| 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 | 56.2 | Low | 58.2 | Low | 200 Ų | 200 | 127.6 Ų | 127.6 | 99% | 0.985 | 66% | 0.663 | S | S | * | * | 0 | -28.9 | 0 | -62.2 | -62.3 | -99.4 | 0 | 0 | 115.1 | |||||
| 2 | K | 55.3 | Low | 58.4 | Low | 192 Ų | 192 | 128.5 Ų | 128.5 | 84% | 0.835 | 67% | 0.668 | S | S | * | * | trans | -90.9 | -25.1 | -179.4 | -74.8 | 168.2 | 176.2 | 169.3 | 0 | 114.9 | ||||
| 3 | V | 55 | Low | 58.5 | Low | 114 Ų | 114 | 130.2 Ų | 130.2 | 69% | 0.691 | 68% | 0.678 | S | S | * | * | H | α-helix | trans | -73.9 | -34.4 | -179.5 | -170.5 | 0 | 0 | 0 | 0 | 112.2 | R5 A6 L7 | V3-R5 VanDerWaalsContact C-N 3.3Å; V3-R5 PolarHBondContact O-N 2.85Å; V3-A6 PolarHBondContact O-N 3.13Å; V3-L7 PolarHBondContact O-N 3.09Å |
| 4 | L | 57.2 | Low | 58.5 | Low | 120 Ų | 120 | 128.5 Ų | 128.5 | 63% | 0.628 | 68% | 0.68 | S | S | * | * | H | α-helix | trans | -64.7 | -30.9 | 177.8 | -75.3 | 161.3 | 0 | 0 | 0 | 113.3 | L8 | L4-L8 PolarHBondContact O-N 3.42Å |
| 5 | R | 58.3 | Low | 57.6 | Low | 194 Ų | 194 | 124.6 Ų | 124.6 | 73% | 0.732 | 68% | 0.683 | S | S | * | * | H | α-helix | trans | -72.8 | -33.5 | 179 | -73.3 | -167.2 | 172.2 | -167.7 | -2 | 112.7 | V3 L9 | V3-R5 VanDerWaalsContact C-N 3.3Å; V3-R5 PolarHBondContact O-N 2.85Å; R5-L9 WeakPolarHBondContact O-CD1 3.37Å; R5-L9 WeakPolarHBondContact O-CG 3.49Å; R5-L9 PolarHBondContact O-N 2.84Å |
| 6 | A | 59.6 | Low | 57.1 | Low | 64 Ų | 64 | 127.9 Ų | 127.9 | 53% | 0.529 | 69% | 0.692 | S | S | . | * | H | α-helix | trans | -70.4 | -36.3 | 176.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | V3 L9 A10 | V3-A6 PolarHBondContact O-N 3.13Å; A6-L9 PolarHBondContact O-N 2.9Å; A6-A10 PolarHBondContact O-N 3.25Å |
| 7 | L | 59.4 | Low | 56.7 | Low | 113 Ų | 113 | 128.4 Ų | 128.4 | 59% | 0.592 | 70% | 0.703 | S | S | * | * | H | α-helix | trans | -69.7 | -37.3 | 177.8 | -118.5 | 119.4 | 0 | 0 | 0 | 112.9 | V3 A10 L11 | V3-L7 PolarHBondContact O-N 3.09Å; L7-A10 PolarHBondContact O-N 3.43Å; L7-L11 PolarHBondContact O-N 2.8Å |
| 8 | L | 60.4 | Low | 55.8 | Low | 109 Ų | 109 | 125.1 Ų | 125.1 | 57% | 0.571 | 70% | 0.704 | S | S | * | * | H | α-helix | trans | -64.4 | -38.7 | 174.8 | -91.9 | 156.6 | 0 | 0 | 0 | 112.8 | L4 L11 L12 | L4-L8 PolarHBondContact O-N 3.42Å; L8-L11 PolarHBondContact O-N 2.84Å; L8-L12 PolarHBondContact O-N 3.37Å |
| 9 | L | 60.4 | Low | 55.3 | Low | 111 Ų | 111 | 131.2 Ų | 131.2 | 58% | 0.581 | 72% | 0.715 | S | S | * | * | H | α-helix | trans | -68.9 | -34.2 | 178 | -74.8 | 162.7 | 0 | 0 | 0 | 112.1 | R5 A6 L13 | R5-L9 WeakPolarHBondContact O-CD1 3.37Å; R5-L9 WeakPolarHBondContact O-CG 3.49Å; R5-L9 PolarHBondContact O-N 2.84Å; A6-L9 PolarHBondContact O-N 2.9Å; L9-L13 WeakPolarHBondContact O-CD1 3.44Å; L9-L13 WeakPolarHBondContact O-CG 3.35Å |
| 10 | A | 60.6 | Low | 54.3 | Low | 57 Ų | 57 | 128.6 Ų | 128.6 | 47% | 0.471 | 72% | 0.72 | S | S | . | * | H | α-helix | trans | -69.7 | -36.3 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.8 | A6 L7 L13 | A6-A10 PolarHBondContact O-N 3.25Å; L7-A10 PolarHBondContact O-N 3.43Å; A10-L13 PolarHBondContact O-N 2.75Å |
| 11 | L | 58.1 | Low | 53.5 | Low | 130 Ų | 130 | 130.6 Ų | 130.6 | 68% | 0.681 | 72% | 0.724 | S | S | * | * | H | α-helix | trans | -69 | -33.3 | 177.5 | -78.4 | 162.6 | 0 | 0 | 0 | 113 | L7 L8 L13 | L7-L11 PolarHBondContact O-N 2.8Å; L8-L11 PolarHBondContact O-N 2.84Å; L11-L13 VanDerWaalsContact C-N 3.33Å |
| 12 | L | 60.8 | Low | 52.4 | Low | 138 Ų | 138 | 125 Ų | 125 | 72% | 0.723 | 71% | 0.709 | S | S | * | * | H | α-helix | trans | -72.2 | -24.9 | 177.7 | -78.9 | 160.7 | 0 | 0 | 0 | 113.4 | L8 | L8-L12 PolarHBondContact O-N 3.37Å |
| 13 | L | 59.6 | Low | 51.7 | Low | 151 Ų | 151 | 123.8 Ų | 123.8 | 79% | 0.791 | 71% | 0.706 | S | S | * | * | H | α-helix | trans | -94.4 | -8.7 | -175 | -71.7 | 164.7 | 0 | 0 | 0 | 114 | L9 A10 L11 | L9-L13 WeakPolarHBondContact O-CD1 3.44Å; L9-L13 WeakPolarHBondContact O-CG 3.35Å; A10-L13 PolarHBondContact O-N 2.75Å; L11-L13 VanDerWaalsContact C-N 3.33Å |
| 14 | C | 57.6 | Low | 50.9 | Low | 106 Ų | 106 | 126.5 Ų | 126.5 | 72% | 0.716 | 71% | 0.712 | S | S | * | * | trans | -108.5 | 12.2 | -179.3 | -69.6 | 0 | 0 | 0 | 0 | 114.4 | Q16 | C14-Q16 PolarHBondContact O-N 2.76Š| ||
| 15 | G | 46.1 | Very low | 50 | Low | 70 Ų | 70 | 127.5 Ų | 127.5 | 72% | 0.722 | 71% | 0.713 | S | S | * | * | trans | -72.4 | 86.4 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 16 | Q | 49.3 | Very low | 49.2 | Very low | 178 Ų | 178 | 127.6 Ų | 127.6 | 83% | 0.832 | 72% | 0.722 | S | S | * | * | trans | -66.4 | 144.4 | 164.4 | -74.3 | -173.2 | -67.3 | 0 | 0 | 110.7 | C14 G18 | C14-Q16 PolarHBondContact O-N 2.76Å; Q16-G18 PolarHBondContact O-N 3.02Å | ||
| 17 | P | 50.2 | Low | 48.3 | Very low | 135 Ų | 135 | 132 Ų | 132 | 88% | 0.877 | 73% | 0.731 | S | S | * | * | trans | -74.6 | 92.7 | 170 | 30.1 | -29.2 | 0 | 0 | 0 | 109 | ||||
| 18 | G | 41.2 | Very low | 47.6 | Very low | 70 Ų | 70 | 134.8 Ų | 134.8 | 72% | 0.722 | 75% | 0.747 | S | S | * | * | trans | -95.2 | 101.6 | 177 | 0 | 0 | 0 | 0 | 0 | 111.7 | Q16 | Q16-G18 PolarHBondContact O-N 3.02Š| ||
| 19 | R | 44.9 | Very low | 47 | Very low | 241 Ų | 241 | 137.8 Ų | 137.8 | 91% | 0.909 | 76% | 0.758 | S | S | * | * | trans | -27.1 | 128.4 | 153.4 | -174.5 | 176.9 | 171.4 | 155.5 | -1.6 | 113.2 | ||||
| 20 | G | 35.8 | Very low | 46.4 | Very low | 79 Ų | 79 | 139.9 Ų | 139.9 | 81% | 0.814 | 77% | 0.77 | S | S | * | * | trans | -158.1 | 114.9 | 173.5 | 0 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 21 | Q | 36.7 | Very low | 45.7 | Very low | 171 Ų | 171 | 145.5 Ų | 145.5 | 80% | 0.799 | 79% | 0.786 | S | S | * | * | trans | -101.9 | 151.2 | -174.2 | -177.8 | -176.2 | -12.1 | 0 | 0 | 108.7 | ||||
| 22 | A | 35.1 | Very low | 45.4 | Very low | 81 Ų | 81 | 145.9 Ų | 145.9 | 67% | 0.669 | 79% | 0.789 | S | S | * | * | trans | 62.6 | 156.7 | 160 | 0 | 0 | 0 | 0 | 0 | 116.9 | ||||
| 23 | Q | 40.2 | Very low | 44.7 | Very low | 168 Ų | 168 | 148 Ų | 148 | 79% | 0.785 | 80% | 0.795 | S | S | * | * | cis | -172.6 | 145 | -15.8 | -109.9 | 169.4 | -35.8 | 0 | 0 | 102.9 | ||||
| 24 | Q | 37.4 | Very low | 44.3 | Very low | 171 Ų | 171 | 148.4 Ų | 148.4 | 80% | 0.799 | 79% | 0.79 | S | S | * | * | trans | 168.5 | 104.6 | 141 | -97 | 166.7 | 14.3 | 0 | 0 | 107.2 | ||||
| 25 | E | 38.9 | Very low | 44.4 | Very low | 141 Ų | 141 | 148.5 Ų | 148.5 | 66% | 0.659 | 79% | 0.789 | S | S | * | * | 77.1 | 96.6 | 81.2 | -76.1 | 171.2 | -156.8 | 0 | 0 | 110.3 | |||||
| 26 | E | 40.6 | Very low | 44.6 | Very low | 195 Ų | 195 | 150.5 Ų | 150.5 | 91% | 0.911 | 78% | 0.784 | S | S | * | * | trans | -133.5 | 115.2 | 136.1 | -72 | -75.3 | 160.8 | 0 | 0 | 104.3 | ||||
| 27 | E | 40.8 | Very low | 44.8 | Very low | 156 Ų | 156 | 149.3 Ų | 149.3 | 73% | 0.729 | 78% | 0.783 | S | S | * | * | trans | -68.6 | 140.4 | 175.9 | -62.8 | 167.1 | 150.7 | 0 | 0 | 109.1 | ||||
| 28 | D | 44.4 | Very low | 45 | Very low | 173 Ų | 173 | 149 Ų | 149 | 93% | 0.925 | 77% | 0.774 | S | S | * | * | trans | -149.1 | 118.1 | 139.4 | -88.5 | -37.7 | 0 | 0 | 0 | 107 | ||||
| 29 | E | 48.2 | Very low | 45.8 | Very low | 172 Ų | 172 | 153.9 Ų | 153.9 | 80% | 0.804 | 78% | 0.784 | S | S | * | * | trans | -65.4 | 147.8 | -179.7 | -57.1 | 174.1 | 137.4 | 0 | 0 | 110.2 | ||||
| 30 | D | 48.7 | Very low | 46.5 | Very low | 155 Ų | 155 | 149.7 Ų | 149.7 | 83% | 0.829 | 77% | 0.774 | S | S | * | * | trans | 179.5 | 106.1 | 133.2 | -82.8 | -24.4 | 0 | 0 | 0 | 111.3 | ||||
| 31 | E | 45.3 | Very low | 47.4 | Very low | 175 Ų | 175 | 154 Ų | 154 | 82% | 0.818 | 77% | 0.773 | S | S | * | * | trans | 49.7 | 103.6 | 138.9 | -64.8 | -164.5 | 138.5 | 0 | 0 | 122.5 | ||||
| 32 | D | 52.4 | Low | 48.5 | Very low | 138 Ų | 138 | 153.2 Ų | 153.2 | 74% | 0.738 | 77% | 0.774 | S | S | * | * | 72 | 151.3 | 112.8 | -143.5 | 3 | 0 | 0 | 0 | 120.4 | |||||
| 33 | H | 45.2 | Very low | 49.5 | Very low | 183 Ų | 183 | 158 Ų | 158 | 85% | 0.847 | 78% | 0.783 | S | S | * | * | trans | 114.5 | 71.5 | 179.5 | -62 | 74.7 | 0 | 0 | 0 | 115.2 | ||||
| 34 | K | 52.3 | Low | 50.3 | Low | 158 Ų | 158 | 156.6 Ų | 156.6 | 69% | 0.687 | 78% | 0.781 | S | S | * | * | trans | -110.9 | 149.3 | 130.3 | -129.5 | -164.8 | 82.2 | 157.8 | 0 | 106.6 | D36 | K34-D36 WeakPolarHBondContact CE-OD1 3.43Å; K34-D36 IonicContact NZ-OD1 2.8Å; K34-D36 PolarHBondContact NZ-OD1 2.79Å | ||
| 35 | P | 58 | Low | 51.1 | Low | 108 Ų | 108 | 157.7 Ų | 157.7 | 70% | 0.701 | 79% | 0.786 | S | S | * | * | -141.7 | -177.7 | 65.8 | 17.2 | 9.4 | 0 | 0 | 0 | 111.2 | |||||
