| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 39.3 | Very low | 57.3 | Low | 244 Ų | 244 | 140.5 Ų | 140.5 | 100% | 1.202 | 82% | 0.818 | S | S | * | * | 0 | 98.2 | 0 | -71.3 | -163.1 | 164.9 | 0 | 0 | 107.3 | |||||
| 2 | S | 43.4 | Very low | 58.8 | Low | 121 Ų | 121 | 134.7 Ų | 134.7 | 85% | 0.846 | 79% | 0.788 | S | S | * | * | trans | -116.8 | 110.7 | 179.2 | -58.8 | 0 | 0 | 0 | 0 | 106.9 | ||||
| 3 | S | 46 | Very low | 59.4 | Low | 105 Ų | 105 | 132.8 Ų | 132.8 | 73% | 0.734 | 78% | 0.783 | S | S | * | * | trans | -93 | 103.2 | -178.7 | 39.4 | 0 | 0 | 0 | 0 | 109.5 | K5 | S3-K5 PolarHBondContact O-N 3.48Å; S3-K5 VanDerWaalsContact O-N 3.11Å | ||
| 4 | D | 51.6 | Low | 59.5 | Low | 156 Ų | 156 | 135.9 Ų | 135.9 | 83% | 0.834 | 79% | 0.788 | S | S | * | * | trans | -68.4 | 104 | 166.2 | -76.9 | -30.5 | 0 | 0 | 0 | 108.8 | L6 | D4-L6 PolarHBondContact O-N 3.41Å; D4-L6 VanDerWaalsContact O-N 3.17Å | ||
| 5 | K | 57.6 | Low | 59.7 | Low | 181 Ų | 181 | 136.2 Ų | 136.2 | 79% | 0.787 | 78% | 0.777 | S | S | * | * | trans | -73.4 | 102.6 | 170.5 | -86.9 | 165.8 | 177 | 171.1 | 0 | 108.5 | S3 I7 | S3-K5 PolarHBondContact O-N 3.48Å; S3-K5 VanDerWaalsContact O-N 3.11Å; K5-I7 PolarHBondContact O-N 3.17Å | ||
| 6 | L | 61.8 | Low | 60 | Low | 172 Ų | 172 | 138.6 Ų | 138.6 | 90% | 0.901 | 77% | 0.77 | S | S | * | * | trans | -61.4 | 103.9 | 167.5 | -71.8 | 158 | 0 | 0 | 0 | 109.1 | D4 | D4-L6 PolarHBondContact O-N 3.41Å; D4-L6 VanDerWaalsContact O-N 3.17Å | ||
| 7 | I | 50.6 | Low | 60.1 | Low | 165 Ų | 165 | 142.6 Ų | 142.6 | 85% | 0.846 | 78% | 0.777 | S | S | * | * | trans | -81.5 | 111.3 | 167.6 | -113.3 | 72.3 | 0 | 0 | 0 | 107.1 | K5 | K5-I7 PolarHBondContact O-N 3.17Š| ||
| 8 | G | 68.8 | Low | 59 | Low | 60 Ų | 60 | 142.7 Ų | 142.7 | 62% | 0.619 | 78% | 0.777 | S | S | * | * | S | Bend | trans | 154.5 | 159 | 176.9 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||
| 9 | P | 73.7 | Confident | 58.5 | Low | 128 Ų | 128 | 139.8 Ų | 139.8 | 83% | 0.831 | 78% | 0.783 | S | S | * | * | P | Polyproline II helix | trans | -62 | 141.9 | 174.7 | 27.6 | -33.7 | 0 | 0 | 0 | 110.5 | L11 | P9-L11 PolarHBondContact O-N 3.12Š|
| 10 | A | 70.6 | Confident | 57.4 | Low | 92 Ų | 92 | 138.1 Ų | 138.1 | 76% | 0.76 | 78% | 0.781 | S | S | * | * | P | Polyproline II helix | trans | -61.8 | 127.3 | -177.1 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||
| 11 | L | 66.9 | Low | 56.8 | Low | 121 Ų | 121 | 140.8 Ų | 140.8 | 63% | 0.634 | 79% | 0.787 | S | S | * | * | P | Polyproline II helix | trans | -66.4 | 143 | 175.5 | -76.8 | 161.8 | 0 | 0 | 0 | 111 | P9 | P9-L11 PolarHBondContact O-N 3.12Š|
| 12 | P | 75.9 | Confident | 56.7 | Low | 71 Ų | 71 | 134.1 Ų | 134.1 | 46% | 0.461 | 77% | 0.765 | S | S | . | * | P | Polyproline II helix | trans | -61.8 | 150.1 | 177.5 | 14.3 | -16.8 | 0 | 0 | 0 | 111.4 | M14 F15 | P12-M14 PolarHBondContact O-N 3.03Å; P12-F15 HydrophobicContact CB-CD2 4.43Å; P12-F15 HydrophobicContact CG-CD2 3.74Å; P12-F15 HydrophobicContact CG-CE2 3.97Å; P12-F15 PolarHBondContact O-N 3.33Å |
| 13 | P | 66 | Low | 56.4 | Low | 111 Ų | 111 | 135.8 Ų | 135.8 | 72% | 0.721 | 76% | 0.764 | S | S | * | * | G | 310 helix | trans | -58.1 | -22.3 | -166.1 | 19.1 | -31.2 | 0 | 0 | 0 | 114.9 | F15 | P13-F15 VanDerWaalsContact C-N 3.26Å; P13-F15 PolarHBondContact O-N 3.33Å |
| 14 | M | 61.1 | Low | 56.5 | Low | 175 Ų | 175 | 140.2 Ų | 140.2 | 86% | 0.862 | 77% | 0.773 | S | S | * | * | G | 310 helix | trans | -75.5 | -8.3 | 179.5 | -54.3 | -142.1 | -50.3 | 0 | 0 | 114.7 | P12 | P12-M14 PolarHBondContact O-N 3.03Š|
| 15 | F | 62.8 | Low | 55.9 | Low | 141 Ų | 141 | 137.6 Ų | 137.6 | 62% | 0.618 | 77% | 0.767 | S | S | * | * | G | 310 helix | trans | -104.9 | 9.4 | -178.7 | -66.3 | -84.6 | 0 | 0 | 0 | 113.6 | P12 P13 K17 | P12-F15 HydrophobicContact CB-CD2 4.43Å; P12-F15 HydrophobicContact CG-CD2 3.74Å; P12-F15 HydrophobicContact CG-CE2 3.97Å; P12-F15 PolarHBondContact O-N 3.33Å; P13-F15 VanDerWaalsContact C-N 3.26Å; P13-F15 PolarHBondContact O-N 3.33Å; F15-K17 PolarHBondContact O-N 3.16Å; F15-K17 VanDerWaalsContact O-N 3.16Å |
| 16 | R | 64.3 | Low | 55.7 | Low | 175 Ų | 175 | 137.9 Ų | 137.9 | 66% | 0.66 | 77% | 0.771 | S | S | * | * | trans | -78.8 | 99.4 | 171 | -62.6 | -174.8 | -177.8 | -92 | -3.3 | 107.3 | D18 | R16-D18 PolarHBondContact O-N 3.24Š| ||
| 17 | K | 61.7 | Low | 55.2 | Low | 206 Ų | 206 | 135.3 Ų | 135.3 | 90% | 0.896 | 76% | 0.758 | S | S | * | * | trans | -81.3 | 101.2 | 176.7 | -164.1 | 165.5 | -176.9 | 171.4 | 0 | 107.9 | F15 | F15-K17 PolarHBondContact O-N 3.16Å; F15-K17 VanDerWaalsContact O-N 3.16Å | ||
| 18 | D | 40 | Very low | 55.2 | Low | 145 Ų | 145 | 135.4 Ų | 135.4 | 78% | 0.775 | 76% | 0.761 | S | S | * | * | trans | -66.8 | 130.3 | 167.3 | -67.3 | -40 | 0 | 0 | 0 | 108.4 | R16 S20 | R16-D18 PolarHBondContact O-N 3.24Å; D18-S20 PolarHBondContact O-N 3.1Å | ||
| 19 | G | 49.8 | Very low | 54.6 | Low | 87 Ų | 87 | 140.5 Ų | 140.5 | 90% | 0.897 | 77% | 0.766 | S | S | * | * | trans | -72.3 | 113.1 | 178 | 0 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 20 | S | 36 | Very low | 53.7 | Low | 106 Ų | 106 | 139.5 Ų | 139.5 | 74% | 0.741 | 77% | 0.769 | S | S | * | * | trans | -141.9 | 127.6 | 153.9 | 64.9 | 0 | 0 | 0 | 0 | 109.7 | D18 S22 | D18-S20 PolarHBondContact O-N 3.1Å; S20-S22 PolarHBondContact O-N 3.05Å | ||
| 21 | E | 45.8 | Very low | 53.6 | Low | 195 Ų | 195 | 137 Ų | 137 | 91% | 0.911 | 75% | 0.752 | S | S | * | * | trans | -57.5 | 123.4 | 169.4 | -62.8 | 167.4 | 125 | 0 | 0 | 109.4 | ||||
| 22 | S | 36 | Very low | 53.9 | Low | 104 Ų | 104 | 137.5 Ų | 137.5 | 73% | 0.727 | 76% | 0.762 | S | S | * | * | trans | -168.6 | 113.1 | 162.8 | -79.2 | 0 | 0 | 0 | 0 | 111 | S20 | S20-S22 PolarHBondContact O-N 3.05Š| ||
| 23 | D | 37.3 | Very low | 53.8 | Low | 156 Ų | 156 | 139 Ų | 139 | 83% | 0.834 | 78% | 0.781 | S | S | * | * | trans | 39.4 | 117.3 | 149.5 | -58.8 | -55.9 | 0 | 0 | 0 | 121 | S25 | D23-S25 PolarHBondContact O-N 3.45Š| ||
| 24 | E | 47.9 | Very low | 54.2 | Low | 198 Ų | 198 | 139.4 Ų | 139.4 | 93% | 0.925 | 78% | 0.776 | S | S | * | * | trans | -65.9 | 97.6 | 167.2 | -59.4 | -160.1 | 146.4 | 0 | 0 | 110.8 | ||||
| 25 | S | 40.4 | Very low | 55.1 | Low | 101 Ų | 101 | 134.5 Ų | 134.5 | 71% | 0.706 | 76% | 0.758 | S | S | * | * | trans | -97.7 | 103.4 | 157.7 | 173.5 | 0 | 0 | 0 | 0 | 108.1 | D23 N27 | D23-S25 PolarHBondContact O-N 3.45Å; S25-N27 PolarHBondContact O-N 3.35Å | ||
| 26 | E | 51.8 | Low | 55.6 | Low | 186 Ų | 186 | 134.3 Ų | 134.3 | 87% | 0.869 | 77% | 0.77 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -63 | 73.7 | 170.9 | -71.8 | 179.4 | 131.8 | 0 | 0 | 110.9 | ||
| 27 | N | 51.4 | Low | 55.6 | Low | 118 Ų | 118 | 129.9 Ų | 129.9 | 63% | 0.631 | 78% | 0.78 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -153.2 | 4.5 | 167 | -129.9 | 22.4 | 0 | 0 | 0 | 117.1 | S25 F29 | S25-N27 PolarHBondContact O-N 3.35Å; N27-F29 VanDerWaalsContact C-N 3.29Å; N27-F29 PolarHBondContact O-N 3.03Å |
| 28 | D | 51.7 | Low | 55.8 | Low | 168 Ų | 168 | 128.1 Ų | 128.1 | 90% | 0.898 | 77% | 0.768 | S | S | * | * | trans | -85.4 | 73.3 | 173 | -78.1 | -18.3 | 0 | 0 | 0 | 111.1 | A30 | D28-A30 PolarHBondContact O-N 2.77Å; D28-A30 VanDerWaalsContact O-N 3.15Å | ||
| 29 | F | 55.9 | Low | 57.4 | Low | 166 Ų | 166 | 131 Ų | 131 | 73% | 0.728 | 77% | 0.774 | S | S | * | * | trans | -75 | 98.5 | 168.8 | -173.9 | -98.7 | 0 | 0 | 0 | 109.5 | N27 G31 | N27-F29 VanDerWaalsContact C-N 3.29Å; N27-F29 PolarHBondContact O-N 3.03Å; F29-G31 PolarHBondContact O-N 3.43Å | ||
| 30 | A | 55 | Low | 58.1 | Low | 108 Ų | 108 | 135.6 Ų | 135.6 | 89% | 0.893 | 76% | 0.764 | S | S | * | * | trans | -68.8 | 92.4 | 174.7 | 0 | 0 | 0 | 0 | 0 | 110.9 | D28 | D28-A30 PolarHBondContact O-N 2.77Å; D28-A30 VanDerWaalsContact O-N 3.15Å | ||
| 31 | G | 68.3 | Low | 58.9 | Low | 40 Ų | 40 | 134 Ų | 134 | 41% | 0.412 | 76% | 0.764 | S | S | . | * | S | Bend | trans | -150.2 | 162.6 | 174.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | F29 | F29-G31 PolarHBondContact O-N 3.43Š|
| 32 | P | 72.1 | Confident | 59.3 | Low | 130 Ų | 130 | 133.2 Ų | 133.2 | 84% | 0.844 | 76% | 0.76 | S | S | * | * | P | Polyproline II helix | trans | -59.9 | 140.9 | 177.6 | 26.3 | -34 | 0 | 0 | 0 | 110.8 | ||
| 33 | A | 75.4 | Confident | 59.7 | Low | 102 Ų | 102 | 134.6 Ų | 134.6 | 84% | 0.843 | 77% | 0.767 | S | S | * | * | P | Polyproline II helix | trans | -59.8 | 137 | -179.8 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||
| 34 | L | 74.2 | Confident | 59.7 | Low | 120 Ų | 120 | 132.9 Ų | 132.9 | 63% | 0.628 | 77% | 0.767 | S | S | * | * | P | Polyproline II helix | trans | -73 | 148.3 | 176.8 | -71.3 | 170.5 | 0 | 0 | 0 | 111.2 | ||
| 35 | P | 79.3 | Confident | 59.6 | Low | 73 Ų | 73 | 129.4 Ų | 129.4 | 47% | 0.474 | 77% | 0.765 | S | S | . | * | P | Polyproline II helix | trans | -64.8 | 155.4 | 176.3 | 25.7 | -32.2 | 0 | 0 | 0 | 111.9 | G37 Y38 | P35-G37 PolarHBondContact O-N 2.83Å; P35-Y38 HydrophobicContact CB-CD2 4.5Å; P35-Y38 HydrophobicContact CG-CD2 3.71Å; P35-Y38 HydrophobicContact CG-CE2 3.89Å; P35-Y38 HydrophobicContact CG-CG 4.46Å; P35-Y38 PolarHBondContact O-N 3.22Å |
| 36 | P | 72.9 | Confident | 59.5 | Low | 136 Ų | 136 | 129.8 Ų | 129.8 | 88% | 0.883 | 77% | 0.768 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -55.4 | 131.1 | 179.7 | -21.4 | 31.2 | 0 | 0 | 0 | 111.8 | ||
| 37 | G | 65.8 | Low | 59.2 | Low | 83 Ų | 83 | 126.5 Ų | 126.5 | 86% | 0.856 | 77% | 0.765 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 103.4 | -6.4 | 177.2 | 0 | 0 | 0 | 0 | 0 | 115.9 | P35 | P35-G37 PolarHBondContact O-N 2.83Š|
| 38 | Y | 64.8 | Low | 58.6 | Low | 168 Ų | 168 | 127.9 Ų | 127.9 | 66% | 0.659 | 77% | 0.773 | S | S | * | * | trans | -95.9 | 119.3 | 175.8 | -73.9 | -103.1 | 0 | 0 | 0 | 110.7 | P35 | P35-Y38 HydrophobicContact CB-CD2 4.5Å; P35-Y38 HydrophobicContact CG-CD2 3.71Å; P35-Y38 HydrophobicContact CG-CE2 3.89Å; P35-Y38 HydrophobicContact CG-CG 4.46Å; P35-Y38 PolarHBondContact O-N 3.22Å | ||
| 39 | K | 73.2 | Confident | 58.4 | Low | 205 Ų | 205 | 128.7 Ų | 128.7 | 89% | 0.891 | 77% | 0.771 | S | S | * | * | trans | -104 | 137.6 | 170.9 | -63 | -159.2 | 179.5 | -168.7 | 0 | 110.2 | ||||
| 40 | R | 65.8 | Low | 57.7 | Low | 185 Ų | 185 | 125.6 Ų | 125.6 | 70% | 0.698 | 77% | 0.77 | S | S | * | * | P | Polyproline II helix | trans | -71.8 | 125.6 | 174.9 | -170.1 | -178.7 | -170.3 | -154.5 | 2.6 | 108.6 | ||
| 41 | G | 52.6 | Low | 57.2 | Low | 71 Ų | 71 | 129.8 Ų | 129.8 | 73% | 0.732 | 77% | 0.771 | S | S | * | * | P | Polyproline II helix | trans | -68.6 | 134 | 173.1 | 0 | 0 | 0 | 0 | 0 | 110.7 | ||
| 42 | E | 53.9 | Low | 55.9 | Low | 179 Ų | 179 | 133.1 Ų | 133.1 | 84% | 0.836 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -79.5 | 143.7 | 178.3 | -46.9 | -166 | 176.9 | 0 | 0 | 110 | S44 | E42-S44 PolarHBondContact O-N 2.76Š|
| 43 | P | 43.8 | Very low | 54.4 | Low | 134 Ų | 134 | 135.7 Ų | 135.7 | 87% | 0.87 | 79% | 0.786 | S | S | * | * | trans | -79.6 | 92 | -179.6 | 32.5 | -31.8 | 0 | 0 | 0 | 109.8 | S45 | P43-S45 PolarHBondContact O-N 2.7Š| ||
| 44 | S | 37.3 | Very low | 52.7 | Low | 119 Ų | 119 | 136.4 Ų | 136.4 | 83% | 0.832 | 78% | 0.78 | S | S | * | * | trans | -77.5 | 110 | 166.1 | -92.6 | 0 | 0 | 0 | 0 | 110.4 | E42 S46 | E42-S44 PolarHBondContact O-N 2.76Å; S44-S46 PolarHBondContact O-N 2.79Å | ||
| 45 | S | 46.8 | Very low | 50.9 | Low | 125 Ų | 125 | 135.5 Ų | 135.5 | 87% | 0.874 | 78% | 0.779 | S | S | * | * | trans | -68.2 | 108.8 | 160.9 | -179.5 | 0 | 0 | 0 | 0 | 109.1 | P43 | P43-S45 PolarHBondContact O-N 2.7Š| ||
| 46 | S | 37.8 | Very low | 48.9 | Very low | 110 Ų | 110 | 141.4 Ų | 141.4 | 77% | 0.769 | 80% | 0.798 | S | S | * | * | trans | -163.6 | 121.8 | 158.7 | -176.5 | 0 | 0 | 0 | 0 | 110 | S44 | S44-S46 PolarHBondContact O-N 2.79Š| ||
| 47 | S | 44.3 | Very low | 47.4 | Very low | 117 Ų | 117 | 144.1 Ų | 144.1 | 82% | 0.818 | 80% | 0.796 | S | S | * | * | trans | -65.1 | 121.7 | 170 | -177.3 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 48 | D | 39.1 | Very low | 46.3 | Very low | 147 Ų | 147 | 150.4 Ų | 150.4 | 79% | 0.786 | 79% | 0.794 | S | S | * | * | trans | -165 | 137 | 148.8 | -148.8 | -124.7 | 0 | 0 | 0 | 110.8 | S50 | D48-S50 PolarHBondContact O-N 2.89Š| ||
| 49 | E | 48.3 | Very low | 44.9 | Very low | 185 Ų | 185 | 148.2 Ų | 148.2 | 86% | 0.864 | 80% | 0.8 | S | S | * | * | trans | -74 | 112.1 | 178.2 | -85.4 | -94.9 | 113.7 | 0 | 0 | 111 | ||||
| 50 | S | 40.4 | Very low | 43.3 | Very low | 101 Ų | 101 | 149.5 Ų | 149.5 | 71% | 0.706 | 80% | 0.799 | S | S | * | * | trans | -174.1 | 125.9 | 149.8 | 25.6 | 0 | 0 | 0 | 0 | 109.9 | D48 P52 | D48-S50 PolarHBondContact O-N 2.89Å; S50-P52 VanDerWaalsContact O-CD 3.32Å; S50-P52 WeakPolarHBondContact O-CD 3.32Å | ||
| 51 | E | 44.4 | Very low | 42.2 | Very low | 195 Ų | 195 | 147.6 Ų | 147.6 | 91% | 0.911 | 81% | 0.808 | S | S | * | * | trans | -67.6 | 128.8 | 176.3 | -59.6 | -146.5 | 158.5 | 0 | 0 | 111 | ||||
| 52 | P | 40.8 | Very low | 41.4 | Very low | 110 Ų | 110 | 148 Ų | 148 | 71% | 0.714 | 81% | 0.813 | S | S | * | * | trans | -90.2 | 112.1 | 161.6 | 31.2 | -27.8 | 0 | 0 | 0 | 110.2 | S50 V54 | S50-P52 VanDerWaalsContact O-CD 3.32Å; S50-P52 WeakPolarHBondContact O-CD 3.32Å; P52-V54 PolarHBondContact O-N 2.97Å; P52-V54 VanDerWaalsContact O-N 3.12Å | ||
| 53 | E | 41.8 | Very low | 40.4 | Very low | 184 Ų | 184 | 142.6 Ų | 142.6 | 86% | 0.86 | 81% | 0.805 | S | S | * | * | trans | -51 | 111.3 | 160.5 | -100.7 | -175.4 | 141.7 | 0 | 0 | 110.1 | T55 | E53-T55 PolarHBondContact O-N 3.15Š| ||
| 54 | V | 38.5 | Very low | 39.9 | Very low | 117 Ų | 117 | 143.1 Ų | 143.1 | 71% | 0.709 | 81% | 0.806 | S | S | * | * | trans | -86.8 | 86.9 | 175.3 | -162.7 | 0 | 0 | 0 | 0 | 108.8 | P52 F56 | P52-V54 PolarHBondContact O-N 2.97Å; P52-V54 VanDerWaalsContact O-N 3.12Å; V54-F56 PolarHBondContact O-N 3.29Å | ||
| 55 | T | 37.2 | Very low | 40 | Very low | 101 Ų | 101 | 141.9 Ų | 141.9 | 62% | 0.62 | 80% | 0.803 | S | S | * | * | trans | -68.4 | 117.6 | 167.6 | 57.6 | 0 | 0 | 0 | 0 | 109.7 | E53 K57 | E53-T55 PolarHBondContact O-N 3.15Å; T55-K57 PolarHBondContact O-N 2.88Å; T55-K57 VanDerWaalsContact O-N 3.1Å | ||
| 56 | F | 37.3 | Very low | 39.3 | Very low | 197 Ų | 197 | 145.6 Ų | 145.6 | 86% | 0.864 | 81% | 0.806 | S | S | * | * | trans | -70.4 | 102.3 | 168.8 | -72.5 | -85.7 | 0 | 0 | 0 | 109.7 | V54 R58 | V54-F56 PolarHBondContact O-N 3.29Å; F56-R58 PolarHBondContact O-N 2.84Å | ||
| 57 | K | 41.5 | Very low | 39.4 | Very low | 193 Ų | 193 | 146.5 Ų | 146.5 | 84% | 0.839 | 81% | 0.807 | S | S | * | * | trans | -73.6 | 106.9 | 169.6 | -70.9 | -169.2 | 177.1 | -179.2 | 0 | 109.7 | T55 | T55-K57 PolarHBondContact O-N 2.88Å; T55-K57 VanDerWaalsContact O-N 3.1Å | ||
| 58 | R | 41.7 | Very low | 38.9 | Very low | 216 Ų | 216 | 147 Ų | 147 | 82% | 0.815 | 81% | 0.806 | S | S | * | * | trans | -68.8 | 131.3 | 164.1 | -177 | 175.8 | 179.6 | 171.3 | 0.2 | 108.7 | F56 R60 | F56-R58 PolarHBondContact O-N 2.84Å; R58-R60 PolarHBondContact O-N 3.24Å; R58-R60 VanDerWaalsContact O-N 3.16Å | ||
| 59 | P | 35.8 | Very low | 38.6 | Very low | 121 Ų | 121 | 149.2 Ų | 149.2 | 79% | 0.786 | 81% | 0.808 | S | S | * | * | trans | -68 | 115.8 | 172.6 | 26.8 | -31.1 | 0 | 0 | 0 | 109.1 | ||||
| 60 | R | 40 | Very low | 38.1 | Very low | 232 Ų | 232 | 147.5 Ų | 147.5 | 88% | 0.875 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -97.6 | 116.8 | 157.1 | -75.3 | -143.9 | 172.1 | -159 | -0.9 | 107.1 | R58 | R58-R60 PolarHBondContact O-N 3.24Å; R58-R60 VanDerWaalsContact O-N 3.16Å |
| 61 | T | 42.2 | Very low | 37.8 | Very low | 145 Ų | 145 | 151.8 Ų | 151.8 | 89% | 0.89 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -79.7 | 116.7 | 160.7 | 49.8 | 0 | 0 | 0 | 0 | 106.9 | ||
| 62 | G | 35.7 | Very low | 37.5 | Very low | 80 Ų | 80 | 149.7 Ų | 149.7 | 83% | 0.825 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -99.3 | 159.2 | 174.2 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||
| 63 | G | 32.8 | Very low | 37.3 | Very low | 65 Ų | 65 | 153.6 Ų | 153.6 | 67% | 0.67 | 82% | 0.818 | S | S | * | * | trans | -171.4 | 74 | 163.8 | 0 | 0 | 0 | 0 | 0 | 106.4 | ||||
