| 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 | 39.6 | Very low | 41.6 | Very low | 245 Ų | 245 | 188.6 Ų | 188.6 | 100% | 1.207 | 90% | 0.902 | S | S | * | * | 0 | 117.9 | 0 | -77.5 | -175.7 | 137.9 | 0 | 0 | 110 | |||||
| 2 | P | 38.3 | Very low | 41.4 | Very low | 133 Ų | 133 | 187 Ų | 187 | 86% | 0.864 | 89% | 0.888 | S | S | * | * | trans | -106.7 | 147.6 | 167.8 | 26 | -9.1 | 0 | 0 | 0 | 112.6 | ||||
| 3 | K | 41.3 | Very low | 41.5 | Very low | 210 Ų | 210 | 186.1 Ų | 186.1 | 91% | 0.913 | 88% | 0.878 | S | S | * | * | P | Polyproline II helix | trans | -72.1 | 138.6 | -165.1 | -65.9 | 171.3 | 175.3 | 174.8 | 0 | 113 | G5 | K3-G5 PolarHBondContact O-N 3.35Š|
| 4 | K | 41.1 | Very low | 41.5 | Very low | 209 Ų | 209 | 180.1 Ų | 180.1 | 91% | 0.909 | 88% | 0.876 | S | S | * | * | P | Polyproline II helix | trans | -65.6 | 117.9 | 171.3 | -78.9 | 177.7 | 175.5 | 175.4 | 0 | 110.5 | ||
| 5 | G | 37.6 | Very low | 41.5 | Very low | 72 Ų | 72 | 173.1 Ų | 173.1 | 74% | 0.742 | 87% | 0.87 | S | S | * | * | P | Polyproline II helix | trans | -79 | 125.5 | 170.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | K3 R7 | K3-G5 PolarHBondContact O-N 3.35Å; G5-R7 PolarHBondContact O-N 3.38Å |
| 6 | N | 44.1 | Very low | 41.5 | Very low | 164 Ų | 164 | 169.7 Ų | 169.7 | 88% | 0.877 | 86% | 0.855 | S | S | * | * | trans | -66.3 | 108.5 | 174.8 | -81.5 | -25.8 | 0 | 0 | 0 | 111.2 | K8 | N6-K8 PolarHBondContact O-N 3.39Š| ||
| 7 | R | 43.9 | Very low | 41.6 | Very low | 243 Ų | 243 | 166.4 Ų | 166.4 | 92% | 0.917 | 85% | 0.845 | S | S | * | * | trans | -81.6 | 108.2 | 165 | -83.6 | -178.4 | 166.6 | 170.5 | -3.1 | 109.5 | G5 R9 | G5-R7 PolarHBondContact O-N 3.38Å; R7-R9 PolarHBondContact O-N 2.97Å | ||
| 8 | K | 45.7 | Very low | 41.5 | Very low | 202 Ų | 202 | 162.1 Ų | 162.1 | 88% | 0.878 | 83% | 0.831 | S | S | * | * | trans | -61.1 | 121 | 167.9 | -76.3 | -178.6 | 176.8 | 177.9 | 0 | 109.3 | N6 L10 | N6-K8 PolarHBondContact O-N 3.39Å; K8-L10 PolarHBondContact O-N 2.81Å | ||
| 9 | R | 43.2 | Very low | 41.5 | Very low | 236 Ų | 236 | 160.3 Ų | 160.3 | 89% | 0.891 | 83% | 0.834 | S | S | * | * | trans | -73.8 | 106.5 | 174.3 | -170.8 | 175.6 | 176.8 | -173.4 | -0.8 | 108.5 | R7 K11 | R7-R9 PolarHBondContact O-N 2.97Å; R9-K11 PolarHBondContact O-N 3.19Å | ||
| 10 | L | 42.3 | Very low | 41.6 | Very low | 169 Ų | 169 | 160.1 Ų | 160.1 | 89% | 0.885 | 83% | 0.829 | S | S | * | * | P | Polyproline II helix | trans | -64.8 | 122.1 | 171.1 | -97 | 106.7 | 0 | 0 | 0 | 109.1 | K8 | K8-L10 PolarHBondContact O-N 2.81Š|
| 11 | K | 40.5 | Very low | 41.8 | Very low | 192 Ų | 192 | 157.3 Ų | 157.3 | 84% | 0.835 | 82% | 0.824 | S | S | * | * | P | Polyproline II helix | trans | -85.7 | 117.3 | 169.7 | -70.6 | -173.1 | 177.7 | -177.6 | 0 | 107.9 | R9 | R9-K11 PolarHBondContact O-N 3.19Š|
| 12 | F | 39.3 | Very low | 42.4 | Very low | 169 Ų | 169 | 150.8 Ų | 150.8 | 74% | 0.741 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -74.6 | 127.9 | 174.4 | -144.7 | -98.6 | 0 | 0 | 0 | 108.9 | D16 | F12-D16 HydrophobicContact CE1-CB 4.31Å; F12-D16 HydrophobicContact CZ-CB 4.28Å |
| 13 | K | 42.3 | Very low | 43.2 | Very low | 175 Ų | 175 | 148 Ų | 148 | 76% | 0.761 | 78% | 0.778 | S | S | * | * | P | Polyproline II helix | trans | -99.7 | 143.7 | 171.7 | -78.7 | -175.6 | 175 | -178.9 | 0 | 108.6 | G15 D16 | K13-G15 PolarHBondContact O-N 2.72Å; K13-D16 PolarHBondContact O-N 3.49Å |
| 14 | A | 42.1 | Very low | 43.4 | Very low | 103 Ų | 103 | 144 Ų | 144 | 85% | 0.851 | 77% | 0.771 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -63.7 | -2.6 | -175.9 | 0 | 0 | 0 | 0 | 0 | 115.6 | ||
| 15 | G | 41.7 | Very low | 43.7 | Very low | 75 Ų | 75 | 137 Ų | 137 | 77% | 0.773 | 75% | 0.752 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -98 | 2.4 | 178 | 0 | 0 | 0 | 0 | 0 | 115.3 | K13 V17 | K13-G15 PolarHBondContact O-N 2.72Å; G15-V17 VanDerWaalsContact C-N 3.28Å; G15-V17 PolarHBondContact O-N 2.88Å |
| 16 | D | 41.1 | Very low | 44.5 | Very low | 118 Ų | 118 | 138.2 Ų | 138.2 | 63% | 0.631 | 74% | 0.741 | S | S | * | * | trans | -92.4 | 19.9 | -176.7 | -132.3 | 12.3 | 0 | 0 | 0 | 112.8 | F12 K13 C18 | F12-D16 HydrophobicContact CE1-CB 4.31Å; F12-D16 HydrophobicContact CZ-CB 4.28Å; K13-D16 PolarHBondContact O-N 3.49Å; D16-C18 PolarHBondContact O-N 3.01Å | ||
| 17 | V | 43.4 | Very low | 45.1 | Very low | 114 Ų | 114 | 138.5 Ų | 138.5 | 69% | 0.691 | 74% | 0.735 | S | S | * | * | trans | -73.3 | 96.8 | 174.8 | -177.4 | 0 | 0 | 0 | 0 | 107.6 | G15 S19 | G15-V17 VanDerWaalsContact C-N 3.28Å; G15-V17 PolarHBondContact O-N 2.88Å; V17-S19 PolarHBondContact O-N 3.33Å | ||
| 18 | C | 39.9 | Very low | 45.4 | Very low | 89 Ų | 89 | 129.9 Ų | 129.9 | 60% | 0.601 | 72% | 0.716 | S | S | * | * | trans | -47.3 | 122.7 | 171.1 | -145.1 | 0 | 0 | 0 | 0 | 109.1 | D16 E20 | D16-C18 PolarHBondContact O-N 3.01Å; C18-E20 PolarHBondContact O-N 2.98Å; C18-E20 PolarHBondContact SG-OE2 3.47Å | ||
| 19 | S | 41.2 | Very low | 45.5 | Very low | 127 Ų | 127 | 128.3 Ų | 128.3 | 89% | 0.888 | 72% | 0.717 | S | S | * | * | trans | -74.9 | 49.5 | 174.3 | -54 | 0 | 0 | 0 | 0 | 111 | V17 | V17-S19 PolarHBondContact O-N 3.33Š| ||
| 20 | E | 42.8 | Very low | 45.6 | Very low | 157 Ų | 157 | 119.5 Ų | 119.5 | 73% | 0.734 | 70% | 0.695 | S | S | * | * | trans | -108.6 | 99.5 | 175.2 | -76.4 | 174.8 | 159.1 | 0 | 0 | 107.6 | C18 V22 | C18-E20 PolarHBondContact O-N 2.98Å; C18-E20 PolarHBondContact SG-OE2 3.47Å; E20-V22 PolarHBondContact O-N 3Å | ||
| 21 | S | 47.4 | Very low | 45.8 | Very low | 101 Ų | 101 | 116 Ų | 116 | 71% | 0.706 | 68% | 0.677 | S | S | * | * | trans | -60.1 | 118.5 | 170.8 | 52.4 | 0 | 0 | 0 | 0 | 109.2 | T23 | S21-T23 PolarHBondContact O-N 2.46Š| ||
| 22 | V | 50.6 | Low | 46.3 | Very low | 108 Ų | 108 | 112.7 Ų | 112.7 | 66% | 0.655 | 68% | 0.675 | S | S | * | * | trans | -59.4 | 125.6 | 169.3 | 178.9 | 0 | 0 | 0 | 0 | 108.2 | E20 D26 F27 | E20-V22 PolarHBondContact O-N 3Å; V22-D26 HydrophobicContact CG1-CB 4.39Å; V22-F27 HydrophobicContact CG1-CD2 4.37Å; V22-F27 HydrophobicContact CG1-CE2 3.81Å | ||
| 23 | T | 55.1 | Low | 47.1 | Very low | 74 Ų | 74 | 108.7 Ų | 108.7 | 45% | 0.454 | 67% | 0.674 | S | S | . | * | trans | -110.8 | 160.5 | 179.4 | 66.7 | 0 | 0 | 0 | 0 | 110.8 | S21 A25 D26 | S21-T23 PolarHBondContact O-N 2.46Å; T23-A25 PolarHBondContact O-N 2.76Å; T23-D26 PolarHBondContact N-OD2 2.6Å; T23-D26 VanDerWaalsContact O-CB 3.32Å; T23-D26 WeakPolarHBondContact O-CB 3.15Å; T23-D26 PolarHBondContact O-N 2.86Å | ||
| 24 | V | 45.2 | Very low | 47.5 | Very low | 126 Ų | 126 | 105.9 Ų | 105.9 | 76% | 0.764 | 67% | 0.671 | S | S | * | * | G | 310 helix | trans | -56.7 | -25.9 | -179.9 | 178.1 | 0 | 0 | 0 | 0 | 112.4 | D26 F27 A28 | V24-D26 PolarHBondContact O-N 2.76Å; V24-F27 PolarHBondContact O-N 3.15Å; V24-F27 VanDerWaalsContact O-N 3.16Å; V24-A28 PolarHBondContact O-N 2.84Å |
| 25 | A | 48.3 | Very low | 47.7 | Very low | 62 Ų | 62 | 104.3 Ų | 104.3 | 51% | 0.512 | 65% | 0.65 | S | S | . | * | G | 310 helix | trans | -62.6 | -19.4 | 175.6 | 0 | 0 | 0 | 0 | 0 | 113.6 | T23 F27 | T23-A25 PolarHBondContact O-N 2.76Å; A25-F27 VanDerWaalsContact C-N 3.28Å; A25-F27 PolarHBondContact O-N 3.34Å |
| 26 | D | 54.5 | Low | 48 | Very low | 98 Ų | 98 | 110.6 Ų | 110.6 | 52% | 0.524 | 66% | 0.656 | S | S | . | * | G | 310 helix | trans | -77 | -14.4 | 178.4 | -60.5 | -42.5 | 0 | 0 | 0 | 113 | V22 T23 V24 | V22-D26 HydrophobicContact CG1-CB 4.39Å; T23-D26 PolarHBondContact N-OD2 2.6Å; T23-D26 VanDerWaalsContact O-CB 3.32Å; T23-D26 WeakPolarHBondContact O-CB 3.15Å; T23-D26 PolarHBondContact O-N 2.86Å; V24-D26 PolarHBondContact O-N 2.76Å |
| 27 | F | 56.6 | Low | 48.5 | Very low | 170 Ų | 170 | 109.1 Ų | 109.1 | 75% | 0.746 | 66% | 0.656 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -121.9 | -11.1 | -173.3 | -75.7 | -84.5 | 0 | 0 | 0 | 115.2 | V22 V24 A25 | V22-F27 HydrophobicContact CG1-CD2 4.37Å; V22-F27 HydrophobicContact CG1-CE2 3.81Å; V24-F27 PolarHBondContact O-N 3.15Å; V24-F27 VanDerWaalsContact O-N 3.16Å; A25-F27 VanDerWaalsContact C-N 3.28Å; A25-F27 PolarHBondContact O-N 3.34Å |
| 28 | A | 49.9 | Very low | 48.9 | Very low | 63 Ų | 63 | 107.2 Ų | 107.2 | 52% | 0.521 | 66% | 0.659 | S | S | . | * | S | Bend | trans | -145.9 | 116.8 | 176.7 | 0 | 0 | 0 | 0 | 0 | 111.3 | V24 | V24-A28 PolarHBondContact O-N 2.84Š|
| 29 | N | 48.6 | Very low | 49.6 | Very low | 168 Ų | 168 | 113.2 Ų | 113.2 | 90% | 0.898 | 67% | 0.669 | S | S | * | * | trans | 74.9 | 41.3 | 176.1 | -58.1 | -21.5 | 0 | 0 | 0 | 117.9 | ||||
| 30 | A | 43.9 | Very low | 50.3 | Low | 51 Ų | 51 | 111 Ų | 111 | 42% | 0.421 | 65% | 0.65 | S | S | . | * | trans | -79.2 | 125.4 | 166.3 | 0 | 0 | 0 | 0 | 0 | 111 | V35 | A30-V35 HydrophobicContact CB-CG2 3.41Å; A30-V35 VanDerWaalsContact CB-CG2 3.41Å | ||
| 31 | D | 48 | Very low | 51.4 | Low | 97 Ų | 97 | 111.5 Ų | 111.5 | 52% | 0.519 | 65% | 0.65 | S | S | . | * | trans | -51.5 | 123 | 168.2 | -179 | -14.3 | 0 | 0 | 0 | 109.3 | A33 V34 | D31-A33 PolarHBondContact O-N 3.36Å; D31-A33 WeakPolarHBondContact OD1-CB 3.28Å; D31-A33 PolarHBondContact OD1-N 2.84Å; D31-V34 HydrophobicContact CB-CG2 4.11Å; D31-V34 PolarHBondContact O-N 3.35Å | ||
| 32 | P | 50.9 | Low | 52.2 | Low | 121 Ų | 121 | 114.5 Ų | 114.5 | 79% | 0.786 | 65% | 0.65 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -56.6 | -19.2 | -179.3 | -13 | 17.5 | 0 | 0 | 0 | 113.8 | V34 | P32-V34 VanDerWaalsContact C-N 3.35Š|
| 33 | A | 54.7 | Low | 52.5 | Low | 86 Ų | 86 | 112.9 Ų | 112.9 | 71% | 0.711 | 65% | 0.648 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74.4 | -22.2 | 176.4 | 0 | 0 | 0 | 0 | 0 | 113.7 | D31 | D31-A33 PolarHBondContact O-N 3.36Å; D31-A33 WeakPolarHBondContact OD1-CB 3.28Å; D31-A33 PolarHBondContact OD1-N 2.84Å |
| 34 | V | 52 | Low | 52.3 | Low | 116 Ų | 116 | 112.9 Ų | 112.9 | 70% | 0.703 | 65% | 0.648 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -95.1 | -29.5 | -173.4 | -177.6 | 0 | 0 | 0 | 0 | 112.2 | D31 P32 | D31-V34 HydrophobicContact CB-CG2 4.11Å; D31-V34 PolarHBondContact O-N 3.35Å; P32-V34 VanDerWaalsContact C-N 3.35Å |
| 35 | V | 45.1 | Very low | 53 | Low | 69 Ų | 69 | 108.9 Ų | 108.9 | 42% | 0.418 | 63% | 0.628 | S | S | . | * | trans | -102.2 | 96.5 | -175.9 | -156.8 | 0 | 0 | 0 | 0 | 110.9 | A30 S37 | A30-V35 HydrophobicContact CB-CG2 3.41Å; A30-V35 VanDerWaalsContact CB-CG2 3.41Å; V35-S37 PolarHBondContact O-N 3.39Å | ||
| 36 | K | 49.7 | Very low | 53.5 | Low | 207 Ų | 207 | 109.2 Ų | 109.2 | 90% | 0.9 | 62% | 0.621 | S | S | * | * | S | Bend | trans | -66.2 | 89.5 | 166.8 | -78.1 | -176.7 | 179.6 | 174.6 | 0 | 109.3 | ||
| 37 | S | 49.7 | Very low | 53.6 | Low | 88 Ų | 88 | 106.9 Ų | 106.9 | 62% | 0.615 | 62% | 0.615 | S | S | * | * | trans | 63.9 | 99.8 | 177.6 | 126.2 | 0 | 0 | 0 | 0 | 112.8 | V35 R39 | V35-S37 PolarHBondContact O-N 3.39Å; S37-R39 PolarHBondContact O-N 3.1Å | ||
| 38 | G | 53 | Low | 53.7 | Low | 74 Ų | 74 | 103.2 Ų | 103.2 | 76% | 0.763 | 60% | 0.602 | S | S | * | * | trans | -64 | 27.3 | 164.2 | 0 | 0 | 0 | 0 | 0 | 114.1 | V40 | G38-V40 PolarHBondContact O-N 2.81Š| ||
| 39 | R | 55 | Low | 54 | Low | 215 Ų | 215 | 104.5 Ų | 104.5 | 81% | 0.811 | 60% | 0.598 | S | S | * | * | trans | -89 | 105.2 | 174.9 | -165.3 | 173.8 | -168.2 | 143.8 | 4.6 | 108 | S37 K41 | S37-R39 PolarHBondContact O-N 3.1Å; R39-K41 PolarHBondContact O-N 2.88Å; R39-K41 VanDerWaalsContact O-N 3.15Å | ||
| 40 | V | 56.2 | Low | 54.4 | Low | 80 Ų | 80 | 103 Ų | 103 | 49% | 0.485 | 58% | 0.583 | S | S | . | * | trans | -47.9 | 124.3 | 166.8 | 177.7 | 0 | 0 | 0 | 0 | 108.2 | G38 K42 V44 A45 | G38-V40 PolarHBondContact O-N 2.81Å; V40-K42 PolarHBondContact O-N 2.85Å; V40-V44 HydrophobicContact CG1-CB 3.84Å; V40-V44 HydrophobicContact CG1-CG1 3.88Å; V40-A45 HydrophobicContact CG1-CB 4.2Å | ||
| 41 | K | 65.1 | Low | 54.8 | Low | 168 Ų | 168 | 106.8 Ų | 106.8 | 73% | 0.73 | 59% | 0.592 | S | S | * | * | trans | -56.5 | 131.5 | 179.5 | -72.7 | 177 | -178.2 | 168.5 | 0 | 107.9 | R39 A43 V44 A45 | R39-K41 PolarHBondContact O-N 2.88Å; R39-K41 VanDerWaalsContact O-N 3.15Å; K41-A43 PolarHBondContact O-N 2.85Å; K41-V44 HydrophobicContact CB-CG2 4.23Å; K41-V44 WeakPolarHBondContact O-CA 3.38Å; K41-V44 WeakPolarHBondContact O-CB 3.28Å; K41-V44 PolarHBondContact O-N 2.82Å; K41-A45 PolarHBondContact O-N 3.1Å; K41-A45 VanDerWaalsContact O-N 3.15Å | ||
| 42 | K | 64.7 | Low | 55 | Low | 163 Ų | 163 | 104.4 Ų | 104.4 | 71% | 0.709 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -49.3 | -33.1 | -177.4 | -174 | 172.7 | -177.4 | 173.8 | 0 | 113.3 | V40 N46 | V40-K42 PolarHBondContact O-N 2.85Å; K42-N46 VanDerWaalsContact O-CB 3.24Å; K42-N46 WeakPolarHBondContact O-CB 3.35Å; K42-N46 PolarHBondContact O-N 2.87Å; K42-N46 PolarHBondContact O-OD1 2.76Å |
| 43 | A | 55.8 | Low | 55.5 | Low | 75 Ų | 75 | 102.3 Ų | 102.3 | 62% | 0.62 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -63.9 | -38.3 | 175.3 | 0 | 0 | 0 | 0 | 0 | 113.4 | K41 A47 | K41-A43 PolarHBondContact O-N 2.85Å; A43-A47 WeakPolarHBondContact O-CB 2.75Å; A43-A47 PolarHBondContact O-N 3.46Å |
| 44 | V | 51 | Low | 55.3 | Low | 74 Ų | 74 | 103.7 Ų | 103.7 | 45% | 0.448 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -72.3 | -44.7 | 177.6 | 179.6 | 0 | 0 | 0 | 0 | 110.1 | V40 K41 N46 A47 I48 | V40-V44 HydrophobicContact CG1-CB 3.84Å; V40-V44 HydrophobicContact CG1-CG1 3.88Å; K41-V44 HydrophobicContact CB-CG2 4.23Å; K41-V44 WeakPolarHBondContact O-CA 3.38Å; K41-V44 WeakPolarHBondContact O-CB 3.28Å; K41-V44 PolarHBondContact O-N 2.82Å; V44-N46 VanDerWaalsContact C-N 3.33Å; V44-N46 PolarHBondContact O-N 3.18Å; V44-A47 PolarHBondContact O-N 3.05Å; V44-I48 HydrophobicContact CG1-CD1 4.03Å; V44-I48 WeakPolarHBondContact O-CG1 3.44Å; V44-I48 PolarHBondContact O-N 2.9Å |
| 45 | A | 60.6 | Low | 55.2 | Low | 42 Ų | 42 | 104.8 Ų | 104.8 | 35% | 0.347 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -59 | -44.7 | 174 | 0 | 0 | 0 | 0 | 0 | 111.7 | V40 K41 A47 I48 E49 | V40-A45 HydrophobicContact CG1-CB 4.2Å; K41-A45 PolarHBondContact O-N 3.1Å; K41-A45 VanDerWaalsContact O-N 3.15Å; A45-A47 VanDerWaalsContact C-N 3.33Å; A45-A47 PolarHBondContact O-N 2.78Å; A45-I48 PolarHBondContact O-N 3.12Å; A45-E49 VanDerWaalsContact O-CB 3.28Å; A45-E49 WeakPolarHBondContact O-CB 3.5Å; A45-E49 PolarHBondContact O-N 3.4Å |
| 46 | N | 59.2 | Low | 55.4 | Low | 68 Ų | 68 | 103 Ų | 103 | 36% | 0.364 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -67.6 | -30.5 | 177.2 | -70.5 | 2.7 | 0 | 0 | 0 | 113.1 | K42 V44 K50 | K42-N46 VanDerWaalsContact O-CB 3.24Å; K42-N46 WeakPolarHBondContact O-CB 3.35Å; K42-N46 PolarHBondContact O-N 2.87Å; K42-N46 PolarHBondContact O-OD1 2.76Å; V44-N46 VanDerWaalsContact C-N 3.33Å; V44-N46 PolarHBondContact O-N 3.18Å; N46-K50 WeakPolarHBondContact O-CB 3.47Å; N46-K50 WeakPolarHBondContact O-CG 3.34Å; N46-K50 PolarHBondContact O-N 3.19Å |
| 47 | A | 55.5 | Low | 55.4 | Low | 49 Ų | 49 | 95.8 Ų | 95.8 | 41% | 0.405 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -71.2 | -45.1 | 176.7 | 0 | 0 | 0 | 0 | 0 | 110.8 | A43 V44 A45 K50 E51 | A43-A47 WeakPolarHBondContact O-CB 2.75Å; A43-A47 PolarHBondContact O-N 3.46Å; V44-A47 PolarHBondContact O-N 3.05Å; A45-A47 VanDerWaalsContact C-N 3.33Å; A45-A47 PolarHBondContact O-N 2.78Å; A47-K50 PolarHBondContact O-N 3.13Å; A47-E51 PolarHBondContact O-N 3.29Å |
| 48 | I | 58 | Low | 55.4 | Low | 93 Ų | 93 | 95.4 Ų | 95.4 | 48% | 0.477 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -61.9 | -45.2 | 173.5 | -64.2 | 166.5 | 0 | 0 | 0 | 110 | V44 A45 K50 E51 V52 | V44-I48 HydrophobicContact CG1-CD1 4.03Å; V44-I48 WeakPolarHBondContact O-CG1 3.44Å; V44-I48 PolarHBondContact O-N 2.9Å; A45-I48 PolarHBondContact O-N 3.12Å; I48-K50 VanDerWaalsContact C-N 3.29Å; I48-K50 PolarHBondContact O-N 2.97Å; I48-E51 PolarHBondContact O-N 3.07Å; I48-V52 HydrophobicContact CG2-CG2 4.21Å; I48-V52 WeakPolarHBondContact O-CB 3.17Å; I48-V52 WeakPolarHBondContact O-CG2 3.4Å; I48-V52 PolarHBondContact O-N 3.48Å |
| 49 | E | 57.8 | Low | 55 | Low | 91 Ų | 91 | 98.1 Ų | 98.1 | 43% | 0.425 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -59.7 | -39 | 176.5 | -170.2 | -170.5 | 161.9 | 0 | 0 | 111.9 | A45 K53 | A45-E49 VanDerWaalsContact O-CB 3.28Å; A45-E49 WeakPolarHBondContact O-CB 3.5Å; A45-E49 PolarHBondContact O-N 3.4Å; E49-K53 HydrophobicContact CG-CD 4.17Å; E49-K53 VanDerWaalsContact O-CB 3.29Å; E49-K53 WeakPolarHBondContact O-CB 3.36Å; E49-K53 WeakPolarHBondContact O-CG 3.27Å; E49-K53 PolarHBondContact O-N 3.36Å; E49-K53 VanDerWaalsContact OE1-CE 3.31Å; E49-K53 WeakPolarHBondContact OE1-CE 3.35Å; E49-K53 IonicContact OE1-NZ 2.93Å; E49-K53 PolarHBondContact OE1-NZ 2.89Å |