| 36 | D | 50.2 | Low | 52 | Low | 113 Ų | 113 | 157.4 Ų | 157.4 | 60% | 0.604 | 79% | 0.793 | S | S | * | * | cis | -172.8 | 154.7 | -9.5 | -92.4 | -32.9 | 0 | 0 | 0 | 103 | K34 | K34-D36 WeakPolarHBondContact CE-OD1 3.43Å; K34-D36 IonicContact NZ-OD1 2.8Å; K34-D36 PolarHBondContact NZ-OD1 2.79Å | ||
| 37 | D | 54.2 | Low | 52.5 | Low | 153 Ų | 153 | 156.3 Ų | 156.3 | 82% | 0.818 | 79% | 0.788 | S | S | * | * | 172.1 | 144.6 | 123.3 | -128.7 | -52.4 | 0 | 0 | 0 | 110.8 | |||||
| 38 | D | 54.2 | Low | 53 | Low | 128 Ų | 128 | 156.5 Ų | 156.5 | 68% | 0.684 | 79% | 0.789 | S | S | * | * | trans | -78.5 | 156.3 | -166 | -61.8 | -71.3 | 0 | 0 | 0 | 113.3 | ||||
| 39 | D | 59.4 | Low | 53.3 | Low | 173 Ų | 173 | 156.7 Ų | 156.7 | 93% | 0.925 | 79% | 0.785 | S | S | * | * | -157.3 | 119.1 | 129 | -113.5 | -21.3 | 0 | 0 | 0 | 110.6 | |||||
| 40 | E | 58.8 | Low | 53.6 | Low | 152 Ų | 152 | 157.4 Ų | 157.4 | 71% | 0.71 | 79% | 0.788 | S | S | * | * | trans | -82.9 | 157 | 175.9 | -71.7 | -83.2 | -171.4 | 0 | 0 | 110.4 | ||||
| 41 | E | 54.7 | Low | 53.6 | Low | 170 Ų | 170 | 153.4 Ų | 153.4 | 79% | 0.794 | 77% | 0.769 | S | S | * | * | trans | 68.8 | 112.7 | 156.6 | -66.6 | 172.1 | -156.4 | 0 | 0 | 119.5 | ||||
| 42 | D | 59.6 | Low | 54 | Low | 154 Ų | 154 | 152.1 Ų | 152.1 | 82% | 0.824 | 77% | 0.768 | S | S | * | * | -156.4 | 108 | 116.6 | -97.8 | -28 | 0 | 0 | 0 | 109.8 | |||||
| 43 | E | 55.6 | Low | 53.6 | Low | 183 Ų | 183 | 157.2 Ų | 157.2 | 86% | 0.855 | 78% | 0.777 | S | S | * | * | trans | -74.6 | 115.9 | 163.2 | -63.5 | -172.7 | 161.8 | 0 | 0 | 108.5 | ||||
| 44 | D | 58 | Low | 53.9 | Low | 138 Ų | 138 | 155.9 Ų | 155.9 | 74% | 0.738 | 78% | 0.775 | S | S | * | * | trans | -133.8 | 87.3 | 159.5 | -81.2 | -44.3 | 0 | 0 | 0 | 109.3 | V46 | D44-V46 PolarHBondContact O-N 3.17Š| ||
| 45 | E | 54.3 | Low | 53.7 | Low | 194 Ų | 194 | 154.8 Ų | 154.8 | 91% | 0.907 | 78% | 0.784 | S | S | * | * | trans | -62.2 | 108.5 | 152.1 | -74.2 | -174 | 164.4 | 0 | 0 | 108.6 | ||||
| 46 | V | 56.7 | Low | 53.3 | Low | 134 Ų | 134 | 153.3 Ų | 153.3 | 81% | 0.812 | 79% | 0.788 | S | S | * | * | trans | -121.9 | 100.5 | 158.4 | -75.3 | 0 | 0 | 0 | 0 | 109.5 | D44 | D44-V46 PolarHBondContact O-N 3.17Š| ||
| 47 | E | 50.7 | Low | 53.3 | Low | 172 Ų | 172 | 151 Ų | 151 | 80% | 0.804 | 79% | 0.792 | S | S | * | * | trans | -56.8 | 146.9 | 164.2 | -83.4 | -147 | 154.2 | 0 | 0 | 112.3 | ||||
| 48 | E | 52.6 | Low | 53.3 | Low | 161 Ų | 161 | 155.6 Ų | 155.6 | 75% | 0.752 | 80% | 0.798 | S | S | * | * | trans | 54.7 | 88.8 | 144.7 | -56.7 | -90.4 | 135.1 | 0 | 0 | 117.3 | ||||
| 49 | E | 49.6 | Very low | 53.2 | Low | 177 Ų | 177 | 152.4 Ų | 152.4 | 83% | 0.827 | 80% | 0.795 | S | S | * | * | trans | -122.3 | 88.4 | 143 | -118.5 | -157.2 | 149.7 | 0 | 0 | 110.3 | T51 | E49-T51 VanDerWaalsContact C-N 3.35Å; E49-T51 HydrophobicContact CB-CG2 4.16Å; E49-T51 HydrophobicContact CG-CG2 3.77Å; E49-T51 PolarHBondContact O-N 2.96Å; E49-T51 VanDerWaalsContact O-N 3.15Å; E49-T51 WeakPolarHBondContact OE1-CG2 3.43Å | ||
| 50 | E | 56.3 | Low | 53.5 | Low | 187 Ų | 187 | 152.5 Ų | 152.5 | 87% | 0.874 | 78% | 0.782 | S | S | * | * | trans | -68.2 | 96.4 | 152.1 | -168.5 | -163.8 | 144.6 | 0 | 0 | 107.8 | ||||
| 51 | T | 46.8 | Very low | 54 | Low | 70 Ų | 70 | 151.4 Ų | 151.4 | 43% | 0.429 | 79% | 0.785 | S | S | . | * | trans | -152 | 105.8 | 160.8 | 165 | 0 | 0 | 0 | 0 | 111.3 | E49 R53 | E49-T51 VanDerWaalsContact C-N 3.35Å; E49-T51 HydrophobicContact CB-CG2 4.16Å; E49-T51 HydrophobicContact CG-CG2 3.77Å; E49-T51 PolarHBondContact O-N 2.96Å; E49-T51 VanDerWaalsContact O-N 3.15Å; E49-T51 WeakPolarHBondContact OE1-CG2 3.43Å; T51-R53 PolarHBondContact O-N 2.79Å | ||
| 52 | N | 54 | Low | 55.5 | Low | 149 Ų | 149 | 148.2 Ų | 148.2 | 80% | 0.797 | 77% | 0.773 | S | S | * | * | trans | 54.5 | 56.6 | 146.4 | -57.8 | -69.7 | 0 | 0 | 0 | 116.6 | L54 | N52-L54 PolarHBondContact O-N 3.37Å; N52-L54 VanDerWaalsContact O-N 3.09Å | ||
| 53 | R | 45.4 | Very low | 57.2 | Low | 244 Ų | 244 | 142 Ų | 142 | 92% | 0.921 | 74% | 0.74 | S | S | * | * | trans | -71.1 | 101.7 | 153.8 | -71.4 | -173.9 | 175.6 | 158.7 | 1.5 | 108.7 | T51 | T51-R53 PolarHBondContact O-N 2.79Š| ||
| 54 | L | 51.2 | Low | 59.2 | Low | 156 Ų | 156 | 138.5 Ų | 138.5 | 82% | 0.817 | 72% | 0.719 | S | S | * | * | trans | -36.6 | 135.4 | 158.2 | -68.3 | 154.6 | 0 | 0 | 0 | 109.3 | N52 G56 | N52-L54 PolarHBondContact O-N 3.37Å; N52-L54 VanDerWaalsContact O-N 3.09Å; L54-G56 PolarHBondContact O-N 2.81Å | ||
| 55 | P | 47.6 | Very low | 61.2 | Low | 135 Ų | 135 | 132 Ų | 132 | 88% | 0.877 | 68% | 0.684 | S | S | * | * | S | Bend | trans | -76 | 69.3 | 179.9 | 32.1 | -32.6 | 0 | 0 | 0 | 109.6 | ||
| 56 | G | 49.9 | Very low | 63.3 | Low | 76 Ų | 76 | 125.4 Ų | 125.4 | 78% | 0.784 | 65% | 0.651 | S | S | * | * | trans | -98.8 | 8.1 | 175 | 0 | 0 | 0 | 0 | 0 | 112.9 | L54 | L54-G56 PolarHBondContact O-N 2.81Š| ||
| 57 | G | 48.9 | Very low | 65.2 | Low | 66 Ų | 66 | 120.9 Ų | 120.9 | 68% | 0.68 | 62% | 0.624 | S | S | * | * | S | Bend | trans | -85.5 | 112.5 | 162.9 | 0 | 0 | 0 | 0 | 0 | 107.5 | G59 | G57-G59 PolarHBondContact O-N 3.3Š|
| 58 | R | 54.9 | Low | 67.5 | Low | 249 Ų | 249 | 113.7 Ų | 113.7 | 94% | 0.94 | 59% | 0.592 | S | S | * | * | trans | -64.6 | 78.1 | 167.7 | -156.4 | -178.7 | -156.6 | -153 | 6.3 | 107.1 | R60 | R58-R60 PolarHBondContact O-N 3.03Š| ||
| 59 | G | 51.6 | Low | 69.7 | Low | 60 Ų | 60 | 114.1 Ų | 114.1 | 62% | 0.619 | 59% | 0.594 | S | S | * | * | trans | -53.7 | 108.5 | 179 | 0 | 0 | 0 | 0 | 0 | 105.9 | G57 V61 | G57-G59 PolarHBondContact O-N 3.3Å; G59-V61 VanDerWaalsContact C-N 3.35Å; G59-V61 PolarHBondContact O-N 3.3Å | ||
| 60 | R | 65.6 | Low | 71.9 | Confident | 176 Ų | 176 | 109.2 Ų | 109.2 | 66% | 0.664 | 58% | 0.579 | S | S | * | * | trans | -60.8 | 106.8 | 178.9 | -62.8 | -178.1 | -169.8 | -130 | 10.5 | 104.5 | R58 L62 H85 | R58-R60 PolarHBondContact O-N 3.03Å; R60-L62 WeakPolarHBondContact O-CD1 3.43Å; R60-L62 PolarHBondContact O-N 2.77Å; R60-H85 PolarHBondContact NH1-CE1 2.84Å; R60-H85 PolarHBondContact NH1-NE2 3.11Å; R60-H85 VanDerWaalsContact NH1-NE2 3.15Å | ||
| 61 | V | 70.3 | Confident | 73.9 | Confident | 128 Ų | 128 | 101.8 Ų | 101.8 | 78% | 0.776 | 55% | 0.545 | S | S | * | . | trans | -60.1 | 113.2 | 179.9 | 178 | 0 | 0 | 0 | 0 | 106.2 | G59 L63 | G59-V61 VanDerWaalsContact C-N 3.35Å; G59-V61 PolarHBondContact O-N 3.3Å; V61-L63 PolarHBondContact O-N 3.33Å | ||
| 62 | L | 86 | Confident | 76.3 | Confident | 104 Ų | 104 | 100.3 Ų | 100.3 | 55% | 0.545 | 54% | 0.538 | S | S | . | . | trans | -66.1 | 118.5 | 173.7 | -89.9 | 69.3 | 0 | 0 | 0 | 107.4 | R60 W64 N134 | R60-L62 WeakPolarHBondContact O-CD1 3.43Å; R60-L62 PolarHBondContact O-N 2.77Å; L62-W64 VanDerWaalsContact O-CD1 3.31Å; L62-N134 PolarHBondContact O-OD1 2.8Å | ||
| 63 | L | 95.9 | Very high | 78.3 | Confident | 22 Ų | 22 | 98.6 Ų | 98.6 | 12% | 0.115 | 52% | 0.521 | C | S | . | . | trans | -74.3 | 129.3 | 174.3 | -179.2 | 66.9 | 0 | 0 | 0 | 109 | V61 C83 Q87 F133 N134 | V61-L63 PolarHBondContact O-N 3.33Å; L63-C83 HydrophobicContact CB-CB 4.33Å; L63-C83 PolarHBondContact O-N 2.85Å; L63-Q87 VanDerWaalsContact CD2-O 3.27Å; L63-Q87 WeakPolarHBondContact CD2-O 3.33Å; L63-F133 VanDerWaalsContact CD1-C 3.45Å; L63-N134 WeakPolarHBondContact CA-OD1 3.22Å | ||
| 64 | W | 97.8 | Very high | 80.6 | Confident | 111 Ų | 111 | 92.4 Ų | 92.4 | 42% | 0.42 | 51% | 0.506 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -107.4 | 133.6 | 171.9 | -69.6 | 77.9 | 0 | 0 | 0 | 110 | L62 R81 N134 L135 | L62-W64 VanDerWaalsContact O-CD1 3.31Å; W64-R81 WeakPolarHBondContact CA-O 3.4Å; W64-N134 PolarHBondContact N-OD1 2.81Å; W64-N134 CarbonylContact O-C 3.55Å; W64-N134 WeakPolarHBondContact O-CA 3.39Å; W64-L135 HydrophobicContact CB-CD2 4.12Å; W64-L135 PolarHBondContact O-N 2.99Å |
| 65 | C | 98.4 | Very high | 82.8 | Confident | 0 Ų | 0 | 89.3 Ų | 89.3 | 0% | 0 | 49% | 0.487 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -129.8 | 158.3 | 177.6 | -55.3 | 0 | 0 | 0 | 0 | 110.9 | T80 R81 C83 C89 | C65-T80 WeakPolarHBondContact O-CA 3.27Å; C65-R81 PolarHBondContact N-O 2.89Å; C65-R81 PolarHBondContact O-N 3.35Å; C65-C83 PolarHBondContact SG-SG 2.84Å; C65-C89 HydrophobicContact CB-CB 3.72Å; C65-C89 WeakPolarHBondContact CB-SG 2.99Å; C65-C89 WeakPolarHBondContact SG-CA 3.17Å; C65-C89 WeakPolarHBondContact SG-CB 3.39Å; C65-C89 CovalentContact SG-SG 2.01Å; C65-C89 PolarHBondContact SG-SG 3.12Å |
