| 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 | 44.4 | Very low | 43.3 | Very low | 243 Ų | 243 | 146.3 Ų | 146.3 | 100% | 1.197 | 84% | 0.842 | S | S | * | * | 0 | 172.9 | 0 | -76 | -178.3 | 174.8 | 0 | 0 | 108.9 | |||||
| 2 | I | 39.4 | Very low | 43.3 | Very low | 156 Ų | 156 | 145 Ų | 145 | 80% | 0.8 | 84% | 0.838 | S | S | * | * | trans | 83.7 | 79.3 | 177.9 | -45.9 | 175.7 | 0 | 0 | 0 | 114.9 | ||||
| 3 | L | 41.6 | Very low | 43.7 | Very low | 169 Ų | 169 | 142.8 Ų | 142.8 | 89% | 0.885 | 83% | 0.831 | S | S | * | * | 43.7 | 127.7 | 119.6 | -60.3 | 167.9 | 0 | 0 | 0 | 120 | |||||
| 4 | G | 39.3 | Very low | 43.4 | Very low | 71 Ų | 71 | 139 Ų | 139 | 73% | 0.732 | 83% | 0.825 | S | S | * | * | trans | -86.7 | -175.2 | 168 | 0 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 5 | S | 37.8 | Very low | 43.4 | Very low | 128 Ų | 128 | 143.4 Ų | 143.4 | 90% | 0.895 | 83% | 0.83 | S | S | * | * | trans | -151.4 | 140.4 | 172.1 | -79.3 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 6 | V | 47.7 | Very low | 43.4 | Very low | 138 Ų | 138 | 144.3 Ų | 144.3 | 84% | 0.836 | 83% | 0.83 | S | S | * | * | trans | -80.5 | 149.5 | 173.8 | 169.2 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 7 | N | 39.4 | Very low | 43.3 | Very low | 157 Ų | 157 | 149.2 Ų | 149.2 | 84% | 0.84 | 83% | 0.832 | S | S | * | * | trans | -148.6 | 122.6 | 160.8 | -137.5 | -67.2 | 0 | 0 | 0 | 116.3 | ||||
| 8 | R | 41.6 | Very low | 42.9 | Very low | 232 Ų | 232 | 149.8 Ų | 149.8 | 88% | 0.875 | 83% | 0.833 | S | S | * | * | trans | -151.8 | 153.6 | 154.3 | -99.9 | -168.5 | 176.6 | -143.4 | -0.2 | 103.2 | ||||
| 9 | P | 48.8 | Very low | 43.1 | Very low | 117 Ų | 117 | 147.2 Ų | 147.2 | 76% | 0.76 | 82% | 0.823 | S | S | * | * | cis | -153.7 | -159.3 | 46.1 | 39.2 | -15.4 | 0 | 0 | 0 | 116.1 | ||||
| 10 | A | 37.6 | Very low | 43.3 | Very low | 88 Ų | 88 | 145.5 Ų | 145.5 | 73% | 0.727 | 82% | 0.819 | S | S | * | * | trans | 96.9 | 165 | 149.7 | 0 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 11 | P | 59 | Low | 43.2 | Very low | 110 Ų | 110 | 145.4 Ų | 145.4 | 71% | 0.714 | 82% | 0.821 | S | S | * | * | -142 | -155.8 | -103.7 | 38.1 | -14 | 0 | 0 | 0 | 115.8 | |||||
| 12 | V | 43.2 | Very low | 43.5 | Very low | 131 Ų | 131 | 141.7 Ų | 141.7 | 79% | 0.794 | 81% | 0.806 | S | S | * | * | trans | 90.4 | 156.1 | 165.6 | -44.6 | 0 | 0 | 0 | 0 | 119.3 | ||||
| 13 | P | 48.1 | Very low | 43.6 | Very low | 116 Ų | 116 | 139.7 Ų | 139.7 | 75% | 0.753 | 80% | 0.803 | S | S | * | * | cis | -126.9 | -179.1 | -30.9 | 26.2 | -4.6 | 0 | 0 | 0 | 113.6 | ||||
| 14 | A | 39.3 | Very low | 43.5 | Very low | 90 Ų | 90 | 136.8 Ų | 136.8 | 74% | 0.744 | 80% | 0.797 | S | S | * | * | trans | -107.5 | 152.4 | 176.9 | 0 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 15 | F | 43.7 | Very low | 44 | Very low | 205 Ų | 205 | 138.9 Ų | 138.9 | 90% | 0.899 | 80% | 0.797 | S | S | * | * | trans | -136.2 | 164.2 | 162.6 | -90.4 | -78.7 | 0 | 0 | 0 | 111.2 | ||||
| 16 | L | 43.1 | Very low | 44.6 | Very low | 157 Ų | 157 | 140.6 Ų | 140.6 | 82% | 0.822 | 80% | 0.795 | S | S | * | * | trans | -101.7 | 131.9 | -149.6 | -71.8 | 155.1 | 0 | 0 | 0 | 116.1 | ||||
| 17 | R | 42.8 | Very low | 44.7 | Very low | 229 Ų | 229 | 139.3 Ų | 139.3 | 86% | 0.864 | 78% | 0.784 | S | S | * | * | 54.9 | 110.4 | 126.6 | -165.3 | -179.9 | -166.4 | 145.9 | 2.4 | 120.7 | |||||
| 18 | N | 35.1 | Very low | 45.2 | Very low | 159 Ų | 159 | 139.7 Ų | 139.7 | 85% | 0.85 | 78% | 0.783 | S | S | * | * | -159.2 | 145.4 | 129.7 | -137.7 | 4.7 | 0 | 0 | 0 | 112.5 | |||||
| 19 | P | 46.1 | Very low | 45.5 | Very low | 100 Ų | 100 | 135.3 Ų | 135.3 | 65% | 0.649 | 77% | 0.77 | S | S | * | * | trans | -114.3 | -168.6 | 175 | 41.2 | -29 | 0 | 0 | 0 | 112.3 | ||||
| 20 | P | 48.3 | Very low | 45.6 | Very low | 114 Ų | 114 | 135.4 Ų | 135.4 | 74% | 0.74 | 77% | 0.77 | S | S | * | * | -129.2 | 150 | -59.6 | 37 | -22.6 | 0 | 0 | 0 | 113 | |||||
| 21 | V | 40.4 | Very low | 45.6 | Very low | 144 Ų | 144 | 140.8 Ų | 140.8 | 87% | 0.873 | 78% | 0.778 | S | S | * | * | trans | -141.6 | 126.4 | 160.6 | -177.7 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 22 | L | 51.7 | Low | 44.8 | Very low | 165 Ų | 165 | 143 Ų | 143 | 86% | 0.864 | 78% | 0.783 | S | S | * | * | P | Polyproline II helix | trans | -86.9 | 134.3 | 173.4 | -82 | 149.7 | 0 | 0 | 0 | 111 | ||
| 23 | P | 41.4 | Very low | 44.6 | Very low | 114 Ų | 114 | 145.2 Ų | 145.2 | 74% | 0.74 | 78% | 0.784 | S | S | * | * | P | Polyproline II helix | trans | -93.1 | 134.8 | 153.8 | 33 | -27.8 | 0 | 0 | 0 | 110.8 | ||
| 24 | S | 39 | Very low | 44.1 | Very low | 108 Ų | 108 | 148.8 Ų | 148.8 | 76% | 0.755 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -75.8 | 138.8 | 179.5 | -48.4 | 0 | 0 | 0 | 0 | 112.8 | ||
| 25 | P | 49.4 | Very low | 44 | Very low | 115 Ų | 115 | 149.7 Ų | 149.7 | 75% | 0.747 | 79% | 0.787 | S | S | * | * | trans | -89.8 | 112.8 | 154.2 | 32.2 | -26.1 | 0 | 0 | 0 | 109.6 | ||||
| 26 | L | 49.9 | Very low | 44.3 | Very low | 163 Ų | 163 | 147.9 Ų | 147.9 | 85% | 0.853 | 79% | 0.786 | S | S | * | * | trans | -82.2 | 160.3 | 165.9 | -72 | 173.6 | 0 | 0 | 0 | 110.7 | ||||
| 27 | D | 50.8 | Low | 43.8 | Very low | 112 Ų | 112 | 147.9 Ų | 147.9 | 60% | 0.599 | 78% | 0.781 | S | S | * | * | trans | 68.6 | 75.1 | 176.4 | -159.3 | -122.4 | 0 | 0 | 0 | 117.3 | K29 | D27-K29 IonicContact OD1-NZ 2.83Å; D27-K29 PolarHBondContact OD1-NZ 3.03Å; D27-K29 WeakPolarHBondContact OD2-CE 3.34Å; D27-K29 IonicContact OD2-NZ 2.62Å; D27-K29 PolarHBondContact OD2-NZ 3.14Å | ||
| 28 | M | 49.1 | Very low | 44 | Very low | 165 Ų | 165 | 141.7 Ų | 141.7 | 81% | 0.813 | 77% | 0.774 | S | S | * | * | trans | -128.3 | 120.6 | 139.7 | 24.5 | -151.3 | 74.4 | 0 | 0 | 109.4 | ||||
| 29 | K | 49 | Very low | 44 | Very low | 139 Ų | 139 | 139.1 Ų | 139.1 | 60% | 0.604 | 77% | 0.765 | S | S | * | * | trans | -60.4 | 124.9 | -172.7 | -75.7 | 69.7 | 173.1 | 166.3 | 0 | 109.7 | D27 F31 | D27-K29 IonicContact OD1-NZ 2.83Å; D27-K29 PolarHBondContact OD1-NZ 3.03Å; D27-K29 WeakPolarHBondContact OD2-CE 3.34Å; D27-K29 IonicContact OD2-NZ 2.62Å; D27-K29 PolarHBondContact OD2-NZ 3.14Å; K29-F31 PolarHBondContact O-N 2.98Å | ||
| 30 | P | 49.8 | Very low | 44.1 | Very low | 119 Ų | 119 | 141.9 Ų | 141.9 | 77% | 0.773 | 77% | 0.769 | S | S | * | * | trans | -67.8 | 109 | 167.7 | 27.7 | -31.4 | 0 | 0 | 0 | 108.4 | L32 | P30-L32 PolarHBondContact O-N 3.46Š| ||
| 31 | F | 39.1 | Very low | 43.8 | Very low | 201 Ų | 201 | 142 Ų | 142 | 88% | 0.882 | 77% | 0.77 | S | S | * | * | trans | -61.8 | 107 | 166 | -84.9 | -97.2 | 0 | 0 | 0 | 108.3 | K29 Q33 | K29-F31 PolarHBondContact O-N 2.98Å; F31-Q33 PolarHBondContact O-N 3.26Å | ||
| 32 | L | 41.4 | Very low | 43.9 | Very low | 157 Ų | 157 | 139.2 Ų | 139.2 | 82% | 0.822 | 76% | 0.762 | S | S | * | * | trans | 17.2 | 86.5 | 168.5 | -62.9 | 176.9 | 0 | 0 | 0 | 114.5 | P30 F34 | P30-L32 PolarHBondContact O-N 3.46Å; L32-F34 PolarHBondContact O-N 3.07Å | ||
| 33 | Q | 38.9 | Very low | 43.5 | Very low | 177 Ų | 177 | 135.3 Ų | 135.3 | 83% | 0.827 | 76% | 0.762 | S | S | * | * | trans | -49 | 110.6 | 158.8 | 177.2 | 173.5 | -14.8 | 0 | 0 | 108.2 | F31 P35 | F31-Q33 PolarHBondContact O-N 3.26Å; Q33-P35 WeakPolarHBondContact O-CD 3.37Å | ||
| 34 | F | 36.7 | Very low | 43.6 | Very low | 192 Ų | 192 | 137.9 Ų | 137.9 | 84% | 0.842 | 77% | 0.768 | S | S | * | * | trans | -55.8 | 127.1 | 173.9 | -73.9 | -87.3 | 0 | 0 | 0 | 108.3 | L32 L36 | L32-F34 PolarHBondContact O-N 3.07Å; F34-L36 PolarHBondContact O-N 2.76Å | ||
| 35 | P | 38.3 | Very low | 44.1 | Very low | 109 Ų | 109 | 135.2 Ų | 135.2 | 71% | 0.708 | 76% | 0.758 | S | S | * | * | trans | -59.7 | 111.8 | 168.5 | -22.3 | 33.9 | 0 | 0 | 0 | 108.4 | Q33 E37 | Q33-P35 WeakPolarHBondContact O-CD 3.37Å; P35-E37 HydrophobicContact CB-CB 4.18Å; P35-E37 PolarHBondContact O-N 3.02Å | ||
| 36 | L | 49.6 | Very low | 44.5 | Very low | 166 Ų | 166 | 137.1 Ų | 137.1 | 87% | 0.869 | 76% | 0.761 | S | S | * | * | trans | -74.7 | 55.5 | 160.9 | -174.9 | 60.6 | 0 | 0 | 0 | 108.2 | F34 | F34-L36 PolarHBondContact O-N 2.76Š| ||
| 37 | E | 33.2 | Very low | 44.3 | Very low | 157 Ų | 157 | 135.4 Ų | 135.4 | 73% | 0.734 | 75% | 0.747 | S | S | * | * | trans | -86.4 | 120.8 | 174.6 | -161.9 | 69.7 | -174.3 | 0 | 0 | 106.9 | P35 P39 | P35-E37 HydrophobicContact CB-CB 4.18Å; P35-E37 PolarHBondContact O-N 3.02Å; E37-P39 WeakPolarHBondContact O-CD 3.16Å | ||
| 38 | S | 45.8 | Very low | 44.5 | Very low | 100 Ų | 100 | 139 Ų | 139 | 70% | 0.699 | 76% | 0.76 | S | S | * | * | trans | -102.3 | 85.7 | 176 | -68.9 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 39 | P | 37 | Very low | 44.7 | Very low | 105 Ų | 105 | 135.8 Ų | 135.8 | 68% | 0.682 | 75% | 0.746 | S | S | * | * | P | Polyproline II helix | trans | -81.2 | 121.3 | 162.1 | 32.4 | -30.5 | 0 | 0 | 0 | 109.2 | E37 P41 | E37-P39 WeakPolarHBondContact O-CD 3.16Å; P39-P41 WeakPolarHBondContact O-CD 3.44Å |
| 40 | H | 47.1 | Very low | 45.3 | Very low | 157 Ų | 157 | 133.2 Ų | 133.2 | 73% | 0.727 | 73% | 0.734 | S | S | * | * | P | Polyproline II helix | trans | -53.3 | 122.1 | 170.9 | -76.3 | 57.1 | 0 | 0 | 0 | 110.5 | A42 | H40-A42 PolarHBondContact O-N 3.38Š|
| 41 | P | 41.5 | Very low | 45.8 | Very low | 116 Ų | 116 | 133.2 Ų | 133.2 | 75% | 0.753 | 73% | 0.728 | S | S | * | * | P | Polyproline II helix | trans | -73.5 | 120.8 | 166.3 | 29.7 | -30.5 | 0 | 0 | 0 | 108.6 | P39 G43 | P39-P41 WeakPolarHBondContact O-CD 3.44Å; P41-G43 PolarHBondContact O-N 3.14Å |
| 42 | A | 43 | Very low | 47.2 | Very low | 86 Ų | 86 | 127.5 Ų | 127.5 | 71% | 0.711 | 72% | 0.718 | S | S | * | * | trans | -24.1 | 121.5 | 178.5 | 0 | 0 | 0 | 0 | 0 | 115.2 | H40 I44 | H40-A42 PolarHBondContact O-N 3.38Å; A42-I44 VanDerWaalsContact O-CG1 3.3Å; A42-I44 WeakPolarHBondContact O-CG1 3.39Å; A42-I44 PolarHBondContact O-N 3.5Å | ||
| 43 | G | 44.1 | Very low | 48.7 | Very low | 84 Ų | 84 | 122.3 Ų | 122.3 | 87% | 0.866 | 69% | 0.69 | S | S | * | * | trans | -66.7 | 93.4 | 173.6 | 0 | 0 | 0 | 0 | 0 | 111.4 | P41 G45 | P41-G43 PolarHBondContact O-N 3.14Å; G43-G45 PolarHBondContact O-N 2.82Å | ||
| 44 | I | 42.1 | Very low | 50.6 | Low | 167 Ų | 167 | 118.1 Ų | 118.1 | 86% | 0.856 | 67% | 0.673 | S | S | * | * | trans | -76.8 | 85.8 | 180 | -36.4 | -179.2 | 0 | 0 | 0 | 110.1 | A42 L46 | A42-I44 VanDerWaalsContact O-CG1 3.3Å; A42-I44 WeakPolarHBondContact O-CG1 3.39Å; A42-I44 PolarHBondContact O-N 3.5Å; I44-L46 PolarHBondContact O-N 3.19Å | ||
| 45 | G | 49.5 | Very low | 52.6 | Low | 53 Ų | 53 | 113.7 Ų | 113.7 | 55% | 0.546 | 66% | 0.664 | S | S | . | * | S | Bend | trans | 55.1 | 60.8 | 143.9 | 0 | 0 | 0 | 0 | 0 | 118.7 | G43 | G43-G45 PolarHBondContact O-N 2.82Š|
| 46 | L | 58 | Low | 54.5 | Low | 155 Ų | 155 | 113.3 Ų | 113.3 | 81% | 0.812 | 66% | 0.659 | S | S | * | * | S | Bend | trans | -118.6 | -28.6 | 154 | -102.9 | 166 | 0 | 0 | 0 | 113.3 | I44 | I44-L46 PolarHBondContact O-N 3.19Š|
| 47 | F | 47.3 | Very low | 55.6 | Low | 126 Ų | 126 | 110.2 Ų | 110.2 | 55% | 0.553 | 64% | 0.641 | S | S | * | * | S | Bend | trans | -137.5 | 124.8 | 164.8 | -63.6 | -78.7 | 0 | 0 | 0 | 109.7 | N49 M61 | F47-N49 PolarHBondContact O-N 3.3Å; F47-M61 HydrophobicContact CD2-CE 4.41Å; F47-M61 HydrophobicContact CE2-CE 4.43Å |
| 48 | H | 54.9 | Low | 57.7 | Low | 189 Ų | 189 | 105.4 Ų | 105.4 | 88% | 0.875 | 62% | 0.617 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -70.9 | 14.3 | -175.8 | -81.1 | 86.5 | 0 | 0 | 0 | 114.6 | ||
| 49 | N | 53.3 | Low | 59.1 | Low | 97 Ų | 97 | 103.4 Ų | 103.4 | 52% | 0.519 | 61% | 0.607 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -159.4 | 44.3 | 168.8 | -137.9 | -42 | 0 | 0 | 0 | 116.2 | F47 N51 A52 | F47-N49 PolarHBondContact O-N 3.3Å; N49-N51 PolarHBondContact O-N 3.43Å; N49-N51 VanDerWaalsContact O-N 3.1Å; N49-A52 PolarHBondContact O-N 2.79Å; N49-A52 WeakPolarHBondContact OD1-CB 3.2Å; N49-A52 PolarHBondContact OD1-N 3.11Å |
| 50 | F | 60.8 | Low | 61.1 | Low | 84 Ų | 84 | 102.5 Ų | 102.5 | 37% | 0.368 | 60% | 0.599 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -64.4 | -15 | 178.2 | -163.6 | -100.2 | 0 | 0 | 0 | 113.9 | M53 K58 M61 | F50-M53 HydrophobicContact CD2-SD 4.23Å; F50-K58 HydrophobicContact CE1-CD 4.23Å; F50-K58 HydrophobicContact CE1-CG 4.5Å; F50-K58 HydrophobicContact CE2-CG 4.3Å; F50-K58 HydrophobicContact CZ-CB 4.32Å; F50-K58 HydrophobicContact CZ-CD 4.3Å; F50-K58 HydrophobicContact CZ-CG 4.08Å; F50-K58 WeakPolarHBondContact O-CE 3.25Å; F50-K58 PolarHBondContact O-NZ 2.78Å; F50-K58 VanDerWaalsContact O-NZ 3.11Å; F50-M61 HydrophobicContact CD2-CE 4.43Å; F50-M61 HydrophobicContact CE2-CE 4.36Å |
| 51 | N | 59.6 | Low | 62.2 | Low | 120 Ų | 120 | 96.6 Ų | 96.6 | 64% | 0.642 | 57% | 0.572 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77.7 | -45.3 | 177.5 | -145.7 | -46.2 | 0 | 0 | 0 | 112 | N49 M53 K58 | N49-N51 PolarHBondContact O-N 3.43Å; N49-N51 VanDerWaalsContact O-N 3.1Å; N51-M53 PolarHBondContact O-N 3.29Å; N51-K58 PolarHBondContact O-NZ 3.41Å |
| 52 | A | 68.8 | Low | 63.5 | Low | 81 Ų | 81 | 93.9 Ų | 93.9 | 67% | 0.669 | 55% | 0.554 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.7 | 5.7 | -176.6 | 0 | 0 | 0 | 0 | 0 | 116 | N49 | N49-A52 PolarHBondContact O-N 2.79Å; N49-A52 WeakPolarHBondContact OD1-CB 3.2Å; N49-A52 PolarHBondContact OD1-N 3.11Å |
| 53 | M | 72.9 | Confident | 64.8 | Low | 48 Ų | 48 | 98 Ų | 98 | 24% | 0.236 | 56% | 0.558 | C | S | . | * | S | Bend | trans | -69.3 | 150.5 | 174.2 | -78.1 | 176.7 | 170.9 | 0 | 0 | 112.5 | F50 N51 K58 M61 | F50-M53 HydrophobicContact CD2-SD 4.23Å; N51-M53 PolarHBondContact O-N 3.29Å; M53-K58 HydrophobicContact CB-CG 3.99Å; M53-K58 WeakPolarHBondContact O-CE 3.13Å; M53-M61 HydrophobicContact CE-CE 4.14Å; M53-M61 HydrophobicContact CE-SD 4.33Å; M53-M61 HydrophobicContact SD-CE 3.82Å; M53-M61 HydrophobicContact SD-SD 3.87Å |
| 54 | D | 79.4 | Confident | 66 | Low | 89 Ų | 89 | 98.4 Ų | 98.4 | 48% | 0.476 | 54% | 0.543 | S | S | . | . | trans | -60 | 140.8 | 173.9 | -174.6 | -72.3 | 0 | 0 | 0 | 111.5 | V56 Q57 K58 | D54-V56 PolarHBondContact O-N 3.19Å; D54-V56 VanDerWaalsContact OD1-CB 3.28Å; D54-V56 WeakPolarHBondContact OD1-CB 3.45Å; D54-V56 WeakPolarHBondContact OD1-CG2 3.06Å; D54-V56 PolarHBondContact OD1-N 3.17Å; D54-Q57 HydrophobicContact CB-CB 4.16Å; D54-Q57 WeakPolarHBondContact O-CB 2.81Å; D54-Q57 PolarHBondContact O-N 3.04Å; D54-K58 PolarHBondContact O-N 3.29Å | ||
| 55 | P | 79.1 | Confident | 67.2 | Low | 99 Ų | 99 | 98.1 Ų | 98.1 | 64% | 0.643 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -51.8 | -37.7 | 176.8 | -27.9 | 35.7 | 0 | 0 | 0 | 114.7 | K58 A59 | P55-K58 PolarHBondContact O-N 3Å; P55-A59 WeakPolarHBondContact O-CB 3.4Å; P55-A59 PolarHBondContact O-N 3.3Å |
| 56 | V | 76.8 | Confident | 68 | Low | 101 Ų | 101 | 96.9 Ų | 96.9 | 61% | 0.612 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -68 | -41.4 | 177.4 | -176.8 | 0 | 0 | 0 | 0 | 110.4 | D54 A59 V60 | D54-V56 PolarHBondContact O-N 3.19Å; D54-V56 VanDerWaalsContact OD1-CB 3.28Å; D54-V56 WeakPolarHBondContact OD1-CB 3.45Å; D54-V56 WeakPolarHBondContact OD1-CG2 3.06Å; D54-V56 PolarHBondContact OD1-N 3.17Å; V56-A59 PolarHBondContact O-N 2.84Å; V56-V60 WeakPolarHBondContact O-CG2 3.45Å; V56-V60 PolarHBondContact O-N 3.23Å |
| 57 | Q | 73.4 | Confident | 68.2 | Low | 101 Ų | 101 | 94.3 Ų | 94.3 | 47% | 0.472 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -67.3 | -37.3 | 177 | -164.4 | 172.7 | 1 | 0 | 0 | 111.5 | D54 M61 | D54-Q57 HydrophobicContact CB-CB 4.16Å; D54-Q57 WeakPolarHBondContact O-CB 2.81Å; D54-Q57 PolarHBondContact O-N 3.04Å; Q57-M61 HydrophobicContact CG-SD 4Å; Q57-M61 WeakPolarHBondContact O-CB 3.41Å; Q57-M61 WeakPolarHBondContact O-CG 3.34Å; Q57-M61 PolarHBondContact O-N 3.47Å |
| 58 | K | 78 | Confident | 68.7 | Low | 56 Ų | 56 | 92.6 Ų | 92.6 | 24% | 0.243 | 52% | 0.517 | C | S | . | . | H | α-helix | trans | -63.8 | -41.8 | 169.7 | -65.7 | -173.4 | -163.7 | -175.2 | 0 | 112.1 | F50 N51 M53 D54 P55 M61 T62 | F50-K58 HydrophobicContact CE1-CD 4.23Å; F50-K58 HydrophobicContact CE1-CG 4.5Å; F50-K58 HydrophobicContact CE2-CG 4.3Å; F50-K58 HydrophobicContact CZ-CB 4.32Å; F50-K58 HydrophobicContact CZ-CD 4.3Å; F50-K58 HydrophobicContact CZ-CG 4.08Å; F50-K58 WeakPolarHBondContact O-CE 3.25Å; F50-K58 PolarHBondContact O-NZ 2.78Å; F50-K58 VanDerWaalsContact O-NZ 3.11Å; N51-K58 PolarHBondContact O-NZ 3.41Å; M53-K58 HydrophobicContact CB-CG 3.99Å; M53-K58 WeakPolarHBondContact O-CE 3.13Å; D54-K58 PolarHBondContact O-N 3.29Å; P55-K58 PolarHBondContact O-N 3Å; K58-M61 PolarHBondContact O-N 3.24Å; K58-T62 VanDerWaalsContact O-CB 3.31Å; K58-T62 WeakPolarHBondContact O-CB 3.41Å; K58-T62 PolarHBondContact O-N 3.34Å; K58-T62 PolarHBondContact O-OG1 3.18Å |
| 59 | A | 73.4 | Confident | 68.7 | Low | 58 Ų | 58 | 91.3 Ų | 91.3 | 48% | 0.479 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -64.5 | -47.1 | 179.4 | 0 | 0 | 0 | 0 | 0 | 111.4 | P55 V56 T62 H63 | P55-A59 WeakPolarHBondContact O-CB 3.4Å; P55-A59 PolarHBondContact O-N 3.3Å; V56-A59 PolarHBondContact O-N 2.84Å; A59-T62 PolarHBondContact O-N 3.34Å; A59-H63 VanDerWaalsContact O-CB 3.32Å; A59-H63 WeakPolarHBondContact O-CB 3.43Å; A59-H63 PolarHBondContact O-N 2.91Å |
