| 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 | 37.9 | Very low | 32.9 | Very low | 240 Ų | 240 | 168.7 Ų | 168.7 | 100% | 1.182 | 85% | 0.849 | S | S | * | * | 0 | 102.9 | 0 | -77.3 | 138.4 | 96.5 | 0 | 0 | 106.7 | |||||
| 2 | S | 31.1 | Very low | 32.7 | Very low | 103 Ų | 103 | 163.5 Ų | 163.5 | 72% | 0.72 | 83% | 0.832 | S | S | * | * | 58.2 | 126.6 | 89.2 | -143.6 | 0 | 0 | 0 | 0 | 110.4 | |||||
| 3 | R | 30.6 | Very low | 32.4 | Very low | 227 Ų | 227 | 164.2 Ų | 164.2 | 86% | 0.857 | 83% | 0.831 | S | S | * | * | cis | -175.7 | 156.5 | 24.5 | -138.1 | 175.2 | -160.7 | -166.7 | 5.5 | 108.9 | ||||
| 4 | R | 35.1 | Very low | 32.2 | Very low | 250 Ų | 250 | 165.9 Ų | 165.9 | 94% | 0.943 | 83% | 0.83 | S | S | * | * | trans | -5.8 | 147.4 | 154.5 | -72.5 | 176.5 | 178.7 | -171.3 | -1.2 | 121.8 | ||||
| 5 | G | 32.7 | Very low | 32.8 | Very low | 78 Ų | 78 | 161.9 Ų | 161.9 | 80% | 0.804 | 82% | 0.82 | S | S | * | * | trans | 176.5 | 120.1 | 136.1 | 0 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 6 | G | 30.6 | Very low | 32.7 | Very low | 70 Ų | 70 | 158.1 Ų | 158.1 | 72% | 0.722 | 81% | 0.813 | S | S | * | * | cis | 84.3 | 102.3 | 26.6 | 0 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 7 | F | 34.4 | Very low | 32.5 | Very low | 205 Ų | 205 | 161.1 Ų | 161.1 | 90% | 0.899 | 81% | 0.811 | S | S | * | * | 178.5 | 115.5 | 122.4 | -111.8 | -95.9 | 0 | 0 | 0 | 112.6 | |||||
| 8 | Y | 31.2 | Very low | 32.4 | Very low | 220 Ų | 220 | 161 Ų | 161 | 86% | 0.863 | 81% | 0.808 | S | S | * | * | trans | -70.1 | 141.5 | 155.1 | -94.2 | -108.2 | 0 | 0 | 0 | 109.3 | ||||
| 9 | L | 35.4 | Very low | 32.1 | Very low | 178 Ų | 178 | 161.4 Ų | 161.4 | 93% | 0.932 | 81% | 0.807 | S | S | * | * | trans | -89.1 | 110.2 | 165.1 | -116.1 | 122.6 | 0 | 0 | 0 | 110.2 | ||||
| 10 | N | 31.4 | Very low | 32 | Very low | 127 Ų | 127 | 160.8 Ų | 160.8 | 68% | 0.679 | 80% | 0.801 | S | S | * | * | trans | -31.6 | 156 | 147.3 | -108.1 | -45.1 | 0 | 0 | 0 | 113.2 | ||||
| 11 | Q | 32 | Very low | 31.8 | Very low | 158 Ų | 158 | 160.9 Ų | 160.9 | 74% | 0.738 | 80% | 0.799 | S | S | * | * | 179.7 | 144.8 | 57.7 | -133.5 | 169.2 | -17.4 | 0 | 0 | 105.4 | |||||
| 12 | T | 30.6 | Very low | 31.5 | Very low | 106 Ų | 106 | 159.1 Ų | 159.1 | 65% | 0.65 | 79% | 0.785 | S | S | * | * | 150.1 | 148.6 | 76.8 | 13.4 | 0 | 0 | 0 | 0 | 103.2 | |||||
| 13 | Q | 28.9 | Very low | 31.3 | Very low | 173 Ų | 173 | 159.1 Ų | 159.1 | 81% | 0.808 | 78% | 0.784 | S | S | * | * | cis | -173.1 | 139.2 | 0.9 | -176.5 | 152.7 | -40.5 | 0 | 0 | 106.6 | ||||
| 14 | K | 29.2 | Very low | 31.1 | Very low | 188 Ų | 188 | 157.1 Ų | 157.1 | 82% | 0.817 | 78% | 0.784 | S | S | * | * | trans | -55.6 | -178.5 | 166.3 | -122.9 | -164.7 | 179.7 | 177.9 | 0 | 111.6 | ||||
| 15 | P | 41.7 | Very low | 30.9 | Very low | 106 Ų | 106 | 153.9 Ų | 153.9 | 69% | 0.688 | 78% | 0.782 | S | S | * | * | cis | -153.8 | 175.6 | 28.1 | 38.4 | -14.1 | 0 | 0 | 0 | 120.3 | ||||
| 16 | S | 30.4 | Very low | 31.2 | Very low | 100 Ų | 100 | 155.7 Ų | 155.7 | 70% | 0.699 | 78% | 0.78 | S | S | * | * | trans | 75.6 | 141.8 | 140 | -75.4 | 0 | 0 | 0 | 0 | 119.5 | ||||
| 17 | R | 28.7 | Very low | 31.3 | Very low | 209 Ų | 209 | 161.8 Ų | 161.8 | 79% | 0.789 | 78% | 0.781 | S | S | * | * | cis | -164.3 | 142.5 | 11.9 | -113.7 | -173.7 | -149 | 178.9 | 4 | 107.3 | ||||
| 18 | E | 31.6 | Very low | 31.2 | Very low | 160 Ų | 160 | 159.4 Ų | 159.4 | 75% | 0.748 | 78% | 0.777 | S | S | * | * | 47.4 | 123.2 | 110.6 | -67.8 | -176.8 | 127.4 | 0 | 0 | 115.3 | |||||
| 19 | Q | 27.3 | Very low | 31.4 | Very low | 169 Ų | 169 | 153.9 Ų | 153.9 | 79% | 0.79 | 76% | 0.759 | S | S | * | * | 178 | 133.6 | 69.9 | -111.2 | 163.5 | -34.8 | 0 | 0 | 106.8 | |||||
| 20 | E | 30 | Very low | 31.2 | Very low | 149 Ų | 149 | 153.2 Ų | 153.2 | 70% | 0.696 | 76% | 0.756 | S | S | * | * | 79.3 | 135.2 | 85.7 | -132.8 | -164.7 | 140.7 | 0 | 0 | 117.4 | |||||
| 21 | Q | 28.1 | Very low | 31.4 | Very low | 162 Ų | 162 | 155.1 Ų | 155.1 | 76% | 0.757 | 76% | 0.761 | S | S | * | * | trans | 82.5 | 97.5 | 154 | -83.5 | 170.8 | 18.5 | 0 | 0 | 124.2 | ||||
| 22 | K | 30.2 | Very low | 31.4 | Very low | 203 Ų | 203 | 152.4 Ų | 152.4 | 88% | 0.883 | 76% | 0.758 | S | S | * | * | 13.8 | 121.6 | 119.5 | -164.2 | -179.6 | -169 | -176.3 | 0 | 119.2 | |||||
| 23 | C | 26.6 | Very low | 31.4 | Very low | 104 Ų | 104 | 158.9 Ų | 158.9 | 70% | 0.703 | 77% | 0.771 | S | S | * | * | -175.1 | 135 | 127.6 | -126.2 | 0 | 0 | 0 | 0 | 115.5 | |||||
| 24 | Q | 26.7 | Very low | 31.6 | Very low | 184 Ų | 184 | 155.7 Ų | 155.7 | 86% | 0.86 | 77% | 0.768 | S | S | * | * | trans | 51.6 | 126.7 | 140.4 | -80.2 | 164.9 | -32.7 | 0 | 0 | 124.7 | ||||
| 25 | M | 30.8 | Very low | 31.6 | Very low | 182 Ų | 182 | 153.1 Ų | 153.1 | 90% | 0.897 | 77% | 0.772 | S | S | * | * | trans | -56.6 | 165.3 | 153.7 | -77.9 | -172.2 | -165.9 | 0 | 0 | 113 | ||||
| 26 | P | 40.6 | Very low | 31.4 | Very low | 117 Ų | 117 | 153.5 Ų | 153.5 | 76% | 0.76 | 78% | 0.777 | S | S | * | * | cis | -153.5 | 159.9 | 45.5 | 40.8 | -17.7 | 0 | 0 | 0 | 121.2 | ||||
| 27 | R | 31.4 | Very low | 31.4 | Very low | 198 Ų | 198 | 155 Ų | 155 | 75% | 0.747 | 79% | 0.786 | S | S | * | * | trans | 51.9 | 125.2 | 131.2 | -161.6 | 178.4 | -175.2 | 146 | 0.1 | 122.7 | E29 | R27-E29 HydrophobicContact CG-CG 4.4Å; R27-E29 IonicContact CZ-OE1 3.26Å; R27-E29 VanDerWaalsContact CZ-OE1 3.26Å; R27-E29 IonicContact NE-OE1 2.91Å; R27-E29 PolarHBondContact NE-OE1 3.35Å; R27-E29 IonicContact NH2-OE1 2.77Å; R27-E29 PolarHBondContact NH2-OE1 2.92Å | ||
| 28 | L | 33.6 | Very low | 32 | Very low | 155 Ų | 155 | 150.5 Ų | 150.5 | 81% | 0.812 | 79% | 0.786 | S | S | * | * | trans | -162.7 | 100.6 | 132.2 | -137.5 | 69.6 | 0 | 0 | 0 | 106.8 | ||||
| 29 | E | 34.4 | Very low | 33.1 | Very low | 103 Ų | 103 | 148.1 Ų | 148.1 | 48% | 0.481 | 79% | 0.785 | S | S | . | * | 51.4 | 108.2 | 100.4 | -66.5 | 176.8 | 174.9 | 0 | 0 | 111.1 | R27 | R27-E29 HydrophobicContact CG-CG 4.4Å; R27-E29 IonicContact CZ-OE1 3.26Å; R27-E29 VanDerWaalsContact CZ-OE1 3.26Å; R27-E29 IonicContact NE-OE1 2.91Å; R27-E29 PolarHBondContact NE-OE1 3.35Å; R27-E29 IonicContact NH2-OE1 2.77Å; R27-E29 PolarHBondContact NH2-OE1 2.92Å | |||
| 30 | D | 32.3 | Very low | 33.5 | Very low | 165 Ų | 165 | 149.7 Ų | 149.7 | 88% | 0.882 | 79% | 0.789 | S | S | * | * | -145.5 | 136.5 | 92.1 | -76 | -43 | 0 | 0 | 0 | 115.7 | |||||
| 31 | H | 35.3 | Very low | 34.4 | Very low | 166 Ų | 166 | 147 Ų | 147 | 77% | 0.769 | 79% | 0.793 | S | S | * | * | trans | -59.1 | 148.6 | 160.4 | -63.9 | -86.1 | 0 | 0 | 0 | 109.8 | ||||
| 32 | C | 32.2 | Very low | 34.8 | Very low | 101 Ų | 101 | 147.1 Ų | 147.1 | 68% | 0.682 | 79% | 0.793 | S | S | * | * | 160.6 | 127.1 | 69.3 | -161.1 | 0 | 0 | 0 | 0 | 103.9 | |||||
| 33 | W | 28.8 | Very low | 35.5 | Very low | 242 Ų | 242 | 144.3 Ų | 144.3 | 92% | 0.917 | 79% | 0.793 | S | S | * | * | -179.3 | 141.7 | 87.9 | -100.8 | 68.1 | 0 | 0 | 0 | 108.6 | |||||
| 34 | S | 34.8 | Very low | 36.5 | Very low | 107 Ų | 107 | 147.4 Ų | 147.4 | 75% | 0.748 | 80% | 0.795 | S | S | * | * | trans | -66.4 | 151.8 | 172.1 | -52.1 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 35 | C | 28.5 | Very low | 37.2 | Very low | 133 Ų | 133 | 148 Ų | 148 | 90% | 0.899 | 80% | 0.797 | S | S | * | * | -168.4 | 124.8 | 121.2 | -108.5 | 0 | 0 | 0 | 0 | 112.3 | |||||
| 36 | S | 38.3 | Very low | 37.9 | Very low | 114 Ų | 114 | 143 Ų | 143 | 80% | 0.797 | 78% | 0.78 | S | S | * | * | trans | -61.8 | 146.5 | 172.8 | -57 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 37 | C | 30.2 | Very low | 38.5 | Very low | 133 Ų | 133 | 142.2 Ų | 142.2 | 90% | 0.899 | 78% | 0.777 | S | S | * | * | trans | -179.4 | 113.1 | 130.9 | -90.7 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 38 | S | 41 | Very low | 39.6 | Very low | 113 Ų | 113 | 134.8 Ų | 134.8 | 79% | 0.79 | 76% | 0.762 | S | S | * | * | trans | -102.4 | 155.8 | 144.9 | -153.2 | 0 | 0 | 0 | 0 | 105.5 | ||||
| 39 | P | 54.9 | Low | 40.6 | Very low | 111 Ų | 111 | 130.9 Ų | 130.9 | 72% | 0.721 | 75% | 0.752 | S | S | * | * | cis | -143 | 157.6 | 19.6 | 39 | -19.6 | 0 | 0 | 0 | 115.4 | ||||
| 40 | K | 34.3 | Very low | 41.9 | Very low | 201 Ų | 201 | 131 Ų | 131 | 87% | 0.874 | 76% | 0.756 | S | S | * | * | trans | -168.6 | 119.8 | 138.5 | -123.2 | 170.4 | 179.2 | 174.5 | 0 | 111.6 | E42 | K40-E42 PolarHBondContact O-N 2.87Š| ||
| 41 | A | 49.3 | Very low | 43.6 | Very low | 93 Ų | 93 | 131 Ų | 131 | 77% | 0.769 | 74% | 0.744 | S | S | * | * | trans | -59.9 | 123.4 | 161.1 | 0 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 42 | E | 36.9 | Very low | 44.9 | Very low | 165 Ų | 165 | 130.1 Ų | 130.1 | 77% | 0.771 | 74% | 0.738 | S | S | * | * | trans | -138.9 | 89.1 | 151 | -81.4 | -149.1 | 111.1 | 0 | 0 | 109.1 | K40 K44 | K40-E42 PolarHBondContact O-N 2.87Å; E42-K44 PolarHBondContact O-N 2.77Å | ||
| 43 | T | 45.2 | Very low | 46.8 | Very low | 143 Ų | 143 | 127.7 Ų | 127.7 | 88% | 0.877 | 73% | 0.726 | S | S | * | * | trans | -76 | 87.8 | 160.5 | 6.3 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 44 | K | 46.9 | Very low | 49 | Very low | 169 Ų | 169 | 119.4 Ų | 119.4 | 74% | 0.735 | 71% | 0.705 | S | S | * | * | trans | -140.2 | 137.2 | 161.8 | -82.1 | -177.1 | 178.7 | 169.4 | 0 | 108.8 | E42 | E42-K44 PolarHBondContact O-N 2.77Š| ||
| 45 | H | 42.6 | Very low | 51.1 | Low | 197 Ų | 197 | 120.4 Ų | 120.4 | 91% | 0.912 | 70% | 0.695 | S | S | * | * | S | Bend | trans | 93 | 58.9 | -173.3 | -59 | -82.1 | 0 | 0 | 0 | 117.1 | ||
| 46 | S | 43.9 | Very low | 53.3 | Low | 78 Ų | 78 | 116.4 Ų | 116.4 | 55% | 0.545 | 67% | 0.672 | S | S | . | * | S | Bend | trans | -151.7 | -17.5 | 154.8 | 176.5 | 0 | 0 | 0 | 0 | 112.9 | G48 | S46-G48 PolarHBondContact O-N 3.16Š|
| 47 | S | 53 | Low | 55.2 | Low | 100 Ų | 100 | 117.8 Ų | 117.8 | 70% | 0.699 | 67% | 0.666 | S | S | * | * | H | α-helix | trans | -68.5 | -25.8 | -175.2 | -159 | 0 | 0 | 0 | 0 | 115.3 | W51 | S47-W51 WeakPolarHBondContact O-CB 3.37Å; S47-W51 PolarHBondContact O-N 3.36Å |
| 48 | G | 54.8 | Low | 57.9 | Low | 42 Ų | 42 | 117.5 Ų | 117.5 | 43% | 0.433 | 65% | 0.651 | S | S | . | * | H | α-helix | trans | -73.2 | -49.4 | -177.6 | 0 | 0 | 0 | 0 | 0 | 113 | S46 W51 F52 | S46-G48 PolarHBondContact O-N 3.16Å; G48-W51 WeakPolarHBondContact O-CB 3.37Å; G48-W51 PolarHBondContact O-N 3.36Å; G48-F52 WeakPolarHBondContact O-CD2 3.35Å; G48-F52 PolarHBondContact O-N 3.5Å |
| 49 | A | 55.9 | Low | 59.8 | Low | 72 Ų | 72 | 117.7 Ų | 117.7 | 60% | 0.595 | 64% | 0.641 | S | S | * | * | H | α-helix | trans | -66.5 | -40.3 | -178.4 | 0 | 0 | 0 | 0 | 0 | 112.3 | W51 F52 A53 | A49-W51 VanDerWaalsContact C-N 3.33Å; A49-W51 PolarHBondContact O-N 3.09Å; A49-F52 PolarHBondContact O-N 3.07Å; A49-A53 WeakPolarHBondContact O-CB 3.17Å; A49-A53 PolarHBondContact O-N 2.99Å |
| 50 | N | 60.3 | Low | 60.9 | Low | 107 Ų | 107 | 118 Ų | 118 | 57% | 0.572 | 63% | 0.634 | S | S | * | * | H | α-helix | trans | -67.5 | -33.7 | 176.3 | -69.9 | -0.6 | 0 | 0 | 0 | 112.3 | S54 | N50-S54 VanDerWaalsContact O-CB 3.26Å; N50-S54 WeakPolarHBondContact O-CB 3.25Å; N50-S54 PolarHBondContact O-N 3.45Å |
| 51 | W | 67.6 | Low | 63.4 | Low | 165 Ų | 165 | 112.2 Ų | 112.2 | 63% | 0.625 | 62% | 0.619 | S | S | * | * | H | α-helix | trans | -67.3 | -45.2 | 173.8 | 175.2 | -91.2 | 0 | 0 | 0 | 112.1 | S47 G48 A49 K55 | S47-W51 WeakPolarHBondContact O-CB 3.37Å; S47-W51 PolarHBondContact O-N 3.36Å; G48-W51 WeakPolarHBondContact O-CB 3.37Å; G48-W51 PolarHBondContact O-N 3.36Å; A49-W51 VanDerWaalsContact C-N 3.33Å; A49-W51 PolarHBondContact O-N 3.09Å; W51-K55 VanDerWaalsContact O-CB 3.3Å; W51-K55 WeakPolarHBondContact O-CB 3.3Å; W51-K55 PolarHBondContact O-N 3.29Å |
| 52 | F | 64.5 | Low | 65.1 | Low | 147 Ų | 147 | 112.3 Ų | 112.3 | 65% | 0.645 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -67.2 | -36.8 | 177.1 | -74.8 | -66.9 | 0 | 0 | 0 | 112.4 | G48 A49 A56 | G48-F52 WeakPolarHBondContact O-CD2 3.35Å; G48-F52 PolarHBondContact O-N 3.5Å; A49-F52 PolarHBondContact O-N 3.07Å; F52-A56 VanDerWaalsContact O-CB 3.28Å; F52-A56 WeakPolarHBondContact O-CB 3.25Å; F52-A56 PolarHBondContact O-N 3.38Å |
| 53 | A | 71.6 | Confident | 67.3 | Low | 50 Ų | 50 | 108 Ų | 108 | 41% | 0.413 | 59% | 0.587 | S | S | . | * | H | α-helix | trans | -65.6 | -48.2 | 174.5 | 0 | 0 | 0 | 0 | 0 | 111.9 | A49 K55 A56 E57 | A49-A53 WeakPolarHBondContact O-CB 3.17Å; A49-A53 PolarHBondContact O-N 2.99Å; A53-K55 VanDerWaalsContact C-N 3.32Å; A53-K55 PolarHBondContact O-N 3.4Å; A53-A56 WeakPolarHBondContact O-CB 3.48Å; A53-A56 PolarHBondContact O-N 3.41Å; A53-A56 VanDerWaalsContact O-N 3.14Å; A53-E57 WeakPolarHBondContact O-CG 3.19Å; A53-E57 PolarHBondContact O-N 2.91Å |
| 54 | S | 75.7 | Confident | 69.2 | Low | 68 Ų | 68 | 105.7 Ų | 105.7 | 48% | 0.476 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -60 | -41.3 | 176.8 | 171.2 | 0 | 0 | 0 | 0 | 112.2 | N50 A56 E57 E58 | N50-S54 VanDerWaalsContact O-CB 3.26Å; N50-S54 WeakPolarHBondContact O-CB 3.25Å; N50-S54 PolarHBondContact O-N 3.45Å; S54-A56 VanDerWaalsContact C-N 3.35Å; S54-E57 PolarHBondContact O-N 3.2Å; S54-E58 PolarHBondContact O-N 2.82Å; S54-E58 VanDerWaalsContact O-N 3.08Å |
| 55 | K | 77.6 | Confident | 71 | Confident | 127 Ų | 127 | 100.4 Ų | 100.4 | 55% | 0.552 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -69.8 | -31.9 | 177.1 | -159.3 | 175.3 | -176 | -176.5 | 0 | 112.6 | W51 A53 M59 | W51-K55 VanDerWaalsContact O-CB 3.3Å; W51-K55 WeakPolarHBondContact O-CB 3.3Å; W51-K55 PolarHBondContact O-N 3.29Å; A53-K55 VanDerWaalsContact C-N 3.32Å; A53-K55 PolarHBondContact O-N 3.4Å; K55-M59 WeakPolarHBondContact O-CB 3.17Å; K55-M59 PolarHBondContact O-N 2.98Å; K55-M59 VanDerWaalsContact O-N 3.11Å |
| 56 | A | 75.5 | Confident | 72.9 | Confident | 49 Ų | 49 | 96.9 Ų | 96.9 | 41% | 0.405 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -71.3 | -38.6 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | F52 A53 S54 M59 M60 | F52-A56 VanDerWaalsContact O-CB 3.28Å; F52-A56 WeakPolarHBondContact O-CB 3.25Å; F52-A56 PolarHBondContact O-N 3.38Å; A53-A56 WeakPolarHBondContact O-CB 3.48Å; A53-A56 PolarHBondContact O-N 3.41Å; A53-A56 VanDerWaalsContact O-N 3.14Å; S54-A56 VanDerWaalsContact C-N 3.35Å; A56-M59 PolarHBondContact O-N 3.45Å; A56-M60 WeakPolarHBondContact O-CB 3.38Å; A56-M60 VanDerWaalsContact O-CG 3.29Å; A56-M60 WeakPolarHBondContact O-CG 3.31Å; A56-M60 PolarHBondContact O-N 3.26Å |
| 57 | E | 78.2 | Confident | 74.7 | Confident | 144 Ų | 144 | 98.7 Ų | 98.7 | 67% | 0.673 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -63.8 | -43.4 | 174.6 | -73.9 | -180 | 167.4 | 0 | 0 | 111.9 | A53 S54 M59 M60 S61 | A53-E57 WeakPolarHBondContact O-CG 3.19Å; A53-E57 PolarHBondContact O-N 2.91Å; S54-E57 PolarHBondContact O-N 3.2Å; E57-M59 PolarHBondContact O-N 2.93Å; E57-M60 PolarHBondContact O-N 3.09Å; E57-S61 PolarHBondContact O-N 2.96Å |
| 58 | E | 85.3 | Confident | 76 | Confident | 126 Ų | 126 | 96 Ų | 96 | 59% | 0.589 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -62.4 | -43.3 | 175.4 | -165.7 | 176.6 | -170.6 | 0 | 0 | 111.3 | S54 M60 S61 I62 | S54-E58 PolarHBondContact O-N 2.82Å; S54-E58 VanDerWaalsContact O-N 3.08Å; E58-M60 PolarHBondContact O-N 3.34Å; E58-S61 PolarHBondContact O-N 2.8Å; E58-I62 HydrophobicContact CG-CD1 4.44Å; E58-I62 WeakPolarHBondContact O-CG1 3.47Å; E58-I62 PolarHBondContact O-N 2.77Å; E58-I62 VanDerWaalsContact O-N 3.08Å |
| 59 | M | 82 | Confident | 77.2 | Confident | 117 Ų | 117 | 98 Ų | 98 | 58% | 0.576 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -64.4 | -40.8 | 176.9 | -162.5 | 176 | 87.9 | 0 | 0 | 112.4 | K55 A56 E57 S61 I62 I63 | K55-M59 WeakPolarHBondContact O-CB 3.17Å; K55-M59 PolarHBondContact O-N 2.98Å; K55-M59 VanDerWaalsContact O-N 3.11Å; A56-M59 PolarHBondContact O-N 3.45Å; E57-M59 PolarHBondContact O-N 2.93Å; M59-S61 VanDerWaalsContact C-N 3.35Å; M59-I62 PolarHBondContact O-N 3.39Å; M59-I63 HydrophobicContact CE-CD1 4.38Å; M59-I63 HydrophobicContact CG-CD1 4.22Å; M59-I63 WeakPolarHBondContact O-CD1 3.47Å; M59-I63 VanDerWaalsContact O-CG1 3.25Å; M59-I63 WeakPolarHBondContact O-CG1 3.43Å; M59-I63 PolarHBondContact O-N 3.33Å |
| 60 | M | 78 | Confident | 78.1 | Confident | 118 Ų | 118 | 97.5 Ų | 97.5 | 58% | 0.581 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -65.4 | -36.3 | 176.1 | -77.3 | -73.4 | -74.5 | 0 | 0 | 112.4 | A56 E57 E58 T64 | A56-M60 WeakPolarHBondContact O-CB 3.38Å; A56-M60 VanDerWaalsContact O-CG 3.29Å; A56-M60 WeakPolarHBondContact O-CG 3.31Å; A56-M60 PolarHBondContact O-N 3.26Å; E57-M60 PolarHBondContact O-N 3.09Å; E58-M60 PolarHBondContact O-N 3.34Å; M60-T64 WeakPolarHBondContact O-CB 3.45Å; M60-T64 PolarHBondContact O-N 3.05Å; M60-T64 PolarHBondContact O-OG1 2.91Å |
| 61 | S | 86.6 | Confident | 79 | Confident | 79 Ų | 79 | 100.2 Ų | 100.2 | 55% | 0.552 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -65.5 | -44.9 | 175.5 | -175.6 | 0 | 0 | 0 | 0 | 111.6 | E57 E58 M59 I63 T64 A65 | E57-S61 PolarHBondContact O-N 2.96Å; E58-S61 PolarHBondContact O-N 2.8Å; M59-S61 VanDerWaalsContact C-N 3.35Å; S61-I63 PolarHBondContact O-N 3.02Å; S61-T64 PolarHBondContact O-N 2.98Å; S61-A65 WeakPolarHBondContact O-CB 3.33Å; S61-A65 PolarHBondContact O-N 3.23Å |
| 62 | I | 84.4 | Confident | 79.4 | Confident | 95 Ų | 95 | 94.1 Ų | 94.1 | 49% | 0.487 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -61.8 | -45.9 | 176.6 | -65.5 | 165 | 0 | 0 | 0 | 110.6 | E58 M59 T64 A65 M66 | E58-I62 HydrophobicContact CG-CD1 4.44Å; E58-I62 WeakPolarHBondContact O-CG1 3.47Å; E58-I62 PolarHBondContact O-N 2.77Å; E58-I62 VanDerWaalsContact O-N 3.08Å; M59-I62 PolarHBondContact O-N 3.39Å; I62-T64 VanDerWaalsContact C-N 3.31Å; I62-T64 PolarHBondContact O-N 3.03Å; I62-A65 PolarHBondContact O-N 3.27Å; I62-M66 HydrophobicContact CG2-CG 4.33Å; I62-M66 WeakPolarHBondContact O-CB 3.48Å; I62-M66 WeakPolarHBondContact O-CG 3.39Å; I62-M66 PolarHBondContact O-N 3.31Å |
| 63 | I | 83.6 | Confident | 80.1 | Confident | 76 Ų | 76 | 90.6 Ų | 90.6 | 39% | 0.39 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -60.9 | -43.1 | 177.7 | -68.3 | 165.5 | 0 | 0 | 0 | 110.5 | M59 S61 M66 L67 | M59-I63 HydrophobicContact CE-CD1 4.38Å; M59-I63 HydrophobicContact CG-CD1 4.22Å; M59-I63 WeakPolarHBondContact O-CD1 3.47Å; M59-I63 VanDerWaalsContact O-CG1 3.25Å; M59-I63 WeakPolarHBondContact O-CG1 3.43Å; M59-I63 PolarHBondContact O-N 3.33Å; S61-I63 PolarHBondContact O-N 3.02Å; I63-M66 PolarHBondContact O-N 3.42Å; I63-L67 HydrophobicContact CG2-CD1 3.95Å; I63-L67 WeakPolarHBondContact O-CB 3.25Å; I63-L67 WeakPolarHBondContact O-CD1 3.01Å; I63-L67 PolarHBondContact O-N 2.95Å |
| 64 | T | 85.5 | Confident | 80.3 | Confident | 94 Ų | 94 | 93.2 Ų | 93.2 | 58% | 0.577 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -65.3 | -41 | 179.4 | -56.1 | 0 | 0 | 0 | 0 | 111.8 | M60 S61 I62 G68 | M60-T64 WeakPolarHBondContact O-CB 3.45Å; M60-T64 PolarHBondContact O-N 3.05Å; M60-T64 PolarHBondContact O-OG1 2.91Å; S61-T64 PolarHBondContact O-N 2.98Å; I62-T64 VanDerWaalsContact C-N 3.31Å; I62-T64 PolarHBondContact O-N 3.03Å; T64-G68 PolarHBondContact O-N 3.16Å |
