| 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 | 37.9 | Very low | 31.7 | Very low | 234 Ų | 234 | 151.9 Ų | 151.9 | 100% | 1.153 | 80% | 0.803 | S | S | * | * | 0 | 79.1 | 0 | -83.7 | -173.3 | 168.6 | 0 | 0 | 105 | K3 | M1-K3 PolarHBondContact O-N 3.45Š| |||
| 2 | D | 36.3 | Very low | 31.4 | Very low | 162 Ų | 162 | 145.4 Ų | 145.4 | 87% | 0.866 | 78% | 0.78 | S | S | * | * | trans | -92.4 | 105.2 | -172 | -66.1 | -77.1 | 0 | 0 | 0 | 107.8 | S4 | D2-S4 PolarHBondContact O-N 3.27Š| ||
| 3 | K | 33 | Very low | 31.2 | Very low | 193 Ų | 193 | 144.2 Ų | 144.2 | 84% | 0.839 | 78% | 0.78 | S | S | * | * | trans | -75.9 | 105 | -178.2 | -154.5 | 173.9 | -177.1 | -176.6 | 0 | 106.6 | M1 | M1-K3 PolarHBondContact O-N 3.45Š| ||
| 4 | S | 34.1 | Very low | 31.1 | Very low | 100 Ų | 100 | 141.3 Ų | 141.3 | 70% | 0.699 | 76% | 0.761 | S | S | * | * | trans | -52.3 | 134.6 | 169.1 | -62.5 | 0 | 0 | 0 | 0 | 109 | D2 D6 | D2-S4 PolarHBondContact O-N 3.27Å; S4-D6 PolarHBondContact O-N 3.03Å | ||
| 5 | P | 34.7 | Very low | 31 | Very low | 110 Ų | 110 | 137.1 Ų | 137.1 | 71% | 0.714 | 74% | 0.742 | S | S | * | * | trans | -69.8 | 116.5 | 176 | 27.2 | -29.6 | 0 | 0 | 0 | 108.3 | R7 | P5-R7 PolarHBondContact O-N 2.92Š| ||
| 6 | D | 30.1 | Very low | 31.2 | Very low | 130 Ų | 130 | 140 Ų | 140 | 70% | 0.695 | 75% | 0.749 | S | S | * | * | trans | -52.5 | 100.2 | 168.5 | -74.3 | -60.6 | 0 | 0 | 0 | 109.2 | S4 L8 | S4-D6 PolarHBondContact O-N 3.03Å; D6-L8 PolarHBondContact O-N 3.18Å | ||
| 7 | R | 31.3 | Very low | 31 | Very low | 243 Ų | 243 | 139.9 Ų | 139.9 | 92% | 0.917 | 75% | 0.749 | S | S | * | * | trans | -77.9 | 37.1 | 174.7 | -77.7 | -164.8 | 146.4 | -151.2 | -6.3 | 112.4 | P5 | P5-R7 PolarHBondContact O-N 2.92Š| ||
| 8 | L | 28.6 | Very low | 31 | Very low | 156 Ų | 156 | 134.3 Ų | 134.3 | 82% | 0.817 | 72% | 0.723 | S | S | * | * | trans | -109.2 | 13.4 | -174.7 | -76 | 171 | 0 | 0 | 0 | 114.2 | D6 | D6-L8 PolarHBondContact O-N 3.18Š| ||
| 9 | S | 27 | Very low | 31.1 | Very low | 103 Ų | 103 | 131.3 Ų | 131.3 | 72% | 0.72 | 70% | 0.7 | S | S | * | * | trans | -112.8 | 5.7 | -162.8 | -144.5 | 0 | 0 | 0 | 0 | 118.8 | ||||
| 10 | D | 26.9 | Very low | 31.1 | Very low | 145 Ų | 145 | 135.7 Ų | 135.7 | 78% | 0.775 | 71% | 0.707 | S | S | * | * | trans | -125.5 | 43 | -178.7 | -72.9 | -44.3 | 0 | 0 | 0 | 113.9 | S12 | D10-S12 VanDerWaalsContact C-N 3.29Å; D10-S12 PolarHBondContact O-N 3Å | ||
| 11 | C | 28.6 | Very low | 31.1 | Very low | 95 Ų | 95 | 133.8 Ų | 133.8 | 64% | 0.642 | 70% | 0.701 | S | S | * | * | trans | -83 | 80.9 | 158 | -65.1 | 0 | 0 | 0 | 0 | 108.3 | V13 M120 | C11-V13 PolarHBondContact O-N 3.21Å; C11-V13 VanDerWaalsContact O-N 3.14Å; C11-M120 WeakPolarHBondContact SG-CE 3.31Å | ||
| 12 | S | 27.8 | Very low | 30.8 | Very low | 74 Ų | 74 | 124.3 Ų | 124.3 | 52% | 0.517 | 66% | 0.66 | S | S | . | * | trans | -57.6 | 118.5 | 164.3 | -71 | 0 | 0 | 0 | 0 | 108 | D10 M14 | D10-S12 VanDerWaalsContact C-N 3.29Å; D10-S12 PolarHBondContact O-N 3Å; S12-M14 PolarHBondContact O-N 3.22Å | ||
| 13 | V | 29.4 | Very low | 30.5 | Very low | 130 Ų | 130 | 125.3 Ų | 125.3 | 79% | 0.788 | 65% | 0.651 | S | S | * | * | trans | -52.6 | 110.5 | 170.7 | 176.6 | 0 | 0 | 0 | 0 | 107.3 | C11 T15 | C11-V13 PolarHBondContact O-N 3.21Å; C11-V13 VanDerWaalsContact O-N 3.14Å; V13-T15 PolarHBondContact O-N 3.14Å | ||
| 14 | M | 29.9 | Very low | 30.5 | Very low | 103 Ų | 103 | 121.3 Ų | 121.3 | 51% | 0.507 | 63% | 0.634 | S | S | . | * | trans | -61.7 | 121.6 | 172.3 | -72.1 | -172.5 | 67 | 0 | 0 | 107.6 | S12 | S12-M14 PolarHBondContact O-N 3.22Š| ||
| 15 | T | 29.9 | Very low | 30.3 | Very low | 79 Ų | 79 | 122.2 Ų | 122.2 | 49% | 0.485 | 63% | 0.627 | S | S | . | * | trans | -88 | 154.2 | 175.5 | 57.3 | 0 | 0 | 0 | 0 | 109 | V13 D17 S18 | V13-T15 PolarHBondContact O-N 3.14Å; T15-D17 PolarHBondContact O-N 3.32Å; T15-S18 PolarHBondContact O-N 2.95Å; T15-S18 PolarHBondContact O-OG 2.99Å | ||
| 16 | E | 33.3 | Very low | 30 | Very low | 183 Ų | 183 | 120.9 Ų | 120.9 | 86% | 0.855 | 63% | 0.626 | S | S | * | * | G | 310 helix | trans | -51.6 | -24.2 | -177 | -157.5 | 164.4 | 116.3 | 0 | 0 | 113.4 | S18 | E16-S18 VanDerWaalsContact C-N 3.31Å; E16-S18 PolarHBondContact O-N 3.47Å |
| 17 | D | 28.3 | Very low | 30.1 | Very low | 139 Ų | 139 | 118 Ų | 118 | 74% | 0.743 | 62% | 0.616 | S | S | * | * | G | 310 helix | trans | -69.9 | -15.7 | 177.4 | -85.2 | -47.8 | 0 | 0 | 0 | 115.2 | T15 Y19 | T15-D17 PolarHBondContact O-N 3.32Å; D17-Y19 PolarHBondContact O-N 3.36Å |
| 18 | S | 31.4 | Very low | 30 | Very low | 39 Ų | 39 | 113.6 Ų | 113.6 | 27% | 0.273 | 61% | 0.61 | S | S | . | * | G | 310 helix | trans | -74.3 | -2.7 | -179.6 | -57.6 | 0 | 0 | 0 | 0 | 113.9 | T15 E16 | T15-S18 PolarHBondContact O-N 2.95Å; T15-S18 PolarHBondContact O-OG 2.99Å; E16-S18 VanDerWaalsContact C-N 3.31Å; E16-S18 PolarHBondContact O-N 3.47Å |
| 19 | Y | 31.8 | Very low | 30.2 | Very low | 77 Ų | 77 | 111.7 Ų | 111.7 | 30% | 0.302 | 60% | 0.601 | S | S | . | * | trans | -101.8 | 92.9 | 179.2 | -64.4 | -77.2 | 0 | 0 | 0 | 111.3 | D17 S125 A126 | D17-Y19 PolarHBondContact O-N 3.36Å; Y19-S125 PolarHBondContact OH-O 2.92Å; Y19-A126 HydrophobicContact CD1-CB 3.75Å; Y19-A126 VanDerWaalsContact CE1-CA 3.47Å; Y19-A126 HydrophobicContact CE1-CB 3.55Å | ||
| 20 | R | 31.3 | Very low | 30.2 | Very low | 218 Ų | 218 | 115 Ų | 115 | 82% | 0.823 | 61% | 0.61 | S | S | * | * | trans | -135.5 | 116.1 | 166.9 | -84.4 | -167.1 | 174.3 | -159.7 | -1.5 | 114.6 | ||||
| 21 | T | 30.8 | Very low | 30.2 | Very low | 97 Ų | 97 | 112.1 Ų | 112.1 | 60% | 0.595 | 60% | 0.602 | S | S | * | * | trans | 89.4 | 98.7 | 151.8 | -12.3 | 0 | 0 | 0 | 0 | 117.3 | R23 | T21-R23 HydrophobicContact CG2-CG 4.47Š| ||
| 22 | A | 33 | Very low | 30.3 | Very low | 34 Ų | 34 | 114.6 Ų | 114.6 | 28% | 0.281 | 61% | 0.608 | S | S | . | * | trans | -90.9 | 133.6 | 149.9 | 0 | 0 | 0 | 0 | 0 | 108.2 | L128 | A22-L128 HydrophobicContact CB-CD1 4.31Š| ||
