| 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 | 50.3 | Low | 64.1 | Low | 232 Ų | 232 | 164.6 Ų | 164.6 | 100% | 1.143 | 84% | 0.838 | S | S | * | * | 0 | 93.4 | 0 | -60.5 | -67.5 | -98.1 | 0 | 0 | 107.4 | L3 | M1-L3 PolarHBondContact O-N 2.71Š| |||
| 2 | N | 54.8 | Low | 63.9 | Low | 173 Ų | 173 | 160.1 Ų | 160.1 | 93% | 0.925 | 83% | 0.832 | S | S | * | * | trans | -76.2 | 112.7 | 171.6 | -98 | -60.9 | 0 | 0 | 0 | 106.9 | ||||
| 3 | L | 68.6 | Low | 63.2 | Low | 160 Ų | 160 | 153.2 Ų | 153.2 | 84% | 0.838 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -77.9 | 128.1 | 171.9 | -69.4 | 167.5 | 0 | 0 | 0 | 107.6 | M1 | M1-L3 PolarHBondContact O-N 2.71Š|
| 4 | E | 69.4 | Low | 62.8 | Low | 178 Ų | 178 | 151.5 Ų | 151.5 | 83% | 0.832 | 81% | 0.812 | S | S | * | * | P | Polyproline II helix | trans | -53.3 | 144.8 | 172.2 | -89.9 | 164.5 | 127.8 | 0 | 0 | 111.1 | ||
| 5 | P | 74.4 | Confident | 62.6 | Low | 115 Ų | 115 | 157.7 Ų | 157.7 | 75% | 0.747 | 82% | 0.819 | S | S | * | * | P | Polyproline II helix | trans | -62 | 134.1 | -176.1 | 24.1 | -32.3 | 0 | 0 | 0 | 110.3 | K7 | P5-K7 PolarHBondContact O-N 3.01Š|
| 6 | P | 71.2 | Confident | 62.4 | Low | 123 Ų | 123 | 155.9 Ų | 155.9 | 80% | 0.799 | 82% | 0.817 | S | S | * | * | P | Polyproline II helix | trans | -62.6 | 134.2 | 179.2 | 25.5 | -32.9 | 0 | 0 | 0 | 109.9 | A8 | P6-A8 PolarHBondContact O-N 2.85Š|
| 7 | K | 64.9 | Low | 62.4 | Low | 193 Ų | 193 | 155.1 Ų | 155.1 | 84% | 0.839 | 82% | 0.82 | S | S | * | * | trans | -64.6 | 103.2 | 174.3 | -68.6 | -178.6 | -179.7 | 173.6 | 0 | 108.9 | P5 E9 | P5-K7 PolarHBondContact O-N 3.01Å; K7-E9 PolarHBondContact O-N 2.76Å | ||
| 8 | A | 65.4 | Low | 62.5 | Low | 102 Ų | 102 | 150.9 Ų | 150.9 | 84% | 0.843 | 82% | 0.82 | S | S | * | * | trans | -76.4 | -5.5 | 179.2 | 0 | 0 | 0 | 0 | 0 | 113.8 | P6 | P6-A8 PolarHBondContact O-N 2.85Š| ||
| 9 | E | 63.2 | Low | 62.8 | Low | 138 Ų | 138 | 145.8 Ų | 145.8 | 65% | 0.645 | 81% | 0.806 | S | S | * | * | trans | -101.5 | 100.2 | 177.4 | -74.5 | -166.8 | -170.7 | 0 | 0 | 111.3 | K7 R11 | K7-E9 PolarHBondContact O-N 2.76Å; E9-R11 IonicContact OE2-CZ 3.64Å; E9-R11 IonicContact OE2-NE 3.13Å; E9-R11 PolarHBondContact OE2-NE 2.67Å; E9-R11 VanDerWaalsContact OE2-NE 3.13Å; E9-R11 IonicContact OE2-NH2 3.26Å; E9-R11 PolarHBondContact OE2-NH2 2.99Å | ||
| 10 | F | 61.1 | Low | 62.9 | Low | 184 Ų | 184 | 145.8 Ų | 145.8 | 81% | 0.807 | 81% | 0.813 | S | S | * | * | trans | -88.6 | 95.2 | 158.7 | -94.7 | -91.7 | 0 | 0 | 0 | 108.9 | S12 | F10-S12 PolarHBondContact O-N 3.42Š| ||
| 11 | R | 62.1 | Low | 62.9 | Low | 213 Ų | 213 | 144.8 Ų | 144.8 | 80% | 0.804 | 81% | 0.81 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79 | 60.1 | 170 | -68.7 | -173.5 | -174.4 | -166.6 | -1.3 | 111.4 | E9 | E9-R11 IonicContact OE2-CZ 3.64Å; E9-R11 IonicContact OE2-NE 3.13Å; E9-R11 PolarHBondContact OE2-NE 2.67Å; E9-R11 VanDerWaalsContact OE2-NE 3.13Å; E9-R11 IonicContact OE2-NH2 3.26Å; E9-R11 PolarHBondContact OE2-NH2 2.99Å |
| 12 | S | 60.9 | Low | 63.7 | Low | 110 Ų | 110 | 138.9 Ų | 138.9 | 77% | 0.769 | 79% | 0.787 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -146.9 | 30.2 | 161.5 | -60.8 | 0 | 0 | 0 | 0 | 110.8 | F10 T14 | F10-S12 PolarHBondContact O-N 3.42Å; S12-T14 PolarHBondContact O-N 3.11Å |
| 13 | A | 55.1 | Low | 64.1 | Low | 70 Ų | 70 | 136.8 Ų | 136.8 | 58% | 0.579 | 78% | 0.783 | S | S | * | * | trans | -82.4 | 96.7 | 173.8 | 0 | 0 | 0 | 0 | 0 | 109.2 | R15 | A13-R15 PolarHBondContact O-N 3.37Å; A13-R15 VanDerWaalsContact O-N 3.09Å | ||
| 14 | T | 58.5 | Low | 64.1 | Low | 130 Ų | 130 | 139.4 Ų | 139.4 | 80% | 0.798 | 78% | 0.782 | S | S | * | * | trans | -49.3 | 118.2 | 150.6 | -62.2 | 0 | 0 | 0 | 0 | 106 | S12 V16 | S12-T14 PolarHBondContact O-N 3.11Å; T14-V16 PolarHBondContact O-N 3.34Å | ||
| 15 | R | 59 | Low | 63.9 | Low | 244 Ų | 244 | 140.7 Ų | 140.7 | 92% | 0.921 | 79% | 0.785 | S | S | * | * | S | Bend | trans | -55.7 | 92.1 | -168.4 | -72.6 | 178.4 | 174.6 | 164.3 | -2.1 | 111.9 | A13 | A13-R15 PolarHBondContact O-N 3.37Å; A13-R15 VanDerWaalsContact O-N 3.09Å |
| 16 | V | 60.2 | Low | 63.6 | Low | 130 Ų | 130 | 137.9 Ų | 137.9 | 79% | 0.788 | 78% | 0.777 | S | S | * | * | trans | -132.6 | 53 | 165.9 | -165.7 | 0 | 0 | 0 | 0 | 108.6 | T14 | T14-V16 PolarHBondContact O-N 3.34Š| ||
