| 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 | 42.1 | Very low | 46.5 | Very low | 241 Ų | 241 | 147.6 Ų | 147.6 | 100% | 1.187 | 79% | 0.785 | S | S | * | * | 0 | 152 | 0 | -83.9 | -177.4 | 170 | 0 | 0 | 108.3 | |||||
| 2 | S | 38.7 | Very low | 46.8 | Very low | 107 Ų | 107 | 145 Ų | 145 | 75% | 0.748 | 78% | 0.783 | S | S | * | * | trans | 69.2 | 102.6 | -176.1 | 53.5 | 0 | 0 | 0 | 0 | 116.2 | ||||
| 3 | E | 37.9 | Very low | 47.2 | Very low | 163 Ų | 163 | 141.3 Ų | 141.3 | 76% | 0.762 | 78% | 0.775 | S | S | * | * | 63.7 | 112.4 | 71 | -81.2 | 179.8 | 122.9 | 0 | 0 | 113.2 | |||||
| 4 | F | 43.6 | Very low | 47.5 | Very low | 172 Ų | 172 | 141.8 Ų | 141.8 | 75% | 0.754 | 78% | 0.776 | S | S | * | * | 174.1 | 154.7 | 97.9 | -103.7 | -78.1 | 0 | 0 | 0 | 112.1 | |||||
| 5 | D | 45 | Very low | 47.9 | Very low | 144 Ų | 144 | 141.8 Ų | 141.8 | 77% | 0.77 | 77% | 0.773 | S | S | * | * | trans | 78 | 92 | 160.5 | -74 | -13.9 | 0 | 0 | 0 | 120.4 | ||||
| 6 | T | 52.8 | Low | 48.3 | Very low | 140 Ų | 140 | 139.4 Ų | 139.4 | 86% | 0.859 | 76% | 0.759 | S | S | * | * | trans | -122.9 | 112.2 | 143.6 | -52.3 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 7 | N | 53.2 | Low | 48.6 | Very low | 103 Ų | 103 | 137.2 Ų | 137.2 | 55% | 0.551 | 75% | 0.753 | S | S | * | * | trans | -58.8 | 122.1 | -175.5 | -177.7 | -3.2 | 0 | 0 | 0 | 111.4 | F9 A10 | N7-F9 PolarHBondContact O-N 3.1Å; N7-F9 VanDerWaalsContact O-N 3.12Å; N7-F9 PolarHBondContact OD1-N 3.12Å; N7-F9 VanDerWaalsContact OD1-N 3.1Å; N7-A10 PolarHBondContact O-N 3.26Å | ||
| 8 | P | 52.6 | Low | 48.3 | Very low | 119 Ų | 119 | 138.4 Ų | 138.4 | 77% | 0.773 | 75% | 0.75 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74.3 | 2.9 | -178.1 | 30.5 | -34.4 | 0 | 0 | 0 | 114.1 | ||
| 9 | F | 43.5 | Very low | 48.6 | Very low | 180 Ų | 180 | 138.4 Ų | 138.4 | 79% | 0.789 | 75% | 0.75 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -112.7 | 13.6 | 174.7 | -62.3 | -78.4 | 0 | 0 | 0 | 113.7 | N7 E11 | N7-F9 PolarHBondContact O-N 3.1Å; N7-F9 VanDerWaalsContact O-N 3.12Å; N7-F9 PolarHBondContact OD1-N 3.12Å; N7-F9 VanDerWaalsContact OD1-N 3.1Å; F9-E11 PolarHBondContact O-N 3.3Å |
| 10 | A | 51.8 | Low | 48.8 | Very low | 71 Ų | 71 | 135.5 Ų | 135.5 | 59% | 0.587 | 73% | 0.733 | S | S | * | * | trans | -70.8 | 114.6 | 171.8 | 0 | 0 | 0 | 0 | 0 | 110 | N7 | N7-A10 PolarHBondContact O-N 3.26Š| ||
| 11 | E | 50.8 | Low | 49.1 | Very low | 184 Ų | 184 | 133.6 Ų | 133.6 | 86% | 0.86 | 73% | 0.728 | S | S | * | * | trans | -58.4 | 126 | 175.2 | -70.4 | -170.1 | 149.8 | 0 | 0 | 110.6 | F9 S13 | F9-E11 PolarHBondContact O-N 3.3Å; E11-S13 PolarHBondContact O-N 2.83Å | ||
| 12 | P | 49.8 | Very low | 49.7 | Very low | 116 Ų | 116 | 125.6 Ų | 125.6 | 75% | 0.753 | 70% | 0.696 | S | S | * | * | trans | -67.2 | 127.3 | 166.5 | 26.5 | -29.1 | 0 | 0 | 0 | 108.6 | N14 | P12-N14 PolarHBondContact O-N 3.41Š| ||
| 13 | S | 52.5 | Low | 50.3 | Low | 97 Ų | 97 | 124 Ų | 124 | 68% | 0.678 | 68% | 0.682 | S | S | * | * | trans | -21.3 | 123.1 | 171 | 49.9 | 0 | 0 | 0 | 0 | 114.5 | E11 I15 | E11-S13 PolarHBondContact O-N 2.83Å; S13-I15 PolarHBondContact O-N 3.34Å | ||
| 14 | N | 51.4 | Low | 51.1 | Low | 148 Ų | 148 | 119.8 Ų | 119.8 | 79% | 0.791 | 67% | 0.667 | S | S | * | * | trans | -33.3 | 87.7 | 169.5 | -161.4 | -17.7 | 0 | 0 | 0 | 113.6 | P12 N16 | P12-N14 PolarHBondContact O-N 3.41Å; N14-N16 PolarHBondContact O-N 3.31Å | ||
| 15 | I | 52.5 | Low | 51.5 | Low | 142 Ų | 142 | 119.2 Ų | 119.2 | 73% | 0.728 | 67% | 0.667 | S | S | * | * | trans | -82.3 | 99.8 | 168.8 | -71 | 159.5 | 0 | 0 | 0 | 105.8 | S13 P17 | S13-I15 PolarHBondContact O-N 3.34Å; I15-P17 WeakPolarHBondContact O-CD 3.2Å | ||
| 16 | N | 54.8 | Low | 51.8 | Low | 104 Ų | 104 | 117.9 Ų | 117.9 | 56% | 0.556 | 66% | 0.664 | S | S | * | * | trans | -65.4 | 111.7 | 170.5 | -109.9 | -42.2 | 0 | 0 | 0 | 108.7 | N14 F18 N19 | N14-N16 PolarHBondContact O-N 3.31Å; N16-F18 PolarHBondContact O-N 3.3Å; N16-N19 PolarHBondContact O-N 3.43Å | ||
| 17 | P | 53.4 | Low | 51.7 | Low | 101 Ų | 101 | 116.8 Ų | 116.8 | 66% | 0.656 | 66% | 0.657 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71 | -3.5 | -173.8 | 29.1 | -34 | 0 | 0 | 0 | 113.4 | I15 | I15-P17 WeakPolarHBondContact O-CD 3.2Š|
| 18 | F | 43.9 | Very low | 51.5 | Low | 159 Ų | 159 | 118.7 Ų | 118.7 | 70% | 0.697 | 67% | 0.667 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -93.9 | -0.4 | 178.4 | -67.5 | -77.9 | 0 | 0 | 0 | 114.1 | N16 D20 | N16-F18 PolarHBondContact O-N 3.3Å; F18-D20 VanDerWaalsContact C-N 3.27Å; F18-D20 PolarHBondContact O-N 3.24Å |
| 19 | N | 52.4 | Low | 51 | Low | 139 Ų | 139 | 116.4 Ų | 116.4 | 74% | 0.743 | 65% | 0.654 | S | S | * | * | trans | -91.8 | 20.8 | -179.1 | -125.2 | 19 | 0 | 0 | 0 | 113.4 | N16 | N16-N19 PolarHBondContact O-N 3.43Š| ||
| 20 | D | 53.5 | Low | 51.2 | Low | 79 Ų | 79 | 114 Ų | 114 | 42% | 0.422 | 66% | 0.659 | S | S | . | * | trans | -71.4 | 130.2 | 177.6 | -169.2 | -49.1 | 0 | 0 | 0 | 110.5 | F18 S22 V23 | F18-D20 VanDerWaalsContact C-N 3.27Å; F18-D20 PolarHBondContact O-N 3.24Å; D20-S22 PolarHBondContact O-N 3.29Å; D20-S22 WeakPolarHBondContact OD1-CB 3.5Å; D20-S22 PolarHBondContact OD1-N 3.42Å; D20-S22 PolarHBondContact OD1-OG 3.01Å; D20-V23 HydrophobicContact CB-CG2 4.26Å; D20-V23 PolarHBondContact O-N 3.08Å | ||
| 21 | P | 54.9 | Low | 50.7 | Low | 96 Ų | 96 | 117.1 Ų | 117.1 | 62% | 0.623 | 67% | 0.665 | S | S | * | * | H | α-helix | trans | -59.8 | -14.4 | 178.5 | 23.1 | -33.1 | 0 | 0 | 0 | 114.6 | T24 | P21-T24 WeakPolarHBondContact CA-OG1 3.5Å; P21-T24 PolarHBondContact O-OG1 3.26Å |
| 22 | S | 55 | Low | 50.5 | Low | 74 Ų | 74 | 116.7 Ų | 116.7 | 52% | 0.517 | 66% | 0.663 | S | S | . | * | H | α-helix | trans | -77.8 | -24.1 | 172.7 | 62.5 | 0 | 0 | 0 | 0 | 113.9 | D20 | D20-S22 PolarHBondContact O-N 3.29Å; D20-S22 WeakPolarHBondContact OD1-CB 3.5Å; D20-S22 PolarHBondContact OD1-N 3.42Å; D20-S22 PolarHBondContact OD1-OG 3.01Å |
| 23 | V | 51.9 | Low | 50.2 | Low | 74 Ų | 74 | 116.9 Ų | 116.9 | 45% | 0.448 | 66% | 0.664 | S | S | . | * | H | α-helix | trans | -84.1 | -31.7 | 179.6 | 179.3 | 0 | 0 | 0 | 0 | 111.6 | D20 T27 | D20-V23 HydrophobicContact CB-CG2 4.26Å; D20-V23 PolarHBondContact O-N 3.08Å; V23-T27 PolarHBondContact O-OG1 3.25Å |
| 24 | T | 53.1 | Low | 49.7 | Very low | 73 Ų | 73 | 119.1 Ų | 119.1 | 45% | 0.448 | 67% | 0.673 | S | S | . | * | H | α-helix | trans | -77.9 | -16.2 | 178.9 | 35.9 | 0 | 0 | 0 | 0 | 113.9 | P21 T27 | P21-T24 WeakPolarHBondContact CA-OG1 3.5Å; P21-T24 PolarHBondContact O-OG1 3.26Å; T24-T27 PolarHBondContact O-OG1 3.04Å |
| 25 | Q | 53 | Low | 49.4 | Very low | 160 Ų | 160 | 119.4 Ų | 119.4 | 75% | 0.748 | 68% | 0.675 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79 | -22.9 | 173.9 | -77 | -163.7 | 1.4 | 0 | 0 | 113.9 | T27 | Q25-T27 VanDerWaalsContact C-N 3.35Š|
| 26 | V | 50.8 | Low | 49.2 | Very low | 117 Ų | 117 | 121 Ų | 121 | 71% | 0.709 | 68% | 0.679 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77.4 | -24.6 | 176.3 | -176.9 | 0 | 0 | 0 | 0 | 111.6 | ||
| 27 | T | 50.7 | Low | 48.6 | Very low | 116 Ų | 116 | 126.4 Ų | 126.4 | 71% | 0.712 | 69% | 0.693 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -88.1 | -6.6 | 178.9 | 26 | 0 | 0 | 0 | 0 | 114 | V23 T24 Q25 | V23-T27 PolarHBondContact O-OG1 3.25Å; T24-T27 PolarHBondContact O-OG1 3.04Å; Q25-T27 VanDerWaalsContact C-N 3.35Å |
| 28 | N | 48.9 | Very low | 48.5 | Very low | 144 Ų | 144 | 126.5 Ų | 126.5 | 77% | 0.77 | 69% | 0.688 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -121.7 | 31.4 | -177.2 | -118.6 | -19 | 0 | 0 | 0 | 113.4 | S30 | N28-S30 PolarHBondContact O-N 3.46Š|
| 29 | S | 41.9 | Very low | 48.3 | Very low | 70 Ų | 70 | 123.1 Ų | 123.1 | 49% | 0.49 | 68% | 0.682 | S | S | . | * | trans | -76.5 | 112.8 | 164 | 51 | 0 | 0 | 0 | 0 | 109.4 | I31 | S29-I31 VanDerWaalsContact C-N 3.35Å; S29-I31 PolarHBondContact O-N 2.97Å | ||
| 30 | S | 48.4 | Very low | 48 | Very low | 130 Ų | 130 | 124 Ų | 124 | 91% | 0.909 | 68% | 0.68 | S | S | * | * | trans | -59.2 | 96.8 | 164.5 | -71.6 | 0 | 0 | 0 | 0 | 109.2 | N28 | N28-S30 PolarHBondContact O-N 3.46Š| ||
| 31 | I | 41.9 | Very low | 47.5 | Very low | 136 Ų | 136 | 126 Ų | 126 | 70% | 0.697 | 70% | 0.697 | S | S | * | * | trans | -115.4 | 118.8 | 168.5 | -64.9 | 172.1 | 0 | 0 | 0 | 105.2 | S29 | S29-I31 VanDerWaalsContact C-N 3.35Å; S29-I31 PolarHBondContact O-N 2.97Å | ||
| 32 | E | 46.5 | Very low | 46.9 | Very low | 176 Ų | 176 | 126.9 Ų | 126.9 | 82% | 0.822 | 70% | 0.703 | S | S | * | * | P | Polyproline II helix | trans | -50.1 | 133.5 | 172.1 | -81.1 | 174.1 | 99.3 | 0 | 0 | 110.3 | V34 | E32-V34 PolarHBondContact O-N 3.41Š|
| 33 | P | 42.4 | Very low | 46.3 | Very low | 120 Ų | 120 | 129.3 Ų | 129.3 | 78% | 0.779 | 72% | 0.72 | S | S | * | * | P | Polyproline II helix | trans | -69.8 | 119 | 176.9 | 28.3 | -30.1 | 0 | 0 | 0 | 108.6 | D35 | P33-D35 PolarHBondContact O-N 3.32Š|
| 34 | V | 42.8 | Very low | 45.5 | Very low | 144 Ų | 144 | 130.7 Ų | 130.7 | 87% | 0.873 | 73% | 0.733 | S | S | * | * | P | Polyproline II helix | trans | -58.8 | 121.4 | 170.3 | 173.9 | 0 | 0 | 0 | 0 | 108.2 | E32 Q36 | E32-V34 PolarHBondContact O-N 3.41Å; V34-Q36 PolarHBondContact O-N 2.86Å |
| 35 | D | 45.3 | Very low | 44.6 | Very low | 154 Ų | 154 | 132.6 Ų | 132.6 | 82% | 0.824 | 74% | 0.744 | S | S | * | * | P | Polyproline II helix | trans | -49.4 | 131.8 | 179.3 | -84.7 | -55.4 | 0 | 0 | 0 | 113 | P33 Y37 | P33-D35 PolarHBondContact O-N 3.32Å; D35-Y37 PolarHBondContact O-N 3.42Å; D35-Y37 VanDerWaalsContact O-N 3.13Å |
| 36 | Q | 47.6 | Very low | 43.4 | Very low | 175 Ų | 175 | 136 Ų | 136 | 82% | 0.818 | 75% | 0.75 | S | S | * | * | trans | -43.4 | 102.5 | 165.8 | -164.8 | 101.8 | 11.2 | 0 | 0 | 112.2 | V34 N38 | V34-Q36 PolarHBondContact O-N 2.86Å; Q36-N38 HydrophobicContact CG-CB 4.49Å; Q36-N38 PolarHBondContact O-N 3.05Å | ||
| 37 | Y | 41.8 | Very low | 42.6 | Very low | 218 Ų | 218 | 141.4 Ų | 141.4 | 86% | 0.855 | 76% | 0.758 | S | S | * | * | trans | -69.9 | 93.8 | 166 | -162.2 | -85 | 0 | 0 | 0 | 109.2 | D35 | D35-Y37 PolarHBondContact O-N 3.42Å; D35-Y37 VanDerWaalsContact O-N 3.13Å | ||
| 38 | N | 51.8 | Low | 41.7 | Very low | 102 Ų | 102 | 143.9 Ų | 143.9 | 55% | 0.545 | 76% | 0.761 | S | S | . | * | trans | -105.7 | 113.5 | 174.6 | -172 | 24 | 0 | 0 | 0 | 109.3 | Q36 F40 | Q36-N38 HydrophobicContact CG-CB 4.49Å; Q36-N38 PolarHBondContact O-N 3.05Å; N38-F40 PolarHBondContact ND2-O 2.99Å; N38-F40 VanDerWaalsContact ND2-O 3.11Å; N38-F40 PolarHBondContact O-N 3.43Å; N38-F40 VanDerWaalsContact O-N 3.11Å | ||
| 39 | P | 39.5 | Very low | 40.7 | Very low | 89 Ų | 89 | 142.9 Ų | 142.9 | 58% | 0.578 | 76% | 0.756 | S | S | * | * | S | Bend | trans | -77.7 | 9.9 | -173.5 | 29.9 | -32.3 | 0 | 0 | 0 | 114.6 | ||
| 40 | F | 46.2 | Very low | 40 | Very low | 158 Ų | 158 | 149 Ų | 149 | 69% | 0.693 | 77% | 0.774 | S | S | * | * | S | Bend | trans | -137.7 | 121.3 | 176.7 | -62 | -77.1 | 0 | 0 | 0 | 111.3 | N38 | N38-F40 PolarHBondContact ND2-O 2.99Å; N38-F40 VanDerWaalsContact ND2-O 3.11Å; N38-F40 PolarHBondContact O-N 3.43Å; N38-F40 VanDerWaalsContact O-N 3.11Å |
| 41 | P | 42.7 | Very low | 39.1 | Very low | 121 Ų | 121 | 147.5 Ų | 147.5 | 79% | 0.786 | 77% | 0.77 | S | S | * | * | P | Polyproline II helix | trans | -81 | 131.9 | -177.1 | 30.3 | -31.7 | 0 | 0 | 0 | 111.7 | ||
| 42 | P | 43.7 | Very low | 38.6 | Very low | 114 Ų | 114 | 144.6 Ų | 144.6 | 74% | 0.74 | 77% | 0.773 | S | S | * | * | P | Polyproline II helix | trans | -87.4 | 122.6 | 164.8 | 30.7 | -27.6 | 0 | 0 | 0 | 110.7 | ||
| 43 | S | 40.7 | Very low | 37.8 | Very low | 125 Ų | 125 | 140.5 Ų | 140.5 | 87% | 0.874 | 77% | 0.769 | S | S | * | * | P | Polyproline II helix | trans | -61.9 | 139.1 | 168.8 | -40.4 | 0 | 0 | 0 | 0 | 110.9 | ||
| 44 | S | 36.4 | Very low | 37.2 | Very low | 102 Ų | 102 | 143.1 Ų | 143.1 | 71% | 0.713 | 77% | 0.771 | S | S | * | * | P | Polyproline II helix | trans | -85 | 158.3 | -167.9 | 53.3 | 0 | 0 | 0 | 0 | 115.5 | ||
| 45 | V | 32.7 | Very low | 36.7 | Very low | 114 Ų | 114 | 142.5 Ų | 142.5 | 69% | 0.691 | 77% | 0.768 | S | S | * | * | trans | 84.1 | 134.5 | 151.5 | -163.6 | 0 | 0 | 0 | 0 | 115.3 | ||||
| 46 | R | 28.9 | Very low | 36.1 | Very low | 231 Ų | 231 | 141.5 Ų | 141.5 | 87% | 0.872 | 77% | 0.768 | S | S | * | * | cis | -156.8 | 153.7 | 20.1 | -142.6 | 168.4 | -76.7 | 179.9 | -1.5 | 109.6 | ||||
| 47 | R | 33.6 | Very low | 35.6 | Very low | 230 Ų | 230 | 139.4 Ų | 139.4 | 87% | 0.868 | 77% | 0.769 | S | S | * | * | trans | -98.8 | 132.3 | 165.4 | -136.1 | -173.9 | -75.3 | 159.4 | -6.1 | 108 | ||||
| 48 | Q | 31.4 | Very low | 35.3 | Very low | 169 Ų | 169 | 133.7 Ų | 133.7 | 79% | 0.79 | 77% | 0.767 | S | S | * | * | trans | 174 | 133.4 | 140.5 | -100.6 | 174.9 | -49.1 | 0 | 0 | 115.1 | ||||
| 49 | D | 27.6 | Very low | 34.4 | Very low | 122 Ų | 122 | 134.5 Ų | 134.5 | 65% | 0.652 | 78% | 0.781 | S | S | * | * | trans | 76.1 | 118.8 | 136.8 | -54.9 | -25.1 | 0 | 0 | 0 | 124.9 | ||||
| 50 | F | 28.6 | Very low | 34.3 | Very low | 198 Ų | 198 | 136.9 Ų | 136.9 | 87% | 0.868 | 79% | 0.794 | S | S | * | * | trans | 58 | 127.4 | 137.4 | -87.2 | -94.4 | 0 | 0 | 0 | 124.6 | ||||
| 51 | A | 29 | Very low | 33.9 | Very low | 100 Ų | 100 | 133.6 Ų | 133.6 | 83% | 0.826 | 80% | 0.796 | S | S | * | * | trans | 74.2 | 129.3 | 140.8 | 0 | 0 | 0 | 0 | 0 | 121.3 | ||||
| 52 | G | 30.6 | Very low | 33.8 | Very low | 74 Ų | 74 | 134 Ų | 134 | 76% | 0.763 | 80% | 0.798 | S | S | * | * | trans | 137.9 | 93.6 | 151.4 | 0 | 0 | 0 | 0 | 0 | 117.3 | ||||
| 53 | A | 30.4 | Very low | 33.2 | Very low | 90 Ų | 90 | 139.6 Ų | 139.6 | 74% | 0.744 | 81% | 0.806 | S | S | * | * | trans | 49.6 | 123.2 | 134.8 | 0 | 0 | 0 | 0 | 0 | 122.8 | ||||
| 54 | Q | 30.9 | Very low | 33.2 | Very low | 175 Ų | 175 | 142.4 Ų | 142.4 | 82% | 0.818 | 81% | 0.806 | S | S | * | * | 102.8 | 114.4 | 127.3 | -76.1 | 173.6 | -4 | 0 | 0 | 122.2 | |||||
| 55 | T | 31.1 | Very low | 33.5 | Very low | 131 Ų | 131 | 143.1 Ų | 143.1 | 80% | 0.804 | 81% | 0.808 | S | S | * | * | trans | 75 | 124 | 134.7 | 57.8 | 0 | 0 | 0 | 0 | 121.9 | ||||
| 56 | T | 32.9 | Very low | 33.8 | Very low | 134 Ų | 134 | 142.2 Ų | 142.2 | 82% | 0.822 | 81% | 0.812 | S | S | * | * | trans | -71.3 | 163 | 165.3 | 42.9 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 57 | P | 36.4 | Very low | 34.3 | Very low | 130 Ų | 130 | 137.7 Ų | 137.7 | 84% | 0.844 | 81% | 0.81 | S | S | * | * | -137 | 152.5 | 91.2 | 23.5 | -3.2 | 0 | 0 | 0 | 115.2 | |||||
| 58 | A | 35.4 | Very low | 34.7 | Very low | 98 Ų | 98 | 134.5 Ų | 134.5 | 81% | 0.81 | 81% | 0.809 | S | S | * | * | trans | -70.4 | 144.6 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 59 | S | 33.6 | Very low | 35 | Very low | 120 Ų | 120 | 135 Ų | 135 | 84% | 0.839 | 81% | 0.812 | S | S | * | * | trans | -109 | 118.1 | 162.7 | -175.5 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 60 | T | 37.2 | Very low | 35.7 | Very low | 139 Ų | 139 | 134.9 Ų | 134.9 | 85% | 0.853 | 82% | 0.818 | S | S | * | * | trans | -66 | 126.3 | 172.6 | 38.5 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 61 | A | 38.9 | Very low | 36.6 | Very low | 89 Ų | 89 | 131.1 Ų | 131.1 | 74% | 0.736 | 82% | 0.816 | S | S | * | * | trans | -124.4 | 145.1 | 160.3 | 0 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 62 | P | 38.9 | Very low | 37.6 | Very low | 128 Ų | 128 | 133 Ų | 133 | 83% | 0.831 | 82% | 0.817 | S | S | * | * | trans | -77.3 | 144.9 | -164.3 | 11.4 | -1 | 0 | 0 | 0 | 113.7 | ||||
| 63 | Y | 32.1 | Very low | 38.5 | Very low | 233 Ų | 233 | 138 Ų | 138 | 91% | 0.914 | 82% | 0.82 | S | S | * | * | trans | -53.6 | 128.9 | 175.8 | -80.2 | -107.1 | 0 | 0 | 0 | 113.3 | ||||
| 64 | Q | 40.3 | Very low | 39.4 | Very low | 184 Ų | 184 | 138.1 Ų | 138.1 | 86% | 0.86 | 81% | 0.814 | S | S | * | * | trans | -111.4 | 131.7 | 150.7 | -88.7 | 179.4 | -58.1 | 0 | 0 | 108.3 | A66 | Q64-A66 PolarHBondContact O-N 2.65Š| ||
| 65 | P | 42.9 | Very low | 40.7 | Very low | 117 Ų | 117 | 132.6 Ų | 132.6 | 76% | 0.76 | 80% | 0.795 | S | S | * | * | trans | -69 | 122.2 | 175.3 | 26.5 | -30.2 | 0 | 0 | 0 | 109.8 | V67 | P65-V67 PolarHBondContact O-N 3.12Š| ||
| 66 | A | 38.7 | Very low | 42 | Very low | 95 Ų | 95 | 131.4 Ų | 131.4 | 79% | 0.785 | 79% | 0.789 | S | S | * | * | trans | -67.5 | 112.2 | 171.4 | 0 | 0 | 0 | 0 | 0 | 109.2 | Q64 L68 | Q64-A66 PolarHBondContact O-N 2.65Å; A66-L68 PolarHBondContact O-N 3.13Å | ||
| 67 | V | 40.2 | Very low | 43.3 | Very low | 135 Ų | 135 | 132.6 Ų | 132.6 | 82% | 0.818 | 79% | 0.785 | S | S | * | * | trans | -81.4 | 109.9 | 170.8 | -167.2 | 0 | 0 | 0 | 0 | 107 | P65 Q69 | P65-V67 PolarHBondContact O-N 3.12Å; V67-Q69 PolarHBondContact O-N 3.11Å | ||
| 68 | L | 41.5 | Very low | 44.5 | Very low | 164 Ų | 164 | 128.7 Ų | 128.7 | 86% | 0.859 | 76% | 0.764 | S | S | * | * | trans | -68.4 | 113.2 | 171.3 | -69.1 | 167.2 | 0 | 0 | 0 | 108.5 | A66 | A66-L68 PolarHBondContact O-N 3.13Š| ||
| 69 | Q | 38.8 | Very low | 45.9 | Very low | 179 Ų | 179 | 127.2 Ų | 127.2 | 84% | 0.836 | 75% | 0.748 | S | S | * | * | trans | -70.8 | 131.7 | 163 | -87.9 | 173.6 | -5.1 | 0 | 0 | 108.5 | V67 S71 | V67-Q69 PolarHBondContact O-N 3.11Å; Q69-S71 PolarHBondContact O-N 2.85Å | ||
| 70 | P | 40.8 | Very low | 47.5 | Very low | 120 Ų | 120 | 124 Ų | 124 | 78% | 0.779 | 73% | 0.729 | S | S | * | * | trans | -68.4 | 122.9 | 172.3 | 7 | 4.2 | 0 | 0 | 0 | 108.6 | T72 | P70-T72 PolarHBondContact O-N 2.95Å; P70-T72 VanDerWaalsContact O-N 3.08Å | ||
| 71 | S | 47.6 | Very low | 49.2 | Very low | 119 Ų | 119 | 120.1 Ų | 120.1 | 83% | 0.832 | 71% | 0.711 | S | S | * | * | trans | -58.4 | 111.1 | 161.6 | -84.2 | 0 | 0 | 0 | 0 | 108.2 | Q69 E73 | Q69-S71 PolarHBondContact O-N 2.85Å; S71-E73 VanDerWaalsContact C-N 3.3Å; S71-E73 PolarHBondContact O-N 3.4Å | ||
| 72 | T | 49.8 | Very low | 50.8 | Low | 138 Ų | 138 | 118.3 Ų | 118.3 | 85% | 0.847 | 70% | 0.695 | S | S | * | * | trans | -70.9 | 90.9 | 164.3 | -2.7 | 0 | 0 | 0 | 0 | 107.4 | P70 P74 | P70-T72 PolarHBondContact O-N 2.95Å; P70-T72 VanDerWaalsContact O-N 3.08Å; T72-P74 WeakPolarHBondContact O-CD 3.34Å | ||
| 73 | E | 50 | Low | 52.5 | Low | 179 Ų | 179 | 114.5 Ų | 114.5 | 84% | 0.836 | 68% | 0.675 | S | S | * | * | P | Polyproline II helix | trans | -60.9 | 123.3 | 163.9 | -121.1 | 173.4 | 117.2 | 0 | 0 | 108 | S71 S75 | S71-E73 VanDerWaalsContact C-N 3.3Å; S71-E73 PolarHBondContact O-N 3.4Å; E73-S75 PolarHBondContact O-N 2.88Å |
| 74 | P | 49.4 | Very low | 54.5 | Low | 94 Ų | 94 | 109.8 Ų | 109.8 | 61% | 0.61 | 66% | 0.661 | S | S | * | * | P | Polyproline II helix | trans | -65.9 | 135.5 | 173.2 | -7.7 | 22 | 0 | 0 | 0 | 108.2 | T72 A78 | T72-P74 WeakPolarHBondContact O-CD 3.34Å; P74-A78 HydrophobicContact CB-CB 4.39Å |
| 75 | S | 58 | Low | 56.4 | Low | 59 Ų | 59 | 103 Ų | 103 | 41% | 0.413 | 64% | 0.637 | S | S | . | * | P | Polyproline II helix | trans | -54.9 | 147.2 | 175.4 | 65.7 | 0 | 0 | 0 | 0 | 110.8 | E73 Q77 A78 S79 | E73-S75 PolarHBondContact O-N 2.88Å; S75-Q77 PolarHBondContact O-N 3.43Å; S75-A78 WeakPolarHBondContact O-CA 3.34Å; S75-A78 WeakPolarHBondContact O-CB 3.5Å; S75-A78 PolarHBondContact O-N 2.89Å; S75-A78 PolarHBondContact OG-N 3.28Å; S75-S79 PolarHBondContact O-N 3.43Å; S75-S79 VanDerWaalsContact O-N 3.13Å |
| 76 | P | 59.6 | Low | 58.1 | Low | 106 Ų | 106 | 101.9 Ų | 101.9 | 69% | 0.688 | 62% | 0.624 | S | S | * | * | H | α-helix | trans | -57.8 | -19.5 | 179.7 | 18.1 | -29.8 | 0 | 0 | 0 | 113.4 | S79 A80 | P76-S79 PolarHBondContact O-OG 2.92Å; P76-S79 VanDerWaalsContact O-OG 3.11Å; P76-A80 VanDerWaalsContact O-CB 3.26Å; P76-A80 WeakPolarHBondContact O-CB 3.26Å; P76-A80 PolarHBondContact O-N 2.96Å; P76-A80 VanDerWaalsContact O-N 3.12Å |
| 77 | Q | 59.3 | Low | 60 | Low | 158 Ų | 158 | 102.6 Ų | 102.6 | 74% | 0.738 | 61% | 0.614 | S | S | * | * | H | α-helix | trans | -76.6 | -36.5 | 172.9 | -69.6 | 160.1 | -33.5 | 0 | 0 | 112.6 | S75 A81 | S75-Q77 PolarHBondContact O-N 3.43Å; Q77-A81 WeakPolarHBondContact O-CB 3.48Å; Q77-A81 PolarHBondContact O-N 2.96Å |
| 78 | A | 61.2 | Low | 62.1 | Low | 48 Ų | 48 | 101.3 Ų | 101.3 | 40% | 0.397 | 60% | 0.602 | S | S | . | * | H | α-helix | trans | -72.3 | -35.6 | 175.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | P74 S75 A82 | P74-A78 HydrophobicContact CB-CB 4.39Å; S75-A78 WeakPolarHBondContact O-CA 3.34Å; S75-A78 WeakPolarHBondContact O-CB 3.5Å; S75-A78 PolarHBondContact O-N 2.89Å; S75-A78 PolarHBondContact OG-N 3.28Å; A78-A82 VanDerWaalsContact O-CB 3.31Å; A78-A82 WeakPolarHBondContact O-CB 3.31Å; A78-A82 PolarHBondContact O-N 2.91Å |
| 79 | S | 65.2 | Low | 64.1 | Low | 67 Ų | 67 | 101.1 Ų | 101.1 | 47% | 0.469 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -69.8 | -37.8 | 173.3 | 74.3 | 0 | 0 | 0 | 0 | 112 | S75 P76 A82 A83 | S75-S79 PolarHBondContact O-N 3.43Å; S75-S79 VanDerWaalsContact O-N 3.13Å; P76-S79 PolarHBondContact O-OG 2.92Å; P76-S79 VanDerWaalsContact O-OG 3.11Å; S79-A82 PolarHBondContact O-N 3.5Å; S79-A83 WeakPolarHBondContact O-CB 3.42Å; S79-A83 PolarHBondContact O-N 2.93Å |
| 80 | A | 67.3 | Low | 66.2 | Low | 54 Ų | 54 | 98 Ų | 98 | 45% | 0.446 | 58% | 0.576 | S | S | . | * | H | α-helix | trans | -65.9 | -42.7 | 174.1 | 0 | 0 | 0 | 0 | 0 | 111.9 | P76 A83 Q84 | P76-A80 VanDerWaalsContact O-CB 3.26Å; P76-A80 WeakPolarHBondContact O-CB 3.26Å; P76-A80 PolarHBondContact O-N 2.96Å; P76-A80 VanDerWaalsContact O-N 3.12Å; A80-A83 PolarHBondContact O-N 3.42Å; A80-Q84 WeakPolarHBondContact O-CB 3.39Å; A80-Q84 PolarHBondContact O-N 3.22Å |
| 81 | A | 72.6 | Confident | 68.2 | Low | 57 Ų | 57 | 97.8 Ų | 97.8 | 47% | 0.471 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -64.4 | -39.2 | 175 | 0 | 0 | 0 | 0 | 0 | 112.1 | Q77 Q84 A85 | Q77-A81 WeakPolarHBondContact O-CB 3.48Å; Q77-A81 PolarHBondContact O-N 2.96Å; A81-Q84 PolarHBondContact O-N 3.46Å; A81-A85 WeakPolarHBondContact O-CB 3.36Å; A81-A85 PolarHBondContact O-N 3.21Å |
| 82 | A | 73.8 | Confident | 70.1 | Confident | 50 Ų | 50 | 98.7 Ų | 98.7 | 41% | 0.413 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -66.9 | -38.3 | 174 | 0 | 0 | 0 | 0 | 0 | 112.3 | A78 S79 A85 N86 | A78-A82 VanDerWaalsContact O-CB 3.31Å; A78-A82 WeakPolarHBondContact O-CB 3.31Å; A78-A82 PolarHBondContact O-N 2.91Å; S79-A82 PolarHBondContact O-N 3.5Å; A82-A85 PolarHBondContact O-N 3.21Å; A82-N86 WeakPolarHBondContact O-CB 3.36Å; A82-N86 VanDerWaalsContact O-CG 3.3Å; A82-N86 PolarHBondContact O-N 3.23Å; A82-N86 PolarHBondContact O-ND2 3.12Å |
| 83 | A | 73.9 | Confident | 71.8 | Confident | 49 Ų | 49 | 97.9 Ų | 97.9 | 41% | 0.405 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -65.3 | -42 | 174.1 | 0 | 0 | 0 | 0 | 0 | 111.7 | S79 A80 A85 N86 L87 | S79-A83 WeakPolarHBondContact O-CB 3.42Å; S79-A83 PolarHBondContact O-N 2.93Å; A80-A83 PolarHBondContact O-N 3.42Å; A83-A85 PolarHBondContact O-N 3.23Å; A83-N86 PolarHBondContact O-N 3.41Å; A83-L87 WeakPolarHBondContact O-CG 3.35Å; A83-L87 PolarHBondContact O-N 2.96Å |
| 84 | Q | 73.8 | Confident | 73.2 | Confident | 134 Ų | 134 | 94.5 Ų | 94.5 | 63% | 0.626 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -65.4 | -38.9 | 177.1 | -143.1 | 170 | 13.6 | 0 | 0 | 111.7 | A80 A81 L87 L88 | A80-Q84 WeakPolarHBondContact O-CB 3.39Å; A80-Q84 PolarHBondContact O-N 3.22Å; A81-Q84 PolarHBondContact O-N 3.46Å; Q84-L87 PolarHBondContact O-N 3.4Å; Q84-L88 PolarHBondContact O-N 2.93Å |
| 85 | A | 79.6 | Confident | 74.9 | Confident | 42 Ų | 42 | 96.4 Ų | 96.4 | 35% | 0.347 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -66.2 | -36.1 | 173.1 | 0 | 0 | 0 | 0 | 0 | 112.8 | A81 A82 A83 R89 | A81-A85 WeakPolarHBondContact O-CB 3.36Å; A81-A85 PolarHBondContact O-N 3.21Å; A82-A85 PolarHBondContact O-N 3.21Å; A83-A85 PolarHBondContact O-N 3.23Å; A85-R89 PolarHBondContact O-N 2.87Å; A85-R89 VanDerWaalsContact O-N 3.1Å |
| 86 | N | 80.1 | Confident | 76.3 | Confident | 93 Ų | 93 | 103.3 Ų | 103.3 | 50% | 0.497 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -70.7 | -36.5 | 175.3 | -75.8 | -29.4 | 0 | 0 | 0 | 112.4 | A82 A83 R89 Q90 | A82-N86 WeakPolarHBondContact O-CB 3.36Å; A82-N86 VanDerWaalsContact O-CG 3.3Å; A82-N86 PolarHBondContact O-N 3.23Å; A82-N86 PolarHBondContact O-ND2 3.12Å; A83-N86 PolarHBondContact O-N 3.41Å; N86-R89 PolarHBondContact O-N 3.06Å; N86-Q90 WeakPolarHBondContact O-CB 3.47Å; N86-Q90 PolarHBondContact O-N 3.1Å |
| 87 | L | 78.2 | Confident | 77.6 | Confident | 109 Ų | 109 | 104.9 Ų | 104.9 | 57% | 0.571 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -65 | -42.2 | 174.1 | -71.2 | 172.6 | 0 | 0 | 0 | 111.7 | A83 Q84 Q90 Q91 | A83-L87 WeakPolarHBondContact O-CG 3.35Å; A83-L87 PolarHBondContact O-N 2.96Å; Q84-L87 PolarHBondContact O-N 3.4Å; L87-Q90 PolarHBondContact O-N 3.16Å; L87-Q91 WeakPolarHBondContact O-CB 3.41Å; L87-Q91 PolarHBondContact O-N 2.97Å |
