| 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 | 34.7 | Very low | 32.7 | Very low | 249 Ų | 249 | 165.3 Ų | 165.3 | 100% | 1.227 | 84% | 0.84 | S | S | * | * | 0 | 116 | 0 | -95.8 | 156.6 | 154.4 | 0 | 0 | 108 | |||||
| 2 | N | 30.6 | Very low | 32.4 | Very low | 140 Ų | 140 | 160.2 Ų | 160.2 | 75% | 0.749 | 83% | 0.83 | S | S | * | * | trans | 10.4 | 125.3 | 164.9 | -77.6 | -1.5 | 0 | 0 | 0 | 123.3 | ||||
| 3 | Y | 31 | Very low | 32.2 | Very low | 210 Ų | 210 | 157.8 Ų | 157.8 | 82% | 0.824 | 83% | 0.828 | S | S | * | * | trans | 49.3 | 124.3 | 136.3 | -64.1 | -78.8 | 0 | 0 | 0 | 121.8 | ||||
| 4 | T | 31 | Very low | 32.1 | Very low | 123 Ų | 123 | 152.1 Ų | 152.1 | 76% | 0.755 | 82% | 0.815 | S | S | * | * | trans | -152.5 | 125.3 | 146.2 | -29.3 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 5 | E | 31.1 | Very low | 32.1 | Very low | 185 Ų | 185 | 153.3 Ų | 153.3 | 86% | 0.864 | 82% | 0.818 | S | S | * | * | trans | 64.8 | 162.1 | 144.3 | -84.5 | -177.7 | 127.4 | 0 | 0 | 124.2 | ||||
| 6 | S | 30.8 | Very low | 32 | Very low | 93 Ų | 93 | 147.8 Ų | 147.8 | 65% | 0.65 | 81% | 0.81 | S | S | * | * | trans | -124 | 159.2 | -146.4 | 46.7 | 0 | 0 | 0 | 0 | 113 | ||||
| 7 | S | 31.8 | Very low | 32 | Very low | 112 Ų | 112 | 150.9 Ų | 150.9 | 78% | 0.783 | 81% | 0.814 | S | S | * | * | trans | 83.5 | 162.4 | 154.8 | -49.8 | 0 | 0 | 0 | 0 | 117.2 | ||||
| 8 | P | 42.8 | Very low | 32.1 | Very low | 119 Ų | 119 | 149.6 Ų | 149.6 | 77% | 0.773 | 81% | 0.812 | S | S | * | * | cis | -136.7 | 174.5 | -1.5 | 28.4 | -4.1 | 0 | 0 | 0 | 116.9 | ||||
| 9 | L | 35.3 | Very low | 32.6 | Very low | 165 Ų | 165 | 148 Ų | 148 | 86% | 0.864 | 81% | 0.81 | S | S | * | * | trans | -13.2 | 135.4 | 154.5 | -89.7 | 143.8 | 0 | 0 | 0 | 119.3 | ||||
| 10 | R | 30.2 | Very low | 33 | Very low | 249 Ų | 249 | 150.2 Ų | 150.2 | 94% | 0.94 | 81% | 0.814 | S | S | * | * | trans | -163.1 | 128.9 | 133.5 | -147.7 | 168.2 | 168.5 | 176.6 | -4.7 | 113.7 | ||||
| 11 | E | 30.8 | Very low | 33.2 | Very low | 173 Ų | 173 | 150.5 Ų | 150.5 | 81% | 0.808 | 81% | 0.814 | S | S | * | * | trans | -83.6 | 162.9 | 172.4 | -111.5 | 175.3 | 163.5 | 0 | 0 | 113.2 | ||||
| 12 | S | 29.5 | Very low | 33.5 | Very low | 104 Ų | 104 | 147.1 Ų | 147.1 | 73% | 0.727 | 80% | 0.796 | S | S | * | * | trans | 103.9 | 106.7 | 146.2 | -82.1 | 0 | 0 | 0 | 0 | 121.4 | ||||
| 13 | T | 29 | Very low | 33.8 | Very low | 130 Ų | 130 | 144.7 Ų | 144.7 | 80% | 0.798 | 79% | 0.789 | S | S | * | * | 83.5 | 112.4 | 122.9 | -38.6 | 0 | 0 | 0 | 0 | 120 | |||||
| 14 | A | 30.9 | Very low | 34.2 | Very low | 78 Ų | 78 | 140.7 Ų | 140.7 | 65% | 0.645 | 78% | 0.781 | S | S | * | * | 166.6 | 120.9 | 113.3 | 0 | 0 | 0 | 0 | 0 | 114.4 | |||||
| 15 | I | 32.8 | Very low | 34.7 | Very low | 169 Ų | 169 | 141.6 Ų | 141.6 | 87% | 0.867 | 78% | 0.78 | S | S | * | * | trans | 69.8 | 121 | 132.8 | -51.7 | 166.5 | 0 | 0 | 0 | 119.5 | ||||
| 16 | G | 30.6 | Very low | 35.4 | Very low | 66 Ų | 66 | 137.6 Ų | 137.6 | 68% | 0.68 | 77% | 0.77 | S | S | * | * | trans | 139.9 | 81.6 | 144.4 | 0 | 0 | 0 | 0 | 0 | 118.3 | ||||
| 17 | F | 30.8 | Very low | 36.2 | Very low | 201 Ų | 201 | 139 Ų | 139 | 88% | 0.882 | 77% | 0.774 | S | S | * | * | trans | 24.9 | 107.3 | 149.9 | -64.8 | -87.4 | 0 | 0 | 0 | 121.6 | ||||
| 18 | T | 35.3 | Very low | 37.1 | Very low | 127 Ų | 127 | 138.9 Ų | 138.9 | 78% | 0.779 | 77% | 0.771 | S | S | * | * | trans | -7.2 | 148.5 | 146.2 | 50 | 0 | 0 | 0 | 0 | 120 | ||||
| 19 | P | 40.7 | Very low | 37.3 | Very low | 119 Ų | 119 | 136.2 Ų | 136.2 | 77% | 0.773 | 76% | 0.755 | S | S | * | * | -140.3 | 175 | 59.5 | 37.2 | -17.4 | 0 | 0 | 0 | 116.2 | |||||
| 20 | E | 39.9 | Very low | 38.3 | Very low | 192 Ų | 192 | 135.2 Ų | 135.2 | 90% | 0.897 | 75% | 0.751 | S | S | * | * | trans | 85.1 | 87.5 | -177.1 | -59.8 | -171.1 | 118.1 | 0 | 0 | 116.2 | ||||
| 21 | L | 38 | Very low | 39.5 | Very low | 156 Ų | 156 | 129.9 Ų | 129.9 | 82% | 0.817 | 74% | 0.736 | S | S | * | * | -173.2 | 80.6 | 112.2 | -164.4 | 67.4 | 0 | 0 | 0 | 108.3 | S23 | L21-S23 PolarHBondContact O-N 3.23Š| |||
| 22 | E | 40.3 | Very low | 40.8 | Very low | 179 Ų | 179 | 126.7 Ų | 126.7 | 84% | 0.836 | 73% | 0.729 | S | S | * | * | trans | -73.1 | 75.4 | 165.1 | -157.8 | 162.3 | 177.3 | 0 | 0 | 107.5 | I24 | E22-I24 HydrophobicContact CG-CD1 4.48Å; E22-I24 HydrophobicContact CG-CG1 4.04Å; E22-I24 PolarHBondContact O-N 3.47Å | ||
| 23 | S | 37.4 | Very low | 42.1 | Very low | 88 Ų | 88 | 124.3 Ų | 124.3 | 62% | 0.615 | 72% | 0.715 | S | S | * | * | trans | -79.3 | 82.6 | 162 | 69.5 | 0 | 0 | 0 | 0 | 107.7 | L21 I25 | L21-S23 PolarHBondContact O-N 3.23Å; S23-I25 VanDerWaalsContact C-N 3.31Å; S23-I25 PolarHBondContact O-N 3.24Å | ||
| 24 | I | 39.8 | Very low | 43.6 | Very low | 127 Ų | 127 | 122.5 Ų | 122.5 | 65% | 0.651 | 71% | 0.707 | S | S | * | * | trans | -50.4 | 102 | 156.2 | -61.5 | 169.2 | 0 | 0 | 0 | 105.7 | E22 P26 | E22-I24 HydrophobicContact CG-CD1 4.48Å; E22-I24 HydrophobicContact CG-CG1 4.04Å; E22-I24 PolarHBondContact O-N 3.47Å; I24-P26 WeakPolarHBondContact O-CD 3.36Å | ||
| 25 | I | 42 | Very low | 45 | Very low | 142 Ų | 142 | 124.1 Ų | 124.1 | 73% | 0.728 | 70% | 0.701 | S | S | * | * | trans | -68.9 | 110.8 | 155.2 | -63.3 | 179.1 | 0 | 0 | 0 | 103.9 | S23 V27 | S23-I25 VanDerWaalsContact C-N 3.31Å; S23-I25 PolarHBondContact O-N 3.24Å; I25-V27 PolarHBondContact O-N 3.2Å; I25-V27 VanDerWaalsContact O-N 3.1Å | ||
| 26 | P | 45.8 | Very low | 46.1 | Very low | 100 Ų | 100 | 120.6 Ų | 120.6 | 65% | 0.649 | 68% | 0.684 | S | S | * | * | trans | -69.8 | 113.7 | 166.3 | 2.3 | 16.7 | 0 | 0 | 0 | 104.6 | I24 P28 | I24-P26 WeakPolarHBondContact O-CD 3.36Å; P26-P28 WeakPolarHBondContact O-CD 3.43Å; P26-P28 VanDerWaalsContact O-N 3.1Å | ||
| 27 | V | 47.3 | Very low | 47.5 | Very low | 123 Ų | 123 | 124.5 Ų | 124.5 | 75% | 0.745 | 68% | 0.678 | S | S | * | * | trans | -49.7 | 118.7 | 154.1 | 174.9 | 0 | 0 | 0 | 0 | 105.2 | I25 S29 | I25-V27 PolarHBondContact O-N 3.2Å; I25-V27 VanDerWaalsContact O-N 3.1Å; V27-S29 PolarHBondContact O-N 3.46Å | ||
| 28 | P | 49.8 | Very low | 48.8 | Very low | 110 Ų | 110 | 123.5 Ų | 123.5 | 71% | 0.714 | 67% | 0.669 | S | S | * | * | trans | -65.9 | 105.8 | 177.5 | 26.2 | -30.1 | 0 | 0 | 0 | 106.3 | P26 N30 | P26-P28 WeakPolarHBondContact O-CD 3.43Å; P26-P28 VanDerWaalsContact O-N 3.1Å; P28-N30 PolarHBondContact O-N 3.19Å | ||
| 29 | S | 47.8 | Very low | 49.8 | Very low | 63 Ų | 63 | 123.4 Ų | 123.4 | 44% | 0.441 | 66% | 0.66 | S | S | . | * | trans | -65.3 | 119.4 | 172.5 | 47.5 | 0 | 0 | 0 | 0 | 107.3 | V27 E31 | V27-S29 PolarHBondContact O-N 3.46Å; S29-E31 PolarHBondContact O-N 3.16Å; S29-E31 PolarHBondContact OG-OE2 2.66Å | ||
| 30 | N | 55.9 | Low | 50.8 | Low | 144 Ų | 144 | 118.9 Ų | 118.9 | 77% | 0.77 | 63% | 0.628 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -65.3 | 28.4 | 167.4 | -81 | -24.6 | 0 | 0 | 0 | 112.4 | P28 | P28-N30 PolarHBondContact O-N 3.19Š|
| 31 | E | 54.6 | Low | 52 | Low | 136 Ų | 136 | 113.9 Ų | 113.9 | 64% | 0.636 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -79.9 | -25.2 | -178.1 | -73.7 | 174.3 | 164.7 | 0 | 0 | 111.7 | S29 E35 | S29-E31 PolarHBondContact O-N 3.16Å; S29-E31 PolarHBondContact OG-OE2 2.66Å; E31-E35 WeakPolarHBondContact O-CG 3.48Å; E31-E35 PolarHBondContact O-N 3.4Å |
| 32 | T | 58.3 | Low | 53.8 | Low | 106 Ų | 106 | 109.6 Ų | 109.6 | 65% | 0.65 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -76.9 | -26.1 | -177.3 | 56.5 | 0 | 0 | 0 | 0 | 114 | N36 | T32-N36 PolarHBondContact O-ND2 3.06Å |
| 33 | A | 57.4 | Low | 55.9 | Low | 54 Ų | 54 | 107 Ų | 107 | 45% | 0.446 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -70.8 | -45.9 | 175.9 | 0 | 0 | 0 | 0 | 0 | 110.7 | N36 | A33-N36 PolarHBondContact O-N 3.21Å |
| 34 | C | 61 | Low | 58.2 | Low | 92 Ų | 92 | 104.1 Ų | 104.1 | 62% | 0.622 | 55% | 0.55 | S | S | * | * | H | α-helix | trans | -69 | -33.5 | -178.7 | -89.4 | 0 | 0 | 0 | 0 | 114.4 | N36 W37 R38 | C34-N36 VanDerWaalsContact C-N 3.31Å; C34-N36 PolarHBondContact O-N 3.26Å; C34-W37 WeakPolarHBondContact O-CB 3.21Å; C34-W37 PolarHBondContact O-N 3.25Å; C34-W37 VanDerWaalsContact O-N 3.07Å; C34-R38 PolarHBondContact O-N 3.14Å |
| 35 | E | 58.6 | Low | 60.5 | Low | 112 Ų | 112 | 99.7 Ų | 99.7 | 52% | 0.523 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -63 | -37.4 | 176.7 | -75 | -122.6 | 125.1 | 0 | 0 | 112.4 | E31 W37 R38 | E31-E35 WeakPolarHBondContact O-CG 3.48Å; E31-E35 PolarHBondContact O-N 3.4Å; E35-W37 PolarHBondContact O-N 3.03Å; E35-R38 WeakPolarHBondContact O-CB 3.27Å; E35-R38 PolarHBondContact O-N 3.12Å; E35-R38 VanDerWaalsContact O-N 3.1Å; E35-R38 IonicContact OE1-CZ 2.67Å; E35-R38 IonicContact OE1-NH1 2.87Å; E35-R38 PolarHBondContact OE1-NH1 3.39Å; E35-R38 IonicContact OE1-NH2 2.92Å; E35-R38 PolarHBondContact OE1-NH2 3.46Å |
| 36 | N | 57.5 | Low | 62.8 | Low | 95 Ų | 95 | 97 Ų | 97 | 51% | 0.508 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -60.8 | -32.4 | 173.2 | -79.9 | -64.1 | 0 | 0 | 0 | 112.3 | T32 A33 C34 I40 | T32-N36 PolarHBondContact O-ND2 3.06Å; A33-N36 PolarHBondContact O-N 3.21Å; C34-N36 VanDerWaalsContact C-N 3.31Å; C34-N36 PolarHBondContact O-N 3.26Å; N36-I40 WeakPolarHBondContact O-CD1 3.48Å; N36-I40 WeakPolarHBondContact O-CG1 3.24Å; N36-I40 PolarHBondContact O-N 2.92Å |
| 37 | W | 59.7 | Low | 65 | Low | 148 Ų | 148 | 95 Ų | 95 | 56% | 0.561 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -70.7 | -29.8 | 176 | -65 | 92 | 0 | 0 | 0 | 113 | C34 E35 E39 I40 H41 | C34-W37 WeakPolarHBondContact O-CB 3.21Å; C34-W37 PolarHBondContact O-N 3.25Å; C34-W37 VanDerWaalsContact O-N 3.07Å; E35-W37 PolarHBondContact O-N 3.03Å; W37-E39 VanDerWaalsContact C-N 3.29Å; W37-E39 PolarHBondContact O-N 3.1Å; W37-I40 HydrophobicContact CD2-CD1 4.49Å; W37-I40 HydrophobicContact CE3-CD1 4.49Å; W37-I40 WeakPolarHBondContact O-CB 3.11Å; W37-I40 PolarHBondContact O-N 3.49Å; W37-I40 VanDerWaalsContact O-N 3.16Å; W37-H41 AromaticContact CE3-NE2 3.68Å; W37-H41 PolarHBondContact O-CD2 3.1Å; W37-H41 PolarHBondContact O-N 3Å |
| 38 | R | 57.7 | Low | 67.1 | Low | 181 Ų | 181 | 89.1 Ų | 89.1 | 68% | 0.683 | 46% | 0.461 | S | S | * | . | H | α-helix | trans | -65.8 | -33.4 | -179.6 | -164.8 | 168.3 | 69.7 | -152.1 | -8.1 | 112.5 | C34 E35 | C34-R38 PolarHBondContact O-N 3.14Å; E35-R38 WeakPolarHBondContact O-CB 3.27Å; E35-R38 PolarHBondContact O-N 3.12Å; E35-R38 VanDerWaalsContact O-N 3.1Å; E35-R38 IonicContact OE1-CZ 2.67Å; E35-R38 IonicContact OE1-NH1 2.87Å; E35-R38 PolarHBondContact OE1-NH1 3.39Å; E35-R38 IonicContact OE1-NH2 2.92Å; E35-R38 PolarHBondContact OE1-NH2 3.46Å |
| 39 | E | 57.3 | Low | 69.2 | Low | 125 Ų | 125 | 86.8 Ų | 86.8 | 58% | 0.584 | 44% | 0.442 | S | S | * | . | H | α-helix | trans | -78.1 | -28.9 | 175.4 | -156.4 | 164 | -151.8 | 0 | 0 | 112 | W37 | W37-E39 VanDerWaalsContact C-N 3.29Å; W37-E39 PolarHBondContact O-N 3.1Å |
| 40 | I | 60 | Low | 71.4 | Confident | 23 Ų | 23 | 88.8 Ų | 88.8 | 12% | 0.118 | 45% | 0.447 | C | S | . | . | H | α-helix | trans | -72.3 | -38.2 | 176.6 | -63.7 | 162.5 | 0 | 0 | 0 | 111.6 | N36 W37 H42 W83 | N36-I40 WeakPolarHBondContact O-CD1 3.48Å; N36-I40 WeakPolarHBondContact O-CG1 3.24Å; N36-I40 PolarHBondContact O-N 2.92Å; W37-I40 HydrophobicContact CD2-CD1 4.49Å; W37-I40 HydrophobicContact CE3-CD1 4.49Å; W37-I40 WeakPolarHBondContact O-CB 3.11Å; W37-I40 PolarHBondContact O-N 3.49Å; W37-I40 VanDerWaalsContact O-N 3.16Å; I40-H42 PolarHBondContact O-N 3.48Å; I40-H42 VanDerWaalsContact O-N 3.13Å; I40-W83 HydrophobicContact CB-CZ2 4.42Å; I40-W83 HydrophobicContact CG2-CH2 4.36Å; I40-W83 HydrophobicContact CG2-CZ2 3.92Å; I40-W83 WeakPolarHBondContact O-CZ2 3.09Å; I40-W83 PolarHBondContact O-NE1 3.05Å; I40-W83 VanDerWaalsContact O-NE1 3.13Å |
| 41 | H | 65.2 | Low | 73.2 | Confident | 88 Ų | 88 | 82.4 Ų | 82.4 | 41% | 0.407 | 41% | 0.414 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -87.3 | 40.3 | -176.2 | -77.6 | -81.4 | 0 | 0 | 0 | 114 | W37 H46 | W37-H41 AromaticContact CE3-NE2 3.68Å; W37-H41 PolarHBondContact O-CD2 3.1Å; W37-H41 PolarHBondContact O-N 3Å; H41-H46 AromaticContact CG-NE2 3.94Å; H41-H46 AromaticContact ND1-CE1 3.53Å; H41-H46 AromaticContact ND1-NE2 3.21Å; H41-H46 PolarHBondContact ND1-NE2 3.08Å |
| 42 | H | 76.6 | Confident | 75.1 | Confident | 66 Ų | 66 | 77.8 Ų | 77.8 | 31% | 0.306 | 39% | 0.391 | S | S | . | . | trans | -63.3 | 146.7 | 176.2 | -163.7 | -98.2 | 0 | 0 | 0 | 111 | I40 V44 F45 Y87 | I40-H42 PolarHBondContact O-N 3.48Å; I40-H42 VanDerWaalsContact O-N 3.13Å; H42-V44 VanDerWaalsContact ND1-CG2 3.33Å; H42-V44 WeakPolarHBondContact ND1-CG2 3.28Å; H42-V44 PolarHBondContact ND1-N 3.39Å; H42-V44 PolarHBondContact O-N 2.94Å; H42-F45 VanDerWaalsContact O-CB 3.3Å; H42-F45 WeakPolarHBondContact O-CB 3.31Å; H42-F45 PolarHBondContact O-N 3.38Å; H42-Y87 AromaticContact CD2-CE1 3.5Å; H42-Y87 VanDerWaalsContact CD2-CE1 3.5Å; H42-Y87 WeakPolarHBondContact CD2-CE1 3.32Å; H42-Y87 AromaticContact CD2-CZ 3.89Å; H42-Y87 AromaticContact CE1-CE1 3.84Å; H42-Y87 AromaticContact CE1-CZ 3.43Å; H42-Y87 VanDerWaalsContact CE1-CZ 3.43Å; H42-Y87 PolarHBondContact CE1-OH 3.37Å; H42-Y87 AromaticContact CG-CE1 3.81Å; H42-Y87 AromaticContact CG-CZ 3.88Å; H42-Y87 AromaticContact ND1-CE1 4Å; H42-Y87 AromaticContact ND1-CE2 3.9Å; H42-Y87 AromaticContact ND1-CZ 3.59Å; H42-Y87 AromaticContact NE2-CE1 3.55Å; H42-Y87 AromaticContact NE2-CZ 3.64Å; H42-Y87 PolarHBondContact NE2-OH 2.81Å | ||
| 43 | L | 84.5 | Confident | 76.8 | Confident | 125 Ų | 125 | 75.1 Ų | 75.1 | 65% | 0.654 | 38% | 0.38 | S | S | * | . | H | α-helix | trans | -51.2 | -35.6 | -178.7 | -177.9 | 148.4 | 0 | 0 | 0 | 112.5 | F45 H46 V47 | L43-F45 VanDerWaalsContact C-N 3.29Å; L43-F45 PolarHBondContact O-N 3.48Å; L43-H46 PolarHBondContact O-N 2.91Å; L43-V47 HydrophobicContact CD2-CG2 3.59Å; L43-V47 HydrophobicContact CG-CG2 4.28Å; L43-V47 WeakPolarHBondContact O-CG2 3.47Å; L43-V47 PolarHBondContact O-N 3.3Å |
| 44 | V | 85.4 | Confident | 78.6 | Confident | 26 Ų | 26 | 75.8 Ų | 75.8 | 16% | 0.158 | 38% | 0.378 | C | S | . | . | H | α-helix | trans | -58.4 | -38.5 | 177.4 | 179.4 | 0 | 0 | 0 | 0 | 112.2 | H42 A48 L79 W83 | H42-V44 VanDerWaalsContact ND1-CG2 3.33Å; H42-V44 WeakPolarHBondContact ND1-CG2 3.28Å; H42-V44 PolarHBondContact ND1-N 3.39Å; H42-V44 PolarHBondContact O-N 2.94Å; V44-A48 WeakPolarHBondContact O-CB 3.41Å; V44-A48 PolarHBondContact O-N 3.16Å; V44-L79 HydrophobicContact CG1-CB 4.26Å; V44-L79 HydrophobicContact CG1-CD2 4.36Å; V44-L79 WeakPolarHBondContact CG1-O 3.42Å; V44-W83 HydrophobicContact CG1-CB 4Å |
| 45 | F | 87.7 | Confident | 80.1 | Confident | 35 Ų | 35 | 71.4 Ų | 71.4 | 15% | 0.154 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -65.1 | -44.7 | 176.6 | 173.8 | -94 | 0 | 0 | 0 | 111.5 | H42 L43 A48 N49 Y80 W83 | H42-F45 VanDerWaalsContact O-CB 3.3Å; H42-F45 WeakPolarHBondContact O-CB 3.31Å; H42-F45 PolarHBondContact O-N 3.38Å; L43-F45 VanDerWaalsContact C-N 3.29Å; L43-F45 PolarHBondContact O-N 3.48Å; F45-A48 PolarHBondContact O-N 3.34Å; F45-N49 VanDerWaalsContact CE1-ND2 3.3Å; F45-N49 WeakPolarHBondContact CE1-ND2 3.49Å; F45-N49 VanDerWaalsContact CZ-ND2 3.31Å; F45-N49 WeakPolarHBondContact CZ-ND2 3.21Å; F45-N49 PolarHBondContact O-N 3.48Å; F45-N49 VanDerWaalsContact O-N 3.12Å; F45-N49 PolarHBondContact O-ND2 3.26Å; F45-Y80 AromaticContact CD2-CE2 3.9Å; F45-Y80 HydrophobicContact CD2-CE2 3.9Å; F45-Y80 AromaticContact CE2-CE2 3.75Å; F45-Y80 HydrophobicContact CE2-CE2 3.75Å; F45-Y80 AromaticContact CE2-CZ 3.69Å; F45-Y80 VanDerWaalsContact CE2-OH 3.28Å; F45-Y80 WeakPolarHBondContact CE2-OH 3.36Å; F45-W83 HydrophobicContact CB-CD2 4.3Å; F45-W83 HydrophobicContact CB-CG 4.18Å; F45-W83 HydrophobicContact CD2-CD2 4.16Å; F45-W83 HydrophobicContact CD2-CE3 4.26Å; F45-W83 HydrophobicContact CD2-CH2 4.32Å; F45-W83 HydrophobicContact CD2-CZ2 4.23Å; F45-W83 HydrophobicContact CD2-CZ3 4.35Å |
| 46 | H | 89.9 | Confident | 81.6 | Confident | 86 Ų | 86 | 72.3 Ų | 72.3 | 40% | 0.398 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -66.6 | -41.5 | 178.4 | -71.3 | -68.8 | 0 | 0 | 0 | 111.9 | H41 L43 A48 N49 I50 | H41-H46 AromaticContact CG-NE2 3.94Å; H41-H46 AromaticContact ND1-CE1 3.53Å; H41-H46 AromaticContact ND1-NE2 3.21Å; H41-H46 PolarHBondContact ND1-NE2 3.08Å; L43-H46 PolarHBondContact O-N 2.91Å; H46-A48 VanDerWaalsContact C-N 3.34Å; H46-A48 PolarHBondContact O-N 3.41Å; H46-N49 PolarHBondContact O-N 3.04Å; H46-I50 VanDerWaalsContact O-CG1 3.27Å; H46-I50 WeakPolarHBondContact O-CG1 3.2Å; H46-I50 PolarHBondContact O-N 3.47Å |
| 47 | V | 92.4 | Very high | 83.3 | Confident | 56 Ų | 56 | 73.3 Ų | 73.3 | 34% | 0.339 | 37% | 0.366 | S | S | . | . | H | α-helix | trans | -63.9 | -39.1 | 176.1 | 177.8 | 0 | 0 | 0 | 0 | 111.5 | L43 I50 C51 L79 | L43-V47 HydrophobicContact CD2-CG2 3.59Å; L43-V47 HydrophobicContact CG-CG2 4.28Å; L43-V47 WeakPolarHBondContact O-CG2 3.47Å; L43-V47 PolarHBondContact O-N 3.3Å; V47-I50 PolarHBondContact O-N 3.25Å; V47-C51 PolarHBondContact O-N 3.36Å; V47-C51 PolarHBondContact O-SG 3.14Å; V47-L79 HydrophobicContact CB-CD1 4.49Å; V47-L79 HydrophobicContact CG1-CD1 3.77Å |
| 48 | A | 92.4 | Very high | 84.8 | Confident | 0 Ų | 0 | 67.6 Ų | 67.6 | 0% | 0 | 35% | 0.346 | C | S | . | . | H | α-helix | trans | -60.6 | -46.4 | 175.5 | 0 | 0 | 0 | 0 | 0 | 111.9 | V44 F45 H46 C51 F52 L79 Y80 | V44-A48 WeakPolarHBondContact O-CB 3.41Å; V44-A48 PolarHBondContact O-N 3.16Å; F45-A48 PolarHBondContact O-N 3.34Å; H46-A48 VanDerWaalsContact C-N 3.34Å; H46-A48 PolarHBondContact O-N 3.41Å; A48-C51 WeakPolarHBondContact O-CB 3.39Å; A48-C51 PolarHBondContact O-N 3.34Å; A48-F52 WeakPolarHBondContact O-CD2 3.34Å; A48-F52 PolarHBondContact O-N 3.17Å; A48-L79 HydrophobicContact CB-CB 3.73Å; A48-Y80 HydrophobicContact CB-CD2 3.87Å |
| 49 | N | 92.8 | Very high | 86.2 | Confident | 62 Ų | 62 | 62.4 Ų | 62.4 | 33% | 0.332 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -66.5 | -37.4 | 177.7 | -75.4 | -66 | 0 | 0 | 0 | 112.9 | F45 H46 C51 F52 A53 | F45-N49 VanDerWaalsContact CE1-ND2 3.3Å; F45-N49 WeakPolarHBondContact CE1-ND2 3.49Å; F45-N49 VanDerWaalsContact CZ-ND2 3.31Å; F45-N49 WeakPolarHBondContact CZ-ND2 3.21Å; F45-N49 PolarHBondContact O-N 3.48Å; F45-N49 VanDerWaalsContact O-N 3.12Å; F45-N49 PolarHBondContact O-ND2 3.26Å; H46-N49 PolarHBondContact O-N 3.04Å; N49-C51 VanDerWaalsContact C-N 3.3Å; N49-C51 PolarHBondContact O-N 3.28Å; N49-F52 PolarHBondContact O-N 3.02Å; N49-A53 WeakPolarHBondContact O-CB 3.35Å; N49-A53 PolarHBondContact O-N 3.22Å |
| 50 | I | 94.5 | Very high | 87.5 | Confident | 104 Ų | 104 | 62 Ų | 62 | 53% | 0.533 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -62 | -41.8 | 172.2 | -69.8 | 165.2 | 0 | 0 | 0 | 110 | H46 V47 F52 A53 V54 | H46-I50 VanDerWaalsContact O-CG1 3.27Å; H46-I50 WeakPolarHBondContact O-CG1 3.2Å; H46-I50 PolarHBondContact O-N 3.47Å; V47-I50 PolarHBondContact O-N 3.25Å; I50-F52 VanDerWaalsContact C-N 3.34Å; I50-F52 PolarHBondContact O-N 3.01Å; I50-A53 PolarHBondContact O-N 3.03Å; I50-V54 HydrophobicContact CG2-CG2 4.16Å; I50-V54 WeakPolarHBondContact O-CB 3.23Å; I50-V54 VanDerWaalsContact O-CG2 3.28Å; I50-V54 WeakPolarHBondContact O-CG2 3.35Å; I50-V54 PolarHBondContact O-N 3.38Å |
| 51 | C | 93.6 | Very high | 88.5 | Confident | 11 Ų | 11 | 66.8 Ų | 66.8 | 7% | 0.074 | 37% | 0.373 | C | S | . | . | H | α-helix | trans | -60.8 | -42.5 | 176.6 | -72.3 | 0 | 0 | 0 | 0 | 111.9 | V47 A48 N49 G55 M72 | V47-C51 PolarHBondContact O-N 3.36Å; V47-C51 PolarHBondContact O-SG 3.14Å; A48-C51 WeakPolarHBondContact O-CB 3.39Å; A48-C51 PolarHBondContact O-N 3.34Å; N49-C51 VanDerWaalsContact C-N 3.3Å; N49-C51 PolarHBondContact O-N 3.28Å; C51-G55 PolarHBondContact O-N 2.93Å; C51-M72 HydrophobicContact CB-CE 3.83Å |
| 52 | F | 94.5 | Very high | 89.3 | Confident | 38 Ų | 38 | 66.7 Ų | 66.7 | 17% | 0.167 | 38% | 0.375 | C | S | . | . | H | α-helix | trans | -63.2 | -46.1 | 173.6 | -64.7 | -41.7 | 0 | 0 | 0 | 112.6 | A48 N49 I50 V54 G55 L56 L73 Y80 | A48-F52 WeakPolarHBondContact O-CD2 3.34Å; A48-F52 PolarHBondContact O-N 3.17Å; N49-F52 PolarHBondContact O-N 3.02Å; I50-F52 VanDerWaalsContact C-N 3.34Å; I50-F52 PolarHBondContact O-N 3.01Å; F52-V54 PolarHBondContact O-N 3.19Å; F52-G55 PolarHBondContact O-N 2.88Å; F52-L56 WeakPolarHBondContact O-CG 3.38Å; F52-L56 PolarHBondContact O-N 3.02Å; F52-L73 HydrophobicContact CD1-CD2 3.88Å; F52-L73 HydrophobicContact CE1-CD2 4.29Å; F52-Y80 AromaticContact CE2-CD2 4Å; F52-Y80 HydrophobicContact CE2-CD2 4Å |
| 53 | A | 94.9 | Very high | 89.3 | Confident | 51 Ų | 51 | 70.7 Ų | 70.7 | 42% | 0.421 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -60.1 | -48.1 | 178.1 | 0 | 0 | 0 | 0 | 0 | 111.5 | N49 I50 G55 L56 V57 | N49-A53 WeakPolarHBondContact O-CB 3.35Å; N49-A53 PolarHBondContact O-N 3.22Å; I50-A53 PolarHBondContact O-N 3.03Å; A53-G55 VanDerWaalsContact C-N 3.31Å; A53-G55 PolarHBondContact O-N 3.43Å; A53-L56 PolarHBondContact O-N 2.71Å; A53-V57 WeakPolarHBondContact O-CB 3.29Å; A53-V57 WeakPolarHBondContact O-CG2 3.31Å; A53-V57 PolarHBondContact O-N 2.88Å |
| 54 | V | 93.7 | Very high | 89.3 | Confident | 67 Ų | 67 | 68.4 Ų | 68.4 | 41% | 0.406 | 38% | 0.381 | S | S | . | . | H | α-helix | trans | -59.2 | -45 | 175.5 | 171.8 | 0 | 0 | 0 | 0 | 110.2 | I50 F52 L56 V57 I58 M72 | I50-V54 HydrophobicContact CG2-CG2 4.16Å; I50-V54 WeakPolarHBondContact O-CB 3.23Å; I50-V54 VanDerWaalsContact O-CG2 3.28Å; I50-V54 WeakPolarHBondContact O-CG2 3.35Å; I50-V54 PolarHBondContact O-N 3.38Å; F52-V54 PolarHBondContact O-N 3.19Å; V54-L56 VanDerWaalsContact C-N 3.28Å; V54-L56 PolarHBondContact O-N 3.49Å; V54-V57 PolarHBondContact O-N 3.47Å; V54-I58 HydrophobicContact CG1-CD1 4.4Å; V54-I58 WeakPolarHBondContact O-CD1 3.03Å; V54-I58 WeakPolarHBondContact O-CG1 3.17Å; V54-I58 PolarHBondContact O-N 3.49Å; V54-M72 HydrophobicContact CB-CE 4Å; V54-M72 HydrophobicContact CG1-CE 3.9Å; V54-M72 HydrophobicContact CG1-CG 4.43Å |
| 55 | G | 92.1 | Very high | 89.6 | Confident | 0 Ų | 0 | 68.3 Ų | 68.3 | 0% | 0 | 38% | 0.379 | C | S | . | . | H | α-helix | trans | -50 | -47.4 | 175 | 0 | 0 | 0 | 0 | 0 | 113.1 | C51 F52 A53 L69 | C51-G55 PolarHBondContact O-N 2.93Å; F52-G55 PolarHBondContact O-N 2.88Å; A53-G55 VanDerWaalsContact C-N 3.31Å; A53-G55 PolarHBondContact O-N 3.43Å; G55-L69 WeakPolarHBondContact O-CD1 3.29Å |
| 56 | L | 90.6 | Very high | 89.7 | Confident | 131 Ų | 131 | 71 Ų | 71 | 69% | 0.686 | 39% | 0.393 | S | S | * | . | H | α-helix | trans | -79.1 | -26.9 | -176.4 | -64.6 | 173.4 | 0 | 0 | 0 | 114.1 | F52 A53 V54 L69 | F52-L56 WeakPolarHBondContact O-CG 3.38Å; F52-L56 PolarHBondContact O-N 3.02Å; A53-L56 PolarHBondContact O-N 2.71Å; V54-L56 VanDerWaalsContact C-N 3.28Å; V54-L56 PolarHBondContact O-N 3.49Å; L56-L69 HydrophobicContact CD2-CD1 4.34Å |
| 57 | V | 94 | Very high | 89.7 | Confident | 117 Ų | 117 | 68.4 Ų | 68.4 | 71% | 0.709 | 38% | 0.382 | S | S | * | . | H | α-helix | trans | -84.3 | -18.4 | -177.3 | 171.8 | 0 | 0 | 0 | 0 | 112.6 | A53 V54 | A53-V57 WeakPolarHBondContact O-CB 3.29Å; A53-V57 WeakPolarHBondContact O-CG2 3.31Å; A53-V57 PolarHBondContact O-N 2.88Å; V54-V57 PolarHBondContact O-N 3.47Å |
| 58 | I | 90.5 | Very high | 89.7 | Confident | 28 Ų | 28 | 70.9 Ų | 70.9 | 14% | 0.144 | 39% | 0.388 | C | S | . | . | S | Bend | trans | -55.5 | 125.8 | 180 | -69.8 | 151.2 | 0 | 0 | 0 | 109.8 | V54 L62 H65 F68 M72 | V54-I58 HydrophobicContact CG1-CD1 4.4Å; V54-I58 WeakPolarHBondContact O-CD1 3.03Å; V54-I58 WeakPolarHBondContact O-CG1 3.17Å; V54-I58 PolarHBondContact O-N 3.49Å; I58-L62 HydrophobicContact CG2-CD1 3.78Å; I58-H65 WeakPolarHBondContact CG2-ND1 3.44Å; I58-H65 PolarHBondContact O-CE1 3.32Å; I58-H65 PolarHBondContact O-ND1 2.84Å; I58-F68 HydrophobicContact CD1-CB 3.82Å; I58-M72 HydrophobicContact CD1-CG 4.31Å |
| 59 | P | 86.9 | Confident | 89.8 | Confident | 71 Ų | 71 | 72 Ų | 72 | 46% | 0.461 | 39% | 0.394 | S | S | . | . | trans | -67.8 | 142.5 | -177.6 | 24.8 | -31.5 | 0 | 0 | 0 | 111.4 | T61 L62 H65 | P59-T61 PolarHBondContact O-N 2.83Å; P59-T61 VanDerWaalsContact O-N 3.16Å; P59-L62 HydrophobicContact CG-CD1 4.3Å; P59-L62 HydrophobicContact CG-CG 4.18Å; P59-L62 PolarHBondContact O-N 3.05Å; P59-H65 PolarHBondContact O-ND1 3.18Å; P59-H65 VanDerWaalsContact O-ND1 3.11Å | ||
| 60 | T | 84.9 | Confident | 89.9 | Confident | 118 Ų | 118 | 72 Ų | 72 | 72% | 0.724 | 39% | 0.39 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -67.3 | -10.7 | 178.6 | 52.2 | 0 | 0 | 0 | 0 | 113.3 | L62 | T60-L62 VanDerWaalsContact C-N 3.27Å; T60-L62 PolarHBondContact O-N 3.37Å |
| 61 | T | 80.9 | Confident | 89.9 | Confident | 123 Ų | 123 | 68.2 Ų | 68.2 | 76% | 0.755 | 38% | 0.376 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -72.7 | -15.4 | 178.2 | 56.4 | 0 | 0 | 0 | 0 | 113.7 | P59 | P59-T61 PolarHBondContact O-N 2.83Å; P59-T61 VanDerWaalsContact O-N 3.16Å |
| 62 | L | 81.9 | Confident | 89.9 | Confident | 86 Ų | 86 | 69.6 Ų | 69.6 | 45% | 0.45 | 38% | 0.382 | S | S | . | . | S | Bend | trans | -77.4 | 131.2 | 177.2 | -59.9 | -179.7 | 0 | 0 | 0 | 111.2 | I58 P59 T60 L64 H65 | I58-L62 HydrophobicContact CG2-CD1 3.78Å; P59-L62 HydrophobicContact CG-CD1 4.3Å; P59-L62 HydrophobicContact CG-CG 4.18Å; P59-L62 PolarHBondContact O-N 3.05Å; T60-L62 VanDerWaalsContact C-N 3.27Å; T60-L62 PolarHBondContact O-N 3.37Å; L62-L64 PolarHBondContact O-N 2.98Å; L62-H65 HydrophobicContact CB-CB 4.26Å; L62-H65 WeakPolarHBondContact O-CB 3.37Å; L62-H65 PolarHBondContact O-N 3.48Å |
| 63 | H | 77.4 | Confident | 89.9 | Confident | 150 Ų | 150 | 69.3 Ų | 69.3 | 69% | 0.694 | 38% | 0.382 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -57.3 | -25.5 | 179.6 | 179.7 | -105.1 | 0 | 0 | 0 | 114.1 | K115 | H63-K115 PolarHBondContact CE1-NZ 3.44Å; H63-K115 PolarHBondContact NE2-NZ 3.06Å |