| 17 | V | 62.3 | Low | 63.7 | Low | 142 Ų | 142 | 137.7 Ų | 137.7 | 86% | 0.861 | 78% | 0.775 | S | S | * | * | trans | -133.7 | 98.4 | 169.5 | -177 | 0 | 0 | 0 | 0 | 106.3 | ||||
| 18 | G | 63.9 | Low | 64.3 | Low | 80 Ų | 80 | 134.4 Ų | 134.4 | 83% | 0.825 | 77% | 0.773 | S | S | * | * | trans | 145.4 | 25.4 | 176.3 | 0 | 0 | 0 | 0 | 0 | 117.9 | ||||
| 19 | G | 68.2 | Low | 64.7 | Low | 54 Ų | 54 | 138.7 Ų | 138.7 | 56% | 0.557 | 77% | 0.773 | S | S | * | * | S | Bend | trans | -74 | 159 | 162.6 | 0 | 0 | 0 | 0 | 0 | 111.1 | V21 | G19-V21 PolarHBondContact O-N 3.45Š|
| 20 | P | 65.1 | Low | 65.2 | Low | 145 Ų | 145 | 141 Ų | 141 | 94% | 0.942 | 78% | 0.781 | S | S | * | * | trans | -62.7 | 102.8 | 175.9 | 11.2 | -9.7 | 0 | 0 | 0 | 110.2 | ||||
| 21 | V | 62.8 | Low | 65.8 | Low | 124 Ų | 124 | 141 Ų | 141 | 75% | 0.752 | 78% | 0.781 | S | S | * | * | trans | -107.1 | 107.6 | 173.5 | 177.8 | 0 | 0 | 0 | 0 | 107.4 | G19 P23 | G19-V21 PolarHBondContact O-N 3.45Å; V21-P23 WeakPolarHBondContact O-CD 3.48Å | ||
| 22 | T | 65.8 | Low | 66.4 | Low | 108 Ų | 108 | 138.2 Ų | 138.2 | 66% | 0.663 | 78% | 0.777 | S | S | * | * | trans | -74.1 | 124.4 | 164 | 56.2 | 0 | 0 | 0 | 0 | 107.7 | R24 | T22-R24 PolarHBondContact O-N 2.75Š| ||
| 23 | P | 63.7 | Low | 66.9 | Low | 129 Ų | 129 | 140 Ų | 140 | 84% | 0.838 | 77% | 0.767 | S | S | * | * | trans | -69.1 | 78.8 | 174.6 | -14.4 | 29.4 | 0 | 0 | 0 | 109.4 | V21 | V21-P23 WeakPolarHBondContact O-CD 3.48Š| ||
| 24 | R | 69.2 | Low | 67.5 | Low | 216 Ų | 216 | 145.2 Ų | 145.2 | 82% | 0.815 | 78% | 0.78 | S | S | * | * | trans | -66.2 | 142.2 | 160.1 | -67.8 | -162.3 | -71.5 | -155.1 | -1.4 | 106.6 | T22 G26 | T22-R24 PolarHBondContact O-N 2.75Å; R24-G26 PolarHBondContact O-N 3.5Å | ||
| 25 | K | 65.1 | Low | 67.4 | Low | 205 Ų | 205 | 144.5 Ų | 144.5 | 89% | 0.891 | 78% | 0.775 | S | S | * | * | S | Bend | trans | -8.5 | 113 | -177.3 | -72.6 | 177.1 | -179.8 | 174.1 | 0 | 111.4 | ||
| 26 | G | 67.4 | Low | 67.6 | Low | 56 Ų | 56 | 139.8 Ų | 139.8 | 58% | 0.577 | 76% | 0.757 | S | S | * | * | trans | -46.3 | 161.1 | 179.5 | 0 | 0 | 0 | 0 | 0 | 112 | R24 | R24-G26 PolarHBondContact O-N 3.5Š| ||
| 27 | P | 73.6 | Confident | 67.8 | Low | 119 Ų | 119 | 141 Ų | 141 | 77% | 0.773 | 76% | 0.755 | S | S | * | * | S | Bend | trans | -40.3 | 133.2 | -170.1 | -29.5 | 33.4 | 0 | 0 | 0 | 111.4 | K29 | P27-K29 PolarHBondContact O-N 3.02Å; P27-K29 VanDerWaalsContact O-N 3.11Å |
| 28 | P | 77 | Confident | 67.4 | Low | 123 Ų | 123 | 140.5 Ų | 140.5 | 80% | 0.799 | 74% | 0.741 | S | S | * | * | trans | -44.1 | 126.7 | -177.7 | -29 | 34 | 0 | 0 | 0 | 109.6 | F30 | P28-F30 PolarHBondContact O-N 2.77Š| ||
| 29 | K | 74.7 | Confident | 67.2 | Low | 192 Ų | 192 | 145.6 Ų | 145.6 | 84% | 0.835 | 74% | 0.74 | S | S | * | * | trans | -54.6 | 112.8 | -178.6 | -74.3 | -173 | 177.6 | -177.5 | 0 | 107.5 | P27 K31 | P27-K29 PolarHBondContact O-N 3.02Å; P27-K29 VanDerWaalsContact O-N 3.11Å; K29-K31 VanDerWaalsContact C-N 3.33Å; K29-K31 PolarHBondContact O-N 2.99Å | ||
| 30 | F | 73.5 | Confident | 66.6 | Low | 187 Ų | 187 | 145.9 Ų | 145.9 | 82% | 0.82 | 73% | 0.734 | S | S | * | * | trans | -61.3 | 100.6 | 175.5 | -178.8 | -104.9 | 0 | 0 | 0 | 107.3 | P28 Q32 | P28-F30 PolarHBondContact O-N 2.77Å; F30-Q32 HydrophobicContact CE1-CB 4.17Å; F30-Q32 PolarHBondContact O-N 2.99Å | ||
| 31 | K | 74.6 | Confident | 66.3 | Low | 185 Ų | 185 | 147.7 Ų | 147.7 | 80% | 0.804 | 73% | 0.727 | S | S | * | * | trans | -83.9 | 101.1 | 173.3 | -71.6 | -175.7 | -179.8 | -179.5 | 0 | 105.8 | K29 R33 | K29-K31 VanDerWaalsContact C-N 3.33Å; K29-K31 PolarHBondContact O-N 2.99Å; K31-R33 PolarHBondContact O-N 3.36Å | ||
| 32 | Q | 74.5 | Confident | 66.1 | Low | 153 Ų | 153 | 147.3 Ų | 147.3 | 72% | 0.715 | 73% | 0.727 | S | S | * | * | trans | -59 | 106.5 | 166.6 | -177.1 | 177.5 | -8.3 | 0 | 0 | 107.3 | F30 | F30-Q32 HydrophobicContact CE1-CB 4.17Å; F30-Q32 PolarHBondContact O-N 2.99Å | ||
| 33 | R | 70.6 | Confident | 65.6 | Low | 149 Ų | 149 | 146.3 Ų | 146.3 | 56% | 0.562 | 72% | 0.722 | S | S | * | * | trans | -61.8 | 145.1 | 171.8 | -165.8 | 179.7 | -171.4 | 136.5 | 5.3 | 108.1 | K31 T35 P55 | K31-R33 PolarHBondContact O-N 3.36Å; R33-T35 PolarHBondContact O-N 3.46Å; R33-P55 PolarHBondContact NH1-O 3.42Å; R33-P55 VanDerWaalsContact NH2-CG 3.29Å | ||
