| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 41.6 | Very low | 44.9 | Very low | 247 Ų | 247 | 143 Ų | 143 | 100% | 1.217 | 84% | 0.835 | S | S | * | * | 0 | 120.2 | 0 | -79.7 | 175.4 | 153.6 | 0 | 0 | 107 | |||||
| 2 | S | 41.8 | Very low | 44.8 | Very low | 101 Ų | 101 | 138.3 Ų | 138.3 | 71% | 0.706 | 82% | 0.824 | S | S | * | * | trans | -61.4 | 156.5 | -173.5 | -42.1 | 0 | 0 | 0 | 0 | 113 | ||||
| 3 | N | 46.4 | Very low | 44.3 | Very low | 169 Ų | 169 | 136.3 Ų | 136.3 | 90% | 0.904 | 82% | 0.822 | S | S | * | * | trans | -159.2 | 98.5 | 132.8 | -86.2 | -24.2 | 0 | 0 | 0 | 108.3 | ||||
| 4 | D | 49.1 | Very low | 43.8 | Very low | 143 Ų | 143 | 137.6 Ų | 137.6 | 77% | 0.765 | 82% | 0.822 | S | S | * | * | trans | -70.2 | 137.8 | 155 | -72.3 | -73.4 | 0 | 0 | 0 | 109.3 | ||||
| 5 | V | 51.8 | Low | 43.9 | Very low | 150 Ų | 150 | 136.7 Ų | 136.7 | 91% | 0.909 | 82% | 0.818 | S | S | * | * | trans | -144.1 | 112.6 | 146.1 | -84.9 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 6 | S | 47.6 | Very low | 43.9 | Very low | 105 Ų | 105 | 138.8 Ų | 138.8 | 73% | 0.734 | 82% | 0.816 | S | S | * | * | trans | -87.6 | 157.1 | 173.4 | -77.4 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 7 | S | 45.5 | Very low | 43.8 | Very low | 122 Ų | 122 | 141.2 Ų | 141.2 | 85% | 0.853 | 82% | 0.818 | S | S | * | * | trans | 71.3 | 147.7 | 149.9 | -77.8 | 0 | 0 | 0 | 0 | 117.7 | ||||
| 8 | S | 41.2 | Very low | 43.9 | Very low | 103 Ų | 103 | 139.9 Ų | 139.9 | 72% | 0.72 | 81% | 0.812 | S | S | * | * | cis | 177.3 | 145.7 | 2.8 | 162.7 | 0 | 0 | 0 | 0 | 105.3 | ||||
| 9 | S | 40.3 | Very low | 43.8 | Very low | 111 Ų | 111 | 138.6 Ų | 138.6 | 78% | 0.776 | 81% | 0.808 | S | S | * | * | trans | 175.4 | 120.8 | 135.8 | -163.4 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 10 | D | 44.4 | Very low | 44.2 | Very low | 134 Ų | 134 | 140.8 Ų | 140.8 | 72% | 0.717 | 81% | 0.811 | S | S | * | * | trans | -48 | 147.2 | 156.7 | -70.3 | -99.3 | 0 | 0 | 0 | 112.9 | ||||
| 11 | E | 44.1 | Very low | 44.6 | Very low | 188 Ų | 188 | 143.4 Ų | 143.4 | 88% | 0.879 | 81% | 0.813 | S | S | * | * | trans | -160.3 | 144.3 | 131.7 | -84.2 | -49.8 | 95.2 | 0 | 0 | 109 | ||||
| 12 | A | 43.3 | Very low | 45.3 | Very low | 86 Ų | 86 | 142.8 Ų | 142.8 | 71% | 0.711 | 80% | 0.797 | S | S | * | * | trans | -87.4 | 166.7 | -160 | 0 | 0 | 0 | 0 | 0 | 116.2 | ||||
| 13 | S | 39.3 | Very low | 46.1 | Very low | 113 Ų | 113 | 149 Ų | 149 | 79% | 0.79 | 81% | 0.805 | S | S | * | * | trans | 79.3 | 104.7 | 149.3 | -50.1 | 0 | 0 | 0 | 0 | 118.3 | ||||
| 14 | D | 37.5 | Very low | 46.8 | Very low | 155 Ų | 155 | 150.6 Ų | 150.6 | 83% | 0.829 | 80% | 0.804 | S | S | * | * | -159.4 | 140.7 | 103.6 | -143 | -14 | 0 | 0 | 0 | 111.6 | E16 | D14-E16 PolarHBondContact O-N 3.45Š| |||
| 15 | T | 44.2 | Very low | 47.6 | Very low | 123 Ų | 123 | 152.1 Ų | 152.1 | 76% | 0.755 | 81% | 0.806 | S | S | * | * | trans | -101.9 | 81.2 | -165.2 | -32 | 0 | 0 | 0 | 0 | 108.8 | E17 | T15-E17 PolarHBondContact O-N 3.45Š| ||
| 16 | E | 44.1 | Very low | 48.3 | Very low | 171 Ų | 171 | 149.2 Ų | 149.2 | 80% | 0.799 | 80% | 0.798 | S | S | * | * | trans | -90.4 | 95.6 | 165.9 | -78.8 | -85.4 | 154.8 | 0 | 0 | 107.9 | D14 V18 | D14-E16 PolarHBondContact O-N 3.45Å; E16-V18 VanDerWaalsContact C-N 3.26Å; E16-V18 PolarHBondContact O-N 2.83Å | ||
| 17 | E | 42.5 | Very low | 49.6 | Very low | 179 Ų | 179 | 149.9 Ų | 149.9 | 84% | 0.836 | 80% | 0.802 | S | S | * | * | trans | -59.7 | 89.7 | 166.2 | -85.7 | -160.3 | 144.9 | 0 | 0 | 109.3 | T15 P19 | T15-E17 PolarHBondContact O-N 3.45Å; E17-P19 WeakPolarHBondContact O-CD 3.43Å | ||
| 18 | V | 45.3 | Very low | 51.6 | Low | 119 Ų | 119 | 154.8 Ų | 154.8 | 72% | 0.721 | 80% | 0.802 | S | S | * | * | trans | -58.6 | 123.3 | 158.6 | 177.7 | 0 | 0 | 0 | 0 | 106.3 | E16 Q20 | E16-V18 VanDerWaalsContact C-N 3.26Å; E16-V18 PolarHBondContact O-N 2.83Å; V18-Q20 PolarHBondContact O-N 2.71Å | ||
| 19 | P | 43 | Very low | 53.9 | Low | 114 Ų | 114 | 159.3 Ų | 159.3 | 74% | 0.74 | 81% | 0.805 | S | S | * | * | trans | -59.4 | 108.3 | 179.1 | -17.7 | 28.3 | 0 | 0 | 0 | 107.4 | E17 K21 | E17-P19 WeakPolarHBondContact O-CD 3.43Å; P19-K21 PolarHBondContact O-N 2.8Å | ||
| 20 | Q | 50.5 | Low | 56.4 | Low | 183 Ų | 183 | 162.3 Ų | 162.3 | 86% | 0.855 | 81% | 0.807 | S | S | * | * | trans | -57.9 | 96.2 | 168.3 | -83.7 | -173 | -22 | 0 | 0 | 105.8 | V18 R22 | V18-Q20 PolarHBondContact O-N 2.71Å; Q20-R22 PolarHBondContact O-N 2.73Å | ||
| 21 | K | 52.8 | Low | 58.6 | Low | 195 Ų | 195 | 158.8 Ų | 158.8 | 85% | 0.848 | 79% | 0.792 | S | S | * | * | trans | -53 | 98.9 | 170.3 | -150.7 | 177.4 | -168.3 | 176.8 | 0 | 104.1 | P19 R23 | P19-K21 PolarHBondContact O-N 2.8Å; K21-R23 PolarHBondContact O-N 2.81Å | ||
| 22 | R | 55.7 | Low | 61.1 | Low | 234 Ų | 234 | 153 Ų | 153 | 88% | 0.883 | 77% | 0.771 | S | S | * | * | trans | -53.2 | 97.7 | 178.1 | -77.1 | -176.5 | 172.5 | -175.2 | -1.9 | 105.2 | Q20 K24 | Q20-R22 PolarHBondContact O-N 2.73Å; R22-K24 PolarHBondContact O-N 2.69Å | ||
| 23 | R | 59.1 | Low | 63.6 | Low | 232 Ų | 232 | 153.8 Ų | 153.8 | 88% | 0.875 | 78% | 0.777 | S | S | * | * | trans | -60.6 | 101.8 | 171.3 | -76.1 | -177 | 170.3 | -179.3 | -2.7 | 102.6 | K21 Q25 | K21-R23 PolarHBondContact O-N 2.81Å; R23-Q25 VanDerWaalsContact C-N 3.28Å; R23-Q25 PolarHBondContact O-N 2.98Å | ||
| 24 | K | 62.3 | Low | 66.3 | Low | 202 Ų | 202 | 155.8 Ų | 155.8 | 88% | 0.878 | 78% | 0.779 | S | S | * | * | trans | -50.9 | 104.2 | 171.1 | -70.8 | -179.3 | 178.2 | -178.4 | 0 | 104.2 | R22 A26 | R22-K24 PolarHBondContact O-N 2.69Å; K24-A26 PolarHBondContact O-N 2.79Å | ||
| 25 | Q | 65.8 | Low | 69.1 | Low | 176 Ų | 176 | 155 Ų | 155 | 82% | 0.822 | 77% | 0.768 | S | S | * | * | trans | -58.7 | 115.8 | 175.4 | -72.7 | -168 | -1.2 | 0 | 0 | 104.3 | R23 S27 | R23-Q25 VanDerWaalsContact C-N 3.28Å; R23-Q25 PolarHBondContact O-N 2.98Å; Q25-S27 PolarHBondContact O-N 2.95Å | ||
| 26 | A | 66.6 | Low | 71.5 | Confident | 89 Ų | 89 | 155.4 Ų | 155.4 | 74% | 0.736 | 77% | 0.771 | S | S | * | * | trans | -51.5 | 121.1 | 170.6 | 0 | 0 | 0 | 0 | 0 | 105.8 | K24 R28 | K24-A26 PolarHBondContact O-N 2.79Å; A26-R28 PolarHBondContact O-N 3.04Å | ||
| 27 | S | 74.6 | Confident | 73.6 | Confident | 118 Ų | 118 | 152.1 Ų | 152.1 | 83% | 0.825 | 77% | 0.772 | S | S | * | * | trans | -53.3 | 114.6 | 177.4 | 49.4 | 0 | 0 | 0 | 0 | 107 | Q25 | Q25-S27 PolarHBondContact O-N 2.95Š| ||
| 28 | R | 87.7 | Confident | 75.8 | Confident | 225 Ų | 225 | 151.8 Ų | 151.8 | 85% | 0.849 | 77% | 0.769 | S | S | * | * | trans | -58.2 | 147.1 | 177.1 | -67.3 | -179.6 | -179.3 | 172.5 | -0.4 | 108 | A26 Q30 | A26-R28 PolarHBondContact O-N 3.04Å; R28-Q30 PolarHBondContact O-N 3.3Å | ||
| 29 | Y | 89.6 | Confident | 77.7 | Confident | 198 Ų | 198 | 150.3 Ų | 150.3 | 78% | 0.776 | 77% | 0.769 | S | S | * | * | trans | -54.2 | 131.8 | 172.4 | 174.6 | -99.7 | 0 | 0 | 0 | 109.7 | C31 | Y29-C31 HydrophobicContact CE1-CB 4.22Š| ||
| 30 | Q | 91.9 | Very high | 79.8 | Confident | 174 Ų | 174 | 150.6 Ų | 150.6 | 81% | 0.813 | 76% | 0.76 | S | S | * | * | trans | -117.1 | 122.5 | 174.5 | -169.9 | 172.8 | 11.1 | 0 | 0 | 108.2 | R28 | R28-Q30 PolarHBondContact O-N 3.3Š| ||
| 31 | C | 91.6 | Very high | 81.7 | Confident | 60 Ų | 60 | 150.6 Ų | 150.6 | 41% | 0.405 | 76% | 0.757 | S | S | . | * | trans | -67.4 | 136.5 | 176.8 | -162.8 | 0 | 0 | 0 | 0 | 109.4 | Y29 F35 | Y29-C31 HydrophobicContact CE1-CB 4.22Å; C31-F35 WeakPolarHBondContact SG-CB 3.42Å | ||
| 32 | P | 95.6 | Very high | 83.5 | Confident | 68 Ų | 68 | 142.5 Ų | 142.5 | 44% | 0.442 | 72% | 0.724 | S | S | . | * | trans | -58.1 | 149.4 | 173.8 | -19 | 29.9 | 0 | 0 | 0 | 111.4 | D34 F35 | P32-D34 PolarHBondContact O-N 3.39Å; P32-D34 VanDerWaalsContact O-N 3.12Å; P32-F35 HydrophobicContact CB-CD2 3.88Å; P32-F35 HydrophobicContact CB-CE2 4.33Å; P32-F35 HydrophobicContact CG-CD2 4.16Å; P32-F35 HydrophobicContact CG-CE2 4.45Å; P32-F35 PolarHBondContact O-N 3.42Å | ||
| 33 | A | 95 | Very high | 85.1 | Confident | 102 Ų | 102 | 135.1 Ų | 135.1 | 84% | 0.843 | 71% | 0.708 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62 | -25.3 | -169.6 | 0 | 0 | 0 | 0 | 0 | 114.6 | F35 | A33-F35 PolarHBondContact O-N 3.12Š|
| 34 | D | 97.5 | Very high | 86.6 | Confident | 154 Ų | 154 | 126.9 Ų | 126.9 | 82% | 0.824 | 69% | 0.689 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79.7 | -4.1 | 179.7 | -53.9 | -41.3 | 0 | 0 | 0 | 113 | P32 | P32-D34 PolarHBondContact O-N 3.39Å; P32-D34 VanDerWaalsContact O-N 3.12Å |
| 35 | F | 96.1 | Very high | 88 | Confident | 138 Ų | 138 | 120.9 Ų | 120.9 | 61% | 0.605 | 67% | 0.673 | S | S | * | * | trans | -112.4 | 137.5 | -179 | -66.9 | -99.8 | 0 | 0 | 0 | 110.4 | C31 P32 A33 | C31-F35 WeakPolarHBondContact SG-CB 3.42Å; P32-F35 HydrophobicContact CB-CD2 3.88Å; P32-F35 HydrophobicContact CB-CE2 4.33Å; P32-F35 HydrophobicContact CG-CD2 4.16Å; P32-F35 HydrophobicContact CG-CE2 4.45Å; P32-F35 PolarHBondContact O-N 3.42Å; A33-F35 PolarHBondContact O-N 3.12Å | ||
| 36 | V | 93.3 | Very high | 89.2 | Confident | 133 Ų | 133 | 114.4 Ų | 114.4 | 81% | 0.806 | 65% | 0.645 | S | S | * | * | trans | -111 | 137.2 | 177 | -178 | 0 | 0 | 0 | 0 | 108.9 | F38 | V36-F38 PolarHBondContact O-N 3.02Š| ||
| 37 | A | 89.9 | Confident | 90.5 | Very high | 101 Ų | 101 | 111.3 Ų | 111.3 | 84% | 0.835 | 62% | 0.616 | S | S | * | * | trans | -61.9 | 123.6 | 172.7 | 0 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 38 | F | 87 | Confident | 91.4 | Very high | 173 Ų | 173 | 107 Ų | 107 | 76% | 0.759 | 58% | 0.584 | S | S | * | * | trans | -118.7 | 124.4 | 178.1 | 179.5 | -101.5 | 0 | 0 | 0 | 109.7 | V36 H40 | V36-F38 PolarHBondContact O-N 3.02Å; F38-H40 HydrophobicContact CD1-CB 4.27Å; F38-H40 HydrophobicContact CE1-CB 3.79Å | ||
| 39 | A | 86.7 | Confident | 91.7 | Very high | 88 Ų | 88 | 100.8 Ų | 100.8 | 73% | 0.727 | 56% | 0.564 | S | S | * | * | trans | -97.1 | 102.9 | 172.8 | 0 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 40 | H | 86.6 | Confident | 91.8 | Very high | 120 Ų | 120 | 97.3 Ų | 97.3 | 56% | 0.556 | 55% | 0.55 | S | S | * | . | trans | -69.6 | 134.7 | 173.2 | 178.9 | -102.6 | 0 | 0 | 0 | 110 | F38 P42 | F38-H40 HydrophobicContact CD1-CB 4.27Å; F38-H40 HydrophobicContact CE1-CB 3.79Å; H40-P42 WeakPolarHBondContact O-CD 3.35Å | ||
| 41 | K | 89.9 | Confident | 91.8 | Very high | 183 Ų | 183 | 89.6 Ų | 89.6 | 80% | 0.796 | 52% | 0.515 | S | S | * | . | trans | -103 | 106.1 | 171.9 | -68.6 | -175.7 | -179.8 | -179 | 0 | 108.7 | ||||
| 42 | P | 90.3 | Very high | 91.8 | Very high | 24 Ų | 24 | 90 Ų | 90 | 16% | 0.156 | 52% | 0.517 | C | S | . | . | trans | -58.8 | 148.9 | 177.7 | -22.6 | 33.5 | 0 | 0 | 0 | 112.1 | H40 L47 S119 | H40-P42 WeakPolarHBondContact O-CD 3.35Å; P42-L47 HydrophobicContact CB-CD2 4.31Å; P42-S119 WeakPolarHBondContact CG-OG 3.25Å | ||
| 43 | C | 90.4 | Very high | 91.7 | Very high | 80 Ų | 80 | 91.5 Ų | 91.5 | 54% | 0.541 | 52% | 0.518 | S | S | . | . | trans | -69.4 | 151.2 | 170.1 | -59.5 | 0 | 0 | 0 | 0 | 110 | S45 T46 L47 | C43-S45 PolarHBondContact O-N 3.26Å; C43-S45 VanDerWaalsContact O-N 3.13Å; C43-T46 HydrophobicContact CB-CG2 4.39Å; C43-T46 PolarHBondContact N-OG1 3.07Å; C43-T46 PolarHBondContact O-N 2.76Å; C43-T46 PolarHBondContact O-OG1 3.17Å; C43-L47 PolarHBondContact O-N 3.49Å | ||
| 44 | A | 90.5 | Very high | 91.4 | Very high | 58 Ų | 58 | 94.5 Ų | 94.5 | 48% | 0.479 | 52% | 0.52 | S | S | . | . | G | 310 helix | trans | -56.8 | -31.9 | 179.6 | 0 | 0 | 0 | 0 | 0 | 113.3 | T46 R50 | A44-T46 VanDerWaalsContact C-N 3.31Å; A44-R50 WeakPolarHBondContact O-CD 3.49Å |
| 45 | S | 90.8 | Very high | 91 | Very high | 77 Ų | 77 | 94.8 Ų | 94.8 | 54% | 0.538 | 52% | 0.522 | S | S | . | . | G | 310 helix | trans | -70.7 | -22.5 | 175.3 | 50.1 | 0 | 0 | 0 | 0 | 114.2 | C43 | C43-S45 PolarHBondContact O-N 3.26Å; C43-S45 VanDerWaalsContact O-N 3.13Å |
| 46 | T | 92.1 | Very high | 90.9 | Very high | 39 Ų | 39 | 90.9 Ų | 90.9 | 24% | 0.239 | 51% | 0.509 | C | S | . | . | G | 310 helix | trans | -98 | -0.7 | -176.8 | 56.9 | 0 | 0 | 0 | 0 | 113.3 | C43 A44 L116 T118 | C43-T46 HydrophobicContact CB-CG2 4.39Å; C43-T46 PolarHBondContact N-OG1 3.07Å; C43-T46 PolarHBondContact O-N 2.76Å; C43-T46 PolarHBondContact O-OG1 3.17Å; A44-T46 VanDerWaalsContact C-N 3.31Å; T46-L116 HydrophobicContact CG2-CD2 4.45Å; T46-T118 VanDerWaalsContact O-CB 3.3Å; T46-T118 WeakPolarHBondContact O-CB 3.43Å; T46-T118 PolarHBondContact O-OG1 3.38Å |
| 47 | L | 93.5 | Very high | 90.8 | Very high | 24 Ų | 24 | 90.4 Ų | 90.4 | 13% | 0.126 | 50% | 0.498 | C | S | . | . | S | Bend | trans | -63 | 147 | 177.1 | -67.9 | 174.8 | 0 | 0 | 0 | 111 | P42 C43 E49 R50 V51 S119 P121 L124 | P42-L47 HydrophobicContact CB-CD2 4.31Å; C43-L47 PolarHBondContact O-N 3.49Å; L47-E49 VanDerWaalsContact C-N 3.27Å; L47-E49 PolarHBondContact O-N 3.34Å; L47-E49 VanDerWaalsContact O-N 3.16Å; L47-R50 PolarHBondContact O-N 2.87Å; L47-V51 PolarHBondContact O-N 3.1Å; L47-S119 WeakPolarHBondContact CD2-O 3.29Å; L47-P121 HydrophobicContact CD1-CB 4.1Å; L47-L124 HydrophobicContact CD2-CD2 4.39Å |