| 23 | R | 30 | Very low | 30.2 | Very low | 183 Ų | 183 | 117.5 Ų | 117.5 | 69% | 0.691 | 62% | 0.622 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -107.9 | 129.9 | 170.2 | -84.7 | -168.3 | 172.6 | -179.1 | -1.3 | 109.2 | T21 | T21-R23 HydrophobicContact CG2-CG 4.47Å |
| 24 | F | 32.6 | Very low | 30 | Very low | 110 Ų | 110 | 119.7 Ų | 119.7 | 48% | 0.482 | 62% | 0.621 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -88.8 | 120.6 | 164.2 | -73.5 | -89.4 | 0 | 0 | 0 | 107.8 | L41 | F24-L41 HydrophobicContact CD1-CD2 4.47Å; F24-L41 HydrophobicContact CE1-CD1 4.4Å; F24-L41 HydrophobicContact CE1-CD2 3.68Å; F24-L41 HydrophobicContact CE1-CG 3.81Å; F24-L41 HydrophobicContact CE2-CD2 4.31Å; F24-L41 HydrophobicContact CZ-CD2 3.59Å; F24-L41 HydrophobicContact CZ-CG 4.23Å |
| 25 | E | 29.5 | Very low | 29.9 | Very low | 118 Ų | 118 | 120.1 Ų | 120.1 | 55% | 0.551 | 63% | 0.63 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -104.8 | 126.4 | 166 | -74.8 | -172.3 | 155.9 | 0 | 0 | 108.1 | S27 | E25-S27 PolarHBondContact O-N 3.06Å |
| 26 | A | 29.6 | Very low | 29.8 | Very low | 82 Ų | 82 | 120.2 Ų | 120.2 | 68% | 0.678 | 63% | 0.627 | S | S | * | * | trans | -63.6 | 128.5 | 166.8 | 0 | 0 | 0 | 0 | 0 | 107.7 | D28 | A26-D28 PolarHBondContact O-N 3.2Š| ||
| 27 | S | 31.4 | Very low | 29.8 | Very low | 70 Ų | 70 | 115 Ų | 115 | 49% | 0.49 | 61% | 0.611 | S | S | . | * | trans | -73.8 | 91.8 | 178.6 | 179.7 | 0 | 0 | 0 | 0 | 109.4 | E25 D29 | E25-S27 PolarHBondContact O-N 3.06Å; S27-D29 PolarHBondContact O-N 3.03Å | ||
| 28 | D | 28.3 | Very low | 30 | Very low | 150 Ų | 150 | 110.2 Ų | 110.2 | 80% | 0.802 | 59% | 0.588 | S | S | * | * | trans | -74.5 | 42.9 | 174 | -74.3 | -42.5 | 0 | 0 | 0 | 112.8 | A26 D30 | A26-D28 PolarHBondContact O-N 3.2Å; D28-D30 PolarHBondContact O-N 2.74Å | ||
| 29 | D | 33.4 | Very low | 30.2 | Very low | 117 Ų | 117 | 114.1 Ų | 114.1 | 63% | 0.626 | 60% | 0.602 | S | S | * | * | trans | -92.9 | 85.8 | 171.6 | -142.3 | -57.8 | 0 | 0 | 0 | 109.2 | S27 S31 | S27-D29 PolarHBondContact O-N 3.03Å; D29-S31 PolarHBondContact O-N 2.91Å; D29-S31 PolarHBondContact OD1-OG 3.13Å | ||
| 30 | D | 26.5 | Very low | 30.1 | Very low | 171 Ų | 171 | 115.2 Ų | 115.2 | 91% | 0.914 | 61% | 0.606 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -61.3 | 22.4 | -179.6 | -103.3 | -30.7 | 0 | 0 | 0 | 115 | D28 | D28-D30 PolarHBondContact O-N 2.74Š|
| 31 | S | 28.6 | Very low | 30.4 | Very low | 86 Ų | 86 | 105.6 Ų | 105.6 | 60% | 0.601 | 57% | 0.57 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -117.2 | -3.6 | -165.6 | 71.7 | 0 | 0 | 0 | 0 | 117.1 | D29 | D29-S31 PolarHBondContact O-N 2.91Å; D29-S31 PolarHBondContact OD1-OG 3.13Å |
| 32 | I | 28.9 | Very low | 30.6 | Very low | 147 Ų | 147 | 104.8 Ų | 104.8 | 75% | 0.754 | 56% | 0.557 | S | S | * | * | trans | -122.6 | 107.9 | 174.8 | -91.7 | 170.4 | 0 | 0 | 0 | 113.1 | K34 | I32-K34 PolarHBondContact O-N 2.77Å; I32-K34 VanDerWaalsContact O-N 3.08Å | ||
| 33 | T | 27 | Very low | 30.8 | Very low | 135 Ų | 135 | 105.9 Ų | 105.9 | 83% | 0.828 | 56% | 0.555 | S | S | * | * | trans | -55.7 | 101.3 | 156.1 | 27.3 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 34 | K | 25.4 | Very low | 31 | Very low | 175 Ų | 175 | 100.1 Ų | 100.1 | 76% | 0.761 | 54% | 0.541 | S | S | * | . | S | Bend | trans | 148.7 | 115.4 | 147 | -84.6 | 164 | -179.2 | -178.3 | 0 | 109.3 | I32 N36 | I32-K34 PolarHBondContact O-N 2.77Å; I32-K34 VanDerWaalsContact O-N 3.08Å; K34-N36 PolarHBondContact O-N 3.45Å |
| 35 | T | 27.5 | Very low | 31.1 | Very low | 113 Ų | 113 | 98.9 Ų | 98.9 | 69% | 0.693 | 54% | 0.542 | S | S | * | . | trans | 18.8 | 91.2 | 143.1 | 51 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 36 | N | 27.4 | Very low | 31.2 | Very low | 81 Ų | 81 | 97.7 Ų | 97.7 | 43% | 0.433 | 54% | 0.543 | S | S | . | . | trans | -167.7 | 108.5 | 146.1 | -93.2 | -26.5 | 0 | 0 | 0 | 106.5 | K34 C38 C64 L65 | K34-N36 PolarHBondContact O-N 3.45Å; N36-C38 PolarHBondContact O-N 3.38Å; N36-C38 PolarHBondContact O-SG 3.28Å; N36-C64 HydrophobicContact CB-CB 4.17Å; N36-L65 PolarHBondContact OD1-O 3.02Å | ||
| 37 | S | 34 | Very low | 31.4 | Very low | 73 Ų | 73 | 99.5 Ų | 99.5 | 51% | 0.51 | 54% | 0.541 | S | S | . | . | trans | -65.5 | 73.8 | 171.1 | 37.4 | 0 | 0 | 0 | 0 | 108.6 | Q39 L65 | S37-Q39 PolarHBondContact O-N 3Å; S37-L65 WeakPolarHBondContact OG-CD1 3.36Å | ||
| 38 | C | 31.7 | Very low | 31.7 | Very low | 38 Ų | 38 | 103.4 Ų | 103.4 | 26% | 0.257 | 55% | 0.551 | S | S | . | * | trans | -79.3 | 111.6 | 179 | -51.8 | 0 | 0 | 0 | 0 | 108.6 | N36 T62 F63 C64 | N36-C38 PolarHBondContact O-N 3.38Å; N36-C38 PolarHBondContact O-SG 3.28Å; C38-T62 HydrophobicContact CB-CG2 3.69Å; C38-F63 CarbonylContact C-O 3.25Å; C38-F63 WeakPolarHBondContact CA-O 3.47Å; C38-C64 HydrophobicContact CB-CB 4.18Å; C38-C64 WeakPolarHBondContact CB-SG 3.46Å; C38-C64 WeakPolarHBondContact SG-CB 3.29Å; C38-C64 CovalentContact SG-SG 2.05Å; C38-C64 PolarHBondContact SG-SG 3.47Å | ||
| 39 | Q | 35 | Very low | 32 | Very low | 122 Ų | 122 | 101.9 Ų | 101.9 | 57% | 0.57 | 54% | 0.543 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -93.3 | 137.7 | 174.8 | -66.9 | -176.2 | 1.9 | 0 | 0 | 109.7 | S37 F63 | S37-Q39 PolarHBondContact O-N 3Å; Q39-F63 PolarHBondContact N-O 3.28Å; Q39-F63 PolarHBondContact O-N 3.04Å |
| 40 | R | 30.9 | Very low | 31.9 | Very low | 100 Ų | 100 | 100.8 Ų | 100.8 | 38% | 0.377 | 54% | 0.537 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -105.1 | 127 | 174.5 | -80.3 | -179.5 | 165.1 | 173.4 | -1.6 | 110 | Y42 T62 | R40-Y42 HydrophobicContact CB-CE2 3.86Å; R40-T62 HydrophobicContact CG-CG2 4.26Å; R40-T62 PolarHBondContact NE-OG1 3.07Å |
| 41 | L | 37.1 | Very low | 32.2 | Very low | 15 Ų | 15 | 100.2 Ų | 100.2 | 8% | 0.079 | 54% | 0.539 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -104.4 | 123 | 174.7 | -89.5 | 147.3 | 0 | 0 | 0 | 109.5 | F24 F43 A60 F63 R104 | F24-L41 HydrophobicContact CD1-CD2 4.47Å; F24-L41 HydrophobicContact CE1-CD1 4.4Å; F24-L41 HydrophobicContact CE1-CD2 3.68Å; F24-L41 HydrophobicContact CE1-CG 3.81Å; F24-L41 HydrophobicContact CE2-CD2 4.31Å; F24-L41 HydrophobicContact CZ-CD2 3.59Å; F24-L41 HydrophobicContact CZ-CG 4.23Å; L41-F43 HydrophobicContact CB-CD1 4.47Å; L41-F43 HydrophobicContact CB-CE1 3.85Å; L41-A60 WeakPolarHBondContact O-CA 3.5Å; L41-F63 HydrophobicContact CB-CE2 4.4Å; L41-F63 HydrophobicContact CD1-CD2 4.21Å; L41-F63 HydrophobicContact CD1-CE2 3.95Å; L41-R104 VanDerWaalsContact CD1-NH1 3.34Å |