| 50 | K | 56.9 | Low | 54.4 | Low | 136 Ų | 136 | 92.5 Ų | 92.5 | 59% | 0.591 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -68.3 | -44.6 | 175.3 | -84.6 | -173.6 | 172.8 | -163.6 | 0 | 112.8 | N46 A47 I48 V52 K53 L54 | N46-K50 WeakPolarHBondContact O-CB 3.47Å; N46-K50 WeakPolarHBondContact O-CG 3.34Å; N46-K50 PolarHBondContact O-N 3.19Å; A47-K50 PolarHBondContact O-N 3.13Å; I48-K50 VanDerWaalsContact C-N 3.29Å; I48-K50 PolarHBondContact O-N 2.97Å; K50-V52 VanDerWaalsContact C-N 3.31Å; K50-V52 PolarHBondContact O-N 3.48Å; K50-K53 PolarHBondContact O-N 3.11Å; K50-L54 WeakPolarHBondContact O-CB 3.32Å; K50-L54 WeakPolarHBondContact O-CG 3.25Å; K50-L54 PolarHBondContact O-N 3.4Å |
| 51 | E | 52.4 | Low | 54 | Low | 130 Ų | 130 | 93.1 Ų | 93.1 | 61% | 0.607 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -62.3 | -41.1 | 175.5 | -75.5 | -174.8 | 169.3 | 0 | 0 | 111.2 | A47 I48 L54 L55 | A47-E51 PolarHBondContact O-N 3.29Å; I48-E51 PolarHBondContact O-N 3.07Å; E51-L54 PolarHBondContact O-N 2.86Å; E51-L55 WeakPolarHBondContact O-CB 3.49Å; E51-L55 WeakPolarHBondContact O-CD1 3.32Å; E51-L55 WeakPolarHBondContact O-CG 3.41Å; E51-L55 PolarHBondContact O-N 3.14Å |
| 52 | V | 52.5 | Low | 52.8 | Low | 48 Ų | 48 | 94.8 Ų | 94.8 | 29% | 0.291 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -66.2 | -41 | 175.8 | 171.9 | 0 | 0 | 0 | 0 | 111.3 | I48 K50 L54 L55 C56 | I48-V52 HydrophobicContact CG2-CG2 4.21Å; I48-V52 WeakPolarHBondContact O-CB 3.17Å; I48-V52 WeakPolarHBondContact O-CG2 3.4Å; I48-V52 PolarHBondContact O-N 3.48Å; K50-V52 VanDerWaalsContact C-N 3.31Å; K50-V52 PolarHBondContact O-N 3.48Å; V52-L54 VanDerWaalsContact C-N 3.35Å; V52-L54 PolarHBondContact O-N 2.85Å; V52-L55 PolarHBondContact O-N 2.97Å; V52-C56 WeakPolarHBondContact O-CB 3.25Å; V52-C56 PolarHBondContact O-N 3.49Å; V52-C56 PolarHBondContact O-SG 2.74Å; V52-C56 VanDerWaalsContact O-SG 3.35Å |
| 53 | K | 61.3 | Low | 51.4 | Low | 77 Ų | 77 | 90.2 Ų | 90.2 | 34% | 0.335 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -64.5 | -37.4 | 175.1 | -79.9 | 171.3 | 172.4 | 175.9 | 0 | 112.8 | E49 K50 G57 L58 E59 | E49-K53 HydrophobicContact CG-CD 4.17Å; E49-K53 VanDerWaalsContact O-CB 3.29Å; E49-K53 WeakPolarHBondContact O-CB 3.36Å; E49-K53 WeakPolarHBondContact O-CG 3.27Å; E49-K53 PolarHBondContact O-N 3.36Å; E49-K53 VanDerWaalsContact OE1-CE 3.31Å; E49-K53 WeakPolarHBondContact OE1-CE 3.35Å; E49-K53 IonicContact OE1-NZ 2.93Å; E49-K53 PolarHBondContact OE1-NZ 2.89Å; K50-K53 PolarHBondContact O-N 3.11Å; K53-G57 PolarHBondContact O-N 3.16Å; K53-L58 HydrophobicContact CB-CB 4.47Å; K53-L58 HydrophobicContact CG-CB 4.18Å; K53-L58 PolarHBondContact O-N 2.87Å; K53-E59 HydrophobicContact CB-CG 4.35Å |
| 54 | L | 50.5 | Low | 50.4 | Low | 114 Ų | 114 | 91.5 Ų | 91.5 | 60% | 0.597 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -68.5 | -42.4 | 173.8 | -79.8 | 162.8 | 0 | 0 | 0 | 111.8 | K50 E51 V52 C56 | K50-L54 WeakPolarHBondContact O-CB 3.32Å; K50-L54 WeakPolarHBondContact O-CG 3.25Å; K50-L54 PolarHBondContact O-N 3.4Å; E51-L54 PolarHBondContact O-N 2.86Å; V52-L54 VanDerWaalsContact C-N 3.35Å; V52-L54 PolarHBondContact O-N 2.85Å; L54-C56 VanDerWaalsContact C-N 3.33Å; L54-C56 PolarHBondContact O-N 3.22Å |
| 55 | L | 48.9 | Very low | 49.7 | Very low | 140 Ų | 140 | 94.3 Ų | 94.3 | 73% | 0.733 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -71 | -26.7 | 178.4 | -72 | 166.8 | 0 | 0 | 0 | 113.2 | E51 V52 | E51-L55 WeakPolarHBondContact O-CB 3.49Å; E51-L55 WeakPolarHBondContact O-CD1 3.32Å; E51-L55 WeakPolarHBondContact O-CG 3.41Å; E51-L55 PolarHBondContact O-N 3.14Å; V52-L55 PolarHBondContact O-N 2.97Å |
| 56 | C | 50.1 | Low | 48.5 | Very low | 30 Ų | 30 | 101.2 Ų | 101.2 | 20% | 0.203 | 58% | 0.583 | C | S | . | * | T | Hydrogen-bonded Turn | trans | -103.8 | 1.1 | -179.1 | -63.7 | 0 | 0 | 0 | 0 | 114.1 | V52 L54 L58 | V52-C56 WeakPolarHBondContact O-CB 3.25Å; V52-C56 PolarHBondContact O-N 3.49Å; V52-C56 PolarHBondContact O-SG 2.74Å; V52-C56 VanDerWaalsContact O-SG 3.35Å; L54-C56 VanDerWaalsContact C-N 3.33Å; L54-C56 PolarHBondContact O-N 3.22Å; C56-L58 VanDerWaalsContact C-N 3.34Å; C56-L58 HydrophobicContact CB-CD1 3.53Å; C56-L58 PolarHBondContact O-N 2.89Å |
| 57 | G | 48.4 | Very low | 47.4 | Very low | 56 Ų | 56 | 106.5 Ų | 106.5 | 58% | 0.577 | 61% | 0.606 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 66.5 | 26.3 | 177.9 | 0 | 0 | 0 | 0 | 0 | 115.4 | K53 | K53-G57 PolarHBondContact O-N 3.16Š|
| 58 | L | 51.3 | Low | 46.5 | Very low | 80 Ų | 80 | 110.7 Ų | 110.7 | 42% | 0.419 | 63% | 0.626 | S | S | . | * | G | 310 helix | trans | -88 | 4.9 | -172.5 | -96.5 | 115.6 | 0 | 0 | 0 | 115.4 | K53 C56 A60 | K53-L58 HydrophobicContact CB-CB 4.47Å; K53-L58 HydrophobicContact CG-CB 4.18Å; K53-L58 PolarHBondContact O-N 2.87Å; C56-L58 VanDerWaalsContact C-N 3.34Å; C56-L58 HydrophobicContact CB-CD1 3.53Å; C56-L58 PolarHBondContact O-N 2.89Å; L58-A60 PolarHBondContact O-N 3.34Å; L58-A60 VanDerWaalsContact O-N 3.16Å |
| 59 | E | 44.5 | Very low | 45.4 | Very low | 131 Ų | 131 | 114 Ų | 114 | 61% | 0.612 | 64% | 0.644 | S | S | * | * | G | 310 helix | trans | -71.6 | -4.1 | -177.6 | -68 | -162.6 | 149.8 | 0 | 0 | 114.8 | K53 | K53-E59 HydrophobicContact CB-CG 4.35Š|
| 60 | A | 42.1 | Very low | 44.4 | Very low | 97 Ų | 97 | 114.6 Ų | 114.6 | 80% | 0.802 | 66% | 0.658 | S | S | * | * | G | 310 helix | trans | -86.5 | -0.9 | -178 | 0 | 0 | 0 | 0 | 0 | 115.7 | L58 | L58-A60 PolarHBondContact O-N 3.34Å; L58-A60 VanDerWaalsContact O-N 3.16Å |
| 61 | S | 46.6 | Very low | 43.3 | Very low | 94 Ų | 94 | 113.5 Ų | 113.5 | 66% | 0.657 | 67% | 0.668 | S | S | * | * | trans | -100.9 | 19.4 | -167.7 | 88.1 | 0 | 0 | 0 | 0 | 116.8 | ||||
| 62 | Q | 41.1 | Very low | 42.5 | Very low | 203 Ų | 203 | 112.1 Ų | 112.1 | 95% | 0.949 | 68% | 0.679 | S | S | * | * | trans | -104 | 80.1 | 168.1 | -86 | 177.2 | -28 | 0 | 0 | 110.5 | ||||
| 63 | G | 35.2 | Very low | 41.6 | Very low | 66 Ų | 66 | 115.1 Ų | 115.1 | 68% | 0.68 | 70% | 0.701 | S | S | * | * | S | Bend | trans | -160.5 | 117.5 | 167.5 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||
| 64 | A | 35.2 | Very low | 40 | Very low | 102 Ų | 102 | 117.3 Ų | 117.3 | 84% | 0.843 | 73% | 0.727 | S | S | * | * | trans | 75.8 | 70.6 | 169.9 | 0 | 0 | 0 | 0 | 0 | 118.5 | ||||
| 65 | V | 36.2 | Very low | 39.3 | Very low | 134 Ų | 134 | 118.6 Ų | 118.6 | 81% | 0.812 | 74% | 0.739 | S | S | * | * | trans | -115.2 | 2.2 | 162.7 | -173.4 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 66 | E | 34.1 | Very low | 38.3 | Very low | 186 Ų | 186 | 123.3 Ų | 123.3 | 87% | 0.869 | 75% | 0.747 | S | S | * | * | S | Bend | trans | -94.5 | -10.5 | -170.7 | -142.4 | 170.3 | -171.4 | 0 | 0 | 116 | ||
| 67 | E | 36.9 | Very low | 37.3 | Very low | 180 Ų | 180 | 125.8 Ų | 125.8 | 84% | 0.841 | 77% | 0.77 | S | S | * | * | S | Bend | trans | -105.6 | -3.5 | -171.4 | -78 | -166.1 | 157.9 | 0 | 0 | 117.5 | ||
| 68 | V | 36.7 | Very low | 36.3 | Very low | 136 Ų | 136 | 130.7 Ų | 130.7 | 82% | 0.824 | 78% | 0.783 | S | S | * | * | S | Bend | trans | -99.4 | -2.3 | -172 | -173 | 0 | 0 | 0 | 0 | 114.2 | ||
| 69 | L | 34 | Very low | 35.3 | Very low | 162 Ų | 162 | 132 Ų | 132 | 85% | 0.848 | 81% | 0.805 | S | S | * | * | S | Bend | trans | -95.4 | 2.5 | -176.6 | -69.5 | 175 | 0 | 0 | 0 | 115.6 | ||
| 70 | S | 36.8 | Very low | 34.7 | Very low | 104 Ų | 104 | 133.1 Ų | 133.1 | 73% | 0.727 | 82% | 0.82 | S | S | * | * | S | Bend | trans | -102.6 | 8.6 | -175 | -59.3 | 0 | 0 | 0 | 0 | 115.4 | ||
| 71 | S | 34.5 | Very low | 34 | Very low | 114 Ų | 114 | 132 Ų | 132 | 80% | 0.797 | 82% | 0.818 | S | S | * | * | S | Bend | trans | -122.5 | 44.2 | -172.9 | -47 | 0 | 0 | 0 | 0 | 113.8 | ||
| 72 | A | 35 | Very low | 33.1 | Very low | 101 Ų | 101 | 133.2 Ų | 133.2 | 84% | 0.835 | 83% | 0.827 | S | S | * | * | S | Bend | trans | -139.2 | 29.2 | 174.6 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||
| 73 | S | 33.8 | Very low | 32.5 | Very low | 110 Ų | 110 | 127.9 Ų | 127.9 | 77% | 0.769 | 81% | 0.812 | S | S | * | * | trans | -146.5 | 84.1 | 173.4 | 64.7 | 0 | 0 | 0 | 0 | 113 | ||||
| 74 | S | 28.8 | Very low | 32.3 | Very low | 124 Ų | 124 | 132.2 Ų | 132.2 | 87% | 0.867 | 82% | 0.82 | S | S | * | * | trans | -168.8 | 111.9 | 144.8 | 55.9 | 0 | 0 | 0 | 0 | 110 | ||||
| 75 | V | 34.4 | Very low | 31.9 | Very low | 141 Ų | 141 | 134.7 Ų | 134.7 | 86% | 0.855 | 82% | 0.819 | S | S | * | * | trans | -101.7 | 125.7 | 166.6 | -171.7 | 0 | 0 | 0 | 0 | 107.1 | ||||
| 76 | R | 29.1 | Very low | 32.5 | Very low | 238 Ų | 238 | 132.8 Ų | 132.8 | 90% | 0.898 | 81% | 0.809 | S | S | * | * | 161.2 | 149 | 127.3 | -90.9 | -177 | -176.4 | -179 | 1.6 | 114.5 | |||||
| 77 | A | 29 | Very low | 32.4 | Very low | 83 Ų | 83 | 131.8 Ų | 131.8 | 69% | 0.686 | 80% | 0.804 | S | S | * | * | trans | 96.6 | 110.9 | 146.5 | 0 | 0 | 0 | 0 | 0 | 119.5 | ||||
| 78 | D | 27.5 | Very low | 32.2 | Very low | 159 Ų | 159 | 130.2 Ų | 130.2 | 85% | 0.85 | 80% | 0.802 | S | S | * | * | trans | 63.7 | 116.7 | 133.1 | -53.4 | -21.8 | 0 | 0 | 0 | 121.6 | ||||
| 79 | A | 29.9 | Very low | 32 | Very low | 108 Ų | 108 | 131 Ų | 131 | 89% | 0.893 | 80% | 0.801 | S | S | * | * | trans | -157.9 | 139.5 | 135.4 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 80 | V | 31.4 | Very low | 31.8 | Very low | 153 Ų | 153 | 132.2 Ų | 132.2 | 93% | 0.927 | 80% | 0.803 | S | S | * | * | trans | -99 | 156.3 | -165.1 | 164.7 | 0 | 0 | 0 | 0 | 112 | ||||
| 81 | G | 27.3 | Very low | 31.4 | Very low | 73 Ų | 73 | 130.9 Ų | 130.9 | 75% | 0.753 | 81% | 0.806 | S | S | * | * | trans | 119.7 | 134.4 | 156.8 | 0 | 0 | 0 | 0 | 0 | 113 | ||||
| 82 | S | 27.8 | Very low | 31 | Very low | 120 Ų | 120 | 134.6 Ų | 134.6 | 84% | 0.839 | 81% | 0.811 | S | S | * | * | cis | -169.6 | 142.3 | 16.2 | 176.2 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 83 | S | 29.8 | Very low | 30.7 | Very low | 92 Ų | 92 | 135.5 Ų | 135.5 | 64% | 0.643 | 81% | 0.81 | S | S | * | * | trans | 39.5 | 121.8 | 143.6 | -145.9 | 0 | 0 | 0 | 0 | 122.2 | ||||
| 84 | D | 29.4 | Very low | 30.4 | Very low | 156 Ų | 156 | 138.7 Ų | 138.7 | 83% | 0.834 | 81% | 0.813 | S | S | * | * | -175.7 | 138 | 96.3 | -91.5 | -11.8 | 0 | 0 | 0 | 111.9 | |||||
| 85 | D | 28.1 | Very low | 30.5 | Very low | 155 Ų | 155 | 138.6 Ų | 138.6 | 83% | 0.829 | 81% | 0.808 | S | S | * | * | trans | -104.4 | -175.4 | -178.9 | -127.9 | -8.3 | 0 | 0 | 0 | 107.6 | ||||
| 86 | P | 48.1 | Very low | 30.3 | Very low | 93 Ų | 93 | 141.2 Ų | 141.2 | 60% | 0.604 | 81% | 0.807 | S | S | * | * | cis | -148 | -172.8 | 7.3 | 34.2 | -7.4 | 0 | 0 | 0 | 116.7 | ||||
| 87 | E | 31.4 | Very low | 30.3 | Very low | 165 Ų | 165 | 136.3 Ų | 136.3 | 77% | 0.771 | 80% | 0.804 | S | S | * | * | trans | 73.4 | 138.8 | 152.8 | -36.2 | -165.3 | 165.8 | 0 | 0 | 118 | ||||
| 88 | D | 32.6 | Very low | 30.6 | Very low | 148 Ų | 148 | 137.1 Ų | 137.1 | 79% | 0.791 | 81% | 0.811 | S | S | * | * | cis | -166.9 | 164.4 | 22.8 | -139.2 | -7.7 | 0 | 0 | 0 | 111.7 | ||||
| 89 | D | 32.7 | Very low | 30.9 | Very low | 151 Ų | 151 | 140.9 Ų | 140.9 | 81% | 0.807 | 81% | 0.813 | S | S | * | * | trans | 98.5 | 127.4 | 148.4 | -141.1 | 15.8 | 0 | 0 | 0 | 122.9 | ||||
| 90 | E | 29.8 | Very low | 31.2 | Very low | 188 Ų | 188 | 145.7 Ų | 145.7 | 88% | 0.879 | 81% | 0.813 | S | S | * | * | trans | -82.8 | 164.5 | -175.7 | -63 | -174.9 | 146.3 | 0 | 0 | 112.5 | ||||
| 91 | G | 28.2 | Very low | 31.5 | Very low | 77 Ų | 77 | 148.2 Ų | 148.2 | 79% | 0.794 | 81% | 0.812 | S | S | * | * | trans | 161.3 | 96.9 | 162.7 | 0 | 0 | 0 | 0 | 0 | 115.3 | ||||
| 92 | E | 27.8 | Very low | 32.1 | Very low | 192 Ų | 192 | 154.3 Ų | 154.3 | 90% | 0.897 | 82% | 0.818 | S | S | * | * | trans | -50.7 | 143.9 | 172.4 | -62 | 173.9 | 134.6 | 0 | 0 | 114.4 | ||||
| 93 | S | 28 | Very low | 32.6 | Very low | 119 Ų | 119 | 154.8 Ų | 154.8 | 83% | 0.832 | 82% | 0.816 | S | S | * | * | 176.7 | 130.4 | 119.8 | 46.1 | 0 | 0 | 0 | 0 | 112.3 | |||||
| 94 | E | 27.9 | Very low | 33.5 | Very low | 178 Ų | 178 | 159.9 Ų | 159.9 | 83% | 0.832 | 83% | 0.827 | S | S | * | * | trans | -66.3 | 136.7 | 172.1 | -55.6 | -179.9 | 133.4 | 0 | 0 | 111.5 | ||||
| 95 | T | 29.7 | Very low | 34.1 | Very low | 122 Ų | 122 | 163.9 Ų | 163.9 | 75% | 0.748 | 83% | 0.83 | S | S | * | * | 158.7 | 112.9 | 114.2 | 37 | 0 | 0 | 0 | 0 | 113.2 | |||||
| 96 | K | 30.4 | Very low | 34.7 | Very low | 195 Ų | 195 | 165.5 Ų | 165.5 | 85% | 0.848 | 83% | 0.829 | S | S | * | * | trans | 34.6 | 102.9 | 136.5 | -58.2 | 178 | -176.6 | 173.8 | 0 | 118.6 | ||||
| 97 | V | 30.1 | Very low | 34.5 | Very low | 136 Ų | 136 | 170 Ų | 170 | 82% | 0.824 | 84% | 0.84 | S | S | * | * | trans | -138.7 | 109.8 | 131.7 | -178.9 | 0 | 0 | 0 | 0 | 109.8 | R99 | V97-R99 PolarHBondContact O-N 3.42Š| ||
| 98 | A | 34.2 | Very low | 34.6 | Very low | 100 Ų | 100 | 170.5 Ų | 170.5 | 83% | 0.826 | 84% | 0.842 | S | S | * | * | trans | -62.4 | 113.5 | 173.9 | 0 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 99 | R | 35.1 | Very low | 34.9 | Very low | 237 Ų | 237 | 168.2 Ų | 168.2 | 89% | 0.894 | 84% | 0.838 | S | S | * | * | trans | -101.8 | 105.3 | 161.9 | -83.8 | -178.3 | 172.5 | 170 | -0.6 | 109.5 | V97 K101 | V97-R99 PolarHBondContact O-N 3.42Å; R99-K101 PolarHBondContact O-N 3.27Å; R99-K101 VanDerWaalsContact O-N 3.09Å | ||
| 100 | K | 35.8 | Very low | 35.6 | Very low | 209 Ų | 209 | 165.5 Ų | 165.5 | 91% | 0.909 | 83% | 0.831 | S | S | * | * | trans | -40 | 110.5 | 167.8 | -93.5 | 171.6 | 169.1 | 169.9 | 0 | 110.7 | K102 | K100-K102 PolarHBondContact O-N 2.77Å; K100-K102 VanDerWaalsContact O-N 3.09Å | ||
| 101 | K | 37.5 | Very low | 36.6 | Very low | 206 Ų | 206 | 165.2 Ų | 165.2 | 90% | 0.896 | 83% | 0.829 | S | S | * | * | trans | -62.7 | 108.1 | 165.8 | -162.1 | 171.3 | -173.7 | 172.4 | 0 | 107.1 | R99 T103 | R99-K101 PolarHBondContact O-N 3.27Å; R99-K101 VanDerWaalsContact O-N 3.09Å; K101-T103 PolarHBondContact O-N 3Å; K101-T103 VanDerWaalsContact O-N 3.13Å | ||
| 102 | K | 39.9 | Very low | 37.6 | Very low | 201 Ų | 201 | 165.6 Ų | 165.6 | 87% | 0.874 | 82% | 0.819 | S | S | * | * | trans | -50.6 | 122.2 | 173.6 | -103.2 | 177.9 | 177.1 | 173.5 | 0 | 108 | K100 K104 | K100-K102 PolarHBondContact O-N 2.77Å; K100-K102 VanDerWaalsContact O-N 3.09Å; K102-K104 PolarHBondContact O-N 3.19Å | ||
| 103 | T | 39 | Very low | 39.1 | Very low | 130 Ų | 130 | 161.7 Ų | 161.7 | 80% | 0.798 | 81% | 0.813 | S | S | * | * | trans | -45 | 128.7 | 174.7 | 18.5 | 0 | 0 | 0 | 0 | 110.6 | K101 R105 | K101-T103 PolarHBondContact O-N 3Å; K101-T103 VanDerWaalsContact O-N 3.13Å; T103-R105 PolarHBondContact O-N 3.04Å | ||
| 104 | K | 47.5 | Very low | 41.2 | Very low | 200 Ų | 200 | 162.3 Ų | 162.3 | 87% | 0.87 | 81% | 0.807 | S | S | * | * | trans | -39.7 | 103.1 | 160.5 | -176.6 | 177.1 | -177 | 177.3 | 0 | 107.5 | K102 K106 | K102-K104 PolarHBondContact O-N 3.19Å; K104-K106 VanDerWaalsContact C-N 3.27Å; K104-K106 PolarHBondContact O-N 2.9Å | ||
| 105 | R | 41.8 | Very low | 43.2 | Very low | 239 Ų | 239 | 156.9 Ų | 156.9 | 90% | 0.902 | 80% | 0.799 | S | S | * | * | trans | -58 | 104.9 | 163.4 | -91.4 | -176.8 | 171.9 | 175.7 | -3.8 | 104.7 | T103 K107 | T103-R105 PolarHBondContact O-N 3.04Å; R105-K107 VanDerWaalsContact C-N 3.31Å; R105-K107 PolarHBondContact O-N 2.82Å | ||
| 106 | K | 40.8 | Very low | 45.6 | Very low | 189 Ų | 189 | 158 Ų | 158 | 82% | 0.822 | 80% | 0.796 | S | S | * | * | trans | -49.1 | 105.1 | 163.7 | -160.5 | 178.2 | -176.8 | -173.6 | 0 | 103.9 | K104 E108 | K104-K106 VanDerWaalsContact C-N 3.27Å; K104-K106 PolarHBondContact O-N 2.9Å; K106-E108 PolarHBondContact O-N 2.89Å | ||
| 107 | K | 44 | Very low | 48.2 | Very low | 188 Ų | 188 | 156 Ų | 156 | 82% | 0.817 | 80% | 0.795 | S | S | * | * | trans | -58.6 | 104.1 | 164.2 | -176.6 | 175 | -178.5 | -178.5 | 0 | 102.5 | R105 S109 | R105-K107 VanDerWaalsContact C-N 3.31Å; R105-K107 PolarHBondContact O-N 2.82Å; K107-S109 PolarHBondContact O-N 2.81Å | ||
| 108 | E | 32.9 | Very low | 51 | Low | 175 Ų | 175 | 155.3 Ų | 155.3 | 82% | 0.818 | 78% | 0.778 | S | S | * | * | trans | -46.6 | 114 | 165.4 | -76.7 | 172.3 | 167.9 | 0 | 0 | 104.5 | K106 S110 | K106-E108 PolarHBondContact O-N 2.89Å; E108-S110 PolarHBondContact O-N 2.86Å | ||
| 109 | S | 39.7 | Very low | 53.7 | Low | 101 Ų | 101 | 154.1 Ų | 154.1 | 71% | 0.706 | 76% | 0.762 | S | S | * | * | trans | -56.5 | 96.7 | 165.9 | 44.4 | 0 | 0 | 0 | 0 | 104.1 | K107 E111 | K107-S109 PolarHBondContact O-N 2.81Å; S109-E111 PolarHBondContact O-N 2.83Å | ||
| 110 | S | 48.3 | Very low | 56.2 | Low | 94 Ų | 94 | 145.7 Ų | 145.7 | 66% | 0.657 | 74% | 0.736 | S | S | * | * | trans | -49.9 | 109.2 | 151.4 | 53 | 0 | 0 | 0 | 0 | 103.3 | E108 S112 | E108-S110 PolarHBondContact O-N 2.86Å; S110-S112 PolarHBondContact O-N 2.85Å | ||
