| 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 | 47 | Very low | 55.1 | Low | 249 Ų | 249 | 153.2 Ų | 153.2 | 100% | 1.227 | 85% | 0.853 | S | S | * | * | 0 | 93.4 | 0 | -69.5 | -126.2 | -99.2 | 0 | 0 | 109.2 | |||||
| 2 | S | 47.9 | Very low | 55.6 | Low | 133 Ų | 133 | 150.8 Ų | 150.8 | 93% | 0.93 | 85% | 0.854 | S | S | * | * | trans | -100.2 | 92.6 | 176 | -179.4 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 3 | G | 52.9 | Low | 56.4 | Low | 70 Ų | 70 | 152.8 Ų | 152.8 | 72% | 0.722 | 85% | 0.848 | S | S | * | * | trans | -92.3 | 116.6 | 174.7 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 4 | R | 58.4 | Low | 57.4 | Low | 230 Ų | 230 | 151.8 Ų | 151.8 | 87% | 0.868 | 85% | 0.848 | S | S | * | * | trans | 51.2 | 97.6 | 130.9 | -149.6 | 171.6 | -162.4 | 168.3 | 3.3 | 117.8 | ||||
| 5 | G | 50.8 | Low | 59 | Low | 72 Ų | 72 | 149 Ų | 149 | 74% | 0.742 | 84% | 0.843 | S | S | * | * | trans | -112.1 | 104.2 | 148.6 | 0 | 0 | 0 | 0 | 0 | 109.7 | K7 | G5-K7 PolarHBondContact O-N 3.45Š| ||
| 6 | K | 59.8 | Low | 61 | Low | 192 Ų | 192 | 143.8 Ų | 143.8 | 84% | 0.835 | 82% | 0.815 | S | S | * | * | trans | -50.5 | 114.1 | 164.3 | -94.6 | 175.3 | 172.6 | 174.6 | 0 | 106.7 | A8 | K6-A8 PolarHBondContact O-N 2.8Å; K6-A8 VanDerWaalsContact O-N 3.12Å | ||
| 7 | K | 55.2 | Low | 63 | Low | 211 Ų | 211 | 138.5 Ų | 138.5 | 92% | 0.917 | 79% | 0.79 | S | S | * | * | trans | -50.4 | 123.6 | 178.2 | -84.2 | -178.8 | 175.4 | 177.3 | 0 | 109 | G5 | G5-K7 PolarHBondContact O-N 3.45Š| ||
| 8 | A | 54.8 | Low | 64.8 | Low | 90 Ų | 90 | 136.2 Ų | 136.2 | 74% | 0.744 | 77% | 0.766 | S | S | * | * | trans | -47.6 | 151.3 | 174.6 | 0 | 0 | 0 | 0 | 0 | 111.3 | K6 S10 | K6-A8 PolarHBondContact O-N 2.8Å; K6-A8 VanDerWaalsContact O-N 3.12Å; A8-S10 VanDerWaalsContact C-N 3.3Å; A8-S10 PolarHBondContact O-N 2.94Å | ||
| 9 | V | 60 | Low | 66.5 | Low | 152 Ų | 152 | 129.8 Ų | 129.8 | 92% | 0.921 | 73% | 0.731 | S | S | * | * | trans | -49.5 | 91.9 | 176.8 | -178.4 | 0 | 0 | 0 | 0 | 109.4 | K11 | V9-K11 PolarHBondContact O-N 3.28Š| ||
| 10 | S | 59.8 | Low | 68 | Low | 89 Ų | 89 | 128.5 Ų | 128.5 | 62% | 0.622 | 73% | 0.726 | S | S | * | * | trans | -68.9 | 130.9 | 172.4 | 59.7 | 0 | 0 | 0 | 0 | 107.2 | A8 S12 | A8-S10 VanDerWaalsContact C-N 3.3Å; A8-S10 PolarHBondContact O-N 2.94Å; S10-S12 PolarHBondContact O-N 3.13Å | ||
| 11 | K | 59.3 | Low | 69.4 | Low | 197 Ų | 197 | 130.5 Ų | 130.5 | 86% | 0.857 | 72% | 0.722 | S | S | * | * | trans | -22.2 | 128.1 | 167.1 | -89.2 | 177.9 | 172.4 | 175.3 | 0 | 111.1 | V9 K13 | V9-K11 PolarHBondContact O-N 3.28Å; K11-K13 VanDerWaalsContact C-N 3.25Å; K11-K13 PolarHBondContact O-N 3.19Å | ||
| 12 | S | 62.1 | Low | 71.8 | Confident | 124 Ų | 124 | 120.6 Ų | 120.6 | 87% | 0.867 | 68% | 0.68 | S | S | * | * | trans | -42.6 | 87.8 | 173.6 | 160.6 | 0 | 0 | 0 | 0 | 110.8 | S10 T14 | S10-S12 PolarHBondContact O-N 3.13Å; S12-T14 PolarHBondContact O-N 2.99Å | ||
| 13 | K | 65.9 | Low | 74.2 | Confident | 177 Ų | 177 | 117.3 Ų | 117.3 | 77% | 0.77 | 67% | 0.667 | S | S | * | * | trans | -65.2 | 130.5 | 167.3 | -77.3 | -174.6 | 175.4 | -176.1 | 0 | 105.1 | K11 S15 | K11-K13 VanDerWaalsContact C-N 3.25Å; K11-K13 PolarHBondContact O-N 3.19Å; K13-S15 PolarHBondContact O-N 3.29Å | ||
| 14 | T | 69.4 | Low | 76.3 | Confident | 139 Ų | 139 | 115.2 Ų | 115.2 | 85% | 0.853 | 64% | 0.639 | S | S | * | * | trans | -45 | 109.3 | 169.1 | 12.9 | 0 | 0 | 0 | 0 | 108 | S12 T16 | S12-T14 PolarHBondContact O-N 2.99Å; T14-T16 PolarHBondContact O-N 2.83Å; T14-T16 VanDerWaalsContact O-N 3.07Å | ||
| 15 | S | 82.3 | Confident | 78.2 | Confident | 110 Ų | 110 | 112.4 Ų | 112.4 | 77% | 0.769 | 64% | 0.635 | S | S | * | * | trans | -70.8 | 112.9 | -172.7 | 104.3 | 0 | 0 | 0 | 0 | 107.4 | K13 S17 | K13-S15 PolarHBondContact O-N 3.29Å; S15-S17 PolarHBondContact O-N 3.32Å | ||
| 16 | T | 90.6 | Very high | 80.5 | Confident | 65 Ų | 65 | 111.9 Ų | 111.9 | 40% | 0.399 | 61% | 0.613 | S | S | . | * | trans | -61.4 | 128.8 | 173.3 | -41.5 | 0 | 0 | 0 | 0 | 109 | T14 V20 R21 | T14-T16 PolarHBondContact O-N 2.83Å; T14-T16 VanDerWaalsContact O-N 3.07Å; T16-V20 HydrophobicContact CG2-CB 3.87Å; T16-V20 HydrophobicContact CG2-CG1 3.54Å; T16-R21 HydrophobicContact CG2-CG 3.81Å | ||
| 17 | S | 94.5 | Very high | 82.3 | Confident | 55 Ų | 55 | 105 Ų | 105 | 39% | 0.385 | 59% | 0.588 | S | S | . | * | trans | -65.4 | 154.4 | 179.6 | 81.1 | 0 | 0 | 0 | 0 | 110.8 | S15 S19 V20 R21 | S15-S17 PolarHBondContact O-N 3.32Å; S17-S19 PolarHBondContact O-N 2.89Å; S17-V20 PolarHBondContact O-N 3.16Å; S17-V20 VanDerWaalsContact OG-CG2 3.31Å; S17-V20 WeakPolarHBondContact OG-CG2 3.42Å; S17-V20 PolarHBondContact OG-N 2.88Å; S17-V20 VanDerWaalsContact OG-N 3.09Å; S17-R21 WeakPolarHBondContact O-CG 3.44Å; S17-R21 PolarHBondContact O-N 2.9Å | ||
| 18 | R | 95.5 | Very high | 84.4 | Confident | 97 Ų | 97 | 94.9 Ų | 94.9 | 37% | 0.366 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -62.1 | -32 | 174.7 | -74.6 | -172.7 | -76.5 | 165.4 | -8.3 | 112.5 | A22 V28 H32 | R18-A22 VanDerWaalsContact O-CB 3.31Å; R18-A22 WeakPolarHBondContact O-CB 3.36Å; R18-A22 PolarHBondContact O-N 3.35Å; R18-V28 HydrophobicContact CB-CB 4.12Å; R18-V28 HydrophobicContact CB-CG1 3.88Å; R18-H32 PolarHBondContact NH1-ND1 3.07Å; R18-H32 VanDerWaalsContact NH1-ND1 3.19Å |
| 19 | S | 97.4 | Very high | 86.4 | Confident | 15 Ų | 15 | 92.1 Ų | 92.1 | 11% | 0.105 | 52% | 0.524 | C | S | . | . | H | α-helix | trans | -63.3 | -50.7 | 174.6 | -63.7 | 0 | 0 | 0 | 0 | 111.4 | S17 R21 A22 G23 L24 F26 P27 V28 | S17-S19 PolarHBondContact O-N 2.89Å; S19-R21 VanDerWaalsContact C-N 3.31Å; S19-R21 PolarHBondContact O-N 3.04Å; S19-A22 CarbonylContact O-C 3.48Å; S19-A22 PolarHBondContact O-N 2.75Å; S19-G23 PolarHBondContact O-N 2.84Å; S19-L24 WeakPolarHBondContact CB-O 3.14Å; S19-L24 PolarHBondContact O-N 2.94Å; S19-F26 WeakPolarHBondContact CB-O 3.13Å; S19-F26 PolarHBondContact OG-O 2.82Å; S19-P27 WeakPolarHBondContact OG-CA 3.34Å; S19-V28 PolarHBondContact OG-N 3.16Å |
| 20 | V | 97.3 | Very high | 88.2 | Confident | 102 Ų | 102 | 92.1 Ų | 92.1 | 62% | 0.618 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -60.8 | -41.1 | 178.2 | 171.3 | 0 | 0 | 0 | 0 | 111.2 | T16 S17 A22 G23 | T16-V20 HydrophobicContact CG2-CB 3.87Å; T16-V20 HydrophobicContact CG2-CG1 3.54Å; S17-V20 PolarHBondContact O-N 3.16Å; S17-V20 VanDerWaalsContact OG-CG2 3.31Å; S17-V20 WeakPolarHBondContact OG-CG2 3.42Å; S17-V20 PolarHBondContact OG-N 2.88Å; S17-V20 VanDerWaalsContact OG-N 3.09Å; V20-A22 VanDerWaalsContact C-N 3.26Å; V20-A22 PolarHBondContact O-N 3.15Å; V20-G23 PolarHBondContact O-N 3.26Å |
| 21 | R | 96.4 | Very high | 90.1 | Very high | 172 Ų | 172 | 88.6 Ų | 88.6 | 65% | 0.649 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -64.9 | -29 | 175.4 | -71.5 | -180 | 178.7 | 145.4 | 5.3 | 113.8 | T16 S17 S19 | T16-R21 HydrophobicContact CG2-CG 3.81Å; S17-R21 WeakPolarHBondContact O-CG 3.44Å; S17-R21 PolarHBondContact O-N 2.9Å; S19-R21 VanDerWaalsContact C-N 3.31Å; S19-R21 PolarHBondContact O-N 3.04Å |
| 22 | A | 97.2 | Very high | 91.9 | Very high | 41 Ų | 41 | 80 Ų | 80 | 34% | 0.339 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -90.6 | -4.9 | 178.7 | 0 | 0 | 0 | 0 | 0 | 113.1 | R18 S19 V20 L24 V50 | R18-A22 VanDerWaalsContact O-CB 3.31Å; R18-A22 WeakPolarHBondContact O-CB 3.36Å; R18-A22 PolarHBondContact O-N 3.35Å; S19-A22 CarbonylContact O-C 3.48Å; S19-A22 PolarHBondContact O-N 2.75Å; V20-A22 VanDerWaalsContact C-N 3.26Å; V20-A22 PolarHBondContact O-N 3.15Å; A22-L24 VanDerWaalsContact C-N 3.29Å; A22-L24 HydrophobicContact CB-CD1 4Å; A22-L24 HydrophobicContact CB-CG 4.03Å; A22-L24 PolarHBondContact O-N 3.17Å; A22-V50 HydrophobicContact CB-CG1 3.83Å |
| 23 | G | 97.9 | Very high | 93.7 | Very high | 63 Ų | 63 | 80.8 Ų | 80.8 | 65% | 0.649 | 43% | 0.428 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 69.9 | 23.3 | -175.2 | 0 | 0 | 0 | 0 | 0 | 114.3 | S19 V20 | S19-G23 PolarHBondContact O-N 2.84Å; V20-G23 PolarHBondContact O-N 3.26Å |
