| 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 | 43 | Very low | 53.6 | Low | 233 Ų | 233 | 159.5 Ų | 159.5 | 100% | 1.148 | 83% | 0.826 | S | S | * | * | 0 | 134.4 | 0 | -74.4 | -178 | 175.2 | 0 | 0 | 106.9 | |||||
| 2 | F | 51 | Low | 54 | Low | 217 Ų | 217 | 162.3 Ų | 162.3 | 95% | 0.952 | 83% | 0.828 | S | S | * | * | trans | 84.2 | 85.5 | -165.2 | -54.1 | -71.3 | 0 | 0 | 0 | 114.6 | ||||
| 3 | A | 49.7 | Very low | 54.7 | Low | 86 Ų | 86 | 156.3 Ų | 156.3 | 71% | 0.711 | 81% | 0.809 | S | S | * | * | trans | -91.7 | 130.8 | 171.2 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 4 | D | 48.2 | Very low | 54.8 | Low | 151 Ų | 151 | 156.9 Ų | 156.9 | 81% | 0.807 | 81% | 0.806 | S | S | * | * | trans | 35 | 112.9 | 132.3 | -49.7 | -37.3 | 0 | 0 | 0 | 119.5 | ||||
| 5 | N | 56.2 | Low | 54.5 | Low | 173 Ų | 173 | 154.7 Ų | 154.7 | 93% | 0.925 | 81% | 0.806 | S | S | * | * | trans | -140.6 | 87.5 | 150.5 | -94.7 | -47.2 | 0 | 0 | 0 | 108.4 | ||||
| 6 | F | 50 | Low | 54.5 | Low | 190 Ų | 190 | 151.3 Ų | 151.3 | 83% | 0.833 | 81% | 0.807 | S | S | * | * | trans | -84.3 | 108.4 | 170 | -146.5 | -93.9 | 0 | 0 | 0 | 106.9 | E8 | F6-E8 PolarHBondContact O-N 3.27Š| ||
| 7 | A | 60.2 | Low | 54.5 | Low | 86 Ų | 86 | 147.6 Ų | 147.6 | 71% | 0.711 | 80% | 0.803 | S | S | * | * | trans | -69.1 | 115.3 | 175.9 | 0 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 8 | E | 55 | Low | 54 | Low | 188 Ų | 188 | 149.3 Ų | 149.3 | 88% | 0.879 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -56.2 | 131.1 | 173.7 | -75.8 | 171.8 | 138.8 | 0 | 0 | 111.1 | F6 | F6-E8 PolarHBondContact O-N 3.27Š|
| 9 | Y | 59.4 | Low | 54.1 | Low | 210 Ų | 210 | 149.5 Ų | 149.5 | 82% | 0.824 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -76.4 | 135.2 | 167.7 | -76.6 | -89 | 0 | 0 | 0 | 109.2 | D11 | Y9-D11 PolarHBondContact O-N 3.1Š|
| 10 | P | 59.8 | Low | 54 | Low | 99 Ų | 99 | 147.2 Ų | 147.2 | 64% | 0.643 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -67.9 | 130.6 | 177.3 | 27.6 | -32.3 | 0 | 0 | 0 | 110.6 | F12 | P10-F12 VanDerWaalsContact O-CD2 3.32Å; P10-F12 WeakPolarHBondContact O-CD2 3.17Å; P10-F12 WeakPolarHBondContact O-CE2 3.5Å |
| 11 | D | 56.8 | Low | 53.5 | Low | 122 Ų | 122 | 146.8 Ų | 146.8 | 65% | 0.652 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -71.3 | 122 | 176.5 | -179.7 | 9.7 | 0 | 0 | 0 | 111 | Y9 S13 | Y9-D11 PolarHBondContact O-N 3.1Å; D11-S13 VanDerWaalsContact C-N 3.29Å; D11-S13 PolarHBondContact O-N 3.31Å; D11-S13 VanDerWaalsContact OD1-CB 3.26Å; D11-S13 WeakPolarHBondContact OD1-CB 3.31Å; D11-S13 PolarHBondContact OD1-N 3.1Å; D11-S13 VanDerWaalsContact OD1-N 3.15Å; D11-S13 PolarHBondContact OD1-OG 3.06Å; D11-S13 PolarHBondContact OD2-OG 3.06Å |
| 12 | F | 58.8 | Low | 53.7 | Low | 193 Ų | 193 | 139.3 Ų | 139.3 | 85% | 0.846 | 79% | 0.789 | S | S | * | * | trans | -87.5 | 14.7 | -177.2 | -74.1 | -85.5 | 0 | 0 | 0 | 113.7 | P10 | P10-F12 VanDerWaalsContact O-CD2 3.32Å; P10-F12 WeakPolarHBondContact O-CD2 3.17Å; P10-F12 WeakPolarHBondContact O-CE2 3.5Å | ||
| 13 | S | 63.5 | Low | 53.1 | Low | 84 Ų | 84 | 137.5 Ų | 137.5 | 59% | 0.587 | 78% | 0.784 | S | S | * | * | trans | -87.8 | 0.5 | -172.1 | 69 | 0 | 0 | 0 | 0 | 115.8 | D11 | D11-S13 VanDerWaalsContact C-N 3.29Å; D11-S13 PolarHBondContact O-N 3.31Å; D11-S13 VanDerWaalsContact OD1-CB 3.26Å; D11-S13 WeakPolarHBondContact OD1-CB 3.31Å; D11-S13 PolarHBondContact OD1-N 3.1Å; D11-S13 VanDerWaalsContact OD1-N 3.15Å; D11-S13 PolarHBondContact OD1-OG 3.06Å; D11-S13 PolarHBondContact OD2-OG 3.06Å | ||
| 14 | Q | 56.2 | Low | 52.6 | Low | 165 Ų | 165 | 139 Ų | 139 | 77% | 0.771 | 79% | 0.786 | S | S | * | * | S | Bend | trans | -97.1 | 135.2 | -178.9 | -63.1 | -172.2 | 10.1 | 0 | 0 | 112.8 | A16 | Q14-A16 PolarHBondContact O-N 2.85Š|
| 15 | P | 50.1 | Low | 52.5 | Low | 124 Ų | 124 | 135.9 Ų | 135.9 | 81% | 0.805 | 78% | 0.781 | S | S | * | * | trans | -67.4 | 132.9 | -180 | 29.3 | -32.9 | 0 | 0 | 0 | 109.7 | A17 | P15-A17 PolarHBondContact O-N 2.79Š| ||
| 16 | A | 54.4 | Low | 51.8 | Low | 99 Ų | 99 | 136.5 Ų | 136.5 | 82% | 0.818 | 78% | 0.778 | S | S | * | * | trans | -53.1 | 112.6 | 179.3 | 0 | 0 | 0 | 0 | 0 | 110.8 | Q14 L18 | Q14-A16 PolarHBondContact O-N 2.85Å; A16-L18 PolarHBondContact O-N 3.5Å | ||
| 17 | A | 54.2 | Low | 51.7 | Low | 89 Ų | 89 | 130.1 Ų | 130.1 | 74% | 0.736 | 76% | 0.755 | S | S | * | * | trans | -59.8 | 127.7 | 172.7 | 0 | 0 | 0 | 0 | 0 | 109.6 | P15 I19 | P15-A17 PolarHBondContact O-N 2.79Å; A17-I19 PolarHBondContact O-N 2.93Å; A17-I19 VanDerWaalsContact O-N 3.14Å | ||
| 18 | L | 45.5 | Very low | 51.6 | Low | 179 Ų | 179 | 132.4 Ų | 132.4 | 94% | 0.937 | 75% | 0.751 | S | S | * | * | trans | -60 | 109.2 | 173.6 | -79.5 | 151.3 | 0 | 0 | 0 | 109.8 | A16 | A16-L18 PolarHBondContact O-N 3.5Š| ||
| 19 | I | 56.5 | Low | 52.2 | Low | 152 Ų | 152 | 128.2 Ų | 128.2 | 78% | 0.779 | 74% | 0.74 | S | S | * | * | P | Polyproline II helix | trans | -83.4 | 125.1 | 173.9 | -59 | 172.7 | 0 | 0 | 0 | 108.4 | A17 | A17-I19 PolarHBondContact O-N 2.93Å; A17-I19 VanDerWaalsContact O-N 3.14Å |
| 20 | P | 51.2 | Low | 52.3 | Low | 104 Ų | 104 | 122.3 Ų | 122.3 | 68% | 0.675 | 72% | 0.723 | S | S | * | * | P | Polyproline II helix | trans | -69.1 | 153.6 | 176.8 | 29.2 | -34 | 0 | 0 | 0 | 111.6 | G22 | P20-G22 PolarHBondContact O-N 3.23Š|
| 21 | P | 44.3 | Very low | 52.4 | Low | 139 Ų | 139 | 122 Ų | 122 | 90% | 0.903 | 71% | 0.712 | S | S | * | * | S | Bend | trans | -76.3 | 124.9 | 179.7 | 31.9 | -30.4 | 0 | 0 | 0 | 109.2 | ||
| 22 | G | 46.3 | Very low | 53 | Low | 75 Ų | 75 | 120.5 Ų | 120.5 | 77% | 0.773 | 70% | 0.702 | S | S | * | * | trans | 144.1 | 17.4 | 166.3 | 0 | 0 | 0 | 0 | 0 | 119.5 | P20 | P20-G22 PolarHBondContact O-N 3.23Š| ||
| 23 | Q | 38.2 | Very low | 53.8 | Low | 180 Ų | 180 | 112.3 Ų | 112.3 | 84% | 0.841 | 67% | 0.671 | S | S | * | * | P | Polyproline II helix | trans | -92.8 | 126.2 | 166.1 | -78.6 | -179.6 | -2.8 | 0 | 0 | 110.2 | A25 | Q23-A25 PolarHBondContact O-N 3.31Š|
| 24 | P | 40.2 | Very low | 54.1 | Low | 117 Ų | 117 | 110.3 Ų | 110.3 | 76% | 0.76 | 65% | 0.653 | S | S | * | * | P | Polyproline II helix | trans | -60.2 | 129.8 | 170.1 | 27 | -31.6 | 0 | 0 | 0 | 107.4 | Q26 | P24-Q26 PolarHBondContact O-N 3.42Š|
| 25 | A | 45.9 | Very low | 54.8 | Low | 85 Ų | 85 | 109.1 Ų | 109.1 | 70% | 0.702 | 64% | 0.643 | S | S | * | * | P | Polyproline II helix | trans | -49 | 130.4 | 173.5 | 0 | 0 | 0 | 0 | 0 | 108.1 | Q23 T27 | Q23-A25 PolarHBondContact O-N 3.31Å; A25-T27 VanDerWaalsContact C-N 3.26Å; A25-T27 PolarHBondContact O-N 3.21Å; A25-T27 PolarHBondContact O-OG1 2.73Å |
| 26 | Q | 40.6 | Very low | 56.1 | Low | 186 Ų | 186 | 109 Ų | 109 | 87% | 0.869 | 63% | 0.632 | S | S | * | * | trans | -58 | 96.7 | 172.2 | -66.6 | 177 | -0.7 | 0 | 0 | 107.1 | P24 E28 | P24-Q26 PolarHBondContact O-N 3.42Å; Q26-E28 PolarHBondContact O-N 2.83Å | ||
| 27 | T | 48.2 | Very low | 57 | Low | 56 Ų | 56 | 106.4 Ų | 106.4 | 34% | 0.344 | 60% | 0.604 | S | S | . | * | trans | -62.8 | 128.9 | 176.6 | -24.9 | 0 | 0 | 0 | 0 | 106.3 | A25 E31 Q32 Y35 | A25-T27 VanDerWaalsContact C-N 3.26Å; A25-T27 PolarHBondContact O-N 3.21Å; A25-T27 PolarHBondContact O-OG1 2.73Å; T27-E31 HydrophobicContact CG2-CB 3.73Å; T27-E31 WeakPolarHBondContact CG2-OE2 3.35Å; T27-Q32 HydrophobicContact CG2-CG 4.48Å; T27-Q32 PolarHBondContact O-NE2 3.44Å; T27-Y35 HydrophobicContact CG2-CE2 4.35Å | ||
| 28 | E | 59.3 | Low | 57.7 | Low | 134 Ų | 134 | 105.8 Ų | 105.8 | 63% | 0.626 | 59% | 0.586 | S | S | * | * | trans | -50.2 | 141.2 | 179.4 | -72.8 | -78.7 | 153.1 | 0 | 0 | 109.9 | Q26 L30 E31 Q32 | Q26-E28 PolarHBondContact O-N 2.83Å; E28-L30 PolarHBondContact O-N 3.34Å; E28-E31 WeakPolarHBondContact O-CA 3.17Å; E28-E31 WeakPolarHBondContact O-CB 3.28Å; E28-E31 PolarHBondContact O-N 3.06Å; E28-Q32 PolarHBondContact O-N 2.86Å; E28-Q32 VanDerWaalsContact O-N 3.1Å | ||
| 29 | P | 66.7 | Low | 59.4 | Low | 101 Ų | 101 | 100.2 Ų | 100.2 | 66% | 0.656 | 57% | 0.566 | S | S | * | * | H | α-helix | trans | -56 | -28.9 | -173.2 | 18.5 | -30.4 | 0 | 0 | 0 | 113.2 | G33 | P29-G33 PolarHBondContact O-N 2.68Å |
| 30 | L | 60.7 | Low | 60.2 | Low | 86 Ų | 86 | 98.4 Ų | 98.4 | 45% | 0.45 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -71 | -35.9 | 174 | -68.6 | 174.2 | 0 | 0 | 0 | 113.5 | E28 M34 | E28-L30 PolarHBondContact O-N 3.34Å; L30-M34 PolarHBondContact O-N 3.43Å |
| 31 | E | 62.4 | Low | 61.2 | Low | 92 Ų | 92 | 97.9 Ų | 97.9 | 43% | 0.43 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -71.3 | -40.9 | 176.3 | -75.7 | -172 | 157.7 | 0 | 0 | 110.4 | T27 E28 G33 M34 Y35 | T27-E31 HydrophobicContact CG2-CB 3.73Å; T27-E31 WeakPolarHBondContact CG2-OE2 3.35Å; E28-E31 WeakPolarHBondContact O-CA 3.17Å; E28-E31 WeakPolarHBondContact O-CB 3.28Å; E28-E31 PolarHBondContact O-N 3.06Å; E31-G33 PolarHBondContact O-N 2.75Å; E31-M34 WeakPolarHBondContact O-CB 3.24Å; E31-M34 PolarHBondContact O-N 3.12Å; E31-M34 VanDerWaalsContact O-N 3.14Å; E31-Y35 HydrophobicContact CB-CE2 4.39Å; E31-Y35 WeakPolarHBondContact O-CD2 3.42Å; E31-Y35 PolarHBondContact O-N 3.07Å |
| 32 | Q | 70.3 | Confident | 62.5 | Low | 91 Ų | 91 | 99.8 Ų | 99.8 | 43% | 0.425 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -56.5 | -49.9 | 174.5 | -63 | -176.1 | 1.9 | 0 | 0 | 111.7 | T27 E28 M34 Y35 E36 | T27-Q32 HydrophobicContact CG2-CG 4.48Å; T27-Q32 PolarHBondContact O-NE2 3.44Å; E28-Q32 PolarHBondContact O-N 2.86Å; E28-Q32 VanDerWaalsContact O-N 3.1Å; Q32-M34 PolarHBondContact O-N 3.01Å; Q32-Y35 PolarHBondContact O-N 2.8Å; Q32-E36 PolarHBondContact O-N 2.9Å |
| 33 | G | 74.4 | Confident | 64 | Low | 20 Ų | 20 | 103.5 Ų | 103.5 | 21% | 0.206 | 54% | 0.539 | C | S | . | . | H | α-helix | trans | -60.9 | -30.9 | 177.6 | 0 | 0 | 0 | 0 | 0 | 113.5 | P29 E31 L37 | P29-G33 PolarHBondContact O-N 2.68Å; E31-G33 PolarHBondContact O-N 2.75Å; G33-L37 WeakPolarHBondContact O-CG 3.36Å; G33-L37 PolarHBondContact O-N 3.33Å; G33-L37 VanDerWaalsContact O-N 3.15Å |
| 34 | M | 69.3 | Low | 65.6 | Low | 43 Ų | 43 | 96.9 Ų | 96.9 | 21% | 0.212 | 51% | 0.511 | C | S | . | . | H | α-helix | trans | -69.8 | -41.4 | 174.2 | -168 | -163.6 | 68.5 | 0 | 0 | 112 | L30 E31 Q32 L37 M38 I62 | L30-M34 PolarHBondContact O-N 3.43Å; E31-M34 WeakPolarHBondContact O-CB 3.24Å; E31-M34 PolarHBondContact O-N 3.12Å; E31-M34 VanDerWaalsContact O-N 3.14Å; Q32-M34 PolarHBondContact O-N 3.01Å; M34-L37 PolarHBondContact O-N 3.2Å; M34-M38 HydrophobicContact CE-CE 3.68Å; M34-M38 HydrophobicContact CE-SD 4.18Å; M34-M38 HydrophobicContact CG-CE 3.91Å; M34-M38 VanDerWaalsContact O-CG 3.32Å; M34-M38 WeakPolarHBondContact O-CG 3.21Å; M34-M38 PolarHBondContact O-N 3.02Å; M34-M38 HydrophobicContact SD-CE 3.76Å; M34-I62 HydrophobicContact CB-CG2 4.42Å |
| 35 | Y | 72.8 | Confident | 67.3 | Low | 139 Ų | 139 | 96.4 Ų | 96.4 | 55% | 0.545 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -65.7 | -39.8 | 177.1 | -76.1 | -70.6 | 0 | 0 | 0 | 112 | T27 E31 Q32 M38 A39 | T27-Y35 HydrophobicContact CG2-CE2 4.35Å; E31-Y35 HydrophobicContact CB-CE2 4.39Å; E31-Y35 WeakPolarHBondContact O-CD2 3.42Å; E31-Y35 PolarHBondContact O-N 3.07Å; Q32-Y35 PolarHBondContact O-N 2.8Å; Y35-M38 PolarHBondContact O-N 3.15Å; Y35-A39 PolarHBondContact O-N 3.45Å |
| 36 | E | 77.7 | Confident | 68.5 | Low | 123 Ų | 123 | 98.9 Ų | 98.9 | 58% | 0.575 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -60.5 | -49.3 | 174.8 | -72 | 175.2 | 176.9 | 0 | 0 | 111.3 | Q32 M38 A39 E40 | Q32-E36 PolarHBondContact O-N 2.9Å; E36-M38 VanDerWaalsContact C-N 3.28Å; E36-M38 PolarHBondContact O-N 3.04Å; E36-A39 PolarHBondContact O-N 3.18Å; E36-A39 VanDerWaalsContact O-N 3.16Å; E36-E40 WeakPolarHBondContact O-CG 3.36Å; E36-E40 PolarHBondContact O-N 2.95Å |
| 37 | L | 71.3 | Confident | 70.2 | Confident | 44 Ų | 44 | 94.6 Ų | 94.6 | 23% | 0.23 | 51% | 0.507 | C | S | . | . | H | α-helix | trans | -62.4 | -32.9 | 176.3 | -73 | -178 | 0 | 0 | 0 | 113.3 | G33 M34 K41 I62 | G33-L37 WeakPolarHBondContact O-CG 3.36Å; G33-L37 PolarHBondContact O-N 3.33Å; G33-L37 VanDerWaalsContact O-N 3.15Å; M34-L37 PolarHBondContact O-N 3.2Å; L37-K41 WeakPolarHBondContact O-CB 3.31Å; L37-K41 PolarHBondContact O-N 3.33Å; L37-I62 HydrophobicContact CD1-CD1 3.42Å; L37-I62 VanDerWaalsContact CD1-CD1 3.42Å; L37-I62 HydrophobicContact CD1-CG1 4.35Å; L37-I62 HydrophobicContact CG-CD1 4.41Å |
| 38 | M | 70.7 | Confident | 71.5 | Confident | 76 Ų | 76 | 96 Ų | 96 | 37% | 0.374 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -68 | -42.1 | 175 | -75.2 | -179 | -179 | 0 | 0 | 111.6 | M34 Y35 E36 K41 E42 | M34-M38 HydrophobicContact CE-CE 3.68Å; M34-M38 HydrophobicContact CE-SD 4.18Å; M34-M38 HydrophobicContact CG-CE 3.91Å; M34-M38 VanDerWaalsContact O-CG 3.32Å; M34-M38 WeakPolarHBondContact O-CG 3.21Å; M34-M38 PolarHBondContact O-N 3.02Å; M34-M38 HydrophobicContact SD-CE 3.76Å; Y35-M38 PolarHBondContact O-N 3.15Å; E36-M38 VanDerWaalsContact C-N 3.28Å; E36-M38 PolarHBondContact O-N 3.04Å; M38-K41 WeakPolarHBondContact O-CB 3.28Å; M38-K41 PolarHBondContact O-N 2.85Å; M38-E42 PolarHBondContact O-N 3.45Å |
| 39 | A | 79.4 | Confident | 72.3 | Confident | 61 Ų | 61 | 97.6 Ų | 97.6 | 50% | 0.504 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -66.2 | -41.6 | 177.2 | 0 | 0 | 0 | 0 | 0 | 111.7 | Y35 E36 K41 E42 L43 | Y35-A39 PolarHBondContact O-N 3.45Å; E36-A39 PolarHBondContact O-N 3.18Å; E36-A39 VanDerWaalsContact O-N 3.16Å; A39-K41 VanDerWaalsContact C-N 3.33Å; A39-K41 PolarHBondContact O-N 3.4Å; A39-E42 PolarHBondContact O-N 2.86Å; A39-L43 PolarHBondContact O-N 3.02Å |
| 40 | E | 74.6 | Confident | 72.7 | Confident | 114 Ų | 114 | 103.4 Ų | 103.4 | 53% | 0.533 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -64.4 | -37.8 | 175.6 | -72.2 | -176 | 169.5 | 0 | 0 | 111.9 | E36 E42 L43 V44 | E36-E40 WeakPolarHBondContact O-CG 3.36Å; E36-E40 PolarHBondContact O-N 2.95Å; E40-E42 VanDerWaalsContact C-N 3.26Å; E40-E42 PolarHBondContact O-N 2.95Å; E40-L43 PolarHBondContact O-N 3.46Å; E40-L43 VanDerWaalsContact O-N 3.14Å; E40-V44 WeakPolarHBondContact O-CG2 3.2Å; E40-V44 PolarHBondContact O-N 2.84Å |
| 41 | K | 71.5 | Confident | 73.4 | Confident | 93 Ų | 93 | 102 Ų | 102 | 40% | 0.404 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -58.6 | -37.8 | 176.9 | -165.1 | -165.6 | 173.7 | -150 | 0 | 112.5 | L37 M38 A39 L43 V44 H52 V55 | L37-K41 WeakPolarHBondContact O-CB 3.31Å; L37-K41 PolarHBondContact O-N 3.33Å; M38-K41 WeakPolarHBondContact O-CB 3.28Å; M38-K41 PolarHBondContact O-N 2.85Å; A39-K41 VanDerWaalsContact C-N 3.33Å; A39-K41 PolarHBondContact O-N 3.4Å; K41-L43 VanDerWaalsContact C-N 3.29Å; K41-V44 PolarHBondContact O-N 2.63Å; K41-H52 VanDerWaalsContact CE-CD2 3.47Å; K41-H52 WeakPolarHBondContact CE-CD2 3.34Å; K41-H52 WeakPolarHBondContact CE-NE2 3.49Å; K41-V55 HydrophobicContact CB-CG1 3.84Å; K41-V55 HydrophobicContact CG-CG1 3.92Å |
| 42 | E | 73 | Confident | 74 | Confident | 179 Ų | 179 | 101 Ų | 101 | 84% | 0.836 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -73.9 | -21.8 | -179.1 | -68.1 | -167.1 | 165.1 | 0 | 0 | 112.9 | M38 A39 E40 | M38-E42 PolarHBondContact O-N 3.45Å; A39-E42 PolarHBondContact O-N 2.86Å; E40-E42 VanDerWaalsContact C-N 3.26Å; E40-E42 PolarHBondContact O-N 2.95Å |
| 43 | L | 76.3 | Confident | 74.4 | Confident | 153 Ų | 153 | 99 Ų | 99 | 80% | 0.801 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -85 | -16.4 | 176.9 | -169.1 | 61.7 | 0 | 0 | 0 | 113 | A39 E40 K41 | A39-L43 PolarHBondContact O-N 3.02Å; E40-L43 PolarHBondContact O-N 3.46Å; E40-L43 VanDerWaalsContact O-N 3.14Å; K41-L43 VanDerWaalsContact C-N 3.29Å |