| 64 | T | 34.2 | Very low | 37.1 | Very low | 145 Ų | 145 | 152.1 Ų | 152.1 | 89% | 0.89 | 82% | 0.815 | S | S | * | * | 69.7 | 100.5 | 105.2 | 55.6 | 0 | 0 | 0 | 0 | 112.9 | |||||
| 65 | A | 38.6 | Very low | 37.1 | Very low | 94 Ų | 94 | 153.5 Ų | 153.5 | 78% | 0.777 | 82% | 0.819 | S | S | * | * | trans | -81.2 | 141.3 | 153.7 | 0 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 66 | E | 33.8 | Very low | 37.1 | Very low | 202 Ų | 202 | 155.1 Ų | 155.1 | 94% | 0.944 | 82% | 0.824 | S | S | * | * | trans | -160.1 | 151.6 | 132.1 | -75.7 | -142.9 | 152.3 | 0 | 0 | 110.1 | ||||
| 67 | V | 40.1 | Very low | 37.5 | Very low | 130 Ų | 130 | 152.2 Ų | 152.2 | 79% | 0.788 | 82% | 0.817 | S | S | * | * | trans | -94.2 | 149.5 | -164.1 | 167.8 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 68 | T | 33.7 | Very low | 37.4 | Very low | 128 Ų | 128 | 150.8 Ų | 150.8 | 79% | 0.785 | 82% | 0.819 | S | S | * | * | trans | 178.5 | 128.7 | 131.1 | 31.2 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 69 | K | 32.3 | Very low | 37.7 | Very low | 193 Ų | 193 | 147.3 Ų | 147.3 | 84% | 0.839 | 82% | 0.817 | S | S | * | * | trans | 75 | 135.8 | 140.6 | -81.3 | -177.1 | 169.6 | -173.2 | 0 | 123.3 | ||||
| 70 | D | 37.8 | Very low | 38 | Very low | 149 Ų | 149 | 149.1 Ų | 149.1 | 80% | 0.797 | 82% | 0.819 | S | S | * | * | trans | -63.2 | 148.4 | 176.6 | -44 | -87.7 | 0 | 0 | 0 | 114.7 | ||||
| 71 | E | 34.6 | Very low | 38.4 | Very low | 191 Ų | 191 | 144.9 Ų | 144.9 | 89% | 0.893 | 81% | 0.814 | S | S | * | * | 177.3 | 152.3 | 123.1 | -94.1 | 173.8 | -166.8 | 0 | 0 | 110.6 | |||||
| 72 | D | 38 | Very low | 38.6 | Very low | 151 Ų | 151 | 145 Ų | 145 | 81% | 0.807 | 81% | 0.809 | S | S | * | * | trans | -66.1 | 155.6 | -168.9 | -53.3 | -82.2 | 0 | 0 | 0 | 116 | ||||
| 73 | E | 36.5 | Very low | 39.2 | Very low | 192 Ų | 192 | 148 Ų | 148 | 90% | 0.897 | 81% | 0.807 | S | S | * | * | 164.2 | 145.7 | 126.4 | -87.9 | 176.7 | -175 | 0 | 0 | 112.4 | |||||
| 74 | D | 37.6 | Very low | 39.9 | Very low | 152 Ų | 152 | 152.2 Ų | 152.2 | 81% | 0.813 | 81% | 0.814 | S | S | * | * | trans | -63.9 | 151.2 | -174.7 | -56.9 | -74.5 | 0 | 0 | 0 | 115.3 | ||||
| 75 | D | 36.8 | Very low | 40.9 | Very low | 146 Ų | 146 | 152.7 Ų | 152.7 | 78% | 0.781 | 81% | 0.811 | S | S | * | * | 170.3 | 124.7 | 122.2 | -100 | -26.6 | 0 | 0 | 0 | 113 | |||||
| 76 | D | 38.8 | Very low | 41.6 | Very low | 135 Ų | 135 | 150.4 Ų | 150.4 | 72% | 0.722 | 80% | 0.796 | S | S | * | * | trans | 45.9 | 128.6 | 138.5 | -66.5 | -23.6 | 0 | 0 | 0 | 124.8 | ||||
| 77 | D | 44.7 | Very low | 43 | Very low | 137 Ų | 137 | 148.5 Ų | 148.5 | 73% | 0.733 | 79% | 0.785 | S | S | * | * | trans | 43.1 | 118.5 | 136.3 | -69 | -34.5 | 0 | 0 | 0 | 120.7 | ||||
| 78 | D | 40 | Very low | 43.6 | Very low | 162 Ų | 162 | 152.4 Ų | 152.4 | 87% | 0.866 | 79% | 0.792 | S | S | * | * | -167.6 | 127.1 | 107.3 | -103.7 | -33.9 | 0 | 0 | 0 | 110.6 | |||||
| 79 | D | 48.8 | Very low | 45.1 | Very low | 144 Ų | 144 | 147.7 Ų | 147.7 | 77% | 0.77 | 77% | 0.769 | S | S | * | * | trans | -61.5 | 127.5 | 163.6 | -85.7 | -46.3 | 0 | 0 | 0 | 109.6 | ||||
| 80 | D | 42.1 | Very low | 46.8 | Very low | 158 Ų | 158 | 144.5 Ų | 144.5 | 85% | 0.845 | 77% | 0.768 | S | S | * | * | trans | -146.6 | 90.9 | 149.7 | -97.9 | -32.8 | 0 | 0 | 0 | 107.9 | D82 | D80-D82 PolarHBondContact O-N 3.11Š| ||
| 81 | D | 47.4 | Very low | 48.4 | Very low | 143 Ų | 143 | 142.1 Ų | 142.1 | 77% | 0.765 | 77% | 0.769 | S | S | * | * | trans | -63.6 | 84.1 | 161.5 | -86.8 | -40 | 0 | 0 | 0 | 108.7 | D83 | D81-D83 PolarHBondContact O-N 2.83Š| ||
| 82 | D | 45.8 | Very low | 50.1 | Low | 147 Ų | 147 | 138 Ų | 138 | 79% | 0.786 | 75% | 0.752 | S | S | * | * | trans | -82.1 | 93 | 158.2 | -95 | -28.8 | 0 | 0 | 0 | 107.8 | D80 D84 | D80-D82 PolarHBondContact O-N 3.11Å; D82-D84 PolarHBondContact O-N 3.27Å | ||
| 83 | D | 49.5 | Very low | 51.9 | Low | 145 Ų | 145 | 134.5 Ų | 134.5 | 78% | 0.775 | 74% | 0.738 | S | S | * | * | trans | -60.8 | 69.9 | 159.8 | -81.4 | -41.2 | 0 | 0 | 0 | 109.4 | D81 D85 | D81-D83 PolarHBondContact O-N 2.83Å; D83-D85 PolarHBondContact O-N 2.64Å | ||
| 84 | D | 46.7 | Very low | 53.4 | Low | 153 Ų | 153 | 132 Ų | 132 | 82% | 0.818 | 74% | 0.738 | S | S | * | * | trans | -77.2 | 82.1 | 168.3 | -140.1 | -0.8 | 0 | 0 | 0 | 105.8 | D82 G86 | D82-D84 PolarHBondContact O-N 3.27Å; D84-G86 PolarHBondContact O-N 2.88Å | ||
| 85 | D | 54.7 | Low | 54.7 | Low | 155 Ų | 155 | 128.3 Ų | 128.3 | 83% | 0.829 | 74% | 0.737 | S | S | * | * | trans | -49.7 | 88.9 | 172.2 | -99.2 | -35.1 | 0 | 0 | 0 | 108.7 | D83 F87 | D83-D85 PolarHBondContact O-N 2.64Å; D85-F87 PolarHBondContact O-N 2.76Å | ||
| 86 | G | 53.9 | Low | 55.9 | Low | 45 Ų | 45 | 128.2 Ų | 128.2 | 46% | 0.464 | 73% | 0.73 | S | S | . | * | trans | -60.1 | 98.9 | -174.7 | 0 | 0 | 0 | 0 | 0 | 109.1 | D84 F88 | D84-G86 PolarHBondContact O-N 2.88Å; G86-F88 WeakPolarHBondContact O-CD2 3.36Å; G86-F88 PolarHBondContact O-N 3.08Å | ||
| 87 | F | 63.6 | Low | 57.2 | Low | 162 Ų | 162 | 131 Ų | 131 | 71% | 0.711 | 74% | 0.735 | S | S | * | * | trans | -64.2 | 88.5 | 168.4 | 179.3 | -104 | 0 | 0 | 0 | 108.5 | D85 G89 | D85-F87 PolarHBondContact O-N 2.76Å; F87-G89 PolarHBondContact O-N 2.98Å | ||
| 88 | F | 52.2 | Low | 58.1 | Low | 212 Ų | 212 | 134.3 Ų | 134.3 | 93% | 0.93 | 74% | 0.743 | S | S | * | * | trans | -73.9 | 54.1 | 177.9 | -74.8 | -81.4 | 0 | 0 | 0 | 111.9 | G86 | G86-F88 WeakPolarHBondContact O-CD2 3.36Å; G86-F88 PolarHBondContact O-N 3.08Å | ||
| 89 | G | 65.9 | Low | 58.5 | Low | 30 Ų | 30 | 135.4 Ų | 135.4 | 31% | 0.309 | 74% | 0.743 | S | S | . | * | S | Bend | trans | -123.7 | 157.2 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | F87 A91 | F87-G89 PolarHBondContact O-N 2.98Å; G89-A91 PolarHBondContact O-N 3.46Å |
| 90 | P | 67.5 | Low | 58.5 | Low | 125 Ų | 125 | 134 Ų | 134 | 81% | 0.812 | 74% | 0.744 | S | S | * | * | P | Polyproline II helix | trans | -58.2 | 135.8 | 175.4 | 26.1 | -33.9 | 0 | 0 | 0 | 110.4 | L92 | P90-L92 PolarHBondContact O-N 2.98Š|
| 91 | A | 70.9 | Confident | 58.4 | Low | 99 Ų | 99 | 131.8 Ų | 131.8 | 82% | 0.818 | 74% | 0.742 | S | S | * | * | P | Polyproline II helix | trans | -56.5 | 135.6 | 179.6 | 0 | 0 | 0 | 0 | 0 | 111.4 | G89 | G89-A91 PolarHBondContact O-N 3.46Š|
| 92 | L | 70.8 | Confident | 58.3 | Low | 104 Ų | 104 | 129.9 Ų | 129.9 | 55% | 0.545 | 74% | 0.737 | S | S | . | * | P | Polyproline II helix | trans | -66.1 | 143.7 | 177.9 | -80.2 | 98 | 0 | 0 | 0 | 111.1 | P90 F96 | P90-L92 PolarHBondContact O-N 2.98Å; L92-F96 HydrophobicContact CB-CB 4.21Å; L92-F96 HydrophobicContact CD2-CB 3.6Å; L92-F96 HydrophobicContact CD2-CD1 4.2Å; L92-F96 HydrophobicContact CD2-CG 3.9Å |
| 93 | P | 75.7 | Confident | 58.5 | Low | 78 Ų | 78 | 132.6 Ų | 132.6 | 51% | 0.506 | 75% | 0.745 | S | S | . | * | P | Polyproline II helix | trans | -62.7 | 152.7 | 177.2 | 25.4 | -32.6 | 0 | 0 | 0 | 111.7 | G95 F96 | P93-G95 PolarHBondContact O-N 3.14Å; P93-F96 HydrophobicContact CG-CD2 3.96Å; P93-F96 HydrophobicContact CG-CE2 4Å; P93-F96 PolarHBondContact O-N 2.81Å |
| 94 | P | 67.3 | Low | 58.8 | Low | 139 Ų | 139 | 136 Ų | 136 | 90% | 0.903 | 75% | 0.747 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -58 | 122.8 | -179.2 | 22.1 | -32 | 0 | 0 | 0 | 110.9 | ||
| 95 | G | 64.6 | Low | 59.3 | Low | 76 Ų | 76 | 134.1 Ų | 134.1 | 78% | 0.784 | 74% | 0.743 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 128.7 | -16 | -177.5 | 0 | 0 | 0 | 0 | 0 | 114.8 | P93 | P93-G95 PolarHBondContact O-N 3.14Š|
| 96 | F | 63.5 | Low | 59.2 | Low | 144 Ų | 144 | 132.5 Ų | 132.5 | 63% | 0.632 | 74% | 0.741 | S | S | * | * | trans | -97.9 | 116.4 | 176.9 | -69.9 | -96.5 | 0 | 0 | 0 | 110.6 | L92 P93 | L92-F96 HydrophobicContact CB-CB 4.21Å; L92-F96 HydrophobicContact CD2-CB 3.6Å; L92-F96 HydrophobicContact CD2-CD1 4.2Å; L92-F96 HydrophobicContact CD2-CG 3.9Å; P93-F96 HydrophobicContact CG-CD2 3.96Å; P93-F96 HydrophobicContact CG-CE2 4Å; P93-F96 PolarHBondContact O-N 2.81Å | ||
| 97 | K | 65.8 | Low | 59.4 | Low | 194 Ų | 194 | 136.1 Ų | 136.1 | 84% | 0.843 | 75% | 0.754 | S | S | * | * | trans | -85 | 130.3 | 177.5 | -63.1 | -179.5 | -178.3 | -178 | 0 | 109.6 | Q99 | K97-Q99 PolarHBondContact O-N 3.43Š| ||
| 98 | K | 63.7 | Low | 58.8 | Low | 205 Ų | 205 | 137 Ų | 137 | 89% | 0.891 | 77% | 0.765 | S | S | * | * | trans | -61.7 | 114.1 | 167.5 | -65.3 | -178.9 | 179.3 | -172.9 | 0 | 107.6 | ||||
| 99 | Q | 48.2 | Very low | 59.6 | Low | 185 Ų | 185 | 129.1 Ų | 129.1 | 86% | 0.864 | 74% | 0.743 | S | S | * | * | P | Polyproline II helix | trans | -81.8 | 117.3 | 171.1 | -59 | -172.1 | -78 | 0 | 0 | 106.8 | K97 S101 | K97-Q99 PolarHBondContact O-N 3.43Å; Q99-S101 PolarHBondContact O-N 3.03Å |
| 100 | S | 48.5 | Very low | 59.8 | Low | 114 Ų | 114 | 133.7 Ų | 133.7 | 80% | 0.797 | 77% | 0.768 | S | S | * | * | P | Polyproline II helix | trans | -63.3 | 119.8 | 162.3 | 55.4 | 0 | 0 | 0 | 0 | 107.4 | ||
| 101 | S | 40.6 | Very low | 60 | Low | 113 Ų | 113 | 132.2 Ų | 132.2 | 79% | 0.79 | 77% | 0.766 | S | S | * | * | P | Polyproline II helix | trans | -52.6 | 136.5 | 177.3 | -74.4 | 0 | 0 | 0 | 0 | 111.7 | Q99 | Q99-S101 PolarHBondContact O-N 3.03Š|
| 102 | P | 45.1 | Very low | 60 | Low | 103 Ų | 103 | 132.5 Ų | 132.5 | 67% | 0.669 | 75% | 0.753 | S | S | * | * | P | Polyproline II helix | trans | -81.2 | 135.7 | 139.9 | 31.3 | -23.8 | 0 | 0 | 0 | 108.2 | R104 | P102-R104 PolarHBondContact O-N 2.76Š|
| 103 | E | 49.8 | Very low | 60.4 | Low | 203 Ų | 203 | 131.5 Ų | 131.5 | 95% | 0.949 | 75% | 0.753 | S | S | * | * | trans | -42.7 | 104.1 | 172.2 | -68.6 | 176.5 | 144.5 | 0 | 0 | 111 | ||||
| 104 | R | 56.7 | Low | 60.1 | Low | 218 Ų | 218 | 134.3 Ų | 134.3 | 82% | 0.823 | 77% | 0.771 | S | S | * | * | trans | -132.7 | 132.2 | 164.6 | -81.9 | -173.6 | 174.6 | -172.6 | -2 | 107.3 | P102 | P102-R104 PolarHBondContact O-N 2.76Š| ||
| 105 | P | 55.4 | Low | 60 | Low | 113 Ų | 113 | 130.7 Ų | 130.7 | 73% | 0.734 | 76% | 0.759 | S | S | * | * | trans | -57.1 | 138.8 | 179.2 | 23.2 | -32 | 0 | 0 | 0 | 109.4 | V107 | P105-V107 PolarHBondContact O-N 3.01Å; P105-V107 VanDerWaalsContact O-N 3.13Å | ||
| 106 | P | 53.9 | Low | 59.9 | Low | 120 Ų | 120 | 134 Ų | 134 | 78% | 0.779 | 75% | 0.752 | S | S | * | * | trans | -60.7 | 120.3 | -171.8 | 23.4 | -32.9 | 0 | 0 | 0 | 110.1 | L108 | P106-L108 PolarHBondContact O-N 2.97Š| ||
| 107 | V | 57.3 | Low | 60.2 | Low | 122 Ų | 122 | 135.5 Ų | 135.5 | 74% | 0.739 | 76% | 0.761 | S | S | * | * | trans | -69.1 | 99.4 | 171.2 | 177.4 | 0 | 0 | 0 | 0 | 107.2 | P105 G109 | P105-V107 PolarHBondContact O-N 3.01Å; P105-V107 VanDerWaalsContact O-N 3.13Å; V107-G109 PolarHBondContact O-N 3.24Å | ||
| 108 | L | 50.7 | Low | 60.1 | Low | 180 Ų | 180 | 137.3 Ų | 137.3 | 94% | 0.942 | 76% | 0.762 | S | S | * | * | trans | -73.2 | 93.8 | 176.3 | -153.7 | 83.4 | 0 | 0 | 0 | 109.1 | P106 | P106-L108 PolarHBondContact O-N 2.97Š| ||
| 109 | G | 69.1 | Low | 59.4 | Low | 46 Ų | 46 | 132.2 Ų | 132.2 | 47% | 0.474 | 76% | 0.758 | S | S | . | * | S | Bend | trans | 142.1 | 165.4 | 173.2 | 0 | 0 | 0 | 0 | 0 | 114.1 | V107 | V107-G109 PolarHBondContact O-N 3.24Š|
| 110 | P | 71.4 | Confident | 59.2 | Low | 127 Ų | 127 | 127.9 Ų | 127.9 | 83% | 0.825 | 75% | 0.754 | S | S | * | * | S | Bend | trans | -60 | 139.5 | 174.5 | 26.9 | -33.8 | 0 | 0 | 0 | 110.5 | L112 | P110-L112 PolarHBondContact O-N 3.14Š|
| 111 | A | 71.4 | Confident | 58.9 | Low | 94 Ų | 94 | 128.3 Ų | 128.3 | 78% | 0.777 | 76% | 0.757 | S | S | * | * | P | Polyproline II helix | trans | -58.1 | 136.8 | 179.9 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||
| 112 | L | 70.9 | Confident | 58.8 | Low | 104 Ų | 104 | 130.1 Ų | 130.1 | 55% | 0.545 | 76% | 0.758 | S | S | . | * | P | Polyproline II helix | trans | -66.4 | 144.1 | 177.3 | -81.7 | 84.9 | 0 | 0 | 0 | 110.6 | P110 F116 | P110-L112 PolarHBondContact O-N 3.14Å; L112-F116 HydrophobicContact CB-CB 4.05Å; L112-F116 HydrophobicContact CD2-CB 3.56Å; L112-F116 HydrophobicContact CD2-CD1 4.4Å; L112-F116 HydrophobicContact CD2-CG 4.31Å; L112-F116 HydrophobicContact CG-CB 4.43Å |
| 113 | P | 78.1 | Confident | 58.9 | Low | 83 Ų | 83 | 131 Ų | 131 | 54% | 0.539 | 77% | 0.766 | S | S | . | * | P | Polyproline II helix | trans | -60.6 | 156.1 | 178.5 | 23.2 | -31.8 | 0 | 0 | 0 | 112 | G115 F116 | P113-G115 PolarHBondContact O-N 3.23Å; P113-F116 HydrophobicContact CG-CD2 4.39Å; P113-F116 PolarHBondContact O-N 2.89Å |
| 114 | P | 69 | Low | 58.3 | Low | 138 Ų | 138 | 128.4 Ų | 128.4 | 90% | 0.896 | 76% | 0.759 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -52.9 | 124.1 | 179.6 | -23.3 | 32.4 | 0 | 0 | 0 | 111.5 | ||
| 115 | G | 66.5 | Low | 57.7 | Low | 62 Ų | 62 | 125.6 Ų | 125.6 | 64% | 0.639 | 76% | 0.76 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 110.2 | -5.4 | -179.2 | 0 | 0 | 0 | 0 | 0 | 115.7 | P113 | P113-G115 PolarHBondContact O-N 3.23Š|
| 116 | F | 63.1 | Low | 56.7 | Low | 146 Ų | 146 | 123.5 Ų | 123.5 | 64% | 0.64 | 76% | 0.76 | S | S | * | * | trans | -111.8 | 114.8 | 173.8 | -77.8 | -104.3 | 0 | 0 | 0 | 110.8 | L112 P113 | L112-F116 HydrophobicContact CB-CB 4.05Å; L112-F116 HydrophobicContact CD2-CB 3.56Å; L112-F116 HydrophobicContact CD2-CD1 4.4Å; L112-F116 HydrophobicContact CD2-CG 4.31Å; L112-F116 HydrophobicContact CG-CB 4.43Å; P113-F116 HydrophobicContact CG-CD2 4.39Å; P113-F116 PolarHBondContact O-N 2.89Å | ||
| 117 | H | 68.8 | Low | 56.4 | Low | 176 Ų | 176 | 126.3 Ų | 126.3 | 82% | 0.815 | 76% | 0.762 | S | S | * | * | trans | -112.7 | 139.3 | 176.8 | -54.4 | -60.9 | 0 | 0 | 0 | 109.9 | ||||
| 118 | R | 62.8 | Low | 55.9 | Low | 232 Ų | 232 | 128.1 Ų | 128.1 | 88% | 0.875 | 77% | 0.768 | S | S | * | * | P | Polyproline II helix | trans | -70.4 | 133.3 | 165.3 | -91.7 | -173.7 | -177.9 | -115.8 | 2.4 | 108.2 | A120 | R118-A120 PolarHBondContact O-N 3.44Š|
| 119 | A | 49.6 | Very low | 55.5 | Low | 97 Ų | 97 | 122.6 Ų | 122.6 | 80% | 0.802 | 76% | 0.755 | S | S | * | * | P | Polyproline II helix | trans | -58.5 | 127.7 | 166.8 | 0 | 0 | 0 | 0 | 0 | 108.3 | S121 | A119-S121 PolarHBondContact O-N 3.45Š|
| 120 | A | 43.5 | Very low | 54.8 | Low | 95 Ų | 95 | 129.4 Ų | 129.4 | 79% | 0.785 | 77% | 0.774 | S | S | * | * | P | Polyproline II helix | trans | -60.5 | 125.3 | 173.4 | 0 | 0 | 0 | 0 | 0 | 108 | R118 D122 | R118-A120 PolarHBondContact O-N 3.44Å; A120-D122 VanDerWaalsContact C-N 3.31Å; A120-D122 PolarHBondContact O-N 2.9Å |
| 121 | S | 43.3 | Very low | 53.6 | Low | 123 Ų | 123 | 130.8 Ų | 130.8 | 86% | 0.86 | 78% | 0.775 | S | S | * | * | trans | -69.4 | 98.5 | 163 | -8.3 | 0 | 0 | 0 | 0 | 105.3 | A119 | A119-S121 PolarHBondContact O-N 3.45Š| ||
| 122 | D | 39 | Very low | 52.6 | Low | 150 Ų | 150 | 133.9 Ų | 133.9 | 80% | 0.802 | 78% | 0.777 | S | S | * | * | trans | -75.1 | 121.2 | 162.1 | -149 | 1.6 | 0 | 0 | 0 | 105.8 | A120 D124 | A120-D122 VanDerWaalsContact C-N 3.31Å; A120-D122 PolarHBondContact O-N 2.9Å; D122-D124 PolarHBondContact O-N 3.36Å | ||
| 123 | S | 46.3 | Very low | 51.5 | Low | 122 Ų | 122 | 135.4 Ų | 135.4 | 85% | 0.853 | 79% | 0.793 | S | S | * | * | trans | -81.7 | 96.3 | 174.6 | -166.4 | 0 | 0 | 0 | 0 | 105.7 | ||||
| 124 | D | 37.6 | Very low | 50.6 | Low | 148 Ų | 148 | 134 Ų | 134 | 79% | 0.791 | 79% | 0.794 | S | S | * | * | trans | -130.8 | 140.2 | 165.1 | -158.7 | 41.7 | 0 | 0 | 0 | 110.2 | D122 | D122-D124 PolarHBondContact O-N 3.36Š| ||
| 125 | D | 43.4 | Very low | 50.4 | Low | 159 Ų | 159 | 133.5 Ų | 133.5 | 85% | 0.85 | 79% | 0.791 | S | S | * | * | trans | -55.7 | 140.2 | -171 | -168.4 | 48.6 | 0 | 0 | 0 | 113.3 | ||||
| 126 | G | 35.3 | Very low | 50.2 | Low | 70 Ų | 70 | 135.5 Ų | 135.5 | 72% | 0.722 | 80% | 0.801 | S | S | * | * | trans | 173.4 | 111.9 | 175.8 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 127 | E | 47.2 | Very low | 50.2 | Low | 178 Ų | 178 | 134.2 Ų | 134.2 | 83% | 0.832 | 80% | 0.8 | S | S | * | * | trans | -58.1 | 166.3 | 175.3 | -66.7 | 176.2 | 141.5 | 0 | 0 | 113.5 | ||||
| 128 | D | 46.7 | Very low | 50.4 | Low | 160 Ų | 160 | 130.1 Ų | 130.1 | 86% | 0.856 | 79% | 0.79 | S | S | * | * | trans | 56.6 | 105.3 | 158.6 | 76.8 | -67.6 | 0 | 0 | 0 | 120 | ||||
| 129 | G | 42.8 | Very low | 50.1 | Low | 65 Ų | 65 | 126 Ų | 126 | 67% | 0.67 | 79% | 0.792 | S | S | * | * | trans | 160 | 113.6 | 159.2 | 0 | 0 | 0 | 0 | 0 | 113.6 | D131 | G129-D131 PolarHBondContact O-N 2.83Š| ||
