| 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 | 46.4 | Very low | 49.8 | Very low | 241 Ų | 241 | 140.7 Ų | 140.7 | 100% | 1.187 | 82% | 0.817 | S | S | * | * | 0 | 106 | 0 | -76.3 | 160.9 | 145.4 | 0 | 0 | 107.3 | |||||
| 2 | F | 41.9 | Very low | 51.5 | Low | 205 Ų | 205 | 134 Ų | 134 | 90% | 0.899 | 78% | 0.784 | S | S | * | * | P | Polyproline II helix | trans | -91 | 134.2 | 174.3 | -73.1 | -79.2 | 0 | 0 | 0 | 108.9 | ||
| 3 | P | 57.9 | Low | 52.1 | Low | 124 Ų | 124 | 132.1 Ų | 132.1 | 81% | 0.805 | 78% | 0.775 | S | S | * | * | P | Polyproline II helix | trans | -75.8 | 129.2 | 176.2 | 29.5 | -30.4 | 0 | 0 | 0 | 110.1 | ||
| 4 | S | 40.5 | Very low | 52.7 | Low | 113 Ų | 113 | 133.9 Ų | 133.9 | 79% | 0.79 | 77% | 0.768 | S | S | * | * | P | Polyproline II helix | trans | -66.8 | 141.7 | 176.3 | -56.5 | 0 | 0 | 0 | 0 | 111.4 | ||
| 5 | P | 49.7 | Very low | 53.4 | Low | 125 Ų | 125 | 130.6 Ų | 130.6 | 81% | 0.812 | 75% | 0.747 | S | S | * | * | P | Polyproline II helix | trans | -71.9 | 132.7 | 176.5 | 28.9 | -32.3 | 0 | 0 | 0 | 111 | T7 | P5-T7 PolarHBondContact O-N 3.44Š|
| 6 | S | 48.1 | Very low | 54.1 | Low | 122 Ų | 122 | 130.1 Ų | 130.1 | 85% | 0.853 | 74% | 0.74 | S | S | * | * | trans | -60 | 115.9 | 175.2 | 24.1 | 0 | 0 | 0 | 0 | 111.1 | S8 | S6-S8 PolarHBondContact O-N 3.29Š| ||
| 7 | T | 45.7 | Very low | 54.3 | Low | 127 Ų | 127 | 130.4 Ų | 130.4 | 78% | 0.779 | 74% | 0.738 | S | S | * | * | trans | -76 | 112.4 | 171.7 | -138 | 0 | 0 | 0 | 0 | 108.5 | P5 T9 | P5-T7 PolarHBondContact O-N 3.44Å; T7-T9 HydrophobicContact CG2-CG2 4.2Å; T7-T9 PolarHBondContact O-N 3.46Å; T7-T9 VanDerWaalsContact O-N 3.12Å | ||
| 8 | S | 44.2 | Very low | 53.9 | Low | 111 Ų | 111 | 129.5 Ų | 129.5 | 78% | 0.776 | 73% | 0.731 | S | S | * | * | trans | -72.1 | 95.1 | 175.1 | 167 | 0 | 0 | 0 | 0 | 109.4 | S6 | S6-S8 PolarHBondContact O-N 3.29Š| ||
| 9 | T | 59.3 | Low | 53.9 | Low | 103 Ų | 103 | 130.8 Ų | 130.8 | 63% | 0.632 | 74% | 0.735 | S | S | * | * | trans | -81.7 | 123.6 | 164.1 | 52.9 | 0 | 0 | 0 | 0 | 108.8 | T7 F11 | T7-T9 HydrophobicContact CG2-CG2 4.2Å; T7-T9 PolarHBondContact O-N 3.46Å; T7-T9 VanDerWaalsContact O-N 3.12Å; T9-F11 PolarHBondContact O-N 3.44Å | ||
| 10 | P | 66.4 | Low | 53.8 | Low | 115 Ų | 115 | 133.8 Ų | 133.8 | 75% | 0.747 | 74% | 0.743 | S | S | * | * | S | Bend | trans | -78.7 | 11.9 | -167.7 | 32.1 | -36.8 | 0 | 0 | 0 | 115.1 | ||
| 11 | F | 47.9 | Very low | 53.7 | Low | 162 Ų | 162 | 135 Ų | 135 | 71% | 0.711 | 74% | 0.743 | S | S | * | * | trans | -139 | 112.4 | 175.1 | -92.4 | -87.8 | 0 | 0 | 0 | 108.8 | T9 | T9-F11 PolarHBondContact O-N 3.44Š| ||
| 12 | S | 69.7 | Low | 53.4 | Low | 60 Ų | 60 | 130.4 Ų | 130.4 | 42% | 0.42 | 72% | 0.723 | S | S | . | * | trans | -85.5 | 142 | 174.7 | -175.8 | 0 | 0 | 0 | 0 | 108.6 | K14 D15 | S12-K14 PolarHBondContact O-N 3.06Å; S12-D15 WeakPolarHBondContact CB-OD2 3.4Å; S12-D15 PolarHBondContact N-OD2 3Å; S12-D15 WeakPolarHBondContact O-CB 3.37Å; S12-D15 PolarHBondContact O-N 2.94Å | ||
| 13 | V | 59.2 | Low | 53.6 | Low | 109 Ų | 109 | 126 Ų | 126 | 66% | 0.661 | 72% | 0.715 | S | S | * | * | H | α-helix | trans | -55.7 | -23.5 | 175.5 | 178 | 0 | 0 | 0 | 0 | 111.7 | D15 I16 | V13-D15 VanDerWaalsContact C-N 3.32Å; V13-D15 PolarHBondContact O-N 2.88Å; V13-I16 PolarHBondContact O-N 3.47Å |
| 14 | K | 60.4 | Low | 53 | Low | 157 Ų | 157 | 126.7 Ų | 126.7 | 68% | 0.683 | 71% | 0.712 | S | S | * | * | H | α-helix | trans | -67.1 | -27.3 | 174.4 | -70.6 | 176 | 174.2 | -177.8 | 0 | 113.7 | S12 I16 N18 | S12-K14 PolarHBondContact O-N 3.06Å; K14-I16 VanDerWaalsContact C-N 3.29Å; K14-I16 PolarHBondContact O-N 3.12Å; K14-N18 PolarHBondContact O-N 3.32Å |
| 15 | D | 63.8 | Low | 53.4 | Low | 85 Ų | 85 | 127.9 Ų | 127.9 | 46% | 0.455 | 71% | 0.714 | S | S | . | * | H | α-helix | trans | -72.2 | -26.9 | 179.9 | -56.6 | -41.6 | 0 | 0 | 0 | 111.9 | S12 V13 | S12-D15 WeakPolarHBondContact CB-OD2 3.4Å; S12-D15 PolarHBondContact N-OD2 3Å; S12-D15 WeakPolarHBondContact O-CB 3.37Å; S12-D15 PolarHBondContact O-N 2.94Å; V13-D15 VanDerWaalsContact C-N 3.32Å; V13-D15 PolarHBondContact O-N 2.88Å |
| 16 | I | 63.6 | Low | 53.1 | Low | 123 Ų | 123 | 130.7 Ų | 130.7 | 63% | 0.631 | 72% | 0.719 | S | S | * | * | H | α-helix | trans | -75 | -36.6 | -179.9 | -59.6 | 169.1 | 0 | 0 | 0 | 110.9 | V13 K14 | V13-I16 PolarHBondContact O-N 3.47Å; K14-I16 VanDerWaalsContact C-N 3.29Å; K14-I16 PolarHBondContact O-N 3.12Å |
| 17 | L | 58.7 | Low | 52.7 | Low | 134 Ų | 134 | 131.7 Ų | 131.7 | 70% | 0.702 | 72% | 0.719 | S | S | * | * | H | α-helix | trans | -84.8 | -18 | -177.7 | -63.8 | 175.1 | 0 | 0 | 0 | 113.1 | ||
| 18 | N | 47.4 | Very low | 52.2 | Low | 115 Ų | 115 | 131.2 Ų | 131.2 | 62% | 0.615 | 72% | 0.721 | S | S | * | * | G | 310 helix | trans | -87.2 | -6.1 | 177.6 | -83.1 | -4.4 | 0 | 0 | 0 | 114.1 | K14 E20 | K14-N18 PolarHBondContact O-N 3.32Å; N18-E20 VanDerWaalsContact C-N 3.28Å; N18-E20 PolarHBondContact O-N 3.31Å |
| 19 | L | 52.5 | Low | 51.9 | Low | 155 Ų | 155 | 131.4 Ų | 131.4 | 81% | 0.812 | 72% | 0.722 | S | S | * | * | G | 310 helix | trans | -79.9 | -8.8 | -178.4 | -152.6 | 68.7 | 0 | 0 | 0 | 113.5 | ||
| 20 | E | 53 | Low | 51.1 | Low | 190 Ų | 190 | 135 Ų | 135 | 89% | 0.888 | 74% | 0.737 | S | S | * | * | G | 310 helix | trans | -90.9 | -3.2 | -179.1 | -151.4 | 174.3 | 98.8 | 0 | 0 | 113.4 | N18 | N18-E20 VanDerWaalsContact C-N 3.28Å; N18-E20 PolarHBondContact O-N 3.31Å |
| 21 | Q | 50.4 | Low | 49.8 | Very low | 159 Ų | 159 | 136.4 Ų | 136.4 | 74% | 0.743 | 74% | 0.738 | S | S | * | * | S | Bend | trans | -116.3 | 23.9 | -166.8 | -135.9 | 169.1 | 31.8 | 0 | 0 | 116.3 | ||
| 22 | N | 41.9 | Very low | 49.6 | Very low | 144 Ų | 144 | 136.5 Ų | 136.5 | 77% | 0.77 | 74% | 0.744 | S | S | * | * | trans | -142.1 | 94.4 | 168.5 | -95.7 | -85.1 | 0 | 0 | 0 | 112.3 | ||||
| 23 | P | 45.8 | Very low | 48.2 | Very low | 113 Ų | 113 | 138.5 Ų | 138.5 | 73% | 0.734 | 76% | 0.758 | S | S | * | * | trans | -106.8 | 51.9 | 162.9 | 39.8 | -29.6 | 0 | 0 | 0 | 110.7 | ||||
| 24 | D | 43.7 | Very low | 47.7 | Very low | 139 Ų | 139 | 139 Ų | 139 | 74% | 0.743 | 76% | 0.764 | S | S | * | * | trans | -152.9 | 70.6 | 178.7 | -88 | -48.5 | 0 | 0 | 0 | 112.4 | ||||
| 25 | V | 50.2 | Low | 46.6 | Very low | 137 Ų | 137 | 142.2 Ų | 142.2 | 83% | 0.83 | 77% | 0.772 | S | S | * | * | S | Bend | trans | -163 | 105.1 | 138.2 | -170.8 | 0 | 0 | 0 | 0 | 106.6 | ||
| 26 | M | 43 | Very low | 45.6 | Very low | 185 Ų | 185 | 145.8 Ų | 145.8 | 91% | 0.911 | 79% | 0.787 | S | S | * | * | trans | 158.4 | 57.4 | 150.2 | -73.4 | -106.2 | -179.4 | 0 | 0 | 108.8 | ||||
| 27 | V | 39.9 | Very low | 44.3 | Very low | 143 Ų | 143 | 146.8 Ų | 146.8 | 87% | 0.867 | 79% | 0.794 | S | S | * | * | trans | -125.7 | 103.8 | 158.7 | 169 | 0 | 0 | 0 | 0 | 106.6 | ||||
| 28 | S | 34.4 | Very low | 43.2 | Very low | 116 Ų | 116 | 146.8 Ų | 146.8 | 81% | 0.811 | 80% | 0.804 | S | S | * | * | trans | -165.9 | 134.4 | 147.7 | -83.1 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 29 | S | 38.4 | Very low | 42.6 | Very low | 115 Ų | 115 | 146.5 Ų | 146.5 | 80% | 0.804 | 81% | 0.811 | S | S | * | * | trans | 81.9 | 84.1 | 173.2 | -56.3 | 0 | 0 | 0 | 0 | 116.7 | ||||
| 30 | L | 43.3 | Very low | 42.2 | Very low | 178 Ų | 178 | 143.5 Ų | 143.5 | 93% | 0.932 | 81% | 0.808 | S | S | * | * | -160.3 | 119.4 | 104.1 | -92 | 162.3 | 0 | 0 | 0 | 108.9 | |||||
| 31 | D | 38 | Very low | 41.5 | Very low | 145 Ų | 145 | 141 Ų | 141 | 78% | 0.775 | 81% | 0.806 | S | S | * | * | trans | -74.7 | 120.5 | 177.4 | -157.3 | -42.4 | 0 | 0 | 0 | 109.1 | ||||
| 32 | I | 44.7 | Very low | 41.2 | Very low | 165 Ų | 165 | 138.5 Ų | 138.5 | 85% | 0.846 | 81% | 0.806 | S | S | * | * | trans | -150.1 | 126.4 | 154.7 | -131.2 | 94.1 | 0 | 0 | 0 | 107.9 | ||||
| 33 | S | 40.1 | Very low | 41.3 | Very low | 102 Ų | 102 | 137.2 Ų | 137.2 | 71% | 0.713 | 81% | 0.809 | S | S | * | * | trans | -63.6 | 155.1 | -168.9 | -54.3 | 0 | 0 | 0 | 0 | 115.2 | ||||
| 34 | P | 48.3 | Very low | 41.1 | Very low | 119 Ų | 119 | 137.5 Ų | 137.5 | 77% | 0.773 | 81% | 0.812 | S | S | * | * | trans | -96 | 133.4 | 171.3 | 35.3 | -27.2 | 0 | 0 | 0 | 111.1 | ||||
| 35 | R | 37.9 | Very low | 41.3 | Very low | 225 Ų | 225 | 138.9 Ų | 138.9 | 85% | 0.849 | 82% | 0.816 | S | S | * | * | trans | -176.1 | 109.5 | 149.5 | -108.3 | 170.3 | 176.3 | 173.1 | 1.6 | 110.8 | ||||
| 36 | M | 43 | Very low | 41.1 | Very low | 159 Ų | 159 | 140.7 Ų | 140.7 | 78% | 0.783 | 82% | 0.82 | S | S | * | * | 172.5 | 137.6 | 112.6 | -85.1 | -58.8 | 153.9 | 0 | 0 | 110.1 | |||||
| 37 | D | 36.1 | Very low | 40.9 | Very low | 145 Ų | 145 | 136 Ų | 136 | 78% | 0.775 | 81% | 0.811 | S | S | * | * | trans | -62.1 | 142.9 | -173 | -55 | -74.1 | 0 | 0 | 0 | 113.8 | ||||
| 38 | C | 34.7 | Very low | 41.1 | Very low | 134 Ų | 134 | 140.8 Ų | 140.8 | 91% | 0.905 | 81% | 0.813 | S | S | * | * | trans | -150.1 | 112.6 | 145.3 | -94.5 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 39 | S | 35.8 | Very low | 41.2 | Very low | 108 Ų | 108 | 143.1 Ų | 143.1 | 76% | 0.755 | 82% | 0.816 | S | S | * | * | trans | -52.8 | 136.5 | -176 | 46.9 | 0 | 0 | 0 | 0 | 115.3 | ||||
| 40 | A | 43.7 | Very low | 41.3 | Very low | 92 Ų | 92 | 147 Ų | 147 | 76% | 0.76 | 82% | 0.818 | S | S | * | * | trans | -57.1 | 136.3 | 157.2 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 41 | T | 37.9 | Very low | 41 | Very low | 137 Ų | 137 | 146.7 Ų | 146.7 | 84% | 0.84 | 81% | 0.812 | S | S | * | * | trans | -144.4 | 100.6 | 150.6 | -6.2 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 42 | S | 45 | Very low | 40.9 | Very low | 107 Ų | 107 | 146.9 Ų | 146.9 | 75% | 0.748 | 81% | 0.808 | S | S | * | * | trans | -83 | 130.8 | 156.1 | -38.6 | 0 | 0 | 0 | 0 | 107.3 | ||||
| 43 | S | 43.8 | Very low | 41.1 | Very low | 118 Ų | 118 | 144.5 Ų | 144.5 | 83% | 0.825 | 80% | 0.803 | S | S | * | * | trans | 155.1 | 147.4 | 158.3 | -80.1 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 44 | C | 40.3 | Very low | 40.8 | Very low | 118 Ų | 118 | 145.9 Ų | 145.9 | 80% | 0.797 | 80% | 0.802 | S | S | * | * | cis | -174.6 | 168.8 | -12.2 | 53.1 | 0 | 0 | 0 | 0 | 106.1 | ||||
| 45 | M | 49.4 | Very low | 40.5 | Very low | 168 Ų | 168 | 152 Ų | 152 | 83% | 0.828 | 81% | 0.81 | S | S | * | * | trans | -62.2 | 166.3 | -178.7 | -56.3 | -138.2 | -69 | 0 | 0 | 115.3 | ||||
| 46 | L | 46.3 | Very low | 40.5 | Very low | 176 Ų | 176 | 147.6 Ų | 147.6 | 92% | 0.921 | 80% | 0.803 | S | S | * | * | trans | 121.1 | 139.4 | 162.5 | -68.6 | 156.4 | 0 | 0 | 0 | 111.8 | ||||
| 47 | A | 38.1 | Very low | 40.1 | Very low | 87 Ų | 87 | 148.9 Ų | 148.9 | 72% | 0.719 | 81% | 0.81 | S | S | * | * | cis | -168.7 | 159.2 | -10.6 | 0 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 48 | R | 43.2 | Very low | 40 | Very low | 242 Ų | 242 | 147 Ų | 147 | 91% | 0.913 | 81% | 0.808 | S | S | * | * | trans | -66.8 | 140.5 | 172.1 | -81.5 | -99.1 | 174.2 | 115.4 | -8.2 | 113.3 | ||||
| 49 | L | 37.8 | Very low | 39.8 | Very low | 166 Ų | 166 | 145.3 Ų | 145.3 | 87% | 0.869 | 80% | 0.797 | S | S | * | * | trans | -169.5 | 136.6 | 152.1 | -90.2 | 137.1 | 0 | 0 | 0 | 104.7 | ||||
| 50 | K | 40.8 | Very low | 39.6 | Very low | 196 Ų | 196 | 145.8 Ų | 145.8 | 85% | 0.852 | 80% | 0.8 | S | S | * | * | cis | -170.7 | 153.6 | 10.7 | -179.6 | 171 | 173.2 | 174.5 | 0 | 106.6 | ||||
| 51 | Q | 36.4 | Very low | 38.9 | Very low | 171 Ų | 171 | 149 Ų | 149 | 80% | 0.799 | 80% | 0.804 | S | S | * | * | trans | -72.8 | 148.9 | -176.3 | -82 | 170 | -26.3 | 0 | 0 | 116 | ||||
| 52 | E | 34.8 | Very low | 38.5 | Very low | 150 Ų | 150 | 147.8 Ų | 147.8 | 70% | 0.701 | 80% | 0.801 | S | S | * | * | trans | 59.9 | 161.8 | 134.7 | -66.5 | -64.2 | 124.7 | 0 | 0 | 121.1 | ||||
| 53 | P | 49.3 | Very low | 38.1 | Very low | 114 Ų | 114 | 150.3 Ų | 150.3 | 74% | 0.74 | 80% | 0.801 | S | S | * | * | cis | -136.8 | 159.6 | 11.1 | 35.1 | -13.5 | 0 | 0 | 0 | 119.4 | ||||
| 54 | L | 35 | Very low | 37.4 | Very low | 132 Ų | 132 | 152.4 Ų | 152.4 | 69% | 0.691 | 80% | 0.798 | S | S | * | * | trans | 6.8 | 126.7 | 141.2 | -134.1 | 113.6 | 0 | 0 | 0 | 120.7 | ||||
| 55 | R | 41.5 | Very low | 37 | Very low | 247 Ų | 247 | 152.8 Ų | 152.8 | 93% | 0.932 | 79% | 0.792 | S | S | * | * | trans | -147.6 | 114.9 | 142 | -70.8 | -155.8 | 177.9 | -156.6 | -0.6 | 111.3 | ||||
| 56 | D | 38.5 | Very low | 36.5 | Very low | 133 Ų | 133 | 151 Ų | 151 | 71% | 0.711 | 78% | 0.784 | S | S | * | * | trans | -79.3 | 144.2 | 156.5 | -82.2 | -53.5 | 0 | 0 | 0 | 109.7 | ||||
| 57 | M | 32.9 | Very low | 36 | Very low | 186 Ų | 186 | 151.1 Ų | 151.1 | 92% | 0.916 | 78% | 0.78 | S | S | * | * | trans | -166.6 | 136.8 | 135.5 | -101 | -53.4 | 122.6 | 0 | 0 | 111.1 | ||||
