| 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 | 38.6 | Very low | 38.8 | Very low | 213 Ų | 213 | 164.8 Ų | 164.8 | 100% | 1.049 | 81% | 0.814 | S | S | * | * | 0 | 131.3 | 0 | -157.3 | -169.4 | -74.5 | 0 | 0 | 106.3 | |||||
| 2 | W | 36.8 | Very low | 38 | Very low | 218 Ų | 218 | 171.4 Ų | 171.4 | 83% | 0.826 | 82% | 0.823 | S | S | * | * | trans | 76.3 | 130.6 | 178.3 | -50.2 | 90.5 | 0 | 0 | 0 | 115.9 | ||||
| 3 | L | 44 | Very low | 37.8 | Very low | 133 Ų | 133 | 168.3 Ų | 168.3 | 70% | 0.696 | 82% | 0.822 | S | S | * | * | cis | -162.5 | 161.4 | -14.1 | -152.6 | 114.2 | 0 | 0 | 0 | 108.5 | ||||
| 4 | L | 44.5 | Very low | 37.4 | Very low | 146 Ų | 146 | 163.3 Ų | 163.3 | 76% | 0.764 | 82% | 0.821 | S | S | * | * | trans | -57.7 | 154.9 | 177.9 | -79.4 | 64.2 | 0 | 0 | 0 | 113.5 | ||||
| 5 | E | 41.1 | Very low | 37.1 | Very low | 197 Ų | 197 | 165.1 Ų | 165.1 | 92% | 0.921 | 83% | 0.826 | S | S | * | * | -151.8 | 136.7 | 120.1 | -143.5 | 177.9 | 156.7 | 0 | 0 | 112.2 | |||||
| 6 | K | 43.3 | Very low | 36.7 | Very low | 193 Ų | 193 | 160.9 Ų | 160.9 | 84% | 0.839 | 83% | 0.825 | S | S | * | * | trans | -116.3 | 142.1 | -178.1 | -103.1 | -152.8 | 177.6 | -172.3 | 0 | 108.1 | ||||
| 7 | A | 40.8 | Very low | 36.4 | Very low | 105 Ų | 105 | 156.4 Ų | 156.4 | 87% | 0.868 | 83% | 0.826 | S | S | * | * | trans | -179.4 | 135.6 | 137.2 | 0 | 0 | 0 | 0 | 0 | 107.3 | ||||
| 8 | G | 35.1 | Very low | 36.1 | Very low | 61 Ų | 61 | 152.9 Ų | 152.9 | 63% | 0.629 | 82% | 0.824 | S | S | * | * | cis | 132.8 | 110.6 | 11.5 | 0 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 9 | Y | 32.4 | Very low | 36.1 | Very low | 221 Ų | 221 | 158.5 Ų | 158.5 | 87% | 0.867 | 83% | 0.832 | S | S | * | * | trans | 65.7 | 152.5 | 149.9 | -68.2 | -74.2 | 0 | 0 | 0 | 118.6 | ||||
| 10 | R | 36.2 | Very low | 35.8 | Very low | 209 Ų | 209 | 158.7 Ų | 158.7 | 79% | 0.789 | 83% | 0.828 | S | S | * | * | cis | -160 | 145.8 | 0.7 | -114 | -155.3 | -166.1 | -118.7 | 2.3 | 109.2 | ||||
| 11 | V | 33.9 | Very low | 35.4 | Very low | 117 Ų | 117 | 155.3 Ų | 155.3 | 71% | 0.709 | 82% | 0.823 | S | S | * | * | trans | -2.7 | 133.3 | 140.3 | 178.4 | 0 | 0 | 0 | 0 | 119.2 | ||||
| 12 | R | 29.8 | Very low | 35 | Very low | 244 Ų | 244 | 152.7 Ų | 152.7 | 92% | 0.921 | 81% | 0.808 | S | S | * | * | -171.3 | 148.3 | 123 | -109.3 | 177.8 | 148.6 | 142.4 | -4.6 | 115.6 | |||||
| 13 | T | 35.2 | Very low | 34.7 | Very low | 131 Ų | 131 | 147.3 Ų | 147.3 | 80% | 0.804 | 80% | 0.804 | S | S | * | * | trans | -93.5 | 157 | -173.6 | 13.3 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 14 | A | 32.8 | Very low | 34.4 | Very low | 98 Ų | 98 | 146 Ų | 146 | 81% | 0.81 | 81% | 0.806 | S | S | * | * | trans | 149.5 | 114.9 | 144.3 | 0 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 15 | E | 32.4 | Very low | 34.1 | Very low | 191 Ų | 191 | 147.1 Ų | 147.1 | 89% | 0.893 | 81% | 0.812 | S | S | * | * | 93.9 | 128.8 | 68.8 | -124.3 | -162.5 | -177 | 0 | 0 | 116 | |||||
| 16 | A | 31.3 | Very low | 34.2 | Very low | 98 Ų | 98 | 144 Ų | 144 | 81% | 0.81 | 81% | 0.806 | S | S | * | * | trans | 55.6 | 134.8 | 148.3 | 0 | 0 | 0 | 0 | 0 | 123.8 | ||||
| 17 | G | 30.6 | Very low | 33.8 | Very low | 83 Ų | 83 | 140.8 Ų | 140.8 | 86% | 0.856 | 81% | 0.805 | S | S | * | * | trans | 169.6 | 96.5 | 158.9 | 0 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 18 | A | 32.1 | Very low | 33.6 | Very low | 95 Ų | 95 | 146.9 Ų | 146.9 | 79% | 0.785 | 81% | 0.805 | S | S | * | * | trans | -63.5 | 159.4 | -179.9 | 0 | 0 | 0 | 0 | 0 | 115.8 | ||||
| 19 | R | 34.9 | Very low | 33.8 | Very low | 258 Ų | 258 | 155 Ų | 155 | 97% | 0.974 | 82% | 0.817 | S | S | * | * | -173.4 | 145.6 | 126.5 | -98.6 | 162.2 | -167.6 | -145.7 | 3.9 | 113.4 | |||||
| 20 | Q | 29.5 | Very low | 33.9 | Very low | 162 Ų | 162 | 156 Ų | 156 | 76% | 0.757 | 82% | 0.819 | S | S | * | * | trans | -116 | 144.5 | -165.9 | 170.1 | -174.9 | -0.6 | 0 | 0 | 109.9 | H22 | Q20-H22 PolarHBondContact NE2-NE2 3Š| ||
| 21 | A | 28.2 | Very low | 34.3 | Very low | 88 Ų | 88 | 152.2 Ų | 152.2 | 73% | 0.727 | 82% | 0.819 | S | S | * | * | trans | -169.9 | 114.6 | 151.4 | 0 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 22 | H | 30.8 | Very low | 34.6 | Very low | 158 Ų | 158 | 152.2 Ų | 152.2 | 73% | 0.731 | 82% | 0.822 | S | S | * | * | 53.6 | 126.8 | 84.5 | -62.2 | -70.6 | 0 | 0 | 0 | 111.3 | Q20 | Q20-H22 PolarHBondContact NE2-NE2 3Š| |||
| 23 | S | 29.3 | Very low | 34.7 | Very low | 106 Ų | 106 | 143.9 Ų | 143.9 | 74% | 0.741 | 81% | 0.811 | S | S | * | * | cis | -170.3 | 148 | 31 | 165.5 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 24 | S | 38.5 | Very low | 35.2 | Very low | 105 Ų | 105 | 143 Ų | 143 | 73% | 0.734 | 81% | 0.811 | S | S | * | * | trans | -77.7 | 132.8 | 169.3 | 49.1 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 25 | L | 38.4 | Very low | 35.8 | Very low | 169 Ų | 169 | 144.1 Ų | 144.1 | 89% | 0.885 | 81% | 0.809 | S | S | * | * | trans | -149.2 | 119.4 | 152.6 | -75.3 | 179.9 | 0 | 0 | 0 | 111.2 | ||||
| 26 | V | 42.2 | Very low | 36.5 | Very low | 131 Ų | 131 | 139.6 Ų | 139.6 | 79% | 0.794 | 80% | 0.799 | S | S | * | * | trans | -73.5 | 148.6 | 168.2 | 176 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 27 | P | 36 | Very low | 37.8 | Very low | 126 Ų | 126 | 145.9 Ų | 145.9 | 82% | 0.818 | 80% | 0.802 | S | S | * | * | -135.5 | 155.7 | 127 | 20.2 | 0.2 | 0 | 0 | 0 | 114.9 | |||||
| 28 | R | 35.5 | Very low | 38.9 | Very low | 233 Ų | 233 | 146.5 Ų | 146.5 | 88% | 0.879 | 79% | 0.792 | S | S | * | * | trans | -66.8 | 145.6 | -174.4 | -77.7 | -175.2 | 158.8 | -164.2 | -1.6 | 115.7 | ||||
| 29 | R | 40.5 | Very low | 39.9 | Very low | 233 Ų | 233 | 147 Ų | 147 | 88% | 0.879 | 78% | 0.782 | S | S | * | * | trans | 32.8 | 107.8 | 131.6 | -149.6 | -178 | -166.6 | -159.5 | 3.9 | 117.9 | ||||
| 30 | R | 32.9 | Very low | 41.2 | Very low | 241 Ų | 241 | 140.2 Ų | 140.2 | 91% | 0.909 | 77% | 0.77 | S | S | * | * | trans | -139.7 | 131.7 | 143.3 | -77.8 | -169.2 | -169.7 | -158.4 | 2.4 | 110.1 | ||||
| 31 | V | 44.7 | Very low | 42.8 | Very low | 130 Ų | 130 | 139.8 Ų | 139.8 | 79% | 0.788 | 77% | 0.773 | S | S | * | * | trans | -78.8 | 136.8 | 161.4 | 174.3 | 0 | 0 | 0 | 0 | 107.2 | ||||
| 32 | P | 41.1 | Very low | 44.9 | Very low | 117 Ų | 117 | 139.4 Ų | 139.4 | 76% | 0.76 | 76% | 0.762 | S | S | * | * | -143.4 | 141.1 | 128.8 | 30.2 | -12.8 | 0 | 0 | 0 | 113.6 | |||||
| 33 | G | 31.3 | Very low | 46.5 | Very low | 68 Ų | 68 | 138 Ų | 138 | 70% | 0.701 | 76% | 0.759 | S | S | * | * | trans | 76.8 | 124.1 | 132.5 | 0 | 0 | 0 | 0 | 0 | 119 | ||||
| 34 | S | 46.4 | Very low | 48.1 | Very low | 114 Ų | 114 | 135.6 Ų | 135.6 | 80% | 0.797 | 74% | 0.74 | S | S | * | * | trans | -43.8 | 137.2 | 172.8 | 54.3 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 35 | P | 45.3 | Very low | 49.2 | Very low | 120 Ų | 120 | 135.5 Ų | 135.5 | 78% | 0.779 | 74% | 0.737 | S | S | * | * | trans | -88.4 | 116.2 | 151.9 | 31.2 | -24.6 | 0 | 0 | 0 | 110 | ||||
| 36 | S | 47.6 | Very low | 50.3 | Low | 96 Ų | 96 | 134.7 Ų | 134.7 | 67% | 0.671 | 73% | 0.733 | S | S | * | * | trans | 7.9 | 130.4 | 142.7 | 41 | 0 | 0 | 0 | 0 | 118.5 | C38 | S36-C38 PolarHBondContact O-N 3.28Å; S36-C38 VanDerWaalsContact O-N 3.15Å | ||
| 37 | R | 57.5 | Low | 51.5 | Low | 231 Ų | 231 | 133.7 Ų | 133.7 | 87% | 0.872 | 72% | 0.715 | S | S | * | * | trans | -46.4 | 108.2 | 164.6 | -63.7 | 171.6 | 174.7 | -162.5 | -2.7 | 111.8 | ||||
| 38 | C | 53.7 | Low | 53.2 | Low | 96 Ų | 96 | 130.9 Ų | 130.9 | 65% | 0.649 | 69% | 0.693 | S | S | * | * | trans | -123 | 120.5 | 160.4 | -57.3 | 0 | 0 | 0 | 0 | 106.3 | S36 | S36-C38 PolarHBondContact O-N 3.28Å; S36-C38 VanDerWaalsContact O-N 3.15Å | ||
| 39 | N | 54.6 | Low | 55.1 | Low | 106 Ų | 106 | 123.1 Ų | 123.1 | 57% | 0.567 | 67% | 0.673 | S | S | * | * | trans | 91.4 | 94 | -179.8 | -43.6 | -41.3 | 0 | 0 | 0 | 115.4 | N41 V42 R47 | N39-N41 PolarHBondContact O-N 3.44Å; N39-V42 HydrophobicContact CB-CB 4.49Å; N39-V42 HydrophobicContact CB-CG2 3.76Å; N39-R47 PolarHBondContact O-NH1 3.04Å | ||
| 40 | P | 60.9 | Low | 56.4 | Low | 114 Ų | 114 | 120.4 Ų | 120.4 | 74% | 0.74 | 67% | 0.67 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -70.3 | -15.1 | 170.9 | 28.3 | -33.1 | 0 | 0 | 0 | 113.3 | ||
| 41 | N | 64 | Low | 58.3 | Low | 153 Ų | 153 | 118 Ų | 118 | 82% | 0.818 | 67% | 0.667 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -100 | 8.3 | -173.1 | -62.5 | -16.9 | 0 | 0 | 0 | 114.6 | N39 | N39-N41 PolarHBondContact O-N 3.44Š|
| 42 | V | 72.2 | Confident | 59.3 | Low | 80 Ų | 80 | 119 Ų | 119 | 49% | 0.485 | 66% | 0.661 | S | S | . | * | trans | -99 | 110.3 | 174.1 | -178.3 | 0 | 0 | 0 | 0 | 107.8 | N39 T44 | N39-V42 HydrophobicContact CB-CB 4.49Å; N39-V42 HydrophobicContact CB-CG2 3.76Å; V42-T44 HydrophobicContact CG1-CG2 4.46Å; V42-T44 PolarHBondContact O-N 2.82Å | ||
| 43 | L | 64.4 | Low | 60.9 | Low | 129 Ų | 129 | 117.7 Ų | 117.7 | 68% | 0.675 | 65% | 0.646 | S | S | * | * | trans | -73.5 | 92.5 | 171 | -67.9 | 174.4 | 0 | 0 | 0 | 108.2 | R47 | L43-R47 HydrophobicContact CD2-CB 4.41Š| ||
| 44 | T | 62.6 | Low | 62.7 | Low | 55 Ų | 55 | 119.4 Ų | 119.4 | 34% | 0.337 | 65% | 0.645 | S | S | . | * | trans | -69.1 | 157.1 | 161.1 | 54.1 | 0 | 0 | 0 | 0 | 108.9 | V42 D46 R47 | V42-T44 HydrophobicContact CG1-CG2 4.46Å; V42-T44 PolarHBondContact O-N 2.82Å; T44-D46 PolarHBondContact O-N 2.75Å; T44-R47 PolarHBondContact O-N 2.95Å | ||
| 45 | P | 62.2 | Low | 63.8 | Low | 104 Ų | 104 | 119.7 Ų | 119.7 | 68% | 0.675 | 64% | 0.644 | S | S | * | * | G | 310 helix | trans | -49.9 | -30.3 | 179.2 | -26.8 | 34.3 | 0 | 0 | 0 | 113.3 | ||
| 46 | D | 61.2 | Low | 64.6 | Low | 151 Ų | 151 | 125.2 Ų | 125.2 | 81% | 0.807 | 65% | 0.65 | S | S | * | * | G | 310 helix | trans | -82.9 | -4.7 | -177.9 | -41.6 | -55.8 | 0 | 0 | 0 | 114.6 | T44 | T44-D46 PolarHBondContact O-N 2.75Š|
| 47 | R | 67.4 | Low | 64.9 | Low | 110 Ų | 110 | 128.5 Ų | 128.5 | 42% | 0.415 | 66% | 0.659 | S | S | . | * | G | 310 helix | trans | -111 | 4.1 | 179.7 | -72.5 | -174.9 | -178.4 | 173.3 | 5.2 | 113.8 | N39 L43 T44 P49 | N39-R47 PolarHBondContact O-NH1 3.04Å; L43-R47 HydrophobicContact CD2-CB 4.41Å; T44-R47 PolarHBondContact O-N 2.95Å; R47-P49 WeakPolarHBondContact O-CD 3.4Å |
| 48 | I | 72 | Confident | 64.4 | Low | 67 Ų | 67 | 128.9 Ų | 128.9 | 34% | 0.344 | 66% | 0.66 | S | S | . | * | S | Bend | trans | -74 | 120.7 | 178.3 | -59.7 | 174.7 | 0 | 0 | 0 | 108.2 | Q50 F52 I53 | I48-Q50 PolarHBondContact O-N 2.65Å; I48-F52 HydrophobicContact CG2-CB 3.56Å; I48-I53 HydrophobicContact CG2-CD1 4.49Å; I48-I53 HydrophobicContact CG2-CG1 3.96Å |
| 49 | P | 74.4 | Confident | 64.1 | Low | 71 Ų | 71 | 131.6 Ų | 131.6 | 46% | 0.461 | 67% | 0.668 | S | S | . | * | trans | -57.7 | 140.3 | 173.6 | -21 | 31.8 | 0 | 0 | 0 | 110.1 | R47 F51 F52 | R47-P49 WeakPolarHBondContact O-CD 3.4Å; P49-F51 PolarHBondContact O-N 2.87Å; P49-F52 HydrophobicContact CB-CD2 4.21Å; P49-F52 HydrophobicContact CG-CD2 4.16Å; P49-F52 PolarHBondContact O-N 2.81Å | ||
| 50 | Q | 67.9 | Low | 63.7 | Low | 175 Ų | 175 | 132.9 Ų | 132.9 | 82% | 0.818 | 68% | 0.682 | S | S | * | * | G | 310 helix | trans | -52.9 | -26.1 | -177.3 | -83.5 | -179.5 | -16.4 | 0 | 0 | 114 | I48 F52 I53 | I48-Q50 PolarHBondContact O-N 2.65Å; Q50-F52 PolarHBondContact O-N 2.96Å; Q50-I53 PolarHBondContact O-N 3Å; Q50-I53 VanDerWaalsContact O-N 3.14Å |
| 51 | F | 74.3 | Confident | 62.4 | Low | 191 Ų | 191 | 132.5 Ų | 132.5 | 84% | 0.838 | 68% | 0.682 | S | S | * | * | G | 310 helix | trans | -60.3 | -29.4 | 174.8 | -175.1 | -99.6 | 0 | 0 | 0 | 113.9 | P49 I53 | P49-F51 PolarHBondContact O-N 2.87Å; F51-I53 VanDerWaalsContact C-N 3.35Å |
| 52 | F | 65 | Low | 61.3 | Low | 151 Ų | 151 | 129.3 Ų | 129.3 | 66% | 0.662 | 69% | 0.686 | S | S | * | * | G | 310 helix | trans | -88.9 | -0.9 | 178.8 | -73.8 | -83.4 | 0 | 0 | 0 | 113.4 | I48 P49 Q50 | I48-F52 HydrophobicContact CG2-CB 3.56Å; P49-F52 HydrophobicContact CB-CD2 4.21Å; P49-F52 HydrophobicContact CG-CD2 4.16Å; P49-F52 PolarHBondContact O-N 2.81Å; Q50-F52 PolarHBondContact O-N 2.96Å |
| 53 | I | 73.6 | Confident | 59.7 | Low | 89 Ų | 89 | 129.8 Ų | 129.8 | 46% | 0.456 | 70% | 0.698 | S | S | . | * | S | Bend | trans | -101.7 | 113.3 | 175.9 | -56.3 | 175.8 | 0 | 0 | 0 | 107 | I48 Q50 F51 | I48-I53 HydrophobicContact CG2-CD1 4.49Å; I48-I53 HydrophobicContact CG2-CG1 3.96Å; Q50-I53 PolarHBondContact O-N 3Å; Q50-I53 VanDerWaalsContact O-N 3.14Å; F51-I53 VanDerWaalsContact C-N 3.35Å |
| 54 | P | 70.3 | Confident | 58.5 | Low | 105 Ų | 105 | 133.3 Ų | 133.3 | 68% | 0.682 | 71% | 0.711 | S | S | * | * | P | Polyproline II helix | trans | -55.5 | 137.4 | 176.9 | -22.7 | 32 | 0 | 0 | 0 | 110.6 | R56 | P54-R56 PolarHBondContact O-N 2.92Š|
| 55 | P | 68.8 | Low | 57.2 | Low | 120 Ų | 120 | 135.2 Ų | 135.2 | 78% | 0.779 | 73% | 0.732 | S | S | * | * | P | Polyproline II helix | trans | -60.2 | 128.3 | 176.4 | 24.7 | -32.1 | 0 | 0 | 0 | 109 | L57 | P55-L57 PolarHBondContact O-N 3.34Š|
| 56 | R | 62.3 | Low | 55.8 | Low | 236 Ų | 236 | 141.9 Ų | 141.9 | 89% | 0.891 | 74% | 0.744 | S | S | * | * | P | Polyproline II helix | trans | -66.2 | 121.3 | 176 | -67 | -172.4 | -179.8 | 170.8 | 1 | 108.4 | P54 R58 | P54-R56 PolarHBondContact O-N 2.92Å; R56-R58 PolarHBondContact O-N 3.22Å |
| 57 | L | 53.3 | Low | 54.7 | Low | 164 Ų | 164 | 141 Ų | 141 | 86% | 0.859 | 74% | 0.744 | S | S | * | * | P | Polyproline II helix | trans | -57.6 | 122.3 | 169.7 | -63.6 | 171.1 | 0 | 0 | 0 | 107.6 | P55 D59 | P55-L57 PolarHBondContact O-N 3.34Å; L57-D59 PolarHBondContact O-N 3.45Å |
| 58 | R | 47.2 | Very low | 53.2 | Low | 240 Ų | 240 | 143.2 Ų | 143.2 | 91% | 0.906 | 76% | 0.764 | S | S | * | * | P | Polyproline II helix | trans | -68.6 | 121.2 | 171.5 | -77.7 | 176.6 | 174.1 | 155.9 | -2.5 | 107.7 | R56 | R56-R58 PolarHBondContact O-N 3.22Š|
| 59 | D | 47.5 | Very low | 51.7 | Low | 153 Ų | 153 | 149.9 Ų | 149.9 | 82% | 0.818 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -65.9 | 124.7 | 164.3 | -68.2 | -42.1 | 0 | 0 | 0 | 108.7 | L57 S61 | L57-D59 PolarHBondContact O-N 3.45Å; D59-S61 PolarHBondContact O-N 3.26Å; D59-S61 VanDerWaalsContact O-N 3.12Å |
| 60 | P | 46.9 | Very low | 49.7 | Very low | 133 Ų | 133 | 153.4 Ų | 153.4 | 86% | 0.864 | 80% | 0.799 | S | S | * | * | trans | -84.9 | 84.9 | 175.9 | 33.8 | -29.9 | 0 | 0 | 0 | 108.6 | ||||
| 61 | S | 33.9 | Very low | 48.3 | Very low | 106 Ų | 106 | 153.3 Ų | 153.3 | 74% | 0.741 | 80% | 0.804 | S | S | * | * | trans | -155.8 | 84.3 | 159.5 | -173.5 | 0 | 0 | 0 | 0 | 110.3 | D59 | D59-S61 PolarHBondContact O-N 3.26Å; D59-S61 VanDerWaalsContact O-N 3.12Å | ||
| 62 | G | 39.1 | Very low | 46.4 | Very low | 86 Ų | 86 | 148 Ų | 148 | 89% | 0.887 | 80% | 0.803 | S | S | * | * | trans | -76.5 | 119.4 | 154.6 | 0 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 63 | A | 38.9 | Very low | 45 | Very low | 89 Ų | 89 | 144.3 Ų | 144.3 | 74% | 0.736 | 81% | 0.808 | S | S | * | * | trans | -150.8 | 115.3 | 154.3 | 0 | 0 | 0 | 0 | 0 | 108 | ||||
| 64 | E | 40.3 | Very low | 43.4 | Very low | 203 Ų | 203 | 151 Ų | 151 | 95% | 0.949 | 83% | 0.827 | S | S | * | * | trans | -57.3 | 134.7 | 168.5 | -67.1 | -169.8 | 128 | 0 | 0 | 110.8 | ||||
| 65 | A | 34.1 | Very low | 41.9 | Very low | 95 Ų | 95 | 152.7 Ų | 152.7 | 79% | 0.785 | 83% | 0.831 | S | S | * | * | trans | -151.6 | 97.4 | 155.4 | 0 | 0 | 0 | 0 | 0 | 110 | ||||
| 66 | R | 34 | Very low | 40.8 | Very low | 244 Ų | 244 | 155.2 Ų | 155.2 | 92% | 0.921 | 84% | 0.837 | S | S | * | * | trans | 33.7 | 120.6 | 137 | -65.4 | -178.7 | 172.1 | 161.8 | -1.6 | 118.5 | D68 | R66-D68 PolarHBondContact O-N 3.42Š| ||
| 67 | V | 38.6 | Very low | 40.1 | Very low | 134 Ų | 134 | 149.4 Ų | 149.4 | 81% | 0.812 | 83% | 0.829 | S | S | * | * | trans | -32.1 | 121.7 | 153.7 | 179.7 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 68 | D | 35.2 | Very low | 39.7 | Very low | 156 Ų | 156 | 147.9 Ų | 147.9 | 83% | 0.834 | 83% | 0.827 | S | S | * | * | trans | -140.9 | 135.2 | 139.2 | -147.6 | -6.4 | 0 | 0 | 0 | 110.8 | R66 | R66-D68 PolarHBondContact O-N 3.42Š| ||
| 69 | R | 39.4 | Very low | 39.3 | Very low | 207 Ų | 207 | 142 Ų | 142 | 78% | 0.781 | 82% | 0.818 | S | S | * | * | trans | -82.5 | 132.8 | 178.7 | -65.6 | 173.5 | -169.8 | 167.8 | 3.7 | 107.1 | ||||
| 70 | N | 33 | Very low | 38.9 | Very low | 144 Ų | 144 | 140.9 Ų | 140.9 | 77% | 0.77 | 82% | 0.82 | S | S | * | * | 179.4 | 119.6 | 127.1 | -91.5 | -35 | 0 | 0 | 0 | 113.1 | |||||