| 24 | L | 98.3 | Very high | 95.2 | Very high | 27 Ų | 27 | 76.6 Ų | 76.6 | 14% | 0.141 | 41% | 0.414 | C | S | . | . | trans | -106 | 140.5 | -175.7 | -63.1 | 176.3 | 0 | 0 | 0 | 111.4 | S19 A22 V28 V50 A53 A54 E57 | S19-L24 WeakPolarHBondContact CB-O 3.14Å; S19-L24 PolarHBondContact O-N 2.94Å; A22-L24 VanDerWaalsContact C-N 3.29Å; A22-L24 HydrophobicContact CB-CD1 4Å; A22-L24 HydrophobicContact CB-CG 4.03Å; A22-L24 PolarHBondContact O-N 3.17Å; L24-V28 HydrophobicContact CD1-CG2 3.84Å; L24-V50 HydrophobicContact CD1-CG1 4.26Å; L24-A53 HydrophobicContact CD1-CB 3.81Å; L24-A54 HydrophobicContact CD1-CB 4.13Å; L24-A54 HydrophobicContact CD2-CB 3.89Å; L24-E57 WeakPolarHBondContact CA-OE2 3.44Å; L24-E57 WeakPolarHBondContact CB-OE2 3.29Å | ||
| 25 | Q | 98.4 | Very high | 96.6 | Very high | 170 Ų | 170 | 71.2 Ų | 71.2 | 79% | 0.794 | 38% | 0.38 | S | S | * | . | S | Bend | trans | -75.1 | -33.2 | 167.2 | -60.6 | -56.8 | -34.6 | 0 | 0 | 111.5 | E57 | Q25-E57 PolarHBondContact N-OE1 3.08Å; Q25-E57 VanDerWaalsContact N-OE1 3.15Å; Q25-E57 PolarHBondContact N-OE2 3.41Å |
| 26 | F | 98.3 | Very high | 97.3 | Very high | 61 Ų | 61 | 71.8 Ų | 71.8 | 27% | 0.268 | 37% | 0.368 | S | S | . | . | S | Bend | trans | -68.9 | 147.3 | -179 | -93.8 | 47.3 | 0 | 0 | 0 | 112.4 | S19 V28 I31 A53 L56 E57 C60 | S19-F26 WeakPolarHBondContact CB-O 3.13Å; S19-F26 PolarHBondContact OG-O 2.82Å; F26-V28 PolarHBondContact O-N 2.86Å; F26-I31 HydrophobicContact CD2-CD1 4.41Å; F26-A53 HydrophobicContact CB-CB 4.38Å; F26-L56 HydrophobicContact CD2-CB 3.81Å; F26-L56 HydrophobicContact CE2-CB 3.73Å; F26-E57 HydrophobicContact CB-CB 4.15Å; F26-E57 WeakPolarHBondContact CB-OE2 3.49Å; F26-E57 HydrophobicContact CD1-CB 3.75Å; F26-E57 HydrophobicContact CD1-CG 3.86Å; F26-E57 HydrophobicContact CD2-CB 4.45Å; F26-E57 HydrophobicContact CE1-CB 4.27Å; F26-E57 HydrophobicContact CE1-CG 4.38Å; F26-E57 HydrophobicContact CG-CB 3.86Å; F26-E57 HydrophobicContact CG-CG 4.42Å; F26-E57 PolarHBondContact N-OE2 2.93Å; F26-C60 HydrophobicContact CE1-CB 4.25Å; F26-C60 HydrophobicContact CZ-CB 3.81Å |
| 27 | P | 98.2 | Very high | 97.7 | Very high | 47 Ų | 47 | 76.1 Ų | 76.1 | 31% | 0.305 | 38% | 0.382 | S | S | . | . | trans | -82.2 | 85 | -171.6 | 33.4 | -37 | 0 | 0 | 0 | 112.5 | S19 G29 R30 I31 | S19-P27 WeakPolarHBondContact OG-CA 3.34Å; P27-G29 PolarHBondContact O-N 3.1Å; P27-G29 VanDerWaalsContact O-N 3.11Å; P27-R30 HydrophobicContact CB-CB 3.84Å; P27-R30 HydrophobicContact CG-CB 3.98Å; P27-R30 WeakPolarHBondContact O-CB 3.04Å; P27-R30 PolarHBondContact O-N 2.8Å; P27-I31 PolarHBondContact O-N 3.45Å | ||
| 28 | V | 98.4 | Very high | 97.8 | Very high | 0 Ų | 0 | 75.1 Ų | 75.1 | 0% | 0 | 38% | 0.38 | C | S | . | . | H | α-helix | trans | -48.8 | -41.9 | 177.1 | 176.2 | 0 | 0 | 0 | 0 | 112.1 | R18 S19 L24 F26 R30 I31 H32 A49 V50 A53 | R18-V28 HydrophobicContact CB-CB 4.12Å; R18-V28 HydrophobicContact CB-CG1 3.88Å; S19-V28 PolarHBondContact OG-N 3.16Å; L24-V28 HydrophobicContact CD1-CG2 3.84Å; F26-V28 PolarHBondContact O-N 2.86Å; V28-R30 PolarHBondContact O-N 2.72Å; V28-I31 PolarHBondContact O-N 3.37Å; V28-H32 WeakPolarHBondContact O-CB 3.34Å; V28-H32 PolarHBondContact O-N 3.01Å; V28-A49 HydrophobicContact CG1-CB 4.35Å; V28-V50 HydrophobicContact CG1-CG2 3.75Å; V28-A53 HydrophobicContact CG2-CB 3.83Å |
| 29 | G | 97.7 | Very high | 97.9 | Very high | 32 Ų | 32 | 78.3 Ų | 78.3 | 33% | 0.33 | 40% | 0.399 | S | S | . | . | H | α-helix | trans | -63.2 | -40.6 | 179.5 | 0 | 0 | 0 | 0 | 0 | 113.5 | P27 R33 | P27-G29 PolarHBondContact O-N 3.1Å; P27-G29 VanDerWaalsContact O-N 3.11Å; G29-R33 PolarHBondContact O-N 2.81Å |
| 30 | R | 98.3 | Very high | 97.8 | Very high | 151 Ų | 151 | 86 Ų | 86 | 57% | 0.57 | 43% | 0.427 | S | S | * | . | H | α-helix | trans | -69.9 | -45 | 177.9 | -175.4 | -177.7 | -66.3 | 166.1 | -1.3 | 110.5 | P27 V28 H32 R33 L34 | P27-R30 HydrophobicContact CB-CB 3.84Å; P27-R30 HydrophobicContact CG-CB 3.98Å; P27-R30 WeakPolarHBondContact O-CB 3.04Å; P27-R30 PolarHBondContact O-N 2.8Å; V28-R30 PolarHBondContact O-N 2.72Å; R30-H32 VanDerWaalsContact C-N 3.34Å; R30-H32 PolarHBondContact O-N 2.89Å; R30-R33 WeakPolarHBondContact O-CB 3.25Å; R30-R33 PolarHBondContact O-N 2.81Å; R30-R33 VanDerWaalsContact O-N 3.1Å; R30-L34 HydrophobicContact CG-CD1 4.3Å; R30-L34 WeakPolarHBondContact O-CG 3.35Å; R30-L34 PolarHBondContact O-N 3.45Å |
| 31 | I | 98.3 | Very high | 97.8 | Very high | 15 Ų | 15 | 83.9 Ų | 83.9 | 8% | 0.077 | 42% | 0.42 | C | S | . | . | H | α-helix | trans | -60.4 | -44.4 | 178.3 | -69.2 | 167.2 | 0 | 0 | 0 | 110.6 | F26 P27 V28 R33 L34 L35 L52 A53 L56 | F26-I31 HydrophobicContact CD2-CD1 4.41Å; P27-I31 PolarHBondContact O-N 3.45Å; V28-I31 PolarHBondContact O-N 3.37Å; I31-R33 VanDerWaalsContact C-N 3.29Å; I31-R33 PolarHBondContact O-N 3.1Å; I31-L34 PolarHBondContact O-N 3.13Å; I31-L34 VanDerWaalsContact O-N 3.15Å; I31-L35 HydrophobicContact CG2-CD1 4.18Å; I31-L35 HydrophobicContact CG2-CG 4.45Å; I31-L35 WeakPolarHBondContact O-CG 3.42Å; I31-L35 PolarHBondContact O-N 3.38Å; I31-L52 HydrophobicContact CG2-CB 4.35Å; I31-L52 HydrophobicContact CG2-CD2 3.91Å; I31-L52 HydrophobicContact CG2-CG 4.21Å; I31-A53 HydrophobicContact CD1-CB 3.47Å; I31-A53 VanDerWaalsContact CD1-CB 3.47Å; I31-L56 HydrophobicContact CD1-CD1 4.11Å |
| 32 | H | 98.3 | Very high | 97.9 | Very high | 16 Ų | 16 | 81 Ų | 81 | 7% | 0.074 | 43% | 0.433 | C | S | . | . | H | α-helix | trans | -57.5 | -41.8 | 174.5 | -167.1 | 111.7 | 0 | 0 | 0 | 112.4 | R18 V28 R30 K36 A49 | R18-H32 PolarHBondContact NH1-ND1 3.07Å; R18-H32 VanDerWaalsContact NH1-ND1 3.19Å; V28-H32 WeakPolarHBondContact O-CB 3.34Å; V28-H32 PolarHBondContact O-N 3.01Å; R30-H32 VanDerWaalsContact C-N 3.34Å; R30-H32 PolarHBondContact O-N 2.89Å; H32-K36 WeakPolarHBondContact NE2-CE 3.37Å; H32-K36 PolarHBondContact O-N 3.34Å; H32-A49 HydrophobicContact CB-CB 3.49Å; H32-A49 VanDerWaalsContact CB-CB 3.49Å |
| 33 | R | 98.3 | Very high | 97.9 | Very high | 141 Ų | 141 | 90 Ų | 90 | 53% | 0.532 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -66.1 | -41.8 | 177 | -177.1 | -179.3 | 62 | 80.3 | 0.2 | 111.6 | G29 R30 I31 K36 K37 | G29-R33 PolarHBondContact O-N 2.81Å; R30-R33 WeakPolarHBondContact O-CB 3.25Å; R30-R33 PolarHBondContact O-N 2.81Å; R30-R33 VanDerWaalsContact O-N 3.1Å; I31-R33 VanDerWaalsContact C-N 3.29Å; I31-R33 PolarHBondContact O-N 3.1Å; R33-K36 PolarHBondContact O-N 2.94Å; R33-K37 PolarHBondContact O-N 2.94Å |
| 34 | L | 98.4 | Very high | 97.9 | Very high | 89 Ų | 89 | 88.5 Ų | 88.5 | 47% | 0.466 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -63.6 | -41.9 | 176.8 | -68.7 | 174.6 | 0 | 0 | 0 | 111.7 | R30 I31 K36 K37 G38 | R30-L34 HydrophobicContact CG-CD1 4.3Å; R30-L34 WeakPolarHBondContact O-CG 3.35Å; R30-L34 PolarHBondContact O-N 3.45Å; I31-L34 PolarHBondContact O-N 3.13Å; I31-L34 VanDerWaalsContact O-N 3.15Å; L34-K36 VanDerWaalsContact C-N 3.32Å; L34-K36 PolarHBondContact O-N 3.09Å; L34-K37 PolarHBondContact O-N 2.91Å; L34-G38 PolarHBondContact O-N 3.37Å |
| 35 | L | 98.1 | Very high | 97.8 | Very high | 26 Ų | 26 | 89.3 Ų | 89.3 | 14% | 0.136 | 45% | 0.45 | C | S | . | . | H | α-helix | trans | -59.1 | -41.1 | 174.6 | -73.5 | 171.3 | 0 | 0 | 0 | 112.4 | I31 Y40 I44 A49 L52 | I31-L35 HydrophobicContact CG2-CD1 4.18Å; I31-L35 HydrophobicContact CG2-CG 4.45Å; I31-L35 WeakPolarHBondContact O-CG 3.42Å; I31-L35 PolarHBondContact O-N 3.38Å; L35-Y40 HydrophobicContact CD2-CD2 3.93Å; L35-Y40 HydrophobicContact CD2-CE2 4.12Å; L35-Y40 WeakPolarHBondContact O-CD2 3.19Å; L35-I44 HydrophobicContact CB-CD1 4.36Å; L35-I44 HydrophobicContact CB-CG1 4.22Å; L35-I44 HydrophobicContact CB-CG2 3.97Å; L35-I44 HydrophobicContact CD1-CG2 4.03Å; L35-A49 HydrophobicContact CD1-CB 4.19Å; L35-L52 HydrophobicContact CD1-CD2 4.14Å; L35-L52 HydrophobicContact CD2-CD2 3.83Å; L35-L52 HydrophobicContact CG-CD2 4.23Å |
| 36 | K | 97.7 | Very high | 97.6 | Very high | 123 Ų | 123 | 86.2 Ų | 86.2 | 54% | 0.535 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -67.6 | -42.1 | 174.8 | -75 | -175.5 | 169.1 | 178.3 | 0 | 112.7 | H32 R33 L34 G38 H39 I44 | H32-K36 WeakPolarHBondContact NE2-CE 3.37Å; H32-K36 PolarHBondContact O-N 3.34Å; R33-K36 PolarHBondContact O-N 2.94Å; L34-K36 VanDerWaalsContact C-N 3.32Å; L34-K36 PolarHBondContact O-N 3.09Å; K36-G38 VanDerWaalsContact C-N 3.28Å; K36-G38 PolarHBondContact O-N 3.11Å; K36-H39 PolarHBondContact O-N 2.88Å; K36-I44 HydrophobicContact CG-CB 4.21Å; K36-I44 HydrophobicContact CG-CG1 3.98Å |