| 48 | I | 93.9 | Very high | 91 | Very high | 28 Ų | 28 | 86.9 Ų | 86.9 | 14% | 0.144 | 47% | 0.465 | C | S | . | . | H | α-helix | trans | -54.9 | -40.1 | -171.4 | -167.1 | 62.9 | 0 | 0 | 0 | 113.4 | R50 V51 C52 T118 S119 H120 V128 A130 | I48-R50 VanDerWaalsContact C-N 3.27Å; I48-R50 PolarHBondContact O-N 3.47Å; I48-V51 PolarHBondContact O-N 2.6Å; I48-C52 WeakPolarHBondContact O-CB 3.23Å; I48-C52 PolarHBondContact O-N 2.91Å; I48-C52 VanDerWaalsContact O-N 3.11Å; I48-C52 PolarHBondContact O-SG 2.85Å; I48-C52 VanDerWaalsContact O-SG 3.33Å; I48-T118 HydrophobicContact CB-CG2 4.15Å; I48-T118 HydrophobicContact CD1-CG2 4.27Å; I48-S119 PolarHBondContact N-O 2.68Å; I48-H120 HydrophobicContact CG2-CB 4.18Å; I48-V128 HydrophobicContact CB-CG2 4.05Å; I48-V128 HydrophobicContact CD1-CG2 4.35Å; I48-V128 HydrophobicContact CG1-CG2 4.19Å; I48-V128 HydrophobicContact CG2-CG2 4.45Å; I48-A130 HydrophobicContact CD1-CB 4.2Å |
| 49 | E | 92.6 | Very high | 91.4 | Very high | 95 Ų | 95 | 81.5 Ų | 81.5 | 44% | 0.444 | 44% | 0.44 | S | S | . | . | H | α-helix | trans | -59.3 | -38.7 | 179.8 | -69.1 | 178.7 | -174.4 | 0 | 0 | 112 | L47 E53 H120 P121 | L47-E49 VanDerWaalsContact C-N 3.27Å; L47-E49 PolarHBondContact O-N 3.34Å; L47-E49 VanDerWaalsContact O-N 3.16Å; E49-E53 WeakPolarHBondContact O-CG 3.43Å; E49-H120 IonicContact OE1-CE1 3Å; E49-H120 PolarHBondContact OE1-CE1 3.43Å; E49-H120 IonicContact OE1-ND1 3.57Å; E49-H120 IonicContact OE1-NE2 3.9Å; E49-P121 HydrophobicContact CG-CG 3.99Å; E49-P121 WeakPolarHBondContact OE1-CG 3.3Å; E49-P121 WeakPolarHBondContact OE2-CG 3.33Å |
| 50 | R | 92.7 | Very high | 91.8 | Very high | 125 Ų | 125 | 80 Ų | 80 | 47% | 0.472 | 42% | 0.419 | S | S | . | . | H | α-helix | trans | -79.8 | -37.7 | -178.2 | -66.6 | -160.8 | -177.4 | 170.6 | -0.7 | 113.4 | A44 L47 I48 C52 E53 T56 | A44-R50 WeakPolarHBondContact O-CD 3.49Å; L47-R50 PolarHBondContact O-N 2.87Å; I48-R50 VanDerWaalsContact C-N 3.27Å; I48-R50 PolarHBondContact O-N 3.47Å; R50-C52 PolarHBondContact O-N 3.35Å; R50-E53 WeakPolarHBondContact O-CB 3.46Å; R50-E53 PolarHBondContact O-N 3.05Å; R50-T56 WeakPolarHBondContact O-CB 3.3Å; R50-T56 PolarHBondContact O-OG1 3.11Å |
| 51 | V | 93 | Very high | 92.2 | Very high | 12 Ų | 12 | 78.9 Ų | 78.9 | 7% | 0.073 | 42% | 0.417 | C | S | . | . | H | α-helix | trans | -72.7 | -23 | -178.9 | -177.2 | 0 | 0 | 0 | 0 | 111.3 | L47 I48 L58 A130 | L47-V51 PolarHBondContact O-N 3.1Å; I48-V51 PolarHBondContact O-N 2.6Å; V51-L58 HydrophobicContact CG1-CB 4.17Å; V51-L58 HydrophobicContact CG1-CD1 4.17Å; V51-L58 HydrophobicContact CG1-CD2 4.14Å; V51-L58 HydrophobicContact CG1-CG 4.37Å; V51-A130 HydrophobicContact CG1-CB 4.25Å |
| 52 | C | 91.4 | Very high | 92.5 | Very high | 68 Ų | 68 | 76.8 Ų | 76.8 | 46% | 0.459 | 41% | 0.408 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -89 | 4 | 174.8 | -67.4 | 0 | 0 | 0 | 0 | 114.1 | I48 R50 | I48-C52 WeakPolarHBondContact O-CB 3.23Å; I48-C52 PolarHBondContact O-N 2.91Å; I48-C52 VanDerWaalsContact O-N 3.11Å; I48-C52 PolarHBondContact O-SG 2.85Å; I48-C52 VanDerWaalsContact O-SG 3.33Å; R50-C52 PolarHBondContact O-N 3.35Å |
| 53 | E | 92.7 | Very high | 92.7 | Very high | 99 Ų | 99 | 77.6 Ų | 77.6 | 46% | 0.463 | 42% | 0.416 | S | S | . | . | S | Bend | trans | -71.8 | 141.5 | 174.9 | -66.9 | 172.2 | -167.2 | 0 | 0 | 110.9 | E49 R50 N55 T56 | E49-E53 WeakPolarHBondContact O-CG 3.43Å; R50-E53 WeakPolarHBondContact O-CB 3.46Å; R50-E53 PolarHBondContact O-N 3.05Å; E53-N55 PolarHBondContact O-N 3.28Å; E53-T56 PolarHBondContact O-N 3.36Å |
| 54 | D | 88.5 | Confident | 92.9 | Very high | 166 Ų | 166 | 76 Ų | 76 | 89% | 0.888 | 40% | 0.404 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -61.5 | -16.8 | -176.1 | -63 | -33.3 | 0 | 0 | 0 | 114.6 | ||
| 55 | N | 90.2 | Very high | 93 | Very high | 159 Ų | 159 | 79.6 Ų | 79.6 | 85% | 0.85 | 43% | 0.427 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -105 | 11.3 | -178.5 | -61 | -52.7 | 0 | 0 | 0 | 113.1 | E53 | E53-N55 PolarHBondContact O-N 3.28Š|
| 56 | T | 92.5 | Very high | 92.9 | Very high | 57 Ų | 57 | 79.6 Ų | 79.6 | 35% | 0.35 | 43% | 0.427 | S | S | . | . | trans | -116.3 | 127.6 | -177.8 | -60.8 | 0 | 0 | 0 | 0 | 110.1 | R50 E53 | R50-T56 WeakPolarHBondContact O-CB 3.3Å; R50-T56 PolarHBondContact O-OG1 3.11Å; E53-T56 PolarHBondContact O-N 3.36Å | ||
| 57 | E | 92.6 | Very high | 92.9 | Very high | 122 Ų | 122 | 79.5 Ų | 79.5 | 57% | 0.57 | 42% | 0.423 | S | S | * | . | trans | -109.1 | 137.4 | 173.6 | -66.8 | -176.5 | 175.3 | 0 | 0 | 110.4 | W59 | E57-W59 PolarHBondContact OE2-NE1 3.33Š| ||
| 58 | L | 93.4 | Very high | 92.7 | Very high | 28 Ų | 28 | 79.9 Ų | 79.9 | 15% | 0.147 | 43% | 0.425 | C | S | . | . | trans | -101.5 | 115.9 | 178.2 | -172.9 | 69.7 | 0 | 0 | 0 | 109.6 | V51 L116 A130 F133 S134 | V51-L58 HydrophobicContact CG1-CB 4.17Å; V51-L58 HydrophobicContact CG1-CD1 4.17Å; V51-L58 HydrophobicContact CG1-CD2 4.14Å; V51-L58 HydrophobicContact CG1-CG 4.37Å; L58-L116 HydrophobicContact CD1-CD2 4.05Å; L58-L116 HydrophobicContact CD2-CB 3.91Å; L58-L116 HydrophobicContact CD2-CD2 4.45Å; L58-A130 HydrophobicContact CD2-CB 4.47Å; L58-F133 HydrophobicContact CB-CD1 4.34Å; L58-F133 HydrophobicContact CD1-CE1 4.21Å; L58-F133 HydrophobicContact CD2-CD1 3.75Å; L58-F133 HydrophobicContact CD2-CE1 3.71Å; L58-F133 HydrophobicContact CD2-CG 4.19Å; L58-F133 HydrophobicContact CD2-CZ 4.11Å; L58-F133 HydrophobicContact CG-CD1 3.51Å; L58-F133 HydrophobicContact CG-CE1 3.61Å; L58-F133 HydrophobicContact CG-CG 4.32Å; L58-F133 HydrophobicContact CG-CZ 4.48Å; L58-F133 CarbonylContact O-C 3.53Å; L58-F133 WeakPolarHBondContact O-CA 3.33Å; L58-S134 PolarHBondContact N-OG 3.23Å; L58-S134 VanDerWaalsContact N-OG 3.14Å; L58-S134 WeakPolarHBondContact O-CB 3.4Å; L58-S134 PolarHBondContact O-N 3.11Å | ||
| 59 | W | 95.1 | Very high | 92.6 | Very high | 59 Ų | 59 | 82.5 Ų | 82.5 | 22% | 0.223 | 44% | 0.444 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -115.4 | 137 | -178.8 | -74.3 | 79.1 | 0 | 0 | 0 | 111.6 | E57 L79 L137 | E57-W59 PolarHBondContact OE2-NE1 3.33Å; W59-L79 HydrophobicContact CD2-CD2 4.06Å; W59-L79 HydrophobicContact CE3-CD2 4.18Å; W59-L79 HydrophobicContact CH2-CB 3.66Å; W59-L79 HydrophobicContact CH2-CD2 4.15Å; W59-L79 HydrophobicContact CH2-CG 4.33Å; W59-L79 WeakPolarHBondContact CH2-O 3.38Å; W59-L79 HydrophobicContact CZ2-CB 3.82Å; W59-L79 HydrophobicContact CZ2-CD1 3.91Å; W59-L79 HydrophobicContact CZ2-CD2 4Å; W59-L79 HydrophobicContact CZ2-CG 4.11Å; W59-L79 HydrophobicContact CZ3-CB 4.31Å; W59-L79 HydrophobicContact CZ3-CD2 4.22Å; W59-L79 WeakPolarHBondContact CZ3-O 3.19Å; W59-L137 HydrophobicContact CE3-CD2 4.12Å; W59-L137 HydrophobicContact CE3-CG 3.96Å; W59-L137 HydrophobicContact CZ3-CD2 4.06Å; W59-L137 HydrophobicContact CZ3-CG 4.4Å |
| 60 | L | 95.3 | Very high | 92.6 | Very high | 56 Ų | 56 | 83.4 Ų | 83.4 | 29% | 0.293 | 45% | 0.452 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -91.5 | 134.8 | 170.9 | -177.2 | 58.2 | 0 | 0 | 0 | 109.1 | A111 L114 F133 G135 L136 L137 | L60-A111 HydrophobicContact CB-CB 4.43Å; L60-A111 HydrophobicContact CD2-CB 4.28Å; L60-L114 HydrophobicContact CD2-CD1 3.54Å; L60-F133 HydrophobicContact CB-CD1 3.76Å; L60-F133 HydrophobicContact CB-CE1 3.92Å; L60-F133 HydrophobicContact CB-CG 4.15Å; L60-F133 HydrophobicContact CB-CZ 4.42Å; L60-F133 HydrophobicContact CD1-CE1 4.42Å; L60-F133 HydrophobicContact CD1-CZ 4.4Å; L60-G135 PolarHBondContact N-O 2.82Å; L60-L136 HydrophobicContact CB-CD1 3.82Å; L60-L136 HydrophobicContact CD2-CD1 3.92Å; L60-L136 HydrophobicContact CG-CD1 3.72Å; L60-L136 CarbonylContact O-C 3.23Å; L60-L136 WeakPolarHBondContact O-CA 3.4Å; L60-L136 WeakPolarHBondContact O-CD1 3.13Å; L60-L137 PolarHBondContact O-N 3.11Å |
| 61 | I | 95.1 | Very high | 92.4 | Very high | 97 Ų | 97 | 77.9 Ų | 77.9 | 50% | 0.497 | 43% | 0.432 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -116.8 | 121.1 | 177 | -54.1 | -179.8 | 0 | 0 | 0 | 108.7 | L137 I139 | I61-L137 WeakPolarHBondContact CA-O 3.46Å; I61-L137 HydrophobicContact CD1-CD1 4.44Å; I61-L137 HydrophobicContact CG1-CB 4.3Å; I61-L137 HydrophobicContact CG1-CD1 4.26Å; I61-L137 HydrophobicContact CG2-CB 4.49Å; I61-I139 HydrophobicContact CG2-CD1 3.8Å; I61-I139 HydrophobicContact CG2-CG1 4.39Å |
| 62 | K | 95.6 | Very high | 92.4 | Very high | 140 Ų | 140 | 78 Ų | 78 | 61% | 0.609 | 43% | 0.432 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -106.1 | 121.6 | 171.4 | 177.7 | 173.5 | 167.6 | -168.3 | 0 | 108.9 | L136 L137 N138 I139 | K62-L136 HydrophobicContact CB-CD1 4.36Å; K62-L137 PolarHBondContact N-O 3.28Å; K62-N138 WeakPolarHBondContact CD-OD1 3.36Å; K62-I139 PolarHBondContact O-N 3.41Å |
| 63 | A | 95.7 | Very high | 92.3 | Very high | 40 Ų | 40 | 79.8 Ų | 79.8 | 33% | 0.331 | 45% | 0.445 | S | S | . | . | trans | -142 | 161.2 | -179.3 | 0 | 0 | 0 | 0 | 0 | 111.2 | F67 I139 | A63-F67 HydrophobicContact CB-CB 3.75Å; A63-F67 HydrophobicContact CB-CD1 3.57Å; A63-F67 HydrophobicContact CB-CD2 4.32Å; A63-F67 HydrophobicContact CB-CE1 4.22Å; A63-F67 HydrophobicContact CB-CG 3.63Å; A63-I139 HydrophobicContact CB-CB 4.06Å; A63-I139 HydrophobicContact CB-CD1 4.48Å | ||
| 64 | P | 93.4 | Very high | 92.1 | Very high | 46 Ų | 46 | 80 Ų | 80 | 30% | 0.299 | 46% | 0.457 | S | S | . | . | trans | -58.6 | 154.9 | 171 | -23 | 33.6 | 0 | 0 | 0 | 111.7 | S66 F67 I139 | P64-S66 PolarHBondContact O-N 3.31Å; P64-F67 WeakPolarHBondContact O-CB 3.32Å; P64-F67 PolarHBondContact O-N 3.22Å; P64-I139 WeakPolarHBondContact CD-O 3.31Å | ||
| 65 | S | 93.4 | Very high | 92.2 | Very high | 135 Ų | 135 | 74.6 Ų | 74.6 | 94% | 0.944 | 43% | 0.428 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63.8 | -22.3 | 175.3 | 56.6 | 0 | 0 | 0 | 0 | 113.6 | F67 | S65-F67 VanDerWaalsContact C-N 3.32Š|
| 66 | S | 89.3 | Confident | 92.3 | Very high | 77 Ų | 77 | 76 Ų | 76 | 54% | 0.538 | 43% | 0.427 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -81.7 | -7.8 | 174.9 | 53.6 | 0 | 0 | 0 | 0 | 113.8 | P64 N68 | P64-S66 PolarHBondContact O-N 3.31Å; S66-N68 PolarHBondContact O-N 3Å |
| 67 | F | 90.7 | Very high | 92.2 | Very high | 36 Ų | 36 | 75.8 Ų | 75.8 | 16% | 0.158 | 42% | 0.422 | C | S | . | . | trans | -68.5 | 127.2 | -178.9 | 174.9 | -103.5 | 0 | 0 | 0 | 110.9 | A63 P64 S65 P69 F72 Y102 I139 | A63-F67 HydrophobicContact CB-CB 3.75Å; A63-F67 HydrophobicContact CB-CD1 3.57Å; A63-F67 HydrophobicContact CB-CD2 4.32Å; A63-F67 HydrophobicContact CB-CE1 4.22Å; A63-F67 HydrophobicContact CB-CG 3.63Å; P64-F67 WeakPolarHBondContact O-CB 3.32Å; P64-F67 PolarHBondContact O-N 3.22Å; S65-F67 VanDerWaalsContact C-N 3.32Å; F67-P69 HydrophobicContact CE1-CB 3.97Å; F67-F72 HydrophobicContact CD2-CE2 4.28Å; F67-F72 AromaticContact CE2-CD2 3.47Å; F67-F72 HydrophobicContact CE2-CD2 3.47Å; F67-F72 VanDerWaalsContact CE2-CD2 3.47Å; F67-F72 AromaticContact CE2-CE2 3.37Å; F67-F72 HydrophobicContact CE2-CE2 3.37Å; F67-F72 HydrophobicContact CE2-CG 4.42Å; F67-F72 HydrophobicContact CE2-CZ 4.19Å; F67-F72 AromaticContact CZ-CD2 3.73Å; F67-F72 HydrophobicContact CZ-CD2 3.73Å; F67-F72 HydrophobicContact CZ-CE2 4.1Å; F67-F72 HydrophobicContact CZ-CG 4.38Å; F67-Y102 HydrophobicContact CD2-CD1 4.47Å; F67-Y102 AromaticContact CD2-CE1 3.83Å; F67-Y102 HydrophobicContact CD2-CE1 3.83Å; F67-Y102 HydrophobicContact CE2-CE1 4.42Å; F67-I139 HydrophobicContact CD2-CG2 3.96Å; F67-I139 HydrophobicContact CE1-CD1 4.08Å; F67-I139 HydrophobicContact CE2-CD1 3.75Å; F67-I139 HydrophobicContact CE2-CG2 3.82Å; F67-I139 HydrophobicContact CZ-CD1 3.49Å; F67-I139 VanDerWaalsContact CZ-CD1 3.49Å | ||
| 68 | N | 90.1 | Very high | 92.3 | Very high | 33 Ų | 33 | 70.8 Ų | 70.8 | 18% | 0.176 | 40% | 0.4 | C | S | . | . | trans | -99.2 | 116.1 | 167.8 | -173.9 | -12.3 | 0 | 0 | 0 | 110.2 | S66 D70 S71 Q90 | S66-N68 PolarHBondContact O-N 3Å; N68-D70 PolarHBondContact O-N 2.74Å; N68-D70 WeakPolarHBondContact OD1-CB 3.49Å; N68-D70 PolarHBondContact OD1-N 2.89Å; N68-D70 PolarHBondContact OD1-OD2 2.71Å; N68-S71 PolarHBondContact O-N 3.05Å; N68-S71 PolarHBondContact O-OG 3.13Å; N68-Q90 HydrophobicContact CB-CG 4.12Å; N68-Q90 PolarHBondContact ND2-NE2 3.42Å; N68-Q90 PolarHBondContact ND2-OE1 3.3Å | ||
| 69 | P | 91.8 | Very high | 92.3 | Very high | 82 Ų | 82 | 73.3 Ų | 73.3 | 53% | 0.532 | 41% | 0.413 | S | S | . | . | G | 310 helix | trans | -58.8 | -29.9 | 175.7 | 24.6 | -34.3 | 0 | 0 | 0 | 113.8 | F67 S71 F72 | F67-P69 HydrophobicContact CE1-CB 3.97Å; P69-S71 PolarHBondContact O-N 3.18Å; P69-F72 PolarHBondContact O-N 3Å; P69-F72 VanDerWaalsContact O-N 3.08Å |
| 70 | D | 92.2 | Very high | 92.2 | Very high | 114 Ų | 114 | 75 Ų | 75 | 61% | 0.61 | 43% | 0.434 | S | S | * | . | G | 310 helix | trans | -65.4 | -25.4 | -178.4 | -63.7 | -33.4 | 0 | 0 | 0 | 112.6 | N68 F72 S73 | N68-D70 PolarHBondContact O-N 2.74Å; N68-D70 WeakPolarHBondContact OD1-CB 3.49Å; N68-D70 PolarHBondContact OD1-N 2.89Å; N68-D70 PolarHBondContact OD1-OD2 2.71Å; D70-F72 PolarHBondContact O-N 3.4Å; D70-F72 VanDerWaalsContact O-N 3.14Å; D70-S73 VanDerWaalsContact O-CB 3.31Å; D70-S73 WeakPolarHBondContact O-CB 3.46Å; D70-S73 PolarHBondContact O-N 3.16Å; D70-S73 VanDerWaalsContact O-N 3.14Å; D70-S73 PolarHBondContact O-OG 3.41Å |
| 71 | S | 89.6 | Confident | 92.2 | Very high | 9 Ų | 9 | 74.3 Ų | 74.3 | 6% | 0.063 | 44% | 0.441 | C | S | . | . | G | 310 helix | trans | -67.1 | -13.5 | 177.1 | 73.8 | 0 | 0 | 0 | 0 | 112.8 | N68 P69 P88 | N68-S71 PolarHBondContact O-N 3.05Å; N68-S71 PolarHBondContact O-OG 3.13Å; P69-S71 PolarHBondContact O-N 3.18Å; S71-P88 WeakPolarHBondContact O-CD 3.43Å |