| 71 | L | 39.3 | Very low | 38.6 | Very low | 173 Ų | 173 | 139.7 Ų | 139.7 | 91% | 0.906 | 82% | 0.815 | S | S | * | * | trans | 38.9 | 105.8 | 133.2 | -67.5 | 159.4 | 0 | 0 | 0 | 119.4 | ||||
| 72 | G | 34.8 | Very low | 39.4 | Very low | 81 Ų | 81 | 141.7 Ų | 141.7 | 84% | 0.835 | 82% | 0.817 | S | S | * | * | trans | -176.7 | 103.6 | 159.3 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 73 | G | 34.3 | Very low | 40.3 | Very low | 73 Ų | 73 | 143.5 Ų | 143.5 | 75% | 0.753 | 81% | 0.813 | S | S | * | * | trans | -76.6 | 154.9 | -166.8 | 0 | 0 | 0 | 0 | 0 | 116.5 | ||||
| 74 | R | 39.9 | Very low | 40.6 | Very low | 228 Ų | 228 | 147.4 Ų | 147.4 | 86% | 0.86 | 82% | 0.815 | S | S | * | * | trans | 76.6 | 105.4 | 134.3 | -69.2 | 177 | 141.9 | 179.7 | -6.9 | 119.3 | ||||
| 75 | N | 39.1 | Very low | 40.7 | Very low | 142 Ų | 142 | 146.2 Ų | 146.2 | 76% | 0.759 | 82% | 0.815 | S | S | * | * | 65.5 | 100.1 | 120.4 | -62.3 | -24.6 | 0 | 0 | 0 | 118.8 | |||||
| 76 | L | 46.3 | Very low | 41.1 | Very low | 173 Ų | 173 | 146.7 Ų | 146.7 | 91% | 0.906 | 82% | 0.818 | S | S | * | * | P | Polyproline II helix | trans | -66.5 | 133 | 148.1 | -66 | 162.6 | 0 | 0 | 0 | 110 | ||
| 77 | P | 46.8 | Very low | 41.2 | Very low | 113 Ų | 113 | 138.8 Ų | 138.8 | 73% | 0.734 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -100.2 | 120.8 | 154.5 | 31.8 | -23.8 | 0 | 0 | 0 | 110.5 | ||
| 78 | V | 44.4 | Very low | 41.5 | Very low | 133 Ų | 133 | 142.1 Ų | 142.1 | 81% | 0.806 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -69.3 | 117.4 | 150.4 | 168 | 0 | 0 | 0 | 0 | 107.1 | ||
| 79 | T | 39.2 | Very low | 42.1 | Very low | 117 Ų | 117 | 141.6 Ų | 141.6 | 72% | 0.718 | 80% | 0.803 | S | S | * | * | trans | -146.9 | 123.3 | 150.6 | 59.1 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 80 | C | 40 | Very low | 42.6 | Very low | 128 Ų | 128 | 135 Ų | 135 | 87% | 0.865 | 80% | 0.8 | S | S | * | * | trans | -65.6 | 127.4 | 170.2 | -53 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 81 | S | 40.9 | Very low | 42.9 | Very low | 109 Ų | 109 | 139.9 Ų | 139.9 | 76% | 0.762 | 81% | 0.807 | S | S | * | * | trans | -121.4 | 110 | 165.8 | 8.5 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 82 | L | 50.8 | Low | 43.1 | Very low | 148 Ų | 148 | 136.6 Ų | 136.6 | 78% | 0.775 | 81% | 0.806 | S | S | * | * | trans | -67.9 | 128.8 | 165.9 | -81.5 | 154.2 | 0 | 0 | 0 | 109.1 | H84 | L82-H84 PolarHBondContact O-N 3.02Å; L82-H84 PolarHBondContact O-ND1 2.85Å | ||
| 83 | P | 56.1 | Low | 43.4 | Very low | 124 Ų | 124 | 142.4 Ų | 142.4 | 81% | 0.805 | 81% | 0.808 | S | S | * | * | trans | -72.9 | 115.1 | 166.7 | 28.7 | -29.7 | 0 | 0 | 0 | 109 | ||||
| 84 | H | 45.2 | Very low | 44.3 | Very low | 170 Ų | 170 | 145.8 Ų | 145.8 | 79% | 0.787 | 81% | 0.808 | S | S | * | * | trans | -72.5 | 130.4 | 166.6 | -72.7 | 31.1 | 0 | 0 | 0 | 108.9 | L82 A86 | L82-H84 PolarHBondContact O-N 3.02Å; L82-H84 PolarHBondContact O-ND1 2.85Å; H84-A86 PolarHBondContact O-N 2.91Å | ||
| 85 | L | 43.7 | Very low | 44.5 | Very low | 179 Ų | 179 | 140.7 Ų | 140.7 | 94% | 0.937 | 81% | 0.805 | S | S | * | * | trans | -61.9 | 108.4 | 171.1 | -76.3 | 158.5 | 0 | 0 | 0 | 109.7 | G87 | L85-G87 PolarHBondContact O-N 3.04Š| ||
| 86 | A | 41.4 | Very low | 44.4 | Very low | 104 Ų | 104 | 142 Ų | 142 | 86% | 0.86 | 81% | 0.806 | S | S | * | * | trans | -83.5 | 94.1 | 158.7 | 0 | 0 | 0 | 0 | 0 | 107.9 | H84 | H84-A86 PolarHBondContact O-N 2.91Š| ||
| 87 | G | 36.7 | Very low | 44.5 | Very low | 78 Ų | 78 | 138.1 Ų | 138.1 | 80% | 0.804 | 79% | 0.794 | S | S | * | * | trans | -79.8 | 115.1 | 164.8 | 0 | 0 | 0 | 0 | 0 | 109.3 | L85 | L85-G87 PolarHBondContact O-N 3.04Š| ||
| 88 | R | 44.4 | Very low | 44.8 | Very low | 204 Ų | 204 | 138.5 Ų | 138.5 | 77% | 0.77 | 80% | 0.796 | S | S | * | * | trans | -93.1 | 149.3 | 161 | -158.1 | 178.2 | 176.6 | -98 | 9.3 | 107.2 | ||||
| 89 | E | 47.5 | Very low | 44.7 | Very low | 145 Ų | 145 | 140.6 Ų | 140.6 | 68% | 0.678 | 80% | 0.797 | S | S | * | * | S | Bend | trans | 66.4 | 94.1 | 179.5 | 42.3 | -88.5 | 158.7 | 0 | 0 | 119.9 | ||
| 90 | G | 50.5 | Low | 45.3 | Very low | 68 Ų | 68 | 141.6 Ų | 141.6 | 70% | 0.701 | 80% | 0.803 | S | S | * | * | trans | 85.7 | 158.1 | 130.4 | 0 | 0 | 0 | 0 | 0 | 117.9 | ||||
| 91 | W | 40.2 | Very low | 45.9 | Very low | 247 Ų | 247 | 146.6 Ų | 146.6 | 94% | 0.936 | 80% | 0.803 | S | S | * | * | trans | 87.5 | 98.8 | 176.3 | -48.7 | 85.8 | 0 | 0 | 0 | 115.4 | ||||
| 92 | A | 42.1 | Very low | 46.4 | Very low | 105 Ų | 105 | 152.1 Ų | 152.1 | 87% | 0.868 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -64.5 | 128.6 | 173 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||
| 93 | F | 40.8 | Very low | 46.1 | Very low | 202 Ų | 202 | 155.4 Ų | 155.4 | 89% | 0.886 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -81.6 | 116.8 | 166.2 | -84.7 | -96.5 | 0 | 0 | 0 | 109.2 | ||
| 94 | L | 54.3 | Low | 45.9 | Very low | 144 Ų | 144 | 157.5 Ų | 157.5 | 75% | 0.754 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -85.2 | 129.9 | 158.4 | -69.2 | 172.7 | 0 | 0 | 0 | 108.4 | E96 | L94-E96 PolarHBondContact O-N 3.5Š|
| 95 | P | 43.4 | Very low | 46.3 | Very low | 122 Ų | 122 | 153.8 Ų | 153.8 | 79% | 0.792 | 80% | 0.802 | S | S | * | * | trans | -83.1 | 84.5 | 164.6 | 32 | -29.6 | 0 | 0 | 0 | 109.1 | S97 | P95-S97 PolarHBondContact O-N 3.17Š| ||
| 96 | E | 38.4 | Very low | 46.5 | Very low | 169 Ų | 169 | 152 Ų | 152 | 79% | 0.79 | 79% | 0.793 | S | S | * | * | trans | -75.3 | 112.1 | 169.4 | -160.3 | 89 | -140.4 | 0 | 0 | 108.4 | L94 | L94-E96 PolarHBondContact O-N 3.5Š| ||
| 97 | S | 46.9 | Very low | 46.9 | Very low | 92 Ų | 92 | 155.9 Ų | 155.9 | 64% | 0.643 | 79% | 0.79 | S | S | * | * | trans | -70.7 | 154.6 | -179.6 | -64.5 | 0 | 0 | 0 | 0 | 111.7 | P95 H99 | P95-S97 PolarHBondContact O-N 3.17Å; S97-H99 PolarHBondContact O-N 3.21Å | ||
| 98 | P | 54.1 | Low | 47 | Very low | 120 Ų | 120 | 160.1 Ų | 160.1 | 78% | 0.779 | 79% | 0.789 | S | S | * | * | trans | -68.3 | 122 | -173.1 | -7.5 | 22.7 | 0 | 0 | 0 | 110.4 | T100 | P98-T100 PolarHBondContact O-N 3.26Š| ||
| 99 | H | 41 | Very low | 46.9 | Very low | 178 Ų | 178 | 156.8 Ų | 156.8 | 82% | 0.824 | 79% | 0.791 | S | S | * | * | trans | -61.6 | 107.7 | 174.3 | -132.1 | 75.1 | 0 | 0 | 0 | 109.9 | S97 | S97-H99 PolarHBondContact O-N 3.21Š| ||
| 100 | T | 53.1 | Low | 46.8 | Very low | 138 Ų | 138 | 155.5 Ų | 155.5 | 85% | 0.847 | 80% | 0.795 | S | S | * | * | trans | -92.9 | 100.7 | 161 | 49.5 | 0 | 0 | 0 | 0 | 107.6 | P98 | P98-T100 PolarHBondContact O-N 3.26Š| ||
| 101 | R | 53.1 | Low | 45.9 | Very low | 232 Ų | 232 | 164 Ų | 164 | 88% | 0.875 | 81% | 0.806 | S | S | * | * | trans | -150.4 | 145.2 | 157.9 | -147.8 | 173.8 | 178.6 | -148.2 | -1.2 | 111.5 | ||||
| 102 | R | 51.2 | Low | 45.5 | Very low | 225 Ų | 225 | 155.3 Ų | 155.3 | 85% | 0.849 | 79% | 0.793 | S | S | * | * | trans | -113.5 | 153.5 | -152.3 | -157.3 | -175.3 | -168.2 | -176.3 | 3.2 | 107.3 | ||||
| 103 | R | 44.3 | Very low | 45.3 | Very low | 217 Ų | 217 | 158.8 Ų | 158.8 | 82% | 0.819 | 80% | 0.796 | S | S | * | * | trans | 78.2 | 144 | 165.5 | -42.3 | 179.2 | 90.1 | -178.8 | 2.1 | 112.6 | ||||
| 104 | E | 52.2 | Low | 45 | Very low | 168 Ų | 168 | 153.2 Ų | 153.2 | 79% | 0.785 | 79% | 0.788 | S | S | * | * | cis | -148 | 150.1 | 28 | 40.4 | -86 | 163.5 | 0 | 0 | 115 | ||||
| 105 | S | 52 | Low | 43.9 | Very low | 93 Ų | 93 | 151.6 Ų | 151.6 | 65% | 0.65 | 80% | 0.795 | S | S | * | * | trans | -52 | 140.9 | 150.5 | 156.5 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 106 | L | 49.7 | Very low | 43.3 | Very low | 142 Ų | 142 | 149 Ų | 149 | 74% | 0.743 | 79% | 0.791 | S | S | * | * | trans | -164.4 | 109.7 | 143.2 | -102.1 | 159.1 | 0 | 0 | 0 | 110.6 | ||||
| 107 | F | 48.1 | Very low | 43.1 | Very low | 184 Ų | 184 | 149.6 Ų | 149.6 | 81% | 0.807 | 80% | 0.798 | S | S | * | * | trans | -57.7 | 132.9 | 152.6 | -70.9 | -95.4 | 0 | 0 | 0 | 108.8 | ||||
| 108 | H | 39.1 | Very low | 42.5 | Very low | 168 Ų | 168 | 149.5 Ų | 149.5 | 78% | 0.778 | 80% | 0.803 | S | S | * | * | trans | -158.7 | 113.7 | 140.5 | -85.3 | -56.5 | 0 | 0 | 0 | 110.4 | ||||
| 109 | V | 42.1 | Very low | 42 | Very low | 134 Ų | 134 | 149.6 Ų | 149.6 | 81% | 0.812 | 80% | 0.804 | S | S | * | * | trans | -92.2 | 138 | 146.7 | 172 | 0 | 0 | 0 | 0 | 105 | ||||
| 110 | P | 45.7 | Very low | 41.5 | Very low | 117 Ų | 117 | 145 Ų | 145 | 76% | 0.76 | 80% | 0.797 | S | S | * | * | -144.8 | 142.9 | 105 | 30.1 | -10.1 | 0 | 0 | 0 | 116.4 | |||||
| 111 | R | 32.5 | Very low | 40.6 | Very low | 246 Ų | 246 | 147.7 Ų | 147.7 | 93% | 0.928 | 80% | 0.8 | S | S | * | * | trans | 0.8 | 141.8 | 138.8 | -81.8 | 171.2 | 137.1 | 128.7 | -5.8 | 118.6 | ||||
| 112 | G | 31.7 | Very low | 39.8 | Very low | 65 Ų | 65 | 142.5 Ų | 142.5 | 67% | 0.67 | 80% | 0.799 | S | S | * | * | trans | 160.3 | 116.5 | 130.8 | 0 | 0 | 0 | 0 | 0 | 117.2 | ||||
| 113 | L | 37.9 | Very low | 39 | Very low | 178 Ų | 178 | 143.4 Ų | 143.4 | 93% | 0.932 | 80% | 0.803 | S | S | * | * | trans | 78.9 | 139.4 | 148.8 | -55.5 | 164.8 | 0 | 0 | 0 | 117.4 | ||||
| 114 | A | 33.5 | Very low | 38.6 | Very low | 85 Ų | 85 | 141.5 Ų | 141.5 | 70% | 0.702 | 81% | 0.808 | S | S | * | * | cis | -175.2 | 167.4 | -8.5 | 0 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 115 | A | 31.9 | Very low | 37.6 | Very low | 110 Ų | 110 | 142 Ų | 142 | 91% | 0.909 | 81% | 0.81 | S | S | * | * | trans | 78.6 | 127.9 | 166.9 | 0 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 116 | G | 30.9 | Very low | 36.8 | Very low | 69 Ų | 69 | 144.3 Ų | 144.3 | 71% | 0.711 | 82% | 0.82 | S | S | * | * | cis | 177.5 | 173.7 | 3.8 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 117 | L | 34.1 | Very low | 36.1 | Very low | 180 Ų | 180 | 142.1 Ų | 142.1 | 94% | 0.942 | 82% | 0.816 | S | S | * | * | trans | 85.6 | 99.2 | 164.5 | -53.7 | 173.1 | 0 | 0 | 0 | 117.3 | ||||
| 118 | A | 34.2 | Very low | 35.7 | Very low | 90 Ų | 90 | 137.9 Ų | 137.9 | 74% | 0.744 | 82% | 0.815 | S | S | * | * | trans | -69.9 | 165.5 | 147.8 | 0 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 119 | P | 44.4 | Very low | 36 | Very low | 122 Ų | 122 | 135.6 Ų | 135.6 | 79% | 0.792 | 82% | 0.815 | S | S | * | * | -144.4 | 164.6 | 94.9 | 36.3 | -20.3 | 0 | 0 | 0 | 116.4 | |||||
| 120 | A | 30.8 | Very low | 35.6 | Very low | 83 Ų | 83 | 135.9 Ų | 135.9 | 69% | 0.686 | 81% | 0.812 | S | S | * | * | trans | 62.8 | 101.5 | 146.5 | 0 | 0 | 0 | 0 | 0 | 119.2 | ||||
| 121 | Q | 34.3 | Very low | 35.3 | Very low | 194 Ų | 194 | 138.6 Ų | 138.6 | 91% | 0.907 | 82% | 0.819 | S | S | * | * | 80 | 104 | 90.3 | -77.8 | -173.3 | -3.4 | 0 | 0 | 114.7 | |||||
| 122 | S | 35.4 | Very low | 35.6 | Very low | 123 Ų | 123 | 137 Ų | 137 | 86% | 0.86 | 81% | 0.814 | S | S | * | * | trans | -158.7 | 99.7 | 141.6 | 50.4 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 123 | R | 34.4 | Very low | 35.7 | Very low | 244 Ų | 244 | 141.9 Ų | 141.9 | 92% | 0.921 | 82% | 0.823 | S | S | * | * | trans | -71.6 | 124 | 168.4 | -71.9 | 178.5 | 170.2 | -164.6 | -2.7 | 108.6 | ||||
| 124 | L | 35.8 | Very low | 35.5 | Very low | 177 Ų | 177 | 139.8 Ų | 139.8 | 93% | 0.927 | 82% | 0.822 | S | S | * | * | trans | -139.5 | 120.4 | 141.5 | -77.9 | -179.7 | 0 | 0 | 0 | 108.8 | ||||
| 125 | H | 32 | Very low | 35.5 | Very low | 178 Ų | 178 | 147.2 Ų | 147.2 | 82% | 0.824 | 83% | 0.832 | S | S | * | * | trans | -95.7 | 115.6 | -177.8 | -157.2 | -86.8 | 0 | 0 | 0 | 105.6 | ||||
| 126 | V | 33.9 | Very low | 36 | Very low | 141 Ų | 141 | 145.5 Ų | 145.5 | 86% | 0.855 | 82% | 0.817 | S | S | * | * | trans | -140.4 | 127.8 | 163.2 | -177.5 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 127 | S | 35.2 | Very low | 37.1 | Very low | 97 Ų | 97 | 148.2 Ų | 148.2 | 68% | 0.678 | 82% | 0.822 | S | S | * | * | P | Polyproline II helix | trans | -73.9 | 152.9 | -162.7 | -46.3 | 0 | 0 | 0 | 0 | 114.1 | ||
| 128 | A | 40.4 | Very low | 37 | Very low | 94 Ų | 94 | 146.1 Ų | 146.1 | 78% | 0.777 | 81% | 0.812 | S | S | * | * | P | Polyproline II helix | trans | -65.5 | 147.6 | 162 | 0 | 0 | 0 | 0 | 0 | 110.9 | ||
| 129 | P | 44.7 | Very low | 37.7 | Very low | 120 Ų | 120 | 147.8 Ų | 147.8 | 78% | 0.779 | 82% | 0.819 | S | S | * | * | P | Polyproline II helix | trans | -93.1 | 120.5 | 161.1 | 31.7 | -24.1 | 0 | 0 | 0 | 110.4 | ||
| 130 | D | 34.1 | Very low | 37.8 | Very low | 140 Ų | 140 | 149.3 Ų | 149.3 | 75% | 0.749 | 82% | 0.82 | S | S | * | * | P | Polyproline II helix | trans | -59.5 | 134.6 | 157.1 | -97.4 | -44.4 | 0 | 0 | 0 | 110 | ||
| 131 | L | 39.1 | Very low | 38.8 | Very low | 174 Ų | 174 | 152.3 Ų | 152.3 | 91% | 0.911 | 83% | 0.83 | S | S | * | * | trans | -125.7 | 95.8 | 160.1 | -72.3 | 177.9 | 0 | 0 | 0 | 108.6 | ||||
| 132 | R | 38.8 | Very low | 39 | Very low | 214 Ų | 214 | 146.8 Ų | 146.8 | 81% | 0.808 | 82% | 0.817 | S | S | * | * | trans | -120.5 | 147.5 | 161.7 | -76.8 | -168.1 | 169.3 | 119.6 | -4 | 108.6 | ||||
| 133 | L | 33.5 | Very low | 39.3 | Very low | 167 Ų | 167 | 147 Ų | 147 | 87% | 0.874 | 82% | 0.819 | S | S | * | * | trans | 88.8 | 107.3 | -174.2 | -55.8 | 155.5 | 0 | 0 | 0 | 110.6 | ||||
| 134 | C | 34.9 | Very low | 39.9 | Very low | 134 Ų | 134 | 140.9 Ų | 140.9 | 91% | 0.905 | 81% | 0.814 | S | S | * | * | -137.2 | 149 | 63.8 | -67.6 | 0 | 0 | 0 | 0 | 115.2 | |||||
| 135 | R | 33.5 | Very low | 40.9 | Very low | 241 Ų | 241 | 138.2 Ų | 138.2 | 91% | 0.909 | 81% | 0.807 | S | S | * | * | trans | -83.6 | 153.9 | 178.3 | -176.9 | 172.4 | -177.6 | 148.5 | -0.5 | 110.7 | ||||
| 136 | A | 40.9 | Very low | 41 | Very low | 73 Ų | 73 | 136.9 Ų | 136.9 | 60% | 0.603 | 81% | 0.806 | S | S | * | * | trans | -56.2 | 173.8 | -179.3 | 0 | 0 | 0 | 0 | 0 | 115.5 | ||||
| 137 | P | 53.7 | Low | 41.1 | Very low | 126 Ų | 126 | 134.6 Ų | 134.6 | 82% | 0.818 | 80% | 0.796 | S | S | * | * | -120.1 | 134.3 | 123.4 | 32.5 | -25.4 | 0 | 0 | 0 | 112 | |||||
| 138 | D | 33.9 | Very low | 41.3 | Very low | 137 Ų | 137 | 135.4 Ų | 135.4 | 73% | 0.733 | 80% | 0.802 | S | S | * | * | trans | -63.8 | 151 | 177 | -51.8 | -64 | 0 | 0 | 0 | 111.6 | ||||
| 139 | S | 47 | Very low | 41.8 | Very low | 125 Ų | 125 | 136 Ų | 136 | 87% | 0.874 | 80% | 0.798 | S | S | * | * | trans | -130.9 | 91 | 162.5 | -68.8 | 0 | 0 | 0 | 0 | 107.6 | ||||
| 140 | D | 47.3 | Very low | 41.1 | Very low | 153 Ų | 153 | 136.6 Ų | 136.6 | 82% | 0.818 | 80% | 0.803 | S | S | * | * | trans | -83.6 | 126.9 | 159.3 | -74.7 | -38.2 | 0 | 0 | 0 | 108.5 | ||||
| 141 | T | 51.4 | Low | 41 | Very low | 146 Ų | 146 | 133.6 Ų | 133.6 | 90% | 0.896 | 81% | 0.805 | S | S | * | * | trans | -132.3 | 111.8 | 136.3 | -46.7 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 142 | A | 39.8 | Very low | 41.1 | Very low | 78 Ų | 78 | 130.8 Ų | 130.8 | 65% | 0.645 | 80% | 0.8 | S | S | * | * | trans | -59.7 | 149.4 | 169.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 143 | S | 41.5 | Very low | 41.4 | Very low | 128 Ų | 128 | 126 Ų | 126 | 90% | 0.895 | 80% | 0.796 | S | S | * | * | -162.5 | 135.6 | 123.3 | -77.9 | 0 | 0 | 0 | 0 | 110.3 | |||||
| 144 | S | 46.5 | Very low | 41.3 | Very low | 116 Ų | 116 | 128.9 Ų | 128.9 | 81% | 0.811 | 80% | 0.796 | S | S | * | * | trans | -81.7 | 178.6 | -163.5 | -73.5 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 145 | P | 56.1 | Low | 41.6 | Very low | 121 Ų | 121 | 128.8 Ų | 128.8 | 79% | 0.786 | 79% | 0.791 | S | S | * | * | trans | -98.8 | 169 | -157.5 | 39.7 | -32.5 | 0 | 0 | 0 | 113.3 | ||||
| 146 | D | 34.4 | Very low | 41.9 | Very low | 150 Ų | 150 | 123.2 Ų | 123.2 | 80% | 0.802 | 79% | 0.786 | S | S | * | * | trans | -150.8 | 118.2 | 148.9 | -135.5 | -14.2 | 0 | 0 | 0 | 112.9 | ||||
| 147 | S | 37.2 | Very low | 41.6 | Very low | 92 Ų | 92 | 130.7 Ų | 130.7 | 64% | 0.643 | 80% | 0.799 | S | S | * | * | trans | 33 | 112.6 | 138.5 | -48.4 | 0 | 0 | 0 | 0 | 121.7 | ||||
| 148 | S | 38.8 | Very low | 41.3 | Very low | 114 Ų | 114 | 128.9 Ų | 128.9 | 80% | 0.797 | 79% | 0.787 | S | S | * | * | 44.1 | 169.3 | 114.2 | -57.5 | 0 | 0 | 0 | 0 | 121.6 | |||||
| 149 | P | 50.2 | Low | 41.1 | Very low | 107 Ų | 107 | 130.3 Ų | 130.3 | 70% | 0.695 | 79% | 0.789 | S | S | * | * | -138.6 | -175.8 | -50.6 | 39.9 | -22.5 | 0 | 0 | 0 | 112.6 | |||||