| 65 | A | 85.3 | Confident | 80.5 | Confident | 57 Ų | 57 | 95 Ų | 95 | 47% | 0.471 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -66.1 | -41.8 | 176.1 | 0 | 0 | 0 | 0 | 0 | 111.9 | S61 I62 G68 S69 | S61-A65 WeakPolarHBondContact O-CB 3.33Å; S61-A65 PolarHBondContact O-N 3.23Å; I62-A65 PolarHBondContact O-N 3.27Å; A65-G68 PolarHBondContact O-N 3.35Å; A65-S69 WeakPolarHBondContact O-CB 3.46Å; A65-S69 PolarHBondContact O-N 2.95Å |
| 66 | M | 82.2 | Confident | 80.7 | Confident | 124 Ų | 124 | 94.2 Ų | 94.2 | 61% | 0.611 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -67.6 | -42.5 | 176.6 | -67.9 | -64.3 | 140 | 0 | 0 | 111.7 | I62 I63 S69 A70 | I62-M66 HydrophobicContact CG2-CG 4.33Å; I62-M66 WeakPolarHBondContact O-CB 3.48Å; I62-M66 WeakPolarHBondContact O-CG 3.39Å; I62-M66 PolarHBondContact O-N 3.31Å; I63-M66 PolarHBondContact O-N 3.42Å; M66-S69 PolarHBondContact O-N 3.48Å; M66-A70 WeakPolarHBondContact O-CB 3.31Å; M66-A70 PolarHBondContact O-N 2.88Å |
| 67 | L | 82.2 | Confident | 81 | Confident | 115 Ų | 115 | 95.5 Ų | 95.5 | 60% | 0.602 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -63.4 | -41.6 | 173.2 | -103.8 | 75.6 | 0 | 0 | 0 | 111.6 | I63 A70 Y71 | I63-L67 HydrophobicContact CG2-CD1 3.95Å; I63-L67 WeakPolarHBondContact O-CB 3.25Å; I63-L67 WeakPolarHBondContact O-CD1 3.01Å; I63-L67 PolarHBondContact O-N 2.95Å; L67-A70 PolarHBondContact O-N 3.29Å; L67-Y71 WeakPolarHBondContact O-CB 3.44Å; L67-Y71 PolarHBondContact O-N 3.47Å |
| 68 | G | 78.9 | Confident | 81.2 | Confident | 45 Ų | 45 | 96.4 Ų | 96.4 | 46% | 0.464 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -64 | -44.2 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.4 | T64 A65 G72 | T64-G68 PolarHBondContact O-N 3.16Å; A65-G68 PolarHBondContact O-N 3.35Å; G68-G72 PolarHBondContact O-N 3.28Å |
| 69 | S | 79.6 | Confident | 81.2 | Confident | 84 Ų | 84 | 92.8 Ų | 92.8 | 59% | 0.587 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -66.1 | -43 | 176 | -173.7 | 0 | 0 | 0 | 0 | 112 | A65 M66 G72 S73 | A65-S69 WeakPolarHBondContact O-CB 3.46Å; A65-S69 PolarHBondContact O-N 2.95Å; M66-S69 PolarHBondContact O-N 3.48Å; S69-G72 PolarHBondContact O-N 2.96Å; S69-S73 VanDerWaalsContact O-CB 3.32Å; S69-S73 WeakPolarHBondContact O-CB 3.27Å; S69-S73 PolarHBondContact O-N 3.25Å |
| 70 | A | 75.3 | Confident | 81.4 | Confident | 61 Ų | 61 | 89.6 Ų | 89.6 | 50% | 0.504 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -67.9 | -41.2 | 177.7 | 0 | 0 | 0 | 0 | 0 | 111.7 | M66 L67 S73 L74 | M66-A70 WeakPolarHBondContact O-CB 3.31Å; M66-A70 PolarHBondContact O-N 2.88Å; L67-A70 PolarHBondContact O-N 3.29Å; A70-S73 PolarHBondContact O-N 3.48Å; A70-L74 VanDerWaalsContact O-CB 3.24Å; A70-L74 WeakPolarHBondContact O-CB 3.21Å; A70-L74 PolarHBondContact O-N 3.46Å |
| 71 | Y | 79.4 | Confident | 81.9 | Confident | 164 Ų | 164 | 87.2 Ų | 87.2 | 64% | 0.643 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -64.6 | -43.7 | 175.2 | -176.1 | -95.4 | 0 | 0 | 0 | 111.4 | L67 L74 H75 | L67-Y71 WeakPolarHBondContact O-CB 3.44Å; L67-Y71 PolarHBondContact O-N 3.47Å; Y71-L74 PolarHBondContact O-N 2.99Å; Y71-H75 VanDerWaalsContact O-CB 3.23Å; Y71-H75 WeakPolarHBondContact O-CB 3.45Å; Y71-H75 PolarHBondContact O-N 3.4Å |
| 72 | G | 76.6 | Confident | 82 | Confident | 36 Ų | 36 | 87.3 Ų | 87.3 | 37% | 0.371 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -60.5 | -47.5 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | G68 S69 H75 D76 | G68-G72 PolarHBondContact O-N 3.28Å; S69-G72 PolarHBondContact O-N 2.96Å; G72-H75 PolarHBondContact O-N 3.48Å; G72-D76 WeakPolarHBondContact O-CB 3.3Å; G72-D76 PolarHBondContact O-N 3.34Å |
| 73 | S | 78.6 | Confident | 82.3 | Confident | 73 Ų | 73 | 88.1 Ų | 88.1 | 51% | 0.51 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -63.3 | -43.2 | 176.9 | -179.2 | 0 | 0 | 0 | 0 | 112.5 | S69 A70 H75 D76 V77 | S69-S73 VanDerWaalsContact O-CB 3.32Å; S69-S73 WeakPolarHBondContact O-CB 3.27Å; S69-S73 PolarHBondContact O-N 3.25Å; A70-S73 PolarHBondContact O-N 3.48Å; S73-H75 PolarHBondContact O-N 2.92Å; S73-D76 PolarHBondContact O-N 2.92Å; S73-V77 WeakPolarHBondContact O-CG2 3.48Å; S73-V77 PolarHBondContact O-N 3.4Å |
| 74 | L | 76.9 | Confident | 82.6 | Confident | 106 Ų | 106 | 93.4 Ų | 93.4 | 56% | 0.555 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -65.4 | -40 | 177.3 | -174.9 | 68.6 | 0 | 0 | 0 | 111.9 | A70 Y71 R78 | A70-L74 VanDerWaalsContact O-CB 3.24Å; A70-L74 WeakPolarHBondContact O-CB 3.21Å; A70-L74 PolarHBondContact O-N 3.46Å; Y71-L74 PolarHBondContact O-N 2.99Å; L74-R78 WeakPolarHBondContact O-CB 3.41Å; L74-R78 PolarHBondContact O-N 2.92Å |
| 75 | H | 79.3 | Confident | 83 | Confident | 104 Ų | 104 | 91.6 Ų | 91.6 | 48% | 0.481 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -66.8 | -38.8 | 176.9 | -171.9 | -86.8 | 0 | 0 | 0 | 111.6 | Y71 G72 S73 R78 T79 | Y71-H75 VanDerWaalsContact O-CB 3.23Å; Y71-H75 WeakPolarHBondContact O-CB 3.45Å; Y71-H75 PolarHBondContact O-N 3.4Å; G72-H75 PolarHBondContact O-N 3.48Å; S73-H75 PolarHBondContact O-N 2.92Å; H75-R78 PolarHBondContact O-N 3.16Å; H75-T79 PolarHBondContact CE1-OG1 3.26Å; H75-T79 VanDerWaalsContact O-CB 3.29Å; H75-T79 WeakPolarHBondContact O-CB 3.33Å; H75-T79 PolarHBondContact O-N 3.13Å; H75-T79 PolarHBondContact O-OG1 3.1Å |
| 76 | D | 81.9 | Confident | 83.3 | Confident | 111 Ų | 111 | 89.4 Ų | 89.4 | 59% | 0.594 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -65.1 | -47.5 | 176.6 | -166.9 | 53.9 | 0 | 0 | 0 | 111.5 | G72 S73 R78 T79 A80 | G72-D76 WeakPolarHBondContact O-CB 3.3Å; G72-D76 PolarHBondContact O-N 3.34Å; S73-D76 PolarHBondContact O-N 2.92Å; D76-R78 VanDerWaalsContact C-N 3.34Å; D76-R78 PolarHBondContact O-N 3.47Å; D76-T79 PolarHBondContact O-N 3.17Å; D76-A80 WeakPolarHBondContact O-CB 3.03Å; D76-A80 PolarHBondContact O-N 2.95Å |
| 77 | V | 81.7 | Confident | 83.9 | Confident | 77 Ų | 77 | 88.7 Ų | 88.7 | 47% | 0.467 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -61.6 | -41.2 | 175.9 | 173.2 | 0 | 0 | 0 | 0 | 111.7 | S73 N81 | S73-V77 WeakPolarHBondContact O-CG2 3.48Å; S73-V77 PolarHBondContact O-N 3.4Å; V77-N81 WeakPolarHBondContact O-CB 3.47Å; V77-N81 VanDerWaalsContact O-CG 3.25Å; V77-N81 PolarHBondContact O-N 3.38Å; V77-N81 PolarHBondContact O-ND2 2.93Å; V77-N81 VanDerWaalsContact O-ND2 3.08Å |
| 78 | R | 82.5 | Confident | 84.5 | Confident | 163 Ų | 163 | 85.9 Ų | 85.9 | 62% | 0.615 | 47% | 0.467 | S | S | * | . | H | α-helix | trans | -64.4 | -45.3 | 176.2 | -178.4 | 175 | -73.7 | 173.8 | -2.5 | 111.4 | L74 H75 D76 N81 L82 | L74-R78 WeakPolarHBondContact O-CB 3.41Å; L74-R78 PolarHBondContact O-N 2.92Å; H75-R78 PolarHBondContact O-N 3.16Å; D76-R78 VanDerWaalsContact C-N 3.34Å; D76-R78 PolarHBondContact O-N 3.47Å; R78-N81 PolarHBondContact O-N 3.21Å; R78-L82 HydrophobicContact CG-CD1 4.41Å; R78-L82 WeakPolarHBondContact O-CG 3.29Å; R78-L82 PolarHBondContact O-N 2.86Å |
| 79 | T | 85.4 | Confident | 85.3 | Confident | 49 Ų | 49 | 83.9 Ų | 83.9 | 30% | 0.301 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -62.7 | -46.1 | 178.1 | -59.2 | 0 | 0 | 0 | 0 | 111 | H75 D76 N81 L82 I83 | H75-T79 PolarHBondContact CE1-OG1 3.26Å; H75-T79 VanDerWaalsContact O-CB 3.29Å; H75-T79 WeakPolarHBondContact O-CB 3.33Å; H75-T79 PolarHBondContact O-N 3.13Å; H75-T79 PolarHBondContact O-OG1 3.1Å; D76-T79 PolarHBondContact O-N 3.17Å; T79-N81 VanDerWaalsContact C-N 3.33Å; T79-N81 PolarHBondContact O-N 3.49Å; T79-L82 PolarHBondContact O-N 2.82Å; T79-I83 HydrophobicContact CG2-CD1 3.85Å; T79-I83 HydrophobicContact CG2-CG1 4.44Å; T79-I83 VanDerWaalsContact O-CG1 3.32Å; T79-I83 WeakPolarHBondContact O-CG1 3.38Å; T79-I83 PolarHBondContact O-N 3.14Å |
| 80 | A | 85.9 | Confident | 86.1 | Confident | 51 Ų | 51 | 83.1 Ų | 83.1 | 42% | 0.421 | 43% | 0.432 | S | S | . | . | H | α-helix | trans | -59.2 | -42.3 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.2 | D76 I83 R84 | D76-A80 WeakPolarHBondContact O-CB 3.03Å; D76-A80 PolarHBondContact O-N 2.95Å; A80-I83 PolarHBondContact O-N 3.5Å; A80-R84 WeakPolarHBondContact O-CB 3.41Å; A80-R84 PolarHBondContact O-N 3.11Å |
| 81 | N | 87.8 | Confident | 87 | Confident | 67 Ų | 67 | 83.7 Ų | 83.7 | 36% | 0.358 | 43% | 0.429 | S | S | . | . | H | α-helix | trans | -64.8 | -39.8 | 176.2 | -76.5 | -33.7 | 0 | 0 | 0 | 112.6 | V77 R78 T79 R84 R85 | V77-N81 WeakPolarHBondContact O-CB 3.47Å; V77-N81 VanDerWaalsContact O-CG 3.25Å; V77-N81 PolarHBondContact O-N 3.38Å; V77-N81 PolarHBondContact O-ND2 2.93Å; V77-N81 VanDerWaalsContact O-ND2 3.08Å; R78-N81 PolarHBondContact O-N 3.21Å; T79-N81 VanDerWaalsContact C-N 3.33Å; T79-N81 PolarHBondContact O-N 3.49Å; N81-R84 PolarHBondContact O-N 2.94Å; N81-R85 VanDerWaalsContact O-CG 3.24Å; N81-R85 WeakPolarHBondContact O-CG 3.37Å; N81-R85 PolarHBondContact O-N 2.77Å |
| 82 | L | 88.8 | Confident | 87.7 | Confident | 81 Ų | 81 | 78 Ų | 78 | 42% | 0.424 | 41% | 0.412 | S | S | . | . | H | α-helix | trans | -65.2 | -44 | 174.9 | -71.2 | 173.4 | 0 | 0 | 0 | 111.7 | R78 T79 R84 R85 G86 L140 | R78-L82 HydrophobicContact CG-CD1 4.41Å; R78-L82 WeakPolarHBondContact O-CG 3.29Å; R78-L82 PolarHBondContact O-N 2.86Å; T79-L82 PolarHBondContact O-N 2.82Å; L82-R84 PolarHBondContact O-N 3.33Å; L82-R85 PolarHBondContact O-N 3.26Å; L82-G86 PolarHBondContact O-N 3.47Å; L82-L140 HydrophobicContact CD2-CD2 4.44Å |
| 83 | I | 90.3 | Very high | 88.5 | Confident | 113 Ų | 113 | 76.6 Ų | 76.6 | 58% | 0.579 | 40% | 0.397 | S | S | * | . | H | α-helix | trans | -60.4 | -46.7 | 176.3 | -68.4 | 167.6 | 0 | 0 | 0 | 110.3 | T79 A80 R85 G86 L87 | T79-I83 HydrophobicContact CG2-CD1 3.85Å; T79-I83 HydrophobicContact CG2-CG1 4.44Å; T79-I83 VanDerWaalsContact O-CG1 3.32Å; T79-I83 WeakPolarHBondContact O-CG1 3.38Å; T79-I83 PolarHBondContact O-N 3.14Å; A80-I83 PolarHBondContact O-N 3.5Å; I83-R85 VanDerWaalsContact C-N 3.35Å; I83-R85 PolarHBondContact O-N 2.86Å; I83-G86 PolarHBondContact O-N 3.44Å; I83-L87 WeakPolarHBondContact O-CB 3.31Å; I83-L87 PolarHBondContact O-N 3.37Å |
| 84 | R | 91 | Very high | 89.2 | Confident | 186 Ų | 186 | 73.9 Ų | 73.9 | 70% | 0.702 | 38% | 0.379 | S | S | * | . | H | α-helix | trans | -58.5 | -46 | 178.2 | -168.3 | -176.1 | -157.7 | -172.6 | 6.5 | 111.7 | A80 N81 L82 L87 V88 | A80-R84 WeakPolarHBondContact O-CB 3.41Å; A80-R84 PolarHBondContact O-N 3.11Å; N81-R84 PolarHBondContact O-N 2.94Å; L82-R84 PolarHBondContact O-N 3.33Å; R84-L87 PolarHBondContact O-N 2.88Å; R84-V88 WeakPolarHBondContact O-CG2 3.42Å; R84-V88 PolarHBondContact O-N 3.44Å |
| 85 | R | 92.4 | Very high | 89.9 | Confident | 57 Ų | 57 | 75 Ų | 75 | 22% | 0.215 | 38% | 0.38 | C | S | . | . | H | α-helix | trans | -63.3 | -44.1 | 176.8 | -70.9 | 171.8 | 179.9 | -179.5 | -2.8 | 111.6 | N81 L82 I83 L87 V88 L89 L140 L264 A265 | N81-R85 VanDerWaalsContact O-CG 3.24Å; N81-R85 WeakPolarHBondContact O-CG 3.37Å; N81-R85 PolarHBondContact O-N 2.77Å; L82-R85 PolarHBondContact O-N 3.26Å; I83-R85 VanDerWaalsContact C-N 3.35Å; I83-R85 PolarHBondContact O-N 2.86Å; R85-L87 VanDerWaalsContact C-N 3.34Å; R85-L87 PolarHBondContact O-N 2.89Å; R85-V88 PolarHBondContact O-N 3.43Å; R85-L89 WeakPolarHBondContact O-CB 3.27Å; R85-L89 WeakPolarHBondContact O-CG 3.46Å; R85-L89 PolarHBondContact O-N 3.2Å; R85-L140 HydrophobicContact CB-CD2 3.98Å; R85-L264 HydrophobicContact CG-CB 4.22Å; R85-L264 VanDerWaalsContact CZ-O 3.28Å; R85-L264 PolarHBondContact NE-O 2.76Å; R85-L264 PolarHBondContact NH2-O 2.92Å; R85-L264 VanDerWaalsContact NH2-O 3.15Å; R85-A265 VanDerWaalsContact CZ-CA 3.43Å; R85-A265 PolarHBondContact NH2-O 3.41Å |
| 86 | G | 93.4 | Very high | 90.5 | Very high | 10 Ų | 10 | 70.7 Ų | 70.7 | 10% | 0.103 | 36% | 0.36 | C | S | . | . | H | α-helix | trans | -58.9 | -43.5 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | L82 I83 L89 F90 | L82-G86 PolarHBondContact O-N 3.47Å; I83-G86 PolarHBondContact O-N 3.44Å; G86-L89 PolarHBondContact O-N 3.49Å; G86-F90 VanDerWaalsContact O-CB 3.3Å; G86-F90 WeakPolarHBondContact O-CB 3.37Å; G86-F90 PolarHBondContact O-N 2.86Å |
| 87 | L | 94.8 | Very high | 90.8 | Very high | 110 Ų | 110 | 66 Ų | 66 | 58% | 0.576 | 34% | 0.337 | S | S | * | . | H | α-helix | trans | -65.1 | -42.2 | 178.1 | -172.1 | 69.2 | 0 | 0 | 0 | 112.3 | I83 R84 R85 F90 T91 | I83-L87 WeakPolarHBondContact O-CB 3.31Å; I83-L87 PolarHBondContact O-N 3.37Å; R84-L87 PolarHBondContact O-N 2.88Å; R85-L87 VanDerWaalsContact C-N 3.34Å; R85-L87 PolarHBondContact O-N 2.89Å; L87-F90 PolarHBondContact O-N 3.36Å; L87-T91 WeakPolarHBondContact O-CG2 3.44Å; L87-T91 PolarHBondContact O-N 3.19Å; L87-T91 PolarHBondContact O-OG1 3.31Å |
| 88 | V | 94.4 | Very high | 91.1 | Very high | 56 Ų | 56 | 65.2 Ų | 65.2 | 34% | 0.339 | 33% | 0.329 | S | S | . | . | H | α-helix | trans | -63.9 | -44.9 | 175.2 | 174.8 | 0 | 0 | 0 | 0 | 110.6 | R84 R85 F90 T91 V92 L264 | R84-V88 WeakPolarHBondContact O-CG2 3.42Å; R84-V88 PolarHBondContact O-N 3.44Å; R85-V88 PolarHBondContact O-N 3.43Å; V88-F90 VanDerWaalsContact C-N 3.33Å; V88-F90 PolarHBondContact O-N 2.83Å; V88-T91 WeakPolarHBondContact CA-OG1 3.37Å; V88-T91 PolarHBondContact O-N 3.07Å; V88-T91 PolarHBondContact O-OG1 3.45Å; V88-V92 HydrophobicContact CG1-CG2 4.33Å; V88-V92 WeakPolarHBondContact O-CB 3.44Å; V88-V92 VanDerWaalsContact O-CG2 3.26Å; V88-V92 WeakPolarHBondContact O-CG2 3.29Å; V88-V92 PolarHBondContact O-N 2.94Å; V88-L264 HydrophobicContact CB-CD1 4.16Å; V88-L264 HydrophobicContact CG1-CD1 3.79Å; V88-L264 HydrophobicContact CG1-CD2 4.08Å |
| 89 | L | 95.1 | Very high | 91.4 | Very high | 2 Ų | 2 | 59.4 Ų | 59.4 | 1% | 0.01 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -63.4 | -39.8 | 176.8 | -74.4 | 162.6 | 0 | 0 | 0 | 112.3 | R85 G86 G93 A136 L140 V257 I260 L264 | R85-L89 WeakPolarHBondContact O-CB 3.27Å; R85-L89 WeakPolarHBondContact O-CG 3.46Å; R85-L89 PolarHBondContact O-N 3.2Å; G86-L89 PolarHBondContact O-N 3.49Å; L89-G93 PolarHBondContact O-N 2.88Å; L89-A136 HydrophobicContact CB-CB 4.37Å; L89-L140 HydrophobicContact CD1-CD2 4.25Å; L89-L140 HydrophobicContact CD1-CG 4.13Å; L89-V257 HydrophobicContact CD2-CG1 4Å; L89-I260 HydrophobicContact CD2-CB 4.1Å; L89-I260 HydrophobicContact CD2-CG2 3.78Å; L89-L264 HydrophobicContact CD1-CD1 4.48Å; L89-L264 HydrophobicContact CD2-CD1 4.04Å; L89-L264 HydrophobicContact CG-CD1 3.81Å |
| 90 | F | 96.4 | Very high | 91.4 | Very high | 68 Ų | 68 | 57.9 Ų | 57.9 | 30% | 0.298 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -61 | -51 | 176.4 | 176.7 | -91.1 | 0 | 0 | 0 | 111.6 | G86 L87 V88 G93 A94 G132 A136 | G86-F90 VanDerWaalsContact O-CB 3.3Å; G86-F90 WeakPolarHBondContact O-CB 3.37Å; G86-F90 PolarHBondContact O-N 2.86Å; L87-F90 PolarHBondContact O-N 3.36Å; V88-F90 VanDerWaalsContact C-N 3.33Å; V88-F90 PolarHBondContact O-N 2.83Å; F90-G93 PolarHBondContact O-N 3.44Å; F90-A94 WeakPolarHBondContact O-CB 2.87Å; F90-A94 PolarHBondContact O-N 3.38Å; F90-G132 WeakPolarHBondContact CA-O 3.42Å; F90-G132 WeakPolarHBondContact O-CA 3.36Å; F90-A136 HydrophobicContact CB-CB 4.25Å |
| 91 | T | 93.9 | Very high | 91.2 | Very high | 74 Ų | 74 | 57.1 Ų | 57.1 | 45% | 0.454 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -64.6 | -44.1 | -178.9 | 49.8 | 0 | 0 | 0 | 0 | 111.8 | L87 V88 A94 F95 | L87-T91 WeakPolarHBondContact O-CG2 3.44Å; L87-T91 PolarHBondContact O-N 3.19Å; L87-T91 PolarHBondContact O-OG1 3.31Å; V88-T91 WeakPolarHBondContact CA-OG1 3.37Å; V88-T91 PolarHBondContact O-N 3.07Å; V88-T91 PolarHBondContact O-OG1 3.45Å; T91-A94 PolarHBondContact O-N 3.31Å; T91-F95 VanDerWaalsContact O-CB 3.31Å; T91-F95 WeakPolarHBondContact O-CB 3.22Å; T91-F95 PolarHBondContact O-N 3.34Å |
| 92 | V | 94.3 | Very high | 90.8 | Very high | 45 Ų | 45 | 57.1 Ų | 57.1 | 27% | 0.273 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -64 | -42.4 | 175.7 | 173.8 | 0 | 0 | 0 | 0 | 111.3 | V88 F95 L96 I260 | V88-V92 HydrophobicContact CG1-CG2 4.33Å; V88-V92 WeakPolarHBondContact O-CB 3.44Å; V88-V92 VanDerWaalsContact O-CG2 3.26Å; V88-V92 WeakPolarHBondContact O-CG2 3.29Å; V88-V92 PolarHBondContact O-N 2.94Å; V92-F95 PolarHBondContact O-N 2.88Å; V92-L96 HydrophobicContact CG1-CD1 4.01Å; V92-L96 HydrophobicContact CG1-CG 4.44Å; V92-L96 WeakPolarHBondContact O-CB 3.39Å; V92-L96 WeakPolarHBondContact O-CG 3.5Å; V92-L96 PolarHBondContact O-N 3.06Å; V92-I260 HydrophobicContact CG1-CD1 3.94Å |
| 93 | G | 93.9 | Very high | 90.3 | Very high | 6 Ų | 6 | 55.8 Ų | 55.8 | 6% | 0.062 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -63.3 | -45.1 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112.9 | L89 F90 L96 A97 | L89-G93 PolarHBondContact O-N 2.88Å; F90-G93 PolarHBondContact O-N 3.44Å; G93-L96 PolarHBondContact O-N 3.11Å; G93-A97 WeakPolarHBondContact O-CB 3.44Å; G93-A97 PolarHBondContact O-N 3.26Å |
| 94 | A | 92.9 | Very high | 89.4 | Confident | 15 Ų | 15 | 53.2 Ų | 53.2 | 12% | 0.124 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -64.2 | -42.2 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.7 | F90 T91 A97 L98 P128 | F90-A94 WeakPolarHBondContact O-CB 2.87Å; F90-A94 PolarHBondContact O-N 3.38Å; T91-A94 PolarHBondContact O-N 3.31Å; A94-A97 PolarHBondContact O-N 2.81Å; A94-L98 WeakPolarHBondContact O-CG 3.5Å; A94-L98 PolarHBondContact O-N 3.33Å; A94-P128 HydrophobicContact CB-CB 4.39Å |
| 95 | F | 92.1 | Very high | 88.3 | Confident | 131 Ų | 131 | 46.5 Ų | 46.5 | 58% | 0.575 | 25% | 0.247 | S | C | * | . | H | α-helix | trans | -62.2 | -47 | 175.7 | 176.8 | -101.1 | 0 | 0 | 0 | 112 | T91 V92 A97 L98 V99 | T91-F95 VanDerWaalsContact O-CB 3.31Å; T91-F95 WeakPolarHBondContact O-CB 3.22Å; T91-F95 PolarHBondContact O-N 3.34Å; V92-F95 PolarHBondContact O-N 2.88Å; F95-A97 VanDerWaalsContact C-N 3.32Å; F95-A97 PolarHBondContact O-N 3.33Å; F95-L98 WeakPolarHBondContact O-CB 3.27Å; F95-L98 PolarHBondContact O-N 2.96Å; F95-V99 HydrophobicContact CD1-CG2 4.24Å; F95-V99 HydrophobicContact CE1-CG2 3.76Å; F95-V99 HydrophobicContact CE2-CG2 4.13Å; F95-V99 HydrophobicContact CZ-CG2 3.7Å; F95-V99 WeakPolarHBondContact O-CG2 3.36Å; F95-V99 PolarHBondContact O-N 2.87Å |
| 96 | L | 91.4 | Very high | 86.9 | Confident | 13 Ų | 13 | 49.8 Ų | 49.8 | 7% | 0.068 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -59.5 | -44.4 | 175.7 | -75.2 | 171.1 | 0 | 0 | 0 | 111 | V92 G93 L98 V99 L100 I166 V170 | V92-L96 HydrophobicContact CG1-CD1 4.01Å; V92-L96 HydrophobicContact CG1-CG 4.44Å; V92-L96 WeakPolarHBondContact O-CB 3.39Å; V92-L96 WeakPolarHBondContact O-CG 3.5Å; V92-L96 PolarHBondContact O-N 3.06Å; G93-L96 PolarHBondContact O-N 3.11Å; L96-L98 VanDerWaalsContact C-N 3.31Å; L96-L98 PolarHBondContact O-N 3.39Å; L96-V99 PolarHBondContact O-N 3.43Å; L96-V99 VanDerWaalsContact O-N 3.16Å; L96-L100 VanDerWaalsContact O-CG 3.27Å; L96-L100 WeakPolarHBondContact O-CG 3.43Å; L96-L100 PolarHBondContact O-N 2.84Å; L96-I166 HydrophobicContact CD2-CG2 3.76Å; L96-V170 HydrophobicContact CD2-CG2 4.23Å |