| 66 | Y | 98.6 | Very high | 85.1 | Confident | 57 Ų | 57 | 88.5 Ų | 88.5 | 22% | 0.224 | 47% | 0.471 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -69.7 | 142 | 165.3 | -74.3 | -69.2 | 0 | 0 | 0 | 110.8 | C77 L79 T80 A108 W109 L135 N137 V138 | Y66-C77 HydrophobicContact CD1-CB 4.13Å; Y66-C77 VanDerWaalsContact CD1-O 3.23Å; Y66-C77 WeakPolarHBondContact CD1-O 3.29Å; Y66-C77 WeakPolarHBondContact CE1-O 3.38Å; Y66-C77 HydrophobicContact CG-CB 4.37Å; Y66-L79 CarbonylContact C-O 3.56Å; Y66-L79 VanDerWaalsContact CA-O 3.31Å; Y66-L79 WeakPolarHBondContact CA-O 2.93Å; Y66-L79 WeakPolarHBondContact CD1-O 3.38Å; Y66-T80 HydrophobicContact CD1-CG2 3.77Å; Y66-T80 HydrophobicContact CE1-CG2 3.71Å; Y66-A108 CarbonylContact O-C 3.57Å; Y66-A108 VanDerWaalsContact O-C 3.24Å; Y66-A108 WeakPolarHBondContact O-CB 3.39Å; Y66-W109 PolarHBondContact O-N 2.86Å; Y66-L135 HydrophobicContact CD2-CB 4.28Å; Y66-L135 HydrophobicContact CD2-CD2 4.46Å; Y66-L135 HydrophobicContact CE2-CB 3.74Å; Y66-L135 HydrophobicContact CE2-CD2 4.33Å; Y66-L135 HydrophobicContact CE2-CG 4.49Å; Y66-N137 PolarHBondContact N-OD1 3.36Å; Y66-N137 PolarHBondContact O-ND2 3.46Å; Y66-V138 HydrophobicContact CD2-CG2 3.83Å; Y66-V138 HydrophobicContact CE2-CG2 3.54Å |
| 67 | T | 98.4 | Very high | 87.3 | Confident | 39 Ų | 39 | 85.5 Ų | 85.5 | 24% | 0.239 | 44% | 0.438 | C | S | . | . | trans | -132.1 | 92.7 | 179.8 | 65.4 | 0 | 0 | 0 | 0 | 111.7 | L79 R81 A108 | T67-L79 PolarHBondContact N-O 2.88Å; T67-L79 WeakPolarHBondContact O-CB 3.35Å; T67-R81 HydrophobicContact CG2-CB 3.52Å; T67-A108 CarbonylContact C-O 3.55Å; T67-A108 WeakPolarHBondContact CA-O 3.4Å | ||
| 68 | C | 98.4 | Very high | 89.6 | Confident | 20 Ų | 20 | 89.1 Ų | 89.1 | 14% | 0.135 | 44% | 0.442 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -141.4 | 154.5 | 179.1 | -65.5 | 0 | 0 | 0 | 0 | 110.8 | L71 C77 S107 A108 | C68-L71 HydrophobicContact CB-CD1 3.57Å; C68-L71 HydrophobicContact CB-CD2 4.45Å; C68-L71 HydrophobicContact CB-CG 3.87Å; C68-C77 HydrophobicContact CB-CB 3.76Å; C68-C77 WeakPolarHBondContact CB-SG 2.99Å; C68-C77 WeakPolarHBondContact SG-CA 3.4Å; C68-C77 WeakPolarHBondContact SG-CB 3.31Å; C68-C77 CovalentContact SG-SG 2.03Å; C68-C77 PolarHBondContact SG-SG 3Å; C68-S107 WeakPolarHBondContact O-CA 3.31Å; C68-A108 PolarHBondContact N-O 3.03Å; C68-A108 PolarHBondContact O-N 2.8Å |
| 69 | Q | 98 | Very high | 91.7 | Very high | 171 Ų | 171 | 82.6 Ų | 82.6 | 80% | 0.799 | 43% | 0.425 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -120.7 | 127.1 | -177.4 | -171.1 | 172 | 21.4 | 0 | 0 | 110.8 | L71 | Q69-L71 VanDerWaalsContact C-N 3.31Å; Q69-L71 PolarHBondContact O-N 2.86Å |
| 70 | S | 96.7 | Very high | 93.9 | Very high | 73 Ų | 73 | 83 Ų | 83 | 51% | 0.51 | 42% | 0.416 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | 51.5 | 43.8 | 168.7 | -168 | 0 | 0 | 0 | 0 | 114.6 | H106 S107 | S70-H106 PolarHBondContact N-O 3.22Å; S70-S107 PolarHBondContact N-OG 3.04Å |
| 71 | L | 98.1 | Very high | 95.4 | Very high | 31 Ų | 31 | 82.8 Ų | 82.8 | 16% | 0.162 | 42% | 0.415 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -70.6 | 146.9 | 173.5 | -63.9 | -175.1 | 0 | 0 | 0 | 110.7 | C68 Q69 E75 C77 T105 H106 | C68-L71 HydrophobicContact CB-CD1 3.57Å; C68-L71 HydrophobicContact CB-CD2 4.45Å; C68-L71 HydrophobicContact CB-CG 3.87Å; Q69-L71 VanDerWaalsContact C-N 3.31Å; Q69-L71 PolarHBondContact O-N 2.86Å; L71-E75 WeakPolarHBondContact CA-OE2 3.42Å; L71-E75 HydrophobicContact CB-CB 4.04Å; L71-E75 WeakPolarHBondContact CD2-OE2 2.94Å; L71-C77 HydrophobicContact CD1-CB 3.77Å; L71-T105 CarbonylContact O-C 3.51Å; L71-T105 WeakPolarHBondContact O-CA 3.43Å; L71-H106 VanDerWaalsContact CB-CE1 3.4Å; L71-H106 WeakPolarHBondContact CB-CE1 3.45Å; L71-H106 PolarHBondContact N-O 3.44Å; L71-H106 PolarHBondContact O-N 2.89Å; L71-H106 PolarHBondContact O-ND1 2.83Å |
| 72 | S | 96.6 | Very high | 96.7 | Very high | 40 Ų | 40 | 79.2 Ų | 79.2 | 28% | 0.28 | 40% | 0.395 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -67.8 | 165.1 | 172.6 | 72.7 | 0 | 0 | 0 | 0 | 111.3 | D74 E75 H106 | S72-D74 VanDerWaalsContact C-N 3.26Å; S72-D74 PolarHBondContact O-N 3.28Å; S72-E75 PolarHBondContact N-OE2 3.11Å; S72-E75 PolarHBondContact O-N 3.26Å; S72-E75 VanDerWaalsContact OG-CG 3.23Å; S72-E75 WeakPolarHBondContact OG-CG 3.05Å; S72-E75 PolarHBondContact OG-OE1 2Å; S72-E75 PolarHBondContact OG-OE2 2.87Å; S72-H106 PolarHBondContact O-CE1 3.32Å; S72-H106 PolarHBondContact O-ND1 3.24Å; S72-H106 VanDerWaalsContact O-ND1 3.12Å |
| 73 | R | 95.6 | Very high | 97.2 | Very high | 113 Ų | 113 | 74.8 Ų | 74.8 | 43% | 0.426 | 37% | 0.373 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -51.9 | -42.5 | -175.7 | -172.9 | 175.6 | 167 | -89.8 | 6.5 | 113.9 | T104 W141 Q142 | R73-T104 PolarHBondContact N-O 2.84Å; R73-T104 VanDerWaalsContact N-O 3.11Å; R73-W141 HydrophobicContact CG-CD2 4.37Å; R73-W141 HydrophobicContact CG-CZ2 4.05Å; R73-W141 PolarHBondContact O-NE1 3.34Å; R73-Q142 PolarHBondContact O-NE2 3.39Å |
| 74 | D | 94.8 | Very high | 97.1 | Very high | 113 Ų | 113 | 77.6 Ų | 77.6 | 60% | 0.604 | 40% | 0.395 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -96.2 | -4.5 | -170.5 | -52.3 | -41.6 | 0 | 0 | 0 | 112.3 | S72 | S72-D74 VanDerWaalsContact C-N 3.26Å; S72-D74 PolarHBondContact O-N 3.28Å |
| 75 | E | 96.7 | Very high | 96.9 | Very high | 92 Ų | 92 | 79 Ų | 79 | 43% | 0.43 | 41% | 0.406 | S | S | . | . | P | Polyproline II helix | trans | -76.3 | 139.2 | 171.2 | -82 | 161.6 | -152.8 | 0 | 0 | 111.3 | L71 S72 H106 Q142 | L71-E75 WeakPolarHBondContact CA-OE2 3.42Å; L71-E75 HydrophobicContact CB-CB 4.04Å; L71-E75 WeakPolarHBondContact CD2-OE2 2.94Å; S72-E75 PolarHBondContact N-OE2 3.11Å; S72-E75 PolarHBondContact O-N 3.26Å; S72-E75 VanDerWaalsContact OG-CG 3.23Å; S72-E75 WeakPolarHBondContact OG-CG 3.05Å; S72-E75 PolarHBondContact OG-OE1 2Å; S72-E75 PolarHBondContact OG-OE2 2.87Å; E75-H106 PolarHBondContact O-CE1 2.89Å; E75-H106 PolarHBondContact O-NE2 2.97Å; E75-Q142 PolarHBondContact O-NE2 3.45Å |
| 76 | H | 95.6 | Very high | 96.5 | Very high | 117 Ų | 117 | 82.1 Ų | 82.1 | 54% | 0.542 | 44% | 0.437 | S | S | . | . | P | Polyproline II helix | trans | -102.3 | 135.7 | 175.8 | -72.4 | -93.3 | 0 | 0 | 0 | 110.7 | N78 Q142 | H76-N78 PolarHBondContact O-N 3.03Å; H76-Q142 PolarHBondContact ND1-OE1 2.66Å; H76-Q142 VanDerWaalsContact ND1-OE1 3.17Å |
| 77 | C | 97.3 | Very high | 96.4 | Very high | 13 Ų | 13 | 81 Ų | 81 | 9% | 0.088 | 43% | 0.434 | C | S | . | . | P | Polyproline II helix | trans | -76.2 | 119.7 | 172.3 | -175.3 | 0 | 0 | 0 | 0 | 110.5 | Y66 C68 L71 | Y66-C77 HydrophobicContact CD1-CB 4.13Å; Y66-C77 VanDerWaalsContact CD1-O 3.23Å; Y66-C77 WeakPolarHBondContact CD1-O 3.29Å; Y66-C77 WeakPolarHBondContact CE1-O 3.38Å; Y66-C77 HydrophobicContact CG-CB 4.37Å; C68-C77 HydrophobicContact CB-CB 3.76Å; C68-C77 WeakPolarHBondContact CB-SG 2.99Å; C68-C77 WeakPolarHBondContact SG-CA 3.4Å; C68-C77 WeakPolarHBondContact SG-CB 3.31Å; C68-C77 CovalentContact SG-SG 2.03Å; C68-C77 PolarHBondContact SG-SG 3Å; L71-C77 HydrophobicContact CD1-CB 3.77Å |
| 78 | N | 96.4 | Very high | 96.4 | Very high | 142 Ų | 142 | 79.6 Ų | 79.6 | 76% | 0.759 | 43% | 0.427 | S | S | * | . | trans | -106.9 | -0.5 | 177.8 | -64.4 | -36.4 | 0 | 0 | 0 | 113.2 | H76 | H76-N78 PolarHBondContact O-N 3.03Š| ||
| 79 | L | 98.2 | Very high | 96.4 | Very high | 112 Ų | 112 | 78.7 Ų | 78.7 | 59% | 0.586 | 42% | 0.42 | S | S | * | . | trans | -94 | 127.2 | -179.4 | -62.4 | 177.3 | 0 | 0 | 0 | 109.7 | Y66 T67 | Y66-L79 CarbonylContact C-O 3.56Å; Y66-L79 VanDerWaalsContact CA-O 3.31Å; Y66-L79 WeakPolarHBondContact CA-O 2.93Å; Y66-L79 WeakPolarHBondContact CD1-O 3.38Å; T67-L79 PolarHBondContact N-O 2.88Å; T67-L79 WeakPolarHBondContact O-CB 3.35Å | ||
| 80 | T | 98.1 | Very high | 96.4 | Very high | 69 Ų | 69 | 70.7 Ų | 70.7 | 42% | 0.423 | 38% | 0.383 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -123.1 | 151.8 | 178.6 | 63.6 | 0 | 0 | 0 | 0 | 110.5 | C65 Y66 L135 | C65-T80 WeakPolarHBondContact O-CA 3.27Å; Y66-T80 HydrophobicContact CD1-CG2 3.77Å; Y66-T80 HydrophobicContact CE1-CG2 3.71Å; T80-L135 HydrophobicContact CG2-CD2 3.55Å |
| 81 | R | 97.3 | Very high | 96.5 | Very high | 171 Ų | 171 | 67.3 Ų | 67.3 | 65% | 0.645 | 36% | 0.359 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -144.6 | 147 | 178.6 | -164.2 | -178.1 | -177.5 | 161.3 | 2.7 | 110.5 | W64 C65 T67 | W64-R81 WeakPolarHBondContact CA-O 3.4Å; C65-R81 PolarHBondContact N-O 2.89Å; C65-R81 PolarHBondContact O-N 3.35Å; T67-R81 HydrophobicContact CG2-CB 3.52Å |
| 82 | S | 97.1 | Very high | 96.5 | Very high | 53 Ų | 53 | 68.1 Ų | 68.1 | 37% | 0.371 | 36% | 0.364 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -73.8 | 133.1 | 165.3 | 56.1 | 0 | 0 | 0 | 0 | 110.5 | ||