| 37 | K | 98.1 | Very high | 97.5 | Very high | 155 Ų | 155 | 85.5 Ų | 85.5 | 67% | 0.674 | 45% | 0.452 | S | S | * | . | H | α-helix | trans | -67.6 | -29.6 | 178.9 | -172 | -178.9 | 177.1 | -173.2 | 0 | 112.2 | R33 L34 H39 | R33-K37 PolarHBondContact O-N 2.94Å; L34-K37 PolarHBondContact O-N 2.91Å; K37-H39 PolarHBondContact O-CD2 3.35Å; K37-H39 PolarHBondContact O-N 3.25Å |
| 38 | G | 97.6 | Very high | 97.5 | Very high | 34 Ų | 34 | 85.7 Ų | 85.7 | 35% | 0.351 | 46% | 0.458 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -75.3 | -4.6 | 179.5 | 0 | 0 | 0 | 0 | 0 | 114.8 | L34 K36 Y40 | L34-G38 PolarHBondContact O-N 3.37Å; K36-G38 VanDerWaalsContact C-N 3.28Å; K36-G38 PolarHBondContact O-N 3.11Å; G38-Y40 PolarHBondContact O-N 3.3Å; G38-Y40 VanDerWaalsContact O-N 3.08Å |
| 39 | H | 96.4 | Very high | 97.5 | Very high | 165 Ų | 165 | 85.7 Ų | 85.7 | 76% | 0.764 | 46% | 0.458 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 53.1 | 29.6 | 179.2 | -61 | -74.1 | 0 | 0 | 0 | 114.7 | K36 K37 A41 | K36-H39 PolarHBondContact O-N 2.88Å; K37-H39 PolarHBondContact O-CD2 3.35Å; K37-H39 PolarHBondContact O-N 3.25Å; H39-A41 PolarHBondContact O-N 2.84Å |
| 40 | Y | 97 | Very high | 97.5 | Very high | 175 Ų | 175 | 86.6 Ų | 86.6 | 69% | 0.686 | 46% | 0.457 | S | S | * | . | S | Bend | trans | -65.3 | -26.2 | -179.8 | -58.4 | -68.4 | 0 | 0 | 0 | 113.7 | L35 G38 | L35-Y40 HydrophobicContact CD2-CD2 3.93Å; L35-Y40 HydrophobicContact CD2-CE2 4.12Å; L35-Y40 WeakPolarHBondContact O-CD2 3.19Å; G38-Y40 PolarHBondContact O-N 3.3Å; G38-Y40 VanDerWaalsContact O-N 3.08Å |
| 41 | A | 97.5 | Very high | 97.6 | Very high | 58 Ų | 58 | 87.6 Ų | 87.6 | 48% | 0.479 | 46% | 0.462 | S | S | . | . | S | Bend | trans | -158.6 | 159.9 | 175.2 | 0 | 0 | 0 | 0 | 0 | 110.5 | H39 R43 I44 | H39-A41 PolarHBondContact O-N 2.84Å; A41-R43 VanDerWaalsContact C-N 3.26Å; A41-R43 PolarHBondContact O-N 2.89Å; A41-I44 HydrophobicContact CB-CD1 4.14Å |
| 42 | A | 97.1 | Very high | 97.6 | Very high | 111 Ų | 111 | 89.7 Ų | 89.7 | 92% | 0.917 | 47% | 0.473 | S | S | * | . | S | Bend | trans | -61.4 | -32.2 | 177.4 | 0 | 0 | 0 | 0 | 0 | 113.3 | ||
| 43 | R | 97.8 | Very high | 97.6 | Very high | 230 Ų | 230 | 89 Ų | 89 | 87% | 0.868 | 47% | 0.47 | S | S | * | . | trans | -135.2 | 138.5 | 176.8 | -61.8 | 179.5 | 74.2 | -153.1 | 4.2 | 109.9 | A41 | A41-R43 VanDerWaalsContact C-N 3.26Å; A41-R43 PolarHBondContact O-N 2.89Å | ||
| 44 | I | 98 | Very high | 97.6 | Very high | 32 Ų | 32 | 84 Ų | 84 | 16% | 0.164 | 46% | 0.459 | C | S | . | . | trans | -112.5 | 119.2 | 175.5 | -56.6 | -61.6 | 0 | 0 | 0 | 108.8 | L35 K36 A41 | L35-I44 HydrophobicContact CB-CD1 4.36Å; L35-I44 HydrophobicContact CB-CG1 4.22Å; L35-I44 HydrophobicContact CB-CG2 3.97Å; L35-I44 HydrophobicContact CD1-CG2 4.03Å; K36-I44 HydrophobicContact CG-CB 4.21Å; K36-I44 HydrophobicContact CG-CG1 3.98Å; A41-I44 HydrophobicContact CB-CD1 4.14Å | ||
| 45 | G | 96.9 | Very high | 97.6 | Very high | 45 Ų | 45 | 83 Ų | 83 | 46% | 0.464 | 45% | 0.453 | S | S | . | . | trans | -64.3 | 151.6 | 175 | 0 | 0 | 0 | 0 | 0 | 112.2 | A48 | G45-A48 PolarHBondContact O-N 3.44Š| ||
| 46 | T | 92.1 | Very high | 97.6 | Very high | 105 Ų | 105 | 85 Ų | 85 | 64% | 0.644 | 46% | 0.464 | S | S | * | . | H | α-helix | trans | -65 | -40 | 176.9 | 46.2 | 0 | 0 | 0 | 0 | 112.1 | A49 | T46-A49 PolarHBondContact O-N 2.9Å |
| 47 | G | 97.3 | Very high | 97.7 | Very high | 45 Ų | 45 | 81.2 Ų | 81.2 | 46% | 0.464 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -64.4 | -35 | 178.2 | 0 | 0 | 0 | 0 | 0 | 113.8 | A49 V50 Y51 | G47-A49 VanDerWaalsContact C-N 3.27Å; G47-A49 PolarHBondContact O-N 3.26Å; G47-V50 WeakPolarHBondContact O-CB 3.29Å; G47-V50 PolarHBondContact O-N 2.95Å; G47-Y51 PolarHBondContact O-N 3.13Å |
| 48 | A | 98.3 | Very high | 97.7 | Very high | 51 Ų | 51 | 80.2 Ų | 80.2 | 42% | 0.421 | 44% | 0.441 | S | S | . | . | H | α-helix | trans | -57.3 | -40.8 | 179.2 | 0 | 0 | 0 | 0 | 0 | 112.5 | G45 V50 Y51 L52 | G45-A48 PolarHBondContact O-N 3.44Å; A48-V50 VanDerWaalsContact C-N 3.35Å; A48-Y51 PolarHBondContact O-N 2.99Å; A48-L52 WeakPolarHBondContact O-CB 3.45Å; A48-L52 PolarHBondContact O-N 3.42Å |
| 49 | A | 98.2 | Very high | 97.8 | Very high | 0 Ų | 0 | 81.4 Ų | 81.4 | 0% | 0 | 44% | 0.439 | C | S | . | . | H | α-helix | trans | -71.6 | -28.3 | 178.2 | 0 | 0 | 0 | 0 | 0 | 113.5 | V28 H32 L35 T46 G47 A53 | V28-A49 HydrophobicContact CG1-CB 4.35Å; H32-A49 HydrophobicContact CB-CB 3.49Å; H32-A49 VanDerWaalsContact CB-CB 3.49Å; L35-A49 HydrophobicContact CD1-CB 4.19Å; T46-A49 PolarHBondContact O-N 2.9Å; G47-A49 VanDerWaalsContact C-N 3.27Å; G47-A49 PolarHBondContact O-N 3.26Å; A49-A53 WeakPolarHBondContact O-CB 3.42Å; A49-A53 PolarHBondContact O-N 3.39Å |
| 50 | V | 98.5 | Very high | 97.9 | Very high | 51 Ų | 51 | 76 Ų | 76 | 31% | 0.309 | 42% | 0.42 | S | S | . | . | H | α-helix | trans | -72.2 | -48.3 | 174.5 | 177.4 | 0 | 0 | 0 | 0 | 109.3 | A22 L24 V28 G47 A48 A53 A54 | A22-V50 HydrophobicContact CB-CG1 3.83Å; L24-V50 HydrophobicContact CD1-CG1 4.26Å; V28-V50 HydrophobicContact CG1-CG2 3.75Å; G47-V50 WeakPolarHBondContact O-CB 3.29Å; G47-V50 PolarHBondContact O-N 2.95Å; A48-V50 VanDerWaalsContact C-N 3.35Å; V50-A53 WeakPolarHBondContact O-CB 3.07Å; V50-A53 PolarHBondContact O-N 3.37Å; V50-A54 PolarHBondContact O-N 3.24Å |
| 51 | Y | 98.8 | Very high | 97.9 | Very high | 172 Ų | 172 | 70.3 Ų | 70.3 | 68% | 0.675 | 41% | 0.408 | S | S | * | . | H | α-helix | trans | -61 | -48.3 | -179.2 | -165.3 | -98.6 | 0 | 0 | 0 | 111.9 | G47 A48 A53 A54 I55 | G47-Y51 PolarHBondContact O-N 3.13Å; A48-Y51 PolarHBondContact O-N 2.99Å; Y51-A53 VanDerWaalsContact C-N 3.32Å; Y51-A53 PolarHBondContact O-N 3.19Å; Y51-A54 PolarHBondContact O-N 3.32Å; Y51-I55 HydrophobicContact CD1-CD1 3.59Å; Y51-I55 HydrophobicContact CD1-CG1 4.5Å; Y51-I55 HydrophobicContact CE1-CD1 3.31Å; Y51-I55 HydrophobicContact CE1-CG1 4.32Å; Y51-I55 PolarHBondContact O-N 3.16Å |
| 52 | L | 98.6 | Very high | 98 | Very high | 60 Ų | 60 | 70.6 Ų | 70.6 | 31% | 0.314 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -63.6 | -37.6 | 176.3 | -178.2 | 60.5 | 0 | 0 | 0 | 112.2 | I31 L35 A48 A54 I55 L56 | I31-L52 HydrophobicContact CG2-CB 4.35Å; I31-L52 HydrophobicContact CG2-CD2 3.91Å; I31-L52 HydrophobicContact CG2-CG 4.21Å; L35-L52 HydrophobicContact CD1-CD2 4.14Å; L35-L52 HydrophobicContact CD2-CD2 3.83Å; L35-L52 HydrophobicContact CG-CD2 4.23Å; A48-L52 WeakPolarHBondContact O-CB 3.45Å; A48-L52 PolarHBondContact O-N 3.42Å; L52-A54 VanDerWaalsContact C-N 3.33Å; L52-A54 PolarHBondContact O-N 3.4Å; L52-I55 PolarHBondContact O-N 3.28Å; L52-L56 HydrophobicContact CD1-CD1 4.25Å; L52-L56 HydrophobicContact CD1-CG 4.12Å; L52-L56 HydrophobicContact CG-CD1 4.02Å; L52-L56 HydrophobicContact CG-CG 4.33Å; L52-L56 WeakPolarHBondContact O-CB 3.32Å; L52-L56 VanDerWaalsContact O-CG 3.26Å; L52-L56 WeakPolarHBondContact O-CG 3.3Å; L52-L56 PolarHBondContact O-N 3.21Å |
| 53 | A | 98.6 | Very high | 98 | Very high | 0 Ų | 0 | 66.8 Ų | 66.8 | 0% | 0 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -62.6 | -41.7 | 176 | 0 | 0 | 0 | 0 | 0 | 112.1 | L24 F26 V28 I31 A49 V50 Y51 L56 E57 | L24-A53 HydrophobicContact CD1-CB 3.81Å; F26-A53 HydrophobicContact CB-CB 4.38Å; V28-A53 HydrophobicContact CG2-CB 3.83Å; I31-A53 HydrophobicContact CD1-CB 3.47Å; I31-A53 VanDerWaalsContact CD1-CB 3.47Å; A49-A53 WeakPolarHBondContact O-CB 3.42Å; A49-A53 PolarHBondContact O-N 3.39Å; V50-A53 WeakPolarHBondContact O-CB 3.07Å; V50-A53 PolarHBondContact O-N 3.37Å; Y51-A53 VanDerWaalsContact C-N 3.32Å; Y51-A53 PolarHBondContact O-N 3.19Å; A53-L56 PolarHBondContact O-N 2.86Å; A53-E57 WeakPolarHBondContact O-CB 3.29Å; A53-E57 PolarHBondContact O-N 2.8Å |
| 54 | A | 98.8 | Very high | 98.1 | Very high | 38 Ų | 38 | 60 Ų | 60 | 31% | 0.314 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -62.9 | -44.2 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112 | L24 V50 Y51 L52 E57 Y58 | L24-A54 HydrophobicContact CD1-CB 4.13Å; L24-A54 HydrophobicContact CD2-CB 3.89Å; V50-A54 PolarHBondContact O-N 3.24Å; Y51-A54 PolarHBondContact O-N 3.32Å; L52-A54 VanDerWaalsContact C-N 3.33Å; L52-A54 PolarHBondContact O-N 3.4Å; A54-E57 PolarHBondContact O-N 2.64Å; A54-Y58 WeakPolarHBondContact O-CB 3.34Å; A54-Y58 PolarHBondContact O-N 3.24Å |