| 97 | A | 89.3 | Confident | 85.4 | Confident | 13 Ų | 13 | 55.5 Ų | 55.5 | 11% | 0.107 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -58.5 | -42 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | G93 A94 F95 L100 N101 C131 | G93-A97 WeakPolarHBondContact O-CB 3.44Å; G93-A97 PolarHBondContact O-N 3.26Å; A94-A97 PolarHBondContact O-N 2.81Å; F95-A97 VanDerWaalsContact C-N 3.32Å; F95-A97 PolarHBondContact O-N 3.33Å; A97-L100 PolarHBondContact O-N 3.42Å; A97-N101 VanDerWaalsContact O-CB 3.27Å; A97-N101 WeakPolarHBondContact O-CB 3.37Å; A97-N101 PolarHBondContact O-N 2.76Å; A97-C131 HydrophobicContact CB-CB 3.57Å |
| 98 | L | 87.6 | Confident | 83.5 | Confident | 59 Ų | 59 | 56.5 Ų | 56.5 | 31% | 0.309 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -62.1 | -46.7 | 174.2 | -71.7 | 170.7 | 0 | 0 | 0 | 111.8 | A94 F95 L96 L100 N101 L102 L121 P128 | A94-L98 WeakPolarHBondContact O-CG 3.5Å; A94-L98 PolarHBondContact O-N 3.33Å; F95-L98 WeakPolarHBondContact O-CB 3.27Å; F95-L98 PolarHBondContact O-N 2.96Å; L96-L98 VanDerWaalsContact C-N 3.31Å; L96-L98 PolarHBondContact O-N 3.39Å; L98-L100 PolarHBondContact O-N 2.92Å; L98-N101 PolarHBondContact O-N 3.47Å; L98-L102 VanDerWaalsContact O-CG 3.31Å; L98-L102 WeakPolarHBondContact O-CG 3.45Å; L98-L102 PolarHBondContact O-N 2.84Å; L98-L121 HydrophobicContact CD2-CD2 3.86Å; L98-P128 HydrophobicContact CD2-CB 4.11Å; L98-P128 HydrophobicContact CD2-CG 3.49Å; L98-P128 VanDerWaalsContact CD2-CG 3.49Å; L98-P128 HydrophobicContact CG-CB 4.06Å; L98-P128 HydrophobicContact CG-CG 3.99Å |
| 99 | V | 87.6 | Confident | 81.3 | Confident | 41 Ų | 41 | 56.9 Ų | 56.9 | 25% | 0.248 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -60 | -47 | 178.1 | 170.8 | 0 | 0 | 0 | 0 | 111.1 | F95 L96 N101 L102 L103 | F95-V99 HydrophobicContact CD1-CG2 4.24Å; F95-V99 HydrophobicContact CE1-CG2 3.76Å; F95-V99 HydrophobicContact CE2-CG2 4.13Å; F95-V99 HydrophobicContact CZ-CG2 3.7Å; F95-V99 WeakPolarHBondContact O-CG2 3.36Å; F95-V99 PolarHBondContact O-N 2.87Å; L96-V99 PolarHBondContact O-N 3.43Å; L96-V99 VanDerWaalsContact O-N 3.16Å; V99-N101 VanDerWaalsContact C-N 3.34Å; V99-N101 PolarHBondContact O-N 2.94Å; V99-L102 PolarHBondContact O-N 2.66Å; V99-L103 HydrophobicContact CG1-CD1 4.02Å; V99-L103 HydrophobicContact CG1-CG 4.48Å; V99-L103 VanDerWaalsContact O-CG 3.31Å; V99-L103 WeakPolarHBondContact O-CG 3.47Å; V99-L103 PolarHBondContact O-N 2.89Å |
| 100 | L | 85.9 | Confident | 78.7 | Confident | 18 Ų | 18 | 61.8 Ų | 61.8 | 9% | 0.094 | 32% | 0.321 | C | S | . | . | H | α-helix | trans | -61.9 | -43.9 | 177.9 | -63.1 | -171.9 | 0 | 0 | 0 | 111.2 | L96 A97 L98 L102 L103 Q104 F169 V170 N173 | L96-L100 VanDerWaalsContact O-CG 3.27Å; L96-L100 WeakPolarHBondContact O-CG 3.43Å; L96-L100 PolarHBondContact O-N 2.84Å; A97-L100 PolarHBondContact O-N 3.42Å; L98-L100 PolarHBondContact O-N 2.92Å; L100-L102 PolarHBondContact O-N 2.69Å; L100-L103 PolarHBondContact O-N 3.26Å; L100-Q104 WeakPolarHBondContact O-CB 3.35Å; L100-Q104 WeakPolarHBondContact O-CG 3.37Å; L100-Q104 PolarHBondContact O-N 2.98Å; L100-F169 HydrophobicContact CD1-CE1 3.7Å; L100-F169 HydrophobicContact CD1-CZ 3.58Å; L100-V170 HydrophobicContact CD2-CB 4.37Å; L100-V170 HydrophobicContact CD2-CG1 4.33Å; L100-V170 HydrophobicContact CD2-CG2 4.06Å; L100-N173 HydrophobicContact CD1-CB 4.29Å; L100-N173 HydrophobicContact CD2-CB 3.66Å; L100-N173 HydrophobicContact CG-CB 4.47Å |
| 101 | N | 81.4 | Confident | 76.2 | Confident | 34 Ų | 34 | 65.6 Ų | 65.6 | 18% | 0.182 | 34% | 0.344 | C | S | . | . | H | α-helix | trans | -61.8 | -44.2 | 177.6 | -169.9 | 34.6 | 0 | 0 | 0 | 111.7 | A97 L98 V99 L103 Q104 I105 | A97-N101 VanDerWaalsContact O-CB 3.27Å; A97-N101 WeakPolarHBondContact O-CB 3.37Å; A97-N101 PolarHBondContact O-N 2.76Å; L98-N101 PolarHBondContact O-N 3.47Å; V99-N101 VanDerWaalsContact C-N 3.34Å; V99-N101 PolarHBondContact O-N 2.94Å; N101-L103 PolarHBondContact O-N 3.48Å; N101-Q104 PolarHBondContact O-N 3.02Å; N101-I105 WeakPolarHBondContact O-CD1 3.36Å; N101-I105 VanDerWaalsContact O-CG1 3.25Å; N101-I105 WeakPolarHBondContact O-CG1 3.26Å; N101-I105 PolarHBondContact O-N 2.89Å |
| 102 | L | 79.5 | Confident | 74 | Confident | 67 Ų | 67 | 69.6 Ų | 69.6 | 35% | 0.351 | 36% | 0.355 | S | S | . | . | H | α-helix | trans | -61.9 | -42.9 | 175.8 | -71.1 | 174.3 | 0 | 0 | 0 | 111.9 | L98 V99 L100 Q104 I105 Q106 M117 | L98-L102 VanDerWaalsContact O-CG 3.31Å; L98-L102 WeakPolarHBondContact O-CG 3.45Å; L98-L102 PolarHBondContact O-N 2.84Å; V99-L102 PolarHBondContact O-N 2.66Å; L100-L102 PolarHBondContact O-N 2.69Å; L102-Q104 VanDerWaalsContact C-N 3.3Å; L102-Q104 PolarHBondContact O-N 3.02Å; L102-I105 PolarHBondContact O-N 3.14Å; L102-Q106 WeakPolarHBondContact O-CB 3.42Å; L102-Q106 WeakPolarHBondContact O-CG 3.34Å; L102-Q106 PolarHBondContact O-N 2.73Å; L102-M117 HydrophobicContact CD2-CG 4.5Å; L102-M117 HydrophobicContact CD2-SD 4.13Å |
| 103 | L | 79.3 | Confident | 72 | Confident | 53 Ų | 53 | 71 Ų | 71 | 28% | 0.277 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -64.8 | -34.8 | 177 | -71.4 | 173.5 | 0 | 0 | 0 | 112.5 | V99 L100 N101 V170 | V99-L103 HydrophobicContact CG1-CD1 4.02Å; V99-L103 HydrophobicContact CG1-CG 4.48Å; V99-L103 VanDerWaalsContact O-CG 3.31Å; V99-L103 WeakPolarHBondContact O-CG 3.47Å; V99-L103 PolarHBondContact O-N 2.89Å; L100-L103 PolarHBondContact O-N 3.26Å; N101-L103 PolarHBondContact O-N 3.48Å; L103-V170 HydrophobicContact CD1-CG1 3.56Å |
| 104 | Q | 71.2 | Confident | 70.3 | Confident | 60 Ų | 60 | 78.2 Ų | 78.2 | 28% | 0.28 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -68.3 | -39.8 | 174.5 | -72.6 | 173.5 | -18.8 | 0 | 0 | 111.5 | L100 N101 L102 N173 V177 | L100-Q104 WeakPolarHBondContact O-CB 3.35Å; L100-Q104 WeakPolarHBondContact O-CG 3.37Å; L100-Q104 PolarHBondContact O-N 2.98Å; N101-Q104 PolarHBondContact O-N 3.02Å; L102-Q104 VanDerWaalsContact C-N 3.3Å; L102-Q104 PolarHBondContact O-N 3.02Å; Q104-N173 PolarHBondContact NE2-ND2 3.32Å; Q104-V177 HydrophobicContact CB-CG2 4.43Å; Q104-V177 HydrophobicContact CG-CG2 3.7Å |
| 105 | I | 67.3 | Low | 68.6 | Low | 45 Ų | 45 | 84.3 Ų | 84.3 | 23% | 0.231 | 42% | 0.423 | C | S | . | . | H | α-helix | trans | -74.8 | -45.8 | -178.4 | -67.5 | 163.7 | 0 | 0 | 0 | 112.5 | N101 L102 R107 N108 L120 | N101-I105 WeakPolarHBondContact O-CD1 3.36Å; N101-I105 VanDerWaalsContact O-CG1 3.25Å; N101-I105 WeakPolarHBondContact O-CG1 3.26Å; N101-I105 PolarHBondContact O-N 2.89Å; L102-I105 PolarHBondContact O-N 3.14Å; I105-R107 PolarHBondContact O-N 3.23Å; I105-N108 PolarHBondContact O-N 3.3Å; I105-N108 VanDerWaalsContact O-N 3.09Å; I105-L120 HydrophobicContact CD1-CB 4.45Å; I105-L120 HydrophobicContact CD1-CD1 3.92Å; I105-L120 HydrophobicContact CG1-CD1 4.15Å |
| 106 | Q | 64.3 | Low | 67 | Low | 125 Ų | 125 | 81.3 Ų | 81.3 | 58% | 0.584 | 42% | 0.415 | S | S | * | . | H | α-helix | trans | -56.2 | -21.9 | -177.3 | -76 | -76.7 | -24 | 0 | 0 | 113.8 | L102 | L102-Q106 WeakPolarHBondContact O-CB 3.42Å; L102-Q106 WeakPolarHBondContact O-CG 3.34Å; L102-Q106 PolarHBondContact O-N 2.73Å |
| 107 | R | 61.3 | Low | 65.4 | Low | 131 Ų | 131 | 84.1 Ų | 84.1 | 49% | 0.494 | 43% | 0.429 | S | S | . | . | H | α-helix | trans | -97 | -27.2 | 179.1 | -76.8 | -68.8 | -65.3 | 176.9 | -0.8 | 114.4 | I105 V109 V177 | I105-R107 PolarHBondContact O-N 3.23Å; R107-V109 PolarHBondContact O-N 2.92Å; R107-V177 HydrophobicContact CB-CG1 4.19Å |
| 108 | N | 54.1 | Low | 63.9 | Low | 131 Ų | 131 | 87.5 Ų | 87.5 | 70% | 0.701 | 45% | 0.448 | S | S | * | . | H | α-helix | trans | -70.5 | -24.5 | 179.3 | -152.7 | -16.4 | 0 | 0 | 0 | 110.9 | I105 | I105-N108 PolarHBondContact O-N 3.3Å; I105-N108 VanDerWaalsContact O-N 3.09Å |
| 109 | V | 47.8 | Very low | 62.6 | Low | 63 Ų | 63 | 88.9 Ų | 88.9 | 38% | 0.382 | 46% | 0.459 | S | S | . | . | trans | -143.8 | 101.9 | 170.5 | -165.1 | 0 | 0 | 0 | 0 | 112.1 | R107 L111 F112 | R107-V109 PolarHBondContact O-N 2.92Å; V109-L111 WeakPolarHBondContact CG1-O 3.49Å; V109-L111 PolarHBondContact O-N 2.84Å; V109-L111 VanDerWaalsContact O-N 3.09Å; V109-F112 HydrophobicContact CB-CB 4.43Å; V109-F112 HydrophobicContact CB-CD2 3.56Å; V109-F112 HydrophobicContact CB-CE2 4.13Å; V109-F112 HydrophobicContact CB-CG 4.4Å; V109-F112 HydrophobicContact CG1-CB 3.97Å; V109-F112 HydrophobicContact CG1-CD2 2.92Å; V109-F112 HydrophobicContact CG1-CE2 3.3Å; V109-F112 HydrophobicContact CG1-CG 3.64Å; V109-F112 HydrophobicContact CG1-CZ 4.33Å; V109-F112 HydrophobicContact CG2-CD2 3.61Å; V109-F112 HydrophobicContact CG2-CE2 3.92Å | ||
| 110 | T | 40.4 | Very low | 61.2 | Low | 106 Ų | 106 | 90.4 Ų | 90.4 | 65% | 0.65 | 47% | 0.466 | S | S | * | . | S | Bend | trans | -73.2 | 8.6 | 174.8 | 48.9 | 0 | 0 | 0 | 0 | 113.9 | ||
| 111 | L | 45.1 | Very low | 60 | Low | 147 Ų | 147 | 93.1 Ų | 93.1 | 77% | 0.77 | 48% | 0.48 | S | S | * | . | S | Bend | trans | -151.9 | 81.5 | 176.9 | -71.3 | 174.7 | 0 | 0 | 0 | 110.5 | V109 | V109-L111 WeakPolarHBondContact CG1-O 3.49Å; V109-L111 PolarHBondContact O-N 2.84Å; V109-L111 VanDerWaalsContact O-N 3.09Å |
| 112 | F | 47 | Very low | 59 | Low | 159 Ų | 159 | 95.7 Ų | 95.7 | 70% | 0.697 | 50% | 0.501 | S | S | * | . | trans | -150.3 | 151.1 | 164.7 | -89.7 | -40.1 | 0 | 0 | 0 | 115.4 | V109 | V109-F112 HydrophobicContact CB-CB 4.43Å; V109-F112 HydrophobicContact CB-CD2 3.56Å; V109-F112 HydrophobicContact CB-CE2 4.13Å; V109-F112 HydrophobicContact CB-CG 4.4Å; V109-F112 HydrophobicContact CG1-CB 3.97Å; V109-F112 HydrophobicContact CG1-CD2 2.92Å; V109-F112 HydrophobicContact CG1-CE2 3.3Å; V109-F112 HydrophobicContact CG1-CG 3.64Å; V109-F112 HydrophobicContact CG1-CZ 4.33Å; V109-F112 HydrophobicContact CG2-CD2 3.61Å; V109-F112 HydrophobicContact CG2-CE2 3.92Å | ||
| 113 | P | 52.7 | Low | 58 | Low | 74 Ų | 74 | 96.6 Ų | 96.6 | 48% | 0.481 | 51% | 0.513 | S | S | . | . | trans | -74.4 | 161.6 | -171.3 | 32 | -36.9 | 0 | 0 | 0 | 113.4 | E115 V116 | P113-E115 PolarHBondContact O-N 2.89Å; P113-V116 PolarHBondContact O-N 3.15Å | ||
| 114 | E | 57.3 | Low | 57.6 | Low | 158 Ų | 158 | 95 Ų | 95 | 74% | 0.738 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -51.4 | -23.4 | -174.6 | -71.7 | -146.5 | 144.4 | 0 | 0 | 115.5 | V116 M117 T118 | E114-V116 PolarHBondContact O-N 3.39Å; E114-M117 PolarHBondContact O-N 2.93Å; E114-T118 PolarHBondContact O-N 2.95Å |
| 115 | E | 58.1 | Low | 57.9 | Low | 142 Ų | 142 | 100.9 Ų | 100.9 | 66% | 0.664 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -62.6 | -35.2 | -176.2 | -67.4 | 170.8 | 170 | 0 | 0 | 113.7 | P113 T118 T119 | P113-E115 PolarHBondContact O-N 2.89Å; E115-T118 PolarHBondContact O-OG1 3.34Å; E115-T119 PolarHBondContact O-N 2.89Å; E115-T119 VanDerWaalsContact O-N 3.16Å; E115-T119 PolarHBondContact O-OG1 3.02Å |
| 116 | V | 58.6 | Low | 58.6 | Low | 68 Ų | 68 | 102.3 Ų | 102.3 | 41% | 0.412 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -73.7 | -34.6 | -178.7 | -177.8 | 0 | 0 | 0 | 0 | 111.9 | P113 E114 T118 T119 L120 | P113-V116 PolarHBondContact O-N 3.15Å; E114-V116 PolarHBondContact O-N 3.39Å; V116-T118 VanDerWaalsContact C-N 3.35Å; V116-T118 PolarHBondContact O-N 3.06Å; V116-T119 PolarHBondContact O-N 3.23Å; V116-L120 HydrophobicContact CG1-CD1 4.22Å; V116-L120 PolarHBondContact O-N 3.24Å |
| 117 | M | 57.9 | Low | 59.6 | Low | 72 Ų | 72 | 98.1 Ų | 98.1 | 36% | 0.355 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -64.9 | -41.3 | 178.3 | -172.8 | 169.3 | 63.4 | 0 | 0 | 111.1 | L102 E114 L121 | L102-M117 HydrophobicContact CD2-CG 4.5Å; L102-M117 HydrophobicContact CD2-SD 4.13Å; E114-M117 PolarHBondContact O-N 2.93Å; M117-L121 HydrophobicContact CG-CD1 4.15Å; M117-L121 WeakPolarHBondContact O-CB 3.36Å; M117-L121 WeakPolarHBondContact O-CG 3.26Å; M117-L121 PolarHBondContact O-N 2.79Å; M117-L121 VanDerWaalsContact O-N 3.07Å |
| 118 | T | 58.4 | Low | 60.9 | Low | 84 Ų | 84 | 92.7 Ų | 92.7 | 52% | 0.515 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -68.6 | -35.8 | 175.9 | 65.8 | 0 | 0 | 0 | 0 | 112.2 | E114 E115 V116 S122 | E114-T118 PolarHBondContact O-N 2.95Å; E115-T118 PolarHBondContact O-OG1 3.34Å; V116-T118 VanDerWaalsContact C-N 3.35Å; V116-T118 PolarHBondContact O-N 3.06Å; T118-S122 WeakPolarHBondContact O-CB 3.39Å; T118-S122 PolarHBondContact O-N 3.43Å |
| 119 | T | 58.8 | Low | 62.5 | Low | 88 Ų | 88 | 89 Ų | 89 | 54% | 0.54 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -72.5 | -39.5 | -178.6 | -54.1 | 0 | 0 | 0 | 0 | 112 | E115 V116 S122 S123 | E115-T119 PolarHBondContact O-N 2.89Å; E115-T119 VanDerWaalsContact O-N 3.16Å; E115-T119 PolarHBondContact O-OG1 3.02Å; V116-T119 PolarHBondContact O-N 3.23Å; T119-S122 PolarHBondContact O-N 2.97Å; T119-S123 WeakPolarHBondContact O-CB 3.27Å; T119-S123 PolarHBondContact O-N 3.36Å |
| 120 | L | 57.9 | Low | 64.5 | Low | 73 Ų | 73 | 89.3 Ų | 89.3 | 38% | 0.382 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -73.6 | -38.4 | 174.6 | -73.9 | 175.6 | 0 | 0 | 0 | 112.6 | I105 V116 S122 S123 A124 | I105-L120 HydrophobicContact CD1-CB 4.45Å; I105-L120 HydrophobicContact CD1-CD1 3.92Å; I105-L120 HydrophobicContact CG1-CD1 4.15Å; V116-L120 HydrophobicContact CG1-CD1 4.22Å; V116-L120 PolarHBondContact O-N 3.24Å; L120-S122 PolarHBondContact O-N 3.45Å; L120-S123 PolarHBondContact O-N 2.85Å; L120-A124 WeakPolarHBondContact O-CA 3.47Å; L120-A124 VanDerWaalsContact O-CB 3.25Å; L120-A124 WeakPolarHBondContact O-CB 3.45Å; L120-A124 PolarHBondContact O-N 3.47Å |
| 121 | L | 60.9 | Low | 66.9 | Low | 75 Ų | 75 | 86.9 Ų | 86.9 | 39% | 0.393 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -61.6 | -34.6 | 170.9 | -79.9 | 167 | 0 | 0 | 0 | 111.6 | L98 M117 W125 | L98-L121 HydrophobicContact CD2-CD2 3.86Å; M117-L121 HydrophobicContact CG-CD1 4.15Å; M117-L121 WeakPolarHBondContact O-CB 3.36Å; M117-L121 WeakPolarHBondContact O-CG 3.26Å; M117-L121 PolarHBondContact O-N 2.79Å; M117-L121 VanDerWaalsContact O-N 3.07Å; L121-W125 VanDerWaalsContact O-CA 3.3Å; L121-W125 WeakPolarHBondContact O-CA 3.38Å; L121-W125 VanDerWaalsContact O-CB 3.25Å; L121-W125 WeakPolarHBondContact O-CB 3.47Å; L121-W125 PolarHBondContact O-N 2.97Å |
| 122 | S | 61.1 | Low | 69.1 | Low | 88 Ų | 88 | 79.9 Ų | 79.9 | 62% | 0.615 | 43% | 0.43 | S | S | * | . | H | α-helix | trans | -78.8 | -33 | 176.8 | -164.3 | 0 | 0 | 0 | 0 | 113.2 | T118 T119 L120 W125 | T118-S122 WeakPolarHBondContact O-CB 3.39Å; T118-S122 PolarHBondContact O-N 3.43Å; T119-S122 PolarHBondContact O-N 2.97Å; L120-S122 PolarHBondContact O-N 3.45Å; S122-W125 VanDerWaalsContact O-CD1 3.23Å |
| 123 | S | 59.2 | Low | 71.3 | Confident | 87 Ų | 87 | 75.9 Ų | 75.9 | 61% | 0.608 | 42% | 0.419 | S | S | * | . | H | α-helix | trans | -85 | -28.6 | -179.2 | -171.5 | 0 | 0 | 0 | 0 | 113 | T119 L120 | T119-S123 WeakPolarHBondContact O-CB 3.27Å; T119-S123 PolarHBondContact O-N 3.36Å; L120-S123 PolarHBondContact O-N 2.85Å |
| 124 | A | 69.3 | Low | 73.2 | Confident | 20 Ų | 20 | 73.8 Ų | 73.8 | 17% | 0.165 | 41% | 0.41 | C | S | . | . | S | Bend | trans | -113.9 | 22.7 | -178.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | L120 W126 I127 P128 | L120-A124 WeakPolarHBondContact O-CA 3.47Å; L120-A124 VanDerWaalsContact O-CB 3.25Å; L120-A124 WeakPolarHBondContact O-CB 3.45Å; L120-A124 PolarHBondContact O-N 3.47Å; A124-W126 PolarHBondContact O-N 2.83Å; A124-I127 HydrophobicContact CB-CD1 3.72Å; A124-I127 HydrophobicContact CB-CG1 4.13Å; A124-I127 WeakPolarHBondContact O-CB 3.3Å; A124-I127 PolarHBondContact O-N 3.4Å; A124-P128 WeakPolarHBondContact O-CD 3.49Å |
| 125 | W | 79.1 | Confident | 74.9 | Confident | 182 Ų | 182 | 66.6 Ų | 66.6 | 69% | 0.689 | 38% | 0.378 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -56.3 | -21.5 | -179.7 | 73.5 | -77.3 | 0 | 0 | 0 | 114.1 | L121 S122 P129 | L121-W125 VanDerWaalsContact O-CA 3.3Å; L121-W125 WeakPolarHBondContact O-CA 3.38Å; L121-W125 VanDerWaalsContact O-CB 3.25Å; L121-W125 WeakPolarHBondContact O-CB 3.47Å; L121-W125 PolarHBondContact O-N 2.97Å; S122-W125 VanDerWaalsContact O-CD1 3.23Å; W125-P129 WeakPolarHBondContact O-CD 3.44Å; W125-P129 WeakPolarHBondContact O-CG 3.35Å |
| 126 | W | 81.9 | Confident | 76.7 | Confident | 76 Ų | 76 | 60.5 Ų | 60.5 | 29% | 0.288 | 35% | 0.352 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -78.5 | -20 | 178.3 | 63.6 | -95.7 | 0 | 0 | 0 | 113.5 | A124 P129 C130 L226 V231 Y232 | A124-W126 PolarHBondContact O-N 2.83Å; W126-P129 WeakPolarHBondContact O-CD 3.44Å; W126-C130 HydrophobicContact CE3-CB 4.4Å; W126-C130 VanDerWaalsContact O-CB 3.3Å; W126-C130 WeakPolarHBondContact O-CB 3.22Å; W126-C130 PolarHBondContact O-N 3.42Å; W126-C130 VanDerWaalsContact O-N 3.1Å; W126-L226 HydrophobicContact CE3-CD2 4.5Å; W126-L226 HydrophobicContact CH2-CD2 3.23Å; W126-L226 HydrophobicContact CZ2-CD2 4.12Å; W126-L226 HydrophobicContact CZ3-CD2 3.46Å; W126-L226 VanDerWaalsContact CZ3-CD2 3.46Å; W126-V231 HydrophobicContact CZ2-CG1 4.2Å; W126-Y232 HydrophobicContact CH2-CD2 4.23Å; W126-Y232 HydrophobicContact CZ2-CD2 4.08Å |
| 127 | I | 83.8 | Confident | 78.4 | Confident | 36 Ų | 36 | 61.5 Ų | 61.5 | 19% | 0.185 | 36% | 0.358 | C | S | . | . | H | α-helix | trans | -66 | -51.9 | -177.5 | -59.4 | -177.9 | 0 | 0 | 0 | 111.2 | A124 C130 C131 Y232 | A124-I127 HydrophobicContact CB-CD1 3.72Å; A124-I127 HydrophobicContact CB-CG1 4.13Å; A124-I127 WeakPolarHBondContact O-CB 3.3Å; A124-I127 PolarHBondContact O-N 3.4Å; I127-C130 WeakPolarHBondContact O-CB 3.35Å; I127-C130 PolarHBondContact O-N 2.99Å; I127-C130 VanDerWaalsContact O-N 3.17Å; I127-C131 PolarHBondContact O-N 2.92Å; I127-C131 PolarHBondContact O-SG 3.36Å; I127-C131 VanDerWaalsContact O-SG 3.4Å; I127-Y232 HydrophobicContact CD1-CE2 4.01Å |
| 128 | P | 88.8 | Confident | 80 | Confident | 17 Ų | 17 | 59.4 Ų | 59.4 | 11% | 0.11 | 35% | 0.348 | C | S | . | . | H | α-helix | trans | -60.7 | -43.5 | -179.5 | -18.8 | 30.2 | 0 | 0 | 0 | 114.1 | A94 L98 A124 C130 C131 G132 | A94-P128 HydrophobicContact CB-CB 4.39Å; L98-P128 HydrophobicContact CD2-CB 4.11Å; L98-P128 HydrophobicContact CD2-CG 3.49Å; L98-P128 VanDerWaalsContact CD2-CG 3.49Å; L98-P128 HydrophobicContact CG-CB 4.06Å; L98-P128 HydrophobicContact CG-CG 3.99Å; A124-P128 WeakPolarHBondContact O-CD 3.49Å; P128-C130 PolarHBondContact O-N 2.73Å; P128-C131 PolarHBondContact O-N 3.48Å; P128-G132 PolarHBondContact O-N 3.22Å |
| 129 | P | 89.3 | Confident | 81.6 | Confident | 55 Ų | 55 | 55.5 Ų | 55.5 | 36% | 0.357 | 32% | 0.324 | S | S | . | . | H | α-helix | trans | -60.6 | -39.4 | 172.2 | -25.5 | 34.9 | 0 | 0 | 0 | 113.8 | W125 W126 G132 T133 | W125-P129 WeakPolarHBondContact O-CD 3.44Å; W125-P129 WeakPolarHBondContact O-CG 3.35Å; W126-P129 WeakPolarHBondContact O-CD 3.44Å; P129-G132 PolarHBondContact O-N 3.36Å; P129-T133 WeakPolarHBondContact O-CB 3.35Å; P129-T133 PolarHBondContact O-N 3.01Å; P129-T133 PolarHBondContact O-OG1 2.87Å |
