| 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 | 41.8 | Very low | 52.7 | Low | 235 Ų | 235 | 131.4 Ų | 131.4 | 100% | 1.158 | 76% | 0.764 | S | S | * | * | 0 | 105 | 0 | -67.3 | -66 | 156.8 | 0 | 0 | 107.5 | |||||
| 2 | P | 46.6 | Very low | 52.5 | Low | 134 Ų | 134 | 130.4 Ų | 130.4 | 87% | 0.87 | 75% | 0.753 | S | S | * | * | trans | -80.5 | 126.8 | -175.8 | 30.8 | -29.4 | 0 | 0 | 0 | 110.7 | ||||
| 3 | A | 50.8 | Low | 52.2 | Low | 109 Ų | 109 | 128.2 Ų | 128.2 | 90% | 0.901 | 75% | 0.75 | S | S | * | * | trans | -79 | 116.6 | 168.4 | 0 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 4 | G | 55.6 | Low | 52 | Low | 72 Ų | 72 | 123.6 Ų | 123.6 | 74% | 0.742 | 74% | 0.743 | S | S | * | * | trans | -173.4 | 16.1 | -179.4 | 0 | 0 | 0 | 0 | 0 | 118 | ||||
| 5 | M | 59.6 | Low | 51.8 | Low | 175 Ų | 175 | 128.7 Ų | 128.7 | 86% | 0.862 | 74% | 0.744 | S | S | * | * | S | Bend | trans | -115.1 | 9.6 | -172.6 | -68.6 | -165.5 | 74.3 | 0 | 0 | 116.2 | ||
| 6 | F | 50.3 | Low | 51.2 | Low | 197 Ų | 197 | 128.1 Ų | 128.1 | 86% | 0.864 | 75% | 0.746 | S | S | * | * | trans | -132 | 46.7 | 177.6 | -62.8 | -73.1 | 0 | 0 | 0 | 113.1 | I8 | F6-I8 PolarHBondContact O-N 3.45Š| ||
| 7 | S | 52.1 | Low | 50.5 | Low | 71 Ų | 71 | 126.2 Ų | 126.2 | 50% | 0.497 | 74% | 0.741 | S | S | . | * | trans | -75.8 | 123.2 | 164.3 | -144.8 | 0 | 0 | 0 | 0 | 109.1 | D9 S10 | S7-D9 PolarHBondContact O-N 3.38Å; S7-D9 PolarHBondContact OG-OD2 3.2Å; S7-D9 VanDerWaalsContact OG-OD2 3.09Å; S7-S10 PolarHBondContact O-N 3.2Å; S7-S10 VanDerWaalsContact O-N 3.08Å | ||
| 8 | I | 57.6 | Low | 50 | Low | 125 Ų | 125 | 126.4 Ų | 126.4 | 64% | 0.641 | 75% | 0.749 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -54.5 | -26.1 | -179.2 | -65 | 166.4 | 0 | 0 | 0 | 111.3 | F6 S10 I11 | F6-I8 PolarHBondContact O-N 3.45Å; I8-S10 VanDerWaalsContact C-N 3.29Å; I8-S10 PolarHBondContact O-N 3.33Å; I8-I11 PolarHBondContact O-N 3.28Å; I8-I11 VanDerWaalsContact O-N 3.1Å |
| 9 | D | 57.8 | Low | 49.6 | Very low | 102 Ų | 102 | 129.7 Ų | 129.7 | 55% | 0.545 | 75% | 0.753 | S | S | . | * | H | α-helix | trans | -64.5 | -26.1 | 179.9 | -50.6 | -59.3 | 0 | 0 | 0 | 113.9 | S7 I11 S13 | S7-D9 PolarHBondContact O-N 3.38Å; S7-D9 PolarHBondContact OG-OD2 3.2Å; S7-D9 VanDerWaalsContact OG-OD2 3.09Å; D9-I11 VanDerWaalsContact C-N 3.33Å; D9-I11 PolarHBondContact O-N 3.16Å; D9-S13 PolarHBondContact O-N 2.94Å; D9-S13 PolarHBondContact O-OG 3.09Å |
| 10 | S | 50.5 | Low | 48.8 | Very low | 94 Ų | 94 | 131.5 Ų | 131.5 | 66% | 0.657 | 75% | 0.754 | S | S | * | * | H | α-helix | trans | -72.5 | -24.3 | 174.1 | -83.2 | 0 | 0 | 0 | 0 | 113.2 | S7 I8 | S7-S10 PolarHBondContact O-N 3.2Å; S7-S10 VanDerWaalsContact O-N 3.08Å; I8-S10 VanDerWaalsContact C-N 3.29Å; I8-S10 PolarHBondContact O-N 3.33Å |
| 11 | I | 56.8 | Low | 48.3 | Very low | 131 Ų | 131 | 131 Ų | 131 | 67% | 0.672 | 76% | 0.755 | S | S | * | * | H | α-helix | trans | -80.5 | -28.2 | -179.8 | -58.4 | 173.1 | 0 | 0 | 0 | 111 | I8 D9 | I8-I11 PolarHBondContact O-N 3.28Å; I8-I11 VanDerWaalsContact O-N 3.1Å; D9-I11 VanDerWaalsContact C-N 3.33Å; D9-I11 PolarHBondContact O-N 3.16Å |
| 12 | L | 50.6 | Low | 48.2 | Very low | 120 Ų | 120 | 127.5 Ų | 127.5 | 63% | 0.628 | 74% | 0.74 | S | S | * | * | H | α-helix | trans | -79.9 | -26.4 | 175.7 | -69.7 | 169.3 | 0 | 0 | 0 | 112.5 | G14 | L12-G14 VanDerWaalsContact C-N 3.35Å |
| 13 | S | 49.3 | Very low | 48.1 | Very low | 102 Ų | 102 | 129.2 Ų | 129.2 | 71% | 0.713 | 74% | 0.741 | S | S | * | * | H | α-helix | trans | -76.5 | -19.1 | 179.6 | -54.8 | 0 | 0 | 0 | 0 | 113.9 | D9 | D9-S13 PolarHBondContact O-N 2.94Å; D9-S13 PolarHBondContact O-OG 3.09Å |
| 14 | G | 49.3 | Very low | 47.5 | Very low | 63 Ų | 63 | 132 Ų | 132 | 65% | 0.649 | 74% | 0.74 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -96.1 | 8.8 | -175 | 0 | 0 | 0 | 0 | 0 | 116.1 | L12 | L12-G14 VanDerWaalsContact C-N 3.35Š|
| 15 | R | 47.8 | Very low | 46.9 | Very low | 201 Ų | 201 | 137 Ų | 137 | 76% | 0.758 | 74% | 0.744 | S | S | * | * | S | Bend | trans | -80.7 | 126.8 | 172.6 | -76.8 | -173.1 | 170.8 | -171.1 | -0.9 | 109.6 | S17 | R15-S17 PolarHBondContact O-N 3.38Š|
| 16 | P | 43.1 | Very low | 45.8 | Very low | 119 Ų | 119 | 140 Ų | 140 | 77% | 0.773 | 75% | 0.745 | S | S | * | * | trans | -61.1 | 112.8 | 168.3 | 25.3 | -30.4 | 0 | 0 | 0 | 108.1 | C18 | P16-C18 PolarHBondContact O-N 3.18Š| ||
| 17 | S | 39.5 | Very low | 45.3 | Very low | 96 Ų | 96 | 135.4 Ų | 135.4 | 67% | 0.671 | 74% | 0.738 | S | S | * | * | trans | -56.9 | 120.8 | 169 | -177.9 | 0 | 0 | 0 | 0 | 107.9 | R15 K19 | R15-S17 PolarHBondContact O-N 3.38Å; S17-K19 PolarHBondContact O-N 3.32Å | ||
| 18 | C | 40.3 | Very low | 45 | Very low | 130 Ų | 130 | 134.9 Ų | 134.9 | 88% | 0.878 | 74% | 0.744 | S | S | * | * | trans | -68.7 | 84.8 | 171.1 | -65.1 | 0 | 0 | 0 | 0 | 107.3 | P16 | P16-C18 PolarHBondContact O-N 3.18Š| ||
| 19 | K | 44 | Very low | 44.3 | Very low | 188 Ų | 188 | 134.8 Ų | 134.8 | 82% | 0.817 | 75% | 0.751 | S | S | * | * | trans | -67.3 | 142.6 | 167.2 | -72 | -173.1 | 175.9 | -175.2 | 0 | 109 | S17 | S17-K19 PolarHBondContact O-N 3.32Š| ||
| 20 | E | 32.9 | Very low | 43.5 | Very low | 166 Ų | 166 | 136.1 Ų | 136.1 | 78% | 0.776 | 76% | 0.763 | S | S | * | * | trans | -45.6 | 156.9 | -174.7 | -84.9 | 159.7 | 105.1 | 0 | 0 | 116.2 | L22 | E20-L22 PolarHBondContact O-N 2.89Š| ||
| 21 | P | 38.4 | Very low | 43.3 | Very low | 120 Ų | 120 | 138 Ų | 138 | 78% | 0.779 | 77% | 0.77 | S | S | * | * | trans | -71.9 | 92.5 | 169.7 | 31.8 | -30.6 | 0 | 0 | 0 | 109 | L23 | P21-L23 PolarHBondContact O-N 3.4Š| ||
| 22 | L | 39.4 | Very low | 42.5 | Very low | 162 Ų | 162 | 138.9 Ų | 138.9 | 85% | 0.848 | 78% | 0.775 | S | S | * | * | trans | -68 | 121.1 | 164.6 | -69.9 | -175.4 | 0 | 0 | 0 | 109.1 | E20 L24 | E20-L22 PolarHBondContact O-N 2.89Å; L22-L24 PolarHBondContact O-N 3.03Å; L22-L24 VanDerWaalsContact O-N 3.1Å | ||
| 23 | L | 44.4 | Very low | 42.1 | Very low | 170 Ų | 170 | 138.8 Ų | 138.8 | 89% | 0.89 | 78% | 0.782 | S | S | * | * | trans | -48.9 | 106.7 | 176.9 | -61.6 | 175.1 | 0 | 0 | 0 | 111 | P21 H25 | P21-L23 PolarHBondContact O-N 3.4Å; L23-H25 PolarHBondContact O-N 3.07Å | ||
| 24 | L | 39 | Very low | 41.5 | Very low | 168 Ų | 168 | 139.2 Ų | 139.2 | 88% | 0.88 | 79% | 0.791 | S | S | * | * | trans | -75.5 | 104.1 | 160.8 | -109.2 | 166.4 | 0 | 0 | 0 | 107.9 | L22 R26 | L22-L24 PolarHBondContact O-N 3.03Å; L22-L24 VanDerWaalsContact O-N 3.1Å; L24-R26 PolarHBondContact O-N 3.41Å | ||
| 25 | H | 42.3 | Very low | 41.2 | Very low | 178 Ų | 178 | 139.3 Ų | 139.3 | 82% | 0.824 | 79% | 0.793 | S | S | * | * | trans | -43.7 | 103.5 | 164.4 | -153 | -100.3 | 0 | 0 | 0 | 109.5 | L23 S27 | L23-H25 PolarHBondContact O-N 3.07Å; H25-S27 PolarHBondContact O-N 3.41Å | ||
| 26 | R | 36.1 | Very low | 41.1 | Very low | 236 Ų | 236 | 137.8 Ų | 137.8 | 89% | 0.891 | 80% | 0.799 | S | S | * | * | trans | -77.6 | 104.4 | 174.6 | -174.6 | 174 | 170.3 | -156.4 | -2.7 | 107.6 | L24 | L24-R26 PolarHBondContact O-N 3.41Š| ||
| 27 | S | 40.9 | Very low | 41 | Very low | 102 Ų | 102 | 138.6 Ų | 138.6 | 71% | 0.713 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -50.9 | 137 | 163.1 | 33.3 | 0 | 0 | 0 | 0 | 110.3 | H25 | H25-S27 PolarHBondContact O-N 3.41Š|
| 28 | G | 45.4 | Very low | 40.6 | Very low | 59 Ų | 59 | 140.8 Ų | 140.8 | 61% | 0.608 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -61.9 | 163.2 | -175.5 | 0 | 0 | 0 | 0 | 0 | 113.9 | V30 | G28-V30 PolarHBondContact O-N 3.01Š|
| 29 | P | 42.7 | Very low | 41 | Very low | 124 Ų | 124 | 140.1 Ų | 140.1 | 81% | 0.805 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -73.1 | 122.1 | 179 | 29.1 | -30.5 | 0 | 0 | 0 | 110.6 | V31 | P29-V31 PolarHBondContact O-N 3.15Š|
| 30 | V | 40.9 | Very low | 40.9 | Very low | 130 Ų | 130 | 138.9 Ų | 138.9 | 79% | 0.788 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -61.3 | 120.8 | 164.2 | 172.8 | 0 | 0 | 0 | 0 | 108.3 | G28 L32 | G28-V30 PolarHBondContact O-N 3.01Å; V30-L32 HydrophobicContact CG1-CD1 4.45Å; V30-L32 HydrophobicContact CG1-CG 4.36Å |
| 31 | V | 45.6 | Very low | 40.9 | Very low | 133 Ų | 133 | 140.7 Ų | 140.7 | 81% | 0.806 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -86.4 | 120.3 | 169.2 | 174.5 | 0 | 0 | 0 | 0 | 107.8 | P29 | P29-V31 PolarHBondContact O-N 3.15Š|
| 32 | L | 40.9 | Very low | 41.3 | Very low | 150 Ų | 150 | 141.7 Ų | 141.7 | 79% | 0.785 | 80% | 0.804 | S | S | * | * | trans | -139.8 | 145.1 | 159.5 | -80.2 | 174 | 0 | 0 | 0 | 109.7 | V30 | V30-L32 HydrophobicContact CG1-CD1 4.45Å; V30-L32 HydrophobicContact CG1-CG 4.36Å | ||
| 33 | P | 41 | Very low | 41.5 | Very low | 117 Ų | 117 | 140.7 Ų | 140.7 | 76% | 0.76 | 80% | 0.799 | S | S | * | * | trans | -87.4 | 154.6 | -153.2 | 35.3 | -35.5 | 0 | 0 | 0 | 113.5 | ||||
| 34 | A | 38.4 | Very low | 41.2 | Very low | 111 Ų | 111 | 142.3 Ų | 142.3 | 92% | 0.917 | 80% | 0.795 | S | S | * | * | trans | -72.2 | 132.8 | 170.4 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 35 | G | 42.5 | Very low | 41.4 | Very low | 66 Ų | 66 | 139.6 Ų | 139.6 | 68% | 0.68 | 79% | 0.79 | S | S | * | * | trans | 175 | 121.2 | 166.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 36 | L | 45 | Very low | 41.6 | Very low | 169 Ų | 169 | 134.6 Ų | 134.6 | 89% | 0.885 | 79% | 0.786 | S | S | * | * | trans | 73.2 | 111.2 | 167.7 | -57.6 | 158.6 | 0 | 0 | 0 | 113.6 | ||||
| 37 | T | 40.8 | Very low | 42.1 | Very low | 136 Ų | 136 | 130.7 Ų | 130.7 | 83% | 0.834 | 78% | 0.782 | S | S | * | * | -167.5 | 138.6 | 65.2 | 35.5 | 0 | 0 | 0 | 0 | 110.5 | |||||
| 38 | D | 32.6 | Very low | 41.8 | Very low | 142 Ų | 142 | 136.9 Ų | 136.9 | 76% | 0.759 | 79% | 0.792 | S | S | * | * | trans | -61 | 157.9 | 169.1 | -87.9 | -71 | 0 | 0 | 0 | 113.5 | ||||
| 39 | T | 48.8 | Very low | 41.6 | Very low | 115 Ų | 115 | 140.1 Ų | 140.1 | 71% | 0.706 | 81% | 0.805 | S | S | * | * | trans | 58.7 | 81.8 | 145.5 | 52.3 | 0 | 0 | 0 | 0 | 118.6 | ||||
| 40 | I | 41.8 | Very low | 41.5 | Very low | 163 Ų | 163 | 138.6 Ų | 138.6 | 84% | 0.836 | 80% | 0.803 | S | S | * | * | S | Bend | trans | -146.7 | 137.8 | 133.5 | -35.8 | -89.5 | 0 | 0 | 0 | 106.4 | ||
| 41 | Y | 32.3 | Very low | 41.4 | Very low | 204 Ų | 204 | 137.2 Ų | 137.2 | 80% | 0.8 | 81% | 0.805 | S | S | * | * | trans | 93.2 | 33.8 | 171.9 | -119.6 | -91.9 | 0 | 0 | 0 | 118.7 | D43 | Y41-D43 PolarHBondContact O-N 3.4Š| ||
| 42 | T | 47.6 | Very low | 41.2 | Very low | 141 Ų | 141 | 142.8 Ų | 142.8 | 87% | 0.865 | 81% | 0.812 | S | S | * | * | trans | -74.3 | 101.7 | 139.3 | 32.3 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 43 | D | 42.8 | Very low | 41.3 | Very low | 141 Ų | 141 | 138.6 Ų | 138.6 | 75% | 0.754 | 81% | 0.805 | S | S | * | * | trans | 161.1 | 80.5 | 136 | -162.9 | -2.2 | 0 | 0 | 0 | 109.3 | Y41 | Y41-D43 PolarHBondContact O-N 3.4Š| ||
| 44 | Y | 38.2 | Very low | 41.6 | Very low | 204 Ų | 204 | 139.6 Ų | 139.6 | 80% | 0.8 | 81% | 0.812 | S | S | * | * | S | Bend | trans | -169.8 | 135 | 146 | -130.8 | -105.5 | 0 | 0 | 0 | 107.8 | ||
| 45 | S | 44.1 | Very low | 41.9 | Very low | 110 Ų | 110 | 139.3 Ų | 139.3 | 77% | 0.769 | 80% | 0.803 | S | S | * | * | trans | 94.9 | 48.5 | 175.3 | -33.2 | 0 | 0 | 0 | 0 | 115.9 | L47 | S45-L47 PolarHBondContact O-N 3.49Š| ||
| 46 | G | 45.2 | Very low | 41.8 | Very low | 73 Ų | 73 | 141.5 Ų | 141.5 | 75% | 0.753 | 81% | 0.805 | S | S | * | * | trans | -59.2 | 121.8 | 130.5 | 0 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 47 | L | 46.1 | Very low | 41.7 | Very low | 154 Ų | 154 | 140 Ų | 140 | 81% | 0.806 | 81% | 0.805 | S | S | * | * | trans | 166.2 | 20.7 | 149 | -88.2 | 172.8 | 0 | 0 | 0 | 115.1 | S45 | S45-L47 PolarHBondContact O-N 3.49Š| ||
| 48 | Y | 36.2 | Very low | 42 | Very low | 233 Ų | 233 | 137 Ų | 137 | 91% | 0.914 | 80% | 0.801 | S | S | * | * | trans | -139.4 | 67.3 | 160.8 | -62.9 | -76.6 | 0 | 0 | 0 | 111.8 | A50 | Y48-A50 PolarHBondContact O-N 3.32Š| ||