| 111 | E | 49.4 | Very low | 58.7 | Low | 182 Ų | 182 | 139.9 Ų | 139.9 | 85% | 0.85 | 72% | 0.715 | S | S | * | * | trans | -57.6 | 85.1 | 163.5 | -69.2 | 176.1 | 167 | 0 | 0 | 104.6 | S109 S113 | S109-E111 PolarHBondContact O-N 2.83Å; E111-S113 PolarHBondContact O-N 2.65Å | ||
| 112 | S | 50 | Low | 61.4 | Low | 84 Ų | 84 | 133.6 Ų | 133.6 | 59% | 0.587 | 69% | 0.691 | S | S | * | * | trans | -62.3 | 94.8 | 152.4 | 52.5 | 0 | 0 | 0 | 0 | 102.1 | S110 D114 | S110-S112 PolarHBondContact O-N 2.85Å; S112-D114 PolarHBondContact O-N 3.44Å | ||
| 113 | S | 59.9 | Low | 64 | Low | 110 Ų | 110 | 125.4 Ų | 125.4 | 77% | 0.769 | 65% | 0.654 | S | S | * | * | trans | -57.1 | 87.9 | 159.5 | 173.3 | 0 | 0 | 0 | 0 | 104.4 | E111 G115 | E111-S113 PolarHBondContact O-N 2.65Å; S113-G115 PolarHBondContact O-N 2.77Å | ||
| 114 | D | 70.6 | Confident | 66.5 | Low | 132 Ų | 132 | 120.5 Ų | 120.5 | 71% | 0.706 | 62% | 0.623 | S | S | * | * | P | Polyproline II helix | trans | -53.4 | 129.5 | 165.6 | -80.3 | -16.7 | 0 | 0 | 0 | 105.3 | S112 | S112-D114 PolarHBondContact O-N 3.44Š|
| 115 | G | 70.3 | Confident | 68.7 | Low | 64 Ų | 64 | 116.3 Ų | 116.3 | 66% | 0.66 | 61% | 0.608 | S | S | * | * | P | Polyproline II helix | trans | -60.5 | 152.4 | -178.3 | 0 | 0 | 0 | 0 | 0 | 110.5 | S113 D117 | S113-G115 PolarHBondContact O-N 2.77Å; G115-D117 PolarHBondContact O-N 2.92Å |
| 116 | E | 81.2 | Confident | 71.3 | Confident | 147 Ų | 147 | 109 Ų | 109 | 69% | 0.687 | 59% | 0.586 | S | S | * | * | P | Polyproline II helix | trans | -65.4 | 132.9 | 176 | -63.5 | -63.3 | 156.5 | 0 | 0 | 111.3 | Y118 | E116-Y118 HydrophobicContact CB-CD2 4.48Å; E116-Y118 HydrophobicContact CB-CE2 3.89Å; E116-Y118 VanDerWaalsContact O-CD2 3.29Å; E116-Y118 WeakPolarHBondContact O-CD2 3.19Å; E116-Y118 PolarHBondContact O-N 3.27Å |
| 117 | D | 84.3 | Confident | 73.8 | Confident | 152 Ų | 152 | 100.3 Ų | 100.3 | 81% | 0.813 | 55% | 0.549 | S | S | * | . | trans | -81.5 | 99.1 | 176.7 | -88.3 | -27.9 | 0 | 0 | 0 | 110.6 | G115 | G115-D117 PolarHBondContact O-N 2.92Š| ||
| 118 | Y | 88.3 | Confident | 76.2 | Confident | 121 Ų | 121 | 93 Ų | 93 | 48% | 0.475 | 52% | 0.523 | S | S | . | . | trans | -80.9 | 141.8 | 174 | -66.2 | -81.5 | 0 | 0 | 0 | 112.1 | E116 I122 W123 N144 | E116-Y118 HydrophobicContact CB-CD2 4.48Å; E116-Y118 HydrophobicContact CB-CE2 3.89Å; E116-Y118 VanDerWaalsContact O-CD2 3.29Å; E116-Y118 WeakPolarHBondContact O-CD2 3.19Å; E116-Y118 PolarHBondContact O-N 3.27Å; Y118-I122 HydrophobicContact CD1-CD1 3.77Å; Y118-I122 HydrophobicContact CG-CD1 4.4Å; Y118-W123 PolarHBondContact O-NE1 2.81Å; Y118-N144 PolarHBondContact O-ND2 2.91Å | ||
| 119 | P | 90.8 | Very high | 79.1 | Confident | 76 Ų | 76 | 93.4 Ų | 93.4 | 49% | 0.494 | 52% | 0.518 | S | S | . | . | trans | -52 | 148.1 | 171.5 | -27.3 | 33.8 | 0 | 0 | 0 | 113.1 | D121 I122 | P119-D121 PolarHBondContact O-N 2.79Å; P119-D121 VanDerWaalsContact O-N 3.11Å; P119-I122 PolarHBondContact O-N 2.92Å; P119-I122 VanDerWaalsContact O-N 3.08Å | ||
| 120 | V | 88.5 | Confident | 81.9 | Confident | 59 Ų | 59 | 90.3 Ų | 90.3 | 36% | 0.358 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -57.1 | -29.1 | -179 | 70.3 | 0 | 0 | 0 | 0 | 112.9 | I122 W123 L124 V148 | V120-I122 VanDerWaalsContact C-N 3.3Å; V120-I122 PolarHBondContact O-N 3.11Å; V120-W123 WeakPolarHBondContact O-CB 3.4Å; V120-W123 PolarHBondContact O-N 3.36Å; V120-W123 VanDerWaalsContact O-N 3.15Å; V120-L124 PolarHBondContact O-N 2.84Å; V120-V148 HydrophobicContact CG2-CG2 3.9Å |
| 121 | D | 88.9 | Confident | 84.2 | Confident | 87 Ų | 87 | 93 Ų | 93 | 47% | 0.465 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -62.5 | -37 | 179.2 | -55.3 | -50.4 | 0 | 0 | 0 | 112.2 | P119 L124 M125 | P119-D121 PolarHBondContact O-N 2.79Å; P119-D121 VanDerWaalsContact O-N 3.11Å; D121-L124 PolarHBondContact O-N 2.89Å; D121-M125 WeakPolarHBondContact O-CG 3.16Å; D121-M125 PolarHBondContact O-N 2.72Å |
| 122 | I | 93.8 | Very high | 86.4 | Confident | 74 Ų | 74 | 85 Ų | 85 | 38% | 0.379 | 45% | 0.452 | S | S | . | . | H | α-helix | trans | -65.3 | -44.5 | 175.8 | -62.7 | -179.1 | 0 | 0 | 0 | 109.5 | Y118 P119 V120 L124 M125 L126 | Y118-I122 HydrophobicContact CD1-CD1 3.77Å; Y118-I122 HydrophobicContact CG-CD1 4.4Å; P119-I122 PolarHBondContact O-N 2.92Å; P119-I122 VanDerWaalsContact O-N 3.08Å; V120-I122 VanDerWaalsContact C-N 3.3Å; V120-I122 PolarHBondContact O-N 3.11Å; I122-L124 VanDerWaalsContact C-N 3.32Å; I122-L124 PolarHBondContact O-N 3.32Å; I122-M125 PolarHBondContact O-N 3.42Å; I122-L126 HydrophobicContact CG2-CD1 4.1Å; I122-L126 HydrophobicContact CG2-CG 4.42Å; I122-L126 VanDerWaalsContact O-CG 3.31Å; I122-L126 WeakPolarHBondContact O-CG 3.27Å; I122-L126 PolarHBondContact O-N 2.94Å |
| 123 | W | 94.6 | Very high | 88.6 | Confident | 29 Ų | 29 | 83.7 Ų | 83.7 | 11% | 0.11 | 44% | 0.437 | C | S | . | . | H | α-helix | trans | -62.8 | -38.5 | 176.1 | -65.5 | 100.6 | 0 | 0 | 0 | 112.1 | Y118 V120 L126 S127 F138 I141 C142 N144 A145 V148 | Y118-W123 PolarHBondContact O-NE1 2.81Å; V120-W123 WeakPolarHBondContact O-CB 3.4Å; V120-W123 PolarHBondContact O-N 3.36Å; V120-W123 VanDerWaalsContact O-N 3.15Å; W123-L126 HydrophobicContact CE3-CD1 4.34Å; W123-L126 PolarHBondContact O-N 3.16Å; W123-S127 WeakPolarHBondContact O-CB 3.38Å; W123-S127 PolarHBondContact O-N 3.32Å; W123-F138 AromaticContact CE3-CE2 3.89Å; W123-F138 HydrophobicContact CE3-CE2 3.89Å; W123-F138 HydrophobicContact CE3-CZ 4.11Å; W123-F138 HydrophobicContact CZ3-CE2 4.3Å; W123-I141 HydrophobicContact CH2-CB 4.44Å; W123-I141 HydrophobicContact CH2-CG2 3.52Å; W123-I141 HydrophobicContact CZ3-CB 4.31Å; W123-I141 HydrophobicContact CZ3-CD1 4.23Å; W123-I141 HydrophobicContact CZ3-CG2 3.82Å; W123-C142 WeakPolarHBondContact CZ2-SG 3.28Å; W123-N144 HydrophobicContact CD2-CB 4.42Å; W123-N144 HydrophobicContact CG-CB 3.85Å; W123-A145 HydrophobicContact CD2-CB 4.19Å; W123-A145 HydrophobicContact CE3-CB 3.61Å; W123-A145 HydrophobicContact CZ3-CB 3.91Å; W123-V148 HydrophobicContact CB-CG2 3.83Å |
| 124 | L | 91.6 | Very high | 90.4 | Very high | 27 Ų | 27 | 80.7 Ų | 80.7 | 14% | 0.141 | 41% | 0.412 | C | S | . | . | H | α-helix | trans | -64.8 | -41.2 | 175.3 | -175.6 | 64.3 | 0 | 0 | 0 | 111.4 | V120 D121 I122 S127 V148 | V120-L124 PolarHBondContact O-N 2.84Å; D121-L124 PolarHBondContact O-N 2.89Å; I122-L124 VanDerWaalsContact C-N 3.32Å; I122-L124 PolarHBondContact O-N 3.32Å; L124-S127 PolarHBondContact O-N 3.14Å; L124-S127 PolarHBondContact O-OG 2.93Å; L124-V148 HydrophobicContact CB-CG2 4.34Å; L124-V148 HydrophobicContact CD1-CG1 4Å |
| 125 | M | 93.6 | Very high | 91.6 | Very high | 113 Ų | 113 | 75.2 Ų | 75.2 | 56% | 0.557 | 38% | 0.384 | S | S | * | . | H | α-helix | trans | -62.5 | -50.3 | 174.6 | -73.1 | -59.9 | -65.8 | 0 | 0 | 111.4 | D121 I122 S127 S128 | D121-M125 WeakPolarHBondContact O-CG 3.16Å; D121-M125 PolarHBondContact O-N 2.72Å; I122-M125 PolarHBondContact O-N 3.42Å; M125-S127 VanDerWaalsContact C-N 3.26Å; M125-S127 PolarHBondContact O-N 3.31Å; M125-S128 WeakPolarHBondContact O-CB 3.44Å; M125-S128 PolarHBondContact O-N 2.97Å; M125-S128 PolarHBondContact O-OG 3.25Å |
| 126 | L | 95.1 | Very high | 92.8 | Very high | 84 Ų | 84 | 76.1 Ų | 76.1 | 44% | 0.44 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -58.8 | -38.3 | 177.9 | -70.1 | 174.3 | 0 | 0 | 0 | 112.2 | I122 W123 S128 Y129 F138 | I122-L126 HydrophobicContact CG2-CD1 4.1Å; I122-L126 HydrophobicContact CG2-CG 4.42Å; I122-L126 VanDerWaalsContact O-CG 3.31Å; I122-L126 WeakPolarHBondContact O-CG 3.27Å; I122-L126 PolarHBondContact O-N 2.94Å; W123-L126 HydrophobicContact CE3-CD1 4.34Å; W123-L126 PolarHBondContact O-N 3.16Å; L126-S128 PolarHBondContact O-N 2.99Å; L126-Y129 PolarHBondContact O-N 2.99Å; L126-F138 HydrophobicContact CB-CE2 4.37Å |
| 127 | S | 95.2 | Very high | 93.6 | Very high | 7 Ų | 7 | 76.8 Ų | 76.8 | 5% | 0.049 | 38% | 0.375 | C | S | . | . | H | α-helix | trans | -57.9 | -25.7 | -178.6 | 80.1 | 0 | 0 | 0 | 0 | 113.9 | W123 L124 M125 Y129 I130 | W123-S127 WeakPolarHBondContact O-CB 3.38Å; W123-S127 PolarHBondContact O-N 3.32Å; L124-S127 PolarHBondContact O-N 3.14Å; L124-S127 PolarHBondContact O-OG 2.93Å; M125-S127 VanDerWaalsContact C-N 3.26Å; M125-S127 PolarHBondContact O-N 3.31Å; S127-Y129 PolarHBondContact O-N 3.32Å; S127-I130 PolarHBondContact O-N 2.83Å |
| 128 | S | 93 | Very high | 94.2 | Very high | 36 Ų | 36 | 69.9 Ų | 69.9 | 25% | 0.252 | 34% | 0.338 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -65.4 | -19.6 | 178.5 | -51.8 | 0 | 0 | 0 | 0 | 113.2 | M125 L126 R157 R161 | M125-S128 WeakPolarHBondContact O-CB 3.44Å; M125-S128 PolarHBondContact O-N 2.97Å; M125-S128 PolarHBondContact O-OG 3.25Å; L126-S128 PolarHBondContact O-N 2.99Å; S128-R157 PolarHBondContact OG-NH1 2.92Å; S128-R161 PolarHBondContact O-NH1 2.87Å |
| 129 | Y | 94.9 | Very high | 94.5 | Very high | 182 Ų | 182 | 65.1 Ų | 65.1 | 71% | 0.714 | 32% | 0.322 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -103.6 | -6.2 | -177.8 | -59.9 | -82.3 | 0 | 0 | 0 | 113.3 | L126 S127 | L126-Y129 PolarHBondContact O-N 2.99Å; S127-Y129 PolarHBondContact O-N 3.32Å |
| 130 | I | 96.9 | Very high | 94.6 | Very high | 36 Ų | 36 | 68 Ų | 68 | 19% | 0.185 | 33% | 0.333 | C | S | . | . | trans | -72.9 | 132.4 | -178.9 | -58.4 | -59.7 | 0 | 0 | 0 | 109.8 | S127 D134 V135 F138 R161 | S127-I130 PolarHBondContact O-N 2.83Å; I130-D134 HydrophobicContact CG2-CB 3.84Å; I130-V135 HydrophobicContact CG2-CG2 4.43Å; I130-F138 HydrophobicContact CD1-CB 4.15Å; I130-F138 HydrophobicContact CD1-CD2 3.54Å; I130-F138 HydrophobicContact CD1-CE2 4.2Å; I130-F138 HydrophobicContact CD1-CG 4.01Å; I130-F138 HydrophobicContact CG1-CB 4.13Å; I130-F138 HydrophobicContact CG1-CD1 4.35Å; I130-F138 HydrophobicContact CG1-CD2 3.63Å; I130-F138 HydrophobicContact CG1-CE2 4.09Å; I130-F138 HydrophobicContact CG1-CG 3.77Å; I130-F138 HydrophobicContact CG2-CB 3.92Å; I130-F138 HydrophobicContact CG2-CG 4.38Å; I130-R161 VanDerWaalsContact O-CZ 3.28Å; I130-R161 PolarHBondContact O-NH1 3.37Å; I130-R161 PolarHBondContact O-NH2 2.97Å | ||
| 131 | R | 96.7 | Very high | 94.8 | Very high | 151 Ų | 151 | 70.2 Ų | 70.2 | 57% | 0.57 | 34% | 0.341 | S | S | * | . | trans | -75.8 | 153.4 | 176.7 | -58.4 | -176 | -179.3 | 179.2 | -1.4 | 111 | E133 D134 V135 | R131-E133 VanDerWaalsContact CB-CD 3.42Å; R131-E133 HydrophobicContact CB-CG 4.21Å; R131-E133 WeakPolarHBondContact CB-OE1 3.43Å; R131-E133 WeakPolarHBondContact CD-OE1 3.4Å; R131-E133 IonicContact NH1-OE1 2.62Å; R131-E133 PolarHBondContact O-N 2.9Å; R131-E133 VanDerWaalsContact O-N 3.16Å; R131-D134 PolarHBondContact O-N 3.43Å; R131-V135 PolarHBondContact O-N 2.85Å | ||
| 132 | P | 97.1 | Very high | 94.9 | Very high | 13 Ų | 13 | 68 Ų | 68 | 8% | 0.084 | 33% | 0.332 | C | S | . | . | G | 310 helix | trans | -49.5 | -39.1 | 177 | -30.7 | 38.3 | 0 | 0 | 0 | 114.8 | D134 V135 L158 L192 Y196 F199 | P132-D134 VanDerWaalsContact C-N 3.27Å; P132-D134 PolarHBondContact O-N 3.06Å; P132-V135 WeakPolarHBondContact O-CG2 3.46Å; P132-L158 HydrophobicContact CG-CD1 4.22Å; P132-L192 HydrophobicContact CB-CD1 4.05Å; P132-L192 HydrophobicContact CB-CD2 4.3Å; P132-L192 HydrophobicContact CG-CD1 4.38Å; P132-L192 HydrophobicContact CG-CD2 3.81Å; P132-Y196 HydrophobicContact CB-CD1 3.93Å; P132-Y196 HydrophobicContact CB-CE1 3.91Å; P132-Y196 HydrophobicContact CG-CD1 3.73Å; P132-Y196 HydrophobicContact CG-CD2 4.12Å; P132-Y196 HydrophobicContact CG-CE1 3.74Å; P132-Y196 HydrophobicContact CG-CE2 4.15Å; P132-Y196 HydrophobicContact CG-CG 3.92Å; P132-F199 HydrophobicContact CB-CE1 4.27Å; P132-F199 HydrophobicContact CB-CE2 3.93Å; P132-F199 HydrophobicContact CB-CZ 3.61Å |
| 133 | E | 96 | Very high | 94.7 | Very high | 57 Ų | 57 | 72.9 Ų | 72.9 | 27% | 0.266 | 35% | 0.346 | S | S | . | . | G | 310 helix | trans | -70.3 | -18.9 | 177.7 | 61.5 | -87.8 | -159.4 | 0 | 0 | 114.5 | R131 R137 Y196 F199 | R131-E133 VanDerWaalsContact CB-CD 3.42Å; R131-E133 HydrophobicContact CB-CG 4.21Å; R131-E133 WeakPolarHBondContact CB-OE1 3.43Å; R131-E133 WeakPolarHBondContact CD-OE1 3.4Å; R131-E133 IonicContact NH1-OE1 2.62Å; R131-E133 PolarHBondContact O-N 2.9Å; R131-E133 VanDerWaalsContact O-N 3.16Å; E133-R137 PolarHBondContact O-NH1 2.89Å; E133-R137 VanDerWaalsContact O-NH1 3.08Å; E133-Y196 VanDerWaalsContact CD-OH 3.31Å; E133-Y196 PolarHBondContact OE1-OH 3.34Å; E133-Y196 VanDerWaalsContact OE1-OH 3.04Å; E133-Y196 WeakPolarHBondContact OE2-CE1 3.47Å; E133-Y196 VanDerWaalsContact OE2-CZ 3.3Å; E133-Y196 PolarHBondContact OE2-OH 3.36Å; E133-F199 HydrophobicContact CB-CE1 4.26Å |
| 134 | D | 97.2 | Very high | 94.5 | Very high | 48 Ų | 48 | 73.9 Ų | 73.9 | 26% | 0.257 | 35% | 0.353 | S | S | . | . | G | 310 helix | trans | -102.4 | -2.6 | -173.8 | -67.5 | -43.7 | 0 | 0 | 0 | 113.2 | I130 R131 P132 C136 R137 F138 | I130-D134 HydrophobicContact CG2-CB 3.84Å; R131-D134 PolarHBondContact O-N 3.43Å; P132-D134 VanDerWaalsContact C-N 3.27Å; P132-D134 PolarHBondContact O-N 3.06Å; D134-C136 VanDerWaalsContact C-N 3.25Å; D134-C136 PolarHBondContact O-N 3.32Å; D134-R137 PolarHBondContact O-N 3.16Å; D134-R137 IonicContact OD1-CZ 3.88Å; D134-R137 IonicContact OD1-NH1 2.65Å; D134-R137 PolarHBondContact OD1-NH1 3.29Å; D134-F138 WeakPolarHBondContact O-CB 3.36Å; D134-F138 PolarHBondContact O-N 2.78Å |
| 135 | V | 96.8 | Very high | 94.6 | Very high | 17 Ų | 17 | 72.6 Ų | 72.6 | 10% | 0.103 | 35% | 0.347 | C | S | . | . | H | α-helix | trans | -54.6 | -42.5 | -179.5 | 177.3 | 0 | 0 | 0 | 0 | 111.9 | I130 R131 P132 S139 T149 F154 W155 L158 | I130-V135 HydrophobicContact CG2-CG2 4.43Å; R131-V135 PolarHBondContact O-N 2.85Å; P132-V135 WeakPolarHBondContact O-CG2 3.46Å; V135-S139 WeakPolarHBondContact O-CB 3.45Å; V135-S139 PolarHBondContact O-N 3.13Å; V135-T149 HydrophobicContact CG1-CG2 4.19Å; V135-F154 HydrophobicContact CB-CZ 4.37Å; V135-F154 HydrophobicContact CG1-CE1 3.8Å; V135-F154 HydrophobicContact CG1-CZ 3.71Å; V135-F154 HydrophobicContact CG2-CE1 4.4Å; V135-F154 HydrophobicContact CG2-CZ 3.86Å; V135-W155 HydrophobicContact CG1-CH2 4.06Å; V135-W155 HydrophobicContact CG1-CZ2 4.38Å; V135-L158 HydrophobicContact CG2-CD2 4.18Å |
| 136 | C | 94.8 | Very high | 94.6 | Very high | 83 Ų | 83 | 69.5 Ų | 69.5 | 56% | 0.561 | 33% | 0.329 | S | S | * | . | H | α-helix | trans | -64.4 | -48.6 | 176.9 | -173.5 | 0 | 0 | 0 | 0 | 111.3 | D134 F138 S139 L140 | D134-C136 VanDerWaalsContact C-N 3.25Å; D134-C136 PolarHBondContact O-N 3.32Å; C136-F138 VanDerWaalsContact C-N 3.31Å; C136-F138 PolarHBondContact O-N 2.78Å; C136-S139 PolarHBondContact O-N 2.93Å; C136-S139 VanDerWaalsContact O-N 3.16Å; C136-S139 PolarHBondContact O-OG 2.82Å; C136-L140 WeakPolarHBondContact O-CG 3.35Å; C136-L140 PolarHBondContact O-N 2.82Å; C136-L140 VanDerWaalsContact O-N 3.12Å |
| 137 | R | 97.1 | Very high | 94.5 | Very high | 161 Ų | 161 | 67.3 Ų | 67.3 | 61% | 0.608 | 32% | 0.319 | S | S | * | . | H | α-helix | trans | -58.7 | -44.5 | 178.6 | -63.3 | -175.3 | -172.9 | 83.7 | 7.9 | 111.3 | E133 D134 L140 | E133-R137 PolarHBondContact O-NH1 2.89Å; E133-R137 VanDerWaalsContact O-NH1 3.08Å; D134-R137 PolarHBondContact O-N 3.16Å; D134-R137 IonicContact OD1-CZ 3.88Å; D134-R137 IonicContact OD1-NH1 2.65Å; D134-R137 PolarHBondContact OD1-NH1 3.29Å; R137-L140 PolarHBondContact O-N 3.48Å |
| 138 | F | 97 | Very high | 94.4 | Very high | 7 Ų | 7 | 67.1 Ų | 67.1 | 3% | 0.031 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -59.3 | -47.3 | 175.5 | 176.5 | -103.3 | 0 | 0 | 0 | 111.9 | W123 L126 I130 D134 C136 L140 I141 A145 V148 T149 | W123-F138 AromaticContact CE3-CE2 3.89Å; W123-F138 HydrophobicContact CE3-CE2 3.89Å; W123-F138 HydrophobicContact CE3-CZ 4.11Å; W123-F138 HydrophobicContact CZ3-CE2 4.3Å; L126-F138 HydrophobicContact CB-CE2 4.37Å; I130-F138 HydrophobicContact CD1-CB 4.15Å; I130-F138 HydrophobicContact CD1-CD2 3.54Å; I130-F138 HydrophobicContact CD1-CE2 4.2Å; I130-F138 HydrophobicContact CD1-CG 4.01Å; I130-F138 HydrophobicContact CG1-CB 4.13Å; I130-F138 HydrophobicContact CG1-CD1 4.35Å; I130-F138 HydrophobicContact CG1-CD2 3.63Å; I130-F138 HydrophobicContact CG1-CE2 4.09Å; I130-F138 HydrophobicContact CG1-CG 3.77Å; I130-F138 HydrophobicContact CG2-CB 3.92Å; I130-F138 HydrophobicContact CG2-CG 4.38Å; D134-F138 WeakPolarHBondContact O-CB 3.36Å; D134-F138 PolarHBondContact O-N 2.78Å; C136-F138 VanDerWaalsContact C-N 3.31Å; C136-F138 PolarHBondContact O-N 2.78Å; F138-L140 PolarHBondContact O-N 3.5Å; F138-I141 HydrophobicContact CD2-CD1 3.96Å; F138-I141 WeakPolarHBondContact O-CB 3.45Å; F138-I141 WeakPolarHBondContact O-CG1 3.37Å; F138-I141 PolarHBondContact O-N 2.96Å; F138-I141 VanDerWaalsContact O-N 3.15Å; F138-A145 HydrophobicContact CD1-CB 4.35Å; F138-A145 HydrophobicContact CE1-CB 4.03Å; F138-A145 HydrophobicContact CE2-CB 4.24Å; F138-A145 HydrophobicContact CZ-CB 3.97Å; F138-A145 WeakPolarHBondContact O-CB 3.28Å; F138-V148 HydrophobicContact CE1-CB 4.41Å; F138-V148 HydrophobicContact CE1-CG1 4.27Å; F138-T149 HydrophobicContact CD1-CG2 3.61Å; F138-T149 HydrophobicContact CE1-CG2 3.97Å |