| 60 | V | 79.8 | Confident | 68.8 | Low | 85 Ų | 85 | 91.4 Ų | 91.4 | 52% | 0.515 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -58.8 | -50.7 | 174.4 | 167.3 | 0 | 0 | 0 | 0 | 111.1 | V56 T62 H63 T64 | V56-V60 WeakPolarHBondContact O-CG2 3.45Å; V56-V60 PolarHBondContact O-N 3.23Å; V60-T62 VanDerWaalsContact C-N 3.32Å; V60-T62 PolarHBondContact O-N 3.27Å; V60-H63 PolarHBondContact O-N 2.9Å; V60-H63 VanDerWaalsContact O-N 3.14Å; V60-T64 WeakPolarHBondContact O-CB 3.42Å; V60-T64 PolarHBondContact O-N 2.87Å; V60-T64 PolarHBondContact O-OG1 2.86Å |
| 61 | M | 70.2 | Confident | 68.4 | Low | 33 Ų | 33 | 97 Ų | 97 | 16% | 0.163 | 54% | 0.543 | C | S | . | . | H | α-helix | trans | -63.6 | -36.2 | 179.6 | -73.8 | 164.9 | 59 | 0 | 0 | 112.5 | F47 F50 M53 Q57 K58 F65 | F47-M61 HydrophobicContact CD2-CE 4.41Å; F47-M61 HydrophobicContact CE2-CE 4.43Å; F50-M61 HydrophobicContact CD2-CE 4.43Å; F50-M61 HydrophobicContact CE2-CE 4.36Å; M53-M61 HydrophobicContact CE-CE 4.14Å; M53-M61 HydrophobicContact CE-SD 4.33Å; M53-M61 HydrophobicContact SD-CE 3.82Å; M53-M61 HydrophobicContact SD-SD 3.87Å; Q57-M61 HydrophobicContact CG-SD 4Å; Q57-M61 WeakPolarHBondContact O-CB 3.41Å; Q57-M61 WeakPolarHBondContact O-CG 3.34Å; Q57-M61 PolarHBondContact O-N 3.47Å; K58-M61 PolarHBondContact O-N 3.24Å; M61-F65 HydrophobicContact CB-CD2 4.49Å; M61-F65 WeakPolarHBondContact O-CB 3.18Å; M61-F65 WeakPolarHBondContact O-CD2 3.47Å; M61-F65 PolarHBondContact O-N 3.33Å |
| 62 | T | 69.1 | Low | 68.3 | Low | 60 Ų | 60 | 96 Ų | 96 | 37% | 0.368 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -68.5 | -34.6 | 174.6 | -51.8 | 0 | 0 | 0 | 0 | 112.1 | K58 A59 V60 G66 | K58-T62 VanDerWaalsContact O-CB 3.31Å; K58-T62 WeakPolarHBondContact O-CB 3.41Å; K58-T62 PolarHBondContact O-N 3.34Å; K58-T62 PolarHBondContact O-OG1 3.18Å; A59-T62 PolarHBondContact O-N 3.34Å; V60-T62 VanDerWaalsContact C-N 3.32Å; V60-T62 PolarHBondContact O-N 3.27Å; T62-G66 CarbonylContact O-C 3.23Å; T62-G66 VanDerWaalsContact O-C 3.23Å; T62-G66 WeakPolarHBondContact O-CA 3.34Å; T62-G66 PolarHBondContact O-N 3.28Å |
| 63 | H | 69.4 | Low | 67.9 | Low | 172 Ų | 172 | 101.8 Ų | 101.8 | 80% | 0.796 | 55% | 0.552 | S | S | * | * | H | α-helix | trans | -76 | -36 | 177.8 | -170.7 | -86.8 | 0 | 0 | 0 | 112.4 | A59 V60 | A59-H63 VanDerWaalsContact O-CB 3.32Å; A59-H63 WeakPolarHBondContact O-CB 3.43Å; A59-H63 PolarHBondContact O-N 2.91Å; V60-H63 PolarHBondContact O-N 2.9Å; V60-H63 VanDerWaalsContact O-N 3.14Å |
| 64 | T | 70.9 | Confident | 67.6 | Low | 92 Ų | 92 | 108 Ų | 108 | 56% | 0.564 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -79.4 | -38.6 | 179.8 | -61.3 | 0 | 0 | 0 | 0 | 113.3 | V60 | V60-T64 WeakPolarHBondContact O-CB 3.42Å; V60-T64 PolarHBondContact O-N 2.87Å; V60-T64 PolarHBondContact O-OG1 2.86Å |
| 65 | F | 66.8 | Low | 67 | Low | 161 Ų | 161 | 108.7 Ų | 108.7 | 71% | 0.706 | 58% | 0.582 | S | S | * | * | H | α-helix | trans | -106 | -1 | -176.4 | -62.6 | -74.5 | 0 | 0 | 0 | 114.1 | M61 | M61-F65 HydrophobicContact CB-CD2 4.49Å; M61-F65 WeakPolarHBondContact O-CB 3.18Å; M61-F65 WeakPolarHBondContact O-CD2 3.47Å; M61-F65 PolarHBondContact O-N 3.33Å |
| 66 | G | 65.5 | Low | 66.7 | Low | 27 Ų | 27 | 109.3 Ų | 109.3 | 28% | 0.278 | 58% | 0.579 | S | S | . | * | trans | 70.4 | 175.1 | -168.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | T62 | T62-G66 CarbonylContact O-C 3.23Å; T62-G66 VanDerWaalsContact O-C 3.23Å; T62-G66 WeakPolarHBondContact O-CA 3.34Å; T62-G66 PolarHBondContact O-N 3.28Å | ||
| 67 | P | 63.4 | Low | 67.2 | Low | 102 Ų | 102 | 106.9 Ų | 106.9 | 66% | 0.662 | 56% | 0.562 | S | S | * | * | S | Bend | trans | -55.3 | 129.1 | 167.3 | -21.5 | 32.8 | 0 | 0 | 0 | 109.1 | I69 | P67-I69 PolarHBondContact O-N 3.03Š|
| 68 | P | 56.5 | Low | 68.1 | Low | 89 Ų | 89 | 104.5 Ų | 104.5 | 58% | 0.578 | 56% | 0.556 | S | S | * | * | trans | -55.4 | 116.5 | 177.2 | -25.6 | 34.1 | 0 | 0 | 0 | 109.2 | V70 | P68-V70 HydrophobicContact CB-CG1 4.4Å; P68-V70 PolarHBondContact O-N 2.86Å | ||
| 69 | I | 55.9 | Low | 68.9 | Low | 163 Ų | 163 | 101.9 Ų | 101.9 | 84% | 0.836 | 55% | 0.545 | S | S | * | . | trans | -73.9 | 68.9 | 174.1 | -46.1 | 175.4 | 0 | 0 | 0 | 107.3 | P67 K71 | P67-I69 PolarHBondContact O-N 3.03Å; I69-K71 PolarHBondContact O-N 3.35Å; I69-K71 VanDerWaalsContact O-N 3.07Å | ||
| 70 | V | 54.3 | Low | 69.7 | Low | 98 Ų | 98 | 105.9 Ų | 105.9 | 59% | 0.594 | 56% | 0.558 | S | S | * | * | trans | -54 | 118.7 | 169.5 | -74.7 | 0 | 0 | 0 | 0 | 106.2 | P68 T72 | P68-V70 HydrophobicContact CB-CG1 4.4Å; P68-V70 PolarHBondContact O-N 2.86Å; V70-T72 HydrophobicContact CB-CG2 4.29Å; V70-T72 HydrophobicContact CG2-CG2 3.86Å; V70-T72 PolarHBondContact O-N 3.19Å; V70-T72 PolarHBondContact O-OG1 2.87Å | ||
| 71 | K | 53.6 | Low | 70.3 | Confident | 201 Ų | 201 | 104 Ų | 104 | 87% | 0.874 | 55% | 0.547 | S | S | * | . | trans | -74 | 60.9 | 168.7 | -66.3 | 174 | -176 | 170.2 | 0 | 107.7 | I69 K73 | I69-K71 PolarHBondContact O-N 3.35Å; I69-K71 VanDerWaalsContact O-N 3.07Å; K71-K73 PolarHBondContact O-N 3.29Å | ||
| 72 | T | 56.7 | Low | 71.3 | Confident | 100 Ų | 100 | 103 Ų | 103 | 61% | 0.613 | 54% | 0.544 | S | S | * | . | trans | -50.9 | 114.7 | 163.7 | 37.5 | 0 | 0 | 0 | 0 | 105.6 | V70 R74 | V70-T72 HydrophobicContact CB-CG2 4.29Å; V70-T72 HydrophobicContact CG2-CG2 3.86Å; V70-T72 PolarHBondContact O-N 3.19Å; V70-T72 PolarHBondContact O-OG1 2.87Å; T72-R74 PolarHBondContact O-N 2.99Å | ||
| 73 | K | 61 | Low | 72.3 | Confident | 202 Ų | 202 | 108.8 Ų | 108.8 | 88% | 0.878 | 57% | 0.566 | S | S | * | * | trans | -60.5 | 103 | -177.1 | -67.2 | 176.6 | -178.9 | 174.7 | 0 | 106.3 | K71 | K71-K73 PolarHBondContact O-N 3.29Š| ||
| 74 | R | 65.6 | Low | 73.3 | Confident | 179 Ų | 179 | 103.7 Ų | 103.7 | 68% | 0.675 | 54% | 0.544 | S | S | * | . | trans | -49.4 | 127 | -177.5 | -68.8 | -178.7 | -179.7 | 163.5 | -1.6 | 107.9 | T72 I76 | T72-R74 PolarHBondContact O-N 2.99Å; R74-I76 PolarHBondContact O-N 2.97Å | ||
| 75 | P | 67.5 | Low | 74.3 | Confident | 104 Ų | 104 | 108.8 Ų | 108.8 | 68% | 0.675 | 55% | 0.553 | S | S | * | * | trans | -58.6 | 118.2 | -177.1 | 22.6 | -32.3 | 0 | 0 | 0 | 108.6 | I77 | P75-I77 VanDerWaalsContact C-N 3.3Å; P75-I77 PolarHBondContact O-N 3.29Å | ||
| 76 | I | 73.6 | Confident | 75.5 | Confident | 112 Ų | 112 | 102.1 Ų | 102.1 | 57% | 0.574 | 52% | 0.524 | S | S | * | . | trans | -76.3 | 89.8 | 178.5 | -60.8 | 174.9 | 0 | 0 | 0 | 107 | R74 S78 R85 | R74-I76 PolarHBondContact O-N 2.97Å; I76-S78 PolarHBondContact O-N 2.87Å; I76-R85 HydrophobicContact CG2-CB 3.86Å; I76-R85 HydrophobicContact CG2-CG 4.28Å | ||
| 77 | I | 87.6 | Confident | 76.5 | Confident | 49 Ų | 49 | 105.7 Ų | 105.7 | 25% | 0.251 | 54% | 0.537 | S | S | . | . | trans | -67.7 | 130.7 | 177 | -61.5 | 157 | 0 | 0 | 0 | 107.7 | P75 F86 E89 A92 Y96 | P75-I77 VanDerWaalsContact C-N 3.3Å; P75-I77 PolarHBondContact O-N 3.29Å; I77-F86 PolarHBondContact O-N 3.39Å; I77-E89 HydrophobicContact CD1-CB 3.77Å; I77-E89 HydrophobicContact CD1-CG 4.05Å; I77-A92 HydrophobicContact CB-CB 3.96Å; I77-A92 HydrophobicContact CD1-CB 4.49Å; I77-A92 HydrophobicContact CG2-CB 3.44Å; I77-A92 VanDerWaalsContact CG2-CB 3.44Å; I77-Y96 HydrophobicContact CG2-CE2 4.37Å | ||
| 78 | S | 91.6 | Very high | 77.8 | Confident | 51 Ų | 51 | 103 Ų | 103 | 36% | 0.357 | 52% | 0.52 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -135.8 | 145.7 | -177 | 73.3 | 0 | 0 | 0 | 0 | 112.4 | I76 I84 Y96 | I76-S78 PolarHBondContact O-N 2.87Å; S78-I84 CarbonylContact C-O 3.58Å; S78-I84 VanDerWaalsContact CA-O 3.3Å; S78-I84 WeakPolarHBondContact CA-O 3.4Å; S78-Y96 PolarHBondContact O-OH 2.89Å |
| 79 | C | 94.1 | Very high | 79.4 | Confident | 1 Ų | 1 | 105.2 Ų | 105.2 | 1% | 0.007 | 52% | 0.523 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -104.5 | 107.7 | -177 | 171 | 0 | 0 | 0 | 0 | 110.1 | V81 C82 Q83 I84 F86 H95 Y96 H101 | C79-V81 VanDerWaalsContact C-N 3.32Å; C79-V81 PolarHBondContact O-N 2.74Å; C79-C82 HydrophobicContact CB-CB 4.45Å; C79-C82 PolarHBondContact O-N 2.74Å; C79-C82 PolarHBondContact SG-N 3.28Å; C79-Q83 VanDerWaalsContact O-CA 3.31Å; C79-Q83 WeakPolarHBondContact O-CA 3.33Å; C79-Q83 PolarHBondContact O-N 3.5Å; C79-I84 PolarHBondContact N-O 3.25Å; C79-I84 PolarHBondContact O-N 3.35Å; C79-F86 HydrophobicContact CB-CE2 4.24Å; C79-H95 PolarHBondContact SG-NE2 2.97Å; C79-Y96 WeakPolarHBondContact CA-OH 3.32Å; C79-Y96 HydrophobicContact CB-CE1 3.73Å; C79-H101 PolarHBondContact SG-CE1 3.22Å; C79-H101 PolarHBondContact SG-ND1 2.96Å |
| 80 | N | 91.4 | Very high | 81.1 | Confident | 142 Ų | 142 | 101 Ų | 101 | 76% | 0.759 | 51% | 0.507 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63.1 | -35.5 | -177.6 | -67.2 | -28 | 0 | 0 | 0 | 113.1 | C82 | N80-C82 VanDerWaalsContact C-N 3.29Å; N80-C82 PolarHBondContact O-N 3.17Å |
| 81 | V | 91.4 | Very high | 82.9 | Confident | 47 Ų | 47 | 101.4 Ų | 101.4 | 29% | 0.285 | 50% | 0.503 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -63.8 | -35.6 | 177.4 | 177.9 | 0 | 0 | 0 | 0 | 111.6 | C79 R104 V105 I108 | C79-V81 VanDerWaalsContact C-N 3.32Å; C79-V81 PolarHBondContact O-N 2.74Å; V81-R104 HydrophobicContact CG1-CB 4.1Å; V81-R104 HydrophobicContact CG1-CG 3.72Å; V81-R104 WeakPolarHBondContact O-CD 3.46Å; V81-V105 HydrophobicContact CG1-CG2 3.99Å; V81-V105 HydrophobicContact CG2-CG2 4.32Å; V81-I108 HydrophobicContact CB-CD1 4.49Å; V81-I108 HydrophobicContact CG1-CD1 3.96Å; V81-I108 HydrophobicContact CG2-CD1 3.87Å |
| 82 | C | 90.4 | Very high | 84.8 | Confident | 12 Ų | 12 | 92 Ų | 92 | 8% | 0.081 | 46% | 0.463 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -104.4 | -11.6 | -176.9 | -68 | 0 | 0 | 0 | 0 | 114.9 | C79 N80 I84 H95 | C79-C82 HydrophobicContact CB-CB 4.45Å; C79-C82 PolarHBondContact O-N 2.74Å; C79-C82 PolarHBondContact SG-N 3.28Å; N80-C82 VanDerWaalsContact C-N 3.29Å; N80-C82 PolarHBondContact O-N 3.17Å; C82-I84 HydrophobicContact CB-CD1 4.01Å; C82-I84 HydrophobicContact CB-CG1 3.89Å; C82-I84 PolarHBondContact O-N 3.33Å; C82-H95 WeakPolarHBondContact CB-NE2 3.33Å; C82-H95 PolarHBondContact SG-CE1 2.86Å; C82-H95 PolarHBondContact SG-NE2 3.38Å |
| 83 | Q | 91.6 | Very high | 86.5 | Confident | 181 Ų | 181 | 91.6 Ų | 91.6 | 85% | 0.846 | 45% | 0.454 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 52.5 | 38.4 | -169.4 | -57 | -173 | 23.1 | 0 | 0 | 113.5 | C79 | C79-Q83 VanDerWaalsContact O-CA 3.31Å; C79-Q83 WeakPolarHBondContact O-CA 3.33Å; C79-Q83 PolarHBondContact O-N 3.5Å |
| 84 | I | 90.5 | Very high | 88.2 | Confident | 65 Ų | 65 | 85.2 Ų | 85.2 | 33% | 0.333 | 44% | 0.438 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -107 | 134.2 | 177.9 | -52.9 | -179.4 | 0 | 0 | 0 | 109.2 | S78 C79 C82 F86 | S78-I84 CarbonylContact C-O 3.58Å; S78-I84 VanDerWaalsContact CA-O 3.3Å; S78-I84 WeakPolarHBondContact CA-O 3.4Å; C79-I84 PolarHBondContact N-O 3.25Å; C79-I84 PolarHBondContact O-N 3.35Å; C82-I84 HydrophobicContact CB-CD1 4.01Å; C82-I84 HydrophobicContact CB-CG1 3.89Å; C82-I84 PolarHBondContact O-N 3.33Å; I84-F86 HydrophobicContact CB-CE1 4.48Å; I84-F86 HydrophobicContact CB-CE2 4.09Å; I84-F86 HydrophobicContact CB-CZ 3.77Å; I84-F86 HydrophobicContact CG2-CD1 4.3Å; I84-F86 HydrophobicContact CG2-CE1 3.57Å; I84-F86 HydrophobicContact CG2-CE2 3.95Å; I84-F86 HydrophobicContact CG2-CZ 3.34Å |
| 85 | R | 91.7 | Very high | 89.6 | Confident | 198 Ų | 198 | 77.8 Ų | 77.8 | 75% | 0.747 | 41% | 0.411 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -104.5 | 137 | 173.7 | -64.7 | -178.4 | 177.3 | 175 | -0 | 109.5 | I76 | I76-R85 HydrophobicContact CG2-CB 3.86Å; I76-R85 HydrophobicContact CG2-CG 4.28Å |
| 86 | F | 91.1 | Very high | 90.9 | Very high | 22 Ų | 22 | 77.3 Ų | 77.3 | 10% | 0.096 | 40% | 0.397 | C | S | . | . | trans | -115.6 | 145.6 | -178.7 | -59 | -74.5 | 0 | 0 | 0 | 110.8 | I77 C79 I84 Q91 A92 H95 | I77-F86 PolarHBondContact O-N 3.39Å; C79-F86 HydrophobicContact CB-CE2 4.24Å; I84-F86 HydrophobicContact CB-CE1 4.48Å; I84-F86 HydrophobicContact CB-CE2 4.09Å; I84-F86 HydrophobicContact CB-CZ 3.77Å; I84-F86 HydrophobicContact CG2-CD1 4.3Å; I84-F86 HydrophobicContact CG2-CE1 3.57Å; I84-F86 HydrophobicContact CG2-CE2 3.95Å; I84-F86 HydrophobicContact CG2-CZ 3.34Å; F86-Q91 HydrophobicContact CB-CB 4.26Å; F86-Q91 HydrophobicContact CD1-CB 3.73Å; F86-Q91 HydrophobicContact CG-CB 4.27Å; F86-A92 HydrophobicContact CB-CB 4.09Å; F86-A92 HydrophobicContact CD2-CB 3.67Å; F86-A92 HydrophobicContact CE2-CB 4.42Å; F86-A92 HydrophobicContact CG-CB 3.98Å; F86-H95 HydrophobicContact CE1-CB 3.94Å; F86-H95 HydrophobicContact CE2-CB 3.84Å; F86-H95 AromaticContact CE2-CD2 3.94Å; F86-H95 AromaticContact CE2-CG 3.81Å; F86-H95 HydrophobicContact CZ-CB 3.33Å; F86-H95 AromaticContact CZ-CD2 3.88Å; F86-H95 AromaticContact CZ-CG 3.32Å; F86-H95 AromaticContact CZ-ND1 3.68Å | ||
| 87 | N | 87.4 | Confident | 91.9 | Very high | 102 Ų | 102 | 79.8 Ų | 79.8 | 55% | 0.545 | 40% | 0.403 | S | S | . | . | S | Bend | trans | -91.8 | -13.3 | 175.7 | -166.6 | -97.8 | 0 | 0 | 0 | 112.8 | ||
| 88 | S | 89.6 | Confident | 92.3 | Very high | 44 Ų | 44 | 78.4 Ų | 78.4 | 31% | 0.308 | 40% | 0.402 | S | S | . | . | S | Bend | trans | -134.1 | 142.8 | -179.7 | -175.7 | 0 | 0 | 0 | 0 | 110.3 | S90 Q91 A92 | S88-S90 VanDerWaalsContact C-N 3.34Å; S88-S90 PolarHBondContact O-N 3.29Å; S88-S90 PolarHBondContact OG-N 2.97Å; S88-S90 PolarHBondContact OG-OG 2.86Å; S88-Q91 PolarHBondContact O-N 3.04Å; S88-A92 PolarHBondContact O-N 3.29Å |
| 89 | E | 91 | Very high | 92.5 | Very high | 137 Ų | 137 | 80.9 Ų | 80.9 | 64% | 0.64 | 41% | 0.411 | S | S | * | . | H | α-helix | trans | -57 | -45.9 | 172.5 | -177.9 | 166.7 | -145.3 | 0 | 0 | 111.8 | I77 Q91 A92 E93 | I77-E89 HydrophobicContact CD1-CB 3.77Å; I77-E89 HydrophobicContact CD1-CG 4.05Å; E89-Q91 PolarHBondContact O-N 3.4Å; E89-Q91 VanDerWaalsContact O-N 3.16Å; E89-A92 CarbonylContact O-C 3.58Å; E89-A92 WeakPolarHBondContact O-CA 3.47Å; E89-A92 WeakPolarHBondContact O-CB 3.36Å; E89-A92 PolarHBondContact O-N 2.86Å; E89-E93 HydrophobicContact CG-CG 4.46Å; E89-E93 PolarHBondContact O-N 3.13Å |
| 90 | S | 92.4 | Very high | 92.4 | Very high | 73 Ų | 73 | 90.5 Ų | 90.5 | 51% | 0.51 | 45% | 0.447 | S | S | . | . | H | α-helix | trans | -57 | -32.4 | 176.8 | 57.4 | 0 | 0 | 0 | 0 | 114 | S88 A94 | S88-S90 VanDerWaalsContact C-N 3.34Å; S88-S90 PolarHBondContact O-N 3.29Å; S88-S90 PolarHBondContact OG-N 2.97Å; S88-S90 PolarHBondContact OG-OG 2.86Å; S90-A94 VanDerWaalsContact O-CB 3.31Å; S90-A94 WeakPolarHBondContact O-CB 3.48Å; S90-A94 PolarHBondContact O-N 3.05Å; S90-A94 VanDerWaalsContact O-N 3.1Å |
| 91 | Q | 90.3 | Very high | 92.6 | Very high | 108 Ų | 108 | 84.9 Ų | 84.9 | 51% | 0.505 | 42% | 0.416 | S | S | . | . | H | α-helix | trans | -74.4 | -36.7 | 174 | -69.2 | -178 | 16.7 | 0 | 0 | 112.1 | F86 S88 E89 H95 | F86-Q91 HydrophobicContact CB-CB 4.26Å; F86-Q91 HydrophobicContact CD1-CB 3.73Å; F86-Q91 HydrophobicContact CG-CB 4.27Å; S88-Q91 PolarHBondContact O-N 3.04Å; E89-Q91 PolarHBondContact O-N 3.4Å; E89-Q91 VanDerWaalsContact O-N 3.16Å; Q91-H95 WeakPolarHBondContact O-CB 3.15Å; Q91-H95 PolarHBondContact O-N 3.08Å |
| 92 | A | 93.9 | Very high | 92.7 | Very high | 3 Ų | 3 | 85.1 Ų | 85.1 | 3% | 0.025 | 42% | 0.423 | C | S | . | . | H | α-helix | trans | -67.1 | -44.8 | 175.3 | 0 | 0 | 0 | 0 | 0 | 111.1 | I77 F86 S88 E89 H95 Y96 | I77-A92 HydrophobicContact CB-CB 3.96Å; I77-A92 HydrophobicContact CD1-CB 4.49Å; I77-A92 HydrophobicContact CG2-CB 3.44Å; I77-A92 VanDerWaalsContact CG2-CB 3.44Å; F86-A92 HydrophobicContact CB-CB 4.09Å; F86-A92 HydrophobicContact CD2-CB 3.67Å; F86-A92 HydrophobicContact CE2-CB 4.42Å; F86-A92 HydrophobicContact CG-CB 3.98Å; S88-A92 PolarHBondContact O-N 3.29Å; E89-A92 CarbonylContact O-C 3.58Å; E89-A92 WeakPolarHBondContact O-CA 3.47Å; E89-A92 WeakPolarHBondContact O-CB 3.36Å; E89-A92 PolarHBondContact O-N 2.86Å; A92-H95 WeakPolarHBondContact O-CB 3.47Å; A92-H95 PolarHBondContact O-N 3.22Å; A92-H95 VanDerWaalsContact O-N 3.15Å; A92-Y96 HydrophobicContact CB-CD2 4.42Å; A92-Y96 HydrophobicContact CB-CE2 4.13Å; A92-Y96 WeakPolarHBondContact O-CD2 3.11Å; A92-Y96 PolarHBondContact O-N 2.81Å |
| 93 | E | 93.9 | Very high | 92.9 | Very high | 91 Ų | 91 | 93 Ų | 93 | 43% | 0.425 | 45% | 0.451 | S | S | . | . | H | α-helix | trans | -59 | -48.9 | 174.8 | -72.5 | -158.2 | 94 | 0 | 0 | 112.6 | E89 H95 Y96 K97 | E89-E93 HydrophobicContact CG-CG 4.46Å; E89-E93 PolarHBondContact O-N 3.13Å; E93-H95 PolarHBondContact O-N 2.65Å; E93-Y96 PolarHBondContact O-N 3.11Å; E93-K97 WeakPolarHBondContact O-CB 3.5Å; E93-K97 WeakPolarHBondContact O-CG 3.37Å; E93-K97 PolarHBondContact O-N 3.35Å; E93-K97 IonicContact OE1-NZ 2.8Å; E93-K97 PolarHBondContact OE1-NZ 3.35Å |
| 94 | A | 95.2 | Very high | 92.9 | Very high | 68 Ų | 68 | 90.4 Ų | 90.4 | 56% | 0.562 | 43% | 0.434 | S | S | * | . | H | α-helix | trans | -61.1 | -31.7 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112 | S90 G98 | S90-A94 VanDerWaalsContact O-CB 3.31Å; S90-A94 WeakPolarHBondContact O-CB 3.48Å; S90-A94 PolarHBondContact O-N 3.05Å; S90-A94 VanDerWaalsContact O-N 3.1Å; A94-G98 PolarHBondContact O-N 2.99Å |