| 88 | L | 83.6 | Confident | 78.6 | Confident | 108 Ų | 108 | 100.1 Ų | 100.1 | 57% | 0.565 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -61.5 | -43.6 | 174.8 | -83.5 | 158.4 | 0 | 0 | 0 | 112 | Q84 Q90 Q91 E92 | Q84-L88 PolarHBondContact O-N 2.93Å; L88-Q90 VanDerWaalsContact C-N 3.33Å; L88-Q90 PolarHBondContact O-N 3.31Å; L88-Q91 WeakPolarHBondContact O-CB 3.24Å; L88-Q91 PolarHBondContact O-N 3.45Å; L88-E92 PolarHBondContact O-N 3.32Å |
| 89 | R | 82.8 | Confident | 79.7 | Confident | 160 Ų | 160 | 100.9 Ų | 100.9 | 60% | 0.604 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -62.6 | -39.9 | 173.7 | -78.2 | -173.3 | 177.1 | 122 | 0.3 | 112.6 | A85 N86 Q91 E92 E93 | A85-R89 PolarHBondContact O-N 2.87Å; A85-R89 VanDerWaalsContact O-N 3.1Å; N86-R89 PolarHBondContact O-N 3.06Å; R89-Q91 VanDerWaalsContact C-N 3.31Å; R89-E92 PolarHBondContact O-N 3.45Å; R89-E93 PolarHBondContact O-N 3.48Å |
| 90 | Q | 83.7 | Confident | 80.6 | Confident | 115 Ų | 115 | 101.1 Ų | 101.1 | 54% | 0.537 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -68.7 | -33.6 | 178.6 | -167.3 | 166.8 | 76.9 | 0 | 0 | 111.7 | N86 L87 L88 E93 L94 | N86-Q90 WeakPolarHBondContact O-CB 3.47Å; N86-Q90 PolarHBondContact O-N 3.1Å; L87-Q90 PolarHBondContact O-N 3.16Å; L88-Q90 VanDerWaalsContact C-N 3.33Å; L88-Q90 PolarHBondContact O-N 3.31Å; Q90-E93 PolarHBondContact O-N 3.36Å; Q90-L94 HydrophobicContact CG-CD1 4.5Å; Q90-L94 WeakPolarHBondContact O-CB 3.22Å; Q90-L94 VanDerWaalsContact O-CG 3.24Å; Q90-L94 WeakPolarHBondContact O-CG 3.36Å; Q90-L94 PolarHBondContact O-N 3.3Å |
| 91 | Q | 83.5 | Confident | 81 | Confident | 115 Ų | 115 | 103.6 Ų | 103.6 | 54% | 0.537 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -65.9 | -44 | 173.9 | -162.1 | 165.1 | 24.5 | 0 | 0 | 111.3 | L87 L88 R89 L94 E95 | L87-Q91 WeakPolarHBondContact O-CB 3.41Å; L87-Q91 PolarHBondContact O-N 2.97Å; L88-Q91 WeakPolarHBondContact O-CB 3.24Å; L88-Q91 PolarHBondContact O-N 3.45Å; R89-Q91 VanDerWaalsContact C-N 3.31Å; Q91-L94 PolarHBondContact O-N 2.94Å; Q91-E95 WeakPolarHBondContact O-CG 3.49Å; Q91-E95 PolarHBondContact O-N 3.47Å |
| 92 | E | 87.6 | Confident | 81.6 | Confident | 138 Ų | 138 | 105 Ų | 105 | 65% | 0.645 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -63.8 | -40.3 | 175 | -170.7 | -179.6 | 177 | 0 | 0 | 112.2 | L88 R89 E95 R96 | L88-E92 PolarHBondContact O-N 3.32Å; R89-E92 PolarHBondContact O-N 3.45Å; E92-E95 PolarHBondContact O-N 2.93Å; E92-R96 WeakPolarHBondContact O-CB 3.37Å; E92-R96 PolarHBondContact O-N 3.11Å |
| 93 | E | 85.6 | Confident | 82.1 | Confident | 121 Ų | 121 | 108.6 Ų | 108.6 | 57% | 0.565 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -66.1 | -37.2 | 174.2 | -77.8 | -172.7 | -176.4 | 0 | 0 | 113 | R89 Q90 R96 K97 | R89-E93 PolarHBondContact O-N 3.48Å; Q90-E93 PolarHBondContact O-N 3.36Å; E93-R96 PolarHBondContact O-N 3.41Å; E93-K97 WeakPolarHBondContact O-CG 3.36Å; E93-K97 PolarHBondContact O-N 3.13Å |
| 94 | L | 78.1 | Confident | 82.1 | Confident | 108 Ų | 108 | 113.5 Ų | 113.5 | 57% | 0.565 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -67.4 | -42.9 | 176.3 | -78.9 | 170.5 | 0 | 0 | 0 | 111.3 | Q90 Q91 R96 K97 A98 | Q90-L94 HydrophobicContact CG-CD1 4.5Å; Q90-L94 WeakPolarHBondContact O-CB 3.22Å; Q90-L94 VanDerWaalsContact O-CG 3.24Å; Q90-L94 WeakPolarHBondContact O-CG 3.36Å; Q90-L94 PolarHBondContact O-N 3.3Å; Q91-L94 PolarHBondContact O-N 2.94Å; L94-R96 VanDerWaalsContact C-N 3.32Å; L94-R96 PolarHBondContact O-N 3.38Å; L94-K97 PolarHBondContact O-N 3.05Å; L94-A98 WeakPolarHBondContact O-CB 3.45Å; L94-A98 PolarHBondContact O-N 3.3Å |
| 95 | E | 85.8 | Confident | 82.3 | Confident | 133 Ų | 133 | 112.3 Ų | 112.3 | 62% | 0.621 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -63.1 | -40 | 174.9 | -75.8 | -175.5 | 162.9 | 0 | 0 | 111.6 | Q91 E92 K97 A98 A99 | Q91-E95 WeakPolarHBondContact O-CG 3.49Å; Q91-E95 PolarHBondContact O-N 3.47Å; E92-E95 PolarHBondContact O-N 2.93Å; E95-K97 PolarHBondContact O-N 2.96Å; E95-A98 PolarHBondContact O-N 3.03Å; E95-A99 WeakPolarHBondContact O-CB 3.4Å; E95-A99 PolarHBondContact O-N 3.06Å |
| 96 | R | 87.9 | Confident | 82 | Confident | 204 Ų | 204 | 115.7 Ų | 115.7 | 77% | 0.77 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -63.6 | -40.5 | 174.5 | -173.1 | 178.9 | 172 | -175.3 | -1.4 | 112.4 | E92 E93 L94 E100 | E92-R96 WeakPolarHBondContact O-CB 3.37Å; E92-R96 PolarHBondContact O-N 3.11Å; E93-R96 PolarHBondContact O-N 3.41Å; L94-R96 VanDerWaalsContact C-N 3.32Å; L94-R96 PolarHBondContact O-N 3.38Å; R96-E100 PolarHBondContact O-N 3.47Å; R96-E100 VanDerWaalsContact O-N 3.08Å |
| 97 | K | 85.8 | Confident | 81.7 | Confident | 140 Ų | 140 | 116.1 Ų | 116.1 | 61% | 0.609 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -68.8 | -38.5 | 175 | -78.7 | 179.5 | -178.7 | 169.3 | 0 | 111.8 | E93 L94 E95 E100 L101 | E93-K97 WeakPolarHBondContact O-CG 3.36Å; E93-K97 PolarHBondContact O-N 3.13Å; L94-K97 PolarHBondContact O-N 3.05Å; E95-K97 PolarHBondContact O-N 2.96Å; K97-E100 PolarHBondContact O-N 2.91Å; K97-L101 VanDerWaalsContact O-CB 3.25Å; K97-L101 WeakPolarHBondContact O-CB 3.48Å; K97-L101 PolarHBondContact O-N 3.41Å |
| 98 | A | 80.2 | Confident | 80.9 | Confident | 58 Ų | 58 | 116.3 Ų | 116.3 | 48% | 0.479 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -63.6 | -43.3 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.1 | L94 E95 L101 D102 | L94-A98 WeakPolarHBondContact O-CB 3.45Å; L94-A98 PolarHBondContact O-N 3.3Å; E95-A98 PolarHBondContact O-N 3.03Å; A98-L101 PolarHBondContact O-N 2.97Å; A98-D102 WeakPolarHBondContact O-CB 3.39Å; A98-D102 PolarHBondContact O-N 3.49Å |
| 99 | A | 84 | Confident | 80 | Confident | 64 Ų | 64 | 118.1 Ų | 118.1 | 53% | 0.529 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -65.6 | -38.5 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.9 | E95 R103 | E95-A99 WeakPolarHBondContact O-CB 3.4Å; E95-A99 PolarHBondContact O-N 3.06Å; A99-R103 WeakPolarHBondContact O-CB 3.45Å; A99-R103 PolarHBondContact O-N 3.02Å |
| 100 | E | 84.6 | Confident | 78.8 | Confident | 72 Ų | 72 | 116.5 Ų | 116.5 | 34% | 0.336 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -68.8 | -36.2 | 174.2 | -176.9 | 62.7 | -156.2 | 0 | 0 | 111.7 | R96 K97 R103 R104 | R96-E100 PolarHBondContact O-N 3.47Å; R96-E100 VanDerWaalsContact O-N 3.08Å; K97-E100 PolarHBondContact O-N 2.91Å; E100-R103 PolarHBondContact O-N 3.46Å; E100-R103 IonicContact OE1-CZ 3.95Å; E100-R103 IonicContact OE1-NE 3.8Å; E100-R103 IonicContact OE1-NH2 3.72Å; E100-R103 PolarHBondContact OE1-NH2 3.42Å; E100-R103 IonicContact OE2-CZ 3.41Å; E100-R103 IonicContact OE2-NE 2.77Å; E100-R103 PolarHBondContact OE2-NE 3.2Å; E100-R103 IonicContact OE2-NH2 2.85Å; E100-R103 PolarHBondContact OE2-NH2 3.11Å; E100-R104 WeakPolarHBondContact O-CB 3.45Å; E100-R104 WeakPolarHBondContact O-CG 3.33Å; E100-R104 PolarHBondContact O-N 3.33Å; E100-R104 IonicContact OE1-NE 3.75Å |
| 101 | L | 76.4 | Confident | 77.4 | Confident | 105 Ų | 105 | 121 Ų | 121 | 55% | 0.55 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -70.6 | -40.8 | 178.1 | -153 | 148.4 | 0 | 0 | 0 | 110.8 | K97 A98 R104 E105 | K97-L101 VanDerWaalsContact O-CB 3.25Å; K97-L101 WeakPolarHBondContact O-CB 3.48Å; K97-L101 PolarHBondContact O-N 3.41Å; A98-L101 PolarHBondContact O-N 2.97Å; L101-R104 CarbonylContact O-C 3.5Å; L101-R104 PolarHBondContact O-N 2.92Å; L101-E105 HydrophobicContact CD2-CG 4.17Å; L101-E105 WeakPolarHBondContact O-CB 3.36Å; L101-E105 PolarHBondContact O-N 2.89Å |
| 102 | D | 84.5 | Confident | 75.5 | Confident | 86 Ų | 86 | 117.8 Ų | 117.8 | 46% | 0.46 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -67.8 | -35.6 | 174.2 | -163.3 | 44.9 | 0 | 0 | 0 | 111.5 | A98 E105 Q106 | A98-D102 WeakPolarHBondContact O-CB 3.39Å; A98-D102 PolarHBondContact O-N 3.49Å; D102-E105 PolarHBondContact O-N 2.85Å; D102-Q106 WeakPolarHBondContact O-CB 3.37Å; D102-Q106 WeakPolarHBondContact O-CG 3.48Å; D102-Q106 PolarHBondContact O-N 3.22Å |
| 103 | R | 83.4 | Confident | 73.8 | Confident | 127 Ų | 127 | 115.8 Ų | 115.8 | 48% | 0.479 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -64 | -43.9 | 169.8 | -169.8 | -178.2 | 73.6 | 150.2 | 1.3 | 111.4 | A99 E100 Q106 E107 | A99-R103 WeakPolarHBondContact O-CB 3.45Å; A99-R103 PolarHBondContact O-N 3.02Å; E100-R103 PolarHBondContact O-N 3.46Å; E100-R103 IonicContact OE1-CZ 3.95Å; E100-R103 IonicContact OE1-NE 3.8Å; E100-R103 IonicContact OE1-NH2 3.72Å; E100-R103 PolarHBondContact OE1-NH2 3.42Å; E100-R103 IonicContact OE2-CZ 3.41Å; E100-R103 IonicContact OE2-NE 2.77Å; E100-R103 PolarHBondContact OE2-NE 3.2Å; E100-R103 IonicContact OE2-NH2 2.85Å; E100-R103 PolarHBondContact OE2-NH2 3.11Å; R103-Q106 PolarHBondContact O-N 3.18Å; R103-E107 IonicContact CZ-OE1 3.44Å; R103-E107 IonicContact NE-OE1 2.78Å; R103-E107 WeakPolarHBondContact O-CB 3.49Å; R103-E107 VanDerWaalsContact O-CG 3.24Å; R103-E107 WeakPolarHBondContact O-CG 3.03Å; R103-E107 PolarHBondContact O-N 3.49Å |
| 104 | R | 75.9 | Confident | 72 | Confident | 151 Ų | 151 | 116.1 Ų | 116.1 | 57% | 0.57 | 57% | 0.572 | S | S | * | * | H | α-helix | trans | -66.7 | -36.2 | 175 | -78.3 | -173.9 | -177.1 | -178.4 | -0.3 | 112.3 | E100 L101 E107 L108 | E100-R104 WeakPolarHBondContact O-CB 3.45Å; E100-R104 WeakPolarHBondContact O-CG 3.33Å; E100-R104 PolarHBondContact O-N 3.33Å; E100-R104 IonicContact OE1-NE 3.75Å; L101-R104 CarbonylContact O-C 3.5Å; L101-R104 PolarHBondContact O-N 2.92Å; R104-E107 PolarHBondContact O-N 3.31Å; R104-L108 VanDerWaalsContact O-CB 3.29Å; R104-L108 WeakPolarHBondContact O-CB 3.4Å; R104-L108 WeakPolarHBondContact O-CG 3.48Å; R104-L108 PolarHBondContact O-N 2.91Å |
| 105 | E | 76 | Confident | 70.6 | Confident | 109 Ų | 109 | 114.4 Ų | 114.4 | 51% | 0.509 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -67.2 | -44.2 | 173.8 | -83.3 | -170.3 | 152.1 | 0 | 0 | 110.4 | L101 D102 E107 L108 Q109 | L101-E105 HydrophobicContact CD2-CG 4.17Å; L101-E105 WeakPolarHBondContact O-CB 3.36Å; L101-E105 PolarHBondContact O-N 2.89Å; D102-E105 PolarHBondContact O-N 2.85Å; E105-E107 PolarHBondContact O-N 3.28Å; E105-L108 CarbonylContact O-C 3.58Å; E105-L108 PolarHBondContact O-N 3.33Å; E105-Q109 WeakPolarHBondContact O-CA 3.35Å; E105-Q109 WeakPolarHBondContact O-CB 3.36Å; E105-Q109 PolarHBondContact O-N 3.11Å |
| 106 | Q | 74.7 | Confident | 69 | Low | 114 Ų | 114 | 111.4 Ų | 111.4 | 53% | 0.533 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -63.9 | -37.9 | 172.4 | -80.2 | -177.1 | 2.2 | 0 | 0 | 112.4 | D102 R103 Q109 N110 | D102-Q106 WeakPolarHBondContact O-CB 3.37Å; D102-Q106 WeakPolarHBondContact O-CG 3.48Å; D102-Q106 PolarHBondContact O-N 3.22Å; R103-Q106 PolarHBondContact O-N 3.18Å; Q106-Q109 PolarHBondContact O-N 2.82Å; Q106-N110 WeakPolarHBondContact O-CB 3.43Å; Q106-N110 PolarHBondContact O-N 2.82Å |
| 107 | E | 74.4 | Confident | 67.4 | Low | 101 Ų | 101 | 110.2 Ų | 110.2 | 47% | 0.472 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -64.5 | -42.3 | 172.5 | -77.5 | 174 | -172.1 | 0 | 0 | 110.7 | R103 R104 E105 R111 | R103-E107 IonicContact CZ-OE1 3.44Å; R103-E107 IonicContact NE-OE1 2.78Å; R103-E107 WeakPolarHBondContact O-CB 3.49Å; R103-E107 VanDerWaalsContact O-CG 3.24Å; R103-E107 WeakPolarHBondContact O-CG 3.03Å; R103-E107 PolarHBondContact O-N 3.49Å; R104-E107 PolarHBondContact O-N 3.31Å; E105-E107 PolarHBondContact O-N 3.28Å; E107-R111 WeakPolarHBondContact O-CA 3.27Å; E107-R111 WeakPolarHBondContact O-CB 3.09Å; E107-R111 PolarHBondContact O-N 3.47Å |
| 108 | L | 60.8 | Low | 65.8 | Low | 114 Ų | 114 | 107.5 Ų | 107.5 | 60% | 0.597 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -71 | -28.5 | 174.8 | -73.4 | 169.6 | 0 | 0 | 0 | 113 | R104 E105 R111 A112 | R104-L108 VanDerWaalsContact O-CB 3.29Å; R104-L108 WeakPolarHBondContact O-CB 3.4Å; R104-L108 WeakPolarHBondContact O-CG 3.48Å; R104-L108 PolarHBondContact O-N 2.91Å; E105-L108 CarbonylContact O-C 3.58Å; E105-L108 PolarHBondContact O-N 3.33Å; L108-R111 CarbonylContact O-C 3.54Å; L108-A112 WeakPolarHBondContact O-CB 3.37Å; L108-A112 PolarHBondContact O-N 3.49Å |
| 109 | Q | 63.6 | Low | 64.9 | Low | 145 Ų | 145 | 109.4 Ų | 109.4 | 68% | 0.678 | 56% | 0.563 | S | S | * | * | H | α-helix | trans | -81.3 | -38.7 | 178.7 | -165.8 | 88.4 | 31.9 | 0 | 0 | 111 | E105 Q106 R111 A112 | E105-Q109 WeakPolarHBondContact O-CA 3.35Å; E105-Q109 WeakPolarHBondContact O-CB 3.36Å; E105-Q109 PolarHBondContact O-N 3.11Å; Q106-Q109 PolarHBondContact O-N 2.82Å; Q109-R111 VanDerWaalsContact C-N 3.3Å; Q109-A112 WeakPolarHBondContact O-CB 3.34Å; Q109-A112 PolarHBondContact O-N 2.93Å |
| 110 | N | 58.4 | Low | 63.6 | Low | 126 Ų | 126 | 108.8 Ų | 108.8 | 67% | 0.674 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -72.9 | -25.9 | 169.7 | -79.8 | -16.9 | 0 | 0 | 0 | 111.7 | Q106 T114 | Q106-N110 WeakPolarHBondContact O-CB 3.43Å; Q106-N110 PolarHBondContact O-N 2.82Å; N110-T114 PolarHBondContact O-OG1 3.45Å |
| 111 | R | 54.2 | Low | 61.9 | Low | 210 Ų | 210 | 107 Ų | 107 | 79% | 0.792 | 54% | 0.542 | S | S | * | . | S | Bend | trans | -91.5 | -1.7 | 171.5 | -154.2 | 156.9 | 93.2 | 133.2 | 4.6 | 113 | E107 L108 Q109 | E107-R111 WeakPolarHBondContact O-CA 3.27Å; E107-R111 WeakPolarHBondContact O-CB 3.09Å; E107-R111 PolarHBondContact O-N 3.47Å; L108-R111 CarbonylContact O-C 3.54Å; Q109-R111 VanDerWaalsContact C-N 3.3Å |
| 112 | A | 43 | Very low | 60.8 | Low | 48 Ų | 48 | 106.1 Ų | 106.1 | 40% | 0.397 | 54% | 0.543 | S | S | . | . | S | Bend | trans | -74.9 | 134.3 | 157.4 | 0 | 0 | 0 | 0 | 0 | 107 | L108 Q109 T114 | L108-A112 WeakPolarHBondContact O-CB 3.37Å; L108-A112 PolarHBondContact O-N 3.49Å; Q109-A112 WeakPolarHBondContact O-CB 3.34Å; Q109-A112 PolarHBondContact O-N 2.93Å; A112-T114 PolarHBondContact O-N 2.81Å |
| 113 | P | 51.5 | Low | 59.1 | Low | 95 Ų | 95 | 105.1 Ų | 105.1 | 62% | 0.617 | 54% | 0.537 | S | S | * | . | -73.8 | 104.1 | -128.3 | 28.6 | -34.8 | 0 | 0 | 0 | 111.8 | G115 K116 | P113-G115 PolarHBondContact O-N 3.25Å; P113-K116 HydrophobicContact CB-CD 4.46Å | |||
| 114 | T | 48.5 | Very low | 57.6 | Low | 128 Ų | 128 | 103.6 Ų | 103.6 | 79% | 0.785 | 54% | 0.544 | S | S | * | . | S | Bend | trans | -64.1 | 98.5 | 152.1 | 21.7 | 0 | 0 | 0 | 0 | 108.1 | N110 A112 | N110-T114 PolarHBondContact O-OG1 3.45Å; A112-T114 PolarHBondContact O-N 2.81Å |
| 115 | G | 49.4 | Very low | 56.7 | Low | 72 Ų | 72 | 107 Ų | 107 | 74% | 0.742 | 56% | 0.562 | S | S | * | * | trans | 66 | 62 | 155.9 | 0 | 0 | 0 | 0 | 0 | 117.3 | P113 E117 | P113-G115 PolarHBondContact O-N 3.25Å; G115-E117 PolarHBondContact O-N 3.27Å | ||
| 116 | K | 51.6 | Low | 55.6 | Low | 71 Ų | 71 | 111.6 Ų | 111.6 | 31% | 0.309 | 58% | 0.581 | S | S | . | * | trans | -69.7 | 110.1 | 157.9 | -88.3 | 168.3 | 156.8 | 179.6 | 0 | 108.6 | P113 N118 Y134 E139 | P113-K116 HydrophobicContact CB-CD 4.46Å; K116-N118 PolarHBondContact O-N 2.97Å; K116-Y134 HydrophobicContact CB-CD1 3.8Å; K116-Y134 HydrophobicContact CB-CD2 3.75Å; K116-Y134 HydrophobicContact CB-CE1 4.13Å; K116-Y134 HydrophobicContact CB-CE2 4.05Å; K116-Y134 HydrophobicContact CB-CG 3.57Å; K116-Y134 HydrophobicContact CD-CD1 3.7Å; K116-Y134 HydrophobicContact CD-CE1 3.35Å; K116-Y134 HydrophobicContact CD-CE2 4.42Å; K116-Y134 HydrophobicContact CD-CG 4.36Å; K116-Y134 WeakPolarHBondContact CE-OH 3.34Å; K116-Y134 HydrophobicContact CG-CD1 4.11Å; K116-Y134 HydrophobicContact CG-CD2 4.3Å; K116-Y134 HydrophobicContact CG-CE1 3.92Å; K116-Y134 HydrophobicContact CG-CE2 4.09Å; K116-Y134 HydrophobicContact CG-CG 4.27Å; K116-E139 VanDerWaalsContact CE-OE2 3.31Å; K116-E139 WeakPolarHBondContact CE-OE2 3.25Å; K116-E139 IonicContact NZ-OE1 3.21Å; K116-E139 PolarHBondContact NZ-OE1 3.48Å; K116-E139 IonicContact NZ-OE2 3.09Å; K116-E139 PolarHBondContact NZ-OE2 3.06Å | ||
| 117 | E | 53.4 | Low | 54.1 | Low | 179 Ų | 179 | 112.2 Ų | 112.2 | 84% | 0.836 | 58% | 0.582 | S | S | * | * | trans | -57.1 | 127.8 | -176.2 | -133.9 | -176.3 | 161.8 | 0 | 0 | 110.7 | G115 N119 Y134 | G115-E117 PolarHBondContact O-N 3.27Å; E117-N119 PolarHBondContact O-N 3.46Å; E117-Y134 VanDerWaalsContact O-CD2 3.27Å; E117-Y134 WeakPolarHBondContact O-CD2 3.48Å | ||
| 118 | N | 52.9 | Low | 53 | Low | 82 Ų | 82 | 113.3 Ų | 113.3 | 44% | 0.439 | 60% | 0.598 | S | S | . | * | trans | -61.1 | 123.3 | -178.6 | -68.7 | -31 | 0 | 0 | 0 | 110.5 | K116 P131 C132 F133 Y134 | K116-N118 PolarHBondContact O-N 2.97Å; N118-P131 HydrophobicContact CB-CB 3.78Å; N118-P131 WeakPolarHBondContact CB-O 3.25Å; N118-P131 PolarHBondContact ND2-O 2.98Å; N118-P131 WeakPolarHBondContact O-CB 3.37Å; N118-C132 VanDerWaalsContact CG-C 3.5Å; N118-F133 CarbonylContact C-O 3.56Å; N118-F133 WeakPolarHBondContact OD1-CA 3.33Å; N118-Y134 PolarHBondContact OD1-N 2.62Å | ||
| 119 | N | 62.5 | Low | 52.3 | Low | 99 Ų | 99 | 111.9 Ų | 111.9 | 53% | 0.529 | 59% | 0.59 | S | S | . | * | trans | -110.2 | -3 | -176.5 | -174.4 | 39.4 | 0 | 0 | 0 | 112.7 | E117 F133 | E117-N119 PolarHBondContact O-N 3.46Å; N119-F133 PolarHBondContact N-O 2.9Å | ||
| 120 | W | 56.4 | Low | 51.5 | Low | 51 Ų | 51 | 112.6 Ų | 112.6 | 19% | 0.193 | 59% | 0.594 | C | S | . | * | B | Isolated β-bridge | trans | -132.8 | 134.4 | -168.9 | -163.2 | -95.3 | 0 | 0 | 0 | 113.6 | P122 P131 C132 F133 Q135 Y153 | W120-P122 HydrophobicContact CE3-CG 4.18Å; W120-P122 VanDerWaalsContact CH2-CD 3.49Å; W120-P122 HydrophobicContact CH2-CG 4.04Å; W120-P122 HydrophobicContact CZ3-CG 3.66Å; W120-P131 CarbonylContact O-C 3.49Å; W120-P131 WeakPolarHBondContact O-CA 3.48Å; W120-C132 PolarHBondContact O-N 3.19Å; W120-F133 WeakPolarHBondContact CA-O 3.33Å; W120-F133 HydrophobicContact CB-CB 4.42Å; W120-F133 VanDerWaalsContact CB-O 3.32Å; W120-F133 WeakPolarHBondContact CB-O 3.34Å; W120-F133 PolarHBondContact N-O 2.79Å; W120-F133 PolarHBondContact O-N 3.45Å; W120-Q135 HydrophobicContact CB-CB 4.03Å; W120-Q135 HydrophobicContact CG-CB 4.33Å; W120-Y153 AromaticContact CE2-CE2 3.85Å; W120-Y153 HydrophobicContact CH2-CE1 4.32Å; W120-Y153 HydrophobicContact CH2-CE2 4.15Å; W120-Y153 AromaticContact CH2-CZ 3.52Å; W120-Y153 WeakPolarHBondContact CH2-OH 3.21Å; W120-Y153 AromaticContact CZ2-CE2 3.57Å; W120-Y153 HydrophobicContact CZ2-CE2 3.57Å; W120-Y153 AromaticContact CZ2-CZ 3.36Å; W120-Y153 WeakPolarHBondContact CZ2-OH 3.31Å |
| 121 | P | 48.7 | Very low | 51.3 | Low | 35 Ų | 35 | 109.4 Ų | 109.4 | 23% | 0.227 | 58% | 0.58 | C | S | . | * | S | Bend | cis | -74.5 | 146 | -8 | 30.7 | -34.5 | 0 | 0 | 0 | 112.3 | L123 I129 | P121-L123 HydrophobicContact CB-CD1 4.31Å; P121-L123 HydrophobicContact CB-CG 3.96Å; P121-L123 HydrophobicContact CG-CD1 3.56Å; P121-L123 HydrophobicContact CG-CG 3.75Å; P121-L123 PolarHBondContact O-N 3.15Å; P121-I129 HydrophobicContact CG-CG2 4.45Å |
| 122 | P | 52.1 | Low | 51.3 | Low | 86 Ų | 86 | 103.7 Ų | 103.7 | 56% | 0.558 | 57% | 0.571 | S | S | * | * | trans | -74.9 | 69.7 | 173.4 | 32.7 | -36.1 | 0 | 0 | 0 | 108.6 | W120 | W120-P122 HydrophobicContact CE3-CG 4.18Å; W120-P122 VanDerWaalsContact CH2-CD 3.49Å; W120-P122 HydrophobicContact CH2-CG 4.04Å; W120-P122 HydrophobicContact CZ3-CG 3.66Å | ||
| 123 | L | 49.3 | Very low | 51.7 | Low | 64 Ų | 64 | 104 Ų | 104 | 34% | 0.335 | 56% | 0.563 | S | S | . | * | trans | -80.7 | 142.3 | 173.9 | -67 | 170.4 | 0 | 0 | 0 | 108.5 | P121 K125 F127 I129 | P121-L123 HydrophobicContact CB-CD1 4.31Å; P121-L123 HydrophobicContact CB-CG 3.96Å; P121-L123 HydrophobicContact CG-CD1 3.56Å; P121-L123 HydrophobicContact CG-CG 3.75Å; P121-L123 PolarHBondContact O-N 3.15Å; L123-K125 PolarHBondContact O-N 3.5Å; L123-F127 HydrophobicContact CB-CB 4.02Å; L123-F127 HydrophobicContact CD1-CB 4.17Å; L123-F127 HydrophobicContact CD1-CD1 4.13Å; L123-F127 HydrophobicContact CD1-CG 4.39Å; L123-I129 HydrophobicContact CD1-CB 3.68Å; L123-I129 HydrophobicContact CD1-CD1 4.3Å; L123-I129 HydrophobicContact CD1-CG1 4.49Å; L123-I129 HydrophobicContact CD1-CG2 4.04Å | ||
| 124 | P | 52.8 | Low | 51.7 | Low | 96 Ų | 96 | 101.6 Ų | 101.6 | 62% | 0.623 | 54% | 0.542 | S | S | * | . | trans | -50.6 | 143.2 | 166.5 | -22.4 | 32 | 0 | 0 | 0 | 109.6 | F126 F127 | P124-F126 PolarHBondContact O-N 2.62Å; P124-F127 PolarHBondContact O-N 2.79Å | ||
| 125 | K | 55.8 | Low | 51.9 | Low | 222 Ų | 222 | 96.2 Ų | 96.2 | 97% | 0.965 | 51% | 0.508 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -56.5 | -2.8 | -177.3 | -61.3 | -175.6 | -179.7 | -176.3 | 0 | 115.3 | L123 | L123-K125 PolarHBondContact O-N 3.5Š|
| 126 | F | 53.9 | Low | 52.4 | Low | 206 Ų | 206 | 95.2 Ų | 95.2 | 90% | 0.904 | 49% | 0.486 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -90.6 | -9.4 | 179.1 | -145.9 | -97.8 | 0 | 0 | 0 | 113.6 | P124 | P124-F126 PolarHBondContact O-N 2.62Š|
| 127 | F | 42.9 | Very low | 52.7 | Low | 126 Ų | 126 | 93.3 Ų | 93.3 | 55% | 0.553 | 48% | 0.478 | S | S | * | . | S | Bend | trans | -91.4 | 135.5 | 176.1 | -123.9 | -99.1 | 0 | 0 | 0 | 110.5 | L123 P124 I129 | L123-F127 HydrophobicContact CB-CB 4.02Å; L123-F127 HydrophobicContact CD1-CB 4.17Å; L123-F127 HydrophobicContact CD1-CD1 4.13Å; L123-F127 HydrophobicContact CD1-CG 4.39Å; P124-F127 PolarHBondContact O-N 2.79Å; F127-I129 HydrophobicContact CD1-CD1 4.07Å; F127-I129 HydrophobicContact CD1-CG1 4.29Å; F127-I129 HydrophobicContact CE1-CD1 4.28Å; F127-I129 PolarHBondContact O-N 3.49Å |
| 128 | P | 50.6 | Low | 52.6 | Low | 124 Ų | 124 | 88.7 Ų | 88.7 | 81% | 0.805 | 47% | 0.465 | S | S | * | . | S | Bend | trans | -71.1 | 4 | -176.1 | 27.2 | -34.2 | 0 | 0 | 0 | 114.8 | ||
| 129 | I | 47.8 | Very low | 52.7 | Low | 85 Ų | 85 | 90.7 Ų | 90.7 | 44% | 0.436 | 47% | 0.472 | S | S | . | . | trans | -98.1 | 102 | 179.3 | -55.9 | 171.9 | 0 | 0 | 0 | 107.1 | P121 L123 F127 | P121-I129 HydrophobicContact CG-CG2 4.45Å; L123-I129 HydrophobicContact CD1-CB 3.68Å; L123-I129 HydrophobicContact CD1-CD1 4.3Å; L123-I129 HydrophobicContact CD1-CG1 4.49Å; L123-I129 HydrophobicContact CD1-CG2 4.04Å; F127-I129 HydrophobicContact CD1-CD1 4.07Å; F127-I129 HydrophobicContact CD1-CG1 4.29Å; F127-I129 HydrophobicContact CE1-CD1 4.28Å; F127-I129 PolarHBondContact O-N 3.49Å | ||
| 130 | Q | 46.4 | Very low | 52.4 | Low | 160 Ų | 160 | 87.4 Ų | 87.4 | 75% | 0.748 | 45% | 0.453 | S | S | * | . | trans | -63 | 151.1 | 172 | -73.5 | -176 | -50.8 | 0 | 0 | 110.3 | C132 | Q130-C132 PolarHBondContact O-N 3.2Å; Q130-C132 PolarHBondContact O-SG 2.88Å | ||
| 131 | P | 53.9 | Low | 52.6 | Low | 58 Ų | 58 | 85.2 Ų | 85.2 | 38% | 0.377 | 45% | 0.445 | S | S | . | . | trans | -54 | 113.3 | 168.7 | -23.5 | 34 | 0 | 0 | 0 | 109.1 | N118 W120 | N118-P131 HydrophobicContact CB-CB 3.78Å; N118-P131 WeakPolarHBondContact CB-O 3.25Å; N118-P131 PolarHBondContact ND2-O 2.98Å; N118-P131 WeakPolarHBondContact O-CB 3.37Å; W120-P131 CarbonylContact O-C 3.49Å; W120-P131 WeakPolarHBondContact O-CA 3.48Å | ||
| 132 | C | 53.3 | Low | 53.2 | Low | 90 Ų | 90 | 87 Ų | 87 | 61% | 0.608 | 46% | 0.456 | S | S | * | . | trans | -95.1 | -10 | -175.8 | -67.4 | 0 | 0 | 0 | 0 | 112.4 | N118 W120 Q130 | N118-C132 VanDerWaalsContact CG-C 3.5Å; W120-C132 PolarHBondContact O-N 3.19Å; Q130-C132 PolarHBondContact O-N 3.2Å; Q130-C132 PolarHBondContact O-SG 2.88Å | ||
| 133 | F | 52.5 | Low | 53.7 | Low | 55 Ų | 55 | 86.8 Ų | 86.8 | 24% | 0.241 | 46% | 0.463 | C | S | . | . | B | Isolated β-bridge | trans | -146.5 | 138 | -170 | -168.1 | -114.1 | 0 | 0 | 0 | 112.8 | N118 N119 W120 Q135 Y207 | N118-F133 CarbonylContact C-O 3.56Å; N118-F133 WeakPolarHBondContact OD1-CA 3.33Å; N119-F133 PolarHBondContact N-O 2.9Å; W120-F133 WeakPolarHBondContact CA-O 3.33Å; W120-F133 HydrophobicContact CB-CB 4.42Å; W120-F133 VanDerWaalsContact CB-O 3.32Å; W120-F133 WeakPolarHBondContact CB-O 3.34Å; W120-F133 PolarHBondContact N-O 2.79Å; W120-F133 PolarHBondContact O-N 3.45Å; F133-Q135 HydrophobicContact CD1-CB 3.87Å; F133-Q135 HydrophobicContact CE1-CB 4.03Å; F133-Q135 HydrophobicContact CE1-CG 4.5Å; F133-Y207 HydrophobicContact CE1-CE1 4.34Å; F133-Y207 HydrophobicContact CZ-CD1 4.43Å; F133-Y207 AromaticContact CZ-CE1 3.91Å; F133-Y207 HydrophobicContact CZ-CE1 3.91Å |
| 134 | Y | 50.8 | Low | 54.5 | Low | 45 Ų | 45 | 90.9 Ų | 90.9 | 18% | 0.176 | 48% | 0.48 | C | S | . | . | trans | -84.5 | 119 | 163.3 | 175.9 | -96.5 | 0 | 0 | 0 | 109.1 | K116 E117 N118 D136 E139 | K116-Y134 HydrophobicContact CB-CD1 3.8Å; K116-Y134 HydrophobicContact CB-CD2 3.75Å; K116-Y134 HydrophobicContact CB-CE1 4.13Å; K116-Y134 HydrophobicContact CB-CE2 4.05Å; K116-Y134 HydrophobicContact CB-CG 3.57Å; K116-Y134 HydrophobicContact CD-CD1 3.7Å; K116-Y134 HydrophobicContact CD-CE1 3.35Å; K116-Y134 HydrophobicContact CD-CE2 4.42Å; K116-Y134 HydrophobicContact CD-CG 4.36Å; K116-Y134 WeakPolarHBondContact CE-OH 3.34Å; K116-Y134 HydrophobicContact CG-CD1 4.11Å; K116-Y134 HydrophobicContact CG-CD2 4.3Å; K116-Y134 HydrophobicContact CG-CE1 3.92Å; K116-Y134 HydrophobicContact CG-CE2 4.09Å; K116-Y134 HydrophobicContact CG-CG 4.27Å; E117-Y134 VanDerWaalsContact O-CD2 3.27Å; E117-Y134 WeakPolarHBondContact O-CD2 3.48Å; N118-Y134 PolarHBondContact OD1-N 2.62Å; Y134-D136 HydrophobicContact CE1-CB 3.72Å; Y134-E139 PolarHBondContact OH-OE2 2.72Å | ||
