| 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 | 38.1 | Very low | 35.3 | Very low | 233 Ų | 233 | 158.3 Ų | 158.3 | 100% | 1.148 | 82% | 0.818 | S | S | * | * | 0 | 132.3 | 0 | -73.2 | -178.4 | 163 | 0 | 0 | 108.7 | |||||
| 2 | T | 35.8 | Very low | 35 | Very low | 130 Ų | 130 | 164.4 Ų | 164.4 | 80% | 0.798 | 82% | 0.823 | S | S | * | * | trans | 58.1 | 94.7 | 160 | 52.4 | 0 | 0 | 0 | 0 | 118 | ||||
| 3 | F | 29.3 | Very low | 34.6 | Very low | 206 Ų | 206 | 159.2 Ų | 159.2 | 90% | 0.904 | 81% | 0.811 | S | S | * | * | 56.6 | 123.2 | 71.3 | -85.2 | -84.9 | 0 | 0 | 0 | 116.6 | |||||
| 4 | A | 37.4 | Very low | 34.1 | Very low | 83 Ų | 83 | 160.5 Ų | 160.5 | 69% | 0.686 | 82% | 0.82 | S | S | * | * | trans | 146.3 | 102.3 | 135.3 | 0 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 5 | Q | 37.2 | Very low | 34.1 | Very low | 166 Ų | 166 | 160.4 Ų | 160.4 | 78% | 0.776 | 81% | 0.811 | S | S | * | * | 73.3 | 100 | 91.8 | -75.1 | 174.9 | -46.3 | 0 | 0 | 113.2 | |||||
| 6 | I | 37.8 | Very low | 33.7 | Very low | 137 Ų | 137 | 166.3 Ų | 166.3 | 70% | 0.703 | 82% | 0.821 | S | S | * | * | 59.4 | 118.6 | 95.5 | -55.9 | 167.5 | 0 | 0 | 0 | 113.3 | |||||
| 7 | M | 31.8 | Very low | 33.6 | Very low | 155 Ų | 155 | 166.9 Ų | 166.9 | 76% | 0.764 | 82% | 0.818 | S | S | * | * | 172.3 | 129 | 122.6 | -88 | -79.9 | 116.1 | 0 | 0 | 111.8 | |||||
| 8 | D | 31.3 | Very low | 33.2 | Very low | 125 Ų | 125 | 163.6 Ų | 163.6 | 67% | 0.668 | 82% | 0.822 | S | S | * | * | trans | 25.2 | 134.8 | 150.3 | -76.8 | -56.1 | 0 | 0 | 0 | 123 | ||||
| 9 | T | 38.5 | Very low | 33 | Very low | 139 Ų | 139 | 158.7 Ų | 158.7 | 85% | 0.853 | 82% | 0.817 | S | S | * | * | 179 | 117.5 | 103.8 | 31.6 | 0 | 0 | 0 | 0 | 112.2 | H11 | T9-H11 PolarHBondContact O-N 2.74Š| |||
| 10 | H | 33.1 | Very low | 32.7 | Very low | 188 Ų | 188 | 160.9 Ų | 160.9 | 87% | 0.87 | 82% | 0.824 | S | S | * | * | trans | -70.1 | 117 | 168.4 | -99.8 | -98.1 | 0 | 0 | 0 | 110.8 | ||||
| 11 | H | 38.3 | Very low | 32.7 | Very low | 179 Ų | 179 | 158.2 Ų | 158.2 | 83% | 0.829 | 82% | 0.819 | S | S | * | * | trans | -139.9 | 127.3 | 161.3 | -130.3 | -102.5 | 0 | 0 | 0 | 113.7 | T9 | T9-H11 PolarHBondContact O-N 2.74Š| ||
| 12 | R | 31.1 | Very low | 32.2 | Very low | 232 Ų | 232 | 154.8 Ų | 154.8 | 88% | 0.875 | 81% | 0.805 | S | S | * | * | trans | -26 | 135.7 | 173.1 | -70.8 | 167.6 | 162.5 | -158.2 | -0.2 | 116.9 | ||||
| 13 | S | 30 | Very low | 32 | Very low | 96 Ų | 96 | 157.7 Ų | 157.7 | 67% | 0.671 | 81% | 0.807 | S | S | * | * | trans | -160 | 106.3 | 131.6 | -161.4 | 0 | 0 | 0 | 0 | 112.1 | K15 | S13-K15 PolarHBondContact O-N 2.88Š| ||
| 14 | L | 28.2 | Very low | 32 | Very low | 178 Ų | 178 | 155.7 Ų | 155.7 | 93% | 0.932 | 81% | 0.805 | S | S | * | * | trans | -76.1 | 77.3 | 163.4 | -78.3 | 164 | 0 | 0 | 0 | 107.9 | ||||
| 15 | K | 33.8 | Very low | 31.7 | Very low | 159 Ų | 159 | 162 Ų | 162 | 69% | 0.691 | 82% | 0.817 | S | S | * | * | trans | -87.6 | 116.5 | 168 | -104.8 | 179.6 | 177.1 | 177.9 | 0 | 108.9 | S13 F17 | S13-K15 PolarHBondContact O-N 2.88Å; K15-F17 HydrophobicContact CB-CD2 4.13Å; K15-F17 HydrophobicContact CB-CE2 4.12Å; K15-F17 HydrophobicContact CD-CE2 4.07Å; K15-F17 PolarHBondContact O-N 3.41Å | ||
| 16 | W | 27.9 | Very low | 31.6 | Very low | 254 Ų | 254 | 159 Ų | 159 | 96% | 0.962 | 81% | 0.81 | S | S | * | * | trans | -57.9 | 116 | 164.6 | -77.5 | 60.9 | 0 | 0 | 0 | 108.5 | ||||
| 17 | F | 30.9 | Very low | 31.8 | Very low | 177 Ų | 177 | 153.9 Ų | 153.9 | 78% | 0.776 | 79% | 0.786 | S | S | * | * | trans | -119.8 | 115 | 166 | -93.2 | -80.6 | 0 | 0 | 0 | 109.3 | K15 G19 | K15-F17 HydrophobicContact CB-CD2 4.13Å; K15-F17 HydrophobicContact CB-CE2 4.12Å; K15-F17 HydrophobicContact CD-CE2 4.07Å; K15-F17 PolarHBondContact O-N 3.41Å; F17-G19 PolarHBondContact O-N 2.92Å; F17-G19 VanDerWaalsContact O-N 3.15Å | ||
| 18 | A | 26.9 | Very low | 32.4 | Very low | 107 Ų | 107 | 148.5 Ų | 148.5 | 88% | 0.884 | 76% | 0.76 | S | S | * | * | trans | -63.5 | 103.5 | 163.9 | 0 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 19 | G | 28.9 | Very low | 33.2 | Very low | 71 Ų | 71 | 143.3 Ų | 143.3 | 73% | 0.732 | 73% | 0.734 | S | S | * | * | trans | -101.6 | 109.6 | 176.6 | 0 | 0 | 0 | 0 | 0 | 110.5 | F17 | F17-G19 PolarHBondContact O-N 2.92Å; F17-G19 VanDerWaalsContact O-N 3.15Å | ||
| 20 | Q | 27.4 | Very low | 33.5 | Very low | 203 Ų | 203 | 141.2 Ų | 141.2 | 95% | 0.949 | 71% | 0.714 | S | S | * | * | trans | -56.9 | 129.5 | 165.7 | -67.8 | 175.6 | -20.2 | 0 | 0 | 109.7 | ||||
| 21 | S | 32.6 | Very low | 33.6 | Very low | 105 Ų | 105 | 136 Ų | 136 | 73% | 0.734 | 69% | 0.693 | S | S | * | * | trans | -150.3 | 104.7 | 167 | -177.7 | 0 | 0 | 0 | 0 | 109.8 | K23 | S21-K23 PolarHBondContact O-N 2.79Š| ||
| 22 | N | 28.1 | Very low | 33.6 | Very low | 160 Ų | 160 | 132.8 Ų | 132.8 | 86% | 0.856 | 67% | 0.673 | S | S | * | * | trans | -60.9 | 117.7 | 164.4 | -74.7 | -38.7 | 0 | 0 | 0 | 109.2 | ||||
| 23 | K | 31.2 | Very low | 33.5 | Very low | 192 Ų | 192 | 128.1 Ų | 128.1 | 84% | 0.835 | 66% | 0.657 | S | S | * | * | trans | -178.3 | 112 | 152.8 | -99.7 | 153 | -171.2 | -172.4 | 0 | 111.7 | S21 | S21-K23 PolarHBondContact O-N 2.79Š| ||
| 24 | L | 30.3 | Very low | 33.5 | Very low | 163 Ų | 163 | 131.9 Ų | 131.9 | 85% | 0.853 | 66% | 0.661 | S | S | * | * | trans | 47.7 | 98 | 151.8 | -65.5 | 155.8 | 0 | 0 | 0 | 118.2 | V26 | L24-V26 PolarHBondContact O-N 3.18Å; L24-V26 VanDerWaalsContact O-N 3.12Å | ||
| 25 | K | 30.7 | Very low | 33.5 | Very low | 216 Ų | 216 | 134 Ų | 134 | 94% | 0.939 | 66% | 0.658 | S | S | * | * | trans | -72.1 | 94.8 | 175.6 | -76.4 | 174.7 | 177.7 | 170.3 | 0 | 112.2 | ||||
| 26 | V | 35.4 | Very low | 33.1 | Very low | 103 Ų | 103 | 132.3 Ų | 132.3 | 62% | 0.624 | 66% | 0.661 | S | S | * | * | trans | -96.1 | 125.7 | 171.3 | -177.6 | 0 | 0 | 0 | 0 | 109.6 | L24 L313 | L24-V26 PolarHBondContact O-N 3.18Å; L24-V26 VanDerWaalsContact O-N 3.12Å; V26-L313 HydrophobicContact CG1-CD1 3.41Å; V26-L313 VanDerWaalsContact CG1-CD1 3.41Å; V26-L313 HydrophobicContact CG1-CD2 4.05Å; V26-L313 HydrophobicContact CG1-CG 4.31Å | ||
| 27 | S | 41.4 | Very low | 33 | Very low | 30 Ų | 30 | 128.8 Ų | 128.8 | 21% | 0.21 | 65% | 0.652 | C | S | . | * | trans | -114.5 | 132.9 | -165 | 34.7 | 0 | 0 | 0 | 0 | 113.2 | L313 P367 | S27-L313 VanDerWaalsContact O-CD1 3.31Å; S27-L313 WeakPolarHBondContact O-CD1 3.22Å; S27-P367 VanDerWaalsContact CB-CG 3.48Å; S27-P367 WeakPolarHBondContact OG-CA 3.39Å; S27-P367 WeakPolarHBondContact OG-CB 3.29Å; S27-P367 WeakPolarHBondContact OG-CG 3.39Å | ||
| 28 | N | 43.3 | Very low | 33 | Very low | 42 Ų | 42 | 126 Ų | 126 | 23% | 0.225 | 65% | 0.65 | C | S | . | * | trans | -104.6 | 144.6 | -168.3 | 175.2 | -10.3 | 0 | 0 | 0 | 111.2 | Q30 P309 | N28-Q30 PolarHBondContact ND2-OE1 3.33Å; N28-Q30 PolarHBondContact O-N 3.31Å; N28-Q30 WeakPolarHBondContact OD1-CG 3.49Å; N28-P309 PolarHBondContact OD1-O 2.97Å | ||
| 29 | C | 49.1 | Very low | 33.2 | Very low | 16 Ų | 16 | 126.8 Ų | 126.8 | 11% | 0.108 | 64% | 0.639 | C | S | . | * | S | Bend | trans | -69 | 7.2 | -172.1 | -55.8 | 0 | 0 | 0 | 0 | 116.7 | N31 C268 R307 P309 R372 | C29-N31 VanDerWaalsContact C-N 3.35Å; C29-N31 PolarHBondContact O-N 3.09Å; C29-C268 HydrophobicContact CB-CB 4.03Å; C29-C268 WeakPolarHBondContact CB-SG 3.34Å; C29-C268 WeakPolarHBondContact SG-CB 2.92Å; C29-C268 CovalentContact SG-SG 2.06Å; C29-C268 PolarHBondContact SG-SG 3.37Å; C29-R307 PolarHBondContact O-NH2 3.43Å; C29-P309 WeakPolarHBondContact CB-O 3.44Å; C29-P309 PolarHBondContact N-O 3.06Å; C29-P309 VanDerWaalsContact N-O 3.07Å; C29-P309 PolarHBondContact SG-O 3.06Å; C29-R372 PolarHBondContact O-NH1 2.97Å |
| 30 | Q | 44.1 | Very low | 33.1 | Very low | 94 Ų | 94 | 129 Ų | 129 | 44% | 0.439 | 64% | 0.643 | S | S | . | * | trans | -81.7 | 3.6 | -162.4 | -82.1 | 178 | -18.9 | 0 | 0 | 116.4 | N28 R32 P309 | N28-Q30 PolarHBondContact ND2-OE1 3.33Å; N28-Q30 PolarHBondContact O-N 3.31Å; N28-Q30 WeakPolarHBondContact OD1-CG 3.49Å; Q30-R32 PolarHBondContact O-N 3.01Å; Q30-P309 HydrophobicContact CG-CB 3.76Å | ||
| 31 | N | 35.4 | Very low | 33.3 | Very low | 79 Ų | 79 | 123.5 Ų | 123.5 | 42% | 0.422 | 63% | 0.627 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -70.8 | 16.6 | -168.9 | -108.1 | 18.4 | 0 | 0 | 0 | 118.5 | C29 V364 A365 A366 | C29-N31 VanDerWaalsContact C-N 3.35Å; C29-N31 PolarHBondContact O-N 3.09Å; N31-V364 PolarHBondContact OD1-O 3.12Å; N31-A365 WeakPolarHBondContact ND2-CA 3.44Å; N31-A366 PolarHBondContact ND2-N 3.46Å; N31-A366 VanDerWaalsContact ND2-N 3.18Å |
| 32 | R | 38.1 | Very low | 33.3 | Very low | 112 Ų | 112 | 126.7 Ų | 126.7 | 42% | 0.423 | 64% | 0.635 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -101 | 8.6 | -170.9 | -139.6 | -177.2 | -98.4 | 177.1 | -5.2 | 116.1 | Q30 N239 R372 | Q30-R32 PolarHBondContact O-N 3.01Å; R32-N239 PolarHBondContact NH1-OD1 3.19Å; R32-R372 VanDerWaalsContact CZ-NH2 3.27Å; R32-R372 VanDerWaalsContact NE-NH2 3.16Å; R32-R372 VanDerWaalsContact NH2-NH2 3.19Å |
| 33 | Y | 30.3 | Very low | 33.2 | Very low | 134 Ų | 134 | 123.7 Ų | 123.7 | 53% | 0.525 | 63% | 0.625 | S | S | . | * | trans | -137 | 72.7 | 175.7 | -58.3 | -81 | 0 | 0 | 0 | 112.3 | ||||
| 34 | K | 30.3 | Very low | 32.9 | Very low | 174 Ų | 174 | 125.8 Ų | 125.8 | 76% | 0.757 | 63% | 0.628 | S | S | * | * | trans | -111.5 | 111 | 155.4 | -84.9 | -177.3 | 177.2 | 178.4 | 0 | 107 | V36 | K34-V36 PolarHBondContact O-N 3.44Š| ||
| 35 | Y | 28 | Very low | 32.9 | Very low | 224 Ų | 224 | 128.6 Ų | 128.6 | 88% | 0.878 | 63% | 0.627 | S | S | * | * | trans | -61.1 | 109.5 | 165.1 | -68.2 | -88 | 0 | 0 | 0 | 107.2 | K37 | Y35-K37 PolarHBondContact O-N 3.14Š| ||
| 36 | V | 25.7 | Very low | 32.6 | Very low | 122 Ų | 122 | 124.1 Ų | 124.1 | 74% | 0.739 | 62% | 0.62 | S | S | * | * | trans | -75.4 | 115.2 | 169.7 | 178.8 | 0 | 0 | 0 | 0 | 106.4 | K34 V38 | K34-V36 PolarHBondContact O-N 3.44Å; V36-V38 PolarHBondContact O-N 3.31Å | ||
| 37 | K | 24.3 | Very low | 32.4 | Very low | 180 Ų | 180 | 127.1 Ų | 127.1 | 78% | 0.783 | 63% | 0.632 | S | S | * | * | trans | -68.8 | 101.4 | 167 | -175.6 | 179.4 | 179.3 | -176.7 | 0 | 106.8 | Y35 N39 | Y35-K37 PolarHBondContact O-N 3.14Å; K37-N39 PolarHBondContact O-N 3.04Å; K37-N39 VanDerWaalsContact O-N 3.11Å | ||
| 38 | V | 31.3 | Very low | 31.8 | Very low | 120 Ų | 120 | 131 Ų | 131 | 73% | 0.727 | 66% | 0.659 | S | S | * | * | trans | -72.7 | 103.9 | 174.2 | -162.5 | 0 | 0 | 0 | 0 | 106.8 | V36 S40 | V36-V38 PolarHBondContact O-N 3.31Å; V38-S40 VanDerWaalsContact C-N 3.31Å; V38-S40 PolarHBondContact O-N 3.09Å; V38-S40 VanDerWaalsContact O-N 3.07Å | ||
| 39 | N | 30.6 | Very low | 31 | Very low | 123 Ų | 123 | 133.9 Ų | 133.9 | 66% | 0.658 | 68% | 0.682 | S | S | * | * | trans | -74.5 | 92 | 166.3 | -86.1 | 1 | 0 | 0 | 0 | 107.1 | K37 S41 | K37-N39 PolarHBondContact O-N 3.04Å; K37-N39 VanDerWaalsContact O-N 3.11Å; N39-S41 VanDerWaalsContact C-N 3.35Å; N39-S41 PolarHBondContact O-N 3.32Å; N39-S41 VanDerWaalsContact O-N 3.13Å | ||
| 40 | S | 27.6 | Very low | 30 | Very low | 117 Ų | 117 | 138.6 Ų | 138.6 | 82% | 0.818 | 72% | 0.716 | S | S | * | * | trans | -77 | 89.8 | 166.4 | 54.9 | 0 | 0 | 0 | 0 | 108.5 | V38 | V38-S40 VanDerWaalsContact C-N 3.31Å; V38-S40 PolarHBondContact O-N 3.09Å; V38-S40 VanDerWaalsContact O-N 3.07Å | ||
| 41 | S | 30.6 | Very low | 29.3 | Very low | 88 Ų | 88 | 142.8 Ų | 142.8 | 62% | 0.615 | 73% | 0.733 | S | S | * | * | trans | -136.2 | 100.4 | 163.3 | 55 | 0 | 0 | 0 | 0 | 107.2 | N39 | N39-S41 VanDerWaalsContact C-N 3.35Å; N39-S41 PolarHBondContact O-N 3.32Å; N39-S41 VanDerWaalsContact O-N 3.13Å | ||
| 42 | L | 32.5 | Very low | 29.1 | Very low | 172 Ų | 172 | 148 Ų | 148 | 90% | 0.901 | 75% | 0.752 | S | S | * | * | 167.3 | 134.8 | 126 | -84.7 | 159.6 | 0 | 0 | 0 | 109.2 | |||||
| 43 | C | 26.7 | Very low | 28.5 | Very low | 96 Ų | 96 | 154.6 Ų | 154.6 | 65% | 0.649 | 78% | 0.777 | S | S | * | * | trans | -100.6 | 144.4 | -173 | -35.1 | 0 | 0 | 0 | 0 | 107.3 | ||||
| 44 | W | 26.1 | Very low | 28.5 | Very low | 237 Ų | 237 | 154 Ų | 154 | 90% | 0.898 | 78% | 0.782 | S | S | * | * | trans | 74.1 | 135.2 | 164.2 | -41.8 | 105 | 0 | 0 | 0 | 115.3 | ||||
| 45 | R | 29 | Very low | 28.5 | Very low | 221 Ų | 221 | 154.2 Ų | 154.2 | 83% | 0.834 | 78% | 0.783 | S | S | * | * | cis | -149.5 | 163.8 | 12.4 | -73 | -167.5 | 173.7 | -143.4 | -1.4 | 108.9 | ||||
| 46 | P | 25.1 | Very low | 28.6 | Very low | 122 Ų | 122 | 154.9 Ų | 154.9 | 79% | 0.792 | 79% | 0.786 | S | S | * | * | trans | -79.4 | 125.7 | 179.1 | 32.2 | -29.5 | 0 | 0 | 0 | 110.1 | ||||
| 47 | L | 31.5 | Very low | 28.9 | Very low | 167 Ų | 167 | 154.9 Ų | 154.9 | 87% | 0.874 | 79% | 0.787 | S | S | * | * | trans | -122.7 | 108.6 | 155.6 | -122.6 | 86.4 | 0 | 0 | 0 | 108.1 | S49 | L47-S49 PolarHBondContact O-N 3.3Š| ||
| 48 | S | 27.4 | Very low | 28.9 | Very low | 110 Ų | 110 | 152.3 Ų | 152.3 | 77% | 0.769 | 79% | 0.79 | S | S | * | * | trans | -53.2 | 124.2 | 162.7 | 48.4 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 49 | S | 28.4 | Very low | 28.8 | Very low | 103 Ų | 103 | 152.2 Ų | 152.2 | 72% | 0.72 | 80% | 0.795 | S | S | * | * | 179.8 | 129.4 | 127.8 | 46.3 | 0 | 0 | 0 | 0 | 110.6 | L47 | L47-S49 PolarHBondContact O-N 3.3Š| |||
| 50 | S | 27.5 | Very low | 28.7 | Very low | 115 Ų | 115 | 151.3 Ų | 151.3 | 80% | 0.804 | 80% | 0.798 | S | S | * | * | trans | -52.8 | 128.4 | 172.1 | -62.9 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 51 | F | 29.8 | Very low | 28.7 | Very low | 183 Ų | 183 | 153 Ų | 153 | 80% | 0.803 | 80% | 0.797 | S | S | * | * | trans | -141.4 | 135.3 | 147.7 | -87.4 | -74.4 | 0 | 0 | 0 | 112.1 | ||||
| 52 | K | 29.9 | Very low | 28.7 | Very low | 188 Ų | 188 | 155.5 Ų | 155.5 | 82% | 0.817 | 81% | 0.809 | S | S | * | * | trans | -60.4 | 146.1 | -166.8 | -64.9 | 165.9 | 171 | 179.5 | 0 | 112.7 | ||||
| 53 | W | 25.9 | Very low | 28.7 | Very low | 250 Ų | 250 | 151.2 Ų | 151.2 | 95% | 0.947 | 81% | 0.806 | S | S | * | * | trans | -102.5 | 106.6 | 166.8 | -34.2 | -31.6 | 0 | 0 | 0 | 106.5 | ||||
| 54 | D | 30.8 | Very low | 28.8 | Very low | 121 Ų | 121 | 150.8 Ų | 150.8 | 65% | 0.647 | 81% | 0.809 | S | S | * | * | trans | -113.3 | 122.9 | 163.8 | -94.8 | -47.3 | 0 | 0 | 0 | 110.1 | ||||
| 55 | K | 29.3 | Very low | 29.2 | Very low | 179 Ų | 179 | 148.2 Ų | 148.2 | 78% | 0.778 | 81% | 0.807 | S | S | * | * | trans | 20.4 | 116.2 | 148.5 | -63 | 171.6 | -176.6 | 173.1 | 0 | 118.2 | ||||
| 56 | Y | 31.2 | Very low | 29.1 | Very low | 238 Ų | 238 | 142.1 Ų | 142.1 | 93% | 0.933 | 80% | 0.798 | S | S | * | * | trans | -108.9 | 97.6 | 147.3 | -77.9 | -77.9 | 0 | 0 | 0 | 109.9 | ||||
| 57 | T | 31.2 | Very low | 29.4 | Very low | 123 Ų | 123 | 144.2 Ų | 144.2 | 76% | 0.755 | 80% | 0.795 | S | S | * | * | trans | -76.3 | 133.1 | 152.7 | 29.5 | 0 | 0 | 0 | 0 | 109.2 | S59 | T57-S59 PolarHBondContact O-N 3.45Š| ||
| 58 | C | 24.8 | Very low | 29.3 | Very low | 125 Ų | 125 | 143.8 Ų | 143.8 | 85% | 0.845 | 79% | 0.786 | S | S | * | * | trans | -55.1 | 123.5 | 165.1 | -168.3 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 59 | S | 29.4 | Very low | 29.4 | Very low | 119 Ų | 119 | 146.7 Ų | 146.7 | 83% | 0.832 | 79% | 0.787 | S | S | * | * | trans | -164.6 | 137.1 | 154.4 | -78.1 | 0 | 0 | 0 | 0 | 110.8 | T57 | T57-S59 PolarHBondContact O-N 3.45Š| ||
| 60 | S | 28.3 | Very low | 29.5 | Very low | 103 Ų | 103 | 147.3 Ų | 147.3 | 72% | 0.72 | 79% | 0.791 | S | S | * | * | trans | -69.3 | 155.2 | -175.1 | -46.2 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 61 | L | 28.3 | Very low | 29.6 | Very low | 154 Ų | 154 | 147.5 Ų | 147.5 | 81% | 0.806 | 79% | 0.793 | S | S | * | * | trans | 66.6 | 117.7 | 145 | -69.3 | 154.8 | 0 | 0 | 0 | 119.9 | ||||
| 62 | T | 30.9 | Very low | 29.8 | Very low | 140 Ų | 140 | 144.4 Ų | 144.4 | 86% | 0.859 | 79% | 0.794 | S | S | * | * | trans | 72.6 | 134.8 | 142 | 62.7 | 0 | 0 | 0 | 0 | 120.6 | ||||
| 63 | G | 31.1 | Very low | 29.7 | Very low | 82 Ų | 82 | 140.5 Ų | 140.5 | 85% | 0.845 | 79% | 0.79 | S | S | * | * | trans | 121.6 | 110.3 | 153.3 | 0 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 64 | A | 28.6 | Very low | 30 | Very low | 87 Ų | 87 | 136.7 Ų | 136.7 | 72% | 0.719 | 79% | 0.787 | S | S | * | * | trans | -81.3 | 149.1 | -175.5 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 65 | H | 34.2 | Very low | 29.7 | Very low | 183 Ų | 183 | 139.7 Ų | 139.7 | 85% | 0.847 | 79% | 0.79 | S | S | * | * | 161.8 | 138.2 | 115.9 | -97.6 | -92.1 | 0 | 0 | 0 | 112.7 | |||||
| 66 | S | 28.5 | Very low | 29.8 | Very low | 92 Ų | 92 | 137 Ų | 137 | 64% | 0.643 | 79% | 0.794 | S | S | * | * | trans | -70.9 | 158.5 | -178.4 | -55.3 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 67 | F | 29.6 | Very low | 29.5 | Very low | 166 Ų | 166 | 135.5 Ų | 135.5 | 73% | 0.728 | 79% | 0.787 | S | S | * | * | 161.6 | 116.8 | 112 | -91.7 | -84.9 | 0 | 0 | 0 | 114.1 | |||||
| 68 | K | 30.3 | Very low | 29.4 | Very low | 159 Ų | 159 | 139.9 Ų | 139.9 | 69% | 0.691 | 80% | 0.796 | S | S | * | * | trans | 64.4 | 122.9 | 132.3 | -69.1 | -175.4 | -175.6 | 167 | 0 | 125.3 | ||||
| 69 | H | 29.3 | Very low | 29.4 | Very low | 170 Ų | 170 | 142 Ų | 142 | 79% | 0.787 | 80% | 0.799 | S | S | * | * | trans | 54.1 | 148.8 | 132.2 | -61.6 | -69.8 | 0 | 0 | 0 | 120.1 | ||||
| 70 | S | 30.4 | Very low | 29.3 | Very low | 116 Ų | 116 | 139.7 Ų | 139.7 | 81% | 0.811 | 79% | 0.794 | S | S | * | * | cis | -169.3 | 174.2 | 24.6 | 10.2 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 71 | S | 29.5 | Very low | 29.2 | Very low | 119 Ų | 119 | 140.6 Ų | 140.6 | 83% | 0.832 | 80% | 0.8 | S | S | * | * | trans | -106.6 | 162.4 | -162.1 | -27.9 | 0 | 0 | 0 | 0 | 115.5 | ||||