| 130 | C | 88.8 | Confident | 83.1 | Confident | 68 Ų | 68 | 53.9 Ų | 53.9 | 46% | 0.459 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -63.9 | -47.8 | 177 | -175.1 | 0 | 0 | 0 | 0 | 111.2 | W126 I127 P128 T133 G134 | W126-C130 HydrophobicContact CE3-CB 4.4Å; W126-C130 VanDerWaalsContact O-CB 3.3Å; W126-C130 WeakPolarHBondContact O-CB 3.22Å; W126-C130 PolarHBondContact O-N 3.42Å; W126-C130 VanDerWaalsContact O-N 3.1Å; I127-C130 WeakPolarHBondContact O-CB 3.35Å; I127-C130 PolarHBondContact O-N 2.99Å; I127-C130 VanDerWaalsContact O-N 3.17Å; P128-C130 PolarHBondContact O-N 2.73Å; C130-T133 PolarHBondContact O-N 2.92Å; C130-G134 PolarHBondContact O-N 3.32Å |
| 131 | C | 90.1 | Very high | 84.6 | Confident | 55 Ų | 55 | 54 Ų | 54 | 37% | 0.372 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -64.4 | -40.7 | 176.6 | -67 | 0 | 0 | 0 | 0 | 112.3 | A97 I127 P128 G134 A135 | A97-C131 HydrophobicContact CB-CB 3.57Å; I127-C131 PolarHBondContact O-N 2.92Å; I127-C131 PolarHBondContact O-SG 3.36Å; I127-C131 VanDerWaalsContact O-SG 3.4Å; P128-C131 PolarHBondContact O-N 3.48Å; C131-G134 PolarHBondContact O-N 3.49Å; C131-A135 VanDerWaalsContact O-CB 3.29Å; C131-A135 WeakPolarHBondContact O-CB 3.35Å; C131-A135 PolarHBondContact O-N 3Å |
| 132 | G | 92.5 | Very high | 85.9 | Confident | 0 Ų | 0 | 50.5 Ų | 50.5 | 0% | 0 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -61 | -42.8 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112.2 | F90 P128 P129 A135 A136 | F90-G132 WeakPolarHBondContact CA-O 3.42Å; F90-G132 WeakPolarHBondContact O-CA 3.36Å; P128-G132 PolarHBondContact O-N 3.22Å; P129-G132 PolarHBondContact O-N 3.36Å; G132-A135 WeakPolarHBondContact O-CB 3.31Å; G132-A135 PolarHBondContact O-N 3.28Å; G132-A136 PolarHBondContact O-N 2.94Å |
| 133 | T | 92.6 | Very high | 87.1 | Confident | 75 Ų | 75 | 47.5 Ų | 47.5 | 46% | 0.46 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -65.5 | -46.4 | 177.6 | -53.3 | 0 | 0 | 0 | 0 | 111.2 | P129 C130 A135 A136 V137 | P129-T133 WeakPolarHBondContact O-CB 3.35Å; P129-T133 PolarHBondContact O-N 3.01Å; P129-T133 PolarHBondContact O-OG1 2.87Å; C130-T133 PolarHBondContact O-N 2.92Å; T133-A135 VanDerWaalsContact C-N 3.27Å; T133-A135 PolarHBondContact O-N 3.36Å; T133-A136 PolarHBondContact O-N 3.43Å; T133-V137 WeakPolarHBondContact O-CG2 3.16Å; T133-V137 PolarHBondContact O-N 3.46Å |
| 134 | G | 92.3 | Very high | 88.3 | Confident | 30 Ų | 30 | 47 Ų | 47 | 31% | 0.309 | 27% | 0.269 | S | S | . | . | H | α-helix | trans | -57.6 | -41.8 | 173.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | C130 C131 V137 I138 | C130-G134 PolarHBondContact O-N 3.32Å; C131-G134 PolarHBondContact O-N 3.49Å; G134-V137 PolarHBondContact O-N 3.49Å; G134-I138 WeakPolarHBondContact O-CB 3.49Å; G134-I138 WeakPolarHBondContact O-CD1 3.27Å; G134-I138 WeakPolarHBondContact O-CG1 3.29Å; G134-I138 PolarHBondContact O-N 3.23Å |
| 135 | A | 93.9 | Very high | 89 | Confident | 7 Ų | 7 | 48.6 Ų | 48.6 | 6% | 0.058 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -63.8 | -42.7 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.8 | C131 G132 T133 G139 V257 | C131-A135 VanDerWaalsContact O-CB 3.29Å; C131-A135 WeakPolarHBondContact O-CB 3.35Å; C131-A135 PolarHBondContact O-N 3Å; G132-A135 WeakPolarHBondContact O-CB 3.31Å; G132-A135 PolarHBondContact O-N 3.28Å; T133-A135 VanDerWaalsContact C-N 3.27Å; T133-A135 PolarHBondContact O-N 3.36Å; A135-G139 PolarHBondContact O-N 3.47Å; A135-V257 HydrophobicContact CB-CB 4.49Å; A135-V257 HydrophobicContact CB-CG1 3.75Å; A135-V257 HydrophobicContact CB-CG2 3.99Å; A135-V257 WeakPolarHBondContact O-CG1 3.25Å |
| 136 | A | 94.9 | Very high | 89.2 | Confident | 14 Ų | 14 | 40.4 Ų | 40.4 | 12% | 0.116 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -61.5 | -45.8 | 175.2 | 0 | 0 | 0 | 0 | 0 | 111.8 | L89 F90 G132 T133 L140 | L89-A136 HydrophobicContact CB-CB 4.37Å; F90-A136 HydrophobicContact CB-CB 4.25Å; G132-A136 PolarHBondContact O-N 2.94Å; T133-A136 PolarHBondContact O-N 3.43Å; A136-L140 WeakPolarHBondContact O-CB 3.25Å; A136-L140 WeakPolarHBondContact O-CG 3.38Å; A136-L140 PolarHBondContact O-N 3Å |
| 137 | V | 94.1 | Very high | 89.1 | Confident | 90 Ų | 90 | 41.4 Ų | 41.4 | 55% | 0.545 | 26% | 0.262 | S | S | . | . | H | α-helix | trans | -61.9 | -51.4 | 178.7 | 172.6 | 0 | 0 | 0 | 0 | 110.9 | T133 G134 L140 L141 | T133-V137 WeakPolarHBondContact O-CG2 3.16Å; T133-V137 PolarHBondContact O-N 3.46Å; G134-V137 PolarHBondContact O-N 3.49Å; V137-L140 PolarHBondContact O-N 3.25Å; V137-L141 WeakPolarHBondContact O-CB 3.41Å; V137-L141 PolarHBondContact O-N 3.14Å |
| 138 | I | 92.6 | Very high | 89 | Confident | 28 Ų | 28 | 47.2 Ų | 47.2 | 14% | 0.144 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -65.5 | -46.9 | -177.7 | -64.5 | 161.3 | 0 | 0 | 0 | 110.6 | G134 L140 L141 Y142 T215 | G134-I138 WeakPolarHBondContact O-CB 3.49Å; G134-I138 WeakPolarHBondContact O-CD1 3.27Å; G134-I138 WeakPolarHBondContact O-CG1 3.29Å; G134-I138 PolarHBondContact O-N 3.23Å; I138-L140 VanDerWaalsContact C-N 3.27Å; I138-L140 PolarHBondContact O-N 3.08Å; I138-L141 PolarHBondContact O-N 3.28Å; I138-L141 VanDerWaalsContact O-N 3.11Å; I138-Y142 HydrophobicContact CG2-CD2 3.67Å; I138-Y142 HydrophobicContact CG2-CE2 3.43Å; I138-Y142 VanDerWaalsContact CG2-CE2 3.43Å; I138-Y142 VanDerWaalsContact O-CD2 3.24Å; I138-Y142 WeakPolarHBondContact O-CD2 3.29Å; I138-Y142 PolarHBondContact O-N 2.99Å; I138-T215 HydrophobicContact CD1-CG2 3.4Å; I138-T215 VanDerWaalsContact CD1-CG2 3.4Å; I138-T215 HydrophobicContact CG1-CG2 4.47Å |
| 139 | G | 91.2 | Very high | 88.5 | Confident | 1 Ų | 1 | 51.4 Ų | 51.4 | 1% | 0.01 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -64.8 | -28.5 | -179.1 | 0 | 0 | 0 | 0 | 0 | 113.6 | A135 P143 G261 | A135-G139 PolarHBondContact O-N 3.47Å; G139-P143 WeakPolarHBondContact O-CD 3.42Å; G139-G261 VanDerWaalsContact O-CA 3.25Å; G139-G261 WeakPolarHBondContact O-CA 3.45Å |
| 140 | L | 91.4 | Very high | 87.4 | Confident | 55 Ų | 55 | 51.5 Ų | 51.5 | 29% | 0.288 | 32% | 0.321 | S | S | . | . | H | α-helix | trans | -81.3 | -32.1 | 171.6 | -68.7 | 174.5 | 0 | 0 | 0 | 112.7 | L82 R85 L89 A136 V137 I138 P143 C144 | L82-L140 HydrophobicContact CD2-CD2 4.44Å; R85-L140 HydrophobicContact CB-CD2 3.98Å; L89-L140 HydrophobicContact CD1-CD2 4.25Å; L89-L140 HydrophobicContact CD1-CG 4.13Å; A136-L140 WeakPolarHBondContact O-CB 3.25Å; A136-L140 WeakPolarHBondContact O-CG 3.38Å; A136-L140 PolarHBondContact O-N 3Å; V137-L140 PolarHBondContact O-N 3.25Å; I138-L140 VanDerWaalsContact C-N 3.27Å; I138-L140 PolarHBondContact O-N 3.08Å; L140-P143 WeakPolarHBondContact O-CD 3.41Å; L140-C144 PolarHBondContact O-SG 2.89Å |
| 141 | L | 89.6 | Confident | 86.2 | Confident | 76 Ų | 76 | 51.2 Ų | 51.2 | 40% | 0.398 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -70.9 | -35.5 | -179.3 | -176.9 | 60.4 | 0 | 0 | 0 | 112.7 | V137 I138 C144 L145 L211 | V137-L141 WeakPolarHBondContact O-CB 3.41Å; V137-L141 PolarHBondContact O-N 3.14Å; I138-L141 PolarHBondContact O-N 3.28Å; I138-L141 VanDerWaalsContact O-N 3.11Å; L141-C144 PolarHBondContact O-N 2.88Å; L141-L145 HydrophobicContact CD1-CD1 3.86Å; L141-L145 HydrophobicContact CD1-CG 4.05Å; L141-L145 HydrophobicContact CD2-CD1 4.25Å; L141-L145 HydrophobicContact CG-CD1 3.74Å; L141-L145 HydrophobicContact CG-CG 4.33Å; L141-L145 PolarHBondContact O-N 3.32Å; L141-L211 HydrophobicContact CD2-CD2 3.72Å; L141-L211 HydrophobicContact CG-CD2 4.2Å |
| 142 | Y | 88.2 | Confident | 84.5 | Confident | 0 Ų | 0 | 52.5 Ų | 52.5 | 0% | 0 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -56.4 | -55.7 | -179.6 | -96.4 | -118.9 | 0 | 0 | 0 | 113.3 | I138 C144 L145 D146 G208 L211 G212 G258 | I138-Y142 HydrophobicContact CG2-CD2 3.67Å; I138-Y142 HydrophobicContact CG2-CE2 3.43Å; I138-Y142 VanDerWaalsContact CG2-CE2 3.43Å; I138-Y142 VanDerWaalsContact O-CD2 3.24Å; I138-Y142 WeakPolarHBondContact O-CD2 3.29Å; I138-Y142 PolarHBondContact O-N 2.99Å; Y142-C144 VanDerWaalsContact C-N 3.28Å; Y142-C144 PolarHBondContact O-N 3.46Å; Y142-L145 PolarHBondContact O-N 3.19Å; Y142-D146 PolarHBondContact O-N 3.02Å; Y142-G208 VanDerWaalsContact CE1-CA 3.41Å; Y142-G208 PolarHBondContact OH-O 2.85Å; Y142-L211 HydrophobicContact CD1-CD1 4.3Å; Y142-L211 HydrophobicContact CD2-CB 4.08Å; Y142-L211 HydrophobicContact CD2-CD1 3.27Å; Y142-L211 HydrophobicContact CD2-CG 4.27Å; Y142-L211 HydrophobicContact CE1-CD1 4.44Å; Y142-L211 HydrophobicContact CE2-CB 3.33Å; Y142-L211 HydrophobicContact CE2-CD1 3.46Å; Y142-L211 VanDerWaalsContact CE2-CD1 3.46Å; Y142-L211 HydrophobicContact CE2-CG 4.01Å; Y142-L211 HydrophobicContact CG-CD1 3.73Å; Y142-G212 PolarHBondContact OH-N 3.43Å; Y142-G258 VanDerWaalsContact CG-CA 3.41Å |
| 143 | P | 85.3 | Confident | 82.8 | Confident | 25 Ų | 25 | 56.8 Ų | 56.8 | 16% | 0.162 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -59.2 | -36.2 | 177.4 | -24.7 | 33.2 | 0 | 0 | 0 | 113.9 | G139 L140 S147 A265 | G139-P143 WeakPolarHBondContact O-CD 3.42Å; L140-P143 WeakPolarHBondContact O-CD 3.41Å; P143-S147 PolarHBondContact O-N 3.43Å; P143-S147 VanDerWaalsContact O-N 3.08Å; P143-A265 HydrophobicContact CB-CB 3.86Å; P143-A265 HydrophobicContact CG-CB 3.78Å |
| 144 | C | 84.3 | Confident | 80.7 | Confident | 78 Ų | 78 | 61.8 Ų | 61.8 | 53% | 0.527 | 36% | 0.355 | S | S | . | . | H | α-helix | trans | -65.9 | -44.7 | 178.8 | -65.2 | 0 | 0 | 0 | 0 | 111.4 | L140 L141 Y142 S147 H148 | L140-C144 PolarHBondContact O-SG 2.89Å; L141-C144 PolarHBondContact O-N 2.88Å; Y142-C144 VanDerWaalsContact C-N 3.28Å; Y142-C144 PolarHBondContact O-N 3.46Å; C144-S147 PolarHBondContact O-N 3.39Å; C144-H148 PolarHBondContact O-N 2.62Å |
| 145 | L | 84.8 | Confident | 78.7 | Confident | 53 Ų | 53 | 68.2 Ų | 68.2 | 28% | 0.277 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -72.6 | -34.5 | 179.2 | -75.2 | 173.3 | 0 | 0 | 0 | 112.8 | L141 Y142 S147 H148 L149 L211 | L141-L145 HydrophobicContact CD1-CD1 3.86Å; L141-L145 HydrophobicContact CD1-CG 4.05Å; L141-L145 HydrophobicContact CD2-CD1 4.25Å; L141-L145 HydrophobicContact CG-CD1 3.74Å; L141-L145 HydrophobicContact CG-CG 4.33Å; L141-L145 PolarHBondContact O-N 3.32Å; Y142-L145 PolarHBondContact O-N 3.19Å; L145-S147 VanDerWaalsContact C-N 3.3Å; L145-S147 PolarHBondContact O-N 2.91Å; L145-H148 PolarHBondContact O-N 3.42Å; L145-L149 WeakPolarHBondContact O-CB 3.37Å; L145-L149 VanDerWaalsContact O-CG 3.29Å; L145-L149 WeakPolarHBondContact O-CG 3.39Å; L145-L149 PolarHBondContact O-N 3.42Å; L145-L211 HydrophobicContact CB-CD1 4.35Å; L145-L211 HydrophobicContact CD1-CD1 3.54Å; L145-L211 HydrophobicContact CD1-CD2 3.45Å; L145-L211 VanDerWaalsContact CD1-CD2 3.45Å; L145-L211 HydrophobicContact CD1-CG 3.77Å |
| 146 | D | 83.9 | Confident | 76.8 | Confident | 9 Ų | 9 | 77.4 Ų | 77.4 | 5% | 0.048 | 41% | 0.414 | C | S | . | . | H | α-helix | trans | -60.8 | -41.9 | 171.5 | -74.7 | -2.7 | 0 | 0 | 0 | 111.6 | Y142 H148 L149 G150 E151 H153 S207 R262 | Y142-D146 PolarHBondContact O-N 3.02Å; D146-H148 VanDerWaalsContact C-N 3.31Å; D146-H148 PolarHBondContact O-N 3.01Å; D146-L149 PolarHBondContact O-N 3.43Å; D146-G150 PolarHBondContact O-N 2.93Å; D146-G150 VanDerWaalsContact O-N 3.11Å; D146-E151 PolarHBondContact O-N 2.89Å; D146-H153 IonicContact OD2-CE1 3.72Å; D146-S207 WeakPolarHBondContact OD1-CB 3.25Å; D146-S207 PolarHBondContact OD1-OG 3.32Å; D146-R262 IonicContact OD1-CZ 2.65Å; D146-R262 IonicContact OD1-NE 2.81Å; D146-R262 IonicContact OD1-NH2 3.81Å; D146-R262 PolarHBondContact OD1-NH2 3.34Å; D146-R262 IonicContact OD2-CZ 2.82Å; D146-R262 VanDerWaalsContact OD2-CZ 3.29Å; D146-R262 IonicContact OD2-NE 3.84Å; D146-R262 PolarHBondContact OD2-NE 3.08Å; D146-R262 IonicContact OD2-NH2 3.85Å; D146-R262 PolarHBondContact OD2-NH2 3.42Å; D146-R262 VanDerWaalsContact OD2-NH2 3.13Å |
| 147 | S | 79.3 | Confident | 75.3 | Confident | 98 Ų | 98 | 77.8 Ų | 77.8 | 69% | 0.685 | 41% | 0.412 | S | S | * | . | H | α-helix | trans | -63.7 | -37 | 175.2 | -174.4 | 0 | 0 | 0 | 0 | 112.2 | P143 C144 L145 | P143-S147 PolarHBondContact O-N 3.43Å; P143-S147 VanDerWaalsContact O-N 3.08Å; C144-S147 PolarHBondContact O-N 3.39Å; L145-S147 VanDerWaalsContact C-N 3.3Å; L145-S147 PolarHBondContact O-N 2.91Å |
| 148 | H | 81.7 | Confident | 74.6 | Confident | 158 Ų | 158 | 79.9 Ų | 79.9 | 73% | 0.731 | 42% | 0.416 | S | S | * | . | H | α-helix | trans | -75.9 | -35 | 180 | -169 | -85.1 | 0 | 0 | 0 | 112.5 | C144 L145 D146 G150 | C144-H148 PolarHBondContact O-N 2.62Å; L145-H148 PolarHBondContact O-N 3.42Å; D146-H148 VanDerWaalsContact C-N 3.31Å; D146-H148 PolarHBondContact O-N 3.01Å; H148-G150 PolarHBondContact O-N 2.96Å |
| 149 | L | 78.1 | Confident | 74.2 | Confident | 104 Ų | 104 | 85.5 Ų | 85.5 | 55% | 0.545 | 44% | 0.436 | S | S | . | . | H | α-helix | trans | -81.3 | -5.6 | 178.3 | -68.8 | 167.5 | 0 | 0 | 0 | 112.8 | L145 D146 E151 | L145-L149 WeakPolarHBondContact O-CB 3.37Å; L145-L149 VanDerWaalsContact O-CG 3.29Å; L145-L149 WeakPolarHBondContact O-CG 3.39Å; L145-L149 PolarHBondContact O-N 3.42Å; D146-L149 PolarHBondContact O-N 3.43Å; L149-E151 PolarHBondContact O-N 3.12Å; L149-E151 VanDerWaalsContact O-N 3.16Å |
| 150 | G | 65.7 | Low | 74 | Confident | 58 Ų | 58 | 87.4 Ų | 87.4 | 60% | 0.598 | 45% | 0.451 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 62.3 | 21 | 178.6 | 0 | 0 | 0 | 0 | 0 | 113.1 | D146 H148 P152 | D146-G150 PolarHBondContact O-N 2.93Å; D146-G150 VanDerWaalsContact O-N 3.11Å; H148-G150 PolarHBondContact O-N 2.96Å; G150-P152 WeakPolarHBondContact O-CD 3.32Å; G150-P152 VanDerWaalsContact O-N 3.17Å |
| 151 | E | 63.8 | Low | 73.8 | Confident | 62 Ų | 62 | 85.9 Ų | 85.9 | 29% | 0.29 | 45% | 0.445 | S | S | . | . | trans | -70.8 | 111 | 173.6 | -70.9 | -138 | 143.6 | 0 | 0 | 107.3 | D146 L149 H153 | D146-E151 PolarHBondContact O-N 2.89Å; L149-E151 PolarHBondContact O-N 3.12Å; L149-E151 VanDerWaalsContact O-N 3.16Å; E151-H153 PolarHBondContact O-N 2.9Å | ||
| 152 | P | 54.8 | Low | 73.7 | Confident | 82 Ų | 82 | 82.4 Ų | 82.4 | 53% | 0.532 | 43% | 0.427 | S | S | . | . | trans | -60.1 | 130.3 | 176.8 | 25.7 | -31.9 | 0 | 0 | 0 | 106.7 | G150 K154 | G150-P152 WeakPolarHBondContact O-CD 3.32Å; G150-P152 VanDerWaalsContact O-N 3.17Å; P152-K154 HydrophobicContact CB-CG 4Å; P152-K154 HydrophobicContact CG-CD 3.79Å; P152-K154 HydrophobicContact CG-CG 3.8Å; P152-K154 WeakPolarHBondContact O-CB 3.37Å; P152-K154 PolarHBondContact O-N 3.38Å | ||
| 153 | H | 56.7 | Low | 73.9 | Confident | 89 Ų | 89 | 88.4 Ų | 88.4 | 41% | 0.412 | 46% | 0.456 | S | S | . | . | trans | -60.3 | 72.3 | 174.2 | -85.7 | 52.4 | 0 | 0 | 0 | 109.4 | D146 E151 F155 | D146-H153 IonicContact OD2-CE1 3.72Å; E151-H153 PolarHBondContact O-N 2.9Å; H153-F155 VanDerWaalsContact C-N 3.29Å; H153-F155 PolarHBondContact O-N 3.46Å | ||
| 154 | K | 47.4 | Very low | 74.2 | Confident | 180 Ų | 180 | 94.3 Ų | 94.3 | 78% | 0.783 | 48% | 0.476 | S | S | * | . | trans | -83.7 | -4.7 | -163.5 | -100.3 | -174.6 | 179.5 | -176.4 | 0 | 113.4 | P152 | P152-K154 HydrophobicContact CB-CG 4Å; P152-K154 HydrophobicContact CG-CD 3.79Å; P152-K154 HydrophobicContact CG-CG 3.8Å; P152-K154 WeakPolarHBondContact O-CB 3.37Å; P152-K154 PolarHBondContact O-N 3.38Å | ||
| 155 | F | 51.8 | Low | 74.5 | Confident | 165 Ų | 165 | 90.7 Ų | 90.7 | 72% | 0.724 | 45% | 0.451 | S | S | * | . | trans | -107.2 | 112.1 | 171.5 | -113.8 | -101.8 | 0 | 0 | 0 | 108.1 | H153 R157 | H153-F155 VanDerWaalsContact C-N 3.29Å; H153-F155 PolarHBondContact O-N 3.46Å; F155-R157 HydrophobicContact CB-CB 4.47Å; F155-R157 PolarHBondContact O-N 3.28Å | ||
| 156 | K | 53.3 | Low | 74.9 | Confident | 201 Ų | 201 | 89.7 Ų | 89.7 | 87% | 0.874 | 45% | 0.445 | S | S | * | . | trans | -57.6 | 78.9 | 152.2 | -73.4 | -176.8 | 176.2 | -176.2 | 0 | 106.3 | E158 | K156-E158 PolarHBondContact O-N 3.41Š| ||
| 157 | R | 63.9 | Low | 75.4 | Confident | 22 Ų | 22 | 92.2 Ų | 92.2 | 8% | 0.083 | 47% | 0.468 | C | S | . | . | trans | -75.8 | 117.4 | -175.2 | -167.4 | 151.8 | 63.1 | -174.4 | -6.6 | 105.2 | F155 F202 D203 N259 Q263 | F155-R157 HydrophobicContact CB-CB 4.47Å; F155-R157 PolarHBondContact O-N 3.28Å; R157-F202 PolarHBondContact NH1-O 2.86Å; R157-D203 IonicContact CZ-OD1 3.98Å; R157-D203 IonicContact NH1-OD1 3.87Å; R157-D203 PolarHBondContact NH1-OD1 3.36Å; R157-D203 IonicContact NH2-OD1 3.29Å; R157-N259 VanDerWaalsContact CZ-OD1 3.22Å; R157-N259 PolarHBondContact NH1-ND2 3.05Å; R157-N259 PolarHBondContact NH1-OD1 3.33Å; R157-N259 PolarHBondContact NH2-O 3.38Å; R157-N259 PolarHBondContact NH2-OD1 2.71Å; R157-Q263 VanDerWaalsContact CG-NE2 3.31Å; R157-Q263 PolarHBondContact O-NE2 2.93Å; R157-Q263 PolarHBondContact O-OE1 2.87Å; R157-Q263 VanDerWaalsContact O-OE1 3.12Å | ||
| 158 | E | 79.6 | Confident | 76 | Confident | 134 Ų | 134 | 90.3 Ų | 90.3 | 63% | 0.626 | 45% | 0.452 | S | S | * | . | trans | -74.2 | 148 | 174.2 | -66.4 | 174 | 176.4 | 0 | 0 | 108.7 | K156 A160 S161 Q263 | K156-E158 PolarHBondContact O-N 3.41Å; E158-A160 HydrophobicContact CB-CB 4.26Å; E158-A160 PolarHBondContact O-N 3.13Å; E158-A160 VanDerWaalsContact O-N 3.07Å; E158-S161 WeakPolarHBondContact O-CB 3.38Å; E158-S161 PolarHBondContact O-N 3.5Å; E158-Q263 PolarHBondContact O-NE2 3.49Å | ||
| 159 | W | 84.4 | Confident | 76.6 | Confident | 146 Ų | 146 | 83.5 Ų | 83.5 | 55% | 0.553 | 42% | 0.42 | S | S | * | . | H | α-helix | trans | -51.7 | -30 | 170.8 | -75 | 103.5 | 0 | 0 | 0 | 111.9 | S161 V162 M163 Q263 L264 | W159-S161 VanDerWaalsContact C-N 3.33Å; W159-S161 PolarHBondContact O-N 2.9Å; W159-V162 WeakPolarHBondContact O-CB 3.4Å; W159-V162 PolarHBondContact O-N 2.87Å; W159-V162 VanDerWaalsContact O-N 3.16Å; W159-M163 WeakPolarHBondContact O-CG 3.34Å; W159-M163 PolarHBondContact O-N 2.86Å; W159-Q263 HydrophobicContact CH2-CB 4.29Å; W159-Q263 HydrophobicContact CZ3-CB 4.46Å; W159-L264 HydrophobicContact CH2-CD2 3.97Å |
| 160 | A | 86.7 | Confident | 77.2 | Confident | 41 Ų | 41 | 80 Ų | 80 | 34% | 0.339 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -56.4 | -41.8 | 172.7 | 0 | 0 | 0 | 0 | 0 | 113.3 | E158 V162 M163 R164 | E158-A160 HydrophobicContact CB-CB 4.26Å; E158-A160 PolarHBondContact O-N 3.13Å; E158-A160 VanDerWaalsContact O-N 3.07Å; A160-V162 VanDerWaalsContact C-N 3.33Å; A160-M163 PolarHBondContact O-N 2.88Å; A160-R164 VanDerWaalsContact O-CG 3.28Å; A160-R164 WeakPolarHBondContact O-CG 3.1Å; A160-R164 PolarHBondContact O-N 3.14Å |
| 161 | S | 85.6 | Confident | 78.4 | Confident | 22 Ų | 22 | 79 Ų | 79 | 15% | 0.154 | 39% | 0.392 | C | S | . | . | H | α-helix | trans | -67.4 | -36.2 | 178.1 | -175.7 | 0 | 0 | 0 | 0 | 111.7 | E158 W159 R164 C165 | E158-S161 WeakPolarHBondContact O-CB 3.38Å; E158-S161 PolarHBondContact O-N 3.5Å; W159-S161 VanDerWaalsContact C-N 3.33Å; W159-S161 PolarHBondContact O-N 2.9Å; S161-R164 PolarHBondContact O-N 3.2Å; S161-C165 WeakPolarHBondContact O-CB 3.49Å; S161-C165 PolarHBondContact O-N 2.97Å |