| 44 | V | 72.8 | Confident | 74.7 | Confident | 41 Ų | 41 | 103.2 Ų | 103.2 | 25% | 0.248 | 54% | 0.539 | C | S | . | . | S | Bend | trans | -82.7 | 126.5 | -177.6 | 173.2 | 0 | 0 | 0 | 0 | 110.9 | E40 K41 L48 V51 | E40-V44 WeakPolarHBondContact O-CG2 3.2Å; E40-V44 PolarHBondContact O-N 2.84Å; K41-V44 PolarHBondContact O-N 2.63Å; V44-L48 HydrophobicContact CG1-CB 4.31Å; V44-V51 HydrophobicContact CB-CG1 4.31Å; V44-V51 HydrophobicContact CG1-CB 3.81Å; V44-V51 HydrophobicContact CG1-CG1 3.56Å; V44-V51 HydrophobicContact CG2-CG1 3.71Å |
| 45 | D | 74.7 | Confident | 75.1 | Confident | 108 Ų | 108 | 102 Ų | 102 | 58% | 0.578 | 54% | 0.535 | S | S | * | . | trans | -55.5 | 131.7 | 176.1 | -75.9 | -44.5 | 0 | 0 | 0 | 111.7 | A47 L48 | D45-A47 PolarHBondContact O-N 3.18Å; D45-L48 HydrophobicContact CB-CD1 4.19Å; D45-L48 PolarHBondContact O-N 3.06Å | ||
| 46 | P | 72.2 | Confident | 75.3 | Confident | 137 Ų | 137 | 99.9 Ų | 99.9 | 89% | 0.89 | 53% | 0.53 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -64.3 | -11.6 | -178.3 | 25.6 | -34.3 | 0 | 0 | 0 | 113.7 | L48 | P46-L48 VanDerWaalsContact C-N 3.34Š|
| 47 | A | 75.2 | Confident | 75.4 | Confident | 95 Ų | 95 | 96.1 Ų | 96.1 | 79% | 0.785 | 52% | 0.52 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -77.7 | -16.1 | 174.5 | 0 | 0 | 0 | 0 | 0 | 113.6 | D45 E49 | D45-A47 PolarHBondContact O-N 3.18Å; A47-E49 PolarHBondContact O-N 3.48Å |
| 48 | L | 75.6 | Confident | 75.6 | Confident | 87 Ų | 87 | 95 Ų | 95 | 46% | 0.455 | 52% | 0.519 | S | S | . | . | trans | -91.1 | 71.3 | -178.7 | -75 | 161.7 | 0 | 0 | 0 | 111.4 | V44 D45 P46 R50 V51 H52 | V44-L48 HydrophobicContact CG1-CB 4.31Å; D45-L48 HydrophobicContact CB-CD1 4.19Å; D45-L48 PolarHBondContact O-N 3.06Å; P46-L48 VanDerWaalsContact C-N 3.34Å; L48-R50 PolarHBondContact O-N 2.9Å; L48-R50 VanDerWaalsContact O-N 3.13Å; L48-V51 HydrophobicContact CB-CB 4.1Å; L48-V51 HydrophobicContact CB-CG2 3.94Å; L48-V51 HydrophobicContact CD1-CG2 4.44Å; L48-V51 HydrophobicContact CD2-CG2 4.42Å; L48-V51 PolarHBondContact O-N 3.27Å; L48-H52 PolarHBondContact O-N 3.03Å; L48-H52 VanDerWaalsContact O-N 3.13Å | ||
| 49 | E | 77.8 | Confident | 75.8 | Confident | 166 Ų | 166 | 97 Ų | 97 | 78% | 0.776 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -54.5 | -35.9 | -177.2 | -157.4 | 168.8 | -143 | 0 | 0 | 113.1 | A47 A53 | A47-E49 PolarHBondContact O-N 3.48Å; E49-A53 PolarHBondContact O-N 2.97Å |
| 50 | R | 74.8 | Confident | 75.4 | Confident | 223 Ų | 223 | 97.5 Ų | 97.5 | 84% | 0.842 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -65.9 | -39.3 | 176.4 | -64.6 | -176.5 | -168.2 | 152.2 | 3.7 | 113.2 | L48 A53 V54 | L48-R50 PolarHBondContact O-N 2.9Å; L48-R50 VanDerWaalsContact O-N 3.13Å; R50-A53 PolarHBondContact O-N 2.84Å; R50-V54 WeakPolarHBondContact O-CG2 2.84Å; R50-V54 PolarHBondContact O-N 3.17Å |
| 51 | V | 74.5 | Confident | 75.4 | Confident | 57 Ų | 57 | 95.8 Ų | 95.8 | 35% | 0.345 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -71.5 | -41.9 | -180 | -178.3 | 0 | 0 | 0 | 0 | 109.4 | V44 L48 A53 V54 V55 | V44-V51 HydrophobicContact CB-CG1 4.31Å; V44-V51 HydrophobicContact CG1-CB 3.81Å; V44-V51 HydrophobicContact CG1-CG1 3.56Å; V44-V51 HydrophobicContact CG2-CG1 3.71Å; L48-V51 HydrophobicContact CB-CB 4.1Å; L48-V51 HydrophobicContact CB-CG2 3.94Å; L48-V51 HydrophobicContact CD1-CG2 4.44Å; L48-V51 HydrophobicContact CD2-CG2 4.42Å; L48-V51 PolarHBondContact O-N 3.27Å; V51-A53 VanDerWaalsContact C-N 3.28Å; V51-A53 PolarHBondContact O-N 3.06Å; V51-V54 PolarHBondContact O-N 2.93Å; V51-V54 VanDerWaalsContact O-N 3.11Å; V51-V55 HydrophobicContact CG1-CG2 4.47Å; V51-V55 WeakPolarHBondContact O-CG2 3.26Å; V51-V55 PolarHBondContact O-N 3.47Å |
| 52 | H | 74.7 | Confident | 75.2 | Confident | 70 Ų | 70 | 92.8 Ų | 92.8 | 32% | 0.324 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -59.4 | -39.2 | 173.7 | -171.2 | -114.7 | 0 | 0 | 0 | 112 | K41 L48 V54 V55 Q56 | K41-H52 VanDerWaalsContact CE-CD2 3.47Å; K41-H52 WeakPolarHBondContact CE-CD2 3.34Å; K41-H52 WeakPolarHBondContact CE-NE2 3.49Å; L48-H52 PolarHBondContact O-N 3.03Å; L48-H52 VanDerWaalsContact O-N 3.13Å; H52-V54 PolarHBondContact O-N 2.65Å; H52-V55 PolarHBondContact O-N 3.39Å; H52-Q56 PolarHBondContact CE1-NE2 3.41Å; H52-Q56 PolarHBondContact ND1-NE2 3.13Å; H52-Q56 WeakPolarHBondContact O-CB 3.48Å; H52-Q56 VanDerWaalsContact O-CG 3.22Å; H52-Q56 WeakPolarHBondContact O-CG 3.49Å; H52-Q56 PolarHBondContact O-N 2.89Å |
| 53 | A | 79.8 | Confident | 75 | Confident | 51 Ų | 51 | 86 Ų | 86 | 42% | 0.421 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -61.9 | -40.1 | 174.3 | 0 | 0 | 0 | 0 | 0 | 112.8 | E49 R50 V51 A57 | E49-A53 PolarHBondContact O-N 2.97Å; R50-A53 PolarHBondContact O-N 2.84Å; V51-A53 VanDerWaalsContact C-N 3.28Å; V51-A53 PolarHBondContact O-N 3.06Å; A53-A57 WeakPolarHBondContact O-CB 3.35Å; A53-A57 PolarHBondContact O-N 3.48Å |
| 54 | V | 80.1 | Confident | 74.4 | Confident | 107 Ų | 107 | 84.1 Ų | 84.1 | 65% | 0.648 | 45% | 0.449 | S | S | * | . | H | α-helix | trans | -67.5 | -45.1 | 176.4 | 175.3 | 0 | 0 | 0 | 0 | 111.3 | R50 V51 H52 Q56 A57 G58 | R50-V54 WeakPolarHBondContact O-CG2 2.84Å; R50-V54 PolarHBondContact O-N 3.17Å; V51-V54 PolarHBondContact O-N 2.93Å; V51-V54 VanDerWaalsContact O-N 3.11Å; H52-V54 PolarHBondContact O-N 2.65Å; V54-Q56 VanDerWaalsContact C-N 3.32Å; V54-Q56 PolarHBondContact O-N 3.4Å; V54-A57 WeakPolarHBondContact O-CB 3.29Å; V54-A57 PolarHBondContact O-N 3.03Å; V54-G58 PolarHBondContact O-N 3.2Å |
| 55 | V | 77.5 | Confident | 73.8 | Confident | 18 Ų | 18 | 88.7 Ų | 88.7 | 11% | 0.109 | 47% | 0.468 | C | S | . | . | H | α-helix | trans | -62.6 | -41 | 177.3 | 175.4 | 0 | 0 | 0 | 0 | 111 | K41 V51 H52 G58 R59 | K41-V55 HydrophobicContact CB-CG1 3.84Å; K41-V55 HydrophobicContact CG-CG1 3.92Å; V51-V55 HydrophobicContact CG1-CG2 4.47Å; V51-V55 WeakPolarHBondContact O-CG2 3.26Å; V51-V55 PolarHBondContact O-N 3.47Å; H52-V55 PolarHBondContact O-N 3.39Å; V55-G58 PolarHBondContact O-N 3.36Å; V55-R59 PolarHBondContact O-N 3.16Å |
| 56 | Q | 77.1 | Confident | 73.1 | Confident | 94 Ų | 94 | 86.6 Ų | 86.6 | 44% | 0.439 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -62.2 | -43.7 | 172.9 | -76.2 | -176.9 | -7 | 0 | 0 | 112.2 | H52 V54 G58 R59 L60 | H52-Q56 PolarHBondContact CE1-NE2 3.41Å; H52-Q56 PolarHBondContact ND1-NE2 3.13Å; H52-Q56 WeakPolarHBondContact O-CB 3.48Å; H52-Q56 VanDerWaalsContact O-CG 3.22Å; H52-Q56 WeakPolarHBondContact O-CG 3.49Å; H52-Q56 PolarHBondContact O-N 2.89Å; V54-Q56 VanDerWaalsContact C-N 3.32Å; V54-Q56 PolarHBondContact O-N 3.4Å; Q56-G58 VanDerWaalsContact C-N 3.35Å; Q56-G58 PolarHBondContact O-N 2.77Å; Q56-R59 PolarHBondContact O-N 3.19Å; Q56-L60 WeakPolarHBondContact O-CG 3.36Å; Q56-L60 PolarHBondContact O-N 3.2Å |
| 57 | A | 79.1 | Confident | 72.3 | Confident | 45 Ų | 45 | 82.5 Ų | 82.5 | 37% | 0.372 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -62.5 | -41.5 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | A53 V54 L60 N61 | A53-A57 WeakPolarHBondContact O-CB 3.35Å; A53-A57 PolarHBondContact O-N 3.48Å; V54-A57 WeakPolarHBondContact O-CB 3.29Å; V54-A57 PolarHBondContact O-N 3.03Å; A57-L60 PolarHBondContact O-N 3.38Å; A57-N61 VanDerWaalsContact O-CG 3.24Å; A57-N61 PolarHBondContact O-N 3Å; A57-N61 PolarHBondContact O-ND2 3.41Å |
| 58 | G | 75.9 | Confident | 71.5 | Confident | 21 Ų | 21 | 84.9 Ų | 84.9 | 22% | 0.216 | 44% | 0.437 | C | S | . | . | H | α-helix | trans | -59.6 | -47.3 | 173.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | V54 V55 Q56 L60 N61 I62 | V54-G58 PolarHBondContact O-N 3.2Å; V55-G58 PolarHBondContact O-N 3.36Å; Q56-G58 VanDerWaalsContact C-N 3.35Å; Q56-G58 PolarHBondContact O-N 2.77Å; G58-L60 PolarHBondContact O-N 3.04Å; G58-N61 WeakPolarHBondContact O-CB 3.4Å; G58-N61 PolarHBondContact O-N 3.45Å; G58-N61 VanDerWaalsContact O-N 3.16Å; G58-I62 WeakPolarHBondContact O-CG1 3.16Å; G58-I62 PolarHBondContact O-N 3.45Å |
| 59 | R | 75.1 | Confident | 70.8 | Confident | 117 Ų | 117 | 83.5 Ų | 83.5 | 44% | 0.442 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -58.7 | -46.2 | 174.6 | 179 | -179.9 | 171.8 | 166.3 | 0.1 | 112.4 | V55 Q56 N61 I62 E63 | V55-R59 PolarHBondContact O-N 3.16Å; Q56-R59 PolarHBondContact O-N 3.19Å; R59-N61 VanDerWaalsContact C-N 3.26Å; R59-N61 PolarHBondContact O-N 3.11Å; R59-I62 PolarHBondContact O-N 3.12Å; R59-E63 HydrophobicContact CG-CG 4.36Å; R59-E63 IonicContact CZ-OE1 3.43Å; R59-E63 IonicContact NE-OE1 2.85Å; R59-E63 PolarHBondContact NE-OE1 3.5Å; R59-E63 IonicContact NH2-OE1 3.09Å; R59-E63 PolarHBondContact NH2-OE1 3.42Å; R59-E63 VanDerWaalsContact NH2-OE1 3.09Å; R59-E63 WeakPolarHBondContact O-CB 3.39Å; R59-E63 WeakPolarHBondContact O-CG 3.44Å; R59-E63 PolarHBondContact O-N 2.98Å |
| 60 | L | 72 | Confident | 70.2 | Confident | 72 Ų | 72 | 79.5 Ų | 79.5 | 38% | 0.377 | 41% | 0.411 | S | S | . | . | H | α-helix | trans | -62.3 | -36.2 | 177.9 | -72.3 | 174.6 | 0 | 0 | 0 | 111.5 | Q56 A57 G58 E63 R64 I69 | Q56-L60 WeakPolarHBondContact O-CG 3.36Å; Q56-L60 PolarHBondContact O-N 3.2Å; A57-L60 PolarHBondContact O-N 3.38Å; G58-L60 PolarHBondContact O-N 3.04Å; L60-E63 PolarHBondContact O-N 3.38Å; L60-R64 WeakPolarHBondContact O-CB 3.37Å; L60-R64 WeakPolarHBondContact O-CD 3.11Å; L60-R64 WeakPolarHBondContact O-CG 3.32Å; L60-R64 PolarHBondContact O-N 2.96Å; L60-I69 HydrophobicContact CD2-CD1 3.96Å |
| 61 | N | 72.9 | Confident | 69.8 | Low | 77 Ų | 77 | 71.4 Ų | 71.4 | 41% | 0.412 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -66.2 | -45.5 | 175.3 | -70.3 | -15.4 | 0 | 0 | 0 | 111.7 | A57 G58 R59 E63 R64 E65 | A57-N61 VanDerWaalsContact O-CG 3.24Å; A57-N61 PolarHBondContact O-N 3Å; A57-N61 PolarHBondContact O-ND2 3.41Å; G58-N61 WeakPolarHBondContact O-CB 3.4Å; G58-N61 PolarHBondContact O-N 3.45Å; G58-N61 VanDerWaalsContact O-N 3.16Å; R59-N61 VanDerWaalsContact C-N 3.26Å; R59-N61 PolarHBondContact O-N 3.11Å; N61-E63 VanDerWaalsContact C-N 3.35Å; N61-E63 PolarHBondContact O-N 3.49Å; N61-R64 WeakPolarHBondContact O-CB 3.45Å; N61-R64 PolarHBondContact O-N 3.34Å; N61-R64 PolarHBondContact OD1-NH1 3.25Å; N61-E65 WeakPolarHBondContact O-CG 3.47Å; N61-E65 PolarHBondContact O-N 3.01Å |
| 62 | I | 69.1 | Low | 69.7 | Low | 30 Ų | 30 | 75.8 Ų | 75.8 | 15% | 0.154 | 40% | 0.404 | C | S | . | . | H | α-helix | trans | -63.9 | -40 | 174.8 | -61.6 | -177.2 | 0 | 0 | 0 | 111.1 | M34 L37 G58 R59 R64 E65 S66 | M34-I62 HydrophobicContact CB-CG2 4.42Å; L37-I62 HydrophobicContact CD1-CD1 3.42Å; L37-I62 VanDerWaalsContact CD1-CD1 3.42Å; L37-I62 HydrophobicContact CD1-CG1 4.35Å; L37-I62 HydrophobicContact CG-CD1 4.41Å; G58-I62 WeakPolarHBondContact O-CG1 3.16Å; G58-I62 PolarHBondContact O-N 3.45Å; R59-I62 PolarHBondContact O-N 3.12Å; I62-R64 VanDerWaalsContact C-N 3.34Å; I62-R64 PolarHBondContact O-N 3.44Å; I62-E65 PolarHBondContact O-N 3.41Å; I62-S66 WeakPolarHBondContact O-CB 3.48Å; I62-S66 PolarHBondContact O-N 3.45Å |
| 63 | E | 67.8 | Low | 69.7 | Low | 38 Ų | 38 | 81.1 Ų | 81.1 | 18% | 0.178 | 42% | 0.423 | C | S | . | . | H | α-helix | trans | -66.9 | -34.2 | 177 | -74.7 | 179.3 | 173.9 | 0 | 0 | 112.5 | R59 L60 N61 G67 K68 I69 | R59-E63 HydrophobicContact CG-CG 4.36Å; R59-E63 IonicContact CZ-OE1 3.43Å; R59-E63 IonicContact NE-OE1 2.85Å; R59-E63 PolarHBondContact NE-OE1 3.5Å; R59-E63 IonicContact NH2-OE1 3.09Å; R59-E63 PolarHBondContact NH2-OE1 3.42Å; R59-E63 VanDerWaalsContact NH2-OE1 3.09Å; R59-E63 WeakPolarHBondContact O-CB 3.39Å; R59-E63 WeakPolarHBondContact O-CG 3.44Å; R59-E63 PolarHBondContact O-N 2.98Å; L60-E63 PolarHBondContact O-N 3.38Å; N61-E63 VanDerWaalsContact C-N 3.35Å; N61-E63 PolarHBondContact O-N 3.49Å; E63-G67 PolarHBondContact O-N 2.88Å; E63-K68 PolarHBondContact O-N 2.9Å; E63-K68 VanDerWaalsContact O-N 3.08Å; E63-I69 HydrophobicContact CB-CD1 3.72Å; E63-I69 HydrophobicContact CB-CG1 4.34Å |
| 64 | R | 63.1 | Low | 69.7 | Low | 112 Ų | 112 | 81.8 Ų | 81.8 | 42% | 0.423 | 42% | 0.419 | S | S | . | . | H | α-helix | trans | -65 | -45.1 | 170.1 | -74.8 | 165.8 | -176.7 | 145.9 | -2.1 | 111.2 | L60 N61 I62 S66 G67 I69 | L60-R64 WeakPolarHBondContact O-CB 3.37Å; L60-R64 WeakPolarHBondContact O-CD 3.11Å; L60-R64 WeakPolarHBondContact O-CG 3.32Å; L60-R64 PolarHBondContact O-N 2.96Å; N61-R64 WeakPolarHBondContact O-CB 3.45Å; N61-R64 PolarHBondContact O-N 3.34Å; N61-R64 PolarHBondContact OD1-NH1 3.25Å; I62-R64 VanDerWaalsContact C-N 3.34Å; I62-R64 PolarHBondContact O-N 3.44Å; R64-S66 VanDerWaalsContact C-N 3.33Å; R64-G67 PolarHBondContact O-N 3.43Å; R64-I69 HydrophobicContact CG-CB 3.95Å; R64-I69 HydrophobicContact CG-CD1 4.33Å; R64-I69 HydrophobicContact CG-CG2 4.17Å |
| 65 | E | 61.2 | Low | 69.6 | Low | 137 Ų | 137 | 81.1 Ų | 81.1 | 64% | 0.64 | 41% | 0.411 | S | S | * | . | H | α-helix | trans | -67.1 | -33.6 | 176.6 | -72.5 | 177.9 | 178.6 | 0 | 0 | 112.5 | N61 I62 G67 | N61-E65 WeakPolarHBondContact O-CG 3.47Å; N61-E65 PolarHBondContact O-N 3.01Å; I62-E65 PolarHBondContact O-N 3.41Å; E65-G67 PolarHBondContact O-N 3.45Å; E65-G67 VanDerWaalsContact O-N 3.12Å |
| 66 | S | 59.9 | Low | 69.7 | Low | 64 Ų | 64 | 87 Ų | 87 | 45% | 0.448 | 44% | 0.441 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -68.2 | -3.8 | 171.5 | -166.8 | 0 | 0 | 0 | 0 | 112.6 | I62 R64 K68 | I62-S66 WeakPolarHBondContact O-CB 3.48Å; I62-S66 PolarHBondContact O-N 3.45Å; R64-S66 VanDerWaalsContact C-N 3.33Å; S66-K68 VanDerWaalsContact C-N 3.26Å; S66-K68 PolarHBondContact O-N 3.43Å |
| 67 | G | 56.1 | Low | 69.6 | Low | 51 Ų | 51 | 88.6 Ų | 88.6 | 53% | 0.526 | 45% | 0.452 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 70.4 | 19 | 177.5 | 0 | 0 | 0 | 0 | 0 | 113.8 | E63 R64 E65 | E63-G67 PolarHBondContact O-N 2.88Å; R64-G67 PolarHBondContact O-N 3.43Å; E65-G67 PolarHBondContact O-N 3.45Å; E65-G67 VanDerWaalsContact O-N 3.12Å |
| 68 | K | 57.5 | Low | 68.9 | Low | 145 Ų | 145 | 94 Ų | 94 | 63% | 0.63 | 48% | 0.475 | S | S | * | . | trans | -83.3 | -26.6 | 178 | -66.8 | 178.9 | -176.3 | 170.3 | 0 | 112.3 | E63 S66 | E63-K68 PolarHBondContact O-N 2.9Å; E63-K68 VanDerWaalsContact O-N 3.08Å; S66-K68 VanDerWaalsContact C-N 3.26Å; S66-K68 PolarHBondContact O-N 3.43Å | ||
| 69 | I | 61 | Low | 68.9 | Low | 59 Ų | 59 | 99.3 Ų | 99.3 | 30% | 0.303 | 49% | 0.492 | S | S | . | . | S | Bend | trans | -115.9 | 120.4 | -177.3 | -55.7 | 171.1 | 0 | 0 | 0 | 108 | L60 E63 R64 | L60-I69 HydrophobicContact CD2-CD1 3.96Å; E63-I69 HydrophobicContact CB-CD1 3.72Å; E63-I69 HydrophobicContact CB-CG1 4.34Å; R64-I69 HydrophobicContact CG-CB 3.95Å; R64-I69 HydrophobicContact CG-CD1 4.33Å; R64-I69 HydrophobicContact CG-CG2 4.17Å |
| 70 | E | 64.7 | Low | 69.3 | Low | 81 Ų | 81 | 98.5 Ų | 98.5 | 38% | 0.379 | 50% | 0.5 | S | S | . | . | trans | -62.8 | 137 | 173.5 | -65 | -177.4 | 173.2 | 0 | 0 | 109.2 | E72 K85 | E70-E72 PolarHBondContact O-N 3.43Å; E70-K85 WeakPolarHBondContact OE1-CE 3.14Å; E70-K85 IonicContact OE1-NZ 2.75Å; E70-K85 PolarHBondContact OE1-NZ 3.11Å; E70-K85 IonicContact OE2-NZ 3.78Å; E70-K85 PolarHBondContact OE2-NZ 3.32Å | ||
| 71 | P | 66.8 | Low | 70.1 | Confident | 54 Ų | 54 | 95.7 Ų | 95.7 | 35% | 0.351 | 49% | 0.485 | S | S | . | . | trans | -63.1 | 127.4 | -179.7 | 27.3 | -33.6 | 0 | 0 | 0 | 109.4 | Y73 L81 | P71-Y73 PolarHBondContact O-N 3.39Å; P71-L81 HydrophobicContact CG-CD1 3.51Å | ||
| 72 | E | 72.2 | Confident | 70.8 | Confident | 149 Ų | 149 | 100.2 Ų | 100.2 | 70% | 0.696 | 50% | 0.501 | S | S | * | . | S | Bend | trans | -62.5 | -35.9 | 178.3 | -173.4 | -178.2 | 161.7 | 0 | 0 | 111.5 | E70 | E70-E72 PolarHBondContact O-N 3.43Š|
| 73 | Y | 75.4 | Confident | 71.8 | Confident | 181 Ų | 181 | 98.9 Ų | 98.9 | 71% | 0.71 | 49% | 0.494 | S | S | * | . | S | Bend | trans | -113.9 | 132.9 | 177.6 | -59.1 | -87.8 | 0 | 0 | 0 | 110.1 | P71 | P71-Y73 PolarHBondContact O-N 3.39Š|
