| 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 | 50.7 | Low | 63.8 | Low | 248 Ų | 248 | 152.2 Ų | 152.2 | 100% | 1.222 | 87% | 0.868 | S | S | * | * | 0 | 123.2 | 0 | -84.1 | 176.8 | 162.9 | 0 | 0 | 109.3 | G3 | M1-G3 PolarHBondContact O-N 3.23Š| |||
| 2 | T | 58.2 | Low | 65.2 | Low | 143 Ų | 143 | 145 Ų | 145 | 88% | 0.877 | 85% | 0.853 | S | S | * | * | trans | -70.6 | 114.5 | -176.9 | 44.7 | 0 | 0 | 0 | 0 | 112 | R4 | T2-R4 PolarHBondContact O-N 2.83Š| ||
| 3 | G | 64.9 | Low | 66.6 | Low | 83 Ų | 83 | 149.8 Ų | 149.8 | 86% | 0.856 | 86% | 0.857 | S | S | * | * | trans | -77 | 84.4 | 171.7 | 0 | 0 | 0 | 0 | 0 | 111.2 | M1 G5 | M1-G3 PolarHBondContact O-N 3.23Å; G3-G5 PolarHBondContact O-N 3.12Å; G3-G5 VanDerWaalsContact O-N 3.17Å | ||
| 4 | R | 61.1 | Low | 68.2 | Low | 240 Ų | 240 | 146.8 Ų | 146.8 | 91% | 0.906 | 85% | 0.849 | S | S | * | * | trans | -43 | 112.9 | 174.1 | -166 | 162.9 | 175.2 | 127 | -6.6 | 110.8 | T2 K6 | T2-R4 PolarHBondContact O-N 2.83Å; R4-K6 PolarHBondContact O-N 2.81Å | ||
| 5 | G | 61.9 | Low | 69.8 | Low | 69 Ų | 69 | 147.1 Ų | 147.1 | 71% | 0.711 | 84% | 0.836 | S | S | * | * | trans | -52.5 | 120.7 | -179.7 | 0 | 0 | 0 | 0 | 0 | 110.9 | G3 G7 | G3-G5 PolarHBondContact O-N 3.12Å; G3-G5 VanDerWaalsContact O-N 3.17Å; G5-G7 PolarHBondContact O-N 2.85Å | ||
| 6 | K | 62.8 | Low | 71.4 | Confident | 209 Ų | 209 | 141.9 Ų | 141.9 | 91% | 0.909 | 81% | 0.812 | S | S | * | * | trans | -49.7 | 111.8 | 170 | -101.9 | 176.1 | 172.8 | 171.9 | 0 | 107.5 | R4 G8 | R4-K6 PolarHBondContact O-N 2.81Å; K6-G8 PolarHBondContact O-N 2.95Å | ||
| 7 | G | 59.4 | Low | 72.9 | Confident | 72 Ų | 72 | 139.2 Ų | 139.2 | 74% | 0.742 | 79% | 0.785 | S | S | * | * | trans | -44.5 | 115.6 | 176.8 | 0 | 0 | 0 | 0 | 0 | 109.4 | G5 K9 | G5-G7 PolarHBondContact O-N 2.85Å; G7-K9 PolarHBondContact O-N 3Å | ||
| 8 | G | 66.9 | Low | 74.3 | Confident | 72 Ų | 72 | 132.3 Ų | 132.3 | 74% | 0.742 | 75% | 0.748 | S | S | * | * | trans | -59.1 | 108.4 | 179.7 | 0 | 0 | 0 | 0 | 0 | 107.4 | K6 V10 | K6-G8 PolarHBondContact O-N 2.95Å; G8-V10 PolarHBondContact O-N 3.36Å | ||
| 9 | K | 70.1 | Confident | 75.5 | Confident | 193 Ų | 193 | 128.8 Ų | 128.8 | 84% | 0.839 | 73% | 0.733 | S | S | * | * | trans | -46.7 | 120.5 | 165.8 | -78.5 | -176.4 | 176.4 | 179.9 | 0 | 105.9 | G7 K11 | G7-K9 PolarHBondContact O-N 3Å; K9-K11 PolarHBondContact O-N 3.29Å | ||
| 10 | V | 72 | Confident | 76.5 | Confident | 144 Ų | 144 | 131.1 Ų | 131.1 | 87% | 0.873 | 73% | 0.729 | S | S | * | * | trans | -50.6 | 106.5 | 176.4 | -177.3 | 0 | 0 | 0 | 0 | 105.8 | G8 G12 | G8-V10 PolarHBondContact O-N 3.36Å; V10-G12 PolarHBondContact O-N 2.87Å | ||
| 11 | K | 74.3 | Confident | 77.5 | Confident | 201 Ų | 201 | 126.8 Ų | 126.8 | 87% | 0.874 | 71% | 0.711 | S | S | * | * | trans | -61.2 | 113 | -178 | -79.2 | -176.6 | 178.2 | 175.8 | 0 | 105.5 | K9 K13 | K9-K11 PolarHBondContact O-N 3.29Å; K11-K13 PolarHBondContact O-N 3.2Å | ||
| 12 | G | 80.2 | Confident | 79.8 | Confident | 66 Ų | 66 | 118 Ų | 118 | 68% | 0.68 | 68% | 0.684 | S | S | * | * | P | Polyproline II helix | trans | -51.7 | 143.6 | 174.7 | 0 | 0 | 0 | 0 | 0 | 109.4 | V10 S14 | V10-G12 PolarHBondContact O-N 2.87Å; G12-S14 PolarHBondContact O-N 3.34Å |
| 13 | K | 83.2 | Confident | 81.7 | Confident | 208 Ų | 208 | 112.5 Ų | 112.5 | 90% | 0.904 | 65% | 0.649 | S | S | * | * | P | Polyproline II helix | trans | -51.8 | 126.8 | 177.9 | -74.4 | -179.9 | 178.5 | 175.9 | 0 | 108.9 | K11 K15 | K11-K13 PolarHBondContact O-N 3.2Å; K13-K15 PolarHBondContact O-N 3.08Å; K13-K15 VanDerWaalsContact O-N 3.16Å |
| 14 | S | 88.9 | Confident | 83.3 | Confident | 107 Ų | 107 | 116.5 Ų | 116.5 | 75% | 0.748 | 65% | 0.645 | S | S | * | * | P | Polyproline II helix | trans | -60.2 | 120.8 | 177.5 | -174.8 | 0 | 0 | 0 | 0 | 109.3 | G12 S16 | G12-S14 PolarHBondContact O-N 3.34Å; S14-S16 PolarHBondContact O-N 3.27Å |
| 15 | K | 92.5 | Very high | 85.1 | Confident | 151 Ų | 151 | 107.7 Ų | 107.7 | 66% | 0.657 | 61% | 0.613 | S | S | * | * | P | Polyproline II helix | trans | -61.7 | 130 | 173.6 | -70.7 | -174.1 | 176.5 | -176.7 | 0 | 109.4 | K13 R20 | K13-K15 PolarHBondContact O-N 3.08Å; K13-K15 VanDerWaalsContact O-N 3.16Å; K15-R20 HydrophobicContact CB-CG 4.09Å; K15-R20 PolarHBondContact O-NE 3Å |
| 16 | S | 95.8 | Very high | 86.8 | Confident | 65 Ų | 65 | 106.4 Ų | 106.4 | 46% | 0.455 | 59% | 0.592 | S | S | . | * | P | Polyproline II helix | trans | -65.9 | 154.5 | 178.6 | 76.1 | 0 | 0 | 0 | 0 | 110.8 | S14 S18 S19 R20 | S14-S16 PolarHBondContact O-N 3.27Å; S16-S18 PolarHBondContact O-N 3.12Å; S16-S19 PolarHBondContact N-OG 2.87Å; S16-S19 PolarHBondContact O-N 2.87Å; S16-S19 PolarHBondContact O-OG 3.33Å; S16-S19 WeakPolarHBondContact OG-CB 3.49Å; S16-S19 PolarHBondContact OG-N 3.24Å; S16-S19 PolarHBondContact OG-OG 3.22Å; S16-R20 WeakPolarHBondContact O-CG 3.29Å; S16-R20 PolarHBondContact O-N 3.15Å |
| 17 | R | 96.4 | Very high | 88.5 | Confident | 95 Ų | 95 | 96.4 Ų | 96.4 | 36% | 0.358 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -58.4 | -36.5 | 174.6 | -74.3 | -168.8 | -77.4 | 160.4 | -4.1 | 112.5 | R20 A21 V27 H31 | R17-R20 PolarHBondContact O-N 3.36Å; R17-A21 WeakPolarHBondContact O-CB 3.5Å; R17-A21 PolarHBondContact O-N 3.48Å; R17-V27 HydrophobicContact CB-CB 4.11Å; R17-V27 HydrophobicContact CB-CG1 3.84Å; R17-H31 PolarHBondContact NH1-ND1 3.26Å; R17-H31 VanDerWaalsContact NH1-ND1 3.12Å; R17-H31 VanDerWaalsContact NH2-CB 3.31Å; R17-H31 PolarHBondContact NH2-ND1 2.73Å |
| 18 | S | 98 | Very high | 90.3 | Very high | 15 Ų | 15 | 94.6 Ų | 94.6 | 11% | 0.105 | 53% | 0.531 | C | S | . | . | H | α-helix | trans | -60.9 | -49.9 | 173.5 | -60.9 | 0 | 0 | 0 | 0 | 111.9 | S16 R20 A21 G22 L23 F25 P26 V27 | S16-S18 PolarHBondContact O-N 3.12Å; S18-R20 VanDerWaalsContact C-N 3.25Å; S18-R20 PolarHBondContact O-N 2.92Å; S18-A21 CarbonylContact O-C 3.34Å; S18-A21 PolarHBondContact O-N 3.24Å; S18-G22 PolarHBondContact O-N 3.4Å; S18-L23 CarbonylContact C-O 3.51Å; S18-L23 WeakPolarHBondContact CB-O 3.39Å; S18-L23 PolarHBondContact O-N 3.32Å; S18-F25 WeakPolarHBondContact CB-O 3.44Å; S18-F25 PolarHBondContact OG-O 3.4Å; S18-P26 WeakPolarHBondContact OG-CA 3.35Å; S18-V27 PolarHBondContact OG-N 3.07Å |
| 19 | S | 97 | Very high | 91.8 | Very high | 67 Ų | 67 | 98.3 Ų | 98.3 | 47% | 0.469 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -62.7 | -30.2 | 177.7 | 67.3 | 0 | 0 | 0 | 0 | 113.6 | S16 | S16-S19 PolarHBondContact N-OG 2.87Å; S16-S19 PolarHBondContact O-N 2.87Å; S16-S19 PolarHBondContact O-OG 3.33Å; S16-S19 WeakPolarHBondContact OG-CB 3.49Å; S16-S19 PolarHBondContact OG-N 3.24Å; S16-S19 PolarHBondContact OG-OG 3.22Å |
| 20 | R | 96.5 | Very high | 93.2 | Very high | 174 Ų | 174 | 90.1 Ų | 90.1 | 66% | 0.657 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -74.9 | -30.9 | 174.3 | -70.2 | 176.5 | -176.2 | -178.2 | 1 | 112.5 | K15 S16 R17 S18 | K15-R20 HydrophobicContact CB-CG 4.09Å; K15-R20 PolarHBondContact O-NE 3Å; S16-R20 WeakPolarHBondContact O-CG 3.29Å; S16-R20 PolarHBondContact O-N 3.15Å; R17-R20 PolarHBondContact O-N 3.36Å; S18-R20 VanDerWaalsContact C-N 3.25Å; S18-R20 PolarHBondContact O-N 2.92Å |
| 21 | A | 97.4 | Very high | 94.4 | Very high | 41 Ų | 41 | 84.8 Ų | 84.8 | 34% | 0.339 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -86.8 | -7.6 | 178 | 0 | 0 | 0 | 0 | 0 | 113.4 | R17 S18 L23 V49 | R17-A21 WeakPolarHBondContact O-CB 3.5Å; R17-A21 PolarHBondContact O-N 3.48Å; S18-A21 CarbonylContact O-C 3.34Å; S18-A21 PolarHBondContact O-N 3.24Å; A21-L23 VanDerWaalsContact C-N 3.32Å; A21-L23 HydrophobicContact CB-CD1 3.95Å; A21-L23 HydrophobicContact CB-CG 4.03Å; A21-V49 HydrophobicContact CB-CG1 3.9Å |
| 22 | G | 97.8 | Very high | 95.6 | Very high | 64 Ų | 64 | 83.3 Ų | 83.3 | 66% | 0.66 | 44% | 0.442 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 73.2 | 22.3 | -175.4 | 0 | 0 | 0 | 0 | 0 | 114.1 | S18 | S18-G22 PolarHBondContact O-N 3.4Š|