| 162 | V | 89.5 | Confident | 79.6 | Confident | 3 Ų | 3 | 76.2 Ų | 76.2 | 2% | 0.018 | 38% | 0.379 | C | S | . | . | H | α-helix | trans | -65.1 | -46.7 | 175.7 | -171.6 | 0 | 0 | 0 | 0 | 110.6 | W159 A160 R164 C165 I166 I260 Q263 | W159-V162 WeakPolarHBondContact O-CB 3.4Å; W159-V162 PolarHBondContact O-N 2.87Å; W159-V162 VanDerWaalsContact O-N 3.16Å; A160-V162 VanDerWaalsContact C-N 3.33Å; V162-R164 VanDerWaalsContact C-N 3.31Å; V162-R164 PolarHBondContact O-N 3.49Å; V162-C165 WeakPolarHBondContact O-CB 3.34Å; V162-C165 PolarHBondContact O-N 3.22Å; V162-C165 VanDerWaalsContact O-N 3.12Å; V162-I166 HydrophobicContact CG1-CD1 4.13Å; V162-I166 WeakPolarHBondContact O-CG1 3.4Å; V162-I166 PolarHBondContact O-N 3.48Å; V162-I260 HydrophobicContact CG1-CG1 3.58Å; V162-Q263 HydrophobicContact CG2-CB 4.46Å; V162-Q263 HydrophobicContact CG2-CG 3.56Å |
| 163 | M | 90.5 | Very high | 81.2 | Confident | 126 Ų | 126 | 72.4 Ų | 72.4 | 62% | 0.621 | 36% | 0.355 | S | S | * | . | H | α-helix | trans | -63 | -38.7 | 178.4 | -66.2 | -61 | -82.4 | 0 | 0 | 111.7 | W159 A160 I166 A167 | W159-M163 WeakPolarHBondContact O-CG 3.34Å; W159-M163 PolarHBondContact O-N 2.86Å; A160-M163 PolarHBondContact O-N 2.88Å; M163-I166 PolarHBondContact O-N 3.48Å; M163-I166 HydrophobicContact SD-CD1 4.21Å; M163-A167 WeakPolarHBondContact O-CB 3.24Å; M163-A167 PolarHBondContact O-N 3.18Å |
| 164 | R | 92.3 | Very high | 82.6 | Confident | 150 Ų | 150 | 71 Ų | 71 | 57% | 0.566 | 35% | 0.348 | S | S | * | . | H | α-helix | trans | -63.3 | -42.5 | 172.1 | -69.7 | 173.7 | -161.2 | 153.4 | 5.9 | 111.8 | A160 S161 V162 A167 V168 F202 | A160-R164 VanDerWaalsContact O-CG 3.28Å; A160-R164 WeakPolarHBondContact O-CG 3.1Å; A160-R164 PolarHBondContact O-N 3.14Å; S161-R164 PolarHBondContact O-N 3.2Å; V162-R164 VanDerWaalsContact C-N 3.31Å; V162-R164 PolarHBondContact O-N 3.49Å; R164-A167 PolarHBondContact O-N 2.72Å; R164-V168 WeakPolarHBondContact O-CG2 3.46Å; R164-V168 PolarHBondContact O-N 2.86Å; R164-F202 HydrophobicContact CB-CD1 4.48Å; R164-F202 HydrophobicContact CB-CE1 3.52Å; R164-F202 HydrophobicContact CB-CZ 3.88Å |
| 165 | C | 91.1 | Very high | 84.3 | Confident | 1 Ų | 1 | 63.4 Ų | 63.4 | 1% | 0.007 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -61.6 | -44.5 | 176.8 | -175.9 | 0 | 0 | 0 | 0 | 111.5 | S161 V162 V168 F169 F202 | S161-C165 WeakPolarHBondContact O-CB 3.49Å; S161-C165 PolarHBondContact O-N 2.97Å; V162-C165 WeakPolarHBondContact O-CB 3.34Å; V162-C165 PolarHBondContact O-N 3.22Å; V162-C165 VanDerWaalsContact O-N 3.12Å; C165-V168 PolarHBondContact O-N 2.85Å; C165-F169 WeakPolarHBondContact O-CB 3.39Å; C165-F169 PolarHBondContact O-N 3.2Å; C165-F202 HydrophobicContact CB-CB 4.06Å; C165-F202 HydrophobicContact CB-CD1 4.12Å; C165-F202 HydrophobicContact CB-CD2 4.17Å; C165-F202 HydrophobicContact CB-CG 3.85Å |
| 166 | I | 93.3 | Very high | 85.6 | Confident | 32 Ų | 32 | 55.9 Ų | 55.9 | 16% | 0.164 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -59.9 | -47 | 173.8 | -66.8 | 165.8 | 0 | 0 | 0 | 110.8 | L96 V162 M163 V168 F169 V170 T256 I260 | L96-I166 HydrophobicContact CD2-CG2 3.76Å; V162-I166 HydrophobicContact CG1-CD1 4.13Å; V162-I166 WeakPolarHBondContact O-CG1 3.4Å; V162-I166 PolarHBondContact O-N 3.48Å; M163-I166 PolarHBondContact O-N 3.48Å; M163-I166 HydrophobicContact SD-CD1 4.21Å; I166-V168 PolarHBondContact O-N 3.07Å; I166-F169 WeakPolarHBondContact O-CB 3.46Å; I166-F169 PolarHBondContact O-N 3.47Å; I166-V170 HydrophobicContact CG2-CG2 4.37Å; I166-V170 WeakPolarHBondContact O-CG2 3.49Å; I166-V170 PolarHBondContact O-N 2.87Å; I166-T256 HydrophobicContact CB-CG2 4.46Å; I166-T256 HydrophobicContact CG1-CG2 3.71Å; I166-I260 HydrophobicContact CD1-CD1 4.05Å; I166-I260 HydrophobicContact CD1-CG1 4.47Å; I166-I260 HydrophobicContact CG1-CD1 4.32Å |
| 167 | A | 93 | Very high | 86.6 | Confident | 63 Ų | 63 | 48.8 Ų | 48.8 | 52% | 0.521 | 26% | 0.261 | S | S | . | . | H | α-helix | trans | -61.9 | -42.9 | 179.5 | 0 | 0 | 0 | 0 | 0 | 112.2 | M163 R164 G171 | M163-A167 WeakPolarHBondContact O-CB 3.24Å; M163-A167 PolarHBondContact O-N 3.18Å; R164-A167 PolarHBondContact O-N 2.72Å; A167-G171 PolarHBondContact O-N 3.45Å |
| 168 | V | 92.8 | Very high | 87 | Confident | 58 Ų | 58 | 53.9 Ų | 53.9 | 35% | 0.352 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -65.8 | -42.1 | 175.4 | 176.8 | 0 | 0 | 0 | 0 | 110.5 | R164 C165 I166 G171 I172 L198 F202 | R164-V168 WeakPolarHBondContact O-CG2 3.46Å; R164-V168 PolarHBondContact O-N 2.86Å; C165-V168 PolarHBondContact O-N 2.85Å; I166-V168 PolarHBondContact O-N 3.07Å; V168-G171 CarbonylContact O-C 3.53Å; V168-G171 WeakPolarHBondContact O-CA 3.23Å; V168-G171 PolarHBondContact O-N 3.46Å; V168-G171 VanDerWaalsContact O-N 3.15Å; V168-I172 HydrophobicContact CG1-CD1 3.98Å; V168-I172 HydrophobicContact CG1-CG1 4.27Å; V168-I172 VanDerWaalsContact O-CG1 3.27Å; V168-I172 WeakPolarHBondContact O-CG1 3.32Å; V168-I172 PolarHBondContact O-N 3.29Å; V168-L198 HydrophobicContact CB-CD1 4.28Å; V168-L198 HydrophobicContact CG1-CB 4.45Å; V168-L198 HydrophobicContact CG1-CD1 3.98Å; V168-F202 HydrophobicContact CB-CE2 4.25Å; V168-F202 HydrophobicContact CG2-CE2 3.9Å; V168-F202 HydrophobicContact CG2-CZ 4.04Å |
| 169 | F | 93.4 | Very high | 86.5 | Confident | 14 Ų | 14 | 50.5 Ų | 50.5 | 6% | 0.061 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -59.3 | -48.9 | 176.1 | 169 | -116 | 0 | 0 | 0 | 112.5 | L100 C165 I166 G171 I172 N173 L198 I249 G253 T256 | L100-F169 HydrophobicContact CD1-CE1 3.7Å; L100-F169 HydrophobicContact CD1-CZ 3.58Å; C165-F169 WeakPolarHBondContact O-CB 3.39Å; C165-F169 PolarHBondContact O-N 3.2Å; I166-F169 WeakPolarHBondContact O-CB 3.46Å; I166-F169 PolarHBondContact O-N 3.47Å; F169-G171 VanDerWaalsContact C-N 3.26Å; F169-G171 PolarHBondContact O-N 2.9Å; F169-I172 PolarHBondContact O-N 2.68Å; F169-N173 PolarHBondContact O-N 3.26Å; F169-L198 HydrophobicContact CB-CD1 4.13Å; F169-I249 HydrophobicContact CE2-CG2 4.17Å; F169-G253 VanDerWaalsContact CE2-N 3.32Å; F169-T256 HydrophobicContact CB-CG2 4.39Å; F169-T256 HydrophobicContact CD1-CG2 4.5Å |
| 170 | V | 91.9 | Very high | 85.5 | Confident | 31 Ų | 31 | 49.6 Ų | 49.6 | 19% | 0.188 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -60.1 | -39.7 | 174.2 | 174.1 | 0 | 0 | 0 | 0 | 110.6 | L96 L100 L103 I166 N173 H174 | L96-V170 HydrophobicContact CD2-CG2 4.23Å; L100-V170 HydrophobicContact CD2-CB 4.37Å; L100-V170 HydrophobicContact CD2-CG1 4.33Å; L100-V170 HydrophobicContact CD2-CG2 4.06Å; L103-V170 HydrophobicContact CD1-CG1 3.56Å; I166-V170 HydrophobicContact CG2-CG2 4.37Å; I166-V170 WeakPolarHBondContact O-CG2 3.49Å; I166-V170 PolarHBondContact O-N 2.87Å; V170-N173 PolarHBondContact O-N 3.48Å; V170-H174 WeakPolarHBondContact O-CB 3.28Å; V170-H174 PolarHBondContact O-N 2.85Å |
| 171 | G | 90.4 | Very high | 84.3 | Confident | 36 Ų | 36 | 50.8 Ų | 50.8 | 37% | 0.371 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -62.8 | -42 | 175 | 0 | 0 | 0 | 0 | 0 | 113.8 | A167 V168 F169 H174 A175 | A167-G171 PolarHBondContact O-N 3.45Å; V168-G171 CarbonylContact O-C 3.53Å; V168-G171 WeakPolarHBondContact O-CA 3.23Å; V168-G171 PolarHBondContact O-N 3.46Å; V168-G171 VanDerWaalsContact O-N 3.15Å; F169-G171 VanDerWaalsContact C-N 3.26Å; F169-G171 PolarHBondContact O-N 2.9Å; G171-H174 PolarHBondContact O-N 3.43Å; G171-A175 VanDerWaalsContact O-CB 3.26Å; G171-A175 WeakPolarHBondContact O-CB 3.4Å; G171-A175 PolarHBondContact O-N 3.38Å |
| 172 | I | 89.7 | Confident | 83.1 | Confident | 4 Ų | 4 | 55.5 Ų | 55.5 | 2% | 0.021 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -62.5 | -45.8 | 175.5 | -68.1 | 169.4 | 0 | 0 | 0 | 109.8 | V168 F169 A175 S176 L191 L194 L198 I249 | V168-I172 HydrophobicContact CG1-CD1 3.98Å; V168-I172 HydrophobicContact CG1-CG1 4.27Å; V168-I172 VanDerWaalsContact O-CG1 3.27Å; V168-I172 WeakPolarHBondContact O-CG1 3.32Å; V168-I172 PolarHBondContact O-N 3.29Å; F169-I172 PolarHBondContact O-N 2.68Å; I172-A175 PolarHBondContact O-N 2.81Å; I172-S176 PolarHBondContact O-N 3.17Å; I172-L191 HydrophobicContact CG2-CD2 3.61Å; I172-L194 HydrophobicContact CD1-CB 4.04Å; I172-L194 HydrophobicContact CG1-CB 4Å; I172-L194 HydrophobicContact CG1-CD1 4.46Å; I172-L198 HydrophobicContact CD1-CB 4.33Å; I172-L198 HydrophobicContact CD1-CD1 3.94Å; I172-I249 HydrophobicContact CG2-CD1 3.67Å |
| 173 | N | 87.8 | Confident | 82.4 | Confident | 3 Ų | 3 | 59.5 Ų | 59.5 | 2% | 0.016 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -65 | -39 | 177.5 | -174.9 | -91.1 | 0 | 0 | 0 | 112.3 | L100 Q104 F169 V170 S176 I249 | L100-N173 HydrophobicContact CD1-CB 4.29Å; L100-N173 HydrophobicContact CD2-CB 3.66Å; L100-N173 HydrophobicContact CG-CB 4.47Å; Q104-N173 PolarHBondContact NE2-ND2 3.32Å; F169-N173 PolarHBondContact O-N 3.26Å; V170-N173 PolarHBondContact O-N 3.48Å; N173-S176 PolarHBondContact O-N 2.9Å; N173-S176 PolarHBondContact O-OG 2.86Å; N173-I249 HydrophobicContact CB-CD1 4.26Å |
| 174 | H | 85.2 | Confident | 81.5 | Confident | 59 Ų | 59 | 55.9 Ų | 55.9 | 27% | 0.273 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -65.9 | -40.9 | 173.6 | -175.5 | 70.2 | 0 | 0 | 0 | 111.8 | V170 G171 S176 V177 K178 | V170-H174 WeakPolarHBondContact O-CB 3.28Å; V170-H174 PolarHBondContact O-N 2.85Å; G171-H174 PolarHBondContact O-N 3.43Å; H174-S176 VanDerWaalsContact C-N 3.33Å; H174-S176 PolarHBondContact O-N 2.9Å; H174-V177 PolarHBondContact O-N 2.86Å; H174-K178 WeakPolarHBondContact O-CB 3.32Å; H174-K178 PolarHBondContact O-N 3.31Å; H174-K178 VanDerWaalsContact O-N 3.07Å |
| 175 | A | 84.4 | Confident | 80.9 | Confident | 21 Ų | 21 | 53.7 Ų | 53.7 | 17% | 0.174 | 32% | 0.321 | C | S | . | . | H | α-helix | trans | -64.7 | -34.7 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | G171 I172 V177 K178 L179 | G171-A175 VanDerWaalsContact O-CB 3.26Å; G171-A175 WeakPolarHBondContact O-CB 3.4Å; G171-A175 PolarHBondContact O-N 3.38Å; I172-A175 PolarHBondContact O-N 2.81Å; A175-V177 PolarHBondContact O-N 3.02Å; A175-K178 PolarHBondContact O-N 3.41Å; A175-L179 HydrophobicContact CB-CD1 4.27Å; A175-L179 WeakPolarHBondContact O-CB 3.38Å; A175-L179 WeakPolarHBondContact O-CG 3.34Å; A175-L179 PolarHBondContact O-N 3.38Å |
| 176 | S | 78.6 | Confident | 80.4 | Confident | 7 Ų | 7 | 58.3 Ų | 58.3 | 5% | 0.049 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -66.7 | -23.5 | 178.6 | 69.6 | 0 | 0 | 0 | 0 | 113.7 | I172 N173 H174 L191 | I172-S176 PolarHBondContact O-N 3.17Å; N173-S176 PolarHBondContact O-N 2.9Å; N173-S176 PolarHBondContact O-OG 2.86Å; H174-S176 VanDerWaalsContact C-N 3.33Å; H174-S176 PolarHBondContact O-N 2.9Å; S176-L191 VanDerWaalsContact CB-CD1 3.44Å |
| 177 | V | 74.3 | Confident | 79.8 | Confident | 52 Ų | 52 | 57 Ų | 57 | 32% | 0.315 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -88.5 | -33.2 | 172.8 | -177.7 | 0 | 0 | 0 | 0 | 111.4 | Q104 R107 H174 A175 | Q104-V177 HydrophobicContact CB-CG2 4.43Å; Q104-V177 HydrophobicContact CG-CG2 3.7Å; R107-V177 HydrophobicContact CB-CG1 4.19Å; H174-V177 PolarHBondContact O-N 2.86Å; A175-V177 PolarHBondContact O-N 3.02Å |
| 178 | K | 73.3 | Confident | 79.3 | Confident | 128 Ų | 128 | 54.9 Ų | 54.9 | 56% | 0.557 | 32% | 0.317 | S | S | * | . | H | α-helix | trans | -82.9 | -34.6 | -173.1 | -172.2 | 173.7 | -179.5 | 177 | 0 | 113.5 | H174 A175 D180 | H174-K178 WeakPolarHBondContact O-CB 3.32Å; H174-K178 PolarHBondContact O-N 3.31Å; H174-K178 VanDerWaalsContact O-N 3.07Å; A175-K178 PolarHBondContact O-N 3.41Å; K178-D180 PolarHBondContact O-N 2.84Å |
| 179 | L | 68.3 | Low | 79 | Confident | 64 Ų | 64 | 58 Ų | 58 | 34% | 0.335 | 33% | 0.331 | S | S | . | . | trans | -87.7 | 103.4 | 176.8 | -60.7 | 173.2 | 0 | 0 | 0 | 106.6 | A175 F181 L187 | A175-L179 HydrophobicContact CB-CD1 4.27Å; A175-L179 WeakPolarHBondContact O-CB 3.38Å; A175-L179 WeakPolarHBondContact O-CG 3.34Å; A175-L179 PolarHBondContact O-N 3.38Å; L179-F181 HydrophobicContact CB-CD2 4.05Å; L179-F181 HydrophobicContact CB-CE2 3.78Å; L179-F181 HydrophobicContact CB-CZ 4.4Å; L179-F181 HydrophobicContact CD1-CE2 3.88Å; L179-F181 HydrophobicContact CD1-CZ 4.31Å; L179-F181 HydrophobicContact CD2-CE2 4.23Å; L179-F181 HydrophobicContact CD2-CZ 4.04Å; L179-F181 HydrophobicContact CG-CE2 4.17Å; L179-F181 HydrophobicContact CG-CZ 4.48Å; L179-L187 WeakPolarHBondContact O-CD1 3.19Å | ||
| 180 | D | 63.1 | Low | 78.7 | Confident | 127 Ų | 127 | 59.8 Ų | 59.8 | 68% | 0.679 | 34% | 0.343 | S | S | * | . | trans | -107.1 | 76.8 | 167.6 | -151.9 | 9.3 | 0 | 0 | 0 | 106.6 | K178 R243 | K178-D180 PolarHBondContact O-N 2.84Å; D180-R243 IonicContact OD1-NH2 3.95Å | ||
| 181 | F | 61 | Low | 78.5 | Confident | 65 Ų | 65 | 58.4 Ų | 58.4 | 29% | 0.285 | 34% | 0.335 | S | S | . | . | trans | -66.8 | 138.3 | 175.5 | -69.2 | -68.1 | 0 | 0 | 0 | 108.2 | L179 N183 Q186 L187 | L179-F181 HydrophobicContact CB-CD2 4.05Å; L179-F181 HydrophobicContact CB-CE2 3.78Å; L179-F181 HydrophobicContact CB-CZ 4.4Å; L179-F181 HydrophobicContact CD1-CE2 3.88Å; L179-F181 HydrophobicContact CD1-CZ 4.31Å; L179-F181 HydrophobicContact CD2-CE2 4.23Å; L179-F181 HydrophobicContact CD2-CZ 4.04Å; L179-F181 HydrophobicContact CG-CE2 4.17Å; L179-F181 HydrophobicContact CG-CZ 4.48Å; F181-N183 PolarHBondContact O-N 3.04Å; F181-Q186 HydrophobicContact CD2-CG 4.44Å; F181-Q186 HydrophobicContact CG-CG 4.45Å; F181-L187 HydrophobicContact CD2-CB 4.1Å | ||
| 182 | A | 60.7 | Low | 78.5 | Confident | 122 Ų | 122 | 58.2 Ų | 58.2 | 100% | 1.008 | 33% | 0.329 | S | S | * | . | S | Bend | trans | -55.1 | -14.6 | 176.1 | 0 | 0 | 0 | 0 | 0 | 113.9 | ||
| 183 | N | 74.8 | Confident | 78.6 | Confident | 87 Ų | 87 | 61 Ų | 61 | 47% | 0.465 | 35% | 0.353 | S | S | . | . | trans | -119.9 | 111.2 | 174.8 | -167.7 | -13.8 | 0 | 0 | 0 | 111.4 | F181 V185 Q186 L187 | F181-N183 PolarHBondContact O-N 3.04Å; N183-V185 PolarHBondContact O-N 3.11Å; N183-V185 VanDerWaalsContact O-N 3.11Å; N183-V185 WeakPolarHBondContact OD1-CB 3.24Å; N183-V185 PolarHBondContact OD1-N 2.89Å; N183-V185 VanDerWaalsContact OD1-N 3.14Å; N183-Q186 HydrophobicContact CB-CB 4.43Å; N183-Q186 WeakPolarHBondContact O-CB 3.32Å; N183-Q186 PolarHBondContact O-N 3.02Å; N183-L187 PolarHBondContact O-N 3.27Å | ||
| 184 | N | 72.9 | Confident | 78.7 | Confident | 50 Ų | 50 | 64.5 Ų | 64.5 | 27% | 0.267 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -55.9 | -27 | 177.5 | -71.5 | -46.4 | 0 | 0 | 0 | 113.7 | S188 D238 | N184-S188 WeakPolarHBondContact O-CB 3.43Å; N184-S188 PolarHBondContact O-N 2.93Å; N184-S188 PolarHBondContact O-OG 2.73Å; N184-D238 VanDerWaalsContact CG-CG 3.46Å; N184-D238 VanDerWaalsContact CG-OD2 3.29Å; N184-D238 PolarHBondContact ND2-OD1 3.49Å; N184-D238 PolarHBondContact ND2-OD2 2.52Å; N184-D238 PolarHBondContact OD1-OD2 3.13Å; N184-D238 VanDerWaalsContact OD1-OD2 3.13Å |
| 185 | V | 77.9 | Confident | 79 | Confident | 103 Ų | 103 | 61.8 Ų | 61.8 | 62% | 0.624 | 36% | 0.359 | S | S | * | . | H | α-helix | trans | -68.4 | -42.5 | 177.4 | -179.7 | 0 | 0 | 0 | 0 | 111.2 | N183 L187 S188 L189 | N183-V185 PolarHBondContact O-N 3.11Å; N183-V185 VanDerWaalsContact O-N 3.11Å; N183-V185 WeakPolarHBondContact OD1-CB 3.24Å; N183-V185 PolarHBondContact OD1-N 2.89Å; N183-V185 VanDerWaalsContact OD1-N 3.14Å; V185-L187 VanDerWaalsContact C-N 3.34Å; V185-L187 PolarHBondContact O-N 3.22Å; V185-S188 PolarHBondContact O-N 3.44Å; V185-L189 VanDerWaalsContact O-CB 3.31Å; V185-L189 WeakPolarHBondContact O-CB 3.29Å; V185-L189 PolarHBondContact O-N 2.86Å |
| 186 | Q | 82.2 | Confident | 79.4 | Confident | 99 Ų | 99 | 64.7 Ų | 64.7 | 46% | 0.463 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -65.5 | -40.8 | 179.6 | -177.4 | 176.3 | -7.6 | 0 | 0 | 111.3 | F181 N183 T190 | F181-Q186 HydrophobicContact CD2-CG 4.44Å; F181-Q186 HydrophobicContact CG-CG 4.45Å; N183-Q186 HydrophobicContact CB-CB 4.43Å; N183-Q186 WeakPolarHBondContact O-CB 3.32Å; N183-Q186 PolarHBondContact O-N 3.02Å; Q186-T190 WeakPolarHBondContact O-CB 3.45Å; Q186-T190 PolarHBondContact O-N 2.91Å; Q186-T190 PolarHBondContact O-OG1 3.49Å |
| 187 | L | 79.9 | Confident | 80 | Confident | 3 Ų | 3 | 65.8 Ų | 65.8 | 2% | 0.016 | 38% | 0.384 | C | S | . | . | H | α-helix | trans | -60.4 | -49.6 | 174.1 | -178.7 | 144.4 | 0 | 0 | 0 | 111.6 | L179 F181 N183 V185 L189 T190 L191 W245 | L179-L187 WeakPolarHBondContact O-CD1 3.19Å; F181-L187 HydrophobicContact CD2-CB 4.1Å; N183-L187 PolarHBondContact O-N 3.27Å; V185-L187 VanDerWaalsContact C-N 3.34Å; V185-L187 PolarHBondContact O-N 3.22Å; L187-L189 PolarHBondContact O-N 2.89Å; L187-T190 PolarHBondContact O-N 3.39Å; L187-L191 HydrophobicContact CD2-CD1 3.62Å; L187-L191 HydrophobicContact CG-CD1 4.09Å; L187-L191 WeakPolarHBondContact O-CG 3.34Å; L187-L191 PolarHBondContact O-N 2.93Å; L187-W245 HydrophobicContact CD2-CB 3.65Å; L187-W245 HydrophobicContact CD2-CG 3.89Å |
| 188 | S | 83.2 | Confident | 80.9 | Confident | 20 Ų | 20 | 63.4 Ų | 63.4 | 14% | 0.14 | 37% | 0.369 | C | S | . | . | H | α-helix | trans | -64.9 | -41.5 | -178.3 | -53.2 | 0 | 0 | 0 | 0 | 111.6 | N184 V185 L191 A192 S244 | N184-S188 WeakPolarHBondContact O-CB 3.43Å; N184-S188 PolarHBondContact O-N 2.93Å; N184-S188 PolarHBondContact O-OG 2.73Å; V185-S188 PolarHBondContact O-N 3.44Å; S188-L191 PolarHBondContact O-N 3.07Å; S188-A192 VanDerWaalsContact O-CB 3.27Å; S188-A192 WeakPolarHBondContact O-CB 3.22Å; S188-A192 PolarHBondContact O-N 3.16Å; S188-S244 VanDerWaalsContact OG-CB 3.29Å; S188-S244 WeakPolarHBondContact OG-CB 3.22Å; S188-S244 PolarHBondContact OG-OG 3.5Å |
| 189 | L | 85.4 | Confident | 81.7 | Confident | 124 Ų | 124 | 59.4 Ų | 59.4 | 65% | 0.649 | 35% | 0.351 | S | S | * | . | H | α-helix | trans | -64.7 | -41.2 | 177.3 | -170.8 | 69.9 | 0 | 0 | 0 | 111.8 | V185 L187 A192 A193 | V185-L189 VanDerWaalsContact O-CB 3.31Å; V185-L189 WeakPolarHBondContact O-CB 3.29Å; V185-L189 PolarHBondContact O-N 2.86Å; L187-L189 PolarHBondContact O-N 2.89Å; L189-A192 PolarHBondContact O-N 3.37Å; L189-A193 WeakPolarHBondContact O-CB 3.43Å; L189-A193 PolarHBondContact O-N 2.9Å |
| 190 | T | 88.6 | Confident | 82.8 | Confident | 50 Ų | 50 | 63.3 Ų | 63.3 | 31% | 0.307 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -64.2 | -45.6 | 177.5 | -56 | 0 | 0 | 0 | 0 | 110.8 | Q186 L187 A193 L194 | Q186-T190 WeakPolarHBondContact O-CB 3.45Å; Q186-T190 PolarHBondContact O-N 2.91Å; Q186-T190 PolarHBondContact O-OG1 3.49Å; L187-T190 PolarHBondContact O-N 3.39Å; T190-A193 PolarHBondContact O-N 3.42Å; T190-L194 HydrophobicContact CG2-CD1 4.31Å; T190-L194 WeakPolarHBondContact O-CG 3.18Å; T190-L194 PolarHBondContact O-N 2.94Å |
| 191 | L | 87.3 | Confident | 83.9 | Confident | 3 Ų | 3 | 61.9 Ų | 61.9 | 2% | 0.016 | 36% | 0.357 | C | S | . | . | H | α-helix | trans | -68.7 | -35.6 | 178.4 | -72.1 | 166.4 | 0 | 0 | 0 | 112.4 | I172 S176 L187 S188 L194 S195 W245 C248 | I172-L191 HydrophobicContact CG2-CD2 3.61Å; S176-L191 VanDerWaalsContact CB-CD1 3.44Å; L187-L191 HydrophobicContact CD2-CD1 3.62Å; L187-L191 HydrophobicContact CG-CD1 4.09Å; L187-L191 WeakPolarHBondContact O-CG 3.34Å; L187-L191 PolarHBondContact O-N 2.93Å; S188-L191 PolarHBondContact O-N 3.07Å; L191-L194 PolarHBondContact O-N 3.07Å; L191-S195 VanDerWaalsContact O-CB 3.23Å; L191-S195 WeakPolarHBondContact O-CB 3.42Å; L191-S195 PolarHBondContact O-N 3.37Å; L191-S195 PolarHBondContact O-OG 3.41Å; L191-W245 HydrophobicContact CD1-CB 3.39Å; L191-W245 HydrophobicContact CD1-CG 4.19Å; L191-C248 HydrophobicContact CB-CB 4.2Å |
