| 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 | 39.3 | Very low | 40.4 | Very low | 248 Ų | 248 | 157.5 Ų | 157.5 | 100% | 1.222 | 81% | 0.811 | S | S | * | * | 0 | 129.6 | 0 | -83.5 | 157.1 | 66.4 | 0 | 0 | 108.2 | |||||
| 2 | F | 37 | Very low | 40.2 | Very low | 189 Ų | 189 | 150.3 Ų | 150.3 | 83% | 0.829 | 80% | 0.803 | S | S | * | * | trans | -67.9 | 149.1 | -179.3 | -94.3 | -102.9 | 0 | 0 | 0 | 113.4 | ||||
| 3 | Q | 38.2 | Very low | 40.2 | Very low | 178 Ų | 178 | 151.3 Ų | 151.3 | 83% | 0.832 | 81% | 0.808 | S | S | * | * | 168.4 | 103.2 | 118.8 | -102.3 | 172.2 | -75.3 | 0 | 0 | 108.9 | |||||
| 4 | T | 46.4 | Very low | 40.3 | Very low | 121 Ų | 121 | 153.1 Ų | 153.1 | 74% | 0.742 | 82% | 0.816 | S | S | * | * | 56.4 | 129.1 | 85.1 | 52.7 | 0 | 0 | 0 | 0 | 117 | |||||
| 5 | G | 38.9 | Very low | 40.4 | Very low | 70 Ų | 70 | 148.5 Ų | 148.5 | 72% | 0.722 | 81% | 0.807 | S | S | * | * | trans | 152.9 | 59.7 | 166.5 | 0 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 6 | V | 40.3 | Very low | 40.5 | Very low | 125 Ų | 125 | 149.9 Ų | 149.9 | 76% | 0.758 | 81% | 0.807 | S | S | * | * | 65.2 | 99.8 | 111.4 | -176.9 | 0 | 0 | 0 | 0 | 114.7 | I8 | V6-I8 HydrophobicContact CG1-CD1 4.28Å; V6-I8 HydrophobicContact CG1-CG1 3.82Å | |||
| 7 | L | 39.2 | Very low | 40.4 | Very low | 162 Ų | 162 | 150.5 Ų | 150.5 | 85% | 0.848 | 81% | 0.808 | S | S | * | * | trans | -106.8 | 110.7 | 159.5 | -144.6 | 94.4 | 0 | 0 | 0 | 107.4 | V9 | L7-V9 HydrophobicContact CD2-CG2 4.02Å; L7-V9 PolarHBondContact O-N 3.01Å | ||
| 8 | I | 49 | Very low | 40.2 | Very low | 130 Ų | 130 | 152.1 Ų | 152.1 | 67% | 0.667 | 81% | 0.812 | S | S | * | * | trans | -83 | 108.3 | 173.8 | -65.5 | 171.6 | 0 | 0 | 0 | 107.3 | V6 F10 | V6-I8 HydrophobicContact CG1-CD1 4.28Å; V6-I8 HydrophobicContact CG1-CG1 3.82Å; I8-F10 HydrophobicContact CG2-CD2 3.49Å; I8-F10 VanDerWaalsContact CG2-CD2 3.49Å; I8-F10 HydrophobicContact CG2-CE2 3.7Å | ||
| 9 | V | 40.2 | Very low | 39.9 | Very low | 98 Ų | 98 | 149.1 Ų | 149.1 | 59% | 0.594 | 81% | 0.81 | S | S | * | * | trans | -107.8 | 104.3 | 165.9 | 178.4 | 0 | 0 | 0 | 0 | 106.5 | L7 Y11 | L7-V9 HydrophobicContact CD2-CG2 4.02Å; L7-V9 PolarHBondContact O-N 3.01Å; V9-Y11 HydrophobicContact CG1-CD2 3.99Å; V9-Y11 HydrophobicContact CG1-CE2 4.24Å; V9-Y11 PolarHBondContact O-N 3.27Å | ||
| 10 | F | 38.4 | Very low | 39.9 | Very low | 194 Ų | 194 | 150.6 Ų | 150.6 | 85% | 0.851 | 81% | 0.812 | S | S | * | * | trans | -78.4 | 107.6 | 167.6 | -95.2 | -82.2 | 0 | 0 | 0 | 108.9 | I8 | I8-F10 HydrophobicContact CG2-CD2 3.49Å; I8-F10 VanDerWaalsContact CG2-CD2 3.49Å; I8-F10 HydrophobicContact CG2-CE2 3.7Å | ||
| 11 | Y | 37.8 | Very low | 39.3 | Very low | 218 Ų | 218 | 153.5 Ų | 153.5 | 86% | 0.855 | 82% | 0.818 | S | S | * | * | trans | -78.2 | 141.3 | 159.7 | -101.5 | -95.7 | 0 | 0 | 0 | 109.9 | V9 | V9-Y11 HydrophobicContact CG1-CD2 3.99Å; V9-Y11 HydrophobicContact CG1-CE2 4.24Å; V9-Y11 PolarHBondContact O-N 3.27Å | ||
| 12 | G | 38.1 | Very low | 38.8 | Very low | 70 Ų | 70 | 145.1 Ų | 145.1 | 72% | 0.722 | 80% | 0.795 | S | S | * | * | trans | 156.1 | 133 | 161.1 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 13 | L | 39.4 | Very low | 38.6 | Very low | 164 Ų | 164 | 139.8 Ų | 139.8 | 86% | 0.859 | 79% | 0.793 | S | S | * | * | cis | -169.8 | 97.1 | -2.5 | -176.2 | 74.4 | 0 | 0 | 0 | 103.1 | A15 | L13-A15 VanDerWaalsContact C-N 3.3Å; L13-A15 PolarHBondContact O-N 3.32Å | ||
| 14 | L | 42.4 | Very low | 38.2 | Very low | 177 Ų | 177 | 139.7 Ų | 139.7 | 93% | 0.927 | 80% | 0.797 | S | S | * | * | trans | -84 | 80 | -177.9 | -131.6 | 139.4 | 0 | 0 | 0 | 108.2 | Q16 | L14-Q16 PolarHBondContact O-N 2.49Š| ||
| 15 | A | 40.6 | Very low | 37.8 | Very low | 83 Ų | 83 | 139 Ų | 139 | 69% | 0.686 | 80% | 0.795 | S | S | * | * | trans | -76.2 | 108.3 | 174.1 | 0 | 0 | 0 | 0 | 0 | 109.5 | L13 | L13-A15 VanDerWaalsContact C-N 3.3Å; L13-A15 PolarHBondContact O-N 3.32Å | ||
| 16 | Q | 43 | Very low | 37.8 | Very low | 171 Ų | 171 | 141.5 Ų | 141.5 | 80% | 0.799 | 80% | 0.796 | S | S | * | * | trans | -63.8 | 135.5 | 161.4 | -67 | 178.4 | -30.4 | 0 | 0 | 109.6 | L14 | L14-Q16 PolarHBondContact O-N 2.49Š| ||
| 17 | I | 39.3 | Very low | 37.4 | Very low | 161 Ų | 161 | 141.5 Ų | 141.5 | 83% | 0.826 | 80% | 0.798 | S | S | * | * | trans | -127.3 | 98.3 | 151.3 | -64.8 | -179.1 | 0 | 0 | 0 | 107.3 | ||||
| 18 | M | 35.5 | Very low | 37.6 | Very low | 178 Ų | 178 | 140.9 Ų | 140.9 | 88% | 0.877 | 80% | 0.795 | S | S | * | * | trans | -75.3 | 122.5 | 156.6 | -75.5 | -93.6 | -110.5 | 0 | 0 | 107.4 | ||||
| 19 | A | 35.7 | Very low | 37.1 | Very low | 95 Ų | 95 | 141.6 Ų | 141.6 | 79% | 0.785 | 80% | 0.8 | S | S | * | * | trans | -120.8 | 109 | 158.4 | 0 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 20 | Q | 39.2 | Very low | 36.8 | Very low | 179 Ų | 179 | 145.6 Ų | 145.6 | 84% | 0.836 | 81% | 0.812 | S | S | * | * | trans | -63.8 | 146.7 | 172.6 | -75 | 162.8 | -74.1 | 0 | 0 | 111.4 | ||||
| 21 | F | 28.4 | Very low | 36.8 | Very low | 213 Ų | 213 | 141.5 Ų | 141.5 | 93% | 0.934 | 81% | 0.814 | S | S | * | * | -171.6 | 109.1 | 127.8 | -116.4 | -87.2 | 0 | 0 | 0 | 105.8 | |||||
| 22 | G | 28.1 | Very low | 36.4 | Very low | 72 Ų | 72 | 138.4 Ų | 138.4 | 74% | 0.742 | 81% | 0.812 | S | S | * | * | 103.4 | 106 | 85.2 | 0 | 0 | 0 | 0 | 0 | 107.9 | |||||
| 23 | G | 33.5 | Very low | 36.4 | Very low | 76 Ų | 76 | 140.4 Ų | 140.4 | 78% | 0.784 | 81% | 0.812 | S | S | * | * | trans | -73.5 | 147.2 | -172.4 | 0 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 24 | L | 29.6 | Very low | 36 | Very low | 176 Ų | 176 | 140.5 Ų | 140.5 | 92% | 0.921 | 81% | 0.812 | S | S | * | * | trans | -172.7 | 160.4 | 137.5 | -121.6 | 88.6 | 0 | 0 | 0 | 108.7 | ||||
| 25 | P | 37.6 | Very low | 35.7 | Very low | 107 Ų | 107 | 138.3 Ų | 138.3 | 70% | 0.695 | 81% | 0.807 | S | S | * | * | trans | -85.3 | 154.8 | -155.4 | 35.4 | -36.9 | 0 | 0 | 0 | 115.3 | ||||
| 26 | V | 39 | Very low | 35.8 | Very low | 123 Ų | 123 | 140.4 Ų | 140.4 | 75% | 0.745 | 81% | 0.811 | S | S | * | * | trans | 10.9 | 133.1 | 153.6 | -173.4 | 0 | 0 | 0 | 0 | 117.8 | ||||
| 27 | P | 31.9 | Very low | 35.6 | Very low | 125 Ų | 125 | 138.5 Ų | 138.5 | 81% | 0.812 | 81% | 0.806 | S | S | * | * | -120.2 | 144.6 | 125.6 | 11.4 | 8.5 | 0 | 0 | 0 | 112.3 | |||||
| 28 | L | 42.4 | Very low | 36 | Very low | 149 Ų | 149 | 135.4 Ų | 135.4 | 78% | 0.78 | 80% | 0.796 | S | S | * | * | trans | -50.8 | 160 | 169.2 | -122.5 | 73 | 0 | 0 | 0 | 112.6 | ||||
| 29 | D | 38.1 | Very low | 36.8 | Very low | 145 Ų | 145 | 132.7 Ų | 132.7 | 78% | 0.775 | 79% | 0.792 | S | S | * | * | trans | 83.7 | 99.2 | 168.3 | -72.6 | -40.9 | 0 | 0 | 0 | 118.3 | ||||
| 30 | Q | 34.4 | Very low | 37.4 | Very low | 182 Ų | 182 | 135.6 Ų | 135.6 | 85% | 0.85 | 79% | 0.794 | S | S | * | * | -169.7 | 101.3 | 129.9 | -101.1 | 160.5 | 11.4 | 0 | 0 | 110.3 | L32 | Q30-L32 PolarHBondContact O-N 3.16Å; Q30-L32 VanDerWaalsContact O-N 3.13Å | |||
| 31 | A | 38 | Very low | 38.1 | Very low | 108 Ų | 108 | 132.9 Ų | 132.9 | 89% | 0.893 | 79% | 0.791 | S | S | * | * | trans | -67.7 | 101.4 | 166.8 | 0 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 32 | L | 30.6 | Very low | 39.5 | Very low | 153 Ų | 153 | 126.8 Ų | 126.8 | 80% | 0.801 | 77% | 0.768 | S | S | * | * | trans | -80.8 | 129.3 | 164.2 | -94.8 | 135.9 | 0 | 0 | 0 | 108.8 | Q30 L34 | Q30-L32 PolarHBondContact O-N 3.16Å; Q30-L32 VanDerWaalsContact O-N 3.13Å; L32-L34 PolarHBondContact O-N 2.94Å | ||
| 33 | P | 37.9 | Very low | 41.3 | Very low | 112 Ų | 112 | 126.8 Ų | 126.8 | 73% | 0.727 | 76% | 0.756 | S | S | * | * | trans | -69 | 127.9 | 179.4 | 27.9 | -30.8 | 0 | 0 | 0 | 109.3 | T35 | P33-T35 PolarHBondContact O-N 3.09Å; P33-T35 VanDerWaalsContact O-N 3.08Å | ||
| 34 | L | 31.9 | Very low | 42.6 | Very low | 165 Ų | 165 | 126.4 Ų | 126.4 | 86% | 0.864 | 74% | 0.74 | S | S | * | * | trans | -56.4 | 112.5 | 168.5 | -70.9 | 162.9 | 0 | 0 | 0 | 108.2 | L32 V36 | L32-L34 PolarHBondContact O-N 2.94Å; L34-V36 VanDerWaalsContact C-N 3.3Å; L34-V36 PolarHBondContact O-N 3.19Å | ||
| 35 | T | 34.4 | Very low | 44.3 | Very low | 132 Ų | 132 | 122 Ų | 122 | 81% | 0.81 | 72% | 0.721 | S | S | * | * | trans | -60.5 | 96.7 | 167.8 | -51.6 | 0 | 0 | 0 | 0 | 107.6 | P33 N37 | P33-T35 PolarHBondContact O-N 3.09Å; P33-T35 VanDerWaalsContact O-N 3.08Å; T35-N37 VanDerWaalsContact C-N 3.33Å; T35-N37 PolarHBondContact O-N 3.18Å | ||
| 36 | V | 44.5 | Very low | 46.4 | Very low | 126 Ų | 126 | 118 Ų | 118 | 76% | 0.764 | 70% | 0.699 | S | S | * | * | trans | -65.8 | 100.5 | 166.6 | -179.7 | 0 | 0 | 0 | 0 | 105.4 | L34 P38 | L34-V36 VanDerWaalsContact C-N 3.3Å; L34-V36 PolarHBondContact O-N 3.19Å; V36-P38 WeakPolarHBondContact O-CD 3.2Å | ||
| 37 | N | 37.5 | Very low | 48.7 | Very low | 131 Ų | 131 | 112.6 Ų | 112.6 | 70% | 0.701 | 67% | 0.666 | S | S | * | * | P | Polyproline II helix | trans | -58.1 | 121.2 | 171.8 | -143.2 | 28.3 | 0 | 0 | 0 | 106.6 | T35 | T35-N37 VanDerWaalsContact C-N 3.33Å; T35-N37 PolarHBondContact O-N 3.18Å |
| 38 | P | 47.1 | Very low | 51.5 | Low | 96 Ų | 96 | 107.3 Ų | 107.3 | 62% | 0.623 | 63% | 0.633 | S | S | * | * | P | Polyproline II helix | trans | -58.5 | 139.9 | 176.6 | -19.4 | 30.1 | 0 | 0 | 0 | 108.9 | V36 L40 | V36-P38 WeakPolarHBondContact O-CD 3.2Å; P38-L40 PolarHBondContact O-N 3.23Å; P38-L40 VanDerWaalsContact O-N 3.15Å |
| 39 | P | 53.4 | Low | 53.8 | Low | 121 Ų | 121 | 101.7 Ų | 101.7 | 79% | 0.786 | 61% | 0.61 | S | S | * | * | P | Polyproline II helix | trans | -54.8 | 125.6 | 169.8 | 22.8 | -30.9 | 0 | 0 | 0 | 108.1 | ||
| 40 | L | 48.9 | Very low | 56.5 | Low | 157 Ų | 157 | 96.7 Ų | 96.7 | 82% | 0.822 | 59% | 0.587 | S | S | * | * | P | Polyproline II helix | trans | -51.8 | 131 | 177 | -79.2 | 138 | 0 | 0 | 0 | 108.8 | P38 L42 | P38-L40 PolarHBondContact O-N 3.23Å; P38-L40 VanDerWaalsContact O-N 3.15Å; L40-L42 PolarHBondContact O-N 3.32Å |
| 41 | P | 52.9 | Low | 59.4 | Low | 121 Ų | 121 | 88 Ų | 88 | 79% | 0.786 | 55% | 0.546 | S | S | * | . | P | Polyproline II helix | trans | -58.2 | 125.5 | 177.5 | 22.2 | -30.5 | 0 | 0 | 0 | 108.9 | S43 | P41-S43 PolarHBondContact O-N 2.75Š|
| 42 | L | 58.3 | Low | 62.1 | Low | 86 Ų | 86 | 84.1 Ų | 84.1 | 45% | 0.45 | 51% | 0.511 | S | S | . | . | P | Polyproline II helix | trans | -54.1 | 122.9 | 175.3 | -81.8 | 147.7 | 0 | 0 | 0 | 108.2 | L40 L47 | L40-L42 PolarHBondContact O-N 3.32Å; L42-L47 HydrophobicContact CB-CD2 3.87Å; L42-L47 HydrophobicContact CB-CG 4.22Å; L42-L47 HydrophobicContact CD1-CD2 4.03Å; L42-L47 HydrophobicContact CG-CD2 4.46Å |
| 43 | S | 64.6 | Low | 65.2 | Low | 71 Ų | 71 | 81.6 Ų | 81.6 | 50% | 0.497 | 50% | 0.499 | S | S | . | . | P | Polyproline II helix | trans | -60.7 | 149.6 | 171.9 | 58.1 | 0 | 0 | 0 | 0 | 109.2 | P41 T45 G46 L47 | P41-S43 PolarHBondContact O-N 2.75Å; S43-T45 PolarHBondContact O-N 3.4Å; S43-T45 VanDerWaalsContact O-N 3.13Å; S43-G46 VanDerWaalsContact O-CA 3.31Å; S43-G46 WeakPolarHBondContact O-CA 3.37Å; S43-G46 PolarHBondContact O-N 2.98Å; S43-G46 PolarHBondContact OG-N 3.12Å; S43-L47 PolarHBondContact O-N 3.2Å |
| 44 | P | 61.3 | Low | 68 | Low | 69 Ų | 69 | 77.6 Ų | 77.6 | 45% | 0.448 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -53.3 | -37.7 | -178.7 | -27.6 | 34.2 | 0 | 0 | 0 | 113.3 | G46 L47 F251 | P44-G46 VanDerWaalsContact C-N 3.32Å; P44-G46 PolarHBondContact O-N 3.37Å; P44-L47 PolarHBondContact O-N 2.81Å; P44-F251 HydrophobicContact CB-CB 3.86Å |
| 45 | T | 64.9 | Low | 71 | Confident | 82 Ų | 82 | 70 Ų | 70 | 50% | 0.503 | 44% | 0.436 | S | S | . | . | H | α-helix | trans | -66.7 | -33 | 174.4 | -44 | 0 | 0 | 0 | 0 | 112.6 | S43 L47 G49 I253 | S43-T45 PolarHBondContact O-N 3.4Å; S43-T45 VanDerWaalsContact O-N 3.13Å; T45-L47 VanDerWaalsContact C-N 3.32Å; T45-L47 PolarHBondContact O-N 3.41Å; T45-G49 PolarHBondContact O-N 2.91Å; T45-I253 HydrophobicContact CG2-CD1 3.98Å; T45-I253 WeakPolarHBondContact OG1-CD1 3.14Å |
| 46 | G | 82.3 | Confident | 74 | Confident | 23 Ų | 23 | 65.1 Ų | 65.1 | 24% | 0.237 | 41% | 0.407 | C | S | . | . | H | α-helix | trans | -66.8 | -30.6 | 175.4 | 0 | 0 | 0 | 0 | 0 | 113.3 | S43 P44 S50 | S43-G46 VanDerWaalsContact O-CA 3.31Å; S43-G46 WeakPolarHBondContact O-CA 3.37Å; S43-G46 PolarHBondContact O-N 2.98Å; S43-G46 PolarHBondContact OG-N 3.12Å; P44-G46 VanDerWaalsContact C-N 3.32Å; P44-G46 PolarHBondContact O-N 3.37Å; G46-S50 VanDerWaalsContact O-CB 3.26Å; G46-S50 WeakPolarHBondContact O-CB 3.49Å; G46-S50 PolarHBondContact O-N 3.34Å; G46-S50 PolarHBondContact O-OG 2.79Å |
| 47 | L | 87.8 | Confident | 76.6 | Confident | 11 Ų | 11 | 64 Ų | 64 | 6% | 0.058 | 40% | 0.397 | C | S | . | . | H | α-helix | trans | -66.4 | -45 | 177.5 | -68.1 | 173.2 | 0 | 0 | 0 | 112.1 | L42 S43 P44 T45 S50 L51 L237 D240 M244 F251 | L42-L47 HydrophobicContact CB-CD2 3.87Å; L42-L47 HydrophobicContact CB-CG 4.22Å; L42-L47 HydrophobicContact CD1-CD2 4.03Å; L42-L47 HydrophobicContact CG-CD2 4.46Å; S43-L47 PolarHBondContact O-N 3.2Å; P44-L47 PolarHBondContact O-N 2.81Å; T45-L47 VanDerWaalsContact C-N 3.32Å; T45-L47 PolarHBondContact O-N 3.41Å; L47-S50 PolarHBondContact O-N 2.88Å; L47-L51 PolarHBondContact O-N 2.98Å; L47-L237 HydrophobicContact CD2-CD1 4.16Å; L47-D240 HydrophobicContact CD2-CB 4.01Å; L47-M244 HydrophobicContact CD1-CG 4.35Å; L47-F251 HydrophobicContact CB-CD2 4.07Å; L47-F251 HydrophobicContact CB-CE2 4.3Å |
| 48 | A | 90.2 | Very high | 79.4 | Confident | 14 Ų | 14 | 58.5 Ų | 58.5 | 12% | 0.116 | 37% | 0.37 | C | S | . | . | H | α-helix | trans | -59.5 | -49 | 178.2 | 0 | 0 | 0 | 0 | 0 | 111.6 | L51 T52 L119 F251 V252 | A48-L51 PolarHBondContact O-N 2.94Å; A48-T52 PolarHBondContact O-N 2.9Å; A48-T52 VanDerWaalsContact O-N 3.09Å; A48-T52 PolarHBondContact O-OG1 2.94Å; A48-L119 HydrophobicContact CB-CD2 3.87Å; A48-F251 HydrophobicContact CB-CD2 4.16Å; A48-F251 HydrophobicContact CB-CE2 4.26Å; A48-V252 HydrophobicContact CB-CG2 4.2Å |
| 49 | G | 91.5 | Very high | 81.8 | Confident | 30 Ų | 30 | 54 Ų | 54 | 31% | 0.309 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -66.6 | -35.3 | 176.9 | 0 | 0 | 0 | 0 | 0 | 113.4 | T45 T52 N53 | T45-G49 PolarHBondContact O-N 2.91Å; G49-T52 WeakPolarHBondContact CA-OG1 3.5Å; G49-T52 PolarHBondContact O-OG1 2.78Å; G49-N53 VanDerWaalsContact O-CB 3.29Å; G49-N53 WeakPolarHBondContact O-CB 3.44Å; G49-N53 PolarHBondContact O-N 3.23Å; G49-N53 PolarHBondContact O-ND2 2.93Å; G49-N53 VanDerWaalsContact O-ND2 3.11Å |
| 50 | S | 94.1 | Very high | 83.9 | Confident | 40 Ų | 40 | 51.8 Ų | 51.8 | 28% | 0.28 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -66.3 | -39.4 | 175.6 | -60.1 | 0 | 0 | 0 | 0 | 111.6 | G46 L47 A54 | G46-S50 VanDerWaalsContact O-CB 3.26Å; G46-S50 WeakPolarHBondContact O-CB 3.49Å; G46-S50 PolarHBondContact O-N 3.34Å; G46-S50 PolarHBondContact O-OG 2.79Å; L47-S50 PolarHBondContact O-N 2.88Å; S50-A54 VanDerWaalsContact O-CB 3.26Å; S50-A54 WeakPolarHBondContact O-CB 3.3Å; S50-A54 PolarHBondContact O-N 2.92Å |
| 51 | L | 94.4 | Very high | 86.2 | Confident | 0 Ų | 0 | 49.3 Ų | 49.3 | 0% | 0 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -63.2 | -50.9 | 175.2 | 179.2 | 62.6 | 0 | 0 | 0 | 111.7 | L47 A48 N53 A54 L55 L119 L128 I162 L233 I241 | L47-L51 PolarHBondContact O-N 2.98Å; A48-L51 PolarHBondContact O-N 2.94Å; L51-N53 VanDerWaalsContact C-N 3.29Å; L51-N53 PolarHBondContact O-N 2.85Å; L51-A54 PolarHBondContact O-N 3.29Å; L51-L55 HydrophobicContact CD1-CD1 3.87Å; L51-L55 HydrophobicContact CD1-CG 3.97Å; L51-L55 HydrophobicContact CD2-CD1 4.47Å; L51-L55 HydrophobicContact CG-CD1 3.86Å; L51-L55 HydrophobicContact CG-CG 4.34Å; L51-L55 WeakPolarHBondContact O-CB 3.44Å; L51-L55 WeakPolarHBondContact O-CG 3.11Å; L51-L55 PolarHBondContact O-N 2.87Å; L51-L119 HydrophobicContact CD2-CD1 4.1Å; L51-L119 HydrophobicContact CD2-CD2 4.19Å; L51-L128 HydrophobicContact CD2-CD1 3.54Å; L51-I162 HydrophobicContact CD2-CD1 4.34Å; L51-L233 HydrophobicContact CD1-CD1 3.86Å; L51-I241 HydrophobicContact CB-CD1 3.72Å; L51-I241 HydrophobicContact CD1-CD1 3.8Å; L51-I241 HydrophobicContact CD2-CD1 4.11Å; L51-I241 HydrophobicContact CG-CD1 4.06Å |
| 52 | T | 95.4 | Very high | 88.2 | Confident | 26 Ų | 26 | 45.2 Ų | 45.2 | 16% | 0.16 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -62.1 | -39.7 | -179.3 | 52.7 | 0 | 0 | 0 | 0 | 111.3 | A48 G49 S56 L117 L119 | A48-T52 PolarHBondContact O-N 2.9Å; A48-T52 VanDerWaalsContact O-N 3.09Å; A48-T52 PolarHBondContact O-OG1 2.94Å; G49-T52 WeakPolarHBondContact CA-OG1 3.5Å; G49-T52 PolarHBondContact O-OG1 2.78Å; T52-S56 VanDerWaalsContact O-CB 3.23Å; T52-S56 WeakPolarHBondContact O-CB 3.38Å; T52-S56 PolarHBondContact O-N 3.32Å; T52-L117 HydrophobicContact CG2-CB 4.39Å; T52-L119 HydrophobicContact CG2-CB 3.76Å; T52-L119 HydrophobicContact CG2-CD2 4.15Å; T52-L119 HydrophobicContact CG2-CG 4.46Å |
| 53 | N | 95.7 | Very high | 90 | Very high | 100 Ų | 100 | 42.6 Ų | 42.6 | 54% | 0.535 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -64.5 | -46.2 | 174.7 | -72.1 | -23.4 | 0 | 0 | 0 | 112.1 | G49 L51 S56 N57 | G49-N53 VanDerWaalsContact O-CB 3.29Å; G49-N53 WeakPolarHBondContact O-CB 3.44Å; G49-N53 PolarHBondContact O-N 3.23Å; G49-N53 PolarHBondContact O-ND2 2.93Å; G49-N53 VanDerWaalsContact O-ND2 3.11Å; L51-N53 VanDerWaalsContact C-N 3.29Å; L51-N53 PolarHBondContact O-N 2.85Å; N53-S56 PolarHBondContact O-N 2.86Å; N53-N57 VanDerWaalsContact O-CB 3.28Å; N53-N57 WeakPolarHBondContact O-CB 3.47Å; N53-N57 PolarHBondContact O-N 3Å; N53-N57 PolarHBondContact O-ND2 2.88Å |