| 34 | Q | 67.7 | Low | 65.6 | Low | 179 Ų | 179 | 148.4 Ų | 148.4 | 84% | 0.836 | 72% | 0.718 | S | S | * | * | trans | -48.1 | 133.8 | 166.7 | -90.3 | -177.8 | 10.9 | 0 | 0 | 108.9 | R36 | Q34-R36 VanDerWaalsContact C-N 3.27Å; Q34-R36 PolarHBondContact O-N 3.02Å | ||
| 35 | T | 57.2 | Low | 65 | Low | 115 Ų | 115 | 148.9 Ų | 148.9 | 71% | 0.706 | 73% | 0.726 | S | S | * | * | trans | -66.1 | 89.5 | 178 | 51.4 | 0 | 0 | 0 | 0 | 108.2 | R33 Q37 | R33-T35 PolarHBondContact O-N 3.46Å; T35-Q37 VanDerWaalsContact C-N 3.35Å; T35-Q37 PolarHBondContact O-N 3.08Å | ||
| 36 | R | 62.8 | Low | 64.9 | Low | 144 Ų | 144 | 143 Ų | 143 | 54% | 0.543 | 72% | 0.724 | S | S | . | * | trans | -65.2 | 107.4 | 158.6 | -69 | -177.1 | 80 | -139.1 | 12.5 | 104.4 | Q34 F38 D53 | Q34-R36 VanDerWaalsContact C-N 3.27Å; Q34-R36 PolarHBondContact O-N 3.02Å; R36-F38 PolarHBondContact O-N 3.41Å; R36-D53 IonicContact CZ-OD1 3.84Å; R36-D53 PolarHBondContact NH1-O 3.24Å; R36-D53 IonicContact NH1-OD1 3.18Å; R36-D53 PolarHBondContact NH1-OD1 3.37Å; R36-D53 IonicContact NH2-OD1 3.19Å; R36-D53 PolarHBondContact NH2-OD1 3.45Å; R36-D53 IonicContact NH2-OD2 3.34Å | ||
| 37 | Q | 64.8 | Low | 64.3 | Low | 157 Ų | 157 | 144.4 Ų | 144.4 | 73% | 0.734 | 72% | 0.721 | S | S | * | * | trans | -51.3 | 116.5 | 166.8 | -77.7 | 158.6 | 6.5 | 0 | 0 | 106 | T35 K39 | T35-Q37 VanDerWaalsContact C-N 3.35Å; T35-Q37 PolarHBondContact O-N 3.08Å; Q37-K39 PolarHBondContact O-N 3.06Å | ||
| 38 | F | 53 | Low | 63.5 | Low | 130 Ų | 130 | 146.4 Ų | 146.4 | 57% | 0.57 | 72% | 0.72 | S | S | * | * | trans | -58.8 | 95.7 | 171.5 | -179.6 | -116.4 | 0 | 0 | 0 | 106.4 | R36 S40 F50 | R36-F38 PolarHBondContact O-N 3.41Å; F38-S40 VanDerWaalsContact CD1-CB 3.43Å; F38-S40 WeakPolarHBondContact CD1-OG 3.46Å; F38-S40 VanDerWaalsContact CE1-OG 3.25Å; F38-S40 WeakPolarHBondContact CE1-OG 3.29Å; F38-S40 PolarHBondContact O-N 2.88Å; F38-F50 HydrophobicContact CD2-CE1 4.43Å; F38-F50 HydrophobicContact CE1-CE1 4.18Å; F38-F50 HydrophobicContact CE1-CZ 4.06Å; F38-F50 AromaticContact CE2-CD1 3.7Å; F38-F50 HydrophobicContact CE2-CD1 3.7Å; F38-F50 AromaticContact CE2-CE1 3.27Å; F38-F50 HydrophobicContact CE2-CE1 3.27Å; F38-F50 AromaticContact CE2-CZ 3.78Å; F38-F50 HydrophobicContact CE2-CZ 3.78Å; F38-F50 AromaticContact CZ-CD1 3.98Å; F38-F50 HydrophobicContact CZ-CD1 3.98Å; F38-F50 AromaticContact CZ-CE1 3.14Å; F38-F50 HydrophobicContact CZ-CE1 3.14Å; F38-F50 AromaticContact CZ-CE2 3.95Å; F38-F50 HydrophobicContact CZ-CE2 3.95Å; F38-F50 AromaticContact CZ-CZ 3.15Å; F38-F50 HydrophobicContact CZ-CZ 3.15Å | ||
| 39 | K | 59.2 | Low | 62.6 | Low | 187 Ų | 187 | 142.1 Ų | 142.1 | 81% | 0.813 | 70% | 0.698 | S | S | * | * | trans | -79.3 | 61.1 | 177.9 | -71.1 | -174.7 | -177.8 | 179.8 | 0 | 107.7 | Q37 K41 | Q37-K39 PolarHBondContact O-N 3.06Å; K39-K41 PolarHBondContact O-N 2.76Å | ||
| 40 | S | 56.5 | Low | 61.7 | Low | 60 Ų | 60 | 137.8 Ų | 137.8 | 42% | 0.42 | 68% | 0.68 | S | S | . | * | trans | -75.2 | 96.8 | 171.9 | 54.8 | 0 | 0 | 0 | 0 | 108.8 | F38 | F38-S40 VanDerWaalsContact CD1-CB 3.43Å; F38-S40 WeakPolarHBondContact CD1-OG 3.46Å; F38-S40 VanDerWaalsContact CE1-OG 3.25Å; F38-S40 WeakPolarHBondContact CE1-OG 3.29Å; F38-S40 PolarHBondContact O-N 2.88Å | ||
| 41 | K | 58.2 | Low | 61 | Low | 183 Ų | 183 | 131.6 Ų | 131.6 | 80% | 0.796 | 67% | 0.668 | S | S | * | * | P | Polyproline II helix | trans | -68.3 | 142.5 | 145.8 | -67.5 | -179.1 | -179.7 | 179.5 | 0 | 106.7 | K39 | K39-K41 PolarHBondContact O-N 2.76Š|
| 42 | P | 59.6 | Low | 60.1 | Low | 116 Ų | 116 | 130.9 Ų | 130.9 | 75% | 0.753 | 67% | 0.673 | S | S | * | * | P | Polyproline II helix | trans | -51 | 131.2 | 174 | -25.4 | 33.5 | 0 | 0 | 0 | 109.9 | K44 | P42-K44 PolarHBondContact O-N 2.97Š|
| 43 | P | 55.6 | Low | 59.3 | Low | 87 Ų | 87 | 128.9 Ų | 128.9 | 57% | 0.565 | 67% | 0.667 | S | S | * | * | P | Polyproline II helix | trans | -58 | 134.1 | 177.6 | 20.7 | -28.8 | 0 | 0 | 0 | 108.9 | V47 | P43-V47 HydrophobicContact CB-CB 4.35Š|
| 44 | K | 63.5 | Low | 58.5 | Low | 174 Ų | 174 | 124.2 Ų | 124.2 | 76% | 0.757 | 65% | 0.653 | S | S | * | * | P | Polyproline II helix | trans | -61.1 | 144.9 | 176 | -68.6 | -178.9 | 179.7 | 178 | 0 | 108.5 | P42 G46 V47 | P42-K44 PolarHBondContact O-N 2.97Å; K44-G46 PolarHBondContact O-N 2.84Å; K44-V47 HydrophobicContact CB-CG2 4.07Å; K44-V47 WeakPolarHBondContact O-CB 3.48Å; K44-V47 PolarHBondContact O-N 2.9Å |