| 42 | Y | 35 | Very low | 32.2 | Very low | 81 Ų | 81 | 100.7 Ų | 100.7 | 32% | 0.318 | 54% | 0.539 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -106.5 | 125.2 | 172 | -64 | -90.9 | 0 | 0 | 0 | 109 | R40 A60 | R40-Y42 HydrophobicContact CB-CE2 3.86Å; Y42-A60 HydrophobicContact CD1-CB 3.71Å; Y42-A60 HydrophobicContact CD2-CB 4.49Å; Y42-A60 HydrophobicContact CE1-CB 3.45Å; Y42-A60 VanDerWaalsContact CE1-CB 3.45Å; Y42-A60 HydrophobicContact CE2-CB 4.26Å; Y42-A60 HydrophobicContact CG-CB 4.23Å |
| 43 | F | 38.1 | Very low | 32.3 | Very low | 56 Ų | 56 | 96.5 Ų | 96.5 | 25% | 0.246 | 53% | 0.526 | C | S | . | . | trans | -115.7 | 135.6 | 170 | 2.7 | -84.7 | 0 | 0 | 0 | 109.5 | L41 S58 V92 | L41-F43 HydrophobicContact CB-CD1 4.47Å; L41-F43 HydrophobicContact CB-CE1 3.85Å; F43-S58 WeakPolarHBondContact CD2-OG 3.36Å; F43-S58 VanDerWaalsContact CE2-OG 3.31Å; F43-S58 WeakPolarHBondContact CE2-OG 3.43Å; F43-S58 PolarHBondContact O-N 2.88Å; F43-V92 HydrophobicContact CE2-CG1 4.44Å; F43-V92 HydrophobicContact CZ-CG1 4.43Å | ||
| 44 | T | 32.8 | Very low | 32.4 | Very low | 62 Ų | 62 | 94.6 Ų | 94.6 | 38% | 0.38 | 51% | 0.514 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -117.9 | 116.9 | 172 | -19.5 | 0 | 0 | 0 | 0 | 107.3 | L55 T57 | T44-L55 HydrophobicContact CG2-CD2 3.53Å; T44-T57 HydrophobicContact CG2-CG2 4.42Å |
| 45 | T | 34.6 | Very low | 32.6 | Very low | 85 Ų | 85 | 91.8 Ų | 91.8 | 52% | 0.521 | 51% | 0.507 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -93.6 | 124 | 173.9 | 51.4 | 0 | 0 | 0 | 0 | 108.6 | C56 | T45-C56 PolarHBondContact N-O 2.96Å; T45-C56 WeakPolarHBondContact OG1-CB 3.34Å |
| 46 | V | 32.4 | Very low | 32.8 | Very low | 92 Ų | 92 | 89 Ų | 89 | 56% | 0.558 | 49% | 0.491 | S | S | * | . | trans | -104.3 | 118.8 | 173.3 | -168 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 47 | L | 33.9 | Very low | 33 | Very low | 121 Ų | 121 | 90.3 Ų | 90.3 | 63% | 0.634 | 50% | 0.502 | S | S | * | . | trans | -91.7 | 114.4 | 174.4 | -146.1 | 85 | 0 | 0 | 0 | 108.1 | N49 | L47-N49 VanDerWaalsContact C-N 3.29Å; L47-N49 PolarHBondContact O-N 3.07Å | ||
| 48 | E | 36.6 | Very low | 33 | Very low | 151 Ų | 151 | 88.8 Ų | 88.8 | 71% | 0.706 | 49% | 0.492 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -79.5 | -4.1 | -169.3 | -148.8 | -177.4 | 157.7 | 0 | 0 | 114.6 | ||
| 49 | N | 35.7 | Very low | 33 | Very low | 118 Ų | 118 | 93.6 Ų | 93.6 | 63% | 0.631 | 51% | 0.51 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -101 | 2.7 | -174.4 | -106.6 | 10.8 | 0 | 0 | 0 | 115.9 | L47 | L47-N49 VanDerWaalsContact C-N 3.29Å; L47-N49 PolarHBondContact O-N 3.07Å |
| 50 | D | 31.6 | Very low | 32.9 | Very low | 95 Ų | 95 | 89.1 Ų | 89.1 | 51% | 0.508 | 49% | 0.494 | S | S | . | . | trans | -108.6 | 123.2 | 172.6 | -104.1 | -48.3 | 0 | 0 | 0 | 110.4 | T52 A53 | D50-T52 CarbonylContact O-C 3.48Å; D50-T52 VanDerWaalsContact O-C 3.25Å; D50-T52 PolarHBondContact O-N 3.15Å; D50-A53 PolarHBondContact O-N 2.95Å | ||
| 51 | V | 31.8 | Very low | 33.1 | Very low | 158 Ų | 158 | 88.5 Ų | 88.5 | 96% | 0.958 | 50% | 0.496 | S | S | * | . | S | Bend | trans | -57.1 | -11.2 | 170.8 | -175.9 | 0 | 0 | 0 | 0 | 111.3 | ||
| 52 | T | 29.1 | Very low | 32.9 | Very low | 97 Ų | 97 | 91 Ų | 91 | 60% | 0.595 | 51% | 0.512 | S | S | * | . | S | Bend | trans | -109.4 | 80.6 | 160.6 | 47.1 | 0 | 0 | 0 | 0 | 109.9 | D50 T54 | D50-T52 CarbonylContact O-C 3.48Å; D50-T52 VanDerWaalsContact O-C 3.25Å; D50-T52 PolarHBondContact O-N 3.15Å; T52-T54 VanDerWaalsContact C-N 3.3Å; T52-T54 PolarHBondContact O-N 2.9Å; T52-T54 PolarHBondContact O-OG1 3.12Å |
| 53 | A | 31.2 | Very low | 33 | Very low | 59 Ų | 59 | 90.7 Ų | 90.7 | 49% | 0.488 | 51% | 0.512 | S | S | . | . | trans | -56.3 | 96.8 | 172.3 | 0 | 0 | 0 | 0 | 0 | 108.9 | D50 L55 | D50-A53 PolarHBondContact O-N 2.95Å; A53-L55 PolarHBondContact O-N 3.42Å; A53-L55 VanDerWaalsContact O-N 3.15Å | ||
| 54 | T | 28.4 | Very low | 32.6 | Very low | 94 Ų | 94 | 90.9 Ų | 90.9 | 58% | 0.577 | 52% | 0.52 | S | S | * | . | trans | -82.9 | 99 | -179.6 | -48.1 | 0 | 0 | 0 | 0 | 104.9 | T52 C56 | T52-T54 VanDerWaalsContact C-N 3.3Å; T52-T54 PolarHBondContact O-N 2.9Å; T52-T54 PolarHBondContact O-OG1 3.12Å; T54-C56 PolarHBondContact O-N 3.21Å | ||
| 55 | L | 30.7 | Very low | 32.7 | Very low | 117 Ų | 117 | 91.9 Ų | 91.9 | 61% | 0.613 | 52% | 0.522 | S | S | * | . | trans | -58.8 | 99.3 | 172.8 | -88 | 140.4 | 0 | 0 | 0 | 108.2 | T44 A53 T57 | T44-L55 HydrophobicContact CG2-CD2 3.53Å; A53-L55 PolarHBondContact O-N 3.42Å; A53-L55 VanDerWaalsContact O-N 3.15Å; L55-T57 PolarHBondContact O-N 2.81Å; L55-T57 VanDerWaalsContact O-N 3.13Å | ||
| 56 | C | 31.4 | Very low | 32.5 | Very low | 53 Ų | 53 | 95.8 Ų | 95.8 | 36% | 0.358 | 54% | 0.535 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -80.4 | 94.5 | 172.1 | -70.7 | 0 | 0 | 0 | 0 | 107.5 | T45 T54 S58 | T45-C56 PolarHBondContact N-O 2.96Å; T45-C56 WeakPolarHBondContact OG1-CB 3.34Å; T54-C56 PolarHBondContact O-N 3.21Å; C56-S58 PolarHBondContact O-N 3.23Å |
| 57 | T | 31.6 | Very low | 32.3 | Very low | 109 Ų | 109 | 97.5 Ų | 97.5 | 67% | 0.669 | 54% | 0.541 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -70.5 | 104.9 | 164.4 | 42.1 | 0 | 0 | 0 | 0 | 108.1 | T44 L55 | T44-T57 HydrophobicContact CG2-CG2 4.42Å; L55-T57 PolarHBondContact O-N 2.81Å; L55-T57 VanDerWaalsContact O-N 3.13Å |
| 58 | S | 34.1 | Very low | 32 | Very low | 41 Ų | 41 | 96.4 Ų | 96.4 | 29% | 0.287 | 54% | 0.543 | S | S | . | . | P | Polyproline II helix | trans | -69.7 | 141.4 | 166.3 | 176.5 | 0 | 0 | 0 | 0 | 109.3 | F43 C56 | F43-S58 WeakPolarHBondContact CD2-OG 3.36Å; F43-S58 VanDerWaalsContact CE2-OG 3.31Å; F43-S58 WeakPolarHBondContact CE2-OG 3.43Å; F43-S58 PolarHBondContact O-N 2.88Å; C56-S58 PolarHBondContact O-N 3.23Å |