| 135 | Q | 53.6 | Low | 55.4 | Low | 15 Ų | 15 | 87.6 Ų | 87.6 | 7% | 0.07 | 46% | 0.455 | C | S | . | . | trans | -122.1 | 101.6 | 179.9 | -176.5 | 65.7 | 87.4 | 0 | 0 | 108.9 | W120 F133 F137 Y203 Y207 | W120-Q135 HydrophobicContact CB-CB 4.03Å; W120-Q135 HydrophobicContact CG-CB 4.33Å; F133-Q135 HydrophobicContact CD1-CB 3.87Å; F133-Q135 HydrophobicContact CE1-CB 4.03Å; F133-Q135 HydrophobicContact CE1-CG 4.5Å; Q135-F137 HydrophobicContact CG-CD2 4.37Å; Q135-F137 HydrophobicContact CG-CE2 3.77Å; Q135-F137 HydrophobicContact CG-CZ 3.87Å; Q135-Y203 PolarHBondContact OE1-OH 3.23Å; Q135-Y207 PolarHBondContact NE2-OH 3.49Å | ||
| 136 | D | 58.1 | Low | 56.4 | Low | 51 Ų | 51 | 78.7 Ų | 78.7 | 27% | 0.273 | 42% | 0.417 | S | S | . | . | trans | -123.4 | 107 | 167.2 | -164.5 | -29.7 | 0 | 0 | 0 | 110 | Y134 S138 E139 E140 | Y134-D136 HydrophobicContact CE1-CB 3.72Å; D136-S138 PolarHBondContact O-N 3.25Å; D136-S138 WeakPolarHBondContact OD1-CB 3.47Å; D136-S138 PolarHBondContact OD1-N 2.85Å; D136-S138 PolarHBondContact OD1-OG 3.06Å; D136-E139 HydrophobicContact CB-CB 4.44Å; D136-E140 WeakPolarHBondContact O-CB 3.48Å; D136-E140 PolarHBondContact O-N 3.28Å | ||
| 137 | F | 58.4 | Low | 57.5 | Low | 31 Ų | 31 | 78 Ų | 78 | 14% | 0.136 | 41% | 0.408 | C | S | . | . | H | α-helix | trans | -66 | -23.6 | 179.4 | -64.5 | -79.9 | 0 | 0 | 0 | 112.9 | Q135 Q146 C149 K150 Y153 Y203 | Q135-F137 HydrophobicContact CG-CD2 4.37Å; Q135-F137 HydrophobicContact CG-CE2 3.77Å; Q135-F137 HydrophobicContact CG-CZ 3.87Å; F137-Q146 VanDerWaalsContact O-CD 3.3Å; F137-Q146 VanDerWaalsContact O-CG 3.31Å; F137-Q146 WeakPolarHBondContact O-CG 3.13Å; F137-Q146 PolarHBondContact O-NE2 3.02Å; F137-C149 HydrophobicContact CD1-CB 4.15Å; F137-C149 HydrophobicContact CE1-CB 4.25Å; F137-K150 HydrophobicContact CB-CG 4.34Å; F137-K150 HydrophobicContact CD1-CG 4.14Å; F137-K150 HydrophobicContact CD2-CG 4.21Å; F137-K150 HydrophobicContact CG-CG 3.97Å; F137-Y153 HydrophobicContact CZ-CD1 4.37Å; F137-Y153 AromaticContact CZ-CG 3.98Å; F137-Y153 HydrophobicContact CZ-CG 3.98Å; F137-Y203 WeakPolarHBondContact CZ-OH 3.29Å |
| 138 | S | 52.7 | Low | 59.5 | Low | 81 Ų | 81 | 72.2 Ų | 72.2 | 57% | 0.566 | 38% | 0.384 | S | S | * | . | H | α-helix | trans | -83.9 | -31.5 | -171.9 | -42.7 | 0 | 0 | 0 | 0 | 112 | D136 Q146 | D136-S138 PolarHBondContact O-N 3.25Å; D136-S138 WeakPolarHBondContact OD1-CB 3.47Å; D136-S138 PolarHBondContact OD1-N 2.85Å; D136-S138 PolarHBondContact OD1-OG 3.06Å; S138-Q146 PolarHBondContact O-NE2 3.4Å |
| 139 | E | 54.4 | Low | 61 | Low | 125 Ų | 125 | 66.4 Ų | 66.4 | 58% | 0.584 | 35% | 0.346 | S | S | * | . | H | α-helix | trans | -98.1 | -28.8 | -176.6 | -148.3 | -169.9 | 150.7 | 0 | 0 | 112.8 | K116 Y134 D136 | K116-E139 VanDerWaalsContact CE-OE2 3.31Å; K116-E139 WeakPolarHBondContact CE-OE2 3.25Å; K116-E139 IonicContact NZ-OE1 3.21Å; K116-E139 PolarHBondContact NZ-OE1 3.48Å; K116-E139 IonicContact NZ-OE2 3.09Å; K116-E139 PolarHBondContact NZ-OE2 3.06Å; Y134-E139 PolarHBondContact OH-OE2 2.72Å; D136-E139 HydrophobicContact CB-CB 4.44Å |
| 140 | E | 54.9 | Low | 62.7 | Low | 29 Ų | 29 | 65.9 Ų | 65.9 | 14% | 0.136 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -99.9 | -14.4 | -173.8 | -58.7 | -154.9 | 138.8 | 0 | 0 | 115.3 | D136 Y207 R211 | D136-E140 WeakPolarHBondContact O-CB 3.48Å; D136-E140 PolarHBondContact O-N 3.28Å; E140-Y207 WeakPolarHBondContact CB-OH 3.35Å; E140-Y207 PolarHBondContact OE2-OH 2.77Å; E140-R211 IonicContact OE1-CZ 2.83Å; E140-R211 IonicContact OE1-NH1 3.54Å; E140-R211 PolarHBondContact OE1-NH1 2.9Å; E140-R211 IonicContact OE1-NH2 2.87Å; E140-R211 PolarHBondContact OE1-NH2 3.21Å; E140-R211 IonicContact OE2-CZ 3.66Å; E140-R211 IonicContact OE2-NH1 3.68Å; E140-R211 PolarHBondContact OE2-NH1 3.33Å |
| 141 | I | 60.8 | Low | 64.6 | Low | 6 Ų | 6 | 61.6 Ų | 61.6 | 3% | 0.031 | 32% | 0.321 | C | S | . | . | S | Bend | trans | -123.9 | 132.1 | -176.9 | -58.2 | -158.1 | 0 | 0 | 0 | 110.2 | A143 Q146 C149 Y207 F210 | I141-A143 PolarHBondContact O-N 3.23Å; I141-Q146 HydrophobicContact CB-CG 4.03Å; I141-Q146 HydrophobicContact CG2-CG 3.98Å; I141-Q146 WeakPolarHBondContact O-CG 3.42Å; I141-Q146 PolarHBondContact O-NE2 3.21Å; I141-C149 HydrophobicContact CD1-CB 3.8Å; I141-C149 WeakPolarHBondContact CD1-SG 3.3Å; I141-Y207 HydrophobicContact CD1-CD2 3.82Å; I141-Y207 HydrophobicContact CD1-CE2 3.56Å; I141-Y207 HydrophobicContact CG1-CE2 4.09Å; I141-F210 HydrophobicContact CD1-CB 4.26Å; I141-F210 HydrophobicContact CG2-CB 4.38Å |
| 142 | P | 62.1 | Low | 66.3 | Low | 71 Ų | 71 | 58.9 Ų | 58.9 | 46% | 0.461 | 30% | 0.303 | S | S | . | . | trans | -54.7 | 139 | 173.9 | -23.2 | 32.1 | 0 | 0 | 0 | 111.5 | E144 Y145 Q146 | P142-E144 PolarHBondContact O-N 3.06Å; P142-Y145 HydrophobicContact CB-CD2 4.09Å; P142-Y145 HydrophobicContact CG-CD2 4.16Å; P142-Y145 PolarHBondContact O-N 3.25Å; P142-Q146 WeakPolarHBondContact O-CG 3.09Å; P142-Q146 PolarHBondContact O-N 2.84Å | ||
| 143 | A | 63 | Low | 67.9 | Low | 83 Ų | 83 | 55.1 Ų | 55.1 | 69% | 0.686 | 28% | 0.277 | S | S | * | . | H | α-helix | trans | -50 | -30.3 | -173.1 | 0 | 0 | 0 | 0 | 0 | 114.3 | I141 | I141-A143 PolarHBondContact O-N 3.23Å |
| 144 | E | 65.1 | Low | 69.6 | Low | 150 Ų | 150 | 59.3 Ų | 59.3 | 70% | 0.701 | 29% | 0.292 | S | S | * | . | H | α-helix | trans | -64.3 | -36.5 | 177.6 | -167.9 | 169.5 | -175.5 | 0 | 0 | 113.7 | P142 | P142-E144 PolarHBondContact O-N 3.06Å |
| 145 | Y | 72.2 | Confident | 71.6 | Confident | 26 Ų | 26 | 57.4 Ų | 57.4 | 10% | 0.102 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -96.8 | -14.7 | -176.4 | -57.5 | -63 | 0 | 0 | 0 | 113.7 | P142 R147 V148 C149 F210 M289 T293 | P142-Y145 HydrophobicContact CB-CD2 4.09Å; P142-Y145 HydrophobicContact CG-CD2 4.16Å; P142-Y145 PolarHBondContact O-N 3.25Å; Y145-R147 VanDerWaalsContact C-N 3.29Å; Y145-R147 PolarHBondContact O-N 2.99Å; Y145-V148 PolarHBondContact O-N 2.83Å; Y145-C149 PolarHBondContact O-N 3.29Å; Y145-C149 VanDerWaalsContact O-N 3.07Å; Y145-C149 PolarHBondContact O-SG 2.91Å; Y145-F210 AromaticContact CD1-CD1 3.61Å; Y145-F210 HydrophobicContact CD1-CD1 3.61Å; Y145-F210 AromaticContact CD1-CE1 3.61Å; Y145-F210 HydrophobicContact CD1-CE1 3.61Å; Y145-F210 HydrophobicContact CD2-CD1 4.35Å; Y145-F210 HydrophobicContact CE1-CD1 4.37Å; Y145-F210 HydrophobicContact CE1-CE1 4.31Å; Y145-F210 AromaticContact CG-CD1 3.6Å; Y145-F210 HydrophobicContact CG-CD1 3.6Å; Y145-F210 HydrophobicContact CG-CE1 4.08Å; Y145-F210 HydrophobicContact CG-CG 4.47Å; Y145-M289 HydrophobicContact CD1-CE 4.25Å; Y145-M289 HydrophobicContact CD1-SD 3.81Å; Y145-M289 HydrophobicContact CE1-CB 4.31Å; Y145-M289 HydrophobicContact CE1-SD 4.25Å; Y145-T293 WeakPolarHBondContact OH-CG2 3.22Å; Y145-T293 PolarHBondContact OH-OG1 3.47Å |
| 146 | Q | 76.6 | Confident | 73.5 | Confident | 35 Ų | 35 | 58.3 Ų | 58.3 | 16% | 0.164 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -55.7 | -40.1 | -176 | -70.2 | -177.8 | 4.8 | 0 | 0 | 113.5 | F137 S138 I141 P142 V148 C149 K150 | F137-Q146 VanDerWaalsContact O-CD 3.3Å; F137-Q146 VanDerWaalsContact O-CG 3.31Å; F137-Q146 WeakPolarHBondContact O-CG 3.13Å; F137-Q146 PolarHBondContact O-NE2 3.02Å; S138-Q146 PolarHBondContact O-NE2 3.4Å; I141-Q146 HydrophobicContact CB-CG 4.03Å; I141-Q146 HydrophobicContact CG2-CG 3.98Å; I141-Q146 WeakPolarHBondContact O-CG 3.42Å; I141-Q146 PolarHBondContact O-NE2 3.21Å; P142-Q146 WeakPolarHBondContact O-CG 3.09Å; P142-Q146 PolarHBondContact O-N 2.84Å; Q146-V148 PolarHBondContact O-N 3.27Å; Q146-C149 PolarHBondContact O-N 3.4Å; Q146-K150 WeakPolarHBondContact O-CB 3.48Å; Q146-K150 VanDerWaalsContact O-CG 3.28Å; Q146-K150 WeakPolarHBondContact O-CG 3.4Å; Q146-K150 PolarHBondContact O-N 2.89Å |
| 147 | R | 77.8 | Confident | 75 | Confident | 192 Ų | 192 | 59.4 Ų | 59.4 | 73% | 0.725 | 29% | 0.292 | S | S | * | . | H | α-helix | trans | -62.1 | -46.1 | -178.1 | -168.8 | 179.3 | -158.2 | 158.9 | 6.1 | 111.3 | Y145 K150 M151 | Y145-R147 VanDerWaalsContact C-N 3.29Å; Y145-R147 PolarHBondContact O-N 2.99Å; R147-K150 PolarHBondContact O-N 2.81Å; R147-M151 HydrophobicContact CG-SD 4.4Å; R147-M151 VanDerWaalsContact O-CG 3.29Å; R147-M151 WeakPolarHBondContact O-CG 3.02Å; R147-M151 PolarHBondContact O-N 3.3Å |
| 148 | V | 83.4 | Confident | 76.7 | Confident | 5 Ų | 5 | 60.5 Ų | 60.5 | 3% | 0.03 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -72.1 | -39.1 | -178.3 | 179.8 | 0 | 0 | 0 | 0 | 110.8 | Y145 Q146 K150 M151 M152 F210 L282 M285 V286 M289 | Y145-V148 PolarHBondContact O-N 2.83Å; Q146-V148 PolarHBondContact O-N 3.27Å; V148-K150 VanDerWaalsContact C-N 3.35Å; V148-K150 PolarHBondContact O-N 2.89Å; V148-M151 PolarHBondContact O-N 2.92Å; V148-M152 WeakPolarHBondContact O-CB 3.13Å; V148-M152 PolarHBondContact O-N 2.98Å; V148-F210 HydrophobicContact CG1-CZ 4.3Å; V148-L282 HydrophobicContact CG1-CD2 4.18Å; V148-M285 HydrophobicContact CG2-CE 3.96Å; V148-V286 HydrophobicContact CG1-CG2 3.56Å; V148-M289 HydrophobicContact CB-CE 3.53Å; V148-M289 HydrophobicContact CB-SD 4.25Å; V148-M289 HydrophobicContact CG1-CE 3.56Å; V148-M289 HydrophobicContact CG2-CE 3.47Å; V148-M289 VanDerWaalsContact CG2-CE 3.47Å; V148-M289 HydrophobicContact CG2-SD 3.65Å |
| 149 | C | 83.8 | Confident | 78.7 | Confident | 2 Ų | 2 | 57 Ų | 57 | 1% | 0.014 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -58.6 | -44.4 | 172.6 | -68.3 | 0 | 0 | 0 | 0 | 112.9 | F137 I141 Y145 Q146 M152 Y153 F210 | F137-C149 HydrophobicContact CD1-CB 4.15Å; F137-C149 HydrophobicContact CE1-CB 4.25Å; I141-C149 HydrophobicContact CD1-CB 3.8Å; I141-C149 WeakPolarHBondContact CD1-SG 3.3Å; Y145-C149 PolarHBondContact O-N 3.29Å; Y145-C149 VanDerWaalsContact O-N 3.07Å; Y145-C149 PolarHBondContact O-SG 2.91Å; Q146-C149 PolarHBondContact O-N 3.4Å; C149-M152 WeakPolarHBondContact O-CB 3.37Å; C149-M152 PolarHBondContact O-N 2.99Å; C149-Y153 WeakPolarHBondContact O-CB 3.47Å; C149-Y153 PolarHBondContact O-N 2.61Å; C149-F210 WeakPolarHBondContact SG-CD2 3.4Å; C149-F210 VanDerWaalsContact SG-CG 3.55Å |
| 150 | K | 83.5 | Confident | 80.5 | Confident | 74 Ų | 74 | 52 Ų | 52 | 32% | 0.322 | 25% | 0.25 | S | C | . | . | H | α-helix | trans | -62.7 | -46.5 | 176 | -73.1 | 174 | -171.1 | 176.1 | 0 | 111.1 | F137 Q146 R147 V148 M152 Y153 Y154 | F137-K150 HydrophobicContact CB-CG 4.34Å; F137-K150 HydrophobicContact CD1-CG 4.14Å; F137-K150 HydrophobicContact CD2-CG 4.21Å; F137-K150 HydrophobicContact CG-CG 3.97Å; Q146-K150 WeakPolarHBondContact O-CB 3.48Å; Q146-K150 VanDerWaalsContact O-CG 3.28Å; Q146-K150 WeakPolarHBondContact O-CG 3.4Å; Q146-K150 PolarHBondContact O-N 2.89Å; R147-K150 PolarHBondContact O-N 2.81Å; V148-K150 VanDerWaalsContact C-N 3.35Å; V148-K150 PolarHBondContact O-N 2.89Å; K150-M152 VanDerWaalsContact C-N 3.28Å; K150-M152 PolarHBondContact O-N 2.9Å; K150-Y153 WeakPolarHBondContact O-CB 3.48Å; K150-Y153 PolarHBondContact O-N 3.48Å; K150-Y154 HydrophobicContact CB-CE2 4.32Å; K150-Y154 WeakPolarHBondContact O-CD2 3.45Å; K150-Y154 PolarHBondContact O-N 3.08Å |
| 151 | M | 86.4 | Confident | 82.4 | Confident | 70 Ų | 70 | 54.2 Ų | 54.2 | 35% | 0.345 | 27% | 0.265 | S | S | . | . | H | α-helix | trans | -60.9 | -39.2 | 177.1 | -69.5 | 174.2 | 71.7 | 0 | 0 | 112.2 | R147 V148 Y154 L155 L282 M285 | R147-M151 HydrophobicContact CG-SD 4.4Å; R147-M151 VanDerWaalsContact O-CG 3.29Å; R147-M151 WeakPolarHBondContact O-CG 3.02Å; R147-M151 PolarHBondContact O-N 3.3Å; V148-M151 PolarHBondContact O-N 2.92Å; M151-Y154 PolarHBondContact O-N 2.84Å; M151-L155 WeakPolarHBondContact O-CB 3.46Å; M151-L155 PolarHBondContact O-N 2.89Å; M151-L282 HydrophobicContact CB-CD1 4.25Å; M151-L282 HydrophobicContact CB-CD2 3.63Å; M151-L282 HydrophobicContact CE-CD2 3.94Å; M151-L282 HydrophobicContact SD-CD2 4.28Å; M151-M285 HydrophobicContact CE-SD 4.04Å; M151-M285 HydrophobicContact SD-CE 4.17Å; M151-M285 HydrophobicContact SD-SD 4.34Å |
| 152 | M | 88.7 | Confident | 84.1 | Confident | 0 Ų | 0 | 54 Ų | 54 | 0% | 0 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -65.6 | -39.6 | 177.5 | -166.1 | 53.7 | 80 | 0 | 0 | 111.8 | V148 C149 K150 L155 W156 W202 V206 F221 F225 L282 V286 | V148-M152 WeakPolarHBondContact O-CB 3.13Å; V148-M152 PolarHBondContact O-N 2.98Å; C149-M152 WeakPolarHBondContact O-CB 3.37Å; C149-M152 PolarHBondContact O-N 2.99Å; K150-M152 VanDerWaalsContact C-N 3.28Å; K150-M152 PolarHBondContact O-N 2.9Å; M152-L155 WeakPolarHBondContact O-CB 3.46Å; M152-L155 PolarHBondContact O-N 2.86Å; M152-L155 HydrophobicContact SD-CD2 4.28Å; M152-W156 PolarHBondContact O-N 2.85Å; M152-W156 VanDerWaalsContact O-N 3.14Å; M152-W202 HydrophobicContact CG-CE3 4.07Å; M152-W202 HydrophobicContact CG-CZ3 3.5Å; M152-W202 VanDerWaalsContact CG-CZ3 3.5Å; M152-W202 WeakPolarHBondContact O-CH2 3.45Å; M152-W202 HydrophobicContact SD-CE3 3.68Å; M152-W202 HydrophobicContact SD-CH2 3.97Å; M152-W202 HydrophobicContact SD-CZ3 3.18Å; M152-W202 WeakPolarHBondContact SD-CZ3 3.37Å; M152-V206 HydrophobicContact CG-CG1 3.69Å; M152-F221 HydrophobicContact CE-CE2 3.94Å; M152-F221 HydrophobicContact CE-CZ 3.49Å; M152-F221 VanDerWaalsContact CE-CZ 3.49Å; M152-F221 HydrophobicContact SD-CE2 4.16Å; M152-F221 HydrophobicContact SD-CZ 4.29Å; M152-F225 HydrophobicContact CE-CE1 4.19Å; M152-F225 HydrophobicContact CE-CE2 4.44Å; M152-F225 HydrophobicContact CE-CZ 4.01Å; M152-F225 HydrophobicContact SD-CD2 4.45Å; M152-F225 HydrophobicContact SD-CE1 4.49Å; M152-F225 HydrophobicContact SD-CE2 3.73Å; M152-F225 HydrophobicContact SD-CZ 3.76Å; M152-L282 HydrophobicContact CE-CB 3.9Å; M152-L282 HydrophobicContact CE-CD1 4.49Å; M152-V286 HydrophobicContact CE-CG2 3.73Å |
| 153 | Y | 87.3 | Confident | 85.7 | Confident | 12 Ų | 12 | 50.7 Ų | 50.7 | 5% | 0.047 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -63.1 | -48 | 170.8 | 171.3 | -100.9 | 0 | 0 | 0 | 112.3 | W120 F137 C149 K150 L155 W156 M157 Y203 | W120-Y153 AromaticContact CE2-CE2 3.85Å; W120-Y153 HydrophobicContact CH2-CE1 4.32Å; W120-Y153 HydrophobicContact CH2-CE2 4.15Å; W120-Y153 AromaticContact CH2-CZ 3.52Å; W120-Y153 WeakPolarHBondContact CH2-OH 3.21Å; W120-Y153 AromaticContact CZ2-CE2 3.57Å; W120-Y153 HydrophobicContact CZ2-CE2 3.57Å; W120-Y153 AromaticContact CZ2-CZ 3.36Å; W120-Y153 WeakPolarHBondContact CZ2-OH 3.31Å; F137-Y153 HydrophobicContact CZ-CD1 4.37Å; F137-Y153 AromaticContact CZ-CG 3.98Å; F137-Y153 HydrophobicContact CZ-CG 3.98Å; C149-Y153 WeakPolarHBondContact O-CB 3.47Å; C149-Y153 PolarHBondContact O-N 2.61Å; K150-Y153 WeakPolarHBondContact O-CB 3.48Å; K150-Y153 PolarHBondContact O-N 3.48Å; Y153-L155 VanDerWaalsContact C-N 3.29Å; Y153-L155 PolarHBondContact O-N 2.89Å; Y153-W156 HydrophobicContact CD2-CE3 4.26Å; Y153-W156 AromaticContact CE2-CE3 3.83Å; Y153-W156 HydrophobicContact CE2-CE3 3.83Å; Y153-W156 AromaticContact CE2-CZ3 3.88Å; Y153-W156 HydrophobicContact CE2-CZ3 3.88Å; Y153-W156 WeakPolarHBondContact O-CB 3.49Å; Y153-W156 PolarHBondContact O-N 3.02Å; Y153-M157 HydrophobicContact CE1-CE 4.19Å; Y153-M157 PolarHBondContact O-N 2.89Å; Y153-M157 PolarHBondContact OH-SD 3.1Å; Y153-M157 VanDerWaalsContact OH-SD 3.35Å; Y153-Y203 HydrophobicContact CD2-CE2 4.08Å; Y153-Y203 AromaticContact CD2-CZ 3.93Å; Y153-Y203 HydrophobicContact CG-CE2 4.35Å |
| 154 | Y | 88.4 | Confident | 87.3 | Confident | 142 Ų | 142 | 51.5 Ų | 51.5 | 56% | 0.557 | 23% | 0.231 | S | C | * | . | H | α-helix | trans | -64.1 | -34.3 | 177.4 | -73.4 | -61.9 | 0 | 0 | 0 | 112.6 | K150 M151 M157 F158 | K150-Y154 HydrophobicContact CB-CE2 4.32Å; K150-Y154 WeakPolarHBondContact O-CD2 3.45Å; K150-Y154 PolarHBondContact O-N 3.08Å; M151-Y154 PolarHBondContact O-N 2.84Å; Y154-M157 HydrophobicContact CD1-CE 3.66Å; Y154-M157 HydrophobicContact CE1-CE 3.93Å; Y154-M157 PolarHBondContact O-N 2.89Å; Y154-F158 VanDerWaalsContact O-CB 3.25Å; Y154-F158 WeakPolarHBondContact O-CB 3.4Å; Y154-F158 PolarHBondContact O-N 3.16Å |
| 155 | L | 92.2 | Very high | 88.8 | Confident | 5 Ų | 5 | 47.2 Ų | 47.2 | 3% | 0.026 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -61 | -45.8 | 172.6 | -179 | 76.1 | 0 | 0 | 0 | 111.3 | M151 M152 Y153 M157 F158 Y159 W202 F225 M278 S279 L282 | M151-L155 WeakPolarHBondContact O-CB 3.46Å; M151-L155 PolarHBondContact O-N 2.89Å; M152-L155 WeakPolarHBondContact O-CB 3.46Å; M152-L155 PolarHBondContact O-N 2.86Å; M152-L155 HydrophobicContact SD-CD2 4.28Å; Y153-L155 VanDerWaalsContact C-N 3.29Å; Y153-L155 PolarHBondContact O-N 2.89Å; L155-M157 VanDerWaalsContact C-N 3.34Å; L155-M157 PolarHBondContact O-N 3.17Å; L155-F158 PolarHBondContact O-N 3.5Å; L155-Y159 WeakPolarHBondContact O-CB 3.34Å; L155-Y159 PolarHBondContact O-N 3.13Å; L155-W202 HydrophobicContact CD2-CH2 4.12Å; L155-F225 HydrophobicContact CD2-CE2 3.8Å; L155-F225 HydrophobicContact CD2-CZ 3.52Å; L155-M278 HydrophobicContact CD1-CB 3.64Å; L155-M278 HydrophobicContact CD1-CE 4.04Å; L155-S279 WeakPolarHBondContact CD2-OG 3.35Å; L155-L282 HydrophobicContact CB-CD1 3.89Å; L155-L282 HydrophobicContact CD1-CD1 4.46Å; L155-L282 HydrophobicContact CD2-CD1 3.78Å; L155-L282 HydrophobicContact CG-CD1 4.26Å |
| 156 | W | 92.7 | Very high | 89.9 | Confident | 35 Ų | 35 | 46 Ų | 46 | 13% | 0.133 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -60.5 | -44 | 176.8 | 170.2 | 75.6 | 0 | 0 | 0 | 111.8 | M152 Y153 Y159 S160 T195 S198 F199 W202 | M152-W156 PolarHBondContact O-N 2.85Å; M152-W156 VanDerWaalsContact O-N 3.14Å; Y153-W156 HydrophobicContact CD2-CE3 4.26Å; Y153-W156 AromaticContact CE2-CE3 3.83Å; Y153-W156 HydrophobicContact CE2-CE3 3.83Å; Y153-W156 AromaticContact CE2-CZ3 3.88Å; Y153-W156 HydrophobicContact CE2-CZ3 3.88Å; Y153-W156 WeakPolarHBondContact O-CB 3.49Å; Y153-W156 PolarHBondContact O-N 3.02Å; W156-Y159 PolarHBondContact O-N 3.27Å; W156-S160 PolarHBondContact O-N 2.95Å; W156-S160 PolarHBondContact O-OG 3.42Å; W156-T195 HydrophobicContact CZ2-CG2 4.33Å; W156-T195 PolarHBondContact NE1-O 3.21Å; W156-S198 PolarHBondContact NE1-OG 2.81Å; W156-F199 HydrophobicContact CD2-CD2 4.15Å; W156-F199 AromaticContact CE2-CD2 3.85Å; W156-F199 HydrophobicContact CE3-CD2 4.46Å; W156-F199 HydrophobicContact CH2-CD2 4.22Å; W156-F199 HydrophobicContact CZ2-CB 4.07Å; W156-F199 AromaticContact CZ2-CD2 3.89Å; W156-F199 HydrophobicContact CZ2-CD2 3.89Å; W156-F199 HydrophobicContact CZ2-CG 4.26Å; W156-F199 HydrophobicContact CZ3-CD2 4.5Å; W156-W202 HydrophobicContact CB-CH2 3.58Å; W156-W202 HydrophobicContact CB-CZ2 3.94Å; W156-W202 HydrophobicContact CB-CZ3 4.41Å |
| 157 | M | 90.4 | Very high | 90.9 | Very high | 73 Ų | 73 | 45.5 Ų | 45.5 | 36% | 0.36 | 21% | 0.206 | S | C | . | . | H | α-helix | trans | -65.3 | -44 | 177.3 | -173.2 | 162.5 | 61 | 0 | 0 | 111.5 | Y153 Y154 L155 Y159 S160 V161 | Y153-M157 HydrophobicContact CE1-CE 4.19Å; Y153-M157 PolarHBondContact O-N 2.89Å; Y153-M157 PolarHBondContact OH-SD 3.1Å; Y153-M157 VanDerWaalsContact OH-SD 3.35Å; Y154-M157 HydrophobicContact CD1-CE 3.66Å; Y154-M157 HydrophobicContact CE1-CE 3.93Å; Y154-M157 PolarHBondContact O-N 2.89Å; L155-M157 VanDerWaalsContact C-N 3.34Å; L155-M157 PolarHBondContact O-N 3.17Å; M157-Y159 VanDerWaalsContact C-N 3.32Å; M157-Y159 PolarHBondContact O-N 3.08Å; M157-S160 WeakPolarHBondContact O-CB 3.34Å; M157-S160 PolarHBondContact O-N 3.31Å; M157-V161 WeakPolarHBondContact O-CG2 3.43Å; M157-V161 PolarHBondContact O-N 2.95Å |
| 158 | F | 93.7 | Very high | 91.7 | Very high | 54 Ų | 54 | 40 Ų | 40 | 24% | 0.237 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -58.5 | -43.6 | 174.2 | 175.8 | -92 | 0 | 0 | 0 | 111.9 | Y154 L155 V161 T162 L271 I274 M278 | Y154-F158 VanDerWaalsContact O-CB 3.25Å; Y154-F158 WeakPolarHBondContact O-CB 3.4Å; Y154-F158 PolarHBondContact O-N 3.16Å; L155-F158 PolarHBondContact O-N 3.5Å; F158-V161 PolarHBondContact O-N 3.44Å; F158-T162 WeakPolarHBondContact O-CB 3.27Å; F158-T162 PolarHBondContact O-N 3.15Å; F158-T162 PolarHBondContact O-OG1 2.73Å; F158-L271 VanDerWaalsContact CE1-O 3.31Å; F158-L271 WeakPolarHBondContact CE1-O 3.39Å; F158-L271 HydrophobicContact CE2-CD2 3.8Å; F158-L271 HydrophobicContact CZ-CB 4.18Å; F158-L271 HydrophobicContact CZ-CD2 3.77Å; F158-L271 WeakPolarHBondContact CZ-O 3.32Å; F158-I274 HydrophobicContact CE1-CG2 4.44Å; F158-I274 HydrophobicContact CZ-CB 4.2Å; F158-I274 HydrophobicContact CZ-CG2 3.94Å; F158-M278 HydrophobicContact CD1-CE 3.46Å; F158-M278 VanDerWaalsContact CD1-CE 3.46Å; F158-M278 HydrophobicContact CD2-CE 4.22Å; F158-M278 HydrophobicContact CE1-CE 3.59Å; F158-M278 HydrophobicContact CE2-CE 4.31Å; F158-M278 HydrophobicContact CG-CE 3.8Å; F158-M278 HydrophobicContact CZ-CE 4.02Å |
| 159 | Y | 94.8 | Very high | 92.3 | Very high | 8 Ų | 8 | 39.8 Ų | 39.8 | 3% | 0.031 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -62.9 | -42.7 | 176.8 | -179.5 | -119.6 | 0 | 0 | 0 | 111.8 | L155 W156 M157 V161 T162 L163 F194 H228 V232 Q235 F272 | L155-Y159 WeakPolarHBondContact O-CB 3.34Å; L155-Y159 PolarHBondContact O-N 3.13Å; W156-Y159 PolarHBondContact O-N 3.27Å; M157-Y159 VanDerWaalsContact C-N 3.32Å; M157-Y159 PolarHBondContact O-N 3.08Å; Y159-V161 PolarHBondContact O-N 3.47Å; Y159-T162 WeakPolarHBondContact O-CB 3.41Å; Y159-T162 PolarHBondContact O-N 3.3Å; Y159-L163 HydrophobicContact CD1-CD1 4.14Å; Y159-L163 HydrophobicContact CE1-CD1 3.61Å; Y159-L163 HydrophobicContact CE1-CG 4.3Å; Y159-L163 HydrophobicContact CE2-CD1 4.27Å; Y159-L163 HydrophobicContact CE2-CD2 4.22Å; Y159-L163 HydrophobicContact CE2-CG 4.08Å; Y159-L163 WeakPolarHBondContact O-CG 3.18Å; Y159-L163 PolarHBondContact O-N 3.22Å; Y159-F194 HydrophobicContact CE1-CB 4.11Å; Y159-H228 AromaticContact CD1-CE1 3.76Å; Y159-H228 AromaticContact CE1-CE1 3.74Å; Y159-H228 AromaticContact CG-CE1 3.92Å; Y159-H228 AromaticContact CZ-CE1 3.91Å; Y159-V232 HydrophobicContact CD2-CG2 3.91Å; Y159-V232 HydrophobicContact CE2-CG2 3.68Å; Y159-Q235 VanDerWaalsContact CE2-OE1 3.3Å; Y159-Q235 PolarHBondContact OH-NE2 3.06Å; Y159-Q235 VanDerWaalsContact OH-NE2 3.1Å; Y159-Q235 PolarHBondContact OH-OE1 2.92Å; Y159-F272 HydrophobicContact CE2-CE1 4.29Å |
| 160 | S | 93.2 | Very high | 92.8 | Very high | 20 Ų | 20 | 39.8 Ų | 39.8 | 14% | 0.14 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -61.9 | -44.4 | 176.8 | -55.1 | 0 | 0 | 0 | 0 | 111.9 | W156 M157 T162 L163 F164 | W156-S160 PolarHBondContact O-N 2.95Å; W156-S160 PolarHBondContact O-OG 3.42Å; M157-S160 WeakPolarHBondContact O-CB 3.34Å; M157-S160 PolarHBondContact O-N 3.31Å; S160-T162 VanDerWaalsContact C-N 3.33Å; S160-T162 PolarHBondContact O-N 2.91Å; S160-L163 PolarHBondContact O-N 2.89Å; S160-F164 PolarHBondContact O-N 3.21Å |
| 161 | V | 95.1 | Very high | 93.3 | Very high | 76 Ų | 76 | 39 Ų | 39 | 46% | 0.461 | 19% | 0.188 | S | C | . | . | H | α-helix | trans | -63.5 | -40 | 174.4 | 172.7 | 0 | 0 | 0 | 0 | 111 | M157 F158 Y159 F164 L165 | M157-V161 WeakPolarHBondContact O-CG2 3.43Å; M157-V161 PolarHBondContact O-N 2.95Å; F158-V161 PolarHBondContact O-N 3.44Å; Y159-V161 PolarHBondContact O-N 3.47Å; V161-F164 WeakPolarHBondContact O-CB 3.45Å; V161-F164 PolarHBondContact O-N 3.39Å; V161-L165 HydrophobicContact CG1-CD1 4.1Å; V161-L165 HydrophobicContact CG1-CG 4.4Å; V161-L165 WeakPolarHBondContact O-CG 3.28Å; V161-L165 PolarHBondContact O-N 3.18Å |
| 162 | T | 96.2 | Very high | 93.6 | Very high | 1 Ų | 1 | 36.8 Ų | 36.8 | 1% | 0.006 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -64.3 | -42.6 | 178.2 | -56.9 | 0 | 0 | 0 | 0 | 111.5 | F158 Y159 S160 F164 L165 N166 L271 F272 | F158-T162 WeakPolarHBondContact O-CB 3.27Å; F158-T162 PolarHBondContact O-N 3.15Å; F158-T162 PolarHBondContact O-OG1 2.73Å; Y159-T162 WeakPolarHBondContact O-CB 3.41Å; Y159-T162 PolarHBondContact O-N 3.3Å; S160-T162 VanDerWaalsContact C-N 3.33Å; S160-T162 PolarHBondContact O-N 2.91Å; T162-F164 VanDerWaalsContact C-N 3.29Å; T162-F164 PolarHBondContact O-N 3.05Å; T162-L165 PolarHBondContact O-N 2.83Å; T162-N166 WeakPolarHBondContact O-CB 3.22Å; T162-N166 PolarHBondContact O-N 3.37Å; T162-L271 HydrophobicContact CG2-CB 3.71Å; T162-F272 HydrophobicContact CG2-CD1 3.57Å; T162-F272 HydrophobicContact CG2-CD2 4.2Å; T162-F272 HydrophobicContact CG2-CE1 3.62Å; T162-F272 HydrophobicContact CG2-CE2 4.26Å; T162-F272 HydrophobicContact CG2-CG 3.86Å; T162-F272 HydrophobicContact CG2-CZ 3.98Å |
| 163 | L | 95.7 | Very high | 93.7 | Very high | 1 Ų | 1 | 37.5 Ų | 37.5 | 1% | 0.005 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -62.2 | -37.2 | 173.7 | -72.3 | 175.4 | 0 | 0 | 0 | 112.1 | Y159 S160 N166 L167 W190 L191 F194 F272 | Y159-L163 HydrophobicContact CD1-CD1 4.14Å; Y159-L163 HydrophobicContact CE1-CD1 3.61Å; Y159-L163 HydrophobicContact CE1-CG 4.3Å; Y159-L163 HydrophobicContact CE2-CD1 4.27Å; Y159-L163 HydrophobicContact CE2-CD2 4.22Å; Y159-L163 HydrophobicContact CE2-CG 4.08Å; Y159-L163 WeakPolarHBondContact O-CG 3.18Å; Y159-L163 PolarHBondContact O-N 3.22Å; S160-L163 PolarHBondContact O-N 2.89Å; L163-N166 WeakPolarHBondContact O-CB 3.4Å; L163-N166 PolarHBondContact O-N 3.48Å; L163-L167 PolarHBondContact O-N 2.91Å; L163-W190 HydrophobicContact CD2-CB 4.46Å; L163-L191 HydrophobicContact CB-CD1 3.66Å; L163-F194 HydrophobicContact CD1-CB 3.93Å; L163-F272 HydrophobicContact CD2-CE1 4.21Å; L163-F272 HydrophobicContact CD2-CZ 4.23Å |