| 64 | L | 84.7 | Confident | 90 | Very high | 76 Ų | 76 | 67.9 Ų | 67.9 | 40% | 0.398 | 37% | 0.368 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -106.2 | 12.9 | 178.8 | -60.1 | 178 | 0 | 0 | 0 | 113.3 | L62 M66 I67 F68 | L62-L64 PolarHBondContact O-N 2.98Å; L64-M66 VanDerWaalsContact C-N 3.34Å; L64-M66 PolarHBondContact O-N 3.24Å; L64-I67 HydrophobicContact CD2-CD1 4.07Å; L64-I67 PolarHBondContact O-N 3.43Å; L64-F68 HydrophobicContact CB-CD2 3.75Å; L64-F68 HydrophobicContact CB-CE2 3.7Å; L64-F68 HydrophobicContact CD1-CE2 4.17Å; L64-F68 WeakPolarHBondContact O-CD2 3.48Å; L64-F68 PolarHBondContact O-N 3.21Å |
| 65 | H | 90.3 | Very high | 90.1 | Very high | 24 Ų | 24 | 68.5 Ų | 68.5 | 11% | 0.111 | 37% | 0.368 | C | S | . | . | H | α-helix | trans | -47 | -52.9 | -175.8 | 167.7 | 81.5 | 0 | 0 | 0 | 112.7 | I58 P59 L62 I67 F68 L69 | I58-H65 WeakPolarHBondContact CG2-ND1 3.44Å; I58-H65 PolarHBondContact O-CE1 3.32Å; I58-H65 PolarHBondContact O-ND1 2.84Å; P59-H65 PolarHBondContact O-ND1 3.18Å; P59-H65 VanDerWaalsContact O-ND1 3.11Å; L62-H65 HydrophobicContact CB-CB 4.26Å; L62-H65 WeakPolarHBondContact O-CB 3.37Å; L62-H65 PolarHBondContact O-N 3.48Å; H65-I67 VanDerWaalsContact C-N 3.26Å; H65-I67 PolarHBondContact O-N 3Å; H65-F68 PolarHBondContact O-N 2.94Å; H65-F68 VanDerWaalsContact O-N 3.17Å; H65-L69 WeakPolarHBondContact O-CB 3.41Å; H65-L69 PolarHBondContact O-N 3.42Å |
| 66 | M | 89.7 | Confident | 90.2 | Very high | 91 Ų | 91 | 68.5 Ų | 68.5 | 45% | 0.448 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -62.4 | -30.9 | -177.7 | -68 | -60.4 | -68.1 | 0 | 0 | 113.6 | L64 L69 R70 L111 | L64-M66 VanDerWaalsContact C-N 3.34Å; L64-M66 PolarHBondContact O-N 3.24Å; M66-L69 HydrophobicContact SD-CD2 4.37Å; M66-R70 VanDerWaalsContact O-CG 3.24Å; M66-R70 WeakPolarHBondContact O-CG 3.46Å; M66-R70 PolarHBondContact O-N 2.97Å; M66-L111 HydrophobicContact CB-CD1 4.05Å |
| 67 | I | 91.8 | Very high | 90.5 | Very high | 32 Ų | 32 | 62.4 Ų | 62.4 | 16% | 0.164 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -74.3 | -45.2 | 176.9 | -70.6 | 168 | 0 | 0 | 0 | 109.7 | L64 H65 R70 G71 L108 L111 L112 K115 | L64-I67 HydrophobicContact CD2-CD1 4.07Å; L64-I67 PolarHBondContact O-N 3.43Å; H65-I67 VanDerWaalsContact C-N 3.26Å; H65-I67 PolarHBondContact O-N 3Å; I67-R70 PolarHBondContact O-N 3.4Å; I67-G71 PolarHBondContact O-N 3.02Å; I67-L108 HydrophobicContact CG2-CD1 3.99Å; I67-L111 HydrophobicContact CG1-CB 4.03Å; I67-L112 HydrophobicContact CD1-CD2 4.48Å; I67-L112 HydrophobicContact CG2-CD2 4.23Å; I67-K115 HydrophobicContact CD1-CB 4.01Å; I67-K115 HydrophobicContact CD1-CG 3.97Å |
| 68 | F | 92.1 | Very high | 90.5 | Very high | 108 Ų | 108 | 59.2 Ų | 59.2 | 47% | 0.474 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -64 | -43.7 | 177.3 | -78.3 | -70.8 | 0 | 0 | 0 | 112.2 | I58 L64 H65 R70 G71 M72 | I58-F68 HydrophobicContact CD1-CB 3.82Å; L64-F68 HydrophobicContact CB-CD2 3.75Å; L64-F68 HydrophobicContact CB-CE2 3.7Å; L64-F68 HydrophobicContact CD1-CE2 4.17Å; L64-F68 WeakPolarHBondContact O-CD2 3.48Å; L64-F68 PolarHBondContact O-N 3.21Å; H65-F68 PolarHBondContact O-N 2.94Å; H65-F68 VanDerWaalsContact O-N 3.17Å; F68-R70 PolarHBondContact O-N 3.36Å; F68-G71 PolarHBondContact O-N 2.76Å; F68-M72 WeakPolarHBondContact O-CB 3.5Å; F68-M72 VanDerWaalsContact O-CG 3.31Å; F68-M72 WeakPolarHBondContact O-CG 3.47Å; F68-M72 PolarHBondContact O-N 2.99Å |
| 69 | L | 93.9 | Very high | 90.6 | Very high | 25 Ų | 25 | 59.9 Ų | 59.9 | 13% | 0.131 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -53.6 | -53.4 | 174.3 | 172 | 65.9 | 0 | 0 | 0 | 111 | G55 L56 H65 M66 M72 L73 | G55-L69 WeakPolarHBondContact O-CD1 3.29Å; L56-L69 HydrophobicContact CD2-CD1 4.34Å; H65-L69 WeakPolarHBondContact O-CB 3.41Å; H65-L69 PolarHBondContact O-N 3.42Å; M66-L69 HydrophobicContact SD-CD2 4.37Å; L69-M72 PolarHBondContact O-N 3.48Å; L69-L73 HydrophobicContact CD1-CD1 3.85Å; L69-L73 HydrophobicContact CD1-CG 4.43Å; L69-L73 HydrophobicContact CG-CD1 4.01Å; L69-L73 WeakPolarHBondContact O-CB 3.5Å; L69-L73 WeakPolarHBondContact O-CD1 3.41Å; L69-L73 VanDerWaalsContact O-CG 3.29Å; L69-L73 WeakPolarHBondContact O-CG 3.4Å; L69-L73 PolarHBondContact O-N 3.19Å |
| 70 | R | 94.1 | Very high | 90.8 | Very high | 61 Ų | 61 | 58.8 Ų | 58.8 | 23% | 0.23 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -66.7 | -37.6 | -179.6 | -65 | -64.5 | 177.4 | -173 | -1.4 | 112.4 | M66 I67 F68 L73 T74 N104 H107 L108 L111 | M66-R70 VanDerWaalsContact O-CG 3.24Å; M66-R70 WeakPolarHBondContact O-CG 3.46Å; M66-R70 PolarHBondContact O-N 2.97Å; I67-R70 PolarHBondContact O-N 3.4Å; F68-R70 PolarHBondContact O-N 3.36Å; R70-L73 PolarHBondContact O-N 2.8Å; R70-T74 WeakPolarHBondContact O-CB 3.46Å; R70-T74 PolarHBondContact O-N 3.29Å; R70-T74 PolarHBondContact O-OG1 2.91Å; R70-T74 VanDerWaalsContact O-OG1 3.06Å; R70-N104 VanDerWaalsContact CD-OD1 3.24Å; R70-N104 WeakPolarHBondContact CD-OD1 3.47Å; R70-N104 PolarHBondContact NH1-OD1 3.3Å; R70-H107 HydrophobicContact CG-CB 4.47Å; R70-L108 HydrophobicContact CB-CB 4.16Å; R70-L108 HydrophobicContact CB-CD1 4.24Å; R70-L111 HydrophobicContact CG-CD1 4.06Å |
| 71 | G | 94.4 | Very high | 91.2 | Very high | 24 Ų | 24 | 54.5 Ų | 54.5 | 25% | 0.247 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -63.5 | -45.2 | 175.8 | 0 | 0 | 0 | 0 | 0 | 113.1 | I67 F68 T74 L75 | I67-G71 PolarHBondContact O-N 3.02Å; F68-G71 PolarHBondContact O-N 2.76Å; G71-T74 PolarHBondContact O-N 3.33Å; G71-L75 PolarHBondContact O-N 3.48Å |
| 72 | M | 94.9 | Very high | 91.7 | Very high | 41 Ų | 41 | 51.6 Ų | 51.6 | 20% | 0.202 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -68.3 | -36.5 | 178 | -68.9 | -54.2 | -65.5 | 0 | 0 | 112.3 | C51 V54 I58 F68 L69 L75 G76 | C51-M72 HydrophobicContact CB-CE 3.83Å; V54-M72 HydrophobicContact CB-CE 4Å; V54-M72 HydrophobicContact CG1-CE 3.9Å; V54-M72 HydrophobicContact CG1-CG 4.43Å; I58-M72 HydrophobicContact CD1-CG 4.31Å; F68-M72 WeakPolarHBondContact O-CB 3.5Å; F68-M72 VanDerWaalsContact O-CG 3.31Å; F68-M72 WeakPolarHBondContact O-CG 3.47Å; F68-M72 PolarHBondContact O-N 2.99Å; L69-M72 PolarHBondContact O-N 3.48Å; M72-L75 PolarHBondContact O-N 2.91Å; M72-G76 PolarHBondContact O-N 2.52Å |
| 73 | L | 94.9 | Very high | 92 | Very high | 31 Ų | 31 | 48 Ų | 48 | 16% | 0.162 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -64.8 | -43.6 | 172.2 | -72.7 | 163.9 | 0 | 0 | 0 | 111.7 | F52 L69 R70 L75 G76 C77 | F52-L73 HydrophobicContact CD1-CD2 3.88Å; F52-L73 HydrophobicContact CE1-CD2 4.29Å; L69-L73 HydrophobicContact CD1-CD1 3.85Å; L69-L73 HydrophobicContact CD1-CG 4.43Å; L69-L73 HydrophobicContact CG-CD1 4.01Å; L69-L73 WeakPolarHBondContact O-CB 3.5Å; L69-L73 WeakPolarHBondContact O-CD1 3.41Å; L69-L73 VanDerWaalsContact O-CG 3.29Å; L69-L73 WeakPolarHBondContact O-CG 3.4Å; L69-L73 PolarHBondContact O-N 3.19Å; R70-L73 PolarHBondContact O-N 2.8Å; L73-L75 PolarHBondContact O-N 2.97Å; L73-G76 PolarHBondContact O-N 2.86Å; L73-C77 WeakPolarHBondContact O-CB 3.29Å; L73-C77 PolarHBondContact O-N 2.82Å; L73-C77 PolarHBondContact O-SG 2.93Å |
| 74 | T | 96.1 | Very high | 92.6 | Very high | 21 Ų | 21 | 40.9 Ų | 40.9 | 13% | 0.129 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -58.7 | -47 | 173.7 | -68 | 0 | 0 | 0 | 0 | 111.2 | R70 G71 C77 T78 L101 N104 I105 | R70-T74 WeakPolarHBondContact O-CB 3.46Å; R70-T74 PolarHBondContact O-N 3.29Å; R70-T74 PolarHBondContact O-OG1 2.91Å; R70-T74 VanDerWaalsContact O-OG1 3.06Å; G71-T74 PolarHBondContact O-N 3.33Å; T74-C77 PolarHBondContact O-N 2.8Å; T74-T78 WeakPolarHBondContact O-CG2 3.27Å; T74-T78 PolarHBondContact O-N 2.86Å; T74-T78 PolarHBondContact O-OG1 3.08Å; T74-L101 HydrophobicContact CG2-CD1 3.66Å; T74-N104 WeakPolarHBondContact OG1-CB 3.49Å; T74-I105 HydrophobicContact CG2-CD1 4.4Å; T74-I105 HydrophobicContact CG2-CG1 3.82Å |
| 75 | L | 96.1 | Very high | 92.6 | Very high | 80 Ų | 80 | 40.3 Ų | 40.3 | 42% | 0.419 | 21% | 0.21 | S | C | . | . | H | α-helix | trans | -65.1 | -40.4 | 178.4 | -177.3 | 61.3 | 0 | 0 | 0 | 112.5 | G71 M72 L73 T78 L79 | G71-L75 PolarHBondContact O-N 3.48Å; M72-L75 PolarHBondContact O-N 2.91Å; L73-L75 PolarHBondContact O-N 2.97Å; L75-T78 PolarHBondContact O-OG1 3.25Å; L75-L79 HydrophobicContact CD1-CD1 4.39Å; L75-L79 HydrophobicContact CD1-CG 4.48Å; L75-L79 HydrophobicContact CG-CD1 4.24Å; L75-L79 VanDerWaalsContact O-CG 3.26Å; L75-L79 WeakPolarHBondContact O-CG 3.19Å; L75-L79 PolarHBondContact O-N 2.94Å; L75-L79 VanDerWaalsContact O-N 3.15Å |
| 76 | G | 94.9 | Very high | 92.2 | Very high | 0 Ų | 0 | 45 Ų | 45 | 0% | 0 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -62.3 | -46.1 | 174.5 | 0 | 0 | 0 | 0 | 0 | 111.9 | M72 L73 T78 L79 Y80 | M72-G76 PolarHBondContact O-N 2.52Å; L73-G76 PolarHBondContact O-N 2.86Å; G76-T78 PolarHBondContact O-N 3.3Å; G76-L79 PolarHBondContact O-N 3.41Å; G76-Y80 WeakPolarHBondContact O-CB 3.03Å; G76-Y80 PolarHBondContact O-N 3.08Å |
| 77 | C | 94.9 | Very high | 91.7 | Very high | 4 Ų | 4 | 44.6 Ų | 44.6 | 3% | 0.027 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -63.5 | -40.6 | 178.5 | -70.4 | 0 | 0 | 0 | 0 | 112.5 | L73 T74 Y80 I81 L101 | L73-C77 WeakPolarHBondContact O-CB 3.29Å; L73-C77 PolarHBondContact O-N 2.82Å; L73-C77 PolarHBondContact O-SG 2.93Å; T74-C77 PolarHBondContact O-N 2.8Å; C77-Y80 PolarHBondContact O-N 3.4Å; C77-I81 WeakPolarHBondContact O-CD1 3.46Å; C77-I81 VanDerWaalsContact O-CG1 3.24Å; C77-I81 WeakPolarHBondContact O-CG1 3.42Å; C77-I81 PolarHBondContact O-N 3.44Å; C77-L101 HydrophobicContact CB-CB 4.02Å; C77-L101 HydrophobicContact CB-CD1 4.21Å |
| 78 | T | 94.7 | Very high | 90.9 | Very high | 50 Ų | 50 | 49.4 Ų | 49.4 | 31% | 0.307 | 25% | 0.246 | S | C | . | . | H | α-helix | trans | -64 | -44.4 | 176.7 | 53.6 | 0 | 0 | 0 | 0 | 111.8 | T74 L75 G76 Y80 I81 V82 L101 | T74-T78 WeakPolarHBondContact O-CG2 3.27Å; T74-T78 PolarHBondContact O-N 2.86Å; T74-T78 PolarHBondContact O-OG1 3.08Å; L75-T78 PolarHBondContact O-OG1 3.25Å; G76-T78 PolarHBondContact O-N 3.3Å; T78-Y80 VanDerWaalsContact C-N 3.32Å; T78-Y80 PolarHBondContact O-N 2.9Å; T78-I81 PolarHBondContact O-N 3.02Å; T78-V82 WeakPolarHBondContact O-CG2 3.37Å; T78-V82 PolarHBondContact O-N 3.47Å; T78-L101 HydrophobicContact CG2-CD1 3.58Å; T78-L101 HydrophobicContact CG2-CD2 3.86Å; T78-L101 HydrophobicContact CG2-CG 4.4Å |
| 79 | L | 93.3 | Very high | 90.2 | Very high | 42 Ų | 42 | 49.3 Ų | 49.3 | 22% | 0.22 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -63.3 | -38.4 | 177.1 | -68.2 | 172.5 | 0 | 0 | 0 | 111.8 | V44 V47 A48 L75 G76 V82 W83 | V44-L79 HydrophobicContact CG1-CB 4.26Å; V44-L79 HydrophobicContact CG1-CD2 4.36Å; V44-L79 WeakPolarHBondContact CG1-O 3.42Å; V47-L79 HydrophobicContact CB-CD1 4.49Å; V47-L79 HydrophobicContact CG1-CD1 3.77Å; A48-L79 HydrophobicContact CB-CB 3.73Å; L75-L79 HydrophobicContact CD1-CD1 4.39Å; L75-L79 HydrophobicContact CD1-CG 4.48Å; L75-L79 HydrophobicContact CG-CD1 4.24Å; L75-L79 VanDerWaalsContact O-CG 3.26Å; L75-L79 WeakPolarHBondContact O-CG 3.19Å; L75-L79 PolarHBondContact O-N 2.94Å; L75-L79 VanDerWaalsContact O-N 3.15Å; G76-L79 PolarHBondContact O-N 3.41Å; L79-V82 PolarHBondContact O-N 3.14Å; L79-W83 WeakPolarHBondContact O-CB 3.37Å; L79-W83 PolarHBondContact O-N 3.39Å |
| 80 | Y | 91.6 | Very high | 89.7 | Confident | 47 Ų | 47 | 49.3 Ų | 49.3 | 18% | 0.184 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -68.3 | -37.6 | 177.4 | -139.7 | -84.6 | 0 | 0 | 0 | 112.5 | F45 A48 F52 G76 C77 T78 W83 A84 I93 N97 | F45-Y80 AromaticContact CD2-CE2 3.9Å; F45-Y80 HydrophobicContact CD2-CE2 3.9Å; F45-Y80 AromaticContact CE2-CE2 3.75Å; F45-Y80 HydrophobicContact CE2-CE2 3.75Å; F45-Y80 AromaticContact CE2-CZ 3.69Å; F45-Y80 VanDerWaalsContact CE2-OH 3.28Å; F45-Y80 WeakPolarHBondContact CE2-OH 3.36Å; A48-Y80 HydrophobicContact CB-CD2 3.87Å; F52-Y80 AromaticContact CE2-CD2 4Å; F52-Y80 HydrophobicContact CE2-CD2 4Å; G76-Y80 WeakPolarHBondContact O-CB 3.03Å; G76-Y80 PolarHBondContact O-N 3.08Å; C77-Y80 PolarHBondContact O-N 3.4Å; T78-Y80 VanDerWaalsContact C-N 3.32Å; T78-Y80 PolarHBondContact O-N 2.9Å; Y80-W83 HydrophobicContact CD1-CE3 4.4Å; Y80-W83 HydrophobicContact CE1-CE3 4.27Å; Y80-W83 HydrophobicContact CE1-CZ3 4.23Å; Y80-W83 PolarHBondContact O-N 3.21Å; Y80-A84 WeakPolarHBondContact O-CB 3.29Å; Y80-A84 PolarHBondContact O-N 3.02Å; Y80-I93 HydrophobicContact CD1-CG2 3.69Å; Y80-I93 HydrophobicContact CE1-CG2 3.58Å; Y80-N97 WeakPolarHBondContact CD1-ND2 3.42Å |
| 81 | I | 92.2 | Very high | 89.3 | Confident | 28 Ų | 28 | 51.8 Ų | 51.8 | 14% | 0.144 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -63.7 | -47.1 | 172.6 | -67 | 161.7 | 0 | 0 | 0 | 110.2 | C77 T78 W83 A84 T85 N97 L101 | C77-I81 WeakPolarHBondContact O-CD1 3.46Å; C77-I81 VanDerWaalsContact O-CG1 3.24Å; C77-I81 WeakPolarHBondContact O-CG1 3.42Å; C77-I81 PolarHBondContact O-N 3.44Å; T78-I81 PolarHBondContact O-N 3.02Å; I81-W83 VanDerWaalsContact C-N 3.27Å; I81-W83 PolarHBondContact O-N 2.87Å; I81-A84 PolarHBondContact O-N 3.21Å; I81-T85 HydrophobicContact CG2-CG2 4.13Å; I81-T85 WeakPolarHBondContact O-CG2 3.43Å; I81-T85 PolarHBondContact O-N 2.86Å; I81-T85 PolarHBondContact O-OG1 3.29Å; I81-T85 VanDerWaalsContact O-OG1 3.1Å; I81-N97 HydrophobicContact CD1-CB 4.18Å; I81-N97 HydrophobicContact CG1-CB 3.57Å; I81-L101 HydrophobicContact CD1-CB 4.28Å; I81-L101 HydrophobicContact CD1-CD2 3.75Å |
| 82 | V | 90.9 | Very high | 89 | Confident | 63 Ų | 63 | 55.7 Ų | 55.7 | 38% | 0.382 | 29% | 0.293 | S | S | . | . | H | α-helix | trans | -59.7 | -39.1 | 177.6 | 171.2 | 0 | 0 | 0 | 0 | 111.4 | T78 L79 T85 L86 | T78-V82 WeakPolarHBondContact O-CG2 3.37Å; T78-V82 PolarHBondContact O-N 3.47Å; L79-V82 PolarHBondContact O-N 3.14Å; V82-T85 WeakPolarHBondContact CA-OG1 3.2Å; V82-T85 PolarHBondContact O-OG1 2.94Å; V82-L86 HydrophobicContact CG1-CD1 3.78Å; V82-L86 HydrophobicContact CG1-CG 4.45Å; V82-L86 WeakPolarHBondContact O-CB 3.3Å; V82-L86 WeakPolarHBondContact O-CG 3.48Å; V82-L86 PolarHBondContact O-N 2.8Å; V82-L86 VanDerWaalsContact O-N 3.14Å |
| 83 | W | 90 | Very high | 88.7 | Confident | 10 Ų | 10 | 56.5 Ų | 56.5 | 4% | 0.038 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -66.1 | -46.5 | 175 | 175.9 | 77.9 | 0 | 0 | 0 | 111.9 | I40 V44 F45 L79 Y80 I81 T85 Y87 R88 I93 | I40-W83 HydrophobicContact CB-CZ2 4.42Å; I40-W83 HydrophobicContact CG2-CH2 4.36Å; I40-W83 HydrophobicContact CG2-CZ2 3.92Å; I40-W83 WeakPolarHBondContact O-CZ2 3.09Å; I40-W83 PolarHBondContact O-NE1 3.05Å; I40-W83 VanDerWaalsContact O-NE1 3.13Å; V44-W83 HydrophobicContact CG1-CB 4Å; F45-W83 HydrophobicContact CB-CD2 4.3Å; F45-W83 HydrophobicContact CB-CG 4.18Å; F45-W83 HydrophobicContact CD2-CD2 4.16Å; F45-W83 HydrophobicContact CD2-CE3 4.26Å; F45-W83 HydrophobicContact CD2-CH2 4.32Å; F45-W83 HydrophobicContact CD2-CZ2 4.23Å; F45-W83 HydrophobicContact CD2-CZ3 4.35Å; L79-W83 WeakPolarHBondContact O-CB 3.37Å; L79-W83 PolarHBondContact O-N 3.39Å; Y80-W83 HydrophobicContact CD1-CE3 4.4Å; Y80-W83 HydrophobicContact CE1-CE3 4.27Å; Y80-W83 HydrophobicContact CE1-CZ3 4.23Å; Y80-W83 PolarHBondContact O-N 3.21Å; I81-W83 VanDerWaalsContact C-N 3.27Å; I81-W83 PolarHBondContact O-N 2.87Å; W83-T85 PolarHBondContact O-N 3.43Å; W83-Y87 AromaticContact CD1-CD2 3.92Å; W83-Y87 HydrophobicContact CG-CD2 4.5Å; W83-Y87 PolarHBondContact O-N 3.13Å; W83-Y87 VanDerWaalsContact O-N 3.1Å; W83-R88 HydrophobicContact CH2-CB 4.41Å; W83-R88 HydrophobicContact CH2-CG 3.89Å; W83-R88 HydrophobicContact CZ2-CG 3.91Å; W83-I93 HydrophobicContact CZ3-CD1 4.46Å |
| 84 | A | 88.5 | Confident | 88.5 | Confident | 0 Ų | 0 | 57 Ų | 57 | 0% | 0 | 30% | 0.3 | C | S | . | . | I | π-helix | trans | -67.4 | -33.2 | -179.2 | 0 | 0 | 0 | 0 | 0 | 113.3 | Y80 I81 C89 A90 I93 M94 | Y80-A84 WeakPolarHBondContact O-CB 3.29Å; Y80-A84 PolarHBondContact O-N 3.02Å; I81-A84 PolarHBondContact O-N 3.21Å; A84-C89 WeakPolarHBondContact O-CA 3.28Å; A84-C89 PolarHBondContact O-N 2.97Å; A84-A90 PolarHBondContact O-N 3.12Å; A84-I93 HydrophobicContact CB-CB 4.29Å; A84-I93 HydrophobicContact CB-CG2 3.89Å; A84-M94 HydrophobicContact CB-CG 3.6Å |
| 85 | T | 85 | Confident | 88.3 | Confident | 64 Ų | 64 | 60.2 Ų | 60.2 | 39% | 0.393 | 32% | 0.315 | S | S | . | . | I | π-helix | trans | -72.2 | -51.3 | 175.8 | 51 | 0 | 0 | 0 | 0 | 111.9 | I81 V82 W83 M94 | I81-T85 HydrophobicContact CG2-CG2 4.13Å; I81-T85 WeakPolarHBondContact O-CG2 3.43Å; I81-T85 PolarHBondContact O-N 2.86Å; I81-T85 PolarHBondContact O-OG1 3.29Å; I81-T85 VanDerWaalsContact O-OG1 3.1Å; V82-T85 WeakPolarHBondContact CA-OG1 3.2Å; V82-T85 PolarHBondContact O-OG1 2.94Å; W83-T85 PolarHBondContact O-N 3.43Å; T85-M94 HydrophobicContact CG2-CG 4.28Å; T85-M94 HydrophobicContact CG2-SD 3.09Å; T85-M94 WeakPolarHBondContact CG2-SD 3.01Å |
| 86 | L | 82.8 | Confident | 88.2 | Confident | 124 Ų | 124 | 63.1 Ų | 63.1 | 65% | 0.649 | 32% | 0.321 | S | S | * | . | I | π-helix | trans | -86 | -29.8 | -166.1 | -63.6 | -179.2 | 0 | 0 | 0 | 113.8 | V82 | V82-L86 HydrophobicContact CG1-CD1 3.78Å; V82-L86 HydrophobicContact CG1-CG 4.45Å; V82-L86 WeakPolarHBondContact O-CB 3.3Å; V82-L86 WeakPolarHBondContact O-CG 3.48Å; V82-L86 PolarHBondContact O-N 2.8Å; V82-L86 VanDerWaalsContact O-N 3.14Å |
| 87 | Y | 78.6 | Confident | 88.1 | Confident | 81 Ų | 81 | 64.1 Ų | 64.1 | 32% | 0.318 | 33% | 0.326 | S | S | . | . | I | π-helix | trans | -114.9 | -27.8 | -170.3 | -57 | -88.3 | 0 | 0 | 0 | 113.9 | H42 W83 | H42-Y87 AromaticContact CD2-CE1 3.5Å; H42-Y87 VanDerWaalsContact CD2-CE1 3.5Å; H42-Y87 WeakPolarHBondContact CD2-CE1 3.32Å; H42-Y87 AromaticContact CD2-CZ 3.89Å; H42-Y87 AromaticContact CE1-CE1 3.84Å; H42-Y87 AromaticContact CE1-CZ 3.43Å; H42-Y87 VanDerWaalsContact CE1-CZ 3.43Å; H42-Y87 PolarHBondContact CE1-OH 3.37Å; H42-Y87 AromaticContact CG-CE1 3.81Å; H42-Y87 AromaticContact CG-CZ 3.88Å; H42-Y87 AromaticContact ND1-CE1 4Å; H42-Y87 AromaticContact ND1-CE2 3.9Å; H42-Y87 AromaticContact ND1-CZ 3.59Å; H42-Y87 AromaticContact NE2-CE1 3.55Å; H42-Y87 AromaticContact NE2-CZ 3.64Å; H42-Y87 PolarHBondContact NE2-OH 2.81Å; W83-Y87 AromaticContact CD1-CD2 3.92Å; W83-Y87 HydrophobicContact CG-CD2 4.5Å; W83-Y87 PolarHBondContact O-N 3.13Å; W83-Y87 VanDerWaalsContact O-N 3.1Å |
| 88 | R | 74.2 | Confident | 88.1 | Confident | 133 Ų | 133 | 66.7 Ų | 66.7 | 50% | 0.502 | 34% | 0.344 | S | S | . | . | I | π-helix | trans | -119.8 | -14.7 | -174 | -101 | -66.3 | -158.2 | 159.7 | 4.3 | 115.4 | W83 A90 | W83-R88 HydrophobicContact CH2-CB 4.41Å; W83-R88 HydrophobicContact CH2-CG 3.89Å; W83-R88 HydrophobicContact CZ2-CG 3.91Å; R88-A90 HydrophobicContact CB-CB 4.25Å; R88-A90 PolarHBondContact O-N 3.15Å; R88-A90 VanDerWaalsContact O-N 3.11Å |
| 89 | C | 78.5 | Confident | 88.2 | Confident | 107 Ų | 107 | 67.9 Ų | 67.9 | 72% | 0.723 | 35% | 0.351 | S | S | * | . | trans | 45.7 | 38 | -173.4 | -165.1 | 0 | 0 | 0 | 0 | 113.2 | A84 L91 | A84-C89 WeakPolarHBondContact O-CA 3.28Å; A84-C89 PolarHBondContact O-N 2.97Å; C89-L91 PolarHBondContact O-N 2.85Å | ||
| 90 | A | 83.6 | Confident | 88.3 | Confident | 25 Ų | 25 | 71 Ų | 71 | 21% | 0.207 | 36% | 0.363 | C | S | . | . | trans | -93.5 | 94 | -172.8 | 0 | 0 | 0 | 0 | 0 | 111.1 | A84 R88 D92 I93 M94 | A84-A90 PolarHBondContact O-N 3.12Å; R88-A90 HydrophobicContact CB-CB 4.25Å; R88-A90 PolarHBondContact O-N 3.15Å; R88-A90 VanDerWaalsContact O-N 3.11Å; A90-D92 PolarHBondContact O-N 3.34Å; A90-I93 HydrophobicContact CB-CB 4.26Å; A90-I93 HydrophobicContact CB-CD1 3.95Å; A90-I93 HydrophobicContact CB-CG1 4.23Å; A90-I93 PolarHBondContact O-N 3.22Å; A90-M94 WeakPolarHBondContact O-CG 3.46Å; A90-M94 PolarHBondContact O-N 2.88Å; A90-M94 VanDerWaalsContact O-N 3.17Å | ||
| 91 | L | 84.9 | Confident | 88.5 | Confident | 113 Ų | 113 | 70.1 Ų | 70.1 | 59% | 0.592 | 36% | 0.362 | S | S | * | . | H | α-helix | trans | -58.7 | -43.5 | -173 | -156.1 | 171.7 | 0 | 0 | 0 | 113.1 | C89 I93 M94 I95 | C89-L91 PolarHBondContact O-N 2.85Å; L91-I93 PolarHBondContact O-N 2.99Å; L91-M94 HydrophobicContact CB-CE 4.43Å; L91-M94 HydrophobicContact CG-CE 4.39Å; L91-M94 WeakPolarHBondContact O-CB 3.37Å; L91-M94 PolarHBondContact O-N 2.75Å; L91-M94 VanDerWaalsContact O-N 3.16Å; L91-I95 HydrophobicContact CD2-CD1 3.15Å; L91-I95 HydrophobicContact CD2-CG1 3.64Å; L91-I95 PolarHBondContact O-N 2.88Å |
| 92 | D | 88.8 | Confident | 88.7 | Confident | 106 Ų | 106 | 70.7 Ų | 70.7 | 57% | 0.567 | 38% | 0.375 | S | S | * | . | H | α-helix | trans | -60.6 | -46.6 | -179.7 | -176.5 | 44.6 | 0 | 0 | 0 | 112.6 | A90 M94 I95 W96 | A90-D92 PolarHBondContact O-N 3.34Å; D92-M94 VanDerWaalsContact C-N 3.27Å; D92-M94 PolarHBondContact O-N 2.88Å; D92-I95 PolarHBondContact O-N 3.45Å; D92-W96 VanDerWaalsContact O-CD1 3.3Å; D92-W96 PolarHBondContact O-N 2.87Å; D92-W96 VanDerWaalsContact O-N 3.12Å; D92-W96 VanDerWaalsContact OD1-CD1 3.26Å; D92-W96 PolarHBondContact OD1-NE1 3.24Å |
| 93 | I | 88 | Confident | 88.9 | Confident | 57 Ų | 57 | 71 Ų | 71 | 29% | 0.292 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -61.1 | -39.3 | 176.4 | -62.7 | 177.4 | 0 | 0 | 0 | 110.7 | Y80 W83 A84 A90 L91 N97 | Y80-I93 HydrophobicContact CD1-CG2 3.69Å; Y80-I93 HydrophobicContact CE1-CG2 3.58Å; W83-I93 HydrophobicContact CZ3-CD1 4.46Å; A84-I93 HydrophobicContact CB-CB 4.29Å; A84-I93 HydrophobicContact CB-CG2 3.89Å; A90-I93 HydrophobicContact CB-CB 4.26Å; A90-I93 HydrophobicContact CB-CD1 3.95Å; A90-I93 HydrophobicContact CB-CG1 4.23Å; A90-I93 PolarHBondContact O-N 3.22Å; L91-I93 PolarHBondContact O-N 2.99Å; I93-N97 WeakPolarHBondContact CG2-ND2 3.46Å; I93-N97 WeakPolarHBondContact O-CB 3.4Å; I93-N97 PolarHBondContact O-N 3.18Å; I93-N97 VanDerWaalsContact O-N 3.1Å; I93-N97 PolarHBondContact O-ND2 3.46Å |
| 94 | M | 90.5 | Very high | 89.2 | Confident | 43 Ų | 43 | 71 Ų | 71 | 21% | 0.212 | 38% | 0.377 | C | S | . | . | H | α-helix | trans | -65 | -43.6 | 177 | -67.3 | -165.7 | -60 | 0 | 0 | 112.5 | A84 T85 A90 L91 D92 S98 | A84-M94 HydrophobicContact CB-CG 3.6Å; T85-M94 HydrophobicContact CG2-CG 4.28Å; T85-M94 HydrophobicContact CG2-SD 3.09Å; T85-M94 WeakPolarHBondContact CG2-SD 3.01Å; A90-M94 WeakPolarHBondContact O-CG 3.46Å; A90-M94 PolarHBondContact O-N 2.88Å; A90-M94 VanDerWaalsContact O-N 3.17Å; L91-M94 HydrophobicContact CB-CE 4.43Å; L91-M94 HydrophobicContact CG-CE 4.39Å; L91-M94 WeakPolarHBondContact O-CB 3.37Å; L91-M94 PolarHBondContact O-N 2.75Å; L91-M94 VanDerWaalsContact O-N 3.16Å; D92-M94 VanDerWaalsContact C-N 3.27Å; D92-M94 PolarHBondContact O-N 2.88Å; M94-S98 VanDerWaalsContact O-CB 3.27Å; M94-S98 WeakPolarHBondContact O-CB 3.35Å; M94-S98 PolarHBondContact O-N 3.1Å; M94-S98 PolarHBondContact O-OG 3.07Å |
| 95 | I | 93.3 | Very high | 89.5 | Confident | 88 Ų | 88 | 74.9 Ų | 74.9 | 45% | 0.451 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -60.3 | -53.6 | 179.4 | -73.5 | 170.3 | 0 | 0 | 0 | 109.8 | L91 D92 N97 S98 V99 | L91-I95 HydrophobicContact CD2-CD1 3.15Å; L91-I95 HydrophobicContact CD2-CG1 3.64Å; L91-I95 PolarHBondContact O-N 2.88Å; D92-I95 PolarHBondContact O-N 3.45Å; I95-N97 PolarHBondContact O-N 3.48Å; I95-S98 WeakPolarHBondContact O-CB 3.38Å; I95-S98 PolarHBondContact O-N 2.82Å; I95-S98 VanDerWaalsContact O-N 3.11Å; I95-V99 WeakPolarHBondContact O-CG2 3.28Å; I95-V99 PolarHBondContact O-N 3.27Å |
| 96 | W | 94.1 | Very high | 90 | Very high | 140 Ų | 140 | 77.4 Ų | 77.4 | 53% | 0.53 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -62.5 | -44.2 | -176.4 | -76.6 | 112.2 | 0 | 0 | 0 | 112.5 | D92 S98 V99 F100 | D92-W96 VanDerWaalsContact O-CD1 3.3Å; D92-W96 PolarHBondContact O-N 2.87Å; D92-W96 VanDerWaalsContact O-N 3.12Å; D92-W96 VanDerWaalsContact OD1-CD1 3.26Å; D92-W96 PolarHBondContact OD1-NE1 3.24Å; W96-S98 VanDerWaalsContact C-N 3.27Å; W96-S98 PolarHBondContact O-N 3.26Å; W96-V99 PolarHBondContact O-N 3.44Å; W96-F100 HydrophobicContact CB-CE2 4.42Å; W96-F100 WeakPolarHBondContact O-CD2 3.3Å; W96-F100 PolarHBondContact O-N 2.98Å |
| 97 | N | 92.5 | Very high | 90.5 | Very high | 21 Ų | 21 | 75.6 Ų | 75.6 | 11% | 0.112 | 40% | 0.395 | C | S | . | . | H | α-helix | trans | -66.2 | -30.3 | 176.6 | -78.1 | -80.4 | 0 | 0 | 0 | 112.5 | Y80 I81 I93 I95 L101 | Y80-N97 WeakPolarHBondContact CD1-ND2 3.42Å; I81-N97 HydrophobicContact CD1-CB 4.18Å; I81-N97 HydrophobicContact CG1-CB 3.57Å; I93-N97 WeakPolarHBondContact CG2-ND2 3.46Å; I93-N97 WeakPolarHBondContact O-CB 3.4Å; I93-N97 PolarHBondContact O-N 3.18Å; I93-N97 VanDerWaalsContact O-N 3.1Å; I93-N97 PolarHBondContact O-ND2 3.46Å; I95-N97 PolarHBondContact O-N 3.48Å; N97-L101 WeakPolarHBondContact O-CB 3.42Å; N97-L101 PolarHBondContact O-N 3.24Å |
| 98 | S | 94.5 | Very high | 91.2 | Very high | 58 Ų | 58 | 73.2 Ų | 73.2 | 41% | 0.406 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -68.9 | -38.9 | 174.1 | -60.8 | 0 | 0 | 0 | 0 | 112.1 | M94 I95 W96 L101 G102 | M94-S98 VanDerWaalsContact O-CB 3.27Å; M94-S98 WeakPolarHBondContact O-CB 3.35Å; M94-S98 PolarHBondContact O-N 3.1Å; M94-S98 PolarHBondContact O-OG 3.07Å; I95-S98 WeakPolarHBondContact O-CB 3.38Å; I95-S98 PolarHBondContact O-N 2.82Å; I95-S98 VanDerWaalsContact O-N 3.11Å; W96-S98 VanDerWaalsContact C-N 3.27Å; W96-S98 PolarHBondContact O-N 3.26Å; S98-L101 WeakPolarHBondContact O-CB 3.31Å; S98-L101 PolarHBondContact O-N 3.41Å; S98-G102 PolarHBondContact O-N 3.47Å |