| 130 | E | 53.9 | Low | 50.5 | Low | 188 Ų | 188 | 125.1 Ų | 125.1 | 88% | 0.879 | 79% | 0.794 | S | S | * | * | trans | -61.3 | 72.2 | 174.7 | -48.8 | -70.4 | 167.1 | 0 | 0 | 112.3 | L132 | E130-L132 PolarHBondContact O-N 3.49Š| ||
| 131 | D | 45.9 | Very low | 51.3 | Low | 157 Ų | 157 | 128 Ų | 128 | 84% | 0.84 | 79% | 0.785 | S | S | * | * | trans | -91.3 | 85.5 | 177.3 | -90.2 | -13.8 | 0 | 0 | 0 | 111.1 | G129 | G129-D131 PolarHBondContact O-N 2.83Š| ||
| 132 | L | 50.4 | Low | 51.9 | Low | 159 Ų | 159 | 130.3 Ų | 130.3 | 83% | 0.832 | 78% | 0.782 | S | S | * | * | trans | -55.7 | 124.9 | 160.7 | -67.1 | 163.8 | 0 | 0 | 0 | 108.8 | E130 G134 | E130-L132 PolarHBondContact O-N 3.49Å; L132-G134 VanDerWaalsContact C-N 3.31Å; L132-G134 PolarHBondContact O-N 3.16Å | ||
| 133 | P | 48.8 | Very low | 52.8 | Low | 135 Ų | 135 | 126.7 Ų | 126.7 | 88% | 0.877 | 77% | 0.773 | S | S | * | * | trans | -74.4 | 83.1 | -175.5 | 29.8 | -34.7 | 0 | 0 | 0 | 111.1 | ||||
| 134 | G | 58.8 | Low | 52.6 | Low | 55 Ų | 55 | 129 Ų | 129 | 57% | 0.567 | 77% | 0.771 | S | S | * | * | P | Polyproline II helix | trans | -84.5 | 157.6 | 166.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | L132 A136 | L132-G134 VanDerWaalsContact C-N 3.31Å; L132-G134 PolarHBondContact O-N 3.16Å; G134-A136 PolarHBondContact O-N 3.42Å |
| 135 | P | 64.7 | Low | 53 | Low | 127 Ų | 127 | 133.3 Ų | 133.3 | 83% | 0.825 | 78% | 0.776 | S | S | * | * | P | Polyproline II helix | trans | -59.5 | 129.9 | 173.9 | 25.6 | -33 | 0 | 0 | 0 | 110.3 | L137 | P135-L137 PolarHBondContact O-N 2.7Š|
| 136 | A | 62.4 | Low | 52.9 | Low | 103 Ų | 103 | 131.1 Ų | 131.1 | 85% | 0.851 | 77% | 0.773 | S | S | * | * | P | Polyproline II helix | trans | -56.8 | 125.1 | -179.8 | 0 | 0 | 0 | 0 | 0 | 111.1 | G134 | G134-A136 PolarHBondContact O-N 3.42Š|
| 137 | L | 63.8 | Low | 53.6 | Low | 119 Ų | 119 | 132.8 Ų | 132.8 | 62% | 0.623 | 77% | 0.774 | S | S | * | * | P | Polyproline II helix | trans | -70 | 147.8 | 177 | -66.7 | 168.3 | 0 | 0 | 0 | 110.2 | P135 Y141 | P135-L137 PolarHBondContact O-N 2.7Å; L137-Y141 HydrophobicContact CD1-CD1 3.66Å; L137-Y141 HydrophobicContact CD1-CE1 3.98Å |
| 138 | P | 71.2 | Confident | 53.3 | Low | 91 Ų | 91 | 129.3 Ų | 129.3 | 59% | 0.591 | 77% | 0.769 | S | S | * | * | P | Polyproline II helix | trans | -62.2 | 148.8 | -177.5 | 24.9 | -33.8 | 0 | 0 | 0 | 111.9 | G140 Y141 | P138-G140 PolarHBondContact O-N 2.91Å; P138-G140 VanDerWaalsContact O-N 3.1Å; P138-Y141 PolarHBondContact O-N 2.88Å |
| 139 | P | 57.9 | Low | 53.5 | Low | 144 Ų | 144 | 130.9 Ų | 130.9 | 94% | 0.935 | 77% | 0.771 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -55.9 | 117.4 | 178.4 | -23.3 | 32.8 | 0 | 0 | 0 | 111.3 | ||
| 140 | G | 58.4 | Low | 53.7 | Low | 80 Ų | 80 | 131.9 Ų | 131.9 | 83% | 0.825 | 77% | 0.773 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 115.3 | 1.1 | 178 | 0 | 0 | 0 | 0 | 0 | 116.4 | P138 | P138-G140 PolarHBondContact O-N 2.91Å; P138-G140 VanDerWaalsContact O-N 3.1Å |
| 141 | Y | 60.2 | Low | 53.8 | Low | 154 Ų | 154 | 132.2 Ų | 132.2 | 60% | 0.604 | 77% | 0.774 | S | S | * | * | trans | -84.1 | 116.8 | 173.5 | -171.7 | -97.5 | 0 | 0 | 0 | 111.4 | L137 P138 A143 | L137-Y141 HydrophobicContact CD1-CD1 3.66Å; L137-Y141 HydrophobicContact CD1-CE1 3.98Å; P138-Y141 PolarHBondContact O-N 2.88Å; Y141-A143 HydrophobicContact CE1-CB 4.15Å | ||
| 142 | Q | 54.8 | Low | 54.4 | Low | 173 Ų | 173 | 132.3 Ų | 132.3 | 81% | 0.808 | 78% | 0.775 | S | S | * | * | trans | -105.9 | 115.7 | 169.7 | -68.3 | -173.8 | -30.4 | 0 | 0 | 108.7 | E144 | Q142-E144 PolarHBondContact O-N 3.26Š| ||
| 143 | A | 57.6 | Low | 54.8 | Low | 73 Ų | 73 | 133.8 Ų | 133.8 | 60% | 0.603 | 78% | 0.778 | S | S | * | * | trans | -75.9 | 110.2 | 170.3 | 0 | 0 | 0 | 0 | 0 | 108.4 | Y141 R145 | Y141-A143 HydrophobicContact CE1-CB 4.15Å; A143-R145 PolarHBondContact O-N 3.45Å | ||
| 144 | E | 42.3 | Very low | 55.5 | Low | 172 Ų | 172 | 134.8 Ų | 134.8 | 80% | 0.804 | 78% | 0.776 | S | S | * | * | trans | -60.6 | 104.1 | 168.9 | -73.9 | -72.4 | 179.6 | 0 | 0 | 108.5 | Q142 S146 | Q142-E144 PolarHBondContact O-N 3.26Å; E144-S146 PolarHBondContact O-N 3.39Å; E144-S146 VanDerWaalsContact O-N 3.08Å | ||
| 145 | R | 46.7 | Very low | 55.8 | Low | 237 Ų | 237 | 137.3 Ų | 137.3 | 89% | 0.894 | 78% | 0.78 | S | S | * | * | trans | -73.3 | 95.1 | 167.7 | -70.6 | -177.1 | -176.6 | 177.9 | 0.4 | 106.7 | A143 S147 | A143-R145 PolarHBondContact O-N 3.45Å; R145-S147 VanDerWaalsContact C-N 3.29Å; R145-S147 PolarHBondContact O-N 3.47Å | ||
| 146 | S | 40.5 | Very low | 55.9 | Low | 113 Ų | 113 | 140.2 Ų | 140.2 | 79% | 0.79 | 79% | 0.786 | S | S | * | * | trans | -61.7 | 97.9 | 163.2 | -80.7 | 0 | 0 | 0 | 0 | 108.5 | E144 S148 | E144-S146 PolarHBondContact O-N 3.39Å; E144-S146 VanDerWaalsContact O-N 3.08Å; S146-S148 PolarHBondContact O-N 2.93Å | ||
| 147 | S | 50.9 | Low | 56.5 | Low | 106 Ų | 106 | 137.5 Ų | 137.5 | 74% | 0.741 | 77% | 0.768 | S | S | * | * | trans | -65.6 | 110.7 | 159.9 | -175.1 | 0 | 0 | 0 | 0 | 107.9 | R145 | R145-S147 VanDerWaalsContact C-N 3.29Å; R145-S147 PolarHBondContact O-N 3.47Å | ||
| 148 | S | 40.2 | Very low | 57.2 | Low | 105 Ų | 105 | 138.3 Ų | 138.3 | 73% | 0.734 | 78% | 0.781 | S | S | * | * | trans | -128 | 93 | 159.4 | 60.9 | 0 | 0 | 0 | 0 | 107.6 | S146 A150 | S146-S148 PolarHBondContact O-N 2.93Å; S148-A150 PolarHBondContact O-N 3.28Å; S148-A150 VanDerWaalsContact O-N 3.16Å | ||
| 149 | E | 51.6 | Low | 57.3 | Low | 192 Ų | 192 | 139.6 Ų | 139.6 | 90% | 0.897 | 78% | 0.78 | S | S | * | * | trans | -56.2 | 108.1 | 157 | -84.8 | 175.1 | 97.1 | 0 | 0 | 108.7 | ||||
| 150 | A | 46.5 | Very low | 58 | Low | 86 Ų | 86 | 138 Ų | 138 | 71% | 0.711 | 77% | 0.77 | S | S | * | * | trans | -149.5 | 99.9 | 154.7 | 0 | 0 | 0 | 0 | 0 | 106.2 | S148 D152 | S148-A150 PolarHBondContact O-N 3.28Å; S148-A150 VanDerWaalsContact O-N 3.16Å; A150-D152 PolarHBondContact O-N 2.86Å | ||
| 151 | E | 56.6 | Low | 58.7 | Low | 195 Ų | 195 | 138.6 Ų | 138.6 | 91% | 0.911 | 77% | 0.767 | S | S | * | * | trans | -53.6 | 107.4 | 165.8 | -64.6 | 178.6 | 158.6 | 0 | 0 | 108.7 | ||||
| 152 | D | 58.6 | Low | 58.8 | Low | 159 Ų | 159 | 140.5 Ų | 140.5 | 85% | 0.85 | 78% | 0.779 | S | S | * | * | trans | -161.9 | 50.1 | 157.8 | -84.9 | -34.9 | 0 | 0 | 0 | 107.3 | A150 D154 | A150-D152 PolarHBondContact O-N 2.86Å; D152-D154 VanDerWaalsContact C-N 3.31Å; D152-D154 PolarHBondContact O-N 2.75Å; D152-D154 VanDerWaalsContact O-N 3.12Å | ||
| 153 | E | 58.2 | Low | 59.7 | Low | 190 Ų | 190 | 134.2 Ų | 134.2 | 89% | 0.888 | 76% | 0.761 | S | S | * | * | trans | -75 | 89.2 | 161.2 | -82.9 | -177.7 | 171.3 | 0 | 0 | 107.8 | ||||
| 154 | D | 63.5 | Low | 60.1 | Low | 157 Ų | 157 | 136.7 Ų | 136.7 | 84% | 0.84 | 77% | 0.771 | S | S | * | * | S | Bend | trans | 167.6 | 77.3 | 146.2 | -84.1 | -28.1 | 0 | 0 | 0 | 109.7 | D152 | D152-D154 VanDerWaalsContact C-N 3.31Å; D152-D154 PolarHBondContact O-N 2.75Å; D152-D154 VanDerWaalsContact O-N 3.12Å |
| 155 | V | 64.9 | Low | 61 | Low | 108 Ų | 108 | 134.1 Ų | 134.1 | 66% | 0.655 | 77% | 0.766 | S | S | * | * | trans | 173.2 | 83.4 | 146.1 | 155.9 | 0 | 0 | 0 | 0 | 107.9 | M159 | V155-M159 HydrophobicContact CG1-CG 4.05Š| ||
| 156 | I | 67.6 | Low | 61.8 | Low | 187 Ų | 187 | 131.4 Ų | 131.4 | 96% | 0.959 | 76% | 0.764 | S | S | * | * | trans | -94.6 | 95.3 | 168.2 | -64.5 | 161.4 | 0 | 0 | 0 | 106.9 | ||||
| 157 | G | 74.9 | Confident | 63 | Low | 46 Ų | 46 | 130.9 Ų | 130.9 | 47% | 0.474 | 75% | 0.752 | S | S | . | * | S | Bend | trans | 157.7 | 156.7 | 174.6 | 0 | 0 | 0 | 0 | 0 | 113.3 | M159 | G157-M159 PolarHBondContact O-N 2.68Å; G157-M159 VanDerWaalsContact O-N 3.16Å |
| 158 | P | 78.4 | Confident | 64.3 | Low | 136 Ų | 136 | 128.6 Ų | 128.6 | 88% | 0.883 | 74% | 0.736 | S | S | * | * | P | Polyproline II helix | trans | -63.5 | 118 | 176.9 | 26.2 | -32.8 | 0 | 0 | 0 | 110 | ||
| 159 | M | 73.1 | Confident | 66.2 | Low | 118 Ų | 118 | 128.5 Ų | 128.5 | 58% | 0.581 | 73% | 0.731 | S | S | * | * | P | Polyproline II helix | trans | -62.4 | 131.1 | 174.4 | -79.6 | -172 | 69 | 0 | 0 | 110.2 | V155 G157 K162 | V155-M159 HydrophobicContact CG1-CG 4.05Å; G157-M159 PolarHBondContact O-N 2.68Å; G157-M159 VanDerWaalsContact O-N 3.16Å; M159-K162 VanDerWaalsContact CE-CE 3.5Å |
| 160 | P | 72.9 | Confident | 67.6 | Low | 112 Ų | 112 | 122.6 Ų | 122.6 | 73% | 0.727 | 72% | 0.715 | S | S | * | * | P | Polyproline II helix | trans | -61.1 | 142.9 | 173.9 | 24.3 | -31.6 | 0 | 0 | 0 | 110.4 | K162 | P160-K162 PolarHBondContact O-N 2.92Å; P160-K162 VanDerWaalsContact O-N 3.17Å |
| 161 | A | 72.7 | Confident | 69.4 | Low | 92 Ų | 92 | 122.6 Ų | 122.6 | 76% | 0.76 | 70% | 0.702 | S | S | * | * | P | Polyproline II helix | trans | -58.4 | 120.8 | -179 | 0 | 0 | 0 | 0 | 0 | 110.4 | G163 | A161-G163 PolarHBondContact O-N 3.18Š|
| 162 | K | 63.4 | Low | 70.8 | Confident | 193 Ų | 193 | 116.2 Ų | 116.2 | 84% | 0.839 | 67% | 0.673 | S | S | * | * | S | Bend | trans | -78.7 | 74.4 | 173.7 | -68.2 | 176.1 | 177.5 | 173.1 | 0 | 109.3 | M159 P160 | M159-K162 VanDerWaalsContact CE-CE 3.5Å; P160-K162 PolarHBondContact O-N 2.92Å; P160-K162 VanDerWaalsContact O-N 3.17Å |
| 163 | G | 71.9 | Confident | 72.1 | Confident | 42 Ų | 42 | 114.9 Ų | 114.9 | 43% | 0.433 | 66% | 0.66 | S | S | . | * | S | Bend | trans | -160.1 | 160.6 | 176 | 0 | 0 | 0 | 0 | 0 | 111.3 | A161 V165 | A161-G163 PolarHBondContact O-N 3.18Å; G163-V165 PolarHBondContact O-N 3.39Å |
| 164 | P | 66.4 | Low | 73.6 | Confident | 125 Ų | 125 | 110.9 Ų | 110.9 | 81% | 0.812 | 64% | 0.641 | S | S | * | * | trans | -60.3 | 111.3 | 174.4 | 24.9 | -31.5 | 0 | 0 | 0 | 108.8 | Q166 | P164-Q166 PolarHBondContact O-N 3.48Š| ||
| 165 | V | 62 | Low | 74.9 | Confident | 117 Ų | 117 | 110.3 Ų | 110.3 | 71% | 0.709 | 63% | 0.627 | S | S | * | * | trans | -65.6 | 106 | 178.6 | -172.3 | 0 | 0 | 0 | 0 | 107.3 | G163 D167 | G163-V165 PolarHBondContact O-N 3.39Å; V165-D167 HydrophobicContact CG1-CB 4.36Å; V165-D167 WeakPolarHBondContact CG1-O 3.4Å; V165-D167 PolarHBondContact O-N 2.87Å | ||
| 166 | Q | 63.1 | Low | 76 | Confident | 180 Ų | 180 | 111.7 Ų | 111.7 | 84% | 0.841 | 62% | 0.62 | S | S | * | * | S | Bend | trans | -71 | -15.6 | 179 | -65.7 | -173.2 | -13.6 | 0 | 0 | 112.3 | P164 S168 | P164-Q166 PolarHBondContact O-N 3.48Å; Q166-S168 PolarHBondContact O-N 2.83Å |
| 167 | D | 64.7 | Low | 77.1 | Confident | 103 Ų | 103 | 105.6 Ų | 105.6 | 55% | 0.551 | 60% | 0.598 | S | S | * | * | S | Bend | trans | -93.7 | 96.1 | 176.2 | -72.4 | -20.1 | 0 | 0 | 0 | 109.9 | V165 | V165-D167 HydrophobicContact CG1-CB 4.36Å; V165-D167 WeakPolarHBondContact CG1-O 3.4Å; V165-D167 PolarHBondContact O-N 2.87Å |
| 168 | S | 78.4 | Confident | 77.7 | Confident | 57 Ų | 57 | 108 Ų | 108 | 40% | 0.399 | 60% | 0.597 | S | S | . | * | trans | -63.9 | 144.3 | 169.9 | 73 | 0 | 0 | 0 | 0 | 110.2 | Q166 A170 L171 E172 | Q166-S168 PolarHBondContact O-N 2.83Å; S168-A170 PolarHBondContact O-N 3.05Å; S168-L171 WeakPolarHBondContact O-CB 3.33Å; S168-L171 PolarHBondContact O-N 3.4Å; S168-L171 WeakPolarHBondContact OG-CG 3.35Å; S168-L171 PolarHBondContact OG-N 3.1Å; S168-E172 PolarHBondContact O-N 3.4Å | ||
| 169 | V | 80.4 | Confident | 78.1 | Confident | 104 Ų | 104 | 106.9 Ų | 106.9 | 63% | 0.63 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -51.7 | -33.4 | 178 | 173.4 | 0 | 0 | 0 | 0 | 111.8 | E172 F173 | V169-E172 WeakPolarHBondContact O-CB 2.99Å; V169-E172 PolarHBondContact O-N 2.78Å; V169-F173 HydrophobicContact CG1-CD2 3.69Å; V169-F173 HydrophobicContact CG1-CE2 3.28Å; V169-F173 HydrophobicContact CG1-CZ 4.21Å; V169-F173 WeakPolarHBondContact O-CD2 3.21Å; V169-F173 PolarHBondContact O-N 3.42Å; V169-F173 VanDerWaalsContact O-N 3.09Å |
| 170 | A | 82.3 | Confident | 78.7 | Confident | 68 Ų | 68 | 106.9 Ų | 106.9 | 56% | 0.562 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -62.4 | -42.2 | 175.1 | 0 | 0 | 0 | 0 | 0 | 113.2 | S168 E172 F173 E174 | S168-A170 PolarHBondContact O-N 3.05Å; A170-E172 VanDerWaalsContact C-N 3.34Å; A170-F173 PolarHBondContact O-N 2.88Å; A170-E174 PolarHBondContact O-N 3.28Å |
| 171 | L | 84.6 | Confident | 79.3 | Confident | 85 Ų | 85 | 108.2 Ų | 108.2 | 45% | 0.445 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -71 | -29.7 | 177.2 | -67.7 | 173.8 | 0 | 0 | 0 | 112 | S168 R175 | S168-L171 WeakPolarHBondContact O-CB 3.33Å; S168-L171 PolarHBondContact O-N 3.4Å; S168-L171 WeakPolarHBondContact OG-CG 3.35Å; S168-L171 PolarHBondContact OG-N 3.1Å; L171-R175 VanDerWaalsContact O-CB 3.3Å; L171-R175 WeakPolarHBondContact O-CB 3.43Å; L171-R175 PolarHBondContact O-N 3.25Å |
| 172 | E | 85.5 | Confident | 79.7 | Confident | 62 Ų | 62 | 109.9 Ų | 109.9 | 29% | 0.29 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -61.4 | -53.4 | 169.5 | -165.2 | -66.7 | 163.6 | 0 | 0 | 109.7 | S168 V169 A170 E174 R175 R176 R179 | S168-E172 PolarHBondContact O-N 3.4Å; V169-E172 WeakPolarHBondContact O-CB 2.99Å; V169-E172 PolarHBondContact O-N 2.78Å; A170-E172 VanDerWaalsContact C-N 3.34Å; E172-E174 PolarHBondContact O-N 2.85Å; E172-R175 CarbonylContact O-C 3.58Å; E172-R175 PolarHBondContact O-N 3.46Å; E172-R175 VanDerWaalsContact O-N 3.09Å; E172-R176 WeakPolarHBondContact O-CB 3.22Å; E172-R176 PolarHBondContact O-N 3.43Å; E172-R176 IonicContact OE1-CZ 2.68Å; E172-R176 IonicContact OE1-NE 2.82Å; E172-R176 PolarHBondContact OE1-NE 3.28Å; E172-R176 IonicContact OE1-NH2 3.01Å; E172-R176 PolarHBondContact OE1-NH2 3.16Å; E172-R176 IonicContact OE2-CZ 3.97Å; E172-R176 IonicContact OE2-NE 2.91Å; E172-R176 PolarHBondContact OE2-NE 2.9Å; E172-R176 VanDerWaalsContact OE2-NE 3.13Å; E172-R176 IonicContact OE2-NH2 2.88Å; E172-R179 IonicContact OE1-NH2 2.79Å |
| 173 | F | 86.1 | Confident | 80.4 | Confident | 131 Ų | 131 | 109.3 Ų | 109.3 | 58% | 0.575 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -59 | -40.5 | -176.4 | -78.2 | -58.6 | 0 | 0 | 0 | 111.2 | V169 A170 R176 A177 | V169-F173 HydrophobicContact CG1-CD2 3.69Å; V169-F173 HydrophobicContact CG1-CE2 3.28Å; V169-F173 HydrophobicContact CG1-CZ 4.21Å; V169-F173 WeakPolarHBondContact O-CD2 3.21Å; V169-F173 PolarHBondContact O-N 3.42Å; V169-F173 VanDerWaalsContact O-N 3.09Å; A170-F173 PolarHBondContact O-N 2.88Å; F173-R176 PolarHBondContact O-N 2.75Å; F173-A177 VanDerWaalsContact O-CB 3.3Å; F173-A177 WeakPolarHBondContact O-CB 3.17Å; F173-A177 PolarHBondContact O-N 3.29Å |
| 174 | E | 89.7 | Confident | 80.5 | Confident | 105 Ų | 105 | 114 Ų | 114 | 49% | 0.491 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -64.9 | -46.7 | 175.4 | -173.5 | 171.1 | -161.8 | 0 | 0 | 111.9 | A170 E172 R176 A177 Q178 | A170-E174 PolarHBondContact O-N 3.28Å; E172-E174 PolarHBondContact O-N 2.85Å; E174-R176 VanDerWaalsContact C-N 3.29Å; E174-R176 PolarHBondContact O-N 2.96Å; E174-A177 PolarHBondContact O-N 3.37Å; E174-Q178 WeakPolarHBondContact O-CB 3.35Å; E174-Q178 WeakPolarHBondContact O-CG 3.31Å; E174-Q178 PolarHBondContact O-N 3.36Å |
| 175 | R | 89.6 | Confident | 80.6 | Confident | 146 Ų | 146 | 112.4 Ų | 112.4 | 55% | 0.551 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -63.9 | -35.4 | 176.7 | -167 | -174.6 | -68.5 | -163.3 | 4.2 | 111.9 | L171 E172 R179 | L171-R175 VanDerWaalsContact O-CB 3.3Å; L171-R175 WeakPolarHBondContact O-CB 3.43Å; L171-R175 PolarHBondContact O-N 3.25Å; E172-R175 CarbonylContact O-C 3.58Å; E172-R175 PolarHBondContact O-N 3.46Å; E172-R175 VanDerWaalsContact O-N 3.09Å; R175-R179 WeakPolarHBondContact O-CB 3.44Å; R175-R179 WeakPolarHBondContact O-CG 3.4Å; R175-R179 PolarHBondContact O-N 2.97Å; R175-R179 PolarHBondContact O-NE 3.24Å |
| 176 | R | 88.4 | Confident | 80.7 | Confident | 136 Ų | 136 | 109.2 Ų | 109.2 | 51% | 0.513 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -67.8 | -43.4 | 175.3 | -179.8 | -178.2 | -66.4 | -133.8 | -4 | 111 | E172 F173 E174 R179 M180 | E172-R176 WeakPolarHBondContact O-CB 3.22Å; E172-R176 PolarHBondContact O-N 3.43Å; E172-R176 IonicContact OE1-CZ 2.68Å; E172-R176 IonicContact OE1-NE 2.82Å; E172-R176 PolarHBondContact OE1-NE 3.28Å; E172-R176 IonicContact OE1-NH2 3.01Å; E172-R176 PolarHBondContact OE1-NH2 3.16Å; E172-R176 IonicContact OE2-CZ 3.97Å; E172-R176 IonicContact OE2-NE 2.91Å; E172-R176 PolarHBondContact OE2-NE 2.9Å; E172-R176 VanDerWaalsContact OE2-NE 3.13Å; E172-R176 IonicContact OE2-NH2 2.88Å; F173-R176 PolarHBondContact O-N 2.75Å; E174-R176 VanDerWaalsContact C-N 3.29Å; E174-R176 PolarHBondContact O-N 2.96Å; R176-R179 PolarHBondContact O-N 2.98Å; R176-M180 WeakPolarHBondContact O-CB 2.98Å; R176-M180 PolarHBondContact O-N 3.4Å |