| 55 | I | 98.6 | Very high | 98.1 | Very high | 66 Ų | 66 | 63.9 Ų | 63.9 | 34% | 0.338 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -62.7 | -45.9 | 177.2 | -69.5 | 169.2 | 0 | 0 | 0 | 111.3 | Y51 L52 E57 Y58 L59 | Y51-I55 HydrophobicContact CD1-CD1 3.59Å; Y51-I55 HydrophobicContact CD1-CG1 4.5Å; Y51-I55 HydrophobicContact CE1-CD1 3.31Å; Y51-I55 HydrophobicContact CE1-CG1 4.32Å; Y51-I55 PolarHBondContact O-N 3.16Å; L52-I55 PolarHBondContact O-N 3.28Å; I55-E57 VanDerWaalsContact C-N 3.31Å; I55-E57 PolarHBondContact O-N 3.44Å; I55-Y58 PolarHBondContact O-N 3.13Å; I55-L59 HydrophobicContact CG2-CD1 3.89Å; I55-L59 HydrophobicContact CG2-CG 4.35Å; I55-L59 WeakPolarHBondContact O-CG 3.35Å; I55-L59 PolarHBondContact O-N 3.34Å |
| 56 | L | 98.7 | Very high | 98.2 | Very high | 70 Ų | 70 | 63.9 Ų | 63.9 | 37% | 0.366 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -65.2 | -36.6 | 179.5 | -68.6 | 174.6 | 0 | 0 | 0 | 112.1 | F26 I31 L52 A53 C60 | F26-L56 HydrophobicContact CD2-CB 3.81Å; F26-L56 HydrophobicContact CE2-CB 3.73Å; I31-L56 HydrophobicContact CD1-CD1 4.11Å; L52-L56 HydrophobicContact CD1-CD1 4.25Å; L52-L56 HydrophobicContact CD1-CG 4.12Å; L52-L56 HydrophobicContact CG-CD1 4.02Å; L52-L56 HydrophobicContact CG-CG 4.33Å; L52-L56 WeakPolarHBondContact O-CB 3.32Å; L52-L56 VanDerWaalsContact O-CG 3.26Å; L52-L56 WeakPolarHBondContact O-CG 3.3Å; L52-L56 PolarHBondContact O-N 3.21Å; A53-L56 PolarHBondContact O-N 2.86Å; L56-C60 VanDerWaalsContact O-CB 3.23Å; L56-C60 WeakPolarHBondContact O-CB 3.37Å; L56-C60 PolarHBondContact O-N 2.86Å; L56-C60 VanDerWaalsContact O-N 3.09Å |
| 57 | E | 98.8 | Very high | 98.5 | Very high | 42 Ų | 42 | 58.9 Ų | 58.9 | 20% | 0.196 | 32% | 0.321 | C | S | . | . | H | α-helix | trans | -65.3 | -45.6 | 174.3 | -174.5 | 166.5 | 149.2 | 0 | 0 | 111.4 | L24 Q25 F26 A53 A54 I55 C60 A61 | L24-E57 WeakPolarHBondContact CA-OE2 3.44Å; L24-E57 WeakPolarHBondContact CB-OE2 3.29Å; Q25-E57 PolarHBondContact N-OE1 3.08Å; Q25-E57 VanDerWaalsContact N-OE1 3.15Å; Q25-E57 PolarHBondContact N-OE2 3.41Å; F26-E57 HydrophobicContact CB-CB 4.15Å; F26-E57 WeakPolarHBondContact CB-OE2 3.49Å; F26-E57 HydrophobicContact CD1-CB 3.75Å; F26-E57 HydrophobicContact CD1-CG 3.86Å; F26-E57 HydrophobicContact CD2-CB 4.45Å; F26-E57 HydrophobicContact CE1-CB 4.27Å; F26-E57 HydrophobicContact CE1-CG 4.38Å; F26-E57 HydrophobicContact CG-CB 3.86Å; F26-E57 HydrophobicContact CG-CG 4.42Å; F26-E57 PolarHBondContact N-OE2 2.93Å; A53-E57 WeakPolarHBondContact O-CB 3.29Å; A53-E57 PolarHBondContact O-N 2.8Å; A54-E57 PolarHBondContact O-N 2.64Å; I55-E57 VanDerWaalsContact C-N 3.31Å; I55-E57 PolarHBondContact O-N 3.44Å; E57-C60 PolarHBondContact O-N 3.31Å; E57-A61 WeakPolarHBondContact O-CB 3.38Å; E57-A61 PolarHBondContact O-N 2.95Å |
| 58 | Y | 98.6 | Very high | 98.6 | Very high | 135 Ų | 135 | 57.8 Ų | 57.8 | 53% | 0.529 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -59.1 | -53.3 | 176.5 | 168.2 | -115 | 0 | 0 | 0 | 112.2 | A54 I55 C60 A61 E62 | A54-Y58 WeakPolarHBondContact O-CB 3.34Å; A54-Y58 PolarHBondContact O-N 3.24Å; I55-Y58 PolarHBondContact O-N 3.13Å; Y58-C60 VanDerWaalsContact C-N 3.27Å; Y58-C60 PolarHBondContact O-N 3.3Å; Y58-A61 WeakPolarHBondContact O-CB 3.26Å; Y58-A61 PolarHBondContact O-N 2.86Å; Y58-A61 VanDerWaalsContact O-N 3.1Å; Y58-E62 PolarHBondContact O-N 3.37Å |
| 59 | L | 98.4 | Very high | 98.6 | Very high | 59 Ų | 59 | 57.6 Ų | 57.6 | 31% | 0.309 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -61.4 | -36.4 | 179.5 | -68.5 | 173 | 0 | 0 | 0 | 112.3 | I55 V63 L97 | I55-L59 HydrophobicContact CG2-CD1 3.89Å; I55-L59 HydrophobicContact CG2-CG 4.35Å; I55-L59 WeakPolarHBondContact O-CG 3.35Å; I55-L59 PolarHBondContact O-N 3.34Å; L59-V63 WeakPolarHBondContact O-CG2 3.32Å; L59-V63 PolarHBondContact O-N 3.26Å; L59-V63 VanDerWaalsContact O-N 3.14Å; L59-L97 HydrophobicContact CD2-CD2 4.27Å |
| 60 | C | 98.5 | Very high | 98.6 | Very high | 52 Ų | 52 | 58.1 Ų | 58.1 | 35% | 0.351 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -65.5 | -44.2 | 175.3 | -169.8 | 0 | 0 | 0 | 0 | 111.2 | F26 L56 E57 Y58 L64 | F26-C60 HydrophobicContact CE1-CB 4.25Å; F26-C60 HydrophobicContact CZ-CB 3.81Å; L56-C60 VanDerWaalsContact O-CB 3.23Å; L56-C60 WeakPolarHBondContact O-CB 3.37Å; L56-C60 PolarHBondContact O-N 2.86Å; L56-C60 VanDerWaalsContact O-N 3.09Å; E57-C60 PolarHBondContact O-N 3.31Å; Y58-C60 VanDerWaalsContact C-N 3.27Å; Y58-C60 PolarHBondContact O-N 3.3Å; C60-L64 VanDerWaalsContact O-CB 3.32Å; C60-L64 WeakPolarHBondContact O-CB 3.37Å; C60-L64 WeakPolarHBondContact O-CG 3.42Å; C60-L64 PolarHBondContact O-N 3.02Å |
| 61 | A | 98.5 | Very high | 98.6 | Very high | 54 Ų | 54 | 55.9 Ų | 55.9 | 45% | 0.446 | 29% | 0.293 | S | S | . | . | H | α-helix | trans | -61.6 | -44.8 | 177.1 | 0 | 0 | 0 | 0 | 0 | 111.6 | E57 Y58 L64 E65 | E57-A61 WeakPolarHBondContact O-CB 3.38Å; E57-A61 PolarHBondContact O-N 2.95Å; Y58-A61 WeakPolarHBondContact O-CB 3.26Å; Y58-A61 PolarHBondContact O-N 2.86Å; Y58-A61 VanDerWaalsContact O-N 3.1Å; A61-L64 PolarHBondContact O-N 3.43Å; A61-E65 WeakPolarHBondContact O-CB 3.34Å; A61-E65 PolarHBondContact O-N 3.21Å |
| 62 | E | 98.4 | Very high | 98.6 | Very high | 64 Ų | 64 | 55.4 Ų | 55.4 | 30% | 0.299 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -59.6 | -50.7 | 179 | -163.5 | 63.6 | -134.7 | 0 | 0 | 111.7 | Y58 L64 E65 L66 | Y58-E62 PolarHBondContact O-N 3.37Å; E62-L64 VanDerWaalsContact C-N 3.3Å; E62-L64 PolarHBondContact O-N 2.92Å; E62-E65 PolarHBondContact O-N 2.96Å; E62-L66 WeakPolarHBondContact O-CG 3.13Å; E62-L66 PolarHBondContact O-N 3.14Å; E62-L66 VanDerWaalsContact O-N 3.14Å |
| 63 | V | 98.5 | Very high | 98.5 | Very high | 31 Ų | 31 | 58.5 Ų | 58.5 | 19% | 0.188 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -61.7 | -40.3 | 177.7 | 174 | 0 | 0 | 0 | 0 | 110.9 | L59 S67 I84 L94 | L59-V63 WeakPolarHBondContact O-CG2 3.32Å; L59-V63 PolarHBondContact O-N 3.26Å; L59-V63 VanDerWaalsContact O-N 3.14Å; V63-S67 WeakPolarHBondContact O-CB 3.37Å; V63-S67 PolarHBondContact O-N 3.45Å; V63-S67 PolarHBondContact O-OG 2.94Å; V63-I84 HydrophobicContact CG1-CG2 4.12Å; V63-L94 HydrophobicContact CG2-CD1 3.97Å; V63-L94 HydrophobicContact CG2-CD2 3.89Å |
| 64 | L | 98.7 | Very high | 98.5 | Very high | 89 Ų | 89 | 62 Ų | 62 | 47% | 0.466 | 33% | 0.326 | S | S | . | . | H | α-helix | trans | -69.4 | -37.8 | 179.5 | -74.9 | 172.9 | 0 | 0 | 0 | 113 | C60 A61 E62 G68 I79 | C60-L64 VanDerWaalsContact O-CB 3.32Å; C60-L64 WeakPolarHBondContact O-CB 3.37Å; C60-L64 WeakPolarHBondContact O-CG 3.42Å; C60-L64 PolarHBondContact O-N 3.02Å; A61-L64 PolarHBondContact O-N 3.43Å; E62-L64 VanDerWaalsContact C-N 3.3Å; E62-L64 PolarHBondContact O-N 2.92Å; L64-G68 PolarHBondContact O-N 3.29Å; L64-I79 HydrophobicContact CD2-CD1 4.1Å |
| 65 | E | 98.6 | Very high | 98.4 | Very high | 113 Ų | 113 | 69.6 Ų | 69.6 | 53% | 0.528 | 35% | 0.351 | S | S | . | . | H | α-helix | trans | -61.9 | -54.6 | 177.3 | -178.9 | 60.9 | -154 | 0 | 0 | 110.2 | A61 E62 S67 G68 N69 | A61-E65 WeakPolarHBondContact O-CB 3.34Å; A61-E65 PolarHBondContact O-N 3.21Å; E62-E65 PolarHBondContact O-N 2.96Å; E65-S67 VanDerWaalsContact C-N 3.35Å; E65-S67 PolarHBondContact O-N 3.31Å; E65-G68 PolarHBondContact O-N 3.36Å; E65-G68 VanDerWaalsContact O-N 3.12Å; E65-N69 PolarHBondContact O-N 3.3Å; E65-N69 PolarHBondContact O-ND2 2.99Å |
| 66 | L | 98.6 | Very high | 98.4 | Very high | 45 Ų | 45 | 72.8 Ų | 72.8 | 24% | 0.236 | 36% | 0.363 | C | S | . | . | H | α-helix | trans | -63.7 | -39.7 | 178.8 | -62 | 179.2 | 0 | 0 | 0 | 112 | E62 G68 N69 A70 A87 D91 L94 | E62-L66 WeakPolarHBondContact O-CG 3.13Å; E62-L66 PolarHBondContact O-N 3.14Å; E62-L66 VanDerWaalsContact O-N 3.14Å; L66-G68 VanDerWaalsContact C-N 3.31Å; L66-G68 PolarHBondContact O-N 3.09Å; L66-N69 PolarHBondContact O-N 2.9Å; L66-A70 PolarHBondContact O-N 2.96Å; L66-A87 HydrophobicContact CB-CB 3.65Å; L66-D91 HydrophobicContact CD1-CB 4.01Å; L66-L94 HydrophobicContact CD1-CD1 3.73Å |