| 99 | V | 96.4 | Very high | 92 | Very high | 75 Ų | 75 | 69.7 Ų | 69.7 | 46% | 0.455 | 38% | 0.384 | S | S | . | . | H | α-helix | trans | -63.3 | -48.6 | 173.6 | 174.5 | 0 | 0 | 0 | 0 | 110.3 | I95 W96 L101 G102 V103 | I95-V99 WeakPolarHBondContact O-CG2 3.28Å; I95-V99 PolarHBondContact O-N 3.27Å; W96-V99 PolarHBondContact O-N 3.44Å; V99-L101 VanDerWaalsContact C-N 3.29Å; V99-L101 PolarHBondContact O-N 3.17Å; V99-G102 PolarHBondContact O-N 2.87Å; V99-V103 WeakPolarHBondContact O-CG2 3.39Å; V99-V103 PolarHBondContact O-N 3.13Å |
| 100 | F | 94.6 | Very high | 92.6 | Very high | 108 Ų | 108 | 71.1 Ų | 71.1 | 47% | 0.474 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -61.9 | -38.1 | 176.3 | -69.2 | -53.5 | 0 | 0 | 0 | 112.3 | W96 N104 | W96-F100 HydrophobicContact CB-CE2 4.42Å; W96-F100 WeakPolarHBondContact O-CD2 3.3Å; W96-F100 PolarHBondContact O-N 2.98Å; F100-N104 WeakPolarHBondContact O-CB 3.46Å; F100-N104 PolarHBondContact O-N 2.88Å; F100-N104 PolarHBondContact O-ND2 2.86Å |
| 101 | L | 96.3 | Very high | 92.8 | Very high | 29 Ų | 29 | 71.5 Ų | 71.5 | 15% | 0.152 | 37% | 0.373 | C | S | . | . | H | α-helix | trans | -60 | -49.2 | 174.2 | 179.4 | 62.5 | 0 | 0 | 0 | 110.9 | T74 C77 T78 I81 N97 S98 V99 V103 N104 I105 | T74-L101 HydrophobicContact CG2-CD1 3.66Å; C77-L101 HydrophobicContact CB-CB 4.02Å; C77-L101 HydrophobicContact CB-CD1 4.21Å; T78-L101 HydrophobicContact CG2-CD1 3.58Å; T78-L101 HydrophobicContact CG2-CD2 3.86Å; T78-L101 HydrophobicContact CG2-CG 4.4Å; I81-L101 HydrophobicContact CD1-CB 4.28Å; I81-L101 HydrophobicContact CD1-CD2 3.75Å; N97-L101 WeakPolarHBondContact O-CB 3.42Å; N97-L101 PolarHBondContact O-N 3.24Å; S98-L101 WeakPolarHBondContact O-CB 3.31Å; S98-L101 PolarHBondContact O-N 3.41Å; V99-L101 VanDerWaalsContact C-N 3.29Å; V99-L101 PolarHBondContact O-N 3.17Å; L101-V103 PolarHBondContact O-N 3.45Å; L101-N104 PolarHBondContact O-N 3.35Å; L101-I105 HydrophobicContact CD1-CD1 3.73Å; L101-I105 HydrophobicContact CD1-CG1 4.06Å; L101-I105 HydrophobicContact CD2-CD1 4.44Å; L101-I105 HydrophobicContact CG-CD1 3.75Å; L101-I105 HydrophobicContact CG-CG1 4.4Å; L101-I105 WeakPolarHBondContact O-CB 3.39Å; L101-I105 VanDerWaalsContact O-CG1 3.28Å; L101-I105 WeakPolarHBondContact O-CG1 3.33Å; L101-I105 PolarHBondContact O-N 3.28Å |
| 102 | G | 96.4 | Very high | 92.9 | Very high | 40 Ų | 40 | 70.3 Ų | 70.3 | 41% | 0.412 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -58.1 | -48.2 | 178.4 | 0 | 0 | 0 | 0 | 0 | 112.7 | S98 V99 I105 L106 | S98-G102 PolarHBondContact O-N 3.47Å; V99-G102 PolarHBondContact O-N 2.87Å; G102-I105 PolarHBondContact O-N 3.2Å; G102-L106 WeakPolarHBondContact O-CB 3.27Å; G102-L106 PolarHBondContact O-N 3.44Å |
| 103 | V | 96 | Very high | 92.5 | Very high | 68 Ų | 68 | 73.9 Ų | 73.9 | 41% | 0.412 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -61.9 | -45.7 | 177.3 | 174.3 | 0 | 0 | 0 | 0 | 111.3 | V99 L101 L106 H107 | V99-V103 WeakPolarHBondContact O-CG2 3.39Å; V99-V103 PolarHBondContact O-N 3.13Å; L101-V103 PolarHBondContact O-N 3.45Å; V103-L106 PolarHBondContact O-N 2.93Å; V103-H107 PolarHBondContact O-CD2 2.94Å; V103-H107 PolarHBondContact O-N 3.29Å |
| 104 | N | 94.8 | Very high | 92 | Very high | 10 Ų | 10 | 78.5 Ų | 78.5 | 5% | 0.053 | 39% | 0.392 | C | S | . | . | H | α-helix | trans | -67.9 | -37.4 | -179.8 | -77.2 | -68.6 | 0 | 0 | 0 | 112.3 | R70 T74 F100 L101 H107 L108 | R70-N104 VanDerWaalsContact CD-OD1 3.24Å; R70-N104 WeakPolarHBondContact CD-OD1 3.47Å; R70-N104 PolarHBondContact NH1-OD1 3.3Å; T74-N104 WeakPolarHBondContact OG1-CB 3.49Å; F100-N104 WeakPolarHBondContact O-CB 3.46Å; F100-N104 PolarHBondContact O-N 2.88Å; F100-N104 PolarHBondContact O-ND2 2.86Å; L101-N104 PolarHBondContact O-N 3.35Å; N104-H107 PolarHBondContact O-N 3.03Å; N104-L108 WeakPolarHBondContact O-CB 3.33Å; N104-L108 PolarHBondContact O-N 2.97Å |
| 105 | I | 95.9 | Very high | 91.1 | Very high | 83 Ų | 83 | 81.1 Ų | 81.1 | 43% | 0.426 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -63.5 | -44.4 | 173 | -72.2 | 173.9 | 0 | 0 | 0 | 110.8 | T74 L101 G102 L108 S109 | T74-I105 HydrophobicContact CG2-CD1 4.4Å; T74-I105 HydrophobicContact CG2-CG1 3.82Å; L101-I105 HydrophobicContact CD1-CD1 3.73Å; L101-I105 HydrophobicContact CD1-CG1 4.06Å; L101-I105 HydrophobicContact CD2-CD1 4.44Å; L101-I105 HydrophobicContact CG-CD1 3.75Å; L101-I105 HydrophobicContact CG-CG1 4.4Å; L101-I105 WeakPolarHBondContact O-CB 3.39Å; L101-I105 VanDerWaalsContact O-CG1 3.28Å; L101-I105 WeakPolarHBondContact O-CG1 3.33Å; L101-I105 PolarHBondContact O-N 3.28Å; G102-I105 PolarHBondContact O-N 3.2Å; I105-L108 PolarHBondContact O-N 3.11Å; I105-S109 VanDerWaalsContact O-CB 3.3Å; I105-S109 WeakPolarHBondContact O-CB 3.3Å; I105-S109 PolarHBondContact O-N 3.14Å; I105-S109 PolarHBondContact O-OG 3.33Å |
| 106 | L | 95.3 | Very high | 89.7 | Confident | 117 Ų | 117 | 85.1 Ų | 85.1 | 61% | 0.613 | 41% | 0.411 | S | S | * | . | H | α-helix | trans | -61.6 | -47.3 | 178 | -177.3 | 62.8 | 0 | 0 | 0 | 111.4 | G102 V103 S109 Y110 | G102-L106 WeakPolarHBondContact O-CB 3.27Å; G102-L106 PolarHBondContact O-N 3.44Å; V103-L106 PolarHBondContact O-N 2.93Å; L106-S109 WeakPolarHBondContact CA-OG 3.26Å; L106-S109 PolarHBondContact O-N 2.95Å; L106-S109 PolarHBondContact O-OG 2.81Å; L106-Y110 WeakPolarHBondContact O-CB 3.31Å; L106-Y110 PolarHBondContact O-N 3.47Å |
| 107 | H | 93.3 | Very high | 87.7 | Confident | 85 Ų | 85 | 83.8 Ų | 83.8 | 39% | 0.394 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -65.3 | -41.4 | 175.9 | -85.7 | -99.8 | 0 | 0 | 0 | 112.6 | R70 V103 N104 Y110 L111 | R70-H107 HydrophobicContact CG-CB 4.47Å; V103-H107 PolarHBondContact O-CD2 2.94Å; V103-H107 PolarHBondContact O-N 3.29Å; N104-H107 PolarHBondContact O-N 3.03Å; H107-Y110 PolarHBondContact O-N 3.02Å; H107-L111 WeakPolarHBondContact O-CB 3.36Å; H107-L111 VanDerWaalsContact O-CG 3.25Å; H107-L111 WeakPolarHBondContact O-CG 3.48Å; H107-L111 PolarHBondContact O-N 2.97Å |
| 108 | L | 93.3 | Very high | 85.7 | Confident | 32 Ų | 32 | 86 Ų | 86 | 17% | 0.168 | 44% | 0.435 | C | S | . | . | H | α-helix | trans | -62 | -46.8 | 177.6 | 179.5 | 60.9 | 0 | 0 | 0 | 110.7 | I67 R70 N104 I105 L111 L112 | I67-L108 HydrophobicContact CG2-CD1 3.99Å; R70-L108 HydrophobicContact CB-CB 4.16Å; R70-L108 HydrophobicContact CB-CD1 4.24Å; N104-L108 WeakPolarHBondContact O-CB 3.33Å; N104-L108 PolarHBondContact O-N 2.97Å; I105-L108 PolarHBondContact O-N 3.11Å; L108-L111 PolarHBondContact O-N 3.1Å; L108-L112 HydrophobicContact CD1-CD1 4.1Å; L108-L112 HydrophobicContact CD1-CG 4.17Å; L108-L112 HydrophobicContact CG-CD1 3.91Å; L108-L112 HydrophobicContact CG-CG 4.41Å; L108-L112 WeakPolarHBondContact O-CB 3.27Å; L108-L112 VanDerWaalsContact O-CG 3.24Å; L108-L112 WeakPolarHBondContact O-CG 3.33Å; L108-L112 PolarHBondContact O-N 3.32Å |
| 109 | S | 90.9 | Very high | 83.6 | Confident | 58 Ų | 58 | 92.1 Ų | 92.1 | 41% | 0.406 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -62.6 | -42.4 | 176.7 | 61.7 | 0 | 0 | 0 | 0 | 112.2 | I105 L106 L112 Y113 | I105-S109 VanDerWaalsContact O-CB 3.3Å; I105-S109 WeakPolarHBondContact O-CB 3.3Å; I105-S109 PolarHBondContact O-N 3.14Å; I105-S109 PolarHBondContact O-OG 3.33Å; L106-S109 WeakPolarHBondContact CA-OG 3.26Å; L106-S109 PolarHBondContact O-N 2.95Å; L106-S109 PolarHBondContact O-OG 2.81Å; S109-L112 PolarHBondContact O-N 2.79Å; S109-Y113 VanDerWaalsContact O-CB 3.3Å; S109-Y113 WeakPolarHBondContact O-CB 3.4Å; S109-Y113 PolarHBondContact O-N 3.35Å |
| 110 | Y | 91.1 | Very high | 81.8 | Confident | 137 Ų | 137 | 90.7 Ų | 90.7 | 54% | 0.537 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -59.4 | -46.9 | 173 | 172.1 | -96.3 | 0 | 0 | 0 | 112.2 | L106 H107 Y113 K114 | L106-Y110 WeakPolarHBondContact O-CB 3.31Å; L106-Y110 PolarHBondContact O-N 3.47Å; H107-Y110 PolarHBondContact O-N 3.02Å; Y110-Y113 PolarHBondContact O-N 3.36Å; Y110-K114 PolarHBondContact O-N 2.84Å |
| 111 | L | 88.3 | Confident | 80.6 | Confident | 33 Ų | 33 | 90.6 Ų | 90.6 | 17% | 0.173 | 44% | 0.444 | C | S | . | . | H | α-helix | trans | -64.9 | -42.7 | 178.8 | -71.9 | 173.4 | 0 | 0 | 0 | 111.7 | M66 I67 R70 H107 L108 Y113 K114 K115 | M66-L111 HydrophobicContact CB-CD1 4.05Å; I67-L111 HydrophobicContact CG1-CB 4.03Å; R70-L111 HydrophobicContact CG-CD1 4.06Å; H107-L111 WeakPolarHBondContact O-CB 3.36Å; H107-L111 VanDerWaalsContact O-CG 3.25Å; H107-L111 WeakPolarHBondContact O-CG 3.48Å; H107-L111 PolarHBondContact O-N 2.97Å; L108-L111 PolarHBondContact O-N 3.1Å; L111-Y113 VanDerWaalsContact C-N 3.32Å; L111-K114 PolarHBondContact O-N 2.77Å; L111-K115 VanDerWaalsContact O-CB 3.26Å; L111-K115 WeakPolarHBondContact O-CB 3.45Å; L111-K115 WeakPolarHBondContact O-CG 3.45Å; L111-K115 PolarHBondContact O-N 2.93Å |
| 112 | L | 86.1 | Confident | 79.4 | Confident | 88 Ų | 88 | 98.7 Ų | 98.7 | 46% | 0.461 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -64.5 | -36.9 | 175.3 | -73.7 | 172.9 | 0 | 0 | 0 | 111.8 | I67 L108 S109 R116 | I67-L112 HydrophobicContact CD1-CD2 4.48Å; I67-L112 HydrophobicContact CG2-CD2 4.23Å; L108-L112 HydrophobicContact CD1-CD1 4.1Å; L108-L112 HydrophobicContact CD1-CG 4.17Å; L108-L112 HydrophobicContact CG-CD1 3.91Å; L108-L112 HydrophobicContact CG-CG 4.41Å; L108-L112 WeakPolarHBondContact O-CB 3.27Å; L108-L112 VanDerWaalsContact O-CG 3.24Å; L108-L112 WeakPolarHBondContact O-CG 3.33Å; L108-L112 PolarHBondContact O-N 3.32Å; S109-L112 PolarHBondContact O-N 2.79Å; L112-R116 WeakPolarHBondContact O-CA 3.31Å; L112-R116 WeakPolarHBondContact O-CB 3.33Å; L112-R116 PolarHBondContact O-N 2.8Å |
| 113 | Y | 81.3 | Confident | 78.3 | Confident | 182 Ų | 182 | 99.2 Ų | 99.2 | 71% | 0.714 | 47% | 0.47 | S | S | * | . | H | α-helix | trans | -64.4 | -47.6 | 174.4 | -175 | -97.8 | 0 | 0 | 0 | 111.2 | S109 Y110 L111 K115 R116 | S109-Y113 VanDerWaalsContact O-CB 3.3Å; S109-Y113 WeakPolarHBondContact O-CB 3.4Å; S109-Y113 PolarHBondContact O-N 3.35Å; Y110-Y113 PolarHBondContact O-N 3.36Å; L111-Y113 VanDerWaalsContact C-N 3.32Å; Y113-K115 PolarHBondContact O-N 3.4Å; Y113-R116 WeakPolarHBondContact O-CB 3.4Å; Y113-R116 PolarHBondContact O-N 2.99Å |
| 114 | K | 77.7 | Confident | 77.8 | Confident | 153 Ų | 153 | 96.5 Ų | 96.5 | 67% | 0.665 | 45% | 0.453 | S | S | * | . | H | α-helix | trans | -65.4 | -36.5 | 178 | -173.5 | 175.8 | -179.7 | 176.3 | 0 | 112.9 | Y110 L111 | Y110-K114 PolarHBondContact O-N 2.84Å; L111-K114 PolarHBondContact O-N 2.77Å |
| 115 | K | 70.1 | Confident | 77.3 | Confident | 99 Ų | 99 | 97.9 Ų | 97.9 | 43% | 0.43 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -94.1 | 2.3 | -178.2 | -71.7 | -80.6 | -171.3 | 175.5 | 0 | 113.4 | H63 I67 L111 Y113 P117 | H63-K115 PolarHBondContact CE1-NZ 3.44Å; H63-K115 PolarHBondContact NE2-NZ 3.06Å; I67-K115 HydrophobicContact CD1-CB 4.01Å; I67-K115 HydrophobicContact CD1-CG 3.97Å; L111-K115 VanDerWaalsContact O-CB 3.26Å; L111-K115 WeakPolarHBondContact O-CB 3.45Å; L111-K115 WeakPolarHBondContact O-CG 3.45Å; L111-K115 PolarHBondContact O-N 2.93Å; Y113-K115 PolarHBondContact O-N 3.4Å; K115-P117 WeakPolarHBondContact O-CD 3.25Å |
| 116 | R | 65.3 | Low | 76.9 | Confident | 172 Ų | 172 | 95.6 Ų | 95.6 | 65% | 0.649 | 46% | 0.46 | S | S | * | . | trans | -55 | 117.3 | -179.9 | -167.6 | 179.9 | -168.1 | -179 | 5.6 | 107.9 | L112 Y113 V118 | L112-R116 WeakPolarHBondContact O-CA 3.31Å; L112-R116 WeakPolarHBondContact O-CB 3.33Å; L112-R116 PolarHBondContact O-N 2.8Å; Y113-R116 WeakPolarHBondContact O-CB 3.4Å; Y113-R116 PolarHBondContact O-N 2.99Å; R116-V118 PolarHBondContact O-N 3.42Å | ||
| 117 | P | 51.6 | Low | 76.7 | Confident | 111 Ų | 111 | 90.1 Ų | 90.1 | 72% | 0.721 | 43% | 0.432 | S | S | * | . | trans | -60.5 | 111.3 | 178.5 | 24.4 | -32.4 | 0 | 0 | 0 | 106.4 | K115 K119 | K115-P117 WeakPolarHBondContact O-CD 3.25Å; P117-K119 PolarHBondContact O-N 3.16Å | ||
| 118 | V | 50.8 | Low | 76.6 | Confident | 67 Ų | 67 | 87.4 Ų | 87.4 | 41% | 0.406 | 42% | 0.418 | S | S | . | . | trans | -71.2 | 127.5 | -177.4 | 178.8 | 0 | 0 | 0 | 0 | 106.7 | R116 I120 R143 | R116-V118 PolarHBondContact O-N 3.42Å; V118-I120 VanDerWaalsContact C-N 3.3Å; V118-I120 PolarHBondContact O-N 2.89Å; V118-R143 VanDerWaalsContact CG1-CD 3.46Å; V118-R143 HydrophobicContact CG1-CG 3.95Å; V118-R143 VanDerWaalsContact CG1-NE 3.33Å; V118-R143 VanDerWaalsContact CG2-NE 3.27Å; V118-R143 VanDerWaalsContact CG2-NH1 3.29Å | ||
| 119 | K | 49.5 | Very low | 76.5 | Confident | 188 Ų | 188 | 93.7 Ų | 93.7 | 82% | 0.817 | 44% | 0.44 | S | S | * | . | trans | -63.7 | 93.3 | 176.9 | -64.2 | 178.1 | 179.5 | -178.8 | 0 | 108 | P117 E121 | P117-K119 PolarHBondContact O-N 3.16Å; K119-E121 PolarHBondContact O-N 2.83Å | ||
| 120 | I | 60.3 | Low | 76.5 | Confident | 45 Ų | 45 | 98.4 Ų | 98.4 | 23% | 0.231 | 45% | 0.449 | C | S | . | . | trans | -61.9 | 120.3 | 158.3 | -61.6 | 174 | 0 | 0 | 0 | 104.2 | V118 K122 L124 P139 F142 | V118-I120 VanDerWaalsContact C-N 3.3Å; V118-I120 PolarHBondContact O-N 2.89Å; I120-K122 PolarHBondContact O-N 2.65Å; I120-L124 HydrophobicContact CG2-CB 3.7Å; I120-P139 HydrophobicContact CD1-CB 4.46Å; I120-F142 HydrophobicContact CD1-CD1 4.31Å; I120-F142 HydrophobicContact CG2-CE1 4.21Å | ||
| 121 | E | 68.3 | Low | 76.6 | Confident | 106 Ų | 106 | 92.7 Ų | 92.7 | 50% | 0.495 | 43% | 0.427 | S | S | . | . | trans | -52.1 | 138.3 | 178.7 | -168.4 | 167.8 | -169.8 | 0 | 0 | 109.1 | K119 E123 L124 S125 I152 | K119-E121 PolarHBondContact O-N 2.83Å; E121-E123 HydrophobicContact CG-CG 4.48Å; E121-E123 PolarHBondContact O-N 2.9Å; E121-L124 HydrophobicContact CB-CD1 4.48Å; E121-L124 PolarHBondContact O-N 2.89Å; E121-S125 PolarHBondContact O-N 3.01Å; E121-I152 WeakPolarHBondContact OE2-CD1 3.34Å | ||
| 122 | K | 70.9 | Confident | 76.8 | Confident | 198 Ų | 198 | 91.1 Ų | 91.1 | 86% | 0.861 | 42% | 0.419 | S | S | * | . | H | α-helix | trans | -52.4 | -27 | -170.3 | -69.8 | -177.6 | 178.3 | 179.3 | 0 | 112.6 | I120 | I120-K122 PolarHBondContact O-N 2.65Å |
| 123 | E | 74.1 | Confident | 77.1 | Confident | 52 Ų | 52 | 91.6 Ų | 91.6 | 24% | 0.243 | 42% | 0.419 | C | S | . | . | H | α-helix | trans | -77.2 | -37.3 | -178.7 | -44.1 | -164.8 | 168.8 | 0 | 0 | 113 | E121 S125 L177 R226 | E121-E123 HydrophobicContact CG-CG 4.48Å; E121-E123 PolarHBondContact O-N 2.9Å; E123-S125 VanDerWaalsContact C-N 3.3Å; E123-L177 HydrophobicContact CB-CD1 4.25Å; E123-R226 IonicContact OE1-CZ 3.15Å; E123-R226 IonicContact OE1-NH1 2.7Å; E123-R226 PolarHBondContact OE1-NH1 3.04Å; E123-R226 IonicContact OE1-NH2 3.1Å; E123-R226 PolarHBondContact OE1-NH2 2.95Å; E123-R226 IonicContact OE2-CZ 3.15Å; E123-R226 IonicContact OE2-NE 2.65Å; E123-R226 PolarHBondContact OE2-NE 2.95Å; E123-R226 IonicContact OE2-NH1 2.91Å; E123-R226 PolarHBondContact OE2-NH1 3.17Å; E123-R226 VanDerWaalsContact OE2-NH1 3.15Å; E123-R226 IonicContact OE2-NH2 3.55Å; E123-R226 PolarHBondContact OE2-NH2 3.35Å |
| 124 | L | 85.1 | Confident | 77.7 | Confident | 10 Ų | 10 | 87.3 Ų | 87.3 | 5% | 0.052 | 41% | 0.413 | C | S | . | . | H | α-helix | trans | -74.5 | -25.1 | 176.4 | -87.6 | 62.7 | 0 | 0 | 0 | 111.6 | I120 E121 G126 I127 Y128 F142 T146 I152 L177 L228 | I120-L124 HydrophobicContact CG2-CB 3.7Å; E121-L124 HydrophobicContact CB-CD1 4.48Å; E121-L124 PolarHBondContact O-N 2.89Å; L124-G126 VanDerWaalsContact C-N 3.26Å; L124-G126 PolarHBondContact O-N 2.71Å; L124-I127 PolarHBondContact O-N 3.24Å; L124-I127 VanDerWaalsContact O-N 3.16Å; L124-Y128 PolarHBondContact O-N 3.07Å; L124-F142 HydrophobicContact CB-CE1 4.18Å; L124-F142 HydrophobicContact CB-CZ 4.39Å; L124-T146 HydrophobicContact CD2-CG2 3.71Å; L124-I152 HydrophobicContact CD1-CD1 3.54Å; L124-I152 HydrophobicContact CD1-CG1 4.26Å; L124-L177 HydrophobicContact CD1-CD1 4.39Å; L124-L228 HydrophobicContact CD1-CD1 4.06Å; L124-L228 HydrophobicContact CD2-CD1 4.32Å; L124-L228 HydrophobicContact CG-CD1 4.29Å |
| 125 | S | 85.1 | Confident | 78.4 | Confident | 39 Ų | 39 | 82 Ų | 82 | 27% | 0.273 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -58.5 | -37.9 | 177.2 | -175.1 | 0 | 0 | 0 | 0 | 112.3 | E121 E123 Y128 R129 | E121-S125 PolarHBondContact O-N 3.01Å; E123-S125 VanDerWaalsContact C-N 3.3Å; S125-Y128 PolarHBondContact O-N 3.41Å; S125-R129 WeakPolarHBondContact O-CG 3.46Å; S125-R129 PolarHBondContact O-N 3.42Å |
| 126 | G | 87.3 | Confident | 79.5 | Confident | 35 Ų | 35 | 87.9 Ų | 87.9 | 36% | 0.361 | 41% | 0.412 | S | S | . | . | H | α-helix | trans | -65.2 | -39.9 | 176.8 | 0 | 0 | 0 | 0 | 0 | 113 | L124 R130 | L124-G126 VanDerWaalsContact C-N 3.26Å; L124-G126 PolarHBondContact O-N 2.71Å; G126-R130 WeakPolarHBondContact O-CB 3.49Å; G126-R130 WeakPolarHBondContact O-CG 3.21Å; G126-R130 PolarHBondContact O-N 3.07Å |
| 127 | I | 91.1 | Very high | 80.8 | Confident | 2 Ų | 2 | 79.8 Ų | 79.8 | 1% | 0.01 | 38% | 0.381 | C | S | . | . | H | α-helix | trans | -67 | -46.1 | 174.9 | -75.2 | -166.7 | 0 | 0 | 0 | 111.3 | L124 R129 R130 L131 F132 F142 I175 L177 | L124-I127 PolarHBondContact O-N 3.24Å; L124-I127 VanDerWaalsContact O-N 3.16Å; I127-R129 VanDerWaalsContact C-N 3.32Å; I127-R129 PolarHBondContact O-N 2.88Å; I127-R130 PolarHBondContact O-N 2.91Å; I127-L131 HydrophobicContact CG2-CD1 4.14Å; I127-L131 WeakPolarHBondContact O-CB 3.28Å; I127-L131 PolarHBondContact O-N 3.44Å; I127-F132 HydrophobicContact CG2-CD2 3.86Å; I127-F132 HydrophobicContact CG2-CE2 3.61Å; I127-F142 HydrophobicContact CG2-CE2 4.36Å; I127-F142 HydrophobicContact CG2-CZ 4.25Å; I127-I175 HydrophobicContact CD1-CB 4.18Å; I127-I175 HydrophobicContact CD1-CG2 3.56Å; I127-L177 HydrophobicContact CD1-CD2 3.09Å; I127-L177 HydrophobicContact CD1-CG 4.46Å; I127-L177 HydrophobicContact CG1-CD2 3.98Å |
| 128 | Y | 91.3 | Very high | 82.6 | Confident | 28 Ų | 28 | 77.4 Ų | 77.4 | 11% | 0.11 | 37% | 0.366 | C | S | . | . | I | π-helix | trans | -54.3 | -52.1 | 179.2 | 177.3 | -107.5 | 0 | 0 | 0 | 110.5 | L124 S125 R130 F132 E133 V137 P139 F142 | L124-Y128 PolarHBondContact O-N 3.07Å; S125-Y128 PolarHBondContact O-N 3.41Å; Y128-R130 VanDerWaalsContact C-N 3.33Å; Y128-R130 PolarHBondContact O-N 2.88Å; Y128-F132 HydrophobicContact CD2-CB 3.77Å; Y128-F132 HydrophobicContact CE2-CB 4.1Å; Y128-F132 CarbonylContact O-C 3.56Å; Y128-F132 PolarHBondContact O-N 2.74Å; Y128-E133 HydrophobicContact CE1-CB 4.17Å; Y128-E133 WeakPolarHBondContact O-CB 3.4Å; Y128-E133 PolarHBondContact O-N 3.32Å; Y128-V137 WeakPolarHBondContact CE2-O 3.31Å; Y128-V137 PolarHBondContact OH-O 3.48Å; Y128-P139 HydrophobicContact CE1-CG 4.32Å; Y128-P139 VanDerWaalsContact OH-CD 3.25Å; Y128-P139 WeakPolarHBondContact OH-CD 3.19Å; Y128-P139 VanDerWaalsContact OH-CG 3.31Å; Y128-P139 WeakPolarHBondContact OH-CG 3.36Å; Y128-F142 HydrophobicContact CD2-CB 3.73Å; Y128-F142 AromaticContact CD2-CD1 3.61Å; Y128-F142 HydrophobicContact CD2-CD1 3.61Å; Y128-F142 HydrophobicContact CD2-CD2 4.05Å; Y128-F142 HydrophobicContact CD2-CE1 4.21Å; Y128-F142 AromaticContact CD2-CG 3.51Å; Y128-F142 HydrophobicContact CD2-CG 3.51Å; Y128-F142 HydrophobicContact CE2-CB 3.89Å; Y128-F142 HydrophobicContact CE2-CD1 4.5Å; Y128-F142 HydrophobicContact CE2-CG 4.19Å; Y128-F142 HydrophobicContact CG-CD1 4.07Å; Y128-F142 HydrophobicContact CG-CE1 4.33Å; Y128-F142 HydrophobicContact CG-CG 4.39Å |
| 129 | R | 90.8 | Very high | 84.3 | Confident | 164 Ų | 164 | 77 Ų | 77 | 62% | 0.619 | 36% | 0.364 | S | S | * | . | I | π-helix | trans | -63.1 | -34.1 | -178.8 | -69.7 | -173.5 | 171 | 178.5 | -2 | 114.4 | S125 I127 E133 P134 | S125-R129 WeakPolarHBondContact O-CG 3.46Å; S125-R129 PolarHBondContact O-N 3.42Å; I127-R129 VanDerWaalsContact C-N 3.32Å; I127-R129 PolarHBondContact O-N 2.88Å; R129-E133 VanDerWaalsContact CA-OE2 3.27Å; R129-E133 WeakPolarHBondContact CA-OE2 3.01Å; R129-E133 WeakPolarHBondContact CB-OE2 3.36Å; R129-E133 VanDerWaalsContact CG-OE2 3.31Å; R129-E133 WeakPolarHBondContact CG-OE2 3.25Å; R129-P134 WeakPolarHBondContact O-CD 3.39Å |
| 130 | R | 91.3 | Very high | 86 | Confident | 158 Ų | 158 | 72.6 Ų | 72.6 | 60% | 0.596 | 35% | 0.35 | S | S | * | . | I | π-helix | trans | -89.5 | -34.2 | -175.4 | -69.3 | -179 | 69.6 | -159.2 | 2.6 | 114.1 | G126 I127 Y128 P195 C196 | G126-R130 WeakPolarHBondContact O-CB 3.49Å; G126-R130 WeakPolarHBondContact O-CG 3.21Å; G126-R130 PolarHBondContact O-N 3.07Å; I127-R130 PolarHBondContact O-N 2.91Å; Y128-R130 VanDerWaalsContact C-N 3.33Å; Y128-R130 PolarHBondContact O-N 2.88Å; R130-P195 PolarHBondContact NH1-O 3.29Å; R130-C196 PolarHBondContact NH1-SG 3.49Å |
| 131 | L | 91.9 | Very high | 87.3 | Confident | 17 Ų | 17 | 71.2 Ų | 71.2 | 9% | 0.089 | 34% | 0.343 | C | S | . | . | I | π-helix | trans | -108.3 | -41.1 | -173.4 | -62.6 | -175.8 | 0 | 0 | 0 | 113.3 | I127 L135 I175 C196 L252 | I127-L131 HydrophobicContact CG2-CD1 4.14Å; I127-L131 WeakPolarHBondContact O-CB 3.28Å; I127-L131 PolarHBondContact O-N 3.44Å; L131-L135 VanDerWaalsContact O-CD1 3.31Å; L131-L135 WeakPolarHBondContact O-CD1 3.39Å; L131-I175 HydrophobicContact CD1-CD1 4.42Å; L131-I175 HydrophobicContact CD1-CG2 4.47Å; L131-C196 HydrophobicContact CD1-CB 4.37Å; L131-C196 HydrophobicContact CD2-CB 4.46Å; L131-C196 HydrophobicContact CG-CB 4.35Å; L131-L252 HydrophobicContact CB-CD2 4.4Å; L131-L252 HydrophobicContact CD2-CD2 4.44Å |
| 132 | F | 92.9 | Very high | 88.3 | Confident | 0 Ų | 0 | 66.1 Ų | 66.1 | 0% | 0 | 32% | 0.319 | C | S | . | . | I | π-helix | trans | -103.1 | -36.2 | -166.4 | -67.8 | -86.6 | 0 | 0 | 0 | 113 | I127 Y128 L135 R136 V137 F142 L145 I248 F249 L252 | I127-F132 HydrophobicContact CG2-CD2 3.86Å; I127-F132 HydrophobicContact CG2-CE2 3.61Å; Y128-F132 HydrophobicContact CD2-CB 3.77Å; Y128-F132 HydrophobicContact CE2-CB 4.1Å; Y128-F132 CarbonylContact O-C 3.56Å; Y128-F132 PolarHBondContact O-N 2.74Å; F132-L135 CarbonylContact O-C 3.59Å; F132-L135 PolarHBondContact O-N 3.23Å; F132-R136 PolarHBondContact O-N 3.16Å; F132-V137 HydrophobicContact CB-CB 4.01Å; F132-V137 HydrophobicContact CB-CG1 4.47Å; F132-V137 HydrophobicContact CB-CG2 4.26Å; F132-V137 HydrophobicContact CD1-CB 4.43Å; F132-V137 HydrophobicContact CD1-CG1 4.36Å; F132-V137 HydrophobicContact CD1-CG2 4.13Å; F132-V137 WeakPolarHBondContact O-CB 3.03Å; F132-V137 WeakPolarHBondContact O-CG2 3.47Å; F132-V137 PolarHBondContact O-N 3.07Å; F132-F142 HydrophobicContact CB-CD2 4.28Å; F132-F142 HydrophobicContact CD1-CD2 4.01Å; F132-F142 HydrophobicContact CD1-CE2 4.43Å; F132-F142 AromaticContact CD2-CD2 3.75Å; F132-F142 HydrophobicContact CD2-CD2 3.75Å; F132-F142 AromaticContact CD2-CE2 3.44Å; F132-F142 HydrophobicContact CD2-CE2 3.44Å; F132-F142 VanDerWaalsContact CD2-CE2 3.44Å; F132-F142 HydrophobicContact CD2-CZ 4.38Å; F132-F142 HydrophobicContact CE1-CD2 4.28Å; F132-F142 HydrophobicContact CE1-CE2 4.46Å; F132-F142 HydrophobicContact CE2-CD2 4.04Å; F132-F142 AromaticContact CE2-CE2 3.49Å; F132-F142 HydrophobicContact CE2-CE2 3.49Å; F132-F142 VanDerWaalsContact CE2-CE2 3.49Å; F132-F142 AromaticContact CG-CD2 3.74Å; F132-F142 HydrophobicContact CG-CD2 3.74Å; F132-F142 AromaticContact CG-CE2 3.95Å; F132-F142 HydrophobicContact CG-CE2 3.95Å; F132-F142 HydrophobicContact CZ-CD2 4.29Å; F132-F142 HydrophobicContact CZ-CE2 4.02Å; F132-L145 HydrophobicContact CE1-CD2 4.1Å; F132-L145 HydrophobicContact CZ-CD2 4.24Å; F132-I248 HydrophobicContact CD1-CG2 4.43Å; F132-F249 AromaticContact CE1-CE2 3.97Å; F132-F249 HydrophobicContact CE1-CE2 3.97Å; F132-F249 HydrophobicContact CZ-CE2 4.3Å; F132-F249 HydrophobicContact CZ-CZ 4.41Å; F132-L252 HydrophobicContact CD1-CD1 4.4Å; F132-L252 HydrophobicContact CE1-CD1 3.91Å; F132-L252 HydrophobicContact CZ-CD1 4.05Å |
| 133 | E | 92.1 | Very high | 89 | Confident | 98 Ų | 98 | 59.5 Ų | 59.5 | 46% | 0.458 | 29% | 0.289 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -62.1 | -44.3 | 177.3 | -179.2 | 174.1 | -140.4 | 0 | 0 | 112.8 | Y128 R129 L135 R136 | Y128-E133 HydrophobicContact CE1-CB 4.17Å; Y128-E133 WeakPolarHBondContact O-CB 3.4Å; Y128-E133 PolarHBondContact O-N 3.32Å; R129-E133 VanDerWaalsContact CA-OE2 3.27Å; R129-E133 WeakPolarHBondContact CA-OE2 3.01Å; R129-E133 WeakPolarHBondContact CB-OE2 3.36Å; R129-E133 VanDerWaalsContact CG-OE2 3.31Å; R129-E133 WeakPolarHBondContact CG-OE2 3.25Å; E133-L135 PolarHBondContact O-N 2.84Å; E133-R136 PolarHBondContact O-N 2.83Å |
| 134 | P | 94 | Very high | 89.6 | Confident | 91 Ų | 91 | 62.3 Ų | 62.3 | 59% | 0.591 | 30% | 0.297 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63.4 | -24.6 | 176.5 | -22.6 | 35.4 | 0 | 0 | 0 | 113.4 | R129 R136 | R129-P134 WeakPolarHBondContact O-CD 3.39Å; P134-R136 VanDerWaalsContact C-N 3.27Å |
| 135 | L | 93.6 | Very high | 89.7 | Confident | 43 Ų | 43 | 62 Ų | 62 | 23% | 0.225 | 30% | 0.295 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -90.7 | 11.4 | 177.8 | -59.2 | 178 | 0 | 0 | 0 | 112.5 | L131 F132 E133 V137 I248 Y251 L252 | L131-L135 VanDerWaalsContact O-CD1 3.31Å; L131-L135 WeakPolarHBondContact O-CD1 3.39Å; F132-L135 CarbonylContact O-C 3.59Å; F132-L135 PolarHBondContact O-N 3.23Å; E133-L135 PolarHBondContact O-N 2.84Å; L135-V137 HydrophobicContact CB-CG2 4.29Å; L135-V137 PolarHBondContact O-N 3.35Å; L135-I248 HydrophobicContact CB-CD1 3.86Å; L135-I248 HydrophobicContact CD1-CD1 4.19Å; L135-I248 HydrophobicContact CD1-CG2 3.75Å; L135-I248 HydrophobicContact CG-CD1 4.46Å; L135-Y251 HydrophobicContact CD1-CD1 3.8Å; L135-Y251 HydrophobicContact CD1-CE1 3.94Å; L135-Y251 HydrophobicContact CD2-CD1 4.13Å; L135-Y251 HydrophobicContact CD2-CE1 3.79Å; L135-Y251 HydrophobicContact CG-CE1 4.5Å; L135-L252 HydrophobicContact CD1-CD1 4.28Å; L135-L252 HydrophobicContact CD1-CD2 3.74Å; L135-L252 HydrophobicContact CD1-CG 3.89Å |
| 136 | R | 92.5 | Very high | 89.7 | Confident | 222 Ų | 222 | 61 Ų | 61 | 84% | 0.838 | 29% | 0.288 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 59.1 | 29.7 | 178.6 | -57.1 | -178.1 | 173.3 | -175 | -1.8 | 113.9 | F132 E133 P134 P138 | F132-R136 PolarHBondContact O-N 3.16Å; E133-R136 PolarHBondContact O-N 2.83Å; P134-R136 VanDerWaalsContact C-N 3.27Å; R136-P138 WeakPolarHBondContact O-CD 3.46Å |