| 74 | I | 78.2 | Confident | 73 | Confident | 66 Ų | 66 | 99 Ų | 99 | 34% | 0.338 | 50% | 0.498 | S | S | . | . | trans | -103.6 | 118.2 | 177.1 | -59.7 | 177.9 | 0 | 0 | 0 | 107.8 | L81 P164 Y168 | I74-L81 HydrophobicContact CD1-CD2 4.42Å; I74-P164 HydrophobicContact CG2-CB 3.51Å; I74-P164 HydrophobicContact CG2-CG 3.3Å; I74-Y168 HydrophobicContact CD1-CE2 3.72Å | ||
| 75 | D | 80 | Confident | 74.5 | Confident | 93 Ų | 93 | 97.3 Ų | 97.3 | 50% | 0.497 | 49% | 0.493 | S | S | . | . | trans | -82.4 | 120.7 | 168.9 | -173.1 | -4.2 | 0 | 0 | 0 | 109 | D77 K79 | D75-D77 PolarHBondContact OD1-N 3.03Å; D75-K79 HydrophobicContact CB-CB 4.46Å | ||
| 76 | I | 78.3 | Confident | 76 | Confident | 141 Ų | 141 | 95.9 Ų | 95.9 | 72% | 0.723 | 49% | 0.485 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -77.7 | -28.3 | -173.9 | -61.9 | 175.1 | 0 | 0 | 0 | 110.6 | ||
| 77 | D | 74.6 | Confident | 77.6 | Confident | 128 Ų | 128 | 94.1 Ų | 94.1 | 68% | 0.684 | 47% | 0.472 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -80.3 | -33.2 | -155.7 | -69.7 | -26.2 | 0 | 0 | 0 | 113.4 | D75 | D75-D77 PolarHBondContact OD1-N 3.03Š|
| 78 | N | 64.3 | Low | 79.4 | Confident | 158 Ų | 158 | 97 Ų | 97 | 85% | 0.845 | 48% | 0.475 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -154.7 | 6.8 | -177.1 | -75.6 | -62.4 | 0 | 0 | 0 | 116.2 | ||
| 79 | K | 76.3 | Confident | 81.1 | Confident | 133 Ų | 133 | 90.6 Ų | 90.6 | 58% | 0.578 | 45% | 0.447 | S | S | * | . | trans | -93.4 | 120.3 | -171.9 | -161.1 | 169.6 | -176.5 | 176.4 | 0 | 112.3 | D75 L81 | D75-K79 HydrophobicContact CB-CB 4.46Å; K79-L81 PolarHBondContact O-N 3.36Å | ||
| 80 | V | 84.5 | Confident | 82.5 | Confident | 99 Ų | 99 | 89.4 Ų | 89.4 | 60% | 0.6 | 44% | 0.443 | S | S | * | . | trans | -66.5 | 115.1 | 165.2 | 178.6 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 81 | L | 87.2 | Confident | 83.6 | Confident | 13 Ų | 13 | 87.7 Ų | 87.7 | 7% | 0.068 | 44% | 0.438 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -88 | 135.4 | 176.5 | -174.1 | 68.7 | 0 | 0 | 0 | 109.3 | P71 I74 K79 V83 S161 G162 P164 V167 Y168 | P71-L81 HydrophobicContact CG-CD1 3.51Å; I74-L81 HydrophobicContact CD1-CD2 4.42Å; K79-L81 PolarHBondContact O-N 3.36Å; L81-V83 HydrophobicContact CD1-CG2 4.38Å; L81-V83 HydrophobicContact CD2-CG2 3.61Å; L81-V83 HydrophobicContact CG-CG2 3.75Å; L81-S161 VanDerWaalsContact O-CA 3.31Å; L81-S161 WeakPolarHBondContact O-CA 3.44Å; L81-G162 PolarHBondContact N-O 3.41Å; L81-G162 PolarHBondContact O-N 3.08Å; L81-P164 HydrophobicContact CB-CG 4.35Å; L81-P164 HydrophobicContact CD2-CB 4.16Å; L81-V167 HydrophobicContact CB-CG2 4.38Å; L81-V167 HydrophobicContact CD2-CB 4.47Å; L81-V167 HydrophobicContact CD2-CG1 4.33Å; L81-V167 WeakPolarHBondContact O-CG2 3.35Å; L81-Y168 HydrophobicContact CD2-CE2 4.01Å |
| 82 | K | 88.8 | Confident | 84.6 | Confident | 172 Ų | 172 | 91.1 Ų | 91.1 | 75% | 0.748 | 45% | 0.453 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -116.1 | 113.8 | 170.1 | -70 | 178.7 | -179 | 172.3 | 0 | 108.1 | A160 | K82-A160 WeakPolarHBondContact CA-O 3.31Å |
| 83 | V | 90.2 | Very high | 85.3 | Confident | 3 Ų | 3 | 93.7 Ų | 93.7 | 2% | 0.018 | 46% | 0.457 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -113.1 | 137.4 | 178.3 | 177 | 0 | 0 | 0 | 0 | 109.4 | L81 K85 Q159 A160 V167 I171 | L81-V83 HydrophobicContact CD1-CG2 4.38Å; L81-V83 HydrophobicContact CD2-CG2 3.61Å; L81-V83 HydrophobicContact CG-CG2 3.75Å; V83-K85 HydrophobicContact CG1-CD 4.35Å; V83-K85 HydrophobicContact CG1-CG 4.11Å; V83-Q159 WeakPolarHBondContact O-CA 3.34Å; V83-A160 PolarHBondContact N-O 3.18Å; V83-A160 PolarHBondContact O-N 3.11Å; V83-V167 HydrophobicContact CB-CG1 3.64Å; V83-V167 HydrophobicContact CG2-CG1 3.54Å; V83-I171 HydrophobicContact CB-CD1 3.71Å; V83-I171 HydrophobicContact CG1-CD1 3.4Å |
| 84 | T | 92.3 | Very high | 85.7 | Confident | 40 Ų | 40 | 88.3 Ų | 88.3 | 25% | 0.245 | 44% | 0.438 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -120.7 | 122.2 | 172.8 | -69.7 | 0 | 0 | 0 | 0 | 109.1 | R157 I158 Q159 | T84-R157 HydrophobicContact CG2-CG 3.67Å; T84-I158 CarbonylContact C-O 3.26Å; T84-I158 VanDerWaalsContact CA-O 3.3Å; T84-I158 WeakPolarHBondContact CA-O 3.44Å; T84-Q159 HydrophobicContact CG2-CG 4.35Å; T84-Q159 PolarHBondContact OG1-NE2 3.46Å |
| 85 | K | 93.8 | Very high | 86.1 | Confident | 76 Ų | 76 | 90 Ų | 90 | 33% | 0.33 | 45% | 0.453 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -116.6 | 143.1 | 171.3 | -63.8 | -60.6 | -173.7 | -174.2 | 0 | 110.8 | E70 V83 R157 I158 I171 | E70-K85 WeakPolarHBondContact OE1-CE 3.14Å; E70-K85 IonicContact OE1-NZ 2.75Å; E70-K85 PolarHBondContact OE1-NZ 3.11Å; E70-K85 IonicContact OE2-NZ 3.78Å; E70-K85 PolarHBondContact OE2-NZ 3.32Å; V83-K85 HydrophobicContact CG1-CD 4.35Å; V83-K85 HydrophobicContact CG1-CG 4.11Å; K85-R157 WeakPolarHBondContact O-CA 3.49Å; K85-I158 PolarHBondContact N-O 2.61Å; K85-I158 PolarHBondContact O-N 3.09Å; K85-I171 HydrophobicContact CG-CD1 4.36Å; K85-I171 HydrophobicContact CG-CG2 4.34Å |
| 86 | K | 93.9 | Very high | 86.2 | Confident | 107 Ų | 107 | 92.1 Ų | 92.1 | 47% | 0.465 | 47% | 0.465 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -108.1 | 124 | 176.5 | -67.5 | 174.6 | 171 | -168.2 | 0 | 108.6 | E152 | K86-E152 VanDerWaalsContact NZ-CD 3.33Å; K86-E152 IonicContact NZ-OE1 2.65Å; K86-E152 PolarHBondContact NZ-OE1 3.35Å; K86-E152 VanDerWaalsContact NZ-OE1 3.08Å; K86-E152 IonicContact NZ-OE2 2.63Å; K86-E152 PolarHBondContact NZ-OE2 2.99Å |
| 87 | V | 94.3 | Very high | 86.5 | Confident | 28 Ų | 28 | 87 Ų | 87 | 17% | 0.17 | 44% | 0.437 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -109.5 | 117.9 | 179.4 | -176.1 | 0 | 0 | 0 | 0 | 109 | Q155 V156 I158 L175 L182 | V87-Q155 CarbonylContact O-C 3.55Å; V87-Q155 WeakPolarHBondContact O-CA 3.26Å; V87-Q155 VanDerWaalsContact O-CB 3.29Å; V87-Q155 WeakPolarHBondContact O-CB 3.48Å; V87-V156 PolarHBondContact N-O 3.17Å; V87-V156 PolarHBondContact O-N 2.98Å; V87-I158 HydrophobicContact CG2-CD1 3.76Å; V87-I158 HydrophobicContact CG2-CG1 4.32Å; V87-L175 HydrophobicContact CG2-CD2 3.63Å; V87-L182 HydrophobicContact CG1-CD1 3.57Å |
| 88 | L | 93.7 | Very high | 87.1 | Confident | 112 Ų | 112 | 84.6 Ų | 84.6 | 59% | 0.586 | 42% | 0.424 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -69.6 | 136.8 | 179.2 | -69.5 | 169.5 | 0 | 0 | 0 | 111.3 | K153 | L88-K153 HydrophobicContact CD2-CB 3.97Å; L88-K153 HydrophobicContact CD2-CD 4.5Å |
| 89 | I | 92.4 | Very high | 88.4 | Confident | 9 Ų | 9 | 77.2 Ų | 77.2 | 5% | 0.046 | 39% | 0.385 | C | S | . | . | trans | -91.6 | 127.1 | 172.9 | -54.1 | -166.6 | 0 | 0 | 0 | 108.6 | V91 F99 L154 V156 L182 | I89-V91 HydrophobicContact CB-CG1 4.44Å; I89-V91 HydrophobicContact CG2-CG1 3.95Å; I89-V91 PolarHBondContact O-N 2.99Å; I89-F99 HydrophobicContact CG2-CB 3.51Å; I89-F99 HydrophobicContact CG2-CD1 4.01Å; I89-F99 HydrophobicContact CG2-CD2 3.62Å; I89-F99 HydrophobicContact CG2-CE2 4.32Å; I89-F99 HydrophobicContact CG2-CG 3.43Å; I89-F99 VanDerWaalsContact CG2-CG 3.43Å; I89-L154 HydrophobicContact CB-CD2 4.1Å; I89-L154 HydrophobicContact CB-CG 4.19Å; I89-L154 HydrophobicContact CD1-CD2 3.93Å; I89-L154 HydrophobicContact CD1-CG 3.87Å; I89-L154 HydrophobicContact CG1-CD2 4.44Å; I89-L154 HydrophobicContact CG1-CG 4.22Å; I89-L154 HydrophobicContact CG2-CD2 4.17Å; I89-L154 PolarHBondContact N-O 3.34Å; I89-V156 HydrophobicContact CD1-CG2 3.74Å; I89-V156 HydrophobicContact CG1-CG2 4.08Å; I89-L182 HydrophobicContact CB-CD2 4.38Å; I89-L182 HydrophobicContact CD1-CD2 4.09Å; I89-L182 HydrophobicContact CG1-CD2 3.82Å; I89-L182 HydrophobicContact CG2-CD2 4.16Å | ||
| 90 | P | 89.8 | Confident | 89.1 | Confident | 34 Ų | 34 | 71.6 Ų | 71.6 | 22% | 0.221 | 36% | 0.361 | C | S | . | . | trans | -77.8 | 54.8 | -174.8 | 33.7 | -37.2 | 0 | 0 | 0 | 113 | D92 R93 H94 F99 L182 | P90-D92 PolarHBondContact O-N 3.48Å; P90-R93 PolarHBondContact O-N 3.1Å; P90-H94 PolarHBondContact O-N 3.16Å; P90-F99 HydrophobicContact CG-CE1 4.24Å; P90-F99 HydrophobicContact CG-CZ 4.1Å; P90-L182 WeakPolarHBondContact CG-O 3.44Å | ||
| 91 | V | 89 | Confident | 89.4 | Confident | 46 Ų | 46 | 68 Ų | 68 | 28% | 0.279 | 35% | 0.345 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -61.2 | -32.2 | 176.9 | -66.1 | 0 | 0 | 0 | 0 | 112.5 | I89 R93 H94 P95 F99 L154 | I89-V91 HydrophobicContact CB-CG1 4.44Å; I89-V91 HydrophobicContact CG2-CG1 3.95Å; I89-V91 PolarHBondContact O-N 2.99Å; V91-R93 PolarHBondContact O-N 3.03Å; V91-H94 CarbonylContact O-C 3.13Å; V91-H94 VanDerWaalsContact O-C 3.26Å; V91-H94 PolarHBondContact O-N 3.35Å; V91-P95 WeakPolarHBondContact O-CA 3.39Å; V91-P95 VanDerWaalsContact O-N 3.15Å; V91-F99 HydrophobicContact CG1-CD2 4.01Å; V91-F99 HydrophobicContact CG1-CE2 4.36Å; V91-L154 HydrophobicContact CG1-CB 4.48Å; V91-L154 HydrophobicContact CG1-CD2 3.54Å |
| 92 | D | 87.6 | Confident | 89.5 | Confident | 126 Ų | 126 | 67.9 Ų | 67.9 | 67% | 0.674 | 34% | 0.344 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63 | -31.4 | 179.9 | -61.7 | -27.7 | 0 | 0 | 0 | 111.9 | P90 K153 | P90-D92 PolarHBondContact O-N 3.48Å; D92-K153 IonicContact OD2-NZ 2.63Å |
| 93 | R | 87 | Confident | 89.6 | Confident | 203 Ų | 203 | 59.7 Ų | 59.7 | 77% | 0.766 | 31% | 0.308 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -84 | -29.6 | 180 | -61.9 | -176 | -171.1 | 166.3 | 2.3 | 112.7 | P90 V91 | P90-R93 PolarHBondContact O-N 3.1Å; V91-R93 PolarHBondContact O-N 3.03Å |
| 94 | H | 84.2 | Confident | 89.7 | Confident | 68 Ų | 68 | 63.3 Ų | 63.3 | 32% | 0.315 | 33% | 0.326 | S | S | . | . | trans | -137.6 | 71.5 | -176 | -57.5 | -74.5 | 0 | 0 | 0 | 110.8 | P90 V91 N96 F97 F99 A184 | P90-H94 PolarHBondContact O-N 3.16Å; V91-H94 CarbonylContact O-C 3.13Å; V91-H94 VanDerWaalsContact O-C 3.26Å; V91-H94 PolarHBondContact O-N 3.35Å; H94-N96 PolarHBondContact O-N 3.27Å; H94-F97 HydrophobicContact CB-CB 4.04Å; H94-F97 PolarHBondContact O-N 3.29Å; H94-F97 VanDerWaalsContact O-N 3.16Å; H94-F99 HydrophobicContact CB-CE2 4.16Å; H94-F99 HydrophobicContact CB-CZ 3.95Å; H94-A184 HydrophobicContact CB-CB 3.95Å | ||
| 95 | P | 85.3 | Confident | 89.5 | Confident | 101 Ų | 101 | 62.1 Ų | 62.1 | 66% | 0.656 | 32% | 0.322 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -65.4 | -23.2 | -175.6 | 25.2 | -35 | 0 | 0 | 0 | 113.4 | V91 F97 | V91-P95 WeakPolarHBondContact O-CA 3.39Å; V91-P95 VanDerWaalsContact O-N 3.15Å; P95-F97 VanDerWaalsContact C-N 3.32Å |
| 96 | N | 83.6 | Confident | 89.3 | Confident | 138 Ų | 138 | 60.1 Ų | 60.1 | 74% | 0.738 | 32% | 0.316 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -85.6 | -1.6 | -179.6 | -63.5 | -25.4 | 0 | 0 | 0 | 113.5 | H94 | H94-N96 PolarHBondContact O-N 3.27Š|
| 97 | F | 84.3 | Confident | 88.9 | Confident | 32 Ų | 32 | 59.6 Ų | 59.6 | 14% | 0.14 | 34% | 0.341 | C | S | . | . | S | Bend | trans | -104.6 | 129.6 | -176.1 | -172.8 | -97.9 | 0 | 0 | 0 | 111.6 | H94 P95 F99 K102 A184 | H94-F97 HydrophobicContact CB-CB 4.04Å; H94-F97 PolarHBondContact O-N 3.29Å; H94-F97 VanDerWaalsContact O-N 3.16Å; P95-F97 VanDerWaalsContact C-N 3.32Å; F97-F99 HydrophobicContact CB-CE2 4.2Å; F97-F99 HydrophobicContact CB-CZ 4.38Å; F97-F99 HydrophobicContact CD1-CB 4.44Å; F97-F99 AromaticContact CD1-CD1 3.45Å; F97-F99 HydrophobicContact CD1-CD1 3.45Å; F97-F99 VanDerWaalsContact CD1-CD1 3.45Å; F97-F99 AromaticContact CD1-CD2 3.81Å; F97-F99 HydrophobicContact CD1-CD2 3.81Å; F97-F99 AromaticContact CD1-CE1 3.45Å; F97-F99 HydrophobicContact CD1-CE1 3.45Å; F97-F99 VanDerWaalsContact CD1-CE1 3.45Å; F97-F99 AromaticContact CD1-CE2 3.82Å; F97-F99 HydrophobicContact CD1-CE2 3.82Å; F97-F99 AromaticContact CD1-CG 3.64Å; F97-F99 HydrophobicContact CD1-CG 3.64Å; F97-F99 AromaticContact CD1-CZ 3.66Å; F97-F99 HydrophobicContact CD1-CZ 3.66Å; F97-F99 AromaticContact CE1-CD1 3.53Å; F97-F99 HydrophobicContact CE1-CD1 3.53Å; F97-F99 AromaticContact CE1-CE1 3.73Å; F97-F99 HydrophobicContact CE1-CE1 3.73Å; F97-F99 HydrophobicContact CE1-CG 4.02Å; F97-F99 HydrophobicContact CE1-CZ 4.39Å; F97-F99 HydrophobicContact CG-CZ 4.41Å; F97-F99 WeakPolarHBondContact O-CD2 3.39Å; F97-F99 PolarHBondContact O-N 2.8Å; F97-K102 HydrophobicContact CE1-CD 4.08Å; F97-K102 HydrophobicContact CZ-CD 3.56Å; F97-A184 HydrophobicContact CB-CB 4.36Å; F97-A184 HydrophobicContact CD1-CB 4.07Å; F97-A184 HydrophobicContact CD2-CB 4.34Å; F97-A184 HydrophobicContact CE1-CB 4.39Å; F97-A184 HydrophobicContact CG-CB 4.01Å |
| 98 | N | 87.5 | Confident | 88.7 | Confident | 79 Ų | 79 | 59.5 Ų | 59.5 | 42% | 0.422 | 35% | 0.345 | S | S | . | . | trans | -89.2 | 82.5 | 179.1 | -172.4 | 3.8 | 0 | 0 | 0 | 111.7 | V100 G101 K102 | N98-V100 VanDerWaalsContact C-N 3.32Å; N98-V100 PolarHBondContact O-N 3.47Å; N98-V100 PolarHBondContact OD1-N 3.24Å; N98-G101 PolarHBondContact O-N 3.33Å; N98-G101 PolarHBondContact OD1-N 3.32Å; N98-K102 PolarHBondContact O-N 3.46Å; N98-K102 VanDerWaalsContact O-N 3.13Å | ||
| 99 | F | 90.7 | Very high | 88.6 | Confident | 3 Ų | 3 | 55.3 Ų | 55.3 | 1% | 0.013 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -58.4 | -42 | 175.5 | -63.9 | -81 | 0 | 0 | 0 | 112.7 | I89 P90 V91 H94 F97 K102 L103 L182 A184 | I89-F99 HydrophobicContact CG2-CB 3.51Å; I89-F99 HydrophobicContact CG2-CD1 4.01Å; I89-F99 HydrophobicContact CG2-CD2 3.62Å; I89-F99 HydrophobicContact CG2-CE2 4.32Å; I89-F99 HydrophobicContact CG2-CG 3.43Å; I89-F99 VanDerWaalsContact CG2-CG 3.43Å; P90-F99 HydrophobicContact CG-CE1 4.24Å; P90-F99 HydrophobicContact CG-CZ 4.1Å; V91-F99 HydrophobicContact CG1-CD2 4.01Å; V91-F99 HydrophobicContact CG1-CE2 4.36Å; H94-F99 HydrophobicContact CB-CE2 4.16Å; H94-F99 HydrophobicContact CB-CZ 3.95Å; F97-F99 HydrophobicContact CB-CE2 4.2Å; F97-F99 HydrophobicContact CB-CZ 4.38Å; F97-F99 HydrophobicContact CD1-CB 4.44Å; F97-F99 AromaticContact CD1-CD1 3.45Å; F97-F99 HydrophobicContact CD1-CD1 3.45Å; F97-F99 VanDerWaalsContact CD1-CD1 3.45Å; F97-F99 AromaticContact CD1-CD2 3.81Å; F97-F99 HydrophobicContact CD1-CD2 3.81Å; F97-F99 AromaticContact CD1-CE1 3.45Å; F97-F99 HydrophobicContact CD1-CE1 3.45Å; F97-F99 VanDerWaalsContact CD1-CE1 3.45Å; F97-F99 AromaticContact CD1-CE2 3.82Å; F97-F99 HydrophobicContact CD1-CE2 3.82Å; F97-F99 AromaticContact CD1-CG 3.64Å; F97-F99 HydrophobicContact CD1-CG 3.64Å; F97-F99 AromaticContact CD1-CZ 3.66Å; F97-F99 HydrophobicContact CD1-CZ 3.66Å; F97-F99 AromaticContact CE1-CD1 3.53Å; F97-F99 HydrophobicContact CE1-CD1 3.53Å; F97-F99 AromaticContact CE1-CE1 3.73Å; F97-F99 HydrophobicContact CE1-CE1 3.73Å; F97-F99 HydrophobicContact CE1-CG 4.02Å; F97-F99 HydrophobicContact CE1-CZ 4.39Å; F97-F99 HydrophobicContact CG-CZ 4.41Å; F97-F99 WeakPolarHBondContact O-CD2 3.39Å; F97-F99 PolarHBondContact O-N 2.8Å; F99-K102 PolarHBondContact O-N 2.94Å; F99-L103 VanDerWaalsContact O-CB 3.23Å; F99-L103 WeakPolarHBondContact O-CB 3.45Å; F99-L103 PolarHBondContact O-N 3.5Å; F99-L182 VanDerWaalsContact CE1-O 3.32Å; F99-L182 WeakPolarHBondContact CE1-O 3.43Å; F99-A184 HydrophobicContact CE1-CB 4Å; F99-A184 HydrophobicContact CZ-CB 3.93Å |
| 100 | V | 91.1 | Very high | 88.6 | Confident | 14 Ų | 14 | 55.6 Ų | 55.6 | 9% | 0.085 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -65.6 | -42.7 | -177.2 | -178.1 | 0 | 0 | 0 | 0 | 110.8 | N98 L103 M104 V124 L154 | N98-V100 VanDerWaalsContact C-N 3.32Å; N98-V100 PolarHBondContact O-N 3.47Å; N98-V100 PolarHBondContact OD1-N 3.24Å; V100-L103 PolarHBondContact O-N 3.16Å; V100-M104 HydrophobicContact CG1-CE 3.67Å; V100-M104 HydrophobicContact CG1-CG 4.33Å; V100-M104 HydrophobicContact CG1-SD 4.28Å; V100-M104 WeakPolarHBondContact O-CB 3.32Å; V100-M104 WeakPolarHBondContact O-CG 3.39Å; V100-M104 PolarHBondContact O-N 3.42Å; V100-V124 HydrophobicContact CG1-CG1 4.2Å; V100-V124 HydrophobicContact CG2-CG1 4.05Å; V100-L154 HydrophobicContact CG2-CD1 4.17Å; V100-L154 HydrophobicContact CG2-CD2 3.84Å |