| 49 | S | 40.3 | Very low | 42.4 | Very low | 126 Ų | 126 | 136.9 Ų | 136.9 | 88% | 0.881 | 81% | 0.806 | S | S | * | * | trans | -75.4 | 96.4 | 157.8 | -75.6 | 0 | 0 | 0 | 0 | 108 | A51 | S49-A51 PolarHBondContact O-N 3.41Š| ||
| 50 | A | 41.3 | Very low | 42.3 | Very low | 92 Ų | 92 | 140.1 Ų | 140.1 | 76% | 0.76 | 81% | 0.813 | S | S | * | * | trans | -65.7 | 113.4 | 165.8 | 0 | 0 | 0 | 0 | 0 | 108.3 | Y48 R52 | Y48-A50 PolarHBondContact O-N 3.32Å; A50-R52 PolarHBondContact O-N 2.99Å; A50-R52 VanDerWaalsContact O-N 3.09Å | ||
| 51 | A | 37.2 | Very low | 42 | Very low | 102 Ų | 102 | 137.3 Ų | 137.3 | 84% | 0.843 | 81% | 0.814 | S | S | * | * | trans | -53 | 113.8 | 173.7 | 0 | 0 | 0 | 0 | 0 | 110.2 | S49 G53 | S49-A51 PolarHBondContact O-N 3.41Å; A51-G53 PolarHBondContact O-N 2.69Å | ||
| 52 | R | 42.7 | Very low | 42.6 | Very low | 249 Ų | 249 | 135.4 Ų | 135.4 | 94% | 0.94 | 82% | 0.816 | S | S | * | * | trans | -75.5 | 105.6 | 163.7 | -82.3 | -179.9 | 163.9 | 153.7 | -3.7 | 107.6 | A50 | A50-R52 PolarHBondContact O-N 2.99Å; A50-R52 VanDerWaalsContact O-N 3.09Å | ||
| 53 | G | 43.4 | Very low | 42.9 | Very low | 63 Ų | 63 | 135.1 Ų | 135.1 | 65% | 0.649 | 82% | 0.82 | S | S | * | * | P | Polyproline II helix | trans | -66.6 | 152.6 | 164.3 | 0 | 0 | 0 | 0 | 0 | 110.9 | A51 S55 | A51-G53 PolarHBondContact O-N 2.69Å; G53-S55 PolarHBondContact O-N 3.47Å |
| 54 | P | 46.3 | Very low | 43 | Very low | 137 Ų | 137 | 131.6 Ų | 131.6 | 89% | 0.89 | 82% | 0.817 | S | S | * | * | P | Polyproline II helix | trans | -71 | 128.5 | 177.6 | 28.5 | -32.1 | 0 | 0 | 0 | 110.8 | ||
| 55 | S | 45.9 | Very low | 43.5 | Very low | 105 Ų | 105 | 126.8 Ų | 126.8 | 73% | 0.734 | 82% | 0.819 | S | S | * | * | P | Polyproline II helix | trans | -76.3 | 148.2 | 171.2 | 50 | 0 | 0 | 0 | 0 | 111.6 | G53 | G53-S55 PolarHBondContact O-N 3.47Š|
| 56 | P | 40.1 | Very low | 43.8 | Very low | 112 Ų | 112 | 130.8 Ų | 130.8 | 73% | 0.727 | 82% | 0.818 | S | S | * | * | P | Polyproline II helix | trans | -70.3 | 151.9 | 174.1 | 30 | -33.6 | 0 | 0 | 0 | 111.7 | ||
| 57 | P | 41.8 | Very low | 43.8 | Very low | 137 Ų | 137 | 135.7 Ų | 135.7 | 89% | 0.89 | 83% | 0.825 | S | S | * | * | S | Bend | trans | -79.2 | 132 | 179.3 | 31.3 | -30.9 | 0 | 0 | 0 | 110.6 | ||
| 58 | G | 48.4 | Very low | 43.5 | Very low | 73 Ų | 73 | 131.6 Ų | 131.6 | 75% | 0.753 | 82% | 0.82 | S | S | * | * | trans | 150 | 2.8 | 167.9 | 0 | 0 | 0 | 0 | 0 | 118.9 | ||||
| 59 | V | 40.7 | Very low | 44.1 | Very low | 140 Ų | 140 | 131.8 Ų | 131.8 | 85% | 0.848 | 82% | 0.82 | S | S | * | * | trans | -120 | 107.9 | 177.4 | -65.8 | 0 | 0 | 0 | 0 | 111.3 | A61 | V59-A61 PolarHBondContact O-N 2.85Š| ||
| 60 | H | 45.1 | Very low | 44.3 | Very low | 184 Ų | 184 | 132.3 Ų | 132.3 | 85% | 0.852 | 81% | 0.813 | S | S | * | * | trans | -64.4 | 124.8 | 167.3 | -76.7 | -91 | 0 | 0 | 0 | 109 | L62 | H60-L62 PolarHBondContact O-N 2.91Å; H60-L62 VanDerWaalsContact O-N 3.12Å | ||
| 61 | A | 36.8 | Very low | 44.8 | Very low | 104 Ų | 104 | 131.3 Ų | 131.3 | 86% | 0.86 | 81% | 0.812 | S | S | * | * | trans | -72.6 | 101.1 | 173.8 | 0 | 0 | 0 | 0 | 0 | 109.4 | V59 | V59-A61 PolarHBondContact O-N 2.85Š| ||
| 62 | L | 45.1 | Very low | 45.4 | Very low | 164 Ų | 164 | 136.2 Ų | 136.2 | 86% | 0.859 | 81% | 0.81 | S | S | * | * | trans | -83.1 | 130.2 | 164.4 | -67.4 | 175.3 | 0 | 0 | 0 | 109 | H60 G64 | H60-L62 PolarHBondContact O-N 2.91Å; H60-L62 VanDerWaalsContact O-N 3.12Å; L62-G64 PolarHBondContact O-N 2.67Å | ||
| 63 | S | 53.2 | Low | 45.5 | Very low | 135 Ų | 135 | 133.1 Ų | 133.1 | 94% | 0.944 | 80% | 0.8 | S | S | * | * | trans | -51.2 | 117.8 | -172.9 | -164.7 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 64 | G | 44.3 | Very low | 45.9 | Very low | 66 Ų | 66 | 141.1 Ų | 141.1 | 68% | 0.68 | 81% | 0.812 | S | S | * | * | trans | -125.6 | 114.8 | 174.6 | 0 | 0 | 0 | 0 | 0 | 110.6 | L62 | L62-G64 PolarHBondContact O-N 2.67Š| ||
| 65 | A | 50.4 | Low | 45.8 | Very low | 103 Ų | 103 | 137.4 Ų | 137.4 | 85% | 0.851 | 80% | 0.799 | S | S | * | * | trans | -62.1 | 134.6 | -179 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 66 | R | 48.5 | Very low | 45.9 | Very low | 195 Ų | 195 | 140.4 Ų | 140.4 | 74% | 0.736 | 80% | 0.801 | S | S | * | * | trans | -91.9 | 109.6 | 176.9 | -63.9 | -83.3 | -156.2 | -157.9 | 0.8 | 109.7 | Y73 | R66-Y73 PolarHBondContact NH1-OH 3.29Å; R66-Y73 PolarHBondContact NH2-OH 3.36Å | ||
| 67 | I | 46.7 | Very low | 46.1 | Very low | 176 Ų | 176 | 142.2 Ų | 142.2 | 90% | 0.903 | 80% | 0.804 | S | S | * | * | trans | -141 | 109.2 | 160.7 | -56.4 | 179.6 | 0 | 0 | 0 | 109.2 | ||||
| 68 | G | 39.7 | Very low | 46.3 | Very low | 68 Ų | 68 | 143.7 Ų | 143.7 | 70% | 0.701 | 80% | 0.799 | S | S | * | * | trans | 175.3 | 120.4 | 170.1 | 0 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 69 | Y | 48.7 | Very low | 45.9 | Very low | 237 Ų | 237 | 145.5 Ų | 145.5 | 93% | 0.929 | 80% | 0.795 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71.7 | 144.6 | 169 | -104.5 | -100.3 | 0 | 0 | 0 | 110.3 | ||
| 70 | N | 43.3 | Very low | 45.9 | Very low | 136 Ų | 136 | 148.5 Ų | 148.5 | 73% | 0.727 | 80% | 0.8 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 78.3 | 23.3 | -177.6 | -66.7 | -38.2 | 0 | 0 | 0 | 118.5 | Y72 | N70-Y72 HydrophobicContact CB-CD2 4.17Å; N70-Y72 HydrophobicContact CB-CE2 4.16Å; N70-Y72 WeakPolarHBondContact O-CD2 3.38Å; N70-Y72 WeakPolarHBondContact O-CE2 3.38Å; N70-Y72 PolarHBondContact O-N 2.95Å |
| 71 | G | 52.5 | Low | 45.7 | Very low | 71 Ų | 71 | 141.8 Ų | 141.8 | 73% | 0.732 | 78% | 0.781 | S | S | * | * | trans | 61 | 10.5 | 154.3 | 0 | 0 | 0 | 0 | 0 | 118.1 | ||||
| 72 | Y | 49.6 | Very low | 46.2 | Very low | 206 Ų | 206 | 143 Ų | 143 | 81% | 0.808 | 78% | 0.78 | S | S | * | * | trans | -83.5 | 119.9 | 173.9 | -66 | -76.5 | 0 | 0 | 0 | 109.6 | N70 Y74 | N70-Y72 HydrophobicContact CB-CD2 4.17Å; N70-Y72 HydrophobicContact CB-CE2 4.16Å; N70-Y72 WeakPolarHBondContact O-CD2 3.38Å; N70-Y72 WeakPolarHBondContact O-CE2 3.38Å; N70-Y72 PolarHBondContact O-N 2.95Å; Y72-Y74 PolarHBondContact O-N 3.04Å | ||
| 73 | Y | 45.8 | Very low | 46.5 | Very low | 184 Ų | 184 | 139.5 Ų | 139.5 | 72% | 0.722 | 78% | 0.783 | S | S | * | * | trans | -70.4 | 107.4 | 171.4 | -87.1 | -97.8 | 0 | 0 | 0 | 109.6 | R66 | R66-Y73 PolarHBondContact NH1-OH 3.29Å; R66-Y73 PolarHBondContact NH2-OH 3.36Å | ||
| 74 | Y | 50.5 | Low | 45.9 | Very low | 230 Ų | 230 | 136.8 Ų | 136.8 | 90% | 0.902 | 78% | 0.776 | S | S | * | * | trans | -108.6 | 90.6 | 152.3 | -90.6 | -86.7 | 0 | 0 | 0 | 107.5 | Y72 | Y72-Y74 PolarHBondContact O-N 3.04Š| ||
| 75 | G | 44.8 | Very low | 46.2 | Very low | 60 Ų | 60 | 136.7 Ų | 136.7 | 62% | 0.619 | 78% | 0.775 | S | S | * | * | trans | -84.5 | 122.1 | 164.9 | 0 | 0 | 0 | 0 | 0 | 108.5 | L77 | G75-L77 PolarHBondContact O-N 3.08Š| ||
| 76 | Q | 48.2 | Very low | 46.1 | Very low | 167 Ų | 167 | 137.2 Ų | 137.2 | 78% | 0.78 | 77% | 0.77 | S | S | * | * | trans | -69.7 | 98.9 | 166.3 | -175.5 | 167.2 | -18.3 | 0 | 0 | 107.7 | Q78 | Q76-Q78 HydrophobicContact CG-CG 4.36Å; Q76-Q78 PolarHBondContact O-N 3.37Å | ||
| 77 | L | 44 | Very low | 46.1 | Very low | 150 Ų | 150 | 133.7 Ų | 133.7 | 79% | 0.785 | 77% | 0.773 | S | S | * | * | trans | -68.8 | 100.5 | 169.5 | -121.3 | 84.1 | 0 | 0 | 0 | 107.4 | G75 V79 | G75-L77 PolarHBondContact O-N 3.08Å; L77-V79 VanDerWaalsContact C-N 3.28Å; L77-V79 HydrophobicContact CB-CG2 4.39Å; L77-V79 HydrophobicContact CD2-CG2 3.79Å; L77-V79 HydrophobicContact CG-CG2 4.41Å; L77-V79 PolarHBondContact O-N 2.85Å; L77-V79 VanDerWaalsContact O-N 3.12Å | ||
| 78 | Q | 45.7 | Very low | 46.3 | Very low | 168 Ų | 168 | 130.6 Ų | 130.6 | 79% | 0.785 | 77% | 0.765 | S | S | * | * | trans | -78.3 | 88.2 | 161.5 | -63.5 | -157.5 | -12.7 | 0 | 0 | 107.6 | Q76 Q80 | Q76-Q78 HydrophobicContact CG-CG 4.36Å; Q76-Q78 PolarHBondContact O-N 3.37Å; Q78-Q80 PolarHBondContact O-N 3.35Å | ||
| 79 | V | 40.3 | Very low | 46.9 | Very low | 111 Ų | 111 | 133.7 Ų | 133.7 | 67% | 0.673 | 77% | 0.774 | S | S | * | * | trans | -75.9 | 107.6 | 165.3 | 175.9 | 0 | 0 | 0 | 0 | 106.6 | L77 G81 | L77-V79 VanDerWaalsContact C-N 3.28Å; L77-V79 HydrophobicContact CB-CG2 4.39Å; L77-V79 HydrophobicContact CD2-CG2 3.79Å; L77-V79 HydrophobicContact CG-CG2 4.41Å; L77-V79 PolarHBondContact O-N 2.85Å; L77-V79 VanDerWaalsContact O-N 3.12Å; V79-G81 PolarHBondContact O-N 3.11Å | ||
| 80 | Q | 41.7 | Very low | 46.4 | Very low | 203 Ų | 203 | 125.5 Ų | 125.5 | 95% | 0.949 | 76% | 0.762 | S | S | * | * | trans | -73.7 | 80.9 | 163.3 | -166.7 | 155.7 | 68.2 | 0 | 0 | 107.5 | Q78 | Q78-Q80 PolarHBondContact O-N 3.35Š| ||
| 81 | G | 40.3 | Very low | 46.5 | Very low | 44 Ų | 44 | 123.8 Ų | 123.8 | 45% | 0.454 | 77% | 0.767 | S | S | . | * | P | Polyproline II helix | trans | -93.4 | 141.8 | 166.3 | 0 | 0 | 0 | 0 | 0 | 109.1 | V79 G83 | V79-G81 PolarHBondContact O-N 3.11Å; G81-G83 PolarHBondContact O-N 3.01Å |
| 82 | P | 47.4 | Very low | 46.1 | Very low | 130 Ų | 130 | 126.5 Ų | 126.5 | 84% | 0.844 | 77% | 0.769 | S | S | * | * | P | Polyproline II helix | trans | -61.9 | 138.5 | 171.3 | 28.4 | -31 | 0 | 0 | 0 | 108.5 | ||
| 83 | G | 50.3 | Low | 46.1 | Very low | 89 Ų | 89 | 123.1 Ų | 123.1 | 92% | 0.918 | 77% | 0.773 | S | S | * | * | P | Polyproline II helix | trans | -50.2 | 136 | -169.8 | 0 | 0 | 0 | 0 | 0 | 114.4 | G81 | G81-G83 PolarHBondContact O-N 3.01Š|
| 84 | G | 42.3 | Very low | 46.4 | Very low | 78 Ų | 78 | 117.6 Ų | 117.6 | 80% | 0.804 | 77% | 0.772 | S | S | * | * | trans | -163.6 | 76.1 | 175.2 | 0 | 0 | 0 | 0 | 0 | 110 | ||||
| 85 | G | 49 | Very low | 45.9 | Very low | 64 Ų | 64 | 114.7 Ų | 114.7 | 66% | 0.66 | 77% | 0.771 | S | S | * | * | trans | -69.7 | 168.8 | 163.4 | 0 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 86 | P | 48.7 | Very low | 46 | Very low | 114 Ų | 114 | 116.4 Ų | 116.4 | 74% | 0.74 | 77% | 0.773 | S | S | * | * | trans | -59.3 | 139.2 | 178.5 | 25.5 | -32.8 | 0 | 0 | 0 | 110.5 | C88 | P86-C88 VanDerWaalsContact C-N 3.27Å; P86-C88 PolarHBondContact O-N 3.19Å | ||
| 87 | P | 48.5 | Very low | 46.1 | Very low | 122 Ų | 122 | 114.4 Ų | 114.4 | 79% | 0.792 | 78% | 0.775 | S | S | * | * | trans | -79.7 | 77.7 | -176.3 | 33.8 | -34 | 0 | 0 | 0 | 109.6 | C89 | P87-C89 PolarHBondContact O-N 2.83Š| ||
| 88 | C | 50.7 | Low | 46.3 | Very low | 111 Ų | 111 | 114.8 Ų | 114.8 | 75% | 0.75 | 77% | 0.773 | S | S | * | * | S | Bend | trans | -83.1 | 102.4 | 153.8 | 55.3 | 0 | 0 | 0 | 0 | 106.9 | P86 | P86-C88 VanDerWaalsContact C-N 3.27Å; P86-C88 PolarHBondContact O-N 3.19Å |
| 89 | C | 52.8 | Low | 46.3 | Very low | 132 Ų | 132 | 115.1 Ų | 115.1 | 89% | 0.892 | 77% | 0.774 | S | S | * | * | trans | 82.1 | 71.2 | 179.3 | -46.9 | 0 | 0 | 0 | 0 | 115.2 | P87 | P87-C89 PolarHBondContact O-N 2.83Š| ||
| 90 | G | 37.8 | Very low | 46 | Very low | 65 Ų | 65 | 115.9 Ų | 115.9 | 67% | 0.67 | 78% | 0.783 | S | S | * | * | trans | -80.2 | 133.9 | 155.8 | 0 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 91 | A | 46.3 | Very low | 46.4 | Very low | 101 Ų | 101 | 112.3 Ų | 112.3 | 84% | 0.835 | 78% | 0.777 | S | S | * | * | trans | -58 | 131.3 | -169.8 | 0 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 92 | V | 44.1 | Very low | 46 | Very low | 128 Ų | 128 | 116 Ų | 116 | 78% | 0.776 | 80% | 0.795 | S | S | * | * | trans | -113.2 | 118.2 | 151.8 | -86.6 | 0 | 0 | 0 | 0 | 107.8 | G94 | V92-G94 PolarHBondContact O-N 3.37Š| ||
| 93 | P | 48.4 | Very low | 45.5 | Very low | 135 Ų | 135 | 118.9 Ų | 118.9 | 88% | 0.877 | 80% | 0.795 | S | S | * | * | S | Bend | trans | -74.8 | 120.9 | 170.2 | -4.8 | 21.2 | 0 | 0 | 0 | 108.8 | ||
| 94 | G | 53.2 | Low | 45.5 | Very low | 68 Ų | 68 | 121 Ų | 121 | 70% | 0.701 | 79% | 0.792 | S | S | * | * | trans | 103.9 | 57.5 | 160.8 | 0 | 0 | 0 | 0 | 0 | 116.6 | V92 | V92-G94 PolarHBondContact O-N 3.37Š| ||
| 95 | L | 40.3 | Very low | 45.7 | Very low | 169 Ų | 169 | 121 Ų | 121 | 89% | 0.885 | 79% | 0.785 | S | S | * | * | trans | -143.3 | 137.8 | 153.5 | -73.8 | 177 | 0 | 0 | 0 | 110.7 | ||||