| 59 | E | 30.5 | Very low | 31.8 | Very low | 139 Ų | 139 | 96.1 Ų | 96.1 | 65% | 0.65 | 55% | 0.545 | S | S | * | . | P | Polyproline II helix | trans | -64 | 135 | 174.2 | -55.4 | -179 | 153.6 | 0 | 0 | 109.3 | E61 | E59-E61 PolarHBondContact O-N 3.33Š|
| 60 | A | 34.3 | Very low | 31.3 | Very low | 28 Ų | 28 | 100.1 Ų | 100.1 | 23% | 0.231 | 56% | 0.56 | C | S | . | * | P | Polyproline II helix | trans | -75.4 | 116.4 | 179.1 | 0 | 0 | 0 | 0 | 0 | 110.1 | L41 Y42 | L41-A60 WeakPolarHBondContact O-CA 3.5Å; Y42-A60 HydrophobicContact CD1-CB 3.71Å; Y42-A60 HydrophobicContact CD2-CB 4.49Å; Y42-A60 HydrophobicContact CE1-CB 3.45Å; Y42-A60 VanDerWaalsContact CE1-CB 3.45Å; Y42-A60 HydrophobicContact CE2-CB 4.26Å; Y42-A60 HydrophobicContact CG-CB 4.23Å |
| 61 | E | 34.9 | Very low | 30.9 | Very low | 87 Ų | 87 | 98 Ų | 98 | 41% | 0.407 | 56% | 0.561 | S | S | . | * | P | Polyproline II helix | trans | -76 | 132.4 | 164.3 | -79.3 | -169.7 | 117.1 | 0 | 0 | 109.3 | E59 F63 | E59-E61 PolarHBondContact O-N 3.33Å; E61-F63 HydrophobicContact CB-CE2 4.04Å; E61-F63 HydrophobicContact CB-CZ 3.87Å; E61-F63 WeakPolarHBondContact O-CD2 2.95Å; E61-F63 WeakPolarHBondContact O-CE2 3.32Å |
| 62 | T | 32.4 | Very low | 30.5 | Very low | 67 Ų | 67 | 99.8 Ų | 99.8 | 41% | 0.411 | 56% | 0.556 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -93.3 | 113.8 | 179.6 | -57.4 | 0 | 0 | 0 | 0 | 107.5 | C38 R40 | C38-T62 HydrophobicContact CB-CG2 3.69Å; R40-T62 HydrophobicContact CG-CG2 4.26Å; R40-T62 PolarHBondContact NE-OG1 3.07Å |
| 63 | F | 37.2 | Very low | 30.3 | Very low | 76 Ų | 76 | 102.7 Ų | 102.7 | 33% | 0.333 | 56% | 0.562 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -98.8 | 110.6 | -179.9 | -59.2 | -85 | 0 | 0 | 0 | 108.8 | C38 Q39 L41 E61 A90 | C38-F63 CarbonylContact C-O 3.25Å; C38-F63 WeakPolarHBondContact CA-O 3.47Å; Q39-F63 PolarHBondContact N-O 3.28Å; Q39-F63 PolarHBondContact O-N 3.04Å; L41-F63 HydrophobicContact CB-CE2 4.4Å; L41-F63 HydrophobicContact CD1-CD2 4.21Å; L41-F63 HydrophobicContact CD1-CE2 3.95Å; E61-F63 HydrophobicContact CB-CE2 4.04Å; E61-F63 HydrophobicContact CB-CZ 3.87Å; E61-F63 WeakPolarHBondContact O-CD2 2.95Å; E61-F63 WeakPolarHBondContact O-CE2 3.32Å; F63-A90 HydrophobicContact CE1-CB 4.37Å |
| 64 | C | 30.3 | Very low | 30.1 | Very low | 60 Ų | 60 | 105.3 Ų | 105.3 | 41% | 0.405 | 58% | 0.577 | S | S | . | * | trans | -92.7 | 128.3 | 169.2 | -58.1 | 0 | 0 | 0 | 0 | 108 | N36 C38 E66 | N36-C64 HydrophobicContact CB-CB 4.17Å; C38-C64 HydrophobicContact CB-CB 4.18Å; C38-C64 WeakPolarHBondContact CB-SG 3.46Å; C38-C64 WeakPolarHBondContact SG-CB 3.29Å; C38-C64 CovalentContact SG-SG 2.05Å; C38-C64 PolarHBondContact SG-SG 3.47Å; C64-E66 PolarHBondContact O-N 2.88Å | ||
| 65 | L | 34.1 | Very low | 30 | Very low | 82 Ų | 82 | 107.9 Ų | 107.9 | 43% | 0.429 | 59% | 0.587 | S | S | . | * | trans | -52.8 | 107.2 | 166.4 | -100.4 | 145.8 | 0 | 0 | 0 | 107.3 | N36 S37 D67 | N36-L65 PolarHBondContact OD1-O 3.02Å; S37-L65 WeakPolarHBondContact OG-CD1 3.36Å; L65-D67 PolarHBondContact O-N 3.47Å | ||
| 66 | E | 29.6 | Very low | 29.8 | Very low | 167 Ų | 167 | 109.7 Ų | 109.7 | 78% | 0.78 | 60% | 0.598 | S | S | * | * | trans | -68.6 | 119.8 | 175.7 | -143 | 173.2 | 143 | 0 | 0 | 106.6 | C64 S68 | C64-E66 PolarHBondContact O-N 2.88Å; E66-S68 PolarHBondContact O-N 3.39Å | ||
| 67 | D | 28.1 | Very low | 29.6 | Very low | 128 Ų | 128 | 112.9 Ų | 112.9 | 68% | 0.684 | 62% | 0.615 | S | S | * | * | trans | -62.3 | 57.1 | 172.1 | -96.2 | -33.2 | 0 | 0 | 0 | 111.1 | L65 | L65-D67 PolarHBondContact O-N 3.47Š| ||
| 68 | S | 28.3 | Very low | 29.3 | Very low | 99 Ų | 99 | 112.4 Ų | 112.4 | 69% | 0.692 | 61% | 0.613 | S | S | * | * | trans | -114.1 | 48 | 166.1 | -78.7 | 0 | 0 | 0 | 0 | 109.6 | E66 | E66-S68 PolarHBondContact O-N 3.39Š| ||
| 69 | I | 31.8 | Very low | 29 | Very low | 144 Ų | 144 | 119.9 Ų | 119.9 | 74% | 0.738 | 64% | 0.643 | S | S | * | * | trans | -91.2 | 88.7 | 146.8 | -45.9 | 175.4 | 0 | 0 | 0 | 105 | G71 | I69-G71 PolarHBondContact O-N 3.43Š| ||
| 70 | E | 25.5 | Very low | 28.7 | Very low | 203 Ų | 203 | 120.4 Ų | 120.4 | 95% | 0.949 | 65% | 0.645 | S | S | * | * | trans | -65.2 | 82.7 | 170.3 | -161.3 | 178 | -175.6 | 0 | 0 | 108.1 | ||||
| 71 | G | 23.9 | Very low | 28.4 | Very low | 51 Ų | 51 | 125.4 Ų | 125.4 | 53% | 0.526 | 67% | 0.668 | S | S | . | * | S | Bend | trans | 150.2 | 97.8 | 175 | 0 | 0 | 0 | 0 | 0 | 116 | I69 | I69-G71 PolarHBondContact O-N 3.43Š|
| 72 | K | 24.3 | Very low | 28.1 | Very low | 194 Ų | 194 | 125.1 Ų | 125.1 | 84% | 0.843 | 67% | 0.672 | S | S | * | * | trans | 81.1 | 108.5 | 155.6 | -69.4 | -172.3 | 170.3 | -177.3 | 0 | 119.1 | ||||
| 73 | E | 24 | Very low | 27.9 | Very low | 158 Ų | 158 | 126.6 Ų | 126.6 | 74% | 0.738 | 69% | 0.685 | S | S | * | * | 64.7 | 91.5 | 121.7 | -148.3 | 172.5 | 168.3 | 0 | 0 | 115.9 | D75 | E73-D75 PolarHBondContact O-N 3.13Š| |||
| 74 | S | 27.3 | Very low | 27.6 | Very low | 114 Ų | 114 | 126.7 Ų | 126.7 | 80% | 0.797 | 69% | 0.689 | S | S | * | * | trans | 16.6 | 74.4 | 139.9 | 54.1 | 0 | 0 | 0 | 0 | 116.5 | ||||
| 75 | D | 26.3 | Very low | 27.6 | Very low | 148 Ų | 148 | 128.4 Ų | 128.4 | 79% | 0.791 | 69% | 0.694 | S | S | * | * | trans | -117.8 | 125.1 | 161.6 | -89.2 | -38.6 | 0 | 0 | 0 | 108.3 | E73 V77 | E73-D75 PolarHBondContact O-N 3.13Å; D75-V77 PolarHBondContact O-N 3.23Å; D75-V77 VanDerWaalsContact O-N 3.07Å | ||
| 76 | N | 25.3 | Very low | 27.4 | Very low | 155 Ų | 155 | 127.4 Ų | 127.4 | 83% | 0.829 | 69% | 0.692 | S | S | * | * | trans | -51.6 | 114.4 | 179 | -65.9 | -47.6 | 0 | 0 | 0 | 109.5 | T78 | N76-T78 VanDerWaalsContact C-N 3.27Å; N76-T78 PolarHBondContact O-N 3.34Å; N76-T78 PolarHBondContact O-OG1 2.93Å | ||
| 77 | V | 28.3 | Very low | 27.3 | Very low | 121 Ų | 121 | 127 Ų | 127 | 73% | 0.733 | 69% | 0.69 | S | S | * | * | trans | -64.9 | 93 | 172.9 | -177.7 | 0 | 0 | 0 | 0 | 107.7 | D75 V82 | D75-V77 PolarHBondContact O-N 3.23Å; D75-V77 VanDerWaalsContact O-N 3.07Å; V77-V82 HydrophobicContact CG1-CG2 3.95Å | ||