| 95 | H | 95.6 | Very high | 93 | Very high | 23 Ų | 23 | 89 Ų | 89 | 11% | 0.106 | 43% | 0.428 | C | S | . | . | H | α-helix | trans | -68.7 | -50.6 | 172.1 | 177 | 80.1 | 0 | 0 | 0 | 112.5 | C79 C82 F86 Q91 A92 E93 K97 G98 H101 | C79-H95 PolarHBondContact SG-NE2 2.97Å; C82-H95 WeakPolarHBondContact CB-NE2 3.33Å; C82-H95 PolarHBondContact SG-CE1 2.86Å; C82-H95 PolarHBondContact SG-NE2 3.38Å; F86-H95 HydrophobicContact CE1-CB 3.94Å; F86-H95 HydrophobicContact CE2-CB 3.84Å; F86-H95 AromaticContact CE2-CD2 3.94Å; F86-H95 AromaticContact CE2-CG 3.81Å; F86-H95 HydrophobicContact CZ-CB 3.33Å; F86-H95 AromaticContact CZ-CD2 3.88Å; F86-H95 AromaticContact CZ-CG 3.32Å; F86-H95 AromaticContact CZ-ND1 3.68Å; Q91-H95 WeakPolarHBondContact O-CB 3.15Å; Q91-H95 PolarHBondContact O-N 3.08Å; A92-H95 WeakPolarHBondContact O-CB 3.47Å; A92-H95 PolarHBondContact O-N 3.22Å; A92-H95 VanDerWaalsContact O-N 3.15Å; E93-H95 PolarHBondContact O-N 2.65Å; H95-K97 PolarHBondContact O-N 3.32Å; H95-G98 WeakPolarHBondContact O-CA 3.49Å; H95-G98 PolarHBondContact O-N 3.49Å; H95-H101 AromaticContact CD2-ND1 3.97Å; H95-H101 AromaticContact NE2-CG 3.89Å; H95-H101 AromaticContact NE2-ND1 3.44Å; H95-H101 PolarHBondContact NE2-ND1 3.14Å; H95-H101 WeakPolarHBondContact O-CB 3.26Å |
| 96 | Y | 95.3 | Very high | 93 | Very high | 94 Ų | 94 | 86.8 Ų | 86.8 | 37% | 0.369 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -63.5 | -40.5 | -178 | -71.3 | -57.4 | 0 | 0 | 0 | 112.2 | I77 S78 C79 A92 E93 G98 H101 | I77-Y96 HydrophobicContact CG2-CE2 4.37Å; S78-Y96 PolarHBondContact O-OH 2.89Å; C79-Y96 WeakPolarHBondContact CA-OH 3.32Å; C79-Y96 HydrophobicContact CB-CE1 3.73Å; A92-Y96 HydrophobicContact CB-CD2 4.42Å; A92-Y96 HydrophobicContact CB-CE2 4.13Å; A92-Y96 WeakPolarHBondContact O-CD2 3.11Å; A92-Y96 PolarHBondContact O-N 2.81Å; E93-Y96 PolarHBondContact O-N 3.11Å; Y96-G98 PolarHBondContact O-N 3.04Å; Y96-H101 AromaticContact CD1-CE1 3.79Å; Y96-H101 AromaticContact CD1-NE2 3.62Å; Y96-H101 PolarHBondContact O-CD2 3.03Å |
| 97 | K | 94.8 | Very high | 93 | Very high | 164 Ų | 164 | 87.4 Ų | 87.4 | 71% | 0.713 | 44% | 0.437 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -75.2 | -5.3 | 173.8 | -64.2 | 167.4 | -178.2 | 161.9 | 0 | 112.7 | E93 H95 | E93-K97 WeakPolarHBondContact O-CB 3.5Å; E93-K97 WeakPolarHBondContact O-CG 3.37Å; E93-K97 PolarHBondContact O-N 3.35Å; E93-K97 IonicContact OE1-NZ 2.8Å; E93-K97 PolarHBondContact OE1-NZ 3.35Å; H95-K97 PolarHBondContact O-N 3.32Å |
| 98 | G | 95.6 | Very high | 92.9 | Very high | 21 Ų | 21 | 86.3 Ų | 86.3 | 22% | 0.216 | 43% | 0.43 | C | S | . | . | S | Bend | trans | -83.1 | 139 | -174.6 | 0 | 0 | 0 | 0 | 0 | 114.8 | A94 H95 Y96 R100 H101 A102 | A94-G98 PolarHBondContact O-N 2.99Å; H95-G98 WeakPolarHBondContact O-CA 3.49Å; H95-G98 PolarHBondContact O-N 3.49Å; Y96-G98 PolarHBondContact O-N 3.04Å; G98-R100 PolarHBondContact O-N 2.91Å; G98-H101 PolarHBondContact O-N 3Å; G98-A102 PolarHBondContact O-N 3.16Å |
| 99 | N | 95.5 | Very high | 92.5 | Very high | 102 Ų | 102 | 89.6 Ų | 89.6 | 55% | 0.545 | 44% | 0.44 | S | S | . | . | H | α-helix | trans | -55.1 | -27.4 | 179.6 | -159.7 | -18.1 | 0 | 0 | 0 | 113.4 | R103 | N99-R103 PolarHBondContact ND2-NH2 3.39Å; N99-R103 WeakPolarHBondContact O-CB 3.4Å; N99-R103 VanDerWaalsContact O-CG 3.23Å; N99-R103 WeakPolarHBondContact O-CG 3.06Å; N99-R103 PolarHBondContact O-N 3.15Å; N99-R103 VanDerWaalsContact O-N 3.14Å; N99-R103 PolarHBondContact OD1-NE 2.84Å |
| 100 | R | 91.5 | Very high | 91.6 | Very high | 203 Ų | 203 | 87.6 Ų | 87.6 | 77% | 0.766 | 44% | 0.437 | S | S | * | . | H | α-helix | trans | -66.6 | -40.4 | 174.6 | -173.8 | -177.9 | -69.7 | -141.2 | 2.4 | 112.5 | G98 R104 | G98-R100 PolarHBondContact O-N 2.91Å; R100-R104 PolarHBondContact O-N 3.01Å |
| 101 | H | 95.6 | Very high | 90.6 | Very high | 24 Ų | 24 | 87.4 Ų | 87.4 | 11% | 0.111 | 44% | 0.436 | C | S | . | . | H | α-helix | trans | -71.2 | -50.8 | 177.5 | 179.7 | 74.3 | 0 | 0 | 0 | 110.2 | C79 H95 Y96 G98 R103 R104 V105 | C79-H101 PolarHBondContact SG-CE1 3.22Å; C79-H101 PolarHBondContact SG-ND1 2.96Å; H95-H101 AromaticContact CD2-ND1 3.97Å; H95-H101 AromaticContact NE2-CG 3.89Å; H95-H101 AromaticContact NE2-ND1 3.44Å; H95-H101 PolarHBondContact NE2-ND1 3.14Å; H95-H101 WeakPolarHBondContact O-CB 3.26Å; Y96-H101 AromaticContact CD1-CE1 3.79Å; Y96-H101 AromaticContact CD1-NE2 3.62Å; Y96-H101 PolarHBondContact O-CD2 3.03Å; G98-H101 PolarHBondContact O-N 3Å; H101-R103 VanDerWaalsContact C-N 3.32Å; H101-R103 PolarHBondContact O-N 2.97Å; H101-R104 WeakPolarHBondContact O-CA 3.48Å; H101-R104 PolarHBondContact O-N 3.45Å; H101-V105 WeakPolarHBondContact NE2-CG2 3.2Å; H101-V105 WeakPolarHBondContact O-CG2 3.05Å; H101-V105 PolarHBondContact O-N 3.44Å |
| 102 | A | 94.4 | Very high | 89.6 | Confident | 53 Ų | 53 | 89.8 Ų | 89.8 | 44% | 0.438 | 45% | 0.445 | S | S | . | . | H | α-helix | trans | -53.3 | -43.5 | 179.3 | 0 | 0 | 0 | 0 | 0 | 113.5 | G98 R104 V105 K106 | G98-A102 PolarHBondContact O-N 3.16Å; A102-R104 VanDerWaalsContact C-N 3.33Å; A102-R104 PolarHBondContact O-N 2.58Å; A102-V105 PolarHBondContact O-N 3.41Å; A102-K106 WeakPolarHBondContact O-CB 3.38Å; A102-K106 PolarHBondContact O-N 3.37Å |
| 103 | R | 93.8 | Very high | 87.9 | Confident | 178 Ų | 178 | 93.4 Ų | 93.4 | 67% | 0.672 | 47% | 0.467 | S | S | * | . | H | α-helix | trans | -63.6 | -35.6 | 175.1 | -72.1 | 174.4 | -164.9 | -151 | 4.4 | 113.2 | N99 H101 G107 | N99-R103 PolarHBondContact ND2-NH2 3.39Å; N99-R103 WeakPolarHBondContact O-CB 3.4Å; N99-R103 VanDerWaalsContact O-CG 3.23Å; N99-R103 WeakPolarHBondContact O-CG 3.06Å; N99-R103 PolarHBondContact O-N 3.15Å; N99-R103 VanDerWaalsContact O-N 3.14Å; N99-R103 PolarHBondContact OD1-NE 2.84Å; H101-R103 VanDerWaalsContact C-N 3.32Å; H101-R103 PolarHBondContact O-N 2.97Å; R103-G107 PolarHBondContact O-N 2.9Å; R103-G107 VanDerWaalsContact O-N 3.16Å |
| 104 | R | 91.7 | Very high | 86.1 | Confident | 126 Ų | 126 | 93.5 Ų | 93.5 | 48% | 0.475 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -74.9 | -40.8 | 178.4 | -171.3 | 172.5 | -84.5 | 171.3 | -21.3 | 111.2 | V81 R100 H101 A102 G107 I108 | V81-R104 HydrophobicContact CG1-CB 4.1Å; V81-R104 HydrophobicContact CG1-CG 3.72Å; V81-R104 WeakPolarHBondContact O-CD 3.46Å; R100-R104 PolarHBondContact O-N 3.01Å; H101-R104 WeakPolarHBondContact O-CA 3.48Å; H101-R104 PolarHBondContact O-N 3.45Å; A102-R104 VanDerWaalsContact C-N 3.33Å; A102-R104 PolarHBondContact O-N 2.58Å; R104-G107 PolarHBondContact O-N 2.91Å; R104-I108 PolarHBondContact O-N 3.24Å |
| 105 | V | 92.8 | Very high | 84.3 | Confident | 36 Ų | 36 | 100.5 Ų | 100.5 | 22% | 0.218 | 49% | 0.489 | C | S | . | . | H | α-helix | trans | -55.3 | -54.7 | 172.2 | 176 | 0 | 0 | 0 | 0 | 110.2 | V81 H101 A102 G107 I108 E109 | V81-V105 HydrophobicContact CG1-CG2 3.99Å; V81-V105 HydrophobicContact CG2-CG2 4.32Å; H101-V105 WeakPolarHBondContact NE2-CG2 3.2Å; H101-V105 WeakPolarHBondContact O-CG2 3.05Å; H101-V105 PolarHBondContact O-N 3.44Å; A102-V105 PolarHBondContact O-N 3.41Å; V105-G107 PolarHBondContact O-N 3.47Å; V105-G107 VanDerWaalsContact O-N 3.14Å; V105-I108 WeakPolarHBondContact O-CG1 3.48Å; V105-I108 PolarHBondContact O-N 3.14Å; V105-E109 HydrophobicContact CG1-CG 4.36Å; V105-E109 WeakPolarHBondContact O-CG 3.23Å; V105-E109 PolarHBondContact O-N 2.82Å |
| 106 | K | 91.9 | Very high | 82.4 | Confident | 151 Ų | 151 | 106.3 Ų | 106.3 | 66% | 0.657 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -61.2 | -29.5 | 179.7 | -159.1 | 165.1 | -172.7 | 170.4 | 0 | 113.4 | A102 T110 | A102-K106 WeakPolarHBondContact O-CB 3.38Å; A102-K106 PolarHBondContact O-N 3.37Å; K106-T110 WeakPolarHBondContact O-CG2 3.47Å; K106-T110 PolarHBondContact O-N 2.76Å; K106-T110 PolarHBondContact O-OG1 3.19Å |
| 107 | G | 90.1 | Very high | 80.2 | Confident | 35 Ų | 35 | 109.8 Ų | 109.8 | 36% | 0.361 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -74.4 | -33.9 | 173.8 | 0 | 0 | 0 | 0 | 0 | 114.7 | R103 R104 V105 T110 S111 | R103-G107 PolarHBondContact O-N 2.9Å; R103-G107 VanDerWaalsContact O-N 3.16Å; R104-G107 PolarHBondContact O-N 2.91Å; V105-G107 PolarHBondContact O-N 3.47Å; V105-G107 VanDerWaalsContact O-N 3.14Å; G107-T110 WeakPolarHBondContact CA-OG1 3.31Å; G107-T110 PolarHBondContact O-OG1 3.43Å; G107-S111 PolarHBondContact O-N 3.47Å; G107-S111 PolarHBondContact O-OG 3.46Å |
| 108 | I | 86.2 | Confident | 77.8 | Confident | 79 Ų | 79 | 109.5 Ų | 109.5 | 41% | 0.405 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -78.3 | -33.1 | 174.4 | 61.8 | 165.9 | 0 | 0 | 0 | 112.1 | V81 R104 V105 S111 K112 | V81-I108 HydrophobicContact CB-CD1 4.49Å; V81-I108 HydrophobicContact CG1-CD1 3.96Å; V81-I108 HydrophobicContact CG2-CD1 3.87Å; R104-I108 PolarHBondContact O-N 3.24Å; V105-I108 WeakPolarHBondContact O-CG1 3.48Å; V105-I108 PolarHBondContact O-N 3.14Å; I108-S111 WeakPolarHBondContact CA-OG 3.44Å; I108-S111 PolarHBondContact O-N 3.32Å; I108-S111 PolarHBondContact O-OG 3.31Å; I108-K112 WeakPolarHBondContact O-CB 3.39Å; I108-K112 PolarHBondContact O-N 3.04Å |
| 109 | E | 81.2 | Confident | 75.5 | Confident | 112 Ų | 112 | 112.3 Ų | 112.3 | 52% | 0.523 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -65.1 | -48.3 | 176.2 | -70.2 | 170.4 | 144.2 | 0 | 0 | 111 | V105 S111 K112 T113 | V105-E109 HydrophobicContact CG1-CG 4.36Å; V105-E109 WeakPolarHBondContact O-CG 3.23Å; V105-E109 PolarHBondContact O-N 2.82Å; E109-S111 VanDerWaalsContact C-N 3.34Å; E109-S111 PolarHBondContact O-N 3.39Å; E109-K112 PolarHBondContact O-N 3.45Å; E109-T113 PolarHBondContact O-N 3.33Å; E109-T113 PolarHBondContact O-OG1 2.85Å |
| 110 | T | 72.8 | Confident | 73.3 | Confident | 95 Ų | 95 | 114.1 Ų | 114.1 | 58% | 0.583 | 59% | 0.585 | S | S | * | * | H | α-helix | trans | -62 | -37 | 177.1 | 43.5 | 0 | 0 | 0 | 0 | 113.5 | K106 G107 | K106-T110 WeakPolarHBondContact O-CG2 3.47Å; K106-T110 PolarHBondContact O-N 2.76Å; K106-T110 PolarHBondContact O-OG1 3.19Å; G107-T110 WeakPolarHBondContact CA-OG1 3.31Å; G107-T110 PolarHBondContact O-OG1 3.43Å |
| 111 | S | 70.4 | Confident | 70.6 | Confident | 70 Ų | 70 | 112.1 Ų | 112.1 | 49% | 0.49 | 58% | 0.582 | S | S | . | * | H | α-helix | trans | -79.5 | -28.9 | 176.4 | 49.9 | 0 | 0 | 0 | 0 | 113.9 | G107 I108 E109 | G107-S111 PolarHBondContact O-N 3.47Å; G107-S111 PolarHBondContact O-OG 3.46Å; I108-S111 WeakPolarHBondContact CA-OG 3.44Å; I108-S111 PolarHBondContact O-N 3.32Å; I108-S111 PolarHBondContact O-OG 3.31Å; E109-S111 VanDerWaalsContact C-N 3.34Å; E109-S111 PolarHBondContact O-N 3.39Å |
| 112 | K | 69.2 | Low | 67.7 | Low | 157 Ų | 157 | 119.4 Ų | 119.4 | 68% | 0.683 | 62% | 0.616 | S | S | * | * | H | α-helix | trans | -74.3 | -35.9 | 175 | -166.2 | 171.2 | -177.5 | -178.5 | 0 | 112.1 | I108 E109 S114 R115 | I108-K112 WeakPolarHBondContact O-CB 3.39Å; I108-K112 PolarHBondContact O-N 3.04Å; E109-K112 PolarHBondContact O-N 3.45Å; K112-S114 VanDerWaalsContact C-N 3.34Å; K112-S114 PolarHBondContact O-N 3.08Å; K112-R115 PolarHBondContact O-N 3.22Å |
| 113 | T | 58.2 | Low | 64.8 | Low | 80 Ų | 80 | 125.9 Ų | 125.9 | 49% | 0.491 | 64% | 0.637 | S | S | . | * | H | α-helix | trans | -65.4 | -34.8 | 175.2 | -57.1 | 0 | 0 | 0 | 0 | 112.5 | E109 R115 L116 | E109-T113 PolarHBondContact O-N 3.33Å; E109-T113 PolarHBondContact O-OG1 2.85Å; T113-R115 PolarHBondContact O-N 3.37Å; T113-L116 PolarHBondContact O-N 2.96Å |
| 114 | S | 56.9 | Low | 62.1 | Low | 92 Ų | 92 | 123 Ų | 123 | 64% | 0.643 | 64% | 0.641 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -64.9 | -16.3 | 175.9 | -174.2 | 0 | 0 | 0 | 0 | 114.2 | K112 | K112-S114 VanDerWaalsContact C-N 3.34Å; K112-S114 PolarHBondContact O-N 3.08Å |
| 115 | R | 57 | Low | 59.4 | Low | 215 Ų | 215 | 127.4 Ų | 127.4 | 81% | 0.811 | 66% | 0.657 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89.7 | -5 | 177.8 | -78.9 | -73.2 | -170.9 | -178 | 0.9 | 113.8 | K112 T113 | K112-R115 PolarHBondContact O-N 3.22Å; T113-R115 PolarHBondContact O-N 3.37Å |
| 116 | L | 54.9 | Low | 56.8 | Low | 145 Ų | 145 | 130.7 Ų | 130.7 | 76% | 0.759 | 68% | 0.68 | S | S | * | * | S | Bend | trans | -109.9 | 2.1 | -176.8 | -69.3 | 171.8 | 0 | 0 | 0 | 114 | T113 | T113-L116 PolarHBondContact O-N 2.96Š|
| 117 | Q | 49.3 | Very low | 54.5 | Low | 168 Ų | 168 | 128.7 Ų | 128.7 | 79% | 0.785 | 68% | 0.682 | S | S | * | * | S | Bend | trans | -107.6 | 0.9 | 174.4 | -71 | -175.6 | 29.5 | 0 | 0 | 113.7 | ||
| 118 | D | 44.6 | Very low | 51.6 | Low | 158 Ų | 158 | 132 Ų | 132 | 85% | 0.845 | 70% | 0.7 | S | S | * | * | S | Bend | trans | -102.3 | 79.2 | 172.5 | -159.3 | -109.5 | 0 | 0 | 0 | 107.9 | ||
| 119 | G | 48.3 | Very low | 49.2 | Very low | 79 Ų | 79 | 133.7 Ų | 133.7 | 81% | 0.814 | 72% | 0.718 | S | S | * | * | trans | 179.7 | 15.1 | -169.3 | 0 | 0 | 0 | 0 | 0 | 116.8 | ||||
| 120 | D | 48.2 | Very low | 47.4 | Very low | 140 Ų | 140 | 133.6 Ų | 133.6 | 75% | 0.749 | 73% | 0.727 | S | S | * | * | trans | -123.4 | 140.2 | 173.9 | -172.1 | -122.2 | 0 | 0 | 0 | 110.7 | ||||
| 121 | K | 36.2 | Very low | 45.6 | Very low | 162 Ų | 162 | 134.3 Ų | 134.3 | 70% | 0.704 | 74% | 0.736 | S | S | * | * | trans | 64.8 | 96.9 | 179.1 | -69.8 | 175.8 | 175 | -179.9 | 0 | 119.4 | ||||
| 122 | H | 33.1 | Very low | 44.6 | Very low | 177 Ų | 177 | 136.8 Ų | 136.8 | 82% | 0.819 | 75% | 0.751 | S | S | * | * | 171.1 | 121.2 | 91.6 | -99.2 | -77.1 | 0 | 0 | 0 | 111.6 | |||||
| 123 | Q | 34.9 | Very low | 43.5 | Very low | 189 Ų | 189 | 135.3 Ų | 135.3 | 88% | 0.883 | 76% | 0.757 | S | S | * | * | trans | -138.8 | 121 | 156.4 | -160.4 | -172.7 | 41.2 | 0 | 0 | 109.5 | ||||
| 124 | P | 35.5 | Very low | 42.1 | Very low | 117 Ų | 117 | 134.8 Ų | 134.8 | 76% | 0.76 | 77% | 0.768 | S | S | * | * | P | Polyproline II helix | trans | -80 | 138.1 | 173.2 | -10.8 | 27.7 | 0 | 0 | 0 | 112 | ||
| 125 | R | 36.1 | Very low | 41 | Very low | 218 Ų | 218 | 138.6 Ų | 138.6 | 82% | 0.823 | 78% | 0.78 | S | S | * | * | P | Polyproline II helix | trans | -77.7 | 145.1 | 173.1 | 158 | -169 | -83.8 | -85.5 | 10.2 | 111.6 | ||
| 126 | P | 37.9 | Very low | 39.7 | Very low | 105 Ų | 105 | 134.5 Ų | 134.5 | 68% | 0.682 | 78% | 0.779 | S | S | * | * | P | Polyproline II helix | trans | -92.9 | 155.5 | 153.4 | 34.4 | -29.7 | 0 | 0 | 0 | 112.7 | ||
| 127 | P | 43.1 | Very low | 39 | Very low | 109 Ų | 109 | 133 Ų | 133 | 71% | 0.708 | 78% | 0.778 | S | S | * | * | trans | -98.5 | -178.7 | -159.2 | 39.3 | -38.1 | 0 | 0 | 0 | 116.2 | ||||
| 128 | S | 29.3 | Very low | 38 | Very low | 105 Ų | 105 | 129.7 Ų | 129.7 | 73% | 0.734 | 77% | 0.774 | S | S | * | * | trans | 79.1 | 138.2 | 175.3 | -44.6 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 129 | S | 35.7 | Very low | 37.4 | Very low | 114 Ų | 114 | 127.6 Ų | 127.6 | 80% | 0.797 | 77% | 0.771 | S | S | * | * | cis | -154.5 | 177.4 | -3.8 | -103.5 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 130 | P | 44 | Very low | 36.7 | Very low | 110 Ų | 110 | 129.8 Ų | 129.8 | 71% | 0.714 | 77% | 0.771 | S | S | * | * | trans | -103.6 | 144.4 | -147.2 | 37.5 | -35.9 | 0 | 0 | 0 | 119.4 | ||||
| 131 | S | 35.9 | Very low | 35.8 | Very low | 110 Ų | 110 | 129.4 Ų | 129.4 | 77% | 0.769 | 77% | 0.774 | S | S | * | * | trans | 61.6 | 166.3 | 135.2 | -58.7 | 0 | 0 | 0 | 0 | 122.1 | ||||
| 132 | P | 49.5 | Very low | 35.5 | Very low | 122 Ų | 122 | 126.9 Ų | 126.9 | 79% | 0.792 | 78% | 0.777 | S | S | * | * | cis | -128.4 | -139.5 | -46.6 | 35.6 | -14.6 | 0 | 0 | 0 | 112.2 | ||||
| 133 | P | 45.9 | Very low | 35.3 | Very low | 126 Ų | 126 | 125.7 Ų | 125.7 | 82% | 0.818 | 78% | 0.777 | S | S | * | * | -110.2 | 169.6 | -115.4 | 40.8 | -25.1 | 0 | 0 | 0 | 116.1 | |||||
| 134 | G | 27.7 | Very low | 35.9 | Very low | 69 Ų | 69 | 121.5 Ų | 121.5 | 71% | 0.711 | 77% | 0.766 | S | S | * | * | trans | -168.4 | 95.6 | 174.1 | 0 | 0 | 0 | 0 | 0 | 117.4 | ||||
| 135 | L | 33.2 | Very low | 35.5 | Very low | 173 Ų | 173 | 122.1 Ų | 122.1 | 91% | 0.906 | 76% | 0.763 | S | S | * | * | trans | 55.3 | 121.4 | 140.2 | -55.2 | 176.3 | 0 | 0 | 0 | 121.8 | ||||
| 136 | T | 30.5 | Very low | 35.3 | Very low | 128 Ų | 128 | 119.5 Ų | 119.5 | 79% | 0.785 | 76% | 0.757 | S | S | * | * | trans | -60.2 | 164.7 | 147.1 | 45.1 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 137 | P | 41.4 | Very low | 34.8 | Very low | 113 Ų | 113 | 122.6 Ų | 122.6 | 73% | 0.734 | 76% | 0.763 | S | S | * | * | cis | -156 | -171 | 47 | 41.6 | -17.4 | 0 | 0 | 0 | 119.4 | ||||
| 138 | S | 28.1 | Very low | 34.2 | Very low | 100 Ų | 100 | 125 Ų | 125 | 70% | 0.699 | 77% | 0.769 | S | S | * | * | trans | 93.4 | 96.1 | 148.6 | -59.2 | 0 | 0 | 0 | 0 | 120.7 | ||||
| 139 | S | 30.1 | Very low | 34.3 | Very low | 113 Ų | 113 | 126.5 Ų | 126.5 | 79% | 0.79 | 77% | 0.769 | S | S | * | * | 62.4 | 125.4 | 119.1 | -52.7 | 0 | 0 | 0 | 0 | 121.5 | |||||
| 140 | P | 34 | Very low | 34.7 | Very low | 125 Ų | 125 | 125.6 Ų | 125.6 | 81% | 0.812 | 76% | 0.76 | S | S | * | * | trans | -94.2 | 151.1 | 171.8 | 37.3 | -32.9 | 0 | 0 | 0 | 113.4 | ||||
| 141 | T | 29.1 | Very low | 33.9 | Very low | 132 Ų | 132 | 128.1 Ų | 128.1 | 81% | 0.81 | 76% | 0.763 | S | S | * | * | trans | -143.2 | 115.3 | 164.3 | 53.9 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 142 | S | 30.2 | Very low | 33.5 | Very low | 110 Ų | 110 | 128.2 Ų | 128.2 | 77% | 0.769 | 76% | 0.763 | S | S | * | * | trans | 59.4 | 110.4 | 144 | -53.8 | 0 | 0 | 0 | 0 | 122.1 | ||||
| 143 | D | 30.3 | Very low | 32.6 | Very low | 152 Ų | 152 | 128.3 Ų | 128.3 | 81% | 0.813 | 77% | 0.766 | S | S | * | * | 12.1 | 168 | 124.2 | -73.3 | -78.1 | 0 | 0 | 0 | 122.4 | |||||
| 144 | P | 46.7 | Very low | 32.3 | Very low | 100 Ų | 100 | 128 Ų | 128 | 65% | 0.649 | 76% | 0.764 | S | S | * | * | cis | -141.5 | 159.9 | -31.4 | 36.8 | -20.6 | 0 | 0 | 0 | 114.7 | ||||