| 54 | A | 96 | Very high | 91.6 | Very high | 29 Ų | 29 | 39.2 Ų | 39.2 | 24% | 0.24 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -63 | -42.9 | 178.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | S50 L51 G58 L233 L237 | S50-A54 VanDerWaalsContact O-CB 3.26Å; S50-A54 WeakPolarHBondContact O-CB 3.3Å; S50-A54 PolarHBondContact O-N 2.92Å; L51-A54 PolarHBondContact O-N 3.29Å; A54-G58 PolarHBondContact O-N 3.42Å; A54-L233 HydrophobicContact CB-CD2 3.61Å; A54-L237 HydrophobicContact CB-CD2 3.95Å |
| 55 | L | 96.7 | Very high | 93.3 | Very high | 5 Ų | 5 | 38.7 Ų | 38.7 | 3% | 0.026 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -64.5 | -47.7 | 175.7 | -73.4 | 174.5 | 0 | 0 | 0 | 111.9 | L51 N57 G58 L59 L117 V130 I162 V229 L230 | L51-L55 HydrophobicContact CD1-CD1 3.87Å; L51-L55 HydrophobicContact CD1-CG 3.97Å; L51-L55 HydrophobicContact CD2-CD1 4.47Å; L51-L55 HydrophobicContact CG-CD1 3.86Å; L51-L55 HydrophobicContact CG-CG 4.34Å; L51-L55 WeakPolarHBondContact O-CB 3.44Å; L51-L55 WeakPolarHBondContact O-CG 3.11Å; L51-L55 PolarHBondContact O-N 2.87Å; L55-N57 PolarHBondContact O-N 2.97Å; L55-G58 PolarHBondContact O-N 3.36Å; L55-L59 WeakPolarHBondContact O-CB 3.26Å; L55-L59 WeakPolarHBondContact O-CG 3.34Å; L55-L59 PolarHBondContact O-N 3.2Å; L55-L117 HydrophobicContact CB-CD1 3.7Å; L55-V130 HydrophobicContact CD1-CG1 4.2Å; L55-V130 HydrophobicContact CD1-CG2 3.9Å; L55-I162 HydrophobicContact CD1-CD1 4.1Å; L55-V229 HydrophobicContact CD2-CG1 3.98Å; L55-L230 HydrophobicContact CD2-CD2 3.78Å; L55-L230 HydrophobicContact CD2-CG 4.15Å |
| 56 | S | 97.5 | Very high | 94.8 | Very high | 29 Ų | 29 | 36.2 Ų | 36.2 | 20% | 0.203 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -60.1 | -48.7 | 179.2 | -176.1 | 0 | 0 | 0 | 0 | 111.1 | T52 N53 G58 L59 L60 | T52-S56 VanDerWaalsContact O-CB 3.23Å; T52-S56 WeakPolarHBondContact O-CB 3.38Å; T52-S56 PolarHBondContact O-N 3.32Å; N53-S56 PolarHBondContact O-N 2.86Å; S56-G58 PolarHBondContact O-N 3.14Å; S56-L59 PolarHBondContact O-N 3.38Å; S56-L60 WeakPolarHBondContact O-CG 3.47Å; S56-L60 PolarHBondContact O-N 3.45Å |
| 57 | N | 97.4 | Very high | 95.4 | Very high | 104 Ų | 104 | 37.8 Ų | 37.8 | 56% | 0.556 | 25% | 0.254 | S | S | * | . | H | α-helix | trans | -63.6 | -41 | 177.4 | -70.5 | -25.1 | 0 | 0 | 0 | 112.1 | N53 L55 L60 S61 | N53-N57 VanDerWaalsContact O-CB 3.28Å; N53-N57 WeakPolarHBondContact O-CB 3.47Å; N53-N57 PolarHBondContact O-N 3Å; N53-N57 PolarHBondContact O-ND2 2.88Å; L55-N57 PolarHBondContact O-N 2.97Å; N57-L60 PolarHBondContact O-N 3.22Å; N57-S61 VanDerWaalsContact O-CB 3.29Å; N57-S61 WeakPolarHBondContact O-CB 3.39Å; N57-S61 PolarHBondContact O-N 2.81Å; N57-S61 PolarHBondContact O-OG 2.84Å |
| 58 | G | 97.1 | Very high | 95.7 | Very high | 14 Ų | 14 | 37.3 Ų | 37.3 | 14% | 0.144 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -65.1 | -39.8 | 177.1 | 0 | 0 | 0 | 0 | 0 | 113 | A54 L55 S56 S61 G62 V229 | A54-G58 PolarHBondContact O-N 3.42Å; L55-G58 PolarHBondContact O-N 3.36Å; S56-G58 PolarHBondContact O-N 3.14Å; G58-S61 WeakPolarHBondContact CA-OG 3.32Å; G58-S61 PolarHBondContact O-OG 3.05Å; G58-G62 WeakPolarHBondContact O-CA 3.45Å; G58-G62 PolarHBondContact O-N 3.4Å; G58-V229 WeakPolarHBondContact O-CG2 3.49Å |
| 59 | L | 97.8 | Very high | 95.9 | Very high | 2 Ų | 2 | 40.8 Ų | 40.8 | 1% | 0.01 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -64.1 | -45 | 174.9 | -73.5 | 168.9 | 0 | 0 | 0 | 111.2 | L55 S56 G63 L64 L114 L117 I132 L225 V226 | L55-L59 WeakPolarHBondContact O-CB 3.26Å; L55-L59 WeakPolarHBondContact O-CG 3.34Å; L55-L59 PolarHBondContact O-N 3.2Å; S56-L59 PolarHBondContact O-N 3.38Å; L59-G63 PolarHBondContact O-N 2.91Å; L59-L64 HydrophobicContact CB-CB 4.37Å; L59-L64 HydrophobicContact CB-CD2 3.99Å; L59-L64 WeakPolarHBondContact O-CB 3.34Å; L59-L64 PolarHBondContact O-N 3.22Å; L59-L114 HydrophobicContact CB-CD2 4.16Å; L59-L114 HydrophobicContact CD1-CD2 4.26Å; L59-L117 HydrophobicContact CD1-CD1 4.49Å; L59-I132 HydrophobicContact CD1-CD1 4.25Å; L59-I132 HydrophobicContact CD1-CG2 4.15Å; L59-L225 HydrophobicContact CD2-CD2 3.84Å; L59-L225 HydrophobicContact CD2-CG 3.97Å; L59-V226 HydrophobicContact CD2-CG2 3.89Å |
| 60 | L | 97.6 | Very high | 96 | Very high | 75 Ų | 75 | 45.6 Ų | 45.6 | 39% | 0.393 | 28% | 0.284 | S | S | . | . | H | α-helix | trans | -66.5 | -45.6 | 178.5 | -68.2 | 174.8 | 0 | 0 | 0 | 112 | S56 N57 G62 G63 L65 L114 | S56-L60 WeakPolarHBondContact O-CG 3.47Å; S56-L60 PolarHBondContact O-N 3.45Å; N57-L60 PolarHBondContact O-N 3.22Å; L60-G62 VanDerWaalsContact C-N 3.34Å; L60-G63 PolarHBondContact O-N 2.76Å; L60-G63 VanDerWaalsContact O-N 3.12Å; L60-L65 HydrophobicContact CD2-CD1 3.99Å; L60-L65 HydrophobicContact CD2-CD2 4.12Å; L60-L65 HydrophobicContact CD2-CG 3.88Å; L60-L114 HydrophobicContact CD2-CB 4.17Å; L60-L114 HydrophobicContact CD2-CD2 4.15Å; L60-L114 HydrophobicContact CG-CD2 4.06Å |
| 61 | S | 97.3 | Very high | 95.8 | Very high | 104 Ų | 104 | 44.3 Ų | 44.3 | 73% | 0.727 | 27% | 0.274 | S | S | * | . | H | α-helix | trans | -69.9 | -32 | 179.3 | 67.9 | 0 | 0 | 0 | 0 | 112.6 | N57 G58 G63 | N57-S61 VanDerWaalsContact O-CB 3.29Å; N57-S61 WeakPolarHBondContact O-CB 3.39Å; N57-S61 PolarHBondContact O-N 2.81Å; N57-S61 PolarHBondContact O-OG 2.84Å; G58-S61 WeakPolarHBondContact CA-OG 3.32Å; G58-S61 PolarHBondContact O-OG 3.05Å; S61-G63 PolarHBondContact O-N 2.95Å |
| 62 | G | 95.1 | Very high | 95.4 | Very high | 35 Ų | 35 | 46.8 Ų | 46.8 | 36% | 0.361 | 29% | 0.291 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -73.7 | 7.1 | 170.7 | 0 | 0 | 0 | 0 | 0 | 114.1 | G58 L60 | G58-G62 WeakPolarHBondContact O-CA 3.45Å; G58-G62 PolarHBondContact O-N 3.4Å; L60-G62 VanDerWaalsContact C-N 3.34Å |
| 63 | G | 96.2 | Very high | 94.8 | Very high | 32 Ų | 32 | 45.7 Ų | 45.7 | 33% | 0.33 | 28% | 0.284 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 81.3 | 21.8 | 169.2 | 0 | 0 | 0 | 0 | 0 | 114.9 | L59 L60 S61 L65 G66 I67 | L59-G63 PolarHBondContact O-N 2.91Å; L60-G63 PolarHBondContact O-N 2.76Å; L60-G63 VanDerWaalsContact O-N 3.12Å; S61-G63 PolarHBondContact O-N 2.95Å; G63-L65 PolarHBondContact O-N 2.79Å; G63-L65 VanDerWaalsContact O-N 3.12Å; G63-G66 PolarHBondContact O-N 2.97Å; G63-I67 WeakPolarHBondContact O-CG1 3.3Å; G63-I67 PolarHBondContact O-N 2.95Å |
| 64 | L | 97.2 | Very high | 93.7 | Very high | 0 Ų | 0 | 42.4 Ų | 42.4 | 0% | 0 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -45.3 | -46.8 | 179.2 | 173.1 | 64.5 | 0 | 0 | 0 | 112.7 | L59 G66 I67 L68 L114 L134 V222 L225 | L59-L64 HydrophobicContact CB-CB 4.37Å; L59-L64 HydrophobicContact CB-CD2 3.99Å; L59-L64 WeakPolarHBondContact O-CB 3.34Å; L59-L64 PolarHBondContact O-N 3.22Å; L64-G66 PolarHBondContact O-N 2.77Å; L64-I67 WeakPolarHBondContact O-CB 3.37Å; L64-I67 PolarHBondContact O-N 3.35Å; L64-L68 HydrophobicContact CD1-CD1 4.14Å; L64-L68 HydrophobicContact CD1-CG 4.17Å; L64-L68 HydrophobicContact CG-CD1 4.18Å; L64-L68 WeakPolarHBondContact O-CG 3.3Å; L64-L68 PolarHBondContact O-N 3.23Å; L64-L114 HydrophobicContact CD2-CB 4.21Å; L64-L114 HydrophobicContact CD2-CD1 4.05Å; L64-L114 HydrophobicContact CD2-CD2 4.05Å; L64-L114 HydrophobicContact CD2-CG 4.33Å; L64-L134 HydrophobicContact CD2-CD2 3.87Å; L64-V222 HydrophobicContact CD1-CG2 3.72Å; L64-L225 HydrophobicContact CB-CD2 3.78Å; L64-L225 HydrophobicContact CD1-CD2 4.18Å |
| 65 | L | 96.8 | Very high | 92.4 | Very high | 58 Ų | 58 | 46.4 Ų | 46.4 | 30% | 0.304 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -64.7 | -42.2 | -177.3 | -57.8 | -169.4 | 0 | 0 | 0 | 112 | L60 G63 I67 L68 E69 P112 | L60-L65 HydrophobicContact CD2-CD1 3.99Å; L60-L65 HydrophobicContact CD2-CD2 4.12Å; L60-L65 HydrophobicContact CD2-CG 3.88Å; G63-L65 PolarHBondContact O-N 2.79Å; G63-L65 VanDerWaalsContact O-N 3.12Å; L65-I67 VanDerWaalsContact C-N 3.34Å; L65-L68 PolarHBondContact O-N 2.74Å; L65-E69 PolarHBondContact O-N 2.8Å; L65-P112 HydrophobicContact CB-CB 4.31Å; L65-P112 HydrophobicContact CB-CG 3.94Å; L65-P112 HydrophobicContact CD2-CB 4.15Å; L65-P112 WeakPolarHBondContact O-CG 3.48Å |
| 66 | G | 95.9 | Very high | 90.9 | Very high | 30 Ų | 30 | 48.3 Ų | 48.3 | 31% | 0.309 | 29% | 0.293 | S | S | . | . | H | α-helix | trans | -67.6 | -34.8 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | G63 L64 L68 E69 N70 | G63-G66 PolarHBondContact O-N 2.97Å; L64-G66 PolarHBondContact O-N 2.77Å; G66-L68 VanDerWaalsContact C-N 3.35Å; G66-E69 PolarHBondContact O-N 2.87Å; G66-N70 PolarHBondContact O-N 2.8Å; G66-N70 VanDerWaalsContact O-N 3.13Å; G66-N70 PolarHBondContact O-ND2 2.96Å |
| 67 | I | 94.9 | Very high | 89.3 | Confident | 55 Ų | 55 | 48.1 Ų | 48.1 | 28% | 0.282 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -63.3 | -42.5 | 173.8 | -69.7 | 165.8 | 0 | 0 | 0 | 110.8 | G63 L64 L65 K221 L225 | G63-I67 WeakPolarHBondContact O-CG1 3.3Å; G63-I67 PolarHBondContact O-N 2.95Å; L64-I67 WeakPolarHBondContact O-CB 3.37Å; L64-I67 PolarHBondContact O-N 3.35Å; L65-I67 VanDerWaalsContact C-N 3.34Å; I67-K221 HydrophobicContact CG2-CB 3.6Å; I67-K221 HydrophobicContact CG2-CD 4.37Å; I67-K221 HydrophobicContact CG2-CG 4.07Å; I67-L225 HydrophobicContact CD1-CD2 4.12Å |
| 68 | L | 95.1 | Very high | 87.4 | Confident | 1 Ų | 1 | 48.5 Ų | 48.5 | 1% | 0.005 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -67.9 | -39.7 | 176.6 | -67.7 | 175.6 | 0 | 0 | 0 | 112.1 | L64 L65 G66 N70 L71 V109 P112 L134 I136 V218 | L64-L68 HydrophobicContact CD1-CD1 4.14Å; L64-L68 HydrophobicContact CD1-CG 4.17Å; L64-L68 HydrophobicContact CG-CD1 4.18Å; L64-L68 WeakPolarHBondContact O-CG 3.3Å; L64-L68 PolarHBondContact O-N 3.23Å; L65-L68 PolarHBondContact O-N 2.74Å; G66-L68 VanDerWaalsContact C-N 3.35Å; L68-N70 VanDerWaalsContact C-N 3.26Å; L68-N70 PolarHBondContact O-N 2.83Å; L68-L71 HydrophobicContact CD2-CD1 4.14Å; L68-L71 WeakPolarHBondContact O-CD1 3.42Å; L68-L71 VanDerWaalsContact O-CG 3.29Å; L68-L71 WeakPolarHBondContact O-CG 3.35Å; L68-L71 PolarHBondContact O-N 3.3Å; L68-V109 WeakPolarHBondContact O-CG1 3.37Å; L68-P112 HydrophobicContact CB-CB 3.97Å; L68-P112 HydrophobicContact CD1-CB 4.28Å; L68-L134 HydrophobicContact CD1-CD2 4.22Å; L68-I136 HydrophobicContact CB-CG2 4.22Å; L68-I136 HydrophobicContact CD1-CG2 4.24Å; L68-V218 HydrophobicContact CD2-CG1 4.05Å; L68-V218 HydrophobicContact CD2-CG2 4.33Å |
| 69 | E | 94.6 | Very high | 85.1 | Confident | 88 Ų | 88 | 51.8 Ų | 51.8 | 41% | 0.411 | 31% | 0.305 | S | S | . | . | H | α-helix | trans | -63.3 | -33.6 | 178.4 | -164.7 | 175 | -177.1 | 0 | 0 | 112.3 | L65 G66 | L65-E69 PolarHBondContact O-N 2.8Å; G66-E69 PolarHBondContact O-N 2.87Å |
| 70 | N | 92.3 | Very high | 82.5 | Confident | 130 Ų | 130 | 55.5 Ų | 55.5 | 70% | 0.695 | 34% | 0.343 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -99.5 | 26.1 | -176.8 | -65.8 | -73.5 | 0 | 0 | 0 | 113.6 | G66 L68 | G66-N70 PolarHBondContact O-N 2.8Å; G66-N70 VanDerWaalsContact O-N 3.13Å; G66-N70 PolarHBondContact O-ND2 2.96Å; L68-N70 VanDerWaalsContact C-N 3.26Å; L68-N70 PolarHBondContact O-N 2.83Å |
| 71 | L | 89.9 | Confident | 79.5 | Confident | 13 Ų | 13 | 56.1 Ų | 56.1 | 7% | 0.068 | 37% | 0.368 | C | S | . | . | trans | -64.8 | 133.9 | 175.5 | -73.3 | 171 | 0 | 0 | 0 | 110.9 | L68 L73 V109 L214 V218 K221 | L68-L71 HydrophobicContact CD2-CD1 4.14Å; L68-L71 WeakPolarHBondContact O-CD1 3.42Å; L68-L71 VanDerWaalsContact O-CG 3.29Å; L68-L71 WeakPolarHBondContact O-CG 3.35Å; L68-L71 PolarHBondContact O-N 3.3Å; L71-L73 HydrophobicContact CB-CD2 4.29Å; L71-L73 HydrophobicContact CB-CG 4.04Å; L71-L73 PolarHBondContact O-N 3.48Å; L71-V109 HydrophobicContact CB-CG2 4.4Å; L71-L214 HydrophobicContact CD1-CD1 4.41Å; L71-V218 HydrophobicContact CD1-CG2 3.94Å; L71-K221 HydrophobicContact CD2-CG 4.03Å | ||
| 72 | P | 86.3 | Confident | 76.7 | Confident | 53 Ų | 53 | 54 Ų | 54 | 34% | 0.344 | 36% | 0.363 | S | S | . | . | trans | -78.6 | 53.6 | -176.9 | 34.1 | -37.5 | 0 | 0 | 0 | 112.2 | L74 I76 | P72-L74 VanDerWaalsContact C-N 3.34Å; P72-L74 PolarHBondContact O-N 3Å; P72-I76 HydrophobicContact CG-CD1 4.44Å; P72-I76 WeakPolarHBondContact O-CD1 3.43Å | ||
| 73 | L | 82.9 | Confident | 73.9 | Confident | 2 Ų | 2 | 59.9 Ų | 59.9 | 1% | 0.01 | 39% | 0.392 | C | S | . | . | H | α-helix | trans | -64.2 | -38.9 | -174.7 | -63.5 | 179.8 | 0 | 0 | 0 | 112.2 | L71 I76 L77 I107 V109 L138 L214 L217 | L71-L73 HydrophobicContact CB-CD2 4.29Å; L71-L73 HydrophobicContact CB-CG 4.04Å; L71-L73 PolarHBondContact O-N 3.48Å; L73-I76 PolarHBondContact O-N 3.06Å; L73-L77 WeakPolarHBondContact O-CB 3.13Å; L73-L77 WeakPolarHBondContact O-CD1 3.23Å; L73-L77 WeakPolarHBondContact O-CG 3.18Å; L73-L77 PolarHBondContact O-N 3.47Å; L73-L77 VanDerWaalsContact O-N 3.14Å; L73-I107 HydrophobicContact CB-CG2 4.22Å; L73-I107 HydrophobicContact CD1-CG2 4.05Å; L73-V109 HydrophobicContact CD1-CG2 3.48Å; L73-V109 VanDerWaalsContact CD1-CG2 3.48Å; L73-V109 HydrophobicContact CG-CG2 4.35Å; L73-L138 HydrophobicContact CD1-CD2 3.48Å; L73-L138 VanDerWaalsContact CD1-CD2 3.48Å; L73-L214 HydrophobicContact CD1-CD1 4.45Å; L73-L214 HydrophobicContact CD2-CD1 3.6Å; L73-L217 HydrophobicContact CD2-CD1 3.66Å |
| 74 | L | 73.8 | Confident | 71.4 | Confident | 32 Ų | 32 | 62.7 Ų | 62.7 | 17% | 0.168 | 41% | 0.407 | C | S | . | . | H | α-helix | trans | -64 | -44.6 | -179.9 | -82.4 | -173.1 | 0 | 0 | 0 | 114.2 | P72 I76 L77 K78 I104 D106 I107 | P72-L74 VanDerWaalsContact C-N 3.34Å; P72-L74 PolarHBondContact O-N 3Å; L74-I76 PolarHBondContact O-N 2.9Å; L74-I76 VanDerWaalsContact O-N 3.16Å; L74-L77 CarbonylContact O-C 3.53Å; L74-L77 PolarHBondContact O-N 3.31Å; L74-K78 PolarHBondContact O-N 3.49Å; L74-I104 HydrophobicContact CD2-CG2 4.1Å; L74-D106 HydrophobicContact CD1-CB 4.23Å; L74-D106 WeakPolarHBondContact CD1-OD1 3.48Å; L74-I107 HydrophobicContact CD2-CB 3.74Å; L74-I107 HydrophobicContact CD2-CD1 4.08Å; L74-I107 HydrophobicContact CD2-CG1 3.72Å; L74-I107 HydrophobicContact CG-CB 4.12Å |
| 75 | D | 68.6 | Low | 68.7 | Low | 113 Ų | 113 | 67.2 Ų | 67.2 | 60% | 0.604 | 45% | 0.453 | S | S | * | . | H | α-helix | trans | -64.2 | -24.5 | -176 | -67.2 | -26.7 | 0 | 0 | 0 | 111.2 | ||
| 76 | I | 65.7 | Low | 66.2 | Low | 45 Ų | 45 | 66.5 Ų | 66.5 | 23% | 0.231 | 46% | 0.46 | C | S | . | . | H | α-helix | trans | -89 | -20.4 | 177.6 | -57.6 | 160.9 | 0 | 0 | 0 | 111.7 | P72 L73 L74 L92 V213 L217 | P72-I76 HydrophobicContact CG-CD1 4.44Å; P72-I76 WeakPolarHBondContact O-CD1 3.43Å; L73-I76 PolarHBondContact O-N 3.06Å; L74-I76 PolarHBondContact O-N 2.9Å; L74-I76 VanDerWaalsContact O-N 3.16Å; I76-L92 WeakPolarHBondContact O-CD2 3.48Å; I76-V213 HydrophobicContact CB-CG1 4.16Å; I76-V213 HydrophobicContact CD1-CG1 4.09Å; I76-V213 HydrophobicContact CG2-CB 4.25Å; I76-V213 HydrophobicContact CG2-CG1 3.44Å; I76-V213 VanDerWaalsContact CG2-CG1 3.44Å; I76-V213 HydrophobicContact CG2-CG2 3.76Å; I76-L217 HydrophobicContact CD1-CD1 3.37Å; I76-L217 HydrophobicContact CD1-CD2 3.46Å; I76-L217 VanDerWaalsContact CD1-CD2 3.46Å; I76-L217 HydrophobicContact CD1-CG 3.86Å |
| 77 | L | 62.8 | Low | 64 | Low | 24 Ų | 24 | 73 Ų | 73 | 13% | 0.126 | 49% | 0.487 | C | S | . | . | H | α-helix | trans | -94.3 | -14.9 | 177.7 | -68.9 | 167.8 | 0 | 0 | 0 | 113.2 | L73 L74 L92 I107 L206 I209 L210 | L73-L77 WeakPolarHBondContact O-CB 3.13Å; L73-L77 WeakPolarHBondContact O-CD1 3.23Å; L73-L77 WeakPolarHBondContact O-CG 3.18Å; L73-L77 PolarHBondContact O-N 3.47Å; L73-L77 VanDerWaalsContact O-N 3.14Å; L74-L77 CarbonylContact O-C 3.53Å; L74-L77 PolarHBondContact O-N 3.31Å; L77-L92 WeakPolarHBondContact O-CD2 3.41Å; L77-I107 HydrophobicContact CD1-CD1 3.13Å; L77-I107 HydrophobicContact CG-CD1 4.4Å; L77-L206 HydrophobicContact CD1-CD1 4.16Å; L77-L206 HydrophobicContact CD2-CD1 4.33Å; L77-I209 HydrophobicContact CD2-CB 3.99Å; L77-I209 HydrophobicContact CD2-CD1 4.23Å; L77-I209 HydrophobicContact CD2-CG2 3.42Å; L77-I209 VanDerWaalsContact CD2-CG2 3.42Å; L77-L210 HydrophobicContact CD1-CD2 4.3Å |
| 78 | K | 57.6 | Low | 61.8 | Low | 113 Ų | 113 | 75 Ų | 75 | 49% | 0.491 | 50% | 0.498 | S | S | . | . | S | Bend | trans | -73 | 132 | 174.6 | -83.5 | 177.5 | -178.2 | 165.9 | 0 | 111.5 | L74 G80 L92 | L74-K78 PolarHBondContact O-N 3.49Å; K78-G80 PolarHBondContact O-N 3.22Å; K78-L92 VanDerWaalsContact C-CD2 3.44Å; K78-L92 WeakPolarHBondContact O-CD2 3.31Å |
| 79 | P | 48.5 | Very low | 59.3 | Low | 83 Ų | 83 | 77.9 Ų | 77.9 | 54% | 0.539 | 53% | 0.527 | S | S | . | . | S | Bend | trans | -66.3 | 104.6 | 172.1 | 29.4 | -35.6 | 0 | 0 | 0 | 110.3 | T96 | P79-T96 HydrophobicContact CB-CG2 4.4Å; P79-T96 HydrophobicContact CG-CG2 3.95Å |
| 80 | G | 43.5 | Very low | 57 | Low | 79 Ų | 79 | 77 Ų | 77 | 81% | 0.814 | 54% | 0.542 | S | S | * | . | trans | 73.4 | 103.7 | 155.4 | 0 | 0 | 0 | 0 | 0 | 117.4 | K78 | K78-G80 PolarHBondContact O-N 3.22Š| ||
| 81 | G | 35.1 | Very low | 55 | Low | 89 Ų | 89 | 73.3 Ų | 73.3 | 92% | 0.918 | 52% | 0.522 | S | S | * | . | trans | -159.3 | 9 | 159.2 | 0 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 82 | G | 37.4 | Very low | 53.1 | Low | 60 Ų | 60 | 74.3 Ų | 74.3 | 62% | 0.619 | 53% | 0.527 | S | S | * | . | S | Bend | trans | -126.7 | 131.8 | -179.5 | 0 | 0 | 0 | 0 | 0 | 110.8 | S84 | G82-S84 PolarHBondContact O-N 3.48Š|