| 78 | T | 24.9 | Very low | 27.5 | Very low | 99 Ų | 99 | 126.4 Ų | 126.4 | 61% | 0.607 | 68% | 0.683 | S | S | * | * | trans | -80 | 139.2 | 164.1 | 3.9 | 0 | 0 | 0 | 0 | 106.1 | N76 E80 | N76-T78 VanDerWaalsContact C-N 3.27Å; N76-T78 PolarHBondContact O-N 3.34Å; N76-T78 PolarHBondContact O-OG1 2.93Å; T78-E80 PolarHBondContact O-N 3.14Å | ||
| 79 | E | 27.8 | Very low | 27.6 | Very low | 197 Ų | 197 | 126.6 Ų | 126.6 | 92% | 0.921 | 68% | 0.676 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -55.7 | 3.1 | -170.8 | -65.6 | 179.9 | 115.4 | 0 | 0 | 116 | ||
| 80 | E | 25.3 | Very low | 27.5 | Very low | 151 Ų | 151 | 121 Ų | 121 | 71% | 0.706 | 65% | 0.651 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -91.6 | -7.9 | -177.4 | -96 | -171.9 | 125.9 | 0 | 0 | 116.2 | T78 M134 | T78-E80 PolarHBondContact O-N 3.14Å; E80-M134 HydrophobicContact CG-CE 3.98Å |
| 81 | N | 26.8 | Very low | 27.7 | Very low | 133 Ų | 133 | 115.1 Ų | 115.1 | 71% | 0.711 | 63% | 0.629 | S | S | * | * | trans | -136.7 | 23.3 | -168.2 | -66.6 | -69.2 | 0 | 0 | 0 | 117.3 | S83 | N81-S83 VanDerWaalsContact C-N 3.28Å; N81-S83 PolarHBondContact O-N 3.03Å | ||
| 82 | V | 29.2 | Very low | 28.1 | Very low | 80 Ų | 80 | 113.3 Ų | 113.3 | 49% | 0.485 | 61% | 0.608 | S | S | . | * | trans | -79.8 | 82.5 | 169.6 | -172.4 | 0 | 0 | 0 | 0 | 109 | V77 L84 | V77-V82 HydrophobicContact CG1-CG2 3.95Å; V82-L84 HydrophobicContact CG1-CD2 3.81Å; V82-L84 HydrophobicContact CG1-CG 4.06Å; V82-L84 PolarHBondContact O-N 3.19Å; V82-L84 VanDerWaalsContact O-N 3.07Å | ||
| 83 | S | 28.6 | Very low | 28.3 | Very low | 98 Ų | 98 | 111.9 Ų | 111.9 | 69% | 0.685 | 60% | 0.601 | S | S | * | * | trans | -70.7 | 96.5 | 163.4 | -177.3 | 0 | 0 | 0 | 0 | 107.4 | N81 N85 | N81-S83 VanDerWaalsContact C-N 3.28Å; N81-S83 PolarHBondContact O-N 3.03Å; S83-N85 PolarHBondContact O-N 3.21Å; S83-N85 VanDerWaalsContact O-N 3.15Å | ||
| 84 | L | 31.1 | Very low | 28.7 | Very low | 78 Ų | 78 | 105.9 Ų | 105.9 | 41% | 0.408 | 58% | 0.576 | S | S | . | * | trans | -66.1 | 111.8 | 172.7 | -69.3 | 171.9 | 0 | 0 | 0 | 107.3 | V82 P86 V106 | V82-L84 HydrophobicContact CG1-CD2 3.81Å; V82-L84 HydrophobicContact CG1-CG 4.06Å; V82-L84 PolarHBondContact O-N 3.19Å; V82-L84 VanDerWaalsContact O-N 3.07Å; L84-P86 WeakPolarHBondContact O-CD 3.31Å; L84-V106 HydrophobicContact CD1-CG1 4.12Å | ||
| 85 | N | 28.3 | Very low | 28.8 | Very low | 96 Ų | 96 | 105 Ų | 105 | 51% | 0.513 | 57% | 0.566 | S | S | . | * | trans | -60.6 | 122.6 | 176.3 | -165.5 | -18.3 | 0 | 0 | 0 | 108.2 | S83 Q87 Q88 | S83-N85 PolarHBondContact O-N 3.21Å; S83-N85 VanDerWaalsContact O-N 3.15Å; N85-Q87 PolarHBondContact O-N 3.15Å; N85-Q88 PolarHBondContact O-N 3.18Å | ||
| 86 | P | 31.7 | Very low | 29 | Very low | 61 Ų | 61 | 104.2 Ų | 104.2 | 40% | 0.396 | 56% | 0.556 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -62.9 | 2.2 | -171.1 | 21 | -33.6 | 0 | 0 | 0 | 115.2 | L84 V106 | L84-P86 WeakPolarHBondContact O-CD 3.31Å; P86-V106 WeakPolarHBondContact CA-O 3.49Å |
| 87 | Q | 27.6 | Very low | 29.2 | Very low | 159 Ų | 159 | 103.3 Ų | 103.3 | 74% | 0.743 | 56% | 0.558 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -94.9 | -0.7 | 178.7 | -64.9 | -176 | -6.6 | 0 | 0 | 114.2 | N85 I89 | N85-Q87 PolarHBondContact O-N 3.15Å; Q87-I89 VanDerWaalsContact C-N 3.33Å; Q87-I89 PolarHBondContact O-N 2.77Å |
| 88 | Q | 30.7 | Very low | 29.3 | Very low | 115 Ų | 115 | 100 Ų | 100 | 54% | 0.537 | 55% | 0.549 | S | S | . | . | trans | -78.9 | 84 | 177 | -70.8 | -176.5 | -24.3 | 0 | 0 | 110.8 | N85 A90 | N85-Q88 PolarHBondContact O-N 3.18Å; Q88-A90 PolarHBondContact O-N 3.15Å | ||
| 89 | I | 30.1 | Very low | 29.6 | Very low | 104 Ų | 104 | 98.3 Ų | 98.3 | 53% | 0.533 | 54% | 0.539 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -74.3 | 110.5 | 170.6 | -60 | 171.1 | 0 | 0 | 0 | 107.9 | Q87 V91 R104 | Q87-I89 VanDerWaalsContact C-N 3.33Å; Q87-I89 PolarHBondContact O-N 2.77Å; I89-V91 HydrophobicContact CG2-CG2 4.31Å; I89-R104 WeakPolarHBondContact CA-O 3.36Å |
| 90 | A | 31.6 | Very low | 29.7 | Very low | 27 Ų | 27 | 93.4 Ų | 93.4 | 22% | 0.223 | 52% | 0.519 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -86.5 | 119.2 | 171.5 | 0 | 0 | 0 | 0 | 0 | 109 | F63 Q88 R104 | F63-A90 HydrophobicContact CE1-CB 4.37Å; Q88-A90 PolarHBondContact O-N 3.15Å; A90-R104 HydrophobicContact CB-CB 4.35Å; A90-R104 PolarHBondContact N-O 3.04Å; A90-R104 PolarHBondContact O-N 2.71Å |
| 91 | V | 29.3 | Very low | 30 | Very low | 79 Ų | 79 | 91.7 Ų | 91.7 | 48% | 0.479 | 51% | 0.509 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -95.3 | 102.1 | 176.4 | -178.1 | 0 | 0 | 0 | 0 | 107.7 | I89 F103 | I89-V91 HydrophobicContact CG2-CG2 4.31Å; V91-F103 HydrophobicContact CG1-CD1 4.49Å; V91-F103 HydrophobicContact CG1-CE1 4.33Å; V91-F103 HydrophobicContact CG2-CD1 4.09Å; V91-F103 HydrophobicContact CG2-CE1 4.26Å |
| 92 | V | 31.7 | Very low | 30.4 | Very low | 13 Ų | 13 | 86.9 Ų | 86.9 | 8% | 0.079 | 48% | 0.483 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -85.3 | 123 | 174.6 | -177.7 | 0 | 0 | 0 | 0 | 107.4 | F43 P94 L102 | F43-V92 HydrophobicContact CE2-CG1 4.44Å; F43-V92 HydrophobicContact CZ-CG1 4.43Å; V92-P94 VanDerWaalsContact O-CD 3.22Å; V92-P94 WeakPolarHBondContact O-CD 3.38Å; V92-L102 HydrophobicContact CB-CB 3.81Å; V92-L102 HydrophobicContact CB-CD2 4.31Å; V92-L102 PolarHBondContact N-O 3.29Å; V92-L102 VanDerWaalsContact N-O 3.15Å; V92-L102 WeakPolarHBondContact O-CB 3.38Å; V92-L102 PolarHBondContact O-N 2.97Å |
| 93 | K | 29.3 | Very low | 30.5 | Very low | 163 Ų | 163 | 87.2 Ų | 87.2 | 71% | 0.709 | 48% | 0.478 | S | S | * | . | trans | -91.5 | 106.1 | 178.9 | -145.1 | -179.4 | -173.4 | -178.6 | 0 | 107.6 | T95 | K93-T95 PolarHBondContact O-N 3.07Š| ||
| 94 | P | 30.9 | Very low | 31 | Very low | 32 Ų | 32 | 83.9 Ų | 83.9 | 21% | 0.208 | 45% | 0.45 | C | S | . | . | trans | -64.4 | 130 | -179.3 | 26.4 | -33.9 | 0 | 0 | 0 | 109.8 | V92 F96 T99 | V92-P94 VanDerWaalsContact O-CD 3.22Å; V92-P94 WeakPolarHBondContact O-CD 3.38Å; P94-F96 PolarHBondContact O-N 3.35Å; P94-F96 VanDerWaalsContact O-N 3.15Å; P94-T99 WeakPolarHBondContact CB-OG1 3.5Å; P94-T99 VanDerWaalsContact CG-O 3.29Å; P94-T99 WeakPolarHBondContact CG-O 3.22Å; P94-T99 WeakPolarHBondContact CG-OG1 3.4Å | ||
