| 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 | 41.9 | Very low | 43.8 | Very low | 224 Ų | 224 | 147.6 Ų | 147.6 | 100% | 1.103 | 80% | 0.795 | S | S | * | * | 0 | 98.4 | 0 | -168.3 | 107 | -176.4 | 0 | 0 | 106.6 | |||||
| 2 | F | 42.9 | Very low | 43.4 | Very low | 178 Ų | 178 | 144.3 Ų | 144.3 | 78% | 0.781 | 79% | 0.791 | S | S | * | * | trans | 33.4 | 114.4 | 157.1 | -51.3 | -77 | 0 | 0 | 0 | 120.2 | ||||
| 3 | L | 37.6 | Very low | 43.4 | Very low | 159 Ų | 159 | 147.2 Ų | 147.2 | 83% | 0.832 | 80% | 0.799 | S | S | * | * | 60.9 | 109.6 | 85 | -116.1 | 76.6 | 0 | 0 | 0 | 112 | |||||
| 4 | S | 44.9 | Very low | 43.8 | Very low | 100 Ų | 100 | 151 Ų | 151 | 70% | 0.699 | 81% | 0.809 | S | S | * | * | 136.2 | 150.4 | 83.5 | -76.9 | 0 | 0 | 0 | 0 | 104.5 | |||||
| 5 | D | 39.6 | Very low | 43.3 | Very low | 142 Ų | 142 | 145.1 Ų | 145.1 | 76% | 0.759 | 80% | 0.798 | S | S | * | * | cis | -173 | 118.8 | 44 | -161.6 | 52.5 | 0 | 0 | 0 | 106 | ||||
| 6 | H | 55.3 | Low | 43.5 | Very low | 165 Ų | 165 | 145.3 Ų | 145.3 | 76% | 0.764 | 80% | 0.798 | S | S | * | * | 34.1 | 115.3 | 105.8 | -96.3 | 39.5 | 0 | 0 | 0 | 117.1 | |||||
| 7 | T | 46.2 | Very low | 43.2 | Very low | 144 Ų | 144 | 145 Ų | 145 | 88% | 0.883 | 80% | 0.802 | S | S | * | * | trans | -147.3 | 122.1 | 139.2 | -38.5 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 8 | D | 44.9 | Very low | 43.5 | Very low | 137 Ų | 137 | 141.1 Ų | 141.1 | 73% | 0.733 | 78% | 0.784 | S | S | * | * | trans | -78.9 | 142.7 | 174.5 | -163.7 | -65.2 | 0 | 0 | 0 | 109.9 | ||||
| 9 | A | 46.5 | Very low | 43.4 | Very low | 99 Ų | 99 | 141.1 Ų | 141.1 | 82% | 0.818 | 78% | 0.781 | S | S | * | * | trans | -163.3 | 85.9 | 161.8 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 10 | D | 35.8 | Very low | 43.8 | Very low | 115 Ų | 115 | 139 Ų | 139 | 62% | 0.615 | 78% | 0.783 | S | S | * | * | 25.3 | 129.4 | 129.6 | -148.3 | -123 | 0 | 0 | 0 | 122.4 | |||||
| 11 | Q | 46.4 | Very low | 43.9 | Very low | 161 Ų | 161 | 140.2 Ų | 140.2 | 75% | 0.752 | 78% | 0.782 | S | S | * | * | trans | 38.1 | 126.8 | 142.4 | -69.1 | 167.6 | 55.3 | 0 | 0 | 121.2 | ||||
| 12 | S | 38.6 | Very low | 44.3 | Very low | 108 Ų | 108 | 135.3 Ų | 135.3 | 76% | 0.755 | 76% | 0.76 | S | S | * | * | -179.2 | 132.1 | 114.6 | 36 | 0 | 0 | 0 | 0 | 114.6 | |||||
| 13 | M | 43.1 | Very low | 44.6 | Very low | 181 Ų | 181 | 131.9 Ų | 131.9 | 89% | 0.892 | 76% | 0.756 | S | S | * | * | trans | 76.2 | 125.6 | 136.5 | -67.9 | -177.1 | 179.8 | 0 | 0 | 122 | ||||
| 14 | E | 50.1 | Low | 45.3 | Very low | 201 Ų | 201 | 127.3 Ų | 127.3 | 94% | 0.939 | 73% | 0.73 | S | S | * | * | trans | -36.1 | 131.3 | 157.4 | -61.6 | 168.4 | 104.5 | 0 | 0 | 113.1 | ||||
| 15 | G | 35.8 | Very low | 45.6 | Very low | 63 Ų | 63 | 126.8 Ų | 126.8 | 65% | 0.649 | 73% | 0.726 | S | S | * | * | trans | -150.6 | 79.6 | 179 | 0 | 0 | 0 | 0 | 0 | 111.7 | T17 | G15-T17 PolarHBondContact O-N 3.34Š| ||
| 16 | N | 46.4 | Very low | 45.9 | Very low | 147 Ų | 147 | 127.4 Ų | 127.4 | 79% | 0.786 | 73% | 0.725 | S | S | * | * | trans | 6.4 | 103.2 | 142.5 | -172.3 | 62.1 | 0 | 0 | 0 | 116.1 | P18 | N16-P18 WeakPolarHBondContact ND2-CD 3.39Å; N16-P18 WeakPolarHBondContact OD1-CD 3.18Å | ||
| 17 | T | 37.7 | Very low | 45.7 | Very low | 141 Ų | 141 | 127.3 Ų | 127.3 | 87% | 0.865 | 72% | 0.719 | S | S | * | * | trans | -109.1 | 88.8 | 163.1 | 54.6 | 0 | 0 | 0 | 0 | 111.4 | G15 | G15-T17 PolarHBondContact O-N 3.34Š| ||
| 18 | P | 50.1 | Low | 46.2 | Very low | 75 Ų | 75 | 121.7 Ų | 121.7 | 49% | 0.487 | 69% | 0.689 | S | S | . | * | -92.4 | 134.4 | 126.3 | 38.3 | -28.2 | 0 | 0 | 0 | 104.2 | N16 | N16-P18 WeakPolarHBondContact ND2-CD 3.39Å; N16-P18 WeakPolarHBondContact OD1-CD 3.18Å | |||
| 19 | I | 40.3 | Very low | 46.8 | Very low | 140 Ų | 140 | 119 Ų | 119 | 72% | 0.718 | 67% | 0.674 | S | S | * | * | -174.2 | 128.7 | 78.1 | -67.5 | 132.6 | 0 | 0 | 0 | 103.3 | E21 | I19-E21 HydrophobicContact CG2-CG 4.42Å; I19-E21 PolarHBondContact O-N 2.92Å | |||
| 20 | A | 52.3 | Low | 47.5 | Very low | 99 Ų | 99 | 117.3 Ų | 117.3 | 82% | 0.818 | 65% | 0.654 | S | S | * | * | trans | -66.2 | 92.1 | 162.4 | 0 | 0 | 0 | 0 | 0 | 107.5 | N22 | A20-N22 PolarHBondContact O-N 2.91Š| ||
| 21 | E | 46.4 | Very low | 48.7 | Very low | 166 Ų | 166 | 117 Ų | 117 | 78% | 0.776 | 65% | 0.649 | S | S | * | * | trans | -69.2 | 90.8 | 166.5 | -86.9 | -164 | 97.6 | 0 | 0 | 107.7 | I19 P23 | I19-E21 HydrophobicContact CG2-CG 4.42Å; I19-E21 PolarHBondContact O-N 2.92Å; E21-P23 VanDerWaalsContact O-CD 3.27Å; E21-P23 WeakPolarHBondContact O-CD 3.27Å | ||
| 22 | N | 49.4 | Very low | 49.4 | Very low | 121 Ų | 121 | 112.7 Ų | 112.7 | 65% | 0.647 | 63% | 0.631 | S | S | * | * | trans | -76.2 | 110.3 | 160.1 | -130.1 | -21.6 | 0 | 0 | 0 | 105.1 | A20 H24 S25 | A20-N22 PolarHBondContact O-N 2.91Å; N22-H24 PolarHBondContact O-N 3.25Å; N22-S25 PolarHBondContact O-N 3.18Å; N22-S25 PolarHBondContact O-OG 2.71Å | ||
| 23 | P | 50.3 | Low | 50.7 | Low | 105 Ų | 105 | 111.5 Ų | 111.5 | 68% | 0.682 | 62% | 0.616 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -65.4 | 12.8 | -172.4 | 26.3 | -35.1 | 0 | 0 | 0 | 114.4 | E21 | E21-P23 VanDerWaalsContact O-CD 3.27Å; E21-P23 WeakPolarHBondContact O-CD 3.27Å |
| 24 | H | 52.1 | Low | 51.6 | Low | 64 Ų | 64 | 108.9 Ų | 108.9 | 30% | 0.296 | 60% | 0.601 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -104.3 | -10.5 | -176.8 | -148.7 | 60.5 | 0 | 0 | 0 | 113.5 | N22 E26 L29 T30 I33 | N22-H24 PolarHBondContact O-N 3.25Å; H24-E26 VanDerWaalsContact C-N 3.33Å; H24-L29 WeakPolarHBondContact CE1-CB 3.27Å; H24-L29 WeakPolarHBondContact CE1-CD2 3.17Å; H24-L29 WeakPolarHBondContact NE2-CB 3.27Å; H24-T30 HydrophobicContact CB-CG2 4.08Å; H24-I33 VanDerWaalsContact NE2-CD1 3.27Å; H24-I33 WeakPolarHBondContact NE2-CD1 3.31Å |
| 25 | S | 49.9 | Very low | 52.2 | Low | 88 Ų | 88 | 105.1 Ų | 105.1 | 62% | 0.615 | 58% | 0.578 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71.6 | -27 | 176.1 | 48.7 | 0 | 0 | 0 | 0 | 113.1 | N22 | N22-S25 PolarHBondContact O-N 3.18Å; N22-S25 PolarHBondContact O-OG 2.71Å |
| 26 | E | 46.8 | Very low | 53.7 | Low | 155 Ų | 155 | 107.2 Ų | 107.2 | 72% | 0.724 | 57% | 0.573 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.1 | -27.8 | -175.9 | -165.3 | 174.9 | 124.5 | 0 | 0 | 113.2 | H24 | H24-E26 VanDerWaalsContact C-N 3.33Š|