| 23 | L | 98.4 | Very high | 96.4 | Very high | 26 Ų | 26 | 84.4 Ų | 84.4 | 14% | 0.136 | 43% | 0.431 | C | S | . | . | trans | -107.1 | 140.2 | -175.4 | -63.2 | 175.5 | 0 | 0 | 0 | 111.1 | S18 A21 V27 V49 A52 A53 E56 | S18-L23 CarbonylContact C-O 3.51Å; S18-L23 WeakPolarHBondContact CB-O 3.39Å; S18-L23 PolarHBondContact O-N 3.32Å; A21-L23 VanDerWaalsContact C-N 3.32Å; A21-L23 HydrophobicContact CB-CD1 3.95Å; A21-L23 HydrophobicContact CB-CG 4.03Å; L23-V27 HydrophobicContact CD1-CG2 3.85Å; L23-V49 HydrophobicContact CD1-CG1 4.26Å; L23-A52 HydrophobicContact CD1-CB 3.81Å; L23-A53 HydrophobicContact CD1-CB 4.05Å; L23-A53 HydrophobicContact CD2-CB 3.9Å; L23-E56 WeakPolarHBondContact CA-OE2 3.33Å; L23-E56 WeakPolarHBondContact CB-OE2 3.31Å | ||
| 24 | Q | 98.4 | Very high | 97.1 | Very high | 168 Ų | 168 | 75.8 Ų | 75.8 | 79% | 0.785 | 40% | 0.395 | S | S | * | . | S | Bend | trans | -74.3 | -31.3 | 166.1 | -62.5 | -56.7 | -41 | 0 | 0 | 111.2 | E56 | Q24-E56 VanDerWaalsContact N-CD 3.34Å; Q24-E56 PolarHBondContact N-OE1 3.25Å; Q24-E56 VanDerWaalsContact N-OE1 3.07Å; Q24-E56 PolarHBondContact N-OE2 3.11Å |
| 25 | F | 98.5 | Very high | 97.5 | Very high | 54 Ų | 54 | 77.3 Ų | 77.3 | 24% | 0.237 | 38% | 0.384 | C | S | . | . | S | Bend | trans | -73.8 | 146.1 | -174.5 | -82.9 | 39.7 | 0 | 0 | 0 | 111.4 | S18 V27 A52 I55 E56 T59 | S18-F25 WeakPolarHBondContact CB-O 3.44Å; S18-F25 PolarHBondContact OG-O 3.4Å; F25-V27 PolarHBondContact O-N 3.27Å; F25-A52 HydrophobicContact CB-CB 4.3Å; F25-I55 HydrophobicContact CD2-CB 4.15Å; F25-I55 HydrophobicContact CD2-CG2 3.97Å; F25-I55 HydrophobicContact CE2-CB 4.18Å; F25-I55 HydrophobicContact CE2-CG2 3.58Å; F25-E56 HydrophobicContact CB-CB 4.09Å; F25-E56 WeakPolarHBondContact CB-OE2 3.28Å; F25-E56 HydrophobicContact CD1-CB 3.7Å; F25-E56 HydrophobicContact CD1-CG 3.63Å; F25-E56 HydrophobicContact CD2-CB 3.98Å; F25-E56 HydrophobicContact CE1-CB 4.13Å; F25-E56 HydrophobicContact CE1-CG 3.99Å; F25-E56 HydrophobicContact CE2-CB 4.39Å; F25-E56 HydrophobicContact CG-CB 3.64Å; F25-E56 HydrophobicContact CG-CG 4.1Å; F25-E56 HydrophobicContact CZ-CB 4.46Å; F25-E56 PolarHBondContact N-OE2 3.07Å; F25-T59 HydrophobicContact CZ-CG2 3.86Å; F25-T59 WeakPolarHBondContact CZ-OG1 3.37Å |
| 26 | P | 98.3 | Very high | 97.7 | Very high | 42 Ų | 42 | 80 Ų | 80 | 27% | 0.273 | 39% | 0.39 | S | S | . | . | trans | -82.5 | 82.6 | -166.5 | 33.8 | -38.1 | 0 | 0 | 0 | 112.7 | S18 G28 R29 I30 | S18-P26 WeakPolarHBondContact OG-CA 3.35Å; P26-G28 PolarHBondContact O-N 2.99Å; P26-G28 VanDerWaalsContact O-N 3.11Å; P26-R29 HydrophobicContact CB-CB 3.82Å; P26-R29 HydrophobicContact CG-CB 4.02Å; P26-R29 WeakPolarHBondContact O-CB 3.33Å; P26-R29 PolarHBondContact O-N 3.28Å; P26-I30 PolarHBondContact O-N 3.25Å | ||
| 27 | V | 98.6 | Very high | 97.8 | Very high | 0 Ų | 0 | 78.6 Ų | 78.6 | 0% | 0 | 39% | 0.386 | C | S | . | . | H | α-helix | trans | -47.4 | -41.5 | 173.8 | 176.9 | 0 | 0 | 0 | 0 | 111.9 | R17 S18 L23 F25 R29 I30 H31 P48 V49 A52 | R17-V27 HydrophobicContact CB-CB 4.11Å; R17-V27 HydrophobicContact CB-CG1 3.84Å; S18-V27 PolarHBondContact OG-N 3.07Å; L23-V27 HydrophobicContact CD1-CG2 3.85Å; F25-V27 PolarHBondContact O-N 3.27Å; V27-R29 PolarHBondContact O-N 2.93Å; V27-I30 PolarHBondContact O-N 3.06Å; V27-H31 PolarHBondContact O-N 3.34Å; V27-P48 HydrophobicContact CG1-CB 4.2Å; V27-P48 HydrophobicContact CG1-CG 4.38Å; V27-V49 HydrophobicContact CG1-CG2 3.69Å; V27-A52 HydrophobicContact CG2-CB 3.79Å |
| 28 | G | 98 | Very high | 97.8 | Very high | 34 Ų | 34 | 80.6 Ų | 80.6 | 35% | 0.351 | 40% | 0.404 | S | S | . | . | H | α-helix | trans | -59.2 | -45.4 | 178.3 | 0 | 0 | 0 | 0 | 0 | 113.3 | P26 R32 | P26-G28 PolarHBondContact O-N 2.99Å; P26-G28 VanDerWaalsContact O-N 3.11Å; G28-R32 PolarHBondContact O-N 3.4Å |
| 29 | R | 98.4 | Very high | 97.6 | Very high | 150 Ų | 150 | 88.3 Ų | 88.3 | 57% | 0.566 | 43% | 0.432 | S | S | * | . | H | α-helix | trans | -70.5 | -43.7 | -179.8 | -174.2 | -176.6 | -64.5 | 154.6 | 0.1 | 110.7 | P26 V27 H31 R32 L33 | P26-R29 HydrophobicContact CB-CB 3.82Å; P26-R29 HydrophobicContact CG-CB 4.02Å; P26-R29 WeakPolarHBondContact O-CB 3.33Å; P26-R29 PolarHBondContact O-N 3.28Å; V27-R29 PolarHBondContact O-N 2.93Å; R29-H31 VanDerWaalsContact C-N 3.34Å; R29-H31 PolarHBondContact O-N 3.21Å; R29-R32 WeakPolarHBondContact O-CB 3.17Å; R29-R32 PolarHBondContact O-N 3.26Å; R29-R32 VanDerWaalsContact O-N 3.16Å; R29-L33 HydrophobicContact CG-CD1 4.23Å; R29-L33 WeakPolarHBondContact O-CG 3.41Å; R29-L33 PolarHBondContact O-N 3.26Å |
| 30 | I | 98.3 | Very high | 97.6 | Very high | 21 Ų | 21 | 87.9 Ų | 87.9 | 11% | 0.108 | 43% | 0.433 | C | S | . | . | H | α-helix | trans | -60.6 | -44 | 178.4 | -69.1 | 167.1 | 0 | 0 | 0 | 110.4 | P26 V27 R32 L33 L34 P48 L51 A52 | P26-I30 PolarHBondContact O-N 3.25Å; V27-I30 PolarHBondContact O-N 3.06Å; I30-R32 VanDerWaalsContact C-N 3.32Å; I30-R32 PolarHBondContact O-N 3.34Å; I30-L33 PolarHBondContact O-N 3.28Å; I30-L34 HydrophobicContact CG2-CD1 3.98Å; I30-L34 HydrophobicContact CG2-CG 4.27Å; I30-L34 WeakPolarHBondContact O-CG 3.5Å; I30-L34 PolarHBondContact O-N 3.12Å; I30-P48 HydrophobicContact CB-CB 4.37Å; I30-P48 HydrophobicContact CG2-CB 4Å; I30-L51 HydrophobicContact CG2-CB 4.25Å; I30-L51 HydrophobicContact CG2-CD2 3.84Å; I30-L51 HydrophobicContact CG2-CG 4.21Å; I30-A52 HydrophobicContact CD1-CB 3.53Å |
| 31 | H | 98.3 | Very high | 97.6 | Very high | 31 Ų | 31 | 89 Ų | 89 | 14% | 0.144 | 45% | 0.445 | C | S | . | . | H | α-helix | trans | -57.8 | -44 | 175 | -173.4 | -148.6 | 0 | 0 | 0 | 112.8 | R17 V27 R29 L33 L34 R35 P48 | R17-H31 PolarHBondContact NH1-ND1 3.26Å; R17-H31 VanDerWaalsContact NH1-ND1 3.12Å; R17-H31 VanDerWaalsContact NH2-CB 3.31Å; R17-H31 PolarHBondContact NH2-ND1 2.73Å; V27-H31 PolarHBondContact O-N 3.34Å; R29-H31 VanDerWaalsContact C-N 3.34Å; R29-H31 PolarHBondContact O-N 3.21Å; H31-L33 VanDerWaalsContact C-N 3.34Å; H31-L34 PolarHBondContact O-N 2.85Å; H31-R35 PolarHBondContact CE1-NE 3.28Å; H31-R35 PolarHBondContact NE2-NE 2.98Å; H31-R35 PolarHBondContact O-N 2.81Å; H31-R35 VanDerWaalsContact O-N 3.1Å; H31-P48 HydrophobicContact CB-CB 3.66Å; H31-P48 HydrophobicContact CB-CG 3.72Å |
| 32 | R | 98 | Very high | 97.6 | Very high | 171 Ų | 171 | 97.7 Ų | 97.7 | 65% | 0.645 | 47% | 0.469 | S | S | * | . | H | α-helix | trans | -63.3 | -42 | 178.2 | -175.8 | -177.4 | 66.8 | 170.7 | 2.6 | 111.2 | G28 R29 I30 R35 R36 | G28-R32 PolarHBondContact O-N 3.4Å; R29-R32 WeakPolarHBondContact O-CB 3.17Å; R29-R32 PolarHBondContact O-N 3.26Å; R29-R32 VanDerWaalsContact O-N 3.16Å; I30-R32 VanDerWaalsContact C-N 3.32Å; I30-R32 PolarHBondContact O-N 3.34Å; R32-R35 PolarHBondContact O-N 2.99Å; R32-R36 PolarHBondContact O-N 2.97Å |
| 33 | L | 98.3 | Very high | 97.6 | Very high | 89 Ų | 89 | 95.7 Ų | 95.7 | 47% | 0.466 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -67.8 | -41.8 | 178.2 | -68.2 | 175.4 | 0 | 0 | 0 | 112 | R29 I30 H31 R35 R36 G37 | R29-L33 HydrophobicContact CG-CD1 4.23Å; R29-L33 WeakPolarHBondContact O-CG 3.41Å; R29-L33 PolarHBondContact O-N 3.26Å; I30-L33 PolarHBondContact O-N 3.28Å; H31-L33 VanDerWaalsContact C-N 3.34Å; L33-R35 VanDerWaalsContact C-N 3.3Å; L33-R35 PolarHBondContact O-N 2.97Å; L33-R36 PolarHBondContact O-N 2.92Å; L33-G37 PolarHBondContact O-N 3.35Å |
| 34 | L | 98 | Very high | 97.5 | Very high | 27 Ų | 27 | 96.6 Ų | 96.6 | 14% | 0.141 | 46% | 0.459 | C | S | . | . | H | α-helix | trans | -59.4 | -40.9 | 175.1 | -72.6 | 172.6 | 0 | 0 | 0 | 112 | I30 H31 Y39 I43 P48 L51 | I30-L34 HydrophobicContact CG2-CD1 3.98Å; I30-L34 HydrophobicContact CG2-CG 4.27Å; I30-L34 WeakPolarHBondContact O-CG 3.5Å; I30-L34 PolarHBondContact O-N 3.12Å; H31-L34 PolarHBondContact O-N 2.85Å; L34-Y39 HydrophobicContact CD2-CD2 3.96Å; L34-Y39 HydrophobicContact CD2-CE2 4.18Å; L34-Y39 WeakPolarHBondContact O-CD2 3.47Å; L34-I43 HydrophobicContact CB-CD1 4.31Å; L34-I43 HydrophobicContact CB-CG1 4.26Å; L34-I43 HydrophobicContact CB-CG2 4.07Å; L34-I43 HydrophobicContact CD1-CG2 4.12Å; L34-P48 HydrophobicContact CD1-CB 4.16Å; L34-L51 HydrophobicContact CD1-CD2 4.34Å; L34-L51 HydrophobicContact CD2-CD2 4Å; L34-L51 HydrophobicContact CG-CD2 4.44Å |