| 83 | T | 37.3 | Very low | 51.3 | Low | 157 Ų | 157 | 74 Ų | 74 | 96% | 0.963 | 53% | 0.534 | S | S | * | . | trans | -72.5 | 36.3 | -173.7 | 50.9 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 84 | S | 43.6 | Very low | 49.8 | Very low | 91 Ų | 91 | 80.8 Ų | 80.8 | 64% | 0.636 | 56% | 0.563 | S | S | * | * | trans | -102 | 88.6 | 177.5 | 48.3 | 0 | 0 | 0 | 0 | 110.6 | G82 G86 | G82-S84 PolarHBondContact O-N 3.48Å; S84-G86 PolarHBondContact O-N 3.49Å | ||
| 85 | G | 39.9 | Very low | 48.7 | Very low | 95 Ų | 95 | 80.3 Ų | 80.3 | 98% | 0.979 | 56% | 0.561 | S | S | * | * | trans | -67.6 | 57.9 | 169 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 86 | G | 44.2 | Very low | 47.7 | Very low | 43 Ų | 43 | 78 Ų | 78 | 44% | 0.443 | 55% | 0.551 | S | S | . | * | S | Bend | trans | -124 | 168.2 | 173.7 | 0 | 0 | 0 | 0 | 0 | 111.1 | S84 L88 G89 | S84-G86 PolarHBondContact O-N 3.49Å; G86-L88 PolarHBondContact O-N 2.79Å; G86-G89 PolarHBondContact O-N 3.13Å |
| 87 | L | 49.8 | Very low | 46.9 | Very low | 168 Ų | 168 | 79.5 Ų | 79.5 | 88% | 0.88 | 57% | 0.566 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -36.9 | -19.1 | -171.8 | -161.1 | 64.3 | 0 | 0 | 0 | 118.3 | ||
| 88 | L | 48.3 | Very low | 46.3 | Very low | 96 Ų | 96 | 81.2 Ų | 81.2 | 50% | 0.503 | 58% | 0.577 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -75.7 | -26.3 | 175 | -59.6 | 176.9 | 0 | 0 | 0 | 113.6 | G86 G90 L91 L92 | G86-L88 PolarHBondContact O-N 2.79Å; L88-G90 VanDerWaalsContact C-N 3.25Å; L88-G90 PolarHBondContact O-N 3.18Å; L88-L91 PolarHBondContact O-N 3.18Å; L88-L92 WeakPolarHBondContact O-CD1 3.45Å |
| 89 | G | 44 | Very low | 45.9 | Very low | 61 Ų | 61 | 78.3 Ų | 78.3 | 63% | 0.629 | 57% | 0.567 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -65.3 | -22.7 | -179.9 | 0 | 0 | 0 | 0 | 0 | 114.8 | G86 | G86-G89 PolarHBondContact O-N 3.13Š|
| 90 | G | 45.8 | Very low | 45.8 | Very low | 70 Ų | 70 | 80 Ų | 80 | 72% | 0.722 | 58% | 0.578 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87.1 | -15.2 | 179.7 | 0 | 0 | 0 | 0 | 0 | 114.8 | L88 | L88-G90 VanDerWaalsContact C-N 3.25Å; L88-G90 PolarHBondContact O-N 3.18Å |
| 91 | L | 49.4 | Very low | 46.1 | Very low | 53 Ų | 53 | 79.5 Ų | 79.5 | 28% | 0.277 | 57% | 0.572 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -90.9 | -27.6 | -173.3 | -115.7 | 86.1 | 0 | 0 | 0 | 114.2 | L88 K94 K212 | L88-L91 PolarHBondContact O-N 3.18Å; L91-K94 PolarHBondContact O-N 2.94Å; L91-K212 HydrophobicContact CD2-CD 3.13Å; L91-K212 HydrophobicContact CD2-CG 4.46Å; L91-K212 HydrophobicContact CG-CD 4.44Å |
| 92 | L | 50.7 | Low | 47 | Very low | 33 Ų | 33 | 76.2 Ų | 76.2 | 17% | 0.173 | 53% | 0.534 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -77.5 | -20.1 | -176.2 | -90.7 | 109.5 | 0 | 0 | 0 | 114.5 | I76 L77 K78 L88 K94 | I76-L92 WeakPolarHBondContact O-CD2 3.48Å; L77-L92 WeakPolarHBondContact O-CD2 3.41Å; K78-L92 VanDerWaalsContact C-CD2 3.44Å; K78-L92 WeakPolarHBondContact O-CD2 3.31Å; L88-L92 WeakPolarHBondContact O-CD1 3.45Å; L92-K94 PolarHBondContact O-N 3.43Å; L92-K94 VanDerWaalsContact O-N 3.1Å |
| 93 | G | 49.6 | Very low | 48 | Very low | 47 Ų | 47 | 78.7 Ų | 78.7 | 49% | 0.485 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -62.4 | -15.7 | 173.4 | 0 | 0 | 0 | 0 | 0 | 113.2 | S97 | G93-S97 WeakPolarHBondContact O-CB 3.43Å; G93-S97 PolarHBondContact O-N 2.95Å; G93-S97 PolarHBondContact O-OG 3.43Å; G93-S97 VanDerWaalsContact O-OG 3.04Å |
| 94 | K | 49.8 | Very low | 49.4 | Very low | 144 Ų | 144 | 72.9 Ų | 72.9 | 63% | 0.626 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -80.1 | -44.2 | -173.2 | -141.9 | 174.4 | -178.2 | -175.3 | 0 | 113.3 | L91 L92 T96 S97 V98 | L91-K94 PolarHBondContact O-N 2.94Å; L92-K94 PolarHBondContact O-N 3.43Å; L92-K94 VanDerWaalsContact O-N 3.1Å; K94-T96 PolarHBondContact O-N 3.36Å; K94-S97 WeakPolarHBondContact CA-OG 3.38Å; K94-S97 PolarHBondContact O-N 2.93Å; K94-S97 PolarHBondContact O-OG 3.12Å; K94-V98 HydrophobicContact CG-CG2 4.35Å; K94-V98 WeakPolarHBondContact O-CB 3.38Å; K94-V98 WeakPolarHBondContact O-CG2 3.03Å; K94-V98 PolarHBondContact O-N 2.74Å |
| 95 | V | 51.3 | Low | 50.7 | Low | 22 Ų | 22 | 73.3 Ų | 73.3 | 13% | 0.133 | 49% | 0.489 | C | S | . | . | H | α-helix | trans | -65.1 | -43.7 | -177.7 | 174 | 0 | 0 | 0 | 0 | 112.1 | S97 V98 I104 L202 I209 | V95-S97 VanDerWaalsContact C-N 3.29Å; V95-S97 PolarHBondContact O-N 2.04Å; V95-V98 PolarHBondContact O-N 2.68Å; V95-I104 HydrophobicContact CG1-CD1 4.31Å; V95-L202 HydrophobicContact CG1-CD1 4.4Å; V95-I209 HydrophobicContact CB-CD1 4.42Å; V95-I209 HydrophobicContact CG2-CD1 3.32Å; V95-I209 HydrophobicContact CG2-CG1 4.37Å |
| 96 | T | 47.5 | Very low | 52.4 | Low | 64 Ų | 64 | 71.4 Ų | 71.4 | 39% | 0.393 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -72 | -23.1 | 177.9 | 53.1 | 0 | 0 | 0 | 0 | 113.3 | P79 K94 | P79-T96 HydrophobicContact CB-CG2 4.4Å; P79-T96 HydrophobicContact CG-CG2 3.95Å; K94-T96 PolarHBondContact O-N 3.36Å |
| 97 | S | 49.1 | Very low | 54.3 | Low | 77 Ų | 77 | 69.8 Ų | 69.8 | 54% | 0.538 | 44% | 0.438 | S | S | . | . | H | α-helix | trans | -82.8 | -24.6 | 175.9 | 72.3 | 0 | 0 | 0 | 0 | 113.9 | G93 K94 V95 | G93-S97 WeakPolarHBondContact O-CB 3.43Å; G93-S97 PolarHBondContact O-N 2.95Å; G93-S97 PolarHBondContact O-OG 3.43Å; G93-S97 VanDerWaalsContact O-OG 3.04Å; K94-S97 WeakPolarHBondContact CA-OG 3.38Å; K94-S97 PolarHBondContact O-N 2.93Å; K94-S97 PolarHBondContact O-OG 3.12Å; V95-S97 VanDerWaalsContact C-N 3.29Å; V95-S97 PolarHBondContact O-N 2.04Å |
| 98 | V | 49.6 | Very low | 56.2 | Low | 60 Ų | 60 | 66.4 Ų | 66.4 | 36% | 0.364 | 42% | 0.416 | S | S | . | . | H | α-helix | trans | -79.1 | -30.7 | -172.4 | 169.2 | 0 | 0 | 0 | 0 | 112.1 | K94 V95 | K94-V98 HydrophobicContact CG-CG2 4.35Å; K94-V98 WeakPolarHBondContact O-CB 3.38Å; K94-V98 WeakPolarHBondContact O-CG2 3.03Å; K94-V98 PolarHBondContact O-N 2.74Å; V95-V98 PolarHBondContact O-N 2.68Å |
| 99 | I | 50.2 | Low | 58.3 | Low | 53 Ų | 53 | 61.9 Ų | 61.9 | 27% | 0.272 | 39% | 0.393 | S | S | . | . | S | Bend | trans | -139 | 105.7 | 168.2 | -53.3 | 172.4 | 0 | 0 | 0 | 109.9 | G101 L102 L202 | I99-G101 PolarHBondContact O-N 3.09Å; I99-L102 HydrophobicContact CB-CB 4.13Å; I99-L102 HydrophobicContact CB-CD1 3.85Å; I99-L102 HydrophobicContact CD1-CD1 3.38Å; I99-L102 HydrophobicContact CG1-CD1 4.16Å; I99-L102 HydrophobicContact CG2-CB 4.23Å; I99-L102 HydrophobicContact CG2-CD1 3.82Å; I99-L102 HydrophobicContact CG2-CG 4.36Å; I99-L102 PolarHBondContact O-N 3.48Å; I99-L202 HydrophobicContact CD1-CB 4.2Å |
| 100 | P | 46.2 | Very low | 60.6 | Low | 118 Ų | 118 | 60.1 Ų | 60.1 | 77% | 0.766 | 37% | 0.37 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -56.7 | 121.1 | 172 | -19.4 | 30.2 | 0 | 0 | 0 | 110.2 | ||
| 101 | G | 48.5 | Very low | 62.9 | Low | 68 Ų | 68 | 61 Ų | 61 | 70% | 0.701 | 36% | 0.358 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 98.7 | -3.6 | 176 | 0 | 0 | 0 | 0 | 0 | 116.5 | I99 N103 | I99-G101 PolarHBondContact O-N 3.09Å; G101-N103 PolarHBondContact O-N 3.49Å |
| 102 | L | 54.5 | Low | 65.2 | Low | 21 Ų | 21 | 59.5 Ų | 59.5 | 11% | 0.11 | 35% | 0.351 | C | S | . | . | trans | -87.1 | 93 | 171.6 | -112 | 164.5 | 0 | 0 | 0 | 110.1 | I99 T142 L144 L202 | I99-L102 HydrophobicContact CB-CB 4.13Å; I99-L102 HydrophobicContact CB-CD1 3.85Å; I99-L102 HydrophobicContact CD1-CD1 3.38Å; I99-L102 HydrophobicContact CG1-CD1 4.16Å; I99-L102 HydrophobicContact CG2-CB 4.23Å; I99-L102 HydrophobicContact CG2-CD1 3.82Å; I99-L102 HydrophobicContact CG2-CG 4.36Å; I99-L102 PolarHBondContact O-N 3.48Å; L102-T142 HydrophobicContact CD2-CG2 3.92Å; L102-L144 HydrophobicContact CD2-CD1 3.43Å; L102-L144 VanDerWaalsContact CD2-CD1 3.43Å; L102-L144 HydrophobicContact CG-CD1 3.78Å; L102-L202 HydrophobicContact CD1-CD2 4.11Å; L102-L202 HydrophobicContact CD2-CD2 4.18Å | ||
| 103 | N | 59.7 | Low | 67.3 | Low | 112 Ų | 112 | 63.1 Ų | 63.1 | 60% | 0.599 | 37% | 0.368 | S | S | * | . | trans | -88.5 | 120.3 | 170 | -77.4 | -16.4 | 0 | 0 | 0 | 109.3 | G101 I105 P143 | G101-N103 PolarHBondContact O-N 3.49Å; N103-I105 PolarHBondContact O-N 2.84Å; N103-P143 HydrophobicContact CB-CG 4.47Å; N103-P143 WeakPolarHBondContact O-CD 2.98Å | ||
| 104 | I | 66.4 | Low | 69.6 | Low | 34 Ų | 34 | 62.4 Ų | 62.4 | 17% | 0.174 | 35% | 0.352 | C | S | . | . | trans | -71.5 | 115.9 | 166.1 | -61.7 | 172.3 | 0 | 0 | 0 | 106.6 | L74 V95 I107 V140 L206 | L74-I104 HydrophobicContact CD2-CG2 4.1Å; V95-I104 HydrophobicContact CG1-CD1 4.31Å; I104-I107 HydrophobicContact CD1-CD1 4.4Å; I104-I107 HydrophobicContact CG2-CD1 3.75Å; I104-I107 HydrophobicContact CG2-CG1 3.63Å; I104-V140 HydrophobicContact CG1-CG1 4.32Å; I104-V140 HydrophobicContact CG2-CG1 3.9Å; I104-L206 HydrophobicContact CD1-CD1 4.4Å | ||
| 105 | I | 70 | Confident | 71.8 | Confident | 100 Ų | 100 | 59 Ų | 59 | 51% | 0.513 | 34% | 0.341 | S | S | . | . | trans | -78 | -48.8 | 179.1 | -64.2 | 158.5 | 0 | 0 | 0 | 109 | N103 N141 P143 | N103-I105 PolarHBondContact O-N 2.84Å; I105-N141 PolarHBondContact N-O 2.75Å; I105-P143 HydrophobicContact CD1-CB 3.76Å; I105-P143 HydrophobicContact CD1-CG 4.13Å; I105-P143 HydrophobicContact CG1-CB 4.43Å; I105-P143 HydrophobicContact CG1-CG 4.33Å | ||
| 106 | D | 75.9 | Confident | 73.9 | Confident | 55 Ų | 55 | 66.6 Ų | 66.6 | 29% | 0.294 | 38% | 0.375 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -151.9 | 145.7 | -169.6 | 178.8 | 34.5 | 0 | 0 | 0 | 111.3 | L74 N141 | L74-D106 HydrophobicContact CD1-CB 4.23Å; L74-D106 WeakPolarHBondContact CD1-OD1 3.48Å; D106-N141 HydrophobicContact CB-CB 4.07Å; D106-N141 PolarHBondContact O-N 2.97Å; D106-N141 PolarHBondContact OD2-ND2 2.89Å; D106-N141 VanDerWaalsContact OD2-ND2 3.13Å |
| 107 | I | 84.5 | Confident | 76.2 | Confident | 10 Ų | 10 | 64.2 Ų | 64.2 | 5% | 0.051 | 36% | 0.36 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -131.6 | 106 | 173.9 | -67.8 | 173.2 | 0 | 0 | 0 | 105.5 | L73 L74 L77 I104 Q139 V140 L206 | L73-I107 HydrophobicContact CB-CG2 4.22Å; L73-I107 HydrophobicContact CD1-CG2 4.05Å; L74-I107 HydrophobicContact CD2-CB 3.74Å; L74-I107 HydrophobicContact CD2-CD1 4.08Å; L74-I107 HydrophobicContact CD2-CG1 3.72Å; L74-I107 HydrophobicContact CG-CB 4.12Å; L77-I107 HydrophobicContact CD1-CD1 3.13Å; L77-I107 HydrophobicContact CG-CD1 4.4Å; I104-I107 HydrophobicContact CD1-CD1 4.4Å; I104-I107 HydrophobicContact CG2-CD1 3.75Å; I104-I107 HydrophobicContact CG2-CG1 3.63Å; I107-Q139 WeakPolarHBondContact CA-O 3.43Å; I107-V140 HydrophobicContact CD1-CG1 4.48Å; I107-V140 HydrophobicContact CG1-CB 4.42Å; I107-V140 HydrophobicContact CG1-CG1 4.05Å; I107-V140 HydrophobicContact CG1-CG2 4.18Å; I107-L206 HydrophobicContact CD1-CD1 4.25Å |
| 108 | K | 88.7 | Confident | 78.4 | Confident | 96 Ų | 96 | 62 Ų | 62 | 42% | 0.417 | 35% | 0.349 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -99.5 | 131.2 | 179.2 | -172.7 | 173.9 | 179.8 | -178.9 | 0 | 109.5 | T110 L138 Q139 | K108-T110 HydrophobicContact CD-CG2 4.14Å; K108-T110 HydrophobicContact CG-CG2 3.99Å; K108-L138 WeakPolarHBondContact O-CA 3.14Å; K108-Q139 PolarHBondContact N-O 3.48Å; K108-Q139 PolarHBondContact O-N 3.25Å |
| 109 | V | 92.3 | Very high | 80.6 | Confident | 2 Ų | 2 | 60.3 Ų | 60.3 | 1% | 0.012 | 34% | 0.338 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -81.1 | 131.9 | 165.7 | -175 | 0 | 0 | 0 | 0 | 108 | L68 L71 L73 I136 N137 L138 | L68-V109 WeakPolarHBondContact O-CG1 3.37Å; L71-V109 HydrophobicContact CB-CG2 4.4Å; L73-V109 HydrophobicContact CD1-CG2 3.48Å; L73-V109 VanDerWaalsContact CD1-CG2 3.48Å; L73-V109 HydrophobicContact CG-CG2 4.35Å; V109-I136 HydrophobicContact CG1-CB 3.77Å; V109-I136 HydrophobicContact CG1-CD1 4.02Å; V109-I136 HydrophobicContact CG1-CG1 4.38Å; V109-I136 HydrophobicContact CG1-CG2 3.93Å; V109-N137 CarbonylContact C-O 3.58Å; V109-N137 WeakPolarHBondContact CA-O 3.39Å; V109-L138 HydrophobicContact CB-CD2 4.42Å; V109-L138 HydrophobicContact CG2-CD2 3.76Å |
| 110 | T | 92.6 | Very high | 82.7 | Confident | 24 Ų | 24 | 61.2 Ų | 61.2 | 15% | 0.147 | 35% | 0.345 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -132.8 | 164.9 | 176 | 69.5 | 0 | 0 | 0 | 0 | 110.1 | K108 P112 N137 | K108-T110 HydrophobicContact CD-CG2 4.14Å; K108-T110 HydrophobicContact CG-CG2 3.99Å; T110-P112 VanDerWaalsContact C-CD 3.42Å; T110-N137 PolarHBondContact N-O 3.47Å; T110-N137 PolarHBondContact O-N 3.02Å; T110-N137 WeakPolarHBondContact OG1-CB 3.33Å |
| 111 | D | 94.9 | Very high | 85 | Confident | 87 Ų | 87 | 55.9 Ų | 55.9 | 47% | 0.465 | 31% | 0.31 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | 46.7 | 49.5 | 175.9 | -45.7 | -49 | 0 | 0 | 0 | 114.4 | Q113 N137 | D111-Q113 PolarHBondContact O-N 3.25Å; D111-N137 HydrophobicContact CB-CB 4.45Å; D111-N137 PolarHBondContact OD2-ND2 2.69Å |
| 112 | P | 96.2 | Very high | 87.3 | Confident | 22 Ų | 22 | 53 Ų | 53 | 14% | 0.143 | 28% | 0.279 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -64 | 135 | 175.4 | 30.1 | -36 | 0 | 0 | 0 | 110.3 | L65 L68 T110 G135 I136 | L65-P112 HydrophobicContact CB-CB 4.31Å; L65-P112 HydrophobicContact CB-CG 3.94Å; L65-P112 HydrophobicContact CD2-CB 4.15Å; L65-P112 WeakPolarHBondContact O-CG 3.48Å; L68-P112 HydrophobicContact CB-CB 3.97Å; L68-P112 HydrophobicContact CD1-CB 4.28Å; T110-P112 VanDerWaalsContact C-CD 3.42Å; P112-G135 CarbonylContact C-O 3.59Å; P112-G135 WeakPolarHBondContact CA-O 3.42Å; P112-I136 HydrophobicContact CB-CG2 4.17Å |
| 113 | Q | 96.4 | Very high | 89.1 | Confident | 110 Ų | 110 | 57.6 Ų | 57.6 | 51% | 0.514 | 31% | 0.31 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -135.4 | 134.9 | -175.9 | -68.3 | 175.3 | 33.8 | 0 | 0 | 110.1 | D111 L115 L134 G135 | D111-Q113 PolarHBondContact O-N 3.25Å; Q113-L115 HydrophobicContact CB-CD1 4.41Å; Q113-L134 WeakPolarHBondContact O-CA 3.33Å; Q113-G135 PolarHBondContact N-O 3.11Å; Q113-G135 PolarHBondContact O-N 2.91Å |
| 114 | L | 97.4 | Very high | 90.7 | Very high | 31 Ų | 31 | 56.1 Ų | 56.1 | 16% | 0.162 | 30% | 0.302 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -100.7 | 118.1 | 163.8 | 177.5 | 62.8 | 0 | 0 | 0 | 107.4 | L59 L60 L64 L117 I132 L134 | L59-L114 HydrophobicContact CB-CD2 4.16Å; L59-L114 HydrophobicContact CD1-CD2 4.26Å; L60-L114 HydrophobicContact CD2-CB 4.17Å; L60-L114 HydrophobicContact CD2-CD2 4.15Å; L60-L114 HydrophobicContact CG-CD2 4.06Å; L64-L114 HydrophobicContact CD2-CB 4.21Å; L64-L114 HydrophobicContact CD2-CD1 4.05Å; L64-L114 HydrophobicContact CD2-CD2 4.05Å; L64-L114 HydrophobicContact CD2-CG 4.33Å; L114-L117 HydrophobicContact CD1-CD2 3.94Å; L114-I132 HydrophobicContact CD1-CG2 3.58Å; L114-L134 HydrophobicContact CD1-CD2 3.71Å |
| 115 | L | 95.9 | Very high | 91.9 | Very high | 74 Ų | 74 | 54.5 Ų | 54.5 | 39% | 0.387 | 29% | 0.294 | S | S | . | . | trans | -84.7 | 175.1 | 173.9 | -69.7 | 81.1 | 0 | 0 | 0 | 109.6 | Q113 L117 P133 | Q113-L115 HydrophobicContact CB-CD1 4.41Å; L115-L117 PolarHBondContact O-N 2.99Å; L115-P133 HydrophobicContact CB-CB 3.96Å; L115-P133 HydrophobicContact CB-CG 3.66Å; L115-P133 PolarHBondContact N-O 2.92Å | ||
| 116 | E | 95.2 | Very high | 93.1 | Very high | 181 Ų | 181 | 53.8 Ų | 53.8 | 85% | 0.846 | 29% | 0.288 | S | S | * | . | P | Polyproline II helix | trans | -58.3 | 130.1 | 179.8 | -171.8 | 175.4 | -178.2 | 0 | 0 | 111.8 | G118 P133 | E116-G118 PolarHBondContact O-N 2.84Å; E116-P133 WeakPolarHBondContact O-CG 3.11Å |
| 117 | L | 96.7 | Very high | 94 | Very high | 14 Ų | 14 | 55.9 Ų | 55.9 | 7% | 0.073 | 29% | 0.292 | C | S | . | . | P | Polyproline II helix | trans | -69.6 | 131.6 | -179.6 | -61 | -173.7 | 0 | 0 | 0 | 110.6 | T52 L55 L59 L114 L115 V130 T131 I132 | T52-L117 HydrophobicContact CG2-CB 4.39Å; L55-L117 HydrophobicContact CB-CD1 3.7Å; L59-L117 HydrophobicContact CD1-CD1 4.49Å; L114-L117 HydrophobicContact CD1-CD2 3.94Å; L115-L117 PolarHBondContact O-N 2.99Å; L117-V130 HydrophobicContact CB-CG1 4.45Å; L117-V130 HydrophobicContact CD1-CG1 4.3Å; L117-T131 WeakPolarHBondContact CA-O 3.33Å; L117-I132 HydrophobicContact CD2-CB 4.02Å; L117-I132 HydrophobicContact CD2-CG1 3.92Å; L117-I132 HydrophobicContact CD2-CG2 3.9Å |
| 118 | G | 95 | Very high | 94.6 | Very high | 30 Ų | 30 | 55.4 Ų | 55.4 | 31% | 0.309 | 29% | 0.29 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -83 | 140.5 | 166.5 | 0 | 0 | 0 | 0 | 0 | 110.3 | E116 V130 T131 | E116-G118 PolarHBondContact O-N 2.84Å; G118-V130 CarbonylContact O-C 3.56Å; G118-V130 WeakPolarHBondContact O-CA 3.41Å; G118-T131 PolarHBondContact N-O 3.35Å; G118-T131 PolarHBondContact O-N 3.09Å |
| 119 | L | 95.3 | Very high | 95 | Very high | 25 Ų | 25 | 54.2 Ų | 54.2 | 13% | 0.131 | 28% | 0.283 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -130.3 | 125.9 | 172.5 | -174.5 | 71 | 0 | 0 | 0 | 109.2 | A48 L51 T52 L128 V130 V252 | A48-L119 HydrophobicContact CB-CD2 3.87Å; L51-L119 HydrophobicContact CD2-CD1 4.1Å; L51-L119 HydrophobicContact CD2-CD2 4.19Å; T52-L119 HydrophobicContact CG2-CB 3.76Å; T52-L119 HydrophobicContact CG2-CD2 4.15Å; T52-L119 HydrophobicContact CG2-CG 4.46Å; L119-L128 HydrophobicContact CD1-CB 4.01Å; L119-L128 HydrophobicContact CD1-CD1 4.37Å; L119-L128 HydrophobicContact CD1-CD2 4.42Å; L119-V130 HydrophobicContact CD1-CG2 3.73Å; L119-V252 HydrophobicContact CD2-CG2 3.77Å; L119-V252 HydrophobicContact CG-CG1 4.46Å; L119-V252 HydrophobicContact CG-CG2 4.09Å; L119-V252 WeakPolarHBondContact O-CG1 3.41Å |