| 150 | C | 31.5 | Very low | 40.4 | Very low | 133 Ų | 133 | 128.6 Ų | 128.6 | 90% | 0.899 | 78% | 0.777 | S | S | * | * | trans | 76.4 | 134.5 | 153.5 | -64.7 | 0 | 0 | 0 | 0 | 121.1 | ||||
| 151 | G | 31.6 | Very low | 40 | Very low | 76 Ų | 76 | 129.1 Ų | 129.1 | 78% | 0.784 | 78% | 0.779 | S | S | * | * | trans | 117.8 | 82.9 | 140 | 0 | 0 | 0 | 0 | 0 | 117.5 | ||||
| 152 | S | 40.3 | Very low | 39.1 | Very low | 116 Ų | 116 | 127.2 Ų | 127.2 | 81% | 0.811 | 77% | 0.772 | S | S | * | * | trans | -65 | 157.3 | 136.2 | -67.3 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 153 | P | 45 | Very low | 39.3 | Very low | 112 Ų | 112 | 128.7 Ų | 128.7 | 73% | 0.727 | 78% | 0.775 | S | S | * | * | cis | -152.2 | -171.2 | 38.1 | 29.4 | -1.5 | 0 | 0 | 0 | 116.3 | ||||
| 154 | R | 32 | Very low | 39.1 | Very low | 228 Ų | 228 | 130.3 Ų | 130.3 | 86% | 0.86 | 77% | 0.773 | S | S | * | * | trans | 97.7 | 110.5 | 147.5 | -47.9 | -179.2 | 96.5 | -158.6 | 4.4 | 118.2 | ||||
| 155 | T | 41.9 | Very low | 38.7 | Very low | 132 Ų | 132 | 133 Ų | 133 | 81% | 0.81 | 77% | 0.773 | S | S | * | * | trans | -47.6 | 152.9 | 148.5 | 49.3 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 156 | P | 38.3 | Very low | 37.8 | Very low | 124 Ų | 124 | 134 Ų | 134 | 81% | 0.805 | 78% | 0.778 | S | S | * | * | -139.4 | 134.1 | 103.2 | 23.5 | -3.1 | 0 | 0 | 0 | 114.1 | |||||
| 157 | R | 35.9 | Very low | 37.9 | Very low | 230 Ų | 230 | 132.5 Ų | 132.5 | 87% | 0.868 | 78% | 0.778 | S | S | * | * | trans | -62.5 | 169.2 | 141.5 | -78.9 | -176.9 | 175.7 | 133.6 | -2.5 | 108.1 | ||||
| 158 | P | 47.7 | Very low | 38.2 | Very low | 88 Ų | 88 | 134 Ų | 134 | 57% | 0.571 | 79% | 0.789 | S | S | * | * | cis | -148.1 | -170.1 | 24.6 | 16.7 | 14.4 | 0 | 0 | 0 | 115.2 | ||||
| 159 | H | 29 | Very low | 38.1 | Very low | 167 Ų | 167 | 132.6 Ų | 132.6 | 77% | 0.773 | 78% | 0.784 | S | S | * | * | trans | 91.2 | 138.5 | 156.7 | -47.3 | -59.4 | 0 | 0 | 0 | 116.8 | ||||
| 160 | S | 32.1 | Very low | 37.7 | Very low | 90 Ų | 90 | 134.8 Ų | 134.8 | 63% | 0.629 | 79% | 0.79 | S | S | * | * | cis | -174.8 | 162.7 | -16.7 | -73.7 | 0 | 0 | 0 | 0 | 105.4 | ||||
| 161 | L | 38 | Very low | 38.1 | Very low | 163 Ų | 163 | 135 Ų | 135 | 85% | 0.853 | 79% | 0.788 | S | S | * | * | trans | 84.2 | 101 | 154 | -48.3 | -176.5 | 0 | 0 | 0 | 119.5 | ||||
| 162 | S | 32.6 | Very low | 38.5 | Very low | 107 Ų | 107 | 136.9 Ų | 136.9 | 75% | 0.748 | 79% | 0.789 | S | S | * | * | trans | -44.8 | 166.6 | 130.7 | 52.7 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 163 | P | 44.3 | Very low | 38.6 | Very low | 108 Ų | 108 | 136.7 Ų | 136.7 | 70% | 0.701 | 79% | 0.785 | S | S | * | * | cis | -137 | 163.5 | 25.7 | 38.9 | -20.3 | 0 | 0 | 0 | 114.6 | ||||
| 164 | D | 37.2 | Very low | 38.5 | Very low | 162 Ų | 162 | 141.7 Ų | 141.7 | 87% | 0.866 | 79% | 0.79 | S | S | * | * | -165 | 128.6 | 129 | -103.1 | -33.1 | 0 | 0 | 0 | 110.5 | |||||
| 165 | E | 39.2 | Very low | 38.8 | Very low | 174 Ų | 174 | 135 Ų | 135 | 81% | 0.813 | 78% | 0.784 | S | S | * | * | trans | -73.4 | 130.9 | 171.1 | -67.3 | -95.8 | 103.8 | 0 | 0 | 107.8 | ||||
| 166 | T | 36.6 | Very low | 39 | Very low | 142 Ų | 142 | 132.6 Ų | 132.6 | 87% | 0.871 | 78% | 0.778 | S | S | * | * | trans | -178.8 | 138.1 | 136.2 | 25.8 | 0 | 0 | 0 | 0 | 111 | ||||
| 167 | S | 36.9 | Very low | 39.7 | Very low | 117 Ų | 117 | 138 Ų | 138 | 82% | 0.818 | 78% | 0.782 | S | S | * | * | trans | 87.1 | 88 | 150.4 | -148.1 | 0 | 0 | 0 | 0 | 118 | ||||
| 168 | S | 42.7 | Very low | 40.4 | Very low | 125 Ų | 125 | 138.2 Ų | 138.2 | 87% | 0.874 | 78% | 0.783 | S | S | * | * | trans | -60.2 | 124.5 | 147.6 | -59.5 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 169 | A | 37.5 | Very low | 40.7 | Very low | 83 Ų | 83 | 139.9 Ų | 139.9 | 69% | 0.686 | 79% | 0.792 | S | S | * | * | -179.6 | 121.7 | 128.9 | 0 | 0 | 0 | 0 | 0 | 110.4 | |||||
| 170 | D | 42.1 | Very low | 41.9 | Very low | 154 Ų | 154 | 136.7 Ų | 136.7 | 82% | 0.824 | 79% | 0.786 | S | S | * | * | trans | 52.6 | 90.5 | 142.5 | -58.9 | -29.1 | 0 | 0 | 0 | 119.7 | ||||
| 171 | T | 38.7 | Very low | 43 | Very low | 138 Ų | 138 | 136.6 Ų | 136.6 | 85% | 0.847 | 78% | 0.783 | S | S | * | * | trans | -154.1 | 99.4 | 133.5 | -37.8 | 0 | 0 | 0 | 0 | 110.1 | P173 | T171-P173 VanDerWaalsContact O-CD 3.3Å; T171-P173 WeakPolarHBondContact O-CD 3.29Å | ||
| 172 | S | 39.6 | Very low | 43.8 | Very low | 115 Ų | 115 | 135.5 Ų | 135.5 | 80% | 0.804 | 78% | 0.777 | S | S | * | * | trans | -66.3 | 115.9 | 169.4 | 175.4 | 0 | 0 | 0 | 0 | 109.6 | Y174 | S172-Y174 PolarHBondContact O-N 3.31Š| ||
| 173 | P | 43.9 | Very low | 44.7 | Very low | 112 Ų | 112 | 138.4 Ų | 138.4 | 73% | 0.727 | 78% | 0.777 | S | S | * | * | trans | -86.4 | 115 | 171.9 | 32.2 | -23.5 | 0 | 0 | 0 | 107.7 | T171 A175 | T171-P173 VanDerWaalsContact O-CD 3.3Å; T171-P173 WeakPolarHBondContact O-CD 3.29Å; P173-A175 PolarHBondContact O-N 3.06Å | ||
| 174 | Y | 41.3 | Very low | 45 | Very low | 216 Ų | 216 | 138 Ų | 138 | 85% | 0.847 | 77% | 0.765 | S | S | * | * | trans | 1.4 | 92.6 | 153.8 | -142.8 | -97.8 | 0 | 0 | 0 | 113.7 | S172 A176 | S172-Y174 PolarHBondContact O-N 3.31Å; Y174-A176 VanDerWaalsContact C-N 3.35Å; Y174-A176 PolarHBondContact O-N 3.09Å | ||
| 175 | A | 40.1 | Very low | 45.7 | Very low | 89 Ų | 89 | 135 Ų | 135 | 74% | 0.736 | 75% | 0.749 | S | S | * | * | trans | -59.5 | 102.3 | 170.5 | 0 | 0 | 0 | 0 | 0 | 107.5 | P173 R177 | P173-A175 PolarHBondContact O-N 3.06Å; A175-R177 PolarHBondContact O-N 2.83Å | ||
| 176 | A | 44.9 | Very low | 46.2 | Very low | 81 Ų | 81 | 131.6 Ų | 131.6 | 67% | 0.669 | 74% | 0.736 | S | S | * | * | trans | -46.5 | 116.3 | 167.3 | 0 | 0 | 0 | 0 | 0 | 106.9 | Y174 R178 | Y174-A176 VanDerWaalsContact C-N 3.35Å; Y174-A176 PolarHBondContact O-N 3.09Å; A176-R178 VanDerWaalsContact C-N 3.32Å; A176-R178 PolarHBondContact O-N 2.92Å | ||
| 177 | R | 52.8 | Low | 46.6 | Very low | 236 Ų | 236 | 130.5 Ų | 130.5 | 89% | 0.891 | 72% | 0.719 | S | S | * | * | trans | -50.9 | 100.2 | 177.9 | -71.7 | -178.8 | 178.2 | -169.3 | -0.5 | 107.4 | A175 T179 | A175-R177 PolarHBondContact O-N 2.83Å; R177-T179 VanDerWaalsContact C-N 3.33Å; R177-T179 PolarHBondContact O-N 3.44Å | ||
| 178 | R | 50.5 | Low | 47.3 | Very low | 235 Ų | 235 | 128.5 Ų | 128.5 | 89% | 0.887 | 70% | 0.699 | S | S | * | * | trans | -60.9 | 103.3 | 170.8 | -64.9 | -179.7 | 75.4 | -176.9 | 4 | 105 | A176 | A176-R178 VanDerWaalsContact C-N 3.32Å; A176-R178 PolarHBondContact O-N 2.92Å | ||
| 179 | T | 54.9 | Low | 47.6 | Very low | 124 Ų | 124 | 126.1 Ų | 126.1 | 76% | 0.761 | 68% | 0.681 | S | S | * | * | P | Polyproline II helix | trans | -48 | 123.4 | 166.2 | 41.5 | 0 | 0 | 0 | 0 | 106.9 | R177 | R177-T179 VanDerWaalsContact C-N 3.33Å; R177-T179 PolarHBondContact O-N 3.44Å |
| 180 | P | 54.7 | Low | 47.9 | Very low | 99 Ų | 99 | 125.1 Ų | 125.1 | 64% | 0.643 | 67% | 0.669 | S | S | * | * | P | Polyproline II helix | trans | -58.5 | 142.4 | -179.8 | 24.2 | -31.6 | 0 | 0 | 0 | 108.2 | L182 | P180-L182 PolarHBondContact O-N 3.01Š|
| 181 | P | 54.9 | Low | 48.1 | Very low | 88 Ų | 88 | 124.3 Ų | 124.3 | 57% | 0.571 | 66% | 0.66 | S | S | * | * | P | Polyproline II helix | trans | -55.8 | 128.5 | 178.6 | 21.5 | -30.6 | 0 | 0 | 0 | 109.1 | F183 H184 | P181-F183 HydrophobicContact CB-CD2 4.04Å; P181-F183 PolarHBondContact O-N 3.22Å; P181-H184 PolarHBondContact O-N 3.44Å |
| 182 | L | 53.3 | Low | 48.7 | Very low | 141 Ų | 141 | 124 Ų | 124 | 74% | 0.738 | 65% | 0.653 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -50.1 | -16.9 | -179 | -83.7 | 156.8 | 0 | 0 | 0 | 114 | P180 H184 L185 | P180-L182 PolarHBondContact O-N 3.01Å; L182-H184 PolarHBondContact O-N 3.3Å; L182-L185 HydrophobicContact CD2-CD1 4.39Å; L182-L185 PolarHBondContact O-N 2.92Å |
| 183 | F | 52.1 | Low | 49.8 | Very low | 167 Ų | 167 | 123.3 Ų | 123.3 | 73% | 0.732 | 63% | 0.632 | S | S | * | * | H | α-helix | trans | -67.4 | -15.3 | 173.9 | -53.1 | -65.9 | 0 | 0 | 0 | 114.8 | P181 | P181-F183 HydrophobicContact CB-CD2 4.04Å; P181-F183 PolarHBondContact O-N 3.22Å |
| 184 | H | 50.5 | Low | 51.3 | Low | 101 Ų | 101 | 121.9 Ų | 121.9 | 47% | 0.468 | 62% | 0.623 | S | S | . | * | H | α-helix | trans | -79 | -25.1 | 178.5 | -159.4 | 45.5 | 0 | 0 | 0 | 112.8 | P181 L182 F187 L188 | P181-H184 PolarHBondContact O-N 3.44Å; L182-H184 PolarHBondContact O-N 3.3Å; H184-F187 PolarHBondContact O-N 2.91Å; H184-L188 WeakPolarHBondContact O-CG 3.46Å; H184-L188 PolarHBondContact O-N 2.78Å |
| 185 | L | 51.7 | Low | 53.6 | Low | 99 Ų | 99 | 115.3 Ų | 115.3 | 52% | 0.518 | 61% | 0.606 | S | S | . | * | H | α-helix | trans | -67.7 | -36.5 | 173.6 | -81.6 | 160 | 0 | 0 | 0 | 111.2 | L182 F187 L188 C189 | L182-L185 HydrophobicContact CD2-CD1 4.39Å; L182-L185 PolarHBondContact O-N 2.92Å; L185-F187 VanDerWaalsContact C-N 3.31Å; L185-F187 PolarHBondContact O-N 2.7Å; L185-L188 PolarHBondContact O-N 3Å; L185-C189 WeakPolarHBondContact O-CB 3.34Å; L185-C189 PolarHBondContact O-N 2.78Å; L185-C189 PolarHBondContact O-SG 3.24Å |
| 186 | D | 50.1 | Low | 56.1 | Low | 101 Ų | 101 | 114.2 Ų | 114.2 | 54% | 0.54 | 58% | 0.584 | S | S | . | * | H | α-helix | trans | -64.7 | -37.2 | 175.9 | -66.4 | -34.9 | 0 | 0 | 0 | 111.9 | C190 | D186-C190 WeakPolarHBondContact O-CB 3.35Å; D186-C190 PolarHBondContact O-N 2.91Å; D186-C190 PolarHBondContact O-SG 3.35Å |
| 187 | F | 45.9 | Very low | 58.5 | Low | 119 Ų | 119 | 115.9 Ų | 115.9 | 52% | 0.522 | 58% | 0.582 | S | S | . | * | H | α-helix | trans | -67.1 | -43.3 | 174.3 | -173.9 | -99.4 | 0 | 0 | 0 | 111.5 | H184 L185 C190 Q191 | H184-F187 PolarHBondContact O-N 2.91Å; L185-F187 VanDerWaalsContact C-N 3.31Å; L185-F187 PolarHBondContact O-N 2.7Å; F187-C190 PolarHBondContact O-N 2.88Å; F187-Q191 HydrophobicContact CD1-CG 4.46Å; F187-Q191 HydrophobicContact CE1-CG 4.26Å; F187-Q191 HydrophobicContact CZ-CG 4.39Å; F187-Q191 WeakPolarHBondContact O-CB 3.18Å; F187-Q191 WeakPolarHBondContact O-CG 3.13Å; F187-Q191 PolarHBondContact O-N 2.87Å |
| 188 | L | 50.1 | Low | 60.6 | Low | 76 Ų | 76 | 105.2 Ų | 105.2 | 40% | 0.398 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -68.5 | -38.6 | 176.2 | -66.4 | 170.2 | 0 | 0 | 0 | 112.1 | H184 L185 Q191 L192 | H184-L188 WeakPolarHBondContact O-CG 3.46Å; H184-L188 PolarHBondContact O-N 2.78Å; L185-L188 PolarHBondContact O-N 3Å; L188-Q191 PolarHBondContact O-N 2.83Å; L188-L192 VanDerWaalsContact O-CB 3.27Å; L188-L192 WeakPolarHBondContact O-CB 3.47Å; L188-L192 WeakPolarHBondContact O-CD1 3.22Å; L188-L192 VanDerWaalsContact O-CG 3.26Å; L188-L192 WeakPolarHBondContact O-CG 3.47Å; L188-L192 PolarHBondContact O-N 2.82Å |
| 189 | C | 49.2 | Very low | 62.9 | Low | 74 Ų | 74 | 97.7 Ų | 97.7 | 50% | 0.5 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -70.7 | -31 | 175.2 | -71.7 | 0 | 0 | 0 | 0 | 112.4 | L185 R193 | L185-C189 WeakPolarHBondContact O-CB 3.34Å; L185-C189 PolarHBondContact O-N 2.78Å; L185-C189 PolarHBondContact O-SG 3.24Å; C189-R193 WeakPolarHBondContact O-CG 3.34Å; C189-R193 PolarHBondContact O-N 2.81Å |
| 190 | C | 45.3 | Very low | 64.8 | Low | 63 Ų | 63 | 92.5 Ų | 92.5 | 43% | 0.426 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -72.9 | -28.3 | 171.8 | -73.5 | 0 | 0 | 0 | 0 | 112.8 | D186 F187 R193 | D186-C190 WeakPolarHBondContact O-CB 3.35Å; D186-C190 PolarHBondContact O-N 2.91Å; D186-C190 PolarHBondContact O-SG 3.35Å; F187-C190 PolarHBondContact O-N 2.88Å; C190-R193 PolarHBondContact SG-NH2 3.43Å; C190-R193 VanDerWaalsContact SG-NH2 3.38Å |
| 191 | Q | 45.5 | Very low | 66.8 | Low | 137 Ų | 137 | 96.1 Ų | 96.1 | 64% | 0.64 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -88.7 | -17 | 176.5 | -64.4 | -72.7 | 29.1 | 0 | 0 | 113.4 | F187 L188 | F187-Q191 HydrophobicContact CD1-CG 4.46Å; F187-Q191 HydrophobicContact CE1-CG 4.26Å; F187-Q191 HydrophobicContact CZ-CG 4.39Å; F187-Q191 WeakPolarHBondContact O-CB 3.18Å; F187-Q191 WeakPolarHBondContact O-CG 3.13Å; F187-Q191 PolarHBondContact O-N 2.87Å; L188-Q191 PolarHBondContact O-N 2.83Å |
| 192 | L | 52 | Low | 68.8 | Low | 131 Ų | 131 | 92 Ų | 92 | 69% | 0.686 | 47% | 0.465 | S | S | * | . | trans | -103.7 | 24.2 | 174.9 | -68.9 | 166.4 | 0 | 0 | 0 | 112.1 | L188 P194 | L188-L192 VanDerWaalsContact O-CB 3.27Å; L188-L192 WeakPolarHBondContact O-CB 3.47Å; L188-L192 WeakPolarHBondContact O-CD1 3.22Å; L188-L192 VanDerWaalsContact O-CG 3.26Å; L188-L192 WeakPolarHBondContact O-CG 3.47Å; L188-L192 PolarHBondContact O-N 2.82Å; L192-P194 WeakPolarHBondContact O-CD 3.43Å | ||
| 193 | R | 62.3 | Low | 70.7 | Confident | 101 Ų | 101 | 89.6 Ų | 89.6 | 38% | 0.381 | 45% | 0.45 | S | S | . | . | trans | -68.6 | 105.1 | 166.9 | -62.1 | -171.3 | -157.2 | 159.2 | 7.2 | 106.5 | C189 C190 T195 E214 | C189-R193 WeakPolarHBondContact O-CG 3.34Å; C189-R193 PolarHBondContact O-N 2.81Å; C190-R193 PolarHBondContact SG-NH2 3.43Å; C190-R193 VanDerWaalsContact SG-NH2 3.38Å; R193-T195 PolarHBondContact O-N 3.06Å; R193-E214 HydrophobicContact CB-CG 4.14Å; R193-E214 WeakPolarHBondContact CD-OE1 3.24Å; R193-E214 IonicContact CZ-OE1 3.86Å; R193-E214 IonicContact NE-OE1 3.92Å; R193-E214 IonicContact NH1-OE1 4Å; R193-E214 PolarHBondContact NH1-OE1 3.41Å | ||
| 194 | P | 74.9 | Confident | 72.5 | Confident | 81 Ų | 81 | 86.7 Ų | 86.7 | 53% | 0.526 | 45% | 0.447 | S | S | . | . | trans | -71.8 | 110.9 | -170.1 | 31.8 | -29.7 | 0 | 0 | 0 | 105.9 | L192 P322 | L192-P194 WeakPolarHBondContact O-CD 3.43Å; P194-P322 HydrophobicContact CB-CB 4.04Å; P194-P322 HydrophobicContact CB-CG 3.63Å; P194-P322 HydrophobicContact CG-CB 4.47Å; P194-P322 HydrophobicContact CG-CG 4.04Å; P194-P322 WeakPolarHBondContact O-CG 3.35Å | ||
| 195 | T | 89.4 | Confident | 74 | Confident | 79 Ų | 79 | 88.5 Ų | 88.5 | 49% | 0.485 | 45% | 0.45 | S | S | . | . | trans | -90.8 | 143 | 172.3 | 47.9 | 0 | 0 | 0 | 0 | 107.7 | R193 T213 E214 | R193-T195 PolarHBondContact O-N 3.06Å; T195-T213 CarbonylContact C-O 3.53Å; T195-T213 VanDerWaalsContact CA-O 3.28Å; T195-T213 WeakPolarHBondContact CA-O 3.25Å; T195-E214 HydrophobicContact CG2-CB 3.99Å; T195-E214 HydrophobicContact CG2-CG 4.13Å | ||
| 196 | K | 93.8 | Very high | 75.6 | Confident | 66 Ų | 66 | 85.2 Ų | 85.2 | 29% | 0.287 | 44% | 0.44 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -119.8 | 120.2 | 171.6 | 176.3 | 173.3 | 179.7 | -176.3 | 0 | 110.1 | S212 T213 A319 L320 L321 P322 | K196-S212 WeakPolarHBondContact O-CA 3.42Å; K196-T213 PolarHBondContact N-O 2.77Å; K196-T213 PolarHBondContact O-N 3.19Å; K196-A319 WeakPolarHBondContact CE-O 3.15Å; K196-A319 PolarHBondContact NZ-O 2.89Å; K196-L320 WeakPolarHBondContact CB-O 3.29Å; K196-L320 WeakPolarHBondContact CD-O 3.35Å; K196-L320 WeakPolarHBondContact CG-O 3.13Å; K196-L321 WeakPolarHBondContact CD-O 3.3Å; K196-L321 PolarHBondContact NZ-O 3.06Å; K196-P322 HydrophobicContact CB-CG 3.95Å |
| 197 | D | 95.5 | Very high | 77.7 | Confident | 115 Ų | 115 | 81 Ų | 81 | 62% | 0.615 | 42% | 0.421 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -80.4 | 126.7 | 169.6 | -67.5 | -11.1 | 0 | 0 | 0 | 109 | L211 S212 | D197-L211 CarbonylContact C-O 3.31Å; D197-L211 WeakPolarHBondContact CA-O 3.44Å; D197-S212 WeakPolarHBondContact OD1-CB 3.37Å; D197-S212 PolarHBondContact OD1-OG 3.23Å |
| 198 | S | 96.4 | Very high | 80.1 | Confident | 12 Ų | 12 | 78.6 Ų | 78.6 | 8% | 0.084 | 41% | 0.411 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -128.3 | 135.2 | -176.3 | -62.4 | 0 | 0 | 0 | 0 | 109.8 | R210 L211 | S198-R210 WeakPolarHBondContact O-CA 3.18Å; S198-L211 PolarHBondContact N-O 3.49Å; S198-L211 PolarHBondContact O-N 3.28Å |
| 199 | V | 97.4 | Very high | 82.3 | Confident | 77 Ų | 77 | 75 Ų | 75 | 47% | 0.467 | 39% | 0.392 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -110.1 | 112.5 | 172.9 | -171.5 | 0 | 0 | 0 | 0 | 108 | Q208 R210 | V199-Q208 HydrophobicContact CG1-CB 3.98Å; V199-Q208 HydrophobicContact CG1-CG 4.39Å; V199-Q208 VanDerWaalsContact CG1-OE1 3.23Å; V199-R210 HydrophobicContact CG1-CG 4.31Å; V199-R210 HydrophobicContact CG2-CG 4.18Å |
| 200 | L | 96.9 | Very high | 84.7 | Confident | 15 Ų | 15 | 76.2 Ų | 76.2 | 8% | 0.079 | 39% | 0.386 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -102.4 | 124.9 | -177.3 | -53.4 | -174.2 | 0 | 0 | 0 | 109.8 | Q208 L209 L211 C313 T315 L320 | L200-Q208 CarbonylContact O-C 3.58Å; L200-Q208 WeakPolarHBondContact O-CA 3.49Å; L200-L209 HydrophobicContact CB-CB 4.35Å; L200-L209 PolarHBondContact N-O 2.96Å; L200-L209 PolarHBondContact O-N 2.99Å; L200-L211 HydrophobicContact CD1-CD1 3.58Å; L200-L211 HydrophobicContact CD1-CG 4.49Å; L200-L211 HydrophobicContact CG-CD1 4.35Å; L200-C313 HydrophobicContact CB-CB 4.48Å; L200-T315 HydrophobicContact CD2-CG2 4.07Å; L200-T315 WeakPolarHBondContact CD2-OG1 3.26Å; L200-L320 HydrophobicContact CD1-CD2 4.15Å; L200-L320 HydrophobicContact CD2-CD2 3.84Å; L200-L320 HydrophobicContact CG-CD2 4.43Å |