| 192 | A | 89.9 | Confident | 85 | Confident | 31 Ų | 31 | 60.4 Ų | 60.4 | 26% | 0.256 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -61.9 | -46.5 | 171.5 | 0 | 0 | 0 | 0 | 0 | 110.8 | S188 L189 L194 S195 L196 | S188-A192 VanDerWaalsContact O-CB 3.27Å; S188-A192 WeakPolarHBondContact O-CB 3.22Å; S188-A192 PolarHBondContact O-N 3.16Å; L189-A192 PolarHBondContact O-N 3.37Å; A192-L194 PolarHBondContact O-N 3.19Å; A192-S195 PolarHBondContact O-N 3.49Å; A192-L196 WeakPolarHBondContact O-CB 3.28Å; A192-L196 VanDerWaalsContact O-CG 3.28Å; A192-L196 WeakPolarHBondContact O-CG 3.41Å; A192-L196 PolarHBondContact O-N 3.45Å |
| 193 | A | 91.6 | Very high | 86 | Confident | 62 Ų | 62 | 55.7 Ų | 55.7 | 51% | 0.512 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -61.7 | -43.5 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | L189 T190 G197 | L189-A193 WeakPolarHBondContact O-CB 3.43Å; L189-A193 PolarHBondContact O-N 2.9Å; T190-A193 PolarHBondContact O-N 3.42Å; A193-G197 PolarHBondContact O-N 3.41Å |
| 194 | L | 91.4 | Very high | 86.4 | Confident | 78 Ų | 78 | 59.9 Ų | 59.9 | 41% | 0.408 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -64.8 | -39.5 | 175.6 | -70.3 | 173.6 | 0 | 0 | 0 | 112.2 | I172 T190 L191 A192 G197 L198 | I172-L194 HydrophobicContact CD1-CB 4.04Å; I172-L194 HydrophobicContact CG1-CB 4Å; I172-L194 HydrophobicContact CG1-CD1 4.46Å; T190-L194 HydrophobicContact CG2-CD1 4.31Å; T190-L194 WeakPolarHBondContact O-CG 3.18Å; T190-L194 PolarHBondContact O-N 2.94Å; L191-L194 PolarHBondContact O-N 3.07Å; A192-L194 PolarHBondContact O-N 3.19Å; L194-G197 PolarHBondContact O-N 3.33Å; L194-L198 WeakPolarHBondContact O-CB 3.4Å; L194-L198 PolarHBondContact O-N 2.96Å |
| 195 | S | 91.3 | Very high | 86.9 | Confident | 2 Ų | 2 | 58 Ų | 58 | 1% | 0.014 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -69.2 | -41.4 | 179.4 | -58.8 | 0 | 0 | 0 | 0 | 111.8 | L191 A192 L198 W199 C248 | L191-S195 VanDerWaalsContact O-CB 3.23Å; L191-S195 WeakPolarHBondContact O-CB 3.42Å; L191-S195 PolarHBondContact O-N 3.37Å; L191-S195 PolarHBondContact O-OG 3.41Å; A192-S195 PolarHBondContact O-N 3.49Å; S195-L198 PolarHBondContact O-N 3.02Å; S195-W199 PolarHBondContact O-N 3.09Å; S195-W199 VanDerWaalsContact O-N 3.1Å; S195-C248 PolarHBondContact OG-O 2.71Å |
| 196 | L | 92.1 | Very high | 87.2 | Confident | 82 Ų | 82 | 62.7 Ų | 62.7 | 43% | 0.429 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -66.6 | -38.3 | 171.9 | -69.7 | 174.8 | 0 | 0 | 0 | 111.6 | A192 W199 W200 F209 F251 | A192-L196 WeakPolarHBondContact O-CB 3.28Å; A192-L196 VanDerWaalsContact O-CG 3.28Å; A192-L196 WeakPolarHBondContact O-CG 3.41Å; A192-L196 PolarHBondContact O-N 3.45Å; L196-W199 PolarHBondContact O-N 3.32Å; L196-W200 WeakPolarHBondContact O-CB 3.43Å; L196-W200 PolarHBondContact O-N 2.88Å; L196-F209 HydrophobicContact CD2-CE2 3.84Å; L196-F251 HydrophobicContact CD2-CE1 4.46Å; L196-F251 HydrophobicContact CD2-CZ 4.44Å |
| 197 | G | 92.1 | Very high | 87.4 | Confident | 30 Ų | 30 | 58.3 Ų | 58.3 | 31% | 0.309 | 30% | 0.295 | S | S | . | . | H | α-helix | trans | -62.3 | -40.7 | 174 | 0 | 0 | 0 | 0 | 0 | 112.6 | A193 L194 W200 T201 | A193-G197 PolarHBondContact O-N 3.41Å; L194-G197 PolarHBondContact O-N 3.33Å; G197-W200 PolarHBondContact O-N 3.08Å; G197-T201 VanDerWaalsContact O-CB 3.23Å; G197-T201 WeakPolarHBondContact O-CB 3.23Å; G197-T201 PolarHBondContact O-N 2.84Å; G197-T201 PolarHBondContact O-OG1 3.15Å |
| 198 | L | 91.4 | Very high | 87.6 | Confident | 2 Ų | 2 | 58.2 Ų | 58.2 | 1% | 0.01 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -60.6 | -49.2 | 173.1 | 178.6 | 157.8 | 0 | 0 | 0 | 110.7 | V168 F169 I172 L194 S195 W200 T201 F202 V255 | V168-L198 HydrophobicContact CB-CD1 4.28Å; V168-L198 HydrophobicContact CG1-CB 4.45Å; V168-L198 HydrophobicContact CG1-CD1 3.98Å; F169-L198 HydrophobicContact CB-CD1 4.13Å; I172-L198 HydrophobicContact CD1-CB 4.33Å; I172-L198 HydrophobicContact CD1-CD1 3.94Å; L194-L198 WeakPolarHBondContact O-CB 3.4Å; L194-L198 PolarHBondContact O-N 2.96Å; S195-L198 PolarHBondContact O-N 3.02Å; L198-W200 PolarHBondContact O-N 2.94Å; L198-T201 PolarHBondContact O-N 3.26Å; L198-F202 HydrophobicContact CG-CD2 4.03Å; L198-F202 WeakPolarHBondContact O-CD2 3.4Å; L198-F202 PolarHBondContact O-N 3.34Å; L198-V255 HydrophobicContact CD2-CB 4.2Å; L198-V255 HydrophobicContact CD2-CG1 3.79Å |
| 199 | W | 91.5 | Very high | 88 | Confident | 44 Ų | 44 | 60.7 Ų | 60.7 | 17% | 0.167 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -59 | -48.7 | 176.4 | 166.7 | 70.8 | 0 | 0 | 0 | 111.4 | S195 L196 T201 D203 R204 S205 F209 F251 V255 | S195-W199 PolarHBondContact O-N 3.09Å; S195-W199 VanDerWaalsContact O-N 3.1Å; L196-W199 PolarHBondContact O-N 3.32Å; W199-T201 VanDerWaalsContact C-N 3.33Å; W199-T201 PolarHBondContact O-N 3.46Å; W199-D203 CarbonylContact O-C 3.6Å; W199-D203 PolarHBondContact O-N 3.03Å; W199-R204 PolarHBondContact O-N 3.21Å; W199-S205 PolarHBondContact NE1-O 2.73Å; W199-F209 HydrophobicContact CD2-CB 4.4Å; W199-F209 AromaticContact CD2-CD2 3.79Å; W199-F209 HydrophobicContact CD2-CD2 3.79Å; W199-F209 AromaticContact CE2-CD2 3.79Å; W199-F209 AromaticContact CE3-CD2 3.88Å; W199-F209 HydrophobicContact CE3-CD2 3.88Å; W199-F209 HydrophobicContact CE3-CE2 4.33Å; W199-F209 HydrophobicContact CG-CD2 4.44Å; W199-F209 HydrophobicContact CH2-CB 4.38Å; W199-F209 AromaticContact CH2-CD2 3.95Å; W199-F209 HydrophobicContact CH2-CD2 3.95Å; W199-F209 HydrophobicContact CH2-CG 4.25Å; W199-F209 HydrophobicContact CZ2-CB 3.6Å; W199-F209 AromaticContact CZ2-CD2 3.9Å; W199-F209 HydrophobicContact CZ2-CD2 3.9Å; W199-F209 AromaticContact CZ2-CG 3.95Å; W199-F209 HydrophobicContact CZ2-CG 3.95Å; W199-F209 AromaticContact CZ3-CD2 3.94Å; W199-F209 HydrophobicContact CZ3-CD2 3.94Å; W199-F209 HydrophobicContact CZ3-CE2 4.27Å; W199-F251 HydrophobicContact CB-CE1 3.93Å; W199-F251 HydrophobicContact CB-CZ 4.07Å; W199-F251 HydrophobicContact CG-CZ 4.27Å; W199-V255 HydrophobicContact CB-CG2 4.5Å |
| 200 | W | 89.6 | Confident | 88.2 | Confident | 146 Ų | 146 | 56.4 Ų | 56.4 | 55% | 0.553 | 29% | 0.289 | S | S | * | . | H | α-helix | trans | -60.9 | -39.7 | -180 | -177.1 | -99.4 | 0 | 0 | 0 | 113.1 | L196 G197 L198 | L196-W200 WeakPolarHBondContact O-CB 3.43Å; L196-W200 PolarHBondContact O-N 2.88Å; G197-W200 PolarHBondContact O-N 3.08Å; L198-W200 PolarHBondContact O-N 2.94Å |
| 201 | T | 87.7 | Confident | 88.3 | Confident | 97 Ų | 97 | 54.9 Ų | 54.9 | 60% | 0.595 | 28% | 0.279 | S | S | * | . | H | α-helix | trans | -81.1 | -42.9 | -174 | -54.5 | 0 | 0 | 0 | 0 | 112.7 | G197 L198 W199 | G197-T201 VanDerWaalsContact O-CB 3.23Å; G197-T201 WeakPolarHBondContact O-CB 3.23Å; G197-T201 PolarHBondContact O-N 2.84Å; G197-T201 PolarHBondContact O-OG1 3.15Å; L198-T201 PolarHBondContact O-N 3.26Å; W199-T201 VanDerWaalsContact C-N 3.33Å; W199-T201 PolarHBondContact O-N 3.46Å |
| 202 | F | 84.6 | Confident | 88.5 | Confident | 34 Ų | 34 | 54.8 Ų | 54.8 | 15% | 0.149 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -104 | -21.5 | -169.5 | -64.5 | -71.8 | 0 | 0 | 0 | 114.4 | R157 R164 C165 V168 L198 | R157-F202 PolarHBondContact NH1-O 2.86Å; R164-F202 HydrophobicContact CB-CD1 4.48Å; R164-F202 HydrophobicContact CB-CE1 3.52Å; R164-F202 HydrophobicContact CB-CZ 3.88Å; C165-F202 HydrophobicContact CB-CB 4.06Å; C165-F202 HydrophobicContact CB-CD1 4.12Å; C165-F202 HydrophobicContact CB-CD2 4.17Å; C165-F202 HydrophobicContact CB-CG 3.85Å; V168-F202 HydrophobicContact CB-CE2 4.25Å; V168-F202 HydrophobicContact CG2-CE2 3.9Å; V168-F202 HydrophobicContact CG2-CZ 4.04Å; L198-F202 HydrophobicContact CG-CD2 4.03Å; L198-F202 WeakPolarHBondContact O-CD2 3.4Å; L198-F202 PolarHBondContact O-N 3.34Å |
| 203 | D | 80.2 | Confident | 88.6 | Confident | 22 Ų | 22 | 57.3 Ų | 57.3 | 12% | 0.118 | 29% | 0.286 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -123.5 | -49.5 | -172.7 | -162.9 | 46.9 | 0 | 0 | 0 | 114.7 | R157 W199 S205 V255 N259 R262 | R157-D203 IonicContact CZ-OD1 3.98Å; R157-D203 IonicContact NH1-OD1 3.87Å; R157-D203 PolarHBondContact NH1-OD1 3.36Å; R157-D203 IonicContact NH2-OD1 3.29Å; W199-D203 CarbonylContact O-C 3.6Å; W199-D203 PolarHBondContact O-N 3.03Å; D203-S205 PolarHBondContact O-N 3.23Å; D203-S205 PolarHBondContact OD2-OG 3.32Å; D203-V255 HydrophobicContact CB-CG1 3.83Å; D203-N259 PolarHBondContact OD1-OD1 3.11Å; D203-R262 IonicContact OD1-CZ 3.13Å; D203-R262 IonicContact OD1-NH1 3.03Å; D203-R262 PolarHBondContact OD1-NH1 3.4Å; D203-R262 IonicContact OD2-CZ 3.75Å; D203-R262 IonicContact OD2-NH1 2.6Å; D203-R262 PolarHBondContact OD2-NH1 2.91Å |
| 204 | R | 83.9 | Confident | 88.6 | Confident | 175 Ų | 175 | 58.4 Ų | 58.4 | 66% | 0.66 | 29% | 0.287 | S | S | * | . | trans | 50.5 | 14.1 | 177.5 | -157.5 | 173.7 | 175.6 | 167.7 | -0.3 | 115 | W199 | W199-R204 PolarHBondContact O-N 3.21Š| ||
| 205 | S | 83.8 | Confident | 88.6 | Confident | 11 Ų | 11 | 55.7 Ų | 55.7 | 8% | 0.077 | 27% | 0.274 | C | S | . | . | trans | -94.7 | 145.2 | -174.9 | 77.9 | 0 | 0 | 0 | 0 | 111.5 | W199 D203 G208 F209 R262 | W199-S205 PolarHBondContact NE1-O 2.73Å; D203-S205 PolarHBondContact O-N 3.23Å; D203-S205 PolarHBondContact OD2-OG 3.32Å; S205-G208 PolarHBondContact O-N 2.89Å; S205-G208 VanDerWaalsContact OG-CA 3.29Å; S205-G208 WeakPolarHBondContact OG-CA 3.41Å; S205-G208 PolarHBondContact OG-N 3.32Å; S205-F209 PolarHBondContact O-N 2.82Å; S205-F209 VanDerWaalsContact O-N 3.13Å; S205-R262 PolarHBondContact OG-NH1 2.99Å; S205-R262 VanDerWaalsContact OG-NH1 3.09Å; S205-R262 PolarHBondContact OG-NH2 2.92Å | ||
| 206 | R | 84.2 | Confident | 88.6 | Confident | 202 Ų | 202 | 56.1 Ų | 56.1 | 76% | 0.762 | 28% | 0.277 | S | S | * | . | H | α-helix | trans | -71 | -41.6 | 178.3 | -67.3 | 175.1 | 175.6 | 170.9 | -1.7 | 111.5 | G208 F209 G210 | R206-G208 VanDerWaalsContact C-N 3.31Å; R206-G208 PolarHBondContact O-N 3.1Å; R206-F209 PolarHBondContact O-N 3Å; R206-G210 PolarHBondContact O-N 3.22Å |
| 207 | S | 84.8 | Confident | 88.6 | Confident | 7 Ų | 7 | 59.3 Ų | 59.3 | 5% | 0.049 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -60.7 | -40.7 | 174.2 | 48.5 | 0 | 0 | 0 | 0 | 111.6 | D146 G210 L211 R262 | D146-S207 WeakPolarHBondContact OD1-CB 3.25Å; D146-S207 PolarHBondContact OD1-OG 3.32Å; S207-G210 PolarHBondContact O-N 2.85Å; S207-L211 VanDerWaalsContact O-CB 3.25Å; S207-L211 WeakPolarHBondContact O-CB 3.37Å; S207-L211 WeakPolarHBondContact O-CG 3.33Å; S207-L211 PolarHBondContact O-N 3.5Å; S207-R262 PolarHBondContact OG-NH2 2.98Å |
| 208 | G | 85.9 | Confident | 88.6 | Confident | 0 Ų | 0 | 62.6 Ų | 62.6 | 0% | 0 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -69.7 | -33 | 178 | 0 | 0 | 0 | 0 | 0 | 113.6 | Y142 S205 R206 G212 | Y142-G208 VanDerWaalsContact CE1-CA 3.41Å; Y142-G208 PolarHBondContact OH-O 2.85Å; S205-G208 PolarHBondContact O-N 2.89Å; S205-G208 VanDerWaalsContact OG-CA 3.29Å; S205-G208 WeakPolarHBondContact OG-CA 3.41Å; S205-G208 PolarHBondContact OG-N 3.32Å; R206-G208 VanDerWaalsContact C-N 3.31Å; R206-G208 PolarHBondContact O-N 3.1Å; G208-G212 PolarHBondContact O-N 2.84Å |
| 209 | F | 90.3 | Very high | 88.4 | Confident | 73 Ų | 73 | 63.4 Ų | 63.4 | 32% | 0.32 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -66.2 | -51.3 | 171.4 | -171.7 | -108 | 0 | 0 | 0 | 111.7 | L196 W199 S205 R206 G212 I213 F251 | L196-F209 HydrophobicContact CD2-CE2 3.84Å; W199-F209 HydrophobicContact CD2-CB 4.4Å; W199-F209 AromaticContact CD2-CD2 3.79Å; W199-F209 HydrophobicContact CD2-CD2 3.79Å; W199-F209 AromaticContact CE2-CD2 3.79Å; W199-F209 AromaticContact CE3-CD2 3.88Å; W199-F209 HydrophobicContact CE3-CD2 3.88Å; W199-F209 HydrophobicContact CE3-CE2 4.33Å; W199-F209 HydrophobicContact CG-CD2 4.44Å; W199-F209 HydrophobicContact CH2-CB 4.38Å; W199-F209 AromaticContact CH2-CD2 3.95Å; W199-F209 HydrophobicContact CH2-CD2 3.95Å; W199-F209 HydrophobicContact CH2-CG 4.25Å; W199-F209 HydrophobicContact CZ2-CB 3.6Å; W199-F209 AromaticContact CZ2-CD2 3.9Å; W199-F209 HydrophobicContact CZ2-CD2 3.9Å; W199-F209 AromaticContact CZ2-CG 3.95Å; W199-F209 HydrophobicContact CZ2-CG 3.95Å; W199-F209 AromaticContact CZ3-CD2 3.94Å; W199-F209 HydrophobicContact CZ3-CD2 3.94Å; W199-F209 HydrophobicContact CZ3-CE2 4.27Å; S205-F209 PolarHBondContact O-N 2.82Å; S205-F209 VanDerWaalsContact O-N 3.13Å; R206-F209 PolarHBondContact O-N 3Å; F209-G212 PolarHBondContact O-N 3.35Å; F209-I213 HydrophobicContact CD1-CD1 3.86Å; F209-I213 HydrophobicContact CE1-CD1 3.32Å; F209-I213 HydrophobicContact CE1-CG1 4.47Å; F209-I213 HydrophobicContact CE2-CD1 4.18Å; F209-I213 HydrophobicContact CG-CD1 4.49Å; F209-I213 HydrophobicContact CZ-CD1 3.52Å; F209-I213 HydrophobicContact CZ-CG1 4.47Å; F209-I213 WeakPolarHBondContact O-CG1 3.43Å; F209-I213 PolarHBondContact O-N 3.02Å; F209-F251 HydrophobicContact CD2-CE2 4.18Å; F209-F251 AromaticContact CD2-CZ 3.93Å; F209-F251 HydrophobicContact CD2-CZ 3.93Å; F209-F251 HydrophobicContact CE2-CE2 4.44Å; F209-F251 HydrophobicContact CE2-CZ 4.26Å |
| 210 | G | 90.6 | Very high | 88.3 | Confident | 34 Ų | 34 | 62.8 Ų | 62.8 | 35% | 0.351 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -60.7 | -50.2 | -179 | 0 | 0 | 0 | 0 | 0 | 112 | R206 S207 G212 I213 T214 | R206-G210 PolarHBondContact O-N 3.22Å; S207-G210 PolarHBondContact O-N 2.85Å; G210-G212 VanDerWaalsContact C-N 3.32Å; G210-G212 PolarHBondContact O-N 3.35Å; G210-I213 PolarHBondContact O-N 2.88Å; G210-T214 PolarHBondContact O-N 3.02Å; G210-T214 PolarHBondContact O-OG1 3.39Å; G210-T214 VanDerWaalsContact O-OG1 3.09Å |
| 211 | L | 89.5 | Confident | 88.2 | Confident | 18 Ų | 18 | 58.5 Ų | 58.5 | 9% | 0.094 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -65.3 | -34.5 | 177.5 | -73.9 | 171.4 | 0 | 0 | 0 | 113.2 | L141 Y142 L145 S207 T214 T215 | L141-L211 HydrophobicContact CD2-CD2 3.72Å; L141-L211 HydrophobicContact CG-CD2 4.2Å; Y142-L211 HydrophobicContact CD1-CD1 4.3Å; Y142-L211 HydrophobicContact CD2-CB 4.08Å; Y142-L211 HydrophobicContact CD2-CD1 3.27Å; Y142-L211 HydrophobicContact CD2-CG 4.27Å; Y142-L211 HydrophobicContact CE1-CD1 4.44Å; Y142-L211 HydrophobicContact CE2-CB 3.33Å; Y142-L211 HydrophobicContact CE2-CD1 3.46Å; Y142-L211 VanDerWaalsContact CE2-CD1 3.46Å; Y142-L211 HydrophobicContact CE2-CG 4.01Å; Y142-L211 HydrophobicContact CG-CD1 3.73Å; L145-L211 HydrophobicContact CB-CD1 4.35Å; L145-L211 HydrophobicContact CD1-CD1 3.54Å; L145-L211 HydrophobicContact CD1-CD2 3.45Å; L145-L211 VanDerWaalsContact CD1-CD2 3.45Å; L145-L211 HydrophobicContact CD1-CG 3.77Å; S207-L211 VanDerWaalsContact O-CB 3.25Å; S207-L211 WeakPolarHBondContact O-CB 3.37Å; S207-L211 WeakPolarHBondContact O-CG 3.33Å; S207-L211 PolarHBondContact O-N 3.5Å; L211-T214 PolarHBondContact O-N 3Å; L211-T215 WeakPolarHBondContact O-CB 3.38Å; L211-T215 PolarHBondContact O-N 3.46Å; L211-T215 PolarHBondContact O-OG1 3.36Å |
| 212 | G | 91.3 | Very high | 88.1 | Confident | 0 Ų | 0 | 57.5 Ų | 57.5 | 0% | 0 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -60.7 | -46.2 | 172.4 | 0 | 0 | 0 | 0 | 0 | 111.7 | Y142 G208 F209 G210 T215 A216 | Y142-G212 PolarHBondContact OH-N 3.43Å; G208-G212 PolarHBondContact O-N 2.84Å; F209-G212 PolarHBondContact O-N 3.35Å; G210-G212 VanDerWaalsContact C-N 3.32Å; G210-G212 PolarHBondContact O-N 3.35Å; G212-T215 PolarHBondContact O-N 3.31Å; G212-A216 WeakPolarHBondContact O-CB 3.32Å; G212-A216 PolarHBondContact O-N 2.91Å |
| 213 | I | 93.1 | Very high | 87.9 | Confident | 84 Ų | 84 | 56.9 Ų | 56.9 | 43% | 0.431 | 29% | 0.285 | S | S | . | . | H | α-helix | trans | -64.3 | -47.7 | 176.9 | -70.4 | 175.7 | 0 | 0 | 0 | 110.9 | F209 G210 T215 A216 F217 F251 | F209-I213 HydrophobicContact CD1-CD1 3.86Å; F209-I213 HydrophobicContact CE1-CD1 3.32Å; F209-I213 HydrophobicContact CE1-CG1 4.47Å; F209-I213 HydrophobicContact CE2-CD1 4.18Å; F209-I213 HydrophobicContact CG-CD1 4.49Å; F209-I213 HydrophobicContact CZ-CD1 3.52Å; F209-I213 HydrophobicContact CZ-CG1 4.47Å; F209-I213 WeakPolarHBondContact O-CG1 3.43Å; F209-I213 PolarHBondContact O-N 3.02Å; G210-I213 PolarHBondContact O-N 2.88Å; I213-T215 VanDerWaalsContact C-N 3.29Å; I213-T215 PolarHBondContact O-N 3.42Å; I213-A216 PolarHBondContact O-N 2.75Å; I213-F217 WeakPolarHBondContact O-CB 3.36Å; I213-F217 PolarHBondContact O-N 3.46Å; I213-F251 HydrophobicContact CG1-CD2 4.17Å; I213-F251 HydrophobicContact CG1-CE2 3.97Å |
| 214 | T | 91.9 | Very high | 87.9 | Confident | 86 Ų | 86 | 58.5 Ų | 58.5 | 53% | 0.528 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -59.4 | -43 | 178.3 | -57.3 | 0 | 0 | 0 | 0 | 111.2 | G210 L211 L218 | G210-T214 PolarHBondContact O-N 3.02Å; G210-T214 PolarHBondContact O-OG1 3.39Å; G210-T214 VanDerWaalsContact O-OG1 3.09Å; L211-T214 PolarHBondContact O-N 3Å; T214-L218 VanDerWaalsContact O-CB 3.25Å; T214-L218 WeakPolarHBondContact O-CB 3.48Å; T214-L218 PolarHBondContact O-N 3.01Å |
| 215 | T | 90.9 | Very high | 87.7 | Confident | 21 Ų | 21 | 54.7 Ų | 54.7 | 13% | 0.129 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -61.5 | -49 | 175.4 | -62.4 | 0 | 0 | 0 | 0 | 111.1 | I138 L211 G212 I213 F217 L218 A219 | I138-T215 HydrophobicContact CD1-CG2 3.4Å; I138-T215 VanDerWaalsContact CD1-CG2 3.4Å; I138-T215 HydrophobicContact CG1-CG2 4.47Å; L211-T215 WeakPolarHBondContact O-CB 3.38Å; L211-T215 PolarHBondContact O-N 3.46Å; L211-T215 PolarHBondContact O-OG1 3.36Å; G212-T215 PolarHBondContact O-N 3.31Å; I213-T215 VanDerWaalsContact C-N 3.29Å; I213-T215 PolarHBondContact O-N 3.42Å; T215-F217 VanDerWaalsContact C-N 3.33Å; T215-F217 PolarHBondContact O-N 2.95Å; T215-L218 PolarHBondContact O-N 2.98Å; T215-A219 WeakPolarHBondContact O-CB 3.08Å; T215-A219 PolarHBondContact O-N 3.3Å |
| 216 | A | 92.1 | Very high | 87.5 | Confident | 10 Ų | 10 | 56.3 Ų | 56.3 | 8% | 0.083 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -59.6 | -45.3 | -179.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | G212 I213 T220 P247 F250 F251 | G212-A216 WeakPolarHBondContact O-CB 3.32Å; G212-A216 PolarHBondContact O-N 2.91Å; I213-A216 PolarHBondContact O-N 2.75Å; A216-T220 VanDerWaalsContact O-CB 3.29Å; A216-T220 WeakPolarHBondContact O-CB 3.23Å; A216-T220 PolarHBondContact O-N 3.43Å; A216-T220 PolarHBondContact O-OG1 3.09Å; A216-P247 WeakPolarHBondContact CB-O 3.18Å; A216-F250 HydrophobicContact CB-CB 4.29Å; A216-F251 HydrophobicContact CB-CB 3.94Å |