| 83 | C | 96.8 | Very high | 96.6 | Very high | 12 Ų | 12 | 67 Ų | 67 | 8% | 0.081 | 35% | 0.354 | C | S | . | . | P | Polyproline II helix | trans | -91.1 | 154.5 | 176.1 | -51.7 | 0 | 0 | 0 | 0 | 111.3 | L63 C65 Q87 C110 | L63-C83 HydrophobicContact CB-CB 4.33Å; L63-C83 PolarHBondContact O-N 2.85Å; C65-C83 PolarHBondContact SG-SG 2.84Å; C83-Q87 HydrophobicContact CB-CB 3.92Å; C83-C110 VanDerWaalsContact CA-SG 3.51Å; C83-C110 HydrophobicContact CB-CB 3.69Å; C83-C110 WeakPolarHBondContact CB-SG 3.26Å; C83-C110 WeakPolarHBondContact SG-CB 3.23Å; C83-C110 CovalentContact SG-SG 2.04Å; C83-C110 PolarHBondContact SG-SG 3.34Å |
| 84 | S | 95.2 | Very high | 96.7 | Very high | 80 Ų | 80 | 62.5 Ų | 62.5 | 56% | 0.559 | 34% | 0.342 | S | S | * | . | P | Polyproline II helix | trans | -67.1 | 159.9 | 170.4 | -58.7 | 0 | 0 | 0 | 0 | 111.2 | G86 Q87 | S84-G86 PolarHBondContact O-N 3.35Å; S84-Q87 WeakPolarHBondContact O-CB 3.25Å; S84-Q87 PolarHBondContact O-N 2.79Å |
| 85 | H | 92.4 | Very high | 96.9 | Very high | 142 Ų | 142 | 60.2 Ų | 60.2 | 66% | 0.657 | 33% | 0.327 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -59.8 | 130.7 | 179.2 | 179.4 | -90.4 | 0 | 0 | 0 | 111.7 | R60 Q87 | R60-H85 PolarHBondContact NH1-CE1 2.84Å; R60-H85 PolarHBondContact NH1-NE2 3.11Å; R60-H85 VanDerWaalsContact NH1-NE2 3.15Å; H85-Q87 VanDerWaalsContact C-N 3.33Å |
| 86 | G | 90.9 | Very high | 96.8 | Very high | 64 Ų | 64 | 56.2 Ų | 56.2 | 66% | 0.66 | 31% | 0.311 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 88.6 | -7.3 | 179.6 | 0 | 0 | 0 | 0 | 0 | 114.7 | S84 | S84-G86 PolarHBondContact O-N 3.35Š|
| 87 | Q | 96.3 | Very high | 96.8 | Very high | 34 Ų | 34 | 56.6 Ų | 56.6 | 16% | 0.159 | 32% | 0.317 | C | S | . | . | trans | -75.2 | 158.5 | 174.4 | -65.1 | -171.2 | -38.4 | 0 | 0 | 112.2 | L63 C83 S84 H85 T111 D112 | L63-Q87 VanDerWaalsContact CD2-O 3.27Å; L63-Q87 WeakPolarHBondContact CD2-O 3.33Å; C83-Q87 HydrophobicContact CB-CB 3.92Å; S84-Q87 WeakPolarHBondContact O-CB 3.25Å; S84-Q87 PolarHBondContact O-N 2.79Å; H85-Q87 VanDerWaalsContact C-N 3.33Å; Q87-T111 CarbonylContact C-O 3.57Å; Q87-T111 VanDerWaalsContact CA-O 3.23Å; Q87-T111 WeakPolarHBondContact CA-O 3.23Å; Q87-T111 WeakPolarHBondContact CB-O 3.23Å; Q87-D112 VanDerWaalsContact CG-OD1 3.23Å; Q87-D112 WeakPolarHBondContact CG-OD1 3.38Å; Q87-D112 PolarHBondContact NE2-OD1 2.89Å | ||
| 88 | A | 97.3 | Very high | 96.5 | Very high | 10 Ų | 10 | 59.1 Ų | 59.1 | 8% | 0.083 | 33% | 0.332 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -119.5 | 158.5 | 171.9 | 0 | 0 | 0 | 0 | 0 | 110.6 | C110 T111 C114 Q132 | A88-C110 WeakPolarHBondContact O-CA 3.24Å; A88-T111 PolarHBondContact N-O 3.42Å; A88-T111 PolarHBondContact O-N 3.01Å; A88-C114 HydrophobicContact CB-CB 4.16Å; A88-Q132 HydrophobicContact CB-CG 4.33Å |
| 89 | C | 98.4 | Very high | 96.2 | Very high | 0 Ų | 0 | 62.4 Ų | 62.4 | 0% | 0 | 34% | 0.342 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -78.8 | 136.7 | 168.4 | -51.6 | 0 | 0 | 0 | 0 | 109.9 | C65 C130 C131 C136 N137 | C65-C89 HydrophobicContact CB-CB 3.72Å; C65-C89 WeakPolarHBondContact CB-SG 2.99Å; C65-C89 WeakPolarHBondContact SG-CA 3.17Å; C65-C89 WeakPolarHBondContact SG-CB 3.39Å; C65-C89 CovalentContact SG-SG 2.01Å; C65-C89 PolarHBondContact SG-SG 3.12Å; C89-C130 WeakPolarHBondContact O-CA 3.23Å; C89-C131 PolarHBondContact N-O 3.15Å; C89-C131 PolarHBondContact O-N 3.42Å; C89-C136 WeakPolarHBondContact CB-SG 3.23Å; C89-N137 HydrophobicContact CB-CB 3.6Å |
| 90 | T | 98.7 | Very high | 95.9 | Very high | 3 Ų | 3 | 63 Ų | 63 | 2% | 0.018 | 36% | 0.357 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -119 | 141.8 | 177.6 | -57.8 | 0 | 0 | 0 | 0 | 110.4 | A108 W109 T111 C114 T128 T129 N137 | T90-A108 VanDerWaalsContact O-CA 3.3Å; T90-A108 WeakPolarHBondContact O-CA 3.49Å; T90-W109 HydrophobicContact CG2-CD2 4.46Å; T90-W109 HydrophobicContact CG2-CH2 4.04Å; T90-W109 HydrophobicContact CG2-CZ2 3.68Å; T90-W109 PolarHBondContact N-O 3.49Å; T90-W109 PolarHBondContact O-N 2.95Å; T90-W109 VanDerWaalsContact O-N 3.15Å; T90-T111 WeakPolarHBondContact OG1-CG2 3.27Å; T90-C114 PolarHBondContact OG1-SG 3.17Å; T90-T128 HydrophobicContact CG2-CG2 3.7Å; T90-T129 WeakPolarHBondContact CA-O 3.37Å; T90-N137 PolarHBondContact O-ND2 3.26Å |
| 91 | T | 98.6 | Very high | 95.6 | Very high | 2 Ų | 2 | 61.3 Ų | 61.3 | 1% | 0.012 | 35% | 0.352 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -119 | 135.2 | 161.7 | -45.7 | 0 | 0 | 0 | 0 | 108.3 | I93 S107 T128 T129 N137 P139 | T91-I93 HydrophobicContact CG2-CD1 4.44Å; T91-I93 HydrophobicContact CG2-CG1 4.11Å; T91-S107 CarbonylContact C-O 3.54Å; T91-S107 WeakPolarHBondContact CA-O 3.46Å; T91-T128 CarbonylContact O-C 3.56Å; T91-T128 VanDerWaalsContact O-CA 3.29Å; T91-T128 WeakPolarHBondContact O-CA 3.34Å; T91-T129 WeakPolarHBondContact CB-OG1 3.07Å; T91-T129 PolarHBondContact N-O 2.03Å; T91-T129 PolarHBondContact O-N 2.96Å; T91-N137 VanDerWaalsContact OG1-CA 3.25Å; T91-N137 WeakPolarHBondContact OG1-CA 3.37Å; T91-N137 VanDerWaalsContact OG1-CB 3.26Å; T91-N137 WeakPolarHBondContact OG1-CB 2.98Å; T91-N137 PolarHBondContact OG1-O 3.19Å; T91-P139 HydrophobicContact CG2-CG 4.45Å |
| 92 | L | 98.6 | Very high | 95.4 | Very high | 48 Ų | 48 | 58.4 Ų | 58.4 | 25% | 0.251 | 35% | 0.349 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -119.4 | 125.6 | 168.3 | -178.6 | 154.4 | 0 | 0 | 0 | 108.9 | A94 H106 S107 W109 V126 T127 | L92-A94 HydrophobicContact CD2-CB 4.48Å; L92-H106 CarbonylContact O-C 3.24Å; L92-H106 VanDerWaalsContact O-CA 3.24Å; L92-H106 WeakPolarHBondContact O-CA 3.3Å; L92-S107 PolarHBondContact N-O 3.23Å; L92-S107 PolarHBondContact O-N 2Å; L92-W109 HydrophobicContact CB-CH2 3.39Å; L92-W109 HydrophobicContact CB-CZ3 3.66Å; L92-W109 HydrophobicContact CD1-CH2 3.91Å; L92-W109 HydrophobicContact CG-CH2 4.28Å; L92-V126 HydrophobicContact CD1-CG1 4.04Å; L92-V126 HydrophobicContact CD2-CG1 4.08Å; L92-V126 HydrophobicContact CG-CG1 3.91Å; L92-T127 CarbonylContact C-O 3.57Å; L92-T127 WeakPolarHBondContact CA-O 3.45Å |
| 93 | I | 98.5 | Very high | 95.4 | Very high | 16 Ų | 16 | 59.8 Ų | 59.8 | 8% | 0.082 | 35% | 0.352 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -114.2 | 124.6 | 178.5 | -62.9 | 163.1 | 0 | 0 | 0 | 107.1 | T91 T104 T105 H106 V126 T127 P139 P140 W141 | T91-I93 HydrophobicContact CG2-CD1 4.44Å; T91-I93 HydrophobicContact CG2-CG1 4.11Å; I93-T104 HydrophobicContact CG2-CG2 4Å; I93-T105 WeakPolarHBondContact CA-O 2.96Å; I93-H106 HydrophobicContact CG1-CB 4.17Å; I93-V126 CarbonylContact O-C 3.51Å; I93-V126 VanDerWaalsContact O-CA 3.31Å; I93-V126 WeakPolarHBondContact O-CA 3.33Å; I93-T127 PolarHBondContact N-O 2.01Å; I93-T127 PolarHBondContact O-N 2.96Å; I93-P139 HydrophobicContact CD1-CB 4.5Å; I93-P140 HydrophobicContact CD1-CG 4.37Å; I93-W141 HydrophobicContact CB-CH2 4.45Å; I93-W141 HydrophobicContact CD1-CH2 3.84Å; I93-W141 HydrophobicContact CD1-CZ3 3.8Å; I93-W141 HydrophobicContact CG1-CH2 3.91Å; I93-W141 HydrophobicContact CG1-CZ3 4.35Å; I93-W141 HydrophobicContact CG2-CH2 3.71Å; I93-W141 HydrophobicContact CG2-CZ3 4.05Å |
| 94 | A | 98.1 | Very high | 95.4 | Very high | 20 Ų | 20 | 60.1 Ų | 60.1 | 17% | 0.165 | 35% | 0.354 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -111.1 | 128.8 | 170.4 | 0 | 0 | 0 | 0 | 0 | 108.7 | L92 T104 T105 T124 Q125 V126 | L92-A94 HydrophobicContact CD2-CB 4.48Å; A94-T104 CarbonylContact O-C 3.46Å; A94-T104 VanDerWaalsContact O-CA 3.31Å; A94-T104 WeakPolarHBondContact O-CA 3.47Å; A94-T105 PolarHBondContact N-O 3.26Å; A94-T105 PolarHBondContact O-N 3.02Å; A94-T124 HydrophobicContact CB-CG2 4.07Å; A94-Q125 CarbonylContact C-O 3.57Å; A94-Q125 WeakPolarHBondContact CA-O 3.47Å; A94-V126 HydrophobicContact CB-CG2 4.45Å |
| 95 | H | 97.8 | Very high | 95.5 | Very high | 65 Ų | 65 | 57.8 Ų | 57.8 | 30% | 0.301 | 34% | 0.336 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -132.6 | 116 | -178.2 | -178.6 | 74.4 | 0 | 0 | 0 | 108.9 | L103 T104 T124 Q125 | H95-L103 WeakPolarHBondContact CA-O 3.29Å; H95-T104 HydrophobicContact CB-CG2 4.46Å; H95-T104 PolarHBondContact ND1-OG1 3.15Å; H95-T124 CarbonylContact O-C 3.53Å; H95-Q125 PolarHBondContact N-O 3.36Å; H95-Q125 PolarHBondContact O-N 2.89Å |
| 96 | G | 95.8 | Very high | 95.8 | Very high | 8 Ų | 8 | 51.1 Ų | 51.1 | 8% | 0.082 | 31% | 0.305 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -169 | 169.3 | -173.9 | 0 | 0 | 0 | 0 | 0 | 112.8 | L103 | G96-L103 PolarHBondContact N-O 3.4Å; G96-L103 PolarHBondContact O-N 3Å |
| 97 | N | 95.4 | Very high | 96.2 | Very high | 125 Ų | 125 | 49 Ų | 49 | 67% | 0.668 | 28% | 0.28 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -81.5 | 140.5 | 175.1 | -76.4 | -25.2 | 0 | 0 | 0 | 110.9 | L102 | N97-L102 WeakPolarHBondContact OD1-CD1 3.48Å |