| 101 | G | 89.5 | Confident | 88.8 | Confident | 25 Ų | 25 | 54.9 Ų | 54.9 | 26% | 0.258 | 33% | 0.326 | S | S | . | . | H | α-helix | trans | -62.3 | -46.9 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | N98 L103 G105 | N98-G101 PolarHBondContact O-N 3.33Å; N98-G101 PolarHBondContact OD1-N 3.32Å; G101-L103 VanDerWaalsContact C-N 3.33Å; G101-L103 PolarHBondContact O-N 2.92Å; G101-G105 PolarHBondContact O-N 3.05Å |
| 102 | K | 89.5 | Confident | 89.1 | Confident | 9 Ų | 9 | 58.8 Ų | 58.8 | 4% | 0.039 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -62.2 | -40.5 | 176.2 | -175.8 | 176 | 174.6 | -176.6 | 0 | 111.9 | F97 N98 F99 P180 Y181 D192 I194 V195 Q198 | F97-K102 HydrophobicContact CE1-CD 4.08Å; F97-K102 HydrophobicContact CZ-CD 3.56Å; N98-K102 PolarHBondContact O-N 3.46Å; N98-K102 VanDerWaalsContact O-N 3.13Å; F99-K102 PolarHBondContact O-N 2.94Å; K102-P180 PolarHBondContact NZ-O 3.46Å; K102-Y181 HydrophobicContact CG-CD1 4.11Å; K102-D192 VanDerWaalsContact CE-OD1 3.31Å; K102-D192 WeakPolarHBondContact CE-OD1 3.03Å; K102-D192 VanDerWaalsContact CE-OD2 3.28Å; K102-D192 WeakPolarHBondContact CE-OD2 3.48Å; K102-D192 IonicContact NZ-OD1 3.08Å; K102-D192 PolarHBondContact NZ-OD1 3.44Å; K102-D192 IonicContact NZ-OD2 2.95Å; K102-D192 PolarHBondContact NZ-OD2 3.25Å; K102-I194 HydrophobicContact CG-CG2 3.94Å; K102-V195 HydrophobicContact CD-CG2 4.17Å; K102-V195 HydrophobicContact CG-CG2 4.3Å; K102-Q198 PolarHBondContact O-NE2 3.3Å |
| 103 | L | 92.3 | Very high | 89.4 | Confident | 1 Ų | 1 | 58.1 Ų | 58.1 | 1% | 0.005 | 33% | 0.331 | C | S | . | . | H | α-helix | trans | -71.7 | -43.2 | -179.3 | -178.7 | 61.6 | 0 | 0 | 0 | 112.8 | F99 V100 G101 L111 M114 V124 V156 L178 Y181 | F99-L103 VanDerWaalsContact O-CB 3.23Å; F99-L103 WeakPolarHBondContact O-CB 3.45Å; F99-L103 PolarHBondContact O-N 3.5Å; V100-L103 PolarHBondContact O-N 3.16Å; G101-L103 VanDerWaalsContact C-N 3.33Å; G101-L103 PolarHBondContact O-N 2.92Å; L103-L111 HydrophobicContact CD1-CD1 4.23Å; L103-L111 HydrophobicContact CD2-CD1 4.48Å; L103-L111 HydrophobicContact CG-CD1 4.11Å; L103-L111 PolarHBondContact O-N 3.39Å; L103-M114 HydrophobicContact CD1-CE 4.31Å; L103-M114 HydrophobicContact CD1-SD 4.49Å; L103-V124 HydrophobicContact CD2-CG2 3.93Å; L103-V156 HydrophobicContact CD2-CG2 3.61Å; L103-L178 HydrophobicContact CD1-CD2 3.52Å; L103-L178 HydrophobicContact CD2-CD2 4.36Å; L103-Y181 HydrophobicContact CD1-CD1 4.17Å; L103-Y181 HydrophobicContact CD1-CD2 4.5Å; L103-Y181 HydrophobicContact CD1-CG 3.94Å |
| 104 | M | 91.8 | Very high | 89.8 | Confident | 79 Ų | 79 | 49 Ų | 49 | 39% | 0.389 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -72.4 | -39.7 | 178.6 | -70.9 | -161.6 | -60.5 | 0 | 0 | 112.3 | V100 G108 G109 T110 L111 | V100-M104 HydrophobicContact CG1-CE 3.67Å; V100-M104 HydrophobicContact CG1-CG 4.33Å; V100-M104 HydrophobicContact CG1-SD 4.28Å; V100-M104 WeakPolarHBondContact O-CB 3.32Å; V100-M104 WeakPolarHBondContact O-CG 3.39Å; V100-M104 PolarHBondContact O-N 3.42Å; M104-G108 CarbonylContact O-C 3.59Å; M104-G108 WeakPolarHBondContact O-CA 3.4Å; M104-G109 PolarHBondContact O-N 3.01Å; M104-T110 WeakPolarHBondContact O-CB 3.47Å; M104-T110 PolarHBondContact O-N 3.17Å; M104-L111 HydrophobicContact CG-CD2 4.44Å; M104-L111 PolarHBondContact O-N 3.34Å |
| 105 | G | 88.2 | Confident | 90.3 | Very high | 15 Ų | 15 | 48.3 Ų | 48.3 | 16% | 0.155 | 29% | 0.293 | C | S | . | . | trans | 65.9 | -173.1 | -173.1 | 0 | 0 | 0 | 0 | 0 | 113.3 | G101 G107 G108 | G101-G105 PolarHBondContact O-N 3.05Å; G105-G107 PolarHBondContact O-N 3.02Å; G105-G108 PolarHBondContact O-N 3.4Å | ||
| 106 | P | 89.4 | Confident | 90.8 | Very high | 34 Ų | 34 | 49.7 Ų | 49.7 | 22% | 0.221 | 29% | 0.291 | C | S | . | . | G | 310 helix | trans | -63.4 | 124.6 | -178.9 | 27.3 | -34.3 | 0 | 0 | 0 | 110.9 | G108 G109 L202 | P106-G108 PolarHBondContact O-N 3.26Å; P106-G109 PolarHBondContact O-N 3.16Å; P106-L202 HydrophobicContact CB-CD1 4.26Å; P106-L202 HydrophobicContact CB-CD2 3.52Å; P106-L202 HydrophobicContact CB-CG 3.75Å; P106-L202 HydrophobicContact CG-CG 4.37Å |
| 107 | G | 86.3 | Confident | 91.3 | Very high | 95 Ų | 95 | 50.3 Ų | 50.3 | 98% | 0.979 | 29% | 0.287 | S | S | * | . | G | 310 helix | trans | 62.2 | 12.5 | -179.4 | 0 | 0 | 0 | 0 | 0 | 115.4 | G105 G109 | G105-G107 PolarHBondContact O-N 3.02Å; G107-G109 VanDerWaalsContact C-N 3.27Å |
| 108 | G | 89.5 | Confident | 91.8 | Very high | 26 Ų | 26 | 49.6 Ų | 49.6 | 27% | 0.268 | 29% | 0.285 | S | S | . | . | G | 310 helix | trans | 78.3 | 8.6 | -172.8 | 0 | 0 | 0 | 0 | 0 | 114.3 | M104 G105 P106 T110 L111 K112 | M104-G108 CarbonylContact O-C 3.59Å; M104-G108 WeakPolarHBondContact O-CA 3.4Å; G105-G108 PolarHBondContact O-N 3.4Å; P106-G108 PolarHBondContact O-N 3.26Å; G108-T110 VanDerWaalsContact C-N 3.34Å; G108-T110 PolarHBondContact O-N 3Å; G108-L111 PolarHBondContact O-N 3.03Å; G108-K112 WeakPolarHBondContact O-CB 3.31Å; G108-K112 PolarHBondContact O-N 2.79Å; G108-K112 VanDerWaalsContact O-N 3.11Å |
| 109 | G | 92 | Very high | 92.1 | Very high | 25 Ų | 25 | 47.9 Ų | 47.9 | 26% | 0.258 | 29% | 0.285 | S | S | . | . | H | α-helix | trans | -63.9 | -35.5 | -175 | 0 | 0 | 0 | 0 | 0 | 113.5 | M104 P106 G107 K112 K113 | M104-G109 PolarHBondContact O-N 3.01Å; P106-G109 PolarHBondContact O-N 3.16Å; G107-G109 VanDerWaalsContact C-N 3.27Å; G109-K112 PolarHBondContact O-N 3.27Å; G109-K113 WeakPolarHBondContact O-CB 3.38Å; G109-K113 WeakPolarHBondContact O-CG 3.41Å; G109-K113 PolarHBondContact O-N 2.86Å |
| 110 | T | 92.5 | Very high | 92.3 | Very high | 14 Ų | 14 | 48.1 Ų | 48.1 | 9% | 0.086 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -66.9 | -47.9 | -179.9 | -56.5 | 0 | 0 | 0 | 0 | 111.4 | M104 G108 K112 K113 M114 Y181 Q198 | M104-T110 WeakPolarHBondContact O-CB 3.47Å; M104-T110 PolarHBondContact O-N 3.17Å; G108-T110 VanDerWaalsContact C-N 3.34Å; G108-T110 PolarHBondContact O-N 3Å; T110-K112 VanDerWaalsContact C-N 3.33Å; T110-K112 PolarHBondContact O-N 3.37Å; T110-K113 PolarHBondContact O-N 2.81Å; T110-M114 WeakPolarHBondContact O-CB 3.4Å; T110-M114 PolarHBondContact O-N 3.41Å; T110-Y181 HydrophobicContact CG2-CE1 3.65Å; T110-Y181 WeakPolarHBondContact CG2-OH 3.23Å; T110-Q198 PolarHBondContact OG1-NE2 3.16Å |
| 111 | L | 93.9 | Very high | 92.6 | Very high | 19 Ų | 19 | 53 Ų | 53 | 10% | 0.099 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -62.7 | -41.8 | 177.4 | -174 | 67.3 | 0 | 0 | 0 | 111.2 | L103 M104 G108 M114 Q115 L122 | L103-L111 HydrophobicContact CD1-CD1 4.23Å; L103-L111 HydrophobicContact CD2-CD1 4.48Å; L103-L111 HydrophobicContact CG-CD1 4.11Å; L103-L111 PolarHBondContact O-N 3.39Å; M104-L111 HydrophobicContact CG-CD2 4.44Å; M104-L111 PolarHBondContact O-N 3.34Å; G108-L111 PolarHBondContact O-N 3.03Å; L111-M114 PolarHBondContact O-N 2.9Å; L111-Q115 WeakPolarHBondContact O-CG 3.2Å; L111-Q115 PolarHBondContact O-N 3.31Å; L111-L122 HydrophobicContact CD1-CB 3.74Å; L111-L122 HydrophobicContact CD1-CD1 3.87Å; L111-L122 HydrophobicContact CD1-CG 4.47Å; L111-L122 HydrophobicContact CG-CB 4.45Å |
| 112 | K | 94.7 | Very high | 92.9 | Very high | 128 Ų | 128 | 52 Ų | 52 | 56% | 0.557 | 30% | 0.296 | S | S | * | . | H | α-helix | trans | -63.7 | -46.9 | 177.8 | -171.7 | 178.7 | 175.4 | -174 | 0 | 112.3 | G108 G109 T110 M114 Q115 E116 | G108-K112 WeakPolarHBondContact O-CB 3.31Å; G108-K112 PolarHBondContact O-N 2.79Å; G108-K112 VanDerWaalsContact O-N 3.11Å; G109-K112 PolarHBondContact O-N 3.27Å; T110-K112 VanDerWaalsContact C-N 3.33Å; T110-K112 PolarHBondContact O-N 3.37Å; K112-M114 VanDerWaalsContact C-N 3.29Å; K112-M114 PolarHBondContact O-N 3.31Å; K112-Q115 WeakPolarHBondContact O-CB 3.48Å; K112-Q115 PolarHBondContact O-N 3.09Å; K112-E116 WeakPolarHBondContact CE-OE1 3.45Å; K112-E116 WeakPolarHBondContact O-CG 3.49Å; K112-E116 PolarHBondContact O-N 3.25Å |
| 113 | K | 94.3 | Very high | 93.1 | Very high | 113 Ų | 113 | 53.3 Ų | 53.3 | 49% | 0.491 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -56.7 | -43.5 | 174.9 | -75.7 | 172 | -178.2 | 177.8 | 0 | 111.2 | G109 T110 E116 K117 E201 | G109-K113 WeakPolarHBondContact O-CB 3.38Å; G109-K113 WeakPolarHBondContact O-CG 3.41Å; G109-K113 PolarHBondContact O-N 2.86Å; T110-K113 PolarHBondContact O-N 2.81Å; K113-E116 PolarHBondContact O-N 3.34Å; K113-K117 WeakPolarHBondContact O-CB 3.25Å; K113-K117 PolarHBondContact O-N 2.83Å; K113-E201 IonicContact NZ-OE1 3.02Å; K113-E201 PolarHBondContact NZ-OE1 3.1Å; K113-E201 IonicContact NZ-OE2 3.95Å |
| 114 | M | 94.6 | Very high | 93.2 | Very high | 10 Ų | 10 | 54.6 Ų | 54.6 | 5% | 0.049 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -63.9 | -42.9 | 177.9 | -175.4 | -174.9 | -70.6 | 0 | 0 | 112 | L103 T110 L111 K112 K117 L118 L122 E177 L178 Y181 | L103-M114 HydrophobicContact CD1-CE 4.31Å; L103-M114 HydrophobicContact CD1-SD 4.49Å; T110-M114 WeakPolarHBondContact O-CB 3.4Å; T110-M114 PolarHBondContact O-N 3.41Å; L111-M114 PolarHBondContact O-N 2.9Å; K112-M114 VanDerWaalsContact C-N 3.29Å; K112-M114 PolarHBondContact O-N 3.31Å; M114-K117 PolarHBondContact O-N 2.94Å; M114-L118 HydrophobicContact CG-CD1 3.73Å; M114-L118 WeakPolarHBondContact O-CB 3.44Å; M114-L118 WeakPolarHBondContact O-CG 3.46Å; M114-L118 PolarHBondContact O-N 2.78Å; M114-L118 VanDerWaalsContact O-N 3.12Å; M114-L122 HydrophobicContact CB-CD1 4.32Å; M114-L122 HydrophobicContact CG-CD1 3.76Å; M114-L122 HydrophobicContact SD-CD1 3.47Å; M114-L122 WeakPolarHBondContact SD-CD1 3.36Å; M114-E177 HydrophobicContact CE-CB 4.44Å; M114-E177 HydrophobicContact SD-CB 4.48Å; M114-L178 HydrophobicContact CE-CD2 4.34Å; M114-L178 HydrophobicContact SD-CD2 3.66Å; M114-L178 HydrophobicContact SD-CG 4.1Å; M114-Y181 HydrophobicContact CE-CD2 3.58Å; M114-Y181 HydrophobicContact CE-CE1 4.5Å; M114-Y181 HydrophobicContact CE-CE2 3.18Å; M114-Y181 HydrophobicContact CE-CG 4.38Å |
| 115 | Q | 95.4 | Very high | 93.2 | Very high | 54 Ų | 54 | 52.4 Ų | 52.4 | 25% | 0.252 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -61.5 | -43.6 | 175.9 | -74.4 | -177.6 | -114.5 | 0 | 0 | 112.8 | L111 K112 G119 V120 L122 | L111-Q115 WeakPolarHBondContact O-CG 3.2Å; L111-Q115 PolarHBondContact O-N 3.31Å; K112-Q115 WeakPolarHBondContact O-CB 3.48Å; K112-Q115 PolarHBondContact O-N 3.09Å; Q115-G119 WeakPolarHBondContact O-CA 3.27Å; Q115-G119 PolarHBondContact O-N 2.66Å; Q115-V120 WeakPolarHBondContact CA-O 3.39Å; Q115-V120 WeakPolarHBondContact CB-O 3.41Å; Q115-V120 WeakPolarHBondContact CG-O 3.47Å; Q115-V120 PolarHBondContact O-N 3.5Å; Q115-L122 HydrophobicContact CG-CB 3.67Å; Q115-L122 HydrophobicContact CG-CD1 3.96Å; Q115-L122 HydrophobicContact CG-CG 3.74Å; Q115-L122 PolarHBondContact OE1-O 2.87Å |
| 116 | E | 95.3 | Very high | 93.5 | Very high | 131 Ų | 131 | 51.7 Ų | 51.7 | 61% | 0.612 | 30% | 0.296 | S | S | * | . | H | α-helix | trans | -65.6 | -43.8 | 178 | -72 | 172 | -175.2 | 0 | 0 | 111.6 | K112 K113 L118 G119 | K112-E116 WeakPolarHBondContact CE-OE1 3.45Å; K112-E116 WeakPolarHBondContact O-CG 3.49Å; K112-E116 PolarHBondContact O-N 3.25Å; K113-E116 PolarHBondContact O-N 3.34Å; E116-L118 PolarHBondContact O-N 2.84Å; E116-G119 PolarHBondContact O-N 3Å |
| 117 | K | 94.9 | Very high | 93.5 | Very high | 151 Ų | 151 | 58.9 Ų | 58.9 | 66% | 0.657 | 32% | 0.319 | S | S | * | . | H | α-helix | trans | -60.6 | -43.7 | 178.9 | -174.8 | -176.8 | -179.5 | -171.4 | 0 | 112.6 | K113 M114 E177 | K113-K117 WeakPolarHBondContact O-CB 3.25Å; K113-K117 PolarHBondContact O-N 2.83Å; M114-K117 PolarHBondContact O-N 2.94Å; K117-E177 WeakPolarHBondContact CE-OE1 3.49Å; K117-E177 IonicContact NZ-OE1 2.71Å; K117-E177 PolarHBondContact NZ-OE1 2.97Å |
| 118 | L | 94.2 | Very high | 93.6 | Very high | 17 Ų | 17 | 56.4 Ų | 56.4 | 9% | 0.089 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -89.1 | -17.5 | -174.7 | -67.2 | 169.3 | 0 | 0 | 0 | 113.3 | M114 E116 V120 D173 A174 E177 | M114-L118 HydrophobicContact CG-CD1 3.73Å; M114-L118 WeakPolarHBondContact O-CB 3.44Å; M114-L118 WeakPolarHBondContact O-CG 3.46Å; M114-L118 PolarHBondContact O-N 2.78Å; M114-L118 VanDerWaalsContact O-N 3.12Å; E116-L118 PolarHBondContact O-N 2.84Å; L118-V120 VanDerWaalsContact C-N 3.29Å; L118-V120 HydrophobicContact CB-CG1 4.31Å; L118-V120 HydrophobicContact CB-CG2 3.75Å; L118-V120 HydrophobicContact CD1-CG2 4.15Å; L118-V120 PolarHBondContact O-N 2.86Å; L118-D173 HydrophobicContact CD2-CB 3.59Å; L118-A174 HydrophobicContact CD1-CB 3.76Å; L118-E177 HydrophobicContact CD1-CB 4.22Å; L118-E177 HydrophobicContact CD1-CG 4.28Å; L118-E177 HydrophobicContact CD2-CG 4.06Å; L118-E177 HydrophobicContact CG-CG 4.49Å |
| 119 | G | 94.3 | Very high | 93.6 | Very high | 42 Ų | 42 | 56.3 Ų | 56.3 | 43% | 0.433 | 29% | 0.289 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 62.4 | 37.2 | -172.4 | 0 | 0 | 0 | 0 | 0 | 112.7 | Q115 E116 | Q115-G119 WeakPolarHBondContact O-CA 3.27Å; Q115-G119 PolarHBondContact O-N 2.66Å; E116-G119 PolarHBondContact O-N 3Å |
| 120 | V | 95.7 | Very high | 93.5 | Very high | 9 Ų | 9 | 57.8 Ų | 57.8 | 6% | 0.055 | 29% | 0.289 | C | S | . | . | trans | -125.7 | 155.8 | 177.9 | -56.4 | 0 | 0 | 0 | 0 | 111 | Q115 L118 L122 I158 A160 K170 A174 | Q115-V120 WeakPolarHBondContact CA-O 3.39Å; Q115-V120 WeakPolarHBondContact CB-O 3.41Å; Q115-V120 WeakPolarHBondContact CG-O 3.47Å; Q115-V120 PolarHBondContact O-N 3.5Å; L118-V120 VanDerWaalsContact C-N 3.29Å; L118-V120 HydrophobicContact CB-CG1 4.31Å; L118-V120 HydrophobicContact CB-CG2 3.75Å; L118-V120 HydrophobicContact CD1-CG2 4.15Å; L118-V120 PolarHBondContact O-N 2.86Å; V120-L122 HydrophobicContact CG2-CD2 3.86Å; V120-L122 HydrophobicContact CG2-CG 3.98Å; V120-I158 HydrophobicContact CB-CG2 4.43Å; V120-I158 HydrophobicContact CG2-CG2 4.37Å; V120-A160 HydrophobicContact CG1-CB 3.96Å; V120-K170 HydrophobicContact CG1-CB 3.7Å; V120-K170 HydrophobicContact CG1-CD 4.2Å; V120-K170 HydrophobicContact CG1-CG 4.33Å; V120-A174 HydrophobicContact CG2-CB 4.26Å | ||
| 121 | K | 95.6 | Very high | 93.1 | Very high | 116 Ų | 116 | 66.8 Ų | 66.8 | 50% | 0.504 | 32% | 0.322 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -94.6 | 116.7 | 172.7 | -180 | 173.2 | 176.2 | -177.3 | 0 | 109.5 | Q159 | K121-Q159 HydrophobicContact CB-CB 4.21Å; K121-Q159 PolarHBondContact N-O 2.98Å; K121-Q159 PolarHBondContact O-N 3.42Å |
| 122 | L | 95.7 | Very high | 92.8 | Very high | 3 Ų | 3 | 68.4 Ų | 68.4 | 2% | 0.016 | 33% | 0.332 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -103.5 | 137.7 | 176 | -59.8 | 176.9 | 0 | 0 | 0 | 109.2 | L111 M114 Q115 V120 R157 I158 L178 | L111-L122 HydrophobicContact CD1-CB 3.74Å; L111-L122 HydrophobicContact CD1-CD1 3.87Å; L111-L122 HydrophobicContact CD1-CG 4.47Å; L111-L122 HydrophobicContact CG-CB 4.45Å; M114-L122 HydrophobicContact CB-CD1 4.32Å; M114-L122 HydrophobicContact CG-CD1 3.76Å; M114-L122 HydrophobicContact SD-CD1 3.47Å; M114-L122 WeakPolarHBondContact SD-CD1 3.36Å; Q115-L122 HydrophobicContact CG-CB 3.67Å; Q115-L122 HydrophobicContact CG-CD1 3.96Å; Q115-L122 HydrophobicContact CG-CG 3.74Å; Q115-L122 PolarHBondContact OE1-O 2.87Å; V120-L122 HydrophobicContact CG2-CD2 3.86Å; V120-L122 HydrophobicContact CG2-CG 3.98Å; L122-R157 CarbonylContact C-O 3.43Å; L122-R157 WeakPolarHBondContact CA-O 3.49Å; L122-I158 HydrophobicContact CD2-CB 4.16Å; L122-I158 HydrophobicContact CD2-CG1 3.75Å; L122-I158 HydrophobicContact CD2-CG2 4.04Å; L122-L178 HydrophobicContact CD2-CD1 4.34Å |