| 217 | F | 91.4 | Very high | 87 | Confident | 149 Ų | 149 | 47.8 Ų | 47.8 | 65% | 0.654 | 26% | 0.262 | S | S | * | . | H | α-helix | trans | -63.4 | -52.8 | 177 | -178.7 | -101.2 | 0 | 0 | 0 | 111.5 | I213 T215 A219 T220 V221 | I213-F217 WeakPolarHBondContact O-CB 3.36Å; I213-F217 PolarHBondContact O-N 3.46Å; T215-F217 VanDerWaalsContact C-N 3.33Å; T215-F217 PolarHBondContact O-N 2.95Å; F217-A219 PolarHBondContact O-N 3.22Å; F217-T220 PolarHBondContact O-N 3.31Å; F217-V221 HydrophobicContact CD1-CG2 4.36Å; F217-V221 HydrophobicContact CE1-CG2 3.97Å; F217-V221 HydrophobicContact CE2-CG2 4.25Å; F217-V221 HydrophobicContact CZ-CG2 3.91Å; F217-V221 WeakPolarHBondContact O-CG2 3.35Å; F217-V221 PolarHBondContact O-N 3.18Å |
| 218 | L | 91.2 | Very high | 86.5 | Confident | 99 Ų | 99 | 56.8 Ų | 56.8 | 52% | 0.518 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -61.4 | -44.7 | -177.9 | -177.5 | 61.1 | 0 | 0 | 0 | 111.9 | T214 T215 T220 V221 I222 | T214-L218 VanDerWaalsContact O-CB 3.25Å; T214-L218 WeakPolarHBondContact O-CB 3.48Å; T214-L218 PolarHBondContact O-N 3.01Å; T215-L218 PolarHBondContact O-N 2.98Å; L218-T220 VanDerWaalsContact C-N 3.32Å; L218-T220 PolarHBondContact O-N 2.89Å; L218-V221 PolarHBondContact O-N 3.12Å; L218-I222 HydrophobicContact CD1-CD1 4.2Å; L218-I222 HydrophobicContact CD1-CG1 4.47Å; L218-I222 HydrophobicContact CG-CD1 3.94Å; L218-I222 WeakPolarHBondContact O-CB 3.48Å; L218-I222 VanDerWaalsContact O-CG1 3.27Å; L218-I222 WeakPolarHBondContact O-CG1 3.37Å; L218-I222 PolarHBondContact O-N 3.28Å |
| 219 | A | 88.6 | Confident | 86.1 | Confident | 19 Ų | 19 | 62.3 Ų | 62.3 | 16% | 0.157 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -65.2 | -36.1 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | T215 F217 T223 F250 | T215-A219 WeakPolarHBondContact O-CB 3.08Å; T215-A219 PolarHBondContact O-N 3.3Å; F217-A219 PolarHBondContact O-N 3.22Å; A219-T223 WeakPolarHBondContact O-CB 3.37Å; A219-T223 PolarHBondContact O-N 2.98Å; A219-T223 PolarHBondContact O-OG1 2.81Å; A219-F250 HydrophobicContact CB-CB 4.05Å; A219-F250 HydrophobicContact CB-CD1 3.88Å; A219-F250 HydrophobicContact CB-CD2 3.44Å; A219-F250 VanDerWaalsContact CB-CD2 3.44Å; A219-F250 HydrophobicContact CB-CE1 4.14Å; A219-F250 HydrophobicContact CB-CE2 3.68Å; A219-F250 HydrophobicContact CB-CG 3.54Å; A219-F250 HydrophobicContact CB-CZ 4.04Å |
| 220 | T | 88.1 | Confident | 84.9 | Confident | 31 Ų | 31 | 61 Ų | 61 | 19% | 0.19 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -66.8 | -43.2 | 174.7 | -55.5 | 0 | 0 | 0 | 0 | 111.1 | A216 F217 L218 T223 Q224 P247 | A216-T220 VanDerWaalsContact O-CB 3.29Å; A216-T220 WeakPolarHBondContact O-CB 3.23Å; A216-T220 PolarHBondContact O-N 3.43Å; A216-T220 PolarHBondContact O-OG1 3.09Å; F217-T220 PolarHBondContact O-N 3.31Å; L218-T220 VanDerWaalsContact C-N 3.32Å; L218-T220 PolarHBondContact O-N 2.89Å; T220-T223 PolarHBondContact O-N 2.69Å; T220-Q224 WeakPolarHBondContact O-CB 3.32Å; T220-Q224 PolarHBondContact O-N 3.25Å; T220-P247 HydrophobicContact CG2-CG 4.22Å |
| 221 | V | 88.3 | Confident | 83.9 | Confident | 57 Ų | 57 | 63.6 Ų | 63.6 | 35% | 0.345 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -62.8 | -45 | 175.4 | 171.4 | 0 | 0 | 0 | 0 | 111.3 | F217 L218 T223 Q224 L225 | F217-V221 HydrophobicContact CD1-CG2 4.36Å; F217-V221 HydrophobicContact CE1-CG2 3.97Å; F217-V221 HydrophobicContact CE2-CG2 4.25Å; F217-V221 HydrophobicContact CZ-CG2 3.91Å; F217-V221 WeakPolarHBondContact O-CG2 3.35Å; F217-V221 PolarHBondContact O-N 3.18Å; L218-V221 PolarHBondContact O-N 3.12Å; V221-T223 VanDerWaalsContact C-N 3.34Å; V221-T223 PolarHBondContact O-N 3.03Å; V221-Q224 WeakPolarHBondContact O-CB 3.34Å; V221-Q224 PolarHBondContact O-N 2.7Å; V221-L225 HydrophobicContact CG1-CD1 4.24Å; V221-L225 WeakPolarHBondContact O-CG 3.25Å; V221-L225 PolarHBondContact O-N 3.04Å |
| 222 | I | 85.9 | Confident | 82.7 | Confident | 76 Ų | 76 | 66.1 Ų | 66.1 | 39% | 0.39 | 35% | 0.351 | S | S | . | . | H | α-helix | trans | -59.4 | -48.5 | 175.8 | -70.5 | 166.9 | 0 | 0 | 0 | 109.8 | L218 Q224 L225 L226 | L218-I222 HydrophobicContact CD1-CD1 4.2Å; L218-I222 HydrophobicContact CD1-CG1 4.47Å; L218-I222 HydrophobicContact CG-CD1 3.94Å; L218-I222 WeakPolarHBondContact O-CB 3.48Å; L218-I222 VanDerWaalsContact O-CG1 3.27Å; L218-I222 WeakPolarHBondContact O-CG1 3.37Å; L218-I222 PolarHBondContact O-N 3.28Å; I222-Q224 VanDerWaalsContact C-N 3.28Å; I222-Q224 PolarHBondContact O-N 3.1Å; I222-L225 WeakPolarHBondContact O-CB 3.47Å; I222-L225 PolarHBondContact O-N 3.38Å; I222-L225 VanDerWaalsContact O-N 3.11Å; I222-L226 HydrophobicContact CG2-CD1 3.64Å; I222-L226 WeakPolarHBondContact O-CD1 3.29Å; I222-L226 PolarHBondContact O-N 2.6Å |
| 223 | T | 80 | Confident | 81.1 | Confident | 20 Ų | 20 | 74 Ų | 74 | 12% | 0.123 | 39% | 0.387 | C | S | . | . | H | α-helix | trans | -58.8 | -42.3 | 177.6 | -55 | 0 | 0 | 0 | 0 | 111.4 | A219 T220 V221 L225 L226 V227 Y234 V242 L246 | A219-T223 WeakPolarHBondContact O-CB 3.37Å; A219-T223 PolarHBondContact O-N 2.98Å; A219-T223 PolarHBondContact O-OG1 2.81Å; T220-T223 PolarHBondContact O-N 2.69Å; V221-T223 VanDerWaalsContact C-N 3.34Å; V221-T223 PolarHBondContact O-N 3.03Å; T223-L225 VanDerWaalsContact C-N 3.33Å; T223-L225 PolarHBondContact O-N 3.11Å; T223-L226 PolarHBondContact O-N 3.09Å; T223-V227 HydrophobicContact CG2-CG2 4.49Å; T223-V227 WeakPolarHBondContact O-CG2 3.34Å; T223-V227 PolarHBondContact O-N 2.81Å; T223-Y234 HydrophobicContact CG2-CE2 3.88Å; T223-V242 HydrophobicContact CG2-CG2 4.22Å; T223-L246 HydrophobicContact CG2-CD2 3.77Å |
| 224 | Q | 80.1 | Confident | 79.3 | Confident | 57 Ų | 57 | 72.4 Ų | 72.4 | 27% | 0.266 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -58.8 | -44.6 | 176 | -171.1 | 65.6 | 25 | 0 | 0 | 111.9 | T220 V221 I222 V227 Y228 L240 | T220-Q224 WeakPolarHBondContact O-CB 3.32Å; T220-Q224 PolarHBondContact O-N 3.25Å; V221-Q224 WeakPolarHBondContact O-CB 3.34Å; V221-Q224 PolarHBondContact O-N 2.7Å; I222-Q224 VanDerWaalsContact C-N 3.28Å; I222-Q224 PolarHBondContact O-N 3.1Å; Q224-V227 PolarHBondContact O-N 2.65Å; Q224-Y228 WeakPolarHBondContact O-CB 3.18Å; Q224-Y228 PolarHBondContact O-N 2.6Å; Q224-L240 PolarHBondContact NE2-O 2.81Å; Q224-L240 PolarHBondContact OE1-O 3.32Å |
| 225 | L | 80.8 | Confident | 77.3 | Confident | 95 Ų | 95 | 75 Ų | 75 | 50% | 0.497 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -64.6 | -40.3 | 177 | -69.8 | 171.1 | 0 | 0 | 0 | 111.4 | V221 I222 T223 V227 Y228 N229 | V221-L225 HydrophobicContact CG1-CD1 4.24Å; V221-L225 WeakPolarHBondContact O-CG 3.25Å; V221-L225 PolarHBondContact O-N 3.04Å; I222-L225 WeakPolarHBondContact O-CB 3.47Å; I222-L225 PolarHBondContact O-N 3.38Å; I222-L225 VanDerWaalsContact O-N 3.11Å; T223-L225 VanDerWaalsContact C-N 3.33Å; T223-L225 PolarHBondContact O-N 3.11Å; L225-V227 VanDerWaalsContact C-N 3.34Å; L225-V227 PolarHBondContact O-N 2.82Å; L225-Y228 PolarHBondContact O-N 3.42Å; L225-N229 WeakPolarHBondContact O-CB 3.24Å; L225-N229 PolarHBondContact O-N 2.87Å; L225-N229 PolarHBondContact O-ND2 3.08Å |
| 226 | L | 78 | Confident | 75.2 | Confident | 44 Ų | 44 | 76.9 Ų | 76.9 | 23% | 0.23 | 41% | 0.406 | C | S | . | . | H | α-helix | trans | -64.9 | -39.2 | 177.2 | -88.9 | 76 | 0 | 0 | 0 | 112.1 | W126 I222 T223 G230 V231 Y232 | W126-L226 HydrophobicContact CE3-CD2 4.5Å; W126-L226 HydrophobicContact CH2-CD2 3.23Å; W126-L226 HydrophobicContact CZ2-CD2 4.12Å; W126-L226 HydrophobicContact CZ3-CD2 3.46Å; W126-L226 VanDerWaalsContact CZ3-CD2 3.46Å; I222-L226 HydrophobicContact CG2-CD1 3.64Å; I222-L226 WeakPolarHBondContact O-CD1 3.29Å; I222-L226 PolarHBondContact O-N 2.6Å; T223-L226 PolarHBondContact O-N 3.09Å; L226-G230 PolarHBondContact O-N 3.13Å; L226-V231 PolarHBondContact O-N 3.31Å; L226-Y232 PolarHBondContact O-N 3.04Å |
| 227 | V | 75.4 | Confident | 73.5 | Confident | 23 Ų | 23 | 79.7 Ų | 79.7 | 14% | 0.139 | 42% | 0.424 | C | S | . | . | H | α-helix | trans | -66.5 | -43.5 | 175.2 | 174.7 | 0 | 0 | 0 | 0 | 110.9 | T223 Q224 L225 N229 G230 Y232 Y234 | T223-V227 HydrophobicContact CG2-CG2 4.49Å; T223-V227 WeakPolarHBondContact O-CG2 3.34Å; T223-V227 PolarHBondContact O-N 2.81Å; Q224-V227 PolarHBondContact O-N 2.65Å; L225-V227 VanDerWaalsContact C-N 3.34Å; L225-V227 PolarHBondContact O-N 2.82Å; V227-N229 VanDerWaalsContact C-N 3.33Å; V227-N229 PolarHBondContact O-N 2.79Å; V227-G230 PolarHBondContact O-N 2.96Å; V227-Y232 WeakPolarHBondContact CA-O 3.29Å; V227-Y232 HydrophobicContact CG2-CD1 4.05Å; V227-Y234 HydrophobicContact CG2-CD2 3.97Å; V227-Y234 HydrophobicContact CG2-CE2 4.09Å |
| 228 | Y | 73.3 | Confident | 71.8 | Confident | 196 Ų | 196 | 75.3 Ų | 75.3 | 77% | 0.769 | 41% | 0.407 | S | S | * | . | H | α-helix | trans | -62.5 | -38.4 | 177.6 | -177 | -100.9 | 0 | 0 | 0 | 112.8 | Q224 L225 G230 | Q224-Y228 WeakPolarHBondContact O-CB 3.18Å; Q224-Y228 PolarHBondContact O-N 2.6Å; L225-Y228 PolarHBondContact O-N 3.42Å; Y228-G230 PolarHBondContact O-N 3.28Å |
| 229 | N | 76.5 | Confident | 69.7 | Low | 116 Ų | 116 | 78.1 Ų | 78.1 | 62% | 0.62 | 42% | 0.415 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -78.6 | 2.2 | 175.7 | -73.3 | -76.8 | 0 | 0 | 0 | 113.5 | L225 V227 V231 | L225-N229 WeakPolarHBondContact O-CB 3.24Å; L225-N229 PolarHBondContact O-N 2.87Å; L225-N229 PolarHBondContact O-ND2 3.08Å; V227-N229 VanDerWaalsContact C-N 3.33Å; V227-N229 PolarHBondContact O-N 2.79Å; N229-V231 HydrophobicContact CB-CG2 4.25Å; N229-V231 PolarHBondContact O-N 2.82Å |
| 230 | G | 66.7 | Low | 67.6 | Low | 47 Ų | 47 | 83.6 Ų | 83.6 | 49% | 0.485 | 44% | 0.441 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 72.3 | 8.5 | 178.2 | 0 | 0 | 0 | 0 | 0 | 115.2 | L226 V227 Y228 Y232 | L226-G230 PolarHBondContact O-N 3.13Å; V227-G230 PolarHBondContact O-N 2.96Å; Y228-G230 PolarHBondContact O-N 3.28Å; G230-Y232 VanDerWaalsContact C-N 3.32Å |
| 231 | V | 69.4 | Low | 65.8 | Low | 88 Ų | 88 | 89.9 Ų | 89.9 | 53% | 0.533 | 46% | 0.463 | S | S | . | . | S | Bend | trans | -74.2 | -26.8 | 178.7 | 179.8 | 0 | 0 | 0 | 0 | 111.2 | W126 L226 N229 | W126-V231 HydrophobicContact CZ2-CG1 4.2Å; L226-V231 PolarHBondContact O-N 3.31Å; N229-V231 HydrophobicContact CB-CG2 4.25Å; N229-V231 PolarHBondContact O-N 2.82Å |
| 232 | Y | 63.2 | Low | 64.4 | Low | 71 Ų | 71 | 87.5 Ų | 87.5 | 28% | 0.278 | 45% | 0.448 | S | S | . | . | trans | -134.5 | 134.4 | -179.8 | -166.2 | -86.8 | 0 | 0 | 0 | 110.7 | W126 I127 L226 V227 G230 Y234 | W126-Y232 HydrophobicContact CH2-CD2 4.23Å; W126-Y232 HydrophobicContact CZ2-CD2 4.08Å; I127-Y232 HydrophobicContact CD1-CE2 4.01Å; L226-Y232 PolarHBondContact O-N 3.04Å; V227-Y232 WeakPolarHBondContact CA-O 3.29Å; V227-Y232 HydrophobicContact CG2-CD1 4.05Å; G230-Y232 VanDerWaalsContact C-N 3.32Å; Y232-Y234 AromaticContact CD1-CD2 3.81Å; Y232-Y234 HydrophobicContact CD1-CD2 3.81Å; Y232-Y234 AromaticContact CD1-CE2 3.57Å; Y232-Y234 HydrophobicContact CD1-CE2 3.57Å; Y232-Y234 HydrophobicContact CD1-CG 4.41Å; Y232-Y234 AromaticContact CE1-CD1 3.84Å; Y232-Y234 HydrophobicContact CE1-CD1 3.84Å; Y232-Y234 AromaticContact CE1-CD2 3.6Å; Y232-Y234 HydrophobicContact CE1-CD2 3.6Å; Y232-Y234 AromaticContact CE1-CE1 3.54Å; Y232-Y234 HydrophobicContact CE1-CE1 3.54Å; Y232-Y234 AromaticContact CE1-CE2 3.27Å; Y232-Y234 HydrophobicContact CE1-CE2 3.27Å; Y232-Y234 AromaticContact CE1-CG 3.86Å; Y232-Y234 HydrophobicContact CE1-CG 3.86Å; Y232-Y234 AromaticContact CE1-CZ 3.23Å; Y232-Y234 AromaticContact CZ-CZ 3.96Å | ||
| 233 | Q | 57.4 | Low | 63.5 | Low | 165 Ų | 165 | 85.6 Ų | 85.6 | 77% | 0.771 | 44% | 0.436 | S | S | * | . | trans | -125.2 | 128.8 | 175.7 | -66.8 | -149.9 | -16.4 | 0 | 0 | 111.3 | ||||
| 234 | Y | 57.1 | Low | 63.1 | Low | 50 Ų | 50 | 86.4 Ų | 86.4 | 20% | 0.196 | 44% | 0.443 | C | S | . | . | trans | -91.2 | 133 | 170.4 | -77.3 | -77.9 | 0 | 0 | 0 | 110 | T223 V227 Y232 S236 L246 | T223-Y234 HydrophobicContact CG2-CE2 3.88Å; V227-Y234 HydrophobicContact CG2-CD2 3.97Å; V227-Y234 HydrophobicContact CG2-CE2 4.09Å; Y232-Y234 AromaticContact CD1-CD2 3.81Å; Y232-Y234 HydrophobicContact CD1-CD2 3.81Å; Y232-Y234 AromaticContact CD1-CE2 3.57Å; Y232-Y234 HydrophobicContact CD1-CE2 3.57Å; Y232-Y234 HydrophobicContact CD1-CG 4.41Å; Y232-Y234 AromaticContact CE1-CD1 3.84Å; Y232-Y234 HydrophobicContact CE1-CD1 3.84Å; Y232-Y234 AromaticContact CE1-CD2 3.6Å; Y232-Y234 HydrophobicContact CE1-CD2 3.6Å; Y232-Y234 AromaticContact CE1-CE1 3.54Å; Y232-Y234 HydrophobicContact CE1-CE1 3.54Å; Y232-Y234 AromaticContact CE1-CE2 3.27Å; Y232-Y234 HydrophobicContact CE1-CE2 3.27Å; Y232-Y234 AromaticContact CE1-CG 3.86Å; Y232-Y234 HydrophobicContact CE1-CG 3.86Å; Y232-Y234 AromaticContact CE1-CZ 3.23Å; Y232-Y234 AromaticContact CZ-CZ 3.96Å; Y234-S236 PolarHBondContact O-N 2.82Å; Y234-L246 WeakPolarHBondContact OH-CD1 3.32Å | ||
| 235 | T | 48.8 | Very low | 62.9 | Low | 142 Ų | 142 | 84.8 Ų | 84.8 | 87% | 0.871 | 43% | 0.434 | S | S | * | . | S | Bend | trans | -63.6 | -23 | -178.1 | -38.4 | 0 | 0 | 0 | 0 | 113.3 | ||
| 236 | S | 47.3 | Very low | 62.9 | Low | 59 Ų | 59 | 80.8 Ų | 80.8 | 41% | 0.413 | 41% | 0.413 | S | S | . | . | S | Bend | trans | -152.8 | 105.5 | 170.2 | 40.7 | 0 | 0 | 0 | 0 | 111.5 | Y234 R243 | Y234-S236 PolarHBondContact O-N 2.82Å; S236-R243 PolarHBondContact O-NH1 2.93Å; S236-R243 PolarHBondContact OG-NH1 3.48Å |
| 237 | P | 55.5 | Low | 63.3 | Low | 70 Ų | 70 | 80.8 Ų | 80.8 | 46% | 0.455 | 42% | 0.416 | S | S | . | . | trans | -78.8 | 134.7 | 174.7 | 29 | -30.9 | 0 | 0 | 0 | 111.4 | ||||
| 238 | D | 55.7 | Low | 63.9 | Low | 56 Ų | 56 | 80.6 Ų | 80.6 | 30% | 0.299 | 42% | 0.416 | S | S | . | . | trans | -100.6 | -49.3 | 179.1 | -73.6 | -40.3 | 0 | 0 | 0 | 112.7 | N184 R243 | N184-D238 VanDerWaalsContact CG-CG 3.46Å; N184-D238 VanDerWaalsContact CG-OD2 3.29Å; N184-D238 PolarHBondContact ND2-OD1 3.49Å; N184-D238 PolarHBondContact ND2-OD2 2.52Å; N184-D238 PolarHBondContact OD1-OD2 3.13Å; N184-D238 VanDerWaalsContact OD1-OD2 3.13Å; D238-R243 IonicContact OD1-NH1 3.55Å; D238-R243 VanDerWaalsContact OD2-CG 3.29Å; D238-R243 WeakPolarHBondContact OD2-CG 3.43Å; D238-R243 IonicContact OD2-CZ 3.16Å; D238-R243 IonicContact OD2-NE 3.84Å; D238-R243 PolarHBondContact OD2-NE 2.92Å; D238-R243 VanDerWaalsContact OD2-NE 3.16Å; D238-R243 IonicContact OD2-NH1 3.71Å; D238-R243 IonicContact OD2-NH2 3.2Å | ||
| 239 | F | 46.8 | Very low | 64.6 | Low | 158 Ų | 158 | 71.8 Ų | 71.8 | 69% | 0.693 | 38% | 0.382 | S | S | * | . | B | Isolated β-bridge | trans | -133.4 | 121 | -176.9 | -142.9 | -98.8 | 0 | 0 | 0 | 109.7 | Y241 V242 | F239-Y241 VanDerWaalsContact C-N 3.34Å; F239-Y241 PolarHBondContact O-N 2.89Å; F239-V242 PolarHBondContact N-O 3.47Å; F239-V242 PolarHBondContact O-N 3.46Å; F239-V242 VanDerWaalsContact O-N 3.14Å |
| 240 | L | 45.2 | Very low | 65.4 | Low | 134 Ų | 134 | 69 Ų | 69 | 70% | 0.702 | 36% | 0.364 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 50.2 | 43.3 | 179.9 | -61.9 | 170.2 | 0 | 0 | 0 | 114.5 | Q224 V242 | Q224-L240 PolarHBondContact NE2-O 2.81Å; Q224-L240 PolarHBondContact OE1-O 3.32Å; L240-V242 VanDerWaalsContact C-N 3.27Å; L240-V242 PolarHBondContact O-N 2.87Å |
| 241 | Y | 50.8 | Low | 66.7 | Low | 164 Ų | 164 | 67.5 Ų | 67.5 | 64% | 0.643 | 34% | 0.344 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 70.1 | 2.3 | -179.4 | -60.8 | -95.1 | 0 | 0 | 0 | 117 | F239 | F239-Y241 VanDerWaalsContact C-N 3.34Å; F239-Y241 PolarHBondContact O-N 2.89Å |
| 242 | V | 57.8 | Low | 67.8 | Low | 7 Ų | 7 | 63.3 Ų | 63.3 | 4% | 0.042 | 32% | 0.319 | C | S | . | . | B | Isolated β-bridge | trans | -127.1 | 155.6 | 175.4 | 172.3 | 0 | 0 | 0 | 0 | 110.7 | T223 F239 L240 L246 | T223-V242 HydrophobicContact CG2-CG2 4.22Å; F239-V242 PolarHBondContact N-O 3.47Å; F239-V242 PolarHBondContact O-N 3.46Å; F239-V242 VanDerWaalsContact O-N 3.14Å; L240-V242 VanDerWaalsContact C-N 3.27Å; L240-V242 PolarHBondContact O-N 2.87Å; V242-L246 HydrophobicContact CG1-CB 3.99Å; V242-L246 HydrophobicContact CG1-CD2 3.55Å; V242-L246 HydrophobicContact CG1-CG 4.4Å |
| 243 | R | 68.4 | Low | 69.2 | Low | 36 Ų | 36 | 60.5 Ų | 60.5 | 14% | 0.136 | 31% | 0.311 | C | S | . | . | trans | -80.6 | 131.4 | 179.4 | -142.6 | 153.3 | 173.6 | 119.4 | -7.3 | 111.8 | D180 S236 D238 W245 L246 | D180-R243 IonicContact OD1-NH2 3.95Å; S236-R243 PolarHBondContact O-NH1 2.93Å; S236-R243 PolarHBondContact OG-NH1 3.48Å; D238-R243 IonicContact OD1-NH1 3.55Å; D238-R243 VanDerWaalsContact OD2-CG 3.29Å; D238-R243 WeakPolarHBondContact OD2-CG 3.43Å; D238-R243 IonicContact OD2-CZ 3.16Å; D238-R243 IonicContact OD2-NE 3.84Å; D238-R243 PolarHBondContact OD2-NE 2.92Å; D238-R243 VanDerWaalsContact OD2-NE 3.16Å; D238-R243 IonicContact OD2-NH1 3.71Å; D238-R243 IonicContact OD2-NH2 3.2Å; R243-W245 HydrophobicContact CB-CZ2 4.39Å; R243-W245 VanDerWaalsContact CG-CD1 3.47Å; R243-W245 HydrophobicContact CG-CG 4.43Å; R243-W245 PolarHBondContact O-N 2.86Å; R243-L246 WeakPolarHBondContact O-CB 3.41Å; R243-L246 PolarHBondContact O-N 2.79Å | ||
| 244 | S | 71.1 | Confident | 70.9 | Confident | 37 Ų | 37 | 52.8 Ų | 52.8 | 26% | 0.259 | 28% | 0.276 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -62.8 | -16 | -168.9 | 53.3 | 0 | 0 | 0 | 0 | 114.8 | S188 P247 | S188-S244 VanDerWaalsContact OG-CB 3.29Å; S188-S244 WeakPolarHBondContact OG-CB 3.22Å; S188-S244 PolarHBondContact OG-OG 3.5Å; S244-P247 WeakPolarHBondContact O-CD 3.08Å |
| 245 | W | 75.9 | Confident | 72.5 | Confident | 22 Ų | 22 | 50.4 Ų | 50.4 | 8% | 0.083 | 27% | 0.267 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -83.6 | -17.5 | 174.1 | 56.2 | -102.7 | 0 | 0 | 0 | 114.7 | L187 L191 R243 P247 C248 I249 | L187-W245 HydrophobicContact CD2-CB 3.65Å; L187-W245 HydrophobicContact CD2-CG 3.89Å; L191-W245 HydrophobicContact CD1-CB 3.39Å; L191-W245 HydrophobicContact CD1-CG 4.19Å; R243-W245 HydrophobicContact CB-CZ2 4.39Å; R243-W245 VanDerWaalsContact CG-CD1 3.47Å; R243-W245 HydrophobicContact CG-CG 4.43Å; R243-W245 PolarHBondContact O-N 2.86Å; W245-P247 VanDerWaalsContact C-CD 3.5Å; W245-C248 WeakPolarHBondContact O-CB 3.33Å; W245-C248 PolarHBondContact O-N 2.85Å; W245-C248 VanDerWaalsContact O-N 3.08Å; W245-I249 HydrophobicContact CE3-CG1 3.57Å; W245-I249 HydrophobicContact CZ3-CG1 3.83Å; W245-I249 PolarHBondContact O-N 3.46Å |
| 246 | L | 79.9 | Confident | 74.6 | Confident | 11 Ų | 11 | 43.7 Ų | 43.7 | 6% | 0.058 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -58.8 | -43 | -175.2 | -157.2 | 84.2 | 0 | 0 | 0 | 113.2 | T223 Y234 V242 R243 C248 I249 F250 | T223-L246 HydrophobicContact CG2-CD2 3.77Å; Y234-L246 WeakPolarHBondContact OH-CD1 3.32Å; V242-L246 HydrophobicContact CG1-CB 3.99Å; V242-L246 HydrophobicContact CG1-CD2 3.55Å; V242-L246 HydrophobicContact CG1-CG 4.4Å; R243-L246 WeakPolarHBondContact O-CB 3.41Å; R243-L246 PolarHBondContact O-N 2.79Å; L246-C248 PolarHBondContact O-N 2.87Å; L246-I249 PolarHBondContact O-N 3.07Å; L246-I249 VanDerWaalsContact O-N 3.14Å; L246-F250 HydrophobicContact CD1-CZ 4.48Å; L246-F250 HydrophobicContact CD2-CD2 4.23Å; L246-F250 HydrophobicContact CD2-CE2 3.31Å; L246-F250 HydrophobicContact CD2-CZ 3.75Å; L246-F250 HydrophobicContact CG-CD2 4.08Å; L246-F250 HydrophobicContact CG-CE2 3.53Å; L246-F250 HydrophobicContact CG-CZ 3.92Å; L246-F250 WeakPolarHBondContact O-CD2 3.21Å; L246-F250 PolarHBondContact O-N 3Å |
