų | 169 | 116.4 Ų | 116.4 | 74% | 0.735 | 61% | 0.607 | S | S | * | * | S | Bend | trans | -136.4 | 132.6 | 179.3 | -68.6 | -170.2 | 179.9 | -178.8 | 0 | 112.1 | T60 | K58-T60 PolarHBondContact O-N 3.39Š|
| 59 | P | 38.3 | Very low | 40.8 | Very low | 94 Ų | 94 | 124.9 Ų | 124.9 | 61% | 0.61 | 63% | 0.625 | S | S | * | * | trans | -67.6 | 130.9 | -174.5 | 28.3 | -33.4 | 0 | 0 | 0 | 109.9 | L61 | P59-L61 HydrophobicContact CB-CB 4.23Å; P59-L61 HydrophobicContact CB-CD1 3.86Å; P59-L61 PolarHBondContact O-N 2.73Å | ||
| 60 | T | 42 | Very low | 40.5 | Very low | 88 Ų | 88 | 124.7 Ų | 124.7 | 54% | 0.54 | 63% | 0.63 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -52.9 | -3 | 169.8 | -40.6 | 0 | 0 | 0 | 0 | 113.6 | K58 L62 W63 | K58-T60 PolarHBondContact O-N 3.39Å; T60-L62 VanDerWaalsContact C-N 3.27Å; T60-L62 PolarHBondContact O-N 3.03Å; T60-W63 PolarHBondContact O-N 2.8Å |
| 61 | L | 41.6 | Very low | 40.5 | Very low | 127 Ų | 127 | 121.2 Ų | 121.2 | 67% | 0.665 | 62% | 0.616 | S | S | * | * | H | α-helix | trans | -61.6 | -18.2 | -179.1 | -98.5 | 106.7 | 0 | 0 | 0 | 116.2 | P59 W63 | P59-L61 HydrophobicContact CB-CB 4.23Å; P59-L61 HydrophobicContact CB-CD1 3.86Å; P59-L61 PolarHBondContact O-N 2.73Å; L61-W63 VanDerWaalsContact C-N 3.34Å |
| 62 | L | 40.7 | Very low | 40.4 | Very low | 133 Ų | 133 | 120.2 Ų | 120.2 | 70% | 0.696 | 62% | 0.623 | S | S | * | * | H | α-helix | trans | -79 | -14.7 | -178.8 | -92.1 | 160 | 0 | 0 | 0 | 114.1 | T60 | T60-L62 VanDerWaalsContact C-N 3.27Å; T60-L62 PolarHBondContact O-N 3.03Å |
| 63 | W | 41.5 | Very low | 40.3 | Very low | 121 Ų | 121 | 125.8 Ų | 125.8 | 46% | 0.458 | 65% | 0.645 | S | S | . | * | H | α-helix | trans | -93.8 | -31.1 | -167.8 | -73.1 | 63.3 | 0 | 0 | 0 | 113.4 | L49 T60 L61 N65 K66 L67 | L49-W63 HydrophobicContact CD1-CE3 4.1Å; L49-W63 HydrophobicContact CD1-CH2 3.89Å; L49-W63 HydrophobicContact CD1-CZ3 3.28Å; L49-W63 HydrophobicContact CD2-CH2 3.25Å; L49-W63 HydrophobicContact CD2-CZ2 4.05Å; L49-W63 HydrophobicContact CD2-CZ3 3.59Å; L49-W63 HydrophobicContact CG-CH2 4.21Å; L49-W63 HydrophobicContact CG-CZ3 4.06Å; T60-W63 PolarHBondContact O-N 2.8Å; L61-W63 VanDerWaalsContact C-N 3.34Å; W63-N65 PolarHBondContact O-N 2.94Å; W63-K66 PolarHBondContact O-N 2.96Å; W63-L67 PolarHBondContact O-N 3.28Å; W63-L67 VanDerWaalsContact O-N 3.16Å |
| 64 | F | 39.1 | Very low | 40.1 | Very low | 51 Ų | 51 | 124.3 Ų | 124.3 | 22% | 0.224 | 63% | 0.633 | C | S | . | * | H | α-helix | trans | -69.6 | -33.2 | 179.2 | -82.8 | -87.2 | 0 | 0 | 0 | 114 | D20 E23 K66 R68 | D20-F64 HydrophobicContact CB-CE2 4.04Å; D20-F64 HydrophobicContact CB-CZ 4.17Å; E23-F64 HydrophobicContact CB-CE1 4.25Å; F64-K66 VanDerWaalsContact C-N 3.33Å; F64-K66 PolarHBondContact O-N 3.22Å; F64-R68 WeakPolarHBondContact O-CB 3.29Å; F64-R68 PolarHBondContact O-N 2.89Å |