| 201 | R | 96.6 | Very high | 87.1 | Confident | 176 Ų | 176 | 73.3 Ų | 73.3 | 66% | 0.664 | 37% | 0.367 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -74.2 | 139.2 | 174.3 | -52.9 | -166.8 | -22.9 | -171.1 | 9.1 | 110.6 | E203 C313 | R201-E203 IonicContact CZ-OE1 3.68Å; R201-E203 IonicContact NE-OE1 3.81Å; R201-E203 IonicContact NH2-OE1 3.04Å; R201-E203 PolarHBondContact NH2-OE1 3.46Å; R201-C313 VanDerWaalsContact O-CB 3.25Å; R201-C313 WeakPolarHBondContact O-CB 3.35Å |
| 202 | L | 96.3 | Very high | 89.6 | Confident | 0 Ų | 0 | 67.7 Ų | 67.7 | 0% | 0 | 34% | 0.343 | C | S | . | . | P | Polyproline II helix | trans | -98.5 | 132 | 179.1 | -61.4 | 171.8 | 0 | 0 | 0 | 110.1 | G206 G207 L209 L232 V297 C313 | L202-G206 CarbonylContact O-C 3.56Å; L202-G206 VanDerWaalsContact O-CA 3.22Å; L202-G206 WeakPolarHBondContact O-CA 3.34Å; L202-G206 PolarHBondContact O-N 2.62Å; L202-G207 PolarHBondContact N-O 3.01Å; L202-L209 HydrophobicContact CD2-CB 4.14Å; L202-L209 HydrophobicContact CG-CB 4.38Å; L202-L232 HydrophobicContact CD1-CD2 3.5Å; L202-V297 HydrophobicContact CD1-CB 4.4Å; L202-V297 HydrophobicContact CD1-CG2 3.63Å; L202-V297 HydrophobicContact CD2-CG2 3.89Å; L202-V297 HydrophobicContact CG-CG2 4.44Å; L202-C313 HydrophobicContact CD2-CB 4.19Å |
| 203 | E | 93.1 | Very high | 91.7 | Very high | 92 Ų | 92 | 61.5 Ų | 61.5 | 43% | 0.43 | 31% | 0.31 | S | S | . | . | B | Isolated β-bridge | trans | -116.3 | 153.7 | 175.9 | -62.8 | -62.5 | 161.2 | 0 | 0 | 109.7 | R201 G311 E312 | R201-E203 IonicContact CZ-OE1 3.68Å; R201-E203 IonicContact NE-OE1 3.81Å; R201-E203 IonicContact NH2-OE1 3.04Å; R201-E203 PolarHBondContact NH2-OE1 3.46Å; E203-G311 CarbonylContact O-C 3.53Å; E203-G311 WeakPolarHBondContact O-CA 3.27Å; E203-E312 PolarHBondContact N-O 2.85Å; E203-E312 PolarHBondContact O-N 3.48Å |
| 204 | P | 88.9 | Confident | 93.2 | Very high | 105 Ų | 105 | 57.1 Ų | 57.1 | 68% | 0.682 | 29% | 0.294 | S | S | * | . | T | Hydrogen-bonded Turn | cis | -93 | -6 | 1.5 | 35.9 | -34.8 | 0 | 0 | 0 | 114.3 | ||
| 205 | R | 83.4 | Confident | 94 | Very high | 140 Ų | 140 | 55.3 Ų | 55.3 | 53% | 0.528 | 28% | 0.277 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -94.2 | 2.8 | -169 | -58.5 | -176.1 | 173.5 | -155.5 | -2.5 | 113.9 | P233 L310 | R205-P233 HydrophobicContact CB-CB 4.07Å; R205-P233 HydrophobicContact CB-CG 3.47Å; R205-P233 VanDerWaalsContact CB-CG 3.47Å; R205-L310 WeakPolarHBondContact CB-O 3.34Å |
| 206 | G | 85 | Confident | 94.1 | Very high | 29 Ų | 29 | 54 Ų | 54 | 30% | 0.299 | 27% | 0.266 | S | S | . | . | trans | 79.9 | -178 | -174.7 | 0 | 0 | 0 | 0 | 0 | 113.6 | L202 | L202-G206 CarbonylContact O-C 3.56Å; L202-G206 VanDerWaalsContact O-CA 3.22Å; L202-G206 WeakPolarHBondContact O-CA 3.34Å; L202-G206 PolarHBondContact O-N 2.62Å | ||
| 207 | G | 93.3 | Very high | 93.8 | Very high | 14 Ų | 14 | 54.3 Ų | 54.3 | 14% | 0.144 | 28% | 0.28 | C | S | . | . | trans | 102.6 | 170.3 | -172.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | L202 E230 D231 | L202-G207 PolarHBondContact N-O 3.01Å; G207-E230 CarbonylContact C-O 3.49Å; G207-E230 WeakPolarHBondContact CA-O 3.35Å; G207-D231 WeakPolarHBondContact CA-O 3.41Å | ||
| 208 | Q | 96.6 | Very high | 93.3 | Very high | 68 Ų | 68 | 52.7 Ų | 52.7 | 32% | 0.318 | 29% | 0.291 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -133.1 | 148.1 | -173.7 | -58.9 | -179.2 | 70.4 | 0 | 0 | 110.4 | V199 L200 A229 E230 D231 | V199-Q208 HydrophobicContact CG1-CB 3.98Å; V199-Q208 HydrophobicContact CG1-CG 4.39Å; V199-Q208 VanDerWaalsContact CG1-OE1 3.23Å; L200-Q208 CarbonylContact O-C 3.58Å; L200-Q208 WeakPolarHBondContact O-CA 3.49Å; Q208-A229 CarbonylContact O-C 3.55Å; Q208-A229 VanDerWaalsContact O-CA 3.25Å; Q208-A229 WeakPolarHBondContact O-CA 3.48Å; Q208-E230 HydrophobicContact CB-CB 4.38Å; Q208-E230 PolarHBondContact N-O 3.01Å; Q208-E230 PolarHBondContact O-N 2.89Å; Q208-D231 PolarHBondContact NE2-OD2 2.82Å |
| 209 | L | 97.3 | Very high | 92.8 | Very high | 0 Ų | 0 | 55.8 Ų | 55.8 | 0% | 0 | 31% | 0.311 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -124.4 | 119.1 | 176.8 | -171.2 | 71.6 | 0 | 0 | 0 | 109 | L200 L202 L211 L226 A229 V248 A295 V297 | L200-L209 HydrophobicContact CB-CB 4.35Å; L200-L209 PolarHBondContact N-O 2.96Å; L200-L209 PolarHBondContact O-N 2.99Å; L202-L209 HydrophobicContact CD2-CB 4.14Å; L202-L209 HydrophobicContact CG-CB 4.38Å; L209-L211 HydrophobicContact CD2-CD1 4.27Å; L209-L211 HydrophobicContact CD2-CD2 4.13Å; L209-L211 HydrophobicContact CD2-CG 4.28Å; L209-L211 HydrophobicContact CG-CD2 4.14Å; L209-L211 HydrophobicContact CG-CG 4.27Å; L209-L226 HydrophobicContact CD1-CD1 3.48Å; L209-L226 VanDerWaalsContact CD1-CD1 3.48Å; L209-L226 HydrophobicContact CD2-CD1 4.46Å; L209-L226 HydrophobicContact CG-CD1 4.06Å; L209-A229 HydrophobicContact CD1-CB 3.88Å; L209-V248 HydrophobicContact CD1-CG1 4.38Å; L209-V248 HydrophobicContact CD1-CG2 4.11Å; L209-V248 HydrophobicContact CD2-CG1 4.29Å; L209-A295 HydrophobicContact CD2-CB 3.48Å; L209-A295 VanDerWaalsContact CD2-CB 3.48Å; L209-V297 HydrophobicContact CD1-CG2 4.37Å |
| 210 | R | 97.9 | Very high | 92.5 | Very high | 99 Ų | 99 | 52.6 Ų | 52.6 | 37% | 0.374 | 29% | 0.293 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -96.7 | 120.2 | 179.5 | -64.1 | -175.5 | 65.5 | -160.3 | 0.1 | 110.3 | S198 V199 V227 S228 E230 | S198-R210 WeakPolarHBondContact O-CA 3.18Å; V199-R210 HydrophobicContact CG1-CG 4.31Å; V199-R210 HydrophobicContact CG2-CG 4.18Å; R210-V227 HydrophobicContact CB-CB 4.15Å; R210-V227 WeakPolarHBondContact O-CB 3.49Å; R210-V227 PolarHBondContact O-N 3.01Å; R210-S228 PolarHBondContact N-O 3.31Å; R210-E230 VanDerWaalsContact CD-CD 3.44Å; R210-E230 WeakPolarHBondContact CD-OE1 3.42Å; R210-E230 IonicContact NE-OE1 3.75Å; R210-E230 IonicContact NH1-OE1 3.22Å; R210-E230 PolarHBondContact NH1-OE1 3.27Å |
| 211 | L | 97.5 | Very high | 92.2 | Very high | 2 Ų | 2 | 56.1 Ų | 56.1 | 1% | 0.01 | 31% | 0.305 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -124 | 143.3 | 179.8 | -58.6 | 179.6 | 0 | 0 | 0 | 109.3 | D197 S198 L200 L209 T213 L224 R225 L226 L293 | D197-L211 CarbonylContact C-O 3.31Å; D197-L211 WeakPolarHBondContact CA-O 3.44Å; S198-L211 PolarHBondContact N-O 3.49Å; S198-L211 PolarHBondContact O-N 3.28Å; L200-L211 HydrophobicContact CD1-CD1 3.58Å; L200-L211 HydrophobicContact CD1-CG 4.49Å; L200-L211 HydrophobicContact CG-CD1 4.35Å; L209-L211 HydrophobicContact CD2-CD1 4.27Å; L209-L211 HydrophobicContact CD2-CD2 4.13Å; L209-L211 HydrophobicContact CD2-CG 4.28Å; L209-L211 HydrophobicContact CG-CD2 4.14Å; L209-L211 HydrophobicContact CG-CG 4.27Å; L211-T213 HydrophobicContact CB-CG2 4.39Å; L211-L224 HydrophobicContact CD1-CD2 4.43Å; L211-R225 CarbonylContact C-O 3.46Å; L211-R225 WeakPolarHBondContact CA-O 3.37Å; L211-L226 HydrophobicContact CD2-CB 4.2Å; L211-L226 HydrophobicContact CD2-CD1 3.55Å; L211-L226 HydrophobicContact CD2-CG 4.48Å; L211-L293 HydrophobicContact CD1-CD2 3.62Å |
| 212 | S | 96.9 | Very high | 92 | Very high | 20 Ų | 20 | 47.9 Ų | 47.9 | 14% | 0.14 | 27% | 0.274 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -114.5 | 129.3 | 165.1 | -170.4 | 0 | 0 | 0 | 0 | 108.3 | K196 D197 R225 | K196-S212 WeakPolarHBondContact O-CA 3.42Å; D197-S212 WeakPolarHBondContact OD1-CB 3.37Å; D197-S212 PolarHBondContact OD1-OG 3.23Å; S212-R225 PolarHBondContact N-O 2.69Å; S212-R225 PolarHBondContact O-N 3.33Å |
| 213 | T | 95.8 | Very high | 92 | Very high | 1 Ų | 1 | 51 Ų | 51 | 1% | 0.006 | 29% | 0.286 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -124.9 | 140.1 | -172.2 | 94.5 | 0 | 0 | 0 | 0 | 111.9 | T195 K196 L211 R223 L224 L320 | T195-T213 CarbonylContact C-O 3.53Å; T195-T213 VanDerWaalsContact CA-O 3.28Å; T195-T213 WeakPolarHBondContact CA-O 3.25Å; K196-T213 PolarHBondContact N-O 2.77Å; K196-T213 PolarHBondContact O-N 3.19Å; L211-T213 HydrophobicContact CB-CG2 4.39Å; T213-R223 WeakPolarHBondContact CA-O 3.03Å; T213-L224 HydrophobicContact CG2-CD2 3.36Å; T213-L224 HydrophobicContact CG2-CG 4.49Å; T213-L320 HydrophobicContact CG2-CB 3.88Å; T213-L320 VanDerWaalsContact OG1-C 3.29Å; T213-L320 PolarHBondContact OG1-O 3.04Å |
| 214 | E | 94.1 | Very high | 92.1 | Very high | 8 Ų | 8 | 46.6 Ų | 46.6 | 4% | 0.037 | 27% | 0.266 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -138.4 | 130.1 | -176.7 | -172 | -165.4 | 143.2 | 0 | 0 | 108.1 | R193 T195 Q216 R223 | R193-E214 HydrophobicContact CB-CG 4.14Å; R193-E214 WeakPolarHBondContact CD-OE1 3.24Å; R193-E214 IonicContact CZ-OE1 3.86Å; R193-E214 IonicContact NE-OE1 3.92Å; R193-E214 IonicContact NH1-OE1 4Å; R193-E214 PolarHBondContact NH1-OE1 3.41Å; T195-E214 HydrophobicContact CG2-CB 3.99Å; T195-E214 HydrophobicContact CG2-CG 4.13Å; E214-Q216 PolarHBondContact OE1-NE2 2.62Å; E214-R223 HydrophobicContact CB-CB 4.25Å; E214-R223 PolarHBondContact N-O 2.81Å; E214-R223 PolarHBondContact O-N 2.81Å; E214-R223 WeakPolarHBondContact OE2-CD 3.45Å; E214-R223 IonicContact OE2-CZ 2.83Å; E214-R223 IonicContact OE2-NH1 3.88Å; E214-R223 PolarHBondContact OE2-NH1 2.91Å |
| 215 | Y | 92.7 | Very high | 92.5 | Very high | 43 Ų | 43 | 46.3 Ų | 46.3 | 17% | 0.169 | 25% | 0.251 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -117 | 129.7 | 174.6 | 176 | -105.5 | 0 | 0 | 0 | 111 | A217 L222 L283 L288 L321 | Y215-A217 HydrophobicContact CD1-CB 4.45Å; Y215-A217 HydrophobicContact CE1-CB 3.78Å; Y215-L222 HydrophobicContact CD2-CB 4.36Å; Y215-L283 HydrophobicContact CE2-CB 4.3Å; Y215-L283 WeakPolarHBondContact CE2-O 3.32Å; Y215-L283 PolarHBondContact OH-O 2.95Å; Y215-L288 HydrophobicContact CD1-CD1 3.71Å; Y215-L288 HydrophobicContact CD2-CD1 4.02Å; Y215-L288 HydrophobicContact CD2-CD2 3.98Å; Y215-L288 HydrophobicContact CD2-CG 4.49Å; Y215-L288 HydrophobicContact CE1-CD1 3.62Å; Y215-L288 HydrophobicContact CE2-CD1 3.95Å; Y215-L288 HydrophobicContact CE2-CD2 4.06Å; Y215-L288 HydrophobicContact CE2-CG 4.27Å; Y215-L288 HydrophobicContact CG-CD1 3.9Å; Y215-L288 HydrophobicContact CG-CD2 4.49Å; Y215-L321 HydrophobicContact CG-CD1 4.4Å |
| 216 | Q | 90.9 | Very high | 93.2 | Very high | 53 Ų | 53 | 39.7 Ų | 39.7 | 25% | 0.248 | 23% | 0.226 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -108.2 | 106.7 | 176.3 | -63.2 | 178.6 | 22.3 | 0 | 0 | 108.8 | E214 G218 P219 G220 R221 | E214-Q216 PolarHBondContact OE1-NE2 2.62Å; Q216-G218 PolarHBondContact O-N 2.87Å; Q216-P219 HydrophobicContact CB-CG 3.65Å; Q216-P219 WeakPolarHBondContact O-CD 3.45Å; Q216-G220 WeakPolarHBondContact O-CA 3.38Å; Q216-G220 PolarHBondContact O-N 2.83Å; Q216-R221 PolarHBondContact N-O 2.84Å; Q216-R221 PolarHBondContact O-N 3.5Å |
| 217 | A | 86.8 | Confident | 93.8 | Very high | 72 Ų | 72 | 39.9 Ų | 39.9 | 60% | 0.595 | 22% | 0.221 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -65.3 | -36.2 | -175.6 | 0 | 0 | 0 | 0 | 0 | 113.5 | Y215 G220 | Y215-A217 HydrophobicContact CD1-CB 4.45Å; Y215-A217 HydrophobicContact CE1-CB 3.78Å; A217-G220 PolarHBondContact O-N 2.79Å |
| 218 | G | 85.8 | Confident | 94 | Very high | 81 Ų | 81 | 39.5 Ų | 39.5 | 84% | 0.835 | 22% | 0.216 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -55.8 | -59.7 | 178.7 | 0 | 0 | 0 | 0 | 0 | 113.2 | Q216 G220 | Q216-G218 PolarHBondContact O-N 2.87Å; G218-G220 VanDerWaalsContact C-N 3.31Å; G218-G220 PolarHBondContact O-N 2.8Å |
| 219 | P | 86.5 | Confident | 94 | Very high | 77 Ų | 77 | 36.3 Ų | 36.3 | 50% | 0.5 | 20% | 0.201 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -81.4 | -3.7 | 176.3 | 32.1 | -36.4 | 0 | 0 | 0 | 114.2 | Q216 R221 | Q216-P219 HydrophobicContact CB-CG 3.65Å; Q216-P219 WeakPolarHBondContact O-CD 3.45Å; P219-R221 VanDerWaalsContact C-N 3.3Å; P219-R221 HydrophobicContact CB-CB 4.22Å; P219-R221 HydrophobicContact CG-CB 3.95Å; P219-R221 PolarHBondContact O-N 2.87Å |
| 220 | G | 89.4 | Confident | 93.9 | Very high | 9 Ų | 9 | 38.7 Ų | 38.7 | 9% | 0.093 | 21% | 0.212 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 57.7 | 43.4 | -171.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | Q216 A217 G218 E281 G282 L283 | Q216-G220 WeakPolarHBondContact O-CA 3.38Å; Q216-G220 PolarHBondContact O-N 2.83Å; A217-G220 PolarHBondContact O-N 2.79Å; G218-G220 VanDerWaalsContact C-N 3.31Å; G218-G220 PolarHBondContact O-N 2.8Å; G220-E281 CarbonylContact O-C 3.58Å; G220-G282 PolarHBondContact O-N 2.98Å; G220-L283 CarbonylContact C-O 3.46Å; G220-L283 WeakPolarHBondContact CA-O 3.46Å; G220-L283 PolarHBondContact O-N 2.84Å |
| 221 | R | 91.8 | Very high | 93.6 | Very high | 90 Ų | 90 | 38.8 Ų | 38.8 | 34% | 0.34 | 22% | 0.22 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -114.9 | 123.4 | -173.5 | -174.7 | -174.2 | -81.1 | 175.9 | 0.4 | 110.6 | Q216 P219 F279 F280 E281 | Q216-R221 PolarHBondContact N-O 2.84Å; Q216-R221 PolarHBondContact O-N 3.5Å; P219-R221 VanDerWaalsContact C-N 3.3Å; P219-R221 HydrophobicContact CB-CB 4.22Å; P219-R221 HydrophobicContact CG-CB 3.95Å; P219-R221 PolarHBondContact O-N 2.87Å; R221-F279 HydrophobicContact CG-CD1 4.4Å; R221-F280 CarbonylContact C-O 3.55Å; R221-F280 WeakPolarHBondContact CA-O 3.27Å; R221-E281 HydrophobicContact CB-CG 4.49Å; R221-E281 HydrophobicContact CG-CG 4.02Å; R221-E281 IonicContact CZ-OE1 3.33Å; R221-E281 IonicContact NE-OE1 2.77Å; R221-E281 PolarHBondContact NE-OE1 2.95Å; R221-E281 IonicContact NH2-OE1 3.74Å; R221-E281 PolarHBondContact NH2-OE1 2.92Å |
| 222 | L | 92.8 | Very high | 93.3 | Very high | 2 Ų | 2 | 39 Ų | 39 | 1% | 0.01 | 22% | 0.222 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -95.4 | 122.9 | 168.5 | -179.5 | 75.2 | 0 | 0 | 0 | 109.2 | Y215 L224 F279 F280 L283 L317 L321 | Y215-L222 HydrophobicContact CD2-CB 4.36Å; L222-L224 HydrophobicContact CD2-CD1 3.64Å; L222-L224 HydrophobicContact CD2-CG 4.07Å; L222-L224 HydrophobicContact CG-CD1 4.27Å; L222-L224 HydrophobicContact CG-CG 4.21Å; L222-F279 WeakPolarHBondContact O-CA 3.49Å; L222-F280 HydrophobicContact CB-CB 4.31Å; L222-F280 HydrophobicContact CD2-CD2 4.42Å; L222-F280 PolarHBondContact N-O 2.8Å; L222-F280 PolarHBondContact O-N 2.83Å; L222-L283 HydrophobicContact CB-CD1 3.55Å; L222-L283 HydrophobicContact CD2-CD1 4.1Å; L222-L283 HydrophobicContact CG-CD1 4.48Å; L222-L317 HydrophobicContact CD2-CD1 4.22Å; L222-L317 HydrophobicContact CD2-CD2 3.72Å; L222-L321 HydrophobicContact CD1-CD2 3.85Å |
| 223 | R | 95.1 | Very high | 92.7 | Very high | 66 Ų | 66 | 39.7 Ų | 39.7 | 25% | 0.249 | 23% | 0.226 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -101.1 | 126.5 | 168.8 | 175.1 | -173.8 | 176.5 | -150.4 | 2.8 | 108.9 | T213 E214 D277 F278 F279 | T213-R223 WeakPolarHBondContact CA-O 3.03Å; E214-R223 HydrophobicContact CB-CB 4.25Å; E214-R223 PolarHBondContact N-O 2.81Å; E214-R223 PolarHBondContact O-N 2.81Å; E214-R223 WeakPolarHBondContact OE2-CD 3.45Å; E214-R223 IonicContact OE2-CZ 2.83Å; E214-R223 IonicContact OE2-NH1 3.88Å; E214-R223 PolarHBondContact OE2-NH1 2.91Å; R223-D277 IonicContact CZ-OD2 3.84Å; R223-D277 VanDerWaalsContact CZ-OD2 3.25Å; R223-D277 IonicContact NE-OD1 2.72Å; R223-D277 IonicContact NE-OD2 2.84Å; R223-D277 PolarHBondContact NE-OD2 3.03Å; R223-D277 IonicContact NH2-OD1 2.92Å; R223-D277 IonicContact NH2-OD2 3.24Å; R223-D277 PolarHBondContact NH2-OD2 3.16Å; R223-F278 CarbonylContact C-O 3.56Å; R223-F278 WeakPolarHBondContact CA-O 3.4Å; R223-F279 HydrophobicContact CB-CD1 3.95Å; R223-F279 HydrophobicContact CB-CE1 3.85Å; R223-F279 HydrophobicContact CG-CD1 4.09Å; R223-F279 HydrophobicContact CG-CE1 3.6Å; R223-F279 HydrophobicContact CG-CZ 4.25Å |
| 224 | L | 95.8 | Very high | 91.8 | Very high | 0 Ų | 0 | 46.1 Ų | 46.1 | 0% | 0 | 25% | 0.25 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -119.9 | 109.4 | 178.9 | -87.3 | 160.4 | 0 | 0 | 0 | 108.5 | L211 T213 L222 F278 F280 L293 | L211-L224 HydrophobicContact CD1-CD2 4.43Å; T213-L224 HydrophobicContact CG2-CD2 3.36Å; T213-L224 HydrophobicContact CG2-CG 4.49Å; L222-L224 HydrophobicContact CD2-CD1 3.64Å; L222-L224 HydrophobicContact CD2-CG 4.07Å; L222-L224 HydrophobicContact CG-CD1 4.27Å; L222-L224 HydrophobicContact CG-CG 4.21Å; L224-F278 HydrophobicContact CB-CB 4.18Å; L224-F278 PolarHBondContact N-O 2.79Å; L224-F278 WeakPolarHBondContact O-CB 3.43Å; L224-F278 PolarHBondContact O-N 2.87Å; L224-F280 HydrophobicContact CB-CE2 4.5Å; L224-F280 HydrophobicContact CD1-CD2 3.74Å; L224-F280 HydrophobicContact CD1-CE2 3.46Å; L224-F280 VanDerWaalsContact CD1-CE2 3.46Å; L224-F280 HydrophobicContact CD1-CZ 4.48Å; L224-L293 HydrophobicContact CD1-CD1 3.75Å; L224-L293 HydrophobicContact CD1-CD2 3.91Å; L224-L293 HydrophobicContact CD1-CG 4.42Å; L224-L293 HydrophobicContact CD2-CD2 3.79Å |