| 95 | T | 30.3 | Very low | 31.1 | Very low | 95 Ų | 95 | 83.5 Ų | 83.5 | 58% | 0.583 | 45% | 0.452 | S | S | * | . | S | Bend | trans | -75.9 | 7.4 | -176.7 | -23.3 | 0 | 0 | 0 | 0 | 113.6 | K93 | K93-T95 PolarHBondContact O-N 3.07Š|
| 96 | F | 30.1 | Very low | 31.2 | Very low | 132 Ų | 132 | 80.3 Ų | 80.3 | 58% | 0.579 | 44% | 0.435 | S | S | * | . | S | Bend | trans | -102.8 | 137.1 | -178.2 | -72.4 | -82.4 | 0 | 0 | 0 | 113 | P94 G98 T99 | P94-F96 PolarHBondContact O-N 3.35Å; P94-F96 VanDerWaalsContact O-N 3.15Å; F96-G98 PolarHBondContact O-N 3.04Å; F96-T99 PolarHBondContact O-OG1 3.15Å |
| 97 | P | 29.9 | Very low | 31.2 | Very low | 136 Ų | 136 | 80.9 Ų | 80.9 | 88% | 0.883 | 44% | 0.438 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -68.7 | 115.2 | 172.1 | 27.6 | -31 | 0 | 0 | 0 | 109.8 | ||
| 98 | G | 30 | Very low | 31.5 | Very low | 52 Ų | 52 | 78.5 Ų | 78.5 | 54% | 0.536 | 43% | 0.43 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 121.5 | -7.7 | 177.3 | 0 | 0 | 0 | 0 | 0 | 115.6 | F96 | F96-G98 PolarHBondContact O-N 3.04Š|
| 99 | T | 32 | Very low | 31.4 | Very low | 64 Ų | 64 | 80 Ų | 80 | 39% | 0.393 | 44% | 0.442 | S | S | . | . | trans | -107.8 | 116.1 | 172.9 | 40 | 0 | 0 | 0 | 0 | 109.9 | P94 F96 | P94-T99 WeakPolarHBondContact CB-OG1 3.5Å; P94-T99 VanDerWaalsContact CG-O 3.29Å; P94-T99 WeakPolarHBondContact CG-O 3.22Å; P94-T99 WeakPolarHBondContact CG-OG1 3.4Å; F96-T99 PolarHBondContact O-OG1 3.15Å | ||
| 100 | D | 29.4 | Very low | 31.6 | Very low | 94 Ų | 94 | 80 Ų | 80 | 50% | 0.503 | 44% | 0.439 | S | S | . | . | trans | -79.3 | 133.6 | 169.4 | -85.1 | -38.8 | 0 | 0 | 0 | 109.2 | S118 | D100-S118 WeakPolarHBondContact OD2-CB 3.19Š| ||
| 101 | K | 32.3 | Very low | 31.6 | Very low | 114 Ų | 114 | 80.1 Ų | 80.1 | 50% | 0.496 | 44% | 0.436 | S | S | . | . | trans | 16 | 116 | 166.2 | -57.4 | 178.5 | -175.9 | -179.7 | 0 | 117.2 | F103 | K101-F103 HydrophobicContact CB-CD2 4.3Å; K101-F103 HydrophobicContact CB-CE2 3.54Å; K101-F103 HydrophobicContact CB-CZ 3.67Å; K101-F103 HydrophobicContact CD-CE2 4.42Å; K101-F103 HydrophobicContact CD-CZ 3.8Å; K101-F103 HydrophobicContact CG-CZ 4.38Å; K101-F103 WeakPolarHBondContact O-CD2 3.44Å | ||
| 102 | L | 34.2 | Very low | 31.8 | Very low | 32 Ų | 32 | 78 Ų | 78 | 17% | 0.168 | 43% | 0.43 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -76.8 | 136.4 | 160.5 | -114.8 | 87.8 | 0 | 0 | 0 | 109.1 | V92 V113 C115 | V92-L102 HydrophobicContact CB-CB 3.81Å; V92-L102 HydrophobicContact CB-CD2 4.31Å; V92-L102 PolarHBondContact N-O 3.29Å; V92-L102 VanDerWaalsContact N-O 3.15Å; V92-L102 WeakPolarHBondContact O-CB 3.38Å; V92-L102 PolarHBondContact O-N 2.97Å; L102-V113 HydrophobicContact CD2-CG1 3.59Å; L102-V113 HydrophobicContact CG-CG1 4.45Å; L102-C115 HydrophobicContact CD1-CB 4.06Å; L102-C115 WeakPolarHBondContact CD1-SG 3.1Å; L102-C115 HydrophobicContact CG-CB 4.36Å; L102-C115 VanDerWaalsContact CG-SG 3.52Å |
| 103 | F | 31.7 | Very low | 31.9 | Very low | 87 Ų | 87 | 79 Ų | 79 | 38% | 0.382 | 44% | 0.437 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -118.3 | 125.5 | 170.1 | -61.4 | -86.9 | 0 | 0 | 0 | 108.4 | V91 K101 A114 | V91-F103 HydrophobicContact CG1-CD1 4.49Å; V91-F103 HydrophobicContact CG1-CE1 4.33Å; V91-F103 HydrophobicContact CG2-CD1 4.09Å; V91-F103 HydrophobicContact CG2-CE1 4.26Å; K101-F103 HydrophobicContact CB-CD2 4.3Å; K101-F103 HydrophobicContact CB-CE2 3.54Å; K101-F103 HydrophobicContact CB-CZ 3.67Å; K101-F103 HydrophobicContact CD-CE2 4.42Å; K101-F103 HydrophobicContact CD-CZ 3.8Å; K101-F103 HydrophobicContact CG-CZ 4.38Å; K101-F103 WeakPolarHBondContact O-CD2 3.44Å; F103-A114 PolarHBondContact N-O 3.31Å; F103-A114 VanDerWaalsContact N-O 3.14Å; F103-A114 PolarHBondContact O-N 2.79Å |
| 104 | R | 38.9 | Very low | 32.1 | Very low | 28 Ų | 28 | 73.6 Ų | 73.6 | 11% | 0.106 | 42% | 0.422 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -112.2 | 124.9 | 173.6 | -157.2 | -177.1 | -165 | -166.5 | 7.4 | 109.2 | L41 I89 A90 G112 V113 | L41-R104 VanDerWaalsContact CD1-NH1 3.34Å; I89-R104 WeakPolarHBondContact CA-O 3.36Å; A90-R104 HydrophobicContact CB-CB 4.35Å; A90-R104 PolarHBondContact N-O 3.04Å; A90-R104 PolarHBondContact O-N 2.71Å; R104-G112 WeakPolarHBondContact CG-O 3.17Å; R104-V113 HydrophobicContact CG-CG2 4.23Å |
| 105 | T | 32.2 | Very low | 31.9 | Very low | 71 Ų | 71 | 73.2 Ų | 73.2 | 44% | 0.436 | 42% | 0.42 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -105.4 | 122.6 | 169.8 | -50 | 0 | 0 | 0 | 0 | 106.9 | ||
| 106 | V | 32.3 | Very low | 31.9 | Very low | 29 Ų | 29 | 75.3 Ų | 75.3 | 18% | 0.176 | 42% | 0.421 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -98.4 | 114.7 | 175.5 | -175.7 | 0 | 0 | 0 | 0 | 107.5 | L84 P86 L111 | L84-V106 HydrophobicContact CD1-CG1 4.12Å; P86-V106 WeakPolarHBondContact CA-O 3.49Å; V106-L111 HydrophobicContact CG1-CD2 4.14Å; V106-L111 HydrophobicContact CG2-CD2 3.85Å |
| 107 | T | 30.8 | Very low | 31.9 | Very low | 72 Ų | 72 | 71 Ų | 71 | 44% | 0.442 | 41% | 0.407 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -110.3 | 145.9 | 168.3 | 41.5 | 0 | 0 | 0 | 0 | 108.8 | D109 E110 | T107-D109 PolarHBondContact O-N 3.41Å; T107-E110 PolarHBondContact O-N 2.98Å; T107-E110 PolarHBondContact OG1-O 3.4Å |
| 108 | D | 33.1 | Very low | 31.8 | Very low | 110 Ų | 110 | 68 Ų | 68 | 59% | 0.588 | 39% | 0.389 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -43.8 | -24.6 | -173 | -98.6 | -88.8 | 0 | 0 | 0 | 115.7 | ||
| 109 | D | 30.2 | Very low | 31.7 | Very low | 145 Ų | 145 | 72 Ų | 72 | 78% | 0.775 | 40% | 0.398 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -115.6 | -11 | -176.3 | -75.8 | -65.1 | 0 | 0 | 0 | 115.9 | T107 | T107-D109 PolarHBondContact O-N 3.41Š|
| 110 | E | 32.6 | Very low | 31.4 | Very low | 104 Ų | 104 | 74.5 Ų | 74.5 | 49% | 0.486 | 41% | 0.407 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -149.9 | 132.4 | -179.9 | -80.9 | -162 | 116.9 | 0 | 0 | 112.8 | T107 G112 S127 | T107-E110 PolarHBondContact O-N 2.98Å; T107-E110 PolarHBondContact OG1-O 3.4Å; E110-G112 PolarHBondContact O-N 2.94Å; E110-S127 PolarHBondContact OE1-OG 3.23Å |