| 35 | R | 96.9 | Very high | 97.4 | Very high | 139 Ų | 139 | 92.3 Ų | 92.3 | 53% | 0.525 | 45% | 0.452 | S | S | . | . | H | α-helix | trans | -66.9 | -41.8 | 174.4 | -74.5 | -174.5 | 175 | -103.9 | -4.5 | 112.6 | H31 R32 L33 G37 N38 I43 | H31-R35 PolarHBondContact CE1-NE 3.28Å; H31-R35 PolarHBondContact NE2-NE 2.98Å; H31-R35 PolarHBondContact O-N 2.81Å; H31-R35 VanDerWaalsContact O-N 3.1Å; R32-R35 PolarHBondContact O-N 2.99Å; L33-R35 VanDerWaalsContact C-N 3.3Å; L33-R35 PolarHBondContact O-N 2.97Å; R35-G37 VanDerWaalsContact C-N 3.3Å; R35-G37 PolarHBondContact O-N 3.42Å; R35-N38 PolarHBondContact O-N 3.42Å; R35-N38 PolarHBondContact O-OD1 2.93Å; R35-I43 HydrophobicContact CG-CB 4.23Å; R35-I43 HydrophobicContact CG-CG1 3.93Å |
| 36 | R | 97.4 | Very high | 97.4 | Very high | 207 Ų | 207 | 92.1 Ų | 92.1 | 78% | 0.781 | 47% | 0.465 | S | S | * | . | H | α-helix | trans | -66.2 | -32.6 | 178.1 | -175.2 | -179.6 | 178 | -173.3 | 0.9 | 112.4 | R32 L33 N38 | R32-R36 PolarHBondContact O-N 2.97Å; L33-R36 PolarHBondContact O-N 2.92Å; R36-N38 PolarHBondContact O-N 2.82Å |
| 37 | G | 97.3 | Very high | 97.4 | Very high | 35 Ų | 35 | 92.3 Ų | 92.3 | 36% | 0.361 | 47% | 0.47 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -74.4 | -4.9 | 179.3 | 0 | 0 | 0 | 0 | 0 | 114.7 | L33 R35 Y39 | L33-G37 PolarHBondContact O-N 3.35Å; R35-G37 VanDerWaalsContact C-N 3.3Å; R35-G37 PolarHBondContact O-N 3.42Å; G37-Y39 PolarHBondContact O-N 2.9Å; G37-Y39 VanDerWaalsContact O-N 3.12Å |
| 38 | N | 95.4 | Very high | 97.4 | Very high | 138 Ų | 138 | 92.3 Ų | 92.3 | 74% | 0.738 | 47% | 0.47 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 50.9 | 33.9 | 179.6 | -61.7 | -28.1 | 0 | 0 | 0 | 114 | R35 R36 A40 | R35-N38 PolarHBondContact O-N 3.42Å; R35-N38 PolarHBondContact O-OD1 2.93Å; R36-N38 PolarHBondContact O-N 2.82Å; N38-A40 PolarHBondContact O-N 3.23Å |
| 39 | Y | 95.1 | Very high | 97.4 | Very high | 177 Ų | 177 | 93 Ų | 93 | 69% | 0.694 | 47% | 0.468 | S | S | * | . | S | Bend | trans | -67.8 | -20.7 | -177.2 | -61.4 | -71.4 | 0 | 0 | 0 | 114 | L34 G37 | L34-Y39 HydrophobicContact CD2-CD2 3.96Å; L34-Y39 HydrophobicContact CD2-CE2 4.18Å; L34-Y39 WeakPolarHBondContact O-CD2 3.47Å; G37-Y39 PolarHBondContact O-N 2.9Å; G37-Y39 VanDerWaalsContact O-N 3.12Å |
| 40 | A | 96.3 | Very high | 97.4 | Very high | 58 Ų | 58 | 94.2 Ų | 94.2 | 48% | 0.479 | 47% | 0.474 | S | S | . | . | S | Bend | trans | -160.3 | 159 | 174.3 | 0 | 0 | 0 | 0 | 0 | 109.4 | N38 R42 I43 | N38-A40 PolarHBondContact O-N 3.23Å; A40-R42 PolarHBondContact O-N 3.37Å; A40-I43 HydrophobicContact CB-CD1 4.21Å |
| 41 | E | 96.2 | Very high | 97.4 | Very high | 198 Ų | 198 | 96.3 Ų | 96.3 | 93% | 0.925 | 49% | 0.485 | S | S | * | . | S | Bend | trans | -58.3 | -35.5 | 175.1 | -63.8 | -177.3 | 175.6 | 0 | 0 | 112.6 | ||
| 42 | R | 97.4 | Very high | 97.4 | Very high | 223 Ų | 223 | 94.8 Ų | 94.8 | 84% | 0.842 | 48% | 0.478 | S | S | * | . | trans | -131.8 | 127.6 | -179.8 | -63.1 | -176.6 | 179.9 | -167.4 | 0.4 | 110.4 | A40 | A40-R42 PolarHBondContact O-N 3.37Š| ||
| 43 | I | 97.5 | Very high | 97.5 | Very high | 21 Ų | 21 | 88.4 Ų | 88.4 | 11% | 0.108 | 46% | 0.461 | C | S | . | . | trans | -100 | 112.6 | 171.2 | -54.2 | -59.8 | 0 | 0 | 0 | 108.8 | L34 R35 A40 A47 | L34-I43 HydrophobicContact CB-CD1 4.31Å; L34-I43 HydrophobicContact CB-CG1 4.26Å; L34-I43 HydrophobicContact CB-CG2 4.07Å; L34-I43 HydrophobicContact CD1-CG2 4.12Å; R35-I43 HydrophobicContact CG-CB 4.23Å; R35-I43 HydrophobicContact CG-CG1 3.93Å; A40-I43 HydrophobicContact CB-CD1 4.21Å; I43-A47 HydrophobicContact CG2-CB 4.17Å | ||
| 44 | G | 97.5 | Very high | 97.5 | Very high | 45 Ų | 45 | 86.7 Ų | 86.7 | 46% | 0.464 | 46% | 0.455 | S | S | . | . | trans | -64.5 | 151.1 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | G46 A47 P48 | G44-G46 PolarHBondContact O-N 3.07Å; G44-A47 WeakPolarHBondContact O-CB 3.49Å; G44-A47 PolarHBondContact O-N 3.22Å; G44-P48 WeakPolarHBondContact O-CD 3.24Å | ||
| 45 | A | 95.5 | Very high | 97.5 | Very high | 79 Ų | 79 | 88.7 Ų | 88.7 | 65% | 0.653 | 46% | 0.464 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63.8 | -28.7 | -175.3 | 0 | 0 | 0 | 0 | 0 | 113.8 | P48 | A45-P48 WeakPolarHBondContact O-CD 3.46Å; A45-P48 WeakPolarHBondContact O-CG 3.38Å |
| 46 | G | 97.8 | Very high | 97.6 | Very high | 49 Ų | 49 | 83.8 Ų | 83.8 | 51% | 0.505 | 45% | 0.448 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -77.1 | -28.3 | 177.3 | 0 | 0 | 0 | 0 | 0 | 114.3 | G44 V49 Y50 | G44-G46 PolarHBondContact O-N 3.07Å; G46-V49 WeakPolarHBondContact O-CB 3.42Å; G46-V49 PolarHBondContact O-N 2.69Å; G46-Y50 PolarHBondContact O-N 3.3Å |
| 47 | A | 98.3 | Very high | 97.6 | Very high | 46 Ų | 46 | 80.7 Ų | 80.7 | 38% | 0.38 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -53.8 | -49.7 | -179.4 | 0 | 0 | 0 | 0 | 0 | 113.9 | I43 G44 V49 Y50 L51 | I43-A47 HydrophobicContact CG2-CB 4.17Å; G44-A47 WeakPolarHBondContact O-CB 3.49Å; G44-A47 PolarHBondContact O-N 3.22Å; A47-V49 VanDerWaalsContact C-N 3.29Å; A47-V49 PolarHBondContact O-N 3Å; A47-Y50 PolarHBondContact O-N 3.41Å; A47-L51 WeakPolarHBondContact O-CB 3.43Å; A47-L51 PolarHBondContact O-N 2.82Å |
| 48 | P | 98.5 | Very high | 97.7 | Very high | 0 Ų | 0 | 81.6 Ų | 81.6 | 0% | 0 | 43% | 0.433 | C | S | . | . | H | α-helix | trans | -70.2 | -21.8 | 176.6 | 29 | -37.8 | 0 | 0 | 0 | 114.2 | V27 I30 H31 L34 G44 A45 A52 | V27-P48 HydrophobicContact CG1-CB 4.2Å; V27-P48 HydrophobicContact CG1-CG 4.38Å; I30-P48 HydrophobicContact CB-CB 4.37Å; I30-P48 HydrophobicContact CG2-CB 4Å; H31-P48 HydrophobicContact CB-CB 3.66Å; H31-P48 HydrophobicContact CB-CG 3.72Å; L34-P48 HydrophobicContact CD1-CB 4.16Å; G44-P48 WeakPolarHBondContact O-CD 3.24Å; A45-P48 WeakPolarHBondContact O-CD 3.46Å; A45-P48 WeakPolarHBondContact O-CG 3.38Å; P48-A52 WeakPolarHBondContact O-CB 3.41Å; P48-A52 PolarHBondContact O-N 3.4Å; P48-A52 VanDerWaalsContact O-N 3.17Å |
| 49 | V | 98.6 | Very high | 97.8 | Very high | 50 Ų | 50 | 77.3 Ų | 77.3 | 30% | 0.303 | 41% | 0.412 | S | S | . | . | H | α-helix | trans | -73.9 | -50.2 | 174.9 | 178.1 | 0 | 0 | 0 | 0 | 109.2 | A21 L23 V27 G46 A47 A52 A53 | A21-V49 HydrophobicContact CB-CG1 3.9Å; L23-V49 HydrophobicContact CD1-CG1 4.26Å; V27-V49 HydrophobicContact CG1-CG2 3.69Å; G46-V49 WeakPolarHBondContact O-CB 3.42Å; G46-V49 PolarHBondContact O-N 2.69Å; A47-V49 VanDerWaalsContact C-N 3.29Å; A47-V49 PolarHBondContact O-N 3Å; V49-A52 PolarHBondContact O-N 3.22Å; V49-A53 WeakPolarHBondContact O-CB 3.34Å; V49-A53 PolarHBondContact O-N 3.39Å |
| 50 | Y | 98.7 | Very high | 98 | Very high | 174 Ų | 174 | 71.6 Ų | 71.6 | 68% | 0.682 | 40% | 0.401 | S | S | * | . | H | α-helix | trans | -57.8 | -50.9 | 177.4 | -179.9 | -97.2 | 0 | 0 | 0 | 111.5 | G46 A47 A52 A53 V54 | G46-Y50 PolarHBondContact O-N 3.3Å; A47-Y50 PolarHBondContact O-N 3.41Å; Y50-A52 VanDerWaalsContact C-N 3.33Å; Y50-A52 PolarHBondContact O-N 3.2Å; Y50-A53 PolarHBondContact O-N 3.46Å; Y50-V54 HydrophobicContact CD1-CG2 4.31Å; Y50-V54 HydrophobicContact CE1-CG2 3.9Å; Y50-V54 HydrophobicContact CE2-CG2 4.25Å; Y50-V54 WeakPolarHBondContact O-CG2 3.3Å; Y50-V54 PolarHBondContact O-N 3.24Å |
| 51 | L | 98.6 | Very high | 98.1 | Very high | 65 Ų | 65 | 71.5 Ų | 71.5 | 34% | 0.34 | 39% | 0.391 | S | S | . | . | H | α-helix | trans | -63.6 | -38.3 | 179.5 | -176.9 | 59.4 | 0 | 0 | 0 | 112.2 | I30 L34 A47 I55 | I30-L51 HydrophobicContact CG2-CB 4.25Å; I30-L51 HydrophobicContact CG2-CD2 3.84Å; I30-L51 HydrophobicContact CG2-CG 4.21Å; L34-L51 HydrophobicContact CD1-CD2 4.34Å; L34-L51 HydrophobicContact CD2-CD2 4Å; L34-L51 HydrophobicContact CG-CD2 4.44Å; A47-L51 WeakPolarHBondContact O-CB 3.43Å; A47-L51 PolarHBondContact O-N 2.82Å; L51-I55 HydrophobicContact CD1-CD1 3.83Å; L51-I55 HydrophobicContact CD1-CG1 4.07Å; L51-I55 HydrophobicContact CG-CD1 3.85Å; L51-I55 HydrophobicContact CG-CG1 4.47Å; L51-I55 VanDerWaalsContact O-CG1 3.22Å; L51-I55 WeakPolarHBondContact O-CG1 3.11Å; L51-I55 PolarHBondContact O-N 3.19Å; L51-I55 VanDerWaalsContact O-N 3.13Å |