| 177 | A | 89.9 | Confident | 80.3 | Confident | 59 Ų | 59 | 110.3 Ų | 110.3 | 49% | 0.488 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -64.3 | -42.1 | 175.8 | 0 | 0 | 0 | 0 | 0 | 111.5 | F173 E174 M180 K181 | F173-A177 VanDerWaalsContact O-CB 3.3Å; F173-A177 WeakPolarHBondContact O-CB 3.17Å; F173-A177 PolarHBondContact O-N 3.29Å; E174-A177 PolarHBondContact O-N 3.37Å; A177-M180 PolarHBondContact O-N 3.06Å; A177-K181 WeakPolarHBondContact O-CB 3.23Å; A177-K181 PolarHBondContact O-N 2.85Å |
| 178 | Q | 88.9 | Confident | 80 | Confident | 98 Ų | 98 | 113.3 Ų | 113.3 | 46% | 0.458 | 57% | 0.568 | S | S | . | * | H | α-helix | trans | -61.4 | -47.6 | 174.5 | -73.1 | 176.2 | 4.8 | 0 | 0 | 111.6 | E174 M180 K181 E182 | E174-Q178 WeakPolarHBondContact O-CB 3.35Å; E174-Q178 WeakPolarHBondContact O-CG 3.31Å; E174-Q178 PolarHBondContact O-N 3.36Å; Q178-M180 VanDerWaalsContact C-N 3.29Å; Q178-M180 PolarHBondContact O-N 3.21Å; Q178-K181 WeakPolarHBondContact O-CB 3.45Å; Q178-K181 PolarHBondContact O-N 3.15Å; Q178-K181 VanDerWaalsContact O-N 3.13Å; Q178-E182 WeakPolarHBondContact O-CG 3.22Å; Q178-E182 PolarHBondContact O-N 3.4Å |
| 179 | R | 87.1 | Confident | 79 | Confident | 111 Ų | 111 | 115 Ų | 115 | 42% | 0.419 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -57.9 | -39.2 | 173.6 | -81.5 | -177.6 | -87.1 | 127 | -5.2 | 112.8 | E172 R175 R176 K183 | E172-R179 IonicContact OE1-NH2 2.79Å; R175-R179 WeakPolarHBondContact O-CB 3.44Å; R175-R179 WeakPolarHBondContact O-CG 3.4Å; R175-R179 PolarHBondContact O-N 2.97Å; R175-R179 PolarHBondContact O-NE 3.24Å; R176-R179 PolarHBondContact O-N 2.98Å; R179-K183 VanDerWaalsContact O-CG 3.24Å; R179-K183 WeakPolarHBondContact O-CG 3.34Å; R179-K183 PolarHBondContact O-N 3.04Å |
| 180 | M | 83.9 | Confident | 78 | Confident | 118 Ų | 118 | 114.3 Ų | 114.3 | 58% | 0.581 | 58% | 0.583 | S | S | * | * | H | α-helix | trans | -69.5 | -40.7 | 176.6 | -174.2 | -175.9 | -72.4 | 0 | 0 | 111.4 | R176 A177 Q178 K183 L184 | R176-M180 WeakPolarHBondContact O-CB 2.98Å; R176-M180 PolarHBondContact O-N 3.4Å; A177-M180 PolarHBondContact O-N 3.06Å; Q178-M180 VanDerWaalsContact C-N 3.29Å; Q178-M180 PolarHBondContact O-N 3.21Å; M180-K183 WeakPolarHBondContact O-CB 3.42Å; M180-K183 PolarHBondContact O-N 3.34Å; M180-L184 HydrophobicContact CG-CD1 4.32Å; M180-L184 WeakPolarHBondContact O-CG 3.41Å; M180-L184 PolarHBondContact O-N 2.92Å; M180-L184 VanDerWaalsContact O-N 3.13Å |
| 181 | K | 85.7 | Confident | 77 | Confident | 140 Ų | 140 | 119.4 Ų | 119.4 | 61% | 0.609 | 60% | 0.595 | S | S | * | * | H | α-helix | trans | -61.9 | -47.3 | 176.5 | -175.3 | -178.5 | 176.4 | -175.5 | 0 | 111 | A177 Q178 K183 L184 T185 | A177-K181 WeakPolarHBondContact O-CB 3.23Å; A177-K181 PolarHBondContact O-N 2.85Å; Q178-K181 WeakPolarHBondContact O-CB 3.45Å; Q178-K181 PolarHBondContact O-N 3.15Å; Q178-K181 VanDerWaalsContact O-N 3.13Å; K181-K183 VanDerWaalsContact C-N 3.31Å; K181-K183 PolarHBondContact O-N 3.36Å; K181-L184 CarbonylContact O-C 3.58Å; K181-L184 PolarHBondContact O-N 3.23Å; K181-T185 HydrophobicContact CG-CG2 4.34Å; K181-T185 PolarHBondContact O-N 2.81Å; K181-T185 PolarHBondContact O-OG1 2.88Å |
| 182 | E | 82.6 | Confident | 76.1 | Confident | 128 Ų | 128 | 121.2 Ų | 121.2 | 60% | 0.598 | 61% | 0.609 | S | S | * | * | H | α-helix | trans | -59.4 | -40.1 | 176.1 | -72.1 | 169.6 | 176.8 | 0 | 0 | 112.2 | Q178 L184 T185 G186 | Q178-E182 WeakPolarHBondContact O-CG 3.22Å; Q178-E182 PolarHBondContact O-N 3.4Å; E182-L184 PolarHBondContact O-N 2.66Å; E182-T185 PolarHBondContact O-N 3.4Å; E182-G186 PolarHBondContact O-N 3.2Å |
| 183 | K | 77.2 | Confident | 75.2 | Confident | 181 Ų | 181 | 124.8 Ų | 124.8 | 79% | 0.787 | 64% | 0.635 | S | S | * | * | H | α-helix | trans | -62.7 | -28.2 | 172.6 | -72.3 | 172.7 | -177.4 | -169.7 | 0 | 113.8 | R179 M180 K181 | R179-K183 VanDerWaalsContact O-CG 3.24Å; R179-K183 WeakPolarHBondContact O-CG 3.34Å; R179-K183 PolarHBondContact O-N 3.04Å; M180-K183 WeakPolarHBondContact O-CB 3.42Å; M180-K183 PolarHBondContact O-N 3.34Å; K181-K183 VanDerWaalsContact C-N 3.31Å; K181-K183 PolarHBondContact O-N 3.36Å |
| 184 | L | 73.1 | Confident | 74.6 | Confident | 141 Ų | 141 | 122.6 Ų | 122.6 | 74% | 0.738 | 64% | 0.636 | S | S | * | * | H | α-helix | trans | -91 | -28.6 | -179.3 | -70.3 | 173.6 | 0 | 0 | 0 | 112.9 | M180 K181 E182 | M180-L184 HydrophobicContact CG-CD1 4.32Å; M180-L184 WeakPolarHBondContact O-CG 3.41Å; M180-L184 PolarHBondContact O-N 2.92Å; M180-L184 VanDerWaalsContact O-N 3.13Å; K181-L184 CarbonylContact O-C 3.58Å; K181-L184 PolarHBondContact O-N 3.23Å; E182-L184 PolarHBondContact O-N 2.66Å |
| 185 | T | 70.2 | Confident | 74.3 | Confident | 91 Ų | 91 | 125.7 Ų | 125.7 | 56% | 0.558 | 64% | 0.643 | S | S | * | * | H | α-helix | trans | -114.4 | -3.6 | -171.9 | 66.1 | 0 | 0 | 0 | 0 | 114.8 | K181 E182 E187 | K181-T185 HydrophobicContact CG-CG2 4.34Å; K181-T185 PolarHBondContact O-N 2.81Å; K181-T185 PolarHBondContact O-OG1 2.88Å; E182-T185 PolarHBondContact O-N 3.4Å; T185-E187 PolarHBondContact O-N 3.04Å |
| 186 | G | 62.3 | Low | 74 | Confident | 50 Ų | 50 | 124.7 Ų | 124.7 | 52% | 0.515 | 65% | 0.645 | S | S | . | * | trans | -68.3 | 116.9 | 177 | 0 | 0 | 0 | 0 | 0 | 112 | E182 E188 | E182-G186 PolarHBondContact O-N 3.2Å; G186-E188 PolarHBondContact O-N 3.5Å | ||
| 187 | E | 55.5 | Low | 73.6 | Confident | 203 Ų | 203 | 122.8 Ų | 122.8 | 95% | 0.949 | 65% | 0.649 | S | S | * | * | S | Bend | trans | -74.9 | 27.7 | 174.6 | -65.2 | -171.4 | 152.6 | 0 | 0 | 113.9 | T185 | T185-E187 PolarHBondContact O-N 3.04Š|
| 188 | E | 57.7 | Low | 73.2 | Confident | 166 Ų | 166 | 128.6 Ų | 128.6 | 78% | 0.776 | 66% | 0.658 | S | S | * | * | trans | -106.5 | 96.1 | 154.3 | -159.9 | -160.8 | -140.7 | 0 | 0 | 104.8 | G186 P190 | G186-E188 PolarHBondContact O-N 3.5Å; E188-P190 WeakPolarHBondContact O-CD 3.45Å; E188-P190 VanDerWaalsContact O-N 3.11Å | ||
| 189 | A | 59.3 | Low | 72.7 | Confident | 92 Ų | 92 | 128.3 Ų | 128.3 | 76% | 0.76 | 66% | 0.658 | S | S | * | * | trans | -66.5 | 107.4 | 166.6 | 0 | 0 | 0 | 0 | 0 | 105.7 | E191 | A189-E191 PolarHBondContact O-N 3.34Å; A189-E191 VanDerWaalsContact O-N 3.13Å | ||
| 190 | P | 58.3 | Low | 72.4 | Confident | 90 Ų | 90 | 127.2 Ų | 127.2 | 58% | 0.584 | 66% | 0.664 | S | S | * | * | trans | -57.5 | 128.4 | 161.9 | 28.1 | -32.8 | 0 | 0 | 0 | 104.5 | E188 V192 | E188-P190 WeakPolarHBondContact O-CD 3.45Å; E188-P190 VanDerWaalsContact O-N 3.11Å; P190-V192 PolarHBondContact O-N 2.96Å | ||
| 191 | E | 61.7 | Low | 72.2 | Confident | 174 Ų | 174 | 127.9 Ų | 127.9 | 81% | 0.813 | 67% | 0.665 | S | S | * | * | trans | -34.4 | 109.2 | 163.3 | -179.3 | 172.6 | -167.5 | 0 | 0 | 106.1 | A189 V193 | A189-E191 PolarHBondContact O-N 3.34Å; A189-E191 VanDerWaalsContact O-N 3.13Å; E191-V193 PolarHBondContact O-N 2.81Å | ||
| 192 | V | 65.2 | Low | 71.8 | Confident | 123 Ų | 123 | 125.7 Ų | 125.7 | 75% | 0.745 | 66% | 0.66 | S | S | * | * | trans | -41.6 | 120.7 | -172.3 | 170.7 | 0 | 0 | 0 | 0 | 104.7 | P190 S194 | P190-V192 PolarHBondContact O-N 2.96Å; V192-S194 WeakPolarHBondContact O-CA 3.5Å; V192-S194 WeakPolarHBondContact O-CB 3.31Å; V192-S194 PolarHBondContact O-N 3.11Å; V192-S194 PolarHBondContact O-OG 2.95Å | ||
| 193 | V | 66.4 | Low | 71.7 | Confident | 138 Ų | 138 | 123.1 Ų | 123.1 | 84% | 0.836 | 65% | 0.654 | S | S | * | * | trans | -63.9 | 77.5 | -175 | -176.5 | 0 | 0 | 0 | 0 | 107.2 | E191 | E191-V193 PolarHBondContact O-N 2.81Š| ||
| 194 | S | 73.8 | Confident | 71.3 | Confident | 84 Ų | 84 | 119.1 Ų | 119.1 | 59% | 0.587 | 65% | 0.646 | S | S | * | * | P | Polyproline II helix | trans | -84.2 | 121.9 | -176.3 | 53.3 | 0 | 0 | 0 | 0 | 102.9 | V192 E196 | V192-S194 WeakPolarHBondContact O-CA 3.5Å; V192-S194 WeakPolarHBondContact O-CB 3.31Å; V192-S194 PolarHBondContact O-N 3.11Å; V192-S194 PolarHBondContact O-OG 2.95Å; S194-E196 PolarHBondContact O-N 3.13Å |
| 195 | R | 83 | Confident | 70.9 | Confident | 171 Ų | 171 | 117.1 Ų | 117.1 | 65% | 0.645 | 63% | 0.634 | S | S | * | * | P | Polyproline II helix | trans | -51.3 | 135.9 | 172.1 | -81.7 | -176.2 | 163 | 77.8 | 3.2 | 108.2 | M199 T200 | R195-M199 HydrophobicContact CB-CB 4.07Å; R195-M199 HydrophobicContact CB-CE 3.75Å; R195-M199 HydrophobicContact CG-CE 3.73Å; R195-T200 HydrophobicContact CB-CG2 3.49Å; R195-T200 VanDerWaalsContact CB-CG2 3.49Å |
| 196 | E | 83.3 | Confident | 70.7 | Confident | 125 Ų | 125 | 115.9 Ų | 115.9 | 58% | 0.584 | 62% | 0.623 | S | S | * | * | P | Polyproline II helix | trans | -48.7 | 144.1 | 178.4 | -65.3 | 171.4 | -156.2 | 0 | 0 | 109.8 | S194 W198 M199 T200 | S194-E196 PolarHBondContact O-N 3.13Å; E196-W198 VanDerWaalsContact CB-CD1 3.42Å; E196-W198 HydrophobicContact CB-CG 4.48Å; E196-W198 VanDerWaalsContact CB-NE1 3.3Å; E196-W198 PolarHBondContact O-N 3.28Å; E196-W198 PolarHBondContact OE2-NE1 2.88Å; E196-M199 HydrophobicContact CB-CE 4.37Å; E196-M199 WeakPolarHBondContact O-CA 3.46Å; E196-M199 WeakPolarHBondContact O-CB 3.5Å; E196-M199 PolarHBondContact O-N 3.43Å; E196-T200 PolarHBondContact O-N 3.25Å |
| 197 | T | 80 | Confident | 70.9 | Confident | 96 Ų | 96 | 119.5 Ų | 119.5 | 59% | 0.589 | 63% | 0.626 | S | S | * | * | H | α-helix | trans | -55.7 | -29.2 | -169.2 | 49.3 | 0 | 0 | 0 | 0 | 113.5 | M199 T200 E201 | T197-M199 PolarHBondContact O-N 2.91Å; T197-T200 PolarHBondContact O-N 3.29Å; T197-E201 WeakPolarHBondContact O-CA 3.47Å; T197-E201 VanDerWaalsContact O-CB 3.28Å; T197-E201 WeakPolarHBondContact O-CB 3.4Å; T197-E201 PolarHBondContact O-N 3.49Å |
| 198 | W | 81.1 | Confident | 71.3 | Confident | 181 Ų | 181 | 117.4 Ų | 117.4 | 69% | 0.686 | 62% | 0.616 | S | S | * | * | H | α-helix | trans | -67.7 | -18.7 | 174.5 | 70.3 | -89.6 | 0 | 0 | 0 | 114.4 | E196 | E196-W198 VanDerWaalsContact CB-CD1 3.42Å; E196-W198 HydrophobicContact CB-CG 4.48Å; E196-W198 VanDerWaalsContact CB-NE1 3.3Å; E196-W198 PolarHBondContact O-N 3.28Å; E196-W198 PolarHBondContact OE2-NE1 2.88Å |
| 199 | M | 79.9 | Confident | 71.7 | Confident | 91 Ų | 91 | 114.8 Ų | 114.8 | 45% | 0.448 | 61% | 0.607 | S | S | . | * | H | α-helix | trans | -92.2 | -22.9 | 176.4 | -70.5 | -158.2 | -76.9 | 0 | 0 | 113.4 | R195 E196 T197 | R195-M199 HydrophobicContact CB-CB 4.07Å; R195-M199 HydrophobicContact CB-CE 3.75Å; R195-M199 HydrophobicContact CG-CE 3.73Å; E196-M199 HydrophobicContact CB-CE 4.37Å; E196-M199 WeakPolarHBondContact O-CA 3.46Å; E196-M199 WeakPolarHBondContact O-CB 3.5Å; E196-M199 PolarHBondContact O-N 3.43Å; T197-M199 PolarHBondContact O-N 2.91Å |
| 200 | T | 80.5 | Confident | 72.2 | Confident | 89 Ų | 89 | 112.7 Ų | 112.7 | 55% | 0.546 | 59% | 0.594 | S | S | . | * | H | α-helix | trans | -108.9 | -30.3 | -176.3 | 53.6 | 0 | 0 | 0 | 0 | 113 | R195 E196 T197 | R195-T200 HydrophobicContact CB-CG2 3.49Å; R195-T200 VanDerWaalsContact CB-CG2 3.49Å; E196-T200 PolarHBondContact O-N 3.25Å; T197-T200 PolarHBondContact O-N 3.29Å |
| 201 | E | 78.6 | Confident | 72.6 | Confident | 131 Ų | 131 | 117.9 Ų | 117.9 | 61% | 0.612 | 62% | 0.616 | S | S | * | * | S | Bend | trans | -104.3 | 120.2 | -178.5 | -57.6 | -175.1 | 176.3 | 0 | 0 | 109.4 | T197 | T197-E201 WeakPolarHBondContact O-CA 3.47Å; T197-E201 VanDerWaalsContact O-CB 3.28Å; T197-E201 WeakPolarHBondContact O-CB 3.4Å; T197-E201 PolarHBondContact O-N 3.49Å |
| 202 | L | 79.3 | Confident | 73 | Confident | 94 Ų | 94 | 112 Ų | 112 | 49% | 0.492 | 60% | 0.601 | S | S | . | * | trans | -61 | 143.1 | 169.1 | -76.1 | 154.5 | 0 | 0 | 0 | 108.8 | L206 | L202-L206 HydrophobicContact CB-CB 4.08Å; L202-L206 HydrophobicContact CD2-CB 4.04Å | ||
| 203 | P | 78.5 | Confident | 73.5 | Confident | 74 Ų | 74 | 110.7 Ų | 110.7 | 48% | 0.481 | 60% | 0.604 | S | S | . | * | trans | -47.9 | 146.4 | 170 | -27.3 | 33.8 | 0 | 0 | 0 | 110.7 | E205 L206 Q207 | P203-E205 PolarHBondContact O-N 2.92Å; P203-L206 HydrophobicContact CB-CD1 3.98Å; P203-L206 HydrophobicContact CG-CD1 4.02Å; P203-L206 WeakPolarHBondContact O-CA 3.39Å; P203-L206 PolarHBondContact O-N 2.95Å; P203-Q207 PolarHBondContact O-N 3.44Å | ||
| 204 | P | 69.3 | Low | 73.6 | Confident | 97 Ų | 97 | 115.4 Ų | 115.4 | 63% | 0.63 | 61% | 0.607 | S | S | * | * | G | 310 helix | trans | -50.4 | -30.1 | -173.9 | -29.8 | 34.7 | 0 | 0 | 0 | 114.8 | L206 | P204-L206 VanDerWaalsContact C-N 3.34Š|
| 205 | E | 66 | Low | 73.7 | Confident | 100 Ų | 100 | 117.1 Ų | 117.1 | 47% | 0.467 | 61% | 0.614 | S | S | . | * | G | 310 helix | trans | -72.4 | -24.3 | 177.9 | -55 | -170.9 | 148.1 | 0 | 0 | 114.1 | P203 N225 | P203-E205 PolarHBondContact O-N 2.92Å; E205-N225 PolarHBondContact OE1-ND2 2.83Å; E205-N225 PolarHBondContact OE1-OD1 3.42Å; E205-N225 PolarHBondContact OE2-ND2 2.95Å |
| 206 | L | 65.3 | Low | 73.2 | Confident | 65 Ų | 65 | 118.5 Ų | 118.5 | 34% | 0.34 | 63% | 0.625 | S | S | . | * | G | 310 helix | trans | -102.8 | 0.5 | -176.6 | -75.1 | 112 | 0 | 0 | 0 | 114.1 | L202 P203 P204 H208 I209 | L202-L206 HydrophobicContact CB-CB 4.08Å; L202-L206 HydrophobicContact CD2-CB 4.04Å; P203-L206 HydrophobicContact CB-CD1 3.98Å; P203-L206 HydrophobicContact CG-CD1 4.02Å; P203-L206 WeakPolarHBondContact O-CA 3.39Å; P203-L206 PolarHBondContact O-N 2.95Å; P204-L206 VanDerWaalsContact C-N 3.34Å; L206-H208 PolarHBondContact O-N 2.95Å; L206-I209 HydrophobicContact CB-CD1 3.76Å; L206-I209 HydrophobicContact CD2-CD1 3.33Å; L206-I209 HydrophobicContact CG-CD1 3.44Å; L206-I209 VanDerWaalsContact CG-CD1 3.44Å; L206-I209 WeakPolarHBondContact O-CB 3.42Å; L206-I209 PolarHBondContact O-N 2.65Å |
| 207 | Q | 66.5 | Low | 72.5 | Confident | 125 Ų | 125 | 120.7 Ų | 120.7 | 58% | 0.584 | 63% | 0.632 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -55.6 | -22.3 | -179.8 | -70 | 179 | -5.8 | 0 | 0 | 113.8 | P203 | P203-Q207 PolarHBondContact O-N 3.44Š|
| 208 | H | 64.1 | Low | 72.1 | Confident | 159 Ų | 159 | 126 Ų | 126 | 74% | 0.736 | 65% | 0.647 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -99.9 | 10.5 | -179.4 | -42.1 | -70 | 0 | 0 | 0 | 114.4 | L206 G210 | L206-H208 PolarHBondContact O-N 2.95Å; H208-G210 VanDerWaalsContact C-N 3.32Å |
| 209 | I | 66.8 | Low | 71.4 | Confident | 112 Ų | 112 | 127.2 Ų | 127.2 | 57% | 0.574 | 65% | 0.652 | S | S | * | * | S | Bend | trans | -89.4 | 1.4 | -175.7 | -68.7 | 170.3 | 0 | 0 | 0 | 112.4 | L206 | L206-I209 HydrophobicContact CB-CD1 3.76Å; L206-I209 HydrophobicContact CD2-CD1 3.33Å; L206-I209 HydrophobicContact CG-CD1 3.44Å; L206-I209 VanDerWaalsContact CG-CD1 3.44Å; L206-I209 WeakPolarHBondContact O-CB 3.42Å; L206-I209 PolarHBondContact O-N 2.65Å |
| 210 | G | 68.9 | Low | 70.4 | Confident | 48 Ų | 48 | 127.4 Ų | 127.4 | 50% | 0.495 | 66% | 0.662 | S | S | . | * | S | Bend | trans | -99.8 | 154.3 | 175.1 | 0 | 0 | 0 | 0 | 0 | 114.9 | H208 G212 | H208-G210 VanDerWaalsContact C-N 3.32Å; G210-G212 PolarHBondContact O-N 3.13Å |
| 211 | L | 65.6 | Low | 69.7 | Low | 198 Ų | 198 | 124.8 Ų | 124.8 | 100% | 1.037 | 65% | 0.652 | S | S | * | * | S | Bend | trans | 45.5 | 1.8 | 162.2 | -62.7 | 171.3 | 0 | 0 | 0 | 120 | ||
| 212 | G | 71.6 | Confident | 68.8 | Low | 50 Ų | 50 | 122.2 Ų | 122.2 | 52% | 0.515 | 65% | 0.647 | S | S | . | * | S | Bend | trans | -102.2 | 166.9 | 172.2 | 0 | 0 | 0 | 0 | 0 | 112.5 | G210 R214 | G210-G212 PolarHBondContact O-N 3.13Å; G212-R214 PolarHBondContact O-N 2.97Å; G212-R214 VanDerWaalsContact O-N 3.08Å |
| 213 | A | 75.6 | Confident | 67.8 | Low | 96 Ų | 96 | 123.7 Ų | 123.7 | 79% | 0.793 | 65% | 0.651 | S | S | * | * | trans | -55.5 | 116.1 | 175.3 | 0 | 0 | 0 | 0 | 0 | 111 | T215 | A213-T215 PolarHBondContact O-N 3.48Å; A213-T215 VanDerWaalsContact O-N 3.09Å | ||
| 214 | R | 68.1 | Low | 66.7 | Low | 238 Ų | 238 | 126.6 Ų | 126.6 | 90% | 0.898 | 66% | 0.663 | S | S | * | * | trans | -79 | 91.8 | -177.1 | -63.8 | 170.1 | 70 | 178.1 | 2.5 | 109.4 | G212 | G212-R214 PolarHBondContact O-N 2.97Å; G212-R214 VanDerWaalsContact O-N 3.08Å | ||