| 137 | V | 92.4 | Very high | 89.2 | Confident | 1 Ų | 1 | 62.1 Ų | 62.1 | 1% | 0.006 | 30% | 0.299 | C | S | . | . | trans | -73.2 | 122.5 | 176.8 | 179.3 | 0 | 0 | 0 | 0 | 109.8 | Y128 F132 L135 L141 F142 F244 L245 I248 | Y128-V137 WeakPolarHBondContact CE2-O 3.31Å; Y128-V137 PolarHBondContact OH-O 3.48Å; F132-V137 HydrophobicContact CB-CB 4.01Å; F132-V137 HydrophobicContact CB-CG1 4.47Å; F132-V137 HydrophobicContact CB-CG2 4.26Å; F132-V137 HydrophobicContact CD1-CB 4.43Å; F132-V137 HydrophobicContact CD1-CG1 4.36Å; F132-V137 HydrophobicContact CD1-CG2 4.13Å; F132-V137 WeakPolarHBondContact O-CB 3.03Å; F132-V137 WeakPolarHBondContact O-CG2 3.47Å; F132-V137 PolarHBondContact O-N 3.07Å; L135-V137 HydrophobicContact CB-CG2 4.29Å; L135-V137 PolarHBondContact O-N 3.35Å; V137-L141 HydrophobicContact CG1-CB 4.47Å; V137-L141 HydrophobicContact CG1-CD2 4.42Å; V137-F142 HydrophobicContact CG1-CB 4.33Å; V137-F244 HydrophobicContact CB-CE1 4.35Å; V137-F244 HydrophobicContact CG2-CE1 3.89Å; V137-F244 HydrophobicContact CG2-CZ 4.08Å; V137-L245 HydrophobicContact CG1-CD1 4.39Å; V137-I248 HydrophobicContact CG2-CG1 4.09Å; V137-I248 HydrophobicContact CG2-CG2 4.13Å | ||
| 138 | P | 89.3 | Confident | 88.1 | Confident | 62 Ų | 62 | 68 Ų | 68 | 40% | 0.403 | 33% | 0.326 | S | S | . | . | trans | -60.9 | 141 | 178.7 | -24 | 34.4 | 0 | 0 | 0 | 111.9 | R136 D140 L141 F142 | R136-P138 WeakPolarHBondContact O-CD 3.46Å; P138-D140 PolarHBondContact O-N 2.96Å; P138-D140 VanDerWaalsContact O-N 3.15Å; P138-L141 HydrophobicContact CB-CB 4.36Å; P138-L141 PolarHBondContact O-N 3.21Å; P138-F142 PolarHBondContact O-N 3.04Å; P138-F142 VanDerWaalsContact O-N 3.09Å | ||
| 139 | P | 86.8 | Confident | 87.1 | Confident | 58 Ų | 58 | 69.6 Ų | 69.6 | 38% | 0.377 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -57.5 | -31.6 | 178.4 | -21.9 | 29 | 0 | 0 | 0 | 113.4 | I120 Y128 R143 | I120-P139 HydrophobicContact CD1-CB 4.46Å; Y128-P139 HydrophobicContact CE1-CG 4.32Å; Y128-P139 VanDerWaalsContact OH-CD 3.25Å; Y128-P139 WeakPolarHBondContact OH-CD 3.19Å; Y128-P139 VanDerWaalsContact OH-CG 3.31Å; Y128-P139 WeakPolarHBondContact OH-CG 3.36Å; P139-R143 WeakPolarHBondContact O-CB 3.39Å; P139-R143 PolarHBondContact O-N 3.4Å; P139-R143 VanDerWaalsContact O-N 3.09Å |
| 140 | D | 85.1 | Confident | 86.8 | Confident | 95 Ų | 95 | 62.9 Ų | 62.9 | 51% | 0.508 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -69.2 | -36.9 | 178.8 | -62.6 | -34.7 | 0 | 0 | 0 | 112 | P138 R143 R144 | P138-D140 PolarHBondContact O-N 2.96Å; P138-D140 VanDerWaalsContact O-N 3.15Å; D140-R143 IonicContact OD1-CZ 3.39Å; D140-R143 IonicContact OD1-NH1 3.57Å; D140-R143 PolarHBondContact OD1-NH1 3.21Å; D140-R143 IonicContact OD1-NH2 2.97Å; D140-R143 PolarHBondContact OD1-NH2 2.87Å; D140-R144 WeakPolarHBondContact O-CG 3.25Å; D140-R144 PolarHBondContact O-N 3.39Å; D140-R144 VanDerWaalsContact O-N 3.12Å |
| 141 | L | 87.5 | Confident | 86.5 | Confident | 16 Ų | 16 | 61.5 Ų | 61.5 | 8% | 0.084 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -72.5 | -44.6 | 177.1 | -174.7 | 61.7 | 0 | 0 | 0 | 111.2 | V137 P138 R143 R144 L145 E242 F244 L245 | V137-L141 HydrophobicContact CG1-CB 4.47Å; V137-L141 HydrophobicContact CG1-CD2 4.42Å; P138-L141 HydrophobicContact CB-CB 4.36Å; P138-L141 PolarHBondContact O-N 3.21Å; L141-R143 PolarHBondContact O-N 3.15Å; L141-R144 PolarHBondContact O-N 2.91Å; L141-L145 PolarHBondContact O-N 3.47Å; L141-E242 HydrophobicContact CD1-CG 4.23Å; L141-F244 HydrophobicContact CD2-CD1 3.71Å; L141-F244 HydrophobicContact CD2-CE1 4.16Å; L141-L245 HydrophobicContact CD2-CB 4.39Å |
| 142 | F | 89.4 | Confident | 86.4 | Confident | 0 Ų | 0 | 63.1 Ų | 63.1 | 0% | 0 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -57.5 | -38.9 | 175 | 178.1 | -105.8 | 0 | 0 | 0 | 111.9 | I120 L124 I127 Y128 F132 V137 P138 L145 T146 | I120-F142 HydrophobicContact CD1-CD1 4.31Å; I120-F142 HydrophobicContact CG2-CE1 4.21Å; L124-F142 HydrophobicContact CB-CE1 4.18Å; L124-F142 HydrophobicContact CB-CZ 4.39Å; I127-F142 HydrophobicContact CG2-CE2 4.36Å; I127-F142 HydrophobicContact CG2-CZ 4.25Å; Y128-F142 HydrophobicContact CD2-CB 3.73Å; Y128-F142 AromaticContact CD2-CD1 3.61Å; Y128-F142 HydrophobicContact CD2-CD1 3.61Å; Y128-F142 HydrophobicContact CD2-CD2 4.05Å; Y128-F142 HydrophobicContact CD2-CE1 4.21Å; Y128-F142 AromaticContact CD2-CG 3.51Å; Y128-F142 HydrophobicContact CD2-CG 3.51Å; Y128-F142 HydrophobicContact CE2-CB 3.89Å; Y128-F142 HydrophobicContact CE2-CD1 4.5Å; Y128-F142 HydrophobicContact CE2-CG 4.19Å; Y128-F142 HydrophobicContact CG-CD1 4.07Å; Y128-F142 HydrophobicContact CG-CE1 4.33Å; Y128-F142 HydrophobicContact CG-CG 4.39Å; F132-F142 HydrophobicContact CB-CD2 4.28Å; F132-F142 HydrophobicContact CD1-CD2 4.01Å; F132-F142 HydrophobicContact CD1-CE2 4.43Å; F132-F142 AromaticContact CD2-CD2 3.75Å; F132-F142 HydrophobicContact CD2-CD2 3.75Å; F132-F142 AromaticContact CD2-CE2 3.44Å; F132-F142 HydrophobicContact CD2-CE2 3.44Å; F132-F142 VanDerWaalsContact CD2-CE2 3.44Å; F132-F142 HydrophobicContact CD2-CZ 4.38Å; F132-F142 HydrophobicContact CE1-CD2 4.28Å; F132-F142 HydrophobicContact CE1-CE2 4.46Å; F132-F142 HydrophobicContact CE2-CD2 4.04Å; F132-F142 AromaticContact CE2-CE2 3.49Å; F132-F142 HydrophobicContact CE2-CE2 3.49Å; F132-F142 VanDerWaalsContact CE2-CE2 3.49Å; F132-F142 AromaticContact CG-CD2 3.74Å; F132-F142 HydrophobicContact CG-CD2 3.74Å; F132-F142 AromaticContact CG-CE2 3.95Å; F132-F142 HydrophobicContact CG-CE2 3.95Å; F132-F142 HydrophobicContact CZ-CD2 4.29Å; F132-F142 HydrophobicContact CZ-CE2 4.02Å; V137-F142 HydrophobicContact CG1-CB 4.33Å; P138-F142 PolarHBondContact O-N 3.04Å; P138-F142 VanDerWaalsContact O-N 3.09Å; F142-L145 HydrophobicContact CD2-CD2 4.19Å; F142-L145 WeakPolarHBondContact O-CB 3.47Å; F142-L145 PolarHBondContact O-N 3.45Å; F142-T146 HydrophobicContact CD1-CG2 4.46Å; F142-T146 HydrophobicContact CD2-CG2 4.33Å; F142-T146 HydrophobicContact CE1-CG2 3.99Å; F142-T146 HydrophobicContact CE2-CG2 3.83Å; F142-T146 HydrophobicContact CZ-CG2 3.65Å; F142-T146 WeakPolarHBondContact O-CG2 3.37Å; F142-T146 PolarHBondContact O-N 2.92Å; F142-T146 PolarHBondContact O-OG1 2.67Å |
| 143 | R | 85.1 | Confident | 86.3 | Confident | 59 Ų | 59 | 66.7 Ų | 66.7 | 22% | 0.223 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -67.3 | -39.5 | 174.2 | 174 | -155.3 | -55 | 149.3 | 7.6 | 113.5 | V118 P139 D140 L141 L145 T146 G147 | V118-R143 VanDerWaalsContact CG1-CD 3.46Å; V118-R143 HydrophobicContact CG1-CG 3.95Å; V118-R143 VanDerWaalsContact CG1-NE 3.33Å; V118-R143 VanDerWaalsContact CG2-NE 3.27Å; V118-R143 VanDerWaalsContact CG2-NH1 3.29Å; P139-R143 WeakPolarHBondContact O-CB 3.39Å; P139-R143 PolarHBondContact O-N 3.4Å; P139-R143 VanDerWaalsContact O-N 3.09Å; D140-R143 IonicContact OD1-CZ 3.39Å; D140-R143 IonicContact OD1-NH1 3.57Å; D140-R143 PolarHBondContact OD1-NH1 3.21Å; D140-R143 IonicContact OD1-NH2 2.97Å; D140-R143 PolarHBondContact OD1-NH2 2.87Å; L141-R143 PolarHBondContact O-N 3.15Å; R143-L145 VanDerWaalsContact C-N 3.26Å; R143-L145 PolarHBondContact O-N 3.32Å; R143-T146 PolarHBondContact O-N 2.61Å; R143-G147 VanDerWaalsContact O-CA 3.25Å; R143-G147 WeakPolarHBondContact O-CA 3.45Å; R143-G147 PolarHBondContact O-N 2.84Å |
| 144 | R | 86.1 | Confident | 86.4 | Confident | 111 Ų | 111 | 67 Ų | 67 | 42% | 0.419 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -59.1 | -44.2 | 174.7 | -74.3 | 170.9 | 62.4 | -150.8 | -4.5 | 110.1 | D140 L141 T146 G147 F238 E242 | D140-R144 WeakPolarHBondContact O-CG 3.25Å; D140-R144 PolarHBondContact O-N 3.39Å; D140-R144 VanDerWaalsContact O-N 3.12Å; L141-R144 PolarHBondContact O-N 2.91Å; R144-T146 PolarHBondContact O-N 2.92Å; R144-G147 PolarHBondContact O-N 2.95Å; R144-F238 HydrophobicContact CB-CE2 4.22Å; R144-F238 HydrophobicContact CB-CZ 3.78Å; R144-E242 IonicContact CZ-OE1 2.78Å; R144-E242 IonicContact NH1-OE1 3.4Å; R144-E242 PolarHBondContact NH1-OE1 3.21Å; R144-E242 IonicContact NH1-OE2 2.73Å; R144-E242 IonicContact NH2-OE1 3.4Å; R144-E242 PolarHBondContact NH2-OE1 3.32Å |
| 145 | L | 87.6 | Confident | 86.5 | Confident | 3 Ų | 3 | 63.6 Ų | 63.6 | 2% | 0.016 | 32% | 0.324 | C | S | . | . | H | α-helix | trans | -58.5 | -46 | 174.5 | 170 | 71.9 | 0 | 0 | 0 | 112.9 | F132 L141 F142 R143 W230 L235 F238 L245 F249 | F132-L145 HydrophobicContact CE1-CD2 4.1Å; F132-L145 HydrophobicContact CZ-CD2 4.24Å; L141-L145 PolarHBondContact O-N 3.47Å; F142-L145 HydrophobicContact CD2-CD2 4.19Å; F142-L145 WeakPolarHBondContact O-CB 3.47Å; F142-L145 PolarHBondContact O-N 3.45Å; R143-L145 VanDerWaalsContact C-N 3.26Å; R143-L145 PolarHBondContact O-N 3.32Å; L145-W230 HydrophobicContact CD1-CZ2 4.27Å; L145-W230 HydrophobicContact CD2-CZ2 3.99Å; L145-W230 HydrophobicContact CG-CZ2 3.96Å; L145-W230 PolarHBondContact O-NE1 3.29Å; L145-W230 VanDerWaalsContact O-NE1 3.11Å; L145-L235 HydrophobicContact CD1-CD1 3.52Å; L145-F238 HydrophobicContact CB-CE1 3.88Å; L145-F238 HydrophobicContact CD1-CD1 4.09Å; L145-F238 HydrophobicContact CD1-CE1 4.19Å; L145-L245 HydrophobicContact CB-CD2 4.04Å; L145-L245 HydrophobicContact CD1-CD2 3.98Å; L145-L245 HydrophobicContact CD2-CD1 4.49Å; L145-L245 HydrophobicContact CD2-CD2 4.16Å; L145-L245 HydrophobicContact CG-CD2 4.26Å; L145-F249 HydrophobicContact CD1-CE2 3.98Å; L145-F249 HydrophobicContact CD1-CZ 3.84Å; L145-F249 HydrophobicContact CD2-CE2 3.61Å; L145-F249 HydrophobicContact CD2-CZ 3.75Å; L145-F249 HydrophobicContact CG-CE2 4.42Å; L145-F249 HydrophobicContact CG-CZ 4.38Å |
| 146 | T | 86.6 | Confident | 86.7 | Confident | 19 Ų | 19 | 68.5 Ų | 68.5 | 12% | 0.117 | 34% | 0.344 | C | S | . | . | H | α-helix | trans | -89 | -11.6 | -177.4 | 63.2 | 0 | 0 | 0 | 0 | 114 | L124 F142 R143 R144 C150 L228 W230 | L124-T146 HydrophobicContact CD2-CG2 3.71Å; F142-T146 HydrophobicContact CD1-CG2 4.46Å; F142-T146 HydrophobicContact CD2-CG2 4.33Å; F142-T146 HydrophobicContact CE1-CG2 3.99Å; F142-T146 HydrophobicContact CE2-CG2 3.83Å; F142-T146 HydrophobicContact CZ-CG2 3.65Å; F142-T146 WeakPolarHBondContact O-CG2 3.37Å; F142-T146 PolarHBondContact O-N 2.92Å; F142-T146 PolarHBondContact O-OG1 2.67Å; R143-T146 PolarHBondContact O-N 2.61Å; R144-T146 PolarHBondContact O-N 2.92Å; T146-C150 WeakPolarHBondContact O-CB 3.3Å; T146-L228 HydrophobicContact CG2-CD2 4.38Å; T146-W230 HydrophobicContact CG2-CZ2 4.25Å |
| 147 | G | 76.4 | Confident | 86.9 | Confident | 57 Ų | 57 | 64 Ų | 64 | 59% | 0.588 | 33% | 0.33 | S | S | * | . | H | α-helix | trans | -92.9 | -34.8 | -169.1 | 0 | 0 | 0 | 0 | 0 | 114.3 | R143 R144 | R143-G147 VanDerWaalsContact O-CA 3.25Å; R143-G147 WeakPolarHBondContact O-CA 3.45Å; R143-G147 PolarHBondContact O-N 2.84Å; R144-G147 PolarHBondContact O-N 2.95Å |
| 148 | Q | 66.6 | Low | 87 | Confident | 125 Ų | 125 | 66.5 Ų | 66.5 | 58% | 0.584 | 36% | 0.356 | S | S | * | . | S | Bend | trans | -94.8 | -28.8 | -171.9 | -70.3 | -177.1 | -31.3 | 0 | 0 | 113.7 | ||
| 149 | F | 71.5 | Confident | 87.4 | Confident | 62 Ų | 62 | 67.9 Ų | 67.9 | 27% | 0.272 | 36% | 0.357 | S | S | . | . | S | Bend | trans | -142.6 | 21 | -166.4 | -47.5 | -60.7 | 0 | 0 | 0 | 114.3 | R234 | F149-R234 HydrophobicContact CB-CB 3.9Å; F149-R234 HydrophobicContact CD1-CB 4.14Å; F149-R234 HydrophobicContact CD1-CG 4.28Å; F149-R234 HydrophobicContact CD2-CB 4.37Å; F149-R234 HydrophobicContact CG-CB 3.86Å; F149-R234 HydrophobicContact CG-CG 4.49Å |
| 150 | C | 83.3 | Confident | 87.8 | Confident | 24 Ų | 24 | 68.6 Ų | 68.6 | 16% | 0.162 | 36% | 0.361 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -115.1 | 135 | -173.9 | -153.4 | 0 | 0 | 0 | 0 | 111.5 | T146 L228 W230 | T146-C150 WeakPolarHBondContact O-CB 3.3Å; C150-L228 HydrophobicContact CB-CD1 4.43Å; C150-L228 WeakPolarHBondContact SG-CD1 3.25Å; C150-L228 WeakPolarHBondContact SG-CG 3.24Å; C150-W230 VanDerWaalsContact SG-CD1 3.56Å; C150-W230 VanDerWaalsContact SG-CE2 3.58Å; C150-W230 PolarHBondContact SG-NE1 2.83Å |
| 151 | M | 86.2 | Confident | 88.3 | Confident | 128 Ų | 128 | 64.8 Ų | 64.8 | 63% | 0.631 | 34% | 0.339 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -121.3 | 132.6 | 178.1 | -65.2 | -63.6 | -70.4 | 0 | 0 | 109.4 | C229 | M151-C229 PolarHBondContact N-O 3.29Å; M151-C229 WeakPolarHBondContact O-CB 3.33Å; M151-C229 PolarHBondContact O-N 3.26Å |
| 152 | I | 89.8 | Confident | 88.6 | Confident | 52 Ų | 52 | 64 Ų | 64 | 27% | 0.267 | 34% | 0.335 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -90.8 | 124.1 | 170.1 | -58.6 | 177.1 | 0 | 0 | 0 | 108 | E121 L124 L177 F227 L228 | E121-I152 WeakPolarHBondContact OE2-CD1 3.34Å; L124-I152 HydrophobicContact CD1-CD1 3.54Å; L124-I152 HydrophobicContact CD1-CG1 4.26Å; I152-L177 HydrophobicContact CD1-CD1 4.38Å; I152-L177 HydrophobicContact CG1-CD1 4.41Å; I152-L177 HydrophobicContact CG2-CD1 3.91Å; I152-F227 WeakPolarHBondContact CA-O 3.41Å; I152-L228 HydrophobicContact CG1-CD1 4.06Å |
| 153 | Q | 90.9 | Very high | 88.9 | Confident | 75 Ų | 75 | 65.2 Ų | 65.2 | 35% | 0.35 | 35% | 0.345 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -118.4 | 153 | 178.8 | -67.2 | -173.1 | 56.6 | 0 | 0 | 110.7 | R226 F227 | Q153-R226 VanDerWaalsContact O-CA 3.31Å; Q153-R226 WeakPolarHBondContact O-CA 3.49Å; Q153-F227 HydrophobicContact CB-CD1 4.46Å; Q153-F227 HydrophobicContact CB-CD2 4.3Å; Q153-F227 HydrophobicContact CB-CE1 3.86Å; Q153-F227 HydrophobicContact CB-CE2 3.68Å; Q153-F227 HydrophobicContact CB-CZ 3.43Å; Q153-F227 VanDerWaalsContact CB-CZ 3.43Å; Q153-F227 HydrophobicContact CG-CE2 4.31Å; Q153-F227 HydrophobicContact CG-CZ 4.32Å; Q153-F227 PolarHBondContact N-O 3.5Å; Q153-F227 PolarHBondContact O-N 2.83Å |
| 154 | T | 94 | Very high | 89.1 | Confident | 103 Ų | 103 | 64 Ų | 64 | 63% | 0.632 | 34% | 0.342 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -121.5 | 134.1 | -178.8 | 66.4 | 0 | 0 | 0 | 0 | 110 | C225 R226 | T154-C225 CarbonylContact C-O 3.57Å; T154-C225 WeakPolarHBondContact CA-O 3.43Å; T154-R226 HydrophobicContact CG2-CG 3.71Å |
| 155 | L | 95.9 | Very high | 89.2 | Confident | 21 Ų | 21 | 63.6 Ų | 63.6 | 11% | 0.11 | 35% | 0.348 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -125.7 | 124 | -179.7 | -163.9 | 66.3 | 0 | 0 | 0 | 108.7 | Q159 M181 A221 N224 C225 F227 | L155-Q159 HydrophobicContact CD1-CB 3.41Å; L155-Q159 VanDerWaalsContact CD1-CB 3.41Å; L155-Q159 HydrophobicContact CD1-CG 4.42Å; L155-Q159 HydrophobicContact CG-CB 3.73Å; L155-M181 HydrophobicContact CD2-CE 4.11Å; L155-A221 HydrophobicContact CB-CB 4.43Å; L155-A221 HydrophobicContact CD2-CB 3.81Å; L155-A221 HydrophobicContact CG-CB 3.94Å; L155-N224 CarbonylContact O-C 3.57Å; L155-C225 HydrophobicContact CB-CB 4.26Å; L155-C225 PolarHBondContact N-O 3.02Å; L155-C225 PolarHBondContact O-N 2.96Å; L155-F227 HydrophobicContact CB-CE1 4.16Å |
| 156 | K | 97 | Very high | 89.4 | Confident | 146 Ų | 146 | 71.6 Ų | 71.6 | 64% | 0.635 | 38% | 0.383 | S | S | * | . | trans | -75.1 | 155.4 | 177.7 | -64.4 | -177.8 | -179.5 | 178.9 | 0 | 110.3 | G158 Q159 A221 N224 | K156-G158 PolarHBondContact O-N 3.18Å; K156-Q159 HydrophobicContact CB-CG 4.16Å; K156-Q159 WeakPolarHBondContact O-CB 3.38Å; K156-Q159 PolarHBondContact O-N 3.15Å; K156-A221 VanDerWaalsContact O-CB 3.31Å; K156-A221 WeakPolarHBondContact O-CB 3.44Å; K156-N224 WeakPolarHBondContact CA-OD1 3.31Å | ||
| 157 | K | 97.1 | Very high | 89.6 | Confident | 127 Ų | 127 | 72.2 Ų | 72.2 | 55% | 0.552 | 39% | 0.387 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -49.7 | 132 | 172.9 | 179.4 | 166.4 | -172.5 | 136 | 0 | 111.3 | Q159 D222 D223 N224 | K157-Q159 VanDerWaalsContact C-N 3.3Å; K157-Q159 PolarHBondContact O-N 3.09Å; K157-D222 WeakPolarHBondContact CD-O 3.27Å; K157-D222 WeakPolarHBondContact CE-O 3.37Å; K157-D222 VanDerWaalsContact CG-O 3.3Å; K157-D222 WeakPolarHBondContact CG-O 3.4Å; K157-D222 PolarHBondContact NZ-O 3.42Å; K157-D223 IonicContact NZ-OD1 3.32Å; K157-N224 PolarHBondContact N-OD1 2.96Å; K157-N224 VanDerWaalsContact N-OD1 3.11Å |
| 158 | G | 95 | Very high | 90.2 | Very high | 53 Ų | 53 | 71.4 Ų | 71.4 | 55% | 0.546 | 37% | 0.372 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 83.6 | -9.1 | -178.8 | 0 | 0 | 0 | 0 | 0 | 115.3 | K156 A221 | K156-G158 PolarHBondContact O-N 3.18Å; G158-A221 PolarHBondContact N-O 2.94Å |
| 159 | Q | 96.7 | Very high | 91 | Very high | 91 Ų | 91 | 65.6 Ų | 65.6 | 43% | 0.425 | 35% | 0.345 | S | S | . | . | trans | -77.7 | 146.1 | 174.6 | -66.3 | -175.5 | -40.1 | 0 | 0 | 111.5 | L155 K156 K157 A221 | L155-Q159 HydrophobicContact CD1-CB 3.41Å; L155-Q159 VanDerWaalsContact CD1-CB 3.41Å; L155-Q159 HydrophobicContact CD1-CG 4.42Å; L155-Q159 HydrophobicContact CG-CB 3.73Å; K156-Q159 HydrophobicContact CB-CG 4.16Å; K156-Q159 WeakPolarHBondContact O-CB 3.38Å; K156-Q159 PolarHBondContact O-N 3.15Å; K157-Q159 VanDerWaalsContact C-N 3.3Å; K157-Q159 PolarHBondContact O-N 3.09Å; Q159-A221 PolarHBondContact O-N 3.23Å | ||
| 160 | T | 95.8 | Very high | 91.3 | Very high | 74 Ų | 74 | 63.8 Ų | 63.8 | 45% | 0.454 | 34% | 0.338 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -88.6 | 126.4 | -177.5 | -52.4 | 0 | 0 | 0 | 0 | 110.7 | A162 A163 T218 I220 | T160-A162 VanDerWaalsContact CG2-C 3.44Å; T160-A162 WeakPolarHBondContact CG2-O 3.29Å; T160-A163 HydrophobicContact CG2-CB 4.09Å; T160-T218 HydrophobicContact CG2-CG2 4.43Å; T160-I220 HydrophobicContact CG2-CG1 4.32Å |
| 161 | Y | 95.4 | Very high | 91.1 | Very high | 14 Ų | 14 | 66.9 Ų | 66.9 | 6% | 0.055 | 35% | 0.353 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -79 | -48.7 | 169.9 | 174.4 | -95.7 | 0 | 0 | 0 | 110.7 | R172 S174 I199 D200 F215 I219 F227 | Y161-R172 WeakPolarHBondContact OH-CD 3.49Å; Y161-S174 WeakPolarHBondContact OH-CB 3.5Å; Y161-S174 PolarHBondContact OH-OG 3.39Å; Y161-I199 HydrophobicContact CD1-CG2 3.6Å; Y161-I199 HydrophobicContact CE1-CB 4.33Å; Y161-I199 HydrophobicContact CE1-CG2 3.45Å; Y161-I199 VanDerWaalsContact CE1-CG2 3.45Å; Y161-I199 HydrophobicContact CE2-CD1 4.3Å; Y161-I199 HydrophobicContact CE2-CG2 4.45Å; Y161-I199 HydrophobicContact CG-CG2 4.18Å; Y161-D200 PolarHBondContact OH-OD2 3.11Å; Y161-F215 HydrophobicContact CE1-CZ 4.26Å; Y161-I219 HydrophobicContact CD1-CB 4.28Å; Y161-I219 HydrophobicContact CD1-CD1 4.19Å; Y161-I219 HydrophobicContact CD1-CG2 4.35Å; Y161-I219 PolarHBondContact N-O 3.17Å; Y161-F227 HydrophobicContact CD2-CE1 4.11Å; Y161-F227 HydrophobicContact CD2-CE2 4.15Å; Y161-F227 AromaticContact CD2-CZ 3.81Å; Y161-F227 HydrophobicContact CD2-CZ 3.81Å; Y161-F227 HydrophobicContact CE2-CD2 4.14Å; Y161-F227 HydrophobicContact CE2-CE1 4.37Å; Y161-F227 AromaticContact CE2-CE2 3.59Å; Y161-F227 HydrophobicContact CE2-CE2 3.59Å; Y161-F227 AromaticContact CE2-CZ 3.72Å; Y161-F227 HydrophobicContact CE2-CZ 3.72Å |
| 162 | A | 95 | Very high | 91.3 | Very high | 0 Ų | 0 | 63.8 Ų | 63.8 | 0% | 0 | 33% | 0.334 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -141.7 | 137.4 | 177.3 | 0 | 0 | 0 | 0 | 0 | 109.7 | T160 T167 F215 T218 I219 | T160-A162 VanDerWaalsContact CG2-C 3.44Å; T160-A162 WeakPolarHBondContact CG2-O 3.29Å; A162-T167 HydrophobicContact CB-CG2 4.11Å; A162-F215 HydrophobicContact CB-CB 4.15Å; A162-F215 HydrophobicContact CB-CD1 3.62Å; A162-F215 HydrophobicContact CB-CD2 3.79Å; A162-F215 HydrophobicContact CB-CE1 3.89Å; A162-F215 HydrophobicContact CB-CE2 4.04Å; A162-F215 HydrophobicContact CB-CG 3.57Å; A162-F215 HydrophobicContact CB-CZ 4.1Å; A162-T218 CarbonylContact O-C 3.58Å; A162-T218 WeakPolarHBondContact O-CA 3.21Å; A162-I219 HydrophobicContact CB-CB 4.49Å; A162-I219 PolarHBondContact N-O 3.04Å; A162-I219 PolarHBondContact O-N 3.26Å |
| 163 | A | 94.3 | Very high | 91.5 | Very high | 25 Ų | 25 | 61.3 Ų | 61.3 | 21% | 0.207 | 32% | 0.321 | C | S | . | . | trans | -108.4 | 134 | 175.3 | 0 | 0 | 0 | 0 | 0 | 109.8 | T160 D165 K166 T167 | T160-A163 HydrophobicContact CG2-CB 4.09Å; A163-D165 PolarHBondContact O-N 2.85Å; A163-K166 HydrophobicContact CB-CB 3.97Å; A163-K166 HydrophobicContact CB-CD 4.16Å; A163-K166 PolarHBondContact O-N 3.09Å; A163-K166 VanDerWaalsContact O-N 3.17Å; A163-T167 PolarHBondContact N-OG1 3.07Å; A163-T167 PolarHBondContact O-N 3.03Å | ||
| 164 | E | 90 | Very high | 91.7 | Very high | 34 Ų | 34 | 57.7 Ų | 57.7 | 16% | 0.159 | 31% | 0.305 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -51.6 | 132.4 | 176.4 | -178.7 | 173.8 | 172.2 | 0 | 0 | 110.9 | K166 R186 F215 Q216 T218 | E164-K166 PolarHBondContact O-N 3.05Å; E164-R186 WeakPolarHBondContact OE1-CG 3.44Å; E164-R186 PolarHBondContact OE2-N 2.82Å; E164-F215 CarbonylContact C-O 3.44Å; E164-F215 WeakPolarHBondContact CA-O 3.14Å; E164-Q216 WeakPolarHBondContact CG-O 3.38Å; E164-T218 VanDerWaalsContact CB-OG1 3.3Å; E164-T218 WeakPolarHBondContact CB-OG1 3.42Å; E164-T218 PolarHBondContact N-OG1 3.21Å; E164-T218 VanDerWaalsContact N-OG1 3.12Å |
| 165 | D | 88.9 | Confident | 91.8 | Very high | 103 Ų | 103 | 52.8 Ų | 52.8 | 55% | 0.551 | 28% | 0.275 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 56.4 | 12.5 | 179.5 | -60.3 | -38.5 | 0 | 0 | 0 | 116 | A163 K214 F215 | A163-D165 PolarHBondContact O-N 2.85Å; D165-K214 WeakPolarHBondContact O-CD 3.34Å; D165-K214 PolarHBondContact O-NZ 3.3Å; D165-F215 PolarHBondContact N-O 3.09Å |
| 166 | K | 90.8 | Very high | 91.8 | Very high | 171 Ų | 171 | 51.8 Ų | 51.8 | 74% | 0.743 | 27% | 0.269 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -120.8 | -49.2 | -179 | -68.8 | 179.8 | -176.7 | -180 | 0 | 112.7 | A163 E164 | A163-K166 HydrophobicContact CB-CB 3.97Å; A163-K166 HydrophobicContact CB-CD 4.16Å; A163-K166 PolarHBondContact O-N 3.09Å; A163-K166 VanDerWaalsContact O-N 3.17Å; E164-K166 PolarHBondContact O-N 3.05Å |
| 167 | T | 90.7 | Very high | 91.7 | Very high | 32 Ų | 32 | 46 Ų | 46 | 20% | 0.196 | 25% | 0.245 | C | C | . | . | S | Bend | trans | -81 | 131.9 | -176.8 | -55.9 | 0 | 0 | 0 | 0 | 110.2 | A162 A163 K214 F215 | A162-T167 HydrophobicContact CB-CG2 4.11Å; A163-T167 PolarHBondContact N-OG1 3.07Å; A163-T167 PolarHBondContact O-N 3.03Å; T167-K214 CarbonylContact O-C 3.59Å; T167-K214 VanDerWaalsContact O-CA 3.25Å; T167-K214 WeakPolarHBondContact O-CA 3.43Å; T167-K214 WeakPolarHBondContact O-CB 3.35Å; T167-F215 HydrophobicContact CG2-CD2 3.8Å; T167-F215 HydrophobicContact CG2-CE2 4.02Å; T167-F215 PolarHBondContact O-N 3.09Å |
| 168 | S | 89.1 | Confident | 91.5 | Very high | 39 Ų | 39 | 46 Ų | 46 | 27% | 0.273 | 25% | 0.245 | S | C | . | . | B | Isolated β-bridge | trans | -70.3 | 143.8 | 173 | 179.9 | 0 | 0 | 0 | 0 | 111.1 | D170 F215 | S168-D170 PolarHBondContact OG-N 3.29Å; S168-F215 WeakPolarHBondContact O-CE2 3.19Å |
| 169 | V | 84.6 | Confident | 91.5 | Very high | 3 Ų | 3 | 44.2 Ų | 44.2 | 2% | 0.018 | 23% | 0.227 | C | C | . | . | S | Bend | trans | -89.4 | -9.9 | 176 | -58.5 | 0 | 0 | 0 | 0 | 113.7 | D171 E203 T207 E213 K214 F215 R232 | V169-D171 VanDerWaalsContact C-N 3.26Å; V169-D171 PolarHBondContact O-N 3.05Å; V169-E203 HydrophobicContact CB-CB 4.1Å; V169-E203 HydrophobicContact CG1-CB 3.91Å; V169-E203 HydrophobicContact CG1-CG 3.82Å; V169-T207 HydrophobicContact CB-CG2 4.36Å; V169-T207 HydrophobicContact CG2-CG2 3.63Å; V169-T207 VanDerWaalsContact CG2-OG1 3.29Å; V169-T207 WeakPolarHBondContact CG2-OG1 3.39Å; V169-E213 HydrophobicContact CG2-CB 3.59Å; V169-E213 VanDerWaalsContact CG2-O 3.3Å; V169-E213 WeakPolarHBondContact CG2-O 3.39Å; V169-E213 PolarHBondContact N-O 3.42Å; V169-K214 VanDerWaalsContact CG1-C 3.44Å; V169-F215 HydrophobicContact CB-CE2 4.39Å; V169-F215 HydrophobicContact CG1-CD2 3.71Å; V169-F215 HydrophobicContact CG1-CE2 3.98Å; V169-F215 HydrophobicContact CG1-CG 4.11Å; V169-R232 PolarHBondContact O-NE 2.91Å; V169-R232 PolarHBondContact O-NH2 3.46Å |
| 170 | D | 76.9 | Confident | 91.5 | Very high | 24 Ų | 24 | 42 Ų | 42 | 13% | 0.128 | 22% | 0.216 | C | C | . | . | S | Bend | trans | -76.4 | -14.5 | -168.6 | -72.8 | -9.9 | 0 | 0 | 0 | 113.1 | S168 H210 K211 G212 R232 | S168-D170 PolarHBondContact OG-N 3.29Å; D170-H210 WeakPolarHBondContact OD2-CA 3.31Å; D170-H210 PolarHBondContact OD2-N 3.02Å; D170-K211 PolarHBondContact OD2-N 3.28Å; D170-G212 PolarHBondContact OD2-N 3.18Å; D170-R232 VanDerWaalsContact O-CB 3.32Å; D170-R232 WeakPolarHBondContact O-CB 3.45Å; D170-R232 WeakPolarHBondContact O-CD 3.3Å; D170-R232 PolarHBondContact O-NE 3.21Å |
| 171 | D | 79.5 | Confident | 91.6 | Very high | 90 Ų | 90 | 38.5 Ų | 38.5 | 48% | 0.481 | 20% | 0.195 | S | C | . | . | S | Bend | trans | -83.9 | -36.9 | -160.9 | -59.9 | -18.7 | 0 | 0 | 0 | 114.1 | V169 R232 | V169-D171 VanDerWaalsContact C-N 3.26Å; V169-D171 PolarHBondContact O-N 3.05Å; D171-R232 PolarHBondContact O-N 3.19Å; D171-R232 VanDerWaalsContact O-N 3.09Å |
| 172 | R | 90.3 | Very high | 91.6 | Very high | 62 Ų | 62 | 41.9 Ų | 41.9 | 23% | 0.234 | 21% | 0.21 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -156 | 162.6 | -162.8 | 57.1 | -175.5 | 152.9 | -132.7 | -4.1 | 116.1 | Y161 C229 W230 | Y161-R172 WeakPolarHBondContact OH-CD 3.49Å; R172-C229 VanDerWaalsContact CB-SG 3.57Å; R172-C229 WeakPolarHBondContact CD-SG 3.26Å; R172-W230 WeakPolarHBondContact CA-O 3.38Å; R172-W230 WeakPolarHBondContact CB-O 3.45Å |