| 72 | S | 33.8 | Very low | 29.1 | Very low | 119 Ų | 119 | 141.7 Ų | 141.7 | 83% | 0.832 | 80% | 0.801 | S | S | * | * | trans | -173.9 | 111.3 | 148.6 | 26.4 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 73 | S | 28.6 | Very low | 28.8 | Very low | 105 Ų | 105 | 140.8 Ų | 140.8 | 73% | 0.734 | 80% | 0.796 | S | S | * | * | 69.9 | 118 | 77.3 | 172.2 | 0 | 0 | 0 | 0 | 114.6 | |||||
| 74 | I | 31.5 | Very low | 28.5 | Very low | 171 Ų | 171 | 146.5 Ų | 146.5 | 88% | 0.877 | 79% | 0.793 | S | S | * | * | -166.7 | 139.6 | 128.2 | -89.1 | 148.1 | 0 | 0 | 0 | 110.3 | |||||
| 75 | Y | 24.2 | Very low | 28.4 | Very low | 183 Ų | 183 | 148.9 Ų | 148.9 | 72% | 0.718 | 79% | 0.794 | S | S | * | * | trans | -82.3 | 153.1 | -176 | -110.8 | -103.7 | 0 | 0 | 0 | 113.4 | R77 | Y75-R77 HydrophobicContact CD1-CG 4.14Å; Y75-R77 HydrophobicContact CE1-CG 4.25Å | ||
| 76 | S | 31.1 | Very low | 27.9 | Very low | 124 Ų | 124 | 147 Ų | 147 | 87% | 0.867 | 80% | 0.796 | S | S | * | * | trans | -157.3 | 134.5 | 134.8 | 47 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 77 | R | 25 | Very low | 28 | Very low | 205 Ų | 205 | 149 Ų | 149 | 77% | 0.774 | 80% | 0.804 | S | S | * | * | trans | -92.5 | 146.5 | -176.3 | -62.3 | 175.4 | -175.4 | 169.6 | 0.7 | 109.8 | Y75 | Y75-R77 HydrophobicContact CD1-CG 4.14Å; Y75-R77 HydrophobicContact CE1-CG 4.25Å | ||
| 78 | F | 29 | Very low | 28.1 | Very low | 216 Ų | 216 | 148.4 Ų | 148.4 | 95% | 0.947 | 81% | 0.807 | S | S | * | * | trans | -148.4 | 133.6 | 144.2 | -114 | -83.7 | 0 | 0 | 0 | 111.8 | ||||
| 79 | N | 26.4 | Very low | 27.9 | Very low | 168 Ų | 168 | 144.4 Ų | 144.4 | 90% | 0.898 | 81% | 0.81 | S | S | * | * | trans | -72.9 | 151.9 | -179.7 | -88.4 | -23.9 | 0 | 0 | 0 | 112.3 | ||||
| 80 | G | 26.6 | Very low | 28 | Very low | 71 Ų | 71 | 147.2 Ų | 147.2 | 73% | 0.732 | 81% | 0.814 | S | S | * | * | trans | 167.1 | 80.7 | 163.8 | 0 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 81 | S | 27 | Very low | 27.8 | Very low | 123 Ų | 123 | 149.7 Ų | 149.7 | 86% | 0.86 | 82% | 0.818 | S | S | * | * | trans | 35.2 | 106.2 | 145 | -48.9 | 0 | 0 | 0 | 0 | 120.5 | ||||
| 82 | Q | 24.7 | Very low | 27.9 | Very low | 177 Ų | 177 | 153.6 Ų | 153.6 | 83% | 0.827 | 82% | 0.815 | S | S | * | * | trans | -89.1 | 118.2 | 163.2 | -69.6 | 178.7 | 12.8 | 0 | 0 | 111 | ||||
| 83 | T | 25.8 | Very low | 27.5 | Very low | 121 Ų | 121 | 153.7 Ų | 153.7 | 74% | 0.742 | 81% | 0.813 | S | S | * | * | trans | -109.2 | 119.7 | 161.9 | 51.7 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 84 | Y | 24 | Very low | 27.5 | Very low | 201 Ų | 201 | 155.6 Ų | 155.6 | 79% | 0.788 | 81% | 0.805 | S | S | * | * | trans | -90.6 | 109.8 | 175.7 | 18.2 | -91.5 | 0 | 0 | 0 | 109.7 | ||||
| 85 | N | 26.1 | Very low | 27.3 | Very low | 137 Ų | 137 | 154.7 Ų | 154.7 | 73% | 0.733 | 80% | 0.802 | S | S | * | * | trans | -106.1 | 110.2 | 171.4 | -76.2 | -23.7 | 0 | 0 | 0 | 110.2 | T87 | N85-T87 PolarHBondContact O-N 2.64Š| ||
| 86 | T | 23.9 | Very low | 27.4 | Very low | 145 Ų | 145 | 156.2 Ų | 156.2 | 89% | 0.89 | 81% | 0.808 | S | S | * | * | trans | -75.6 | 102.6 | 164.6 | 29 | 0 | 0 | 0 | 0 | 108 | ||||
| 87 | T | 31.1 | Very low | 27.2 | Very low | 133 Ų | 133 | 157.6 Ų | 157.6 | 82% | 0.816 | 80% | 0.804 | S | S | * | * | trans | -98.6 | 103.3 | 176.2 | 35.7 | 0 | 0 | 0 | 0 | 110.8 | N85 | N85-T87 PolarHBondContact O-N 2.64Š| ||
| 88 | I | 31.3 | Very low | 27.2 | Very low | 154 Ų | 154 | 159 Ų | 159 | 79% | 0.79 | 81% | 0.809 | S | S | * | * | trans | -49 | 140.8 | 155.5 | -67.7 | 162.3 | 0 | 0 | 0 | 108.8 | R90 | I88-R90 PolarHBondContact O-N 3.41Š| ||
| 89 | G | 26 | Very low | 27.1 | Very low | 74 Ų | 74 | 157.6 Ų | 157.6 | 76% | 0.763 | 80% | 0.802 | S | S | * | * | trans | -44.7 | 131.9 | -176.1 | 0 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 90 | R | 31.2 | Very low | 27 | Very low | 230 Ų | 230 | 154.4 Ų | 154.4 | 87% | 0.868 | 79% | 0.793 | S | S | * | * | trans | -134.2 | 125.8 | 164.6 | -71.9 | -172 | -179.9 | -179.8 | -0.5 | 108 | I88 R92 | I88-R90 PolarHBondContact O-N 3.41Å; R90-R92 PolarHBondContact O-N 2.98Å | ||
| 91 | D | 27.9 | Very low | 27.2 | Very low | 168 Ų | 168 | 157.2 Ų | 157.2 | 90% | 0.898 | 79% | 0.792 | S | S | * | * | trans | -43.1 | 125.6 | 167.7 | -65.5 | -62 | 0 | 0 | 0 | 110.5 | ||||
| 92 | R | 30.2 | Very low | 27.4 | Very low | 200 Ų | 200 | 160.1 Ų | 160.1 | 76% | 0.755 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -99 | 120 | 168.5 | -84.4 | -174.8 | 176.3 | -171.1 | -1.5 | 108.5 | R90 Y94 | R90-R92 PolarHBondContact O-N 2.98Å; R92-Y94 HydrophobicContact CB-CE2 4.28Å |
| 93 | P | 25.6 | Very low | 27.4 | Very low | 121 Ų | 121 | 155 Ų | 155 | 79% | 0.786 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -75 | 126.6 | 169.6 | 31.2 | -29.1 | 0 | 0 | 0 | 108 | ||
| 94 | Y | 28.1 | Very low | 27.7 | Very low | 145 Ų | 145 | 156.9 Ų | 156.9 | 57% | 0.569 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -101.1 | 117.6 | 168.4 | -78.5 | -80.6 | 0 | 0 | 0 | 109.1 | R92 | R92-Y94 HydrophobicContact CB-CE2 4.28Š|
| 95 | N | 27.4 | Very low | 27.7 | Very low | 153 Ų | 153 | 155.4 Ų | 155.4 | 82% | 0.818 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -75.2 | 124.9 | 164.1 | -69.1 | -28.5 | 0 | 0 | 0 | 108.2 | I97 | N95-I97 PolarHBondContact O-N 2.93Š|
| 96 | Y | 27.2 | Very low | 28 | Very low | 214 Ų | 214 | 157.7 Ų | 157.7 | 84% | 0.839 | 80% | 0.798 | S | S | * | * | trans | -76.7 | 115.2 | 170.3 | -68.8 | -84.2 | 0 | 0 | 0 | 109 | ||||
| 97 | I | 26.4 | Very low | 28.3 | Very low | 153 Ų | 153 | 159 Ų | 159 | 79% | 0.785 | 80% | 0.799 | S | S | * | * | trans | -86.9 | 109 | 160 | -62.4 | 173.9 | 0 | 0 | 0 | 106.2 | N95 K99 | N95-I97 PolarHBondContact O-N 2.93Å; I97-K99 HydrophobicContact CG2-CG 4.45Å | ||
| 98 | R | 24.6 | Very low | 27.9 | Very low | 234 Ų | 234 | 160.8 Ų | 160.8 | 88% | 0.883 | 80% | 0.802 | S | S | * | * | trans | -85.5 | 105.9 | 170.2 | -154.1 | -176.7 | -142.3 | -176.4 | 4.4 | 106.4 | ||||
| 99 | K | 28.1 | Very low | 27.8 | Very low | 187 Ų | 187 | 161.1 Ų | 161.1 | 81% | 0.813 | 80% | 0.804 | S | S | * | * | trans | -79.5 | 115.5 | 162.4 | -74.2 | -170.8 | 174.5 | -171.1 | 0 | 107.4 | I97 | I97-K99 HydrophobicContact CG2-CG 4.45Š| ||
| 100 | S | 24.5 | Very low | 27.8 | Very low | 101 Ų | 101 | 163.3 Ų | 163.3 | 71% | 0.706 | 81% | 0.805 | S | S | * | * | trans | -101.5 | 114.6 | 170.8 | 47.3 | 0 | 0 | 0 | 0 | 107.2 | ||||
| 101 | D | 30.2 | Very low | 28 | Very low | 130 Ų | 130 | 158.8 Ų | 158.8 | 70% | 0.695 | 80% | 0.802 | S | S | * | * | trans | -130.5 | 132.9 | 164.6 | -70.7 | -47.7 | 0 | 0 | 0 | 109 | ||||
| 102 | H | 30.2 | Very low | 28.1 | Very low | 184 Ų | 184 | 156.5 Ų | 156.5 | 85% | 0.852 | 80% | 0.797 | S | S | * | * | trans | 84.6 | 117.9 | 169.8 | -56.2 | -62.7 | 0 | 0 | 0 | 118.5 | ||||
| 103 | G | 26.1 | Very low | 27.9 | Very low | 69 Ų | 69 | 150.7 Ų | 150.7 | 71% | 0.711 | 80% | 0.799 | S | S | * | * | trans | -80.2 | 154.3 | -176.6 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 104 | D | 30.7 | Very low | 28.2 | Very low | 161 Ų | 161 | 152.8 Ų | 152.8 | 86% | 0.861 | 80% | 0.802 | S | S | * | * | -158.7 | 145.5 | 127.8 | -110.4 | -27.5 | 0 | 0 | 0 | 109.3 | |||||
| 105 | Q | 25.5 | Very low | 28.3 | Very low | 170 Ų | 170 | 151.6 Ų | 151.6 | 79% | 0.794 | 81% | 0.812 | S | S | * | * | trans | -70.9 | 138 | -166.2 | -58.5 | 164 | 16.4 | 0 | 0 | 111.6 | ||||
| 106 | Q | 32.5 | Very low | 28.2 | Very low | 186 Ų | 186 | 153.5 Ų | 153.5 | 87% | 0.869 | 82% | 0.816 | S | S | * | * | trans | -177.1 | 113.3 | 137.7 | -99.6 | 156.8 | 72.5 | 0 | 0 | 113.6 | ||||
| 107 | L | 29.5 | Very low | 28.5 | Very low | 173 Ų | 173 | 152.2 Ų | 152.2 | 91% | 0.906 | 82% | 0.817 | S | S | * | * | trans | 51.8 | 117.1 | 143.6 | -67.1 | 162.4 | 0 | 0 | 0 | 121.2 | ||||
| 108 | L | 22.8 | Very low | 28.8 | Very low | 170 Ų | 170 | 153.5 Ų | 153.5 | 89% | 0.89 | 82% | 0.817 | S | S | * | * | trans | -76.6 | 139.2 | 177.6 | -64.7 | 163.2 | 0 | 0 | 0 | 113.1 | ||||
| 109 | I | 29.5 | Very low | 28.9 | Very low | 160 Ų | 160 | 150 Ų | 150 | 82% | 0.821 | 82% | 0.816 | S | S | * | * | trans | -140.9 | 119.6 | 150.3 | -54.1 | 178.1 | 0 | 0 | 0 | 108.1 | ||||
| 110 | P | 25.3 | Very low | 29 | Very low | 120 Ų | 120 | 150.9 Ų | 150.9 | 78% | 0.779 | 82% | 0.82 | S | S | * | * | trans | -94.2 | 143.5 | 174.9 | 33.8 | -28.4 | 0 | 0 | 0 | 111.9 | ||||
| 111 | V | 35.3 | Very low | 29.1 | Very low | 135 Ų | 135 | 154 Ų | 154 | 82% | 0.818 | 83% | 0.828 | S | S | * | * | trans | -124.3 | 138.7 | 169.9 | 179.9 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 112 | P | 29.5 | Very low | 28.9 | Very low | 121 Ų | 121 | 155.7 Ų | 155.7 | 79% | 0.786 | 84% | 0.836 | S | S | * | * | trans | -85.9 | 159.5 | -159.7 | -4.7 | 25.2 | 0 | 0 | 0 | 114.4 | ||||
| 113 | G | 26.6 | Very low | 28.5 | Very low | 78 Ų | 78 | 152.1 Ų | 152.1 | 80% | 0.804 | 83% | 0.832 | S | S | * | * | trans | -76.2 | 162 | 179.1 | 0 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 114 | I | 32.8 | Very low | 28.7 | Very low | 165 Ų | 165 | 154.1 Ų | 154.1 | 85% | 0.846 | 84% | 0.835 | S | S | * | * | trans | -130.4 | 142.7 | 169.8 | -66.8 | 179.7 | 0 | 0 | 0 | 108.5 | ||||
| 115 | P | 29 | Very low | 28.3 | Very low | 120 Ų | 120 | 155.3 Ų | 155.3 | 78% | 0.779 | 84% | 0.835 | S | S | * | * | trans | -96.2 | 168.3 | -147.3 | -2.7 | 24 | 0 | 0 | 0 | 116.1 | ||||
| 116 | Q | 26.9 | Very low | 28.6 | Very low | 193 Ų | 193 | 155 Ų | 155 | 90% | 0.902 | 84% | 0.837 | S | S | * | * | trans | -62.2 | 139.7 | 169.7 | -61.4 | -176.4 | -13.3 | 0 | 0 | 112.5 | ||||
| 117 | H | 33.3 | Very low | 28.5 | Very low | 186 Ų | 186 | 151.5 Ų | 151.5 | 86% | 0.861 | 83% | 0.833 | S | S | * | * | trans | -118.7 | 133.5 | 167.2 | -154.8 | -81.5 | 0 | 0 | 0 | 111.1 | ||||
| 118 | K | 31.9 | Very low | 28.4 | Very low | 180 Ų | 180 | 149.5 Ų | 149.5 | 78% | 0.783 | 83% | 0.834 | S | S | * | * | trans | -84.7 | 160.6 | -172.4 | -62.8 | 171 | 178.7 | 176.7 | 0 | 112 | ||||
| 119 | D | 26.3 | Very low | 28.7 | Very low | 162 Ų | 162 | 145.1 Ų | 145.1 | 87% | 0.866 | 83% | 0.83 | S | S | * | * | trans | -49.8 | 143 | 175 | -57.1 | -60.6 | 0 | 0 | 0 | 114.4 | ||||
| 120 | K | 30.9 | Very low | 28.5 | Very low | 204 Ų | 204 | 144 Ų | 144 | 89% | 0.887 | 83% | 0.83 | S | S | * | * | trans | -142.1 | 110 | 153.8 | -90.2 | -172.6 | 177.6 | -177.8 | 0 | 109.6 | ||||
| 121 | L | 25.6 | Very low | 28.6 | Very low | 168 Ų | 168 | 145.6 Ų | 145.6 | 88% | 0.88 | 83% | 0.831 | S | S | * | * | trans | -65.5 | 136.8 | 157.2 | -70.6 | 166.3 | 0 | 0 | 0 | 108.6 | ||||
| 122 | L | 26.4 | Very low | 28.4 | Very low | 164 Ų | 164 | 144.3 Ų | 144.3 | 86% | 0.859 | 83% | 0.828 | S | S | * | * | trans | -138.7 | 109.7 | 160.9 | -156.2 | 76.2 | 0 | 0 | 0 | 108.7 | ||||
| 123 | S | 22.3 | Very low | 28.1 | Very low | 109 Ų | 109 | 150.2 Ų | 150.2 | 76% | 0.762 | 83% | 0.834 | S | S | * | * | trans | -76 | 144.8 | 167.3 | -53.3 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 124 | S | 30 | Very low | 28.4 | Very low | 111 Ų | 111 | 153.5 Ų | 153.5 | 78% | 0.776 | 84% | 0.838 | S | S | * | * | trans | -146.2 | 101 | 161.3 | -55.1 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 125 | E | 22.3 | Very low | 28.1 | Very low | 186 Ų | 186 | 156.4 Ų | 156.4 | 87% | 0.869 | 84% | 0.839 | S | S | * | * | trans | -77.3 | 133.2 | 162.7 | -58.1 | -171.8 | 153.3 | 0 | 0 | 108.5 | ||||
| 126 | I | 32.2 | Very low | 28.4 | Very low | 163 Ų | 163 | 158.7 Ų | 158.7 | 84% | 0.836 | 84% | 0.839 | S | S | * | * | trans | -149.1 | 113.6 | 147.7 | -60.4 | -171.4 | 0 | 0 | 0 | 110.2 | ||||
| 127 | S | 31 | Very low | 28.8 | Very low | 113 Ų | 113 | 155.6 Ų | 155.6 | 79% | 0.79 | 83% | 0.829 | S | S | * | * | trans | 54.4 | 118.4 | 140 | -57 | 0 | 0 | 0 | 0 | 124.1 | ||||
| 128 | S | 25.8 | Very low | 28.8 | Very low | 131 Ų | 131 | 153.6 Ų | 153.6 | 92% | 0.916 | 82% | 0.824 | S | S | * | * | trans | -52 | 139.8 | 148.1 | -52.7 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 129 | G | 29.3 | Very low | 29 | Very low | 78 Ų | 78 | 152.2 Ų | 152.2 | 80% | 0.804 | 83% | 0.831 | S | S | * | * | trans | -160.6 | 115.3 | 169.2 | 0 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 130 | V | 25.5 | Very low | 29.3 | Very low | 136 Ų | 136 | 147.3 Ų | 147.3 | 82% | 0.824 | 82% | 0.818 | S | S | * | * | trans | -84.9 | 169.8 | 174.9 | 178 | 0 | 0 | 0 | 0 | 109 | ||||
| 131 | I | 28.4 | Very low | 29.3 | Very low | 155 Ų | 155 | 145.8 Ų | 145.8 | 80% | 0.795 | 82% | 0.819 | S | S | * | * | trans | 93.1 | 130.3 | 166.3 | -49.5 | 173.6 | 0 | 0 | 0 | 112.1 | ||||
| 132 | S | 29.7 | Very low | 29.5 | Very low | 108 Ų | 108 | 143.3 Ų | 143.3 | 76% | 0.755 | 81% | 0.812 | S | S | * | * | cis | -160 | 163.3 | 12.3 | -117 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 133 | R | 24.1 | Very low | 29.6 | Very low | 245 Ų | 245 | 141 Ų | 141 | 93% | 0.925 | 81% | 0.81 | S | S | * | * | trans | -65.9 | 138.2 | 170 | -63.5 | 171.8 | 177.9 | 159.4 | -0.6 | 111.3 | ||||
| 134 | V | 33.7 | Very low | 29.8 | Very low | 147 Ų | 147 | 141.5 Ų | 141.5 | 89% | 0.891 | 81% | 0.812 | S | S | * | * | trans | -135.4 | 133.2 | 154.2 | 178.6 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 135 | R | 26 | Very low | 29.6 | Very low | 226 Ų | 226 | 141 Ų | 141 | 85% | 0.853 | 81% | 0.809 | S | S | * | * | trans | -97 | 173 | -177.7 | -161.4 | 179.7 | -169.6 | -171.4 | 1.5 | 108.2 | ||||
| 136 | E | 34.5 | Very low | 30.1 | Very low | 168 Ų | 168 | 136.8 Ų | 136.8 | 79% | 0.785 | 80% | 0.8 | S | S | * | * | trans | 104.8 | 139 | 169.2 | -59.2 | 179.9 | -177.7 | 0 | 0 | 114.7 | ||||
| 137 | N | 36.4 | Very low | 29.8 | Very low | 128 Ų | 128 | 137 Ų | 137 | 68% | 0.684 | 80% | 0.803 | S | S | * | * | cis | -161.2 | 155.1 | -10.8 | -101.1 | -24.7 | 0 | 0 | 0 | 109 | ||||
| 138 | N | 31.9 | Very low | 29.7 | Very low | 143 Ų | 143 | 137.7 Ų | 137.7 | 77% | 0.765 | 80% | 0.802 | S | S | * | * | trans | -32 | 141.2 | 177.3 | -56.8 | -67.8 | 0 | 0 | 0 | 120 | ||||
| 139 | V | 37.3 | Very low | 29.8 | Very low | 152 Ų | 152 | 138.5 Ų | 138.5 | 92% | 0.921 | 80% | 0.795 | S | S | * | * | -150.6 | 107.3 | 126.3 | -177.7 | 0 | 0 | 0 | 0 | 111 | |||||
| 140 | G | 32.5 | Very low | 29.7 | Very low | 58 Ų | 58 | 144.7 Ų | 144.7 | 60% | 0.598 | 80% | 0.796 | S | S | * | * | 64.2 | 98.3 | 128.4 | 0 | 0 | 0 | 0 | 0 | 124.7 | |||||
| 141 | L | 30.2 | Very low | 30.1 | Very low | 172 Ų | 172 | 143.2 Ų | 143.2 | 90% | 0.901 | 79% | 0.787 | S | S | * | * | trans | 71.8 | 152.8 | 134 | -69.7 | 132.9 | 0 | 0 | 0 | 122.3 | ||||
| 142 | P | 31.1 | Very low | 30.5 | Very low | 116 Ų | 116 | 144.6 Ų | 144.6 | 75% | 0.753 | 79% | 0.787 | S | S | * | * | cis | -127.4 | 166.2 | -22.7 | 33.1 | -14.1 | 0 | 0 | 0 | 115 | ||||
| 143 | S | 26.6 | Very low | 31.1 | Very low | 115 Ų | 115 | 145.6 Ų | 145.6 | 80% | 0.804 | 79% | 0.789 | S | S | * | * | trans | -45.4 | 128.4 | 177.9 | -175.5 | 0 | 0 | 0 | 0 | 116.1 | ||||
| 144 | C | 27.1 | Very low | 31.9 | Very low | 120 Ų | 120 | 138.1 Ų | 138.1 | 81% | 0.811 | 77% | 0.774 | S | S | * | * | trans | -142.7 | 104.4 | 142.4 | -155.9 | 0 | 0 | 0 | 0 | 109.6 | S146 | C144-S146 PolarHBondContact O-N 3.15Š| ||
| 145 | S | 26.8 | Very low | 32.5 | Very low | 102 Ų | 102 | 141.3 Ų | 141.3 | 71% | 0.713 | 77% | 0.77 | S | S | * | * | trans | -53.6 | 116.8 | 171.2 | 50.6 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 146 | S | 32.1 | Very low | 33.1 | Very low | 96 Ų | 96 | 137.1 Ų | 137.1 | 67% | 0.671 | 76% | 0.758 | S | S | * | * | trans | -158.8 | 91.8 | 156.3 | -76.6 | 0 | 0 | 0 | 0 | 109 | C144 V148 | C144-S146 PolarHBondContact O-N 3.15Å; S146-V148 PolarHBondContact O-N 3.48Å | ||
| 147 | N | 26.1 | Very low | 33.3 | Very low | 167 Ų | 167 | 139.7 Ų | 139.7 | 89% | 0.893 | 76% | 0.761 | S | S | * | * | trans | -60.1 | 82.8 | 162.4 | -73.5 | -40.3 | 0 | 0 | 0 | 109 | L149 | N147-L149 VanDerWaalsContact C-N 3.26Å; N147-L149 PolarHBondContact O-N 3.04Å | ||
| 148 | V | 28 | Very low | 33.5 | Very low | 128 Ų | 128 | 141.6 Ų | 141.6 | 78% | 0.776 | 76% | 0.76 | S | S | * | * | trans | -83.9 | 81.6 | 171.3 | -174.6 | 0 | 0 | 0 | 0 | 107.6 | S146 Y150 | S146-V148 PolarHBondContact O-N 3.48Å; V148-Y150 PolarHBondContact O-N 3.31Å | ||
| 149 | L | 27.8 | Very low | 34.3 | Very low | 148 Ų | 148 | 139.1 Ų | 139.1 | 78% | 0.775 | 75% | 0.75 | S | S | * | * | trans | -52.7 | 104.4 | 162.8 | -88.5 | 151.4 | 0 | 0 | 0 | 109 | N147 T151 | N147-L149 VanDerWaalsContact C-N 3.26Å; N147-L149 PolarHBondContact O-N 3.04Å; L149-T151 VanDerWaalsContact C-N 3.29Å; L149-T151 PolarHBondContact O-N 3.39Å | ||
| 150 | Y | 28.1 | Very low | 34.3 | Very low | 209 Ų | 209 | 138.5 Ų | 138.5 | 82% | 0.82 | 73% | 0.734 | S | S | * | * | trans | -64.8 | 86.9 | 172.5 | -175.1 | -91.4 | 0 | 0 | 0 | 109.3 | V148 | V148-Y150 PolarHBondContact O-N 3.31Š| ||
| 151 | T | 33.4 | Very low | 34.4 | Very low | 104 Ų | 104 | 141.3 Ų | 141.3 | 64% | 0.638 | 74% | 0.742 | S | S | * | * | trans | -80.9 | 123.6 | 170.8 | 59.9 | 0 | 0 | 0 | 0 | 108.7 | L149 T153 | L149-T151 VanDerWaalsContact C-N 3.29Å; L149-T151 PolarHBondContact O-N 3.39Å; T151-T153 WeakPolarHBondContact O-CG2 3.19Å; T151-T153 PolarHBondContact O-N 3.36Å | ||
| 152 | K | 37.4 | Very low | 35.2 | Very low | 184 Ų | 184 | 137.2 Ų | 137.2 | 80% | 0.8 | 74% | 0.741 | S | S | * | * | trans | -54 | 93.6 | 177.3 | -72.5 | 170.9 | 175.8 | 171.9 | 0 | 110.5 | S154 | K152-S154 PolarHBondContact O-N 3.39Š| ||