| 27 | Y | 51.4 | Low | 54.6 | Low | 163 Ų | 163 | 103.5 Ų | 103.5 | 64% | 0.639 | 56% | 0.556 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -97.6 | 6.8 | -173.9 | -65.5 | -73.2 | 0 | 0 | 0 | 115 | L29 | Y27-L29 VanDerWaalsContact O-CD1 3.31Å; Y27-L29 WeakPolarHBondContact O-CD1 3.38Å; Y27-L29 PolarHBondContact O-N 2.93Å |
| 28 | G | 55.5 | Low | 55.7 | Low | 26 Ų | 26 | 102.8 Ų | 102.8 | 27% | 0.268 | 54% | 0.543 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 60.9 | 8.2 | -177.1 | 0 | 0 | 0 | 0 | 0 | 114.1 | T30 E31 N32 | G28-T30 VanDerWaalsContact C-N 3.31Å; G28-T30 PolarHBondContact O-N 3.14Å; G28-E31 PolarHBondContact O-N 3.43Å; G28-N32 PolarHBondContact O-N 3.49Å; G28-N32 VanDerWaalsContact O-N 3.14Å; G28-N32 PolarHBondContact O-ND2 3.38Å |
| 29 | L | 57.6 | Low | 56 | Low | 80 Ų | 80 | 104.3 Ų | 104.3 | 42% | 0.419 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -70.5 | -29.1 | 178.9 | -95.3 | 70 | 0 | 0 | 0 | 111.1 | H24 Y27 E31 N32 I33 | H24-L29 WeakPolarHBondContact CE1-CB 3.27Å; H24-L29 WeakPolarHBondContact CE1-CD2 3.17Å; H24-L29 WeakPolarHBondContact NE2-CB 3.27Å; Y27-L29 VanDerWaalsContact O-CD1 3.31Å; Y27-L29 WeakPolarHBondContact O-CD1 3.38Å; Y27-L29 PolarHBondContact O-N 2.93Å; L29-E31 VanDerWaalsContact C-N 3.32Å; L29-E31 PolarHBondContact O-N 3.35Å; L29-N32 PolarHBondContact O-N 3.45Å; L29-I33 WeakPolarHBondContact O-CB 3.14Å; L29-I33 WeakPolarHBondContact O-CD1 3.36Å; L29-I33 WeakPolarHBondContact O-CG1 3.31Å; L29-I33 PolarHBondContact O-N 2.86Å |
| 30 | T | 62.1 | Low | 56.8 | Low | 64 Ų | 64 | 103.9 Ų | 103.9 | 39% | 0.393 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -57.9 | -44.8 | 170.8 | 47.6 | 0 | 0 | 0 | 0 | 111.6 | H24 G28 I33 Q34 | H24-T30 HydrophobicContact CB-CG2 4.08Å; G28-T30 VanDerWaalsContact C-N 3.31Å; G28-T30 PolarHBondContact O-N 3.14Å; T30-I33 PolarHBondContact O-N 3.37Å; T30-Q34 WeakPolarHBondContact O-CB 3.5Å; T30-Q34 PolarHBondContact O-N 2.93Å |
| 31 | E | 60.4 | Low | 56.8 | Low | 110 Ų | 110 | 106.2 Ų | 106.2 | 51% | 0.514 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -69.3 | -38.9 | -179.7 | -154.2 | -170.9 | 153.6 | 0 | 0 | 111.7 | G28 L29 Q34 R35 | G28-E31 PolarHBondContact O-N 3.43Å; L29-E31 VanDerWaalsContact C-N 3.32Å; L29-E31 PolarHBondContact O-N 3.35Å; E31-Q34 WeakPolarHBondContact O-CB 3.33Å; E31-Q34 PolarHBondContact O-N 2.78Å; E31-R35 WeakPolarHBondContact O-CG 3.37Å; E31-R35 PolarHBondContact O-N 3.3Å; E31-R35 IonicContact OE1-CZ 3.37Å; E31-R35 IonicContact OE1-NE 2.78Å; E31-R35 IonicContact OE1-NH2 3.66Å; E31-R35 PolarHBondContact OE1-NH2 2.94Å; E31-R35 IonicContact OE2-NH2 3.72Å; E31-R35 PolarHBondContact OE2-NH2 2.88Å |
| 32 | N | 61.1 | Low | 56.9 | Low | 69 Ų | 69 | 99.8 Ų | 99.8 | 37% | 0.369 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -66.6 | -41.1 | 175.7 | -64.9 | -20.7 | 0 | 0 | 0 | 111.7 | G28 L29 R35 I36 | G28-N32 PolarHBondContact O-N 3.49Å; G28-N32 VanDerWaalsContact O-N 3.14Å; G28-N32 PolarHBondContact O-ND2 3.38Å; L29-N32 PolarHBondContact O-N 3.45Å; N32-R35 PolarHBondContact O-N 3.4Å; N32-R35 PolarHBondContact OD1-NH1 2.78Å; N32-I36 WeakPolarHBondContact O-CD1 3.4Å; N32-I36 WeakPolarHBondContact O-CG1 3.5Å; N32-I36 PolarHBondContact O-N 2.87Å |
| 33 | I | 65.2 | Low | 56.7 | Low | 84 Ų | 84 | 99.3 Ų | 99.3 | 43% | 0.431 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -65.5 | -42 | 174.5 | -67 | 163.8 | 0 | 0 | 0 | 110.3 | H24 L29 T30 R35 I36 V37 | H24-I33 VanDerWaalsContact NE2-CD1 3.27Å; H24-I33 WeakPolarHBondContact NE2-CD1 3.31Å; L29-I33 WeakPolarHBondContact O-CB 3.14Å; L29-I33 WeakPolarHBondContact O-CD1 3.36Å; L29-I33 WeakPolarHBondContact O-CG1 3.31Å; L29-I33 PolarHBondContact O-N 2.86Å; T30-I33 PolarHBondContact O-N 3.37Å; I33-R35 VanDerWaalsContact C-N 3.33Å; I33-R35 PolarHBondContact O-N 2.92Å; I33-I36 PolarHBondContact O-N 3.43Å; I33-V37 HydrophobicContact CG2-CG2 4.32Å; I33-V37 VanDerWaalsContact O-CG2 3.29Å; I33-V37 WeakPolarHBondContact O-CG2 3.44Å; I33-V37 PolarHBondContact O-N 2.89Å |
| 34 | Q | 62.8 | Low | 56.7 | Low | 126 Ų | 126 | 99.4 Ų | 99.4 | 59% | 0.589 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -58.1 | -45.4 | 175 | -154.8 | 87.6 | 21.6 | 0 | 0 | 111.1 | T30 E31 V37 E38 | T30-Q34 WeakPolarHBondContact O-CB 3.5Å; T30-Q34 PolarHBondContact O-N 2.93Å; E31-Q34 WeakPolarHBondContact O-CB 3.33Å; E31-Q34 PolarHBondContact O-N 2.78Å; Q34-V37 PolarHBondContact O-N 2.97Å; Q34-E38 WeakPolarHBondContact O-CB 3.4Å; Q34-E38 WeakPolarHBondContact O-CG 3.29Å; Q34-E38 PolarHBondContact O-N 3.43Å |
| 35 | R | 63.8 | Low | 56.4 | Low | 122 Ų | 122 | 104.1 Ų | 104.1 | 46% | 0.46 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -65.7 | -36.9 | 176.3 | -71.8 | -174 | -136.6 | 127.7 | 1.1 | 112.9 | E31 N32 I33 N39 | E31-R35 WeakPolarHBondContact O-CG 3.37Å; E31-R35 PolarHBondContact O-N 3.3Å; E31-R35 IonicContact OE1-CZ 3.37Å; E31-R35 IonicContact OE1-NE 2.78Å; E31-R35 IonicContact OE1-NH2 3.66Å; E31-R35 PolarHBondContact OE1-NH2 2.94Å; E31-R35 IonicContact OE2-NH2 3.72Å; E31-R35 PolarHBondContact OE2-NH2 2.88Å; N32-R35 PolarHBondContact O-N 3.4Å; N32-R35 PolarHBondContact OD1-NH1 2.78Å; I33-R35 VanDerWaalsContact C-N 3.33Å; I33-R35 PolarHBondContact O-N 2.92Å; R35-N39 WeakPolarHBondContact O-CB 3.16Å; R35-N39 PolarHBondContact O-N 3.21Å |
| 36 | I | 65.8 | Low | 56.1 | Low | 106 Ų | 106 | 107 Ų | 107 | 54% | 0.544 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -66.6 | -45.5 | 176.2 | -67.9 | 160.5 | 0 | 0 | 0 | 110.1 | N32 I33 N39 E40 | N32-I36 WeakPolarHBondContact O-CD1 3.4Å; N32-I36 WeakPolarHBondContact O-CG1 3.5Å; N32-I36 PolarHBondContact O-N 2.87Å; I33-I36 PolarHBondContact O-N 3.43Å; I36-N39 PolarHBondContact O-N 3.37Å; I36-E40 WeakPolarHBondContact O-CB 3.39Å; I36-E40 PolarHBondContact O-N 3.26Å |
| 37 | V | 65.9 | Low | 56.1 | Low | 69 Ų | 69 | 105.7 Ų | 105.7 | 42% | 0.418 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -67.4 | -37.4 | 178.7 | 176.6 | 0 | 0 | 0 | 0 | 111.8 | I33 Q34 K41 | I33-V37 HydrophobicContact CG2-CG2 4.32Å; I33-V37 VanDerWaalsContact O-CG2 3.29Å; I33-V37 WeakPolarHBondContact O-CG2 3.44Å; I33-V37 PolarHBondContact O-N 2.89Å; Q34-V37 PolarHBondContact O-N 2.97Å; V37-K41 WeakPolarHBondContact O-CB 3.2Å; V37-K41 WeakPolarHBondContact O-CG 3.44Å; V37-K41 PolarHBondContact O-N 2.84Å |