| 215 | T | 76.8 | Confident | 66.3 | Low | 119 Ų | 119 | 126.1 Ų | 126.1 | 73% | 0.73 | 66% | 0.655 | S | S | * | * | trans | -102.6 | 143 | 170.8 | 63.9 | 0 | 0 | 0 | 0 | 110.8 | A213 K217 | A213-T215 PolarHBondContact O-N 3.48Å; A213-T215 VanDerWaalsContact O-N 3.09Å; T215-K217 PolarHBondContact O-N 2.95Å | ||
| 216 | F | 71.1 | Confident | 65.9 | Low | 201 Ų | 201 | 124.6 Ų | 124.6 | 88% | 0.882 | 65% | 0.65 | S | S | * | * | trans | -54 | 137.8 | 171.7 | -69.2 | -81.8 | 0 | 0 | 0 | 111.3 | K218 | F216-K218 PolarHBondContact O-N 3.01Š| ||
| 217 | K | 69.4 | Low | 65.7 | Low | 170 Ų | 170 | 129.2 Ų | 129.2 | 74% | 0.739 | 66% | 0.663 | S | S | * | * | trans | -66.2 | 102.2 | 177.3 | -160.2 | 86.9 | 172.3 | -171.6 | 0 | 108.7 | T215 R219 | T215-K217 PolarHBondContact O-N 2.95Å; K217-R219 WeakPolarHBondContact CG-O 3.18Å; K217-R219 PolarHBondContact O-N 3.27Å; K217-R219 VanDerWaalsContact O-N 3.1Å | ||
| 218 | K | 71.8 | Confident | 65.4 | Low | 209 Ų | 209 | 124.4 Ų | 124.4 | 91% | 0.909 | 64% | 0.644 | S | S | * | * | S | Bend | trans | -69.1 | -0.3 | 179.3 | -67.2 | -175.1 | 178 | -178.9 | 0 | 114.6 | F216 | F216-K218 PolarHBondContact O-N 3.01Š|
| 219 | R | 65.3 | Low | 65.4 | Low | 206 Ų | 206 | 124 Ų | 124 | 78% | 0.777 | 65% | 0.645 | S | S | * | * | S | Bend | trans | -130.3 | 142.8 | 177.4 | -64.1 | -170 | -70.4 | 173.9 | -0.7 | 108.1 | K217 G221 | K217-R219 WeakPolarHBondContact CG-O 3.18Å; K217-R219 PolarHBondContact O-N 3.27Å; K217-R219 VanDerWaalsContact O-N 3.1Å; R219-G221 PolarHBondContact O-N 3.35Å |
| 220 | S | 60.5 | Low | 65.4 | Low | 95 Ų | 95 | 130.1 Ų | 130.1 | 66% | 0.664 | 66% | 0.661 | S | S | * | * | P | Polyproline II helix | trans | -50.6 | 134.9 | 166.3 | 47.6 | 0 | 0 | 0 | 0 | 108.4 | ||
| 221 | G | 64.2 | Low | 65.3 | Low | 33 Ų | 33 | 133.1 Ų | 133.1 | 34% | 0.34 | 67% | 0.67 | S | S | . | * | P | Polyproline II helix | trans | -57 | 167.7 | 177.9 | 0 | 0 | 0 | 0 | 0 | 111.4 | R219 E223 | R219-G221 PolarHBondContact O-N 3.35Å; G221-E223 PolarHBondContact O-N 3.39Å |
| 222 | P | 61 | Low | 65.5 | Low | 78 Ų | 78 | 126.2 Ų | 126.2 | 51% | 0.506 | 63% | 0.634 | S | S | . | * | P | Polyproline II helix | trans | -51.6 | 120.9 | 175.7 | 23 | -31.7 | 0 | 0 | 0 | 109.3 | N224 | P222-N224 HydrophobicContact CB-CB 4.35Å; P222-N224 PolarHBondContact O-N 3.12Å |
| 223 | E | 56.8 | Low | 65.7 | Low | 124 Ų | 124 | 127.1 Ų | 127.1 | 58% | 0.579 | 63% | 0.63 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -65.6 | 23.4 | 174.2 | -66.2 | -73 | 162.3 | 0 | 0 | 112 | G221 R227 | G221-E223 PolarHBondContact O-N 3.39Å; E223-R227 IonicContact OE2-CZ 3.97Å; E223-R227 IonicContact OE2-NH1 3.91Å; E223-R227 PolarHBondContact OE2-NH1 3.15Å |
| 224 | N | 56.5 | Low | 65.5 | Low | 136 Ų | 136 | 128.2 Ų | 128.2 | 73% | 0.727 | 63% | 0.629 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -95.4 | -10.5 | -174.3 | -56.3 | -12.1 | 0 | 0 | 0 | 112 | P222 D226 | P222-N224 HydrophobicContact CB-CB 4.35Å; P222-N224 PolarHBondContact O-N 3.12Å; N224-D226 PolarHBondContact O-N 3.13Å |
| 225 | N | 59.8 | Low | 65.8 | Low | 86 Ų | 86 | 120.1 Ų | 120.1 | 46% | 0.46 | 61% | 0.613 | S | S | . | * | S | Bend | trans | -77.6 | 102.9 | 166.7 | -90.5 | -21.8 | 0 | 0 | 0 | 108 | E205 R227 | E205-N225 PolarHBondContact OE1-ND2 2.83Å; E205-N225 PolarHBondContact OE1-OD1 3.42Å; E205-N225 PolarHBondContact OE2-ND2 2.95Å; N225-R227 WeakPolarHBondContact O-CG 3.39Å; N225-R227 PolarHBondContact O-N 3.36Å |
| 226 | D | 59 | Low | 65.8 | Low | 69 Ų | 69 | 117.7 Ų | 117.7 | 37% | 0.369 | 60% | 0.596 | S | S | . | * | trans | -49.5 | 89.4 | 163.2 | -107.9 | -27.3 | 0 | 0 | 0 | 108.3 | N224 S228 I229 K240 R244 | N224-D226 PolarHBondContact O-N 3.13Å; D226-S228 PolarHBondContact O-N 3.44Å; D226-S228 VanDerWaalsContact O-N 3.08Å; D226-I229 WeakPolarHBondContact O-CD1 3.31Å; D226-K240 IonicContact OD1-NZ 3.74Å; D226-K240 PolarHBondContact OD1-NZ 2.95Å; D226-K240 WeakPolarHBondContact OD2-CE 3.33Å; D226-K240 IonicContact OD2-NZ 3.13Å; D226-K240 PolarHBondContact OD2-NZ 3.46Å; D226-R244 IonicContact OD2-NH2 3.08Å; D226-R244 PolarHBondContact OD2-NH2 2.88Å | ||
| 227 | R | 60.8 | Low | 66 | Low | 161 Ų | 161 | 117 Ų | 117 | 61% | 0.608 | 59% | 0.587 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -66.5 | -4.2 | 170.9 | -60.6 | 179.5 | -177.5 | 99.5 | -5.4 | 111.4 | E223 N225 I229 | E223-R227 IonicContact OE2-CZ 3.97Å; E223-R227 IonicContact OE2-NH1 3.91Å; E223-R227 PolarHBondContact OE2-NH1 3.15Å; N225-R227 WeakPolarHBondContact O-CG 3.39Å; N225-R227 PolarHBondContact O-N 3.36Å; R227-I229 PolarHBondContact O-N 3.35Å |
| 228 | S | 59.7 | Low | 66.5 | Low | 25 Ų | 25 | 114.4 Ų | 114.4 | 18% | 0.175 | 58% | 0.578 | C | S | . | * | H | α-helix | trans | -64.6 | -14.3 | 177.7 | 92.7 | 0 | 0 | 0 | 0 | 113.5 | D226 W230 T231 D232 K240 | D226-S228 PolarHBondContact O-N 3.44Å; D226-S228 VanDerWaalsContact O-N 3.08Å; S228-W230 PolarHBondContact O-N 2.97Å; S228-T231 WeakPolarHBondContact CA-OG1 3.23Å; S228-T231 PolarHBondContact O-N 3.02Å; S228-D232 VanDerWaalsContact O-CB 3.28Å; S228-D232 WeakPolarHBondContact O-CB 3.32Å; S228-D232 PolarHBondContact O-N 3.25Å; S228-K240 PolarHBondContact OG-NZ 2.94Å |
| 229 | I | 64.8 | Low | 66.8 | Low | 150 Ų | 150 | 113.2 Ų | 113.2 | 77% | 0.769 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -60 | -29 | -179.9 | -66 | 157.2 | 0 | 0 | 0 | 112 | D226 R227 | D226-I229 WeakPolarHBondContact O-CD1 3.31Å; R227-I229 PolarHBondContact O-N 3.35Å |
| 230 | W | 65.8 | Low | 67.2 | Low | 241 Ų | 241 | 106.1 Ų | 106.1 | 91% | 0.913 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -99.3 | -19.5 | 178 | -174.7 | -88.7 | 0 | 0 | 0 | 113.8 | S228 | S228-W230 PolarHBondContact O-N 2.97Å |
| 231 | T | 67.6 | Low | 67.9 | Low | 110 Ų | 110 | 103.9 Ų | 103.9 | 68% | 0.675 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -104.8 | -2.8 | -177.6 | 56.7 | 0 | 0 | 0 | 0 | 114.2 | S228 | S228-T231 WeakPolarHBondContact CA-OG1 3.23Å; S228-T231 PolarHBondContact O-N 3.02Å |
| 232 | D | 69.9 | Low | 68.3 | Low | 53 Ų | 53 | 109.2 Ų | 109.2 | 28% | 0.283 | 54% | 0.539 | S | S | . | . | trans | -77.4 | 133.7 | 179.6 | -119.2 | 2.4 | 0 | 0 | 0 | 112.3 | S228 D236 | S228-D232 VanDerWaalsContact O-CB 3.28Å; S228-D232 WeakPolarHBondContact O-CB 3.32Å; S228-D232 PolarHBondContact O-N 3.25Å; D232-D236 WeakPolarHBondContact OD1-CB 3.47Å | ||
| 233 | T | 75.4 | Confident | 68.8 | Low | 70 Ų | 70 | 111.7 Ų | 111.7 | 43% | 0.429 | 54% | 0.544 | S | S | . | . | trans | -76.9 | 158.4 | 166.2 | 67.6 | 0 | 0 | 0 | 0 | 110.5 | A235 D236 R237 | T233-A235 PolarHBondContact O-N 3.36Å; T233-A235 VanDerWaalsContact O-N 3.15Å; T233-D236 PolarHBondContact O-N 3.06Å; T233-D236 PolarHBondContact OG1-N 2.98Å; T233-D236 PolarHBondContact OG1-OD2 2.86Å; T233-R237 PolarHBondContact O-N 2.77Å | ||
| 234 | P | 71.3 | Confident | 69.3 | Low | 118 Ų | 118 | 113 Ų | 113 | 77% | 0.766 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -55.1 | -33.4 | 177.2 | -26.8 | 34.8 | 0 | 0 | 0 | 113.9 | E238 | P234-E238 PolarHBondContact O-N 2.84Å; P234-E238 VanDerWaalsContact O-N 3.16Å |
| 235 | A | 74.8 | Confident | 69.6 | Low | 69 Ų | 69 | 112.2 Ų | 112.2 | 57% | 0.57 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -71.3 | -40 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.6 | T233 R237 E238 R239 | T233-A235 PolarHBondContact O-N 3.36Å; T233-A235 VanDerWaalsContact O-N 3.15Å; A235-R237 VanDerWaalsContact C-N 3.33Å; A235-E238 PolarHBondContact O-N 3.45Å; A235-R239 WeakPolarHBondContact O-CB 3.27Å; A235-R239 PolarHBondContact O-N 2.79Å |
| 236 | D | 76.8 | Confident | 69.5 | Low | 68 Ų | 68 | 114.1 Ų | 114.1 | 36% | 0.364 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -68.6 | -34.9 | 175.1 | -68.6 | -45.5 | 0 | 0 | 0 | 111.6 | D232 T233 E238 R239 K240 | D232-D236 WeakPolarHBondContact OD1-CB 3.47Å; T233-D236 PolarHBondContact O-N 3.06Å; T233-D236 PolarHBondContact OG1-N 2.98Å; T233-D236 PolarHBondContact OG1-OD2 2.86Å; D236-E238 PolarHBondContact O-N 3.31Å; D236-R239 PolarHBondContact O-N 3.21Å; D236-K240 VanDerWaalsContact O-CB 3.23Å; D236-K240 WeakPolarHBondContact O-CB 3.46Å; D236-K240 PolarHBondContact O-N 3.18Å |
| 237 | R | 75.9 | Confident | 69.2 | Low | 185 Ų | 185 | 113.1 Ų | 113.1 | 70% | 0.698 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -63.6 | -41.7 | 175.1 | -168.2 | 173.5 | -175.2 | 163.9 | 1.1 | 112 | T233 A235 A241 | T233-R237 PolarHBondContact O-N 2.77Å; A235-R237 VanDerWaalsContact C-N 3.33Å; R237-A241 WeakPolarHBondContact O-CB 3.47Å; R237-A241 PolarHBondContact O-N 3.35Å |
| 238 | E | 77.9 | Confident | 68.9 | Low | 117 Ų | 117 | 113.5 Ų | 113.5 | 55% | 0.547 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -67.1 | -43.6 | 175.2 | -165.9 | -167.5 | 152.2 | 0 | 0 | 111.4 | P234 A235 D236 K240 A241 R242 | P234-E238 PolarHBondContact O-N 2.84Å; P234-E238 VanDerWaalsContact O-N 3.16Å; A235-E238 PolarHBondContact O-N 3.45Å; D236-E238 PolarHBondContact O-N 3.31Å; E238-K240 PolarHBondContact O-N 3.33Å; E238-A241 PolarHBondContact O-N 3.24Å; E238-R242 WeakPolarHBondContact O-CB 3.38Å; E238-R242 PolarHBondContact O-N 2.64Å; E238-R242 IonicContact OE1-CZ 3.88Å; E238-R242 IonicContact OE1-NH2 2.93Å; E238-R242 PolarHBondContact OE1-NH2 3.24Å |
| 239 | R | 78.2 | Confident | 68.4 | Low | 184 Ų | 184 | 121.5 Ų | 121.5 | 69% | 0.694 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -60.8 | -45.9 | 177 | -174.1 | -178.7 | 176.8 | -176.7 | -0 | 111.8 | A235 D236 R242 E243 | A235-R239 WeakPolarHBondContact O-CB 3.27Å; A235-R239 PolarHBondContact O-N 2.79Å; D236-R239 PolarHBondContact O-N 3.21Å; R239-R242 PolarHBondContact O-N 2.97Å; R239-E243 PolarHBondContact O-N 3.19Å |
| 240 | K | 74.3 | Confident | 67.2 | Low | 57 Ų | 57 | 118.7 Ų | 118.7 | 25% | 0.248 | 58% | 0.578 | C | S | . | * | H | α-helix | trans | -69.6 | -33.7 | 178.5 | -163.6 | 171.8 | -176.7 | 170.8 | 0 | 112.1 | D226 S228 D236 E238 R244 | D226-K240 IonicContact OD1-NZ 3.74Å; D226-K240 PolarHBondContact OD1-NZ 2.95Å; D226-K240 WeakPolarHBondContact OD2-CE 3.33Å; D226-K240 IonicContact OD2-NZ 3.13Å; D226-K240 PolarHBondContact OD2-NZ 3.46Å; S228-K240 PolarHBondContact OG-NZ 2.94Å; D236-K240 VanDerWaalsContact O-CB 3.23Å; D236-K240 WeakPolarHBondContact O-CB 3.46Å; D236-K240 PolarHBondContact O-N 3.18Å; E238-K240 PolarHBondContact O-N 3.33Å; K240-R244 WeakPolarHBondContact O-CB 3.49Å; K240-R244 PolarHBondContact O-N 3.36Å |
| 241 | A | 75.8 | Confident | 66.3 | Low | 48 Ų | 48 | 111.4 Ų | 111.4 | 40% | 0.397 | 58% | 0.579 | S | S | . | * | H | α-helix | trans | -67.3 | -41.9 | 172.8 | 0 | 0 | 0 | 0 | 0 | 112 | R237 E238 R244 L245 | R237-A241 WeakPolarHBondContact O-CB 3.47Å; R237-A241 PolarHBondContact O-N 3.35Å; E238-A241 PolarHBondContact O-N 3.24Å; A241-R244 PolarHBondContact O-N 2.82Å; A241-L245 WeakPolarHBondContact O-CG 3.47Å; A241-L245 PolarHBondContact O-N 3.42Å |
| 242 | R | 73.1 | Confident | 65.1 | Low | 144 Ų | 144 | 113.4 Ų | 113.4 | 54% | 0.543 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -62.2 | -45.7 | 175 | -164.4 | 178.6 | -64.9 | -175.3 | 1.5 | 111 | E238 R239 R244 L245 E246 | E238-R242 WeakPolarHBondContact O-CB 3.38Å; E238-R242 PolarHBondContact O-N 2.64Å; E238-R242 IonicContact OE1-CZ 3.88Å; E238-R242 IonicContact OE1-NH2 2.93Å; E238-R242 PolarHBondContact OE1-NH2 3.24Å; R239-R242 PolarHBondContact O-N 2.97Å; R242-R244 PolarHBondContact O-N 3.27Å; R242-L245 PolarHBondContact O-N 3.05Å; R242-E246 WeakPolarHBondContact O-CG 3.31Å; R242-E246 PolarHBondContact O-N 2.77Å |
| 243 | E | 71.4 | Confident | 63.9 | Low | 131 Ų | 131 | 114.6 Ų | 114.6 | 61% | 0.612 | 60% | 0.597 | S | S | * | * | H | α-helix | trans | -62.7 | -39.7 | 175.6 | -171.5 | -177.5 | 175 | 0 | 0 | 112.6 | R239 E246 G247 | R239-E243 PolarHBondContact O-N 3.19Å; E243-E246 PolarHBondContact O-N 3.49Å; E243-G247 PolarHBondContact O-N 3.44Å |
| 244 | R | 67.1 | Low | 62.5 | Low | 151 Ų | 151 | 121 Ų | 121 | 57% | 0.57 | 62% | 0.619 | S | S | * | * | H | α-helix | trans | -67.7 | -32.1 | 174.7 | -85.3 | -166.6 | -175 | 163.8 | 3.8 | 113.3 | D226 K240 A241 R242 K248 | D226-R244 IonicContact OD2-NH2 3.08Å; D226-R244 PolarHBondContact OD2-NH2 2.88Å; K240-R244 WeakPolarHBondContact O-CB 3.49Å; K240-R244 PolarHBondContact O-N 3.36Å; A241-R244 PolarHBondContact O-N 2.82Å; R242-R244 PolarHBondContact O-N 3.27Å; R244-K248 VanDerWaalsContact O-CG 3.25Å; R244-K248 WeakPolarHBondContact O-CG 3.37Å; R244-K248 PolarHBondContact O-N 3.07Å |
| 245 | L | 61.3 | Low | 61.3 | Low | 119 Ų | 119 | 121.5 Ų | 121.5 | 62% | 0.623 | 62% | 0.615 | S | S | * | * | H | α-helix | trans | -76 | -35.5 | 176.4 | -73.3 | 172 | 0 | 0 | 0 | 111.7 | A241 R242 | A241-L245 WeakPolarHBondContact O-CG 3.47Å; A241-L245 PolarHBondContact O-N 3.42Å; R242-L245 PolarHBondContact O-N 3.05Å |
| 246 | E | 58.4 | Low | 59.8 | Low | 127 Ų | 127 | 123.7 Ų | 123.7 | 59% | 0.593 | 62% | 0.618 | S | S | * | * | H | α-helix | trans | -71.7 | -41.7 | 174.1 | -72.2 | 174.7 | -176.6 | 0 | 0 | 111.7 | R242 E243 K248 K249 | R242-E246 WeakPolarHBondContact O-CG 3.31Å; R242-E246 PolarHBondContact O-N 2.77Å; E243-E246 PolarHBondContact O-N 3.49Å; E246-K248 PolarHBondContact O-N 3.17Å; E246-K249 PolarHBondContact O-N 3.11Å; E246-K249 VanDerWaalsContact O-N 3.16Å |
| 247 | G | 54 | Low | 58.5 | Low | 48 Ų | 48 | 129.6 Ų | 129.6 | 50% | 0.495 | 64% | 0.64 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -70.1 | -9.3 | 176.6 | 0 | 0 | 0 | 0 | 0 | 115.4 | E243 | E243-G247 PolarHBondContact O-N 3.44Š|
| 248 | K | 52.8 | Low | 57.3 | Low | 168 Ų | 168 | 125.7 Ų | 125.7 | 73% | 0.73 | 64% | 0.637 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -91.2 | -17.4 | 172.2 | -78.7 | 175.6 | 175 | -171.7 | 0 | 113.3 | R244 E246 | R244-K248 VanDerWaalsContact O-CG 3.25Å; R244-K248 WeakPolarHBondContact O-CG 3.37Å; R244-K248 PolarHBondContact O-N 3.07Å; E246-K248 PolarHBondContact O-N 3.17Å |
| 249 | K | 49.5 | Very low | 56.2 | Low | 194 Ų | 194 | 123.4 Ų | 123.4 | 84% | 0.843 | 63% | 0.632 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89.1 | -19.2 | 178.3 | -72.1 | -174.5 | 176.8 | 179.6 | 0 | 113 | E246 | E246-K249 PolarHBondContact O-N 3.11Å; E246-K249 VanDerWaalsContact O-N 3.16Å |
| 250 | T | 40.7 | Very low | 55.3 | Low | 90 Ų | 90 | 123.5 Ų | 123.5 | 55% | 0.552 | 64% | 0.64 | S | S | * | * | trans | -97.4 | 86 | 168.1 | 50.5 | 0 | 0 | 0 | 0 | 109.2 | E252 | T250-E252 PolarHBondContact O-N 2.96Š| ||
| 251 | G | 45.4 | Very low | 54.8 | Low | 89 Ų | 89 | 125.2 Ų | 125.2 | 92% | 0.918 | 66% | 0.656 | S | S | * | * | trans | -68.8 | 52.8 | 162.8 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 252 | E | 43.3 | Very low | 55 | Low | 151 Ų | 151 | 125.5 Ų | 125.5 | 71% | 0.706 | 66% | 0.655 | S | S | * | * | trans | -113.3 | 125.1 | 176.7 | -140.3 | 177.1 | 145.8 | 0 | 0 | 107 | T250 K254 | T250-E252 PolarHBondContact O-N 2.96Å; E252-K254 PolarHBondContact O-N 3.1Å; E252-K254 VanDerWaalsContact O-N 3.1Å | ||
| 253 | A | 45.2 | Very low | 55.6 | Low | 78 Ų | 78 | 129 Ų | 129 | 65% | 0.645 | 67% | 0.668 | S | S | * | * | trans | -38.2 | 123.1 | 173.2 | 0 | 0 | 0 | 0 | 0 | 108.9 | N255 | A253-N255 PolarHBondContact O-N 2.99Š| ||
| 254 | K | 46.1 | Very low | 56.3 | Low | 204 Ų | 204 | 132.2 Ų | 132.2 | 89% | 0.887 | 67% | 0.674 | S | S | * | * | trans | -59.1 | 89.1 | 154.4 | -69.9 | -177.4 | 179.9 | -179.8 | 0 | 104.3 | E252 D256 | E252-K254 PolarHBondContact O-N 3.1Å; E252-K254 VanDerWaalsContact O-N 3.1Å; K254-D256 PolarHBondContact O-N 3.2Å | ||
| 255 | N | 44.9 | Very low | 57.1 | Low | 129 Ų | 129 | 128.5 Ų | 128.5 | 69% | 0.69 | 67% | 0.666 | S | S | * | * | trans | -48.5 | 105.3 | 152.6 | -75.4 | -67.4 | 0 | 0 | 0 | 102.5 | A253 K257 | A253-N255 PolarHBondContact O-N 2.99Å; N255-K257 VanDerWaalsContact C-N 3.33Å; N255-K257 PolarHBondContact O-N 2.94Å | ||
| 256 | D | 42.7 | Very low | 58.3 | Low | 115 Ų | 115 | 125.8 Ų | 125.8 | 62% | 0.615 | 65% | 0.654 | S | S | * | * | trans | -38 | 112.8 | 156.3 | -92.8 | -58.4 | 0 | 0 | 0 | 104.6 | K254 V258 K343 | K254-D256 PolarHBondContact O-N 3.2Å; D256-V258 PolarHBondContact O-N 3.46Å; D256-K343 IonicContact OD1-NZ 2.9Å; D256-K343 PolarHBondContact OD1-NZ 3.36Å | ||
| 257 | K | 51.3 | Low | 60 | Low | 192 Ų | 192 | 124.6 Ų | 124.6 | 84% | 0.835 | 65% | 0.648 | S | S | * | * | trans | -62 | 87.3 | 162.4 | -78.3 | -176.3 | 179.3 | -173.9 | 0 | 103.2 | N255 P259 | N255-K257 VanDerWaalsContact C-N 3.33Å; N255-K257 PolarHBondContact O-N 2.94Å; K257-P259 WeakPolarHBondContact O-CD 3.45Å; K257-P259 VanDerWaalsContact O-N 3.12Å | ||