| 67 | S | 98.8 | Very high | 98.4 | Very high | 0 Ų | 0 | 75.8 Ų | 75.8 | 0% | 0 | 39% | 0.39 | C | S | . | . | H | α-helix | trans | -66 | -34.3 | 175.2 | -61.4 | 0 | 0 | 0 | 0 | 112.3 | V63 E65 A71 I84 | V63-S67 WeakPolarHBondContact O-CB 3.37Å; V63-S67 PolarHBondContact O-N 3.45Å; V63-S67 PolarHBondContact O-OG 2.94Å; E65-S67 VanDerWaalsContact C-N 3.35Å; E65-S67 PolarHBondContact O-N 3.31Å; S67-A71 WeakPolarHBondContact O-CB 3.47Å; S67-A71 PolarHBondContact O-N 3.35Å; S67-I84 WeakPolarHBondContact OG-CA 3.37Å |
| 68 | G | 98.8 | Very high | 98.4 | Very high | 21 Ų | 21 | 83.7 Ų | 83.7 | 22% | 0.216 | 42% | 0.418 | C | S | . | . | H | α-helix | trans | -65.9 | -41.6 | 174.3 | 0 | 0 | 0 | 0 | 0 | 111.7 | L64 E65 L66 A71 R72 | L64-G68 PolarHBondContact O-N 3.29Å; E65-G68 PolarHBondContact O-N 3.36Å; E65-G68 VanDerWaalsContact O-N 3.12Å; L66-G68 VanDerWaalsContact C-N 3.31Å; L66-G68 PolarHBondContact O-N 3.09Å; G68-A71 PolarHBondContact O-N 3.23Å; G68-R72 WeakPolarHBondContact O-CB 3.37Å; G68-R72 PolarHBondContact O-N 3.12Å |
| 69 | N | 98.6 | Very high | 98.4 | Very high | 48 Ų | 48 | 80.3 Ų | 80.3 | 26% | 0.257 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -62.9 | -49.6 | 173.5 | -66.2 | -25.1 | 0 | 0 | 0 | 111 | E65 L66 A71 R72 D73 | E65-N69 PolarHBondContact O-N 3.3Å; E65-N69 PolarHBondContact O-ND2 2.99Å; L66-N69 PolarHBondContact O-N 2.9Å; N69-A71 VanDerWaalsContact C-N 3.28Å; N69-A71 PolarHBondContact O-N 2.82Å; N69-R72 WeakPolarHBondContact O-CA 3.49Å; N69-R72 WeakPolarHBondContact O-CB 3.34Å; N69-R72 PolarHBondContact O-N 3.46Å; N69-R72 PolarHBondContact OD1-NH1 2.92Å; N69-D73 VanDerWaalsContact O-CG 3.27Å; N69-D73 PolarHBondContact O-N 3.14Å |
| 70 | A | 98.3 | Very high | 98.4 | Very high | 11 Ų | 11 | 79.4 Ų | 79.4 | 9% | 0.091 | 41% | 0.409 | C | S | . | . | H | α-helix | trans | -59.6 | -35.9 | 175.7 | 0 | 0 | 0 | 0 | 0 | 113.2 | L66 N74 H83 L86 | L66-A70 PolarHBondContact O-N 2.96Å; A70-N74 WeakPolarHBondContact O-CB 3.48Å; A70-N74 PolarHBondContact O-N 3.31Å; A70-N74 PolarHBondContact O-ND2 3.14Å; A70-H83 HydrophobicContact CB-CB 4.25Å; A70-L86 HydrophobicContact CB-CB 4.25Å |
| 71 | A | 98.7 | Very high | 98.4 | Very high | 3 Ų | 3 | 79.1 Ų | 79.1 | 3% | 0.025 | 41% | 0.407 | C | S | . | . | H | α-helix | trans | -65.7 | -43.6 | 173.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | S67 G68 N69 N74 K75 K76 I79 H83 | S67-A71 WeakPolarHBondContact O-CB 3.47Å; S67-A71 PolarHBondContact O-N 3.35Å; G68-A71 PolarHBondContact O-N 3.23Å; N69-A71 VanDerWaalsContact C-N 3.28Å; N69-A71 PolarHBondContact O-N 2.82Å; A71-N74 CarbonylContact O-C 3.49Å; A71-N74 PolarHBondContact O-N 2.83Å; A71-K75 PolarHBondContact O-N 3.35Å; A71-K76 CarbonylContact C-O 3.29Å; A71-K76 VanDerWaalsContact C-O 3.29Å; A71-K76 WeakPolarHBondContact O-CA 3.39Å; A71-K76 PolarHBondContact O-N 3.4Å; A71-I79 HydrophobicContact CB-CG1 4.3Å; A71-H83 HydrophobicContact CB-CB 4.34Å; A71-H83 WeakPolarHBondContact CB-ND1 3.46Å |
| 72 | R | 98.4 | Very high | 98.4 | Very high | 163 Ų | 163 | 80.1 Ų | 80.1 | 62% | 0.615 | 40% | 0.399 | S | S | * | . | H | α-helix | trans | -62.4 | -43.6 | 177.9 | -171.2 | -175.3 | -63.6 | 122 | 1.4 | 111.5 | G68 N69 N74 K75 | G68-R72 WeakPolarHBondContact O-CB 3.37Å; G68-R72 PolarHBondContact O-N 3.12Å; N69-R72 WeakPolarHBondContact O-CA 3.49Å; N69-R72 WeakPolarHBondContact O-CB 3.34Å; N69-R72 PolarHBondContact O-N 3.46Å; N69-R72 PolarHBondContact OD1-NH1 2.92Å; R72-N74 VanDerWaalsContact C-N 3.26Å; R72-N74 PolarHBondContact O-N 2.79Å; R72-K75 WeakPolarHBondContact O-CA 3.46Å; R72-K75 PolarHBondContact O-N 3.29Å |
| 73 | D | 97.4 | Very high | 98.4 | Very high | 124 Ų | 124 | 77.6 Ų | 77.6 | 66% | 0.663 | 39% | 0.387 | S | S | * | . | H | α-helix | trans | -62.5 | -36.2 | 177.8 | -63.7 | -19.7 | 0 | 0 | 0 | 111.4 | N69 K75 | N69-D73 VanDerWaalsContact O-CG 3.27Å; N69-D73 PolarHBondContact O-N 3.14Å; D73-K75 PolarHBondContact O-N 3.08Å |
| 74 | N | 97.3 | Very high | 98.4 | Very high | 75 Ų | 75 | 78.8 Ų | 78.8 | 40% | 0.401 | 39% | 0.392 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -78.3 | 9.5 | 172.1 | -69.7 | -18.9 | 0 | 0 | 0 | 114 | A70 A71 R72 K76 H83 | A70-N74 WeakPolarHBondContact O-CB 3.48Å; A70-N74 PolarHBondContact O-N 3.31Å; A70-N74 PolarHBondContact O-ND2 3.14Å; A71-N74 CarbonylContact O-C 3.49Å; A71-N74 PolarHBondContact O-N 2.83Å; R72-N74 VanDerWaalsContact C-N 3.26Å; R72-N74 PolarHBondContact O-N 2.79Å; N74-K76 HydrophobicContact CB-CG 4.39Å; N74-K76 PolarHBondContact O-N 3.46Å; N74-H83 PolarHBondContact ND2-CD2 2.95Å; N74-H83 PolarHBondContact ND2-NE2 3.36Å |
| 75 | K | 98.3 | Very high | 98.4 | Very high | 196 Ų | 196 | 75.4 Ų | 75.4 | 85% | 0.852 | 37% | 0.374 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 56.7 | 36.9 | -179.3 | -52.6 | 176.9 | -176.7 | 177.8 | 0 | 112.5 | A71 R72 D73 | A71-K75 PolarHBondContact O-N 3.35Å; R72-K75 WeakPolarHBondContact O-CA 3.46Å; R72-K75 PolarHBondContact O-N 3.29Å; D73-K75 PolarHBondContact O-N 3.08Å |
| 76 | K | 98.3 | Very high | 98.4 | Very high | 133 Ų | 133 | 71 Ų | 71 | 58% | 0.578 | 35% | 0.354 | S | S | * | . | trans | -117.3 | 145.4 | 176.3 | -58.4 | -62.2 | -179.8 | 178.7 | 0 | 110.3 | A71 N74 | A71-K76 CarbonylContact C-O 3.29Å; A71-K76 VanDerWaalsContact C-O 3.29Å; A71-K76 WeakPolarHBondContact O-CA 3.39Å; A71-K76 PolarHBondContact O-N 3.4Å; N74-K76 HydrophobicContact CB-CG 4.39Å; N74-K76 PolarHBondContact O-N 3.46Å | ||
| 77 | S | 97.6 | Very high | 98.4 | Very high | 134 Ų | 134 | 69.3 Ų | 69.3 | 94% | 0.937 | 35% | 0.346 | S | S | * | . | S | Bend | trans | -94.1 | -9.6 | 174.1 | 57 | 0 | 0 | 0 | 0 | 113.7 | ||
| 78 | R | 98.7 | Very high | 98.4 | Very high | 207 Ų | 207 | 69.3 Ų | 69.3 | 78% | 0.781 | 35% | 0.346 | S | S | * | . | S | Bend | trans | -114.6 | 128.8 | -178.5 | -176.6 | 177.4 | -65.5 | 149.6 | 1.6 | 110.4 | H83 | R78-H83 PolarHBondContact O-CE1 2.92Å; R78-H83 PolarHBondContact O-ND1 3.49Å |
| 79 | I | 98.8 | Very high | 98.4 | Very high | 65 Ų | 65 | 70.4 Ų | 70.4 | 33% | 0.333 | 34% | 0.343 | S | S | . | . | trans | -67.2 | 133.2 | 170.7 | -62.3 | 173.4 | 0 | 0 | 0 | 109 | L64 A71 H83 I84 | L64-I79 HydrophobicContact CD2-CD1 4.1Å; A71-I79 HydrophobicContact CB-CG1 4.3Å; I79-H83 HydrophobicContact CG2-CB 4.29Å; I79-I84 HydrophobicContact CG2-CD1 4.28Å; I79-I84 HydrophobicContact CG2-CG1 3.85Å | ||
| 80 | A | 98.5 | Very high | 98.3 | Very high | 40 Ų | 40 | 73.8 Ų | 73.8 | 33% | 0.331 | 36% | 0.361 | S | S | . | . | trans | -126.8 | 164.7 | 177.2 | 0 | 0 | 0 | 0 | 0 | 108.5 | R82 H83 I84 | A80-R82 PolarHBondContact O-N 3.39Å; A80-R82 VanDerWaalsContact O-N 3.11Å; A80-H83 PolarHBondContact N-ND1 3.4Å; A80-H83 VanDerWaalsContact N-ND1 3.13Å; A80-H83 WeakPolarHBondContact O-CB 3.32Å; A80-H83 PolarHBondContact O-N 2.99Å; A80-I84 PolarHBondContact O-N 3.1Å | ||
| 81 | P | 98.8 | Very high | 98.3 | Very high | 46 Ų | 46 | 75.5 Ų | 75.5 | 30% | 0.299 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -54.7 | -34.5 | -179.1 | -27.1 | 35.5 | 0 | 0 | 0 | 113.7 | H83 I84 Q85 S104 E105 | P81-H83 VanDerWaalsContact C-N 3.32Å; P81-H83 PolarHBondContact O-N 2.87Å; P81-I84 PolarHBondContact O-N 3.2Å; P81-Q85 PolarHBondContact O-N 3.07Å; P81-S104 WeakPolarHBondContact CB-O 3.45Å; P81-E105 HydrophobicContact CB-CB 3.95Å; P81-E105 HydrophobicContact CG-CB 4.12Å |
| 82 | R | 98.6 | Very high | 98.3 | Very high | 74 Ų | 74 | 83.1 Ų | 83.1 | 28% | 0.279 | 40% | 0.404 | S | S | . | . | H | α-helix | trans | -54.8 | -44.1 | 171.3 | 180 | 56.5 | 175.7 | 178.2 | 0.8 | 113 | A80 I84 Q85 L86 G106 V108 | A80-R82 PolarHBondContact O-N 3.39Å; A80-R82 VanDerWaalsContact O-N 3.11Å; R82-I84 VanDerWaalsContact C-N 3.35Å; R82-Q85 PolarHBondContact O-N 2.91Å; R82-L86 HydrophobicContact CG-CD1 4.26Å; R82-L86 HydrophobicContact CG-CG 4.48Å; R82-L86 VanDerWaalsContact O-CG 3.29Å; R82-L86 WeakPolarHBondContact O-CG 3.2Å; R82-L86 PolarHBondContact O-N 2.97Å; R82-G106 WeakPolarHBondContact CD-O 3.24Å; R82-G106 PolarHBondContact NH1-O 3.44Å; R82-V108 VanDerWaalsContact CZ-O 3.24Å; R82-V108 VanDerWaalsContact NH1-N 3.18Å; R82-V108 PolarHBondContact NH1-O 2.99Å; R82-V108 PolarHBondContact NH2-O 2.69Å |