| 38 | E | 60.7 | Low | 55.8 | Low | 126 Ų | 126 | 101.4 Ų | 101.4 | 59% | 0.589 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -67 | -40 | 171.7 | -82.6 | 179.3 | 166.6 | 0 | 0 | 112.4 | Q34 A42 | Q34-E38 WeakPolarHBondContact O-CB 3.4Å; Q34-E38 WeakPolarHBondContact O-CG 3.29Å; Q34-E38 PolarHBondContact O-N 3.43Å; E38-A42 WeakPolarHBondContact O-CB 3.42Å; E38-A42 PolarHBondContact O-N 3.11Å |
| 39 | N | 56.5 | Low | 55.6 | Low | 108 Ų | 108 | 109.1 Ų | 109.1 | 58% | 0.578 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -69.6 | -33 | 176.8 | -168.1 | 61 | 0 | 0 | 0 | 111.9 | R35 I36 N43 | R35-N39 WeakPolarHBondContact O-CB 3.16Å; R35-N39 PolarHBondContact O-N 3.21Å; I36-N39 PolarHBondContact O-N 3.37Å; N39-N43 VanDerWaalsContact O-CB 3.29Å; N39-N43 WeakPolarHBondContact O-CB 3.02Å; N39-N43 PolarHBondContact O-N 2.95Å |
| 40 | E | 57 | Low | 55.3 | Low | 130 Ų | 130 | 113.8 Ų | 113.8 | 61% | 0.607 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -73.3 | -43 | 176 | -150.6 | -175 | 124.8 | 0 | 0 | 111.7 | I36 A42 N43 T44 | I36-E40 WeakPolarHBondContact O-CB 3.39Å; I36-E40 PolarHBondContact O-N 3.26Å; E40-A42 VanDerWaalsContact C-N 3.34Å; E40-A42 PolarHBondContact O-N 3.5Å; E40-N43 PolarHBondContact O-N 2.87Å; E40-T44 PolarHBondContact O-N 3.06Å; E40-T44 PolarHBondContact O-OG1 2.88Å; E40-T44 VanDerWaalsContact O-OG1 3.09Å |
| 41 | K | 52.2 | Low | 55.3 | Low | 149 Ų | 149 | 119.8 Ų | 119.8 | 65% | 0.648 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -63.1 | -39.5 | 171.3 | -76.7 | -175.7 | 175.8 | -172.2 | 0 | 112 | V37 N43 E45 | V37-K41 WeakPolarHBondContact O-CB 3.2Å; V37-K41 WeakPolarHBondContact O-CG 3.44Å; V37-K41 PolarHBondContact O-N 2.84Å; K41-N43 VanDerWaalsContact C-N 3.3Å; K41-N43 PolarHBondContact O-N 3.48Å; K41-E45 WeakPolarHBondContact O-CG 3.17Å; K41-E45 PolarHBondContact O-N 2.88Å; K41-E45 VanDerWaalsContact O-N 3.11Å |
| 42 | A | 48.9 | Very low | 55.7 | Low | 30 Ų | 30 | 117.8 Ų | 117.8 | 25% | 0.248 | 59% | 0.586 | C | S | . | * | H | α-helix | trans | -69.2 | -25.1 | 172.4 | 0 | 0 | 0 | 0 | 0 | 112.6 | E38 E40 K46 | E38-A42 WeakPolarHBondContact O-CB 3.42Å; E38-A42 PolarHBondContact O-N 3.11Å; E40-A42 VanDerWaalsContact C-N 3.34Å; E40-A42 PolarHBondContact O-N 3.5Å; A42-K46 WeakPolarHBondContact O-CA 3.29Å; A42-K46 WeakPolarHBondContact O-CB 3.49Å; A42-K46 VanDerWaalsContact O-CD 3.3Å; A42-K46 WeakPolarHBondContact O-CD 2.98Å; A42-K46 WeakPolarHBondContact O-CG 3.3Å; A42-K46 PolarHBondContact O-N 3.09Å |
| 43 | N | 45.6 | Very low | 56.9 | Low | 112 Ų | 112 | 119 Ų | 119 | 60% | 0.599 | 59% | 0.593 | S | S | * | * | H | α-helix | trans | -78.6 | -36.9 | 176.3 | -157.7 | -76.6 | 0 | 0 | 0 | 111.8 | N39 E40 K41 E45 K46 | N39-N43 VanDerWaalsContact O-CB 3.29Å; N39-N43 WeakPolarHBondContact O-CB 3.02Å; N39-N43 PolarHBondContact O-N 2.95Å; E40-N43 PolarHBondContact O-N 2.87Å; K41-N43 VanDerWaalsContact C-N 3.3Å; K41-N43 PolarHBondContact O-N 3.48Å; N43-E45 VanDerWaalsContact C-N 3.32Å; N43-E45 PolarHBondContact O-N 3.48Å; N43-K46 PolarHBondContact O-N 3.46Å |
| 44 | T | 49.3 | Very low | 58 | Low | 106 Ų | 106 | 117.5 Ų | 117.5 | 65% | 0.65 | 59% | 0.585 | S | S | * | * | H | α-helix | trans | -68 | -32.2 | 173 | -44 | 0 | 0 | 0 | 0 | 112 | E40 | E40-T44 PolarHBondContact O-N 3.06Å; E40-T44 PolarHBondContact O-OG1 2.88Å; E40-T44 VanDerWaalsContact O-OG1 3.09Å |
| 45 | E | 46.5 | Very low | 59.2 | Low | 164 Ų | 164 | 118.7 Ų | 118.7 | 77% | 0.766 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -91.6 | -12.9 | 176.9 | -60.6 | -134.7 | 125.2 | 0 | 0 | 114.3 | K41 N43 V47 S48 | K41-E45 WeakPolarHBondContact O-CG 3.17Å; K41-E45 PolarHBondContact O-N 2.88Å; K41-E45 VanDerWaalsContact O-N 3.11Å; N43-E45 VanDerWaalsContact C-N 3.32Å; N43-E45 PolarHBondContact O-N 3.48Å; E45-V47 VanDerWaalsContact C-N 3.32Å; E45-S48 PolarHBondContact O-N 3.45Å |
| 46 | K | 43.6 | Very low | 60.5 | Low | 147 Ų | 147 | 117 Ų | 117 | 64% | 0.639 | 60% | 0.597 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -93.2 | 25.2 | 169.4 | -68.9 | 170.9 | -172 | 177.9 | 0 | 113.6 | A42 N43 S48 | A42-K46 WeakPolarHBondContact O-CA 3.29Å; A42-K46 WeakPolarHBondContact O-CB 3.49Å; A42-K46 VanDerWaalsContact O-CD 3.3Å; A42-K46 WeakPolarHBondContact O-CD 2.98Å; A42-K46 WeakPolarHBondContact O-CG 3.3Å; A42-K46 PolarHBondContact O-N 3.09Å; N43-K46 PolarHBondContact O-N 3.46Å; K46-S48 VanDerWaalsContact CA-N 3.35Å; K46-S48 WeakPolarHBondContact CA-OG 3.5Å; K46-S48 PolarHBondContact O-N 2.86Å |
| 47 | V | 47 | Very low | 61.7 | Low | 129 Ų | 129 | 113.8 Ų | 113.8 | 78% | 0.782 | 58% | 0.581 | S | S | * | * | trans | -72.6 | 38.1 | 136.6 | -162.8 | 0 | 0 | 0 | 0 | 108.8 | E45 K49 | E45-V47 VanDerWaalsContact C-N 3.32Å; V47-K49 PolarHBondContact O-N 3.01Å | ||
| 48 | S | 44.8 | Very low | 63.2 | Low | 73 Ų | 73 | 114.9 Ų | 114.9 | 51% | 0.51 | 59% | 0.59 | S | S | . | * | trans | -72.1 | 86.6 | 177 | 51.7 | 0 | 0 | 0 | 0 | 106 | E45 K46 Q50 | E45-S48 PolarHBondContact O-N 3.45Å; K46-S48 VanDerWaalsContact CA-N 3.35Å; K46-S48 WeakPolarHBondContact CA-OG 3.5Å; K46-S48 PolarHBondContact O-N 2.86Å; S48-Q50 PolarHBondContact O-N 2.74Å | ||
| 49 | K | 51 | Low | 64.9 | Low | 187 Ų | 187 | 114.2 Ų | 114.2 | 81% | 0.813 | 60% | 0.595 | S | S | * | * | trans | 37.7 | 52.2 | 148.3 | -57.3 | 172.7 | -175.7 | 172.7 | 0 | 112 | V47 K51 | V47-K49 PolarHBondContact O-N 3.01Å; K49-K51 PolarHBondContact O-N 2.69Å | ||
| 50 | Q | 51.3 | Low | 66.9 | Low | 178 Ų | 178 | 118.5 Ų | 118.5 | 83% | 0.832 | 60% | 0.603 | S | S | * | * | trans | -65.4 | 92.4 | 159 | -176.6 | 165.1 | -15.8 | 0 | 0 | 101.2 | S48 V52 | S48-Q50 PolarHBondContact O-N 2.74Å; Q50-V52 PolarHBondContact O-N 2.71Å | ||
| 51 | K | 61 | Low | 68.7 | Low | 191 Ų | 191 | 113.8 Ų | 113.8 | 83% | 0.83 | 59% | 0.586 | S | S | * | * | trans | -52.8 | 101.3 | 178.4 | -69.9 | -168.4 | 175.4 | -159.1 | 0 | 102.9 | K49 D53 | K49-K51 PolarHBondContact O-N 2.69Å; K51-D53 PolarHBondContact O-N 3.48Å | ||