| 145 | N | 26.7 | Very low | 32.2 | Very low | 131 Ų | 131 | 129.6 Ų | 129.6 | 70% | 0.701 | 76% | 0.764 | S | S | * | * | trans | -179.3 | 155.2 | 142.1 | -115.1 | -69.9 | 0 | 0 | 0 | 117.4 | ||||
| 146 | K | 31.5 | Very low | 32 | Very low | 163 Ų | 163 | 127.5 Ų | 127.5 | 71% | 0.709 | 75% | 0.753 | S | S | * | * | trans | 46.6 | 114 | 151.7 | -74.2 | 147.7 | -169.4 | -64.3 | 0 | 119.4 | ||||
| 147 | Q | 28.4 | Very low | 31.8 | Very low | 170 Ų | 170 | 129.4 Ų | 129.4 | 79% | 0.794 | 75% | 0.75 | S | S | * | * | 80.6 | 103.2 | 68 | -178.8 | -172.3 | -24.9 | 0 | 0 | 113.4 | |||||
| 148 | D | 30.2 | Very low | 31.2 | Very low | 158 Ų | 158 | 130.8 Ų | 130.8 | 85% | 0.845 | 75% | 0.752 | S | S | * | * | -159.5 | 146.3 | 128.7 | -143.3 | -156.5 | 0 | 0 | 0 | 111.9 | |||||
| 149 | D | 30.6 | Very low | 31.3 | Very low | 138 Ų | 138 | 131 Ų | 131 | 74% | 0.738 | 75% | 0.753 | S | S | * | * | trans | -100.3 | -170.7 | 168.6 | -153.3 | -138 | 0 | 0 | 0 | 106.4 | ||||
| 150 | P | 44.7 | Very low | 31.7 | Very low | 94 Ų | 94 | 130.6 Ų | 130.6 | 61% | 0.61 | 75% | 0.748 | S | S | * | * | cis | -140.4 | -169.9 | 2 | 38.9 | -16.2 | 0 | 0 | 0 | 116.8 | ||||
| 151 | Q | 26.8 | Very low | 31.4 | Very low | 164 Ų | 164 | 132.2 Ų | 132.2 | 77% | 0.766 | 75% | 0.749 | S | S | * | * | trans | 92.6 | 104 | 140.8 | -146.8 | 86.5 | -42.9 | 0 | 0 | 119.6 | ||||
| 152 | S | 28.2 | Very low | 31.5 | Very low | 111 Ų | 111 | 131.4 Ų | 131.4 | 78% | 0.776 | 74% | 0.744 | S | S | * | * | 170 | 109.9 | 107.7 | -72.3 | 0 | 0 | 0 | 0 | 114.8 | |||||
| 153 | C | 30.8 | Very low | 31.7 | Very low | 125 Ų | 125 | 132.4 Ų | 132.4 | 85% | 0.845 | 75% | 0.748 | S | S | * | * | trans | -80.8 | 169 | 148.2 | -62.4 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 154 | P | 39.3 | Very low | 31.6 | Very low | 120 Ų | 120 | 129.7 Ų | 129.7 | 78% | 0.779 | 74% | 0.74 | S | S | * | * | cis | -145.5 | 149.2 | 42.9 | 37 | -13.3 | 0 | 0 | 0 | 117.1 | ||||
| 155 | S | 25.4 | Very low | 31 | Very low | 102 Ų | 102 | 133.1 Ų | 133.1 | 71% | 0.713 | 75% | 0.747 | S | S | * | * | 68.6 | 130.7 | 95.1 | -157.4 | 0 | 0 | 0 | 0 | 117.8 | |||||
| 156 | L | 29.9 | Very low | 31.5 | Very low | 129 Ų | 129 | 134.4 Ų | 134.4 | 68% | 0.675 | 75% | 0.754 | S | S | * | * | 150.4 | 136.7 | 119.9 | -81.2 | 175.8 | 0 | 0 | 0 | 115.7 | |||||
| 157 | K | 25.7 | Very low | 31.8 | Very low | 167 Ų | 167 | 132.8 Ų | 132.8 | 73% | 0.726 | 76% | 0.76 | S | S | * | * | trans | 68.4 | 150.2 | 147.6 | -62.1 | 163.2 | -174.5 | 174.1 | 0 | 118 | ||||
| 158 | D | 27.8 | Very low | 32 | Very low | 143 Ų | 143 | 130.3 Ų | 130.3 | 77% | 0.765 | 76% | 0.756 | S | S | * | * | cis | -151.2 | 166 | -9.3 | -128.3 | -58.3 | 0 | 0 | 0 | 109.7 | ||||
| 159 | S | 31.7 | Very low | 31.8 | Very low | 103 Ų | 103 | 129.6 Ų | 129.6 | 72% | 0.72 | 76% | 0.758 | S | S | * | * | trans | -101.3 | 172.4 | 170.3 | -53.2 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 160 | P | 37.9 | Very low | 31.8 | Very low | 105 Ų | 105 | 130.9 Ų | 130.9 | 68% | 0.682 | 76% | 0.759 | S | S | * | * | -161.3 | 179.1 | 74.3 | 42.6 | -19.8 | 0 | 0 | 0 | 117.8 | |||||
| 161 | L | 28.4 | Very low | 31.1 | Very low | 160 Ų | 160 | 135 Ų | 135 | 84% | 0.838 | 77% | 0.772 | S | S | * | * | trans | 67.8 | 141 | 159.4 | -50.6 | -173.2 | 0 | 0 | 0 | 118.2 | ||||
| 162 | T | 30.2 | Very low | 31.5 | Very low | 115 Ų | 115 | 134 Ų | 134 | 71% | 0.706 | 77% | 0.772 | S | S | * | * | cis | -149.8 | 163.8 | -6.2 | 46.8 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 163 | P | 33.9 | Very low | 31.8 | Very low | 131 Ų | 131 | 134.5 Ų | 134.5 | 85% | 0.851 | 78% | 0.776 | S | S | * | * | trans | -131.9 | 125.3 | 153.7 | 34.7 | -20.5 | 0 | 0 | 0 | 113.2 | ||||
| 164 | S | 29.6 | Very low | 32.1 | Very low | 94 Ų | 94 | 133 Ų | 133 | 66% | 0.657 | 77% | 0.773 | S | S | * | * | trans | -127.9 | 114.6 | 179.3 | -93.4 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 165 | H | 33.9 | Very low | 31.7 | Very low | 173 Ų | 173 | 134.4 Ų | 134.4 | 80% | 0.801 | 77% | 0.774 | S | S | * | * | trans | 62.3 | 110.8 | 150.9 | -47.5 | -63.4 | 0 | 0 | 0 | 121.1 | ||||
| 166 | L | 37.2 | Very low | 32.2 | Very low | 158 Ų | 158 | 133.3 Ų | 133.3 | 83% | 0.827 | 77% | 0.771 | S | S | * | * | P | Polyproline II helix | trans | -94.9 | 152.4 | 140.1 | -73.8 | 83.4 | 0 | 0 | 0 | 109 | ||
| 167 | P | 37.9 | Very low | 32.2 | Very low | 129 Ų | 129 | 134.7 Ų | 134.7 | 84% | 0.838 | 77% | 0.774 | S | S | * | * | P | Polyproline II helix | trans | -82.3 | 127.2 | 153.6 | 31.8 | -27.8 | 0 | 0 | 0 | 110.4 | ||
| 168 | T | 30.8 | Very low | 32.4 | Very low | 117 Ų | 117 | 133.2 Ų | 133.2 | 72% | 0.718 | 77% | 0.773 | S | S | * | * | P | Polyproline II helix | trans | -94.3 | 129.1 | 172 | -67.8 | 0 | 0 | 0 | 0 | 109.6 | Q170 | T168-Q170 HydrophobicContact CG2-CG 4.08Š|
| 169 | T | 27.5 | Very low | 32.6 | Very low | 144 Ų | 144 | 131.2 Ų | 131.2 | 88% | 0.883 | 77% | 0.77 | S | S | * | * | trans | -110.5 | 103.9 | 158.5 | 33.7 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 170 | Q | 29.5 | Very low | 32.6 | Very low | 164 Ų | 164 | 132.9 Ų | 132.9 | 77% | 0.766 | 78% | 0.776 | S | S | * | * | trans | -76.4 | 149.6 | 164.3 | -81.2 | -172.5 | -4.1 | 0 | 0 | 110 | T168 | T168-Q170 HydrophobicContact CG2-CG 4.08Š| ||
| 171 | M | 30.6 | Very low | 32.3 | Very low | 180 Ų | 180 | 131.4 Ų | 131.4 | 89% | 0.887 | 78% | 0.78 | S | S | * | * | trans | -122.1 | 117.5 | 167.4 | 54.5 | -154.5 | 168.9 | 0 | 0 | 106.6 | ||||
| 172 | N | 35.6 | Very low | 32.7 | Very low | 143 Ų | 143 | 128.6 Ų | 128.6 | 77% | 0.765 | 78% | 0.78 | S | S | * | * | trans | -102.4 | 151.4 | 172.6 | -87 | 25.3 | 0 | 0 | 0 | 109.7 | ||||
| 173 | S | 33 | Very low | 33.4 | Very low | 123 Ų | 123 | 128.9 Ų | 128.9 | 86% | 0.86 | 78% | 0.784 | S | S | * | * | trans | -142.2 | 135.5 | 174.7 | -55.4 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 174 | A | 38.9 | Very low | 33.5 | Very low | 94 Ų | 94 | 130.3 Ų | 130.3 | 78% | 0.777 | 78% | 0.783 | S | S | * | * | trans | 175.7 | 145.1 | 165.4 | 0 | 0 | 0 | 0 | 0 | 104.8 | ||||
| 175 | D | 30.6 | Very low | 34.2 | Very low | 148 Ų | 148 | 131.1 Ų | 131.1 | 79% | 0.791 | 79% | 0.787 | S | S | * | * | cis | -136.6 | 144.1 | 18.4 | -124.6 | -145.4 | 0 | 0 | 0 | 108.5 | ||||
| 176 | A | 36.3 | Very low | 34.1 | Very low | 80 Ų | 80 | 128.4 Ų | 128.4 | 66% | 0.661 | 79% | 0.787 | S | S | * | * | 61.3 | 143.2 | 89.1 | 0 | 0 | 0 | 0 | 0 | 114 | |||||
| 177 | E | 30 | Very low | 34.3 | Very low | 158 Ų | 158 | 126.1 Ų | 126.1 | 74% | 0.738 | 78% | 0.784 | S | S | * | * | cis | -166.4 | 143.8 | -4.5 | -115.1 | -81.8 | 94.1 | 0 | 0 | 104.2 | ||||
| 178 | L | 29.5 | Very low | 34.8 | Very low | 136 Ų | 136 | 125.8 Ų | 125.8 | 71% | 0.712 | 78% | 0.782 | S | S | * | * | 170.7 | 143.7 | 90.9 | -110 | 147.6 | 0 | 0 | 0 | 110.2 | |||||
| 179 | S | 31.9 | Very low | 34.9 | Very low | 100 Ų | 100 | 125.4 Ų | 125.4 | 70% | 0.699 | 78% | 0.784 | S | S | * | * | trans | 45 | 140.2 | 134.1 | -84.7 | 0 | 0 | 0 | 0 | 122.5 | ||||
| 180 | V | 31.8 | Very low | 35.5 | Very low | 138 Ų | 138 | 123.1 Ų | 123.1 | 84% | 0.836 | 77% | 0.774 | S | S | * | * | cis | -153.4 | 154 | 4.8 | -169.2 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 181 | G | 30.9 | Very low | 35.8 | Very low | 75 Ų | 75 | 120.6 Ų | 120.6 | 77% | 0.773 | 78% | 0.775 | S | S | * | * | trans | 100.3 | 118.6 | 141.1 | 0 | 0 | 0 | 0 | 0 | 119.2 | ||||
| 182 | A | 36.3 | Very low | 36 | Very low | 101 Ų | 101 | 116.7 Ų | 116.7 | 84% | 0.835 | 77% | 0.771 | S | S | * | * | trans | -94.8 | 170.2 | 158.1 | 0 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 183 | P | 45.3 | Very low | 35.8 | Very low | 120 Ų | 120 | 114.6 Ų | 114.6 | 78% | 0.779 | 77% | 0.773 | S | S | * | * | cis | -134.1 | 179.6 | 12.4 | 41 | -22.3 | 0 | 0 | 0 | 117 | ||||
| 184 | L | 35.7 | Very low | 36 | Very low | 161 Ų | 161 | 116.6 Ų | 116.6 | 84% | 0.843 | 77% | 0.774 | S | S | * | * | trans | -48.2 | 150.8 | 163.6 | -76.3 | 156.8 | 0 | 0 | 0 | 112.7 | ||||
| 185 | P | 45.8 | Very low | 35.8 | Very low | 112 Ų | 112 | 118.2 Ų | 118.2 | 73% | 0.727 | 78% | 0.779 | S | S | * | * | -153 | 175.9 | 84.9 | 42.9 | -24.9 | 0 | 0 | 0 | 118.2 | |||||
| 186 | S | 30.8 | Very low | 35.8 | Very low | 115 Ų | 115 | 115.1 Ų | 115.1 | 80% | 0.804 | 78% | 0.782 | S | S | * | * | trans | 81.9 | 123.1 | 149.8 | -57.5 | 0 | 0 | 0 | 0 | 121.3 | ||||
| 187 | S | 41.3 | Very low | 35.8 | Very low | 110 Ų | 110 | 116.7 Ų | 116.7 | 77% | 0.769 | 79% | 0.788 | S | S | * | * | trans | -65.3 | 169.8 | 152.2 | -45.1 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 188 | P | 47.9 | Very low | 36 | Very low | 123 Ų | 123 | 115 Ų | 115 | 80% | 0.799 | 79% | 0.794 | S | S | * | * | -145.5 | 170.8 | 105.4 | 40.6 | -28.2 | 0 | 0 | 0 | 115.8 | |||||
| 189 | S | 33.9 | Very low | 36.1 | Very low | 108 Ų | 108 | 112.5 Ų | 112.5 | 76% | 0.755 | 80% | 0.801 | S | S | * | * | trans | -102.6 | 173.5 | 161 | -46.8 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 190 | S | 39.7 | Very low | 36.3 | Very low | 97 Ų | 97 | 115.2 Ų | 115.2 | 68% | 0.678 | 81% | 0.808 | S | S | * | * | cis | -158.2 | 170.4 | 20.2 | -67.6 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 191 | S | 36.7 | Very low | 37.3 | Very low | 111 Ų | 111 | 114 Ų | 114 | 78% | 0.776 | 80% | 0.803 | S | S | * | * | trans | 68.3 | 150.6 | 135.2 | 58.6 | 0 | 0 | 0 | 0 | 123 | ||||
| 192 | A | 35 | Very low | 37.2 | Very low | 97 Ų | 97 | 114.8 Ų | 114.8 | 80% | 0.802 | 80% | 0.802 | S | S | * | * | trans | 71.9 | 150 | 147.8 | 0 | 0 | 0 | 0 | 0 | 118.1 | ||||
| 193 | A | 29.8 | Very low | 37 | Very low | 100 Ų | 100 | 114.8 Ų | 114.8 | 83% | 0.826 | 80% | 0.802 | S | S | * | * | cis | -158.3 | -177.1 | -13.8 | 0 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 194 | L | 37.9 | Very low | 36.4 | Very low | 165 Ų | 165 | 113.5 Ų | 113.5 | 86% | 0.864 | 80% | 0.801 | S | S | * | * | trans | -72.6 | 158.8 | -173.5 | -61.7 | 153 | 0 | 0 | 0 | 114.8 | ||||
| 195 | S | 35.1 | Very low | 36.3 | Very low | 127 Ų | 127 | 110.5 Ų | 110.5 | 89% | 0.888 | 80% | 0.8 | S | S | * | * | trans | 122.6 | 129.6 | 136.2 | -55.4 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 196 | G | 30.2 | Very low | 36 | Very low | 83 Ų | 83 | 113.1 Ų | 113.1 | 86% | 0.856 | 81% | 0.807 | S | S | * | * | trans | 176.5 | 106.4 | 170.5 | 0 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 197 | S | 36.7 | Very low | 36.9 | Very low | 114 Ų | 114 | 113.3 Ų | 113.3 | 80% | 0.797 | 81% | 0.805 | S | S | * | * | trans | -112.5 | 164.5 | -165.7 | -176.5 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 198 | S | 33.9 | Very low | 36.5 | Very low | 123 Ų | 123 | 114.6 Ų | 114.6 | 86% | 0.86 | 80% | 0.803 | S | S | * | * | trans | 76 | 126.5 | 155 | 60 | 0 | 0 | 0 | 0 | 119.9 | ||||
| 199 | G | 30.6 | Very low | 36 | Very low | 83 Ų | 83 | 114.2 Ų | 114.2 | 86% | 0.856 | 80% | 0.799 | S | S | * | * | trans | 168.7 | 51.6 | 177.2 | 0 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 200 | D | 37.4 | Very low | 36.5 | Very low | 157 Ų | 157 | 115 Ų | 115 | 84% | 0.84 | 80% | 0.802 | S | S | * | * | trans | -111.1 | 165.4 | 165.1 | -120 | -73.8 | 0 | 0 | 0 | 107.2 | ||||
| 201 | P | 52.3 | Low | 36.9 | Very low | 113 Ų | 113 | 115.1 Ų | 115.1 | 73% | 0.734 | 80% | 0.803 | S | S | * | * | cis | -138.3 | 176.7 | 3.4 | 41.5 | -24.2 | 0 | 0 | 0 | 116.2 | ||||
| 202 | A | 29.8 | Very low | 37.3 | Very low | 90 Ų | 90 | 115.9 Ų | 115.9 | 74% | 0.744 | 81% | 0.805 | S | S | * | * | -179.5 | 125 | 129.3 | 0 | 0 | 0 | 0 | 0 | 114.2 | |||||
| 203 | A | 31.4 | Very low | 37.7 | Very low | 102 Ų | 102 | 115.2 Ų | 115.2 | 84% | 0.843 | 80% | 0.799 | S | S | * | * | trans | 29.7 | 135.1 | 141.2 | 0 | 0 | 0 | 0 | 0 | 120.3 | ||||
| 204 | A | 32.8 | Very low | 38.3 | Very low | 93 Ų | 93 | 116.5 Ų | 116.5 | 77% | 0.769 | 80% | 0.799 | S | S | * | * | cis | -175.2 | 161.5 | 42.2 | 0 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 205 | A | 32.4 | Very low | 38.4 | Very low | 98 Ų | 98 | 113.9 Ų | 113.9 | 81% | 0.81 | 80% | 0.795 | S | S | * | * | trans | 63.1 | 115.4 | 149 | 0 | 0 | 0 | 0 | 0 | 121.9 | ||||
| 206 | L | 41 | Very low | 38.9 | Very low | 166 Ų | 166 | 113.3 Ų | 113.3 | 87% | 0.869 | 79% | 0.788 | S | S | * | * | trans | -81.6 | 165 | 147.6 | -72.1 | 164 | 0 | 0 | 0 | 110 | ||||
| 207 | P | 49.7 | Very low | 39.4 | Very low | 119 Ų | 119 | 115.6 Ų | 115.6 | 77% | 0.773 | 79% | 0.786 | S | S | * | * | -144.4 | 154 | 95 | 32.3 | -14.1 | 0 | 0 | 0 | 116.9 | |||||
| 208 | D | 32.5 | Very low | 39.6 | Very low | 137 Ų | 137 | 115.6 Ų | 115.6 | 73% | 0.733 | 79% | 0.785 | S | S | * | * | trans | 8.7 | 146.8 | 131.2 | -92.6 | -90.3 | 0 | 0 | 0 | 120.2 | ||||
| 209 | T | 38 | Very low | 39.9 | Very low | 116 Ų | 116 | 113 Ų | 113 | 71% | 0.712 | 78% | 0.778 | S | S | * | * | cis | -167.7 | -172.8 | -6.9 | -0.2 | 0 | 0 | 0 | 0 | 106.2 | ||||
| 210 | P | 44.2 | Very low | 40.5 | Very low | 124 Ų | 124 | 117.7 Ų | 117.7 | 81% | 0.805 | 78% | 0.778 | S | S | * | * | cis | -128.8 | -147.5 | -9.1 | 40.9 | -19.9 | 0 | 0 | 0 | 113.6 | ||||
| 211 | S | 48 | Very low | 41.4 | Very low | 100 Ų | 100 | 113.4 Ų | 113.4 | 70% | 0.699 | 76% | 0.76 | S | S | * | * | trans | -92 | 155.5 | 176.2 | -166.8 | 0 | 0 | 0 | 0 | 113 | ||||
| 212 | P | 44.5 | Very low | 41.8 | Very low | 127 Ų | 127 | 115.6 Ų | 115.6 | 83% | 0.825 | 76% | 0.76 | S | S | * | * | -141.1 | 149.5 | 98.8 | 37.7 | -24.9 | 0 | 0 | 0 | 115.1 | |||||
| 213 | A | 42.7 | Very low | 43.5 | Very low | 83 Ų | 83 | 116.5 Ų | 116.5 | 69% | 0.686 | 75% | 0.749 | S | S | * | * | trans | -80.1 | 154.7 | 162.2 | 0 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 214 | P | 43.3 | Very low | 45.1 | Very low | 127 Ų | 127 | 117.5 Ų | 117.5 | 83% | 0.825 | 74% | 0.736 | S | S | * | * | -139.2 | 151.4 | 74.5 | 36.6 | -21.2 | 0 | 0 | 0 | 115.3 | |||||
| 215 | S | 40.5 | Very low | 46.7 | Very low | 110 Ų | 110 | 120.1 Ų | 120.1 | 77% | 0.769 | 73% | 0.731 | S | S | * | * | trans | -68.4 | 163.2 | 164.8 | -42.9 | 0 | 0 | 0 | 0 | 111 | ||||
| 216 | P | 45.8 | Very low | 48.1 | Very low | 115 Ų | 115 | 116 Ų | 116 | 75% | 0.747 | 70% | 0.697 | S | S | * | * | -149.4 | 160.5 | 90 | 39 | -22.1 | 0 | 0 | 0 | 116.7 | |||||
| 217 | T | 40 | Very low | 49.4 | Very low | 131 Ų | 131 | 112.3 Ų | 112.3 | 80% | 0.804 | 67% | 0.673 | S | S | * | * | trans | 49.9 | 97.9 | 147.8 | -170.1 | 0 | 0 | 0 | 0 | 120.8 | ||||
| 218 | S | 41.7 | Very low | 50.4 | Low | 113 Ų | 113 | 115.1 Ų | 115.1 | 79% | 0.79 | 67% | 0.674 | S | S | * | * | -155.6 | 124.4 | 112.9 | -172.4 | 0 | 0 | 0 | 0 | 109.2 | E220 | S218-E220 PolarHBondContact O-N 3.16Š| |||
| 219 | G | 39 | Very low | 52.4 | Low | 68 Ų | 68 | 114 Ų | 114 | 70% | 0.701 | 67% | 0.667 | S | S | * | * | trans | -70.9 | 116.4 | 171.2 | 0 | 0 | 0 | 0 | 0 | 109.3 | S221 | G219-S221 PolarHBondContact O-N 3.15Š| ||
| 220 | E | 42.9 | Very low | 54.7 | Low | 183 Ų | 183 | 110.3 Ų | 110.3 | 86% | 0.855 | 64% | 0.643 | S | S | * | * | trans | -62.2 | 88.1 | 166 | 52.8 | -175.5 | 98.7 | 0 | 0 | 109 | S218 | S218-E220 PolarHBondContact O-N 3.16Š| ||
| 221 | S | 56.8 | Low | 56.9 | Low | 67 Ų | 67 | 108.6 Ų | 108.6 | 47% | 0.469 | 62% | 0.621 | S | S | . | * | trans | -60.4 | 144.3 | -176.7 | 177.7 | 0 | 0 | 0 | 0 | 110 | G219 E223 E224 | G219-S221 PolarHBondContact O-N 3.15Å; S221-E223 PolarHBondContact O-N 3.41Å; S221-E223 WeakPolarHBondContact OG-CB 3.43Å; S221-E223 PolarHBondContact OG-N 3Å; S221-E224 PolarHBondContact O-N 2.87Å | ||
| 222 | E | 61.3 | Low | 59 | Low | 158 Ų | 158 | 104 Ų | 104 | 74% | 0.738 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -47.9 | -26.4 | 169.4 | -168.4 | -177.2 | 118 | 0 | 0 | 111.8 | A226 | E222-A226 VanDerWaalsContact O-CB 3.28Å; E222-A226 WeakPolarHBondContact O-CB 3.25Å; E222-A226 PolarHBondContact O-N 3.21Å |
| 223 | E | 65 | Low | 61 | Low | 110 Ų | 110 | 100.5 Ų | 100.5 | 51% | 0.514 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -66.3 | -32.7 | 174.8 | -158.8 | -174.9 | 128.1 | 0 | 0 | 114.9 | S221 A226 K227 | S221-E223 PolarHBondContact O-N 3.41Å; S221-E223 WeakPolarHBondContact OG-CB 3.43Å; S221-E223 PolarHBondContact OG-N 3Å; E223-A226 PolarHBondContact O-N 3.19Å; E223-K227 WeakPolarHBondContact O-CB 3.49Å; E223-K227 WeakPolarHBondContact O-CD 3.36Å; E223-K227 VanDerWaalsContact O-CG 3.25Å; E223-K227 WeakPolarHBondContact O-CG 2.94Å; E223-K227 PolarHBondContact O-N 3Å; E223-K227 WeakPolarHBondContact OE1-CE 3.49Å; E223-K227 IonicContact OE1-NZ 3.77Å; E223-K227 PolarHBondContact OE1-NZ 2.87Å |
| 224 | E | 64.6 | Low | 63.1 | Low | 122 Ų | 122 | 99 Ų | 99 | 57% | 0.57 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -72.5 | -43.4 | 175.8 | -161.3 | -150.7 | 127.7 | 0 | 0 | 110.7 | S221 A226 K227 K228 | S221-E224 PolarHBondContact O-N 2.87Å; E224-A226 VanDerWaalsContact C-N 3.26Å; E224-A226 PolarHBondContact O-N 3.45Å; E224-K227 WeakPolarHBondContact O-CB 3.48Å; E224-K227 PolarHBondContact O-N 3.48Å; E224-K227 VanDerWaalsContact O-N 3.12Å; E224-K228 PolarHBondContact O-N 3.36Å |