| 52 | A | 98.7 | Very high | 98.2 | Very high | 0 Ų | 0 | 63.3 Ų | 63.3 | 0% | 0 | 36% | 0.355 | C | S | . | . | H | α-helix | trans | -61.6 | -45.2 | 174.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | L23 F25 V27 I30 P48 V49 Y50 I55 E56 | L23-A52 HydrophobicContact CD1-CB 3.81Å; F25-A52 HydrophobicContact CB-CB 4.3Å; V27-A52 HydrophobicContact CG2-CB 3.79Å; I30-A52 HydrophobicContact CD1-CB 3.53Å; P48-A52 WeakPolarHBondContact O-CB 3.41Å; P48-A52 PolarHBondContact O-N 3.4Å; P48-A52 VanDerWaalsContact O-N 3.17Å; V49-A52 PolarHBondContact O-N 3.22Å; Y50-A52 VanDerWaalsContact C-N 3.33Å; Y50-A52 PolarHBondContact O-N 3.2Å; A52-I55 PolarHBondContact O-N 2.97Å; A52-E56 VanDerWaalsContact O-CB 3.24Å; A52-E56 WeakPolarHBondContact O-CB 3.48Å; A52-E56 PolarHBondContact O-N 3.21Å |
| 53 | A | 98.8 | Very high | 98.2 | Very high | 36 Ų | 36 | 56.9 Ų | 56.9 | 30% | 0.298 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -62.5 | -45.1 | 179.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | L23 V49 Y50 E56 Y57 | L23-A53 HydrophobicContact CD1-CB 4.05Å; L23-A53 HydrophobicContact CD2-CB 3.9Å; V49-A53 WeakPolarHBondContact O-CB 3.34Å; V49-A53 PolarHBondContact O-N 3.39Å; Y50-A53 PolarHBondContact O-N 3.46Å; A53-E56 PolarHBondContact O-N 2.76Å; A53-Y57 WeakPolarHBondContact O-CB 3.44Å; A53-Y57 PolarHBondContact O-N 2.83Å |
| 54 | V | 98.6 | Very high | 98.3 | Very high | 54 Ų | 54 | 61.5 Ų | 61.5 | 33% | 0.327 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -63.4 | -45.2 | 179.3 | 172.6 | 0 | 0 | 0 | 0 | 111.5 | Y50 Y57 L58 | Y50-V54 HydrophobicContact CD1-CG2 4.31Å; Y50-V54 HydrophobicContact CE1-CG2 3.9Å; Y50-V54 HydrophobicContact CE2-CG2 4.25Å; Y50-V54 WeakPolarHBondContact O-CG2 3.3Å; Y50-V54 PolarHBondContact O-N 3.24Å; V54-Y57 PolarHBondContact O-N 3.37Å; V54-L58 HydrophobicContact CG1-CD1 4.08Å; V54-L58 WeakPolarHBondContact O-CG 3.48Å; V54-L58 PolarHBondContact O-N 3.47Å |
| 55 | I | 98.4 | Very high | 98.3 | Very high | 68 Ų | 68 | 61.5 Ų | 61.5 | 35% | 0.349 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -68.3 | -38.6 | 179 | -57.6 | 169.5 | 0 | 0 | 0 | 110.3 | F25 L51 A52 T59 | F25-I55 HydrophobicContact CD2-CB 4.15Å; F25-I55 HydrophobicContact CD2-CG2 3.97Å; F25-I55 HydrophobicContact CE2-CB 4.18Å; F25-I55 HydrophobicContact CE2-CG2 3.58Å; L51-I55 HydrophobicContact CD1-CD1 3.83Å; L51-I55 HydrophobicContact CD1-CG1 4.07Å; L51-I55 HydrophobicContact CG-CD1 3.85Å; L51-I55 HydrophobicContact CG-CG1 4.47Å; L51-I55 VanDerWaalsContact O-CG1 3.22Å; L51-I55 WeakPolarHBondContact O-CG1 3.11Å; L51-I55 PolarHBondContact O-N 3.19Å; L51-I55 VanDerWaalsContact O-N 3.13Å; A52-I55 PolarHBondContact O-N 2.97Å; I55-T59 VanDerWaalsContact O-CB 3.3Å; I55-T59 WeakPolarHBondContact O-CB 3.33Å; I55-T59 PolarHBondContact O-N 2.71Å; I55-T59 PolarHBondContact O-OG1 3.36Å |
| 56 | E | 98.7 | Very high | 98.5 | Very high | 37 Ų | 37 | 57.8 Ų | 57.8 | 17% | 0.173 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -60.6 | -48.3 | 175.6 | -176 | 165.1 | 151.5 | 0 | 0 | 111.4 | L23 Q24 F25 A52 A53 T59 A60 | L23-E56 WeakPolarHBondContact CA-OE2 3.33Å; L23-E56 WeakPolarHBondContact CB-OE2 3.31Å; Q24-E56 VanDerWaalsContact N-CD 3.34Å; Q24-E56 PolarHBondContact N-OE1 3.25Å; Q24-E56 VanDerWaalsContact N-OE1 3.07Å; Q24-E56 PolarHBondContact N-OE2 3.11Å; F25-E56 HydrophobicContact CB-CB 4.09Å; F25-E56 WeakPolarHBondContact CB-OE2 3.28Å; F25-E56 HydrophobicContact CD1-CB 3.7Å; F25-E56 HydrophobicContact CD1-CG 3.63Å; F25-E56 HydrophobicContact CD2-CB 3.98Å; F25-E56 HydrophobicContact CE1-CB 4.13Å; F25-E56 HydrophobicContact CE1-CG 3.99Å; F25-E56 HydrophobicContact CE2-CB 4.39Å; F25-E56 HydrophobicContact CG-CB 3.64Å; F25-E56 HydrophobicContact CG-CG 4.1Å; F25-E56 HydrophobicContact CZ-CB 4.46Å; F25-E56 PolarHBondContact N-OE2 3.07Å; A52-E56 VanDerWaalsContact O-CB 3.24Å; A52-E56 WeakPolarHBondContact O-CB 3.48Å; A52-E56 PolarHBondContact O-N 3.21Å; A53-E56 PolarHBondContact O-N 2.76Å; E56-T59 PolarHBondContact O-N 2.94Å; E56-A60 WeakPolarHBondContact O-CB 3.41Å; E56-A60 PolarHBondContact O-N 3.48Å |
| 57 | Y | 98.2 | Very high | 98.5 | Very high | 142 Ų | 142 | 56.7 Ų | 56.7 | 56% | 0.557 | 31% | 0.305 | S | S | * | . | H | α-helix | trans | -56.7 | -54.2 | 176.4 | 170 | -100.7 | 0 | 0 | 0 | 111.9 | A53 V54 T59 A60 E61 | A53-Y57 WeakPolarHBondContact O-CB 3.44Å; A53-Y57 PolarHBondContact O-N 2.83Å; V54-Y57 PolarHBondContact O-N 3.37Å; Y57-T59 VanDerWaalsContact C-N 3.26Å; Y57-T59 PolarHBondContact O-N 3.01Å; Y57-A60 PolarHBondContact O-N 3.3Å; Y57-A60 VanDerWaalsContact O-N 3.17Å; Y57-E61 PolarHBondContact O-N 3.19Å |
| 58 | L | 98.1 | Very high | 98.5 | Very high | 53 Ų | 53 | 58.2 Ų | 58.2 | 28% | 0.277 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -61.5 | -36.2 | 179.7 | -69 | 172 | 0 | 0 | 0 | 112.2 | V54 V62 F96 | V54-L58 HydrophobicContact CG1-CD1 4.08Å; V54-L58 WeakPolarHBondContact O-CG 3.48Å; V54-L58 PolarHBondContact O-N 3.47Å; L58-V62 WeakPolarHBondContact O-CG2 3.2Å; L58-V62 PolarHBondContact O-N 3.47Å; L58-F96 HydrophobicContact CD1-CE1 4.16Å; L58-F96 HydrophobicContact CD1-CZ 4Å; L58-F96 HydrophobicContact CD2-CE1 4.48Å |
| 59 | T | 98.5 | Very high | 98.5 | Very high | 49 Ų | 49 | 58.8 Ų | 58.8 | 30% | 0.301 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -69.8 | -41.9 | 177.5 | -55.6 | 0 | 0 | 0 | 0 | 111.1 | F25 I55 E56 Y57 L63 | F25-T59 HydrophobicContact CZ-CG2 3.86Å; F25-T59 WeakPolarHBondContact CZ-OG1 3.37Å; I55-T59 VanDerWaalsContact O-CB 3.3Å; I55-T59 WeakPolarHBondContact O-CB 3.33Å; I55-T59 PolarHBondContact O-N 2.71Å; I55-T59 PolarHBondContact O-OG1 3.36Å; E56-T59 PolarHBondContact O-N 2.94Å; Y57-T59 VanDerWaalsContact C-N 3.26Å; Y57-T59 PolarHBondContact O-N 3.01Å; T59-L63 HydrophobicContact CG2-CD1 3.68Å; T59-L63 HydrophobicContact CG2-CG 4.11Å; T59-L63 VanDerWaalsContact O-CB 3.31Å; T59-L63 WeakPolarHBondContact O-CB 3.31Å; T59-L63 WeakPolarHBondContact O-CG 3.49Å; T59-L63 PolarHBondContact O-N 3.01Å |
| 60 | A | 98.4 | Very high | 98.5 | Very high | 56 Ų | 56 | 56.6 Ų | 56.6 | 46% | 0.463 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -60.3 | -47.5 | 177.8 | 0 | 0 | 0 | 0 | 0 | 111.1 | E56 Y57 V62 L63 E64 | E56-A60 WeakPolarHBondContact O-CB 3.41Å; E56-A60 PolarHBondContact O-N 3.48Å; Y57-A60 PolarHBondContact O-N 3.3Å; Y57-A60 VanDerWaalsContact O-N 3.17Å; A60-V62 PolarHBondContact O-N 2.75Å; A60-L63 PolarHBondContact O-N 3.17Å; A60-E64 WeakPolarHBondContact O-CB 3.47Å; A60-E64 PolarHBondContact O-N 3.11Å |
| 61 | E | 98.1 | Very high | 98.5 | Very high | 56 Ų | 56 | 57.7 Ų | 57.7 | 26% | 0.262 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -57.1 | -50.6 | 178.6 | -169.2 | 61.8 | -145.1 | 0 | 0 | 112 | Y57 L63 E64 L65 L93 | Y57-E61 PolarHBondContact O-N 3.19Å; E61-L63 VanDerWaalsContact C-N 3.33Å; E61-L63 PolarHBondContact O-N 2.84Å; E61-E64 PolarHBondContact O-N 3Å; E61-L65 WeakPolarHBondContact O-CG 3.3Å; E61-L65 PolarHBondContact O-N 3.28Å; E61-L93 HydrophobicContact CG-CD1 4.31Å |
| 62 | V | 98.5 | Very high | 98.4 | Very high | 27 Ų | 27 | 60.5 Ų | 60.5 | 16% | 0.164 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -62.9 | -40.5 | 178.6 | 173.3 | 0 | 0 | 0 | 0 | 111.4 | L58 A60 A66 L83 I87 L93 | L58-V62 WeakPolarHBondContact O-CG2 3.2Å; L58-V62 PolarHBondContact O-N 3.47Å; A60-V62 PolarHBondContact O-N 2.75Å; V62-A66 WeakPolarHBondContact O-CB 3.33Å; V62-A66 PolarHBondContact O-N 3.35Å; V62-L83 HydrophobicContact CG1-CD2 3.8Å; V62-I87 HydrophobicContact CG1-CD1 4.19Å; V62-I87 HydrophobicContact CG1-CG1 4.34Å; V62-L93 HydrophobicContact CG2-CD1 3.95Å; V62-L93 HydrophobicContact CG2-CD2 3.87Å |