| 52 | V | 70.6 | Confident | 70.8 | Confident | 67 Ų | 67 | 110.9 Ų | 110.9 | 41% | 0.406 | 57% | 0.572 | S | S | . | * | trans | -60.9 | 115 | -178.8 | 176.5 | 0 | 0 | 0 | 0 | 102.8 | Q50 L54 L57 | Q50-V52 PolarHBondContact O-N 2.71Å; V52-L54 PolarHBondContact O-N 2.88Å; V52-L57 HydrophobicContact CG1-CD1 3.7Å; V52-L57 HydrophobicContact CG1-CD2 3.66Å; V52-L57 HydrophobicContact CG1-CG 3.85Å | ||
| 53 | D | 85.4 | Confident | 73 | Confident | 96 Ų | 96 | 113 Ų | 113 | 51% | 0.513 | 58% | 0.579 | S | S | . | * | trans | -68.8 | 94.7 | 178.5 | 176.2 | 20 | 0 | 0 | 0 | 106.7 | K51 Q55 S56 | K51-D53 PolarHBondContact O-N 3.48Å; D53-Q55 PolarHBondContact O-N 3.47Å; D53-Q55 PolarHBondContact OD1-N 3.1Å; D53-S56 PolarHBondContact O-N 3.47Å; D53-S56 PolarHBondContact O-OG 2.94Å | ||
| 54 | L | 87.5 | Confident | 75.4 | Confident | 52 Ų | 52 | 111.4 Ų | 111.4 | 27% | 0.272 | 57% | 0.57 | S | S | . | * | G | 310 helix | trans | -54.1 | -29.5 | -175.1 | -67.8 | 177.7 | 0 | 0 | 0 | 111.2 | V52 S56 L57 Y62 Q65 T66 | V52-L54 PolarHBondContact O-N 2.88Å; L54-S56 VanDerWaalsContact C-N 3.31Å; L54-S56 PolarHBondContact O-N 3.07Å; L54-L57 HydrophobicContact CD2-CD1 3.87Å; L54-L57 PolarHBondContact O-N 3.05Å; L54-Y62 HydrophobicContact CB-CD2 3.96Å; L54-Y62 HydrophobicContact CB-CE2 3.92Å; L54-Y62 VanDerWaalsContact O-CD2 3.22Å; L54-Y62 WeakPolarHBondContact O-CD2 3.41Å; L54-Q65 HydrophobicContact CD2-CB 4.32Å; L54-T66 HydrophobicContact CD1-CG2 4.03Å; L54-T66 HydrophobicContact CD2-CG2 4.3Å |
| 55 | Q | 87.8 | Confident | 77.5 | Confident | 151 Ų | 151 | 109.3 Ų | 109.3 | 71% | 0.706 | 55% | 0.553 | S | S | * | * | G | 310 helix | trans | -73.8 | -22.4 | -179.4 | -58 | -54.4 | -56.4 | 0 | 0 | 113.5 | D53 | D53-Q55 PolarHBondContact O-N 3.47Å; D53-Q55 PolarHBondContact OD1-N 3.1Å |
| 56 | S | 91.7 | Very high | 79.7 | Confident | 85 Ų | 85 | 103.5 Ų | 103.5 | 59% | 0.594 | 53% | 0.528 | S | S | * | . | G | 310 helix | trans | -87.7 | -11.3 | 178.2 | 72.9 | 0 | 0 | 0 | 0 | 113.6 | D53 L54 | D53-S56 PolarHBondContact O-N 3.47Å; D53-S56 PolarHBondContact O-OG 2.94Å; L54-S56 VanDerWaalsContact C-N 3.31Å; L54-S56 PolarHBondContact O-N 3.07Å |
| 57 | L | 92.4 | Very high | 82.2 | Confident | 39 Ų | 39 | 99.2 Ų | 99.2 | 20% | 0.204 | 52% | 0.515 | C | S | . | . | S | Bend | trans | -71 | 144.5 | -174.2 | -72.1 | 179.1 | 0 | 0 | 0 | 111.9 | V52 L54 A61 | V52-L57 HydrophobicContact CG1-CD1 3.7Å; V52-L57 HydrophobicContact CG1-CD2 3.66Å; V52-L57 HydrophobicContact CG1-CG 3.85Å; L54-L57 HydrophobicContact CD2-CD1 3.87Å; L54-L57 PolarHBondContact O-N 3.05Å; L57-A61 HydrophobicContact CB-CB 4.25Å; L57-A61 HydrophobicContact CD1-CB 4.35Å; L57-A61 HydrophobicContact CD2-CB 4.24Å |
| 58 | P | 97.1 | Very high | 84.6 | Confident | 93 Ų | 93 | 94.9 Ų | 94.9 | 60% | 0.604 | 49% | 0.489 | S | S | * | . | trans | -54.4 | 146 | 162.2 | -23.3 | 33.6 | 0 | 0 | 0 | 110.8 | R60 A61 Y62 | P58-R60 PolarHBondContact O-N 3.15Å; P58-A61 PolarHBondContact O-N 3.31Å; P58-Y62 PolarHBondContact O-N 3.04Å | ||
| 59 | T | 96.7 | Very high | 87.1 | Confident | 112 Ų | 112 | 93.8 Ų | 93.8 | 69% | 0.687 | 48% | 0.479 | S | S | * | . | H | α-helix | trans | -48.7 | -43.6 | -173 | -51.8 | 0 | 0 | 0 | 0 | 113.5 | Y62 L63 | T59-Y62 PolarHBondContact O-N 2.92Å; T59-L63 HydrophobicContact CG2-CD1 4.22Å; T59-L63 WeakPolarHBondContact O-CG 3.48Å; T59-L63 PolarHBondContact O-N 3.15Å; T59-L63 VanDerWaalsContact O-N 3.08Å |
| 60 | R | 97.3 | Very high | 89.3 | Confident | 197 Ų | 197 | 85.5 Ų | 85.5 | 74% | 0.743 | 44% | 0.444 | S | S | * | . | H | α-helix | trans | -62.3 | -47.4 | 179.6 | -174 | 172.4 | -175 | 159.5 | 2.7 | 112.1 | P58 Y62 L63 D64 | P58-R60 PolarHBondContact O-N 3.15Å; R60-Y62 VanDerWaalsContact C-N 3.34Å; R60-Y62 PolarHBondContact O-N 3Å; R60-L63 PolarHBondContact O-N 3.03Å; R60-D64 WeakPolarHBondContact O-CB 3.04Å; R60-D64 PolarHBondContact O-N 2.8Å |
| 61 | A | 95.4 | Very high | 91.6 | Very high | 32 Ų | 32 | 79.6 Ų | 79.6 | 26% | 0.264 | 42% | 0.418 | S | S | . | . | H | α-helix | trans | -64.9 | -38.6 | 179.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | L57 P58 D64 Q65 | L57-A61 HydrophobicContact CB-CB 4.25Å; L57-A61 HydrophobicContact CD1-CB 4.35Å; L57-A61 HydrophobicContact CD2-CB 4.24Å; P58-A61 PolarHBondContact O-N 3.31Å; A61-D64 PolarHBondContact O-N 3.28Å; A61-Q65 WeakPolarHBondContact O-CB 3.34Å; A61-Q65 WeakPolarHBondContact O-CG 3.38Å; A61-Q65 PolarHBondContact O-N 3.46Å |
| 62 | Y | 95.7 | Very high | 93.3 | Very high | 88 Ų | 88 | 75.7 Ų | 75.7 | 35% | 0.345 | 41% | 0.405 | S | S | . | . | H | α-helix | trans | -59.1 | -48 | 174.1 | 177.2 | -97.3 | 0 | 0 | 0 | 111.7 | L54 P58 T59 R60 Q65 T66 | L54-Y62 HydrophobicContact CB-CD2 3.96Å; L54-Y62 HydrophobicContact CB-CE2 3.92Å; L54-Y62 VanDerWaalsContact O-CD2 3.22Å; L54-Y62 WeakPolarHBondContact O-CD2 3.41Å; P58-Y62 PolarHBondContact O-N 3.04Å; T59-Y62 PolarHBondContact O-N 2.92Å; R60-Y62 VanDerWaalsContact C-N 3.34Å; R60-Y62 PolarHBondContact O-N 3Å; Y62-Q65 PolarHBondContact O-N 2.91Å; Y62-T66 HydrophobicContact CD2-CG2 4.05Å; Y62-T66 HydrophobicContact CE1-CG2 4.31Å; Y62-T66 HydrophobicContact CE2-CG2 3.77Å; Y62-T66 HydrophobicContact CG-CG2 4.47Å; Y62-T66 WeakPolarHBondContact O-CB 3.46Å; Y62-T66 VanDerWaalsContact O-CG2 3.31Å; Y62-T66 WeakPolarHBondContact O-CG2 3.49Å; Y62-T66 PolarHBondContact O-N 3.39Å; Y62-T66 PolarHBondContact O-OG1 2.73Å |
| 63 | L | 96.4 | Very high | 94.6 | Very high | 74 Ų | 74 | 76.7 Ų | 76.7 | 39% | 0.387 | 41% | 0.406 | S | S | . | . | H | α-helix | trans | -65.6 | -43.2 | 179.3 | -66.5 | 175 | 0 | 0 | 0 | 111.7 | T59 R60 Q65 T66 V67 V68 | T59-L63 HydrophobicContact CG2-CD1 4.22Å; T59-L63 WeakPolarHBondContact O-CG 3.48Å; T59-L63 PolarHBondContact O-N 3.15Å; T59-L63 VanDerWaalsContact O-N 3.08Å; R60-L63 PolarHBondContact O-N 3.03Å; L63-Q65 VanDerWaalsContact C-N 3.26Å; L63-Q65 PolarHBondContact O-N 3.47Å; L63-T66 PolarHBondContact O-N 2.89Å; L63-V67 HydrophobicContact CD2-CG2 3.83Å; L63-V67 PolarHBondContact O-N 2.94Å; L63-V68 VanDerWaalsContact C-CG2 3.46Å; L63-V68 HydrophobicContact CB-CG2 3.96Å; L63-V68 WeakPolarHBondContact O-CB 3.36Å; L63-V68 WeakPolarHBondContact O-CG2 3.46Å; L63-V68 PolarHBondContact O-N 3.23Å |