| 247 | P | 86.5 | Confident | 76.8 | Confident | 45 Ų | 45 | 41.6 Ų | 41.6 | 29% | 0.292 | 21% | 0.21 | S | C | . | . | H | α-helix | trans | -60.2 | -32.9 | 176.4 | -22.3 | 33.7 | 0 | 0 | 0 | 113 | A216 T220 S244 W245 F250 F251 | A216-P247 WeakPolarHBondContact CB-O 3.18Å; T220-P247 HydrophobicContact CG2-CG 4.22Å; S244-P247 WeakPolarHBondContact O-CD 3.08Å; W245-P247 VanDerWaalsContact C-CD 3.5Å; P247-F250 PolarHBondContact O-N 3.4Å; P247-F251 WeakPolarHBondContact O-CB 3.43Å; P247-F251 PolarHBondContact O-N 3.48Å |
| 248 | C | 88.4 | Confident | 78.5 | Confident | 19 Ų | 19 | 38.3 Ų | 38.3 | 13% | 0.128 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -69.2 | -38.4 | 178.2 | -60.1 | 0 | 0 | 0 | 0 | 111.5 | L191 S195 W245 L246 F251 S252 | L191-C248 HydrophobicContact CB-CB 4.2Å; S195-C248 PolarHBondContact OG-O 2.71Å; W245-C248 WeakPolarHBondContact O-CB 3.33Å; W245-C248 PolarHBondContact O-N 2.85Å; W245-C248 VanDerWaalsContact O-N 3.08Å; L246-C248 PolarHBondContact O-N 2.87Å; C248-F251 PolarHBondContact O-N 2.85Å; C248-S252 WeakPolarHBondContact O-CB 3.4Å; C248-S252 PolarHBondContact O-N 3.21Å; C248-S252 PolarHBondContact O-OG 3.13Å |
| 249 | I | 89 | Confident | 80.2 | Confident | 11 Ų | 11 | 35.7 Ų | 35.7 | 6% | 0.056 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -66.7 | -43.1 | 174.6 | -60.1 | -57.7 | 0 | 0 | 0 | 110.7 | F169 I172 N173 W245 L246 F251 S252 G253 | F169-I249 HydrophobicContact CE2-CG2 4.17Å; I172-I249 HydrophobicContact CG2-CD1 3.67Å; N173-I249 HydrophobicContact CB-CD1 4.26Å; W245-I249 HydrophobicContact CE3-CG1 3.57Å; W245-I249 HydrophobicContact CZ3-CG1 3.83Å; W245-I249 PolarHBondContact O-N 3.46Å; L246-I249 PolarHBondContact O-N 3.07Å; L246-I249 VanDerWaalsContact O-N 3.14Å; I249-F251 PolarHBondContact O-N 3.38Å; I249-S252 WeakPolarHBondContact CA-OG 3.35Å; I249-S252 PolarHBondContact O-N 3.44Å; I249-S252 PolarHBondContact O-OG 3.1Å; I249-S252 VanDerWaalsContact O-OG 3.07Å; I249-G253 PolarHBondContact O-N 3.11Å |
| 250 | F | 91.7 | Very high | 82.3 | Confident | 56 Ų | 56 | 28.5 Ų | 28.5 | 25% | 0.246 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -66 | -38 | 176.3 | -67.9 | -42.3 | 0 | 0 | 0 | 112.8 | A216 A219 L246 P247 G254 | A216-F250 HydrophobicContact CB-CB 4.29Å; A219-F250 HydrophobicContact CB-CB 4.05Å; A219-F250 HydrophobicContact CB-CD1 3.88Å; A219-F250 HydrophobicContact CB-CD2 3.44Å; A219-F250 VanDerWaalsContact CB-CD2 3.44Å; A219-F250 HydrophobicContact CB-CE1 4.14Å; A219-F250 HydrophobicContact CB-CE2 3.68Å; A219-F250 HydrophobicContact CB-CG 3.54Å; A219-F250 HydrophobicContact CB-CZ 4.04Å; L246-F250 HydrophobicContact CD1-CZ 4.48Å; L246-F250 HydrophobicContact CD2-CD2 4.23Å; L246-F250 HydrophobicContact CD2-CE2 3.31Å; L246-F250 HydrophobicContact CD2-CZ 3.75Å; L246-F250 HydrophobicContact CG-CD2 4.08Å; L246-F250 HydrophobicContact CG-CE2 3.53Å; L246-F250 HydrophobicContact CG-CZ 3.92Å; L246-F250 WeakPolarHBondContact O-CD2 3.21Å; L246-F250 PolarHBondContact O-N 3Å; P247-F250 PolarHBondContact O-N 3.4Å; F250-G254 PolarHBondContact O-N 3.2Å |
| 251 | F | 93.9 | Very high | 84.4 | Confident | 16 Ų | 16 | 22.3 Ų | 22.3 | 7% | 0.07 | 11% | 0.112 | C | C | . | . | H | α-helix | trans | -60.1 | -53.9 | 173.8 | 177 | -91.7 | 0 | 0 | 0 | 111.4 | L196 W199 F209 I213 A216 P247 C248 I249 G253 G254 V255 | L196-F251 HydrophobicContact CD2-CE1 4.46Å; L196-F251 HydrophobicContact CD2-CZ 4.44Å; W199-F251 HydrophobicContact CB-CE1 3.93Å; W199-F251 HydrophobicContact CB-CZ 4.07Å; W199-F251 HydrophobicContact CG-CZ 4.27Å; F209-F251 HydrophobicContact CD2-CE2 4.18Å; F209-F251 AromaticContact CD2-CZ 3.93Å; F209-F251 HydrophobicContact CD2-CZ 3.93Å; F209-F251 HydrophobicContact CE2-CE2 4.44Å; F209-F251 HydrophobicContact CE2-CZ 4.26Å; I213-F251 HydrophobicContact CG1-CD2 4.17Å; I213-F251 HydrophobicContact CG1-CE2 3.97Å; A216-F251 HydrophobicContact CB-CB 3.94Å; P247-F251 WeakPolarHBondContact O-CB 3.43Å; P247-F251 PolarHBondContact O-N 3.48Å; C248-F251 PolarHBondContact O-N 2.85Å; I249-F251 PolarHBondContact O-N 3.38Å; F251-G253 VanDerWaalsContact C-N 3.35Å; F251-G253 PolarHBondContact O-N 3.38Å; F251-G254 PolarHBondContact O-N 3.34Å; F251-V255 HydrophobicContact CD1-CG2 4.48Å; F251-V255 HydrophobicContact CE1-CG2 4.08Å; F251-V255 HydrophobicContact CZ-CG2 4.08Å; F251-V255 WeakPolarHBondContact O-CG2 3.46Å; F251-V255 PolarHBondContact O-N 3.16Å |
| 252 | S | 93.2 | Very high | 86.2 | Confident | 0 Ų | 0 | 15 Ų | 15 | 0% | 0 | 8% | 0.083 | C | C | . | . | H | α-helix | trans | -65.4 | -36.4 | -178.7 | 52.1 | 0 | 0 | 0 | 0 | 112.6 | C248 I249 T256 | C248-S252 WeakPolarHBondContact O-CB 3.4Å; C248-S252 PolarHBondContact O-N 3.21Å; C248-S252 PolarHBondContact O-OG 3.13Å; I249-S252 WeakPolarHBondContact CA-OG 3.35Å; I249-S252 PolarHBondContact O-N 3.44Å; I249-S252 PolarHBondContact O-OG 3.1Å; I249-S252 VanDerWaalsContact O-OG 3.07Å; S252-T256 WeakPolarHBondContact O-CB 3.12Å; S252-T256 PolarHBondContact O-N 3.11Å; S252-T256 PolarHBondContact O-OG1 2.91Å |
| 253 | G | 92.6 | Very high | 87.6 | Confident | 12 Ų | 12 | 15.1 Ų | 15.1 | 12% | 0.124 | 8% | 0.083 | C | C | . | . | H | α-helix | trans | -64.3 | -45.2 | 172.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | F169 I249 F251 V255 T256 V257 | F169-G253 VanDerWaalsContact CE2-N 3.32Å; I249-G253 PolarHBondContact O-N 3.11Å; F251-G253 VanDerWaalsContact C-N 3.35Å; F251-G253 PolarHBondContact O-N 3.38Å; G253-V255 PolarHBondContact O-N 2.61Å; G253-T256 PolarHBondContact O-N 3.47Å; G253-V257 WeakPolarHBondContact O-CG2 3.39Å; G253-V257 PolarHBondContact O-N 3.32Å |
| 254 | G | 92.4 | Very high | 88.5 | Confident | 3 Ų | 3 | 14.9 Ų | 14.9 | 3% | 0.031 | 8% | 0.084 | C | C | . | . | H | α-helix | trans | -58.5 | -46.6 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | F250 F251 T256 V257 G258 | F250-G254 PolarHBondContact O-N 3.2Å; F251-G254 PolarHBondContact O-N 3.34Å; G254-T256 PolarHBondContact O-N 3.47Å; G254-V257 PolarHBondContact O-N 3.42Å; G254-G258 PolarHBondContact O-N 2.88Å |
| 255 | V | 92.1 | Very high | 89.2 | Confident | 0 Ų | 0 | 13.9 Ų | 13.9 | 0% | 0 | 8% | 0.078 | C | C | . | . | H | α-helix | trans | -62.3 | -43 | 175 | 174.9 | 0 | 0 | 0 | 0 | 111.3 | L198 W199 D203 F251 G253 G258 N259 | L198-V255 HydrophobicContact CD2-CB 4.2Å; L198-V255 HydrophobicContact CD2-CG1 3.79Å; W199-V255 HydrophobicContact CB-CG2 4.5Å; D203-V255 HydrophobicContact CB-CG1 3.83Å; F251-V255 HydrophobicContact CD1-CG2 4.48Å; F251-V255 HydrophobicContact CE1-CG2 4.08Å; F251-V255 HydrophobicContact CZ-CG2 4.08Å; F251-V255 WeakPolarHBondContact O-CG2 3.46Å; F251-V255 PolarHBondContact O-N 3.16Å; G253-V255 PolarHBondContact O-N 2.61Å; V255-G258 PolarHBondContact O-N 3.25Å; V255-N259 WeakPolarHBondContact O-CB 3.44Å; V255-N259 PolarHBondContact O-N 2.85Å; V255-N259 PolarHBondContact O-ND2 2.96Å; V255-N259 PolarHBondContact O-OD1 3.5Å |
| 256 | T | 92.9 | Very high | 89.2 | Confident | 1 Ų | 1 | 15.8 Ų | 15.8 | 1% | 0.006 | 9% | 0.089 | C | C | . | . | H | α-helix | trans | -63.6 | -45.7 | 179.8 | -57.3 | 0 | 0 | 0 | 0 | 111.8 | I166 F169 S252 G253 G254 N259 I260 | I166-T256 HydrophobicContact CB-CG2 4.46Å; I166-T256 HydrophobicContact CG1-CG2 3.71Å; F169-T256 HydrophobicContact CB-CG2 4.39Å; F169-T256 HydrophobicContact CD1-CG2 4.5Å; S252-T256 WeakPolarHBondContact O-CB 3.12Å; S252-T256 PolarHBondContact O-N 3.11Å; S252-T256 PolarHBondContact O-OG1 2.91Å; G253-T256 PolarHBondContact O-N 3.47Å; G254-T256 PolarHBondContact O-N 3.47Å; T256-N259 VanDerWaalsContact O-CB 3.32Å; T256-N259 WeakPolarHBondContact O-CB 3.49Å; T256-N259 PolarHBondContact O-N 2.83Å; T256-I260 WeakPolarHBondContact O-CG1 3.26Å; T256-I260 PolarHBondContact O-N 3.47Å; T256-I260 VanDerWaalsContact O-N 3.14Å |
| 257 | V | 93.2 | Very high | 88.4 | Confident | 16 Ų | 16 | 17.9 Ų | 17.9 | 10% | 0.097 | 11% | 0.114 | C | C | . | . | H | α-helix | trans | -70 | -41.5 | 178.4 | 176.1 | 0 | 0 | 0 | 0 | 111.6 | L89 A135 G253 G254 N259 I260 G261 | L89-V257 HydrophobicContact CD2-CG1 4Å; A135-V257 HydrophobicContact CB-CB 4.49Å; A135-V257 HydrophobicContact CB-CG1 3.75Å; A135-V257 HydrophobicContact CB-CG2 3.99Å; A135-V257 WeakPolarHBondContact O-CG1 3.25Å; G253-V257 WeakPolarHBondContact O-CG2 3.39Å; G253-V257 PolarHBondContact O-N 3.32Å; G254-V257 PolarHBondContact O-N 3.42Å; V257-N259 PolarHBondContact O-N 3.41Å; V257-I260 PolarHBondContact O-N 3.08Å; V257-I260 VanDerWaalsContact O-N 3.13Å; V257-G261 PolarHBondContact O-N 3.49Å |
| 258 | G | 91 | Very high | 86.9 | Confident | 0 Ų | 0 | 18.1 Ų | 18.1 | 0% | 0 | 12% | 0.124 | C | C | . | . | H | α-helix | trans | -55.7 | -34.7 | 171 | 0 | 0 | 0 | 0 | 0 | 111.7 | Y142 G254 V255 G261 R262 | Y142-G258 VanDerWaalsContact CG-CA 3.41Å; G254-G258 PolarHBondContact O-N 2.88Å; V255-G258 PolarHBondContact O-N 3.25Å; G258-G261 PolarHBondContact O-N 3.39Å; G258-R262 WeakPolarHBondContact O-CG 3.29Å; G258-R262 PolarHBondContact O-N 3.49Å |
| 259 | N | 90.3 | Very high | 85.2 | Confident | 1 Ų | 1 | 22.5 Ų | 22.5 | 1% | 0.005 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -67.8 | -41.4 | 177.1 | -70.8 | -15.4 | 0 | 0 | 0 | 114.2 | R157 D203 V255 T256 V257 G261 Q263 | R157-N259 VanDerWaalsContact CZ-OD1 3.22Å; R157-N259 PolarHBondContact NH1-ND2 3.05Å; R157-N259 PolarHBondContact NH1-OD1 3.33Å; R157-N259 PolarHBondContact NH2-O 3.38Å; R157-N259 PolarHBondContact NH2-OD1 2.71Å; D203-N259 PolarHBondContact OD1-OD1 3.11Å; V255-N259 WeakPolarHBondContact O-CB 3.44Å; V255-N259 PolarHBondContact O-N 2.85Å; V255-N259 PolarHBondContact O-ND2 2.96Å; V255-N259 PolarHBondContact O-OD1 3.5Å; T256-N259 VanDerWaalsContact O-CB 3.32Å; T256-N259 WeakPolarHBondContact O-CB 3.49Å; T256-N259 PolarHBondContact O-N 2.83Å; V257-N259 PolarHBondContact O-N 3.41Å; N259-G261 VanDerWaalsContact C-N 3.34Å; N259-Q263 WeakPolarHBondContact O-CG 3.18Å; N259-Q263 PolarHBondContact O-N 3.39Å |
| 260 | I | 91.3 | Very high | 82.8 | Confident | 8 Ų | 8 | 30.3 Ų | 30.3 | 4% | 0.041 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -64.4 | -42.5 | 173.1 | -61.6 | 162.1 | 0 | 0 | 0 | 109.7 | L89 V92 V162 I166 T256 V257 R262 Q263 L264 | L89-I260 HydrophobicContact CD2-CB 4.1Å; L89-I260 HydrophobicContact CD2-CG2 3.78Å; V92-I260 HydrophobicContact CG1-CD1 3.94Å; V162-I260 HydrophobicContact CG1-CG1 3.58Å; I166-I260 HydrophobicContact CD1-CD1 4.05Å; I166-I260 HydrophobicContact CD1-CG1 4.47Å; I166-I260 HydrophobicContact CG1-CD1 4.32Å; T256-I260 WeakPolarHBondContact O-CG1 3.26Å; T256-I260 PolarHBondContact O-N 3.47Å; T256-I260 VanDerWaalsContact O-N 3.14Å; V257-I260 PolarHBondContact O-N 3.08Å; V257-I260 VanDerWaalsContact O-N 3.13Å; I260-R262 PolarHBondContact O-N 3.02Å; I260-Q263 WeakPolarHBondContact O-CB 3.49Å; I260-Q263 PolarHBondContact O-N 3.38Å; I260-Q263 VanDerWaalsContact O-N 3.09Å; I260-L264 HydrophobicContact CG2-CD1 3.87Å; I260-L264 HydrophobicContact CG2-CG 4.28Å; I260-L264 WeakPolarHBondContact O-CG 3.28Å; I260-L264 PolarHBondContact O-N 3.48Å |
| 261 | G | 90.5 | Very high | 80.4 | Confident | 3 Ų | 3 | 36 Ų | 36 | 3% | 0.031 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -57.3 | -48.1 | 178.1 | 0 | 0 | 0 | 0 | 0 | 113.5 | G139 V257 G258 N259 Q263 L264 A265 | G139-G261 VanDerWaalsContact O-CA 3.25Å; G139-G261 WeakPolarHBondContact O-CA 3.45Å; V257-G261 PolarHBondContact O-N 3.49Å; G258-G261 PolarHBondContact O-N 3.39Å; N259-G261 VanDerWaalsContact C-N 3.34Å; G261-Q263 VanDerWaalsContact C-N 3.26Å; G261-Q263 PolarHBondContact O-N 3.3Å; G261-L264 PolarHBondContact O-N 3.3Å; G261-A265 WeakPolarHBondContact O-CB 3.3Å; G261-A265 PolarHBondContact O-N 3.23Å |
| 262 | R | 88.2 | Confident | 77.7 | Confident | 10 Ų | 10 | 40.4 Ų | 40.4 | 4% | 0.038 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -57.5 | -38.6 | 173.4 | -72.6 | 167.1 | 169 | 148.2 | -0.1 | 112.8 | D146 D203 S205 S207 G258 I260 A265 M266 | D146-R262 IonicContact OD1-CZ 2.65Å; D146-R262 IonicContact OD1-NE 2.81Å; D146-R262 IonicContact OD1-NH2 3.81Å; D146-R262 PolarHBondContact OD1-NH2 3.34Å; D146-R262 IonicContact OD2-CZ 2.82Å; D146-R262 VanDerWaalsContact OD2-CZ 3.29Å; D146-R262 IonicContact OD2-NE 3.84Å; D146-R262 PolarHBondContact OD2-NE 3.08Å; D146-R262 IonicContact OD2-NH2 3.85Å; D146-R262 PolarHBondContact OD2-NH2 3.42Å; D146-R262 VanDerWaalsContact OD2-NH2 3.13Å; D203-R262 IonicContact OD1-CZ 3.13Å; D203-R262 IonicContact OD1-NH1 3.03Å; D203-R262 PolarHBondContact OD1-NH1 3.4Å; D203-R262 IonicContact OD2-CZ 3.75Å; D203-R262 IonicContact OD2-NH1 2.6Å; D203-R262 PolarHBondContact OD2-NH1 2.91Å; S205-R262 PolarHBondContact OG-NH1 2.99Å; S205-R262 VanDerWaalsContact OG-NH1 3.09Å; S205-R262 PolarHBondContact OG-NH2 2.92Å; S207-R262 PolarHBondContact OG-NH2 2.98Å; G258-R262 WeakPolarHBondContact O-CG 3.29Å; G258-R262 PolarHBondContact O-N 3.49Å; I260-R262 PolarHBondContact O-N 3.02Å; R262-A265 WeakPolarHBondContact O-CB 3.49Å; R262-A265 PolarHBondContact O-N 2.96Å; R262-M266 HydrophobicContact CB-CE 4.5Å; R262-M266 WeakPolarHBondContact O-CE 3Å; R262-M266 WeakPolarHBondContact O-CG 3.35Å; R262-M266 PolarHBondContact O-N 2.92Å; R262-M266 VanDerWaalsContact O-N 3.11Å |
| 263 | Q | 87.6 | Confident | 75.1 | Confident | 10 Ų | 10 | 48.1 Ų | 48.1 | 5% | 0.047 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -72.1 | -43.9 | -177.7 | -70.2 | -84.4 | 45.2 | 0 | 0 | 112.6 | R157 E158 W159 V162 N259 I260 G261 A265 M266 G267 | R157-Q263 VanDerWaalsContact CG-NE2 3.31Å; R157-Q263 PolarHBondContact O-NE2 2.93Å; R157-Q263 PolarHBondContact O-OE1 2.87Å; R157-Q263 VanDerWaalsContact O-OE1 3.12Å; E158-Q263 PolarHBondContact O-NE2 3.49Å; W159-Q263 HydrophobicContact CH2-CB 4.29Å; W159-Q263 HydrophobicContact CZ3-CB 4.46Å; V162-Q263 HydrophobicContact CG2-CB 4.46Å; V162-Q263 HydrophobicContact CG2-CG 3.56Å; N259-Q263 WeakPolarHBondContact O-CG 3.18Å; N259-Q263 PolarHBondContact O-N 3.39Å; I260-Q263 WeakPolarHBondContact O-CB 3.49Å; I260-Q263 PolarHBondContact O-N 3.38Å; I260-Q263 VanDerWaalsContact O-N 3.09Å; G261-Q263 VanDerWaalsContact C-N 3.26Å; G261-Q263 PolarHBondContact O-N 3.3Å; Q263-A265 PolarHBondContact O-N 3Å; Q263-M266 HydrophobicContact CG-CE 4.3Å; Q263-M266 PolarHBondContact O-N 2.96Å; Q263-G267 PolarHBondContact O-N 3.14Å |
| 264 | L | 87.1 | Confident | 72.7 | Confident | 31 Ų | 31 | 56 Ų | 56 | 16% | 0.162 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -63.1 | -29.3 | 171.3 | -66.1 | 172.2 | 0 | 0 | 0 | 111.7 | R85 V88 L89 W159 I260 G261 | R85-L264 HydrophobicContact CG-CB 4.22Å; R85-L264 VanDerWaalsContact CZ-O 3.28Å; R85-L264 PolarHBondContact NE-O 2.76Å; R85-L264 PolarHBondContact NH2-O 2.92Å; R85-L264 VanDerWaalsContact NH2-O 3.15Å; V88-L264 HydrophobicContact CB-CD1 4.16Å; V88-L264 HydrophobicContact CG1-CD1 3.79Å; V88-L264 HydrophobicContact CG1-CD2 4.08Å; L89-L264 HydrophobicContact CD1-CD1 4.48Å; L89-L264 HydrophobicContact CD2-CD1 4.04Å; L89-L264 HydrophobicContact CG-CD1 3.81Å; W159-L264 HydrophobicContact CH2-CD2 3.97Å; I260-L264 HydrophobicContact CG2-CD1 3.87Å; I260-L264 HydrophobicContact CG2-CG 4.28Å; I260-L264 WeakPolarHBondContact O-CG 3.28Å; I260-L264 PolarHBondContact O-N 3.48Å; G261-L264 PolarHBondContact O-N 3.3Å |
| 265 | A | 84.9 | Confident | 70.4 | Confident | 16 Ų | 16 | 65.9 Ų | 65.9 | 13% | 0.132 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -67.2 | -39.5 | 174.5 | 0 | 0 | 0 | 0 | 0 | 113.2 | R85 P143 G261 R262 Q263 | R85-A265 VanDerWaalsContact CZ-CA 3.43Å; R85-A265 PolarHBondContact NH2-O 3.41Å; P143-A265 HydrophobicContact CB-CB 3.86Å; P143-A265 HydrophobicContact CG-CB 3.78Å; G261-A265 WeakPolarHBondContact O-CB 3.3Å; G261-A265 PolarHBondContact O-N 3.23Å; R262-A265 WeakPolarHBondContact O-CB 3.49Å; R262-A265 PolarHBondContact O-N 2.96Å; Q263-A265 PolarHBondContact O-N 3Å |
| 266 | M | 76.3 | Confident | 69.4 | Low | 63 Ų | 63 | 69.2 Ų | 69.2 | 31% | 0.31 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -74.8 | -41 | 179.3 | -71 | -177.4 | -80.4 | 0 | 0 | 113.1 | R262 Q263 G268 V269 | R262-M266 HydrophobicContact CB-CE 4.5Å; R262-M266 WeakPolarHBondContact O-CE 3Å; R262-M266 WeakPolarHBondContact O-CG 3.35Å; R262-M266 PolarHBondContact O-N 2.92Å; R262-M266 VanDerWaalsContact O-N 3.11Å; Q263-M266 HydrophobicContact CG-CE 4.3Å; Q263-M266 PolarHBondContact O-N 2.96Å; M266-G268 PolarHBondContact O-N 3.32Å; M266-G268 VanDerWaalsContact O-N 3.1Å; M266-V269 PolarHBondContact O-N 3.22Å |
| 267 | G | 62.2 | Low | 68.1 | Low | 55 Ų | 55 | 72.8 Ų | 72.8 | 57% | 0.567 | 40% | 0.403 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -68.5 | -6.4 | -177.5 | 0 | 0 | 0 | 0 | 0 | 115.9 | Q263 | Q263-G267 PolarHBondContact O-N 3.14Š|
| 268 | G | 55.7 | Low | 66.7 | Low | 50 Ų | 50 | 75.9 Ų | 75.9 | 52% | 0.515 | 42% | 0.42 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -88.4 | -0.6 | 175.6 | 0 | 0 | 0 | 0 | 0 | 114.8 | M266 | M266-G268 PolarHBondContact O-N 3.32Å; M266-G268 VanDerWaalsContact O-N 3.1Å |
| 269 | V | 52.3 | Low | 65.3 | Low | 111 Ų | 111 | 80.4 Ų | 80.4 | 67% | 0.673 | 45% | 0.445 | S | S | * | . | trans | -106.4 | 11.9 | -174.5 | -171.2 | 0 | 0 | 0 | 0 | 111.9 | M266 K271 | M266-V269 PolarHBondContact O-N 3.22Å; V269-K271 PolarHBondContact O-N 3.4Å; V269-K271 VanDerWaalsContact O-N 3.11Å | ||
| 270 | E | 40.2 | Very low | 63.7 | Low | 175 Ų | 175 | 85.4 Ų | 85.4 | 82% | 0.818 | 47% | 0.472 | S | S | * | . | trans | -73.8 | 108.3 | 175 | -142 | 167.2 | 142.3 | 0 | 0 | 109.5 | ||||
| 271 | K | 39.9 | Very low | 61.9 | Low | 176 Ų | 176 | 90.5 Ų | 90.5 | 77% | 0.765 | 50% | 0.501 | S | S | * | . | trans | -59.1 | 149.2 | 179 | -70.9 | 176.5 | 176.3 | 176.8 | 0 | 110.4 | V269 H273 | V269-K271 PolarHBondContact O-N 3.4Å; V269-K271 VanDerWaalsContact O-N 3.11Å; K271-H273 PolarHBondContact O-N 2.77Å; K271-H273 VanDerWaalsContact O-N 3.1Å | ||
| 272 | P | 37.8 | Very low | 59.9 | Low | 108 Ų | 108 | 96.8 Ų | 96.8 | 70% | 0.701 | 53% | 0.534 | S | S | * | . | trans | -59.1 | 120.8 | 167.1 | 25.8 | -30.5 | 0 | 0 | 0 | 108.3 | M274 | P272-M274 PolarHBondContact O-N 2.91Å; P272-M274 VanDerWaalsContact O-N 3.13Å | ||
| 273 | H | 37.6 | Very low | 57.7 | Low | 162 Ų | 162 | 103.5 Ų | 103.5 | 75% | 0.75 | 57% | 0.572 | S | S | * | * | trans | -58.1 | 113 | 160.3 | -102.4 | 54.4 | 0 | 0 | 0 | 106.4 | K271 D275 | K271-H273 PolarHBondContact O-N 2.77Å; K271-H273 VanDerWaalsContact O-N 3.1Å; H273-D275 IonicContact CD2-OD1 3.68Å | ||
| 274 | M | 43.1 | Very low | 55.2 | Low | 176 Ų | 176 | 111.3 Ų | 111.3 | 87% | 0.867 | 62% | 0.616 | S | S | * | * | trans | -87.9 | 99.6 | 161.5 | -75.7 | -97.4 | 139.4 | 0 | 0 | 104.7 | P272 | P272-M274 PolarHBondContact O-N 2.91Å; P272-M274 VanDerWaalsContact O-N 3.13Å | ||
| 275 | D | 45.3 | Very low | 52.3 | Low | 212 Ų | 212 | 118.5 Ų | 118.5 | 100% | 1.134 | 66% | 0.658 | S | S | * | * | trans | -77.2 | 0 | 162.5 | -66.4 | -29.7 | 0 | 0 | 0 | 109.7 | H273 | H273-D275 IonicContact CD2-OD1 3.68Š|
Retrieved 275 of 275 residues in 102 ms
(Link to these results)