| 63 | L | 98.5 | Very high | 98.4 | Very high | 88 Ų | 88 | 64.2 Ų | 64.2 | 46% | 0.461 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -73.5 | -33.3 | -178.6 | -72 | 179.6 | 0 | 0 | 0 | 112.9 | T59 A60 E61 G67 I78 | T59-L63 HydrophobicContact CG2-CD1 3.68Å; T59-L63 HydrophobicContact CG2-CG 4.11Å; T59-L63 VanDerWaalsContact O-CB 3.31Å; T59-L63 WeakPolarHBondContact O-CB 3.31Å; T59-L63 WeakPolarHBondContact O-CG 3.49Å; T59-L63 PolarHBondContact O-N 3.01Å; A60-L63 PolarHBondContact O-N 3.17Å; E61-L63 VanDerWaalsContact C-N 3.33Å; E61-L63 PolarHBondContact O-N 2.84Å; L63-G67 WeakPolarHBondContact O-CA 3.24Å; L63-G67 PolarHBondContact O-N 2.9Å; L63-I78 HydrophobicContact CD2-CD1 4.03Å |
| 64 | E | 98.5 | Very high | 98.3 | Very high | 118 Ų | 118 | 71.9 Ų | 71.9 | 55% | 0.551 | 36% | 0.363 | S | S | * | . | H | α-helix | trans | -62.4 | -55.6 | 174.4 | 176.2 | 168.3 | -144.2 | 0 | 0 | 110.2 | A60 E61 A66 G67 N68 | A60-E64 WeakPolarHBondContact O-CB 3.47Å; A60-E64 PolarHBondContact O-N 3.11Å; E61-E64 PolarHBondContact O-N 3Å; E64-A66 PolarHBondContact O-N 2.95Å; E64-G67 WeakPolarHBondContact O-CA 3.27Å; E64-G67 PolarHBondContact O-N 2.93Å; E64-G67 VanDerWaalsContact O-N 3.12Å; E64-N68 PolarHBondContact O-N 3.29Å |
| 65 | L | 98.7 | Very high | 98.3 | Very high | 45 Ų | 45 | 75.5 Ų | 75.5 | 24% | 0.236 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -63.2 | -40.7 | 180 | -64.4 | 175.9 | 0 | 0 | 0 | 112.1 | E61 G67 N68 A69 A86 D90 L93 | E61-L65 WeakPolarHBondContact O-CG 3.3Å; E61-L65 PolarHBondContact O-N 3.28Å; L65-G67 VanDerWaalsContact C-N 3.32Å; L65-N68 PolarHBondContact O-N 3.04Å; L65-A69 PolarHBondContact O-N 3.16Å; L65-A86 HydrophobicContact CB-CB 3.65Å; L65-D90 HydrophobicContact CD1-CB 3.91Å; L65-L93 HydrophobicContact CD1-CD1 3.72Å |
| 66 | A | 98.8 | Very high | 98.3 | Very high | 0 Ų | 0 | 79.8 Ų | 79.8 | 0% | 0 | 40% | 0.404 | C | S | . | . | H | α-helix | trans | -69.8 | -31 | 176 | 0 | 0 | 0 | 0 | 0 | 112.5 | V62 E64 A70 I78 H82 L83 A86 | V62-A66 WeakPolarHBondContact O-CB 3.33Å; V62-A66 PolarHBondContact O-N 3.35Å; E64-A66 PolarHBondContact O-N 2.95Å; A66-A70 WeakPolarHBondContact O-CB 3.35Å; A66-A70 PolarHBondContact O-N 3.46Å; A66-I78 HydrophobicContact CB-CD1 4.14Å; A66-I78 HydrophobicContact CB-CG1 4.47Å; A66-I78 HydrophobicContact CB-CG2 3.97Å; A66-H82 HydrophobicContact CB-CB 4.46Å; A66-L83 HydrophobicContact CB-CD2 3.8Å; A66-A86 HydrophobicContact CB-CB 4Å |
| 67 | G | 98.7 | Very high | 98.3 | Very high | 27 Ų | 27 | 87.2 Ų | 87.2 | 28% | 0.278 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -63.7 | -44.9 | 171.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | L63 E64 L65 A70 R71 | L63-G67 WeakPolarHBondContact O-CA 3.24Å; L63-G67 PolarHBondContact O-N 2.9Å; E64-G67 WeakPolarHBondContact O-CA 3.27Å; E64-G67 PolarHBondContact O-N 2.93Å; E64-G67 VanDerWaalsContact O-N 3.12Å; L65-G67 VanDerWaalsContact C-N 3.32Å; G67-A70 WeakPolarHBondContact O-CB 3.29Å; G67-A70 PolarHBondContact O-N 3.46Å; G67-R71 PolarHBondContact O-N 3.47Å |
| 68 | N | 98.5 | Very high | 98.3 | Very high | 78 Ų | 78 | 83.5 Ų | 83.5 | 42% | 0.417 | 42% | 0.42 | S | S | . | . | H | α-helix | trans | -59.9 | -50.1 | 173.4 | -67.4 | -21.8 | 0 | 0 | 0 | 111.1 | E64 L65 A70 R71 D72 | E64-N68 PolarHBondContact O-N 3.29Å; L65-N68 PolarHBondContact O-N 3.04Å; N68-A70 VanDerWaalsContact C-N 3.27Å; N68-A70 PolarHBondContact O-N 2.8Å; N68-R71 WeakPolarHBondContact O-CB 3.35Å; N68-R71 PolarHBondContact O-N 3.03Å; N68-R71 VanDerWaalsContact O-N 3.07Å; N68-D72 VanDerWaalsContact O-CG 3.31Å; N68-D72 PolarHBondContact O-N 2.87Å |
| 69 | A | 98.4 | Very high | 98.3 | Very high | 12 Ų | 12 | 84.7 Ų | 84.7 | 10% | 0.099 | 43% | 0.426 | C | S | . | . | H | α-helix | trans | -60.5 | -34.1 | 177 | 0 | 0 | 0 | 0 | 0 | 113.3 | L65 N73 H82 L85 | L65-A69 PolarHBondContact O-N 3.16Å; A69-N73 PolarHBondContact O-N 2.95Å; A69-N73 PolarHBondContact O-ND2 3.45Å; A69-H82 HydrophobicContact CB-CB 4.22Å; A69-L85 HydrophobicContact CB-CB 4.27Å |
| 70 | A | 98.7 | Very high | 98.3 | Very high | 4 Ų | 4 | 84.9 Ų | 84.9 | 3% | 0.033 | 43% | 0.428 | C | S | . | . | H | α-helix | trans | -66.5 | -44.6 | 174.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | A66 G67 N68 N73 K74 K75 I78 H82 | A66-A70 WeakPolarHBondContact O-CB 3.35Å; A66-A70 PolarHBondContact O-N 3.46Å; G67-A70 WeakPolarHBondContact O-CB 3.29Å; G67-A70 PolarHBondContact O-N 3.46Å; N68-A70 VanDerWaalsContact C-N 3.27Å; N68-A70 PolarHBondContact O-N 2.8Å; A70-N73 CarbonylContact O-C 3.56Å; A70-N73 PolarHBondContact O-N 3.17Å; A70-K74 PolarHBondContact O-N 3.35Å; A70-K75 CarbonylContact C-O 3.51Å; A70-K75 WeakPolarHBondContact O-CA 3.45Å; A70-K75 PolarHBondContact O-N 3.02Å; A70-K75 VanDerWaalsContact O-O 3.07Å; A70-I78 HydrophobicContact CB-CG1 4.26Å; A70-H82 VanDerWaalsContact CA-CE1 3.47Å; A70-H82 WeakPolarHBondContact CA-CE1 3.22Å; A70-H82 WeakPolarHBondContact CA-ND1 3.01Å; A70-H82 HydrophobicContact CB-CB 4.47Å; A70-H82 WeakPolarHBondContact CB-ND1 3.33Å |
| 71 | R | 98.4 | Very high | 98.3 | Very high | 196 Ų | 196 | 85.5 Ų | 85.5 | 74% | 0.74 | 42% | 0.418 | S | S | * | . | H | α-helix | trans | -62.4 | -43.2 | 178 | -176.4 | -178.5 | 177.3 | -176.9 | -1.8 | 111.7 | G67 N68 N73 K74 | G67-R71 PolarHBondContact O-N 3.47Å; N68-R71 WeakPolarHBondContact O-CB 3.35Å; N68-R71 PolarHBondContact O-N 3.03Å; N68-R71 VanDerWaalsContact O-N 3.07Å; R71-N73 VanDerWaalsContact C-N 3.25Å; R71-N73 PolarHBondContact O-N 3.39Å; R71-K74 WeakPolarHBondContact O-CA 3.36Å; R71-K74 PolarHBondContact O-N 3.01Å |
| 72 | D | 97.4 | Very high | 98.3 | Very high | 125 Ų | 125 | 83 Ų | 83 | 67% | 0.668 | 41% | 0.406 | S | S | * | . | H | α-helix | trans | -61.8 | -36.4 | 177.7 | -66.2 | -18.6 | 0 | 0 | 0 | 111.7 | N68 K74 | N68-D72 VanDerWaalsContact O-CG 3.31Å; N68-D72 PolarHBondContact O-N 2.87Å; D72-K74 PolarHBondContact O-N 3.18Å |
| 73 | N | 96.9 | Very high | 98.3 | Very high | 78 Ų | 78 | 84 Ų | 84 | 42% | 0.417 | 41% | 0.411 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -79.7 | 11.1 | 172.8 | -68.2 | -29.1 | 0 | 0 | 0 | 113.7 | A69 A70 R71 K75 H82 | A69-N73 PolarHBondContact O-N 2.95Å; A69-N73 PolarHBondContact O-ND2 3.45Å; A70-N73 CarbonylContact O-C 3.56Å; A70-N73 PolarHBondContact O-N 3.17Å; R71-N73 VanDerWaalsContact C-N 3.25Å; R71-N73 PolarHBondContact O-N 3.39Å; N73-K75 HydrophobicContact CB-CG 4.33Å; N73-K75 WeakPolarHBondContact O-CG 3.25Å; N73-K75 PolarHBondContact O-N 3.17Å; N73-H82 PolarHBondContact ND2-CD2 3.46Å; N73-H82 VanDerWaalsContact ND2-CD2 3.26Å; N73-H82 PolarHBondContact ND2-NE2 3.31Å |
| 74 | K | 98.1 | Very high | 98.3 | Very high | 196 Ų | 196 | 80.7 Ų | 80.7 | 85% | 0.852 | 39% | 0.393 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 55.4 | 37.2 | -179 | -53.9 | 177 | -177.9 | 177.9 | 0 | 112.4 | A70 R71 D72 | A70-K74 PolarHBondContact O-N 3.35Å; R71-K74 WeakPolarHBondContact O-CA 3.36Å; R71-K74 PolarHBondContact O-N 3.01Å; D72-K74 PolarHBondContact O-N 3.18Å |
| 75 | K | 98.3 | Very high | 98.3 | Very high | 130 Ų | 130 | 76.4 Ų | 76.4 | 57% | 0.565 | 37% | 0.374 | S | S | * | . | trans | -115.5 | 147.4 | 176.5 | -58 | -56.6 | -179.8 | -178.3 | 0 | 110.3 | A70 N73 | A70-K75 CarbonylContact C-O 3.51Å; A70-K75 WeakPolarHBondContact O-CA 3.45Å; A70-K75 PolarHBondContact O-N 3.02Å; A70-K75 VanDerWaalsContact O-O 3.07Å; N73-K75 HydrophobicContact CB-CG 4.33Å; N73-K75 WeakPolarHBondContact O-CG 3.25Å; N73-K75 PolarHBondContact O-N 3.17Å | ||
| 76 | T | 97.3 | Very high | 98.3 | Very high | 158 Ų | 158 | 74.7 Ų | 74.7 | 97% | 0.969 | 37% | 0.365 | S | S | * | . | S | Bend | trans | -95.6 | -7.2 | 174.4 | 54.7 | 0 | 0 | 0 | 0 | 113.1 | ||
| 77 | R | 98.6 | Very high | 98.3 | Very high | 193 Ų | 193 | 75.1 Ų | 75.1 | 73% | 0.728 | 37% | 0.368 | S | S | * | . | S | Bend | trans | -117.2 | 129.4 | -177.6 | -178.7 | 175 | -66.5 | 153.1 | 1.4 | 110.4 | I79 H82 | R77-I79 HydrophobicContact CG-CG2 4.4Å; R77-I79 PolarHBondContact O-N 2.69Å; R77-H82 PolarHBondContact O-CE1 2.84Å; R77-H82 PolarHBondContact O-ND1 3.31Å |
| 78 | I | 98.7 | Very high | 98.2 | Very high | 65 Ų | 65 | 76.2 Ų | 76.2 | 33% | 0.333 | 36% | 0.363 | S | S | . | . | trans | -68.7 | 127.3 | 168.3 | -63.3 | 173.6 | 0 | 0 | 0 | 108.5 | L63 A66 A70 H82 L83 | L63-I78 HydrophobicContact CD2-CD1 4.03Å; A66-I78 HydrophobicContact CB-CD1 4.14Å; A66-I78 HydrophobicContact CB-CG1 4.47Å; A66-I78 HydrophobicContact CB-CG2 3.97Å; A70-I78 HydrophobicContact CB-CG1 4.26Å; I78-H82 HydrophobicContact CG2-CB 4.27Å; I78-L83 HydrophobicContact CG2-CD2 4.1Å; I78-L83 HydrophobicContact CG2-CG 4.08Å | ||
