| 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 | 61.1 | Low | 55.4 | Low | 240 Ų | 240 | 144.5 Ų | 144.5 | 100% | 1.182 | 82% | 0.824 | S | S | * | * | 0 | 114.6 | 0 | -72.7 | 72.4 | 173.5 | 0 | 0 | 108.1 | |||||
| 2 | N | 50.5 | Low | 56 | Low | 160 Ų | 160 | 139.8 Ų | 139.8 | 86% | 0.856 | 82% | 0.817 | S | S | * | * | trans | -81.7 | 128.8 | 169.3 | -74.9 | -43.2 | 0 | 0 | 0 | 108.4 | ||||
| 3 | Y | 50.7 | Low | 55 | Low | 234 Ų | 234 | 145 Ų | 145 | 92% | 0.918 | 82% | 0.816 | S | S | * | * | trans | -150.7 | 125.7 | 151.1 | -109.7 | -83.6 | 0 | 0 | 0 | 110.1 | ||||
| 4 | S | 58.2 | Low | 56 | Low | 116 Ų | 116 | 141.7 Ų | 141.7 | 81% | 0.811 | 80% | 0.804 | S | S | * | * | trans | -36 | 155.7 | 165.7 | -47.7 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 5 | G | 54.2 | Low | 56.1 | Low | 59 Ų | 59 | 141.9 Ų | 141.9 | 61% | 0.608 | 80% | 0.802 | S | S | * | * | cis | 141.8 | 159.7 | 28.4 | 0 | 0 | 0 | 0 | 0 | 107.4 | ||||
| 6 | Y | 56.2 | Low | 55.4 | Low | 230 Ų | 230 | 146.5 Ų | 146.5 | 90% | 0.902 | 81% | 0.805 | S | S | * | * | trans | 83 | 81.7 | 177.4 | -50.9 | -71.9 | 0 | 0 | 0 | 117.1 | ||||
| 7 | S | 55.5 | Low | 55.3 | Low | 116 Ų | 116 | 143.4 Ų | 143.4 | 81% | 0.811 | 80% | 0.796 | S | S | * | * | trans | -93.5 | 115.2 | 148.3 | 169.9 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 8 | S | 58.8 | Low | 55.3 | Low | 115 Ų | 115 | 146.2 Ų | 146.2 | 80% | 0.804 | 80% | 0.802 | S | S | * | * | trans | -103 | 118.6 | 170.1 | -71.9 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 9 | S | 61.3 | Low | 55.1 | Low | 104 Ų | 104 | 148.2 Ų | 148.2 | 73% | 0.727 | 81% | 0.805 | S | S | * | * | trans | -126.6 | 168.7 | 164.1 | -74.9 | 0 | 0 | 0 | 0 | 107.4 | ||||
| 10 | P | 56.3 | Low | 55.2 | Low | 114 Ų | 114 | 148.6 Ų | 148.6 | 74% | 0.74 | 81% | 0.805 | S | S | * | * | cis | -131.5 | 146.6 | -48.4 | 34.1 | -18.9 | 0 | 0 | 0 | 110.4 | ||||
| 11 | S | 47.2 | Very low | 55 | Low | 101 Ų | 101 | 148.6 Ų | 148.6 | 71% | 0.706 | 81% | 0.805 | S | S | * | * | trans | -97.7 | 86.4 | 168.5 | 173.3 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 12 | A | 62 | Low | 54.9 | Low | 89 Ų | 89 | 141.4 Ų | 141.4 | 74% | 0.736 | 78% | 0.784 | S | S | * | * | trans | -96.2 | 109.4 | 168.6 | 0 | 0 | 0 | 0 | 0 | 109 | ||||
| 13 | Y | 43.3 | Very low | 54.8 | Low | 207 Ų | 207 | 141.4 Ų | 141.4 | 81% | 0.812 | 78% | 0.784 | S | S | * | * | trans | -71.3 | 132.3 | 168.3 | -74.9 | -89.3 | 0 | 0 | 0 | 109.4 | N15 | Y13-N15 PolarHBondContact O-N 3.17Š| ||
| 14 | P | 68.1 | Low | 54.9 | Low | 99 Ų | 99 | 136.9 Ų | 136.9 | 64% | 0.643 | 78% | 0.78 | S | S | * | * | trans | -72.5 | 124.4 | 173.1 | 26.2 | -29.8 | 0 | 0 | 0 | 110.9 | Y16 | P14-Y16 HydrophobicContact CB-CE2 4.38Å; P14-Y16 HydrophobicContact CG-CE2 4.2Å | ||
| 15 | N | 57.5 | Low | 54.8 | Low | 145 Ų | 145 | 136.7 Ų | 136.7 | 78% | 0.775 | 78% | 0.779 | S | S | * | * | trans | -72.7 | 116 | 168.6 | -174.3 | -36.1 | 0 | 0 | 0 | 108.6 | Y13 S17 | Y13-N15 PolarHBondContact O-N 3.17Å; N15-S17 WeakPolarHBondContact OD1-CB 3.41Å; N15-S17 PolarHBondContact OD1-N 2.8Å | ||
| 16 | Y | 44.8 | Very low | 54.7 | Low | 215 Ų | 215 | 140.6 Ų | 140.6 | 84% | 0.843 | 79% | 0.791 | S | S | * | * | trans | -97.5 | 89.4 | 171.2 | -80.2 | -86 | 0 | 0 | 0 | 109.1 | P14 | P14-Y16 HydrophobicContact CB-CE2 4.38Å; P14-Y16 HydrophobicContact CG-CE2 4.2Å | ||
| 17 | S | 54.4 | Low | 55 | Low | 93 Ų | 93 | 135.1 Ų | 135.1 | 65% | 0.65 | 78% | 0.783 | S | S | * | * | trans | -154.6 | 78.4 | 169.8 | -172.1 | 0 | 0 | 0 | 0 | 109.1 | N15 | N15-S17 WeakPolarHBondContact OD1-CB 3.41Å; N15-S17 PolarHBondContact OD1-N 2.8Å | ||
| 18 | E | 55.6 | Low | 54.8 | Low | 194 Ų | 194 | 135.4 Ų | 135.4 | 91% | 0.907 | 79% | 0.785 | S | S | * | * | trans | -175.8 | 148.3 | 153.8 | -107.8 | 178.6 | 126.2 | 0 | 0 | 110.3 | ||||
| 19 | Q | 51.6 | Low | 54.3 | Low | 185 Ų | 185 | 137.3 Ų | 137.3 | 86% | 0.864 | 79% | 0.787 | S | S | * | * | trans | 90.7 | 68.8 | 171.9 | -62.8 | -175.7 | -19.5 | 0 | 0 | 119.8 | ||||
| 20 | L | 57.1 | Low | 53.8 | Low | 155 Ų | 155 | 137.2 Ų | 137.2 | 81% | 0.812 | 78% | 0.781 | S | S | * | * | trans | -144.9 | 124.6 | 134.4 | -63.8 | 175.7 | 0 | 0 | 0 | 102.2 | ||||
| 21 | D | 51.3 | Low | 53.4 | Low | 150 Ų | 150 | 140.1 Ų | 140.1 | 80% | 0.802 | 78% | 0.784 | S | S | * | * | cis | -166.1 | 141.6 | 40.2 | -69.9 | -73.1 | 0 | 0 | 0 | 106.7 | ||||
| 22 | A | 58.3 | Low | 53.4 | Low | 89 Ų | 89 | 138.2 Ų | 138.2 | 74% | 0.736 | 78% | 0.781 | S | S | * | * | trans | -173 | 109.8 | 148.2 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 23 | N | 47.5 | Very low | 52.9 | Low | 159 Ų | 159 | 143 Ų | 143 | 85% | 0.85 | 79% | 0.788 | S | S | * | * | trans | 61.7 | 87.4 | 143 | -65.5 | -38.7 | 0 | 0 | 0 | 118.6 | ||||
| 24 | V | 53.6 | Low | 53.1 | Low | 139 Ų | 139 | 138.1 Ų | 138.1 | 84% | 0.842 | 78% | 0.784 | S | S | * | * | trans | -123.5 | 115.9 | 145.2 | 173.7 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 25 | S | 56.5 | Low | 51.7 | Low | 113 Ų | 113 | 144 Ų | 144 | 79% | 0.79 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -52.5 | 132.3 | 174.2 | -52.9 | 0 | 0 | 0 | 0 | 112.7 | ||
| 26 | V | 51.7 | Low | 51.9 | Low | 140 Ų | 140 | 143.2 Ų | 143.2 | 85% | 0.848 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -94.4 | 124.8 | 170.1 | -175.3 | 0 | 0 | 0 | 0 | 109.1 | ||
| 27 | P | 61.7 | Low | 52.4 | Low | 116 Ų | 116 | 138.9 Ų | 138.9 | 75% | 0.753 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -85.9 | 145.9 | 167.7 | 33 | -29.6 | 0 | 0 | 0 | 111.5 | ||
| 28 | S | 52.7 | Low | 52.6 | Low | 121 Ų | 121 | 141.9 Ų | 141.9 | 85% | 0.846 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -73.3 | 129.4 | 176.2 | -147 | 0 | 0 | 0 | 0 | 111.2 | ||
| 29 | N | 47.1 | Very low | 52.8 | Low | 156 Ų | 156 | 138.8 Ų | 138.8 | 83% | 0.834 | 80% | 0.795 | S | S | * | * | trans | -154.7 | 141.3 | 148.6 | -151.4 | -15.9 | 0 | 0 | 0 | 111.7 | ||||
| 30 | V | 51.4 | Low | 52.8 | Low | 101 Ų | 101 | 133.2 Ų | 133.2 | 61% | 0.612 | 79% | 0.787 | S | S | * | * | trans | -92.1 | 156.9 | -173.8 | -176 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 31 | H | 48.5 | Very low | 52.3 | Low | 175 Ų | 175 | 136.8 Ų | 136.8 | 81% | 0.81 | 79% | 0.792 | S | S | * | * | trans | 108.4 | 106.6 | 160 | -54.6 | 91.6 | 0 | 0 | 0 | 117.6 | ||||
| 32 | G | 45.8 | Very low | 52.8 | Low | 62 Ų | 62 | 135.3 Ų | 135.3 | 64% | 0.639 | 79% | 0.79 | S | S | * | * | 83.8 | 129.4 | 123.9 | 0 | 0 | 0 | 0 | 0 | 120.3 | |||||
| 33 | H | 52.8 | Low | 52.6 | Low | 188 Ų | 188 | 136.7 Ų | 136.7 | 87% | 0.87 | 79% | 0.794 | S | S | * | * | trans | 101.8 | 110.9 | 151.4 | -52 | -68.6 | 0 | 0 | 0 | 120 | ||||
| 34 | S | 47.7 | Very low | 52.7 | Low | 105 Ų | 105 | 137.8 Ų | 137.8 | 73% | 0.734 | 79% | 0.794 | S | S | * | * | trans | 54.6 | 118.6 | 140.9 | 71.7 | 0 | 0 | 0 | 0 | 122.9 | ||||
| 35 | Y | 38.9 | Very low | 52.3 | Low | 222 Ų | 222 | 140.1 Ų | 140.1 | 87% | 0.871 | 80% | 0.796 | S | S | * | * | trans | 19.1 | 118.7 | 139.2 | -70.6 | -88.6 | 0 | 0 | 0 | 120.6 | ||||
| 36 | T | 62 | Low | 52.3 | Low | 129 Ų | 129 | 139.5 Ų | 139.5 | 79% | 0.791 | 79% | 0.792 | S | S | * | * | -157.9 | 133.4 | 128 | 47.3 | 0 | 0 | 0 | 0 | 110 | |||||
| 37 | P | 53.6 | Low | 52.8 | Low | 125 Ų | 125 | 138.2 Ų | 138.2 | 81% | 0.812 | 79% | 0.787 | S | S | * | * | trans | -95.4 | 127 | 170.1 | 34.7 | -26.4 | 0 | 0 | 0 | 110.8 | ||||
| 38 | I | 59.2 | Low | 52.7 | Low | 156 Ų | 156 | 138.6 Ų | 138.6 | 80% | 0.8 | 79% | 0.789 | S | S | * | * | trans | -158 | 133.4 | -179.3 | -120.9 | 175.2 | 0 | 0 | 0 | 103.6 | ||||
| 39 | V | 59.2 | Low | 53.1 | Low | 128 Ų | 128 | 141.1 Ų | 141.1 | 78% | 0.776 | 79% | 0.785 | S | S | * | * | cis | -154.3 | 123.8 | 26 | -179.9 | 0 | 0 | 0 | 0 | 104.7 | ||||
| 40 | G | 52.7 | Low | 53.2 | Low | 68 Ų | 68 | 141.1 Ų | 141.1 | 70% | 0.701 | 78% | 0.78 | S | S | * | * | 80.8 | 80.8 | 97.8 | 0 | 0 | 0 | 0 | 0 | 113 | |||||
| 41 | Y | 46.6 | Very low | 52.9 | Low | 231 Ų | 231 | 144 Ų | 144 | 91% | 0.906 | 79% | 0.789 | S | S | * | * | trans | -70.4 | 134.7 | 158.7 | -83.9 | -90.4 | 0 | 0 | 0 | 108.5 | S43 | Y41-S43 PolarHBondContact O-N 3.18Š| ||
| 42 | P | 60.6 | Low | 52.8 | Low | 118 Ų | 118 | 143.8 Ų | 143.8 | 77% | 0.766 | 78% | 0.782 | S | S | * | * | trans | -67.2 | 103.8 | 167.7 | 27.4 | -30.3 | 0 | 0 | 0 | 108 | Q44 | P42-Q44 PolarHBondContact O-N 3.16Å; P42-Q44 VanDerWaalsContact O-N 3.08Å | ||
| 43 | S | 55.4 | Low | 53.1 | Low | 118 Ų | 118 | 147.5 Ų | 147.5 | 83% | 0.825 | 79% | 0.787 | S | S | * | * | trans | -57.5 | 110.7 | 166.3 | -117.9 | 0 | 0 | 0 | 0 | 107.7 | Y41 E45 | Y41-S43 PolarHBondContact O-N 3.18Å; S43-E45 PolarHBondContact O-N 2.88Å | ||
| 44 | Q | 48.4 | Very low | 52.4 | Low | 182 Ų | 182 | 145 Ų | 145 | 85% | 0.85 | 77% | 0.771 | S | S | * | * | trans | -62.8 | 102.3 | 170.1 | -74.6 | -108.7 | -14.9 | 0 | 0 | 108 | P42 S46 | P42-Q44 PolarHBondContact O-N 3.16Å; P42-Q44 VanDerWaalsContact O-N 3.08Å; Q44-S46 PolarHBondContact O-N 3.14Å | ||
| 45 | E | 46.2 | Very low | 52.7 | Low | 188 Ų | 188 | 145.9 Ų | 145.9 | 88% | 0.879 | 77% | 0.772 | S | S | * | * | trans | -56.3 | 107.1 | 172.1 | -165.8 | 173.8 | 146.3 | 0 | 0 | 108.2 | S43 | S43-E45 PolarHBondContact O-N 2.88Š| ||
| 46 | S | 55.6 | Low | 53.2 | Low | 101 Ų | 101 | 140.6 Ų | 140.6 | 71% | 0.706 | 76% | 0.763 | S | S | * | * | P | Polyproline II helix | trans | -70.3 | 132.5 | 178.3 | -57.6 | 0 | 0 | 0 | 0 | 108.4 | Q44 | Q44-S46 PolarHBondContact O-N 3.14Š|
| 47 | P | 63.3 | Low | 52.8 | Low | 113 Ų | 113 | 141.7 Ų | 141.7 | 73% | 0.734 | 77% | 0.769 | S | S | * | * | P | Polyproline II helix | trans | -58.8 | 145.6 | 179.6 | 22 | -31.1 | 0 | 0 | 0 | 110.8 | K49 | P47-K49 PolarHBondContact O-N 2.8Å; P47-K49 VanDerWaalsContact O-N 3.12Å |
| 48 | P | 59.8 | Low | 52.9 | Low | 124 Ų | 124 | 145.2 Ų | 145.2 | 81% | 0.805 | 77% | 0.774 | S | S | * | * | P | Polyproline II helix | trans | -58.8 | 119.9 | -175 | 22.9 | -32.7 | 0 | 0 | 0 | 110.2 | Q50 | P48-Q50 PolarHBondContact O-N 2.92Å; P48-Q50 VanDerWaalsContact O-N 3.08Å |
| 49 | K | 60.4 | Low | 52.7 | Low | 173 Ų | 173 | 146.1 Ų | 146.1 | 75% | 0.752 | 78% | 0.775 | S | S | * | * | trans | -64.7 | 111.3 | 170.9 | -68.7 | -164.4 | 178.5 | -169.9 | 0 | 107.9 | P47 M51 | P47-K49 PolarHBondContact O-N 2.8Å; P47-K49 VanDerWaalsContact O-N 3.12Å; K49-M51 PolarHBondContact O-N 2.9Å | ||
| 50 | Q | 48.9 | Very low | 52.4 | Low | 157 Ų | 157 | 148.3 Ų | 148.3 | 73% | 0.734 | 78% | 0.777 | S | S | * | * | trans | -46.9 | 111 | 164.9 | -69.4 | -86.1 | -19.3 | 0 | 0 | 108.5 | P48 Y52 | P48-Q50 PolarHBondContact O-N 2.92Å; P48-Q50 VanDerWaalsContact O-N 3.08Å; Q50-Y52 HydrophobicContact CB-CD2 4.34Å; Q50-Y52 HydrophobicContact CB-CE2 4.04Å; Q50-Y52 PolarHBondContact O-N 3.38Å | ||
| 51 | M | 44.5 | Very low | 52.5 | Low | 162 Ų | 162 | 154.4 Ų | 154.4 | 80% | 0.798 | 79% | 0.787 | S | S | * | * | trans | -69.6 | 95.7 | 173.5 | -81.9 | -175.7 | 59.8 | 0 | 0 | 108.4 | K49 N53 | K49-M51 PolarHBondContact O-N 2.9Å; M51-N53 PolarHBondContact O-N 3.2Å | ||
| 52 | Y | 47.8 | Very low | 52.8 | Low | 169 Ų | 169 | 151.2 Ų | 151.2 | 66% | 0.663 | 78% | 0.781 | S | S | * | * | trans | -77 | 114.9 | 162.7 | -77.3 | -83.1 | 0 | 0 | 0 | 108.2 | Q50 Y54 | Q50-Y52 HydrophobicContact CB-CD2 4.34Å; Q50-Y52 HydrophobicContact CB-CE2 4.04Å; Q50-Y52 PolarHBondContact O-N 3.38Å; Y52-Y54 WeakPolarHBondContact O-CD2 3.49Å; Y52-Y54 VanDerWaalsContact O-CE2 3.29Å; Y52-Y54 WeakPolarHBondContact O-CE2 3.48Å; Y52-Y54 PolarHBondContact O-N 3.09Å | ||
| 53 | N | 52.3 | Low | 52 | Low | 140 Ų | 140 | 151.8 Ų | 151.8 | 75% | 0.749 | 78% | 0.784 | S | S | * | * | trans | -66.3 | 111.4 | 177.4 | -69.9 | -42.4 | 0 | 0 | 0 | 109.8 | M51 T55 | M51-N53 PolarHBondContact O-N 3.2Å; N53-T55 PolarHBondContact O-N 3.41Å | ||
| 54 | Y | 38.3 | Very low | 51.6 | Low | 137 Ų | 137 | 151 Ų | 151 | 54% | 0.537 | 79% | 0.785 | S | S | . | * | trans | -88.4 | 90.9 | 171.7 | -61.8 | -84.8 | 0 | 0 | 0 | 108.7 | Y52 M186 | Y52-Y54 WeakPolarHBondContact O-CD2 3.49Å; Y52-Y54 VanDerWaalsContact O-CE2 3.29Å; Y52-Y54 WeakPolarHBondContact O-CE2 3.48Å; Y52-Y54 PolarHBondContact O-N 3.09Å; Y54-M186 HydrophobicContact CE1-CE 3.84Å; Y54-M186 HydrophobicContact CE1-SD 3.73Å; Y54-M186 WeakPolarHBondContact OH-CE 2.79Å | ||