| 258 | V | 51 | Low | 61.7 | Low | 103 Ų | 103 | 127.8 Ų | 127.8 | 62% | 0.624 | 65% | 0.652 | S | S | * | * | trans | -45.3 | 121.5 | 163.5 | 180 | 0 | 0 | 0 | 0 | 102.8 | D256 Q260 | D256-V258 PolarHBondContact O-N 3.46Å; V258-Q260 PolarHBondContact O-N 3.26Å | ||
| 259 | P | 53.5 | Low | 63.4 | Low | 70 Ų | 70 | 122.8 Ų | 122.8 | 46% | 0.455 | 64% | 0.642 | S | S | . | * | trans | -49.2 | 111.9 | 171 | -23.9 | 32.7 | 0 | 0 | 0 | 105.4 | K257 V261 K343 | K257-P259 WeakPolarHBondContact O-CD 3.45Å; K257-P259 VanDerWaalsContact O-N 3.12Å; P259-V261 PolarHBondContact O-N 3.34Å; P259-K343 HydrophobicContact CG-CB 3.92Å; P259-K343 HydrophobicContact CG-CD 4.03Å; P259-K343 HydrophobicContact CG-CG 3.9Å | ||
| 260 | Q | 60 | Low | 65.5 | Low | 185 Ų | 185 | 118 Ų | 118 | 86% | 0.864 | 62% | 0.623 | S | S | * | * | trans | -65.4 | 97.6 | 179.5 | -79.3 | -164.1 | -7.7 | 0 | 0 | 104.9 | V258 S262 | V258-Q260 PolarHBondContact O-N 3.26Å; Q260-S262 PolarHBondContact O-N 2.63Å | ||
| 261 | V | 64.3 | Low | 68 | Low | 94 Ų | 94 | 120.3 Ų | 120.3 | 57% | 0.57 | 63% | 0.625 | S | S | * | * | trans | -47.7 | 127.7 | 164.9 | -135.7 | 0 | 0 | 0 | 0 | 104.9 | P259 R263 D265 V266 | P259-V261 PolarHBondContact O-N 3.34Å; V261-R263 PolarHBondContact O-N 3.18Å; V261-D265 HydrophobicContact CG1-CB 4.08Å; V261-V266 HydrophobicContact CB-CG2 3.97Å; V261-V266 HydrophobicContact CG2-CG2 4.44Å | ||
| 262 | S | 79.8 | Confident | 70.1 | Confident | 54 Ų | 54 | 119.6 Ų | 119.6 | 38% | 0.378 | 60% | 0.603 | S | S | . | * | trans | -56.7 | 142.7 | -172 | 80.9 | 0 | 0 | 0 | 0 | 108.2 | Q260 R264 D265 V266 | Q260-S262 PolarHBondContact O-N 2.63Å; S262-R264 PolarHBondContact O-N 2.92Å; S262-D265 WeakPolarHBondContact CB-OD2 3.35Å; S262-D265 PolarHBondContact N-OD2 3.28Å; S262-D265 PolarHBondContact O-N 2.72Å; S262-D265 PolarHBondContact OG-N 3.08Å; S262-D265 PolarHBondContact OG-OD1 3.46Å; S262-D265 PolarHBondContact OG-OD2 3.35Å; S262-V266 PolarHBondContact O-N 2.74Å | ||
| 263 | R | 84.1 | Confident | 72.3 | Confident | 217 Ų | 217 | 114.7 Ų | 114.7 | 82% | 0.819 | 59% | 0.585 | S | S | * | * | H | α-helix | trans | -51.9 | -32.9 | -179.1 | -70.5 | -174.5 | 177 | -176.3 | -1.3 | 111.7 | V261 V266 E267 | V261-R263 PolarHBondContact O-N 3.18Å; R263-V266 PolarHBondContact O-N 2.8Å; R263-E267 VanDerWaalsContact O-CG 3.32Å; R263-E267 WeakPolarHBondContact O-CG 2.96Å; R263-E267 PolarHBondContact O-N 2.96Å |
| 264 | R | 87.4 | Confident | 74.6 | Confident | 198 Ų | 198 | 117 Ų | 117 | 75% | 0.747 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -61.2 | -44.1 | 173.2 | -75.2 | -169.4 | 174.6 | 89.6 | 0.6 | 113.3 | S262 E267 M268 | S262-R264 PolarHBondContact O-N 2.92Å; R264-E267 PolarHBondContact O-N 2.98Å; R264-M268 VanDerWaalsContact O-CB 3.32Å; R264-M268 WeakPolarHBondContact O-CB 3.35Å; R264-M268 PolarHBondContact O-N 2.86Å |
| 265 | D | 83.6 | Confident | 76.8 | Confident | 73 Ų | 73 | 114 Ų | 114 | 39% | 0.39 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -68.2 | -38 | -178.8 | -59.2 | -34.8 | 0 | 0 | 0 | 111.4 | V261 S262 M268 A269 | V261-D265 HydrophobicContact CG1-CB 4.08Å; S262-D265 WeakPolarHBondContact CB-OD2 3.35Å; S262-D265 PolarHBondContact N-OD2 3.28Å; S262-D265 PolarHBondContact O-N 2.72Å; S262-D265 PolarHBondContact OG-N 3.08Å; S262-D265 PolarHBondContact OG-OD1 3.46Å; S262-D265 PolarHBondContact OG-OD2 3.35Å; D265-M268 PolarHBondContact O-N 3.09Å; D265-A269 WeakPolarHBondContact O-CB 3.37Å; D265-A269 PolarHBondContact O-N 2.93Å |
| 266 | V | 86.9 | Confident | 78.9 | Confident | 62 Ų | 62 | 110.1 Ų | 110.1 | 38% | 0.376 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -63 | -49.6 | 174.6 | -178.5 | 0 | 0 | 0 | 0 | 110.3 | V261 S262 R263 M268 A269 E270 | V261-V266 HydrophobicContact CB-CG2 3.97Å; V261-V266 HydrophobicContact CG2-CG2 4.44Å; S262-V266 PolarHBondContact O-N 2.74Å; R263-V266 PolarHBondContact O-N 2.8Å; V266-M268 VanDerWaalsContact C-N 3.28Å; V266-M268 PolarHBondContact O-N 2.98Å; V266-A269 PolarHBondContact O-N 3.13Å; V266-E270 WeakPolarHBondContact O-CG 3.2Å; V266-E270 PolarHBondContact O-N 2.83Å |
| 267 | E | 92.8 | Very high | 81 | Confident | 102 Ų | 102 | 111.9 Ų | 111.9 | 48% | 0.477 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -60.3 | -38.3 | 176.5 | -73.2 | 173.8 | -155 | 0 | 0 | 112.4 | R263 R264 K271 | R263-E267 VanDerWaalsContact O-CG 3.32Å; R263-E267 WeakPolarHBondContact O-CG 2.96Å; R263-E267 PolarHBondContact O-N 2.96Å; R264-E267 PolarHBondContact O-N 2.98Å; E267-K271 WeakPolarHBondContact O-CB 3.47Å; E267-K271 WeakPolarHBondContact O-CD 3.4Å; E267-K271 VanDerWaalsContact O-CG 3.22Å; E267-K271 WeakPolarHBondContact O-CG 3.22Å; E267-K271 PolarHBondContact O-N 3.04Å |
| 268 | M | 90.3 | Very high | 82.8 | Confident | 116 Ų | 116 | 107 Ų | 107 | 57% | 0.571 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -67.3 | -44.6 | 177.4 | -168.1 | -177.4 | -56.9 | 0 | 0 | 111.1 | R264 D265 V266 E270 K271 V272 | R264-M268 VanDerWaalsContact O-CB 3.32Å; R264-M268 WeakPolarHBondContact O-CB 3.35Å; R264-M268 PolarHBondContact O-N 2.86Å; D265-M268 PolarHBondContact O-N 3.09Å; V266-M268 VanDerWaalsContact C-N 3.28Å; V266-M268 PolarHBondContact O-N 2.98Å; M268-E270 VanDerWaalsContact C-N 3.34Å; M268-E270 PolarHBondContact O-N 2.79Å; M268-K271 PolarHBondContact O-N 2.79Å; M268-V272 WeakPolarHBondContact O-CG2 3.3Å; M268-V272 PolarHBondContact O-N 3.03Å |
| 269 | A | 89.1 | Confident | 84.6 | Confident | 62 Ų | 62 | 109.4 Ų | 109.4 | 51% | 0.512 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -60.6 | -42.7 | 176.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | D265 V266 V272 S273 | D265-A269 WeakPolarHBondContact O-CB 3.37Å; D265-A269 PolarHBondContact O-N 2.93Å; V266-A269 PolarHBondContact O-N 3.13Å; A269-V272 PolarHBondContact O-N 2.64Å; A269-S273 WeakPolarHBondContact O-CB 3.44Å; A269-S273 PolarHBondContact O-N 3.28Å |
| 270 | E | 92.3 | Very high | 86.2 | Confident | 95 Ų | 95 | 113.8 Ų | 113.8 | 44% | 0.444 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -65 | -39.6 | 175.4 | -73.3 | -176.9 | -169 | 0 | 0 | 113 | V266 M268 V272 S273 K274 | V266-E270 WeakPolarHBondContact O-CG 3.2Å; V266-E270 PolarHBondContact O-N 2.83Å; M268-E270 VanDerWaalsContact C-N 3.34Å; M268-E270 PolarHBondContact O-N 2.79Å; E270-V272 VanDerWaalsContact C-N 3.33Å; E270-S273 WeakPolarHBondContact CA-OG 3.46Å; E270-S273 PolarHBondContact O-N 3.2Å; E270-S273 PolarHBondContact O-OG 2.76Å; E270-K274 WeakPolarHBondContact O-CB 3.46Å; E270-K274 VanDerWaalsContact O-CG 3.25Å; E270-K274 WeakPolarHBondContact O-CG 3.49Å; E270-K274 PolarHBondContact O-N 2.91Å; E270-K274 IonicContact OE2-NZ 3.88Å |
| 271 | K | 93.6 | Very high | 87.4 | Confident | 137 Ų | 137 | 108.3 Ų | 108.3 | 60% | 0.596 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -62.9 | -43.3 | 175.4 | -74.6 | 166.6 | -171.8 | 167.6 | 0 | 110.7 | E267 M268 Y275 | E267-K271 WeakPolarHBondContact O-CB 3.47Å; E267-K271 WeakPolarHBondContact O-CD 3.4Å; E267-K271 VanDerWaalsContact O-CG 3.22Å; E267-K271 WeakPolarHBondContact O-CG 3.22Å; E267-K271 PolarHBondContact O-N 3.04Å; M268-K271 PolarHBondContact O-N 2.79Å; K271-Y275 WeakPolarHBondContact O-CB 3.25Å; K271-Y275 PolarHBondContact O-N 2.77Å |
| 272 | V | 90.9 | Very high | 88.5 | Confident | 75 Ų | 75 | 108.5 Ų | 108.5 | 46% | 0.455 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -67.8 | -39.9 | 177.8 | 172.4 | 0 | 0 | 0 | 0 | 111.3 | M268 A269 E270 Y275 N276 | M268-V272 WeakPolarHBondContact O-CG2 3.3Å; M268-V272 PolarHBondContact O-N 3.03Å; A269-V272 PolarHBondContact O-N 2.64Å; E270-V272 VanDerWaalsContact C-N 3.33Å; V272-Y275 PolarHBondContact O-N 3.47Å; V272-N276 WeakPolarHBondContact CG1-ND2 3.31Å; V272-N276 WeakPolarHBondContact O-CB 3.34Å; V272-N276 PolarHBondContact O-N 3.29Å; V272-N276 PolarHBondContact O-ND2 2.74Å |
| 273 | S | 88.9 | Confident | 88.9 | Confident | 47 Ų | 47 | 109 Ų | 109 | 33% | 0.329 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -64 | -47.4 | 177 | 71 | 0 | 0 | 0 | 0 | 111.4 | A269 E270 Y275 N276 E277 | A269-S273 WeakPolarHBondContact O-CB 3.44Å; A269-S273 PolarHBondContact O-N 3.28Å; E270-S273 WeakPolarHBondContact CA-OG 3.46Å; E270-S273 PolarHBondContact O-N 3.2Å; E270-S273 PolarHBondContact O-OG 2.76Å; S273-Y275 VanDerWaalsContact C-N 3.31Å; S273-Y275 PolarHBondContact O-N 3.41Å; S273-N276 PolarHBondContact O-N 2.66Å; S273-N276 VanDerWaalsContact O-N 3.15Å; S273-E277 WeakPolarHBondContact O-CB 3.47Å; S273-E277 VanDerWaalsContact O-CG 3.31Å; S273-E277 WeakPolarHBondContact O-CG 3.22Å; S273-E277 PolarHBondContact O-N 3.24Å |
| 274 | K | 92.3 | Very high | 89.1 | Confident | 126 Ų | 126 | 105.6 Ų | 105.6 | 55% | 0.548 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -59.1 | -40.2 | 175.7 | -71.5 | 169.4 | -175.6 | 167.3 | 0 | 112.5 | E270 S278 | E270-K274 WeakPolarHBondContact O-CB 3.46Å; E270-K274 VanDerWaalsContact O-CG 3.25Å; E270-K274 WeakPolarHBondContact O-CG 3.49Å; E270-K274 PolarHBondContact O-N 2.91Å; E270-K274 IonicContact OE2-NZ 3.88Å; K274-S278 PolarHBondContact O-N 3.05Å; K274-S278 PolarHBondContact O-OG 3.33Å |
| 275 | Y | 92.5 | Very high | 89.1 | Confident | 142 Ų | 142 | 102.4 Ų | 102.4 | 56% | 0.557 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -65.8 | -45.9 | 175.1 | -179.6 | -92.7 | 0 | 0 | 0 | 111.4 | K271 V272 S273 E277 S278 K279 | K271-Y275 WeakPolarHBondContact O-CB 3.25Å; K271-Y275 PolarHBondContact O-N 2.77Å; V272-Y275 PolarHBondContact O-N 3.47Å; S273-Y275 VanDerWaalsContact C-N 3.31Å; S273-Y275 PolarHBondContact O-N 3.41Å; Y275-E277 PolarHBondContact O-N 3.2Å; Y275-S278 PolarHBondContact O-N 3.31Å; Y275-S278 PolarHBondContact O-OG 2.82Å; Y275-K279 HydrophobicContact CD1-CB 4.47Å; Y275-K279 HydrophobicContact CD2-CG 3.94Å; Y275-K279 HydrophobicContact CE1-CB 4.12Å; Y275-K279 HydrophobicContact CE1-CG 4.45Å; Y275-K279 HydrophobicContact CE2-CB 4.2Å; Y275-K279 HydrophobicContact CE2-CG 3.64Å; Y275-K279 HydrophobicContact CG-CG 4.49Å; Y275-K279 WeakPolarHBondContact O-CB 3.43Å; Y275-K279 PolarHBondContact O-N 3.1Å |
| 276 | N | 89.4 | Confident | 89.3 | Confident | 48 Ų | 48 | 100.8 Ų | 100.8 | 26% | 0.257 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -62.6 | -41.6 | 178.2 | -72.1 | -27 | 0 | 0 | 0 | 111.7 | V272 S273 S278 R280 | V272-N276 WeakPolarHBondContact CG1-ND2 3.31Å; V272-N276 WeakPolarHBondContact O-CB 3.34Å; V272-N276 PolarHBondContact O-N 3.29Å; V272-N276 PolarHBondContact O-ND2 2.74Å; S273-N276 PolarHBondContact O-N 2.66Å; S273-N276 VanDerWaalsContact O-N 3.15Å; N276-S278 VanDerWaalsContact C-N 3.33Å; N276-S278 PolarHBondContact O-N 3.18Å; N276-R280 CarbonylContact O-C 3.54Å; N276-R280 VanDerWaalsContact O-CA 3.31Å; N276-R280 WeakPolarHBondContact O-CA 3.5Å; N276-R280 WeakPolarHBondContact O-CB 3.15Å; N276-R280 PolarHBondContact O-N 2.81Å; N276-R280 VanDerWaalsContact O-O 3.06Å; N276-R280 WeakPolarHBondContact OD1-CD 3.45Å; N276-R280 PolarHBondContact OD1-NE 3.01Å; N276-R280 PolarHBondContact OD1-NH1 2.82Å |
| 277 | E | 87.4 | Confident | 89.6 | Confident | 151 Ų | 151 | 100.2 Ų | 100.2 | 71% | 0.706 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -65.8 | -32.9 | 179.6 | -73.1 | 166.3 | -165.6 | 0 | 0 | 113.4 | S273 Y275 | S273-E277 WeakPolarHBondContact O-CB 3.47Å; S273-E277 VanDerWaalsContact O-CG 3.31Å; S273-E277 WeakPolarHBondContact O-CG 3.22Å; S273-E277 PolarHBondContact O-N 3.24Å; Y275-E277 PolarHBondContact O-N 3.2Å |
| 278 | S | 88.2 | Confident | 89.6 | Confident | 90 Ų | 90 | 100.9 Ų | 100.9 | 63% | 0.629 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -94 | -31.2 | -176.8 | 57.6 | 0 | 0 | 0 | 0 | 114.1 | K274 Y275 N276 | K274-S278 PolarHBondContact O-N 3.05Å; K274-S278 PolarHBondContact O-OG 3.33Å; Y275-S278 PolarHBondContact O-N 3.31Å; Y275-S278 PolarHBondContact O-OG 2.82Å; N276-S278 VanDerWaalsContact C-N 3.33Å; N276-S278 PolarHBondContact O-N 3.18Å |
| 279 | K | 88.8 | Confident | 89.5 | Confident | 154 Ų | 154 | 97.6 Ų | 97.6 | 67% | 0.67 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -107 | -24.2 | -175.8 | -63.8 | -63.1 | -173.4 | 179.7 | 0 | 113.8 | Y275 | Y275-K279 HydrophobicContact CD1-CB 4.47Å; Y275-K279 HydrophobicContact CD2-CG 3.94Å; Y275-K279 HydrophobicContact CE1-CB 4.12Å; Y275-K279 HydrophobicContact CE1-CG 4.45Å; Y275-K279 HydrophobicContact CE2-CB 4.2Å; Y275-K279 HydrophobicContact CE2-CG 3.64Å; Y275-K279 HydrophobicContact CG-CG 4.49Å; Y275-K279 WeakPolarHBondContact O-CB 3.43Å; Y275-K279 PolarHBondContact O-N 3.1Å |
| 280 | R | 86.6 | Confident | 89.7 | Confident | 162 Ų | 162 | 100 Ų | 100 | 61% | 0.611 | 51% | 0.512 | S | S | * | . | S | Bend | trans | -100.3 | 142.1 | 172.9 | -59.6 | -176 | 170.8 | 167.4 | -5.1 | 109 | N276 | N276-R280 CarbonylContact O-C 3.54Å; N276-R280 VanDerWaalsContact O-CA 3.31Å; N276-R280 WeakPolarHBondContact O-CA 3.5Å; N276-R280 WeakPolarHBondContact O-CB 3.15Å; N276-R280 PolarHBondContact O-N 2.81Å; N276-R280 VanDerWaalsContact O-O 3.06Å; N276-R280 WeakPolarHBondContact OD1-CD 3.45Å; N276-R280 PolarHBondContact OD1-NE 3.01Å; N276-R280 PolarHBondContact OD1-NH1 2.82Å |
| 281 | G | 86.8 | Confident | 89.6 | Confident | 70 Ų | 70 | 101.6 Ų | 101.6 | 72% | 0.722 | 52% | 0.517 | S | S | * | . | trans | -63.3 | 174 | 166.5 | 0 | 0 | 0 | 0 | 0 | 111 | S283 | G281-S283 PolarHBondContact O-N 3.08Š| ||
| 282 | E | 87.5 | Confident | 89.3 | Confident | 97 Ų | 97 | 99.9 Ų | 99.9 | 45% | 0.453 | 51% | 0.514 | S | S | . | . | trans | -52.9 | 137.1 | 174.6 | 47.9 | 176.6 | 164.4 | 0 | 0 | 112 | L287 K290 | E282-L287 HydrophobicContact CB-CG 4.4Å; E282-L287 VanDerWaalsContact CD-CG 3.46Å; E282-L287 HydrophobicContact CG-CD1 4Å; E282-L287 HydrophobicContact CG-CD2 3.85Å; E282-L287 HydrophobicContact CG-CG 3.61Å; E282-L287 WeakPolarHBondContact OE1-CD2 3.32Å; E282-K290 WeakPolarHBondContact OE2-CD 3.47Å; E282-K290 WeakPolarHBondContact OE2-CE 3.32Å; E282-K290 IonicContact OE2-NZ 3.39Å; E282-K290 PolarHBondContact OE2-NZ 2.79Å | ||
| 283 | S | 87.3 | Confident | 89.3 | Confident | 66 Ų | 66 | 102.9 Ų | 102.9 | 46% | 0.462 | 52% | 0.521 | S | S | . | . | trans | -59.7 | 142.9 | 179.3 | 173.4 | 0 | 0 | 0 | 0 | 110.4 | G281 I285 S286 L287 | G281-S283 PolarHBondContact O-N 3.08Å; S283-I285 PolarHBondContact O-N 2.85Å; S283-I285 VanDerWaalsContact O-N 3.1Å; S283-I285 PolarHBondContact OG-N 3.5Å; S283-S286 PolarHBondContact N-OG 3.3Å; S283-S286 CarbonylContact O-C 3.55Å; S283-S286 WeakPolarHBondContact O-CA 3.48Å; S283-S286 PolarHBondContact O-N 3.34Å; S283-S286 PolarHBondContact O-OG 3.18Å; S283-L287 PolarHBondContact O-N 3Å | ||
| 284 | L | 89 | Confident | 89.4 | Confident | 144 Ų | 144 | 106.6 Ų | 106.6 | 75% | 0.754 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -52.5 | -35.3 | 175 | -172.6 | 66.3 | 0 | 0 | 0 | 112.1 | L287 H288 | L284-L287 WeakPolarHBondContact O-CB 3.17Å; L284-L287 PolarHBondContact O-N 3.39Å; L284-H288 WeakPolarHBondContact O-CB 3.36Å; L284-H288 PolarHBondContact O-N 3.21Å |
| 285 | I | 87.3 | Confident | 89.1 | Confident | 132 Ų | 132 | 106.2 Ų | 106.2 | 68% | 0.677 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -67.4 | -43.4 | 175.5 | -65.9 | 162.8 | 0 | 0 | 0 | 110.6 | S283 L287 H288 S289 | S283-I285 PolarHBondContact O-N 2.85Å; S283-I285 VanDerWaalsContact O-N 3.1Å; S283-I285 PolarHBondContact OG-N 3.5Å; I285-L287 VanDerWaalsContact C-N 3.35Å; I285-H288 PolarHBondContact O-N 2.83Å; I285-S289 WeakPolarHBondContact O-CB 3.34Å; I285-S289 PolarHBondContact O-N 3.35Å |
| 286 | S | 88.4 | Confident | 88.9 | Confident | 38 Ų | 38 | 102 Ų | 102 | 27% | 0.266 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -66 | -40.7 | 177 | 64.7 | 0 | 0 | 0 | 0 | 111.2 | S283 S289 K290 | S283-S286 PolarHBondContact N-OG 3.3Å; S283-S286 CarbonylContact O-C 3.55Å; S283-S286 WeakPolarHBondContact O-CA 3.48Å; S283-S286 PolarHBondContact O-N 3.34Å; S283-S286 PolarHBondContact O-OG 3.18Å; S286-S289 WeakPolarHBondContact CA-OG 3.44Å; S286-S289 PolarHBondContact O-N 2.95Å; S286-S289 PolarHBondContact O-OG 2.77Å; S286-K290 WeakPolarHBondContact O-CB 3.31Å; S286-K290 VanDerWaalsContact O-CG 3.31Å; S286-K290 WeakPolarHBondContact O-CG 3.42Å; S286-K290 PolarHBondContact O-N 3.23Å |