| 153 | T | 42.5 | Very low | 35.8 | Very low | 130 Ų | 130 | 134 Ų | 134 | 80% | 0.798 | 72% | 0.722 | S | S | * | * | trans | -76.2 | 50.2 | 178.4 | 54.3 | 0 | 0 | 0 | 0 | 112.4 | T151 R155 | T151-T153 WeakPolarHBondContact O-CG2 3.19Å; T151-T153 PolarHBondContact O-N 3.36Å; T153-R155 PolarHBondContact O-N 3.46Å | ||
| 154 | S | 40.1 | Very low | 36.8 | Very low | 87 Ų | 87 | 133.8 Ų | 133.8 | 61% | 0.608 | 72% | 0.721 | S | S | * | * | trans | -81 | 114.5 | 165.6 | -173.4 | 0 | 0 | 0 | 0 | 108.9 | K152 F156 | K152-S154 PolarHBondContact O-N 3.39Å; S154-F156 PolarHBondContact O-N 3.26Å; S154-F156 PolarHBondContact OG-O 3.49Å | ||
| 155 | R | 46.5 | Very low | 37.9 | Very low | 215 Ų | 215 | 132.8 Ų | 132.8 | 81% | 0.811 | 72% | 0.721 | S | S | * | * | S | Bend | trans | -63 | -1.4 | 174.3 | -76.4 | -178.6 | -77.1 | 165.2 | -3.5 | 114.2 | T153 | T153-R155 PolarHBondContact O-N 3.46Š|
| 156 | F | 38.2 | Very low | 38.8 | Very low | 137 Ų | 137 | 133.4 Ų | 133.4 | 60% | 0.601 | 73% | 0.725 | S | S | * | * | trans | -145.5 | 123.8 | 177 | -60.8 | -79.7 | 0 | 0 | 0 | 108.6 | S154 I183 | S154-F156 PolarHBondContact O-N 3.26Å; S154-F156 PolarHBondContact OG-O 3.49Å; F156-I183 HydrophobicContact CD1-CG2 3.83Å; F156-I183 HydrophobicContact CE1-CG2 3.67Å | ||
| 157 | R | 40.4 | Very low | 39 | Very low | 223 Ų | 223 | 133 Ų | 133 | 84% | 0.842 | 72% | 0.722 | S | S | * | * | trans | -101.1 | 122 | 167.5 | -165 | -177.1 | -89.3 | -166.2 | -2.8 | 107.7 | V159 | R157-V159 PolarHBondContact O-N 2.99Š| ||
| 158 | Y | 40.5 | Very low | 39.8 | Very low | 167 Ų | 167 | 136 Ų | 136 | 66% | 0.655 | 72% | 0.721 | S | S | * | * | trans | -69.8 | 122.5 | 169.6 | -177.8 | -98.8 | 0 | 0 | 0 | 108 | K160 | Y158-K160 HydrophobicContact CD1-CG 4.42Å; Y158-K160 HydrophobicContact CE1-CG 3.58Å | ||
| 159 | V | 48.1 | Very low | 40.3 | Very low | 91 Ų | 91 | 138.5 Ų | 138.5 | 55% | 0.552 | 73% | 0.729 | S | S | * | * | trans | -117.8 | 117.6 | 173.6 | -175.2 | 0 | 0 | 0 | 0 | 105.9 | R157 S163 | R157-V159 PolarHBondContact O-N 2.99Å; V159-S163 VanDerWaalsContact CG1-OG 3.27Å; V159-S163 WeakPolarHBondContact CG1-OG 3.21Å | ||
| 160 | K | 36.2 | Very low | 40.6 | Very low | 139 Ų | 139 | 136.5 Ų | 136.5 | 60% | 0.604 | 73% | 0.734 | S | S | * | * | trans | -64.1 | 138.5 | 173.2 | -85 | -171.7 | 173 | 175.4 | 0 | 108.4 | Y158 G162 S163 | Y158-K160 HydrophobicContact CD1-CG 4.42Å; Y158-K160 HydrophobicContact CE1-CG 3.58Å; K160-G162 PolarHBondContact O-N 3.24Å; K160-G162 VanDerWaalsContact O-N 3.14Å; K160-S163 PolarHBondContact O-N 2.75Å; K160-S163 PolarHBondContact O-OG 2.85Å; K160-S163 VanDerWaalsContact O-OG 3.09Å | ||
| 161 | P | 35.2 | Very low | 41 | Very low | 117 Ų | 117 | 131.4 Ų | 131.4 | 76% | 0.76 | 73% | 0.728 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -55.3 | 122.3 | 163.4 | -15.5 | 28.4 | 0 | 0 | 0 | 108 | ||
| 162 | G | 46.8 | Very low | 41.2 | Very low | 86 Ų | 86 | 134.8 Ų | 134.8 | 89% | 0.887 | 74% | 0.735 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 103.5 | -4.3 | 179.3 | 0 | 0 | 0 | 0 | 0 | 116.8 | K160 S164 | K160-G162 PolarHBondContact O-N 3.24Å; K160-G162 VanDerWaalsContact O-N 3.14Å; G162-S164 PolarHBondContact O-N 3.13Å |
| 163 | S | 44.7 | Very low | 41 | Very low | 49 Ų | 49 | 133.6 Ų | 133.6 | 34% | 0.343 | 74% | 0.737 | S | S | . | * | trans | -72.7 | 128.7 | 170 | 51 | 0 | 0 | 0 | 0 | 110.8 | V159 K160 A165 | V159-S163 VanDerWaalsContact CG1-OG 3.27Å; V159-S163 WeakPolarHBondContact CG1-OG 3.21Å; K160-S163 PolarHBondContact O-N 2.75Å; K160-S163 PolarHBondContact O-OG 2.85Å; K160-S163 VanDerWaalsContact O-OG 3.09Å; S163-A165 PolarHBondContact O-N 3.39Å | ||
| 164 | S | 47.8 | Very low | 40.6 | Very low | 111 Ų | 111 | 133.8 Ų | 133.8 | 78% | 0.776 | 73% | 0.733 | S | S | * | * | G | 310 helix | trans | -51.7 | 7.8 | -176.1 | 39.2 | 0 | 0 | 0 | 0 | 117.8 | G162 S166 S167 | G162-S164 PolarHBondContact O-N 3.13Å; S164-S166 VanDerWaalsContact C-N 3.31Å; S164-S167 PolarHBondContact O-OG 3.42Å |
| 165 | A | 50.3 | Low | 40.4 | Very low | 99 Ų | 99 | 135.3 Ų | 135.3 | 82% | 0.818 | 74% | 0.743 | S | S | * | * | G | 310 helix | trans | -84.2 | -0.7 | 174.1 | 0 | 0 | 0 | 0 | 0 | 113.8 | S163 | S163-A165 PolarHBondContact O-N 3.39Š|
| 166 | S | 43.9 | Very low | 40.2 | Very low | 115 Ų | 115 | 132.3 Ų | 132.3 | 80% | 0.804 | 74% | 0.739 | S | S | * | * | G | 310 helix | trans | -108.7 | 2 | -177 | -149.9 | 0 | 0 | 0 | 0 | 114.5 | S164 | S164-S166 VanDerWaalsContact C-N 3.31Š|
| 167 | S | 37.2 | Very low | 40.1 | Very low | 86 Ų | 86 | 133 Ų | 133 | 60% | 0.601 | 75% | 0.748 | S | S | * | * | trans | -103.7 | 83 | -178.5 | 55.6 | 0 | 0 | 0 | 0 | 110.4 | S164 | S164-S167 PolarHBondContact O-OG 3.42Š| ||
| 168 | R | 42 | Very low | 39.9 | Very low | 231 Ų | 231 | 128.7 Ų | 128.7 | 87% | 0.872 | 75% | 0.746 | S | S | * | * | S | Bend | trans | -175.3 | 100 | 159.8 | -104.1 | 177.5 | -88.9 | -145.5 | 3 | 105.6 | ||
| 169 | L | 39.9 | Very low | 40 | Very low | 181 Ų | 181 | 129 Ų | 129 | 95% | 0.948 | 75% | 0.751 | S | S | * | * | S | Bend | trans | 98.2 | 72.9 | -177.5 | -52.9 | 148.7 | 0 | 0 | 0 | 115.6 | ||
| 170 | A | 34 | Very low | 39.7 | Very low | 105 Ų | 105 | 133.1 Ų | 133.1 | 87% | 0.868 | 76% | 0.761 | S | S | * | * | trans | -157 | 81 | 151 | 0 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 171 | S | 36.5 | Very low | 39.8 | Very low | 102 Ų | 102 | 134.9 Ų | 134.9 | 71% | 0.713 | 77% | 0.769 | S | S | * | * | trans | -71.3 | 130.3 | 171.9 | -161.4 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 172 | K | 36.5 | Very low | 40.1 | Very low | 176 Ų | 176 | 134.2 Ų | 134.2 | 77% | 0.765 | 77% | 0.767 | S | S | * | * | S | Bend | trans | 61.9 | 120.5 | 152.7 | -65.5 | 173 | -180 | -178.1 | 0 | 117.8 | ||
| 173 | N | 34.6 | Very low | 40 | Very low | 158 Ų | 158 | 136.2 Ų | 136.2 | 85% | 0.845 | 76% | 0.756 | S | S | * | * | trans | 75.1 | 93.5 | 156.4 | -49 | -10.6 | 0 | 0 | 0 | 115.1 | ||||
| 174 | N | 33.5 | Very low | 40.5 | Very low | 135 Ų | 135 | 142.8 Ų | 142.8 | 72% | 0.722 | 78% | 0.778 | S | S | * | * | 168.8 | 113.2 | 110.6 | -146.6 | -19.6 | 0 | 0 | 0 | 108.9 | Q176 | N174-Q176 PolarHBondContact O-N 3.18Š| |||
| 175 | S | 36.3 | Very low | 40.5 | Very low | 118 Ų | 118 | 145.3 Ų | 145.3 | 83% | 0.825 | 78% | 0.775 | S | S | * | * | trans | -67.9 | 85.6 | 174 | 40.8 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 176 | Q | 42.3 | Very low | 40.7 | Very low | 153 Ų | 153 | 148.4 Ų | 148.4 | 72% | 0.715 | 78% | 0.775 | S | S | * | * | trans | -127.7 | 110.1 | 165.4 | -76.4 | -173.9 | 4.6 | 0 | 0 | 110.5 | N174 V178 | N174-Q176 PolarHBondContact O-N 3.18Å; Q176-V178 PolarHBondContact O-N 3.29Å | ||
| 177 | L | 35.5 | Very low | 41.2 | Very low | 152 Ų | 152 | 147.7 Ų | 147.7 | 80% | 0.796 | 77% | 0.77 | S | S | * | * | trans | -33.1 | 101.5 | 168.5 | -88.4 | 151.9 | 0 | 0 | 0 | 113.1 | K179 | L177-K179 VanDerWaalsContact C-N 3.31Å; L177-K179 PolarHBondContact O-N 3.22Å | ||
| 178 | V | 36.7 | Very low | 41.8 | Very low | 131 Ų | 131 | 152.6 Ų | 152.6 | 79% | 0.794 | 78% | 0.775 | S | S | * | * | trans | -76.3 | 82.9 | 173.9 | -175.5 | 0 | 0 | 0 | 0 | 109.3 | Q176 K180 | Q176-V178 PolarHBondContact O-N 3.29Å; V178-K180 PolarHBondContact O-N 3.34Å | ||
| 179 | K | 42.2 | Very low | 42.5 | Very low | 175 Ų | 175 | 149.4 Ų | 149.4 | 76% | 0.761 | 77% | 0.77 | S | S | * | * | trans | -83.8 | 21.5 | 172.7 | -70.1 | -173.9 | 179.9 | 178.6 | 0 | 113.7 | L177 | L177-K179 VanDerWaalsContact C-N 3.31Å; L177-K179 PolarHBondContact O-N 3.22Å | ||
| 180 | K | 42.4 | Very low | 43.4 | Very low | 177 Ų | 177 | 148.2 Ų | 148.2 | 77% | 0.77 | 77% | 0.765 | S | S | * | * | S | Bend | trans | -117.8 | 117.1 | -176 | -75.5 | 179.2 | 178.1 | 173.2 | 0 | 110.8 | V178 S182 | V178-K180 PolarHBondContact O-N 3.34Å; K180-S182 PolarHBondContact O-N 3.34Å |
| 181 | F | 38.3 | Very low | 44.7 | Very low | 176 Ų | 176 | 149.1 Ų | 149.1 | 77% | 0.772 | 76% | 0.759 | S | S | * | * | trans | -54.3 | 106.1 | 161.2 | -63.7 | -83.5 | 0 | 0 | 0 | 108.4 | ||||
| 182 | S | 41.1 | Very low | 46 | Very low | 102 Ų | 102 | 149.6 Ų | 149.6 | 71% | 0.713 | 76% | 0.76 | S | S | * | * | trans | -89.2 | 109.4 | 177.1 | -176.3 | 0 | 0 | 0 | 0 | 109.3 | K180 K184 | K180-S182 PolarHBondContact O-N 3.34Å; S182-K184 PolarHBondContact O-N 3.33Å | ||
| 183 | I | 45.4 | Very low | 47.4 | Very low | 129 Ų | 129 | 152.5 Ų | 152.5 | 66% | 0.662 | 77% | 0.766 | S | S | * | * | trans | -78.5 | 95.5 | 165.9 | -60.1 | 175.9 | 0 | 0 | 0 | 106.7 | F156 K185 | F156-I183 HydrophobicContact CD1-CG2 3.83Å; F156-I183 HydrophobicContact CE1-CG2 3.67Å; I183-K185 PolarHBondContact O-N 3.27Å | ||
| 184 | K | 53.4 | Low | 49.1 | Very low | 186 Ų | 186 | 147.4 Ų | 147.4 | 81% | 0.809 | 74% | 0.742 | S | S | * | * | trans | -69.6 | 112.9 | 175.8 | -130.5 | 175.2 | -175.3 | 178.1 | 0 | 109.1 | S182 M186 | S182-K184 PolarHBondContact O-N 3.33Å; K184-M186 PolarHBondContact O-N 3.37Å | ||
| 185 | K | 48.2 | Very low | 51.3 | Low | 164 Ų | 164 | 144.3 Ų | 144.3 | 71% | 0.713 | 73% | 0.73 | S | S | * | * | trans | -72 | 106.3 | 172.7 | -169.7 | 179.9 | -179.6 | -174 | 0 | 107.6 | I183 S187 | I183-K185 PolarHBondContact O-N 3.27Å; K185-S187 PolarHBondContact O-N 3.39Å | ||
| 186 | M | 55.5 | Low | 53.5 | Low | 165 Ų | 165 | 142.9 Ų | 142.9 | 81% | 0.813 | 73% | 0.726 | S | S | * | * | trans | -63.6 | 136.6 | 172.6 | -63 | -176.8 | 69.8 | 0 | 0 | 109.3 | K184 R188 | K184-M186 PolarHBondContact O-N 3.37Å; M186-R188 PolarHBondContact O-N 3.32Å | ||
| 187 | S | 53.2 | Low | 55.5 | Low | 99 Ų | 99 | 139.3 Ų | 139.3 | 69% | 0.692 | 72% | 0.717 | S | S | * | * | trans | -55.7 | 126.4 | 177.4 | -175.7 | 0 | 0 | 0 | 0 | 110 | K185 H189 | K185-S187 PolarHBondContact O-N 3.39Å; S187-H189 PolarHBondContact O-N 3.49Å; S187-H189 PolarHBondContact OG-CD2 2.95Å; S187-H189 VanDerWaalsContact OG-CD2 3.25Å | ||
| 188 | R | 51.1 | Low | 57.6 | Low | 190 Ų | 190 | 137.3 Ų | 137.3 | 72% | 0.717 | 70% | 0.703 | S | S | * | * | trans | -89.9 | 9.4 | -164.5 | -74.1 | -171.6 | 178.6 | 177 | -0.9 | 114.5 | M186 N190 | M186-R188 PolarHBondContact O-N 3.32Å; R188-N190 VanDerWaalsContact C-N 3.27Å; R188-N190 PolarHBondContact O-N 3.33Å | ||
| 189 | H | 55.8 | Low | 59.4 | Low | 163 Ų | 163 | 138 Ų | 138 | 76% | 0.755 | 69% | 0.693 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.7 | -1.3 | -158.7 | -70.9 | -63.8 | 0 | 0 | 0 | 116.8 | S187 | S187-H189 PolarHBondContact O-N 3.49Å; S187-H189 PolarHBondContact OG-CD2 2.95Å; S187-H189 VanDerWaalsContact OG-CD2 3.25Å |
| 190 | N | 58.1 | Low | 61.2 | Low | 157 Ų | 157 | 136.2 Ų | 136.2 | 84% | 0.84 | 69% | 0.685 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -145.1 | 23.5 | -178.8 | -85.8 | -42.4 | 0 | 0 | 0 | 115.7 | R188 P192 | R188-N190 VanDerWaalsContact C-N 3.27Å; R188-N190 PolarHBondContact O-N 3.33Å; N190-P192 VanDerWaalsContact O-CD 3.27Å; N190-P192 WeakPolarHBondContact O-CD 3.24Å |
| 191 | V | 61.4 | Low | 63.1 | Low | 123 Ų | 123 | 133.8 Ų | 133.8 | 75% | 0.745 | 67% | 0.674 | S | S | * | * | trans | -95.6 | 108.8 | 174.2 | -173.2 | 0 | 0 | 0 | 0 | 109.3 | R193 | V191-R193 PolarHBondContact O-N 2.88Š| ||
| 192 | P | 65.3 | Low | 65 | Low | 113 Ų | 113 | 129 Ų | 129 | 73% | 0.734 | 66% | 0.656 | S | S | * | * | P | Polyproline II helix | trans | -58.9 | 131.7 | 176.6 | 20.7 | -28.9 | 0 | 0 | 0 | 109.5 | N190 | N190-P192 VanDerWaalsContact O-CD 3.27Å; N190-P192 WeakPolarHBondContact O-CD 3.24Å |
| 193 | R | 64.6 | Low | 66.9 | Low | 237 Ų | 237 | 126.9 Ų | 126.9 | 89% | 0.894 | 64% | 0.638 | S | S | * | * | P | Polyproline II helix | trans | -59.5 | 126.2 | 175.7 | -173.2 | 175.7 | -178 | 174.5 | -0 | 107.3 | V191 S195 | V191-R193 PolarHBondContact O-N 2.88Å; R193-S195 PolarHBondContact O-N 2.95Å |
| 194 | P | 70.4 | Confident | 68.4 | Low | 51 Ų | 51 | 125.5 Ų | 125.5 | 33% | 0.331 | 63% | 0.629 | S | S | . | * | P | Polyproline II helix | trans | -56.1 | 140.5 | 179.7 | 20.3 | -30.3 | 0 | 0 | 0 | 109.4 | Q198 | P194-Q198 HydrophobicContact CB-CB 4.06Å; P194-Q198 HydrophobicContact CB-CG 4.15Å |
| 195 | S | 81 | Confident | 69.6 | Low | 69 Ų | 69 | 124 Ų | 124 | 48% | 0.483 | 62% | 0.623 | S | S | . | * | P | Polyproline II helix | trans | -53.4 | 154.6 | 174.8 | 70.1 | 0 | 0 | 0 | 0 | 110.3 | R193 C197 Q198 Y199 | R193-S195 PolarHBondContact O-N 2.95Å; S195-C197 PolarHBondContact O-N 2.88Å; S195-C197 VanDerWaalsContact O-N 3.11Å; S195-Q198 PolarHBondContact O-N 3.11Å; S195-Q198 PolarHBondContact OG-N 2.99Å; S195-Y199 PolarHBondContact O-N 3.1Å |
| 196 | A | 81.8 | Confident | 70.8 | Confident | 89 Ų | 89 | 118.4 Ų | 118.4 | 74% | 0.736 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -52.6 | -38.2 | -178.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | K200 | A196-K200 PolarHBondContact O-N 3.18Å |
| 197 | C | 85.1 | Confident | 71.7 | Confident | 77 Ų | 77 | 114.4 Ų | 114.4 | 52% | 0.52 | 59% | 0.592 | S | S | . | * | H | α-helix | trans | -64.3 | -45.4 | 175 | -177.8 | 0 | 0 | 0 | 0 | 112.6 | S195 K200 K201 | S195-C197 PolarHBondContact O-N 2.88Å; S195-C197 VanDerWaalsContact O-N 3.11Å; C197-K200 PolarHBondContact O-N 3.23Å; C197-K201 PolarHBondContact O-N 3.28Å; C197-K201 VanDerWaalsContact O-N 3.1Å |
| 198 | Q | 79.1 | Confident | 72.5 | Confident | 111 Ų | 111 | 115 Ų | 115 | 52% | 0.519 | 58% | 0.583 | S | S | . | * | H | α-helix | trans | -68.4 | -37.5 | 179.5 | -168.4 | 168.5 | 11.5 | 0 | 0 | 112 | P194 S195 K201 I202 | P194-Q198 HydrophobicContact CB-CB 4.06Å; P194-Q198 HydrophobicContact CB-CG 4.15Å; S195-Q198 PolarHBondContact O-N 3.11Å; S195-Q198 PolarHBondContact OG-N 2.99Å; Q198-K201 PolarHBondContact O-N 3.45Å; Q198-I202 HydrophobicContact CG-CD1 4.29Å; Q198-I202 VanDerWaalsContact O-CG1 3.29Å; Q198-I202 WeakPolarHBondContact O-CG1 3.29Å; Q198-I202 PolarHBondContact O-N 2.86Å |
| 199 | Y | 74.5 | Confident | 73.2 | Confident | 146 Ų | 146 | 108.9 Ų | 108.9 | 57% | 0.573 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -60.5 | -45.5 | 172.3 | -175.7 | -98.8 | 0 | 0 | 0 | 111.7 | S195 K201 I202 V203 | S195-Y199 PolarHBondContact O-N 3.1Å; Y199-K201 VanDerWaalsContact C-N 3.34Å; Y199-K201 PolarHBondContact O-N 3.44Å; Y199-I202 PolarHBondContact O-N 3.01Å; Y199-V203 HydrophobicContact CD1-CG2 4.05Å; Y199-V203 HydrophobicContact CE1-CG2 3.64Å; Y199-V203 HydrophobicContact CE2-CG2 4.26Å; Y199-V203 WeakPolarHBondContact O-CG2 3.43Å; Y199-V203 PolarHBondContact O-N 3.27Å |
| 200 | K | 78.7 | Confident | 73.8 | Confident | 137 Ų | 137 | 106.5 Ų | 106.5 | 60% | 0.596 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -56.6 | -45.6 | 176 | -171 | 177.5 | -179.4 | 179.7 | 0 | 111.7 | A196 C197 V203 Q204 | A196-K200 PolarHBondContact O-N 3.18Å; C197-K200 PolarHBondContact O-N 3.23Å; K200-V203 PolarHBondContact O-N 3.06Å; K200-Q204 WeakPolarHBondContact O-CB 3.3Å; K200-Q204 WeakPolarHBondContact O-CG 3.4Å; K200-Q204 PolarHBondContact O-N 3.41Å |
| 201 | K | 82.8 | Confident | 73.8 | Confident | 126 Ų | 126 | 106.7 Ų | 106.7 | 55% | 0.548 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -63 | -41.6 | 176.6 | -70.8 | -178.7 | -179.6 | 179.5 | 0 | 112.7 | C197 Q198 Y199 Q204 K205 | C197-K201 PolarHBondContact O-N 3.28Å; C197-K201 VanDerWaalsContact O-N 3.1Å; Q198-K201 PolarHBondContact O-N 3.45Å; Y199-K201 VanDerWaalsContact C-N 3.34Å; Y199-K201 PolarHBondContact O-N 3.44Å; K201-Q204 PolarHBondContact O-N 3.42Å; K201-K205 WeakPolarHBondContact O-CB 3.26Å; K201-K205 WeakPolarHBondContact O-CG 3.47Å; K201-K205 PolarHBondContact O-N 3.34Å |
| 202 | I | 78.7 | Confident | 73.4 | Confident | 74 Ų | 74 | 108.8 Ų | 108.8 | 38% | 0.379 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -63.1 | -45.5 | 177.2 | -68.1 | 164.2 | 0 | 0 | 0 | 110.6 | Q198 Y199 K205 A206 | Q198-I202 HydrophobicContact CG-CD1 4.29Å; Q198-I202 VanDerWaalsContact O-CG1 3.29Å; Q198-I202 WeakPolarHBondContact O-CG1 3.29Å; Q198-I202 PolarHBondContact O-N 2.86Å; Y199-I202 PolarHBondContact O-N 3.01Å; I202-K205 PolarHBondContact O-N 3.4Å; I202-A206 WeakPolarHBondContact O-CB 3.5Å; I202-A206 PolarHBondContact O-N 3.25Å |
| 203 | V | 80.8 | Confident | 72.8 | Confident | 58 Ų | 58 | 113.2 Ų | 113.2 | 35% | 0.352 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -64.3 | -45.6 | 178.2 | 175 | 0 | 0 | 0 | 0 | 110.8 | Y199 K200 K205 A206 V207 | Y199-V203 HydrophobicContact CD1-CG2 4.05Å; Y199-V203 HydrophobicContact CE1-CG2 3.64Å; Y199-V203 HydrophobicContact CE2-CG2 4.26Å; Y199-V203 WeakPolarHBondContact O-CG2 3.43Å; Y199-V203 PolarHBondContact O-N 3.27Å; K200-V203 PolarHBondContact O-N 3.06Å; V203-K205 PolarHBondContact O-N 2.84Å; V203-A206 PolarHBondContact O-N 3.45Å; V203-V207 HydrophobicContact CG1-CG2 4.17Å; V203-V207 WeakPolarHBondContact O-CB 3.33Å; V203-V207 VanDerWaalsContact O-CG2 3.29Å; V203-V207 WeakPolarHBondContact O-CG2 3.11Å; V203-V207 PolarHBondContact O-N 3.02Å |
| 204 | Q | 76.6 | Confident | 72.6 | Confident | 100 Ų | 100 | 111.4 Ų | 111.4 | 47% | 0.467 | 55% | 0.55 | S | S | . | * | H | α-helix | trans | -57.8 | -47.3 | 175.8 | -76.5 | 175.1 | -21.1 | 0 | 0 | 112 | K200 K201 A206 V207 H208 | K200-Q204 WeakPolarHBondContact O-CB 3.3Å; K200-Q204 WeakPolarHBondContact O-CG 3.4Å; K200-Q204 PolarHBondContact O-N 3.41Å; K201-Q204 PolarHBondContact O-N 3.42Å; Q204-A206 VanDerWaalsContact C-N 3.34Å; Q204-A206 PolarHBondContact O-N 3Å; Q204-V207 PolarHBondContact O-N 3.26Å; Q204-H208 WeakPolarHBondContact O-CB 3.45Å; Q204-H208 PolarHBondContact O-N 3.16Å |