| 79 | I | 98.4 | Very high | 98.1 | Very high | 78 Ų | 78 | 78 Ų | 78 | 40% | 0.4 | 37% | 0.373 | S | S | . | . | trans | -122.9 | 167.2 | 174.5 | 64.6 | 165.6 | 0 | 0 | 0 | 108.9 | R77 R81 H82 L83 | R77-I79 HydrophobicContact CG-CG2 4.4Å; R77-I79 PolarHBondContact O-N 2.69Å; I79-R81 HydrophobicContact CD1-CB 4Å; I79-R81 HydrophobicContact CG1-CB 4.1Å; I79-R81 PolarHBondContact O-N 3.05Å; I79-H82 PolarHBondContact N-ND1 3.07Å; I79-H82 WeakPolarHBondContact O-CB 3.24Å; I79-H82 PolarHBondContact O-N 2.95Å; I79-L83 PolarHBondContact O-N 2.94Å | ||
| 80 | P | 98.6 | Very high | 98.1 | Very high | 53 Ų | 53 | 79.5 Ų | 79.5 | 34% | 0.344 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -53.1 | -33.2 | -178.4 | -30.4 | 37.5 | 0 | 0 | 0 | 114.8 | H82 L83 Q84 I102 A103 Q104 | P80-H82 VanDerWaalsContact C-N 3.32Å; P80-H82 PolarHBondContact O-N 3.47Å; P80-L83 PolarHBondContact O-N 3.34Å; P80-Q84 PolarHBondContact O-N 3.1Å; P80-I102 HydrophobicContact CB-CG2 4.34Å; P80-A103 VanDerWaalsContact CB-O 3.29Å; P80-A103 WeakPolarHBondContact CB-O 3.47Å; P80-Q104 HydrophobicContact CB-CB 4.06Å; P80-Q104 HydrophobicContact CG-CB 4.21Å |
| 81 | R | 98.4 | Very high | 98.1 | Very high | 68 Ų | 68 | 87.3 Ų | 87.3 | 26% | 0.257 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -57.8 | -41.8 | 172.6 | 179.2 | 55.6 | 177.8 | 176.2 | -2.3 | 113 | I79 Q84 L85 G105 V107 | I79-R81 HydrophobicContact CD1-CB 4Å; I79-R81 HydrophobicContact CG1-CB 4.1Å; I79-R81 PolarHBondContact O-N 3.05Å; R81-Q84 PolarHBondContact O-N 3.18Å; R81-L85 HydrophobicContact CG-CD1 4.24Å; R81-L85 WeakPolarHBondContact O-CG 3.41Å; R81-L85 PolarHBondContact O-N 3.48Å; R81-G105 WeakPolarHBondContact CD-O 3.48Å; R81-G105 PolarHBondContact NH1-O 3.28Å; R81-G105 VanDerWaalsContact NH1-O 3.08Å; R81-V107 PolarHBondContact NH1-O 3.12Å; R81-V107 PolarHBondContact NH2-O 3.48Å |
| 82 | H | 98.7 | Very high | 98 | Very high | 4 Ų | 4 | 85 Ų | 85 | 2% | 0.019 | 41% | 0.413 | C | S | . | . | H | α-helix | trans | -68.3 | -37.9 | 179.9 | -55.3 | 152.3 | 0 | 0 | 0 | 111.3 | A66 A69 A70 N73 R77 I78 I79 P80 L85 A86 | A66-H82 HydrophobicContact CB-CB 4.46Å; A69-H82 HydrophobicContact CB-CB 4.22Å; A70-H82 VanDerWaalsContact CA-CE1 3.47Å; A70-H82 WeakPolarHBondContact CA-CE1 3.22Å; A70-H82 WeakPolarHBondContact CA-ND1 3.01Å; A70-H82 HydrophobicContact CB-CB 4.47Å; A70-H82 WeakPolarHBondContact CB-ND1 3.33Å; N73-H82 PolarHBondContact ND2-CD2 3.46Å; N73-H82 VanDerWaalsContact ND2-CD2 3.26Å; N73-H82 PolarHBondContact ND2-NE2 3.31Å; R77-H82 PolarHBondContact O-CE1 2.84Å; R77-H82 PolarHBondContact O-ND1 3.31Å; I78-H82 HydrophobicContact CG2-CB 4.27Å; I79-H82 PolarHBondContact N-ND1 3.07Å; I79-H82 WeakPolarHBondContact O-CB 3.24Å; I79-H82 PolarHBondContact O-N 2.95Å; P80-H82 VanDerWaalsContact C-N 3.32Å; P80-H82 PolarHBondContact O-N 3.47Å; H82-L85 PolarHBondContact O-N 2.88Å; H82-A86 VanDerWaalsContact O-CB 3.3Å; H82-A86 WeakPolarHBondContact O-CB 3.36Å; H82-A86 PolarHBondContact O-N 2.98Å |
| 83 | L | 98.5 | Very high | 98.1 | Very high | 49 Ų | 49 | 79.5 Ų | 79.5 | 26% | 0.257 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -62.7 | -43.8 | 172.9 | -65 | 172.4 | 0 | 0 | 0 | 111.6 | V62 A66 I78 I79 P80 A86 I87 I102 | V62-L83 HydrophobicContact CG1-CD2 3.8Å; A66-L83 HydrophobicContact CB-CD2 3.8Å; I78-L83 HydrophobicContact CG2-CD2 4.1Å; I78-L83 HydrophobicContact CG2-CG 4.08Å; I79-L83 PolarHBondContact O-N 2.94Å; P80-L83 PolarHBondContact O-N 3.34Å; L83-A86 PolarHBondContact O-N 2.99Å; L83-I87 HydrophobicContact CB-CD1 4.44Å; L83-I87 VanDerWaalsContact O-CB 3.31Å; L83-I87 WeakPolarHBondContact O-CB 3.44Å; L83-I87 WeakPolarHBondContact O-CD1 3.35Å; L83-I87 WeakPolarHBondContact O-CG1 3.36Å; L83-I87 PolarHBondContact O-N 3.38Å; L83-I102 HydrophobicContact CB-CG2 4.46Å |
| 84 | Q | 98.4 | Very high | 98.1 | Very high | 17 Ų | 17 | 77.8 Ų | 77.8 | 8% | 0.079 | 38% | 0.377 | C | S | . | . | H | α-helix | trans | -62 | -45.8 | 177 | -178.9 | 75.2 | 22.1 | 0 | 0 | 112 | P80 R81 R88 I102 G105 G106 | P80-Q84 PolarHBondContact O-N 3.1Å; R81-Q84 PolarHBondContact O-N 3.18Å; Q84-R88 HydrophobicContact CG-CG 4.4Å; Q84-R88 WeakPolarHBondContact O-CB 3.24Å; Q84-R88 WeakPolarHBondContact O-CG 3.48Å; Q84-R88 PolarHBondContact O-N 3.13Å; Q84-I102 HydrophobicContact CB-CD1 4.43Å; Q84-G105 WeakPolarHBondContact CB-O 3.43Å; Q84-G105 WeakPolarHBondContact CG-O 3.39Å; Q84-G106 VanDerWaalsContact CD-O 3.27Å; Q84-G106 WeakPolarHBondContact CG-O 3.43Å; Q84-G106 PolarHBondContact NE2-O 3.39Å |
| 85 | L | 98 | Very high | 98.1 | Very high | 29 Ų | 29 | 76.4 Ų | 76.4 | 15% | 0.152 | 37% | 0.371 | C | S | . | . | H | α-helix | trans | -63.2 | -44.2 | 178.3 | -70.2 | 176.9 | 0 | 0 | 0 | 111.3 | A69 R81 H82 N89 L108 | A69-L85 HydrophobicContact CB-CB 4.27Å; R81-L85 HydrophobicContact CG-CD1 4.24Å; R81-L85 WeakPolarHBondContact O-CG 3.41Å; R81-L85 PolarHBondContact O-N 3.48Å; H82-L85 PolarHBondContact O-N 2.88Å; L85-N89 VanDerWaalsContact O-CB 3.28Å; L85-N89 WeakPolarHBondContact O-CB 3.36Å; L85-N89 PolarHBondContact O-N 3.28Å; L85-N89 PolarHBondContact O-ND2 3.35Å; L85-L108 HydrophobicContact CD2-CD2 3.93Å |
| 86 | A | 98.2 | Very high | 98.1 | Very high | 8 Ų | 8 | 76.5 Ų | 76.5 | 7% | 0.066 | 37% | 0.372 | C | S | . | . | H | α-helix | trans | -61.6 | -55.5 | 177.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | L65 A66 H82 L83 R88 D90 | L65-A86 HydrophobicContact CB-CB 3.65Å; A66-A86 HydrophobicContact CB-CB 4Å; H82-A86 VanDerWaalsContact O-CB 3.3Å; H82-A86 WeakPolarHBondContact O-CB 3.36Å; H82-A86 PolarHBondContact O-N 2.98Å; L83-A86 PolarHBondContact O-N 2.99Å; A86-R88 PolarHBondContact O-N 3.1Å; A86-D90 PolarHBondContact O-N 3.17Å |
| 87 | I | 98.3 | Very high | 98.1 | Very high | 10 Ų | 10 | 70.8 Ų | 70.8 | 5% | 0.051 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -67.3 | -34.1 | -172.9 | -71.3 | 162.8 | 0 | 0 | 0 | 112.6 | V62 L83 L93 S94 L97 I102 | V62-I87 HydrophobicContact CG1-CD1 4.19Å; V62-I87 HydrophobicContact CG1-CG1 4.34Å; L83-I87 HydrophobicContact CB-CD1 4.44Å; L83-I87 VanDerWaalsContact O-CB 3.31Å; L83-I87 WeakPolarHBondContact O-CB 3.44Å; L83-I87 WeakPolarHBondContact O-CD1 3.35Å; L83-I87 WeakPolarHBondContact O-CG1 3.36Å; L83-I87 PolarHBondContact O-N 3.38Å; I87-L93 HydrophobicContact CG2-CB 4.43Å; I87-S94 VanDerWaalsContact O-CA 3.29Å; I87-S94 WeakPolarHBondContact O-CA 3.33Å; I87-S94 WeakPolarHBondContact O-CB 3.16Å; I87-S94 PolarHBondContact O-N 2.99Å; I87-S94 VanDerWaalsContact O-N 3.11Å; I87-L97 HydrophobicContact CB-CD1 4.46Å; I87-L97 HydrophobicContact CD1-CD1 3.65Å; I87-L97 HydrophobicContact CG1-CD1 3.91Å; I87-L97 HydrophobicContact CG2-CB 4.05Å; I87-L97 HydrophobicContact CG2-CD1 3.68Å; I87-L97 HydrophobicContact CG2-CG 4.43Å; I87-I102 HydrophobicContact CB-CD1 4.34Å; I87-I102 HydrophobicContact CD1-CD1 3.58Å |
| 88 | R | 97.9 | Very high | 98 | Very high | 49 Ų | 49 | 72 Ų | 72 | 19% | 0.185 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -88.6 | -22.7 | -176.7 | -60.1 | -51.1 | 176.1 | -149 | -2.5 | 114.6 | Q84 A86 L97 V100 L108 | Q84-R88 HydrophobicContact CG-CG 4.4Å; Q84-R88 WeakPolarHBondContact O-CB 3.24Å; Q84-R88 WeakPolarHBondContact O-CG 3.48Å; Q84-R88 PolarHBondContact O-N 3.13Å; A86-R88 PolarHBondContact O-N 3.1Å; R88-L97 PolarHBondContact NH1-O 3.46Å; R88-V100 PolarHBondContact NH2-O 2.86Å; R88-L108 HydrophobicContact CB-CD1 3.59Å; R88-L108 HydrophobicContact CB-CD2 4.04Å; R88-L108 HydrophobicContact CB-CG 3.66Å; R88-L108 HydrophobicContact CG-CG 4.49Å |
| 89 | N | 96.9 | Very high | 97.9 | Very high | 115 Ų | 115 | 72.6 Ų | 72.6 | 62% | 0.615 | 36% | 0.362 | S | S | * | . | H | α-helix | trans | -84.4 | -19.1 | 174.1 | -71.9 | -49 | 0 | 0 | 0 | 112.4 | L85 | L85-N89 VanDerWaalsContact O-CB 3.28Å; L85-N89 WeakPolarHBondContact O-CB 3.36Å; L85-N89 PolarHBondContact O-N 3.28Å; L85-N89 PolarHBondContact O-ND2 3.35Å |