| 120 | V | 94.9 | Very high | 95.2 | Very high | 72 Ų | 72 | 54.3 Ų | 54.3 | 44% | 0.436 | 28% | 0.283 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -129.8 | 144.5 | 171.5 | -58.6 | 0 | 0 | 0 | 0 | 109.7 | L128 Y129 | V120-L128 CarbonylContact O-C 3.6Å; V120-L128 WeakPolarHBondContact O-CA 3.34Å; V120-Y129 HydrophobicContact CG2-CD2 4.3Å; V120-Y129 HydrophobicContact CG2-CG 4.46Å; V120-Y129 PolarHBondContact N-O 3.35Å; V120-Y129 PolarHBondContact O-N 3.04Å |
| 121 | Q | 94.8 | Very high | 95.5 | Very high | 6 Ų | 6 | 55.1 Ų | 55.1 | 3% | 0.028 | 29% | 0.288 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -101.3 | 142 | 174.9 | -169.5 | 168.2 | 12.4 | 0 | 0 | 110.1 | G125 R127 L128 L249 Q250 V252 | Q121-G125 PolarHBondContact NE2-O 2.8Å; Q121-R127 WeakPolarHBondContact CA-O 3.48Å; Q121-L128 HydrophobicContact CB-CD2 3.9Å; Q121-L128 HydrophobicContact CG-CD2 3.88Å; Q121-L249 PolarHBondContact NE2-O 3.13Å; Q121-Q250 VanDerWaalsContact OE1-OE1 3.1Å; Q121-V252 HydrophobicContact CB-CB 3.86Å; Q121-V252 HydrophobicContact CB-CG2 3.87Å |
| 122 | S | 95 | Very high | 95.6 | Very high | 6 Ų | 6 | 51.1 Ų | 51.1 | 4% | 0.042 | 27% | 0.267 | C | S | . | . | trans | -60.7 | 152.1 | 175.1 | 56.7 | 0 | 0 | 0 | 0 | 110.8 | D124 G125 H126 R127 Q250 | S122-D124 WeakPolarHBondContact CB-OD1 3.34Å; S122-D124 PolarHBondContact O-N 3.24Å; S122-D124 PolarHBondContact OG-OD1 3.19Å; S122-G125 WeakPolarHBondContact O-CA 3.41Å; S122-G125 PolarHBondContact O-N 3.23Å; S122-H126 PolarHBondContact OG-N 3.25Å; S122-R127 PolarHBondContact N-O 2.89Å; S122-R127 PolarHBondContact OG-N 3.44Å; S122-R127 PolarHBondContact OG-O 3.22Å; S122-Q250 PolarHBondContact O-NE2 3.04Å | ||
| 123 | P | 92.9 | Very high | 95.7 | Very high | 118 Ų | 118 | 51 Ų | 51 | 77% | 0.766 | 27% | 0.267 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -59.2 | -31.9 | 179.1 | -24.8 | 34.7 | 0 | 0 | 0 | 113.8 | G125 Q250 | P123-G125 PolarHBondContact O-N 2.89Å; P123-Q250 PolarHBondContact O-NE2 3.2Å |
| 124 | D | 92.9 | Very high | 95.8 | Very high | 82 Ų | 82 | 46.1 Ų | 46.1 | 44% | 0.439 | 24% | 0.244 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -76 | -7.7 | 175.4 | 65.2 | 6.1 | 0 | 0 | 0 | 113.2 | S122 H126 G248 | S122-D124 WeakPolarHBondContact CB-OD1 3.34Å; S122-D124 PolarHBondContact O-N 3.24Å; S122-D124 PolarHBondContact OG-OD1 3.19Å; D124-H126 PolarHBondContact O-CE1 3.25Å; D124-H126 VanDerWaalsContact O-CE1 3.32Å; D124-H126 PolarHBondContact O-N 2.86Å; D124-H126 PolarHBondContact O-ND1 3.15Å; D124-H126 PolarHBondContact OD1-N 3.39Å; D124-H126 IonicContact OD1-ND1 2.87Å; D124-G248 WeakPolarHBondContact O-CA 3.38Å |
| 125 | G | 93 | Very high | 95.7 | Very high | 0 Ų | 0 | 45.1 Ų | 45.1 | 0% | 0 | 24% | 0.241 | C | C | . | . | S | Bend | trans | 77.1 | -2.5 | 179.9 | 0 | 0 | 0 | 0 | 0 | 115.3 | Q121 S122 P123 L245 | Q121-G125 PolarHBondContact NE2-O 2.8Å; S122-G125 WeakPolarHBondContact O-CA 3.41Å; S122-G125 PolarHBondContact O-N 3.23Å; P123-G125 PolarHBondContact O-N 2.89Å; G125-L245 VanDerWaalsContact O-CD2 3.3Å; G125-L245 WeakPolarHBondContact O-CD2 2.87Å |
| 126 | H | 94.4 | Very high | 95.7 | Very high | 84 Ų | 84 | 42 Ų | 42 | 39% | 0.389 | 22% | 0.224 | S | C | . | . | S | Bend | trans | -90.3 | -11.2 | -170.4 | -68.4 | 80.4 | 0 | 0 | 0 | 114.8 | S122 D124 L245 | S122-H126 PolarHBondContact OG-N 3.25Å; D124-H126 PolarHBondContact O-CE1 3.25Å; D124-H126 VanDerWaalsContact O-CE1 3.32Å; D124-H126 PolarHBondContact O-N 2.86Å; D124-H126 PolarHBondContact O-ND1 3.15Å; D124-H126 PolarHBondContact OD1-N 3.39Å; D124-H126 IonicContact OD1-ND1 2.87Å; H126-L245 WeakPolarHBondContact CA-O 3.35Å; H126-L245 PolarHBondContact CD2-O 2.79Å |
| 127 | R | 95.5 | Very high | 95.7 | Very high | 100 Ų | 100 | 35.1 Ų | 35.1 | 38% | 0.377 | 19% | 0.194 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -135.8 | 147 | -172.2 | -37.9 | -172.7 | -173.9 | -168.8 | 0.2 | 110.9 | Q121 S122 Y129 E161 L163 | Q121-R127 WeakPolarHBondContact CA-O 3.48Å; S122-R127 PolarHBondContact N-O 2.89Å; S122-R127 PolarHBondContact OG-N 3.44Å; S122-R127 PolarHBondContact OG-O 3.22Å; R127-Y129 HydrophobicContact CB-CE2 4.35Å; R127-Y129 WeakPolarHBondContact CD-OH 3.31Å; R127-E161 HydrophobicContact CB-CG 4.49Å; R127-E161 WeakPolarHBondContact CD-OE1 3.42Å; R127-E161 IonicContact CZ-OE1 3.77Å; R127-E161 IonicContact NE-OE1 3.87Å; R127-E161 IonicContact NH1-OE1 2.84Å; R127-E161 PolarHBondContact NH1-OE1 3.38Å; R127-L163 HydrophobicContact CB-CD2 3.91Å; R127-L163 HydrophobicContact CG-CD2 3.58Å |
| 128 | L | 96.6 | Very high | 95.4 | Very high | 0 Ų | 0 | 34.6 Ų | 34.6 | 0% | 0 | 19% | 0.191 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -112.7 | 139.7 | 168.3 | -56.2 | 169.7 | 0 | 0 | 0 | 109.1 | L51 L119 V120 Q121 E161 I162 I241 L245 F251 V252 | L51-L128 HydrophobicContact CD2-CD1 3.54Å; L119-L128 HydrophobicContact CD1-CB 4.01Å; L119-L128 HydrophobicContact CD1-CD1 4.37Å; L119-L128 HydrophobicContact CD1-CD2 4.42Å; V120-L128 CarbonylContact O-C 3.6Å; V120-L128 WeakPolarHBondContact O-CA 3.34Å; Q121-L128 HydrophobicContact CB-CD2 3.9Å; Q121-L128 HydrophobicContact CG-CD2 3.88Å; L128-E161 CarbonylContact O-C 3.53Å; L128-E161 VanDerWaalsContact O-CA 3.3Å; L128-E161 WeakPolarHBondContact O-CA 3.21Å; L128-I162 HydrophobicContact CB-CB 4.19Å; L128-I162 PolarHBondContact N-O 3.49Å; L128-I162 PolarHBondContact O-N 3.33Å; L128-I241 HydrophobicContact CD1-CG2 3.91Å; L128-L245 HydrophobicContact CD1-CD1 3.96Å; L128-L245 HydrophobicContact CD1-CD2 4.31Å; L128-L245 HydrophobicContact CD2-CD2 3.92Å; L128-L245 HydrophobicContact CG-CD1 3.98Å; L128-L245 HydrophobicContact CG-CD2 3.77Å; L128-L245 HydrophobicContact CG-CG 4.43Å; L128-F251 HydrophobicContact CD1-CZ 3.98Å; L128-F251 HydrophobicContact CD2-CE1 4.2Å; L128-F251 HydrophobicContact CD2-CZ 3.82Å; L128-F251 HydrophobicContact CG-CZ 4.45Å; L128-V252 HydrophobicContact CD2-CG2 3.96Å |
| 129 | Y | 97.1 | Very high | 95.1 | Very high | 71 Ų | 71 | 34.8 Ų | 34.8 | 28% | 0.278 | 18% | 0.184 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -112 | 113.2 | 168.1 | -59.2 | -80.3 | 0 | 0 | 0 | 108.2 | V120 R127 T159 A160 E161 | V120-Y129 HydrophobicContact CG2-CD2 4.3Å; V120-Y129 HydrophobicContact CG2-CG 4.46Å; V120-Y129 PolarHBondContact N-O 3.35Å; V120-Y129 PolarHBondContact O-N 3.04Å; R127-Y129 HydrophobicContact CB-CE2 4.35Å; R127-Y129 WeakPolarHBondContact CD-OH 3.31Å; Y129-T159 HydrophobicContact CD1-CG2 4.32Å; Y129-A160 WeakPolarHBondContact CA-O 3.33Å; Y129-E161 HydrophobicContact CD1-CB 4.06Å; Y129-E161 HydrophobicContact CD1-CG 4.15Å; Y129-E161 HydrophobicContact CE1-CB 3.89Å; Y129-E161 HydrophobicContact CE1-CG 3.63Å; Y129-E161 PolarHBondContact OH-OE1 2.89Å |
| 130 | V | 97.4 | Very high | 94.5 | Very high | 3 Ų | 3 | 33.7 Ų | 33.7 | 2% | 0.018 | 18% | 0.178 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -92.5 | 123.3 | 174.6 | -173.3 | 0 | 0 | 0 | 0 | 108.1 | L55 L117 G118 L119 I132 T159 A160 I162 | L55-V130 HydrophobicContact CD1-CG1 4.2Å; L55-V130 HydrophobicContact CD1-CG2 3.9Å; L117-V130 HydrophobicContact CB-CG1 4.45Å; L117-V130 HydrophobicContact CD1-CG1 4.3Å; G118-V130 CarbonylContact O-C 3.56Å; G118-V130 WeakPolarHBondContact O-CA 3.41Å; L119-V130 HydrophobicContact CD1-CG2 3.73Å; V130-I132 HydrophobicContact CG1-CG1 4Å; V130-T159 CarbonylContact O-C 3.6Å; V130-T159 VanDerWaalsContact O-CA 3.31Å; V130-T159 WeakPolarHBondContact O-CA 3.31Å; V130-A160 PolarHBondContact N-O 3.12Å; V130-A160 PolarHBondContact O-N 3.1Å; V130-I162 HydrophobicContact CG2-CD1 3.45Å; V130-I162 VanDerWaalsContact CG2-CD1 3.45Å; V130-I162 HydrophobicContact CG2-CG1 4.18Å |
| 131 | T | 97.7 | Very high | 93.7 | Very high | 41 Ų | 41 | 32 Ų | 32 | 25% | 0.252 | 17% | 0.167 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -95.8 | 121.5 | 169.3 | -57.4 | 0 | 0 | 0 | 0 | 108.4 | L117 G118 P133 N157 I158 | L117-T131 WeakPolarHBondContact CA-O 3.33Å; G118-T131 PolarHBondContact N-O 3.35Å; G118-T131 PolarHBondContact O-N 3.09Å; T131-P133 VanDerWaalsContact C-CD 3.49Å; T131-P133 WeakPolarHBondContact O-CD 3.4Å; T131-N157 HydrophobicContact CG2-CB 4.07Å; T131-I158 CarbonylContact C-O 3.51Å |
| 132 | I | 98.1 | Very high | 92.6 | Very high | 3 Ų | 3 | 33.3 Ų | 33.3 | 2% | 0.015 | 18% | 0.175 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -108.9 | 90.7 | -179.5 | -53 | 170 | 0 | 0 | 0 | 107.4 | L59 L114 L117 V130 L134 N157 I158 V222 V226 | L59-I132 HydrophobicContact CD1-CD1 4.25Å; L59-I132 HydrophobicContact CD1-CG2 4.15Å; L114-I132 HydrophobicContact CD1-CG2 3.58Å; L117-I132 HydrophobicContact CD2-CB 4.02Å; L117-I132 HydrophobicContact CD2-CG1 3.92Å; L117-I132 HydrophobicContact CD2-CG2 3.9Å; V130-I132 HydrophobicContact CG1-CG1 4Å; I132-L134 HydrophobicContact CG2-CD2 3.88Å; I132-L134 HydrophobicContact CG2-CG 4.24Å; I132-L134 PolarHBondContact O-N 3.28Å; I132-N157 WeakPolarHBondContact O-CA 3.25Å; I132-I158 HydrophobicContact CB-CB 4.26Å; I132-I158 PolarHBondContact N-O 3.01Å; I132-I158 PolarHBondContact O-N 3.38Å; I132-V222 HydrophobicContact CD1-CG1 4.32Å; I132-V226 HydrophobicContact CD1-CG2 3.44Å; I132-V226 VanDerWaalsContact CD1-CG2 3.44Å |
| 133 | P | 97.6 | Very high | 91.1 | Very high | 21 Ų | 21 | 36.3 Ų | 36.3 | 14% | 0.136 | 19% | 0.194 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -76.7 | 120.8 | 177.8 | 27.3 | -31.7 | 0 | 0 | 0 | 111.4 | L115 E116 T131 N157 | L115-P133 HydrophobicContact CB-CB 3.96Å; L115-P133 HydrophobicContact CB-CG 3.66Å; L115-P133 PolarHBondContact N-O 2.92Å; E116-P133 WeakPolarHBondContact O-CG 3.11Å; T131-P133 VanDerWaalsContact C-CD 3.49Å; T131-P133 WeakPolarHBondContact O-CD 3.4Å; P133-N157 WeakPolarHBondContact CA-OD1 3.16Å; P133-N157 WeakPolarHBondContact CB-OD1 3.12Å |
| 134 | L | 97.4 | Very high | 89.7 | Confident | 7 Ų | 7 | 33.9 Ų | 33.9 | 4% | 0.037 | 17% | 0.174 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -113.8 | 139.5 | -178.3 | -56.7 | 172.7 | 0 | 0 | 0 | 110.1 | L64 L68 Q113 L114 I132 K155 L156 I158 V218 V222 | L64-L134 HydrophobicContact CD2-CD2 3.87Å; L68-L134 HydrophobicContact CD1-CD2 4.22Å; Q113-L134 WeakPolarHBondContact O-CA 3.33Å; L114-L134 HydrophobicContact CD1-CD2 3.71Å; I132-L134 HydrophobicContact CG2-CD2 3.88Å; I132-L134 HydrophobicContact CG2-CG 4.24Å; I132-L134 PolarHBondContact O-N 3.28Å; L134-K155 CarbonylContact O-C 3.55Å; L134-K155 WeakPolarHBondContact O-CA 3.41Å; L134-L156 WeakPolarHBondContact CA-O 3.47Å; L134-L156 WeakPolarHBondContact CB-O 3.43Å; L134-L156 PolarHBondContact N-O 3.32Å; L134-L156 PolarHBondContact O-N 3.41Å; L134-I158 HydrophobicContact CD1-CG1 4.03Å; L134-V218 HydrophobicContact CD1-CG1 3.5Å; L134-V218 VanDerWaalsContact CD1-CG1 3.5Å; L134-V222 HydrophobicContact CD1-CG2 3.85Å |
| 135 | G | 96.3 | Very high | 87.8 | Confident | 9 Ų | 9 | 37.3 Ų | 37.3 | 9% | 0.093 | 20% | 0.198 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -123.5 | 138.1 | 171.2 | 0 | 0 | 0 | 0 | 0 | 110.5 | P112 Q113 V154 | P112-G135 CarbonylContact C-O 3.59Å; P112-G135 WeakPolarHBondContact CA-O 3.42Å; Q113-G135 PolarHBondContact N-O 3.11Å; Q113-G135 PolarHBondContact O-N 2.91Å; G135-V154 CarbonylContact C-O 3.58Å; G135-V154 WeakPolarHBondContact CA-O 3.36Å |
| 136 | I | 95.9 | Very high | 86 | Confident | 9 Ų | 9 | 40.5 Ų | 40.5 | 5% | 0.046 | 23% | 0.231 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -142 | 154.1 | 170.8 | 64.3 | 177 | 0 | 0 | 0 | 109.8 | L68 V109 P112 L138 V154 L214 | L68-I136 HydrophobicContact CB-CG2 4.22Å; L68-I136 HydrophobicContact CD1-CG2 4.24Å; V109-I136 HydrophobicContact CG1-CB 3.77Å; V109-I136 HydrophobicContact CG1-CD1 4.02Å; V109-I136 HydrophobicContact CG1-CG1 4.38Å; V109-I136 HydrophobicContact CG1-CG2 3.93Å; P112-I136 HydrophobicContact CB-CG2 4.17Å; I136-L138 HydrophobicContact CD1-CD2 3.9Å; I136-L138 HydrophobicContact CG1-CD2 4.43Å; I136-V154 HydrophobicContact CG1-CB 3.81Å; I136-V154 HydrophobicContact CG1-CG2 4.42Å; I136-V154 PolarHBondContact N-O 2.9Å; I136-V154 PolarHBondContact O-N 3.35Å; I136-L214 HydrophobicContact CD1-CD1 4.27Å; I136-L214 HydrophobicContact CD1-CD2 4.33Å |
| 137 | N | 94.8 | Very high | 84.3 | Confident | 37 Ų | 37 | 38 Ų | 38 | 20% | 0.198 | 23% | 0.225 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -104.3 | 140 | 167 | -68.9 | -20.2 | 0 | 0 | 0 | 109.4 | V109 T110 D111 L152 | V109-N137 CarbonylContact C-O 3.58Å; V109-N137 WeakPolarHBondContact CA-O 3.39Å; T110-N137 PolarHBondContact N-O 3.47Å; T110-N137 PolarHBondContact O-N 3.02Å; T110-N137 WeakPolarHBondContact OG1-CB 3.33Å; D111-N137 HydrophobicContact CB-CB 4.45Å; D111-N137 PolarHBondContact OD2-ND2 2.69Å; N137-L152 CarbonylContact C-O 3.47Å; N137-L152 VanDerWaalsContact CA-O 3.27Å; N137-L152 WeakPolarHBondContact CA-O 3.29Å |
| 138 | L | 91.4 | Very high | 82.8 | Confident | 2 Ų | 2 | 38.3 Ų | 38.3 | 1% | 0.01 | 23% | 0.234 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -109.8 | 124.5 | 173 | -56.2 | -180 | 0 | 0 | 0 | 108.9 | L73 K108 V109 I136 R151 L152 V154 L210 | L73-L138 HydrophobicContact CD1-CD2 3.48Å; L73-L138 VanDerWaalsContact CD1-CD2 3.48Å; K108-L138 WeakPolarHBondContact O-CA 3.14Å; V109-L138 HydrophobicContact CB-CD2 4.42Å; V109-L138 HydrophobicContact CG2-CD2 3.76Å; I136-L138 HydrophobicContact CD1-CD2 3.9Å; I136-L138 HydrophobicContact CG1-CD2 4.43Å; L138-R151 CarbonylContact O-C 3.53Å; L138-R151 VanDerWaalsContact O-CA 3.31Å; L138-R151 WeakPolarHBondContact O-CA 3.39Å; L138-L152 HydrophobicContact CB-CB 4.24Å; L138-L152 PolarHBondContact N-O 3.15Å; L138-L152 PolarHBondContact O-N 2.79Å; L138-V154 HydrophobicContact CD1-CG2 3.78Å; L138-V154 HydrophobicContact CG-CG2 3.91Å; L138-L210 HydrophobicContact CD1-CD1 3.57Å; L138-L210 HydrophobicContact CD1-CD2 4.1Å; L138-L210 HydrophobicContact CD1-CG 4.49Å |
| 139 | Q | 88.2 | Confident | 81.5 | Confident | 35 Ų | 35 | 41.9 Ų | 41.9 | 16% | 0.164 | 25% | 0.252 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -105.5 | 115.7 | 171.6 | 179.2 | 170.9 | 77 | 0 | 0 | 109 | I107 K108 | I107-Q139 WeakPolarHBondContact CA-O 3.43Å; K108-Q139 PolarHBondContact N-O 3.48Å; K108-Q139 PolarHBondContact O-N 3.25Å |
| 140 | V | 83.6 | Confident | 80.8 | Confident | 2 Ų | 2 | 38.9 Ų | 38.9 | 1% | 0.012 | 24% | 0.241 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -100.8 | 114.7 | -179.7 | -172 | 0 | 0 | 0 | 0 | 109.1 | I104 I107 T142 L150 L206 | I104-V140 HydrophobicContact CG1-CG1 4.32Å; I104-V140 HydrophobicContact CG2-CG1 3.9Å; I107-V140 HydrophobicContact CD1-CG1 4.48Å; I107-V140 HydrophobicContact CG1-CB 4.42Å; I107-V140 HydrophobicContact CG1-CG1 4.05Å; I107-V140 HydrophobicContact CG1-CG2 4.18Å; V140-T142 HydrophobicContact CG1-CG2 4.21Å; V140-L150 HydrophobicContact CB-CB 4.14Å; V140-L150 HydrophobicContact CB-CD2 4.27Å; V140-L150 HydrophobicContact CG2-CD2 4.12Å; V140-L150 PolarHBondContact N-O 3.11Å; V140-L206 HydrophobicContact CG2-CD2 3.77Å |
| 141 | N | 77.1 | Confident | 80.4 | Confident | 37 Ų | 37 | 43.4 Ų | 43.4 | 20% | 0.198 | 26% | 0.258 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -91.6 | 121.5 | 178.8 | -65.5 | -36.1 | 0 | 0 | 0 | 109.3 | I105 D106 L149 | I105-N141 PolarHBondContact N-O 2.75Å; D106-N141 HydrophobicContact CB-CB 4.07Å; D106-N141 PolarHBondContact O-N 2.97Å; D106-N141 PolarHBondContact OD2-ND2 2.89Å; D106-N141 VanDerWaalsContact OD2-ND2 3.13Å; N141-L149 WeakPolarHBondContact OD1-CD2 3.26Å |
| 142 | T | 70.7 | Confident | 80 | Confident | 32 Ų | 32 | 41.4 Ų | 41.4 | 20% | 0.196 | 25% | 0.246 | C | C | . | . | trans | -122.3 | 148 | 178 | 69.1 | 0 | 0 | 0 | 0 | 110.5 | L102 V140 L144 | L102-T142 HydrophobicContact CD2-CG2 3.92Å; V140-T142 HydrophobicContact CG1-CG2 4.21Å; T142-L144 PolarHBondContact O-N 2.7Å; T142-L144 VanDerWaalsContact O-N 3.15Å | ||
| 143 | P | 64.3 | Low | 79.8 | Confident | 69 Ų | 69 | 42.3 Ų | 42.3 | 45% | 0.448 | 25% | 0.253 | S | S | . | . | trans | -74.5 | 3.3 | -175.4 | 23.6 | -27.5 | 0 | 0 | 0 | 113.8 | N103 I105 V145 | N103-P143 HydrophobicContact CB-CG 4.47Å; N103-P143 WeakPolarHBondContact O-CD 2.98Å; I105-P143 HydrophobicContact CD1-CB 3.76Å; I105-P143 HydrophobicContact CD1-CG 4.13Å; I105-P143 HydrophobicContact CG1-CB 4.43Å; I105-P143 HydrophobicContact CG1-CG 4.33Å; P143-V145 PolarHBondContact O-N 2.89Å | ||
| 144 | L | 64.1 | Low | 79.7 | Confident | 67 Ų | 67 | 41.5 Ų | 41.5 | 35% | 0.351 | 25% | 0.248 | S | C | . | . | trans | -76.4 | 116.6 | -171.9 | -81.6 | 79.2 | 0 | 0 | 0 | 110.5 | L102 T142 G146 A147 | L102-L144 HydrophobicContact CD2-CD1 3.43Å; L102-L144 VanDerWaalsContact CD2-CD1 3.43Å; L102-L144 HydrophobicContact CG-CD1 3.78Å; T142-L144 PolarHBondContact O-N 2.7Å; T142-L144 VanDerWaalsContact O-N 3.15Å; L144-G146 PolarHBondContact O-N 3.31Å; L144-A147 HydrophobicContact CB-CB 3.62Å; L144-A147 WeakPolarHBondContact O-CB 3.49Å; L144-A147 PolarHBondContact O-N 2.91Å | ||
| 145 | V | 52.3 | Low | 79.7 | Confident | 155 Ų | 155 | 47.2 Ų | 47.2 | 94% | 0.939 | 27% | 0.273 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -58.8 | 119.1 | 174.6 | -178.9 | 0 | 0 | 0 | 0 | 109.3 | P143 | P143-V145 PolarHBondContact O-N 2.89Š|
| 146 | G | 54.7 | Low | 79.7 | Confident | 67 Ų | 67 | 47 Ų | 47 | 69% | 0.691 | 27% | 0.27 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 84.1 | 2.9 | -179.1 | 0 | 0 | 0 | 0 | 0 | 115.4 | L144 | L144-G146 PolarHBondContact O-N 3.31Š|