| 164 | F | 95.8 | Very high | 94 | Very high | 100 Ų | 100 | 40.1 Ų | 40.1 | 44% | 0.439 | 20% | 0.196 | S | C | . | . | H | α-helix | trans | -67 | -43.6 | 175.6 | 177.3 | -100.6 | 0 | 0 | 0 | 111.9 | S160 V161 T162 N166 L167 L168 L191 | S160-F164 PolarHBondContact O-N 3.21Å; V161-F164 WeakPolarHBondContact O-CB 3.45Å; V161-F164 PolarHBondContact O-N 3.39Å; T162-F164 VanDerWaalsContact C-N 3.29Å; T162-F164 PolarHBondContact O-N 3.05Å; F164-N166 VanDerWaalsContact C-N 3.29Å; F164-N166 PolarHBondContact O-N 2.84Å; F164-L167 WeakPolarHBondContact O-CB 3.46Å; F164-L167 PolarHBondContact O-N 3.26Å; F164-L168 HydrophobicContact CD1-CD1 4.38Å; F164-L168 HydrophobicContact CE1-CD1 3.77Å; F164-L168 HydrophobicContact CE1-CG 4.26Å; F164-L168 HydrophobicContact CZ-CD1 4.18Å; F164-L168 HydrophobicContact CZ-CD2 4.36Å; F164-L168 HydrophobicContact CZ-CG 4.38Å; F164-L168 PolarHBondContact O-N 3.27Å; F164-L168 VanDerWaalsContact O-N 3.12Å; F164-L191 HydrophobicContact CB-CD1 4.08Å |
| 165 | L | 96.1 | Very high | 94.2 | Very high | 61 Ų | 61 | 39.4 Ų | 39.4 | 32% | 0.319 | 20% | 0.2 | S | C | . | . | H | α-helix | trans | -66.1 | -34 | 174.6 | -67.2 | 175.2 | 0 | 0 | 0 | 111.9 | V161 T162 L168 A169 V268 L271 | V161-L165 HydrophobicContact CG1-CD1 4.1Å; V161-L165 HydrophobicContact CG1-CG 4.4Å; V161-L165 WeakPolarHBondContact O-CG 3.28Å; V161-L165 PolarHBondContact O-N 3.18Å; T162-L165 PolarHBondContact O-N 2.83Å; L165-L168 HydrophobicContact CD2-CD1 4.31Å; L165-L168 PolarHBondContact O-N 3.46Å; L165-A169 PolarHBondContact O-N 2.77Å; L165-V268 HydrophobicContact CB-CG2 4.25Å; L165-L271 HydrophobicContact CD1-CD1 3.46Å; L165-L271 VanDerWaalsContact CD1-CD1 3.46Å |
| 166 | N | 96.8 | Very high | 94 | Very high | 0 Ų | 0 | 43 Ų | 43 | 0% | 0 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -62.2 | -41.6 | 171.5 | 179.1 | 72.3 | 0 | 0 | 0 | 112 | T162 L163 F164 L168 A169 C170 G243 N244 S245 V268 F272 | T162-N166 WeakPolarHBondContact O-CB 3.22Å; T162-N166 PolarHBondContact O-N 3.37Å; L163-N166 WeakPolarHBondContact O-CB 3.4Å; L163-N166 PolarHBondContact O-N 3.48Å; F164-N166 VanDerWaalsContact C-N 3.29Å; F164-N166 PolarHBondContact O-N 2.84Å; N166-L168 VanDerWaalsContact C-N 3.31Å; N166-L168 PolarHBondContact O-N 3.48Å; N166-A169 PolarHBondContact O-N 3.5Å; N166-C170 WeakPolarHBondContact O-CB 3.2Å; N166-C170 PolarHBondContact O-N 3.48Å; N166-C170 PolarHBondContact O-SG 2.94Å; N166-C170 VanDerWaalsContact O-SG 3.35Å; N166-G243 PolarHBondContact ND2-O 2.91Å; N166-N244 WeakPolarHBondContact OD1-CA 3.4Å; N166-S245 PolarHBondContact OD1-N 3.32Å; N166-V268 HydrophobicContact CB-CG1 3.82Å; N166-F272 HydrophobicContact CB-CE2 3.9Å; N166-F272 HydrophobicContact CB-CZ 3.86Å |
| 167 | L | 96.4 | Very high | 93.7 | Very high | 25 Ų | 25 | 43.2 Ų | 43.2 | 13% | 0.131 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -57.4 | -44.6 | 172 | 170.4 | 67.3 | 0 | 0 | 0 | 111.5 | L163 F164 C170 L171 F184 S187 I188 L191 | L163-L167 PolarHBondContact O-N 2.91Å; F164-L167 WeakPolarHBondContact O-CB 3.46Å; F164-L167 PolarHBondContact O-N 3.26Å; L167-C170 PolarHBondContact O-N 3.4Å; L167-L171 WeakPolarHBondContact O-CB 3.28Å; L167-L171 PolarHBondContact O-N 2.98Å; L167-F184 HydrophobicContact CD1-CD2 3.9Å; L167-F184 HydrophobicContact CD1-CE2 3.5Å; L167-F184 VanDerWaalsContact CD1-CE2 3.5Å; L167-F184 HydrophobicContact CD1-CZ 4.43Å; L167-F184 HydrophobicContact CG-CE2 4.48Å; L167-S187 WeakPolarHBondContact CD1-OG 3.3Å; L167-I188 HydrophobicContact CD1-CB 4.39Å; L167-I188 HydrophobicContact CD1-CD1 4.34Å; L167-I188 HydrophobicContact CD1-CG1 3.34Å; L167-L191 HydrophobicContact CD2-CD2 3.87Å |
| 168 | L | 95.8 | Very high | 93.6 | Very high | 77 Ų | 77 | 45 Ų | 45 | 40% | 0.403 | 24% | 0.238 | S | C | . | . | H | α-helix | trans | -66 | -37.3 | 177.3 | -61.3 | -175.4 | 0 | 0 | 0 | 112.6 | F164 L165 N166 L171 A172 | F164-L168 HydrophobicContact CD1-CD1 4.38Å; F164-L168 HydrophobicContact CE1-CD1 3.77Å; F164-L168 HydrophobicContact CE1-CG 4.26Å; F164-L168 HydrophobicContact CZ-CD1 4.18Å; F164-L168 HydrophobicContact CZ-CD2 4.36Å; F164-L168 HydrophobicContact CZ-CG 4.38Å; F164-L168 PolarHBondContact O-N 3.27Å; F164-L168 VanDerWaalsContact O-N 3.12Å; L165-L168 HydrophobicContact CD2-CD1 4.31Å; L165-L168 PolarHBondContact O-N 3.46Å; N166-L168 VanDerWaalsContact C-N 3.31Å; N166-L168 PolarHBondContact O-N 3.48Å; L168-L171 WeakPolarHBondContact O-CB 3.48Å; L168-L171 PolarHBondContact O-N 2.93Å; L168-A172 PolarHBondContact O-N 3.03Å |
| 169 | A | 94.6 | Very high | 93.3 | Very high | 0 Ų | 0 | 50 Ų | 50 | 0% | 0 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -66.7 | -45.3 | 175.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | L165 N166 L171 A172 Y173 S245 I264 M265 V268 | L165-A169 PolarHBondContact O-N 2.77Å; N166-A169 PolarHBondContact O-N 3.5Å; A169-L171 VanDerWaalsContact C-N 3.29Å; A169-L171 PolarHBondContact O-N 3.27Å; A169-A172 PolarHBondContact O-N 3.39Å; A169-Y173 PolarHBondContact O-N 2.98Å; A169-S245 WeakPolarHBondContact CB-OG 3.49Å; A169-I264 HydrophobicContact CB-CG2 3.96Å; A169-M265 HydrophobicContact CB-CG 4.44Å; A169-V268 HydrophobicContact CB-CG2 3.8Å |
| 170 | C | 94.4 | Very high | 93 | Very high | 1 Ų | 1 | 50.7 Ų | 50.7 | 1% | 0.007 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -65.7 | -31.9 | 175.3 | -66.8 | 0 | 0 | 0 | 0 | 112.1 | N166 L167 Y173 F174 S245 | N166-C170 WeakPolarHBondContact O-CB 3.2Å; N166-C170 PolarHBondContact O-N 3.48Å; N166-C170 PolarHBondContact O-SG 2.94Å; N166-C170 VanDerWaalsContact O-SG 3.35Å; L167-C170 PolarHBondContact O-N 3.4Å; C170-Y173 PolarHBondContact O-N 2.93Å; C170-F174 WeakPolarHBondContact O-CB 3.3Å; C170-F174 PolarHBondContact O-N 2.87Å; C170-S245 PolarHBondContact SG-OG 2.98Å; C170-S245 VanDerWaalsContact SG-OG 3.33Å |
| 171 | L | 94.6 | Very high | 92.8 | Very high | 57 Ų | 57 | 51 Ų | 51 | 30% | 0.298 | 27% | 0.269 | S | S | . | . | H | α-helix | trans | -64.5 | -48.4 | 171.4 | 176.2 | 61.2 | 0 | 0 | 0 | 111.3 | L167 L168 A169 Y173 F174 I175 F184 | L167-L171 WeakPolarHBondContact O-CB 3.28Å; L167-L171 PolarHBondContact O-N 2.98Å; L168-L171 WeakPolarHBondContact O-CB 3.48Å; L168-L171 PolarHBondContact O-N 2.93Å; A169-L171 VanDerWaalsContact C-N 3.29Å; A169-L171 PolarHBondContact O-N 3.27Å; L171-Y173 PolarHBondContact O-N 3.3Å; L171-F174 PolarHBondContact O-N 3.06Å; L171-I175 HydrophobicContact CD1-CD1 4Å; L171-I175 HydrophobicContact CD1-CG1 4.24Å; L171-I175 HydrophobicContact CG-CD1 3.95Å; L171-I175 VanDerWaalsContact O-CG1 3.32Å; L171-I175 WeakPolarHBondContact O-CG1 3.44Å; L171-I175 PolarHBondContact O-N 3.3Å; L171-F184 HydrophobicContact CB-CD2 3.85Å; L171-F184 HydrophobicContact CB-CE2 3.7Å; L171-F184 HydrophobicContact CD1-CD2 4.22Å; L171-F184 HydrophobicContact CD1-CE1 4.43Å; L171-F184 HydrophobicContact CD1-CE2 3.76Å; L171-F184 HydrophobicContact CD1-CZ 3.87Å; L171-F184 HydrophobicContact CG-CE2 4.21Å |
| 172 | A | 92.9 | Very high | 92.7 | Very high | 25 Ų | 25 | 51.2 Ų | 51.2 | 21% | 0.207 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -59.1 | -38.3 | 176 | 0 | 0 | 0 | 0 | 0 | 111.3 | L168 A169 D176 I264 | L168-A172 PolarHBondContact O-N 3.03Å; A169-A172 PolarHBondContact O-N 3.39Å; A172-D176 PolarHBondContact O-N 3.44Å; A172-I264 HydrophobicContact CB-CD1 4.48Å |
| 173 | Y | 91.9 | Very high | 92.6 | Very high | 14 Ų | 14 | 51.5 Ų | 51.5 | 6% | 0.055 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -65.2 | -44.8 | 176.4 | -166.2 | -168.7 | 0 | 0 | 0 | 112.4 | A169 C170 L171 I175 D176 D177 H180 E253 V261 M265 | A169-Y173 PolarHBondContact O-N 2.98Å; C170-Y173 PolarHBondContact O-N 2.93Å; L171-Y173 PolarHBondContact O-N 3.3Å; Y173-I175 PolarHBondContact O-N 3.49Å; Y173-D176 PolarHBondContact O-N 3.38Å; Y173-D177 PolarHBondContact O-N 3.18Å; Y173-H180 HydrophobicContact CD1-CB 3.92Å; Y173-H180 AromaticContact CD1-CG 3.75Å; Y173-H180 AromaticContact CD1-ND1 3.93Å; Y173-H180 HydrophobicContact CD2-CB 4.28Å; Y173-H180 AromaticContact CD2-CD2 3.8Å; Y173-H180 AromaticContact CD2-CG 3.98Å; Y173-H180 HydrophobicContact CE1-CB 4.18Å; Y173-H180 AromaticContact CE1-CD2 3.86Å; Y173-H180 AromaticContact CE1-CE1 3.56Å; Y173-H180 AromaticContact CE1-CG 3.49Å; Y173-H180 VanDerWaalsContact CE1-CG 3.49Å; Y173-H180 AromaticContact CE1-ND1 3.3Å; Y173-H180 VanDerWaalsContact CE1-ND1 3.3Å; Y173-H180 WeakPolarHBondContact CE1-ND1 3.24Å; Y173-H180 AromaticContact CE1-NE2 3.93Å; Y173-H180 HydrophobicContact CE2-CB 4.48Å; Y173-H180 AromaticContact CE2-CD2 3.26Å; Y173-H180 WeakPolarHBondContact CE2-CD2 3.48Å; Y173-H180 AromaticContact CE2-CG 3.71Å; Y173-H180 AromaticContact CE2-NE2 3.52Å; Y173-H180 HydrophobicContact CG-CB 4.02Å; Y173-H180 AromaticContact CZ-CD2 3.36Å; Y173-H180 AromaticContact CZ-CE1 3.28Å; Y173-H180 AromaticContact CZ-CG 3.51Å; Y173-H180 AromaticContact CZ-ND1 3.48Å; Y173-H180 AromaticContact CZ-NE2 3.24Å; Y173-H180 PolarHBondContact OH-CE1 3.33Å; Y173-H180 PolarHBondContact OH-NE2 2.8Å; Y173-H180 VanDerWaalsContact OH-NE2 3.16Å; Y173-E253 HydrophobicContact CE2-CG 4.15Å; Y173-E253 VanDerWaalsContact CE2-OE1 3.24Å; Y173-E253 WeakPolarHBondContact CE2-OE1 3.02Å; Y173-E253 WeakPolarHBondContact CE2-OE2 3.43Å; Y173-E253 PolarHBondContact OH-OE2 3.29Å; Y173-V261 HydrophobicContact CD2-CG1 4.39Å; Y173-M265 HydrophobicContact CD1-CE 3.77Å; Y173-M265 HydrophobicContact CE1-CE 3.97Å; Y173-M265 HydrophobicContact CG-CE 4.38Å |
| 174 | F | 93.6 | Very high | 92.5 | Very high | 68 Ų | 68 | 53.9 Ų | 53.9 | 30% | 0.298 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -65.3 | -36.2 | 177.6 | 171.9 | -120.4 | 0 | 0 | 0 | 113.6 | C170 L171 D176 D177 T178 G181 F184 | C170-F174 WeakPolarHBondContact O-CB 3.3Å; C170-F174 PolarHBondContact O-N 2.87Å; L171-F174 PolarHBondContact O-N 3.06Å; F174-D176 VanDerWaalsContact C-N 3.25Å; F174-D176 PolarHBondContact O-N 3.49Å; F174-D177 CarbonylContact O-C 3.29Å; F174-D177 VanDerWaalsContact O-C 3.29Å; F174-T178 HydrophobicContact CE2-CG2 4.49Å; F174-T178 WeakPolarHBondContact CE2-O 3.34Å; F174-G181 VanDerWaalsContact CD2-N 3.34Å; F174-F184 HydrophobicContact CB-CB 3.98Å; F174-F184 HydrophobicContact CD1-CD1 4.18Å; F174-F184 HydrophobicContact CD1-CG 4.5Å; F174-F184 HydrophobicContact CG-CB 4.34Å |
| 175 | I | 91.6 | Very high | 92.4 | Very high | 127 Ų | 127 | 50.9 Ų | 50.9 | 65% | 0.651 | 28% | 0.281 | S | S | * | . | H | α-helix | trans | -64.6 | -35.2 | 176.8 | -70.2 | 166.9 | 0 | 0 | 0 | 110.8 | L171 Y173 | L171-I175 HydrophobicContact CD1-CD1 4Å; L171-I175 HydrophobicContact CD1-CG1 4.24Å; L171-I175 HydrophobicContact CG-CD1 3.95Å; L171-I175 VanDerWaalsContact O-CG1 3.32Å; L171-I175 WeakPolarHBondContact O-CG1 3.44Å; L171-I175 PolarHBondContact O-N 3.3Å; Y173-I175 PolarHBondContact O-N 3.49Å |
| 176 | D | 88.1 | Confident | 92.3 | Very high | 79 Ų | 79 | 50 Ų | 50 | 42% | 0.422 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -83.2 | -36.3 | -177.4 | -169.5 | 84.7 | 0 | 0 | 0 | 113 | A172 Y173 F174 K258 V261 | A172-D176 PolarHBondContact O-N 3.44Å; Y173-D176 PolarHBondContact O-N 3.38Å; F174-D176 VanDerWaalsContact C-N 3.25Å; F174-D176 PolarHBondContact O-N 3.49Å; D176-K258 WeakPolarHBondContact OD2-CD 3.36Å; D176-K258 WeakPolarHBondContact OD2-CE 3.47Å; D176-K258 IonicContact OD2-NZ 3.46Å; D176-K258 PolarHBondContact OD2-NZ 2.93Å; D176-V261 HydrophobicContact CB-CG2 4.13Å |
| 177 | D | 86.3 | Confident | 92.3 | Very high | 41 Ų | 41 | 50 Ų | 50 | 22% | 0.219 | 28% | 0.276 | C | S | . | . | trans | -139 | 116.6 | 167.8 | -175 | -14.9 | 0 | 0 | 0 | 111.3 | Y173 F174 K179 H180 | Y173-D177 PolarHBondContact O-N 3.18Å; F174-D177 CarbonylContact O-C 3.29Å; F174-D177 VanDerWaalsContact O-C 3.29Å; D177-K179 PolarHBondContact O-N 3.45Å; D177-K179 VanDerWaalsContact OD1-CB 3.32Å; D177-K179 WeakPolarHBondContact OD1-CB 3.29Å; D177-K179 VanDerWaalsContact OD1-CG 3.28Å; D177-K179 WeakPolarHBondContact OD1-CG 3.1Å; D177-K179 PolarHBondContact OD1-N 3.36Å; D177-H180 PolarHBondContact O-N 2.79Å | ||
| 178 | T | 88.4 | Confident | 92.2 | Very high | 110 Ų | 110 | 52.2 Ų | 52.2 | 68% | 0.675 | 29% | 0.287 | S | S | * | . | G | 310 helix | trans | -63.3 | -16.3 | -175.7 | 54.2 | 0 | 0 | 0 | 0 | 113.7 | F174 H180 G181 | F174-T178 HydrophobicContact CE2-CG2 4.49Å; F174-T178 WeakPolarHBondContact CE2-O 3.34Å; T178-H180 PolarHBondContact O-N 2.96Å; T178-G181 PolarHBondContact O-N 3.03Å |
| 179 | K | 87.7 | Confident | 92.2 | Very high | 158 Ų | 158 | 52.7 Ų | 52.7 | 69% | 0.687 | 29% | 0.29 | S | S | * | . | G | 310 helix | trans | -63.5 | -22.5 | 173.6 | -65.5 | 171.5 | -172.3 | 165.8 | 0 | 112.8 | D177 G181 | D177-K179 PolarHBondContact O-N 3.45Å; D177-K179 VanDerWaalsContact OD1-CB 3.32Å; D177-K179 WeakPolarHBondContact OD1-CB 3.29Å; D177-K179 VanDerWaalsContact OD1-CG 3.28Å; D177-K179 WeakPolarHBondContact OD1-CG 3.1Å; D177-K179 PolarHBondContact OD1-N 3.36Å; K179-G181 VanDerWaalsContact C-N 3.26Å; K179-G181 PolarHBondContact O-N 2.78Å |
| 180 | H | 88 | Confident | 92.1 | Very high | 23 Ų | 23 | 54.4 Ų | 54.4 | 11% | 0.106 | 30% | 0.296 | C | S | . | . | G | 310 helix | trans | -88.3 | 18.3 | 179.9 | -66.1 | -72.5 | 0 | 0 | 0 | 114 | Y173 D177 T178 V182 D183 F184 | Y173-H180 HydrophobicContact CD1-CB 3.92Å; Y173-H180 AromaticContact CD1-CG 3.75Å; Y173-H180 AromaticContact CD1-ND1 3.93Å; Y173-H180 HydrophobicContact CD2-CB 4.28Å; Y173-H180 AromaticContact CD2-CD2 3.8Å; Y173-H180 AromaticContact CD2-CG 3.98Å; Y173-H180 HydrophobicContact CE1-CB 4.18Å; Y173-H180 AromaticContact CE1-CD2 3.86Å; Y173-H180 AromaticContact CE1-CE1 3.56Å; Y173-H180 AromaticContact CE1-CG 3.49Å; Y173-H180 VanDerWaalsContact CE1-CG 3.49Å; Y173-H180 AromaticContact CE1-ND1 3.3Å; Y173-H180 VanDerWaalsContact CE1-ND1 3.3Å; Y173-H180 WeakPolarHBondContact CE1-ND1 3.24Å; Y173-H180 AromaticContact CE1-NE2 3.93Å; Y173-H180 HydrophobicContact CE2-CB 4.48Å; Y173-H180 AromaticContact CE2-CD2 3.26Å; Y173-H180 WeakPolarHBondContact CE2-CD2 3.48Å; Y173-H180 AromaticContact CE2-CG 3.71Å; Y173-H180 AromaticContact CE2-NE2 3.52Å; Y173-H180 HydrophobicContact CG-CB 4.02Å; Y173-H180 AromaticContact CZ-CD2 3.36Å; Y173-H180 AromaticContact CZ-CE1 3.28Å; Y173-H180 AromaticContact CZ-CG 3.51Å; Y173-H180 AromaticContact CZ-ND1 3.48Å; Y173-H180 AromaticContact CZ-NE2 3.24Å; Y173-H180 PolarHBondContact OH-CE1 3.33Å; Y173-H180 PolarHBondContact OH-NE2 2.8Å; Y173-H180 VanDerWaalsContact OH-NE2 3.16Å; D177-H180 PolarHBondContact O-N 2.79Å; T178-H180 PolarHBondContact O-N 2.96Å; H180-V182 PolarHBondContact O-N 3.37Å; H180-D183 IonicContact CG-OD2 3.04Å; H180-D183 IonicContact ND1-OD2 3.89Å; H180-D183 PolarHBondContact ND1-OD2 3.4Å; H180-D183 VanDerWaalsContact ND1-OD2 3.09Å; H180-D183 WeakPolarHBondContact O-CB 3.18Å; H180-D183 PolarHBondContact O-N 3.43Å; H180-D183 VanDerWaalsContact O-N 3.08Å; H180-F184 PolarHBondContact O-N 2.75Å |
| 181 | G | 89.8 | Confident | 92 | Very high | 26 Ų | 26 | 56 Ų | 56 | 27% | 0.268 | 31% | 0.305 | S | S | . | . | H | α-helix | trans | -59.9 | -29.1 | 174.2 | 0 | 0 | 0 | 0 | 0 | 113.4 | F174 T178 K179 F184 G185 | F174-G181 VanDerWaalsContact CD2-N 3.34Å; T178-G181 PolarHBondContact O-N 3.03Å; K179-G181 VanDerWaalsContact C-N 3.26Å; K179-G181 PolarHBondContact O-N 2.78Å; G181-F184 PolarHBondContact O-N 2.93Å; G181-G185 PolarHBondContact O-N 2.69Å |
| 182 | V | 92.9 | Very high | 91.9 | Very high | 82 Ų | 82 | 58.1 Ų | 58.1 | 50% | 0.497 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -64.6 | -43.6 | 174 | 178.2 | 0 | 0 | 0 | 0 | 111 | H180 F184 G185 L186 | H180-V182 PolarHBondContact O-N 3.37Å; V182-F184 VanDerWaalsContact C-N 3.33Å; V182-F184 PolarHBondContact O-N 3.21Å; V182-G185 PolarHBondContact O-N 2.8Å; V182-L186 HydrophobicContact CG1-CD1 3.89Å; V182-L186 HydrophobicContact CG1-CG 4.34Å; V182-L186 WeakPolarHBondContact O-CB 3.32Å; V182-L186 WeakPolarHBondContact O-CG 3.33Å; V182-L186 PolarHBondContact O-N 3.48Å |
| 183 | D | 93 | Very high | 91.8 | Very high | 6 Ų | 6 | 60.9 Ų | 60.9 | 3% | 0.032 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -63.7 | -40.8 | 178.3 | -70.5 | -67.3 | 0 | 0 | 0 | 111.4 | H180 S187 F241 W242 G243 | H180-D183 IonicContact CG-OD2 3.04Å; H180-D183 IonicContact ND1-OD2 3.89Å; H180-D183 PolarHBondContact ND1-OD2 3.4Å; H180-D183 VanDerWaalsContact ND1-OD2 3.09Å; H180-D183 WeakPolarHBondContact O-CB 3.18Å; H180-D183 PolarHBondContact O-N 3.43Å; H180-D183 VanDerWaalsContact O-N 3.08Å; D183-S187 WeakPolarHBondContact O-CB 3.34Å; D183-S187 PolarHBondContact O-N 2.89Å; D183-S187 PolarHBondContact O-OG 2.77Å; D183-F241 WeakPolarHBondContact OD1-CA 3.36Å; D183-F241 PolarHBondContact OD1-N 3.34Å; D183-F241 VanDerWaalsContact OD1-N 3.09Å; D183-W242 PolarHBondContact OD1-N 2.84Å; D183-G243 WeakPolarHBondContact O-CA 2.99Å; D183-G243 PolarHBondContact OD1-N 2.95Å |
| 184 | F | 94.7 | Very high | 91.7 | Very high | 51 Ų | 51 | 62.2 Ų | 62.2 | 22% | 0.224 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -63.1 | -49.9 | 174 | 177.7 | -119.2 | 0 | 0 | 0 | 112.1 | L167 L171 F174 H180 G181 V182 L186 S187 I188 | L167-F184 HydrophobicContact CD1-CD2 3.9Å; L167-F184 HydrophobicContact CD1-CE2 3.5Å; L167-F184 VanDerWaalsContact CD1-CE2 3.5Å; L167-F184 HydrophobicContact CD1-CZ 4.43Å; L167-F184 HydrophobicContact CG-CE2 4.48Å; L171-F184 HydrophobicContact CB-CD2 3.85Å; L171-F184 HydrophobicContact CB-CE2 3.7Å; L171-F184 HydrophobicContact CD1-CD2 4.22Å; L171-F184 HydrophobicContact CD1-CE1 4.43Å; L171-F184 HydrophobicContact CD1-CE2 3.76Å; L171-F184 HydrophobicContact CD1-CZ 3.87Å; L171-F184 HydrophobicContact CG-CE2 4.21Å; F174-F184 HydrophobicContact CB-CB 3.98Å; F174-F184 HydrophobicContact CD1-CD1 4.18Å; F174-F184 HydrophobicContact CD1-CG 4.5Å; F174-F184 HydrophobicContact CG-CB 4.34Å; H180-F184 PolarHBondContact O-N 2.75Å; G181-F184 PolarHBondContact O-N 2.93Å; V182-F184 VanDerWaalsContact C-N 3.33Å; V182-F184 PolarHBondContact O-N 3.21Å; F184-L186 PolarHBondContact O-N 3.02Å; F184-S187 PolarHBondContact O-N 3.2Å; F184-S187 VanDerWaalsContact O-N 3.16Å; F184-S187 PolarHBondContact O-OG 3.21Å; F184-I188 HydrophobicContact CD1-CD1 4.41Å; F184-I188 HydrophobicContact CE1-CD1 3.9Å; F184-I188 HydrophobicContact CE2-CD1 4.2Å; F184-I188 HydrophobicContact CE2-CG1 4.4Å; F184-I188 HydrophobicContact CZ-CD1 3.78Å; F184-I188 HydrophobicContact CZ-CG1 4.45Å; F184-I188 PolarHBondContact O-N 2.91Å |
| 185 | G | 93.6 | Very high | 91.4 | Very high | 38 Ų | 38 | 60.6 Ų | 60.6 | 39% | 0.392 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -59.7 | -43.1 | 178.4 | 0 | 0 | 0 | 0 | 0 | 113.2 | G181 V182 I188 L189 | G181-G185 PolarHBondContact O-N 2.69Å; V182-G185 PolarHBondContact O-N 2.8Å; G185-I188 PolarHBondContact O-N 2.97Å; G185-L189 PolarHBondContact O-N 3.35Å; G185-L189 VanDerWaalsContact O-N 3.15Å |
| 186 | L | 94.5 | Very high | 91.2 | Very high | 43 Ų | 43 | 57.6 Ų | 57.6 | 23% | 0.225 | 32% | 0.321 | C | S | . | . | H | α-helix | trans | -66.5 | -36.1 | 176.1 | -74.1 | 175.9 | 0 | 0 | 0 | 112.3 | V182 F184 I188 L189 W190 F241 | V182-L186 HydrophobicContact CG1-CD1 3.89Å; V182-L186 HydrophobicContact CG1-CG 4.34Å; V182-L186 WeakPolarHBondContact O-CB 3.32Å; V182-L186 WeakPolarHBondContact O-CG 3.33Å; V182-L186 PolarHBondContact O-N 3.48Å; F184-L186 PolarHBondContact O-N 3.02Å; L186-I188 VanDerWaalsContact C-N 3.3Å; L186-I188 PolarHBondContact O-N 2.86Å; L186-L189 HydrophobicContact CD2-CD2 4.11Å; L186-L189 WeakPolarHBondContact O-CB 3.37Å; L186-L189 PolarHBondContact O-N 3.34Å; L186-W190 HydrophobicContact CD2-CZ2 4.45Å; L186-W190 PolarHBondContact O-N 3.47Å; L186-F241 WeakPolarHBondContact CD1-O 3.31Å |
| 187 | S | 95.4 | Very high | 91.1 | Very high | 0 Ų | 0 | 56.4 Ų | 56.4 | 0% | 0 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -63.2 | -35.6 | 176.5 | 74.1 | 0 | 0 | 0 | 0 | 112.8 | L167 D183 F184 L191 G243 | L167-S187 WeakPolarHBondContact CD1-OG 3.3Å; D183-S187 WeakPolarHBondContact O-CB 3.34Å; D183-S187 PolarHBondContact O-N 2.89Å; D183-S187 PolarHBondContact O-OG 2.77Å; F184-S187 PolarHBondContact O-N 3.2Å; F184-S187 VanDerWaalsContact O-N 3.16Å; F184-S187 PolarHBondContact O-OG 3.21Å; S187-L191 WeakPolarHBondContact O-CB 3.49Å; S187-L191 PolarHBondContact O-N 3.46Å; S187-G243 WeakPolarHBondContact CB-O 3.35Å |
| 188 | I | 95.3 | Very high | 91.1 | Very high | 71 Ų | 71 | 54.8 Ų | 54.8 | 36% | 0.364 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -64.8 | -48.3 | 171.9 | -61.6 | 169 | 0 | 0 | 0 | 110 | L167 F184 G185 L186 W190 L191 V192 | L167-I188 HydrophobicContact CD1-CB 4.39Å; L167-I188 HydrophobicContact CD1-CD1 4.34Å; L167-I188 HydrophobicContact CD1-CG1 3.34Å; F184-I188 HydrophobicContact CD1-CD1 4.41Å; F184-I188 HydrophobicContact CE1-CD1 3.9Å; F184-I188 HydrophobicContact CE2-CD1 4.2Å; F184-I188 HydrophobicContact CE2-CG1 4.4Å; F184-I188 HydrophobicContact CZ-CD1 3.78Å; F184-I188 HydrophobicContact CZ-CG1 4.45Å; F184-I188 PolarHBondContact O-N 2.91Å; G185-I188 PolarHBondContact O-N 2.97Å; L186-I188 VanDerWaalsContact C-N 3.3Å; L186-I188 PolarHBondContact O-N 2.86Å; I188-W190 VanDerWaalsContact C-N 3.31Å; I188-W190 PolarHBondContact O-N 3.43Å; I188-L191 PolarHBondContact O-N 3.07Å; I188-V192 HydrophobicContact CG2-CG2 4.41Å; I188-V192 WeakPolarHBondContact O-CG2 3.37Å; I188-V192 PolarHBondContact O-N 3.21Å |
| 189 | L | 94.5 | Very high | 90.9 | Very high | 87 Ų | 87 | 51 Ų | 51 | 46% | 0.455 | 28% | 0.284 | S | S | . | . | H | α-helix | trans | -57.1 | -45.6 | 178 | 178 | 65.8 | 0 | 0 | 0 | 111 | G185 L186 V192 L193 | G185-L189 PolarHBondContact O-N 3.35Å; G185-L189 VanDerWaalsContact O-N 3.15Å; L186-L189 HydrophobicContact CD2-CD2 4.11Å; L186-L189 WeakPolarHBondContact O-CB 3.37Å; L186-L189 PolarHBondContact O-N 3.34Å; L189-V192 PolarHBondContact O-N 3.49Å; L189-L193 WeakPolarHBondContact O-CB 3.36Å; L189-L193 PolarHBondContact O-N 3.35Å |
| 190 | W | 93 | Very high | 90.6 | Very high | 36 Ų | 36 | 47.8 Ų | 47.8 | 14% | 0.136 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -64.7 | -41.7 | 178.3 | -61.8 | 142.6 | 0 | 0 | 0 | 112.8 | L163 L186 I188 L193 F194 W242 | L163-W190 HydrophobicContact CD2-CB 4.46Å; L186-W190 HydrophobicContact CD2-CZ2 4.45Å; L186-W190 PolarHBondContact O-N 3.47Å; I188-W190 VanDerWaalsContact C-N 3.31Å; I188-W190 PolarHBondContact O-N 3.43Å; W190-L193 HydrophobicContact CE3-CD2 4.43Å; W190-L193 HydrophobicContact CZ3-CD2 4.23Å; W190-F194 HydrophobicContact CB-CD2 3.85Å; W190-F194 HydrophobicContact CB-CE2 4.1Å; W190-F194 HydrophobicContact CD2-CD2 4.21Å; W190-F194 AromaticContact CD2-CE2 3.57Å; W190-F194 HydrophobicContact CD2-CE2 3.57Å; W190-F194 HydrophobicContact CD2-CZ 4.12Å; W190-F194 AromaticContact CE3-CD2 3.88Å; W190-F194 HydrophobicContact CE3-CD2 3.88Å; W190-F194 HydrophobicContact CE3-CE1 4.1Å; W190-F194 AromaticContact CE3-CE2 3.19Å; W190-F194 HydrophobicContact CE3-CE2 3.19Å; W190-F194 AromaticContact CE3-CZ 3.33Å; W190-F194 HydrophobicContact CE3-CZ 3.33Å; W190-F194 HydrophobicContact CG-CD2 4.23Å; W190-F194 AromaticContact CG-CE2 3.95Å; W190-F194 HydrophobicContact CG-CE2 3.95Å; W190-F194 HydrophobicContact CH2-CZ 4.39Å; W190-F194 HydrophobicContact CZ3-CE1 4.21Å; W190-F194 AromaticContact CZ3-CE2 3.86Å; W190-F194 HydrophobicContact CZ3-CE2 3.86Å; W190-F194 AromaticContact CZ3-CZ 3.5Å; W190-F194 HydrophobicContact CZ3-CZ 3.5Å; W190-F194 VanDerWaalsContact CZ3-CZ 3.5Å; W190-F194 VanDerWaalsContact O-CB 3.23Å; W190-F194 WeakPolarHBondContact O-CB 3.46Å; W190-F194 PolarHBondContact O-N 2.87Å; W190-W242 AromaticContact CZ2-NE1 3.89Å; W190-W242 PolarHBondContact NE1-O 3.23Å |
| 191 | L | 92.8 | Very high | 90.2 | Very high | 35 Ų | 35 | 48.6 Ų | 48.6 | 18% | 0.183 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -58.4 | -50.4 | 174.6 | -176.9 | 75.1 | 0 | 0 | 0 | 111 | L163 F164 L167 S187 I188 T195 | L163-L191 HydrophobicContact CB-CD1 3.66Å; F164-L191 HydrophobicContact CB-CD1 4.08Å; L167-L191 HydrophobicContact CD2-CD2 3.87Å; S187-L191 WeakPolarHBondContact O-CB 3.49Å; S187-L191 PolarHBondContact O-N 3.46Å; I188-L191 PolarHBondContact O-N 3.07Å; L191-T195 WeakPolarHBondContact O-CB 3.31Å; L191-T195 PolarHBondContact O-N 3.21Å; L191-T195 PolarHBondContact O-OG1 3.42Å |
| 192 | V | 92.3 | Very high | 90 | Very high | 100 Ų | 100 | 47.5 Ų | 47.5 | 61% | 0.606 | 27% | 0.27 | S | S | * | . | H | α-helix | trans | -73.1 | -34.5 | -175 | 174.4 | 0 | 0 | 0 | 0 | 112.2 | I188 L189 P196 | I188-V192 HydrophobicContact CG2-CG2 4.41Å; I188-V192 WeakPolarHBondContact O-CG2 3.37Å; I188-V192 PolarHBondContact O-N 3.21Å; L189-V192 PolarHBondContact O-N 3.49Å; V192-P196 WeakPolarHBondContact O-CD 3.08Å; V192-P196 WeakPolarHBondContact O-CG 3.05Å |
| 193 | L | 90.5 | Very high | 89.5 | Confident | 84 Ų | 84 | 43.7 Ų | 43.7 | 44% | 0.44 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -82.6 | -52.3 | -178.9 | -176.7 | 64.7 | 0 | 0 | 0 | 111.7 | L189 W190 P196 C197 | L189-L193 WeakPolarHBondContact O-CB 3.36Å; L189-L193 PolarHBondContact O-N 3.35Å; W190-L193 HydrophobicContact CE3-CD2 4.43Å; W190-L193 HydrophobicContact CZ3-CD2 4.23Å; L193-P196 WeakPolarHBondContact O-CD 3.04Å; L193-C197 WeakPolarHBondContact O-CB 3.36Å; L193-C197 PolarHBondContact O-N 2.89Å; L193-C197 VanDerWaalsContact O-N 3.16Å |