| 90 | D | 97.9 | Very high | 97.8 | Very high | 44 Ų | 44 | 72.3 Ų | 72.3 | 24% | 0.235 | 36% | 0.364 | C | S | . | . | S | Bend | trans | -88.8 | 127.7 | 172.2 | -179.3 | 72.5 | 0 | 0 | 0 | 111.5 | L65 A86 E92 L93 S94 | L65-D90 HydrophobicContact CD1-CB 3.91Å; A86-D90 PolarHBondContact O-N 3.17Å; D90-E92 PolarHBondContact OD2-N 3.27Å; D90-L93 HydrophobicContact CB-CB 4.13Å; D90-L93 HydrophobicContact CB-CD1 4.15Å; D90-L93 HydrophobicContact CB-CG 4.35Å; D90-L93 VanDerWaalsContact OD2-CB 3.27Å; D90-L93 WeakPolarHBondContact OD2-CB 3.35Å; D90-L93 VanDerWaalsContact OD2-CG 3.24Å; D90-L93 WeakPolarHBondContact OD2-CG 3.44Å; D90-L93 PolarHBondContact OD2-N 2.94Å; D90-S94 WeakPolarHBondContact O-CB 3.43Å; D90-S94 PolarHBondContact O-N 3.12Å |
| 91 | E | 97.7 | Very high | 97.7 | Very high | 169 Ų | 169 | 76 Ų | 76 | 79% | 0.79 | 39% | 0.385 | S | S | * | . | H | α-helix | trans | -66.2 | -45 | -173.9 | -174.3 | 180 | 169.2 | 0 | 0 | 112.1 | S94 K95 | E91-S94 PolarHBondContact O-N 3.4Å; E91-K95 WeakPolarHBondContact O-CB 3.44Å; E91-K95 PolarHBondContact O-N 2.73Å |
| 92 | E | 97.9 | Very high | 97.7 | Very high | 148 Ų | 148 | 74.2 Ų | 74.2 | 69% | 0.692 | 38% | 0.381 | S | S | * | . | H | α-helix | trans | -69.2 | -46.9 | -175.6 | -62.4 | -166.5 | 153.7 | 0 | 0 | 111.1 | D90 K95 F96 | D90-E92 PolarHBondContact OD2-N 3.27Å; E92-K95 PolarHBondContact O-N 3.01Å; E92-F96 VanDerWaalsContact O-CB 3.24Å; E92-F96 WeakPolarHBondContact O-CB 3.4Å; E92-F96 PolarHBondContact O-N 2.79Å |
| 93 | L | 98.2 | Very high | 97.7 | Very high | 8 Ų | 8 | 77.6 Ų | 77.6 | 4% | 0.042 | 41% | 0.409 | C | S | . | . | H | α-helix | trans | -66.4 | -38.1 | 176.2 | -68 | 178.3 | 0 | 0 | 0 | 111.8 | E61 V62 L65 I87 D90 K95 F96 L97 | E61-L93 HydrophobicContact CG-CD1 4.31Å; V62-L93 HydrophobicContact CG2-CD1 3.95Å; V62-L93 HydrophobicContact CG2-CD2 3.87Å; L65-L93 HydrophobicContact CD1-CD1 3.72Å; I87-L93 HydrophobicContact CG2-CB 4.43Å; D90-L93 HydrophobicContact CB-CB 4.13Å; D90-L93 HydrophobicContact CB-CD1 4.15Å; D90-L93 HydrophobicContact CB-CG 4.35Å; D90-L93 VanDerWaalsContact OD2-CB 3.27Å; D90-L93 WeakPolarHBondContact OD2-CB 3.35Å; D90-L93 VanDerWaalsContact OD2-CG 3.24Å; D90-L93 WeakPolarHBondContact OD2-CG 3.44Å; D90-L93 PolarHBondContact OD2-N 2.94Å; L93-K95 VanDerWaalsContact C-N 3.31Å; L93-K95 PolarHBondContact O-N 3.17Å; L93-F96 PolarHBondContact O-N 3.48Å; L93-L97 WeakPolarHBondContact O-CB 3.47Å; L93-L97 PolarHBondContact O-N 3.16Å |
| 94 | S | 97.8 | Very high | 97.6 | Very high | 42 Ų | 42 | 83.6 Ų | 83.6 | 29% | 0.294 | 44% | 0.436 | S | S | . | . | H | α-helix | trans | -63.5 | -40.6 | 177.1 | -172.7 | 0 | 0 | 0 | 0 | 111 | I87 D90 E91 L97 R98 | I87-S94 VanDerWaalsContact O-CA 3.29Å; I87-S94 WeakPolarHBondContact O-CA 3.33Å; I87-S94 WeakPolarHBondContact O-CB 3.16Å; I87-S94 PolarHBondContact O-N 2.99Å; I87-S94 VanDerWaalsContact O-N 3.11Å; D90-S94 WeakPolarHBondContact O-CB 3.43Å; D90-S94 PolarHBondContact O-N 3.12Å; E91-S94 PolarHBondContact O-N 3.4Å; S94-L97 CarbonylContact O-C 3.58Å; S94-R98 PolarHBondContact O-N 3.03Å |
| 95 | K | 98.1 | Very high | 97.6 | Very high | 167 Ų | 167 | 82.9 Ų | 82.9 | 73% | 0.726 | 43% | 0.433 | S | S | * | . | H | α-helix | trans | -68.6 | -46.5 | 173.7 | -175.6 | 179.2 | -179.4 | 179.2 | 0 | 112.1 | E91 E92 L93 L97 R98 | E91-K95 WeakPolarHBondContact O-CB 3.44Å; E91-K95 PolarHBondContact O-N 2.73Å; E92-K95 PolarHBondContact O-N 3.01Å; L93-K95 VanDerWaalsContact C-N 3.31Å; L93-K95 PolarHBondContact O-N 3.17Å; K95-L97 VanDerWaalsContact C-N 3.34Å; K95-L97 PolarHBondContact O-N 3.16Å; K95-R98 VanDerWaalsContact O-CB 3.25Å; K95-R98 WeakPolarHBondContact O-CB 3.38Å; K95-R98 PolarHBondContact O-N 3.4Å |
| 96 | F | 97.7 | Very high | 97.5 | Very high | 132 Ų | 132 | 83.9 Ų | 83.9 | 58% | 0.579 | 45% | 0.45 | S | S | * | . | H | α-helix | trans | -62.7 | -40.3 | -179.6 | -179.3 | -111.5 | 0 | 0 | 0 | 112 | L58 E92 L93 | L58-F96 HydrophobicContact CD1-CE1 4.16Å; L58-F96 HydrophobicContact CD1-CZ 4Å; L58-F96 HydrophobicContact CD2-CE1 4.48Å; E92-F96 VanDerWaalsContact O-CB 3.24Å; E92-F96 WeakPolarHBondContact O-CB 3.4Å; E92-F96 PolarHBondContact O-N 2.79Å; L93-F96 PolarHBondContact O-N 3.48Å |
| 97 | L | 97.4 | Very high | 97.4 | Very high | 38 Ų | 38 | 88.7 Ų | 88.7 | 20% | 0.199 | 48% | 0.479 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -100.6 | 31.4 | 179.2 | -58.3 | 175.8 | 0 | 0 | 0 | 112.2 | I87 R88 L93 S94 K95 G99 V100 | I87-L97 HydrophobicContact CB-CD1 4.46Å; I87-L97 HydrophobicContact CD1-CD1 3.65Å; I87-L97 HydrophobicContact CG1-CD1 3.91Å; I87-L97 HydrophobicContact CG2-CB 4.05Å; I87-L97 HydrophobicContact CG2-CD1 3.68Å; I87-L97 HydrophobicContact CG2-CG 4.43Å; R88-L97 PolarHBondContact NH1-O 3.46Å; L93-L97 WeakPolarHBondContact O-CB 3.47Å; L93-L97 PolarHBondContact O-N 3.16Å; S94-L97 CarbonylContact O-C 3.58Å; K95-L97 VanDerWaalsContact C-N 3.34Å; K95-L97 PolarHBondContact O-N 3.16Å; L97-G99 PolarHBondContact O-N 3.03Å; L97-V100 HydrophobicContact CB-CB 4.27Å; L97-V100 HydrophobicContact CB-CG2 4.23Å; L97-V100 HydrophobicContact CD2-CG2 4.18Å; L97-V100 PolarHBondContact O-N 3.01Å |
| 98 | R | 96.6 | Very high | 97.3 | Very high | 219 Ų | 219 | 90.9 Ų | 90.9 | 83% | 0.826 | 49% | 0.49 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63.6 | 122.3 | 174.6 | -176.6 | 176.4 | -179.2 | -89.6 | 0.1 | 109.5 | S94 K95 | S94-R98 PolarHBondContact O-N 3.03Å; K95-R98 VanDerWaalsContact O-CB 3.25Å; K95-R98 WeakPolarHBondContact O-CB 3.38Å; K95-R98 PolarHBondContact O-N 3.4Å |
| 99 | G | 95.9 | Very high | 97.1 | Very high | 77 Ų | 77 | 93.8 Ų | 93.8 | 79% | 0.794 | 52% | 0.516 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 87.7 | -4.1 | -179.4 | 0 | 0 | 0 | 0 | 0 | 115.3 | L97 | L97-G99 PolarHBondContact O-N 3.03Š|
| 100 | V | 97 | Very high | 97 | Very high | 73 Ų | 73 | 94.1 Ų | 94.1 | 44% | 0.442 | 52% | 0.517 | S | S | . | . | trans | -78.2 | 128.5 | 172.2 | 177.2 | 0 | 0 | 0 | 0 | 109.5 | R88 L97 | R88-V100 PolarHBondContact NH2-O 2.86Å; L97-V100 HydrophobicContact CB-CB 4.27Å; L97-V100 HydrophobicContact CB-CG2 4.23Å; L97-V100 HydrophobicContact CD2-CG2 4.18Å; L97-V100 PolarHBondContact O-N 3.01Å | ||
| 101 | T | 97.3 | Very high | 96.9 | Very high | 129 Ų | 129 | 97.6 Ų | 97.6 | 79% | 0.791 | 53% | 0.534 | S | S | * | . | trans | -93.1 | 125.3 | 173 | -63.6 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 102 | I | 97.5 | Very high | 96.7 | Very high | 31 Ų | 31 | 94.9 Ų | 94.9 | 16% | 0.159 | 52% | 0.522 | C | S | . | . | trans | -94.6 | 99.8 | 173.4 | -55.9 | 173.8 | 0 | 0 | 0 | 107.5 | P80 L83 Q84 I87 Q104 G105 | P80-I102 HydrophobicContact CB-CG2 4.34Å; L83-I102 HydrophobicContact CB-CG2 4.46Å; Q84-I102 HydrophobicContact CB-CD1 4.43Å; I87-I102 HydrophobicContact CB-CD1 4.34Å; I87-I102 HydrophobicContact CD1-CD1 3.58Å; I102-Q104 PolarHBondContact O-N 3.26Å; I102-G105 PolarHBondContact O-N 3.35Å | ||
| 103 | A | 98.1 | Very high | 96.5 | Very high | 75 Ų | 75 | 91.6 Ų | 91.6 | 62% | 0.62 | 52% | 0.52 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -54.7 | 135.4 | 177.1 | 0 | 0 | 0 | 0 | 0 | 110.4 | P80 G105 | P80-A103 VanDerWaalsContact CB-O 3.29Å; P80-A103 WeakPolarHBondContact CB-O 3.47Å; A103-G105 PolarHBondContact O-N 2.96Å; A103-G105 VanDerWaalsContact O-N 3.15Å |
| 104 | Q | 98 | Very high | 96.3 | Very high | 176 Ų | 176 | 96.3 Ų | 96.3 | 82% | 0.822 | 55% | 0.554 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 62.3 | 11.3 | -176.4 | -53 | -62.3 | -32.4 | 0 | 0 | 115.2 | P80 I102 | P80-Q104 HydrophobicContact CB-CB 4.06Å; P80-Q104 HydrophobicContact CG-CB 4.21Å; I102-Q104 PolarHBondContact O-N 3.26Å |
| 105 | G | 97.8 | Very high | 96.2 | Very high | 1 Ų | 1 | 100.6 Ų | 100.6 | 1% | 0.01 | 57% | 0.573 | C | S | . | * | trans | -79.6 | -22.5 | 177.7 | 0 | 0 | 0 | 0 | 0 | 114.8 | R81 Q84 I102 A103 | R81-G105 WeakPolarHBondContact CD-O 3.48Å; R81-G105 PolarHBondContact NH1-O 3.28Å; R81-G105 VanDerWaalsContact NH1-O 3.08Å; Q84-G105 WeakPolarHBondContact CB-O 3.43Å; Q84-G105 WeakPolarHBondContact CG-O 3.39Å; I102-G105 PolarHBondContact O-N 3.35Å; A103-G105 PolarHBondContact O-N 2.96Å; A103-G105 VanDerWaalsContact O-N 3.15Å | ||