| 72 | F | 91.5 | Very high | 92.1 | Very high | 16 Ų | 16 | 75.6 Ų | 75.6 | 7% | 0.07 | 45% | 0.448 | C | S | . | . | G | 310 helix | trans | -105.8 | 2.5 | 177.3 | -76.6 | -99.5 | 0 | 0 | 0 | 113.8 | F67 P69 D70 S74 L75 M77 M85 A87 Y102 | F67-F72 HydrophobicContact CD2-CE2 4.28Å; F67-F72 AromaticContact CE2-CD2 3.47Å; F67-F72 HydrophobicContact CE2-CD2 3.47Å; F67-F72 VanDerWaalsContact CE2-CD2 3.47Å; F67-F72 AromaticContact CE2-CE2 3.37Å; F67-F72 HydrophobicContact CE2-CE2 3.37Å; F67-F72 HydrophobicContact CE2-CG 4.42Å; F67-F72 HydrophobicContact CE2-CZ 4.19Å; F67-F72 AromaticContact CZ-CD2 3.73Å; F67-F72 HydrophobicContact CZ-CD2 3.73Å; F67-F72 HydrophobicContact CZ-CE2 4.1Å; F67-F72 HydrophobicContact CZ-CG 4.38Å; P69-F72 PolarHBondContact O-N 3Å; P69-F72 VanDerWaalsContact O-N 3.08Å; D70-F72 PolarHBondContact O-N 3.4Å; D70-F72 VanDerWaalsContact O-N 3.14Å; F72-S74 PolarHBondContact O-N 3.14Å; F72-L75 HydrophobicContact CD1-CB 4.08Å; F72-L75 HydrophobicContact CD1-CD1 3.73Å; F72-L75 HydrophobicContact CE1-CD1 4.01Å; F72-L75 HydrophobicContact CG-CD1 4.21Å; F72-L75 PolarHBondContact O-N 3.48Å; F72-M77 HydrophobicContact CD1-CE 3.97Å; F72-M77 HydrophobicContact CD1-CG 4.37Å; F72-M77 HydrophobicContact CD1-SD 3.26Å; F72-M77 WeakPolarHBondContact CD1-SD 3.43Å; F72-M77 HydrophobicContact CE1-CE 4.02Å; F72-M77 HydrophobicContact CE1-SD 3.52Å; F72-M77 VanDerWaalsContact CE1-SD 3.52Å; F72-M77 HydrophobicContact CG-SD 4.31Å; F72-M85 HydrophobicContact CD1-CE 4.42Å; F72-M85 HydrophobicContact CE1-CB 4.24Å; F72-M85 HydrophobicContact CE1-CE 4.32Å; F72-M85 HydrophobicContact CE1-SD 4.26Å; F72-A87 HydrophobicContact CD2-CB 4.22Å; F72-A87 HydrophobicContact CE2-CB 3.7Å; F72-A87 HydrophobicContact CZ-CB 4Å; F72-Y102 AromaticContact CE2-CD2 3.64Å; F72-Y102 HydrophobicContact CE2-CD2 3.64Å; F72-Y102 AromaticContact CE2-CE2 3.71Å; F72-Y102 HydrophobicContact CE2-CE2 3.71Å; F72-Y102 HydrophobicContact CE2-CG 4.08Å; F72-Y102 HydrophobicContact CZ-CD1 4.44Å; F72-Y102 AromaticContact CZ-CD2 3.43Å; F72-Y102 HydrophobicContact CZ-CD2 3.43Å; F72-Y102 VanDerWaalsContact CZ-CD2 3.43Å; F72-Y102 HydrophobicContact CZ-CE2 4.02Å; F72-Y102 AromaticContact CZ-CG 3.66Å; F72-Y102 HydrophobicContact CZ-CG 3.66Å |
| 73 | S | 90.2 | Very high | 92 | Very high | 105 Ų | 105 | 73.3 Ų | 73.3 | 73% | 0.734 | 44% | 0.44 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -54 | -28.2 | -176.9 | 54.2 | 0 | 0 | 0 | 0 | 115.2 | D70 | D70-S73 VanDerWaalsContact O-CB 3.31Å; D70-S73 WeakPolarHBondContact O-CB 3.46Å; D70-S73 PolarHBondContact O-N 3.16Å; D70-S73 VanDerWaalsContact O-N 3.14Å; D70-S73 PolarHBondContact O-OG 3.41Å |
| 74 | S | 88.3 | Confident | 91.8 | Very high | 102 Ų | 102 | 75 Ų | 75 | 71% | 0.713 | 45% | 0.446 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -107.1 | 3.4 | 178.5 | 56.1 | 0 | 0 | 0 | 0 | 113.9 | F72 | F72-S74 PolarHBondContact O-N 3.14Š|
| 75 | L | 90.5 | Very high | 91.7 | Very high | 53 Ų | 53 | 73.7 Ų | 73.7 | 28% | 0.277 | 44% | 0.436 | S | S | . | . | trans | -104.3 | 138.8 | -174.2 | -61 | -178.9 | 0 | 0 | 0 | 111.1 | F72 M85 Q86 A87 | F72-L75 HydrophobicContact CD1-CB 4.08Å; F72-L75 HydrophobicContact CD1-CD1 3.73Å; F72-L75 HydrophobicContact CE1-CD1 4.01Å; F72-L75 HydrophobicContact CG-CD1 4.21Å; F72-L75 PolarHBondContact O-N 3.48Å; L75-M85 HydrophobicContact CB-CE 3.7Å; L75-M85 HydrophobicContact CD1-CE 4.31Å; L75-M85 HydrophobicContact CG-CE 4.49Å; L75-Q86 WeakPolarHBondContact CD1-O 3.44Å; L75-A87 HydrophobicContact CD1-CB 4Å | ||
| 76 | K | 92.4 | Very high | 91.5 | Very high | 190 Ų | 190 | 70.9 Ų | 70.9 | 83% | 0.826 | 41% | 0.408 | S | S | * | . | P | Polyproline II helix | trans | -86.1 | 119.9 | 172.9 | -67.7 | -173.4 | 178.3 | -175.3 | 0 | 109.8 | M85 | K76-M85 WeakPolarHBondContact O-CE 3.46Š|
| 77 | M | 90.9 | Very high | 91.4 | Very high | 51 Ų | 51 | 67.3 Ų | 67.3 | 25% | 0.251 | 38% | 0.383 | S | S | . | . | P | Polyproline II helix | trans | -89.1 | 138.8 | 179.6 | -65.6 | -67.8 | -90.2 | 0 | 0 | 111.2 | F72 L79 M85 V104 I139 | F72-M77 HydrophobicContact CD1-CE 3.97Å; F72-M77 HydrophobicContact CD1-CG 4.37Å; F72-M77 HydrophobicContact CD1-SD 3.26Å; F72-M77 WeakPolarHBondContact CD1-SD 3.43Å; F72-M77 HydrophobicContact CE1-CE 4.02Å; F72-M77 HydrophobicContact CE1-SD 3.52Å; F72-M77 VanDerWaalsContact CE1-SD 3.52Å; F72-M77 HydrophobicContact CG-SD 4.31Å; M77-L79 PolarHBondContact O-N 3.45Å; M77-M85 HydrophobicContact SD-CE 3.88Å; M77-M85 HydrophobicContact SD-SD 3.45Å; M77-V104 HydrophobicContact CE-CB 4.21Å; M77-V104 HydrophobicContact CE-CG1 3.52Å; M77-V104 HydrophobicContact CE-CG2 3.59Å; M77-V104 HydrophobicContact SD-CG1 4.31Å; M77-V104 HydrophobicContact SD-CG2 4.04Å; M77-I139 HydrophobicContact CE-CD1 3.52Å; M77-I139 HydrophobicContact CE-CG1 3.9Å |
| 78 | P | 92.8 | Very high | 91.2 | Very high | 18 Ų | 18 | 69.5 Ų | 69.5 | 12% | 0.117 | 40% | 0.401 | C | S | . | . | P | Polyproline II helix | trans | -71.1 | 127.4 | 171 | 32.7 | -38.1 | 0 | 0 | 0 | 110.1 | S80 Q83 V104 L137 | P78-S80 VanDerWaalsContact C-N 3.34Å; P78-Q83 HydrophobicContact CB-CB 4.26Å; P78-Q83 HydrophobicContact CG-CB 3.68Å; P78-V104 HydrophobicContact CG-CB 4.02Å; P78-V104 HydrophobicContact CG-CG1 3.8Å; P78-L137 VanDerWaalsContact O-CD2 3.25Å; P78-L137 WeakPolarHBondContact O-CD2 3.47Å |
| 79 | L | 93.4 | Very high | 90.7 | Very high | 80 Ų | 80 | 69.7 Ų | 69.7 | 42% | 0.419 | 41% | 0.407 | S | S | . | . | S | Bend | trans | -83.9 | -14.7 | 171.3 | -63.5 | -175.8 | 0 | 0 | 0 | 112.4 | W59 M77 G106 G107 L137 | W59-L79 HydrophobicContact CD2-CD2 4.06Å; W59-L79 HydrophobicContact CE3-CD2 4.18Å; W59-L79 HydrophobicContact CH2-CB 3.66Å; W59-L79 HydrophobicContact CH2-CD2 4.15Å; W59-L79 HydrophobicContact CH2-CG 4.33Å; W59-L79 WeakPolarHBondContact CH2-O 3.38Å; W59-L79 HydrophobicContact CZ2-CB 3.82Å; W59-L79 HydrophobicContact CZ2-CD1 3.91Å; W59-L79 HydrophobicContact CZ2-CD2 4Å; W59-L79 HydrophobicContact CZ2-CG 4.11Å; W59-L79 HydrophobicContact CZ3-CB 4.31Å; W59-L79 HydrophobicContact CZ3-CD2 4.22Å; W59-L79 WeakPolarHBondContact CZ3-O 3.19Å; M77-L79 PolarHBondContact O-N 3.45Å; L79-G106 CarbonylContact O-C 3.52Å; L79-G106 VanDerWaalsContact O-C 3.26Å; L79-G107 PolarHBondContact O-N 2.9Å; L79-L137 HydrophobicContact CD2-CD1 4.28Å; L79-L137 HydrophobicContact CD2-CD2 4.25Å |
| 80 | S | 94 | Very high | 89.6 | Confident | 95 Ų | 95 | 71.4 Ų | 71.4 | 66% | 0.664 | 41% | 0.408 | S | S | * | . | S | Bend | trans | -138.7 | 143.4 | 177.1 | 65.4 | 0 | 0 | 0 | 0 | 111.8 | P78 G106 | P78-S80 VanDerWaalsContact C-N 3.34Å; S80-G106 CarbonylContact C-O 3.43Å; S80-G106 WeakPolarHBondContact CA-O 3.13Å |
| 81 | G | 94.6 | Very high | 88.2 | Confident | 41 Ų | 41 | 74.4 Ų | 74.4 | 42% | 0.423 | 42% | 0.418 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | 78.6 | -171.8 | 178.4 | 0 | 0 | 0 | 0 | 0 | 113.5 | L105 G106 | G81-L105 WeakPolarHBondContact O-CA 3.22Å; G81-G106 PolarHBondContact N-O 2.85Å; G81-G106 PolarHBondContact O-N 2.91Å |
| 82 | L | 93.7 | Very high | 86.4 | Confident | 124 Ų | 124 | 76.3 Ų | 76.3 | 65% | 0.649 | 43% | 0.431 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -108.3 | 129 | -178.2 | 179.2 | 67.6 | 0 | 0 | 0 | 110 | V104 L105 | L82-V104 CarbonylContact C-O 3.56Å; L82-V104 WeakPolarHBondContact CA-O 3.48Å; L82-L105 HydrophobicContact CB-CD1 4.16Å; L82-L105 HydrophobicContact CD1-CB 4.04Å |
| 83 | Q | 93.2 | Very high | 84.3 | Confident | 93 Ų | 93 | 82.2 Ų | 82.2 | 44% | 0.435 | 47% | 0.473 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -136.9 | 136.9 | 174.3 | -163.5 | 178.1 | -2.2 | 0 | 0 | 111.4 | P78 M85 V104 | P78-Q83 HydrophobicContact CB-CB 4.26Å; P78-Q83 HydrophobicContact CG-CB 3.68Å; Q83-M85 HydrophobicContact CG-CG 4.32Å; Q83-V104 PolarHBondContact N-O 3.2Å; Q83-V104 PolarHBondContact O-N 3.01Å |
| 84 | T | 92.4 | Very high | 82.4 | Confident | 76 Ų | 76 | 81.5 Ų | 81.5 | 47% | 0.466 | 47% | 0.468 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -86.9 | 129.8 | 168.6 | -51.8 | 0 | 0 | 0 | 0 | 109.7 | I101 Y102 | T84-I101 HydrophobicContact CG2-CG2 3.33Å; T84-Y102 CarbonylContact C-O 3.26Å; T84-Y102 WeakPolarHBondContact CA-O 3.5Å |
| 85 | M | 89.6 | Confident | 80.5 | Confident | 17 Ų | 17 | 81.3 Ų | 81.3 | 8% | 0.084 | 48% | 0.482 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -127.9 | 148.5 | -177.5 | -63 | -174.5 | 69.4 | 0 | 0 | 110.8 | F72 L75 K76 M77 Q83 I101 Y102 V104 | F72-M85 HydrophobicContact CD1-CE 4.42Å; F72-M85 HydrophobicContact CE1-CB 4.24Å; F72-M85 HydrophobicContact CE1-CE 4.32Å; F72-M85 HydrophobicContact CE1-SD 4.26Å; L75-M85 HydrophobicContact CB-CE 3.7Å; L75-M85 HydrophobicContact CD1-CE 4.31Å; L75-M85 HydrophobicContact CG-CE 4.49Å; K76-M85 WeakPolarHBondContact O-CE 3.46Å; M77-M85 HydrophobicContact SD-CE 3.88Å; M77-M85 HydrophobicContact SD-SD 3.45Å; Q83-M85 HydrophobicContact CG-CG 4.32Å; M85-I101 WeakPolarHBondContact O-CA 3.31Å; M85-Y102 PolarHBondContact N-O 3.4Å; M85-Y102 PolarHBondContact O-N 3.49Å; M85-V104 HydrophobicContact CG-CG2 4.3Å; M85-V104 HydrophobicContact SD-CB 4.48Å; M85-V104 HydrophobicContact SD-CG2 3.9Å |
| 86 | Q | 89.8 | Confident | 78.8 | Confident | 77 Ų | 77 | 80.4 Ų | 80.4 | 36% | 0.36 | 49% | 0.486 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -110 | 124 | 175.2 | -62.9 | -173.1 | -7.6 | 0 | 0 | 109.3 | L75 R99 Q100 I101 | L75-Q86 WeakPolarHBondContact CD1-O 3.44Å; Q86-R99 HydrophobicContact CB-CB 4.33Å; Q86-Q100 WeakPolarHBondContact CA-O 3.34Å; Q86-I101 HydrophobicContact CG-CG1 4.27Å |
| 87 | A | 88.1 | Confident | 77.2 | Confident | 1 Ų | 1 | 79.4 Ų | 79.4 | 1% | 0.008 | 49% | 0.489 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -111.9 | 153.9 | 173.6 | 0 | 0 | 0 | 0 | 0 | 110.6 | F72 L75 A89 R99 Q100 Y102 | F72-A87 HydrophobicContact CD2-CB 4.22Å; F72-A87 HydrophobicContact CE2-CB 3.7Å; F72-A87 HydrophobicContact CZ-CB 4Å; L75-A87 HydrophobicContact CD1-CB 4Å; A87-A89 PolarHBondContact O-N 3.27Å; A87-R99 CarbonylContact O-C 3.59Å; A87-R99 WeakPolarHBondContact O-CA 3.5Å; A87-Q100 PolarHBondContact N-O 3.24Å; A87-Q100 PolarHBondContact O-N 2.99Å; A87-Y102 HydrophobicContact CB-CD2 4.05Å; A87-Y102 HydrophobicContact CB-CE2 3.9Å |
| 88 | P | 86.6 | Confident | 76.3 | Confident | 83 Ų | 83 | 81.5 Ų | 81.5 | 54% | 0.539 | 50% | 0.502 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -57 | 130.1 | 171.5 | -20.5 | 32.5 | 0 | 0 | 0 | 110.2 | S71 | S71-P88 WeakPolarHBondContact O-CD 3.43Å |
| 89 | A | 79.1 | Confident | 75.7 | Confident | 36 Ų | 36 | 88.7 Ų | 88.7 | 30% | 0.298 | 53% | 0.526 | S | S | . | . | trans | -69.9 | 141.2 | 174.4 | 0 | 0 | 0 | 0 | 0 | 110.4 | A87 N98 | A87-A89 PolarHBondContact O-N 3.27Å; A89-N98 HydrophobicContact CB-CB 4.3Å; A89-N98 WeakPolarHBondContact CB-O 3.38Å; A89-N98 PolarHBondContact N-O 2.8Å | ||
| 90 | Q | 69.1 | Low | 75.4 | Confident | 118 Ų | 118 | 86.5 Ų | 86.5 | 55% | 0.551 | 51% | 0.514 | S | S | * | . | S | Bend | trans | -74.8 | -30.1 | -177 | -74.2 | -105.3 | -71.4 | 0 | 0 | 112.8 | N68 | N68-Q90 HydrophobicContact CB-CG 4.12Å; N68-Q90 PolarHBondContact ND2-NE2 3.42Å; N68-Q90 PolarHBondContact ND2-OE1 3.3Å |
| 91 | Q | 62.4 | Low | 75.2 | Confident | 178 Ų | 178 | 82.6 Ų | 82.6 | 83% | 0.832 | 49% | 0.485 | S | S | * | . | trans | -153 | 116.8 | -178.8 | -64.1 | -178.4 | -2.6 | 0 | 0 | 110.4 | ||||
| 92 | S | 52.2 | Low | 75.1 | Confident | 49 Ų | 49 | 80.8 Ų | 80.8 | 34% | 0.343 | 47% | 0.466 | S | S | . | . | trans | -122.1 | 107.8 | 167.3 | 170.3 | 0 | 0 | 0 | 0 | 107.8 | S94 N98 | S92-S94 PolarHBondContact O-N 3Å; S92-S94 PolarHBondContact OG-N 2.82Å; S92-S94 PolarHBondContact OG-O 3.05Å; S92-S94 VanDerWaalsContact OG-O 3.08Å; S92-N98 PolarHBondContact OG-ND2 3.16Å | ||
| 93 | C | 46.7 | Very low | 75.1 | Confident | 139 Ų | 139 | 76.4 Ų | 76.4 | 94% | 0.939 | 45% | 0.446 | S | S | * | . | S | Bend | trans | -72.9 | 4.6 | 171.8 | -61.5 | 0 | 0 | 0 | 0 | 112.8 | ||
| 94 | S | 50.1 | Low | 75.2 | Confident | 91 Ų | 91 | 72 Ų | 72 | 64% | 0.636 | 43% | 0.425 | S | S | * | . | S | Bend | trans | -140.4 | 84.6 | -174.8 | 175.2 | 0 | 0 | 0 | 0 | 109.7 | S92 G96 | S92-S94 PolarHBondContact O-N 3Å; S92-S94 PolarHBondContact OG-N 2.82Å; S92-S94 PolarHBondContact OG-O 3.05Å; S92-S94 VanDerWaalsContact OG-O 3.08Å; S94-G96 PolarHBondContact O-N 2.81Å |
| 95 | G | 48 | Very low | 75.3 | Confident | 97 Ų | 97 | 72.4 Ų | 72.4 | 100% | 1 | 42% | 0.424 | S | S | * | . | S | Bend | trans | 36.3 | 6.1 | 148.3 | 0 | 0 | 0 | 0 | 0 | 122.7 | ||
| 96 | G | 56.1 | Low | 75.5 | Confident | 35 Ų | 35 | 71.9 Ų | 71.9 | 36% | 0.361 | 42% | 0.423 | S | S | . | . | S | Bend | trans | -117.6 | 151 | -173.3 | 0 | 0 | 0 | 0 | 0 | 111.1 | S94 N98 | S94-G96 PolarHBondContact O-N 2.81Å; G96-N98 PolarHBondContact O-N 2.8Å |
| 97 | N | 59.4 | Low | 75.7 | Confident | 168 Ų | 168 | 69 Ų | 69 | 90% | 0.898 | 41% | 0.413 | S | S | * | . | trans | -68.6 | 65.1 | 172.4 | -67.7 | -31.9 | 0 | 0 | 0 | 110.3 | R99 | N97-R99 PolarHBondContact O-N 2.94Å; N97-R99 VanDerWaalsContact O-N 3.13Å | ||
| 98 | N | 70.1 | Confident | 75.8 | Confident | 96 Ų | 96 | 74 Ų | 74 | 51% | 0.513 | 45% | 0.446 | S | S | . | . | trans | -73.7 | 109.1 | 179.3 | -70.2 | -9.7 | 0 | 0 | 0 | 107.4 | A89 S92 G96 | A89-N98 HydrophobicContact CB-CB 4.3Å; A89-N98 WeakPolarHBondContact CB-O 3.38Å; A89-N98 PolarHBondContact N-O 2.8Å; S92-N98 PolarHBondContact OG-ND2 3.16Å; G96-N98 PolarHBondContact O-N 2.8Å | ||
| 99 | R | 81.9 | Confident | 75.3 | Confident | 168 Ų | 168 | 75.1 Ų | 75.1 | 63% | 0.634 | 46% | 0.456 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -95.8 | 133.8 | 167.7 | -69 | -178.4 | 173.2 | -171.7 | -3.5 | 107.3 | Q86 A87 N97 | Q86-R99 HydrophobicContact CB-CB 4.33Å; A87-R99 CarbonylContact O-C 3.59Å; A87-R99 WeakPolarHBondContact O-CA 3.5Å; N97-R99 PolarHBondContact O-N 2.94Å; N97-R99 VanDerWaalsContact O-N 3.13Å |