| 98 | T | 90.4 | Very high | 96.3 | Very high | 66 Ų | 66 | 47.6 Ų | 47.6 | 41% | 0.405 | 27% | 0.274 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -122.9 | 175 | 171.4 | 67.4 | 0 | 0 | 0 | 0 | 109 | S100 G101 L103 | T98-S100 PolarHBondContact O-N 2.86Å; T98-S100 PolarHBondContact OG1-N 3.3Å; T98-G101 PolarHBondContact N-O 2.83Å; T98-G101 PolarHBondContact O-N 2.92Å; T98-G101 PolarHBondContact OG1-O 2.85Å; T98-L103 HydrophobicContact CG2-CB 3.77Å; T98-L103 HydrophobicContact CG2-CD2 3.92Å |
| 99 | E | 91.3 | Very high | 96.4 | Very high | 210 Ų | 210 | 51.5 Ų | 51.5 | 98% | 0.981 | 29% | 0.287 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -56.6 | -30.1 | 173.4 | -62.6 | -178 | 172.5 | 0 | 0 | 112.4 | G101 | E99-G101 VanDerWaalsContact C-N 3.31Š|
| 100 | S | 90.1 | Very high | 96.4 | Very high | 126 Ų | 126 | 52.7 Ų | 52.7 | 88% | 0.881 | 30% | 0.295 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -87.3 | 4.5 | 178.4 | -54.7 | 0 | 0 | 0 | 0 | 113.7 | T98 | T98-S100 PolarHBondContact O-N 2.86Å; T98-S100 PolarHBondContact OG1-N 3.3Å |
| 101 | G | 92.8 | Very high | 96.3 | Very high | 32 Ų | 32 | 54 Ų | 54 | 33% | 0.33 | 30% | 0.303 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | 104.6 | -164 | -176.8 | 0 | 0 | 0 | 0 | 0 | 113.9 | T98 E99 L103 | T98-G101 PolarHBondContact N-O 2.83Å; T98-G101 PolarHBondContact O-N 2.92Å; T98-G101 PolarHBondContact OG1-O 2.85Å; E99-G101 VanDerWaalsContact C-N 3.31Å; G101-L103 PolarHBondContact O-N 3.15Å |
| 102 | L | 94 | Very high | 96.2 | Very high | 111 Ų | 111 | 59.4 Ų | 59.4 | 58% | 0.581 | 33% | 0.332 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -69.6 | 121.3 | -177.3 | -170.4 | 70.8 | 0 | 0 | 0 | 110.6 | N97 | N97-L102 WeakPolarHBondContact OD1-CD1 3.48Å |
| 103 | L | 95.7 | Very high | 96.1 | Very high | 82 Ų | 82 | 62.8 Ų | 62.8 | 43% | 0.429 | 35% | 0.35 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -119.9 | 139.7 | -178.5 | -175.7 | 64.7 | 0 | 0 | 0 | 110.5 | H95 G96 T98 G101 T105 | H95-L103 WeakPolarHBondContact CA-O 3.29Å; G96-L103 PolarHBondContact N-O 3.4Å; G96-L103 PolarHBondContact O-N 3Å; T98-L103 HydrophobicContact CG2-CB 3.77Å; T98-L103 HydrophobicContact CG2-CD2 3.92Å; G101-L103 PolarHBondContact O-N 3.15Å; L103-T105 HydrophobicContact CD2-CG2 4.01Å; L103-T105 HydrophobicContact CG-CG2 4.08Å |
| 104 | T | 97.7 | Very high | 96 | Very high | 19 Ų | 19 | 63.4 Ų | 63.4 | 12% | 0.117 | 36% | 0.356 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -121.4 | 124.3 | 169.3 | -47.8 | 0 | 0 | 0 | 0 | 109.1 | R73 I93 A94 H95 W141 | R73-T104 PolarHBondContact N-O 2.84Å; R73-T104 VanDerWaalsContact N-O 3.11Å; I93-T104 HydrophobicContact CG2-CG2 4Å; A94-T104 CarbonylContact O-C 3.46Å; A94-T104 VanDerWaalsContact O-CA 3.31Å; A94-T104 WeakPolarHBondContact O-CA 3.47Å; H95-T104 HydrophobicContact CB-CG2 4.46Å; H95-T104 PolarHBondContact ND1-OG1 3.15Å; T104-W141 HydrophobicContact CG2-CH2 3.8Å; T104-W141 HydrophobicContact CG2-CZ2 4.28Å; T104-W141 HydrophobicContact CG2-CZ3 4.4Å |
| 105 | T | 97.8 | Very high | 95.9 | Very high | 30 Ų | 30 | 68.9 Ų | 68.9 | 18% | 0.184 | 38% | 0.378 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -120.7 | 152.8 | 173.8 | 59.5 | 0 | 0 | 0 | 0 | 110.5 | L71 I93 A94 L103 | L71-T105 CarbonylContact O-C 3.51Å; L71-T105 WeakPolarHBondContact O-CA 3.43Å; I93-T105 WeakPolarHBondContact CA-O 2.96Å; A94-T105 PolarHBondContact N-O 3.26Å; A94-T105 PolarHBondContact O-N 3.02Å; L103-T105 HydrophobicContact CD2-CG2 4.01Å; L103-T105 HydrophobicContact CG-CG2 4.08Å |
| 106 | H | 98.3 | Very high | 95.9 | Very high | 2 Ų | 2 | 70.3 Ų | 70.3 | 1% | 0.009 | 39% | 0.393 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -136.8 | 148.1 | 174.4 | 69.4 | -76.6 | 0 | 0 | 0 | 112.4 | S70 L71 S72 E75 L92 I93 P139 W141 | S70-H106 PolarHBondContact N-O 3.22Å; L71-H106 VanDerWaalsContact CB-CE1 3.4Å; L71-H106 WeakPolarHBondContact CB-CE1 3.45Å; L71-H106 PolarHBondContact N-O 3.44Å; L71-H106 PolarHBondContact O-N 2.89Å; L71-H106 PolarHBondContact O-ND1 2.83Å; S72-H106 PolarHBondContact O-CE1 3.32Å; S72-H106 PolarHBondContact O-ND1 3.24Å; S72-H106 VanDerWaalsContact O-ND1 3.12Å; E75-H106 PolarHBondContact O-CE1 2.89Å; E75-H106 PolarHBondContact O-NE2 2.97Å; L92-H106 CarbonylContact O-C 3.24Å; L92-H106 VanDerWaalsContact O-CA 3.24Å; L92-H106 WeakPolarHBondContact O-CA 3.3Å; I93-H106 HydrophobicContact CG1-CB 4.17Å; H106-P139 HydrophobicContact CB-CG 4.02Å; H106-P139 WeakPolarHBondContact CD2-CG 3.32Å; H106-W141 HydrophobicContact CB-CZ2 4.45Å |
| 107 | S | 98.7 | Very high | 96 | Very high | 19 Ų | 19 | 73.2 Ų | 73.2 | 13% | 0.133 | 41% | 0.406 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -133.3 | 151.2 | 178.6 | -66.2 | 0 | 0 | 0 | 0 | 109 | C68 S70 T91 L92 | C68-S107 WeakPolarHBondContact O-CA 3.31Å; S70-S107 PolarHBondContact N-OG 3.04Å; T91-S107 CarbonylContact C-O 3.54Å; T91-S107 WeakPolarHBondContact CA-O 3.46Å; L92-S107 PolarHBondContact N-O 3.23Å; L92-S107 PolarHBondContact O-N 2Å |
| 108 | A | 98.5 | Very high | 96.2 | Very high | 5 Ų | 5 | 71.3 Ų | 71.3 | 4% | 0.041 | 40% | 0.399 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -141.2 | 136.4 | -175.8 | 0 | 0 | 0 | 0 | 0 | 110 | Y66 T67 C68 T90 N137 | Y66-A108 CarbonylContact O-C 3.57Å; Y66-A108 VanDerWaalsContact O-C 3.24Å; Y66-A108 WeakPolarHBondContact O-CB 3.39Å; T67-A108 CarbonylContact C-O 3.55Å; T67-A108 WeakPolarHBondContact CA-O 3.4Å; C68-A108 PolarHBondContact N-O 3.03Å; C68-A108 PolarHBondContact O-N 2.8Å; T90-A108 VanDerWaalsContact O-CA 3.3Å; T90-A108 WeakPolarHBondContact O-CA 3.49Å; A108-N137 WeakPolarHBondContact CB-ND2 3.45Å |
| 109 | W | 98.6 | Very high | 96.5 | Very high | 92 Ų | 92 | 74.4 Ų | 74.4 | 35% | 0.348 | 41% | 0.406 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -163.7 | 170.8 | 177.6 | 62.9 | 101.9 | 0 | 0 | 0 | 113 | Y66 T90 L92 | Y66-W109 PolarHBondContact O-N 2.86Å; T90-W109 HydrophobicContact CG2-CD2 4.46Å; T90-W109 HydrophobicContact CG2-CH2 4.04Å; T90-W109 HydrophobicContact CG2-CZ2 3.68Å; T90-W109 PolarHBondContact N-O 3.49Å; T90-W109 PolarHBondContact O-N 2.95Å; T90-W109 VanDerWaalsContact O-N 3.15Å; L92-W109 HydrophobicContact CB-CH2 3.39Å; L92-W109 HydrophobicContact CB-CZ3 3.66Å; L92-W109 HydrophobicContact CD1-CH2 3.91Å; L92-W109 HydrophobicContact CG-CH2 4.28Å |
| 110 | C | 98.3 | Very high | 96.8 | Very high | 25 Ų | 25 | 68.9 Ų | 68.9 | 17% | 0.169 | 39% | 0.387 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -84.8 | 134.9 | 167.2 | -55.1 | 0 | 0 | 0 | 0 | 110.2 | C83 A88 | C83-C110 VanDerWaalsContact CA-SG 3.51Å; C83-C110 HydrophobicContact CB-CB 3.69Å; C83-C110 WeakPolarHBondContact CB-SG 3.26Å; C83-C110 WeakPolarHBondContact SG-CB 3.23Å; C83-C110 CovalentContact SG-SG 2.04Å; C83-C110 PolarHBondContact SG-SG 3.34Å; A88-C110 WeakPolarHBondContact O-CA 3.24Å |
| 111 | T | 97.8 | Very high | 97.1 | Very high | 31 Ų | 31 | 67 Ų | 67 | 19% | 0.19 | 37% | 0.37 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -136 | 147.6 | 174.9 | -162.2 | 0 | 0 | 0 | 0 | 112.2 | Q87 A88 T90 C114 | Q87-T111 CarbonylContact C-O 3.57Å; Q87-T111 VanDerWaalsContact CA-O 3.23Å; Q87-T111 WeakPolarHBondContact CA-O 3.23Å; Q87-T111 WeakPolarHBondContact CB-O 3.23Å; A88-T111 PolarHBondContact N-O 3.42Å; A88-T111 PolarHBondContact O-N 3.01Å; T90-T111 WeakPolarHBondContact OG1-CG2 3.27Å; T111-C114 HydrophobicContact CG2-CB 3.51Å |
| 112 | D | 96.6 | Very high | 97.2 | Very high | 116 Ų | 116 | 74.8 Ų | 74.8 | 62% | 0.62 | 40% | 0.398 | S | S | * | . | S | Bend | trans | -71 | -35.7 | 177 | -51.9 | -70.6 | 0 | 0 | 0 | 112.3 | Q87 | Q87-D112 VanDerWaalsContact CG-OD1 3.23Å; Q87-D112 WeakPolarHBondContact CG-OD1 3.38Å; Q87-D112 PolarHBondContact NE2-OD1 2.89Å |
| 113 | N | 95.1 | Very high | 97.2 | Very high | 119 Ų | 119 | 72.5 Ų | 72.5 | 64% | 0.636 | 40% | 0.401 | S | S | * | . | S | Bend | trans | -133.5 | 100.6 | -176 | -161.7 | 63.8 | 0 | 0 | 0 | 110.6 | ||
| 114 | C | 97 | Very high | 97.2 | Very high | 29 Ų | 29 | 70.7 Ų | 70.7 | 20% | 0.196 | 39% | 0.394 | C | S | . | . | trans | -102.6 | 119.9 | -178.1 | -160.3 | 0 | 0 | 0 | 0 | 110.6 | A88 T90 T111 C130 | A88-C114 HydrophobicContact CB-CB 4.16Å; T90-C114 PolarHBondContact OG1-SG 3.17Å; T111-C114 HydrophobicContact CG2-CB 3.51Å; C114-C130 HydrophobicContact CB-CB 3.66Å; C114-C130 WeakPolarHBondContact CB-SG 3.12Å; C114-C130 VanDerWaalsContact SG-CA 3.54Å; C114-C130 WeakPolarHBondContact SG-CB 3.49Å; C114-C130 CovalentContact SG-SG 2Å; C114-C130 PolarHBondContact SG-SG 2.78Å | ||