| 111 | L | 33.5 | Very low | 31.3 | Very low | 31 Ų | 31 | 78.8 Ų | 78.8 | 16% | 0.162 | 42% | 0.424 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -89.2 | 82.6 | 169.8 | -88.5 | 157.1 | 0 | 0 | 0 | 109.9 | V106 L128 V130 | V106-L111 HydrophobicContact CG1-CD2 4.14Å; V106-L111 HydrophobicContact CG2-CD2 3.85Å; L111-L128 HydrophobicContact CB-CB 4.5Å; L111-V130 HydrophobicContact CD1-CG2 4.49Å |
| 112 | G | 32.3 | Very low | 31.1 | Very low | 34 Ų | 34 | 75.6 Ų | 75.6 | 35% | 0.351 | 42% | 0.419 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -78.1 | 122.6 | 173.3 | 0 | 0 | 0 | 0 | 0 | 112 | R104 E110 | R104-G112 WeakPolarHBondContact CG-O 3.17Å; E110-G112 PolarHBondContact O-N 2.94Å |
| 113 | V | 34 | Very low | 30.8 | Very low | 35 Ų | 35 | 80.8 Ų | 80.8 | 21% | 0.212 | 45% | 0.445 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -102.8 | 121 | 168.5 | -179.4 | 0 | 0 | 0 | 0 | 108.3 | L102 R104 A126 | L102-V113 HydrophobicContact CD2-CG1 3.59Å; L102-V113 HydrophobicContact CG-CG1 4.45Å; R104-V113 HydrophobicContact CG-CG2 4.23Å; V113-A126 HydrophobicContact CB-CB 4.23Å |
| 114 | A | 32.5 | Very low | 30.8 | Very low | 48 Ų | 48 | 80.1 Ų | 80.1 | 40% | 0.397 | 44% | 0.444 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -114.1 | 120.4 | 173.4 | 0 | 0 | 0 | 0 | 0 | 110.3 | F103 | F103-A114 PolarHBondContact N-O 3.31Å; F103-A114 VanDerWaalsContact N-O 3.14Å; F103-A114 PolarHBondContact O-N 2.79Å |
| 115 | C | 28.6 | Very low | 30.4 | Very low | 24 Ų | 24 | 82.3 Ų | 82.3 | 16% | 0.162 | 46% | 0.464 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -101.5 | 134.2 | 174.2 | -57.9 | 0 | 0 | 0 | 0 | 108.9 | L102 A122 M124 | L102-C115 HydrophobicContact CD1-CB 4.06Å; L102-C115 WeakPolarHBondContact CD1-SG 3.1Å; L102-C115 HydrophobicContact CG-CB 4.36Å; L102-C115 VanDerWaalsContact CG-SG 3.52Å; C115-A122 VanDerWaalsContact O-O 3.06Å; C115-M124 HydrophobicContact CB-CB 4.32Å; C115-M124 HydrophobicContact CB-CE 3.66Å |
| 116 | K | 29.1 | Very low | 30.2 | Very low | 140 Ų | 140 | 80 Ų | 80 | 61% | 0.609 | 45% | 0.452 | S | S | * | . | trans | -117.8 | 95.8 | 173.6 | -163.3 | 172.1 | -175.7 | 173.9 | 0 | 110.1 | ||||
| 117 | S | 29.4 | Very low | 30 | Very low | 41 Ų | 41 | 82.4 Ų | 82.4 | 29% | 0.287 | 47% | 0.47 | S | S | . | . | trans | -69.5 | 138.5 | 172 | 167.9 | 0 | 0 | 0 | 0 | 110.5 | N119 M120 | S117-N119 PolarHBondContact O-N 2.99Å; S117-N119 PolarHBondContact OG-N 2.74Å; S117-M120 WeakPolarHBondContact CB-O 3.1Å; S117-M120 PolarHBondContact OG-N 3.05Å | ||
| 118 | S | 28.9 | Very low | 29.9 | Very low | 72 Ų | 72 | 81.7 Ų | 81.7 | 50% | 0.503 | 46% | 0.463 | S | S | . | . | S | Bend | trans | -78.7 | -6.9 | 176.9 | 99.1 | 0 | 0 | 0 | 0 | 113.6 | D100 | D100-S118 WeakPolarHBondContact OD2-CB 3.19Š|
| 119 | N | 26.8 | Very low | 29.5 | Very low | 136 Ų | 136 | 85.2 Ų | 85.2 | 73% | 0.727 | 48% | 0.476 | S | S | * | . | S | Bend | trans | -118.6 | 1.7 | -177.1 | -87.8 | -22.6 | 0 | 0 | 0 | 115 | S117 | S117-N119 PolarHBondContact O-N 2.99Å; S117-N119 PolarHBondContact OG-N 2.74Å |
| 120 | M | 27 | Very low | 29.3 | Very low | 118 Ų | 118 | 82.5 Ų | 82.5 | 58% | 0.581 | 46% | 0.464 | S | S | * | . | S | Bend | trans | -165.1 | 135.1 | 175.6 | -106.2 | 156.4 | 114.7 | 0 | 0 | 109.6 | C11 S117 A122 | C11-M120 WeakPolarHBondContact SG-CE 3.31Å; S117-M120 WeakPolarHBondContact CB-O 3.1Å; S117-M120 PolarHBondContact OG-N 3.05Å; M120-A122 PolarHBondContact O-N 2.94Å |
| 121 | E | 26.6 | Very low | 28.8 | Very low | 184 Ų | 184 | 83.8 Ų | 83.8 | 86% | 0.86 | 48% | 0.48 | S | S | * | . | trans | -62.7 | 77.6 | 163.8 | -73.5 | -177.4 | 113.1 | 0 | 0 | 109.7 | ||||
| 122 | A | 28 | Very low | 28.6 | Very low | 47 Ų | 47 | 86 Ų | 86 | 39% | 0.388 | 50% | 0.497 | S | S | . | . | trans | -110.9 | 87.2 | 166.8 | 0 | 0 | 0 | 0 | 0 | 106.8 | C115 M120 M124 | C115-A122 VanDerWaalsContact O-O 3.06Å; M120-A122 PolarHBondContact O-N 2.94Å; A122-M124 VanDerWaalsContact C-N 3.27Å; A122-M124 PolarHBondContact O-N 3.32Å | ||
| 123 | I | 29.4 | Very low | 28.1 | Very low | 141 Ų | 141 | 90.2 Ų | 90.2 | 72% | 0.723 | 52% | 0.522 | S | S | * | . | trans | -73.2 | 91.1 | 165.6 | -57 | 175.5 | 0 | 0 | 0 | 105.9 | S125 | I123-S125 PolarHBondContact O-N 2.69Š| ||
| 124 | M | 30.4 | Very low | 27.6 | Very low | 73 Ų | 73 | 93.7 Ų | 93.7 | 36% | 0.36 | 54% | 0.537 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -69.1 | 121.5 | 166.4 | -78.9 | -173.4 | -105.4 | 0 | 0 | 107.8 | C115 A122 | C115-M124 HydrophobicContact CB-CB 4.32Å; C115-M124 HydrophobicContact CB-CE 3.66Å; A122-M124 VanDerWaalsContact C-N 3.27Å; A122-M124 PolarHBondContact O-N 3.32Å |
| 125 | S | 29.9 | Very low | 27.1 | Very low | 74 Ų | 74 | 98.4 Ų | 98.4 | 52% | 0.517 | 56% | 0.556 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -112.1 | 96.7 | 170.6 | -54.9 | 0 | 0 | 0 | 0 | 107.2 | Y19 I123 | Y19-S125 PolarHBondContact OH-O 2.92Å; I123-S125 PolarHBondContact O-N 2.69Å |
| 126 | A | 29.6 | Very low | 26.8 | Very low | 23 Ų | 23 | 103.2 Ų | 103.2 | 19% | 0.19 | 58% | 0.584 | C | S | . | * | E | Extended strand (participates in β ladder) | trans | -85.4 | 110.1 | 170.9 | 0 | 0 | 0 | 0 | 0 | 108.8 | Y19 V113 | Y19-A126 HydrophobicContact CD1-CB 3.75Å; Y19-A126 VanDerWaalsContact CE1-CA 3.47Å; Y19-A126 HydrophobicContact CE1-CB 3.55Å; V113-A126 HydrophobicContact CB-CB 4.23Å |
| 127 | S | 27.8 | Very low | 26.4 | Very low | 78 Ų | 78 | 106.5 Ų | 106.5 | 55% | 0.545 | 59% | 0.592 | S | S | . | * | trans | -86.6 | 118.1 | 162.4 | -80.2 | 0 | 0 | 0 | 0 | 108 | E110 | E110-S127 PolarHBondContact OE1-OG 3.23Š| ||
| 128 | L | 28.6 | Very low | 26.1 | Very low | 57 Ų | 57 | 113.1 Ų | 113.1 | 30% | 0.298 | 62% | 0.619 | S | S | . | * | trans | -101.4 | 109.3 | 172.6 | -156.3 | 91 | 0 | 0 | 0 | 107.2 | A22 L111 V130 | A22-L128 HydrophobicContact CB-CD1 4.31Å; L111-L128 HydrophobicContact CB-CB 4.5Å; L128-V130 HydrophobicContact CD2-CG2 4.43Å; L128-V130 PolarHBondContact O-N 3.07Å | ||