| 45 | K | 55.5 | Low | 58.1 | Low | 226 Ų | 226 | 117.9 Ų | 117.9 | 98% | 0.983 | 63% | 0.628 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -51.7 | 114.4 | 175.7 | -164 | 176.1 | -176.7 | 180 | 0 | 109 | ||
| 46 | G | 63 | Low | 58.3 | Low | 82 Ų | 82 | 115.3 Ų | 115.3 | 85% | 0.845 | 62% | 0.624 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 105.5 | -5.4 | -175.2 | 0 | 0 | 0 | 0 | 0 | 116.1 | K44 | K44-G46 PolarHBondContact O-N 2.84Š|
| 47 | V | 55.3 | Low | 57.9 | Low | 85 Ų | 85 | 111.6 Ų | 111.6 | 52% | 0.515 | 61% | 0.613 | S | S | . | * | trans | -94.7 | 95.6 | 171.6 | -178 | 0 | 0 | 0 | 0 | 108.3 | P43 K44 | P43-V47 HydrophobicContact CB-CB 4.35Å; K44-V47 HydrophobicContact CB-CG2 4.07Å; K44-V47 WeakPolarHBondContact O-CB 3.48Å; K44-V47 PolarHBondContact O-N 2.9Å | ||
| 48 | Q | 55.9 | Low | 57.8 | Low | 160 Ų | 160 | 111.5 Ų | 111.5 | 75% | 0.748 | 61% | 0.613 | S | S | * | * | trans | -90.8 | 116.4 | 175.2 | -166.2 | 167.6 | 5.3 | 0 | 0 | 108.4 | V66 | Q48-V66 HydrophobicContact CG-CG2 4.23Š| ||
| 49 | G | 59.8 | Low | 57.9 | Low | 33 Ų | 33 | 108.7 Ų | 108.7 | 34% | 0.34 | 62% | 0.621 | S | S | . | * | S | Bend | trans | 107.3 | 141 | 176.3 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||
| 50 | F | 54.8 | Low | 57.7 | Low | 102 Ų | 102 | 103.5 Ų | 103.5 | 45% | 0.447 | 60% | 0.602 | S | S | . | * | trans | -74 | 119.6 | 154.8 | -74.9 | -89.9 | 0 | 0 | 0 | 105.7 | F38 I54 | F38-F50 HydrophobicContact CD2-CE1 4.43Å; F38-F50 HydrophobicContact CE1-CE1 4.18Å; F38-F50 HydrophobicContact CE1-CZ 4.06Å; F38-F50 AromaticContact CE2-CD1 3.7Å; F38-F50 HydrophobicContact CE2-CD1 3.7Å; F38-F50 AromaticContact CE2-CE1 3.27Å; F38-F50 HydrophobicContact CE2-CE1 3.27Å; F38-F50 AromaticContact CE2-CZ 3.78Å; F38-F50 HydrophobicContact CE2-CZ 3.78Å; F38-F50 AromaticContact CZ-CD1 3.98Å; F38-F50 HydrophobicContact CZ-CD1 3.98Å; F38-F50 AromaticContact CZ-CE1 3.14Å; F38-F50 HydrophobicContact CZ-CE1 3.14Å; F38-F50 AromaticContact CZ-CE2 3.95Å; F38-F50 HydrophobicContact CZ-CE2 3.95Å; F38-F50 AromaticContact CZ-CZ 3.15Å; F38-F50 HydrophobicContact CZ-CZ 3.15Å; F50-I54 HydrophobicContact CB-CD1 3.4Å; F50-I54 VanDerWaalsContact CB-CD1 3.4Å; F50-I54 HydrophobicContact CB-CG1 3.91Å; F50-I54 HydrophobicContact CD1-CD1 4.29Å; F50-I54 HydrophobicContact CD2-CD1 4.36Å; F50-I54 HydrophobicContact CG-CD1 3.77Å; F50-I54 HydrophobicContact CG-CG1 4.5Å | ||
| 51 | G | 59.5 | Low | 57.5 | Low | 56 Ų | 56 | 102.7 Ų | 102.7 | 58% | 0.577 | 60% | 0.603 | S | S | * | * | trans | -59 | -175.4 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | D53 I54 | G51-D53 PolarHBondContact O-N 3.27Å; G51-I54 PolarHBondContact O-N 3.37Å | ||
| 52 | D | 55.3 | Low | 57.2 | Low | 171 Ų | 171 | 99.5 Ų | 99.5 | 91% | 0.914 | 60% | 0.599 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -57 | 9.2 | -177.9 | -56.5 | -50.1 | 0 | 0 | 0 | 116.1 | I54 | D52-I54 VanDerWaalsContact C-N 3.34Š|
| 53 | D | 56.7 | Low | 56.7 | Low | 110 Ų | 110 | 100.7 Ų | 100.7 | 59% | 0.588 | 60% | 0.599 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89.7 | 3.9 | -179.2 | -149.8 | -15.6 | 0 | 0 | 0 | 112.7 | R36 G51 P55 | R36-D53 IonicContact CZ-OD1 3.84Å; R36-D53 PolarHBondContact NH1-O 3.24Å; R36-D53 IonicContact NH1-OD1 3.18Å; R36-D53 PolarHBondContact NH1-OD1 3.37Å; R36-D53 IonicContact NH2-OD1 3.19Å; R36-D53 PolarHBondContact NH2-OD1 3.45Å; R36-D53 IonicContact NH2-OD2 3.34Å; G51-D53 PolarHBondContact O-N 3.27Å; D53-P55 VanDerWaalsContact O-CD 3.29Å; D53-P55 WeakPolarHBondContact O-CD 3.37Å |
| 54 | I | 55.4 | Low | 56.4 | Low | 51 Ų | 51 | 101 Ų | 101 | 26% | 0.262 | 60% | 0.595 | S | S | . | * | S | Bend | trans | -90.4 | 109.3 | 165.6 | -62.6 | -174.7 | 0 | 0 | 0 | 108.7 | F50 G51 D52 M57 | F50-I54 HydrophobicContact CB-CD1 3.4Å; F50-I54 VanDerWaalsContact CB-CD1 3.4Å; F50-I54 HydrophobicContact CB-CG1 3.91Å; F50-I54 HydrophobicContact CD1-CD1 4.29Å; F50-I54 HydrophobicContact CD2-CD1 4.36Å; F50-I54 HydrophobicContact CG-CD1 3.77Å; F50-I54 HydrophobicContact CG-CG1 4.5Å; G51-I54 PolarHBondContact O-N 3.37Å; D52-I54 VanDerWaalsContact C-N 3.34Å; I54-M57 HydrophobicContact CB-CB 4.37Å; I54-M57 HydrophobicContact CB-CE 3.74Å; I54-M57 HydrophobicContact CB-SD 4.15Å; I54-M57 HydrophobicContact CD1-CE 3.58Å; I54-M57 HydrophobicContact CD1-SD 4.49Å; I54-M57 HydrophobicContact CG1-CE 4.16Å; I54-M57 HydrophobicContact CG2-CB 4.24Å; I54-M57 HydrophobicContact CG2-CE 3.77Å; I54-M57 HydrophobicContact CG2-CG 4.49Å; I54-M57 HydrophobicContact CG2-SD 3.51Å; I54-M57 VanDerWaalsContact CG2-SD 3.51Å; I54-M57 WeakPolarHBondContact O-CB 3.47Å; I54-M57 PolarHBondContact O-N 3.11Å |