| 96 | S | 46.4 | Very low | 45.4 | Very low | 95 Ų | 95 | 121.7 Ų | 121.7 | 66% | 0.664 | 79% | 0.792 | S | S | * | * | trans | -60 | 150 | -175.2 | 55.9 | 0 | 0 | 0 | 0 | 114 | Q98 | S96-Q98 VanDerWaalsContact C-N 3.32Å; S96-Q98 PolarHBondContact O-N 2.96Å | ||
| 97 | P | 50.3 | Low | 44.9 | Very low | 126 Ų | 126 | 125.6 Ų | 125.6 | 82% | 0.818 | 79% | 0.793 | S | S | * | * | S | Bend | trans | -81.6 | 70.4 | -178 | 34.6 | -34.1 | 0 | 0 | 0 | 111.1 | ||
| 98 | Q | 48.9 | Very low | 44.9 | Very low | 158 Ų | 158 | 127.9 Ų | 127.9 | 74% | 0.738 | 80% | 0.799 | S | S | * | * | trans | -147.3 | 24.6 | 174.7 | -80.7 | -58.5 | 32.7 | 0 | 0 | 117.2 | S96 | S96-Q98 VanDerWaalsContact C-N 3.32Å; S96-Q98 PolarHBondContact O-N 2.96Å | ||
| 99 | Q | 44.5 | Very low | 44.2 | Very low | 174 Ų | 174 | 126.5 Ų | 126.5 | 81% | 0.813 | 79% | 0.79 | S | S | * | * | trans | -154.1 | 96.7 | 166.3 | -92.3 | 123.7 | 81.7 | 0 | 0 | 111.7 | ||||
| 100 | C | 34.1 | Very low | 44.4 | Very low | 128 Ų | 128 | 126.6 Ų | 126.6 | 87% | 0.865 | 79% | 0.789 | S | S | * | * | trans | -138.9 | 108.5 | 149.7 | -85.8 | 0 | 0 | 0 | 0 | 107 | ||||
| 101 | P | 49.5 | Very low | 44.6 | Very low | 127 Ų | 127 | 127.3 Ų | 127.3 | 83% | 0.825 | 79% | 0.788 | S | S | * | * | trans | -92.1 | 102.4 | 178.7 | 32.9 | -25.7 | 0 | 0 | 0 | 109.3 | ||||
| 102 | C | 32 | Very low | 44.5 | Very low | 123 Ų | 123 | 127.5 Ų | 127.5 | 83% | 0.831 | 78% | 0.784 | S | S | * | * | trans | -173.6 | 78.9 | 146.4 | 40.8 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 103 | F | 37.2 | Very low | 44.6 | Very low | 190 Ų | 190 | 127.3 Ų | 127.3 | 83% | 0.833 | 78% | 0.783 | S | S | * | * | trans | -97.5 | 154.1 | 144.3 | -90.1 | -61.9 | 0 | 0 | 0 | 106.6 | A105 | F103-A105 HydrophobicContact CD1-CB 3.91Å; F103-A105 VanDerWaalsContact CD1-N 3.33Å; F103-A105 HydrophobicContact CE1-CB 4.01Å | ||
| 104 | P | 49.9 | Very low | 44.6 | Very low | 132 Ų | 132 | 128.6 Ų | 128.6 | 86% | 0.857 | 78% | 0.781 | S | S | * | * | -120.1 | 133.7 | 59.3 | 14.2 | 7.3 | 0 | 0 | 0 | 114.8 | |||||
| 105 | A | 47.6 | Very low | 44.7 | Very low | 80 Ų | 80 | 131.8 Ų | 131.8 | 66% | 0.661 | 78% | 0.782 | S | S | * | * | trans | -62.5 | 146.4 | 144.4 | 0 | 0 | 0 | 0 | 0 | 108.6 | F103 | F103-A105 HydrophobicContact CD1-CB 3.91Å; F103-A105 VanDerWaalsContact CD1-N 3.33Å; F103-A105 HydrophobicContact CE1-CB 4.01Å | ||
| 106 | G | 41.3 | Very low | 44.9 | Very low | 78 Ų | 78 | 128.1 Ų | 128.1 | 80% | 0.804 | 77% | 0.77 | S | S | * | * | trans | 131.3 | 78 | 164.7 | 0 | 0 | 0 | 0 | 0 | 114 | ||||
| 107 | Y | 38.9 | Very low | 45.6 | Very low | 196 Ų | 196 | 128.4 Ų | 128.4 | 77% | 0.769 | 77% | 0.77 | S | S | * | * | trans | -148.5 | 111.2 | 133 | 81.6 | -87.3 | 0 | 0 | 0 | 109.2 | ||||
| 108 | D | 47.8 | Very low | 45.9 | Very low | 170 Ų | 170 | 125.5 Ų | 125.5 | 91% | 0.909 | 75% | 0.749 | S | S | * | * | trans | -83.5 | 104.1 | 155.3 | -128.1 | -63.9 | 0 | 0 | 0 | 105.4 | ||||
| 109 | S | 36.8 | Very low | 46.3 | Very low | 82 Ų | 82 | 122.1 Ų | 122.1 | 57% | 0.573 | 74% | 0.741 | S | S | * | * | trans | -165.2 | 123.2 | 164.9 | -111.1 | 0 | 0 | 0 | 0 | 112.1 | A111 | S109-A111 PolarHBondContact O-N 2.95Š| ||
| 110 | P | 57.1 | Low | 46.9 | Very low | 134 Ų | 134 | 122.4 Ų | 122.4 | 87% | 0.87 | 74% | 0.742 | S | S | * | * | trans | -87.3 | 81.9 | 174.3 | 35.2 | -29.3 | 0 | 0 | 0 | 108.7 | ||||
| 111 | A | 41.3 | Very low | 48.1 | Very low | 79 Ų | 79 | 123.7 Ų | 123.7 | 65% | 0.653 | 74% | 0.735 | S | S | * | * | trans | -152.8 | 108.8 | 169.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | S109 | S109-A111 PolarHBondContact O-N 2.95Š| ||
| 112 | S | 45.8 | Very low | 48.4 | Very low | 106 Ų | 106 | 121.1 Ų | 121.1 | 74% | 0.741 | 71% | 0.713 | S | S | * | * | trans | 61.2 | 84.9 | 146 | -53.5 | 0 | 0 | 0 | 0 | 117.1 | L114 | S112-L114 PolarHBondContact O-N 3.46Š| ||
| 113 | V | 44.3 | Very low | 49.8 | Very low | 124 Ų | 124 | 118.3 Ų | 118.3 | 75% | 0.752 | 69% | 0.689 | S | S | * | * | trans | -63.6 | 101.3 | 156.8 | -171.9 | 0 | 0 | 0 | 0 | 107.7 | L115 | V113-L115 PolarHBondContact O-N 3.23Š| ||
| 114 | L | 50.3 | Low | 50.8 | Low | 161 Ų | 161 | 114.2 Ų | 114.2 | 84% | 0.843 | 68% | 0.684 | S | S | * | * | trans | -66.8 | 89.7 | 165.6 | -66.8 | -174.9 | 0 | 0 | 0 | 107.9 | S112 S116 | S112-L114 PolarHBondContact O-N 3.46Å; L114-S116 VanDerWaalsContact C-N 3.29Å; L114-S116 PolarHBondContact O-N 3.06Å | ||
| 115 | L | 55.1 | Low | 51.1 | Low | 135 Ų | 135 | 113.2 Ų | 113.2 | 71% | 0.707 | 66% | 0.664 | S | S | * | * | trans | -69.8 | 87.7 | 177.5 | -160.1 | 75.5 | 0 | 0 | 0 | 109.2 | V113 | V113-L115 PolarHBondContact O-N 3.23Š| ||
| 116 | S | 43.5 | Very low | 51.6 | Low | 93 Ų | 93 | 113.5 Ų | 113.5 | 65% | 0.65 | 65% | 0.652 | S | S | * | * | trans | -59.9 | 141.8 | 170.8 | -171.2 | 0 | 0 | 0 | 0 | 110 | L114 V118 | L114-S116 VanDerWaalsContact C-N 3.29Å; L114-S116 PolarHBondContact O-N 3.06Å; S116-V118 PolarHBondContact O-N 2.9Å | ||
| 117 | P | 60.4 | Low | 52.7 | Low | 101 Ų | 101 | 115.1 Ų | 115.1 | 66% | 0.656 | 64% | 0.642 | S | S | * | * | trans | -63.9 | 112.5 | -179.3 | -15.5 | 28.8 | 0 | 0 | 0 | 110.6 | ||||
| 118 | V | 56.9 | Low | 53.8 | Low | 64 Ų | 64 | 109.8 Ų | 109.8 | 39% | 0.388 | 63% | 0.625 | S | S | . | * | trans | -64.6 | 127 | 175.7 | 174.1 | 0 | 0 | 0 | 0 | 109.3 | S116 M122 M123 | S116-V118 PolarHBondContact O-N 2.9Å; V118-M122 HydrophobicContact CG1-CB 3.28Å; V118-M122 HydrophobicContact CG1-CG 4.38Å; V118-M123 HydrophobicContact CB-CE 3.97Å; V118-M123 HydrophobicContact CG1-CE 3.75Å | ||
| 119 | P | 58.8 | Low | 54.7 | Low | 87 Ų | 87 | 105 Ų | 105 | 57% | 0.565 | 62% | 0.616 | S | S | * | * | trans | -63.6 | 148.2 | -174.3 | 20.7 | -30.5 | 0 | 0 | 0 | 112.7 | H121 M122 | P119-H121 PolarHBondContact O-N 2.98Å; P119-H121 VanDerWaalsContact O-N 3.11Å; P119-M122 HydrophobicContact CG-CG 4.28Å; P119-M122 WeakPolarHBondContact O-CA 3.36Å; P119-M122 WeakPolarHBondContact O-CB 3.42Å; P119-M122 PolarHBondContact O-N 3.37Å | ||
| 120 | H | 56.2 | Low | 56.3 | Low | 180 Ų | 180 | 105.4 Ų | 105.4 | 83% | 0.833 | 62% | 0.619 | S | S | * | * | G | 310 helix | trans | -53.3 | -34.9 | -168 | -93 | -87.6 | 0 | 0 | 0 | 117.5 | M122 M123 | H120-M122 PolarHBondContact O-N 2.86Å; H120-M122 VanDerWaalsContact O-N 3.17Å; H120-M123 PolarHBondContact O-N 3.43Å |
| 121 | H | 58.4 | Low | 57 | Low | 155 Ų | 155 | 100.7 Ų | 100.7 | 72% | 0.718 | 59% | 0.587 | S | S | * | * | G | 310 helix | trans | -55.2 | -32.1 | 172.3 | 166.5 | -99.8 | 0 | 0 | 0 | 111.9 | P119 M123 S124 | P119-H121 PolarHBondContact O-N 2.98Å; P119-H121 VanDerWaalsContact O-N 3.11Å; H121-M123 VanDerWaalsContact C-N 3.29Å; H121-M123 PolarHBondContact O-N 3.22Å; H121-S124 PolarHBondContact O-OG 2.94Å |
| 122 | M | 57.6 | Low | 58.8 | Low | 74 Ų | 74 | 99.7 Ų | 99.7 | 37% | 0.365 | 58% | 0.575 | S | S | . | * | G | 310 helix | trans | -36.3 | -38.8 | 166 | -40.3 | -154.3 | 108.8 | 0 | 0 | 121.1 | V118 P119 H120 Y125 | V118-M122 HydrophobicContact CG1-CB 3.28Å; V118-M122 HydrophobicContact CG1-CG 4.38Å; P119-M122 HydrophobicContact CG-CG 4.28Å; P119-M122 WeakPolarHBondContact O-CA 3.36Å; P119-M122 WeakPolarHBondContact O-CB 3.42Å; P119-M122 PolarHBondContact O-N 3.37Å; H120-M122 PolarHBondContact O-N 2.86Å; H120-M122 VanDerWaalsContact O-N 3.17Å; M122-Y125 HydrophobicContact CB-CD1 4.23Å; M122-Y125 HydrophobicContact CB-CE1 3.11Å; M122-Y125 WeakPolarHBondContact CB-OH 3.43Å; M122-Y125 HydrophobicContact CE-CD1 4.23Å; M122-Y125 HydrophobicContact CE-CE1 3.17Å; M122-Y125 WeakPolarHBondContact CE-OH 3.4Å; M122-Y125 HydrophobicContact CG-CD1 4.39Å; M122-Y125 HydrophobicContact CG-CE1 3.24Å; M122-Y125 WeakPolarHBondContact CG-OH 3.19Å; M122-Y125 WeakPolarHBondContact O-CD1 2.92Å; M122-Y125 WeakPolarHBondContact O-CE1 3.33Å; M122-Y125 VanDerWaalsContact O-CE2 3.22Å; M122-Y125 WeakPolarHBondContact O-CE2 3.46Å; M122-Y125 HydrophobicContact SD-CE1 3.67Å; M122-Y125 PolarHBondContact SD-OH 2.97Å |
| 123 | M | 59.9 | Low | 60.2 | Low | 64 Ų | 64 | 105.3 Ų | 105.3 | 32% | 0.315 | 58% | 0.58 | S | S | . | * | G | 310 helix | trans | -92.5 | -10.5 | -160.5 | -65.1 | -76 | 98.2 | 0 | 0 | 112.5 | V118 H120 H121 M126 | V118-M123 HydrophobicContact CB-CE 3.97Å; V118-M123 HydrophobicContact CG1-CE 3.75Å; H120-M123 PolarHBondContact O-N 3.43Å; H121-M123 VanDerWaalsContact C-N 3.29Å; H121-M123 PolarHBondContact O-N 3.22Å; M123-M126 HydrophobicContact CE-CG 4.28Å |
| 124 | S | 58 | Low | 61.9 | Low | 104 Ų | 104 | 104.3 Ų | 104.3 | 73% | 0.727 | 57% | 0.574 | S | S | * | * | S | Bend | trans | -79 | -23.8 | 179 | 59 | 0 | 0 | 0 | 0 | 113.2 | H121 | H121-S124 PolarHBondContact O-OG 2.94Š|
| 125 | Y | 56 | Low | 63.2 | Low | 111 Ų | 111 | 101.5 Ų | 101.5 | 44% | 0.435 | 56% | 0.557 | S | S | . | * | S | Bend | trans | -96.9 | -7.5 | 178.4 | 63.8 | -109.6 | 0 | 0 | 0 | 113.7 | M122 N127 | M122-Y125 HydrophobicContact CB-CD1 4.23Å; M122-Y125 HydrophobicContact CB-CE1 3.11Å; M122-Y125 WeakPolarHBondContact CB-OH 3.43Å; M122-Y125 HydrophobicContact CE-CD1 4.23Å; M122-Y125 HydrophobicContact CE-CE1 3.17Å; M122-Y125 WeakPolarHBondContact CE-OH 3.4Å; M122-Y125 HydrophobicContact CG-CD1 4.39Å; M122-Y125 HydrophobicContact CG-CE1 3.24Å; M122-Y125 WeakPolarHBondContact CG-OH 3.19Å; M122-Y125 WeakPolarHBondContact O-CD1 2.92Å; M122-Y125 WeakPolarHBondContact O-CE1 3.33Å; M122-Y125 VanDerWaalsContact O-CE2 3.22Å; M122-Y125 WeakPolarHBondContact O-CE2 3.46Å; M122-Y125 HydrophobicContact SD-CE1 3.67Å; M122-Y125 PolarHBondContact SD-OH 2.97Å; Y125-N127 PolarHBondContact O-N 3.38Å |
| 126 | M | 59.2 | Low | 64.3 | Low | 85 Ų | 85 | 99 Ų | 99 | 42% | 0.419 | 54% | 0.543 | S | S | . | . | S | Bend | trans | -75.9 | 105.7 | 171 | -72.1 | -79.3 | -176.3 | 0 | 0 | 107.2 | M123 M128 | M123-M126 HydrophobicContact CE-CG 4.28Å; M126-M128 VanDerWaalsContact C-N 3.33Å; M126-M128 PolarHBondContact O-N 3.41Å |
| 127 | N | 64.3 | Low | 65.9 | Low | 112 Ų | 112 | 100.2 Ų | 100.2 | 60% | 0.599 | 54% | 0.539 | S | S | * | . | trans | -64.9 | 90.5 | 176.9 | -175.1 | 13 | 0 | 0 | 0 | 109.9 | Y125 G129 S130 | Y125-N127 PolarHBondContact O-N 3.38Å; N127-G129 PolarHBondContact O-N 3.02Å; N127-G129 PolarHBondContact OD1-N 3.4Å; N127-S130 PolarHBondContact O-N 3.49Å; N127-S130 PolarHBondContact O-OG 3.41Å | ||
| 128 | M | 62.4 | Low | 66.9 | Low | 84 Ų | 84 | 100 Ų | 100 | 41% | 0.414 | 53% | 0.531 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -57.6 | -14 | 179.4 | -61.8 | -70.5 | 178.4 | 0 | 0 | 113.1 | M126 L131 L139 | M126-M128 VanDerWaalsContact C-N 3.33Å; M126-M128 PolarHBondContact O-N 3.41Å; M128-L131 HydrophobicContact SD-CD1 3.7Å; M128-L139 HydrophobicContact SD-CD1 4.27Å |
| 129 | G | 65.8 | Low | 67.8 | Low | 70 Ų | 70 | 99.3 Ų | 99.3 | 72% | 0.722 | 53% | 0.526 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -82.9 | -13 | 175.6 | 0 | 0 | 0 | 0 | 0 | 115.5 | N127 | N127-G129 PolarHBondContact O-N 3.02Å; N127-G129 PolarHBondContact OD1-N 3.4Å |
| 130 | S | 69.9 | Low | 68.5 | Low | 91 Ų | 91 | 99.5 Ų | 99.5 | 64% | 0.636 | 52% | 0.522 | S | S | * | . | S | Bend | trans | -99.6 | -2.4 | 173.3 | 85.4 | 0 | 0 | 0 | 0 | 113.3 | N127 | N127-S130 PolarHBondContact O-N 3.49Å; N127-S130 PolarHBondContact O-OG 3.41Å |
| 131 | L | 72.3 | Confident | 69.2 | Low | 35 Ų | 35 | 96.2 Ų | 96.2 | 18% | 0.183 | 51% | 0.507 | C | S | . | . | trans | -74.6 | 130.8 | 179.9 | -64.1 | 179.3 | 0 | 0 | 0 | 109.7 | M128 E135 L136 L139 | M128-L131 HydrophobicContact SD-CD1 3.7Å; L131-E135 HydrophobicContact CB-CB 4.11Å; L131-E135 HydrophobicContact CD2-CB 4.27Å; L131-E135 WeakPolarHBondContact CD2-OE2 3.47Å; L131-L136 HydrophobicContact CB-CD1 3.91Å; L131-L136 HydrophobicContact CB-CG 4.16Å; L131-L136 WeakPolarHBondContact O-CD1 3.5Å; L131-L139 HydrophobicContact CD1-CD1 3.51Å | ||
| 132 | S | 79.4 | Confident | 69.8 | Low | 57 Ų | 57 | 91.2 Ų | 91.2 | 40% | 0.399 | 49% | 0.485 | S | S | . | . | trans | -65.4 | 159.7 | 173.7 | 73 | 0 | 0 | 0 | 0 | 110.6 | T134 E135 L136 | S132-T134 PolarHBondContact O-N 3.5Å; S132-T134 VanDerWaalsContact O-N 3.1Å; S132-T134 PolarHBondContact OG-OG1 3.2Å; S132-E135 WeakPolarHBondContact O-CB 3.49Å; S132-E135 PolarHBondContact O-N 2.85Å; S132-E135 WeakPolarHBondContact OG-CG 3.34Å; S132-E135 PolarHBondContact OG-N 2.93Å; S132-L136 PolarHBondContact O-N 3.1Å | ||