| 225 | R | 97.4 | Very high | 90.4 | Very high | 99 Ų | 99 | 48.5 Ų | 48.5 | 37% | 0.374 | 27% | 0.266 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -91.4 | 112.6 | 172.5 | -178 | 166.8 | 176.4 | 169.6 | -0.4 | 109.7 | L211 S212 V227 E276 D277 | L211-R225 CarbonylContact C-O 3.46Å; L211-R225 WeakPolarHBondContact CA-O 3.37Å; S212-R225 PolarHBondContact N-O 2.69Å; S212-R225 PolarHBondContact O-N 3.33Å; R225-V227 HydrophobicContact CG-CG2 4.31Å; R225-V227 PolarHBondContact O-N 2.77Å; R225-E276 CarbonylContact C-O 3.58Å; R225-E276 WeakPolarHBondContact CA-O 3.42Å; R225-D277 WeakPolarHBondContact CB-OD1 3.34Å; R225-D277 WeakPolarHBondContact CD-OD1 3.34Å; R225-D277 WeakPolarHBondContact CG-OD1 3.32Å |
| 226 | L | 97.8 | Very high | 88.9 | Confident | 0 Ų | 0 | 58.2 Ų | 58.2 | 0% | 0 | 30% | 0.302 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -77.5 | 109.3 | 169.3 | 176.6 | 63.1 | 0 | 0 | 0 | 109 | L209 L211 V248 F274 N275 E276 F278 | L209-L226 HydrophobicContact CD1-CD1 3.48Å; L209-L226 VanDerWaalsContact CD1-CD1 3.48Å; L209-L226 HydrophobicContact CD2-CD1 4.46Å; L209-L226 HydrophobicContact CG-CD1 4.06Å; L211-L226 HydrophobicContact CD2-CB 4.2Å; L211-L226 HydrophobicContact CD2-CD1 3.55Å; L211-L226 HydrophobicContact CD2-CG 4.48Å; L226-V248 HydrophobicContact CD1-CG1 4.47Å; L226-V248 HydrophobicContact CD1-CG2 4.3Å; L226-V248 HydrophobicContact CD2-CB 3.68Å; L226-V248 HydrophobicContact CD2-CG1 4.28Å; L226-V248 HydrophobicContact CD2-CG2 3.82Å; L226-F274 HydrophobicContact CB-CB 4.42Å; L226-F274 HydrophobicContact CD1-CD2 4.2Å; L226-F274 HydrophobicContact CD2-CB 3.73Å; L226-F274 HydrophobicContact CD2-CD1 4.08Å; L226-F274 HydrophobicContact CD2-CD2 3.63Å; L226-F274 HydrophobicContact CD2-CE2 4.26Å; L226-F274 HydrophobicContact CD2-CG 3.53Å; L226-F274 HydrophobicContact CG-CB 3.76Å; L226-F274 HydrophobicContact CG-CD2 3.73Å; L226-F274 HydrophobicContact CG-CG 3.89Å; L226-N275 CarbonylContact O-C 3.52Å; L226-N275 WeakPolarHBondContact O-CA 3.4Å; L226-N275 PolarHBondContact O-N 3.43Å; L226-E276 PolarHBondContact N-O 3.26Å; L226-E276 PolarHBondContact O-N 3.08Å; L226-F278 HydrophobicContact CB-CD2 4.18Å; L226-F278 HydrophobicContact CB-CE2 3.7Å; L226-F278 HydrophobicContact CD2-CE2 4.05Å |
| 227 | V | 97.6 | Very high | 87.3 | Confident | 34 Ų | 34 | 59.8 Ų | 59.8 | 21% | 0.206 | 32% | 0.324 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -84.7 | -67.1 | -176.3 | -178.9 | 0 | 0 | 0 | 0 | 109.7 | R210 R225 F274 N275 | R210-V227 HydrophobicContact CB-CB 4.15Å; R210-V227 WeakPolarHBondContact O-CB 3.49Å; R210-V227 PolarHBondContact O-N 3.01Å; R225-V227 HydrophobicContact CG-CG2 4.31Å; R225-V227 PolarHBondContact O-N 2.77Å; V227-F274 PolarHBondContact O-N 3.26Å; V227-N275 PolarHBondContact O-N 3.31Å; V227-N275 VanDerWaalsContact O-N 3.15Å |
| 228 | S | 97.3 | Very high | 86 | Confident | 6 Ų | 6 | 66 Ų | 66 | 4% | 0.042 | 33% | 0.332 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -150 | 159.4 | -177.5 | 54.6 | 0 | 0 | 0 | 0 | 110.7 | R210 E230 P272 | R210-S228 PolarHBondContact N-O 3.31Å; S228-E230 PolarHBondContact OG-OE1 2.88Å; S228-P272 VanDerWaalsContact CA-O 3.27Å; S228-P272 WeakPolarHBondContact CA-O 3.44Å |
| 229 | A | 96.4 | Very high | 84.4 | Confident | 0 Ų | 0 | 68.7 Ų | 68.7 | 0% | 0 | 34% | 0.335 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -108.8 | 144 | 154 | 0 | 0 | 0 | 0 | 0 | 107.8 | Q208 L209 L232 N271 P272 F274 | Q208-A229 CarbonylContact O-C 3.55Å; Q208-A229 VanDerWaalsContact O-CA 3.25Å; Q208-A229 WeakPolarHBondContact O-CA 3.48Å; L209-A229 HydrophobicContact CD1-CB 3.88Å; A229-L232 HydrophobicContact CB-CD1 3.71Å; A229-L232 HydrophobicContact CB-CD2 4.02Å; A229-L232 HydrophobicContact CB-CG 3.92Å; A229-N271 CarbonylContact O-C 3.58Å; A229-N271 VanDerWaalsContact O-C 3.31Å; A229-N271 WeakPolarHBondContact O-CA 3.45Å; A229-P272 HydrophobicContact CB-CG 3.98Å; A229-P272 PolarHBondContact N-O 2.88Å; A229-P272 VanDerWaalsContact O-CD 3.23Å; A229-P272 WeakPolarHBondContact O-CD 3.05Å; A229-F274 HydrophobicContact CB-CE2 4.23Å |
| 230 | E | 95.4 | Very high | 83 | Confident | 50 Ų | 50 | 69.4 Ų | 69.4 | 23% | 0.234 | 36% | 0.357 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -129.7 | 150.2 | -172.9 | -67.3 | 172.7 | -171.5 | 0 | 0 | 109.6 | G207 Q208 R210 S228 L232 N271 | G207-E230 CarbonylContact C-O 3.49Å; G207-E230 WeakPolarHBondContact CA-O 3.35Å; Q208-E230 HydrophobicContact CB-CB 4.38Å; Q208-E230 PolarHBondContact N-O 3.01Å; Q208-E230 PolarHBondContact O-N 2.89Å; R210-E230 VanDerWaalsContact CD-CD 3.44Å; R210-E230 WeakPolarHBondContact CD-OE1 3.42Å; R210-E230 IonicContact NE-OE1 3.75Å; R210-E230 IonicContact NH1-OE1 3.22Å; R210-E230 PolarHBondContact NH1-OE1 3.27Å; S228-E230 PolarHBondContact OG-OE1 2.88Å; E230-L232 PolarHBondContact O-N 2.78Å; E230-L232 VanDerWaalsContact O-N 3.16Å; E230-N271 VanDerWaalsContact CA-OD1 3.28Å; E230-N271 WeakPolarHBondContact CA-OD1 3.47Å |
| 231 | D | 92.7 | Very high | 81.5 | Confident | 101 Ų | 101 | 70.6 Ų | 70.6 | 54% | 0.54 | 36% | 0.363 | S | S | . | . | S | Bend | trans | 53 | 36.1 | 178.7 | -55.7 | -42.8 | 0 | 0 | 0 | 113.9 | G207 Q208 N271 | G207-D231 WeakPolarHBondContact CA-O 3.41Å; Q208-D231 PolarHBondContact NE2-OD2 2.82Å; D231-N271 PolarHBondContact N-OD1 2.82Å |
| 232 | L | 90.9 | Very high | 79.9 | Confident | 8 Ų | 8 | 68.9 Ų | 68.9 | 4% | 0.042 | 37% | 0.373 | C | S | . | . | trans | -67.9 | 134 | -178.3 | -68.4 | -179.1 | 0 | 0 | 0 | 111.5 | L202 A229 E230 R234 C246 S270 P272 V297 L310 | L202-L232 HydrophobicContact CD1-CD2 3.5Å; A229-L232 HydrophobicContact CB-CD1 3.71Å; A229-L232 HydrophobicContact CB-CD2 4.02Å; A229-L232 HydrophobicContact CB-CG 3.92Å; E230-L232 PolarHBondContact O-N 2.78Å; E230-L232 VanDerWaalsContact O-N 3.16Å; L232-R234 PolarHBondContact O-N 2.77Å; L232-R234 VanDerWaalsContact O-N 3.13Å; L232-C246 HydrophobicContact CD1-CB 4.46Å; L232-C246 WeakPolarHBondContact CD1-SG 3.4Å; L232-S270 WeakPolarHBondContact CB-O 3.45Å; L232-S270 PolarHBondContact N-O 2.89Å; L232-P272 HydrophobicContact CD1-CG 3.73Å; L232-V297 HydrophobicContact CD1-CG1 3.76Å; L232-V297 HydrophobicContact CD2-CG1 3.93Å; L232-L310 HydrophobicContact CB-CD1 4.45Å; L232-L310 HydrophobicContact CD1-CD1 4.22Å | ||
| 233 | P | 84.5 | Confident | 78.7 | Confident | 34 Ų | 34 | 70.3 Ų | 70.3 | 22% | 0.221 | 39% | 0.389 | C | S | . | . | trans | -71.1 | 112.4 | 179.4 | 26.6 | -30.9 | 0 | 0 | 0 | 109 | R205 L310 | R205-P233 HydrophobicContact CB-CB 4.07Å; R205-P233 HydrophobicContact CB-CG 3.47Å; R205-P233 VanDerWaalsContact CB-CG 3.47Å; P233-L310 WeakPolarHBondContact O-CD2 3.22Å | ||
| 234 | R | 76 | Confident | 77.9 | Confident | 135 Ų | 135 | 67.8 Ų | 67.8 | 51% | 0.509 | 38% | 0.384 | S | S | . | . | trans | -83.9 | 131.6 | 174.1 | -67.6 | -158.9 | -162.1 | -178.3 | 20.1 | 110.7 | L232 R236 G268 S270 | L232-R234 PolarHBondContact O-N 2.77Å; L232-R234 VanDerWaalsContact O-N 3.13Å; R234-R236 PolarHBondContact O-N 2.93Å; R234-G268 VanDerWaalsContact NH1-C 3.28Å; R234-G268 PolarHBondContact NH1-O 2.83Å; R234-G268 PolarHBondContact NH2-O 2.89Å; R234-S270 PolarHBondContact NE-OG 3.29Å; R234-S270 PolarHBondContact NH2-OG 2.91Å | ||
| 235 | P | 65.7 | Low | 77.6 | Confident | 59 Ų | 59 | 67.9 Ų | 67.9 | 38% | 0.383 | 39% | 0.385 | S | S | . | . | trans | -54.1 | 132.8 | 164.3 | -18.9 | 30.2 | 0 | 0 | 0 | 108.6 | A237 L310 | P235-A237 PolarHBondContact O-N 2.92Å; P235-L310 HydrophobicContact CG-CD2 4.5Å | ||
| 236 | R | 60.6 | Low | 77.3 | Confident | 247 Ų | 247 | 63.5 Ų | 63.5 | 93% | 0.932 | 37% | 0.369 | S | S | * | . | trans | -49.6 | 113.6 | 176.1 | -74.3 | -178.7 | 176.3 | 158.6 | -1.1 | 108.4 | R234 R238 | R234-R236 PolarHBondContact O-N 2.93Å; R236-R238 PolarHBondContact O-N 2.76Å | ||
| 237 | A | 57.4 | Low | 77.2 | Confident | 85 Ų | 85 | 63.5 Ų | 63.5 | 70% | 0.702 | 37% | 0.369 | S | S | * | . | trans | -64.6 | 104.7 | -177.6 | 0 | 0 | 0 | 0 | 0 | 108 | P235 | P235-A237 PolarHBondContact O-N 2.92Š| ||
| 238 | R | 59 | Low | 77.1 | Confident | 203 Ų | 203 | 61.9 Ų | 61.9 | 77% | 0.766 | 36% | 0.359 | S | S | * | . | trans | -64.3 | 141 | 159.2 | -82 | -178.9 | 170.3 | 160.4 | -2.6 | 107.5 | R236 G240 S241 | R236-R238 PolarHBondContact O-N 2.76Å; R238-G240 PolarHBondContact O-N 2.87Å; R238-S241 VanDerWaalsContact O-CB 3.3Å; R238-S241 WeakPolarHBondContact O-CB 3.41Å; R238-S241 PolarHBondContact O-N 2.89Å | ||
| 239 | P | 53 | Low | 77.1 | Confident | 138 Ų | 138 | 62.1 Ų | 62.1 | 90% | 0.896 | 36% | 0.36 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -50.6 | 125.5 | 173 | -21.9 | 30.6 | 0 | 0 | 0 | 109.5 | ||
| 240 | G | 55.8 | Low | 77.1 | Confident | 92 Ų | 92 | 62.1 Ų | 62.1 | 95% | 0.948 | 36% | 0.36 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 87.1 | -4.4 | -175.8 | 0 | 0 | 0 | 0 | 0 | 116.2 | R238 G242 | R238-G240 PolarHBondContact O-N 2.87Å; G240-G242 PolarHBondContact O-N 2.81Å |
| 241 | S | 58.8 | Low | 77.1 | Confident | 34 Ų | 34 | 62.6 Ų | 62.6 | 24% | 0.238 | 36% | 0.36 | C | S | . | . | trans | -97.9 | 52.2 | 174.9 | -176.7 | 0 | 0 | 0 | 0 | 111.3 | R238 G243 R305 | R238-S241 VanDerWaalsContact O-CB 3.3Å; R238-S241 WeakPolarHBondContact O-CB 3.41Å; R238-S241 PolarHBondContact O-N 2.89Å; S241-G243 PolarHBondContact O-N 3.36Å; S241-G243 VanDerWaalsContact O-N 3.14Å; S241-R305 PolarHBondContact OG-NH1 3.22Å | ||
| 242 | G | 58.3 | Low | 77.2 | Confident | 53 Ų | 53 | 58 Ų | 58 | 55% | 0.546 | 34% | 0.335 | S | S | . | . | trans | -52.3 | 122.5 | 168.3 | 0 | 0 | 0 | 0 | 0 | 109.1 | G240 G244 V302 | G240-G242 PolarHBondContact O-N 2.81Å; G242-G244 PolarHBondContact O-N 2.8Å; G242-V302 WeakPolarHBondContact O-CG2 3.41Å | ||
| 243 | G | 66.8 | Low | 77.3 | Confident | 33 Ų | 33 | 59.5 Ų | 59.5 | 34% | 0.34 | 34% | 0.342 | S | S | . | . | trans | -62.5 | 133.9 | 175.1 | 0 | 0 | 0 | 0 | 0 | 108.8 | S241 G245 Q267 | S241-G243 PolarHBondContact O-N 3.36Å; S241-G243 VanDerWaalsContact O-N 3.14Å; G243-G245 PolarHBondContact O-N 2.78Å; G243-Q267 PolarHBondContact O-OE1 2.78Å | ||
| 244 | G | 78.9 | Confident | 77.5 | Confident | 13 Ų | 13 | 61.8 Ų | 61.8 | 13% | 0.134 | 36% | 0.357 | C | S | . | . | trans | -72.7 | 5.7 | -175.9 | 0 | 0 | 0 | 0 | 0 | 113.6 | G242 V265 Q267 R300 V302 | G242-G244 PolarHBondContact O-N 2.8Å; G244-V265 WeakPolarHBondContact O-CG1 3.5Å; G244-Q267 PolarHBondContact O-NE2 3.42Å; G244-Q267 PolarHBondContact O-OE1 2.72Å; G244-Q267 VanDerWaalsContact O-OE1 3.13Å; G244-R300 WeakPolarHBondContact CA-O 3.43Å; G244-R300 PolarHBondContact N-O 2.75Å; G244-R300 WeakPolarHBondContact O-CB 3.23Å; G244-V302 VanDerWaalsContact CA-CG2 3.45Å | ||
| 245 | G | 88.9 | Confident | 77.8 | Confident | 2 Ų | 2 | 65.1 Ų | 65.1 | 2% | 0.021 | 37% | 0.369 | C | S | . | . | trans | 108.2 | 155.2 | 170.1 | 0 | 0 | 0 | 0 | 0 | 112.6 | G243 V266 R300 | G243-G245 PolarHBondContact O-N 2.78Å; G245-V266 CarbonylContact C-O 3.55Å; G245-V266 VanDerWaalsContact CA-O 3.29Å; G245-V266 WeakPolarHBondContact CA-O 3.21Å; G245-R300 VanDerWaalsContact O-CB 3.27Å; G245-R300 WeakPolarHBondContact O-CB 3.36Å; G245-R300 VanDerWaalsContact O-CG 3.3Å; G245-R300 WeakPolarHBondContact O-CG 3.5Å; G245-R300 PolarHBondContact O-N 2.89Å | ||
| 246 | C | 92.1 | Very high | 77.9 | Confident | 6 Ų | 6 | 66.2 Ų | 66.2 | 4% | 0.041 | 38% | 0.375 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -86.5 | 138.8 | 179.9 | -175.2 | 0 | 0 | 0 | 0 | 111.1 | L232 V265 V266 P272 V297 L298 | L232-C246 HydrophobicContact CD1-CB 4.46Å; L232-C246 WeakPolarHBondContact CD1-SG 3.4Å; C246-V265 CarbonylContact O-C 3.44Å; C246-V265 WeakPolarHBondContact O-CA 3.35Å; C246-V266 PolarHBondContact N-O 2.82Å; C246-V266 PolarHBondContact O-N 3.46Å; C246-P272 HydrophobicContact CB-CB 4.3Å; C246-P272 HydrophobicContact CB-CG 3.97Å; C246-V297 WeakPolarHBondContact SG-CG1 3.46Å; C246-L298 CarbonylContact C-O 3.52Å; C246-L298 WeakPolarHBondContact CA-O 3.35Å |
| 247 | C | 94.8 | Very high | 78.5 | Confident | 0 Ų | 0 | 65.2 Ų | 65.2 | 0% | 0 | 37% | 0.371 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -142 | 154.8 | 167.2 | 62.3 | 0 | 0 | 0 | 0 | 111 | R262 V265 L298 | C247-R262 PolarHBondContact SG-NE 2.84Å; C247-R262 PolarHBondContact SG-NH2 3.24Å; C247-V265 HydrophobicContact CB-CG2 4.04Å; C247-L298 PolarHBondContact N-O 3.2Å; C247-L298 PolarHBondContact O-N 3.38Å |
| 248 | V | 96.8 | Very high | 79.2 | Confident | 0 Ų | 0 | 63.4 Ų | 63.4 | 0% | 0 | 35% | 0.352 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -113.3 | 136.6 | -179.4 | -173.5 | 0 | 0 | 0 | 0 | 109.1 | L209 L226 L250 R262 S263 F274 A295 K296 V297 | L209-V248 HydrophobicContact CD1-CG1 4.38Å; L209-V248 HydrophobicContact CD1-CG2 4.11Å; L209-V248 HydrophobicContact CD2-CG1 4.29Å; L226-V248 HydrophobicContact CD1-CG1 4.47Å; L226-V248 HydrophobicContact CD1-CG2 4.3Å; L226-V248 HydrophobicContact CD2-CB 3.68Å; L226-V248 HydrophobicContact CD2-CG1 4.28Å; L226-V248 HydrophobicContact CD2-CG2 3.82Å; V248-L250 HydrophobicContact CG1-CD2 3.83Å; V248-L250 HydrophobicContact CG1-CG 4.31Å; V248-R262 WeakPolarHBondContact O-CA 3.34Å; V248-S263 PolarHBondContact N-OG 3.15Å; V248-S263 PolarHBondContact O-N 3.32Å; V248-S263 PolarHBondContact O-OG 3.38Å; V248-F274 HydrophobicContact CG2-CD2 4.46Å; V248-F274 HydrophobicContact CG2-CE1 4.45Å; V248-F274 HydrophobicContact CG2-CE2 3.77Å; V248-F274 HydrophobicContact CG2-CZ 3.77Å; V248-A295 HydrophobicContact CG1-CB 4.35Å; V248-K296 CarbonylContact C-O 3.56Å; V248-K296 WeakPolarHBondContact CA-O 2.95Å; V248-V297 HydrophobicContact CG1-CG2 4.48Å; V248-V297 HydrophobicContact CG2-CG1 4.44Å; V248-V297 HydrophobicContact CG2-CG2 4.14Å |
| 249 | V | 96.8 | Very high | 80.4 | Confident | 11 Ų | 11 | 64.6 Ų | 64.6 | 7% | 0.067 | 36% | 0.357 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -112.9 | 116.7 | 175 | -178.8 | 0 | 0 | 0 | 0 | 108.5 | A260 Q261 R262 A295 K296 L298 | V249-A260 HydrophobicContact CG1-CB 3.78Å; V249-Q261 CarbonylContact C-O 3.57Å; V249-Q261 WeakPolarHBondContact CA-O 3.45Å; V249-R262 HydrophobicContact CG2-CB 4.39Å; V249-R262 HydrophobicContact CG2-CG 3.97Å; V249-A295 CarbonylContact O-C 3.56Å; V249-A295 WeakPolarHBondContact O-CA 3.25Å; V249-K296 HydrophobicContact CB-CB 4.48Å; V249-K296 PolarHBondContact N-O 3.07Å; V249-K296 PolarHBondContact O-N 3.01Å; V249-L298 HydrophobicContact CG2-CD1 3.78Å |
| 250 | L | 96.6 | Very high | 82.2 | Confident | 0 Ų | 0 | 60.2 Ų | 60.2 | 0% | 0 | 33% | 0.332 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -103.1 | 134.5 | 179.7 | -59.2 | 179.6 | 0 | 0 | 0 | 110.4 | V248 A260 Q261 F278 F280 L293 A295 | V248-L250 HydrophobicContact CG1-CD2 3.83Å; V248-L250 HydrophobicContact CG1-CG 4.31Å; L250-A260 WeakPolarHBondContact O-CA 3.35Å; L250-Q261 PolarHBondContact N-O 2.88Å; L250-Q261 PolarHBondContact O-N 2.81Å; L250-F278 HydrophobicContact CD1-CB 4.27Å; L250-F278 HydrophobicContact CD1-CD1 4.44Å; L250-F278 HydrophobicContact CD1-CD2 3.38Å; L250-F278 HydrophobicContact CD1-CE2 3.74Å; L250-F278 HydrophobicContact CD1-CG 3.76Å; L250-F278 HydrophobicContact CD1-CZ 4.4Å; L250-F280 HydrophobicContact CB-CZ 4.36Å; L250-L293 HydrophobicContact CB-CD1 4.25Å; L250-L293 HydrophobicContact CD2-CD1 4.47Å; L250-A295 HydrophobicContact CD2-CB 3.5Å; L250-A295 VanDerWaalsContact CD2-CB 3.5Å |
| 251 | R | 95.3 | Very high | 84.1 | Confident | 60 Ų | 60 | 58.1 Ų | 58.1 | 23% | 0.226 | 30% | 0.297 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -144.2 | 145.9 | -179.5 | -81.3 | 179.4 | -82.5 | -117 | -1.3 | 110.8 | A260 R294 K296 | R251-A260 VanDerWaalsContact CG-CA 3.43Å; R251-A260 HydrophobicContact CG-CB 3.25Å; R251-R294 PolarHBondContact N-O 3.28Å; R251-R294 PolarHBondContact O-N 3.26Å; R251-K296 VanDerWaalsContact NH2-CD 3.26Å; R251-K296 VanDerWaalsContact NH2-CE 3.31Å |