| 65 | N | 40.5 | Very low | 39.8 | Very low | 122 Ų | 122 | 127.7 Ų | 127.7 | 65% | 0.652 | 64% | 0.641 | S | S | * | * | H | α-helix | trans | -74.4 | -20.3 | 177.9 | -86.1 | -24.6 | 0 | 0 | 0 | 113.8 | W63 | W63-N65 PolarHBondContact O-N 2.94Å |
| 66 | K | 41.9 | Very low | 39.4 | Very low | 173 Ų | 173 | 130 Ų | 130 | 75% | 0.752 | 66% | 0.656 | S | S | * | * | H | α-helix | trans | -87.3 | -34.6 | 172.7 | -74.9 | -170.2 | 175.6 | -175.6 | 0 | 112.3 | W63 F64 | W63-K66 PolarHBondContact O-N 2.96Å; F64-K66 VanDerWaalsContact C-N 3.33Å; F64-K66 PolarHBondContact O-N 3.22Å |
| 67 | L | 38.9 | Very low | 38.9 | Very low | 120 Ų | 120 | 128.3 Ų | 128.3 | 63% | 0.628 | 65% | 0.649 | S | S | * | * | H | α-helix | trans | -71.5 | -32.2 | 175.5 | -83.1 | 156.6 | 0 | 0 | 0 | 113.3 | W63 R69 | W63-L67 PolarHBondContact O-N 3.28Å; W63-L67 VanDerWaalsContact O-N 3.16Å; L67-R69 VanDerWaalsContact C-N 3.3Å; L67-R69 PolarHBondContact O-N 3.43Å |
| 68 | R | 39.9 | Very low | 38.4 | Very low | 181 Ų | 181 | 126.8 Ų | 126.8 | 68% | 0.683 | 65% | 0.645 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.4 | -11.6 | 176 | -89.3 | -173.8 | 176.8 | 169.9 | 5 | 115.4 | F64 | F64-R68 WeakPolarHBondContact O-CB 3.29Å; F64-R68 PolarHBondContact O-N 2.89Å |
| 69 | R | 41.2 | Very low | 38 | Very low | 223 Ų | 223 | 123.3 Ų | 123.3 | 84% | 0.842 | 64% | 0.642 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -103.3 | 0.1 | -178.7 | -79.4 | -172.9 | 174.9 | -175.2 | -0.7 | 114.7 | L67 | L67-R69 VanDerWaalsContact C-N 3.3Å; L67-R69 PolarHBondContact O-N 3.43Å |
| 70 | S | 36.9 | Very low | 37.6 | Very low | 68 Ų | 68 | 128.2 Ų | 128.2 | 48% | 0.476 | 65% | 0.654 | S | S | . | * | S | Bend | trans | -160.3 | 95.5 | 179.9 | 173.3 | 0 | 0 | 0 | 0 | 110 | ||
| 71 | P | 41.1 | Very low | 36.8 | Very low | 74 Ų | 74 | 132.2 Ų | 132.2 | 48% | 0.481 | 67% | 0.667 | S | S | . | * | S | Bend | -140.3 | 1 | 96.9 | 22.6 | -1.6 | 0 | 0 | 0 | 115.6 | Q73 V74 L75 | P71-Q73 PolarHBondContact O-N 3.1Å; P71-Q73 VanDerWaalsContact O-N 3.14Å; P71-V74 PolarHBondContact O-N 2.92Å; P71-L75 PolarHBondContact O-N 3.46Å | |
| 72 | T | 40.7 | Very low | 36.3 | Very low | 130 Ų | 130 | 131.7 Ų | 131.7 | 80% | 0.798 | 67% | 0.669 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71 | -5.8 | -177.8 | 27.9 | 0 | 0 | 0 | 0 | 114.9 | ||
| 73 | Q | 39 | Very low | 35.8 | Very low | 178 Ų | 178 | 141 Ų | 141 | 83% | 0.832 | 70% | 0.695 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -119.1 | 1.9 | 176.2 | -73 | -174.9 | -21.7 | 0 | 0 | 114.5 | P71 | P71-Q73 PolarHBondContact O-N 3.1Å; P71-Q73 VanDerWaalsContact O-N 3.14Å |