| 100 | Q | 86.5 | Confident | 75.1 | Confident | 35 Ų | 35 | 76 Ų | 76 | 16% | 0.164 | 47% | 0.469 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -84.3 | 131.3 | 174.8 | -163.1 | 170.6 | 17 | 0 | 0 | 108.3 | Q86 A87 Y102 E141 | Q86-Q100 WeakPolarHBondContact CA-O 3.34Å; A87-Q100 PolarHBondContact N-O 3.24Å; A87-Q100 PolarHBondContact O-N 2.99Å; Q100-Y102 HydrophobicContact CB-CD2 4.41Å; Q100-Y102 HydrophobicContact CB-CE2 3.72Å; Q100-Y102 VanDerWaalsContact CD-CZ 3.44Å; Q100-Y102 HydrophobicContact CG-CD2 4.32Å; Q100-Y102 HydrophobicContact CG-CE2 3.59Å; Q100-Y102 PolarHBondContact NE2-OH 2.82Å; Q100-Y102 PolarHBondContact OE1-OH 3.22Å; Q100-E141 HydrophobicContact CG-CG 4.23Å; Q100-E141 PolarHBondContact NE2-OE1 3.41Å; Q100-E141 PolarHBondContact NE2-OE2 2.95Å |
| 101 | I | 88.9 | Confident | 75.8 | Confident | 12 Ų | 12 | 70.6 Ų | 70.6 | 6% | 0.062 | 44% | 0.444 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -101.2 | 128.9 | -176.3 | -53 | 175.1 | 0 | 0 | 0 | 107.3 | T84 M85 Q86 S142 G144 | T84-I101 HydrophobicContact CG2-CG2 3.33Å; M85-I101 WeakPolarHBondContact O-CA 3.31Å; Q86-I101 HydrophobicContact CG-CG1 4.27Å; I101-S142 VanDerWaalsContact C-OG 3.29Å; I101-S142 VanDerWaalsContact CG2-OG 3.28Å; I101-S142 WeakPolarHBondContact CG2-OG 3.38Å; I101-S142 PolarHBondContact O-N 2.82Å; I101-S142 VanDerWaalsContact O-O 3.13Å; I101-S142 PolarHBondContact O-OG 2.89Å; I101-S142 VanDerWaalsContact O-OG 3.07Å; I101-G144 WeakPolarHBondContact CD1-O 3Å |
| 102 | Y | 92.2 | Very high | 76.9 | Confident | 3 Ų | 3 | 65.3 Ų | 65.3 | 1% | 0.012 | 43% | 0.431 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -121.5 | 141.5 | 179.8 | -68.3 | -87.2 | 0 | 0 | 0 | 109.8 | F67 F72 T84 M85 A87 Q100 I139 C140 E141 | F67-Y102 HydrophobicContact CD2-CD1 4.47Å; F67-Y102 AromaticContact CD2-CE1 3.83Å; F67-Y102 HydrophobicContact CD2-CE1 3.83Å; F67-Y102 HydrophobicContact CE2-CE1 4.42Å; F72-Y102 AromaticContact CE2-CD2 3.64Å; F72-Y102 HydrophobicContact CE2-CD2 3.64Å; F72-Y102 AromaticContact CE2-CE2 3.71Å; F72-Y102 HydrophobicContact CE2-CE2 3.71Å; F72-Y102 HydrophobicContact CE2-CG 4.08Å; F72-Y102 HydrophobicContact CZ-CD1 4.44Å; F72-Y102 AromaticContact CZ-CD2 3.43Å; F72-Y102 HydrophobicContact CZ-CD2 3.43Å; F72-Y102 VanDerWaalsContact CZ-CD2 3.43Å; F72-Y102 HydrophobicContact CZ-CE2 4.02Å; F72-Y102 AromaticContact CZ-CG 3.66Å; F72-Y102 HydrophobicContact CZ-CG 3.66Å; T84-Y102 CarbonylContact C-O 3.26Å; T84-Y102 WeakPolarHBondContact CA-O 3.5Å; M85-Y102 PolarHBondContact N-O 3.4Å; M85-Y102 PolarHBondContact O-N 3.49Å; A87-Y102 HydrophobicContact CB-CD2 4.05Å; A87-Y102 HydrophobicContact CB-CE2 3.9Å; Q100-Y102 HydrophobicContact CB-CD2 4.41Å; Q100-Y102 HydrophobicContact CB-CE2 3.72Å; Q100-Y102 VanDerWaalsContact CD-CZ 3.44Å; Q100-Y102 HydrophobicContact CG-CD2 4.32Å; Q100-Y102 HydrophobicContact CG-CE2 3.59Å; Q100-Y102 PolarHBondContact NE2-OH 2.82Å; Q100-Y102 PolarHBondContact OE1-OH 3.22Å; Y102-I139 HydrophobicContact CD1-CG2 3.68Å; Y102-I139 HydrophobicContact CE1-CG2 4.33Å; Y102-I139 HydrophobicContact CG-CG2 4.32Å; Y102-C140 CarbonylContact C-O 3.55Å; Y102-C140 VanDerWaalsContact CA-O 3.29Å; Y102-C140 WeakPolarHBondContact CA-O 3.44Å; Y102-E141 HydrophobicContact CD1-CB 4.34Å; Y102-E141 HydrophobicContact CE1-CB 4.23Å |
| 103 | S | 93.9 | Very high | 78.7 | Confident | 33 Ų | 33 | 70.4 Ų | 70.4 | 23% | 0.231 | 45% | 0.454 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -99 | 122.9 | 165.1 | -64.9 | 0 | 0 | 0 | 0 | 108.6 | C140 | S103-C140 PolarHBondContact N-O 3.44Å; S103-C140 PolarHBondContact O-N 3.46Å |
| 104 | V | 95.1 | Very high | 80.9 | Confident | 0 Ų | 0 | 67.8 Ų | 67.8 | 0% | 0 | 43% | 0.43 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -113.7 | 118.8 | -178.2 | -175.2 | 0 | 0 | 0 | 0 | 108.5 | M77 P78 L82 Q83 M85 N138 I139 | M77-V104 HydrophobicContact CE-CB 4.21Å; M77-V104 HydrophobicContact CE-CG1 3.52Å; M77-V104 HydrophobicContact CE-CG2 3.59Å; M77-V104 HydrophobicContact SD-CG1 4.31Å; M77-V104 HydrophobicContact SD-CG2 4.04Å; P78-V104 HydrophobicContact CG-CB 4.02Å; P78-V104 HydrophobicContact CG-CG1 3.8Å; L82-V104 CarbonylContact C-O 3.56Å; L82-V104 WeakPolarHBondContact CA-O 3.48Å; Q83-V104 PolarHBondContact N-O 3.2Å; Q83-V104 PolarHBondContact O-N 3.01Å; M85-V104 HydrophobicContact CG-CG2 4.3Å; M85-V104 HydrophobicContact SD-CB 4.48Å; M85-V104 HydrophobicContact SD-CG2 3.9Å; V104-N138 WeakPolarHBondContact CA-O 3.47Å; V104-I139 HydrophobicContact CG1-CG1 4.48Å; V104-I139 HydrophobicContact CG2-CG1 4.49Å |
| 105 | L | 95.1 | Very high | 83 | Confident | 85 Ų | 85 | 68 Ų | 68 | 45% | 0.445 | 42% | 0.421 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -113 | 114.5 | 175.8 | 175 | 65.7 | 0 | 0 | 0 | 109.3 | G81 L82 N138 | G81-L105 WeakPolarHBondContact O-CA 3.22Å; L82-L105 HydrophobicContact CB-CD1 4.16Å; L82-L105 HydrophobicContact CD1-CB 4.04Å; L105-N138 HydrophobicContact CB-CB 4.33Å; L105-N138 PolarHBondContact N-O 3.48Å; L105-N138 PolarHBondContact O-N 3.45Å |
| 106 | G | 95.1 | Very high | 85.2 | Confident | 6 Ų | 6 | 65.6 Ų | 65.6 | 6% | 0.062 | 39% | 0.385 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -110.5 | 148.4 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.8 | L79 S80 G81 L136 | L79-G106 CarbonylContact O-C 3.52Å; L79-G106 VanDerWaalsContact O-C 3.26Å; S80-G106 CarbonylContact C-O 3.43Å; S80-G106 WeakPolarHBondContact CA-O 3.13Å; G81-G106 PolarHBondContact N-O 2.85Å; G81-G106 PolarHBondContact O-N 2.91Å; G106-L136 WeakPolarHBondContact CA-O 3.38Å |
| 107 | G | 93.8 | Very high | 87 | Confident | 15 Ų | 15 | 68.9 Ų | 68.9 | 16% | 0.155 | 39% | 0.394 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -175.1 | 166.1 | 168.3 | 0 | 0 | 0 | 0 | 0 | 113.9 | L79 S109 G135 L136 | L79-G107 PolarHBondContact O-N 2.9Å; G107-S109 PolarHBondContact O-N 2.9Å; G107-G135 VanDerWaalsContact O-CA 3.31Å; G107-G135 WeakPolarHBondContact O-CA 3.26Å; G107-L136 PolarHBondContact N-O 2.85Å; G107-L136 VanDerWaalsContact N-O 3.16Å; G107-L136 PolarHBondContact O-N 2.78Å |
| 108 | P | 90.4 | Very high | 88.6 | Confident | 108 Ų | 108 | 61 Ų | 61 | 70% | 0.701 | 35% | 0.352 | S | S | * | . | S | Bend | trans | -75.7 | -13.1 | 179.8 | 31.7 | -36.1 | 0 | 0 | 0 | 113.1 | ||
| 109 | S | 76 | Confident | 89.8 | Confident | 106 Ų | 106 | 56.6 Ų | 56.6 | 74% | 0.741 | 33% | 0.328 | S | S | * | . | S | Bend | trans | -96.5 | 137.9 | -176.4 | -173.5 | 0 | 0 | 0 | 0 | 111.2 | G107 | G107-S109 PolarHBondContact O-N 2.9Š|
| 110 | G | 74.2 | Confident | 90.2 | Very high | 55 Ų | 55 | 51.1 Ų | 51.1 | 57% | 0.567 | 31% | 0.31 | S | S | * | . | S | Bend | trans | 122.4 | -3.1 | 169.3 | 0 | 0 | 0 | 0 | 0 | 116.6 | ||
| 111 | A | 83.8 | Confident | 90.1 | Very high | 3 Ų | 3 | 51.8 Ų | 51.8 | 3% | 0.025 | 32% | 0.318 | C | S | . | . | trans | -137.7 | 16.7 | 179.8 | 0 | 0 | 0 | 0 | 0 | 114.3 | L60 D113 L114 F133 L136 | L60-A111 HydrophobicContact CB-CB 4.43Å; L60-A111 HydrophobicContact CD2-CB 4.28Å; A111-D113 VanDerWaalsContact C-N 3.3Å; A111-D113 PolarHBondContact O-N 3.48Å; A111-L114 HydrophobicContact CB-CD1 4.23Å; A111-L114 PolarHBondContact O-N 3.26Å; A111-L114 VanDerWaalsContact O-N 3.11Å; A111-F133 HydrophobicContact CB-CB 3.76Å; A111-F133 HydrophobicContact CB-CD2 4.21Å; A111-F133 HydrophobicContact CB-CG 4.18Å; A111-L136 HydrophobicContact CB-CB 4.41Å | ||
| 112 | A | 84.5 | Confident | 89.9 | Confident | 68 Ų | 68 | 58.6 Ų | 58.6 | 56% | 0.562 | 35% | 0.349 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63.9 | -32.6 | -176.6 | 0 | 0 | 0 | 0 | 0 | 113.5 | L114 | A112-L114 VanDerWaalsContact C-N 3.3Š|
| 113 | D | 90.3 | Very high | 89.5 | Confident | 155 Ų | 155 | 61.4 Ų | 61.4 | 83% | 0.829 | 37% | 0.366 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -86.8 | -1.8 | 178.5 | -56.8 | -37.5 | 0 | 0 | 0 | 112.9 | A111 | A111-D113 VanDerWaalsContact C-N 3.3Å; A111-D113 PolarHBondContact O-N 3.48Å |
| 114 | L | 93.4 | Very high | 88.7 | Confident | 84 Ų | 84 | 64.8 Ų | 64.8 | 44% | 0.44 | 38% | 0.382 | S | S | . | . | trans | -99 | 137.4 | -179 | -59 | 178.7 | 0 | 0 | 0 | 109.5 | L60 A111 A112 F133 | L60-L114 HydrophobicContact CD2-CD1 3.54Å; A111-L114 HydrophobicContact CB-CD1 4.23Å; A111-L114 PolarHBondContact O-N 3.26Å; A111-L114 VanDerWaalsContact O-N 3.11Å; A112-L114 VanDerWaalsContact C-N 3.3Å; L114-F133 HydrophobicContact CB-CD2 3.83Å; L114-F133 HydrophobicContact CB-CE2 3.85Å; L114-F133 VanDerWaalsContact O-CD2 3.23Å; L114-F133 WeakPolarHBondContact O-CD2 3.35Å | ||
| 115 | H | 94.2 | Very high | 87.9 | Confident | 95 Ų | 95 | 72.6 Ų | 72.6 | 44% | 0.44 | 42% | 0.423 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -128.3 | 138.3 | 178.1 | -67.9 | -88.2 | 0 | 0 | 0 | 109.7 | L117 C129 A130 | H115-L117 PolarHBondContact O-N 2.86Å; H115-C129 HydrophobicContact CB-CB 4.32Å; H115-A130 PolarHBondContact ND1-O 3.37Å |
| 116 | L | 94.3 | Very high | 87.5 | Confident | 47 Ų | 47 | 73.8 Ų | 73.8 | 25% | 0.246 | 43% | 0.429 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -73.1 | 125.9 | 170.2 | 172.5 | 67.3 | 0 | 0 | 0 | 109.3 | T46 L58 A130 F133 | T46-L116 HydrophobicContact CG2-CD2 4.45Å; L58-L116 HydrophobicContact CD1-CD2 4.05Å; L58-L116 HydrophobicContact CD2-CB 3.91Å; L58-L116 HydrophobicContact CD2-CD2 4.45Å; L116-A130 HydrophobicContact CB-CB 3.91Å; L116-A130 WeakPolarHBondContact O-CB 3.29Å; L116-A130 PolarHBondContact O-N 3.24Å; L116-F133 HydrophobicContact CB-CZ 4.22Å |
| 117 | L | 94.1 | Very high | 87.3 | Confident | 105 Ų | 105 | 78.2 Ų | 78.2 | 55% | 0.55 | 46% | 0.455 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -82.1 | 117.7 | 167.5 | -62.6 | -177.4 | 0 | 0 | 0 | 108.9 | H115 V127 | H115-L117 PolarHBondContact O-N 2.86Å; L117-V127 HydrophobicContact CB-CG1 3.75Å; L117-V127 HydrophobicContact CD1-CG1 4.47Å; L117-V127 HydrophobicContact CD2-CG1 4.17Å; L117-V127 HydrophobicContact CG-CG1 4.34Å |
| 118 | T | 93.8 | Very high | 87.3 | Confident | 2 Ų | 2 | 79.7 Ų | 79.7 | 1% | 0.012 | 46% | 0.461 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -138.7 | -173.5 | -177.9 | -168.6 | 0 | 0 | 0 | 0 | 110.8 | T46 I48 V127 V128 A130 | T46-T118 VanDerWaalsContact O-CB 3.3Å; T46-T118 WeakPolarHBondContact O-CB 3.43Å; T46-T118 PolarHBondContact O-OG1 3.38Å; I48-T118 HydrophobicContact CB-CG2 4.15Å; I48-T118 HydrophobicContact CD1-CG2 4.27Å; T118-V127 CarbonylContact O-C 3.46Å; T118-V127 WeakPolarHBondContact O-CA 3.28Å; T118-V128 HydrophobicContact CG2-CG2 4.04Å; T118-V128 PolarHBondContact N-O 2.75Å; T118-V128 WeakPolarHBondContact O-CG2 3.36Å; T118-V128 PolarHBondContact O-N 3.08Å; T118-A130 HydrophobicContact CG2-CB 4.33Å |
| 119 | S | 93.2 | Very high | 87.4 | Confident | 3 Ų | 3 | 78.6 Ų | 78.6 | 2% | 0.021 | 46% | 0.455 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -123.8 | 161.9 | 179.4 | -54.4 | 0 | 0 | 0 | 0 | 111.3 | P42 L47 I48 L124 L126 | P42-S119 WeakPolarHBondContact CG-OG 3.25Å; L47-S119 WeakPolarHBondContact CD2-O 3.29Å; I48-S119 PolarHBondContact N-O 2.68Å; S119-L124 PolarHBondContact OG-O 3.07Å; S119-L124 VanDerWaalsContact OG-O 3.05Å; S119-L126 PolarHBondContact OG-O 2.8Å |
| 120 | H | 90.3 | Very high | 88.3 | Confident | 54 Ų | 54 | 73.7 Ų | 73.7 | 25% | 0.25 | 42% | 0.421 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -83.8 | 142 | 165.9 | -156.9 | -61.7 | 0 | 0 | 0 | 109.5 | I48 E49 Q122 T123 L124 | I48-H120 HydrophobicContact CG2-CB 4.18Å; E49-H120 IonicContact OE1-CE1 3Å; E49-H120 PolarHBondContact OE1-CE1 3.43Å; E49-H120 IonicContact OE1-ND1 3.57Å; E49-H120 IonicContact OE1-NE2 3.9Å; H120-Q122 PolarHBondContact ND1-N 2.83Å; H120-Q122 PolarHBondContact O-N 2.74Å; H120-Q122 VanDerWaalsContact O-N 3.11Å; H120-T123 VanDerWaalsContact CB-OG1 3.29Å; H120-T123 WeakPolarHBondContact CB-OG1 3.33Å; H120-T123 CarbonylContact O-C 3.51Å; H120-T123 VanDerWaalsContact O-C 3.23Å; H120-T123 PolarHBondContact O-N 3.48Å; H120-T123 VanDerWaalsContact O-N 3.1Å; H120-L124 PolarHBondContact O-N 2.98Å |
| 121 | P | 85.8 | Confident | 89.1 | Confident | 49 Ų | 49 | 74 Ų | 74 | 32% | 0.318 | 41% | 0.413 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -57 | -26.3 | 175.2 | 15.8 | -29.6 | 0 | 0 | 0 | 114.4 | L47 E49 | L47-P121 HydrophobicContact CD1-CB 4.1Å; E49-P121 HydrophobicContact CG-CG 3.99Å; E49-P121 WeakPolarHBondContact OE1-CG 3.3Å; E49-P121 WeakPolarHBondContact OE2-CG 3.33Å |
| 122 | Q | 85 | Confident | 89.6 | Confident | 155 Ų | 155 | 75.9 Ų | 75.9 | 72% | 0.724 | 43% | 0.428 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -90 | -20.3 | -178 | -60.1 | 169.5 | 20.9 | 0 | 0 | 112.1 | H120 | H120-Q122 PolarHBondContact ND1-N 2.83Å; H120-Q122 PolarHBondContact O-N 2.74Å; H120-Q122 VanDerWaalsContact O-N 3.11Å |
| 123 | T | 83.8 | Confident | 90.1 | Very high | 61 Ų | 61 | 74 Ų | 74 | 37% | 0.374 | 41% | 0.408 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -136.5 | 68.5 | -178.1 | 53.3 | 0 | 0 | 0 | 0 | 110 | H120 D125 L126 | H120-T123 VanDerWaalsContact CB-OG1 3.29Å; H120-T123 WeakPolarHBondContact CB-OG1 3.33Å; H120-T123 CarbonylContact O-C 3.51Å; H120-T123 VanDerWaalsContact O-C 3.23Å; H120-T123 PolarHBondContact O-N 3.48Å; H120-T123 VanDerWaalsContact O-N 3.1Å; T123-D125 PolarHBondContact O-N 2.86Å; T123-D125 VanDerWaalsContact O-N 3.17Å; T123-L126 HydrophobicContact CG2-CD1 4.28Å; T123-L126 PolarHBondContact O-N 3.41Å |