| 205 | K | 78.1 | Confident | 72.5 | Confident | 155 Ų | 155 | 117.9 Ų | 117.9 | 67% | 0.674 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -60.8 | -41 | 175.4 | -77.2 | -175.7 | 178.1 | -174.4 | 0 | 112.3 | K201 I202 V203 S209 | K201-K205 WeakPolarHBondContact O-CB 3.26Å; K201-K205 WeakPolarHBondContact O-CG 3.47Å; K201-K205 PolarHBondContact O-N 3.34Å; I202-K205 PolarHBondContact O-N 3.4Å; V203-K205 PolarHBondContact O-N 2.84Å; K205-S209 VanDerWaalsContact O-CB 3.29Å; K205-S209 WeakPolarHBondContact O-CB 3.24Å; K205-S209 PolarHBondContact O-N 3.04Å; K205-S209 PolarHBondContact O-OG 3.31Å |
| 206 | A | 75.3 | Confident | 72.6 | Confident | 46 Ų | 46 | 121.1 Ų | 121.1 | 38% | 0.38 | 58% | 0.577 | S | S | . | * | H | α-helix | trans | -66 | -45.9 | 177.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | I202 V203 Q204 S209 L210 | I202-A206 WeakPolarHBondContact O-CB 3.5Å; I202-A206 PolarHBondContact O-N 3.25Å; V203-A206 PolarHBondContact O-N 3.45Å; Q204-A206 VanDerWaalsContact C-N 3.34Å; Q204-A206 PolarHBondContact O-N 3Å; A206-S209 PolarHBondContact O-N 3.12Å; A206-L210 WeakPolarHBondContact O-CB 3.32Å; A206-L210 VanDerWaalsContact O-CG 3.22Å; A206-L210 WeakPolarHBondContact O-CG 3.39Å; A206-L210 PolarHBondContact O-N 3.5Å |
| 207 | V | 74.1 | Confident | 72.9 | Confident | 82 Ų | 82 | 118 Ų | 118 | 50% | 0.497 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -62.2 | -45.5 | 176.6 | 172.2 | 0 | 0 | 0 | 0 | 110.8 | V203 Q204 L210 K211 | V203-V207 HydrophobicContact CG1-CG2 4.17Å; V203-V207 WeakPolarHBondContact O-CB 3.33Å; V203-V207 VanDerWaalsContact O-CG2 3.29Å; V203-V207 WeakPolarHBondContact O-CG2 3.11Å; V203-V207 PolarHBondContact O-N 3.02Å; Q204-V207 PolarHBondContact O-N 3.26Å; V207-L210 PolarHBondContact O-N 3.37Å; V207-K211 WeakPolarHBondContact O-CB 3.2Å; V207-K211 PolarHBondContact O-N 3.17Å |
| 208 | H | 69.2 | Low | 73.3 | Confident | 111 Ų | 111 | 114.5 Ų | 114.5 | 51% | 0.514 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -59.3 | -48.8 | 173.7 | -79.8 | -171.8 | 0 | 0 | 0 | 111.3 | Q204 L210 K211 F212 | Q204-H208 WeakPolarHBondContact O-CB 3.45Å; Q204-H208 PolarHBondContact O-N 3.16Å; H208-L210 VanDerWaalsContact C-N 3.29Å; H208-L210 PolarHBondContact O-N 2.91Å; H208-K211 WeakPolarHBondContact O-CA 3.38Å; H208-K211 WeakPolarHBondContact O-CB 3.33Å; H208-K211 PolarHBondContact O-N 2.76Å; H208-F212 HydrophobicContact CB-CD2 4.44Å; H208-F212 HydrophobicContact CB-CE2 4.35Å; H208-F212 WeakPolarHBondContact O-CD2 3.23Å; H208-F212 PolarHBondContact O-N 2.77Å |
| 209 | S | 66.6 | Low | 73.8 | Confident | 62 Ų | 62 | 115.7 Ų | 115.7 | 43% | 0.434 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -60 | -38.2 | 178.2 | -58.8 | 0 | 0 | 0 | 0 | 112.3 | K205 A206 F212 R213 | K205-S209 VanDerWaalsContact O-CB 3.29Å; K205-S209 WeakPolarHBondContact O-CB 3.24Å; K205-S209 PolarHBondContact O-N 3.04Å; K205-S209 PolarHBondContact O-OG 3.31Å; A206-S209 PolarHBondContact O-N 3.12Å; S209-F212 PolarHBondContact O-N 3.4Å; S209-R213 WeakPolarHBondContact O-CB 3.49Å; S209-R213 VanDerWaalsContact O-CG 3.23Å; S209-R213 WeakPolarHBondContact O-CG 3.32Å; S209-R213 PolarHBondContact O-N 3.17Å |
| 210 | L | 67.3 | Low | 74.6 | Confident | 113 Ų | 113 | 112 Ų | 112 | 59% | 0.592 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -67.9 | -38 | 174.8 | -71.1 | 166.5 | 0 | 0 | 0 | 112 | A206 V207 H208 R213 R214 | A206-L210 WeakPolarHBondContact O-CB 3.32Å; A206-L210 VanDerWaalsContact O-CG 3.22Å; A206-L210 WeakPolarHBondContact O-CG 3.39Å; A206-L210 PolarHBondContact O-N 3.5Å; V207-L210 PolarHBondContact O-N 3.37Å; H208-L210 VanDerWaalsContact C-N 3.29Å; H208-L210 PolarHBondContact O-N 2.91Å; L210-R213 PolarHBondContact O-N 3.35Å; L210-R214 PolarHBondContact O-N 3Å |
| 211 | K | 59.3 | Low | 75.3 | Confident | 161 Ų | 161 | 106.9 Ų | 106.9 | 70% | 0.7 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -64 | -41.1 | 174.7 | -168.1 | 177.5 | -179.7 | -178 | 0 | 111.4 | V207 H208 | V207-K211 WeakPolarHBondContact O-CB 3.2Å; V207-K211 PolarHBondContact O-N 3.17Å; H208-K211 WeakPolarHBondContact O-CA 3.38Å; H208-K211 WeakPolarHBondContact O-CB 3.33Å; H208-K211 PolarHBondContact O-N 2.76Å |
| 212 | F | 51.3 | Low | 75.8 | Confident | 166 Ų | 166 | 101 Ų | 101 | 73% | 0.728 | 48% | 0.478 | S | S | * | . | H | α-helix | trans | -74.6 | -29.5 | 175.2 | -72.8 | -69.7 | 0 | 0 | 0 | 113.4 | H208 S209 R214 | H208-F212 HydrophobicContact CB-CD2 4.44Å; H208-F212 HydrophobicContact CB-CE2 4.35Å; H208-F212 WeakPolarHBondContact O-CD2 3.23Å; H208-F212 PolarHBondContact O-N 2.77Å; S209-F212 PolarHBondContact O-N 3.4Å; F212-R214 VanDerWaalsContact C-N 3.29Å; F212-R214 PolarHBondContact O-N 2.97Å |
| 213 | R | 53.1 | Low | 76.4 | Confident | 206 Ų | 206 | 102.9 Ų | 102.9 | 78% | 0.777 | 48% | 0.48 | S | S | * | . | H | α-helix | trans | -71.2 | -21.4 | 175.5 | -81.9 | -177 | -169 | -155.9 | 4.2 | 113.6 | S209 L210 R215 | S209-R213 WeakPolarHBondContact O-CB 3.49Å; S209-R213 VanDerWaalsContact O-CG 3.23Å; S209-R213 WeakPolarHBondContact O-CG 3.32Å; S209-R213 PolarHBondContact O-N 3.17Å; L210-R213 PolarHBondContact O-N 3.35Å; R213-R215 VanDerWaalsContact C-N 3.29Å; R213-R215 PolarHBondContact O-N 2.97Å |
| 214 | R | 61.5 | Low | 76.9 | Confident | 200 Ų | 200 | 103.2 Ų | 103.2 | 76% | 0.755 | 48% | 0.483 | S | S | * | . | S | Bend | trans | -73.9 | 91.9 | 164.7 | -74.1 | -173.7 | 166.3 | 171.1 | -2.8 | 107.2 | L210 F212 M216 | L210-R214 PolarHBondContact O-N 3Å; F212-R214 VanDerWaalsContact C-N 3.29Å; F212-R214 PolarHBondContact O-N 2.97Å; R214-M216 PolarHBondContact O-N 3.27Å |
| 215 | R | 67.9 | Low | 77.7 | Confident | 187 Ų | 187 | 98.9 Ų | 98.9 | 71% | 0.706 | 47% | 0.465 | S | S | * | . | P | Polyproline II helix | trans | -46.8 | 126.8 | 168.2 | -70.8 | -171.7 | -176.8 | 119.7 | -2.2 | 107.2 | R213 S235 | R213-R215 VanDerWaalsContact C-N 3.29Å; R213-R215 PolarHBondContact O-N 2.97Å; R215-S235 PolarHBondContact O-OG 3.4Å |
| 216 | M | 83.1 | Confident | 78.4 | Confident | 137 Ų | 137 | 97.4 Ų | 97.4 | 68% | 0.675 | 46% | 0.459 | S | S | * | . | P | Polyproline II helix | trans | -62.1 | 144.7 | 176.8 | -57.4 | -163.1 | -173.2 | 0 | 0 | 108.2 | R214 Y234 S235 | R214-M216 PolarHBondContact O-N 3.27Å; M216-Y234 HydrophobicContact CB-CD1 3.83Å; M216-Y234 HydrophobicContact CB-CE1 4.11Å; M216-Y234 CarbonylContact O-C 3.52Å; M216-Y234 VanDerWaalsContact O-CA 3.3Å; M216-Y234 WeakPolarHBondContact O-CA 3.37Å; M216-Y234 VanDerWaalsContact O-CB 3.22Å; M216-Y234 WeakPolarHBondContact O-CB 3.31Å; M216-Y234 WeakPolarHBondContact O-CD1 3.33Å; M216-S235 PolarHBondContact O-N 2.61Å |
| 217 | V | 88.8 | Confident | 79.2 | Confident | 22 Ų | 22 | 96.1 Ų | 96.1 | 13% | 0.133 | 45% | 0.446 | C | S | . | . | B | Isolated β-bridge | trans | -70.1 | 141 | 178.5 | -61 | 0 | 0 | 0 | 0 | 110.4 | Q219 S235 Y240 R305 | V217-Q219 PolarHBondContact O-N 3.25Å; V217-S235 WeakPolarHBondContact CA-O 3.39Å; V217-Y240 HydrophobicContact CB-CG 4.5Å; V217-Y240 HydrophobicContact CG1-CD1 4.15Å; V217-Y240 HydrophobicContact CG1-CD2 3.75Å; V217-Y240 HydrophobicContact CG1-CE1 4.39Å; V217-Y240 HydrophobicContact CG1-CE2 4.01Å; V217-Y240 HydrophobicContact CG1-CG 3.81Å; V217-Y240 HydrophobicContact CG2-CD1 4.36Å; V217-Y240 HydrophobicContact CG2-CG 4.49Å; V217-R305 HydrophobicContact CG2-CB 4.49Å |
| 218 | C | 91.9 | Very high | 80.1 | Confident | 5 Ų | 5 | 97.7 Ų | 97.7 | 3% | 0.034 | 46% | 0.461 | C | S | . | . | trans | -71 | 115.5 | 178.3 | -179.9 | 0 | 0 | 0 | 0 | 110 | S220 Y221 C222 S235 H236 | C218-S220 VanDerWaalsContact C-N 3.31Å; C218-S220 PolarHBondContact O-N 3.2Å; C218-Y221 PolarHBondContact O-N 3Å; C218-C222 PolarHBondContact O-N 3.27Å; C218-C222 PolarHBondContact O-SG 3.36Å; C218-S235 PolarHBondContact N-O 3.45Å; C218-H236 WeakPolarHBondContact CB-CD2 3.36Å | ||
| 219 | Q | 90.3 | Very high | 81.1 | Confident | 135 Ų | 135 | 96.3 Ų | 96.3 | 63% | 0.631 | 46% | 0.46 | S | S | * | . | H | α-helix | trans | -63.8 | -36.1 | -178.1 | -63.9 | -178.8 | 16.2 | 0 | 0 | 112.7 | V217 C222 R223 | V217-Q219 PolarHBondContact O-N 3.25Å; Q219-C222 PolarHBondContact O-N 2.92Å; Q219-R223 WeakPolarHBondContact O-CB 3.39Å; Q219-R223 PolarHBondContact O-N 3.43Å |
| 220 | S | 91.9 | Very high | 82 | Confident | 68 Ų | 68 | 100.1 Ų | 100.1 | 48% | 0.476 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -62.4 | -46.3 | 176.8 | -56.4 | 0 | 0 | 0 | 0 | 111.2 | C218 R223 T224 F226 | C218-S220 VanDerWaalsContact C-N 3.31Å; C218-S220 PolarHBondContact O-N 3.2Å; S220-R223 PolarHBondContact O-N 2.9Å; S220-T224 PolarHBondContact O-N 3.26Å; S220-T224 PolarHBondContact O-OG1 3.19Å; S220-F226 CarbonylContact C-O 3.4Å |
| 221 | Y | 93.1 | Very high | 82.9 | Confident | 31 Ų | 31 | 100.7 Ų | 100.7 | 12% | 0.122 | 48% | 0.481 | C | S | . | . | H | α-helix | trans | -63.1 | -49.2 | 175.2 | -179.3 | -102 | 0 | 0 | 0 | 111.3 | C218 R223 T224 G225 F226 H236 E238 L241 | C218-Y221 PolarHBondContact O-N 3Å; Y221-R223 PolarHBondContact O-N 3.44Å; Y221-R223 VanDerWaalsContact O-N 3.17Å; Y221-T224 PolarHBondContact O-N 3.35Å; Y221-G225 WeakPolarHBondContact CD2-O 3.33Å; Y221-G225 WeakPolarHBondContact CE2-O 3.36Å; Y221-G225 WeakPolarHBondContact O-CA 3.2Å; Y221-G225 PolarHBondContact O-N 2.86Å; Y221-F226 WeakPolarHBondContact CA-O 3.22Å; Y221-F226 PolarHBondContact N-O 3.25Å; Y221-H236 HydrophobicContact CD1-CB 3.84Å; Y221-H236 HydrophobicContact CD2-CB 4.11Å; Y221-H236 AromaticContact CD2-CG 3.98Å; Y221-H236 VanDerWaalsContact CE1-C 3.48Å; Y221-H236 HydrophobicContact CE1-CB 3.86Å; Y221-H236 HydrophobicContact CE2-CB 4.14Å; Y221-H236 HydrophobicContact CG-CB 3.96Å; Y221-H236 AromaticContact CG-CD2 3.67Å; Y221-H236 AromaticContact CG-CG 3.86Å; Y221-E238 WeakPolarHBondContact OH-CG 3.3Å; Y221-L241 HydrophobicContact CD1-CD2 4.07Å; Y221-L241 HydrophobicContact CE1-CD2 3.77Å; Y221-L241 HydrophobicContact CE1-CG 4.15Å; Y221-L241 VanDerWaalsContact O-CD2 3.23Å; Y221-L241 WeakPolarHBondContact O-CD2 3.41Å |
| 222 | C | 92.6 | Very high | 84.4 | Confident | 3 Ų | 3 | 94.4 Ų | 94.4 | 2% | 0.02 | 46% | 0.457 | C | S | . | . | H | α-helix | trans | -58 | -33.4 | 178.1 | -65.5 | 0 | 0 | 0 | 0 | 113.2 | C218 Q219 Y240 R242 | C218-C222 PolarHBondContact O-N 3.27Å; C218-C222 PolarHBondContact O-SG 3.36Å; Q219-C222 PolarHBondContact O-N 2.92Å; C222-Y240 WeakPolarHBondContact CB-O 3.17Å; C222-Y240 VanDerWaalsContact SG-CB 3.59Å; C222-R242 WeakPolarHBondContact O-CB 3.25Å; C222-R242 PolarHBondContact O-N 3.42Å |
| 223 | R | 91.7 | Very high | 86.2 | Confident | 112 Ų | 112 | 90.8 Ų | 90.8 | 42% | 0.423 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -83.2 | -39.1 | -177.9 | -179.4 | 176 | 174.1 | 179.7 | -4.2 | 113.8 | Q219 S220 Y221 | Q219-R223 WeakPolarHBondContact O-CB 3.39Å; Q219-R223 PolarHBondContact O-N 3.43Å; S220-R223 PolarHBondContact O-N 2.9Å; Y221-R223 PolarHBondContact O-N 3.44Å; Y221-R223 VanDerWaalsContact O-N 3.17Å |
| 224 | T | 91.5 | Very high | 87.9 | Confident | 66 Ų | 66 | 86.9 Ų | 86.9 | 41% | 0.405 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -115.4 | -16.5 | -169.3 | 64.8 | 0 | 0 | 0 | 0 | 113.8 | S220 Y221 F226 | S220-T224 PolarHBondContact O-N 3.26Å; S220-T224 PolarHBondContact O-OG1 3.19Å; Y221-T224 PolarHBondContact O-N 3.35Å; T224-F226 PolarHBondContact OG1-N 3.41Å; T224-F226 VanDerWaalsContact OG1-N 3.17Å; T224-F226 PolarHBondContact OG1-O 3.26Å |
| 225 | G | 92.8 | Very high | 89.3 | Confident | 8 Ų | 8 | 78.3 Ų | 78.3 | 8% | 0.082 | 41% | 0.41 | C | S | . | . | S | Bend | trans | 79.1 | -0.7 | -168.8 | 0 | 0 | 0 | 0 | 0 | 114.2 | Y221 P260 | Y221-G225 WeakPolarHBondContact CD2-O 3.33Å; Y221-G225 WeakPolarHBondContact CE2-O 3.36Å; Y221-G225 WeakPolarHBondContact O-CA 3.2Å; Y221-G225 PolarHBondContact O-N 2.86Å; G225-P260 WeakPolarHBondContact CA-O 3.47Å |
| 226 | F | 92.3 | Very high | 90.4 | Very high | 125 Ų | 125 | 72.5 Ų | 72.5 | 55% | 0.548 | 39% | 0.391 | S | S | . | . | trans | -131.9 | 154.4 | 179 | -56.6 | -73.1 | 0 | 0 | 0 | 111.9 | S220 Y221 T224 P260 | S220-F226 CarbonylContact C-O 3.4Å; Y221-F226 WeakPolarHBondContact CA-O 3.22Å; Y221-F226 PolarHBondContact N-O 3.25Å; T224-F226 PolarHBondContact OG1-N 3.41Å; T224-F226 VanDerWaalsContact OG1-N 3.17Å; T224-F226 PolarHBondContact OG1-O 3.26Å; F226-P260 HydrophobicContact CD2-CB 4.24Å; F226-P260 HydrophobicContact CD2-CG 4.3Å; F226-P260 HydrophobicContact CE1-CB 4.14Å; F226-P260 HydrophobicContact CE2-CB 3.55Å; F226-P260 HydrophobicContact CE2-CG 3.46Å; F226-P260 VanDerWaalsContact CE2-CG 3.46Å; F226-P260 HydrophobicContact CZ-CB 3.47Å; F226-P260 VanDerWaalsContact CZ-CB 3.47Å; F226-P260 HydrophobicContact CZ-CG 3.77Å | ||
| 227 | C | 93.9 | Very high | 90.7 | Very high | 18 Ų | 18 | 69 Ų | 69 | 12% | 0.122 | 38% | 0.375 | C | S | . | . | trans | -131.9 | 126 | 172.8 | -171.7 | 0 | 0 | 0 | 0 | 108.8 | V229 H236 | C227-V229 VanDerWaalsContact C-N 3.27Å; C227-V229 PolarHBondContact O-N 3.46Å; C227-H236 WeakPolarHBondContact CB-CE1 3.41Å; C227-H236 WeakPolarHBondContact CB-NE2 3.28Å | ||
| 228 | S | 91.7 | Very high | 90.9 | Very high | 116 Ų | 116 | 74.9 Ų | 74.9 | 81% | 0.811 | 40% | 0.4 | S | S | * | . | S | Bend | trans | -73.9 | -19 | 176.7 | 55.2 | 0 | 0 | 0 | 0 | 113 | ||
| 229 | V | 90.3 | Very high | 90.7 | Very high | 81 Ų | 81 | 77.4 Ų | 77.4 | 49% | 0.491 | 41% | 0.414 | S | S | . | . | trans | -85.8 | 121.1 | -176.9 | -176.4 | 0 | 0 | 0 | 0 | 109.7 | C227 C232 | C227-V229 VanDerWaalsContact C-N 3.27Å; C227-V229 PolarHBondContact O-N 3.46Å; V229-C232 WeakPolarHBondContact O-CB 3.36Å; V229-C232 PolarHBondContact O-N 3.48Å | ||
| 230 | Q | 85.5 | Confident | 90.7 | Very high | 143 Ų | 143 | 74.3 Ų | 74.3 | 67% | 0.668 | 40% | 0.397 | S | S | * | . | S | Bend | trans | -132 | 125 | 176.5 | -62.4 | -63 | -13.9 | 0 | 0 | 110.2 | ||
| 231 | P | 86.1 | Confident | 90.8 | Very high | 124 Ų | 124 | 71.7 Ų | 71.7 | 81% | 0.805 | 38% | 0.377 | S | S | * | . | S | Bend | cis | -73.7 | 132 | -10.5 | 31.3 | -33 | 0 | 0 | 0 | 111.3 | ||
| 232 | C | 90.3 | Very high | 90.7 | Very high | 29 Ų | 29 | 72.3 Ų | 72.3 | 20% | 0.196 | 38% | 0.38 | C | S | . | . | trans | -69.9 | 132.1 | 175.9 | -171.4 | 0 | 0 | 0 | 0 | 111.3 | V229 Y234 H236 | V229-C232 WeakPolarHBondContact O-CB 3.36Å; V229-C232 PolarHBondContact O-N 3.48Å; C232-Y234 VanDerWaalsContact C-N 3.27Å; C232-Y234 PolarHBondContact O-N 3.13Å; C232-H236 WeakPolarHBondContact CB-CE1 3.24Å; C232-H236 WeakPolarHBondContact CB-NE2 3.15Å; C232-H236 PolarHBondContact SG-NE2 3.39Å | ||
| 233 | S | 89.7 | Confident | 90.8 | Very high | 90 Ų | 90 | 72.2 Ų | 72.2 | 63% | 0.629 | 38% | 0.379 | S | S | * | . | S | Bend | trans | -73.2 | -18.5 | 176.5 | 57.2 | 0 | 0 | 0 | 0 | 113.6 | ||
| 234 | Y | 89.6 | Confident | 90.9 | Very high | 124 Ų | 124 | 67 Ų | 67 | 49% | 0.486 | 36% | 0.36 | S | S | . | . | S | Bend | trans | -95.9 | 159.1 | 179.8 | -62.1 | -66.7 | 0 | 0 | 0 | 111.8 | M216 C232 | M216-Y234 HydrophobicContact CB-CD1 3.83Å; M216-Y234 HydrophobicContact CB-CE1 4.11Å; M216-Y234 CarbonylContact O-C 3.52Å; M216-Y234 VanDerWaalsContact O-CA 3.3Å; M216-Y234 WeakPolarHBondContact O-CA 3.37Å; M216-Y234 VanDerWaalsContact O-CB 3.22Å; M216-Y234 WeakPolarHBondContact O-CB 3.31Å; M216-Y234 WeakPolarHBondContact O-CD1 3.33Å; C232-Y234 VanDerWaalsContact C-N 3.27Å; C232-Y234 PolarHBondContact O-N 3.13Å |
| 235 | S | 89.6 | Confident | 90.9 | Very high | 20 Ų | 20 | 65.9 Ų | 65.9 | 14% | 0.14 | 35% | 0.354 | C | S | . | . | B | Isolated β-bridge | trans | -77.9 | 137.7 | 177.9 | 66.6 | 0 | 0 | 0 | 0 | 112.4 | R215 M216 V217 C218 D237 | R215-S235 PolarHBondContact O-OG 3.4Å; M216-S235 PolarHBondContact O-N 2.61Å; V217-S235 WeakPolarHBondContact CA-O 3.39Å; C218-S235 PolarHBondContact N-O 3.45Å; S235-D237 WeakPolarHBondContact CB-OD2 3.41Å; S235-D237 PolarHBondContact OG-OD2 3.27Å |
| 236 | H | 91.9 | Very high | 91 | Very high | 66 Ų | 66 | 72.4 Ų | 72.4 | 31% | 0.306 | 38% | 0.376 | S | S | . | . | trans | -99.8 | 78.4 | 171.9 | -66.4 | 164.1 | 0 | 0 | 0 | 109.6 | C218 Y221 C227 C232 | C218-H236 WeakPolarHBondContact CB-CD2 3.36Å; Y221-H236 HydrophobicContact CD1-CB 3.84Å; Y221-H236 HydrophobicContact CD2-CB 4.11Å; Y221-H236 AromaticContact CD2-CG 3.98Å; Y221-H236 VanDerWaalsContact CE1-C 3.48Å; Y221-H236 HydrophobicContact CE1-CB 3.86Å; Y221-H236 HydrophobicContact CE2-CB 4.14Å; Y221-H236 HydrophobicContact CG-CB 3.96Å; Y221-H236 AromaticContact CG-CD2 3.67Å; Y221-H236 AromaticContact CG-CG 3.86Å; C227-H236 WeakPolarHBondContact CB-CE1 3.41Å; C227-H236 WeakPolarHBondContact CB-NE2 3.28Å; C232-H236 WeakPolarHBondContact CB-CE1 3.24Å; C232-H236 WeakPolarHBondContact CB-NE2 3.15Å; C232-H236 PolarHBondContact SG-NE2 3.39Å | ||
| 237 | D | 90.1 | Very high | 91.1 | Very high | 64 Ų | 64 | 69.2 Ų | 69.2 | 34% | 0.342 | 36% | 0.361 | S | S | . | . | trans | -98.1 | 115.6 | -179.2 | -65.9 | -44.3 | 0 | 0 | 0 | 110.9 | S235 N239 Y240 | S235-D237 WeakPolarHBondContact CB-OD2 3.41Å; S235-D237 PolarHBondContact OG-OD2 3.27Å; D237-N239 PolarHBondContact O-N 3.4Å; D237-Y240 HydrophobicContact CB-CD2 3.78Å; D237-Y240 HydrophobicContact CB-CE2 4.42Å; D237-Y240 PolarHBondContact O-N 3.19Å | ||
| 238 | E | 91.1 | Very high | 91 | Very high | 144 Ų | 144 | 68.9 Ų | 68.9 | 67% | 0.673 | 36% | 0.359 | S | S | * | . | G | 310 helix | trans | -55.7 | -26.9 | 178 | -68.7 | 176.1 | -169.2 | 0 | 0 | 113 | Y221 Y240 L241 | Y221-E238 WeakPolarHBondContact OH-CG 3.3Å; E238-Y240 PolarHBondContact O-N 3.15Å; E238-L241 HydrophobicContact CB-CD1 3.99Å; E238-L241 HydrophobicContact CG-CD1 4.15Å; E238-L241 WeakPolarHBondContact O-CB 3.18Å; E238-L241 WeakPolarHBondContact O-CG 3.5Å; E238-L241 PolarHBondContact O-N 2.55Å; E238-L241 VanDerWaalsContact O-N 3.11Å |