| 74 | V | 37.6 | Very low | 35.5 | Very low | 98 Ų | 98 | 142.1 Ų | 142.1 | 59% | 0.594 | 71% | 0.707 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -124.1 | 0.7 | -178.3 | -171.4 | 0 | 0 | 0 | 0 | 113.2 | P71 H76 | P71-V74 PolarHBondContact O-N 2.92Å; V74-H76 PolarHBondContact O-N 2.98Å; V74-H76 VanDerWaalsContact O-N 3.08Å |
| 75 | L | 36.4 | Very low | 35.3 | Very low | 138 Ų | 138 | 146.8 Ų | 146.8 | 72% | 0.723 | 73% | 0.732 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74.3 | 11.6 | 168.8 | -77.3 | 163.8 | 0 | 0 | 0 | 113.7 | P71 | P71-L75 PolarHBondContact O-N 3.46Š|
| 76 | H | 30.4 | Very low | 35 | Very low | 187 Ų | 187 | 148.2 Ų | 148.2 | 87% | 0.866 | 74% | 0.737 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -105.8 | 11.5 | -179.1 | -144.8 | -71.7 | 0 | 0 | 0 | 114.2 | V74 | V74-H76 PolarHBondContact O-N 2.98Å; V74-H76 VanDerWaalsContact O-N 3.08Å |
| 77 | A | 28.8 | Very low | 34.6 | Very low | 68 Ų | 68 | 146.8 Ų | 146.8 | 56% | 0.562 | 74% | 0.736 | S | S | * | * | S | Bend | trans | -130 | 129.1 | 179.9 | 0 | 0 | 0 | 0 | 0 | 110.2 | ||
| 78 | T | 31.8 | Very low | 34.3 | Very low | 120 Ų | 120 | 148.4 Ų | 148.4 | 74% | 0.736 | 74% | 0.743 | S | S | * | * | trans | 79.9 | 78.9 | -177.7 | 60.2 | 0 | 0 | 0 | 0 | 115 | ||||
| 79 | S | 29.3 | Very low | 33.9 | Very low | 96 Ų | 96 | 146.3 Ų | 146.3 | 67% | 0.671 | 75% | 0.747 | S | S | * | * | 40.3 | 73.4 | 77 | 79.7 | 0 | 0 | 0 | 0 | 113.1 | E81 | S79-E81 PolarHBondContact O-N 2.63Š| |||
| 80 | F | 30.2 | Very low | 33.4 | Very low | 197 Ų | 197 | 140.8 Ų | 140.8 | 86% | 0.864 | 74% | 0.74 | S | S | * | * | trans | -80.2 | 62.6 | 142.9 | -86.1 | -88.6 | 0 | 0 | 0 | 108.2 | T82 | F80-T82 VanDerWaalsContact C-N 3.27Å; F80-T82 PolarHBondContact O-N 2.86Å | ||
| 81 | E | 25.6 | Very low | 33.2 | Very low | 172 Ų | 172 | 146.4 Ų | 146.4 | 80% | 0.804 | 76% | 0.76 | S | S | * | * | trans | -75.9 | 89.4 | 148.9 | -81.2 | -171.4 | 152.9 | 0 | 0 | 106.3 | S79 | S79-E81 PolarHBondContact O-N 2.63Š| ||
| 82 | T | 30.8 | Very low | 32.5 | Very low | 116 Ų | 116 | 152.4 Ų | 152.4 | 71% | 0.712 | 78% | 0.783 | S | S | * | * | trans | -172.5 | 101.7 | 149.3 | 38 | 0 | 0 | 0 | 0 | 106.7 | F80 | F80-T82 VanDerWaalsContact C-N 3.27Å; F80-T82 PolarHBondContact O-N 2.86Å | ||
| 83 | R | 29.5 | Very low | 31.8 | Very low | 329 Ų | 329 | 154.5 Ų | 154.5 | 100% | 1.242 | 78% | 0.782 | S | S | * | * | trans | 37.6 | 0 | 156.4 | -71.9 | -177.7 | 176 | 176.4 | -1.2 | 119.3 |
Retrieved 83 of 83 residues in 34.2 ms
(Link to these results)