| 133 | R | 74.4 | Confident | 70.2 | Confident | 224 Ų | 224 | 92.4 Ų | 92.4 | 85% | 0.845 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -54.8 | -31.9 | 179.2 | -173.3 | 177 | 177.8 | -174.7 | -0.5 | 112.8 | Q137 | R133-Q137 WeakPolarHBondContact O-CB 3.41Å; R133-Q137 PolarHBondContact O-N 2.88Å; R133-Q137 VanDerWaalsContact O-N 3.16Å |
| 134 | T | 80.8 | Confident | 70.1 | Confident | 104 Ų | 104 | 93.6 Ų | 93.6 | 64% | 0.638 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -74.5 | -39 | 177.6 | 47.8 | 0 | 0 | 0 | 0 | 112.1 | S132 Q137 L138 | S132-T134 PolarHBondContact O-N 3.5Å; S132-T134 VanDerWaalsContact O-N 3.1Å; S132-T134 PolarHBondContact OG-OG1 3.2Å; T134-Q137 WeakPolarHBondContact O-CB 3.34Å; T134-Q137 PolarHBondContact O-N 3.21Å; T134-L138 PolarHBondContact O-N 3.01Å |
| 135 | E | 77.7 | Confident | 70.2 | Confident | 102 Ų | 102 | 98.5 Ų | 98.5 | 48% | 0.477 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -65.2 | -43.6 | 176.1 | -65.9 | -109.7 | 118.9 | 0 | 0 | 111.7 | L131 S132 Q137 L138 L139 | L131-E135 HydrophobicContact CB-CB 4.11Å; L131-E135 HydrophobicContact CD2-CB 4.27Å; L131-E135 WeakPolarHBondContact CD2-OE2 3.47Å; S132-E135 WeakPolarHBondContact O-CB 3.49Å; S132-E135 PolarHBondContact O-N 2.85Å; S132-E135 WeakPolarHBondContact OG-CG 3.34Å; S132-E135 PolarHBondContact OG-N 2.93Å; E135-Q137 VanDerWaalsContact C-N 3.32Å; E135-Q137 PolarHBondContact O-N 3.39Å; E135-L138 PolarHBondContact O-N 3.4Å; E135-L139 PolarHBondContact O-N 2.81Å |
| 136 | L | 77.7 | Confident | 70.4 | Confident | 82 Ų | 82 | 100.1 Ų | 100.1 | 43% | 0.429 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -61.3 | -40.3 | 173 | -94.5 | 136.5 | 0 | 0 | 0 | 112.2 | L131 S132 L138 N140 | L131-L136 HydrophobicContact CB-CD1 3.91Å; L131-L136 HydrophobicContact CB-CG 4.16Å; L131-L136 WeakPolarHBondContact O-CD1 3.5Å; S132-L136 PolarHBondContact O-N 3.1Å; L136-L138 VanDerWaalsContact C-N 3.34Å; L136-N140 VanDerWaalsContact O-CB 3.29Å; L136-N140 WeakPolarHBondContact O-CB 3.4Å; L136-N140 PolarHBondContact O-N 3.14Å |
| 137 | Q | 78 | Confident | 70.5 | Confident | 119 Ų | 119 | 104.9 Ų | 104.9 | 56% | 0.556 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -64.1 | -41.1 | 176.5 | -171.1 | 68.3 | 60.1 | 0 | 0 | 111.3 | R133 T134 E135 N140 Q141 | R133-Q137 WeakPolarHBondContact O-CB 3.41Å; R133-Q137 PolarHBondContact O-N 2.88Å; R133-Q137 VanDerWaalsContact O-N 3.16Å; T134-Q137 WeakPolarHBondContact O-CB 3.34Å; T134-Q137 PolarHBondContact O-N 3.21Å; E135-Q137 VanDerWaalsContact C-N 3.32Å; E135-Q137 PolarHBondContact O-N 3.39Å; Q137-N140 PolarHBondContact O-N 3.34Å; Q137-Q141 WeakPolarHBondContact O-CB 3.45Å; Q137-Q141 PolarHBondContact O-N 2.96Å |
| 138 | L | 80.4 | Confident | 71 | Confident | 95 Ų | 95 | 109.7 Ų | 109.7 | 50% | 0.497 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -68.2 | -45.8 | 178 | -168.9 | 70.5 | 0 | 0 | 0 | 111.2 | T134 E135 L136 N140 Q141 L142 | T134-L138 PolarHBondContact O-N 3.01Å; E135-L138 PolarHBondContact O-N 3.4Å; L136-L138 VanDerWaalsContact C-N 3.34Å; L138-N140 PolarHBondContact O-N 3.04Å; L138-Q141 PolarHBondContact O-N 3.42Å; L138-L142 HydrophobicContact CG-CD1 4.28Å; L138-L142 WeakPolarHBondContact O-CB 3.4Å; L138-L142 VanDerWaalsContact O-CG 3.26Å; L138-L142 WeakPolarHBondContact O-CG 3.49Å; L138-L142 PolarHBondContact O-N 3.4Å |
| 139 | L | 77.6 | Confident | 71.6 | Confident | 51 Ų | 51 | 115.8 Ų | 115.8 | 27% | 0.267 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -58.4 | -48.2 | 173.2 | -75.3 | -179.4 | 0 | 0 | 0 | 110.6 | M128 L131 E135 Q141 L142 H143 | M128-L139 HydrophobicContact SD-CD1 4.27Å; L131-L139 HydrophobicContact CD1-CD1 3.51Å; E135-L139 PolarHBondContact O-N 2.81Å; L139-Q141 VanDerWaalsContact C-N 3.26Å; L139-Q141 PolarHBondContact O-N 3.27Å; L139-L142 CarbonylContact O-C 3.54Å; L139-L142 PolarHBondContact O-N 2.84Å; L139-L142 VanDerWaalsContact O-N 3.12Å; L139-H143 VanDerWaalsContact C-ND1 3.34Å; L139-H143 WeakPolarHBondContact O-CB 3.34Å; L139-H143 PolarHBondContact O-N 3.16Å; L139-H143 PolarHBondContact O-ND1 3.43Å |
| 140 | N | 73.6 | Confident | 72.4 | Confident | 91 Ų | 91 | 121.3 Ų | 121.3 | 49% | 0.487 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -59 | -40.9 | 178.4 | -167.9 | -69.2 | 0 | 0 | 0 | 111.4 | L136 Q137 L138 L142 H143 C144 | L136-N140 VanDerWaalsContact O-CB 3.29Å; L136-N140 WeakPolarHBondContact O-CB 3.4Å; L136-N140 PolarHBondContact O-N 3.14Å; Q137-N140 PolarHBondContact O-N 3.34Å; L138-N140 PolarHBondContact O-N 3.04Å; N140-L142 PolarHBondContact O-N 3.43Å; N140-H143 PolarHBondContact O-N 3.04Å; N140-C144 WeakPolarHBondContact O-CB 3.34Å; N140-C144 PolarHBondContact O-N 3.22Å; N140-C144 PolarHBondContact O-SG 2.97Å; N140-C144 PolarHBondContact OD1-SG 2.94Å |
| 141 | Q | 70.5 | Confident | 73.3 | Confident | 111 Ų | 111 | 127.1 Ų | 127.1 | 52% | 0.519 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -65.2 | -38.4 | 176.7 | -161.3 | 172.5 | 93.8 | 0 | 0 | 112.3 | Q137 L138 L139 R145 | Q137-Q141 WeakPolarHBondContact O-CB 3.45Å; Q137-Q141 PolarHBondContact O-N 2.96Å; L138-Q141 PolarHBondContact O-N 3.42Å; L139-Q141 VanDerWaalsContact C-N 3.26Å; L139-Q141 PolarHBondContact O-N 3.27Å; Q141-R145 WeakPolarHBondContact O-CB 3.49Å; Q141-R145 WeakPolarHBondContact O-CG 3.35Å; Q141-R145 PolarHBondContact O-N 3.37Å |
| 142 | L | 71.5 | Confident | 74.2 | Confident | 50 Ų | 50 | 127.7 Ų | 127.7 | 26% | 0.262 | 58% | 0.577 | S | S | . | * | H | α-helix | trans | -71.5 | -39.4 | 174.9 | -66.6 | 173.3 | 0 | 0 | 0 | 112.3 | L138 L139 N140 R145 R146 | L138-L142 HydrophobicContact CG-CD1 4.28Å; L138-L142 WeakPolarHBondContact O-CB 3.4Å; L138-L142 VanDerWaalsContact O-CG 3.26Å; L138-L142 WeakPolarHBondContact O-CG 3.49Å; L138-L142 PolarHBondContact O-N 3.4Å; L139-L142 CarbonylContact O-C 3.54Å; L139-L142 PolarHBondContact O-N 2.84Å; L139-L142 VanDerWaalsContact O-N 3.12Å; N140-L142 PolarHBondContact O-N 3.43Å; L142-R145 PolarHBondContact O-N 3.35Å; L142-R146 WeakPolarHBondContact O-CB 3.39Å; L142-R146 VanDerWaalsContact O-CG 3.27Å; L142-R146 WeakPolarHBondContact O-CG 3.4Å; L142-R146 PolarHBondContact O-N 3.44Å |
| 143 | H | 65.2 | Low | 74.8 | Confident | 98 Ų | 98 | 132.2 Ų | 132.2 | 45% | 0.454 | 60% | 0.596 | S | S | . | * | H | α-helix | trans | -68.4 | -40.1 | 175.5 | -72.4 | 92.8 | 0 | 0 | 0 | 111.6 | L139 N140 R145 R146 | L139-H143 VanDerWaalsContact C-ND1 3.34Å; L139-H143 WeakPolarHBondContact O-CB 3.34Å; L139-H143 PolarHBondContact O-N 3.16Å; L139-H143 PolarHBondContact O-ND1 3.43Å; N140-H143 PolarHBondContact O-N 3.04Å; H143-R145 VanDerWaalsContact C-N 3.28Å; H143-R145 PolarHBondContact O-N 3.22Å; H143-R146 PolarHBondContact O-N 2.96Å |
| 144 | C | 58.4 | Low | 75.9 | Confident | 89 Ų | 89 | 123.7 Ų | 123.7 | 60% | 0.601 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -63.9 | -33.1 | 172.1 | -74.1 | 0 | 0 | 0 | 0 | 112.2 | N140 | N140-C144 WeakPolarHBondContact O-CB 3.34Å; N140-C144 PolarHBondContact O-N 3.22Å; N140-C144 PolarHBondContact O-SG 2.97Å; N140-C144 PolarHBondContact OD1-SG 2.94Å |
| 145 | R | 59.9 | Low | 76.7 | Confident | 207 Ų | 207 | 122.4 Ų | 122.4 | 78% | 0.781 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -73.4 | -33.4 | 173.7 | -81.3 | -175.2 | 157.6 | -150.7 | -5.4 | 113.3 | Q141 L142 H143 K147 | Q141-R145 WeakPolarHBondContact O-CB 3.49Å; Q141-R145 WeakPolarHBondContact O-CG 3.35Å; Q141-R145 PolarHBondContact O-N 3.37Å; L142-R145 PolarHBondContact O-N 3.35Å; H143-R145 VanDerWaalsContact C-N 3.28Å; H143-R145 PolarHBondContact O-N 3.22Å; R145-K147 PolarHBondContact O-N 3.37Å |
| 146 | R | 60.5 | Low | 77.6 | Confident | 145 Ų | 145 | 124 Ų | 124 | 55% | 0.547 | 57% | 0.568 | S | S | . | * | H | α-helix | trans | -76.8 | -8.5 | -171.3 | -81.2 | 177 | -171.8 | 125.5 | 2.3 | 116.1 | L142 H143 | L142-R146 WeakPolarHBondContact O-CB 3.39Å; L142-R146 VanDerWaalsContact O-CG 3.27Å; L142-R146 WeakPolarHBondContact O-CG 3.4Å; L142-R146 PolarHBondContact O-N 3.44Å; H143-R146 PolarHBondContact O-N 2.96Å |
| 147 | K | 59.6 | Low | 78.5 | Confident | 186 Ų | 186 | 127.5 Ų | 127.5 | 81% | 0.809 | 58% | 0.583 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -143.5 | 52.5 | 177.7 | -146.8 | 171.3 | -173.3 | 174.7 | 0 | 113.8 | R145 R149 | R145-K147 PolarHBondContact O-N 3.37Å; K147-R149 PolarHBondContact O-N 2.95Å; K147-R149 VanDerWaalsContact O-N 3.08Å |
| 148 | R | 74.8 | Confident | 79.5 | Confident | 213 Ų | 213 | 123.3 Ų | 123.3 | 80% | 0.804 | 56% | 0.563 | S | S | * | * | trans | -67.3 | 108.8 | 168.2 | -166 | 175.7 | -177.4 | 176.1 | 0.8 | 108.3 | H150 | R148-H150 PolarHBondContact O-N 3.31Š| ||
| 149 | R | 76.9 | Confident | 80.3 | Confident | 212 Ų | 212 | 121.8 Ų | 121.8 | 80% | 0.8 | 56% | 0.555 | S | S | * | * | P | Polyproline II helix | trans | -55.1 | 139.5 | 174.9 | -65.1 | -176.1 | -175.3 | -171.8 | 1.1 | 109.3 | K147 R151 | K147-R149 PolarHBondContact O-N 2.95Å; K147-R149 VanDerWaalsContact O-N 3.08Å; R149-R151 PolarHBondContact O-N 3.16Å |
| 150 | H | 82.5 | Confident | 81.3 | Confident | 186 Ų | 186 | 126.4 Ų | 126.4 | 86% | 0.861 | 58% | 0.575 | S | S | * | * | P | Polyproline II helix | trans | -56.9 | 126.6 | 175.7 | -67.7 | -79.7 | 0 | 0 | 0 | 110.1 | R148 | R148-H150 PolarHBondContact O-N 3.31Š|
| 151 | R | 88.1 | Confident | 82.4 | Confident | 212 Ų | 212 | 123.8 Ų | 123.8 | 80% | 0.8 | 57% | 0.567 | S | S | * | * | P | Polyproline II helix | trans | -77.5 | 132 | 178.8 | -171.7 | 175.6 | -177.3 | 174 | 0.7 | 108.6 | R149 | R149-R151 PolarHBondContact O-N 3.16Š|
| 152 | T | 90.3 | Very high | 83.8 | Confident | 47 Ų | 47 | 118.5 Ų | 118.5 | 29% | 0.288 | 54% | 0.542 | S | S | . | . | P | Polyproline II helix | trans | -80.2 | 130 | 169.4 | -56.2 | 0 | 0 | 0 | 0 | 108.6 | F154 K190 | T152-F154 HydrophobicContact CG2-CD1 4.17Å; T152-F154 HydrophobicContact CG2-CE1 3.83Å; T152-F154 HydrophobicContact CG2-CZ 4.23Å; T152-K190 VanDerWaalsContact OG1-CE 3.23Å; T152-K190 WeakPolarHBondContact OG1-CE 3.32Å; T152-K190 PolarHBondContact OG1-NZ 3.2Å |
| 153 | I | 93.4 | Very high | 85 | Confident | 153 Ų | 153 | 118.3 Ų | 118.3 | 79% | 0.785 | 54% | 0.54 | S | S | * | . | P | Polyproline II helix | trans | -100.5 | 128.3 | 168.3 | -60.5 | 165.5 | 0 | 0 | 0 | 105.6 | ||
| 154 | F | 95.9 | Very high | 86.6 | Confident | 45 Ų | 45 | 115.1 Ų | 115.1 | 20% | 0.197 | 53% | 0.533 | C | S | . | . | P | Polyproline II helix | trans | -91.9 | 144.9 | 177.6 | -58.1 | -70.6 | 0 | 0 | 0 | 108.7 | T152 Q158 L159 L186 K190 W194 | T152-F154 HydrophobicContact CG2-CD1 4.17Å; T152-F154 HydrophobicContact CG2-CE1 3.83Å; T152-F154 HydrophobicContact CG2-CZ 4.23Å; F154-Q158 HydrophobicContact CB-CB 4.37Å; F154-L159 HydrophobicContact CB-CD2 3.79Å; F154-L159 HydrophobicContact CB-CG 3.88Å; F154-L159 HydrophobicContact CD2-CD2 4.21Å; F154-L159 HydrophobicContact CG-CD2 4.28Å; F154-L186 HydrophobicContact CD1-CD1 3.64Å; F154-L186 HydrophobicContact CD1-CD2 4.29Å; F154-L186 HydrophobicContact CE1-CD1 3.62Å; F154-L186 HydrophobicContact CE1-CD2 4.28Å; F154-K190 HydrophobicContact CE1-CB 4.31Å; F154-K190 HydrophobicContact CZ-CB 4.49Å; F154-W194 AromaticContact CD2-CD1 3.84Å; F154-W194 AromaticContact CE2-CD1 3.57Å; F154-W194 HydrophobicContact CE2-CG 4.43Å; F154-W194 HydrophobicContact CZ-CB 4.38Å |
| 155 | T | 97.8 | Very high | 88.4 | Confident | 76 Ų | 76 | 111.9 Ų | 111.9 | 47% | 0.466 | 51% | 0.509 | S | S | . | . | P | Polyproline II helix | trans | -75.1 | 163.3 | 170 | 66.7 | 0 | 0 | 0 | 0 | 110.3 | E157 Q158 L159 | T155-E157 VanDerWaalsContact C-N 3.35Å; T155-E157 PolarHBondContact O-N 3Å; T155-Q158 WeakPolarHBondContact O-CB 3.46Å; T155-Q158 PolarHBondContact O-N 2.79Å; T155-Q158 WeakPolarHBondContact OG1-CG 3.41Å; T155-Q158 PolarHBondContact OG1-N 3.38Å; T155-L159 WeakPolarHBondContact O-CG 3.32Å; T155-L159 PolarHBondContact O-N 2.72Å |