| 83 | H | 98.8 | Very high | 98.3 | Very high | 12 Ų | 12 | 82.4 Ų | 82.4 | 6% | 0.056 | 41% | 0.408 | C | S | . | . | H | α-helix | trans | -67.9 | -37.8 | -178.7 | -55.2 | 143.7 | 0 | 0 | 0 | 111.5 | A70 A71 N74 R78 I79 A80 P81 L86 A87 | A70-H83 HydrophobicContact CB-CB 4.25Å; A71-H83 HydrophobicContact CB-CB 4.34Å; A71-H83 WeakPolarHBondContact CB-ND1 3.46Å; N74-H83 PolarHBondContact ND2-CD2 2.95Å; N74-H83 PolarHBondContact ND2-NE2 3.36Å; R78-H83 PolarHBondContact O-CE1 2.92Å; R78-H83 PolarHBondContact O-ND1 3.49Å; I79-H83 HydrophobicContact CG2-CB 4.29Å; A80-H83 PolarHBondContact N-ND1 3.4Å; A80-H83 VanDerWaalsContact N-ND1 3.13Å; A80-H83 WeakPolarHBondContact O-CB 3.32Å; A80-H83 PolarHBondContact O-N 2.99Å; P81-H83 VanDerWaalsContact C-N 3.32Å; P81-H83 PolarHBondContact O-N 2.87Å; H83-L86 PolarHBondContact O-N 2.97Å; H83-A87 WeakPolarHBondContact O-CB 3.41Å; H83-A87 PolarHBondContact O-N 3.33Å |
| 84 | I | 98.8 | Very high | 98.3 | Very high | 55 Ų | 55 | 76.9 Ų | 76.9 | 28% | 0.282 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -64.4 | -44.5 | 174.5 | -56.4 | 172.3 | 0 | 0 | 0 | 110.3 | V63 S67 I79 A80 P81 R82 A87 V88 I103 | V63-I84 HydrophobicContact CG1-CG2 4.12Å; S67-I84 WeakPolarHBondContact OG-CA 3.37Å; I79-I84 HydrophobicContact CG2-CD1 4.28Å; I79-I84 HydrophobicContact CG2-CG1 3.85Å; A80-I84 PolarHBondContact O-N 3.1Å; P81-I84 PolarHBondContact O-N 3.2Å; R82-I84 VanDerWaalsContact C-N 3.35Å; I84-A87 PolarHBondContact O-N 2.88Å; I84-V88 HydrophobicContact CG2-CG2 4.24Å; I84-V88 WeakPolarHBondContact O-CB 3.26Å; I84-V88 VanDerWaalsContact O-CG2 3.3Å; I84-V88 WeakPolarHBondContact O-CG2 3.48Å; I84-V88 PolarHBondContact O-N 3.15Å; I84-I103 HydrophobicContact CG2-CD1 3.91Å |
| 85 | Q | 98.6 | Very high | 98.3 | Very high | 18 Ų | 18 | 76.2 Ų | 76.2 | 8% | 0.084 | 38% | 0.375 | C | S | . | . | H | α-helix | trans | -62 | -44.7 | 176.6 | -179.7 | 74.1 | 3 | 0 | 0 | 112.2 | P81 R82 R89 G106 G107 | P81-Q85 PolarHBondContact O-N 3.07Å; R82-Q85 PolarHBondContact O-N 2.91Å; Q85-R89 HydrophobicContact CG-CG 4.26Å; Q85-R89 WeakPolarHBondContact O-CB 3.33Å; Q85-R89 VanDerWaalsContact O-CG 3.25Å; Q85-R89 WeakPolarHBondContact O-CG 3.23Å; Q85-R89 PolarHBondContact O-N 3.1Å; Q85-G106 WeakPolarHBondContact CB-O 3.44Å; Q85-G106 WeakPolarHBondContact CG-O 3.49Å; Q85-G107 WeakPolarHBondContact CG-O 3.44Å; Q85-G107 PolarHBondContact NE2-O 3.31Å; Q85-G107 VanDerWaalsContact NE2-O 3.16Å |
| 86 | L | 98.3 | Very high | 98.3 | Very high | 22 Ų | 22 | 72 Ų | 72 | 12% | 0.115 | 37% | 0.366 | C | S | . | . | H | α-helix | trans | -61.6 | -46.3 | 177.4 | -69.4 | 177.9 | 0 | 0 | 0 | 111.2 | A70 R82 H83 N90 L109 | A70-L86 HydrophobicContact CB-CB 4.25Å; R82-L86 HydrophobicContact CG-CD1 4.26Å; R82-L86 HydrophobicContact CG-CG 4.48Å; R82-L86 VanDerWaalsContact O-CG 3.29Å; R82-L86 WeakPolarHBondContact O-CG 3.2Å; R82-L86 PolarHBondContact O-N 2.97Å; H83-L86 PolarHBondContact O-N 2.97Å; L86-N90 VanDerWaalsContact O-CB 3.29Å; L86-N90 WeakPolarHBondContact O-CB 3.42Å; L86-N90 PolarHBondContact O-N 3.01Å; L86-N90 VanDerWaalsContact O-N 3.07Å; L86-N90 PolarHBondContact O-ND2 3.19Å; L86-N90 VanDerWaalsContact O-ND2 3.16Å; L86-L109 HydrophobicContact CD2-CD2 3.66Å |
| 87 | A | 98.3 | Very high | 98.3 | Very high | 8 Ų | 8 | 70.9 Ų | 70.9 | 7% | 0.066 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -59.6 | -51.9 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | L66 H83 I84 R89 D91 | L66-A87 HydrophobicContact CB-CB 3.65Å; H83-A87 WeakPolarHBondContact O-CB 3.41Å; H83-A87 PolarHBondContact O-N 3.33Å; I84-A87 PolarHBondContact O-N 2.88Å; A87-R89 PolarHBondContact O-N 3.26Å; A87-D91 WeakPolarHBondContact O-CB 3.37Å; A87-D91 PolarHBondContact O-N 2.92Å |
| 88 | V | 98.3 | Very high | 98.3 | Very high | 0 Ų | 0 | 66.6 Ų | 66.6 | 0% | 0 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -64.8 | -39 | -177.9 | 167.9 | 0 | 0 | 0 | 0 | 112.2 | I84 L94 N95 L98 I103 | I84-V88 HydrophobicContact CG2-CG2 4.24Å; I84-V88 WeakPolarHBondContact O-CB 3.26Å; I84-V88 VanDerWaalsContact O-CG2 3.3Å; I84-V88 WeakPolarHBondContact O-CG2 3.48Å; I84-V88 PolarHBondContact O-N 3.15Å; V88-L94 HydrophobicContact CG1-CB 4.42Å; V88-N95 WeakPolarHBondContact O-CA 3.43Å; V88-N95 WeakPolarHBondContact O-CB 3.21Å; V88-N95 PolarHBondContact O-N 3.11Å; V88-N95 VanDerWaalsContact O-N 3.13Å; V88-L98 HydrophobicContact CB-CD1 4.42Å; V88-L98 HydrophobicContact CG1-CB 3.87Å; V88-L98 HydrophobicContact CG1-CD1 3.7Å; V88-L98 HydrophobicContact CG1-CG 4.35Å; V88-L98 HydrophobicContact CG2-CD1 3.76Å; V88-I103 HydrophobicContact CB-CD1 4.36Å; V88-I103 HydrophobicContact CG2-CD1 4.25Å |
| 89 | R | 98.3 | Very high | 98.2 | Very high | 44 Ų | 44 | 59.1 Ų | 59.1 | 17% | 0.166 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -84 | -23.4 | -174.8 | -61.5 | -58.5 | 173.9 | -160.5 | -4.8 | 114 | Q85 A87 N95 L98 V101 L109 | Q85-R89 HydrophobicContact CG-CG 4.26Å; Q85-R89 WeakPolarHBondContact O-CB 3.33Å; Q85-R89 VanDerWaalsContact O-CG 3.25Å; Q85-R89 WeakPolarHBondContact O-CG 3.23Å; Q85-R89 PolarHBondContact O-N 3.1Å; A87-R89 PolarHBondContact O-N 3.26Å; R89-N95 WeakPolarHBondContact CD-OD1 3.43Å; R89-N95 PolarHBondContact NH1-OD1 3.3Å; R89-L98 PolarHBondContact NH1-O 3.45Å; R89-L98 VanDerWaalsContact NH1-O 3.1Å; R89-L98 PolarHBondContact NH2-O 2.96Å; R89-L98 VanDerWaalsContact NH2-O 3.08Å; R89-V101 PolarHBondContact NH2-O 2.92Å; R89-L109 HydrophobicContact CB-CD1 3.6Å; R89-L109 HydrophobicContact CB-CD2 4.05Å; R89-L109 HydrophobicContact CB-CG 3.66Å |
| 90 | N | 97.4 | Very high | 98.2 | Very high | 119 Ų | 119 | 61.1 Ų | 61.1 | 64% | 0.636 | 35% | 0.345 | S | S | * | . | H | α-helix | trans | -85.3 | -16 | 174.5 | -74.7 | -34.4 | 0 | 0 | 0 | 113.2 | L86 L109 | L86-N90 VanDerWaalsContact O-CB 3.29Å; L86-N90 WeakPolarHBondContact O-CB 3.42Å; L86-N90 PolarHBondContact O-N 3.01Å; L86-N90 VanDerWaalsContact O-N 3.07Å; L86-N90 PolarHBondContact O-ND2 3.19Å; L86-N90 VanDerWaalsContact O-ND2 3.16Å; N90-L109 WeakPolarHBondContact OD1-CD1 3.44Å; N90-L109 WeakPolarHBondContact OD1-CD2 3.31Å |
| 91 | D | 98.3 | Very high | 98.2 | Very high | 47 Ų | 47 | 62.5 Ų | 62.5 | 25% | 0.251 | 35% | 0.35 | S | S | . | . | S | Bend | trans | -95.9 | 127.3 | 175.4 | -178.9 | -97 | 0 | 0 | 0 | 111.2 | L66 A87 E93 L94 N95 | L66-D91 HydrophobicContact CD1-CB 4.01Å; A87-D91 WeakPolarHBondContact O-CB 3.37Å; A87-D91 PolarHBondContact O-N 2.92Å; D91-E93 PolarHBondContact OD1-N 3.46Å; D91-L94 HydrophobicContact CB-CB 4.13Å; D91-L94 HydrophobicContact CB-CD1 4.19Å; D91-L94 HydrophobicContact CB-CG 4.36Å; D91-L94 WeakPolarHBondContact OD1-CB 3.42Å; D91-L94 VanDerWaalsContact OD1-CG 3.26Å; D91-L94 WeakPolarHBondContact OD1-CG 3.39Å; D91-L94 PolarHBondContact OD1-N 2.96Å; D91-N95 WeakPolarHBondContact O-CB 3.49Å; D91-N95 PolarHBondContact O-N 3.48Å |
| 92 | E | 97.9 | Very high | 98.2 | Very high | 163 Ų | 163 | 66.3 Ų | 66.3 | 76% | 0.762 | 37% | 0.372 | S | S | * | . | H | α-helix | trans | -65.6 | -43.1 | -173.5 | -174.3 | 179.3 | 176.2 | 0 | 0 | 112.5 | T96 | E92-T96 WeakPolarHBondContact O-CB 3.47Å; E92-T96 PolarHBondContact O-N 3.02Å; E92-T96 PolarHBondContact O-OG1 3.5Å |
| 93 | E | 98.2 | Very high | 98.1 | Very high | 149 Ų | 149 | 64.4 Ų | 64.4 | 70% | 0.696 | 37% | 0.367 | S | S | * | . | H | α-helix | trans | -71.1 | -45.6 | -176 | -60.8 | -169.2 | 146.9 | 0 | 0 | 110.9 | D91 T96 L97 | D91-E93 PolarHBondContact OD1-N 3.46Å; E93-T96 PolarHBondContact O-N 3.2Å; E93-L97 WeakPolarHBondContact O-CB 3.49Å; E93-L97 PolarHBondContact O-N 2.98Å |
| 94 | L | 98.2 | Very high | 98.1 | Very high | 7 Ų | 7 | 68.4 Ų | 68.4 | 4% | 0.037 | 40% | 0.396 | C | S | . | . | H | α-helix | trans | -68.1 | -38.5 | 176.1 | -67.7 | 178.3 | 0 | 0 | 0 | 112 | V63 L66 V88 D91 T96 L97 L98 | V63-L94 HydrophobicContact CG2-CD1 3.97Å; V63-L94 HydrophobicContact CG2-CD2 3.89Å; L66-L94 HydrophobicContact CD1-CD1 3.73Å; V88-L94 HydrophobicContact CG1-CB 4.42Å; D91-L94 HydrophobicContact CB-CB 4.13Å; D91-L94 HydrophobicContact CB-CD1 4.19Å; D91-L94 HydrophobicContact CB-CG 4.36Å; D91-L94 WeakPolarHBondContact OD1-CB 3.42Å; D91-L94 VanDerWaalsContact OD1-CG 3.26Å; D91-L94 WeakPolarHBondContact OD1-CG 3.39Å; D91-L94 PolarHBondContact OD1-N 2.96Å; L94-T96 VanDerWaalsContact C-N 3.28Å; L94-T96 PolarHBondContact O-N 3.48Å; L94-L97 PolarHBondContact O-N 3.23Å; L94-L98 VanDerWaalsContact O-CB 3.29Å; L94-L98 WeakPolarHBondContact O-CB 3.43Å; L94-L98 PolarHBondContact O-N 3.21Å |