| 55 | P | 59.1 | Low | 55.7 | Low | 47 Ų | 47 | 95.5 Ų | 95.5 | 31% | 0.305 | 58% | 0.576 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -89.7 | 129.3 | -170.7 | 38.5 | -38.1 | 0 | 0 | 0 | 111.1 | R33 D53 | R33-P55 PolarHBondContact NH1-O 3.42Å; R33-P55 VanDerWaalsContact NH2-CG 3.29Å; D53-P55 VanDerWaalsContact O-CD 3.29Å; D53-P55 WeakPolarHBondContact O-CD 3.37Å |
| 56 | G | 60.4 | Low | 55.5 | Low | 61 Ų | 61 | 88.3 Ų | 88.3 | 63% | 0.629 | 55% | 0.551 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 104.6 | 3.3 | -162.8 | 0 | 0 | 0 | 0 | 0 | 113.7 | E58 | G56-E58 PolarHBondContact N-OE1 3.46Å; G56-E58 PolarHBondContact N-OE2 3.28Å |
| 57 | M | 55.4 | Low | 54.9 | Low | 65 Ų | 65 | 89 Ų | 89 | 32% | 0.32 | 53% | 0.534 | S | S | . | . | trans | -116 | 1.8 | 179.5 | -110 | 143.9 | 69.3 | 0 | 0 | 113.4 | I54 G59 L60 T65 | I54-M57 HydrophobicContact CB-CB 4.37Å; I54-M57 HydrophobicContact CB-CE 3.74Å; I54-M57 HydrophobicContact CB-SD 4.15Å; I54-M57 HydrophobicContact CD1-CE 3.58Å; I54-M57 HydrophobicContact CD1-SD 4.49Å; I54-M57 HydrophobicContact CG1-CE 4.16Å; I54-M57 HydrophobicContact CG2-CB 4.24Å; I54-M57 HydrophobicContact CG2-CE 3.77Å; I54-M57 HydrophobicContact CG2-CG 4.49Å; I54-M57 HydrophobicContact CG2-SD 3.51Å; I54-M57 VanDerWaalsContact CG2-SD 3.51Å; I54-M57 WeakPolarHBondContact O-CB 3.47Å; I54-M57 PolarHBondContact O-N 3.11Å; M57-G59 PolarHBondContact O-N 3.13Å; M57-L60 HydrophobicContact CG-CD1 3.77Å; M57-L60 HydrophobicContact CG-CG 4.49Å; M57-L60 PolarHBondContact O-N 3.07Å; M57-L60 VanDerWaalsContact O-N 3.11Å; M57-T65 HydrophobicContact CE-CG2 4.22Å | ||
| 58 | E | 61.4 | Low | 54.9 | Low | 155 Ų | 155 | 86.9 Ų | 86.9 | 72% | 0.724 | 52% | 0.522 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -60.7 | 19.8 | 179.4 | 51.4 | -97.6 | -157.3 | 0 | 0 | 117.2 | G56 | G56-E58 PolarHBondContact N-OE1 3.46Å; G56-E58 PolarHBondContact N-OE2 3.28Å |
| 59 | G | 55.5 | Low | 54.5 | Low | 72 Ų | 72 | 82.1 Ų | 82.1 | 74% | 0.742 | 51% | 0.506 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -151.2 | 3.8 | 174.6 | 0 | 0 | 0 | 0 | 0 | 114.4 | M57 | M57-G59 PolarHBondContact O-N 3.13Š|
| 60 | L | 54.4 | Low | 54 | Low | 78 Ų | 78 | 89.2 Ų | 89.2 | 41% | 0.408 | 52% | 0.522 | S | S | . | . | S | Bend | trans | -99.2 | 94.2 | 176.1 | -56.1 | 179.6 | 0 | 0 | 0 | 105.3 | M57 I64 | M57-L60 HydrophobicContact CG-CD1 3.77Å; M57-L60 HydrophobicContact CG-CG 4.49Å; M57-L60 PolarHBondContact O-N 3.07Å; M57-L60 VanDerWaalsContact O-N 3.11Å; L60-I64 HydrophobicContact CB-CB 3.85Å; L60-I64 HydrophobicContact CB-CD1 3.82Å; L60-I64 HydrophobicContact CB-CG1 4.35Å; L60-I64 HydrophobicContact CB-CG2 3.91Å; L60-I64 HydrophobicContact CD1-CG2 3.94Å; L60-I64 HydrophobicContact CD2-CD1 3.55Å; L60-I64 HydrophobicContact CD2-CG2 4.5Å; L60-I64 HydrophobicContact CG-CD1 4.2Å; L60-I64 HydrophobicContact CG-CG2 4.33Å |
| 61 | G | 53 | Low | 54 | Low | 43 Ų | 43 | 90.1 Ų | 90.1 | 44% | 0.443 | 53% | 0.528 | S | S | . | . | trans | -51.7 | 176.3 | -179 | 0 | 0 | 0 | 0 | 0 | 112.8 | D63 I64 | G61-D63 PolarHBondContact O-N 3.44Å; G61-I64 PolarHBondContact O-N 2.73Å | ||
| 62 | T | 52.7 | Low | 53.6 | Low | 116 Ų | 116 | 89.4 Ų | 89.4 | 71% | 0.712 | 52% | 0.516 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -47.6 | -14.1 | 178.8 | 43.7 | 0 | 0 | 0 | 0 | 115.5 | ||
| 63 | D | 47.8 | Very low | 53.3 | Low | 140 Ų | 140 | 84 Ų | 84 | 75% | 0.749 | 49% | 0.485 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -86.9 | -13 | -173.4 | -39.6 | -23.6 | 0 | 0 | 0 | 112 | G61 | G61-D63 PolarHBondContact O-N 3.44Š|
| 64 | I | 49.5 | Very low | 53.2 | Low | 94 Ų | 94 | 85.5 Ų | 85.5 | 48% | 0.482 | 49% | 0.493 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -109.5 | -15.6 | -179.7 | -60.1 | 176.4 | 0 | 0 | 0 | 111.7 | L60 G61 V66 | L60-I64 HydrophobicContact CB-CB 3.85Å; L60-I64 HydrophobicContact CB-CD1 3.82Å; L60-I64 HydrophobicContact CB-CG1 4.35Å; L60-I64 HydrophobicContact CB-CG2 3.91Å; L60-I64 HydrophobicContact CD1-CG2 3.94Å; L60-I64 HydrophobicContact CD2-CD1 3.55Å; L60-I64 HydrophobicContact CD2-CG2 4.5Å; L60-I64 HydrophobicContact CG-CD1 4.2Å; L60-I64 HydrophobicContact CG-CG2 4.33Å; G61-I64 PolarHBondContact O-N 2.73Å; I64-V66 PolarHBondContact O-N 2.92Å |