| 194 | F | 90.1 | Very high | 89 | Confident | 42 Ų | 42 | 49.2 Ų | 49.2 | 18% | 0.184 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -77.4 | -27.6 | -171.1 | -65.8 | -35.5 | 0 | 0 | 0 | 113.7 | Y159 L163 W190 S198 V231 | Y159-F194 HydrophobicContact CE1-CB 4.11Å; L163-F194 HydrophobicContact CD1-CB 3.93Å; W190-F194 HydrophobicContact CB-CD2 3.85Å; W190-F194 HydrophobicContact CB-CE2 4.1Å; W190-F194 HydrophobicContact CD2-CD2 4.21Å; W190-F194 AromaticContact CD2-CE2 3.57Å; W190-F194 HydrophobicContact CD2-CE2 3.57Å; W190-F194 HydrophobicContact CD2-CZ 4.12Å; W190-F194 AromaticContact CE3-CD2 3.88Å; W190-F194 HydrophobicContact CE3-CD2 3.88Å; W190-F194 HydrophobicContact CE3-CE1 4.1Å; W190-F194 AromaticContact CE3-CE2 3.19Å; W190-F194 HydrophobicContact CE3-CE2 3.19Å; W190-F194 AromaticContact CE3-CZ 3.33Å; W190-F194 HydrophobicContact CE3-CZ 3.33Å; W190-F194 HydrophobicContact CG-CD2 4.23Å; W190-F194 AromaticContact CG-CE2 3.95Å; W190-F194 HydrophobicContact CG-CE2 3.95Å; W190-F194 HydrophobicContact CH2-CZ 4.39Å; W190-F194 HydrophobicContact CZ3-CE1 4.21Å; W190-F194 AromaticContact CZ3-CE2 3.86Å; W190-F194 HydrophobicContact CZ3-CE2 3.86Å; W190-F194 AromaticContact CZ3-CZ 3.5Å; W190-F194 HydrophobicContact CZ3-CZ 3.5Å; W190-F194 VanDerWaalsContact CZ3-CZ 3.5Å; W190-F194 VanDerWaalsContact O-CB 3.23Å; W190-F194 WeakPolarHBondContact O-CB 3.46Å; W190-F194 PolarHBondContact O-N 2.87Å; F194-S198 WeakPolarHBondContact O-CB 3.46Å; F194-S198 PolarHBondContact O-N 3.49Å; F194-S198 PolarHBondContact O-OG 3.01Å; F194-V231 HydrophobicContact CE2-CG1 4.11Å; F194-V231 HydrophobicContact CZ-CG1 4.2Å |
| 195 | T | 87.6 | Confident | 88.4 | Confident | 33 Ų | 33 | 47.4 Ų | 47.4 | 20% | 0.202 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -62.2 | -54.8 | 177.2 | -57.3 | 0 | 0 | 0 | 0 | 112.7 | W156 L191 S198 F199 | W156-T195 HydrophobicContact CZ2-CG2 4.33Å; W156-T195 PolarHBondContact NE1-O 3.21Å; L191-T195 WeakPolarHBondContact O-CB 3.31Å; L191-T195 PolarHBondContact O-N 3.21Å; L191-T195 PolarHBondContact O-OG1 3.42Å; T195-S198 PolarHBondContact O-OG 3.43Å; T195-F199 PolarHBondContact O-N 3.24Å |
| 196 | P | 86.4 | Confident | 87.8 | Confident | 65 Ų | 65 | 45.7 Ų | 45.7 | 42% | 0.422 | 24% | 0.242 | S | C | . | . | H | α-helix | trans | -72.8 | -35.4 | 176.2 | 28.9 | -34.9 | 0 | 0 | 0 | 112.6 | V192 L193 F199 L200 | V192-P196 WeakPolarHBondContact O-CD 3.08Å; V192-P196 WeakPolarHBondContact O-CG 3.05Å; L193-P196 WeakPolarHBondContact O-CD 3.04Å; P196-F199 PolarHBondContact O-N 3.2Å; P196-L200 WeakPolarHBondContact O-CG 3.41Å; P196-L200 PolarHBondContact O-N 3.41Å |
| 197 | C | 86.3 | Confident | 87.1 | Confident | 53 Ų | 53 | 44.4 Ų | 44.4 | 36% | 0.358 | 23% | 0.234 | S | C | . | . | H | α-helix | trans | -62.6 | -46.4 | 178.2 | -179.7 | 0 | 0 | 0 | 0 | 111.5 | L193 F199 L200 C201 | L193-C197 WeakPolarHBondContact O-CB 3.36Å; L193-C197 PolarHBondContact O-N 2.89Å; L193-C197 VanDerWaalsContact O-N 3.16Å; C197-F199 VanDerWaalsContact C-N 3.3Å; C197-F199 PolarHBondContact O-N 2.9Å; C197-L200 PolarHBondContact O-N 3.48Å; C197-C201 WeakPolarHBondContact O-CA 3.37Å; C197-C201 WeakPolarHBondContact O-CB 3.38Å; C197-C201 PolarHBondContact O-N 3.4Å; C197-C201 PolarHBondContact O-SG 3.28Å |
| 198 | S | 86.5 | Confident | 86.2 | Confident | 7 Ų | 7 | 50 Ų | 50 | 5% | 0.049 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -60.3 | -40 | 177 | 55.9 | 0 | 0 | 0 | 0 | 112.6 | W156 F194 T195 W202 Y203 | W156-S198 PolarHBondContact NE1-OG 2.81Å; F194-S198 WeakPolarHBondContact O-CB 3.46Å; F194-S198 PolarHBondContact O-N 3.49Å; F194-S198 PolarHBondContact O-OG 3.01Å; T195-S198 PolarHBondContact O-OG 3.43Å; S198-W202 VanDerWaalsContact CB-NE1 3.25Å; S198-W202 PolarHBondContact O-N 3.45Å; S198-W202 PolarHBondContact O-NE1 3.25Å; S198-Y203 PolarHBondContact O-N 2.9Å |
| 199 | F | 83.6 | Confident | 85.5 | Confident | 31 Ų | 31 | 46.6 Ų | 46.6 | 14% | 0.136 | 24% | 0.241 | C | C | . | . | I | π-helix | trans | -62.3 | -46.7 | 176.3 | -175 | -102 | 0 | 0 | 0 | 112.3 | W156 T195 P196 C197 Y203 R204 | W156-F199 HydrophobicContact CD2-CD2 4.15Å; W156-F199 AromaticContact CE2-CD2 3.85Å; W156-F199 HydrophobicContact CE3-CD2 4.46Å; W156-F199 HydrophobicContact CH2-CD2 4.22Å; W156-F199 HydrophobicContact CZ2-CB 4.07Å; W156-F199 AromaticContact CZ2-CD2 3.89Å; W156-F199 HydrophobicContact CZ2-CD2 3.89Å; W156-F199 HydrophobicContact CZ2-CG 4.26Å; W156-F199 HydrophobicContact CZ3-CD2 4.5Å; T195-F199 PolarHBondContact O-N 3.24Å; P196-F199 PolarHBondContact O-N 3.2Å; C197-F199 VanDerWaalsContact C-N 3.3Å; C197-F199 PolarHBondContact O-N 2.9Å; F199-Y203 AromaticContact CD2-CD1 3.57Å; F199-Y203 HydrophobicContact CD2-CD1 3.57Å; F199-Y203 HydrophobicContact CD2-CE1 4.26Å; F199-Y203 HydrophobicContact CD2-CG 4.24Å; F199-Y203 AromaticContact CE2-CD1 3.29Å; F199-Y203 HydrophobicContact CE2-CD1 3.29Å; F199-Y203 AromaticContact CE2-CE1 3.55Å; F199-Y203 HydrophobicContact CE2-CE1 3.55Å; F199-Y203 HydrophobicContact CE2-CG 4.33Å; F199-Y203 HydrophobicContact CG-CD1 4.46Å; F199-Y203 AromaticContact CZ-CD1 4Å; F199-Y203 HydrophobicContact CZ-CD1 4Å; F199-Y203 HydrophobicContact CZ-CE1 4.14Å; F199-Y203 WeakPolarHBondContact O-CB 3.47Å; F199-R204 HydrophobicContact CE1-CG 4.24Å; F199-R204 PolarHBondContact O-N 3.28Å |
| 200 | L | 81.4 | Confident | 84.6 | Confident | 90 Ų | 90 | 42.7 Ų | 42.7 | 47% | 0.471 | 22% | 0.221 | S | C | . | . | I | π-helix | trans | -78.4 | -37.7 | -176.3 | -66.2 | 176.3 | 0 | 0 | 0 | 113 | P196 C197 P205 | P196-L200 WeakPolarHBondContact O-CG 3.41Å; P196-L200 PolarHBondContact O-N 3.41Å; C197-L200 PolarHBondContact O-N 3.48Å; L200-P205 VanDerWaalsContact O-CD 3.22Å; L200-P205 WeakPolarHBondContact O-CD 3.36Å |
| 201 | C | 80.7 | Confident | 83.8 | Confident | 41 Ų | 41 | 46.9 Ų | 46.9 | 28% | 0.277 | 24% | 0.236 | S | C | . | . | I | π-helix | trans | -91 | -21.5 | -167.7 | -60.7 | 0 | 0 | 0 | 0 | 113.4 | C197 P205 F220 V224 | C197-C201 WeakPolarHBondContact O-CA 3.37Å; C197-C201 WeakPolarHBondContact O-CB 3.38Å; C197-C201 PolarHBondContact O-N 3.4Å; C197-C201 PolarHBondContact O-SG 3.28Å; C201-P205 WeakPolarHBondContact O-CG 3.41Å; C201-F220 VanDerWaalsContact O-CE1 3.3Å; C201-F220 WeakPolarHBondContact O-CE1 3.49Å; C201-V224 HydrophobicContact CB-CG1 3.73Å; C201-V224 WeakPolarHBondContact O-CG1 3.18Å |
| 202 | W | 84.6 | Confident | 82.6 | Confident | 2 Ų | 2 | 48.9 Ų | 48.9 | 1% | 0.008 | 25% | 0.253 | C | S | . | . | I | π-helix | trans | -132.4 | -37.3 | 173.1 | 65.4 | -103.4 | 0 | 0 | 0 | 114.7 | M152 L155 W156 S198 V206 F221 V224 F225 H228 | M152-W202 HydrophobicContact CG-CE3 4.07Å; M152-W202 HydrophobicContact CG-CZ3 3.5Å; M152-W202 VanDerWaalsContact CG-CZ3 3.5Å; M152-W202 WeakPolarHBondContact O-CH2 3.45Å; M152-W202 HydrophobicContact SD-CE3 3.68Å; M152-W202 HydrophobicContact SD-CH2 3.97Å; M152-W202 HydrophobicContact SD-CZ3 3.18Å; M152-W202 WeakPolarHBondContact SD-CZ3 3.37Å; L155-W202 HydrophobicContact CD2-CH2 4.12Å; W156-W202 HydrophobicContact CB-CH2 3.58Å; W156-W202 HydrophobicContact CB-CZ2 3.94Å; W156-W202 HydrophobicContact CB-CZ3 4.41Å; S198-W202 VanDerWaalsContact CB-NE1 3.25Å; S198-W202 PolarHBondContact O-N 3.45Å; S198-W202 PolarHBondContact O-NE1 3.25Å; W202-V206 WeakPolarHBondContact O-CB 3.13Å; W202-V206 PolarHBondContact O-N 3.24Å; W202-F221 HydrophobicContact CB-CD2 4.07Å; W202-F221 HydrophobicContact CB-CE2 4.35Å; W202-F221 HydrophobicContact CE3-CE2 4.28Å; W202-V224 HydrophobicContact CB-CG1 4.13Å; W202-F225 HydrophobicContact CB-CB 4.38Å; W202-F225 HydrophobicContact CB-CD2 4.2Å; W202-F225 AromaticContact CD2-CD2 3.63Å; W202-F225 HydrophobicContact CD2-CD2 3.63Å; W202-F225 AromaticContact CD2-CE2 3.9Å; W202-F225 HydrophobicContact CD2-CE2 3.9Å; W202-F225 AromaticContact CE3-CD2 3.86Å; W202-F225 HydrophobicContact CE3-CD2 3.86Å; W202-F225 AromaticContact CE3-CE2 3.88Å; W202-F225 HydrophobicContact CE3-CE2 3.88Å; W202-F225 AromaticContact CG-CD2 3.82Å; W202-F225 HydrophobicContact CG-CD2 3.82Å; W202-F225 HydrophobicContact CH2-CE2 4.08Å; W202-F225 HydrophobicContact CZ2-CE2 4.1Å; W202-F225 HydrophobicContact CZ3-CD2 4.46Å; W202-F225 HydrophobicContact CZ3-CE2 4.02Å; W202-H228 AromaticContact NE1-CG 3.8Å; W202-H228 AromaticContact NE1-ND1 3.92Å |
| 203 | Y | 83.6 | Confident | 81.4 | Confident | 3 Ų | 3 | 46.7 Ų | 46.7 | 1% | 0.012 | 24% | 0.238 | C | C | . | . | I | π-helix | trans | -67.7 | -44.8 | 179.2 | 176.2 | -100.1 | 0 | 0 | 0 | 112.1 | Q135 F137 Y153 S198 F199 V206 Y207 | Q135-Y203 PolarHBondContact OE1-OH 3.23Å; F137-Y203 WeakPolarHBondContact CZ-OH 3.29Å; Y153-Y203 HydrophobicContact CD2-CE2 4.08Å; Y153-Y203 AromaticContact CD2-CZ 3.93Å; Y153-Y203 HydrophobicContact CG-CE2 4.35Å; S198-Y203 PolarHBondContact O-N 2.9Å; F199-Y203 AromaticContact CD2-CD1 3.57Å; F199-Y203 HydrophobicContact CD2-CD1 3.57Å; F199-Y203 HydrophobicContact CD2-CE1 4.26Å; F199-Y203 HydrophobicContact CD2-CG 4.24Å; F199-Y203 AromaticContact CE2-CD1 3.29Å; F199-Y203 HydrophobicContact CE2-CD1 3.29Å; F199-Y203 AromaticContact CE2-CE1 3.55Å; F199-Y203 HydrophobicContact CE2-CE1 3.55Å; F199-Y203 HydrophobicContact CE2-CG 4.33Å; F199-Y203 HydrophobicContact CG-CD1 4.46Å; F199-Y203 AromaticContact CZ-CD1 4Å; F199-Y203 HydrophobicContact CZ-CD1 4Å; F199-Y203 HydrophobicContact CZ-CE1 4.14Å; F199-Y203 WeakPolarHBondContact O-CB 3.47Å; Y203-V206 WeakPolarHBondContact O-CG1 3.5Å; Y203-V206 PolarHBondContact O-N 2.95Å; Y203-Y207 VanDerWaalsContact O-CB 3.3Å; Y203-Y207 WeakPolarHBondContact O-CB 3.3Å; Y203-Y207 PolarHBondContact O-N 2.94Å |
| 204 | R | 80.8 | Confident | 80.5 | Confident | 122 Ų | 122 | 43.7 Ų | 43.7 | 46% | 0.46 | 23% | 0.225 | S | C | . | . | H | α-helix | trans | -63.4 | -48.3 | 176 | -88.8 | -160.4 | 174.2 | 177.8 | -0.3 | 113.8 | F199 V206 Y207 K208 | F199-R204 HydrophobicContact CE1-CG 4.24Å; F199-R204 PolarHBondContact O-N 3.28Å; R204-V206 VanDerWaalsContact C-N 3.32Å; R204-V206 PolarHBondContact O-N 3.43Å; R204-Y207 WeakPolarHBondContact O-CB 3.44Å; R204-Y207 PolarHBondContact O-N 2.85Å; R204-K208 WeakPolarHBondContact O-CB 2.92Å; R204-K208 PolarHBondContact O-N 3.03Å |
| 205 | P | 82.3 | Confident | 79.7 | Confident | 13 Ų | 13 | 41.7 Ų | 41.7 | 8% | 0.084 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -58.1 | -42.8 | 175.9 | -29.8 | 36.1 | 0 | 0 | 0 | 112.8 | L200 C201 K208 A209 F220 F221 | L200-P205 VanDerWaalsContact O-CD 3.22Å; L200-P205 WeakPolarHBondContact O-CD 3.36Å; C201-P205 WeakPolarHBondContact O-CG 3.41Å; P205-K208 PolarHBondContact O-N 3.23Å; P205-A209 VanDerWaalsContact O-CB 3.28Å; P205-A209 WeakPolarHBondContact O-CB 3.47Å; P205-A209 PolarHBondContact O-N 3.31Å; P205-F220 HydrophobicContact CB-CD1 3.78Å; P205-F220 HydrophobicContact CB-CE1 4.36Å; P205-F220 HydrophobicContact CG-CD1 3.57Å; P205-F220 HydrophobicContact CG-CE1 3.63Å; P205-F221 HydrophobicContact CB-CB 4.46Å |
| 206 | V | 81.8 | Confident | 79.1 | Confident | 1 Ų | 1 | 44.8 Ų | 44.8 | 1% | 0.006 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -67.8 | -39.3 | 179.5 | 90 | 0 | 0 | 0 | 0 | 111.6 | M152 W202 Y203 R204 K208 A209 F210 F221 | M152-V206 HydrophobicContact CG-CG1 3.69Å; W202-V206 WeakPolarHBondContact O-CB 3.13Å; W202-V206 PolarHBondContact O-N 3.24Å; Y203-V206 WeakPolarHBondContact O-CG1 3.5Å; Y203-V206 PolarHBondContact O-N 2.95Å; R204-V206 VanDerWaalsContact C-N 3.32Å; R204-V206 PolarHBondContact O-N 3.43Å; V206-K208 VanDerWaalsContact C-N 3.34Å; V206-K208 PolarHBondContact O-N 3.45Å; V206-A209 WeakPolarHBondContact O-CB 3.46Å; V206-A209 PolarHBondContact O-N 2.96Å; V206-F210 HydrophobicContact CG2-CD2 3.86Å; V206-F210 HydrophobicContact CG2-CE2 3.42Å; V206-F210 VanDerWaalsContact CG2-CE2 3.42Å; V206-F210 HydrophobicContact CG2-CZ 4.25Å; V206-F210 WeakPolarHBondContact O-CD2 3.34Å; V206-F210 PolarHBondContact O-N 3.31Å; V206-F221 HydrophobicContact CB-CB 4.43Å; V206-F221 HydrophobicContact CB-CD2 3.45Å; V206-F221 VanDerWaalsContact CB-CD2 3.45Å; V206-F221 HydrophobicContact CB-CE2 3.79Å; V206-F221 HydrophobicContact CB-CG 3.9Å; V206-F221 HydrophobicContact CG1-CD2 4.4Å; V206-F221 HydrophobicContact CG1-CE2 4.37Å; V206-F221 HydrophobicContact CG2-CB 4.45Å; V206-F221 HydrophobicContact CG2-CD1 3.91Å; V206-F221 HydrophobicContact CG2-CD2 3.55Å; V206-F221 HydrophobicContact CG2-CE1 4.03Å; V206-F221 HydrophobicContact CG2-CE2 3.65Å; V206-F221 HydrophobicContact CG2-CG 3.67Å; V206-F221 HydrophobicContact CG2-CZ 3.91Å |
| 207 | Y | 79.8 | Confident | 78.9 | Confident | 16 Ų | 16 | 42.7 Ų | 42.7 | 6% | 0.063 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -58.3 | -47.6 | 174.2 | -173.3 | -99 | 0 | 0 | 0 | 111.6 | F133 Q135 E140 I141 Y203 R204 F210 R211 | F133-Y207 HydrophobicContact CE1-CE1 4.34Å; F133-Y207 HydrophobicContact CZ-CD1 4.43Å; F133-Y207 AromaticContact CZ-CE1 3.91Å; F133-Y207 HydrophobicContact CZ-CE1 3.91Å; Q135-Y207 PolarHBondContact NE2-OH 3.49Å; E140-Y207 WeakPolarHBondContact CB-OH 3.35Å; E140-Y207 PolarHBondContact OE2-OH 2.77Å; I141-Y207 HydrophobicContact CD1-CD2 3.82Å; I141-Y207 HydrophobicContact CD1-CE2 3.56Å; I141-Y207 HydrophobicContact CG1-CE2 4.09Å; Y203-Y207 VanDerWaalsContact O-CB 3.3Å; Y203-Y207 WeakPolarHBondContact O-CB 3.3Å; Y203-Y207 PolarHBondContact O-N 2.94Å; R204-Y207 WeakPolarHBondContact O-CB 3.44Å; R204-Y207 PolarHBondContact O-N 2.85Å; Y207-F210 PolarHBondContact O-N 2.84Å; Y207-R211 WeakPolarHBondContact O-CB 3.22Å; Y207-R211 PolarHBondContact O-N 3.03Å |
| 208 | K | 77.2 | Confident | 78.7 | Confident | 118 Ų | 118 | 40.5 Ų | 40.5 | 51% | 0.513 | 20% | 0.196 | S | C | . | . | H | α-helix | trans | -66.1 | -38.5 | 177.2 | -171.7 | 176.4 | 178.6 | -176.9 | 0 | 112.1 | R204 P205 V206 R211 S212 | R204-K208 WeakPolarHBondContact O-CB 2.92Å; R204-K208 PolarHBondContact O-N 3.03Å; P205-K208 PolarHBondContact O-N 3.23Å; V206-K208 VanDerWaalsContact C-N 3.34Å; V206-K208 PolarHBondContact O-N 3.45Å; K208-R211 PolarHBondContact O-N 3.37Å; K208-S212 PolarHBondContact O-N 3.27Å |
| 209 | A | 79.4 | Confident | 78.7 | Confident | 0 Ų | 0 | 46.4 Ų | 46.4 | 0% | 0 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -59.9 | -47 | 177 | 0 | 0 | 0 | 0 | 0 | 111 | P205 V206 D213 S214 N217 F218 | P205-A209 VanDerWaalsContact O-CB 3.28Å; P205-A209 WeakPolarHBondContact O-CB 3.47Å; P205-A209 PolarHBondContact O-N 3.31Å; V206-A209 WeakPolarHBondContact O-CB 3.46Å; V206-A209 PolarHBondContact O-N 2.96Å; A209-D213 WeakPolarHBondContact O-CA 3.29Å; A209-D213 PolarHBondContact O-N 3.43Å; A209-S214 PolarHBondContact O-N 2.77Å; A209-N217 HydrophobicContact CB-CB 3.73Å; A209-F218 HydrophobicContact CB-CD1 3.96Å; A209-F218 HydrophobicContact CB-CD2 3.8Å; A209-F218 HydrophobicContact CB-CE1 3.99Å; A209-F218 HydrophobicContact CB-CE2 3.85Å; A209-F218 HydrophobicContact CB-CG 3.85Å; A209-F218 HydrophobicContact CB-CZ 3.94Å |
| 210 | F | 76.6 | Confident | 78.8 | Confident | 5 Ų | 5 | 49.2 Ų | 49.2 | 2% | 0.022 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -72.6 | -30.2 | 178.8 | -70.8 | -57.7 | 0 | 0 | 0 | 114.2 | I141 Y145 V148 C149 V206 Y207 F218 V286 M289 | I141-F210 HydrophobicContact CD1-CB 4.26Å; I141-F210 HydrophobicContact CG2-CB 4.38Å; Y145-F210 AromaticContact CD1-CD1 3.61Å; Y145-F210 HydrophobicContact CD1-CD1 3.61Å; Y145-F210 AromaticContact CD1-CE1 3.61Å; Y145-F210 HydrophobicContact CD1-CE1 3.61Å; Y145-F210 HydrophobicContact CD2-CD1 4.35Å; Y145-F210 HydrophobicContact CE1-CD1 4.37Å; Y145-F210 HydrophobicContact CE1-CE1 4.31Å; Y145-F210 AromaticContact CG-CD1 3.6Å; Y145-F210 HydrophobicContact CG-CD1 3.6Å; Y145-F210 HydrophobicContact CG-CE1 4.08Å; Y145-F210 HydrophobicContact CG-CG 4.47Å; V148-F210 HydrophobicContact CG1-CZ 4.3Å; C149-F210 WeakPolarHBondContact SG-CD2 3.4Å; C149-F210 VanDerWaalsContact SG-CG 3.55Å; V206-F210 HydrophobicContact CG2-CD2 3.86Å; V206-F210 HydrophobicContact CG2-CE2 3.42Å; V206-F210 VanDerWaalsContact CG2-CE2 3.42Å; V206-F210 HydrophobicContact CG2-CZ 4.25Å; V206-F210 WeakPolarHBondContact O-CD2 3.34Å; V206-F210 PolarHBondContact O-N 3.31Å; Y207-F210 PolarHBondContact O-N 2.84Å; F210-F218 HydrophobicContact CD1-CE1 4.02Å; F210-F218 AromaticContact CD1-CZ 3.62Å; F210-F218 HydrophobicContact CD1-CZ 3.62Å; F210-F218 AromaticContact CE1-CE1 3.62Å; F210-F218 HydrophobicContact CE1-CE1 3.62Å; F210-F218 AromaticContact CE1-CZ 3.62Å; F210-F218 HydrophobicContact CE1-CZ 3.62Å; F210-F218 HydrophobicContact CG-CZ 4.36Å; F210-F218 AromaticContact CZ-CE1 3.95Å; F210-F218 HydrophobicContact CZ-CE1 3.95Å; F210-F218 HydrophobicContact CZ-CZ 4.39Å; F210-V286 HydrophobicContact CZ-CG1 3.97Å; F210-V286 HydrophobicContact CZ-CG2 4.17Å; F210-M289 HydrophobicContact CE1-CE 3.59Å; F210-M289 HydrophobicContact CZ-CE 3.48Å; F210-M289 VanDerWaalsContact CZ-CE 3.48Å |
| 211 | R | 75.1 | Confident | 79.2 | Confident | 123 Ų | 123 | 45 Ų | 45 | 46% | 0.464 | 21% | 0.211 | S | C | . | . | H | α-helix | trans | -72.2 | -38.5 | 176.4 | -179.2 | 175.2 | 178.4 | 155.5 | 5.3 | 112.9 | E140 Y207 K208 | E140-R211 IonicContact OE1-CZ 2.83Å; E140-R211 IonicContact OE1-NH1 3.54Å; E140-R211 PolarHBondContact OE1-NH1 2.9Å; E140-R211 IonicContact OE1-NH2 2.87Å; E140-R211 PolarHBondContact OE1-NH2 3.21Å; E140-R211 IonicContact OE2-CZ 3.66Å; E140-R211 IonicContact OE2-NH1 3.68Å; E140-R211 PolarHBondContact OE2-NH1 3.33Å; Y207-R211 WeakPolarHBondContact O-CB 3.22Å; Y207-R211 PolarHBondContact O-N 3.03Å; K208-R211 PolarHBondContact O-N 3.37Å |
| 212 | S | 67.9 | Low | 79.7 | Confident | 78 Ų | 78 | 44.7 Ų | 44.7 | 55% | 0.545 | 21% | 0.205 | S | C | . | . | H | α-helix | trans | -114.3 | 8.7 | -171 | -57.6 | 0 | 0 | 0 | 0 | 114.2 | K208 S214 | K208-S212 PolarHBondContact O-N 3.27Å; S212-S214 PolarHBondContact O-N 2.98Å |
| 213 | D | 66.9 | Low | 79.9 | Confident | 53 Ų | 53 | 50.8 Ų | 50.8 | 28% | 0.283 | 23% | 0.232 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 45.4 | 34 | -171.1 | -165.8 | 42 | 0 | 0 | 0 | 113.4 | A209 S215 K299 | A209-D213 WeakPolarHBondContact O-CA 3.29Å; A209-D213 PolarHBondContact O-N 3.43Å; D213-S215 PolarHBondContact O-N 3.27Å; D213-K299 IonicContact OD2-NZ 2.99Å; D213-K299 PolarHBondContact OD2-NZ 3.44Å |
| 214 | S | 71.8 | Confident | 80.3 | Confident | 22 Ų | 22 | 51.9 Ų | 51.9 | 15% | 0.154 | 24% | 0.239 | C | C | . | . | trans | -83.8 | 112 | -170.3 | 177 | 0 | 0 | 0 | 0 | 110.9 | A209 S212 F216 N217 F218 E303 | A209-S214 PolarHBondContact O-N 2.77Å; S212-S214 PolarHBondContact O-N 2.98Å; S214-F216 VanDerWaalsContact C-N 3.26Å; S214-F216 PolarHBondContact O-N 3.34Å; S214-N217 VanDerWaalsContact CB-ND2 3.31Å; S214-N217 WeakPolarHBondContact CB-ND2 3.42Å; S214-N217 PolarHBondContact O-N 2.86Å; S214-N217 VanDerWaalsContact O-N 3.15Å; S214-N217 PolarHBondContact OG-ND2 3.34Å; S214-F218 WeakPolarHBondContact O-CD2 3.47Å; S214-F218 PolarHBondContact O-N 2.86Å; S214-E303 WeakPolarHBondContact CA-OE2 3.35Å | ||
| 215 | S | 73.2 | Confident | 80.9 | Confident | 0 Ų | 0 | 46 Ų | 46 | 0% | 0 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -63.2 | -32.1 | -177.3 | -57.4 | 0 | 0 | 0 | 0 | 112.3 | D213 F218 F219 E303 | D213-S215 PolarHBondContact O-N 3.27Å; S215-F218 WeakPolarHBondContact O-CB 3.3Å; S215-F218 PolarHBondContact O-N 3.34Å; S215-F219 PolarHBondContact O-N 3.38Å; S215-F219 VanDerWaalsContact O-N 3.08Å; S215-E303 PolarHBondContact N-OE2 3.16Å; S215-E303 PolarHBondContact OG-OE1 3.45Å |
| 216 | F | 74.4 | Confident | 81.4 | Confident | 97 Ų | 97 | 51.6 Ų | 51.6 | 43% | 0.425 | 24% | 0.24 | S | C | . | . | H | α-helix | trans | -64.8 | -43 | 174.8 | 177.7 | -99.8 | 0 | 0 | 0 | 112.6 | S214 F218 F219 F220 F304 | S214-F216 VanDerWaalsContact C-N 3.26Å; S214-F216 PolarHBondContact O-N 3.34Å; F216-F218 VanDerWaalsContact C-N 3.3Å; F216-F218 PolarHBondContact O-N 2.94Å; F216-F219 PolarHBondContact O-N 3.34Å; F216-F220 PolarHBondContact O-N 3.44Å; F216-F220 VanDerWaalsContact O-N 3.1Å; F216-F304 HydrophobicContact CD2-CD2 4.09Å; F216-F304 HydrophobicContact CE2-CD2 4.11Å; F216-F304 HydrophobicContact CE2-CE2 4.27Å |
| 217 | N | 82.6 | Confident | 81.9 | Confident | 22 Ų | 22 | 54.2 Ų | 54.2 | 12% | 0.118 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -68.5 | -32 | 177.9 | -70.3 | -76.1 | 0 | 0 | 0 | 111.4 | A209 S214 F221 | A209-N217 HydrophobicContact CB-CB 3.73Å; S214-N217 VanDerWaalsContact CB-ND2 3.31Å; S214-N217 WeakPolarHBondContact CB-ND2 3.42Å; S214-N217 PolarHBondContact O-N 2.86Å; S214-N217 VanDerWaalsContact O-N 3.15Å; S214-N217 PolarHBondContact OG-ND2 3.34Å; N217-F221 VanDerWaalsContact O-CB 3.28Å; N217-F221 WeakPolarHBondContact O-CB 3.47Å; N217-F221 PolarHBondContact O-N 3.44Å |
| 218 | F | 83.5 | Confident | 82.6 | Confident | 6 Ų | 6 | 54.3 Ų | 54.3 | 3% | 0.026 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -62.4 | -46.2 | 170.1 | -83.2 | -66.7 | 0 | 0 | 0 | 112.4 | A209 F210 S214 S215 F216 F221 F222 V286 Y290 | A209-F218 HydrophobicContact CB-CD1 3.96Å; A209-F218 HydrophobicContact CB-CD2 3.8Å; A209-F218 HydrophobicContact CB-CE1 3.99Å; A209-F218 HydrophobicContact CB-CE2 3.85Å; A209-F218 HydrophobicContact CB-CG 3.85Å; A209-F218 HydrophobicContact CB-CZ 3.94Å; F210-F218 HydrophobicContact CD1-CE1 4.02Å; F210-F218 AromaticContact CD1-CZ 3.62Å; F210-F218 HydrophobicContact CD1-CZ 3.62Å; F210-F218 AromaticContact CE1-CE1 3.62Å; F210-F218 HydrophobicContact CE1-CE1 3.62Å; F210-F218 AromaticContact CE1-CZ 3.62Å; F210-F218 HydrophobicContact CE1-CZ 3.62Å; F210-F218 HydrophobicContact CG-CZ 4.36Å; F210-F218 AromaticContact CZ-CE1 3.95Å; F210-F218 HydrophobicContact CZ-CE1 3.95Å; F210-F218 HydrophobicContact CZ-CZ 4.39Å; S214-F218 WeakPolarHBondContact O-CD2 3.47Å; S214-F218 PolarHBondContact O-N 2.86Å; S215-F218 WeakPolarHBondContact O-CB 3.3Å; S215-F218 PolarHBondContact O-N 3.34Å; F216-F218 VanDerWaalsContact C-N 3.3Å; F216-F218 PolarHBondContact O-N 2.94Å; F218-F221 WeakPolarHBondContact O-CB 3.43Å; F218-F221 PolarHBondContact O-N 2.86Å; F218-F222 HydrophobicContact CB-CE2 4.2Å; F218-F222 HydrophobicContact CD1-CE2 4.35Å; F218-F222 WeakPolarHBondContact O-CD2 3.4Å; F218-F222 PolarHBondContact O-N 3.21Å; F218-V286 HydrophobicContact CD1-CG1 4.22Å; F218-V286 HydrophobicContact CE1-CG1 4.05Å; F218-Y290 HydrophobicContact CB-CD2 3.98Å; F218-Y290 HydrophobicContact CB-CE2 4.04Å; F218-Y290 HydrophobicContact CD1-CD2 4.36Å; F218-Y290 HydrophobicContact CD2-CD2 4.14Å; F218-Y290 AromaticContact CG-CD2 3.92Å; F218-Y290 HydrophobicContact CG-CD2 3.92Å; F218-Y290 HydrophobicContact CG-CE2 4.37Å |
| 219 | F | 84.5 | Confident | 83.5 | Confident | 131 Ų | 131 | 49.1 Ų | 49.1 | 58% | 0.575 | 24% | 0.237 | S | C | * | . | H | α-helix | trans | -60.8 | -47.8 | 178.4 | -179.8 | -98.3 | 0 | 0 | 0 | 112.1 | S215 F216 F221 F222 F223 | S215-F219 PolarHBondContact O-N 3.38Å; S215-F219 VanDerWaalsContact O-N 3.08Å; F216-F219 PolarHBondContact O-N 3.34Å; F219-F221 VanDerWaalsContact C-N 3.33Å; F219-F221 PolarHBondContact O-N 3.27Å; F219-F222 PolarHBondContact O-N 3.31Å; F219-F223 PolarHBondContact O-N 3.01Å; F219-F223 VanDerWaalsContact O-N 3.13Å |
| 220 | F | 86.8 | Confident | 84.2 | Confident | 91 Ų | 91 | 51 Ų | 51 | 40% | 0.399 | 25% | 0.253 | S | S | . | . | H | α-helix | trans | -60.4 | -43.3 | 176.5 | -176 | -98 | 0 | 0 | 0 | 111.7 | C201 P205 F216 F223 V224 | C201-F220 VanDerWaalsContact O-CE1 3.3Å; C201-F220 WeakPolarHBondContact O-CE1 3.49Å; P205-F220 HydrophobicContact CB-CD1 3.78Å; P205-F220 HydrophobicContact CB-CE1 4.36Å; P205-F220 HydrophobicContact CG-CD1 3.57Å; P205-F220 HydrophobicContact CG-CE1 3.63Å; F216-F220 PolarHBondContact O-N 3.44Å; F216-F220 VanDerWaalsContact O-N 3.1Å; F220-F223 PolarHBondContact O-N 3.05Å; F220-V224 HydrophobicContact CD1-CG2 4.22Å; F220-V224 HydrophobicContact CD2-CG2 4.43Å; F220-V224 HydrophobicContact CE1-CG2 3.84Å; F220-V224 HydrophobicContact CE2-CG2 4.05Å; F220-V224 HydrophobicContact CZ-CG2 3.74Å; F220-V224 WeakPolarHBondContact O-CG2 3.42Å; F220-V224 PolarHBondContact O-N 3.37Å |