| 173 | L | 93.9 | Very high | 91.5 | Very high | 0 Ų | 0 | 42.1 Ų | 42.1 | 0% | 0 | 21% | 0.211 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -124.7 | 132.9 | 162.1 | -178.5 | 65.8 | 0 | 0 | 0 | 108.6 | F198 D200 F204 W230 L235 F249 I253 | L173-F198 HydrophobicContact CD1-CD1 3.64Å; L173-F198 HydrophobicContact CD1-CE1 4.05Å; L173-F198 HydrophobicContact CD2-CD1 4.2Å; L173-F198 HydrophobicContact CD2-CE1 3.73Å; L173-F198 HydrophobicContact CG-CD1 3.9Å; L173-F198 HydrophobicContact CG-CE1 3.9Å; L173-D200 WeakPolarHBondContact CA-OD1 3.19Å; L173-F204 HydrophobicContact CB-CD2 3.66Å; L173-F204 HydrophobicContact CB-CE2 3.89Å; L173-F204 HydrophobicContact CB-CG 4.38Å; L173-F204 HydrophobicContact CD1-CB 3.65Å; L173-F204 HydrophobicContact CD1-CD1 4.43Å; L173-F204 HydrophobicContact CD1-CD2 3.92Å; L173-F204 HydrophobicContact CD1-CG 3.75Å; L173-F204 HydrophobicContact CD2-CD1 4.41Å; L173-F204 HydrophobicContact CD2-CD2 4.13Å; L173-F204 HydrophobicContact CD2-CE1 4.42Å; L173-F204 HydrophobicContact CD2-CE2 4.09Å; L173-F204 HydrophobicContact CD2-CG 4.26Å; L173-F204 HydrophobicContact CD2-CZ 4.26Å; L173-F204 HydrophobicContact CG-CD2 4.11Å; L173-F204 HydrophobicContact CG-CE2 4.45Å; L173-F204 HydrophobicContact CG-CG 4.36Å; L173-W230 PolarHBondContact N-O 3.44Å; L173-W230 VanDerWaalsContact N-O 3.07Å; L173-W230 PolarHBondContact O-N 2.9Å; L173-L235 HydrophobicContact CB-CD2 4.02Å; L173-L235 HydrophobicContact CD2-CD2 3.52Å; L173-L235 HydrophobicContact CG-CD2 4.36Å; L173-F249 HydrophobicContact CD2-CD1 4.12Å; L173-F249 HydrophobicContact CD2-CE1 3.95Å; L173-I253 HydrophobicContact CD2-CD1 4.19Å |
| 174 | S | 95.2 | Very high | 91.4 | Very high | 0 Ų | 0 | 41.5 Ų | 41.5 | 0% | 0 | 21% | 0.205 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -133.9 | 146.6 | -173.2 | -57.9 | 0 | 0 | 0 | 0 | 114 | Y161 F198 I199 D200 L228 | Y161-S174 WeakPolarHBondContact OH-CB 3.5Å; Y161-S174 PolarHBondContact OH-OG 3.39Å; S174-F198 WeakPolarHBondContact O-CA 3.14Å; S174-I199 PolarHBondContact O-N 3.41Å; S174-D200 PolarHBondContact N-OD1 3.16Å; S174-L228 CarbonylContact C-O 3.57Å; S174-L228 WeakPolarHBondContact CA-O 3.41Å; S174-L228 WeakPolarHBondContact CB-O 3.26Å |
| 175 | I | 95.7 | Very high | 91.4 | Very high | 0 Ų | 0 | 44.2 Ų | 44.2 | 0% | 0 | 22% | 0.215 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -122.4 | 132 | 174.3 | -57.4 | 173.5 | 0 | 0 | 0 | 109.8 | I127 L131 L177 A197 F198 F227 L228 W230 | I127-I175 HydrophobicContact CD1-CB 4.18Å; I127-I175 HydrophobicContact CD1-CG2 3.56Å; L131-I175 HydrophobicContact CD1-CD1 4.42Å; L131-I175 HydrophobicContact CD1-CG2 4.47Å; I175-L177 PolarHBondContact O-N 2.93Å; I175-A197 WeakPolarHBondContact CG2-O 3.06Å; I175-F198 HydrophobicContact CD1-CD1 4.16Å; I175-F198 HydrophobicContact CD1-CE1 3.57Å; I175-F198 HydrophobicContact CD1-CE2 4.08Å; I175-F198 HydrophobicContact CD1-CZ 3.53Å; I175-F198 HydrophobicContact CG1-CD1 3.49Å; I175-F198 VanDerWaalsContact CG1-CD1 3.49Å; I175-F198 HydrophobicContact CG1-CD2 4.34Å; I175-F198 HydrophobicContact CG1-CE1 3.42Å; I175-F198 VanDerWaalsContact CG1-CE1 3.42Å; I175-F198 HydrophobicContact CG1-CE2 4.26Å; I175-F198 HydrophobicContact CG1-CG 3.98Å; I175-F198 HydrophobicContact CG1-CZ 3.84Å; I175-F227 CarbonylContact O-C 3.55Å; I175-F227 VanDerWaalsContact O-CA 3.26Å; I175-F227 WeakPolarHBondContact O-CA 3.41Å; I175-F227 WeakPolarHBondContact O-CB 3.3Å; I175-L228 HydrophobicContact CB-CB 4.46Å; I175-L228 PolarHBondContact N-O 3.11Å; I175-L228 PolarHBondContact O-N 3.35Å; I175-W230 HydrophobicContact CD1-CH2 3.6Å; I175-W230 HydrophobicContact CD1-CZ3 3.58Å; I175-W230 HydrophobicContact CG1-CH2 4.32Å; I175-W230 HydrophobicContact CG1-CZ3 3.84Å |
| 176 | L | 96 | Very high | 91.4 | Very high | 0 Ų | 0 | 47.8 Ų | 47.8 | 0% | 0 | 22% | 0.221 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -72.5 | 120 | 178.1 | -169.3 | 60.1 | 0 | 0 | 0 | 110.8 | K178 M181 I193 P195 C196 A197 I199 C225 F227 | L176-K178 WeakPolarHBondContact CD1-O 3.07Å; L176-M181 HydrophobicContact CD1-CE 3.72Å; L176-M181 HydrophobicContact CD1-CG 4.32Å; L176-M181 HydrophobicContact CD1-SD 4.16Å; L176-M181 HydrophobicContact CD2-CG 4.26Å; L176-I193 HydrophobicContact CB-CG2 4.46Å; L176-I193 HydrophobicContact CD2-CG2 4.1Å; L176-I193 WeakPolarHBondContact CD2-O 3.35Å; L176-P195 WeakPolarHBondContact O-CA 3.43Å; L176-C196 PolarHBondContact O-N 3.43Å; L176-A197 PolarHBondContact N-O 3.38Å; L176-I199 HydrophobicContact CB-CD1 4.43Å; L176-I199 HydrophobicContact CB-CG1 4.29Å; L176-C225 HydrophobicContact CD1-CB 3.97Å; L176-F227 HydrophobicContact CD1-CB 4.29Å |
| 177 | L | 94.1 | Very high | 91.1 | Very high | 23 Ų | 23 | 43 Ų | 43 | 12% | 0.12 | 22% | 0.219 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -85 | -44.8 | 177.1 | -53.2 | -178 | 0 | 0 | 0 | 111.5 | E123 L124 I127 I152 I175 R226 L228 | E123-L177 HydrophobicContact CB-CD1 4.25Å; L124-L177 HydrophobicContact CD1-CD1 4.39Å; I127-L177 HydrophobicContact CD1-CD2 3.09Å; I127-L177 HydrophobicContact CD1-CG 4.46Å; I127-L177 HydrophobicContact CG1-CD2 3.98Å; I152-L177 HydrophobicContact CD1-CD1 4.38Å; I152-L177 HydrophobicContact CG1-CD1 4.41Å; I152-L177 HydrophobicContact CG2-CD1 3.91Å; I175-L177 PolarHBondContact O-N 2.93Å; L177-R226 WeakPolarHBondContact CA-O 3.46Å; L177-R226 HydrophobicContact CB-CB 4.49Å; L177-R226 VanDerWaalsContact CB-O 3.28Å; L177-R226 WeakPolarHBondContact CB-O 3.29Å; L177-R226 PolarHBondContact N-O 3.23Å; L177-L228 HydrophobicContact CD2-CB 3.83Å; L177-L228 HydrophobicContact CG-CB 4.37Å |
| 178 | K | 94.3 | Very high | 90.9 | Very high | 127 Ų | 127 | 47.1 Ų | 47.1 | 55% | 0.552 | 24% | 0.236 | S | C | * | . | E | Extended strand (participates in β ladder) | trans | -150.6 | 151.4 | -173.7 | -176 | 176.8 | 178.7 | -178.8 | 0 | 109.8 | L176 C225 R226 | L176-K178 WeakPolarHBondContact CD1-O 3.07Å; K178-C225 VanDerWaalsContact O-CA 3.25Å; K178-C225 WeakPolarHBondContact O-CA 3.25Å; K178-R226 PolarHBondContact N-O 3.48Å; K178-R226 VanDerWaalsContact N-O 3.1Å; K178-R226 PolarHBondContact O-N 3.15Å |
| 179 | G | 94.7 | Very high | 90.9 | Very high | 17 Ų | 17 | 49.2 Ų | 49.2 | 18% | 0.175 | 24% | 0.24 | C | C | . | . | S | Bend | trans | 93.2 | -161.8 | 178.3 | 0 | 0 | 0 | 0 | 0 | 111.3 | P195 | G179-P195 VanDerWaalsContact O-CD 3.28Å; G179-P195 WeakPolarHBondContact O-CD 3.37Å; G179-P195 VanDerWaalsContact O-CG 3.32Å; G179-P195 WeakPolarHBondContact O-CG 3.31Å |
| 180 | K | 96.3 | Very high | 91.2 | Very high | 45 Ų | 45 | 51.6 Ų | 51.6 | 20% | 0.196 | 25% | 0.253 | C | S | . | . | trans | -147.2 | 136.3 | -176.5 | -177.6 | -175.3 | 170.2 | -143.4 | 0 | 108.8 | N192 Y194 D222 D223 C225 | K180-N192 VanDerWaalsContact CE-ND2 3.29Å; K180-N192 WeakPolarHBondContact CE-ND2 3.32Å; K180-N192 WeakPolarHBondContact CE-OD1 3.38Å; K180-N192 HydrophobicContact CG-CB 4.4Å; K180-N192 PolarHBondContact NZ-ND2 3.46Å; K180-Y194 HydrophobicContact CD-CD1 4.43Å; K180-Y194 HydrophobicContact CD-CE1 3.79Å; K180-Y194 HydrophobicContact CG-CD1 4.18Å; K180-Y194 HydrophobicContact CG-CE1 3.97Å; K180-D222 HydrophobicContact CB-CB 4.42Å; K180-D222 HydrophobicContact CD-CB 4.48Å; K180-D222 WeakPolarHBondContact CD-OD2 3.24Å; K180-D222 WeakPolarHBondContact CE-OD2 3.34Å; K180-D222 HydrophobicContact CG-CB 4.32Å; K180-D222 IonicContact NZ-OD2 3.15Å; K180-D222 PolarHBondContact NZ-OD2 2.88Å; K180-D222 WeakPolarHBondContact O-CA 3.45Å; K180-D222 WeakPolarHBondContact O-CB 3.43Å; K180-D222 PolarHBondContact O-N 3.32Å; K180-D223 PolarHBondContact O-N 3.47Å; K180-C225 PolarHBondContact N-SG 2.9Å; K180-C225 VanDerWaalsContact N-SG 3.43Å; K180-C225 PolarHBondContact O-SG 3.2Å | ||
| 181 | M | 97.4 | Very high | 91.9 | Very high | 0 Ų | 0 | 51.4 Ų | 51.4 | 0% | 0 | 25% | 0.251 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -116.6 | 150.4 | 175.6 | -60.9 | 178.1 | 170.3 | 0 | 0 | 110.2 | L155 L176 N192 I193 I199 I219 I220 C225 F227 | L155-M181 HydrophobicContact CD2-CE 4.11Å; L176-M181 HydrophobicContact CD1-CE 3.72Å; L176-M181 HydrophobicContact CD1-CG 4.32Å; L176-M181 HydrophobicContact CD1-SD 4.16Å; L176-M181 HydrophobicContact CD2-CG 4.26Å; M181-N192 CarbonylContact O-C 3.59Å; M181-N192 VanDerWaalsContact O-CA 3.29Å; M181-N192 WeakPolarHBondContact O-CA 3.36Å; M181-I193 HydrophobicContact CB-CB 4.24Å; M181-I193 PolarHBondContact N-O 3.47Å; M181-I193 PolarHBondContact O-N 2.72Å; M181-I199 HydrophobicContact CE-CD1 3.81Å; M181-I199 HydrophobicContact SD-CD1 3.73Å; M181-I199 HydrophobicContact SD-CG1 4.1Å; M181-I199 HydrophobicContact SD-CG2 4.12Å; M181-I219 HydrophobicContact CB-CG2 4.1Å; M181-I219 HydrophobicContact SD-CG2 4.12Å; M181-I220 CarbonylContact C-O 3.53Å; M181-I220 WeakPolarHBondContact CA-O 3.09Å; M181-C225 HydrophobicContact CE-CB 3.69Å; M181-F227 HydrophobicContact CE-CD1 3.9Å; M181-F227 HydrophobicContact CE-CE1 4.43Å |
| 182 | K | 95.5 | Very high | 92.6 | Very high | 85 Ų | 85 | 49 Ų | 49 | 37% | 0.37 | 24% | 0.238 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -110.5 | 129.4 | 178.4 | -179 | -179.6 | 175.6 | -176.6 | 0 | 109 | F189 I219 I220 | K182-F189 HydrophobicContact CD-CD2 3.96Å; K182-F189 HydrophobicContact CD-CE2 4.4Å; K182-F189 HydrophobicContact CG-CD2 3.52Å; K182-F189 HydrophobicContact CG-CE2 3.7Å; K182-I219 WeakPolarHBondContact O-CA 3.36Å; K182-I220 PolarHBondContact N-O 2.99Å; K182-I220 PolarHBondContact O-N 3.41Å |
| 183 | V | 94.4 | Very high | 92.9 | Very high | 4 Ų | 4 | 46.2 Ų | 46.2 | 2% | 0.024 | 23% | 0.228 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -102.6 | 136.1 | 174.7 | -171.3 | 0 | 0 | 0 | 0 | 109.3 | L190 H191 I193 V217 I219 | V183-L190 HydrophobicContact CG1-CB 4.5Å; V183-L190 HydrophobicContact CG1-CD1 4.32Å; V183-L190 PolarHBondContact O-N 2.65Å; V183-H191 PolarHBondContact N-O 3.07Å; V183-I193 HydrophobicContact CG2-CD1 3.39Å; V183-I193 HydrophobicContact CG2-CG1 3.73Å; V183-V217 HydrophobicContact CG1-CB 3.88Å; V183-V217 HydrophobicContact CG1-CG1 4.31Å; V183-V217 HydrophobicContact CG1-CG2 3.79Å; V183-I219 HydrophobicContact CG1-CG1 4.4Å; V183-I219 HydrophobicContact CG2-CG1 4.32Å |
| 184 | S | 90.7 | Very high | 92.9 | Very high | 13 Ų | 13 | 52.3 Ų | 52.3 | 9% | 0.091 | 25% | 0.252 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -141.3 | 145.6 | 177.1 | 54.1 | 0 | 0 | 0 | 0 | 112.2 | H188 T218 | S184-H188 CarbonylContact C-O 3.42Å; S184-H188 WeakPolarHBondContact CA-O 3.19Å; S184-H188 WeakPolarHBondContact CB-O 3.14Å; S184-T218 PolarHBondContact N-O 3.37Å; S184-T218 PolarHBondContact O-N 3.25Å; S184-T218 PolarHBondContact OG-O 3.25Å |
| 185 | Y | 90.3 | Very high | 92.9 | Very high | 90 Ų | 90 | 54.5 Ų | 54.5 | 35% | 0.353 | 27% | 0.266 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -117.1 | 123 | 174.1 | 178 | -109.8 | 0 | 0 | 0 | 109.1 | G187 H188 Q216 V217 | Y185-G187 PolarHBondContact O-N 2.88Å; Y185-G187 VanDerWaalsContact O-N 3.08Å; Y185-H188 PolarHBondContact N-O 3.41Å; Y185-H188 WeakPolarHBondContact O-CB 3.45Å; Y185-H188 PolarHBondContact O-N 2.85Å; Y185-Q216 WeakPolarHBondContact CD2-O 3.48Å; Y185-Q216 WeakPolarHBondContact CE2-O 3.26Å; Y185-V217 HydrophobicContact CD2-CG1 4.32Å |
| 186 | R | 88.8 | Confident | 92.8 | Very high | 179 Ų | 179 | 55.4 Ų | 55.4 | 68% | 0.675 | 27% | 0.272 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 50.1 | 36.4 | -176.5 | -60.6 | -177.4 | 172.1 | 178.7 | -1 | 113.5 | E164 H188 | E164-R186 WeakPolarHBondContact OE1-CG 3.44Å; E164-R186 PolarHBondContact OE2-N 2.82Å; R186-H188 VanDerWaalsContact C-N 3.26Å; R186-H188 PolarHBondContact O-CD2 2.91Å; R186-H188 PolarHBondContact O-N 3.03Å |
| 187 | G | 84.6 | Confident | 92.8 | Very high | 69 Ų | 69 | 56.4 Ų | 56.4 | 71% | 0.711 | 28% | 0.281 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 78.5 | -5.5 | -176.9 | 0 | 0 | 0 | 0 | 0 | 115.9 | Y185 | Y185-G187 PolarHBondContact O-N 2.88Å; Y185-G187 VanDerWaalsContact O-N 3.08Å |
| 188 | H | 87.3 | Confident | 92.9 | Very high | 119 Ų | 119 | 55.5 Ų | 55.5 | 55% | 0.551 | 28% | 0.276 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -82.7 | 129.6 | 173 | -66 | -90.8 | 0 | 0 | 0 | 110.5 | S184 Y185 R186 L190 | S184-H188 CarbonylContact C-O 3.42Å; S184-H188 WeakPolarHBondContact CA-O 3.19Å; S184-H188 WeakPolarHBondContact CB-O 3.14Å; Y185-H188 PolarHBondContact N-O 3.41Å; Y185-H188 WeakPolarHBondContact O-CB 3.45Å; Y185-H188 PolarHBondContact O-N 2.85Å; R186-H188 VanDerWaalsContact C-N 3.26Å; R186-H188 PolarHBondContact O-CD2 2.91Å; R186-H188 PolarHBondContact O-N 3.03Å; H188-L190 PolarHBondContact O-N 3.12Å |
| 189 | F | 89.6 | Confident | 93 | Very high | 83 Ų | 83 | 49.6 Ų | 49.6 | 36% | 0.364 | 25% | 0.25 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -65.4 | 133.5 | 175 | 172.6 | -111.9 | 0 | 0 | 0 | 110.6 | K182 H191 N192 | K182-F189 HydrophobicContact CD-CD2 3.96Å; K182-F189 HydrophobicContact CD-CE2 4.4Å; K182-F189 HydrophobicContact CG-CD2 3.52Å; K182-F189 HydrophobicContact CG-CE2 3.7Å; F189-H191 VanDerWaalsContact CE2-C 3.4Å; F189-H191 VanDerWaalsContact CE2-O 3.31Å; F189-H191 WeakPolarHBondContact CE2-O 3.28Å; F189-N192 VanDerWaalsContact CE2-OD1 3.29Å; F189-N192 WeakPolarHBondContact CE2-OD1 3.42Å |
| 190 | L | 89 | Confident | 92.9 | Very high | 54 Ų | 54 | 48.9 Ų | 48.9 | 28% | 0.283 | 24% | 0.242 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -105.1 | -71.6 | 176.6 | -70 | -172.2 | 0 | 0 | 0 | 110.7 | V183 H188 V217 L264 | V183-L190 HydrophobicContact CG1-CB 4.5Å; V183-L190 HydrophobicContact CG1-CD1 4.32Å; V183-L190 PolarHBondContact O-N 2.65Å; H188-L190 PolarHBondContact O-N 3.12Å; L190-V217 HydrophobicContact CD1-CG1 4.06Å; L190-L264 HydrophobicContact CB-CD2 3.68Å; L190-L264 HydrophobicContact CD1-CD2 4.32Å; L190-L264 HydrophobicContact CD2-CD2 4.09Å; L190-L264 HydrophobicContact CG-CD2 4.24Å |
| 191 | H | 92.1 | Very high | 92.8 | Very high | 19 Ų | 19 | 46.7 Ų | 46.7 | 9% | 0.088 | 23% | 0.233 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -153.1 | 169.7 | -179.2 | 65.7 | -82.8 | 0 | 0 | 0 | 110.9 | V183 F189 | V183-H191 PolarHBondContact N-O 3.07Å; F189-H191 VanDerWaalsContact CE2-C 3.4Å; F189-H191 VanDerWaalsContact CE2-O 3.31Å; F189-H191 WeakPolarHBondContact CE2-O 3.28Å |
| 192 | N | 94.2 | Very high | 92.6 | Very high | 39 Ų | 39 | 48.8 Ų | 48.8 | 21% | 0.209 | 25% | 0.246 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -101.8 | 144 | 173.3 | -66.1 | -50.2 | 0 | 0 | 0 | 110.4 | K180 M181 F189 Y194 | K180-N192 VanDerWaalsContact CE-ND2 3.29Å; K180-N192 WeakPolarHBondContact CE-ND2 3.32Å; K180-N192 WeakPolarHBondContact CE-OD1 3.38Å; K180-N192 HydrophobicContact CG-CB 4.4Å; K180-N192 PolarHBondContact NZ-ND2 3.46Å; M181-N192 CarbonylContact O-C 3.59Å; M181-N192 VanDerWaalsContact O-CA 3.29Å; M181-N192 WeakPolarHBondContact O-CA 3.36Å; F189-N192 VanDerWaalsContact CE2-OD1 3.29Å; F189-N192 WeakPolarHBondContact CE2-OD1 3.42Å; N192-Y194 HydrophobicContact CB-CE1 4.5Å; N192-Y194 HydrophobicContact CB-CE2 3.86Å |
| 193 | I | 96.1 | Very high | 92.3 | Very high | 5 Ų | 5 | 45.9 Ų | 45.9 | 3% | 0.026 | 23% | 0.234 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -101.8 | 128.3 | 171.9 | -58.3 | 164.1 | 0 | 0 | 0 | 107.9 | L176 M181 V183 A197 I199 I219 | L176-I193 HydrophobicContact CB-CG2 4.46Å; L176-I193 HydrophobicContact CD2-CG2 4.1Å; L176-I193 WeakPolarHBondContact CD2-O 3.35Å; M181-I193 HydrophobicContact CB-CB 4.24Å; M181-I193 PolarHBondContact N-O 3.47Å; M181-I193 PolarHBondContact O-N 2.72Å; V183-I193 HydrophobicContact CG2-CD1 3.39Å; V183-I193 HydrophobicContact CG2-CG1 3.73Å; I193-A197 HydrophobicContact CG2-CB 3.99Å; I193-I199 HydrophobicContact CD1-CG2 4.25Å; I193-I219 HydrophobicContact CD1-CG2 4.29Å |
| 194 | Y | 95.4 | Very high | 92.1 | Very high | 128 Ų | 128 | 47.1 Ų | 47.1 | 50% | 0.502 | 24% | 0.239 | S | C | . | . | trans | -111.4 | 165.3 | -176.5 | -67.6 | -73.4 | 0 | 0 | 0 | 112.1 | K180 N192 A197 | K180-Y194 HydrophobicContact CD-CD1 4.43Å; K180-Y194 HydrophobicContact CD-CE1 3.79Å; K180-Y194 HydrophobicContact CG-CD1 4.18Å; K180-Y194 HydrophobicContact CG-CE1 3.97Å; N192-Y194 HydrophobicContact CB-CE1 4.5Å; N192-Y194 HydrophobicContact CB-CE2 3.86Å; Y194-A197 VanDerWaalsContact O-CB 3.28Å; Y194-A197 WeakPolarHBondContact O-CB 3.27Å; Y194-A197 PolarHBondContact O-N 3.31Å; Y194-A197 VanDerWaalsContact O-N 3.15Å | ||
| 195 | P | 95.2 | Very high | 92 | Very high | 45 Ų | 45 | 51.7 Ų | 51.7 | 29% | 0.292 | 25% | 0.254 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -56.2 | 140.8 | 179 | -27.4 | 37.4 | 0 | 0 | 0 | 113.1 | R130 L176 G179 A197 | R130-P195 PolarHBondContact NH1-O 3.29Å; L176-P195 WeakPolarHBondContact O-CA 3.43Å; G179-P195 VanDerWaalsContact O-CD 3.28Å; G179-P195 WeakPolarHBondContact O-CD 3.37Å; G179-P195 VanDerWaalsContact O-CG 3.32Å; G179-P195 WeakPolarHBondContact O-CG 3.31Å; P195-A197 VanDerWaalsContact C-N 3.31Å |
| 196 | C | 93.3 | Very high | 91.7 | Very high | 20 Ų | 20 | 49.1 Ų | 49.1 | 14% | 0.135 | 25% | 0.25 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 70.7 | 16.6 | -172.2 | -50.8 | 0 | 0 | 0 | 0 | 115.3 | R130 L131 L176 | R130-C196 PolarHBondContact NH1-SG 3.49Å; L131-C196 HydrophobicContact CD1-CB 4.37Å; L131-C196 HydrophobicContact CD2-CB 4.46Å; L131-C196 HydrophobicContact CG-CB 4.35Å; L176-C196 PolarHBondContact O-N 3.43Å |
| 197 | A | 95.1 | Very high | 91.3 | Very high | 21 Ų | 21 | 41.3 Ų | 41.3 | 17% | 0.174 | 22% | 0.222 | C | C | . | . | S | Bend | trans | -104 | 151.5 | 166.4 | 0 | 0 | 0 | 0 | 0 | 110.9 | I175 L176 I193 Y194 P195 D256 | I175-A197 WeakPolarHBondContact CG2-O 3.06Å; L176-A197 PolarHBondContact N-O 3.38Å; I193-A197 HydrophobicContact CG2-CB 3.99Å; Y194-A197 VanDerWaalsContact O-CB 3.28Å; Y194-A197 WeakPolarHBondContact O-CB 3.27Å; Y194-A197 PolarHBondContact O-N 3.31Å; Y194-A197 VanDerWaalsContact O-N 3.15Å; P195-A197 VanDerWaalsContact C-N 3.31Å; A197-D256 WeakPolarHBondContact CA-OD1 3.46Å |
| 198 | F | 96.6 | Very high | 90.9 | Very high | 4 Ų | 4 | 42.9 Ų | 42.9 | 2% | 0.018 | 21% | 0.211 | C | C | . | . | B | Isolated β-bridge | trans | -72.4 | 147.6 | 171.7 | -74.6 | -95 | 0 | 0 | 0 | 109.9 | L173 S174 I175 W230 F249 L252 I253 D256 K260 | L173-F198 HydrophobicContact CD1-CD1 3.64Å; L173-F198 HydrophobicContact CD1-CE1 4.05Å; L173-F198 HydrophobicContact CD2-CD1 4.2Å; L173-F198 HydrophobicContact CD2-CE1 3.73Å; L173-F198 HydrophobicContact CG-CD1 3.9Å; L173-F198 HydrophobicContact CG-CE1 3.9Å; S174-F198 WeakPolarHBondContact O-CA 3.14Å; I175-F198 HydrophobicContact CD1-CD1 4.16Å; I175-F198 HydrophobicContact CD1-CE1 3.57Å; I175-F198 HydrophobicContact CD1-CE2 4.08Å; I175-F198 HydrophobicContact CD1-CZ 3.53Å; I175-F198 HydrophobicContact CG1-CD1 3.49Å; I175-F198 VanDerWaalsContact CG1-CD1 3.49Å; I175-F198 HydrophobicContact CG1-CD2 4.34Å; I175-F198 HydrophobicContact CG1-CE1 3.42Å; I175-F198 VanDerWaalsContact CG1-CE1 3.42Å; I175-F198 HydrophobicContact CG1-CE2 4.26Å; I175-F198 HydrophobicContact CG1-CG 3.98Å; I175-F198 HydrophobicContact CG1-CZ 3.84Å; F198-W230 HydrophobicContact CE1-CZ3 4.48Å; F198-F249 HydrophobicContact CE1-CE1 4.49Å; F198-L252 HydrophobicContact CE2-CB 4.02Å; F198-L252 HydrophobicContact CZ-CB 4.41Å; F198-I253 HydrophobicContact CE1-CG1 4.48Å; F198-I253 HydrophobicContact CZ-CG1 4.4Å; F198-D256 HydrophobicContact CB-CB 4.45Å; F198-D256 HydrophobicContact CD2-CB 3.97Å; F198-D256 PolarHBondContact N-OD1 2.81Å; F198-K260 VanDerWaalsContact O-CE 3.27Å; F198-K260 WeakPolarHBondContact O-CE 3.19Å; F198-K260 PolarHBondContact O-NZ 3.36Å |
| 199 | I | 95.9 | Very high | 90.4 | Very high | 2 Ų | 2 | 40.1 Ų | 40.1 | 1% | 0.01 | 20% | 0.199 | C | C | . | . | S | Bend | trans | -86 | -50.7 | 179.1 | -57.9 | 173.5 | 0 | 0 | 0 | 109.4 | Y161 S174 L176 M181 I193 I219 F227 K260 | Y161-I199 HydrophobicContact CD1-CG2 3.6Å; Y161-I199 HydrophobicContact CE1-CB 4.33Å; Y161-I199 HydrophobicContact CE1-CG2 3.45Å; Y161-I199 VanDerWaalsContact CE1-CG2 3.45Å; Y161-I199 HydrophobicContact CE2-CD1 4.3Å; Y161-I199 HydrophobicContact CE2-CG2 4.45Å; Y161-I199 HydrophobicContact CG-CG2 4.18Å; S174-I199 PolarHBondContact O-N 3.41Å; L176-I199 HydrophobicContact CB-CD1 4.43Å; L176-I199 HydrophobicContact CB-CG1 4.29Å; M181-I199 HydrophobicContact CE-CD1 3.81Å; M181-I199 HydrophobicContact SD-CD1 3.73Å; M181-I199 HydrophobicContact SD-CG1 4.1Å; M181-I199 HydrophobicContact SD-CG2 4.12Å; I193-I199 HydrophobicContact CD1-CG2 4.25Å; I199-I219 HydrophobicContact CG2-CD1 3.95Å; I199-I219 HydrophobicContact CG2-CG2 4.23Å; I199-F227 HydrophobicContact CD1-CB 3.63Å; I199-F227 HydrophobicContact CD1-CD1 4.47Å; I199-F227 HydrophobicContact CD1-CD2 4.21Å; I199-F227 HydrophobicContact CD1-CG 3.88Å; I199-K260 PolarHBondContact O-NZ 2.99Å |
| 200 | D | 93.9 | Very high | 89.8 | Confident | 2 Ų | 2 | 44 Ų | 44 | 1% | 0.011 | 22% | 0.217 | C | C | . | . | S | Bend | trans | -118.6 | 29.6 | -167.8 | 46.9 | 6 | 0 | 0 | 0 | 112.5 | Y161 L173 S174 E203 F204 F215 | Y161-D200 PolarHBondContact OH-OD2 3.11Å; L173-D200 WeakPolarHBondContact CA-OD1 3.19Å; S174-D200 PolarHBondContact N-OD1 3.16Å; D200-E203 WeakPolarHBondContact CA-OE2 3.38Å; D200-E203 PolarHBondContact O-N 2.95Å; D200-F204 VanDerWaalsContact O-CB 3.3Å; D200-F204 WeakPolarHBondContact O-CB 3.25Å; D200-F204 PolarHBondContact O-N 3.11Å; D200-F215 HydrophobicContact CB-CE1 3.97Å; D200-F215 HydrophobicContact CB-CZ 3.81Å |
| 201 | S | 94.1 | Very high | 89.3 | Confident | 0 Ų | 0 | 45.8 Ų | 45.8 | 0% | 0 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -60.5 | -39.8 | 177.1 | 46 | 0 | 0 | 0 | 0 | 114.6 | F204 R205 D256 K260 | S201-F204 PolarHBondContact O-N 2.93Å; S201-R205 PolarHBondContact O-N 3.09Å; S201-R205 VanDerWaalsContact O-N 3.17Å; S201-D256 PolarHBondContact OG-OD2 2.96Å; S201-K260 PolarHBondContact OG-NZ 3.32Å |
| 202 | P | 91.7 | Very high | 88.6 | Confident | 44 Ų | 44 | 47.3 Ų | 47.3 | 29% | 0.286 | 24% | 0.244 | S | C | . | . | H | α-helix | trans | -63.7 | -49.2 | 175.2 | -19.7 | 33.9 | 0 | 0 | 0 | 111.2 | F204 R205 S206 I257 K260 | P202-F204 VanDerWaalsContact C-N 3.27Å; P202-F204 PolarHBondContact O-N 3.45Å; P202-R205 PolarHBondContact O-N 3.46Å; P202-R205 VanDerWaalsContact O-N 3.13Å; P202-S206 WeakPolarHBondContact O-CB 3.47Å; P202-S206 PolarHBondContact O-N 2.73Å; P202-S206 PolarHBondContact O-OG 3.05Å; P202-I257 HydrophobicContact CG-CG1 4.35Å; P202-K260 HydrophobicContact CG-CD 4.21Å |
| 203 | E | 90.2 | Very high | 88.3 | Confident | 23 Ų | 23 | 48.3 Ų | 48.3 | 11% | 0.107 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -61.9 | -36.5 | 178.7 | -65.1 | 79.1 | -171.7 | 0 | 0 | 111.3 | V169 D200 R205 T207 F215 R232 | V169-E203 HydrophobicContact CB-CB 4.1Å; V169-E203 HydrophobicContact CG1-CB 3.91Å; V169-E203 HydrophobicContact CG1-CG 3.82Å; D200-E203 WeakPolarHBondContact CA-OE2 3.38Å; D200-E203 PolarHBondContact O-N 2.95Å; E203-R205 VanDerWaalsContact C-N 3.34Å; E203-R205 PolarHBondContact O-N 2.7Å; E203-T207 WeakPolarHBondContact O-CG2 3.37Å; E203-T207 PolarHBondContact O-N 2.7Å; E203-T207 PolarHBondContact O-OG1 3.47Å; E203-F215 HydrophobicContact CB-CE1 4.3Å; E203-F215 HydrophobicContact CB-CZ 4.46Å; E203-F215 HydrophobicContact CG-CD1 3.73Å; E203-F215 HydrophobicContact CG-CE1 3.64Å; E203-F215 HydrophobicContact CG-CG 4.38Å; E203-F215 HydrophobicContact CG-CZ 4.22Å; E203-R232 PolarHBondContact O-NH2 3.46Å; E203-R232 VanDerWaalsContact O-NH2 3.16Å |
| 204 | F | 89.8 | Confident | 87.9 | Confident | 31 Ų | 31 | 53.3 Ų | 53.3 | 14% | 0.136 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -62.2 | -41.2 | 175.4 | -172.8 | -89.4 | 0 | 0 | 0 | 113 | L173 D200 S201 P202 R232 L235 I253 | L173-F204 HydrophobicContact CB-CD2 3.66Å; L173-F204 HydrophobicContact CB-CE2 3.89Å; L173-F204 HydrophobicContact CB-CG 4.38Å; L173-F204 HydrophobicContact CD1-CB 3.65Å; L173-F204 HydrophobicContact CD1-CD1 4.43Å; L173-F204 HydrophobicContact CD1-CD2 3.92Å; L173-F204 HydrophobicContact CD1-CG 3.75Å; L173-F204 HydrophobicContact CD2-CD1 4.41Å; L173-F204 HydrophobicContact CD2-CD2 4.13Å; L173-F204 HydrophobicContact CD2-CE1 4.42Å; L173-F204 HydrophobicContact CD2-CE2 4.09Å; L173-F204 HydrophobicContact CD2-CG 4.26Å; L173-F204 HydrophobicContact CD2-CZ 4.26Å; L173-F204 HydrophobicContact CG-CD2 4.11Å; L173-F204 HydrophobicContact CG-CE2 4.45Å; L173-F204 HydrophobicContact CG-CG 4.36Å; D200-F204 VanDerWaalsContact O-CB 3.3Å; D200-F204 WeakPolarHBondContact O-CB 3.25Å; D200-F204 PolarHBondContact O-N 3.11Å; S201-F204 PolarHBondContact O-N 2.93Å; P202-F204 VanDerWaalsContact C-N 3.27Å; P202-F204 PolarHBondContact O-N 3.45Å; F204-R232 VanDerWaalsContact CA-NH2 3.33Å; F204-R232 HydrophobicContact CD2-CG 4.03Å; F204-R232 HydrophobicContact CE2-CG 3.6Å; F204-R232 PolarHBondContact O-NH1 3.41Å; F204-L235 HydrophobicContact CE2-CD2 4.39Å; F204-L235 HydrophobicContact CZ-CD2 4.42Å; F204-I253 HydrophobicContact CD1-CD1 3.69Å; F204-I253 HydrophobicContact CE1-CD1 3.81Å |
| 205 | R | 89 | Confident | 87.7 | Confident | 108 Ų | 108 | 47.4 Ų | 47.4 | 41% | 0.408 | 25% | 0.246 | S | C | . | . | H | α-helix | trans | -82.3 | -35.5 | -176.8 | -171.7 | 176.4 | -175.9 | -176.6 | 1.2 | 113.2 | S201 P202 E203 I253 I257 L306 | S201-R205 PolarHBondContact O-N 3.09Å; S201-R205 VanDerWaalsContact O-N 3.17Å; P202-R205 PolarHBondContact O-N 3.46Å; P202-R205 VanDerWaalsContact O-N 3.13Å; E203-R205 VanDerWaalsContact C-N 3.34Å; E203-R205 PolarHBondContact O-N 2.7Å; R205-I253 HydrophobicContact CB-CG2 4.19Å; R205-I257 HydrophobicContact CB-CD1 3.85Å; R205-I257 VanDerWaalsContact CD-CD1 3.43Å; R205-I257 HydrophobicContact CG-CD1 4.27Å; R205-L306 VanDerWaalsContact NH2-CD2 3.31Å |
| 206 | S | 83.6 | Confident | 87.4 | Confident | 37 Ų | 37 | 51.1 Ų | 51.1 | 26% | 0.259 | 26% | 0.259 | S | S | . | . | H | α-helix | trans | -82.3 | -26.1 | -173.1 | 64.7 | 0 | 0 | 0 | 0 | 113.4 | P202 | P202-S206 WeakPolarHBondContact O-CB 3.47Å; P202-S206 PolarHBondContact O-N 2.73Å; P202-S206 PolarHBondContact O-OG 3.05Å |