| 58 | S | 34.3 | Very low | 35.8 | Very low | 106 Ų | 106 | 154.2 Ų | 154.2 | 74% | 0.741 | 79% | 0.785 | S | S | * | * | trans | -83 | 171.2 | -176.2 | -171.6 | 0 | 0 | 0 | 0 | 113 | ||||
| 59 | S | 31.5 | Very low | 35.4 | Very low | 98 Ų | 98 | 148.1 Ų | 148.1 | 69% | 0.685 | 78% | 0.779 | S | S | * | * | trans | 91.7 | 121.9 | 144.8 | 51.4 | 0 | 0 | 0 | 0 | 123 | ||||
| 60 | S | 30.1 | Very low | 35.3 | Very low | 117 Ų | 117 | 148 Ų | 148 | 82% | 0.818 | 78% | 0.779 | S | S | * | * | trans | 75.9 | 152.8 | 138.7 | 74.5 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 61 | L | 30.3 | Very low | 35 | Very low | 161 Ų | 161 | 148.1 Ų | 148.1 | 84% | 0.843 | 78% | 0.78 | S | S | * | * | cis | 174.8 | 134.2 | -17.7 | 172.9 | 72 | 0 | 0 | 0 | 103.4 | ||||
| 62 | S | 30.1 | Very low | 34.9 | Very low | 110 Ų | 110 | 144.7 Ų | 144.7 | 77% | 0.769 | 78% | 0.781 | S | S | * | * | trans | 164 | 146.1 | 151.4 | 39.2 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 63 | Q | 35 | Very low | 34.9 | Very low | 161 Ų | 161 | 141.6 Ų | 141.6 | 75% | 0.752 | 79% | 0.789 | S | S | * | * | cis | -174.9 | 164.1 | -17.9 | -168.9 | 165.9 | 0.8 | 0 | 0 | 106.5 | ||||
| 64 | Q | 30.7 | Very low | 34.4 | Very low | 162 Ų | 162 | 148.5 Ų | 148.5 | 76% | 0.757 | 80% | 0.8 | S | S | * | * | trans | 98 | 99.8 | 159.2 | -58.3 | -177 | -24.6 | 0 | 0 | 116.1 | ||||
| 65 | D | 31.3 | Very low | 34.5 | Very low | 126 Ų | 126 | 145.2 Ų | 145.2 | 67% | 0.674 | 80% | 0.798 | S | S | * | * | 83.5 | 139.1 | 77 | -74.8 | -43.6 | 0 | 0 | 0 | 111 | |||||
| 66 | I | 37.8 | Very low | 34.3 | Very low | 129 Ų | 129 | 141.1 Ų | 141.1 | 66% | 0.662 | 80% | 0.795 | S | S | * | * | cis | -167.1 | 153.2 | -1.6 | -104.9 | 167 | 0 | 0 | 0 | 105.7 | ||||
| 67 | Q | 36.7 | Very low | 34.2 | Very low | 180 Ų | 180 | 144.8 Ų | 144.8 | 84% | 0.841 | 81% | 0.805 | S | S | * | * | trans | 138.5 | 90.7 | 138.8 | -107.1 | 157.8 | 31.3 | 0 | 0 | 117.3 | ||||
| 68 | D | 32.8 | Very low | 34.7 | Very low | 151 Ų | 151 | 139.8 Ų | 139.8 | 81% | 0.807 | 79% | 0.793 | S | S | * | * | trans | 25.6 | 135 | 133.9 | -87.4 | -52.7 | 0 | 0 | 0 | 125.8 | ||||
| 69 | S | 35.1 | Very low | 35.3 | Very low | 114 Ų | 114 | 141 Ų | 141 | 80% | 0.797 | 80% | 0.798 | S | S | * | * | 113.5 | 120.2 | 125.7 | 68.8 | 0 | 0 | 0 | 0 | 120.1 | |||||
| 70 | N | 35.8 | Very low | 35.7 | Very low | 164 Ų | 164 | 142.6 Ų | 142.6 | 88% | 0.877 | 80% | 0.804 | S | S | * | * | trans | -48.6 | 150.4 | 170.6 | -72.4 | -63.1 | 0 | 0 | 0 | 114.9 | ||||
| 71 | K | 35.2 | Very low | 36.4 | Very low | 199 Ų | 199 | 145.8 Ų | 145.8 | 87% | 0.865 | 80% | 0.804 | S | S | * | * | 160 | 127.7 | 110.4 | -171.2 | 161.5 | -176 | 174.6 | 0 | 113 | |||||
| 72 | A | 35.2 | Very low | 37.1 | Very low | 99 Ų | 99 | 147.7 Ų | 147.7 | 82% | 0.818 | 80% | 0.801 | S | S | * | * | trans | 51 | 128.6 | 149.7 | 0 | 0 | 0 | 0 | 0 | 121 | ||||
| 73 | G | 34.8 | Very low | 37.5 | Very low | 84 Ų | 84 | 146.1 Ų | 146.1 | 87% | 0.866 | 80% | 0.802 | S | S | * | * | trans | 168.1 | 120.8 | 158.8 | 0 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 74 | R | 37.8 | Very low | 37.6 | Very low | 260 Ų | 260 | 148.6 Ų | 148.6 | 98% | 0.981 | 81% | 0.81 | S | S | * | * | trans | -75.6 | 162.3 | 178.9 | -61.9 | 175 | -179.6 | -123.2 | 4.6 | 112.4 | ||||
| 75 | G | 37 | Very low | 38 | Very low | 63 Ų | 63 | 146.8 Ų | 146.8 | 65% | 0.649 | 82% | 0.815 | S | S | * | * | trans | 151.9 | 77.4 | 160.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 76 | N | 37.6 | Very low | 38.2 | Very low | 161 Ų | 161 | 150.1 Ų | 150.1 | 86% | 0.861 | 82% | 0.82 | S | S | * | * | 36.4 | 102.8 | 92 | -89.2 | 34.2 | 0 | 0 | 0 | 115.6 | |||||
| 77 | F | 36.8 | Very low | 38.4 | Very low | 210 Ų | 210 | 150 Ų | 150 | 92% | 0.921 | 83% | 0.825 | S | S | * | * | trans | -121.2 | 124.3 | 145.3 | -85.6 | -83.9 | 0 | 0 | 0 | 109.1 | ||||
| 78 | A | 42.9 | Very low | 38.5 | Very low | 80 Ų | 80 | 144.8 Ų | 144.8 | 66% | 0.661 | 82% | 0.82 | S | S | * | * | P | Polyproline II helix | trans | -87 | 158.1 | 179.9 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||
| 79 | P | 47.8 | Very low | 39.2 | Very low | 131 Ų | 131 | 146.2 Ų | 146.2 | 85% | 0.851 | 82% | 0.824 | S | S | * | * | P | Polyproline II helix | trans | -102.2 | 116.6 | 145.3 | 31.6 | -20.2 | 0 | 0 | 0 | 108.9 | ||
| 80 | T | 39.5 | Very low | 39.5 | Very low | 132 Ų | 132 | 149.9 Ų | 149.9 | 81% | 0.81 | 83% | 0.828 | S | S | * | * | P | Polyproline II helix | trans | -98.4 | 118.1 | 166.4 | 38.3 | 0 | 0 | 0 | 0 | 108.3 | ||
| 81 | F | 43.8 | Very low | 39.7 | Very low | 185 Ų | 185 | 151.2 Ų | 151.2 | 81% | 0.811 | 83% | 0.832 | S | S | * | * | trans | -160.1 | 98.6 | 140.6 | -153.7 | -105.6 | 0 | 0 | 0 | 111.4 | ||||
| 82 | Y | 46.4 | Very low | 40.3 | Very low | 200 Ų | 200 | 150.3 Ų | 150.3 | 78% | 0.784 | 83% | 0.831 | S | S | * | * | trans | 50.7 | 102.7 | 157.5 | -72.2 | -84.8 | 0 | 0 | 0 | 121.5 | ||||
| 83 | G | 37.3 | Very low | 40.4 | Very low | 77 Ų | 77 | 157.6 Ų | 157.6 | 79% | 0.794 | 84% | 0.837 | S | S | * | * | trans | -84.8 | 145.6 | 143.9 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 84 | K | 38.4 | Very low | 40.3 | Very low | 214 Ų | 214 | 157.1 Ų | 157.1 | 93% | 0.93 | 83% | 0.832 | S | S | * | * | trans | -131 | 104.6 | 166.8 | -130.7 | 171.3 | -177.2 | 175.7 | 0 | 106.7 | ||||
| 85 | S | 38.8 | Very low | 40.3 | Very low | 123 Ų | 123 | 149 Ų | 149 | 86% | 0.86 | 82% | 0.82 | S | S | * | * | trans | -105.4 | 131.1 | 170.1 | 45.5 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 86 | Y | 35.9 | Very low | 40.3 | Very low | 197 Ų | 197 | 155.6 Ų | 155.6 | 77% | 0.773 | 83% | 0.831 | S | S | * | * | trans | -130.9 | 137.1 | 157.1 | 101.6 | -93 | 0 | 0 | 0 | 108.9 | ||||
| 87 | T | 41.8 | Very low | 40.4 | Very low | 126 Ų | 126 | 153.4 Ų | 153.4 | 77% | 0.773 | 83% | 0.829 | S | S | * | * | trans | -68.3 | 142.5 | -179.1 | 42.9 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 88 | G | 38.2 | Very low | 40.5 | Very low | 71 Ų | 71 | 151.7 Ų | 151.7 | 73% | 0.732 | 83% | 0.829 | S | S | * | * | trans | 60.4 | 104.5 | 134.2 | 0 | 0 | 0 | 0 | 0 | 119.3 | ||||
| 89 | M | 48 | Very low | 40.3 | Very low | 181 Ų | 181 | 152.2 Ų | 152.2 | 89% | 0.892 | 83% | 0.834 | S | S | * | * | trans | -138.8 | 111.2 | 140.6 | -80.2 | -167.3 | 171.9 | 0 | 0 | 109.3 | ||||
| 90 | E | 41.1 | Very low | 39.6 | Very low | 190 Ų | 190 | 154.6 Ų | 154.6 | 89% | 0.888 | 83% | 0.831 | S | S | * | * | trans | -97.7 | 126.2 | 158.8 | -167.7 | -176.5 | -173 | 0 | 0 | 106.7 | ||||
| 91 | M | 39.6 | Very low | 39.6 | Very low | 192 Ų | 192 | 155.8 Ų | 155.8 | 95% | 0.946 | 83% | 0.827 | S | S | * | * | trans | -165.1 | 127 | 152.9 | -110.5 | -179.6 | -168 | 0 | 0 | 110.4 | ||||
| 92 | E | 47.4 | Very low | 39.4 | Very low | 181 Ų | 181 | 156.1 Ų | 156.1 | 85% | 0.846 | 83% | 0.832 | S | S | * | * | trans | -55.1 | 145.4 | 176.9 | -57.1 | -171.9 | 134.1 | 0 | 0 | 114.5 | ||||
| 93 | R | 37.2 | Very low | 39.1 | Very low | 251 Ų | 251 | 156 Ų | 156 | 95% | 0.947 | 84% | 0.835 | S | S | * | * | trans | -165.5 | 126.6 | 136.8 | -142 | 166.9 | -77.6 | -174.3 | -5.1 | 113.2 | ||||
| 94 | G | 32.2 | Very low | 39.2 | Very low | 74 Ų | 74 | 163.9 Ų | 163.9 | 76% | 0.763 | 84% | 0.841 | S | S | * | * | trans | 105.8 | 77.2 | 132.6 | 0 | 0 | 0 | 0 | 0 | 118.9 | ||||
| 95 | A | 38.6 | Very low | 39.4 | Very low | 89 Ų | 89 | 165.3 Ų | 165.3 | 74% | 0.736 | 84% | 0.84 | S | S | * | * | trans | 17.1 | 125.1 | 132.4 | 0 | 0 | 0 | 0 | 0 | 121.3 | ||||
| 96 | K | 38 | Very low | 39.2 | Very low | 202 Ų | 202 | 169.6 Ų | 169.6 | 88% | 0.878 | 84% | 0.844 | S | S | * | * | 43.6 | 122.8 | 123.8 | -59.1 | 175.1 | 178.5 | 174.9 | 0 | 119.2 | |||||
| 97 | S | 39.2 | Very low | 39 | Very low | 116 Ų | 116 | 164.4 Ų | 164.4 | 81% | 0.811 | 85% | 0.85 | S | S | * | * | 178 | 116.3 | 104.9 | 56.8 | 0 | 0 | 0 | 0 | 112.6 | |||||
| 98 | D | 38.7 | Very low | 39.1 | Very low | 173 Ų | 173 | 166.1 Ų | 166.1 | 93% | 0.925 | 85% | 0.853 | S | S | * | * | trans | -75.1 | 132.6 | 149.1 | -85.1 | -51.9 | 0 | 0 | 0 | 109.2 | ||||
| 99 | A | 38.1 | Very low | 40.1 | Very low | 92 Ų | 92 | 167 Ų | 167 | 76% | 0.76 | 85% | 0.846 | S | S | * | * | trans | -166.8 | 108.4 | 157.2 | 0 | 0 | 0 | 0 | 0 | 107.3 | ||||
| 100 | F | 33.2 | Very low | 39.5 | Very low | 181 Ų | 181 | 165.4 Ų | 165.4 | 79% | 0.794 | 84% | 0.836 | S | S | * | * | 79.2 | 110.5 | 77.4 | -168.8 | -101 | 0 | 0 | 0 | 113.5 | |||||
| 101 | E | 40.6 | Very low | 39.3 | Very low | 156 Ų | 156 | 162.4 Ų | 162.4 | 73% | 0.729 | 83% | 0.826 | S | S | * | * | trans | 60.3 | 97.1 | 142.4 | -143.9 | 83 | -162.4 | 0 | 0 | 119.5 | ||||
| 102 | E | 39.5 | Very low | 39.4 | Very low | 193 Ų | 193 | 162.4 Ų | 162.4 | 90% | 0.902 | 82% | 0.821 | S | S | * | * | trans | -143.3 | 86.4 | 160 | -170.2 | 176.8 | -167.6 | 0 | 0 | 111.2 | ||||
| 103 | K | 40.4 | Very low | 38.8 | Very low | 198 Ų | 198 | 164.5 Ų | 164.5 | 86% | 0.861 | 82% | 0.822 | S | S | * | * | trans | -170.7 | 68.1 | 138.5 | -137 | 153.4 | -175 | 163.4 | 0 | 114.5 | ||||
| 104 | R | 38.4 | Very low | 39 | Very low | 242 Ų | 242 | 156.9 Ų | 156.9 | 91% | 0.913 | 81% | 0.812 | S | S | * | * | trans | -150.8 | 99.6 | 152.3 | -84.7 | -145.7 | 174.7 | -134.7 | -0.6 | 111.3 | ||||
| 105 | R | 41.8 | Very low | 39.8 | Very low | 243 Ų | 243 | 159.3 Ų | 159.3 | 92% | 0.917 | 82% | 0.815 | S | S | * | * | trans | -165.2 | 137 | 135.1 | -63.8 | -152.8 | 171.8 | -179.9 | -4.9 | 105.1 | ||||
| 106 | K | 35.8 | Very low | 40 | Very low | 214 Ų | 214 | 160 Ų | 160 | 93% | 0.93 | 82% | 0.82 | S | S | * | * | -160.9 | 151.3 | 59.4 | -68.6 | -174.6 | 177.9 | -177.4 | 0 | 111.3 | |||||
| 107 | G | 31.7 | Very low | 40 | Very low | 87 Ų | 87 | 153.9 Ų | 153.9 | 90% | 0.897 | 82% | 0.815 | S | S | * | * | trans | 162.2 | 96.9 | 170.3 | 0 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 108 | L | 43 | Very low | 40.5 | Very low | 163 Ų | 163 | 153.9 Ų | 153.9 | 85% | 0.853 | 81% | 0.812 | S | S | * | * | trans | -130.6 | 170.3 | -172.1 | 180 | 77.8 | 0 | 0 | 0 | 105.8 | ||||
| 109 | P | 59.3 | Low | 41 | Very low | 88 Ų | 88 | 152.6 Ų | 152.6 | 57% | 0.571 | 80% | 0.804 | S | S | * | * | cis | -124.6 | -142.2 | -49.1 | 39.3 | -21 | 0 | 0 | 0 | 109.8 | ||||
| 110 | E | 36 | Very low | 41.3 | Very low | 148 Ų | 148 | 155.1 Ų | 155.1 | 69% | 0.692 | 80% | 0.8 | S | S | * | * | trans | 89.3 | 122 | -178.2 | -51.2 | -56.4 | 118.6 | 0 | 0 | 111.7 | ||||
| 111 | D | 36.5 | Very low | 41.9 | Very low | 127 Ų | 127 | 153.8 Ų | 153.8 | 68% | 0.679 | 80% | 0.801 | S | S | * | * | cis | -165.5 | 166.5 | 19.4 | -117.8 | -36.3 | 0 | 0 | 0 | 112.1 | ||||
| 112 | F | 42.2 | Very low | 42.3 | Very low | 192 Ų | 192 | 150.8 Ų | 150.8 | 84% | 0.842 | 80% | 0.803 | S | S | * | * | trans | -43.2 | 150.4 | -179.2 | -79.3 | -108.3 | 0 | 0 | 0 | 119.2 | ||||
| 113 | R | 34 | Very low | 42.7 | Very low | 226 Ų | 226 | 151.4 Ų | 151.4 | 85% | 0.853 | 80% | 0.803 | S | S | * | * | trans | 110.7 | 109.4 | 130.5 | -153 | 157.2 | -171.9 | 178 | 1.1 | 117.9 | ||||
| 114 | A | 42.3 | Very low | 42.8 | Very low | 91 Ų | 91 | 147.8 Ų | 147.8 | 75% | 0.752 | 80% | 0.798 | S | S | * | * | trans | -72.8 | 149.2 | 150.1 | 0 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 115 | P | 47.7 | Very low | 43.4 | Very low | 125 Ų | 125 | 145.8 Ų | 145.8 | 81% | 0.812 | 80% | 0.799 | S | S | * | * | -136 | 166.3 | 122.5 | 32.5 | -17.1 | 0 | 0 | 0 | 113.3 | |||||
| 116 | A | 44.5 | Very low | 43.8 | Very low | 103 Ų | 103 | 142.4 Ų | 142.4 | 85% | 0.851 | 79% | 0.793 | S | S | * | * | trans | -85.9 | 145.1 | -166.8 | 0 | 0 | 0 | 0 | 0 | 115.5 | ||||
| 117 | G | 36.1 | Very low | 44.5 | Very low | 74 Ų | 74 | 138.8 Ų | 138.8 | 76% | 0.763 | 78% | 0.783 | S | S | * | * | trans | 70.1 | 171.4 | 147.1 | 0 | 0 | 0 | 0 | 0 | 119.9 | ||||
| 118 | P | 49.8 | Very low | 45.5 | Very low | 115 Ų | 115 | 143.8 Ų | 143.8 | 75% | 0.747 | 78% | 0.783 | S | S | * | * | cis | -135.2 | 163.4 | -44.1 | 38.3 | -22.4 | 0 | 0 | 0 | 113.8 | ||||
| 119 | L | 50.1 | Low | 46.3 | Very low | 146 Ų | 146 | 146 Ų | 146 | 76% | 0.764 | 78% | 0.781 | S | S | * | * | trans | 62.2 | 139 | 147.5 | -74.3 | 154.7 | 0 | 0 | 0 | 122.2 | ||||
| 120 | E | 45.2 | Very low | 46.3 | Very low | 145 Ų | 145 | 147.6 Ų | 147.6 | 68% | 0.678 | 79% | 0.79 | S | S | * | * | trans | 83.5 | 120.1 | 156.1 | -37.9 | -48.6 | 166.7 | 0 | 0 | 123.3 | ||||
| 121 | D | 46 | Very low | 47.6 | Very low | 153 Ų | 153 | 149.8 Ų | 149.8 | 82% | 0.818 | 80% | 0.798 | S | S | * | * | trans | 62.2 | 101.7 | 139.9 | -79.3 | -43 | 0 | 0 | 0 | 121.7 | ||||