| 239 | N | 89.2 | Confident | 90.9 | Very high | 59 Ų | 59 | 69.4 Ų | 69.4 | 32% | 0.316 | 35% | 0.348 | S | S | . | . | G | 310 helix | trans | -63.4 | -22.7 | 178.4 | -78.8 | -60.7 | 0 | 0 | 0 | 113.7 | R32 D237 R269 | R32-N239 PolarHBondContact NH1-OD1 3.19Å; D237-N239 PolarHBondContact O-N 3.4Å; N239-R269 PolarHBondContact O-NE 2.96Å; N239-R269 PolarHBondContact O-NH2 3.23Å |
| 240 | Y | 90.8 | Very high | 90.9 | Very high | 70 Ų | 70 | 74 Ų | 74 | 28% | 0.275 | 37% | 0.365 | S | S | . | . | G | 310 helix | trans | -100.7 | 5.2 | 178.6 | -68.9 | -96.3 | 0 | 0 | 0 | 112.7 | V217 C222 D237 E238 R242 G306 R307 | V217-Y240 HydrophobicContact CB-CG 4.5Å; V217-Y240 HydrophobicContact CG1-CD1 4.15Å; V217-Y240 HydrophobicContact CG1-CD2 3.75Å; V217-Y240 HydrophobicContact CG1-CE1 4.39Å; V217-Y240 HydrophobicContact CG1-CE2 4.01Å; V217-Y240 HydrophobicContact CG1-CG 3.81Å; V217-Y240 HydrophobicContact CG2-CD1 4.36Å; V217-Y240 HydrophobicContact CG2-CG 4.49Å; C222-Y240 WeakPolarHBondContact CB-O 3.17Å; C222-Y240 VanDerWaalsContact SG-CB 3.59Å; D237-Y240 HydrophobicContact CB-CD2 3.78Å; D237-Y240 HydrophobicContact CB-CE2 4.42Å; D237-Y240 PolarHBondContact O-N 3.19Å; E238-Y240 PolarHBondContact O-N 3.15Å; Y240-R242 PolarHBondContact O-N 3.23Å; Y240-G306 WeakPolarHBondContact O-CA 3.36Å; Y240-R307 HydrophobicContact CD1-CB 4Å; Y240-R307 HydrophobicContact CE1-CB 4.44Å |
| 241 | L | 92.7 | Very high | 91.2 | Very high | 13 Ų | 13 | 70.3 Ų | 70.3 | 7% | 0.068 | 35% | 0.354 | C | S | . | . | P | Polyproline II helix | trans | -62.3 | 133.7 | 172.4 | -69.2 | 170.1 | 0 | 0 | 0 | 110.5 | Y221 E238 P260 A262 R269 | Y221-L241 HydrophobicContact CD1-CD2 4.07Å; Y221-L241 HydrophobicContact CE1-CD2 3.77Å; Y221-L241 HydrophobicContact CE1-CG 4.15Å; Y221-L241 VanDerWaalsContact O-CD2 3.23Å; Y221-L241 WeakPolarHBondContact O-CD2 3.41Å; E238-L241 HydrophobicContact CB-CD1 3.99Å; E238-L241 HydrophobicContact CG-CD1 4.15Å; E238-L241 WeakPolarHBondContact O-CB 3.18Å; E238-L241 WeakPolarHBondContact O-CG 3.5Å; E238-L241 PolarHBondContact O-N 2.55Å; E238-L241 VanDerWaalsContact O-N 3.11Å; L241-P260 WeakPolarHBondContact CD1-O 3.37Å; L241-A262 HydrophobicContact CB-CB 4.32Å; L241-R269 WeakPolarHBondContact O-CD 3.17Å |
| 242 | R | 92.2 | Very high | 91.7 | Very high | 44 Ų | 44 | 65.6 Ų | 65.6 | 17% | 0.166 | 32% | 0.324 | C | S | . | . | P | Polyproline II helix | trans | -63.1 | 151.9 | 170.6 | 178.7 | 178.2 | 159.2 | 176.6 | -4.6 | 110.1 | C222 Y240 A262 W320 | C222-R242 WeakPolarHBondContact O-CB 3.25Å; C222-R242 PolarHBondContact O-N 3.42Å; Y240-R242 PolarHBondContact O-N 3.23Å; R242-A262 PolarHBondContact O-N 3.36Å; R242-W320 HydrophobicContact CG-CZ2 3.82Å; R242-W320 VanDerWaalsContact NE-CD2 3.33Å; R242-W320 VanDerWaalsContact NE-NE1 3.16Å; R242-W320 VanDerWaalsContact NH2-CG 3.3Å |
| 243 | I | 93.4 | Very high | 91.8 | Very high | 0 Ų | 0 | 69.4 Ų | 69.4 | 0% | 0 | 35% | 0.351 | C | S | . | . | B | Isolated β-bridge | trans | -66.2 | 135 | 172.5 | -59.4 | 171.7 | 0 | 0 | 0 | 109.7 | P245 F247 L248 A262 V264 R269 L270 | I243-P245 VanDerWaalsContact O-CD 3.29Å; I243-P245 WeakPolarHBondContact O-CD 3.38Å; I243-F247 HydrophobicContact CG2-CD1 3.72Å; I243-F247 HydrophobicContact CG2-CE1 4.28Å; I243-L248 HydrophobicContact CB-CG 4.48Å; I243-L248 HydrophobicContact CG2-CD1 4.18Å; I243-L248 HydrophobicContact CG2-CD2 3.68Å; I243-L248 HydrophobicContact CG2-CG 3.64Å; I243-A262 VanDerWaalsContact CA-O 3.32Å; I243-A262 WeakPolarHBondContact CA-O 3.38Å; I243-A262 WeakPolarHBondContact CG2-O 3.36Å; I243-V264 WeakPolarHBondContact CD1-O 3.41Å; I243-V264 WeakPolarHBondContact CG1-O 3.19Å; I243-R269 HydrophobicContact CD1-CB 3.73Å; I243-R269 HydrophobicContact CG1-CB 3.68Å; I243-L270 HydrophobicContact CD1-CB 4.38Å; I243-L270 HydrophobicContact CD1-CD2 3.46Å; I243-L270 VanDerWaalsContact CD1-CD2 3.46Å; I243-L270 HydrophobicContact CD1-CG 3.6Å |
| 244 | C | 94.1 | Very high | 92 | Very high | 4 Ų | 4 | 69.1 Ų | 69.1 | 3% | 0.027 | 34% | 0.342 | C | S | . | . | P | Polyproline II helix | trans | -56.8 | 120.1 | 175.6 | 177.5 | 0 | 0 | 0 | 0 | 110.3 | R246 F247 L248 C259 L261 A262 | C244-R246 VanDerWaalsContact C-N 3.26Å; C244-R246 PolarHBondContact O-N 2.88Å; C244-F247 HydrophobicContact CB-CB 3.61Å; C244-F247 WeakPolarHBondContact O-CB 3.47Å; C244-F247 PolarHBondContact O-N 3.03Å; C244-F247 VanDerWaalsContact O-N 3.12Å; C244-F247 PolarHBondContact SG-N 3.17Å; C244-F247 VanDerWaalsContact SG-N 3.45Å; C244-L248 PolarHBondContact O-N 2.99Å; C244-C259 VanDerWaalsContact SG-SG 3.62Å; C244-L261 HydrophobicContact CB-CB 3.69Å; C244-L261 HydrophobicContact CB-CD1 4.27Å; C244-A262 PolarHBondContact N-O 3.37Å |
| 245 | P | 92.4 | Very high | 91.9 | Very high | 42 Ų | 42 | 64.7 Ų | 64.7 | 27% | 0.273 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -60.4 | -36 | 178.3 | -25 | 35 | 0 | 0 | 0 | 112.8 | I243 L248 Q249 W320 | I243-P245 VanDerWaalsContact O-CD 3.29Å; I243-P245 WeakPolarHBondContact O-CD 3.38Å; P245-L248 PolarHBondContact O-N 3.33Å; P245-Q249 WeakPolarHBondContact O-CG 3.33Å; P245-Q249 PolarHBondContact O-N 3.45Å; P245-W320 HydrophobicContact CB-CH2 4.23Å; P245-W320 HydrophobicContact CB-CZ3 4.17Å; P245-W320 HydrophobicContact CG-CH2 3.99Å; P245-W320 HydrophobicContact CG-CZ3 4.12Å |
| 246 | R | 93.9 | Very high | 91.9 | Very high | 145 Ų | 145 | 67.9 Ų | 67.9 | 55% | 0.547 | 36% | 0.356 | S | S | . | . | H | α-helix | trans | -66.3 | -38.4 | 174.9 | -61.2 | -178 | 179.9 | 173.2 | -2 | 111.5 | C244 Q249 Q250 S251 C252 | C244-R246 VanDerWaalsContact C-N 3.26Å; C244-R246 PolarHBondContact O-N 2.88Å; R246-Q249 CarbonylContact O-C 3.58Å; R246-Q249 PolarHBondContact O-N 3.11Å; R246-Q249 VanDerWaalsContact O-N 3.16Å; R246-Q250 PolarHBondContact O-N 2.78Å; R246-S251 PolarHBondContact O-N 3.04Å; R246-S251 PolarHBondContact O-OG 2.81Å; R246-C252 HydrophobicContact CB-CB 3.81Å |
| 247 | F | 94.2 | Very high | 91.7 | Very high | 57 Ų | 57 | 74.3 Ų | 74.3 | 25% | 0.25 | 38% | 0.383 | C | S | . | . | H | α-helix | trans | -63.3 | -41.3 | 174.2 | 169.6 | -105.9 | 0 | 0 | 0 | 111.9 | I243 C244 Q249 Q250 C252 H263 L265 | I243-F247 HydrophobicContact CG2-CD1 3.72Å; I243-F247 HydrophobicContact CG2-CE1 4.28Å; C244-F247 HydrophobicContact CB-CB 3.61Å; C244-F247 WeakPolarHBondContact O-CB 3.47Å; C244-F247 PolarHBondContact O-N 3.03Å; C244-F247 VanDerWaalsContact O-N 3.12Å; C244-F247 PolarHBondContact SG-N 3.17Å; C244-F247 VanDerWaalsContact SG-N 3.45Å; F247-Q249 PolarHBondContact O-N 3.2Å; F247-Q250 PolarHBondContact O-N 3.25Å; F247-C252 HydrophobicContact CB-CB 4.32Å; F247-H263 HydrophobicContact CD1-CB 4.46Å; F247-H263 HydrophobicContact CD2-CB 4.03Å; F247-H263 AromaticContact CD2-CG 3.79Å; F247-H263 AromaticContact CD2-ND1 3.67Å; F247-H263 HydrophobicContact CE2-CB 4.13Å; F247-H263 HydrophobicContact CG-CB 4.2Å; F247-H263 AromaticContact CG-CG 3.89Å; F247-H263 HydrophobicContact CZ-CB 4.38Å; F247-L265 HydrophobicContact CE1-CD2 3.85Å; F247-L265 HydrophobicContact CE1-CG 4.12Å; F247-L265 HydrophobicContact CZ-CD2 4.45Å; F247-L265 HydrophobicContact CZ-CG 4.32Å |
| 248 | L | 91.9 | Very high | 91.8 | Very high | 12 Ų | 12 | 73.5 Ų | 73.5 | 6% | 0.063 | 38% | 0.383 | C | S | . | . | H | α-helix | trans | -62.5 | -26.8 | 174.6 | -70.9 | -178.3 | 0 | 0 | 0 | 113.3 | I243 C244 P245 L265 L270 P271 Y288 W320 | I243-L248 HydrophobicContact CB-CG 4.48Å; I243-L248 HydrophobicContact CG2-CD1 4.18Å; I243-L248 HydrophobicContact CG2-CD2 3.68Å; I243-L248 HydrophobicContact CG2-CG 3.64Å; C244-L248 PolarHBondContact O-N 2.99Å; P245-L248 PolarHBondContact O-N 3.33Å; L248-L265 HydrophobicContact CD2-CD2 3.71Å; L248-L270 HydrophobicContact CD1-CD2 4.47Å; L248-L270 HydrophobicContact CD2-CD2 3.61Å; L248-P271 HydrophobicContact CD1-CG 4.17Å; L248-Y288 HydrophobicContact CD1-CE1 4.12Å; L248-W320 HydrophobicContact CD1-CH2 3.48Å; L248-W320 VanDerWaalsContact CD1-CH2 3.48Å; L248-W320 HydrophobicContact CD1-CZ2 4.09Å; L248-W320 HydrophobicContact CD1-CZ3 4.26Å |
| 249 | Q | 90.4 | Very high | 91.9 | Very high | 127 Ų | 127 | 67.4 Ų | 67.4 | 59% | 0.593 | 36% | 0.356 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -93.4 | 3.4 | 176 | -66.7 | 171.5 | -12.4 | 0 | 0 | 112.7 | P245 R246 F247 S251 | P245-Q249 WeakPolarHBondContact O-CG 3.33Å; P245-Q249 PolarHBondContact O-N 3.45Å; R246-Q249 CarbonylContact O-C 3.58Å; R246-Q249 PolarHBondContact O-N 3.11Å; R246-Q249 VanDerWaalsContact O-N 3.16Å; F247-Q249 PolarHBondContact O-N 3.2Å; Q249-S251 PolarHBondContact O-N 3.44Å |
| 250 | Q | 89.5 | Confident | 92.1 | Very high | 178 Ų | 178 | 66.4 Ų | 66.4 | 83% | 0.832 | 35% | 0.353 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 58.8 | 25.4 | -176.2 | -55.5 | 174.7 | -6.3 | 0 | 0 | 114.3 | R246 F247 | R246-Q250 PolarHBondContact O-N 2.78Å; F247-Q250 PolarHBondContact O-N 3.25Å |
| 251 | S | 93.1 | Very high | 92.3 | Very high | 65 Ų | 65 | 64.3 Ų | 64.3 | 46% | 0.455 | 35% | 0.346 | S | S | . | . | trans | -116.4 | 19.2 | -175.4 | 62.7 | 0 | 0 | 0 | 0 | 113.8 | R246 Q249 S253 | R246-S251 PolarHBondContact O-N 3.04Å; R246-S251 PolarHBondContact O-OG 2.81Å; Q249-S251 PolarHBondContact O-N 3.44Å; S251-S253 PolarHBondContact O-N 3.06Å | ||
| 252 | C | 94.8 | Very high | 92.3 | Very high | 25 Ų | 25 | 64.2 Ų | 64.2 | 17% | 0.169 | 35% | 0.347 | C | S | . | . | trans | -87.9 | 104.2 | -178 | -165.8 | 0 | 0 | 0 | 0 | 112.1 | R246 F247 L254 H263 | R246-C252 HydrophobicContact CB-CB 3.81Å; F247-C252 HydrophobicContact CB-CB 4.32Å; C252-L254 VanDerWaalsContact C-N 3.29Å; C252-L254 PolarHBondContact O-N 2.06Å; C252-H263 PolarHBondContact SG-CE1 2.87Å; C252-H263 PolarHBondContact SG-NE2 2.87Å | ||
| 253 | S | 93.6 | Very high | 92.4 | Very high | 109 Ų | 109 | 63.7 Ų | 63.7 | 76% | 0.762 | 35% | 0.347 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -69.6 | -18.8 | 177.8 | 54.8 | 0 | 0 | 0 | 0 | 115.3 | S251 | S251-S253 PolarHBondContact O-N 3.06Š|
| 254 | L | 92.5 | Very high | 92.3 | Very high | 84 Ų | 84 | 67.1 Ų | 67.1 | 44% | 0.44 | 37% | 0.367 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -77.1 | -20.9 | -176.5 | -69 | -179.1 | 0 | 0 | 0 | 113.1 | C252 S258 C259 | C252-L254 VanDerWaalsContact C-N 3.29Å; C252-L254 PolarHBondContact O-N 2.06Å; L254-S258 VanDerWaalsContact C-OG 3.28Å; L254-S258 WeakPolarHBondContact CA-OG 3.46Å; L254-S258 VanDerWaalsContact CB-OG 3.24Å; L254-S258 WeakPolarHBondContact CB-OG 3.44Å; L254-S258 PolarHBondContact O-OG 3.46Å; L254-C259 HydrophobicContact CB-CB 4.02Å |
| 255 | G | 89 | Confident | 92.1 | Very high | 31 Ų | 31 | 71.4 Ų | 71.4 | 32% | 0.32 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | 64.8 | 178.5 | -172.1 | 0 | 0 | 0 | 0 | 0 | 113.7 | K257 C259 H263 | G255-K257 VanDerWaalsContact C-N 3.35Å; G255-K257 PolarHBondContact O-N 2.83Å; G255-C259 WeakPolarHBondContact O-CB 3.39Å; G255-C259 PolarHBondContact O-N 3.17Å; G255-C259 VanDerWaalsContact O-N 3.15Å; G255-H263 PolarHBondContact O-CE1 2.98Å; G255-H263 VanDerWaalsContact O-CE1 3.23Å |
| 256 | S | 88.6 | Confident | 92 | Very high | 87 Ų | 87 | 69.5 Ų | 69.5 | 61% | 0.608 | 38% | 0.377 | S | S | * | . | H | α-helix | trans | -70.8 | -25.9 | -171.9 | 58.9 | 0 | 0 | 0 | 0 | 114.6 | H263 | S256-H263 WeakPolarHBondContact CA-ND1 3.3Å; S256-H263 PolarHBondContact N-ND1 3.49Å |
| 257 | K | 88 | Confident | 91.9 | Very high | 200 Ų | 200 | 64.4 Ų | 64.4 | 87% | 0.87 | 36% | 0.363 | S | S | * | . | H | α-helix | trans | -85.7 | -30.7 | -175.9 | -65.7 | 179.3 | -177.8 | 171.6 | 0 | 113.3 | G255 | G255-K257 VanDerWaalsContact C-N 3.35Å; G255-K257 PolarHBondContact O-N 2.83Å |
| 258 | S | 92.5 | Very high | 91.8 | Very high | 48 Ų | 48 | 61.7 Ų | 61.7 | 34% | 0.336 | 35% | 0.351 | S | S | . | . | H | α-helix | trans | -106.1 | -18.3 | -176.8 | 85.9 | 0 | 0 | 0 | 0 | 113.7 | L254 | L254-S258 VanDerWaalsContact C-OG 3.28Å; L254-S258 WeakPolarHBondContact CA-OG 3.46Å; L254-S258 VanDerWaalsContact CB-OG 3.24Å; L254-S258 WeakPolarHBondContact CB-OG 3.44Å; L254-S258 PolarHBondContact O-OG 3.46Å |
| 259 | C | 93.9 | Very high | 91.8 | Very high | 16 Ų | 16 | 61.8 Ų | 61.8 | 11% | 0.108 | 35% | 0.35 | C | S | . | . | trans | -69.8 | 129.6 | 173.2 | -167.4 | 0 | 0 | 0 | 0 | 110.5 | C244 L254 G255 L261 H263 | C244-C259 VanDerWaalsContact SG-SG 3.62Å; L254-C259 HydrophobicContact CB-CB 4.02Å; G255-C259 WeakPolarHBondContact O-CB 3.39Å; G255-C259 PolarHBondContact O-N 3.17Å; G255-C259 VanDerWaalsContact O-N 3.15Å; C259-L261 PolarHBondContact O-N 3.07Å; C259-H263 WeakPolarHBondContact CB-NE2 3.41Å; C259-H263 PolarHBondContact SG-NE2 3.31Å | ||
| 260 | P | 93.4 | Very high | 92 | Very high | 38 Ų | 38 | 55.9 Ų | 55.9 | 25% | 0.247 | 32% | 0.323 | C | S | . | . | S | Bend | trans | -75.1 | -2.2 | 179.9 | 36.1 | -42.5 | 0 | 0 | 0 | 112.9 | G225 F226 L241 | G225-P260 WeakPolarHBondContact CA-O 3.47Å; F226-P260 HydrophobicContact CD2-CB 4.24Å; F226-P260 HydrophobicContact CD2-CG 4.3Å; F226-P260 HydrophobicContact CE1-CB 4.14Å; F226-P260 HydrophobicContact CE2-CB 3.55Å; F226-P260 HydrophobicContact CE2-CG 3.46Å; F226-P260 VanDerWaalsContact CE2-CG 3.46Å; F226-P260 HydrophobicContact CZ-CB 3.47Å; F226-P260 VanDerWaalsContact CZ-CB 3.47Å; F226-P260 HydrophobicContact CZ-CG 3.77Å; L241-P260 WeakPolarHBondContact CD1-O 3.37Å |
| 261 | L | 94 | Very high | 92.2 | Very high | 25 Ų | 25 | 47.7 Ų | 47.7 | 13% | 0.131 | 29% | 0.285 | C | S | . | . | S | Bend | trans | -111.6 | 162.8 | -178.9 | -67.3 | 179 | 0 | 0 | 0 | 110.8 | C244 C259 H263 | C244-L261 HydrophobicContact CB-CB 3.69Å; C244-L261 HydrophobicContact CB-CD1 4.27Å; C259-L261 PolarHBondContact O-N 3.07Å; L261-H263 PolarHBondContact O-N 2.89Å |
| 262 | A | 93.1 | Very high | 92.2 | Very high | 12 Ų | 12 | 45 Ų | 45 | 10% | 0.099 | 27% | 0.265 | C | S | . | . | B | Isolated β-bridge | trans | -71.8 | 126.9 | -176.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | L241 R242 I243 C244 | L241-A262 HydrophobicContact CB-CB 4.32Å; R242-A262 PolarHBondContact O-N 3.36Å; I243-A262 VanDerWaalsContact CA-O 3.32Å; I243-A262 WeakPolarHBondContact CA-O 3.38Å; I243-A262 WeakPolarHBondContact CG2-O 3.36Å; C244-A262 PolarHBondContact N-O 3.37Å |
| 263 | H | 93.3 | Very high | 92.2 | Very high | 33 Ų | 33 | 44 Ų | 44 | 15% | 0.153 | 26% | 0.258 | C | S | . | . | trans | -99.7 | 64 | 169 | -78.2 | -147 | 0 | 0 | 0 | 110.1 | F247 C252 G255 S256 C259 L261 | F247-H263 HydrophobicContact CD1-CB 4.46Å; F247-H263 HydrophobicContact CD2-CB 4.03Å; F247-H263 AromaticContact CD2-CG 3.79Å; F247-H263 AromaticContact CD2-ND1 3.67Å; F247-H263 HydrophobicContact CE2-CB 4.13Å; F247-H263 HydrophobicContact CG-CB 4.2Å; F247-H263 AromaticContact CG-CG 3.89Å; F247-H263 HydrophobicContact CZ-CB 4.38Å; C252-H263 PolarHBondContact SG-CE1 2.87Å; C252-H263 PolarHBondContact SG-NE2 2.87Å; G255-H263 PolarHBondContact O-CE1 2.98Å; G255-H263 VanDerWaalsContact O-CE1 3.23Å; S256-H263 WeakPolarHBondContact CA-ND1 3.3Å; S256-H263 PolarHBondContact N-ND1 3.49Å; C259-H263 WeakPolarHBondContact CB-NE2 3.41Å; C259-H263 PolarHBondContact SG-NE2 3.31Å; L261-H263 PolarHBondContact O-N 2.89Å | ||
| 264 | V | 91.1 | Very high | 92.1 | Very high | 71 Ų | 71 | 43 Ų | 43 | 43% | 0.43 | 25% | 0.248 | S | C | . | . | trans | -144.3 | 132.1 | -179.3 | -177.1 | 0 | 0 | 0 | 0 | 109.5 | I243 D266 | I243-V264 WeakPolarHBondContact CD1-O 3.41Å; I243-V264 WeakPolarHBondContact CG1-O 3.19Å; V264-D266 VanDerWaalsContact C-N 3.26Å; V264-D266 HydrophobicContact CG1-CB 4.18Å; V264-D266 PolarHBondContact O-N 3.22Å | ||
| 265 | L | 91.3 | Very high | 92.2 | Very high | 95 Ų | 95 | 45.9 Ų | 45.9 | 50% | 0.497 | 25% | 0.254 | S | S | . | . | trans | -82.6 | 67 | 172.6 | -61.2 | 178.2 | 0 | 0 | 0 | 111 | F247 L248 L270 P287 | F247-L265 HydrophobicContact CE1-CD2 3.85Å; F247-L265 HydrophobicContact CE1-CG 4.12Å; F247-L265 HydrophobicContact CZ-CD2 4.45Å; F247-L265 HydrophobicContact CZ-CG 4.32Å; L248-L265 HydrophobicContact CD2-CD2 3.71Å; L265-L270 HydrophobicContact CD2-CD2 4.33Å; L265-P287 HydrophobicContact CD2-CB 4.17Å | ||
| 266 | D | 90.7 | Very high | 92.5 | Very high | 2 Ų | 2 | 47.8 Ų | 47.8 | 1% | 0.011 | 25% | 0.252 | C | S | . | . | trans | -91.5 | 119.7 | 176.3 | -172.1 | 11 | 0 | 0 | 0 | 110.1 | V264 C268 R269 L270 R307 | V264-D266 VanDerWaalsContact C-N 3.26Å; V264-D266 HydrophobicContact CG1-CB 4.18Å; V264-D266 PolarHBondContact O-N 3.22Å; D266-C268 PolarHBondContact O-N 3.47Å; D266-C268 PolarHBondContact OD1-N 2.89Å; D266-C268 PolarHBondContact OD1-SG 3.43Å; D266-R269 HydrophobicContact CB-CG 4.39Å; D266-R269 PolarHBondContact O-N 3.28Å; D266-L270 WeakPolarHBondContact O-CG 3.47Å; D266-L270 PolarHBondContact O-N 2.73Å; D266-L270 VanDerWaalsContact O-N 3.13Å; D266-R307 IonicContact OD2-NE 3.79Å; D266-R307 IonicContact OD2-NH2 3.64Å | ||
| 267 | P | 91.4 | Very high | 92.6 | Very high | 37 Ų | 37 | 46.1 Ų | 46.1 | 24% | 0.24 | 24% | 0.235 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -55.5 | -23.8 | 178.3 | 21.7 | -34.7 | 0 | 0 | 0 | 113.8 | R269 L289 G311 R312 | P267-R269 PolarHBondContact O-N 3.45Å; P267-L289 HydrophobicContact CB-CD2 4.09Å; P267-G311 WeakPolarHBondContact O-CA 3.46Å; P267-R312 HydrophobicContact CB-CG 3.97Å |
| 268 | C | 91.8 | Very high | 92.8 | Very high | 1 Ų | 1 | 39.4 Ų | 39.4 | 1% | 0.007 | 21% | 0.213 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -74.4 | -13.9 | 179.4 | -35.6 | 0 | 0 | 0 | 0 | 112.2 | C29 D266 R307 C308 | C29-C268 HydrophobicContact CB-CB 4.03Å; C29-C268 WeakPolarHBondContact CB-SG 3.34Å; C29-C268 WeakPolarHBondContact SG-CB 2.92Å; C29-C268 CovalentContact SG-SG 2.06Å; C29-C268 PolarHBondContact SG-SG 3.37Å; D266-C268 PolarHBondContact O-N 3.47Å; D266-C268 PolarHBondContact OD1-N 2.89Å; D266-C268 PolarHBondContact OD1-SG 3.43Å; C268-R307 HydrophobicContact CB-CG 4.14Å; C268-R307 CarbonylContact O-C 3.59Å; C268-R307 WeakPolarHBondContact O-CA 3.32Å; C268-C308 WeakPolarHBondContact CA-O 3.47Å; C268-C308 WeakPolarHBondContact CB-O 3.17Å; C268-C308 PolarHBondContact O-N 2.96Å |