| 139 | S | 94.6 | Very high | 94.6 | Very high | 20 Ų | 20 | 66 Ų | 66 | 14% | 0.14 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -62.1 | -25.1 | 178.8 | 74.2 | 0 | 0 | 0 | 0 | 113.6 | V135 C136 W146 | V135-S139 WeakPolarHBondContact O-CB 3.45Å; V135-S139 PolarHBondContact O-N 3.13Å; C136-S139 PolarHBondContact O-N 2.93Å; C136-S139 VanDerWaalsContact O-N 3.16Å; C136-S139 PolarHBondContact O-OG 2.82Å; S139-W146 WeakPolarHBondContact O-CB 3.47Å |
| 140 | L | 93.6 | Very high | 94.5 | Very high | 138 Ų | 138 | 57.5 Ų | 57.5 | 72% | 0.723 | 28% | 0.276 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -85.8 | -6.1 | -179 | -67.9 | 173 | 0 | 0 | 0 | 113.6 | C136 R137 F138 | C136-L140 WeakPolarHBondContact O-CG 3.35Å; C136-L140 PolarHBondContact O-N 2.82Å; C136-L140 VanDerWaalsContact O-N 3.12Å; R137-L140 PolarHBondContact O-N 3.48Å; F138-L140 PolarHBondContact O-N 3.5Å |
| 141 | I | 92.9 | Very high | 94.3 | Very high | 104 Ų | 104 | 56.5 Ų | 56.5 | 53% | 0.533 | 27% | 0.272 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -65 | -52.6 | -179.7 | -62.8 | 171.3 | 0 | 0 | 0 | 110.7 | W123 F138 A145 | W123-I141 HydrophobicContact CH2-CB 4.44Å; W123-I141 HydrophobicContact CH2-CG2 3.52Å; W123-I141 HydrophobicContact CZ3-CB 4.31Å; W123-I141 HydrophobicContact CZ3-CD1 4.23Å; W123-I141 HydrophobicContact CZ3-CG2 3.82Å; F138-I141 HydrophobicContact CD2-CD1 3.96Å; F138-I141 WeakPolarHBondContact O-CB 3.45Å; F138-I141 WeakPolarHBondContact O-CG1 3.37Å; F138-I141 PolarHBondContact O-N 2.96Å; F138-I141 VanDerWaalsContact O-N 3.15Å; I141-A145 HydrophobicContact CB-CB 4.28Å |
| 142 | C | 90.7 | Very high | 94.1 | Very high | 41 Ų | 41 | 50 Ų | 50 | 28% | 0.277 | 25% | 0.251 | S | S | . | . | trans | -161.2 | 174.7 | -179.3 | 75 | 0 | 0 | 0 | 0 | 111.3 | W123 N144 A145 W146 | W123-C142 WeakPolarHBondContact CZ2-SG 3.28Å; C142-N144 VanDerWaalsContact C-N 3.32Å; C142-N144 PolarHBondContact O-N 3.37Å; C142-A145 PolarHBondContact O-N 3.45Å; C142-A145 PolarHBondContact SG-N 3.02Å; C142-A145 VanDerWaalsContact SG-N 3.38Å; C142-W146 PolarHBondContact O-N 2.88Å | ||
| 143 | R | 88.9 | Confident | 93.9 | Very high | 177 Ų | 177 | 50.9 Ų | 50.9 | 67% | 0.668 | 26% | 0.259 | S | S | * | . | H | α-helix | trans | -62.3 | -35.6 | 179.8 | -171.3 | 175.8 | -177.7 | 169.2 | 0.1 | 113.3 | T147 | R143-T147 WeakPolarHBondContact O-CB 3.23Å; R143-T147 PolarHBondContact O-N 3.3Å; R143-T147 PolarHBondContact O-OG1 3.19Å |
| 144 | N | 91.6 | Very high | 93.9 | Very high | 49 Ų | 49 | 48.4 Ų | 48.4 | 26% | 0.262 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -70.3 | -43 | 178.4 | -71.8 | -11.7 | 0 | 0 | 0 | 111.1 | Y118 W123 C142 W146 T147 V148 | Y118-N144 PolarHBondContact O-ND2 2.91Å; W123-N144 HydrophobicContact CD2-CB 4.42Å; W123-N144 HydrophobicContact CG-CB 3.85Å; C142-N144 VanDerWaalsContact C-N 3.32Å; C142-N144 PolarHBondContact O-N 3.37Å; N144-W146 PolarHBondContact O-N 3.11Å; N144-T147 PolarHBondContact O-N 3.25Å; N144-V148 WeakPolarHBondContact O-CG2 3.35Å; N144-V148 PolarHBondContact O-N 2.85Å |
| 145 | A | 93.9 | Very high | 93.9 | Very high | 0 Ų | 0 | 46.6 Ų | 46.6 | 0% | 0 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -60.2 | -46 | 173.9 | 0 | 0 | 0 | 0 | 0 | 111.7 | W123 F138 I141 C142 T147 V148 T149 | W123-A145 HydrophobicContact CD2-CB 4.19Å; W123-A145 HydrophobicContact CE3-CB 3.61Å; W123-A145 HydrophobicContact CZ3-CB 3.91Å; F138-A145 HydrophobicContact CD1-CB 4.35Å; F138-A145 HydrophobicContact CE1-CB 4.03Å; F138-A145 HydrophobicContact CE2-CB 4.24Å; F138-A145 HydrophobicContact CZ-CB 3.97Å; F138-A145 WeakPolarHBondContact O-CB 3.28Å; I141-A145 HydrophobicContact CB-CB 4.28Å; C142-A145 PolarHBondContact O-N 3.45Å; C142-A145 PolarHBondContact SG-N 3.02Å; C142-A145 VanDerWaalsContact SG-N 3.38Å; A145-T147 PolarHBondContact O-N 3.32Å; A145-V148 PolarHBondContact O-N 3.46Å; A145-T149 WeakPolarHBondContact O-CG2 3.45Å; A145-T149 PolarHBondContact O-N 2.77Å; A145-T149 VanDerWaalsContact O-N 3.17Å |
| 146 | W | 93.1 | Very high | 93.8 | Very high | 49 Ų | 49 | 46.3 Ų | 46.3 | 19% | 0.186 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -57.3 | -46.9 | 173 | 175.8 | 77.2 | 0 | 0 | 0 | 112.2 | S139 C142 N144 V148 T149 C150 L259 H260 P262 | S139-W146 WeakPolarHBondContact O-CB 3.47Å; C142-W146 PolarHBondContact O-N 2.88Å; N144-W146 PolarHBondContact O-N 3.11Å; W146-V148 VanDerWaalsContact C-N 3.32Å; W146-V148 PolarHBondContact O-N 2.93Å; W146-T149 PolarHBondContact O-N 2.76Å; W146-T149 VanDerWaalsContact O-N 3.1Å; W146-T149 PolarHBondContact O-OG1 3.38Å; W146-C150 PolarHBondContact O-N 2.89Å; W146-C150 PolarHBondContact O-SG 2.87Å; W146-L259 HydrophobicContact CD2-CD1 3.89Å; W146-L259 HydrophobicContact CE3-CD1 4.09Å; W146-L259 HydrophobicContact CG-CD1 4.21Å; W146-L259 HydrophobicContact CH2-CB 3.99Å; W146-L259 HydrophobicContact CZ2-CB 3.89Å; W146-L259 HydrophobicContact CZ3-CB 4.4Å; W146-H260 WeakPolarHBondContact CH2-O 3.46Å; W146-P262 HydrophobicContact CH2-CG 4.37Å; W146-P262 HydrophobicContact CZ3-CG 4.46Å |
| 147 | T | 91.8 | Very high | 93.8 | Very high | 38 Ų | 38 | 47.9 Ų | 47.9 | 23% | 0.233 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -60.7 | -41.9 | 179.9 | -61.1 | 0 | 0 | 0 | 0 | 111.3 | R143 N144 A145 T149 C150 T151 | R143-T147 WeakPolarHBondContact O-CB 3.23Å; R143-T147 PolarHBondContact O-N 3.3Å; R143-T147 PolarHBondContact O-OG1 3.19Å; N144-T147 PolarHBondContact O-N 3.25Å; A145-T147 PolarHBondContact O-N 3.32Å; T147-T149 VanDerWaalsContact C-N 3.33Å; T147-T149 PolarHBondContact O-N 3.45Å; T147-C150 VanDerWaalsContact O-CB 3.31Å; T147-C150 WeakPolarHBondContact O-CB 3.44Å; T147-C150 PolarHBondContact O-N 3.02Å; T147-T151 WeakPolarHBondContact O-CG2 3.5Å |
| 148 | V | 94.7 | Very high | 93.8 | Very high | 3 Ų | 3 | 40.6 Ų | 40.6 | 2% | 0.018 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -58.4 | -44.7 | 174.5 | 169.2 | 0 | 0 | 0 | 0 | 111 | V120 W123 L124 F138 N144 A145 W146 C150 T151 F154 | V120-V148 HydrophobicContact CG2-CG2 3.9Å; W123-V148 HydrophobicContact CB-CG2 3.83Å; L124-V148 HydrophobicContact CB-CG2 4.34Å; L124-V148 HydrophobicContact CD1-CG1 4Å; F138-V148 HydrophobicContact CE1-CB 4.41Å; F138-V148 HydrophobicContact CE1-CG1 4.27Å; N144-V148 WeakPolarHBondContact O-CG2 3.35Å; N144-V148 PolarHBondContact O-N 2.85Å; A145-V148 PolarHBondContact O-N 3.46Å; W146-V148 VanDerWaalsContact C-N 3.32Å; W146-V148 PolarHBondContact O-N 2.93Å; V148-C150 PolarHBondContact O-N 2.89Å; V148-C150 VanDerWaalsContact O-N 3.13Å; V148-T151 WeakPolarHBondContact O-CB 3.31Å; V148-T151 PolarHBondContact O-N 3.41Å; V148-T151 PolarHBondContact O-OG1 3.42Å; V148-F154 HydrophobicContact CG1-CB 4.39Å; V148-F154 HydrophobicContact CG1-CD2 4.12Å; V148-F154 WeakPolarHBondContact O-CB 3.44Å |
| 149 | T | 95.4 | Very high | 93.8 | Very high | 12 Ų | 12 | 40.5 Ų | 40.5 | 7% | 0.074 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -66.3 | -13.5 | 176.7 | 67.6 | 0 | 0 | 0 | 0 | 114.3 | V135 F138 A145 W146 T147 F154 W155 | V135-T149 HydrophobicContact CG1-CG2 4.19Å; F138-T149 HydrophobicContact CD1-CG2 3.61Å; F138-T149 HydrophobicContact CE1-CG2 3.97Å; A145-T149 WeakPolarHBondContact O-CG2 3.45Å; A145-T149 PolarHBondContact O-N 2.77Å; A145-T149 VanDerWaalsContact O-N 3.17Å; W146-T149 PolarHBondContact O-N 2.76Å; W146-T149 VanDerWaalsContact O-N 3.1Å; W146-T149 PolarHBondContact O-OG1 3.38Å; T147-T149 VanDerWaalsContact C-N 3.33Å; T147-T149 PolarHBondContact O-N 3.45Å; T149-F154 HydrophobicContact CG2-CE1 4.28Å; T149-F154 HydrophobicContact CG2-CE2 4.36Å; T149-F154 HydrophobicContact CG2-CZ 4.13Å; T149-W155 PolarHBondContact O-NE1 3.18Å |
| 150 | C | 93 | Very high | 93.8 | Very high | 3 Ų | 3 | 47 Ų | 47 | 2% | 0.02 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -83.2 | -17.9 | 174.7 | -65 | 0 | 0 | 0 | 0 | 113.1 | W146 T147 V148 L261 P262 Y265 H269 | W146-C150 PolarHBondContact O-N 2.89Å; W146-C150 PolarHBondContact O-SG 2.87Å; T147-C150 VanDerWaalsContact O-CB 3.31Å; T147-C150 WeakPolarHBondContact O-CB 3.44Å; T147-C150 PolarHBondContact O-N 3.02Å; V148-C150 PolarHBondContact O-N 2.89Å; V148-C150 VanDerWaalsContact O-N 3.13Å; C150-L261 HydrophobicContact CB-CD1 4.13Å; C150-P262 HydrophobicContact CB-CG 4.46Å; C150-Y265 HydrophobicContact CB-CD2 4.08Å; C150-Y265 WeakPolarHBondContact O-CB 3.08Å; C150-H269 VanDerWaalsContact CA-NE2 3.32Å; C150-H269 WeakPolarHBondContact CA-NE2 3.46Å; C150-H269 PolarHBondContact O-NE2 3.22Å |
| 151 | T | 93.3 | Very high | 93.9 | Very high | 16 Ų | 16 | 45.2 Ų | 45.2 | 10% | 0.098 | 21% | 0.207 | C | C | . | . | S | Bend | trans | -79.1 | 151.9 | -172.7 | 69.4 | 0 | 0 | 0 | 0 | 113.5 | T147 V148 A153 F154 W155 Y265 | T147-T151 WeakPolarHBondContact O-CG2 3.5Å; V148-T151 WeakPolarHBondContact O-CB 3.31Å; V148-T151 PolarHBondContact O-N 3.41Å; V148-T151 PolarHBondContact O-OG1 3.42Å; T151-A153 VanDerWaalsContact C-N 3.32Å; T151-F154 WeakPolarHBondContact OG1-CB 3.43Å; T151-F154 PolarHBondContact OG1-N 2.92Å; T151-F154 VanDerWaalsContact OG1-N 3.16Å; T151-W155 VanDerWaalsContact O-CD1 3.24Å; T151-Y265 HydrophobicContact CG2-CE1 4.32Å; T151-Y265 HydrophobicContact CG2-CE2 3.95Å |
| 152 | A | 92.9 | Very high | 94 | Very high | 15 Ų | 15 | 41.9 Ų | 41.9 | 12% | 0.124 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -62.3 | -41 | 170 | 0 | 0 | 0 | 0 | 0 | 111.9 | F154 W155 T156 M181 L184 V268 | A152-F154 VanDerWaalsContact C-N 3.27Å; A152-F154 PolarHBondContact O-N 3.38Å; A152-W155 PolarHBondContact O-N 2.8Å; A152-W155 VanDerWaalsContact O-N 3.13Å; A152-T156 WeakPolarHBondContact O-CB 3.47Å; A152-T156 PolarHBondContact O-N 3.14Å; A152-T156 PolarHBondContact O-OG1 2.98Å; A152-T156 VanDerWaalsContact O-OG1 3.11Å; A152-M181 HydrophobicContact CB-SD 3.86Å; A152-L184 HydrophobicContact CB-CD2 3.72Å; A152-V268 HydrophobicContact CB-CG2 3.83Å |
| 153 | A | 92.9 | Very high | 94.2 | Very high | 30 Ų | 30 | 42.8 Ų | 42.8 | 25% | 0.248 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -54.2 | -42.4 | 180 | 0 | 0 | 0 | 0 | 0 | 112.6 | T151 R157 | T151-A153 VanDerWaalsContact C-N 3.32Å; A153-R157 VanDerWaalsContact O-CB 3.25Å; A153-R157 WeakPolarHBondContact O-CB 3.46Å; A153-R157 VanDerWaalsContact O-CG 3.25Å; A153-R157 WeakPolarHBondContact O-CG 3.33Å; A153-R157 PolarHBondContact O-N 3.24Å |
| 154 | F | 95.9 | Very high | 94.3 | Very high | 6 Ų | 6 | 42.1 Ų | 42.1 | 3% | 0.026 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -59.5 | -53.8 | 175.8 | 172.7 | -97.2 | 0 | 0 | 0 | 112.2 | V135 V148 T149 T151 A152 R157 L158 | V135-F154 HydrophobicContact CB-CZ 4.37Å; V135-F154 HydrophobicContact CG1-CE1 3.8Å; V135-F154 HydrophobicContact CG1-CZ 3.71Å; V135-F154 HydrophobicContact CG2-CE1 4.4Å; V135-F154 HydrophobicContact CG2-CZ 3.86Å; V148-F154 HydrophobicContact CG1-CB 4.39Å; V148-F154 HydrophobicContact CG1-CD2 4.12Å; V148-F154 WeakPolarHBondContact O-CB 3.44Å; T149-F154 HydrophobicContact CG2-CE1 4.28Å; T149-F154 HydrophobicContact CG2-CE2 4.36Å; T149-F154 HydrophobicContact CG2-CZ 4.13Å; T151-F154 WeakPolarHBondContact OG1-CB 3.43Å; T151-F154 PolarHBondContact OG1-N 2.92Å; T151-F154 VanDerWaalsContact OG1-N 3.16Å; A152-F154 VanDerWaalsContact C-N 3.27Å; A152-F154 PolarHBondContact O-N 3.38Å; F154-R157 PolarHBondContact O-N 3.03Å; F154-L158 HydrophobicContact CE1-CD2 4.29Å; F154-L158 HydrophobicContact CZ-CD2 4.38Å; F154-L158 WeakPolarHBondContact O-CB 3.48Å; F154-L158 PolarHBondContact O-N 3.19Å |
| 155 | W | 96.3 | Very high | 94.2 | Very high | 10 Ų | 10 | 45.2 Ų | 45.2 | 4% | 0.038 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -67.6 | -40.8 | -176.8 | -68.1 | 104.5 | 0 | 0 | 0 | 112.2 | V135 T149 T151 A152 L158 Y159 L184 R185 V188 I189 | V135-W155 HydrophobicContact CG1-CH2 4.06Å; V135-W155 HydrophobicContact CG1-CZ2 4.38Å; T149-W155 PolarHBondContact O-NE1 3.18Å; T151-W155 VanDerWaalsContact O-CD1 3.24Å; A152-W155 PolarHBondContact O-N 2.8Å; A152-W155 VanDerWaalsContact O-N 3.13Å; W155-L158 HydrophobicContact CE3-CD2 4.06Å; W155-L158 HydrophobicContact CZ3-CD2 4Å; W155-L158 PolarHBondContact O-N 3.39Å; W155-Y159 WeakPolarHBondContact O-CB 3.46Å; W155-Y159 PolarHBondContact O-N 3.39Å; W155-L184 HydrophobicContact CB-CD1 4.49Å; W155-L184 HydrophobicContact CB-CD2 3.91Å; W155-L184 HydrophobicContact CB-CG 3.8Å; W155-R185 HydrophobicContact CD2-CB 4.04Å; W155-R185 HydrophobicContact CD2-CG 4.02Å; W155-R185 HydrophobicContact CE3-CG 4.29Å; W155-R185 HydrophobicContact CG-CB 4.33Å; W155-R185 HydrophobicContact CH2-CG 3.8Å; W155-R185 HydrophobicContact CZ2-CB 4.3Å; W155-R185 HydrophobicContact CZ2-CG 3.49Å; W155-R185 VanDerWaalsContact CZ2-CG 3.49Å; W155-R185 HydrophobicContact CZ3-CG 4.18Å; W155-V188 HydrophobicContact CB-CG2 4.15Å; W155-V188 HydrophobicContact CE3-CB 3.99Å; W155-V188 HydrophobicContact CE3-CG1 3.85Å; W155-I189 HydrophobicContact CH2-CD1 4.15Å; W155-I189 HydrophobicContact CH2-CG1 4.21Å; W155-I189 HydrophobicContact CZ3-CD1 4.26Å; W155-I189 HydrophobicContact CZ3-CG1 3.84Å |
| 156 | T | 94.9 | Very high | 94 | Very high | 11 Ų | 11 | 53 Ų | 53 | 7% | 0.067 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -63.6 | -42.5 | 176.2 | -58.3 | 0 | 0 | 0 | 0 | 111.5 | A152 Y159 R160 | A152-T156 WeakPolarHBondContact O-CB 3.47Å; A152-T156 PolarHBondContact O-N 3.14Å; A152-T156 PolarHBondContact O-OG1 2.98Å; A152-T156 VanDerWaalsContact O-OG1 3.11Å; T156-Y159 PolarHBondContact O-N 2.85Å; T156-R160 HydrophobicContact CG2-CG 4.49Å; T156-R160 WeakPolarHBondContact O-CB 3.4Å; T156-R160 VanDerWaalsContact O-CG 3.3Å; T156-R160 WeakPolarHBondContact O-CG 3.31Å; T156-R160 PolarHBondContact O-N 3.31Å |
| 157 | R | 95.5 | Very high | 93.8 | Very high | 115 Ų | 115 | 52.8 Ų | 52.8 | 43% | 0.434 | 25% | 0.245 | S | C | . | . | H | α-helix | trans | -62.8 | -44.1 | 173.9 | -80.2 | 177.1 | 145.1 | -177.8 | -4.4 | 111.9 | S128 A153 F154 Y159 R160 R161 | S128-R157 PolarHBondContact OG-NH1 2.92Å; A153-R157 VanDerWaalsContact O-CB 3.25Å; A153-R157 WeakPolarHBondContact O-CB 3.46Å; A153-R157 VanDerWaalsContact O-CG 3.25Å; A153-R157 WeakPolarHBondContact O-CG 3.33Å; A153-R157 PolarHBondContact O-N 3.24Å; F154-R157 PolarHBondContact O-N 3.03Å; R157-Y159 VanDerWaalsContact C-N 3.32Å; R157-Y159 PolarHBondContact O-N 3.28Å; R157-R160 PolarHBondContact O-N 2.96Å; R157-R161 WeakPolarHBondContact O-CB 3.31Å; R157-R161 PolarHBondContact O-N 2.97Å |
| 158 | L | 96.6 | Very high | 93.6 | Very high | 8 Ų | 8 | 57.9 Ų | 57.9 | 4% | 0.042 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -60.6 | -42.9 | 178.5 | -178.3 | 59.2 | 0 | 0 | 0 | 111.7 | P132 V135 F154 W155 H162 V188 L192 | P132-L158 HydrophobicContact CG-CD1 4.22Å; V135-L158 HydrophobicContact CG2-CD2 4.18Å; F154-L158 HydrophobicContact CE1-CD2 4.29Å; F154-L158 HydrophobicContact CZ-CD2 4.38Å; F154-L158 WeakPolarHBondContact O-CB 3.48Å; F154-L158 PolarHBondContact O-N 3.19Å; W155-L158 HydrophobicContact CE3-CD2 4.06Å; W155-L158 HydrophobicContact CZ3-CD2 4Å; W155-L158 PolarHBondContact O-N 3.39Å; L158-H162 PolarHBondContact O-CD2 3.04Å; L158-V188 HydrophobicContact CD2-CG1 4.34Å; L158-V188 HydrophobicContact CG-CG1 4.36Å; L158-L192 HydrophobicContact CD2-CD1 4.11Å; L158-L192 HydrophobicContact CG-CD1 4.44Å |
| 159 | Y | 96.6 | Very high | 93.5 | Very high | 5 Ų | 5 | 58 Ų | 58 | 2% | 0.02 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -60.9 | -55.7 | 173.9 | 177.1 | -94.9 | 0 | 0 | 0 | 111.7 | W155 T156 R157 R161 H162 Y163 L173 P175 I178 V188 S191 L195 | W155-Y159 WeakPolarHBondContact O-CB 3.46Å; W155-Y159 PolarHBondContact O-N 3.39Å; T156-Y159 PolarHBondContact O-N 2.85Å; R157-Y159 VanDerWaalsContact C-N 3.32Å; R157-Y159 PolarHBondContact O-N 3.28Å; Y159-R161 PolarHBondContact O-N 3.4Å; Y159-H162 PolarHBondContact O-N 3.21Å; Y159-Y163 AromaticContact CE1-CD2 3.91Å; Y159-Y163 HydrophobicContact CE1-CD2 3.91Å; Y159-Y163 AromaticContact CE1-CG 3.98Å; Y159-Y163 HydrophobicContact CE1-CG 3.98Å; Y159-Y163 HydrophobicContact CE2-CD2 4.34Å; Y159-Y163 AromaticContact CZ-CD2 3.55Å; Y159-Y163 PolarHBondContact O-N 3.41Å; Y159-Y163 WeakPolarHBondContact OH-CD2 3.12Å; Y159-Y163 WeakPolarHBondContact OH-CE2 2.93Å; Y159-L173 WeakPolarHBondContact CE2-O 3.33Å; Y159-L173 PolarHBondContact OH-O 3.47Å; Y159-P175 HydrophobicContact CE1-CG 4.33Å; Y159-P175 WeakPolarHBondContact OH-CD 3.42Å; Y159-I178 HydrophobicContact CD1-CB 4.49Å; Y159-I178 HydrophobicContact CD1-CG1 4.35Å; Y159-I178 HydrophobicContact CD1-CG2 3.99Å; Y159-I178 HydrophobicContact CD2-CD1 4.27Å; Y159-I178 HydrophobicContact CD2-CG1 4.05Å; Y159-I178 HydrophobicContact CE1-CB 4.36Å; Y159-I178 HydrophobicContact CE1-CG1 4.04Å; Y159-I178 HydrophobicContact CE1-CG2 4.35Å; Y159-I178 HydrophobicContact CE2-CD1 4.16Å; Y159-I178 HydrophobicContact CE2-CG1 3.7Å; Y159-I178 HydrophobicContact CG-CG1 4.36Å; Y159-I178 HydrophobicContact CG-CG2 4.11Å; Y159-V188 HydrophobicContact CD2-CG2 4.35Å; Y159-V188 HydrophobicContact CG-CG2 4.44Å; Y159-S191 VanDerWaalsContact CD2-OG 3.29Å; Y159-S191 WeakPolarHBondContact CD2-OG 3.43Å; Y159-L195 HydrophobicContact CD2-CD1 4.49Å; Y159-L195 HydrophobicContact CE2-CD1 4.16Å |