| 115 | Q | 97.2 | Very high | 97.3 | Very high | 135 Ų | 135 | 74.1 Ų | 74.1 | 63% | 0.631 | 41% | 0.408 | S | S | * | . | trans | -114.6 | 111.3 | 173.6 | -70.3 | -174.4 | -8.8 | 0 | 0 | 109.4 | I117 | Q115-I117 PolarHBondContact O-N 3.17Š| ||
| 116 | P | 97.4 | Very high | 97.3 | Very high | 95 Ų | 95 | 74.4 Ų | 74.4 | 62% | 0.617 | 41% | 0.41 | S | S | * | . | trans | -62.4 | 128.2 | 174.9 | -19 | 30.1 | 0 | 0 | 0 | 110.1 | T128 C130 | P116-T128 VanDerWaalsContact CA-O 3.27Å; P116-T128 WeakPolarHBondContact CA-O 3.36Å; P116-C130 VanDerWaalsContact CD-SG 3.56Å; P116-C130 HydrophobicContact CG-CB 4.04Å | ||
| 117 | I | 98 | Very high | 97.3 | Very high | 68 Ų | 68 | 75.6 Ų | 75.6 | 35% | 0.349 | 42% | 0.417 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -154.2 | 144.4 | -177.9 | -166 | 161.6 | 0 | 0 | 0 | 111.2 | Q115 K119 T127 T128 | Q115-I117 PolarHBondContact O-N 3.17Å; I117-K119 HydrophobicContact CD1-CD 3.6Å; I117-K119 VanDerWaalsContact CD1-CE 3.41Å; I117-K119 HydrophobicContact CD1-CG 4.06Å; I117-K119 HydrophobicContact CG1-CD 4.08Å; I117-K119 HydrophobicContact CG1-CG 3.98Å; I117-T127 CarbonylContact O-C 3.56Å; I117-T127 WeakPolarHBondContact O-CA 3.04Å; I117-T128 PolarHBondContact N-O 2.88Å; I117-T128 PolarHBondContact O-N 3Å |
| 118 | T | 98.1 | Very high | 97.3 | Very high | 85 Ų | 85 | 75.8 Ų | 75.8 | 52% | 0.521 | 42% | 0.418 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -123.5 | 122.2 | 167.5 | -62.1 | 0 | 0 | 0 | 0 | 108.1 | Q125 V126 T127 | T118-Q125 HydrophobicContact CG2-CG 4.13Å; T118-V126 WeakPolarHBondContact CA-O 3.03Å; T118-T127 WeakPolarHBondContact CG2-OG1 3.06Å; T118-T127 WeakPolarHBondContact OG1-CG2 3.21Å; T118-T127 PolarHBondContact OG1-OG1 2.79Å |
| 119 | K | 97.9 | Very high | 97.3 | Very high | 131 Ų | 131 | 78.4 Ų | 78.4 | 57% | 0.57 | 43% | 0.433 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -142.4 | 153.5 | 179.5 | -83 | -179.9 | 171.4 | 166.8 | 0 | 110.2 | I117 V126 | I117-K119 HydrophobicContact CD1-CD 3.6Å; I117-K119 VanDerWaalsContact CD1-CE 3.41Å; I117-K119 HydrophobicContact CD1-CG 4.06Å; I117-K119 HydrophobicContact CG1-CD 4.08Å; I117-K119 HydrophobicContact CG1-CG 3.98Å; K119-V126 PolarHBondContact N-O 3.11Å; K119-V126 PolarHBondContact O-N 3.21Å; K119-V126 VanDerWaalsContact O-O 3.11Å |
| 120 | T | 97.6 | Very high | 97.3 | Very high | 95 Ų | 95 | 76 Ų | 76 | 58% | 0.583 | 43% | 0.43 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -103.2 | 124.5 | 170.7 | -54.3 | 0 | 0 | 0 | 0 | 108.8 | T124 | T120-T124 CarbonylContact C-O 3.52Å; T120-T124 WeakPolarHBondContact CA-O 3.45Å |
| 121 | V | 95.6 | Very high | 97.2 | Very high | 85 Ų | 85 | 76 Ų | 76 | 52% | 0.515 | 43% | 0.43 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -121.4 | 120.1 | 178.1 | -176.7 | 0 | 0 | 0 | 0 | 107.3 | G123 T124 | V121-G123 PolarHBondContact O-N 3.08Å; V121-G123 VanDerWaalsContact O-N 3.09Å; V121-T124 PolarHBondContact N-O 3.46Å; V121-T124 WeakPolarHBondContact O-CA 3.09Å; V121-T124 WeakPolarHBondContact O-CB 3.31Å; V121-T124 PolarHBondContact O-N 2.87Å |
| 122 | E | 95.1 | Very high | 97.1 | Very high | 197 Ų | 197 | 82.7 Ų | 82.7 | 92% | 0.921 | 46% | 0.459 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 50.1 | 38.4 | 179.2 | -59.7 | -172.9 | 149.5 | 0 | 0 | 114 | T124 | E122-T124 VanDerWaalsContact C-N 3.27Å; E122-T124 PolarHBondContact O-N 3.31Å |
| 123 | G | 93.6 | Very high | 97 | Very high | 62 Ų | 62 | 83.7 Ų | 83.7 | 64% | 0.639 | 46% | 0.458 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 80.3 | -1 | -178.6 | 0 | 0 | 0 | 0 | 0 | 115.3 | V121 | V121-G123 PolarHBondContact O-N 3.08Å; V121-G123 VanDerWaalsContact O-N 3.09Å |
| 124 | T | 97.3 | Very high | 97.1 | Very high | 45 Ų | 45 | 81.9 Ų | 81.9 | 28% | 0.276 | 45% | 0.448 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -98.9 | 120.5 | 172.8 | -59.7 | 0 | 0 | 0 | 0 | 110 | A94 H95 T120 V121 E122 V126 | A94-T124 HydrophobicContact CB-CG2 4.07Å; H95-T124 CarbonylContact O-C 3.53Å; T120-T124 CarbonylContact C-O 3.52Å; T120-T124 WeakPolarHBondContact CA-O 3.45Å; V121-T124 PolarHBondContact N-O 3.46Å; V121-T124 WeakPolarHBondContact O-CA 3.09Å; V121-T124 WeakPolarHBondContact O-CB 3.31Å; V121-T124 PolarHBondContact O-N 2.87Å; E122-T124 VanDerWaalsContact C-N 3.27Å; E122-T124 PolarHBondContact O-N 3.31Å; T124-V126 HydrophobicContact CG2-CG2 4.29Å; T124-V126 PolarHBondContact O-N 2.04Å |
| 125 | Q | 98.1 | Very high | 97.1 | Very high | 90 Ų | 90 | 83.7 Ų | 83.7 | 42% | 0.421 | 46% | 0.456 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -75.3 | 118.8 | 171.4 | -177.7 | 175.7 | 87.6 | 0 | 0 | 109.5 | A94 H95 T118 | A94-Q125 CarbonylContact C-O 3.57Å; A94-Q125 WeakPolarHBondContact CA-O 3.47Å; H95-Q125 PolarHBondContact N-O 3.36Å; H95-Q125 PolarHBondContact O-N 2.89Å; T118-Q125 HydrophobicContact CG2-CG 4.13Å |
| 126 | V | 98.1 | Very high | 97.1 | Very high | 36 Ų | 36 | 78.2 Ų | 78.2 | 22% | 0.218 | 43% | 0.432 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -109.8 | 125.4 | 175.2 | -177.3 | 0 | 0 | 0 | 0 | 108.7 | L92 I93 A94 T118 K119 T124 | L92-V126 HydrophobicContact CD1-CG1 4.04Å; L92-V126 HydrophobicContact CD2-CG1 4.08Å; L92-V126 HydrophobicContact CG-CG1 3.91Å; I93-V126 CarbonylContact O-C 3.51Å; I93-V126 VanDerWaalsContact O-CA 3.31Å; I93-V126 WeakPolarHBondContact O-CA 3.33Å; A94-V126 HydrophobicContact CB-CG2 4.45Å; T118-V126 WeakPolarHBondContact CA-O 3.03Å; K119-V126 PolarHBondContact N-O 3.11Å; K119-V126 PolarHBondContact O-N 3.21Å; K119-V126 VanDerWaalsContact O-O 3.11Å; T124-V126 HydrophobicContact CG2-CG2 4.29Å; T124-V126 PolarHBondContact O-N 2.04Å |
| 127 | T | 98.6 | Very high | 97.1 | Very high | 27 Ų | 27 | 73.8 Ų | 73.8 | 17% | 0.166 | 40% | 0.404 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -122 | 122.2 | 176.5 | -63 | 0 | 0 | 0 | 0 | 109.9 | L92 I93 I117 T118 T129 | L92-T127 CarbonylContact C-O 3.57Å; L92-T127 WeakPolarHBondContact CA-O 3.45Å; I93-T127 PolarHBondContact N-O 2.01Å; I93-T127 PolarHBondContact O-N 2.96Å; I117-T127 CarbonylContact O-C 3.56Å; I117-T127 WeakPolarHBondContact O-CA 3.04Å; T118-T127 WeakPolarHBondContact CG2-OG1 3.06Å; T118-T127 WeakPolarHBondContact OG1-CG2 3.21Å; T118-T127 PolarHBondContact OG1-OG1 2.79Å; T127-T129 HydrophobicContact CG2-CG2 4.14Å |
| 128 | T | 98.6 | Very high | 97.1 | Very high | 24 Ų | 24 | 72.9 Ų | 72.9 | 15% | 0.147 | 40% | 0.401 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -106.6 | 129 | 172.7 | -57.2 | 0 | 0 | 0 | 0 | 109.3 | T90 T91 P116 I117 | T90-T128 HydrophobicContact CG2-CG2 3.7Å; T91-T128 CarbonylContact O-C 3.56Å; T91-T128 VanDerWaalsContact O-CA 3.29Å; T91-T128 WeakPolarHBondContact O-CA 3.34Å; P116-T128 VanDerWaalsContact CA-O 3.27Å; P116-T128 WeakPolarHBondContact CA-O 3.36Å; I117-T128 PolarHBondContact N-O 2.88Å; I117-T128 PolarHBondContact O-N 3Å |
| 129 | T | 98.4 | Very high | 97 | Very high | 60 Ų | 60 | 69 Ų | 69 | 37% | 0.368 | 38% | 0.377 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -122.1 | 155.5 | 174.1 | 60.7 | 0 | 0 | 0 | 0 | 110.7 | T90 T91 T127 | T90-T129 WeakPolarHBondContact CA-O 3.37Å; T91-T129 WeakPolarHBondContact CB-OG1 3.07Å; T91-T129 PolarHBondContact N-O 2.03Å; T91-T129 PolarHBondContact O-N 2.96Å; T127-T129 HydrophobicContact CG2-CG2 4.14Å |
| 130 | C | 98.1 | Very high | 96.9 | Very high | 42 Ų | 42 | 65.7 Ų | 65.7 | 28% | 0.284 | 37% | 0.369 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -134.3 | 141.1 | -173 | -53.3 | 0 | 0 | 0 | 0 | 110.2 | C89 C114 P116 | C89-C130 WeakPolarHBondContact O-CA 3.23Å; C114-C130 HydrophobicContact CB-CB 3.66Å; C114-C130 WeakPolarHBondContact CB-SG 3.12Å; C114-C130 VanDerWaalsContact SG-CA 3.54Å; C114-C130 WeakPolarHBondContact SG-CB 3.49Å; C114-C130 CovalentContact SG-SG 2Å; C114-C130 PolarHBondContact SG-SG 2.78Å; P116-C130 VanDerWaalsContact CD-SG 3.56Å; P116-C130 HydrophobicContact CG-CB 4.04Å |
| 131 | C | 97.4 | Very high | 96.7 | Very high | 24 Ų | 24 | 65 Ų | 65 | 16% | 0.162 | 36% | 0.356 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -153.8 | 157.9 | 175.2 | 52.9 | 0 | 0 | 0 | 0 | 111.5 | C89 F133 C136 | C89-C131 PolarHBondContact N-O 3.15Å; C89-C131 PolarHBondContact O-N 3.42Å; C131-F133 HydrophobicContact CB-CD1 4.16Å; C131-F133 HydrophobicContact CB-CE1 3.84Å; C131-C136 VanDerWaalsContact C-SG 3.56Å; C131-C136 HydrophobicContact CB-CB 3.69Å; C131-C136 WeakPolarHBondContact CB-SG 3.35Å; C131-C136 WeakPolarHBondContact SG-CB 3.39Å; C131-C136 CovalentContact SG-SG 2Å; C131-C136 PolarHBondContact SG-SG 3.43Å |
| 132 | Q | 95.8 | Very high | 96.6 | Very high | 171 Ų | 171 | 62.7 Ų | 62.7 | 80% | 0.799 | 34% | 0.34 | S | S | * | . | trans | -122.8 | 22.3 | -169.3 | -63.5 | 179.3 | -1.2 | 0 | 0 | 113.1 | A88 | A88-Q132 HydrophobicContact CB-CG 4.33Š| ||