| 207 | T | 81.8 | Confident | 87.3 | Confident | 15 Ų | 15 | 51.1 Ų | 51.1 | 9% | 0.092 | 26% | 0.259 | C | S | . | . | trans | -105.9 | 153.4 | -172.2 | 75.8 | 0 | 0 | 0 | 0 | 112.7 | V169 E203 E213 R232 | V169-T207 HydrophobicContact CB-CG2 4.36Å; V169-T207 HydrophobicContact CG2-CG2 3.63Å; V169-T207 VanDerWaalsContact CG2-OG1 3.29Å; V169-T207 WeakPolarHBondContact CG2-OG1 3.39Å; E203-T207 WeakPolarHBondContact O-CG2 3.37Å; E203-T207 PolarHBondContact O-N 2.7Å; E203-T207 PolarHBondContact O-OG1 3.47Å; T207-E213 WeakPolarHBondContact CA-OE2 3.28Å; T207-E213 WeakPolarHBondContact CB-OE2 3.44Å; T207-E213 HydrophobicContact CG2-CB 3.98Å; T207-E213 HydrophobicContact CG2-CG 4.4Å; T207-R232 PolarHBondContact OG1-NH2 2.86Å; T207-R232 VanDerWaalsContact OG1-NH2 3.07Å | ||
| 208 | Q | 75.1 | Confident | 87.3 | Confident | 102 Ų | 102 | 51.5 Ų | 51.5 | 48% | 0.477 | 26% | 0.259 | S | S | . | . | trans | -105.5 | 148.4 | 173.3 | -67.5 | 178.8 | -3.3 | 0 | 0 | 109.5 | K211 E213 | Q208-K211 HydrophobicContact CB-CD 3.98Å; Q208-K211 HydrophobicContact CB-CG 4.34Å; Q208-K211 VanDerWaalsContact CD-NZ 3.32Å; Q208-E213 PolarHBondContact N-OE2 3.29Å | ||
| 209 | M | 77.2 | Confident | 87.3 | Confident | 61 Ų | 61 | 51.4 Ų | 51.4 | 30% | 0.3 | 26% | 0.258 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -56.8 | 143.9 | 177.2 | -72.8 | 176.2 | -176.2 | 0 | 0 | 111.8 | K211 R232 E233 T236 | M209-K211 VanDerWaalsContact C-N 3.28Å; M209-K211 PolarHBondContact O-N 3.28Å; M209-R232 HydrophobicContact CE-CB 3.94Å; M209-R232 HydrophobicContact CE-CG 3.4Å; M209-R232 VanDerWaalsContact CE-CG 3.4Å; M209-R232 WeakPolarHBondContact CE-O 3.31Å; M209-R232 HydrophobicContact CG-CG 4.44Å; M209-E233 VanDerWaalsContact CE-CA 3.43Å; M209-E233 HydrophobicContact CE-CB 4.38Å; M209-T236 HydrophobicContact CE-CG2 4.5Å; M209-T236 VanDerWaalsContact CE-OG1 3.31Å; M209-T236 WeakPolarHBondContact CE-OG1 3.4Å |
| 210 | H | 75.7 | Confident | 87.4 | Confident | 163 Ų | 163 | 54 Ų | 54 | 76% | 0.755 | 27% | 0.272 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 67.7 | 19.9 | 172.7 | -46.9 | -62.4 | 0 | 0 | 0 | 115.2 | D170 | D170-H210 WeakPolarHBondContact OD2-CA 3.31Å; D170-H210 PolarHBondContact OD2-N 3.02Å |
| 211 | K | 79.3 | Confident | 87.6 | Confident | 93 Ų | 93 | 54 Ų | 54 | 40% | 0.404 | 27% | 0.272 | S | S | . | . | S | Bend | trans | -90.1 | -11.8 | 172.9 | -72.6 | -166.6 | 179.1 | 173.7 | 0 | 113.6 | D170 Q208 M209 E213 | D170-K211 PolarHBondContact OD2-N 3.28Å; Q208-K211 HydrophobicContact CB-CD 3.98Å; Q208-K211 HydrophobicContact CB-CG 4.34Å; Q208-K211 VanDerWaalsContact CD-NZ 3.32Å; M209-K211 VanDerWaalsContact C-N 3.28Å; M209-K211 PolarHBondContact O-N 3.28Å; K211-E213 HydrophobicContact CB-CG 3.98Å; K211-E213 PolarHBondContact O-N 3.23Å |
| 212 | G | 78.6 | Confident | 87.7 | Confident | 50 Ų | 50 | 56.4 Ų | 56.4 | 52% | 0.515 | 29% | 0.285 | S | S | . | . | trans | 66.9 | 25 | -179 | 0 | 0 | 0 | 0 | 0 | 112.9 | D170 | D170-G212 PolarHBondContact OD2-N 3.18Š| ||
| 213 | E | 86.2 | Confident | 87.9 | Confident | 61 Ų | 61 | 57.6 Ų | 57.6 | 29% | 0.285 | 29% | 0.289 | S | S | . | . | trans | -64.3 | 150.1 | 173 | -67.4 | -179.2 | 91.8 | 0 | 0 | 109.5 | V169 T207 Q208 K211 | V169-E213 HydrophobicContact CG2-CB 3.59Å; V169-E213 VanDerWaalsContact CG2-O 3.3Å; V169-E213 WeakPolarHBondContact CG2-O 3.39Å; V169-E213 PolarHBondContact N-O 3.42Å; T207-E213 WeakPolarHBondContact CA-OE2 3.28Å; T207-E213 WeakPolarHBondContact CB-OE2 3.44Å; T207-E213 HydrophobicContact CG2-CB 3.98Å; T207-E213 HydrophobicContact CG2-CG 4.4Å; Q208-E213 PolarHBondContact N-OE2 3.29Å; K211-E213 HydrophobicContact CB-CG 3.98Å; K211-E213 PolarHBondContact O-N 3.23Å | ||
| 214 | K | 89.3 | Confident | 88.2 | Confident | 110 Ų | 110 | 61.8 Ų | 61.8 | 48% | 0.478 | 31% | 0.312 | S | S | . | . | B | Isolated β-bridge | trans | -121.6 | 155.4 | -175.9 | -60.4 | -173 | -173.6 | 169.7 | 0 | 110.8 | D165 T167 V169 Q216 | D165-K214 WeakPolarHBondContact O-CD 3.34Å; D165-K214 PolarHBondContact O-NZ 3.3Å; T167-K214 CarbonylContact O-C 3.59Å; T167-K214 VanDerWaalsContact O-CA 3.25Å; T167-K214 WeakPolarHBondContact O-CA 3.43Å; T167-K214 WeakPolarHBondContact O-CB 3.35Å; V169-K214 VanDerWaalsContact CG1-C 3.44Å; K214-Q216 PolarHBondContact O-N 3.28Å |
| 215 | F | 89.5 | Confident | 88.5 | Confident | 4 Ų | 4 | 60.4 Ų | 60.4 | 2% | 0.018 | 31% | 0.306 | C | S | . | . | trans | -57.7 | 127.3 | 174.8 | -85.2 | -95.3 | 0 | 0 | 0 | 109.6 | Y161 A162 E164 D165 T167 S168 V169 D200 E203 V217 I219 | Y161-F215 HydrophobicContact CE1-CZ 4.26Å; A162-F215 HydrophobicContact CB-CB 4.15Å; A162-F215 HydrophobicContact CB-CD1 3.62Å; A162-F215 HydrophobicContact CB-CD2 3.79Å; A162-F215 HydrophobicContact CB-CE1 3.89Å; A162-F215 HydrophobicContact CB-CE2 4.04Å; A162-F215 HydrophobicContact CB-CG 3.57Å; A162-F215 HydrophobicContact CB-CZ 4.1Å; E164-F215 CarbonylContact C-O 3.44Å; E164-F215 WeakPolarHBondContact CA-O 3.14Å; D165-F215 PolarHBondContact N-O 3.09Å; T167-F215 HydrophobicContact CG2-CD2 3.8Å; T167-F215 HydrophobicContact CG2-CE2 4.02Å; T167-F215 PolarHBondContact O-N 3.09Å; S168-F215 WeakPolarHBondContact O-CE2 3.19Å; V169-F215 HydrophobicContact CB-CE2 4.39Å; V169-F215 HydrophobicContact CG1-CD2 3.71Å; V169-F215 HydrophobicContact CG1-CE2 3.98Å; V169-F215 HydrophobicContact CG1-CG 4.11Å; D200-F215 HydrophobicContact CB-CE1 3.97Å; D200-F215 HydrophobicContact CB-CZ 3.81Å; E203-F215 HydrophobicContact CB-CE1 4.3Å; E203-F215 HydrophobicContact CB-CZ 4.46Å; E203-F215 HydrophobicContact CG-CD1 3.73Å; E203-F215 HydrophobicContact CG-CE1 3.64Å; E203-F215 HydrophobicContact CG-CG 4.38Å; E203-F215 HydrophobicContact CG-CZ 4.22Å; F215-V217 VanDerWaalsContact C-N 3.28Å; F215-I219 HydrophobicContact CD1-CD1 4.38Å; F215-I219 HydrophobicContact CE1-CD1 4.16Å | ||
| 216 | Q | 89.7 | Confident | 88.8 | Confident | 122 Ų | 122 | 59 Ų | 59 | 57% | 0.57 | 30% | 0.301 | S | S | * | . | S | Bend | trans | -83.5 | -10.1 | 176.6 | -61.3 | 179.7 | 15 | 0 | 0 | 112 | E164 Y185 K214 | E164-Q216 WeakPolarHBondContact CG-O 3.38Å; Y185-Q216 WeakPolarHBondContact CD2-O 3.48Å; Y185-Q216 WeakPolarHBondContact CE2-O 3.26Å; K214-Q216 PolarHBondContact O-N 3.28Å |
| 217 | V | 91.9 | Very high | 89.3 | Confident | 21 Ų | 21 | 57.6 Ų | 57.6 | 13% | 0.127 | 29% | 0.29 | C | S | . | . | S | Bend | trans | -127.5 | 154.6 | -178.5 | -63.5 | 0 | 0 | 0 | 0 | 110.6 | V183 Y185 L190 F215 I219 | V183-V217 HydrophobicContact CG1-CB 3.88Å; V183-V217 HydrophobicContact CG1-CG1 4.31Å; V183-V217 HydrophobicContact CG1-CG2 3.79Å; Y185-V217 HydrophobicContact CD2-CG1 4.32Å; L190-V217 HydrophobicContact CD1-CG1 4.06Å; F215-V217 VanDerWaalsContact C-N 3.28Å; V217-I219 HydrophobicContact CG2-CD1 4.4Å; V217-I219 HydrophobicContact CG2-CG1 4.14Å |
| 218 | T | 94.8 | Very high | 89.8 | Confident | 29 Ų | 29 | 57 Ų | 57 | 18% | 0.178 | 29% | 0.286 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -95.8 | 126.7 | 171 | -64.8 | 0 | 0 | 0 | 0 | 109.9 | T160 A162 E164 S184 I220 | T160-T218 HydrophobicContact CG2-CG2 4.43Å; A162-T218 CarbonylContact O-C 3.58Å; A162-T218 WeakPolarHBondContact O-CA 3.21Å; E164-T218 VanDerWaalsContact CB-OG1 3.3Å; E164-T218 WeakPolarHBondContact CB-OG1 3.42Å; E164-T218 PolarHBondContact N-OG1 3.21Å; E164-T218 VanDerWaalsContact N-OG1 3.12Å; S184-T218 PolarHBondContact N-O 3.37Å; S184-T218 PolarHBondContact O-N 3.25Å; S184-T218 PolarHBondContact OG-O 3.25Å; T218-I220 HydrophobicContact CG2-CD1 3.77Å; T218-I220 HydrophobicContact CG2-CG1 3.84Å |
| 219 | I | 96.8 | Very high | 90.7 | Very high | 2 Ų | 2 | 52.6 Ų | 52.6 | 1% | 0.01 | 27% | 0.266 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -116.1 | 119.7 | 179.4 | -52.3 | 178 | 0 | 0 | 0 | 108.8 | Y161 A162 M181 K182 V183 I193 I199 F215 V217 | Y161-I219 HydrophobicContact CD1-CB 4.28Å; Y161-I219 HydrophobicContact CD1-CD1 4.19Å; Y161-I219 HydrophobicContact CD1-CG2 4.35Å; Y161-I219 PolarHBondContact N-O 3.17Å; A162-I219 HydrophobicContact CB-CB 4.49Å; A162-I219 PolarHBondContact N-O 3.04Å; A162-I219 PolarHBondContact O-N 3.26Å; M181-I219 HydrophobicContact CB-CG2 4.1Å; M181-I219 HydrophobicContact SD-CG2 4.12Å; K182-I219 WeakPolarHBondContact O-CA 3.36Å; V183-I219 HydrophobicContact CG1-CG1 4.4Å; V183-I219 HydrophobicContact CG2-CG1 4.32Å; I193-I219 HydrophobicContact CD1-CG2 4.29Å; I199-I219 HydrophobicContact CG2-CD1 3.95Å; I199-I219 HydrophobicContact CG2-CG2 4.23Å; F215-I219 HydrophobicContact CD1-CD1 4.38Å; F215-I219 HydrophobicContact CE1-CD1 4.16Å; V217-I219 HydrophobicContact CG2-CD1 4.4Å; V217-I219 HydrophobicContact CG2-CG1 4.14Å |
| 220 | I | 97.3 | Very high | 91.4 | Very high | 56 Ų | 56 | 49.7 Ų | 49.7 | 29% | 0.287 | 25% | 0.252 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -125.4 | 142.8 | -177 | -64 | 167.4 | 0 | 0 | 0 | 109.7 | T160 M181 K182 T218 D222 | T160-I220 HydrophobicContact CG2-CG1 4.32Å; M181-I220 CarbonylContact C-O 3.53Å; M181-I220 WeakPolarHBondContact CA-O 3.09Å; K182-I220 PolarHBondContact N-O 2.99Å; K182-I220 PolarHBondContact O-N 3.41Å; T218-I220 HydrophobicContact CG2-CD1 3.77Å; T218-I220 HydrophobicContact CG2-CG1 3.84Å; I220-D222 PolarHBondContact O-N 3.23Å |
| 221 | A | 97.8 | Very high | 92.1 | Very high | 2 Ų | 2 | 44 Ų | 44 | 2% | 0.017 | 23% | 0.23 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -66.7 | 115.5 | 171.6 | 0 | 0 | 0 | 0 | 0 | 111.3 | L155 K156 G158 Q159 D223 | L155-A221 HydrophobicContact CB-CB 4.43Å; L155-A221 HydrophobicContact CD2-CB 3.81Å; L155-A221 HydrophobicContact CG-CB 3.94Å; K156-A221 VanDerWaalsContact O-CB 3.31Å; K156-A221 WeakPolarHBondContact O-CB 3.44Å; G158-A221 PolarHBondContact N-O 2.94Å; Q159-A221 PolarHBondContact O-N 3.23Å; A221-D223 WeakPolarHBondContact CB-O 3.45Å |
| 222 | D | 96.2 | Very high | 92.7 | Very high | 51 Ų | 51 | 40 Ų | 40 | 27% | 0.273 | 21% | 0.213 | S | C | . | . | S | Bend | trans | -79 | -28 | 172.8 | -164.3 | 34.1 | 0 | 0 | 0 | 110.9 | K157 K180 I220 | K157-D222 WeakPolarHBondContact CD-O 3.27Å; K157-D222 WeakPolarHBondContact CE-O 3.37Å; K157-D222 VanDerWaalsContact CG-O 3.3Å; K157-D222 WeakPolarHBondContact CG-O 3.4Å; K157-D222 PolarHBondContact NZ-O 3.42Å; K180-D222 HydrophobicContact CB-CB 4.42Å; K180-D222 HydrophobicContact CD-CB 4.48Å; K180-D222 WeakPolarHBondContact CD-OD2 3.24Å; K180-D222 WeakPolarHBondContact CE-OD2 3.34Å; K180-D222 HydrophobicContact CG-CB 4.32Å; K180-D222 IonicContact NZ-OD2 3.15Å; K180-D222 PolarHBondContact NZ-OD2 2.88Å; K180-D222 WeakPolarHBondContact O-CA 3.45Å; K180-D222 WeakPolarHBondContact O-CB 3.43Å; K180-D222 PolarHBondContact O-N 3.32Å; I220-D222 PolarHBondContact O-N 3.23Å |
| 223 | D | 96.3 | Very high | 93.2 | Very high | 68 Ų | 68 | 43.9 Ų | 43.9 | 36% | 0.364 | 22% | 0.218 | S | C | . | . | S | Bend | trans | -133.8 | 175.3 | 173.9 | -74.4 | -37.8 | 0 | 0 | 0 | 111.7 | K157 K180 A221 C225 | K157-D223 IonicContact NZ-OD1 3.32Å; K180-D223 PolarHBondContact O-N 3.47Å; A221-D223 WeakPolarHBondContact CB-O 3.45Å; D223-C225 PolarHBondContact O-N 2.86Å; D223-C225 PolarHBondContact O-SG 3.18Å |
| 224 | N | 96.5 | Very high | 93.3 | Very high | 112 Ų | 112 | 47.5 Ų | 47.5 | 60% | 0.599 | 23% | 0.229 | S | C | * | . | trans | -62 | 106.7 | 169.8 | -70.2 | -31.2 | 0 | 0 | 0 | 109.9 | L155 K156 K157 | L155-N224 CarbonylContact O-C 3.57Å; K156-N224 WeakPolarHBondContact CA-OD1 3.31Å; K157-N224 PolarHBondContact N-OD1 2.96Å; K157-N224 VanDerWaalsContact N-OD1 3.11Å | ||
| 225 | C | 96.4 | Very high | 93.4 | Very high | 2 Ų | 2 | 42.3 Ų | 42.3 | 1% | 0.014 | 21% | 0.206 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -99.5 | 147.9 | -174.2 | -68.6 | 0 | 0 | 0 | 0 | 111.4 | T154 L155 L176 K178 K180 M181 D223 | T154-C225 CarbonylContact C-O 3.57Å; T154-C225 WeakPolarHBondContact CA-O 3.43Å; L155-C225 HydrophobicContact CB-CB 4.26Å; L155-C225 PolarHBondContact N-O 3.02Å; L155-C225 PolarHBondContact O-N 2.96Å; L176-C225 HydrophobicContact CD1-CB 3.97Å; K178-C225 VanDerWaalsContact O-CA 3.25Å; K178-C225 WeakPolarHBondContact O-CA 3.25Å; K180-C225 PolarHBondContact N-SG 2.9Å; K180-C225 VanDerWaalsContact N-SG 3.43Å; K180-C225 PolarHBondContact O-SG 3.2Å; M181-C225 HydrophobicContact CE-CB 3.69Å; D223-C225 PolarHBondContact O-N 2.86Å; D223-C225 PolarHBondContact O-SG 3.18Å |
| 226 | R | 94.7 | Very high | 93.5 | Very high | 79 Ų | 79 | 44.1 Ų | 44.1 | 30% | 0.298 | 22% | 0.218 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -131.1 | 137.1 | 162.9 | -62.3 | -165.8 | -65.2 | -175.5 | 2.5 | 108.8 | E123 Q153 T154 L177 K178 | E123-R226 IonicContact OE1-CZ 3.15Å; E123-R226 IonicContact OE1-NH1 2.7Å; E123-R226 PolarHBondContact OE1-NH1 3.04Å; E123-R226 IonicContact OE1-NH2 3.1Å; E123-R226 PolarHBondContact OE1-NH2 2.95Å; E123-R226 IonicContact OE2-CZ 3.15Å; E123-R226 IonicContact OE2-NE 2.65Å; E123-R226 PolarHBondContact OE2-NE 2.95Å; E123-R226 IonicContact OE2-NH1 2.91Å; E123-R226 PolarHBondContact OE2-NH1 3.17Å; E123-R226 VanDerWaalsContact OE2-NH1 3.15Å; E123-R226 IonicContact OE2-NH2 3.55Å; E123-R226 PolarHBondContact OE2-NH2 3.35Å; Q153-R226 VanDerWaalsContact O-CA 3.31Å; Q153-R226 WeakPolarHBondContact O-CA 3.49Å; T154-R226 HydrophobicContact CG2-CG 3.71Å; L177-R226 WeakPolarHBondContact CA-O 3.46Å; L177-R226 HydrophobicContact CB-CB 4.49Å; L177-R226 VanDerWaalsContact CB-O 3.28Å; L177-R226 WeakPolarHBondContact CB-O 3.29Å; L177-R226 PolarHBondContact N-O 3.23Å; K178-R226 PolarHBondContact N-O 3.48Å; K178-R226 VanDerWaalsContact N-O 3.1Å; K178-R226 PolarHBondContact O-N 3.15Å |
| 227 | F | 94.3 | Very high | 93.6 | Very high | 6 Ų | 6 | 46.4 Ų | 46.4 | 3% | 0.026 | 22% | 0.222 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -139.9 | 148.1 | -176.1 | 61.9 | -88 | 0 | 0 | 0 | 110.7 | I152 Q153 L155 Y161 I175 L176 M181 I199 C229 | I152-F227 WeakPolarHBondContact CA-O 3.41Å; Q153-F227 HydrophobicContact CB-CD1 4.46Å; Q153-F227 HydrophobicContact CB-CD2 4.3Å; Q153-F227 HydrophobicContact CB-CE1 3.86Å; Q153-F227 HydrophobicContact CB-CE2 3.68Å; Q153-F227 HydrophobicContact CB-CZ 3.43Å; Q153-F227 VanDerWaalsContact CB-CZ 3.43Å; Q153-F227 HydrophobicContact CG-CE2 4.31Å; Q153-F227 HydrophobicContact CG-CZ 4.32Å; Q153-F227 PolarHBondContact N-O 3.5Å; Q153-F227 PolarHBondContact O-N 2.83Å; L155-F227 HydrophobicContact CB-CE1 4.16Å; Y161-F227 HydrophobicContact CD2-CE1 4.11Å; Y161-F227 HydrophobicContact CD2-CE2 4.15Å; Y161-F227 AromaticContact CD2-CZ 3.81Å; Y161-F227 HydrophobicContact CD2-CZ 3.81Å; Y161-F227 HydrophobicContact CE2-CD2 4.14Å; Y161-F227 HydrophobicContact CE2-CE1 4.37Å; Y161-F227 AromaticContact CE2-CE2 3.59Å; Y161-F227 HydrophobicContact CE2-CE2 3.59Å; Y161-F227 AromaticContact CE2-CZ 3.72Å; Y161-F227 HydrophobicContact CE2-CZ 3.72Å; I175-F227 CarbonylContact O-C 3.55Å; I175-F227 VanDerWaalsContact O-CA 3.26Å; I175-F227 WeakPolarHBondContact O-CA 3.41Å; I175-F227 WeakPolarHBondContact O-CB 3.3Å; L176-F227 HydrophobicContact CD1-CB 4.29Å; M181-F227 HydrophobicContact CE-CD1 3.9Å; M181-F227 HydrophobicContact CE-CE1 4.43Å; I199-F227 HydrophobicContact CD1-CB 3.63Å; I199-F227 HydrophobicContact CD1-CD1 4.47Å; I199-F227 HydrophobicContact CD1-CD2 4.21Å; I199-F227 HydrophobicContact CD1-CG 3.88Å; F227-C229 HydrophobicContact CD2-CB 4.17Å; F227-C229 HydrophobicContact CE2-CB 4.06Å |
| 228 | L | 93.2 | Very high | 93.6 | Very high | 2 Ų | 2 | 45.9 Ų | 45.9 | 1% | 0.01 | 22% | 0.218 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -82.6 | 135.1 | 171.1 | -167.9 | 68.4 | 0 | 0 | 0 | 107.9 | L124 T146 C150 I152 S174 I175 L177 W230 | L124-L228 HydrophobicContact CD1-CD1 4.06Å; L124-L228 HydrophobicContact CD2-CD1 4.32Å; L124-L228 HydrophobicContact CG-CD1 4.29Å; T146-L228 HydrophobicContact CG2-CD2 4.38Å; C150-L228 HydrophobicContact CB-CD1 4.43Å; C150-L228 WeakPolarHBondContact SG-CD1 3.25Å; C150-L228 WeakPolarHBondContact SG-CG 3.24Å; I152-L228 HydrophobicContact CG1-CD1 4.06Å; S174-L228 CarbonylContact C-O 3.57Å; S174-L228 WeakPolarHBondContact CA-O 3.41Å; S174-L228 WeakPolarHBondContact CB-O 3.26Å; I175-L228 HydrophobicContact CB-CB 4.46Å; I175-L228 PolarHBondContact N-O 3.11Å; I175-L228 PolarHBondContact O-N 3.35Å; L177-L228 HydrophobicContact CD2-CB 3.83Å; L177-L228 HydrophobicContact CG-CB 4.37Å; L228-W230 HydrophobicContact CD2-CH2 3.36Å; L228-W230 HydrophobicContact CD2-CZ2 3.39Å; L228-W230 HydrophobicContact CD2-CZ3 4.04Å; L228-W230 HydrophobicContact CG-CH2 4.25Å; L228-W230 HydrophobicContact CG-CZ2 4.2Å |
| 229 | C | 92.4 | Very high | 93.5 | Very high | 10 Ų | 10 | 44.9 Ų | 44.9 | 7% | 0.068 | 21% | 0.212 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -134.2 | 124.1 | -177.7 | -179.1 | 0 | 0 | 0 | 0 | 109.7 | M151 R172 F227 | M151-C229 PolarHBondContact N-O 3.29Å; M151-C229 WeakPolarHBondContact O-CB 3.33Å; M151-C229 PolarHBondContact O-N 3.26Å; R172-C229 VanDerWaalsContact CB-SG 3.57Å; R172-C229 WeakPolarHBondContact CD-SG 3.26Å; F227-C229 HydrophobicContact CD2-CB 4.17Å; F227-C229 HydrophobicContact CE2-CB 4.06Å |
| 230 | W | 93.1 | Very high | 93.3 | Very high | 1 Ų | 1 | 51.2 Ų | 51.2 | 0% | 0.004 | 24% | 0.241 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -103 | 144.9 | 168.2 | -64.7 | -81.4 | 0 | 0 | 0 | 110.5 | L145 T146 C150 R172 L173 I175 F198 L228 L235 F249 | L145-W230 HydrophobicContact CD1-CZ2 4.27Å; L145-W230 HydrophobicContact CD2-CZ2 3.99Å; L145-W230 HydrophobicContact CG-CZ2 3.96Å; L145-W230 PolarHBondContact O-NE1 3.29Å; L145-W230 VanDerWaalsContact O-NE1 3.11Å; T146-W230 HydrophobicContact CG2-CZ2 4.25Å; C150-W230 VanDerWaalsContact SG-CD1 3.56Å; C150-W230 VanDerWaalsContact SG-CE2 3.58Å; C150-W230 PolarHBondContact SG-NE1 2.83Å; R172-W230 WeakPolarHBondContact CA-O 3.38Å; R172-W230 WeakPolarHBondContact CB-O 3.45Å; L173-W230 PolarHBondContact N-O 3.44Å; L173-W230 VanDerWaalsContact N-O 3.07Å; L173-W230 PolarHBondContact O-N 2.9Å; I175-W230 HydrophobicContact CD1-CH2 3.6Å; I175-W230 HydrophobicContact CD1-CZ3 3.58Å; I175-W230 HydrophobicContact CG1-CH2 4.32Å; I175-W230 HydrophobicContact CG1-CZ3 3.84Å; F198-W230 HydrophobicContact CE1-CZ3 4.48Å; L228-W230 HydrophobicContact CD2-CH2 3.36Å; L228-W230 HydrophobicContact CD2-CZ2 3.39Å; L228-W230 HydrophobicContact CD2-CZ3 4.04Å; L228-W230 HydrophobicContact CG-CH2 4.25Å; L228-W230 HydrophobicContact CG-CZ2 4.2Å; W230-L235 HydrophobicContact CB-CB 4.05Å; W230-L235 HydrophobicContact CB-CD2 4.02Å; W230-L235 HydrophobicContact CB-CG 4.45Å; W230-L235 HydrophobicContact CD2-CD2 4.41Å; W230-L235 HydrophobicContact CE3-CD2 4.38Å; W230-L235 HydrophobicContact CG-CD1 4.3Å; W230-L235 HydrophobicContact CG-CD2 4.29Å; W230-F249 HydrophobicContact CH2-CE1 4.48Å; W230-F249 HydrophobicContact CH2-CZ 4.09Å; W230-F249 HydrophobicContact CZ2-CZ 4.36Å; W230-F249 HydrophobicContact CZ3-CE1 4.31Å; W230-F249 HydrophobicContact CZ3-CZ 4.37Å |
| 231 | S | 90.6 | Very high | 93 | Very high | 42 Ų | 42 | 51.7 Ų | 51.7 | 29% | 0.294 | 25% | 0.25 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -66.4 | 131.5 | 162.5 | 163.5 | 0 | 0 | 0 | 0 | 108.7 | E233 R234 L235 | S231-E233 PolarHBondContact O-N 3.28Å; S231-R234 PolarHBondContact O-N 2.86Å; S231-L235 VanDerWaalsContact O-CB 3.28Å; S231-L235 WeakPolarHBondContact O-CB 3.37Å; S231-L235 PolarHBondContact O-N 3.25Å |
| 232 | R | 90.3 | Very high | 92.8 | Very high | 9 Ų | 9 | 53.6 Ų | 53.6 | 3% | 0.034 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -56.9 | -50.8 | -178.9 | -165.1 | -166 | -90.8 | -98.7 | 10.1 | 111.4 | V169 D170 D171 E203 F204 T207 M209 R234 L235 T236 | V169-R232 PolarHBondContact O-NE 2.91Å; V169-R232 PolarHBondContact O-NH2 3.46Å; D170-R232 VanDerWaalsContact O-CB 3.32Å; D170-R232 WeakPolarHBondContact O-CB 3.45Å; D170-R232 WeakPolarHBondContact O-CD 3.3Å; D170-R232 PolarHBondContact O-NE 3.21Å; D171-R232 PolarHBondContact O-N 3.19Å; D171-R232 VanDerWaalsContact O-N 3.09Å; E203-R232 PolarHBondContact O-NH2 3.46Å; E203-R232 VanDerWaalsContact O-NH2 3.16Å; F204-R232 VanDerWaalsContact CA-NH2 3.33Å; F204-R232 HydrophobicContact CD2-CG 4.03Å; F204-R232 HydrophobicContact CE2-CG 3.6Å; F204-R232 PolarHBondContact O-NH1 3.41Å; T207-R232 PolarHBondContact OG1-NH2 2.86Å; T207-R232 VanDerWaalsContact OG1-NH2 3.07Å; M209-R232 HydrophobicContact CE-CB 3.94Å; M209-R232 HydrophobicContact CE-CG 3.4Å; M209-R232 VanDerWaalsContact CE-CG 3.4Å; M209-R232 WeakPolarHBondContact CE-O 3.31Å; M209-R232 HydrophobicContact CG-CG 4.44Å; R232-R234 PolarHBondContact O-N 3.04Å; R232-L235 PolarHBondContact O-N 3.48Å; R232-T236 PolarHBondContact O-N 3.18Å; R232-T236 PolarHBondContact O-OG1 2.92Å; R232-T236 VanDerWaalsContact O-OG1 3.05Å |
| 233 | E | 89.4 | Confident | 92.7 | Very high | 132 Ų | 132 | 55.8 Ų | 55.8 | 62% | 0.617 | 28% | 0.275 | S | S | * | . | H | α-helix | trans | -54.6 | -52.5 | -178.8 | -173.7 | -175.2 | 177.8 | 0 | 0 | 111.8 | M209 S231 L235 T236 Y237 | M209-E233 VanDerWaalsContact CE-CA 3.43Å; M209-E233 HydrophobicContact CE-CB 4.38Å; S231-E233 PolarHBondContact O-N 3.28Å; E233-L235 PolarHBondContact O-N 3.42Å; E233-T236 PolarHBondContact O-N 2.82Å; E233-Y237 PolarHBondContact O-N 3.36Å; E233-Y237 VanDerWaalsContact O-N 3.09Å |
| 234 | R | 89.2 | Confident | 92.6 | Very high | 137 Ų | 137 | 56.9 Ų | 56.9 | 52% | 0.517 | 28% | 0.277 | S | S | . | . | H | α-helix | trans | -68.7 | -36.7 | -177.4 | -61.4 | -178.7 | 173.1 | -172.5 | -2.8 | 112.3 | F149 S231 R232 F238 | F149-R234 HydrophobicContact CB-CB 3.9Å; F149-R234 HydrophobicContact CD1-CB 4.14Å; F149-R234 HydrophobicContact CD1-CG 4.28Å; F149-R234 HydrophobicContact CD2-CB 4.37Å; F149-R234 HydrophobicContact CG-CB 3.86Å; F149-R234 HydrophobicContact CG-CG 4.49Å; S231-R234 PolarHBondContact O-N 2.86Å; R232-R234 PolarHBondContact O-N 3.04Å; R234-F238 WeakPolarHBondContact O-CB 3.38Å; R234-F238 PolarHBondContact O-N 3.44Å |
| 235 | L | 91.9 | Very high | 92.4 | Very high | 2 Ų | 2 | 51.6 Ų | 51.6 | 1% | 0.01 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -66 | -47.2 | 176.9 | 179.7 | 62.3 | 0 | 0 | 0 | 110.7 | L145 L173 F204 W230 S231 R232 E233 Y237 F238 L239 F249 | L145-L235 HydrophobicContact CD1-CD1 3.52Å; L173-L235 HydrophobicContact CB-CD2 4.02Å; L173-L235 HydrophobicContact CD2-CD2 3.52Å; L173-L235 HydrophobicContact CG-CD2 4.36Å; F204-L235 HydrophobicContact CE2-CD2 4.39Å; F204-L235 HydrophobicContact CZ-CD2 4.42Å; W230-L235 HydrophobicContact CB-CB 4.05Å; W230-L235 HydrophobicContact CB-CD2 4.02Å; W230-L235 HydrophobicContact CB-CG 4.45Å; W230-L235 HydrophobicContact CD2-CD2 4.41Å; W230-L235 HydrophobicContact CE3-CD2 4.38Å; W230-L235 HydrophobicContact CG-CD1 4.3Å; W230-L235 HydrophobicContact CG-CD2 4.29Å; S231-L235 VanDerWaalsContact O-CB 3.28Å; S231-L235 WeakPolarHBondContact O-CB 3.37Å; S231-L235 PolarHBondContact O-N 3.25Å; R232-L235 PolarHBondContact O-N 3.48Å; E233-L235 PolarHBondContact O-N 3.42Å; L235-Y237 PolarHBondContact O-N 3.04Å; L235-F238 PolarHBondContact O-N 2.84Å; L235-L239 HydrophobicContact CD1-CD1 4.07Å; L235-L239 HydrophobicContact CD1-CD2 4.4Å; L235-L239 HydrophobicContact CD1-CG 4.02Å; L235-L239 HydrophobicContact CD2-CD1 4.5Å; L235-L239 HydrophobicContact CG-CD1 3.9Å; L235-L239 HydrophobicContact CG-CG 4.26Å; L235-L239 VanDerWaalsContact O-CG 3.27Å; L235-L239 WeakPolarHBondContact O-CG 3.1Å; L235-L239 PolarHBondContact O-N 3.3Å; L235-F249 HydrophobicContact CD1-CE1 4.21Å; L235-F249 HydrophobicContact CD1-CZ 4.2Å; L235-F249 HydrophobicContact CD2-CD1 4.46Å; L235-F249 HydrophobicContact CD2-CE1 3.97Å |
| 236 | T | 90.9 | Very high | 92.3 | Very high | 41 Ų | 41 | 56.9 Ų | 56.9 | 25% | 0.252 | 27% | 0.269 | S | S | . | . | H | α-helix | trans | -58.7 | -49.1 | 178.7 | -59.1 | 0 | 0 | 0 | 0 | 111 | M209 R232 E233 F238 L239 E240 | M209-T236 HydrophobicContact CE-CG2 4.5Å; M209-T236 VanDerWaalsContact CE-OG1 3.31Å; M209-T236 WeakPolarHBondContact CE-OG1 3.4Å; R232-T236 PolarHBondContact O-N 3.18Å; R232-T236 PolarHBondContact O-OG1 2.92Å; R232-T236 VanDerWaalsContact O-OG1 3.05Å; E233-T236 PolarHBondContact O-N 2.82Å; T236-F238 VanDerWaalsContact C-N 3.3Å; T236-F238 PolarHBondContact O-N 3.41Å; T236-L239 PolarHBondContact O-N 2.83Å; T236-L239 VanDerWaalsContact O-N 3.15Å; T236-E240 WeakPolarHBondContact O-CG 3.45Å; T236-E240 PolarHBondContact O-N 3.01Å |
| 237 | Y | 91.6 | Very high | 92.4 | Very high | 170 Ų | 170 | 57.2 Ų | 57.2 | 67% | 0.667 | 27% | 0.274 | S | S | * | . | H | α-helix | trans | -57.8 | -41.7 | 176.5 | -178 | -97.7 | 0 | 0 | 0 | 112.6 | E233 L235 E240 S241 | E233-Y237 PolarHBondContact O-N 3.36Å; E233-Y237 VanDerWaalsContact O-N 3.09Å; L235-Y237 PolarHBondContact O-N 3.04Å; Y237-E240 PolarHBondContact O-N 3.34Å; Y237-S241 PolarHBondContact O-N 3.29Å |
| 238 | F | 91.3 | Very high | 92.5 | Very high | 10 Ų | 10 | 57.9 Ų | 57.9 | 4% | 0.044 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -65.8 | -42.1 | 177.3 | -175.9 | -102 | 0 | 0 | 0 | 112.2 | R144 L145 R234 L235 T236 S241 E242 L245 | R144-F238 HydrophobicContact CB-CE2 4.22Å; R144-F238 HydrophobicContact CB-CZ 3.78Å; L145-F238 HydrophobicContact CB-CE1 3.88Å; L145-F238 HydrophobicContact CD1-CD1 4.09Å; L145-F238 HydrophobicContact CD1-CE1 4.19Å; R234-F238 WeakPolarHBondContact O-CB 3.38Å; R234-F238 PolarHBondContact O-N 3.44Å; L235-F238 PolarHBondContact O-N 2.84Å; T236-F238 VanDerWaalsContact C-N 3.3Å; T236-F238 PolarHBondContact O-N 3.41Å; F238-S241 PolarHBondContact O-N 2.9Å; F238-S241 PolarHBondContact O-OG 2.94Å; F238-E242 HydrophobicContact CE1-CG 4.42Å; F238-E242 HydrophobicContact CE2-CG 4.46Å; F238-E242 HydrophobicContact CZ-CG 4.17Å; F238-E242 PolarHBondContact O-N 2.94Å; F238-L245 HydrophobicContact CD1-CD2 4.06Å; F238-L245 HydrophobicContact CE1-CD2 3.51Å |