| 269 | R | 92.1 | Very high | 92.8 | Very high | 13 Ų | 13 | 43.6 Ų | 43.6 | 5% | 0.049 | 23% | 0.227 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -120.1 | -7.2 | 178.4 | -58.6 | 176 | -179.9 | 160 | -3.1 | 113.6 | N239 L241 I243 D266 P267 F303 R307 | N239-R269 PolarHBondContact O-NE 2.96Å; N239-R269 PolarHBondContact O-NH2 3.23Å; L241-R269 WeakPolarHBondContact O-CD 3.17Å; I243-R269 HydrophobicContact CD1-CB 3.73Å; I243-R269 HydrophobicContact CG1-CB 3.68Å; D266-R269 HydrophobicContact CB-CG 4.39Å; D266-R269 PolarHBondContact O-N 3.28Å; P267-R269 PolarHBondContact O-N 3.45Å; R269-F303 WeakPolarHBondContact O-CE2 3.4Å; R269-R307 HydrophobicContact CG-CB 4.4Å; R269-R307 HydrophobicContact CG-CG 4.15Å |
| 270 | L | 93.5 | Very high | 92.8 | Very high | 4 Ų | 4 | 50 Ų | 50 | 2% | 0.021 | 25% | 0.253 | C | S | . | . | P | Polyproline II helix | trans | -77.6 | 134.8 | -177.3 | -79.6 | 167.5 | 0 | 0 | 0 | 111.7 | I243 L248 L265 D266 P287 L289 F303 H318 | I243-L270 HydrophobicContact CD1-CB 4.38Å; I243-L270 HydrophobicContact CD1-CD2 3.46Å; I243-L270 VanDerWaalsContact CD1-CD2 3.46Å; I243-L270 HydrophobicContact CD1-CG 3.6Å; L248-L270 HydrophobicContact CD1-CD2 4.47Å; L248-L270 HydrophobicContact CD2-CD2 3.61Å; L265-L270 HydrophobicContact CD2-CD2 4.33Å; D266-L270 WeakPolarHBondContact O-CG 3.47Å; D266-L270 PolarHBondContact O-N 2.73Å; D266-L270 VanDerWaalsContact O-N 3.13Å; L270-P287 WeakPolarHBondContact CD1-O 3.06Å; L270-P287 VanDerWaalsContact CD2-O 3.3Å; L270-P287 WeakPolarHBondContact CD2-O 3.42Å; L270-L289 HydrophobicContact CB-CD1 4.39Å; L270-L289 HydrophobicContact CB-CD2 3.9Å; L270-L289 HydrophobicContact CB-CG 3.85Å; L270-L289 HydrophobicContact CD1-CD2 4.37Å; L270-L289 WeakPolarHBondContact O-CD1 3.45Å; L270-F303 VanDerWaalsContact O-CE2 3.28Å; L270-F303 WeakPolarHBondContact O-CE2 3.1Å; L270-H318 PolarHBondContact O-ND1 3.44Å |
| 271 | P | 94.4 | Very high | 92.9 | Very high | 6 Ų | 6 | 49.8 Ų | 49.8 | 4% | 0.039 | 25% | 0.252 | C | S | . | . | P | Polyproline II helix | trans | -71.4 | 160.1 | 169.1 | 26 | -28 | 0 | 0 | 0 | 112 | L248 Y288 L289 F303 H318 W320 | L248-P271 HydrophobicContact CD1-CG 4.17Å; P271-Y288 HydrophobicContact CB-CD1 4.45Å; P271-Y288 HydrophobicContact CG-CD1 3.73Å; P271-Y288 HydrophobicContact CG-CE1 3.76Å; P271-L289 PolarHBondContact O-N 3.26Å; P271-F303 HydrophobicContact CB-CZ 3.85Å; P271-H318 CarbonylContact C-O 3.44Å; P271-H318 VanDerWaalsContact CA-O 3.3Å; P271-H318 WeakPolarHBondContact CA-O 3.45Å; P271-W320 HydrophobicContact CB-CD2 4.06Å; P271-W320 HydrophobicContact CB-CE3 4.42Å; P271-W320 HydrophobicContact CG-CD2 3.95Å; P271-W320 HydrophobicContact CG-CE3 4.04Å; P271-W320 HydrophobicContact CG-CH2 3.91Å; P271-W320 HydrophobicContact CG-CZ2 3.68Å; P271-W320 HydrophobicContact CG-CZ3 4.05Å |
| 272 | Q | 93.6 | Very high | 92.9 | Very high | 8 Ų | 8 | 57.4 Ų | 57.4 | 4% | 0.037 | 29% | 0.287 | C | S | . | . | B | Isolated β-bridge | trans | -66.3 | 144.5 | 171.1 | -178 | 177.6 | -20.1 | 0 | 0 | 111.2 | T274 E277 V291 H293 H318 | Q272-T274 PolarHBondContact O-N 3.06Å; Q272-E277 PolarHBondContact NE2-OE1 2.96Å; Q272-E277 VanDerWaalsContact NE2-OE1 3.13Å; Q272-E277 PolarHBondContact NE2-OE2 3.3Å; Q272-V291 HydrophobicContact CB-CG2 4.31Å; Q272-V291 HydrophobicContact CG-CG2 3.76Å; Q272-V291 PolarHBondContact NE2-O 3.08Å; Q272-H293 PolarHBondContact OE1-CD2 2.94Å; Q272-H318 PolarHBondContact N-O 2.82Å |
| 273 | C | 94.4 | Very high | 92.9 | Very high | 3 Ų | 3 | 64.5 Ų | 64.5 | 2% | 0.02 | 31% | 0.311 | C | S | . | . | trans | -76.6 | 111.1 | 173.5 | -176.1 | 0 | 0 | 0 | 0 | 109.5 | Y275 Y276 E277 Y288 L289 | C273-Y275 VanDerWaalsContact C-N 3.27Å; C273-Y275 PolarHBondContact O-N 3.21Å; C273-Y276 PolarHBondContact O-N 3Å; C273-Y276 PolarHBondContact SG-N 3.03Å; C273-E277 PolarHBondContact O-N 3.02Å; C273-Y288 HydrophobicContact CB-CG 4.44Å; C273-L289 PolarHBondContact N-O 3.18Å | ||
| 274 | T | 92.3 | Very high | 92.7 | Very high | 90 Ų | 90 | 69.1 Ų | 69.1 | 55% | 0.552 | 34% | 0.341 | S | S | * | . | H | α-helix | trans | -63.2 | -34.2 | 177.7 | 52.8 | 0 | 0 | 0 | 0 | 112.1 | Q272 E277 S278 | Q272-T274 PolarHBondContact O-N 3.06Å; T274-E277 PolarHBondContact O-N 3.24Å; T274-S278 PolarHBondContact O-N 2.86Å; T274-S278 VanDerWaalsContact O-N 3.12Å; T274-S278 PolarHBondContact O-OG 3.29Å |
| 275 | Y | 94.3 | Very high | 92.6 | Very high | 144 Ų | 144 | 73.2 Ų | 73.2 | 57% | 0.565 | 36% | 0.356 | S | S | * | . | H | α-helix | trans | -69.2 | -38 | 176.1 | -63.4 | -79.9 | 0 | 0 | 0 | 112.1 | C273 S278 E279 K280 C281 | C273-Y275 VanDerWaalsContact C-N 3.27Å; C273-Y275 PolarHBondContact O-N 3.21Å; Y275-S278 CarbonylContact O-C 3.35Å; Y275-S278 PolarHBondContact O-N 3.38Å; Y275-S278 PolarHBondContact O-OG 2.89Å; Y275-S278 VanDerWaalsContact O-OG 3.09Å; Y275-E279 PolarHBondContact O-N 3.06Å; Y275-K280 PolarHBondContact O-N 3.3Å; Y275-C281 PolarHBondContact O-N 2.85Å |
| 276 | Y | 94.3 | Very high | 92.6 | Very high | 70 Ų | 70 | 69.5 Ų | 69.5 | 28% | 0.275 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -71.5 | -35.6 | 177.1 | -178.3 | -97.4 | 0 | 0 | 0 | 111.6 | C273 S278 E279 H290 R292 | C273-Y276 PolarHBondContact O-N 3Å; C273-Y276 PolarHBondContact SG-N 3.03Å; Y276-S278 VanDerWaalsContact C-N 3.25Å; Y276-S278 PolarHBondContact O-N 2.86Å; Y276-E279 PolarHBondContact O-N 3.28Å; Y276-E279 VanDerWaalsContact O-N 3.14Å; Y276-H290 VanDerWaalsContact CD1-C 3.42Å; Y276-H290 HydrophobicContact CD1-CB 3.7Å; Y276-H290 HydrophobicContact CD2-CB 3.77Å; Y276-H290 AromaticContact CD2-CD2 3.83Å; Y276-H290 AromaticContact CD2-CE1 3.96Å; Y276-H290 AromaticContact CD2-CG 3.47Å; Y276-H290 VanDerWaalsContact CD2-CG 3.47Å; Y276-H290 AromaticContact CD2-ND1 3.57Å; Y276-H290 HydrophobicContact CE1-CB 3.71Å; Y276-H290 HydrophobicContact CE2-CB 3.82Å; Y276-H290 AromaticContact CE2-CG 3.91Å; Y276-H290 AromaticContact CE2-ND1 3.9Å; Y276-H290 HydrophobicContact CG-CB 3.71Å; Y276-H290 AromaticContact CG-CD2 3.63Å; Y276-H290 AromaticContact CG-CG 3.58Å; Y276-R292 HydrophobicContact CD1-CG 4.17Å; Y276-R292 HydrophobicContact CE1-CG 3.8Å; Y276-R292 PolarHBondContact O-NE 3.24Å |
| 277 | E | 91.7 | Very high | 92.6 | Very high | 53 Ų | 53 | 71.1 Ų | 71.1 | 25% | 0.248 | 35% | 0.348 | C | S | . | . | H | α-helix | trans | -59.8 | -36.5 | 171.6 | -171.7 | 171.4 | -149.9 | 0 | 0 | 111.6 | Q272 C273 T274 | Q272-E277 PolarHBondContact NE2-OE1 2.96Å; Q272-E277 VanDerWaalsContact NE2-OE1 3.13Å; Q272-E277 PolarHBondContact NE2-OE2 3.3Å; C273-E277 PolarHBondContact O-N 3.02Å; T274-E277 PolarHBondContact O-N 3.24Å |
| 278 | S | 91.6 | Very high | 92.7 | Very high | 58 Ų | 58 | 71.8 Ų | 71.8 | 41% | 0.406 | 35% | 0.346 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -92.5 | 10.1 | 174.8 | 70.5 | 0 | 0 | 0 | 0 | 114.9 | T274 Y275 Y276 K280 | T274-S278 PolarHBondContact O-N 2.86Å; T274-S278 VanDerWaalsContact O-N 3.12Å; T274-S278 PolarHBondContact O-OG 3.29Å; Y275-S278 CarbonylContact O-C 3.35Å; Y275-S278 PolarHBondContact O-N 3.38Å; Y275-S278 PolarHBondContact O-OG 2.89Å; Y275-S278 VanDerWaalsContact O-OG 3.09Å; Y276-S278 VanDerWaalsContact C-N 3.25Å; Y276-S278 PolarHBondContact O-N 2.86Å; S278-K280 VanDerWaalsContact C-N 3.31Å; S278-K280 WeakPolarHBondContact O-CG 3.05Å; S278-K280 PolarHBondContact O-N 3.31Å |
| 279 | E | 92.1 | Very high | 92.8 | Very high | 137 Ų | 137 | 71.8 Ų | 71.8 | 64% | 0.64 | 35% | 0.346 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 62.8 | 23.2 | -179.9 | -35.4 | -160.9 | 153.6 | 0 | 0 | 116.6 | Y275 Y276 R292 | Y275-E279 PolarHBondContact O-N 3.06Å; Y276-E279 PolarHBondContact O-N 3.28Å; Y276-E279 VanDerWaalsContact O-N 3.14Å; E279-R292 VanDerWaalsContact CG-NH2 3.31Å; E279-R292 IonicContact OE1-CZ 2.61Å; E279-R292 IonicContact OE1-NE 3.93Å; E279-R292 IonicContact OE1-NH1 3.72Å; E279-R292 PolarHBondContact OE1-NH1 2.72Å; E279-R292 IonicContact OE1-NH2 3.95Å |
| 280 | K | 94.8 | Very high | 92.9 | Very high | 151 Ų | 151 | 74.1 Ų | 74.1 | 66% | 0.657 | 36% | 0.357 | S | S | * | . | trans | -112.5 | 11.9 | -176.5 | -64.3 | 174.4 | -174.6 | -175.2 | 0 | 114.3 | Y275 S278 E282 | Y275-K280 PolarHBondContact O-N 3.3Å; S278-K280 VanDerWaalsContact C-N 3.31Å; S278-K280 WeakPolarHBondContact O-CG 3.05Å; S278-K280 PolarHBondContact O-N 3.31Å; K280-E282 PolarHBondContact O-N 2.87Å | ||
| 281 | C | 95.2 | Very high | 92.8 | Very high | 33 Ų | 33 | 75 Ų | 75 | 22% | 0.223 | 36% | 0.363 | C | S | . | . | trans | -87.3 | 109.9 | -178.2 | -168.7 | 0 | 0 | 0 | 0 | 110.6 | Y275 H290 | Y275-C281 PolarHBondContact O-N 2.85Å; C281-H290 PolarHBondContact SG-NE2 3.45Å | ||
| 282 | E | 94.4 | Very high | 92.6 | Very high | 184 Ų | 184 | 80.8 Ų | 80.8 | 86% | 0.86 | 38% | 0.384 | S | S | * | . | trans | -96.1 | -4 | 178.4 | -65.6 | 170.1 | -169.1 | 0 | 0 | 113.1 | K280 V284 | K280-E282 PolarHBondContact O-N 2.87Å; E282-V284 PolarHBondContact O-N 3.36Å | ||
| 283 | R | 92.1 | Very high | 92.5 | Very high | 162 Ų | 162 | 82.1 Ų | 82.1 | 61% | 0.611 | 39% | 0.39 | S | S | * | . | trans | -75.3 | 117.6 | -176.3 | -65.3 | -177.3 | -174.4 | 172 | 0.1 | 111.6 | H285 C286 | R283-H285 VanDerWaalsContact C-N 3.33Å; R283-H285 PolarHBondContact O-N 2.83Å; R283-C286 HydrophobicContact CB-CB 4.19Å | ||
| 284 | V | 89.6 | Confident | 92.3 | Very high | 129 Ų | 129 | 86 Ų | 86 | 78% | 0.782 | 42% | 0.415 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -56.6 | -44.4 | 175.8 | -176.8 | 0 | 0 | 0 | 0 | 111.9 | E282 | E282-V284 PolarHBondContact O-N 3.36Š|
| 285 | H | 88.2 | Confident | 92 | Very high | 158 Ų | 158 | 87.6 Ų | 87.6 | 73% | 0.731 | 43% | 0.427 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -115.1 | 60.4 | -179.2 | -61 | -51.4 | 0 | 0 | 0 | 112.1 | R283 | R283-H285 VanDerWaalsContact C-N 3.33Å; R283-H285 PolarHBondContact O-N 2.83Å |
| 286 | C | 91.6 | Very high | 91.7 | Very high | 17 Ų | 17 | 90.4 Ų | 90.4 | 12% | 0.115 | 44% | 0.442 | C | S | . | . | trans | -67.9 | 125.8 | 176.9 | -170.1 | 0 | 0 | 0 | 0 | 111.6 | R283 Y288 H290 | R283-C286 HydrophobicContact CB-CB 4.19Å; C286-Y288 PolarHBondContact O-N 3.12Å; C286-H290 WeakPolarHBondContact CB-NE2 3.4Å; C286-H290 PolarHBondContact SG-NE2 3.43Å; C286-H290 VanDerWaalsContact SG-NE2 3.37Å | ||
| 287 | P | 91.4 | Very high | 91.6 | Very high | 36 Ų | 36 | 88 Ų | 88 | 23% | 0.234 | 44% | 0.435 | C | S | . | . | S | Bend | trans | -72 | -19.1 | 179 | 28.5 | -34.4 | 0 | 0 | 0 | 112.6 | L265 L270 | L265-P287 HydrophobicContact CD2-CB 4.17Å; L270-P287 WeakPolarHBondContact CD1-O 3.06Å; L270-P287 VanDerWaalsContact CD2-O 3.3Å; L270-P287 WeakPolarHBondContact CD2-O 3.42Å |
| 288 | Y | 93.8 | Very high | 91.7 | Very high | 51 Ų | 51 | 88.6 Ų | 88.6 | 20% | 0.2 | 45% | 0.449 | C | S | . | . | S | Bend | trans | -78.9 | 160.9 | -179.6 | -64.3 | -91.3 | 0 | 0 | 0 | 112 | L248 P271 C273 C286 H290 | L248-Y288 HydrophobicContact CD1-CE1 4.12Å; P271-Y288 HydrophobicContact CB-CD1 4.45Å; P271-Y288 HydrophobicContact CG-CD1 3.73Å; P271-Y288 HydrophobicContact CG-CE1 3.76Å; C273-Y288 HydrophobicContact CB-CG 4.44Å; C286-Y288 PolarHBondContact O-N 3.12Å; Y288-H290 PolarHBondContact O-N 3.44Å |
| 289 | L | 93.1 | Very high | 91.8 | Very high | 1 Ų | 1 | 88.2 Ų | 88.2 | 1% | 0.005 | 44% | 0.442 | C | S | . | . | B | Isolated β-bridge | trans | -73.7 | 116.6 | 178.1 | -54.6 | 177.2 | 0 | 0 | 0 | 110.7 | P267 L270 P271 C273 V291 R312 H318 | P267-L289 HydrophobicContact CB-CD2 4.09Å; L270-L289 HydrophobicContact CB-CD1 4.39Å; L270-L289 HydrophobicContact CB-CD2 3.9Å; L270-L289 HydrophobicContact CB-CG 3.85Å; L270-L289 HydrophobicContact CD1-CD2 4.37Å; L270-L289 WeakPolarHBondContact O-CD1 3.45Å; P271-L289 PolarHBondContact O-N 3.26Å; C273-L289 PolarHBondContact N-O 3.18Å; L289-V291 VanDerWaalsContact C-N 3.33Å; L289-V291 HydrophobicContact CB-CG1 4.45Å; L289-V291 HydrophobicContact CB-CG2 4.19Å; L289-V291 PolarHBondContact O-N 2.92Å; L289-V291 VanDerWaalsContact O-N 3.11Å; L289-R312 HydrophobicContact CD2-CG 3.56Å; L289-H318 HydrophobicContact CD1-CB 4.37Å; L289-H318 WeakPolarHBondContact CD1-ND1 3.47Å |
| 290 | H | 93.8 | Very high | 92 | Very high | 61 Ų | 61 | 81.8 Ų | 81.8 | 28% | 0.282 | 41% | 0.412 | S | S | . | . | trans | -79.7 | 81.7 | 167.8 | -74.9 | -171.7 | 0 | 0 | 0 | 109.7 | Y276 C281 C286 Y288 | Y276-H290 VanDerWaalsContact CD1-C 3.42Å; Y276-H290 HydrophobicContact CD1-CB 3.7Å; Y276-H290 HydrophobicContact CD2-CB 3.77Å; Y276-H290 AromaticContact CD2-CD2 3.83Å; Y276-H290 AromaticContact CD2-CE1 3.96Å; Y276-H290 AromaticContact CD2-CG 3.47Å; Y276-H290 VanDerWaalsContact CD2-CG 3.47Å; Y276-H290 AromaticContact CD2-ND1 3.57Å; Y276-H290 HydrophobicContact CE1-CB 3.71Å; Y276-H290 HydrophobicContact CE2-CB 3.82Å; Y276-H290 AromaticContact CE2-CG 3.91Å; Y276-H290 AromaticContact CE2-ND1 3.9Å; Y276-H290 HydrophobicContact CG-CB 3.71Å; Y276-H290 AromaticContact CG-CD2 3.63Å; Y276-H290 AromaticContact CG-CG 3.58Å; C281-H290 PolarHBondContact SG-NE2 3.45Å; C286-H290 WeakPolarHBondContact CB-NE2 3.4Å; C286-H290 PolarHBondContact SG-NE2 3.43Å; C286-H290 VanDerWaalsContact SG-NE2 3.37Å; Y288-H290 PolarHBondContact O-N 3.44Å | ||
| 291 | V | 91.8 | Very high | 91.8 | Very high | 24 Ų | 24 | 77.2 Ų | 77.2 | 15% | 0.145 | 40% | 0.399 | C | S | . | . | trans | -130.3 | 142.4 | 174.9 | -64.6 | 0 | 0 | 0 | 0 | 109.1 | Q272 L289 | Q272-V291 HydrophobicContact CB-CG2 4.31Å; Q272-V291 HydrophobicContact CG-CG2 3.76Å; Q272-V291 PolarHBondContact NE2-O 3.08Å; L289-V291 VanDerWaalsContact C-N 3.33Å; L289-V291 HydrophobicContact CB-CG1 4.45Å; L289-V291 HydrophobicContact CB-CG2 4.19Å; L289-V291 PolarHBondContact O-N 2.92Å; L289-V291 VanDerWaalsContact O-N 3.11Å | ||
| 292 | R | 91 | Very high | 91.6 | Very high | 127 Ų | 127 | 77.4 Ų | 77.4 | 48% | 0.479 | 40% | 0.398 | S | S | . | . | trans | -111.8 | 135 | 172.6 | -70 | -174.8 | -174.7 | 164.5 | 8 | 109.1 | Y276 E279 | Y276-R292 HydrophobicContact CD1-CG 4.17Å; Y276-R292 HydrophobicContact CE1-CG 3.8Å; Y276-R292 PolarHBondContact O-NE 3.24Å; E279-R292 VanDerWaalsContact CG-NH2 3.31Å; E279-R292 IonicContact OE1-CZ 2.61Å; E279-R292 IonicContact OE1-NE 3.93Å; E279-R292 IonicContact OE1-NH1 3.72Å; E279-R292 PolarHBondContact OE1-NH1 2.72Å; E279-R292 IonicContact OE1-NH2 3.95Å | ||
| 293 | H | 90.9 | Very high | 91.6 | Very high | 35 Ų | 35 | 69 Ų | 69 | 16% | 0.162 | 36% | 0.358 | C | S | . | . | trans | -126.1 | 152 | 176.1 | -66.7 | -53.4 | 0 | 0 | 0 | 109.2 | Q272 T297 C314 R317 | Q272-H293 PolarHBondContact OE1-CD2 2.94Å; H293-T297 HydrophobicContact CB-CG2 4.14Å; H293-C314 PolarHBondContact CE1-O 3.4Å; H293-R317 HydrophobicContact CB-CG 4.03Å | ||
| 294 | P | 90.7 | Very high | 91.5 | Very high | 84 Ų | 84 | 64.6 Ų | 64.6 | 55% | 0.545 | 35% | 0.353 | S | S | . | . | trans | -61.4 | 152.4 | 173.8 | 20.2 | -26.3 | 0 | 0 | 0 | 111.1 | K296 T297 | P294-K296 PolarHBondContact O-N 3.48Å; P294-T297 WeakPolarHBondContact CD-OG1 3.5Å; P294-T297 WeakPolarHBondContact CG-OG1 3.38Å; P294-T297 WeakPolarHBondContact O-CB 3.49Å; P294-T297 PolarHBondContact O-N 3.4Å; P294-T297 PolarHBondContact O-OG1 2.96Å | ||
| 295 | P | 85.5 | Confident | 91.3 | Very high | 124 Ų | 124 | 63.9 Ų | 63.9 | 81% | 0.805 | 34% | 0.336 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -61.8 | -14.9 | -169.5 | 22.5 | -34.1 | 0 | 0 | 0 | 114.7 | ||
| 296 | K | 88.7 | Confident | 91.3 | Very high | 203 Ų | 203 | 56.8 Ų | 56.8 | 88% | 0.883 | 31% | 0.306 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -103.4 | 7.9 | 179.5 | -62.9 | -177.9 | -179.8 | 177.1 | 0 | 113.9 | P294 A298 | P294-K296 PolarHBondContact O-N 3.48Å; K296-A298 PolarHBondContact O-N 2.91Å |
| 297 | T | 92.4 | Very high | 91.3 | Very high | 21 Ų | 21 | 57.5 Ų | 57.5 | 13% | 0.129 | 31% | 0.306 | C | S | . | . | P | Polyproline II helix | trans | -67.2 | 130.4 | -179.2 | -65.3 | 0 | 0 | 0 | 0 | 112 | H293 P294 N315 R317 | H293-T297 HydrophobicContact CB-CG2 4.14Å; P294-T297 WeakPolarHBondContact CD-OG1 3.5Å; P294-T297 WeakPolarHBondContact CG-OG1 3.38Å; P294-T297 WeakPolarHBondContact O-CB 3.49Å; P294-T297 PolarHBondContact O-N 3.4Å; P294-T297 PolarHBondContact O-OG1 2.96Å; T297-N315 VanDerWaalsContact CG2-O 3.24Å; T297-N315 WeakPolarHBondContact CG2-O 3.31Å; T297-R317 HydrophobicContact CG2-CG 4.01Å; T297-R317 PolarHBondContact O-NE 3.07Å; T297-R317 PolarHBondContact O-NH2 2.63Å |
| 298 | A | 94 | Very high | 91.4 | Very high | 64 Ų | 64 | 55.8 Ų | 55.8 | 53% | 0.529 | 30% | 0.295 | S | S | . | . | P | Polyproline II helix | trans | -62.3 | 153.8 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | K296 R317 | K296-A298 PolarHBondContact O-N 2.91Å; A298-R317 PolarHBondContact O-N 3.46Å |
| 299 | I | 93.6 | Very high | 91.2 | Very high | 51 Ų | 51 | 54.3 Ų | 54.3 | 26% | 0.262 | 29% | 0.291 | S | S | . | . | B | Isolated β-bridge | trans | -71.3 | 139.2 | 173.7 | -58.8 | 175.1 | 0 | 0 | 0 | 109 | S301 V321 L337 | I299-S301 PolarHBondContact O-N 3.39Å; I299-V321 HydrophobicContact CD1-CG2 3.83Å; I299-V321 HydrophobicContact CG2-CG2 4.49Å; I299-L337 HydrophobicContact CD1-CD1 4.18Å |
| 300 | C | 94.5 | Very high | 91.1 | Very high | 2 Ų | 2 | 57.5 Ų | 57.5 | 1% | 0.014 | 31% | 0.308 | C | S | . | . | trans | -68.2 | 112.7 | 178.4 | -177.1 | 0 | 0 | 0 | 0 | 111.3 | D302 F303 S304 C308 K316 R317 H318 | C300-D302 PolarHBondContact O-N 3.19Å; C300-F303 HydrophobicContact CB-CB 3.71Å; C300-F303 PolarHBondContact O-N 3.01Å; C300-F303 PolarHBondContact SG-N 3.35Å; C300-F303 VanDerWaalsContact SG-N 3.45Å; C300-S304 PolarHBondContact O-N 3.11Å; C300-C308 VanDerWaalsContact SG-SG 3.62Å; C300-K316 HydrophobicContact CB-CB 3.62Å; C300-R317 WeakPolarHBondContact CB-O 3.47Å; C300-R317 PolarHBondContact N-O 3.42Å; C300-H318 VanDerWaalsContact CB-CD2 3.47Å; C300-H318 WeakPolarHBondContact CB-CD2 3.29Å | ||