| 55 | T | 54.1 | Low | 51.7 | Low | 123 Ų | 123 | 146.5 Ų | 146.5 | 76% | 0.755 | 78% | 0.779 | S | S | * | * | trans | -145.4 | 123.6 | 171.5 | -70.6 | 0 | 0 | 0 | 0 | 108.3 | N53 | N53-T55 PolarHBondContact O-N 3.41Š| ||
| 56 | T | 49.5 | Very low | 51.5 | Low | 111 Ų | 111 | 146.6 Ų | 146.6 | 68% | 0.681 | 78% | 0.777 | S | S | * | * | trans | 81.3 | 74.2 | 172.1 | -53.2 | 0 | 0 | 0 | 0 | 117 | ||||
| 57 | V | 52.5 | Low | 50.9 | Low | 152 Ų | 152 | 151.8 Ų | 151.8 | 92% | 0.921 | 78% | 0.782 | S | S | * | * | trans | -135.4 | 54.2 | 150.6 | -167.8 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 58 | Q | 55.5 | Low | 50.2 | Low | 198 Ų | 198 | 150.6 Ų | 150.6 | 93% | 0.925 | 78% | 0.777 | S | S | * | * | S | Bend | trans | -129.3 | 7.7 | 173.3 | -94.7 | -166.5 | 25.3 | 0 | 0 | 114 | ||
| 59 | Q | 54.4 | Low | 49.8 | Very low | 175 Ų | 175 | 152.3 Ų | 152.3 | 82% | 0.818 | 77% | 0.774 | S | S | * | * | S | Bend | trans | -128.8 | 32.9 | -168.8 | -150.5 | 177 | 30.4 | 0 | 0 | 116.1 | ||
| 60 | Q | 53.5 | Low | 49.3 | Very low | 174 Ų | 174 | 148.5 Ų | 148.5 | 81% | 0.813 | 77% | 0.767 | S | S | * | * | trans | -150.8 | 74.4 | 168 | -144 | 162.1 | 20.7 | 0 | 0 | 113.2 | ||||
| 61 | Q | 55.5 | Low | 49.1 | Very low | 197 Ų | 197 | 150.1 Ų | 150.1 | 92% | 0.921 | 78% | 0.775 | S | S | * | * | trans | -91.5 | 106.6 | 161.8 | -168.3 | 158 | 57.7 | 0 | 0 | 107.3 | ||||
| 62 | Q | 52.4 | Low | 49.1 | Very low | 163 Ų | 163 | 152.8 Ų | 152.8 | 76% | 0.762 | 78% | 0.777 | S | S | * | * | trans | -133 | 132.8 | 164.2 | -68.7 | -167.6 | 16.4 | 0 | 0 | 109.2 | ||||
| 63 | P | 43.2 | Very low | 49 | Very low | 130 Ų | 130 | 148.2 Ų | 148.2 | 84% | 0.844 | 78% | 0.782 | S | S | * | * | trans | -99 | 120.4 | -179.7 | 35.3 | -27.3 | 0 | 0 | 0 | 111.2 | ||||
| 64 | A | 47.7 | Very low | 48.2 | Very low | 102 Ų | 102 | 147.8 Ų | 147.8 | 84% | 0.843 | 79% | 0.788 | S | S | * | * | trans | -175 | 140.9 | 168.6 | 0 | 0 | 0 | 0 | 0 | 107.6 | ||||
| 65 | A | 49.5 | Very low | 48.6 | Very low | 87 Ų | 87 | 152.3 Ų | 152.3 | 72% | 0.719 | 81% | 0.806 | S | S | * | * | cis | -162.5 | 141.9 | -0 | 0 | 0 | 0 | 0 | 0 | 106.8 | ||||
| 66 | F | 43.5 | Very low | 48.6 | Very low | 191 Ų | 191 | 152.3 Ų | 152.3 | 84% | 0.838 | 81% | 0.808 | S | S | * | * | trans | 32.6 | 96.6 | 130.2 | -157.4 | -97.5 | 0 | 0 | 0 | 117.3 | ||||
| 67 | Y | 41.4 | Very low | 48.5 | Very low | 209 Ų | 209 | 154.6 Ų | 154.6 | 82% | 0.82 | 82% | 0.816 | S | S | * | * | trans | -128 | 106 | 157.5 | -148.3 | -93.4 | 0 | 0 | 0 | 109.6 | ||||
| 68 | S | 50.1 | Low | 48.3 | Very low | 89 Ų | 89 | 151 Ų | 151 | 62% | 0.622 | 80% | 0.802 | S | S | * | * | trans | -74.5 | 130.3 | 179.8 | -147.3 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 69 | Q | 51.1 | Low | 48.2 | Very low | 160 Ų | 160 | 146 Ų | 146 | 75% | 0.748 | 79% | 0.789 | S | S | * | * | trans | -105.5 | 134.8 | 170 | -79.3 | -80.2 | -30.9 | 0 | 0 | 109 | ||||
| 70 | P | 48.8 | Very low | 48.4 | Very low | 92 Ų | 92 | 143.9 Ų | 143.9 | 60% | 0.597 | 79% | 0.791 | S | S | * | * | trans | -83.4 | 143.5 | 174.1 | 32.5 | -29.7 | 0 | 0 | 0 | 111.9 | ||||
| 71 | E | 45.6 | Very low | 48.7 | Very low | 192 Ų | 192 | 143.6 Ų | 143.6 | 90% | 0.897 | 79% | 0.792 | S | S | * | * | trans | -57.2 | 131.4 | 177.4 | -71 | 170.3 | 120 | 0 | 0 | 113.2 | ||||
| 72 | Y | 44.2 | Very low | 48.7 | Very low | 217 Ų | 217 | 140.3 Ų | 140.3 | 85% | 0.851 | 79% | 0.787 | S | S | * | * | trans | -128.2 | 107.2 | 154.7 | -72.8 | -79.3 | 0 | 0 | 0 | 108.8 | ||||
| 73 | G | 45 | Very low | 48 | Very low | 73 Ų | 73 | 141.2 Ų | 141.2 | 75% | 0.753 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -77 | 147 | -179.8 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||
| 74 | C | 36.9 | Very low | 48.2 | Very low | 132 Ų | 132 | 138.3 Ų | 138.3 | 89% | 0.892 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -95 | 123.5 | 169 | -71.4 | 0 | 0 | 0 | 0 | 109.9 | ||
| 75 | Y | 46.4 | Very low | 48.4 | Very low | 232 Ų | 232 | 139.3 Ų | 139.3 | 91% | 0.91 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -99 | 130.4 | 164 | -81.4 | -87.2 | 0 | 0 | 0 | 109.4 | ||
| 76 | P | 53.1 | Low | 48.5 | Very low | 123 Ų | 123 | 141.9 Ų | 141.9 | 80% | 0.799 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -91.1 | 132.4 | 168.9 | 33.9 | -26.4 | 0 | 0 | 0 | 109.2 | ||
| 77 | N | 47.2 | Very low | 49 | Very low | 158 Ų | 158 | 140.5 Ų | 140.5 | 85% | 0.845 | 80% | 0.797 | S | S | * | * | trans | -144.2 | 134 | 165.5 | -163.3 | 2.9 | 0 | 0 | 0 | 112.8 | ||||
| 78 | A | 48.7 | Very low | 49.6 | Very low | 76 Ų | 76 | 134.9 Ų | 134.9 | 63% | 0.628 | 79% | 0.787 | S | S | * | * | trans | 75.7 | 94.7 | 148.6 | 0 | 0 | 0 | 0 | 0 | 119.3 | ||||
| 79 | S | 53.9 | Low | 49.6 | Very low | 94 Ų | 94 | 141.9 Ų | 141.9 | 66% | 0.657 | 80% | 0.801 | S | S | * | * | 147.6 | 122.5 | 89.8 | -80.8 | 0 | 0 | 0 | 0 | 113 | |||||
| 80 | P | 58.1 | Low | 49 | Very low | 131 Ų | 131 | 138.1 Ų | 138.1 | 85% | 0.851 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -88.8 | 135.9 | 172.9 | 33.3 | -28.8 | 0 | 0 | 0 | 111.9 | ||
| 81 | M | 60 | Low | 48.5 | Very low | 168 Ų | 168 | 138 Ų | 138 | 83% | 0.828 | 82% | 0.821 | S | S | * | * | P | Polyproline II helix | trans | -92.9 | 147.4 | 174.9 | -38.3 | -77.2 | 173.6 | 0 | 0 | 110.3 | ||
| 82 | P | 55.7 | Low | 48.5 | Very low | 128 Ų | 128 | 132.5 Ų | 132.5 | 83% | 0.831 | 82% | 0.816 | S | S | * | * | P | Polyproline II helix | trans | -86.6 | 147.6 | -165.8 | 34.1 | -33.9 | 0 | 0 | 0 | 114.5 | ||
| 83 | I | 39 | Very low | 48.3 | Very low | 182 Ų | 182 | 126.5 Ų | 126.5 | 93% | 0.933 | 82% | 0.82 | S | S | * | * | P | Polyproline II helix | trans | -77 | 124.6 | 171.4 | -67.4 | 168.4 | 0 | 0 | 0 | 108.9 | ||
| 84 | G | 45.8 | Very low | 48.7 | Very low | 68 Ų | 68 | 128.3 Ų | 128.3 | 70% | 0.701 | 82% | 0.821 | S | S | * | * | trans | -144.4 | 122.9 | -179.4 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 85 | S | 52.4 | Low | 49.8 | Very low | 124 Ų | 124 | 128.3 Ų | 128.3 | 87% | 0.867 | 82% | 0.817 | S | S | * | * | trans | 76.2 | 97.2 | 155.5 | -68 | 0 | 0 | 0 | 0 | 120.5 | ||||
| 86 | V | 51.4 | Low | 50.5 | Low | 140 Ų | 140 | 121.8 Ų | 121.8 | 85% | 0.848 | 80% | 0.803 | S | S | * | * | trans | -42.8 | 143.6 | 152.4 | -67.2 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 87 | N | 54.5 | Low | 50.2 | Low | 162 Ų | 162 | 126 Ų | 126 | 87% | 0.866 | 80% | 0.804 | S | S | * | * | trans | -133.6 | 121.4 | 155.6 | -127.7 | -1.8 | 0 | 0 | 0 | 107.8 | ||||
| 88 | P | 54.1 | Low | 50.3 | Low | 92 Ų | 92 | 128.8 Ų | 128.8 | 60% | 0.597 | 80% | 0.804 | S | S | * | * | trans | -88.6 | 163 | 175 | 34.4 | -27.5 | 0 | 0 | 0 | 110.2 | ||||
| 89 | Y | 49.3 | Very low | 49.9 | Very low | 236 Ų | 236 | 135 Ų | 135 | 93% | 0.925 | 81% | 0.813 | S | S | * | * | trans | 88.8 | 118.5 | 176.8 | -57.2 | -80.8 | 0 | 0 | 0 | 117.4 | ||||
| 90 | G | 39.6 | Very low | 49.5 | Very low | 81 Ų | 81 | 136.7 Ų | 136.7 | 84% | 0.835 | 82% | 0.823 | S | S | * | * | trans | 130.9 | 97.5 | 152.3 | 0 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 91 | G | 38.6 | Very low | 48.8 | Very low | 89 Ų | 89 | 134 Ų | 134 | 92% | 0.918 | 82% | 0.819 | S | S | * | * | trans | -64.6 | 167.8 | -175.3 | 0 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 92 | G | 45.2 | Very low | 48.3 | Very low | 77 Ų | 77 | 129.6 Ų | 129.6 | 79% | 0.794 | 82% | 0.816 | S | S | * | * | trans | 140.8 | 89.9 | 166.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | S94 | G92-S94 PolarHBondContact O-N 3.24Š| ||
| 93 | G | 39.5 | Very low | 47.8 | Very low | 91 Ų | 91 | 132.7 Ų | 132.7 | 94% | 0.938 | 82% | 0.82 | S | S | * | * | trans | -61 | 121.9 | 178.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 94 | S | 52.4 | Low | 47.8 | Very low | 110 Ų | 110 | 129.1 Ų | 129.1 | 77% | 0.769 | 81% | 0.811 | S | S | * | * | trans | -155.4 | 115.3 | 166.9 | 169.6 | 0 | 0 | 0 | 0 | 108.1 | G92 | G92-S94 PolarHBondContact O-N 3.24Š| ||
| 95 | V | 61.5 | Low | 48 | Very low | 133 Ų | 133 | 132.5 Ų | 132.5 | 81% | 0.806 | 82% | 0.818 | S | S | * | * | trans | -66.7 | 128.1 | 179.6 | -156.9 | 0 | 0 | 0 | 0 | 108.7 | Y97 | V95-Y97 PolarHBondContact O-N 3.49Š| ||
| 96 | P | 60.5 | Low | 47.5 | Very low | 95 Ų | 95 | 133.2 Ų | 133.2 | 62% | 0.617 | 82% | 0.817 | S | S | * | * | trans | -79.6 | 109.3 | -179.4 | 30.9 | -29.6 | 0 | 0 | 0 | 109.2 | Y98 | P96-Y98 PolarHBondContact O-N 2.89Š| ||
| 97 | Y | 47.2 | Very low | 47.2 | Very low | 211 Ų | 211 | 131.2 Ų | 131.2 | 83% | 0.827 | 82% | 0.815 | S | S | * | * | trans | -71.7 | 114.6 | 162 | -148.4 | -92.4 | 0 | 0 | 0 | 106.9 | V95 Y99 | V95-Y97 PolarHBondContact O-N 3.49Å; Y97-Y99 PolarHBondContact O-N 3.46Å | ||
| 98 | Y | 48.5 | Very low | 46.6 | Very low | 216 Ų | 216 | 129.9 Ų | 129.9 | 85% | 0.847 | 82% | 0.819 | S | S | * | * | trans | -66 | 105 | 176.8 | -76.6 | -88 | 0 | 0 | 0 | 109.7 | P96 | P96-Y98 PolarHBondContact O-N 2.89Š| ||
| 99 | Y | 39.9 | Very low | 46.2 | Very low | 208 Ų | 208 | 129.2 Ų | 129.2 | 82% | 0.816 | 83% | 0.828 | S | S | * | * | trans | -104.7 | 109.9 | 162.4 | -130.3 | -90 | 0 | 0 | 0 | 106.9 | Y97 | Y97-Y99 PolarHBondContact O-N 3.46Š| ||
| 100 | C | 47.2 | Very low | 45.7 | Very low | 129 Ų | 129 | 125 Ų | 125 | 87% | 0.872 | 83% | 0.827 | S | S | * | * | trans | -85.2 | 112.3 | 171.4 | -171.1 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 101 | G | 42.7 | Very low | 45.9 | Very low | 74 Ų | 74 | 125.7 Ų | 125.7 | 76% | 0.763 | 82% | 0.82 | S | S | * | * | trans | -75.6 | 128.9 | 170.3 | 0 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 102 | G | 48.6 | Very low | 46.5 | Very low | 75 Ų | 75 | 130.1 Ų | 130.1 | 77% | 0.773 | 82% | 0.821 | S | S | * | * | trans | -126.4 | 110.8 | 164.3 | 0 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 103 | Q | 45.1 | Very low | 46.6 | Very low | 194 Ų | 194 | 132.2 Ų | 132.2 | 91% | 0.907 | 81% | 0.814 | S | S | * | * | trans | -51 | 143.7 | -179.6 | 59.4 | -142.8 | 15.2 | 0 | 0 | 116 | ||||
| 104 | S | 40.3 | Very low | 47.3 | Very low | 106 Ų | 106 | 135.7 Ų | 135.7 | 74% | 0.741 | 81% | 0.812 | S | S | * | * | trans | -70.6 | 125.5 | 175.6 | 159.7 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 105 | T | 50.1 | Low | 47.1 | Very low | 140 Ų | 140 | 139.2 Ų | 139.2 | 86% | 0.859 | 82% | 0.816 | S | S | * | * | trans | -141 | 138.9 | 141.2 | 49.8 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 106 | V | 40.5 | Very low | 46.6 | Very low | 138 Ų | 138 | 137.4 Ų | 137.4 | 84% | 0.836 | 81% | 0.814 | S | S | * | * | trans | -69.4 | 128.9 | -174.6 | -69.5 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 107 | A | 45 | Very low | 46.2 | Very low | 99 Ų | 99 | 140.3 Ų | 140.3 | 82% | 0.818 | 82% | 0.819 | S | S | * | * | trans | -176.3 | 129.6 | 147.8 | 0 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 108 | S | 42.1 | Very low | 46.3 | Very low | 133 Ų | 133 | 138.1 Ų | 138.1 | 93% | 0.93 | 82% | 0.821 | S | S | * | * | trans | -55.5 | 140.8 | 175.6 | -48.1 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 109 | G | 45.8 | Very low | 45.9 | Very low | 78 Ų | 78 | 133.6 Ų | 133.6 | 80% | 0.804 | 81% | 0.812 | S | S | * | * | trans | 161.7 | 90.3 | 169.3 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 110 | T | 38.5 | Very low | 46.2 | Very low | 147 Ų | 147 | 128.9 Ų | 128.9 | 90% | 0.902 | 81% | 0.809 | S | S | * | * | trans | -71.8 | 119.3 | 173.2 | 50.5 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 111 | S | 45.1 | Very low | 46.3 | Very low | 97 Ų | 97 | 127 Ų | 127 | 68% | 0.678 | 80% | 0.798 | S | S | * | * | trans | -150.2 | 121.8 | 151.9 | -158.6 | 0 | 0 | 0 | 0 | 108.6 | D113 | S111-D113 WeakPolarHBondContact CB-OD1 3.48Å; S111-D113 PolarHBondContact OG-OD1 2.93Å | ||
| 112 | L | 50.3 | Low | 46.7 | Very low | 182 Ų | 182 | 132.2 Ų | 132.2 | 95% | 0.953 | 80% | 0.802 | S | S | * | * | trans | -99.7 | 92.4 | -176.5 | -78.5 | 163 | 0 | 0 | 0 | 107.3 | ||||
| 113 | D | 47.4 | Very low | 46.4 | Very low | 120 Ų | 120 | 135.7 Ų | 135.7 | 64% | 0.642 | 81% | 0.808 | S | S | * | * | trans | -136.8 | 64.5 | 175.9 | 23.7 | -79.6 | 0 | 0 | 0 | 109.6 | S111 | S111-D113 WeakPolarHBondContact CB-OD1 3.48Å; S111-D113 PolarHBondContact OG-OD1 2.93Å | ||
| 114 | D | 54 | Low | 46.5 | Very low | 165 Ų | 165 | 132.2 Ų | 132.2 | 88% | 0.882 | 81% | 0.806 | S | S | * | * | trans | -108.2 | 80.9 | 166.8 | -86.5 | -66.5 | 0 | 0 | 0 | 110 | A116 | D114-A116 PolarHBondContact O-N 2.72Å; D114-A116 VanDerWaalsContact O-N 3.16Å | ||