| 65 | T | 48.6 | Very low | 53.4 | Low | 59 Ų | 59 | 90.4 Ų | 90.4 | 36% | 0.362 | 51% | 0.514 | S | S | . | . | S | Bend | trans | -85.9 | 5.5 | -176.6 | 56 | 0 | 0 | 0 | 0 | 115.5 | M57 | M57-T65 HydrophobicContact CE-CG2 4.22Š|
| 66 | V | 52.7 | Low | 53.2 | Low | 74 Ų | 74 | 90.5 Ų | 90.5 | 45% | 0.448 | 51% | 0.512 | S | S | . | . | S | Bend | trans | -131.2 | -12.1 | -175.4 | -179.3 | 0 | 0 | 0 | 0 | 115.3 | Q48 I64 | Q48-V66 HydrophobicContact CG-CG2 4.23Å; I64-V66 PolarHBondContact O-N 2.92Å |
| 67 | I | 50.5 | Low | 53.3 | Low | 97 Ų | 97 | 93.8 Ų | 93.8 | 50% | 0.497 | 51% | 0.511 | S | S | . | . | S | Bend | trans | -119 | 107.7 | 170.6 | -42 | 178.4 | 0 | 0 | 0 | 107.3 | P69 E71 A72 | I67-P69 VanDerWaalsContact O-N 3.17Å; I67-E71 HydrophobicContact CG2-CB 4.13Å; I67-A72 HydrophobicContact CB-CB 4.28Å; I67-A72 HydrophobicContact CG2-CB 3.45Å; I67-A72 VanDerWaalsContact CG2-CB 3.45Å; I67-A72 VanDerWaalsContact CG2-N 3.33Å |
| 68 | C | 54.2 | Low | 53.5 | Low | 40 Ų | 40 | 97.4 Ų | 97.4 | 27% | 0.27 | 53% | 0.531 | S | S | . | . | trans | -47 | 128.3 | 165.1 | -60.7 | 0 | 0 | 0 | 0 | 107.3 | W70 E71 A72 | C68-W70 HydrophobicContact CB-CD2 3.63Å; C68-W70 HydrophobicContact CB-CE3 4.25Å; C68-W70 HydrophobicContact CB-CG 3.96Å; C68-W70 HydrophobicContact CB-CH2 4.19Å; C68-W70 HydrophobicContact CB-CZ2 3.56Å; C68-W70 VanDerWaalsContact CB-NE1 3.27Å; C68-W70 PolarHBondContact O-N 3.02Å; C68-W70 WeakPolarHBondContact SG-CZ2 3.17Å; C68-E71 HydrophobicContact CB-CB 3.91Å; C68-E71 HydrophobicContact CB-CG 3.97Å; C68-E71 WeakPolarHBondContact CB-OE2 3.25Å; C68-E71 WeakPolarHBondContact O-CA 3.25Å; C68-E71 WeakPolarHBondContact O-CB 3.38Å; C68-E71 PolarHBondContact O-N 3.25Å; C68-E71 PolarHBondContact SG-OE2 3.36Å; C68-A72 PolarHBondContact O-N 3.46Å | ||
| 69 | P | 48.7 | Very low | 53.6 | Low | 61 Ų | 61 | 95.4 Ų | 95.4 | 40% | 0.396 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -51.7 | -37.1 | -178.9 | -27.2 | 33.1 | 0 | 0 | 0 | 111.1 | I67 E71 A72 F73 | I67-P69 VanDerWaalsContact O-N 3.17Å; P69-E71 PolarHBondContact O-N 2.79Å; P69-A72 PolarHBondContact O-N 2.85Å; P69-F73 WeakPolarHBondContact O-CB 3.03Å; P69-F73 WeakPolarHBondContact O-CD2 3.41Å; P69-F73 PolarHBondContact O-N 2.9Å |
| 70 | W | 48.6 | Very low | 54 | Low | 181 Ų | 181 | 95 Ų | 95 | 69% | 0.686 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -68.8 | -24.2 | 173.9 | 60.9 | 79.1 | 0 | 0 | 0 | 115.4 | C68 N74 | C68-W70 HydrophobicContact CB-CD2 3.63Å; C68-W70 HydrophobicContact CB-CE3 4.25Å; C68-W70 HydrophobicContact CB-CG 3.96Å; C68-W70 HydrophobicContact CB-CH2 4.19Å; C68-W70 HydrophobicContact CB-CZ2 3.56Å; C68-W70 VanDerWaalsContact CB-NE1 3.27Å; C68-W70 PolarHBondContact O-N 3.02Å; C68-W70 WeakPolarHBondContact SG-CZ2 3.17Å; W70-N74 WeakPolarHBondContact O-CA 3.35Å; W70-N74 WeakPolarHBondContact O-CB 3.12Å; W70-N74 PolarHBondContact O-N 2.73Å; W70-N74 VanDerWaalsContact O-N 3.13Å |
| 71 | E | 53.6 | Low | 54.3 | Low | 122 Ų | 122 | 91.9 Ų | 91.9 | 57% | 0.57 | 48% | 0.484 | S | S | * | . | H | α-helix | trans | -80.9 | -35.5 | 171.3 | -80.7 | 177.1 | 137.3 | 0 | 0 | 112.1 | I67 C68 P69 F73 | I67-E71 HydrophobicContact CG2-CB 4.13Å; C68-E71 HydrophobicContact CB-CB 3.91Å; C68-E71 HydrophobicContact CB-CG 3.97Å; C68-E71 WeakPolarHBondContact CB-OE2 3.25Å; C68-E71 WeakPolarHBondContact O-CA 3.25Å; C68-E71 WeakPolarHBondContact O-CB 3.38Å; C68-E71 PolarHBondContact O-N 3.25Å; C68-E71 PolarHBondContact SG-OE2 3.36Å; P69-E71 PolarHBondContact O-N 2.79Å; E71-F73 VanDerWaalsContact C-N 3.26Å; E71-F73 PolarHBondContact O-N 2.9Å |
| 72 | A | 51.1 | Low | 54.8 | Low | 40 Ų | 40 | 92.6 Ų | 92.6 | 33% | 0.331 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -66.5 | -33.2 | 175.2 | 0 | 0 | 0 | 0 | 0 | 111.7 | I67 C68 P69 | I67-A72 HydrophobicContact CB-CB 4.28Å; I67-A72 HydrophobicContact CG2-CB 3.45Å; I67-A72 VanDerWaalsContact CG2-CB 3.45Å; I67-A72 VanDerWaalsContact CG2-N 3.33Å; C68-A72 PolarHBondContact O-N 3.46Å; P69-A72 PolarHBondContact O-N 2.85Å |