| 287 | L | 92.1 | Very high | 88.7 | Confident | 51 Ų | 51 | 106.5 Ų | 106.5 | 27% | 0.267 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -55.4 | -52 | 172.9 | -87.7 | 166.3 | 0 | 0 | 0 | 111.4 | E282 S283 L284 I285 S289 K290 K291 | E282-L287 HydrophobicContact CB-CG 4.4Å; E282-L287 VanDerWaalsContact CD-CG 3.46Å; E282-L287 HydrophobicContact CG-CD1 4Å; E282-L287 HydrophobicContact CG-CD2 3.85Å; E282-L287 HydrophobicContact CG-CG 3.61Å; E282-L287 WeakPolarHBondContact OE1-CD2 3.32Å; S283-L287 PolarHBondContact O-N 3Å; L284-L287 WeakPolarHBondContact O-CB 3.17Å; L284-L287 PolarHBondContact O-N 3.39Å; I285-L287 VanDerWaalsContact C-N 3.35Å; L287-S289 VanDerWaalsContact C-N 3.34Å; L287-S289 PolarHBondContact O-N 3.45Å; L287-K290 PolarHBondContact O-N 3.19Å; L287-K291 WeakPolarHBondContact O-CG 3.38Å; L287-K291 PolarHBondContact O-N 2.78Å |
| 288 | H | 92.5 | Very high | 88.4 | Confident | 116 Ų | 116 | 103 Ų | 103 | 54% | 0.537 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -63 | -41.1 | 178.9 | -169.6 | -93.6 | 0 | 0 | 0 | 111.7 | L284 I285 K290 K291 L292 | L284-H288 WeakPolarHBondContact O-CB 3.36Å; L284-H288 PolarHBondContact O-N 3.21Å; I285-H288 PolarHBondContact O-N 2.83Å; H288-K290 PolarHBondContact O-N 3.05Å; H288-K291 PolarHBondContact O-N 3.46Å; H288-L292 VanDerWaalsContact CE1-CD1 3.46Å; H288-L292 WeakPolarHBondContact CE1-CD1 3.46Å; H288-L292 WeakPolarHBondContact O-CB 3.19Å; H288-L292 WeakPolarHBondContact O-CG 3.41Å; H288-L292 PolarHBondContact O-N 3.33Å |
| 289 | S | 89.4 | Confident | 87.7 | Confident | 46 Ų | 46 | 103 Ų | 103 | 32% | 0.322 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -64.7 | -37.7 | 176.9 | 79.2 | 0 | 0 | 0 | 0 | 112.8 | I285 S286 L287 K293 | I285-S289 WeakPolarHBondContact O-CB 3.34Å; I285-S289 PolarHBondContact O-N 3.35Å; S286-S289 WeakPolarHBondContact CA-OG 3.44Å; S286-S289 PolarHBondContact O-N 2.95Å; S286-S289 PolarHBondContact O-OG 2.77Å; L287-S289 VanDerWaalsContact C-N 3.34Å; L287-S289 PolarHBondContact O-N 3.45Å; S289-K293 WeakPolarHBondContact O-CB 3.46Å; S289-K293 VanDerWaalsContact O-CG 3.27Å; S289-K293 WeakPolarHBondContact O-CG 3.28Å; S289-K293 PolarHBondContact O-N 2.93Å |
| 290 | K | 91.6 | Very high | 87.1 | Confident | 114 Ų | 114 | 99.4 Ų | 99.4 | 50% | 0.496 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -66.4 | -48.1 | 175.2 | -75 | 175.1 | -178.6 | 178.6 | 0 | 110.4 | E282 S286 L287 H288 L292 K293 E294 | E282-K290 WeakPolarHBondContact OE2-CD 3.47Å; E282-K290 WeakPolarHBondContact OE2-CE 3.32Å; E282-K290 IonicContact OE2-NZ 3.39Å; E282-K290 PolarHBondContact OE2-NZ 2.79Å; S286-K290 WeakPolarHBondContact O-CB 3.31Å; S286-K290 VanDerWaalsContact O-CG 3.31Å; S286-K290 WeakPolarHBondContact O-CG 3.42Å; S286-K290 PolarHBondContact O-N 3.23Å; L287-K290 PolarHBondContact O-N 3.19Å; H288-K290 PolarHBondContact O-N 3.05Å; K290-L292 PolarHBondContact O-N 2.93Å; K290-K293 PolarHBondContact O-N 2.75Å; K290-K293 VanDerWaalsContact O-N 3.16Å; K290-E294 WeakPolarHBondContact O-CB 3.45Å; K290-E294 PolarHBondContact O-N 3.33Å |
| 291 | K | 92 | Very high | 86.5 | Confident | 127 Ų | 127 | 98.3 Ų | 98.3 | 55% | 0.552 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -57.6 | -45 | 176.1 | -72 | 178.5 | -178.3 | -176.5 | 0 | 112.2 | L287 H288 K293 E294 K295 | L287-K291 WeakPolarHBondContact O-CG 3.38Å; L287-K291 PolarHBondContact O-N 2.78Å; H288-K291 PolarHBondContact O-N 3.46Å; K291-K293 PolarHBondContact O-N 3.25Å; K291-E294 PolarHBondContact O-N 2.53Å; K291-K295 WeakPolarHBondContact O-CB 3.4Å; K291-K295 WeakPolarHBondContact O-CG 3.47Å; K291-K295 PolarHBondContact O-N 2.94Å |
| 292 | L | 87.4 | Confident | 86 | Confident | 101 Ų | 101 | 100.4 Ų | 100.4 | 53% | 0.529 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -61.8 | -43.7 | 175.9 | -78.5 | 175.2 | 0 | 0 | 0 | 112.2 | H288 K290 K295 A296 | H288-L292 VanDerWaalsContact CE1-CD1 3.46Å; H288-L292 WeakPolarHBondContact CE1-CD1 3.46Å; H288-L292 WeakPolarHBondContact O-CB 3.19Å; H288-L292 WeakPolarHBondContact O-CG 3.41Å; H288-L292 PolarHBondContact O-N 3.33Å; K290-L292 PolarHBondContact O-N 2.93Å; L292-K295 PolarHBondContact O-N 3.21Å; L292-A296 WeakPolarHBondContact O-CB 3.44Å; L292-A296 PolarHBondContact O-N 2.92Å |
| 293 | K | 89.5 | Confident | 85.2 | Confident | 138 Ų | 138 | 100.9 Ų | 100.9 | 60% | 0.6 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -65.9 | -38.9 | 177.4 | -74.1 | 174.2 | -178.5 | -178.5 | 0 | 112.3 | S289 K290 K291 A296 K297 | S289-K293 WeakPolarHBondContact O-CB 3.46Å; S289-K293 VanDerWaalsContact O-CG 3.27Å; S289-K293 WeakPolarHBondContact O-CG 3.28Å; S289-K293 PolarHBondContact O-N 2.93Å; K290-K293 PolarHBondContact O-N 2.75Å; K290-K293 VanDerWaalsContact O-N 3.16Å; K291-K293 PolarHBondContact O-N 3.25Å; K293-A296 PolarHBondContact O-N 3.33Å; K293-K297 VanDerWaalsContact O-CG 3.32Å; K293-K297 WeakPolarHBondContact O-CG 3.46Å; K293-K297 PolarHBondContact O-N 2.99Å |
| 294 | E | 91.1 | Very high | 84.5 | Confident | 125 Ų | 125 | 104.9 Ų | 104.9 | 58% | 0.584 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -65.4 | -45.4 | 176 | -170.9 | -178.3 | 174.4 | 0 | 0 | 110.9 | K290 K291 A296 K297 E298 | K290-E294 WeakPolarHBondContact O-CB 3.45Å; K290-E294 PolarHBondContact O-N 3.33Å; K291-E294 PolarHBondContact O-N 2.53Å; E294-A296 VanDerWaalsContact C-N 3.33Å; E294-A296 PolarHBondContact O-N 3.33Å; E294-K297 PolarHBondContact O-N 3.16Å; E294-K297 VanDerWaalsContact O-N 3.14Å; E294-E298 WeakPolarHBondContact O-CB 3.34Å; E294-E298 PolarHBondContact O-N 2.82Å |
| 295 | K | 87.3 | Confident | 84 | Confident | 118 Ų | 118 | 105.6 Ų | 105.6 | 51% | 0.513 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -62.7 | -38 | 174.5 | -68.1 | -72.3 | 159.2 | -159.2 | 0 | 112.5 | K291 L292 K297 E298 T299 | K291-K295 WeakPolarHBondContact O-CB 3.4Å; K291-K295 WeakPolarHBondContact O-CG 3.47Å; K291-K295 PolarHBondContact O-N 2.94Å; L292-K295 PolarHBondContact O-N 3.21Å; K295-K297 VanDerWaalsContact C-N 3.35Å; K295-E298 IonicContact NZ-OE2 3.05Å; K295-E298 PolarHBondContact NZ-OE2 3.5Å; K295-E298 PolarHBondContact O-N 3.01Å; K295-T299 WeakPolarHBondContact O-CB 3.46Å; K295-T299 VanDerWaalsContact O-CG2 3.31Å; K295-T299 WeakPolarHBondContact O-CG2 3.47Å; K295-T299 PolarHBondContact O-N 3.44Å; K295-T299 PolarHBondContact O-OG1 3.16Å |
| 296 | A | 86.9 | Confident | 83.6 | Confident | 54 Ų | 54 | 111.6 Ų | 111.6 | 45% | 0.446 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -64.9 | -37.5 | 173.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | L292 K293 E294 T299 A300 | L292-A296 WeakPolarHBondContact O-CB 3.44Å; L292-A296 PolarHBondContact O-N 2.92Å; K293-A296 PolarHBondContact O-N 3.33Å; E294-A296 VanDerWaalsContact C-N 3.33Å; E294-A296 PolarHBondContact O-N 3.33Å; A296-T299 WeakPolarHBondContact CA-OG1 3.23Å; A296-T299 PolarHBondContact O-OG1 2.92Å; A296-A300 VanDerWaalsContact O-CB 3.23Å; A296-A300 WeakPolarHBondContact O-CB 3.28Å; A296-A300 PolarHBondContact O-N 3.32Å |
| 297 | K | 85 | Confident | 83.3 | Confident | 143 Ų | 143 | 116 Ų | 116 | 62% | 0.622 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -70.8 | -43.8 | 174.2 | -71.5 | 174.6 | 179.6 | -171.1 | 0 | 112 | K293 E294 K295 T299 A300 D301 | K293-K297 VanDerWaalsContact O-CG 3.32Å; K293-K297 WeakPolarHBondContact O-CG 3.46Å; K293-K297 PolarHBondContact O-N 2.99Å; E294-K297 PolarHBondContact O-N 3.16Å; E294-K297 VanDerWaalsContact O-N 3.14Å; K295-K297 VanDerWaalsContact C-N 3.35Å; K297-T299 PolarHBondContact O-N 3.37Å; K297-A300 PolarHBondContact O-N 2.9Å; K297-A300 VanDerWaalsContact O-N 3.11Å; K297-D301 WeakPolarHBondContact O-CB 2.97Å; K297-D301 PolarHBondContact O-N 3.49Å |
| 298 | E | 81.4 | Confident | 83.1 | Confident | 76 Ų | 76 | 118.7 Ų | 118.7 | 36% | 0.355 | 60% | 0.596 | S | S | . | * | H | α-helix | trans | -61 | -32.3 | 177.3 | -161.1 | -157.2 | 140.6 | 0 | 0 | 112.2 | E294 K295 K302 | E294-E298 WeakPolarHBondContact O-CB 3.34Å; E294-E298 PolarHBondContact O-N 2.82Å; K295-E298 IonicContact NZ-OE2 3.05Å; K295-E298 PolarHBondContact NZ-OE2 3.5Å; K295-E298 PolarHBondContact O-N 3.01Å; E298-K302 WeakPolarHBondContact O-CD 3.48Å; E298-K302 WeakPolarHBondContact O-CE 3.25Å; E298-K302 WeakPolarHBondContact O-CG 3.44Å; E298-K302 IonicContact OE1-NZ 2.83Å; E298-K302 PolarHBondContact OE1-NZ 3.06Å |
| 299 | T | 74.5 | Confident | 82.7 | Confident | 92 Ų | 92 | 119.9 Ų | 119.9 | 56% | 0.564 | 60% | 0.6 | S | S | * | * | H | α-helix | trans | -82 | -32.6 | 174.7 | 48.2 | 0 | 0 | 0 | 0 | 112.5 | K295 A296 K297 | K295-T299 WeakPolarHBondContact O-CB 3.46Å; K295-T299 VanDerWaalsContact O-CG2 3.31Å; K295-T299 WeakPolarHBondContact O-CG2 3.47Å; K295-T299 PolarHBondContact O-N 3.44Å; K295-T299 PolarHBondContact O-OG1 3.16Å; A296-T299 WeakPolarHBondContact CA-OG1 3.23Å; A296-T299 PolarHBondContact O-OG1 2.92Å; K297-T299 PolarHBondContact O-N 3.37Å |
| 300 | A | 75.9 | Confident | 82.5 | Confident | 78 Ų | 78 | 120.2 Ų | 120.2 | 65% | 0.645 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -72.7 | -31.2 | 174.7 | 0 | 0 | 0 | 0 | 0 | 113.5 | A296 K297 K302 | A296-A300 VanDerWaalsContact O-CB 3.23Å; A296-A300 WeakPolarHBondContact O-CB 3.28Å; A296-A300 PolarHBondContact O-N 3.32Å; K297-A300 PolarHBondContact O-N 2.9Å; K297-A300 VanDerWaalsContact O-N 3.11Å; A300-K302 VanDerWaalsContact C-N 3.28Å |
| 301 | D | 74.3 | Confident | 82.1 | Confident | 139 Ų | 139 | 122.5 Ų | 122.5 | 74% | 0.743 | 60% | 0.603 | S | S | * | * | S | Bend | trans | -77 | -14.8 | 177.5 | -72.7 | -26.9 | 0 | 0 | 0 | 112.5 | K297 | K297-D301 WeakPolarHBondContact O-CB 2.97Å; K297-D301 PolarHBondContact O-N 3.49Å |
| 302 | K | 75.4 | Confident | 81.5 | Confident | 113 Ų | 113 | 121.2 Ų | 121.2 | 49% | 0.491 | 60% | 0.603 | S | S | . | * | S | Bend | trans | -83.7 | 124.8 | 172.4 | -70.6 | 169.6 | -167.2 | 172.1 | 0 | 108.6 | E298 A300 V304 | E298-K302 WeakPolarHBondContact O-CD 3.48Å; E298-K302 WeakPolarHBondContact O-CE 3.25Å; E298-K302 WeakPolarHBondContact O-CG 3.44Å; E298-K302 IonicContact OE1-NZ 2.83Å; E298-K302 PolarHBondContact OE1-NZ 3.06Å; A300-K302 VanDerWaalsContact C-N 3.28Å; K302-V304 PolarHBondContact O-N 3.31Å |
| 303 | P | 70.8 | Confident | 81.1 | Confident | 107 Ų | 107 | 120.9 Ų | 120.9 | 70% | 0.695 | 60% | 0.599 | S | S | * | * | trans | -58.3 | 136.2 | 175 | 24.9 | -32.5 | 0 | 0 | 0 | 109.4 | E305 | P303-E305 VanDerWaalsContact C-N 3.32Å; P303-E305 PolarHBondContact O-N 3.04Å | ||
| 304 | V | 73.1 | Confident | 80.8 | Confident | 151 Ų | 151 | 118.2 Ų | 118.2 | 92% | 0.915 | 59% | 0.591 | S | S | * | * | trans | -70.9 | 89.2 | -176.6 | -177.6 | 0 | 0 | 0 | 0 | 109.2 | K302 | K302-V304 PolarHBondContact O-N 3.31Š| ||
| 305 | E | 78.9 | Confident | 80.2 | Confident | 159 Ų | 159 | 115.7 Ų | 115.7 | 74% | 0.743 | 58% | 0.581 | S | S | * | * | trans | -75.8 | 152.1 | 169.4 | -66.2 | -176.4 | 176.8 | 0 | 0 | 110.3 | P303 R307 | P303-E305 VanDerWaalsContact C-N 3.32Å; P303-E305 PolarHBondContact O-N 3.04Å; E305-R307 PolarHBondContact O-N 3.15Å | ||
| 306 | R | 77.8 | Confident | 79.5 | Confident | 258 Ų | 258 | 117.4 Ų | 117.4 | 97% | 0.974 | 59% | 0.591 | S | S | * | * | trans | -65.7 | 99.8 | 178 | -69.3 | -178 | 91.9 | 128.4 | 0.6 | 109.3 | ||||
| 307 | R | 82 | Confident | 78.8 | Confident | 130 Ų | 130 | 118.7 Ų | 118.7 | 49% | 0.491 | 59% | 0.593 | S | S | . | * | P | Polyproline II helix | trans | -77.1 | 143.3 | 174.1 | -175.7 | -172.5 | 159.6 | 164.7 | -2.4 | 110.4 | E305 D310 E313 | E305-R307 PolarHBondContact O-N 3.15Å; R307-D310 IonicContact CZ-OD2 3.22Å; R307-D310 IonicContact NH2-OD2 2.7Å; R307-D310 PolarHBondContact NH2-OD2 2.86Å; R307-E313 VanDerWaalsContact CZ-CD 3.44Å; R307-E313 IonicContact CZ-OE1 2.79Å; R307-E313 IonicContact CZ-OE2 3.35Å; R307-E313 VanDerWaalsContact CZ-OE2 3.22Å; R307-E313 IonicContact NH1-OE1 2.64Å; R307-E313 PolarHBondContact NH1-OE1 3.26Å; R307-E313 VanDerWaalsContact NH1-OE1 3.08Å; R307-E313 IonicContact NH1-OE2 3.9Å; R307-E313 PolarHBondContact NH1-OE2 3.13Å; R307-E313 IonicContact NH2-OE1 2.76Å; R307-E313 PolarHBondContact NH2-OE1 3.46Å; R307-E313 IonicContact NH2-OE2 3.22Å; R307-E313 PolarHBondContact NH2-OE2 3.01Å |
| 308 | P | 87.4 | Confident | 78.1 | Confident | 108 Ų | 108 | 119.4 Ų | 119.4 | 70% | 0.701 | 60% | 0.604 | S | S | * | * | P | Polyproline II helix | trans | -63.9 | 154.5 | 169.7 | 27.9 | -35.2 | 0 | 0 | 0 | 111.4 | D310 | P308-D310 PolarHBondContact O-N 3.38Š|
| 309 | F | 84.9 | Confident | 77.8 | Confident | 141 Ų | 141 | 122.5 Ų | 122.5 | 62% | 0.618 | 61% | 0.612 | S | S | * | * | P | Polyproline II helix | trans | -58.4 | 122.9 | -179.8 | -176.6 | -93.1 | 0 | 0 | 0 | 110.8 | R311 D314 L315 | F309-R311 HydrophobicContact CE1-CB 4.49Å; F309-D314 WeakPolarHBondContact CA-OD2 3.44Å; F309-D314 HydrophobicContact CD2-CB 3.57Å; F309-D314 VanDerWaalsContact CD2-OD2 3.22Å; F309-D314 WeakPolarHBondContact CD2-OD2 3.38Å; F309-D314 HydrophobicContact CE1-CB 4.39Å; F309-D314 HydrophobicContact CE2-CB 3.23Å; F309-D314 HydrophobicContact CG-CB 4.3Å; F309-D314 HydrophobicContact CZ-CB 3.69Å; F309-L315 HydrophobicContact CZ-CB 4.17Å; F309-L315 HydrophobicContact CZ-CD1 4.15Å |
| 310 | D | 84.2 | Confident | 77.5 | Confident | 53 Ų | 53 | 125.9 Ų | 125.9 | 28% | 0.283 | 62% | 0.619 | S | S | . | * | trans | -106.9 | 115.9 | 174.5 | -172.2 | -24.1 | 0 | 0 | 0 | 108.6 | R307 P308 D312 E313 D314 | R307-D310 IonicContact CZ-OD2 3.22Å; R307-D310 IonicContact NH2-OD2 2.7Å; R307-D310 PolarHBondContact NH2-OD2 2.86Å; P308-D310 PolarHBondContact O-N 3.38Å; D310-D312 PolarHBondContact O-N 2.82Å; D310-D312 VanDerWaalsContact O-N 3.14Å; D310-D312 PolarHBondContact OD1-N 3.13Å; D310-E313 HydrophobicContact CB-CB 4.28Å; D310-E313 PolarHBondContact O-N 2.98Å; D310-D314 PolarHBondContact N-OD2 2.65Å; D310-D314 WeakPolarHBondContact O-CA 3.41Å; D310-D314 WeakPolarHBondContact O-CB 3.43Å; D310-D314 PolarHBondContact O-N 2.8Å | ||
| 311 | R | 84.8 | Confident | 78 | Confident | 161 Ų | 161 | 126.5 Ų | 126.5 | 61% | 0.608 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -55.5 | -35 | -180 | -178.5 | -177 | 158.9 | 87.1 | 3.9 | 111.7 | F309 L315 | F309-R311 HydrophobicContact CE1-CB 4.49Å; R311-L315 HydrophobicContact CG-CB 4.02Å; R311-L315 HydrophobicContact CG-CD2 4.03Å; R311-L315 VanDerWaalsContact NH1-CD2 3.35Å; R311-L315 CarbonylContact O-C 3.38Å; R311-L315 VanDerWaalsContact O-CA 3.23Å; R311-L315 WeakPolarHBondContact O-CA 3.19Å; R311-L315 WeakPolarHBondContact O-CB 3.49Å; R311-L315 PolarHBondContact O-N 2.9Å |
| 312 | D | 78.9 | Confident | 78.4 | Confident | 100 Ų | 100 | 126.6 Ų | 126.6 | 54% | 0.535 | 61% | 0.608 | S | S | . | * | H | α-helix | trans | -76.7 | -37.6 | -176.5 | -80.7 | -14.8 | 0 | 0 | 0 | 112.2 | D310 R319 | D310-D312 PolarHBondContact O-N 2.82Å; D310-D312 VanDerWaalsContact O-N 3.14Å; D310-D312 PolarHBondContact OD1-N 3.13Å; D312-R319 PolarHBondContact O-NE 3.13Å; D312-R319 PolarHBondContact O-NH1 3.34Å; D312-R319 PolarHBondContact O-NH2 3.33Å |
| 313 | E | 80 | Confident | 78.8 | Confident | 95 Ų | 95 | 123.3 Ų | 123.3 | 44% | 0.444 | 60% | 0.602 | S | S | . | * | H | α-helix | trans | -86.6 | -38.9 | 179.5 | -69.1 | -172.6 | -151.7 | 0 | 0 | 113.4 | R307 D310 | R307-E313 VanDerWaalsContact CZ-CD 3.44Å; R307-E313 IonicContact CZ-OE1 2.79Å; R307-E313 IonicContact CZ-OE2 3.35Å; R307-E313 VanDerWaalsContact CZ-OE2 3.22Å; R307-E313 IonicContact NH1-OE1 2.64Å; R307-E313 PolarHBondContact NH1-OE1 3.26Å; R307-E313 VanDerWaalsContact NH1-OE1 3.08Å; R307-E313 IonicContact NH1-OE2 3.9Å; R307-E313 PolarHBondContact NH1-OE2 3.13Å; R307-E313 IonicContact NH2-OE1 2.76Å; R307-E313 PolarHBondContact NH2-OE1 3.46Å; R307-E313 IonicContact NH2-OE2 3.22Å; R307-E313 PolarHBondContact NH2-OE2 3.01Å; D310-E313 HydrophobicContact CB-CB 4.28Å; D310-E313 PolarHBondContact O-N 2.98Å |
| 314 | D | 81.3 | Confident | 79.5 | Confident | 82 Ų | 82 | 122.9 Ų | 122.9 | 44% | 0.439 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -92.1 | -33.7 | -173.6 | -57.6 | -23.8 | 0 | 0 | 0 | 111.8 | F309 D310 Q316 | F309-D314 WeakPolarHBondContact CA-OD2 3.44Å; F309-D314 HydrophobicContact CD2-CB 3.57Å; F309-D314 VanDerWaalsContact CD2-OD2 3.22Å; F309-D314 WeakPolarHBondContact CD2-OD2 3.38Å; F309-D314 HydrophobicContact CE1-CB 4.39Å; F309-D314 HydrophobicContact CE2-CB 3.23Å; F309-D314 HydrophobicContact CG-CB 4.3Å; F309-D314 HydrophobicContact CZ-CB 3.69Å; D310-D314 PolarHBondContact N-OD2 2.65Å; D310-D314 WeakPolarHBondContact O-CA 3.41Å; D310-D314 WeakPolarHBondContact O-CB 3.43Å; D310-D314 PolarHBondContact O-N 2.8Å; D314-Q316 PolarHBondContact O-N 3.1Å |