| 64 | D | 94.8 | Very high | 95.2 | Very high | 78 Ų | 78 | 72.1 Ų | 72.1 | 42% | 0.417 | 38% | 0.381 | S | S | . | . | H | α-helix | trans | -59.9 | -35.9 | 179.9 | -72.8 | -10.9 | 0 | 0 | 0 | 112 | R60 A61 P69 | R60-D64 WeakPolarHBondContact O-CB 3.04Å; R60-D64 PolarHBondContact O-N 2.8Å; A61-D64 PolarHBondContact O-N 3.28Å; D64-P69 WeakPolarHBondContact O-CD 3.19Å |
| 65 | Q | 92.8 | Very high | 95.8 | Very high | 62 Ų | 62 | 73.7 Ų | 73.7 | 29% | 0.29 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -84.5 | -33.1 | 177.6 | -72.6 | -164.6 | 28.3 | 0 | 0 | 113.9 | L54 A61 Y62 L63 N105 | L54-Q65 HydrophobicContact CD2-CB 4.32Å; A61-Q65 WeakPolarHBondContact O-CB 3.34Å; A61-Q65 WeakPolarHBondContact O-CG 3.38Å; A61-Q65 PolarHBondContact O-N 3.46Å; Y62-Q65 PolarHBondContact O-N 2.91Å; L63-Q65 VanDerWaalsContact C-N 3.26Å; L63-Q65 PolarHBondContact O-N 3.47Å; Q65-N105 PolarHBondContact O-OD1 3.1Å; Q65-N105 PolarHBondContact OE1-ND2 3.4Å |
| 66 | T | 93.8 | Very high | 96.3 | Very high | 42 Ų | 42 | 70.5 Ų | 70.5 | 26% | 0.258 | 38% | 0.384 | S | S | . | . | H | α-helix | trans | -92.9 | -53.6 | -171.1 | 55.2 | 0 | 0 | 0 | 0 | 113.8 | L54 Y62 L63 | L54-T66 HydrophobicContact CD1-CG2 4.03Å; L54-T66 HydrophobicContact CD2-CG2 4.3Å; Y62-T66 HydrophobicContact CD2-CG2 4.05Å; Y62-T66 HydrophobicContact CE1-CG2 4.31Å; Y62-T66 HydrophobicContact CE2-CG2 3.77Å; Y62-T66 HydrophobicContact CG-CG2 4.47Å; Y62-T66 WeakPolarHBondContact O-CB 3.46Å; Y62-T66 VanDerWaalsContact O-CG2 3.31Å; Y62-T66 WeakPolarHBondContact O-CG2 3.49Å; Y62-T66 PolarHBondContact O-N 3.39Å; Y62-T66 PolarHBondContact O-OG1 2.73Å; L63-T66 PolarHBondContact O-N 2.89Å |
| 67 | V | 96.6 | Very high | 96.6 | Very high | 57 Ų | 57 | 68.8 Ų | 68.8 | 35% | 0.345 | 37% | 0.37 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -127.1 | -23.8 | -162.8 | -63.8 | 0 | 0 | 0 | 0 | 114.1 | L63 I70 L71 | L63-V67 HydrophobicContact CD2-CG2 3.83Å; L63-V67 PolarHBondContact O-N 2.94Å; V67-I70 WeakPolarHBondContact O-CG2 3.49Å; V67-I70 PolarHBondContact O-N 3.34Å; V67-L71 HydrophobicContact CB-CD1 3.97Å; V67-L71 HydrophobicContact CG2-CD1 3.91Å; V67-L71 WeakPolarHBondContact O-CB 3.4Å; V67-L71 VanDerWaalsContact O-CG 3.25Å; V67-L71 WeakPolarHBondContact O-CG 3.25Å; V67-L71 PolarHBondContact O-N 2.96Å |
| 68 | V | 97.4 | Very high | 96.8 | Very high | 39 Ų | 39 | 68.3 Ų | 68.3 | 24% | 0.236 | 37% | 0.367 | C | S | . | . | H | α-helix | trans | -58.5 | -44.5 | -177.1 | 168.3 | 0 | 0 | 0 | 0 | 112.7 | L63 I70 L71 L72 | L63-V68 VanDerWaalsContact C-CG2 3.46Å; L63-V68 HydrophobicContact CB-CG2 3.96Å; L63-V68 WeakPolarHBondContact O-CB 3.36Å; L63-V68 WeakPolarHBondContact O-CG2 3.46Å; L63-V68 PolarHBondContact O-N 3.23Å; V68-I70 PolarHBondContact O-N 3.43Å; V68-L71 PolarHBondContact O-N 3.31Å; V68-L72 HydrophobicContact CG1-CD1 3.8Å; V68-L72 HydrophobicContact CG1-CG 4.02Å; V68-L72 WeakPolarHBondContact O-CG 3.21Å; V68-L72 PolarHBondContact O-N 3.01Å |
| 69 | P | 97.3 | Very high | 96.9 | Very high | 49 Ų | 49 | 67 Ų | 67 | 32% | 0.318 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -59.9 | -44.2 | -177.2 | -25.9 | 35.8 | 0 | 0 | 0 | 113.2 | D64 Q73 F101 | D64-P69 WeakPolarHBondContact O-CD 3.19Å; P69-Q73 PolarHBondContact O-N 2.97Å; P69-F101 HydrophobicContact CB-CD1 3.96Å; P69-F101 HydrophobicContact CB-CE1 4.08Å |
| 70 | I | 97.1 | Very high | 96.9 | Very high | 14 Ų | 14 | 69.8 Ų | 69.8 | 7% | 0.072 | 37% | 0.367 | C | S | . | . | H | α-helix | trans | -73.7 | -34.6 | 179.5 | -167.4 | 177.1 | 0 | 0 | 0 | 111.7 | V67 V68 Q73 G74 F93 L94 N97 F101 | V67-I70 WeakPolarHBondContact O-CG2 3.49Å; V67-I70 PolarHBondContact O-N 3.34Å; V68-I70 PolarHBondContact O-N 3.43Å; I70-Q73 PolarHBondContact O-N 3.33Å; I70-G74 PolarHBondContact O-N 2.89Å; I70-F93 HydrophobicContact CG1-CE1 4.42Å; I70-L94 HydrophobicContact CB-CD2 4.25Å; I70-L94 HydrophobicContact CD1-CD2 3.85Å; I70-L94 HydrophobicContact CG1-CD2 3.68Å; I70-L94 HydrophobicContact CG2-CD2 3.82Å; I70-N97 HydrophobicContact CD1-CB 4.11Å; I70-F101 HydrophobicContact CB-CB 4.26Å; I70-F101 HydrophobicContact CB-CD1 3.85Å; I70-F101 HydrophobicContact CB-CD2 3.88Å; I70-F101 HydrophobicContact CB-CE1 4.09Å; I70-F101 HydrophobicContact CB-CE2 4.14Å; I70-F101 HydrophobicContact CB-CG 3.72Å; I70-F101 HydrophobicContact CB-CZ 4.23Å; I70-F101 HydrophobicContact CD1-CD2 3.73Å; I70-F101 HydrophobicContact CD1-CE2 4.22Å; I70-F101 HydrophobicContact CD1-CG 4.24Å; I70-F101 HydrophobicContact CG1-CD2 3.68Å; I70-F101 HydrophobicContact CG1-CE2 3.78Å; I70-F101 HydrophobicContact CG1-CG 4.08Å; I70-F101 HydrophobicContact CG1-CZ 4.23Å |
| 71 | L | 98.3 | Very high | 97 | Very high | 54 Ų | 54 | 66 Ų | 66 | 28% | 0.283 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -66 | -43.6 | 176.1 | -76 | 169.7 | 0 | 0 | 0 | 111.9 | V67 V68 Q73 G74 L75 L94 | V67-L71 HydrophobicContact CB-CD1 3.97Å; V67-L71 HydrophobicContact CG2-CD1 3.91Å; V67-L71 WeakPolarHBondContact O-CB 3.4Å; V67-L71 VanDerWaalsContact O-CG 3.25Å; V67-L71 WeakPolarHBondContact O-CG 3.25Å; V67-L71 PolarHBondContact O-N 2.96Å; V68-L71 PolarHBondContact O-N 3.31Å; L71-Q73 VanDerWaalsContact C-N 3.31Å; L71-Q73 PolarHBondContact O-N 3.45Å; L71-G74 PolarHBondContact O-N 3.43Å; L71-L75 VanDerWaalsContact O-CB 3.27Å; L71-L75 WeakPolarHBondContact O-CB 3.36Å; L71-L75 WeakPolarHBondContact O-CG 3.43Å; L71-L75 PolarHBondContact O-N 3.06Å; L71-L94 HydrophobicContact CD2-CD1 3.99Å; L71-L94 HydrophobicContact CD2-CD2 4.09Å |
| 72 | L | 98.1 | Very high | 97.1 | Very high | 108 Ų | 108 | 74.6 Ų | 74.6 | 57% | 0.565 | 38% | 0.383 | S | S | * | . | H | α-helix | trans | -59.7 | -43 | 177.4 | -71.7 | 178.7 | 0 | 0 | 0 | 111.6 | V68 S76 | V68-L72 HydrophobicContact CG1-CD1 3.8Å; V68-L72 HydrophobicContact CG1-CG 4.02Å; V68-L72 WeakPolarHBondContact O-CG 3.21Å; V68-L72 PolarHBondContact O-N 3.01Å; L72-S76 WeakPolarHBondContact O-CB 3.22Å; L72-S76 PolarHBondContact O-N 3.41Å; L72-S76 VanDerWaalsContact O-N 3.1Å; L72-S76 PolarHBondContact O-OG 3.08Å |
| 73 | Q | 97.8 | Very high | 97.2 | Very high | 89 Ų | 89 | 72.2 Ų | 72.2 | 42% | 0.416 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -67.1 | -46.2 | 176.2 | -170.2 | 173.8 | -44.3 | 0 | 0 | 111.7 | P69 I70 L71 L75 S76 V77 F93 | P69-Q73 PolarHBondContact O-N 2.97Å; I70-Q73 PolarHBondContact O-N 3.33Å; L71-Q73 VanDerWaalsContact C-N 3.31Å; L71-Q73 PolarHBondContact O-N 3.45Å; Q73-L75 PolarHBondContact O-N 3.06Å; Q73-S76 WeakPolarHBondContact O-CB 3.28Å; Q73-S76 PolarHBondContact O-N 3.05Å; Q73-V77 WeakPolarHBondContact O-CG2 3.43Å; Q73-V77 PolarHBondContact O-N 3.44Å; Q73-V77 VanDerWaalsContact O-N 3.13Å; Q73-F93 HydrophobicContact CG-CZ 4.06Å |