| 252 | L | 94.6 | Very high | 85.9 | Confident | 6 Ų | 6 | 60.7 Ų | 60.7 | 3% | 0.031 | 30% | 0.302 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -89.1 | 140.8 | 165.7 | -60.5 | -177.9 | 0 | 0 | 0 | 110.9 | F280 L283 S292 L293 L317 | L252-F280 HydrophobicContact CD1-CB 3.87Å; L252-F280 HydrophobicContact CD1-CD1 3.48Å; L252-F280 VanDerWaalsContact CD1-CD1 3.48Å; L252-F280 HydrophobicContact CD1-CE1 4.24Å; L252-F280 HydrophobicContact CD1-CG 3.81Å; L252-F280 HydrophobicContact CD2-CD1 4.35Å; L252-F280 HydrophobicContact CD2-CE1 4.48Å; L252-F280 HydrophobicContact CG-CD1 3.57Å; L252-F280 HydrophobicContact CG-CE1 3.81Å; L252-F280 HydrophobicContact CG-CG 4.15Å; L252-L283 HydrophobicContact CD1-CD1 3.94Å; L252-L283 HydrophobicContact CD1-CD2 3.79Å; L252-L283 HydrophobicContact CD1-CG 4.39Å; L252-S292 CarbonylContact C-O 3.43Å; L252-S292 WeakPolarHBondContact CA-O 3.36Å; L252-L293 HydrophobicContact CD2-CD1 4.2Å; L252-L317 HydrophobicContact CD2-CD1 4.07Å; L252-L317 HydrophobicContact CD2-CD2 3.89Å; L252-L317 HydrophobicContact CD2-CG 4.39Å |
| 253 | Q | 93.6 | Very high | 87.7 | Confident | 38 Ų | 38 | 58.5 Ų | 58.5 | 18% | 0.178 | 28% | 0.279 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -123 | 141.1 | 174.1 | -91.2 | 176.5 | -143.3 | 0 | 0 | 109.6 | R291 S292 R294 E314 | Q253-R291 CarbonylContact O-C 3.58Å; Q253-R291 WeakPolarHBondContact O-CA 2.88Å; Q253-R291 WeakPolarHBondContact O-CB 3.13Å; Q253-S292 VanDerWaalsContact CB-OG 3.29Å; Q253-S292 WeakPolarHBondContact CB-OG 3.28Å; Q253-S292 PolarHBondContact N-O 2.79Å; Q253-S292 PolarHBondContact O-N 3.13Å; Q253-R294 VanDerWaalsContact OE1-NH1 3.11Å; Q253-E314 PolarHBondContact NE2-OE1 3Å; Q253-E314 PolarHBondContact NE2-OE2 3.37Å |
| 254 | P | 88.4 | Confident | 89 | Confident | 83 Ų | 83 | 63.4 Ų | 63.4 | 54% | 0.539 | 29% | 0.287 | S | S | . | . | S | Bend | cis | -63.1 | 158.7 | -8 | 27.9 | -35.3 | 0 | 0 | 0 | 112.6 | V256 | P254-V256 VanDerWaalsContact C-N 3.31Å; P254-V256 PolarHBondContact O-N 2.92Å |
| 255 | R | 80.9 | Confident | 89.8 | Confident | 204 Ų | 204 | 65.3 Ų | 65.3 | 77% | 0.77 | 30% | 0.296 | S | S | * | . | trans | -73.6 | 83.2 | -171.8 | -67 | -174.9 | -174.7 | 179.9 | 4.9 | 111.7 | ||||
| 256 | V | 69.2 | Low | 90 | Very high | 82 Ų | 82 | 66.6 Ų | 66.6 | 50% | 0.497 | 30% | 0.303 | S | S | . | . | trans | -110.4 | 134.9 | 160.8 | -173.7 | 0 | 0 | 0 | 0 | 104.7 | P254 | P254-V256 VanDerWaalsContact C-N 3.31Å; P254-V256 PolarHBondContact O-N 2.92Å | ||
| 257 | R | 72.3 | Confident | 89.8 | Confident | 226 Ų | 226 | 71.9 Ų | 71.9 | 85% | 0.853 | 33% | 0.327 | S | S | * | . | S | Bend | trans | -37.4 | 144.7 | -176 | -71 | -176 | 178.7 | -158.9 | 2.4 | 111.6 | ||
| 258 | P | 72.8 | Confident | 88.8 | Confident | 47 Ų | 47 | 74.3 Ų | 74.3 | 31% | 0.305 | 35% | 0.352 | S | S | . | . | S | Bend | cis | -86.4 | 168.5 | 18.5 | 32.4 | -36.2 | 0 | 0 | 0 | 116 | F280 | P258-F280 HydrophobicContact CG-CD1 3.43Å; P258-F280 VanDerWaalsContact CG-CD1 3.43Å; P258-F280 HydrophobicContact CG-CE1 3.97Å; P258-F280 HydrophobicContact CG-CG 4.41Å |
| 259 | R | 83.4 | Confident | 88.2 | Confident | 229 Ų | 229 | 76.4 Ų | 76.4 | 86% | 0.864 | 37% | 0.366 | S | S | * | . | P | Polyproline II helix | trans | -63.9 | 165.2 | 170.3 | -77 | -174.9 | 176.4 | -175.5 | 0 | 110.3 | Q261 | R259-Q261 PolarHBondContact O-N 2.72Š|
| 260 | A | 91.3 | Very high | 87.9 | Confident | 45 Ų | 45 | 77.4 Ų | 77.4 | 37% | 0.372 | 37% | 0.374 | S | S | . | . | P | Polyproline II helix | trans | -50.4 | 130.6 | 171.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | V249 L250 R251 | V249-A260 HydrophobicContact CG1-CB 3.78Å; L250-A260 WeakPolarHBondContact O-CA 3.35Å; R251-A260 VanDerWaalsContact CG-CA 3.43Å; R251-A260 HydrophobicContact CG-CB 3.25Å |
| 261 | Q | 95.3 | Very high | 87.7 | Confident | 48 Ų | 48 | 81.1 Ų | 81.1 | 22% | 0.224 | 39% | 0.394 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -99.4 | 140.3 | 171.8 | -61 | -176.7 | -2.1 | 0 | 0 | 108.5 | V249 L250 R259 F278 F279 F280 | V249-Q261 CarbonylContact C-O 3.57Å; V249-Q261 WeakPolarHBondContact CA-O 3.45Å; L250-Q261 PolarHBondContact N-O 2.88Å; L250-Q261 PolarHBondContact O-N 2.81Å; R259-Q261 PolarHBondContact O-N 2.72Å; Q261-F278 HydrophobicContact CB-CD1 3.59Å; Q261-F278 HydrophobicContact CB-CE1 3.99Å; Q261-F278 HydrophobicContact CG-CD1 4.5Å; Q261-F278 VanDerWaalsContact OE1-CB 3.27Å; Q261-F278 VanDerWaalsContact OE1-CD1 3.3Å; Q261-F279 PolarHBondContact NE2-O 2.9Å; Q261-F280 HydrophobicContact CG-CE1 4.49Å; Q261-F280 HydrophobicContact CG-CZ 4.43Å |
| 262 | R | 96 | Very high | 87.7 | Confident | 88 Ų | 88 | 78.3 Ų | 78.3 | 33% | 0.332 | 38% | 0.384 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -123.8 | 135.4 | -174.7 | -174.3 | 176.3 | -162.4 | 156.9 | 12.5 | 109.2 | C247 V248 V249 R300 D307 | C247-R262 PolarHBondContact SG-NE 2.84Å; C247-R262 PolarHBondContact SG-NH2 3.24Å; V248-R262 WeakPolarHBondContact O-CA 3.34Å; V249-R262 HydrophobicContact CG2-CB 4.39Å; V249-R262 HydrophobicContact CG2-CG 3.97Å; R262-R300 VanDerWaalsContact CZ-NE 3.3Å; R262-R300 VanDerWaalsContact NH2-NH1 3.1Å; R262-D307 IonicContact CZ-OD2 3.81Å; R262-D307 IonicContact NH1-OD2 3.92Å; R262-D307 IonicContact NH2-OD2 3.82Å; R262-D307 PolarHBondContact NH2-OD2 3.22Å |
| 263 | S | 96.9 | Very high | 87.7 | Confident | 8 Ų | 8 | 82.6 Ų | 82.6 | 6% | 0.056 | 41% | 0.406 | C | S | . | . | P | Polyproline II helix | trans | -72.4 | 166.9 | 175.2 | 76.7 | 0 | 0 | 0 | 0 | 112.7 | V248 F274 E276 | V248-S263 PolarHBondContact N-OG 3.15Å; V248-S263 PolarHBondContact O-N 3.32Å; V248-S263 PolarHBondContact O-OG 3.38Å; S263-F274 WeakPolarHBondContact OG-CE1 3.15Å; S263-E276 WeakPolarHBondContact CA-OE2 3.28Å; S263-E276 VanDerWaalsContact CB-OE2 3.31Å; S263-E276 WeakPolarHBondContact CB-OE2 3.48Å |
| 264 | R | 95.2 | Very high | 87.9 | Confident | 136 Ų | 136 | 80.8 Ų | 80.8 | 51% | 0.513 | 40% | 0.397 | S | S | . | . | P | Polyproline II helix | trans | -53.3 | 156.1 | 159.9 | 71.7 | -174.9 | -168.4 | -178.2 | 1.1 | 111.6 | V266 I273 F274 E276 | R264-V266 HydrophobicContact CG-CG2 4.33Å; R264-I273 PolarHBondContact NH2-O 3.32Å; R264-F274 HydrophobicContact CG-CD1 4.1Å; R264-F274 PolarHBondContact NE-O 3.05Å; R264-F274 PolarHBondContact NH2-O 3.25Å; R264-F274 WeakPolarHBondContact O-CE1 3.45Å; R264-E276 PolarHBondContact N-OE2 3.38Å |
| 265 | V | 94.3 | Very high | 88.3 | Confident | 53 Ų | 53 | 80.6 Ų | 80.6 | 32% | 0.321 | 39% | 0.392 | S | S | . | . | P | Polyproline II helix | trans | -92.4 | 125 | 175.7 | -177 | 0 | 0 | 0 | 0 | 108.9 | G244 C246 C247 R300 | G244-V265 WeakPolarHBondContact O-CG1 3.5Å; C246-V265 CarbonylContact O-C 3.44Å; C246-V265 WeakPolarHBondContact O-CA 3.35Å; C247-V265 HydrophobicContact CB-CG2 4.04Å; V265-R300 HydrophobicContact CG1-CG 3.86Å; V265-R300 HydrophobicContact CG2-CG 3.97Å |
| 266 | V | 92.9 | Very high | 89 | Confident | 28 Ų | 28 | 73.4 Ų | 73.4 | 17% | 0.17 | 37% | 0.367 | C | S | . | . | B | Isolated β-bridge | trans | -108.3 | 120.8 | 176.8 | 179.7 | 0 | 0 | 0 | 0 | 109.1 | G245 C246 R264 P272 F274 | G245-V266 CarbonylContact C-O 3.55Å; G245-V266 VanDerWaalsContact CA-O 3.29Å; G245-V266 WeakPolarHBondContact CA-O 3.21Å; C246-V266 PolarHBondContact N-O 2.82Å; C246-V266 PolarHBondContact O-N 3.46Å; R264-V266 HydrophobicContact CG-CG2 4.33Å; V266-P272 HydrophobicContact CB-CB 3.69Å; V266-P272 HydrophobicContact CG1-CB 3.65Å; V266-P272 HydrophobicContact CG2-CB 4.25Å; V266-F274 HydrophobicContact CB-CE1 4.27Å; V266-F274 HydrophobicContact CG2-CD1 3.75Å; V266-F274 HydrophobicContact CG2-CE1 3.65Å; V266-F274 HydrophobicContact CG2-CZ 4.38Å |
| 267 | Q | 89.1 | Confident | 90.4 | Very high | 118 Ų | 118 | 72 Ų | 72 | 55% | 0.551 | 36% | 0.357 | S | S | * | . | trans | -77.2 | 141.5 | -173.3 | -63.9 | -59.4 | -27 | 0 | 0 | 112.6 | G243 G244 S269 | G243-Q267 PolarHBondContact O-OE1 2.78Å; G244-Q267 PolarHBondContact O-NE2 3.42Å; G244-Q267 PolarHBondContact O-OE1 2.72Å; G244-Q267 VanDerWaalsContact O-OE1 3.13Å; Q267-S269 PolarHBondContact O-N 3.27Å | ||
| 268 | G | 72.8 | Confident | 91.5 | Very high | 51 Ų | 51 | 61.7 Ų | 61.7 | 53% | 0.526 | 32% | 0.318 | S | S | . | . | S | Bend | trans | 57.6 | 22.6 | 156.4 | 0 | 0 | 0 | 0 | 0 | 117.7 | R234 | R234-G268 VanDerWaalsContact NH1-C 3.28Å; R234-G268 PolarHBondContact NH1-O 2.83Å; R234-G268 PolarHBondContact NH2-O 2.89Å |
| 269 | S | 85 | Confident | 92.5 | Very high | 43 Ų | 43 | 63.5 Ų | 63.5 | 30% | 0.301 | 32% | 0.321 | S | S | . | . | trans | -117 | 140.3 | 177.4 | -170.6 | 0 | 0 | 0 | 0 | 112 | Q267 N271 | Q267-S269 PolarHBondContact O-N 3.27Å; S269-N271 VanDerWaalsContact C-N 3.26Å; S269-N271 PolarHBondContact OG-N 3.45Å; S269-N271 PolarHBondContact OG-O 3.43Å; S269-N271 VanDerWaalsContact OG-O 3.05Å | ||
| 270 | S | 89.3 | Confident | 93 | Very high | 33 Ų | 33 | 52.7 Ų | 52.7 | 23% | 0.231 | 28% | 0.28 | C | S | . | . | S | Bend | trans | -83.2 | -17.4 | 168.9 | -51.2 | 0 | 0 | 0 | 0 | 110.1 | L232 R234 P272 | L232-S270 WeakPolarHBondContact CB-O 3.45Å; L232-S270 PolarHBondContact N-O 2.89Å; R234-S270 PolarHBondContact NE-OG 3.29Å; R234-S270 PolarHBondContact NH2-OG 2.91Å; S270-P272 WeakPolarHBondContact O-CD 3.38Å |
| 271 | N | 93.4 | Very high | 93 | Very high | 78 Ų | 78 | 55.9 Ų | 55.9 | 42% | 0.417 | 29% | 0.288 | S | S | . | . | S | Bend | trans | -123 | 62.3 | 178.8 | -58.1 | -54.1 | 0 | 0 | 0 | 109 | A229 E230 D231 S269 I273 | A229-N271 CarbonylContact O-C 3.58Å; A229-N271 VanDerWaalsContact O-C 3.31Å; A229-N271 WeakPolarHBondContact O-CA 3.45Å; E230-N271 VanDerWaalsContact CA-OD1 3.28Å; E230-N271 WeakPolarHBondContact CA-OD1 3.47Å; D231-N271 PolarHBondContact N-OD1 2.82Å; S269-N271 VanDerWaalsContact C-N 3.26Å; S269-N271 PolarHBondContact OG-N 3.45Å; S269-N271 PolarHBondContact OG-O 3.43Å; S269-N271 VanDerWaalsContact OG-O 3.05Å; N271-I273 PolarHBondContact O-N 2.84Å |
| 272 | P | 94.3 | Very high | 92.7 | Very high | 1 Ų | 1 | 56.4 Ų | 56.4 | 1% | 0.006 | 31% | 0.305 | C | S | . | . | trans | -68.3 | 132 | -179.1 | 28.8 | -35.7 | 0 | 0 | 0 | 110.9 | S228 A229 L232 C246 V266 S270 F274 | S228-P272 VanDerWaalsContact CA-O 3.27Å; S228-P272 WeakPolarHBondContact CA-O 3.44Å; A229-P272 HydrophobicContact CB-CG 3.98Å; A229-P272 PolarHBondContact N-O 2.88Å; A229-P272 VanDerWaalsContact O-CD 3.23Å; A229-P272 WeakPolarHBondContact O-CD 3.05Å; L232-P272 HydrophobicContact CD1-CG 3.73Å; C246-P272 HydrophobicContact CB-CB 4.3Å; C246-P272 HydrophobicContact CB-CG 3.97Å; V266-P272 HydrophobicContact CB-CB 3.69Å; V266-P272 HydrophobicContact CG1-CB 3.65Å; V266-P272 HydrophobicContact CG2-CB 4.25Å; S270-P272 WeakPolarHBondContact O-CD 3.38Å; P272-F274 HydrophobicContact CB-CE1 4.5Å; P272-F274 HydrophobicContact CB-CE2 3.89Å; P272-F274 HydrophobicContact CB-CZ 3.76Å; P272-F274 HydrophobicContact CG-CE2 3.74Å; P272-F274 HydrophobicContact CG-CZ 3.79Å | ||
| 273 | I | 96.3 | Very high | 92.4 | Very high | 96 Ų | 96 | 52.2 Ų | 52.2 | 49% | 0.492 | 29% | 0.29 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -102.6 | 120.7 | 176.2 | -57.9 | 174.3 | 0 | 0 | 0 | 108.6 | R264 N271 N275 | R264-I273 PolarHBondContact NH2-O 3.32Å; N271-I273 PolarHBondContact O-N 2.84Å; I273-N275 VanDerWaalsContact CG2-ND2 3.29Å; I273-N275 WeakPolarHBondContact CG2-ND2 3.47Å |
| 274 | F | 96.8 | Very high | 92 | Very high | 0 Ų | 0 | 52.8 Ų | 52.8 | 0% | 0 | 30% | 0.297 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -100.6 | -48.6 | -177 | -59.5 | -83.8 | 0 | 0 | 0 | 111.6 | L226 V227 A229 V248 S263 R264 V266 P272 E276 | L226-F274 HydrophobicContact CB-CB 4.42Å; L226-F274 HydrophobicContact CD1-CD2 4.2Å; L226-F274 HydrophobicContact CD2-CB 3.73Å; L226-F274 HydrophobicContact CD2-CD1 4.08Å; L226-F274 HydrophobicContact CD2-CD2 3.63Å; L226-F274 HydrophobicContact CD2-CE2 4.26Å; L226-F274 HydrophobicContact CD2-CG 3.53Å; L226-F274 HydrophobicContact CG-CB 3.76Å; L226-F274 HydrophobicContact CG-CD2 3.73Å; L226-F274 HydrophobicContact CG-CG 3.89Å; V227-F274 PolarHBondContact O-N 3.26Å; A229-F274 HydrophobicContact CB-CE2 4.23Å; V248-F274 HydrophobicContact CG2-CD2 4.46Å; V248-F274 HydrophobicContact CG2-CE1 4.45Å; V248-F274 HydrophobicContact CG2-CE2 3.77Å; V248-F274 HydrophobicContact CG2-CZ 3.77Å; S263-F274 WeakPolarHBondContact OG-CE1 3.15Å; R264-F274 HydrophobicContact CG-CD1 4.1Å; R264-F274 PolarHBondContact NE-O 3.05Å; R264-F274 PolarHBondContact NH2-O 3.25Å; R264-F274 WeakPolarHBondContact O-CE1 3.45Å; V266-F274 HydrophobicContact CB-CE1 4.27Å; V266-F274 HydrophobicContact CG2-CD1 3.75Å; V266-F274 HydrophobicContact CG2-CE1 3.65Å; V266-F274 HydrophobicContact CG2-CZ 4.38Å; P272-F274 HydrophobicContact CB-CE1 4.5Å; P272-F274 HydrophobicContact CB-CE2 3.89Å; P272-F274 HydrophobicContact CB-CZ 3.76Å; P272-F274 HydrophobicContact CG-CE2 3.74Å; P272-F274 HydrophobicContact CG-CZ 3.79Å; F274-E276 HydrophobicContact CB-CB 4.38Å; F274-E276 PolarHBondContact O-N 3.13Å |
| 275 | N | 96.6 | Very high | 91.7 | Very high | 79 Ų | 79 | 50.8 Ų | 50.8 | 42% | 0.422 | 30% | 0.301 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | 45.5 | 46.4 | -173.3 | -69.4 | -35.7 | 0 | 0 | 0 | 112.7 | L226 V227 I273 | L226-N275 CarbonylContact O-C 3.52Å; L226-N275 WeakPolarHBondContact O-CA 3.4Å; L226-N275 PolarHBondContact O-N 3.43Å; V227-N275 PolarHBondContact O-N 3.31Å; V227-N275 VanDerWaalsContact O-N 3.15Å; I273-N275 VanDerWaalsContact CG2-ND2 3.29Å; I273-N275 WeakPolarHBondContact CG2-ND2 3.47Å |
| 276 | E | 97.1 | Very high | 91.4 | Very high | 53 Ų | 53 | 52.8 Ų | 52.8 | 25% | 0.248 | 32% | 0.316 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -115.4 | 133.8 | -173 | -171.6 | 174.7 | 171.9 | 0 | 0 | 110.4 | R225 L226 S263 R264 F274 F278 | R225-E276 CarbonylContact C-O 3.58Å; R225-E276 WeakPolarHBondContact CA-O 3.42Å; L226-E276 PolarHBondContact N-O 3.26Å; L226-E276 PolarHBondContact O-N 3.08Å; S263-E276 WeakPolarHBondContact CA-OE2 3.28Å; S263-E276 VanDerWaalsContact CB-OE2 3.31Å; S263-E276 WeakPolarHBondContact CB-OE2 3.48Å; R264-E276 PolarHBondContact N-OE2 3.38Å; F274-E276 HydrophobicContact CB-CB 4.38Å; F274-E276 PolarHBondContact O-N 3.13Å; E276-F278 HydrophobicContact CB-CE2 4.1Å; E276-F278 HydrophobicContact CB-CZ 4.37Å; E276-F278 HydrophobicContact CG-CE2 4.04Å; E276-F278 HydrophobicContact CG-CZ 3.91Å |
| 277 | D | 96.6 | Very high | 91.3 | Very high | 53 Ų | 53 | 53.5 Ų | 53.5 | 28% | 0.283 | 32% | 0.318 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -96 | 133.7 | -179 | -74.2 | -6.8 | 0 | 0 | 0 | 111.3 | R223 R225 F279 | R223-D277 IonicContact CZ-OD2 3.84Å; R223-D277 VanDerWaalsContact CZ-OD2 3.25Å; R223-D277 IonicContact NE-OD1 2.72Å; R223-D277 IonicContact NE-OD2 2.84Å; R223-D277 PolarHBondContact NE-OD2 3.03Å; R223-D277 IonicContact NH2-OD1 2.92Å; R223-D277 IonicContact NH2-OD2 3.24Å; R223-D277 PolarHBondContact NH2-OD2 3.16Å; R225-D277 WeakPolarHBondContact CB-OD1 3.34Å; R225-D277 WeakPolarHBondContact CD-OD1 3.34Å; R225-D277 WeakPolarHBondContact CG-OD1 3.32Å; D277-F279 HydrophobicContact CB-CE2 4.02Å; D277-F279 HydrophobicContact CB-CZ 4.04Å |
| 278 | F | 96.3 | Very high | 91.4 | Very high | 8 Ų | 8 | 48.3 Ų | 48.3 | 4% | 0.035 | 29% | 0.294 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -119 | 139.2 | 177.7 | -65.1 | -79 | 0 | 0 | 0 | 109.8 | R223 L224 L226 L250 Q261 E276 F280 | R223-F278 CarbonylContact C-O 3.56Å; R223-F278 WeakPolarHBondContact CA-O 3.4Å; L224-F278 HydrophobicContact CB-CB 4.18Å; L224-F278 PolarHBondContact N-O 2.79Å; L224-F278 WeakPolarHBondContact O-CB 3.43Å; L224-F278 PolarHBondContact O-N 2.87Å; L226-F278 HydrophobicContact CB-CD2 4.18Å; L226-F278 HydrophobicContact CB-CE2 3.7Å; L226-F278 HydrophobicContact CD2-CE2 4.05Å; L250-F278 HydrophobicContact CD1-CB 4.27Å; L250-F278 HydrophobicContact CD1-CD1 4.44Å; L250-F278 HydrophobicContact CD1-CD2 3.38Å; L250-F278 HydrophobicContact CD1-CE2 3.74Å; L250-F278 HydrophobicContact CD1-CG 3.76Å; L250-F278 HydrophobicContact CD1-CZ 4.4Å; Q261-F278 HydrophobicContact CB-CD1 3.59Å; Q261-F278 HydrophobicContact CB-CE1 3.99Å; Q261-F278 HydrophobicContact CG-CD1 4.5Å; Q261-F278 VanDerWaalsContact OE1-CB 3.27Å; Q261-F278 VanDerWaalsContact OE1-CD1 3.3Å; E276-F278 HydrophobicContact CB-CE2 4.1Å; E276-F278 HydrophobicContact CB-CZ 4.37Å; E276-F278 HydrophobicContact CG-CE2 4.04Å; E276-F278 HydrophobicContact CG-CZ 3.91Å; F278-F280 HydrophobicContact CB-CE2 4.12Å |
| 279 | F | 94.6 | Very high | 92.2 | Very high | 86 Ų | 86 | 49.1 Ų | 49.1 | 38% | 0.377 | 30% | 0.296 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -122.9 | 128.5 | -176 | -60.1 | -81.6 | 0 | 0 | 0 | 110.8 | R221 L222 R223 Q261 D277 | R221-F279 HydrophobicContact CG-CD1 4.4Å; L222-F279 WeakPolarHBondContact O-CA 3.49Å; R223-F279 HydrophobicContact CB-CD1 3.95Å; R223-F279 HydrophobicContact CB-CE1 3.85Å; R223-F279 HydrophobicContact CG-CD1 4.09Å; R223-F279 HydrophobicContact CG-CE1 3.6Å; R223-F279 HydrophobicContact CG-CZ 4.25Å; Q261-F279 PolarHBondContact NE2-O 2.9Å; D277-F279 HydrophobicContact CB-CE2 4.02Å; D277-F279 HydrophobicContact CB-CZ 4.04Å |