| 315 | L | 80 | Confident | 80.2 | Confident | 71 Ų | 71 | 122.3 Ų | 122.3 | 37% | 0.372 | 58% | 0.576 | S | S | . | * | S | Bend | trans | -97.6 | 80.4 | 173.8 | -147 | 76.6 | 0 | 0 | 0 | 108.3 | F309 R311 V317 | F309-L315 HydrophobicContact CZ-CB 4.17Å; F309-L315 HydrophobicContact CZ-CD1 4.15Å; R311-L315 HydrophobicContact CG-CB 4.02Å; R311-L315 HydrophobicContact CG-CD2 4.03Å; R311-L315 VanDerWaalsContact NH1-CD2 3.35Å; R311-L315 CarbonylContact O-C 3.38Å; R311-L315 VanDerWaalsContact O-CA 3.23Å; R311-L315 WeakPolarHBondContact O-CA 3.19Å; R311-L315 WeakPolarHBondContact O-CB 3.49Å; R311-L315 PolarHBondContact O-N 2.9Å; L315-V317 HydrophobicContact CB-CG2 4.16Å; L315-V317 HydrophobicContact CD2-CG2 3.62Å; L315-V317 HydrophobicContact CG-CG2 3.45Å; L315-V317 VanDerWaalsContact CG-CG2 3.45Å; L315-V317 PolarHBondContact O-N 3.38Å |
| 316 | Q | 71.6 | Confident | 80.6 | Confident | 155 Ų | 155 | 118.8 Ų | 118.8 | 72% | 0.724 | 56% | 0.559 | S | S | * | * | trans | -67.3 | 46 | 178.7 | -60.2 | -179.4 | -9.4 | 0 | 0 | 113.5 | D314 | D314-Q316 PolarHBondContact O-N 3.1Š| ||
| 317 | V | 73.3 | Confident | 81 | Confident | 80 Ų | 80 | 114.5 Ų | 114.5 | 49% | 0.485 | 54% | 0.543 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -79.1 | 126.2 | 179.8 | -158.7 | 0 | 0 | 0 | 0 | 108.7 | L315 R319 | L315-V317 HydrophobicContact CB-CG2 4.16Å; L315-V317 HydrophobicContact CD2-CG2 3.62Å; L315-V317 HydrophobicContact CG-CG2 3.45Å; L315-V317 VanDerWaalsContact CG-CG2 3.45Å; L315-V317 PolarHBondContact O-N 3.38Å; V317-R319 PolarHBondContact O-N 2.86Å |
| 318 | N | 69.7 | Low | 81.4 | Confident | 159 Ų | 159 | 114 Ų | 114 | 85% | 0.85 | 55% | 0.549 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 61.7 | 18 | 175.7 | -57.9 | -22.1 | 0 | 0 | 0 | 116.3 | ||
| 319 | R | 74.6 | Confident | 81.3 | Confident | 141 Ų | 141 | 113.4 Ų | 113.4 | 53% | 0.532 | 54% | 0.54 | S | S | . | . | P | Polyproline II helix | trans | -77.9 | 135.7 | 167.6 | -67.3 | -168.9 | 168.5 | -172.9 | -4.6 | 109.3 | D312 V317 D321 | D312-R319 PolarHBondContact O-NE 3.13Å; D312-R319 PolarHBondContact O-NH1 3.34Å; D312-R319 PolarHBondContact O-NH2 3.33Å; V317-R319 PolarHBondContact O-N 2.86Å; R319-D321 PolarHBondContact O-N 3.32Å |
| 320 | F | 69.7 | Low | 81.5 | Confident | 162 Ų | 162 | 112.7 Ų | 112.7 | 71% | 0.711 | 54% | 0.536 | S | S | * | . | P | Polyproline II helix | trans | -55.9 | 125.9 | 166.5 | -88.1 | -84.2 | 0 | 0 | 0 | 108.1 | E322 Q324 | F320-E322 PolarHBondContact O-N 3.06Å; F320-Q324 HydrophobicContact CD1-CB 4.21Å |
| 321 | D | 84.4 | Confident | 81.7 | Confident | 92 Ų | 92 | 116 Ų | 116 | 49% | 0.492 | 55% | 0.548 | S | S | . | . | P | Polyproline II helix | trans | -47.3 | 133.7 | 170.3 | 173 | 8.2 | 0 | 0 | 0 | 108.7 | R319 A323 Q324 K325 | R319-D321 PolarHBondContact O-N 3.32Å; D321-A323 PolarHBondContact O-N 2.92Å; D321-A323 VanDerWaalsContact O-N 3.13Å; D321-A323 PolarHBondContact OD1-N 3.29Å; D321-A323 VanDerWaalsContact OD1-N 3.11Å; D321-Q324 HydrophobicContact CB-CB 4.29Å; D321-Q324 HydrophobicContact CB-CG 3.94Å; D321-Q324 WeakPolarHBondContact O-CA 3.38Å; D321-Q324 WeakPolarHBondContact O-CB 3.47Å; D321-Q324 PolarHBondContact O-N 3.05Å; D321-K325 PolarHBondContact O-N 3.02Å |
| 322 | E | 83.1 | Confident | 81.8 | Confident | 141 Ų | 141 | 111.1 Ų | 111.1 | 66% | 0.659 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -55.8 | -34.8 | -177.7 | -169.5 | 170.9 | -172.6 | 0 | 0 | 110.3 | F320 Q324 K325 Q326 | F320-E322 PolarHBondContact O-N 3.06Å; E322-Q324 PolarHBondContact O-N 3.09Å; E322-K325 PolarHBondContact O-N 3.24Å; E322-Q326 HydrophobicContact CG-CG 4.42Å; E322-Q326 WeakPolarHBondContact O-CB 2.94Å; E322-Q326 WeakPolarHBondContact O-CG 3.44Å; E322-Q326 PolarHBondContact O-N 2.86Å |
| 323 | A | 84 | Confident | 82.1 | Confident | 44 Ų | 44 | 113.4 Ų | 113.4 | 36% | 0.364 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -62.7 | -39 | 173.1 | 0 | 0 | 0 | 0 | 0 | 112.8 | D321 R327 | D321-A323 PolarHBondContact O-N 2.92Å; D321-A323 VanDerWaalsContact O-N 3.13Å; D321-A323 PolarHBondContact OD1-N 3.29Å; D321-A323 VanDerWaalsContact OD1-N 3.11Å; A323-R327 WeakPolarHBondContact O-CB 3.34Å; A323-R327 WeakPolarHBondContact O-CG 3.33Å; A323-R327 PolarHBondContact O-N 3.33Å |
| 324 | Q | 85.4 | Confident | 82.2 | Confident | 98 Ų | 98 | 113.6 Ų | 113.6 | 46% | 0.458 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -68.2 | -41.3 | 175.6 | -66.3 | -178.5 | 7.3 | 0 | 0 | 111.5 | F320 D321 E322 R327 L328 | F320-Q324 HydrophobicContact CD1-CB 4.21Å; D321-Q324 HydrophobicContact CB-CB 4.29Å; D321-Q324 HydrophobicContact CB-CG 3.94Å; D321-Q324 WeakPolarHBondContact O-CA 3.38Å; D321-Q324 WeakPolarHBondContact O-CB 3.47Å; D321-Q324 PolarHBondContact O-N 3.05Å; E322-Q324 PolarHBondContact O-N 3.09Å; Q324-R327 PolarHBondContact O-N 3.32Å; Q324-L328 PolarHBondContact O-N 2.77Å |
| 325 | K | 87.9 | Confident | 82.2 | Confident | 139 Ų | 139 | 113.9 Ų | 113.9 | 60% | 0.604 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -60.3 | -48 | 174.6 | -174.9 | -179.9 | 178.9 | -179.9 | 0 | 111.4 | D321 E322 R327 L328 L329 | D321-K325 PolarHBondContact O-N 3.02Å; E322-K325 PolarHBondContact O-N 3.24Å; K325-R327 VanDerWaalsContact C-N 3.33Å; K325-R327 PolarHBondContact O-N 3.38Å; K325-L328 PolarHBondContact O-N 3.09Å; K325-L329 PolarHBondContact O-N 2.96Å |
| 326 | Q | 87.2 | Confident | 82.1 | Confident | 85 Ų | 85 | 117.5 Ų | 117.5 | 40% | 0.397 | 57% | 0.568 | S | S | . | * | H | α-helix | trans | -63.4 | -38.5 | 177 | -65.6 | -63.9 | -12.1 | 0 | 0 | 111.8 | E322 L329 K330 | E322-Q326 HydrophobicContact CG-CG 4.42Å; E322-Q326 WeakPolarHBondContact O-CB 2.94Å; E322-Q326 WeakPolarHBondContact O-CG 3.44Å; E322-Q326 PolarHBondContact O-N 2.86Å; Q326-L329 PolarHBondContact O-N 2.85Å; Q326-K330 WeakPolarHBondContact O-CB 3.48Å; Q326-K330 VanDerWaalsContact O-CG 3.3Å; Q326-K330 WeakPolarHBondContact O-CG 3.38Å; Q326-K330 PolarHBondContact O-N 3Å |
| 327 | R | 87.6 | Confident | 82.3 | Confident | 167 Ų | 167 | 114 Ų | 114 | 63% | 0.63 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -63.4 | -43 | 174.4 | -77.6 | 170 | -179.5 | -178.1 | 3.1 | 112 | A323 Q324 K325 K330 K331 | A323-R327 WeakPolarHBondContact O-CB 3.34Å; A323-R327 WeakPolarHBondContact O-CG 3.33Å; A323-R327 PolarHBondContact O-N 3.33Å; Q324-R327 PolarHBondContact O-N 3.32Å; K325-R327 VanDerWaalsContact C-N 3.33Å; K325-R327 PolarHBondContact O-N 3.38Å; R327-K330 PolarHBondContact O-N 3.39Å; R327-K331 WeakPolarHBondContact O-CB 3.11Å; R327-K331 VanDerWaalsContact O-CG 3.22Å; R327-K331 WeakPolarHBondContact O-CG 3.48Å; R327-K331 PolarHBondContact O-N 3.42Å |
| 328 | L | 88.4 | Confident | 82.3 | Confident | 120 Ų | 120 | 115.4 Ų | 115.4 | 63% | 0.628 | 55% | 0.554 | S | S | * | * | H | α-helix | trans | -63.9 | -43.7 | 177.1 | -174.7 | 63.9 | 0 | 0 | 0 | 111 | Q324 K325 K331 S332 | Q324-L328 PolarHBondContact O-N 2.77Å; K325-L328 PolarHBondContact O-N 3.09Å; L328-K331 PolarHBondContact O-N 3.18Å; L328-S332 PolarHBondContact O-N 3.13Å |
| 329 | L | 86.6 | Confident | 82.3 | Confident | 96 Ų | 96 | 116.3 Ų | 116.3 | 50% | 0.503 | 55% | 0.55 | S | S | . | * | H | α-helix | trans | -59.7 | -48.8 | 176.3 | -161.4 | 93.7 | 0 | 0 | 0 | 111.5 | K325 Q326 K331 S332 Q333 | K325-L329 PolarHBondContact O-N 2.96Å; Q326-L329 PolarHBondContact O-N 2.85Å; L329-K331 PolarHBondContact O-N 3.32Å; L329-S332 PolarHBondContact O-N 3.25Å; L329-S332 VanDerWaalsContact O-N 3.13Å; L329-S332 PolarHBondContact O-OG 2.95Å; L329-Q333 PolarHBondContact O-N 3.44Å |
| 330 | K | 88.6 | Confident | 82 | Confident | 125 Ų | 125 | 112.4 Ų | 112.4 | 54% | 0.543 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -60.2 | -46 | 176.9 | -73.9 | 177.8 | -179.5 | -174.7 | 0 | 112.1 | Q326 R327 S332 Q333 E334 | Q326-K330 WeakPolarHBondContact O-CB 3.48Å; Q326-K330 VanDerWaalsContact O-CG 3.3Å; Q326-K330 WeakPolarHBondContact O-CG 3.38Å; Q326-K330 PolarHBondContact O-N 3Å; R327-K330 PolarHBondContact O-N 3.39Å; K330-S332 PolarHBondContact O-N 2.88Å; K330-Q333 WeakPolarHBondContact O-CB 3.48Å; K330-Q333 PolarHBondContact O-N 2.99Å; K330-Q333 VanDerWaalsContact O-N 3.15Å; K330-E334 WeakPolarHBondContact O-CG 3.3Å; K330-E334 PolarHBondContact O-N 3.48Å; K330-E334 VanDerWaalsContact O-N 3.12Å |
| 331 | K | 88.6 | Confident | 81.7 | Confident | 123 Ų | 123 | 113.7 Ų | 113.7 | 54% | 0.535 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -57.5 | -37.7 | 174.9 | -75.7 | 172.5 | -178.1 | -179.7 | 0 | 112.3 | R327 L328 L329 | R327-K331 WeakPolarHBondContact O-CB 3.11Å; R327-K331 VanDerWaalsContact O-CG 3.22Å; R327-K331 WeakPolarHBondContact O-CG 3.48Å; R327-K331 PolarHBondContact O-N 3.42Å; L328-K331 PolarHBondContact O-N 3.18Å; L329-K331 PolarHBondContact O-N 3.32Å |
| 332 | S | 87.1 | Confident | 80.3 | Confident | 59 Ų | 59 | 111.4 Ų | 111.4 | 41% | 0.413 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -71.9 | -37.3 | 178.1 | 77 | 0 | 0 | 0 | 0 | 112.5 | L328 L329 K330 E334 L335 | L328-S332 PolarHBondContact O-N 3.13Å; L329-S332 PolarHBondContact O-N 3.25Å; L329-S332 VanDerWaalsContact O-N 3.13Å; L329-S332 PolarHBondContact O-OG 2.95Å; K330-S332 PolarHBondContact O-N 2.88Å; S332-E334 VanDerWaalsContact C-N 3.27Å; S332-E334 PolarHBondContact O-N 3.19Å; S332-L335 VanDerWaalsContact O-CB 3.31Å; S332-L335 WeakPolarHBondContact O-CB 3.36Å; S332-L335 WeakPolarHBondContact O-CG 3.45Å; S332-L335 PolarHBondContact O-N 2.91Å; S332-L335 VanDerWaalsContact O-N 3.13Å |
| 333 | Q | 85.1 | Confident | 79.1 | Confident | 147 Ų | 147 | 110.7 Ų | 110.7 | 69% | 0.687 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -62.1 | -38.1 | 176.5 | -174.9 | 177.9 | 0.3 | 0 | 0 | 111.4 | L329 K330 L335 | L329-Q333 PolarHBondContact O-N 3.44Å; K330-Q333 WeakPolarHBondContact O-CB 3.48Å; K330-Q333 PolarHBondContact O-N 2.99Å; K330-Q333 VanDerWaalsContact O-N 3.15Å; Q333-L335 VanDerWaalsContact C-N 3.26Å; Q333-L335 PolarHBondContact O-N 3.32Å |
| 334 | E | 81.2 | Confident | 77.8 | Confident | 99 Ų | 99 | 115.6 Ų | 115.6 | 46% | 0.463 | 56% | 0.559 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -75.4 | -6.2 | 178.5 | -67.2 | 167.3 | -165.2 | 0 | 0 | 113.4 | K330 S332 N336 T337 R338 | K330-E334 WeakPolarHBondContact O-CG 3.3Å; K330-E334 PolarHBondContact O-N 3.48Å; K330-E334 VanDerWaalsContact O-N 3.12Å; S332-E334 VanDerWaalsContact C-N 3.27Å; S332-E334 PolarHBondContact O-N 3.19Å; E334-N336 PolarHBondContact O-N 2.88Å; E334-T337 CarbonylContact O-C 3.57Å; E334-T337 PolarHBondContact O-N 3.16Å; E334-T337 PolarHBondContact O-OG1 3.12Å; E334-T337 VanDerWaalsContact O-OG1 3.06Å; E334-R338 HydrophobicContact CB-CG 4.31Å; E334-R338 WeakPolarHBondContact O-CB 3.24Å; E334-R338 WeakPolarHBondContact O-CG 3.4Å; E334-R338 PolarHBondContact O-N 3.16Å |
| 335 | L | 81.5 | Confident | 76.5 | Confident | 88 Ų | 88 | 118.2 Ų | 118.2 | 46% | 0.461 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -57.6 | -35.5 | 179.4 | -70.1 | 169.7 | 0 | 0 | 0 | 113.2 | S332 Q333 T337 | S332-L335 VanDerWaalsContact O-CB 3.31Å; S332-L335 WeakPolarHBondContact O-CB 3.36Å; S332-L335 WeakPolarHBondContact O-CG 3.45Å; S332-L335 PolarHBondContact O-N 2.91Å; S332-L335 VanDerWaalsContact O-N 3.13Å; Q333-L335 VanDerWaalsContact C-N 3.26Å; Q333-L335 PolarHBondContact O-N 3.32Å; L335-T337 VanDerWaalsContact C-N 3.25Å; L335-T337 PolarHBondContact O-N 3.3Å |
| 336 | N | 78 | Confident | 74.7 | Confident | 147 Ų | 147 | 119.9 Ų | 119.9 | 79% | 0.786 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -66.4 | -27.7 | 177 | -68.6 | -49.1 | 0 | 0 | 0 | 112.9 | E334 | E334-N336 PolarHBondContact O-N 2.88Å |
| 337 | T | 76.3 | Confident | 73 | Confident | 81 Ų | 81 | 122.3 Ų | 122.3 | 50% | 0.497 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -102.7 | -15.4 | -179.8 | 59.6 | 0 | 0 | 0 | 0 | 113 | E334 L335 F339 S340 | E334-T337 CarbonylContact O-C 3.57Å; E334-T337 PolarHBondContact O-N 3.16Å; E334-T337 PolarHBondContact O-OG1 3.12Å; E334-T337 VanDerWaalsContact O-OG1 3.06Å; L335-T337 VanDerWaalsContact C-N 3.25Å; L335-T337 PolarHBondContact O-N 3.3Å; T337-F339 PolarHBondContact O-N 2.87Å; T337-S340 VanDerWaalsContact CA-OG 3.31Å; T337-S340 WeakPolarHBondContact CA-OG 3.39Å; T337-S340 WeakPolarHBondContact O-CA 3.3Å; T337-S340 WeakPolarHBondContact O-CB 3.49Å; T337-S340 PolarHBondContact O-N 3.08Å; T337-S340 VanDerWaalsContact O-O 3.11Å; T337-S340 PolarHBondContact O-OG 3.35Å |
| 338 | R | 73.2 | Confident | 71 | Confident | 111 Ų | 111 | 125.3 Ų | 125.3 | 42% | 0.419 | 61% | 0.613 | S | S | . | * | H | α-helix | trans | -62 | -27.4 | 179 | -83.1 | 168 | 68.4 | 98.1 | 7 | 113.9 | E334 | E334-R338 HydrophobicContact CB-CG 4.31Å; E334-R338 WeakPolarHBondContact O-CB 3.24Å; E334-R338 WeakPolarHBondContact O-CG 3.4Å; E334-R338 PolarHBondContact O-N 3.16Å |
| 339 | F | 70.1 | Confident | 70.2 | Confident | 177 Ų | 177 | 125.6 Ų | 125.6 | 78% | 0.776 | 61% | 0.612 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -98.5 | -7.3 | 173.1 | -60.2 | -75.8 | 0 | 0 | 0 | 113 | T337 | T337-F339 PolarHBondContact O-N 2.87Š|
| 340 | S | 68.5 | Low | 69.3 | Low | 59 Ų | 59 | 127.1 Ų | 127.1 | 41% | 0.413 | 62% | 0.618 | S | S | . | * | S | Bend | trans | -76.5 | 155.1 | 164.7 | 78.3 | 0 | 0 | 0 | 0 | 109.1 | T337 S342 | T337-S340 VanDerWaalsContact CA-OG 3.31Å; T337-S340 WeakPolarHBondContact CA-OG 3.39Å; T337-S340 WeakPolarHBondContact O-CA 3.3Å; T337-S340 WeakPolarHBondContact O-CB 3.49Å; T337-S340 PolarHBondContact O-N 3.08Å; T337-S340 VanDerWaalsContact O-O 3.11Å; T337-S340 PolarHBondContact O-OG 3.35Å; S340-S342 PolarHBondContact O-N 3.47Å |
| 341 | H | 62.2 | Low | 68.2 | Low | 189 Ų | 189 | 127.2 Ų | 127.2 | 88% | 0.875 | 62% | 0.622 | S | S | * | * | trans | -42.5 | 96.1 | -176.6 | -59.8 | 84.6 | 0 | 0 | 0 | 112.8 | ||||
| 342 | S | 56.5 | Low | 67 | Low | 45 Ų | 45 | 127.5 Ų | 127.5 | 32% | 0.315 | 63% | 0.628 | S | S | . | * | trans | -92.7 | 138.4 | -178.1 | 87.1 | 0 | 0 | 0 | 0 | 109.9 | S340 D344 R345 | S340-S342 PolarHBondContact O-N 3.47Å; S342-D344 PolarHBondContact O-N 3.03Å; S342-R345 PolarHBondContact OG-N 2.99Å; S342-R345 PolarHBondContact OG-O 3.17Å | ||
| 343 | K | 57.8 | Low | 65.8 | Low | 126 Ų | 126 | 131.8 Ų | 131.8 | 55% | 0.548 | 64% | 0.641 | S | S | . | * | S | Bend | trans | -55.6 | -30.7 | -178.2 | -170.1 | 177.5 | 177.8 | -177.2 | 0 | 113.5 | D256 P259 | D256-K343 IonicContact OD1-NZ 2.9Å; D256-K343 PolarHBondContact OD1-NZ 3.36Å; P259-K343 HydrophobicContact CG-CB 3.92Å; P259-K343 HydrophobicContact CG-CD 4.03Å; P259-K343 HydrophobicContact CG-CG 3.9Å |
| 344 | D | 55.8 | Low | 64.5 | Low | 147 Ų | 147 | 130.7 Ų | 130.7 | 79% | 0.786 | 64% | 0.638 | S | S | * | * | S | Bend | trans | -106.9 | -17.8 | -168.1 | -75.7 | -10.3 | 0 | 0 | 0 | 114.5 | S342 | S342-D344 PolarHBondContact O-N 3.03Š|
| 345 | R | 57.4 | Low | 63.3 | Low | 153 Ų | 153 | 133 Ų | 133 | 58% | 0.577 | 65% | 0.65 | S | S | * | * | trans | -144.4 | 110.1 | 175.8 | -71 | -168.8 | -74.6 | -168.2 | -0.8 | 110.4 | S342 F347 | S342-R345 PolarHBondContact OG-N 2.99Å; S342-R345 PolarHBondContact OG-O 3.17Å; R345-F347 HydrophobicContact CB-CD2 4.16Å; R345-F347 HydrophobicContact CB-CE2 3.7Å; R345-F347 HydrophobicContact CB-CZ 3.97Å; R345-F347 PolarHBondContact O-N 2.97Å | ||
| 346 | M | 50.5 | Low | 61.9 | Low | 174 Ų | 174 | 136.5 Ų | 136.5 | 86% | 0.857 | 67% | 0.665 | S | S | * | * | trans | -73.9 | 101.2 | 159 | -62.2 | -160.5 | -64.2 | 0 | 0 | 106.6 | L348 | M346-L348 PolarHBondContact O-N 3.06Š| ||
| 347 | F | 52.7 | Low | 60.5 | Low | 135 Ų | 135 | 135.6 Ų | 135.6 | 59% | 0.592 | 66% | 0.655 | S | S | * | * | trans | -78.7 | 101 | 162.2 | -63.9 | -79.9 | 0 | 0 | 0 | 105.7 | R345 | R345-F347 HydrophobicContact CB-CD2 4.16Å; R345-F347 HydrophobicContact CB-CE2 3.7Å; R345-F347 HydrophobicContact CB-CZ 3.97Å; R345-F347 PolarHBondContact O-N 2.97Å | ||
| 348 | L | 45.5 | Very low | 59.1 | Low | 230 Ų | 230 | 140.5 Ų | 140.5 | 100% | 1.204 | 67% | 0.669 | S | S | * | * | trans | -88.2 | 0 | 165.5 | -132.4 | 87 | 0 | 0 | 0 | 108.9 | M346 | M346-L348 PolarHBondContact O-N 3.06Š|
Retrieved 348 of 348 residues in 618.6 ms
(Link to these results)