| 239 | L | 92.8 | Very high | 92.6 | Very high | 8 Ų | 8 | 57.9 Ų | 57.9 | 4% | 0.042 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -67.4 | -35.9 | 178.6 | -65 | 174.6 | 0 | 0 | 0 | 111.9 | L235 T236 S241 E242 L245 Y246 F249 | L235-L239 HydrophobicContact CD1-CD1 4.07Å; L235-L239 HydrophobicContact CD1-CD2 4.4Å; L235-L239 HydrophobicContact CD1-CG 4.02Å; L235-L239 HydrophobicContact CD2-CD1 4.5Å; L235-L239 HydrophobicContact CG-CD1 3.9Å; L235-L239 HydrophobicContact CG-CG 4.26Å; L235-L239 VanDerWaalsContact O-CG 3.27Å; L235-L239 WeakPolarHBondContact O-CG 3.1Å; L235-L239 PolarHBondContact O-N 3.3Å; T236-L239 PolarHBondContact O-N 2.83Å; T236-L239 VanDerWaalsContact O-N 3.15Å; L239-S241 PolarHBondContact O-N 3.06Å; L239-E242 CarbonylContact O-C 3.32Å; L239-E242 PolarHBondContact O-N 3.48Å; L239-E242 VanDerWaalsContact O-N 3.11Å; L239-L245 HydrophobicContact CD2-CB 4.06Å; L239-L245 HydrophobicContact CD2-CD2 3.85Å; L239-L245 HydrophobicContact CD2-CG 3.67Å; L239-Y246 HydrophobicContact CB-CD2 3.9Å; L239-F249 HydrophobicContact CD1-CB 4.06Å; L239-F249 HydrophobicContact CD1-CD1 4.12Å; L239-F249 HydrophobicContact CD1-CD2 4.48Å; L239-F249 HydrophobicContact CD1-CG 3.96Å; L239-F249 HydrophobicContact CD2-CB 4.35Å; L239-F249 HydrophobicContact CD2-CD2 3.68Å; L239-F249 HydrophobicContact CD2-CE2 4.1Å; L239-F249 HydrophobicContact CD2-CG 3.99Å |
| 240 | E | 92.3 | Very high | 92.7 | Very high | 135 Ų | 135 | 64 Ų | 64 | 63% | 0.631 | 30% | 0.299 | S | S | * | . | H | α-helix | trans | -60.6 | -34.3 | 173.1 | -74.3 | 174.5 | 179.7 | 0 | 0 | 112.3 | T236 Y237 E242 | T236-E240 WeakPolarHBondContact O-CG 3.45Å; T236-E240 PolarHBondContact O-N 3.01Å; Y237-E240 PolarHBondContact O-N 3.34Å; E240-E242 VanDerWaalsContact C-N 3.34Å |
| 241 | S | 92.5 | Very high | 92.8 | Very high | 67 Ų | 67 | 69.7 Ų | 69.7 | 47% | 0.469 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -77.3 | -16.9 | 176.1 | 74.4 | 0 | 0 | 0 | 0 | 114.4 | Y237 F238 L239 | Y237-S241 PolarHBondContact O-N 3.29Å; F238-S241 PolarHBondContact O-N 2.9Å; F238-S241 PolarHBondContact O-OG 2.94Å; L239-S241 PolarHBondContact O-N 3.06Å |
| 242 | E | 93 | Very high | 93.1 | Very high | 42 Ų | 42 | 67.8 Ų | 67.8 | 20% | 0.196 | 31% | 0.308 | C | S | . | . | trans | -130.2 | 82.6 | -172.6 | -69.2 | -70.4 | 165.8 | 0 | 0 | 110.6 | L141 R144 F238 L239 E240 F244 L245 Y246 | L141-E242 HydrophobicContact CD1-CG 4.23Å; R144-E242 IonicContact CZ-OE1 2.78Å; R144-E242 IonicContact NH1-OE1 3.4Å; R144-E242 PolarHBondContact NH1-OE1 3.21Å; R144-E242 IonicContact NH1-OE2 2.73Å; R144-E242 IonicContact NH2-OE1 3.4Å; R144-E242 PolarHBondContact NH2-OE1 3.32Å; F238-E242 HydrophobicContact CE1-CG 4.42Å; F238-E242 HydrophobicContact CE2-CG 4.46Å; F238-E242 HydrophobicContact CZ-CG 4.17Å; F238-E242 PolarHBondContact O-N 2.94Å; L239-E242 CarbonylContact O-C 3.32Å; L239-E242 PolarHBondContact O-N 3.48Å; L239-E242 VanDerWaalsContact O-N 3.11Å; E240-E242 VanDerWaalsContact C-N 3.34Å; E242-F244 VanDerWaalsContact C-N 3.29Å; E242-F244 PolarHBondContact O-N 3.18Å; E242-L245 HydrophobicContact CB-CB 4.15Å; E242-L245 PolarHBondContact O-N 2.93Å; E242-Y246 PolarHBondContact O-N 2.85Å | ||
| 243 | P | 93.3 | Very high | 93.3 | Very high | 96 Ų | 96 | 67.9 Ų | 67.9 | 62% | 0.623 | 31% | 0.309 | S | S | * | . | H | α-helix | trans | -62.5 | -32.5 | -169.1 | 23.1 | -34.1 | 0 | 0 | 0 | 113.6 | L245 Y246 E247 | P243-L245 VanDerWaalsContact C-N 3.34Å; P243-L245 PolarHBondContact O-N 3.47Å; P243-Y246 WeakPolarHBondContact O-CB 3.47Å; P243-Y246 PolarHBondContact O-N 3.12Å; P243-E247 PolarHBondContact O-N 3.38Å |
| 244 | F | 94.1 | Very high | 93.6 | Very high | 92 Ų | 92 | 62.2 Ų | 62.2 | 40% | 0.404 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -60.2 | -45.4 | 173.8 | 170.9 | -110.1 | 0 | 0 | 0 | 111.3 | V137 L141 E242 E247 I248 | V137-F244 HydrophobicContact CB-CE1 4.35Å; V137-F244 HydrophobicContact CG2-CE1 3.89Å; V137-F244 HydrophobicContact CG2-CZ 4.08Å; L141-F244 HydrophobicContact CD2-CD1 3.71Å; L141-F244 HydrophobicContact CD2-CE1 4.16Å; E242-F244 VanDerWaalsContact C-N 3.29Å; E242-F244 PolarHBondContact O-N 3.18Å; F244-E247 PolarHBondContact O-N 2.96Å; F244-I248 HydrophobicContact CE1-CG1 4.33Å; F244-I248 HydrophobicContact CE2-CD1 4.26Å; F244-I248 HydrophobicContact CE2-CG1 4.13Å; F244-I248 HydrophobicContact CZ-CD1 4.36Å; F244-I248 HydrophobicContact CZ-CG1 4.01Å; F244-I248 WeakPolarHBondContact O-CG1 3.3Å; F244-I248 PolarHBondContact O-N 2.85Å |
| 245 | L | 93.6 | Very high | 93.8 | Very high | 0 Ų | 0 | 59.3 Ų | 59.3 | 0% | 0 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -72.9 | -33 | -178.4 | -166 | 64.2 | 0 | 0 | 0 | 111.7 | V137 L141 L145 F238 L239 E242 P243 I248 F249 | V137-L245 HydrophobicContact CG1-CD1 4.39Å; L141-L245 HydrophobicContact CD2-CB 4.39Å; L145-L245 HydrophobicContact CB-CD2 4.04Å; L145-L245 HydrophobicContact CD1-CD2 3.98Å; L145-L245 HydrophobicContact CD2-CD1 4.49Å; L145-L245 HydrophobicContact CD2-CD2 4.16Å; L145-L245 HydrophobicContact CG-CD2 4.26Å; F238-L245 HydrophobicContact CD1-CD2 4.06Å; F238-L245 HydrophobicContact CE1-CD2 3.51Å; L239-L245 HydrophobicContact CD2-CB 4.06Å; L239-L245 HydrophobicContact CD2-CD2 3.85Å; L239-L245 HydrophobicContact CD2-CG 3.67Å; E242-L245 HydrophobicContact CB-CB 4.15Å; E242-L245 PolarHBondContact O-N 2.93Å; P243-L245 VanDerWaalsContact C-N 3.34Å; P243-L245 PolarHBondContact O-N 3.47Å; L245-I248 PolarHBondContact O-N 3.15Å; L245-F249 HydrophobicContact CD1-CD2 4.1Å; L245-F249 HydrophobicContact CD1-CE2 4.03Å; L245-F249 HydrophobicContact CD2-CE2 4.34Å; L245-F249 HydrophobicContact CG-CD2 3.9Å; L245-F249 HydrophobicContact CG-CE2 3.98Å; L245-F249 WeakPolarHBondContact O-CD2 3.42Å; L245-F249 PolarHBondContact O-N 3.39Å |
| 246 | Y | 94.6 | Very high | 94 | Very high | 113 Ų | 113 | 59.9 Ų | 59.9 | 44% | 0.443 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -53.8 | -51.9 | 172.2 | -176.3 | -92 | 0 | 0 | 0 | 111.5 | L239 E242 P243 I248 F249 R250 | L239-Y246 HydrophobicContact CB-CD2 3.9Å; E242-Y246 PolarHBondContact O-N 2.85Å; P243-Y246 WeakPolarHBondContact O-CB 3.47Å; P243-Y246 PolarHBondContact O-N 3.12Å; Y246-I248 PolarHBondContact O-N 2.89Å; Y246-F249 PolarHBondContact O-N 3.02Å; Y246-R250 PolarHBondContact O-N 2.92Å |
| 247 | E | 96 | Very high | 94.2 | Very high | 87 Ų | 87 | 59.1 Ų | 59.1 | 41% | 0.407 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -64.4 | -39.3 | 177.9 | -73.9 | -53 | 122.1 | 0 | 0 | 112.6 | P243 F244 F249 R250 Y251 | P243-E247 PolarHBondContact O-N 3.38Å; F244-E247 PolarHBondContact O-N 2.96Å; E247-F249 VanDerWaalsContact C-N 3.34Å; E247-F249 PolarHBondContact O-N 3.39Å; E247-R250 PolarHBondContact O-N 2.91Å; E247-R250 IonicContact OE1-NE 3.92Å; E247-R250 IonicContact OE2-CZ 2.9Å; E247-R250 IonicContact OE2-NE 2.61Å; E247-R250 PolarHBondContact OE2-NE 3.37Å; E247-R250 IonicContact OE2-NH2 2.8Å; E247-R250 PolarHBondContact OE2-NH2 3.06Å; E247-Y251 WeakPolarHBondContact O-CB 3.24Å; E247-Y251 PolarHBondContact O-N 3.37Å |
| 248 | I | 95.8 | Very high | 94.3 | Very high | 20 Ų | 20 | 54 Ų | 54 | 10% | 0.103 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -60.1 | -44 | 174.7 | -67.6 | -47.9 | 0 | 0 | 0 | 111.4 | F132 L135 V137 F244 L245 Y246 Y251 L252 | F132-I248 HydrophobicContact CD1-CG2 4.43Å; L135-I248 HydrophobicContact CB-CD1 3.86Å; L135-I248 HydrophobicContact CD1-CD1 4.19Å; L135-I248 HydrophobicContact CD1-CG2 3.75Å; L135-I248 HydrophobicContact CG-CD1 4.46Å; V137-I248 HydrophobicContact CG2-CG1 4.09Å; V137-I248 HydrophobicContact CG2-CG2 4.13Å; F244-I248 HydrophobicContact CE1-CG1 4.33Å; F244-I248 HydrophobicContact CE2-CD1 4.26Å; F244-I248 HydrophobicContact CE2-CG1 4.13Å; F244-I248 HydrophobicContact CZ-CD1 4.36Å; F244-I248 HydrophobicContact CZ-CG1 4.01Å; F244-I248 WeakPolarHBondContact O-CG1 3.3Å; F244-I248 PolarHBondContact O-N 2.85Å; L245-I248 PolarHBondContact O-N 3.15Å; Y246-I248 PolarHBondContact O-N 2.89Å; I248-Y251 PolarHBondContact O-N 3.49Å; I248-L252 HydrophobicContact CG2-CD1 3.78Å; I248-L252 HydrophobicContact CG2-CG 4.23Å; I248-L252 WeakPolarHBondContact O-CB 3.33Å; I248-L252 VanDerWaalsContact O-CG 3.26Å; I248-L252 WeakPolarHBondContact O-CG 3.3Å; I248-L252 PolarHBondContact O-N 3.43Å |
| 249 | F | 95.3 | Very high | 94.3 | Very high | 2 Ų | 2 | 57.6 Ų | 57.6 | 1% | 0.009 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -65.1 | -42.7 | 176.7 | -96.3 | -104.5 | 0 | 0 | 0 | 111.8 | F132 L145 L173 F198 W230 L235 L239 L245 Y246 E247 Y251 L252 I253 | F132-F249 AromaticContact CE1-CE2 3.97Å; F132-F249 HydrophobicContact CE1-CE2 3.97Å; F132-F249 HydrophobicContact CZ-CE2 4.3Å; F132-F249 HydrophobicContact CZ-CZ 4.41Å; L145-F249 HydrophobicContact CD1-CE2 3.98Å; L145-F249 HydrophobicContact CD1-CZ 3.84Å; L145-F249 HydrophobicContact CD2-CE2 3.61Å; L145-F249 HydrophobicContact CD2-CZ 3.75Å; L145-F249 HydrophobicContact CG-CE2 4.42Å; L145-F249 HydrophobicContact CG-CZ 4.38Å; L173-F249 HydrophobicContact CD2-CD1 4.12Å; L173-F249 HydrophobicContact CD2-CE1 3.95Å; F198-F249 HydrophobicContact CE1-CE1 4.49Å; W230-F249 HydrophobicContact CH2-CE1 4.48Å; W230-F249 HydrophobicContact CH2-CZ 4.09Å; W230-F249 HydrophobicContact CZ2-CZ 4.36Å; W230-F249 HydrophobicContact CZ3-CE1 4.31Å; W230-F249 HydrophobicContact CZ3-CZ 4.37Å; L235-F249 HydrophobicContact CD1-CE1 4.21Å; L235-F249 HydrophobicContact CD1-CZ 4.2Å; L235-F249 HydrophobicContact CD2-CD1 4.46Å; L235-F249 HydrophobicContact CD2-CE1 3.97Å; L239-F249 HydrophobicContact CD1-CB 4.06Å; L239-F249 HydrophobicContact CD1-CD1 4.12Å; L239-F249 HydrophobicContact CD1-CD2 4.48Å; L239-F249 HydrophobicContact CD1-CG 3.96Å; L239-F249 HydrophobicContact CD2-CB 4.35Å; L239-F249 HydrophobicContact CD2-CD2 3.68Å; L239-F249 HydrophobicContact CD2-CE2 4.1Å; L239-F249 HydrophobicContact CD2-CG 3.99Å; L245-F249 HydrophobicContact CD1-CD2 4.1Å; L245-F249 HydrophobicContact CD1-CE2 4.03Å; L245-F249 HydrophobicContact CD2-CE2 4.34Å; L245-F249 HydrophobicContact CG-CD2 3.9Å; L245-F249 HydrophobicContact CG-CE2 3.98Å; L245-F249 WeakPolarHBondContact O-CD2 3.42Å; L245-F249 PolarHBondContact O-N 3.39Å; Y246-F249 PolarHBondContact O-N 3.02Å; E247-F249 VanDerWaalsContact C-N 3.34Å; E247-F249 PolarHBondContact O-N 3.39Å; F249-Y251 VanDerWaalsContact C-N 3.31Å; F249-Y251 PolarHBondContact O-N 3.29Å; F249-L252 PolarHBondContact O-N 3.49Å; F249-I253 HydrophobicContact CD1-CD1 4.33Å; F249-I253 WeakPolarHBondContact O-CB 3.35Å; F249-I253 VanDerWaalsContact O-CG1 3.27Å; F249-I253 WeakPolarHBondContact O-CG1 3.32Å; F249-I253 PolarHBondContact O-N 3.35Å |
| 250 | R | 94.5 | Very high | 94.3 | Very high | 138 Ų | 138 | 58 Ų | 58 | 52% | 0.521 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -57.7 | -45.6 | 176.4 | -163.2 | 175.5 | 72.8 | 92.3 | 1.9 | 111.3 | Y246 E247 G254 | Y246-R250 PolarHBondContact O-N 2.92Å; E247-R250 PolarHBondContact O-N 2.91Å; E247-R250 IonicContact OE1-NE 3.92Å; E247-R250 IonicContact OE2-CZ 2.9Å; E247-R250 IonicContact OE2-NE 2.61Å; E247-R250 PolarHBondContact OE2-NE 3.37Å; E247-R250 IonicContact OE2-NH2 2.8Å; E247-R250 PolarHBondContact OE2-NH2 3.06Å; R250-G254 PolarHBondContact O-N 3.5Å |
| 251 | Y | 95.9 | Very high | 94.1 | Very high | 121 Ų | 121 | 56.6 Ų | 56.6 | 48% | 0.475 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -62.5 | -50.1 | 173.7 | 168.6 | -99.4 | 0 | 0 | 0 | 112.5 | L135 E247 I248 F249 I253 G254 K255 | L135-Y251 HydrophobicContact CD1-CD1 3.8Å; L135-Y251 HydrophobicContact CD1-CE1 3.94Å; L135-Y251 HydrophobicContact CD2-CD1 4.13Å; L135-Y251 HydrophobicContact CD2-CE1 3.79Å; L135-Y251 HydrophobicContact CG-CE1 4.5Å; E247-Y251 WeakPolarHBondContact O-CB 3.24Å; E247-Y251 PolarHBondContact O-N 3.37Å; I248-Y251 PolarHBondContact O-N 3.49Å; F249-Y251 VanDerWaalsContact C-N 3.31Å; F249-Y251 PolarHBondContact O-N 3.29Å; Y251-I253 PolarHBondContact O-N 2.94Å; Y251-G254 PolarHBondContact O-N 2.96Å; Y251-K255 HydrophobicContact CE1-CD 4.34Å; Y251-K255 WeakPolarHBondContact O-CB 3.2Å; Y251-K255 PolarHBondContact O-N 3.39Å |
| 252 | L | 95.9 | Very high | 93.8 | Very high | 2 Ų | 2 | 61.3 Ų | 61.3 | 1% | 0.01 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -62.8 | -43.4 | -176.8 | -76.7 | 176 | 0 | 0 | 0 | 112.3 | L131 F132 L135 F198 I248 F249 K255 D256 | L131-L252 HydrophobicContact CB-CD2 4.4Å; L131-L252 HydrophobicContact CD2-CD2 4.44Å; F132-L252 HydrophobicContact CD1-CD1 4.4Å; F132-L252 HydrophobicContact CE1-CD1 3.91Å; F132-L252 HydrophobicContact CZ-CD1 4.05Å; L135-L252 HydrophobicContact CD1-CD1 4.28Å; L135-L252 HydrophobicContact CD1-CD2 3.74Å; L135-L252 HydrophobicContact CD1-CG 3.89Å; F198-L252 HydrophobicContact CE2-CB 4.02Å; F198-L252 HydrophobicContact CZ-CB 4.41Å; I248-L252 HydrophobicContact CG2-CD1 3.78Å; I248-L252 HydrophobicContact CG2-CG 4.23Å; I248-L252 WeakPolarHBondContact O-CB 3.33Å; I248-L252 VanDerWaalsContact O-CG 3.26Å; I248-L252 WeakPolarHBondContact O-CG 3.3Å; I248-L252 PolarHBondContact O-N 3.43Å; F249-L252 PolarHBondContact O-N 3.49Å; L252-K255 PolarHBondContact O-N 2.81Å; L252-D256 WeakPolarHBondContact O-CB 3.49Å; L252-D256 PolarHBondContact O-N 2.95Å |
| 253 | I | 95.2 | Very high | 93.3 | Very high | 10 Ų | 10 | 61.8 Ų | 61.8 | 5% | 0.051 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -64.7 | -46.2 | 176 | -69.5 | 166.4 | 0 | 0 | 0 | 110 | L173 F198 F204 R205 F249 Y251 K255 D256 I257 | L173-I253 HydrophobicContact CD2-CD1 4.19Å; F198-I253 HydrophobicContact CE1-CG1 4.48Å; F198-I253 HydrophobicContact CZ-CG1 4.4Å; F204-I253 HydrophobicContact CD1-CD1 3.69Å; F204-I253 HydrophobicContact CE1-CD1 3.81Å; R205-I253 HydrophobicContact CB-CG2 4.19Å; F249-I253 HydrophobicContact CD1-CD1 4.33Å; F249-I253 WeakPolarHBondContact O-CB 3.35Å; F249-I253 VanDerWaalsContact O-CG1 3.27Å; F249-I253 WeakPolarHBondContact O-CG1 3.32Å; F249-I253 PolarHBondContact O-N 3.35Å; Y251-I253 PolarHBondContact O-N 2.94Å; I253-K255 PolarHBondContact O-N 2.82Å; I253-D256 PolarHBondContact O-N 3.48Å; I253-I257 HydrophobicContact CG2-CD1 3.73Å; I253-I257 HydrophobicContact CG2-CG1 4.41Å; I253-I257 VanDerWaalsContact O-CG1 3.29Å; I253-I257 WeakPolarHBondContact O-CG1 3.28Å; I253-I257 PolarHBondContact O-N 3.34Å |
| 254 | G | 95.3 | Very high | 92.6 | Very high | 14 Ų | 14 | 60.7 Ų | 60.7 | 14% | 0.144 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -59 | -44.7 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.8 | R250 Y251 T258 | R250-G254 PolarHBondContact O-N 3.5Å; Y251-G254 PolarHBondContact O-N 2.96Å; G254-T258 WeakPolarHBondContact O-CB 3.28Å; G254-T258 PolarHBondContact O-N 2.96Å; G254-T258 PolarHBondContact O-OG1 3.13Å |
| 255 | K | 94.9 | Very high | 91.5 | Very high | 75 Ų | 75 | 62 Ų | 62 | 33% | 0.326 | 30% | 0.295 | S | S | . | . | H | α-helix | trans | -61 | -45.3 | 175.4 | -174.4 | -178.5 | 73.4 | 177.3 | 0 | 111.8 | Y251 L252 I253 T258 N259 | Y251-K255 HydrophobicContact CE1-CD 4.34Å; Y251-K255 WeakPolarHBondContact O-CB 3.2Å; Y251-K255 PolarHBondContact O-N 3.39Å; L252-K255 PolarHBondContact O-N 2.81Å; I253-K255 PolarHBondContact O-N 2.82Å; K255-T258 PolarHBondContact O-N 3.45Å; K255-N259 VanDerWaalsContact O-CG 3.27Å; K255-N259 PolarHBondContact O-N 2.87Å; K255-N259 PolarHBondContact O-ND2 3.45Å |
| 256 | D | 95.6 | Very high | 90.4 | Very high | 15 Ų | 15 | 65.4 Ų | 65.4 | 8% | 0.08 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -65.3 | -45.3 | -179 | -172.5 | 92.2 | 0 | 0 | 0 | 112.1 | A197 F198 S201 L252 I253 T258 N259 K260 | A197-D256 WeakPolarHBondContact CA-OD1 3.46Å; F198-D256 HydrophobicContact CB-CB 4.45Å; F198-D256 HydrophobicContact CD2-CB 3.97Å; F198-D256 PolarHBondContact N-OD1 2.81Å; S201-D256 PolarHBondContact OG-OD2 2.96Å; L252-D256 WeakPolarHBondContact O-CB 3.49Å; L252-D256 PolarHBondContact O-N 2.95Å; I253-D256 PolarHBondContact O-N 3.48Å; D256-T258 VanDerWaalsContact C-N 3.3Å; D256-T258 PolarHBondContact O-N 3.1Å; D256-N259 PolarHBondContact O-N 3.21Å; D256-K260 WeakPolarHBondContact O-CG 3.46Å; D256-K260 PolarHBondContact O-N 3.37Å; D256-K260 WeakPolarHBondContact OD2-CE 3.41Å; D256-K260 IonicContact OD2-NZ 2.9Å; D256-K260 PolarHBondContact OD2-NZ 3.48Å; D256-K260 VanDerWaalsContact OD2-NZ 3.1Å |
| 257 | I | 94 | Very high | 88.4 | Confident | 25 Ų | 25 | 64.6 Ų | 64.6 | 13% | 0.128 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -57.5 | -46.3 | 174.1 | -68 | 167.5 | 0 | 0 | 0 | 110.4 | P202 R205 I253 N259 K260 L261 | P202-I257 HydrophobicContact CG-CG1 4.35Å; R205-I257 HydrophobicContact CB-CD1 3.85Å; R205-I257 VanDerWaalsContact CD-CD1 3.43Å; R205-I257 HydrophobicContact CG-CD1 4.27Å; I253-I257 HydrophobicContact CG2-CD1 3.73Å; I253-I257 HydrophobicContact CG2-CG1 4.41Å; I253-I257 VanDerWaalsContact O-CG1 3.29Å; I253-I257 WeakPolarHBondContact O-CG1 3.28Å; I253-I257 PolarHBondContact O-N 3.34Å; I257-N259 PolarHBondContact O-N 2.96Å; I257-K260 WeakPolarHBondContact O-CB 3.24Å; I257-K260 PolarHBondContact O-N 2.94Å; I257-L261 HydrophobicContact CG2-CD1 4.19Å; I257-L261 HydrophobicContact CG2-CG 4.46Å; I257-L261 WeakPolarHBondContact O-CG 3.44Å; I257-L261 PolarHBondContact O-N 2.98Å |
| 258 | T | 93.9 | Very high | 86.5 | Confident | 63 Ų | 63 | 65.5 Ų | 65.5 | 39% | 0.387 | 33% | 0.333 | S | S | . | . | H | α-helix | trans | -59.4 | -45.7 | 179 | -57.8 | 0 | 0 | 0 | 0 | 111.4 | G254 K255 D256 K260 L261 Y262 | G254-T258 WeakPolarHBondContact O-CB 3.28Å; G254-T258 PolarHBondContact O-N 2.96Å; G254-T258 PolarHBondContact O-OG1 3.13Å; K255-T258 PolarHBondContact O-N 3.45Å; D256-T258 VanDerWaalsContact C-N 3.3Å; D256-T258 PolarHBondContact O-N 3.1Å; T258-K260 VanDerWaalsContact C-N 3.33Å; T258-K260 PolarHBondContact O-N 3.39Å; T258-L261 PolarHBondContact O-N 3.37Å; T258-Y262 HydrophobicContact CG2-CD2 3.79Å; T258-Y262 HydrophobicContact CG2-CE2 3.47Å; T258-Y262 VanDerWaalsContact CG2-CE2 3.47Å; T258-Y262 WeakPolarHBondContact O-CD2 3.43Å; T258-Y262 PolarHBondContact O-N 2.83Å |
| 259 | N | 91 | Very high | 84.4 | Confident | 85 Ų | 85 | 69.7 Ų | 69.7 | 46% | 0.455 | 36% | 0.356 | S | S | . | . | H | α-helix | trans | -62.5 | -38.9 | 176.8 | -70.7 | -18.7 | 0 | 0 | 0 | 112.7 | K255 D256 I257 Y262 S263 | K255-N259 VanDerWaalsContact O-CG 3.27Å; K255-N259 PolarHBondContact O-N 2.87Å; K255-N259 PolarHBondContact O-ND2 3.45Å; D256-N259 PolarHBondContact O-N 3.21Å; I257-N259 PolarHBondContact O-N 2.96Å; N259-Y262 PolarHBondContact O-N 3.13Å; N259-S263 PolarHBondContact O-N 2.93Å; N259-S263 PolarHBondContact O-OG 2.85Å |
| 260 | K | 92.8 | Very high | 82.2 | Confident | 17 Ų | 17 | 74 Ų | 74 | 7% | 0.074 | 38% | 0.379 | C | S | . | . | H | α-helix | trans | -64 | -42.4 | 174.6 | -71.8 | 174.5 | 176.2 | 173.3 | 0 | 111.3 | F198 I199 S201 P202 D256 I257 T258 S263 L264 | F198-K260 VanDerWaalsContact O-CE 3.27Å; F198-K260 WeakPolarHBondContact O-CE 3.19Å; F198-K260 PolarHBondContact O-NZ 3.36Å; I199-K260 PolarHBondContact O-NZ 2.99Å; S201-K260 PolarHBondContact OG-NZ 3.32Å; P202-K260 HydrophobicContact CG-CD 4.21Å; D256-K260 WeakPolarHBondContact O-CG 3.46Å; D256-K260 PolarHBondContact O-N 3.37Å; D256-K260 WeakPolarHBondContact OD2-CE 3.41Å; D256-K260 IonicContact OD2-NZ 2.9Å; D256-K260 PolarHBondContact OD2-NZ 3.48Å; D256-K260 VanDerWaalsContact OD2-NZ 3.1Å; I257-K260 WeakPolarHBondContact O-CB 3.24Å; I257-K260 PolarHBondContact O-N 2.94Å; T258-K260 VanDerWaalsContact C-N 3.33Å; T258-K260 PolarHBondContact O-N 3.39Å; K260-S263 WeakPolarHBondContact O-CB 3.08Å; K260-S263 PolarHBondContact O-N 3.34Å; K260-L264 WeakPolarHBondContact O-CG 3.4Å; K260-L264 PolarHBondContact O-N 3.3Å; K260-L264 VanDerWaalsContact O-N 3.17Å |
| 261 | L | 88.7 | Confident | 80 | Confident | 104 Ų | 104 | 74.1 Ų | 74.1 | 55% | 0.545 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -62 | -44.2 | 176.4 | -70.1 | 174.3 | 0 | 0 | 0 | 112.2 | I257 T258 S263 L264 N265 | I257-L261 HydrophobicContact CG2-CD1 4.19Å; I257-L261 HydrophobicContact CG2-CG 4.46Å; I257-L261 WeakPolarHBondContact O-CG 3.44Å; I257-L261 PolarHBondContact O-N 2.98Å; T258-L261 PolarHBondContact O-N 3.37Å; L261-S263 VanDerWaalsContact C-N 3.27Å; L261-S263 PolarHBondContact O-N 3.41Å; L261-L264 HydrophobicContact CD2-CD1 4.46Å; L261-L264 WeakPolarHBondContact O-CB 3.47Å; L261-L264 PolarHBondContact O-N 3.48Å; L261-L264 VanDerWaalsContact O-N 3.14Å; L261-N265 PolarHBondContact O-N 3.01Å |
| 262 | Y | 86.6 | Confident | 77.5 | Confident | 166 Ų | 166 | 78.2 Ų | 78.2 | 65% | 0.651 | 41% | 0.41 | S | S | * | . | H | α-helix | trans | -61 | -37.3 | 174.3 | -79.9 | -65.3 | 0 | 0 | 0 | 112.3 | T258 N259 L264 N265 D266 | T258-Y262 HydrophobicContact CG2-CD2 3.79Å; T258-Y262 HydrophobicContact CG2-CE2 3.47Å; T258-Y262 VanDerWaalsContact CG2-CE2 3.47Å; T258-Y262 WeakPolarHBondContact O-CD2 3.43Å; T258-Y262 PolarHBondContact O-N 2.83Å; N259-Y262 PolarHBondContact O-N 3.13Å; Y262-L264 PolarHBondContact O-N 3.39Å; Y262-N265 PolarHBondContact O-N 2.8Å; Y262-N265 VanDerWaalsContact O-N 3.16Å; Y262-D266 PolarHBondContact O-N 2.94Å |
| 263 | S | 82.2 | Confident | 75.1 | Confident | 52 Ų | 52 | 85.9 Ų | 85.9 | 36% | 0.364 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -66.7 | -25.5 | 177.6 | -56 | 0 | 0 | 0 | 0 | 113.2 | N259 K260 L261 | N259-S263 PolarHBondContact O-N 2.93Å; N259-S263 PolarHBondContact O-OG 2.85Å; K260-S263 WeakPolarHBondContact O-CB 3.08Å; K260-S263 PolarHBondContact O-N 3.34Å; L261-S263 VanDerWaalsContact C-N 3.27Å; L261-S263 PolarHBondContact O-N 3.41Å |
| 264 | L | 79 | Confident | 72.8 | Confident | 74 Ų | 74 | 87.4 Ų | 87.4 | 39% | 0.387 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -78.6 | -27.1 | 174.7 | -65.2 | 174.1 | 0 | 0 | 0 | 112.6 | L190 K260 L261 Y262 | L190-L264 HydrophobicContact CB-CD2 3.68Å; L190-L264 HydrophobicContact CD1-CD2 4.32Å; L190-L264 HydrophobicContact CD2-CD2 4.09Å; L190-L264 HydrophobicContact CG-CD2 4.24Å; K260-L264 WeakPolarHBondContact O-CG 3.4Å; K260-L264 PolarHBondContact O-N 3.3Å; K260-L264 VanDerWaalsContact O-N 3.17Å; L261-L264 HydrophobicContact CD2-CD1 4.46Å; L261-L264 WeakPolarHBondContact O-CB 3.47Å; L261-L264 PolarHBondContact O-N 3.48Å; L261-L264 VanDerWaalsContact O-N 3.14Å; Y262-L264 PolarHBondContact O-N 3.39Å |
| 265 | N | 71.4 | Confident | 70.4 | Confident | 120 Ų | 120 | 97 Ų | 97 | 64% | 0.642 | 49% | 0.494 | S | S | * | . | S | Bend | trans | -95.3 | 2.8 | -174.2 | -159.3 | 29.2 | 0 | 0 | 0 | 113.4 | L261 Y262 P267 | L261-N265 PolarHBondContact O-N 3.01Å; Y262-N265 PolarHBondContact O-N 2.8Å; Y262-N265 VanDerWaalsContact O-N 3.16Å; N265-P267 WeakPolarHBondContact O-CD 3.5Å |
| 266 | D | 69.3 | Low | 67.9 | Low | 70 Ų | 70 | 103.1 Ų | 103.1 | 37% | 0.374 | 52% | 0.521 | S | S | . | . | trans | -69.8 | 112.3 | 177.8 | -168.2 | -30.3 | 0 | 0 | 0 | 110.3 | Y262 T268 L269 | Y262-D266 PolarHBondContact O-N 2.94Å; D266-T268 VanDerWaalsContact CG-OG1 3.31Å; D266-T268 PolarHBondContact O-N 2.78Å; D266-T268 VanDerWaalsContact O-N 3.14Å; D266-T268 WeakPolarHBondContact OD1-CB 3.49Å; D266-T268 PolarHBondContact OD1-N 2.92Å; D266-T268 PolarHBondContact OD1-OG1 3.4Å; D266-L269 PolarHBondContact O-N 3.37Å | ||
| 267 | P | 53.9 | Low | 65.6 | Low | 96 Ų | 96 | 106.6 Ų | 106.6 | 62% | 0.623 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -64.5 | -20.8 | -174.5 | 25 | -32.4 | 0 | 0 | 0 | 112.9 | N265 L269 N270 D271 | N265-P267 WeakPolarHBondContact O-CD 3.5Å; P267-L269 PolarHBondContact O-N 3.1Å; P267-N270 PolarHBondContact O-N 3.3Å; P267-D271 PolarHBondContact O-N 3.21Å |
| 268 | T | 54.6 | Low | 63.2 | Low | 106 Ų | 106 | 112.6 Ų | 112.6 | 65% | 0.65 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -69.2 | -18.6 | -179.4 | 65 | 0 | 0 | 0 | 0 | 113.6 | D266 | D266-T268 VanDerWaalsContact CG-OG1 3.31Å; D266-T268 PolarHBondContact O-N 2.78Å; D266-T268 VanDerWaalsContact O-N 3.14Å; D266-T268 WeakPolarHBondContact OD1-CB 3.49Å; D266-T268 PolarHBondContact OD1-N 2.92Å; D266-T268 PolarHBondContact OD1-OG1 3.4Å |
| 269 | L | 52.3 | Low | 60.8 | Low | 109 Ų | 109 | 118.2 Ų | 118.2 | 57% | 0.571 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -90.7 | -21.2 | 174.9 | -68.4 | 176.2 | 0 | 0 | 0 | 113.4 | D266 P267 | D266-L269 PolarHBondContact O-N 3.37Å; P267-L269 PolarHBondContact O-N 3.1Å |
| 270 | N | 49.8 | Very low | 58.7 | Low | 92 Ų | 92 | 122.5 Ų | 122.5 | 49% | 0.492 | 61% | 0.606 | S | S | . | * | H | α-helix | trans | -87.4 | -16.7 | -179.4 | -102 | -15.9 | 0 | 0 | 0 | 113.8 | P267 K272 K273 A274 | P267-N270 PolarHBondContact O-N 3.3Å; N270-K272 VanDerWaalsContact C-N 3.28Å; N270-K272 PolarHBondContact O-N 3.14Å; N270-K272 VanDerWaalsContact O-N 3.16Å; N270-K273 PolarHBondContact O-N 2.98Å; N270-A274 WeakPolarHBondContact O-CB 3.47Å; N270-A274 PolarHBondContact O-N 3.1Å |
| 271 | D | 46.8 | Very low | 56.6 | Low | 140 Ų | 140 | 126.1 Ų | 126.1 | 75% | 0.749 | 63% | 0.625 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -69.1 | -19.8 | -165.1 | -139.5 | 15.4 | 0 | 0 | 0 | 114.8 | P267 | P267-D271 PolarHBondContact O-N 3.21Š|
| 272 | K | 43.9 | Very low | 55 | Low | 207 Ų | 207 | 123.5 Ų | 123.5 | 90% | 0.9 | 62% | 0.616 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -91.7 | -5.3 | 178.2 | -65.6 | -171.8 | -179.3 | -178.3 | 0 | 114.8 | N270 | N270-K272 VanDerWaalsContact C-N 3.28Å; N270-K272 PolarHBondContact O-N 3.14Å; N270-K272 VanDerWaalsContact O-N 3.16Å |
| 273 | K | 46.6 | Very low | 53.1 | Low | 164 Ų | 164 | 122 Ų | 122 | 71% | 0.713 | 62% | 0.618 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -137.2 | -4.9 | -178.7 | -90.3 | -174.8 | 176.4 | 179.7 | 0 | 115.6 | N270 K275 K276 | N270-K273 PolarHBondContact O-N 2.98Å; K273-K275 VanDerWaalsContact C-N 3.28Å; K273-K275 PolarHBondContact O-N 2.94Å; K273-K276 PolarHBondContact O-N 3.1Å |
| 274 | A | 46.7 | Very low | 51.6 | Low | 41 Ų | 41 | 124.3 Ų | 124.3 | 34% | 0.339 | 63% | 0.634 | S | S | . | * | G | 310 helix | trans | -62.3 | -25.9 | -176 | 0 | 0 | 0 | 0 | 0 | 115 | N270 K276 L277 | N270-A274 WeakPolarHBondContact O-CB 3.47Å; N270-A274 PolarHBondContact O-N 3.1Å; A274-K276 PolarHBondContact O-N 3.37Å; A274-L277 PolarHBondContact O-N 3.42Å; A274-L277 VanDerWaalsContact O-N 3.12Å |