| 156 | D | 97.3 | Very high | 90.3 | Very high | 136 Ų | 136 | 102.2 Ų | 102.2 | 73% | 0.727 | 47% | 0.473 | S | S | * | . | H | α-helix | trans | -62.9 | -41.1 | -178.7 | -69.9 | -14.6 | 0 | 0 | 0 | 112.2 | Q158 L159 E160 | D156-Q158 VanDerWaalsContact C-N 3.31Å; D156-Q158 PolarHBondContact O-N 2.72Å; D156-L159 WeakPolarHBondContact O-CB 3.3Å; D156-L159 PolarHBondContact O-N 3.31Å; D156-L159 VanDerWaalsContact O-N 3.11Å; D156-E160 PolarHBondContact O-N 2.83Å |
| 157 | E | 97.3 | Very high | 92 | Very high | 156 Ų | 156 | 101.8 Ų | 101.8 | 73% | 0.729 | 48% | 0.477 | S | S | * | . | H | α-helix | trans | -58.5 | -41.3 | 174.3 | -174.4 | -173.9 | 174.8 | 0 | 0 | 112.2 | T155 L159 E160 A161 | T155-E157 VanDerWaalsContact C-N 3.35Å; T155-E157 PolarHBondContact O-N 3Å; E157-L159 VanDerWaalsContact C-N 3.35Å; E157-E160 PolarHBondContact O-N 3.02Å; E157-A161 PolarHBondContact O-N 3.11Å; E157-A161 VanDerWaalsContact O-N 3.14Å |
| 158 | Q | 97.6 | Very high | 93.8 | Very high | 30 Ų | 30 | 100.6 Ų | 100.6 | 14% | 0.14 | 48% | 0.475 | C | S | . | . | H | α-helix | trans | -65.4 | -41 | 176.2 | -66.7 | 174 | -22.4 | 0 | 0 | 111.2 | F154 T155 D156 L162 V184 | F154-Q158 HydrophobicContact CB-CB 4.37Å; T155-Q158 WeakPolarHBondContact O-CB 3.46Å; T155-Q158 PolarHBondContact O-N 2.79Å; T155-Q158 WeakPolarHBondContact OG1-CG 3.41Å; T155-Q158 PolarHBondContact OG1-N 3.38Å; D156-Q158 VanDerWaalsContact C-N 3.31Å; D156-Q158 PolarHBondContact O-N 2.72Å; Q158-L162 WeakPolarHBondContact O-CB 3.29Å; Q158-L162 VanDerWaalsContact O-CD1 3.29Å; Q158-L162 WeakPolarHBondContact O-CD1 3.5Å; Q158-L162 WeakPolarHBondContact O-CG 3.34Å; Q158-L162 PolarHBondContact O-N 2.88Å; Q158-V184 HydrophobicContact CB-CB 4.5Å; Q158-V184 HydrophobicContact CG-CB 4.11Å; Q158-V184 PolarHBondContact NE2-O 3.35Å |
| 159 | L | 98.1 | Very high | 94.8 | Very high | 63 Ų | 63 | 92.8 Ų | 92.8 | 33% | 0.33 | 45% | 0.451 | S | S | . | . | H | α-helix | trans | -65.7 | -39 | 178 | -70 | 174.4 | 0 | 0 | 0 | 111.8 | F154 T155 D156 E157 L162 E163 | F154-L159 HydrophobicContact CB-CD2 3.79Å; F154-L159 HydrophobicContact CB-CG 3.88Å; F154-L159 HydrophobicContact CD2-CD2 4.21Å; F154-L159 HydrophobicContact CG-CD2 4.28Å; T155-L159 WeakPolarHBondContact O-CG 3.32Å; T155-L159 PolarHBondContact O-N 2.72Å; D156-L159 WeakPolarHBondContact O-CB 3.3Å; D156-L159 PolarHBondContact O-N 3.31Å; D156-L159 VanDerWaalsContact O-N 3.11Å; E157-L159 VanDerWaalsContact C-N 3.35Å; L159-L162 PolarHBondContact O-N 3.4Å; L159-E163 VanDerWaalsContact O-CB 3.3Å; L159-E163 WeakPolarHBondContact O-CB 3.5Å; L159-E163 PolarHBondContact O-N 3.2Å |
| 160 | E | 98.1 | Very high | 95.8 | Very high | 148 Ų | 148 | 86 Ų | 86 | 69% | 0.692 | 43% | 0.427 | S | S | * | . | H | α-helix | trans | -61.3 | -50.3 | 176.4 | -175.8 | 177 | -170.9 | 0 | 0 | 111.2 | D156 E157 L162 E163 G164 | D156-E160 PolarHBondContact O-N 2.83Å; E157-E160 PolarHBondContact O-N 3.02Å; E160-L162 VanDerWaalsContact C-N 3.33Å; E160-L162 PolarHBondContact O-N 3.45Å; E160-E163 PolarHBondContact O-N 3.37Å; E160-G164 PolarHBondContact O-N 3.45Å |
| 161 | A | 97.4 | Very high | 96.5 | Very high | 37 Ų | 37 | 84.7 Ų | 84.7 | 31% | 0.306 | 42% | 0.416 | S | S | . | . | H | α-helix | trans | -62.9 | -38.7 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | E157 L165 L180 V184 | E157-A161 PolarHBondContact O-N 3.11Å; E157-A161 VanDerWaalsContact O-N 3.14Å; A161-L165 PolarHBondContact O-N 3.37Å; A161-L180 HydrophobicContact CB-CD1 4.06Å; A161-V184 HydrophobicContact CB-CG1 3.58Å |
| 162 | L | 98.3 | Very high | 96.9 | Very high | 0 Ų | 0 | 75.3 Ų | 75.3 | 0% | 0 | 38% | 0.382 | C | S | . | . | H | α-helix | trans | -65 | -43.2 | 175.2 | -76.4 | 162.7 | 0 | 0 | 0 | 112.2 | Q158 L159 E160 F166 L180 V191 W194 F195 | Q158-L162 WeakPolarHBondContact O-CB 3.29Å; Q158-L162 VanDerWaalsContact O-CD1 3.29Å; Q158-L162 WeakPolarHBondContact O-CD1 3.5Å; Q158-L162 WeakPolarHBondContact O-CG 3.34Å; Q158-L162 PolarHBondContact O-N 2.88Å; L159-L162 PolarHBondContact O-N 3.4Å; E160-L162 VanDerWaalsContact C-N 3.33Å; E160-L162 PolarHBondContact O-N 3.45Å; L162-F166 WeakPolarHBondContact O-CB 3.17Å; L162-F166 PolarHBondContact O-N 3.12Å; L162-L180 HydrophobicContact CD2-CD2 3.65Å; L162-L180 HydrophobicContact CG-CD2 4.32Å; L162-V191 HydrophobicContact CD2-CB 4.49Å; L162-V191 HydrophobicContact CD2-CG1 3.93Å; L162-V191 HydrophobicContact CD2-CG2 4.33Å; L162-W194 HydrophobicContact CB-CD2 4.01Å; L162-W194 HydrophobicContact CB-CE3 4Å; L162-W194 HydrophobicContact CB-CH2 3.76Å; L162-W194 HydrophobicContact CB-CZ2 3.72Å; L162-W194 HydrophobicContact CB-CZ3 3.89Å; L162-W194 HydrophobicContact CD1-CD2 4Å; L162-W194 HydrophobicContact CD1-CG 3.94Å; L162-W194 HydrophobicContact CD2-CD2 4.06Å; L162-W194 HydrophobicContact CD2-CE3 3.95Å; L162-W194 HydrophobicContact CD2-CG 4.33Å; L162-W194 HydrophobicContact CG-CD2 4.27Å; L162-W194 HydrophobicContact CG-CE3 4.43Å; L162-F195 HydrophobicContact CD2-CE2 4.03Å |
| 163 | E | 98.1 | Very high | 97.3 | Very high | 46 Ų | 46 | 78.4 Ų | 78.4 | 22% | 0.215 | 40% | 0.397 | C | S | . | . | H | α-helix | trans | -71.4 | -37.8 | 178.8 | -168.6 | 64.6 | -151.2 | 0 | 0 | 111.7 | L159 E160 F166 Q167 R198 | L159-E163 VanDerWaalsContact O-CB 3.3Å; L159-E163 WeakPolarHBondContact O-CB 3.5Å; L159-E163 PolarHBondContact O-N 3.2Å; E160-E163 PolarHBondContact O-N 3.37Å; E163-F166 CarbonylContact O-C 3.56Å; E163-F166 WeakPolarHBondContact O-CA 3.45Å; E163-F166 WeakPolarHBondContact O-CB 3.36Å; E163-F166 PolarHBondContact O-N 3.21Å; E163-F166 VanDerWaalsContact O-N 3.11Å; E163-Q167 WeakPolarHBondContact O-CG 3.46Å; E163-Q167 PolarHBondContact O-N 3.37Å; E163-R198 IonicContact OE1-CZ 3.81Å; E163-R198 IonicContact OE1-NE 3.43Å; E163-R198 PolarHBondContact OE1-NE 3.47Å; E163-R198 IonicContact OE1-NH2 2.86Å; E163-R198 PolarHBondContact OE1-NH2 3.45Å; E163-R198 IonicContact OE2-CZ 2.69Å; E163-R198 IonicContact OE2-NE 3.41Å; E163-R198 PolarHBondContact OE2-NE 3.03Å; E163-R198 IonicContact OE2-NH2 3.04Å; E163-R198 PolarHBondContact OE2-NH2 3.1Å |
| 164 | G | 97.9 | Very high | 97.4 | Very high | 30 Ų | 30 | 74.2 Ų | 74.2 | 31% | 0.309 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -56.1 | -52.2 | 173.9 | 0 | 0 | 0 | 0 | 0 | 111.4 | E160 F166 Q167 E168 | E160-G164 PolarHBondContact O-N 3.45Å; G164-F166 VanDerWaalsContact C-N 3.28Å; G164-F166 PolarHBondContact O-N 2.8Å; G164-Q167 WeakPolarHBondContact O-CB 3.28Å; G164-Q167 PolarHBondContact O-N 3.1Å; G164-Q167 VanDerWaalsContact O-N 3.08Å; G164-E168 PolarHBondContact O-N 2.95Å |
| 165 | L | 97.6 | Very high | 97.5 | Very high | 21 Ų | 21 | 73.5 Ų | 73.5 | 11% | 0.11 | 38% | 0.383 | C | S | . | . | H | α-helix | trans | -63.4 | -36.4 | 175 | -174.8 | 67.1 | 0 | 0 | 0 | 111.9 | A161 Q167 E168 T169 P172 T176 L180 F195 | A161-L165 PolarHBondContact O-N 3.37Å; L165-Q167 VanDerWaalsContact C-N 3.25Å; L165-Q167 PolarHBondContact O-N 3.41Å; L165-E168 PolarHBondContact O-N 3.16Å; L165-T169 HydrophobicContact CD1-CG2 4.2Å; L165-T169 HydrophobicContact CG-CG2 4.43Å; L165-T169 PolarHBondContact O-N 3.45Å; L165-P172 HydrophobicContact CD2-CB 4.11Å; L165-P172 HydrophobicContact CD2-CG 4.47Å; L165-T176 HydrophobicContact CD1-CG2 3.84Å; L165-T176 HydrophobicContact CD2-CG2 3.91Å; L165-L180 HydrophobicContact CB-CD2 4.23Å; L165-L180 HydrophobicContact CD2-CB 4.25Å; L165-L180 HydrophobicContact CD2-CD2 3.65Å; L165-L180 HydrophobicContact CD2-CG 4.49Å; L165-F195 HydrophobicContact CB-CZ 4.19Å; L165-F195 HydrophobicContact CD2-CE2 4.29Å; L165-F195 HydrophobicContact CD2-CZ 3.83Å; L165-F195 HydrophobicContact CG-CZ 4.03Å |
| 166 | F | 97.9 | Very high | 97.5 | Very high | 4 Ų | 4 | 72.3 Ų | 72.3 | 2% | 0.018 | 38% | 0.376 | C | S | . | . | H | α-helix | trans | -63.8 | -31.3 | 175.9 | -172.7 | -99.7 | 0 | 0 | 0 | 112.2 | L162 E163 G164 K170 W194 F195 R198 R199 W202 | L162-F166 WeakPolarHBondContact O-CB 3.17Å; L162-F166 PolarHBondContact O-N 3.12Å; E163-F166 CarbonylContact O-C 3.56Å; E163-F166 WeakPolarHBondContact O-CA 3.45Å; E163-F166 WeakPolarHBondContact O-CB 3.36Å; E163-F166 PolarHBondContact O-N 3.21Å; E163-F166 VanDerWaalsContact O-N 3.11Å; G164-F166 VanDerWaalsContact C-N 3.28Å; G164-F166 PolarHBondContact O-N 2.8Å; F166-K170 HydrophobicContact CD1-CD 4.01Å; F166-K170 HydrophobicContact CD2-CD 4.21Å; F166-K170 HydrophobicContact CE1-CD 3.72Å; F166-K170 HydrophobicContact CE2-CB 4.05Å; F166-K170 HydrophobicContact CE2-CD 3.94Å; F166-K170 HydrophobicContact CE2-CG 4.38Å; F166-K170 HydrophobicContact CG-CD 4.24Å; F166-K170 HydrophobicContact CZ-CB 4.32Å; F166-K170 HydrophobicContact CZ-CD 3.68Å; F166-K170 HydrophobicContact CZ-CG 4.21Å; F166-K170 WeakPolarHBondContact O-CD 3.4Å; F166-K170 WeakPolarHBondContact O-CE 3.23Å; F166-K170 PolarHBondContact O-NZ 3.17Å; F166-W194 HydrophobicContact CB-CH2 4.16Å; F166-W194 HydrophobicContact CB-CZ3 4.05Å; F166-W194 HydrophobicContact CD2-CZ3 4.38Å; F166-W194 HydrophobicContact CG-CZ3 4.41Å; F166-F195 HydrophobicContact CB-CE1 4.03Å; F166-F195 HydrophobicContact CB-CZ 4.38Å; F166-F195 AromaticContact CD2-CD1 3.79Å; F166-F195 HydrophobicContact CD2-CD1 3.79Å; F166-F195 AromaticContact CD2-CE1 3.72Å; F166-F195 HydrophobicContact CD2-CE1 3.72Å; F166-F195 HydrophobicContact CE2-CD1 4.48Å; F166-F195 HydrophobicContact CG-CE1 4.38Å; F166-R198 HydrophobicContact CD1-CG 3.87Å; F166-R198 HydrophobicContact CD2-CB 4.33Å; F166-R198 HydrophobicContact CD2-CG 3.71Å; F166-R198 HydrophobicContact CE1-CG 3.79Å; F166-R198 HydrophobicContact CE2-CB 4.15Å; F166-R198 HydrophobicContact CE2-CG 3.63Å; F166-R198 HydrophobicContact CG-CG 3.84Å; F166-R198 HydrophobicContact CZ-CG 3.67Å; F166-R199 HydrophobicContact CE2-CG 3.82Å; F166-R199 HydrophobicContact CZ-CG 4.33Å; F166-W202 HydrophobicContact CZ-CB 4.46Å |
| 167 | Q | 97.1 | Very high | 97.6 | Very high | 136 Ų | 136 | 67.6 Ų | 67.6 | 64% | 0.636 | 35% | 0.348 | S | S | * | . | H | α-helix | trans | -64.9 | -45.8 | 175.4 | -72.3 | 176.9 | 7.8 | 0 | 0 | 110.9 | E163 G164 L165 K170 | E163-Q167 WeakPolarHBondContact O-CG 3.46Å; E163-Q167 PolarHBondContact O-N 3.37Å; G164-Q167 WeakPolarHBondContact O-CB 3.28Å; G164-Q167 PolarHBondContact O-N 3.1Å; G164-Q167 VanDerWaalsContact O-N 3.08Å; L165-Q167 VanDerWaalsContact C-N 3.25Å; L165-Q167 PolarHBondContact O-N 3.41Å; Q167-K170 PolarHBondContact O-NZ 3.41Å |
| 168 | E | 97 | Very high | 97.6 | Very high | 162 Ų | 162 | 64.6 Ų | 64.6 | 76% | 0.757 | 33% | 0.334 | S | S | * | . | H | α-helix | trans | -63.3 | -53.7 | 176.4 | -63.1 | 176.4 | -169.6 | 0 | 0 | 112.5 | G164 L165 | G164-E168 PolarHBondContact O-N 2.95Å; L165-E168 PolarHBondContact O-N 3.16Å |
| 169 | T | 96.4 | Very high | 97.6 | Very high | 49 Ų | 49 | 68.4 Ų | 68.4 | 30% | 0.301 | 35% | 0.352 | S | S | . | . | trans | -140.4 | 128.5 | -179 | 177.8 | 0 | 0 | 0 | 0 | 112.6 | L165 Y171 P172 | L165-T169 HydrophobicContact CD1-CG2 4.2Å; L165-T169 HydrophobicContact CG-CG2 4.43Å; L165-T169 PolarHBondContact O-N 3.45Å; T169-Y171 VanDerWaalsContact C-N 3.26Å; T169-Y171 PolarHBondContact O-N 3.04Å; T169-Y171 PolarHBondContact OG1-N 3.15Å; T169-Y171 PolarHBondContact OG1-O 3.21Å; T169-P172 HydrophobicContact CG2-CB 3.97Å | ||
| 170 | K | 96.8 | Very high | 97.6 | Very high | 68 Ų | 68 | 66 Ų | 66 | 30% | 0.296 | 34% | 0.34 | S | S | . | . | S | Bend | trans | -78 | -17.4 | 177.7 | -50.6 | -31.8 | -171.9 | -150.2 | 0 | 111.9 | F166 Q167 R199 | F166-K170 HydrophobicContact CD1-CD 4.01Å; F166-K170 HydrophobicContact CD2-CD 4.21Å; F166-K170 HydrophobicContact CE1-CD 3.72Å; F166-K170 HydrophobicContact CE2-CB 4.05Å; F166-K170 HydrophobicContact CE2-CD 3.94Å; F166-K170 HydrophobicContact CE2-CG 4.38Å; F166-K170 HydrophobicContact CG-CD 4.24Å; F166-K170 HydrophobicContact CZ-CB 4.32Å; F166-K170 HydrophobicContact CZ-CD 3.68Å; F166-K170 HydrophobicContact CZ-CG 4.21Å; F166-K170 WeakPolarHBondContact O-CD 3.4Å; F166-K170 WeakPolarHBondContact O-CE 3.23Å; F166-K170 PolarHBondContact O-NZ 3.17Å; Q167-K170 PolarHBondContact O-NZ 3.41Å; K170-R199 WeakPolarHBondContact O-CD 3.33Å; K170-R199 PolarHBondContact O-NH1 3.12Å |