| 115 | E | 48.3 | Very low | 46.7 | Very low | 184 Ų | 184 | 132.3 Ų | 132.3 | 86% | 0.86 | 81% | 0.813 | S | S | * | * | trans | -67.4 | 91.7 | 157.5 | -84.7 | -80.1 | 101.9 | 0 | 0 | 108.4 | H117 | E115-H117 PolarHBondContact O-N 2.91Š| ||
| 116 | A | 51.7 | Low | 46.5 | Very low | 94 Ų | 94 | 133.2 Ų | 133.2 | 78% | 0.777 | 81% | 0.812 | S | S | * | * | trans | -72.2 | 84.9 | 168 | 0 | 0 | 0 | 0 | 0 | 109.7 | D114 L118 | D114-A116 PolarHBondContact O-N 2.72Å; D114-A116 VanDerWaalsContact O-N 3.16Å; A116-L118 PolarHBondContact O-N 3.08Å; A116-L118 VanDerWaalsContact O-N 3.12Å | ||
| 117 | H | 51.9 | Low | 46.6 | Very low | 156 Ų | 156 | 131.2 Ų | 131.2 | 72% | 0.722 | 81% | 0.811 | S | S | * | * | trans | -56.7 | 102.8 | 165.1 | -173.2 | -86 | 0 | 0 | 0 | 109.2 | E115 D119 | E115-H117 PolarHBondContact O-N 2.91Å; H117-D119 PolarHBondContact O-N 2.95Å | ||
| 118 | L | 48.7 | Very low | 46.6 | Very low | 165 Ų | 165 | 129.7 Ų | 129.7 | 86% | 0.864 | 80% | 0.804 | S | S | * | * | trans | -71.1 | 85.7 | 165.7 | -80.5 | 166.7 | 0 | 0 | 0 | 108.1 | A116 S120 | A116-L118 PolarHBondContact O-N 3.08Å; A116-L118 VanDerWaalsContact O-N 3.12Å; L118-S120 PolarHBondContact O-N 3.06Å; L118-S120 VanDerWaalsContact O-N 3.09Å | ||
| 119 | D | 40.5 | Very low | 46.5 | Very low | 121 Ų | 121 | 133.3 Ų | 133.3 | 65% | 0.647 | 80% | 0.803 | S | S | * | * | trans | -66.5 | 97.4 | 166.6 | -173 | 38.6 | 0 | 0 | 0 | 108.8 | H117 S121 | H117-D119 PolarHBondContact O-N 2.95Å; D119-S121 PolarHBondContact O-N 3.34Å | ||
| 120 | S | 45.9 | Very low | 47 | Very low | 109 Ų | 109 | 135 Ų | 135 | 76% | 0.762 | 80% | 0.797 | S | S | * | * | trans | -89.9 | 93.4 | 167.1 | -68.8 | 0 | 0 | 0 | 0 | 107.4 | L118 E122 | L118-S120 PolarHBondContact O-N 3.06Å; L118-S120 VanDerWaalsContact O-N 3.09Å; S120-E122 PolarHBondContact O-N 3.07Å; S120-E122 VanDerWaalsContact O-N 3.09Å | ||
| 121 | S | 50.4 | Low | 47.5 | Very low | 90 Ų | 90 | 133.9 Ų | 133.9 | 63% | 0.629 | 79% | 0.791 | S | S | * | * | trans | -59.7 | 107.8 | 171 | 45 | 0 | 0 | 0 | 0 | 111 | D119 | D119-S121 PolarHBondContact O-N 3.34Š| ||
| 122 | E | 50.8 | Low | 48 | Very low | 184 Ų | 184 | 139.3 Ų | 139.3 | 86% | 0.86 | 80% | 0.796 | S | S | * | * | 57.1 | 106 | 118.9 | -57.5 | -176.9 | 148.3 | 0 | 0 | 117.8 | S120 | S120-E122 PolarHBondContact O-N 3.07Å; S120-E122 VanDerWaalsContact O-N 3.09Å | |||
| 123 | T | 40.9 | Very low | 47.6 | Very low | 147 Ų | 147 | 139.2 Ų | 139.2 | 90% | 0.902 | 79% | 0.791 | S | S | * | * | trans | -60.7 | 128.3 | 165.1 | 49.8 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 124 | S | 48.9 | Very low | 47.9 | Very low | 122 Ų | 122 | 144.4 Ų | 144.4 | 85% | 0.853 | 80% | 0.802 | S | S | * | * | trans | -112 | 126 | 151.8 | 62 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 125 | A | 43.2 | Very low | 48.2 | Very low | 107 Ų | 107 | 141.6 Ų | 141.6 | 88% | 0.884 | 79% | 0.791 | S | S | * | * | trans | -78.8 | 128.7 | 176.9 | 0 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 126 | D | 45.8 | Very low | 48.5 | Very low | 159 Ų | 159 | 139 Ų | 139 | 85% | 0.85 | 79% | 0.789 | S | S | * | * | trans | -137.8 | 138.2 | 152.9 | -174.8 | 39.5 | 0 | 0 | 0 | 110.3 | ||||
| 127 | A | 44 | Very low | 48.6 | Very low | 97 Ų | 97 | 145 Ų | 145 | 80% | 0.802 | 79% | 0.792 | S | S | * | * | trans | -78 | 117.4 | -165.6 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 128 | G | 44.4 | Very low | 48.6 | Very low | 66 Ų | 66 | 147.1 Ų | 147.1 | 68% | 0.68 | 80% | 0.799 | S | S | * | * | trans | -148.3 | 82.8 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | V130 | G128-V130 PolarHBondContact O-N 3.19Š| ||
| 129 | K | 40.6 | Very low | 48.7 | Very low | 210 Ų | 210 | 150.4 Ų | 150.4 | 91% | 0.913 | 80% | 0.8 | S | S | * | * | trans | -58.4 | 91.7 | 171.8 | -177.5 | 175.1 | -178.9 | -175.4 | 0 | 110.6 | ||||
| 130 | V | 55.9 | Low | 49 | Very low | 112 Ų | 112 | 152.8 Ų | 152.8 | 68% | 0.679 | 81% | 0.807 | S | S | * | * | trans | -137 | 102.6 | 166.5 | -173.1 | 0 | 0 | 0 | 0 | 110 | G128 R132 | G128-V130 PolarHBondContact O-N 3.19Å; V130-R132 HydrophobicContact CG1-CG 4.34Å; V130-R132 PolarHBondContact O-N 2.76Å | ||
| 131 | T | 49.3 | Very low | 49.3 | Very low | 124 Ų | 124 | 158.1 Ų | 158.1 | 76% | 0.761 | 81% | 0.811 | S | S | * | * | trans | -47.9 | 97.9 | 164.9 | -54.6 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 132 | R | 55.5 | Low | 49.3 | Very low | 211 Ų | 211 | 161 Ų | 161 | 80% | 0.796 | 82% | 0.818 | S | S | * | * | trans | -108.4 | 97.9 | 164.6 | -75.6 | -168.4 | 172.7 | -156.4 | -0.9 | 108.4 | V130 R134 | V130-R132 HydrophobicContact CG1-CG 4.34Å; V130-R132 PolarHBondContact O-N 2.76Å; R132-R134 VanDerWaalsContact C-N 3.35Å; R132-R134 PolarHBondContact O-N 2.68Å | ||
| 133 | Q | 42.4 | Very low | 49 | Very low | 181 Ų | 181 | 162.8 Ų | 162.8 | 85% | 0.846 | 82% | 0.817 | S | S | * | * | trans | -55.5 | 99.5 | 164.2 | -64.9 | -158.2 | -5.7 | 0 | 0 | 108.7 | ||||
| 134 | R | 53.2 | Low | 49.6 | Very low | 229 Ų | 229 | 162.3 Ų | 162.3 | 86% | 0.864 | 80% | 0.802 | S | S | * | * | trans | -92.4 | 102.7 | 172.3 | -69.1 | 178.5 | 72.1 | 177.9 | 3.1 | 106.7 | R132 | R132-R134 VanDerWaalsContact C-N 3.35Å; R132-R134 PolarHBondContact O-N 2.68Å | ||
| 135 | T | 59.1 | Low | 49.8 | Very low | 106 Ų | 106 | 161.4 Ų | 161.4 | 65% | 0.65 | 79% | 0.788 | S | S | * | * | trans | -45.4 | 141.2 | 170.9 | 47.2 | 0 | 0 | 0 | 0 | 111 | R137 | T135-R137 VanDerWaalsContact C-N 3.26Å; T135-R137 PolarHBondContact O-N 2.91Å | ||
| 136 | P | 54.7 | Low | 50.9 | Low | 128 Ų | 128 | 162.7 Ų | 162.7 | 83% | 0.831 | 79% | 0.787 | S | S | * | * | trans | -72.2 | 87.2 | 179.1 | 30.5 | -32.3 | 0 | 0 | 0 | 107.8 | K138 | P136-K138 PolarHBondContact O-N 2.78Š| ||
| 137 | R | 54.6 | Low | 51.7 | Low | 221 Ų | 221 | 160.3 Ų | 160.3 | 83% | 0.834 | 78% | 0.775 | S | S | * | * | trans | -65.7 | 93.4 | 163.6 | -73.5 | -171 | 179.6 | -112 | 2.5 | 106 | T135 R139 | T135-R137 VanDerWaalsContact C-N 3.26Å; T135-R137 PolarHBondContact O-N 2.91Å; R137-R139 PolarHBondContact O-N 2.96Å | ||
| 138 | K | 51.7 | Low | 52.8 | Low | 201 Ų | 201 | 159.9 Ų | 159.9 | 87% | 0.874 | 76% | 0.756 | S | S | * | * | trans | -55.7 | 80.8 | 168.3 | -157.2 | 175.7 | -170.9 | -178.1 | 0 | 106.4 | P136 Q140 | P136-K138 PolarHBondContact O-N 2.78Å; K138-Q140 PolarHBondContact O-N 2.97Å | ||
| 139 | R | 52 | Low | 54.3 | Low | 234 Ų | 234 | 157.3 Ų | 157.3 | 88% | 0.883 | 73% | 0.727 | S | S | * | * | trans | -68.8 | 74.4 | 164.2 | -77.6 | -176.6 | 138.4 | -145.4 | -4.3 | 105.2 | R137 R141 | R137-R139 PolarHBondContact O-N 2.96Å; R139-R141 PolarHBondContact O-N 3.08Å | ||
| 140 | Q | 46.3 | Very low | 56.2 | Low | 171 Ų | 171 | 152.9 Ų | 152.9 | 80% | 0.799 | 71% | 0.71 | S | S | * | * | trans | -35.8 | 112.7 | 156.4 | -168.7 | 170.6 | -0.9 | 0 | 0 | 104.2 | K138 L142 | K138-Q140 PolarHBondContact O-N 2.97Å; Q140-L142 PolarHBondContact O-N 2.99Å | ||
| 141 | R | 51.1 | Low | 57.6 | Low | 221 Ų | 221 | 154.7 Ų | 154.7 | 83% | 0.834 | 71% | 0.709 | S | S | * | * | trans | -59.8 | 89.3 | 176.2 | -71.5 | 179.6 | 177 | -179.1 | -0.4 | 103.9 | R139 R143 | R139-R141 PolarHBondContact O-N 3.08Å; R141-R143 PolarHBondContact O-N 3.02Å | ||
| 142 | L | 51.4 | Low | 59.5 | Low | 150 Ų | 150 | 150.8 Ų | 150.8 | 79% | 0.785 | 69% | 0.685 | S | S | * | * | trans | -47.7 | 111.7 | 176.1 | -169.3 | 66.7 | 0 | 0 | 0 | 102.6 | Q140 K144 | Q140-L142 PolarHBondContact O-N 2.99Å; L142-K144 VanDerWaalsContact C-N 3.34Å; L142-K144 PolarHBondContact O-N 3.12Å | ||
| 143 | R | 45.2 | Very low | 61.1 | Low | 222 Ų | 222 | 142.2 Ų | 142.2 | 84% | 0.838 | 66% | 0.657 | S | S | * | * | trans | -54.5 | 110.3 | -174.2 | -60 | -176.5 | 85.3 | -178.1 | 4.2 | 102.7 | R141 D145 | R141-R143 PolarHBondContact O-N 3.02Å; R143-D145 PolarHBondContact O-N 3.41Å | ||
| 144 | K | 53.2 | Low | 63.5 | Low | 136 Ų | 136 | 136.9 Ų | 136.9 | 59% | 0.591 | 64% | 0.639 | S | S | * | * | trans | -50.5 | 132.2 | 174.8 | -81.8 | 73.2 | 171.7 | -177.7 | 0 | 104.5 | L142 | L142-K144 VanDerWaalsContact C-N 3.34Å; L142-K144 PolarHBondContact O-N 3.12Å | ||
| 145 | D | 53.4 | Low | 65.4 | Low | 103 Ų | 103 | 126.6 Ų | 126.6 | 55% | 0.551 | 60% | 0.603 | S | S | * | * | trans | -41 | 126.2 | -172 | -65.7 | -65.9 | 0 | 0 | 0 | 109 | R143 N147 E148 | R143-D145 PolarHBondContact O-N 3.41Å; D145-N147 PolarHBondContact O-N 3.04Å; D145-E148 HydrophobicContact CB-CB 4.42Å; D145-E148 PolarHBondContact O-N 3.19Å | ||
| 146 | P | 64.7 | Low | 67.2 | Low | 134 Ų | 134 | 125.5 Ų | 125.5 | 87% | 0.87 | 59% | 0.588 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -54.4 | -16.3 | -172.4 | -28.7 | 34.8 | 0 | 0 | 0 | 114.7 | ||
| 147 | N | 63 | Low | 69 | Low | 110 Ų | 110 | 120.9 Ų | 120.9 | 59% | 0.588 | 56% | 0.56 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -99.8 | -14 | -179.4 | -155.8 | 22 | 0 | 0 | 0 | 114 | D145 Y216 H220 | D145-N147 PolarHBondContact O-N 3.04Å; N147-Y216 HydrophobicContact CB-CE2 4.16Å; N147-Y216 WeakPolarHBondContact O-CD2 3.21Å; N147-Y216 VanDerWaalsContact O-CE2 3.22Å; N147-Y216 WeakPolarHBondContact O-CE2 3.35Å; N147-H220 PolarHBondContact ND2-CE1 3.11Å |
| 148 | E | 68.3 | Low | 70.9 | Confident | 87 Ų | 87 | 111.7 Ų | 111.7 | 41% | 0.407 | 53% | 0.527 | S | S | . | . | S | Bend | trans | -78.3 | 125.3 | 174.9 | -168.8 | -176.6 | -177 | 0 | 0 | 108.8 | D145 Q150 Y216 | D145-E148 HydrophobicContact CB-CB 4.42Å; D145-E148 PolarHBondContact O-N 3.19Å; E148-Q150 PolarHBondContact O-N 3.44Å; E148-Q150 VanDerWaalsContact O-N 3.14Å; E148-Y216 HydrophobicContact CG-CE1 4.43Å |
| 149 | P | 75.1 | Confident | 72.9 | Confident | 12 Ų | 12 | 102.4 Ų | 102.4 | 8% | 0.078 | 49% | 0.487 | C | S | . | . | P | Polyproline II helix | trans | -57.4 | 126.8 | 178.3 | 22.6 | -31.5 | 0 | 0 | 0 | 109.2 | Y209 Q212 R213 | P149-Y209 HydrophobicContact CB-CD2 3.86Å; P149-Y209 HydrophobicContact CB-CE2 4.19Å; P149-Y209 HydrophobicContact CG-CD2 4.37Å; P149-Y209 HydrophobicContact CG-CE2 4.29Å; P149-Y209 WeakPolarHBondContact O-CE2 3.36Å; P149-Q212 HydrophobicContact CB-CB 3.72Å; P149-Q212 HydrophobicContact CG-CB 4.18Å; P149-R213 HydrophobicContact CG-CB 3.88Å; P149-R213 HydrophobicContact CG-CG 4.46Å |
| 150 | Q | 79.7 | Confident | 74.9 | Confident | 117 Ų | 117 | 93 Ų | 93 | 55% | 0.547 | 45% | 0.452 | S | S | . | . | P | Polyproline II helix | trans | -74.9 | 132.9 | -178.9 | -174.4 | 171.6 | 110.3 | 0 | 0 | 109.5 | E148 Y209 | E148-Q150 PolarHBondContact O-N 3.44Å; E148-Q150 VanDerWaalsContact O-N 3.14Å; Q150-Y209 VanDerWaalsContact O-CD2 3.25Å; Q150-Y209 WeakPolarHBondContact O-CD2 3.27Å |
| 151 | K | 86 | Confident | 77.2 | Confident | 151 Ų | 151 | 90.6 Ų | 90.6 | 66% | 0.657 | 44% | 0.436 | S | S | * | . | P | Polyproline II helix | trans | -51.1 | 131.5 | 172.8 | -68.2 | 179.1 | -177.5 | -176 | 0 | 109.8 | Y209 | K151-Y209 HydrophobicContact CB-CE2 4.49Å; K151-Y209 HydrophobicContact CG-CE1 4.48Å; K151-Y209 HydrophobicContact CG-CE2 4.01Å; K151-Y209 WeakPolarHBondContact CG-OH 3.47Å |
| 152 | P | 88.9 | Confident | 79.1 | Confident | 41 Ų | 41 | 83.3 Ų | 83.3 | 27% | 0.266 | 41% | 0.414 | S | S | . | . | P | Polyproline II helix | trans | -58.6 | 144.6 | 177.9 | 30.9 | -40.4 | 0 | 0 | 0 | 109.3 | A205 K206 | P152-A205 HydrophobicContact CB-CB 3.97Å; P152-K206 HydrophobicContact CB-CB 4.41Å; P152-K206 HydrophobicContact CG-CB 3.9Å; P152-K206 HydrophobicContact CG-CG 4.24Å |
| 153 | V | 89 | Confident | 81.1 | Confident | 32 Ų | 32 | 76.8 Ų | 76.8 | 19% | 0.194 | 38% | 0.38 | C | S | . | . | P | Polyproline II helix | trans | -81.6 | 146.5 | 172.7 | -71.8 | 0 | 0 | 0 | 0 | 110.1 | A157 L158 R161 T202 | V153-A157 HydrophobicContact CB-CB 3.9Å; V153-A157 HydrophobicContact CG1-CB 4.43Å; V153-L158 HydrophobicContact CG2-CB 3.95Å; V153-L158 HydrophobicContact CG2-CD1 4.05Å; V153-R161 VanDerWaalsContact CG1-CZ 3.5Å; V153-T202 WeakPolarHBondContact O-CG2 3.47Å; V153-T202 PolarHBondContact O-OG1 3.43Å |
| 154 | S | 93 | Very high | 83.3 | Confident | 69 Ų | 69 | 68.7 Ų | 68.7 | 48% | 0.483 | 35% | 0.352 | S | S | . | . | P | Polyproline II helix | trans | -60.7 | 160.6 | 173.2 | 65 | 0 | 0 | 0 | 0 | 111.3 | Y156 A157 L158 | S154-Y156 VanDerWaalsContact C-N 3.28Å; S154-Y156 PolarHBondContact O-N 3.12Å; S154-A157 CarbonylContact O-C 3.6Å; S154-A157 PolarHBondContact O-N 3.4Å; S154-A157 WeakPolarHBondContact OG-CB 3.47Å; S154-A157 PolarHBondContact OG-N 2.92Å; S154-L158 PolarHBondContact O-N 2.95Å |