| 124 | L | 77.3 | Confident | 90.2 | Very high | 105 Ų | 105 | 69 Ų | 69 | 55% | 0.55 | 39% | 0.385 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -60.3 | -27.7 | -175.7 | -66.6 | 174.2 | 0 | 0 | 0 | 113.6 | L47 S119 H120 L126 | L47-L124 HydrophobicContact CD2-CD2 4.39Å; S119-L124 PolarHBondContact OG-O 3.07Å; S119-L124 VanDerWaalsContact OG-O 3.05Å; H120-L124 PolarHBondContact O-N 2.98Å; L124-L126 VanDerWaalsContact C-N 3.31Å |
| 125 | D | 78.4 | Confident | 90.3 | Very high | 163 Ų | 163 | 65 Ų | 65 | 87% | 0.872 | 36% | 0.364 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -79.9 | -10.5 | 179.8 | -68.8 | -16.9 | 0 | 0 | 0 | 113.6 | T123 | T123-D125 PolarHBondContact O-N 2.86Å; T123-D125 VanDerWaalsContact O-N 3.17Å |
| 126 | L | 86.4 | Confident | 90.4 | Very high | 110 Ų | 110 | 61.6 Ų | 61.6 | 58% | 0.576 | 35% | 0.349 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -100.4 | 126.7 | 176.9 | -68 | 176 | 0 | 0 | 0 | 110.3 | S119 T123 L124 | S119-L126 PolarHBondContact OG-O 2.8Å; T123-L126 HydrophobicContact CG2-CD1 4.28Å; T123-L126 PolarHBondContact O-N 3.41Å; L124-L126 VanDerWaalsContact C-N 3.31Å |
| 127 | V | 90.7 | Very high | 90.4 | Very high | 99 Ų | 99 | 59.9 Ų | 59.9 | 60% | 0.6 | 34% | 0.34 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -87.9 | 130.8 | 174.3 | -177.6 | 0 | 0 | 0 | 0 | 109.2 | L117 T118 | L117-V127 HydrophobicContact CB-CG1 3.75Å; L117-V127 HydrophobicContact CD1-CG1 4.47Å; L117-V127 HydrophobicContact CD2-CG1 4.17Å; L117-V127 HydrophobicContact CG-CG1 4.34Å; T118-V127 CarbonylContact O-C 3.46Å; T118-V127 WeakPolarHBondContact O-CA 3.28Å |
| 128 | V | 93.1 | Very high | 90.5 | Very high | 47 Ų | 47 | 56.8 Ų | 56.8 | 29% | 0.285 | 32% | 0.324 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -125 | 155.2 | 177.2 | -61.2 | 0 | 0 | 0 | 0 | 110.2 | I48 T118 | I48-V128 HydrophobicContact CB-CG2 4.05Å; I48-V128 HydrophobicContact CD1-CG2 4.35Å; I48-V128 HydrophobicContact CG1-CG2 4.19Å; I48-V128 HydrophobicContact CG2-CG2 4.45Å; T118-V128 HydrophobicContact CG2-CG2 4.04Å; T118-V128 PolarHBondContact N-O 2.75Å; T118-V128 WeakPolarHBondContact O-CG2 3.36Å; T118-V128 PolarHBondContact O-N 3.08Å |
| 129 | C | 93.4 | Very high | 90.5 | Very high | 84 Ų | 84 | 57 Ų | 57 | 57% | 0.568 | 33% | 0.325 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -88.4 | 127.7 | 174.5 | -60.8 | 0 | 0 | 0 | 0 | 110.1 | H115 | H115-C129 HydrophobicContact CB-CB 4.32Å |
| 130 | A | 93.4 | Very high | 90.5 | Very high | 4 Ų | 4 | 60.2 Ų | 60.2 | 3% | 0.033 | 35% | 0.346 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -72.3 | 168.6 | 169 | 0 | 0 | 0 | 0 | 0 | 111.4 | I48 V51 L58 H115 L116 T118 | I48-A130 HydrophobicContact CD1-CB 4.2Å; V51-A130 HydrophobicContact CG1-CB 4.25Å; L58-A130 HydrophobicContact CD2-CB 4.47Å; H115-A130 PolarHBondContact ND1-O 3.37Å; L116-A130 HydrophobicContact CB-CB 3.91Å; L116-A130 WeakPolarHBondContact O-CB 3.29Å; L116-A130 PolarHBondContact O-N 3.24Å; T118-A130 HydrophobicContact CG2-CB 4.33Å |
| 131 | P | 92.4 | Very high | 90.5 | Very high | 60 Ų | 60 | 60 Ų | 60 | 39% | 0.39 | 35% | 0.346 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -53.4 | 163.4 | 166.7 | -24.3 | 35 | 0 | 0 | 0 | 112.5 | ||
| 132 | A | 93.3 | Very high | 90.4 | Very high | 43 Ų | 43 | 59.2 Ų | 59.2 | 36% | 0.355 | 34% | 0.341 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -61.6 | 152.6 | 174.5 | 0 | 0 | 0 | 0 | 0 | 111 | S134 | A132-S134 PolarHBondContact O-N 2.92Å |
| 133 | F | 95 | Very high | 89.8 | Confident | 29 Ų | 29 | 60.9 Ų | 60.9 | 13% | 0.127 | 34% | 0.342 | C | S | . | . | P | Polyproline II helix | trans | -62.6 | 135.4 | 175.5 | -69.7 | -90.3 | 0 | 0 | 0 | 111.1 | L58 L60 A111 L114 L116 G135 | L58-F133 HydrophobicContact CB-CD1 4.34Å; L58-F133 HydrophobicContact CD1-CE1 4.21Å; L58-F133 HydrophobicContact CD2-CD1 3.75Å; L58-F133 HydrophobicContact CD2-CE1 3.71Å; L58-F133 HydrophobicContact CD2-CG 4.19Å; L58-F133 HydrophobicContact CD2-CZ 4.11Å; L58-F133 HydrophobicContact CG-CD1 3.51Å; L58-F133 HydrophobicContact CG-CE1 3.61Å; L58-F133 HydrophobicContact CG-CG 4.32Å; L58-F133 HydrophobicContact CG-CZ 4.48Å; L58-F133 CarbonylContact O-C 3.53Å; L58-F133 WeakPolarHBondContact O-CA 3.33Å; L60-F133 HydrophobicContact CB-CD1 3.76Å; L60-F133 HydrophobicContact CB-CE1 3.92Å; L60-F133 HydrophobicContact CB-CG 4.15Å; L60-F133 HydrophobicContact CB-CZ 4.42Å; L60-F133 HydrophobicContact CD1-CE1 4.42Å; L60-F133 HydrophobicContact CD1-CZ 4.4Å; A111-F133 HydrophobicContact CB-CB 3.76Å; A111-F133 HydrophobicContact CB-CD2 4.21Å; A111-F133 HydrophobicContact CB-CG 4.18Å; L114-F133 HydrophobicContact CB-CD2 3.83Å; L114-F133 HydrophobicContact CB-CE2 3.85Å; L114-F133 VanDerWaalsContact O-CD2 3.23Å; L114-F133 WeakPolarHBondContact O-CD2 3.35Å; L116-F133 HydrophobicContact CB-CZ 4.22Å; F133-G135 PolarHBondContact O-N 3.22Å |
| 134 | S | 93.9 | Very high | 88.8 | Confident | 50 Ų | 50 | 60.3 Ų | 60.3 | 35% | 0.35 | 35% | 0.348 | S | S | . | . | S | Bend | trans | -63.9 | -27.8 | 172 | -50.7 | 0 | 0 | 0 | 0 | 112.2 | L58 A132 | L58-S134 PolarHBondContact N-OG 3.23Å; L58-S134 VanDerWaalsContact N-OG 3.14Å; L58-S134 WeakPolarHBondContact O-CB 3.4Å; L58-S134 PolarHBondContact O-N 3.11Å; A132-S134 PolarHBondContact O-N 2.92Å |
| 135 | G | 94.6 | Very high | 87.9 | Confident | 0 Ų | 0 | 60.7 Ų | 60.7 | 0% | 0 | 35% | 0.351 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -177.6 | -179.4 | 175.8 | 0 | 0 | 0 | 0 | 0 | 114.4 | L60 G107 F133 | L60-G135 PolarHBondContact N-O 2.82Å; G107-G135 VanDerWaalsContact O-CA 3.31Å; G107-G135 WeakPolarHBondContact O-CA 3.26Å; F133-G135 PolarHBondContact O-N 3.22Å |
| 136 | L | 95.5 | Very high | 86.7 | Confident | 24 Ų | 24 | 56.3 Ų | 56.3 | 13% | 0.126 | 33% | 0.332 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -126.7 | 133.6 | -179.7 | 174.3 | 67.7 | 0 | 0 | 0 | 110 | L60 K62 G106 G107 A111 | L60-L136 HydrophobicContact CB-CD1 3.82Å; L60-L136 HydrophobicContact CD2-CD1 3.92Å; L60-L136 HydrophobicContact CG-CD1 3.72Å; L60-L136 CarbonylContact O-C 3.23Å; L60-L136 WeakPolarHBondContact O-CA 3.4Å; L60-L136 WeakPolarHBondContact O-CD1 3.13Å; K62-L136 HydrophobicContact CB-CD1 4.36Å; G106-L136 WeakPolarHBondContact CA-O 3.38Å; G107-L136 PolarHBondContact N-O 2.85Å; G107-L136 VanDerWaalsContact N-O 3.16Å; G107-L136 PolarHBondContact O-N 2.78Å; A111-L136 HydrophobicContact CB-CB 4.41Å |
| 137 | L | 95.3 | Very high | 85.2 | Confident | 10 Ų | 10 | 55.1 Ų | 55.1 | 5% | 0.052 | 33% | 0.333 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -106.4 | 123.6 | 167.8 | -63 | -178.9 | 0 | 0 | 0 | 109.6 | W59 L60 I61 K62 P78 L79 | W59-L137 HydrophobicContact CE3-CD2 4.12Å; W59-L137 HydrophobicContact CE3-CG 3.96Å; W59-L137 HydrophobicContact CZ3-CD2 4.06Å; W59-L137 HydrophobicContact CZ3-CG 4.4Å; L60-L137 PolarHBondContact O-N 3.11Å; I61-L137 WeakPolarHBondContact CA-O 3.46Å; I61-L137 HydrophobicContact CD1-CD1 4.44Å; I61-L137 HydrophobicContact CG1-CB 4.3Å; I61-L137 HydrophobicContact CG1-CD1 4.26Å; I61-L137 HydrophobicContact CG2-CB 4.49Å; K62-L137 PolarHBondContact N-O 3.28Å; P78-L137 VanDerWaalsContact O-CD2 3.25Å; P78-L137 WeakPolarHBondContact O-CD2 3.47Å; L79-L137 HydrophobicContact CD2-CD1 4.28Å; L79-L137 HydrophobicContact CD2-CD2 4.25Å |
| 138 | N | 95.3 | Very high | 83.5 | Confident | 40 Ų | 40 | 54 Ų | 54 | 21% | 0.214 | 33% | 0.327 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -104.8 | 118.6 | 169.9 | -68.2 | -77.1 | 0 | 0 | 0 | 109.1 | K62 V104 L105 | K62-N138 WeakPolarHBondContact CD-OD1 3.36Å; V104-N138 WeakPolarHBondContact CA-O 3.47Å; L105-N138 HydrophobicContact CB-CB 4.33Å; L105-N138 PolarHBondContact N-O 3.48Å; L105-N138 PolarHBondContact O-N 3.45Å |
| 139 | I | 95.4 | Very high | 81.7 | Confident | 6 Ų | 6 | 58.6 Ų | 58.6 | 3% | 0.031 | 35% | 0.35 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -106.3 | 130.3 | 175.6 | -56.6 | 176.6 | 0 | 0 | 0 | 107.1 | I61 K62 A63 P64 F67 M77 Y102 V104 | I61-I139 HydrophobicContact CG2-CD1 3.8Å; I61-I139 HydrophobicContact CG2-CG1 4.39Å; K62-I139 PolarHBondContact O-N 3.41Å; A63-I139 HydrophobicContact CB-CB 4.06Å; A63-I139 HydrophobicContact CB-CD1 4.48Å; P64-I139 WeakPolarHBondContact CD-O 3.31Å; F67-I139 HydrophobicContact CD2-CG2 3.96Å; F67-I139 HydrophobicContact CE1-CD1 4.08Å; F67-I139 HydrophobicContact CE2-CD1 3.75Å; F67-I139 HydrophobicContact CE2-CG2 3.82Å; F67-I139 HydrophobicContact CZ-CD1 3.49Å; F67-I139 VanDerWaalsContact CZ-CD1 3.49Å; M77-I139 HydrophobicContact CE-CD1 3.52Å; M77-I139 HydrophobicContact CE-CG1 3.9Å; Y102-I139 HydrophobicContact CD1-CG2 3.68Å; Y102-I139 HydrophobicContact CE1-CG2 4.33Å; Y102-I139 HydrophobicContact CG-CG2 4.32Å; V104-I139 HydrophobicContact CG1-CG1 4.48Å; V104-I139 HydrophobicContact CG2-CG1 4.49Å |
| 140 | C | 93.1 | Very high | 80.2 | Confident | 71 Ų | 71 | 60.9 Ų | 60.9 | 48% | 0.48 | 35% | 0.352 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -131.2 | 134.9 | 173.9 | -63.7 | 0 | 0 | 0 | 0 | 108.8 | Y102 S103 S142 | Y102-C140 CarbonylContact C-O 3.55Å; Y102-C140 VanDerWaalsContact CA-O 3.29Å; Y102-C140 WeakPolarHBondContact CA-O 3.44Å; S103-C140 PolarHBondContact N-O 3.44Å; S103-C140 PolarHBondContact O-N 3.46Å; C140-S142 PolarHBondContact O-N 2.88Å |
| 141 | E | 90 | Very high | 79.2 | Confident | 51 Ų | 51 | 66.2 Ų | 66.2 | 24% | 0.238 | 38% | 0.384 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -67.4 | 127.9 | 167.8 | -174.6 | 175.7 | -170.2 | 0 | 0 | 108.4 | Q100 Y102 Y143 | Q100-E141 HydrophobicContact CG-CG 4.23Å; Q100-E141 PolarHBondContact NE2-OE1 3.41Å; Q100-E141 PolarHBondContact NE2-OE2 2.95Å; Y102-E141 HydrophobicContact CD1-CB 4.34Å; Y102-E141 HydrophobicContact CE1-CB 4.23Å; E141-Y143 VanDerWaalsContact CD-CZ 3.46Å; E141-Y143 HydrophobicContact CG-CE1 4.02Å; E141-Y143 HydrophobicContact CG-CE2 4.39Å; E141-Y143 VanDerWaalsContact OE1-CE1 3.3Å; E141-Y143 WeakPolarHBondContact OE1-CE1 3.31Å; E141-Y143 PolarHBondContact OE2-OH 3.14Å |
| 142 | S | 82.5 | Confident | 78.4 | Confident | 31 Ų | 31 | 69.3 Ų | 69.3 | 22% | 0.217 | 40% | 0.404 | C | S | . | . | trans | -110.3 | 122.8 | 176.4 | 52.4 | 0 | 0 | 0 | 0 | 109.1 | I101 C140 | I101-S142 VanDerWaalsContact C-OG 3.29Å; I101-S142 VanDerWaalsContact CG2-OG 3.28Å; I101-S142 WeakPolarHBondContact CG2-OG 3.38Å; I101-S142 PolarHBondContact O-N 2.82Å; I101-S142 VanDerWaalsContact O-O 3.13Å; I101-S142 PolarHBondContact O-OG 2.89Å; I101-S142 VanDerWaalsContact O-OG 3.07Å; C140-S142 PolarHBondContact O-N 2.88Å | ||
| 143 | Y | 73.6 | Confident | 77.9 | Confident | 191 Ų | 191 | 73.4 Ų | 73.4 | 75% | 0.749 | 42% | 0.419 | S | S | * | . | trans | -90 | 126.1 | 176.3 | -57.7 | -77 | 0 | 0 | 0 | 109.8 | E141 | E141-Y143 VanDerWaalsContact CD-CZ 3.46Å; E141-Y143 HydrophobicContact CG-CE1 4.02Å; E141-Y143 HydrophobicContact CG-CE2 4.39Å; E141-Y143 VanDerWaalsContact OE1-CE1 3.3Å; E141-Y143 WeakPolarHBondContact OE1-CE1 3.31Å; E141-Y143 PolarHBondContact OE2-OH 3.14Å | ||
| 144 | G | 62.8 | Low | 77.4 | Confident | 49 Ų | 49 | 76.3 Ų | 76.3 | 51% | 0.505 | 45% | 0.449 | S | S | . | . | S | Bend | trans | 142.8 | 126.5 | 177 | 0 | 0 | 0 | 0 | 0 | 111.8 | I101 C146 | I101-G144 WeakPolarHBondContact CD1-O 3Å; G144-C146 PolarHBondContact O-N 2.78Å |
| 145 | D | 58.2 | Low | 77 | Confident | 112 Ų | 112 | 81 Ų | 81 | 60% | 0.599 | 47% | 0.468 | S | S | * | . | trans | -69.7 | 94.3 | 179.2 | -78.2 | -25.3 | 0 | 0 | 0 | 110.8 | S147 T148 | D145-S147 PolarHBondContact O-N 3.14Å; D145-S147 VanDerWaalsContact O-N 3.09Å; D145-T148 HydrophobicContact CB-CG2 4.12Å; D145-T148 PolarHBondContact O-N 3.08Å; D145-T148 PolarHBondContact O-OG1 2.91Å | ||
| 146 | C | 53.1 | Low | 76.7 | Confident | 72 Ų | 72 | 86.1 Ų | 86.1 | 49% | 0.486 | 50% | 0.501 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -63.8 | -8.7 | 165.5 | -58.2 | 0 | 0 | 0 | 0 | 112.3 | G144 T148 | G144-C146 PolarHBondContact O-N 2.78Å; C146-T148 VanDerWaalsContact C-N 3.25Å |
| 147 | S | 55.3 | Low | 76.5 | Confident | 84 Ų | 84 | 89.6 Ų | 89.6 | 59% | 0.587 | 53% | 0.533 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -69.6 | -25.9 | 171.4 | 65.7 | 0 | 0 | 0 | 0 | 111.7 | D145 N149 | D145-S147 PolarHBondContact O-N 3.14Å; D145-S147 VanDerWaalsContact O-N 3.09Å; S147-N149 PolarHBondContact O-N 3.02Å |
| 148 | T | 54.8 | Low | 76.1 | Confident | 77 Ų | 77 | 95 Ų | 95 | 47% | 0.472 | 57% | 0.567 | S | S | . | * | trans | -82.2 | 72 | 168 | 70.8 | 0 | 0 | 0 | 0 | 108.3 | D145 C146 Q150 | D145-T148 HydrophobicContact CB-CG2 4.12Å; D145-T148 PolarHBondContact O-N 3.08Å; D145-T148 PolarHBondContact O-OG1 2.91Å; C146-T148 VanDerWaalsContact C-N 3.25Å; T148-Q150 PolarHBondContact O-N 2.72Å | ||
| 149 | N | 55.1 | Low | 75.9 | Confident | 143 Ų | 143 | 98.7 Ų | 98.7 | 77% | 0.765 | 59% | 0.593 | S | S | * | * | trans | -62.6 | 64.6 | 146.9 | -68.2 | -74.4 | 0 | 0 | 0 | 107.1 | S147 T151 | S147-N149 PolarHBondContact O-N 3.02Å; N149-T151 VanDerWaalsContact C-N 3.28Å; N149-T151 PolarHBondContact O-N 2.95Å | ||
| 150 | Q | 62 | Low | 75.8 | Confident | 131 Ų | 131 | 102.3 Ų | 102.3 | 61% | 0.612 | 62% | 0.624 | S | S | * | * | trans | -63.8 | 107.4 | 163.2 | -56.8 | -151.6 | 16.7 | 0 | 0 | 103.4 | T148 | T148-Q150 PolarHBondContact O-N 2.72Š| ||
| 151 | T | 71.3 | Confident | 75.7 | Confident | 116 Ų | 116 | 105.1 Ų | 105.1 | 71% | 0.712 | 64% | 0.641 | S | S | * | * | trans | -42 | 127.7 | 161.1 | 47 | 0 | 0 | 0 | 0 | 106.6 | N149 I153 | N149-T151 VanDerWaalsContact C-N 3.28Å; N149-T151 PolarHBondContact O-N 2.95Å; T151-I153 PolarHBondContact O-N 2.78Å | ||