| 123 | S | 94.1 | Very high | 92.4 | Very high | 38 Ų | 38 | 65.5 Ų | 65.5 | 27% | 0.266 | 33% | 0.332 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -145.1 | 125.6 | 176 | -64.7 | 0 | 0 | 0 | 0 | 110.4 | R157 | S123-R157 PolarHBondContact N-O 3.4Å; S123-R157 PolarHBondContact O-N 3.32Å |
| 124 | V | 94.5 | Very high | 92.1 | Very high | 28 Ų | 28 | 63.3 Ų | 63.3 | 17% | 0.17 | 33% | 0.331 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -77.3 | 126.1 | 171.5 | -175.4 | 0 | 0 | 0 | 0 | 107.8 | V100 L103 L154 | V100-V124 HydrophobicContact CG1-CG1 4.2Å; V100-V124 HydrophobicContact CG2-CG1 4.05Å; L103-V124 HydrophobicContact CD2-CG2 3.93Å; V124-L154 HydrophobicContact CG1-CD1 4.04Å |
| 125 | M | 92.6 | Very high | 91.8 | Very high | 33 Ų | 33 | 67.5 Ų | 67.5 | 16% | 0.163 | 35% | 0.351 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -136.9 | 162.2 | -175.6 | -62.7 | -169.8 | 83.6 | 0 | 0 | 109.4 | H149 Q155 R157 | M125-H149 HydrophobicContact CE-CB 3.64Å; M125-H149 VanDerWaalsContact CE-CG 3.48Å; M125-Q155 HydrophobicContact CB-CG 4.22Å; M125-Q155 PolarHBondContact N-O 3.2Å; M125-Q155 PolarHBondContact O-N 2.95Å; M125-R157 HydrophobicContact CG-CB 4.39Å; M125-R157 HydrophobicContact SD-CB 3.88Å; M125-R157 WeakPolarHBondContact SD-CD 3.32Å; M125-R157 HydrophobicContact SD-CG 4.32Å |
| 126 | G | 93 | Very high | 91.5 | Very high | 0 Ų | 0 | 65.5 Ų | 65.5 | 0% | 0 | 34% | 0.341 | C | S | . | . | S | Bend | trans | 106.4 | 178.1 | 177.2 | 0 | 0 | 0 | 0 | 0 | 113.4 | G128 S129 H149 E152 | G126-G128 PolarHBondContact O-N 3.44Å; G126-S129 WeakPolarHBondContact O-CB 3.47Å; G126-S129 PolarHBondContact O-N 2.89Å; G126-S129 VanDerWaalsContact O-N 3.16Å; G126-S129 PolarHBondContact O-OG 2.82Å; G126-H149 VanDerWaalsContact CA-O 3.26Å; G126-H149 WeakPolarHBondContact CA-O 3.24Å; G126-E152 WeakPolarHBondContact CA-O 3.49Å |
| 127 | R | 90.7 | Very high | 91.1 | Very high | 184 Ų | 184 | 64.1 Ų | 64.1 | 69% | 0.694 | 34% | 0.338 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -60.6 | 131.1 | 175.6 | -169.2 | 179.9 | 179.5 | -175.1 | -0.6 | 111.2 | S129 E136 L150 E152 L154 | R127-S129 VanDerWaalsContact C-N 3.3Å; R127-E136 WeakPolarHBondContact CA-OE1 3.19Å; R127-E136 WeakPolarHBondContact CG-OE1 3.23Å; R127-L150 WeakPolarHBondContact CA-O 3.3Å; R127-L150 WeakPolarHBondContact CB-O 3.46Å; R127-L150 PolarHBondContact N-O 3.14Å; R127-E152 PolarHBondContact N-O 3.03Å; R127-L154 WeakPolarHBondContact O-CB 3.26Å |
| 128 | G | 89 | Confident | 90.9 | Very high | 43 Ų | 43 | 63.2 Ų | 63.2 | 44% | 0.443 | 34% | 0.336 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 77.3 | 10.5 | -176 | 0 | 0 | 0 | 0 | 0 | 114.6 | G126 M130 E136 | G126-G128 PolarHBondContact O-N 3.44Å; G128-M130 VanDerWaalsContact C-N 3.3Å; G128-E136 VanDerWaalsContact CA-OE2 3.23Å; G128-E136 WeakPolarHBondContact CA-OE2 3.44Å; G128-E136 VanDerWaalsContact N-CD 3.3Å; G128-E136 PolarHBondContact N-OE1 3.41Å; G128-E136 PolarHBondContact N-OE2 2.8Å |
| 129 | S | 89.4 | Confident | 90.6 | Very high | 24 Ų | 24 | 63.5 Ų | 63.5 | 17% | 0.168 | 34% | 0.34 | C | S | . | . | trans | -73.7 | -24.3 | 172.6 | 60.4 | 0 | 0 | 0 | 0 | 112.2 | G126 R127 | G126-S129 WeakPolarHBondContact O-CB 3.47Å; G126-S129 PolarHBondContact O-N 2.89Å; G126-S129 VanDerWaalsContact O-N 3.16Å; G126-S129 PolarHBondContact O-OG 2.82Å; R127-S129 VanDerWaalsContact C-N 3.3Å | ||
| 130 | M | 88.5 | Confident | 90.2 | Very high | 56 Ų | 56 | 64.4 Ų | 64.4 | 28% | 0.276 | 33% | 0.334 | S | S | . | . | S | Bend | trans | -84.1 | 143.3 | 175.8 | -66.3 | -173.7 | 67.7 | 0 | 0 | 111 | G128 V132 Q135 E136 C139 L150 | G128-M130 VanDerWaalsContact C-N 3.3Å; M130-V132 PolarHBondContact O-N 3.24Å; M130-Q135 HydrophobicContact CE-CB 3.89Å; M130-E136 HydrophobicContact CB-CB 4.19Å; M130-E136 HydrophobicContact CB-CG 4.44Å; M130-E136 HydrophobicContact CG-CB 4.49Å; M130-E136 HydrophobicContact CG-CG 4.44Å; M130-E136 PolarHBondContact N-OE2 2.8Å; M130-E136 HydrophobicContact SD-CB 4.04Å; M130-E136 HydrophobicContact SD-CG 4.19Å; M130-C139 HydrophobicContact SD-CB 4.49Å; M130-L150 HydrophobicContact CG-CD2 4.31Å; M130-L150 HydrophobicContact SD-CD1 4.12Å; M130-L150 HydrophobicContact SD-CD2 4.39Å |
| 131 | R | 84.5 | Confident | 89.9 | Confident | 203 Ų | 203 | 67.9 Ų | 67.9 | 77% | 0.766 | 36% | 0.364 | S | S | * | . | S | Bend | trans | -61.4 | -31 | 178.2 | 179.2 | 177 | 171 | 177.9 | -1.3 | 112.8 | ||
| 132 | V | 87.6 | Confident | 89.6 | Confident | 53 Ų | 53 | 65.2 Ų | 65.2 | 32% | 0.321 | 36% | 0.36 | S | S | . | . | trans | -120.9 | 112.7 | -173.5 | -175.4 | 0 | 0 | 0 | 0 | 109 | M130 S134 Q135 E136 | M130-V132 PolarHBondContact O-N 3.24Å; V132-S134 VanDerWaalsContact C-N 3.3Å; V132-S134 VanDerWaalsContact CG1-OG 3.25Å; V132-S134 WeakPolarHBondContact CG1-OG 3.1Å; V132-S134 PolarHBondContact O-N 2.83Å; V132-Q135 HydrophobicContact CB-CB 4.3Å; V132-Q135 HydrophobicContact CB-CG 4.1Å; V132-Q135 HydrophobicContact CG1-CB 4.47Å; V132-Q135 HydrophobicContact CG1-CG 4.01Å; V132-Q135 PolarHBondContact O-N 2.88Å; V132-E136 PolarHBondContact O-N 3.15Å | ||
| 133 | A | 86 | Confident | 89.2 | Confident | 67 Ų | 67 | 68.2 Ų | 68.2 | 55% | 0.554 | 39% | 0.391 | S | S | * | . | H | α-helix | trans | -65.3 | -28.7 | -176.7 | 0 | 0 | 0 | 0 | 0 | 113.8 | E136 N137 | A133-E136 WeakPolarHBondContact O-CB 3.44Å; A133-E136 PolarHBondContact O-N 3.41Å; A133-N137 PolarHBondContact O-N 2.96Å; A133-N137 PolarHBondContact O-ND2 2.88Å |
| 134 | S | 88.6 | Confident | 88.9 | Confident | 67 Ų | 67 | 70.4 Ų | 70.4 | 47% | 0.469 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -65.7 | -45.1 | 175.9 | 58.7 | 0 | 0 | 0 | 0 | 111.7 | V132 E136 N137 E138 | V132-S134 VanDerWaalsContact C-N 3.3Å; V132-S134 VanDerWaalsContact CG1-OG 3.25Å; V132-S134 WeakPolarHBondContact CG1-OG 3.1Å; V132-S134 PolarHBondContact O-N 2.83Å; S134-E136 VanDerWaalsContact C-N 3.27Å; S134-E136 PolarHBondContact O-N 3.23Å; S134-N137 PolarHBondContact O-N 3.47Å; S134-E138 WeakPolarHBondContact O-CG 3.37Å; S134-E138 PolarHBondContact O-N 2.84Å; S134-E138 VanDerWaalsContact O-N 3.09Å |
| 135 | Q | 88.5 | Confident | 88.5 | Confident | 99 Ų | 99 | 74 Ų | 74 | 46% | 0.463 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -63.7 | -34.9 | 175.7 | -65.6 | 179.7 | 6 | 0 | 0 | 111.7 | M130 V132 E138 C139 | M130-Q135 HydrophobicContact CE-CB 3.89Å; V132-Q135 HydrophobicContact CB-CB 4.3Å; V132-Q135 HydrophobicContact CB-CG 4.1Å; V132-Q135 HydrophobicContact CG1-CB 4.47Å; V132-Q135 HydrophobicContact CG1-CG 4.01Å; V132-Q135 PolarHBondContact O-N 2.88Å; Q135-E138 PolarHBondContact O-N 2.94Å; Q135-C139 WeakPolarHBondContact O-CB 3.41Å; Q135-C139 PolarHBondContact O-N 2.92Å; Q135-C139 PolarHBondContact O-SG 3.1Å |
| 136 | E | 87.9 | Confident | 88.3 | Confident | 11 Ų | 11 | 79.9 Ų | 79.9 | 5% | 0.051 | 45% | 0.449 | C | S | . | . | H | α-helix | trans | -59 | -48.1 | 175.3 | -166.6 | 175.3 | 112.8 | 0 | 0 | 111.5 | R127 G128 M130 V132 A133 S134 C139 L140 L150 | R127-E136 WeakPolarHBondContact CA-OE1 3.19Å; R127-E136 WeakPolarHBondContact CG-OE1 3.23Å; G128-E136 VanDerWaalsContact CA-OE2 3.23Å; G128-E136 WeakPolarHBondContact CA-OE2 3.44Å; G128-E136 VanDerWaalsContact N-CD 3.3Å; G128-E136 PolarHBondContact N-OE1 3.41Å; G128-E136 PolarHBondContact N-OE2 2.8Å; M130-E136 HydrophobicContact CB-CB 4.19Å; M130-E136 HydrophobicContact CB-CG 4.44Å; M130-E136 HydrophobicContact CG-CB 4.49Å; M130-E136 HydrophobicContact CG-CG 4.44Å; M130-E136 PolarHBondContact N-OE2 2.8Å; M130-E136 HydrophobicContact SD-CB 4.04Å; M130-E136 HydrophobicContact SD-CG 4.19Å; V132-E136 PolarHBondContact O-N 3.15Å; A133-E136 WeakPolarHBondContact O-CB 3.44Å; A133-E136 PolarHBondContact O-N 3.41Å; S134-E136 VanDerWaalsContact C-N 3.27Å; S134-E136 PolarHBondContact O-N 3.23Å; E136-C139 PolarHBondContact O-N 3.44Å; E136-L140 WeakPolarHBondContact O-CB 3.11Å; E136-L140 PolarHBondContact O-N 3.23Å; E136-L150 HydrophobicContact CG-CB 4.35Å; E136-L150 HydrophobicContact CG-CD1 3.81Å; E136-L150 HydrophobicContact CG-CD2 3.86Å; E136-L150 HydrophobicContact CG-CG 4.22Å |
| 137 | N | 87.6 | Confident | 88.2 | Confident | 103 Ų | 103 | 83 Ų | 83 | 55% | 0.551 | 46% | 0.461 | S | S | * | . | H | α-helix | trans | -66.4 | -39 | 179.2 | -68.8 | -34.4 | 0 | 0 | 0 | 112.2 | A133 S134 L140 A141 | A133-N137 PolarHBondContact O-N 2.96Å; A133-N137 PolarHBondContact O-ND2 2.88Å; S134-N137 PolarHBondContact O-N 3.47Å; N137-L140 PolarHBondContact O-N 2.85Å; N137-A141 VanDerWaalsContact O-CB 3.29Å; N137-A141 WeakPolarHBondContact O-CB 3.48Å; N137-A141 PolarHBondContact O-N 3.13Å |
| 138 | E | 90.5 | Very high | 88.1 | Confident | 131 Ų | 131 | 76.7 Ų | 76.7 | 61% | 0.612 | 45% | 0.449 | S | S | * | . | H | α-helix | trans | -64 | -43.9 | 174.5 | -71.1 | 169.8 | -162.7 | 0 | 0 | 111.7 | S134 Q135 L140 A141 S142 | S134-E138 WeakPolarHBondContact O-CG 3.37Å; S134-E138 PolarHBondContact O-N 2.84Å; S134-E138 VanDerWaalsContact O-N 3.09Å; Q135-E138 PolarHBondContact O-N 2.94Å; E138-L140 VanDerWaalsContact C-N 3.32Å; E138-L140 PolarHBondContact O-N 3.35Å; E138-A141 PolarHBondContact O-N 3.4Å; E138-S142 PolarHBondContact O-N 3.24Å |
| 139 | C | 87.8 | Confident | 88.2 | Confident | 24 Ų | 24 | 76.4 Ų | 76.4 | 16% | 0.162 | 44% | 0.435 | C | S | . | . | H | α-helix | trans | -63.7 | -38.4 | 176.2 | -70.3 | 0 | 0 | 0 | 0 | 111.6 | M130 Q135 E136 S142 Y147 L150 | M130-C139 HydrophobicContact SD-CB 4.49Å; Q135-C139 WeakPolarHBondContact O-CB 3.41Å; Q135-C139 PolarHBondContact O-N 2.92Å; Q135-C139 PolarHBondContact O-SG 3.1Å; E136-C139 PolarHBondContact O-N 3.44Å; C139-S142 WeakPolarHBondContact O-CB 3.29Å; C139-S142 PolarHBondContact O-N 3.18Å; C139-S142 PolarHBondContact O-OG 2.97Å; C139-Y147 HydrophobicContact CB-CD1 3.96Å; C139-Y147 HydrophobicContact CB-CD2 3.78Å; C139-Y147 HydrophobicContact CB-CE1 4.24Å; C139-Y147 HydrophobicContact CB-CE2 4.07Å; C139-Y147 HydrophobicContact CB-CG 3.75Å; C139-Y147 WeakPolarHBondContact O-CD2 3.45Å; C139-L150 HydrophobicContact CB-CD1 4Å |
| 140 | L | 86.7 | Confident | 88.3 | Confident | 60 Ų | 60 | 75.4 Ų | 75.4 | 31% | 0.314 | 43% | 0.428 | S | S | . | . | H | α-helix | trans | -68.7 | -38.9 | 175.3 | -171 | 150.4 | 0 | 0 | 0 | 111.7 | E136 N137 E138 S142 G143 L150 K151 | E136-L140 WeakPolarHBondContact O-CB 3.11Å; E136-L140 PolarHBondContact O-N 3.23Å; N137-L140 PolarHBondContact O-N 2.85Å; E138-L140 VanDerWaalsContact C-N 3.32Å; E138-L140 PolarHBondContact O-N 3.35Å; L140-S142 VanDerWaalsContact C-N 3.29Å; L140-S142 PolarHBondContact O-N 3.21Å; L140-G143 PolarHBondContact O-N 3.29Å; L140-L150 HydrophobicContact CB-CD1 4.48Å; L140-L150 HydrophobicContact CD1-CB 3.99Å; L140-K151 HydrophobicContact CD1-CG 3.66Å; L140-K151 HydrophobicContact CG-CG 4.2Å |
| 141 | A | 89 | Confident | 88.4 | Confident | 83 Ų | 83 | 80.4 Ų | 80.4 | 69% | 0.686 | 45% | 0.448 | S | S | * | . | H | α-helix | trans | -67.9 | -27.2 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.9 | N137 E138 G143 | N137-A141 VanDerWaalsContact O-CB 3.29Å; N137-A141 WeakPolarHBondContact O-CB 3.48Å; N137-A141 PolarHBondContact O-N 3.13Å; E138-A141 PolarHBondContact O-N 3.4Å; A141-G143 PolarHBondContact O-N 2.99Å; A141-G143 VanDerWaalsContact O-N 3.09Å |
| 142 | S | 88.9 | Confident | 88.8 | Confident | 60 Ų | 60 | 74.3 Ų | 74.3 | 42% | 0.42 | 43% | 0.429 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -61.7 | -16.1 | 176.5 | 78.5 | 0 | 0 | 0 | 0 | 114.1 | E138 C139 L140 N144 | E138-S142 PolarHBondContact O-N 3.24Å; C139-S142 WeakPolarHBondContact O-CB 3.29Å; C139-S142 PolarHBondContact O-N 3.18Å; C139-S142 PolarHBondContact O-OG 2.97Å; L140-S142 VanDerWaalsContact C-N 3.29Å; L140-S142 PolarHBondContact O-N 3.21Å; S142-N144 PolarHBondContact O-N 3.2Å; S142-N144 PolarHBondContact OG-ND2 3.14Å |
| 143 | G | 87.1 | Confident | 89 | Confident | 65 Ų | 65 | 78.3 Ų | 78.3 | 67% | 0.67 | 44% | 0.442 | S | S | * | . | trans | 73.9 | -0.3 | 177.5 | 0 | 0 | 0 | 0 | 0 | 115.3 | L140 A141 | L140-G143 PolarHBondContact O-N 3.29Å; A141-G143 PolarHBondContact O-N 2.99Å; A141-G143 VanDerWaalsContact O-N 3.09Å | ||
| 144 | N | 88.6 | Confident | 89.4 | Confident | 85 Ų | 85 | 75.9 Ų | 75.9 | 46% | 0.455 | 42% | 0.419 | S | S | . | . | trans | -66.2 | 134 | -177.9 | -70.6 | -54.3 | 0 | 0 | 0 | 112 | S142 K146 Y147 | S142-N144 PolarHBondContact O-N 3.2Å; S142-N144 PolarHBondContact OG-ND2 3.14Å; N144-K146 PolarHBondContact O-N 3.39Å; N144-K146 VanDerWaalsContact O-N 3.14Å; N144-Y147 HydrophobicContact CB-CD2 3.9Å; N144-Y147 HydrophobicContact CB-CE2 4.37Å; N144-Y147 PolarHBondContact O-N 3.08Å | ||
| 145 | P | 87 | Confident | 89.7 | Confident | 104 Ų | 104 | 73.2 Ų | 73.2 | 68% | 0.675 | 40% | 0.399 | S | S | * | . | G | 310 helix | trans | -62.5 | -25.9 | -179.9 | 25.1 | -34.1 | 0 | 0 | 0 | 112.4 | Y147 A148 | P145-Y147 PolarHBondContact O-N 2.71Å; P145-A148 VanDerWaalsContact O-CB 3.27Å; P145-A148 WeakPolarHBondContact O-CB 3.3Å; P145-A148 PolarHBondContact O-N 2.91Å; P145-A148 VanDerWaalsContact O-N 3.11Å |
| 146 | K | 87.8 | Confident | 90 | Very high | 155 Ų | 155 | 68.5 Ų | 68.5 | 67% | 0.674 | 38% | 0.377 | S | S | * | . | G | 310 helix | trans | -53.5 | -35.7 | 171.7 | -174.1 | 179.2 | 179 | -176.6 | 0 | 112.4 | N144 H149 | N144-K146 PolarHBondContact O-N 3.39Å; N144-K146 VanDerWaalsContact O-N 3.14Å; K146-H149 PolarHBondContact O-CE1 2.75Å; K146-H149 PolarHBondContact O-ND1 2.85Å |
| 147 | Y | 90 | Very high | 90.3 | Very high | 65 Ų | 65 | 71.5 Ų | 71.5 | 26% | 0.255 | 39% | 0.388 | S | S | . | . | G | 310 helix | trans | -100.2 | 5 | -178 | -57.6 | -57.9 | 0 | 0 | 0 | 113.7 | C139 N144 P145 H149 L150 | C139-Y147 HydrophobicContact CB-CD1 3.96Å; C139-Y147 HydrophobicContact CB-CD2 3.78Å; C139-Y147 HydrophobicContact CB-CE1 4.24Å; C139-Y147 HydrophobicContact CB-CE2 4.07Å; C139-Y147 HydrophobicContact CB-CG 3.75Å; C139-Y147 WeakPolarHBondContact O-CD2 3.45Å; N144-Y147 HydrophobicContact CB-CD2 3.9Å; N144-Y147 HydrophobicContact CB-CE2 4.37Å; N144-Y147 PolarHBondContact O-N 3.08Å; P145-Y147 PolarHBondContact O-N 2.71Å; Y147-H149 PolarHBondContact O-N 2.96Å; Y147-H149 VanDerWaalsContact O-N 3.14Å; Y147-L150 HydrophobicContact CD1-CD1 4.22Å; Y147-L150 HydrophobicContact CG-CD1 4.34Å; Y147-L150 WeakPolarHBondContact O-CB 3.29Å; Y147-L150 WeakPolarHBondContact O-CG 3.12Å; Y147-L150 PolarHBondContact O-N 3.18Å |
| 148 | A | 90.3 | Very high | 90.7 | Very high | 53 Ų | 53 | 66.6 Ų | 66.6 | 44% | 0.438 | 36% | 0.362 | S | S | . | . | G | 310 helix | trans | -57.3 | -33.3 | -179.8 | 0 | 0 | 0 | 0 | 0 | 112.9 | P145 L150 K151 | P145-A148 VanDerWaalsContact O-CB 3.27Å; P145-A148 WeakPolarHBondContact O-CB 3.3Å; P145-A148 PolarHBondContact O-N 2.91Å; P145-A148 VanDerWaalsContact O-N 3.11Å; A148-L150 PolarHBondContact O-N 3.2Å; A148-K151 WeakPolarHBondContact O-CB 3.45Å; A148-K151 PolarHBondContact O-N 2.71Å |
| 149 | H | 90.4 | Very high | 90.8 | Very high | 36 Ų | 36 | 62.7 Ų | 62.7 | 17% | 0.167 | 34% | 0.344 | C | S | . | . | G | 310 helix | trans | -60.2 | -22.8 | 176.2 | 66.8 | -68.4 | 0 | 0 | 0 | 114.3 | M125 G126 K146 Y147 K151 E152 | M125-H149 HydrophobicContact CE-CB 3.64Å; M125-H149 VanDerWaalsContact CE-CG 3.48Å; G126-H149 VanDerWaalsContact CA-O 3.26Å; G126-H149 WeakPolarHBondContact CA-O 3.24Å; K146-H149 PolarHBondContact O-CE1 2.75Å; K146-H149 PolarHBondContact O-ND1 2.85Å; Y147-H149 PolarHBondContact O-N 2.96Å; Y147-H149 VanDerWaalsContact O-N 3.14Å; H149-K151 PolarHBondContact O-N 2.63Å; H149-E152 WeakPolarHBondContact O-CB 3.45Å; H149-E152 PolarHBondContact O-N 3.44Å |