| 155 | A | 94.2 | Very high | 85.1 | Confident | 13 Ų | 13 | 65.2 Ų | 65.2 | 11% | 0.107 | 35% | 0.348 | C | S | . | . | H | α-helix | trans | -53.5 | -45.4 | -179.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | A157 L158 F159 W187 K199 T202 | A155-A157 PolarHBondContact O-N 2.85Å; A155-L158 PolarHBondContact O-N 2.92Å; A155-F159 PolarHBondContact O-N 3.07Å; A155-W187 HydrophobicContact CB-CH2 4.14Å; A155-K199 HydrophobicContact CB-CG 4.02Å; A155-T202 WeakPolarHBondContact CA-OG1 3.4Å; A155-T202 PolarHBondContact N-OG1 3.35Å; A155-T202 VanDerWaalsContact N-OG1 3.15Å |
| 156 | Y | 95 | Very high | 87 | Confident | 83 Ų | 83 | 61.8 Ų | 61.8 | 33% | 0.325 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -63.4 | -40.9 | 175.2 | 178.2 | -114 | 0 | 0 | 0 | 112.6 | S154 L158 F159 F160 V183 W187 | S154-Y156 VanDerWaalsContact C-N 3.28Å; S154-Y156 PolarHBondContact O-N 3.12Å; Y156-L158 VanDerWaalsContact C-N 3.33Å; Y156-L158 PolarHBondContact O-N 3.32Å; Y156-F159 PolarHBondContact O-N 3.38Å; Y156-F160 VanDerWaalsContact O-CB 3.27Å; Y156-F160 WeakPolarHBondContact O-CB 3.38Å; Y156-F160 PolarHBondContact O-N 3.27Å; Y156-V183 HydrophobicContact CE2-CG1 4.43Å; Y156-W187 HydrophobicContact CD2-CB 3.91Å; Y156-W187 AromaticContact CD2-CD1 3.69Å; Y156-W187 AromaticContact CD2-CD2 3.66Å; Y156-W187 HydrophobicContact CD2-CD2 3.66Å; Y156-W187 AromaticContact CD2-CE2 3.98Å; Y156-W187 HydrophobicContact CD2-CE3 4.27Å; Y156-W187 AromaticContact CD2-CG 3.45Å; Y156-W187 HydrophobicContact CD2-CG 3.45Å; Y156-W187 VanDerWaalsContact CD2-CG 3.45Å; Y156-W187 AromaticContact CD2-NE1 3.97Å; Y156-W187 HydrophobicContact CE2-CB 3.71Å; Y156-W187 HydrophobicContact CE2-CD2 4.39Å; Y156-W187 AromaticContact CE2-CG 3.74Å; Y156-W187 HydrophobicContact CE2-CG 3.74Å |
| 157 | A | 94.2 | Very high | 88.2 | Confident | 30 Ų | 30 | 55.9 Ų | 55.9 | 25% | 0.248 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -70.1 | -30.4 | 178.8 | 0 | 0 | 0 | 0 | 0 | 112.7 | V153 S154 A155 R161 | V153-A157 HydrophobicContact CB-CB 3.9Å; V153-A157 HydrophobicContact CG1-CB 4.43Å; S154-A157 CarbonylContact O-C 3.6Å; S154-A157 PolarHBondContact O-N 3.4Å; S154-A157 WeakPolarHBondContact OG-CB 3.47Å; S154-A157 PolarHBondContact OG-N 2.92Å; A155-A157 PolarHBondContact O-N 2.85Å; A157-R161 WeakPolarHBondContact O-CG 3.29Å; A157-R161 PolarHBondContact O-N 3.41Å; A157-R161 VanDerWaalsContact O-N 3.15Å |
| 158 | L | 93 | Very high | 89.5 | Confident | 28 Ų | 28 | 56.4 Ų | 56.4 | 15% | 0.147 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -65.4 | -51.7 | 171.1 | -173.1 | 60.4 | 0 | 0 | 0 | 110.1 | V153 S154 A155 Y156 F160 R161 D162 Y198 R201 | V153-L158 HydrophobicContact CG2-CB 3.95Å; V153-L158 HydrophobicContact CG2-CD1 4.05Å; S154-L158 PolarHBondContact O-N 2.95Å; A155-L158 PolarHBondContact O-N 2.92Å; Y156-L158 VanDerWaalsContact C-N 3.33Å; Y156-L158 PolarHBondContact O-N 3.32Å; L158-F160 VanDerWaalsContact C-N 3.27Å; L158-F160 PolarHBondContact O-N 3.44Å; L158-R161 PolarHBondContact O-N 3.23Å; L158-R161 VanDerWaalsContact O-N 3.17Å; L158-D162 PolarHBondContact O-N 2.87Å; L158-Y198 HydrophobicContact CB-CD1 4.46Å; L158-Y198 HydrophobicContact CD2-CD1 4.04Å; L158-Y198 HydrophobicContact CG-CD1 4.15Å; L158-R201 HydrophobicContact CD2-CB 3.84Å |
| 159 | F | 94.8 | Very high | 90.6 | Very high | 7 Ų | 7 | 55.2 Ų | 55.2 | 3% | 0.031 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -57 | -41.1 | 174.4 | 177.6 | -105.8 | 0 | 0 | 0 | 112.3 | A155 Y156 R161 D162 T163 V183 M186 W187 L190 Y198 | A155-F159 PolarHBondContact O-N 3.07Å; Y156-F159 PolarHBondContact O-N 3.38Å; F159-R161 VanDerWaalsContact C-N 3.35Å; F159-R161 PolarHBondContact O-N 3.1Å; F159-D162 PolarHBondContact O-N 2.62Å; F159-T163 WeakPolarHBondContact CD2-OG1 3.35Å; F159-T163 HydrophobicContact CE1-CG2 4.49Å; F159-T163 WeakPolarHBondContact CE2-OG1 3.35Å; F159-T163 HydrophobicContact CZ-CG2 4.19Å; F159-T163 WeakPolarHBondContact CZ-OG1 3.16Å; F159-T163 WeakPolarHBondContact O-CB 3.11Å; F159-T163 PolarHBondContact O-N 3.08Å; F159-T163 PolarHBondContact O-OG1 3.2Å; F159-T163 VanDerWaalsContact O-OG1 3.04Å; F159-V183 HydrophobicContact CD1-CG1 4.01Å; F159-V183 HydrophobicContact CE1-CG1 3.92Å; F159-M186 HydrophobicContact CE1-CB 4.13Å; F159-M186 HydrophobicContact CZ-CB 3.85Å; F159-W187 HydrophobicContact CB-CE3 3.79Å; F159-W187 HydrophobicContact CB-CZ3 3.84Å; F159-W187 HydrophobicContact CD1-CB 3.92Å; F159-W187 HydrophobicContact CD1-CD2 4.28Å; F159-W187 AromaticContact CD1-CE3 3.57Å; F159-W187 HydrophobicContact CD1-CE3 3.57Å; F159-W187 HydrophobicContact CD1-CG 4.45Å; F159-W187 HydrophobicContact CD1-CZ3 4.45Å; F159-W187 HydrophobicContact CD2-CE3 4.32Å; F159-W187 HydrophobicContact CE1-CB 3.76Å; F159-W187 HydrophobicContact CE1-CE3 4.23Å; F159-W187 AromaticContact CG-CE3 3.61Å; F159-W187 HydrophobicContact CG-CE3 3.61Å; F159-W187 HydrophobicContact CG-CZ3 4.07Å; F159-L190 HydrophobicContact CD2-CD1 3.77Å; F159-L190 HydrophobicContact CE1-CD1 4.37Å; F159-L190 HydrophobicContact CE2-CD1 3.46Å; F159-L190 VanDerWaalsContact CE2-CD1 3.46Å; F159-L190 HydrophobicContact CE2-CG 4.33Å; F159-L190 HydrophobicContact CG-CD1 4.36Å; F159-L190 HydrophobicContact CZ-CD1 3.77Å; F159-L190 HydrophobicContact CZ-CG 4.38Å; F159-Y198 HydrophobicContact CB-CD1 4.37Å; F159-Y198 HydrophobicContact CB-CE1 4.33Å; F159-Y198 HydrophobicContact CD2-CD2 4.48Å; F159-Y198 HydrophobicContact CD2-CE1 4.38Å; F159-Y198 AromaticContact CD2-CE2 3.8Å; F159-Y198 HydrophobicContact CD2-CE2 3.8Å; F159-Y198 AromaticContact CD2-CZ 3.75Å |
| 160 | F | 94.5 | Very high | 91.3 | Very high | 35 Ų | 35 | 61.9 Ų | 61.9 | 15% | 0.154 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -60.4 | -43.8 | 178.4 | -174.3 | -82.2 | 0 | 0 | 0 | 111.7 | Y156 L158 Q164 F176 V183 | Y156-F160 VanDerWaalsContact O-CB 3.27Å; Y156-F160 WeakPolarHBondContact O-CB 3.38Å; Y156-F160 PolarHBondContact O-N 3.27Å; L158-F160 VanDerWaalsContact C-N 3.27Å; L158-F160 PolarHBondContact O-N 3.44Å; F160-Q164 HydrophobicContact CD1-CB 4.33Å; F160-Q164 HydrophobicContact CE1-CB 4.24Å; F160-Q164 HydrophobicContact CE1-CG 4.31Å; F160-Q164 WeakPolarHBondContact O-CA 3.46Å; F160-Q164 WeakPolarHBondContact O-CB 2.94Å; F160-Q164 PolarHBondContact O-N 3.33Å; F160-F176 AromaticContact CE1-CE2 3.94Å; F160-F176 HydrophobicContact CE1-CE2 3.94Å; F160-F176 HydrophobicContact CE1-CZ 4.21Å; F160-F176 AromaticContact CZ-CE2 3.68Å; F160-F176 HydrophobicContact CZ-CE2 3.68Å; F160-F176 AromaticContact CZ-CZ 3.75Å; F160-F176 HydrophobicContact CZ-CZ 3.75Å; F160-V183 HydrophobicContact CB-CG1 4.14Å; F160-V183 HydrophobicContact CD2-CB 4.09Å; F160-V183 HydrophobicContact CD2-CG1 3.53Å; F160-V183 HydrophobicContact CD2-CG2 4.44Å; F160-V183 HydrophobicContact CE2-CB 4.33Å; F160-V183 HydrophobicContact CE2-CG1 4.26Å; F160-V183 HydrophobicContact CG-CG1 4.13Å |
| 161 | R | 92.7 | Very high | 91.5 | Very high | 121 Ų | 121 | 60.7 Ų | 60.7 | 46% | 0.457 | 33% | 0.331 | S | S | . | . | H | α-helix | trans | -62.9 | -45.8 | 178.2 | -73.7 | 176.7 | 176.8 | -177.1 | -0.5 | 111.8 | V153 A157 L158 F159 A165 | V153-R161 VanDerWaalsContact CG1-CZ 3.5Å; A157-R161 WeakPolarHBondContact O-CG 3.29Å; A157-R161 PolarHBondContact O-N 3.41Å; A157-R161 VanDerWaalsContact O-N 3.15Å; L158-R161 PolarHBondContact O-N 3.23Å; L158-R161 VanDerWaalsContact O-N 3.17Å; F159-R161 VanDerWaalsContact C-N 3.35Å; F159-R161 PolarHBondContact O-N 3.1Å; R161-A165 WeakPolarHBondContact O-CB 3.47Å; R161-A165 PolarHBondContact O-N 3.17Å; R161-A165 VanDerWaalsContact O-N 3.12Å |
| 162 | D | 92.3 | Very high | 91.6 | Very high | 69 Ų | 69 | 58 Ų | 58 | 37% | 0.369 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -66.5 | -47.6 | -177.2 | -68.2 | -10.6 | 0 | 0 | 0 | 111 | L158 F159 A165 A166 R201 | L158-D162 PolarHBondContact O-N 2.87Å; F159-D162 PolarHBondContact O-N 2.62Å; D162-A165 PolarHBondContact O-N 2.97Å; D162-A166 PolarHBondContact O-N 3.33Å; D162-A166 VanDerWaalsContact O-N 3.11Å; D162-R201 IonicContact OD2-NH1 4Å |
| 163 | T | 93 | Very high | 91.6 | Very high | 12 Ų | 12 | 63.6 Ų | 63.6 | 7% | 0.074 | 36% | 0.356 | C | S | . | . | H | α-helix | trans | -74.1 | -39 | -177.9 | -55 | 0 | 0 | 0 | 0 | 112.2 | F159 A165 A166 I167 V183 M186 | F159-T163 WeakPolarHBondContact CD2-OG1 3.35Å; F159-T163 HydrophobicContact CE1-CG2 4.49Å; F159-T163 WeakPolarHBondContact CE2-OG1 3.35Å; F159-T163 HydrophobicContact CZ-CG2 4.19Å; F159-T163 WeakPolarHBondContact CZ-OG1 3.16Å; F159-T163 WeakPolarHBondContact O-CB 3.11Å; F159-T163 PolarHBondContact O-N 3.08Å; F159-T163 PolarHBondContact O-OG1 3.2Å; F159-T163 VanDerWaalsContact O-OG1 3.04Å; T163-A165 VanDerWaalsContact C-N 3.29Å; T163-A165 PolarHBondContact O-N 3.15Å; T163-A166 PolarHBondContact O-N 3.04Å; T163-I167 HydrophobicContact CG2-CD1 3.83Å; T163-I167 HydrophobicContact CG2-CG1 4.33Å; T163-I167 WeakPolarHBondContact O-CG1 3.32Å; T163-I167 PolarHBondContact O-N 2.88Å; T163-V183 HydrophobicContact CG2-CG2 3.81Å; T163-M186 HydrophobicContact CG2-CE 3.96Å; T163-M186 HydrophobicContact CG2-SD 3.46Å; T163-M186 WeakPolarHBondContact CG2-SD 3.25Å |
| 164 | Q | 92.3 | Very high | 91.4 | Very high | 52 Ų | 52 | 63.4 Ų | 63.4 | 24% | 0.243 | 36% | 0.358 | C | S | . | . | H | α-helix | trans | -59.6 | -42.2 | 173.8 | -175 | -161.6 | -4 | 0 | 0 | 110.8 | F160 A166 I167 K168 V179 | F160-Q164 HydrophobicContact CD1-CB 4.33Å; F160-Q164 HydrophobicContact CE1-CB 4.24Å; F160-Q164 HydrophobicContact CE1-CG 4.31Å; F160-Q164 WeakPolarHBondContact O-CA 3.46Å; F160-Q164 WeakPolarHBondContact O-CB 2.94Å; F160-Q164 PolarHBondContact O-N 3.33Å; Q164-A166 VanDerWaalsContact C-N 3.35Å; Q164-I167 PolarHBondContact O-N 3.13Å; Q164-K168 WeakPolarHBondContact O-CB 3.24Å; Q164-K168 PolarHBondContact O-N 3.33Å; Q164-V179 HydrophobicContact CB-CG1 4.19Å; Q164-V179 HydrophobicContact CG-CG1 3.76Å |
| 165 | A | 91 | Very high | 91.3 | Very high | 63 Ų | 63 | 63.6 Ų | 63.6 | 52% | 0.521 | 36% | 0.36 | S | S | . | . | H | α-helix | trans | -64.3 | -39.8 | 176.9 | 0 | 0 | 0 | 0 | 0 | 111.8 | R161 D162 T163 G169 | R161-A165 WeakPolarHBondContact O-CB 3.47Å; R161-A165 PolarHBondContact O-N 3.17Å; R161-A165 VanDerWaalsContact O-N 3.12Å; D162-A165 PolarHBondContact O-N 2.97Å; T163-A165 VanDerWaalsContact C-N 3.29Å; T163-A165 PolarHBondContact O-N 3.15Å; A165-G169 PolarHBondContact O-N 3.42Å; A165-G169 VanDerWaalsContact O-N 3.09Å |
| 166 | A | 92.1 | Very high | 91.1 | Very high | 31 Ų | 31 | 69 Ų | 69 | 26% | 0.256 | 38% | 0.381 | S | S | . | . | H | α-helix | trans | -63.1 | -51.2 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | D162 T163 Q164 K168 G169 Q170 | D162-A166 PolarHBondContact O-N 3.33Å; D162-A166 VanDerWaalsContact O-N 3.11Å; T163-A166 PolarHBondContact O-N 3.04Å; Q164-A166 VanDerWaalsContact C-N 3.35Å; A166-K168 PolarHBondContact O-N 2.77Å; A166-G169 PolarHBondContact O-N 3.35Å; A166-Q170 WeakPolarHBondContact O-CG 3.07Å; A166-Q170 PolarHBondContact O-N 3.42Å |
| 167 | I | 90.7 | Very high | 91 | Very high | 11 Ų | 11 | 66.9 Ų | 66.9 | 6% | 0.056 | 38% | 0.384 | C | S | . | . | H | α-helix | trans | -64.1 | -42.9 | -178.2 | -64.6 | 166 | 0 | 0 | 0 | 111 | T163 Q164 G169 Q170 N171 V179 I182 V183 | T163-I167 HydrophobicContact CG2-CD1 3.83Å; T163-I167 HydrophobicContact CG2-CG1 4.33Å; T163-I167 WeakPolarHBondContact O-CG1 3.32Å; T163-I167 PolarHBondContact O-N 2.88Å; Q164-I167 PolarHBondContact O-N 3.13Å; I167-G169 VanDerWaalsContact C-N 3.27Å; I167-G169 PolarHBondContact O-N 3.07Å; I167-Q170 PolarHBondContact O-N 3.48Å; I167-Q170 VanDerWaalsContact O-N 3.16Å; I167-N171 PolarHBondContact O-N 3Å; I167-V179 HydrophobicContact CB-CG1 4.06Å; I167-V179 HydrophobicContact CD1-CG1 4.06Å; I167-V179 HydrophobicContact CG2-CB 4.43Å; I167-V179 HydrophobicContact CG2-CG1 4.02Å; I167-V179 HydrophobicContact CG2-CG2 3.89Å; I167-I182 HydrophobicContact CD1-CB 3.99Å; I167-I182 HydrophobicContact CD1-CG2 3.57Å; I167-V183 HydrophobicContact CD1-CG2 3.86Å |
| 168 | K | 89.8 | Confident | 90.8 | Very high | 121 Ų | 121 | 70.7 Ų | 70.7 | 53% | 0.526 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -68.7 | -27.4 | 179.8 | -171.5 | 159.2 | -179.8 | 158.2 | 0 | 112.7 | Q164 A166 N171 P172 | Q164-K168 WeakPolarHBondContact O-CB 3.24Å; Q164-K168 PolarHBondContact O-N 3.33Å; A166-K168 PolarHBondContact O-N 2.77Å; K168-N171 CarbonylContact O-C 3.44Å; K168-P172 WeakPolarHBondContact O-CA 3.33Å |