| 152 | P | 75.7 | Confident | 75.8 | Confident | 125 Ų | 125 | 108.9 Ų | 108.9 | 81% | 0.812 | 67% | 0.668 | S | S | * | * | trans | -43.8 | 119.8 | 178.9 | -28.8 | 33.2 | 0 | 0 | 0 | 108.8 | A154 | P152-A154 PolarHBondContact O-N 3.05Š| ||
| 153 | I | 83.1 | Confident | 76.1 | Confident | 129 Ų | 129 | 112 Ų | 112 | 66% | 0.662 | 69% | 0.686 | S | S | * | * | trans | -65.7 | 112.3 | -179.2 | -62.5 | 174 | 0 | 0 | 0 | 105.4 | T151 I155 | T151-I153 PolarHBondContact O-N 2.78Å; I153-I155 PolarHBondContact O-N 3.49Å | ||
| 154 | A | 84.9 | Confident | 76.8 | Confident | 91 Ų | 91 | 107.2 Ų | 107.2 | 75% | 0.752 | 68% | 0.678 | S | S | * | * | trans | -63 | 105.5 | 177.5 | 0 | 0 | 0 | 0 | 0 | 108.1 | P152 | P152-A154 PolarHBondContact O-N 3.05Š| ||
| 155 | I | 85.4 | Confident | 78 | Confident | 148 Ų | 148 | 111.3 Ų | 111.3 | 76% | 0.759 | 70% | 0.695 | S | S | * | * | P | Polyproline II helix | trans | -76.1 | 121 | 170 | -58 | 178.2 | 0 | 0 | 0 | 105.8 | I153 A157 | I153-I155 PolarHBondContact O-N 3.49Å; I155-A157 PolarHBondContact O-N 3.13Å |
| 156 | P | 89.3 | Confident | 79.3 | Confident | 108 Ų | 108 | 109.3 Ų | 109.3 | 70% | 0.701 | 70% | 0.702 | S | S | * | * | P | Polyproline II helix | trans | -57.7 | 140.9 | 176.7 | 23.4 | -31.7 | 0 | 0 | 0 | 109.3 | T158 | P156-T158 PolarHBondContact O-N 3.17Š|
| 157 | A | 89.7 | Confident | 80.9 | Confident | 96 Ų | 96 | 112.7 Ų | 112.7 | 79% | 0.793 | 71% | 0.714 | S | S | * | * | P | Polyproline II helix | trans | -54.5 | 127.2 | 178.9 | 0 | 0 | 0 | 0 | 0 | 109.6 | I155 | I155-A157 PolarHBondContact O-N 3.13Š|
| 158 | T | 88.6 | Confident | 82.3 | Confident | 124 Ų | 124 | 118.7 Ų | 118.7 | 76% | 0.761 | 72% | 0.724 | S | S | * | * | P | Polyproline II helix | trans | -58.3 | 134.4 | 170.9 | 50.3 | 0 | 0 | 0 | 0 | 108.4 | P156 | P156-T158 PolarHBondContact O-N 3.17Š|
| 159 | P | 91 | Very high | 83.7 | Confident | 117 Ų | 117 | 121.9 Ų | 121.9 | 76% | 0.76 | 73% | 0.734 | S | S | * | * | P | Polyproline II helix | trans | -57.7 | 151.9 | 178 | 25 | -33.6 | 0 | 0 | 0 | 110.3 | ||
| 160 | A | 92.1 | Very high | 85.1 | Confident | 83 Ų | 83 | 126.9 Ų | 126.9 | 69% | 0.686 | 74% | 0.742 | S | S | * | * | P | Polyproline II helix | trans | -53.6 | 136.5 | 177.8 | 0 | 0 | 0 | 0 | 0 | 110 | T162 | A160-T162 PolarHBondContact O-N 3.08Š|
| 161 | P | 90.9 | Very high | 86.2 | Confident | 129 Ų | 129 | 128 Ų | 128 | 84% | 0.838 | 74% | 0.744 | S | S | * | * | P | Polyproline II helix | trans | -57.8 | 129.2 | 178.8 | 24.2 | -33.1 | 0 | 0 | 0 | 109.4 | ||
| 162 | T | 91.8 | Very high | 86.8 | Confident | 131 Ų | 131 | 127.3 Ų | 127.3 | 80% | 0.804 | 73% | 0.733 | S | S | * | * | P | Polyproline II helix | trans | -74.7 | 134.3 | 178.4 | -57.9 | 0 | 0 | 0 | 0 | 109.4 | A160 P164 | A160-T162 PolarHBondContact O-N 3.08Å; T162-P164 WeakPolarHBondContact O-CD 3.23Å |
| 163 | V | 89.1 | Confident | 87.3 | Confident | 96 Ų | 96 | 124.2 Ų | 124.2 | 58% | 0.582 | 71% | 0.713 | S | S | * | * | P | Polyproline II helix | trans | -61.8 | 125.4 | 173.3 | 178.4 | 0 | 0 | 0 | 0 | 108.5 | L167 | V163-L167 HydrophobicContact CG1-CB 3.69Å; V163-L167 HydrophobicContact CG1-CD1 4.06Å; V163-L167 HydrophobicContact CG1-CD2 3.96Å; V163-L167 HydrophobicContact CG1-CG 4.1Å |
| 164 | P | 89.7 | Confident | 87.3 | Confident | 91 Ų | 91 | 128.3 Ų | 128.3 | 59% | 0.591 | 73% | 0.727 | S | S | * | * | P | Polyproline II helix | trans | -58.1 | 141.5 | 179.8 | -25.5 | 34.1 | 0 | 0 | 0 | 111.8 | T162 G166 L167 | T162-P164 WeakPolarHBondContact O-CD 3.23Å; P164-G166 PolarHBondContact O-N 3.13Å; P164-L167 PolarHBondContact O-N 3.34Å |
| 165 | P | 87.3 | Confident | 87.2 | Confident | 134 Ų | 134 | 128.1 Ų | 128.1 | 87% | 0.87 | 73% | 0.734 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -57 | 139.5 | 171.3 | 25.8 | -33.3 | 0 | 0 | 0 | 109.7 | ||
| 166 | G | 85.4 | Confident | 86.8 | Confident | 71 Ų | 71 | 123.3 Ų | 123.3 | 73% | 0.732 | 71% | 0.713 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 94.8 | 4.4 | -178.7 | 0 | 0 | 0 | 0 | 0 | 115.5 | P164 R168 | P164-G166 PolarHBondContact O-N 3.13Å; G166-R168 PolarHBondContact O-N 3.37Å |
| 167 | L | 86.4 | Confident | 85.9 | Confident | 142 Ų | 142 | 129.2 Ų | 129.2 | 74% | 0.743 | 72% | 0.721 | S | S | * | * | trans | -65.9 | 113.6 | 165.7 | -162.6 | 112.2 | 0 | 0 | 0 | 109.7 | V163 P164 | V163-L167 HydrophobicContact CG1-CB 3.69Å; V163-L167 HydrophobicContact CG1-CD1 4.06Å; V163-L167 HydrophobicContact CG1-CD2 3.96Å; V163-L167 HydrophobicContact CG1-CG 4.1Å; P164-L167 PolarHBondContact O-N 3.34Å | ||
| 168 | R | 84.7 | Confident | 84.8 | Confident | 210 Ų | 210 | 128.4 Ų | 128.4 | 79% | 0.792 | 71% | 0.707 | S | S | * | * | trans | -117.6 | 153.3 | -177.9 | -64.9 | 177.1 | 69.9 | -162.4 | 1 | 111.1 | G166 R170 | G166-R168 PolarHBondContact O-N 3.37Å; R168-R170 PolarHBondContact O-N 3.19Å; R168-R170 VanDerWaalsContact O-N 3.08Å | ||
| 169 | Q | 85 | Confident | 83.4 | Confident | 145 Ų | 145 | 127.6 Ų | 127.6 | 68% | 0.678 | 70% | 0.703 | S | S | * | * | trans | -61.2 | 108.9 | 171.6 | -179.1 | 176.4 | -4.4 | 0 | 0 | 109.8 | F171 | Q169-F171 VanDerWaalsContact CG-O 3.31Å; Q169-F171 WeakPolarHBondContact CG-O 3.32Å; Q169-F171 PolarHBondContact NE2-O 3.43Å | ||
| 170 | R | 84 | Confident | 81.7 | Confident | 248 Ų | 248 | 128.3 Ų | 128.3 | 94% | 0.936 | 71% | 0.705 | S | S | * | * | trans | -91.3 | -17.4 | 179.8 | -63.9 | -173.8 | -179.1 | -170.6 | -0.6 | 113.7 | R168 | R168-R170 PolarHBondContact O-N 3.19Å; R168-R170 VanDerWaalsContact O-N 3.08Å | ||
| 171 | F | 85.2 | Confident | 80.2 | Confident | 153 Ų | 153 | 132 Ų | 132 | 67% | 0.671 | 71% | 0.713 | S | S | * | * | trans | -106.3 | 117.7 | 178.5 | -176.8 | -102.5 | 0 | 0 | 0 | 110.1 | Q169 P173 | Q169-F171 VanDerWaalsContact CG-O 3.31Å; Q169-F171 WeakPolarHBondContact CG-O 3.32Å; Q169-F171 PolarHBondContact NE2-O 3.43Å; F171-P173 HydrophobicContact CE1-CB 4.13Å | ||
| 172 | Q | 83.9 | Confident | 78.1 | Confident | 103 Ų | 103 | 130.7 Ų | 130.7 | 48% | 0.481 | 71% | 0.707 | S | S | . | * | trans | -112.5 | 114.2 | 172.7 | -173.8 | 167.4 | 3.9 | 0 | 0 | 107.3 | S176 | Q172-S176 WeakPolarHBondContact CG-OG 2.94Å; Q172-S176 PolarHBondContact NE2-O 3.44Å | ||
| 173 | P | 86.5 | Confident | 75.9 | Confident | 59 Ų | 59 | 136.3 Ų | 136.3 | 38% | 0.383 | 71% | 0.713 | S | S | . | * | trans | -63 | 144.7 | 178.2 | 22.5 | -28.6 | 0 | 0 | 0 | 110.1 | F171 G175 S176 | F171-P173 HydrophobicContact CE1-CB 4.13Å; P173-G175 PolarHBondContact O-N 2.99Å; P173-S176 VanDerWaalsContact CD-OG 3.23Å; P173-S176 WeakPolarHBondContact CD-OG 3.45Å; P173-S176 VanDerWaalsContact CG-OG 3.32Å; P173-S176 WeakPolarHBondContact CG-OG 3.44Å; P173-S176 PolarHBondContact O-N 3.05Å; P173-S176 PolarHBondContact O-OG 3.09Å | ||
| 174 | F | 82.1 | Confident | 73.9 | Confident | 216 Ų | 216 | 139.3 Ų | 139.3 | 95% | 0.947 | 73% | 0.725 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -52.1 | 128.1 | 178.2 | -78.5 | -84.5 | 0 | 0 | 0 | 110.7 | ||
| 175 | G | 82.7 | Confident | 71.9 | Confident | 87 Ų | 87 | 142.8 Ų | 142.8 | 90% | 0.897 | 74% | 0.736 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 86.2 | -6.5 | 179.8 | 0 | 0 | 0 | 0 | 0 | 115.9 | P173 | P173-G175 PolarHBondContact O-N 2.99Š|
| 176 | S | 77.5 | Confident | 69.6 | Low | 46 Ų | 46 | 145.4 Ų | 145.4 | 32% | 0.322 | 74% | 0.736 | S | S | . | * | trans | -86.4 | 131.9 | 171.9 | 68.7 | 0 | 0 | 0 | 0 | 110.5 | Q172 P173 | Q172-S176 WeakPolarHBondContact CG-OG 2.94Å; Q172-S176 PolarHBondContact NE2-O 3.44Å; P173-S176 VanDerWaalsContact CD-OG 3.23Å; P173-S176 WeakPolarHBondContact CD-OG 3.45Å; P173-S176 VanDerWaalsContact CG-OG 3.32Å; P173-S176 WeakPolarHBondContact CG-OG 3.44Å; P173-S176 PolarHBondContact O-N 3.05Å; P173-S176 PolarHBondContact O-OG 3.09Å | ||
| 177 | R | 70.9 | Confident | 67.3 | Low | 233 Ų | 233 | 149.2 Ų | 149.2 | 88% | 0.879 | 74% | 0.74 | S | S | * | * | trans | -106.9 | 118.8 | 165.3 | -66.5 | 176.2 | 71.3 | 174.5 | 2.3 | 106.5 | P179 | R177-P179 WeakPolarHBondContact O-CD 3.37Š| ||
| 178 | T | 65.6 | Low | 64.9 | Low | 79 Ų | 79 | 148.7 Ų | 148.7 | 49% | 0.485 | 74% | 0.743 | S | S | . | * | trans | -69.1 | 122 | 169.8 | 33.5 | 0 | 0 | 0 | 0 | 108.3 | T180 | T178-T180 PolarHBondContact O-N 3.26Š| ||
| 179 | P | 58.8 | Low | 63.2 | Low | 106 Ų | 106 | 144 Ų | 144 | 69% | 0.688 | 74% | 0.739 | S | S | * | * | trans | -67.7 | 122.5 | 170.6 | 26.6 | -29 | 0 | 0 | 0 | 107.6 | R177 L181 | R177-P179 WeakPolarHBondContact O-CD 3.37Å; P179-L181 PolarHBondContact O-N 3.31Å | ||
| 180 | T | 56.6 | Low | 60.8 | Low | 132 Ų | 132 | 144.2 Ų | 144.2 | 81% | 0.81 | 75% | 0.745 | S | S | * | * | trans | -62.8 | 77.8 | 173.9 | -48.1 | 0 | 0 | 0 | 0 | 109.7 | T178 S182 | T178-T180 PolarHBondContact O-N 3.26Å; T180-S182 PolarHBondContact O-N 3.33Å; T180-S182 VanDerWaalsContact O-N 3.16Å | ||
| 181 | L | 59.7 | Low | 58.5 | Low | 161 Ų | 161 | 138.2 Ų | 138.2 | 84% | 0.843 | 74% | 0.736 | S | S | * | * | trans | -82.4 | 85.8 | 169.9 | -74.6 | -175.4 | 0 | 0 | 0 | 109.4 | P179 | P179-L181 PolarHBondContact O-N 3.31Š| ||
| 182 | S | 47.8 | Very low | 56.4 | Low | 102 Ų | 102 | 135.7 Ų | 135.7 | 71% | 0.713 | 74% | 0.736 | S | S | * | * | trans | 179.6 | 59.9 | 144.1 | 52.7 | 0 | 0 | 0 | 0 | 110.2 | T180 L184 | T180-S182 PolarHBondContact O-N 3.33Å; T180-S182 VanDerWaalsContact O-N 3.16Å; S182-L184 PolarHBondContact O-N 3.46Å | ||
| 183 | R | 46 | Very low | 54.4 | Low | 248 Ų | 248 | 138.3 Ų | 138.3 | 94% | 0.936 | 75% | 0.752 | S | S | * | * | trans | -71.7 | 89.6 | 155.2 | -163.3 | -178.4 | -169.9 | -162 | 2 | 105.8 | M185 | R183-M185 PolarHBondContact O-N 3.15Š| ||
| 184 | L | 46 | Very low | 52.3 | Low | 159 Ų | 159 | 140.8 Ų | 140.8 | 83% | 0.832 | 77% | 0.768 | S | S | * | * | trans | -57.7 | 133.4 | 170.1 | -157.5 | 84.2 | 0 | 0 | 0 | 107.7 | S182 E186 | S182-L184 PolarHBondContact O-N 3.46Å; L184-E186 PolarHBondContact O-N 3.39Å | ||
| 185 | M | 48.4 | Very low | 49.9 | Very low | 164 Ų | 164 | 134.5 Ų | 134.5 | 81% | 0.808 | 75% | 0.751 | S | S | * | * | trans | -54.5 | 127.9 | 172.7 | -68.8 | 166.9 | 80.7 | 0 | 0 | 110.2 | R183 | R183-M185 PolarHBondContact O-N 3.15Š| ||
| 186 | E | 39 | Very low | 47.7 | Very low | 189 Ų | 189 | 136.8 Ų | 136.8 | 88% | 0.883 | 75% | 0.748 | S | S | * | * | trans | -144.9 | 102.7 | 151.2 | -126.6 | 177 | 171.4 | 0 | 0 | 106.3 | L184 | L184-E186 PolarHBondContact O-N 3.39Š| ||
| 187 | D | 37.5 | Very low | 46.2 | Very low | 152 Ų | 152 | 139.9 Ų | 139.9 | 81% | 0.813 | 77% | 0.767 | S | S | * | * | trans | -80.4 | 119.4 | 174 | -89 | -34.7 | 0 | 0 | 0 | 108.9 | ||||
| 188 | T | 34.4 | Very low | 44.5 | Very low | 130 Ų | 130 | 138.2 Ų | 138.2 | 80% | 0.798 | 77% | 0.769 | S | S | * | * | trans | -146.6 | 129.9 | 152.3 | -42.6 | 0 | 0 | 0 | 0 | 107.1 | ||||
| 189 | P | 49.8 | Very low | 42.9 | Very low | 111 Ų | 111 | 140.6 Ų | 140.6 | 72% | 0.721 | 78% | 0.783 | S | S | * | * | trans | -93.9 | 138.1 | -166.8 | 35 | -31.3 | 0 | 0 | 0 | 112.2 | ||||
| 190 | D | 33.4 | Very low | 42 | Very low | 150 Ų | 150 | 141.4 Ų | 141.4 | 80% | 0.802 | 79% | 0.789 | S | S | * | * | trans | -177.8 | 108 | 131.2 | -101.1 | -35.8 | 0 | 0 | 0 | 112.7 | ||||
| 191 | T | 37 | Very low | 40.9 | Very low | 122 Ų | 122 | 143.2 Ų | 143.2 | 75% | 0.748 | 79% | 0.792 | S | S | * | * | 61.1 | 150.1 | 125.2 | -40.7 | 0 | 0 | 0 | 0 | 119.7 | |||||
| 192 | P | 41.6 | Very low | 39.7 | Very low | 101 Ų | 101 | 146.2 Ų | 146.2 | 66% | 0.656 | 79% | 0.792 | S | S | * | * | -134 | 152.3 | -70.7 | 39.9 | -21.4 | 0 | 0 | 0 | 115.7 | |||||
| 193 | L | 40.8 | Very low | 39.1 | Very low | 158 Ų | 158 | 148.3 Ų | 148.3 | 83% | 0.827 | 80% | 0.801 | S | S | * | * | trans | 58.2 | 169.2 | 148.8 | -66.8 | 169.7 | 0 | 0 | 0 | 119.6 | ||||
| 194 | P | 42.1 | Very low | 38.5 | Very low | 111 Ų | 111 | 142 Ų | 142 | 72% | 0.721 | 79% | 0.79 | S | S | * | * | cis | -125.6 | 140.2 | 7.3 | 33.4 | -13.2 | 0 | 0 | 0 | 114.7 | ||||
| 195 | S | 32.9 | Very low | 37.9 | Very low | 84 Ų | 84 | 142.2 Ų | 142.2 | 59% | 0.587 | 79% | 0.791 | S | S | * | * | 48 | 105.5 | 90.5 | 72.9 | 0 | 0 | 0 | 0 | 118.8 | |||||
| 196 | T | 36.2 | Very low | 37.3 | Very low | 135 Ų | 135 | 141.4 Ų | 141.4 | 83% | 0.828 | 79% | 0.79 | S | S | * | * | trans | 80.1 | 165.9 | 141 | 65.2 | 0 | 0 | 0 | 0 | 119.8 | ||||
| 197 | P | 45.5 | Very low | 37.3 | Very low | 111 Ų | 111 | 138.1 Ų | 138.1 | 72% | 0.721 | 79% | 0.785 | S | S | * | * | -137 | 155.1 | -63.7 | 38.4 | -22.6 | 0 | 0 | 0 | 111.8 | |||||
| 198 | E | 34.8 | Very low | 36.9 | Very low | 198 Ų | 198 | 134.2 Ų | 134.2 | 93% | 0.925 | 78% | 0.781 | S | S | * | * | trans | -129.5 | 125.2 | 162.3 | -71.7 | -164.6 | 164.6 | 0 | 0 | 112.5 | ||||
| 199 | T | 31.5 | Very low | 36.9 | Very low | 128 Ų | 128 | 137.9 Ų | 137.9 | 79% | 0.785 | 79% | 0.789 | S | S | * | * | trans | -61.1 | 147.6 | -175.7 | 44.4 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 200 | P | 40 | Very low | 36.2 | Very low | 124 Ų | 124 | 139.6 Ų | 139.6 | 81% | 0.805 | 79% | 0.787 | S | S | * | * | trans | -87.1 | 129 | 153.7 | 31.1 | -24.4 | 0 | 0 | 0 | 110.7 | R202 | P200-R202 PolarHBondContact O-N 3.21Š| ||
| 201 | L | 35.1 | Very low | 36.3 | Very low | 169 Ų | 169 | 142.2 Ų | 142.2 | 89% | 0.885 | 79% | 0.786 | S | S | * | * | trans | -45.7 | 129 | 171.4 | -102.5 | 137.7 | 0 | 0 | 0 | 112.5 | ||||