| 129 | E | 25.2 | Very low | 25.9 | Very low | 184 Ų | 184 | 121.3 Ų | 121.3 | 86% | 0.86 | 64% | 0.639 | S | S | * | * | trans | -66.4 | 101.3 | 168.9 | -74.1 | -166.8 | 127.6 | 0 | 0 | 108.6 | T131 | E129-T131 VanDerWaalsContact C-N 3.35Å; E129-T131 PolarHBondContact O-N 2.05Å; E129-T131 VanDerWaalsContact O-N 3.07Å | ||
| 130 | V | 26.4 | Very low | 25.7 | Very low | 88 Ų | 88 | 124.5 Ų | 124.5 | 53% | 0.533 | 65% | 0.646 | S | S | . | * | trans | -76.6 | 91 | 169.7 | -177.8 | 0 | 0 | 0 | 0 | 106.9 | L111 L128 S132 | L111-V130 HydrophobicContact CD1-CG2 4.49Å; L128-V130 HydrophobicContact CD2-CG2 4.43Å; L128-V130 PolarHBondContact O-N 3.07Å; V130-S132 PolarHBondContact O-N 3.01Å | ||
| 131 | T | 22 | Very low | 25.5 | Very low | 131 Ų | 131 | 123.6 Ų | 123.6 | 80% | 0.804 | 66% | 0.657 | S | S | * | * | trans | -74.6 | 75.6 | 163.2 | 53.7 | 0 | 0 | 0 | 0 | 108.5 | E129 S133 | E129-T131 VanDerWaalsContact C-N 3.35Å; E129-T131 PolarHBondContact O-N 2.05Å; E129-T131 VanDerWaalsContact O-N 3.07Å; T131-S133 PolarHBondContact O-N 3.48Å | ||
| 132 | S | 27.8 | Very low | 25.4 | Very low | 77 Ų | 77 | 118.7 Ų | 118.7 | 54% | 0.538 | 65% | 0.648 | S | S | . | * | trans | -69.6 | 117.7 | 160.8 | 176.4 | 0 | 0 | 0 | 0 | 107.3 | V130 M134 | V130-S132 PolarHBondContact O-N 3.01Å; S132-M134 PolarHBondContact O-N 3.23Å | ||
| 133 | S | 22.7 | Very low | 25.1 | Very low | 124 Ų | 124 | 123.6 Ų | 123.6 | 87% | 0.867 | 67% | 0.667 | S | S | * | * | trans | -72.2 | 63.9 | 166.8 | 168.2 | 0 | 0 | 0 | 0 | 109.3 | T131 | T131-S133 PolarHBondContact O-N 3.48Š| ||
| 134 | M | 22.4 | Very low | 24.8 | Very low | 108 Ų | 108 | 125.8 Ų | 125.8 | 53% | 0.532 | 68% | 0.675 | S | S | . | * | S | Bend | trans | -142.6 | 125 | 168 | -67.4 | -171.6 | 72.6 | 0 | 0 | 108.9 | E80 S132 V136 | E80-M134 HydrophobicContact CG-CE 3.98Å; S132-M134 PolarHBondContact O-N 3.23Å; M134-V136 PolarHBondContact O-N 2.71Å |
| 135 | D | 21.8 | Very low | 24.6 | Very low | 147 Ų | 147 | 130.6 Ų | 130.6 | 79% | 0.786 | 70% | 0.701 | S | S | * | * | trans | -36.9 | 100.7 | 179.8 | -108.6 | -83.7 | 0 | 0 | 0 | 114 | R137 | D135-R137 PolarHBondContact O-N 2.82Å; D135-R137 IonicContact OD1-NE 3.85Å | ||
| 136 | V | 24.1 | Very low | 24.2 | Very low | 124 Ų | 124 | 132.2 Ų | 132.2 | 75% | 0.752 | 71% | 0.708 | S | S | * | * | trans | -97.7 | 85 | 166.3 | -173.2 | 0 | 0 | 0 | 0 | 109.5 | M134 | M134-V136 PolarHBondContact O-N 2.71Š| ||
| 137 | R | 20.4 | Very low | 24 | Very low | 209 Ų | 209 | 135.3 Ų | 135.3 | 79% | 0.789 | 73% | 0.733 | S | S | * | * | trans | -88.2 | 92.5 | 154.8 | -66.2 | -174.6 | -156.2 | -177.5 | 5.4 | 108.2 | D135 | D135-R137 PolarHBondContact O-N 2.82Å; D135-R137 IonicContact OD1-NE 3.85Å | ||
| 138 | H | 23.4 | Very low | 23.8 | Very low | 180 Ų | 180 | 138.6 Ų | 138.6 | 83% | 0.833 | 74% | 0.744 | S | S | * | * | 176.1 | 136.2 | 128.5 | -94.9 | -60.3 | 0 | 0 | 0 | 111.4 | |||||
| 139 | R | 23.8 | Very low | 23.5 | Very low | 245 Ų | 245 | 142.5 Ų | 142.5 | 93% | 0.925 | 77% | 0.765 | S | S | * | * | trans | -69.8 | 151.2 | -179.3 | -69.5 | 171.7 | 167.2 | 159.2 | -5.1 | 112.9 | ||||
| 140 | K | 22.2 | Very low | 23.6 | Very low | 203 Ų | 203 | 139.2 Ų | 139.2 | 88% | 0.883 | 76% | 0.757 | S | S | * | * | trans | 103.7 | 99.5 | 133.4 | -162.9 | 178.9 | -176.6 | -178.9 | 0 | 118.5 | ||||
| 141 | A | 23.3 | Very low | 23.4 | Very low | 98 Ų | 98 | 142.4 Ų | 142.4 | 81% | 0.81 | 77% | 0.771 | S | S | * | * | trans | -173.9 | 113.6 | 131.8 | 0 | 0 | 0 | 0 | 0 | 106 | ||||
| 142 | A | 23.6 | Very low | 23.8 | Very low | 81 Ų | 81 | 143 Ų | 143 | 67% | 0.669 | 80% | 0.804 | S | S | * | * | cis | 67.6 | 108.3 | 43.5 | 0 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 143 | D | 23.2 | Very low | 23.6 | Very low | 150 Ų | 150 | 146.3 Ų | 146.3 | 80% | 0.802 | 82% | 0.817 | S | S | * | * | trans | 59.6 | 102 | 149.9 | -71.6 | -56.7 | 0 | 0 | 0 | 118.5 | ||||
| 144 | Q | 23 | Very low | 23.7 | Very low | 187 Ų | 187 | 147.5 Ų | 147.5 | 87% | 0.874 | 81% | 0.814 | S | S | * | * | trans | -179.3 | 71.3 | 141 | -101.4 | 168.2 | 102.3 | 0 | 0 | 111.6 | ||||
| 145 | L | 25.5 | Very low | 23.8 | Very low | 175 Ų | 175 | 149.7 Ų | 149.7 | 92% | 0.916 | 83% | 0.83 | S | S | * | * | trans | -91.5 | 96.9 | 153.5 | -100 | 158.1 | 0 | 0 | 0 | 106.8 | A147 | L145-A147 PolarHBondContact O-N 2.79Å; L145-A147 VanDerWaalsContact O-N 3.13Å | ||
| 146 | V | 22.4 | Very low | 23.9 | Very low | 108 Ų | 108 | 149.8 Ų | 149.8 | 66% | 0.655 | 83% | 0.832 | S | S | * | * | trans | -65.1 | 109.6 | 172.8 | 175.1 | 0 | 0 | 0 | 0 | 107.4 | L148 | V146-L148 PolarHBondContact O-N 3.22Å; V146-L148 VanDerWaalsContact O-N 3.12Å | ||
| 147 | A | 23.7 | Very low | 23.9 | Very low | 88 Ų | 88 | 151.4 Ų | 151.4 | 73% | 0.727 | 84% | 0.838 | S | S | * | * | trans | -54.6 | 115 | 160.3 | 0 | 0 | 0 | 0 | 0 | 107.5 | L145 D149 | L145-A147 PolarHBondContact O-N 2.79Å; L145-A147 VanDerWaalsContact O-N 3.13Å; A147-D149 PolarHBondContact O-N 2.92Å | ||
| 148 | L | 24.3 | Very low | 24.1 | Very low | 147 Ų | 147 | 147.6 Ų | 147.6 | 77% | 0.77 | 84% | 0.841 | S | S | * | * | trans | -69.4 | 95.2 | 164.5 | -78 | 170.2 | 0 | 0 | 0 | 106.5 | V146 V150 | V146-L148 PolarHBondContact O-N 3.22Å; V146-L148 VanDerWaalsContact O-N 3.12Å; L148-V150 PolarHBondContact O-N 3.08Å | ||
| 149 | D | 22.8 | Very low | 24.1 | Very low | 139 Ų | 139 | 145.3 Ų | 145.3 | 74% | 0.743 | 84% | 0.841 | S | S | * | * | trans | -53.6 | 115.4 | 166 | -148.7 | -28.9 | 0 | 0 | 0 | 108.1 | A147 | A147-D149 PolarHBondContact O-N 2.92Š| ||
| 150 | V | 26 | Very low | 24.2 | Very low | 115 Ų | 115 | 137.6 Ų | 137.6 | 70% | 0.697 | 84% | 0.835 | S | S | * | * | trans | -97.1 | 88.7 | 169.1 | 179.1 | 0 | 0 | 0 | 0 | 105.8 | L148 | L148-V150 PolarHBondContact O-N 3.08Š| ||
| 151 | D | 23.5 | Very low | 24.3 | Very low | 154 Ų | 154 | 132.2 Ų | 132.2 | 82% | 0.824 | 83% | 0.831 | S | S | * | * | trans | -104.1 | 118.7 | 167.1 | -148 | -64.7 | 0 | 0 | 0 | 107.8 | ||||
| 152 | G | 30.8 | Very low | 24.4 | Very low | 144 Ų | 144 | 135.3 Ų | 135.3 | 100% | 1.485 | 83% | 0.833 | S | S | * | * | trans | 145.3 | 0 | 175.5 | 0 | 0 | 0 | 0 | 0 | 115.5 |
Retrieved 152 of 152 residues in 64.4 ms
(Link to these results)