| 169 | G | 90.9 | Very high | 90.8 | Very high | 61 Ų | 61 | 69.5 Ų | 69.5 | 63% | 0.629 | 39% | 0.391 | S | S | * | . | H | α-helix | trans | -68.2 | -36.8 | 170.6 | 0 | 0 | 0 | 0 | 0 | 112.9 | A165 A166 I167 | A165-G169 PolarHBondContact O-N 3.42Å; A165-G169 VanDerWaalsContact O-N 3.09Å; A166-G169 PolarHBondContact O-N 3.35Å; I167-G169 VanDerWaalsContact C-N 3.27Å; I167-G169 PolarHBondContact O-N 3.07Å |
| 170 | Q | 90.4 | Very high | 90.7 | Very high | 153 Ų | 153 | 70.6 Ų | 70.6 | 72% | 0.715 | 40% | 0.399 | S | S | * | . | H | α-helix | trans | -79 | -37.4 | 176.8 | -61.2 | -58.1 | -43 | 0 | 0 | 112.5 | A166 I167 | A166-Q170 WeakPolarHBondContact O-CG 3.07Å; A166-Q170 PolarHBondContact O-N 3.42Å; I167-Q170 PolarHBondContact O-N 3.48Å; I167-Q170 VanDerWaalsContact O-N 3.16Å |
| 171 | N | 84.5 | Confident | 90.7 | Very high | 92 Ų | 92 | 76.6 Ų | 76.6 | 49% | 0.492 | 43% | 0.425 | S | S | . | . | trans | -128.9 | 81.5 | -176.8 | -65.5 | -77.5 | 0 | 0 | 0 | 110.1 | I167 K168 N173 A174 | I167-N171 PolarHBondContact O-N 3Å; K168-N171 CarbonylContact O-C 3.44Å; N171-N173 PolarHBondContact O-N 3.02Å; N171-N173 VanDerWaalsContact O-N 3.17Å; N171-A174 HydrophobicContact CB-CB 3.78Å; N171-A174 WeakPolarHBondContact O-CB 3.41Å; N171-A174 PolarHBondContact O-N 3.35Å; N171-A174 VanDerWaalsContact O-N 3.14Å | ||
| 172 | P | 87.5 | Confident | 90.7 | Very high | 93 Ų | 93 | 74.3 Ų | 74.3 | 60% | 0.604 | 42% | 0.421 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63.9 | -21.2 | 179.6 | 24.6 | -33.9 | 0 | 0 | 0 | 113.2 | K168 | K168-P172 WeakPolarHBondContact O-CA 3.33Š|
| 173 | N | 88.9 | Confident | 90.8 | Very high | 160 Ų | 160 | 71 Ų | 71 | 86% | 0.856 | 40% | 0.404 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -88.3 | -9.3 | 178.8 | -63.9 | -29.5 | 0 | 0 | 0 | 114.1 | N171 | N171-N173 PolarHBondContact O-N 3.02Å; N171-N173 VanDerWaalsContact O-N 3.17Å |
| 174 | A | 84.4 | Confident | 90.9 | Very high | 28 Ų | 28 | 72 Ų | 72 | 23% | 0.231 | 41% | 0.413 | C | S | . | . | trans | -67.6 | 135.6 | -178.3 | 0 | 0 | 0 | 0 | 0 | 111.2 | N171 V179 | N171-A174 HydrophobicContact CB-CB 3.78Å; N171-A174 WeakPolarHBondContact O-CB 3.41Å; N171-A174 PolarHBondContact O-N 3.35Å; N171-A174 VanDerWaalsContact O-N 3.14Å; A174-V179 HydrophobicContact CB-CG2 3.95Å | ||
| 175 | S | 90.3 | Very high | 91 | Very high | 73 Ų | 73 | 72.6 Ų | 72.6 | 51% | 0.51 | 43% | 0.427 | S | S | . | . | trans | -71.3 | 146.2 | 178 | -178.8 | 0 | 0 | 0 | 0 | 110.7 | G177 E178 V179 | S175-G177 PolarHBondContact O-N 2.82Å; S175-G177 VanDerWaalsContact O-N 3.08Å; S175-E178 PolarHBondContact N-OE2 3.23Å; S175-E178 WeakPolarHBondContact O-CB 3.49Å; S175-E178 PolarHBondContact O-N 2.86Å; S175-V179 WeakPolarHBondContact O-CG2 3.49Å; S175-V179 PolarHBondContact O-N 3.48Å | ||
| 176 | F | 90 | Very high | 91.1 | Very high | 126 Ų | 126 | 71.9 Ų | 71.9 | 55% | 0.553 | 41% | 0.413 | S | S | * | . | H | α-helix | trans | -53.2 | -33.9 | 177.8 | 178.2 | -103 | 0 | 0 | 0 | 112.7 | F160 S180 | F160-F176 AromaticContact CE1-CE2 3.94Å; F160-F176 HydrophobicContact CE1-CE2 3.94Å; F160-F176 HydrophobicContact CE1-CZ 4.21Å; F160-F176 AromaticContact CZ-CE2 3.68Å; F160-F176 HydrophobicContact CZ-CE2 3.68Å; F160-F176 AromaticContact CZ-CZ 3.75Å; F160-F176 HydrophobicContact CZ-CZ 3.75Å; F176-S180 WeakPolarHBondContact O-CB 3.5Å; F176-S180 PolarHBondContact O-N 3.33Å; F176-S180 PolarHBondContact O-OG 3Å |
| 177 | G | 92.8 | Very high | 91.3 | Very high | 38 Ų | 38 | 72.4 Ų | 72.4 | 39% | 0.392 | 41% | 0.409 | S | S | . | . | H | α-helix | trans | -65.5 | -39.2 | 176.4 | 0 | 0 | 0 | 0 | 0 | 113.3 | S175 K181 | S175-G177 PolarHBondContact O-N 2.82Å; S175-G177 VanDerWaalsContact O-N 3.08Å; G177-K181 WeakPolarHBondContact O-CG 3.19Å; G177-K181 PolarHBondContact O-N 2.93Å |
| 178 | E | 91.7 | Very high | 91.5 | Very high | 110 Ų | 110 | 77.4 Ų | 77.4 | 51% | 0.514 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -69.2 | -46.5 | 176.4 | -63 | 170.2 | 136.9 | 0 | 0 | 110.3 | S175 S180 K181 I182 | S175-E178 PolarHBondContact N-OE2 3.23Å; S175-E178 WeakPolarHBondContact O-CB 3.49Å; S175-E178 PolarHBondContact O-N 2.86Å; E178-S180 VanDerWaalsContact C-N 3.28Å; E178-S180 PolarHBondContact O-N 2.88Å; E178-K181 PolarHBondContact O-N 3.38Å; E178-I182 WeakPolarHBondContact O-CG1 3.27Å; E178-I182 PolarHBondContact O-N 3.5Å; E178-I182 VanDerWaalsContact O-N 3.07Å |
| 179 | V | 92.4 | Very high | 91.7 | Very high | 4 Ų | 4 | 74.9 Ų | 74.9 | 2% | 0.024 | 44% | 0.444 | C | S | . | . | H | α-helix | trans | -58.2 | -43.2 | 176.8 | -177.5 | 0 | 0 | 0 | 0 | 110.8 | Q164 I167 A174 S175 K181 I182 V183 | Q164-V179 HydrophobicContact CB-CG1 4.19Å; Q164-V179 HydrophobicContact CG-CG1 3.76Å; I167-V179 HydrophobicContact CB-CG1 4.06Å; I167-V179 HydrophobicContact CD1-CG1 4.06Å; I167-V179 HydrophobicContact CG2-CB 4.43Å; I167-V179 HydrophobicContact CG2-CG1 4.02Å; I167-V179 HydrophobicContact CG2-CG2 3.89Å; A174-V179 HydrophobicContact CB-CG2 3.95Å; S175-V179 WeakPolarHBondContact O-CG2 3.49Å; S175-V179 PolarHBondContact O-N 3.48Å; V179-K181 VanDerWaalsContact C-N 3.34Å; V179-K181 PolarHBondContact O-N 3.15Å; V179-I182 PolarHBondContact O-N 3.26Å; V179-V183 HydrophobicContact CG1-CG2 4.26Å; V179-V183 VanDerWaalsContact O-CG2 3.24Å; V179-V183 WeakPolarHBondContact O-CG2 3.17Å; V179-V183 PolarHBondContact O-N 2.89Å |
| 180 | S | 92.9 | Very high | 91.8 | Very high | 30 Ų | 30 | 73.9 Ų | 73.9 | 21% | 0.21 | 42% | 0.424 | C | S | . | . | H | α-helix | trans | -62.5 | -39.5 | 179.7 | -59.3 | 0 | 0 | 0 | 0 | 112.6 | F176 E178 A184 | F176-S180 WeakPolarHBondContact O-CB 3.5Å; F176-S180 PolarHBondContact O-N 3.33Å; F176-S180 PolarHBondContact O-OG 3Å; E178-S180 VanDerWaalsContact C-N 3.28Å; E178-S180 PolarHBondContact O-N 2.88Å; S180-A184 PolarHBondContact O-N 3.27Å; S180-A184 VanDerWaalsContact O-N 3.07Å |
| 181 | K | 93.9 | Very high | 92 | Very high | 161 Ų | 161 | 71.7 Ų | 71.7 | 70% | 0.7 | 42% | 0.417 | S | S | * | . | H | α-helix | trans | -65.2 | -43.3 | 176.1 | -71.4 | 174.7 | -178.7 | -177.4 | 0 | 111.9 | G177 E178 V179 A184 A185 | G177-K181 WeakPolarHBondContact O-CG 3.19Å; G177-K181 PolarHBondContact O-N 2.93Å; E178-K181 PolarHBondContact O-N 3.38Å; V179-K181 VanDerWaalsContact C-N 3.34Å; V179-K181 PolarHBondContact O-N 3.15Å; K181-A184 PolarHBondContact O-N 3.37Å; K181-A185 PolarHBondContact O-N 3.48Å; K181-A185 VanDerWaalsContact O-N 3.1Å |
| 182 | I | 92.7 | Very high | 92.4 | Very high | 73 Ų | 73 | 71.5 Ų | 71.5 | 37% | 0.374 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -63.6 | -44.9 | 178.3 | -63 | 164.2 | 0 | 0 | 0 | 110.3 | I167 E178 V179 A184 A185 M186 | I167-I182 HydrophobicContact CD1-CB 3.99Å; I167-I182 HydrophobicContact CD1-CG2 3.57Å; E178-I182 WeakPolarHBondContact O-CG1 3.27Å; E178-I182 PolarHBondContact O-N 3.5Å; E178-I182 VanDerWaalsContact O-N 3.07Å; V179-I182 PolarHBondContact O-N 3.26Å; I182-A184 VanDerWaalsContact C-N 3.34Å; I182-A184 PolarHBondContact O-N 3.39Å; I182-A185 PolarHBondContact O-N 2.83Å; I182-M186 HydrophobicContact CG2-CG 4.38Å; I182-M186 HydrophobicContact CG2-SD 4.18Å; I182-M186 WeakPolarHBondContact O-CG 3.43Å; I182-M186 PolarHBondContact O-N 3.14Å |
| 183 | V | 94.9 | Very high | 92.7 | Very high | 0 Ų | 0 | 74.2 Ų | 74.2 | 0% | 0 | 43% | 0.428 | C | S | . | . | H | α-helix | trans | -61.1 | -42.5 | 178.1 | 173.8 | 0 | 0 | 0 | 0 | 111.6 | Y156 F159 F160 T163 I167 V179 M186 W187 | Y156-V183 HydrophobicContact CE2-CG1 4.43Å; F159-V183 HydrophobicContact CD1-CG1 4.01Å; F159-V183 HydrophobicContact CE1-CG1 3.92Å; F160-V183 HydrophobicContact CB-CG1 4.14Å; F160-V183 HydrophobicContact CD2-CB 4.09Å; F160-V183 HydrophobicContact CD2-CG1 3.53Å; F160-V183 HydrophobicContact CD2-CG2 4.44Å; F160-V183 HydrophobicContact CE2-CB 4.33Å; F160-V183 HydrophobicContact CE2-CG1 4.26Å; F160-V183 HydrophobicContact CG-CG1 4.13Å; T163-V183 HydrophobicContact CG2-CG2 3.81Å; I167-V183 HydrophobicContact CD1-CG2 3.86Å; V179-V183 HydrophobicContact CG1-CG2 4.26Å; V179-V183 VanDerWaalsContact O-CG2 3.24Å; V179-V183 WeakPolarHBondContact O-CG2 3.17Å; V179-V183 PolarHBondContact O-N 2.89Å; V183-M186 PolarHBondContact O-N 2.97Å; V183-W187 WeakPolarHBondContact O-CB 3.15Å; V183-W187 PolarHBondContact O-N 2.97Å |
| 184 | A | 94.7 | Very high | 93 | Very high | 32 Ų | 32 | 68.2 Ų | 68.2 | 26% | 0.264 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -60.5 | -49.1 | 177.1 | 0 | 0 | 0 | 0 | 0 | 111.3 | S180 K181 I182 M186 W187 D188 | S180-A184 PolarHBondContact O-N 3.27Å; S180-A184 VanDerWaalsContact O-N 3.07Å; K181-A184 PolarHBondContact O-N 3.37Å; I182-A184 VanDerWaalsContact C-N 3.34Å; I182-A184 PolarHBondContact O-N 3.39Å; A184-M186 VanDerWaalsContact C-N 3.31Å; A184-M186 PolarHBondContact O-N 3.41Å; A184-W187 WeakPolarHBondContact O-CB 3.22Å; A184-W187 PolarHBondContact O-N 3.38Å; A184-W187 VanDerWaalsContact O-N 3.13Å; A184-D188 PolarHBondContact O-N 3.29Å |
| 185 | A | 94.8 | Very high | 93.4 | Very high | 65 Ų | 65 | 69.3 Ų | 69.3 | 54% | 0.537 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -60 | -40.1 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | K181 I182 D188 G189 | K181-A185 PolarHBondContact O-N 3.48Å; K181-A185 VanDerWaalsContact O-N 3.1Å; I182-A185 PolarHBondContact O-N 2.83Å; A185-D188 PolarHBondContact O-N 3.25Å; A185-G189 PolarHBondContact O-N 3.36Å |
| 186 | M | 93.5 | Very high | 93.6 | Very high | 48 Ų | 48 | 69.3 Ų | 69.3 | 24% | 0.236 | 39% | 0.394 | C | S | . | . | H | α-helix | trans | -66.1 | -39.9 | 175.3 | -71.9 | -177 | 71.9 | 0 | 0 | 112.3 | Y54 F159 T163 I182 V183 A184 D188 G189 L190 | Y54-M186 HydrophobicContact CE1-CE 3.84Å; Y54-M186 HydrophobicContact CE1-SD 3.73Å; Y54-M186 WeakPolarHBondContact OH-CE 2.79Å; F159-M186 HydrophobicContact CE1-CB 4.13Å; F159-M186 HydrophobicContact CZ-CB 3.85Å; T163-M186 HydrophobicContact CG2-CE 3.96Å; T163-M186 HydrophobicContact CG2-SD 3.46Å; T163-M186 WeakPolarHBondContact CG2-SD 3.25Å; I182-M186 HydrophobicContact CG2-CG 4.38Å; I182-M186 HydrophobicContact CG2-SD 4.18Å; I182-M186 WeakPolarHBondContact O-CG 3.43Å; I182-M186 PolarHBondContact O-N 3.14Å; V183-M186 PolarHBondContact O-N 2.97Å; A184-M186 VanDerWaalsContact C-N 3.31Å; A184-M186 PolarHBondContact O-N 3.41Å; M186-D188 VanDerWaalsContact C-N 3.34Å; M186-G189 CarbonylContact O-C 3.59Å; M186-G189 PolarHBondContact O-N 3.48Å; M186-L190 WeakPolarHBondContact O-CG 3.4Å; M186-L190 PolarHBondContact O-N 3.44Å |
| 187 | W | 94.8 | Very high | 93.9 | Very high | 41 Ų | 41 | 66.2 Ų | 66.2 | 16% | 0.155 | 39% | 0.388 | C | S | . | . | H | α-helix | trans | -62.8 | -43.9 | 177 | 176.4 | -104.1 | 0 | 0 | 0 | 111.1 | A155 Y156 F159 V183 A184 G189 L190 K195 Y198 | A155-W187 HydrophobicContact CB-CH2 4.14Å; Y156-W187 HydrophobicContact CD2-CB 3.91Å; Y156-W187 AromaticContact CD2-CD1 3.69Å; Y156-W187 AromaticContact CD2-CD2 3.66Å; Y156-W187 HydrophobicContact CD2-CD2 3.66Å; Y156-W187 AromaticContact CD2-CE2 3.98Å; Y156-W187 HydrophobicContact CD2-CE3 4.27Å; Y156-W187 AromaticContact CD2-CG 3.45Å; Y156-W187 HydrophobicContact CD2-CG 3.45Å; Y156-W187 VanDerWaalsContact CD2-CG 3.45Å; Y156-W187 AromaticContact CD2-NE1 3.97Å; Y156-W187 HydrophobicContact CE2-CB 3.71Å; Y156-W187 HydrophobicContact CE2-CD2 4.39Å; Y156-W187 AromaticContact CE2-CG 3.74Å; Y156-W187 HydrophobicContact CE2-CG 3.74Å; F159-W187 HydrophobicContact CB-CE3 3.79Å; F159-W187 HydrophobicContact CB-CZ3 3.84Å; F159-W187 HydrophobicContact CD1-CB 3.92Å; F159-W187 HydrophobicContact CD1-CD2 4.28Å; F159-W187 AromaticContact CD1-CE3 3.57Å; F159-W187 HydrophobicContact CD1-CE3 3.57Å; F159-W187 HydrophobicContact CD1-CG 4.45Å; F159-W187 HydrophobicContact CD1-CZ3 4.45Å; F159-W187 HydrophobicContact CD2-CE3 4.32Å; F159-W187 HydrophobicContact CE1-CB 3.76Å; F159-W187 HydrophobicContact CE1-CE3 4.23Å; F159-W187 AromaticContact CG-CE3 3.61Å; F159-W187 HydrophobicContact CG-CE3 3.61Å; F159-W187 HydrophobicContact CG-CZ3 4.07Å; V183-W187 WeakPolarHBondContact O-CB 3.15Å; V183-W187 PolarHBondContact O-N 2.97Å; A184-W187 WeakPolarHBondContact O-CB 3.22Å; A184-W187 PolarHBondContact O-N 3.38Å; A184-W187 VanDerWaalsContact O-N 3.13Å; W187-G189 VanDerWaalsContact C-N 3.3Å; W187-G189 PolarHBondContact O-N 3.24Å; W187-L190 HydrophobicContact CE3-CD1 3.82Å; W187-L190 HydrophobicContact CZ3-CD1 4.18Å; W187-L190 PolarHBondContact O-N 2.9Å; W187-K195 HydrophobicContact CH2-CB 4.21Å; W187-K195 HydrophobicContact CH2-CG 3.94Å; W187-K195 HydrophobicContact CZ2-CG 4.09Å; W187-K195 HydrophobicContact CZ3-CG 4.17Å; W187-K195 WeakPolarHBondContact O-CE 3.44Å; W187-K195 PolarHBondContact O-NZ 3.45Å; W187-K195 VanDerWaalsContact O-NZ 3.15Å; W187-Y198 HydrophobicContact CZ3-CD2 4.16Å; W187-Y198 HydrophobicContact CZ3-CG 4.45Å |