| 280 | F | 93.5 | Very high | 92.5 | Very high | 1 Ų | 1 | 50.5 Ų | 50.5 | 0% | 0.004 | 31% | 0.31 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -119.4 | 118.5 | 173.4 | -59.9 | -93.5 | 0 | 0 | 0 | 108.4 | R221 L222 L224 L250 L252 P258 Q261 F278 L283 | R221-F280 CarbonylContact C-O 3.55Å; R221-F280 WeakPolarHBondContact CA-O 3.27Å; L222-F280 HydrophobicContact CB-CB 4.31Å; L222-F280 HydrophobicContact CD2-CD2 4.42Å; L222-F280 PolarHBondContact N-O 2.8Å; L222-F280 PolarHBondContact O-N 2.83Å; L224-F280 HydrophobicContact CB-CE2 4.5Å; L224-F280 HydrophobicContact CD1-CD2 3.74Å; L224-F280 HydrophobicContact CD1-CE2 3.46Å; L224-F280 VanDerWaalsContact CD1-CE2 3.46Å; L224-F280 HydrophobicContact CD1-CZ 4.48Å; L250-F280 HydrophobicContact CB-CZ 4.36Å; L252-F280 HydrophobicContact CD1-CB 3.87Å; L252-F280 HydrophobicContact CD1-CD1 3.48Å; L252-F280 VanDerWaalsContact CD1-CD1 3.48Å; L252-F280 HydrophobicContact CD1-CE1 4.24Å; L252-F280 HydrophobicContact CD1-CG 3.81Å; L252-F280 HydrophobicContact CD2-CD1 4.35Å; L252-F280 HydrophobicContact CD2-CE1 4.48Å; L252-F280 HydrophobicContact CG-CD1 3.57Å; L252-F280 HydrophobicContact CG-CE1 3.81Å; L252-F280 HydrophobicContact CG-CG 4.15Å; P258-F280 HydrophobicContact CG-CD1 3.43Å; P258-F280 VanDerWaalsContact CG-CD1 3.43Å; P258-F280 HydrophobicContact CG-CE1 3.97Å; P258-F280 HydrophobicContact CG-CG 4.41Å; Q261-F280 HydrophobicContact CG-CE1 4.49Å; Q261-F280 HydrophobicContact CG-CZ 4.43Å; F278-F280 HydrophobicContact CB-CE2 4.12Å; F280-L283 HydrophobicContact CB-CD1 3.73Å |
| 281 | E | 91.8 | Very high | 92.7 | Very high | 113 Ų | 113 | 50 Ų | 50 | 53% | 0.528 | 30% | 0.304 | S | S | . | . | trans | -107.4 | 161.4 | -175.8 | -63.7 | -180 | 173.2 | 0 | 0 | 111.5 | G220 R221 L283 | G220-E281 CarbonylContact O-C 3.58Å; R221-E281 HydrophobicContact CB-CG 4.49Å; R221-E281 HydrophobicContact CG-CG 4.02Å; R221-E281 IonicContact CZ-OE1 3.33Å; R221-E281 IonicContact NE-OE1 2.77Å; R221-E281 PolarHBondContact NE-OE1 2.95Å; R221-E281 IonicContact NH2-OE1 3.74Å; R221-E281 PolarHBondContact NH2-OE1 2.92Å; E281-L283 VanDerWaalsContact C-N 3.32Å | ||
| 282 | G | 88.9 | Confident | 92.8 | Very high | 58 Ų | 58 | 47.1 Ų | 47.1 | 60% | 0.598 | 29% | 0.289 | S | S | * | . | S | Bend | trans | 71 | 29.5 | -179.8 | 0 | 0 | 0 | 0 | 0 | 112.8 | G220 | G220-G282 PolarHBondContact O-N 2.98Š|
| 283 | L | 89.5 | Confident | 92.9 | Very high | 1 Ų | 1 | 47.1 Ų | 47.1 | 1% | 0.005 | 29% | 0.289 | C | S | . | . | trans | -97.3 | 111.6 | 172.7 | -63.6 | 174.5 | 0 | 0 | 0 | 108.3 | Y215 G220 L222 L252 F280 E281 D287 L317 | Y215-L283 HydrophobicContact CE2-CB 4.3Å; Y215-L283 WeakPolarHBondContact CE2-O 3.32Å; Y215-L283 PolarHBondContact OH-O 2.95Å; G220-L283 CarbonylContact C-O 3.46Å; G220-L283 WeakPolarHBondContact CA-O 3.46Å; G220-L283 PolarHBondContact O-N 2.84Å; L222-L283 HydrophobicContact CB-CD1 3.55Å; L222-L283 HydrophobicContact CD2-CD1 4.1Å; L222-L283 HydrophobicContact CG-CD1 4.48Å; L252-L283 HydrophobicContact CD1-CD1 3.94Å; L252-L283 HydrophobicContact CD1-CD2 3.79Å; L252-L283 HydrophobicContact CD1-CG 4.39Å; F280-L283 HydrophobicContact CB-CD1 3.73Å; E281-L283 VanDerWaalsContact C-N 3.32Å; L283-D287 HydrophobicContact CB-CB 4.47Å; L283-D287 HydrophobicContact CD2-CB 4.09Å; L283-L317 HydrophobicContact CD1-CD1 4.37Å | ||
| 284 | G | 88.5 | Confident | 92.9 | Very high | 20 Ų | 20 | 44.8 Ų | 44.8 | 21% | 0.206 | 27% | 0.274 | C | S | . | . | trans | -82.5 | 170 | 169.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | P286 D287 L288 | G284-P286 VanDerWaalsContact C-CD 3.42Å; G284-D287 PolarHBondContact N-OD2 2.75Å; G284-D287 WeakPolarHBondContact O-CB 3.06Å; G284-D287 PolarHBondContact O-N 3.43Å; G284-L288 PolarHBondContact O-N 2.84Å | ||
| 285 | P | 87.6 | Confident | 92.9 | Very high | 93 Ų | 93 | 44.9 Ų | 44.9 | 60% | 0.604 | 28% | 0.275 | S | S | * | . | H | α-helix | trans | -48.6 | -43.6 | 169.8 | -25.6 | 34.3 | 0 | 0 | 0 | 115.4 | D287 L288 | P285-D287 VanDerWaalsContact C-N 3.3Å; P285-D287 PolarHBondContact O-N 2.64Å; P285-L288 WeakPolarHBondContact O-CB 3.31Å; P285-L288 PolarHBondContact O-N 3.15Å |
| 286 | P | 89.5 | Confident | 92.9 | Very high | 96 Ų | 96 | 43 Ų | 43 | 62% | 0.623 | 26% | 0.263 | S | S | * | . | H | α-helix | trans | -67.6 | -30.4 | 177.2 | 26.6 | -34.9 | 0 | 0 | 0 | 112.8 | G284 L288 A289 A290 | G284-P286 VanDerWaalsContact C-CD 3.42Å; P286-L288 VanDerWaalsContact C-N 3.29Å; P286-L288 PolarHBondContact O-N 2.85Å; P286-A289 PolarHBondContact O-N 3.14Å; P286-A290 WeakPolarHBondContact O-CB 3.48Å; P286-A290 PolarHBondContact O-N 3.48Å |
| 287 | D | 90.3 | Very high | 92.8 | Very high | 42 Ų | 42 | 40.5 Ų | 40.5 | 23% | 0.225 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -66.5 | -32.4 | 175.8 | -69.4 | -64 | 0 | 0 | 0 | 112 | L283 G284 P285 A289 A290 R291 | L283-D287 HydrophobicContact CB-CB 4.47Å; L283-D287 HydrophobicContact CD2-CB 4.09Å; G284-D287 PolarHBondContact N-OD2 2.75Å; G284-D287 WeakPolarHBondContact O-CB 3.06Å; G284-D287 PolarHBondContact O-N 3.43Å; P285-D287 VanDerWaalsContact C-N 3.3Å; P285-D287 PolarHBondContact O-N 2.64Å; D287-A289 VanDerWaalsContact C-N 3.29Å; D287-A289 PolarHBondContact O-N 2.87Å; D287-A290 PolarHBondContact O-N 2.85Å; D287-R291 WeakPolarHBondContact O-CB 3.17Å; D287-R291 VanDerWaalsContact O-CG 3.22Å; D287-R291 WeakPolarHBondContact O-CG 3.43Å; D287-R291 PolarHBondContact O-N 3.01Å; D287-R291 IonicContact OD1-CZ 2.7Å; D287-R291 VanDerWaalsContact OD1-CZ 3.28Å; D287-R291 IonicContact OD1-NE 3Å; D287-R291 PolarHBondContact OD1-NE 3.03Å; D287-R291 IonicContact OD1-NH2 2.75Å; D287-R291 PolarHBondContact OD1-NH2 3.28Å; D287-R291 IonicContact OD2-NH2 3.8Å |
| 288 | L | 90.2 | Very high | 92.7 | Very high | 9 Ų | 9 | 39.3 Ų | 39.3 | 5% | 0.047 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -63.6 | -37.6 | 176.2 | -62.7 | 178 | 0 | 0 | 0 | 111.7 | Y215 G284 P285 P286 L317 I318 L321 | Y215-L288 HydrophobicContact CD1-CD1 3.71Å; Y215-L288 HydrophobicContact CD2-CD1 4.02Å; Y215-L288 HydrophobicContact CD2-CD2 3.98Å; Y215-L288 HydrophobicContact CD2-CG 4.49Å; Y215-L288 HydrophobicContact CE1-CD1 3.62Å; Y215-L288 HydrophobicContact CE2-CD1 3.95Å; Y215-L288 HydrophobicContact CE2-CD2 4.06Å; Y215-L288 HydrophobicContact CE2-CG 4.27Å; Y215-L288 HydrophobicContact CG-CD1 3.9Å; Y215-L288 HydrophobicContact CG-CD2 4.49Å; G284-L288 PolarHBondContact O-N 2.84Å; P285-L288 WeakPolarHBondContact O-CB 3.31Å; P285-L288 PolarHBondContact O-N 3.15Å; P286-L288 VanDerWaalsContact C-N 3.29Å; P286-L288 PolarHBondContact O-N 2.85Å; L288-L317 HydrophobicContact CD2-CB 4.26Å; L288-L317 HydrophobicContact CD2-CD1 3.99Å; L288-L317 WeakPolarHBondContact O-CB 3.2Å; L288-I318 PolarHBondContact O-N 2.88Å; L288-L321 HydrophobicContact CD1-CD1 3.69Å; L288-L321 HydrophobicContact CD2-CD1 3.93Å; L288-L321 HydrophobicContact CG-CD1 4.29Å |
| 289 | A | 89.9 | Confident | 92.4 | Very high | 68 Ų | 68 | 40.2 Ų | 40.2 | 56% | 0.562 | 25% | 0.25 | S | C | * | . | H | α-helix | trans | -75.3 | -35.6 | 176 | 0 | 0 | 0 | 0 | 0 | 112.4 | P286 D287 I318 | P286-A289 PolarHBondContact O-N 3.14Å; D287-A289 VanDerWaalsContact C-N 3.29Å; D287-A289 PolarHBondContact O-N 2.87Å; A289-I318 HydrophobicContact CB-CG2 4.34Å |
| 290 | A | 91.9 | Very high | 92.2 | Very high | 73 Ų | 73 | 39.7 Ų | 39.7 | 60% | 0.603 | 25% | 0.245 | S | C | * | . | H | α-helix | trans | -85 | -17.6 | -175.4 | 0 | 0 | 0 | 0 | 0 | 114.5 | P286 D287 | P286-A290 WeakPolarHBondContact O-CB 3.48Å; P286-A290 PolarHBondContact O-N 3.48Å; D287-A290 PolarHBondContact O-N 2.85Å |
| 291 | R | 93.4 | Very high | 91.8 | Very high | 23 Ų | 23 | 40.8 Ų | 40.8 | 9% | 0.087 | 26% | 0.256 | C | S | . | . | trans | -111.8 | 151.2 | -172.5 | -59 | -179.2 | -167.6 | -161.8 | 10 | 113.5 | Q253 D287 L317 | Q253-R291 CarbonylContact O-C 3.58Å; Q253-R291 WeakPolarHBondContact O-CA 2.88Å; Q253-R291 WeakPolarHBondContact O-CB 3.13Å; D287-R291 WeakPolarHBondContact O-CB 3.17Å; D287-R291 VanDerWaalsContact O-CG 3.22Å; D287-R291 WeakPolarHBondContact O-CG 3.43Å; D287-R291 PolarHBondContact O-N 3.01Å; D287-R291 IonicContact OD1-CZ 2.7Å; D287-R291 VanDerWaalsContact OD1-CZ 3.28Å; D287-R291 IonicContact OD1-NE 3Å; D287-R291 PolarHBondContact OD1-NE 3.03Å; D287-R291 IonicContact OD1-NH2 2.75Å; D287-R291 PolarHBondContact OD1-NH2 3.28Å; D287-R291 IonicContact OD2-NH2 3.8Å; R291-L317 HydrophobicContact CB-CD1 3.92Å; R291-L317 HydrophobicContact CB-CG 4.42Å; R291-L317 WeakPolarHBondContact O-CG 3.45Å; R291-L317 PolarHBondContact O-N 2.88Å | ||
| 292 | S | 95.6 | Very high | 91.3 | Very high | 17 Ų | 17 | 39.3 Ų | 39.3 | 12% | 0.119 | 26% | 0.255 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -117.2 | 148.2 | 172.9 | 59.2 | 0 | 0 | 0 | 0 | 111.2 | L252 Q253 E314 T315 | L252-S292 CarbonylContact C-O 3.43Å; L252-S292 WeakPolarHBondContact CA-O 3.36Å; Q253-S292 VanDerWaalsContact CB-OG 3.29Å; Q253-S292 WeakPolarHBondContact CB-OG 3.28Å; Q253-S292 PolarHBondContact N-O 2.79Å; Q253-S292 PolarHBondContact O-N 3.13Å; S292-E314 PolarHBondContact OG-OE1 3.44Å; S292-T315 CarbonylContact C-O 3.59Å; S292-T315 WeakPolarHBondContact CA-O 3.4Å |
| 293 | L | 96.4 | Very high | 91 | Very high | 0 Ų | 0 | 40.2 Ų | 40.2 | 0% | 0 | 26% | 0.264 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -88.4 | 121.4 | 165.6 | 178.9 | 68.9 | 0 | 0 | 0 | 108.4 | L211 L224 L250 L252 E314 T315 L317 L320 | L211-L293 HydrophobicContact CD1-CD2 3.62Å; L224-L293 HydrophobicContact CD1-CD1 3.75Å; L224-L293 HydrophobicContact CD1-CD2 3.91Å; L224-L293 HydrophobicContact CD1-CG 4.42Å; L224-L293 HydrophobicContact CD2-CD2 3.79Å; L250-L293 HydrophobicContact CB-CD1 4.25Å; L250-L293 HydrophobicContact CD2-CD1 4.47Å; L252-L293 HydrophobicContact CD2-CD1 4.2Å; L293-E314 WeakPolarHBondContact O-CA 3.47Å; L293-T315 PolarHBondContact N-O 3.49Å; L293-T315 PolarHBondContact O-N 3.19Å; L293-L317 HydrophobicContact CB-CD2 3.9Å; L293-L320 HydrophobicContact CB-CD1 3.7Å; L293-L320 HydrophobicContact CD2-CD1 3.55Å; L293-L320 HydrophobicContact CG-CD1 4.28Å |
| 294 | R | 96.5 | Very high | 90.7 | Very high | 48 Ų | 48 | 48.9 Ų | 48.9 | 18% | 0.181 | 31% | 0.31 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -103.5 | 121.4 | 166.4 | -171.9 | 172.1 | -179.7 | -177.5 | 10.8 | 110.7 | R251 Q253 K296 E312 C313 E314 | R251-R294 PolarHBondContact N-O 3.28Å; R251-R294 PolarHBondContact O-N 3.26Å; Q253-R294 VanDerWaalsContact OE1-NH1 3.11Å; R294-K296 VanDerWaalsContact CZ-CE 3.49Å; R294-E312 IonicContact CZ-OE1 2.62Å; R294-E312 IonicContact CZ-OE2 3.28Å; R294-E312 IonicContact NE-OE1 3.14Å; R294-E312 IonicContact NE-OE2 3.89Å; R294-E312 VanDerWaalsContact NH2-CD 3.32Å; R294-E312 IonicContact NH2-OE1 3.57Å; R294-E312 PolarHBondContact NH2-OE1 3.42Å; R294-E312 IonicContact NH2-OE2 2.89Å; R294-E312 PolarHBondContact NH2-OE2 3.18Å; R294-C313 WeakPolarHBondContact CA-O 3.12Å; R294-E314 HydrophobicContact CB-CG 4.42Å; R294-E314 HydrophobicContact CG-CB 4.48Å |
| 295 | A | 96.9 | Very high | 90.5 | Very high | 1 Ų | 1 | 55.2 Ų | 55.2 | 1% | 0.008 | 33% | 0.327 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -107.9 | 136.2 | 173.3 | 0 | 0 | 0 | 0 | 0 | 110.2 | L209 V248 V249 L250 E312 C313 | L209-A295 HydrophobicContact CD2-CB 3.48Å; L209-A295 VanDerWaalsContact CD2-CB 3.48Å; V248-A295 HydrophobicContact CG1-CB 4.35Å; V249-A295 CarbonylContact O-C 3.56Å; V249-A295 WeakPolarHBondContact O-CA 3.25Å; L250-A295 HydrophobicContact CD2-CB 3.5Å; L250-A295 VanDerWaalsContact CD2-CB 3.5Å; A295-E312 VanDerWaalsContact O-CA 3.24Å; A295-E312 WeakPolarHBondContact O-CA 3.39Å; A295-E312 WeakPolarHBondContact O-CB 3.41Å; A295-C313 PolarHBondContact N-O 2.83Å; A295-C313 PolarHBondContact O-N 2.85Å |
| 296 | K | 96.3 | Very high | 90.5 | Very high | 41 Ų | 41 | 61.7 Ų | 61.7 | 18% | 0.178 | 34% | 0.34 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -124.9 | 124.9 | 172.3 | -56.8 | -156.9 | -173.7 | -139.9 | 0 | 110.2 | V248 V249 R251 R294 L309 E312 | V248-K296 CarbonylContact C-O 3.56Å; V248-K296 WeakPolarHBondContact CA-O 2.95Å; V249-K296 HydrophobicContact CB-CB 4.48Å; V249-K296 PolarHBondContact N-O 3.07Å; V249-K296 PolarHBondContact O-N 3.01Å; R251-K296 VanDerWaalsContact NH2-CD 3.26Å; R251-K296 VanDerWaalsContact NH2-CE 3.31Å; R294-K296 VanDerWaalsContact CZ-CE 3.49Å; K296-L309 HydrophobicContact CB-CD1 4Å; K296-L309 HydrophobicContact CD-CD1 4.25Å; K296-L309 HydrophobicContact CG-CD1 4.5Å; K296-E312 WeakPolarHBondContact CD-OE2 3.42Å; K296-E312 WeakPolarHBondContact CE-OE2 3.17Å; K296-E312 HydrophobicContact CG-CB 4.07Å; K296-E312 IonicContact NZ-OE2 3.01Å; K296-E312 PolarHBondContact NZ-OE2 2.95Å |
| 297 | V | 95.5 | Very high | 90.5 | Very high | 0 Ų | 0 | 60 Ų | 60 | 0% | 0 | 33% | 0.326 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -96.7 | 122.5 | 176 | -171.5 | 0 | 0 | 0 | 0 | 108.8 | L202 L209 L232 C246 V248 L310 G311 | L202-V297 HydrophobicContact CD1-CB 4.4Å; L202-V297 HydrophobicContact CD1-CG2 3.63Å; L202-V297 HydrophobicContact CD2-CG2 3.89Å; L202-V297 HydrophobicContact CG-CG2 4.44Å; L209-V297 HydrophobicContact CD1-CG2 4.37Å; L232-V297 HydrophobicContact CD1-CG1 3.76Å; L232-V297 HydrophobicContact CD2-CG1 3.93Å; C246-V297 WeakPolarHBondContact SG-CG1 3.46Å; V248-V297 HydrophobicContact CG1-CG2 4.48Å; V248-V297 HydrophobicContact CG2-CG1 4.44Å; V248-V297 HydrophobicContact CG2-CG2 4.14Å; V297-L310 HydrophobicContact CB-CB 4.39Å; V297-L310 HydrophobicContact CG1-CB 4.25Å; V297-L310 HydrophobicContact CG1-CD1 4.25Å; V297-L310 PolarHBondContact O-N 3.02Å; V297-G311 PolarHBondContact N-O 3.05Å; V297-G311 PolarHBondContact O-N 3.04Å |
| 298 | L | 93.3 | Very high | 90.5 | Very high | 28 Ų | 28 | 60.9 Ų | 60.9 | 15% | 0.147 | 33% | 0.332 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -121.1 | 133.1 | -174.3 | -55.8 | 176.6 | 0 | 0 | 0 | 110.2 | C246 C247 V249 V308 L309 | C246-L298 CarbonylContact C-O 3.52Å; C246-L298 WeakPolarHBondContact CA-O 3.35Å; C247-L298 PolarHBondContact N-O 3.2Å; C247-L298 PolarHBondContact O-N 3.38Å; V249-L298 HydrophobicContact CG2-CD1 3.78Å; L298-V308 CarbonylContact C-O 3.58Å; L298-V308 WeakPolarHBondContact CA-O 3.3Å; L298-L309 HydrophobicContact CD2-CB 4.24Å; L298-L309 HydrophobicContact CD2-CD1 3.72Å |
| 299 | D | 91.1 | Very high | 90.6 | Very high | 26 Ų | 26 | 63.5 Ų | 63.5 | 14% | 0.139 | 35% | 0.346 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -85.8 | 119.5 | 162 | -173.8 | 16.9 | 0 | 0 | 0 | 108.5 | D307 V308 L310 | D299-D307 CarbonylContact O-C 3.58Å; D299-D307 VanDerWaalsContact O-CA 3.32Å; D299-D307 WeakPolarHBondContact O-CA 3.1Å; D299-V308 HydrophobicContact CB-CB 4.4Å; D299-V308 PolarHBondContact N-O 2.79Å; D299-V308 PolarHBondContact O-N 3.24Å; D299-L310 HydrophobicContact CB-CD1 4.02Å; D299-L310 HydrophobicContact CB-CD2 3.83Å; D299-L310 HydrophobicContact CB-CG 3.92Å |
| 300 | R | 89.8 | Confident | 90.7 | Very high | 76 Ų | 76 | 60.7 Ų | 60.7 | 29% | 0.287 | 32% | 0.321 | S | S | . | . | P | Polyproline II helix | trans | -69.8 | 133.1 | -178.5 | -70.8 | -69.2 | -144.4 | 155 | 7.6 | 109.6 | G244 G245 R262 V265 D307 | G244-R300 WeakPolarHBondContact CA-O 3.43Å; G244-R300 PolarHBondContact N-O 2.75Å; G244-R300 WeakPolarHBondContact O-CB 3.23Å; G245-R300 VanDerWaalsContact O-CB 3.27Å; G245-R300 WeakPolarHBondContact O-CB 3.36Å; G245-R300 VanDerWaalsContact O-CG 3.3Å; G245-R300 WeakPolarHBondContact O-CG 3.5Å; G245-R300 PolarHBondContact O-N 2.89Å; R262-R300 VanDerWaalsContact CZ-NE 3.3Å; R262-R300 VanDerWaalsContact NH2-NH1 3.1Å; V265-R300 HydrophobicContact CG1-CG 3.86Å; V265-R300 HydrophobicContact CG2-CG 3.97Å; R300-D307 WeakPolarHBondContact CA-OD1 3.3Å; R300-D307 WeakPolarHBondContact CD-OD1 3.14Å; R300-D307 IonicContact NH1-OD1 3.25Å; R300-D307 IonicContact NH1-OD2 3.92Å; R300-D307 PolarHBondContact NH1-OD2 2.86Å |
| 301 | G | 84.8 | Confident | 90.8 | Very high | 23 Ų | 23 | 57.2 Ų | 57.2 | 24% | 0.237 | 29% | 0.293 | C | S | . | . | P | Polyproline II helix | trans | -67.7 | 138.6 | 168.6 | 0 | 0 | 0 | 0 | 0 | 110.9 | R305 D307 | G301-R305 WeakPolarHBondContact CA-O 3.27Å; G301-D307 PolarHBondContact N-OD1 3.03Å |
| 302 | V | 82.4 | Confident | 91 | Very high | 82 Ų | 82 | 58.7 Ų | 58.7 | 50% | 0.497 | 30% | 0.301 | S | S | . | . | S | Bend | trans | -77.8 | 131 | 167 | -177.1 | 0 | 0 | 0 | 0 | 108.9 | G242 G244 L304 R305 | G242-V302 WeakPolarHBondContact O-CG2 3.41Å; G244-V302 VanDerWaalsContact CA-CG2 3.45Å; V302-L304 PolarHBondContact O-N 2.99Å; V302-R305 WeakPolarHBondContact O-CB 3.14Å; V302-R305 WeakPolarHBondContact O-CG 3.47Å; V302-R305 PolarHBondContact O-N 2.96Å |