| 122 | A | 47.5 | Very low | 48.9 | Very low | 93 Ų | 93 | 149.3 Ų | 149.3 | 77% | 0.769 | 80% | 0.802 | S | S | * | * | trans | -151 | 109.6 | 139.2 | 0 | 0 | 0 | 0 | 0 | 111.4 | T124 | A122-T124 PolarHBondContact O-N 2.71Š| ||
| 123 | K | 48.1 | Very low | 50.1 | Low | 206 Ų | 206 | 151.7 Ų | 151.7 | 90% | 0.896 | 81% | 0.805 | S | S | * | * | trans | -46.1 | 119.4 | 164.8 | -73.1 | 175.1 | 173.6 | 176.7 | 0 | 110.8 | ||||
| 124 | T | 43 | Very low | 51.8 | Low | 123 Ų | 123 | 152.7 Ų | 152.7 | 76% | 0.755 | 81% | 0.809 | S | S | * | * | trans | -124.6 | 105.1 | 154.8 | -53.3 | 0 | 0 | 0 | 0 | 106.8 | A122 E126 | A122-T124 PolarHBondContact O-N 2.71Å; T124-E126 PolarHBondContact O-N 2.9Å | ||
| 125 | E | 51.2 | Low | 53.5 | Low | 200 Ų | 200 | 160 Ų | 160 | 94% | 0.935 | 82% | 0.817 | S | S | * | * | trans | -61.5 | 88.7 | 162.6 | -89.1 | -153.1 | 160.2 | 0 | 0 | 108.1 | L127 | E125-L127 PolarHBondContact O-N 3.31Š| ||
| 126 | E | 49 | Very low | 55.2 | Low | 171 Ų | 171 | 165.6 Ų | 165.6 | 80% | 0.799 | 82% | 0.822 | S | S | * | * | trans | -85.3 | 96 | 165.5 | -168.1 | 176.7 | 175.3 | 0 | 0 | 107.5 | T124 E128 | T124-E126 PolarHBondContact O-N 2.9Å; E126-E128 PolarHBondContact O-N 2.86Å | ||
| 127 | L | 52.1 | Low | 56.9 | Low | 139 Ų | 139 | 170.1 Ų | 170.1 | 73% | 0.728 | 82% | 0.822 | S | S | * | * | trans | -25.5 | 100 | 163.7 | -158.2 | 90.8 | 0 | 0 | 0 | 111.2 | E125 R129 | E125-L127 PolarHBondContact O-N 3.31Å; L127-R129 VanDerWaalsContact C-N 3.26Å; L127-R129 PolarHBondContact O-N 3.24Å | ||
| 128 | E | 51.4 | Low | 59.3 | Low | 192 Ų | 192 | 172.1 Ų | 172.1 | 90% | 0.897 | 82% | 0.822 | S | S | * | * | trans | -60.9 | 89.5 | 175.8 | -87.2 | -163.1 | 141.9 | 0 | 0 | 108.9 | E126 P130 | E126-E128 PolarHBondContact O-N 2.86Å; E128-P130 WeakPolarHBondContact O-CD 3.42Å | ||
| 129 | R | 61.3 | Low | 61.2 | Low | 210 Ų | 210 | 178.2 Ų | 178.2 | 79% | 0.792 | 83% | 0.83 | S | S | * | * | trans | -62.9 | 123.9 | 165.5 | -77.1 | 179.8 | -159.7 | -140.6 | -0.2 | 106.6 | L127 K131 | L127-R129 VanDerWaalsContact C-N 3.26Å; L127-R129 PolarHBondContact O-N 3.24Å; R129-K131 PolarHBondContact O-N 3.34Å | ||
| 130 | P | 59.4 | Low | 63.2 | Low | 120 Ų | 120 | 177.2 Ų | 177.2 | 78% | 0.779 | 83% | 0.83 | S | S | * | * | trans | -59.9 | 113.4 | 176.4 | 22.4 | -30.7 | 0 | 0 | 0 | 108.3 | E128 P132 | E128-P130 WeakPolarHBondContact O-CD 3.42Å; P130-P132 VanDerWaalsContact O-N 3.1Å | ||
| 131 | K | 62.2 | Low | 65.6 | Low | 195 Ų | 195 | 177.7 Ų | 177.7 | 85% | 0.848 | 84% | 0.836 | S | S | * | * | trans | -44.6 | 118.7 | 176.6 | -139.9 | 122.5 | 178.7 | 173.4 | 0 | 107.9 | R129 R133 | R129-K131 PolarHBondContact O-N 3.34Å; K131-R133 PolarHBondContact O-N 3.33Å | ||
| 132 | P | 64.1 | Low | 68 | Low | 117 Ų | 117 | 173.4 Ų | 173.4 | 76% | 0.76 | 81% | 0.81 | S | S | * | * | trans | -60.2 | 114.4 | -175.5 | 20.9 | -30.9 | 0 | 0 | 0 | 108.4 | P130 R134 | P130-P132 VanDerWaalsContact O-N 3.1Å; P132-R134 PolarHBondContact O-N 3Å | ||
| 133 | R | 68.1 | Low | 70.4 | Confident | 242 Ų | 242 | 171.7 Ų | 171.7 | 91% | 0.913 | 79% | 0.793 | S | S | * | * | trans | -48.8 | 116 | 176.9 | -72.1 | -178.8 | 170.7 | 139.3 | -1.6 | 107.6 | K131 R135 | K131-R133 PolarHBondContact O-N 3.33Å; R133-R135 PolarHBondContact O-N 2.89Å | ||
| 134 | R | 69.6 | Low | 72.8 | Confident | 247 Ų | 247 | 169.2 Ų | 169.2 | 93% | 0.932 | 78% | 0.784 | S | S | * | * | trans | -52.4 | 109.1 | -178.2 | -74.7 | -161.3 | 171 | -138.2 | 0.9 | 108.8 | P132 R136 | P132-R134 PolarHBondContact O-N 3Å; R134-R136 PolarHBondContact O-N 3.33Å | ||
| 135 | R | 77 | Confident | 75.4 | Confident | 244 Ų | 244 | 166.8 Ų | 166.8 | 92% | 0.921 | 78% | 0.777 | S | S | * | * | P | Polyproline II helix | trans | -56.8 | 130.6 | 178.4 | -70.5 | -173.3 | 169.6 | -167.4 | -2.5 | 108.3 | R133 | R133-R135 PolarHBondContact O-N 2.89Š|
| 136 | R | 83.3 | Confident | 77.7 | Confident | 243 Ų | 243 | 159 Ų | 159 | 92% | 0.917 | 74% | 0.741 | S | S | * | * | P | Polyproline II helix | trans | -57.2 | 142.1 | 178.1 | -74.7 | 179 | 153.5 | -171.4 | -6.7 | 109.2 | R134 | R134-R136 PolarHBondContact O-N 3.33Š|
| 137 | K | 80.8 | Confident | 80.1 | Confident | 197 Ų | 197 | 152.4 Ų | 152.4 | 86% | 0.857 | 71% | 0.712 | S | S | * | * | P | Polyproline II helix | trans | -58.1 | 135.5 | 177.1 | -74.8 | 94 | 165.9 | -167.1 | 0 | 109.5 | ||
| 138 | P | 85.8 | Confident | 82.3 | Confident | 116 Ų | 116 | 152.5 Ų | 152.5 | 75% | 0.753 | 70% | 0.703 | S | S | * | * | P | Polyproline II helix | trans | -58.2 | 143.8 | 174.9 | 24.1 | -32 | 0 | 0 | 0 | 110.2 | V140 | P138-V140 PolarHBondContact O-N 3.01Š|
| 139 | R | 90.6 | Very high | 84.5 | Confident | 243 Ų | 243 | 146 Ų | 146 | 92% | 0.917 | 67% | 0.673 | S | S | * | * | P | Polyproline II helix | trans | -71.3 | 127.1 | 175.9 | -69.5 | -177.7 | 177.6 | 172.2 | -1 | 108.5 | ||
| 140 | V | 90.9 | Very high | 86.3 | Confident | 126 Ų | 126 | 136 Ų | 136 | 76% | 0.764 | 64% | 0.635 | S | S | * | * | P | Polyproline II helix | trans | -91.6 | 130.7 | 173.9 | -178.8 | 0 | 0 | 0 | 0 | 108.4 | P138 | P138-V140 PolarHBondContact O-N 3.01Š|
| 141 | L | 95.2 | Very high | 88.1 | Confident | 155 Ų | 155 | 133.3 Ų | 133.3 | 81% | 0.812 | 61% | 0.612 | S | S | * | * | P | Polyproline II helix | trans | -96.8 | 150.8 | 173.3 | -61.9 | 178.6 | 0 | 0 | 0 | 110 | ||
| 142 | F | 97.8 | Very high | 89.9 | Confident | 62 Ų | 62 | 130 Ų | 130 | 27% | 0.272 | 59% | 0.594 | S | S | . | * | P | Polyproline II helix | trans | -76.3 | 146.2 | 171 | -58.4 | -39.5 | 0 | 0 | 0 | 110.2 | Q146 V147 L150 L174 Q178 W182 | F142-Q146 HydrophobicContact CB-CB 4.24Å; F142-V147 HydrophobicContact CB-CG2 3.94Å; F142-L150 HydrophobicContact CD2-CD1 4.36Å; F142-L174 HydrophobicContact CD1-CD1 4.35Å; F142-L174 HydrophobicContact CD1-CD2 3.86Å; F142-L174 HydrophobicContact CE1-CD1 4.27Å; F142-L174 HydrophobicContact CE1-CD2 3.77Å; F142-Q178 HydrophobicContact CE1-CB 4.41Å; F142-Q178 HydrophobicContact CE1-CG 4.4Å; F142-Q178 HydrophobicContact CZ-CB 4.01Å; F142-Q178 HydrophobicContact CZ-CG 4.26Å; F142-W182 AromaticContact CD2-CD1 3.7Å; F142-W182 HydrophobicContact CE2-CB 4.23Å; F142-W182 AromaticContact CE2-CD1 3.61Å; F142-W182 HydrophobicContact CE2-CG 4.25Å |
| 143 | S | 98.3 | Very high | 91.5 | Very high | 58 Ų | 58 | 128.3 Ų | 128.3 | 41% | 0.406 | 57% | 0.573 | S | S | . | * | P | Polyproline II helix | trans | -65.7 | 158.7 | 172.5 | 66.3 | 0 | 0 | 0 | 0 | 111.2 | A145 Q146 V147 | S143-A145 VanDerWaalsContact C-N 3.29Å; S143-A145 PolarHBondContact O-N 3.43Å; S143-Q146 WeakPolarHBondContact O-CB 3.26Å; S143-Q146 PolarHBondContact O-N 3.33Å; S143-Q146 VanDerWaalsContact O-N 3.15Å; S143-Q146 WeakPolarHBondContact OG-CB 3.48Å; S143-Q146 VanDerWaalsContact OG-CD 3.28Å; S143-Q146 WeakPolarHBondContact OG-CG 3.42Å; S143-Q146 PolarHBondContact OG-N 2.93Å; S143-Q146 PolarHBondContact OG-OE1 2.93Å; S143-V147 WeakPolarHBondContact O-CG2 3.21Å; S143-V147 PolarHBondContact O-N 3Å |
| 144 | Q | 98.2 | Very high | 93 | Very high | 153 Ų | 153 | 117.2 Ų | 117.2 | 72% | 0.715 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -61.2 | -38.1 | 179.7 | -170.7 | 62.4 | 10.6 | 0 | 0 | 112.6 | Q146 V147 Y148 | Q144-Q146 PolarHBondContact O-N 2.95Å; Q144-V147 PolarHBondContact O-N 3.3Å; Q144-Y148 WeakPolarHBondContact O-CB 3.46Å; Q144-Y148 PolarHBondContact O-N 3.15Å |
| 145 | A | 98.1 | Very high | 94.3 | Very high | 72 Ų | 72 | 113.8 Ų | 113.8 | 60% | 0.595 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -62.8 | -41.5 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | S143 Y148 E149 | S143-A145 VanDerWaalsContact C-N 3.29Å; S143-A145 PolarHBondContact O-N 3.43Å; A145-Y148 PolarHBondContact O-N 3.15Å; A145-E149 PolarHBondContact O-N 3.39Å; A145-E149 VanDerWaalsContact O-N 3.15Å |
| 146 | Q | 98.6 | Very high | 95.3 | Very high | 38 Ų | 38 | 107.9 Ų | 107.9 | 18% | 0.178 | 51% | 0.506 | C | S | . | . | H | α-helix | trans | -63.2 | -44.9 | 174.8 | -73.6 | 167.3 | -34.6 | 0 | 0 | 111.4 | F142 S143 Q144 Y148 L150 L172 | F142-Q146 HydrophobicContact CB-CB 4.24Å; S143-Q146 WeakPolarHBondContact O-CB 3.26Å; S143-Q146 PolarHBondContact O-N 3.33Å; S143-Q146 VanDerWaalsContact O-N 3.15Å; S143-Q146 WeakPolarHBondContact OG-CB 3.48Å; S143-Q146 VanDerWaalsContact OG-CD 3.28Å; S143-Q146 WeakPolarHBondContact OG-CG 3.42Å; S143-Q146 PolarHBondContact OG-N 2.93Å; S143-Q146 PolarHBondContact OG-OE1 2.93Å; Q144-Q146 PolarHBondContact O-N 2.95Å; Q146-Y148 VanDerWaalsContact C-N 3.34Å; Q146-Y148 PolarHBondContact O-N 3.5Å; Q146-L150 WeakPolarHBondContact O-CB 3.41Å; Q146-L150 WeakPolarHBondContact O-CD1 3.36Å; Q146-L150 WeakPolarHBondContact O-CG 3.47Å; Q146-L150 PolarHBondContact O-N 2.77Å; Q146-L172 HydrophobicContact CG-CB 4.45Å; Q146-L172 PolarHBondContact NE2-O 2.88Å |
| 147 | V | 98.5 | Very high | 96 | Very high | 32 Ų | 32 | 99.1 Ų | 99.1 | 19% | 0.194 | 48% | 0.476 | C | S | . | . | H | α-helix | trans | -62.4 | -42.9 | 177.7 | 176.5 | 0 | 0 | 0 | 0 | 110.9 | F142 S143 Q144 L150 E151 | F142-V147 HydrophobicContact CB-CG2 3.94Å; S143-V147 WeakPolarHBondContact O-CG2 3.21Å; S143-V147 PolarHBondContact O-N 3Å; Q144-V147 PolarHBondContact O-N 3.3Å; V147-L150 PolarHBondContact O-N 3.02Å; V147-E151 HydrophobicContact CG1-CG 4.26Å; V147-E151 WeakPolarHBondContact O-CB 3.44Å; V147-E151 WeakPolarHBondContact O-CG 3.47Å; V147-E151 PolarHBondContact O-N 3.13Å |
| 148 | Y | 98.5 | Very high | 96.8 | Very high | 141 Ų | 141 | 95 Ų | 95 | 55% | 0.553 | 46% | 0.455 | S | S | * | . | H | α-helix | trans | -57.7 | -50.9 | 178.7 | 173.2 | -94.7 | 0 | 0 | 0 | 112.2 | Q144 A145 Q146 L150 E151 R152 | Q144-Y148 WeakPolarHBondContact O-CB 3.46Å; Q144-Y148 PolarHBondContact O-N 3.15Å; A145-Y148 PolarHBondContact O-N 3.15Å; Q146-Y148 VanDerWaalsContact C-N 3.34Å; Q146-Y148 PolarHBondContact O-N 3.5Å; Y148-L150 PolarHBondContact O-N 2.87Å; Y148-E151 PolarHBondContact O-N 3.49Å; Y148-R152 WeakPolarHBondContact O-CB 3.17Å; Y148-R152 PolarHBondContact O-N 3.49Å |
| 149 | E | 98.6 | Very high | 97.4 | Very high | 56 Ų | 56 | 96.6 Ų | 96.6 | 26% | 0.262 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -67.3 | -37 | 179.6 | -79.6 | -60.8 | 144.8 | 0 | 0 | 112.5 | A145 E151 R152 R153 L172 | A145-E149 PolarHBondContact O-N 3.39Å; A145-E149 VanDerWaalsContact O-N 3.15Å; E149-E151 VanDerWaalsContact C-N 3.35Å; E149-E151 PolarHBondContact O-N 3.46Å; E149-R152 PolarHBondContact O-N 3.04Å; E149-R152 IonicContact OE1-NH1 3.02Å; E149-R152 PolarHBondContact OE1-NH1 3.49Å; E149-R152 IonicContact OE2-NH1 3.6Å; E149-R153 WeakPolarHBondContact O-CB 3.44Å; E149-R153 PolarHBondContact O-N 3.08Å; E149-L172 HydrophobicContact CB-CD1 4.21Å; E149-L172 HydrophobicContact CB-CD2 3.56Å; E149-L172 HydrophobicContact CB-CG 4.48Å; E149-L172 HydrophobicContact CG-CD2 4.03Å |
| 150 | L | 98.7 | Very high | 97.8 | Very high | 0 Ų | 0 | 86.1 Ų | 86.1 | 0% | 0 | 41% | 0.409 | C | S | . | . | H | α-helix | trans | -60.1 | -44.7 | 172.2 | -72.8 | 165.8 | 0 | 0 | 0 | 111.4 | F142 Q146 V147 Y148 F154 L168 L172 L174 V179 W182 F183 | F142-L150 HydrophobicContact CD2-CD1 4.36Å; Q146-L150 WeakPolarHBondContact O-CB 3.41Å; Q146-L150 WeakPolarHBondContact O-CD1 3.36Å; Q146-L150 WeakPolarHBondContact O-CG 3.47Å; Q146-L150 PolarHBondContact O-N 2.77Å; V147-L150 PolarHBondContact O-N 3.02Å; Y148-L150 PolarHBondContact O-N 2.87Å; L150-F154 VanDerWaalsContact O-CB 3.28Å; L150-F154 WeakPolarHBondContact O-CB 3.4Å; L150-F154 PolarHBondContact O-N 3.36Å; L150-L168 HydrophobicContact CD2-CD2 4.01Å; L150-L172 HydrophobicContact CD1-CD1 4.49Å; L150-L172 HydrophobicContact CD2-CD1 3.82Å; L150-L172 HydrophobicContact CG-CD1 3.68Å; L150-L174 HydrophobicContact CD1-CD1 4.21Å; L150-V179 HydrophobicContact CD2-CG1 4.36Å; L150-V179 HydrophobicContact CD2-CG2 4.49Å; L150-W182 HydrophobicContact CB-CD2 3.9Å; L150-W182 HydrophobicContact CB-CE3 3.86Å; L150-W182 HydrophobicContact CB-CH2 3.66Å; L150-W182 HydrophobicContact CB-CZ2 3.68Å; L150-W182 HydrophobicContact CB-CZ3 3.75Å; L150-W182 HydrophobicContact CD1-CD2 3.84Å; L150-W182 HydrophobicContact CD1-CE3 4.47Å; L150-W182 HydrophobicContact CD1-CG 3.83Å; L150-W182 HydrophobicContact CD2-CD2 4.33Å; L150-W182 HydrophobicContact CD2-CE3 4.2Å; L150-W182 HydrophobicContact CG-CD2 4.24Å; L150-W182 HydrophobicContact CG-CE3 4.4Å; L150-F183 HydrophobicContact CD2-CD2 4.48Å; L150-F183 HydrophobicContact CD2-CE2 3.93Å |
| 151 | E | 98.4 | Very high | 98.1 | Very high | 62 Ų | 62 | 82.7 Ų | 82.7 | 29% | 0.29 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -67.6 | -40.8 | 176.9 | -72.8 | -164.8 | 150.6 | 0 | 0 | 112.4 | V147 Y148 E149 F154 K155 W182 R186 | V147-E151 HydrophobicContact CG1-CG 4.26Å; V147-E151 WeakPolarHBondContact O-CB 3.44Å; V147-E151 WeakPolarHBondContact O-CG 3.47Å; V147-E151 PolarHBondContact O-N 3.13Å; Y148-E151 PolarHBondContact O-N 3.49Å; E149-E151 VanDerWaalsContact C-N 3.35Å; E149-E151 PolarHBondContact O-N 3.46Å; E151-F154 PolarHBondContact O-N 2.82Å; E151-K155 WeakPolarHBondContact O-CG 3.37Å; E151-K155 PolarHBondContact O-N 3.25Å; E151-W182 HydrophobicContact CB-CH2 4.39Å; E151-W182 HydrophobicContact CG-CH2 3.69Å; E151-W182 HydrophobicContact CG-CZ2 3.71Å; E151-R186 IonicContact OE1-CZ 3.47Å; E151-R186 IonicContact OE1-NH1 2.77Å; E151-R186 PolarHBondContact OE1-NH1 2.86Å; E151-R186 IonicContact OE1-NH2 3.75Å |