| 225 | K | 65.7 | Low | 65.2 | Low | 149 Ų | 149 | 94.4 Ų | 94.4 | 65% | 0.648 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -60.2 | -38.3 | 171.1 | -170.8 | 174 | -178.3 | 174.9 | 0 | 111.3 | K228 L229 | K225-K228 PolarHBondContact O-N 3.44Å; K225-L229 HydrophobicContact CG-CD1 4.07Å; K225-L229 WeakPolarHBondContact O-CB 3.37Å; K225-L229 VanDerWaalsContact O-CG 3.28Å; K225-L229 WeakPolarHBondContact O-CG 3.2Å; K225-L229 PolarHBondContact O-N 3.34Å |
| 226 | A | 63.1 | Low | 67.5 | Low | 12 Ų | 12 | 96.9 Ų | 96.9 | 10% | 0.099 | 52% | 0.515 | C | S | . | . | H | α-helix | trans | -66.7 | -38.6 | 173.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | E222 E223 E224 L229 L230 Y231 | E222-A226 VanDerWaalsContact O-CB 3.28Å; E222-A226 WeakPolarHBondContact O-CB 3.25Å; E222-A226 PolarHBondContact O-N 3.21Å; E223-A226 PolarHBondContact O-N 3.19Å; E224-A226 VanDerWaalsContact C-N 3.26Å; E224-A226 PolarHBondContact O-N 3.45Å; A226-L229 CarbonylContact O-C 3.4Å; A226-L229 PolarHBondContact O-N 2.91Å; A226-L230 PolarHBondContact O-N 3.33Å; A226-Y231 WeakPolarHBondContact CB-O 3.37Å; A226-Y231 PolarHBondContact O-N 3.27Å |
| 227 | K | 69 | Low | 69.4 | Low | 87 Ų | 87 | 94.5 Ų | 94.5 | 38% | 0.378 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -62.7 | -43.4 | 171.4 | -75.8 | 161.3 | -173.6 | 162.3 | 0 | 111.7 | E223 E224 L229 L230 L242 L245 | E223-K227 WeakPolarHBondContact O-CB 3.49Å; E223-K227 WeakPolarHBondContact O-CD 3.36Å; E223-K227 VanDerWaalsContact O-CG 3.25Å; E223-K227 WeakPolarHBondContact O-CG 2.94Å; E223-K227 PolarHBondContact O-N 3Å; E223-K227 WeakPolarHBondContact OE1-CE 3.49Å; E223-K227 IonicContact OE1-NZ 3.77Å; E223-K227 PolarHBondContact OE1-NZ 2.87Å; E224-K227 WeakPolarHBondContact O-CB 3.48Å; E224-K227 PolarHBondContact O-N 3.48Å; E224-K227 VanDerWaalsContact O-N 3.12Å; K227-L229 VanDerWaalsContact C-N 3.32Å; K227-L229 PolarHBondContact O-N 3.01Å; K227-L230 WeakPolarHBondContact O-CD2 3.3Å; K227-L230 PolarHBondContact O-N 3.45Å; K227-L230 VanDerWaalsContact O-N 3.1Å; K227-L242 HydrophobicContact CB-CD2 4.04Å; K227-L242 HydrophobicContact CG-CD2 4.42Å; K227-L245 HydrophobicContact CG-CD2 4.33Å |
| 228 | K | 69.1 | Low | 71.8 | Confident | 179 Ų | 179 | 91.6 Ų | 91.6 | 78% | 0.778 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -65.5 | -31.9 | 175.4 | -170.5 | 171.3 | -176.9 | 171.8 | 0 | 113.2 | E224 K225 L230 | E224-K228 PolarHBondContact O-N 3.36Å; K225-K228 PolarHBondContact O-N 3.44Å; K228-L230 VanDerWaalsContact C-N 3.34Å |
| 229 | L | 74.3 | Confident | 74.1 | Confident | 114 Ų | 114 | 88 Ų | 88 | 60% | 0.597 | 46% | 0.46 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -89.9 | 5.4 | 173.4 | -67.2 | 171.3 | 0 | 0 | 0 | 113.6 | K225 A226 K227 Y231 | K225-L229 HydrophobicContact CG-CD1 4.07Å; K225-L229 WeakPolarHBondContact O-CB 3.37Å; K225-L229 VanDerWaalsContact O-CG 3.28Å; K225-L229 WeakPolarHBondContact O-CG 3.2Å; K225-L229 PolarHBondContact O-N 3.34Å; A226-L229 CarbonylContact O-C 3.4Å; A226-L229 PolarHBondContact O-N 2.91Å; K227-L229 VanDerWaalsContact C-N 3.32Å; K227-L229 PolarHBondContact O-N 3.01Å; L229-Y231 PolarHBondContact O-N 2.99Å; L229-Y231 VanDerWaalsContact O-N 3.15Å |
| 230 | L | 87.3 | Confident | 76.6 | Confident | 38 Ų | 38 | 91.4 Ų | 91.4 | 20% | 0.199 | 46% | 0.463 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 51.3 | 37.1 | -179.7 | -57.4 | 174.5 | 0 | 0 | 0 | 113.4 | A226 K227 K228 A238 V239 N240 S241 L242 | A226-L230 PolarHBondContact O-N 3.33Å; K227-L230 WeakPolarHBondContact O-CD2 3.3Å; K227-L230 PolarHBondContact O-N 3.45Å; K227-L230 VanDerWaalsContact O-N 3.1Å; K228-L230 VanDerWaalsContact C-N 3.34Å; L230-A238 CarbonylContact O-C 3.59Å; L230-A238 WeakPolarHBondContact O-CA 3Å; L230-V239 HydrophobicContact CB-CG2 4.35Å; L230-V239 WeakPolarHBondContact CB-O 3.42Å; L230-V239 WeakPolarHBondContact O-CG2 3.34Å; L230-V239 PolarHBondContact O-N 3.24Å; L230-N240 WeakPolarHBondContact CD1-O 3.48Å; L230-S241 VanDerWaalsContact CD2-C 3.49Å; L230-L242 HydrophobicContact CD2-CB 4.11Å; L230-L242 HydrophobicContact CD2-CD2 3.98Å; L230-L242 HydrophobicContact CD2-CG 3.68Å; L230-L242 VanDerWaalsContact CD2-N 3.26Å |
| 231 | Y | 91.1 | Very high | 78.8 | Confident | 87 Ų | 87 | 85 Ų | 85 | 34% | 0.341 | 44% | 0.438 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -117.5 | 134.8 | -168.1 | 179.6 | -106.6 | 0 | 0 | 0 | 112.3 | A226 L229 K236 A238 | A226-Y231 WeakPolarHBondContact CB-O 3.37Å; A226-Y231 PolarHBondContact O-N 3.27Å; L229-Y231 PolarHBondContact O-N 2.99Å; L229-Y231 VanDerWaalsContact O-N 3.15Å; Y231-K236 WeakPolarHBondContact OH-CA 3.43Å; Y231-K236 WeakPolarHBondContact OH-CB 3.46Å; Y231-A238 HydrophobicContact CD2-CB 4.17Å |
| 232 | C | 90.4 | Very high | 80.3 | Confident | 4 Ų | 4 | 85.9 Ų | 85.9 | 3% | 0.027 | 44% | 0.437 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -95.2 | 106.6 | 171.4 | -177 | 0 | 0 | 0 | 0 | 110.6 | L234 C235 K236 V237 L245 H248 H254 | C232-L234 PolarHBondContact O-N 2.9Å; C232-C235 HydrophobicContact CB-CB 4.33Å; C232-C235 PolarHBondContact O-N 3.41Å; C232-C235 PolarHBondContact SG-N 2.92Å; C232-C235 VanDerWaalsContact SG-N 3.39Å; C232-K236 WeakPolarHBondContact O-CA 3.45Å; C232-K236 PolarHBondContact O-N 3.49Å; C232-V237 PolarHBondContact N-O 2.96Å; C232-V237 PolarHBondContact O-N 3.09Å; C232-L245 HydrophobicContact CB-CD1 3.94Å; C232-H248 PolarHBondContact SG-NE2 3.1Å; C232-H248 VanDerWaalsContact SG-NE2 3.36Å; C232-H254 PolarHBondContact SG-CE1 3.12Å; C232-H254 PolarHBondContact SG-ND1 3.43Å |
| 233 | S | 86.8 | Confident | 81.7 | Confident | 54 Ų | 54 | 82 Ų | 82 | 38% | 0.378 | 43% | 0.428 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -62.3 | -29.2 | 176.3 | 60.4 | 0 | 0 | 0 | 0 | 113.6 | ||
| 234 | L | 87.4 | Confident | 82.9 | Confident | 52 Ų | 52 | 81.3 Ų | 81.3 | 27% | 0.272 | 42% | 0.424 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -74.4 | -41.1 | 179.5 | -64.8 | -176 | 0 | 0 | 0 | 113.1 | C232 L258 R261 | C232-L234 PolarHBondContact O-N 2.9Å; L234-L258 HydrophobicContact CD1-CB 4.01Å; L234-L258 HydrophobicContact CD1-CD1 3.79Å; L234-L258 HydrophobicContact CD1-CG 3.85Å; L234-R261 PolarHBondContact O-NH1 3.11Å |
| 235 | C | 86.8 | Confident | 84.2 | Confident | 30 Ų | 30 | 75.7 Ų | 75.7 | 20% | 0.203 | 40% | 0.398 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -99.8 | -9.3 | -178.2 | -63.9 | 0 | 0 | 0 | 0 | 113.9 | C232 V237 H248 | C232-C235 HydrophobicContact CB-CB 4.33Å; C232-C235 PolarHBondContact O-N 3.41Å; C232-C235 PolarHBondContact SG-N 2.92Å; C232-C235 VanDerWaalsContact SG-N 3.39Å; C235-V237 VanDerWaalsContact C-N 3.3Å; C235-V237 HydrophobicContact CB-CG2 4.24Å; C235-V237 PolarHBondContact O-N 3.35Å; C235-H248 WeakPolarHBondContact CB-NE2 3.5Å; C235-H248 PolarHBondContact SG-NE2 3.04Å; C235-H248 VanDerWaalsContact SG-NE2 3.4Å |
| 236 | K | 89.1 | Confident | 85.3 | Confident | 161 Ų | 161 | 73.3 Ų | 73.3 | 70% | 0.7 | 39% | 0.389 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 57.4 | 33.4 | -173.3 | -56.8 | -171.8 | 177.8 | -173.8 | 0 | 115 | Y231 C232 | Y231-K236 WeakPolarHBondContact OH-CA 3.43Å; Y231-K236 WeakPolarHBondContact OH-CB 3.46Å; C232-K236 WeakPolarHBondContact O-CA 3.45Å; C232-K236 PolarHBondContact O-N 3.49Å |
| 237 | V | 86.9 | Confident | 86.8 | Confident | 66 Ų | 66 | 75.8 Ų | 75.8 | 40% | 0.4 | 41% | 0.41 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -110.6 | 129.8 | -179.8 | -179 | 0 | 0 | 0 | 0 | 109.8 | C232 C235 V239 | C232-V237 PolarHBondContact N-O 2.96Å; C232-V237 PolarHBondContact O-N 3.09Å; C235-V237 VanDerWaalsContact C-N 3.3Å; C235-V237 HydrophobicContact CB-CG2 4.24Å; C235-V237 PolarHBondContact O-N 3.35Å; V237-V239 HydrophobicContact CG1-CG1 4.1Å |
| 238 | A | 89.9 | Confident | 87.9 | Confident | 69 Ų | 69 | 73.8 Ų | 73.8 | 57% | 0.57 | 40% | 0.401 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -91 | 142 | 163.7 | 0 | 0 | 0 | 0 | 0 | 109.7 | L230 Y231 | L230-A238 CarbonylContact O-C 3.59Å; L230-A238 WeakPolarHBondContact O-CA 3Å; Y231-A238 HydrophobicContact CD2-CB 4.17Å |
| 239 | V | 89.8 | Confident | 88.9 | Confident | 37 Ų | 37 | 67.9 Ų | 67.9 | 22% | 0.224 | 38% | 0.378 | C | S | . | . | trans | -126.7 | 169.7 | 178.1 | -64.1 | 0 | 0 | 0 | 0 | 110.5 | L230 V237 Q244 L245 | L230-V239 HydrophobicContact CB-CG2 4.35Å; L230-V239 WeakPolarHBondContact CB-O 3.42Å; L230-V239 WeakPolarHBondContact O-CG2 3.34Å; L230-V239 PolarHBondContact O-N 3.24Å; V237-V239 HydrophobicContact CG1-CG1 4.1Å; V239-Q244 HydrophobicContact CB-CB 4Å; V239-Q244 HydrophobicContact CG2-CB 4.02Å; V239-L245 HydrophobicContact CG2-CB 3.64Å; V239-L245 HydrophobicContact CG2-CD1 4.11Å; V239-L245 HydrophobicContact CG2-CG 4.46Å | ||
| 240 | N | 90.3 | Very high | 89.7 | Confident | 141 Ų | 141 | 69.8 Ų | 69.8 | 75% | 0.754 | 38% | 0.382 | S | S | * | . | S | Bend | trans | -92.6 | -15.7 | -166.9 | -169.6 | -89 | 0 | 0 | 0 | 114 | L230 | L230-N240 WeakPolarHBondContact CD1-O 3.48Š|
| 241 | S | 89.8 | Confident | 89.9 | Confident | 49 Ų | 49 | 69.2 Ų | 69.2 | 34% | 0.343 | 39% | 0.385 | S | S | . | . | S | Bend | trans | -144.8 | 154.8 | 177.2 | -174.3 | 0 | 0 | 0 | 0 | 112.7 | L230 S243 Q244 L245 | L230-S241 VanDerWaalsContact CD2-C 3.49Å; S241-S243 PolarHBondContact O-N 3.22Å; S241-S243 PolarHBondContact OG-OG 2.92Å; S241-Q244 WeakPolarHBondContact O-CB 3.4Å; S241-Q244 PolarHBondContact O-N 3.21Å; S241-L245 PolarHBondContact O-N 3.3Å; S241-L245 VanDerWaalsContact O-N 3.09Å |
| 242 | L | 89.4 | Confident | 89.8 | Confident | 85 Ų | 85 | 70.4 Ų | 70.4 | 45% | 0.445 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -58.7 | -38.7 | 177.9 | -97.6 | 177.5 | 0 | 0 | 0 | 111.5 | K227 L230 Q244 L245 E246 | K227-L242 HydrophobicContact CB-CD2 4.04Å; K227-L242 HydrophobicContact CG-CD2 4.42Å; L230-L242 HydrophobicContact CD2-CB 4.11Å; L230-L242 HydrophobicContact CD2-CD2 3.98Å; L230-L242 HydrophobicContact CD2-CG 3.68Å; L230-L242 VanDerWaalsContact CD2-N 3.26Å; L242-Q244 VanDerWaalsContact C-N 3.27Å; L242-Q244 PolarHBondContact O-N 2.89Å; L242-L245 HydrophobicContact CD2-CD2 4.5Å; L242-L245 WeakPolarHBondContact O-CB 3.44Å; L242-L245 PolarHBondContact O-N 2.82Å; L242-E246 PolarHBondContact O-N 2.93Å |
| 243 | S | 90.2 | Very high | 89.6 | Confident | 77 Ų | 77 | 78.6 Ų | 78.6 | 54% | 0.538 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -61.8 | -34.6 | 175.7 | 59.3 | 0 | 0 | 0 | 0 | 112.5 | S241 A247 | S241-S243 PolarHBondContact O-N 3.22Å; S241-S243 PolarHBondContact OG-OG 2.92Å; S243-A247 VanDerWaalsContact O-CB 3.27Å; S243-A247 WeakPolarHBondContact O-CB 3.39Å; S243-A247 PolarHBondContact O-N 2.84Å |
| 244 | Q | 89.3 | Confident | 89.8 | Confident | 94 Ų | 94 | 76.6 Ų | 76.6 | 44% | 0.439 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -70.8 | -35.5 | 173.3 | -65 | 176.3 | -1.6 | 0 | 0 | 111.7 | V239 S241 L242 H248 | V239-Q244 HydrophobicContact CB-CB 4Å; V239-Q244 HydrophobicContact CG2-CB 4.02Å; S241-Q244 WeakPolarHBondContact O-CB 3.4Å; S241-Q244 PolarHBondContact O-N 3.21Å; L242-Q244 VanDerWaalsContact C-N 3.27Å; L242-Q244 PolarHBondContact O-N 2.89Å; Q244-H248 WeakPolarHBondContact O-CB 3.21Å; Q244-H248 PolarHBondContact O-N 3.15Å |
| 245 | L | 91.9 | Very high | 89.9 | Confident | 4 Ų | 4 | 79.7 Ų | 79.7 | 2% | 0.021 | 43% | 0.433 | C | S | . | . | H | α-helix | trans | -69.3 | -41.6 | 176.9 | -174.7 | 64.9 | 0 | 0 | 0 | 110.5 | K227 C232 V239 S241 L242 H248 N249 | K227-L245 HydrophobicContact CG-CD2 4.33Å; C232-L245 HydrophobicContact CB-CD1 3.94Å; V239-L245 HydrophobicContact CG2-CB 3.64Å; V239-L245 HydrophobicContact CG2-CD1 4.11Å; V239-L245 HydrophobicContact CG2-CG 4.46Å; S241-L245 PolarHBondContact O-N 3.3Å; S241-L245 VanDerWaalsContact O-N 3.09Å; L242-L245 HydrophobicContact CD2-CD2 4.5Å; L242-L245 WeakPolarHBondContact O-CB 3.44Å; L242-L245 PolarHBondContact O-N 2.82Å; L245-H248 WeakPolarHBondContact O-CB 3.4Å; L245-H248 PolarHBondContact O-N 2.93Å; L245-N249 WeakPolarHBondContact O-CB 3.11Å; L245-N249 PolarHBondContact O-N 3.44Å; L245-N249 PolarHBondContact O-ND2 3.4Å |
| 246 | E | 90.3 | Very high | 89.9 | Confident | 99 Ų | 99 | 81.8 Ų | 81.8 | 46% | 0.463 | 45% | 0.445 | S | S | . | . | H | α-helix | trans | -63.3 | -45 | 173.5 | -78 | -164.5 | -142.6 | 0 | 0 | 112.8 | L242 H248 N249 K250 | L242-E246 PolarHBondContact O-N 2.93Å; E246-H248 VanDerWaalsContact C-N 3.31Å; E246-H248 PolarHBondContact O-N 3.24Å; E246-N249 PolarHBondContact O-N 3.33Å; E246-K250 WeakPolarHBondContact O-CB 3.45Å; E246-K250 WeakPolarHBondContact O-CE 3.49Å; E246-K250 VanDerWaalsContact O-CG 3.3Å; E246-K250 WeakPolarHBondContact O-CG 3.39Å; E246-K250 PolarHBondContact O-N 3.36Å; E246-K250 IonicContact OE2-NZ 2.58Å; E246-K250 PolarHBondContact OE2-NZ 3.23Å |
| 247 | A | 92.9 | Very high | 89.8 | Confident | 64 Ų | 64 | 77.3 Ų | 77.3 | 53% | 0.529 | 43% | 0.428 | S | S | . | . | H | α-helix | trans | -63.7 | -37.8 | 174.7 | 0 | 0 | 0 | 0 | 0 | 111.7 | S243 G251 | S243-A247 VanDerWaalsContact O-CB 3.27Å; S243-A247 WeakPolarHBondContact O-CB 3.39Å; S243-A247 PolarHBondContact O-N 2.84Å; A247-G251 PolarHBondContact O-N 3.32Å |
| 248 | H | 93.4 | Very high | 89.8 | Confident | 45 Ų | 45 | 77.3 Ų | 77.3 | 21% | 0.208 | 43% | 0.425 | C | S | . | . | H | α-helix | trans | -61.8 | -50.6 | 172.7 | 172.7 | 91.3 | 0 | 0 | 0 | 111.4 | C232 C235 Q244 L245 E246 K250 G251 H254 | C232-H248 PolarHBondContact SG-NE2 3.1Å; C232-H248 VanDerWaalsContact SG-NE2 3.36Å; C235-H248 WeakPolarHBondContact CB-NE2 3.5Å; C235-H248 PolarHBondContact SG-NE2 3.04Å; C235-H248 VanDerWaalsContact SG-NE2 3.4Å; Q244-H248 WeakPolarHBondContact O-CB 3.21Å; Q244-H248 PolarHBondContact O-N 3.15Å; L245-H248 WeakPolarHBondContact O-CB 3.4Å; L245-H248 PolarHBondContact O-N 2.93Å; E246-H248 VanDerWaalsContact C-N 3.31Å; E246-H248 PolarHBondContact O-N 3.24Å; H248-K250 VanDerWaalsContact C-N 3.33Å; H248-K250 PolarHBondContact O-N 3.47Å; H248-G251 PolarHBondContact O-N 3.39Å; H248-H254 AromaticContact CD2-ND1 3.47Å; H248-H254 PolarHBondContact CD2-ND1 3.01Å; H248-H254 AromaticContact NE2-ND1 3.33Å; H248-H254 PolarHBondContact NE2-ND1 2.77Å; H248-H254 WeakPolarHBondContact O-CB 3.28Å |
| 249 | N | 90.3 | Very high | 89.4 | Confident | 55 Ų | 55 | 79.3 Ų | 79.3 | 29% | 0.294 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -63.2 | -37.4 | -179.3 | -69.1 | -16.1 | 0 | 0 | 0 | 112.2 | L245 E246 G251 H254 | L245-N249 WeakPolarHBondContact O-CB 3.11Å; L245-N249 PolarHBondContact O-N 3.44Å; L245-N249 PolarHBondContact O-ND2 3.4Å; E246-N249 PolarHBondContact O-N 3.33Å; N249-G251 VanDerWaalsContact C-N 3.26Å; N249-G251 PolarHBondContact O-N 3.41Å; N249-H254 PolarHBondContact O-CD2 3.05Å; N249-H254 VanDerWaalsContact O-CD2 3.24Å; N249-H254 PolarHBondContact OD1-CE1 3.36Å; N249-H254 PolarHBondContact OD1-ND1 2.93Å |
| 250 | K | 90.6 | Very high | 88.9 | Confident | 154 Ų | 154 | 81.7 Ų | 81.7 | 67% | 0.67 | 45% | 0.446 | S | S | * | . | H | α-helix | trans | -74.7 | -12.4 | 173.6 | -68.6 | 179.3 | -107 | -92.1 | 0 | 113.1 | E246 H248 | E246-K250 WeakPolarHBondContact O-CB 3.45Å; E246-K250 WeakPolarHBondContact O-CE 3.49Å; E246-K250 VanDerWaalsContact O-CG 3.3Å; E246-K250 WeakPolarHBondContact O-CG 3.39Å; E246-K250 PolarHBondContact O-N 3.36Å; E246-K250 IonicContact OE2-NZ 2.58Å; E246-K250 PolarHBondContact OE2-NZ 3.23Å; H248-K250 VanDerWaalsContact C-N 3.33Å; H248-K250 PolarHBondContact O-N 3.47Å |
| 251 | G | 91.4 | Very high | 88.1 | Confident | 26 Ų | 26 | 82.2 Ų | 82.2 | 27% | 0.268 | 44% | 0.437 | S | S | . | . | S | Bend | trans | -76.8 | 146.9 | -175.7 | 0 | 0 | 0 | 0 | 0 | 114.3 | A247 H248 N249 K253 H254 K255 | A247-G251 PolarHBondContact O-N 3.32Å; H248-G251 PolarHBondContact O-N 3.39Å; N249-G251 VanDerWaalsContact C-N 3.26Å; N249-G251 PolarHBondContact O-N 3.41Å; G251-K253 PolarHBondContact O-N 3.46Å; G251-K253 VanDerWaalsContact O-N 3.11Å; G251-H254 PolarHBondContact O-N 2.99Å; G251-H254 VanDerWaalsContact O-N 3.09Å; G251-K255 PolarHBondContact O-N 2.85Å |
| 252 | T | 89.3 | Confident | 87.5 | Confident | 112 Ų | 112 | 83.2 Ų | 83.2 | 69% | 0.687 | 45% | 0.445 | S | S | * | . | H | α-helix | trans | -53.1 | -38.4 | -176.4 | -40.6 | 0 | 0 | 0 | 0 | 113.5 | K255 T256 | T252-K255 PolarHBondContact O-N 3.27Å; T252-T256 HydrophobicContact CG2-CG2 4.47Å; T252-T256 WeakPolarHBondContact O-CG2 3.13Å; T252-T256 PolarHBondContact O-N 3.3Å; T252-T256 PolarHBondContact O-OG1 2.9Å; T252-T256 VanDerWaalsContact O-OG1 3.12Å |
| 253 | K | 86.4 | Confident | 86.3 | Confident | 176 Ų | 176 | 81.8 Ų | 81.8 | 77% | 0.765 | 45% | 0.451 | S | S | * | . | H | α-helix | trans | -61.4 | -51 | 179.1 | -64.4 | 178.8 | -178.4 | 176.3 | 0 | 111.2 | G251 T256 I257 | G251-K253 PolarHBondContact O-N 3.46Å; G251-K253 VanDerWaalsContact O-N 3.11Å; K253-T256 PolarHBondContact O-N 3.05Å; K253-T256 PolarHBondContact O-OG1 3.29Å; K253-I257 WeakPolarHBondContact O-CG1 3.42Å; K253-I257 PolarHBondContact O-N 2.88Å |
| 254 | H | 91.2 | Very high | 84.5 | Confident | 12 Ų | 12 | 86.9 Ų | 86.9 | 6% | 0.056 | 47% | 0.471 | C | S | . | . | H | α-helix | trans | -62.3 | -47.5 | 176.5 | -178.3 | 106.8 | 0 | 0 | 0 | 110.8 | C232 H248 N249 G251 T256 I257 L258 | C232-H254 PolarHBondContact SG-CE1 3.12Å; C232-H254 PolarHBondContact SG-ND1 3.43Å; H248-H254 AromaticContact CD2-ND1 3.47Å; H248-H254 PolarHBondContact CD2-ND1 3.01Å; H248-H254 AromaticContact NE2-ND1 3.33Å; H248-H254 PolarHBondContact NE2-ND1 2.77Å; H248-H254 WeakPolarHBondContact O-CB 3.28Å; N249-H254 PolarHBondContact O-CD2 3.05Å; N249-H254 VanDerWaalsContact O-CD2 3.24Å; N249-H254 PolarHBondContact OD1-CE1 3.36Å; N249-H254 PolarHBondContact OD1-ND1 2.93Å; G251-H254 PolarHBondContact O-N 2.99Å; G251-H254 VanDerWaalsContact O-N 3.09Å; H254-T256 PolarHBondContact O-N 3.39Å; H254-I257 PolarHBondContact O-N 2.84Å; H254-I257 VanDerWaalsContact O-N 3.08Å; H254-L258 WeakPolarHBondContact O-CB 3.39Å; H254-L258 PolarHBondContact O-N 2.65Å |