| 171 | Y | 97.6 | Very high | 97.6 | Very high | 160 Ų | 160 | 59.3 Ų | 59.3 | 63% | 0.627 | 31% | 0.309 | S | S | * | . | S | Bend | trans | -132.7 | 74.1 | -176.7 | -65 | -87.6 | 0 | 0 | 0 | 109.4 | T169 | T169-Y171 VanDerWaalsContact C-N 3.26Å; T169-Y171 PolarHBondContact O-N 3.04Å; T169-Y171 PolarHBondContact OG1-N 3.15Å; T169-Y171 PolarHBondContact OG1-O 3.21Å |
| 172 | P | 97 | Very high | 97.6 | Very high | 14 Ų | 14 | 65.7 Ų | 65.7 | 9% | 0.091 | 33% | 0.325 | C | S | . | . | trans | -68 | 144.3 | 175 | 29.6 | -36.2 | 0 | 0 | 0 | 110.9 | L165 T169 T176 R177 F195 | L165-P172 HydrophobicContact CD2-CB 4.11Å; L165-P172 HydrophobicContact CD2-CG 4.47Å; T169-P172 HydrophobicContact CG2-CB 3.97Å; P172-T176 HydrophobicContact CB-CG2 4.31Å; P172-R177 HydrophobicContact CB-CG 3.98Å; P172-R177 HydrophobicContact CG-CG 3.74Å; P172-F195 VanDerWaalsContact CD-CD1 3.44Å; P172-F195 VanDerWaalsContact CD-CE1 3.48Å; P172-F195 HydrophobicContact CG-CD1 3.62Å; P172-F195 HydrophobicContact CG-CD2 4.17Å; P172-F195 HydrophobicContact CG-CE1 3.47Å; P172-F195 VanDerWaalsContact CG-CE1 3.47Å; P172-F195 HydrophobicContact CG-CE2 4.06Å; P172-F195 HydrophobicContact CG-CG 3.99Å; P172-F195 HydrophobicContact CG-CZ 3.73Å | ||
| 173 | D | 98 | Very high | 97.5 | Very high | 112 Ų | 112 | 73.7 Ų | 73.7 | 60% | 0.599 | 36% | 0.36 | S | S | * | . | trans | -72.5 | 163.9 | 173.8 | -177 | 38.8 | 0 | 0 | 0 | 111.7 | G175 T176 R177 | D173-G175 VanDerWaalsContact C-N 3.29Å; D173-G175 PolarHBondContact O-N 3.28Å; D173-T176 PolarHBondContact O-N 3.06Å; D173-R177 WeakPolarHBondContact O-CG 3.45Å; D173-R177 PolarHBondContact O-N 3.44Å | ||
| 174 | V | 97.2 | Very high | 97.5 | Very high | 66 Ų | 66 | 72.2 Ų | 72.2 | 40% | 0.4 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -51.5 | -48.3 | 178.8 | -173.3 | 0 | 0 | 0 | 0 | 110.8 | T176 R177 E178 | V174-T176 PolarHBondContact O-N 3.05Å; V174-R177 PolarHBondContact O-N 3.36Å; V174-R177 VanDerWaalsContact O-N 3.16Å; V174-E178 HydrophobicContact CG1-CG 4.4Å; V174-E178 WeakPolarHBondContact O-CG 3.16Å; V174-E178 PolarHBondContact O-N 2.96Å |
| 175 | G | 97.9 | Very high | 97.4 | Very high | 29 Ų | 29 | 79 Ų | 79 | 30% | 0.299 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -61.8 | -41.5 | -179.1 | 0 | 0 | 0 | 0 | 0 | 113.2 | D173 E178 Q179 | D173-G175 VanDerWaalsContact C-N 3.29Å; D173-G175 PolarHBondContact O-N 3.28Å; G175-E178 PolarHBondContact O-N 3.37Å; G175-Q179 WeakPolarHBondContact O-CG 2.96Å; G175-Q179 PolarHBondContact O-N 3.07Å |
| 176 | T | 97.6 | Very high | 97.3 | Very high | 52 Ų | 52 | 79.5 Ų | 79.5 | 32% | 0.319 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -66.4 | -40.1 | 176.1 | -45.9 | 0 | 0 | 0 | 0 | 111.5 | L165 P172 D173 V174 Q179 L180 | L165-T176 HydrophobicContact CD1-CG2 3.84Å; L165-T176 HydrophobicContact CD2-CG2 3.91Å; P172-T176 HydrophobicContact CB-CG2 4.31Å; D173-T176 PolarHBondContact O-N 3.06Å; V174-T176 PolarHBondContact O-N 3.05Å; T176-Q179 PolarHBondContact O-N 2.96Å; T176-L180 PolarHBondContact O-N 3.15Å |
| 177 | R | 98.3 | Very high | 97.3 | Very high | 36 Ų | 36 | 86.9 Ų | 86.9 | 14% | 0.136 | 41% | 0.408 | C | S | . | . | H | α-helix | trans | -64.2 | -41.8 | 176.2 | -68.3 | -173.2 | -56.9 | 175.9 | 13 | 111.5 | P172 D173 V174 L180 A181 E188 V191 E192 | P172-R177 HydrophobicContact CB-CG 3.98Å; P172-R177 HydrophobicContact CG-CG 3.74Å; D173-R177 WeakPolarHBondContact O-CG 3.45Å; D173-R177 PolarHBondContact O-N 3.44Å; V174-R177 PolarHBondContact O-N 3.36Å; V174-R177 VanDerWaalsContact O-N 3.16Å; R177-L180 PolarHBondContact O-N 3.17Å; R177-A181 WeakPolarHBondContact O-CB 3.27Å; R177-A181 PolarHBondContact O-N 3.08Å; R177-E188 HydrophobicContact CB-CG 4.17Å; R177-E188 IonicContact CZ-OE1 3.63Å; R177-E188 IonicContact NE-OE1 2.72Å; R177-E188 PolarHBondContact NE-OE1 2.99Å; R177-E188 IonicContact NH1-OE1 2.99Å; R177-E188 IonicContact NH2-OE1 3.41Å; R177-E188 PolarHBondContact NH2-OE1 2.97Å; R177-V191 HydrophobicContact CB-CG1 4.19Å; R177-V191 HydrophobicContact CG-CG1 4.21Å; R177-E192 IonicContact CZ-OE2 3.44Å; R177-E192 VanDerWaalsContact NH1-CG 3.32Å; R177-E192 IonicContact NH1-OE2 2.72Å; R177-E192 PolarHBondContact NH1-OE2 3.47Å; R177-E192 IonicContact NH2-OE2 3.38Å; R177-E192 PolarHBondContact NH2-OE2 3.22Å |
| 178 | E | 98.4 | Very high | 97.3 | Very high | 94 Ų | 94 | 82.9 Ų | 82.9 | 44% | 0.439 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -64.5 | -39.6 | 176.5 | -73.7 | 180 | 167.9 | 0 | 0 | 112.6 | V174 G175 R182 E188 | V174-E178 HydrophobicContact CG1-CG 4.4Å; V174-E178 WeakPolarHBondContact O-CG 3.16Å; V174-E178 PolarHBondContact O-N 2.96Å; G175-E178 PolarHBondContact O-N 3.37Å; E178-R182 WeakPolarHBondContact O-CG 3.46Å; E178-R182 PolarHBondContact O-N 2.79Å; E178-R182 VanDerWaalsContact O-N 3.07Å; E178-R182 PolarHBondContact O-NE 2.8Å; E178-E188 HydrophobicContact CG-CB 4.42Å; E178-E188 HydrophobicContact CG-CG 3.87Å |
| 179 | Q | 97.9 | Very high | 97.3 | Very high | 109 Ų | 109 | 79.5 Ų | 79.5 | 51% | 0.509 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -63.5 | -46.2 | 174.4 | -74.6 | 176.6 | -10.7 | 0 | 0 | 111.4 | G175 T176 R182 K183 | G175-Q179 WeakPolarHBondContact O-CG 2.96Å; G175-Q179 PolarHBondContact O-N 3.07Å; T176-Q179 PolarHBondContact O-N 2.96Å; Q179-R182 PolarHBondContact O-N 3.17Å; Q179-K183 WeakPolarHBondContact O-CG 3.34Å; Q179-K183 PolarHBondContact O-N 3.11Å; Q179-K183 VanDerWaalsContact O-N 3.15Å |
| 180 | L | 97.8 | Very high | 97.3 | Very high | 14 Ų | 14 | 79.4 Ų | 79.4 | 7% | 0.073 | 37% | 0.369 | C | S | . | . | H | α-helix | trans | -62.4 | -47.8 | 176.2 | -179.1 | 64.7 | 0 | 0 | 0 | 110.9 | A161 L162 L165 T176 R177 R182 K183 V184 V191 F195 | A161-L180 HydrophobicContact CB-CD1 4.06Å; L162-L180 HydrophobicContact CD2-CD2 3.65Å; L162-L180 HydrophobicContact CG-CD2 4.32Å; L165-L180 HydrophobicContact CB-CD2 4.23Å; L165-L180 HydrophobicContact CD2-CB 4.25Å; L165-L180 HydrophobicContact CD2-CD2 3.65Å; L165-L180 HydrophobicContact CD2-CG 4.49Å; T176-L180 PolarHBondContact O-N 3.15Å; R177-L180 PolarHBondContact O-N 3.17Å; L180-R182 PolarHBondContact O-N 3.43Å; L180-K183 WeakPolarHBondContact O-CA 3.29Å; L180-K183 WeakPolarHBondContact O-CB 3.38Å; L180-K183 PolarHBondContact O-N 3.47Å; L180-V184 HydrophobicContact CD1-CG1 4.01Å; L180-V184 WeakPolarHBondContact O-CG2 3.48Å; L180-V184 PolarHBondContact O-N 3.38Å; L180-V191 HydrophobicContact CD2-CG1 4.12Å; L180-F195 HydrophobicContact CD2-CE2 4.25Å |
| 181 | A | 97.8 | Very high | 97.4 | Very high | 6 Ų | 6 | 76.2 Ų | 76.2 | 5% | 0.05 | 36% | 0.355 | C | S | . | . | H | α-helix | trans | -52.7 | -42.4 | 178.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | R177 H185 L186 E188 V191 | R177-A181 WeakPolarHBondContact O-CB 3.27Å; R177-A181 PolarHBondContact O-N 3.08Å; A181-H185 WeakPolarHBondContact O-CA 3.46Å; A181-H185 PolarHBondContact O-N 3.37Å; A181-L186 CarbonylContact C-O 3.58Å; A181-L186 WeakPolarHBondContact CB-O 3.32Å; A181-L186 PolarHBondContact O-N 3.25Å; A181-E188 HydrophobicContact CB-CB 4.39Å; A181-V191 HydrophobicContact CB-CG2 3.89Å |
| 182 | R | 97.7 | Very high | 97.4 | Very high | 172 Ų | 172 | 71.2 Ų | 71.2 | 65% | 0.649 | 34% | 0.337 | S | S | * | . | H | α-helix | trans | -63.7 | -44.3 | 173.6 | -76.1 | -176.5 | -79.4 | 161.6 | -11.8 | 112.8 | E178 Q179 L180 H185 | E178-R182 WeakPolarHBondContact O-CG 3.46Å; E178-R182 PolarHBondContact O-N 2.79Å; E178-R182 VanDerWaalsContact O-N 3.07Å; E178-R182 PolarHBondContact O-NE 2.8Å; Q179-R182 PolarHBondContact O-N 3.17Å; L180-R182 PolarHBondContact O-N 3.43Å; R182-H185 PolarHBondContact O-N 3.24Å |
| 183 | K | 96.6 | Very high | 97.4 | Very high | 168 Ų | 168 | 73.7 Ų | 73.7 | 73% | 0.73 | 35% | 0.352 | S | S | * | . | H | α-helix | trans | -61.9 | -41.9 | 178.6 | -71.3 | 179 | 178.2 | -176.7 | 0 | 112.6 | Q179 L180 | Q179-K183 WeakPolarHBondContact O-CG 3.34Å; Q179-K183 PolarHBondContact O-N 3.11Å; Q179-K183 VanDerWaalsContact O-N 3.15Å; L180-K183 WeakPolarHBondContact O-CA 3.29Å; L180-K183 WeakPolarHBondContact O-CB 3.38Å; L180-K183 PolarHBondContact O-N 3.47Å |
| 184 | V | 96.4 | Very high | 97.4 | Very high | 15 Ų | 15 | 69.7 Ų | 69.7 | 9% | 0.091 | 33% | 0.328 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -95.6 | 7.8 | -175.8 | -59 | 0 | 0 | 0 | 0 | 113.8 | Q158 A161 L180 L186 | Q158-V184 HydrophobicContact CB-CB 4.5Å; Q158-V184 HydrophobicContact CG-CB 4.11Å; Q158-V184 PolarHBondContact NE2-O 3.35Å; A161-V184 HydrophobicContact CB-CG1 3.58Å; L180-V184 HydrophobicContact CD1-CG1 4.01Å; L180-V184 WeakPolarHBondContact O-CG2 3.48Å; L180-V184 PolarHBondContact O-N 3.38Å; V184-L186 VanDerWaalsContact C-N 3.31Å; V184-L186 HydrophobicContact CG2-CB 4Å; V184-L186 HydrophobicContact CG2-CD1 3.64Å; V184-L186 HydrophobicContact CG2-CG 3.79Å; V184-L186 PolarHBondContact O-N 3.33Å |
| 185 | H | 97.1 | Very high | 97.4 | Very high | 173 Ų | 173 | 66.6 Ų | 66.6 | 80% | 0.801 | 31% | 0.31 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 52.6 | 42.3 | -177.5 | -59.4 | -72.7 | 0 | 0 | 0 | 114.4 | A181 R182 | A181-H185 WeakPolarHBondContact O-CA 3.46Å; A181-H185 PolarHBondContact O-N 3.37Å; R182-H185 PolarHBondContact O-N 3.24Å |
| 186 | L | 96 | Very high | 97.4 | Very high | 31 Ų | 31 | 70.3 Ų | 70.3 | 16% | 0.162 | 32% | 0.317 | C | S | . | . | trans | -113.6 | 161.1 | 175.8 | -65.3 | 175.6 | 0 | 0 | 0 | 111.2 | F154 A181 V184 V191 | F154-L186 HydrophobicContact CD1-CD1 3.64Å; F154-L186 HydrophobicContact CD1-CD2 4.29Å; F154-L186 HydrophobicContact CE1-CD1 3.62Å; F154-L186 HydrophobicContact CE1-CD2 4.28Å; A181-L186 CarbonylContact C-O 3.58Å; A181-L186 WeakPolarHBondContact CB-O 3.32Å; A181-L186 PolarHBondContact O-N 3.25Å; V184-L186 VanDerWaalsContact C-N 3.31Å; V184-L186 HydrophobicContact CG2-CB 4Å; V184-L186 HydrophobicContact CG2-CD1 3.64Å; V184-L186 HydrophobicContact CG2-CG 3.79Å; V184-L186 PolarHBondContact O-N 3.33Å; L186-V191 HydrophobicContact CB-CG2 4.43Å | ||
| 187 | R | 96.6 | Very high | 97.4 | Very high | 159 Ų | 159 | 72.8 Ų | 72.8 | 60% | 0.6 | 33% | 0.329 | S | S | * | . | trans | -73.7 | 142.3 | 165.8 | -68.9 | -172.9 | -78.3 | 149.9 | -9.2 | 109.7 | E189 K190 V191 | R187-E189 IonicContact NH1-OE2 3.31Å; R187-E189 PolarHBondContact NH1-OE2 3.49Å; R187-E189 PolarHBondContact O-N 3.36Å; R187-K190 HydrophobicContact CB-CG 4.29Å; R187-K190 WeakPolarHBondContact O-CA 3.22Å; R187-K190 WeakPolarHBondContact O-CB 3.4Å; R187-K190 PolarHBondContact O-N 3.19Å; R187-V191 PolarHBondContact O-N 2.84Å | ||
| 188 | E | 97.6 | Very high | 97.4 | Very high | 51 Ų | 51 | 73.5 Ų | 73.5 | 24% | 0.238 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -51.8 | -41.8 | 176.8 | -173 | -78.9 | 164.4 | 0 | 0 | 111.7 | R177 E178 A181 K190 V191 E192 | R177-E188 HydrophobicContact CB-CG 4.17Å; R177-E188 IonicContact CZ-OE1 3.63Å; R177-E188 IonicContact NE-OE1 2.72Å; R177-E188 PolarHBondContact NE-OE1 2.99Å; R177-E188 IonicContact NH1-OE1 2.99Å; R177-E188 IonicContact NH2-OE1 3.41Å; R177-E188 PolarHBondContact NH2-OE1 2.97Å; E178-E188 HydrophobicContact CG-CB 4.42Å; E178-E188 HydrophobicContact CG-CG 3.87Å; A181-E188 HydrophobicContact CB-CB 4.39Å; E188-K190 PolarHBondContact O-N 3.21Å; E188-K190 VanDerWaalsContact O-N 3.1Å; E188-V191 CarbonylContact O-C 3.51Å; E188-V191 WeakPolarHBondContact O-CA 2.86Å; E188-V191 WeakPolarHBondContact O-CB 3.13Å; E188-V191 PolarHBondContact O-N 2.94Å; E188-E192 PolarHBondContact O-N 3.12Å |
| 189 | E | 97 | Very high | 97.3 | Very high | 91 Ų | 91 | 71.3 Ų | 71.3 | 43% | 0.425 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -53.9 | -35.9 | 176.3 | -170.9 | -167.4 | 176.9 | 0 | 0 | 112.5 | R187 E192 V193 | R187-E189 IonicContact NH1-OE2 3.31Å; R187-E189 PolarHBondContact NH1-OE2 3.49Å; R187-E189 PolarHBondContact O-N 3.36Å; E189-E192 PolarHBondContact O-N 2.94Å; E189-V193 VanDerWaalsContact O-CG2 3.28Å; E189-V193 WeakPolarHBondContact O-CG2 3Å; E189-V193 PolarHBondContact O-N 3.19Å |