| 152 | R | 98.6 | Very high | 98.3 | Very high | 125 Ų | 125 | 77.7 Ų | 77.7 | 47% | 0.472 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -57.8 | -49.8 | 174.7 | -178.8 | -174.8 | 176.1 | -168.4 | 0.5 | 110.7 | Y148 E149 K155 Q156 | Y148-R152 WeakPolarHBondContact O-CB 3.17Å; Y148-R152 PolarHBondContact O-N 3.49Å; E149-R152 PolarHBondContact O-N 3.04Å; E149-R152 IonicContact OE1-NH1 3.02Å; E149-R152 PolarHBondContact OE1-NH1 3.49Å; E149-R152 IonicContact OE2-NH1 3.6Å; R152-K155 PolarHBondContact O-N 3.5Å; R152-Q156 PolarHBondContact O-N 3.34Å |
| 153 | R | 98.3 | Very high | 98.3 | Very high | 83 Ų | 83 | 79 Ų | 79 | 31% | 0.313 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -66 | -38 | 177.7 | -168.2 | 63.3 | 176 | -174.9 | -1.1 | 112 | E149 K155 Q156 Q157 L160 L168 F183 | E149-R153 WeakPolarHBondContact O-CB 3.44Å; E149-R153 PolarHBondContact O-N 3.08Å; R153-K155 VanDerWaalsContact C-N 3.32Å; R153-K155 PolarHBondContact O-N 3.02Å; R153-Q156 WeakPolarHBondContact O-CB 3.47Å; R153-Q156 PolarHBondContact O-N 2.9Å; R153-Q156 VanDerWaalsContact O-N 3.13Å; R153-Q157 PolarHBondContact O-N 3.48Å; R153-L160 HydrophobicContact CG-CD2 4.26Å; R153-L168 HydrophobicContact CB-CD2 4.27Å; R153-L168 HydrophobicContact CG-CD2 4.1Å; R153-F183 HydrophobicContact CB-CZ 4.38Å; R153-F183 HydrophobicContact CG-CZ 4.32Å |
| 154 | F | 98.6 | Very high | 98.3 | Very high | 9 Ų | 9 | 79 Ų | 79 | 4% | 0.039 | 38% | 0.38 | C | S | . | . | H | α-helix | trans | -62.8 | -36.3 | 177.6 | -176.1 | -94.8 | 0 | 0 | 0 | 113.5 | L150 E151 Q156 Q157 R158 W182 F183 R186 R187 | L150-F154 VanDerWaalsContact O-CB 3.28Å; L150-F154 WeakPolarHBondContact O-CB 3.4Å; L150-F154 PolarHBondContact O-N 3.36Å; E151-F154 PolarHBondContact O-N 2.82Å; F154-Q156 VanDerWaalsContact C-N 3.26Å; F154-Q156 PolarHBondContact O-N 3Å; F154-Q157 CarbonylContact O-C 3.42Å; F154-Q157 PolarHBondContact O-N 3.44Å; F154-R158 HydrophobicContact CE1-CG 4.36Å; F154-R158 HydrophobicContact CE2-CB 4.1Å; F154-R158 HydrophobicContact CE2-CG 4.37Å; F154-R158 HydrophobicContact CZ-CB 4.23Å; F154-R158 HydrophobicContact CZ-CG 4.08Å; F154-W182 HydrophobicContact CB-CH2 4.36Å; F154-W182 HydrophobicContact CB-CZ3 4.06Å; F154-W182 HydrophobicContact CD2-CZ3 4.42Å; F154-W182 HydrophobicContact CG-CZ3 4.41Å; F154-F183 HydrophobicContact CB-CE1 4.2Å; F154-F183 HydrophobicContact CB-CZ 4.35Å; F154-F183 AromaticContact CD2-CD1 3.79Å; F154-F183 HydrophobicContact CD2-CD1 3.79Å; F154-F183 AromaticContact CD2-CE1 3.83Å; F154-F183 HydrophobicContact CD2-CE1 3.83Å; F154-F183 HydrophobicContact CE2-CD1 4.44Å; F154-R186 HydrophobicContact CD1-CG 3.76Å; F154-R186 HydrophobicContact CD2-CB 4.24Å; F154-R186 HydrophobicContact CD2-CG 3.77Å; F154-R186 HydrophobicContact CE1-CG 3.68Å; F154-R186 HydrophobicContact CE2-CB 4.06Å; F154-R186 HydrophobicContact CE2-CG 3.69Å; F154-R186 HydrophobicContact CG-CG 3.8Å; F154-R186 HydrophobicContact CZ-CB 4.36Å; F154-R186 HydrophobicContact CZ-CG 3.64Å; F154-R187 HydrophobicContact CE2-CG 3.8Å; F154-R187 HydrophobicContact CZ-CG 4.11Å |
| 155 | K | 98 | Very high | 98.3 | Very high | 175 Ų | 175 | 74.7 Ų | 74.7 | 76% | 0.761 | 36% | 0.357 | S | S | * | . | H | α-helix | trans | -62.3 | -35.6 | 174.6 | -73.2 | 173.8 | -177.1 | 179.2 | 0 | 111.7 | E151 R152 R153 | E151-K155 WeakPolarHBondContact O-CG 3.37Å; E151-K155 PolarHBondContact O-N 3.25Å; R152-K155 PolarHBondContact O-N 3.5Å; R153-K155 VanDerWaalsContact C-N 3.32Å; R153-K155 PolarHBondContact O-N 3.02Å |
| 156 | Q | 98 | Very high | 98.4 | Very high | 120 Ų | 120 | 75.2 Ų | 75.2 | 56% | 0.561 | 35% | 0.35 | S | S | * | . | H | α-helix | trans | -74.5 | -44.7 | 176.3 | -62.1 | 170.7 | -5 | 0 | 0 | 111.3 | R152 R153 F154 | R152-Q156 PolarHBondContact O-N 3.34Å; R153-Q156 WeakPolarHBondContact O-CB 3.47Å; R153-Q156 PolarHBondContact O-N 2.9Å; R153-Q156 VanDerWaalsContact O-N 3.13Å; F154-Q156 VanDerWaalsContact C-N 3.26Å; F154-Q156 PolarHBondContact O-N 3Å |
| 157 | Q | 97.9 | Very high | 98.4 | Very high | 59 Ų | 59 | 80 Ų | 80 | 28% | 0.276 | 37% | 0.372 | S | S | . | . | trans | -147.9 | 116 | -171.9 | -173.6 | 178.6 | -13 | 0 | 0 | 110.8 | R153 F154 Y159 L160 E164 F183 | R153-Q157 PolarHBondContact O-N 3.48Å; F154-Q157 CarbonylContact O-C 3.42Å; F154-Q157 PolarHBondContact O-N 3.44Å; Q157-Y159 VanDerWaalsContact C-N 3.29Å; Q157-Y159 WeakPolarHBondContact CG-O 3.21Å; Q157-Y159 PolarHBondContact NE2-O 3.5Å; Q157-Y159 PolarHBondContact O-N 3.01Å; Q157-L160 HydrophobicContact CB-CD2 4.35Å; Q157-L160 HydrophobicContact CG-CD2 4.17Å; Q157-E164 PolarHBondContact NE2-OE1 3.2Å; Q157-E164 VanDerWaalsContact NE2-OE1 3.16Å; Q157-E164 PolarHBondContact NE2-OE2 3.02Å; Q157-E164 PolarHBondContact OE1-OE1 3.04Å; Q157-F183 WeakPolarHBondContact O-CE1 3.36Å | ||
| 158 | R | 97.6 | Very high | 98.4 | Very high | 111 Ų | 111 | 79.2 Ų | 79.2 | 42% | 0.419 | 37% | 0.366 | S | S | . | . | S | Bend | trans | -76.2 | -16.8 | -175.6 | -60.4 | 177 | 74.3 | 95.3 | 0.6 | 113.7 | F154 R187 | F154-R158 HydrophobicContact CE1-CG 4.36Å; F154-R158 HydrophobicContact CE2-CB 4.1Å; F154-R158 HydrophobicContact CE2-CG 4.37Å; F154-R158 HydrophobicContact CZ-CB 4.23Å; F154-R158 HydrophobicContact CZ-CG 4.08Å; R158-R187 WeakPolarHBondContact O-CD 3.46Å |
| 159 | Y | 98.3 | Very high | 98.4 | Very high | 148 Ų | 148 | 72.7 Ų | 72.7 | 58% | 0.58 | 34% | 0.342 | S | S | * | . | S | Bend | trans | -136.6 | 117.3 | -176.4 | -64 | -97.4 | 0 | 0 | 0 | 109.5 | Q157 R187 | Q157-Y159 VanDerWaalsContact C-N 3.29Å; Q157-Y159 WeakPolarHBondContact CG-O 3.21Å; Q157-Y159 PolarHBondContact NE2-O 3.5Å; Q157-Y159 PolarHBondContact O-N 3.01Å; Y159-R187 VanDerWaalsContact CE1-CD 3.46Å |
| 160 | L | 98.3 | Very high | 98.4 | Very high | 23 Ų | 23 | 72.1 Ų | 72.1 | 12% | 0.12 | 35% | 0.351 | C | S | . | . | trans | -96.2 | 139.6 | 177 | -62 | -179.8 | 0 | 0 | 0 | 110.9 | R153 Q157 E164 R165 L168 V179 F183 | R153-L160 HydrophobicContact CG-CD2 4.26Å; Q157-L160 HydrophobicContact CB-CD2 4.35Å; Q157-L160 HydrophobicContact CG-CD2 4.17Å; L160-E164 HydrophobicContact CB-CB 4.29Å; L160-E164 HydrophobicContact CD2-CB 4.24Å; L160-R165 HydrophobicContact CB-CG 3.54Å; L160-R165 HydrophobicContact CD1-CG 4.03Å; L160-R165 HydrophobicContact CG-CG 4.45Å; L160-L168 HydrophobicContact CD1-CD2 3.84Å; L160-V179 HydrophobicContact CD1-CG1 4.15Å; L160-F183 HydrophobicContact CD1-CD1 4.26Å; L160-F183 HydrophobicContact CD1-CD2 4.17Å; L160-F183 HydrophobicContact CD1-CE1 3.71Å; L160-F183 HydrophobicContact CD1-CE2 3.61Å; L160-F183 HydrophobicContact CD1-CG 4.48Å; L160-F183 HydrophobicContact CD1-CZ 3.36Å; L160-F183 HydrophobicContact CD2-CE1 4.27Å; L160-F183 HydrophobicContact CD2-CZ 4.43Å; L160-F183 HydrophobicContact CG-CD1 4.07Å; L160-F183 HydrophobicContact CG-CE1 3.6Å; L160-F183 HydrophobicContact CG-CE2 4.41Å; L160-F183 HydrophobicContact CG-CZ 3.81Å | ||
| 161 | S | 98.4 | Very high | 98.3 | Very high | 54 Ų | 54 | 76.3 Ų | 76.3 | 38% | 0.378 | 38% | 0.376 | S | S | . | . | trans | -70.7 | 167.8 | 165.9 | 67.4 | 0 | 0 | 0 | 0 | 111.1 | E164 R165 | S161-E164 VanDerWaalsContact CB-OE2 3.3Å; S161-E164 WeakPolarHBondContact CB-OE2 3.38Å; S161-E164 PolarHBondContact N-OE2 2.74Å; S161-E164 PolarHBondContact O-N 2.77Å; S161-E164 VanDerWaalsContact OG-CG 3.23Å; S161-E164 WeakPolarHBondContact OG-CG 3.14Å; S161-E164 PolarHBondContact OG-OE2 2.76Å; S161-R165 WeakPolarHBondContact O-CG 3.3Å; S161-R165 PolarHBondContact O-N 3.07Å; S161-R165 VanDerWaalsContact O-N 3.12Å | ||
| 162 | A | 98.3 | Very high | 98.3 | Very high | 50 Ų | 50 | 74.1 Ų | 74.1 | 41% | 0.413 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -54.1 | -55.6 | 178 | 0 | 0 | 0 | 0 | 0 | 113.6 | E164 R165 D166 | A162-E164 VanDerWaalsContact C-N 3.3Å; A162-E164 PolarHBondContact O-N 2.88Å; A162-R165 WeakPolarHBondContact O-CB 3.14Å; A162-R165 PolarHBondContact O-N 2.98Å; A162-R165 VanDerWaalsContact O-N 3.14Å; A162-D166 PolarHBondContact O-N 2.89Å; A162-D166 VanDerWaalsContact O-N 3.1Å |
| 163 | P | 98.4 | Very high | 98.3 | Very high | 91 Ų | 91 | 76.7 Ų | 76.7 | 59% | 0.591 | 38% | 0.381 | S | S | * | . | H | α-helix | trans | -63.4 | -34.3 | -177.6 | 24.4 | -35.1 | 0 | 0 | 0 | 113.1 | R165 D166 H167 | P163-R165 PolarHBondContact O-N 3.34Å; P163-D166 PolarHBondContact O-N 2.87Å; P163-H167 PolarHBondContact O-N 3.1Å |
| 164 | E | 98.4 | Very high | 98.3 | Very high | 57 Ų | 57 | 73.8 Ų | 73.8 | 27% | 0.266 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -67 | -37.1 | 177.3 | -67.8 | 168.7 | 136.1 | 0 | 0 | 112.3 | Q157 L160 S161 A162 L168 | Q157-E164 PolarHBondContact NE2-OE1 3.2Å; Q157-E164 VanDerWaalsContact NE2-OE1 3.16Å; Q157-E164 PolarHBondContact NE2-OE2 3.02Å; Q157-E164 PolarHBondContact OE1-OE1 3.04Å; L160-E164 HydrophobicContact CB-CB 4.29Å; L160-E164 HydrophobicContact CD2-CB 4.24Å; S161-E164 VanDerWaalsContact CB-OE2 3.3Å; S161-E164 WeakPolarHBondContact CB-OE2 3.38Å; S161-E164 PolarHBondContact N-OE2 2.74Å; S161-E164 PolarHBondContact O-N 2.77Å; S161-E164 VanDerWaalsContact OG-CG 3.23Å; S161-E164 WeakPolarHBondContact OG-CG 3.14Å; S161-E164 PolarHBondContact OG-OE2 2.76Å; A162-E164 VanDerWaalsContact C-N 3.3Å; A162-E164 PolarHBondContact O-N 2.88Å; E164-L168 WeakPolarHBondContact O-CB 3.47Å; E164-L168 PolarHBondContact O-N 3.38Å |
| 165 | R | 98.7 | Very high | 98.3 | Very high | 62 Ų | 62 | 76.7 Ų | 76.7 | 23% | 0.234 | 39% | 0.39 | C | S | . | . | H | α-helix | trans | -66.3 | -41 | 174.1 | -69.8 | -175.7 | -52.7 | -158.2 | 2.1 | 111.2 | L160 S161 A162 P163 H167 L168 A169 V179 | L160-R165 HydrophobicContact CB-CG 3.54Å; L160-R165 HydrophobicContact CD1-CG 4.03Å; L160-R165 HydrophobicContact CG-CG 4.45Å; S161-R165 WeakPolarHBondContact O-CG 3.3Å; S161-R165 PolarHBondContact O-N 3.07Å; S161-R165 VanDerWaalsContact O-N 3.12Å; A162-R165 WeakPolarHBondContact O-CB 3.14Å; A162-R165 PolarHBondContact O-N 2.98Å; A162-R165 VanDerWaalsContact O-N 3.14Å; P163-R165 PolarHBondContact O-N 3.34Å; R165-H167 VanDerWaalsContact C-N 3.32Å; R165-L168 PolarHBondContact O-N 3Å; R165-A169 WeakPolarHBondContact O-CB 3.31Å; R165-A169 PolarHBondContact O-N 2.92Å; R165-V179 HydrophobicContact CB-CG1 4.41Å; R165-V179 HydrophobicContact CG-CG1 4.21Å |
| 166 | D | 98.6 | Very high | 98.3 | Very high | 83 Ų | 83 | 70.6 Ų | 70.6 | 44% | 0.444 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -63.8 | -41.9 | -179.5 | -63 | -23.6 | 0 | 0 | 0 | 110.7 | A162 P163 A169 G170 P176 | A162-D166 PolarHBondContact O-N 2.89Å; A162-D166 VanDerWaalsContact O-N 3.1Å; P163-D166 PolarHBondContact O-N 2.87Å; D166-A169 PolarHBondContact O-N 3.3Å; D166-G170 PolarHBondContact O-N 3.05Å; D166-P176 VanDerWaalsContact OD1-CB 3.24Å; D166-P176 WeakPolarHBondContact OD1-CB 3.45Å; D166-P176 WeakPolarHBondContact OD1-CG 3.34Å |
| 167 | H | 98.6 | Very high | 98.3 | Very high | 138 Ų | 138 | 69 Ų | 69 | 64% | 0.639 | 37% | 0.367 | S | S | * | . | H | α-helix | trans | -61.2 | -50.9 | 173.4 | -177.9 | 71.2 | 0 | 0 | 0 | 112.4 | P163 R165 A169 G170 V171 | P163-H167 PolarHBondContact O-N 3.1Å; R165-H167 VanDerWaalsContact C-N 3.32Å; H167-A169 VanDerWaalsContact C-N 3.3Å; H167-A169 PolarHBondContact O-N 3.37Å; H167-G170 PolarHBondContact O-N 3.41Å; H167-G170 VanDerWaalsContact O-N 3.1Å; H167-V171 PolarHBondContact O-N 3.01Å; H167-V171 VanDerWaalsContact O-N 3.13Å |
| 168 | L | 98.4 | Very high | 98.3 | Very high | 16 Ų | 16 | 69.4 Ų | 69.4 | 8% | 0.084 | 37% | 0.369 | C | S | . | . | H | α-helix | trans | -63.1 | -37.9 | -179.4 | -173.5 | 62.4 | 0 | 0 | 0 | 112.2 | L150 R153 L160 E164 R165 G170 V171 L172 V179 F183 | L150-L168 HydrophobicContact CD2-CD2 4.01Å; R153-L168 HydrophobicContact CB-CD2 4.27Å; R153-L168 HydrophobicContact CG-CD2 4.1Å; L160-L168 HydrophobicContact CD1-CD2 3.84Å; E164-L168 WeakPolarHBondContact O-CB 3.47Å; E164-L168 PolarHBondContact O-N 3.38Å; R165-L168 PolarHBondContact O-N 3Å; L168-G170 VanDerWaalsContact C-N 3.32Å; L168-G170 PolarHBondContact O-N 3.29Å; L168-V171 PolarHBondContact O-N 3.48Å; L168-L172 HydrophobicContact CD1-CD1 3.86Å; L168-L172 HydrophobicContact CD1-CG 4.14Å; L168-L172 HydrophobicContact CG-CD1 3.97Å; L168-L172 HydrophobicContact CG-CG 4.46Å; L168-L172 WeakPolarHBondContact O-CG 3.12Å; L168-L172 PolarHBondContact O-N 3.07Å; L168-V179 HydrophobicContact CD2-CG1 3.94Å; L168-F183 HydrophobicContact CD2-CE2 3.95Å; L168-F183 HydrophobicContact CD2-CZ 4.27Å |