| 160 | R | 95.1 | Very high | 93.3 | Very high | 157 Ų | 157 | 59.2 Ų | 59.2 | 59% | 0.592 | 28% | 0.279 | S | S | * | . | H | α-helix | trans | -60 | -33 | -176.1 | -72.1 | 178.5 | -176.3 | 173.1 | 3 | 112.9 | T156 R157 H162 D179 | T156-R160 HydrophobicContact CG2-CG 4.49Å; T156-R160 WeakPolarHBondContact O-CB 3.4Å; T156-R160 VanDerWaalsContact O-CG 3.3Å; T156-R160 WeakPolarHBondContact O-CG 3.31Å; T156-R160 PolarHBondContact O-N 3.31Å; R157-R160 PolarHBondContact O-N 2.96Å; R160-H162 VanDerWaalsContact C-N 3.27Å; R160-H162 PolarHBondContact O-N 3.07Å; R160-D179 IonicContact NH2-OD1 3.67Å; R160-D179 PolarHBondContact NH2-OD1 2.96Å |
| 161 | R | 95.6 | Very high | 93.1 | Very high | 101 Ų | 101 | 66.3 Ų | 66.3 | 38% | 0.381 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -63.2 | -31.7 | 176.6 | -172.7 | 179.4 | 66.1 | -179.2 | -1 | 113.2 | S128 I130 R157 Y159 | S128-R161 PolarHBondContact O-NH1 2.87Å; I130-R161 VanDerWaalsContact O-CZ 3.28Å; I130-R161 PolarHBondContact O-NH1 3.37Å; I130-R161 PolarHBondContact O-NH2 2.97Å; R157-R161 WeakPolarHBondContact O-CB 3.31Å; R157-R161 PolarHBondContact O-N 2.97Å; Y159-R161 PolarHBondContact O-N 3.4Å |
| 162 | H | 95 | Very high | 92.9 | Very high | 34 Ų | 34 | 69.3 Ų | 69.3 | 16% | 0.157 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -108.5 | -11.5 | -175.2 | -68.7 | -66 | 0 | 0 | 0 | 113.6 | L158 Y159 R160 L192 L195 Y196 | L158-H162 PolarHBondContact O-CD2 3.04Å; Y159-H162 PolarHBondContact O-N 3.21Å; R160-H162 VanDerWaalsContact C-N 3.27Å; R160-H162 PolarHBondContact O-N 3.07Å; H162-L192 HydrophobicContact CB-CD2 4.27Å; H162-L195 HydrophobicContact CB-CB 4.35Å; H162-Y196 AromaticContact CE1-CD2 3.46Å; H162-Y196 VanDerWaalsContact CE1-CD2 3.46Å; H162-Y196 WeakPolarHBondContact CE1-CD2 3.29Å; H162-Y196 AromaticContact CE1-CE2 3.63Å; H162-Y196 AromaticContact ND1-CD2 3.7Å |
| 163 | Y | 95 | Very high | 92.8 | Very high | 60 Ų | 60 | 68.8 Ų | 68.8 | 24% | 0.235 | 32% | 0.315 | C | S | . | . | trans | -63.9 | 137.7 | 178.9 | -178.2 | -104.3 | 0 | 0 | 0 | 111.8 | Y159 V165 L169 P175 L195 | Y159-Y163 AromaticContact CE1-CD2 3.91Å; Y159-Y163 HydrophobicContact CE1-CD2 3.91Å; Y159-Y163 AromaticContact CE1-CG 3.98Å; Y159-Y163 HydrophobicContact CE1-CG 3.98Å; Y159-Y163 HydrophobicContact CE2-CD2 4.34Å; Y159-Y163 AromaticContact CZ-CD2 3.55Å; Y159-Y163 PolarHBondContact O-N 3.41Å; Y159-Y163 WeakPolarHBondContact OH-CD2 3.12Å; Y159-Y163 WeakPolarHBondContact OH-CE2 2.93Å; Y163-V165 HydrophobicContact CE1-CG2 3.92Å; Y163-L169 HydrophobicContact CD2-CD1 3.99Å; Y163-L169 HydrophobicContact CE2-CD1 3.8Å; Y163-P175 HydrophobicContact CD1-CG 4.24Å; Y163-P175 HydrophobicContact CD2-CG 4.28Å; Y163-P175 HydrophobicContact CE1-CG 3.6Å; Y163-P175 HydrophobicContact CE2-CG 3.67Å; Y163-P175 WeakPolarHBondContact OH-CD 3.47Å; Y163-P175 WeakPolarHBondContact OH-CG 3.2Å; Y163-L195 HydrophobicContact CD2-CD1 4.25Å; Y163-L195 HydrophobicContact CD2-CD2 4.48Å | ||
| 164 | R | 91.7 | Very high | 92.8 | Very high | 162 Ų | 162 | 69.7 Ų | 69.7 | 61% | 0.611 | 31% | 0.314 | S | S | * | . | trans | -135.7 | 130.4 | 178.1 | -68.2 | -175.3 | -176.9 | -177.1 | 0.1 | 107.7 | E166 V167 | R164-E166 WeakPolarHBondContact CB-OE2 3.35Å; R164-E166 PolarHBondContact O-N 2.9Å; R164-V167 HydrophobicContact CB-CG2 4.08Å; R164-V167 PolarHBondContact O-N 3.49Å | ||
| 165 | V | 89.7 | Confident | 92.7 | Very high | 115 Ų | 115 | 71 Ų | 71 | 70% | 0.697 | 32% | 0.323 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -66.9 | -25.2 | -174.8 | 176.4 | 0 | 0 | 0 | 0 | 111.2 | Y163 V167 | Y163-V165 HydrophobicContact CE1-CG2 3.92Å; V165-V167 VanDerWaalsContact C-N 3.29Å; V165-V167 PolarHBondContact O-N 3.25Å |
| 166 | E | 89.8 | Confident | 92.4 | Very high | 164 Ų | 164 | 76.6 Ų | 76.6 | 77% | 0.766 | 35% | 0.354 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -77.6 | -12.7 | -176.1 | -52.2 | 77.3 | -164.5 | 0 | 0 | 113.6 | R164 | R164-E166 WeakPolarHBondContact CB-OE2 3.35Å; R164-E166 PolarHBondContact O-N 2.9Å |
| 167 | V | 89.1 | Confident | 92.1 | Very high | 44 Ų | 44 | 77 Ų | 77 | 27% | 0.267 | 36% | 0.357 | S | S | . | . | S | Bend | trans | -91.2 | 119.8 | -178.1 | -178.9 | 0 | 0 | 0 | 0 | 109.7 | R164 V165 L169 H194 L195 | R164-V167 HydrophobicContact CB-CG2 4.08Å; R164-V167 PolarHBondContact O-N 3.49Å; V165-V167 VanDerWaalsContact C-N 3.29Å; V165-V167 PolarHBondContact O-N 3.25Å; V167-L169 HydrophobicContact CG1-CD2 4.03Å; V167-L169 HydrophobicContact CG1-CG 4.44Å; V167-L169 PolarHBondContact O-N 3.17Å; V167-L169 VanDerWaalsContact O-N 3.12Å; V167-H194 HydrophobicContact CG1-CB 4.39Å; V167-L195 HydrophobicContact CB-CD2 3.97Å; V167-L195 HydrophobicContact CG1-CD2 4.11Å; V167-L195 HydrophobicContact CG2-CD2 4.16Å |
| 168 | D | 87.7 | Confident | 91.9 | Very high | 145 Ų | 145 | 71.7 Ų | 71.7 | 78% | 0.775 | 34% | 0.337 | S | S | * | . | trans | -70.5 | 108.4 | 173.9 | -172.2 | 22 | 0 | 0 | 0 | 110.5 | ||||
| 169 | L | 91.6 | Very high | 91.5 | Very high | 4 Ų | 4 | 75.1 Ų | 75.1 | 2% | 0.021 | 36% | 0.356 | C | S | . | . | trans | -102.7 | 143.2 | 177.2 | -65.1 | 179.8 | 0 | 0 | 0 | 110.6 | Y163 V167 F171 L173 Q174 H194 L195 | Y163-L169 HydrophobicContact CD2-CD1 3.99Å; Y163-L169 HydrophobicContact CE2-CD1 3.8Å; V167-L169 HydrophobicContact CG1-CD2 4.03Å; V167-L169 HydrophobicContact CG1-CG 4.44Å; V167-L169 PolarHBondContact O-N 3.17Å; V167-L169 VanDerWaalsContact O-N 3.12Å; L169-F171 PolarHBondContact O-N 3.11Å; L169-L173 HydrophobicContact CB-CB 4.2Å; L169-L173 HydrophobicContact CD1-CB 4.47Å; L169-L173 WeakPolarHBondContact CD1-O 3.43Å; L169-Q174 HydrophobicContact CB-CG 4.42Å; L169-Q174 PolarHBondContact O-NE2 3.31Å; L169-H194 HydrophobicContact CD2-CB 3.37Å; L169-L195 HydrophobicContact CD1-CD1 4.1Å; L169-L195 HydrophobicContact CD1-CD2 4.26Å; L169-L195 HydrophobicContact CD1-CG 4.36Å; L169-L195 HydrophobicContact CD2-CD2 4.28Å; L169-L195 HydrophobicContact CD2-CG 4.25Å | ||
| 170 | P | 91.6 | Very high | 91 | Very high | 38 Ų | 38 | 83.2 Ų | 83.2 | 25% | 0.247 | 39% | 0.386 | C | S | . | . | trans | -49.8 | 143.1 | 166.8 | -25.1 | 31.9 | 0 | 0 | 0 | 111.6 | R172 L173 Q174 | P170-R172 VanDerWaalsContact C-N 3.25Å; P170-R172 PolarHBondContact O-N 3.33Å; P170-L173 HydrophobicContact CB-CD1 4.39Å; P170-L173 HydrophobicContact CB-CG 4.33Å; P170-L173 HydrophobicContact CG-CD1 4.09Å; P170-L173 WeakPolarHBondContact O-CA 3.48Å; P170-L173 WeakPolarHBondContact O-CB 3.32Å; P170-L173 PolarHBondContact O-N 3.42Å; P170-Q174 PolarHBondContact O-N 2.96Å | ||
| 171 | F | 88.9 | Confident | 90.4 | Very high | 153 Ų | 153 | 80 Ų | 80 | 67% | 0.671 | 38% | 0.379 | S | S | * | . | G | 310 helix | trans | -44.1 | -43.1 | -175 | 176.6 | -99.2 | 0 | 0 | 0 | 115.1 | L169 L173 Q174 S177 | L169-F171 PolarHBondContact O-N 3.11Å; F171-L173 PolarHBondContact O-N 3.01Å; F171-Q174 WeakPolarHBondContact O-CB 3.38Å; F171-Q174 PolarHBondContact O-N 3.47Å; F171-S177 PolarHBondContact O-OG 3.35Å |
| 172 | R | 88.1 | Confident | 90 | Very high | 78 Ų | 78 | 81.7 Ų | 81.7 | 29% | 0.294 | 39% | 0.385 | S | S | . | . | G | 310 helix | trans | -70.9 | -12.5 | 179.6 | -73.9 | -156.9 | -74.9 | -104.6 | 0.1 | 115 | P170 S177 L357 | P170-R172 VanDerWaalsContact C-N 3.25Å; P170-R172 PolarHBondContact O-N 3.33Å; R172-S177 VanDerWaalsContact O-CB 3.31Å; R172-S177 WeakPolarHBondContact O-CB 3.36Å; R172-L357 VanDerWaalsContact CZ-O 3.24Å; R172-L357 PolarHBondContact NH1-O 3.09Å; R172-L357 PolarHBondContact NH2-O 3.09Å |
| 173 | L | 92.3 | Very high | 89.8 | Confident | 4 Ų | 4 | 80.9 Ų | 80.9 | 2% | 0.021 | 38% | 0.383 | C | S | . | . | G | 310 helix | trans | -106 | -1.8 | -179.2 | -51.6 | -173.1 | 0 | 0 | 0 | 112.1 | Y159 L169 P170 F171 C187 R190 | Y159-L173 WeakPolarHBondContact CE2-O 3.33Å; Y159-L173 PolarHBondContact OH-O 3.47Å; L169-L173 HydrophobicContact CB-CB 4.2Å; L169-L173 HydrophobicContact CD1-CB 4.47Å; L169-L173 WeakPolarHBondContact CD1-O 3.43Å; P170-L173 HydrophobicContact CB-CD1 4.39Å; P170-L173 HydrophobicContact CB-CG 4.33Å; P170-L173 HydrophobicContact CG-CD1 4.09Å; P170-L173 WeakPolarHBondContact O-CA 3.48Å; P170-L173 WeakPolarHBondContact O-CB 3.32Å; P170-L173 PolarHBondContact O-N 3.42Å; F171-L173 PolarHBondContact O-N 3.01Å; L173-C187 HydrophobicContact CD2-CB 4.01Å; L173-C187 WeakPolarHBondContact CD2-O 3.27Å; L173-R190 HydrophobicContact CD1-CB 3.86Å; L173-R190 HydrophobicContact CD2-CB 3.86Å |
| 174 | Q | 92.9 | Very high | 89.8 | Confident | 49 Ų | 49 | 78 Ų | 78 | 23% | 0.229 | 37% | 0.372 | C | S | . | . | S | Bend | trans | -72.1 | 155.4 | 174.1 | -68.3 | -71 | -7.6 | 0 | 0 | 111.3 | L169 P170 F171 D176 S177 I178 | L169-Q174 HydrophobicContact CB-CG 4.42Å; L169-Q174 PolarHBondContact O-NE2 3.31Å; P170-Q174 PolarHBondContact O-N 2.96Å; F171-Q174 WeakPolarHBondContact O-CB 3.38Å; F171-Q174 PolarHBondContact O-N 3.47Å; Q174-D176 VanDerWaalsContact C-N 3.31Å; Q174-D176 PolarHBondContact O-N 2.92Å; Q174-S177 WeakPolarHBondContact O-CB 3.38Å; Q174-S177 PolarHBondContact O-N 3.21Å; Q174-I178 WeakPolarHBondContact O-CG1 3.21Å; Q174-I178 PolarHBondContact O-N 2.86Å; Q174-I178 VanDerWaalsContact O-N 3.16Å |
| 175 | P | 93 | Very high | 89.9 | Confident | 34 Ų | 34 | 74.6 Ų | 74.6 | 22% | 0.221 | 36% | 0.359 | C | S | . | . | H | α-helix | trans | -51.5 | -45 | -175.7 | -29 | 35.9 | 0 | 0 | 0 | 114.1 | Y159 Y163 S177 I178 D179 | Y159-P175 HydrophobicContact CE1-CG 4.33Å; Y159-P175 WeakPolarHBondContact OH-CD 3.42Å; Y163-P175 HydrophobicContact CD1-CG 4.24Å; Y163-P175 HydrophobicContact CD2-CG 4.28Å; Y163-P175 HydrophobicContact CE1-CG 3.6Å; Y163-P175 HydrophobicContact CE2-CG 3.67Å; Y163-P175 WeakPolarHBondContact OH-CD 3.47Å; Y163-P175 WeakPolarHBondContact OH-CG 3.2Å; P175-S177 PolarHBondContact O-N 3.34Å; P175-S177 VanDerWaalsContact O-N 3.14Å; P175-I178 WeakPolarHBondContact O-CB 3.35Å; P175-I178 PolarHBondContact O-N 3.38Å; P175-D179 PolarHBondContact O-N 2.99Å |
| 176 | D | 90.6 | Very high | 90.2 | Very high | 128 Ų | 128 | 69.4 Ų | 69.4 | 68% | 0.684 | 33% | 0.328 | S | S | * | . | H | α-helix | trans | -58.4 | -30 | 179.4 | -63.4 | -10.4 | 0 | 0 | 0 | 113.7 | Q174 R180 | Q174-D176 VanDerWaalsContact C-N 3.31Å; Q174-D176 PolarHBondContact O-N 2.92Å; D176-R180 PolarHBondContact O-NE 3.21Å |
| 177 | S | 88.1 | Confident | 90.4 | Very high | 19 Ų | 19 | 62.5 Ų | 62.5 | 13% | 0.133 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -82.1 | -36.3 | 176.1 | -70 | 0 | 0 | 0 | 0 | 111.5 | F171 R172 Q174 P175 R180 | F171-S177 PolarHBondContact O-OG 3.35Å; R172-S177 VanDerWaalsContact O-CB 3.31Å; R172-S177 WeakPolarHBondContact O-CB 3.36Å; Q174-S177 WeakPolarHBondContact O-CB 3.38Å; Q174-S177 PolarHBondContact O-N 3.21Å; P175-S177 PolarHBondContact O-N 3.34Å; P175-S177 VanDerWaalsContact O-N 3.14Å; S177-R180 WeakPolarHBondContact O-CB 3.48Å; S177-R180 PolarHBondContact O-N 3.17Å |
| 178 | I | 90.7 | Very high | 90.7 | Very high | 4 Ų | 4 | 60.4 Ų | 60.4 | 2% | 0.021 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -66 | -39.3 | 178.7 | -63.9 | -60.8 | 0 | 0 | 0 | 111.2 | Y159 Q174 P175 R180 M181 L184 C187 V188 | Y159-I178 HydrophobicContact CD1-CB 4.49Å; Y159-I178 HydrophobicContact CD1-CG1 4.35Å; Y159-I178 HydrophobicContact CD1-CG2 3.99Å; Y159-I178 HydrophobicContact CD2-CD1 4.27Å; Y159-I178 HydrophobicContact CD2-CG1 4.05Å; Y159-I178 HydrophobicContact CE1-CB 4.36Å; Y159-I178 HydrophobicContact CE1-CG1 4.04Å; Y159-I178 HydrophobicContact CE1-CG2 4.35Å; Y159-I178 HydrophobicContact CE2-CD1 4.16Å; Y159-I178 HydrophobicContact CE2-CG1 3.7Å; Y159-I178 HydrophobicContact CG-CG1 4.36Å; Y159-I178 HydrophobicContact CG-CG2 4.11Å; Q174-I178 WeakPolarHBondContact O-CG1 3.21Å; Q174-I178 PolarHBondContact O-N 2.86Å; Q174-I178 VanDerWaalsContact O-N 3.16Å; P175-I178 WeakPolarHBondContact O-CB 3.35Å; P175-I178 PolarHBondContact O-N 3.38Å; I178-R180 PolarHBondContact O-N 3.48Å; I178-R180 VanDerWaalsContact O-N 3.13Å; I178-M181 PolarHBondContact O-N 3.15Å; I178-L184 HydrophobicContact CG2-CD1 3.64Å; I178-C187 HydrophobicContact CD1-CB 3.51Å; I178-V188 HydrophobicContact CD1-CG2 4.4Å |
| 179 | D | 88.4 | Confident | 91.1 | Very high | 79 Ų | 79 | 54.7 Ų | 54.7 | 42% | 0.422 | 25% | 0.254 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -65.5 | -15.2 | 179.6 | -73 | -29.4 | 0 | 0 | 0 | 113.2 | R160 P175 M181 | R160-D179 IonicContact NH2-OD1 3.67Å; R160-D179 PolarHBondContact NH2-OD1 2.96Å; P175-D179 PolarHBondContact O-N 2.99Å; D179-M181 VanDerWaalsContact C-N 3.27Å; D179-M181 PolarHBondContact O-N 3Å |
| 180 | R | 85.9 | Confident | 91.3 | Very high | 175 Ų | 175 | 55.6 Ų | 55.6 | 66% | 0.66 | 26% | 0.257 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -76.8 | -8.1 | 173.5 | -57.7 | 179.8 | -169.3 | -168.6 | -0.5 | 114 | D176 S177 I178 R182 | D176-R180 PolarHBondContact O-NE 3.21Å; S177-R180 WeakPolarHBondContact O-CB 3.48Å; S177-R180 PolarHBondContact O-N 3.17Å; I178-R180 PolarHBondContact O-N 3.48Å; I178-R180 VanDerWaalsContact O-N 3.13Å; R180-R182 PolarHBondContact O-N 3.34Å |
| 181 | M | 83.1 | Confident | 91.4 | Very high | 91 Ų | 91 | 53.8 Ų | 53.8 | 45% | 0.448 | 25% | 0.246 | S | C | . | . | trans | 59.2 | -6.4 | 175.4 | -53.3 | -170.3 | -174.9 | 0 | 0 | 118 | A152 I178 D179 C183 L184 | A152-M181 HydrophobicContact CB-SD 3.86Å; I178-M181 PolarHBondContact O-N 3.15Å; D179-M181 VanDerWaalsContact C-N 3.27Å; D179-M181 PolarHBondContact O-N 3Å; M181-C183 PolarHBondContact O-N 3.3Å; M181-L184 VanDerWaalsContact O-CB 3.27Å; M181-L184 WeakPolarHBondContact O-CB 3.16Å; M181-L184 PolarHBondContact O-N 3.03Å | ||
| 182 | R | 86.9 | Confident | 91.8 | Very high | 136 Ų | 136 | 46.7 Ų | 46.7 | 51% | 0.513 | 22% | 0.215 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -70.4 | 128.4 | 175 | -168.3 | -178.3 | -175.5 | -136 | 0.7 | 111.1 | R180 L184 M270 | R180-R182 PolarHBondContact O-N 3.34Å; R182-L184 PolarHBondContact O-N 3.29Å; R182-L184 VanDerWaalsContact O-N 3.16Å; R182-M270 HydrophobicContact CG-CE 3.39Å; R182-M270 VanDerWaalsContact NE-CE 3.32Å |
| 183 | C | 91.3 | Very high | 92.1 | Very high | 16 Ų | 16 | 43.8 Ų | 43.8 | 11% | 0.108 | 20% | 0.204 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 55.1 | 26.3 | -175.6 | -54 | 0 | 0 | 0 | 0 | 113.4 | M181 R185 A186 C187 E267 M270 | M181-C183 PolarHBondContact O-N 3.3Å; C183-R185 VanDerWaalsContact C-N 3.33Å; C183-R185 PolarHBondContact O-N 3.29Å; C183-A186 HydrophobicContact CB-CB 4.5Å; C183-A186 WeakPolarHBondContact O-CB 3.21Å; C183-A186 PolarHBondContact O-N 3.45Å; C183-C187 PolarHBondContact O-N 3.17Å; C183-C187 PolarHBondContact O-SG 3.34Å; C183-E267 WeakPolarHBondContact CA-O 3.46Å; C183-E267 PolarHBondContact N-O 2.96Å; C183-M270 WeakPolarHBondContact CA-O 3.33Å; C183-M270 VanDerWaalsContact CB-O 3.25Å; C183-M270 WeakPolarHBondContact CB-O 3.48Å; C183-M270 WeakPolarHBondContact SG-CE 3.01Å; C183-M270 PolarHBondContact SG-O 3.5Å; C183-M270 VanDerWaalsContact SG-O 3.37Å |
| 184 | L | 93.9 | Very high | 92.1 | Very high | 1 Ų | 1 | 46 Ų | 46 | 1% | 0.005 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -51.7 | -48.7 | -167.5 | 174.3 | 62.6 | 0 | 0 | 0 | 112.6 | A152 W155 I178 M181 R182 A186 C187 V188 V268 | A152-L184 HydrophobicContact CB-CD2 3.72Å; W155-L184 HydrophobicContact CB-CD1 4.49Å; W155-L184 HydrophobicContact CB-CD2 3.91Å; W155-L184 HydrophobicContact CB-CG 3.8Å; I178-L184 HydrophobicContact CG2-CD1 3.64Å; M181-L184 VanDerWaalsContact O-CB 3.27Å; M181-L184 WeakPolarHBondContact O-CB 3.16Å; M181-L184 PolarHBondContact O-N 3.03Å; R182-L184 PolarHBondContact O-N 3.29Å; R182-L184 VanDerWaalsContact O-N 3.16Å; L184-A186 VanDerWaalsContact C-N 3.31Å; L184-A186 PolarHBondContact O-N 2.95Å; L184-C187 PolarHBondContact O-N 3.03Å; L184-V188 HydrophobicContact CD1-CG2 3.78Å; L184-V188 HydrophobicContact CG-CG2 4.35Å; L184-V188 VanDerWaalsContact O-CG2 3.32Å; L184-V188 WeakPolarHBondContact O-CG2 3.25Å; L184-V188 PolarHBondContact O-N 3.4Å; L184-V268 HydrophobicContact CB-CG1 4.22Å; L184-V268 HydrophobicContact CD2-CG1 4.32Å; L184-V268 PolarHBondContact N-O 3.01Å |