| 133 | F | 95.2 | Very high | 96.1 | Very high | 137 Ų | 137 | 55.3 Ų | 55.3 | 60% | 0.601 | 31% | 0.31 | S | S | * | . | S | Bend | trans | -121.9 | 158 | 176.9 | 60 | -84.5 | 0 | 0 | 0 | 110.6 | L63 C131 L135 C136 | L63-F133 VanDerWaalsContact CD1-C 3.45Å; C131-F133 HydrophobicContact CB-CD1 4.16Å; C131-F133 HydrophobicContact CB-CE1 3.84Å; F133-L135 PolarHBondContact O-N 2.8Å; F133-C136 HydrophobicContact CD1-CB 3.66Å; F133-C136 HydrophobicContact CD2-CB 3.29Å; F133-C136 HydrophobicContact CE1-CB 3.47Å; F133-C136 VanDerWaalsContact CE1-CB 3.47Å; F133-C136 HydrophobicContact CE2-CB 3.07Å; F133-C136 HydrophobicContact CG-CB 3.58Å; F133-C136 HydrophobicContact CZ-CB 3.18Å; F133-C136 VanDerWaalsContact O-CB 3.23Å; F133-C136 WeakPolarHBondContact O-CB 3.48Å; F133-C136 PolarHBondContact O-N 2.9Å; F133-C136 PolarHBondContact O-SG 2.86Å |
| 134 | N | 96.8 | Very high | 94.8 | Very high | 81 Ų | 81 | 58.5 Ų | 58.5 | 43% | 0.433 | 32% | 0.322 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -59.2 | 132.9 | -174.2 | -70.3 | -27.7 | 0 | 0 | 0 | 111.7 | L62 L63 W64 C136 | L62-N134 PolarHBondContact O-OD1 2.8Å; L63-N134 WeakPolarHBondContact CA-OD1 3.22Å; W64-N134 PolarHBondContact N-OD1 2.81Å; W64-N134 CarbonylContact O-C 3.55Å; W64-N134 WeakPolarHBondContact O-CA 3.39Å; N134-C136 PolarHBondContact O-N 3.24Å; N134-C136 VanDerWaalsContact O-N 3.17Å |
| 135 | L | 96.9 | Very high | 92.8 | Very high | 67 Ų | 67 | 67.4 Ų | 67.4 | 35% | 0.351 | 35% | 0.351 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 55.6 | 31.7 | 173.2 | -52.1 | -178.8 | 0 | 0 | 0 | 113.5 | W64 Y66 T80 F133 | W64-L135 HydrophobicContact CB-CD2 4.12Å; W64-L135 PolarHBondContact O-N 2.99Å; Y66-L135 HydrophobicContact CD2-CB 4.28Å; Y66-L135 HydrophobicContact CD2-CD2 4.46Å; Y66-L135 HydrophobicContact CE2-CB 3.74Å; Y66-L135 HydrophobicContact CE2-CD2 4.33Å; Y66-L135 HydrophobicContact CE2-CG 4.49Å; T80-L135 HydrophobicContact CG2-CD2 3.55Å; F133-L135 PolarHBondContact O-N 2.8Å |
| 136 | C | 96.9 | Very high | 90.5 | Very high | 20 Ų | 20 | 66.6 Ų | 66.6 | 14% | 0.135 | 35% | 0.352 | C | S | . | . | trans | -81 | -22.2 | -173.8 | 63.6 | 0 | 0 | 0 | 0 | 115.2 | C89 C131 F133 N134 V138 | C89-C136 WeakPolarHBondContact CB-SG 3.23Å; C131-C136 VanDerWaalsContact C-SG 3.56Å; C131-C136 HydrophobicContact CB-CB 3.69Å; C131-C136 WeakPolarHBondContact CB-SG 3.35Å; C131-C136 WeakPolarHBondContact SG-CB 3.39Å; C131-C136 CovalentContact SG-SG 2Å; C131-C136 PolarHBondContact SG-SG 3.43Å; F133-C136 HydrophobicContact CD1-CB 3.66Å; F133-C136 HydrophobicContact CD2-CB 3.29Å; F133-C136 HydrophobicContact CE1-CB 3.47Å; F133-C136 VanDerWaalsContact CE1-CB 3.47Å; F133-C136 HydrophobicContact CE2-CB 3.07Å; F133-C136 HydrophobicContact CG-CB 3.58Å; F133-C136 HydrophobicContact CZ-CB 3.18Å; F133-C136 VanDerWaalsContact O-CB 3.23Å; F133-C136 WeakPolarHBondContact O-CB 3.48Å; F133-C136 PolarHBondContact O-N 2.9Å; F133-C136 PolarHBondContact O-SG 2.86Å; N134-C136 PolarHBondContact O-N 3.24Å; N134-C136 VanDerWaalsContact O-N 3.17Å; C136-V138 PolarHBondContact O-N 2.86Å | ||
| 137 | N | 97.8 | Very high | 88 | Confident | 3 Ų | 3 | 72.3 Ų | 72.3 | 2% | 0.016 | 38% | 0.376 | C | S | . | . | trans | -82.1 | 45.7 | -168.8 | 60.4 | -31.6 | 0 | 0 | 0 | 113.1 | Y66 C89 T90 T91 A108 | Y66-N137 PolarHBondContact N-OD1 3.36Å; Y66-N137 PolarHBondContact O-ND2 3.46Å; C89-N137 HydrophobicContact CB-CB 3.6Å; T90-N137 PolarHBondContact O-ND2 3.26Å; T91-N137 VanDerWaalsContact OG1-CA 3.25Å; T91-N137 WeakPolarHBondContact OG1-CA 3.37Å; T91-N137 VanDerWaalsContact OG1-CB 3.26Å; T91-N137 WeakPolarHBondContact OG1-CB 2.98Å; T91-N137 PolarHBondContact OG1-O 3.19Å; A108-N137 WeakPolarHBondContact CB-ND2 3.45Å | ||
| 138 | V | 97.4 | Very high | 85.1 | Confident | 48 Ų | 48 | 78.7 Ų | 78.7 | 29% | 0.291 | 41% | 0.409 | S | S | . | . | trans | -91.2 | 136.3 | 177.1 | 179.8 | 0 | 0 | 0 | 0 | 109.3 | Y66 C136 Q142 | Y66-V138 HydrophobicContact CD2-CG2 3.83Å; Y66-V138 HydrophobicContact CE2-CG2 3.54Å; C136-V138 PolarHBondContact O-N 2.86Å; V138-Q142 HydrophobicContact CG1-CB 3.62Å | ||
| 139 | P | 96.7 | Very high | 82.6 | Confident | 5 Ų | 5 | 81.8 Ų | 81.8 | 3% | 0.032 | 43% | 0.43 | C | S | . | . | trans | -56.6 | 149.1 | 176 | -23.5 | 32.4 | 0 | 0 | 0 | 112.9 | T91 I93 H106 W141 Q142 S143 | T91-P139 HydrophobicContact CG2-CG 4.45Å; I93-P139 HydrophobicContact CD1-CB 4.5Å; H106-P139 HydrophobicContact CB-CG 4.02Å; H106-P139 WeakPolarHBondContact CD2-CG 3.32Å; P139-W141 VanDerWaalsContact C-N 3.31Å; P139-W141 HydrophobicContact CB-CD2 3.91Å; P139-W141 VanDerWaalsContact CB-CE2 3.5Å; P139-W141 HydrophobicContact CB-CE3 4.21Å; P139-W141 HydrophobicContact CB-CH2 3.77Å; P139-W141 HydrophobicContact CB-CZ2 3.42Å; P139-W141 VanDerWaalsContact CB-CZ2 3.42Å; P139-W141 HydrophobicContact CB-CZ3 4.15Å; P139-W141 HydrophobicContact CG-CZ2 4.01Å; P139-W141 PolarHBondContact O-N 3.48Å; P139-Q142 PolarHBondContact O-N 3.38Å; P139-S143 PolarHBondContact O-N 2.71Å; P139-S143 VanDerWaalsContact O-N 3.15Å | ||
| 140 | P | 95.1 | Very high | 80.3 | Confident | 61 Ų | 61 | 85.7 Ų | 85.7 | 40% | 0.396 | 46% | 0.456 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -59.7 | -38.5 | -172.1 | 20.6 | -31 | 0 | 0 | 0 | 113.1 | I93 Q142 S143 V146 | I93-P140 HydrophobicContact CD1-CG 4.37Å; P140-Q142 VanDerWaalsContact C-N 3.25Å; P140-Q142 PolarHBondContact O-N 3.33Å; P140-S143 PolarHBondContact O-N 3.4Å; P140-S143 PolarHBondContact O-OG 3.25Å; P140-V146 HydrophobicContact CB-CG2 3.95Å; P140-V146 WeakPolarHBondContact O-CB 3.18Å; P140-V146 WeakPolarHBondContact O-CG2 2.92Å |
| 141 | W | 94.1 | Very high | 77.9 | Confident | 80 Ų | 80 | 87.1 Ų | 87.1 | 30% | 0.303 | 48% | 0.478 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -70.9 | -16.8 | 179.2 | 58 | 87 | 0 | 0 | 0 | 114.3 | R73 I93 T104 H106 P139 | R73-W141 HydrophobicContact CG-CD2 4.37Å; R73-W141 HydrophobicContact CG-CZ2 4.05Å; R73-W141 PolarHBondContact O-NE1 3.34Å; I93-W141 HydrophobicContact CB-CH2 4.45Å; I93-W141 HydrophobicContact CD1-CH2 3.84Å; I93-W141 HydrophobicContact CD1-CZ3 3.8Å; I93-W141 HydrophobicContact CG1-CH2 3.91Å; I93-W141 HydrophobicContact CG1-CZ3 4.35Å; I93-W141 HydrophobicContact CG2-CH2 3.71Å; I93-W141 HydrophobicContact CG2-CZ3 4.05Å; T104-W141 HydrophobicContact CG2-CH2 3.8Å; T104-W141 HydrophobicContact CG2-CZ2 4.28Å; T104-W141 HydrophobicContact CG2-CZ3 4.4Å; H106-W141 HydrophobicContact CB-CZ2 4.45Å; P139-W141 VanDerWaalsContact C-N 3.31Å; P139-W141 HydrophobicContact CB-CD2 3.91Å; P139-W141 VanDerWaalsContact CB-CE2 3.5Å; P139-W141 HydrophobicContact CB-CE3 4.21Å; P139-W141 HydrophobicContact CB-CH2 3.77Å; P139-W141 HydrophobicContact CB-CZ2 3.42Å; P139-W141 VanDerWaalsContact CB-CZ2 3.42Å; P139-W141 HydrophobicContact CB-CZ3 4.15Å; P139-W141 HydrophobicContact CG-CZ2 4.01Å; P139-W141 PolarHBondContact O-N 3.48Å |
| 142 | Q | 92.3 | Very high | 75.4 | Confident | 37 Ų | 37 | 95.4 Ų | 95.4 | 17% | 0.173 | 51% | 0.511 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -94.5 | -20.6 | 175.1 | -64 | -176.5 | 4.5 | 0 | 0 | 111.8 | R73 E75 H76 V138 P139 P140 S144 | R73-Q142 PolarHBondContact O-NE2 3.39Å; E75-Q142 PolarHBondContact O-NE2 3.45Å; H76-Q142 PolarHBondContact ND1-OE1 2.66Å; H76-Q142 VanDerWaalsContact ND1-OE1 3.17Å; V138-Q142 HydrophobicContact CG1-CB 3.62Å; P139-Q142 PolarHBondContact O-N 3.38Å; P140-Q142 VanDerWaalsContact C-N 3.25Å; P140-Q142 PolarHBondContact O-N 3.33Å; Q142-S144 PolarHBondContact O-N 3.29Å |
| 143 | S | 84.6 | Confident | 73.1 | Confident | 42 Ų | 42 | 91.6 Ų | 91.6 | 29% | 0.294 | 52% | 0.518 | S | S | . | . | S | Bend | trans | -72.9 | 122.9 | 171.3 | 77.3 | 0 | 0 | 0 | 0 | 109 | P139 P140 R145 V146 | P139-S143 PolarHBondContact O-N 2.71Å; P139-S143 VanDerWaalsContact O-N 3.15Å; P140-S143 PolarHBondContact O-N 3.4Å; P140-S143 PolarHBondContact O-OG 3.25Å; S143-R145 PolarHBondContact O-N 3.19Å; S143-V146 PolarHBondContact O-N 3.09Å |
| 144 | S | 67.4 | Low | 70.8 | Confident | 129 Ų | 129 | 89.1 Ų | 89.1 | 90% | 0.902 | 52% | 0.523 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -60.8 | 1.3 | 176.8 | 55 | 0 | 0 | 0 | 0 | 114.5 | Q142 | Q142-S144 PolarHBondContact O-N 3.29Š|
| 145 | R | 55.2 | Low | 68.6 | Low | 232 Ų | 232 | 89.6 Ų | 89.6 | 88% | 0.875 | 55% | 0.547 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -98.8 | 3.3 | -178.5 | -64.5 | -167.6 | 177.2 | -162.8 | 0.3 | 114.1 | S143 Q147 | S143-R145 PolarHBondContact O-N 3.19Å; R145-Q147 PolarHBondContact O-N 3.45Å |