| 150 | L | 91.5 | Very high | 91.2 | Very high | 3 Ų | 3 | 61.8 Ų | 61.8 | 2% | 0.016 | 34% | 0.338 | C | S | . | . | G | 310 helix | trans | -64.8 | -17.9 | 177.9 | -62.5 | 176.6 | 0 | 0 | 0 | 112.7 | R127 M130 E136 C139 L140 Y147 A148 | R127-L150 WeakPolarHBondContact CA-O 3.3Å; R127-L150 WeakPolarHBondContact CB-O 3.46Å; R127-L150 PolarHBondContact N-O 3.14Å; M130-L150 HydrophobicContact CG-CD2 4.31Å; M130-L150 HydrophobicContact SD-CD1 4.12Å; M130-L150 HydrophobicContact SD-CD2 4.39Å; E136-L150 HydrophobicContact CG-CB 4.35Å; E136-L150 HydrophobicContact CG-CD1 3.81Å; E136-L150 HydrophobicContact CG-CD2 3.86Å; E136-L150 HydrophobicContact CG-CG 4.22Å; C139-L150 HydrophobicContact CB-CD1 4Å; L140-L150 HydrophobicContact CB-CD1 4.48Å; L140-L150 HydrophobicContact CD1-CB 3.99Å; Y147-L150 HydrophobicContact CD1-CD1 4.22Å; Y147-L150 HydrophobicContact CG-CD1 4.34Å; Y147-L150 WeakPolarHBondContact O-CB 3.29Å; Y147-L150 WeakPolarHBondContact O-CG 3.12Å; Y147-L150 PolarHBondContact O-N 3.18Å; A148-L150 PolarHBondContact O-N 3.2Å |
| 151 | K | 90.2 | Very high | 91.4 | Very high | 161 Ų | 161 | 61.9 Ų | 61.9 | 70% | 0.7 | 34% | 0.344 | S | S | * | . | G | 310 helix | trans | -76.6 | -23.1 | 171.8 | -64.7 | 176.3 | -178.8 | 179.6 | 0 | 112.7 | L140 A148 H149 | L140-K151 HydrophobicContact CD1-CG 3.66Å; L140-K151 HydrophobicContact CG-CG 4.2Å; A148-K151 WeakPolarHBondContact O-CB 3.45Å; A148-K151 PolarHBondContact O-N 2.71Å; H149-K151 PolarHBondContact O-N 2.63Å |
| 152 | E | 91.9 | Very high | 91.5 | Very high | 75 Ų | 75 | 58.5 Ų | 58.5 | 35% | 0.35 | 32% | 0.317 | S | S | . | . | S | Bend | trans | -78.8 | 162.8 | -179.9 | -58.3 | -176.8 | -175.8 | 0 | 0 | 111.2 | K86 G126 R127 H149 Q155 | K86-E152 VanDerWaalsContact NZ-CD 3.33Å; K86-E152 IonicContact NZ-OE1 2.65Å; K86-E152 PolarHBondContact NZ-OE1 3.35Å; K86-E152 VanDerWaalsContact NZ-OE1 3.08Å; K86-E152 IonicContact NZ-OE2 2.63Å; K86-E152 PolarHBondContact NZ-OE2 2.99Å; G126-E152 WeakPolarHBondContact CA-O 3.49Å; R127-E152 PolarHBondContact N-O 3.03Å; H149-E152 WeakPolarHBondContact O-CB 3.45Å; H149-E152 PolarHBondContact O-N 3.44Å; E152-Q155 PolarHBondContact OE2-NE2 3.14Å |
| 153 | K | 92.9 | Very high | 91.6 | Very high | 138 Ų | 138 | 59 Ų | 59 | 60% | 0.6 | 32% | 0.317 | S | S | * | . | P | Polyproline II helix | trans | -63.2 | 152.6 | 173.6 | -68 | -168.8 | 175 | -163.4 | 0 | 111.1 | L88 D92 Q155 | L88-K153 HydrophobicContact CD2-CB 3.97Å; L88-K153 HydrophobicContact CD2-CD 4.5Å; D92-K153 IonicContact OD2-NZ 2.63Å; K153-Q155 PolarHBondContact O-N 3.2Å |
| 154 | L | 94.1 | Very high | 91.7 | Very high | 15 Ų | 15 | 56.8 Ų | 56.8 | 8% | 0.079 | 29% | 0.292 | C | S | . | . | S | Bend | trans | -57.6 | 124 | 175.9 | -171.7 | 68.7 | 0 | 0 | 0 | 110.6 | I89 V91 V100 V124 R127 | I89-L154 HydrophobicContact CB-CD2 4.1Å; I89-L154 HydrophobicContact CB-CG 4.19Å; I89-L154 HydrophobicContact CD1-CD2 3.93Å; I89-L154 HydrophobicContact CD1-CG 3.87Å; I89-L154 HydrophobicContact CG1-CD2 4.44Å; I89-L154 HydrophobicContact CG1-CG 4.22Å; I89-L154 HydrophobicContact CG2-CD2 4.17Å; I89-L154 PolarHBondContact N-O 3.34Å; V91-L154 HydrophobicContact CG1-CB 4.48Å; V91-L154 HydrophobicContact CG1-CD2 3.54Å; V100-L154 HydrophobicContact CG2-CD1 4.17Å; V100-L154 HydrophobicContact CG2-CD2 3.84Å; V124-L154 HydrophobicContact CG1-CD1 4.04Å; R127-L154 WeakPolarHBondContact O-CB 3.26Å |
| 155 | Q | 94.4 | Very high | 91.8 | Very high | 11 Ų | 11 | 56.6 Ų | 56.6 | 5% | 0.051 | 30% | 0.302 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -151 | 155.1 | -173 | 66.3 | -171.4 | 2 | 0 | 0 | 112 | V87 M125 E152 K153 | V87-Q155 CarbonylContact O-C 3.55Å; V87-Q155 WeakPolarHBondContact O-CA 3.26Å; V87-Q155 VanDerWaalsContact O-CB 3.29Å; V87-Q155 WeakPolarHBondContact O-CB 3.48Å; M125-Q155 HydrophobicContact CB-CG 4.22Å; M125-Q155 PolarHBondContact N-O 3.2Å; M125-Q155 PolarHBondContact O-N 2.95Å; E152-Q155 PolarHBondContact OE2-NE2 3.14Å; K153-Q155 PolarHBondContact O-N 3.2Å |
| 156 | V | 95.2 | Very high | 92.1 | Very high | 0 Ų | 0 | 55.2 Ų | 55.2 | 0% | 0 | 29% | 0.286 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -101.2 | 122.6 | 169.1 | -174 | 0 | 0 | 0 | 0 | 108.5 | V87 I89 L103 L178 L182 | V87-V156 PolarHBondContact N-O 3.17Å; V87-V156 PolarHBondContact O-N 2.98Å; I89-V156 HydrophobicContact CD1-CG2 3.74Å; I89-V156 HydrophobicContact CG1-CG2 4.08Å; L103-V156 HydrophobicContact CD2-CG2 3.61Å; V156-L178 HydrophobicContact CG1-CD1 4.14Å; V156-L178 HydrophobicContact CG1-CD2 4.44Å; V156-L182 HydrophobicContact CG2-CD2 4.44Å |
| 157 | R | 94.4 | Very high | 92.4 | Very high | 75 Ų | 75 | 47.9 Ų | 47.9 | 28% | 0.283 | 25% | 0.254 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -90.6 | 121.5 | 173.3 | -173.9 | -179.5 | -178.6 | 176.1 | 7.2 | 109.2 | T84 K85 L122 S123 M125 Q159 | T84-R157 HydrophobicContact CG2-CG 3.67Å; K85-R157 WeakPolarHBondContact O-CA 3.49Å; L122-R157 CarbonylContact C-O 3.43Å; L122-R157 WeakPolarHBondContact CA-O 3.49Å; S123-R157 PolarHBondContact N-O 3.4Å; S123-R157 PolarHBondContact O-N 3.32Å; M125-R157 HydrophobicContact CG-CB 4.39Å; M125-R157 HydrophobicContact SD-CB 3.88Å; M125-R157 WeakPolarHBondContact SD-CD 3.32Å; M125-R157 HydrophobicContact SD-CG 4.32Å; R157-Q159 HydrophobicContact CG-CG 4.05Å |
| 158 | I | 95.6 | Very high | 92.5 | Very high | 0 Ų | 0 | 50 Ų | 50 | 0% | 0 | 26% | 0.263 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -102.2 | 121.7 | 173.5 | -51.1 | 174 | 0 | 0 | 0 | 107.2 | T84 K85 V87 V120 L122 A174 L175 L178 | T84-I158 CarbonylContact C-O 3.26Å; T84-I158 VanDerWaalsContact CA-O 3.3Å; T84-I158 WeakPolarHBondContact CA-O 3.44Å; K85-I158 PolarHBondContact N-O 2.61Å; K85-I158 PolarHBondContact O-N 3.09Å; V87-I158 HydrophobicContact CG2-CD1 3.76Å; V87-I158 HydrophobicContact CG2-CG1 4.32Å; V120-I158 HydrophobicContact CB-CG2 4.43Å; V120-I158 HydrophobicContact CG2-CG2 4.37Å; L122-I158 HydrophobicContact CD2-CB 4.16Å; L122-I158 HydrophobicContact CD2-CG1 3.75Å; L122-I158 HydrophobicContact CD2-CG2 4.04Å; I158-A174 HydrophobicContact CD1-CB 4.18Å; I158-A174 HydrophobicContact CG2-CB 4.1Å; I158-L175 HydrophobicContact CD1-CD2 3.88Å; I158-L175 HydrophobicContact CD1-CG 4.3Å; I158-L178 HydrophobicContact CD1-CD1 3.71Å; I158-L178 HydrophobicContact CG1-CD1 4.04Å |
| 159 | Q | 94.3 | Very high | 92.8 | Very high | 49 Ų | 49 | 54.8 Ų | 54.8 | 23% | 0.229 | 27% | 0.269 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -118.8 | 124.3 | 172.3 | -44.1 | -171.3 | -78.3 | 0 | 0 | 109.6 | V83 T84 K121 R157 | V83-Q159 WeakPolarHBondContact O-CA 3.34Å; T84-Q159 HydrophobicContact CG2-CG 4.35Å; T84-Q159 PolarHBondContact OG1-NE2 3.46Å; K121-Q159 HydrophobicContact CB-CB 4.21Å; K121-Q159 PolarHBondContact N-O 2.98Å; K121-Q159 PolarHBondContact O-N 3.42Å; R157-Q159 HydrophobicContact CG-CG 4.05Å |
| 160 | A | 94.3 | Very high | 93 | Very high | 4 Ų | 4 | 55.3 Ų | 55.3 | 3% | 0.033 | 27% | 0.271 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -126.1 | 143.3 | 178.4 | 0 | 0 | 0 | 0 | 0 | 110.1 | K82 V83 V120 V167 K170 I171 | K82-A160 WeakPolarHBondContact CA-O 3.31Å; V83-A160 PolarHBondContact N-O 3.18Å; V83-A160 PolarHBondContact O-N 3.11Å; V120-A160 HydrophobicContact CG1-CB 3.96Å; A160-V167 HydrophobicContact CB-CG1 4.03Å; A160-K170 HydrophobicContact CB-CB 4.33Å; A160-I171 HydrophobicContact CB-CD1 4.39Å; A160-I171 HydrophobicContact CB-CG1 4Å |
| 161 | S | 91.4 | Very high | 93.2 | Very high | 62 Ų | 62 | 55.8 Ų | 55.8 | 43% | 0.434 | 27% | 0.273 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -132.6 | 145 | 175.4 | 58.9 | 0 | 0 | 0 | 0 | 110.8 | L81 V167 K170 | L81-S161 VanDerWaalsContact O-CA 3.31Å; L81-S161 WeakPolarHBondContact O-CA 3.44Å; S161-V167 VanDerWaalsContact C-CG2 3.5Å; S161-K170 PolarHBondContact O-NZ 3.43Å |
| 162 | G | 91.3 | Very high | 93.5 | Very high | 13 Ų | 13 | 49.8 Ų | 49.8 | 13% | 0.134 | 26% | 0.258 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | 155 | -162.2 | -179.5 | 0 | 0 | 0 | 0 | 0 | 111.9 | L81 | L81-G162 PolarHBondContact N-O 3.41Å; L81-G162 PolarHBondContact O-N 3.08Å |
| 163 | T | 91.2 | Very high | 93.7 | Very high | 69 Ų | 69 | 49.6 Ų | 49.6 | 42% | 0.423 | 26% | 0.259 | S | S | . | . | S | Bend | trans | -64.6 | 153.8 | 168.1 | 61.4 | 0 | 0 | 0 | 0 | 110 | A165 E166 V167 | T163-A165 VanDerWaalsContact C-N 3.27Å; T163-A165 PolarHBondContact O-N 3.26Å; T163-E166 PolarHBondContact N-OE2 3.36Å; T163-E166 VanDerWaalsContact N-OE2 3.1Å; T163-E166 PolarHBondContact O-N 3.14Å; T163-E166 VanDerWaalsContact O-N 3.1Å; T163-E166 WeakPolarHBondContact OG1-CB 3.49Å; T163-E166 WeakPolarHBondContact OG1-CG 3.4Å; T163-E166 PolarHBondContact OG1-N 3.12Å; T163-E166 PolarHBondContact OG1-OE2 2.76Å; T163-V167 VanDerWaalsContact O-CG2 3.31Å; T163-V167 WeakPolarHBondContact O-CG2 3.31Å; T163-V167 PolarHBondContact O-N 3.26Å |
| 164 | P | 89.6 | Confident | 93.8 | Very high | 20 Ų | 20 | 43 Ų | 43 | 13% | 0.13 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -52.8 | -45.2 | -179.1 | -27.2 | 34.3 | 0 | 0 | 0 | 113 | I74 L81 E166 V167 Y168 | I74-P164 HydrophobicContact CG2-CB 3.51Å; I74-P164 HydrophobicContact CG2-CG 3.3Å; L81-P164 HydrophobicContact CB-CG 4.35Å; L81-P164 HydrophobicContact CD2-CB 4.16Å; P164-E166 PolarHBondContact O-N 3.27Å; P164-V167 PolarHBondContact O-N 2.88Å; P164-Y168 WeakPolarHBondContact O-CD2 3.44Å; P164-Y168 PolarHBondContact O-N 2.88Å; P164-Y168 VanDerWaalsContact O-N 3.14Å |
| 165 | A | 91 | Very high | 93.9 | Very high | 80 Ų | 80 | 46.2 Ų | 46.2 | 66% | 0.661 | 25% | 0.247 | S | C | * | . | H | α-helix | trans | -59.6 | -45.5 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | T163 R169 | T163-A165 VanDerWaalsContact C-N 3.27Å; T163-A165 PolarHBondContact O-N 3.26Å; A165-R169 WeakPolarHBondContact O-CB 3.29Å; A165-R169 PolarHBondContact O-N 3.3Å; A165-R169 VanDerWaalsContact O-N 3.16Å |
| 166 | E | 92.8 | Very high | 93.8 | Very high | 76 Ų | 76 | 52.8 Ų | 52.8 | 36% | 0.355 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -67.4 | -39.4 | 178.4 | -70.9 | 170 | 146.5 | 0 | 0 | 112.6 | T163 P164 R169 K170 | T163-E166 PolarHBondContact N-OE2 3.36Å; T163-E166 VanDerWaalsContact N-OE2 3.1Å; T163-E166 PolarHBondContact O-N 3.14Å; T163-E166 VanDerWaalsContact O-N 3.1Å; T163-E166 WeakPolarHBondContact OG1-CB 3.49Å; T163-E166 WeakPolarHBondContact OG1-CG 3.4Å; T163-E166 PolarHBondContact OG1-N 3.12Å; T163-E166 PolarHBondContact OG1-OE2 2.76Å; P164-E166 PolarHBondContact O-N 3.27Å; E166-R169 PolarHBondContact O-N 3.41Å; E166-K170 WeakPolarHBondContact O-CB 3.36Å; E166-K170 VanDerWaalsContact O-CG 3.27Å; E166-K170 WeakPolarHBondContact O-CG 3.48Å; E166-K170 PolarHBondContact O-N 3.04Å |
| 167 | V | 93.2 | Very high | 93.6 | Very high | 0 Ų | 0 | 55.5 Ų | 55.5 | 0% | 0 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -63.9 | -46.8 | -178 | 170.3 | 0 | 0 | 0 | 0 | 110.7 | L81 V83 A160 S161 T163 P164 R169 K170 I171 | L81-V167 HydrophobicContact CB-CG2 4.38Å; L81-V167 HydrophobicContact CD2-CB 4.47Å; L81-V167 HydrophobicContact CD2-CG1 4.33Å; L81-V167 WeakPolarHBondContact O-CG2 3.35Å; V83-V167 HydrophobicContact CB-CG1 3.64Å; V83-V167 HydrophobicContact CG2-CG1 3.54Å; A160-V167 HydrophobicContact CB-CG1 4.03Å; S161-V167 VanDerWaalsContact C-CG2 3.5Å; T163-V167 VanDerWaalsContact O-CG2 3.31Å; T163-V167 WeakPolarHBondContact O-CG2 3.31Å; T163-V167 PolarHBondContact O-N 3.26Å; P164-V167 PolarHBondContact O-N 2.88Å; V167-R169 VanDerWaalsContact C-N 3.35Å; V167-K170 PolarHBondContact O-N 2.76Å; V167-I171 HydrophobicContact CG1-CD1 3.97Å; V167-I171 VanDerWaalsContact O-CG1 3.29Å; V167-I171 WeakPolarHBondContact O-CG1 3.33Å; V167-I171 PolarHBondContact O-N 3Å |
| 168 | Y | 93 | Very high | 93.5 | Very high | 111 Ų | 111 | 52 Ų | 52 | 44% | 0.435 | 28% | 0.277 | S | S | . | . | H | α-helix | trans | -65.6 | -37.9 | 176.8 | -74.2 | -69.9 | 0 | 0 | 0 | 112.2 | I74 L81 P164 I171 G172 | I74-Y168 HydrophobicContact CD1-CE2 3.72Å; L81-Y168 HydrophobicContact CD2-CE2 4.01Å; P164-Y168 WeakPolarHBondContact O-CD2 3.44Å; P164-Y168 PolarHBondContact O-N 2.88Å; P164-Y168 VanDerWaalsContact O-N 3.14Å; Y168-I171 PolarHBondContact O-N 3.45Å; Y168-G172 PolarHBondContact O-N 3.23Å |
| 169 | R | 95.5 | Very high | 93.3 | Very high | 152 Ų | 152 | 59 Ų | 59 | 57% | 0.574 | 31% | 0.308 | S | S | * | . | H | α-helix | trans | -60.2 | -52.3 | 173.6 | -172.4 | 179.7 | 68 | -163.6 | -3.2 | 111.6 | A165 E166 V167 I171 G172 D173 | A165-R169 WeakPolarHBondContact O-CB 3.29Å; A165-R169 PolarHBondContact O-N 3.3Å; A165-R169 VanDerWaalsContact O-N 3.16Å; E166-R169 PolarHBondContact O-N 3.41Å; V167-R169 VanDerWaalsContact C-N 3.35Å; R169-I171 VanDerWaalsContact C-N 3.27Å; R169-I171 PolarHBondContact O-N 3.35Å; R169-G172 WeakPolarHBondContact O-CA 3.48Å; R169-G172 PolarHBondContact O-N 2.83Å; R169-D173 VanDerWaalsContact O-CG 3.26Å; R169-D173 PolarHBondContact O-N 3.1Å |
| 170 | K | 96.3 | Very high | 93 | Very high | 47 Ų | 47 | 59.3 Ų | 59.3 | 20% | 0.204 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -57.1 | -38.4 | 178.3 | -75.6 | 178.9 | -178.1 | -177.1 | 0 | 112.8 | V120 A160 S161 E166 V167 A174 | V120-K170 HydrophobicContact CG1-CB 3.7Å; V120-K170 HydrophobicContact CG1-CD 4.2Å; V120-K170 HydrophobicContact CG1-CG 4.33Å; A160-K170 HydrophobicContact CB-CB 4.33Å; S161-K170 PolarHBondContact O-NZ 3.43Å; E166-K170 WeakPolarHBondContact O-CB 3.36Å; E166-K170 VanDerWaalsContact O-CG 3.27Å; E166-K170 WeakPolarHBondContact O-CG 3.48Å; E166-K170 PolarHBondContact O-N 3.04Å; V167-K170 PolarHBondContact O-N 2.76Å; K170-A174 VanDerWaalsContact O-CB 3.24Å; K170-A174 WeakPolarHBondContact O-CB 3.27Å; K170-A174 PolarHBondContact O-N 3.26Å |
| 171 | I | 95.3 | Very high | 92.7 | Very high | 13 Ų | 13 | 60.6 Ų | 60.6 | 7% | 0.067 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -67.8 | -43.1 | 176.5 | -69.6 | 168.6 | 0 | 0 | 0 | 110.7 | V83 K85 A160 V167 Y168 R169 A174 L175 | V83-I171 HydrophobicContact CB-CD1 3.71Å; V83-I171 HydrophobicContact CG1-CD1 3.4Å; K85-I171 HydrophobicContact CG-CD1 4.36Å; K85-I171 HydrophobicContact CG-CG2 4.34Å; A160-I171 HydrophobicContact CB-CD1 4.39Å; A160-I171 HydrophobicContact CB-CG1 4Å; V167-I171 HydrophobicContact CG1-CD1 3.97Å; V167-I171 VanDerWaalsContact O-CG1 3.29Å; V167-I171 WeakPolarHBondContact O-CG1 3.33Å; V167-I171 PolarHBondContact O-N 3Å; Y168-I171 PolarHBondContact O-N 3.45Å; R169-I171 VanDerWaalsContact C-N 3.27Å; R169-I171 PolarHBondContact O-N 3.35Å; I171-A174 PolarHBondContact O-N 2.83Å; I171-L175 HydrophobicContact CG2-CD1 4.13Å; I171-L175 HydrophobicContact CG2-CG 4.49Å; I171-L175 VanDerWaalsContact O-CG 3.3Å; I171-L175 WeakPolarHBondContact O-CG 3.06Å; I171-L175 PolarHBondContact O-N 2.94Å |
| 172 | G | 95.9 | Very high | 92.6 | Very high | 36 Ų | 36 | 58.6 Ų | 58.6 | 37% | 0.371 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -57.7 | -52.4 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112 | Y168 R169 A174 L175 E176 | Y168-G172 PolarHBondContact O-N 3.23Å; R169-G172 WeakPolarHBondContact O-CA 3.48Å; R169-G172 PolarHBondContact O-N 2.83Å; G172-A174 VanDerWaalsContact C-N 3.28Å; G172-A174 PolarHBondContact O-N 3.46Å; G172-L175 PolarHBondContact O-N 2.82Å; G172-L175 VanDerWaalsContact O-N 3.1Å; G172-E176 PolarHBondContact O-N 3.16Å; G172-E176 VanDerWaalsContact O-N 3.11Å |
| 173 | D | 96.2 | Very high | 92.1 | Very high | 70 Ų | 70 | 61.4 Ų | 61.4 | 37% | 0.374 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -58.3 | -41.1 | 178.2 | -59.1 | -20.5 | 0 | 0 | 0 | 111.1 | L118 R169 L175 E176 E177 | L118-D173 HydrophobicContact CD2-CB 3.59Å; R169-D173 VanDerWaalsContact O-CG 3.26Å; R169-D173 PolarHBondContact O-N 3.1Å; D173-L175 PolarHBondContact O-N 3.48Å; D173-E176 PolarHBondContact O-N 3.39Å; D173-E177 WeakPolarHBondContact O-CG 3.35Å; D173-E177 PolarHBondContact O-N 3.28Å |