| 221 | F | 89.8 | Confident | 85.1 | Confident | 0 Ų | 0 | 53 Ų | 53 | 0% | 0 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -56.6 | -51.6 | 174 | 163.7 | -99.6 | 0 | 0 | 0 | 111.8 | M152 W202 P205 V206 N217 F218 F219 F223 V224 F225 V286 | M152-F221 HydrophobicContact CE-CE2 3.94Å; M152-F221 HydrophobicContact CE-CZ 3.49Å; M152-F221 VanDerWaalsContact CE-CZ 3.49Å; M152-F221 HydrophobicContact SD-CE2 4.16Å; M152-F221 HydrophobicContact SD-CZ 4.29Å; W202-F221 HydrophobicContact CB-CD2 4.07Å; W202-F221 HydrophobicContact CB-CE2 4.35Å; W202-F221 HydrophobicContact CE3-CE2 4.28Å; P205-F221 HydrophobicContact CB-CB 4.46Å; V206-F221 HydrophobicContact CB-CB 4.43Å; V206-F221 HydrophobicContact CB-CD2 3.45Å; V206-F221 VanDerWaalsContact CB-CD2 3.45Å; V206-F221 HydrophobicContact CB-CE2 3.79Å; V206-F221 HydrophobicContact CB-CG 3.9Å; V206-F221 HydrophobicContact CG1-CD2 4.4Å; V206-F221 HydrophobicContact CG1-CE2 4.37Å; V206-F221 HydrophobicContact CG2-CB 4.45Å; V206-F221 HydrophobicContact CG2-CD1 3.91Å; V206-F221 HydrophobicContact CG2-CD2 3.55Å; V206-F221 HydrophobicContact CG2-CE1 4.03Å; V206-F221 HydrophobicContact CG2-CE2 3.65Å; V206-F221 HydrophobicContact CG2-CG 3.67Å; V206-F221 HydrophobicContact CG2-CZ 3.91Å; N217-F221 VanDerWaalsContact O-CB 3.28Å; N217-F221 WeakPolarHBondContact O-CB 3.47Å; N217-F221 PolarHBondContact O-N 3.44Å; F218-F221 WeakPolarHBondContact O-CB 3.43Å; F218-F221 PolarHBondContact O-N 2.86Å; F219-F221 VanDerWaalsContact C-N 3.33Å; F219-F221 PolarHBondContact O-N 3.27Å; F221-F223 VanDerWaalsContact C-N 3.32Å; F221-F223 PolarHBondContact O-N 3.18Å; F221-V224 PolarHBondContact O-N 3.34Å; F221-F225 HydrophobicContact CD2-CB 4.04Å; F221-F225 HydrophobicContact CD2-CG 4.46Å; F221-F225 HydrophobicContact CE1-CB 4.39Å; F221-F225 HydrophobicContact CE1-CD1 4.37Å; F221-F225 HydrophobicContact CE2-CB 3.66Å; F221-F225 HydrophobicContact CE2-CD1 4.09Å; F221-F225 AromaticContact CE2-CD2 3.84Å; F221-F225 HydrophobicContact CE2-CD2 3.84Å; F221-F225 AromaticContact CE2-CG 3.6Å; F221-F225 HydrophobicContact CE2-CG 3.6Å; F221-F225 HydrophobicContact CZ-CB 3.84Å; F221-F225 AromaticContact CZ-CD1 3.61Å; F221-F225 HydrophobicContact CZ-CD1 3.61Å; F221-F225 HydrophobicContact CZ-CD2 4.19Å; F221-F225 HydrophobicContact CZ-CE1 4.19Å; F221-F225 AromaticContact CZ-CG 3.62Å; F221-F225 HydrophobicContact CZ-CG 3.62Å; F221-F225 WeakPolarHBondContact O-CB 3.28Å; F221-F225 PolarHBondContact O-N 2.95Å; F221-V286 HydrophobicContact CD1-CG1 4.07Å; F221-V286 HydrophobicContact CE1-CB 3.96Å; F221-V286 HydrophobicContact CE1-CG1 3.58Å; F221-V286 HydrophobicContact CE1-CG2 4.1Å; F221-V286 HydrophobicContact CZ-CG1 4.45Å; F221-V286 HydrophobicContact CZ-CG2 4.22Å |
| 222 | F | 90.3 | Very high | 86 | Confident | 35 Ų | 35 | 47.2 Ų | 47.2 | 15% | 0.154 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -60 | -42.6 | -177.2 | -74.9 | -58.9 | 0 | 0 | 0 | 112.4 | F218 F219 F226 L283 V286 H287 Y290 | F218-F222 HydrophobicContact CB-CE2 4.2Å; F218-F222 HydrophobicContact CD1-CE2 4.35Å; F218-F222 WeakPolarHBondContact O-CD2 3.4Å; F218-F222 PolarHBondContact O-N 3.21Å; F219-F222 PolarHBondContact O-N 3.31Å; F222-F226 WeakPolarHBondContact O-CB 3.31Å; F222-F226 PolarHBondContact O-N 3.14Å; F222-L283 HydrophobicContact CD1-CD1 3.75Å; F222-L283 HydrophobicContact CE1-CD1 4.3Å; F222-V286 HydrophobicContact CE1-CB 4.13Å; F222-V286 HydrophobicContact CE1-CG1 3.85Å; F222-V286 HydrophobicContact CZ-CB 4.39Å; F222-V286 HydrophobicContact CZ-CG1 3.74Å; F222-H287 HydrophobicContact CE1-CB 3.83Å; F222-H287 HydrophobicContact CZ-CB 4.09Å; F222-Y290 HydrophobicContact CE2-CD1 4.18Å; F222-Y290 HydrophobicContact CE2-CD2 4.3Å; F222-Y290 AromaticContact CE2-CG 3.94Å; F222-Y290 HydrophobicContact CE2-CG 3.94Å; F222-Y290 HydrophobicContact CZ-CG 4.31Å |
| 223 | F | 89.8 | Confident | 87.3 | Confident | 130 Ų | 130 | 47.4 Ų | 47.4 | 57% | 0.57 | 24% | 0.238 | S | C | * | . | H | α-helix | trans | -62.8 | -53.1 | 178.1 | 176.1 | -103.6 | 0 | 0 | 0 | 111.9 | F219 F220 F221 F225 F226 C227 | F219-F223 PolarHBondContact O-N 3.01Å; F219-F223 VanDerWaalsContact O-N 3.13Å; F220-F223 PolarHBondContact O-N 3.05Å; F221-F223 VanDerWaalsContact C-N 3.32Å; F221-F223 PolarHBondContact O-N 3.18Å; F223-F225 PolarHBondContact O-N 3.42Å; F223-F226 PolarHBondContact O-N 2.88Å; F223-C227 PolarHBondContact O-N 2.99Å; F223-C227 PolarHBondContact O-SG 3.48Å |
| 224 | V | 91.3 | Very high | 88.7 | Confident | 26 Ų | 26 | 48.4 Ų | 48.4 | 16% | 0.158 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -66.9 | -41.2 | -178.1 | 177.3 | 0 | 0 | 0 | 0 | 111.4 | C201 W202 F220 F221 F226 C227 H228 | C201-V224 HydrophobicContact CB-CG1 3.73Å; C201-V224 WeakPolarHBondContact O-CG1 3.18Å; W202-V224 HydrophobicContact CB-CG1 4.13Å; F220-V224 HydrophobicContact CD1-CG2 4.22Å; F220-V224 HydrophobicContact CD2-CG2 4.43Å; F220-V224 HydrophobicContact CE1-CG2 3.84Å; F220-V224 HydrophobicContact CE2-CG2 4.05Å; F220-V224 HydrophobicContact CZ-CG2 3.74Å; F220-V224 WeakPolarHBondContact O-CG2 3.42Å; F220-V224 PolarHBondContact O-N 3.37Å; F221-V224 PolarHBondContact O-N 3.34Å; V224-F226 VanDerWaalsContact C-N 3.32Å; V224-F226 PolarHBondContact O-N 2.94Å; V224-C227 WeakPolarHBondContact O-CB 3.33Å; V224-C227 PolarHBondContact O-N 3.24Å; V224-H228 PolarHBondContact O-N 3.32Å |
| 225 | F | 93.6 | Very high | 89.8 | Confident | 0 Ų | 0 | 47.5 Ų | 47.5 | 0% | 0 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -69 | -32.6 | -178.9 | -164.8 | -113.3 | 0 | 0 | 0 | 111.7 | M152 L155 W202 F221 F223 H228 V229 S279 L283 | M152-F225 HydrophobicContact CE-CE1 4.19Å; M152-F225 HydrophobicContact CE-CE2 4.44Å; M152-F225 HydrophobicContact CE-CZ 4.01Å; M152-F225 HydrophobicContact SD-CD2 4.45Å; M152-F225 HydrophobicContact SD-CE1 4.49Å; M152-F225 HydrophobicContact SD-CE2 3.73Å; M152-F225 HydrophobicContact SD-CZ 3.76Å; L155-F225 HydrophobicContact CD2-CE2 3.8Å; L155-F225 HydrophobicContact CD2-CZ 3.52Å; W202-F225 HydrophobicContact CB-CB 4.38Å; W202-F225 HydrophobicContact CB-CD2 4.2Å; W202-F225 AromaticContact CD2-CD2 3.63Å; W202-F225 HydrophobicContact CD2-CD2 3.63Å; W202-F225 AromaticContact CD2-CE2 3.9Å; W202-F225 HydrophobicContact CD2-CE2 3.9Å; W202-F225 AromaticContact CE3-CD2 3.86Å; W202-F225 HydrophobicContact CE3-CD2 3.86Å; W202-F225 AromaticContact CE3-CE2 3.88Å; W202-F225 HydrophobicContact CE3-CE2 3.88Å; W202-F225 AromaticContact CG-CD2 3.82Å; W202-F225 HydrophobicContact CG-CD2 3.82Å; W202-F225 HydrophobicContact CH2-CE2 4.08Å; W202-F225 HydrophobicContact CZ2-CE2 4.1Å; W202-F225 HydrophobicContact CZ3-CD2 4.46Å; W202-F225 HydrophobicContact CZ3-CE2 4.02Å; F221-F225 HydrophobicContact CD2-CB 4.04Å; F221-F225 HydrophobicContact CD2-CG 4.46Å; F221-F225 HydrophobicContact CE1-CB 4.39Å; F221-F225 HydrophobicContact CE1-CD1 4.37Å; F221-F225 HydrophobicContact CE2-CB 3.66Å; F221-F225 HydrophobicContact CE2-CD1 4.09Å; F221-F225 AromaticContact CE2-CD2 3.84Å; F221-F225 HydrophobicContact CE2-CD2 3.84Å; F221-F225 AromaticContact CE2-CG 3.6Å; F221-F225 HydrophobicContact CE2-CG 3.6Å; F221-F225 HydrophobicContact CZ-CB 3.84Å; F221-F225 AromaticContact CZ-CD1 3.61Å; F221-F225 HydrophobicContact CZ-CD1 3.61Å; F221-F225 HydrophobicContact CZ-CD2 4.19Å; F221-F225 HydrophobicContact CZ-CE1 4.19Å; F221-F225 AromaticContact CZ-CG 3.62Å; F221-F225 HydrophobicContact CZ-CG 3.62Å; F221-F225 WeakPolarHBondContact O-CB 3.28Å; F221-F225 PolarHBondContact O-N 2.95Å; F223-F225 PolarHBondContact O-N 3.42Å; F225-H228 AromaticContact CD2-CD2 3.97Å; F225-H228 AromaticContact CE2-CD2 3.75Å; F225-H228 WeakPolarHBondContact O-CB 3.45Å; F225-H228 PolarHBondContact O-N 3.04Å; F225-V229 HydrophobicContact CD1-CG2 4.48Å; F225-V229 HydrophobicContact CE1-CG2 4.4Å; F225-V229 VanDerWaalsContact O-CG2 3.31Å; F225-V229 WeakPolarHBondContact O-CG2 3.18Å; F225-V229 PolarHBondContact O-N 2.92Å; F225-S279 WeakPolarHBondContact CE1-O 3.43Å; F225-L283 HydrophobicContact CD1-CB 4.09Å; F225-L283 HydrophobicContact CD1-CD1 3.82Å; F225-L283 HydrophobicContact CE1-CB 3.98Å |
| 226 | F | 92.9 | Very high | 90.9 | Very high | 129 Ų | 129 | 47.9 Ų | 47.9 | 57% | 0.566 | 24% | 0.239 | S | C | * | . | H | α-helix | trans | -61.8 | -45.9 | 169.6 | 177.2 | -97.5 | 0 | 0 | 0 | 112 | F222 F223 V224 H228 V229 A230 | F222-F226 WeakPolarHBondContact O-CB 3.31Å; F222-F226 PolarHBondContact O-N 3.14Å; F223-F226 PolarHBondContact O-N 2.88Å; V224-F226 VanDerWaalsContact C-N 3.32Å; V224-F226 PolarHBondContact O-N 2.94Å; F226-H228 VanDerWaalsContact C-N 3.3Å; F226-H228 PolarHBondContact O-N 3.47Å; F226-V229 WeakPolarHBondContact O-CB 3.32Å; F226-V229 PolarHBondContact O-N 3.14Å; F226-A230 PolarHBondContact O-N 3.48Å |
| 227 | C | 93.4 | Very high | 91.9 | Very high | 57 Ų | 57 | 46.1 Ų | 46.1 | 39% | 0.385 | 24% | 0.236 | S | C | . | . | H | α-helix | trans | -60.1 | -40.5 | 173.3 | -66.9 | 0 | 0 | 0 | 0 | 111.8 | F223 V224 A230 V231 | F223-C227 PolarHBondContact O-N 2.99Å; F223-C227 PolarHBondContact O-SG 3.48Å; V224-C227 WeakPolarHBondContact O-CB 3.33Å; V224-C227 PolarHBondContact O-N 3.24Å; C227-A230 PolarHBondContact O-N 2.92Å; C227-V231 WeakPolarHBondContact O-CG2 3.36Å; C227-V231 PolarHBondContact O-N 3.38Å |
| 228 | H | 94.1 | Very high | 92.3 | Very high | 17 Ų | 17 | 45 Ų | 45 | 8% | 0.079 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -59.9 | -45 | 174.3 | 170.8 | 69.9 | 0 | 0 | 0 | 112.2 | Y159 W202 V224 F225 F226 A230 V231 V232 | Y159-H228 AromaticContact CD1-CE1 3.76Å; Y159-H228 AromaticContact CE1-CE1 3.74Å; Y159-H228 AromaticContact CG-CE1 3.92Å; Y159-H228 AromaticContact CZ-CE1 3.91Å; W202-H228 AromaticContact NE1-CG 3.8Å; W202-H228 AromaticContact NE1-ND1 3.92Å; V224-H228 PolarHBondContact O-N 3.32Å; F225-H228 AromaticContact CD2-CD2 3.97Å; F225-H228 AromaticContact CE2-CD2 3.75Å; F225-H228 WeakPolarHBondContact O-CB 3.45Å; F225-H228 PolarHBondContact O-N 3.04Å; F226-H228 VanDerWaalsContact C-N 3.3Å; F226-H228 PolarHBondContact O-N 3.47Å; H228-A230 VanDerWaalsContact C-N 3.32Å; H228-A230 PolarHBondContact O-N 3.33Å; H228-V231 PolarHBondContact O-N 2.77Å; H228-V232 PolarHBondContact O-N 3.44Å |
| 229 | V | 95.2 | Very high | 92.7 | Very high | 10 Ų | 10 | 48.3 Ų | 48.3 | 6% | 0.061 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -57.7 | -45.5 | 174.5 | 172.1 | 0 | 0 | 0 | 0 | 110.7 | F225 F226 V231 V232 I233 V280 | F225-V229 HydrophobicContact CD1-CG2 4.48Å; F225-V229 HydrophobicContact CE1-CG2 4.4Å; F225-V229 VanDerWaalsContact O-CG2 3.31Å; F225-V229 WeakPolarHBondContact O-CG2 3.18Å; F225-V229 PolarHBondContact O-N 2.92Å; F226-V229 WeakPolarHBondContact O-CB 3.32Å; F226-V229 PolarHBondContact O-N 3.14Å; V229-V231 PolarHBondContact O-N 2.94Å; V229-V232 PolarHBondContact O-N 2.78Å; V229-I233 HydrophobicContact CG1-CD1 3.88Å; V229-I233 VanDerWaalsContact O-CG1 3.3Å; V229-I233 WeakPolarHBondContact O-CG1 3.5Å; V229-I233 PolarHBondContact O-N 3.24Å; V229-V280 HydrophobicContact CG1-CG2 3.75Å |
| 230 | A | 95.3 | Very high | 92.7 | Very high | 40 Ų | 40 | 45.2 Ų | 45.2 | 33% | 0.331 | 24% | 0.24 | S | C | . | . | H | α-helix | trans | -60.9 | -44.6 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | F226 C227 H228 V232 I233 I234 | F226-A230 PolarHBondContact O-N 3.48Å; C227-A230 PolarHBondContact O-N 2.92Å; H228-A230 VanDerWaalsContact C-N 3.32Å; H228-A230 PolarHBondContact O-N 3.33Å; A230-V232 PolarHBondContact O-N 2.82Å; A230-I233 PolarHBondContact O-N 2.87Å; A230-I234 WeakPolarHBondContact O-CG1 3.46Å; A230-I234 PolarHBondContact O-N 3.35Å |
| 231 | V | 93.9 | Very high | 92.7 | Very high | 47 Ų | 47 | 46.5 Ų | 46.5 | 29% | 0.285 | 25% | 0.246 | S | C | . | . | H | α-helix | trans | -60.3 | -46.1 | 176.4 | 169.9 | 0 | 0 | 0 | 0 | 111.1 | F194 C227 H228 V229 I233 I234 Q235 | F194-V231 HydrophobicContact CE2-CG1 4.11Å; F194-V231 HydrophobicContact CZ-CG1 4.2Å; C227-V231 WeakPolarHBondContact O-CG2 3.36Å; C227-V231 PolarHBondContact O-N 3.38Å; H228-V231 PolarHBondContact O-N 2.77Å; V229-V231 PolarHBondContact O-N 2.94Å; V231-I233 VanDerWaalsContact C-N 3.29Å; V231-I233 PolarHBondContact O-N 2.85Å; V231-I234 PolarHBondContact O-N 3.34Å; V231-I234 VanDerWaalsContact O-N 3.14Å; V231-Q235 HydrophobicContact CG1-CG 4.32Å; V231-Q235 VanDerWaalsContact O-CG 3.32Å; V231-Q235 WeakPolarHBondContact O-CG 3.44Å; V231-Q235 PolarHBondContact O-N 2.49Å |
| 232 | V | 95.2 | Very high | 92.7 | Very high | 1 Ų | 1 | 52.7 Ų | 52.7 | 1% | 0.006 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -67.6 | -31 | -177.5 | 101.7 | 0 | 0 | 0 | 0 | 112.1 | Y159 H228 V229 A230 Q235 A236 F272 A276 | Y159-V232 HydrophobicContact CD2-CG2 3.91Å; Y159-V232 HydrophobicContact CE2-CG2 3.68Å; H228-V232 PolarHBondContact O-N 3.44Å; V229-V232 PolarHBondContact O-N 2.78Å; A230-V232 PolarHBondContact O-N 2.82Å; V232-Q235 PolarHBondContact O-N 3.42Å; V232-A236 WeakPolarHBondContact O-CB 3.46Å; V232-A236 PolarHBondContact O-N 2.73Å; V232-F272 HydrophobicContact CG2-CD1 4.13Å; V232-A276 HydrophobicContact CG1-CB 3.56Å |
| 233 | I | 95.8 | Very high | 92.7 | Very high | 81 Ų | 81 | 51 Ų | 51 | 42% | 0.415 | 26% | 0.262 | S | S | . | . | H | α-helix | trans | -65.9 | -45.3 | 171.5 | -69.2 | 166.7 | 0 | 0 | 0 | 110.5 | V229 A230 V231 Q235 A236 V237 A276 | V229-I233 HydrophobicContact CG1-CD1 3.88Å; V229-I233 VanDerWaalsContact O-CG1 3.3Å; V229-I233 WeakPolarHBondContact O-CG1 3.5Å; V229-I233 PolarHBondContact O-N 3.24Å; A230-I233 PolarHBondContact O-N 2.87Å; V231-I233 VanDerWaalsContact C-N 3.29Å; V231-I233 PolarHBondContact O-N 2.85Å; I233-Q235 VanDerWaalsContact C-N 3.29Å; I233-Q235 PolarHBondContact O-N 3.16Å; I233-A236 WeakPolarHBondContact O-CB 3.46Å; I233-A236 PolarHBondContact O-N 3.25Å; I233-V237 WeakPolarHBondContact O-CG2 3.42Å; I233-V237 PolarHBondContact O-N 3.02Å; I233-A276 HydrophobicContact CG1-CB 4.05Å |
| 234 | I | 94.7 | Very high | 92.8 | Very high | 74 Ų | 74 | 45 Ų | 45 | 38% | 0.379 | 24% | 0.235 | S | C | . | . | H | α-helix | trans | -61.7 | -39.8 | 176.3 | -66.8 | 165 | 0 | 0 | 0 | 110.9 | A230 V231 V237 G238 I239 | A230-I234 WeakPolarHBondContact O-CG1 3.46Å; A230-I234 PolarHBondContact O-N 3.35Å; V231-I234 PolarHBondContact O-N 3.34Å; V231-I234 VanDerWaalsContact O-N 3.14Å; I234-V237 PolarHBondContact O-N 3.2Å; I234-G238 PolarHBondContact O-N 3.49Å; I234-I239 HydrophobicContact CG2-CD1 3.99Å |
| 235 | Q | 94.8 | Very high | 92.9 | Very high | 3 Ų | 3 | 43.8 Ų | 43.8 | 1% | 0.014 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -64.2 | -40.3 | 174.7 | -69.3 | 175.8 | -20 | 0 | 0 | 112.2 | Y159 V231 V232 I233 V237 G238 N244 F272 | Y159-Q235 VanDerWaalsContact CE2-OE1 3.3Å; Y159-Q235 PolarHBondContact OH-NE2 3.06Å; Y159-Q235 VanDerWaalsContact OH-NE2 3.1Å; Y159-Q235 PolarHBondContact OH-OE1 2.92Å; V231-Q235 HydrophobicContact CG1-CG 4.32Å; V231-Q235 VanDerWaalsContact O-CG 3.32Å; V231-Q235 WeakPolarHBondContact O-CG 3.44Å; V231-Q235 PolarHBondContact O-N 2.49Å; V232-Q235 PolarHBondContact O-N 3.42Å; I233-Q235 VanDerWaalsContact C-N 3.29Å; I233-Q235 PolarHBondContact O-N 3.16Å; Q235-V237 VanDerWaalsContact C-N 3.32Å; Q235-V237 PolarHBondContact O-N 2.83Å; Q235-G238 PolarHBondContact O-N 3.44Å; Q235-N244 HydrophobicContact CB-CB 4.4Å; Q235-F272 HydrophobicContact CB-CD1 3.86Å; Q235-F272 HydrophobicContact CB-CD2 4.35Å; Q235-F272 HydrophobicContact CB-CE1 3.85Å; Q235-F272 HydrophobicContact CB-CE2 4.33Å; Q235-F272 HydrophobicContact CB-CG 4.13Å; Q235-F272 HydrophobicContact CB-CZ 4.09Å; Q235-F272 HydrophobicContact CG-CE1 4.37Å |
| 236 | A | 96.6 | Very high | 92.9 | Very high | 9 Ų | 9 | 43.8 Ų | 43.8 | 7% | 0.074 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -62.9 | -38.6 | 175 | 0 | 0 | 0 | 0 | 0 | 112 | V232 I233 G246 W247 F272 | V232-A236 WeakPolarHBondContact O-CB 3.46Å; V232-A236 PolarHBondContact O-N 2.73Å; I233-A236 WeakPolarHBondContact O-CB 3.46Å; I233-A236 PolarHBondContact O-N 3.25Å; A236-G246 CarbonylContact O-C 3.37Å; A236-G246 VanDerWaalsContact O-CA 3.26Å; A236-G246 WeakPolarHBondContact O-CA 3.13Å; A236-W247 PolarHBondContact O-N 2.9Å; A236-F272 HydrophobicContact CB-CB 3.81Å |
| 237 | V | 96 | Very high | 93 | Very high | 59 Ų | 59 | 41.6 Ų | 41.6 | 36% | 0.358 | 22% | 0.216 | S | C | . | . | H | α-helix | trans | -62.7 | -43.5 | 173.9 | 172.1 | 0 | 0 | 0 | 0 | 110.7 | I233 I234 Q235 I239 W247 I248 | I233-V237 WeakPolarHBondContact O-CG2 3.42Å; I233-V237 PolarHBondContact O-N 3.02Å; I234-V237 PolarHBondContact O-N 3.2Å; Q235-V237 VanDerWaalsContact C-N 3.32Å; Q235-V237 PolarHBondContact O-N 2.83Å; V237-I239 HydrophobicContact CG1-CG1 4.43Å; V237-W247 PolarHBondContact O-N 3.21Å; V237-I248 HydrophobicContact CG1-CD1 3.45Å; V237-I248 VanDerWaalsContact CG1-CD1 3.45Å; V237-I248 HydrophobicContact CG1-CG1 4.13Å; V237-I248 WeakPolarHBondContact O-CB 3.49Å; V237-I248 WeakPolarHBondContact O-CG1 3.41Å; V237-I248 PolarHBondContact O-N 2.92Å |
| 238 | G | 91.6 | Very high | 93 | Very high | 0 Ų | 0 | 42.9 Ų | 42.9 | 0% | 0 | 22% | 0.219 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 73.1 | 64.7 | 177 | 0 | 0 | 0 | 0 | 0 | 112.3 | I234 Q235 S249 | I234-G238 PolarHBondContact O-N 3.49Å; Q235-G238 PolarHBondContact O-N 3.44Å; G238-S249 PolarHBondContact O-OG 3.32Å |
| 239 | I | 90.6 | Very high | 92.9 | Very high | 74 Ų | 74 | 42.4 Ų | 42.4 | 38% | 0.379 | 22% | 0.217 | S | C | . | . | trans | -61.7 | 129.6 | 174.8 | -58 | 176.2 | 0 | 0 | 0 | 108.6 | I234 V237 W242 | I234-I239 HydrophobicContact CG2-CD1 3.99Å; V237-I239 HydrophobicContact CG1-CG1 4.43Å; I239-W242 HydrophobicContact CB-CB 4.15Å; I239-W242 WeakPolarHBondContact O-CB 3.45Å; I239-W242 PolarHBondContact O-N 3.41Å | ||
| 240 | P | 86 | Confident | 92.8 | Very high | 66 Ų | 66 | 42 Ų | 42 | 43% | 0.429 | 21% | 0.214 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -55.8 | 144.5 | 178 | -25.1 | 33.7 | 0 | 0 | 0 | 112.1 | W242 I248 | P240-W242 PolarHBondContact O-N 2.83Å; P240-I248 HydrophobicContact CG-CG2 4.32Å |
| 241 | F | 86.8 | Confident | 92.7 | Very high | 118 Ų | 118 | 45.8 Ų | 45.8 | 52% | 0.518 | 22% | 0.224 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 62.2 | 17.3 | -177.8 | -48.5 | -75.1 | 0 | 0 | 0 | 114.7 | D183 L186 | D183-F241 WeakPolarHBondContact OD1-CA 3.36Å; D183-F241 PolarHBondContact OD1-N 3.34Å; D183-F241 VanDerWaalsContact OD1-N 3.09Å; L186-F241 WeakPolarHBondContact CD1-O 3.31Å |
| 242 | W | 90 | Very high | 92.6 | Very high | 131 Ų | 131 | 46.3 Ų | 46.3 | 50% | 0.496 | 23% | 0.229 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -101.4 | -0.7 | 173.5 | -154 | -85.8 | 0 | 0 | 0 | 112.1 | D183 W190 I239 P240 N244 | D183-W242 PolarHBondContact OD1-N 2.84Å; W190-W242 AromaticContact CZ2-NE1 3.89Å; W190-W242 PolarHBondContact NE1-O 3.23Å; I239-W242 HydrophobicContact CB-CB 4.15Å; I239-W242 WeakPolarHBondContact O-CB 3.45Å; I239-W242 PolarHBondContact O-N 3.41Å; P240-W242 PolarHBondContact O-N 2.83Å; W242-N244 VanDerWaalsContact C-N 3.34Å; W242-N244 VanDerWaalsContact CD1-ND2 3.3Å; W242-N244 PolarHBondContact O-N 3.24Å |
| 243 | G | 89.1 | Confident | 92.3 | Very high | 0 Ų | 0 | 46.3 Ų | 46.3 | 0% | 0 | 23% | 0.229 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 73.1 | 22.4 | 179.4 | 0 | 0 | 0 | 0 | 0 | 115.2 | N166 D183 S187 | N166-G243 PolarHBondContact ND2-O 2.91Å; D183-G243 WeakPolarHBondContact O-CA 2.99Å; D183-G243 PolarHBondContact OD1-N 2.95Å; S187-G243 WeakPolarHBondContact CB-O 3.35Å |
| 244 | N | 92.4 | Very high | 92.1 | Very high | 2 Ų | 2 | 45.6 Ų | 45.6 | 1% | 0.011 | 23% | 0.225 | C | C | . | . | trans | -122.1 | 130.5 | 172.5 | -57.2 | -60.7 | 0 | 0 | 0 | 111.4 | N166 Q235 W242 G246 S249 | N166-N244 WeakPolarHBondContact OD1-CA 3.4Å; Q235-N244 HydrophobicContact CB-CB 4.4Å; W242-N244 VanDerWaalsContact C-N 3.34Å; W242-N244 VanDerWaalsContact CD1-ND2 3.3Å; W242-N244 PolarHBondContact O-N 3.24Å; N244-G246 VanDerWaalsContact C-N 3.26Å; N244-G246 PolarHBondContact O-N 3.05Å; N244-G246 VanDerWaalsContact O-N 3.14Å; N244-S249 PolarHBondContact O-OG 3.38Å | ||
| 245 | S | 92.6 | Very high | 91.9 | Very high | 1 Ų | 1 | 45.1 Ų | 45.1 | 1% | 0.007 | 24% | 0.239 | C | C | . | . | trans | -87.2 | 61.7 | 174.8 | -65.6 | 0 | 0 | 0 | 0 | 110.7 | N166 A169 C170 | N166-S245 PolarHBondContact OD1-N 3.32Å; A169-S245 WeakPolarHBondContact CB-OG 3.49Å; C170-S245 PolarHBondContact SG-OG 2.98Å; C170-S245 VanDerWaalsContact SG-OG 3.33Å | ||
| 246 | G | 93.2 | Very high | 91.6 | Very high | 0 Ų | 0 | 50 Ų | 50 | 0% | 0 | 27% | 0.266 | C | S | . | . | trans | -86.2 | -169.8 | 176.1 | 0 | 0 | 0 | 0 | 0 | 113.2 | A236 N244 I248 S249 A250 | A236-G246 CarbonylContact O-C 3.37Å; A236-G246 VanDerWaalsContact O-CA 3.26Å; A236-G246 WeakPolarHBondContact O-CA 3.13Å; N244-G246 VanDerWaalsContact C-N 3.26Å; N244-G246 PolarHBondContact O-N 3.05Å; N244-G246 VanDerWaalsContact O-N 3.14Å; G246-I248 PolarHBondContact O-N 3.44Å; G246-S249 PolarHBondContact O-N 3.47Å; G246-A250 WeakPolarHBondContact O-CB 3.26Å; G246-A250 PolarHBondContact O-N 3.06Å | ||
| 247 | W | 96.3 | Very high | 91.1 | Very high | 84 Ų | 84 | 52.2 Ų | 52.2 | 32% | 0.318 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -57.7 | -43.2 | -173 | -72.1 | 107.5 | 0 | 0 | 0 | 114 | A236 V237 A250 F251 I266 A269 T273 | A236-W247 PolarHBondContact O-N 2.9Å; V237-W247 PolarHBondContact O-N 3.21Å; W247-A250 PolarHBondContact O-N 3.31Å; W247-F251 HydrophobicContact CB-CE2 4.29Å; W247-F251 HydrophobicContact CD2-CE2 4.46Å; W247-F251 HydrophobicContact CE3-CE1 4.31Å; W247-F251 AromaticContact CE3-CE2 3.67Å; W247-F251 HydrophobicContact CE3-CE2 3.67Å; W247-F251 AromaticContact CE3-CZ 3.5Å; W247-F251 HydrophobicContact CE3-CZ 3.5Å; W247-F251 VanDerWaalsContact CE3-CZ 3.5Å; W247-F251 HydrophobicContact CZ3-CE1 4.47Å; W247-F251 HydrophobicContact CZ3-CE2 4.42Å; W247-F251 AromaticContact CZ3-CZ 3.81Å; W247-F251 HydrophobicContact CZ3-CZ 3.81Å; W247-F251 WeakPolarHBondContact O-CD2 3.45Å; W247-F251 WeakPolarHBondContact O-CG 3.46Å; W247-F251 PolarHBondContact O-N 3.47Å; W247-I266 HydrophobicContact CE3-CD1 3.83Å; W247-I266 HydrophobicContact CZ3-CD1 3.69Å; W247-I266 HydrophobicContact CZ3-CG2 4.4Å; W247-A269 HydrophobicContact CD2-CB 3.84Å; W247-A269 HydrophobicContact CE3-CB 4.3Å; W247-A269 HydrophobicContact CG-CB 3.99Å; W247-A269 HydrophobicContact CZ2-CB 4.49Å; W247-T273 PolarHBondContact NE1-OG1 3.35Å |
| 248 | I | 94 | Very high | 90.7 | Very high | 84 Ų | 84 | 52.1 Ų | 52.1 | 43% | 0.431 | 28% | 0.284 | S | S | . | . | H | α-helix | trans | -64.5 | -51.3 | -178.7 | -65.2 | 177.6 | 0 | 0 | 0 | 110.1 | V237 P240 G246 A250 F251 S252 | V237-I248 HydrophobicContact CG1-CD1 3.45Å; V237-I248 VanDerWaalsContact CG1-CD1 3.45Å; V237-I248 HydrophobicContact CG1-CG1 4.13Å; V237-I248 WeakPolarHBondContact O-CB 3.49Å; V237-I248 WeakPolarHBondContact O-CG1 3.41Å; V237-I248 PolarHBondContact O-N 2.92Å; P240-I248 HydrophobicContact CG-CG2 4.32Å; G246-I248 PolarHBondContact O-N 3.44Å; I248-A250 VanDerWaalsContact C-N 3.3Å; I248-A250 PolarHBondContact O-N 3.44Å; I248-F251 PolarHBondContact O-N 3.35Å; I248-S252 WeakPolarHBondContact O-CB 3.32Å; I248-S252 PolarHBondContact O-N 2.84Å |
| 249 | S | 91.3 | Very high | 90.6 | Very high | 7 Ų | 7 | 60 Ų | 60 | 5% | 0.049 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -59 | -42.1 | 177.5 | -52.8 | 0 | 0 | 0 | 0 | 111.7 | G238 N244 G246 S252 E253 M265 | G238-S249 PolarHBondContact O-OG 3.32Å; N244-S249 PolarHBondContact O-OG 3.38Å; G246-S249 PolarHBondContact O-N 3.47Å; S249-S252 PolarHBondContact O-N 3.39Å; S249-E253 PolarHBondContact O-N 3.21Å; S249-E253 VanDerWaalsContact O-N 3.1Å; S249-M265 VanDerWaalsContact CB-CE 3.43Å |
| 250 | A | 93.4 | Very high | 90.6 | Very high | 0 Ų | 0 | 60.2 Ų | 60.2 | 0% | 0 | 33% | 0.331 | C | S | . | . | H | α-helix | trans | -63.4 | -47.4 | 179 | 0 | 0 | 0 | 0 | 0 | 112.6 | G246 W247 I248 E253 I254 M265 I266 | G246-A250 WeakPolarHBondContact O-CB 3.26Å; G246-A250 PolarHBondContact O-N 3.06Å; W247-A250 PolarHBondContact O-N 3.31Å; I248-A250 VanDerWaalsContact C-N 3.3Å; I248-A250 PolarHBondContact O-N 3.44Å; A250-E253 PolarHBondContact O-N 3.18Å; A250-I254 VanDerWaalsContact O-CG1 3.31Å; A250-I254 WeakPolarHBondContact O-CG1 3.44Å; A250-I254 PolarHBondContact O-N 3.1Å; A250-I254 VanDerWaalsContact O-N 3.1Å; A250-M265 HydrophobicContact CB-CB 3.6Å; A250-I266 HydrophobicContact CB-CD1 3.62Å; A250-I266 HydrophobicContact CB-CG1 3.94Å |
| 251 | F | 93.4 | Very high | 90.9 | Very high | 121 Ų | 121 | 57.8 Ų | 57.8 | 53% | 0.531 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -69.6 | -35.2 | 178.9 | -68.6 | -43.1 | 0 | 0 | 0 | 113 | W247 I248 E253 I254 G255 I266 | W247-F251 HydrophobicContact CB-CE2 4.29Å; W247-F251 HydrophobicContact CD2-CE2 4.46Å; W247-F251 HydrophobicContact CE3-CE1 4.31Å; W247-F251 AromaticContact CE3-CE2 3.67Å; W247-F251 HydrophobicContact CE3-CE2 3.67Å; W247-F251 AromaticContact CE3-CZ 3.5Å; W247-F251 HydrophobicContact CE3-CZ 3.5Å; W247-F251 VanDerWaalsContact CE3-CZ 3.5Å; W247-F251 HydrophobicContact CZ3-CE1 4.47Å; W247-F251 HydrophobicContact CZ3-CE2 4.42Å; W247-F251 AromaticContact CZ3-CZ 3.81Å; W247-F251 HydrophobicContact CZ3-CZ 3.81Å; W247-F251 WeakPolarHBondContact O-CD2 3.45Å; W247-F251 WeakPolarHBondContact O-CG 3.46Å; W247-F251 PolarHBondContact O-N 3.47Å; I248-F251 PolarHBondContact O-N 3.35Å; F251-E253 VanDerWaalsContact C-N 3.29Å; F251-E253 PolarHBondContact O-N 3.34Å; F251-I254 HydrophobicContact CD1-CD1 4.46Å; F251-I254 PolarHBondContact O-N 2.65Å; F251-G255 PolarHBondContact O-N 2.94Å; F251-I266 HydrophobicContact CD1-CD1 4.09Å; F251-I266 HydrophobicContact CE1-CD1 3.72Å; F251-I266 HydrophobicContact CZ-CD1 4.26Å |
| 252 | S | 90.9 | Very high | 91.2 | Very high | 57 Ų | 57 | 52.2 Ų | 52.2 | 40% | 0.399 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -56.2 | -46.6 | 172.2 | -179.3 | 0 | 0 | 0 | 0 | 110.7 | I248 S249 G255 N256 | I248-S252 WeakPolarHBondContact O-CB 3.32Å; I248-S252 PolarHBondContact O-N 2.84Å; S249-S252 PolarHBondContact O-N 3.39Å; S252-G255 PolarHBondContact O-N 3.21Å; S252-N256 VanDerWaalsContact O-CG 3.31Å; S252-N256 PolarHBondContact O-N 2.83Å; S252-N256 PolarHBondContact O-ND2 3.22Å |