| 146 | V | 49.4 | Very low | 66 | Low | 73 Ų | 73 | 89.6 Ų | 89.6 | 44% | 0.442 | 56% | 0.563 | S | S | . | * | S | Bend | trans | -93.9 | 93.7 | 175.1 | 176 | 0 | 0 | 0 | 0 | 110.4 | P140 S143 | P140-V146 HydrophobicContact CB-CG2 3.95Å; P140-V146 WeakPolarHBondContact O-CB 3.18Å; P140-V146 WeakPolarHBondContact O-CG2 2.92Å; S143-V146 PolarHBondContact O-N 3.09Å |
| 147 | Q | 44.8 | Very low | 63.8 | Low | 155 Ų | 155 | 95 Ų | 95 | 72% | 0.724 | 60% | 0.598 | S | S | * | * | trans | 115 | 91.5 | 158.5 | -64.3 | 173.1 | 97.7 | 0 | 0 | 116.7 | R145 | R145-Q147 PolarHBondContact O-N 3.45Š| ||
| 148 | D | 37.9 | Very low | 61.6 | Low | 161 Ų | 161 | 106.9 Ų | 106.9 | 86% | 0.861 | 64% | 0.643 | S | S | * | * | -105.4 | 123 | 108.5 | -86.3 | -49.7 | 0 | 0 | 0 | 107.3 | |||||
| 149 | P | 46.3 | Very low | 58.6 | Low | 89 Ų | 89 | 108 Ų | 108 | 58% | 0.578 | 66% | 0.663 | S | S | * | * | trans | -59.5 | 138 | 171 | -18.5 | 29.6 | 0 | 0 | 0 | 110.4 | G151 | P149-G151 VanDerWaalsContact C-N 3.29Å; P149-G151 PolarHBondContact O-N 2.99Å | ||
| 150 | P | 49.1 | Very low | 56 | Low | 142 Ų | 142 | 113.1 Ų | 113.1 | 92% | 0.922 | 70% | 0.7 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.9 | 87.9 | 172.9 | 30 | -30 | 0 | 0 | 0 | 108.3 | ||
| 151 | G | 47.8 | Very low | 53.4 | Low | 73 Ų | 73 | 115.5 Ų | 115.5 | 75% | 0.753 | 72% | 0.716 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 175.6 | 16.6 | -176.8 | 0 | 0 | 0 | 0 | 0 | 118.3 | P149 | P149-G151 VanDerWaalsContact C-N 3.29Å; P149-G151 PolarHBondContact O-N 2.99Å |
| 152 | K | 45 | Very low | 50.7 | Low | 197 Ų | 197 | 120.7 Ų | 120.7 | 86% | 0.857 | 74% | 0.744 | S | S | * | * | trans | -133.7 | 53.6 | 171.9 | -144 | 164.3 | 178 | -170 | 0 | 112.8 | A154 | K152-A154 VanDerWaalsContact C-N 3.29Å; K152-A154 PolarHBondContact O-N 2.95Å; K152-A154 VanDerWaalsContact O-N 3.13Å | ||
| 153 | G | 47.8 | Very low | 48.4 | Very low | 92 Ų | 92 | 125.4 Ų | 125.4 | 95% | 0.948 | 78% | 0.775 | S | S | * | * | trans | -72.3 | 87.7 | 153.2 | 0 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 154 | A | 47.1 | Very low | 46.3 | Very low | 85 Ų | 85 | 128 Ų | 128 | 70% | 0.702 | 80% | 0.8 | S | S | * | * | trans | -129.8 | 113.4 | 158.3 | 0 | 0 | 0 | 0 | 0 | 106.7 | K152 | K152-A154 VanDerWaalsContact C-N 3.29Å; K152-A154 PolarHBondContact O-N 2.95Å; K152-A154 VanDerWaalsContact O-N 3.13Å | ||
| 155 | G | 51.7 | Low | 45 | Very low | 91 Ų | 91 | 125.4 Ų | 125.4 | 94% | 0.938 | 79% | 0.793 | S | S | * | * | trans | -55.7 | 136.4 | -171.1 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 156 | G | 42.2 | Very low | 44.6 | Very low | 66 Ų | 66 | 121.4 Ų | 121.4 | 68% | 0.68 | 79% | 0.794 | S | S | * | * | trans | -123.1 | 143.2 | 159.1 | 0 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 157 | P | 49.8 | Very low | 44.7 | Very low | 133 Ų | 133 | 122.3 Ų | 122.3 | 86% | 0.864 | 81% | 0.809 | S | S | * | * | trans | -72.8 | 138 | -161.8 | -10.9 | 27.2 | 0 | 0 | 0 | 112.3 | G159 | P157-G159 PolarHBondContact O-N 3.34Š| ||
| 158 | R | 51.3 | Low | 44.6 | Very low | 254 Ų | 254 | 122.4 Ų | 122.4 | 96% | 0.958 | 81% | 0.814 | S | S | * | * | trans | -55.8 | 118.7 | 162.6 | -77.1 | 172.9 | 154 | 178.3 | -7.4 | 110.2 | ||||
| 159 | G | 35.7 | Very low | 45.3 | Very low | 70 Ų | 70 | 123.1 Ų | 123.1 | 72% | 0.722 | 82% | 0.817 | S | S | * | * | trans | -130.9 | 89.3 | 154.5 | 0 | 0 | 0 | 0 | 0 | 106.5 | P157 | P157-G159 PolarHBondContact O-N 3.34Š| ||
| 160 | S | 42.5 | Very low | 45.4 | Very low | 114 Ų | 114 | 125.7 Ų | 125.7 | 80% | 0.797 | 83% | 0.825 | S | S | * | * | 55.1 | 110.1 | 102.6 | -158.5 | 0 | 0 | 0 | 0 | 113.1 | |||||
| 161 | C | 39.2 | Very low | 45.4 | Very low | 111 Ų | 111 | 126.4 Ų | 126.4 | 75% | 0.75 | 82% | 0.821 | S | S | * | * | trans | -60.1 | 129.7 | 170.3 | -169.9 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 162 | E | 38.4 | Very low | 45.5 | Very low | 188 Ų | 188 | 131 Ų | 131 | 88% | 0.879 | 83% | 0.828 | S | S | * | * | trans | -148.9 | 116.7 | 154.5 | -117.7 | 171.4 | 137 | 0 | 0 | 110.9 | ||||
| 163 | T | 42.8 | Very low | 45.9 | Very low | 136 Ų | 136 | 130.1 Ų | 130.1 | 83% | 0.834 | 83% | 0.831 | S | S | * | * | trans | -74.7 | 115.2 | 170.7 | -49.1 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 164 | A | 41 | Very low | 45.8 | Very low | 98 Ų | 98 | 131 Ų | 131 | 81% | 0.81 | 83% | 0.83 | S | S | * | * | trans | -162.3 | 112 | 158.7 | 0 | 0 | 0 | 0 | 0 | 106.3 | ||||
| 165 | G | 40 | Very low | 45.9 | Very low | 73 Ų | 73 | 130.5 Ų | 130.5 | 75% | 0.753 | 83% | 0.833 | S | S | * | * | 103.6 | 92.7 | 72.8 | 0 | 0 | 0 | 0 | 0 | 107.1 | A167 | G165-A167 PolarHBondContact O-N 3.15Š| |||
| 166 | T | 46.9 | Very low | 45.9 | Very low | 148 Ų | 148 | 134.7 Ų | 134.7 | 91% | 0.908 | 83% | 0.833 | S | S | * | * | trans | -42.2 | 121.8 | 166.6 | 36.1 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 167 | A | 51.3 | Low | 46 | Very low | 92 Ų | 92 | 134.9 Ų | 134.9 | 76% | 0.76 | 84% | 0.835 | S | S | * | * | trans | -178.9 | 153.4 | 137.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | G165 | G165-A167 PolarHBondContact O-N 3.15Š| ||
| 168 | L | 42.9 | Very low | 45.9 | Very low | 158 Ų | 158 | 133.4 Ų | 133.4 | 83% | 0.827 | 83% | 0.834 | S | S | * | * | trans | 98.6 | 67.2 | 156.4 | -123.1 | 81.7 | 0 | 0 | 0 | 117.9 | ||||
| 169 | L | 51.8 | Low | 45.8 | Very low | 175 Ų | 175 | 130.1 Ų | 130.1 | 92% | 0.916 | 83% | 0.832 | S | S | * | * | trans | -77.7 | 112.8 | 143.7 | -83.9 | 162.7 | 0 | 0 | 0 | 108.4 | ||||
| 170 | L | 49.8 | Very low | 46.4 | Very low | 144 Ų | 144 | 130.7 Ų | 130.7 | 75% | 0.754 | 84% | 0.838 | S | S | * | * | trans | -164.1 | 142.1 | 156.6 | -98.7 | 165 | 0 | 0 | 0 | 109.1 | ||||
| 171 | N | 48.1 | Very low | 46.7 | Very low | 156 Ų | 156 | 130.2 Ų | 130.2 | 83% | 0.834 | 84% | 0.84 | S | S | * | * | trans | 101.6 | 65.5 | 174.1 | -51.9 | -54.2 | 0 | 0 | 0 | 116.8 | ||||
| 172 | L | 50.6 | Low | 47.1 | Very low | 170 Ų | 170 | 128.6 Ų | 128.6 | 89% | 0.89 | 84% | 0.843 | S | S | * | * | trans | -98.2 | 134.8 | 136.9 | -92.4 | 105.5 | 0 | 0 | 0 | 108.4 | ||||
| 173 | L | 52.8 | Low | 47.8 | Very low | 178 Ų | 178 | 131.1 Ų | 131.1 | 93% | 0.932 | 84% | 0.844 | S | S | * | * | trans | 113.3 | 85.8 | 169.9 | -62.3 | 163.9 | 0 | 0 | 0 | 114.5 | ||||
| 174 | A | 46.4 | Very low | 48.8 | Very low | 111 Ų | 111 | 133.7 Ų | 133.7 | 92% | 0.917 | 86% | 0.863 | S | S | * | * | trans | 179.4 | 121.6 | 132.3 | 0 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 175 | G | 49.4 | Very low | 49.2 | Very low | 75 Ų | 75 | 135.5 Ų | 135.5 | 77% | 0.773 | 87% | 0.866 | S | S | * | * | trans | 167.2 | 57.4 | 174.1 | 0 | 0 | 0 | 0 | 0 | 114.1 | G177 | G175-G177 PolarHBondContact O-N 3.28Š| ||
| 176 | L | 50.8 | Low | 49.7 | Very low | 179 Ų | 179 | 138.8 Ų | 138.8 | 94% | 0.937 | 87% | 0.872 | S | S | * | * | trans | -45.6 | 122.6 | 166.8 | -98.3 | 66.7 | 0 | 0 | 0 | 110.9 | A178 | L176-A178 PolarHBondContact O-N 2.8Š| ||
| 177 | G | 44.7 | Very low | 49.8 | Very low | 70 Ų | 70 | 138.3 Ų | 138.3 | 72% | 0.722 | 87% | 0.87 | S | S | * | * | trans | -69.1 | 120.8 | 169.2 | 0 | 0 | 0 | 0 | 0 | 111 | G175 | G175-G177 PolarHBondContact O-N 3.28Š| ||
| 178 | A | 47 | Very low | 49.7 | Very low | 101 Ų | 101 | 141 Ų | 141 | 84% | 0.835 | 88% | 0.876 | S | S | * | * | trans | -80.3 | 119.8 | 161.5 | 0 | 0 | 0 | 0 | 0 | 108.7 | L176 | L176-A178 PolarHBondContact O-N 2.8Š| ||
| 179 | M | 50.1 | Low | 50.2 | Low | 185 Ų | 185 | 139.9 Ų | 139.9 | 91% | 0.911 | 88% | 0.88 | S | S | * | * | trans | -128.5 | 108.3 | 164.1 | -56.5 | -164.1 | -176.7 | 0 | 0 | 107.7 | ||||
| 180 | G | 47.5 | Very low | 50 | Low | 83 Ų | 83 | 137.6 Ų | 137.6 | 86% | 0.856 | 88% | 0.877 | S | S | * | * | P | Polyproline II helix | trans | -66.1 | 138.1 | 177.4 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||
| 181 | A | 49 | Very low | 50.1 | Low | 103 Ų | 103 | 137.1 Ų | 137.1 | 85% | 0.851 | 89% | 0.886 | S | S | * | * | P | Polyproline II helix | trans | -81.9 | 121 | 169.1 | 0 | 0 | 0 | 0 | 0 | 109.6 | ||
| 182 | G | 47.8 | Very low | 50.2 | Low | 77 Ų | 77 | 135.7 Ų | 135.7 | 79% | 0.794 | 89% | 0.89 | S | S | * | * | P | Polyproline II helix | trans | -70.9 | 137.4 | 158.9 | 0 | 0 | 0 | 0 | 0 | 109.8 | ||
| 183 | R | 53.4 | Low | 50.2 | Low | 241 Ų | 241 | 132.8 Ų | 132.8 | 91% | 0.909 | 89% | 0.89 | S | S | * | * | P | Polyproline II helix | trans | -85.4 | 167 | -179.4 | -112.8 | -178.3 | 154.4 | -170.5 | -6.1 | 111.4 | ||
| 184 | P | 63.3 | Low | 49.9 | Very low | 191 Ų | 191 | 128.7 Ų | 128.7 | 100% | 1.24 | 89% | 0.886 | S | S | * | * | trans | -73.1 | 0 | -167.7 | 32.6 | -36.4 | 0 | 0 | 0 | 114.5 |
Retrieved 184 of 184 residues in 77.7 ms
(Link to these results)