| 174 | A | 95.7 | Very high | 91.1 | Very high | 0 Ų | 0 | 58.9 Ų | 58.9 | 0% | 0 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -65.5 | -36.7 | 177.2 | 0 | 0 | 0 | 0 | 0 | 113.6 | L118 V120 I158 K170 I171 G172 L178 | L118-A174 HydrophobicContact CD1-CB 3.76Å; V120-A174 HydrophobicContact CG2-CB 4.26Å; I158-A174 HydrophobicContact CD1-CB 4.18Å; I158-A174 HydrophobicContact CG2-CB 4.1Å; K170-A174 VanDerWaalsContact O-CB 3.24Å; K170-A174 WeakPolarHBondContact O-CB 3.27Å; K170-A174 PolarHBondContact O-N 3.26Å; I171-A174 PolarHBondContact O-N 2.83Å; G172-A174 VanDerWaalsContact C-N 3.28Å; G172-A174 PolarHBondContact O-N 3.46Å; A174-L178 VanDerWaalsContact O-CB 3.31Å; A174-L178 WeakPolarHBondContact O-CB 3.47Å; A174-L178 WeakPolarHBondContact O-CD1 3.21Å; A174-L178 WeakPolarHBondContact O-CG 3.46Å; A174-L178 PolarHBondContact O-N 3.09Å |
| 175 | L | 94.6 | Very high | 89.8 | Confident | 82 Ų | 82 | 60.4 Ų | 60.4 | 43% | 0.429 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -68.4 | -37.8 | 177 | -71.5 | 170.7 | 0 | 0 | 0 | 111.6 | V87 I158 I171 G172 D173 K179 | V87-L175 HydrophobicContact CG2-CD2 3.63Å; I158-L175 HydrophobicContact CD1-CD2 3.88Å; I158-L175 HydrophobicContact CD1-CG 4.3Å; I171-L175 HydrophobicContact CG2-CD1 4.13Å; I171-L175 HydrophobicContact CG2-CG 4.49Å; I171-L175 VanDerWaalsContact O-CG 3.3Å; I171-L175 WeakPolarHBondContact O-CG 3.06Å; I171-L175 PolarHBondContact O-N 2.94Å; G172-L175 PolarHBondContact O-N 2.82Å; G172-L175 VanDerWaalsContact O-N 3.1Å; D173-L175 PolarHBondContact O-N 3.48Å; L175-K179 PolarHBondContact O-N 2.85Å; L175-K179 VanDerWaalsContact O-N 3.16Å |
| 176 | E | 93.5 | Very high | 88 | Confident | 149 Ų | 149 | 59.9 Ų | 59.9 | 70% | 0.696 | 30% | 0.303 | S | S | * | . | H | α-helix | trans | -66.6 | -44.6 | 176.5 | -171.1 | 164.1 | -159.2 | 0 | 0 | 111.6 | G172 D173 L178 K179 P180 | G172-E176 PolarHBondContact O-N 3.16Å; G172-E176 VanDerWaalsContact O-N 3.11Å; D173-E176 PolarHBondContact O-N 3.39Å; E176-L178 PolarHBondContact O-N 3.45Å; E176-K179 WeakPolarHBondContact O-CB 3.13Å; E176-K179 PolarHBondContact O-N 2.84Å; E176-P180 WeakPolarHBondContact O-CD 3.43Å |
| 177 | E | 91.2 | Very high | 86 | Confident | 58 Ų | 58 | 64.1 Ų | 64.1 | 27% | 0.271 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -66.2 | -34.5 | 176 | -72.5 | -74.4 | -178.1 | 0 | 0 | 113.1 | M114 K117 L118 D173 P180 Y181 | M114-E177 HydrophobicContact CE-CB 4.44Å; M114-E177 HydrophobicContact SD-CB 4.48Å; K117-E177 WeakPolarHBondContact CE-OE1 3.49Å; K117-E177 IonicContact NZ-OE1 2.71Å; K117-E177 PolarHBondContact NZ-OE1 2.97Å; L118-E177 HydrophobicContact CD1-CB 4.22Å; L118-E177 HydrophobicContact CD1-CG 4.28Å; L118-E177 HydrophobicContact CD2-CG 4.06Å; L118-E177 HydrophobicContact CG-CG 4.49Å; D173-E177 WeakPolarHBondContact O-CG 3.35Å; D173-E177 PolarHBondContact O-N 3.28Å; E177-P180 VanDerWaalsContact O-CD 3.29Å; E177-P180 WeakPolarHBondContact O-CD 3.48Å; E177-P180 WeakPolarHBondContact O-CG 3.37Å; E177-Y181 WeakPolarHBondContact O-CD2 3.43Å; E177-Y181 WeakPolarHBondContact O-CE2 3.4Å |
| 178 | L | 92.2 | Very high | 83.8 | Confident | 1 Ų | 1 | 75.4 Ų | 75.4 | 1% | 0.005 | 36% | 0.36 | C | S | . | . | H | α-helix | trans | -76 | -26.9 | 179.1 | -76.8 | 170.9 | 0 | 0 | 0 | 113.2 | L103 M114 L122 V156 I158 A174 E176 Y181 L182 | L103-L178 HydrophobicContact CD1-CD2 3.52Å; L103-L178 HydrophobicContact CD2-CD2 4.36Å; M114-L178 HydrophobicContact CE-CD2 4.34Å; M114-L178 HydrophobicContact SD-CD2 3.66Å; M114-L178 HydrophobicContact SD-CG 4.1Å; L122-L178 HydrophobicContact CD2-CD1 4.34Å; V156-L178 HydrophobicContact CG1-CD1 4.14Å; V156-L178 HydrophobicContact CG1-CD2 4.44Å; I158-L178 HydrophobicContact CD1-CD1 3.71Å; I158-L178 HydrophobicContact CG1-CD1 4.04Å; A174-L178 VanDerWaalsContact O-CB 3.31Å; A174-L178 WeakPolarHBondContact O-CB 3.47Å; A174-L178 WeakPolarHBondContact O-CD1 3.21Å; A174-L178 WeakPolarHBondContact O-CG 3.46Å; A174-L178 PolarHBondContact O-N 3.09Å; E176-L178 PolarHBondContact O-N 3.45Å; L178-Y181 PolarHBondContact O-N 2.9Å; L178-L182 HydrophobicContact CB-CD1 4.31Å; L178-L182 WeakPolarHBondContact O-CG 3.35Å; L178-L182 PolarHBondContact O-N 3.47Å |
| 179 | K | 90.7 | Very high | 81.8 | Confident | 146 Ų | 146 | 75.1 Ų | 75.1 | 64% | 0.635 | 37% | 0.366 | S | S | * | . | H | α-helix | trans | -49.8 | -48.4 | -177.6 | -171.6 | 179.1 | 179.1 | -177.8 | 0 | 114.5 | L175 E176 Y181 L182 T183 | L175-K179 PolarHBondContact O-N 2.85Å; L175-K179 VanDerWaalsContact O-N 3.16Å; E176-K179 WeakPolarHBondContact O-CB 3.13Å; E176-K179 PolarHBondContact O-N 2.84Å; K179-Y181 VanDerWaalsContact C-N 3.29Å; K179-Y181 PolarHBondContact O-N 3.19Å; K179-L182 PolarHBondContact O-N 2.99Å; K179-T183 WeakPolarHBondContact O-CB 3.41Å; K179-T183 PolarHBondContact O-N 3.07Å; K179-T183 PolarHBondContact O-OG1 3.24Å |
| 180 | P | 87.5 | Confident | 79.9 | Confident | 56 Ų | 56 | 72.1 Ų | 72.1 | 36% | 0.364 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -68.1 | -24 | 178.8 | 26.7 | -36.8 | 0 | 0 | 0 | 114 | K102 E176 E177 I194 | K102-P180 PolarHBondContact NZ-O 3.46Å; E176-P180 WeakPolarHBondContact O-CD 3.43Å; E177-P180 VanDerWaalsContact O-CD 3.29Å; E177-P180 WeakPolarHBondContact O-CD 3.48Å; E177-P180 WeakPolarHBondContact O-CG 3.37Å; P180-I194 HydrophobicContact CB-CD1 3.96Å; P180-I194 HydrophobicContact CG-CD1 4.4Å |
| 181 | Y | 89.3 | Confident | 78 | Confident | 32 Ų | 32 | 76.1 Ų | 76.1 | 13% | 0.125 | 39% | 0.392 | C | S | . | . | H | α-helix | trans | -80.6 | -32.4 | 176.2 | -62.9 | -92.4 | 0 | 0 | 0 | 112.3 | K102 L103 T110 M114 E177 L178 K179 I194 | K102-Y181 HydrophobicContact CG-CD1 4.11Å; L103-Y181 HydrophobicContact CD1-CD1 4.17Å; L103-Y181 HydrophobicContact CD1-CD2 4.5Å; L103-Y181 HydrophobicContact CD1-CG 3.94Å; T110-Y181 HydrophobicContact CG2-CE1 3.65Å; T110-Y181 WeakPolarHBondContact CG2-OH 3.23Å; M114-Y181 HydrophobicContact CE-CD2 3.58Å; M114-Y181 HydrophobicContact CE-CE1 4.5Å; M114-Y181 HydrophobicContact CE-CE2 3.18Å; M114-Y181 HydrophobicContact CE-CG 4.38Å; E177-Y181 WeakPolarHBondContact O-CD2 3.43Å; E177-Y181 WeakPolarHBondContact O-CE2 3.4Å; L178-Y181 PolarHBondContact O-N 2.9Å; K179-Y181 VanDerWaalsContact C-N 3.29Å; K179-Y181 PolarHBondContact O-N 3.19Å; Y181-I194 HydrophobicContact CD1-CD1 4.11Å; Y181-I194 HydrophobicContact CD1-CG2 4.09Å; Y181-I194 HydrophobicContact CD2-CD1 4.33Å; Y181-I194 HydrophobicContact CE1-CD1 3.87Å; Y181-I194 HydrophobicContact CE1-CG1 4.36Å; Y181-I194 HydrophobicContact CE1-CG2 3.51Å; Y181-I194 HydrophobicContact CE2-CD1 4.09Å; Y181-I194 HydrophobicContact CG-CD1 4.34Å |
| 182 | L | 87.8 | Confident | 77 | Confident | 20 Ų | 20 | 76.5 Ų | 76.5 | 11% | 0.105 | 39% | 0.394 | C | S | . | . | H | α-helix | trans | -87.4 | -9.6 | 178.7 | -61.4 | -178.2 | 0 | 0 | 0 | 113.4 | V87 I89 P90 F99 V156 L178 K179 | V87-L182 HydrophobicContact CG1-CD1 3.57Å; I89-L182 HydrophobicContact CB-CD2 4.38Å; I89-L182 HydrophobicContact CD1-CD2 4.09Å; I89-L182 HydrophobicContact CG1-CD2 3.82Å; I89-L182 HydrophobicContact CG2-CD2 4.16Å; P90-L182 WeakPolarHBondContact CG-O 3.44Å; F99-L182 VanDerWaalsContact CE1-O 3.32Å; F99-L182 WeakPolarHBondContact CE1-O 3.43Å; V156-L182 HydrophobicContact CG2-CD2 4.44Å; L178-L182 HydrophobicContact CB-CD1 4.31Å; L178-L182 WeakPolarHBondContact O-CG 3.35Å; L178-L182 PolarHBondContact O-N 3.47Å; K179-L182 PolarHBondContact O-N 2.99Å |
| 183 | T | 82.5 | Confident | 76.2 | Confident | 72 Ų | 72 | 81.2 Ų | 81.2 | 44% | 0.442 | 41% | 0.407 | S | S | . | . | S | Bend | trans | -91.3 | 114.9 | 172.5 | -54.3 | 0 | 0 | 0 | 0 | 108.7 | K179 V185 | K179-T183 WeakPolarHBondContact O-CB 3.41Å; K179-T183 PolarHBondContact O-N 3.07Å; K179-T183 PolarHBondContact O-OG1 3.24Å; T183-V185 PolarHBondContact O-N 3.06Å |
| 184 | A | 69.2 | Low | 75.3 | Confident | 15 Ų | 15 | 79 Ų | 79 | 12% | 0.124 | 40% | 0.395 | C | S | . | . | trans | -73.4 | 99.1 | 169.8 | 0 | 0 | 0 | 0 | 0 | 108.1 | H94 F97 F99 S186 | H94-A184 HydrophobicContact CB-CB 3.95Å; F97-A184 HydrophobicContact CB-CB 4.36Å; F97-A184 HydrophobicContact CD1-CB 4.07Å; F97-A184 HydrophobicContact CD2-CB 4.34Å; F97-A184 HydrophobicContact CE1-CB 4.39Å; F97-A184 HydrophobicContact CG-CB 4.01Å; F99-A184 HydrophobicContact CE1-CB 4Å; F99-A184 HydrophobicContact CZ-CB 3.93Å; A184-S186 PolarHBondContact O-N 3.14Å | ||
| 185 | V | 62.9 | Low | 74.5 | Confident | 53 Ų | 53 | 81.3 Ų | 81.3 | 32% | 0.321 | 41% | 0.408 | S | S | . | . | trans | -67.1 | 113.4 | 162.7 | -177 | 0 | 0 | 0 | 0 | 105 | T183 Y187 D189 | T183-V185 PolarHBondContact O-N 3.06Å; V185-Y187 PolarHBondContact O-N 3.04Å; V185-D189 HydrophobicContact CG1-CB 4.01Å | ||
| 186 | S | 52.3 | Low | 73.8 | Confident | 68 Ų | 68 | 82 Ų | 82 | 48% | 0.476 | 41% | 0.409 | S | S | . | . | trans | -56.6 | 134.3 | -179.1 | -79.4 | 0 | 0 | 0 | 0 | 108.9 | A184 R188 D189 | A184-S186 PolarHBondContact O-N 3.14Å; S186-R188 PolarHBondContact O-N 3.49Å; S186-D189 PolarHBondContact O-N 3.15Å | ||
| 187 | Y | 50.3 | Low | 73.2 | Confident | 165 Ų | 165 | 80.5 Ų | 80.5 | 65% | 0.647 | 40% | 0.403 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -48.8 | -13.5 | -179.2 | -106.6 | -98 | 0 | 0 | 0 | 115.6 | V185 D189 | V185-Y187 PolarHBondContact O-N 3.04Å; Y187-D189 VanDerWaalsContact C-N 3.31Å |
| 188 | R | 48.4 | Very low | 72.9 | Confident | 237 Ų | 237 | 78.7 Ų | 78.7 | 89% | 0.894 | 39% | 0.394 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -70.7 | -25.4 | 174.2 | -72.7 | -169.2 | 170.5 | -166.8 | -2.5 | 113.3 | S186 | S186-R188 PolarHBondContact O-N 3.49Š|
| 189 | D | 51.5 | Low | 72.2 | Confident | 105 Ų | 105 | 80.3 Ų | 80.3 | 56% | 0.561 | 40% | 0.404 | S | S | * | . | S | Bend | trans | -99.4 | 89.3 | 170.4 | -61 | -42.9 | 0 | 0 | 0 | 107.4 | V185 S186 Y187 N191 | V185-D189 HydrophobicContact CG1-CB 4.01Å; S186-D189 PolarHBondContact O-N 3.15Å; Y187-D189 VanDerWaalsContact C-N 3.31Å; D189-N191 PolarHBondContact O-N 3.46Å |
| 190 | S | 54.2 | Low | 71.6 | Confident | 90 Ų | 90 | 77.5 Ų | 77.5 | 63% | 0.629 | 40% | 0.403 | S | S | * | . | trans | -64.7 | 13.2 | -174.6 | -52.9 | 0 | 0 | 0 | 0 | 115.3 | Q196 | S190-Q196 PolarHBondContact O-NE2 3.17Š| ||
| 191 | N | 57.1 | Low | 71.2 | Confident | 130 Ų | 130 | 80 Ų | 80 | 70% | 0.695 | 41% | 0.41 | S | S | * | . | trans | -101.5 | 36.9 | -174.8 | -62.9 | -35.4 | 0 | 0 | 0 | 112.3 | D189 E193 | D189-N191 PolarHBondContact O-N 3.46Å; N191-E193 VanDerWaalsContact C-N 3.29Å; N191-E193 PolarHBondContact O-N 2.87Å | ||
| 192 | D | 73.9 | Confident | 70.3 | Confident | 22 Ų | 22 | 81.7 Ų | 81.7 | 12% | 0.118 | 42% | 0.421 | C | S | . | . | trans | -77.8 | 87.2 | 168.2 | -160.4 | -20.9 | 0 | 0 | 0 | 108.9 | K102 I194 V195 Q196 | K102-D192 VanDerWaalsContact CE-OD1 3.31Å; K102-D192 WeakPolarHBondContact CE-OD1 3.03Å; K102-D192 VanDerWaalsContact CE-OD2 3.28Å; K102-D192 WeakPolarHBondContact CE-OD2 3.48Å; K102-D192 IonicContact NZ-OD1 3.08Å; K102-D192 PolarHBondContact NZ-OD1 3.44Å; K102-D192 IonicContact NZ-OD2 2.95Å; K102-D192 PolarHBondContact NZ-OD2 3.25Å; D192-I194 PolarHBondContact O-N 3.32Å; D192-I194 VanDerWaalsContact O-N 3.12Å; D192-V195 HydrophobicContact CB-CB 4.31Å; D192-V195 HydrophobicContact CB-CG2 4.17Å; D192-V195 PolarHBondContact O-N 3.32Å; D192-Q196 PolarHBondContact O-N 2.94Å | ||
| 193 | E | 79.3 | Confident | 69 | Low | 134 Ų | 134 | 83.7 Ų | 83.7 | 63% | 0.626 | 45% | 0.446 | S | S | * | . | H | α-helix | trans | -53.3 | -32.9 | -177.8 | -63.6 | -175.5 | 167.6 | 0 | 0 | 112 | N191 Q196 Q197 | N191-E193 VanDerWaalsContact C-N 3.29Å; N191-E193 PolarHBondContact O-N 2.87Å; E193-Q196 PolarHBondContact O-N 3.5Å; E193-Q197 VanDerWaalsContact O-CB 3.28Å; E193-Q197 WeakPolarHBondContact O-CB 3.32Å; E193-Q197 WeakPolarHBondContact O-CG 3.41Å; E193-Q197 PolarHBondContact O-N 2.92Å |
| 194 | I | 77.3 | Confident | 67.6 | Low | 24 Ų | 24 | 85.1 Ų | 85.1 | 12% | 0.123 | 45% | 0.446 | C | S | . | . | H | α-helix | trans | -63.6 | -49.2 | 178.7 | -64.3 | 168.4 | 0 | 0 | 0 | 110.3 | K102 P180 Y181 D192 Q196 Q197 Q198 | K102-I194 HydrophobicContact CG-CG2 3.94Å; P180-I194 HydrophobicContact CB-CD1 3.96Å; P180-I194 HydrophobicContact CG-CD1 4.4Å; Y181-I194 HydrophobicContact CD1-CD1 4.11Å; Y181-I194 HydrophobicContact CD1-CG2 4.09Å; Y181-I194 HydrophobicContact CD2-CD1 4.33Å; Y181-I194 HydrophobicContact CE1-CD1 3.87Å; Y181-I194 HydrophobicContact CE1-CG1 4.36Å; Y181-I194 HydrophobicContact CE1-CG2 3.51Å; Y181-I194 HydrophobicContact CE2-CD1 4.09Å; Y181-I194 HydrophobicContact CG-CD1 4.34Å; D192-I194 PolarHBondContact O-N 3.32Å; D192-I194 VanDerWaalsContact O-N 3.12Å; I194-Q196 VanDerWaalsContact C-N 3.33Å; I194-Q197 PolarHBondContact O-N 3.45Å; I194-Q198 WeakPolarHBondContact O-CB 3.5Å; I194-Q198 WeakPolarHBondContact O-CG 3.38Å; I194-Q198 PolarHBondContact O-N 3.24Å |
| 195 | V | 79 | Confident | 66.6 | Low | 48 Ų | 48 | 89.6 Ų | 89.6 | 29% | 0.291 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -67.4 | -39.3 | -179 | 179.1 | 0 | 0 | 0 | 0 | 110 | K102 D192 Q198 T199 | K102-V195 HydrophobicContact CD-CG2 4.17Å; K102-V195 HydrophobicContact CG-CG2 4.3Å; D192-V195 HydrophobicContact CB-CB 4.31Å; D192-V195 HydrophobicContact CB-CG2 4.17Å; D192-V195 PolarHBondContact O-N 3.32Å; V195-Q198 PolarHBondContact O-N 2.92Å; V195-T199 VanDerWaalsContact O-CB 3.24Å; V195-T199 WeakPolarHBondContact O-CB 3.34Å; V195-T199 PolarHBondContact O-N 2.99Å; V195-T199 PolarHBondContact O-OG1 3.27Å |
| 196 | Q | 78.9 | Confident | 66.1 | Low | 96 Ų | 96 | 92.1 Ų | 92.1 | 45% | 0.449 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -63.6 | -45.9 | 176.4 | -67 | -177.5 | 15.4 | 0 | 0 | 112 | S190 D192 E193 I194 T199 S200 | S190-Q196 PolarHBondContact O-NE2 3.17Å; D192-Q196 PolarHBondContact O-N 2.94Å; E193-Q196 PolarHBondContact O-N 3.5Å; I194-Q196 VanDerWaalsContact C-N 3.33Å; Q196-T199 PolarHBondContact O-N 3.37Å; Q196-S200 VanDerWaalsContact O-CB 3.31Å; Q196-S200 WeakPolarHBondContact O-CB 3.46Å; Q196-S200 PolarHBondContact O-N 3.05Å; Q196-S200 PolarHBondContact O-OG 3.38Å |
| 197 | Q | 81.8 | Confident | 65.8 | Low | 118 Ų | 118 | 97.6 Ų | 97.6 | 55% | 0.551 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -60.8 | -48 | 176.2 | -75.6 | 173.4 | 12 | 0 | 0 | 110.8 | E193 I194 T199 S200 E201 | E193-Q197 VanDerWaalsContact O-CB 3.28Å; E193-Q197 WeakPolarHBondContact O-CB 3.32Å; E193-Q197 WeakPolarHBondContact O-CG 3.41Å; E193-Q197 PolarHBondContact O-N 2.92Å; I194-Q197 PolarHBondContact O-N 3.45Å; Q197-T199 VanDerWaalsContact C-N 3.34Å; Q197-T199 PolarHBondContact O-N 2.88Å; Q197-S200 WeakPolarHBondContact O-CB 3.43Å; Q197-S200 PolarHBondContact O-N 2.85Å; Q197-E201 WeakPolarHBondContact O-CG 3.47Å; Q197-E201 PolarHBondContact O-N 3.39Å |
| 198 | Q | 84 | Confident | 65.4 | Low | 20 Ų | 20 | 91.7 Ų | 91.7 | 9% | 0.093 | 49% | 0.493 | C | S | . | . | H | α-helix | trans | -63.2 | -38.3 | 177.8 | -72.3 | 174.9 | -11.6 | 0 | 0 | 112.6 | K102 T110 I194 V195 S200 L202 | K102-Q198 PolarHBondContact O-NE2 3.3Å; T110-Q198 PolarHBondContact OG1-NE2 3.16Å; I194-Q198 WeakPolarHBondContact O-CB 3.5Å; I194-Q198 WeakPolarHBondContact O-CG 3.38Å; I194-Q198 PolarHBondContact O-N 3.24Å; V195-Q198 PolarHBondContact O-N 2.92Å; Q198-S200 VanDerWaalsContact C-N 3.35Å; Q198-L202 WeakPolarHBondContact O-CG 3.46Å; Q198-L202 PolarHBondContact O-N 3.31Å; Q198-L202 VanDerWaalsContact O-N 3.15Å |
| 199 | T | 77.9 | Confident | 64.8 | Low | 36 Ų | 36 | 92.7 Ų | 92.7 | 22% | 0.221 | 50% | 0.497 | C | S | . | . | H | α-helix | trans | -69.4 | -35.2 | 176.6 | -56.4 | 0 | 0 | 0 | 0 | 111.5 | V195 Q196 Q197 L202 F204 | V195-T199 VanDerWaalsContact O-CB 3.24Å; V195-T199 WeakPolarHBondContact O-CB 3.34Å; V195-T199 PolarHBondContact O-N 2.99Å; V195-T199 PolarHBondContact O-OG1 3.27Å; Q196-T199 PolarHBondContact O-N 3.37Å; Q197-T199 VanDerWaalsContact C-N 3.34Å; Q197-T199 PolarHBondContact O-N 2.88Å; T199-L202 PolarHBondContact O-N 3.3Å; T199-F204 HydrophobicContact CG2-CB 4.03Å; T199-F204 HydrophobicContact CG2-CD1 4.47Å; T199-F204 PolarHBondContact O-N 3.48Å |