| 169 | A | 98.6 | Very high | 98.4 | Very high | 4 Ų | 4 | 64.1 Ų | 64.1 | 3% | 0.033 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -59 | -43.7 | 173.5 | 0 | 0 | 0 | 0 | 0 | 111.4 | R165 D166 H167 V171 L172 K173 L174 P176 V179 | R165-A169 WeakPolarHBondContact O-CB 3.31Å; R165-A169 PolarHBondContact O-N 2.92Å; D166-A169 PolarHBondContact O-N 3.3Å; H167-A169 VanDerWaalsContact C-N 3.3Å; H167-A169 PolarHBondContact O-N 3.37Å; A169-V171 PolarHBondContact O-N 2.85Å; A169-L172 PolarHBondContact O-N 2.91Å; A169-K173 WeakPolarHBondContact O-CA 3.42Å; A169-K173 PolarHBondContact O-N 3.13Å; A169-L174 CarbonylContact C-O 3.53Å; A169-L174 VanDerWaalsContact CB-O 3.3Å; A169-L174 WeakPolarHBondContact CB-O 3.28Å; A169-L174 PolarHBondContact O-N 3.49Å; A169-P176 HydrophobicContact CB-CG 4Å; A169-V179 HydrophobicContact CB-CG2 4.1Å |
| 170 | G | 98.4 | Very high | 98.4 | Very high | 44 Ų | 44 | 62.2 Ų | 62.2 | 45% | 0.454 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -61.6 | -40.4 | 176.1 | 0 | 0 | 0 | 0 | 0 | 113.9 | D166 H167 L168 | D166-G170 PolarHBondContact O-N 3.05Å; H167-G170 PolarHBondContact O-N 3.41Å; H167-G170 VanDerWaalsContact O-N 3.1Å; L168-G170 VanDerWaalsContact C-N 3.32Å; L168-G170 PolarHBondContact O-N 3.29Å |
| 171 | V | 97.9 | Very high | 98.4 | Very high | 89 Ų | 89 | 65 Ų | 65 | 54% | 0.539 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -68.7 | -45.2 | 177.7 | 177.3 | 0 | 0 | 0 | 0 | 111.3 | H167 L168 A169 K173 | H167-V171 PolarHBondContact O-N 3.01Å; H167-V171 VanDerWaalsContact O-N 3.13Å; L168-V171 PolarHBondContact O-N 3.48Å; A169-V171 PolarHBondContact O-N 2.85Å; V171-K173 VanDerWaalsContact C-N 3.35Å; V171-K173 PolarHBondContact O-N 3.36Å |
| 172 | L | 97.9 | Very high | 98.4 | Very high | 16 Ų | 16 | 63.9 Ų | 63.9 | 8% | 0.084 | 35% | 0.346 | C | S | . | . | H | α-helix | trans | -88.8 | 0.5 | -173.8 | -59.4 | -177.2 | 0 | 0 | 0 | 114.6 | Q146 E149 L150 L168 A169 L174 | Q146-L172 HydrophobicContact CG-CB 4.45Å; Q146-L172 PolarHBondContact NE2-O 2.88Å; E149-L172 HydrophobicContact CB-CD1 4.21Å; E149-L172 HydrophobicContact CB-CD2 3.56Å; E149-L172 HydrophobicContact CB-CG 4.48Å; E149-L172 HydrophobicContact CG-CD2 4.03Å; L150-L172 HydrophobicContact CD1-CD1 4.49Å; L150-L172 HydrophobicContact CD2-CD1 3.82Å; L150-L172 HydrophobicContact CG-CD1 3.68Å; L168-L172 HydrophobicContact CD1-CD1 3.86Å; L168-L172 HydrophobicContact CD1-CG 4.14Å; L168-L172 HydrophobicContact CG-CD1 3.97Å; L168-L172 HydrophobicContact CG-CG 4.46Å; L168-L172 WeakPolarHBondContact O-CG 3.12Å; L168-L172 PolarHBondContact O-N 3.07Å; A169-L172 PolarHBondContact O-N 2.91Å; L172-L174 HydrophobicContact CB-CD1 4.17Å; L172-L174 HydrophobicContact CB-CG 4.11Å; L172-L174 PolarHBondContact O-N 3.43Å |
| 173 | K | 98.3 | Very high | 98.4 | Very high | 179 Ų | 179 | 61.9 Ų | 61.9 | 78% | 0.778 | 33% | 0.327 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 52.8 | 41.3 | -173.2 | -53 | -58.6 | -178.6 | -169 | 0 | 112.1 | A169 V171 | A169-K173 WeakPolarHBondContact O-CA 3.42Å; A169-K173 PolarHBondContact O-N 3.13Å; V171-K173 VanDerWaalsContact C-N 3.35Å; V171-K173 PolarHBondContact O-N 3.36Å |
| 174 | L | 97.9 | Very high | 98.4 | Very high | 22 Ų | 22 | 60.7 Ų | 60.7 | 12% | 0.115 | 31% | 0.314 | C | S | . | . | trans | -111.5 | 167.9 | 174.3 | -64.9 | -179.9 | 0 | 0 | 0 | 109.6 | F142 L150 A169 L172 Q178 V179 | F142-L174 HydrophobicContact CD1-CD1 4.35Å; F142-L174 HydrophobicContact CD1-CD2 3.86Å; F142-L174 HydrophobicContact CE1-CD1 4.27Å; F142-L174 HydrophobicContact CE1-CD2 3.77Å; L150-L174 HydrophobicContact CD1-CD1 4.21Å; A169-L174 CarbonylContact C-O 3.53Å; A169-L174 VanDerWaalsContact CB-O 3.3Å; A169-L174 WeakPolarHBondContact CB-O 3.28Å; A169-L174 PolarHBondContact O-N 3.49Å; L172-L174 HydrophobicContact CB-CD1 4.17Å; L172-L174 HydrophobicContact CB-CG 4.11Å; L172-L174 PolarHBondContact O-N 3.43Å; L174-Q178 HydrophobicContact CB-CB 4.44Å; L174-V179 HydrophobicContact CB-CG2 4.29Å | ||
| 175 | T | 98.4 | Very high | 98.4 | Very high | 69 Ų | 69 | 62.6 Ų | 62.6 | 42% | 0.423 | 33% | 0.326 | S | S | . | . | trans | -83.5 | 149.1 | 168.9 | 60.8 | 0 | 0 | 0 | 0 | 110.7 | T177 Q178 V179 | T175-T177 PolarHBondContact O-N 2.98Å; T175-T177 VanDerWaalsContact O-N 3.12Å; T175-Q178 WeakPolarHBondContact O-CB 3.24Å; T175-Q178 PolarHBondContact O-N 3.12Å; T175-Q178 WeakPolarHBondContact OG1-CB 3.44Å; T175-Q178 VanDerWaalsContact OG1-CD 3.29Å; T175-Q178 WeakPolarHBondContact OG1-CG 3.23Å; T175-Q178 PolarHBondContact OG1-N 3.29Å; T175-Q178 PolarHBondContact OG1-OE1 2.93Å; T175-V179 PolarHBondContact O-N 3.12Å; T175-V179 VanDerWaalsContact O-N 3.12Å | ||
| 176 | P | 98.3 | Very high | 98.3 | Very high | 47 Ų | 47 | 62.7 Ų | 62.7 | 31% | 0.305 | 33% | 0.326 | S | S | . | . | H | α-helix | trans | -54.7 | -32.6 | 174.4 | -26.7 | 34.9 | 0 | 0 | 0 | 113 | D166 A169 V179 K180 | D166-P176 VanDerWaalsContact OD1-CB 3.24Å; D166-P176 WeakPolarHBondContact OD1-CB 3.45Å; D166-P176 WeakPolarHBondContact OD1-CG 3.34Å; A169-P176 HydrophobicContact CB-CG 4Å; P176-V179 PolarHBondContact O-N 2.87Å; P176-K180 WeakPolarHBondContact O-CB 3.36Å; P176-K180 PolarHBondContact O-N 3.26Å |
| 177 | T | 98.4 | Very high | 98.3 | Very high | 88 Ų | 88 | 62.4 Ų | 62.4 | 54% | 0.54 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -66.7 | -42.1 | 175.1 | -57.8 | 0 | 0 | 0 | 0 | 112.5 | T175 V179 K180 I181 | T175-T177 PolarHBondContact O-N 2.98Å; T175-T177 VanDerWaalsContact O-N 3.12Å; T177-V179 VanDerWaalsContact C-N 3.33Å; T177-V179 PolarHBondContact O-N 3.5Å; T177-K180 WeakPolarHBondContact O-CB 3.38Å; T177-K180 PolarHBondContact O-N 3.44Å; T177-I181 HydrophobicContact CG2-CD1 3.95Å; T177-I181 HydrophobicContact CG2-CG1 4.48Å; T177-I181 VanDerWaalsContact O-CG1 3.32Å; T177-I181 WeakPolarHBondContact O-CG1 3.49Å; T177-I181 PolarHBondContact O-N 3.28Å |
| 178 | Q | 98.3 | Very high | 98.3 | Very high | 67 Ų | 67 | 61.7 Ų | 61.7 | 31% | 0.313 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -62.4 | -42.4 | 174.5 | -78.3 | 164.5 | -43.4 | 0 | 0 | 111.2 | F142 L174 T175 I181 W182 | F142-Q178 HydrophobicContact CE1-CB 4.41Å; F142-Q178 HydrophobicContact CE1-CG 4.4Å; F142-Q178 HydrophobicContact CZ-CB 4.01Å; F142-Q178 HydrophobicContact CZ-CG 4.26Å; L174-Q178 HydrophobicContact CB-CB 4.44Å; T175-Q178 WeakPolarHBondContact O-CB 3.24Å; T175-Q178 PolarHBondContact O-N 3.12Å; T175-Q178 WeakPolarHBondContact OG1-CB 3.44Å; T175-Q178 VanDerWaalsContact OG1-CD 3.29Å; T175-Q178 WeakPolarHBondContact OG1-CG 3.23Å; T175-Q178 PolarHBondContact OG1-N 3.29Å; T175-Q178 PolarHBondContact OG1-OE1 2.93Å; Q178-I181 PolarHBondContact O-N 3.43Å; Q178-W182 WeakPolarHBondContact O-CB 3.43Å; Q178-W182 PolarHBondContact O-N 2.83Å |
| 179 | V | 98.6 | Very high | 98.2 | Very high | 0 Ų | 0 | 67.3 Ų | 67.3 | 0% | 0 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -60.6 | -46.8 | 174 | 178 | 0 | 0 | 0 | 0 | 110.2 | L150 L160 R165 L168 A169 L174 T175 P176 T177 I181 W182 F183 | L150-V179 HydrophobicContact CD2-CG1 4.36Å; L150-V179 HydrophobicContact CD2-CG2 4.49Å; L160-V179 HydrophobicContact CD1-CG1 4.15Å; R165-V179 HydrophobicContact CB-CG1 4.41Å; R165-V179 HydrophobicContact CG-CG1 4.21Å; L168-V179 HydrophobicContact CD2-CG1 3.94Å; A169-V179 HydrophobicContact CB-CG2 4.1Å; L174-V179 HydrophobicContact CB-CG2 4.29Å; T175-V179 PolarHBondContact O-N 3.12Å; T175-V179 VanDerWaalsContact O-N 3.12Å; P176-V179 PolarHBondContact O-N 2.87Å; T177-V179 VanDerWaalsContact C-N 3.33Å; T177-V179 PolarHBondContact O-N 3.5Å; V179-I181 PolarHBondContact O-N 3.36Å; V179-W182 PolarHBondContact O-N 3.39Å; V179-F183 HydrophobicContact CG1-CD2 3.81Å; V179-F183 HydrophobicContact CG1-CE2 3.9Å; V179-F183 VanDerWaalsContact O-CD2 3.31Å; V179-F183 WeakPolarHBondContact O-CD2 3.43Å; V179-F183 PolarHBondContact O-N 3.49Å |
| 180 | K | 98.4 | Very high | 97.9 | Very high | 107 Ų | 107 | 68.2 Ų | 68.2 | 47% | 0.465 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -55.6 | -49.9 | 175.8 | 178.1 | -174.5 | 176.6 | -177 | 0 | 112.1 | P176 T177 F183 Q184 | P176-K180 WeakPolarHBondContact O-CB 3.36Å; P176-K180 PolarHBondContact O-N 3.26Å; T177-K180 WeakPolarHBondContact O-CB 3.38Å; T177-K180 PolarHBondContact O-N 3.44Å; K180-F183 PolarHBondContact O-N 3.31Å; K180-Q184 WeakPolarHBondContact O-CB 3.32Å; K180-Q184 PolarHBondContact O-N 3.38Å |
| 181 | I | 98.4 | Very high | 97.8 | Very high | 81 Ų | 81 | 71.6 Ų | 71.6 | 42% | 0.415 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -63.8 | -43.6 | -179.7 | -69 | 168 | 0 | 0 | 0 | 110.3 | T177 Q178 V179 F183 Q184 N185 | T177-I181 HydrophobicContact CG2-CD1 3.95Å; T177-I181 HydrophobicContact CG2-CG1 4.48Å; T177-I181 VanDerWaalsContact O-CG1 3.32Å; T177-I181 WeakPolarHBondContact O-CG1 3.49Å; T177-I181 PolarHBondContact O-N 3.28Å; Q178-I181 PolarHBondContact O-N 3.43Å; V179-I181 PolarHBondContact O-N 3.36Å; I181-F183 PolarHBondContact O-N 3.47Å; I181-Q184 WeakPolarHBondContact O-CB 3.46Å; I181-Q184 PolarHBondContact O-N 3.44Å; I181-N185 WeakPolarHBondContact O-CB 3.23Å; I181-N185 VanDerWaalsContact O-CG 3.3Å; I181-N185 PolarHBondContact O-N 2.95Å |
| 182 | W | 98.4 | Very high | 97.5 | Very high | 32 Ų | 32 | 75.2 Ų | 75.2 | 12% | 0.121 | 35% | 0.347 | C | S | . | . | H | α-helix | trans | -61.9 | -46.6 | 178.7 | -171.2 | 97 | 0 | 0 | 0 | 111.5 | F142 L150 E151 F154 Q178 V179 Q184 N185 R186 | F142-W182 AromaticContact CD2-CD1 3.7Å; F142-W182 HydrophobicContact CE2-CB 4.23Å; F142-W182 AromaticContact CE2-CD1 3.61Å; F142-W182 HydrophobicContact CE2-CG 4.25Å; L150-W182 HydrophobicContact CB-CD2 3.9Å; L150-W182 HydrophobicContact CB-CE3 3.86Å; L150-W182 HydrophobicContact CB-CH2 3.66Å; L150-W182 HydrophobicContact CB-CZ2 3.68Å; L150-W182 HydrophobicContact CB-CZ3 3.75Å; L150-W182 HydrophobicContact CD1-CD2 3.84Å; L150-W182 HydrophobicContact CD1-CE3 4.47Å; L150-W182 HydrophobicContact CD1-CG 3.83Å; L150-W182 HydrophobicContact CD2-CD2 4.33Å; L150-W182 HydrophobicContact CD2-CE3 4.2Å; L150-W182 HydrophobicContact CG-CD2 4.24Å; L150-W182 HydrophobicContact CG-CE3 4.4Å; E151-W182 HydrophobicContact CB-CH2 4.39Å; E151-W182 HydrophobicContact CG-CH2 3.69Å; E151-W182 HydrophobicContact CG-CZ2 3.71Å; F154-W182 HydrophobicContact CB-CH2 4.36Å; F154-W182 HydrophobicContact CB-CZ3 4.06Å; F154-W182 HydrophobicContact CD2-CZ3 4.42Å; F154-W182 HydrophobicContact CG-CZ3 4.41Å; Q178-W182 WeakPolarHBondContact O-CB 3.43Å; Q178-W182 PolarHBondContact O-N 2.83Å; V179-W182 PolarHBondContact O-N 3.39Å; W182-Q184 VanDerWaalsContact C-N 3.29Å; W182-Q184 PolarHBondContact O-N 2.91Å; W182-N185 PolarHBondContact O-N 3.13Å; W182-R186 HydrophobicContact CE3-CB 4.14Å; W182-R186 HydrophobicContact CH2-CB 4.19Å; W182-R186 HydrophobicContact CH2-CG 3.94Å; W182-R186 HydrophobicContact CZ3-CB 3.87Å; W182-R186 HydrophobicContact CZ3-CG 3.95Å; W182-R186 WeakPolarHBondContact O-CB 3.39Å; W182-R186 PolarHBondContact O-N 3.34Å |
| 183 | F | 98.7 | Very high | 97.2 | Very high | 7 Ų | 7 | 79.6 Ų | 79.6 | 3% | 0.031 | 37% | 0.367 | C | S | . | . | H | α-helix | trans | -63.3 | -35.6 | 176.8 | -90.6 | -106.1 | 0 | 0 | 0 | 112.3 | L150 R153 F154 Q157 L160 L168 V179 K180 I181 R187 | L150-F183 HydrophobicContact CD2-CD2 4.48Å; L150-F183 HydrophobicContact CD2-CE2 3.93Å; R153-F183 HydrophobicContact CB-CZ 4.38Å; R153-F183 HydrophobicContact CG-CZ 4.32Å; F154-F183 HydrophobicContact CB-CE1 4.2Å; F154-F183 HydrophobicContact CB-CZ 4.35Å; F154-F183 AromaticContact CD2-CD1 3.79Å; F154-F183 HydrophobicContact CD2-CD1 3.79Å; F154-F183 AromaticContact CD2-CE1 3.83Å; F154-F183 HydrophobicContact CD2-CE1 3.83Å; F154-F183 HydrophobicContact CE2-CD1 4.44Å; Q157-F183 WeakPolarHBondContact O-CE1 3.36Å; L160-F183 HydrophobicContact CD1-CD1 4.26Å; L160-F183 HydrophobicContact CD1-CD2 4.17Å; L160-F183 HydrophobicContact CD1-CE1 3.71Å; L160-F183 HydrophobicContact CD1-CE2 3.61Å; L160-F183 HydrophobicContact CD1-CG 4.48Å; L160-F183 HydrophobicContact CD1-CZ 3.36Å; L160-F183 HydrophobicContact CD2-CE1 4.27Å; L160-F183 HydrophobicContact CD2-CZ 4.43Å; L160-F183 HydrophobicContact CG-CD1 4.07Å; L160-F183 HydrophobicContact CG-CE1 3.6Å; L160-F183 HydrophobicContact CG-CE2 4.41Å; L160-F183 HydrophobicContact CG-CZ 3.81Å; L168-F183 HydrophobicContact CD2-CE2 3.95Å; L168-F183 HydrophobicContact CD2-CZ 4.27Å; V179-F183 HydrophobicContact CG1-CD2 3.81Å; V179-F183 HydrophobicContact CG1-CE2 3.9Å; V179-F183 VanDerWaalsContact O-CD2 3.31Å; V179-F183 WeakPolarHBondContact O-CD2 3.43Å; V179-F183 PolarHBondContact O-N 3.49Å; K180-F183 PolarHBondContact O-N 3.31Å; I181-F183 PolarHBondContact O-N 3.47Å; F183-R187 WeakPolarHBondContact O-CG 3.46Å; F183-R187 PolarHBondContact O-N 3.4Å; F183-R187 PolarHBondContact O-NE 2.62Å |