| 188 | D | 94.9 | Very high | 94 | Very high | 116 Ų | 116 | 66.5 Ų | 66.5 | 62% | 0.62 | 38% | 0.378 | S | S | * | . | H | α-helix | trans | -64 | -38.7 | 178.4 | -66.3 | -27 | 0 | 0 | 0 | 111.2 | A184 A185 M186 L190 K195 | A184-D188 PolarHBondContact O-N 3.29Å; A185-D188 PolarHBondContact O-N 3.25Å; M186-D188 VanDerWaalsContact C-N 3.34Å; D188-L190 PolarHBondContact O-N 2.87Å; D188-K195 PolarHBondContact O-NZ 2.95Å |
| 189 | G | 94.3 | Very high | 94.1 | Very high | 69 Ų | 69 | 66.5 Ų | 66.5 | 71% | 0.711 | 38% | 0.376 | S | S | * | . | H | α-helix | trans | -77.7 | -7 | 176.6 | 0 | 0 | 0 | 0 | 0 | 116.7 | A185 M186 W187 | A185-G189 PolarHBondContact O-N 3.36Å; M186-G189 CarbonylContact O-C 3.59Å; M186-G189 PolarHBondContact O-N 3.48Å; W187-G189 VanDerWaalsContact C-N 3.3Å; W187-G189 PolarHBondContact O-N 3.24Å |
| 190 | L | 93 | Very high | 94.3 | Very high | 40 Ų | 40 | 71.2 Ų | 71.2 | 21% | 0.209 | 40% | 0.398 | C | S | . | . | S | Bend | trans | -69.6 | 141.3 | 174.4 | -83.3 | 176.1 | 0 | 0 | 0 | 111.2 | F159 M186 W187 D188 A194 K195 Y198 | F159-L190 HydrophobicContact CD2-CD1 3.77Å; F159-L190 HydrophobicContact CE1-CD1 4.37Å; F159-L190 HydrophobicContact CE2-CD1 3.46Å; F159-L190 VanDerWaalsContact CE2-CD1 3.46Å; F159-L190 HydrophobicContact CE2-CG 4.33Å; F159-L190 HydrophobicContact CG-CD1 4.36Å; F159-L190 HydrophobicContact CZ-CD1 3.77Å; F159-L190 HydrophobicContact CZ-CG 4.38Å; M186-L190 WeakPolarHBondContact O-CG 3.4Å; M186-L190 PolarHBondContact O-N 3.44Å; W187-L190 HydrophobicContact CE3-CD1 3.82Å; W187-L190 HydrophobicContact CZ3-CD1 4.18Å; W187-L190 PolarHBondContact O-N 2.9Å; D188-L190 PolarHBondContact O-N 2.87Å; L190-A194 HydrophobicContact CB-CB 4.5Å; L190-A194 HydrophobicContact CD2-CB 3.99Å; L190-K195 HydrophobicContact CB-CG 4.04Å; L190-K195 VanDerWaalsContact O-CE 3.25Å; L190-K195 WeakPolarHBondContact O-CE 3.39Å; L190-K195 PolarHBondContact O-NZ 3.17Å; L190-Y198 HydrophobicContact CD1-CE2 4.29Å |
| 191 | D | 94.5 | Very high | 94.3 | Very high | 107 Ų | 107 | 75.4 Ų | 75.4 | 57% | 0.572 | 41% | 0.409 | S | S | * | . | trans | -64.3 | 154.6 | 173.3 | -164 | 13 | 0 | 0 | 0 | 111.6 | E193 A194 K195 | D191-E193 PolarHBondContact O-N 3.09Å; D191-A194 PolarHBondContact O-N 3.39Å; D191-K195 PolarHBondContact O-N 3.14Å | ||
| 192 | S | 93.2 | Very high | 94.3 | Very high | 87 Ų | 87 | 68.9 Ų | 68.9 | 61% | 0.608 | 38% | 0.383 | S | S | * | . | H | α-helix | trans | -56.1 | -37.6 | 179.4 | 61.8 | 0 | 0 | 0 | 0 | 112.4 | K195 N196 | S192-K195 PolarHBondContact O-N 2.85Å; S192-N196 VanDerWaalsContact O-CB 3.29Å; S192-N196 WeakPolarHBondContact O-CB 3.32Å; S192-N196 PolarHBondContact O-N 3.3Å |
| 193 | E | 94.8 | Very high | 94.4 | Very high | 150 Ų | 150 | 70.3 Ų | 70.3 | 70% | 0.701 | 39% | 0.388 | S | S | * | . | H | α-helix | trans | -64.7 | -46.6 | 176.7 | -172.2 | 179.4 | -175.5 | 0 | 0 | 111.8 | D191 K195 N196 S197 | D191-E193 PolarHBondContact O-N 3.09Å; E193-K195 PolarHBondContact O-N 3.49Å; E193-N196 WeakPolarHBondContact O-CB 3.42Å; E193-N196 PolarHBondContact O-N 2.89Å; E193-N196 VanDerWaalsContact O-N 3.14Å; E193-S197 PolarHBondContact O-N 3.15Å |
| 194 | A | 93.6 | Very high | 94.4 | Very high | 34 Ų | 34 | 75.1 Ų | 75.1 | 28% | 0.281 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -62.9 | -44.8 | 177 | 0 | 0 | 0 | 0 | 0 | 111.1 | L190 D191 N196 S197 Y198 | L190-A194 HydrophobicContact CB-CB 4.5Å; L190-A194 HydrophobicContact CD2-CB 3.99Å; D191-A194 PolarHBondContact O-N 3.39Å; A194-N196 VanDerWaalsContact C-N 3.28Å; A194-N196 PolarHBondContact O-N 3.4Å; A194-S197 WeakPolarHBondContact O-CB 3.34Å; A194-S197 PolarHBondContact O-N 3.32Å; A194-Y198 WeakPolarHBondContact O-CD2 3.24Å; A194-Y198 PolarHBondContact O-N 2.97Å |
| 195 | K | 93.6 | Very high | 94.3 | Very high | 51 Ų | 51 | 75.7 Ų | 75.7 | 22% | 0.222 | 42% | 0.418 | C | S | . | . | H | α-helix | trans | -57.5 | -42.2 | 172.9 | -74.6 | 171.2 | 173.5 | 149.4 | 0 | 111.3 | W187 D188 L190 D191 S192 E193 Y198 K199 | W187-K195 HydrophobicContact CH2-CB 4.21Å; W187-K195 HydrophobicContact CH2-CG 3.94Å; W187-K195 HydrophobicContact CZ2-CG 4.09Å; W187-K195 HydrophobicContact CZ3-CG 4.17Å; W187-K195 WeakPolarHBondContact O-CE 3.44Å; W187-K195 PolarHBondContact O-NZ 3.45Å; W187-K195 VanDerWaalsContact O-NZ 3.15Å; D188-K195 PolarHBondContact O-NZ 2.95Å; L190-K195 HydrophobicContact CB-CG 4.04Å; L190-K195 VanDerWaalsContact O-CE 3.25Å; L190-K195 WeakPolarHBondContact O-CE 3.39Å; L190-K195 PolarHBondContact O-NZ 3.17Å; D191-K195 PolarHBondContact O-N 3.14Å; S192-K195 PolarHBondContact O-N 2.85Å; E193-K195 PolarHBondContact O-N 3.49Å; K195-Y198 PolarHBondContact O-N 3.04Å; K195-K199 WeakPolarHBondContact O-CG 3.42Å; K195-K199 PolarHBondContact O-N 3.35Å |
| 196 | N | 94.9 | Very high | 94.2 | Very high | 74 Ų | 74 | 78.7 Ų | 78.7 | 40% | 0.396 | 42% | 0.419 | S | S | . | . | H | α-helix | trans | -66.3 | -38.3 | 179.2 | -163 | 35.7 | 0 | 0 | 0 | 112.3 | S192 E193 A194 Y198 K199 Q200 | S192-N196 VanDerWaalsContact O-CB 3.29Å; S192-N196 WeakPolarHBondContact O-CB 3.32Å; S192-N196 PolarHBondContact O-N 3.3Å; E193-N196 WeakPolarHBondContact O-CB 3.42Å; E193-N196 PolarHBondContact O-N 2.89Å; E193-N196 VanDerWaalsContact O-N 3.14Å; A194-N196 VanDerWaalsContact C-N 3.28Å; A194-N196 PolarHBondContact O-N 3.4Å; N196-Y198 VanDerWaalsContact C-N 3.31Å; N196-Y198 PolarHBondContact O-N 2.88Å; N196-K199 WeakPolarHBondContact O-CA 3.5Å; N196-K199 WeakPolarHBondContact O-CB 3.45Å; N196-K199 PolarHBondContact O-N 3.03Å; N196-K199 VanDerWaalsContact O-N 3.09Å; N196-Q200 PolarHBondContact ND2-NE2 3.47Å; N196-Q200 WeakPolarHBondContact O-CG 3.29Å; N196-Q200 PolarHBondContact O-N 2.96Å |
| 197 | S | 95.5 | Very high | 94.2 | Very high | 60 Ų | 60 | 82.5 Ų | 82.5 | 42% | 0.42 | 43% | 0.434 | S | S | . | . | H | α-helix | trans | -56.6 | -44.7 | 172.8 | -176.2 | 0 | 0 | 0 | 0 | 111.6 | E193 A194 K199 Q200 R201 | E193-S197 PolarHBondContact O-N 3.15Å; A194-S197 WeakPolarHBondContact O-CB 3.34Å; A194-S197 PolarHBondContact O-N 3.32Å; S197-K199 PolarHBondContact O-N 2.88Å; S197-Q200 PolarHBondContact O-N 3.13Å; S197-R201 WeakPolarHBondContact O-CG 3.35Å; S197-R201 PolarHBondContact O-N 3.09Å |
| 198 | Y | 95.3 | Very high | 94.1 | Very high | 44 Ų | 44 | 84 Ų | 84 | 17% | 0.173 | 45% | 0.445 | C | S | . | . | H | α-helix | trans | -65.6 | -36.6 | 174.7 | -72.4 | -75.2 | 0 | 0 | 0 | 112.9 | L158 F159 W187 L190 A194 K195 N196 R201 T202 | L158-Y198 HydrophobicContact CB-CD1 4.46Å; L158-Y198 HydrophobicContact CD2-CD1 4.04Å; L158-Y198 HydrophobicContact CG-CD1 4.15Å; F159-Y198 HydrophobicContact CB-CD1 4.37Å; F159-Y198 HydrophobicContact CB-CE1 4.33Å; F159-Y198 HydrophobicContact CD2-CD2 4.48Å; F159-Y198 HydrophobicContact CD2-CE1 4.38Å; F159-Y198 AromaticContact CD2-CE2 3.8Å; F159-Y198 HydrophobicContact CD2-CE2 3.8Å; F159-Y198 AromaticContact CD2-CZ 3.75Å; W187-Y198 HydrophobicContact CZ3-CD2 4.16Å; W187-Y198 HydrophobicContact CZ3-CG 4.45Å; L190-Y198 HydrophobicContact CD1-CE2 4.29Å; A194-Y198 WeakPolarHBondContact O-CD2 3.24Å; A194-Y198 PolarHBondContact O-N 2.97Å; K195-Y198 PolarHBondContact O-N 3.04Å; N196-Y198 VanDerWaalsContact C-N 3.31Å; N196-Y198 PolarHBondContact O-N 2.88Å; Y198-R201 PolarHBondContact O-N 3.09Å; Y198-T202 WeakPolarHBondContact O-CB 3.42Å; Y198-T202 PolarHBondContact O-N 3.47Å; Y198-T202 PolarHBondContact O-OG1 3.47Å |
| 199 | K | 94.7 | Very high | 94 | Very high | 111 Ų | 111 | 79.5 Ų | 79.5 | 48% | 0.483 | 42% | 0.419 | S | S | . | . | H | α-helix | trans | -60.5 | -49.6 | 173.1 | -69.6 | -179.5 | 178.2 | -172.5 | 0 | 111.3 | A155 K195 N196 S197 R201 T202 E203 | A155-K199 HydrophobicContact CB-CG 4.02Å; K195-K199 WeakPolarHBondContact O-CG 3.42Å; K195-K199 PolarHBondContact O-N 3.35Å; N196-K199 WeakPolarHBondContact O-CA 3.5Å; N196-K199 WeakPolarHBondContact O-CB 3.45Å; N196-K199 PolarHBondContact O-N 3.03Å; N196-K199 VanDerWaalsContact O-N 3.09Å; S197-K199 PolarHBondContact O-N 2.88Å; K199-R201 PolarHBondContact O-N 3.42Å; K199-T202 WeakPolarHBondContact O-CB 3.45Å; K199-T202 PolarHBondContact O-N 2.9Å; K199-T202 VanDerWaalsContact O-N 3.13Å; K199-E203 WeakPolarHBondContact O-CG 3.25Å; K199-E203 PolarHBondContact O-N 3.44Å |
| 200 | Q | 95.7 | Very high | 93.8 | Very high | 102 Ų | 102 | 80 Ų | 80 | 48% | 0.477 | 41% | 0.405 | S | S | . | . | H | α-helix | trans | -59.7 | -43.4 | 177.3 | -68.6 | 178.7 | 27.3 | 0 | 0 | 112.1 | N196 S197 T202 E203 L204 | N196-Q200 PolarHBondContact ND2-NE2 3.47Å; N196-Q200 WeakPolarHBondContact O-CG 3.29Å; N196-Q200 PolarHBondContact O-N 2.96Å; S197-Q200 PolarHBondContact O-N 3.13Å; Q200-T202 VanDerWaalsContact C-N 3.33Å; Q200-T202 PolarHBondContact O-N 3.13Å; Q200-E203 PolarHBondContact O-N 3.29Å; Q200-L204 WeakPolarHBondContact O-CG 3.19Å; Q200-L204 PolarHBondContact O-N 3.26Å |
| 201 | R | 93.3 | Very high | 93.8 | Very high | 118 Ų | 118 | 84.9 Ų | 84.9 | 45% | 0.445 | 43% | 0.425 | S | S | . | . | H | α-helix | trans | -59.8 | -43.2 | 175 | -71.2 | 176.7 | 74 | -162.7 | 0.4 | 111.7 | L158 D162 S197 Y198 K199 A205 | L158-R201 HydrophobicContact CD2-CB 3.84Å; D162-R201 IonicContact OD2-NH1 4Å; S197-R201 WeakPolarHBondContact O-CG 3.35Å; S197-R201 PolarHBondContact O-N 3.09Å; Y198-R201 PolarHBondContact O-N 3.09Å; K199-R201 PolarHBondContact O-N 3.42Å; R201-A205 WeakPolarHBondContact O-CB 3.2Å; R201-A205 PolarHBondContact O-N 3.23Å |
| 202 | T | 93.7 | Very high | 93.5 | Very high | 24 Ų | 24 | 85.1 Ų | 85.1 | 15% | 0.147 | 42% | 0.423 | C | S | . | . | H | α-helix | trans | -64.5 | -40.8 | 175.2 | -74.8 | 0 | 0 | 0 | 0 | 112.1 | V153 A155 Y198 K199 Q200 A205 K206 | V153-T202 WeakPolarHBondContact O-CG2 3.47Å; V153-T202 PolarHBondContact O-OG1 3.43Å; A155-T202 WeakPolarHBondContact CA-OG1 3.4Å; A155-T202 PolarHBondContact N-OG1 3.35Å; A155-T202 VanDerWaalsContact N-OG1 3.15Å; Y198-T202 WeakPolarHBondContact O-CB 3.42Å; Y198-T202 PolarHBondContact O-N 3.47Å; Y198-T202 PolarHBondContact O-OG1 3.47Å; K199-T202 WeakPolarHBondContact O-CB 3.45Å; K199-T202 PolarHBondContact O-N 2.9Å; K199-T202 VanDerWaalsContact O-N 3.13Å; Q200-T202 VanDerWaalsContact C-N 3.33Å; Q200-T202 PolarHBondContact O-N 3.13Å; T202-A205 PolarHBondContact O-N 3.37Å; T202-K206 WeakPolarHBondContact O-CB 3.48Å; T202-K206 PolarHBondContact O-N 3.21Å |
| 203 | E | 94.3 | Very high | 93.3 | Very high | 104 Ų | 104 | 84.7 Ų | 84.7 | 49% | 0.486 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -65.5 | -43 | 177.7 | -74.3 | 173.5 | -171.9 | 0 | 0 | 112.6 | K199 Q200 K206 K207 | K199-E203 WeakPolarHBondContact O-CG 3.25Å; K199-E203 PolarHBondContact O-N 3.44Å; Q200-E203 PolarHBondContact O-N 3.29Å; E203-K206 WeakPolarHBondContact O-CB 3.49Å; E203-K206 PolarHBondContact O-N 2.93Å; E203-K207 WeakPolarHBondContact O-CG 3.24Å; E203-K207 PolarHBondContact O-N 3.3Å |
| 204 | L | 94.6 | Very high | 93 | Very high | 101 Ų | 101 | 80.4 Ų | 80.4 | 53% | 0.529 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -59.6 | -48.7 | 173.2 | -72 | 172.3 | 0 | 0 | 0 | 110.6 | Q200 K206 K207 D208 | Q200-L204 WeakPolarHBondContact O-CG 3.19Å; Q200-L204 PolarHBondContact O-N 3.26Å; L204-K206 PolarHBondContact O-N 3.18Å; L204-K207 WeakPolarHBondContact O-CB 3.2Å; L204-K207 PolarHBondContact O-N 3.1Å; L204-K207 VanDerWaalsContact O-N 3.1Å; L204-D208 PolarHBondContact O-N 3.18Å |
| 205 | A | 93.2 | Very high | 92.8 | Very high | 44 Ų | 44 | 81.5 Ų | 81.5 | 36% | 0.364 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -60.1 | -33.7 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | P152 R201 T202 Y209 | P152-A205 HydrophobicContact CB-CB 3.97Å; R201-A205 WeakPolarHBondContact O-CB 3.2Å; R201-A205 PolarHBondContact O-N 3.23Å; T202-A205 PolarHBondContact O-N 3.37Å; A205-Y209 VanDerWaalsContact O-CB 3.24Å; A205-Y209 WeakPolarHBondContact O-CB 3.33Å; A205-Y209 PolarHBondContact O-N 2.88Å |