| 74 | G | 98 | Very high | 97.2 | Very high | 0 Ų | 0 | 75.3 Ų | 75.3 | 0% | 0 | 40% | 0.401 | C | S | . | . | H | α-helix | trans | -62.3 | -42.3 | 179.2 | 0 | 0 | 0 | 0 | 0 | 113 | I70 L71 S76 V77 L78 F93 | I70-G74 PolarHBondContact O-N 2.89Å; L71-G74 PolarHBondContact O-N 3.43Å; G74-S76 VanDerWaalsContact C-N 3.34Å; G74-S76 PolarHBondContact O-N 3.44Å; G74-V77 PolarHBondContact O-N 3.46Å; G74-L78 VanDerWaalsContact O-CB 3.29Å; G74-L78 WeakPolarHBondContact O-CB 3.31Å; G74-L78 PolarHBondContact O-N 3.39Å; G74-F93 VanDerWaalsContact CA-CD1 3.46Å |
| 75 | L | 98.5 | Very high | 97.4 | Very high | 84 Ų | 84 | 76 Ų | 76 | 44% | 0.44 | 40% | 0.404 | S | S | . | . | H | α-helix | trans | -65.7 | -36.2 | 176.2 | -71.7 | 172.4 | 0 | 0 | 0 | 112.1 | L71 Q73 L78 A79 L90 | L71-L75 VanDerWaalsContact O-CB 3.27Å; L71-L75 WeakPolarHBondContact O-CB 3.36Å; L71-L75 WeakPolarHBondContact O-CG 3.43Å; L71-L75 PolarHBondContact O-N 3.06Å; Q73-L75 PolarHBondContact O-N 3.06Å; L75-L78 HydrophobicContact CD2-CD2 4.14Å; L75-L78 PolarHBondContact O-N 3.08Å; L75-A79 VanDerWaalsContact O-CB 3.28Å; L75-A79 WeakPolarHBondContact O-CB 3.46Å; L75-A79 PolarHBondContact O-N 2.67Å; L75-L90 HydrophobicContact CD2-CD2 3.99Å |
| 76 | S | 98.3 | Very high | 97.6 | Very high | 85 Ų | 85 | 76.1 Ų | 76.1 | 59% | 0.594 | 41% | 0.41 | S | S | * | . | H | α-helix | trans | -63.1 | -43.4 | 175.2 | -60.3 | 0 | 0 | 0 | 0 | 111.7 | L72 Q73 G74 K80 | L72-S76 WeakPolarHBondContact O-CB 3.22Å; L72-S76 PolarHBondContact O-N 3.41Å; L72-S76 VanDerWaalsContact O-N 3.1Å; L72-S76 PolarHBondContact O-OG 3.08Å; Q73-S76 WeakPolarHBondContact O-CB 3.28Å; Q73-S76 PolarHBondContact O-N 3.05Å; G74-S76 VanDerWaalsContact C-N 3.34Å; G74-S76 PolarHBondContact O-N 3.44Å; S76-K80 PolarHBondContact O-N 2.78Å |
| 77 | V | 98.1 | Very high | 97.8 | Very high | 49 Ų | 49 | 81 Ų | 81 | 30% | 0.297 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -68 | -44.9 | 175.9 | 177.7 | 0 | 0 | 0 | 0 | 111 | Q73 G74 A79 K80 E81 F89 F93 | Q73-V77 WeakPolarHBondContact O-CG2 3.43Å; Q73-V77 PolarHBondContact O-N 3.44Å; Q73-V77 VanDerWaalsContact O-N 3.13Å; G74-V77 PolarHBondContact O-N 3.46Å; V77-A79 VanDerWaalsContact C-N 3.32Å; V77-A79 PolarHBondContact O-N 2.92Å; V77-K80 WeakPolarHBondContact O-CB 3.28Å; V77-K80 PolarHBondContact O-N 2.95Å; V77-K80 VanDerWaalsContact O-N 3.12Å; V77-E81 HydrophobicContact CG1-CG 4.18Å; V77-E81 PolarHBondContact O-N 3.46Å; V77-F89 HydrophobicContact CG1-CE1 4.03Å; V77-F89 HydrophobicContact CG1-CZ 3.9Å; V77-F93 HydrophobicContact CB-CE2 4.37Å; V77-F93 HydrophobicContact CG2-CE2 4.05Å; V77-F93 HydrophobicContact CG2-CZ 4.43Å |
| 78 | L | 98.3 | Very high | 97.9 | Very high | 28 Ų | 28 | 84.5 Ų | 84.5 | 15% | 0.147 | 45% | 0.446 | C | S | . | . | H | α-helix | trans | -56.9 | -45.3 | 177.5 | -177.9 | 76.2 | 0 | 0 | 0 | 111.8 | G74 L75 K80 E81 R82 P83 P86 F89 | G74-L78 VanDerWaalsContact O-CB 3.29Å; G74-L78 WeakPolarHBondContact O-CB 3.31Å; G74-L78 PolarHBondContact O-N 3.39Å; L75-L78 HydrophobicContact CD2-CD2 4.14Å; L75-L78 PolarHBondContact O-N 3.08Å; L78-K80 PolarHBondContact O-N 3.02Å; L78-E81 PolarHBondContact O-N 3.45Å; L78-R82 WeakPolarHBondContact O-CA 3.45Å; L78-R82 PolarHBondContact O-N 3.34Å; L78-P83 HydrophobicContact CD1-CG 3.77Å; L78-P86 HydrophobicContact CD1-CB 3.83Å; L78-P86 WeakPolarHBondContact CD1-O 3.47Å; L78-P86 HydrophobicContact CD2-CB 4.3Å; L78-P86 HydrophobicContact CG-CB 4.47Å; L78-F89 HydrophobicContact CB-CD1 4.48Å; L78-F89 HydrophobicContact CD1-CB 4.25Å; L78-F89 HydrophobicContact CD1-CD1 3.58Å; L78-F89 HydrophobicContact CD1-CE1 4.33Å; L78-F89 HydrophobicContact CD1-CG 4.23Å |
| 79 | A | 97.9 | Very high | 98 | Very high | 65 Ų | 65 | 85.8 Ų | 85.8 | 54% | 0.537 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -64.4 | -28.9 | 179.8 | 0 | 0 | 0 | 0 | 0 | 112.9 | L75 V77 R82 | L75-A79 VanDerWaalsContact O-CB 3.28Å; L75-A79 WeakPolarHBondContact O-CB 3.46Å; L75-A79 PolarHBondContact O-N 2.67Å; V77-A79 VanDerWaalsContact C-N 3.32Å; V77-A79 PolarHBondContact O-N 2.92Å; A79-R82 WeakPolarHBondContact O-CG 3.46Å |
| 80 | K | 98.1 | Very high | 98 | Very high | 171 Ų | 171 | 84.9 Ų | 84.9 | 74% | 0.743 | 44% | 0.441 | S | S | * | . | H | α-helix | trans | -77.9 | -49.5 | 176.7 | -174.6 | -175.7 | 176.9 | -174.1 | 0 | 112.2 | S76 V77 L78 | S76-K80 PolarHBondContact O-N 2.78Å; V77-K80 WeakPolarHBondContact O-CB 3.28Å; V77-K80 PolarHBondContact O-N 2.95Å; V77-K80 VanDerWaalsContact O-N 3.12Å; L78-K80 PolarHBondContact O-N 3.02Å |
| 81 | E | 97.8 | Very high | 98.1 | Very high | 118 Ų | 118 | 86.5 Ų | 86.5 | 55% | 0.551 | 46% | 0.456 | S | S | * | . | H | α-helix | trans | -79.3 | -29.9 | -174.3 | -64.6 | -64.7 | 138.7 | 0 | 0 | 112.9 | V77 L78 F89 | V77-E81 HydrophobicContact CG1-CG 4.18Å; V77-E81 PolarHBondContact O-N 3.46Å; L78-E81 PolarHBondContact O-N 3.45Å; E81-F89 HydrophobicContact CG-CZ 4.44Å |
| 82 | R | 97.9 | Very high | 98.1 | Very high | 213 Ų | 213 | 86.7 Ų | 86.7 | 80% | 0.804 | 47% | 0.465 | S | S | * | . | trans | 42.5 | 56.5 | -176.2 | -62.2 | -169 | 174.4 | -166.1 | -2.4 | 113.8 | L78 A79 | L78-R82 WeakPolarHBondContact O-CA 3.45Å; L78-R82 PolarHBondContact O-N 3.34Å; A79-R82 WeakPolarHBondContact O-CG 3.46Å | ||
| 83 | P | 97.6 | Very high | 98.1 | Very high | 37 Ų | 37 | 82.9 Ų | 82.9 | 24% | 0.24 | 44% | 0.444 | C | S | . | . | trans | -65.6 | 156.3 | -178.8 | 30.2 | -36.3 | 0 | 0 | 0 | 111.7 | L78 N85 F89 | L78-P83 HydrophobicContact CD1-CG 3.77Å; P83-N85 PolarHBondContact O-N 2.89Å; P83-F89 HydrophobicContact CB-CB 4.32Å; P83-F89 HydrophobicContact CB-CD2 4.24Å; P83-F89 HydrophobicContact CB-CG 4.37Å; P83-F89 HydrophobicContact CG-CB 3.63Å; P83-F89 HydrophobicContact CG-CD1 4.12Å; P83-F89 HydrophobicContact CG-CD2 3.93Å; P83-F89 HydrophobicContact CG-CG 3.63Å | ||
| 84 | T | 97.8 | Very high | 98.1 | Very high | 140 Ų | 140 | 81 Ų | 81 | 86% | 0.859 | 44% | 0.437 | S | S | * | . | S | Bend | trans | -57.3 | -35.9 | -179.7 | -39.9 | 0 | 0 | 0 | 0 | 112.9 | P86 | T84-P86 VanDerWaalsContact O-CD 3.28Å; T84-P86 WeakPolarHBondContact O-CD 3.27Å |