| 95 | N | 97.9 | Very high | 98.1 | Very high | 61 Ų | 61 | 73.7 Ų | 73.7 | 33% | 0.326 | 42% | 0.42 | S | S | . | . | H | α-helix | trans | -63.8 | -38.3 | 176.2 | -175 | 47.3 | 0 | 0 | 0 | 110.9 | V88 R89 D91 L98 G99 | V88-N95 WeakPolarHBondContact O-CA 3.43Å; V88-N95 WeakPolarHBondContact O-CB 3.21Å; V88-N95 PolarHBondContact O-N 3.11Å; V88-N95 VanDerWaalsContact O-N 3.13Å; R89-N95 WeakPolarHBondContact CD-OD1 3.43Å; R89-N95 PolarHBondContact NH1-OD1 3.3Å; D91-N95 WeakPolarHBondContact O-CB 3.49Å; D91-N95 PolarHBondContact O-N 3.48Å; N95-L98 CarbonylContact O-C 3.49Å; N95-G99 WeakPolarHBondContact O-CA 3.48Å; N95-G99 PolarHBondContact O-N 3.4Å |
| 96 | T | 98.3 | Very high | 98.1 | Very high | 108 Ų | 108 | 72.9 Ų | 72.9 | 66% | 0.663 | 42% | 0.416 | S | S | * | . | H | α-helix | trans | -66.5 | -50 | 174.2 | -60.4 | 0 | 0 | 0 | 0 | 110.9 | E92 E93 L94 L98 G99 | E92-T96 WeakPolarHBondContact O-CB 3.47Å; E92-T96 PolarHBondContact O-N 3.02Å; E92-T96 PolarHBondContact O-OG1 3.5Å; E93-T96 PolarHBondContact O-N 3.2Å; L94-T96 VanDerWaalsContact C-N 3.28Å; L94-T96 PolarHBondContact O-N 3.48Å; T96-L98 VanDerWaalsContact C-N 3.26Å; T96-L98 PolarHBondContact O-N 3.26Å; T96-G99 PolarHBondContact O-N 2.76Å |
| 97 | L | 98 | Very high | 98.1 | Very high | 109 Ų | 109 | 74.2 Ų | 74.2 | 57% | 0.571 | 44% | 0.435 | S | S | * | . | H | α-helix | trans | -59.9 | -36.2 | 179.5 | -178.9 | 61.6 | 0 | 0 | 0 | 112.4 | L59 E93 L94 | L59-L97 HydrophobicContact CD2-CD2 4.27Å; E93-L97 WeakPolarHBondContact O-CB 3.49Å; E93-L97 PolarHBondContact O-N 2.98Å; L94-L97 PolarHBondContact O-N 3.23Å |
| 98 | L | 97.9 | Very high | 98 | Very high | 45 Ų | 45 | 79.2 Ų | 79.2 | 24% | 0.236 | 47% | 0.465 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -111.5 | 25.1 | -175.4 | -57.3 | 177.4 | 0 | 0 | 0 | 112.7 | V88 R89 L94 N95 T96 A100 V101 | V88-L98 HydrophobicContact CB-CD1 4.42Å; V88-L98 HydrophobicContact CG1-CB 3.87Å; V88-L98 HydrophobicContact CG1-CD1 3.7Å; V88-L98 HydrophobicContact CG1-CG 4.35Å; V88-L98 HydrophobicContact CG2-CD1 3.76Å; R89-L98 PolarHBondContact NH1-O 3.45Å; R89-L98 VanDerWaalsContact NH1-O 3.1Å; R89-L98 PolarHBondContact NH2-O 2.96Å; R89-L98 VanDerWaalsContact NH2-O 3.08Å; L94-L98 VanDerWaalsContact O-CB 3.29Å; L94-L98 WeakPolarHBondContact O-CB 3.43Å; L94-L98 PolarHBondContact O-N 3.21Å; N95-L98 CarbonylContact O-C 3.49Å; T96-L98 VanDerWaalsContact C-N 3.26Å; T96-L98 PolarHBondContact O-N 3.26Å; L98-A100 VanDerWaalsContact C-N 3.28Å; L98-A100 PolarHBondContact O-N 2.81Å; L98-V101 HydrophobicContact CB-CB 4.21Å; L98-V101 HydrophobicContact CB-CG2 4.35Å; L98-V101 HydrophobicContact CD2-CB 4.45Å; L98-V101 HydrophobicContact CD2-CG2 3.96Å; L98-V101 PolarHBondContact O-N 3.15Å; L98-V101 VanDerWaalsContact O-N 3.09Å |
| 99 | G | 96.9 | Very high | 97.9 | Very high | 50 Ų | 50 | 81.9 Ų | 81.9 | 52% | 0.515 | 48% | 0.479 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -57.7 | -39.1 | -175.5 | 0 | 0 | 0 | 0 | 0 | 113.4 | N95 T96 | N95-G99 WeakPolarHBondContact O-CA 3.48Å; N95-G99 PolarHBondContact O-N 3.4Å; T96-G99 PolarHBondContact O-N 2.76Å |
| 100 | A | 97.9 | Very high | 97.8 | Very high | 106 Ų | 106 | 84.2 Ų | 84.2 | 88% | 0.876 | 50% | 0.5 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -95.2 | 6.1 | 179.9 | 0 | 0 | 0 | 0 | 0 | 114.3 | L98 | L98-A100 VanDerWaalsContact C-N 3.28Å; L98-A100 PolarHBondContact O-N 2.81Å |
| 101 | V | 98.3 | Very high | 97.6 | Very high | 70 Ų | 70 | 83.8 Ų | 83.8 | 42% | 0.424 | 50% | 0.497 | S | S | . | . | trans | -95.2 | 128.6 | -177 | 177.6 | 0 | 0 | 0 | 0 | 110.4 | R89 L98 | R89-V101 PolarHBondContact NH2-O 2.92Å; L98-V101 HydrophobicContact CB-CB 4.21Å; L98-V101 HydrophobicContact CB-CG2 4.35Å; L98-V101 HydrophobicContact CD2-CB 4.45Å; L98-V101 HydrophobicContact CD2-CG2 3.96Å; L98-V101 PolarHBondContact O-N 3.15Å; L98-V101 VanDerWaalsContact O-N 3.09Å | ||
| 102 | T | 98.4 | Very high | 97.5 | Very high | 126 Ų | 126 | 85.9 Ų | 85.9 | 77% | 0.773 | 51% | 0.507 | S | S | * | . | trans | -91.1 | 124.4 | 170 | -55 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 103 | I | 98.1 | Very high | 97.3 | Very high | 34 Ų | 34 | 83.8 Ų | 83.8 | 17% | 0.174 | 50% | 0.498 | C | S | . | . | trans | -95.1 | 108.2 | 173.1 | -52.5 | -173.6 | 0 | 0 | 0 | 108.1 | I84 V88 E105 G106 | I84-I103 HydrophobicContact CG2-CD1 3.91Å; V88-I103 HydrophobicContact CB-CD1 4.36Å; V88-I103 HydrophobicContact CG2-CD1 4.25Å; I103-E105 PolarHBondContact O-N 3.19Å; I103-G106 PolarHBondContact O-N 3.48Å; I103-G106 VanDerWaalsContact O-N 3.1Å | ||
| 104 | S | 98.4 | Very high | 97.1 | Very high | 95 Ų | 95 | 80.4 Ų | 80.4 | 66% | 0.664 | 50% | 0.496 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -54.4 | 136.3 | 176.2 | -59.3 | 0 | 0 | 0 | 0 | 110.8 | P81 G106 | P81-S104 WeakPolarHBondContact CB-O 3.45Å; S104-G106 PolarHBondContact O-N 2.99Å; S104-G106 VanDerWaalsContact O-N 3.13Å |
| 105 | E | 98.4 | Very high | 97 | Very high | 167 Ų | 167 | 88.6 Ų | 88.6 | 78% | 0.78 | 54% | 0.536 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 61 | 14.2 | -178.2 | -50.9 | -176.4 | 147.5 | 0 | 0 | 115.1 | P81 I103 | P81-E105 HydrophobicContact CB-CB 3.95Å; P81-E105 HydrophobicContact CG-CB 4.12Å; I103-E105 PolarHBondContact O-N 3.19Å |
| 106 | G | 97.8 | Very high | 96.8 | Very high | 1 Ų | 1 | 92.1 Ų | 92.1 | 1% | 0.01 | 55% | 0.554 | C | S | . | * | trans | -77.9 | -28.6 | 179.9 | 0 | 0 | 0 | 0 | 0 | 115 | R82 Q85 I103 S104 | R82-G106 WeakPolarHBondContact CD-O 3.24Å; R82-G106 PolarHBondContact NH1-O 3.44Å; Q85-G106 WeakPolarHBondContact CB-O 3.44Å; Q85-G106 WeakPolarHBondContact CG-O 3.49Å; I103-G106 PolarHBondContact O-N 3.48Å; I103-G106 VanDerWaalsContact O-N 3.1Å; S104-G106 PolarHBondContact O-N 2.99Å; S104-G106 VanDerWaalsContact O-N 3.13Å | ||
| 107 | G | 97.8 | Very high | 96.5 | Very high | 50 Ų | 50 | 90.8 Ų | 90.8 | 52% | 0.515 | 54% | 0.542 | S | S | . | . | trans | 63.6 | -155.4 | -168.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | Q85 | Q85-G107 WeakPolarHBondContact CG-O 3.44Å; Q85-G107 PolarHBondContact NE2-O 3.31Å; Q85-G107 VanDerWaalsContact NE2-O 3.16Å | ||
| 108 | V | 97.6 | Very high | 96.3 | Very high | 113 Ų | 113 | 91.1 Ų | 91.1 | 69% | 0.685 | 55% | 0.551 | S | S | * | * | trans | -127 | 159.4 | -180 | -62.4 | 0 | 0 | 0 | 0 | 111.8 | R82 | R82-V108 VanDerWaalsContact CZ-O 3.24Å; R82-V108 VanDerWaalsContact NH1-N 3.18Å; R82-V108 PolarHBondContact NH1-O 2.99Å; R82-V108 PolarHBondContact NH2-O 2.69Å | ||
| 109 | L | 96.1 | Very high | 95.6 | Very high | 56 Ų | 56 | 98.4 Ų | 98.4 | 29% | 0.293 | 58% | 0.581 | S | S | . | * | trans | -59.1 | 133.6 | 169.8 | -70.5 | -179.7 | 0 | 0 | 0 | 109.2 | L86 R89 N90 N111 | L86-L109 HydrophobicContact CD2-CD2 3.66Å; R89-L109 HydrophobicContact CB-CD1 3.6Å; R89-L109 HydrophobicContact CB-CD2 4.05Å; R89-L109 HydrophobicContact CB-CG 3.66Å; N90-L109 WeakPolarHBondContact OD1-CD1 3.44Å; N90-L109 WeakPolarHBondContact OD1-CD2 3.31Å; L109-N111 PolarHBondContact O-N 3.36Å | ||
| 110 | P | 94.9 | Very high | 94.7 | Very high | 93 Ų | 93 | 105.9 Ų | 105.9 | 60% | 0.604 | 60% | 0.599 | S | S | * | * | trans | -59.2 | 120.2 | 170.6 | -18.9 | 32.7 | 0 | 0 | 0 | 108.8 | ||||
| 111 | N | 94.3 | Very high | 93 | Very high | 110 Ų | 110 | 106.9 Ų | 106.9 | 59% | 0.588 | 60% | 0.595 | S | S | * | * | trans | -154.6 | 126.4 | 175.2 | -179.2 | 18.7 | 0 | 0 | 0 | 108.6 | L109 | L109-N111 PolarHBondContact O-N 3.36Š| ||
| 112 | I | 95.6 | Very high | 91.2 | Very high | 90 Ų | 90 | 113.6 Ų | 113.6 | 46% | 0.462 | 62% | 0.618 | S | S | . | * | trans | -119.1 | 118.9 | 175.3 | -58.8 | 176.7 | 0 | 0 | 0 | 107.4 | A114 L116 L117 | I112-A114 PolarHBondContact O-N 3.05Å; I112-L116 HydrophobicContact CG2-CB 3.93Å; I112-L117 HydrophobicContact CB-CD2 4.39Å; I112-L117 HydrophobicContact CG2-CD2 3.9Å; I112-L117 HydrophobicContact CG2-CG 4.43Å | ||