| 147 | A | 59.5 | Low | 79.8 | Confident | 31 Ų | 31 | 48.9 Ų | 48.9 | 26% | 0.256 | 28% | 0.28 | S | S | . | . | P | Polyproline II helix | trans | -77.7 | 130.2 | 168.4 | 0 | 0 | 0 | 0 | 0 | 110.1 | L144 L197 | L144-A147 HydrophobicContact CB-CB 3.62Å; L144-A147 WeakPolarHBondContact O-CB 3.49Å; L144-A147 PolarHBondContact O-N 2.91Å; A147-L197 HydrophobicContact CB-CD1 4.36Å |
| 148 | N | 63.3 | Low | 79.9 | Confident | 107 Ų | 107 | 47.1 Ų | 47.1 | 57% | 0.572 | 27% | 0.27 | S | S | * | . | P | Polyproline II helix | trans | -67.6 | 143.7 | 171.2 | -76.1 | 11 | 0 | 0 | 0 | 109.6 | L150 | N148-L150 PolarHBondContact O-N 3.03Š|
| 149 | L | 71.1 | Confident | 80.2 | Confident | 74 Ų | 74 | 48.8 Ų | 48.8 | 39% | 0.387 | 28% | 0.28 | S | S | . | . | P | Polyproline II helix | trans | -55.6 | 120.6 | 171.9 | -68 | 171.6 | 0 | 0 | 0 | 109.5 | N141 R151 | N141-L149 WeakPolarHBondContact OD1-CD2 3.26Å; L149-R151 PolarHBondContact O-N 3.2Å |
| 150 | L | 81.9 | Confident | 80.7 | Confident | 9 Ų | 9 | 47.1 Ų | 47.1 | 5% | 0.047 | 27% | 0.273 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -76.2 | 120.6 | 176.6 | 178.8 | 75.3 | 0 | 0 | 0 | 108.4 | V140 N148 L152 L190 I199 L206 | V140-L150 HydrophobicContact CB-CB 4.14Å; V140-L150 HydrophobicContact CB-CD2 4.27Å; V140-L150 HydrophobicContact CG2-CD2 4.12Å; V140-L150 PolarHBondContact N-O 3.11Å; N148-L150 PolarHBondContact O-N 3.03Å; L150-L152 HydrophobicContact CG-CD2 4.43Å; L150-L190 HydrophobicContact CD1-CD1 3.34Å; L150-L190 HydrophobicContact CG-CD1 4.39Å; L150-I199 HydrophobicContact CD1-CD1 4.07Å; L150-L206 HydrophobicContact CD2-CD2 4.05Å |
| 151 | R | 88 | Confident | 81.4 | Confident | 97 Ų | 97 | 47.6 Ų | 47.6 | 37% | 0.366 | 28% | 0.275 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -117.4 | 124.9 | 179.2 | -63.9 | -177.5 | -170.3 | -130.8 | 4.9 | 110 | L138 L149 L191 D192 | L138-R151 CarbonylContact O-C 3.53Å; L138-R151 VanDerWaalsContact O-CA 3.31Å; L138-R151 WeakPolarHBondContact O-CA 3.39Å; L149-R151 PolarHBondContact O-N 3.2Å; R151-L191 HydrophobicContact CB-CB 4.02Å; R151-L191 PolarHBondContact O-N 3.39Å; R151-D192 HydrophobicContact CB-CB 4.31Å; R151-D192 PolarHBondContact N-O 3.49Å; R151-D192 PolarHBondContact O-N 3.4Å |
| 152 | L | 90.4 | Very high | 82.3 | Confident | 0 Ų | 0 | 45.9 Ų | 45.9 | 0% | 0 | 27% | 0.265 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -115.2 | 132.8 | 177.2 | -53.7 | 171.6 | 0 | 0 | 0 | 109.3 | N137 L138 L150 I188 S189 L190 L203 L206 L210 | N137-L152 CarbonylContact C-O 3.47Å; N137-L152 VanDerWaalsContact CA-O 3.27Å; N137-L152 WeakPolarHBondContact CA-O 3.29Å; L138-L152 HydrophobicContact CB-CB 4.24Å; L138-L152 PolarHBondContact N-O 3.15Å; L138-L152 PolarHBondContact O-N 2.79Å; L150-L152 HydrophobicContact CG-CD2 4.43Å; L152-I188 HydrophobicContact CB-CG2 4.23Å; L152-I188 HydrophobicContact CD1-CG2 4.23Å; L152-I188 HydrophobicContact CD2-CG2 4.48Å; L152-S189 CarbonylContact C-O 3.57Å; L152-S189 VanDerWaalsContact CA-O 3.3Å; L152-S189 WeakPolarHBondContact CA-O 3.08Å; L152-L190 HydrophobicContact CD2-CD1 3.82Å; L152-L203 HydrophobicContact CD2-CD1 3.56Å; L152-L206 HydrophobicContact CD1-CD2 3.74Å; L152-L206 HydrophobicContact CD1-CG 4.46Å; L152-L210 HydrophobicContact CD1-CD1 4.02Å |
| 153 | A | 93.9 | Very high | 83.5 | Confident | 21 Ų | 21 | 46.4 Ų | 46.4 | 17% | 0.174 | 27% | 0.267 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -88.7 | 132.5 | 164.2 | 0 | 0 | 0 | 0 | 0 | 108.7 | I188 S189 L191 | A153-I188 CarbonylContact O-C 3.57Å; A153-I188 WeakPolarHBondContact O-CA 3.38Å; A153-S189 PolarHBondContact N-O 2.89Å; A153-S189 PolarHBondContact O-N 2.86Å; A153-L191 HydrophobicContact CB-CD1 3.87Å; A153-L191 HydrophobicContact CB-CD2 3.76Å; A153-L191 HydrophobicContact CB-CG 3.69Å |
| 154 | V | 95.3 | Very high | 85 | Confident | 4 Ų | 4 | 44 Ų | 44 | 2% | 0.024 | 25% | 0.253 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -124.7 | 131.5 | 178.3 | -170.8 | 0 | 0 | 0 | 0 | 110 | G135 I136 L138 L186 H187 I188 L214 | G135-V154 CarbonylContact C-O 3.58Å; G135-V154 WeakPolarHBondContact CA-O 3.36Å; I136-V154 HydrophobicContact CG1-CB 3.81Å; I136-V154 HydrophobicContact CG1-CG2 4.42Å; I136-V154 PolarHBondContact N-O 2.9Å; I136-V154 PolarHBondContact O-N 3.35Å; L138-V154 HydrophobicContact CD1-CG2 3.78Å; L138-V154 HydrophobicContact CG-CG2 3.91Å; V154-L186 HydrophobicContact CG1-CD1 3.47Å; V154-L186 VanDerWaalsContact CG1-CD1 3.47Å; V154-H187 CarbonylContact C-O 3.58Å; V154-H187 VanDerWaalsContact CA-O 3.28Å; V154-H187 WeakPolarHBondContact CA-O 3.41Å; V154-I188 HydrophobicContact CG1-CG1 3.99Å; V154-I188 HydrophobicContact CG2-CG1 4.13Å; V154-I188 HydrophobicContact CG2-CG2 4.35Å; V154-L214 HydrophobicContact CB-CD2 4.32Å; V154-L214 HydrophobicContact CG1-CD2 3.45Å; V154-L214 VanDerWaalsContact CG1-CD2 3.45Å; V154-L214 HydrophobicContact CG2-CD2 4.45Å |
| 155 | K | 96.8 | Very high | 86.5 | Confident | 127 Ų | 127 | 43.9 Ų | 43.9 | 55% | 0.552 | 26% | 0.255 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -119.7 | 138.7 | 170.9 | -61.8 | -177.3 | 179.3 | -177.1 | 0 | 109 | L134 L186 H187 | L134-K155 CarbonylContact O-C 3.55Å; L134-K155 WeakPolarHBondContact O-CA 3.41Å; K155-L186 CarbonylContact O-C 3.55Å; K155-L186 VanDerWaalsContact O-CA 3.3Å; K155-L186 WeakPolarHBondContact O-CA 3.16Å; K155-H187 HydrophobicContact CB-CB 4.43Å; K155-H187 PolarHBondContact N-O 3.21Å; K155-H187 PolarHBondContact O-N 2.82Å |
| 156 | L | 96.9 | Very high | 88.4 | Confident | 6 Ų | 6 | 43.3 Ų | 43.3 | 3% | 0.031 | 24% | 0.236 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -150.2 | 137.4 | 179.1 | 178.8 | 68.4 | 0 | 0 | 0 | 109 | L134 I158 H181 L186 P215 V218 | L134-L156 WeakPolarHBondContact CA-O 3.47Å; L134-L156 WeakPolarHBondContact CB-O 3.43Å; L134-L156 PolarHBondContact N-O 3.32Å; L134-L156 PolarHBondContact O-N 3.41Å; L156-I158 HydrophobicContact CD2-CD1 4.3Å; L156-H181 HydrophobicContact CD1-CB 4.22Å; L156-L186 HydrophobicContact CB-CD1 4.33Å; L156-L186 HydrophobicContact CD1-CB 3.91Å; L156-L186 HydrophobicContact CD1-CD1 4.24Å; L156-P215 HydrophobicContact CD1-CB 4.44Å; L156-P215 HydrophobicContact CD1-CG 4.46Å; L156-V218 HydrophobicContact CD2-CB 3.67Å; L156-V218 HydrophobicContact CD2-CG1 3.87Å; L156-V218 HydrophobicContact CD2-CG2 3.96Å |
| 157 | N | 97.6 | Very high | 90 | Very high | 48 Ų | 48 | 41.7 Ų | 41.7 | 26% | 0.257 | 21% | 0.211 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -104.7 | 138.1 | 174 | -61.8 | -13.5 | 0 | 0 | 0 | 110.1 | T131 I132 P133 H181 S182 S185 | T131-N157 HydrophobicContact CG2-CB 4.07Å; I132-N157 WeakPolarHBondContact O-CA 3.25Å; P133-N157 WeakPolarHBondContact CA-OD1 3.16Å; P133-N157 WeakPolarHBondContact CB-OD1 3.12Å; N157-H181 CarbonylContact O-C 3.48Å; N157-H181 WeakPolarHBondContact O-CA 3.1Å; N157-S182 WeakPolarHBondContact CB-OG 3.28Å; N157-S182 PolarHBondContact O-N 3.12Å; N157-S182 PolarHBondContact O-OG 3.12Å; N157-S185 PolarHBondContact N-OG 3.41Å; N157-S185 VanDerWaalsContact N-OG 3.09Å; N157-S185 PolarHBondContact O-OG 3.43Å |
| 158 | I | 97.6 | Very high | 91.5 | Very high | 0 Ų | 0 | 50.2 Ų | 50.2 | 0% | 0 | 24% | 0.243 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -104.7 | 133.6 | 165.4 | -56.9 | -57.5 | 0 | 0 | 0 | 108.2 | T131 I132 L134 L156 H181 V218 Q219 V222 | T131-I158 CarbonylContact C-O 3.51Å; I132-I158 HydrophobicContact CB-CB 4.26Å; I132-I158 PolarHBondContact N-O 3.01Å; I132-I158 PolarHBondContact O-N 3.38Å; L134-I158 HydrophobicContact CD1-CG1 4.03Å; L156-I158 HydrophobicContact CD2-CD1 4.3Å; I158-H181 HydrophobicContact CD1-CB 3.81Å; I158-V218 HydrophobicContact CD1-CG1 4.19Å; I158-V218 HydrophobicContact CG1-CG1 4.27Å; I158-Q219 HydrophobicContact CD1-CB 4.18Å; I158-V222 HydrophobicContact CB-CG1 4.46Å; I158-V222 HydrophobicContact CG1-CB 4.37Å; I158-V222 HydrophobicContact CG1-CG1 4.24Å; I158-V222 HydrophobicContact CG2-CG1 4.37Å |
| 159 | T | 97.9 | Very high | 92.7 | Very high | 36 Ų | 36 | 51.7 Ų | 51.7 | 22% | 0.221 | 25% | 0.246 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -105.3 | 124.8 | 171.5 | -57 | 0 | 0 | 0 | 0 | 109 | Y129 V130 C179 T180 S182 | Y129-T159 HydrophobicContact CD1-CG2 4.32Å; V130-T159 CarbonylContact O-C 3.6Å; V130-T159 VanDerWaalsContact O-CA 3.31Å; V130-T159 WeakPolarHBondContact O-CA 3.31Å; T159-C179 WeakPolarHBondContact O-CA 3.37Å; T159-T180 PolarHBondContact N-O 3.37Å; T159-T180 PolarHBondContact O-N 2.91Å; T159-T180 VanDerWaalsContact O-O 3.12Å; T159-S182 PolarHBondContact OG1-OG 3.26Å |
| 160 | A | 97.9 | Very high | 93.4 | Very high | 0 Ų | 0 | 49.5 Ų | 49.5 | 0% | 0 | 24% | 0.241 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -117.3 | 125.3 | 175.3 | 0 | 0 | 0 | 0 | 0 | 110 | Y129 V130 L176 V226 | Y129-A160 WeakPolarHBondContact CA-O 3.33Å; V130-A160 PolarHBondContact N-O 3.12Å; V130-A160 PolarHBondContact O-N 3.1Å; A160-L176 HydrophobicContact CB-CD1 3.84Å; A160-V226 HydrophobicContact CB-CG1 4.07Å |
| 161 | E | 97.9 | Very high | 93.6 | Very high | 12 Ų | 12 | 57 Ų | 57 | 6% | 0.056 | 27% | 0.269 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -85.7 | 128.6 | 172.2 | -172.8 | -179 | -132.8 | 0 | 0 | 109.3 | R127 L128 Y129 L163 G177 D178 | R127-E161 HydrophobicContact CB-CG 4.49Å; R127-E161 WeakPolarHBondContact CD-OE1 3.42Å; R127-E161 IonicContact CZ-OE1 3.77Å; R127-E161 IonicContact NE-OE1 3.87Å; R127-E161 IonicContact NH1-OE1 2.84Å; R127-E161 PolarHBondContact NH1-OE1 3.38Å; L128-E161 CarbonylContact O-C 3.53Å; L128-E161 VanDerWaalsContact O-CA 3.3Å; L128-E161 WeakPolarHBondContact O-CA 3.21Å; Y129-E161 HydrophobicContact CD1-CB 4.06Å; Y129-E161 HydrophobicContact CD1-CG 4.15Å; Y129-E161 HydrophobicContact CE1-CB 3.89Å; Y129-E161 HydrophobicContact CE1-CG 3.63Å; Y129-E161 PolarHBondContact OH-OE1 2.89Å; E161-L163 HydrophobicContact CG-CD2 3.91Å; E161-L163 HydrophobicContact CG-CG 4.18Å; E161-G177 PolarHBondContact O-N 3.23Å; E161-D178 HydrophobicContact CB-CB 4.39Å; E161-D178 WeakPolarHBondContact CB-O 3.28Å; E161-D178 PolarHBondContact N-O 2.88Å; E161-D178 PolarHBondContact OE2-N 3.37Å |
| 162 | I | 97.3 | Very high | 93.7 | Very high | 1 Ų | 1 | 53.6 Ų | 53.6 | 1% | 0.005 | 26% | 0.258 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -111.6 | 130 | 173.3 | -55.2 | 169.8 | 0 | 0 | 0 | 108.2 | L51 L55 L128 V130 L174 L230 | L51-I162 HydrophobicContact CD2-CD1 4.34Å; L55-I162 HydrophobicContact CD1-CD1 4.1Å; L128-I162 HydrophobicContact CB-CB 4.19Å; L128-I162 PolarHBondContact N-O 3.49Å; L128-I162 PolarHBondContact O-N 3.33Å; V130-I162 HydrophobicContact CG2-CD1 3.45Å; V130-I162 VanDerWaalsContact CG2-CD1 3.45Å; V130-I162 HydrophobicContact CG2-CG1 4.18Å; I162-L174 HydrophobicContact CG2-CB 4.13Å; I162-L174 HydrophobicContact CG2-CD1 4.42Å; I162-L174 HydrophobicContact CG2-CD2 4Å; I162-L174 HydrophobicContact CG2-CG 4.41Å; I162-L230 HydrophobicContact CD1-CD1 4.5Å; I162-L230 HydrophobicContact CD1-CD2 3.7Å; I162-L230 HydrophobicContact CG1-CD1 4.08Å; I162-L230 HydrophobicContact CG1-CD2 4.08Å; I162-L230 HydrophobicContact CG2-CD2 4.34Å |
| 163 | L | 95.9 | Very high | 93.8 | Very high | 43 Ų | 43 | 57 Ų | 57 | 23% | 0.225 | 27% | 0.274 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -121.7 | 150.4 | -178.4 | -57 | 172.6 | 0 | 0 | 0 | 110 | R127 E161 L174 V175 | R127-L163 HydrophobicContact CB-CD2 3.91Å; R127-L163 HydrophobicContact CG-CD2 3.58Å; E161-L163 HydrophobicContact CG-CD2 3.91Å; E161-L163 HydrophobicContact CG-CG 4.18Å; L163-L174 CarbonylContact O-C 3.54Å; L163-L174 WeakPolarHBondContact O-CA 3.47Å; L163-V175 HydrophobicContact CB-CG2 3.93Å; L163-V175 PolarHBondContact N-O 3.48Å; L163-V175 PolarHBondContact O-N 2.88Å |
| 164 | A | 95.6 | Very high | 93.8 | Very high | 19 Ų | 19 | 56.9 Ų | 56.9 | 16% | 0.157 | 27% | 0.27 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -100 | 124.9 | 167.8 | 0 | 0 | 0 | 0 | 0 | 110.1 | I172 L174 A242 L245 I246 | A164-I172 HydrophobicContact CB-CG2 4.35Å; A164-L174 HydrophobicContact CB-CD2 4.39Å; A164-A242 HydrophobicContact CB-CB 3.9Å; A164-A242 VanDerWaalsContact CB-O 3.32Å; A164-A242 WeakPolarHBondContact CB-O 3.33Å; A164-L245 HydrophobicContact CB-CB 3.67Å; A164-L245 HydrophobicContact CB-CD1 4.33Å; A164-I246 HydrophobicContact CB-CB 4.48Å; A164-I246 HydrophobicContact CB-CG1 3.98Å |
| 165 | V | 93.9 | Very high | 93.8 | Very high | 64 Ų | 64 | 58.6 Ų | 58.6 | 39% | 0.388 | 28% | 0.28 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -124.4 | 147.1 | -179.6 | -179.3 | 0 | 0 | 0 | 0 | 109.7 | I172 H173 V175 | V165-I172 WeakPolarHBondContact O-CA 3.27Å; V165-H173 PolarHBondContact N-O 3.13Å; V165-H173 PolarHBondContact O-N 3.09Å; V165-H173 PolarHBondContact O-ND1 3.3Å; V165-V175 HydrophobicContact CB-CG2 4.42Å; V165-V175 HydrophobicContact CG2-CG2 3.62Å |
| 166 | R | 92.7 | Very high | 93.8 | Very high | 143 Ų | 143 | 54.2 Ų | 54.2 | 54% | 0.54 | 26% | 0.263 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -97 | 124.8 | 173.3 | -169 | 176.7 | -71.8 | -104.2 | 9.8 | 109.6 | G170 R171 I246 | R166-G170 PolarHBondContact NH1-O 2.85Å; R166-R171 WeakPolarHBondContact CA-O 3.29Å; R166-I246 HydrophobicContact CB-CD1 4.41Å |
| 167 | D | 89.1 | Confident | 93.7 | Very high | 33 Ų | 33 | 55.1 Ų | 55.1 | 18% | 0.176 | 27% | 0.274 | C | S | . | . | trans | -73.7 | 175.3 | 174.3 | 74.9 | 10.7 | 0 | 0 | 0 | 111.8 | Q169 G170 R171 | D167-Q169 PolarHBondContact O-N 3.43Å; D167-Q169 VanDerWaalsContact OD1-C 3.27Å; D167-Q169 VanDerWaalsContact OD1-CA 3.3Å; D167-Q169 WeakPolarHBondContact OD1-CA 3.19Å; D167-Q169 WeakPolarHBondContact OD1-CB 3.3Å; D167-Q169 PolarHBondContact OD1-N 2.95Å; D167-Q169 PolarHBondContact OD1-OE1 2.95Å; D167-Q169 PolarHBondContact OD2-OE1 2.99Å; D167-G170 PolarHBondContact O-N 3.41Å; D167-G170 PolarHBondContact OD1-N 3.02Å; D167-R171 PolarHBondContact N-O 3.18Å; D167-R171 PolarHBondContact OD1-N 3.41Å; D167-R171 WeakPolarHBondContact OD2-CB 3.4Å; D167-R171 IonicContact OD2-CZ 3.35Å; D167-R171 IonicContact OD2-NE 3.97Å; D167-R171 PolarHBondContact OD2-NE 3.13Å; D167-R171 IonicContact OD2-NH2 2.95Å; D167-R171 PolarHBondContact OD2-NH2 2.89Å | ||
| 168 | K | 89.9 | Confident | 93.7 | Very high | 211 Ų | 211 | 58.9 Ų | 58.9 | 92% | 0.917 | 29% | 0.294 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63.4 | -23.5 | 179.5 | -64.4 | -177.9 | -178.4 | 177.8 | 0 | 112.9 | G170 | K168-G170 VanDerWaalsContact C-N 3.27Š|
| 169 | Q | 88.5 | Confident | 93.7 | Very high | 138 Ų | 138 | 60 Ų | 60 | 65% | 0.645 | 30% | 0.301 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -86.4 | 0.1 | 176.7 | -62.1 | 82.9 | 2.9 | 0 | 0 | 112.3 | D167 R171 | D167-Q169 PolarHBondContact O-N 3.43Å; D167-Q169 VanDerWaalsContact OD1-C 3.27Å; D167-Q169 VanDerWaalsContact OD1-CA 3.3Å; D167-Q169 WeakPolarHBondContact OD1-CA 3.19Å; D167-Q169 WeakPolarHBondContact OD1-CB 3.3Å; D167-Q169 PolarHBondContact OD1-N 2.95Å; D167-Q169 PolarHBondContact OD1-OE1 2.95Å; D167-Q169 PolarHBondContact OD2-OE1 2.99Å; Q169-R171 VanDerWaalsContact C-N 3.33Å; Q169-R171 HydrophobicContact CB-CG 4.42Å |
| 170 | G | 85.4 | Confident | 93.6 | Very high | 28 Ų | 28 | 61.2 Ų | 61.2 | 29% | 0.289 | 31% | 0.309 | S | S | . | . | S | Bend | trans | 83.1 | 4.9 | -179.1 | 0 | 0 | 0 | 0 | 0 | 114.2 | R166 D167 K168 | R166-G170 PolarHBondContact NH1-O 2.85Å; D167-G170 PolarHBondContact O-N 3.41Å; D167-G170 PolarHBondContact OD1-N 3.02Å; K168-G170 VanDerWaalsContact C-N 3.27Å |
| 171 | R | 87.6 | Confident | 93.4 | Very high | 166 Ų | 166 | 63.8 Ų | 63.8 | 63% | 0.626 | 32% | 0.321 | S | S | * | . | trans | -81 | 136.4 | 178.2 | -55.1 | 179.3 | -63.3 | -177.2 | 2.7 | 110.4 | R166 D167 Q169 | R166-R171 WeakPolarHBondContact CA-O 3.29Å; D167-R171 PolarHBondContact N-O 3.18Å; D167-R171 PolarHBondContact OD1-N 3.41Å; D167-R171 WeakPolarHBondContact OD2-CB 3.4Å; D167-R171 IonicContact OD2-CZ 3.35Å; D167-R171 IonicContact OD2-NE 3.97Å; D167-R171 PolarHBondContact OD2-NE 3.13Å; D167-R171 IonicContact OD2-NH2 2.95Å; D167-R171 PolarHBondContact OD2-NH2 2.89Å; Q169-R171 VanDerWaalsContact C-N 3.33Å; Q169-R171 HydrophobicContact CB-CG 4.42Å | ||
| 172 | I | 89.4 | Confident | 93.2 | Very high | 26 Ų | 26 | 64.1 Ų | 64.1 | 13% | 0.133 | 32% | 0.324 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -90.9 | 131.9 | 180 | -55.3 | 172.2 | 0 | 0 | 0 | 108.4 | A164 V165 A242 I246 | A164-I172 HydrophobicContact CB-CG2 4.35Å; V165-I172 WeakPolarHBondContact O-CA 3.27Å; I172-A242 HydrophobicContact CG2-CB 3.38Å; I172-I246 HydrophobicContact CB-CD1 4.2Å; I172-I246 HydrophobicContact CD1-CD1 3.82Å; I172-I246 HydrophobicContact CD1-CG2 4.2Å; I172-I246 HydrophobicContact CG1-CD1 3.68Å; I172-I246 HydrophobicContact CG2-CD1 3.56Å; I172-I246 HydrophobicContact CG2-CG1 4.43Å |
| 173 | H | 91.6 | Very high | 92.8 | Very high | 72 Ų | 72 | 69.9 Ų | 69.9 | 33% | 0.333 | 36% | 0.362 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -139.7 | 153.2 | 176.5 | 55.4 | -75.3 | 0 | 0 | 0 | 110.7 | V165 V175 | V165-H173 PolarHBondContact N-O 3.13Å; V165-H173 PolarHBondContact O-N 3.09Å; V165-H173 PolarHBondContact O-ND1 3.3Å; H173-V175 WeakPolarHBondContact CD2-CG1 3.21Å |