| 73 | F | 49.2 | Very low | 55.4 | Low | 59 Ų | 59 | 93.9 Ų | 93.9 | 26% | 0.259 | 48% | 0.483 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -117.2 | 25 | -172.7 | -57.4 | -62.6 | 0 | 0 | 0 | 112.7 | P69 E71 H75 L76 L81 I86 | P69-F73 WeakPolarHBondContact O-CB 3.03Å; P69-F73 WeakPolarHBondContact O-CD2 3.41Å; P69-F73 PolarHBondContact O-N 2.9Å; E71-F73 VanDerWaalsContact C-N 3.26Å; E71-F73 PolarHBondContact O-N 2.9Å; F73-H75 PolarHBondContact O-N 3.3Å; F73-L76 HydrophobicContact CB-CB 4.32Å; F73-L76 HydrophobicContact CB-CD1 4.18Å; F73-L76 HydrophobicContact CD1-CD1 3.51Å; F73-L76 HydrophobicContact CE1-CD1 4.35Å; F73-L76 HydrophobicContact CG-CD1 4.26Å; F73-L76 PolarHBondContact O-N 3.11Å; F73-L81 HydrophobicContact CB-CD1 3.9Å; F73-L81 HydrophobicContact CB-CD2 3.68Å; F73-L81 HydrophobicContact CB-CG 4.28Å; F73-L81 HydrophobicContact CD1-CD2 3.82Å; F73-L81 HydrophobicContact CD2-CD1 4.12Å; F73-L81 HydrophobicContact CD2-CD2 3.43Å; F73-L81 VanDerWaalsContact CD2-CD2 3.43Å; F73-L81 HydrophobicContact CD2-CG 4.43Å; F73-L81 HydrophobicContact CE1-CD2 4.28Å; F73-L81 HydrophobicContact CE2-CD2 3.99Å; F73-L81 HydrophobicContact CG-CD1 4.28Å; F73-L81 HydrophobicContact CG-CD2 3.36Å; F73-L81 HydrophobicContact CG-CG 4.41Å; F73-L81 HydrophobicContact CZ-CD2 4.38Å; F73-I86 HydrophobicContact CE1-CD1 4.34Å; F73-I86 HydrophobicContact CE2-CD1 4.1Å; F73-I86 HydrophobicContact CE2-CG2 3.85Å; F73-I86 HydrophobicContact CZ-CD1 3.75Å; F73-I86 HydrophobicContact CZ-CG2 4.49Å |
| 74 | N | 54.4 | Low | 55.9 | Low | 141 Ų | 141 | 95 Ų | 95 | 75% | 0.754 | 48% | 0.478 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -60.1 | -10.5 | 179.4 | -161.4 | 13.7 | 0 | 0 | 0 | 113.8 | W70 | W70-N74 WeakPolarHBondContact O-CA 3.35Å; W70-N74 WeakPolarHBondContact O-CB 3.12Å; W70-N74 PolarHBondContact O-N 2.73Å; W70-N74 VanDerWaalsContact O-N 3.13Å |
| 75 | H | 60.3 | Low | 56.3 | Low | 154 Ų | 154 | 93.5 Ų | 93.5 | 71% | 0.713 | 49% | 0.486 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -98.4 | -8.1 | 175 | 63.8 | -80.4 | 0 | 0 | 0 | 113.7 | F73 | F73-H75 PolarHBondContact O-N 3.3Š|
| 76 | L | 55.4 | Low | 56.8 | Low | 48 Ų | 48 | 94.6 Ų | 94.6 | 25% | 0.251 | 49% | 0.489 | S | S | . | . | S | Bend | trans | -110.8 | 136 | 178.3 | -71.5 | 138.6 | 0 | 0 | 0 | 108.9 | F73 E80 | F73-L76 HydrophobicContact CB-CB 4.32Å; F73-L76 HydrophobicContact CB-CD1 4.18Å; F73-L76 HydrophobicContact CD1-CD1 3.51Å; F73-L76 HydrophobicContact CE1-CD1 4.35Å; F73-L76 HydrophobicContact CG-CD1 4.26Å; F73-L76 PolarHBondContact O-N 3.11Å; L76-E80 WeakPolarHBondContact CA-OE2 3.4Å; L76-E80 HydrophobicContact CB-CB 4.35Å; L76-E80 WeakPolarHBondContact CB-OE2 3.39Å; L76-E80 HydrophobicContact CD2-CB 3.96Å; L76-E80 HydrophobicContact CD2-CG 4.37Å; L76-E80 VanDerWaalsContact CD2-OE2 3.25Å; L76-E80 WeakPolarHBondContact CD2-OE2 3.39Å |
| 77 | E | 62.3 | Low | 56.9 | Low | 130 Ų | 130 | 97.5 Ų | 97.5 | 61% | 0.607 | 50% | 0.5 | S | S | * | . | trans | -74.8 | 153.8 | 178 | -71 | -157.8 | 169.4 | 0 | 0 | 110.8 | H79 E80 | E77-H79 WeakPolarHBondContact CB-CE1 3.48Å; E77-H79 WeakPolarHBondContact CB-ND1 3.4Å; E77-H79 PolarHBondContact O-N 2.87Å; E77-H79 IonicContact OE2-CE1 2.99Å; E77-H79 PolarHBondContact OE2-CE1 3.3Å; E77-H79 IonicContact OE2-ND1 2.77Å; E77-H79 PolarHBondContact OE2-ND1 2.83Å; E77-E80 PolarHBondContact N-OE2 2.9Å; E77-E80 WeakPolarHBondContact O-CB 3.18Å; E77-E80 PolarHBondContact O-N 3.19Å | ||
| 78 | L | 59.8 | Low | 57.2 | Low | 141 Ų | 141 | 97.5 Ų | 97.5 | 74% | 0.738 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -47.1 | -31.2 | -179.4 | -81.2 | 148.5 | 0 | 0 | 0 | 113.8 | A82 I87 | L78-A82 PolarHBondContact O-N 3.24Å; L78-I87 HydrophobicContact CD2-CD1 4.13Å |
| 79 | H | 62.6 | Low | 57.3 | Low | 113 Ų | 113 | 100.5 Ų | 100.5 | 52% | 0.523 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -71.1 | -28.1 | -179.7 | 70.4 | -96.6 | 0 | 0 | 0 | 113.4 | E77 Q83 | E77-H79 WeakPolarHBondContact CB-CE1 3.48Å; E77-H79 WeakPolarHBondContact CB-ND1 3.4Å; E77-H79 PolarHBondContact O-N 2.87Å; E77-H79 IonicContact OE2-CE1 2.99Å; E77-H79 PolarHBondContact OE2-CE1 3.3Å; E77-H79 IonicContact OE2-ND1 2.77Å; E77-H79 PolarHBondContact OE2-ND1 2.83Å; H79-Q83 PolarHBondContact O-N 2.96Å |