| 255 | K | 89.4 | Confident | 82.8 | Confident | 117 Ų | 117 | 84.8 Ų | 84.8 | 51% | 0.509 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -54.3 | -48.4 | 178.5 | -173.7 | 177.5 | 171.5 | 178 | 0 | 112.2 | G251 T252 I257 L258 E259 | G251-K255 PolarHBondContact O-N 2.85Å; T252-K255 PolarHBondContact O-N 3.27Å; K255-I257 VanDerWaalsContact C-N 3.32Å; K255-I257 PolarHBondContact O-N 2.8Å; K255-L258 WeakPolarHBondContact O-CB 3.3Å; K255-L258 PolarHBondContact O-N 2.77Å; K255-E259 WeakPolarHBondContact CE-OE1 3.36Å; K255-E259 HydrophobicContact CG-CG 4.37Å; K255-E259 IonicContact NZ-OE1 2.84Å; K255-E259 WeakPolarHBondContact O-CB 3.31Å; K255-E259 WeakPolarHBondContact O-CG 3.49Å; K255-E259 PolarHBondContact O-N 3.18Å |
| 256 | T | 87.3 | Confident | 80.9 | Confident | 74 Ų | 74 | 90.8 Ų | 90.8 | 45% | 0.454 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -64.7 | -32.4 | 178 | 54.4 | 0 | 0 | 0 | 0 | 113.9 | T252 K253 H254 A260 | T252-T256 HydrophobicContact CG2-CG2 4.47Å; T252-T256 WeakPolarHBondContact O-CG2 3.13Å; T252-T256 PolarHBondContact O-N 3.3Å; T252-T256 PolarHBondContact O-OG1 2.9Å; T252-T256 VanDerWaalsContact O-OG1 3.12Å; K253-T256 PolarHBondContact O-N 3.05Å; K253-T256 PolarHBondContact O-OG1 3.29Å; H254-T256 PolarHBondContact O-N 3.39Å; T256-A260 VanDerWaalsContact O-CB 3.25Å; T256-A260 WeakPolarHBondContact O-CB 3.21Å; T256-A260 PolarHBondContact O-N 2.84Å |
| 257 | I | 85.9 | Confident | 78.8 | Confident | 67 Ų | 67 | 93.1 Ų | 93.1 | 34% | 0.344 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -73.4 | -36.4 | 176.3 | -69.3 | 166.3 | 0 | 0 | 0 | 110.6 | K253 H254 K255 R261 | K253-I257 WeakPolarHBondContact O-CG1 3.42Å; K253-I257 PolarHBondContact O-N 2.88Å; H254-I257 PolarHBondContact O-N 2.84Å; H254-I257 VanDerWaalsContact O-N 3.08Å; K255-I257 VanDerWaalsContact C-N 3.32Å; K255-I257 PolarHBondContact O-N 2.8Å; I257-R261 WeakPolarHBondContact O-CB 3.27Å; I257-R261 PolarHBondContact O-N 3.01Å; I257-R261 VanDerWaalsContact O-N 3.16Å |
| 258 | L | 86.2 | Confident | 76.6 | Confident | 67 Ų | 67 | 99.4 Ų | 99.4 | 35% | 0.351 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -66.3 | -51.7 | 174.5 | -169 | 158.5 | 0 | 0 | 0 | 110.2 | L234 H254 K255 A260 R261 S262 | L234-L258 HydrophobicContact CD1-CB 4.01Å; L234-L258 HydrophobicContact CD1-CD1 3.79Å; L234-L258 HydrophobicContact CD1-CG 3.85Å; H254-L258 WeakPolarHBondContact O-CB 3.39Å; H254-L258 PolarHBondContact O-N 2.65Å; K255-L258 WeakPolarHBondContact O-CB 3.3Å; K255-L258 PolarHBondContact O-N 2.77Å; L258-A260 VanDerWaalsContact C-N 3.31Å; L258-A260 PolarHBondContact O-N 2.62Å; L258-R261 CarbonylContact O-C 3.56Å; L258-R261 WeakPolarHBondContact O-CA 3.46Å; L258-R261 PolarHBondContact O-N 3.06Å; L258-S262 PolarHBondContact O-N 3.23Å; L258-S262 PolarHBondContact O-OG 3.28Å |
| 259 | E | 81.9 | Confident | 73.9 | Confident | 111 Ų | 111 | 101.4 Ų | 101.4 | 52% | 0.519 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -57.9 | -40.7 | 176.9 | -71.8 | 169.9 | 146.7 | 0 | 0 | 112.2 | K255 R261 | K255-E259 WeakPolarHBondContact CE-OE1 3.36Å; K255-E259 HydrophobicContact CG-CG 4.37Å; K255-E259 IonicContact NZ-OE1 2.84Å; K255-E259 WeakPolarHBondContact O-CB 3.31Å; K255-E259 WeakPolarHBondContact O-CG 3.49Å; K255-E259 PolarHBondContact O-N 3.18Å; E259-R261 VanDerWaalsContact C-N 3.28Å; E259-R261 PolarHBondContact O-N 3.33Å |
| 260 | A | 79.6 | Confident | 71.3 | Confident | 86 Ų | 86 | 108.7 Ų | 108.7 | 71% | 0.711 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -69.1 | -21.5 | 175.1 | 0 | 0 | 0 | 0 | 0 | 114.1 | T256 L258 | T256-A260 VanDerWaalsContact O-CB 3.25Å; T256-A260 WeakPolarHBondContact O-CB 3.21Å; T256-A260 PolarHBondContact O-N 2.84Å; L258-A260 VanDerWaalsContact C-N 3.31Å; L258-A260 PolarHBondContact O-N 2.62Å |
| 261 | R | 74.1 | Confident | 69.5 | Low | 152 Ų | 152 | 107.3 Ų | 107.3 | 57% | 0.574 | 60% | 0.599 | S | S | * | * | H | α-helix | trans | -93.8 | -28.4 | 176.5 | -86.1 | 179.5 | 137.6 | 171.3 | -11.9 | 113.7 | L234 I257 L258 E259 G263 | L234-R261 PolarHBondContact O-NH1 3.11Å; I257-R261 WeakPolarHBondContact O-CB 3.27Å; I257-R261 PolarHBondContact O-N 3.01Å; I257-R261 VanDerWaalsContact O-N 3.16Å; L258-R261 CarbonylContact O-C 3.56Å; L258-R261 WeakPolarHBondContact O-CA 3.46Å; L258-R261 PolarHBondContact O-N 3.06Å; E259-R261 VanDerWaalsContact C-N 3.28Å; E259-R261 PolarHBondContact O-N 3.33Å; R261-G263 PolarHBondContact O-N 2.99Å; R261-G263 VanDerWaalsContact O-N 3.15Å |
| 262 | S | 76.7 | Confident | 67.3 | Low | 71 Ų | 71 | 117.5 Ų | 117.5 | 50% | 0.497 | 63% | 0.629 | S | S | . | * | S | Bend | trans | -69.6 | -5 | -178.4 | -68.4 | 0 | 0 | 0 | 0 | 114.6 | L258 L264 | L258-S262 PolarHBondContact O-N 3.23Å; L258-S262 PolarHBondContact O-OG 3.28Å; S262-L264 VanDerWaalsContact C-N 3.26Å; S262-L264 PolarHBondContact O-N 2.83Å |
| 263 | G | 64.6 | Low | 65.1 | Low | 55 Ų | 55 | 120.7 Ų | 120.7 | 57% | 0.567 | 64% | 0.641 | S | S | * | * | trans | 69 | 9.3 | 154.5 | 0 | 0 | 0 | 0 | 0 | 117.4 | R261 G265 | R261-G263 PolarHBondContact O-N 2.99Å; R261-G263 VanDerWaalsContact O-N 3.15Å; G263-G265 PolarHBondContact O-N 3.16Å | ||
| 264 | L | 51.6 | Low | 62.7 | Low | 183 Ų | 183 | 115.4 Ų | 115.4 | 96% | 0.958 | 64% | 0.636 | S | S | * | * | trans | -79.7 | 51.7 | 175.6 | -64 | -179.1 | 0 | 0 | 0 | 112.3 | S262 | S262-L264 VanDerWaalsContact C-N 3.26Å; S262-L264 PolarHBondContact O-N 2.83Å | ||
| 265 | G | 53.8 | Low | 60.5 | Low | 50 Ų | 50 | 121 Ų | 121 | 52% | 0.515 | 67% | 0.674 | S | S | . | * | S | Bend | trans | -151.6 | 145.4 | 171 | 0 | 0 | 0 | 0 | 0 | 109.1 | G263 I267 | G263-G265 PolarHBondContact O-N 3.16Å; G265-I267 PolarHBondContact O-N 3.21Å |
| 266 | P | 51.6 | Low | 58.3 | Low | 131 Ų | 131 | 124.4 Ų | 124.4 | 85% | 0.851 | 69% | 0.689 | S | S | * | * | S | Bend | trans | -71.2 | 104.4 | -173.2 | 27.8 | -32.5 | 0 | 0 | 0 | 110.7 | ||
| 267 | I | 46.3 | Very low | 55.9 | Low | 147 Ų | 147 | 126.3 Ų | 126.3 | 75% | 0.754 | 70% | 0.702 | S | S | * | * | -178.6 | 115 | 120.6 | -86.2 | 150.4 | 0 | 0 | 0 | 110.4 | G265 | G265-I267 PolarHBondContact O-N 3.21Š| |||
| 268 | K | 47.3 | Very low | 53.7 | Low | 197 Ų | 197 | 127.3 Ų | 127.3 | 86% | 0.857 | 72% | 0.715 | S | S | * | * | trans | 15.3 | 105 | 140.9 | -147.3 | 152.3 | -177.3 | 169.4 | 0 | 118.3 | ||||
| 269 | A | 37 | Very low | 51.6 | Low | 87 Ų | 87 | 129.6 Ų | 129.6 | 72% | 0.719 | 73% | 0.734 | S | S | * | * | trans | 38.9 | 108.6 | 142.3 | 0 | 0 | 0 | 0 | 0 | 119.6 | ||||
| 270 | Y | 35.9 | Very low | 49.5 | Very low | 208 Ų | 208 | 131.4 Ų | 131.4 | 82% | 0.816 | 74% | 0.743 | S | S | * | * | P | Polyproline II helix | trans | -77.1 | 127.6 | 151 | -80 | -92.9 | 0 | 0 | 0 | 110.1 | R272 | Y270-R272 PolarHBondContact O-N 2.85Š|
| 271 | P | 53 | Low | 47.6 | Very low | 124 Ų | 124 | 136.4 Ų | 136.4 | 81% | 0.805 | 75% | 0.751 | S | S | * | * | P | Polyproline II helix | trans | -60.6 | 130 | 167.5 | -23.9 | 35.3 | 0 | 0 | 0 | 111.4 | ||
| 272 | R | 44.8 | Very low | 45.7 | Very low | 240 Ų | 240 | 133.2 Ų | 133.2 | 91% | 0.906 | 77% | 0.766 | S | S | * | * | P | Polyproline II helix | trans | -77 | 137.8 | 178.4 | -154 | -174 | -145.6 | -105.6 | 12.7 | 109.3 | Y270 | Y270-R272 PolarHBondContact O-N 2.85Š|
| 273 | L | 43.5 | Very low | 43.5 | Very low | 180 Ų | 180 | 133.8 Ų | 133.8 | 94% | 0.942 | 78% | 0.782 | S | S | * | * | P | Polyproline II helix | trans | -76.5 | 123.9 | 175.7 | -77.4 | 168.9 | 0 | 0 | 0 | 111.8 | ||
| 274 | G | 35.7 | Very low | 41.9 | Very low | 64 Ų | 64 | 139.7 Ų | 139.7 | 66% | 0.66 | 80% | 0.795 | S | S | * | * | trans | 90.6 | 154.6 | 164.6 | 0 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 275 | P | 43.8 | Very low | 41.3 | Very low | 130 Ų | 130 | 137.7 Ų | 137.7 | 84% | 0.844 | 79% | 0.785 | S | S | * | * | cis | -113 | 176.3 | -1.9 | 15.7 | 8.2 | 0 | 0 | 0 | 114.3 | ||||
| 276 | K | 43.4 | Very low | 40.6 | Very low | 189 Ų | 189 | 140.5 Ų | 140.5 | 82% | 0.822 | 80% | 0.796 | S | S | * | * | trans | -72.2 | 137.4 | -179.1 | 174.1 | 179.3 | 178.6 | 176.9 | 0 | 113.2 | ||||
| 277 | P | 36.7 | Very low | 39.9 | Very low | 114 Ų | 114 | 139.9 Ų | 139.9 | 74% | 0.74 | 80% | 0.795 | S | S | * | * | trans | -118.6 | 134.5 | 142 | 34.6 | -26.1 | 0 | 0 | 0 | 111.5 | ||||
| 278 | S | 40.8 | Very low | 39.6 | Very low | 88 Ų | 88 | 139.5 Ų | 139.5 | 62% | 0.615 | 80% | 0.795 | S | S | * | * | trans | -77.6 | 149.5 | 146.5 | 42.1 | 0 | 0 | 0 | 0 | 108 | ||||
| 279 | P | 41.7 | Very low | 39.7 | Very low | 114 Ų | 114 | 135.9 Ų | 135.9 | 74% | 0.74 | 79% | 0.791 | S | S | * | * | -140.8 | 162.6 | 93.8 | 34 | -18.1 | 0 | 0 | 0 | 114.8 | |||||
| 280 | E | 38.2 | Very low | 40.2 | Very low | 150 Ų | 150 | 138 Ų | 138 | 70% | 0.701 | 79% | 0.791 | S | S | * | * | trans | -67.1 | 142.5 | 167.5 | 54.4 | -96.9 | 57.2 | 0 | 0 | 113.7 | ||||
| 281 | Q | 39.9 | Very low | 40.7 | Very low | 191 Ų | 191 | 134.2 Ų | 134.2 | 89% | 0.893 | 79% | 0.789 | S | S | * | * | 170.8 | 150.6 | 113.4 | -92 | 168.7 | -19.3 | 0 | 0 | 111.2 | |||||
| 282 | G | 32.7 | Very low | 40.5 | Very low | 85 Ų | 85 | 135.3 Ų | 135.3 | 88% | 0.876 | 78% | 0.784 | S | S | * | * | trans | -91.7 | 169.1 | -164.4 | 0 | 0 | 0 | 0 | 0 | 115.8 | ||||
| 283 | G | 30.8 | Very low | 40.9 | Very low | 82 Ų | 82 | 129.6 Ų | 129.6 | 85% | 0.845 | 77% | 0.767 | S | S | * | * | trans | -179.5 | 101.3 | 176.7 | 0 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 284 | E | 31.5 | Very low | 41.8 | Very low | 180 Ų | 180 | 128.6 Ų | 128.6 | 84% | 0.841 | 75% | 0.751 | S | S | * | * | trans | -47.8 | 133.8 | -176 | -170.5 | -140.9 | 136 | 0 | 0 | 116.6 | ||||
| 285 | L | 39.7 | Very low | 43.5 | Very low | 140 Ų | 140 | 129 Ų | 129 | 73% | 0.733 | 74% | 0.741 | S | S | * | * | 159.9 | 145.9 | 120.5 | -175.4 | 58.3 | 0 | 0 | 0 | 112 | |||||
| 286 | S | 38.1 | Very low | 45.3 | Very low | 109 Ų | 109 | 125 Ų | 125 | 76% | 0.762 | 71% | 0.71 | S | S | * | * | trans | 64.8 | 80.5 | 173.5 | 70.5 | 0 | 0 | 0 | 0 | 118.9 | ||||
| 287 | S | 38 | Very low | 47.4 | Very low | 118 Ų | 118 | 121 Ų | 121 | 83% | 0.825 | 69% | 0.694 | S | S | * | * | trans | -91 | 103.7 | 163 | -57.4 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 288 | D | 39.4 | Very low | 49.9 | Very low | 140 Ų | 140 | 115.8 Ų | 115.8 | 75% | 0.749 | 66% | 0.661 | S | S | * | * | trans | -159.6 | 76.5 | 130.2 | -133.8 | -38.2 | 0 | 0 | 0 | 114.2 | N290 | D288-N290 VanDerWaalsContact C-N 3.3Å; D288-N290 PolarHBondContact O-N 3.49Å; D288-N290 WeakPolarHBondContact OD1-CB 3.49Å | ||
| 289 | P | 49.4 | Very low | 52 | Low | 120 Ų | 120 | 117.7 Ų | 117.7 | 78% | 0.779 | 66% | 0.66 | S | S | * | * | trans | -92 | 30.2 | 171.6 | 37.2 | -34.2 | 0 | 0 | 0 | 112.8 | T291 | P289-T291 PolarHBondContact O-N 3.49Š| ||
| 290 | N | 46.8 | Very low | 54 | Low | 133 Ų | 133 | 117 Ų | 117 | 71% | 0.711 | 65% | 0.649 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -97.4 | 46.3 | -168.4 | -166.4 | 20.4 | 0 | 0 | 0 | 115.3 | D288 | D288-N290 VanDerWaalsContact C-N 3.3Å; D288-N290 PolarHBondContact O-N 3.49Å; D288-N290 WeakPolarHBondContact OD1-CB 3.49Å |
| 291 | T | 47.2 | Very low | 56.3 | Low | 127 Ų | 127 | 112.1 Ų | 112.1 | 78% | 0.779 | 63% | 0.63 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -150.3 | 39.4 | 159.8 | -32 | 0 | 0 | 0 | 0 | 113.1 | P289 E293 | P289-T291 PolarHBondContact O-N 3.49Å; T291-E293 PolarHBondContact O-N 2.82Å |
| 292 | Q | 49.5 | Very low | 58.4 | Low | 148 Ų | 148 | 110.1 Ų | 110.1 | 69% | 0.692 | 63% | 0.626 | S | S | * | * | trans | -80.8 | 60.9 | 160.6 | -154.2 | -173.5 | 33 | 0 | 0 | 110.5 | R294 | Q292-R294 VanDerWaalsContact C-N 3.27Å; Q292-R294 HydrophobicContact CG-CG 4.04Å; Q292-R294 PolarHBondContact O-N 3.15Å | ||
| 293 | E | 51.7 | Low | 60.9 | Low | 119 Ų | 119 | 109 Ų | 109 | 56% | 0.556 | 60% | 0.602 | S | S | * | * | trans | -55.2 | 104.9 | 147.7 | -80 | -153.7 | 136.2 | 0 | 0 | 105.5 | T291 T295 N306 | T291-E293 PolarHBondContact O-N 2.82Å; E293-T295 PolarHBondContact O-N 3.02Å; E293-N306 PolarHBondContact OE1-ND2 3.49Å; E293-N306 PolarHBondContact OE2-ND2 2.84Å | ||
| 294 | R | 62.1 | Low | 63.7 | Low | 159 Ų | 159 | 114.4 Ų | 114.4 | 60% | 0.6 | 60% | 0.597 | S | S | * | * | trans | -69.2 | 87.3 | 176.7 | -64.2 | -178.6 | -163 | 116.8 | 8.5 | 106.4 | Q292 F296 | Q292-R294 VanDerWaalsContact C-N 3.27Å; Q292-R294 HydrophobicContact CG-CG 4.04Å; Q292-R294 PolarHBondContact O-N 3.15Å; R294-F296 VanDerWaalsContact C-N 3.34Å; R294-F296 HydrophobicContact CB-CE1 4.35Å; R294-F296 HydrophobicContact CB-CE2 3.92Å; R294-F296 HydrophobicContact CB-CZ 3.82Å; R294-F296 WeakPolarHBondContact O-CD2 3.25Å; R294-F296 WeakPolarHBondContact O-CE2 3.42Å; R294-F296 WeakPolarHBondContact O-CG 3.46Å; R294-F296 PolarHBondContact O-N 2.85Å | ||
| 295 | T | 72.2 | Confident | 66.3 | Low | 74 Ų | 74 | 106.8 Ų | 106.8 | 45% | 0.454 | 56% | 0.562 | S | S | . | * | trans | -64.5 | 100.4 | 174 | 52.8 | 0 | 0 | 0 | 0 | 107.6 | E293 H297 V305 | E293-T295 PolarHBondContact O-N 3.02Å; T295-H297 PolarHBondContact O-N 2.83Å; T295-H297 VanDerWaalsContact O-N 3.14Å; T295-V305 CarbonylContact C-O 3.59Å | ||
| 296 | F | 81.9 | Confident | 68.3 | Low | 46 Ų | 46 | 104.5 Ų | 104.5 | 20% | 0.202 | 55% | 0.551 | C | S | . | * | E | Extended strand (participates in β ladder) | trans | -69.4 | 110.2 | -174.9 | -70.5 | -82 | 0 | 0 | 0 | 108.5 | R294 V305 E308 L311 | R294-F296 VanDerWaalsContact C-N 3.34Å; R294-F296 HydrophobicContact CB-CE1 4.35Å; R294-F296 HydrophobicContact CB-CE2 3.92Å; R294-F296 HydrophobicContact CB-CZ 3.82Å; R294-F296 WeakPolarHBondContact O-CD2 3.25Å; R294-F296 WeakPolarHBondContact O-CE2 3.42Å; R294-F296 WeakPolarHBondContact O-CG 3.46Å; R294-F296 PolarHBondContact O-N 2.85Å; F296-V305 HydrophobicContact CB-CG2 4.1Å; F296-V305 PolarHBondContact N-O 2.91Å; F296-V305 WeakPolarHBondContact O-CG2 3.3Å; F296-V305 PolarHBondContact O-N 3.44Å; F296-E308 HydrophobicContact CD1-CB 4.16Å; F296-E308 HydrophobicContact CD1-CG 4.03Å; F296-E308 HydrophobicContact CD2-CB 4.07Å; F296-E308 HydrophobicContact CE1-CB 3.7Å; F296-E308 HydrophobicContact CE1-CG 3.55Å; F296-E308 HydrophobicContact CE2-CB 3.62Å; F296-E308 HydrophobicContact CE2-CG 4.41Å; F296-E308 HydrophobicContact CG-CB 4.34Å; F296-E308 HydrophobicContact CZ-CB 3.42Å; F296-E308 VanDerWaalsContact CZ-CB 3.42Å; F296-E308 HydrophobicContact CZ-CG 3.78Å; F296-L311 HydrophobicContact CB-CB 3.7Å; F296-L311 HydrophobicContact CB-CD2 3.73Å; F296-L311 HydrophobicContact CB-CG 4.19Å; F296-L311 HydrophobicContact CD1-CD2 4.25Å; F296-L311 HydrophobicContact CG-CB 4.43Å; F296-L311 HydrophobicContact CG-CD2 4.44Å |
| 297 | H | 88.3 | Confident | 70.7 | Confident | 103 Ų | 103 | 101.8 Ų | 101.8 | 48% | 0.477 | 53% | 0.532 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -96.9 | 141.4 | -177.5 | 70.9 | -66.8 | 0 | 0 | 0 | 111.2 | T295 E299 R304 | T295-H297 PolarHBondContact O-N 2.83Å; T295-H297 VanDerWaalsContact O-N 3.14Å; H297-E299 WeakPolarHBondContact CD2-CG 3.47Å; H297-E299 IonicContact CD2-OE1 3.65Å; H297-E299 IonicContact CE1-OE1 3.82Å; H297-E299 WeakPolarHBondContact NE2-CG 3.4Å; H297-E299 IonicContact NE2-OE1 2.79Å; H297-E299 PolarHBondContact NE2-OE1 3.5Å; H297-R304 HydrophobicContact CB-CG 4.2Å |
| 298 | C | 88.4 | Confident | 73 | Confident | 6 Ų | 6 | 100.3 Ų | 100.3 | 4% | 0.041 | 51% | 0.512 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -103.9 | 109.2 | 167.1 | -179.6 | 0 | 0 | 0 | 0 | 108.9 | C301 N302 V303 L311 H314 H320 | C298-C301 HydrophobicContact CB-CB 4.49Å; C298-C301 PolarHBondContact O-N 3.34Å; C298-N302 WeakPolarHBondContact O-CA 2.99Å; C298-N302 PolarHBondContact O-N 3.12Å; C298-V303 PolarHBondContact N-O 3.37Å; C298-V303 PolarHBondContact O-N 3.34Å; C298-L311 HydrophobicContact CB-CD1 3.78Å; C298-H314 PolarHBondContact SG-NE2 3.03Å; C298-H320 PolarHBondContact SG-CE1 2.87Å; C298-H320 PolarHBondContact SG-ND1 2.92Å |
| 299 | E | 85.4 | Confident | 75.4 | Confident | 128 Ų | 128 | 99.8 Ų | 99.8 | 60% | 0.598 | 51% | 0.509 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -65.7 | -38.6 | -179.5 | -64.1 | 174.1 | -176.2 | 0 | 0 | 112.1 | H297 C301 N302 | H297-E299 WeakPolarHBondContact CD2-CG 3.47Å; H297-E299 IonicContact CD2-OE1 3.65Å; H297-E299 IonicContact CE1-OE1 3.82Å; H297-E299 WeakPolarHBondContact NE2-CG 3.4Å; H297-E299 IonicContact NE2-OE1 2.79Å; H297-E299 PolarHBondContact NE2-OE1 3.5Å; E299-C301 VanDerWaalsContact C-N 3.27Å; E299-C301 PolarHBondContact O-N 3.09Å; E299-N302 PolarHBondContact O-N 2.86Å; E299-N302 PolarHBondContact O-OD1 2.94Å |
| 300 | I | 84 | Confident | 77.2 | Confident | 100 Ų | 100 | 98.6 Ų | 98.6 | 51% | 0.513 | 49% | 0.493 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -64.4 | -29.7 | -179.7 | -63.3 | 133.9 | 0 | 0 | 0 | 112.7 | V324 | I300-V324 HydrophobicContact CD1-CG2 3.94Å; I300-V324 HydrophobicContact CG1-CG2 4.36Å; I300-V324 HydrophobicContact CG2-CG2 3.83Å |