| 85 | N | 97.9 | Very high | 98 | Very high | 93 Ų | 93 | 87.5 Ų | 87.5 | 50% | 0.497 | 47% | 0.471 | S | S | . | . | S | Bend | trans | -114.3 | 82.8 | 178.5 | -62.2 | -21 | 0 | 0 | 0 | 110.2 | P83 I87 E88 F89 | P83-N85 PolarHBondContact O-N 2.89Å; N85-I87 PolarHBondContact O-N 3.43Å; N85-E88 HydrophobicContact CB-CB 4Å; N85-E88 PolarHBondContact ND2-OE2 3.26Å; N85-E88 VanDerWaalsContact ND2-OE2 3.1Å; N85-E88 PolarHBondContact O-N 2.77Å; N85-F89 WeakPolarHBondContact O-CB 3.2Å; N85-F89 PolarHBondContact O-N 3.1Å; N85-F89 VanDerWaalsContact O-N 3.09Å |
| 86 | P | 97.8 | Very high | 98 | Very high | 63 Ų | 63 | 91.6 Ų | 91.6 | 41% | 0.409 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -66 | -35.2 | -170.7 | 23.8 | -34.1 | 0 | 0 | 0 | 113.8 | L78 T84 L90 | L78-P86 HydrophobicContact CD1-CB 3.83Å; L78-P86 WeakPolarHBondContact CD1-O 3.47Å; L78-P86 HydrophobicContact CD2-CB 4.3Å; L78-P86 HydrophobicContact CG-CB 4.47Å; T84-P86 VanDerWaalsContact O-CD 3.28Å; T84-P86 WeakPolarHBondContact O-CD 3.27Å; P86-L90 WeakPolarHBondContact O-CB 3.29Å; P86-L90 PolarHBondContact O-N 2.97Å |
| 87 | I | 98.3 | Very high | 97.9 | Very high | 144 Ų | 144 | 88.6 Ų | 88.6 | 74% | 0.738 | 46% | 0.462 | S | S | * | . | H | α-helix | trans | -69.3 | -46.9 | -179.3 | -62.3 | 173.2 | 0 | 0 | 0 | 110.6 | N85 F89 L90 A91 | N85-I87 PolarHBondContact O-N 3.43Å; I87-F89 VanDerWaalsContact C-N 3.35Å; I87-F89 PolarHBondContact O-N 3.05Å; I87-L90 PolarHBondContact O-N 3.33Å; I87-A91 WeakPolarHBondContact O-CB 3.35Å; I87-A91 PolarHBondContact O-N 3.28Å |
| 88 | E | 98.4 | Very high | 97.7 | Very high | 131 Ų | 131 | 91.6 Ų | 91.6 | 61% | 0.612 | 47% | 0.471 | S | S | * | . | H | α-helix | trans | -62.3 | -44.1 | 179.2 | -173.7 | 179.3 | -176.1 | 0 | 0 | 111.1 | N85 L90 A91 A92 | N85-E88 HydrophobicContact CB-CB 4Å; N85-E88 PolarHBondContact ND2-OE2 3.26Å; N85-E88 VanDerWaalsContact ND2-OE2 3.1Å; N85-E88 PolarHBondContact O-N 2.77Å; E88-L90 PolarHBondContact O-N 3.13Å; E88-A91 PolarHBondContact O-N 3.49Å; E88-A92 WeakPolarHBondContact O-CB 3.42Å; E88-A92 PolarHBondContact O-N 2.86Å |
| 89 | F | 98.6 | Very high | 97.4 | Very high | 67 Ų | 67 | 93.9 Ų | 93.9 | 29% | 0.294 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -58.6 | -47.9 | 174.6 | -180 | -87 | 0 | 0 | 0 | 112 | V77 L78 E81 P83 N85 I87 A92 F93 | V77-F89 HydrophobicContact CG1-CE1 4.03Å; V77-F89 HydrophobicContact CG1-CZ 3.9Å; L78-F89 HydrophobicContact CB-CD1 4.48Å; L78-F89 HydrophobicContact CD1-CB 4.25Å; L78-F89 HydrophobicContact CD1-CD1 3.58Å; L78-F89 HydrophobicContact CD1-CE1 4.33Å; L78-F89 HydrophobicContact CD1-CG 4.23Å; E81-F89 HydrophobicContact CG-CZ 4.44Å; P83-F89 HydrophobicContact CB-CB 4.32Å; P83-F89 HydrophobicContact CB-CD2 4.24Å; P83-F89 HydrophobicContact CB-CG 4.37Å; P83-F89 HydrophobicContact CG-CB 3.63Å; P83-F89 HydrophobicContact CG-CD1 4.12Å; P83-F89 HydrophobicContact CG-CD2 3.93Å; P83-F89 HydrophobicContact CG-CG 3.63Å; N85-F89 WeakPolarHBondContact O-CB 3.2Å; N85-F89 PolarHBondContact O-N 3.1Å; N85-F89 VanDerWaalsContact O-N 3.09Å; I87-F89 VanDerWaalsContact C-N 3.35Å; I87-F89 PolarHBondContact O-N 3.05Å; F89-A92 PolarHBondContact O-N 2.86Å; F89-F93 WeakPolarHBondContact O-CB 3.39Å; F89-F93 PolarHBondContact O-N 3.39Å |
| 90 | L | 98.3 | Very high | 97.2 | Very high | 29 Ų | 29 | 96.5 Ų | 96.5 | 15% | 0.152 | 49% | 0.491 | C | S | . | . | H | α-helix | trans | -64.3 | -43.3 | -179.7 | -176.5 | 62 | 0 | 0 | 0 | 111.2 | L75 P86 I87 E88 A92 F93 L94 | L75-L90 HydrophobicContact CD2-CD2 3.99Å; P86-L90 WeakPolarHBondContact O-CB 3.29Å; P86-L90 PolarHBondContact O-N 2.97Å; I87-L90 PolarHBondContact O-N 3.33Å; E88-L90 PolarHBondContact O-N 3.13Å; L90-A92 PolarHBondContact O-N 3.48Å; L90-F93 WeakPolarHBondContact O-CB 3.3Å; L90-F93 PolarHBondContact O-N 2.81Å; L90-L94 VanDerWaalsContact O-CG 3.3Å; L90-L94 WeakPolarHBondContact O-CG 3.43Å; L90-L94 PolarHBondContact O-N 3.46Å |
| 91 | A | 98.2 | Very high | 96.8 | Very high | 49 Ų | 49 | 89.6 Ų | 89.6 | 41% | 0.405 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -59.3 | -46 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.7 | I87 E88 F93 L94 L95 | I87-A91 WeakPolarHBondContact O-CB 3.35Å; I87-A91 PolarHBondContact O-N 3.28Å; E88-A91 PolarHBondContact O-N 3.49Å; A91-F93 VanDerWaalsContact C-N 3.32Å; A91-F93 PolarHBondContact O-N 3.35Å; A91-L94 PolarHBondContact O-N 3.18Å; A91-L95 WeakPolarHBondContact O-CG 3.39Å; A91-L95 PolarHBondContact O-N 3.44Å |
| 92 | A | 98.1 | Very high | 96.2 | Very high | 57 Ų | 57 | 89.7 Ų | 89.7 | 47% | 0.471 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -61.5 | -40.4 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112 | E88 F89 L90 L95 K96 | E88-A92 WeakPolarHBondContact O-CB 3.42Å; E88-A92 PolarHBondContact O-N 2.86Å; F89-A92 PolarHBondContact O-N 2.86Å; L90-A92 PolarHBondContact O-N 3.48Å; A92-L95 PolarHBondContact O-N 2.93Å; A92-K96 VanDerWaalsContact O-CB 3.28Å; A92-K96 WeakPolarHBondContact O-CB 3.35Å; A92-K96 PolarHBondContact O-N 3.33Å |
| 93 | F | 98.2 | Very high | 94.8 | Very high | 28 Ų | 28 | 86 Ų | 86 | 12% | 0.123 | 46% | 0.458 | C | S | . | . | H | α-helix | trans | -60.3 | -47.1 | 175 | -177.2 | -84.2 | 0 | 0 | 0 | 111.4 | I70 Q73 G74 V77 F89 L90 A91 K96 N97 | I70-F93 HydrophobicContact CG1-CE1 4.42Å; Q73-F93 HydrophobicContact CG-CZ 4.06Å; G74-F93 VanDerWaalsContact CA-CD1 3.46Å; V77-F93 HydrophobicContact CB-CE2 4.37Å; V77-F93 HydrophobicContact CG2-CE2 4.05Å; V77-F93 HydrophobicContact CG2-CZ 4.43Å; F89-F93 WeakPolarHBondContact O-CB 3.39Å; F89-F93 PolarHBondContact O-N 3.39Å; L90-F93 WeakPolarHBondContact O-CB 3.3Å; L90-F93 PolarHBondContact O-N 2.81Å; A91-F93 VanDerWaalsContact C-N 3.32Å; A91-F93 PolarHBondContact O-N 3.35Å; F93-K96 PolarHBondContact O-N 2.9Å; F93-N97 HydrophobicContact CE1-CB 4.46Å; F93-N97 WeakPolarHBondContact O-CB 3.5Å; F93-N97 PolarHBondContact O-N 3.26Å; F93-N97 VanDerWaalsContact O-N 3.08Å; F93-N97 PolarHBondContact O-ND2 3.48Å |