| 275 | K | 44.6 | Very low | 50.3 | Low | 215 Ų | 215 | 123.5 Ų | 123.5 | 94% | 0.935 | 63% | 0.631 | S | S | * | * | G | 310 helix | trans | -63.8 | -4.5 | -179 | -79.3 | -172.4 | 177.1 | -178.8 | 0 | 116 | K273 | K273-K275 VanDerWaalsContact C-N 3.28Å; K273-K275 PolarHBondContact O-N 2.94Å |
| 276 | K | 42.3 | Very low | 49.2 | Very low | 204 Ų | 204 | 123.6 Ų | 123.6 | 89% | 0.887 | 63% | 0.628 | S | S | * | * | G | 310 helix | trans | -119.6 | -5.5 | 174.4 | -154.4 | 173.3 | -178.8 | -179.6 | 0 | 114.4 | K273 A274 | K273-K276 PolarHBondContact O-N 3.1Å; A274-K276 PolarHBondContact O-N 3.37Å |
| 277 | L | 47.9 | Very low | 48.3 | Very low | 88 Ų | 88 | 124.5 Ų | 124.5 | 46% | 0.461 | 63% | 0.632 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -105.4 | -13.5 | -174.2 | -166.4 | 63.8 | 0 | 0 | 0 | 113.6 | A274 H279 Q280 L281 | A274-L277 PolarHBondContact O-N 3.42Å; A274-L277 VanDerWaalsContact O-N 3.12Å; L277-H279 VanDerWaalsContact C-N 3.26Å; L277-H279 PolarHBondContact O-N 3.42Å; L277-Q280 PolarHBondContact O-N 3.34Å; L277-L281 HydrophobicContact CD1-CD1 4.29Å; L277-L281 HydrophobicContact CD2-CD2 4.2Å; L277-L281 HydrophobicContact CG-CB 4.37Å; L277-L281 HydrophobicContact CG-CD1 4.41Å; L277-L281 HydrophobicContact CG-CD2 4.49Å; L277-L281 PolarHBondContact O-N 3.35Å |
| 278 | E | 43 | Very low | 48.5 | Very low | 152 Ų | 152 | 121.8 Ų | 121.8 | 71% | 0.71 | 62% | 0.616 | S | S | * | * | H | α-helix | trans | -65.6 | -26.1 | -174.1 | -139 | 168.6 | -169.3 | 0 | 0 | 113.4 | Q280 | E278-Q280 PolarHBondContact O-N 3.07Å |
| 279 | H | 43.8 | Very low | 48.3 | Very low | 181 Ų | 181 | 122.2 Ų | 122.2 | 84% | 0.838 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -85.6 | -5.5 | -174.6 | -152.1 | 41.5 | 0 | 0 | 0 | 115.4 | L277 | L277-H279 VanDerWaalsContact C-N 3.26Å; L277-H279 PolarHBondContact O-N 3.42Å |
| 280 | Q | 45.6 | Very low | 48.3 | Very low | 174 Ų | 174 | 122.7 Ų | 122.7 | 81% | 0.813 | 61% | 0.614 | S | S | * | * | H | α-helix | trans | -127.3 | -12.2 | 179.8 | -81 | -77.1 | -46.2 | 0 | 0 | 114.2 | L277 E278 | L277-Q280 PolarHBondContact O-N 3.34Å; E278-Q280 PolarHBondContact O-N 3.07Å |
| 281 | L | 49.1 | Very low | 48.5 | Very low | 94 Ų | 94 | 124.1 Ų | 124.1 | 49% | 0.492 | 62% | 0.617 | S | S | . | * | H | α-helix | trans | -99.2 | -8.6 | 179.9 | -134 | 81.5 | 0 | 0 | 0 | 114.2 | L277 T285 | L277-L281 HydrophobicContact CD1-CD1 4.29Å; L277-L281 HydrophobicContact CD2-CD2 4.2Å; L277-L281 HydrophobicContact CG-CB 4.37Å; L277-L281 HydrophobicContact CG-CD1 4.41Å; L277-L281 HydrophobicContact CG-CD2 4.49Å; L277-L281 PolarHBondContact O-N 3.35Å; L281-T285 WeakPolarHBondContact O-CB 3.42Å; L281-T285 PolarHBondContact O-OG1 3.48Å; L281-T285 VanDerWaalsContact O-OG1 3.1Å |
| 282 | S | 56.1 | Low | 48.7 | Very low | 49 Ų | 49 | 122 Ų | 122 | 34% | 0.343 | 61% | 0.605 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -83.4 | -15 | -165.1 | -170.6 | 0 | 0 | 0 | 0 | 116 | Q286 | S282-Q286 VanDerWaalsContact O-CB 3.27Å; S282-Q286 WeakPolarHBondContact O-CB 3.49Å; S282-Q286 WeakPolarHBondContact O-CG 3.08Å; S282-Q286 PolarHBondContact O-OE1 2.84Å; S282-Q286 PolarHBondContact OG-NE2 3.47Å |
| 283 | L | 45.7 | Very low | 49.2 | Very low | 133 Ų | 133 | 121.7 Ų | 121.7 | 70% | 0.696 | 60% | 0.597 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -102.8 | -47.5 | -176 | -88.5 | 151 | 0 | 0 | 0 | 113 | I287 | L283-I287 HydrophobicContact CD2-CD1 4.37Å; L283-I287 VanDerWaalsContact O-CB 3.31Å; L283-I287 WeakPolarHBondContact O-CB 3.37Å; L283-I287 VanDerWaalsContact O-CD1 3.28Å; L283-I287 WeakPolarHBondContact O-CD1 3.48Å; L283-I287 WeakPolarHBondContact O-CG1 3.41Å; L283-I287 PolarHBondContact O-N 3.18Å |
| 284 | C | 50.8 | Low | 49.3 | Very low | 102 Ų | 102 | 118.8 Ų | 118.8 | 69% | 0.689 | 59% | 0.59 | S | S | * | * | H | α-helix | trans | -68.7 | -40.9 | 178.1 | -78.3 | 0 | 0 | 0 | 0 | 112.7 | S288 | C284-S288 WeakPolarHBondContact O-CB 3.48Å; C284-S288 PolarHBondContact O-N 3.16Å; C284-S288 PolarHBondContact O-OG 2.93Å |
| 285 | T | 51.9 | Low | 49.4 | Very low | 56 Ų | 56 | 119.8 Ų | 119.8 | 34% | 0.344 | 59% | 0.594 | S | S | . | * | H | α-helix | trans | -73.1 | -34.9 | -178.7 | -40.1 | 0 | 0 | 0 | 0 | 111.8 | L281 M289 | L281-T285 WeakPolarHBondContact O-CB 3.42Å; L281-T285 PolarHBondContact O-OG1 3.48Å; L281-T285 VanDerWaalsContact O-OG1 3.1Å; T285-M289 HydrophobicContact CG2-CE 3.69Å; T285-M289 WeakPolarHBondContact O-CB 3.41Å; T285-M289 VanDerWaalsContact O-CG 3.24Å; T285-M289 WeakPolarHBondContact O-CG 3.27Å; T285-M289 PolarHBondContact O-N 3.44Å |
| 286 | Q | 48.3 | Very low | 49.8 | Very low | 122 Ų | 122 | 115.1 Ų | 115.1 | 57% | 0.57 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -71.7 | -38.9 | 175.2 | -69.7 | -171.8 | 7 | 0 | 0 | 112.4 | S282 M289 L290 | S282-Q286 VanDerWaalsContact O-CB 3.27Å; S282-Q286 WeakPolarHBondContact O-CB 3.49Å; S282-Q286 WeakPolarHBondContact O-CG 3.08Å; S282-Q286 PolarHBondContact O-OE1 2.84Å; S282-Q286 PolarHBondContact OG-NE2 3.47Å; Q286-M289 PolarHBondContact O-N 2.84Å; Q286-L290 WeakPolarHBondContact O-CB 3.43Å; Q286-L290 PolarHBondContact O-N 2.7Å |
| 287 | I | 51.4 | Low | 50.3 | Low | 90 Ų | 90 | 109.7 Ų | 109.7 | 46% | 0.462 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -63.6 | -44 | 174.5 | -68.1 | 165.9 | 0 | 0 | 0 | 110.2 | L283 M289 L290 E291 | L283-I287 HydrophobicContact CD2-CD1 4.37Å; L283-I287 VanDerWaalsContact O-CB 3.31Å; L283-I287 WeakPolarHBondContact O-CB 3.37Å; L283-I287 VanDerWaalsContact O-CD1 3.28Å; L283-I287 WeakPolarHBondContact O-CD1 3.48Å; L283-I287 WeakPolarHBondContact O-CG1 3.41Å; L283-I287 PolarHBondContact O-N 3.18Å; I287-M289 VanDerWaalsContact C-N 3.34Å; I287-M289 PolarHBondContact O-N 3.1Å; I287-L290 PolarHBondContact O-N 2.94Å; I287-E291 WeakPolarHBondContact O-CB 3.09Å; I287-E291 WeakPolarHBondContact O-CG 3.34Å; I287-E291 PolarHBondContact O-N 2.98Å |
| 288 | S | 56.4 | Low | 50.3 | Low | 39 Ų | 39 | 110.2 Ų | 110.2 | 27% | 0.273 | 58% | 0.582 | S | S | . | * | H | α-helix | trans | -62.5 | -36.4 | 176 | -66.8 | 0 | 0 | 0 | 0 | 113.7 | C284 M292 | C284-S288 WeakPolarHBondContact O-CB 3.48Å; C284-S288 PolarHBondContact O-N 3.16Å; C284-S288 PolarHBondContact O-OG 2.93Å; S288-M292 WeakPolarHBondContact O-CB 3.37Å; S288-M292 PolarHBondContact O-N 3.24Å |
| 289 | M | 51.7 | Low | 50.2 | Low | 115 Ų | 115 | 106.5 Ų | 106.5 | 57% | 0.567 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -75.5 | -34.1 | 177.1 | -70.9 | -176.2 | -170.7 | 0 | 0 | 112.7 | T285 Q286 I287 M292 R293 | T285-M289 HydrophobicContact CG2-CE 3.69Å; T285-M289 WeakPolarHBondContact O-CB 3.41Å; T285-M289 VanDerWaalsContact O-CG 3.24Å; T285-M289 WeakPolarHBondContact O-CG 3.27Å; T285-M289 PolarHBondContact O-N 3.44Å; Q286-M289 PolarHBondContact O-N 2.84Å; I287-M289 VanDerWaalsContact C-N 3.34Å; I287-M289 PolarHBondContact O-N 3.1Å; M289-M292 PolarHBondContact O-N 3.43Å; M289-R293 PolarHBondContact O-N 3.11Å; M289-R293 VanDerWaalsContact O-N 3.1Å |
| 290 | L | 51.8 | Low | 50.5 | Low | 118 Ų | 118 | 103.3 Ų | 103.3 | 62% | 0.618 | 57% | 0.571 | S | S | * | * | H | α-helix | trans | -71.3 | -38.8 | 175.7 | -145.5 | 83.2 | 0 | 0 | 0 | 111.3 | Q286 I287 R293 N294 | Q286-L290 WeakPolarHBondContact O-CB 3.43Å; Q286-L290 PolarHBondContact O-N 2.7Å; I287-L290 PolarHBondContact O-N 2.94Å; L290-R293 PolarHBondContact O-N 3.37Å; L290-N294 WeakPolarHBondContact O-CB 3.34Å; L290-N294 PolarHBondContact O-N 3.45Å; L290-N294 PolarHBondContact O-ND2 2.81Å |
| 291 | E | 53.3 | Low | 50.6 | Low | 122 Ų | 122 | 102.5 Ų | 102.5 | 57% | 0.57 | 57% | 0.572 | S | S | * | * | H | α-helix | trans | -65.5 | -38.3 | 171.4 | -78.7 | -179.6 | 150.6 | 0 | 0 | 112.3 | I287 R293 N294 S295 | I287-E291 WeakPolarHBondContact O-CB 3.09Å; I287-E291 WeakPolarHBondContact O-CG 3.34Å; I287-E291 PolarHBondContact O-N 2.98Å; E291-R293 VanDerWaalsContact C-N 3.34Å; E291-R293 PolarHBondContact O-N 3Å; E291-N294 PolarHBondContact O-N 2.88Å; E291-S295 WeakPolarHBondContact O-CB 3.41Å; E291-S295 PolarHBondContact O-N 3.23Å; E291-S295 PolarHBondContact O-OG 2.97Å |
| 292 | M | 52.7 | Low | 50.5 | Low | 97 Ų | 97 | 102.3 Ų | 102.3 | 48% | 0.478 | 58% | 0.579 | S | S | . | * | H | α-helix | trans | -61.7 | -40.6 | 173.4 | -170.6 | -179 | -155.2 | 0 | 0 | 112 | S288 M289 S295 I296 | S288-M292 WeakPolarHBondContact O-CB 3.37Å; S288-M292 PolarHBondContact O-N 3.24Å; M289-M292 PolarHBondContact O-N 3.43Å; M292-S295 WeakPolarHBondContact CA-OG 3.09Å; M292-S295 PolarHBondContact O-OG 2.91Å; M292-I296 HydrophobicContact CG-CD1 4.11Å; M292-I296 WeakPolarHBondContact O-CD1 3.34Å; M292-I296 VanDerWaalsContact O-CG1 3.23Å; M292-I296 WeakPolarHBondContact O-CG1 3.47Å; M292-I296 PolarHBondContact O-N 3.11Å |
| 293 | R | 53.1 | Low | 50.3 | Low | 199 Ų | 199 | 106.2 Ų | 106.2 | 75% | 0.751 | 60% | 0.596 | S | S | * | * | H | α-helix | trans | -71.1 | -38 | 178.9 | -164.7 | 174.9 | 178.5 | 176 | -1.4 | 112.2 | M289 L290 E291 A297 | M289-R293 PolarHBondContact O-N 3.11Å; M289-R293 VanDerWaalsContact O-N 3.1Å; L290-R293 PolarHBondContact O-N 3.37Å; E291-R293 VanDerWaalsContact C-N 3.34Å; E291-R293 PolarHBondContact O-N 3Å; R293-A297 PolarHBondContact O-N 3.2Å |
| 294 | N | 49.8 | Very low | 50.4 | Low | 104 Ų | 104 | 105.6 Ų | 105.6 | 56% | 0.556 | 59% | 0.593 | S | S | * | * | H | α-helix | trans | -73.3 | -34.1 | 177.6 | -73.4 | -17.3 | 0 | 0 | 0 | 112.8 | L290 E291 A297 S298 | L290-N294 WeakPolarHBondContact O-CB 3.34Å; L290-N294 PolarHBondContact O-N 3.45Å; L290-N294 PolarHBondContact O-ND2 2.81Å; E291-N294 PolarHBondContact O-N 2.88Å; N294-A297 PolarHBondContact O-N 3.35Å; N294-S298 WeakPolarHBondContact O-CB 3.39Å; N294-S298 PolarHBondContact O-N 3.45Å; N294-S298 VanDerWaalsContact O-N 3.08Å |
| 295 | S | 48 | Very low | 50 | Low | 61 Ų | 61 | 103.4 Ų | 103.4 | 43% | 0.427 | 59% | 0.588 | S | S | . | * | H | α-helix | trans | -69.9 | -38 | 176.2 | 46.3 | 0 | 0 | 0 | 0 | 112.5 | E291 M292 A297 S298 S299 | E291-S295 WeakPolarHBondContact O-CB 3.41Å; E291-S295 PolarHBondContact O-N 3.23Å; E291-S295 PolarHBondContact O-OG 2.97Å; M292-S295 WeakPolarHBondContact CA-OG 3.09Å; M292-S295 PolarHBondContact O-OG 2.91Å; S295-A297 VanDerWaalsContact C-N 3.35Å; S295-S298 PolarHBondContact O-N 3.37Å; S295-S299 PolarHBondContact O-N 3.17Å; S295-S299 PolarHBondContact O-OG 3.12Å |
| 296 | I | 54 | Low | 49.7 | Very low | 118 Ų | 118 | 104.1 Ų | 104.1 | 61% | 0.605 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -67.9 | -34.8 | 175.2 | -66.7 | 167.5 | 0 | 0 | 0 | 111.7 | M292 S298 | M292-I296 HydrophobicContact CG-CD1 4.11Å; M292-I296 WeakPolarHBondContact O-CD1 3.34Å; M292-I296 VanDerWaalsContact O-CG1 3.23Å; M292-I296 WeakPolarHBondContact O-CG1 3.47Å; M292-I296 PolarHBondContact O-N 3.11Å; I296-S298 VanDerWaalsContact C-N 3.32Å |
| 297 | A | 52.5 | Low | 49.5 | Very low | 89 Ų | 89 | 103.8 Ų | 103.8 | 74% | 0.736 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -75.8 | -20.1 | 175.4 | 0 | 0 | 0 | 0 | 0 | 113.2 | R293 N294 S295 | R293-A297 PolarHBondContact O-N 3.2Å; N294-A297 PolarHBondContact O-N 3.35Å; S295-A297 VanDerWaalsContact C-N 3.35Å |
| 298 | S | 46.9 | Very low | 49.3 | Very low | 99 Ų | 99 | 107.4 Ų | 107.4 | 69% | 0.692 | 60% | 0.603 | S | S | * | * | H | α-helix | trans | -97.7 | -13.3 | -175.5 | -177.2 | 0 | 0 | 0 | 0 | 114.5 | N294 S295 I296 S300 | N294-S298 WeakPolarHBondContact O-CB 3.39Å; N294-S298 PolarHBondContact O-N 3.45Å; N294-S298 VanDerWaalsContact O-N 3.08Å; S295-S298 PolarHBondContact O-N 3.37Å; I296-S298 VanDerWaalsContact C-N 3.32Å; S298-S300 PolarHBondContact O-N 3.22Å |
| 299 | S | 41.9 | Very low | 48.8 | Very low | 75 Ų | 75 | 111.2 Ų | 111.2 | 52% | 0.524 | 62% | 0.615 | S | S | . | * | trans | -99.6 | 85.5 | -177.8 | 66.1 | 0 | 0 | 0 | 0 | 111.9 | S295 | S295-S299 PolarHBondContact O-N 3.17Å; S295-S299 PolarHBondContact O-OG 3.12Å | ||
| 300 | S | 49.8 | Very low | 48.5 | Very low | 113 Ų | 113 | 108.9 Ų | 108.9 | 79% | 0.79 | 60% | 0.604 | S | S | * | * | S | Bend | trans | -72.1 | 113.2 | 141.6 | 56.2 | 0 | 0 | 0 | 0 | 107 | S298 | S298-S300 PolarHBondContact O-N 3.22Š|
| 301 | D | 47.9 | Very low | 48.3 | Very low | 157 Ų | 157 | 111.5 Ų | 111.5 | 84% | 0.84 | 61% | 0.606 | S | S | * | * | S | Bend | trans | 61.2 | 96.8 | 174.3 | -74.2 | -24 | 0 | 0 | 0 | 118.1 | ||
| 302 | S | 47.3 | Very low | 47.5 | Very low | 90 Ų | 90 | 108.2 Ų | 108.2 | 63% | 0.629 | 60% | 0.604 | S | S | * | * | 156.8 | 140.5 | 128.8 | 50.1 | 0 | 0 | 0 | 0 | 112.1 | D304 | S302-D304 PolarHBondContact O-N 2.95Š| |||
| 303 | D | 50.8 | Low | 46.8 | Very low | 131 Ų | 131 | 110.4 Ų | 110.4 | 70% | 0.701 | 62% | 0.623 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -64.7 | 3.8 | -172.3 | -112.8 | -33 | 0 | 0 | 0 | 115.6 | ||
| 304 | D | 47.3 | Very low | 45.8 | Very low | 120 Ų | 120 | 106.6 Ų | 106.6 | 64% | 0.642 | 63% | 0.627 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79.9 | -23 | -166.3 | -79.9 | -34.2 | 0 | 0 | 0 | 114.8 | S302 L306 H307 | S302-D304 PolarHBondContact O-N 2.95Å; D304-L306 VanDerWaalsContact C-N 3.32Å; D304-L306 PolarHBondContact O-N 3.16Å; D304-H307 PolarHBondContact O-N 3.1Å |
| 305 | G | 43 | Very low | 45 | Very low | 56 Ų | 56 | 107.2 Ų | 107.2 | 58% | 0.577 | 64% | 0.64 | S | S | * | * | H | α-helix | trans | -65.9 | -30.6 | -176.6 | 0 | 0 | 0 | 0 | 0 | 114.3 | H307 | G305-H307 VanDerWaalsContact C-N 3.34Å; G305-H307 PolarHBondContact O-N 3.34Å |
| 306 | L | 45.3 | Very low | 44.1 | Very low | 71 Ų | 71 | 112.8 Ų | 112.8 | 37% | 0.372 | 66% | 0.661 | S | S | . | * | H | α-helix | trans | -73.9 | -27.3 | -176.9 | -166.9 | 67.4 | 0 | 0 | 0 | 112.4 | R205 D304 L310 | R205-L306 VanDerWaalsContact NH2-CD2 3.31Å; D304-L306 VanDerWaalsContact C-N 3.32Å; D304-L306 PolarHBondContact O-N 3.16Å; L306-L310 HydrophobicContact CG-CD1 4.31Å; L306-L310 WeakPolarHBondContact O-CG 3.18Å; L306-L310 PolarHBondContact O-N 3.19Å |
| 307 | H | 44.9 | Very low | 42.9 | Very low | 116 Ų | 116 | 112.7 Ų | 112.7 | 54% | 0.537 | 67% | 0.671 | S | S | . | * | H | α-helix | trans | -73.8 | -28.6 | -178.1 | -79.3 | -78.8 | 0 | 0 | 0 | 113.4 | D304 G305 | D304-H307 PolarHBondContact O-N 3.1Å; G305-H307 VanDerWaalsContact C-N 3.34Å; G305-H307 PolarHBondContact O-N 3.34Å |
| 308 | Q | 47.2 | Very low | 41.8 | Very low | 166 Ų | 166 | 113.1 Ų | 113.1 | 78% | 0.776 | 67% | 0.669 | S | S | * | * | H | α-helix | trans | -72.1 | -37.3 | 178.2 | -162.4 | 87 | 6.9 | 0 | 0 | 111.6 | ||
| 309 | F | 44.7 | Very low | 40.8 | Very low | 119 Ų | 119 | 115.9 Ų | 115.9 | 52% | 0.522 | 68% | 0.675 | S | S | . | * | H | α-helix | trans | -77.8 | -36.4 | -176.1 | -170.7 | -103.1 | 0 | 0 | 0 | 113.1 | R311 | F309-R311 PolarHBondContact O-N 3.38Å; F309-R311 VanDerWaalsContact O-N 3.14Å |
| 310 | L | 45.6 | Very low | 40.2 | Very low | 65 Ų | 65 | 120.5 Ų | 120.5 | 34% | 0.34 | 69% | 0.688 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -66.8 | -12.4 | 177.6 | -70 | 173.4 | 0 | 0 | 0 | 113.6 | L306 | L306-L310 HydrophobicContact CG-CD1 4.31Å; L306-L310 WeakPolarHBondContact O-CG 3.18Å; L306-L310 PolarHBondContact O-N 3.19Å |
| 311 | R | 48.3 | Very low | 39.1 | Very low | 174 Ų | 174 | 121.5 Ų | 121.5 | 66% | 0.657 | 69% | 0.689 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84.5 | -12.8 | -177.5 | -101.6 | -170 | -173.6 | 165.8 | 9.9 | 116.2 | F309 | F309-R311 PolarHBondContact O-N 3.38Å; F309-R311 VanDerWaalsContact O-N 3.14Å |
| 312 | G | 36.2 | Very low | 38.1 | Very low | 52 Ų | 52 | 118.5 Ų | 118.5 | 54% | 0.536 | 68% | 0.68 | S | S | . | * | trans | 58.4 | 113.4 | 176.7 | 0 | 0 | 0 | 0 | 0 | 114.5 | S314 | G312-S314 PolarHBondContact O-N 3.07Å; G312-S314 VanDerWaalsContact O-N 3.08Å | ||
| 313 | T | 37.4 | Very low | 37.2 | Very low | 143 Ų | 143 | 119 Ų | 119 | 88% | 0.877 | 68% | 0.683 | S | S | * | * | trans | -56.9 | 112.3 | 176.8 | 51.6 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 314 | S | 31.9 | Very low | 36.3 | Very low | 119 Ų | 119 | 118.6 Ų | 118.6 | 83% | 0.832 | 69% | 0.688 | S | S | * | * | trans | -78.9 | 122.6 | 163.5 | 36.4 | 0 | 0 | 0 | 0 | 109.6 | G312 M316 | G312-S314 PolarHBondContact O-N 3.07Å; G312-S314 VanDerWaalsContact O-N 3.08Å; S314-M316 PolarHBondContact O-N 2.91Å | ||
| 315 | S | 34.5 | Very low | 35.5 | Very low | 118 Ų | 118 | 121.4 Ų | 121.4 | 83% | 0.825 | 70% | 0.697 | S | S | * | * | trans | -68.4 | 119.4 | 171.7 | -47.9 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 316 | M | 28.9 | Very low | 34.9 | Very low | 178 Ų | 178 | 127.7 Ų | 127.7 | 88% | 0.877 | 71% | 0.711 | S | S | * | * | trans | -141 | 116.9 | 149.3 | -82.9 | -157.7 | 80.9 | 0 | 0 | 110 | S314 | S314-M316 PolarHBondContact O-N 2.91Š| ||
| 317 | S | 29.3 | Very low | 34.1 | Very low | 116 Ų | 116 | 135.7 Ų | 135.7 | 81% | 0.811 | 74% | 0.736 | S | S | * | * | trans | -66.2 | 125.4 | 163.7 | -41.7 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 318 | S | 27.9 | Very low | 33.4 | Very low | 98 Ų | 98 | 135.1 Ų | 135.1 | 69% | 0.685 | 75% | 0.752 | S | S | * | * | trans | 179.7 | 134 | 135.5 | 58.6 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 319 | L | 26.3 | Very low | 32.7 | Very low | 157 Ų | 157 | 133 Ų | 133 | 82% | 0.822 | 76% | 0.756 | S | S | * | * | trans | 79.9 | 90.9 | 145.6 | -67.5 | 155.1 | 0 | 0 | 0 | 119 | V321 | L319-V321 PolarHBondContact O-N 2.91Š| ||
| 320 | H | 29.4 | Very low | 32.3 | Very low | 172 Ų | 172 | 131.9 Ų | 131.9 | 80% | 0.796 | 77% | 0.768 | S | S | * | * | 10.3 | 105.1 | 127.7 | -165.4 | -73 | 0 | 0 | 0 | 117 | |||||
| 321 | V | 26.8 | Very low | 31.8 | Very low | 134 Ų | 134 | 138.6 Ų | 138.6 | 81% | 0.812 | 79% | 0.794 | S | S | * | * | trans | -139.1 | 133.1 | 147.9 | -178.4 | 0 | 0 | 0 | 0 | 109 | L319 | L319-V321 PolarHBondContact O-N 2.91Š| ||
| 322 | S | 26.3 | Very low | 31 | Very low | 93 Ų | 93 | 139.5 Ų | 139.5 | 65% | 0.65 | 81% | 0.808 | S | S | * | * | trans | -61.6 | 153.3 | -170.6 | 40.1 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 323 | S | 28.9 | Very low | 31.1 | Very low | 100 Ų | 100 | 146.1 Ų | 146.1 | 70% | 0.699 | 82% | 0.822 | S | S | * | * | trans | -54.3 | 164.4 | 172.6 | 75.5 | 0 | 0 | 0 | 0 | 114 | ||||
| 324 | P | 32.7 | Very low | 30.8 | Very low | 124 Ų | 124 | 145.3 Ų | 145.3 | 81% | 0.805 | 82% | 0.82 | S | S | * | * | -124.3 | 133.8 | 125 | 20.1 | -2.7 | 0 | 0 | 0 | 112.3 | |||||
| 325 | H | 31 | Very low | 31.1 | Very low | 178 Ų | 178 | 147.7 Ų | 147.7 | 82% | 0.824 | 82% | 0.822 | S | S | * | * | trans | -47.1 | 140.6 | 161.5 | -80.7 | -50.6 | 0 | 0 | 0 | 112.5 | ||||
| 326 | Q | 29.3 | Very low | 31.1 | Very low | 189 Ų | 189 | 150.9 Ų | 150.9 | 88% | 0.883 | 82% | 0.823 | S | S | * | * | trans | -151.7 | 107.5 | 139.5 | -109.6 | 172.3 | 18.8 | 0 | 0 | 112.3 | ||||
| 327 | R | 28.7 | Very low | 31.4 | Very low | 238 Ų | 238 | 152 Ų | 152 | 90% | 0.898 | 83% | 0.826 | S | S | * | * | trans | 66.7 | 108.3 | 136.4 | -133.2 | 172.1 | -159.5 | 155.8 | 4 | 119.8 | ||||
| 328 | A | 31 | Very low | 31.5 | Very low | 104 Ų | 104 | 150.2 Ų | 150.2 | 86% | 0.86 | 83% | 0.826 | S | S | * | * | trans | -59.6 | 139.4 | 156.2 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 329 | S | 31.1 | Very low | 31.9 | Very low | 123 Ų | 123 | 150.3 Ų | 150.3 | 86% | 0.86 | 83% | 0.833 | S | S | * | * | trans | -138.2 | 123.4 | 159.7 | -169.7 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 330 | A | 36.5 | Very low | 32.4 | Very low | 94 Ų | 94 | 152 Ų | 152 | 78% | 0.777 | 84% | 0.836 | S | S | * | * | trans | -94.6 | 123 | -180 | 0 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 331 | K | 36.1 | Very low | 32.8 | Very low | 206 Ų | 206 | 151 Ų | 151 | 90% | 0.896 | 84% | 0.837 | S | S | * | * | trans | 159.1 | 113.2 | 146.4 | -99.8 | 177.9 | 171.5 | 179.4 | 0 | 110.1 | ||||
| 332 | M | 30 | Very low | 33.4 | Very low | 193 Ų | 193 | 152.5 Ų | 152.5 | 95% | 0.951 | 84% | 0.841 | S | S | * | * | trans | -167.5 | 135.9 | 133.6 | -150.2 | 72.1 | 170.5 | 0 | 0 | 108.6 | ||||
| 333 | K | 38.8 | Very low | 33.9 | Very low | 191 Ų | 191 | 155.2 Ų | 155.2 | 83% | 0.83 | 85% | 0.848 | S | S | * | * | P | Polyproline II helix | trans | -81.5 | 159.1 | -173.9 | -75.9 | -177.4 | 173.8 | -174.1 | 0 | 112.5 | ||
| 334 | P | 32.4 | Very low | 34.3 | Very low | 126 Ų | 126 | 159 Ų | 159 | 82% | 0.818 | 86% | 0.855 | S | S | * | * | P | Polyproline II helix | trans | -69.6 | 145.1 | 176.2 | -7.8 | 25 | 0 | 0 | 0 | 111.1 | ||
| 335 | I | 37.1 | Very low | 34.6 | Very low | 170 Ų | 170 | 158.8 Ų | 158.8 | 87% | 0.872 | 85% | 0.85 | S | S | * | * | P | Polyproline II helix | trans | -93.5 | 126.4 | 174.5 | -66.5 | 169 | 0 | 0 | 0 | 108.1 | ||
| 336 | E | 35.6 | Very low | 34.7 | Very low | 185 Ų | 185 | 159.5 Ų | 159.5 | 86% | 0.864 | 85% | 0.852 | S | S | * | * | P | Polyproline II helix | trans | -73.4 | 141.3 | 173.1 | -81.5 | 174 | 139.5 | 0 | 0 | 111.3 | ||
| 337 | E | 34.8 | Very low | 35 | Very low | 201 Ų | 201 | 158.8 Ų | 158.8 | 94% | 0.939 | 85% | 0.848 | S | S | * | * | P | Polyproline II helix | trans | -73.1 | 120.6 | 168.3 | -74.3 | 179.9 | 152 | 0 | 0 | 109.9 | ||
| 338 | G | 30.8 | Very low | 35.7 | Very low | 78 Ų | 78 | 152.5 Ų | 152.5 | 80% | 0.804 | 84% | 0.838 | S | S | * | * | trans | -108.5 | 116 | 165.4 | 0 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 339 | A | 36.3 | Very low | 35.8 | Very low | 100 Ų | 100 | 152.5 Ų | 152.5 | 83% | 0.826 | 84% | 0.838 | S | S | * | * | trans | -85.7 | 126.3 | 168.1 | 0 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 340 | E | 37.4 | Very low | 36 | Very low | 192 Ų | 192 | 152.2 Ų | 152.2 | 90% | 0.897 | 84% | 0.836 | S | S | * | * | trans | -138.8 | 119.6 | 162.1 | -68.7 | -172.2 | 163.5 | 0 | 0 | 108.7 | ||||
| 341 | D | 36.4 | Very low | 36.6 | Very low | 152 Ų | 152 | 152.8 Ų | 152.8 | 81% | 0.813 | 83% | 0.832 | S | S | * | * | trans | -60.5 | 151.7 | 162.4 | -75.1 | -46.7 | 0 | 0 | 0 | 109.8 | ||||
| 342 | D | 41.3 | Very low | 36.4 | Very low | 166 Ų | 166 | 149.6 Ų | 149.6 | 89% | 0.888 | 83% | 0.825 | S | S | * | * | -169 | 117.3 | 128.7 | -94.5 | -24.7 | 0 | 0 | 0 | 110.1 | |||||
| 343 | D | 35.2 | Very low | 36.5 | Very low | 150 Ų | 150 | 146.7 Ų | 146.7 | 80% | 0.802 | 82% | 0.818 | S | S | * | * | trans | -49.3 | 142.3 | 155 | -69.4 | -64.2 | 0 | 0 | 0 | 110.7 | ||||
| 344 | E | 38.8 | Very low | 36.2 | Very low | 180 Ų | 180 | 145.1 Ų | 145.1 | 84% | 0.841 | 82% | 0.818 | S | S | * | * | trans | 174.5 | 117.7 | 132.9 | -84.8 | -110.7 | 138.1 | 0 | 0 | 111.9 | ||||
| 345 | V | 39 | Very low | 36.3 | Very low | 118 Ų | 118 | 148.8 Ų | 148.8 | 72% | 0.715 | 82% | 0.821 | S | S | * | * | trans | 83.6 | 98.4 | 131.6 | -175.1 | 0 | 0 | 0 | 0 | 119.8 | ||||
| 346 | F | 32 | Very low | 36.3 | Very low | 194 Ų | 194 | 146.2 Ų | 146.2 | 85% | 0.851 | 81% | 0.813 | S | S | * | * | trans | -54.7 | 132.1 | 143.5 | -95.2 | -106.7 | 0 | 0 | 0 | 112.7 | ||||
| 347 | E | 36.8 | Very low | 36.5 | Very low | 174 Ų | 174 | 146.3 Ų | 146.3 | 81% | 0.813 | 81% | 0.813 | S | S | * | * | 171.9 | 152.5 | 115.5 | -96 | -97.3 | 126.1 | 0 | 0 | 112.3 | |||||
| 348 | P | 42.9 | Very low | 36.6 | Very low | 106 Ų | 106 | 145.4 Ų | 145.4 | 69% | 0.688 | 81% | 0.809 | S | S | * | * | trans | -101.9 | 160.2 | -169.1 | 38.5 | -29.2 | 0 | 0 | 0 | 113.6 | ||||
| 349 | A | 32.5 | Very low | 36.8 | Very low | 103 Ų | 103 | 149.1 Ų | 149.1 | 85% | 0.851 | 81% | 0.809 | S | S | * | * | trans | -139.1 | 124.4 | 165.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 350 | S | 35.1 | Very low | 37.5 | Very low | 117 Ų | 117 | 153.3 Ų | 153.3 | 82% | 0.818 | 83% | 0.828 | S | S | * | * | trans | -105.4 | -174.5 | 159.8 | -65.3 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 351 | P | 49.6 | Very low | 37.5 | Very low | 107 Ų | 107 | 151.4 Ų | 151.4 | 70% | 0.695 | 83% | 0.825 | S | S | * | * | -122.4 | -173.5 | -75.9 | 35.8 | -18.7 | 0 | 0 | 0 | 111.6 | |||||
| 352 | N | 31.6 | Very low | 37.6 | Very low | 138 Ų | 138 | 151.4 Ų | 151.4 | 74% | 0.738 | 83% | 0.825 | S | S | * | * | trans | 113.9 | 114.2 | 159.7 | -57.7 | -28.4 | 0 | 0 | 0 | 115.2 | ||||
| 353 | T | 32.7 | Very low | 37.4 | Very low | 133 Ų | 133 | 150.6 Ų | 150.6 | 82% | 0.816 | 82% | 0.822 | S | S | * | * | 167 | 126.9 | 93.4 | 32.5 | 0 | 0 | 0 | 0 | 111.5 | |||||
| 354 | L | 32.2 | Very low | 37.5 | Very low | 158 Ų | 158 | 150.6 Ų | 150.6 | 83% | 0.827 | 82% | 0.823 | S | S | * | * | trans | -6.6 | 126.4 | 146.5 | -134.7 | 97 | 0 | 0 | 0 | 117.1 | ||||
| 355 | K | 34.8 | Very low | 37.4 | Very low | 203 Ų | 203 | 148.8 Ų | 148.8 | 88% | 0.883 | 82% | 0.822 | S | S | * | * | trans | -161.1 | 115.1 | 133.5 | -110.8 | 172.1 | -171.8 | -179.4 | 0 | 113 | ||||
| 356 | V | 37 | Very low | 37.3 | Very low | 115 Ų | 115 | 150.8 Ų | 150.8 | 70% | 0.697 | 83% | 0.829 | S | S | * | * | trans | -19.9 | 132.4 | 155.9 | 179.6 | 0 | 0 | 0 | 0 | 115 | ||||
| 357 | H | 40.1 | Very low | 37.7 | Very low | 188 Ų | 188 | 147.7 Ų | 147.7 | 87% | 0.87 | 83% | 0.828 | S | S | * | * | trans | -120.8 | 118.9 | 157.7 | -104 | 32.3 | 0 | 0 | 0 | 109.9 | ||||
| 358 | Q | 35.4 | Very low | 37.8 | Very low | 181 Ų | 181 | 145.7 Ų | 145.7 | 85% | 0.846 | 83% | 0.829 | S | S | * | * | trans | -86.8 | 136.1 | 166.6 | -117.6 | 169.8 | -22.4 | 0 | 0 | 108.2 | ||||
| 359 | L | 35.7 | Very low | 37.3 | Very low | 156 Ų | 156 | 149 Ų | 149 | 82% | 0.817 | 84% | 0.84 | S | S | * | * | trans | -59 | 161.5 | 169.8 | -107.1 | 86.5 | 0 | 0 | 0 | 112.4 | ||||
| 360 | P | 51.3 | Low | 37.8 | Very low | 189 Ų | 189 | 153.2 Ų | 153.2 | 100% | 1.227 | 84% | 0.839 | S | S | * | * | -98.2 | 0 | 116.3 | 11.9 | 1.5 | 0 | 0 | 0 | 112.2 |
Retrieved 360 of 360 residues in 71.7 ms
(Link to these results)