| 301 | C | 84.9 | Confident | 79.4 | Confident | 46 Ų | 46 | 93.4 Ų | 93.4 | 31% | 0.311 | 47% | 0.465 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -114.1 | -2.2 | -179.4 | -61 | 0 | 0 | 0 | 0 | 113.5 | C298 E299 V303 | C298-C301 HydrophobicContact CB-CB 4.49Å; C298-C301 PolarHBondContact O-N 3.34Å; E299-C301 VanDerWaalsContact C-N 3.27Å; E299-C301 PolarHBondContact O-N 3.09Å; C301-V303 HydrophobicContact CB-CG2 3.95Å; C301-V303 WeakPolarHBondContact O-CG2 3.39Å; C301-V303 PolarHBondContact O-N 3.06Å |
| 302 | N | 85.3 | Confident | 81.4 | Confident | 149 Ų | 149 | 92.3 Ų | 92.3 | 80% | 0.797 | 45% | 0.449 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 47 | 34.8 | -170.6 | -69.9 | -59.7 | 0 | 0 | 0 | 114.7 | C298 E299 | C298-N302 WeakPolarHBondContact O-CA 2.99Å; C298-N302 PolarHBondContact O-N 3.12Å; E299-N302 PolarHBondContact O-N 2.86Å; E299-N302 PolarHBondContact O-OD1 2.94Å |
| 303 | V | 84.2 | Confident | 83.5 | Confident | 61 Ų | 61 | 91.8 Ų | 91.8 | 37% | 0.37 | 45% | 0.447 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -102 | 128.3 | 178.7 | -174.2 | 0 | 0 | 0 | 0 | 110 | C298 C301 V305 | C298-V303 PolarHBondContact N-O 3.37Å; C298-V303 PolarHBondContact O-N 3.34Å; C301-V303 HydrophobicContact CB-CG2 3.95Å; C301-V303 WeakPolarHBondContact O-CG2 3.39Å; C301-V303 PolarHBondContact O-N 3.06Å; V303-V305 HydrophobicContact CG1-CG1 4.19Å |
| 304 | R | 89.1 | Confident | 85.5 | Confident | 196 Ų | 196 | 88 Ų | 88 | 74% | 0.74 | 43% | 0.429 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -94.2 | 136 | 167.2 | -66 | -173.8 | -66.9 | -111.2 | 3.1 | 109.8 | H297 | H297-R304 HydrophobicContact CB-CG 4.2Å |
| 305 | V | 86.4 | Confident | 86.9 | Confident | 20 Ų | 20 | 84 Ų | 84 | 12% | 0.121 | 42% | 0.419 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -131.4 | 146.1 | 176.9 | -77 | 0 | 0 | 0 | 0 | 109.8 | T295 F296 V303 Q310 L311 | T295-V305 CarbonylContact C-O 3.59Å; F296-V305 HydrophobicContact CB-CG2 4.1Å; F296-V305 PolarHBondContact N-O 2.91Å; F296-V305 WeakPolarHBondContact O-CG2 3.3Å; F296-V305 PolarHBondContact O-N 3.44Å; V303-V305 HydrophobicContact CG1-CG1 4.19Å; V305-Q310 HydrophobicContact CB-CB 4.12Å; V305-Q310 HydrophobicContact CB-CG 3.91Å; V305-Q310 VanDerWaalsContact CB-OE1 3.3Å; V305-Q310 HydrophobicContact CG1-CG 3.82Å; V305-Q310 HydrophobicContact CG2-CB 4.46Å; V305-L311 HydrophobicContact CG2-CB 3.64Å; V305-L311 HydrophobicContact CG2-CD1 3.94Å; V305-L311 HydrophobicContact CG2-CG 4.38Å |
| 306 | N | 83 | Confident | 87.8 | Confident | 93 Ų | 93 | 84.4 Ų | 84.4 | 50% | 0.497 | 42% | 0.424 | S | S | . | . | S | Bend | trans | -79.8 | -19.6 | -169.9 | 171.9 | -88.1 | 0 | 0 | 0 | 112.7 | E293 | E293-N306 PolarHBondContact OE1-ND2 3.49Å; E293-N306 PolarHBondContact OE2-ND2 2.84Å |
| 307 | S | 86.8 | Confident | 88.2 | Confident | 51 Ų | 51 | 84 Ų | 84 | 36% | 0.357 | 43% | 0.427 | S | S | . | . | trans | -122.1 | 143.4 | -179.2 | 179.2 | 0 | 0 | 0 | 0 | 113.7 | L309 Q310 L311 | S307-L309 PolarHBondContact O-N 3.14Å; S307-L309 PolarHBondContact OG-N 3.39Å; S307-Q310 WeakPolarHBondContact O-CA 3.42Å; S307-Q310 WeakPolarHBondContact O-CB 3.28Å; S307-Q310 PolarHBondContact O-N 2.89Å; S307-L311 PolarHBondContact O-N 3.39Å | ||
| 308 | E | 87.3 | Confident | 88.2 | Confident | 87 Ų | 87 | 88.3 Ų | 88.3 | 41% | 0.407 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -59.1 | -36.5 | 174.5 | -162.4 | -177.8 | 136.3 | 0 | 0 | 111.4 | F296 Q310 L311 K312 | F296-E308 HydrophobicContact CD1-CB 4.16Å; F296-E308 HydrophobicContact CD1-CG 4.03Å; F296-E308 HydrophobicContact CD2-CB 4.07Å; F296-E308 HydrophobicContact CE1-CB 3.7Å; F296-E308 HydrophobicContact CE1-CG 3.55Å; F296-E308 HydrophobicContact CE2-CB 3.62Å; F296-E308 HydrophobicContact CE2-CG 4.41Å; F296-E308 HydrophobicContact CG-CB 4.34Å; F296-E308 HydrophobicContact CZ-CB 3.42Å; F296-E308 VanDerWaalsContact CZ-CB 3.42Å; F296-E308 HydrophobicContact CZ-CG 3.78Å; E308-Q310 VanDerWaalsContact C-N 3.33Å; E308-L311 PolarHBondContact O-N 2.92Å; E308-K312 HydrophobicContact CG-CD 4.36Å; E308-K312 WeakPolarHBondContact O-CB 3.35Å; E308-K312 WeakPolarHBondContact O-CG 3.1Å; E308-K312 PolarHBondContact O-N 2.85Å; E308-K312 WeakPolarHBondContact OE1-CE 3.47Å; E308-K312 IonicContact OE1-NZ 3.35Å; E308-K312 PolarHBondContact OE1-NZ 2.77Å |
| 309 | L | 90.4 | Very high | 88.2 | Confident | 130 Ų | 130 | 98.7 Ų | 98.7 | 68% | 0.681 | 48% | 0.478 | S | S | * | . | H | α-helix | trans | -67 | -38.2 | 177.3 | -171.8 | 62.1 | 0 | 0 | 0 | 111 | S307 K312 Q313 | S307-L309 PolarHBondContact O-N 3.14Å; S307-L309 PolarHBondContact OG-N 3.39Å; L309-K312 PolarHBondContact O-N 2.99Å; L309-Q313 WeakPolarHBondContact O-CB 3.05Å; L309-Q313 PolarHBondContact O-N 3.07Å |
| 310 | Q | 87.1 | Confident | 88.3 | Confident | 95 Ų | 95 | 93.1 Ų | 93.1 | 44% | 0.444 | 45% | 0.452 | S | S | . | . | H | α-helix | trans | -67 | -36.5 | 174.9 | -164.5 | -179.5 | 29.6 | 0 | 0 | 111.1 | V305 S307 E308 H314 | V305-Q310 HydrophobicContact CB-CB 4.12Å; V305-Q310 HydrophobicContact CB-CG 3.91Å; V305-Q310 VanDerWaalsContact CB-OE1 3.3Å; V305-Q310 HydrophobicContact CG1-CG 3.82Å; V305-Q310 HydrophobicContact CG2-CB 4.46Å; S307-Q310 WeakPolarHBondContact O-CA 3.42Å; S307-Q310 WeakPolarHBondContact O-CB 3.28Å; S307-Q310 PolarHBondContact O-N 2.89Å; E308-Q310 VanDerWaalsContact C-N 3.33Å; Q310-H314 WeakPolarHBondContact O-CB 3.35Å; Q310-H314 PolarHBondContact O-N 3.32Å |
| 311 | L | 92 | Very high | 88.5 | Confident | 24 Ų | 24 | 96.6 Ų | 96.6 | 13% | 0.126 | 46% | 0.458 | C | S | . | . | H | α-helix | trans | -68.2 | -45.3 | 172.4 | -174.6 | 66.3 | 0 | 0 | 0 | 111.8 | F296 C298 V305 S307 E308 Q313 H314 I315 | F296-L311 HydrophobicContact CB-CB 3.7Å; F296-L311 HydrophobicContact CB-CD2 3.73Å; F296-L311 HydrophobicContact CB-CG 4.19Å; F296-L311 HydrophobicContact CD1-CD2 4.25Å; F296-L311 HydrophobicContact CG-CB 4.43Å; F296-L311 HydrophobicContact CG-CD2 4.44Å; C298-L311 HydrophobicContact CB-CD1 3.78Å; V305-L311 HydrophobicContact CG2-CB 3.64Å; V305-L311 HydrophobicContact CG2-CD1 3.94Å; V305-L311 HydrophobicContact CG2-CG 4.38Å; S307-L311 PolarHBondContact O-N 3.39Å; E308-L311 PolarHBondContact O-N 2.92Å; L311-Q313 VanDerWaalsContact C-N 3.29Å; L311-Q313 PolarHBondContact O-N 3.47Å; L311-H314 CarbonylContact O-C 3.6Å; L311-H314 WeakPolarHBondContact O-CB 3.09Å; L311-H314 PolarHBondContact O-N 3.35Å; L311-H314 VanDerWaalsContact O-N 3.11Å; L311-I315 HydrophobicContact CD1-CD1 4.11Å; L311-I315 HydrophobicContact CD1-CG1 4.25Å; L311-I315 HydrophobicContact CD2-CD1 4.12Å; L311-I315 HydrophobicContact CG-CD1 3.73Å; L311-I315 HydrophobicContact CG-CG1 4.27Å; L311-I315 WeakPolarHBondContact O-CB 3.38Å; L311-I315 WeakPolarHBondContact O-CG1 3.08Å; L311-I315 PolarHBondContact O-N 3.1Å |
| 312 | K | 89.6 | Confident | 88.5 | Confident | 103 Ų | 103 | 98.3 Ų | 98.3 | 45% | 0.448 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -59.2 | -40.6 | 175.1 | -75.8 | 167.9 | 170.8 | 170.9 | 0 | 111.6 | E308 L309 S316 | E308-K312 HydrophobicContact CG-CD 4.36Å; E308-K312 WeakPolarHBondContact O-CB 3.35Å; E308-K312 WeakPolarHBondContact O-CG 3.1Å; E308-K312 PolarHBondContact O-N 2.85Å; E308-K312 WeakPolarHBondContact OE1-CE 3.47Å; E308-K312 IonicContact OE1-NZ 3.35Å; E308-K312 PolarHBondContact OE1-NZ 2.77Å; L309-K312 PolarHBondContact O-N 2.99Å; K312-S316 WeakPolarHBondContact O-CB 3.37Å; K312-S316 PolarHBondContact O-N 3.45Å; K312-S316 PolarHBondContact O-OG 3.41Å |
| 313 | Q | 93.3 | Very high | 88.3 | Confident | 137 Ų | 137 | 93 Ų | 93 | 64% | 0.64 | 45% | 0.445 | S | S | * | . | H | α-helix | trans | -66.6 | -40.4 | 173.3 | -166.7 | 178.8 | 19.9 | 0 | 0 | 112.2 | L309 L311 S316 S317 | L309-Q313 WeakPolarHBondContact O-CB 3.05Å; L309-Q313 PolarHBondContact O-N 3.07Å; L311-Q313 VanDerWaalsContact C-N 3.29Å; L311-Q313 PolarHBondContact O-N 3.47Å; Q313-S316 WeakPolarHBondContact CA-OG 3.35Å; Q313-S316 PolarHBondContact O-OG 2.86Å; Q313-S316 VanDerWaalsContact O-OG 3.04Å; Q313-S317 WeakPolarHBondContact O-CB 3.31Å; Q313-S317 PolarHBondContact O-N 3.21Å; Q313-S317 VanDerWaalsContact O-N 3.08Å |
| 314 | H | 93.9 | Very high | 88.1 | Confident | 40 Ų | 40 | 94.1 Ų | 94.1 | 19% | 0.185 | 45% | 0.452 | C | S | . | . | H | α-helix | trans | -60.3 | -50.4 | 173.4 | 173.2 | 91.6 | 0 | 0 | 0 | 111.5 | C298 Q310 L311 S316 S317 H320 | C298-H314 PolarHBondContact SG-NE2 3.03Å; Q310-H314 WeakPolarHBondContact O-CB 3.35Å; Q310-H314 PolarHBondContact O-N 3.32Å; L311-H314 CarbonylContact O-C 3.6Å; L311-H314 WeakPolarHBondContact O-CB 3.09Å; L311-H314 PolarHBondContact O-N 3.35Å; L311-H314 VanDerWaalsContact O-N 3.11Å; H314-S316 PolarHBondContact O-N 3.31Å; H314-S317 WeakPolarHBondContact O-CB 3.43Å; H314-S317 PolarHBondContact O-N 3.39Å; H314-S317 PolarHBondContact O-OG 2.71Å; H314-H320 AromaticContact CD2-ND1 3.59Å; H314-H320 AromaticContact NE2-ND1 3.34Å; H314-H320 PolarHBondContact NE2-ND1 3.32Å; H314-H320 WeakPolarHBondContact O-CB 3.14Å |
| 315 | I | 91.6 | Very high | 87.5 | Confident | 76 Ų | 76 | 87.6 Ų | 87.6 | 39% | 0.39 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -63.6 | -42.2 | -178.6 | -68.2 | 170.2 | 0 | 0 | 0 | 111.4 | L311 S317 H320 | L311-I315 HydrophobicContact CD1-CD1 4.11Å; L311-I315 HydrophobicContact CD1-CG1 4.25Å; L311-I315 HydrophobicContact CD2-CD1 4.12Å; L311-I315 HydrophobicContact CG-CD1 3.73Å; L311-I315 HydrophobicContact CG-CG1 4.27Å; L311-I315 WeakPolarHBondContact O-CB 3.38Å; L311-I315 WeakPolarHBondContact O-CG1 3.08Å; L311-I315 PolarHBondContact O-N 3.1Å; I315-S317 PolarHBondContact O-N 2.94Å; I315-H320 PolarHBondContact O-CD2 2.97Å |
| 316 | S | 90 | Very high | 86.2 | Confident | 81 Ų | 81 | 89.7 Ų | 89.7 | 57% | 0.566 | 47% | 0.465 | S | S | * | . | H | α-helix | trans | -69.7 | -16.5 | 174.8 | 60.7 | 0 | 0 | 0 | 0 | 113.8 | K312 Q313 H314 | K312-S316 WeakPolarHBondContact O-CB 3.37Å; K312-S316 PolarHBondContact O-N 3.45Å; K312-S316 PolarHBondContact O-OG 3.41Å; Q313-S316 WeakPolarHBondContact CA-OG 3.35Å; Q313-S316 PolarHBondContact O-OG 2.86Å; Q313-S316 VanDerWaalsContact O-OG 3.04Å; H314-S316 PolarHBondContact O-N 3.31Å |
| 317 | S | 90.8 | Very high | 84.6 | Confident | 38 Ų | 38 | 92.8 Ų | 92.8 | 27% | 0.266 | 47% | 0.474 | S | S | . | . | S | Bend | trans | -65.2 | 146.3 | -178.7 | 84.1 | 0 | 0 | 0 | 0 | 111.8 | Q313 H314 I315 R319 H320 R321 | Q313-S317 WeakPolarHBondContact O-CB 3.31Å; Q313-S317 PolarHBondContact O-N 3.21Å; Q313-S317 VanDerWaalsContact O-N 3.08Å; H314-S317 WeakPolarHBondContact O-CB 3.43Å; H314-S317 PolarHBondContact O-N 3.39Å; H314-S317 PolarHBondContact O-OG 2.71Å; I315-S317 PolarHBondContact O-N 2.94Å; S317-R319 PolarHBondContact O-N 3.26Å; S317-H320 PolarHBondContact O-N 3.4Å; S317-H320 PolarHBondContact OG-N 3.1Å; S317-R321 WeakPolarHBondContact O-CG 3.45Å; S317-R321 PolarHBondContact O-N 2.94Å; S317-R321 VanDerWaalsContact O-N 3.13Å |
| 318 | R | 89.1 | Confident | 82.8 | Confident | 194 Ų | 194 | 95.8 Ų | 95.8 | 73% | 0.732 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -56.2 | -36.6 | 176.4 | -178.5 | 173.5 | 178.9 | 179.7 | 5.5 | 112.3 | R321 D322 | R318-R321 PolarHBondContact O-N 3.4Å; R318-D322 VanDerWaalsContact CG-OD2 3.26Å; R318-D322 WeakPolarHBondContact CG-OD2 3.5Å; R318-D322 IonicContact NE-OD2 2.65Å; R318-D322 PolarHBondContact NE-OD2 2.79Å; R318-D322 WeakPolarHBondContact O-CB 3.28Å; R318-D322 PolarHBondContact O-N 3.38Å |
| 319 | R | 86.8 | Confident | 81 | Confident | 224 Ų | 224 | 96.2 Ų | 96.2 | 85% | 0.845 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -63.5 | -42.6 | -179.4 | -66.9 | -178.4 | 179.6 | 176.3 | -0.4 | 112.5 | S317 G323 | S317-R319 PolarHBondContact O-N 3.26Å; R319-G323 PolarHBondContact O-N 2.67Å |
| 320 | H | 89.3 | Confident | 79.3 | Confident | 11 Ų | 11 | 95.6 Ų | 95.6 | 5% | 0.051 | 50% | 0.501 | C | S | . | . | H | α-helix | trans | -66.5 | -48.1 | 175.1 | 177.4 | 90.7 | 0 | 0 | 0 | 110.9 | C298 H314 I315 S317 D322 G323 V324 | C298-H320 PolarHBondContact SG-CE1 2.87Å; C298-H320 PolarHBondContact SG-ND1 2.92Å; H314-H320 AromaticContact CD2-ND1 3.59Å; H314-H320 AromaticContact NE2-ND1 3.34Å; H314-H320 PolarHBondContact NE2-ND1 3.32Å; H314-H320 WeakPolarHBondContact O-CB 3.14Å; I315-H320 PolarHBondContact O-CD2 2.97Å; S317-H320 PolarHBondContact O-N 3.4Å; S317-H320 PolarHBondContact OG-N 3.1Å; H320-D322 VanDerWaalsContact C-N 3.33Å; H320-D322 PolarHBondContact O-N 3.44Å; H320-G323 CarbonylContact O-C 3.59Å; H320-G323 WeakPolarHBondContact O-CA 3.35Å; H320-G323 PolarHBondContact O-N 3.37Å; H320-V324 WeakPolarHBondContact NE2-CG2 3.45Å; H320-V324 WeakPolarHBondContact O-CG2 3.41Å; H320-V324 PolarHBondContact O-N 3.11Å |
| 321 | R | 88.4 | Confident | 77.8 | Confident | 172 Ų | 172 | 97.9 Ų | 97.9 | 65% | 0.649 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -59.7 | -39.4 | 178.9 | -66.5 | -179.2 | 64.2 | -164 | -1.4 | 113.4 | S317 R318 G323 A325 | S317-R321 WeakPolarHBondContact O-CG 3.45Å; S317-R321 PolarHBondContact O-N 2.94Å; S317-R321 VanDerWaalsContact O-N 3.13Å; R318-R321 PolarHBondContact O-N 3.4Å; R321-G323 VanDerWaalsContact C-N 3.32Å; R321-A325 PolarHBondContact O-N 2.88Å |
| 322 | D | 84.6 | Confident | 76 | Confident | 83 Ų | 83 | 103.3 Ų | 103.3 | 44% | 0.444 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -68.3 | -32.1 | 176 | -69.3 | -20.8 | 0 | 0 | 0 | 111.2 | R318 H320 | R318-D322 VanDerWaalsContact CG-OD2 3.26Å; R318-D322 WeakPolarHBondContact CG-OD2 3.5Å; R318-D322 IonicContact NE-OD2 2.65Å; R318-D322 PolarHBondContact NE-OD2 2.79Å; R318-D322 WeakPolarHBondContact O-CB 3.28Å; R318-D322 PolarHBondContact O-N 3.38Å; H320-D322 VanDerWaalsContact C-N 3.33Å; H320-D322 PolarHBondContact O-N 3.44Å |
| 323 | G | 80.6 | Confident | 73.9 | Confident | 37 Ų | 37 | 103.9 Ų | 103.9 | 38% | 0.381 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -73.2 | -39.8 | 173.2 | 0 | 0 | 0 | 0 | 0 | 114.4 | R319 H320 R321 A325 G326 | R319-G323 PolarHBondContact O-N 2.67Å; H320-G323 CarbonylContact O-C 3.59Å; H320-G323 WeakPolarHBondContact O-CA 3.35Å; H320-G323 PolarHBondContact O-N 3.37Å; R321-G323 VanDerWaalsContact C-N 3.32Å; G323-A325 PolarHBondContact O-N 3.33Å; G323-G326 PolarHBondContact O-N 3.03Å |
| 324 | V | 80.4 | Confident | 71.9 | Confident | 85 Ų | 85 | 107.8 Ų | 107.8 | 52% | 0.515 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -58.7 | -34.1 | 173.1 | 172.3 | 0 | 0 | 0 | 0 | 111.5 | I300 H320 G326 | I300-V324 HydrophobicContact CD1-CG2 3.94Å; I300-V324 HydrophobicContact CG1-CG2 4.36Å; I300-V324 HydrophobicContact CG2-CG2 3.83Å; H320-V324 WeakPolarHBondContact NE2-CG2 3.45Å; H320-V324 WeakPolarHBondContact O-CG2 3.41Å; H320-V324 PolarHBondContact O-N 3.11Å; V324-G326 PolarHBondContact O-N 2.98Å |
| 325 | A | 75 | Confident | 69.9 | Low | 58 Ų | 58 | 114 Ų | 114 | 48% | 0.479 | 60% | 0.599 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -72.8 | 13.2 | -178.7 | 0 | 0 | 0 | 0 | 0 | 114.8 | R321 G323 K327 | R321-A325 PolarHBondContact O-N 2.88Å; G323-A325 PolarHBondContact O-N 3.33Å; A325-K327 PolarHBondContact O-N 3.44Å |
| 326 | G | 60 | Low | 67.6 | Low | 64 Ų | 64 | 120 Ų | 120 | 66% | 0.66 | 62% | 0.622 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 65.9 | 10.5 | 173 | 0 | 0 | 0 | 0 | 0 | 115.1 | G323 V324 P328 | G323-G326 PolarHBondContact O-N 3.03Å; V324-G326 PolarHBondContact O-N 2.98Å; G326-P328 WeakPolarHBondContact O-CD 3.45Å |
| 327 | K | 49.7 | Very low | 65.3 | Low | 158 Ų | 158 | 125.9 Ų | 125.9 | 69% | 0.687 | 64% | 0.637 | S | S | * | * | trans | -86.5 | 104.2 | 177.6 | -72.8 | 163.4 | -175.7 | 173 | 0 | 107.7 | A325 N329 | A325-K327 PolarHBondContact O-N 3.44Å; K327-N329 PolarHBondContact O-N 2.75Å; K327-N329 VanDerWaalsContact O-N 3.11Å | ||
| 328 | P | 49.3 | Very low | 63.2 | Low | 115 Ų | 115 | 135.6 Ų | 135.6 | 75% | 0.747 | 67% | 0.668 | S | S | * | * | trans | -61.7 | 121.1 | -178.6 | 26.1 | -34 | 0 | 0 | 0 | 108.8 | G326 P330 | G326-P328 WeakPolarHBondContact O-CD 3.45Å; P328-P330 VanDerWaalsContact O-CD 3.25Å; P328-P330 WeakPolarHBondContact O-CD 3.44Å | ||
| 329 | N | 49 | Very low | 61.1 | Low | 96 Ų | 96 | 131.9 Ų | 131.9 | 51% | 0.513 | 67% | 0.667 | S | S | . | * | trans | -68.7 | 113.1 | 173.7 | -176.4 | -31.2 | 0 | 0 | 0 | 107.9 | K327 L331 | K327-N329 PolarHBondContact O-N 2.75Å; K327-N329 VanDerWaalsContact O-N 3.11Å; N329-L331 PolarHBondContact O-N 3.22Å; N329-L331 PolarHBondContact OD1-N 3.44Å | ||
| 330 | P | 55.1 | Low | 58.8 | Low | 117 Ų | 117 | 128.2 Ų | 128.2 | 76% | 0.76 | 67% | 0.665 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -69.4 | -5 | -168.1 | 27.9 | -35.3 | 0 | 0 | 0 | 114 | P328 | P328-P330 VanDerWaalsContact O-CD 3.25Å; P328-P330 WeakPolarHBondContact O-CD 3.44Å |
| 331 | L | 55.5 | Low | 56.5 | Low | 142 Ų | 142 | 137.4 Ų | 137.4 | 74% | 0.743 | 71% | 0.705 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -101.5 | -7.5 | -173.3 | -58 | -173.2 | 0 | 0 | 0 | 115.4 | N329 | N329-L331 PolarHBondContact O-N 3.22Å; N329-L331 PolarHBondContact OD1-N 3.44Å |
| 332 | L | 52.9 | Low | 54.4 | Low | 139 Ų | 139 | 137.6 Ų | 137.6 | 73% | 0.728 | 72% | 0.715 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -105.5 | -13.3 | -175.9 | -61.2 | -173.9 | 0 | 0 | 0 | 115.6 | R334 | L332-R334 PolarHBondContact O-N 2.9Å; L332-R334 VanDerWaalsContact O-N 3.14Å |
| 333 | S | 46 | Very low | 51.8 | Low | 115 Ų | 115 | 142.5 Ų | 142.5 | 80% | 0.804 | 74% | 0.735 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.9 | 6.6 | -179.6 | -59 | 0 | 0 | 0 | 0 | 115.6 | ||