| 94 | L | 97.9 | Very high | 93.4 | Very high | 51 Ų | 51 | 92.2 Ų | 92.2 | 27% | 0.267 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -60.7 | -47.4 | 178.8 | -66.3 | 178.2 | 0 | 0 | 0 | 111.2 | I70 L71 L90 A91 N97 K98 | I70-L94 HydrophobicContact CB-CD2 4.25Å; I70-L94 HydrophobicContact CD1-CD2 3.85Å; I70-L94 HydrophobicContact CG1-CD2 3.68Å; I70-L94 HydrophobicContact CG2-CD2 3.82Å; L71-L94 HydrophobicContact CD2-CD1 3.99Å; L71-L94 HydrophobicContact CD2-CD2 4.09Å; L90-L94 VanDerWaalsContact O-CG 3.3Å; L90-L94 WeakPolarHBondContact O-CG 3.43Å; L90-L94 PolarHBondContact O-N 3.46Å; A91-L94 PolarHBondContact O-N 3.18Å; L94-N97 PolarHBondContact O-N 3.12Å; L94-K98 WeakPolarHBondContact O-CA 3.47Å; L94-K98 WeakPolarHBondContact O-CB 3.39Å; L94-K98 PolarHBondContact O-N 3.28Å |
| 95 | L | 97.4 | Very high | 91.4 | Very high | 135 Ų | 135 | 91.5 Ų | 91.5 | 71% | 0.707 | 47% | 0.468 | S | S | * | . | H | α-helix | trans | -64.4 | -41.7 | 180 | -68.8 | 174.8 | 0 | 0 | 0 | 112.5 | A91 A92 N97 | A91-L95 WeakPolarHBondContact O-CG 3.39Å; A91-L95 PolarHBondContact O-N 3.44Å; A92-L95 PolarHBondContact O-N 2.93Å; L95-N97 VanDerWaalsContact C-N 3.33Å; L95-N97 PolarHBondContact O-N 2.9Å |
| 96 | K | 97.1 | Very high | 91.1 | Very high | 171 Ų | 171 | 91.5 Ų | 91.5 | 74% | 0.743 | 47% | 0.466 | S | S | * | . | H | α-helix | trans | -65.7 | -35 | 178.9 | -178.8 | 176.2 | 176.9 | 179.5 | 0 | 112.8 | A92 F93 | A92-K96 VanDerWaalsContact O-CB 3.28Å; A92-K96 WeakPolarHBondContact O-CB 3.35Å; A92-K96 PolarHBondContact O-N 3.33Å; F93-K96 PolarHBondContact O-N 2.9Å |
| 97 | N | 96.1 | Very high | 90.7 | Very high | 21 Ų | 21 | 92.9 Ų | 92.9 | 11% | 0.112 | 47% | 0.469 | C | S | . | . | H | α-helix | trans | -101.3 | -4.8 | -174.2 | -63.8 | -81.9 | 0 | 0 | 0 | 113.6 | I70 F93 L94 L95 S99 Q100 F101 | I70-N97 HydrophobicContact CD1-CB 4.11Å; F93-N97 HydrophobicContact CE1-CB 4.46Å; F93-N97 WeakPolarHBondContact O-CB 3.5Å; F93-N97 PolarHBondContact O-N 3.26Å; F93-N97 VanDerWaalsContact O-N 3.08Å; F93-N97 PolarHBondContact O-ND2 3.48Å; L94-N97 PolarHBondContact O-N 3.12Å; L95-N97 VanDerWaalsContact C-N 3.33Å; L95-N97 PolarHBondContact O-N 2.9Å; N97-S99 VanDerWaalsContact C-N 3.33Å; N97-S99 PolarHBondContact O-N 3.48Å; N97-S99 VanDerWaalsContact O-N 3.15Å; N97-Q100 WeakPolarHBondContact O-CB 3.43Å; N97-Q100 PolarHBondContact O-N 3.04Å; N97-F101 HydrophobicContact CB-CE2 4.25Å; N97-F101 WeakPolarHBondContact O-CD2 3.46Å |
| 98 | K | 93.8 | Very high | 90.3 | Very high | 112 Ų | 112 | 90.1 Ų | 90.1 | 49% | 0.487 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -44.9 | -49.8 | -174.9 | 177.4 | 174.5 | 171.6 | 169.7 | 0 | 114.1 | L94 Q100 F101 E102 | L94-K98 WeakPolarHBondContact O-CA 3.47Å; L94-K98 WeakPolarHBondContact O-CB 3.39Å; L94-K98 PolarHBondContact O-N 3.28Å; K98-Q100 PolarHBondContact O-N 3.5Å; K98-Q100 VanDerWaalsContact O-N 3.15Å; K98-F101 PolarHBondContact O-N 3.38Å; K98-E102 WeakPolarHBondContact CE-OE2 3.28Å; K98-E102 PolarHBondContact O-N 2.92Å |
| 99 | S | 93.5 | Very high | 89.8 | Confident | 77 Ų | 77 | 87.7 Ų | 87.7 | 54% | 0.538 | 45% | 0.445 | S | S | . | . | H | α-helix | trans | -61.5 | -25.8 | -175.1 | 56.1 | 0 | 0 | 0 | 0 | 114.3 | N97 F101 N103 | N97-S99 VanDerWaalsContact C-N 3.33Å; N97-S99 PolarHBondContact O-N 3.48Å; N97-S99 VanDerWaalsContact O-N 3.15Å; S99-F101 VanDerWaalsContact C-N 3.3Å; S99-N103 PolarHBondContact O-ND2 3.09Å; S99-N103 VanDerWaalsContact O-ND2 3.1Å |
| 100 | Q | 92.3 | Very high | 89.3 | Confident | 120 Ų | 120 | 89 Ų | 89 | 56% | 0.561 | 45% | 0.454 | S | S | * | . | H | α-helix | trans | -77.3 | -17.4 | 178.6 | -57.6 | -174.7 | 26.1 | 0 | 0 | 113 | N97 K98 | N97-Q100 WeakPolarHBondContact O-CB 3.43Å; N97-Q100 PolarHBondContact O-N 3.04Å; K98-Q100 PolarHBondContact O-N 3.5Å; K98-Q100 VanDerWaalsContact O-N 3.15Å |
| 101 | F | 90.9 | Very high | 88.7 | Confident | 26 Ų | 26 | 93 Ų | 93 | 11% | 0.114 | 47% | 0.474 | C | S | . | . | H | α-helix | trans | -111 | -25.9 | -177.6 | -68.1 | -93.4 | 0 | 0 | 0 | 112.7 | P69 I70 N97 K98 S99 N103 R104 | P69-F101 HydrophobicContact CB-CD1 3.96Å; P69-F101 HydrophobicContact CB-CE1 4.08Å; I70-F101 HydrophobicContact CB-CB 4.26Å; I70-F101 HydrophobicContact CB-CD1 3.85Å; I70-F101 HydrophobicContact CB-CD2 3.88Å; I70-F101 HydrophobicContact CB-CE1 4.09Å; I70-F101 HydrophobicContact CB-CE2 4.14Å; I70-F101 HydrophobicContact CB-CG 3.72Å; I70-F101 HydrophobicContact CB-CZ 4.23Å; I70-F101 HydrophobicContact CD1-CD2 3.73Å; I70-F101 HydrophobicContact CD1-CE2 4.22Å; I70-F101 HydrophobicContact CD1-CG 4.24Å; I70-F101 HydrophobicContact CG1-CD2 3.68Å; I70-F101 HydrophobicContact CG1-CE2 3.78Å; I70-F101 HydrophobicContact CG1-CG 4.08Å; I70-F101 HydrophobicContact CG1-CZ 4.23Å; N97-F101 HydrophobicContact CB-CE2 4.25Å; N97-F101 WeakPolarHBondContact O-CD2 3.46Å; K98-F101 PolarHBondContact O-N 3.38Å; S99-F101 VanDerWaalsContact C-N 3.3Å; F101-N103 PolarHBondContact O-N 3.24Å; F101-R104 PolarHBondContact O-N 3.45Å |
| 102 | E | 83.6 | Confident | 88 | Confident | 120 Ų | 120 | 96.1 Ų | 96.1 | 56% | 0.561 | 48% | 0.479 | S | S | * | . | H | α-helix | trans | -66.8 | -34.6 | -178.4 | -167.1 | 174.6 | 174.9 | 0 | 0 | 113.6 | K98 R104 | K98-E102 WeakPolarHBondContact CE-OE2 3.28Å; K98-E102 PolarHBondContact O-N 2.92Å; E102-R104 VanDerWaalsContact C-N 3.33Å; E102-R104 PolarHBondContact O-N 3.36Å |
| 103 | N | 70.1 | Confident | 87.2 | Confident | 136 Ų | 136 | 99.2 Ų | 99.2 | 73% | 0.727 | 48% | 0.48 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -89.1 | 5.6 | -176.5 | -63.2 | -72.8 | 0 | 0 | 0 | 114.2 | S99 F101 | S99-N103 PolarHBondContact O-ND2 3.09Å; S99-N103 VanDerWaalsContact O-ND2 3.1Å; F101-N103 PolarHBondContact O-N 3.24Å |
| 104 | R | 66.8 | Low | 86.3 | Confident | 167 Ų | 167 | 105.1 Ų | 105.1 | 63% | 0.63 | 51% | 0.51 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -99.2 | 8.2 | -175.1 | -146.1 | 160.4 | 76.5 | -145.2 | 10.4 | 113.2 | F101 E102 | F101-R104 PolarHBondContact O-N 3.45Å; E102-R104 VanDerWaalsContact C-N 3.33Å; E102-R104 PolarHBondContact O-N 3.36Å |
| 105 | N | 55.8 | Low | 85.2 | Confident | 125 Ų | 125 | 110 Ų | 110 | 67% | 0.668 | 53% | 0.532 | S | S | * | . | trans | -123.7 | 0 | -175.5 | -134.1 | 75.5 | 0 | 0 | 0 | 110.8 | Q65 | Q65-N105 PolarHBondContact O-OD1 3.1Å; Q65-N105 PolarHBondContact OE1-ND2 3.4Å |
Retrieved 105 of 105 residues in 734.2 ms
(Link to these results)