| 303 | G | 82.2 | Confident | 91 | Very high | 77 Ų | 77 | 58.6 Ų | 58.6 | 79% | 0.794 | 30% | 0.3 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 66.8 | -121.3 | 179.4 | 0 | 0 | 0 | 0 | 0 | 112.7 | R305 | G303-R305 VanDerWaalsContact C-N 3.34Š|
| 304 | L | 81.8 | Confident | 91 | Very high | 183 Ų | 183 | 63.2 Ų | 63.2 | 96% | 0.958 | 32% | 0.321 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -89.5 | 3.9 | -179.4 | -64.7 | 171.5 | 0 | 0 | 0 | 113.6 | V302 | V302-L304 PolarHBondContact O-N 2.99Š|
| 305 | R | 84.8 | Confident | 91 | Very high | 153 Ų | 153 | 62 Ų | 62 | 58% | 0.577 | 32% | 0.32 | S | S | * | . | P | Polyproline II helix | trans | -69.1 | 144.1 | 179 | -62.2 | -177.6 | 95.4 | -167.1 | 7.1 | 109.8 | S241 G301 V302 G303 | S241-R305 PolarHBondContact OG-NH1 3.22Å; G301-R305 WeakPolarHBondContact CA-O 3.27Å; V302-R305 WeakPolarHBondContact O-CB 3.14Å; V302-R305 WeakPolarHBondContact O-CG 3.47Å; V302-R305 PolarHBondContact O-N 2.96Å; G303-R305 VanDerWaalsContact C-N 3.34Å |
| 306 | R | 88.5 | Confident | 91 | Very high | 229 Ų | 229 | 64.9 Ų | 64.9 | 86% | 0.864 | 34% | 0.338 | S | S | * | . | P | Polyproline II helix | trans | -71.9 | 147 | 176.1 | -65.3 | -178.5 | 178.6 | 170.3 | -0.2 | 110.4 | ||
| 307 | D | 89.9 | Confident | 90.9 | Very high | 62 Ų | 62 | 63 Ų | 63 | 33% | 0.332 | 33% | 0.33 | S | S | . | . | P | Polyproline II helix | trans | -61.9 | 135.7 | 169 | -69.7 | -5.6 | 0 | 0 | 0 | 109.4 | R262 D299 R300 G301 | R262-D307 IonicContact CZ-OD2 3.81Å; R262-D307 IonicContact NH1-OD2 3.92Å; R262-D307 IonicContact NH2-OD2 3.82Å; R262-D307 PolarHBondContact NH2-OD2 3.22Å; D299-D307 CarbonylContact O-C 3.58Å; D299-D307 VanDerWaalsContact O-CA 3.32Å; D299-D307 WeakPolarHBondContact O-CA 3.1Å; R300-D307 WeakPolarHBondContact CA-OD1 3.3Å; R300-D307 WeakPolarHBondContact CD-OD1 3.14Å; R300-D307 IonicContact NH1-OD1 3.25Å; R300-D307 IonicContact NH1-OD2 3.92Å; R300-D307 PolarHBondContact NH1-OD2 2.86Å; G301-D307 PolarHBondContact N-OD1 3.03Å |
| 308 | V | 90.3 | Very high | 90.8 | Very high | 60 Ų | 60 | 67.6 Ų | 67.6 | 36% | 0.364 | 35% | 0.354 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -105 | 128.3 | 179.8 | 179.2 | 0 | 0 | 0 | 0 | 109.3 | L298 D299 L310 | L298-V308 CarbonylContact C-O 3.58Å; L298-V308 WeakPolarHBondContact CA-O 3.3Å; D299-V308 HydrophobicContact CB-CB 4.4Å; D299-V308 PolarHBondContact N-O 2.79Å; D299-V308 PolarHBondContact O-N 3.24Å; V308-L310 PolarHBondContact O-N 2.77Å |
| 309 | L | 92.3 | Very high | 90.8 | Very high | 64 Ų | 64 | 68.3 Ų | 68.3 | 34% | 0.335 | 36% | 0.363 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -71 | 116.7 | 173.6 | -177.3 | 68 | 0 | 0 | 0 | 109.9 | K296 L298 G311 E312 | K296-L309 HydrophobicContact CB-CD1 4Å; K296-L309 HydrophobicContact CD-CD1 4.25Å; K296-L309 HydrophobicContact CG-CD1 4.5Å; L298-L309 HydrophobicContact CD2-CB 4.24Å; L298-L309 HydrophobicContact CD2-CD1 3.72Å; L309-G311 WeakPolarHBondContact CD1-O 3.29Å; L309-E312 HydrophobicContact CD1-CB 4.47Å; L309-E312 HydrophobicContact CD2-CG 4.46Å |
| 310 | L | 91.5 | Very high | 91 | Very high | 8 Ų | 8 | 67.2 Ų | 67.2 | 4% | 0.042 | 36% | 0.357 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -83.7 | -40.4 | 173.8 | -61.8 | -173.3 | 0 | 0 | 0 | 111 | R205 L232 P233 P235 V297 D299 V308 | R205-L310 WeakPolarHBondContact CB-O 3.34Å; L232-L310 HydrophobicContact CB-CD1 4.45Å; L232-L310 HydrophobicContact CD1-CD1 4.22Å; P233-L310 WeakPolarHBondContact O-CD2 3.22Å; P235-L310 HydrophobicContact CG-CD2 4.5Å; V297-L310 HydrophobicContact CB-CB 4.39Å; V297-L310 HydrophobicContact CG1-CB 4.25Å; V297-L310 HydrophobicContact CG1-CD1 4.25Å; V297-L310 PolarHBondContact O-N 3.02Å; D299-L310 HydrophobicContact CB-CD1 4.02Å; D299-L310 HydrophobicContact CB-CD2 3.83Å; D299-L310 HydrophobicContact CB-CG 3.92Å; V308-L310 PolarHBondContact O-N 2.77Å |
| 311 | G | 94.2 | Very high | 91.1 | Very high | 0 Ų | 0 | 64.1 Ų | 64.1 | 0% | 0 | 35% | 0.347 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -174.6 | 161.4 | 176 | 0 | 0 | 0 | 0 | 0 | 112.1 | E203 V297 L309 | E203-G311 CarbonylContact O-C 3.53Å; E203-G311 WeakPolarHBondContact O-CA 3.27Å; V297-G311 PolarHBondContact N-O 3.05Å; V297-G311 PolarHBondContact O-N 3.04Å; L309-G311 WeakPolarHBondContact CD1-O 3.29Å |
| 312 | E | 96.2 | Very high | 91.2 | Very high | 54 Ų | 54 | 64.3 Ų | 64.3 | 25% | 0.252 | 34% | 0.343 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -136.2 | 155.1 | 172.6 | 60.8 | 176.9 | -142.5 | 0 | 0 | 111.6 | E203 R294 A295 K296 L309 | E203-E312 PolarHBondContact N-O 2.85Å; E203-E312 PolarHBondContact O-N 3.48Å; R294-E312 IonicContact CZ-OE1 2.62Å; R294-E312 IonicContact CZ-OE2 3.28Å; R294-E312 IonicContact NE-OE1 3.14Å; R294-E312 IonicContact NE-OE2 3.89Å; R294-E312 VanDerWaalsContact NH2-CD 3.32Å; R294-E312 IonicContact NH2-OE1 3.57Å; R294-E312 PolarHBondContact NH2-OE1 3.42Å; R294-E312 IonicContact NH2-OE2 2.89Å; R294-E312 PolarHBondContact NH2-OE2 3.18Å; A295-E312 VanDerWaalsContact O-CA 3.24Å; A295-E312 WeakPolarHBondContact O-CA 3.39Å; A295-E312 WeakPolarHBondContact O-CB 3.41Å; K296-E312 WeakPolarHBondContact CD-OE2 3.42Å; K296-E312 WeakPolarHBondContact CE-OE2 3.17Å; K296-E312 HydrophobicContact CG-CB 4.07Å; K296-E312 IonicContact NZ-OE2 3.01Å; K296-E312 PolarHBondContact NZ-OE2 2.95Å; L309-E312 HydrophobicContact CD1-CB 4.47Å; L309-E312 HydrophobicContact CD2-CG 4.46Å |
| 313 | C | 96.6 | Very high | 90.9 | Very high | 15 Ų | 15 | 65 Ų | 65 | 10% | 0.101 | 35% | 0.35 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -142.9 | 152.9 | 171 | 64.1 | 0 | 0 | 0 | 0 | 109.9 | L200 R201 L202 R294 A295 | L200-C313 HydrophobicContact CB-CB 4.48Å; R201-C313 VanDerWaalsContact O-CB 3.25Å; R201-C313 WeakPolarHBondContact O-CB 3.35Å; L202-C313 HydrophobicContact CD2-CB 4.19Å; R294-C313 WeakPolarHBondContact CA-O 3.12Å; A295-C313 PolarHBondContact N-O 2.83Å; A295-C313 PolarHBondContact O-N 2.85Å |
| 314 | E | 96.9 | Very high | 90.1 | Very high | 97 Ų | 97 | 69 Ų | 69 | 45% | 0.453 | 35% | 0.352 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -133.3 | 122.9 | 174.7 | -174.4 | 166 | 168.3 | 0 | 0 | 108.9 | Q253 S292 L293 R294 | Q253-E314 PolarHBondContact NE2-OE1 3Å; Q253-E314 PolarHBondContact NE2-OE2 3.37Å; S292-E314 PolarHBondContact OG-OE1 3.44Å; L293-E314 WeakPolarHBondContact O-CA 3.47Å; R294-E314 HydrophobicContact CB-CG 4.42Å; R294-E314 HydrophobicContact CG-CB 4.48Å |
| 315 | T | 96.6 | Very high | 88.5 | Confident | 24 Ų | 24 | 66.5 Ų | 66.5 | 15% | 0.147 | 35% | 0.345 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -134 | 132 | -174.5 | -52.1 | 0 | 0 | 0 | 0 | 109.7 | L200 S292 L293 A319 L320 | L200-T315 HydrophobicContact CD2-CG2 4.07Å; L200-T315 WeakPolarHBondContact CD2-OG1 3.26Å; S292-T315 CarbonylContact C-O 3.59Å; S292-T315 WeakPolarHBondContact CA-O 3.4Å; L293-T315 PolarHBondContact N-O 3.49Å; L293-T315 PolarHBondContact O-N 3.19Å; T315-A319 HydrophobicContact CG2-CB 4.12Å; T315-L320 HydrophobicContact CG2-CD2 3.71Å; T315-L320 HydrophobicContact CG2-CG 3.89Å |
| 316 | P | 96 | Very high | 87 | Confident | 60 Ų | 60 | 62.3 Ų | 62.3 | 39% | 0.39 | 35% | 0.349 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -63 | 142.4 | 176.8 | 26.5 | -33.4 | 0 | 0 | 0 | 111 | I318 A319 L320 | P316-I318 VanDerWaalsContact C-N 3.27Å; P316-I318 HydrophobicContact CB-CG1 3.92Å; P316-I318 HydrophobicContact CG-CG1 4.42Å; P316-I318 PolarHBondContact O-N 3.23Å; P316-A319 HydrophobicContact CG-CB 3.83Å; P316-A319 PolarHBondContact O-N 3.4Å; P316-L320 PolarHBondContact O-N 3.14Å |
| 317 | L | 94.3 | Very high | 84.8 | Confident | 1 Ų | 1 | 56.8 Ų | 56.8 | 1% | 0.005 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -62 | -35.8 | -175.9 | -66.8 | -177.9 | 0 | 0 | 0 | 112.2 | L222 L252 L283 L288 R291 L293 A319 L320 L321 | L222-L317 HydrophobicContact CD2-CD1 4.22Å; L222-L317 HydrophobicContact CD2-CD2 3.72Å; L252-L317 HydrophobicContact CD2-CD1 4.07Å; L252-L317 HydrophobicContact CD2-CD2 3.89Å; L252-L317 HydrophobicContact CD2-CG 4.39Å; L283-L317 HydrophobicContact CD1-CD1 4.37Å; L288-L317 HydrophobicContact CD2-CB 4.26Å; L288-L317 HydrophobicContact CD2-CD1 3.99Å; L288-L317 WeakPolarHBondContact O-CB 3.2Å; R291-L317 HydrophobicContact CB-CD1 3.92Å; R291-L317 HydrophobicContact CB-CG 4.42Å; R291-L317 WeakPolarHBondContact O-CG 3.45Å; R291-L317 PolarHBondContact O-N 2.88Å; L293-L317 HydrophobicContact CB-CD2 3.9Å; L317-A319 PolarHBondContact O-N 2.94Å; L317-L320 HydrophobicContact CD2-CD1 4.25Å; L317-L320 WeakPolarHBondContact O-CB 3.32Å; L317-L320 PolarHBondContact O-N 2.95Å; L317-L321 WeakPolarHBondContact O-CG 3.46Å; L317-L321 PolarHBondContact O-N 3.3Å |
| 318 | I | 93 | Very high | 82.7 | Confident | 98 Ų | 98 | 60.5 Ų | 60.5 | 50% | 0.503 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -56 | -32.2 | 173.2 | 49.8 | 159.3 | 0 | 0 | 0 | 113.7 | L288 A289 P316 L320 | L288-I318 PolarHBondContact O-N 2.88Å; A289-I318 HydrophobicContact CB-CG2 4.34Å; P316-I318 VanDerWaalsContact C-N 3.27Å; P316-I318 HydrophobicContact CB-CG1 3.92Å; P316-I318 HydrophobicContact CG-CG1 4.42Å; P316-I318 PolarHBondContact O-N 3.23Å; I318-L320 VanDerWaalsContact C-N 3.35Å |
| 319 | A | 93.9 | Very high | 80.5 | Confident | 43 Ų | 43 | 61 Ų | 61 | 36% | 0.355 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -81.7 | -19 | 179.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | K196 T315 P316 L317 | K196-A319 WeakPolarHBondContact CE-O 3.15Å; K196-A319 PolarHBondContact NZ-O 2.89Å; T315-A319 HydrophobicContact CG2-CB 4.12Å; P316-A319 HydrophobicContact CG-CB 3.83Å; P316-A319 PolarHBondContact O-N 3.4Å; L317-A319 PolarHBondContact O-N 2.94Å |
| 320 | L | 94.3 | Very high | 78.2 | Confident | 2 Ų | 2 | 62.6 Ų | 62.6 | 1% | 0.01 | 40% | 0.402 | C | S | . | . | H | α-helix | trans | -84.6 | -19.2 | 176.6 | -66 | 179.6 | 0 | 0 | 0 | 112.8 | K196 L200 T213 L293 T315 P316 L317 I318 | K196-L320 WeakPolarHBondContact CB-O 3.29Å; K196-L320 WeakPolarHBondContact CD-O 3.35Å; K196-L320 WeakPolarHBondContact CG-O 3.13Å; L200-L320 HydrophobicContact CD1-CD2 4.15Å; L200-L320 HydrophobicContact CD2-CD2 3.84Å; L200-L320 HydrophobicContact CG-CD2 4.43Å; T213-L320 HydrophobicContact CG2-CB 3.88Å; T213-L320 VanDerWaalsContact OG1-C 3.29Å; T213-L320 PolarHBondContact OG1-O 3.04Å; L293-L320 HydrophobicContact CB-CD1 3.7Å; L293-L320 HydrophobicContact CD2-CD1 3.55Å; L293-L320 HydrophobicContact CG-CD1 4.28Å; T315-L320 HydrophobicContact CG2-CD2 3.71Å; T315-L320 HydrophobicContact CG2-CG 3.89Å; P316-L320 PolarHBondContact O-N 3.14Å; L317-L320 HydrophobicContact CD2-CD1 4.25Å; L317-L320 WeakPolarHBondContact O-CB 3.32Å; L317-L320 PolarHBondContact O-N 2.95Å; I318-L320 VanDerWaalsContact C-N 3.35Å |
| 321 | L | 92.1 | Very high | 75.8 | Confident | 12 Ų | 12 | 67.8 Ų | 67.8 | 6% | 0.063 | 44% | 0.439 | C | S | . | . | S | Bend | trans | -93.2 | 155.4 | -179 | -66.8 | 171.5 | 0 | 0 | 0 | 112 | K196 Y215 L222 L288 L317 | K196-L321 WeakPolarHBondContact CD-O 3.3Å; K196-L321 PolarHBondContact NZ-O 3.06Å; Y215-L321 HydrophobicContact CG-CD1 4.4Å; L222-L321 HydrophobicContact CD1-CD2 3.85Å; L288-L321 HydrophobicContact CD1-CD1 3.69Å; L288-L321 HydrophobicContact CD2-CD1 3.93Å; L288-L321 HydrophobicContact CG-CD1 4.29Å; L317-L321 WeakPolarHBondContact O-CG 3.46Å; L317-L321 PolarHBondContact O-N 3.3Å |
| 322 | P | 87.3 | Confident | 73.5 | Confident | 26 Ų | 26 | 75.7 Ų | 75.7 | 17% | 0.169 | 48% | 0.48 | C | S | . | . | P | Polyproline II helix | trans | -52.3 | 145.7 | 168.8 | -19.7 | 28.6 | 0 | 0 | 0 | 110.3 | P194 K196 L324 | P194-P322 HydrophobicContact CB-CB 4.04Å; P194-P322 HydrophobicContact CB-CG 3.63Å; P194-P322 HydrophobicContact CG-CB 4.47Å; P194-P322 HydrophobicContact CG-CG 4.04Å; P194-P322 WeakPolarHBondContact O-CG 3.35Å; K196-P322 HydrophobicContact CB-CG 3.95Å; P322-L324 PolarHBondContact O-N 3.06Å |
| 323 | P | 76.6 | Confident | 71 | Confident | 97 Ų | 97 | 76.7 Ų | 76.7 | 63% | 0.63 | 50% | 0.497 | S | S | * | . | P | Polyproline II helix | trans | -57.7 | 128.9 | 176.1 | 26.8 | -33.3 | 0 | 0 | 0 | 108.4 | T325 | P323-T325 HydrophobicContact CB-CG2 4.27Å; P323-T325 PolarHBondContact O-N 3.39Å |
| 324 | L | 64.9 | Low | 68.6 | Low | 161 Ų | 161 | 81.4 Ų | 81.4 | 84% | 0.843 | 53% | 0.528 | S | S | * | . | trans | -73 | 64.1 | 173.4 | -62 | 171.7 | 0 | 0 | 0 | 108 | P322 G326 | P322-L324 PolarHBondContact O-N 3.06Å; L324-G326 VanDerWaalsContact C-N 3.26Å; L324-G326 PolarHBondContact O-N 3.15Å | ||
| 325 | T | 49.6 | Very low | 66.2 | Low | 131 Ų | 131 | 81.3 Ų | 81.3 | 80% | 0.804 | 54% | 0.544 | S | S | * | . | trans | -73.7 | 87.2 | 174.4 | 39.6 | 0 | 0 | 0 | 0 | 108.2 | P323 | P323-T325 HydrophobicContact CB-CG2 4.27Å; P323-T325 PolarHBondContact O-N 3.39Å | ||
| 326 | G | 51.3 | Low | 64 | Low | 65 Ų | 65 | 88.8 Ų | 88.8 | 67% | 0.67 | 58% | 0.577 | S | S | * | * | trans | -128.2 | 40.9 | 175.1 | 0 | 0 | 0 | 0 | 0 | 111.9 | L324 | L324-G326 VanDerWaalsContact C-N 3.26Å; L324-G326 PolarHBondContact O-N 3.15Å | ||
| 327 | V | 42.7 | Very low | 61.9 | Low | 113 Ų | 113 | 94.1 Ų | 94.1 | 69% | 0.685 | 60% | 0.601 | S | S | * | * | trans | -150.6 | 106.7 | 153 | -165.2 | 0 | 0 | 0 | 0 | 108.7 | G329 | V327-G329 PolarHBondContact O-N 3.23Å; V327-G329 VanDerWaalsContact O-N 3.09Å | ||
| 328 | P | 45.8 | Very low | 59.7 | Low | 140 Ų | 140 | 99.3 Ų | 99.3 | 91% | 0.909 | 64% | 0.637 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71.5 | 95.5 | 161.1 | 28.3 | -27.7 | 0 | 0 | 0 | 107.4 | ||
| 329 | G | 44.3 | Very low | 57.6 | Low | 70 Ų | 70 | 106.5 Ų | 106.5 | 72% | 0.722 | 68% | 0.675 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 172.2 | -0.7 | 179.5 | 0 | 0 | 0 | 0 | 0 | 119.8 | V327 | V327-G329 PolarHBondContact O-N 3.23Å; V327-G329 VanDerWaalsContact O-N 3.09Å |
| 330 | S | 44 | Very low | 55.8 | Low | 97 Ų | 97 | 109.7 Ų | 109.7 | 68% | 0.678 | 69% | 0.691 | S | S | * | * | trans | -124.1 | 67.4 | 172.8 | 47.9 | 0 | 0 | 0 | 0 | 111.6 | L332 | S330-L332 PolarHBondContact O-N 3.25Š| ||
| 331 | S | 41.7 | Very low | 53.8 | Low | 118 Ų | 118 | 115.3 Ų | 115.3 | 83% | 0.825 | 73% | 0.727 | S | S | * | * | trans | -69.2 | 88.9 | 153.8 | -178 | 0 | 0 | 0 | 0 | 107.7 | A333 | S331-A333 VanDerWaalsContact C-N 3.35Å; S331-A333 PolarHBondContact O-N 3.48Å | ||
| 332 | L | 46.5 | Very low | 51.6 | Low | 165 Ų | 165 | 121.1 Ų | 121.1 | 86% | 0.864 | 76% | 0.764 | S | S | * | * | trans | -83.9 | 90.6 | 160.5 | -92.2 | 159.2 | 0 | 0 | 0 | 106.8 | S330 | S330-L332 PolarHBondContact O-N 3.25Š| ||
| 333 | A | 41.9 | Very low | 49.5 | Very low | 75 Ų | 75 | 126.6 Ų | 126.6 | 62% | 0.62 | 80% | 0.799 | S | S | * | * | trans | -58.5 | 139.1 | 166.3 | 0 | 0 | 0 | 0 | 0 | 109.5 | S331 A335 | S331-A333 VanDerWaalsContact C-N 3.35Å; S331-A333 PolarHBondContact O-N 3.48Å; A333-A335 PolarHBondContact O-N 3.23Å | ||
| 334 | P | 48.2 | Very low | 47.8 | Very low | 115 Ų | 115 | 128.5 Ų | 128.5 | 75% | 0.747 | 81% | 0.81 | S | S | * | * | trans | -72.5 | 115.6 | 172.6 | 28.7 | -29.4 | 0 | 0 | 0 | 108.7 | H336 | P334-H336 PolarHBondContact O-N 3.24Š| ||
| 335 | A | 46.5 | Very low | 46.7 | Very low | 95 Ų | 95 | 126.3 Ų | 126.3 | 79% | 0.785 | 81% | 0.808 | S | S | * | * | trans | -64 | 117.5 | 169.3 | 0 | 0 | 0 | 0 | 0 | 108.7 | A333 L337 | A333-A335 PolarHBondContact O-N 3.23Å; A335-L337 PolarHBondContact O-N 3.12Å | ||
| 336 | H | 49 | Very low | 46.5 | Very low | 180 Ų | 180 | 126 Ų | 126 | 83% | 0.833 | 81% | 0.808 | S | S | * | * | trans | -56.2 | 113.6 | 165.2 | -80.1 | -103 | 0 | 0 | 0 | 108.9 | P334 S338 | P334-H336 PolarHBondContact O-N 3.24Å; H336-S338 PolarHBondContact O-N 3.4Å | ||
| 337 | L | 52.1 | Low | 46.1 | Very low | 173 Ų | 173 | 130.7 Ų | 130.7 | 91% | 0.906 | 82% | 0.818 | S | S | * | * | trans | -85.9 | 105.3 | 161.4 | -82.6 | 167.1 | 0 | 0 | 0 | 107.7 | A335 | A335-L337 PolarHBondContact O-N 3.12Š| ||
| 338 | S | 47.5 | Very low | 46.4 | Very low | 109 Ų | 109 | 132.2 Ų | 132.2 | 76% | 0.762 | 83% | 0.83 | S | S | * | * | trans | -71.4 | 133 | 161.2 | -37.4 | 0 | 0 | 0 | 0 | 108.9 | H336 | H336-S338 PolarHBondContact O-N 3.4Š| ||
| 339 | L | 49.7 | Very low | 46.5 | Very low | 249 Ų | 249 | 131.5 Ų | 131.5 | 100% | 1.304 | 82% | 0.822 | S | S | * | * | trans | -132.5 | 0 | 150.6 | -89.5 | 172.7 | 0 | 0 | 0 | 108.1 |
Retrieved 339 of 339 residues in 164.7 ms
(Link to these results)