| 174 | L | 94.9 | Very high | 92.5 | Very high | 17 Ų | 17 | 71.2 Ų | 71.2 | 9% | 0.089 | 39% | 0.386 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -81.5 | 140.4 | 171.3 | -62.6 | 177.8 | 0 | 0 | 0 | 109.7 | I162 L163 A164 L233 A238 I241 A242 L245 | I162-L174 HydrophobicContact CG2-CB 4.13Å; I162-L174 HydrophobicContact CG2-CD1 4.42Å; I162-L174 HydrophobicContact CG2-CD2 4Å; I162-L174 HydrophobicContact CG2-CG 4.41Å; L163-L174 CarbonylContact O-C 3.54Å; L163-L174 WeakPolarHBondContact O-CA 3.47Å; A164-L174 HydrophobicContact CB-CD2 4.39Å; L174-L233 HydrophobicContact CD1-CD1 4.21Å; L174-A238 HydrophobicContact CD1-CB 4.32Å; L174-I241 HydrophobicContact CD1-CB 4.18Å; L174-I241 HydrophobicContact CD1-CG2 3.99Å; L174-I241 HydrophobicContact CD2-CG2 3.99Å; L174-A242 HydrophobicContact CD2-CB 3.51Å; L174-A242 HydrophobicContact CG-CB 3.92Å; L174-L245 HydrophobicContact CD2-CD1 3.91Å |
| 175 | V | 94.6 | Very high | 92.3 | Very high | 40 Ų | 40 | 70.9 Ų | 70.9 | 24% | 0.242 | 38% | 0.382 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -133.5 | 152.1 | 174.5 | -60 | 0 | 0 | 0 | 0 | 110.1 | L163 V165 H173 | L163-V175 HydrophobicContact CB-CG2 3.93Å; L163-V175 PolarHBondContact N-O 3.48Å; L163-V175 PolarHBondContact O-N 2.88Å; V165-V175 HydrophobicContact CB-CG2 4.42Å; V165-V175 HydrophobicContact CG2-CG2 3.62Å; H173-V175 WeakPolarHBondContact CD2-CG1 3.21Å |
| 176 | L | 97.3 | Very high | 92.3 | Very high | 35 Ų | 35 | 69.1 Ų | 69.1 | 18% | 0.183 | 37% | 0.371 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -75 | 122.7 | 167.5 | -172.5 | 64.5 | 0 | 0 | 0 | 109 | A160 C179 C223 V226 N227 L230 | A160-L176 HydrophobicContact CB-CD1 3.84Å; L176-C179 HydrophobicContact CD1-CB 4.14Å; L176-C179 HydrophobicContact CD2-CB 4.01Å; L176-C179 HydrophobicContact CG-CB 4.27Å; L176-C223 WeakPolarHBondContact CD2-O 3.4Å; L176-V226 HydrophobicContact CD1-CG1 3.87Å; L176-N227 HydrophobicContact CB-CB 4.29Å; L176-N227 HydrophobicContact CD2-CB 3.73Å; L176-L230 HydrophobicContact CB-CD1 3.93Å; L176-L230 HydrophobicContact CD1-CD1 3.93Å; L176-L230 HydrophobicContact CG-CD1 4.5Å |
| 177 | G | 95.8 | Very high | 92.4 | Very high | 26 Ų | 26 | 67.6 Ų | 67.6 | 27% | 0.268 | 37% | 0.37 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -87.9 | -130 | 167.5 | 0 | 0 | 0 | 0 | 0 | 110.7 | E161 C179 | E161-G177 PolarHBondContact O-N 3.23Å; G177-C179 PolarHBondContact O-N 3.4Å |
| 178 | D | 96.6 | Very high | 92.5 | Very high | 127 Ų | 127 | 67.6 Ų | 67.6 | 68% | 0.679 | 37% | 0.369 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -66.4 | 130.2 | 176.3 | -74.1 | -17.9 | 0 | 0 | 0 | 111.7 | E161 | E161-D178 HydrophobicContact CB-CB 4.39Å; E161-D178 WeakPolarHBondContact CB-O 3.28Å; E161-D178 PolarHBondContact N-O 2.88Å; E161-D178 PolarHBondContact OE2-N 3.37Å |
| 179 | C | 97.4 | Very high | 92.5 | Very high | 22 Ų | 22 | 60.9 Ų | 60.9 | 15% | 0.149 | 35% | 0.349 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -131.3 | 115 | 174 | -176.4 | 0 | 0 | 0 | 0 | 110.6 | T159 L176 G177 Q219 C223 | T159-C179 WeakPolarHBondContact O-CA 3.37Å; L176-C179 HydrophobicContact CD1-CB 4.14Å; L176-C179 HydrophobicContact CD2-CB 4.01Å; L176-C179 HydrophobicContact CG-CB 4.27Å; G177-C179 PolarHBondContact O-N 3.4Å; C179-Q219 PolarHBondContact O-NE2 2.84Å; C179-C223 HydrophobicContact CB-CB 3.67Å; C179-C223 WeakPolarHBondContact CB-SG 3.44Å; C179-C223 PolarHBondContact O-SG 3.37Å; C179-C223 VanDerWaalsContact O-SG 3.36Å; C179-C223 WeakPolarHBondContact SG-CA 3.33Å; C179-C223 WeakPolarHBondContact SG-CB 3.5Å; C179-C223 CovalentContact SG-SG 2.04Å; C179-C223 PolarHBondContact SG-SG 3.45Å |
| 180 | T | 96.5 | Very high | 92.5 | Very high | 62 Ų | 62 | 57 Ų | 57 | 38% | 0.38 | 33% | 0.332 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -151.8 | 161.9 | -174.6 | -168.7 | 0 | 0 | 0 | 0 | 112.5 | T159 Q219 | T159-T180 PolarHBondContact N-O 3.37Å; T159-T180 PolarHBondContact O-N 2.91Å; T159-T180 VanDerWaalsContact O-O 3.12Å; T180-Q219 PolarHBondContact OG1-OE1 3.21Å |
| 181 | H | 94.2 | Very high | 92.5 | Very high | 55 Ų | 55 | 59.6 Ų | 59.6 | 26% | 0.255 | 34% | 0.339 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -67.6 | 142.2 | 171.7 | 65.4 | -83.6 | 0 | 0 | 0 | 111.4 | L156 N157 I158 P183 P215 Q219 | L156-H181 HydrophobicContact CD1-CB 4.22Å; N157-H181 CarbonylContact O-C 3.48Å; N157-H181 WeakPolarHBondContact O-CA 3.1Å; I158-H181 HydrophobicContact CD1-CB 3.81Å; H181-P183 WeakPolarHBondContact O-CD 3.23Å; H181-P215 HydrophobicContact CB-CB 4.1Å; H181-Q219 VanDerWaalsContact N-OE1 3.15Å; H181-Q219 PolarHBondContact ND1-OE1 2.78Å |
| 182 | S | 92.1 | Very high | 92 | Very high | 19 Ų | 19 | 56.6 Ų | 56.6 | 13% | 0.133 | 34% | 0.335 | C | S | . | . | P | Polyproline II helix | trans | -72.7 | 124.7 | 178.5 | -43.9 | 0 | 0 | 0 | 0 | 109.7 | N157 T159 G184 S185 | N157-S182 WeakPolarHBondContact CB-OG 3.28Å; N157-S182 PolarHBondContact O-N 3.12Å; N157-S182 PolarHBondContact O-OG 3.12Å; T159-S182 PolarHBondContact OG1-OG 3.26Å; S182-G184 PolarHBondContact O-N 3.18Å; S182-S185 WeakPolarHBondContact O-CB 3.26Å; S182-S185 PolarHBondContact O-N 3.04Å; S182-S185 VanDerWaalsContact O-N 3.12Å; S182-S185 PolarHBondContact O-OG 3.44Å |
| 183 | P | 88.8 | Confident | 90.8 | Very high | 122 Ų | 122 | 55.8 Ų | 55.8 | 79% | 0.792 | 33% | 0.333 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -55.8 | 133 | 179.1 | -26.4 | 34.9 | 0 | 0 | 0 | 111.9 | H181 S185 | H181-P183 WeakPolarHBondContact O-CD 3.23Å; P183-S185 PolarHBondContact O-N 2.69Å |
| 184 | G | 89.8 | Confident | 89.2 | Confident | 71 Ų | 71 | 58 Ų | 58 | 73% | 0.732 | 35% | 0.347 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 72.7 | 2.3 | 179 | 0 | 0 | 0 | 0 | 0 | 115.8 | S182 L186 | S182-G184 PolarHBondContact O-N 3.18Å; G184-L186 VanDerWaalsContact C-N 3.34Å |
| 185 | S | 92 | Very high | 87.5 | Confident | 11 Ų | 11 | 58 Ų | 58 | 8% | 0.077 | 35% | 0.352 | C | S | . | . | trans | -80 | -14.6 | 177 | 67.6 | 0 | 0 | 0 | 0 | 114.3 | N157 S182 P183 H187 | N157-S185 PolarHBondContact N-OG 3.41Å; N157-S185 VanDerWaalsContact N-OG 3.09Å; N157-S185 PolarHBondContact O-OG 3.43Å; S182-S185 WeakPolarHBondContact O-CB 3.26Å; S182-S185 PolarHBondContact O-N 3.04Å; S182-S185 VanDerWaalsContact O-N 3.12Å; S182-S185 PolarHBondContact O-OG 3.44Å; P183-S185 PolarHBondContact O-N 2.69Å; S185-H187 PolarHBondContact O-CD2 3.33Å; S185-H187 PolarHBondContact O-N 3.41Å | ||
| 186 | L | 94.4 | Very high | 85.6 | Confident | 28 Ų | 28 | 62.9 Ų | 62.9 | 15% | 0.147 | 38% | 0.384 | C | S | . | . | trans | -70.4 | 115.4 | 176.9 | -179.4 | 61.6 | 0 | 0 | 0 | 109.7 | V154 K155 L156 G184 I188 N211 L214 P215 | V154-L186 HydrophobicContact CG1-CD1 3.47Å; V154-L186 VanDerWaalsContact CG1-CD1 3.47Å; K155-L186 CarbonylContact O-C 3.55Å; K155-L186 VanDerWaalsContact O-CA 3.3Å; K155-L186 WeakPolarHBondContact O-CA 3.16Å; L156-L186 HydrophobicContact CB-CD1 4.33Å; L156-L186 HydrophobicContact CD1-CB 3.91Å; L156-L186 HydrophobicContact CD1-CD1 4.24Å; G184-L186 VanDerWaalsContact C-N 3.34Å; L186-I188 HydrophobicContact CD1-CD1 4.41Å; L186-I188 HydrophobicContact CD1-CG1 4.08Å; L186-I188 HydrophobicContact CD2-CD1 4.26Å; L186-I188 HydrophobicContact CG-CD1 4.39Å; L186-I188 HydrophobicContact CG-CG1 4.24Å; L186-N211 HydrophobicContact CD2-CB 4.33Å; L186-N211 WeakPolarHBondContact CD2-OD1 3.05Å; L186-L214 HydrophobicContact CD1-CD2 4.13Å; L186-P215 HydrophobicContact CD2-CG 3.81Å | ||
| 187 | H | 94.1 | Very high | 83.7 | Confident | 111 Ų | 111 | 65.1 Ų | 65.1 | 51% | 0.514 | 40% | 0.396 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -123.6 | 122.6 | 173.6 | -65 | -68.4 | 0 | 0 | 0 | 109.5 | V154 K155 S185 | V154-H187 CarbonylContact C-O 3.58Å; V154-H187 VanDerWaalsContact CA-O 3.28Å; V154-H187 WeakPolarHBondContact CA-O 3.41Å; K155-H187 HydrophobicContact CB-CB 4.43Å; K155-H187 PolarHBondContact N-O 3.21Å; K155-H187 PolarHBondContact O-N 2.82Å; S185-H187 PolarHBondContact O-CD2 3.33Å; S185-H187 PolarHBondContact O-N 3.41Å |
| 188 | I | 92.1 | Very high | 82 | Confident | 32 Ų | 32 | 69.3 Ų | 69.3 | 16% | 0.164 | 42% | 0.418 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -115.7 | 119.7 | 176.7 | -58 | 173.8 | 0 | 0 | 0 | 106.9 | L152 A153 V154 L186 T207 L210 | L152-I188 HydrophobicContact CB-CG2 4.23Å; L152-I188 HydrophobicContact CD1-CG2 4.23Å; L152-I188 HydrophobicContact CD2-CG2 4.48Å; A153-I188 CarbonylContact O-C 3.57Å; A153-I188 WeakPolarHBondContact O-CA 3.38Å; V154-I188 HydrophobicContact CG1-CG1 3.99Å; V154-I188 HydrophobicContact CG2-CG1 4.13Å; V154-I188 HydrophobicContact CG2-CG2 4.35Å; L186-I188 HydrophobicContact CD1-CD1 4.41Å; L186-I188 HydrophobicContact CD1-CG1 4.08Å; L186-I188 HydrophobicContact CD2-CD1 4.26Å; L186-I188 HydrophobicContact CG-CD1 4.39Å; L186-I188 HydrophobicContact CG-CG1 4.24Å; I188-T207 HydrophobicContact CB-CG2 4.29Å; I188-T207 HydrophobicContact CD1-CG2 4.16Å; I188-T207 HydrophobicContact CG2-CG2 4.44Å; I188-L210 HydrophobicContact CD1-CB 3.65Å; I188-L210 HydrophobicContact CD1-CD1 4.32Å |
| 189 | S | 90.3 | Very high | 80.6 | Confident | 71 Ų | 71 | 64.5 Ų | 64.5 | 50% | 0.497 | 39% | 0.392 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -123.5 | 142.3 | -179.6 | -63.7 | 0 | 0 | 0 | 0 | 110.1 | L152 A153 L191 | L152-S189 CarbonylContact C-O 3.57Å; L152-S189 VanDerWaalsContact CA-O 3.3Å; L152-S189 WeakPolarHBondContact CA-O 3.08Å; A153-S189 PolarHBondContact N-O 2.89Å; A153-S189 PolarHBondContact O-N 2.86Å; S189-L191 PolarHBondContact O-N 2.92Å |
| 190 | L | 87.9 | Confident | 79.3 | Confident | 56 Ų | 56 | 70.2 Ų | 70.2 | 29% | 0.293 | 42% | 0.417 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -76.1 | 123.4 | 173 | -175.8 | 62.9 | 0 | 0 | 0 | 109.8 | L150 L152 D192 L194 L203 | L150-L190 HydrophobicContact CD1-CD1 3.34Å; L150-L190 HydrophobicContact CG-CD1 4.39Å; L152-L190 HydrophobicContact CD2-CD1 3.82Å; L190-D192 VanDerWaalsContact CD1-O 3.29Å; L190-D192 WeakPolarHBondContact CD1-O 3.49Å; L190-L194 HydrophobicContact CD2-CD1 3.94Å; L190-L194 HydrophobicContact CD2-CD2 3.56Å; L190-L194 HydrophobicContact CD2-CG 3.56Å; L190-L203 HydrophobicContact CD2-CD2 4.18Å |
| 191 | L | 84.5 | Confident | 78.1 | Confident | 82 Ų | 82 | 68.6 Ų | 68.6 | 43% | 0.429 | 41% | 0.412 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -88 | -54.2 | 172.8 | -69 | 176.2 | 0 | 0 | 0 | 110.4 | R151 A153 S189 | R151-L191 HydrophobicContact CB-CB 4.02Å; R151-L191 PolarHBondContact O-N 3.39Å; A153-L191 HydrophobicContact CB-CD1 3.87Å; A153-L191 HydrophobicContact CB-CD2 3.76Å; A153-L191 HydrophobicContact CB-CG 3.69Å; S189-L191 PolarHBondContact O-N 2.92Å |
| 192 | D | 77.7 | Confident | 77.1 | Confident | 103 Ų | 103 | 66.6 Ų | 66.6 | 55% | 0.551 | 40% | 0.403 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -148.9 | 158.6 | -177.3 | -71.1 | -53.2 | 0 | 0 | 0 | 109.9 | R151 L190 | R151-D192 HydrophobicContact CB-CB 4.31Å; R151-D192 PolarHBondContact N-O 3.49Å; R151-D192 PolarHBondContact O-N 3.4Å; L190-D192 VanDerWaalsContact CD1-O 3.29Å; L190-D192 WeakPolarHBondContact CD1-O 3.49Å |
| 193 | G | 64.9 | Low | 76.4 | Confident | 9 Ų | 9 | 67.2 Ų | 67.2 | 9% | 0.093 | 41% | 0.405 | C | S | . | . | trans | 136 | -1.8 | 169.5 | 0 | 0 | 0 | 0 | 0 | 115.9 | G195 I199 | G193-G195 PolarHBondContact O-N 2.96Å; G193-I199 WeakPolarHBondContact O-CD1 3.34Å | ||
| 194 | L | 58.3 | Low | 75.9 | Confident | 118 Ų | 118 | 66.5 Ų | 66.5 | 62% | 0.618 | 40% | 0.395 | S | S | * | . | trans | -78.7 | 62.5 | 177.7 | -58.5 | 174.8 | 0 | 0 | 0 | 111.9 | L190 I199 | L190-L194 HydrophobicContact CD2-CD1 3.94Å; L190-L194 HydrophobicContact CD2-CD2 3.56Å; L190-L194 HydrophobicContact CD2-CG 3.56Å; L194-I199 HydrophobicContact CD2-CD1 3.98Å; L194-I199 HydrophobicContact CD2-CG1 4.06Å | ||
| 195 | G | 58.9 | Low | 75.3 | Confident | 19 Ų | 19 | 64 Ų | 64 | 20% | 0.196 | 37% | 0.366 | C | S | . | . | trans | -55.6 | 176.6 | 159.8 | 0 | 0 | 0 | 0 | 0 | 110.9 | G193 L197 | G193-G195 PolarHBondContact O-N 2.96Å; G195-L197 PolarHBondContact O-N 3.43Å | ||
| 196 | P | 54.2 | Low | 74.7 | Confident | 141 Ų | 141 | 63.6 Ų | 63.6 | 92% | 0.916 | 36% | 0.363 | S | S | * | . | S | Bend | trans | -65.7 | 11.4 | -176.8 | 28.2 | -35.5 | 0 | 0 | 0 | 115.1 | ||
| 197 | L | 56.6 | Low | 74.2 | Confident | 83 Ų | 83 | 63.7 Ų | 63.7 | 44% | 0.435 | 37% | 0.365 | S | S | . | . | S | Bend | trans | -96.1 | 144.5 | -174.9 | -70 | 161.6 | 0 | 0 | 0 | 111.3 | A147 G195 I199 | A147-L197 HydrophobicContact CB-CD1 4.36Å; G195-L197 PolarHBondContact O-N 3.43Å; L197-I199 HydrophobicContact CB-CG2 4.01Å; L197-I199 PolarHBondContact O-N 2.87Å |
| 198 | P | 60.3 | Low | 73.6 | Confident | 114 Ų | 114 | 59.9 Ų | 59.9 | 74% | 0.74 | 36% | 0.356 | S | S | * | . | trans | -74.5 | 75.2 | 175.5 | 31.8 | -34.4 | 0 | 0 | 0 | 110.8 | Q200 | P198-Q200 VanDerWaalsContact C-N 3.34Š| ||
| 199 | I | 67.3 | Low | 73.1 | Confident | 26 Ų | 26 | 58.8 Ų | 58.8 | 13% | 0.133 | 35% | 0.35 | C | S | . | . | trans | -89.1 | 6 | -178.8 | 57.5 | 157.5 | 0 | 0 | 0 | 114.1 | L150 G193 L194 L197 G201 L202 L203 | L150-I199 HydrophobicContact CD1-CD1 4.07Å; G193-I199 WeakPolarHBondContact O-CD1 3.34Å; L194-I199 HydrophobicContact CD2-CD1 3.98Å; L194-I199 HydrophobicContact CD2-CG1 4.06Å; L197-I199 HydrophobicContact CB-CG2 4.01Å; L197-I199 PolarHBondContact O-N 2.87Å; I199-G201 VanDerWaalsContact C-N 3.35Å; I199-G201 PolarHBondContact O-N 3.3Å; I199-L202 WeakPolarHBondContact O-CB 3.47Å; I199-L202 PolarHBondContact O-N 3.49Å; I199-L203 PolarHBondContact O-N 3.19Å | ||
| 200 | Q | 70.6 | Confident | 72.9 | Confident | 142 Ų | 142 | 55.5 Ų | 55.5 | 66% | 0.664 | 33% | 0.327 | S | S | * | . | H | α-helix | trans | -60.6 | -42 | -179.9 | -68.2 | -166.3 | -5.8 | 0 | 0 | 112.3 | P198 L202 L203 D204 | P198-Q200 VanDerWaalsContact C-N 3.34Å; Q200-L202 VanDerWaalsContact C-N 3.31Å; Q200-L202 PolarHBondContact O-N 2.92Å; Q200-L203 PolarHBondContact O-N 2.85Å; Q200-L203 VanDerWaalsContact O-N 3.17Å; Q200-D204 WeakPolarHBondContact O-CB 3.33Å; Q200-D204 VanDerWaalsContact O-CG 3.27Å; Q200-D204 PolarHBondContact O-N 2.89Å |
| 201 | G | 70.3 | Confident | 72.9 | Confident | 27 Ų | 27 | 56.4 Ų | 56.4 | 28% | 0.278 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -64.3 | -33.8 | 177.7 | 0 | 0 | 0 | 0 | 0 | 113.8 | I199 S205 | I199-G201 VanDerWaalsContact C-N 3.35Å; I199-G201 PolarHBondContact O-N 3.3Å; G201-S205 WeakPolarHBondContact O-CB 3.48Å; G201-S205 PolarHBondContact O-N 3.35Å; G201-S205 VanDerWaalsContact O-N 3.14Å; G201-S205 PolarHBondContact O-OG 2.85Å |
| 202 | L | 73.1 | Confident | 72.9 | Confident | 13 Ų | 13 | 57.8 Ų | 57.8 | 7% | 0.068 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -67.9 | -46.6 | 172.7 | 176.7 | 65.1 | 0 | 0 | 0 | 110.6 | V95 I99 L102 I199 Q200 S205 L206 | V95-L202 HydrophobicContact CG1-CD1 4.4Å; I99-L202 HydrophobicContact CD1-CB 4.2Å; L102-L202 HydrophobicContact CD1-CD2 4.11Å; L102-L202 HydrophobicContact CD2-CD2 4.18Å; I199-L202 WeakPolarHBondContact O-CB 3.47Å; I199-L202 PolarHBondContact O-N 3.49Å; Q200-L202 VanDerWaalsContact C-N 3.31Å; Q200-L202 PolarHBondContact O-N 2.92Å; L202-S205 PolarHBondContact O-N 2.98Å; L202-L206 VanDerWaalsContact O-CB 3.26Å; L202-L206 WeakPolarHBondContact O-CB 3.26Å; L202-L206 PolarHBondContact O-N 3.36Å |
| 203 | L | 77.4 | Confident | 73.3 | Confident | 32 Ų | 32 | 53.7 Ų | 53.7 | 17% | 0.168 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -60.8 | -45.2 | 179.1 | 179.9 | 62.1 | 0 | 0 | 0 | 111.8 | L152 L190 I199 Q200 L206 T207 | L152-L203 HydrophobicContact CD2-CD1 3.56Å; L190-L203 HydrophobicContact CD2-CD2 4.18Å; I199-L203 PolarHBondContact O-N 3.19Å; Q200-L203 PolarHBondContact O-N 2.85Å; Q200-L203 VanDerWaalsContact O-N 3.17Å; L203-L206 PolarHBondContact O-N 3.08Å; L203-T207 WeakPolarHBondContact O-CB 3.31Å; L203-T207 PolarHBondContact O-N 3.04Å; L203-T207 PolarHBondContact O-OG1 3.04Å |
| 204 | D | 79 | Confident | 74.5 | Confident | 108 Ų | 108 | 53.3 Ų | 53.3 | 58% | 0.578 | 31% | 0.309 | S | S | * | . | H | α-helix | trans | -64.9 | -41.6 | 179.1 | -69.6 | -21.7 | 0 | 0 | 0 | 111.3 | Q200 G208 | Q200-D204 WeakPolarHBondContact O-CB 3.33Å; Q200-D204 VanDerWaalsContact O-CG 3.27Å; Q200-D204 PolarHBondContact O-N 2.89Å; D204-G208 PolarHBondContact O-N 2.79Å |
| 205 | S | 77.4 | Confident | 76.2 | Confident | 19 Ų | 19 | 48.1 Ų | 48.1 | 13% | 0.133 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -68 | -44.9 | 178.5 | -58.1 | 0 | 0 | 0 | 0 | 111.6 | G201 L202 G208 I209 | G201-S205 WeakPolarHBondContact O-CB 3.48Å; G201-S205 PolarHBondContact O-N 3.35Å; G201-S205 VanDerWaalsContact O-N 3.14Å; G201-S205 PolarHBondContact O-OG 2.85Å; L202-S205 PolarHBondContact O-N 2.98Å; S205-G208 PolarHBondContact O-N 3.1Å; S205-I209 PolarHBondContact O-N 3.39Å; S205-I209 VanDerWaalsContact O-N 3.1Å |
| 206 | L | 78.6 | Confident | 77.7 | Confident | 1 Ų | 1 | 53.2 Ų | 53.2 | 1% | 0.005 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -65.5 | -49.9 | 178.8 | -178.8 | 64.8 | 0 | 0 | 0 | 111 | L77 I104 I107 V140 L150 L152 L202 L203 G208 I209 L210 | L77-L206 HydrophobicContact CD1-CD1 4.16Å; L77-L206 HydrophobicContact CD2-CD1 4.33Å; I104-L206 HydrophobicContact CD1-CD1 4.4Å; I107-L206 HydrophobicContact CD1-CD1 4.25Å; V140-L206 HydrophobicContact CG2-CD2 3.77Å; L150-L206 HydrophobicContact CD2-CD2 4.05Å; L152-L206 HydrophobicContact CD1-CD2 3.74Å; L152-L206 HydrophobicContact CD1-CG 4.46Å; L202-L206 VanDerWaalsContact O-CB 3.26Å; L202-L206 WeakPolarHBondContact O-CB 3.26Å; L202-L206 PolarHBondContact O-N 3.36Å; L203-L206 PolarHBondContact O-N 3.08Å; L206-G208 PolarHBondContact O-N 3.5Å; L206-I209 PolarHBondContact O-N 3.48Å; L206-I209 VanDerWaalsContact O-N 3.12Å; L206-L210 HydrophobicContact CD1-CD1 4.15Å; L206-L210 HydrophobicContact CD1-CG 4.16Å; L206-L210 HydrophobicContact CD2-CD1 4.4Å; L206-L210 HydrophobicContact CG-CD1 3.82Å; L206-L210 HydrophobicContact CG-CG 4.25Å; L206-L210 WeakPolarHBondContact O-CB 3.44Å; L206-L210 VanDerWaalsContact O-CG 3.31Å; L206-L210 WeakPolarHBondContact O-CG 3.16Å; L206-L210 PolarHBondContact O-N 2.76Å |