| 253 | E | 90.1 | Very high | 91.3 | Very high | 1 Ų | 1 | 47.4 Ų | 47.4 | 1% | 0.005 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -71.7 | -36.5 | -176.5 | -156.4 | 60.8 | -172 | 0 | 0 | 113.5 | Y173 S249 A250 F251 G255 N256 K258 V261 M265 | Y173-E253 HydrophobicContact CE2-CG 4.15Å; Y173-E253 VanDerWaalsContact CE2-OE1 3.24Å; Y173-E253 WeakPolarHBondContact CE2-OE1 3.02Å; Y173-E253 WeakPolarHBondContact CE2-OE2 3.43Å; Y173-E253 PolarHBondContact OH-OE2 3.29Å; S249-E253 PolarHBondContact O-N 3.21Å; S249-E253 VanDerWaalsContact O-N 3.1Å; A250-E253 PolarHBondContact O-N 3.18Å; F251-E253 VanDerWaalsContact C-N 3.29Å; F251-E253 PolarHBondContact O-N 3.34Å; E253-G255 VanDerWaalsContact C-N 3.32Å; E253-N256 PolarHBondContact O-N 3.17Å; E253-K258 HydrophobicContact CG-CB 4.07Å; E253-K258 HydrophobicContact CG-CD 4.39Å; E253-K258 PolarHBondContact O-N 2.85Å; E253-K258 WeakPolarHBondContact OE1-CD 3.25Å; E253-K258 IonicContact OE1-NZ 2.63Å; E253-K258 PolarHBondContact OE1-NZ 3.39Å; E253-V261 HydrophobicContact CG-CB 4.22Å; E253-V261 HydrophobicContact CG-CG1 4.13Å; E253-M265 HydrophobicContact CB-SD 4.07Å; E253-M265 HydrophobicContact CG-SD 4.33Å |
| 254 | I | 91.1 | Very high | 91.6 | Very high | 66 Ų | 66 | 51 Ų | 51 | 34% | 0.338 | 30% | 0.3 | S | S | . | . | H | α-helix | trans | -62.8 | -41.9 | 171.5 | -65.6 | 170 | 0 | 0 | 0 | 110.5 | A250 F251 N256 G257 I266 | A250-I254 VanDerWaalsContact O-CG1 3.31Å; A250-I254 WeakPolarHBondContact O-CG1 3.44Å; A250-I254 PolarHBondContact O-N 3.1Å; A250-I254 VanDerWaalsContact O-N 3.1Å; F251-I254 HydrophobicContact CD1-CD1 4.46Å; F251-I254 PolarHBondContact O-N 2.65Å; I254-N256 VanDerWaalsContact C-N 3.28Å; I254-N256 PolarHBondContact O-N 2.85Å; I254-G257 PolarHBondContact O-N 2.96Å; I254-G257 VanDerWaalsContact O-N 3.1Å; I254-I266 HydrophobicContact CD1-CD1 4.26Å; I254-I266 HydrophobicContact CD1-CG1 3.87Å |
| 255 | G | 89.3 | Confident | 91.7 | Very high | 65 Ų | 65 | 51 Ų | 51 | 67% | 0.67 | 30% | 0.3 | S | S | * | . | H | α-helix | trans | -62.3 | -33.5 | 177.5 | 0 | 0 | 0 | 0 | 0 | 113.3 | F251 S252 E253 G257 | F251-G255 PolarHBondContact O-N 2.94Å; S252-G255 PolarHBondContact O-N 3.21Å; E253-G255 VanDerWaalsContact C-N 3.32Å; G255-G257 PolarHBondContact O-N 2.74Å |
| 256 | N | 88.3 | Confident | 91.8 | Very high | 106 Ų | 106 | 52.7 Ų | 52.7 | 57% | 0.567 | 31% | 0.309 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -77 | 4.8 | 175.6 | -66.4 | -31.8 | 0 | 0 | 0 | 113.8 | S252 E253 I254 | S252-N256 VanDerWaalsContact O-CG 3.31Å; S252-N256 PolarHBondContact O-N 2.83Å; S252-N256 PolarHBondContact O-ND2 3.22Å; E253-N256 PolarHBondContact O-N 3.17Å; I254-N256 VanDerWaalsContact C-N 3.28Å; I254-N256 PolarHBondContact O-N 2.85Å |
| 257 | G | 86.3 | Confident | 92 | Very high | 54 Ų | 54 | 57.7 Ų | 57.7 | 56% | 0.557 | 33% | 0.334 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 89 | -0.9 | 176 | 0 | 0 | 0 | 0 | 0 | 115 | I254 G255 K259 | I254-G257 PolarHBondContact O-N 2.96Å; I254-G257 VanDerWaalsContact O-N 3.1Å; G255-G257 PolarHBondContact O-N 2.74Å; G257-K259 PolarHBondContact O-N 3.34Å |
| 258 | K | 87.7 | Confident | 92 | Very high | 58 Ų | 58 | 53.9 Ų | 53.9 | 25% | 0.252 | 32% | 0.32 | S | S | . | . | trans | -96.2 | 69.1 | -174.6 | -63.9 | 163 | 171.4 | -162.1 | 0 | 111.3 | D176 E253 A260 G262 | D176-K258 WeakPolarHBondContact OD2-CD 3.36Å; D176-K258 WeakPolarHBondContact OD2-CE 3.47Å; D176-K258 IonicContact OD2-NZ 3.46Å; D176-K258 PolarHBondContact OD2-NZ 2.93Å; E253-K258 HydrophobicContact CG-CB 4.07Å; E253-K258 HydrophobicContact CG-CD 4.39Å; E253-K258 PolarHBondContact O-N 2.85Å; E253-K258 WeakPolarHBondContact OE1-CD 3.25Å; E253-K258 IonicContact OE1-NZ 2.63Å; E253-K258 PolarHBondContact OE1-NZ 3.39Å; K258-A260 VanDerWaalsContact C-N 3.29Å; K258-A260 PolarHBondContact O-N 3.32Å; K258-G262 PolarHBondContact O-N 3.17Å; K258-G262 VanDerWaalsContact O-N 3.13Å | ||
| 259 | K | 89.8 | Confident | 92.2 | Very high | 164 Ų | 164 | 49.9 Ų | 49.9 | 71% | 0.713 | 30% | 0.299 | S | S | * | . | H | α-helix | trans | -61.1 | -32.1 | -170.4 | -59.8 | -178.7 | -176.5 | 178.1 | 0 | 114.1 | G257 G263 | G257-K259 PolarHBondContact O-N 3.34Å; K259-G263 PolarHBondContact O-N 3.17Å |
| 260 | A | 90.9 | Very high | 92.5 | Very high | 80 Ų | 80 | 51.8 Ų | 51.8 | 66% | 0.661 | 31% | 0.312 | S | S | * | . | H | α-helix | trans | -69.1 | -52.9 | -177.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | K258 G263 I264 | K258-A260 VanDerWaalsContact C-N 3.29Å; K258-A260 PolarHBondContact O-N 3.32Å; A260-G263 PolarHBondContact O-N 3.24Å; A260-I264 PolarHBondContact O-N 2.82Å |
| 261 | V | 91.8 | Very high | 92.7 | Very high | 15 Ų | 15 | 53.4 Ų | 53.4 | 9% | 0.091 | 32% | 0.321 | C | S | . | . | H | α-helix | trans | -62.5 | -47.5 | 177.6 | -179.7 | 0 | 0 | 0 | 0 | 110 | Y173 D176 E253 G263 I264 M265 | Y173-V261 HydrophobicContact CD2-CG1 4.39Å; D176-V261 HydrophobicContact CB-CG2 4.13Å; E253-V261 HydrophobicContact CG-CB 4.22Å; E253-V261 HydrophobicContact CG-CG1 4.13Å; V261-G263 VanDerWaalsContact C-N 3.26Å; V261-G263 PolarHBondContact O-N 2.82Å; V261-I264 WeakPolarHBondContact O-CB 3.41Å; V261-I264 PolarHBondContact O-N 3.19Å; V261-M265 HydrophobicContact CG1-CG 4.43Å; V261-M265 HydrophobicContact CG1-SD 4.01Å; V261-M265 WeakPolarHBondContact O-CG 3.16Å; V261-M265 PolarHBondContact O-N 2.97Å |
| 262 | G | 92.8 | Very high | 92.8 | Very high | 0 Ų | 0 | 47.7 Ų | 47.7 | 0% | 0 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -56.1 | -39 | 175.4 | 0 | 0 | 0 | 0 | 0 | 113.3 | K258 M265 I266 | K258-G262 PolarHBondContact O-N 3.17Å; K258-G262 VanDerWaalsContact O-N 3.13Å; G262-M265 PolarHBondContact O-N 2.92Å; G262-I266 WeakPolarHBondContact O-CG1 3.23Å; G262-I266 PolarHBondContact O-N 3.4Å |
| 263 | G | 93.3 | Very high | 93.1 | Very high | 30 Ų | 30 | 47.3 Ų | 47.3 | 31% | 0.309 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -61.8 | -42 | 174.7 | 0 | 0 | 0 | 0 | 0 | 113.6 | K259 A260 V261 M265 I266 I267 | K259-G263 PolarHBondContact O-N 3.17Å; A260-G263 PolarHBondContact O-N 3.24Å; V261-G263 VanDerWaalsContact C-N 3.26Å; V261-G263 PolarHBondContact O-N 2.82Å; G263-M265 VanDerWaalsContact C-N 3.33Å; G263-I266 PolarHBondContact O-N 3.06Å; G263-I267 PolarHBondContact O-N 2.93Å |
| 264 | I | 93.9 | Very high | 93.5 | Very high | 77 Ų | 77 | 51.3 Ų | 51.3 | 40% | 0.395 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -63.4 | -42.9 | 174.9 | -62.6 | 168.3 | 0 | 0 | 0 | 110.2 | A169 A172 A260 V261 I266 I267 V268 | A169-I264 HydrophobicContact CB-CG2 3.96Å; A172-I264 HydrophobicContact CB-CD1 4.48Å; A260-I264 PolarHBondContact O-N 2.82Å; V261-I264 WeakPolarHBondContact O-CB 3.41Å; V261-I264 PolarHBondContact O-N 3.19Å; I264-I266 VanDerWaalsContact C-N 3.33Å; I264-I266 PolarHBondContact O-N 3.35Å; I264-I267 WeakPolarHBondContact O-CB 3.15Å; I264-I267 PolarHBondContact O-N 3.37Å; I264-V268 PolarHBondContact O-N 3.35Å |
| 265 | M | 94.7 | Very high | 93.7 | Very high | 1 Ų | 1 | 48.4 Ų | 48.4 | 1% | 0.005 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -64.8 | -35.5 | 178.4 | -61.1 | 173.4 | 90.8 | 0 | 0 | 112.1 | A169 Y173 S249 A250 E253 V261 G262 G263 I267 V268 A269 | A169-M265 HydrophobicContact CB-CG 4.44Å; Y173-M265 HydrophobicContact CD1-CE 3.77Å; Y173-M265 HydrophobicContact CE1-CE 3.97Å; Y173-M265 HydrophobicContact CG-CE 4.38Å; S249-M265 VanDerWaalsContact CB-CE 3.43Å; A250-M265 HydrophobicContact CB-CB 3.6Å; E253-M265 HydrophobicContact CB-SD 4.07Å; E253-M265 HydrophobicContact CG-SD 4.33Å; V261-M265 HydrophobicContact CG1-CG 4.43Å; V261-M265 HydrophobicContact CG1-SD 4.01Å; V261-M265 WeakPolarHBondContact O-CG 3.16Å; V261-M265 PolarHBondContact O-N 2.97Å; G262-M265 PolarHBondContact O-N 2.92Å; G263-M265 VanDerWaalsContact C-N 3.33Å; M265-I267 VanDerWaalsContact C-N 3.33Å; M265-I267 PolarHBondContact O-N 3.39Å; M265-V268 PolarHBondContact O-N 2.93Å; M265-A269 WeakPolarHBondContact O-CB 2.97Å; M265-A269 PolarHBondContact O-N 2.97Å |
| 266 | I | 96.6 | Very high | 94 | Very high | 37 Ų | 37 | 45.9 Ų | 45.9 | 19% | 0.19 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -60.8 | -41.6 | 173.1 | -70.3 | -67.4 | 0 | 0 | 0 | 111.4 | W247 A250 F251 I254 G262 G263 I264 V268 A269 C270 | W247-I266 HydrophobicContact CE3-CD1 3.83Å; W247-I266 HydrophobicContact CZ3-CD1 3.69Å; W247-I266 HydrophobicContact CZ3-CG2 4.4Å; A250-I266 HydrophobicContact CB-CD1 3.62Å; A250-I266 HydrophobicContact CB-CG1 3.94Å; F251-I266 HydrophobicContact CD1-CD1 4.09Å; F251-I266 HydrophobicContact CE1-CD1 3.72Å; F251-I266 HydrophobicContact CZ-CD1 4.26Å; I254-I266 HydrophobicContact CD1-CD1 4.26Å; I254-I266 HydrophobicContact CD1-CG1 3.87Å; G262-I266 WeakPolarHBondContact O-CG1 3.23Å; G262-I266 PolarHBondContact O-N 3.4Å; G263-I266 PolarHBondContact O-N 3.06Å; I264-I266 VanDerWaalsContact C-N 3.33Å; I264-I266 PolarHBondContact O-N 3.35Å; I266-V268 VanDerWaalsContact C-N 3.31Å; I266-V268 PolarHBondContact O-N 3.42Å; I266-A269 PolarHBondContact O-N 3.24Å; I266-C270 WeakPolarHBondContact O-CB 3.13Å; I266-C270 PolarHBondContact O-N 3.34Å; I266-C270 PolarHBondContact O-SG 3.3Å; I266-C270 VanDerWaalsContact O-SG 3.35Å |
| 267 | I | 96.4 | Very high | 94.5 | Very high | 105 Ų | 105 | 44.9 Ų | 44.9 | 54% | 0.538 | 27% | 0.268 | S | S | . | . | H | α-helix | trans | -60.8 | -44.9 | 177.3 | -63.2 | 168.4 | 0 | 0 | 0 | 109.9 | G263 I264 M265 C270 L271 | G263-I267 PolarHBondContact O-N 2.93Å; I264-I267 WeakPolarHBondContact O-CB 3.15Å; I264-I267 PolarHBondContact O-N 3.37Å; M265-I267 VanDerWaalsContact C-N 3.33Å; M265-I267 PolarHBondContact O-N 3.39Å; I267-C270 WeakPolarHBondContact O-CB 3.48Å; I267-C270 PolarHBondContact O-N 3.42Å; I267-L271 HydrophobicContact CG2-CD1 4.33Å; I267-L271 WeakPolarHBondContact O-CG 3.5Å; I267-L271 PolarHBondContact O-N 2.84Å |
| 268 | V | 96.8 | Very high | 94.9 | Very high | 3 Ų | 3 | 45.5 Ų | 45.5 | 2% | 0.018 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -64.2 | -43 | 177.3 | 175 | 0 | 0 | 0 | 0 | 111.7 | L165 N166 A169 I264 M265 I266 C270 L271 F272 | L165-V268 HydrophobicContact CB-CG2 4.25Å; N166-V268 HydrophobicContact CB-CG1 3.82Å; A169-V268 HydrophobicContact CB-CG2 3.8Å; I264-V268 PolarHBondContact O-N 3.35Å; M265-V268 PolarHBondContact O-N 2.93Å; I266-V268 VanDerWaalsContact C-N 3.31Å; I266-V268 PolarHBondContact O-N 3.42Å; V268-C270 VanDerWaalsContact C-N 3.32Å; V268-C270 PolarHBondContact O-N 3.47Å; V268-L271 PolarHBondContact O-N 2.91Å; V268-L271 VanDerWaalsContact O-N 3.13Å; V268-F272 HydrophobicContact CG1-CD2 3.69Å; V268-F272 HydrophobicContact CG1-CE2 3.48Å; V268-F272 VanDerWaalsContact CG1-CE2 3.48Å; V268-F272 WeakPolarHBondContact O-CD2 3.45Å; V268-F272 PolarHBondContact O-N 3.13Å |
| 269 | A | 96.9 | Very high | 95.2 | Very high | 0 Ų | 0 | 42.9 Ų | 42.9 | 0% | 0 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -60.2 | -41.3 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | W247 M265 I266 F272 T273 | W247-A269 HydrophobicContact CD2-CB 3.84Å; W247-A269 HydrophobicContact CE3-CB 4.3Å; W247-A269 HydrophobicContact CG-CB 3.99Å; W247-A269 HydrophobicContact CZ2-CB 4.49Å; M265-A269 WeakPolarHBondContact O-CB 2.97Å; M265-A269 PolarHBondContact O-N 2.97Å; I266-A269 PolarHBondContact O-N 3.24Å; A269-F272 PolarHBondContact O-N 2.9Å; A269-T273 WeakPolarHBondContact O-CB 3.27Å; A269-T273 PolarHBondContact O-N 3Å; A269-T273 PolarHBondContact O-OG1 3.14Å |
| 270 | C | 97.4 | Very high | 95.5 | Very high | 47 Ų | 47 | 38 Ų | 38 | 32% | 0.318 | 23% | 0.23 | S | C | . | . | H | α-helix | trans | -60.9 | -45.2 | 172.6 | -75.2 | 0 | 0 | 0 | 0 | 111.6 | I266 I267 V268 T273 I274 | I266-C270 WeakPolarHBondContact O-CB 3.13Å; I266-C270 PolarHBondContact O-N 3.34Å; I266-C270 PolarHBondContact O-SG 3.3Å; I266-C270 VanDerWaalsContact O-SG 3.35Å; I267-C270 WeakPolarHBondContact O-CB 3.48Å; I267-C270 PolarHBondContact O-N 3.42Å; V268-C270 VanDerWaalsContact C-N 3.32Å; V268-C270 PolarHBondContact O-N 3.47Å; C270-T273 WeakPolarHBondContact O-CB 3.11Å; C270-T273 PolarHBondContact O-N 3.37Å; C270-I274 WeakPolarHBondContact O-CB 3.02Å; C270-I274 VanDerWaalsContact O-CG1 3.26Å; C270-I274 WeakPolarHBondContact O-CG1 3Å; C270-I274 PolarHBondContact O-N 2.79Å |
| 271 | L | 97.5 | Very high | 95.6 | Very high | 35 Ų | 35 | 37.5 Ų | 37.5 | 18% | 0.183 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -62.9 | -44.8 | 178.2 | -69.3 | 172.1 | 0 | 0 | 0 | 112.1 | F158 T162 L165 I267 V268 T273 I274 G275 | F158-L271 VanDerWaalsContact CE1-O 3.31Å; F158-L271 WeakPolarHBondContact CE1-O 3.39Å; F158-L271 HydrophobicContact CE2-CD2 3.8Å; F158-L271 HydrophobicContact CZ-CB 4.18Å; F158-L271 HydrophobicContact CZ-CD2 3.77Å; F158-L271 WeakPolarHBondContact CZ-O 3.32Å; T162-L271 HydrophobicContact CG2-CB 3.71Å; L165-L271 HydrophobicContact CD1-CD1 3.46Å; L165-L271 VanDerWaalsContact CD1-CD1 3.46Å; I267-L271 HydrophobicContact CG2-CD1 4.33Å; I267-L271 WeakPolarHBondContact O-CG 3.5Å; I267-L271 PolarHBondContact O-N 2.84Å; V268-L271 PolarHBondContact O-N 2.91Å; V268-L271 VanDerWaalsContact O-N 3.13Å; L271-T273 VanDerWaalsContact C-N 3.3Å; L271-T273 PolarHBondContact O-N 2.94Å; L271-I274 PolarHBondContact O-N 2.82Å; L271-G275 PolarHBondContact O-N 3.3Å |
| 272 | F | 97.2 | Very high | 95.6 | Very high | 1 Ų | 1 | 37 Ų | 37 | 0% | 0.004 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -61.5 | -38.8 | 173.8 | -79.4 | -56.6 | 0 | 0 | 0 | 112.2 | Y159 T162 L163 N166 V232 Q235 A236 V268 A269 G275 A276 | Y159-F272 HydrophobicContact CE2-CE1 4.29Å; T162-F272 HydrophobicContact CG2-CD1 3.57Å; T162-F272 HydrophobicContact CG2-CD2 4.2Å; T162-F272 HydrophobicContact CG2-CE1 3.62Å; T162-F272 HydrophobicContact CG2-CE2 4.26Å; T162-F272 HydrophobicContact CG2-CG 3.86Å; T162-F272 HydrophobicContact CG2-CZ 3.98Å; L163-F272 HydrophobicContact CD2-CE1 4.21Å; L163-F272 HydrophobicContact CD2-CZ 4.23Å; N166-F272 HydrophobicContact CB-CE2 3.9Å; N166-F272 HydrophobicContact CB-CZ 3.86Å; V232-F272 HydrophobicContact CG2-CD1 4.13Å; Q235-F272 HydrophobicContact CB-CD1 3.86Å; Q235-F272 HydrophobicContact CB-CD2 4.35Å; Q235-F272 HydrophobicContact CB-CE1 3.85Å; Q235-F272 HydrophobicContact CB-CE2 4.33Å; Q235-F272 HydrophobicContact CB-CG 4.13Å; Q235-F272 HydrophobicContact CB-CZ 4.09Å; Q235-F272 HydrophobicContact CG-CE1 4.37Å; A236-F272 HydrophobicContact CB-CB 3.81Å; V268-F272 HydrophobicContact CG1-CD2 3.69Å; V268-F272 HydrophobicContact CG1-CE2 3.48Å; V268-F272 VanDerWaalsContact CG1-CE2 3.48Å; V268-F272 WeakPolarHBondContact O-CD2 3.45Å; V268-F272 PolarHBondContact O-N 3.13Å; A269-F272 PolarHBondContact O-N 2.9Å; F272-G275 PolarHBondContact O-N 3.42Å; F272-A276 PolarHBondContact O-N 2.87Å |
| 273 | T | 97.4 | Very high | 95.6 | Very high | 48 Ų | 48 | 38.8 Ų | 38.8 | 29% | 0.294 | 23% | 0.225 | S | C | . | . | H | α-helix | trans | -65.5 | -45.7 | 177 | -55.2 | 0 | 0 | 0 | 0 | 111.5 | W247 A269 C270 L271 G275 A276 V277 | W247-T273 PolarHBondContact NE1-OG1 3.35Å; A269-T273 WeakPolarHBondContact O-CB 3.27Å; A269-T273 PolarHBondContact O-N 3Å; A269-T273 PolarHBondContact O-OG1 3.14Å; C270-T273 WeakPolarHBondContact O-CB 3.11Å; C270-T273 PolarHBondContact O-N 3.37Å; L271-T273 VanDerWaalsContact C-N 3.3Å; L271-T273 PolarHBondContact O-N 2.94Å; T273-G275 VanDerWaalsContact C-N 3.29Å; T273-G275 PolarHBondContact O-N 2.78Å; T273-A276 WeakPolarHBondContact O-CB 3.15Å; T273-A276 PolarHBondContact O-N 3.49Å; T273-V277 WeakPolarHBondContact O-CG2 3.42Å; T273-V277 PolarHBondContact O-N 2.96Å |
| 274 | I | 97.4 | Very high | 95.4 | Very high | 85 Ų | 85 | 44.5 Ų | 44.5 | 44% | 0.436 | 24% | 0.241 | S | C | . | . | H | α-helix | trans | -59.9 | -43.6 | 174.4 | -69.5 | 163.4 | 0 | 0 | 0 | 109.7 | F158 C270 L271 A276 V277 M278 | F158-I274 HydrophobicContact CE1-CG2 4.44Å; F158-I274 HydrophobicContact CZ-CB 4.2Å; F158-I274 HydrophobicContact CZ-CG2 3.94Å; C270-I274 WeakPolarHBondContact O-CB 3.02Å; C270-I274 VanDerWaalsContact O-CG1 3.26Å; C270-I274 WeakPolarHBondContact O-CG1 3Å; C270-I274 PolarHBondContact O-N 2.79Å; L271-I274 PolarHBondContact O-N 2.82Å; I274-A276 PolarHBondContact O-N 3.18Å; I274-V277 PolarHBondContact O-N 3.23Å; I274-M278 HydrophobicContact CG2-CE 3.72Å; I274-M278 HydrophobicContact CG2-CG 4.39Å; I274-M278 HydrophobicContact CG2-SD 4.15Å; I274-M278 WeakPolarHBondContact O-CB 3.26Å; I274-M278 WeakPolarHBondContact O-CG 3.47Å; I274-M278 PolarHBondContact O-N 3.49Å |
| 275 | G | 95.6 | Very high | 95.2 | Very high | 5 Ų | 5 | 44 Ų | 44 | 5% | 0.052 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -55.6 | -49.5 | 172.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | L271 F272 T273 V277 M278 S279 | L271-G275 PolarHBondContact O-N 3.3Å; F272-G275 PolarHBondContact O-N 3.42Å; T273-G275 VanDerWaalsContact C-N 3.29Å; T273-G275 PolarHBondContact O-N 2.78Å; G275-V277 PolarHBondContact O-N 3.35Å; G275-M278 PolarHBondContact O-N 3.03Å; G275-S279 WeakPolarHBondContact O-CB 3.33Å; G275-S279 PolarHBondContact O-N 2.9Å; G275-S279 PolarHBondContact O-OG 3.4Å |
| 276 | A | 96.5 | Very high | 94.8 | Very high | 12 Ų | 12 | 43.9 Ų | 43.9 | 10% | 0.099 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -57.7 | -48.2 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112.3 | V232 I233 F272 T273 I274 S279 V280 | V232-A276 HydrophobicContact CG1-CB 3.56Å; I233-A276 HydrophobicContact CG1-CB 4.05Å; F272-A276 PolarHBondContact O-N 2.87Å; T273-A276 WeakPolarHBondContact O-CB 3.15Å; T273-A276 PolarHBondContact O-N 3.49Å; I274-A276 PolarHBondContact O-N 3.18Å; A276-S279 PolarHBondContact O-N 3.39Å; A276-V280 WeakPolarHBondContact O-CG2 3.4Å; A276-V280 PolarHBondContact O-N 2.9Å |
| 277 | V | 97.1 | Very high | 94.4 | Very high | 86 Ų | 86 | 46.6 Ų | 46.6 | 52% | 0.521 | 25% | 0.249 | S | C | . | . | H | α-helix | trans | -63 | -47 | 179.2 | 176 | 0 | 0 | 0 | 0 | 110.7 | T273 I274 G275 S279 V280 V281 | T273-V277 WeakPolarHBondContact O-CG2 3.42Å; T273-V277 PolarHBondContact O-N 2.96Å; I274-V277 PolarHBondContact O-N 3.23Å; G275-V277 PolarHBondContact O-N 3.35Å; V277-S279 VanDerWaalsContact C-N 3.33Å; V277-S279 PolarHBondContact O-N 3.09Å; V277-V280 PolarHBondContact O-N 3.09Å; V277-V281 HydrophobicContact CG1-CG2 4.43Å; V277-V281 WeakPolarHBondContact O-CG2 3.31Å; V277-V281 PolarHBondContact O-N 3.46Å |
| 278 | M | 94.8 | Very high | 93.8 | Very high | 67 Ų | 67 | 43.9 Ų | 43.9 | 33% | 0.33 | 24% | 0.24 | S | C | . | . | H | α-helix | trans | -61.7 | -40.8 | 177.5 | -70.7 | -172 | -58.3 | 0 | 0 | 112 | L155 F158 I274 G275 V281 L282 | L155-M278 HydrophobicContact CD1-CB 3.64Å; L155-M278 HydrophobicContact CD1-CE 4.04Å; F158-M278 HydrophobicContact CD1-CE 3.46Å; F158-M278 VanDerWaalsContact CD1-CE 3.46Å; F158-M278 HydrophobicContact CD2-CE 4.22Å; F158-M278 HydrophobicContact CE1-CE 3.59Å; F158-M278 HydrophobicContact CE2-CE 4.31Å; F158-M278 HydrophobicContact CG-CE 3.8Å; F158-M278 HydrophobicContact CZ-CE 4.02Å; I274-M278 HydrophobicContact CG2-CE 3.72Å; I274-M278 HydrophobicContact CG2-CG 4.39Å; I274-M278 HydrophobicContact CG2-SD 4.15Å; I274-M278 WeakPolarHBondContact O-CB 3.26Å; I274-M278 WeakPolarHBondContact O-CG 3.47Å; I274-M278 PolarHBondContact O-N 3.49Å; G275-M278 PolarHBondContact O-N 3.03Å; M278-V281 PolarHBondContact O-N 3.34Å; M278-L282 WeakPolarHBondContact O-CB 3.45Å; M278-L282 WeakPolarHBondContact O-CG 3.44Å; M278-L282 PolarHBondContact O-N 3.39Å |
| 279 | S | 94.5 | Very high | 92.9 | Very high | 2 Ų | 2 | 45.1 Ų | 45.1 | 1% | 0.014 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -62.6 | -42.7 | 176.2 | -60.5 | 0 | 0 | 0 | 0 | 111.8 | L155 F225 G275 A276 V277 L282 L283 | L155-S279 WeakPolarHBondContact CD2-OG 3.35Å; F225-S279 WeakPolarHBondContact CE1-O 3.43Å; G275-S279 WeakPolarHBondContact O-CB 3.33Å; G275-S279 PolarHBondContact O-N 2.9Å; G275-S279 PolarHBondContact O-OG 3.4Å; A276-S279 PolarHBondContact O-N 3.39Å; V277-S279 VanDerWaalsContact C-N 3.33Å; V277-S279 PolarHBondContact O-N 3.09Å; S279-L282 PolarHBondContact O-N 2.95Å; S279-L283 WeakPolarHBondContact O-CB 3.33Å; S279-L283 PolarHBondContact O-N 3.39Å |
| 280 | V | 95.5 | Very high | 92 | Very high | 61 Ų | 61 | 47.1 Ų | 47.1 | 37% | 0.37 | 25% | 0.253 | S | S | . | . | H | α-helix | trans | -64.9 | -44.3 | 175.7 | 172.3 | 0 | 0 | 0 | 0 | 111.4 | V229 A276 V277 L282 L283 K284 | V229-V280 HydrophobicContact CG1-CG2 3.75Å; A276-V280 WeakPolarHBondContact O-CG2 3.4Å; A276-V280 PolarHBondContact O-N 2.9Å; V277-V280 PolarHBondContact O-N 3.09Å; V280-L282 VanDerWaalsContact C-N 3.34Å; V280-L282 PolarHBondContact O-N 3.06Å; V280-L283 PolarHBondContact O-N 3.5Å; V280-K284 WeakPolarHBondContact O-CG 3.42Å; V280-K284 PolarHBondContact O-N 3.08Å |
| 281 | V | 93.8 | Very high | 91 | Very high | 71 Ų | 71 | 54 Ų | 54 | 43% | 0.43 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -59.8 | -46.9 | 177 | 169.7 | 0 | 0 | 0 | 0 | 110.4 | V277 M278 K284 M285 | V277-V281 HydrophobicContact CG1-CG2 4.43Å; V277-V281 WeakPolarHBondContact O-CG2 3.31Å; V277-V281 PolarHBondContact O-N 3.46Å; M278-V281 PolarHBondContact O-N 3.34Å; V281-K284 PolarHBondContact O-N 2.91Å; V281-M285 HydrophobicContact CG1-CG 4.42Å; V281-M285 HydrophobicContact CG1-SD 4.1Å; V281-M285 WeakPolarHBondContact O-CG 3.49Å; V281-M285 PolarHBondContact O-N 3.36Å |
| 282 | L | 91.6 | Very high | 89.6 | Confident | 5 Ų | 5 | 62.1 Ų | 62.1 | 3% | 0.026 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -66.2 | -38.7 | 179 | -80.4 | 169.7 | 0 | 0 | 0 | 112.7 | V148 M151 M152 L155 M278 S279 V280 K284 M285 V286 | V148-L282 HydrophobicContact CG1-CD2 4.18Å; M151-L282 HydrophobicContact CB-CD1 4.25Å; M151-L282 HydrophobicContact CB-CD2 3.63Å; M151-L282 HydrophobicContact CE-CD2 3.94Å; M151-L282 HydrophobicContact SD-CD2 4.28Å; M152-L282 HydrophobicContact CE-CB 3.9Å; M152-L282 HydrophobicContact CE-CD1 4.49Å; L155-L282 HydrophobicContact CB-CD1 3.89Å; L155-L282 HydrophobicContact CD1-CD1 4.46Å; L155-L282 HydrophobicContact CD2-CD1 3.78Å; L155-L282 HydrophobicContact CG-CD1 4.26Å; M278-L282 WeakPolarHBondContact O-CB 3.45Å; M278-L282 WeakPolarHBondContact O-CG 3.44Å; M278-L282 PolarHBondContact O-N 3.39Å; S279-L282 PolarHBondContact O-N 2.95Å; V280-L282 VanDerWaalsContact C-N 3.34Å; V280-L282 PolarHBondContact O-N 3.06Å; L282-K284 VanDerWaalsContact C-N 3.3Å; L282-K284 PolarHBondContact O-N 3.21Å; L282-M285 HydrophobicContact CD2-SD 4.27Å; L282-M285 PolarHBondContact O-N 2.96Å; L282-V286 VanDerWaalsContact O-CG2 3.3Å; L282-V286 WeakPolarHBondContact O-CG2 3.4Å; L282-V286 PolarHBondContact O-N 3.18Å |
| 283 | L | 92.3 | Very high | 88 | Confident | 36 Ų | 36 | 64.6 Ų | 64.6 | 19% | 0.188 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -56.6 | -46.1 | 172.3 | -178.6 | 71.6 | 0 | 0 | 0 | 110.5 | F222 F225 S279 V280 H287 | F222-L283 HydrophobicContact CD1-CD1 3.75Å; F222-L283 HydrophobicContact CE1-CD1 4.3Å; F225-L283 HydrophobicContact CD1-CB 4.09Å; F225-L283 HydrophobicContact CD1-CD1 3.82Å; F225-L283 HydrophobicContact CE1-CB 3.98Å; S279-L283 WeakPolarHBondContact O-CB 3.33Å; S279-L283 PolarHBondContact O-N 3.39Å; V280-L283 PolarHBondContact O-N 3.5Å; L283-H287 WeakPolarHBondContact O-CB 3.49Å; L283-H287 PolarHBondContact O-N 2.83Å |
| 284 | K | 90.5 | Very high | 85.9 | Confident | 151 Ų | 151 | 65.1 Ų | 65.1 | 66% | 0.657 | 33% | 0.331 | S | S | * | . | H | α-helix | trans | -66.3 | -38.5 | 176.8 | -66.4 | -168 | 82.5 | 165.4 | 0 | 112.6 | V280 V281 L282 S288 | V280-K284 WeakPolarHBondContact O-CG 3.42Å; V280-K284 PolarHBondContact O-N 3.08Å; V281-K284 PolarHBondContact O-N 2.91Å; L282-K284 VanDerWaalsContact C-N 3.3Å; L282-K284 PolarHBondContact O-N 3.21Å; K284-S288 VanDerWaalsContact O-CB 3.27Å; K284-S288 WeakPolarHBondContact O-CB 2.76Å; K284-S288 PolarHBondContact O-N 2.98Å |
| 285 | M | 88.4 | Confident | 83.9 | Confident | 65 Ų | 65 | 61.5 Ų | 61.5 | 32% | 0.32 | 31% | 0.314 | S | S | . | . | H | α-helix | trans | -64.1 | -49.1 | 176.6 | -71.6 | -179.7 | 78.3 | 0 | 0 | 111.5 | V148 M151 V281 L282 H287 S288 M289 | V148-M285 HydrophobicContact CG2-CE 3.96Å; M151-M285 HydrophobicContact CE-SD 4.04Å; M151-M285 HydrophobicContact SD-CE 4.17Å; M151-M285 HydrophobicContact SD-SD 4.34Å; V281-M285 HydrophobicContact CG1-CG 4.42Å; V281-M285 HydrophobicContact CG1-SD 4.1Å; V281-M285 WeakPolarHBondContact O-CG 3.49Å; V281-M285 PolarHBondContact O-N 3.36Å; L282-M285 HydrophobicContact CD2-SD 4.27Å; L282-M285 PolarHBondContact O-N 2.96Å; M285-H287 VanDerWaalsContact C-N 3.34Å; M285-H287 PolarHBondContact O-N 3.16Å; M285-S288 PolarHBondContact O-N 3.38Å; M285-M289 WeakPolarHBondContact O-CG 2.86Å; M285-M289 PolarHBondContact O-N 3.26Å |