| 184 | Q | 98.5 | Very high | 96.5 | Very high | 67 Ų | 67 | 79.9 Ų | 79.9 | 31% | 0.313 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -65.3 | -51.3 | 174 | 178.9 | 169 | 25.9 | 0 | 0 | 111.3 | K180 I181 W182 R186 R187 Y188 | K180-Q184 WeakPolarHBondContact O-CB 3.32Å; K180-Q184 PolarHBondContact O-N 3.38Å; I181-Q184 WeakPolarHBondContact O-CB 3.46Å; I181-Q184 PolarHBondContact O-N 3.44Å; W182-Q184 VanDerWaalsContact C-N 3.29Å; W182-Q184 PolarHBondContact O-N 2.91Å; Q184-R186 VanDerWaalsContact C-N 3.27Å; Q184-R186 PolarHBondContact O-N 3.45Å; Q184-R187 PolarHBondContact O-N 3.09Å; Q184-Y188 HydrophobicContact CG-CD2 3.7Å; Q184-Y188 HydrophobicContact CG-CE2 3.24Å; Q184-Y188 PolarHBondContact NE2-OH 3.32Å; Q184-Y188 WeakPolarHBondContact O-CD2 3.46Å; Q184-Y188 PolarHBondContact O-N 3.2Å |
| 185 | N | 98.1 | Very high | 95.8 | Very high | 96 Ų | 96 | 84 Ų | 84 | 51% | 0.513 | 38% | 0.382 | S | S | . | . | H | α-helix | trans | -58.1 | -40.9 | 176.3 | -71.5 | -14.6 | 0 | 0 | 0 | 111.7 | I181 W182 Y188 K189 | I181-N185 WeakPolarHBondContact O-CB 3.23Å; I181-N185 VanDerWaalsContact O-CG 3.3Å; I181-N185 PolarHBondContact O-N 2.95Å; W182-N185 PolarHBondContact O-N 3.13Å; N185-Y188 PolarHBondContact O-N 3.08Å; N185-K189 PolarHBondContact O-N 3.4Å |
| 186 | R | 98.1 | Very high | 94.9 | Very high | 65 Ų | 65 | 83.9 Ų | 83.9 | 25% | 0.245 | 38% | 0.379 | C | S | . | . | H | α-helix | trans | -63.4 | -43.7 | 178.1 | -172.3 | 66.1 | -168.1 | -166.6 | -1.3 | 112.1 | E151 F154 W182 Q184 K189 C190 | E151-R186 IonicContact OE1-CZ 3.47Å; E151-R186 IonicContact OE1-NH1 2.77Å; E151-R186 PolarHBondContact OE1-NH1 2.86Å; E151-R186 IonicContact OE1-NH2 3.75Å; F154-R186 HydrophobicContact CD1-CG 3.76Å; F154-R186 HydrophobicContact CD2-CB 4.24Å; F154-R186 HydrophobicContact CD2-CG 3.77Å; F154-R186 HydrophobicContact CE1-CG 3.68Å; F154-R186 HydrophobicContact CE2-CB 4.06Å; F154-R186 HydrophobicContact CE2-CG 3.69Å; F154-R186 HydrophobicContact CG-CG 3.8Å; F154-R186 HydrophobicContact CZ-CB 4.36Å; F154-R186 HydrophobicContact CZ-CG 3.64Å; W182-R186 HydrophobicContact CE3-CB 4.14Å; W182-R186 HydrophobicContact CH2-CB 4.19Å; W182-R186 HydrophobicContact CH2-CG 3.94Å; W182-R186 HydrophobicContact CZ3-CB 3.87Å; W182-R186 HydrophobicContact CZ3-CG 3.95Å; W182-R186 WeakPolarHBondContact O-CB 3.39Å; W182-R186 PolarHBondContact O-N 3.34Å; Q184-R186 VanDerWaalsContact C-N 3.27Å; Q184-R186 PolarHBondContact O-N 3.45Å; R186-K189 PolarHBondContact O-N 3.41Å; R186-C190 PolarHBondContact O-N 2.89Å; R186-C190 VanDerWaalsContact O-N 3.13Å |
| 187 | R | 98 | Very high | 93.8 | Very high | 76 Ų | 76 | 86.6 Ų | 86.6 | 29% | 0.287 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -62.5 | -43.5 | 174.5 | -73.8 | -178.1 | -71.2 | 138 | -5.5 | 111.9 | F154 R158 Y159 F183 Q184 C190 K191 | F154-R187 HydrophobicContact CE2-CG 3.8Å; F154-R187 HydrophobicContact CZ-CG 4.11Å; R158-R187 WeakPolarHBondContact O-CD 3.46Å; Y159-R187 VanDerWaalsContact CE1-CD 3.46Å; F183-R187 WeakPolarHBondContact O-CG 3.46Å; F183-R187 PolarHBondContact O-N 3.4Å; F183-R187 PolarHBondContact O-NE 2.62Å; Q184-R187 PolarHBondContact O-N 3.09Å; R187-C190 PolarHBondContact O-N 3.1Å; R187-K191 PolarHBondContact O-N 3.01Å |
| 188 | Y | 97.8 | Very high | 92.5 | Very high | 123 Ų | 123 | 85.6 Ų | 85.6 | 48% | 0.482 | 38% | 0.384 | S | S | . | . | H | α-helix | trans | -61.9 | -43.2 | 176.4 | -74.6 | -60.3 | 0 | 0 | 0 | 112.4 | Q184 N185 C190 K191 R192 | Q184-Y188 HydrophobicContact CG-CD2 3.7Å; Q184-Y188 HydrophobicContact CG-CE2 3.24Å; Q184-Y188 PolarHBondContact NE2-OH 3.32Å; Q184-Y188 WeakPolarHBondContact O-CD2 3.46Å; Q184-Y188 PolarHBondContact O-N 3.2Å; N185-Y188 PolarHBondContact O-N 3.08Å; Y188-C190 PolarHBondContact O-N 3.14Å; Y188-K191 PolarHBondContact O-N 3.3Å; Y188-R192 WeakPolarHBondContact O-CB 3.5Å; Y188-R192 PolarHBondContact O-N 3.46Å |
| 189 | K | 96.1 | Very high | 90.8 | Very high | 135 Ų | 135 | 87.6 Ų | 87.6 | 59% | 0.587 | 40% | 0.397 | S | S | * | . | H | α-helix | trans | -59.5 | -46.5 | 177.1 | -171.5 | 178.6 | 178.4 | -177.9 | 0 | 111.8 | N185 R186 K191 R192 Q193 | N185-K189 PolarHBondContact O-N 3.4Å; R186-K189 PolarHBondContact O-N 3.41Å; K189-K191 VanDerWaalsContact C-N 3.34Å; K189-K191 PolarHBondContact O-N 3.45Å; K189-R192 PolarHBondContact O-N 3.3Å; K189-Q193 WeakPolarHBondContact O-CB 3.37Å; K189-Q193 PolarHBondContact O-N 3.49Å |
| 190 | C | 93.6 | Very high | 88.9 | Confident | 23 Ų | 23 | 95.5 Ų | 95.5 | 16% | 0.155 | 43% | 0.433 | C | S | . | . | H | α-helix | trans | -62.2 | -39.7 | 175.8 | -77.6 | 0 | 0 | 0 | 0 | 112.9 | R186 R187 Y188 R194 | R186-C190 PolarHBondContact O-N 2.89Å; R186-C190 VanDerWaalsContact O-N 3.13Å; R187-C190 PolarHBondContact O-N 3.1Å; Y188-C190 PolarHBondContact O-N 3.14Å; C190-R194 PolarHBondContact O-N 3.12Å |
| 191 | K | 94.6 | Very high | 87 | Confident | 114 Ų | 114 | 98.6 Ų | 98.6 | 50% | 0.496 | 45% | 0.452 | S | S | . | . | H | α-helix | trans | -63.9 | -45.9 | 177.4 | -174.2 | -179.5 | 68.7 | 169.1 | 0 | 110.7 | R187 Y188 K189 R194 Q195 | R187-K191 PolarHBondContact O-N 3.01Å; Y188-K191 PolarHBondContact O-N 3.3Å; K189-K191 VanDerWaalsContact C-N 3.34Å; K189-K191 PolarHBondContact O-N 3.45Å; K191-R194 PolarHBondContact O-N 3.25Å; K191-Q195 PolarHBondContact O-N 2.98Å |
| 192 | R | 93.6 | Very high | 85.1 | Confident | 166 Ų | 166 | 98.7 Ų | 98.7 | 63% | 0.626 | 46% | 0.456 | S | S | * | . | H | α-helix | trans | -65.2 | -42.7 | -178.4 | -170.8 | 148.6 | -172.9 | -133.8 | -0.2 | 112.2 | Y188 K189 R194 Q195 D196 | Y188-R192 WeakPolarHBondContact O-CB 3.5Å; Y188-R192 PolarHBondContact O-N 3.46Å; K189-R192 PolarHBondContact O-N 3.3Å; R192-R194 PolarHBondContact O-N 3.06Å; R192-Q195 PolarHBondContact O-N 3.02Å; R192-D196 WeakPolarHBondContact CG-OD2 3.43Å; R192-D196 PolarHBondContact O-N 2.97Å |
| 193 | Q | 90.7 | Very high | 83 | Confident | 107 Ų | 107 | 102.5 Ų | 102.5 | 50% | 0.5 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -57.4 | -35.5 | 176.4 | -172.6 | 175.8 | 7.1 | 0 | 0 | 113.1 | K189 Q197 | K189-Q193 WeakPolarHBondContact O-CB 3.37Å; K189-Q193 PolarHBondContact O-N 3.49Å; Q193-Q197 WeakPolarHBondContact O-CB 3.41Å; Q193-Q197 VanDerWaalsContact O-CG 3.23Å; Q193-Q197 WeakPolarHBondContact O-CG 3.36Å; Q193-Q197 PolarHBondContact O-N 3.33Å; Q193-Q197 VanDerWaalsContact O-N 3.08Å |
| 194 | R | 83.1 | Confident | 81.2 | Confident | 186 Ų | 186 | 108 Ų | 108 | 70% | 0.702 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -71.3 | -35.1 | 176.3 | -69.6 | -178.1 | 177.7 | -144.7 | -2.6 | 113 | C190 K191 R192 S198 | C190-R194 PolarHBondContact O-N 3.12Å; K191-R194 PolarHBondContact O-N 3.25Å; R192-R194 PolarHBondContact O-N 3.06Å; R194-S198 PolarHBondContact O-N 3.2Å |
| 195 | Q | 83.1 | Confident | 79.5 | Confident | 107 Ų | 107 | 109.1 Ų | 109.1 | 50% | 0.5 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -73.2 | -43.5 | 177.5 | -68.8 | 179.7 | -8.2 | 0 | 0 | 110.9 | K191 R192 Q197 S198 L199 | K191-Q195 PolarHBondContact O-N 2.98Å; R192-Q195 PolarHBondContact O-N 3.02Å; Q195-Q197 VanDerWaalsContact C-N 3.33Å; Q195-Q197 PolarHBondContact O-N 3.42Å; Q195-S198 PolarHBondContact O-N 3.26Å; Q195-S198 VanDerWaalsContact O-N 3.11Å; Q195-S198 PolarHBondContact O-OG 3.35Å; Q195-L199 PolarHBondContact O-N 3.49Å; Q195-L199 VanDerWaalsContact O-N 3.11Å |
| 196 | D | 80.3 | Confident | 77.9 | Confident | 68 Ų | 68 | 109.7 Ų | 109.7 | 36% | 0.364 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -64 | -40.1 | 177.9 | -62.1 | -18.6 | 0 | 0 | 0 | 110.7 | R192 S198 L199 E200 | R192-D196 WeakPolarHBondContact CG-OD2 3.43Å; R192-D196 PolarHBondContact O-N 2.97Å; D196-S198 VanDerWaalsContact C-N 3.3Å; D196-S198 PolarHBondContact O-N 3.11Å; D196-L199 PolarHBondContact O-N 3.2Å; D196-L199 VanDerWaalsContact O-N 3.09Å; D196-E200 PolarHBondContact O-N 3.19Å |
| 197 | Q | 75.7 | Confident | 76.3 | Confident | 103 Ų | 103 | 112.6 Ų | 112.6 | 48% | 0.481 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -60.3 | -36.6 | 172.4 | -79.2 | 176.3 | -3.1 | 0 | 0 | 113.2 | Q193 Q195 L199 E200 M201 | Q193-Q197 WeakPolarHBondContact O-CB 3.41Å; Q193-Q197 VanDerWaalsContact O-CG 3.23Å; Q193-Q197 WeakPolarHBondContact O-CG 3.36Å; Q193-Q197 PolarHBondContact O-N 3.33Å; Q193-Q197 VanDerWaalsContact O-N 3.08Å; Q195-Q197 VanDerWaalsContact C-N 3.33Å; Q195-Q197 PolarHBondContact O-N 3.42Å; Q197-L199 VanDerWaalsContact C-N 3.3Å; Q197-L199 PolarHBondContact O-N 3.33Å; Q197-E200 PolarHBondContact O-N 3.03Å; Q197-M201 PolarHBondContact O-N 3.3Å |
| 198 | S | 70.2 | Confident | 74.6 | Confident | 67 Ų | 67 | 119.2 Ų | 119.2 | 47% | 0.469 | 59% | 0.591 | S | S | . | * | H | α-helix | trans | -69.2 | -29.7 | 175.8 | 70.4 | 0 | 0 | 0 | 0 | 112.9 | R194 Q195 D196 V202 | R194-S198 PolarHBondContact O-N 3.2Å; Q195-S198 PolarHBondContact O-N 3.26Å; Q195-S198 VanDerWaalsContact O-N 3.11Å; Q195-S198 PolarHBondContact O-OG 3.35Å; D196-S198 VanDerWaalsContact C-N 3.3Å; D196-S198 PolarHBondContact O-N 3.11Å; S198-V202 PolarHBondContact O-N 3.27Å |
| 199 | L | 61.8 | Low | 72.8 | Confident | 110 Ų | 110 | 125.1 Ų | 125.1 | 58% | 0.576 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -79.5 | -26.5 | 176.5 | -69.7 | 174.7 | 0 | 0 | 0 | 112.8 | Q195 D196 Q197 | Q195-L199 PolarHBondContact O-N 3.49Å; Q195-L199 VanDerWaalsContact O-N 3.11Å; D196-L199 PolarHBondContact O-N 3.2Å; D196-L199 VanDerWaalsContact O-N 3.09Å; Q197-L199 VanDerWaalsContact C-N 3.3Å; Q197-L199 PolarHBondContact O-N 3.33Å |
| 200 | E | 60 | Low | 71.3 | Confident | 165 Ų | 165 | 124.5 Ų | 124.5 | 77% | 0.771 | 62% | 0.619 | S | S | * | * | H | α-helix | trans | -76.6 | -29 | 173.4 | -72.3 | -172.8 | 167.9 | 0 | 0 | 112.6 | D196 Q197 | D196-E200 PolarHBondContact O-N 3.19Å; Q197-E200 PolarHBondContact O-N 3.03Å |
| 201 | M | 58.3 | Low | 69.5 | Low | 172 Ų | 172 | 128.3 Ų | 128.3 | 85% | 0.847 | 65% | 0.646 | S | S | * | * | H | α-helix | trans | -77 | -24.3 | 175.7 | -72.4 | -170.9 | 71.8 | 0 | 0 | 113.5 | Q197 S203 | Q197-M201 PolarHBondContact O-N 3.3Å; M201-S203 PolarHBondContact O-N 3.45Å |
| 202 | V | 58.3 | Low | 68.1 | Low | 83 Ų | 83 | 128.7 Ų | 128.7 | 50% | 0.503 | 66% | 0.658 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -87.7 | 99.8 | 163.9 | -179.1 | 0 | 0 | 0 | 0 | 105.9 | S198 L204 | S198-V202 PolarHBondContact O-N 3.27Å; V202-L204 HydrophobicContact CG1-CD1 4.37Å; V202-L204 HydrophobicContact CG1-CD2 4.16Å; V202-L204 HydrophobicContact CG1-CG 3.81Å; V202-L204 PolarHBondContact O-N 3.42Å |
| 203 | S | 54.2 | Low | 66.5 | Low | 112 Ų | 112 | 125.5 Ų | 125.5 | 78% | 0.783 | 66% | 0.659 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -59.3 | 60.4 | 177.6 | 174.5 | 0 | 0 | 0 | 0 | 113.3 | M201 P205 | M201-S203 PolarHBondContact O-N 3.45Å; S203-P205 WeakPolarHBondContact O-CD 3.33Å |
| 204 | L | 61.3 | Low | 65.2 | Low | 123 Ų | 123 | 126.1 Ų | 126.1 | 64% | 0.644 | 67% | 0.67 | S | S | * | * | P | Polyproline II helix | trans | -74.1 | 118.8 | 166.1 | -64.7 | 179.5 | 0 | 0 | 0 | 106 | V202 | V202-L204 HydrophobicContact CG1-CD1 4.37Å; V202-L204 HydrophobicContact CG1-CD2 4.16Å; V202-L204 HydrophobicContact CG1-CG 3.81Å; V202-L204 PolarHBondContact O-N 3.42Å |
| 205 | P | 62.6 | Low | 64.2 | Low | 90 Ų | 90 | 125.3 Ų | 125.3 | 58% | 0.584 | 68% | 0.678 | S | S | * | * | P | Polyproline II helix | trans | -55.7 | 142 | 177.3 | 23.3 | -32 | 0 | 0 | 0 | 108.7 | S203 | S203-P205 WeakPolarHBondContact O-CD 3.33Š|
| 206 | P | 65.1 | Low | 63 | Low | 109 Ų | 109 | 124 Ų | 124 | 71% | 0.708 | 68% | 0.678 | S | S | * | * | P | Polyproline II helix | trans | -46.4 | 134.2 | 174.5 | -24.8 | 31.2 | 0 | 0 | 0 | 108.8 | R208 | P206-R208 VanDerWaalsContact C-N 3.34Å; P206-R208 PolarHBondContact O-N 3.42Å |
| 207 | P | 63.8 | Low | 61.6 | Low | 125 Ų | 125 | 131.6 Ų | 131.6 | 81% | 0.812 | 70% | 0.701 | S | S | * | * | trans | -55.4 | 106 | 178.2 | 21.5 | -30.8 | 0 | 0 | 0 | 106.9 | R209 | P207-R209 PolarHBondContact O-N 3.45Š| ||
| 208 | R | 63.1 | Low | 60.3 | Low | 215 Ų | 215 | 134.3 Ų | 134.3 | 81% | 0.811 | 72% | 0.719 | S | S | * | * | trans | -55.9 | 120.5 | 179.6 | -61.6 | -174.7 | -162.3 | 168.8 | 5.2 | 104.5 | P206 V210 | P206-R208 VanDerWaalsContact C-N 3.34Å; P206-R208 PolarHBondContact O-N 3.42Å; R208-V210 VanDerWaalsContact C-N 3.25Å; R208-V210 PolarHBondContact O-N 2.88Å | ||
| 209 | R | 60.2 | Low | 59.6 | Low | 248 Ų | 248 | 133.3 Ų | 133.3 | 94% | 0.936 | 72% | 0.719 | S | S | * | * | trans | -58.2 | 97.5 | 173.8 | -76.4 | -179.5 | 145.9 | -176.9 | -6.3 | 106.5 | P207 S211 | P207-R209 PolarHBondContact O-N 3.45Å; R209-S211 PolarHBondContact O-N 2.88Å | ||
| 210 | V | 64.4 | Low | 58.9 | Low | 121 Ų | 121 | 136.3 Ų | 136.3 | 73% | 0.733 | 73% | 0.727 | S | S | * | * | trans | -63.6 | 112.1 | 169.6 | 179.1 | 0 | 0 | 0 | 0 | 104.5 | R208 V212 | R208-V210 VanDerWaalsContact C-N 3.25Å; R208-V210 PolarHBondContact O-N 2.88Å; V210-V212 PolarHBondContact O-N 3.11Å | ||