| 190 | K | 97 | Very high | 97.3 | Very high | 48 Ų | 48 | 66.8 Ų | 66.8 | 21% | 0.209 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -71.4 | -39.1 | 178.1 | -61.9 | -64.8 | 178.5 | 171.1 | 0 | 111.4 | T152 F154 R187 E188 V193 W194 | T152-K190 VanDerWaalsContact OG1-CE 3.23Å; T152-K190 WeakPolarHBondContact OG1-CE 3.32Å; T152-K190 PolarHBondContact OG1-NZ 3.2Å; F154-K190 HydrophobicContact CE1-CB 4.31Å; F154-K190 HydrophobicContact CZ-CB 4.49Å; R187-K190 HydrophobicContact CB-CG 4.29Å; R187-K190 WeakPolarHBondContact O-CA 3.22Å; R187-K190 WeakPolarHBondContact O-CB 3.4Å; R187-K190 PolarHBondContact O-N 3.19Å; E188-K190 PolarHBondContact O-N 3.21Å; E188-K190 VanDerWaalsContact O-N 3.1Å; K190-V193 PolarHBondContact O-N 3.23Å; K190-W194 WeakPolarHBondContact O-CB 3.2Å; K190-W194 PolarHBondContact O-N 3.45Å |
| 191 | V | 97.4 | Very high | 97.2 | Very high | 0 Ų | 0 | 71.6 Ų | 71.6 | 0% | 0 | 32% | 0.321 | C | S | . | . | H | α-helix | trans | -63.6 | -46.5 | 173.3 | -179.1 | 0 | 0 | 0 | 0 | 109.7 | L162 R177 L180 A181 L186 R187 E188 V193 W194 F195 | L162-V191 HydrophobicContact CD2-CB 4.49Å; L162-V191 HydrophobicContact CD2-CG1 3.93Å; L162-V191 HydrophobicContact CD2-CG2 4.33Å; R177-V191 HydrophobicContact CB-CG1 4.19Å; R177-V191 HydrophobicContact CG-CG1 4.21Å; L180-V191 HydrophobicContact CD2-CG1 4.12Å; A181-V191 HydrophobicContact CB-CG2 3.89Å; L186-V191 HydrophobicContact CB-CG2 4.43Å; R187-V191 PolarHBondContact O-N 2.84Å; E188-V191 CarbonylContact O-C 3.51Å; E188-V191 WeakPolarHBondContact O-CA 2.86Å; E188-V191 WeakPolarHBondContact O-CB 3.13Å; E188-V191 PolarHBondContact O-N 2.94Å; V191-V193 PolarHBondContact O-N 2.68Å; V191-W194 WeakPolarHBondContact O-CB 3.42Å; V191-W194 PolarHBondContact O-N 2.86Å; V191-F195 HydrophobicContact CG1-CD2 3.74Å; V191-F195 HydrophobicContact CG1-CE2 3.77Å; V191-F195 WeakPolarHBondContact O-CD2 3.19Å; V191-F195 PolarHBondContact O-N 3.37Å |
| 192 | E | 97.8 | Very high | 97 | Very high | 56 Ų | 56 | 75.7 Ų | 75.7 | 26% | 0.262 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -53.9 | -53.6 | 175 | 171.1 | 168.8 | 153.4 | 0 | 0 | 112 | R177 E188 E189 W194 F195 K196 | R177-E192 IonicContact CZ-OE2 3.44Å; R177-E192 VanDerWaalsContact NH1-CG 3.32Å; R177-E192 IonicContact NH1-OE2 2.72Å; R177-E192 PolarHBondContact NH1-OE2 3.47Å; R177-E192 IonicContact NH2-OE2 3.38Å; R177-E192 PolarHBondContact NH2-OE2 3.22Å; E188-E192 PolarHBondContact O-N 3.12Å; E189-E192 PolarHBondContact O-N 2.94Å; E192-W194 VanDerWaalsContact C-N 3.26Å; E192-W194 PolarHBondContact O-N 3.45Å; E192-F195 PolarHBondContact O-N 3.12Å; E192-K196 HydrophobicContact CG-CD 3.7Å; E192-K196 HydrophobicContact CG-CG 4.48Å; E192-K196 WeakPolarHBondContact O-CG 3.41Å; E192-K196 PolarHBondContact O-N 3.05Å; E192-K196 IonicContact OE1-NZ 2.97Å; E192-K196 PolarHBondContact OE1-NZ 2.97Å |
| 193 | V | 97.2 | Very high | 96.9 | Very high | 65 Ų | 65 | 74.3 Ų | 74.3 | 39% | 0.394 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -62.7 | -38.2 | -177.4 | 171.5 | 0 | 0 | 0 | 0 | 110.5 | E189 K190 V191 K196 N197 | E189-V193 VanDerWaalsContact O-CG2 3.28Å; E189-V193 WeakPolarHBondContact O-CG2 3Å; E189-V193 PolarHBondContact O-N 3.19Å; K190-V193 PolarHBondContact O-N 3.23Å; V191-V193 PolarHBondContact O-N 2.68Å; V193-K196 PolarHBondContact O-N 3.2Å; V193-N197 WeakPolarHBondContact O-CB 3.47Å; V193-N197 PolarHBondContact O-N 3.29Å; V193-N197 PolarHBondContact O-ND2 3.02Å |
| 194 | W | 97.6 | Very high | 96.6 | Very high | 28 Ų | 28 | 74.6 Ų | 74.6 | 11% | 0.106 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -60.5 | -49.4 | 174.8 | -172.8 | 100 | 0 | 0 | 0 | 111.3 | F154 L162 F166 K190 V191 E192 K196 N197 R198 | F154-W194 AromaticContact CD2-CD1 3.84Å; F154-W194 AromaticContact CE2-CD1 3.57Å; F154-W194 HydrophobicContact CE2-CG 4.43Å; F154-W194 HydrophobicContact CZ-CB 4.38Å; L162-W194 HydrophobicContact CB-CD2 4.01Å; L162-W194 HydrophobicContact CB-CE3 4Å; L162-W194 HydrophobicContact CB-CH2 3.76Å; L162-W194 HydrophobicContact CB-CZ2 3.72Å; L162-W194 HydrophobicContact CB-CZ3 3.89Å; L162-W194 HydrophobicContact CD1-CD2 4Å; L162-W194 HydrophobicContact CD1-CG 3.94Å; L162-W194 HydrophobicContact CD2-CD2 4.06Å; L162-W194 HydrophobicContact CD2-CE3 3.95Å; L162-W194 HydrophobicContact CD2-CG 4.33Å; L162-W194 HydrophobicContact CG-CD2 4.27Å; L162-W194 HydrophobicContact CG-CE3 4.43Å; F166-W194 HydrophobicContact CB-CH2 4.16Å; F166-W194 HydrophobicContact CB-CZ3 4.05Å; F166-W194 HydrophobicContact CD2-CZ3 4.38Å; F166-W194 HydrophobicContact CG-CZ3 4.41Å; K190-W194 WeakPolarHBondContact O-CB 3.2Å; K190-W194 PolarHBondContact O-N 3.45Å; V191-W194 WeakPolarHBondContact O-CB 3.42Å; V191-W194 PolarHBondContact O-N 2.86Å; E192-W194 VanDerWaalsContact C-N 3.26Å; E192-W194 PolarHBondContact O-N 3.45Å; W194-K196 VanDerWaalsContact C-N 3.34Å; W194-K196 PolarHBondContact O-N 3.48Å; W194-N197 PolarHBondContact O-N 3.21Å; W194-N197 VanDerWaalsContact O-N 3.16Å; W194-R198 HydrophobicContact CD2-CB 4.46Å; W194-R198 HydrophobicContact CE3-CB 4.05Å; W194-R198 HydrophobicContact CH2-CB 4.05Å; W194-R198 HydrophobicContact CH2-CG 3.7Å; W194-R198 HydrophobicContact CZ2-CB 4.47Å; W194-R198 HydrophobicContact CZ2-CG 4.31Å; W194-R198 HydrophobicContact CZ3-CB 3.83Å; W194-R198 HydrophobicContact CZ3-CG 3.85Å; W194-R198 WeakPolarHBondContact O-CB 3.27Å; W194-R198 PolarHBondContact O-N 2.76Å |
| 195 | F | 98.3 | Very high | 96.3 | Very high | 2 Ų | 2 | 78.4 Ų | 78.4 | 1% | 0.009 | 34% | 0.343 | C | S | . | . | H | α-helix | trans | -61.8 | -39.2 | 178.9 | -91 | -91.6 | 0 | 0 | 0 | 112.4 | L162 L165 F166 P172 L180 V191 E192 R198 R199 | L162-F195 HydrophobicContact CD2-CE2 4.03Å; L165-F195 HydrophobicContact CB-CZ 4.19Å; L165-F195 HydrophobicContact CD2-CE2 4.29Å; L165-F195 HydrophobicContact CD2-CZ 3.83Å; L165-F195 HydrophobicContact CG-CZ 4.03Å; F166-F195 HydrophobicContact CB-CE1 4.03Å; F166-F195 HydrophobicContact CB-CZ 4.38Å; F166-F195 AromaticContact CD2-CD1 3.79Å; F166-F195 HydrophobicContact CD2-CD1 3.79Å; F166-F195 AromaticContact CD2-CE1 3.72Å; F166-F195 HydrophobicContact CD2-CE1 3.72Å; F166-F195 HydrophobicContact CE2-CD1 4.48Å; F166-F195 HydrophobicContact CG-CE1 4.38Å; P172-F195 VanDerWaalsContact CD-CD1 3.44Å; P172-F195 VanDerWaalsContact CD-CE1 3.48Å; P172-F195 HydrophobicContact CG-CD1 3.62Å; P172-F195 HydrophobicContact CG-CD2 4.17Å; P172-F195 HydrophobicContact CG-CE1 3.47Å; P172-F195 VanDerWaalsContact CG-CE1 3.47Å; P172-F195 HydrophobicContact CG-CE2 4.06Å; P172-F195 HydrophobicContact CG-CG 3.99Å; P172-F195 HydrophobicContact CG-CZ 3.73Å; L180-F195 HydrophobicContact CD2-CE2 4.25Å; V191-F195 HydrophobicContact CG1-CD2 3.74Å; V191-F195 HydrophobicContact CG1-CE2 3.77Å; V191-F195 WeakPolarHBondContact O-CD2 3.19Å; V191-F195 PolarHBondContact O-N 3.37Å; E192-F195 PolarHBondContact O-N 3.12Å; F195-R198 PolarHBondContact O-N 3.32Å; F195-R199 WeakPolarHBondContact O-CB 3.45Å; F195-R199 WeakPolarHBondContact O-CG 3.45Å; F195-R199 PolarHBondContact O-N 2.79Å |
| 196 | K | 97.9 | Very high | 95.6 | Very high | 106 Ų | 106 | 76.4 Ų | 76.4 | 46% | 0.461 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -61.2 | -46.9 | 174.2 | -73.3 | 163.8 | 99.1 | 164.1 | 0 | 111.5 | E192 V193 W194 A200 | E192-K196 HydrophobicContact CG-CD 3.7Å; E192-K196 HydrophobicContact CG-CG 4.48Å; E192-K196 WeakPolarHBondContact O-CG 3.41Å; E192-K196 PolarHBondContact O-N 3.05Å; E192-K196 IonicContact OE1-NZ 2.97Å; E192-K196 PolarHBondContact OE1-NZ 2.97Å; V193-K196 PolarHBondContact O-N 3.2Å; W194-K196 VanDerWaalsContact C-N 3.34Å; W194-K196 PolarHBondContact O-N 3.48Å; K196-A200 WeakPolarHBondContact O-CB 3.43Å; K196-A200 PolarHBondContact O-N 2.77Å |
| 197 | N | 97.4 | Very high | 94.7 | Very high | 105 Ų | 105 | 84.1 Ų | 84.1 | 56% | 0.561 | 36% | 0.359 | S | S | * | . | H | α-helix | trans | -66.1 | -40.6 | 178 | -73.8 | -25.2 | 0 | 0 | 0 | 112 | V193 W194 A200 K201 | V193-N197 WeakPolarHBondContact O-CB 3.47Å; V193-N197 PolarHBondContact O-N 3.29Å; V193-N197 PolarHBondContact O-ND2 3.02Å; W194-N197 PolarHBondContact O-N 3.21Å; W194-N197 VanDerWaalsContact O-N 3.16Å; N197-A200 WeakPolarHBondContact O-CB 3.12Å; N197-A200 PolarHBondContact O-N 3.48Å; N197-K201 PolarHBondContact O-N 3.17Å |
| 198 | R | 97.7 | Very high | 93.5 | Very high | 51 Ų | 51 | 78.6 Ų | 78.6 | 19% | 0.192 | 35% | 0.345 | C | S | . | . | H | α-helix | trans | -62.6 | -46.5 | 178.6 | -173.8 | 65 | -176.9 | 119.6 | -5.5 | 111.4 | E163 F166 W194 F195 A200 K201 W202 | E163-R198 IonicContact OE1-CZ 3.81Å; E163-R198 IonicContact OE1-NE 3.43Å; E163-R198 PolarHBondContact OE1-NE 3.47Å; E163-R198 IonicContact OE1-NH2 2.86Å; E163-R198 PolarHBondContact OE1-NH2 3.45Å; E163-R198 IonicContact OE2-CZ 2.69Å; E163-R198 IonicContact OE2-NE 3.41Å; E163-R198 PolarHBondContact OE2-NE 3.03Å; E163-R198 IonicContact OE2-NH2 3.04Å; E163-R198 PolarHBondContact OE2-NH2 3.1Å; F166-R198 HydrophobicContact CD1-CG 3.87Å; F166-R198 HydrophobicContact CD2-CB 4.33Å; F166-R198 HydrophobicContact CD2-CG 3.71Å; F166-R198 HydrophobicContact CE1-CG 3.79Å; F166-R198 HydrophobicContact CE2-CB 4.15Å; F166-R198 HydrophobicContact CE2-CG 3.63Å; F166-R198 HydrophobicContact CG-CG 3.84Å; F166-R198 HydrophobicContact CZ-CG 3.67Å; W194-R198 HydrophobicContact CD2-CB 4.46Å; W194-R198 HydrophobicContact CE3-CB 4.05Å; W194-R198 HydrophobicContact CH2-CB 4.05Å; W194-R198 HydrophobicContact CH2-CG 3.7Å; W194-R198 HydrophobicContact CZ2-CB 4.47Å; W194-R198 HydrophobicContact CZ2-CG 4.31Å; W194-R198 HydrophobicContact CZ3-CB 3.83Å; W194-R198 HydrophobicContact CZ3-CG 3.85Å; W194-R198 WeakPolarHBondContact O-CB 3.27Å; W194-R198 PolarHBondContact O-N 2.76Å; F195-R198 PolarHBondContact O-N 3.32Å; R198-A200 VanDerWaalsContact C-N 3.33Å; R198-A200 PolarHBondContact O-N 3.46Å; R198-K201 PolarHBondContact O-N 2.87Å; R198-W202 PolarHBondContact O-N 3.25Å |
| 199 | R | 97.5 | Very high | 91.7 | Very high | 47 Ų | 47 | 80.2 Ų | 80.2 | 18% | 0.177 | 36% | 0.362 | C | S | . | . | H | α-helix | trans | -61.4 | -38.8 | 173.2 | -73.3 | -164.8 | -63.8 | -89.4 | 3.6 | 112.7 | F166 K170 F195 W202 R203 | F166-R199 HydrophobicContact CE2-CG 3.82Å; F166-R199 HydrophobicContact CZ-CG 4.33Å; K170-R199 WeakPolarHBondContact O-CD 3.33Å; K170-R199 PolarHBondContact O-NH1 3.12Å; F195-R199 WeakPolarHBondContact O-CB 3.45Å; F195-R199 WeakPolarHBondContact O-CG 3.45Å; F195-R199 PolarHBondContact O-N 2.79Å; R199-W202 PolarHBondContact O-N 3.16Å; R199-R203 WeakPolarHBondContact O-CG 3.43Å; R199-R203 PolarHBondContact O-N 3.03Å |
| 200 | A | 96.9 | Very high | 89.9 | Confident | 14 Ų | 14 | 80.1 Ų | 80.1 | 12% | 0.116 | 37% | 0.371 | C | S | . | . | H | α-helix | trans | -62.6 | -42.6 | 175.8 | 0 | 0 | 0 | 0 | 0 | 111.7 | K196 N197 R198 R204 | K196-A200 WeakPolarHBondContact O-CB 3.43Å; K196-A200 PolarHBondContact O-N 2.77Å; N197-A200 WeakPolarHBondContact O-CB 3.12Å; N197-A200 PolarHBondContact O-N 3.48Å; R198-A200 VanDerWaalsContact C-N 3.33Å; R198-A200 PolarHBondContact O-N 3.46Å; A200-R204 WeakPolarHBondContact O-CG 3.08Å; A200-R204 PolarHBondContact O-N 2.94Å; A200-R204 VanDerWaalsContact O-N 3.15Å |
| 201 | K | 95.4 | Very high | 88 | Confident | 116 Ų | 116 | 83.6 Ų | 83.6 | 50% | 0.504 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -62.3 | -45.2 | 173.9 | -174.2 | 177.9 | 178.6 | -176.1 | 0 | 111.5 | N197 R198 R203 R204 Q205 | N197-K201 PolarHBondContact O-N 3.17Å; R198-K201 PolarHBondContact O-N 2.87Å; K201-R203 PolarHBondContact O-N 3.45Å; K201-R204 PolarHBondContact O-N 3.3Å; K201-R204 VanDerWaalsContact O-N 3.16Å; K201-Q205 PolarHBondContact O-N 3.05Å |
| 202 | W | 94.4 | Very high | 86 | Confident | 92 Ų | 92 | 89 Ų | 89 | 35% | 0.348 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -59.8 | -43.7 | 178.8 | 179.3 | 81.9 | 0 | 0 | 0 | 112.7 | F166 R198 R199 R204 Q205 K206 | F166-W202 HydrophobicContact CZ-CB 4.46Å; R198-W202 PolarHBondContact O-N 3.25Å; R199-W202 PolarHBondContact O-N 3.16Å; W202-R204 VanDerWaalsContact C-N 3.33Å; W202-R204 PolarHBondContact O-N 3.19Å; W202-Q205 PolarHBondContact O-N 2.96Å; W202-K206 HydrophobicContact CH2-CD 3.97Å; W202-K206 VanDerWaalsContact CH2-NZ 3.28Å; W202-K206 HydrophobicContact CZ2-CD 3.87Å; W202-K206 HydrophobicContact CZ3-CD 4.33Å; W202-K206 PolarHBondContact O-N 3.17Å; W202-K206 VanDerWaalsContact O-N 3.16Å |