| 286 | V | 87.1 | Confident | 82 | Confident | 0 Ų | 0 | 63.6 Ų | 63.6 | 0% | 0 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -62.6 | -43.4 | 177.8 | -178.6 | 0 | 0 | 0 | 0 | 110.7 | V148 M152 F210 F218 F221 F222 L282 S288 M289 Y290 | V148-V286 HydrophobicContact CG1-CG2 3.56Å; M152-V286 HydrophobicContact CE-CG2 3.73Å; F210-V286 HydrophobicContact CZ-CG1 3.97Å; F210-V286 HydrophobicContact CZ-CG2 4.17Å; F218-V286 HydrophobicContact CD1-CG1 4.22Å; F218-V286 HydrophobicContact CE1-CG1 4.05Å; F221-V286 HydrophobicContact CD1-CG1 4.07Å; F221-V286 HydrophobicContact CE1-CB 3.96Å; F221-V286 HydrophobicContact CE1-CG1 3.58Å; F221-V286 HydrophobicContact CE1-CG2 4.1Å; F221-V286 HydrophobicContact CZ-CG1 4.45Å; F221-V286 HydrophobicContact CZ-CG2 4.22Å; F222-V286 HydrophobicContact CE1-CB 4.13Å; F222-V286 HydrophobicContact CE1-CG1 3.85Å; F222-V286 HydrophobicContact CZ-CB 4.39Å; F222-V286 HydrophobicContact CZ-CG1 3.74Å; L282-V286 VanDerWaalsContact O-CG2 3.3Å; L282-V286 WeakPolarHBondContact O-CG2 3.4Å; L282-V286 PolarHBondContact O-N 3.18Å; V286-S288 PolarHBondContact O-N 3Å; V286-M289 HydrophobicContact CG2-CE 4.4Å; V286-M289 PolarHBondContact O-N 3.4Å; V286-Y290 WeakPolarHBondContact O-CB 3.11Å; V286-Y290 PolarHBondContact O-N 3.15Å |
| 287 | H | 87 | Confident | 79.9 | Confident | 93 Ų | 93 | 69.9 Ų | 69.9 | 43% | 0.431 | 35% | 0.353 | S | S | . | . | H | α-helix | trans | -63.5 | -40.1 | 176.3 | -176.1 | -96.1 | 0 | 0 | 0 | 112.7 | F222 L283 M285 M289 Y290 R291 | F222-H287 HydrophobicContact CE1-CB 3.83Å; F222-H287 HydrophobicContact CZ-CB 4.09Å; L283-H287 WeakPolarHBondContact O-CB 3.49Å; L283-H287 PolarHBondContact O-N 2.83Å; M285-H287 VanDerWaalsContact C-N 3.34Å; M285-H287 PolarHBondContact O-N 3.16Å; H287-M289 VanDerWaalsContact C-N 3.33Å; H287-M289 PolarHBondContact O-N 2.68Å; H287-Y290 PolarHBondContact O-N 3.4Å; H287-R291 WeakPolarHBondContact O-CB 3.4Å; H287-R291 PolarHBondContact O-N 3.49Å |
| 288 | S | 83.6 | Confident | 77.8 | Confident | 49 Ų | 49 | 72.4 Ų | 72.4 | 34% | 0.343 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -64.6 | -38.2 | 175.8 | -176.1 | 0 | 0 | 0 | 0 | 112.1 | K284 M285 V286 R292 | K284-S288 VanDerWaalsContact O-CB 3.27Å; K284-S288 WeakPolarHBondContact O-CB 2.76Å; K284-S288 PolarHBondContact O-N 2.98Å; M285-S288 PolarHBondContact O-N 3.38Å; V286-S288 PolarHBondContact O-N 3Å; S288-R292 VanDerWaalsContact O-CG 3.3Å; S288-R292 WeakPolarHBondContact O-CG 3.49Å; S288-R292 PolarHBondContact O-N 2.94Å; S288-R292 VanDerWaalsContact O-N 3.16Å |
| 289 | M | 79.1 | Confident | 76.3 | Confident | 28 Ų | 28 | 72.4 Ų | 72.4 | 14% | 0.138 | 36% | 0.357 | C | S | . | . | H | α-helix | trans | -66.9 | -49.7 | 174.8 | -70 | -173 | -53.9 | 0 | 0 | 110.4 | Y145 V148 F210 M285 V286 H287 R291 R292 T293 | Y145-M289 HydrophobicContact CD1-CE 4.25Å; Y145-M289 HydrophobicContact CD1-SD 3.81Å; Y145-M289 HydrophobicContact CE1-CB 4.31Å; Y145-M289 HydrophobicContact CE1-SD 4.25Å; V148-M289 HydrophobicContact CB-CE 3.53Å; V148-M289 HydrophobicContact CB-SD 4.25Å; V148-M289 HydrophobicContact CG1-CE 3.56Å; V148-M289 HydrophobicContact CG2-CE 3.47Å; V148-M289 VanDerWaalsContact CG2-CE 3.47Å; V148-M289 HydrophobicContact CG2-SD 3.65Å; F210-M289 HydrophobicContact CE1-CE 3.59Å; F210-M289 HydrophobicContact CZ-CE 3.48Å; F210-M289 VanDerWaalsContact CZ-CE 3.48Å; M285-M289 WeakPolarHBondContact O-CG 2.86Å; M285-M289 PolarHBondContact O-N 3.26Å; V286-M289 HydrophobicContact CG2-CE 4.4Å; V286-M289 PolarHBondContact O-N 3.4Å; H287-M289 VanDerWaalsContact C-N 3.33Å; H287-M289 PolarHBondContact O-N 2.68Å; M289-R291 VanDerWaalsContact C-N 3.26Å; M289-R291 PolarHBondContact O-N 3.24Å; M289-R292 WeakPolarHBondContact O-CA 3.47Å; M289-R292 WeakPolarHBondContact O-CB 3.44Å; M289-R292 PolarHBondContact O-N 3.06Å; M289-T293 PolarHBondContact O-N 3.46Å; M289-T293 PolarHBondContact O-OG1 2.79Å |
| 290 | Y | 77.1 | Confident | 74.5 | Confident | 42 Ų | 42 | 72.9 Ų | 72.9 | 17% | 0.165 | 36% | 0.362 | C | S | . | . | H | α-helix | trans | -51.9 | -43.6 | 176.1 | 177.5 | -101.7 | 0 | 0 | 0 | 112.6 | F218 F222 V286 H287 T293 A295 | F218-Y290 HydrophobicContact CB-CD2 3.98Å; F218-Y290 HydrophobicContact CB-CE2 4.04Å; F218-Y290 HydrophobicContact CD1-CD2 4.36Å; F218-Y290 HydrophobicContact CD2-CD2 4.14Å; F218-Y290 AromaticContact CG-CD2 3.92Å; F218-Y290 HydrophobicContact CG-CD2 3.92Å; F218-Y290 HydrophobicContact CG-CE2 4.37Å; F222-Y290 HydrophobicContact CE2-CD1 4.18Å; F222-Y290 HydrophobicContact CE2-CD2 4.3Å; F222-Y290 AromaticContact CE2-CG 3.94Å; F222-Y290 HydrophobicContact CE2-CG 3.94Å; F222-Y290 HydrophobicContact CZ-CG 4.31Å; V286-Y290 WeakPolarHBondContact O-CB 3.11Å; V286-Y290 PolarHBondContact O-N 3.15Å; H287-Y290 PolarHBondContact O-N 3.4Å; Y290-T293 PolarHBondContact O-N 3.1Å; Y290-A295 HydrophobicContact CD2-CB 3.87Å; Y290-A295 HydrophobicContact CE2-CB 3.41Å; Y290-A295 VanDerWaalsContact CE2-CB 3.41Å; Y290-A295 VanDerWaalsContact CZ-O 3.28Å; Y290-A295 PolarHBondContact OH-O 2.92Å |
| 291 | R | 76.4 | Confident | 72.7 | Confident | 192 Ų | 192 | 75.8 Ų | 75.8 | 73% | 0.725 | 37% | 0.371 | S | S | * | . | H | α-helix | trans | -65.3 | -34.2 | 174.5 | -87.6 | -117 | -57.5 | 155.2 | 6.4 | 114.3 | H287 M289 | H287-R291 WeakPolarHBondContact O-CB 3.4Å; H287-R291 PolarHBondContact O-N 3.49Å; M289-R291 VanDerWaalsContact C-N 3.26Å; M289-R291 PolarHBondContact O-N 3.24Å |
| 292 | R | 69.6 | Low | 71.3 | Confident | 206 Ų | 206 | 78.1 Ų | 78.1 | 78% | 0.777 | 38% | 0.378 | S | S | * | . | H | α-helix | trans | -75.3 | -31.2 | -179.8 | -77.8 | 173.9 | 172.5 | 179.1 | -3.1 | 112 | S288 M289 G294 | S288-R292 VanDerWaalsContact O-CG 3.3Å; S288-R292 WeakPolarHBondContact O-CG 3.49Å; S288-R292 PolarHBondContact O-N 2.94Å; S288-R292 VanDerWaalsContact O-N 3.16Å; M289-R292 WeakPolarHBondContact O-CA 3.47Å; M289-R292 WeakPolarHBondContact O-CB 3.44Å; M289-R292 PolarHBondContact O-N 3.06Å; R292-G294 PolarHBondContact O-N 3.18Å |
| 293 | T | 62.1 | Low | 70.2 | Confident | 52 Ų | 52 | 80.2 Ų | 80.2 | 32% | 0.319 | 39% | 0.387 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -75.9 | -2.8 | 179.4 | -35.4 | 0 | 0 | 0 | 0 | 113.3 | Y145 M289 Y290 A295 | Y145-T293 WeakPolarHBondContact OH-CG2 3.22Å; Y145-T293 PolarHBondContact OH-OG1 3.47Å; M289-T293 PolarHBondContact O-N 3.46Å; M289-T293 PolarHBondContact O-OG1 2.79Å; Y290-T293 PolarHBondContact O-N 3.1Å; T293-A295 PolarHBondContact O-N 3.34Å |
| 294 | G | 55 | Low | 69 | Low | 59 Ų | 59 | 84.1 Ų | 84.1 | 61% | 0.608 | 40% | 0.403 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 68 | 14.3 | 178.5 | 0 | 0 | 0 | 0 | 0 | 114.4 | R292 S296 | R292-G294 PolarHBondContact O-N 3.18Å; G294-S296 PolarHBondContact O-N 3.44Å |
| 295 | A | 55.3 | Low | 67.6 | Low | 10 Ų | 10 | 79.7 Ų | 79.7 | 8% | 0.083 | 39% | 0.391 | C | S | . | . | trans | -68.5 | 114.4 | 176.7 | 0 | 0 | 0 | 0 | 0 | 109.7 | Y290 T293 | Y290-A295 HydrophobicContact CD2-CB 3.87Å; Y290-A295 HydrophobicContact CE2-CB 3.41Å; Y290-A295 VanDerWaalsContact CE2-CB 3.41Å; Y290-A295 VanDerWaalsContact CZ-O 3.28Å; Y290-A295 PolarHBondContact OH-O 2.92Å; T293-A295 PolarHBondContact O-N 3.34Å | ||
| 296 | S | 54.6 | Low | 66.2 | Low | 49 Ų | 49 | 82.7 Ų | 82.7 | 34% | 0.343 | 40% | 0.404 | S | S | . | . | trans | -105 | 160.4 | 178.6 | 71.2 | 0 | 0 | 0 | 0 | 110.9 | G294 Q298 K299 A300 | G294-S296 PolarHBondContact O-N 3.44Å; S296-Q298 PolarHBondContact O-N 3.24Å; S296-Q298 PolarHBondContact OG-N 3.2Å; S296-K299 WeakPolarHBondContact O-CB 3.37Å; S296-K299 PolarHBondContact O-N 3.44Å; S296-K299 PolarHBondContact OG-N 3.18Å; S296-A300 PolarHBondContact O-N 3.26Å | ||
| 297 | F | 52.7 | Low | 64.7 | Low | 143 Ų | 143 | 84.7 Ų | 84.7 | 63% | 0.627 | 42% | 0.424 | S | S | * | . | H | α-helix | trans | -55 | -32.1 | 171.4 | -176.8 | -98.9 | 0 | 0 | 0 | 112.1 | A300 Q301 | F297-A300 WeakPolarHBondContact O-CB 3.37Å; F297-A300 PolarHBondContact O-N 3.44Å; F297-Q301 PolarHBondContact O-N 3.01Å |
| 298 | Q | 53.3 | Low | 63.2 | Low | 140 Ų | 140 | 83.7 Ų | 83.7 | 65% | 0.654 | 43% | 0.425 | S | S | * | . | H | α-helix | trans | -66.3 | -40.4 | 174.8 | -72.3 | 165.3 | -35.2 | 0 | 0 | 112.4 | S296 A300 Q301 Q302 | S296-Q298 PolarHBondContact O-N 3.24Å; S296-Q298 PolarHBondContact OG-N 3.2Å; Q298-A300 VanDerWaalsContact C-N 3.33Å; Q298-Q301 PolarHBondContact O-N 2.91Å; Q298-Q302 WeakPolarHBondContact O-CB 3.49Å; Q298-Q302 WeakPolarHBondContact O-CG 3.38Å; Q298-Q302 PolarHBondContact O-N 3.22Å |
| 299 | K | 63.2 | Low | 61.9 | Low | 66 Ų | 66 | 86 Ų | 86 | 29% | 0.287 | 44% | 0.436 | S | S | . | . | H | α-helix | trans | -63.1 | -39.7 | 172.1 | -169.2 | -173.7 | 174.7 | -165.6 | 0 | 110.9 | D213 S296 Q302 E303 | D213-K299 IonicContact OD2-NZ 2.99Å; D213-K299 PolarHBondContact OD2-NZ 3.44Å; S296-K299 WeakPolarHBondContact O-CB 3.37Å; S296-K299 PolarHBondContact O-N 3.44Å; S296-K299 PolarHBondContact OG-N 3.18Å; K299-Q302 PolarHBondContact O-N 2.9Å; K299-E303 WeakPolarHBondContact CE-OE1 3.1Å; K299-E303 WeakPolarHBondContact O-CB 3.43Å; K299-E303 WeakPolarHBondContact O-CG 3.45Å; K299-E303 PolarHBondContact O-N 3.28Å |
| 300 | A | 56.6 | Low | 60.6 | Low | 13 Ų | 13 | 88.8 Ų | 88.8 | 11% | 0.107 | 46% | 0.455 | C | S | . | . | H | α-helix | trans | -64.9 | -39.2 | 175 | 0 | 0 | 0 | 0 | 0 | 113.2 | S296 F297 Q298 E303 F304 | S296-A300 PolarHBondContact O-N 3.26Å; F297-A300 WeakPolarHBondContact O-CB 3.37Å; F297-A300 PolarHBondContact O-N 3.44Å; Q298-A300 VanDerWaalsContact C-N 3.33Å; A300-E303 PolarHBondContact O-N 2.89Å; A300-F304 WeakPolarHBondContact O-CB 3.41Å; A300-F304 PolarHBondContact O-N 3.34Å |
| 301 | Q | 57.3 | Low | 59.2 | Low | 122 Ų | 122 | 89.1 Ų | 89.1 | 57% | 0.57 | 46% | 0.464 | S | S | * | . | H | α-helix | trans | -67.9 | -38.8 | 175.4 | -169.8 | 176.7 | -3.6 | 0 | 0 | 111.2 | F297 Q298 F304 S305 | F297-Q301 PolarHBondContact O-N 3.01Å; Q298-Q301 PolarHBondContact O-N 2.91Å; Q301-F304 PolarHBondContact O-N 3.1Å; Q301-S305 WeakPolarHBondContact O-CB 3.08Å; Q301-S305 PolarHBondContact O-N 3.42Å; Q301-S305 PolarHBondContact O-OG 3.33Å; Q301-S305 VanDerWaalsContact O-OG 3.11Å |
| 302 | Q | 65.4 | Low | 58 | Low | 120 Ų | 120 | 88 Ų | 88 | 56% | 0.561 | 46% | 0.464 | S | S | * | . | H | α-helix | trans | -64 | -47.2 | 173 | -76.2 | 175.8 | -24 | 0 | 0 | 111.5 | Q298 K299 F304 S305 Q306 | Q298-Q302 WeakPolarHBondContact O-CB 3.49Å; Q298-Q302 WeakPolarHBondContact O-CG 3.38Å; Q298-Q302 PolarHBondContact O-N 3.22Å; K299-Q302 PolarHBondContact O-N 2.9Å; Q302-F304 PolarHBondContact O-N 3.2Å; Q302-S305 WeakPolarHBondContact CA-OG 3.31Å; Q302-S305 PolarHBondContact O-N 3.35Å; Q302-S305 PolarHBondContact O-OG 2.86Å; Q302-Q306 WeakPolarHBondContact O-CB 3.33Å; Q302-Q306 WeakPolarHBondContact O-CG 3.4Å; Q302-Q306 PolarHBondContact O-N 3.24Å |
| 303 | E | 67.1 | Low | 57.3 | Low | 49 Ų | 49 | 80.9 Ų | 80.9 | 23% | 0.229 | 46% | 0.455 | C | S | . | . | H | α-helix | trans | -63.3 | -38.1 | 176.1 | -75.6 | 173.6 | -153.9 | 0 | 0 | 112.9 | S214 S215 K299 A300 G307 | S214-E303 WeakPolarHBondContact CA-OE2 3.35Å; S215-E303 PolarHBondContact N-OE2 3.16Å; S215-E303 PolarHBondContact OG-OE1 3.45Å; K299-E303 WeakPolarHBondContact CE-OE1 3.1Å; K299-E303 WeakPolarHBondContact O-CB 3.43Å; K299-E303 WeakPolarHBondContact O-CG 3.45Å; K299-E303 PolarHBondContact O-N 3.28Å; A300-E303 PolarHBondContact O-N 2.89Å; E303-G307 WeakPolarHBondContact O-CA 3.35Å; E303-G307 PolarHBondContact O-N 3.21Å |
| 304 | F | 67.7 | Low | 57 | Low | 117 Ų | 117 | 84.7 Ų | 84.7 | 51% | 0.513 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -67.2 | -45.8 | 175.6 | -176 | -97.5 | 0 | 0 | 0 | 111.3 | F216 A300 Q301 Q302 G307 V308 | F216-F304 HydrophobicContact CD2-CD2 4.09Å; F216-F304 HydrophobicContact CE2-CD2 4.11Å; F216-F304 HydrophobicContact CE2-CE2 4.27Å; A300-F304 WeakPolarHBondContact O-CB 3.41Å; A300-F304 PolarHBondContact O-N 3.34Å; Q301-F304 PolarHBondContact O-N 3.1Å; Q302-F304 PolarHBondContact O-N 3.2Å; F304-G307 PolarHBondContact O-N 3.16Å; F304-V308 HydrophobicContact CD1-CG2 4.49Å; F304-V308 HydrophobicContact CE1-CG2 4.21Å; F304-V308 HydrophobicContact CZ-CG2 4.26Å; F304-V308 VanDerWaalsContact O-CG2 3.29Å; F304-V308 WeakPolarHBondContact O-CG2 3.46Å; F304-V308 PolarHBondContact O-N 2.94Å |
| 305 | S | 60.8 | Low | 57.1 | Low | 59 Ų | 59 | 86.4 Ų | 86.4 | 41% | 0.413 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -63.5 | -44.4 | 176.8 | 67.5 | 0 | 0 | 0 | 0 | 111.8 | Q301 Q302 V308 V309 | Q301-S305 WeakPolarHBondContact O-CB 3.08Å; Q301-S305 PolarHBondContact O-N 3.42Å; Q301-S305 PolarHBondContact O-OG 3.33Å; Q301-S305 VanDerWaalsContact O-OG 3.11Å; Q302-S305 WeakPolarHBondContact CA-OG 3.31Å; Q302-S305 PolarHBondContact O-N 3.35Å; Q302-S305 PolarHBondContact O-OG 2.86Å; S305-V308 PolarHBondContact O-N 3.46Å; S305-V309 WeakPolarHBondContact O-CG2 3.3Å; S305-V309 PolarHBondContact O-N 3.36Å; S305-V309 VanDerWaalsContact O-N 3.15Å |
| 306 | Q | 59.5 | Low | 57.2 | Low | 128 Ų | 128 | 90.4 Ų | 90.4 | 60% | 0.598 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -68.4 | -38 | 176.8 | -73.3 | -178.4 | -3.8 | 0 | 0 | 112 | Q302 V308 V309 T310 | Q302-Q306 WeakPolarHBondContact O-CB 3.33Å; Q302-Q306 WeakPolarHBondContact O-CG 3.4Å; Q302-Q306 PolarHBondContact O-N 3.24Å; Q306-V308 PolarHBondContact O-N 2.88Å; Q306-V309 CarbonylContact O-C 3.59Å; Q306-V309 PolarHBondContact O-N 3.32Å; Q306-T310 WeakPolarHBondContact O-CB 3.5Å; Q306-T310 PolarHBondContact O-N 3.44Å; Q306-T310 PolarHBondContact O-OG1 3.12Å |
| 307 | G | 56.3 | Low | 57.2 | Low | 41 Ų | 41 | 91 Ų | 91 | 42% | 0.423 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -67.5 | -32.4 | 178.4 | 0 | 0 | 0 | 0 | 0 | 113.7 | E303 F304 S311 | E303-G307 WeakPolarHBondContact O-CA 3.35Å; E303-G307 PolarHBondContact O-N 3.21Å; F304-G307 PolarHBondContact O-N 3.16Å; G307-S311 PolarHBondContact O-N 3.45Å |
| 308 | V | 54.9 | Low | 57.4 | Low | 73 Ų | 73 | 86.6 Ų | 86.6 | 44% | 0.442 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -69.5 | -40.6 | 170.5 | 173.1 | 0 | 0 | 0 | 0 | 110.5 | F304 S305 Q306 S311 | F304-V308 HydrophobicContact CD1-CG2 4.49Å; F304-V308 HydrophobicContact CE1-CG2 4.21Å; F304-V308 HydrophobicContact CZ-CG2 4.26Å; F304-V308 VanDerWaalsContact O-CG2 3.29Å; F304-V308 WeakPolarHBondContact O-CG2 3.46Å; F304-V308 PolarHBondContact O-N 2.94Å; S305-V308 PolarHBondContact O-N 3.46Å; Q306-V308 PolarHBondContact O-N 2.88Å; V308-S311 PolarHBondContact O-OG 3.19Å |
| 309 | V | 54.9 | Low | 57.6 | Low | 96 Ų | 96 | 84.3 Ų | 84.3 | 58% | 0.582 | 48% | 0.477 | S | S | * | . | H | α-helix | trans | -77.2 | -28 | -177.1 | -177.5 | 0 | 0 | 0 | 0 | 113.4 | S305 Q306 Q315 | S305-V309 WeakPolarHBondContact O-CG2 3.3Å; S305-V309 PolarHBondContact O-N 3.36Å; S305-V309 VanDerWaalsContact O-N 3.15Å; Q306-V309 CarbonylContact O-C 3.59Å; Q306-V309 PolarHBondContact O-N 3.32Å; V309-Q315 WeakPolarHBondContact O-CG 3.47Å; V309-Q315 PolarHBondContact O-NE2 3.26Å |
| 310 | T | 53 | Low | 57.5 | Low | 88 Ų | 88 | 83 Ų | 83 | 54% | 0.54 | 48% | 0.481 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -96.1 | 1.1 | 178 | 49.1 | 0 | 0 | 0 | 0 | 113.8 | Q306 K312 | Q306-T310 WeakPolarHBondContact O-CB 3.5Å; Q306-T310 PolarHBondContact O-N 3.44Å; Q306-T310 PolarHBondContact O-OG1 3.12Å; T310-K312 PolarHBondContact O-N 3.05Å |
| 311 | S | 47.1 | Very low | 57.6 | Low | 48 Ų | 48 | 85.3 Ų | 85.3 | 34% | 0.336 | 50% | 0.501 | S | S | . | . | trans | -59.1 | 111.2 | 172.3 | 66.3 | 0 | 0 | 0 | 0 | 108.7 | G307 V308 G313 F314 Q315 | G307-S311 PolarHBondContact O-N 3.45Å; V308-S311 PolarHBondContact O-OG 3.19Å; S311-G313 PolarHBondContact O-N 3.23Å; S311-F314 PolarHBondContact O-N 2.66Å; S311-F314 WeakPolarHBondContact OG-CB 3.26Å; S311-Q315 PolarHBondContact O-N 2.93Å | ||
| 312 | K | 51.1 | Low | 57.7 | Low | 169 Ų | 169 | 82.5 Ų | 82.5 | 74% | 0.735 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -52.2 | -28.5 | 178.8 | -75 | -173.6 | 176.4 | -178 | 0 | 111.5 | T310 T316 | T310-K312 PolarHBondContact O-N 3.05Å; K312-T316 WeakPolarHBondContact O-CB 3.34Å; K312-T316 PolarHBondContact O-N 3.24Å; K312-T316 PolarHBondContact O-OG1 3.45Å |
| 313 | G | 56.2 | Low | 57.5 | Low | 57 Ų | 57 | 79.6 Ų | 79.6 | 59% | 0.588 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -64.9 | -42.1 | 172.3 | 0 | 0 | 0 | 0 | 0 | 113.9 | S311 A317 | S311-G313 PolarHBondContact O-N 3.23Å; G313-A317 WeakPolarHBondContact O-CB 3.34Å; G313-A317 PolarHBondContact O-N 3.41Å |
| 314 | F | 54.1 | Low | 57.3 | Low | 132 Ų | 132 | 80.3 Ų | 80.3 | 58% | 0.579 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -76.9 | -36.2 | 177.2 | -159.9 | -95.4 | 0 | 0 | 0 | 111.8 | S311 A317 A318 | S311-F314 PolarHBondContact O-N 2.66Å; S311-F314 WeakPolarHBondContact OG-CB 3.26Å; F314-A317 PolarHBondContact O-N 3.49Å; F314-A318 WeakPolarHBondContact O-CB 3.28Å; F314-A318 PolarHBondContact O-N 3.32Å |
| 315 | Q | 57.9 | Low | 57 | Low | 95 Ų | 95 | 77.8 Ų | 77.8 | 44% | 0.444 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -66.4 | -39.5 | 172.4 | -72.5 | -179.3 | -14.9 | 0 | 0 | 112.2 | V309 S311 T319 | V309-Q315 WeakPolarHBondContact O-CG 3.47Å; V309-Q315 PolarHBondContact O-NE2 3.26Å; S311-Q315 PolarHBondContact O-N 2.93Å; Q315-T319 WeakPolarHBondContact O-CB 3.43Å; Q315-T319 WeakPolarHBondContact O-CG2 3.47Å; Q315-T319 PolarHBondContact O-N 3.13Å; Q315-T319 PolarHBondContact O-OG1 3Å |
| 316 | T | 57.2 | Low | 56.8 | Low | 94 Ų | 94 | 77.2 Ų | 77.2 | 58% | 0.577 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -71.8 | -37.3 | 176.1 | -54.1 | 0 | 0 | 0 | 0 | 111.5 | K312 T319 G320 | K312-T316 WeakPolarHBondContact O-CB 3.34Å; K312-T316 PolarHBondContact O-N 3.24Å; K312-T316 PolarHBondContact O-OG1 3.45Å; T316-T319 WeakPolarHBondContact CA-OG1 3.21Å; T316-T319 PolarHBondContact O-OG1 3.21Å; T316-G320 PolarHBondContact O-N 3.1Å |
| 317 | A | 55.7 | Low | 56.8 | Low | 62 Ų | 62 | 80.3 Ų | 80.3 | 51% | 0.512 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -69.3 | -39.7 | 174 | 0 | 0 | 0 | 0 | 0 | 112.2 | G313 F314 A321 | G313-A317 WeakPolarHBondContact O-CB 3.34Å; G313-A317 PolarHBondContact O-N 3.41Å; F314-A317 PolarHBondContact O-N 3.49Å; A317-A321 VanDerWaalsContact O-CB 3.25Å; A317-A321 WeakPolarHBondContact O-CB 3Å; A317-A321 PolarHBondContact O-N 3.26Å |
| 318 | A | 55.8 | Low | 56.9 | Low | 50 Ų | 50 | 80.4 Ų | 80.4 | 41% | 0.413 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -70.5 | -41.4 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | F314 A321 A322 | F314-A318 WeakPolarHBondContact O-CB 3.28Å; F314-A318 PolarHBondContact O-N 3.32Å; A318-A321 PolarHBondContact O-N 3.2Å; A318-A322 VanDerWaalsContact O-CB 3.27Å; A318-A322 WeakPolarHBondContact O-CB 3.32Å; A318-A322 PolarHBondContact O-N 3.23Å |
| 319 | T | 57.6 | Low | 56.9 | Low | 92 Ų | 92 | 81.9 Ų | 81.9 | 56% | 0.564 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -69.1 | -35.1 | 173.2 | 47 | 0 | 0 | 0 | 0 | 112.2 | Q315 T316 S323 | Q315-T319 WeakPolarHBondContact O-CB 3.43Å; Q315-T319 WeakPolarHBondContact O-CG2 3.47Å; Q315-T319 PolarHBondContact O-N 3.13Å; Q315-T319 PolarHBondContact O-OG1 3Å; T316-T319 WeakPolarHBondContact CA-OG1 3.21Å; T316-T319 PolarHBondContact O-OG1 3.21Å; T319-S323 WeakPolarHBondContact O-CB 3.32Å; T319-S323 PolarHBondContact O-N 2.97Å; T319-S323 PolarHBondContact O-OG 3.22Å |
| 320 | G | 61.2 | Low | 57 | Low | 37 Ų | 37 | 85.7 Ų | 85.7 | 38% | 0.381 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -65.3 | -41.8 | 171.7 | 0 | 0 | 0 | 0 | 0 | 113.2 | T316 S323 A324 | T316-G320 PolarHBondContact O-N 3.1Å; G320-S323 WeakPolarHBondContact CA-OG 2.84Å; G320-S323 PolarHBondContact O-OG 3.24Å; G320-S323 VanDerWaalsContact O-OG 3.06Å; G320-A324 WeakPolarHBondContact O-CB 2.81Å; G320-A324 PolarHBondContact O-N 2.94Å |
| 321 | A | 59.4 | Low | 57.1 | Low | 62 Ų | 62 | 89.6 Ų | 89.6 | 51% | 0.512 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -70.8 | -39.8 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | A317 A318 A324 A325 | A317-A321 VanDerWaalsContact O-CB 3.25Å; A317-A321 WeakPolarHBondContact O-CB 3Å; A317-A321 PolarHBondContact O-N 3.26Å; A318-A321 PolarHBondContact O-N 3.2Å; A321-A324 PolarHBondContact O-N 3.21Å; A321-A325 WeakPolarHBondContact O-CB 3.24Å; A321-A325 PolarHBondContact O-N 3.07Å |
| 322 | A | 59.5 | Low | 57.2 | Low | 63 Ų | 63 | 90.5 Ų | 90.5 | 52% | 0.521 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -66.2 | -39.5 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | A318 A325 A326 | A318-A322 VanDerWaalsContact O-CB 3.27Å; A318-A322 WeakPolarHBondContact O-CB 3.32Å; A318-A322 PolarHBondContact O-N 3.23Å; A322-A325 PolarHBondContact O-N 3.04Å; A322-A326 WeakPolarHBondContact O-CB 3.49Å; A322-A326 PolarHBondContact O-N 2.63Å |
| 323 | S | 61.6 | Low | 57.1 | Low | 60 Ų | 60 | 89.2 Ų | 89.2 | 42% | 0.42 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -71.7 | -32.9 | 176.1 | 52 | 0 | 0 | 0 | 0 | 113 | T319 G320 R327 | T319-S323 WeakPolarHBondContact O-CB 3.32Å; T319-S323 PolarHBondContact O-N 2.97Å; T319-S323 PolarHBondContact O-OG 3.22Å; G320-S323 WeakPolarHBondContact CA-OG 2.84Å; G320-S323 PolarHBondContact O-OG 3.24Å; G320-S323 VanDerWaalsContact O-OG 3.06Å; S323-R327 WeakPolarHBondContact O-CG 3.45Å; S323-R327 PolarHBondContact O-N 3.42Å |
| 324 | A | 61.3 | Low | 56.3 | Low | 63 Ų | 63 | 97.5 Ų | 97.5 | 52% | 0.521 | 59% | 0.591 | S | S | . | * | H | α-helix | trans | -68.7 | -41.7 | 171.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | G320 A321 R327 G328 | G320-A324 WeakPolarHBondContact O-CB 2.81Å; G320-A324 PolarHBondContact O-N 2.94Å; A321-A324 PolarHBondContact O-N 3.21Å; A324-R327 PolarHBondContact O-N 3.26Å; A324-G328 PolarHBondContact O-N 3.48Å |
| 325 | A | 60.9 | Low | 56.5 | Low | 65 Ų | 65 | 95.8 Ų | 95.8 | 54% | 0.537 | 59% | 0.592 | S | S | . | * | H | α-helix | trans | -64.7 | -43.8 | 176 | 0 | 0 | 0 | 0 | 0 | 111.8 | A321 A322 R327 G328 T329 | A321-A325 WeakPolarHBondContact O-CB 3.24Å; A321-A325 PolarHBondContact O-N 3.07Å; A322-A325 PolarHBondContact O-N 3.04Å; A325-R327 VanDerWaalsContact C-N 3.34Å; A325-R327 PolarHBondContact O-N 3.34Å; A325-G328 PolarHBondContact O-N 2.91Å; A325-G328 VanDerWaalsContact O-N 3.16Å; A325-T329 PolarHBondContact O-N 3.28Å; A325-T329 VanDerWaalsContact O-N 3.12Å; A325-T329 PolarHBondContact O-OG1 2.97Å |
| 326 | A | 58 | Low | 56.4 | Low | 46 Ų | 46 | 95.8 Ų | 95.8 | 38% | 0.38 | 60% | 0.6 | S | S | . | * | H | α-helix | trans | -59.3 | -43.2 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112 | A322 G328 T329 F330 | A322-A326 WeakPolarHBondContact O-CB 3.49Å; A322-A326 PolarHBondContact O-N 2.63Å; A326-G328 VanDerWaalsContact C-N 3.35Å; A326-G328 PolarHBondContact O-N 3.25Å; A326-T329 PolarHBondContact O-N 2.96Å; A326-T329 PolarHBondContact O-OG1 2.73Å; A326-F330 VanDerWaalsContact O-CD2 3.22Å; A326-F330 WeakPolarHBondContact O-CD2 3.49Å; A326-F330 PolarHBondContact O-N 3.42Å |
| 327 | R | 58.7 | Low | 56.3 | Low | 193 Ų | 193 | 95.9 Ų | 95.9 | 73% | 0.728 | 60% | 0.601 | S | S | * | * | H | α-helix | trans | -66 | -33.6 | 176.2 | -73.5 | 177.4 | 178.6 | 177.2 | 0.9 | 113.2 | S323 A324 A325 F330 Q331 | S323-R327 WeakPolarHBondContact O-CG 3.45Å; S323-R327 PolarHBondContact O-N 3.42Å; A324-R327 PolarHBondContact O-N 3.26Å; A325-R327 VanDerWaalsContact C-N 3.34Å; A325-R327 PolarHBondContact O-N 3.34Å; R327-F330 PolarHBondContact O-N 3.02Å; R327-Q331 PolarHBondContact O-N 3.45Å |
| 328 | G | 58 | Low | 56.4 | Low | 43 Ų | 43 | 97.9 Ų | 97.9 | 44% | 0.443 | 61% | 0.606 | S | S | . | * | H | α-helix | trans | -65.7 | -38.9 | 174.4 | 0 | 0 | 0 | 0 | 0 | 113.4 | A324 A325 A326 Q331 G332 | A324-G328 PolarHBondContact O-N 3.48Å; A325-G328 PolarHBondContact O-N 2.91Å; A325-G328 VanDerWaalsContact O-N 3.16Å; A326-G328 VanDerWaalsContact C-N 3.35Å; A326-G328 PolarHBondContact O-N 3.25Å; G328-Q331 PolarHBondContact O-N 2.97Å; G328-G332 PolarHBondContact O-N 3.06Å |
| 329 | T | 56.1 | Low | 56.4 | Low | 104 Ų | 104 | 100.9 Ų | 100.9 | 64% | 0.638 | 62% | 0.618 | S | S | * | * | H | α-helix | trans | -69.6 | -29.3 | 175.7 | 20.3 | 0 | 0 | 0 | 0 | 114 | A325 A326 | A325-T329 PolarHBondContact O-N 3.28Å; A325-T329 VanDerWaalsContact O-N 3.12Å; A325-T329 PolarHBondContact O-OG1 2.97Å; A326-T329 PolarHBondContact O-N 2.96Å; A326-T329 PolarHBondContact O-OG1 2.73Å |
| 330 | F | 56.3 | Low | 56.3 | Low | 176 Ų | 176 | 101.5 Ų | 101.5 | 77% | 0.772 | 62% | 0.622 | S | S | * | * | H | α-helix | trans | -79.7 | -20.8 | 176.3 | -81 | -73 | 0 | 0 | 0 | 113.9 | A326 R327 | A326-F330 VanDerWaalsContact O-CD2 3.22Å; A326-F330 WeakPolarHBondContact O-CD2 3.49Å; A326-F330 PolarHBondContact O-N 3.42Å; R327-F330 PolarHBondContact O-N 3.02Å |
| 331 | Q | 54.7 | Low | 56 | Low | 171 Ų | 171 | 106.1 Ų | 106.1 | 80% | 0.799 | 64% | 0.639 | S | S | * | * | H | α-helix | trans | -90.4 | -13.9 | 174.7 | -80.6 | -176.6 | -26.8 | 0 | 0 | 113.9 | R327 G328 | R327-Q331 PolarHBondContact O-N 3.45Å; G328-Q331 PolarHBondContact O-N 2.97Å |
| 332 | G | 50.5 | Low | 55.7 | Low | 66 Ų | 66 | 109.5 Ų | 109.5 | 68% | 0.68 | 65% | 0.649 | S | S | * | * | S | Bend | trans | -88.3 | 5.4 | -179.7 | 0 | 0 | 0 | 0 | 0 | 115.8 | G328 | G328-G332 PolarHBondContact O-N 3.06Š|
| 333 | N | 47.6 | Very low | 55.4 | Low | 142 Ų | 142 | 113.3 Ų | 113.3 | 76% | 0.759 | 66% | 0.659 | S | S | * | * | trans | -127.3 | 32.5 | -173 | -152.3 | 65.9 | 0 | 0 | 0 | 114.5 | ||||
| 334 | N | 41.3 | Very low | 54.8 | Low | 231 Ų | 231 | 118.2 Ų | 118.2 | 100% | 1.235 | 68% | 0.681 | S | S | * | * | trans | -122.4 | 0 | 167.4 | -96.8 | -6.2 | 0 | 0 | 0 | 111.2 |
Retrieved 334 of 334 residues in 91.9 ms
(Link to these results)