| 211 | S | 55.3 | Low | 58.4 | Low | 104 Ų | 104 | 134.6 Ų | 134.6 | 73% | 0.727 | 73% | 0.73 | S | S | * | * | trans | -57.8 | 109.9 | 168.6 | 51.2 | 0 | 0 | 0 | 0 | 106.4 | R209 P213 | R209-S211 PolarHBondContact O-N 2.88Å; S211-P213 WeakPolarHBondContact O-CD 3.13Å; S211-P213 VanDerWaalsContact O-N 3.1Å | ||
| 212 | V | 64.3 | Low | 57.9 | Low | 122 Ų | 122 | 130.3 Ų | 130.3 | 74% | 0.739 | 72% | 0.717 | S | S | * | * | trans | -61.9 | 112.6 | 171.3 | 177.2 | 0 | 0 | 0 | 0 | 105.6 | V210 V214 | V210-V212 PolarHBondContact O-N 3.11Å; V212-V214 PolarHBondContact O-N 2.63Å | ||
| 213 | P | 60.6 | Low | 57.5 | Low | 99 Ų | 99 | 135.3 Ų | 135.3 | 64% | 0.643 | 74% | 0.74 | S | S | * | * | trans | -62.4 | 117.8 | 172.3 | 25.8 | -29.8 | 0 | 0 | 0 | 106.1 | S211 L215 | S211-P213 WeakPolarHBondContact O-CD 3.13Å; S211-P213 VanDerWaalsContact O-N 3.1Å; P213-L215 PolarHBondContact O-N 3.32Å | ||
| 214 | V | 63.3 | Low | 57.1 | Low | 120 Ų | 120 | 134.3 Ų | 134.3 | 73% | 0.727 | 74% | 0.738 | S | S | * | * | trans | -58.5 | 105.5 | 169.5 | -179.7 | 0 | 0 | 0 | 0 | 105.1 | V212 V216 | V212-V214 PolarHBondContact O-N 2.63Å; V214-V216 HydrophobicContact CB-CG2 4.21Å; V214-V216 HydrophobicContact CG1-CG2 3.6Å; V214-V216 PolarHBondContact O-N 2.93Å | ||
| 215 | L | 61.9 | Low | 56.2 | Low | 168 Ų | 168 | 132.1 Ų | 132.1 | 88% | 0.88 | 75% | 0.745 | S | S | * | * | trans | -68.8 | 80.9 | 167.9 | -77.1 | 168.7 | 0 | 0 | 0 | 106.5 | P213 R217 | P213-L215 PolarHBondContact O-N 3.32Å; L215-R217 PolarHBondContact O-N 3.22Å; L215-R217 VanDerWaalsContact O-N 3.08Å | ||
| 216 | V | 57.8 | Low | 55.3 | Low | 81 Ų | 81 | 137.3 Ų | 137.3 | 49% | 0.491 | 76% | 0.762 | S | S | . | * | trans | -65.6 | 102.7 | 166.9 | 178.6 | 0 | 0 | 0 | 0 | 106.1 | V214 | V214-V216 HydrophobicContact CB-CG2 4.21Å; V214-V216 HydrophobicContact CG1-CG2 3.6Å; V214-V216 PolarHBondContact O-N 2.93Å | ||
| 217 | R | 51.9 | Low | 54.2 | Low | 227 Ų | 227 | 136.5 Ų | 136.5 | 86% | 0.857 | 76% | 0.764 | S | S | * | * | S | Bend | trans | -85.6 | 115.2 | 156.5 | -162.2 | 157.8 | 178.8 | 130.1 | -3.2 | 105.5 | L215 | L215-R217 PolarHBondContact O-N 3.22Å; L215-R217 VanDerWaalsContact O-N 3.08Å |
| 218 | D | 47.8 | Very low | 53.2 | Low | 159 Ų | 159 | 135 Ų | 135 | 85% | 0.85 | 76% | 0.762 | S | S | * | * | S | Bend | trans | 76.9 | 51.6 | 175.7 | -47.4 | -35.2 | 0 | 0 | 0 | 117.9 | ||
| 219 | G | 55.2 | Low | 52.4 | Low | 46 Ų | 46 | 129.7 Ų | 129.7 | 47% | 0.474 | 77% | 0.765 | S | S | . | * | trans | -156.3 | 47.8 | 170.1 | 0 | 0 | 0 | 0 | 0 | 113.6 | P221 | G219-P221 WeakPolarHBondContact O-CD 3.3Š| ||
| 220 | K | 47.5 | Very low | 51.3 | Low | 173 Ų | 173 | 128.2 Ų | 128.2 | 75% | 0.752 | 76% | 0.761 | S | S | * | * | trans | -83.1 | 128.5 | 177.7 | -64.1 | -142.8 | -164.2 | 176.8 | 0 | 112.4 | C222 | K220-C222 HydrophobicContact CB-CB 4.12Å; K220-C222 HydrophobicContact CD-CB 3.9Å; K220-C222 WeakPolarHBondContact CD-SG 3.2Å | ||
| 221 | P | 48.7 | Very low | 50.7 | Low | 129 Ų | 129 | 128.3 Ų | 128.3 | 84% | 0.838 | 76% | 0.757 | S | S | * | * | trans | -78.4 | 97.9 | 135.1 | 30.4 | -21.6 | 0 | 0 | 0 | 107.9 | G219 | G219-P221 WeakPolarHBondContact O-CD 3.3Š| ||
| 222 | C | 47.9 | Very low | 50.3 | Low | 83 Ų | 83 | 127.7 Ų | 127.7 | 56% | 0.561 | 75% | 0.75 | S | S | * | * | trans | -140.5 | 93.5 | 164.4 | -72.4 | 0 | 0 | 0 | 0 | 108.1 | K220 A224 | K220-C222 HydrophobicContact CB-CB 4.12Å; K220-C222 HydrophobicContact CD-CB 3.9Å; K220-C222 WeakPolarHBondContact CD-SG 3.2Å; C222-A224 PolarHBondContact O-N 2.76Å | ||
| 223 | L | 51.1 | Low | 49.4 | Very low | 187 Ų | 187 | 126.5 Ų | 126.5 | 98% | 0.979 | 75% | 0.747 | S | S | * | * | trans | -80.9 | 96.7 | 155.9 | -66.7 | 174.1 | 0 | 0 | 0 | 106.8 | ||||
| 224 | A | 45.3 | Very low | 48.4 | Very low | 91 Ų | 91 | 131.7 Ų | 131.7 | 75% | 0.752 | 76% | 0.756 | S | S | * | * | trans | -148.8 | 114.2 | 161.1 | 0 | 0 | 0 | 0 | 0 | 106.5 | C222 | C222-A224 PolarHBondContact O-N 2.76Š| ||
| 225 | G | 41.9 | Very low | 47.6 | Very low | 77 Ų | 77 | 132 Ų | 132 | 79% | 0.794 | 76% | 0.764 | S | S | * | * | trans | -68.6 | 173.8 | -167.8 | 0 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 226 | E | 44.1 | Very low | 46.7 | Very low | 200 Ų | 200 | 130.5 Ų | 130.5 | 94% | 0.935 | 76% | 0.761 | S | S | * | * | trans | -33 | 134.6 | 176.8 | -61.7 | 178.2 | 130.3 | 0 | 0 | 115.4 | ||||
| 227 | A | 41 | Very low | 46.2 | Very low | 92 Ų | 92 | 128.9 Ų | 128.9 | 76% | 0.76 | 76% | 0.76 | S | S | * | * | -180 | 128.2 | 118.7 | 0 | 0 | 0 | 0 | 0 | 111.2 | |||||
| 228 | A | 42.9 | Very low | 46.1 | Very low | 92 Ų | 92 | 123.6 Ų | 123.6 | 76% | 0.76 | 76% | 0.755 | S | S | * | * | trans | 55.2 | 118.6 | 140.1 | 0 | 0 | 0 | 0 | 0 | 120.9 | Y230 | A228-Y230 PolarHBondContact O-N 2.65Š| ||
| 229 | A | 48.2 | Very low | 46 | Very low | 105 Ų | 105 | 122.5 Ų | 122.5 | 87% | 0.868 | 75% | 0.748 | S | S | * | * | trans | 9.4 | 99.6 | 131.6 | 0 | 0 | 0 | 0 | 0 | 116.7 | ||||
| 230 | Y | 37 | Very low | 45.4 | Very low | 217 Ų | 217 | 126.9 Ų | 126.9 | 85% | 0.851 | 76% | 0.761 | S | S | * | * | trans | -150.9 | 119.8 | 152.3 | -160.5 | -103.6 | 0 | 0 | 0 | 110.1 | A228 | A228-Y230 PolarHBondContact O-N 2.65Š| ||
| 231 | N | 50.6 | Low | 45.2 | Very low | 122 Ų | 122 | 125.7 Ų | 125.7 | 65% | 0.652 | 76% | 0.757 | S | S | * | * | trans | -71.3 | 134.7 | 170.5 | 179.2 | 4.6 | 0 | 0 | 0 | 109.5 | S233 | N231-S233 PolarHBondContact OD1-N 2.81Š| ||
| 232 | P | 48 | Very low | 44.8 | Very low | 91 Ų | 91 | 129.4 Ų | 129.4 | 59% | 0.591 | 76% | 0.761 | S | S | * | * | trans | -120.7 | 111.4 | 151.1 | 32.5 | -18.2 | 0 | 0 | 0 | 110.9 | Y234 | P232-Y234 HydrophobicContact CB-CD2 4.13Å; P232-Y234 HydrophobicContact CB-CE2 4.17Å; P232-Y234 PolarHBondContact O-N 3.16Å | ||
| 233 | S | 44.8 | Very low | 44.5 | Very low | 97 Ų | 97 | 129.5 Ų | 129.5 | 68% | 0.678 | 77% | 0.767 | S | S | * | * | trans | -57 | 107 | 160.7 | -40.8 | 0 | 0 | 0 | 0 | 110.2 | N231 | N231-S233 PolarHBondContact OD1-N 2.81Š| ||
| 234 | Y | 39.9 | Very low | 44 | Very low | 208 Ų | 208 | 131.1 Ų | 131.1 | 82% | 0.816 | 76% | 0.762 | S | S | * | * | trans | -137.2 | 120.3 | 159.2 | -76.5 | -80.7 | 0 | 0 | 0 | 110.2 | P232 V236 | P232-Y234 HydrophobicContact CB-CD2 4.13Å; P232-Y234 HydrophobicContact CB-CE2 4.17Å; P232-Y234 PolarHBondContact O-N 3.16Å; Y234-V236 PolarHBondContact O-N 3.49Å | ||
| 235 | S | 46.6 | Very low | 44.3 | Very low | 128 Ų | 128 | 133.7 Ų | 133.7 | 90% | 0.895 | 76% | 0.763 | S | S | * | * | trans | -46.1 | 113.1 | 177.3 | -70.7 | 0 | 0 | 0 | 0 | 112.9 | G237 | S235-G237 PolarHBondContact O-N 2.99Š| ||
| 236 | V | 42.8 | Very low | 44 | Very low | 136 Ų | 136 | 137.2 Ų | 137.2 | 82% | 0.824 | 76% | 0.764 | S | S | * | * | trans | -83.5 | 94.2 | 158.6 | -178.2 | 0 | 0 | 0 | 0 | 106.8 | Y234 | Y234-V236 PolarHBondContact O-N 3.49Š| ||
| 237 | G | 46.4 | Very low | 44 | Very low | 46 Ų | 46 | 137.6 Ų | 137.6 | 47% | 0.474 | 76% | 0.758 | S | S | . | * | trans | -64.5 | 149.1 | 165.6 | 0 | 0 | 0 | 0 | 0 | 110.3 | S235 I239 | S235-G237 PolarHBondContact O-N 2.99Å; G237-I239 PolarHBondContact O-N 3.09Å | ||
| 238 | P | 51.2 | Low | 44.7 | Very low | 117 Ų | 117 | 138 Ų | 138 | 76% | 0.76 | 75% | 0.753 | S | S | * | * | trans | -69.2 | 111.9 | -172.1 | 26.9 | -31.6 | 0 | 0 | 0 | 110.5 | N240 | P238-N240 PolarHBondContact O-N 3.06Š| ||
| 239 | I | 44.3 | Very low | 44.7 | Very low | 135 Ų | 135 | 138.1 Ų | 138.1 | 69% | 0.692 | 75% | 0.754 | S | S | * | * | trans | -67.7 | 97.9 | 164.3 | -73.5 | 167.7 | 0 | 0 | 0 | 106.9 | G237 H241 | G237-I239 PolarHBondContact O-N 3.09Å; I239-H241 PolarHBondContact O-N 3.2Å; I239-H241 VanDerWaalsContact O-N 3.09Å | ||
| 240 | N | 42.3 | Very low | 44.3 | Very low | 139 Ų | 139 | 142.6 Ų | 142.6 | 74% | 0.743 | 75% | 0.754 | S | S | * | * | trans | -67.4 | 98.6 | 163.5 | -78 | -45.1 | 0 | 0 | 0 | 108.3 | P238 | P238-N240 PolarHBondContact O-N 3.06Š| ||
| 241 | H | 43.5 | Very low | 44.8 | Very low | 147 Ų | 147 | 137.3 Ų | 137.3 | 68% | 0.681 | 75% | 0.749 | S | S | * | * | S | Bend | trans | -69.5 | 130.8 | 157.7 | -78.4 | -15 | 0 | 0 | 0 | 108.1 | I239 | I239-H241 PolarHBondContact O-N 3.2Å; I239-H241 VanDerWaalsContact O-N 3.09Å |
| 242 | F | 41.3 | Very low | 44.6 | Very low | 208 Ų | 208 | 138.6 Ų | 138.6 | 91% | 0.912 | 76% | 0.756 | S | S | * | * | trans | 87.5 | 63.2 | 179.7 | -39.7 | -66.2 | 0 | 0 | 0 | 117.6 | ||||
| 243 | A | 41.9 | Very low | 44.1 | Very low | 84 Ų | 84 | 145.1 Ų | 145.1 | 69% | 0.694 | 77% | 0.77 | S | S | * | * | trans | -110.9 | 93.7 | 153.4 | 0 | 0 | 0 | 0 | 0 | 109.6 | N245 | A243-N245 VanDerWaalsContact C-N 3.34Å; A243-N245 PolarHBondContact O-N 3.32Å | ||
| 244 | Y | 40.1 | Very low | 44.3 | Very low | 222 Ų | 222 | 147.8 Ų | 147.8 | 87% | 0.871 | 78% | 0.783 | S | S | * | * | trans | -85.2 | 79.2 | 171.4 | -156.7 | -89.5 | 0 | 0 | 0 | 107.8 | ||||
| 245 | N | 50.6 | Low | 44.3 | Very low | 144 Ų | 144 | 140.6 Ų | 140.6 | 77% | 0.77 | 77% | 0.772 | S | S | * | * | trans | 160.4 | 90.4 | 159.7 | -92.6 | -58.2 | 0 | 0 | 0 | 108.5 | A243 | A243-N245 VanDerWaalsContact C-N 3.34Å; A243-N245 PolarHBondContact O-N 3.32Å | ||
| 246 | N | 37.5 | Very low | 44.6 | Very low | 152 Ų | 152 | 141.5 Ų | 141.5 | 81% | 0.813 | 77% | 0.774 | S | S | * | * | trans | -146.8 | 94.1 | 162.3 | -152.6 | -0.1 | 0 | 0 | 0 | 108.6 | ||||
| 247 | Y | 42.5 | Very low | 44.7 | Very low | 207 Ų | 207 | 138 Ų | 138 | 81% | 0.812 | 77% | 0.766 | S | S | * | * | trans | -82.2 | 134.3 | 164.4 | -92.9 | -90.8 | 0 | 0 | 0 | 107.8 | A249 | Y247-A249 PolarHBondContact O-N 3.17Š| ||
| 248 | P | 56.1 | Low | 44.4 | Very low | 100 Ų | 100 | 141.5 Ų | 141.5 | 65% | 0.649 | 78% | 0.782 | S | S | * | * | trans | -65.9 | 123.4 | 173.2 | 26.3 | -30.5 | 0 | 0 | 0 | 109.4 | F250 | P248-F250 PolarHBondContact O-N 3.4Š| ||
| 249 | A | 42.8 | Very low | 43.8 | Very low | 95 Ų | 95 | 142.3 Ų | 142.3 | 79% | 0.785 | 78% | 0.78 | S | S | * | * | trans | -68.5 | 111.3 | 171.9 | 0 | 0 | 0 | 0 | 0 | 109.2 | Y247 S251 | Y247-A249 PolarHBondContact O-N 3.17Å; A249-S251 VanDerWaalsContact C-N 3.32Å; A249-S251 PolarHBondContact O-N 3.29Å | ||
| 250 | F | 40.2 | Very low | 43.7 | Very low | 199 Ų | 199 | 141.3 Ų | 141.3 | 87% | 0.873 | 78% | 0.78 | S | S | * | * | trans | -73.3 | 90.9 | 164 | -75.9 | -81.9 | 0 | 0 | 0 | 108.5 | P248 N252 | P248-F250 PolarHBondContact O-N 3.4Å; F250-N252 PolarHBondContact O-N 2.9Å; F250-N252 VanDerWaalsContact O-N 3.11Å | ||
| 251 | S | 47.3 | Very low | 43.7 | Very low | 107 Ų | 107 | 141 Ų | 141 | 75% | 0.748 | 78% | 0.778 | S | S | * | * | trans | -68.8 | 97.2 | 158.9 | -90.1 | 0 | 0 | 0 | 0 | 108 | A249 | A249-S251 VanDerWaalsContact C-N 3.32Å; A249-S251 PolarHBondContact O-N 3.29Å | ||
| 252 | N | 45.7 | Very low | 43.4 | Very low | 148 Ų | 148 | 144.5 Ų | 144.5 | 79% | 0.791 | 79% | 0.787 | S | S | * | * | trans | 166 | 82.4 | 146.1 | -88.2 | -44.8 | 0 | 0 | 0 | 109.8 | F250 | F250-N252 PolarHBondContact O-N 2.9Å; F250-N252 VanDerWaalsContact O-N 3.11Å | ||
| 253 | Y | 38.8 | Very low | 43.3 | Very low | 228 Ų | 228 | 138.3 Ų | 138.3 | 89% | 0.894 | 77% | 0.774 | S | S | * | * | trans | -158.1 | 98.7 | 148.3 | -104.2 | -78.2 | 0 | 0 | 0 | 107.7 | G255 | Y253-G255 PolarHBondContact O-N 3.21Š| ||
| 254 | T | 48.2 | Very low | 43.1 | Very low | 154 Ų | 154 | 139.9 Ų | 139.9 | 95% | 0.945 | 78% | 0.779 | S | S | * | * | trans | -74.7 | 98.5 | 160.7 | 18.9 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 255 | G | 41 | Very low | 43 | Very low | 56 Ų | 56 | 134.4 Ų | 134.4 | 58% | 0.577 | 77% | 0.773 | S | S | * | * | trans | -149.8 | 128.7 | 172.5 | 0 | 0 | 0 | 0 | 0 | 109.7 | Y253 G257 | Y253-G255 PolarHBondContact O-N 3.21Å; G255-G257 PolarHBondContact O-N 3.08Å | ||
| 256 | P | 51.3 | Low | 42.5 | Very low | 147 Ų | 147 | 137.7 Ų | 137.7 | 96% | 0.955 | 78% | 0.776 | S | S | * | * | trans | -82.2 | 115 | -173.6 | 31.3 | -29.8 | 0 | 0 | 0 | 110 | ||||
| 257 | G | 45.7 | Very low | 43.2 | Very low | 62 Ų | 62 | 136.3 Ų | 136.3 | 64% | 0.639 | 78% | 0.775 | S | S | * | * | trans | -180 | 118.7 | 173.9 | 0 | 0 | 0 | 0 | 0 | 112.7 | G255 | G255-G257 PolarHBondContact O-N 3.08Š| ||
| 258 | C | 39.6 | Very low | 43.2 | Very low | 121 Ų | 121 | 131 Ų | 131 | 82% | 0.818 | 78% | 0.775 | S | S | * | * | trans | 55.8 | 90.2 | 170.1 | 62.5 | 0 | 0 | 0 | 0 | 118.2 | T260 | C258-T260 PolarHBondContact O-N 3.03Š| ||
| 259 | N | 39.5 | Very low | 42.5 | Very low | 134 Ų | 134 | 129.7 Ų | 129.7 | 72% | 0.717 | 78% | 0.779 | S | S | * | * | trans | -58.9 | 121.7 | 157.9 | -175.8 | -30.9 | 0 | 0 | 0 | 110.1 | N261 | N259-N261 WeakPolarHBondContact OD1-CB 3.49Å; N259-N261 PolarHBondContact OD1-N 3.22Å; N259-N261 PolarHBondContact OD1-ND2 3.11Å | ||