| 185 | R | 95.3 | Very high | 92.2 | Very high | 90 Ų | 90 | 44.4 Ų | 44.4 | 34% | 0.34 | 21% | 0.207 | S | C | . | . | H | α-helix | trans | -56.8 | -45.9 | 178.8 | 174 | 175.1 | 179.7 | -71.6 | -2.9 | 111.7 | W155 C183 V188 I189 V268 H269 | W155-R185 HydrophobicContact CD2-CB 4.04Å; W155-R185 HydrophobicContact CD2-CG 4.02Å; W155-R185 HydrophobicContact CE3-CG 4.29Å; W155-R185 HydrophobicContact CG-CB 4.33Å; W155-R185 HydrophobicContact CH2-CG 3.8Å; W155-R185 HydrophobicContact CZ2-CB 4.3Å; W155-R185 HydrophobicContact CZ2-CG 3.49Å; W155-R185 VanDerWaalsContact CZ2-CG 3.49Å; W155-R185 HydrophobicContact CZ3-CG 4.18Å; C183-R185 VanDerWaalsContact C-N 3.33Å; C183-R185 PolarHBondContact O-N 3.29Å; R185-V188 PolarHBondContact O-N 3.24Å; R185-I189 HydrophobicContact CG-CD1 3.74Å; R185-I189 HydrophobicContact CG-CG1 4.5Å; R185-I189 VanDerWaalsContact CZ-CD1 3.4Å; R185-I189 WeakPolarHBondContact O-CB 3.21Å; R185-I189 VanDerWaalsContact O-CG1 3.23Å; R185-I189 WeakPolarHBondContact O-CG1 3.47Å; R185-I189 PolarHBondContact O-N 2.68Å; R185-V268 HydrophobicContact CB-CG1 4.38Å; R185-V268 VanDerWaalsContact CB-O 3.22Å; R185-V268 WeakPolarHBondContact CB-O 3.17Å; R185-V268 PolarHBondContact N-O 3.03Å; R185-H269 WeakPolarHBondContact CD-ND1 3.42Å |
| 186 | A | 94.4 | Very high | 92.4 | Very high | 5 Ų | 5 | 44.1 Ų | 44.1 | 4% | 0.041 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -65.4 | -42.2 | -179.5 | 0 | 0 | 0 | 0 | 0 | 111.3 | C183 L184 I189 R190 N271 W349 | C183-A186 HydrophobicContact CB-CB 4.5Å; C183-A186 WeakPolarHBondContact O-CB 3.21Å; C183-A186 PolarHBondContact O-N 3.45Å; L184-A186 VanDerWaalsContact C-N 3.31Å; L184-A186 PolarHBondContact O-N 2.95Å; A186-I189 PolarHBondContact O-N 3.12Å; A186-R190 WeakPolarHBondContact O-CB 3.16Å; A186-R190 WeakPolarHBondContact O-CG 3.46Å; A186-R190 PolarHBondContact O-N 3.44Å; A186-N271 HydrophobicContact CB-CB 4.03Å; A186-W349 HydrophobicContact CB-CH2 4.42Å; A186-W349 HydrophobicContact CB-CZ3 3.9Å |
| 187 | C | 94.4 | Very high | 92.5 | Very high | 19 Ų | 19 | 43.5 Ų | 43.5 | 13% | 0.128 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -62.9 | -45.9 | 176.4 | -64.7 | 0 | 0 | 0 | 0 | 111.8 | L173 I178 C183 L184 R190 S191 | L173-C187 HydrophobicContact CD2-CB 4.01Å; L173-C187 WeakPolarHBondContact CD2-O 3.27Å; I178-C187 HydrophobicContact CD1-CB 3.51Å; C183-C187 PolarHBondContact O-N 3.17Å; C183-C187 PolarHBondContact O-SG 3.34Å; L184-C187 PolarHBondContact O-N 3.03Å; C187-R190 PolarHBondContact O-N 3.02Å; C187-S191 PolarHBondContact O-N 3.25Å; C187-S191 PolarHBondContact O-OG 3.44Å |
| 188 | V | 96.3 | Very high | 92.8 | Very high | 0 Ų | 0 | 45 Ų | 45 | 0% | 0 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -65.4 | -41.3 | 178.5 | 176.7 | 0 | 0 | 0 | 0 | 111.5 | W155 L158 Y159 I178 L184 R185 R190 S191 L192 | W155-V188 HydrophobicContact CB-CG2 4.15Å; W155-V188 HydrophobicContact CE3-CB 3.99Å; W155-V188 HydrophobicContact CE3-CG1 3.85Å; L158-V188 HydrophobicContact CD2-CG1 4.34Å; L158-V188 HydrophobicContact CG-CG1 4.36Å; Y159-V188 HydrophobicContact CD2-CG2 4.35Å; Y159-V188 HydrophobicContact CG-CG2 4.44Å; I178-V188 HydrophobicContact CD1-CG2 4.4Å; L184-V188 HydrophobicContact CD1-CG2 3.78Å; L184-V188 HydrophobicContact CG-CG2 4.35Å; L184-V188 VanDerWaalsContact O-CG2 3.32Å; L184-V188 WeakPolarHBondContact O-CG2 3.25Å; L184-V188 PolarHBondContact O-N 3.4Å; R185-V188 PolarHBondContact O-N 3.24Å; V188-R190 VanDerWaalsContact C-N 3.31Å; V188-R190 PolarHBondContact O-N 3.44Å; V188-S191 WeakPolarHBondContact CA-OG 3.15Å; V188-S191 PolarHBondContact O-N 3.38Å; V188-S191 PolarHBondContact O-OG 2.95Å; V188-L192 HydrophobicContact CG1-CD1 4.16Å; V188-L192 HydrophobicContact CG1-CG 4.45Å; V188-L192 WeakPolarHBondContact O-CD1 3.21Å; V188-L192 WeakPolarHBondContact O-CG 3.45Å; V188-L192 PolarHBondContact O-N 2.93Å |
| 189 | I | 95.8 | Very high | 93 | Very high | 25 Ų | 25 | 45.7 Ų | 45.7 | 13% | 0.128 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -59.7 | -44.9 | 174.9 | -71.2 | 167.8 | 0 | 0 | 0 | 110.6 | W155 R185 A186 L192 F193 W349 W350 | W155-I189 HydrophobicContact CH2-CD1 4.15Å; W155-I189 HydrophobicContact CH2-CG1 4.21Å; W155-I189 HydrophobicContact CZ3-CD1 4.26Å; W155-I189 HydrophobicContact CZ3-CG1 3.84Å; R185-I189 HydrophobicContact CG-CD1 3.74Å; R185-I189 HydrophobicContact CG-CG1 4.5Å; R185-I189 VanDerWaalsContact CZ-CD1 3.4Å; R185-I189 WeakPolarHBondContact O-CB 3.21Å; R185-I189 VanDerWaalsContact O-CG1 3.23Å; R185-I189 WeakPolarHBondContact O-CG1 3.47Å; R185-I189 PolarHBondContact O-N 2.68Å; A186-I189 PolarHBondContact O-N 3.12Å; I189-L192 PolarHBondContact O-N 3.29Å; I189-F193 HydrophobicContact CG2-CE2 4.13Å; I189-F193 WeakPolarHBondContact O-CD2 3.48Å; I189-W349 HydrophobicContact CB-CH2 4.08Å; I189-W349 HydrophobicContact CB-CZ3 4.41Å; I189-W349 HydrophobicContact CD1-CH2 4.04Å; I189-W349 HydrophobicContact CG2-CH2 3.78Å; I189-W349 HydrophobicContact CG2-CZ3 4.21Å; I189-W350 HydrophobicContact CG2-CB 3.9Å |
| 190 | R | 94.6 | Very high | 93.1 | Very high | 24 Ų | 24 | 43.8 Ų | 43.8 | 9% | 0.091 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -62.4 | -46.4 | 176.9 | -76.2 | 178.2 | 73.9 | 150.4 | 6.9 | 112.1 | L173 A186 C187 V188 L192 F193 H194 D273 W349 W350 Y354 | L173-R190 HydrophobicContact CD1-CB 3.86Å; L173-R190 HydrophobicContact CD2-CB 3.86Å; A186-R190 WeakPolarHBondContact O-CB 3.16Å; A186-R190 WeakPolarHBondContact O-CG 3.46Å; A186-R190 PolarHBondContact O-N 3.44Å; C187-R190 PolarHBondContact O-N 3.02Å; V188-R190 VanDerWaalsContact C-N 3.31Å; V188-R190 PolarHBondContact O-N 3.44Å; R190-L192 VanDerWaalsContact C-N 3.26Å; R190-L192 PolarHBondContact O-N 3.27Å; R190-F193 PolarHBondContact O-N 2.99Å; R190-F193 VanDerWaalsContact O-N 3.16Å; R190-H194 PolarHBondContact O-CD2 2.87Å; R190-D273 IonicContact NH1-OD2 2.68Å; R190-W349 HydrophobicContact CG-CE3 4.29Å; R190-W349 HydrophobicContact CG-CZ3 4.17Å; R190-W350 HydrophobicContact CG-CB 4.46Å; R190-Y354 PolarHBondContact NH2-O 3.45Å |
| 191 | S | 95.4 | Very high | 93.4 | Very high | 0 Ų | 0 | 38.8 Ų | 38.8 | 0% | 0 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -63.4 | -33.2 | -179 | 69.7 | 0 | 0 | 0 | 0 | 112.1 | Y159 C187 V188 F193 H194 L195 | Y159-S191 VanDerWaalsContact CD2-OG 3.29Å; Y159-S191 WeakPolarHBondContact CD2-OG 3.43Å; C187-S191 PolarHBondContact O-N 3.25Å; C187-S191 PolarHBondContact O-OG 3.44Å; V188-S191 WeakPolarHBondContact CA-OG 3.15Å; V188-S191 PolarHBondContact O-N 3.38Å; V188-S191 PolarHBondContact O-OG 2.95Å; S191-F193 PolarHBondContact O-N 2.92Å; S191-H194 WeakPolarHBondContact O-CA 3.27Å; S191-H194 WeakPolarHBondContact O-CB 3.21Å; S191-H194 PolarHBondContact O-N 3.41Å; S191-L195 WeakPolarHBondContact O-CB 3.32Å; S191-L195 WeakPolarHBondContact O-CG 3.13Å; S191-L195 PolarHBondContact O-N 3.13Å |
| 192 | L | 96.2 | Very high | 93.8 | Very high | 4 Ų | 4 | 42 Ų | 42 | 2% | 0.021 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -61.1 | -28.8 | 177.1 | -72.7 | 164.6 | 0 | 0 | 0 | 112.8 | P132 L158 H162 V188 I189 R190 H194 L195 Y196 F199 | P132-L192 HydrophobicContact CB-CD1 4.05Å; P132-L192 HydrophobicContact CB-CD2 4.3Å; P132-L192 HydrophobicContact CG-CD1 4.38Å; P132-L192 HydrophobicContact CG-CD2 3.81Å; L158-L192 HydrophobicContact CD2-CD1 4.11Å; L158-L192 HydrophobicContact CG-CD1 4.44Å; H162-L192 HydrophobicContact CB-CD2 4.27Å; V188-L192 HydrophobicContact CG1-CD1 4.16Å; V188-L192 HydrophobicContact CG1-CG 4.45Å; V188-L192 WeakPolarHBondContact O-CD1 3.21Å; V188-L192 WeakPolarHBondContact O-CG 3.45Å; V188-L192 PolarHBondContact O-N 2.93Å; I189-L192 PolarHBondContact O-N 3.29Å; R190-L192 VanDerWaalsContact C-N 3.26Å; R190-L192 PolarHBondContact O-N 3.27Å; L192-H194 PolarHBondContact O-N 2.98Å; L192-L195 PolarHBondContact O-N 2.88Å; L192-Y196 WeakPolarHBondContact O-CA 3.3Å; L192-Y196 VanDerWaalsContact O-CB 3.24Å; L192-Y196 WeakPolarHBondContact O-CB 3.5Å; L192-Y196 PolarHBondContact O-N 3.48Å; L192-F199 HydrophobicContact CB-CD2 3.84Å; L192-F199 HydrophobicContact CB-CE2 4.04Å; L192-F199 HydrophobicContact CD1-CE2 4.43Å |
| 193 | F | 94.6 | Very high | 93.8 | Very high | 16 Ų | 16 | 37 Ų | 37 | 7% | 0.07 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -71.5 | -13.9 | 174 | -73 | -80.8 | 0 | 0 | 0 | 114 | I189 R190 S191 F199 S200 I203 W350 P352 | I189-F193 HydrophobicContact CG2-CE2 4.13Å; I189-F193 WeakPolarHBondContact O-CD2 3.48Å; R190-F193 PolarHBondContact O-N 2.99Å; R190-F193 VanDerWaalsContact O-N 3.16Å; S191-F193 PolarHBondContact O-N 2.92Å; F193-F199 HydrophobicContact CD1-CB 3.59Å; F193-F199 HydrophobicContact CD1-CD2 4.15Å; F193-F199 HydrophobicContact CD1-CG 4.18Å; F193-F199 HydrophobicContact CD2-CD2 4.27Å; F193-F199 HydrophobicContact CE1-CB 3.84Å; F193-F199 AromaticContact CE1-CD2 3.97Å; F193-F199 HydrophobicContact CE1-CD2 3.97Å; F193-F199 HydrophobicContact CE1-CG 4Å; F193-F199 HydrophobicContact CE2-CD2 4.05Å; F193-F199 HydrophobicContact CE2-CE2 4.47Å; F193-F199 HydrophobicContact CG-CB 4.23Å; F193-F199 HydrophobicContact CG-CD2 4.31Å; F193-F199 AromaticContact CZ-CD2 3.91Å; F193-F199 HydrophobicContact CZ-CD2 3.91Å; F193-F199 HydrophobicContact CZ-CE2 4.39Å; F193-F199 HydrophobicContact CZ-CG 4.35Å; F193-S200 PolarHBondContact O-OG 3.4Å; F193-I203 HydrophobicContact CB-CD1 3.99Å; F193-I203 HydrophobicContact CD1-CD1 3.25Å; F193-I203 HydrophobicContact CD1-CG1 4.11Å; F193-I203 HydrophobicContact CE1-CD1 4.03Å; F193-I203 HydrophobicContact CE1-CG1 4.49Å; F193-I203 HydrophobicContact CG-CD1 3.93Å; F193-W350 AromaticContact CD1-CE3 3.97Å; F193-W350 HydrophobicContact CD1-CE3 3.97Å; F193-W350 AromaticContact CD1-CZ3 3.93Å; F193-W350 HydrophobicContact CD1-CZ3 3.93Å; F193-W350 HydrophobicContact CD2-CB 4.34Å; F193-W350 HydrophobicContact CD2-CD2 4.48Å; F193-W350 AromaticContact CD2-CE3 3.74Å; F193-W350 HydrophobicContact CD2-CE3 3.74Å; F193-W350 HydrophobicContact CD2-CZ3 4.5Å; F193-W350 WeakPolarHBondContact CD2-O 3.25Å; F193-W350 HydrophobicContact CE1-CD2 4.5Å; F193-W350 AromaticContact CE1-CE3 3.46Å; F193-W350 HydrophobicContact CE1-CE3 3.46Å; F193-W350 VanDerWaalsContact CE1-CE3 3.46Å; F193-W350 HydrophobicContact CE1-CH2 4.21Å; F193-W350 AromaticContact CE1-CZ3 3.27Å; F193-W350 HydrophobicContact CE1-CZ3 3.27Å; F193-W350 HydrophobicContact CE2-CB 3.96Å; F193-W350 AromaticContact CE2-CD2 3.72Å; F193-W350 HydrophobicContact CE2-CD2 3.72Å; F193-W350 AromaticContact CE2-CE3 3.23Å; F193-W350 HydrophobicContact CE2-CE3 3.23Å; F193-W350 HydrophobicContact CE2-CG 4.06Å; F193-W350 AromaticContact CE2-CZ3 3.98Å; F193-W350 HydrophobicContact CE2-CZ3 3.98Å; F193-W350 HydrophobicContact CG-CE3 4.09Å; F193-W350 HydrophobicContact CG-CZ3 4.49Å; F193-W350 AromaticContact CZ-CD2 3.72Å; F193-W350 HydrophobicContact CZ-CD2 3.72Å; F193-W350 AromaticContact CZ-CE3 3.06Å; F193-W350 HydrophobicContact CZ-CE3 3.06Å; F193-W350 HydrophobicContact CZ-CG 4.47Å; F193-W350 HydrophobicContact CZ-CH2 4.15Å; F193-W350 AromaticContact CZ-CZ3 3.32Å; F193-W350 HydrophobicContact CZ-CZ3 3.32Å; F193-P352 HydrophobicContact CB-CB 4.48Å; F193-P352 HydrophobicContact CB-CG 4.39Å |
| 194 | H | 93.4 | Very high | 93.5 | Very high | 51 Ų | 51 | 40.2 Ų | 40.2 | 24% | 0.236 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -97.2 | -36.1 | 170.8 | -63.2 | -93.2 | 0 | 0 | 0 | 112.5 | V167 L169 R190 S191 L192 P352 | V167-H194 HydrophobicContact CG1-CB 4.39Å; L169-H194 HydrophobicContact CD2-CB 3.37Å; R190-H194 PolarHBondContact O-CD2 2.87Å; S191-H194 WeakPolarHBondContact O-CA 3.27Å; S191-H194 WeakPolarHBondContact O-CB 3.21Å; S191-H194 PolarHBondContact O-N 3.41Å; L192-H194 PolarHBondContact O-N 2.98Å; H194-P352 WeakPolarHBondContact CE1-CB 3.32Å; H194-P352 WeakPolarHBondContact NE2-CB 3.31Å |
| 195 | L | 94.8 | Very high | 93.1 | Very high | 15 Ų | 15 | 48 Ų | 48 | 8% | 0.079 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -98.4 | -24.1 | -168 | -64.6 | 170.9 | 0 | 0 | 0 | 114.1 | Y159 H162 Y163 V167 L169 S191 L192 | Y159-L195 HydrophobicContact CD2-CD1 4.49Å; Y159-L195 HydrophobicContact CE2-CD1 4.16Å; H162-L195 HydrophobicContact CB-CB 4.35Å; Y163-L195 HydrophobicContact CD2-CD1 4.25Å; Y163-L195 HydrophobicContact CD2-CD2 4.48Å; V167-L195 HydrophobicContact CB-CD2 3.97Å; V167-L195 HydrophobicContact CG1-CD2 4.11Å; V167-L195 HydrophobicContact CG2-CD2 4.16Å; L169-L195 HydrophobicContact CD1-CD1 4.1Å; L169-L195 HydrophobicContact CD1-CD2 4.26Å; L169-L195 HydrophobicContact CD1-CG 4.36Å; L169-L195 HydrophobicContact CD2-CD2 4.28Å; L169-L195 HydrophobicContact CD2-CG 4.25Å; S191-L195 WeakPolarHBondContact O-CB 3.32Å; S191-L195 WeakPolarHBondContact O-CG 3.13Å; S191-L195 PolarHBondContact O-N 3.13Å; L192-L195 PolarHBondContact O-N 2.88Å |
| 196 | Y | 95.5 | Very high | 92.5 | Very high | 29 Ų | 29 | 47.3 Ų | 47.3 | 11% | 0.114 | 24% | 0.242 | C | C | . | . | trans | -112.4 | 110.6 | -172.4 | -172.9 | -118.7 | 0 | 0 | 0 | 111.4 | P132 E133 H162 L192 P198 F199 S200 | P132-Y196 HydrophobicContact CB-CD1 3.93Å; P132-Y196 HydrophobicContact CB-CE1 3.91Å; P132-Y196 HydrophobicContact CG-CD1 3.73Å; P132-Y196 HydrophobicContact CG-CD2 4.12Å; P132-Y196 HydrophobicContact CG-CE1 3.74Å; P132-Y196 HydrophobicContact CG-CE2 4.15Å; P132-Y196 HydrophobicContact CG-CG 3.92Å; E133-Y196 VanDerWaalsContact CD-OH 3.31Å; E133-Y196 PolarHBondContact OE1-OH 3.34Å; E133-Y196 VanDerWaalsContact OE1-OH 3.04Å; E133-Y196 WeakPolarHBondContact OE2-CE1 3.47Å; E133-Y196 VanDerWaalsContact OE2-CZ 3.3Å; E133-Y196 PolarHBondContact OE2-OH 3.36Å; H162-Y196 AromaticContact CE1-CD2 3.46Å; H162-Y196 VanDerWaalsContact CE1-CD2 3.46Å; H162-Y196 WeakPolarHBondContact CE1-CD2 3.29Å; H162-Y196 AromaticContact CE1-CE2 3.63Å; H162-Y196 AromaticContact ND1-CD2 3.7Å; L192-Y196 WeakPolarHBondContact O-CA 3.3Å; L192-Y196 VanDerWaalsContact O-CB 3.24Å; L192-Y196 WeakPolarHBondContact O-CB 3.5Å; L192-Y196 PolarHBondContact O-N 3.48Å; Y196-P198 HydrophobicContact CD1-CB 4.18Å; Y196-P198 HydrophobicContact CD1-CG 4.13Å; Y196-P198 HydrophobicContact CE1-CB 3.72Å; Y196-P198 HydrophobicContact CE1-CG 3.55Å; Y196-P198 HydrophobicContact CE2-CG 4.14Å; Y196-F199 HydrophobicContact CD1-CB 4.35Å; Y196-F199 AromaticContact CD1-CD1 3.76Å; Y196-F199 HydrophobicContact CD1-CD1 3.76Å; Y196-F199 HydrophobicContact CD1-CD2 4.32Å; Y196-F199 HydrophobicContact CD1-CE1 4.07Å; Y196-F199 AromaticContact CD1-CG 3.89Å; Y196-F199 HydrophobicContact CD1-CG 3.89Å; Y196-F199 HydrophobicContact CD1-CZ 4.49Å; Y196-F199 HydrophobicContact CE1-CD1 4.1Å; Y196-F199 HydrophobicContact CE1-CE1 4.12Å; Y196-F199 WeakPolarHBondContact O-CB 3.46Å; Y196-F199 PolarHBondContact O-N 2.87Å; Y196-S200 PolarHBondContact O-N 2.82Å; Y196-S200 PolarHBondContact O-OG 2.9Å | ||
| 197 | E | 94 | Very high | 92 | Very high | 115 Ų | 115 | 51 Ų | 51 | 54% | 0.537 | 27% | 0.265 | S | S | . | . | H | α-helix | trans | -51.8 | -43.8 | -170.8 | -175 | -88.8 | -169 | 0 | 0 | 114.5 | F199 S200 L201 | E197-F199 PolarHBondContact O-N 3.24Å; E197-F199 VanDerWaalsContact O-N 3.12Å; E197-S200 PolarHBondContact O-N 2.98Å; E197-S200 VanDerWaalsContact O-N 3.14Å; E197-L201 VanDerWaalsContact CD-CD1 3.49Å; E197-L201 HydrophobicContact CG-CG 4.27Å; E197-L201 WeakPolarHBondContact O-CB 3.48Å; E197-L201 PolarHBondContact O-N 3.28Å; E197-L201 WeakPolarHBondContact OE1-CD1 3.45Å; E197-L201 WeakPolarHBondContact OE1-CG 3.45Å |
| 198 | P | 95 | Very high | 91.4 | Very high | 49 Ų | 49 | 52.7 Ų | 52.7 | 32% | 0.318 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -61 | -29 | 179.8 | -29.8 | 38 | 0 | 0 | 0 | 113.7 | Y196 R202 | Y196-P198 HydrophobicContact CD1-CB 4.18Å; Y196-P198 HydrophobicContact CD1-CG 4.13Å; Y196-P198 HydrophobicContact CE1-CB 3.72Å; Y196-P198 HydrophobicContact CE1-CG 3.55Å; Y196-P198 HydrophobicContact CE2-CG 4.14Å; P198-R202 PolarHBondContact O-N 3.16Å |
| 199 | F | 94.1 | Very high | 90.8 | Very high | 19 Ų | 19 | 54.6 Ų | 54.6 | 8% | 0.083 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -80.2 | -43.1 | 177.8 | -76.9 | 14.7 | 0 | 0 | 0 | 110.9 | P132 E133 L192 F193 Y196 E197 R202 I203 | P132-F199 HydrophobicContact CB-CE1 4.27Å; P132-F199 HydrophobicContact CB-CE2 3.93Å; P132-F199 HydrophobicContact CB-CZ 3.61Å; E133-F199 HydrophobicContact CB-CE1 4.26Å; L192-F199 HydrophobicContact CB-CD2 3.84Å; L192-F199 HydrophobicContact CB-CE2 4.04Å; L192-F199 HydrophobicContact CD1-CE2 4.43Å; F193-F199 HydrophobicContact CD1-CB 3.59Å; F193-F199 HydrophobicContact CD1-CD2 4.15Å; F193-F199 HydrophobicContact CD1-CG 4.18Å; F193-F199 HydrophobicContact CD2-CD2 4.27Å; F193-F199 HydrophobicContact CE1-CB 3.84Å; F193-F199 AromaticContact CE1-CD2 3.97Å; F193-F199 HydrophobicContact CE1-CD2 3.97Å; F193-F199 HydrophobicContact CE1-CG 4Å; F193-F199 HydrophobicContact CE2-CD2 4.05Å; F193-F199 HydrophobicContact CE2-CE2 4.47Å; F193-F199 HydrophobicContact CG-CB 4.23Å; F193-F199 HydrophobicContact CG-CD2 4.31Å; F193-F199 AromaticContact CZ-CD2 3.91Å; F193-F199 HydrophobicContact CZ-CD2 3.91Å; F193-F199 HydrophobicContact CZ-CE2 4.39Å; F193-F199 HydrophobicContact CZ-CG 4.35Å; Y196-F199 HydrophobicContact CD1-CB 4.35Å; Y196-F199 AromaticContact CD1-CD1 3.76Å; Y196-F199 HydrophobicContact CD1-CD1 3.76Å; Y196-F199 HydrophobicContact CD1-CD2 4.32Å; Y196-F199 HydrophobicContact CD1-CE1 4.07Å; Y196-F199 AromaticContact CD1-CG 3.89Å; Y196-F199 HydrophobicContact CD1-CG 3.89Å; Y196-F199 HydrophobicContact CD1-CZ 4.49Å; Y196-F199 HydrophobicContact CE1-CD1 4.1Å; Y196-F199 HydrophobicContact CE1-CE1 4.12Å; Y196-F199 WeakPolarHBondContact O-CB 3.46Å; Y196-F199 PolarHBondContact O-N 2.87Å; E197-F199 PolarHBondContact O-N 3.24Å; E197-F199 VanDerWaalsContact O-N 3.12Å; F199-R202 WeakPolarHBondContact O-CB 3.43Å; F199-R202 PolarHBondContact O-N 3.16Å; F199-I203 PolarHBondContact O-N 3.07Å |