| 206 | K | 92.3 | Very high | 92.5 | Very high | 128 Ų | 128 | 81.7 Ų | 81.7 | 56% | 0.557 | 41% | 0.406 | S | S | * | . | H | α-helix | trans | -67.2 | -44 | 174.2 | -174.3 | -178 | 178.1 | -175.6 | 0 | 111.9 | P152 T202 E203 L204 D208 Y209 L210 | P152-K206 HydrophobicContact CB-CB 4.41Å; P152-K206 HydrophobicContact CG-CB 3.9Å; P152-K206 HydrophobicContact CG-CG 4.24Å; T202-K206 WeakPolarHBondContact O-CB 3.48Å; T202-K206 PolarHBondContact O-N 3.21Å; E203-K206 WeakPolarHBondContact O-CB 3.49Å; E203-K206 PolarHBondContact O-N 2.93Å; L204-K206 PolarHBondContact O-N 3.18Å; K206-D208 VanDerWaalsContact C-N 3.35Å; K206-Y209 PolarHBondContact O-N 3.36Å; K206-L210 WeakPolarHBondContact O-CG 3.37Å; K206-L210 PolarHBondContact O-N 3.46Å |
| 207 | K | 93.5 | Very high | 92.1 | Very high | 127 Ų | 127 | 84.6 Ų | 84.6 | 55% | 0.552 | 41% | 0.412 | S | S | * | . | H | α-helix | trans | -60.7 | -45.1 | 175 | -71.4 | 175 | -179.6 | 174.1 | 0 | 110.9 | E203 L204 L210 K211 | E203-K207 WeakPolarHBondContact O-CG 3.24Å; E203-K207 PolarHBondContact O-N 3.3Å; L204-K207 WeakPolarHBondContact O-CB 3.2Å; L204-K207 PolarHBondContact O-N 3.1Å; L204-K207 VanDerWaalsContact O-N 3.1Å; K207-L210 PolarHBondContact O-N 2.93Å; K207-K211 PolarHBondContact O-N 3.25Å |
| 208 | D | 92.6 | Very high | 91.7 | Very high | 74 Ų | 74 | 85 Ų | 85 | 40% | 0.396 | 42% | 0.419 | S | S | . | . | H | α-helix | trans | -67.9 | -40.4 | 179 | -70 | -18.4 | 0 | 0 | 0 | 112.4 | L204 K206 L210 K211 Q212 | L204-D208 PolarHBondContact O-N 3.18Å; K206-D208 VanDerWaalsContact C-N 3.35Å; D208-L210 VanDerWaalsContact C-N 3.3Å; D208-L210 PolarHBondContact O-N 2.86Å; D208-K211 PolarHBondContact O-N 2.95Å; D208-K211 IonicContact OD1-NZ 3.63Å; D208-Q212 WeakPolarHBondContact O-CB 3.03Å; D208-Q212 WeakPolarHBondContact O-CG 3.49Å; D208-Q212 PolarHBondContact O-N 3.01Å |
| 209 | Y | 92.8 | Very high | 91.1 | Very high | 20 Ų | 20 | 86.8 Ų | 86.8 | 8% | 0.078 | 44% | 0.435 | C | S | . | . | H | α-helix | trans | -57.9 | -41 | 172.9 | 165.5 | -100.9 | 0 | 0 | 0 | 112.1 | P149 Q150 K151 A205 K206 R213 | P149-Y209 HydrophobicContact CB-CD2 3.86Å; P149-Y209 HydrophobicContact CB-CE2 4.19Å; P149-Y209 HydrophobicContact CG-CD2 4.37Å; P149-Y209 HydrophobicContact CG-CE2 4.29Å; P149-Y209 WeakPolarHBondContact O-CE2 3.36Å; Q150-Y209 VanDerWaalsContact O-CD2 3.25Å; Q150-Y209 WeakPolarHBondContact O-CD2 3.27Å; K151-Y209 HydrophobicContact CB-CE2 4.49Å; K151-Y209 HydrophobicContact CG-CE1 4.48Å; K151-Y209 HydrophobicContact CG-CE2 4.01Å; K151-Y209 WeakPolarHBondContact CG-OH 3.47Å; A205-Y209 VanDerWaalsContact O-CB 3.24Å; A205-Y209 WeakPolarHBondContact O-CB 3.33Å; A205-Y209 PolarHBondContact O-N 2.88Å; K206-Y209 PolarHBondContact O-N 3.36Å; Y209-R213 WeakPolarHBondContact O-CB 3.41Å; Y209-R213 PolarHBondContact O-N 2.98Å; Y209-R213 WeakPolarHBondContact OH-CD 3.47Å |
| 210 | L | 91.6 | Very high | 90.3 | Very high | 79 Ų | 79 | 85.4 Ų | 85.4 | 41% | 0.414 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -64.8 | -42.8 | 177.5 | -71.6 | 172.4 | 0 | 0 | 0 | 112 | K206 K207 D208 R213 A214 | K206-L210 WeakPolarHBondContact O-CG 3.37Å; K206-L210 PolarHBondContact O-N 3.46Å; K207-L210 PolarHBondContact O-N 2.93Å; D208-L210 VanDerWaalsContact C-N 3.3Å; D208-L210 PolarHBondContact O-N 2.86Å; L210-R213 VanDerWaalsContact CD2-NH2 3.34Å; L210-R213 PolarHBondContact O-N 2.79Å; L210-A214 WeakPolarHBondContact O-CB 3.47Å; L210-A214 PolarHBondContact O-N 3.48Å |
| 211 | K | 91.3 | Very high | 89.2 | Confident | 144 Ų | 144 | 86.5 Ų | 86.5 | 63% | 0.626 | 44% | 0.438 | S | S | * | . | H | α-helix | trans | -61.4 | -51.4 | 175.2 | -68 | 174.7 | -177.5 | 172.2 | 0 | 111.4 | K207 D208 R213 A214 A215 | K207-K211 PolarHBondContact O-N 3.25Å; D208-K211 PolarHBondContact O-N 2.95Å; D208-K211 IonicContact OD1-NZ 3.63Å; K211-R213 VanDerWaalsContact C-N 3.3Å; K211-R213 PolarHBondContact O-N 3.3Å; K211-A214 PolarHBondContact O-N 3.36Å; K211-A215 PolarHBondContact O-N 3.33Å |
| 212 | Q | 90.2 | Very high | 87.6 | Confident | 112 Ų | 112 | 84.6 Ų | 84.6 | 52% | 0.523 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -62.1 | -39 | 178.9 | -68.3 | 174.5 | 32.2 | 0 | 0 | 111.4 | P149 D208 A215 Y216 | P149-Q212 HydrophobicContact CB-CB 3.72Å; P149-Q212 HydrophobicContact CG-CB 4.18Å; D208-Q212 WeakPolarHBondContact O-CB 3.03Å; D208-Q212 WeakPolarHBondContact O-CG 3.49Å; D208-Q212 PolarHBondContact O-N 3.01Å; Q212-A215 PolarHBondContact O-N 3.22Å; Q212-Y216 VanDerWaalsContact O-CB 3.24Å; Q212-Y216 WeakPolarHBondContact O-CB 3.48Å; Q212-Y216 PolarHBondContact O-N 3.43Å |
| 213 | R | 87.9 | Confident | 85.9 | Confident | 78 Ų | 78 | 85.4 Ų | 85.4 | 29% | 0.294 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -66.8 | -37 | 177.3 | -171.8 | 177.3 | 71 | 169 | 0.5 | 112.3 | P149 Y209 L210 K211 R217 | P149-R213 HydrophobicContact CG-CB 3.88Å; P149-R213 HydrophobicContact CG-CG 4.46Å; Y209-R213 WeakPolarHBondContact O-CB 3.41Å; Y209-R213 PolarHBondContact O-N 2.98Å; Y209-R213 WeakPolarHBondContact OH-CD 3.47Å; L210-R213 VanDerWaalsContact CD2-NH2 3.34Å; L210-R213 PolarHBondContact O-N 2.79Å; K211-R213 VanDerWaalsContact C-N 3.3Å; K211-R213 PolarHBondContact O-N 3.3Å; R213-R217 WeakPolarHBondContact O-CB 3.4Å; R213-R217 VanDerWaalsContact O-CG 3.27Å; R213-R217 WeakPolarHBondContact O-CG 3.37Å; R213-R217 PolarHBondContact O-N 2.82Å |
| 214 | A | 89.6 | Confident | 83.9 | Confident | 59 Ų | 59 | 85.6 Ų | 85.6 | 49% | 0.488 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -65.3 | -46.1 | 173.9 | 0 | 0 | 0 | 0 | 0 | 111.2 | L210 K211 R217 A218 | L210-A214 WeakPolarHBondContact O-CB 3.47Å; L210-A214 PolarHBondContact O-N 3.48Å; K211-A214 PolarHBondContact O-N 3.36Å; A214-R217 PolarHBondContact O-N 3Å; A214-A218 PolarHBondContact O-N 2.97Å |
| 215 | A | 88.7 | Confident | 81.2 | Confident | 57 Ų | 57 | 85.5 Ų | 85.5 | 47% | 0.471 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -62.9 | -42.2 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | K211 Q212 R217 A218 T219 | K211-A215 PolarHBondContact O-N 3.33Å; Q212-A215 PolarHBondContact O-N 3.22Å; A215-R217 PolarHBondContact O-N 2.98Å; A215-A218 PolarHBondContact O-N 3.39Å; A215-T219 WeakPolarHBondContact O-CG2 3.12Å; A215-T219 PolarHBondContact O-N 3.06Å; A215-T219 PolarHBondContact O-OG1 3.19Å |
| 216 | Y | 88 | Confident | 78.6 | Confident | 55 Ų | 55 | 91.9 Ų | 91.9 | 22% | 0.216 | 50% | 0.498 | C | S | . | . | H | α-helix | trans | -61.2 | -43.8 | 175.7 | -177.8 | -93.1 | 0 | 0 | 0 | 111.4 | N147 E148 Q212 T219 H220 | N147-Y216 HydrophobicContact CB-CE2 4.16Å; N147-Y216 WeakPolarHBondContact O-CD2 3.21Å; N147-Y216 VanDerWaalsContact O-CE2 3.22Å; N147-Y216 WeakPolarHBondContact O-CE2 3.35Å; E148-Y216 HydrophobicContact CG-CE1 4.43Å; Q212-Y216 VanDerWaalsContact O-CB 3.24Å; Q212-Y216 WeakPolarHBondContact O-CB 3.48Å; Q212-Y216 PolarHBondContact O-N 3.43Å; Y216-T219 WeakPolarHBondContact CA-OG1 3.27Å; Y216-T219 PolarHBondContact O-N 3.23Å; Y216-T219 PolarHBondContact O-OG1 3.49Å; Y216-H220 AromaticContact CD2-CE1 3.4Å; Y216-H220 WeakPolarHBondContact CD2-CE1 3.41Å; Y216-H220 AromaticContact CD2-ND1 3.49Å; Y216-H220 WeakPolarHBondContact CD2-ND1 3.46Å; Y216-H220 HydrophobicContact CE1-CB 4.26Å; Y216-H220 AromaticContact CE1-CD2 3.99Å; Y216-H220 AromaticContact CE1-CG 3.81Å; Y216-H220 AromaticContact CE2-CD2 3.69Å; Y216-H220 AromaticContact CE2-CE1 3.03Å; Y216-H220 WeakPolarHBondContact CE2-CE1 3.16Å; Y216-H220 AromaticContact CE2-CG 3.81Å; Y216-H220 AromaticContact CE2-ND1 3.41Å; Y216-H220 WeakPolarHBondContact CE2-ND1 3.16Å; Y216-H220 AromaticContact CE2-NE2 3.2Å; Y216-H220 WeakPolarHBondContact CE2-NE2 3.44Å; Y216-H220 AromaticContact CG-ND1 3.87Å; Y216-H220 AromaticContact CZ-CD2 3.38Å; Y216-H220 AromaticContact CZ-CE1 3.59Å; Y216-H220 AromaticContact CZ-CG 3.6Å; Y216-H220 AromaticContact CZ-ND1 3.71Å; Y216-H220 AromaticContact CZ-NE2 3.38Å; Y216-H220 VanDerWaalsContact O-CB 3.27Å; Y216-H220 WeakPolarHBondContact O-CB 3.25Å; Y216-H220 PolarHBondContact O-N 3.36Å; Y216-H220 PolarHBondContact O-ND1 2.85Å; Y216-H220 VanDerWaalsContact O-ND1 3.13Å; Y216-H220 PolarHBondContact OH-CD2 3.4Å; Y216-H220 VanDerWaalsContact OH-CD2 3.29Å; Y216-H220 PolarHBondContact OH-NE2 2.98Å |
| 217 | R | 86.1 | Confident | 75.9 | Confident | 136 Ų | 136 | 91.8 Ų | 91.8 | 51% | 0.513 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -61.5 | -48.4 | 174.3 | -76.4 | 174.9 | -178.6 | -175.7 | -3.2 | 111.5 | R213 A214 A215 T219 H220 L221 | R213-R217 WeakPolarHBondContact O-CB 3.4Å; R213-R217 VanDerWaalsContact O-CG 3.27Å; R213-R217 WeakPolarHBondContact O-CG 3.37Å; R213-R217 PolarHBondContact O-N 2.82Å; A214-R217 PolarHBondContact O-N 3Å; A215-R217 PolarHBondContact O-N 2.98Å; R217-T219 VanDerWaalsContact C-N 3.3Å; R217-T219 PolarHBondContact O-N 2.74Å; R217-H220 PolarHBondContact O-N 2.87Å; R217-L221 HydrophobicContact CB-CD1 4.01Å; R217-L221 WeakPolarHBondContact O-CB 3.47Å; R217-L221 VanDerWaalsContact O-CD1 3.25Å; R217-L221 WeakPolarHBondContact O-CD1 3.48Å; R217-L221 WeakPolarHBondContact O-CG 3.4Å; R217-L221 PolarHBondContact O-N 3.27Å |
| 218 | A | 85.7 | Confident | 73.5 | Confident | 69 Ų | 69 | 89.7 Ų | 89.7 | 57% | 0.57 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -58.5 | -42.1 | 180 | 0 | 0 | 0 | 0 | 0 | 112.2 | A214 A215 | A214-A218 PolarHBondContact O-N 2.97Å; A215-A218 PolarHBondContact O-N 3.39Å |
| 219 | T | 84 | Confident | 71.4 | Confident | 81 Ų | 81 | 94.3 Ų | 94.3 | 50% | 0.497 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -72.7 | -45.9 | 177.9 | 53.9 | 0 | 0 | 0 | 0 | 112.7 | A215 Y216 R217 S222 | A215-T219 WeakPolarHBondContact O-CG2 3.12Å; A215-T219 PolarHBondContact O-N 3.06Å; A215-T219 PolarHBondContact O-OG1 3.19Å; Y216-T219 WeakPolarHBondContact CA-OG1 3.27Å; Y216-T219 PolarHBondContact O-N 3.23Å; Y216-T219 PolarHBondContact O-OG1 3.49Å; R217-T219 VanDerWaalsContact C-N 3.3Å; R217-T219 PolarHBondContact O-N 2.74Å; T219-S222 PolarHBondContact O-N 3.12Å; T219-S222 PolarHBondContact O-OG 2.94Å |
| 220 | H | 76.5 | Confident | 69.4 | Low | 82 Ų | 82 | 98.9 Ų | 98.9 | 38% | 0.38 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -78.4 | -26.2 | -174.8 | -74.3 | 59.9 | 0 | 0 | 0 | 113.8 | N147 Y216 R217 S222 G223 | N147-H220 PolarHBondContact ND2-CE1 3.11Å; Y216-H220 AromaticContact CD2-CE1 3.4Å; Y216-H220 WeakPolarHBondContact CD2-CE1 3.41Å; Y216-H220 AromaticContact CD2-ND1 3.49Å; Y216-H220 WeakPolarHBondContact CD2-ND1 3.46Å; Y216-H220 HydrophobicContact CE1-CB 4.26Å; Y216-H220 AromaticContact CE1-CD2 3.99Å; Y216-H220 AromaticContact CE1-CG 3.81Å; Y216-H220 AromaticContact CE2-CD2 3.69Å; Y216-H220 AromaticContact CE2-CE1 3.03Å; Y216-H220 WeakPolarHBondContact CE2-CE1 3.16Å; Y216-H220 AromaticContact CE2-CG 3.81Å; Y216-H220 AromaticContact CE2-ND1 3.41Å; Y216-H220 WeakPolarHBondContact CE2-ND1 3.16Å; Y216-H220 AromaticContact CE2-NE2 3.2Å; Y216-H220 WeakPolarHBondContact CE2-NE2 3.44Å; Y216-H220 AromaticContact CG-ND1 3.87Å; Y216-H220 AromaticContact CZ-CD2 3.38Å; Y216-H220 AromaticContact CZ-CE1 3.59Å; Y216-H220 AromaticContact CZ-CG 3.6Å; Y216-H220 AromaticContact CZ-ND1 3.71Å; Y216-H220 AromaticContact CZ-NE2 3.38Å; Y216-H220 VanDerWaalsContact O-CB 3.27Å; Y216-H220 WeakPolarHBondContact O-CB 3.25Å; Y216-H220 PolarHBondContact O-N 3.36Å; Y216-H220 PolarHBondContact O-ND1 2.85Å; Y216-H220 VanDerWaalsContact O-ND1 3.13Å; Y216-H220 PolarHBondContact OH-CD2 3.4Å; Y216-H220 VanDerWaalsContact OH-CD2 3.29Å; Y216-H220 PolarHBondContact OH-NE2 2.98Å; R217-H220 PolarHBondContact O-N 2.87Å; H220-S222 VanDerWaalsContact C-N 3.26Å; H220-S222 PolarHBondContact O-N 2.89Å; H220-G223 PolarHBondContact O-N 3.18Å |
| 221 | L | 73.2 | Confident | 67.6 | Low | 124 Ų | 124 | 101.3 Ų | 101.3 | 65% | 0.649 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -69.9 | -25.4 | 172.5 | -72.5 | 160.5 | 0 | 0 | 0 | 111.9 | R217 G223 S224 | R217-L221 HydrophobicContact CB-CD1 4.01Å; R217-L221 WeakPolarHBondContact O-CB 3.47Å; R217-L221 VanDerWaalsContact O-CD1 3.25Å; R217-L221 WeakPolarHBondContact O-CD1 3.48Å; R217-L221 WeakPolarHBondContact O-CG 3.4Å; R217-L221 PolarHBondContact O-N 3.27Å; L221-G223 VanDerWaalsContact C-N 3.31Å; L221-S224 PolarHBondContact O-OG 3.13Å |
| 222 | S | 61.1 | Low | 65.7 | Low | 79 Ų | 79 | 99.1 Ų | 99.1 | 55% | 0.552 | 59% | 0.587 | S | S | * | * | G | 310 helix | trans | -78.3 | -13.6 | 172.7 | 74.2 | 0 | 0 | 0 | 0 | 113.7 | T219 H220 C225 | T219-S222 PolarHBondContact O-N 3.12Å; T219-S222 PolarHBondContact O-OG 2.94Å; H220-S222 VanDerWaalsContact C-N 3.26Å; H220-S222 PolarHBondContact O-N 2.89Å; S222-C225 PolarHBondContact O-SG 3.47Å |