| 106 | G | 96.5 | Very high | 95.9 | Very high | 50 Ų | 50 | 97.3 Ų | 97.3 | 52% | 0.515 | 56% | 0.563 | S | S | . | * | trans | 65.4 | -154.9 | -168.3 | 0 | 0 | 0 | 0 | 0 | 111.7 | Q84 | Q84-G106 VanDerWaalsContact CD-O 3.27Å; Q84-G106 WeakPolarHBondContact CG-O 3.43Å; Q84-G106 PolarHBondContact NE2-O 3.39Å | ||
| 107 | V | 96.1 | Very high | 95.7 | Very high | 109 Ų | 109 | 96.7 Ų | 96.7 | 66% | 0.661 | 57% | 0.572 | S | S | * | * | trans | -127.1 | 162 | 179.1 | -63.2 | 0 | 0 | 0 | 0 | 111 | R81 | R81-V107 PolarHBondContact NH1-O 3.12Å; R81-V107 PolarHBondContact NH2-O 3.48Å | ||
| 108 | L | 95.4 | Very high | 95.1 | Very high | 56 Ų | 56 | 104.3 Ų | 104.3 | 29% | 0.293 | 60% | 0.603 | S | S | . | * | trans | -59 | 132.8 | 167.4 | -72.4 | -177.7 | 0 | 0 | 0 | 108.6 | L85 R88 N110 | L85-L108 HydrophobicContact CD2-CD2 3.93Å; R88-L108 HydrophobicContact CB-CD1 3.59Å; R88-L108 HydrophobicContact CB-CD2 4.04Å; R88-L108 HydrophobicContact CB-CG 3.66Å; R88-L108 HydrophobicContact CG-CG 4.49Å; L108-N110 PolarHBondContact O-N 2.89Å; L108-N110 VanDerWaalsContact O-N 3.12Å | ||
| 109 | P | 93.6 | Very high | 94.4 | Very high | 111 Ų | 111 | 103.9 Ų | 103.9 | 72% | 0.721 | 61% | 0.608 | S | S | * | * | trans | -57.4 | 120.3 | 175.2 | -21.8 | 33.9 | 0 | 0 | 0 | 109.4 | ||||
| 110 | N | 94.8 | Very high | 93.5 | Very high | 122 Ų | 122 | 106.3 Ų | 106.3 | 65% | 0.652 | 61% | 0.607 | S | S | * | * | trans | -149.9 | 132.1 | 177.9 | 179.9 | 46.1 | 0 | 0 | 0 | 108.5 | L108 Q112 | L108-N110 PolarHBondContact O-N 2.89Å; L108-N110 VanDerWaalsContact O-N 3.12Å; N110-Q112 PolarHBondContact ND2-NE2 3.38Å | ||
| 111 | I | 95.4 | Very high | 92.3 | Very high | 116 Ų | 116 | 110.1 Ų | 110.1 | 60% | 0.595 | 63% | 0.625 | S | S | * | * | trans | -114.5 | 120.4 | 176.3 | -59.9 | 174.5 | 0 | 0 | 0 | 107.2 | L115 L116 | I111-L115 HydrophobicContact CG2-CB 4.16Å; I111-L116 HydrophobicContact CG2-CD2 3.82Å; I111-L116 HydrophobicContact CG2-CG 4.25Å | ||
| 112 | Q | 94.1 | Very high | 90.9 | Very high | 112 Ų | 112 | 110.2 Ų | 110.2 | 52% | 0.523 | 63% | 0.625 | S | S | . | * | trans | -65 | 136.8 | 174 | -65.3 | -63.3 | -27.2 | 0 | 0 | 109.6 | N110 S114 L115 | N110-Q112 PolarHBondContact ND2-NE2 3.38Å; Q112-S114 PolarHBondContact O-N 3.01Å; Q112-L115 HydrophobicContact CB-CD1 4.26Å; Q112-L115 HydrophobicContact CB-CG 4.26Å; Q112-L115 WeakPolarHBondContact O-CB 3.18Å; Q112-L115 PolarHBondContact O-N 3.22Å | ||
| 113 | A | 93.4 | Very high | 89.2 | Confident | 80 Ų | 80 | 117.7 Ų | 117.7 | 66% | 0.661 | 66% | 0.656 | S | S | * | * | G | 310 helix | trans | -57.4 | -28.5 | -176.3 | 0 | 0 | 0 | 0 | 0 | 113.3 | L115 L116 | A113-L115 PolarHBondContact O-N 2.99Å; A113-L116 WeakPolarHBondContact O-CB 3.39Å; A113-L116 PolarHBondContact O-N 3.28Å |
| 114 | S | 94.3 | Very high | 87.3 | Confident | 107 Ų | 107 | 120.3 Ų | 120.3 | 75% | 0.748 | 67% | 0.665 | S | S | * | * | G | 310 helix | trans | -65.6 | -22.4 | 174.9 | 55.4 | 0 | 0 | 0 | 0 | 114.3 | Q112 | Q112-S114 PolarHBondContact O-N 3.01Š|
| 115 | L | 94.6 | Very high | 85.7 | Confident | 131 Ų | 131 | 117.8 Ų | 117.8 | 69% | 0.686 | 66% | 0.662 | S | S | * | * | G | 310 helix | trans | -87.8 | -9.4 | 177.5 | -59.1 | 177.2 | 0 | 0 | 0 | 112.4 | I111 Q112 A113 | I111-L115 HydrophobicContact CG2-CB 4.16Å; Q112-L115 HydrophobicContact CB-CD1 4.26Å; Q112-L115 HydrophobicContact CB-CG 4.26Å; Q112-L115 WeakPolarHBondContact O-CB 3.18Å; Q112-L115 PolarHBondContact O-N 3.22Å; A113-L115 PolarHBondContact O-N 2.99Å |
| 116 | L | 93.5 | Very high | 84 | Confident | 98 Ų | 98 | 123.4 Ų | 123.4 | 51% | 0.513 | 70% | 0.698 | S | S | . | * | S | Bend | trans | -75 | 143.4 | 174.5 | -62.9 | 175.2 | 0 | 0 | 0 | 109.8 | I111 A113 K118 | I111-L116 HydrophobicContact CG2-CD2 3.82Å; I111-L116 HydrophobicContact CG2-CG 4.25Å; A113-L116 WeakPolarHBondContact O-CB 3.39Å; A113-L116 PolarHBondContact O-N 3.28Å; L116-K118 PolarHBondContact O-N 2.91Å |
| 117 | P | 92 | Very high | 82.3 | Confident | 119 Ų | 119 | 130.4 Ų | 130.4 | 77% | 0.773 | 71% | 0.714 | S | S | * | * | P | Polyproline II helix | trans | -58.5 | 134.7 | 176.3 | 23 | -31.8 | 0 | 0 | 0 | 110.2 | K119 | P117-K119 PolarHBondContact O-N 3.02Š|
| 118 | K | 86 | Confident | 80.9 | Confident | 199 Ų | 199 | 135 Ų | 135 | 87% | 0.865 | 73% | 0.725 | S | S | * | * | P | Polyproline II helix | trans | -60.5 | 128.5 | 171.5 | -66.6 | -175.3 | -179.4 | -179.2 | 0 | 107.8 | L116 T120 | L116-K118 PolarHBondContact O-N 2.91Å; K118-T120 PolarHBondContact O-N 2.96Å |
| 119 | K | 81.8 | Confident | 79.6 | Confident | 210 Ų | 210 | 143.5 Ų | 143.5 | 91% | 0.913 | 77% | 0.771 | S | S | * | * | trans | -54.4 | 115 | 171.1 | -71.8 | -176.9 | 177.5 | -177.7 | 0 | 107.6 | P117 | P117-K119 PolarHBondContact O-N 3.02Š| ||
| 120 | T | 75.5 | Confident | 78.9 | Confident | 127 Ų | 127 | 145.1 Ų | 145.1 | 78% | 0.779 | 77% | 0.773 | S | S | * | * | trans | -77.9 | 125.9 | 164.7 | 14.3 | 0 | 0 | 0 | 0 | 105.9 | K118 V122 | K118-T120 PolarHBondContact O-N 2.96Å; T120-V122 PolarHBondContact O-N 3.01Å | ||
| 121 | D | 73 | Confident | 78 | Confident | 153 Ų | 153 | 146.3 Ų | 146.3 | 82% | 0.818 | 78% | 0.78 | S | S | * | * | trans | -56.6 | 112.2 | 167.3 | -77.7 | -40.1 | 0 | 0 | 0 | 107 | K123 | D121-K123 VanDerWaalsContact C-N 3.3Å; D121-K123 PolarHBondContact O-N 3.25Å | ||
| 122 | V | 67 | Low | 77.1 | Confident | 131 Ų | 131 | 148 Ų | 148 | 79% | 0.794 | 79% | 0.79 | S | S | * | * | trans | -59.8 | 103.5 | 168.9 | 176.9 | 0 | 0 | 0 | 0 | 104.3 | T120 T124 | T120-V122 PolarHBondContact O-N 3.01Å; V122-T124 VanDerWaalsContact C-N 3.32Å; V122-T124 PolarHBondContact O-N 3.17Å | ||
| 123 | K | 62.1 | Low | 76.1 | Confident | 188 Ų | 188 | 150.1 Ų | 150.1 | 82% | 0.817 | 81% | 0.806 | S | S | * | * | trans | -54.4 | 104.9 | 171.3 | -76.3 | -175.3 | 177.5 | -179.3 | 0 | 105.9 | D121 T125 | D121-K123 VanDerWaalsContact C-N 3.3Å; D121-K123 PolarHBondContact O-N 3.25Å; K123-T125 VanDerWaalsContact C-N 3.28Å; K123-T125 PolarHBondContact O-N 3.05Å | ||
| 124 | T | 59.5 | Low | 75 | Confident | 131 Ų | 131 | 154.5 Ų | 154.5 | 80% | 0.804 | 82% | 0.815 | S | S | * | * | trans | -57.2 | 98.7 | 166.7 | 34.7 | 0 | 0 | 0 | 0 | 106.2 | V122 P126 | V122-T124 VanDerWaalsContact C-N 3.32Å; V122-T124 PolarHBondContact O-N 3.17Å; T124-P126 WeakPolarHBondContact O-CD 3.47Å | ||
| 125 | T | 63 | Low | 73.7 | Confident | 123 Ų | 123 | 157.7 Ų | 157.7 | 76% | 0.755 | 82% | 0.819 | S | S | * | * | P | Polyproline II helix | trans | -58.9 | 122.3 | 166.3 | 39.8 | 0 | 0 | 0 | 0 | 106.6 | K123 K127 | K123-T125 VanDerWaalsContact C-N 3.28Å; K123-T125 PolarHBondContact O-N 3.05Å; T125-K127 PolarHBondContact O-N 3.19Å |
| 126 | P | 61.6 | Low | 72.2 | Confident | 119 Ų | 119 | 159.6 Ų | 159.6 | 77% | 0.773 | 83% | 0.829 | S | S | * | * | P | Polyproline II helix | trans | -60.2 | 128.8 | 178 | 5.5 | -1.4 | 0 | 0 | 0 | 107.9 | T124 K128 | T124-P126 WeakPolarHBondContact O-CD 3.47Å; P126-K128 PolarHBondContact O-N 3.47Å; P126-K128 VanDerWaalsContact O-N 3.12Å |
| 127 | K | 62.8 | Low | 70.6 | Confident | 197 Ų | 197 | 164.3 Ų | 164.3 | 86% | 0.857 | 85% | 0.853 | S | S | * | * | P | Polyproline II helix | trans | -55.1 | 119.4 | 166.6 | -82.9 | 179.4 | 171.9 | 179.1 | 0 | 106.4 | T125 | T125-K127 PolarHBondContact O-N 3.19Š|
| 128 | K | 65.4 | Low | 68.8 | Low | 205 Ų | 205 | 168.1 Ų | 168.1 | 89% | 0.891 | 86% | 0.86 | S | S | * | * | P | Polyproline II helix | trans | -71.9 | 124.8 | 163.1 | -86.9 | -177.4 | 170.5 | -177.1 | 0 | 106.7 | P126 | P126-K128 PolarHBondContact O-N 3.47Å; P126-K128 VanDerWaalsContact O-N 3.12Å |
| 129 | D | 67.8 | Low | 67.2 | Low | 234 Ų | 234 | 165.3 Ų | 165.3 | 100% | 1.251 | 86% | 0.859 | S | S | * | * | trans | -56.5 | 0 | 169.2 | -56.3 | -53 | 0 | 0 | 0 | 111.7 |
Retrieved 129 of 129 residues in 607.7 ms
(Link to these results)