| 200 | S | 91.3 | Very high | 90.2 | Very high | 39 Ų | 39 | 55.5 Ų | 55.5 | 27% | 0.273 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -62.3 | -43.1 | 176.5 | -51 | 0 | 0 | 0 | 0 | 111.8 | F193 Y196 E197 R202 I203 S204 | F193-S200 PolarHBondContact O-OG 3.4Å; Y196-S200 PolarHBondContact O-N 2.82Å; Y196-S200 PolarHBondContact O-OG 2.9Å; E197-S200 PolarHBondContact O-N 2.98Å; E197-S200 VanDerWaalsContact O-N 3.14Å; S200-R202 VanDerWaalsContact C-N 3.33Å; S200-R202 PolarHBondContact O-N 2.98Å; S200-I203 PolarHBondContact O-N 2.95Å; S200-S204 PolarHBondContact O-N 3.26Å |
| 201 | L | 92 | Very high | 89.4 | Confident | 71 Ų | 71 | 63.9 Ų | 63.9 | 37% | 0.372 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -60.6 | -41 | 176.2 | -80.5 | -167.8 | 0 | 0 | 0 | 112.5 | E197 I203 S204 K205 | E197-L201 VanDerWaalsContact CD-CD1 3.49Å; E197-L201 HydrophobicContact CG-CG 4.27Å; E197-L201 WeakPolarHBondContact O-CB 3.48Å; E197-L201 PolarHBondContact O-N 3.28Å; E197-L201 WeakPolarHBondContact OE1-CD1 3.45Å; E197-L201 WeakPolarHBondContact OE1-CG 3.45Å; L201-I203 PolarHBondContact O-N 3.14Å; L201-S204 WeakPolarHBondContact CA-OG 3.27Å; L201-S204 PolarHBondContact O-N 3.23Å; L201-S204 PolarHBondContact O-OG 3.11Å; L201-K205 PolarHBondContact O-N 3.24Å |
| 202 | R | 90.3 | Very high | 88.7 | Confident | 159 Ų | 159 | 68.1 Ų | 68.1 | 60% | 0.6 | 37% | 0.368 | S | S | * | . | H | α-helix | trans | -58.2 | -37.3 | 178.6 | -171.4 | -178.6 | -62.6 | 175.6 | 1.2 | 111.6 | P198 F199 S200 | P198-R202 PolarHBondContact O-N 3.16Å; F199-R202 WeakPolarHBondContact O-CB 3.43Å; F199-R202 PolarHBondContact O-N 3.16Å; S200-R202 VanDerWaalsContact C-N 3.33Å; S200-R202 PolarHBondContact O-N 2.98Å |
| 203 | I | 87.9 | Confident | 88.1 | Confident | 30 Ų | 30 | 69.9 Ų | 69.9 | 15% | 0.154 | 38% | 0.379 | C | S | . | . | H | α-helix | trans | -76 | -43 | 178.8 | -63.7 | 165.4 | 0 | 0 | 0 | 111.1 | F193 F199 S200 L201 K205 S206 W350 H351 P352 | F193-I203 HydrophobicContact CB-CD1 3.99Å; F193-I203 HydrophobicContact CD1-CD1 3.25Å; F193-I203 HydrophobicContact CD1-CG1 4.11Å; F193-I203 HydrophobicContact CE1-CD1 4.03Å; F193-I203 HydrophobicContact CE1-CG1 4.49Å; F193-I203 HydrophobicContact CG-CD1 3.93Å; F199-I203 PolarHBondContact O-N 3.07Å; S200-I203 PolarHBondContact O-N 2.95Å; L201-I203 PolarHBondContact O-N 3.14Å; I203-K205 PolarHBondContact O-N 3.27Å; I203-K205 VanDerWaalsContact O-N 3.07Å; I203-S206 VanDerWaalsContact O-CB 3.27Å; I203-S206 WeakPolarHBondContact O-CB 3.34Å; I203-S206 PolarHBondContact O-N 3.47Å; I203-S206 PolarHBondContact O-OG 3.08Å; I203-W350 HydrophobicContact CD1-CZ3 4.43Å; I203-H351 WeakPolarHBondContact CG2-NE2 3.33Å; I203-P352 HydrophobicContact CD1-CG 3.59Å |
| 204 | S | 85.5 | Confident | 87.5 | Confident | 83 Ų | 83 | 70.3 Ų | 70.3 | 58% | 0.58 | 38% | 0.383 | S | S | * | . | H | α-helix | trans | -57.3 | -27 | -176.6 | 71.4 | 0 | 0 | 0 | 0 | 114.2 | S200 L201 S206 | S200-S204 PolarHBondContact O-N 3.26Å; L201-S204 WeakPolarHBondContact CA-OG 3.27Å; L201-S204 PolarHBondContact O-N 3.23Å; L201-S204 PolarHBondContact O-OG 3.11Å; S204-S206 VanDerWaalsContact C-N 3.28Å; S204-S206 PolarHBondContact O-N 2.81Å |
| 205 | K | 84.9 | Confident | 87 | Confident | 164 Ų | 164 | 72.8 Ų | 72.8 | 71% | 0.713 | 40% | 0.402 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -81.7 | -2 | 179.5 | -65.7 | 177.6 | -178.4 | -177.7 | 0 | 113.9 | L201 I203 | L201-K205 PolarHBondContact O-N 3.24Å; I203-K205 PolarHBondContact O-N 3.27Å; I203-K205 VanDerWaalsContact O-N 3.07Å |
| 206 | S | 81.5 | Confident | 86.6 | Confident | 77 Ų | 77 | 75.8 Ų | 75.8 | 54% | 0.538 | 42% | 0.421 | S | S | . | . | trans | -74.5 | 125.4 | -177.4 | -56.9 | 0 | 0 | 0 | 0 | 110.6 | I203 S204 | I203-S206 VanDerWaalsContact O-CB 3.27Å; I203-S206 WeakPolarHBondContact O-CB 3.34Å; I203-S206 PolarHBondContact O-N 3.47Å; I203-S206 PolarHBondContact O-OG 3.08Å; S204-S206 VanDerWaalsContact C-N 3.28Å; S204-S206 PolarHBondContact O-N 2.81Å | ||
| 207 | P | 85.1 | Confident | 86.2 | Confident | 81 Ų | 81 | 74.4 Ų | 74.4 | 53% | 0.526 | 42% | 0.416 | S | S | . | . | trans | -66.8 | 156.3 | 179.8 | 29 | -35.5 | 0 | 0 | 0 | 111.6 | L209 | P207-L209 WeakPolarHBondContact CB-O 3.38Å; P207-L209 WeakPolarHBondContact CG-O 3.3Å; P207-L209 PolarHBondContact O-N 2.89Å | ||
| 208 | A | 82.4 | Confident | 86 | Confident | 56 Ų | 56 | 72.1 Ų | 72.1 | 46% | 0.463 | 41% | 0.407 | S | S | . | . | S | Bend | trans | -66.4 | -24 | 178.9 | 0 | 0 | 0 | 0 | 0 | 113.3 | S343 V344 | A208-S343 CarbonylContact O-C 3.57Å; A208-S343 WeakPolarHBondContact O-CA 3.24Å; A208-S343 VanDerWaalsContact O-CB 3.28Å; A208-S343 WeakPolarHBondContact O-CB 3.28Å; A208-V344 PolarHBondContact O-N 2.97Å; A208-V344 VanDerWaalsContact O-O 3.12Å |
| 209 | L | 82.3 | Confident | 85.8 | Confident | 40 Ų | 40 | 72.4 Ų | 72.4 | 21% | 0.209 | 41% | 0.406 | C | S | . | . | S | Bend | trans | -127.5 | 135.6 | 171.9 | -75.3 | 162.9 | 0 | 0 | 0 | 107.9 | P207 H311 V341 V344 | P207-L209 WeakPolarHBondContact CB-O 3.38Å; P207-L209 WeakPolarHBondContact CG-O 3.3Å; P207-L209 PolarHBondContact O-N 2.89Å; L209-H311 HydrophobicContact CD1-CB 4.46Å; L209-H311 VanDerWaalsContact CD1-ND1 3.32Å; L209-H311 WeakPolarHBondContact CD1-ND1 3.46Å; L209-H311 HydrophobicContact CD2-CB 4.44Å; L209-V341 HydrophobicContact CD2-CG1 4.36Å; L209-V344 HydrophobicContact CD2-CB 3.99Å; L209-V344 HydrophobicContact CD2-CG2 3.68Å |
| 210 | P | 82.9 | Confident | 85.7 | Confident | 44 Ų | 44 | 71.7 Ų | 71.7 | 29% | 0.286 | 40% | 0.403 | S | S | . | . | trans | -69 | 144.7 | 175.1 | 32.3 | -35.5 | 0 | 0 | 0 | 109.7 | S212 P214 I302 | P210-S212 WeakPolarHBondContact CB-O 3.29Å; P210-S212 PolarHBondContact O-N 3.19Å; P210-P214 HydrophobicContact CB-CG 4.33Å; P210-P214 HydrophobicContact CG-CG 4.16Å; P210-I302 HydrophobicContact CG-CD1 3.48Å; P210-I302 VanDerWaalsContact CG-CD1 3.48Å | ||
| 211 | E | 79.1 | Confident | 85.8 | Confident | 199 Ų | 199 | 74.6 Ų | 74.6 | 93% | 0.93 | 41% | 0.411 | S | S | * | . | S | Bend | trans | -60.6 | -26.1 | 179.5 | -65.8 | 178.3 | 175.2 | 0 | 0 | 112.9 | ||
| 212 | S | 80.9 | Confident | 86 | Confident | 90 Ų | 90 | 71.2 Ų | 71.2 | 63% | 0.629 | 39% | 0.393 | S | S | * | . | S | Bend | trans | -141.8 | 159.8 | 175.1 | 61.3 | 0 | 0 | 0 | 0 | 110.5 | P210 P214 | P210-S212 WeakPolarHBondContact CB-O 3.29Å; P210-S212 PolarHBondContact O-N 3.19Å; S212-P214 WeakPolarHBondContact O-CD 3.21Å |
| 213 | T | 83.1 | Confident | 86.1 | Confident | 40 Ų | 40 | 70.2 Ų | 70.2 | 25% | 0.245 | 39% | 0.393 | C | S | . | . | trans | -63.8 | 120.6 | 177.2 | -63.7 | 0 | 0 | 0 | 0 | 110.3 | T215 F300 I302 | T213-T215 PolarHBondContact O-N 3.26Å; T213-F300 HydrophobicContact CG2-CB 4.41Å; T213-F300 HydrophobicContact CG2-CD1 4.11Å; T213-F300 HydrophobicContact CG2-CD2 4.24Å; T213-F300 HydrophobicContact CG2-CE1 4.46Å; T213-F300 HydrophobicContact CG2-CG 3.99Å; T213-F300 WeakPolarHBondContact CG2-O 3.35Å; T213-I302 HydrophobicContact CG2-CG1 4.44Å; T213-I302 PolarHBondContact OG1-N 2.9Å | ||
| 214 | P | 82.5 | Confident | 86.4 | Confident | 25 Ų | 25 | 71.2 Ų | 71.2 | 16% | 0.162 | 40% | 0.399 | C | S | . | . | trans | -64.2 | 124 | 176.2 | -20.8 | 31.8 | 0 | 0 | 0 | 112 | P210 S212 F300 L346 | P210-P214 HydrophobicContact CB-CG 4.33Å; P210-P214 HydrophobicContact CG-CG 4.16Å; S212-P214 WeakPolarHBondContact O-CD 3.21Å; P214-F300 HydrophobicContact CB-CE1 4.05Å; P214-F300 HydrophobicContact CG-CE1 3.93Å; P214-F300 WeakPolarHBondContact O-CD1 3.38Å; P214-L346 HydrophobicContact CB-CD2 4.01Å; P214-L346 HydrophobicContact CG-CD2 4.48Å | ||
| 215 | T | 82.6 | Confident | 86.8 | Confident | 103 Ų | 103 | 69.2 Ų | 69.2 | 63% | 0.632 | 38% | 0.38 | S | S | * | . | trans | -89.6 | -6.3 | 176 | 54.3 | 0 | 0 | 0 | 0 | 113.2 | T213 L217 L218 | T213-T215 PolarHBondContact O-N 3.26Å; T215-L217 PolarHBondContact O-N 3.04Å; T215-L218 HydrophobicContact CG2-CD1 4.4Å; T215-L218 WeakPolarHBondContact O-CB 3.46Å; T215-L218 WeakPolarHBondContact O-CG 3.37Å; T215-L218 PolarHBondContact O-N 3.26Å; T215-L218 VanDerWaalsContact O-N 3.17Å | ||
| 216 | T | 85.6 | Confident | 87.3 | Confident | 79 Ų | 79 | 64.4 Ų | 64.4 | 49% | 0.485 | 36% | 0.357 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -65.8 | -17.5 | -174.6 | 52.1 | 0 | 0 | 0 | 0 | 114.7 | L346 | T216-L346 WeakPolarHBondContact OG1-CD2 3.4Š|
| 217 | L | 87.8 | Confident | 87.9 | Confident | 0 Ų | 0 | 63 Ų | 63 | 0% | 0 | 35% | 0.345 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -88.9 | -14.1 | 178.3 | -68.4 | -179.2 | 0 | 0 | 0 | 113.7 | T215 N219 S220 F245 C277 L279 L297 F300 L346 | T215-L217 PolarHBondContact O-N 3.04Å; L217-N219 PolarHBondContact O-N 2.78Å; L217-S220 WeakPolarHBondContact O-CB 3.2Å; L217-S220 PolarHBondContact O-N 3.01Å; L217-S220 PolarHBondContact O-OG 3.21Å; L217-F245 HydrophobicContact CD1-CD2 4.08Å; L217-F245 HydrophobicContact CD1-CE2 4.03Å; L217-F245 HydrophobicContact CD2-CB 4.08Å; L217-F245 HydrophobicContact CD2-CD2 3.76Å; L217-F245 HydrophobicContact CD2-CG 4.06Å; L217-F245 HydrophobicContact CG-CD2 4.48Å; L217-C277 WeakPolarHBondContact CD2-SG 3.19Å; L217-L279 HydrophobicContact CD1-CB 3.99Å; L217-L279 HydrophobicContact CD1-CD1 4.31Å; L217-L279 HydrophobicContact CD1-CD2 4.04Å; L217-L279 HydrophobicContact CD1-CG 4.33Å; L217-L297 HydrophobicContact CB-CD2 3.57Å; L217-L297 HydrophobicContact CD1-CD2 4.3Å; L217-F300 HydrophobicContact CD1-CD1 4.03Å; L217-F300 HydrophobicContact CD1-CE1 4.05Å; L217-L346 HydrophobicContact CD1-CD1 3.99Å; L217-L346 HydrophobicContact CD2-CD1 3.76Å; L217-L346 HydrophobicContact CG-CD1 4.02Å; L217-L346 HydrophobicContact CG-CD2 4.41Å |
| 218 | L | 89.7 | Confident | 88.3 | Confident | 67 Ų | 67 | 63.4 Ų | 63.4 | 35% | 0.351 | 34% | 0.339 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -60.1 | 140 | -176.9 | -62.7 | 178.4 | 0 | 0 | 0 | 110.5 | T215 S220 F300 | T215-L218 HydrophobicContact CG2-CD1 4.4Å; T215-L218 WeakPolarHBondContact O-CB 3.46Å; T215-L218 WeakPolarHBondContact O-CG 3.37Å; T215-L218 PolarHBondContact O-N 3.26Å; T215-L218 VanDerWaalsContact O-N 3.17Å; L218-S220 PolarHBondContact O-N 3.48Å; L218-F300 HydrophobicContact CD2-CB 4.5Å |
| 219 | N | 89.7 | Confident | 88.8 | Confident | 55 Ų | 55 | 66.4 Ų | 66.4 | 29% | 0.294 | 34% | 0.341 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 61.6 | 17.9 | -173.2 | -56.9 | -43.7 | 0 | 0 | 0 | 115.2 | L217 L297 P321 L322 | L217-N219 PolarHBondContact O-N 2.78Å; N219-L297 WeakPolarHBondContact CA-O 3.39Å; N219-L297 PolarHBondContact N-O 3.45Å; N219-P321 HydrophobicContact CB-CB 4.38Å; N219-L322 PolarHBondContact OD1-N 2.8Å |
| 220 | S | 92.5 | Very high | 89.1 | Confident | 3 Ų | 3 | 66.4 Ų | 66.4 | 2% | 0.021 | 34% | 0.343 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -89.9 | 142.5 | 171.4 | -55.8 | 0 | 0 | 0 | 0 | 111.1 | L217 L218 K246 L297 | L217-S220 WeakPolarHBondContact O-CB 3.2Å; L217-S220 PolarHBondContact O-N 3.01Å; L217-S220 PolarHBondContact O-OG 3.21Å; L218-S220 PolarHBondContact O-N 3.48Å; S220-K246 WeakPolarHBondContact CA-O 3.49Å; S220-L297 PolarHBondContact O-N 3.06Å |
| 221 | K | 94.2 | Very high | 88.8 | Confident | 101 Ų | 101 | 69.4 Ų | 69.4 | 44% | 0.439 | 37% | 0.365 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -83.6 | 129.2 | 178.2 | -167.6 | 176.7 | -172.8 | 177.8 | 0 | 109.9 | F223 F245 K246 G294 | K221-F223 PolarHBondContact O-N 2.72Å; K221-F245 CarbonylContact O-C 3.57Å; K221-F245 VanDerWaalsContact O-CA 3.32Å; K221-F245 WeakPolarHBondContact O-CA 3.4Å; K221-K246 PolarHBondContact N-O 3.49Å; K221-K246 PolarHBondContact O-N 2.86Å; K221-G294 WeakPolarHBondContact CE-O 3.36Å |
| 222 | C | 94.9 | Very high | 88.2 | Confident | 0 Ų | 0 | 62.5 Ų | 62.5 | 0% | 0 | 35% | 0.347 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -71.8 | 112.1 | 170.5 | -173.3 | 0 | 0 | 0 | 0 | 108.6 | F245 V292 G294 L295 F317 | C222-F245 HydrophobicContact CB-CD1 4.19Å; C222-F245 HydrophobicContact CB-CE1 3.86Å; C222-V292 WeakPolarHBondContact CB-O 3.4Å; C222-G294 PolarHBondContact O-N 3.12Å; C222-L295 PolarHBondContact N-O 3.16Å; C222-F317 HydrophobicContact CB-CD1 4.46Å; C222-F317 HydrophobicContact CB-CE1 3.95Å |
| 223 | F | 92.8 | Very high | 87.2 | Confident | 137 Ų | 137 | 65.5 Ų | 65.5 | 60% | 0.601 | 36% | 0.362 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -89.7 | -40 | -178.4 | -170 | -100.4 | 0 | 0 | 0 | 111.8 | K221 K244 | K221-F223 PolarHBondContact O-N 2.72Å; F223-K244 PolarHBondContact N-O 2.92Å |
| 224 | L | 93.9 | Very high | 86.5 | Confident | 51 Ų | 51 | 70.7 Ų | 70.7 | 27% | 0.267 | 38% | 0.377 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -145 | 143.4 | -178 | -172 | 69 | 0 | 0 | 0 | 109.5 | W226 K244 M293 L357 | L224-W226 HydrophobicContact CB-CE3 4.45Å; L224-W226 HydrophobicContact CB-CZ3 4.3Å; L224-W226 HydrophobicContact CD2-CE3 3.78Å; L224-W226 HydrophobicContact CD2-CZ3 3.84Å; L224-W226 HydrophobicContact CG-CE3 3.81Å; L224-W226 HydrophobicContact CG-CZ3 4.06Å; L224-K244 HydrophobicContact CB-CB 4.06Å; L224-K244 PolarHBondContact N-O 3.31Å; L224-K244 PolarHBondContact O-N 3.27Å; L224-M293 HydrophobicContact CD1-SD 4.21Å; L224-L357 HydrophobicContact CD2-CD1 3.97Å; L224-L357 HydrophobicContact CD2-CD2 4.16Å |
| 225 | F | 93.9 | Very high | 85.8 | Confident | 41 Ų | 41 | 76.1 Ų | 76.1 | 18% | 0.18 | 41% | 0.412 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -133.7 | 140 | 170.8 | 162.5 | -100.2 | 0 | 0 | 0 | 110 | V227 F241 N242 F243 I289 M293 | F225-V227 HydrophobicContact CE1-CG2 3.84Å; F225-V227 HydrophobicContact CE2-CG2 3.96Å; F225-V227 HydrophobicContact CZ-CG2 3.19Å; F225-F241 HydrophobicContact CE2-CB 4.21Å; F225-F241 AromaticContact CE2-CD1 3.9Å; F225-F241 HydrophobicContact CE2-CD1 3.9Å; F225-F241 AromaticContact CZ-CD1 3.82Å; F225-F241 HydrophobicContact CZ-CD1 3.82Å; F225-F241 HydrophobicContact CZ-CE1 4.41Å; F225-N242 VanDerWaalsContact CA-O 3.27Å; F225-N242 WeakPolarHBondContact CA-O 3.33Å; F225-N242 WeakPolarHBondContact CD2-O 3.36Å; F225-F243 HydrophobicContact CB-CD1 4.21Å; F225-F243 AromaticContact CD2-CD1 3.43Å; F225-F243 HydrophobicContact CD2-CD1 3.43Å; F225-F243 VanDerWaalsContact CD2-CD1 3.43Å; F225-F243 HydrophobicContact CD2-CD2 4.33Å; F225-F243 AromaticContact CD2-CE1 3.25Å; F225-F243 HydrophobicContact CD2-CE1 3.25Å; F225-F243 HydrophobicContact CD2-CE2 4.19Å; F225-F243 AromaticContact CD2-CG 3.98Å; F225-F243 HydrophobicContact CD2-CG 3.98Å; F225-F243 AromaticContact CD2-CZ 3.66Å; F225-F243 HydrophobicContact CD2-CZ 3.66Å; F225-F243 HydrophobicContact CE2-CD1 4.21Å; F225-F243 AromaticContact CE2-CE1 3.61Å; F225-F243 HydrophobicContact CE2-CE1 3.61Å; F225-F243 HydrophobicContact CE2-CE2 4.09Å; F225-F243 AromaticContact CE2-CZ 3.54Å; F225-F243 HydrophobicContact CE2-CZ 3.54Å; F225-F243 HydrophobicContact CG-CD1 4.13Å; F225-F243 HydrophobicContact CG-CE1 4.04Å; F225-I289 HydrophobicContact CD1-CD1 4.27Å; F225-I289 HydrophobicContact CD2-CD1 4.07Å; F225-I289 HydrophobicContact CE1-CD1 3.6Å; F225-I289 HydrophobicContact CE1-CG1 3.84Å; F225-I289 HydrophobicContact CE2-CD1 3.39Å; F225-I289 HydrophobicContact CE2-CG1 4.39Å; F225-I289 HydrophobicContact CG-CD1 4.46Å; F225-I289 HydrophobicContact CZ-CD1 3.1Å; F225-I289 HydrophobicContact CZ-CG1 3.62Å; F225-M293 HydrophobicContact CB-CG 4.2Å |
| 226 | W | 94.8 | Very high | 85.6 | Confident | 63 Ų | 63 | 77 Ų | 77 | 24% | 0.239 | 41% | 0.409 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -151.4 | 155.6 | 173.8 | 67.4 | 99 | 0 | 0 | 0 | 111.4 | L224 N242 K244 V278 P355 | L224-W226 HydrophobicContact CB-CE3 4.45Å; L224-W226 HydrophobicContact CB-CZ3 4.3Å; L224-W226 HydrophobicContact CD2-CE3 3.78Å; L224-W226 HydrophobicContact CD2-CZ3 3.84Å; L224-W226 HydrophobicContact CG-CE3 3.81Å; L224-W226 HydrophobicContact CG-CZ3 4.06Å; W226-N242 HydrophobicContact CD2-CB 3.6Å; W226-N242 HydrophobicContact CE3-CB 3.99Å; W226-N242 HydrophobicContact CG-CB 4.18Å; W226-N242 HydrophobicContact CH2-CB 3.7Å; W226-N242 HydrophobicContact CZ2-CB 3.26Å; W226-N242 HydrophobicContact CZ3-CB 4.04Å; W226-N242 PolarHBondContact N-O 2.92Å; W226-N242 PolarHBondContact NE1-ND2 3.23Å; W226-N242 PolarHBondContact O-N 2.92Å; W226-K244 HydrophobicContact CH2-CB 4.45Å; W226-K244 HydrophobicContact CZ3-CB 4.02Å; W226-V278 HydrophobicContact CH2-CG1 4.1Å; W226-V278 HydrophobicContact CH2-CG2 4.17Å; W226-V278 HydrophobicContact CZ2-CG1 4.49Å; W226-P355 HydrophobicContact CH2-CG 3.83Å; W226-P355 HydrophobicContact CZ2-CB 4.17Å; W226-P355 HydrophobicContact CZ2-CG 3.47Å; W226-P355 VanDerWaalsContact CZ2-CG 3.47Å |