| 207 | T | 83.6 | Confident | 79.5 | Confident | 30 Ų | 30 | 48.1 Ų | 48.1 | 18% | 0.184 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -56.9 | -41.9 | 175.2 | -57.7 | 0 | 0 | 0 | 0 | 110.6 | I188 L203 I209 L210 N211 | I188-T207 HydrophobicContact CB-CG2 4.29Å; I188-T207 HydrophobicContact CD1-CG2 4.16Å; I188-T207 HydrophobicContact CG2-CG2 4.44Å; L203-T207 WeakPolarHBondContact O-CB 3.31Å; L203-T207 PolarHBondContact O-N 3.04Å; L203-T207 PolarHBondContact O-OG1 3.04Å; T207-I209 VanDerWaalsContact C-N 3.33Å; T207-I209 PolarHBondContact O-N 3.04Å; T207-L210 PolarHBondContact O-N 2.89Å; T207-N211 VanDerWaalsContact O-CB 3.25Å; T207-N211 WeakPolarHBondContact O-CB 3.34Å; T207-N211 PolarHBondContact O-N 3.14Å; T207-N211 PolarHBondContact O-ND2 3.36Å |
| 208 | G | 83.1 | Confident | 81.3 | Confident | 32 Ų | 32 | 44.4 Ų | 44.4 | 33% | 0.33 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -61.1 | -35.2 | 176.9 | 0 | 0 | 0 | 0 | 0 | 114.5 | D204 S205 L206 | D204-G208 PolarHBondContact O-N 2.79Å; S205-G208 PolarHBondContact O-N 3.1Å; L206-G208 PolarHBondContact O-N 3.5Å |
| 209 | I | 81.2 | Confident | 82.9 | Confident | 9 Ų | 9 | 41.3 Ų | 41.3 | 5% | 0.046 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -80.2 | -46.7 | 175.2 | -63.3 | 175.3 | 0 | 0 | 0 | 111.3 | L77 V95 S205 L206 T207 N211 K212 V213 | L77-I209 HydrophobicContact CD2-CB 3.99Å; L77-I209 HydrophobicContact CD2-CD1 4.23Å; L77-I209 HydrophobicContact CD2-CG2 3.42Å; L77-I209 VanDerWaalsContact CD2-CG2 3.42Å; V95-I209 HydrophobicContact CB-CD1 4.42Å; V95-I209 HydrophobicContact CG2-CD1 3.32Å; V95-I209 HydrophobicContact CG2-CG1 4.37Å; S205-I209 PolarHBondContact O-N 3.39Å; S205-I209 VanDerWaalsContact O-N 3.1Å; L206-I209 PolarHBondContact O-N 3.48Å; L206-I209 VanDerWaalsContact O-N 3.12Å; T207-I209 VanDerWaalsContact C-N 3.33Å; T207-I209 PolarHBondContact O-N 3.04Å; I209-N211 PolarHBondContact O-N 3.22Å; I209-K212 PolarHBondContact O-N 3.13Å; I209-V213 HydrophobicContact CG2-CG2 3.88Å; I209-V213 PolarHBondContact O-N 3.13Å |
| 210 | L | 85.9 | Confident | 84.2 | Confident | 1 Ų | 1 | 42.4 Ų | 42.4 | 1% | 0.005 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -56.1 | -36.3 | 178.1 | -70 | 175.9 | 0 | 0 | 0 | 111.1 | L77 L138 L152 I188 L206 T207 K212 V213 L214 | L77-L210 HydrophobicContact CD1-CD2 4.3Å; L138-L210 HydrophobicContact CD1-CD1 3.57Å; L138-L210 HydrophobicContact CD1-CD2 4.1Å; L138-L210 HydrophobicContact CD1-CG 4.49Å; L152-L210 HydrophobicContact CD1-CD1 4.02Å; I188-L210 HydrophobicContact CD1-CB 3.65Å; I188-L210 HydrophobicContact CD1-CD1 4.32Å; L206-L210 HydrophobicContact CD1-CD1 4.15Å; L206-L210 HydrophobicContact CD1-CG 4.16Å; L206-L210 HydrophobicContact CD2-CD1 4.4Å; L206-L210 HydrophobicContact CG-CD1 3.82Å; L206-L210 HydrophobicContact CG-CG 4.25Å; L206-L210 WeakPolarHBondContact O-CB 3.44Å; L206-L210 VanDerWaalsContact O-CG 3.31Å; L206-L210 WeakPolarHBondContact O-CG 3.16Å; L206-L210 PolarHBondContact O-N 2.76Å; T207-L210 PolarHBondContact O-N 2.89Å; L210-K212 PolarHBondContact O-N 2.84Å; L210-K212 VanDerWaalsContact O-N 3.13Å; L210-V213 PolarHBondContact O-N 2.86Å; L210-L214 WeakPolarHBondContact O-CB 3.47Å; L210-L214 PolarHBondContact O-N 3.41Å |
| 211 | N | 87.7 | Confident | 85.3 | Confident | 75 Ų | 75 | 40.8 Ų | 40.8 | 40% | 0.401 | 23% | 0.231 | S | C | . | . | H | α-helix | trans | -57.9 | -24.5 | 174.8 | -82.7 | -25.6 | 0 | 0 | 0 | 114.9 | L186 T207 I209 | L186-N211 HydrophobicContact CD2-CB 4.33Å; L186-N211 WeakPolarHBondContact CD2-OD1 3.05Å; T207-N211 VanDerWaalsContact O-CB 3.25Å; T207-N211 WeakPolarHBondContact O-CB 3.34Å; T207-N211 PolarHBondContact O-N 3.14Å; T207-N211 PolarHBondContact O-ND2 3.36Å; I209-N211 PolarHBondContact O-N 3.22Å |
| 212 | K | 84.7 | Confident | 86.6 | Confident | 112 Ų | 112 | 39.5 Ų | 39.5 | 49% | 0.487 | 22% | 0.217 | S | C | . | . | H | α-helix | trans | -101.8 | -35 | -179.1 | -69.4 | 173.1 | 177 | -164.2 | 0 | 112.7 | L91 I209 L210 | L91-K212 HydrophobicContact CD2-CD 3.13Å; L91-K212 HydrophobicContact CD2-CG 4.46Å; L91-K212 HydrophobicContact CG-CD 4.44Å; I209-K212 PolarHBondContact O-N 3.13Å; L210-K212 PolarHBondContact O-N 2.84Å; L210-K212 VanDerWaalsContact O-N 3.13Å |
| 213 | V | 86.1 | Confident | 87.7 | Confident | 17 Ų | 17 | 39.6 Ų | 39.6 | 10% | 0.103 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -90.4 | -43.1 | -171.6 | 168.8 | 0 | 0 | 0 | 0 | 111.8 | I76 I209 L210 E216 L217 | I76-V213 HydrophobicContact CB-CG1 4.16Å; I76-V213 HydrophobicContact CD1-CG1 4.09Å; I76-V213 HydrophobicContact CG2-CB 4.25Å; I76-V213 HydrophobicContact CG2-CG1 3.44Å; I76-V213 VanDerWaalsContact CG2-CG1 3.44Å; I76-V213 HydrophobicContact CG2-CG2 3.76Å; I209-V213 HydrophobicContact CG2-CG2 3.88Å; I209-V213 PolarHBondContact O-N 3.13Å; L210-V213 PolarHBondContact O-N 2.86Å; V213-E216 PolarHBondContact O-N 3.47Å; V213-L217 HydrophobicContact CG1-CD1 3.47Å; V213-L217 VanDerWaalsContact CG1-CD1 3.47Å; V213-L217 HydrophobicContact CG1-CG 4.02Å; V213-L217 WeakPolarHBondContact O-CG 3.36Å; V213-L217 PolarHBondContact O-N 2.86Å; V213-L217 VanDerWaalsContact O-N 3.11Å |
| 214 | L | 90.8 | Very high | 88.7 | Confident | 1 Ų | 1 | 41.7 Ų | 41.7 | 1% | 0.005 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -65.1 | -42.1 | -170.1 | -168.4 | 68.5 | 0 | 0 | 0 | 113.3 | L71 L73 I136 V154 L186 L210 E216 L217 V218 | L71-L214 HydrophobicContact CD1-CD1 4.41Å; L73-L214 HydrophobicContact CD1-CD1 4.45Å; L73-L214 HydrophobicContact CD2-CD1 3.6Å; I136-L214 HydrophobicContact CD1-CD1 4.27Å; I136-L214 HydrophobicContact CD1-CD2 4.33Å; V154-L214 HydrophobicContact CB-CD2 4.32Å; V154-L214 HydrophobicContact CG1-CD2 3.45Å; V154-L214 VanDerWaalsContact CG1-CD2 3.45Å; V154-L214 HydrophobicContact CG2-CD2 4.45Å; L186-L214 HydrophobicContact CD1-CD2 4.13Å; L210-L214 WeakPolarHBondContact O-CB 3.47Å; L210-L214 PolarHBondContact O-N 3.41Å; L214-E216 VanDerWaalsContact C-N 3.35Å; L214-E216 PolarHBondContact O-N 2.97Å; L214-L217 PolarHBondContact O-N 3.43Å; L214-V218 HydrophobicContact CD1-CG2 4.05Å; L214-V218 HydrophobicContact CG-CG2 4.14Å; L214-V218 VanDerWaalsContact O-CG2 3.31Å; L214-V218 WeakPolarHBondContact O-CG2 3.39Å; L214-V218 PolarHBondContact O-N 2.85Å |
| 215 | P | 92.9 | Very high | 89.6 | Confident | 8 Ų | 8 | 37 Ų | 37 | 5% | 0.052 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -58.6 | -45.1 | 177.5 | -25.1 | 35.4 | 0 | 0 | 0 | 113 | L156 H181 L186 Q219 | L156-P215 HydrophobicContact CD1-CB 4.44Å; L156-P215 HydrophobicContact CD1-CG 4.46Å; H181-P215 HydrophobicContact CB-CB 4.1Å; L186-P215 HydrophobicContact CD2-CG 3.81Å; P215-Q219 WeakPolarHBondContact O-CB 3.48Å; P215-Q219 PolarHBondContact O-N 3.17Å |
| 216 | E | 90.8 | Very high | 90.5 | Very high | 126 Ų | 126 | 36.3 Ų | 36.3 | 59% | 0.589 | 20% | 0.204 | S | C | * | . | H | α-helix | trans | -66.5 | -40.3 | -179.2 | -64.4 | -172.1 | 173 | 0 | 0 | 111.9 | V213 L214 G220 | V213-E216 PolarHBondContact O-N 3.47Å; L214-E216 VanDerWaalsContact C-N 3.35Å; L214-E216 PolarHBondContact O-N 2.97Å; E216-G220 PolarHBondContact O-N 2.72Å |
| 217 | L | 91.1 | Very high | 91.4 | Very high | 35 Ų | 35 | 40.1 Ų | 40.1 | 18% | 0.183 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -66.2 | -48.5 | 177.7 | -73.5 | 174.6 | 0 | 0 | 0 | 112.9 | L73 I76 V213 L214 G220 K221 | L73-L217 HydrophobicContact CD2-CD1 3.66Å; I76-L217 HydrophobicContact CD1-CD1 3.37Å; I76-L217 HydrophobicContact CD1-CD2 3.46Å; I76-L217 VanDerWaalsContact CD1-CD2 3.46Å; I76-L217 HydrophobicContact CD1-CG 3.86Å; V213-L217 HydrophobicContact CG1-CD1 3.47Å; V213-L217 VanDerWaalsContact CG1-CD1 3.47Å; V213-L217 HydrophobicContact CG1-CG 4.02Å; V213-L217 WeakPolarHBondContact O-CG 3.36Å; V213-L217 PolarHBondContact O-N 2.86Å; V213-L217 VanDerWaalsContact O-N 3.11Å; L214-L217 PolarHBondContact O-N 3.43Å; L217-G220 PolarHBondContact O-N 3.48Å; L217-K221 WeakPolarHBondContact O-CG 3.33Å; L217-K221 PolarHBondContact O-N 2.88Å |
| 218 | V | 94.4 | Very high | 91.9 | Very high | 5 Ų | 5 | 44.9 Ų | 44.9 | 3% | 0.03 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -64.6 | -46.5 | -179.3 | 176 | 0 | 0 | 0 | 0 | 109.2 | L68 L71 L134 L156 I158 L214 G220 K221 V222 | L68-V218 HydrophobicContact CD2-CG1 4.05Å; L68-V218 HydrophobicContact CD2-CG2 4.33Å; L71-V218 HydrophobicContact CD1-CG2 3.94Å; L134-V218 HydrophobicContact CD1-CG1 3.5Å; L134-V218 VanDerWaalsContact CD1-CG1 3.5Å; L156-V218 HydrophobicContact CD2-CB 3.67Å; L156-V218 HydrophobicContact CD2-CG1 3.87Å; L156-V218 HydrophobicContact CD2-CG2 3.96Å; I158-V218 HydrophobicContact CD1-CG1 4.19Å; I158-V218 HydrophobicContact CG1-CG1 4.27Å; L214-V218 HydrophobicContact CD1-CG2 4.05Å; L214-V218 HydrophobicContact CG-CG2 4.14Å; L214-V218 VanDerWaalsContact O-CG2 3.31Å; L214-V218 WeakPolarHBondContact O-CG2 3.39Å; L214-V218 PolarHBondContact O-N 2.85Å; V218-G220 VanDerWaalsContact C-N 3.33Å; V218-G220 PolarHBondContact O-N 2.84Å; V218-K221 PolarHBondContact O-N 2.77Å; V218-K221 VanDerWaalsContact O-N 3.13Å; V218-V222 HydrophobicContact CG1-CG2 3.76Å; V218-V222 WeakPolarHBondContact O-CB 3.43Å; V218-V222 WeakPolarHBondContact O-CG2 3.47Å; V218-V222 PolarHBondContact O-N 3.02Å |
| 219 | Q | 95 | Very high | 92.6 | Very high | 49 Ų | 49 | 44.1 Ų | 44.1 | 23% | 0.229 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -55.1 | -47.9 | 174.3 | 179.3 | -175.1 | -42.5 | 0 | 0 | 111.8 | I158 C179 T180 H181 P215 K221 V222 C223 | I158-Q219 HydrophobicContact CD1-CB 4.18Å; C179-Q219 PolarHBondContact O-NE2 2.84Å; T180-Q219 PolarHBondContact OG1-OE1 3.21Å; H181-Q219 VanDerWaalsContact N-OE1 3.15Å; H181-Q219 PolarHBondContact ND1-OE1 2.78Å; P215-Q219 WeakPolarHBondContact O-CB 3.48Å; P215-Q219 PolarHBondContact O-N 3.17Å; Q219-K221 PolarHBondContact O-N 2.77Å; Q219-K221 VanDerWaalsContact O-N 3.13Å; Q219-V222 PolarHBondContact O-N 3.33Å; Q219-C223 WeakPolarHBondContact O-CB 3.3Å; Q219-C223 PolarHBondContact O-N 2.84Å; Q219-C223 PolarHBondContact O-SG 2.86Å |
| 220 | G | 94.4 | Very high | 93.2 | Very high | 48 Ų | 48 | 44 Ų | 44 | 50% | 0.495 | 23% | 0.233 | S | C | . | . | H | α-helix | trans | -63.8 | -16.7 | -178.8 | 0 | 0 | 0 | 0 | 0 | 114.7 | E216 L217 V218 P224 | E216-G220 PolarHBondContact O-N 2.72Å; L217-G220 PolarHBondContact O-N 3.48Å; V218-G220 VanDerWaalsContact C-N 3.33Å; V218-G220 PolarHBondContact O-N 2.84Å; G220-P224 WeakPolarHBondContact O-CG 3.39Å |
| 221 | K | 94.7 | Very high | 93.6 | Very high | 109 Ų | 109 | 48.6 Ų | 48.6 | 47% | 0.474 | 27% | 0.265 | S | S | . | . | H | α-helix | trans | -103 | -38.5 | 176.2 | -66.8 | -59.5 | -175.8 | -178.8 | 0 | 113.4 | I67 L71 L217 V218 Q219 | I67-K221 HydrophobicContact CG2-CB 3.6Å; I67-K221 HydrophobicContact CG2-CD 4.37Å; I67-K221 HydrophobicContact CG2-CG 4.07Å; L71-K221 HydrophobicContact CD2-CG 4.03Å; L217-K221 WeakPolarHBondContact O-CG 3.33Å; L217-K221 PolarHBondContact O-N 2.88Å; V218-K221 PolarHBondContact O-N 2.77Å; V218-K221 VanDerWaalsContact O-N 3.13Å; Q219-K221 PolarHBondContact O-N 2.77Å; Q219-K221 VanDerWaalsContact O-N 3.13Å |
| 222 | V | 96.3 | Very high | 93.8 | Very high | 0 Ų | 0 | 48 Ų | 48 | 0% | 0 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -77.6 | -41.5 | -176.1 | 177.1 | 0 | 0 | 0 | 0 | 111.4 | L64 I132 L134 I158 V218 Q219 L225 V226 | L64-V222 HydrophobicContact CD1-CG2 3.72Å; I132-V222 HydrophobicContact CD1-CG1 4.32Å; L134-V222 HydrophobicContact CD1-CG2 3.85Å; I158-V222 HydrophobicContact CB-CG1 4.46Å; I158-V222 HydrophobicContact CG1-CB 4.37Å; I158-V222 HydrophobicContact CG1-CG1 4.24Å; I158-V222 HydrophobicContact CG2-CG1 4.37Å; V218-V222 HydrophobicContact CG1-CG2 3.76Å; V218-V222 WeakPolarHBondContact O-CB 3.43Å; V218-V222 WeakPolarHBondContact O-CG2 3.47Å; V218-V222 PolarHBondContact O-N 3.02Å; Q219-V222 PolarHBondContact O-N 3.33Å; V222-L225 WeakPolarHBondContact O-CB 3.34Å; V222-L225 PolarHBondContact O-N 3.42Å; V222-L225 VanDerWaalsContact O-N 3.13Å; V222-V226 HydrophobicContact CG1-CG2 4.06Å; V222-V226 WeakPolarHBondContact O-CG2 3.13Å; V222-V226 PolarHBondContact O-N 2.9Å |
| 223 | C | 97.3 | Very high | 94.3 | Very high | 14 Ų | 14 | 43.6 Ų | 43.6 | 10% | 0.095 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -62 | -44.2 | -176.9 | -69.3 | 0 | 0 | 0 | 0 | 114.1 | L176 C179 Q219 L225 V226 N227 | L176-C223 WeakPolarHBondContact CD2-O 3.4Å; C179-C223 HydrophobicContact CB-CB 3.67Å; C179-C223 WeakPolarHBondContact CB-SG 3.44Å; C179-C223 PolarHBondContact O-SG 3.37Å; C179-C223 VanDerWaalsContact O-SG 3.36Å; C179-C223 WeakPolarHBondContact SG-CA 3.33Å; C179-C223 WeakPolarHBondContact SG-CB 3.5Å; C179-C223 CovalentContact SG-SG 2.04Å; C179-C223 PolarHBondContact SG-SG 3.45Å; Q219-C223 WeakPolarHBondContact O-CB 3.3Å; Q219-C223 PolarHBondContact O-N 2.84Å; Q219-C223 PolarHBondContact O-SG 2.86Å; C223-L225 VanDerWaalsContact C-N 3.29Å; C223-L225 PolarHBondContact O-N 3.3Å; C223-V226 PolarHBondContact O-N 3.42Å; C223-N227 PolarHBondContact O-N 3.02Å; C223-N227 VanDerWaalsContact O-N 3.09Å |
| 224 | P | 97.3 | Very high | 94.6 | Very high | 77 Ų | 77 | 47.4 Ų | 47.4 | 50% | 0.5 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -59.7 | -39.6 | 172.6 | -25.2 | 35.5 | 0 | 0 | 0 | 112.9 | G220 N227 E228 | G220-P224 WeakPolarHBondContact O-CG 3.39Å; P224-N227 WeakPolarHBondContact O-CB 3.47Å; P224-N227 PolarHBondContact O-N 3.13Å; P224-E228 PolarHBondContact O-N 3.3Å |
| 225 | L | 97.4 | Very high | 94.6 | Very high | 9 Ų | 9 | 53.1 Ų | 53.1 | 5% | 0.047 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -65.4 | -41.5 | 177.8 | -178.4 | 66 | 0 | 0 | 0 | 111.6 | L59 L64 I67 V222 C223 N227 E228 V229 | L59-L225 HydrophobicContact CD2-CD2 3.84Å; L59-L225 HydrophobicContact CD2-CG 3.97Å; L64-L225 HydrophobicContact CB-CD2 3.78Å; L64-L225 HydrophobicContact CD1-CD2 4.18Å; I67-L225 HydrophobicContact CD1-CD2 4.12Å; V222-L225 WeakPolarHBondContact O-CB 3.34Å; V222-L225 PolarHBondContact O-N 3.42Å; V222-L225 VanDerWaalsContact O-N 3.13Å; C223-L225 VanDerWaalsContact C-N 3.29Å; C223-L225 PolarHBondContact O-N 3.3Å; L225-N227 VanDerWaalsContact C-N 3.28Å; L225-N227 PolarHBondContact O-N 2.88Å; L225-E228 PolarHBondContact O-N 3.4Å; L225-V229 HydrophobicContact CD1-CG2 4.45Å; L225-V229 HydrophobicContact CG-CG2 4.48Å; L225-V229 VanDerWaalsContact O-CG2 3.29Å; L225-V229 WeakPolarHBondContact O-CG2 3.36Å; L225-V229 PolarHBondContact O-N 3Å |
| 226 | V | 97.3 | Very high | 94.6 | Very high | 4 Ų | 4 | 56.9 Ų | 56.9 | 2% | 0.024 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -58.8 | -43.4 | 174.3 | 175.1 | 0 | 0 | 0 | 0 | 110.5 | L59 I132 A160 L176 V222 C223 E228 V229 L230 | L59-V226 HydrophobicContact CD2-CG2 3.89Å; I132-V226 HydrophobicContact CD1-CG2 3.44Å; I132-V226 VanDerWaalsContact CD1-CG2 3.44Å; A160-V226 HydrophobicContact CB-CG1 4.07Å; L176-V226 HydrophobicContact CD1-CG1 3.87Å; V222-V226 HydrophobicContact CG1-CG2 4.06Å; V222-V226 WeakPolarHBondContact O-CG2 3.13Å; V222-V226 PolarHBondContact O-N 2.9Å; C223-V226 PolarHBondContact O-N 3.42Å; V226-E228 VanDerWaalsContact C-N 3.35Å; V226-E228 PolarHBondContact O-N 3.16Å; V226-V229 PolarHBondContact O-N 3.45Å; V226-L230 HydrophobicContact CG1-CD1 3.86Å; V226-L230 HydrophobicContact CG1-CG 4.29Å; V226-L230 WeakPolarHBondContact O-CB 3.29Å; V226-L230 VanDerWaalsContact O-CG 3.27Å; V226-L230 WeakPolarHBondContact O-CG 3.2Å; V226-L230 PolarHBondContact O-N 3.23Å |
| 227 | N | 96.6 | Very high | 94.7 | Very high | 82 Ų | 82 | 51.7 Ų | 51.7 | 44% | 0.439 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -62 | -42.8 | 177.5 | -171.4 | 56.4 | 0 | 0 | 0 | 112.2 | L176 C223 P224 L225 L230 S231 | L176-N227 HydrophobicContact CB-CB 4.29Å; L176-N227 HydrophobicContact CD2-CB 3.73Å; C223-N227 PolarHBondContact O-N 3.02Å; C223-N227 VanDerWaalsContact O-N 3.09Å; P224-N227 WeakPolarHBondContact O-CB 3.47Å; P224-N227 PolarHBondContact O-N 3.13Å; L225-N227 VanDerWaalsContact C-N 3.28Å; L225-N227 PolarHBondContact O-N 2.88Å; N227-L230 PolarHBondContact O-N 2.98Å; N227-S231 PolarHBondContact O-N 2.8Å |
| 228 | E | 96 | Very high | 94.8 | Very high | 129 Ų | 129 | 50.9 Ų | 50.9 | 60% | 0.603 | 31% | 0.311 | S | S | * | . | H | α-helix | trans | -61.1 | -48.8 | 176.1 | -174.4 | 176.4 | 174.4 | 0 | 0 | 111.2 | P224 L225 V226 L230 S231 G232 | P224-E228 PolarHBondContact O-N 3.3Å; L225-E228 PolarHBondContact O-N 3.4Å; V226-E228 VanDerWaalsContact C-N 3.35Å; V226-E228 PolarHBondContact O-N 3.16Å; E228-L230 PolarHBondContact O-N 3.14Å; E228-S231 PolarHBondContact O-N 3.22Å; E228-S231 PolarHBondContact O-OG 3.44Å; E228-G232 PolarHBondContact O-N 3.37Å; E228-G232 VanDerWaalsContact O-N 3.12Å |
| 229 | V | 96.2 | Very high | 94.7 | Very high | 16 Ų | 16 | 55.1 Ų | 55.1 | 10% | 0.097 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -61.3 | -43.3 | 178.1 | 173.6 | 0 | 0 | 0 | 0 | 111.5 | L55 G58 L225 V226 S231 G232 L233 | L55-V229 HydrophobicContact CD2-CG1 3.98Å; G58-V229 WeakPolarHBondContact O-CG2 3.49Å; L225-V229 HydrophobicContact CD1-CG2 4.45Å; L225-V229 HydrophobicContact CG-CG2 4.48Å; L225-V229 VanDerWaalsContact O-CG2 3.29Å; L225-V229 WeakPolarHBondContact O-CG2 3.36Å; L225-V229 PolarHBondContact O-N 3Å; V226-V229 PolarHBondContact O-N 3.45Å; V229-S231 VanDerWaalsContact C-N 3.3Å; V229-S231 PolarHBondContact O-N 3.35Å; V229-G232 CarbonylContact O-C 3.57Å; V229-G232 PolarHBondContact O-N 3.31Å; V229-G232 VanDerWaalsContact O-N 3.12Å; V229-L233 PolarHBondContact O-N 3.44Å |