| 334 | R | 51.2 | Low | 49.7 | Very low | 219 Ų | 219 | 147.4 Ų | 147.4 | 83% | 0.826 | 75% | 0.752 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -85.7 | -16 | -174.9 | -173.9 | 162.6 | -79.1 | -119.3 | -0.4 | 115 | L332 | L332-R334 PolarHBondContact O-N 2.9Å; L332-R334 VanDerWaalsContact O-N 3.14Å |
| 335 | H | 52.3 | Low | 48 | Very low | 169 Ų | 169 | 148 Ų | 148 | 78% | 0.782 | 76% | 0.757 | S | S | * | * | S | Bend | trans | -123.9 | 58.3 | -169.1 | -63.1 | 116.2 | 0 | 0 | 0 | 114.9 | ||
| 336 | K | 44.3 | Very low | 46.1 | Very low | 204 Ų | 204 | 153.6 Ų | 153.6 | 89% | 0.887 | 77% | 0.771 | S | S | * | * | S | Bend | trans | -150.1 | 44 | 165.7 | -159.3 | 70 | 176.3 | 178 | 0 | 113.6 | ||
| 337 | K | 40.2 | Very low | 44.8 | Very low | 203 Ų | 203 | 156.3 Ų | 156.3 | 88% | 0.883 | 78% | 0.775 | S | S | * | * | trans | -152.1 | 68.8 | 167.3 | -161.6 | 179.6 | -176.6 | -179.5 | 0 | 113 | ||||
| 338 | R | 46.3 | Very low | 44.1 | Very low | 242 Ų | 242 | 157.2 Ų | 157.2 | 91% | 0.913 | 79% | 0.786 | S | S | * | * | trans | -155.7 | 49.4 | 158.5 | -152.7 | 173.5 | 177.8 | 148.2 | 0.5 | 114 | ||||
| 339 | T | 45.2 | Very low | 43.3 | Very low | 117 Ų | 117 | 155.2 Ų | 155.2 | 72% | 0.718 | 79% | 0.787 | S | S | * | * | trans | -140 | 108.6 | 152.1 | 52 | 0 | 0 | 0 | 0 | 100.2 | ||||
| 340 | D | 39.5 | Very low | 42.8 | Very low | 147 Ų | 147 | 157.1 Ų | 157.1 | 79% | 0.786 | 80% | 0.804 | S | S | * | * | S | Bend | cis | -139.8 | -160.1 | 44.7 | -53.4 | -57.1 | 0 | 0 | 0 | 112.4 | ||
| 341 | F | 40.7 | Very low | 41.9 | Very low | 203 Ų | 203 | 154.8 Ų | 154.8 | 89% | 0.89 | 80% | 0.801 | S | S | * | * | trans | 76.9 | 72.1 | -174.5 | -78.5 | -94.5 | 0 | 0 | 0 | 117.1 | ||||
| 342 | M | 43.8 | Very low | 41.1 | Very low | 177 Ų | 177 | 156.2 Ų | 156.2 | 87% | 0.872 | 81% | 0.809 | S | S | * | * | trans | -133.2 | 83.6 | 135.4 | -93.1 | -127.4 | 66.5 | 0 | 0 | 109.5 | ||||
| 343 | E | 30 | Very low | 40.8 | Very low | 185 Ų | 185 | 157.8 Ų | 157.8 | 86% | 0.864 | 82% | 0.817 | S | S | * | * | trans | -139 | 143.1 | 147.5 | -87.4 | -140.5 | 104 | 0 | 0 | 108.9 | ||||
| 344 | L | 36.2 | Very low | 40.6 | Very low | 140 Ų | 140 | 158.4 Ų | 158.4 | 73% | 0.733 | 82% | 0.818 | S | S | * | * | trans | -123 | 132.1 | -173.7 | 171 | 59.5 | 0 | 0 | 0 | 105.9 | ||||
| 345 | P | 45.9 | Very low | 40 | Very low | 97 Ų | 97 | 152.9 Ų | 152.9 | 63% | 0.63 | 81% | 0.814 | S | S | * | * | -149 | 135.1 | 106.4 | 31.1 | -11.7 | 0 | 0 | 0 | 116.8 | |||||
| 346 | K | 35.3 | Very low | 39.9 | Very low | 177 Ų | 177 | 150.8 Ų | 150.8 | 77% | 0.77 | 82% | 0.815 | S | S | * | * | trans | 60.4 | 119.8 | 137.7 | -55.3 | 159.4 | -167 | 163.6 | 0 | 115.2 | ||||
| 347 | T | 32.3 | Very low | 39.8 | Very low | 121 Ų | 121 | 148.8 Ų | 148.8 | 74% | 0.742 | 81% | 0.813 | S | S | * | * | -172.5 | 158.9 | 65.8 | 43.5 | 0 | 0 | 0 | 0 | 113 | |||||
| 348 | L | 33.8 | Very low | 39.8 | Very low | 176 Ų | 176 | 143.7 Ų | 143.7 | 92% | 0.921 | 81% | 0.809 | S | S | * | * | trans | 57.1 | 124.1 | 148.2 | -72.2 | 157.7 | 0 | 0 | 0 | 120.8 | ||||
| 349 | G | 32.7 | Very low | 39.5 | Very low | 73 Ų | 73 | 139 Ų | 139 | 75% | 0.753 | 81% | 0.807 | S | S | * | * | trans | 143.5 | 111.7 | 160 | 0 | 0 | 0 | 0 | 0 | 114 | ||||
| 350 | P | 40.4 | Very low | 39 | Very low | 136 Ų | 136 | 138.5 Ų | 138.5 | 88% | 0.883 | 81% | 0.814 | S | S | * | * | trans | -93 | 149.4 | -174.1 | 35.5 | -34 | 0 | 0 | 0 | 114 | ||||
| 351 | G | 36 | Very low | 38.8 | Very low | 68 Ų | 68 | 136.1 Ų | 136.1 | 70% | 0.701 | 82% | 0.815 | S | S | * | * | trans | 116.2 | 131.1 | 140.8 | 0 | 0 | 0 | 0 | 0 | 118.8 | ||||
| 352 | L | 38.9 | Very low | 38.5 | Very low | 173 Ų | 173 | 131.6 Ų | 131.6 | 91% | 0.906 | 82% | 0.815 | S | S | * | * | trans | 75.8 | 91.7 | 147.2 | -48.8 | -177.1 | 0 | 0 | 0 | 118.5 | ||||
| 353 | L | 45.2 | Very low | 38.3 | Very low | 172 Ų | 172 | 132 Ų | 132 | 90% | 0.901 | 82% | 0.817 | S | S | * | * | trans | -72.6 | 139.7 | 158.1 | -60.7 | 170.4 | 0 | 0 | 0 | 110.8 | ||||
| 354 | P | 42.9 | Very low | 38.6 | Very low | 127 Ų | 127 | 127.9 Ų | 127.9 | 83% | 0.825 | 81% | 0.814 | S | S | * | * | trans | -95.1 | 106.5 | 160.8 | 6.9 | 12.3 | 0 | 0 | 0 | 110.4 | ||||
| 355 | S | 37.4 | Very low | 38.5 | Very low | 104 Ų | 104 | 126.3 Ų | 126.3 | 73% | 0.727 | 82% | 0.822 | S | S | * | * | trans | -88.8 | 130.8 | 162.7 | 179.1 | 0 | 0 | 0 | 0 | 109.2 | L357 | S355-L357 PolarHBondContact O-N 2.91Š| ||
| 356 | P | 49.9 | Very low | 37.8 | Very low | 125 Ų | 125 | 126.9 Ų | 126.9 | 81% | 0.812 | 84% | 0.835 | S | S | * | * | S | Bend | trans | -86.2 | 70.9 | -171.7 | 35.5 | -36.1 | 0 | 0 | 0 | 112.1 | ||
| 357 | L | 43.8 | Very low | 37.7 | Very low | 162 Ų | 162 | 123.5 Ų | 123.5 | 85% | 0.848 | 84% | 0.84 | S | S | * | * | trans | -152.6 | 53 | 174.4 | -150.1 | 85.3 | 0 | 0 | 0 | 115.8 | S355 | S355-L357 PolarHBondContact O-N 2.91Š| ||
| 358 | A | 39.2 | Very low | 38 | Very low | 95 Ų | 95 | 123.1 Ų | 123.1 | 79% | 0.785 | 84% | 0.842 | S | S | * | * | trans | -174 | 118.5 | 155 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 359 | V | 39.8 | Very low | 38.3 | Very low | 145 Ų | 145 | 119.2 Ų | 119.2 | 88% | 0.879 | 83% | 0.83 | S | S | * | * | -174 | 108.1 | 128 | 165.4 | 0 | 0 | 0 | 0 | 106.4 | |||||
| 360 | A | 36.3 | Very low | 38.5 | Very low | 106 Ų | 106 | 121.9 Ų | 121.9 | 88% | 0.876 | 83% | 0.826 | S | S | * | * | trans | -136.3 | 90.6 | 165.7 | 0 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 361 | A | 34.8 | Very low | 38.3 | Very low | 96 Ų | 96 | 122.3 Ų | 122.3 | 79% | 0.793 | 82% | 0.817 | S | S | * | * | trans | -173.1 | 97.8 | 167.1 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 362 | A | 33.6 | Very low | 38.1 | Very low | 109 Ų | 109 | 126.5 Ų | 126.5 | 90% | 0.901 | 82% | 0.822 | S | S | * | * | trans | -157.6 | 99.4 | 154.4 | 0 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 363 | M | 40.3 | Very low | 37.8 | Very low | 186 Ų | 186 | 122 Ų | 122 | 92% | 0.916 | 81% | 0.81 | S | S | * | * | trans | -95 | 153.4 | -178.7 | -82.4 | -84.3 | -161.7 | 0 | 0 | 111.7 | ||||
| 364 | A | 35.5 | Very low | 37.2 | Very low | 97 Ų | 97 | 121.7 Ų | 121.7 | 80% | 0.802 | 81% | 0.808 | S | S | * | * | trans | 55.9 | 102.7 | 147.5 | 0 | 0 | 0 | 0 | 0 | 120.3 | ||||
| 365 | A | 33.8 | Very low | 36.9 | Very low | 108 Ų | 108 | 126.8 Ų | 126.8 | 89% | 0.893 | 81% | 0.811 | S | S | * | * | trans | -161.9 | 85.5 | 146.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 366 | A | 32.9 | Very low | 37.3 | Very low | 109 Ų | 109 | 126.4 Ų | 126.4 | 90% | 0.901 | 81% | 0.806 | S | S | * | * | trans | -160 | 71.4 | 169.6 | 0 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 367 | A | 32.1 | Very low | 37.3 | Very low | 105 Ų | 105 | 126.3 Ų | 126.3 | 87% | 0.868 | 81% | 0.806 | S | S | * | * | trans | -150.3 | 101.4 | 171.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 368 | S | 38 | Very low | 36.7 | Very low | 114 Ų | 114 | 121.9 Ų | 121.9 | 80% | 0.797 | 80% | 0.799 | S | S | * | * | trans | -174.6 | 99 | 163.3 | -175.4 | 0 | 0 | 0 | 0 | 106.8 | ||||
| 369 | S | 39.8 | Very low | 37 | Very low | 94 Ų | 94 | 124.1 Ų | 124.1 | 66% | 0.657 | 81% | 0.805 | S | S | * | * | 72 | 122.8 | 75 | -167.5 | 0 | 0 | 0 | 0 | 110.8 | |||||
| 370 | N | 37.2 | Very low | 36.7 | Very low | 128 Ų | 128 | 121.6 Ų | 121.6 | 68% | 0.684 | 80% | 0.8 | S | S | * | * | cis | -146.5 | 179.5 | 8.1 | -78.8 | -36.6 | 0 | 0 | 0 | 109.2 | ||||
| 371 | Q | 36.3 | Very low | 37.2 | Very low | 146 Ų | 146 | 122.2 Ų | 122.2 | 68% | 0.682 | 80% | 0.795 | S | S | * | * | cis | -167.7 | 153 | 45.2 | -81.2 | -67.4 | 16.4 | 0 | 0 | 113.8 | ||||
| 372 | L | 32.8 | Very low | 37.3 | Very low | 156 Ų | 156 | 126.2 Ų | 126.2 | 82% | 0.817 | 80% | 0.797 | S | S | * | * | trans | 52.7 | 144.7 | 142.9 | -62.9 | 160.4 | 0 | 0 | 0 | 121.1 | ||||
| 373 | A | 32.5 | Very low | 37.9 | Very low | 78 Ų | 78 | 127.1 Ų | 127.1 | 65% | 0.645 | 79% | 0.794 | S | S | * | * | cis | -167.8 | 144 | -9.2 | 0 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 374 | L | 32.5 | Very low | 37.6 | Very low | 166 Ų | 166 | 127 Ų | 127 | 87% | 0.869 | 79% | 0.79 | S | S | * | * | trans | 55.6 | 99.4 | 141 | -56.7 | 172.2 | 0 | 0 | 0 | 125.2 | ||||
| 375 | R | 36.1 | Very low | 38.3 | Very low | 233 Ų | 233 | 127.3 Ų | 127.3 | 88% | 0.879 | 78% | 0.784 | S | S | * | * | 42.2 | 172.7 | 112.7 | -127.7 | -163.9 | 147.2 | 86 | -3.5 | 123.3 | |||||
| 376 | P | 46.5 | Very low | 38.2 | Very low | 96 Ų | 96 | 130 Ų | 130 | 62% | 0.623 | 78% | 0.778 | S | S | * | * | -118.2 | -141.8 | -107.5 | 48.4 | -29.9 | 0 | 0 | 0 | 113.4 | |||||
| 377 | P | 49.5 | Very low | 38.2 | Very low | 124 Ų | 124 | 131.3 Ų | 131.3 | 81% | 0.805 | 77% | 0.769 | S | S | * | * | cis | -127.2 | -170 | -28.7 | 38.9 | -19.5 | 0 | 0 | 0 | 114.3 | ||||
| 378 | G | 31.9 | Very low | 38.3 | Very low | 68 Ų | 68 | 133.5 Ų | 133.5 | 70% | 0.701 | 77% | 0.766 | S | S | * | * | trans | -101.6 | 178 | -177.8 | 0 | 0 | 0 | 0 | 0 | 117.6 | ||||
| 379 | P | 44.5 | Very low | 38.2 | Very low | 142 Ų | 142 | 137.6 Ų | 137.6 | 92% | 0.922 | 77% | 0.772 | S | S | * | * | -151.4 | -168.6 | 112.7 | 38.1 | -17.3 | 0 | 0 | 0 | 117.4 | |||||
| 380 | A | 34.1 | Very low | 37.9 | Very low | 93 Ų | 93 | 136.8 Ų | 136.8 | 77% | 0.769 | 78% | 0.779 | S | S | * | * | trans | -89.8 | -161 | -169.3 | 0 | 0 | 0 | 0 | 0 | 115.7 | ||||
| 381 | P | 46 | Very low | 37.9 | Very low | 118 Ų | 118 | 137.3 Ų | 137.3 | 77% | 0.766 | 79% | 0.787 | S | S | * | * | cis | -140 | -155.4 | -3.9 | 42.8 | -19.5 | 0 | 0 | 0 | 117.1 | ||||
| 382 | H | 36.6 | Very low | 38.8 | Very low | 181 Ų | 181 | 135.3 Ų | 135.3 | 84% | 0.838 | 79% | 0.787 | S | S | * | * | trans | -74.7 | 167.7 | -171.1 | -47 | -80.3 | 0 | 0 | 0 | 118.8 | ||||
| 383 | P | 47.2 | Very low | 39 | Very low | 128 Ų | 128 | 135.3 Ų | 135.3 | 83% | 0.831 | 79% | 0.787 | S | S | * | * | -153.3 | -175.1 | 103.9 | 38.8 | -18.5 | 0 | 0 | 0 | 118.8 | |||||
| 384 | H | 34.6 | Very low | 39.1 | Very low | 182 Ų | 182 | 136.9 Ų | 136.9 | 84% | 0.843 | 79% | 0.793 | S | S | * | * | trans | -82.5 | -164.3 | 179.2 | -68.5 | -102.5 | 0 | 0 | 0 | 114.3 | ||||
| 385 | P | 50.5 | Low | 39.7 | Very low | 104 Ų | 104 | 137 Ų | 137 | 68% | 0.675 | 79% | 0.793 | S | S | * | * | cis | -143.2 | -162.8 | -0.8 | 24.2 | 6.2 | 0 | 0 | 0 | 118 | ||||
| 386 | H | 31.2 | Very low | 39.8 | Very low | 165 Ų | 165 | 134.3 Ų | 134.3 | 76% | 0.764 | 80% | 0.796 | S | S | * | * | trans | 74.1 | 161.5 | 164.4 | -71.5 | -87.8 | 0 | 0 | 0 | 121 | ||||
| 387 | L | 32.9 | Very low | 40.1 | Very low | 136 Ų | 136 | 141 Ų | 141 | 71% | 0.712 | 81% | 0.808 | S | S | * | * | cis | -165.6 | 146.4 | -47.5 | -109.3 | -167 | 0 | 0 | 0 | 109.5 | ||||
| 388 | L | 34.4 | Very low | 40 | Very low | 152 Ų | 152 | 140.5 Ų | 140.5 | 80% | 0.796 | 81% | 0.805 | S | S | * | * | trans | 67.9 | 141.6 | 153.9 | -71.9 | 163.6 | 0 | 0 | 0 | 123.9 | ||||
| 389 | Q | 36.2 | Very low | 40.5 | Very low | 199 Ų | 199 | 141.6 Ų | 141.6 | 93% | 0.93 | 81% | 0.807 | S | S | * | * | trans | 103.7 | 117.4 | 139 | -152.3 | 162.6 | 2.8 | 0 | 0 | 120.2 | ||||
| 390 | G | 32.7 | Very low | 40.8 | Very low | 78 Ų | 78 | 141.2 Ų | 141.2 | 80% | 0.804 | 81% | 0.805 | S | S | * | * | trans | 135.2 | 96.3 | 160.3 | 0 | 0 | 0 | 0 | 0 | 117.8 | ||||
| 391 | T | 36.8 | Very low | 42.1 | Very low | 138 Ų | 138 | 139.5 Ų | 139.5 | 85% | 0.847 | 80% | 0.797 | S | S | * | * | trans | -110.6 | 173.5 | 164.3 | 46.8 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 392 | P | 55.3 | Low | 42.4 | Very low | 105 Ų | 105 | 140.2 Ų | 140.2 | 68% | 0.682 | 80% | 0.801 | S | S | * | * | cis | -133.2 | -161.1 | -28.1 | 26.6 | -2.2 | 0 | 0 | 0 | 112.7 | ||||
| 393 | L | 37.3 | Very low | 43.1 | Very low | 156 Ų | 156 | 139.3 Ų | 139.3 | 82% | 0.817 | 80% | 0.801 | S | S | * | * | trans | 87.3 | 101.6 | 158.3 | -52.3 | 177.5 | 0 | 0 | 0 | 119.5 | ||||
| 394 | S | 34.8 | Very low | 43.2 | Very low | 111 Ų | 111 | 144.1 Ų | 144.1 | 78% | 0.776 | 80% | 0.802 | S | S | * | * | -179.9 | 134.1 | 109.4 | -85.3 | 0 | 0 | 0 | 0 | 115.2 | |||||
| 395 | L | 43.8 | Very low | 43.7 | Very low | 168 Ų | 168 | 142 Ų | 142 | 88% | 0.88 | 80% | 0.802 | S | S | * | * | trans | 65.5 | 61.7 | 148 | -56.9 | 172.3 | 0 | 0 | 0 | 120.2 | R397 | L395-R397 PolarHBondContact O-N 3.04Š| ||
| 396 | L | 40.1 | Very low | 43.5 | Very low | 177 Ų | 177 | 143.5 Ų | 143.5 | 93% | 0.927 | 81% | 0.81 | S | S | * | * | trans | -75.6 | 109.5 | 148.7 | -87.8 | 159 | 0 | 0 | 0 | 109.6 | P398 | L396-P398 WeakPolarHBondContact O-CD 3.32Š| ||
| 397 | R | 52 | Low | 44.3 | Very low | 235 Ų | 235 | 143.3 Ų | 143.3 | 89% | 0.887 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -79 | 121.5 | 179.2 | -177.1 | -177.6 | -179.2 | 104.8 | -2.2 | 111 | L395 | L395-R397 PolarHBondContact O-N 3.04Š|
| 398 | P | 47.2 | Very low | 45.5 | Very low | 115 Ų | 115 | 139 Ų | 139 | 75% | 0.747 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -66.5 | 142.6 | 172.1 | -19.8 | 33.3 | 0 | 0 | 0 | 112 | L396 | L396-P398 WeakPolarHBondContact O-CD 3.32Š|
| 399 | A | 41.5 | Very low | 46.6 | Very low | 90 Ų | 90 | 137.8 Ų | 137.8 | 74% | 0.744 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -71.2 | 151.2 | 174.5 | 0 | 0 | 0 | 0 | 0 | 111.5 | G401 | A399-G401 PolarHBondContact O-N 3.21Š|
| 400 | P | 51.3 | Low | 47.5 | Very low | 135 Ų | 135 | 134.1 Ų | 134.1 | 88% | 0.877 | 78% | 0.784 | S | S | * | * | trans | -67.9 | 115.3 | -175.4 | -18.1 | 32.1 | 0 | 0 | 0 | 112.3 | ||||
| 401 | G | 61.2 | Low | 48.6 | Very low | 57 Ų | 57 | 137.8 Ų | 137.8 | 59% | 0.588 | 79% | 0.785 | S | S | * | * | trans | -76.2 | 163 | 169.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | A399 I403 | A399-G401 PolarHBondContact O-N 3.21Å; G401-I403 PolarHBondContact O-N 2.98Å | ||
| 402 | P | 53.6 | Low | 49.6 | Very low | 132 Ų | 132 | 140.3 Ų | 140.3 | 86% | 0.857 | 78% | 0.784 | S | S | * | * | trans | -68.4 | 123.1 | 178.7 | -14.4 | 29.2 | 0 | 0 | 0 | 110.9 | R404 | P402-R404 PolarHBondContact O-N 2.91Å; P402-R404 VanDerWaalsContact O-N 3.14Å | ||
| 403 | I | 50.5 | Low | 49.1 | Very low | 163 Ų | 163 | 141.5 Ų | 141.5 | 84% | 0.836 | 79% | 0.79 | S | S | * | * | trans | -67.5 | 112.5 | 176.1 | -61.1 | 173.6 | 0 | 0 | 0 | 108.8 | G401 | G401-I403 PolarHBondContact O-N 2.98Š| ||
| 404 | R | 49 | Very low | 50.6 | Low | 229 Ų | 229 | 139.9 Ų | 139.9 | 86% | 0.864 | 79% | 0.789 | S | S | * | * | trans | -76.2 | 123 | 164 | -61.2 | -178.9 | 75.4 | -164.2 | 3.8 | 107.6 | P402 T406 | P402-R404 PolarHBondContact O-N 2.91Å; P402-R404 VanDerWaalsContact O-N 3.14Å; R404-T406 PolarHBondContact O-N 3.49Å | ||
| 405 | T | 45.1 | Very low | 50.8 | Low | 136 Ų | 136 | 149.1 Ų | 149.1 | 83% | 0.834 | 81% | 0.809 | S | S | * | * | trans | -67.7 | 113.9 | 172 | 49.7 | 0 | 0 | 0 | 0 | 109.5 | H407 | T405-H407 PolarHBondContact O-N 3.14Š| ||
| 406 | T | 47.2 | Very low | 51.2 | Low | 137 Ų | 137 | 148.2 Ų | 148.2 | 84% | 0.84 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -68.4 | 119.9 | 173.1 | 43.8 | 0 | 0 | 0 | 0 | 110.2 | R404 | R404-T406 PolarHBondContact O-N 3.49Š|
| 407 | H | 48 | Very low | 51.7 | Low | 160 Ų | 160 | 146.6 Ų | 146.6 | 74% | 0.741 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -67.6 | 128.1 | 168.5 | -170.8 | -78.7 | 0 | 0 | 0 | 109 | T405 | T405-H407 PolarHBondContact O-N 3.14Š|
| 408 | G | 57.5 | Low | 51.7 | Low | 47 Ų | 47 | 141.7 Ų | 141.7 | 49% | 0.485 | 79% | 0.794 | S | S | . | * | P | Polyproline II helix | trans | -68.4 | 159.9 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.5 | I410 | G408-I410 PolarHBondContact O-N 2.85Š|
| 409 | P | 57.3 | Low | 52 | Low | 125 Ų | 125 | 143.3 Ų | 143.3 | 81% | 0.812 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -71 | 123.6 | 175.5 | 29.1 | -32.8 | 0 | 0 | 0 | 110.4 | L411 | P409-L411 PolarHBondContact O-N 3.14Š|
| 410 | I | 55.8 | Low | 52.7 | Low | 122 Ų | 122 | 146.6 Ų | 146.6 | 63% | 0.626 | 80% | 0.8 | S | S | * | * | trans | -77.1 | 113.3 | 168.7 | -64.2 | 172.1 | 0 | 0 | 0 | 107.4 | G408 F412 | G408-I410 PolarHBondContact O-N 2.85Å; I410-F412 HydrophobicContact CG2-CD2 4.08Å; I410-F412 HydrophobicContact CG2-CE2 4.27Å; I410-F412 PolarHBondContact O-N 2.9Å | ||
| 411 | L | 55.9 | Low | 52.7 | Low | 156 Ų | 156 | 147.4 Ų | 147.4 | 82% | 0.817 | 80% | 0.795 | S | S | * | * | trans | -78.4 | 112.9 | 167.1 | -69.4 | 172.6 | 0 | 0 | 0 | 108.7 | P409 | P409-L411 PolarHBondContact O-N 3.14Š| ||
| 412 | F | 57.8 | Low | 52.1 | Low | 190 Ų | 190 | 153.9 Ų | 153.9 | 83% | 0.833 | 81% | 0.809 | S | S | * | * | trans | -78.5 | 120.3 | 165 | -98.6 | -102 | 0 | 0 | 0 | 109.3 | I410 | I410-F412 HydrophobicContact CG2-CD2 4.08Å; I410-F412 HydrophobicContact CG2-CE2 4.27Å; I410-F412 PolarHBondContact O-N 2.9Å | ||
| 413 | T | 45.3 | Very low | 52 | Low | 131 Ų | 131 | 155.5 Ų | 155.5 | 80% | 0.804 | 81% | 0.806 | S | S | * | * | trans | -104.5 | 113.5 | 163.7 | 49.2 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 414 | P | 66.9 | Low | 52.2 | Low | 122 Ų | 122 | 154.9 Ų | 154.9 | 79% | 0.792 | 80% | 0.803 | S | S | * | * | trans | -91.3 | 116.7 | 170.7 | 33 | -28.1 | 0 | 0 | 0 | 110.7 | ||||
| 415 | Y | 40.1 | Very low | 52.4 | Low | 304 Ų | 304 | 148.2 Ų | 148.2 | 100% | 1.192 | 80% | 0.798 | S | S | * | * | -177.5 | 0 | 120.3 | -158.3 | -99.6 | 0 | 0 | 0 | 109.7 |
Retrieved 415 of 415 residues in 343 ms
(Link to these results)