| 301 | S | 91.7 | Very high | 90.9 | Very high | 55 Ų | 55 | 54.7 Ų | 54.7 | 39% | 0.385 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -62.6 | -24.5 | 176.1 | 55.1 | 0 | 0 | 0 | 0 | 113.7 | I299 S304 R305 | I299-S301 PolarHBondContact O-N 3.39Å; S301-S304 WeakPolarHBondContact CA-OG 2.92Å; S301-S304 PolarHBondContact O-OG 3.18Å; S301-R305 VanDerWaalsContact O-CG 3.26Å; S301-R305 WeakPolarHBondContact O-CG 3.4Å; S301-R305 PolarHBondContact O-N 3.44Å; S301-R305 PolarHBondContact O-NE 3.1Å; S301-R305 VanDerWaalsContact O-NE 3.1Å |
| 302 | D | 91.1 | Very high | 90.9 | Very high | 36 Ų | 36 | 60.1 Ų | 60.1 | 19% | 0.193 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -79.3 | -40.1 | 177.4 | -59.8 | -17.1 | 0 | 0 | 0 | 110.4 | C300 R305 G306 R307 C308 P309 | C300-D302 PolarHBondContact O-N 3.19Å; D302-R305 PolarHBondContact O-N 3.08Å; D302-R305 IonicContact OD1-CZ 3.09Å; D302-R305 IonicContact OD1-NE 2.64Å; D302-R305 IonicContact OD1-NH2 3.51Å; D302-R305 PolarHBondContact OD1-NH2 2.88Å; D302-G306 PolarHBondContact O-N 2.87Å; D302-R307 CarbonylContact C-O 3.54Å; D302-R307 CarbonylContact O-C 3.27Å; D302-R307 VanDerWaalsContact O-C 3.27Å; D302-R307 PolarHBondContact O-N 3.39Å; D302-R307 VanDerWaalsContact O-O 3.07Å; D302-C308 HydrophobicContact CB-CB 4.21Å; D302-P309 WeakPolarHBondContact OD2-CD 3.4Å |
| 303 | F | 93.4 | Very high | 90.9 | Very high | 7 Ų | 7 | 58 Ų | 58 | 3% | 0.031 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -65.3 | -41 | 174.3 | -177 | -101.9 | 0 | 0 | 0 | 112 | R269 L270 P271 C300 R305 G306 C308 H318 W320 | R269-F303 WeakPolarHBondContact O-CE2 3.4Å; L270-F303 VanDerWaalsContact O-CE2 3.28Å; L270-F303 WeakPolarHBondContact O-CE2 3.1Å; P271-F303 HydrophobicContact CB-CZ 3.85Å; C300-F303 HydrophobicContact CB-CB 3.71Å; C300-F303 PolarHBondContact O-N 3.01Å; C300-F303 PolarHBondContact SG-N 3.35Å; C300-F303 VanDerWaalsContact SG-N 3.45Å; F303-R305 PolarHBondContact O-N 3.39Å; F303-G306 WeakPolarHBondContact O-CA 3.23Å; F303-G306 PolarHBondContact O-N 3.18Å; F303-C308 HydrophobicContact CB-CB 4.24Å; F303-H318 HydrophobicContact CD1-CB 3.95Å; F303-H318 HydrophobicContact CD2-CB 3.83Å; F303-H318 AromaticContact CD2-CG 3.62Å; F303-H318 AromaticContact CD2-ND1 3.69Å; F303-H318 VanDerWaalsContact CE1-C 3.4Å; F303-H318 HydrophobicContact CE1-CB 4.04Å; F303-H318 HydrophobicContact CE2-CB 3.93Å; F303-H318 HydrophobicContact CG-CB 3.83Å; F303-H318 AromaticContact CG-CD2 3.9Å; F303-H318 AromaticContact CG-CG 3.72Å; F303-H318 HydrophobicContact CZ-CB 4.03Å; F303-W320 AromaticContact CE1-CD1 3.35Å; F303-W320 HydrophobicContact CE1-CG 4.28Å; F303-W320 AromaticContact CE1-NE1 3.67Å; F303-W320 AromaticContact CZ-CD1 3.48Å; F303-W320 VanDerWaalsContact CZ-CD1 3.48Å; F303-W320 HydrophobicContact CZ-CG 4.45Å; F303-W320 AromaticContact CZ-NE1 3.25Å |
| 304 | S | 90 | Very high | 91 | Very high | 71 Ų | 71 | 56.6 Ų | 56.6 | 50% | 0.497 | 31% | 0.305 | S | S | . | . | H | α-helix | trans | -63 | -26.5 | 176.2 | 68.1 | 0 | 0 | 0 | 0 | 112.8 | C300 S301 G306 | C300-S304 PolarHBondContact O-N 3.11Å; S301-S304 WeakPolarHBondContact CA-OG 2.92Å; S301-S304 PolarHBondContact O-OG 3.18Å; S304-G306 VanDerWaalsContact C-N 3.26Å; S304-G306 PolarHBondContact O-N 2.85Å |
| 305 | R | 86.8 | Confident | 91.1 | Very high | 114 Ų | 114 | 59.1 Ų | 59.1 | 43% | 0.43 | 31% | 0.314 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -81.2 | 0.9 | 171.2 | -67.8 | -177.6 | -64.4 | 173.9 | 2.7 | 114 | V217 S301 D302 F303 | V217-R305 HydrophobicContact CG2-CB 4.49Å; S301-R305 VanDerWaalsContact O-CG 3.26Å; S301-R305 WeakPolarHBondContact O-CG 3.4Å; S301-R305 PolarHBondContact O-N 3.44Å; S301-R305 PolarHBondContact O-NE 3.1Å; S301-R305 VanDerWaalsContact O-NE 3.1Å; D302-R305 PolarHBondContact O-N 3.08Å; D302-R305 IonicContact OD1-CZ 3.09Å; D302-R305 IonicContact OD1-NE 2.64Å; D302-R305 IonicContact OD1-NH2 3.51Å; D302-R305 PolarHBondContact OD1-NH2 2.88Å; F303-R305 PolarHBondContact O-N 3.39Å |
| 306 | G | 87.6 | Confident | 91.5 | Very high | 9 Ų | 9 | 57.8 Ų | 57.8 | 9% | 0.093 | 30% | 0.296 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 109.2 | -21.1 | 173.1 | 0 | 0 | 0 | 0 | 0 | 115.4 | Y240 D302 F303 S304 | Y240-G306 WeakPolarHBondContact O-CA 3.36Å; D302-G306 PolarHBondContact O-N 2.87Å; F303-G306 WeakPolarHBondContact O-CA 3.23Å; F303-G306 PolarHBondContact O-N 3.18Å; S304-G306 VanDerWaalsContact C-N 3.26Å; S304-G306 PolarHBondContact O-N 2.85Å |
| 307 | R | 90.8 | Very high | 91.7 | Very high | 32 Ų | 32 | 50.3 Ų | 50.3 | 12% | 0.121 | 26% | 0.262 | C | S | . | . | trans | -153.5 | 120.7 | -179.8 | -171.5 | 174.6 | -175.8 | -90.8 | -5.3 | 112.6 | C29 Y240 D266 C268 R269 D302 | C29-R307 PolarHBondContact O-NH2 3.43Å; Y240-R307 HydrophobicContact CD1-CB 4Å; Y240-R307 HydrophobicContact CE1-CB 4.44Å; D266-R307 IonicContact OD2-NE 3.79Å; D266-R307 IonicContact OD2-NH2 3.64Å; C268-R307 HydrophobicContact CB-CG 4.14Å; C268-R307 CarbonylContact O-C 3.59Å; C268-R307 WeakPolarHBondContact O-CA 3.32Å; R269-R307 HydrophobicContact CG-CB 4.4Å; R269-R307 HydrophobicContact CG-CG 4.15Å; D302-R307 CarbonylContact C-O 3.54Å; D302-R307 CarbonylContact O-C 3.27Å; D302-R307 VanDerWaalsContact O-C 3.27Å; D302-R307 PolarHBondContact O-N 3.39Å; D302-R307 VanDerWaalsContact O-O 3.07Å | ||
| 308 | C | 93.7 | Very high | 91.9 | Very high | 0 Ų | 0 | 49.5 Ų | 49.5 | 0% | 0 | 26% | 0.257 | C | S | . | . | trans | -90.9 | 127.4 | 170.9 | -178.1 | 0 | 0 | 0 | 0 | 111.2 | C268 C300 D302 F303 L310 G311 C314 H318 | C268-C308 WeakPolarHBondContact CA-O 3.47Å; C268-C308 WeakPolarHBondContact CB-O 3.17Å; C268-C308 PolarHBondContact O-N 2.96Å; C300-C308 VanDerWaalsContact SG-SG 3.62Å; D302-C308 HydrophobicContact CB-CB 4.21Å; F303-C308 HydrophobicContact CB-CB 4.24Å; C308-L310 PolarHBondContact O-N 3.31Å; C308-L310 PolarHBondContact SG-N 3.38Å; C308-L310 VanDerWaalsContact SG-N 3.4Å; C308-G311 PolarHBondContact O-N 2.95Å; C308-C314 VanDerWaalsContact SG-SG 3.61Å; C308-H318 VanDerWaalsContact CB-CE1 3.41Å; C308-H318 WeakPolarHBondContact CB-CE1 3.32Å; C308-H318 VanDerWaalsContact CB-NE2 3.31Å; C308-H318 WeakPolarHBondContact CB-NE2 3.37Å; C308-H318 PolarHBondContact SG-NE2 3.15Å; C308-H318 VanDerWaalsContact SG-NE2 3.4Å | ||
| 309 | P | 90.6 | Very high | 91.7 | Very high | 19 Ų | 19 | 48.8 Ų | 48.8 | 12% | 0.123 | 24% | 0.243 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -65.7 | -24.8 | 176.8 | 26.8 | -33.6 | 0 | 0 | 0 | 113.5 | N28 C29 Q30 D302 | N28-P309 PolarHBondContact OD1-O 2.97Å; C29-P309 WeakPolarHBondContact CB-O 3.44Å; C29-P309 PolarHBondContact N-O 3.06Å; C29-P309 VanDerWaalsContact N-O 3.07Å; C29-P309 PolarHBondContact SG-O 3.06Å; Q30-P309 HydrophobicContact CG-CB 3.76Å; D302-P309 WeakPolarHBondContact OD2-CD 3.4Å |
| 310 | L | 91.2 | Very high | 91.5 | Very high | 69 Ų | 69 | 49 Ų | 49 | 36% | 0.361 | 24% | 0.241 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -84.7 | -21.3 | -177.4 | -59.1 | 176.3 | 0 | 0 | 0 | 113.2 | C308 R312 L313 C314 | C308-L310 PolarHBondContact O-N 3.31Å; C308-L310 PolarHBondContact SG-N 3.38Å; C308-L310 VanDerWaalsContact SG-N 3.4Å; L310-R312 PolarHBondContact O-N 3.3Å; L310-L313 WeakPolarHBondContact O-CB 3.29Å; L310-L313 PolarHBondContact O-N 3.37Å; L310-C314 HydrophobicContact CB-CB 3.87Å |
| 311 | G | 89.7 | Confident | 90.9 | Very high | 2 Ų | 2 | 52.4 Ų | 52.4 | 2% | 0.021 | 26% | 0.262 | C | S | . | . | G | 310 helix | trans | 52.4 | -123.3 | 179.8 | 0 | 0 | 0 | 0 | 0 | 112.8 | P267 C308 L313 C314 H318 | P267-G311 WeakPolarHBondContact O-CA 3.46Å; C308-G311 PolarHBondContact O-N 2.95Å; G311-L313 PolarHBondContact O-N 2.95Å; G311-C314 WeakPolarHBondContact O-CB 3.43Å; G311-C314 PolarHBondContact O-N 2.79Å; G311-H318 PolarHBondContact O-CE1 3.25Å; G311-H318 VanDerWaalsContact O-CE1 3.27Å |
| 312 | R | 90.2 | Very high | 89.7 | Confident | 137 Ų | 137 | 57.6 Ų | 57.6 | 52% | 0.517 | 28% | 0.279 | S | S | . | . | G | 310 helix | trans | -58.7 | -23.9 | 177.2 | -75.5 | 173.7 | -170.7 | -97.6 | 0.2 | 113.9 | P267 L289 L310 C314 | P267-R312 HydrophobicContact CB-CG 3.97Å; L289-R312 HydrophobicContact CD2-CG 3.56Å; L310-R312 PolarHBondContact O-N 3.3Å; R312-C314 VanDerWaalsContact C-N 3.33Å |
| 313 | L | 91 | Very high | 88.3 | Confident | 82 Ų | 82 | 63.2 Ų | 63.2 | 43% | 0.429 | 30% | 0.302 | S | S | . | . | G | 310 helix | trans | -93.4 | 8.7 | -176.5 | -56.2 | 168.3 | 0 | 0 | 0 | 112.4 | V26 S27 L310 G311 | V26-L313 HydrophobicContact CG1-CD1 3.41Å; V26-L313 VanDerWaalsContact CG1-CD1 3.41Å; V26-L313 HydrophobicContact CG1-CD2 4.05Å; V26-L313 HydrophobicContact CG1-CG 4.31Å; S27-L313 VanDerWaalsContact O-CD1 3.31Å; S27-L313 WeakPolarHBondContact O-CD1 3.22Å; L310-L313 WeakPolarHBondContact O-CB 3.29Å; L310-L313 PolarHBondContact O-N 3.37Å; G311-L313 PolarHBondContact O-N 2.95Å |
| 314 | C | 93.6 | Very high | 86 | Confident | 7 Ų | 7 | 67.1 Ų | 67.1 | 5% | 0.047 | 33% | 0.33 | C | S | . | . | trans | -74.2 | 130.9 | 179.2 | -164.2 | 0 | 0 | 0 | 0 | 110.5 | H293 C308 L310 G311 R312 K316 H318 | H293-C314 PolarHBondContact CE1-O 3.4Å; C308-C314 VanDerWaalsContact SG-SG 3.61Å; L310-C314 HydrophobicContact CB-CB 3.87Å; G311-C314 WeakPolarHBondContact O-CB 3.43Å; G311-C314 PolarHBondContact O-N 2.79Å; R312-C314 VanDerWaalsContact C-N 3.33Å; C314-K316 PolarHBondContact O-N 2.92Å; C314-H318 VanDerWaalsContact CB-NE2 3.33Å; C314-H318 WeakPolarHBondContact CB-NE2 3.09Å | ||
| 315 | N | 92.9 | Very high | 83.8 | Confident | 136 Ų | 136 | 72.7 Ų | 72.7 | 73% | 0.727 | 35% | 0.346 | S | S | * | . | S | Bend | trans | -82.1 | 10.6 | 175 | -60.7 | -10 | 0 | 0 | 0 | 113 | T297 | T297-N315 VanDerWaalsContact CG2-O 3.24Å; T297-N315 WeakPolarHBondContact CG2-O 3.31Å |
| 316 | K | 94.2 | Very high | 81.7 | Confident | 96 Ų | 96 | 73.1 Ų | 73.1 | 42% | 0.417 | 36% | 0.356 | S | S | . | . | S | Bend | trans | -124.2 | 149.9 | -176.7 | -62.9 | -176.8 | -177.1 | -174.4 | 0 | 109.9 | C300 C314 H318 | C300-K316 HydrophobicContact CB-CB 3.62Å; C314-K316 PolarHBondContact O-N 2.92Å; K316-H318 PolarHBondContact O-CD2 2.85Å; K316-H318 PolarHBondContact O-N 2.87Å |
| 317 | R | 93.8 | Very high | 79.4 | Confident | 47 Ų | 47 | 79.2 Ų | 79.2 | 18% | 0.177 | 39% | 0.387 | C | S | . | . | B | Isolated β-bridge | trans | -70.7 | 128.7 | -174.2 | -62.7 | -167.6 | -66.5 | 158.5 | -3.1 | 112.3 | H293 T297 A298 C300 I319 | H293-R317 HydrophobicContact CB-CG 4.03Å; T297-R317 HydrophobicContact CG2-CG 4.01Å; T297-R317 PolarHBondContact O-NE 3.07Å; T297-R317 PolarHBondContact O-NH2 2.63Å; A298-R317 PolarHBondContact O-N 3.46Å; C300-R317 WeakPolarHBondContact CB-O 3.47Å; C300-R317 PolarHBondContact N-O 3.42Å; R317-I319 HydrophobicContact CB-CD1 3.82Å; R317-I319 HydrophobicContact CB-CG1 4.07Å; R317-I319 HydrophobicContact CG-CD1 4.48Å; R317-I319 PolarHBondContact O-N 3.02Å |
| 318 | H | 94.6 | Very high | 77 | Confident | 4 Ų | 4 | 88.4 Ų | 88.4 | 2% | 0.019 | 43% | 0.428 | C | S | . | . | trans | -91.9 | 77.7 | 174.6 | -74.8 | -170.7 | 0 | 0 | 0 | 110.4 | L270 P271 Q272 L289 C300 F303 C308 G311 C314 K316 | L270-H318 PolarHBondContact O-ND1 3.44Å; P271-H318 CarbonylContact C-O 3.44Å; P271-H318 VanDerWaalsContact CA-O 3.3Å; P271-H318 WeakPolarHBondContact CA-O 3.45Å; Q272-H318 PolarHBondContact N-O 2.82Å; L289-H318 HydrophobicContact CD1-CB 4.37Å; L289-H318 WeakPolarHBondContact CD1-ND1 3.47Å; C300-H318 VanDerWaalsContact CB-CD2 3.47Å; C300-H318 WeakPolarHBondContact CB-CD2 3.29Å; F303-H318 HydrophobicContact CD1-CB 3.95Å; F303-H318 HydrophobicContact CD2-CB 3.83Å; F303-H318 AromaticContact CD2-CG 3.62Å; F303-H318 AromaticContact CD2-ND1 3.69Å; F303-H318 VanDerWaalsContact CE1-C 3.4Å; F303-H318 HydrophobicContact CE1-CB 4.04Å; F303-H318 HydrophobicContact CE2-CB 3.93Å; F303-H318 HydrophobicContact CG-CB 3.83Å; F303-H318 AromaticContact CG-CD2 3.9Å; F303-H318 AromaticContact CG-CG 3.72Å; F303-H318 HydrophobicContact CZ-CB 4.03Å; C308-H318 VanDerWaalsContact CB-CE1 3.41Å; C308-H318 WeakPolarHBondContact CB-CE1 3.32Å; C308-H318 VanDerWaalsContact CB-NE2 3.31Å; C308-H318 WeakPolarHBondContact CB-NE2 3.37Å; C308-H318 PolarHBondContact SG-NE2 3.15Å; C308-H318 VanDerWaalsContact SG-NE2 3.4Å; G311-H318 PolarHBondContact O-CE1 3.25Å; G311-H318 VanDerWaalsContact O-CE1 3.27Å; C314-H318 VanDerWaalsContact CB-NE2 3.33Å; C314-H318 WeakPolarHBondContact CB-NE2 3.09Å; K316-H318 PolarHBondContact O-CD2 2.85Å; K316-H318 PolarHBondContact O-N 2.87Å | ||
| 319 | I | 91.4 | Very high | 74.7 | Confident | 48 Ų | 48 | 93.3 Ų | 93.3 | 25% | 0.246 | 46% | 0.462 | C | S | . | . | trans | -114.7 | 136.1 | -178.1 | -59.9 | 167.8 | 0 | 0 | 0 | 109.9 | R317 V321 | R317-I319 HydrophobicContact CB-CD1 3.82Å; R317-I319 HydrophobicContact CB-CG1 4.07Å; R317-I319 HydrophobicContact CG-CD1 4.48Å; R317-I319 PolarHBondContact O-N 3.02Å; I319-V321 PolarHBondContact O-N 3.34Å | ||
| 320 | W | 89 | Confident | 72 | Confident | 57 Ų | 57 | 95.6 Ų | 95.6 | 22% | 0.216 | 49% | 0.489 | C | S | . | . | trans | -79 | 105.6 | 171.7 | -66.7 | -34.9 | 0 | 0 | 0 | 110.1 | R242 P245 L248 P271 F303 Q322 | R242-W320 HydrophobicContact CG-CZ2 3.82Å; R242-W320 VanDerWaalsContact NE-CD2 3.33Å; R242-W320 VanDerWaalsContact NE-NE1 3.16Å; R242-W320 VanDerWaalsContact NH2-CG 3.3Å; P245-W320 HydrophobicContact CB-CH2 4.23Å; P245-W320 HydrophobicContact CB-CZ3 4.17Å; P245-W320 HydrophobicContact CG-CH2 3.99Å; P245-W320 HydrophobicContact CG-CZ3 4.12Å; L248-W320 HydrophobicContact CD1-CH2 3.48Å; L248-W320 VanDerWaalsContact CD1-CH2 3.48Å; L248-W320 HydrophobicContact CD1-CZ2 4.09Å; L248-W320 HydrophobicContact CD1-CZ3 4.26Å; P271-W320 HydrophobicContact CB-CD2 4.06Å; P271-W320 HydrophobicContact CB-CE3 4.42Å; P271-W320 HydrophobicContact CG-CD2 3.95Å; P271-W320 HydrophobicContact CG-CE3 4.04Å; P271-W320 HydrophobicContact CG-CH2 3.91Å; P271-W320 HydrophobicContact CG-CZ2 3.68Å; P271-W320 HydrophobicContact CG-CZ3 4.05Å; F303-W320 AromaticContact CE1-CD1 3.35Å; F303-W320 HydrophobicContact CE1-CG 4.28Å; F303-W320 AromaticContact CE1-NE1 3.67Å; F303-W320 AromaticContact CZ-CD1 3.48Å; F303-W320 VanDerWaalsContact CZ-CD1 3.48Å; F303-W320 HydrophobicContact CZ-CG 4.45Å; F303-W320 AromaticContact CZ-NE1 3.25Å; W320-Q322 PolarHBondContact O-N 3.37Å | ||
| 321 | V | 80.9 | Confident | 69.4 | Low | 73 Ų | 73 | 101.2 Ų | 101.2 | 44% | 0.442 | 51% | 0.513 | S | S | . | . | trans | -67.3 | 108.3 | 176.3 | -175.3 | 0 | 0 | 0 | 0 | 108.9 | I299 I319 K323 | I299-V321 HydrophobicContact CD1-CG2 3.83Å; I299-V321 HydrophobicContact CG2-CG2 4.49Å; I319-V321 PolarHBondContact O-N 3.34Å; V321-K323 PolarHBondContact O-N 3.06Å | ||
| 322 | Q | 66.5 | Low | 67.2 | Low | 163 Ų | 163 | 109.4 Ų | 109.4 | 76% | 0.762 | 55% | 0.55 | S | S | * | * | trans | -73.1 | 114.4 | 165.4 | -70 | 178.8 | -53 | 0 | 0 | 106.9 | W320 S324 | W320-Q322 PolarHBondContact O-N 3.37Å; Q322-S324 PolarHBondContact O-N 2.98Å | ||
| 323 | K | 61.9 | Low | 64.7 | Low | 155 Ų | 155 | 111.1 Ų | 111.1 | 67% | 0.674 | 56% | 0.562 | S | S | * | * | trans | -66.4 | 103.9 | 168 | -160.1 | 173 | -174.1 | -178 | 0 | 105.5 | V321 F325 | V321-K323 PolarHBondContact O-N 3.06Å; K323-F325 PolarHBondContact O-N 3.3Å | ||
| 324 | S | 45.2 | Very low | 62.2 | Low | 88 Ų | 88 | 116.3 Ų | 116.3 | 62% | 0.615 | 59% | 0.589 | S | S | * | * | trans | -61.2 | 124.9 | 167.8 | 45.4 | 0 | 0 | 0 | 0 | 106.8 | Q322 L326 | Q322-S324 PolarHBondContact O-N 2.98Å; S324-L326 PolarHBondContact O-N 3.43Å | ||
| 325 | F | 44.6 | Very low | 59.6 | Low | 189 Ų | 189 | 119.4 Ų | 119.4 | 83% | 0.829 | 61% | 0.61 | S | S | * | * | trans | -73.2 | 81.5 | 167.2 | -61.5 | -85.5 | 0 | 0 | 0 | 106.3 | K323 N327 | K323-F325 PolarHBondContact O-N 3.3Å; F325-N327 PolarHBondContact O-N 3.07Å | ||
| 326 | L | 41.7 | Very low | 57.1 | Low | 122 Ų | 122 | 121.8 Ų | 121.8 | 64% | 0.639 | 61% | 0.614 | S | S | * | * | trans | -68.5 | 124.5 | 158.3 | -100.7 | 84.1 | 0 | 0 | 0 | 106.6 | S324 | S324-L326 PolarHBondContact O-N 3.43Š| ||
| 327 | N | 39 | Very low | 54.5 | Low | 138 Ų | 138 | 123 Ų | 123 | 74% | 0.738 | 63% | 0.625 | S | S | * | * | trans | -48.8 | 148.2 | 177.7 | -65 | -32.7 | 0 | 0 | 0 | 111.1 | F325 S329 | F325-N327 PolarHBondContact O-N 3.07Å; N327-S329 PolarHBondContact O-N 3.11Å | ||
| 328 | K | 42.1 | Very low | 51.7 | Low | 225 Ų | 225 | 125.8 Ų | 125.8 | 98% | 0.978 | 65% | 0.647 | S | S | * | * | S | Bend | trans | -60.3 | 24.5 | -169.1 | -72.5 | 177.2 | 174.4 | 175.3 | 0 | 117.1 | ||
| 329 | S | 45.2 | Very low | 49 | Very low | 102 Ų | 102 | 131.7 Ų | 131.7 | 71% | 0.713 | 68% | 0.677 | S | S | * | * | S | Bend | trans | -99.3 | 131.3 | 170.5 | 52.6 | 0 | 0 | 0 | 0 | 110 | N327 | N327-S329 PolarHBondContact O-N 3.11Š|
| 330 | G | 33.6 | Very low | 46.3 | Very low | 67 Ų | 67 | 135.9 Ų | 135.9 | 69% | 0.691 | 71% | 0.705 | S | S | * | * | S | Bend | trans | -52.3 | 159.5 | -166 | 0 | 0 | 0 | 0 | 0 | 117.4 | ||
| 331 | H | 36 | Very low | 43.8 | Very low | 187 Ų | 187 | 137.9 Ų | 137.9 | 87% | 0.866 | 73% | 0.727 | S | S | * | * | trans | 58.3 | 102.2 | 166 | -70.3 | -90.7 | 0 | 0 | 0 | 116.8 | ||||
| 332 | Q | 44.4 | Very low | 41.5 | Very low | 174 Ų | 174 | 144.4 Ų | 144.4 | 81% | 0.813 | 75% | 0.75 | S | S | * | * | trans | -159.1 | 105.9 | 136.8 | -107.1 | 158.9 | 87 | 0 | 0 | 113 | ||||