| 113 | Q | 95.2 | Very high | 89.3 | Confident | 119 Ų | 119 | 115 Ų | 115 | 56% | 0.556 | 62% | 0.62 | S | S | * | * | trans | -57 | 132.7 | 176 | -64.9 | -63.9 | -32.4 | 0 | 0 | 110.1 | M115 L116 | Q113-M115 PolarHBondContact O-N 2.99Å; Q113-L116 HydrophobicContact CB-CD1 4.22Å; Q113-L116 HydrophobicContact CB-CG 4.29Å; Q113-L116 WeakPolarHBondContact O-CB 3.31Å; Q113-L116 PolarHBondContact O-N 3.25Å | ||
| 114 | A | 93.8 | Very high | 86.9 | Confident | 79 Ų | 79 | 119.1 Ų | 119.1 | 65% | 0.653 | 65% | 0.649 | S | S | * | * | G | 310 helix | trans | -54.3 | -30.6 | -172.4 | 0 | 0 | 0 | 0 | 0 | 114 | I112 L116 L117 | I112-A114 PolarHBondContact O-N 3.05Å; A114-L116 PolarHBondContact O-N 3.49Å; A114-L117 WeakPolarHBondContact O-CB 3.48Å; A114-L117 PolarHBondContact O-N 3.01Å |
| 115 | M | 94.9 | Very high | 84.4 | Confident | 179 Ų | 179 | 123.7 Ų | 123.7 | 88% | 0.882 | 66% | 0.657 | S | S | * | * | G | 310 helix | trans | -65.1 | -21.9 | 176.6 | -63 | -167.3 | -64.4 | 0 | 0 | 114.1 | Q113 | Q113-M115 PolarHBondContact O-N 2.99Š|
| 116 | L | 94.5 | Very high | 81.9 | Confident | 134 Ų | 134 | 123.2 Ų | 123.2 | 70% | 0.702 | 66% | 0.66 | S | S | * | * | G | 310 helix | trans | -88 | -9.2 | 179 | -56.9 | 178 | 0 | 0 | 0 | 112.4 | I112 Q113 A114 | I112-L116 HydrophobicContact CG2-CB 3.93Å; Q113-L116 HydrophobicContact CB-CD1 4.22Å; Q113-L116 HydrophobicContact CB-CG 4.29Å; Q113-L116 WeakPolarHBondContact O-CB 3.31Å; Q113-L116 PolarHBondContact O-N 3.25Å; A114-L116 PolarHBondContact O-N 3.49Å |
| 117 | L | 92.4 | Very high | 79.5 | Confident | 81 Ų | 81 | 130.7 Ų | 130.7 | 42% | 0.424 | 70% | 0.699 | S | S | . | * | S | Bend | trans | -72.4 | 142.7 | 178.4 | -64.1 | 175.4 | 0 | 0 | 0 | 110.3 | I112 A114 K119 | I112-L117 HydrophobicContact CB-CD2 4.39Å; I112-L117 HydrophobicContact CG2-CD2 3.9Å; I112-L117 HydrophobicContact CG2-CG 4.43Å; A114-L117 WeakPolarHBondContact O-CB 3.48Å; A114-L117 PolarHBondContact O-N 3.01Å; L117-K119 PolarHBondContact O-N 3.35Å |
| 118 | P | 92.2 | Very high | 77.3 | Confident | 116 Ų | 116 | 131 Ų | 131 | 75% | 0.753 | 70% | 0.703 | S | S | * | * | P | Polyproline II helix | trans | -54.3 | 133.2 | 172.6 | -23.1 | 32.5 | 0 | 0 | 0 | 110.4 | K120 | P118-K120 PolarHBondContact O-N 3.37Å; P118-K120 VanDerWaalsContact O-N 3.16Å |
| 119 | K | 84.8 | Confident | 74.7 | Confident | 198 Ų | 198 | 131.3 Ų | 131.3 | 86% | 0.861 | 71% | 0.71 | S | S | * | * | P | Polyproline II helix | trans | -59.5 | 123.7 | 170.3 | -69.7 | -175.7 | 179.2 | 180 | 0 | 107.5 | L117 T121 | L117-K119 PolarHBondContact O-N 3.35Å; K119-T121 VanDerWaalsContact C-N 3.32Å; K119-T121 PolarHBondContact O-N 3.03Å |
| 120 | K | 76.9 | Confident | 72.4 | Confident | 206 Ų | 206 | 136.9 Ų | 136.9 | 90% | 0.896 | 74% | 0.74 | S | S | * | * | trans | -60 | 94.8 | 172.9 | -71.8 | -173.7 | 179.2 | -177.7 | 0 | 108.8 | P118 K122 | P118-K120 PolarHBondContact O-N 3.37Å; P118-K120 VanDerWaalsContact O-N 3.16Å; K120-K122 PolarHBondContact O-N 3.33Å | ||
| 121 | T | 63.4 | Low | 69.8 | Low | 128 Ų | 128 | 136.7 Ų | 136.7 | 79% | 0.785 | 75% | 0.746 | S | S | * | * | trans | -70.6 | 120.5 | 161 | 14.2 | 0 | 0 | 0 | 0 | 106.5 | K119 L123 | K119-T121 VanDerWaalsContact C-N 3.32Å; K119-T121 PolarHBondContact O-N 3.03Å; T121-L123 PolarHBondContact O-N 3.05Å | ||
| 122 | K | 60.1 | Low | 67.3 | Low | 210 Ų | 210 | 138.6 Ų | 138.6 | 91% | 0.913 | 76% | 0.757 | S | S | * | * | trans | -57.7 | 108.3 | 172.8 | -75.3 | 179.9 | 176.7 | 178.4 | 0 | 107.6 | K120 | K120-K122 PolarHBondContact O-N 3.33Š| ||
| 123 | L | 58.3 | Low | 64.7 | Low | 156 Ų | 156 | 142 Ų | 142 | 82% | 0.817 | 78% | 0.775 | S | S | * | * | trans | -59.9 | 141.2 | 164.1 | -78.8 | 155.8 | 0 | 0 | 0 | 107.6 | T121 K125 | T121-L123 PolarHBondContact O-N 3.05Å; L123-K125 PolarHBondContact O-N 3.33Å | ||
| 124 | P | 48.6 | Very low | 62.3 | Low | 120 Ų | 120 | 142.5 Ų | 142.5 | 78% | 0.779 | 79% | 0.787 | S | S | * | * | trans | -54.6 | 130.5 | 173.8 | -18.6 | 30 | 0 | 0 | 0 | 108.8 | D126 | P124-D126 PolarHBondContact O-N 3.09Å; P124-D126 VanDerWaalsContact O-N 3.13Å | ||
| 125 | K | 45.4 | Very low | 59.6 | Low | 192 Ų | 192 | 147 Ų | 147 | 84% | 0.835 | 79% | 0.794 | S | S | * | * | trans | -61.4 | 114.7 | 171.2 | -85.2 | -179.3 | 164 | -175.6 | 0 | 107.7 | L123 | L123-K125 PolarHBondContact O-N 3.33Š| ||
| 126 | D | 45.2 | Very low | 57.2 | Low | 157 Ų | 157 | 143 Ų | 143 | 84% | 0.84 | 78% | 0.784 | S | S | * | * | trans | -91.5 | 115.4 | 161.8 | -157 | 14 | 0 | 0 | 0 | 107 | P124 G128 | P124-D126 PolarHBondContact O-N 3.09Å; P124-D126 VanDerWaalsContact O-N 3.13Å; D126-G128 PolarHBondContact O-N 3.07Å | ||
| 127 | D | 48.8 | Very low | 54.5 | Low | 158 Ų | 158 | 144.7 Ų | 144.7 | 85% | 0.845 | 79% | 0.788 | S | S | * | * | S | Bend | trans | -76 | 65 | -173.9 | -85.7 | -23.5 | 0 | 0 | 0 | 111.3 | ||
| 128 | G | 50.3 | Low | 52 | Low | 57 Ų | 57 | 150 Ų | 150 | 59% | 0.588 | 81% | 0.811 | S | S | * | * | trans | 168.8 | 88.8 | 171.6 | 0 | 0 | 0 | 0 | 0 | 115.5 | D126 | D126-G128 PolarHBondContact O-N 3.07Š| ||
| 129 | S | 42.4 | Very low | 49.9 | Very low | 119 Ų | 119 | 154.1 Ų | 154.1 | 83% | 0.832 | 82% | 0.817 | S | S | * | * | trans | 166 | 141.5 | 132.2 | 46.1 | 0 | 0 | 0 | 0 | 111.1 | A131 | S129-A131 PolarHBondContact O-N 2.88Š| ||
| 130 | N | 48.4 | Very low | 48.2 | Very low | 172 Ų | 172 | 152 Ų | 152 | 92% | 0.92 | 82% | 0.815 | S | S | * | * | trans | -51.2 | 95.1 | 175.5 | -78.5 | -28.7 | 0 | 0 | 0 | 112 | ||||
| 131 | A | 41.7 | Very low | 46.6 | Very low | 90 Ų | 90 | 149.1 Ų | 149.1 | 74% | 0.744 | 81% | 0.811 | S | S | * | * | trans | -93.9 | 109.5 | 161.1 | 0 | 0 | 0 | 0 | 0 | 107.3 | S129 D133 | S129-A131 PolarHBondContact O-N 2.88Å; A131-D133 PolarHBondContact O-N 3.41Å; A131-D133 VanDerWaalsContact O-N 3.15Å | ||
| 132 | N | 41.7 | Very low | 45.7 | Very low | 150 Ų | 150 | 150.3 Ų | 150.3 | 80% | 0.802 | 81% | 0.812 | S | S | * | * | trans | -48 | 123 | 165.3 | -74.6 | -45.1 | 0 | 0 | 0 | 108 | V134 | N132-V134 PolarHBondContact O-N 3.36Š| ||
| 133 | D | 40.2 | Very low | 44.9 | Very low | 160 Ų | 160 | 146.8 Ų | 146.8 | 86% | 0.856 | 81% | 0.806 | S | S | * | * | trans | -55.1 | 92.8 | 167.4 | -104.2 | -30.7 | 0 | 0 | 0 | 107.3 | A131 Q135 | A131-D133 PolarHBondContact O-N 3.41Å; A131-D133 VanDerWaalsContact O-N 3.15Å; D133-Q135 PolarHBondContact O-N 3.02Å | ||
| 134 | V | 44 | Very low | 44 | Very low | 131 Ų | 131 | 146.2 Ų | 146.2 | 79% | 0.794 | 81% | 0.806 | S | S | * | * | trans | -70.2 | 90.7 | 160.3 | -173.4 | 0 | 0 | 0 | 0 | 103 | N132 S136 | N132-V134 PolarHBondContact O-N 3.36Å; V134-S136 VanDerWaalsContact C-N 3.34Å; V134-S136 PolarHBondContact O-N 2.65Å | ||
| 135 | Q | 38.8 | Very low | 43.7 | Very low | 172 Ų | 172 | 147.9 Ų | 147.9 | 80% | 0.804 | 81% | 0.808 | S | S | * | * | trans | -40.2 | 108.2 | 165.4 | -93.7 | 174.2 | -31.9 | 0 | 0 | 106.2 | D133 Q137 | D133-Q135 PolarHBondContact O-N 3.02Å; Q135-Q137 VanDerWaalsContact C-N 3.3Å; Q135-Q137 PolarHBondContact O-N 3.12Å | ||
| 136 | S | 44.1 | Very low | 43.6 | Very low | 97 Ų | 97 | 144.8 Ų | 144.8 | 68% | 0.678 | 81% | 0.806 | S | S | * | * | trans | -50.4 | 107.3 | 165.4 | 42.9 | 0 | 0 | 0 | 0 | 104.8 | V134 E138 | V134-S136 VanDerWaalsContact C-N 3.34Å; V134-S136 PolarHBondContact O-N 2.65Å; S136-E138 PolarHBondContact O-N 3.46Å | ||
| 137 | Q | 38.3 | Very low | 43.5 | Very low | 169 Ų | 169 | 143.8 Ų | 143.8 | 79% | 0.79 | 80% | 0.803 | S | S | * | * | trans | -51.4 | 115.8 | 166.4 | -73.6 | -173.4 | -22.1 | 0 | 0 | 104.8 | Q135 F139 | Q135-Q137 VanDerWaalsContact C-N 3.3Å; Q135-Q137 PolarHBondContact O-N 3.12Å; Q137-F139 PolarHBondContact O-N 2.74Å | ||
| 138 | E | 37.9 | Very low | 43 | Very low | 191 Ų | 191 | 142.7 Ų | 142.7 | 89% | 0.893 | 80% | 0.8 | S | S | * | * | trans | -52.5 | 116.5 | 168.2 | -66.5 | -176.5 | 151.9 | 0 | 0 | 105.3 | S136 | S136-E138 PolarHBondContact O-N 3.46Š| ||
| 139 | F | 48.9 | Very low | 42.4 | Very low | 204 Ų | 204 | 150.5 Ų | 150.5 | 90% | 0.895 | 82% | 0.819 | S | S | * | * | trans | -71.8 | 0 | 177.1 | -72.4 | -82.2 | 0 | 0 | 0 | 109.5 | Q137 | Q137-F139 PolarHBondContact O-N 2.74Š|
Retrieved 139 of 139 residues in 47.1 ms
(Link to these results)