| 80 | E | 63.9 | Low | 57.8 | Low | 64 Ų | 64 | 102.7 Ų | 102.7 | 30% | 0.299 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -77.2 | -32.6 | 179.8 | -60.5 | 177.9 | 115.4 | 0 | 0 | 111.2 | L76 E77 Q83 Y84 | L76-E80 WeakPolarHBondContact CA-OE2 3.4Å; L76-E80 HydrophobicContact CB-CB 4.35Å; L76-E80 WeakPolarHBondContact CB-OE2 3.39Å; L76-E80 HydrophobicContact CD2-CB 3.96Å; L76-E80 HydrophobicContact CD2-CG 4.37Å; L76-E80 VanDerWaalsContact CD2-OE2 3.25Å; L76-E80 WeakPolarHBondContact CD2-OE2 3.39Å; E77-E80 PolarHBondContact N-OE2 2.9Å; E77-E80 WeakPolarHBondContact O-CB 3.18Å; E77-E80 PolarHBondContact O-N 3.19Å; E80-Q83 WeakPolarHBondContact O-CB 3.25Å; E80-Q83 PolarHBondContact O-N 3.18Å; E80-Y84 WeakPolarHBondContact O-CD2 3.41Å; E80-Y84 PolarHBondContact O-N 3.4Å |
| 81 | L | 62.3 | Low | 58.3 | Low | 12 Ų | 12 | 98.1 Ų | 98.1 | 6% | 0.063 | 51% | 0.509 | C | S | . | . | H | α-helix | trans | -69.6 | -36.8 | 176.3 | -61.1 | 178.3 | 0 | 0 | 0 | 112.8 | F73 Q83 Y84 G85 I86 I87 | F73-L81 HydrophobicContact CB-CD1 3.9Å; F73-L81 HydrophobicContact CB-CD2 3.68Å; F73-L81 HydrophobicContact CB-CG 4.28Å; F73-L81 HydrophobicContact CD1-CD2 3.82Å; F73-L81 HydrophobicContact CD2-CD1 4.12Å; F73-L81 HydrophobicContact CD2-CD2 3.43Å; F73-L81 VanDerWaalsContact CD2-CD2 3.43Å; F73-L81 HydrophobicContact CD2-CG 4.43Å; F73-L81 HydrophobicContact CE1-CD2 4.28Å; F73-L81 HydrophobicContact CE2-CD2 3.99Å; F73-L81 HydrophobicContact CG-CD1 4.28Å; F73-L81 HydrophobicContact CG-CD2 3.36Å; F73-L81 HydrophobicContact CG-CG 4.41Å; F73-L81 HydrophobicContact CZ-CD2 4.38Å; L81-Q83 VanDerWaalsContact C-N 3.27Å; L81-Q83 PolarHBondContact O-N 3.09Å; L81-Y84 PolarHBondContact O-N 3.26Å; L81-G85 PolarHBondContact O-N 3.4Å; L81-I86 HydrophobicContact CD2-CD1 4.12Å; L81-I86 PolarHBondContact O-N 2.76Å; L81-I86 VanDerWaalsContact O-N 3.11Å; L81-I87 HydrophobicContact CB-CD1 3.79Å; L81-I87 HydrophobicContact CB-CG1 3.76Å |
| 82 | A | 62.8 | Low | 58.6 | Low | 58 Ų | 58 | 96.6 Ų | 96.6 | 48% | 0.479 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -65.7 | -32.4 | 173.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | L78 Y84 G85 I87 | L78-A82 PolarHBondContact O-N 3.24Å; A82-Y84 VanDerWaalsContact C-N 3.32Å; A82-Y84 PolarHBondContact O-N 3.13Å; A82-G85 PolarHBondContact O-N 3.4Å; A82-I87 HydrophobicContact CB-CG1 4.38Å |
| 83 | Q | 65.7 | Low | 59.1 | Low | 143 Ų | 143 | 100.4 Ų | 100.4 | 67% | 0.668 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -66.1 | -33.4 | 178 | -174.9 | 176.3 | -42.9 | 0 | 0 | 112.6 | H79 E80 L81 | H79-Q83 PolarHBondContact O-N 2.96Å; E80-Q83 WeakPolarHBondContact O-CB 3.25Å; E80-Q83 PolarHBondContact O-N 3.18Å; L81-Q83 VanDerWaalsContact C-N 3.27Å; L81-Q83 PolarHBondContact O-N 3.09Å |
| 84 | Y | 58.3 | Low | 59.9 | Low | 164 Ų | 164 | 103.4 Ų | 103.4 | 64% | 0.643 | 54% | 0.535 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -93.3 | 2.1 | 177.2 | -63.3 | -67.9 | 0 | 0 | 0 | 113.7 | E80 L81 A82 I86 | E80-Y84 WeakPolarHBondContact O-CD2 3.41Å; E80-Y84 PolarHBondContact O-N 3.4Å; L81-Y84 PolarHBondContact O-N 3.26Å; A82-Y84 VanDerWaalsContact C-N 3.32Å; A82-Y84 PolarHBondContact O-N 3.13Å; Y84-I86 PolarHBondContact O-N 2.97Å |
| 85 | G | 56.4 | Low | 60.3 | Low | 63 Ų | 63 | 100.5 Ų | 100.5 | 65% | 0.649 | 52% | 0.519 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 66.5 | 25.2 | 179.3 | 0 | 0 | 0 | 0 | 0 | 114 | L81 A82 | L81-G85 PolarHBondContact O-N 3.4Å; A82-G85 PolarHBondContact O-N 3.4Å |
| 86 | I | 60.2 | Low | 60.3 | Low | 82 Ų | 82 | 96 Ų | 96 | 42% | 0.421 | 50% | 0.502 | S | S | . | . | trans | -78.1 | -29.2 | 176.7 | -62.2 | 172.8 | 0 | 0 | 0 | 110.3 | F73 L81 Y84 | F73-I86 HydrophobicContact CE1-CD1 4.34Å; F73-I86 HydrophobicContact CE2-CD1 4.1Å; F73-I86 HydrophobicContact CE2-CG2 3.85Å; F73-I86 HydrophobicContact CZ-CD1 3.75Å; F73-I86 HydrophobicContact CZ-CG2 4.49Å; L81-I86 HydrophobicContact CD2-CD1 4.12Å; L81-I86 PolarHBondContact O-N 2.76Å; L81-I86 VanDerWaalsContact O-N 3.11Å; Y84-I86 PolarHBondContact O-N 2.97Å | ||
| 87 | I | 53.5 | Low | 60.7 | Low | 134 Ų | 134 | 100.4 Ų | 100.4 | 69% | 0.687 | 53% | 0.525 | S | S | * | . | trans | -129.5 | 0 | 171.3 | 61.2 | 174.2 | 0 | 0 | 0 | 111.1 | L78 L81 A82 | L78-I87 HydrophobicContact CD2-CD1 4.13Å; L81-I87 HydrophobicContact CB-CD1 3.79Å; L81-I87 HydrophobicContact CB-CG1 3.76Å; A82-I87 HydrophobicContact CB-CG1 4.38Å |
Retrieved 87 of 87 residues in 14.9 ms
(Link to these results)