| 260 | T | 41.1 | Very low | 42.5 | Very low | 113 Ų | 113 | 129.5 Ų | 129.5 | 69% | 0.693 | 78% | 0.778 | S | S | * | * | trans | -114 | 81.7 | 170.6 | -36.6 | 0 | 0 | 0 | 0 | 108.6 | C258 Y262 | C258-T260 PolarHBondContact O-N 3.03Å; T260-Y262 HydrophobicContact CG2-CD2 4.44Å | ||
| 261 | N | 43.9 | Very low | 42.5 | Very low | 132 Ų | 132 | 128.9 Ų | 128.9 | 71% | 0.706 | 78% | 0.779 | S | S | * | * | trans | -109.6 | 96.9 | 167.8 | -86.1 | -69.7 | 0 | 0 | 0 | 108.8 | N259 A263 | N259-N261 WeakPolarHBondContact OD1-CB 3.49Å; N259-N261 PolarHBondContact OD1-N 3.22Å; N259-N261 PolarHBondContact OD1-ND2 3.11Å; N261-A263 PolarHBondContact O-N 3.27Å | ||
| 262 | Y | 36.7 | Very low | 42.1 | Very low | 222 Ų | 222 | 132.7 Ų | 132.7 | 87% | 0.871 | 79% | 0.785 | S | S | * | * | trans | -87.5 | 84.3 | 156.3 | -81.1 | -83 | 0 | 0 | 0 | 107.7 | T260 | T260-Y262 HydrophobicContact CG2-CD2 4.44Š| ||
| 263 | A | 38.4 | Very low | 41.7 | Very low | 77 Ų | 77 | 132.1 Ų | 132.1 | 64% | 0.636 | 79% | 0.788 | S | S | * | * | trans | -89.6 | 113.7 | 162.1 | 0 | 0 | 0 | 0 | 0 | 107.5 | N261 S265 | N261-A263 PolarHBondContact O-N 3.27Å; A263-S265 PolarHBondContact O-N 3.04Å; A263-S265 VanDerWaalsContact O-N 3.1Å | ||
| 264 | C | 37.3 | Very low | 41.7 | Very low | 118 Ų | 118 | 127.7 Ų | 127.7 | 80% | 0.797 | 78% | 0.784 | S | S | * | * | trans | -76.2 | 91.3 | 171.9 | -64.2 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 265 | S | 38.3 | Very low | 41 | Very low | 107 Ų | 107 | 129.5 Ų | 129.5 | 75% | 0.748 | 78% | 0.782 | S | S | * | * | trans | -90.6 | 107.8 | 168.7 | 21.5 | 0 | 0 | 0 | 0 | 109.6 | A263 | A263-S265 PolarHBondContact O-N 3.04Å; A263-S265 VanDerWaalsContact O-N 3.1Å | ||
| 266 | Y | 40.9 | Very low | 40.7 | Very low | 213 Ų | 213 | 130.6 Ų | 130.6 | 84% | 0.835 | 79% | 0.793 | S | S | * | * | trans | -77.4 | 128.4 | 165.9 | -75.3 | -90.5 | 0 | 0 | 0 | 109.1 | A268 | Y266-A268 PolarHBondContact O-N 3.2Š| ||
| 267 | P | 50.8 | Low | 39.9 | Very low | 122 Ų | 122 | 129.3 Ų | 129.3 | 79% | 0.792 | 79% | 0.787 | S | S | * | * | trans | -73.9 | 115.3 | 171.2 | 27.5 | -29.1 | 0 | 0 | 0 | 109.6 | G269 | P267-G269 PolarHBondContact O-N 3.32Š| ||
| 268 | A | 43.2 | Very low | 39.5 | Very low | 97 Ų | 97 | 132.5 Ų | 132.5 | 80% | 0.802 | 80% | 0.8 | S | S | * | * | trans | -66.3 | 123.2 | 165 | 0 | 0 | 0 | 0 | 0 | 108.8 | Y266 A270 | Y266-A268 PolarHBondContact O-N 3.2Å; A268-A270 PolarHBondContact O-N 3.44Å | ||
| 269 | G | 41.3 | Very low | 39.2 | Very low | 71 Ų | 71 | 130.3 Ų | 130.3 | 73% | 0.732 | 80% | 0.798 | S | S | * | * | trans | -63.1 | 104.7 | 176.6 | 0 | 0 | 0 | 0 | 0 | 110.9 | P267 | P267-G269 PolarHBondContact O-N 3.32Š| ||
| 270 | A | 42.5 | Very low | 39.1 | Very low | 92 Ų | 92 | 132.3 Ų | 132.3 | 76% | 0.76 | 81% | 0.808 | S | S | * | * | trans | -76.4 | 122.5 | 167 | 0 | 0 | 0 | 0 | 0 | 108.8 | A268 | A268-A270 PolarHBondContact O-N 3.44Š| ||
| 271 | M | 41.4 | Very low | 39.1 | Very low | 185 Ų | 185 | 130.4 Ų | 130.4 | 91% | 0.911 | 81% | 0.812 | S | S | * | * | trans | -73.2 | 124.5 | 174 | -48.1 | -167.3 | 172.9 | 0 | 0 | 107.6 | ||||
| 272 | Q | 38.1 | Very low | 39.1 | Very low | 187 Ų | 187 | 131.4 Ų | 131.4 | 87% | 0.874 | 82% | 0.817 | S | S | * | * | trans | -125.7 | 142.6 | 169 | -80.3 | -168.7 | 2.4 | 0 | 0 | 111.6 | ||||
| 273 | T | 37.8 | Very low | 39.3 | Very low | 137 Ų | 137 | 132 Ų | 132 | 84% | 0.84 | 82% | 0.819 | S | S | * | * | trans | -78 | 149.5 | -164 | 46.6 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 274 | V | 39.5 | Very low | 39.9 | Very low | 134 Ų | 134 | 134.3 Ų | 134.3 | 81% | 0.812 | 83% | 0.825 | S | S | * | * | trans | -61.9 | 129.5 | 170.6 | 171.7 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 275 | Q | 32.9 | Very low | 39.9 | Very low | 193 Ų | 193 | 135.6 Ų | 135.6 | 90% | 0.902 | 82% | 0.824 | S | S | * | * | trans | -178.2 | 134.1 | 136.9 | -109.4 | 171.3 | -59.4 | 0 | 0 | 114.2 | ||||
| 276 | G | 33.6 | Very low | 40 | Very low | 79 Ų | 79 | 139.4 Ų | 139.4 | 81% | 0.814 | 83% | 0.828 | S | S | * | * | 100.9 | 97.3 | 127.5 | 0 | 0 | 0 | 0 | 0 | 119.6 | |||||
| 277 | S | 35.9 | Very low | 39.7 | Very low | 119 Ų | 119 | 132.3 Ų | 132.3 | 83% | 0.832 | 82% | 0.819 | S | S | * | * | trans | -55.8 | 148.8 | 170.6 | -48.4 | 0 | 0 | 0 | 0 | 116.2 | ||||
| 278 | S | 36.7 | Very low | 39.1 | Very low | 129 Ų | 129 | 132.9 Ų | 132.9 | 90% | 0.902 | 82% | 0.82 | S | S | * | * | 173.7 | 136.1 | 122.4 | -79 | 0 | 0 | 0 | 0 | 112.4 | |||||
| 279 | G | 33.8 | Very low | 38.8 | Very low | 75 Ų | 75 | 131.9 Ų | 131.9 | 77% | 0.773 | 82% | 0.819 | S | S | * | * | trans | 126.6 | 87 | 150.2 | 0 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 280 | N | 36.9 | Very low | 38.7 | Very low | 176 Ų | 176 | 135.4 Ų | 135.4 | 94% | 0.941 | 82% | 0.821 | S | S | * | * | trans | 39.7 | 123.2 | 141.6 | -89.4 | 1.4 | 0 | 0 | 0 | 121.9 | ||||
| 281 | G | 40.4 | Very low | 38.7 | Very low | 74 Ų | 74 | 138.6 Ų | 138.6 | 76% | 0.763 | 82% | 0.824 | S | S | * | * | trans | 164.9 | 85.4 | 154 | 0 | 0 | 0 | 0 | 0 | 113.6 | Y283 | G281-Y283 PolarHBondContact O-N 3.4Š| ||
| 282 | N | 44.3 | Very low | 38.4 | Very low | 153 Ų | 153 | 136.5 Ų | 136.5 | 82% | 0.818 | 82% | 0.817 | S | S | * | * | trans | -55.5 | 120.7 | 176.9 | -64.8 | -48.8 | 0 | 0 | 0 | 113 | ||||
| 283 | Y | 42.3 | Very low | 38.1 | Very low | 235 Ų | 235 | 134.5 Ų | 134.5 | 92% | 0.922 | 81% | 0.812 | S | S | * | * | trans | -149.4 | 143.5 | 143 | -77.5 | -70.8 | 0 | 0 | 0 | 111.3 | G281 | G281-Y283 PolarHBondContact O-N 3.4Š| ||
| 284 | V | 49 | Very low | 38.2 | Very low | 124 Ų | 124 | 133.3 Ų | 133.3 | 75% | 0.752 | 81% | 0.805 | S | S | * | * | trans | -60 | 132.5 | -159.5 | -77.4 | 0 | 0 | 0 | 0 | 116.8 | F286 | V284-F286 HydrophobicContact CB-CE2 4.5Š| ||
| 285 | N | 37.7 | Very low | 38 | Very low | 145 Ų | 145 | 135.3 Ų | 135.3 | 78% | 0.775 | 81% | 0.805 | S | S | * | * | trans | -86.5 | 119.1 | 165.7 | -178.7 | -4.2 | 0 | 0 | 0 | 108.7 | G287 | N285-G287 PolarHBondContact OD1-N 3.27Š| ||
| 286 | F | 40.2 | Very low | 38 | Very low | 188 Ų | 188 | 132.3 Ų | 132.3 | 83% | 0.825 | 80% | 0.795 | S | S | * | * | trans | -106.9 | 103.5 | 159.6 | -85.9 | -82 | 0 | 0 | 0 | 108.2 | V284 | V284-F286 HydrophobicContact CB-CE2 4.5Š| ||
| 287 | G | 36.1 | Very low | 38.2 | Very low | 63 Ų | 63 | 133.6 Ų | 133.6 | 65% | 0.649 | 79% | 0.787 | S | S | * | * | trans | -60.8 | 144.3 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112.8 | N285 | N285-G287 PolarHBondContact OD1-N 3.27Š| ||
| 288 | V | 37.6 | Very low | 38.3 | Very low | 134 Ų | 134 | 136.4 Ų | 136.4 | 81% | 0.812 | 79% | 0.785 | S | S | * | * | trans | -57.5 | 128.7 | 162.6 | -178.8 | 0 | 0 | 0 | 0 | 109 | ||||
| 289 | G | 37.4 | Very low | 38.7 | Very low | 76 Ų | 76 | 135.1 Ų | 135.1 | 78% | 0.784 | 78% | 0.776 | S | S | * | * | trans | -110.9 | 110.5 | 166.5 | 0 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 290 | D | 37.8 | Very low | 39.1 | Very low | 145 Ų | 145 | 137.8 Ų | 137.8 | 78% | 0.775 | 78% | 0.779 | S | S | * | * | trans | -53.7 | 143.6 | 174.8 | -69.1 | -79 | 0 | 0 | 0 | 114.7 | ||||
| 291 | L | 43.9 | Very low | 39.2 | Very low | 159 Ų | 159 | 134.7 Ų | 134.7 | 83% | 0.832 | 77% | 0.771 | S | S | * | * | trans | -150 | 103.4 | 145.8 | -95.8 | 163.9 | 0 | 0 | 0 | 109.4 | ||||
| 292 | N | 34.3 | Very low | 39.5 | Very low | 142 Ų | 142 | 139.5 Ų | 139.5 | 76% | 0.759 | 78% | 0.78 | S | S | * | * | trans | 46.5 | 119.8 | 141.4 | -77.6 | -50.7 | 0 | 0 | 0 | 119.5 | ||||
| 293 | N | 32.3 | Very low | 39.3 | Very low | 145 Ų | 145 | 135.3 Ų | 135.3 | 78% | 0.775 | 77% | 0.772 | S | S | * | * | 159.7 | 143.4 | 83.6 | -152.9 | -6 | 0 | 0 | 0 | 113 | |||||
| 294 | V | 40.1 | Very low | 39.3 | Very low | 112 Ų | 112 | 131.2 Ų | 131.2 | 68% | 0.679 | 77% | 0.772 | S | S | * | * | trans | 74.6 | 88.2 | 162.8 | -153.3 | 0 | 0 | 0 | 0 | 119.2 | ||||
| 295 | Q | 35.2 | Very low | 39 | Very low | 175 Ų | 175 | 130.9 Ų | 130.9 | 82% | 0.818 | 78% | 0.775 | S | S | * | * | trans | -60.4 | 121.5 | 150.9 | -167.1 | 166.8 | 8.1 | 0 | 0 | 110.1 | ||||
| 296 | N | 32.5 | Very low | 39.5 | Very low | 131 Ų | 131 | 128.2 Ų | 128.2 | 70% | 0.701 | 77% | 0.768 | S | S | * | * | trans | -125.5 | 101.7 | 164 | -140 | 4.3 | 0 | 0 | 0 | 108.8 | ||||
| 297 | T | 38.6 | Very low | 40 | Very low | 105 Ų | 105 | 127.2 Ų | 127.2 | 64% | 0.644 | 77% | 0.77 | S | S | * | * | trans | -78.3 | 116 | 176.8 | -53.9 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 298 | F | 37 | Very low | 40.6 | Very low | 179 Ų | 179 | 132.2 Ų | 132.2 | 79% | 0.785 | 78% | 0.776 | S | S | * | * | trans | -125 | 117.3 | 161.9 | -85.2 | -80.6 | 0 | 0 | 0 | 110 | ||||
| 299 | S | 45.8 | Very low | 40.8 | Very low | 101 Ų | 101 | 128.8 Ų | 128.8 | 71% | 0.706 | 77% | 0.768 | S | S | * | * | trans | -64.4 | 144.3 | 175.5 | -44.1 | 0 | 0 | 0 | 0 | 111.8 | S301 | S299-S301 PolarHBondContact O-N 3.22Š| ||
| 300 | P | 42.8 | Very low | 41.4 | Very low | 131 Ų | 131 | 132.5 Ų | 132.5 | 85% | 0.851 | 77% | 0.768 | S | S | * | * | trans | -83.9 | 104.3 | 167.4 | 31.4 | -27.8 | 0 | 0 | 0 | 109.4 | ||||
| 301 | S | 38.5 | Very low | 42.4 | Very low | 111 Ų | 111 | 136.1 Ų | 136.1 | 78% | 0.776 | 77% | 0.771 | S | S | * | * | trans | -82.2 | 126.2 | 167.1 | 64.2 | 0 | 0 | 0 | 0 | 110.2 | S299 G303 | S299-S301 PolarHBondContact O-N 3.22Å; S301-G303 PolarHBondContact O-N 3.35Å | ||
| 302 | N | 46.2 | Very low | 42.6 | Very low | 176 Ų | 176 | 134.6 Ų | 134.6 | 94% | 0.941 | 77% | 0.769 | S | S | * | * | trans | -42 | 123.3 | 167.5 | -78.1 | -33.7 | 0 | 0 | 0 | 112.8 | ||||
| 303 | G | 40 | Very low | 43.6 | Very low | 64 Ų | 64 | 142.7 Ų | 142.7 | 66% | 0.66 | 79% | 0.789 | S | S | * | * | trans | -144.7 | 103.8 | 173 | 0 | 0 | 0 | 0 | 0 | 110.3 | S301 S305 | S301-G303 PolarHBondContact O-N 3.35Å; G303-S305 PolarHBondContact O-N 3.35Å | ||
| 304 | V | 43.4 | Very low | 44.1 | Very low | 149 Ų | 149 | 142.6 Ų | 142.6 | 90% | 0.903 | 79% | 0.789 | S | S | * | * | trans | -49.4 | 119.7 | 174.1 | -79 | 0 | 0 | 0 | 0 | 112.1 | S306 | V304-S306 PolarHBondContact O-N 3.38Š| ||
| 305 | S | 42.2 | Very low | 44.4 | Very low | 117 Ų | 117 | 144.2 Ų | 144.2 | 82% | 0.818 | 80% | 0.795 | S | S | * | * | trans | -75.9 | 102.8 | 173.7 | -72.3 | 0 | 0 | 0 | 0 | 110.3 | G303 L307 | G303-S305 PolarHBondContact O-N 3.35Å; S305-L307 PolarHBondContact O-N 2.81Å | ||
| 306 | S | 47.5 | Very low | 44.9 | Very low | 90 Ų | 90 | 142.5 Ų | 142.5 | 63% | 0.629 | 79% | 0.794 | S | S | * | * | trans | -79.5 | 99.7 | 167.9 | -171.8 | 0 | 0 | 0 | 0 | 109.5 | V304 H308 | V304-S306 PolarHBondContact O-N 3.38Å; S306-H308 PolarHBondContact O-N 3.1Å; S306-H308 PolarHBondContact O-ND1 3.29Å; S306-H308 PolarHBondContact OG-CE1 3.04Å; S306-H308 PolarHBondContact OG-ND1 3.43Å | ||
| 307 | L | 50.8 | Low | 45.6 | Very low | 167 Ų | 167 | 143.2 Ų | 143.2 | 87% | 0.874 | 80% | 0.8 | S | S | * | * | trans | -60.6 | 89.5 | 171 | -98.3 | 143.3 | 0 | 0 | 0 | 110.5 | S305 G309 | S305-L307 PolarHBondContact O-N 2.81Å; L307-G309 PolarHBondContact O-N 3.37Å | ||
| 308 | H | 48.9 | Very low | 46 | Very low | 167 Ų | 167 | 145.6 Ų | 145.6 | 77% | 0.773 | 81% | 0.809 | S | S | * | * | trans | -87 | 106.9 | 168.5 | -80.3 | 79.8 | 0 | 0 | 0 | 110.6 | S306 | S306-H308 PolarHBondContact O-N 3.1Å; S306-H308 PolarHBondContact O-ND1 3.29Å; S306-H308 PolarHBondContact OG-CE1 3.04Å; S306-H308 PolarHBondContact OG-ND1 3.43Å | ||
| 309 | G | 41.9 | Very low | 46.6 | Very low | 62 Ų | 62 | 143.3 Ų | 143.3 | 64% | 0.639 | 81% | 0.811 | S | S | * | * | trans | 76 | 79.3 | 139.3 | 0 | 0 | 0 | 0 | 0 | 117.1 | L307 R311 | L307-G309 PolarHBondContact O-N 3.37Å; G309-R311 PolarHBondContact O-N 3.42Å | ||
| 310 | I | 50.3 | Low | 46.7 | Very low | 155 Ų | 155 | 146.4 Ų | 146.4 | 80% | 0.795 | 82% | 0.818 | S | S | * | * | trans | -59.8 | 103.3 | 151.5 | -61.4 | 167.3 | 0 | 0 | 0 | 107.2 | T312 | I310-T312 HydrophobicContact CG2-CG2 4.06Š| ||
| 311 | R | 57.4 | Low | 47 | Very low | 220 Ų | 220 | 147.5 Ų | 147.5 | 83% | 0.83 | 82% | 0.816 | S | S | * | * | trans | -93.8 | 99.4 | 163.1 | -74.8 | 177.6 | -177.9 | -97.3 | -0 | 107.3 | G309 | G309-R311 PolarHBondContact O-N 3.42Š| ||
| 312 | T | 49.6 | Very low | 47.7 | Very low | 128 Ų | 128 | 150.6 Ų | 150.6 | 79% | 0.785 | 82% | 0.819 | S | S | * | * | trans | -61.7 | 132.9 | 163.8 | 45.8 | 0 | 0 | 0 | 0 | 108.8 | I310 | I310-T312 HydrophobicContact CG2-CG2 4.06Š| ||
| 313 | W | 54 | Low | 47.8 | Very low | 312 Ų | 312 | 148.3 Ų | 148.3 | 100% | 1.182 | 81% | 0.808 | S | S | * | * | trans | -106.6 | 0 | 169 | -73.6 | 82.8 | 0 | 0 | 0 | 108.9 |
Retrieved 313 of 313 residues in 155.7 ms
(Link to these results)