| 202 | R | 34.1 | Very low | 36.5 | Very low | 224 Ų | 224 | 145.8 Ų | 145.8 | 85% | 0.845 | 79% | 0.791 | S | S | * | * | trans | -69 | 129.9 | 164 | -72.8 | 179.9 | 168.3 | 168.8 | -3.7 | 109.8 | P200 | P200-R202 PolarHBondContact O-N 3.21Š| ||
| 203 | V | 34.2 | Very low | 36.5 | Very low | 146 Ų | 146 | 146.9 Ų | 146.9 | 89% | 0.885 | 80% | 0.801 | S | S | * | * | trans | -118.9 | 109.4 | 147.1 | 175.1 | 0 | 0 | 0 | 0 | 106.5 | ||||
| 204 | T | 33.3 | Very low | 36.8 | Very low | 116 Ų | 116 | 149.2 Ų | 149.2 | 71% | 0.712 | 81% | 0.805 | S | S | * | * | trans | -103 | 131.4 | 170.1 | 29.4 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 205 | L | 33.8 | Very low | 36.9 | Very low | 163 Ų | 163 | 154 Ų | 154 | 85% | 0.853 | 81% | 0.814 | S | S | * | * | trans | -169.8 | 85 | 146.4 | -94.6 | 169.9 | 0 | 0 | 0 | 105.5 | ||||
| 206 | D | 35.3 | Very low | 37.7 | Very low | 148 Ų | 148 | 159.9 Ų | 159.9 | 79% | 0.791 | 83% | 0.829 | S | S | * | * | 93.7 | 161.6 | 85.8 | -113 | -10 | 0 | 0 | 0 | 113.4 | |||||
| 207 | P | 39.3 | Very low | 38.3 | Very low | 119 Ų | 119 | 162.9 Ų | 162.9 | 77% | 0.773 | 83% | 0.831 | S | S | * | * | -122.8 | 166.9 | -122.9 | 35.1 | -15.6 | 0 | 0 | 0 | 113.3 | |||||
| 208 | G | 28.8 | Very low | 38.4 | Very low | 71 Ų | 71 | 167.3 Ų | 167.3 | 73% | 0.732 | 84% | 0.839 | S | S | * | * | trans | 156.7 | 103.3 | 164.6 | 0 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 209 | E | 34.3 | Very low | 39.2 | Very low | 206 Ų | 206 | 165.6 Ų | 165.6 | 96% | 0.963 | 83% | 0.828 | S | S | * | * | 125 | 128 | 127.3 | -66.7 | -161.4 | 137.3 | 0 | 0 | 116.8 | |||||
| 210 | E | 36.4 | Very low | 39.7 | Very low | 147 Ų | 147 | 167.1 Ų | 167.1 | 69% | 0.687 | 83% | 0.831 | S | S | * | * | trans | -91.1 | 153.2 | -166.8 | -142.9 | -174.9 | -139 | 0 | 0 | 109.6 | ||||
| 211 | R | 35.3 | Very low | 40.3 | Very low | 205 Ų | 205 | 169.3 Ų | 169.3 | 77% | 0.774 | 83% | 0.829 | S | S | * | * | trans | 87.4 | 113.6 | 158.2 | -50.5 | 157.8 | -172.4 | -166 | -0.4 | 117.1 | ||||
| 212 | K | 41.2 | Very low | 40.3 | Very low | 197 Ų | 197 | 169 Ų | 169 | 86% | 0.857 | 83% | 0.827 | S | S | * | * | 179.2 | 116.3 | 95.6 | -91.9 | 166.9 | -173.3 | 173.2 | 0 | 110.1 | K214 | K212-K214 PolarHBondContact O-N 2.6Š| |||
| 213 | S | 41.3 | Very low | 40.6 | Very low | 125 Ų | 125 | 166 Ų | 166 | 87% | 0.874 | 83% | 0.826 | S | S | * | * | trans | -67.3 | 121.4 | 170.6 | 45.9 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 214 | K | 46.8 | Very low | 40.9 | Very low | 207 Ų | 207 | 168.4 Ų | 168.4 | 90% | 0.9 | 82% | 0.824 | S | S | * | * | trans | -114.6 | 96.4 | 165.2 | -98.7 | -179.7 | 177.7 | 174.6 | 0 | 109.8 | K212 K216 | K212-K214 PolarHBondContact O-N 2.6Å; K214-K216 PolarHBondContact O-N 2.76Å; K214-K216 VanDerWaalsContact O-N 3.15Å | ||
| 215 | K | 45.2 | Very low | 40.8 | Very low | 212 Ų | 212 | 168.2 Ų | 168.2 | 92% | 0.922 | 82% | 0.823 | S | S | * | * | trans | -54.4 | 104.3 | 167.4 | -175.9 | 174.2 | -175.8 | 172.8 | 0 | 109.9 | ||||
| 216 | K | 49.5 | Very low | 40.7 | Very low | 206 Ų | 206 | 168.6 Ų | 168.6 | 90% | 0.896 | 82% | 0.821 | S | S | * | * | trans | -106.3 | 101 | 168 | -153.5 | 173.3 | -175.2 | 178.5 | 0 | 109.5 | K214 K218 | K214-K216 PolarHBondContact O-N 2.76Å; K214-K216 VanDerWaalsContact O-N 3.15Å; K216-K218 PolarHBondContact O-N 3.16Å | ||
| 217 | K | 49.3 | Very low | 40.6 | Very low | 198 Ų | 198 | 168.9 Ų | 168.9 | 86% | 0.861 | 82% | 0.817 | S | S | * | * | trans | -54.5 | 112.6 | 172.3 | -176.2 | 178.2 | -176.7 | 176.8 | 0 | 109.9 | ||||
| 218 | K | 47.6 | Very low | 40.3 | Very low | 205 Ų | 205 | 170.7 Ų | 170.7 | 89% | 0.891 | 82% | 0.817 | S | S | * | * | trans | -110.8 | 121 | 162.7 | -158.8 | 175.1 | -178.8 | -176.4 | 0 | 108.1 | K216 | K216-K218 PolarHBondContact O-N 3.16Š| ||
| 219 | K | 50.5 | Low | 40.7 | Very low | 161 Ų | 161 | 175.9 Ų | 175.9 | 70% | 0.7 | 82% | 0.823 | S | S | * | * | trans | -78.4 | 119.1 | -171.6 | 176.3 | 178.2 | 179.8 | 174 | 0 | 109.2 | ||||
| 220 | D | 41.7 | Very low | 40.6 | Very low | 160 Ų | 160 | 174.9 Ų | 174.9 | 86% | 0.856 | 82% | 0.818 | S | S | * | * | trans | -59.1 | 130.9 | 159.2 | -81.5 | -46.7 | 0 | 0 | 0 | 109.7 | ||||
| 221 | K | 53 | Low | 40.4 | Very low | 171 Ų | 171 | 171 Ų | 171 | 74% | 0.743 | 82% | 0.817 | S | S | * | * | trans | -125.5 | 98.4 | 160.2 | -87.3 | -165.8 | 173.7 | -168.9 | 0 | 108.4 | ||||
| 222 | L | 36.1 | Very low | 40.2 | Very low | 163 Ų | 163 | 166.9 Ų | 166.9 | 85% | 0.853 | 82% | 0.815 | S | S | * | * | trans | -4.7 | 119.3 | 144.1 | -146.1 | 84.2 | 0 | 0 | 0 | 115 | ||||
| 223 | I | 39 | Very low | 39.7 | Very low | 160 Ų | 160 | 169 Ų | 169 | 82% | 0.821 | 82% | 0.817 | S | S | * | * | trans | -80.8 | 126 | 163.7 | -65.7 | 164.8 | 0 | 0 | 0 | 106.8 | ||||
| 224 | K | 40.3 | Very low | 39.3 | Very low | 197 Ų | 197 | 169 Ų | 169 | 86% | 0.857 | 81% | 0.812 | S | S | * | * | trans | -114.8 | 119.7 | 170.2 | -158.1 | 179.1 | -176.3 | -173.1 | 0 | 107.7 | ||||
| 225 | T | 32.8 | Very low | 38.7 | Very low | 112 Ų | 112 | 168.7 Ų | 168.7 | 69% | 0.687 | 81% | 0.81 | S | S | * | * | trans | -78.8 | 158.3 | 175.7 | -35.8 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 226 | E | 31.6 | Very low | 38.3 | Very low | 170 Ų | 170 | 167.5 Ų | 167.5 | 79% | 0.794 | 81% | 0.808 | S | S | * | * | trans | 74.8 | 139 | 165.7 | -80.6 | -178.8 | 164.1 | 0 | 0 | 117 | ||||
| 227 | E | 31.6 | Very low | 37.5 | Very low | 154 Ų | 154 | 166.6 Ų | 166.6 | 72% | 0.72 | 81% | 0.807 | S | S | * | * | cis | -164.6 | 153.4 | 9.9 | -146.2 | -178 | 156.2 | 0 | 0 | 108.6 | ||||
| 228 | M | 33.6 | Very low | 36.5 | Very low | 158 Ų | 158 | 165 Ų | 165 | 78% | 0.778 | 81% | 0.807 | S | S | * | * | trans | 51.1 | 135.1 | 149.5 | -108 | 170.2 | 81.4 | 0 | 0 | 124.2 | ||||
| 229 | E | 37.2 | Very low | 35.8 | Very low | 180 Ų | 180 | 162 Ų | 162 | 84% | 0.841 | 80% | 0.801 | S | S | * | * | trans | 94.3 | 78.2 | 148 | -146.6 | 173.5 | -165.7 | 0 | 0 | 117.9 | ||||
| 230 | E | 33.3 | Very low | 35 | Very low | 184 Ų | 184 | 161.6 Ų | 161.6 | 86% | 0.86 | 80% | 0.801 | S | S | * | * | trans | -108.9 | 101.5 | 161 | -163.8 | 172.5 | -167.4 | 0 | 0 | 109.9 | V232 | E230-V232 PolarHBondContact O-N 3.22Š| ||
| 231 | G | 30.9 | Very low | 34.4 | Very low | 66 Ų | 66 | 161.9 Ų | 161.9 | 68% | 0.68 | 80% | 0.799 | S | S | * | * | trans | -72.3 | 107.6 | 166.2 | 0 | 0 | 0 | 0 | 0 | 110.3 | R233 | G231-R233 PolarHBondContact O-N 3.19Å; G231-R233 VanDerWaalsContact O-N 3.13Å | ||
| 232 | V | 30.7 | Very low | 33.4 | Very low | 119 Ų | 119 | 159 Ų | 159 | 72% | 0.721 | 80% | 0.796 | S | S | * | * | trans | -69.1 | 104.1 | 174.9 | 177.8 | 0 | 0 | 0 | 0 | 109.5 | E230 V234 | E230-V232 PolarHBondContact O-N 3.22Å; V232-V234 HydrophobicContact CG1-CG2 4.03Å | ||
| 233 | R | 31 | Very low | 33.2 | Very low | 240 Ų | 240 | 160.2 Ų | 160.2 | 91% | 0.906 | 80% | 0.797 | S | S | * | * | trans | -87.4 | 104 | 164.5 | -62.7 | -173.7 | -174 | -151.1 | 1.1 | 108.2 | G231 K235 | G231-R233 PolarHBondContact O-N 3.19Å; G231-R233 VanDerWaalsContact O-N 3.13Å; R233-K235 PolarHBondContact O-N 3.45Å | ||
| 234 | V | 33.4 | Very low | 33 | Very low | 126 Ų | 126 | 157.5 Ų | 157.5 | 76% | 0.764 | 79% | 0.792 | S | S | * | * | trans | -68.4 | 123.7 | 173.5 | 175 | 0 | 0 | 0 | 0 | 109.1 | V232 Q236 | V232-V234 HydrophobicContact CG1-CG2 4.03Å; V234-Q236 PolarHBondContact O-N 2.93Å | ||
| 235 | K | 34.2 | Very low | 32.7 | Very low | 200 Ų | 200 | 153.9 Ų | 153.9 | 87% | 0.87 | 79% | 0.789 | S | S | * | * | trans | -62.8 | 123.5 | 166.8 | -86 | 178 | 169.4 | -179.1 | 0 | 109.3 | R233 | R233-K235 PolarHBondContact O-N 3.45Š| ||
| 236 | Q | 36.7 | Very low | 32.8 | Very low | 187 Ų | 187 | 157.4 Ų | 157.4 | 87% | 0.874 | 80% | 0.797 | S | S | * | * | trans | -95.2 | 115.7 | 163.7 | -166.9 | 171.2 | 8.6 | 0 | 0 | 107.9 | V234 | V234-Q236 PolarHBondContact O-N 2.93Š| ||
| 237 | E | 33.3 | Very low | 33.1 | Very low | 187 Ų | 187 | 157.5 Ų | 157.5 | 87% | 0.874 | 80% | 0.798 | S | S | * | * | trans | -75.2 | 125.5 | 166.7 | -96.7 | -178 | 158.2 | 0 | 0 | 109.1 | ||||
| 238 | L | 28.4 | Very low | 33.4 | Very low | 165 Ų | 165 | 156.4 Ų | 156.4 | 86% | 0.864 | 80% | 0.804 | S | S | * | * | trans | -110.8 | 107.2 | 172 | 178.8 | 71.5 | 0 | 0 | 0 | 106.6 | ||||
| 239 | L | 33.5 | Very low | 33.3 | Very low | 143 Ų | 143 | 159.4 Ų | 159.4 | 75% | 0.749 | 81% | 0.808 | S | S | * | * | trans | -86 | 106.6 | 161.4 | -83.3 | 143.9 | 0 | 0 | 0 | 106.3 | ||||
| 240 | E | 33.4 | Very low | 33 | Very low | 152 Ų | 152 | 160.6 Ų | 160.6 | 71% | 0.71 | 81% | 0.811 | S | S | * | * | 87.5 | 107.5 | 84.1 | -165.9 | 175.8 | -131.1 | 0 | 0 | 111.4 | |||||
| 241 | M | 28.9 | Very low | 33.2 | Very low | 165 Ų | 165 | 159.4 Ų | 159.4 | 81% | 0.813 | 81% | 0.81 | S | S | * | * | trans | -167.3 | 116.9 | 134.4 | -144.7 | 71.9 | 71 | 0 | 0 | 110.6 | ||||
| 242 | T | 32 | Very low | 33.4 | Very low | 111 Ų | 111 | 162.5 Ų | 162.5 | 68% | 0.681 | 82% | 0.818 | S | S | * | * | trans | -27.1 | 131.6 | 159.1 | 42.4 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 243 | H | 32.1 | Very low | 33.2 | Very low | 188 Ų | 188 | 160.3 Ų | 160.3 | 87% | 0.87 | 82% | 0.819 | S | S | * | * | -158 | 129.6 | 129.8 | -84.4 | -66.2 | 0 | 0 | 0 | 110 | |||||
| 244 | S | 33.7 | Very low | 33.1 | Very low | 103 Ų | 103 | 158.4 Ų | 158.4 | 72% | 0.72 | 82% | 0.82 | S | S | * | * | trans | -66.5 | 146.9 | 177.6 | 177.8 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 245 | P | 35.3 | Very low | 33 | Very low | 122 Ų | 122 | 161 Ų | 161 | 79% | 0.792 | 82% | 0.824 | S | S | * | * | trans | -107.5 | 117.6 | 153 | 26.3 | -11.5 | 0 | 0 | 0 | 111.1 | ||||
| 246 | E | 33.9 | Very low | 32.8 | Very low | 185 Ų | 185 | 158.7 Ų | 158.7 | 86% | 0.864 | 83% | 0.827 | S | S | * | * | P | Polyproline II helix | trans | -67.9 | 164.1 | 162.5 | -68 | -160.9 | 161.4 | 0 | 0 | 111.9 | ||
| 247 | E | 37.8 | Very low | 32.5 | Very low | 173 Ų | 173 | 157.5 Ų | 157.5 | 81% | 0.808 | 82% | 0.821 | S | S | * | * | P | Polyproline II helix | trans | -55.2 | 157.3 | -159.3 | -58.2 | -179 | 139.7 | 0 | 0 | 118.8 | ||
| 248 | P | 37.2 | Very low | 32.4 | Very low | 131 Ų | 131 | 155.7 Ų | 155.7 | 85% | 0.851 | 82% | 0.817 | S | S | * | * | P | Polyproline II helix | trans | -88.5 | 125.4 | 169 | 33.7 | -29.6 | 0 | 0 | 0 | 112.5 | ||
| 249 | Y | 32.4 | Very low | 32.7 | Very low | 220 Ų | 220 | 152.6 Ų | 152.6 | 86% | 0.863 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -97.3 | 150 | 166.8 | 40.8 | -89.9 | 0 | 0 | 0 | 112 | ||
| 250 | K | 30.8 | Very low | 32.9 | Very low | 205 Ų | 205 | 155 Ų | 155 | 89% | 0.891 | 82% | 0.817 | S | S | * | * | P | Polyproline II helix | trans | -68.9 | 147.4 | -160.2 | -67 | 167.9 | 175.1 | 175.5 | 0 | 116.4 | ||
| 251 | L | 37.2 | Very low | 32.7 | Very low | 160 Ų | 160 | 155.7 Ų | 155.7 | 84% | 0.838 | 82% | 0.82 | S | S | * | * | P | Polyproline II helix | trans | -54 | 158.4 | 157.9 | -88 | 165.5 | 0 | 0 | 0 | 113.1 | ||
| 252 | P | 34.9 | Very low | 33.2 | Very low | 131 Ų | 131 | 157 Ų | 157 | 85% | 0.851 | 82% | 0.821 | S | S | * | * | -150.3 | 155.3 | 81.7 | 37.5 | -17.6 | 0 | 0 | 0 | 118 | |||||
| 253 | G | 27.1 | Very low | 33.4 | Very low | 72 Ų | 72 | 162.9 Ų | 162.9 | 74% | 0.742 | 83% | 0.831 | S | S | * | * | trans | 122.9 | 92.4 | 145.2 | 0 | 0 | 0 | 0 | 0 | 116.1 | ||||
| 254 | Q | 29.8 | Very low | 33.7 | Very low | 200 Ų | 200 | 163.5 Ų | 163.5 | 94% | 0.935 | 83% | 0.831 | S | S | * | * | 168.2 | 130.2 | 93.2 | -159 | 165.6 | 38.2 | 0 | 0 | 109.3 | |||||
| 255 | E | 30 | Very low | 34.1 | Very low | 180 Ų | 180 | 168.6 Ų | 168.6 | 84% | 0.841 | 84% | 0.84 | S | S | * | * | trans | -69 | 139 | -178.6 | -58.2 | 166.4 | 152 | 0 | 0 | 110.8 | ||||
| 256 | T | 30.9 | Very low | 34.2 | Very low | 152 Ų | 152 | 173 Ų | 173 | 93% | 0.933 | 85% | 0.847 | S | S | * | * | -154.9 | 132.9 | 127.7 | -12.2 | 0 | 0 | 0 | 0 | 111.6 | |||||
| 257 | E | 30.1 | Very low | 34.5 | Very low | 163 Ų | 163 | 173.1 Ų | 173.1 | 76% | 0.762 | 84% | 0.844 | S | S | * | * | trans | -71.7 | 160.5 | -173.3 | -99.3 | -173.2 | 140 | 0 | 0 | 116 | ||||
| 258 | L | 30.6 | Very low | 34.4 | Very low | 149 Ų | 149 | 173.6 Ų | 173.6 | 78% | 0.78 | 84% | 0.844 | S | S | * | * | trans | 72.6 | 140.8 | 144 | -68.7 | 160.5 | 0 | 0 | 0 | 118.1 | ||||
| 259 | S | 35.8 | Very low | 34.4 | Very low | 100 Ų | 100 | 176.3 Ų | 176.3 | 70% | 0.699 | 84% | 0.842 | S | S | * | * | cis | -161.6 | 156.3 | -4.3 | 64.7 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 260 | E | 36.4 | Very low | 34.7 | Very low | 194 Ų | 194 | 175 Ų | 175 | 91% | 0.907 | 84% | 0.841 | S | S | * | * | trans | -78.8 | 135.5 | 160.3 | -66.9 | -175 | 131.7 | 0 | 0 | 109.9 | ||||
| 261 | E | 30.1 | Very low | 34.8 | Very low | 166 Ų | 166 | 172.5 Ų | 172.5 | 78% | 0.776 | 84% | 0.837 | S | S | * | * | trans | -155.5 | 126.8 | 143.2 | -142.5 | -175.7 | 142.7 | 0 | 0 | 113.5 | ||||
| 262 | K | 38 | Very low | 35.4 | Very low | 191 Ų | 191 | 174.7 Ų | 174.7 | 83% | 0.83 | 84% | 0.84 | S | S | * | * | trans | -69.9 | 144.9 | 172 | -65.7 | 167.7 | 174.1 | 166.3 | 0 | 110.7 | ||||
| 263 | R | 38.2 | Very low | 35.2 | Very low | 236 Ų | 236 | 175.2 Ų | 175.2 | 89% | 0.891 | 84% | 0.836 | S | S | * | * | trans | -168.8 | 156.9 | 137.4 | -105.6 | 155.4 | -174.2 | -159.6 | 2.4 | 115.7 | ||||