| 203 | R | 94.7 | Very high | 83.8 | Confident | 143 Ų | 143 | 89.7 Ų | 89.7 | 54% | 0.54 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -63.7 | -37 | 175 | -73.8 | -174.4 | -69.8 | 104.8 | -4.4 | 112.8 | R199 K201 R207 | R199-R203 WeakPolarHBondContact O-CG 3.43Å; R199-R203 PolarHBondContact O-N 3.03Å; K201-R203 PolarHBondContact O-N 3.45Å; R203-R207 PolarHBondContact O-N 3.29Å |
| 204 | R | 91.5 | Very high | 81.8 | Confident | 174 Ų | 174 | 93.6 Ų | 93.6 | 66% | 0.657 | 44% | 0.438 | S | S | * | . | H | α-helix | trans | -66.3 | -44.8 | 176.3 | -72.7 | 178.6 | -177.1 | 115.4 | -2.7 | 111.6 | A200 K201 W202 K206 R207 S208 | A200-R204 WeakPolarHBondContact O-CG 3.08Å; A200-R204 PolarHBondContact O-N 2.94Å; A200-R204 VanDerWaalsContact O-N 3.15Å; K201-R204 PolarHBondContact O-N 3.3Å; K201-R204 VanDerWaalsContact O-N 3.16Å; W202-R204 VanDerWaalsContact C-N 3.33Å; W202-R204 PolarHBondContact O-N 3.19Å; R204-K206 VanDerWaalsContact C-N 3.3Å; R204-K206 PolarHBondContact O-N 3.1Å; R204-R207 PolarHBondContact O-N 3.27Å; R204-R207 VanDerWaalsContact O-N 3.1Å; R204-S208 PolarHBondContact O-N 2.97Å; R204-S208 PolarHBondContact O-OG 2.86Å |
| 205 | Q | 88.8 | Confident | 79.7 | Confident | 95 Ų | 95 | 97.1 Ų | 97.1 | 44% | 0.444 | 46% | 0.459 | S | S | . | . | H | α-helix | trans | -60.1 | -38.5 | 178 | -76.9 | 177.2 | -22.7 | 0 | 0 | 112.7 | K201 W202 R207 S208 S209 | K201-Q205 PolarHBondContact O-N 3.05Å; W202-Q205 PolarHBondContact O-N 2.96Å; Q205-R207 VanDerWaalsContact C-N 3.3Å; Q205-R207 PolarHBondContact O-N 2.97Å; Q205-S208 PolarHBondContact O-OG 2.93Å; Q205-S209 WeakPolarHBondContact O-CB 3.48Å; Q205-S209 PolarHBondContact O-N 2.82Å |
| 206 | K | 82.3 | Confident | 77.7 | Confident | 130 Ų | 130 | 99.9 Ų | 99.9 | 57% | 0.565 | 48% | 0.479 | S | S | * | . | H | α-helix | trans | -64.2 | -32.1 | 175.2 | -84.6 | -170.6 | 166 | -172.5 | 0 | 113.9 | W202 R204 | W202-K206 HydrophobicContact CH2-CD 3.97Å; W202-K206 VanDerWaalsContact CH2-NZ 3.28Å; W202-K206 HydrophobicContact CZ2-CD 3.87Å; W202-K206 HydrophobicContact CZ3-CD 4.33Å; W202-K206 PolarHBondContact O-N 3.17Å; W202-K206 VanDerWaalsContact O-N 3.16Å; R204-K206 VanDerWaalsContact C-N 3.3Å; R204-K206 PolarHBondContact O-N 3.1Å |
| 207 | R | 78.1 | Confident | 75.6 | Confident | 193 Ų | 193 | 101.2 Ų | 101.2 | 73% | 0.728 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -79.2 | -43.5 | 177.1 | -103 | 168.6 | 161.6 | -144.6 | -2 | 112 | R203 R204 Q205 S209 S210 | R203-R207 PolarHBondContact O-N 3.29Å; R204-R207 PolarHBondContact O-N 3.27Å; R204-R207 VanDerWaalsContact O-N 3.1Å; Q205-R207 VanDerWaalsContact C-N 3.3Å; Q205-R207 PolarHBondContact O-N 2.97Å; R207-S209 VanDerWaalsContact C-N 3.27Å; R207-S209 PolarHBondContact O-N 2.86Å; R207-S210 PolarHBondContact O-N 3.44Å |
| 208 | S | 70.7 | Confident | 73.4 | Confident | 44 Ų | 44 | 103.8 Ų | 103.8 | 31% | 0.308 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -66.4 | -30.2 | 178.7 | 64.7 | 0 | 0 | 0 | 0 | 112.2 | R204 Q205 S210 E211 E212 | R204-S208 PolarHBondContact O-N 2.97Å; R204-S208 PolarHBondContact O-OG 2.86Å; Q205-S208 PolarHBondContact O-OG 2.93Å; S208-S210 PolarHBondContact O-N 3.25Å; S208-S210 VanDerWaalsContact O-N 3.12Å; S208-E211 PolarHBondContact O-N 3.24Å; S208-E212 VanDerWaalsContact O-CB 3.27Å; S208-E212 WeakPolarHBondContact O-CB 3.26Å; S208-E212 PolarHBondContact O-N 3.27Å |
| 209 | S | 60.7 | Low | 71.1 | Confident | 85 Ų | 85 | 111.1 Ų | 111.1 | 59% | 0.594 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -59.4 | -23.4 | 174.6 | -172.1 | 0 | 0 | 0 | 0 | 114.1 | Q205 R207 | Q205-S209 WeakPolarHBondContact O-CB 3.48Å; Q205-S209 PolarHBondContact O-N 2.82Å; R207-S209 VanDerWaalsContact C-N 3.27Å; R207-S209 PolarHBondContact O-N 2.86Å |
| 210 | S | 58.8 | Low | 69.1 | Low | 88 Ų | 88 | 112.5 Ų | 112.5 | 62% | 0.615 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -88.5 | -21.2 | 173.3 | -71.8 | 0 | 0 | 0 | 0 | 113.4 | R207 S208 S213 | R207-S210 PolarHBondContact O-N 3.44Å; S208-S210 PolarHBondContact O-N 3.25Å; S208-S210 VanDerWaalsContact O-N 3.12Å; S210-S213 PolarHBondContact O-OG 2.89Å |
| 211 | E | 57.4 | Low | 67.1 | Low | 121 Ų | 121 | 119.6 Ų | 119.6 | 57% | 0.565 | 57% | 0.566 | S | S | * | * | H | α-helix | trans | -98.8 | -25.1 | -177.3 | -65 | 170.2 | -176.4 | 0 | 0 | 112.3 | S208 S213 E214 N215 | S208-E211 PolarHBondContact O-N 3.24Å; E211-S213 VanDerWaalsContact C-N 3.3Å; E211-S213 PolarHBondContact O-N 3.26Å; E211-E214 PolarHBondContact O-N 2.97Å; E211-N215 PolarHBondContact O-N 3.49Å; E211-N215 VanDerWaalsContact O-N 3.15Å |
| 212 | E | 54.5 | Low | 65 | Low | 115 Ų | 115 | 121.4 Ų | 121.4 | 54% | 0.537 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -67.3 | -30.7 | 179.4 | -161.4 | 94.8 | -136.2 | 0 | 0 | 111.9 | S208 S216 | S208-E212 VanDerWaalsContact O-CB 3.27Å; S208-E212 WeakPolarHBondContact O-CB 3.26Å; S208-E212 PolarHBondContact O-N 3.27Å; E212-S216 VanDerWaalsContact O-CB 3.32Å; E212-S216 WeakPolarHBondContact O-CB 3.22Å; E212-S216 PolarHBondContact O-N 3.37Å; E212-S216 PolarHBondContact O-OG 3.33Å |
| 213 | S | 52.8 | Low | 63.2 | Low | 69 Ų | 69 | 119.8 Ų | 119.8 | 48% | 0.483 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -68.8 | -34.3 | 177.2 | 20.9 | 0 | 0 | 0 | 0 | 112.3 | S210 E211 | S210-S213 PolarHBondContact O-OG 2.89Å; E211-S213 VanDerWaalsContact C-N 3.3Å; E211-S213 PolarHBondContact O-N 3.26Å |
| 214 | E | 55.2 | Low | 61.2 | Low | 147 Ų | 147 | 120.9 Ų | 120.9 | 69% | 0.687 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -81.3 | -35 | 176.6 | -63.5 | -176.2 | 150.5 | 0 | 0 | 112.4 | E211 | E211-E214 PolarHBondContact O-N 2.97Å |
| 215 | N | 52.8 | Low | 59.2 | Low | 102 Ų | 102 | 121.4 Ų | 121.4 | 55% | 0.545 | 60% | 0.598 | S | S | . | * | H | α-helix | trans | -77 | -34.8 | -177.8 | -168.3 | 44 | 0 | 0 | 0 | 113.2 | E211 Q217 K218 W219 | E211-N215 PolarHBondContact O-N 3.49Å; E211-N215 VanDerWaalsContact O-N 3.15Å; N215-Q217 VanDerWaalsContact C-N 3.34Å; N215-Q217 PolarHBondContact O-N 3.48Å; N215-K218 PolarHBondContact O-N 3.1Å; N215-W219 PolarHBondContact O-N 2.77Å |
| 216 | S | 55.3 | Low | 57.5 | Low | 61 Ų | 61 | 122.6 Ų | 122.6 | 43% | 0.427 | 61% | 0.612 | S | S | . | * | H | α-helix | trans | -64.9 | -36.6 | 178.4 | -61.3 | 0 | 0 | 0 | 0 | 112.3 | E212 K218 W219 S220 | E212-S216 VanDerWaalsContact O-CB 3.32Å; E212-S216 WeakPolarHBondContact O-CB 3.22Å; E212-S216 PolarHBondContact O-N 3.37Å; E212-S216 PolarHBondContact O-OG 3.33Å; S216-K218 VanDerWaalsContact C-N 3.33Å; S216-K218 PolarHBondContact O-N 3.08Å; S216-W219 PolarHBondContact O-N 3.31Å; S216-S220 PolarHBondContact O-N 2.86Å; S216-S220 PolarHBondContact O-OG 3.03Å |
| 217 | Q | 55.7 | Low | 55.8 | Low | 134 Ų | 134 | 123.6 Ų | 123.6 | 63% | 0.626 | 62% | 0.624 | S | S | * | * | H | α-helix | trans | -68.3 | -31.3 | 175.4 | -68.1 | -176.3 | -54.4 | 0 | 0 | 113 | N215 K221 | N215-Q217 VanDerWaalsContact C-N 3.34Å; N215-Q217 PolarHBondContact O-N 3.48Å; Q217-K221 PolarHBondContact O-N 3.49Å; Q217-K221 VanDerWaalsContact O-N 3.17Å |
| 218 | K | 50.7 | Low | 54.5 | Low | 159 Ų | 159 | 117.7 Ų | 117.7 | 69% | 0.691 | 62% | 0.622 | S | S | * | * | H | α-helix | trans | -73.6 | -34.6 | 179.3 | -168.1 | 176.1 | -176.5 | 175.2 | 0 | 112.4 | N215 S216 | N215-K218 PolarHBondContact O-N 3.1Å; S216-K218 VanDerWaalsContact C-N 3.33Å; S216-K218 PolarHBondContact O-N 3.08Å |
| 219 | W | 49.7 | Very low | 53.6 | Low | 204 Ų | 204 | 122 Ų | 122 | 77% | 0.773 | 65% | 0.648 | S | S | * | * | H | α-helix | trans | -72.5 | -42.5 | 175.2 | -168.6 | -92.5 | 0 | 0 | 0 | 111.6 | N215 S216 K222 A223 | N215-W219 PolarHBondContact O-N 2.77Å; S216-W219 PolarHBondContact O-N 3.31Å; W219-K222 PolarHBondContact O-N 3.44Å; W219-A223 PolarHBondContact O-N 2.97Å |
| 220 | S | 55.7 | Low | 52.8 | Low | 77 Ų | 77 | 128 Ų | 128 | 54% | 0.538 | 66% | 0.663 | S | S | . | * | H | α-helix | trans | -64.3 | -42.5 | 177.7 | -64.7 | 0 | 0 | 0 | 0 | 113.5 | S216 K222 A223 E224 | S216-S220 PolarHBondContact O-N 2.86Å; S216-S220 PolarHBondContact O-OG 3.03Å; S220-K222 PolarHBondContact O-N 3.09Å; S220-A223 PolarHBondContact O-N 3.09Å; S220-E224 PolarHBondContact O-N 3.41Å |
| 221 | K | 53.9 | Low | 52.2 | Low | 162 Ų | 162 | 128.5 Ų | 128.5 | 70% | 0.704 | 67% | 0.666 | S | S | * | * | H | α-helix | trans | -65.2 | -22.1 | 176.2 | -85.7 | 179.1 | 175.5 | 165.9 | 0 | 114.4 | Q217 | Q217-K221 PolarHBondContact O-N 3.49Å; Q217-K221 VanDerWaalsContact O-N 3.17Å |
| 222 | K | 52.2 | Low | 51.9 | Low | 155 Ų | 155 | 131.5 Ų | 131.5 | 67% | 0.674 | 68% | 0.68 | S | S | * | * | H | α-helix | trans | -83.1 | -27.6 | 179.8 | -156.5 | 177.9 | -176 | -176.1 | 0 | 112 | W219 S220 | W219-K222 PolarHBondContact O-N 3.44Å; S220-K222 PolarHBondContact O-N 3.09Å |
| 223 | A | 54.9 | Low | 51.8 | Low | 58 Ų | 58 | 130.4 Ų | 130.4 | 48% | 0.479 | 69% | 0.691 | S | S | . | * | H | α-helix | trans | -74.9 | -33.8 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.9 | W219 S220 K225 T226 | W219-A223 PolarHBondContact O-N 2.97Å; S220-A223 PolarHBondContact O-N 3.09Å; A223-K225 VanDerWaalsContact C-N 3.32Å; A223-K225 PolarHBondContact O-N 2.92Å; A223-T226 PolarHBondContact O-OG1 3.18Å; A223-T226 VanDerWaalsContact O-OG1 3.09Å |
| 224 | E | 53.9 | Low | 51.5 | Low | 165 Ų | 165 | 134.3 Ų | 134.3 | 77% | 0.771 | 71% | 0.706 | S | S | * | * | G | 310 helix | trans | -71 | -23.2 | 176 | -81.4 | -177.5 | 136.6 | 0 | 0 | 113.7 | S220 | S220-E224 PolarHBondContact O-N 3.41Š|
| 225 | K | 50.2 | Low | 51.8 | Low | 186 Ų | 186 | 132.9 Ų | 132.9 | 81% | 0.809 | 71% | 0.713 | S | S | * | * | G | 310 helix | trans | -85.1 | -6 | -177.5 | -166.2 | 151.6 | -178.7 | 163.3 | 0 | 114.1 | A223 | A223-K225 VanDerWaalsContact C-N 3.32Å; A223-K225 PolarHBondContact O-N 2.92Å |
| 226 | T | 51.4 | Low | 51.9 | Low | 120 Ų | 120 | 134.8 Ų | 134.8 | 74% | 0.736 | 72% | 0.723 | S | S | * | * | G | 310 helix | trans | -101.8 | -3 | -176.9 | 48.8 | 0 | 0 | 0 | 0 | 114.8 | A223 | A223-T226 PolarHBondContact O-OG1 3.18Å; A223-T226 VanDerWaalsContact O-OG1 3.09Å |
| 227 | D | 47.4 | Very low | 52.1 | Low | 151 Ų | 151 | 140.6 Ų | 140.6 | 81% | 0.807 | 76% | 0.763 | S | S | * | * | S | Bend | trans | -101.3 | -7.5 | -175.9 | -160.7 | -113.3 | 0 | 0 | 0 | 113.9 | ||
| 228 | G | 50.2 | Low | 51.9 | Low | 68 Ų | 68 | 140.9 Ų | 140.9 | 70% | 0.701 | 77% | 0.77 | S | S | * | * | S | Bend | trans | -96.4 | 15.6 | -168.2 | 0 | 0 | 0 | 0 | 0 | 118 | ||
| 229 | T | 51.7 | Low | 51.9 | Low | 136 Ų | 136 | 139.9 Ų | 139.9 | 83% | 0.834 | 77% | 0.774 | S | S | * | * | trans | -147.9 | 79.8 | -179.8 | -42.7 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 230 | K | 44.1 | Very low | 52.1 | Low | 210 Ų | 210 | 136.4 Ų | 136.4 | 91% | 0.913 | 78% | 0.775 | S | S | * | * | trans | -158.1 | 72.6 | 147.5 | -155.6 | 164.1 | -177.2 | 172.4 | 0 | 111.2 | ||||
| 231 | S | 47.1 | Very low | 51.8 | Low | 98 Ų | 98 | 139.9 Ų | 139.9 | 69% | 0.685 | 79% | 0.788 | S | S | * | * | trans | -91.7 | 145.4 | 156.9 | 54.6 | 0 | 0 | 0 | 0 | 109 | ||||
| 232 | E | 51.3 | Low | 51.7 | Low | 184 Ų | 184 | 138.5 Ų | 138.5 | 86% | 0.86 | 79% | 0.794 | S | S | * | * | trans | 90 | 140.1 | 158.6 | -58.8 | 177.7 | 162.1 | 0 | 0 | 119.9 | ||||
| 233 | A | 51.8 | Low | 51.7 | Low | 93 Ų | 93 | 137.4 Ų | 137.4 | 77% | 0.769 | 80% | 0.802 | S | S | * | * | trans | 73.4 | 124.3 | 178.7 | 0 | 0 | 0 | 0 | 0 | 115.2 | ||||
| 234 | D | 45.5 | Very low | 51.5 | Low | 150 Ų | 150 | 143.1 Ų | 143.1 | 80% | 0.802 | 83% | 0.825 | S | S | * | * | cis | -159.9 | 135.9 | 29.8 | -129.5 | -60.2 | 0 | 0 | 0 | 109.1 | ||||
| 235 | S | 61.3 | Low | 51.3 | Low | 118 Ų | 118 | 141.4 Ų | 141.4 | 83% | 0.825 | 83% | 0.829 | S | S | * | * | trans | -116.2 | 107 | 163.3 | -75.6 | 0 | 0 | 0 | 0 | 105.9 | ||||
| 236 | D | 56.8 | Low | 51.4 | Low | 142 Ų | 142 | 137.7 Ų | 137.7 | 76% | 0.759 | 83% | 0.83 | S | S | * | * | trans | -170.8 | 143.2 | 140.7 | -148.1 | -83.8 | 0 | 0 | 0 | 111.7 | ||||
| 237 | S | 57.7 | Low | 51.3 | Low | 182 Ų | 182 | 139.3 Ų | 139.3 | 100% | 1.273 | 84% | 0.839 | S | S | * | * | trans | 75.3 | 0 | 164.1 | -70.8 | 0 | 0 | 0 | 0 | 120.1 |
Retrieved 237 of 237 residues in 140.2 ms
(Link to these results)