| 200 | S | 79.3 | Confident | 64.2 | Low | 87 Ų | 87 | 91.1 Ų | 91.1 | 61% | 0.608 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -70.1 | -43.1 | 175.4 | -57.8 | 0 | 0 | 0 | 0 | 111.7 | Q196 Q197 Q198 L202 G203 | Q196-S200 VanDerWaalsContact O-CB 3.31Å; Q196-S200 WeakPolarHBondContact O-CB 3.46Å; Q196-S200 PolarHBondContact O-N 3.05Å; Q196-S200 PolarHBondContact O-OG 3.38Å; Q197-S200 WeakPolarHBondContact O-CB 3.43Å; Q197-S200 PolarHBondContact O-N 2.85Å; Q198-S200 VanDerWaalsContact C-N 3.35Å; S200-L202 PolarHBondContact O-N 3.47Å; S200-G203 PolarHBondContact O-N 3.41Å |
| 201 | E | 78 | Confident | 63.3 | Low | 109 Ų | 109 | 90.3 Ų | 90.3 | 51% | 0.509 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -60.4 | -31.4 | 174.2 | -75.8 | -172.1 | 167.4 | 0 | 0 | 112 | K113 Q197 G203 | K113-E201 IonicContact NZ-OE1 3.02Å; K113-E201 PolarHBondContact NZ-OE1 3.1Å; K113-E201 IonicContact NZ-OE2 3.95Å; Q197-E201 WeakPolarHBondContact O-CG 3.47Å; Q197-E201 PolarHBondContact O-N 3.39Å; E201-G203 PolarHBondContact O-N 2.96Å |
| 202 | L | 71.1 | Confident | 62.3 | Low | 67 Ų | 67 | 87.8 Ų | 87.8 | 35% | 0.351 | 52% | 0.516 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -71.4 | -3.2 | 173.5 | -76.6 | 170.1 | 0 | 0 | 0 | 113.8 | P106 Q198 T199 S200 L217 I221 | P106-L202 HydrophobicContact CB-CD1 4.26Å; P106-L202 HydrophobicContact CB-CD2 3.52Å; P106-L202 HydrophobicContact CB-CG 3.75Å; P106-L202 HydrophobicContact CG-CG 4.37Å; Q198-L202 WeakPolarHBondContact O-CG 3.46Å; Q198-L202 PolarHBondContact O-N 3.31Å; Q198-L202 VanDerWaalsContact O-N 3.15Å; T199-L202 PolarHBondContact O-N 3.3Å; S200-L202 PolarHBondContact O-N 3.47Å; L202-L217 HydrophobicContact CD2-CD2 3.82Å; L202-I221 HydrophobicContact CD1-CD1 4.19Å; L202-I221 HydrophobicContact CD1-CG2 4.46Å |
| 203 | G | 61.2 | Low | 61.2 | Low | 61 Ų | 61 | 96.8 Ų | 96.8 | 63% | 0.629 | 55% | 0.554 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 73.4 | 25.4 | 177.4 | 0 | 0 | 0 | 0 | 0 | 113.7 | S200 E201 N205 | S200-G203 PolarHBondContact O-N 3.41Å; E201-G203 PolarHBondContact O-N 2.96Å; G203-N205 PolarHBondContact O-N 3.11Å |
| 204 | F | 52.4 | Low | 59.8 | Low | 102 Ų | 102 | 96.4 Ų | 96.4 | 45% | 0.447 | 56% | 0.561 | S | S | . | * | trans | -77.6 | 93.3 | 175 | -165.2 | -102.3 | 0 | 0 | 0 | 110 | T199 P206 L218 | T199-F204 HydrophobicContact CG2-CB 4.03Å; T199-F204 HydrophobicContact CG2-CD1 4.47Å; T199-F204 PolarHBondContact O-N 3.48Å; F204-P206 HydrophobicContact CD1-CB 4.43Å; F204-P206 HydrophobicContact CE1-CB 4Å; F204-P206 WeakPolarHBondContact O-CD 3.41Å; F204-L218 HydrophobicContact CD2-CD1 3.52Å; F204-L218 HydrophobicContact CD2-CD2 4.09Å; F204-L218 HydrophobicContact CD2-CG 4.45Å; F204-L218 HydrophobicContact CE2-CD1 3.74Å; F204-L218 HydrophobicContact CE2-CD2 3.38Å; F204-L218 HydrophobicContact CE2-CG 4.21Å; F204-L218 HydrophobicContact CG-CD1 4.08Å; F204-L218 HydrophobicContact CZ-CD1 4.44Å; F204-L218 HydrophobicContact CZ-CD2 3.79Å | ||
| 205 | N | 47.9 | Very low | 58.5 | Low | 109 Ų | 109 | 107 Ų | 107 | 58% | 0.583 | 60% | 0.599 | S | S | * | * | trans | -87.1 | 103.9 | 166.5 | -170.3 | -1.9 | 0 | 0 | 0 | 108.5 | G203 Q207 G208 | G203-N205 PolarHBondContact O-N 3.11Å; N205-Q207 PolarHBondContact O-N 3.36Å; N205-Q207 PolarHBondContact OD1-N 3.19Å; N205-G208 PolarHBondContact O-N 2.99Å; N205-G208 VanDerWaalsContact O-N 3.1Å | ||
| 206 | P | 52 | Low | 57.2 | Low | 107 Ų | 107 | 116 Ų | 116 | 70% | 0.695 | 63% | 0.628 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -63.7 | -11.5 | 179.6 | 24.9 | -33.2 | 0 | 0 | 0 | 113.5 | F204 | F204-P206 HydrophobicContact CD1-CB 4.43Å; F204-P206 HydrophobicContact CE1-CB 4Å; F204-P206 WeakPolarHBondContact O-CD 3.41Å |
| 207 | Q | 47 | Very low | 55.7 | Low | 182 Ų | 182 | 117 Ų | 117 | 85% | 0.85 | 64% | 0.636 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -113.4 | 9.2 | 176.7 | -80 | 171.3 | -4.6 | 0 | 0 | 113.9 | N205 R209 | N205-Q207 PolarHBondContact O-N 3.36Å; N205-Q207 PolarHBondContact OD1-N 3.19Å; Q207-R209 PolarHBondContact O-N 3.32Å |
| 208 | G | 40.4 | Very low | 54.1 | Low | 42 Ų | 42 | 115 Ų | 115 | 43% | 0.433 | 63% | 0.628 | S | S | . | * | trans | -88.9 | 91.4 | -175.8 | 0 | 0 | 0 | 0 | 0 | 114 | N205 G210 | N205-G208 PolarHBondContact O-N 2.99Å; N205-G208 VanDerWaalsContact O-N 3.1Å; G208-G210 PolarHBondContact O-N 3.4Å; G208-G210 VanDerWaalsContact O-N 3.1Å | ||
| 209 | R | 36.6 | Very low | 52.2 | Low | 258 Ų | 258 | 122.6 Ų | 122.6 | 97% | 0.974 | 66% | 0.656 | S | S | * | * | trans | -50.3 | 108.5 | 152.1 | -109.3 | 179.7 | 173 | -178.5 | -1 | 108.8 | Q207 | Q207-R209 PolarHBondContact O-N 3.32Š| ||
| 210 | G | 38.2 | Very low | 50.8 | Low | 72 Ų | 72 | 124.4 Ų | 124.4 | 74% | 0.742 | 66% | 0.664 | S | S | * | * | trans | 171.2 | 113.4 | 169.1 | 0 | 0 | 0 | 0 | 0 | 115.6 | G208 | G208-G210 PolarHBondContact O-N 3.4Å; G208-G210 VanDerWaalsContact O-N 3.1Å | ||
| 211 | G | 37 | Very low | 49.5 | Very low | 73 Ų | 73 | 123.5 Ų | 123.5 | 75% | 0.753 | 65% | 0.652 | S | S | * | * | trans | 72.4 | 108.2 | 142.8 | 0 | 0 | 0 | 0 | 0 | 118 | ||||
| 212 | G | 34.7 | Very low | 47.9 | Very low | 76 Ų | 76 | 121.8 Ų | 121.8 | 78% | 0.784 | 65% | 0.651 | S | S | * | * | S | Bend | trans | -59.9 | 146.2 | 179.9 | 0 | 0 | 0 | 0 | 0 | 115.3 | ||
| 213 | K | 50.9 | Low | 46.7 | Very low | 212 Ų | 212 | 124.7 Ų | 124.7 | 92% | 0.922 | 66% | 0.661 | S | S | * | * | S | Bend | trans | 144.5 | -8.3 | 148.5 | -77.1 | 169 | -176.5 | -177.7 | 0 | 114 | ||
| 214 | T | 50.2 | Low | 46.1 | Very low | 125 Ų | 125 | 126.8 Ų | 126.8 | 77% | 0.767 | 67% | 0.666 | S | S | * | * | trans | -106.1 | 13 | -171.6 | 41.8 | 0 | 0 | 0 | 0 | 116.4 | R216 | T214-R216 VanDerWaalsContact C-N 3.29Å; T214-R216 PolarHBondContact O-N 3.14Å | ||
| 215 | R | 49.6 | Very low | 45.6 | Very low | 246 Ų | 246 | 127.1 Ų | 127.1 | 93% | 0.928 | 68% | 0.678 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71.4 | -7.1 | -177.4 | -74.7 | -173.7 | 179 | 177.1 | -0.6 | 116.3 | ||
| 216 | R | 51.3 | Low | 45.2 | Very low | 238 Ų | 238 | 125.7 Ų | 125.7 | 90% | 0.898 | 69% | 0.69 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84.2 | -19.6 | -176.3 | -85.5 | -172.4 | -169.6 | 155.8 | 3.1 | 115.2 | T214 | T214-R216 VanDerWaalsContact C-N 3.29Å; T214-R216 PolarHBondContact O-N 3.14Å |
| 217 | L | 49.1 | Very low | 44.7 | Very low | 117 Ų | 117 | 123.9 Ų | 123.9 | 61% | 0.613 | 69% | 0.69 | S | S | * | * | S | Bend | trans | -79.1 | -28.8 | -173.8 | -119.7 | 87.8 | 0 | 0 | 0 | 113.5 | L202 R219 L220 | L202-L217 HydrophobicContact CD2-CD2 3.82Å; L217-R219 PolarHBondContact O-N 3.47Å; L217-L220 WeakPolarHBondContact O-CB 3.22Å; L217-L220 PolarHBondContact O-N 3.47Å |
| 218 | L | 47.2 | Very low | 44.7 | Very low | 76 Ų | 76 | 121.4 Ų | 121.4 | 40% | 0.398 | 69% | 0.69 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -66.9 | -20.7 | -172.8 | -153.4 | 73.8 | 0 | 0 | 0 | 113.9 | F204 L220 I221 | F204-L218 HydrophobicContact CD2-CD1 3.52Å; F204-L218 HydrophobicContact CD2-CD2 4.09Å; F204-L218 HydrophobicContact CD2-CG 4.45Å; F204-L218 HydrophobicContact CE2-CD1 3.74Å; F204-L218 HydrophobicContact CE2-CD2 3.38Å; F204-L218 HydrophobicContact CE2-CG 4.21Å; F204-L218 HydrophobicContact CG-CD1 4.08Å; F204-L218 HydrophobicContact CZ-CD1 4.44Å; F204-L218 HydrophobicContact CZ-CD2 3.79Å; L218-L220 PolarHBondContact O-N 3.13Å; L218-I221 HydrophobicContact CD1-CD1 4.23Å |
| 219 | R | 44.8 | Very low | 44.9 | Very low | 180 Ų | 180 | 129.2 Ų | 129.2 | 68% | 0.679 | 72% | 0.715 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -69.1 | -21.4 | 175.6 | -149.6 | 178.5 | -174.6 | 160.2 | 2 | 111.8 | L217 F223 | L217-R219 PolarHBondContact O-N 3.47Å; R219-F223 HydrophobicContact CB-CE2 4.21Å; R219-F223 HydrophobicContact CG-CD2 4.25Å; R219-F223 HydrophobicContact CG-CE2 3.58Å; R219-F223 HydrophobicContact CG-CZ 3.78Å; R219-F223 WeakPolarHBondContact O-CD2 3.06Å; R219-F223 VanDerWaalsContact O-CE2 3.26Å; R219-F223 WeakPolarHBondContact O-CE2 3.47Å |
| 220 | L | 48 | Very low | 45.1 | Very low | 74 Ų | 74 | 120.1 Ų | 120.1 | 39% | 0.387 | 70% | 0.702 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -83.4 | -22.4 | -167 | -159.9 | 62.8 | 0 | 0 | 0 | 114.5 | L217 L218 | L217-L220 WeakPolarHBondContact O-CB 3.22Å; L217-L220 PolarHBondContact O-N 3.47Å; L218-L220 PolarHBondContact O-N 3.13Å |
| 221 | I | 51.8 | Low | 45.4 | Very low | 68 Ų | 68 | 128.6 Ų | 128.6 | 35% | 0.349 | 71% | 0.711 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -96.8 | -19.6 | -175.9 | 51.3 | 169.8 | 0 | 0 | 0 | 113.4 | L202 L218 | L202-I221 HydrophobicContact CD1-CD1 4.19Å; L202-I221 HydrophobicContact CD1-CG2 4.46Å; L218-I221 HydrophobicContact CD1-CD1 4.23Å |
| 222 | C | 44.9 | Very low | 45.4 | Very low | 72 Ų | 72 | 128.5 Ų | 128.5 | 49% | 0.486 | 71% | 0.71 | S | S | . | * | trans | -129 | 36.9 | -173.2 | -59.6 | 0 | 0 | 0 | 0 | 113.6 | S224 | C222-S224 PolarHBondContact O-N 2.99Š| ||
| 223 | F | 45.7 | Very low | 45.6 | Very low | 129 Ų | 129 | 128.3 Ų | 128.3 | 57% | 0.566 | 71% | 0.708 | S | S | * | * | trans | -65.5 | 96.6 | 177 | -108.8 | -79.8 | 0 | 0 | 0 | 110.9 | R219 P225 | R219-F223 HydrophobicContact CB-CE2 4.21Å; R219-F223 HydrophobicContact CG-CD2 4.25Å; R219-F223 HydrophobicContact CG-CE2 3.58Å; R219-F223 HydrophobicContact CG-CZ 3.78Å; R219-F223 WeakPolarHBondContact O-CD2 3.06Å; R219-F223 VanDerWaalsContact O-CE2 3.26Å; R219-F223 WeakPolarHBondContact O-CE2 3.47Å; F223-P225 WeakPolarHBondContact O-CD 3.34Å | ||
| 224 | S | 48.9 | Very low | 45.2 | Very low | 104 Ų | 104 | 129 Ų | 129 | 73% | 0.727 | 71% | 0.706 | S | S | * | * | trans | -69.5 | 118.9 | 152.8 | -57.9 | 0 | 0 | 0 | 0 | 108.1 | C222 G226 | C222-S224 PolarHBondContact O-N 2.99Å; S224-G226 PolarHBondContact O-N 3.13Å | ||
| 225 | P | 41 | Very low | 45.1 | Very low | 109 Ų | 109 | 128.6 Ų | 128.6 | 71% | 0.708 | 71% | 0.709 | S | S | * | * | trans | -84.8 | 99.2 | 168 | 30.8 | -23.5 | 0 | 0 | 0 | 107.6 | F223 | F223-P225 WeakPolarHBondContact O-CD 3.34Š| ||
| 226 | G | 39.6 | Very low | 44.7 | Very low | 80 Ų | 80 | 120 Ų | 120 | 83% | 0.825 | 70% | 0.697 | S | S | * | * | trans | 164.2 | 98.5 | 174.5 | 0 | 0 | 0 | 0 | 0 | 114.6 | S224 | S224-G226 PolarHBondContact O-N 3.13Š| ||
| 227 | G | 42 | Very low | 44.5 | Very low | 69 Ų | 69 | 119.4 Ų | 119.4 | 71% | 0.711 | 70% | 0.701 | S | S | * | * | trans | 169.3 | 105.4 | 166.7 | 0 | 0 | 0 | 0 | 0 | 111.2 | Q229 | G227-Q229 PolarHBondContact O-N 3.21Š| ||
| 228 | P | 47.4 | Very low | 44.2 | Very low | 130 Ų | 130 | 117.6 Ų | 117.6 | 84% | 0.844 | 71% | 0.711 | S | S | * | * | trans | -67.2 | 128 | 175.7 | 27.3 | -30.1 | 0 | 0 | 0 | 109 | G230 | P228-G230 PolarHBondContact O-N 2.98Š| ||
| 229 | Q | 43.5 | Very low | 44.2 | Very low | 206 Ų | 206 | 117.6 Ų | 117.6 | 96% | 0.963 | 73% | 0.729 | S | S | * | * | trans | -76.7 | 78.9 | 174.7 | -142.4 | 169.5 | 55.6 | 0 | 0 | 108.6 | G227 R231 | G227-Q229 PolarHBondContact O-N 3.21Å; Q229-R231 PolarHBondContact O-N 2.98Å | ||
| 230 | G | 41.5 | Very low | 44.5 | Very low | 67 Ų | 67 | 121.1 Ų | 121.1 | 69% | 0.691 | 74% | 0.742 | S | S | * | * | trans | -76.9 | 108.9 | 171.8 | 0 | 0 | 0 | 0 | 0 | 111.2 | P228 | P228-G230 PolarHBondContact O-N 2.98Š| ||
| 231 | R | 44.4 | Very low | 44.5 | Very low | 250 Ų | 250 | 121.7 Ų | 121.7 | 94% | 0.943 | 77% | 0.766 | S | S | * | * | trans | 22.4 | 119.2 | 130.5 | -150.6 | 178.1 | -166.9 | -176.9 | 3 | 118.2 | Q229 | Q229-R231 PolarHBondContact O-N 2.98Š| ||
| 232 | G | 37 | Very low | 44.5 | Very low | 70 Ų | 70 | 121.9 Ų | 121.9 | 72% | 0.722 | 78% | 0.784 | S | S | * | * | trans | 105.1 | 126 | 144.1 | 0 | 0 | 0 | 0 | 0 | 116.2 | ||||
| 233 | G | 40.1 | Very low | 45.2 | Very low | 72 Ų | 72 | 128.4 Ų | 128.4 | 74% | 0.742 | 81% | 0.808 | S | S | * | * | trans | 163.4 | 75.6 | 171.3 | 0 | 0 | 0 | 0 | 0 | 114 | ||||
| 234 | Y | 42.4 | Very low | 45.4 | Very low | 226 Ų | 226 | 126.1 Ų | 126.1 | 89% | 0.886 | 82% | 0.82 | S | S | * | * | trans | -71.9 | 131.8 | 173.2 | -35.4 | -91.4 | 0 | 0 | 0 | 110.6 | ||||
| 235 | S | 46.7 | Very low | 45.9 | Very low | 117 Ų | 117 | 130.1 Ų | 130.1 | 82% | 0.818 | 83% | 0.83 | S | S | * | * | trans | -161.4 | 117.5 | 155.5 | 43.8 | 0 | 0 | 0 | 0 | 104.8 | ||||
| 236 | G | 41.7 | Very low | 46.7 | Very low | 65 Ų | 65 | 130.2 Ų | 130.2 | 67% | 0.67 | 83% | 0.831 | S | S | * | * | cis | 92.2 | 124.9 | 48 | 0 | 0 | 0 | 0 | 0 | 107.3 | ||||
| 237 | F | 47.5 | Very low | 47.3 | Very low | 226 Ų | 226 | 134.6 Ų | 134.6 | 99% | 0.991 | 83% | 0.832 | S | S | * | * | trans | 87.8 | 123.4 | -168.7 | -68.7 | -94.3 | 0 | 0 | 0 | 114.3 | ||||
| 238 | G | 42.7 | Very low | 48 | Very low | 79 Ų | 79 | 138.6 Ų | 138.6 | 81% | 0.814 | 84% | 0.842 | S | S | * | * | cis | 148.2 | 132.1 | 8.8 | 0 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 239 | G | 46.9 | Very low | 48.2 | Very low | 76 Ų | 76 | 134.9 Ų | 134.9 | 78% | 0.784 | 83% | 0.827 | S | S | * | * | trans | 129.2 | 105 | 159.7 | 0 | 0 | 0 | 0 | 0 | 117.9 | ||||
| 240 | R | 51.5 | Low | 48.5 | Very low | 255 Ų | 255 | 134.9 Ų | 134.9 | 96% | 0.962 | 82% | 0.824 | S | S | * | * | trans | 74.9 | 122.3 | 135.1 | -83.2 | -175.2 | 170.2 | -177 | -2.4 | 121.6 | ||||
| 241 | G | 47 | Very low | 49.4 | Very low | 86 Ų | 86 | 141.8 Ų | 141.8 | 89% | 0.887 | 85% | 0.853 | S | S | * | * | trans | 98.9 | 122.5 | 145.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 242 | G | 51.7 | Low | 49.6 | Very low | 71 Ų | 71 | 136.4 Ų | 136.4 | 73% | 0.732 | 85% | 0.849 | S | S | * | * | cis | 157.8 | 134.1 | 8.4 | 0 | 0 | 0 | 0 | 0 | 106.7 | ||||
| 243 | Q | 59.3 | Low | 50.3 | Low | 210 Ų | 210 | 139.9 Ų | 139.9 | 98% | 0.981 | 86% | 0.856 | S | S | * | * | trans | 66.1 | 126.5 | 160.1 | -56.3 | -179.2 | 24.7 | 0 | 0 | 118.9 | ||||
| 244 | G | 51.1 | Low | 50.9 | Low | 80 Ų | 80 | 143.7 Ų | 143.7 | 83% | 0.825 | 86% | 0.862 | S | S | * | * | trans | 156 | 94.5 | 165.8 | 0 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 245 | M | 58.5 | Low | 51.4 | Low | 189 Ų | 189 | 138.8 Ų | 138.8 | 93% | 0.931 | 86% | 0.86 | S | S | * | * | trans | -68.4 | 170.9 | -167.6 | -76.2 | 148 | 76.5 | 0 | 0 | 116.1 | ||||
| 246 | P | 58.2 | Low | 51.6 | Low | 111 Ų | 111 | 140.2 Ų | 140.2 | 72% | 0.721 | 86% | 0.863 | S | S | * | * | trans | -110.4 | 168.8 | -149.3 | 42.3 | -34.6 | 0 | 0 | 0 | 116.2 | ||||
| 247 | M | 52.9 | Low | 52.3 | Low | 172 Ų | 172 | 145.2 Ų | 145.2 | 85% | 0.847 | 88% | 0.876 | S | S | * | * | trans | 60.6 | 119.3 | 144.9 | -70.5 | -77.1 | -146.6 | 0 | 0 | 120.1 | ||||
| 248 | V | 55.5 | Low | 52.6 | Low | 153 Ų | 153 | 139.4 Ų | 139.4 | 93% | 0.927 | 87% | 0.868 | S | S | * | * | -148 | 126 | 119.7 | -145.6 | 0 | 0 | 0 | 0 | 108.7 | |||||
| 249 | G | 51.5 | Low | 53.4 | Low | 51 Ų | 51 | 144.1 Ų | 144.1 | 53% | 0.526 | 87% | 0.872 | S | S | . | * | trans | -122.3 | 169.4 | 170.3 | 0 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 250 | F | 51.3 | Low | 54 | Low | 206 Ų | 206 | 149.8 Ų | 149.8 | 90% | 0.904 | 88% | 0.879 | S | S | * | * | trans | 82.9 | 98.3 | 167.9 | -64.6 | -82.3 | 0 | 0 | 0 | 117.8 | ||||
| 251 | T | 59 | Low | 54.2 | Low | 213 Ų | 213 | 140.2 Ų | 140.2 | 100% | 1.307 | 87% | 0.872 | S | S | * | * | -119.9 | 0 | 100.1 | 36.6 | 0 | 0 | 0 | 0 | 109.1 |
Retrieved 251 of 251 residues in 59.4 ms
(Link to these results)