| 223 | G | 56.8 | Low | 63.8 | Low | 41 Ų | 41 | 98.6 Ų | 98.6 | 42% | 0.423 | 60% | 0.595 | S | S | . | * | G | 310 helix | trans | -89 | -4.4 | -178.1 | 0 | 0 | 0 | 0 | 0 | 115.5 | H220 L221 C225 | H220-G223 PolarHBondContact O-N 3.18Å; L221-G223 VanDerWaalsContact C-N 3.31Å; G223-C225 PolarHBondContact O-N 3.16Å |
| 224 | S | 52 | Low | 62.1 | Low | 107 Ų | 107 | 100.2 Ų | 100.2 | 75% | 0.748 | 61% | 0.608 | S | S | * | * | G | 310 helix | trans | -81.7 | 3 | 172.5 | 54 | 0 | 0 | 0 | 0 | 113.9 | L221 | L221-S224 PolarHBondContact O-OG 3.13Š|
| 225 | C | 37.5 | Very low | 60.5 | Low | 99 Ų | 99 | 102.8 Ų | 102.8 | 67% | 0.669 | 62% | 0.623 | S | S | * | * | trans | -111.8 | 74.4 | 162.5 | 47.3 | 0 | 0 | 0 | 0 | 110.1 | S222 G223 T227 | S222-C225 PolarHBondContact O-SG 3.47Å; G223-C225 PolarHBondContact O-N 3.16Å; C225-T227 PolarHBondContact O-N 2.92Å | ||
| 226 | Q | 38.8 | Very low | 58.8 | Low | 179 Ų | 179 | 105.7 Ų | 105.7 | 84% | 0.836 | 64% | 0.64 | S | S | * | * | trans | -74.3 | 100.3 | 160 | -71.3 | 175.2 | 48.7 | 0 | 0 | 108.6 | ||||
| 227 | T | 35.7 | Very low | 57.1 | Low | 125 Ų | 125 | 107.2 Ų | 107.2 | 77% | 0.767 | 66% | 0.659 | S | S | * | * | trans | -149.5 | 140.8 | 141.9 | 54.7 | 0 | 0 | 0 | 0 | 108.9 | C225 | C225-T227 PolarHBondContact O-N 2.92Š| ||
| 228 | S | 44.2 | Very low | 55.4 | Low | 84 Ų | 84 | 110.3 Ų | 110.3 | 59% | 0.587 | 67% | 0.672 | S | S | * | * | trans | 74.2 | 98.8 | 161.4 | 54.5 | 0 | 0 | 0 | 0 | 118.7 | D230 | S228-D230 WeakPolarHBondContact CB-OD2 3.35Å; S228-D230 PolarHBondContact O-N 2.59Å | ||
| 229 | D | 47.2 | Very low | 53.5 | Low | 171 Ų | 171 | 111.9 Ų | 111.9 | 91% | 0.914 | 68% | 0.678 | S | S | * | * | S | Bend | trans | -54.3 | 49.1 | 153.8 | -60.9 | -72.7 | 0 | 0 | 0 | 114.8 | ||
| 230 | D | 50.7 | Low | 52 | Low | 116 Ų | 116 | 116.5 Ų | 116.5 | 62% | 0.62 | 70% | 0.699 | S | S | * | * | trans | -127.8 | 3 | -168.6 | -71.4 | -60.9 | 0 | 0 | 0 | 118.1 | S228 A232 | S228-D230 WeakPolarHBondContact CB-OD2 3.35Å; S228-D230 PolarHBondContact O-N 2.59Å; D230-A232 PolarHBondContact O-N 3.01Å | ||
| 231 | V | 54.8 | Low | 50.9 | Low | 129 Ų | 129 | 119.3 Ų | 119.3 | 78% | 0.782 | 72% | 0.717 | S | S | * | * | G | 310 helix | trans | -86.2 | -2.9 | -177.4 | 71.7 | 0 | 0 | 0 | 0 | 115.3 | S233 | V231-S233 VanDerWaalsContact C-N 3.32Š|
| 232 | A | 51.6 | Low | 50 | Low | 99 Ų | 99 | 124.6 Ų | 124.6 | 82% | 0.818 | 73% | 0.728 | S | S | * | * | G | 310 helix | trans | -78 | -13.2 | 172.7 | 0 | 0 | 0 | 0 | 0 | 113.7 | D230 | D230-A232 PolarHBondContact O-N 3.01Š|
| 233 | S | 50.3 | Low | 49.2 | Very low | 101 Ų | 101 | 131 Ų | 131 | 71% | 0.706 | 74% | 0.742 | S | S | * | * | G | 310 helix | trans | -93.4 | -9.1 | -177.6 | -169 | 0 | 0 | 0 | 0 | 115 | V231 S235 | V231-S233 VanDerWaalsContact C-N 3.32Å; S233-S235 VanDerWaalsContact C-N 3.35Å |
| 234 | I | 52 | Low | 49 | Very low | 111 Ų | 111 | 135.2 Ų | 135.2 | 57% | 0.569 | 76% | 0.759 | S | S | * | * | G | 310 helix | trans | -86.3 | -5.9 | -179.2 | -104.3 | 160.5 | 0 | 0 | 0 | 113.6 | S236 | I234-S236 PolarHBondContact O-N 3.19Š|
| 235 | S | 54.8 | Low | 49.1 | Very low | 114 Ų | 114 | 137.7 Ų | 137.7 | 80% | 0.797 | 76% | 0.764 | S | S | * | * | G | 310 helix | trans | -70.7 | -6.1 | 178.6 | -171.6 | 0 | 0 | 0 | 0 | 114.7 | S233 | S233-S235 VanDerWaalsContact C-N 3.35Š|
| 236 | S | 54.3 | Low | 49.7 | Very low | 118 Ų | 118 | 142.4 Ų | 142.4 | 83% | 0.825 | 77% | 0.769 | S | S | * | * | G | 310 helix | trans | -108.3 | -4.1 | -172.4 | -166.8 | 0 | 0 | 0 | 0 | 115.6 | I234 | I234-S236 PolarHBondContact O-N 3.19Š|
| 237 | S | 52.7 | Low | 50.7 | Low | 87 Ų | 87 | 140.1 Ų | 140.1 | 61% | 0.608 | 77% | 0.767 | S | S | * | * | trans | -114.3 | -0.1 | -174.6 | 67.8 | 0 | 0 | 0 | 0 | 115.8 | S239 | S237-S239 PolarHBondContact O-N 3.4Š| ||
| 238 | Y | 48.7 | Very low | 51.9 | Low | 201 Ų | 201 | 139.2 Ų | 139.2 | 79% | 0.788 | 76% | 0.763 | S | S | * | * | trans | -80 | 75.8 | 166.4 | -77.6 | -89 | 0 | 0 | 0 | 109.2 | L240 | Y238-L240 PolarHBondContact O-N 3.31Å; Y238-L240 VanDerWaalsContact O-N 3.13Å | ||
| 239 | S | 46.1 | Very low | 52.2 | Low | 101 Ų | 101 | 144.4 Ų | 144.4 | 71% | 0.706 | 78% | 0.778 | S | S | * | * | trans | -49.7 | 112.5 | 167.5 | -160.7 | 0 | 0 | 0 | 0 | 109.1 | S237 D241 | S237-S239 PolarHBondContact O-N 3.4Å; S239-D241 PolarHBondContact O-N 2.89Å | ||
| 240 | L | 53.7 | Low | 52.4 | Low | 178 Ų | 178 | 139.5 Ų | 139.5 | 93% | 0.932 | 77% | 0.768 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.7 | 36.5 | -178.4 | -162.4 | 71.3 | 0 | 0 | 0 | 112.7 | Y238 | Y238-L240 PolarHBondContact O-N 3.31Å; Y238-L240 VanDerWaalsContact O-N 3.13Å |
| 241 | D | 52.8 | Low | 52.4 | Low | 141 Ų | 141 | 143.3 Ų | 143.3 | 75% | 0.754 | 78% | 0.784 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -132.7 | 12.8 | -171.3 | -115.1 | -43.5 | 0 | 0 | 0 | 114.3 | S239 | S239-D241 PolarHBondContact O-N 2.89Š|
| 242 | R | 54.7 | Low | 52.5 | Low | 235 Ų | 235 | 145 Ų | 145 | 89% | 0.887 | 79% | 0.788 | S | S | * | * | trans | -144.3 | 69.9 | 170.7 | -69 | -163.9 | -153.9 | 154.7 | 6.2 | 112.2 | ||||
| 243 | Y | 43.4 | Very low | 53.4 | Low | 214 Ų | 214 | 145.2 Ų | 145.2 | 84% | 0.839 | 78% | 0.781 | S | S | * | * | trans | -149.8 | 67.2 | 155.5 | -151.7 | -94.8 | 0 | 0 | 0 | 110.1 | ||||
| 244 | V | 53.6 | Low | 54.1 | Low | 129 Ų | 129 | 146.5 Ų | 146.5 | 78% | 0.782 | 79% | 0.787 | S | S | * | * | S | Bend | trans | -132.9 | 132 | 160.4 | -108.8 | 0 | 0 | 0 | 0 | 104.4 | ||
| 245 | D | 52.6 | Low | 54.3 | Low | 160 Ų | 160 | 146.2 Ų | 146.2 | 86% | 0.856 | 80% | 0.795 | S | S | * | * | S | Bend | trans | 79.1 | 73.3 | -176.9 | -60.3 | -47.1 | 0 | 0 | 0 | 118.6 | ||
| 246 | Y | 51 | Low | 53.7 | Low | 197 Ų | 197 | 149.9 Ų | 149.9 | 77% | 0.773 | 80% | 0.8 | S | S | * | * | trans | -156.4 | 106.1 | 130.8 | -140.7 | -99.7 | 0 | 0 | 0 | 109.9 | P248 | Y246-P248 HydrophobicContact CD1-CG 4.4Å; Y246-P248 WeakPolarHBondContact O-CD 3.44Å | ||
| 247 | V | 59.6 | Low | 53.6 | Low | 132 Ų | 132 | 153.2 Ų | 153.2 | 80% | 0.8 | 80% | 0.802 | S | S | * | * | trans | -100 | 107 | 169 | 176.1 | 0 | 0 | 0 | 0 | 107.1 | Q249 | V247-Q249 PolarHBondContact O-N 3.21Š| ||
| 248 | P | 61 | Low | 53.4 | Low | 105 Ų | 105 | 155.4 Ų | 155.4 | 68% | 0.682 | 81% | 0.812 | S | S | * | * | trans | -71.8 | 111 | 170 | -10.4 | 26.7 | 0 | 0 | 0 | 108.8 | Y246 G250 | Y246-P248 HydrophobicContact CD1-CG 4.4Å; Y246-P248 WeakPolarHBondContact O-CD 3.44Å; P248-G250 PolarHBondContact O-N 3.48Å | ||
| 249 | Q | 51.5 | Low | 53.6 | Low | 194 Ų | 194 | 152.5 Ų | 152.5 | 91% | 0.907 | 81% | 0.81 | S | S | * | * | trans | -60.8 | 130 | 167.4 | -86.5 | 174.7 | -15.2 | 0 | 0 | 110.1 | V247 | V247-Q249 PolarHBondContact O-N 3.21Š| ||
| 250 | G | 50.2 | Low | 53.8 | Low | 67 Ų | 67 | 155.6 Ų | 155.6 | 69% | 0.691 | 82% | 0.817 | S | S | * | * | trans | 113.7 | 80.5 | 161.2 | 0 | 0 | 0 | 0 | 0 | 113.8 | P248 | P248-G250 PolarHBondContact O-N 3.48Š| ||
| 251 | M | 51.1 | Low | 53.7 | Low | 196 Ų | 196 | 150.3 Ų | 150.3 | 97% | 0.966 | 81% | 0.805 | S | S | * | * | trans | -167.4 | 81.3 | 134.2 | -79.2 | -122.3 | 164.9 | 0 | 0 | 107.5 | ||||
| 252 | L | 57.6 | Low | 53.7 | Low | 166 Ų | 166 | 150.1 Ų | 150.1 | 87% | 0.869 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -75.5 | 131.4 | 165.2 | -100.3 | 132.2 | 0 | 0 | 0 | 108.4 | ||
| 253 | P | 69.7 | Low | 53.7 | Low | 103 Ų | 103 | 149 Ų | 149 | 67% | 0.669 | 81% | 0.812 | S | S | * | * | P | Polyproline II helix | trans | -69.2 | 132.5 | 167.9 | 28.6 | -31.8 | 0 | 0 | 0 | 109.3 | S255 | P253-S255 PolarHBondContact O-N 3.18Š|
| 254 | P | 65.9 | Low | 54 | Low | 127 Ų | 127 | 141.7 Ų | 141.7 | 83% | 0.825 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -64.5 | 121.3 | 176.3 | 24.9 | -31.2 | 0 | 0 | 0 | 109.8 | ||
| 255 | S | 56.4 | Low | 53.9 | Low | 106 Ų | 106 | 139 Ų | 139 | 74% | 0.741 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -65.2 | 142.6 | 172.5 | -65.6 | 0 | 0 | 0 | 0 | 109.9 | P253 E257 | P253-S255 PolarHBondContact O-N 3.18Å; S255-E257 PolarHBondContact O-N 3.25Å |
| 256 | Q | 40.7 | Very low | 54.1 | Low | 191 Ų | 191 | 140.2 Ų | 140.2 | 89% | 0.893 | 80% | 0.798 | S | S | * | * | trans | -71.4 | 110.1 | 177.8 | -58.8 | -176 | -1.8 | 0 | 0 | 108.9 | ||||
| 257 | E | 53.3 | Low | 54.2 | Low | 187 Ų | 187 | 138.7 Ų | 138.7 | 87% | 0.874 | 80% | 0.796 | S | S | * | * | trans | -118.9 | 108.4 | 163.8 | -67.1 | -165.8 | 159.9 | 0 | 0 | 108.2 | S255 | S255-E257 PolarHBondContact O-N 3.25Š| ||
| 258 | T | 48.3 | Very low | 54.1 | Low | 133 Ų | 133 | 136.5 Ų | 136.5 | 82% | 0.816 | 79% | 0.791 | S | S | * | * | trans | -80.1 | 110.6 | 169 | 48 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 259 | D | 52.4 | Low | 54 | Low | 140 Ų | 140 | 139.2 Ų | 139.2 | 75% | 0.749 | 80% | 0.8 | S | S | * | * | trans | -155.6 | 96.5 | 157.4 | -132.2 | -14.3 | 0 | 0 | 0 | 108.4 | ||||
| 260 | I | 51.2 | Low | 54.3 | Low | 166 Ų | 166 | 140.7 Ų | 140.7 | 85% | 0.851 | 80% | 0.797 | S | S | * | * | 43.2 | 101.8 | 105.1 | -42.7 | 169.6 | 0 | 0 | 0 | 112.5 | |||||
| 261 | G | 50 | Low | 54.8 | Low | 67 Ų | 67 | 143.9 Ų | 143.9 | 69% | 0.691 | 81% | 0.808 | S | S | * | * | trans | 163.4 | 84.8 | 169.6 | 0 | 0 | 0 | 0 | 0 | 115.3 | ||||
| 262 | T | 54.2 | Low | 55.4 | Low | 138 Ų | 138 | 141.7 Ų | 141.7 | 85% | 0.847 | 80% | 0.8 | S | S | * | * | trans | 24.7 | 141 | 130.5 | -56.9 | 0 | 0 | 0 | 0 | 119.9 | ||||
| 263 | F | 53.2 | Low | 56 | Low | 211 Ų | 211 | 139.3 Ų | 139.3 | 93% | 0.925 | 80% | 0.795 | S | S | * | * | trans | 101 | 126.8 | 162.4 | -150.5 | -90.8 | 0 | 0 | 0 | 112.7 | ||||
| 264 | G | 50 | Low | 55.5 | Low | 60 Ų | 60 | 140.2 Ų | 140.2 | 62% | 0.619 | 80% | 0.803 | S | S | * | * | cis | 172.3 | 135.2 | 8.1 | 0 | 0 | 0 | 0 | 0 | 103.9 | ||||
| 265 | G | 53 | Low | 55.3 | Low | 74 Ų | 74 | 137.6 Ų | 137.6 | 76% | 0.763 | 80% | 0.8 | S | S | * | * | trans | -71.2 | 174.2 | -161.7 | 0 | 0 | 0 | 0 | 0 | 116.2 | ||||
| 266 | F | 56.3 | Low | 55.6 | Low | 185 Ų | 185 | 138.4 Ų | 138.4 | 81% | 0.811 | 81% | 0.805 | S | S | * | * | trans | -165.1 | 125.2 | 147.9 | -137.4 | -124.4 | 0 | 0 | 0 | 111.1 | ||||
| 267 | F | 52.1 | Low | 56.1 | Low | 164 Ų | 164 | 140.6 Ų | 140.6 | 72% | 0.719 | 82% | 0.821 | S | S | * | * | trans | 79.6 | 98.1 | 153 | -82 | -124.6 | 0 | 0 | 0 | 118.1 | ||||
| 268 | A | 58.3 | Low | 56.2 | Low | 86 Ų | 86 | 138.3 Ų | 138.3 | 71% | 0.711 | 82% | 0.818 | S | S | * | * | 79.8 | 105.1 | 70.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | |||||
| 269 | D | 57.9 | Low | 56.7 | Low | 163 Ų | 163 | 138.6 Ų | 138.6 | 87% | 0.872 | 82% | 0.818 | S | S | * | * | -154.9 | 147 | 125.3 | -129 | -36.4 | 0 | 0 | 0 | 112.5 | |||||
| 270 | R | 57.9 | Low | 56.9 | Low | 224 Ų | 224 | 138.5 Ų | 138.5 | 85% | 0.845 | 82% | 0.822 | S | S | * | * | trans | -71.8 | 142.2 | -162.4 | -70.3 | 164.8 | 168.8 | 141.9 | -4.8 | 113.9 | ||||
| 271 | C | 62.2 | Low | 57.2 | Low | 135 Ų | 135 | 136.9 Ų | 136.9 | 91% | 0.912 | 82% | 0.82 | S | S | * | * | trans | -142.8 | 108.7 | 140.9 | -89.3 | 0 | 0 | 0 | 0 | 107.3 | ||||
| 272 | D | 63.8 | Low | 57.7 | Low | 150 Ų | 150 | 141.3 Ų | 141.3 | 80% | 0.802 | 83% | 0.828 | S | S | * | * | trans | -102.9 | 121.4 | 179.1 | -166.6 | -26.2 | 0 | 0 | 0 | 108 | ||||
| 273 | P | 69 | Low | 57.9 | Low | 116 Ų | 116 | 141.5 Ų | 141.5 | 75% | 0.753 | 83% | 0.827 | S | S | * | * | trans | -106.6 | 113.1 | 163 | 32.2 | -20.4 | 0 | 0 | 0 | 110.2 | ||||
| 274 | S | 60.3 | Low | 58.3 | Low | 121 Ų | 121 | 136.5 Ų | 136.5 | 85% | 0.846 | 82% | 0.82 | S | S | * | * | trans | -49.8 | 132 | 170.2 | 59.4 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 275 | G | 61 | Low | 58.9 | Low | 73 Ų | 73 | 142.4 Ų | 142.4 | 75% | 0.753 | 84% | 0.835 | S | S | * | * | trans | -175.5 | 107.6 | 166.3 | 0 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 276 | S | 62.2 | Low | 59.4 | Low | 122 Ų | 122 | 148.1 Ų | 148.1 | 85% | 0.853 | 84% | 0.842 | S | S | * | * | trans | 88.8 | 97.1 | 149.5 | -163.5 | 0 | 0 | 0 | 0 | 120.3 | ||||
| 277 | I | 51.7 | Low | 59.7 | Low | 238 Ų | 238 | 144.7 Ų | 144.7 | 100% | 1.221 | 84% | 0.844 | S | S | * | * | -138.4 | 0 | 108.5 | -88.6 | 173.3 | 0 | 0 | 0 | 107 |
Retrieved 277 of 277 residues in 53.1 ms
(Link to these results)