| 264 | K | 37.6 | Very low | 35.6 | Very low | 200 Ų | 200 | 183 Ų | 183 | 87% | 0.87 | 84% | 0.843 | S | S | * | * | trans | -81.9 | 144.7 | -161 | -68.8 | 165.7 | 169.4 | 172.9 | 0 | 114.9 | ||||
| 265 | K | 41.2 | Very low | 35.6 | Very low | 211 Ų | 211 | 176.7 Ų | 176.7 | 92% | 0.917 | 83% | 0.831 | S | S | * | * | 34.5 | 110.5 | 128.6 | -145.9 | 174.6 | -169.4 | 175.5 | 0 | 118.4 | |||||
| 266 | K | 39 | Very low | 35.5 | Very low | 215 Ų | 215 | 175.1 Ų | 175.1 | 94% | 0.935 | 83% | 0.828 | S | S | * | * | trans | -146.4 | 153.9 | 147.5 | -159.9 | 169.9 | 178.8 | -179.2 | 0 | 112 | ||||
| 267 | K | 38.4 | Very low | 35.8 | Very low | 186 Ų | 186 | 174.3 Ų | 174.3 | 81% | 0.809 | 82% | 0.823 | S | S | * | * | trans | -93.5 | 140.8 | -154.6 | 175 | -177.8 | 179.4 | -179.2 | 0 | 113.9 | ||||
| 268 | K | 37.5 | Very low | 36 | Very low | 183 Ų | 183 | 174.5 Ų | 174.5 | 80% | 0.796 | 82% | 0.824 | S | S | * | * | trans | 43.4 | 126.2 | 141.7 | -156 | 179.9 | -179.8 | 170.9 | 0 | 120.5 | ||||
| 269 | K | 36 | Very low | 36 | Very low | 188 Ų | 188 | 174.6 Ų | 174.6 | 82% | 0.817 | 83% | 0.825 | S | S | * | * | 134.3 | 122.4 | 120.1 | -158.9 | 177.2 | -176.2 | -177.1 | 0 | 111.3 | |||||
| 270 | K | 38.4 | Very low | 35.7 | Very low | 192 Ų | 192 | 175 Ų | 175 | 84% | 0.835 | 82% | 0.824 | S | S | * | * | 162 | 129.4 | 114.6 | -170.9 | 168 | 178.6 | -179.1 | 0 | 111.2 | |||||
| 271 | D | 33.7 | Very low | 35.6 | Very low | 154 Ų | 154 | 171.9 Ų | 171.9 | 82% | 0.824 | 82% | 0.817 | S | S | * | * | trans | -39.7 | 140.3 | 163.7 | -86.1 | -67.6 | 0 | 0 | 0 | 114.2 | ||||
| 272 | K | 49.4 | Very low | 35.6 | Very low | 206 Ų | 206 | 173.6 Ų | 173.6 | 90% | 0.896 | 82% | 0.818 | S | S | * | * | trans | -149.6 | 109.9 | 144.6 | -168 | 144.6 | 169.5 | 178 | 0 | 110.8 | ||||
| 273 | D | 30.8 | Very low | 35.4 | Very low | 142 Ų | 142 | 169.8 Ų | 169.8 | 76% | 0.759 | 82% | 0.815 | S | S | * | * | trans | -58.4 | 159.4 | 163.4 | -175.8 | 28.2 | 0 | 0 | 0 | 112.7 | ||||
| 274 | R | 36.8 | Very low | 35.2 | Very low | 236 Ų | 236 | 161.8 Ų | 161.8 | 89% | 0.891 | 80% | 0.796 | S | S | * | * | trans | 113.9 | 120 | 146.9 | -148.9 | 175.9 | -166.4 | -175.7 | 3.5 | 119.6 | ||||
| 275 | G | 28.4 | Very low | 34.8 | Very low | 66 Ų | 66 | 161.8 Ų | 161.8 | 68% | 0.68 | 80% | 0.796 | S | S | * | * | trans | 105.7 | 97.4 | 145.4 | 0 | 0 | 0 | 0 | 0 | 114 | ||||
| 276 | D | 29 | Very low | 34.5 | Very low | 147 Ų | 147 | 158.9 Ų | 158.9 | 79% | 0.786 | 79% | 0.791 | S | S | * | * | 71.4 | 111.9 | 73.8 | -165.5 | 26.6 | 0 | 0 | 0 | 112.6 | |||||
| 277 | V | 36.3 | Very low | 34.1 | Very low | 135 Ų | 135 | 154.4 Ų | 154.4 | 82% | 0.818 | 78% | 0.781 | S | S | * | * | -177.2 | 130.5 | 127.5 | 161 | 0 | 0 | 0 | 0 | 108.9 | |||||
| 278 | E | 34.2 | Very low | 34.2 | Very low | 168 Ų | 168 | 152.7 Ų | 152.7 | 79% | 0.785 | 78% | 0.779 | S | S | * | * | trans | -54.5 | 147.2 | 176 | -54.4 | 178.4 | 134.9 | 0 | 0 | 114.1 | ||||
| 279 | D | 31.5 | Very low | 34.3 | Very low | 151 Ų | 151 | 153 Ų | 153 | 81% | 0.807 | 78% | 0.78 | S | S | * | * | -154.6 | 104.8 | 128.5 | -127.3 | -20.7 | 0 | 0 | 0 | 111.1 | |||||
| 280 | T | 29.3 | Very low | 34.3 | Very low | 109 Ų | 109 | 152.8 Ų | 152.8 | 67% | 0.669 | 78% | 0.78 | S | S | * | * | 2.1 | 129.3 | 128.5 | 17.6 | 0 | 0 | 0 | 0 | 115.2 | |||||
| 281 | V | 33.6 | Very low | 34.6 | Very low | 128 Ų | 128 | 152.9 Ų | 152.9 | 78% | 0.776 | 78% | 0.783 | S | S | * | * | -169.4 | 121.5 | 67.3 | 170.6 | 0 | 0 | 0 | 0 | 110.5 | |||||
| 282 | Y | 30.2 | Very low | 34.6 | Very low | 201 Ų | 201 | 151.4 Ų | 151.4 | 79% | 0.788 | 78% | 0.779 | S | S | * | * | trans | 9 | 118.7 | 134.5 | -143.3 | -102.9 | 0 | 0 | 0 | 119.5 | S284 | Y282-S284 WeakPolarHBondContact CE1-OG 3.41Š| ||
| 283 | S | 33.2 | Very low | 34.2 | Very low | 111 Ų | 111 | 151 Ų | 151 | 78% | 0.776 | 78% | 0.781 | S | S | * | * | trans | -153.3 | 107.8 | 142.7 | -152.8 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 284 | S | 34.8 | Very low | 34.7 | Very low | 69 Ų | 69 | 149.8 Ų | 149.8 | 48% | 0.483 | 78% | 0.778 | S | S | . | * | trans | -77.5 | 128.5 | -177.6 | -53.1 | 0 | 0 | 0 | 0 | 111.8 | Y282 | Y282-S284 WeakPolarHBondContact CE1-OG 3.41Š| ||
| 285 | F | 29.7 | Very low | 34.9 | Very low | 200 Ų | 200 | 147.7 Ų | 147.7 | 88% | 0.877 | 78% | 0.776 | S | S | * | * | trans | -93.2 | 112.5 | 164 | -86.5 | -87 | 0 | 0 | 0 | 110 | V287 | F285-V287 PolarHBondContact O-N 2.97Š| ||
| 286 | N | 34.4 | Very low | 35.7 | Very low | 149 Ų | 149 | 150.7 Ų | 150.7 | 80% | 0.797 | 78% | 0.78 | S | S | * | * | trans | -72.5 | 115.6 | 169.5 | -75.8 | -37.7 | 0 | 0 | 0 | 109.9 | I288 | N286-I288 PolarHBondContact O-N 2.96Š| ||
| 287 | V | 31 | Very low | 36.9 | Very low | 121 Ų | 121 | 151.2 Ų | 151.2 | 73% | 0.733 | 78% | 0.778 | S | S | * | * | trans | -82.7 | 104.9 | 169.1 | 175.2 | 0 | 0 | 0 | 0 | 108.2 | F285 K289 | F285-V287 PolarHBondContact O-N 2.97Å; V287-K289 HydrophobicContact CG1-CG 4.06Å; V287-K289 PolarHBondContact O-N 2.93Å | ||
| 288 | I | 39.3 | Very low | 37.9 | Very low | 150 Ų | 150 | 150.7 Ų | 150.7 | 77% | 0.769 | 78% | 0.777 | S | S | * | * | trans | -88 | 100 | 164.5 | -61.8 | 175.9 | 0 | 0 | 0 | 107 | N286 | N286-I288 PolarHBondContact O-N 2.96Š| ||
| 289 | K | 39.7 | Very low | 38.1 | Very low | 189 Ų | 189 | 151.8 Ų | 151.8 | 82% | 0.822 | 79% | 0.785 | S | S | * | * | trans | -75.3 | 119.7 | 162.1 | -78.5 | 179.8 | 178.1 | -178.4 | 0 | 108.1 | V287 | V287-K289 HydrophobicContact CG1-CG 4.06Å; V287-K289 PolarHBondContact O-N 2.93Å | ||
| 290 | K | 37.5 | Very low | 38.5 | Very low | 185 Ų | 185 | 152.5 Ų | 152.5 | 80% | 0.804 | 79% | 0.788 | S | S | * | * | trans | -114 | 107.8 | 157.3 | -102.7 | -178.7 | 174.7 | 173.8 | 0 | 107.5 | ||||
| 291 | E | 43.6 | Very low | 39.5 | Very low | 194 Ų | 194 | 153 Ų | 153 | 91% | 0.907 | 80% | 0.797 | S | S | * | * | trans | -61.7 | 130.5 | 162.7 | -82 | 171.4 | 142.2 | 0 | 0 | 108.8 | ||||
| 292 | V | 33.5 | Very low | 40.3 | Very low | 123 Ų | 123 | 151.7 Ų | 151.7 | 75% | 0.745 | 79% | 0.793 | S | S | * | * | trans | -115.4 | 106.6 | 164.1 | 175.2 | 0 | 0 | 0 | 0 | 106 | V294 | V292-V294 HydrophobicContact CG1-CG2 4.32Å; V292-V294 PolarHBondContact O-N 2.74Å | ||
| 293 | E | 42.2 | Very low | 40.4 | Very low | 198 Ų | 198 | 152.8 Ų | 152.8 | 93% | 0.925 | 80% | 0.798 | S | S | * | * | trans | -61.5 | 111.7 | 167.2 | -109.5 | 179.1 | 157.5 | 0 | 0 | 108.7 | ||||
| 294 | V | 40.1 | Very low | 40.6 | Very low | 116 Ų | 116 | 150.3 Ų | 150.3 | 70% | 0.703 | 79% | 0.79 | S | S | * | * | trans | -98.9 | 108.8 | 166.9 | -179.4 | 0 | 0 | 0 | 0 | 107.7 | V292 V296 | V292-V294 HydrophobicContact CG1-CG2 4.32Å; V292-V294 PolarHBondContact O-N 2.74Å; V294-V296 PolarHBondContact O-N 2.96Å | ||
| 295 | K | 42.3 | Very low | 40.5 | Very low | 192 Ų | 192 | 156.5 Ų | 156.5 | 84% | 0.835 | 81% | 0.811 | S | S | * | * | trans | -67.1 | 106 | 172.7 | -164.2 | 179.3 | -175.7 | -173.5 | 0 | 108.6 | ||||
| 296 | V | 45 | Very low | 40.9 | Very low | 128 Ų | 128 | 153 Ų | 153 | 78% | 0.776 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -89.1 | 117.2 | 173.6 | -179.7 | 0 | 0 | 0 | 0 | 108 | V294 | V294-V296 PolarHBondContact O-N 2.96Š|
| 297 | E | 54.2 | Low | 41 | Very low | 158 Ų | 158 | 154.6 Ų | 154.6 | 74% | 0.738 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -77.1 | 144.4 | 167.6 | -71.5 | -168.6 | 159.2 | 0 | 0 | 110.5 | ||
| 298 | P | 55.7 | Low | 41.5 | Very low | 124 Ų | 124 | 156.1 Ų | 156.1 | 81% | 0.805 | 81% | 0.812 | S | S | * | * | P | Polyproline II helix | trans | -73.8 | 132.1 | -179.6 | 29.5 | -32.4 | 0 | 0 | 0 | 111.1 | D300 | P298-D300 PolarHBondContact O-N 2.75Š|
| 299 | M | 39.7 | Very low | 41.5 | Very low | 191 Ų | 191 | 154.4 Ų | 154.4 | 94% | 0.941 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -71.6 | 119 | 169 | -86.1 | 154.1 | 151.7 | 0 | 0 | 110.1 | S301 | M299-S301 PolarHBondContact O-N 2.98Š|
| 300 | D | 38.6 | Very low | 41.5 | Very low | 166 Ų | 166 | 148.3 Ų | 148.3 | 89% | 0.888 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -65.3 | 127.6 | 169.7 | -96.6 | -34.2 | 0 | 0 | 0 | 110.7 | P298 | P298-D300 PolarHBondContact O-N 2.75Š|
| 301 | S | 50.4 | Low | 41.7 | Very low | 120 Ų | 120 | 149.1 Ų | 149.1 | 84% | 0.839 | 81% | 0.808 | S | S | * | * | trans | -94.9 | 94.4 | 173.5 | 45.5 | 0 | 0 | 0 | 0 | 109.1 | M299 | M299-S301 PolarHBondContact O-N 2.98Š| ||
| 302 | S | 51.5 | Low | 41.7 | Very low | 101 Ų | 101 | 151.2 Ų | 151.2 | 71% | 0.706 | 81% | 0.808 | S | S | * | * | trans | -166.8 | 127.2 | 153.7 | 60 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 303 | Y | 32.8 | Very low | 42.4 | Very low | 224 Ų | 224 | 155.9 Ų | 155.9 | 88% | 0.878 | 82% | 0.818 | S | S | * | * | trans | 174.8 | 108.3 | 135 | -114.4 | -97.3 | 0 | 0 | 0 | 104.9 | ||||
| 304 | G | 36.5 | Very low | 42.7 | Very low | 59 Ų | 59 | 155.6 Ų | 155.6 | 61% | 0.608 | 81% | 0.814 | S | S | * | * | cis | 99.4 | 79.9 | 49.7 | 0 | 0 | 0 | 0 | 0 | 106.7 | V306 | G304-V306 PolarHBondContact O-N 3.44Š| ||
| 305 | E | 33.2 | Very low | 42.8 | Very low | 199 Ų | 199 | 160 Ų | 160 | 93% | 0.93 | 82% | 0.823 | S | S | * | * | trans | -57.5 | 112.5 | 173.9 | -174.4 | 170.6 | -177.2 | 0 | 0 | 109 | ||||
| 306 | V | 38.1 | Very low | 43.1 | Very low | 127 Ų | 127 | 157.4 Ų | 157.4 | 77% | 0.77 | 82% | 0.823 | S | S | * | * | trans | -91.6 | 111.4 | -179.4 | 179.5 | 0 | 0 | 0 | 0 | 108.4 | G304 | G304-V306 PolarHBondContact O-N 3.44Š| ||
| 307 | E | 36.2 | Very low | 43.1 | Very low | 182 Ų | 182 | 160.2 Ų | 160.2 | 85% | 0.85 | 83% | 0.825 | S | S | * | * | trans | -72.6 | 143.3 | 160.6 | -82.8 | -155.1 | 151.4 | 0 | 0 | 111.7 | ||||
| 308 | D | 40.6 | Very low | 42.8 | Very low | 152 Ų | 152 | 162 Ų | 162 | 81% | 0.813 | 83% | 0.83 | S | S | * | * | trans | -60.7 | 134.4 | 179.5 | -173.3 | 19.4 | 0 | 0 | 0 | 113.3 | ||||
| 309 | S | 39.8 | Very low | 42 | Very low | 115 Ų | 115 | 162.9 Ų | 162.9 | 80% | 0.804 | 83% | 0.828 | S | S | * | * | trans | -161.3 | 113.3 | 147.5 | 55.7 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 310 | G | 40.3 | Very low | 42.2 | Very low | 61 Ų | 61 | 164.1 Ų | 164.1 | 63% | 0.629 | 82% | 0.822 | S | S | * | * | trans | -68.4 | 164.6 | -178.3 | 0 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 311 | K | 40.6 | Very low | 42.4 | Very low | 202 Ų | 202 | 164.6 Ų | 164.6 | 88% | 0.878 | 82% | 0.819 | S | S | * | * | trans | -172.2 | 130.6 | 145.9 | -101.5 | 152.9 | -165.6 | 177.2 | 0 | 113.2 | ||||
| 312 | R | 45.1 | Very low | 42 | Very low | 238 Ų | 238 | 165.4 Ų | 165.4 | 90% | 0.898 | 81% | 0.814 | S | S | * | * | trans | 69.8 | 100.4 | 141 | -73.8 | 178.8 | 153.8 | -175.4 | -6.7 | 120.6 | K314 | R312-K314 PolarHBondContact O-N 3.5Š| ||
| 313 | K | 47.1 | Very low | 41.7 | Very low | 220 Ų | 220 | 167.9 Ų | 167.9 | 96% | 0.957 | 82% | 0.819 | S | S | * | * | trans | -42.1 | 115.6 | 153.6 | -150 | 171.9 | -170.2 | 172.7 | 0 | 112.8 | ||||
| 314 | K | 48.1 | Very low | 42.5 | Very low | 193 Ų | 193 | 168.8 Ų | 168.8 | 84% | 0.839 | 84% | 0.839 | S | S | * | * | trans | -107.6 | 118.7 | 167.2 | -167.1 | 173.3 | -178.4 | 178.1 | 0 | 109.7 | R312 | R312-K314 PolarHBondContact O-N 3.5Š| ||
| 315 | K | 43.6 | Very low | 42.8 | Very low | 209 Ų | 209 | 174.3 Ų | 174.3 | 91% | 0.909 | 85% | 0.851 | S | S | * | * | P | Polyproline II helix | trans | -73.4 | 118.4 | -179.9 | -163.5 | 177.9 | -174.2 | 179.8 | 0 | 109 | ||
| 316 | V | 47.9 | Very low | 43.3 | Very low | 137 Ų | 137 | 172.9 Ų | 172.9 | 83% | 0.83 | 85% | 0.846 | S | S | * | * | P | Polyproline II helix | trans | -100.4 | 129.1 | 172.4 | 177.4 | 0 | 0 | 0 | 0 | 109.3 | ||
| 317 | K | 44.5 | Very low | 43.5 | Very low | 187 Ų | 187 | 175.5 Ų | 175.5 | 81% | 0.813 | 85% | 0.851 | S | S | * | * | P | Polyproline II helix | trans | -85.4 | 122.8 | -173.1 | -159.9 | 177.7 | -177.5 | -176.1 | 0 | 108.6 | ||
| 318 | K | 48.2 | Very low | 44 | Very low | 196 Ų | 196 | 175.1 Ų | 175.1 | 85% | 0.852 | 85% | 0.851 | S | S | * | * | trans | -83.8 | 112.2 | 175.1 | -176.6 | 175.8 | -179.1 | 174.3 | 0 | 108.6 | ||||
| 319 | N | 40 | Very low | 44.2 | Very low | 142 Ų | 142 | 176.6 Ų | 176.6 | 76% | 0.759 | 85% | 0.853 | S | S | * | * | P | Polyproline II helix | trans | -84.5 | 129.8 | 166.2 | -76.1 | -4.1 | 0 | 0 | 0 | 108.5 | ||
| 320 | R | 43.3 | Very low | 44.5 | Very low | 216 Ų | 216 | 180.7 Ų | 180.7 | 82% | 0.815 | 86% | 0.856 | S | S | * | * | P | Polyproline II helix | trans | -80.6 | 137.9 | 165.1 | -72 | 178.8 | 174.1 | -177.4 | -4 | 107.7 | ||
| 321 | H | 42.1 | Very low | 44.8 | Very low | 177 Ų | 177 | 189.2 Ų | 189.2 | 82% | 0.819 | 87% | 0.873 | S | S | * | * | P | Polyproline II helix | trans | -101 | 116.6 | 158.7 | -141.4 | -1.6 | 0 | 0 | 0 | 105.1 | ||
| 322 | D | 42.9 | Very low | 45.1 | Very low | 137 Ų | 137 | 188.2 Ų | 188.2 | 73% | 0.733 | 87% | 0.872 | S | S | * | * | P | Polyproline II helix | trans | -86.3 | 127 | 162.4 | -74.3 | -55.7 | 0 | 0 | 0 | 106.3 | ||
| 323 | D | 45.4 | Very low | 45.1 | Very low | 153 Ų | 153 | 184.1 Ų | 184.1 | 82% | 0.818 | 87% | 0.87 | S | S | * | * | P | Polyproline II helix | trans | -99.3 | 123.8 | 163.2 | -84.7 | -49.5 | 0 | 0 | 0 | 106.8 | ||
| 324 | D | 48 | Very low | 44.9 | Very low | 242 Ų | 242 | 180.8 Ų | 180.8 | 100% | 1.294 | 86% | 0.862 | S | S | * | * | trans | -137.7 | 0 | 160.6 | -131.5 | 2.8 | 0 | 0 | 0 | 106.6 |
Retrieved 324 of 324 residues in 430.4 ms
(Link to these results)