| 333 | K | 37 | Very low | 40 | Very low | 174 Ų | 174 | 139.9 Ų | 139.9 | 76% | 0.757 | 75% | 0.747 | S | S | * | * | trans | 10.4 | 121.4 | 140 | -133.9 | 164.8 | -176.7 | 172.5 | 0 | 116.2 | S335 | K333-S335 PolarHBondContact O-N 3.43Š| ||
| 334 | L | 39 | Very low | 38.7 | Very low | 191 Ų | 191 | 137.3 Ų | 137.3 | 100% | 1 | 76% | 0.755 | S | S | * | * | S | Bend | trans | -65.8 | 75.3 | 170.3 | -150.8 | 83.8 | 0 | 0 | 0 | 110.3 | ||
| 335 | S | 38.5 | Very low | 38.1 | Very low | 71 Ų | 71 | 139.6 Ų | 139.6 | 50% | 0.497 | 77% | 0.77 | S | S | . | * | trans | -149 | 92.3 | 175.8 | 59.2 | 0 | 0 | 0 | 0 | 110 | K333 | K333-S335 PolarHBondContact O-N 3.43Š| ||
| 336 | K | 40.5 | Very low | 37.8 | Very low | 187 Ų | 187 | 139.6 Ų | 139.6 | 81% | 0.813 | 77% | 0.769 | S | S | * | * | trans | 138.2 | 85.1 | 160.4 | -82.2 | 171.9 | 176.6 | 177 | 0 | 110.5 | T338 | K336-T338 PolarHBondContact O-N 3.2Š| ||
| 337 | L | 38.6 | Very low | 37.5 | Very low | 121 Ų | 121 | 139.5 Ų | 139.5 | 63% | 0.634 | 77% | 0.774 | S | S | * | * | trans | -75.8 | 87.6 | 143.8 | -77.5 | 165.4 | 0 | 0 | 0 | 105.4 | I299 I339 | I299-L337 HydrophobicContact CD1-CD1 4.18Å; L337-I339 PolarHBondContact O-N 3.48Å; L337-I339 VanDerWaalsContact O-N 3.09Å | ||
| 338 | T | 35.3 | Very low | 37.4 | Very low | 106 Ų | 106 | 140.5 Ų | 140.5 | 65% | 0.65 | 78% | 0.778 | S | S | * | * | trans | -69.5 | 99.7 | 172 | -46.9 | 0 | 0 | 0 | 0 | 107.1 | K336 | K336-T338 PolarHBondContact O-N 3.2Š| ||
| 339 | I | 39.2 | Very low | 36.8 | Very low | 127 Ų | 127 | 137 Ų | 137 | 65% | 0.651 | 77% | 0.77 | S | S | * | * | trans | -66.9 | 127.6 | 154.4 | -63.5 | 173.1 | 0 | 0 | 0 | 105 | L337 S341 | L337-I339 PolarHBondContact O-N 3.48Å; L337-I339 VanDerWaalsContact O-N 3.09Å; I339-S341 PolarHBondContact O-N 3.35Å | ||
| 340 | V | 33.5 | Very low | 36.3 | Very low | 137 Ų | 137 | 137.6 Ų | 137.6 | 83% | 0.83 | 77% | 0.769 | S | S | * | * | trans | -57.7 | 99.1 | 177.1 | 176.7 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 341 | S | 36.6 | Very low | 36.3 | Very low | 98 Ų | 98 | 143.3 Ų | 143.3 | 69% | 0.685 | 78% | 0.775 | S | S | * | * | trans | -132.8 | 116.7 | 154.6 | 69.3 | 0 | 0 | 0 | 0 | 107.7 | I339 | I339-S341 PolarHBondContact O-N 3.35Š| ||
| 342 | K | 33.3 | Very low | 36.3 | Very low | 210 Ų | 210 | 142.8 Ų | 142.8 | 91% | 0.913 | 78% | 0.777 | S | S | * | * | trans | -55.4 | 137.1 | 166.7 | -66 | 174.6 | 175.2 | 178.2 | 0 | 108.5 | ||||
| 343 | G | 35 | Very low | 35.8 | Very low | 68 Ų | 68 | 143.2 Ų | 143.2 | 70% | 0.701 | 78% | 0.779 | S | S | * | * | S | Bend | trans | 112.6 | 102.7 | 166.5 | 0 | 0 | 0 | 0 | 0 | 115.1 | ||
| 344 | A | 34.2 | Very low | 35.5 | Very low | 102 Ų | 102 | 142.7 Ų | 142.7 | 84% | 0.843 | 79% | 0.785 | S | S | * | * | trans | 24.7 | 116 | 150.6 | 0 | 0 | 0 | 0 | 0 | 119.6 | ||||
| 345 | C | 33.8 | Very low | 35 | Very low | 136 Ų | 136 | 140.2 Ų | 140.2 | 92% | 0.919 | 78% | 0.778 | S | S | * | * | -168.2 | 144.8 | 107.6 | -135.1 | 0 | 0 | 0 | 0 | 112.7 | |||||
| 346 | K | 37.1 | Very low | 34.9 | Very low | 189 Ų | 189 | 141.9 Ų | 141.9 | 82% | 0.822 | 79% | 0.788 | S | S | * | * | trans | -90.8 | 150.7 | -175.3 | -68.8 | 169.7 | 171.1 | 170.8 | 0 | 110.6 | ||||
| 347 | T | 35.6 | Very low | 34.2 | Very low | 120 Ų | 120 | 142.1 Ų | 142.1 | 74% | 0.736 | 79% | 0.792 | S | S | * | * | trans | 65.6 | 110.5 | 150.1 | -22.8 | 0 | 0 | 0 | 0 | 119.9 | ||||
| 348 | L | 36.5 | Very low | 34.4 | Very low | 159 Ų | 159 | 146.2 Ų | 146.2 | 83% | 0.832 | 80% | 0.801 | S | S | * | * | 163 | 111.8 | 111 | -86.4 | 177.9 | 0 | 0 | 0 | 110.1 | |||||
| 349 | L | 29.9 | Very low | 34.5 | Very low | 152 Ų | 152 | 148.8 Ų | 148.8 | 80% | 0.796 | 81% | 0.81 | S | S | * | * | trans | -114.2 | 107 | 171.3 | -175.7 | 78.2 | 0 | 0 | 0 | 107.2 | ||||
| 350 | T | 34.8 | Very low | 34.3 | Very low | 114 Ų | 114 | 151.6 Ų | 151.6 | 70% | 0.699 | 81% | 0.814 | S | S | * | * | trans | -135.4 | 110.2 | 164.3 | 42.5 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 351 | K | 33 | Very low | 34.4 | Very low | 187 Ų | 187 | 150.9 Ų | 150.9 | 81% | 0.813 | 81% | 0.813 | S | S | * | * | trans | 45.3 | 106.7 | 142.8 | -55.2 | 179.7 | -178.4 | -179.2 | 0 | 117.4 | ||||
| 352 | L | 35.5 | Very low | 34.5 | Very low | 176 Ų | 176 | 149.4 Ų | 149.4 | 92% | 0.921 | 81% | 0.812 | S | S | * | * | trans | -137.4 | 126.4 | 147.7 | -77.9 | 176 | 0 | 0 | 0 | 109.2 | ||||
| 353 | E | 34.2 | Very low | 34.8 | Very low | 183 Ų | 183 | 144.6 Ų | 144.6 | 86% | 0.855 | 80% | 0.803 | S | S | * | * | trans | -84.3 | 135.5 | -175.6 | -63.5 | 166.7 | 167.2 | 0 | 0 | 109.4 | T355 | E353-T355 PolarHBondContact O-N 3.07Š| ||
| 354 | D | 30.5 | Very low | 35.1 | Very low | 163 Ų | 163 | 145.9 Ų | 145.9 | 87% | 0.872 | 80% | 0.797 | S | S | * | * | trans | -85.2 | 108.6 | 179.9 | -83.3 | -31.8 | 0 | 0 | 0 | 110.6 | ||||
| 355 | T | 29.5 | Very low | 35.4 | Very low | 138 Ų | 138 | 144.1 Ų | 144.1 | 85% | 0.847 | 78% | 0.782 | S | S | * | * | trans | -127 | 104.6 | 155.8 | 54.9 | 0 | 0 | 0 | 0 | 109.1 | E353 | E353-T355 PolarHBondContact O-N 3.07Š| ||
| 356 | C | 36.6 | Very low | 36 | Very low | 107 Ų | 107 | 140 Ų | 140 | 72% | 0.723 | 76% | 0.758 | S | S | * | * | trans | -140.3 | 111.4 | 160.5 | 63.1 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 357 | E | 26.2 | Very low | 36.5 | Very low | 192 Ų | 192 | 133.1 Ų | 133.1 | 90% | 0.897 | 73% | 0.733 | S | S | * | * | trans | -70.7 | 134.5 | 168.9 | -59.6 | -177.2 | 145 | 0 | 0 | 109.4 | ||||
| 358 | Y | 42.9 | Very low | 36.9 | Very low | 206 Ų | 206 | 132.6 Ų | 132.6 | 81% | 0.808 | 74% | 0.741 | S | S | * | * | trans | -133.9 | 117.8 | 173.4 | -112.1 | -86.3 | 0 | 0 | 0 | 112 | ||||
| 359 | N | 35.9 | Very low | 37.5 | Very low | 160 Ų | 160 | 128.8 Ų | 128.8 | 86% | 0.856 | 74% | 0.74 | S | S | * | * | trans | -78.9 | 141 | 170.5 | -85.5 | -54.5 | 0 | 0 | 0 | 111.1 | ||||
| 360 | Y | 36.5 | Very low | 38.4 | Very low | 187 Ų | 187 | 123.1 Ų | 123.1 | 73% | 0.733 | 71% | 0.713 | S | S | * | * | trans | -110.6 | 132.5 | -179.9 | -100.9 | -86.3 | 0 | 0 | 0 | 111.9 | ||||
| 361 | P | 35.9 | Very low | 39.4 | Very low | 122 Ų | 122 | 122.6 Ų | 122.6 | 79% | 0.792 | 71% | 0.705 | S | S | * | * | trans | -105.3 | 158.4 | 158.2 | 28.3 | -13.6 | 0 | 0 | 0 | 113 | ||||
| 362 | G | 38.3 | Very low | 40.1 | Very low | 66 Ų | 66 | 116.9 Ų | 116.9 | 68% | 0.68 | 68% | 0.679 | S | S | * | * | trans | -77 | -164.5 | -161.5 | 0 | 0 | 0 | 0 | 0 | 120 | ||||
| 363 | P | 38.6 | Very low | 40.7 | Very low | 109 Ų | 109 | 115.3 Ų | 115.3 | 71% | 0.708 | 67% | 0.671 | S | S | * | * | trans | -91.4 | 134.3 | -149.1 | 34.6 | -33.9 | 0 | 0 | 0 | 115.9 | ||||
| 364 | V | 42.7 | Very low | 41.2 | Very low | 95 Ų | 95 | 110.2 Ų | 110.2 | 58% | 0.576 | 65% | 0.652 | S | S | * | * | trans | -121.3 | 146.3 | -179.9 | -179.5 | 0 | 0 | 0 | 0 | 111 | N31 | N31-V364 PolarHBondContact OD1-O 3.12Š| ||
| 365 | A | 39.8 | Very low | 41.6 | Very low | 66 Ų | 66 | 112.6 Ų | 112.6 | 55% | 0.545 | 65% | 0.65 | S | S | . | * | P | Polyproline II helix | trans | -66 | 166.3 | -173.9 | 0 | 0 | 0 | 0 | 0 | 115.6 | N31 | N31-A365 WeakPolarHBondContact ND2-CA 3.44Š|
| 366 | A | 45.4 | Very low | 42.4 | Very low | 50 Ų | 50 | 110.9 Ų | 110.9 | 41% | 0.413 | 64% | 0.642 | S | S | . | * | P | Polyproline II helix | trans | -62.4 | 141.4 | -174.6 | 0 | 0 | 0 | 0 | 0 | 113.2 | N31 | N31-A366 PolarHBondContact ND2-N 3.46Å; N31-A366 VanDerWaalsContact ND2-N 3.18Å |
| 367 | P | 49.2 | Very low | 42.9 | Very low | 44 Ų | 44 | 108.1 Ų | 108.1 | 29% | 0.286 | 62% | 0.622 | S | S | . | * | P | Polyproline II helix | trans | -58.9 | 144.5 | 177 | -12.8 | 18.4 | 0 | 0 | 0 | 113.5 | S27 G369 S370 | S27-P367 VanDerWaalsContact CB-CG 3.48Å; S27-P367 WeakPolarHBondContact OG-CA 3.39Å; S27-P367 WeakPolarHBondContact OG-CB 3.29Å; S27-P367 WeakPolarHBondContact OG-CG 3.39Å; P367-G369 PolarHBondContact O-N 3.09Å; P367-S370 WeakPolarHBondContact O-CB 3.43Å; P367-S370 PolarHBondContact O-N 2.75Å |
| 368 | A | 43.5 | Very low | 43.8 | Very low | 109 Ų | 109 | 100.8 Ų | 100.8 | 90% | 0.901 | 59% | 0.591 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -58.4 | 128.6 | 157.1 | 0 | 0 | 0 | 0 | 0 | 109 | ||
| 369 | G | 49 | Very low | 44 | Very low | 79 Ų | 79 | 100.5 Ų | 100.5 | 81% | 0.814 | 60% | 0.597 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 98.1 | -1.9 | -174.1 | 0 | 0 | 0 | 0 | 0 | 115.7 | P367 L371 | P367-G369 PolarHBondContact O-N 3.09Å; G369-L371 PolarHBondContact O-N 3.27Å |
| 370 | S | 48.1 | Very low | 45 | Very low | 33 Ų | 33 | 99.4 Ų | 99.4 | 23% | 0.231 | 59% | 0.585 | C | S | . | * | trans | -74.6 | 103.6 | 171.4 | 167.4 | 0 | 0 | 0 | 0 | 111.2 | P367 R372 | P367-S370 WeakPolarHBondContact O-CB 3.43Å; P367-S370 PolarHBondContact O-N 2.75Å; S370-R372 PolarHBondContact O-N 3.14Å; S370-R372 WeakPolarHBondContact OG-CB 3.27Å | ||
| 371 | L | 56.4 | Low | 45.3 | Very low | 102 Ų | 102 | 93.7 Ų | 93.7 | 53% | 0.534 | 57% | 0.567 | S | S | . | * | G | 310 helix | trans | -61.1 | 1.8 | 175.2 | -69.4 | 175.4 | 0 | 0 | 0 | 115.2 | G369 N373 V374 P378 | G369-L371 PolarHBondContact O-N 3.27Å; L371-N373 PolarHBondContact O-N 3.13Å; L371-N373 VanDerWaalsContact O-N 3.08Å; L371-V374 HydrophobicContact CD2-CB 4.2Å; L371-V374 HydrophobicContact CD2-CG2 3.97Å; L371-V374 PolarHBondContact O-N 3.36Å; L371-P378 HydrophobicContact CD2-CG 4.32Å |
| 372 | R | 46.5 | Very low | 45.3 | Very low | 68 Ų | 68 | 92.8 Ų | 92.8 | 26% | 0.257 | 56% | 0.561 | S | S | . | * | G | 310 helix | trans | -64.9 | -12.1 | -178 | -65.9 | 171.5 | 78.4 | -172.9 | 2.6 | 114 | C29 R32 S370 | C29-R372 PolarHBondContact O-NH1 2.97Å; R32-R372 VanDerWaalsContact CZ-NH2 3.27Å; R32-R372 VanDerWaalsContact NE-NH2 3.16Å; R32-R372 VanDerWaalsContact NH2-NH2 3.19Å; S370-R372 PolarHBondContact O-N 3.14Å; S370-R372 WeakPolarHBondContact OG-CB 3.27Å |
| 373 | N | 48.8 | Very low | 45.3 | Very low | 143 Ų | 143 | 95.5 Ų | 95.5 | 77% | 0.765 | 56% | 0.559 | S | S | * | * | G | 310 helix | trans | -130.9 | 11.5 | -177.9 | -60.3 | -6 | 0 | 0 | 0 | 113.4 | L371 Y375 | L371-N373 PolarHBondContact O-N 3.13Å; L371-N373 VanDerWaalsContact O-N 3.08Å; N373-Y375 PolarHBondContact O-N 3.19Å |
| 374 | V | 45.8 | Very low | 45.4 | Very low | 75 Ų | 75 | 95.9 Ų | 95.9 | 46% | 0.455 | 56% | 0.559 | S | S | . | * | trans | -89.9 | 105.5 | 180 | -179.4 | 0 | 0 | 0 | 0 | 108.2 | L371 | L371-V374 HydrophobicContact CD2-CB 4.2Å; L371-V374 HydrophobicContact CD2-CG2 3.97Å; L371-V374 PolarHBondContact O-N 3.36Å | ||
| 375 | Y | 39 | Very low | 45.3 | Very low | 214 Ų | 214 | 96 Ų | 96 | 84% | 0.839 | 57% | 0.565 | S | S | * | * | S | Bend | trans | -127.1 | 128.8 | 168.7 | -156.8 | -90.4 | 0 | 0 | 0 | 107.5 | N373 | N373-Y375 PolarHBondContact O-N 3.19Š|
| 376 | P | 46 | Very low | 45.3 | Very low | 102 Ų | 102 | 100 Ų | 100 | 66% | 0.662 | 58% | 0.577 | S | S | * | * | S | Bend | cis | -70.9 | 154.9 | 2.4 | 31 | -34 | 0 | 0 | 0 | 112.5 | ||
| 377 | P | 47 | Very low | 45 | Very low | 48 Ų | 48 | 103.8 Ų | 103.8 | 31% | 0.312 | 59% | 0.59 | S | S | . | * | P | Polyproline II helix | trans | -55 | 140.4 | 174 | 21.1 | -30.5 | 0 | 0 | 0 | 110.6 | I381 L383 | P377-I381 HydrophobicContact CB-CD1 4.23Å; P377-L383 HydrophobicContact CB-CD1 4.37Å; P377-L383 HydrophobicContact CG-CD1 3.57Å |
| 378 | P | 44.7 | Very low | 44.5 | Very low | 39 Ų | 39 | 109 Ų | 109 | 25% | 0.253 | 62% | 0.616 | S | S | . | * | P | Polyproline II helix | trans | -65.2 | 139.2 | -179.9 | 24.6 | -32.2 | 0 | 0 | 0 | 111.6 | L371 F380 I381 | L371-P378 HydrophobicContact CD2-CG 4.32Å; P378-F380 HydrophobicContact CB-CD1 3.72Å; P378-F380 HydrophobicContact CB-CE1 3.66Å; P378-F380 HydrophobicContact CG-CD1 3.89Å; P378-F380 HydrophobicContact CG-CE1 3.35Å; P378-F380 HydrophobicContact CG-CZ 4.14Å; P378-F380 PolarHBondContact O-N 3.2Å; P378-I381 HydrophobicContact CG-CD1 4.34Å; P378-I381 PolarHBondContact O-N 3.5Å; P378-I381 VanDerWaalsContact O-N 3.08Å |
| 379 | E | 46.8 | Very low | 44.4 | Very low | 199 Ų | 199 | 112.1 Ų | 112.1 | 93% | 0.93 | 62% | 0.617 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -55.8 | -16.7 | -170.3 | -71.3 | -176.3 | 152.6 | 0 | 0 | 115.7 | I381 | E379-I381 PolarHBondContact O-N 3.25Š|
| 380 | F | 56.4 | Low | 44 | Very low | 138 Ų | 138 | 113.6 Ų | 113.6 | 61% | 0.605 | 62% | 0.615 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.8 | -5.3 | 176.4 | 80 | -93.6 | 0 | 0 | 0 | 113.9 | P378 P382 | P378-F380 HydrophobicContact CB-CD1 3.72Å; P378-F380 HydrophobicContact CB-CE1 3.66Å; P378-F380 HydrophobicContact CG-CD1 3.89Å; P378-F380 HydrophobicContact CG-CE1 3.35Å; P378-F380 HydrophobicContact CG-CZ 4.14Å; P378-F380 PolarHBondContact O-N 3.2Å; F380-P382 VanDerWaalsContact O-CD 3.25Å; F380-P382 WeakPolarHBondContact O-CD 3.27Å |
| 381 | I | 44 | Very low | 43.7 | Very low | 66 Ų | 66 | 120.5 Ų | 120.5 | 34% | 0.338 | 65% | 0.646 | S | S | . | * | S | Bend | trans | -89.7 | 105.1 | 167.9 | -56.2 | 172.2 | 0 | 0 | 0 | 105.8 | P377 P378 E379 L383 | P377-I381 HydrophobicContact CB-CD1 4.23Å; P378-I381 HydrophobicContact CG-CD1 4.34Å; P378-I381 PolarHBondContact O-N 3.5Å; P378-I381 VanDerWaalsContact O-N 3.08Å; E379-I381 PolarHBondContact O-N 3.25Å; I381-L383 HydrophobicContact CG2-CD2 4.27Å; I381-L383 HydrophobicContact CG2-CG 4.3Å; I381-L383 PolarHBondContact O-N 2.92Å |
| 382 | P | 35.3 | Very low | 43.1 | Very low | 104 Ų | 104 | 122 Ų | 122 | 68% | 0.675 | 66% | 0.659 | S | S | * | * | trans | -65.5 | 92.3 | 175.2 | 26.6 | -32.1 | 0 | 0 | 0 | 108 | F380 T384 | F380-P382 VanDerWaalsContact O-CD 3.25Å; F380-P382 WeakPolarHBondContact O-CD 3.27Å; P382-T384 VanDerWaalsContact C-N 3.31Å; P382-T384 PolarHBondContact O-N 3.36Å | ||
| 383 | L | 39.1 | Very low | 42.9 | Very low | 122 Ų | 122 | 122.5 Ų | 122.5 | 64% | 0.639 | 68% | 0.678 | S | S | * | * | trans | -80 | 91.8 | 161.4 | -65.3 | 173 | 0 | 0 | 0 | 104 | P377 I381 S385 | P377-L383 HydrophobicContact CB-CD1 4.37Å; P377-L383 HydrophobicContact CG-CD1 3.57Å; I381-L383 HydrophobicContact CG2-CD2 4.27Å; I381-L383 HydrophobicContact CG2-CG 4.3Å; I381-L383 PolarHBondContact O-N 2.92Å; L383-S385 VanDerWaalsContact C-N 3.34Å; L383-S385 PolarHBondContact O-N 3Å | ||
| 384 | T | 40 | Very low | 43 | Very low | 117 Ų | 117 | 122.6 Ų | 122.6 | 72% | 0.718 | 68% | 0.684 | S | S | * | * | trans | -58.6 | 109.1 | 161.1 | 49.3 | 0 | 0 | 0 | 0 | 105.9 | P382 D386 | P382-T384 VanDerWaalsContact C-N 3.31Å; P382-T384 PolarHBondContact O-N 3.36Å; T384-D386 PolarHBondContact O-N 3.49Å | ||
| 385 | S | 39.9 | Very low | 43.2 | Very low | 99 Ų | 99 | 126.1 Ų | 126.1 | 69% | 0.692 | 70% | 0.701 | S | S | * | * | trans | -64 | 109.7 | 165.5 | 42.3 | 0 | 0 | 0 | 0 | 106.5 | L383 N387 | L383-S385 VanDerWaalsContact C-N 3.34Å; L383-S385 PolarHBondContact O-N 3Å; S385-N387 PolarHBondContact O-N 2.96Å | ||
| 386 | D | 39.8 | Very low | 43.9 | Very low | 148 Ų | 148 | 120.7 Ų | 120.7 | 79% | 0.791 | 70% | 0.7 | S | S | * | * | S | Bend | trans | -68.3 | 79.4 | 165.2 | -60.2 | -38.4 | 0 | 0 | 0 | 107.3 | T384 | T384-D386 PolarHBondContact O-N 3.49Š|
| 387 | N | 39.5 | Very low | 44.2 | Very low | 131 Ų | 131 | 124 Ų | 124 | 70% | 0.701 | 71% | 0.712 | S | S | * | * | trans | -163.2 | 133.1 | 162 | -76.6 | -41.1 | 0 | 0 | 0 | 106.5 | S385 | S385-N387 PolarHBondContact O-N 2.96Š| ||
| 388 | D | 38.9 | Very low | 44.6 | Very low | 154 Ų | 154 | 125.1 Ų | 125.1 | 82% | 0.824 | 73% | 0.732 | S | S | * | * | trans | 102.9 | 50.7 | 168.7 | -45.8 | -29.3 | 0 | 0 | 0 | 117.7 | ||||
| 389 | D | 40.8 | Very low | 44.9 | Very low | 174 Ų | 174 | 132.9 Ų | 132.9 | 93% | 0.93 | 79% | 0.787 | S | S | * | * | trans | -103.2 | 72.6 | 155.6 | -75.4 | -36.3 | 0 | 0 | 0 | 110.1 | ||||
| 390 | S | 42.2 | Very low | 44.8 | Very low | 109 Ų | 109 | 129.6 Ų | 129.6 | 76% | 0.762 | 78% | 0.78 | S | S | * | * | trans | -161.4 | 84.7 | 159.1 | 64.9 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 391 | M | 40.7 | Very low | 44.2 | Very low | 178 Ų | 178 | 129.1 Ų | 129.1 | 88% | 0.877 | 79% | 0.789 | S | S | * | * | trans | -166.3 | 136.8 | 150.5 | -92.1 | -99.8 | 176 | 0 | 0 | 109.6 | ||||
| 392 | T | 44 | Very low | 44.2 | Very low | 133 Ų | 133 | 132.6 Ų | 132.6 | 82% | 0.816 | 81% | 0.814 | S | S | * | * | trans | 99 | 123 | 160.1 | 74.8 | 0 | 0 | 0 | 0 | 119.8 | ||||
| 393 | A | 42.3 | Very low | 44.8 | Very low | 80 Ų | 80 | 134.3 Ų | 134.3 | 66% | 0.661 | 82% | 0.822 | S | S | * | * | trans | 82.7 | 89 | 146.6 | 0 | 0 | 0 | 0 | 0 | 119.3 | ||||
| 394 | T | 50.1 | Low | 45.1 | Very low | 144 Ų | 144 | 135.1 Ų | 135.1 | 88% | 0.883 | 83% | 0.834 | S | S | * | * | trans | -115.2 | 109.1 | 131.1 | 46.2 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 395 | D | 51.3 | Low | 45.5 | Very low | 150 Ų | 150 | 136.3 Ų | 136.3 | 80% | 0.802 | 84% | 0.842 | S | S | * | * | trans | -56.3 | 142.9 | 161.1 | -54.5 | -58.3 | 0 | 0 | 0 | 110.7 | ||||
| 396 | A | 52.8 | Low | 45.8 | Very low | 100 Ų | 100 | 138.9 Ų | 138.9 | 83% | 0.826 | 85% | 0.852 | S | S | * | * | trans | 172.3 | 119.1 | 133.1 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 397 | N | 52.8 | Low | 46.3 | Very low | 172 Ų | 172 | 138.2 Ų | 138.2 | 92% | 0.92 | 86% | 0.857 | S | S | * | * | trans | -53 | 153.3 | 167.3 | -72.9 | -44.5 | 0 | 0 | 0 | 113.6 | ||||
| 398 | G | 55.8 | Low | 46.9 | Very low | 71 Ų | 71 | 138.8 Ų | 138.8 | 73% | 0.732 | 87% | 0.87 | S | S | * | * | trans | 115 | 88.4 | 138.6 | 0 | 0 | 0 | 0 | 0 | 115.8 | ||||
| 399 | S | 50.8 | Low | 47.6 | Very low | 201 Ų | 201 | 137.5 Ų | 137.5 | 100% | 1.406 | 87% | 0.874 | S | S | * | * | 161.1 | 0 | 128 | -64.9 | 0 | 0 | 0 | 0 | 110 |
Retrieved 399 of 399 residues in 53.1 ms
(Link to these results)