| 230 | L | 95.2 | Very high | 94.6 | Very high | 7 Ų | 7 | 55.3 Ų | 55.3 | 4% | 0.037 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -59.4 | -41.5 | 176.6 | -78 | 170.3 | 0 | 0 | 0 | 112 | L55 I162 L176 V226 N227 E228 G232 L233 | L55-L230 HydrophobicContact CD2-CD2 3.78Å; L55-L230 HydrophobicContact CD2-CG 4.15Å; I162-L230 HydrophobicContact CD1-CD1 4.5Å; I162-L230 HydrophobicContact CD1-CD2 3.7Å; I162-L230 HydrophobicContact CG1-CD1 4.08Å; I162-L230 HydrophobicContact CG1-CD2 4.08Å; I162-L230 HydrophobicContact CG2-CD2 4.34Å; L176-L230 HydrophobicContact CB-CD1 3.93Å; L176-L230 HydrophobicContact CD1-CD1 3.93Å; L176-L230 HydrophobicContact CG-CD1 4.5Å; V226-L230 HydrophobicContact CG1-CD1 3.86Å; V226-L230 HydrophobicContact CG1-CG 4.29Å; V226-L230 WeakPolarHBondContact O-CB 3.29Å; V226-L230 VanDerWaalsContact O-CG 3.27Å; V226-L230 WeakPolarHBondContact O-CG 3.2Å; V226-L230 PolarHBondContact O-N 3.23Å; N227-L230 PolarHBondContact O-N 2.98Å; E228-L230 PolarHBondContact O-N 3.14Å; L230-G232 PolarHBondContact O-N 2.94Å; L230-L233 HydrophobicContact CD2-CD1 3.9Å; L230-L233 PolarHBondContact O-N 3.42Å |
| 231 | S | 92.8 | Very high | 94.5 | Very high | 97 Ų | 97 | 53 Ų | 53 | 68% | 0.678 | 31% | 0.309 | S | S | * | . | H | α-helix | trans | -68.9 | -22.6 | 178.2 | 75.3 | 0 | 0 | 0 | 0 | 113.5 | N227 E228 V229 | N227-S231 PolarHBondContact O-N 2.8Å; E228-S231 PolarHBondContact O-N 3.22Å; E228-S231 PolarHBondContact O-OG 3.44Å; V229-S231 VanDerWaalsContact C-N 3.3Å; V229-S231 PolarHBondContact O-N 3.35Å |
| 232 | G | 92.6 | Very high | 94.5 | Very high | 64 Ų | 64 | 47.9 Ų | 47.9 | 66% | 0.66 | 29% | 0.287 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -99.1 | 8.2 | 179.1 | 0 | 0 | 0 | 0 | 0 | 115 | E228 V229 L230 | E228-G232 PolarHBondContact O-N 3.37Å; E228-G232 VanDerWaalsContact O-N 3.12Å; V229-G232 CarbonylContact O-C 3.57Å; V229-G232 PolarHBondContact O-N 3.31Å; V229-G232 VanDerWaalsContact O-N 3.12Å; L230-G232 PolarHBondContact O-N 2.94Å |
| 233 | L | 94.3 | Very high | 94.3 | Very high | 18 Ų | 18 | 50.8 Ų | 50.8 | 9% | 0.094 | 30% | 0.302 | C | S | . | . | S | Bend | trans | -62.4 | 153.9 | 177 | -73.8 | 179 | 0 | 0 | 0 | 111.9 | L51 A54 L174 V229 L230 V235 A238 | L51-L233 HydrophobicContact CD1-CD1 3.86Å; A54-L233 HydrophobicContact CB-CD2 3.61Å; L174-L233 HydrophobicContact CD1-CD1 4.21Å; V229-L233 PolarHBondContact O-N 3.44Å; L230-L233 HydrophobicContact CD2-CD1 3.9Å; L230-L233 PolarHBondContact O-N 3.42Å; L233-V235 PolarHBondContact O-N 3.24Å; L233-A238 HydrophobicContact CB-CB 4.26Å |
| 234 | D | 93.7 | Very high | 94.1 | Very high | 98 Ų | 98 | 51.9 Ų | 51.9 | 52% | 0.524 | 31% | 0.307 | S | S | . | . | trans | -54 | 132.6 | 172.4 | 178.7 | -94.4 | 0 | 0 | 0 | 110.5 | T236 L237 A238 | D234-T236 PolarHBondContact O-N 2.92Å; D234-T236 WeakPolarHBondContact OD1-CA 3.4Å; D234-T236 WeakPolarHBondContact OD1-CB 3.42Å; D234-T236 PolarHBondContact OD1-N 2.87Å; D234-T236 PolarHBondContact OD1-OG1 2.76Å; D234-L237 HydrophobicContact CB-CB 4.11Å; D234-L237 PolarHBondContact O-N 2.83Å; D234-L237 PolarHBondContact OD1-N 2.78Å; D234-L237 VanDerWaalsContact OD1-N 3.15Å; D234-A238 WeakPolarHBondContact O-CB 3.46Å; D234-A238 PolarHBondContact O-N 2.93Å | ||
| 235 | V | 91.3 | Very high | 93.9 | Very high | 121 Ų | 121 | 48.2 Ų | 48.2 | 73% | 0.733 | 28% | 0.283 | S | S | * | . | H | α-helix | trans | -61.2 | -35.4 | -172.4 | -179.3 | 0 | 0 | 0 | 0 | 111.4 | L233 H239 | L233-V235 PolarHBondContact O-N 3.24Å; V235-H239 WeakPolarHBondContact O-CB 3.31Å; V235-H239 PolarHBondContact O-N 3.01Å |
| 236 | T | 91.7 | Very high | 93.8 | Very high | 86 Ų | 86 | 49.9 Ų | 49.9 | 53% | 0.528 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -70.4 | -49.4 | 179 | -41.2 | 0 | 0 | 0 | 0 | 110.1 | D234 A238 H239 D240 | D234-T236 PolarHBondContact O-N 2.92Å; D234-T236 WeakPolarHBondContact OD1-CA 3.4Å; D234-T236 WeakPolarHBondContact OD1-CB 3.42Å; D234-T236 PolarHBondContact OD1-N 2.87Å; D234-T236 PolarHBondContact OD1-OG1 2.76Å; T236-A238 PolarHBondContact O-N 3.48Å; T236-H239 PolarHBondContact O-N 3.12Å; T236-D240 WeakPolarHBondContact O-CB 3.5Å; T236-D240 PolarHBondContact O-N 3.01Å |
| 237 | L | 92.6 | Very high | 93.6 | Very high | 17 Ų | 17 | 55.1 Ų | 55.1 | 9% | 0.089 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -59.9 | -46.9 | 178.4 | -178.5 | 63.3 | 0 | 0 | 0 | 111.6 | L47 A54 D234 H239 D240 I241 | L47-L237 HydrophobicContact CD2-CD1 4.16Å; A54-L237 HydrophobicContact CB-CD2 3.95Å; D234-L237 HydrophobicContact CB-CB 4.11Å; D234-L237 PolarHBondContact O-N 2.83Å; D234-L237 PolarHBondContact OD1-N 2.78Å; D234-L237 VanDerWaalsContact OD1-N 3.15Å; L237-H239 VanDerWaalsContact C-N 3.34Å; L237-H239 PolarHBondContact O-N 3.19Å; L237-D240 PolarHBondContact O-N 2.91Å; L237-I241 HydrophobicContact CD1-CD1 3.64Å; L237-I241 HydrophobicContact CD1-CG1 4.21Å; L237-I241 HydrophobicContact CG-CD1 3.73Å; L237-I241 WeakPolarHBondContact O-CB 3.37Å; L237-I241 WeakPolarHBondContact O-CD1 3.29Å; L237-I241 VanDerWaalsContact O-CG1 3.23Å; L237-I241 WeakPolarHBondContact O-CG1 3.47Å; L237-I241 PolarHBondContact O-N 2.85Å |
| 238 | A | 93.2 | Very high | 93.3 | Very high | 19 Ų | 19 | 52.1 Ų | 52.1 | 16% | 0.157 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -62.1 | -42.7 | 178.5 | 0 | 0 | 0 | 0 | 0 | 111.2 | L174 L233 D234 T236 A242 | L174-A238 HydrophobicContact CD1-CB 4.32Å; L233-A238 HydrophobicContact CB-CB 4.26Å; D234-A238 WeakPolarHBondContact O-CB 3.46Å; D234-A238 PolarHBondContact O-N 2.93Å; T236-A238 PolarHBondContact O-N 3.48Å; A238-A242 WeakPolarHBondContact O-CB 3.07Å; A238-A242 PolarHBondContact O-N 3.4Å |
| 239 | H | 92.3 | Very high | 93.1 | Very high | 93 Ų | 93 | 50.1 Ų | 50.1 | 43% | 0.431 | 30% | 0.297 | S | S | . | . | H | α-helix | trans | -63.8 | -49.2 | 177.8 | -175.1 | 73.2 | 0 | 0 | 0 | 112.2 | V235 T236 L237 I241 A242 N243 | V235-H239 WeakPolarHBondContact O-CB 3.31Å; V235-H239 PolarHBondContact O-N 3.01Å; T236-H239 PolarHBondContact O-N 3.12Å; L237-H239 VanDerWaalsContact C-N 3.34Å; L237-H239 PolarHBondContact O-N 3.19Å; H239-I241 PolarHBondContact O-N 3.12Å; H239-A242 PolarHBondContact O-N 2.91Å; H239-N243 VanDerWaalsContact O-CB 3.26Å; H239-N243 WeakPolarHBondContact O-CB 3.29Å; H239-N243 PolarHBondContact O-N 2.84Å |
| 240 | D | 92.6 | Very high | 92.8 | Very high | 54 Ų | 54 | 53.7 Ų | 53.7 | 29% | 0.289 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -61.6 | -46.8 | -177.8 | -72 | -16.1 | 0 | 0 | 0 | 111.3 | L47 T236 L237 N243 M244 | L47-D240 HydrophobicContact CD2-CB 4.01Å; T236-D240 WeakPolarHBondContact O-CB 3.5Å; T236-D240 PolarHBondContact O-N 3.01Å; L237-D240 PolarHBondContact O-N 2.91Å; D240-N243 PolarHBondContact O-N 3.44Å; D240-M244 WeakPolarHBondContact O-CG 3.42Å; D240-M244 PolarHBondContact O-N 3.32Å |
| 241 | I | 93.4 | Very high | 92.5 | Very high | 0 Ų | 0 | 53.6 Ų | 53.6 | 0% | 0 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -62.9 | -47.6 | 177 | -66.3 | 166.9 | 0 | 0 | 0 | 110.4 | L51 L128 L174 L237 H239 N243 M244 L245 F251 | L51-I241 HydrophobicContact CB-CD1 3.72Å; L51-I241 HydrophobicContact CD1-CD1 3.8Å; L51-I241 HydrophobicContact CD2-CD1 4.11Å; L51-I241 HydrophobicContact CG-CD1 4.06Å; L128-I241 HydrophobicContact CD1-CG2 3.91Å; L174-I241 HydrophobicContact CD1-CB 4.18Å; L174-I241 HydrophobicContact CD1-CG2 3.99Å; L174-I241 HydrophobicContact CD2-CG2 3.99Å; L237-I241 HydrophobicContact CD1-CD1 3.64Å; L237-I241 HydrophobicContact CD1-CG1 4.21Å; L237-I241 HydrophobicContact CG-CD1 3.73Å; L237-I241 WeakPolarHBondContact O-CB 3.37Å; L237-I241 WeakPolarHBondContact O-CD1 3.29Å; L237-I241 VanDerWaalsContact O-CG1 3.23Å; L237-I241 WeakPolarHBondContact O-CG1 3.47Å; L237-I241 PolarHBondContact O-N 2.85Å; H239-I241 PolarHBondContact O-N 3.12Å; I241-N243 PolarHBondContact O-N 3.18Å; I241-M244 WeakPolarHBondContact O-CB 3.27Å; I241-M244 PolarHBondContact O-N 3.32Å; I241-M244 VanDerWaalsContact O-N 3.14Å; I241-L245 HydrophobicContact CG2-CD1 4.07Å; I241-L245 HydrophobicContact CG2-CG 4.31Å; I241-L245 WeakPolarHBondContact O-CG 3.4Å; I241-L245 PolarHBondContact O-N 2.84Å; I241-F251 HydrophobicContact CG2-CZ 4.04Å |
| 242 | A | 93.9 | Very high | 92.1 | Very high | 0 Ų | 0 | 50 Ų | 50 | 0% | 0 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -65.3 | -33 | -177.2 | 0 | 0 | 0 | 0 | 0 | 111.8 | A164 I172 L174 A238 H239 L245 I246 | A164-A242 HydrophobicContact CB-CB 3.9Å; A164-A242 VanDerWaalsContact CB-O 3.32Å; A164-A242 WeakPolarHBondContact CB-O 3.33Å; I172-A242 HydrophobicContact CG2-CB 3.38Å; L174-A242 HydrophobicContact CD2-CB 3.51Å; L174-A242 HydrophobicContact CG-CB 3.92Å; A238-A242 WeakPolarHBondContact O-CB 3.07Å; A238-A242 PolarHBondContact O-N 3.4Å; H239-A242 PolarHBondContact O-N 2.91Å; A242-L245 PolarHBondContact O-N 2.95Å; A242-I246 WeakPolarHBondContact O-CB 3.41Å; A242-I246 PolarHBondContact O-N 3.4Å |
| 243 | N | 92.9 | Very high | 91.4 | Very high | 61 Ų | 61 | 52.2 Ų | 52.2 | 33% | 0.326 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -66.2 | -41.1 | 174.2 | -160.5 | 21.9 | 0 | 0 | 0 | 111.7 | H239 D240 I241 H247 | H239-N243 VanDerWaalsContact O-CB 3.26Å; H239-N243 WeakPolarHBondContact O-CB 3.29Å; H239-N243 PolarHBondContact O-N 2.84Å; D240-N243 PolarHBondContact O-N 3.44Å; I241-N243 PolarHBondContact O-N 3.18Å; N243-H247 PolarHBondContact O-N 3.19Å; N243-H247 PolarHBondContact O-ND1 2.84Å; N243-H247 PolarHBondContact OD1-CE1 2.91Å; N243-H247 PolarHBondContact OD1-ND1 2.75Å; N243-H247 VanDerWaalsContact OD1-ND1 3.12Å |
| 244 | M | 92.8 | Very high | 90.2 | Very high | 37 Ų | 37 | 58.8 Ų | 58.8 | 18% | 0.182 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -61.6 | -45.5 | 173.5 | -67.5 | -65.7 | -77.1 | 0 | 0 | 111.7 | L47 D240 I241 H247 G248 L249 F251 | L47-M244 HydrophobicContact CD1-CG 4.35Å; D240-M244 WeakPolarHBondContact O-CG 3.42Å; D240-M244 PolarHBondContact O-N 3.32Å; I241-M244 WeakPolarHBondContact O-CB 3.27Å; I241-M244 PolarHBondContact O-N 3.32Å; I241-M244 VanDerWaalsContact O-N 3.14Å; M244-H247 PolarHBondContact O-N 2.89Å; M244-G248 PolarHBondContact O-N 3.42Å; M244-L249 HydrophobicContact CB-CB 4.46Å; M244-L249 HydrophobicContact CE-CB 3.53Å; M244-L249 HydrophobicContact CE-CD1 4.2Å; M244-L249 PolarHBondContact O-N 3.02Å; M244-L249 HydrophobicContact SD-CB 3.9Å; M244-L249 HydrophobicContact SD-CD1 3.65Å; M244-L249 HydrophobicContact SD-CG 4.43Å; M244-F251 HydrophobicContact CB-CD1 3.77Å; M244-F251 HydrophobicContact CB-CE1 3.9Å; M244-F251 HydrophobicContact CE-CB 3.73Å; M244-F251 HydrophobicContact CE-CD1 4.14Å; M244-F251 HydrophobicContact CE-CG 4.29Å; M244-F251 HydrophobicContact CG-CD1 4.25Å |
| 245 | L | 94.3 | Very high | 88.3 | Confident | 1 Ų | 1 | 63.9 Ų | 63.9 | 1% | 0.005 | 34% | 0.343 | C | S | . | . | H | α-helix | trans | -67.3 | -42.4 | -179.3 | -65.1 | -179.2 | 0 | 0 | 0 | 112.8 | G125 H126 L128 A164 L174 I241 A242 H247 G248 F251 | G125-L245 VanDerWaalsContact O-CD2 3.3Å; G125-L245 WeakPolarHBondContact O-CD2 2.87Å; H126-L245 WeakPolarHBondContact CA-O 3.35Å; H126-L245 PolarHBondContact CD2-O 2.79Å; L128-L245 HydrophobicContact CD1-CD1 3.96Å; L128-L245 HydrophobicContact CD1-CD2 4.31Å; L128-L245 HydrophobicContact CD2-CD2 3.92Å; L128-L245 HydrophobicContact CG-CD1 3.98Å; L128-L245 HydrophobicContact CG-CD2 3.77Å; L128-L245 HydrophobicContact CG-CG 4.43Å; A164-L245 HydrophobicContact CB-CB 3.67Å; A164-L245 HydrophobicContact CB-CD1 4.33Å; L174-L245 HydrophobicContact CD2-CD1 3.91Å; I241-L245 HydrophobicContact CG2-CD1 4.07Å; I241-L245 HydrophobicContact CG2-CG 4.31Å; I241-L245 WeakPolarHBondContact O-CG 3.4Å; I241-L245 PolarHBondContact O-N 2.84Å; A242-L245 PolarHBondContact O-N 2.95Å; L245-H247 PolarHBondContact O-N 3.13Å; L245-G248 PolarHBondContact O-N 3.27Å; L245-G248 VanDerWaalsContact O-N 3.09Å; L245-F251 HydrophobicContact CD2-CE1 3.94Å; L245-F251 HydrophobicContact CG-CE1 4.47Å |
| 246 | I | 94 | Very high | 88.1 | Confident | 43 Ų | 43 | 61 Ų | 61 | 22% | 0.221 | 32% | 0.324 | C | S | . | . | H | α-helix | trans | -63.4 | -27.6 | 179.1 | -106.4 | 177.6 | 0 | 0 | 0 | 112.7 | A164 R166 I172 A242 | A164-I246 HydrophobicContact CB-CB 4.48Å; A164-I246 HydrophobicContact CB-CG1 3.98Å; R166-I246 HydrophobicContact CB-CD1 4.41Å; I172-I246 HydrophobicContact CB-CD1 4.2Å; I172-I246 HydrophobicContact CD1-CD1 3.82Å; I172-I246 HydrophobicContact CD1-CG2 4.2Å; I172-I246 HydrophobicContact CG1-CD1 3.68Å; I172-I246 HydrophobicContact CG2-CD1 3.56Å; I172-I246 HydrophobicContact CG2-CG1 4.43Å; A242-I246 WeakPolarHBondContact O-CB 3.41Å; A242-I246 PolarHBondContact O-N 3.4Å |
| 247 | H | 93.1 | Very high | 87.9 | Confident | 114 Ų | 114 | 59.7 Ų | 59.7 | 53% | 0.528 | 31% | 0.313 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -96.1 | 2.9 | 178.3 | -65.1 | 101.1 | 0 | 0 | 0 | 113.3 | N243 M244 L245 L249 | N243-H247 PolarHBondContact O-N 3.19Å; N243-H247 PolarHBondContact O-ND1 2.84Å; N243-H247 PolarHBondContact OD1-CE1 2.91Å; N243-H247 PolarHBondContact OD1-ND1 2.75Å; N243-H247 VanDerWaalsContact OD1-ND1 3.12Å; M244-H247 PolarHBondContact O-N 2.89Å; L245-H247 PolarHBondContact O-N 3.13Å; H247-L249 VanDerWaalsContact C-N 3.26Å; H247-L249 HydrophobicContact CB-CD1 4.17Å; H247-L249 HydrophobicContact CB-CG 3.94Å; H247-L249 PolarHBondContact O-N 3.15Å |
| 248 | G | 91.1 | Very high | 87.7 | Confident | 20 Ų | 20 | 62.1 Ų | 62.1 | 21% | 0.206 | 33% | 0.325 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 64.8 | 26.4 | -179.3 | 0 | 0 | 0 | 0 | 0 | 114 | D124 M244 L245 | D124-G248 WeakPolarHBondContact O-CA 3.38Å; M244-G248 PolarHBondContact O-N 3.42Å; L245-G248 PolarHBondContact O-N 3.27Å; L245-G248 VanDerWaalsContact O-N 3.09Å |
| 249 | L | 90.9 | Very high | 87.3 | Confident | 86 Ų | 86 | 64.6 Ų | 64.6 | 45% | 0.45 | 34% | 0.335 | S | S | . | . | trans | -83.4 | 127.7 | -177.5 | -62.5 | 177.8 | 0 | 0 | 0 | 110.8 | Q121 M244 H247 | Q121-L249 PolarHBondContact NE2-O 3.13Å; M244-L249 HydrophobicContact CB-CB 4.46Å; M244-L249 HydrophobicContact CE-CB 3.53Å; M244-L249 HydrophobicContact CE-CD1 4.2Å; M244-L249 PolarHBondContact O-N 3.02Å; M244-L249 HydrophobicContact SD-CB 3.9Å; M244-L249 HydrophobicContact SD-CD1 3.65Å; M244-L249 HydrophobicContact SD-CG 4.43Å; H247-L249 VanDerWaalsContact C-N 3.26Å; H247-L249 HydrophobicContact CB-CD1 4.17Å; H247-L249 HydrophobicContact CB-CG 3.94Å; H247-L249 PolarHBondContact O-N 3.15Å | ||
| 250 | Q | 89.9 | Confident | 87 | Confident | 91 Ų | 91 | 62.8 Ų | 62.8 | 43% | 0.425 | 33% | 0.329 | S | S | . | . | trans | -77.5 | 128.1 | 177.1 | -66.3 | -71.4 | -16.5 | 0 | 0 | 110.7 | Q121 S122 P123 | Q121-Q250 VanDerWaalsContact OE1-OE1 3.1Å; S122-Q250 PolarHBondContact O-NE2 3.04Å; P123-Q250 PolarHBondContact O-NE2 3.2Å | ||
| 251 | F | 88.4 | Confident | 86.6 | Confident | 6 Ų | 6 | 63.4 Ų | 63.4 | 3% | 0.026 | 33% | 0.332 | C | S | . | . | trans | -136.2 | -11.6 | 175.2 | 66.7 | -85.2 | 0 | 0 | 0 | 113.6 | P44 L47 A48 L128 I241 M244 L245 | P44-F251 HydrophobicContact CB-CB 3.86Å; L47-F251 HydrophobicContact CB-CD2 4.07Å; L47-F251 HydrophobicContact CB-CE2 4.3Å; A48-F251 HydrophobicContact CB-CD2 4.16Å; A48-F251 HydrophobicContact CB-CE2 4.26Å; L128-F251 HydrophobicContact CD1-CZ 3.98Å; L128-F251 HydrophobicContact CD2-CE1 4.2Å; L128-F251 HydrophobicContact CD2-CZ 3.82Å; L128-F251 HydrophobicContact CG-CZ 4.45Å; I241-F251 HydrophobicContact CG2-CZ 4.04Å; M244-F251 HydrophobicContact CB-CD1 3.77Å; M244-F251 HydrophobicContact CB-CE1 3.9Å; M244-F251 HydrophobicContact CE-CB 3.73Å; M244-F251 HydrophobicContact CE-CD1 4.14Å; M244-F251 HydrophobicContact CE-CG 4.29Å; M244-F251 HydrophobicContact CG-CD1 4.25Å; L245-F251 HydrophobicContact CD2-CE1 3.94Å; L245-F251 HydrophobicContact CG-CE1 4.47Å | ||
| 252 | V | 84.9 | Confident | 86.2 | Confident | 20 Ų | 20 | 67.9 Ų | 67.9 | 12% | 0.121 | 36% | 0.356 | C | S | . | . | S | Bend | trans | -87.4 | 113 | 171.6 | -175.2 | 0 | 0 | 0 | 0 | 109 | A48 L119 Q121 L128 | A48-V252 HydrophobicContact CB-CG2 4.2Å; L119-V252 HydrophobicContact CD2-CG2 3.77Å; L119-V252 HydrophobicContact CG-CG1 4.46Å; L119-V252 HydrophobicContact CG-CG2 4.09Å; L119-V252 WeakPolarHBondContact O-CG1 3.41Å; Q121-V252 HydrophobicContact CB-CB 3.86Å; Q121-V252 HydrophobicContact CB-CG2 3.87Å; L128-V252 HydrophobicContact CD2-CG2 3.96Å |
| 253 | I | 77.7 | Confident | 85.6 | Confident | 112 Ų | 112 | 73.2 Ų | 73.2 | 57% | 0.574 | 38% | 0.383 | S | S | * | . | trans | -77.3 | 124.7 | 177.1 | -58.3 | 175.7 | 0 | 0 | 0 | 108.6 | T45 V255 | T45-I253 HydrophobicContact CG2-CD1 3.98Å; T45-I253 WeakPolarHBondContact OG1-CD1 3.14Å; I253-V255 PolarHBondContact O-N 3.27Å | ||
| 254 | K | 69.4 | Low | 85 | Confident | 156 Ų | 156 | 74.2 Ų | 74.2 | 68% | 0.678 | 39% | 0.388 | S | S | * | . | trans | -77.9 | 112.2 | 166.6 | -65.9 | -179.4 | -178.8 | 177.1 | 0 | 107.6 | ||||
| 255 | V | 52.9 | Low | 84.2 | Confident | 204 Ų | 204 | 77.5 Ų | 77.5 | 100% | 1.236 | 41% | 0.407 | S | S | * | . | trans | -82.8 | 0 | 170.9 | -173.3 | 0 | 0 | 0 | 0 | 109.1 | I253 | I253-V255 PolarHBondContact O-N 3.27Š|
Retrieved 255 of 255 residues in 416.4 ms
(Link to these results)