| 227 | V | 94.8 | Very high | 85.6 | Confident | 47 Ų | 47 | 75 Ų | 75 | 29% | 0.285 | 40% | 0.401 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -117.1 | 137.3 | 175.7 | -171.4 | 0 | 0 | 0 | 0 | 108.9 | F225 W239 E240 F241 Y286 | F225-V227 HydrophobicContact CE1-CG2 3.84Å; F225-V227 HydrophobicContact CE2-CG2 3.96Å; F225-V227 HydrophobicContact CZ-CG2 3.19Å; V227-W239 HydrophobicContact CG1-CE3 3.98Å; V227-E240 WeakPolarHBondContact CA-O 3.48Å; V227-F241 HydrophobicContact CG1-CD1 4.5Å; V227-F241 HydrophobicContact CG1-CE1 4.27Å; V227-F241 HydrophobicContact CG1-CE2 4.45Å; V227-F241 HydrophobicContact CG1-CZ 4.23Å; V227-F241 HydrophobicContact CG2-CD1 3.71Å; V227-F241 HydrophobicContact CG2-CE1 3.73Å; V227-F241 HydrophobicContact CG2-CG 4.44Å; V227-F241 HydrophobicContact CG2-CZ 4.48Å; V227-Y286 HydrophobicContact CG1-CD2 4.33Å; V227-Y286 HydrophobicContact CG1-CE2 4.08Å |
| 228 | K | 92.9 | Very high | 85.8 | Confident | 91 Ų | 91 | 76.2 Ų | 76.2 | 40% | 0.396 | 41% | 0.407 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -125.4 | 138.5 | 168.7 | 58.9 | 177.4 | 154.2 | 136.9 | 0 | 110.4 | E240 | K228-E240 HydrophobicContact CD-CB 4.45Å; K228-E240 WeakPolarHBondContact CD-OE2 3.44Å; K228-E240 WeakPolarHBondContact CE-OE2 3.32Å; K228-E240 HydrophobicContact CG-CB 3.72Å; K228-E240 WeakPolarHBondContact CG-OE2 3.44Å; K228-E240 PolarHBondContact N-O 3.26Å; K228-E240 IonicContact NZ-OE1 3.89Å; K228-E240 IonicContact NZ-OE2 3.74Å; K228-E240 PolarHBondContact NZ-OE2 3.32Å; K228-E240 PolarHBondContact O-N 2.67Å |
| 229 | K | 92.9 | Very high | 86.1 | Confident | 119 Ų | 119 | 75.9 Ų | 75.9 | 52% | 0.517 | 40% | 0.401 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -76.7 | 124.6 | 167 | -170.2 | -179.1 | -178.5 | -176 | 0 | 107.9 | W239 | K229-W239 HydrophobicContact CB-CD2 4.42Å; K229-W239 HydrophobicContact CB-CE3 3.88Å; K229-W239 HydrophobicContact CB-CH2 3.96Å; K229-W239 HydrophobicContact CB-CZ2 4.44Å; K229-W239 HydrophobicContact CB-CZ3 3.64Å; K229-W239 HydrophobicContact CD-CH2 3.96Å; K229-W239 HydrophobicContact CD-CZ2 3.99Å; K229-W239 HydrophobicContact CG-CD2 4.35Å; K229-W239 HydrophobicContact CG-CE3 4.27Å; K229-W239 HydrophobicContact CG-CH2 3.99Å; K229-W239 HydrophobicContact CG-CZ2 4Å; K229-W239 HydrophobicContact CG-CZ3 4.12Å |
| 230 | V | 89.4 | Confident | 86.4 | Confident | 40 Ų | 40 | 74.6 Ų | 74.6 | 24% | 0.242 | 39% | 0.393 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -91.3 | 109.8 | 174.5 | -175.2 | 0 | 0 | 0 | 0 | 107.5 | L238 E240 | V230-L238 HydrophobicContact CB-CB 4.09Å; V230-L238 PolarHBondContact N-O 3.16Å; V230-E240 HydrophobicContact CG2-CB 4.16Å; V230-E240 HydrophobicContact CG2-CG 3.43Å; V230-E240 VanDerWaalsContact CG2-CG 3.43Å; V230-E240 WeakPolarHBondContact CG2-OE2 3.46Å |
| 231 | S | 75.9 | Confident | 86.6 | Confident | 107 Ų | 107 | 74.5 Ų | 74.5 | 75% | 0.748 | 39% | 0.392 | S | S | * | . | trans | -91.7 | 106.8 | 170.2 | -55.4 | 0 | 0 | 0 | 0 | 107.1 | ||||
| 232 | G | 67 | Low | 86.7 | Confident | 53 Ų | 53 | 69.8 Ų | 69.8 | 55% | 0.546 | 37% | 0.372 | S | S | . | . | trans | -111.1 | -175 | 178.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | R234 | G232-R234 PolarHBondContact O-N 3.2Š| ||
| 233 | T | 60.1 | Low | 86.8 | Confident | 154 Ų | 154 | 69.8 Ų | 69.8 | 95% | 0.945 | 37% | 0.372 | S | S | * | . | S | Bend | trans | -71.2 | -10.1 | 170.2 | 52.2 | 0 | 0 | 0 | 0 | 113.1 | ||
| 234 | R | 68.6 | Low | 86.9 | Confident | 149 Ų | 149 | 63.8 Ų | 63.8 | 56% | 0.562 | 35% | 0.346 | S | S | * | . | S | Bend | trans | -79.6 | 146.7 | 176 | -69.4 | -172.1 | 175.1 | -166.7 | -1.7 | 110.7 | G232 E236 | G232-R234 PolarHBondContact O-N 3.2Å; R234-E236 PolarHBondContact O-N 3.4Å |
| 235 | P | 68.5 | Low | 87 | Confident | 138 Ų | 138 | 61.4 Ų | 61.4 | 90% | 0.896 | 33% | 0.333 | S | S | * | . | S | Bend | trans | -66.6 | -26.2 | 175.5 | 24.9 | -31.7 | 0 | 0 | 0 | 112.8 | ||
| 236 | E | 77.7 | Confident | 86.9 | Confident | 122 Ų | 122 | 64 Ų | 64 | 57% | 0.57 | 34% | 0.344 | S | S | * | . | S | Bend | trans | -82.8 | 125.6 | -179.7 | -67.9 | 166.3 | -174.4 | 0 | 0 | 111.4 | R234 L238 | R234-E236 PolarHBondContact O-N 3.4Å; E236-L238 PolarHBondContact O-N 2.91Å |
| 237 | A | 85.3 | Confident | 86.7 | Confident | 38 Ų | 38 | 64.7 Ų | 64.7 | 31% | 0.314 | 35% | 0.349 | S | S | . | . | P | Polyproline II helix | trans | -74.1 | 118.5 | 174.5 | 0 | 0 | 0 | 0 | 0 | 110.5 | ||
| 238 | L | 93.1 | Very high | 85.9 | Confident | 24 Ų | 24 | 66.3 Ų | 66.3 | 13% | 0.126 | 35% | 0.353 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -94.3 | 155.5 | 174.4 | -61.6 | 176.4 | 0 | 0 | 0 | 110.9 | V230 E236 T282 L284 | V230-L238 HydrophobicContact CB-CB 4.09Å; V230-L238 PolarHBondContact N-O 3.16Å; E236-L238 PolarHBondContact O-N 2.91Å; L238-T282 HydrophobicContact CB-CG2 3.97Å; L238-T282 HydrophobicContact CD1-CG2 4.18Å; L238-T282 HydrophobicContact CG-CG2 4.5Å; L238-L284 HydrophobicContact CD2-CD2 3.57Å |
| 239 | W | 95.3 | Very high | 84.6 | Confident | 61 Ų | 61 | 68.9 Ų | 68.9 | 23% | 0.231 | 37% | 0.367 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -126.9 | 127.1 | 179.5 | -63.4 | 86.4 | 0 | 0 | 0 | 110.6 | V227 K229 F241 T282 T283 Y286 | V227-W239 HydrophobicContact CG1-CE3 3.98Å; K229-W239 HydrophobicContact CB-CD2 4.42Å; K229-W239 HydrophobicContact CB-CE3 3.88Å; K229-W239 HydrophobicContact CB-CH2 3.96Å; K229-W239 HydrophobicContact CB-CZ2 4.44Å; K229-W239 HydrophobicContact CB-CZ3 3.64Å; K229-W239 HydrophobicContact CD-CH2 3.96Å; K229-W239 HydrophobicContact CD-CZ2 3.99Å; K229-W239 HydrophobicContact CG-CD2 4.35Å; K229-W239 HydrophobicContact CG-CE3 4.27Å; K229-W239 HydrophobicContact CG-CH2 3.99Å; K229-W239 HydrophobicContact CG-CZ2 4Å; K229-W239 HydrophobicContact CG-CZ3 4.12Å; W239-F241 HydrophobicContact CB-CE2 3.87Å; W239-T282 CarbonylContact O-C 3.51Å; W239-T282 VanDerWaalsContact O-CA 3.27Å; W239-T282 WeakPolarHBondContact O-CA 3.32Å; W239-T283 PolarHBondContact N-O 3.4Å; W239-T283 PolarHBondContact O-N 3.08Å; W239-T283 PolarHBondContact O-OG1 3.32Å; W239-Y286 AromaticContact CD2-CD2 3.84Å; W239-Y286 HydrophobicContact CD2-CD2 3.84Å; W239-Y286 HydrophobicContact CD2-CG 4.32Å; W239-Y286 AromaticContact CE3-CD2 3.52Å; W239-Y286 HydrophobicContact CE3-CD2 3.52Å; W239-Y286 HydrophobicContact CE3-CE2 4.32Å; W239-Y286 HydrophobicContact CE3-CG 4.36Å; W239-Y286 HydrophobicContact CG-CD2 4.49Å; W239-Y286 HydrophobicContact CH2-CD2 4.13Å; W239-Y286 HydrophobicContact CH2-CG 4.46Å; W239-Y286 HydrophobicContact CZ2-CD2 4.45Å; W239-Y286 HydrophobicContact CZ2-CG 4.47Å; W239-Y286 AromaticContact CZ3-CD2 3.66Å; W239-Y286 HydrophobicContact CZ3-CD2 3.66Å; W239-Y286 HydrophobicContact CZ3-CE2 4.26Å; W239-Y286 HydrophobicContact CZ3-CG 4.41Å |
| 240 | E | 95.8 | Very high | 82.9 | Confident | 27 Ų | 27 | 71.2 Ų | 71.2 | 13% | 0.126 | 38% | 0.379 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -105.1 | 113.9 | 178.3 | -75.7 | 171.1 | 146.6 | 0 | 0 | 110.5 | V227 K228 V230 N242 Q280 V281 T282 | V227-E240 WeakPolarHBondContact CA-O 3.48Å; K228-E240 HydrophobicContact CD-CB 4.45Å; K228-E240 WeakPolarHBondContact CD-OE2 3.44Å; K228-E240 WeakPolarHBondContact CE-OE2 3.32Å; K228-E240 HydrophobicContact CG-CB 3.72Å; K228-E240 WeakPolarHBondContact CG-OE2 3.44Å; K228-E240 PolarHBondContact N-O 3.26Å; K228-E240 IonicContact NZ-OE1 3.89Å; K228-E240 IonicContact NZ-OE2 3.74Å; K228-E240 PolarHBondContact NZ-OE2 3.32Å; K228-E240 PolarHBondContact O-N 2.67Å; V230-E240 HydrophobicContact CG2-CB 4.16Å; V230-E240 HydrophobicContact CG2-CG 3.43Å; V230-E240 VanDerWaalsContact CG2-CG 3.43Å; V230-E240 WeakPolarHBondContact CG2-OE2 3.46Å; E240-N242 PolarHBondContact O-ND2 2.99Å; E240-N242 VanDerWaalsContact O-ND2 3.1Å; E240-Q280 HydrophobicContact CB-CG 4.39Å; E240-Q280 HydrophobicContact CG-CG 4.35Å; E240-Q280 PolarHBondContact OE1-NE2 3.22Å; E240-V281 WeakPolarHBondContact CA-O 3.34Å; E240-T282 HydrophobicContact CG-CG2 4.15Å; E240-T282 WeakPolarHBondContact CG-OG1 3.22Å |
| 241 | F | 97 | Very high | 80.9 | Confident | 1 Ų | 1 | 78.9 Ų | 78.9 | 0% | 0.004 | 41% | 0.41 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -91.5 | 117.8 | 172.3 | -67.4 | -98.1 | 0 | 0 | 0 | 108.7 | F225 V227 W239 F243 Q280 V281 T283 Y286 I287 I289 L338 | F225-F241 HydrophobicContact CE2-CB 4.21Å; F225-F241 AromaticContact CE2-CD1 3.9Å; F225-F241 HydrophobicContact CE2-CD1 3.9Å; F225-F241 AromaticContact CZ-CD1 3.82Å; F225-F241 HydrophobicContact CZ-CD1 3.82Å; F225-F241 HydrophobicContact CZ-CE1 4.41Å; V227-F241 HydrophobicContact CG1-CD1 4.5Å; V227-F241 HydrophobicContact CG1-CE1 4.27Å; V227-F241 HydrophobicContact CG1-CE2 4.45Å; V227-F241 HydrophobicContact CG1-CZ 4.23Å; V227-F241 HydrophobicContact CG2-CD1 3.71Å; V227-F241 HydrophobicContact CG2-CE1 3.73Å; V227-F241 HydrophobicContact CG2-CG 4.44Å; V227-F241 HydrophobicContact CG2-CZ 4.48Å; W239-F241 HydrophobicContact CB-CE2 3.87Å; F241-F243 HydrophobicContact CB-CE2 3.84Å; F241-F243 HydrophobicContact CB-CZ 4.34Å; F241-Q280 WeakPolarHBondContact O-CA 3.21Å; F241-V281 HydrophobicContact CB-CB 4.48Å; F241-V281 PolarHBondContact N-O 2.86Å; F241-V281 PolarHBondContact O-N 3.43Å; F241-T283 HydrophobicContact CD2-CG2 4.22Å; F241-T283 HydrophobicContact CE2-CG2 4.27Å; F241-T283 VanDerWaalsContact CE2-OG1 3.28Å; F241-T283 WeakPolarHBondContact CE2-OG1 3.32Å; F241-Y286 HydrophobicContact CZ-CD2 4.45Å; F241-I287 VanDerWaalsContact CE1-O 3.28Å; F241-I287 WeakPolarHBondContact CE1-O 3.34Å; F241-I287 HydrophobicContact CZ-CB 3.99Å; F241-I287 WeakPolarHBondContact CZ-O 3.27Å; F241-I289 HydrophobicContact CD1-CD1 4.24Å; F241-I289 HydrophobicContact CD1-CG2 4.42Å; F241-I289 HydrophobicContact CE1-CG2 4.07Å; F241-L338 HydrophobicContact CB-CD1 3.97Å; F241-L338 HydrophobicContact CD1-CD2 3.89Å; F241-L338 HydrophobicContact CD2-CD1 4.47Å; F241-L338 HydrophobicContact CD2-CD2 4.08Å; F241-L338 HydrophobicContact CE1-CD2 4.05Å; F241-L338 HydrophobicContact CE2-CD2 4.24Å; F241-L338 HydrophobicContact CG-CD1 4.11Å; F241-L338 HydrophobicContact CG-CD2 3.92Å; F241-L338 HydrophobicContact CZ-CD2 4.24Å |
| 242 | N | 96.8 | Very high | 79.8 | Confident | 2 Ų | 2 | 82.4 Ų | 82.4 | 1% | 0.011 | 41% | 0.412 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -118.1 | 125.5 | -174.9 | -61.7 | -90.4 | 0 | 0 | 0 | 110.2 | F225 W226 E240 V278 L279 Q280 | F225-N242 VanDerWaalsContact CA-O 3.27Å; F225-N242 WeakPolarHBondContact CA-O 3.33Å; F225-N242 WeakPolarHBondContact CD2-O 3.36Å; W226-N242 HydrophobicContact CD2-CB 3.6Å; W226-N242 HydrophobicContact CE3-CB 3.99Å; W226-N242 HydrophobicContact CG-CB 4.18Å; W226-N242 HydrophobicContact CH2-CB 3.7Å; W226-N242 HydrophobicContact CZ2-CB 3.26Å; W226-N242 HydrophobicContact CZ3-CB 4.04Å; W226-N242 PolarHBondContact N-O 2.92Å; W226-N242 PolarHBondContact NE1-ND2 3.23Å; W226-N242 PolarHBondContact O-N 2.92Å; E240-N242 PolarHBondContact O-ND2 2.99Å; E240-N242 VanDerWaalsContact O-ND2 3.1Å; N242-V278 HydrophobicContact CB-CG1 4.42Å; N242-L279 CarbonylContact C-O 3.58Å; N242-L279 WeakPolarHBondContact CA-O 3.46Å; N242-Q280 WeakPolarHBondContact OD1-CG 3.46Å; N242-Q280 PolarHBondContact OD1-OE1 3.48Å |
| 243 | F | 96.3 | Very high | 78.7 | Confident | 0 Ų | 0 | 87.6 Ų | 87.6 | 0% | 0 | 43% | 0.427 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -121 | 113 | 178.7 | -54.5 | -96.1 | 0 | 0 | 0 | 108.6 | F225 F241 F245 V278 L279 I289 V292 L315 F317 V336 L338 | F225-F243 HydrophobicContact CB-CD1 4.21Å; F225-F243 AromaticContact CD2-CD1 3.43Å; F225-F243 HydrophobicContact CD2-CD1 3.43Å; F225-F243 VanDerWaalsContact CD2-CD1 3.43Å; F225-F243 HydrophobicContact CD2-CD2 4.33Å; F225-F243 AromaticContact CD2-CE1 3.25Å; F225-F243 HydrophobicContact CD2-CE1 3.25Å; F225-F243 HydrophobicContact CD2-CE2 4.19Å; F225-F243 AromaticContact CD2-CG 3.98Å; F225-F243 HydrophobicContact CD2-CG 3.98Å; F225-F243 AromaticContact CD2-CZ 3.66Å; F225-F243 HydrophobicContact CD2-CZ 3.66Å; F225-F243 HydrophobicContact CE2-CD1 4.21Å; F225-F243 AromaticContact CE2-CE1 3.61Å; F225-F243 HydrophobicContact CE2-CE1 3.61Å; F225-F243 HydrophobicContact CE2-CE2 4.09Å; F225-F243 AromaticContact CE2-CZ 3.54Å; F225-F243 HydrophobicContact CE2-CZ 3.54Å; F225-F243 HydrophobicContact CG-CD1 4.13Å; F225-F243 HydrophobicContact CG-CE1 4.04Å; F241-F243 HydrophobicContact CB-CE2 3.84Å; F241-F243 HydrophobicContact CB-CZ 4.34Å; F243-F245 HydrophobicContact CB-CD2 4.13Å; F243-F245 HydrophobicContact CB-CE2 3.42Å; F243-F245 VanDerWaalsContact CB-CE2 3.42Å; F243-F245 HydrophobicContact CB-CZ 3.77Å; F243-F245 HydrophobicContact CG-CE2 4.37Å; F243-F245 HydrophobicContact CG-CZ 4.44Å; F243-F245 WeakPolarHBondContact O-CD2 3.35Å; F243-V278 CarbonylContact O-C 3.57Å; F243-V278 WeakPolarHBondContact O-CA 2.94Å; F243-L279 HydrophobicContact CB-CB 4.36Å; F243-L279 HydrophobicContact CD2-CD2 4.38Å; F243-L279 PolarHBondContact N-O 2.89Å; F243-L279 PolarHBondContact O-N 2.84Å; F243-I289 HydrophobicContact CE1-CD1 3.75Å; F243-I289 HydrophobicContact CZ-CD1 3.66Å; F243-V292 HydrophobicContact CD1-CG2 4.06Å; F243-V292 HydrophobicContact CE1-CG2 3.89Å; F243-L315 HydrophobicContact CD2-CD1 4.32Å; F243-L315 HydrophobicContact CE1-CD1 4.38Å; F243-L315 HydrophobicContact CE2-CD1 4.03Å; F243-L315 HydrophobicContact CZ-CD1 4.06Å; F243-F317 HydrophobicContact CD1-CZ 4.31Å; F243-F317 HydrophobicContact CE1-CZ 4.45Å; F243-V336 HydrophobicContact CZ-CG1 4.3Å; F243-L338 HydrophobicContact CE2-CD1 4.28Å |
| 244 | K | 95.9 | Very high | 78.1 | Confident | 12 Ų | 12 | 83.5 Ų | 83.5 | 5% | 0.052 | 42% | 0.415 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -85.3 | 116.6 | 171.6 | -177.7 | 173.9 | 176.5 | 168.4 | 0 | 108.8 | F223 L224 W226 D273 C277 V278 Y354 | F223-K244 PolarHBondContact N-O 2.92Å; L224-K244 HydrophobicContact CB-CB 4.06Å; L224-K244 PolarHBondContact N-O 3.31Å; L224-K244 PolarHBondContact O-N 3.27Å; W226-K244 HydrophobicContact CH2-CB 4.45Å; W226-K244 HydrophobicContact CZ3-CB 4.02Å; K244-D273 IonicContact NZ-OD1 2.6Å; K244-D273 PolarHBondContact NZ-OD1 3.35Å; K244-C277 CarbonylContact C-O 3.51Å; K244-C277 WeakPolarHBondContact CA-O 3.23Å; K244-V278 HydrophobicContact CB-CG2 4.05Å; K244-V278 HydrophobicContact CG-CG2 4.18Å; K244-Y354 WeakPolarHBondContact CE-OH 3.34Å |
| 245 | F | 95.1 | Very high | 77.2 | Confident | 0 Ų | 0 | 80.5 Ų | 80.5 | 0% | 0 | 42% | 0.416 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -103 | 143.4 | 176.1 | -69.1 | -76.2 | 0 | 0 | 0 | 110.8 | L217 K221 C222 F243 C276 C277 L279 L297 F317 | L217-F245 HydrophobicContact CD1-CD2 4.08Å; L217-F245 HydrophobicContact CD1-CE2 4.03Å; L217-F245 HydrophobicContact CD2-CB 4.08Å; L217-F245 HydrophobicContact CD2-CD2 3.76Å; L217-F245 HydrophobicContact CD2-CG 4.06Å; L217-F245 HydrophobicContact CG-CD2 4.48Å; K221-F245 CarbonylContact O-C 3.57Å; K221-F245 VanDerWaalsContact O-CA 3.32Å; K221-F245 WeakPolarHBondContact O-CA 3.4Å; C222-F245 HydrophobicContact CB-CD1 4.19Å; C222-F245 HydrophobicContact CB-CE1 3.86Å; F243-F245 HydrophobicContact CB-CD2 4.13Å; F243-F245 HydrophobicContact CB-CE2 3.42Å; F243-F245 VanDerWaalsContact CB-CE2 3.42Å; F243-F245 HydrophobicContact CB-CZ 3.77Å; F243-F245 HydrophobicContact CG-CE2 4.37Å; F243-F245 HydrophobicContact CG-CZ 4.44Å; F243-F245 WeakPolarHBondContact O-CD2 3.35Å; F245-C276 CarbonylContact O-C 3.58Å; F245-C276 WeakPolarHBondContact O-CA 3.25Å; F245-C277 PolarHBondContact N-O 3.44Å; F245-C277 PolarHBondContact O-N 2.97Å; F245-L279 HydrophobicContact CD2-CB 4.22Å; F245-L279 HydrophobicContact CE2-CB 3.83Å; F245-L279 HydrophobicContact CE2-CD2 4.19Å; F245-L297 HydrophobicContact CD1-CB 4.44Å; F245-L297 HydrophobicContact CE1-CB 3.77Å; F245-L297 HydrophobicContact CE1-CD2 4.08Å; F245-L297 HydrophobicContact CE1-CG 4.37Å; F245-L297 HydrophobicContact CE2-CD2 4.49Å; F245-L297 HydrophobicContact CZ-CB 4.36Å; F245-L297 HydrophobicContact CZ-CD1 4.39Å; F245-L297 HydrophobicContact CZ-CD2 3.92Å; F245-L297 HydrophobicContact CZ-CG 4.47Å; F245-F317 AromaticContact CE1-CE1 3.79Å; F245-F317 HydrophobicContact CE1-CE1 3.79Å; F245-F317 HydrophobicContact CE1-CZ 4.42Å; F245-F317 AromaticContact CZ-CE1 3.98Å; F245-F317 HydrophobicContact CZ-CE1 3.98Å; F245-F317 HydrophobicContact CZ-CZ 4.15Å |
| 246 | K | 92.8 | Very high | 76.7 | Confident | 96 Ų | 96 | 79.2 Ų | 79.2 | 42% | 0.417 | 42% | 0.417 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -114 | 121.8 | 165.5 | -172.6 | 172.4 | -176.8 | 176.1 | 0 | 108.3 | S220 K221 Q248 | S220-K246 WeakPolarHBondContact CA-O 3.49Å; K221-K246 PolarHBondContact N-O 3.49Å; K221-K246 PolarHBondContact O-N 2.86Å; K246-Q248 PolarHBondContact O-N 3.35Å |
| 247 | K | 89 | Confident | 75.8 | Confident | 78 Ų | 78 | 82.3 Ų | 82.3 | 34% | 0.339 | 43% | 0.429 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -63.5 | 134.8 | 174.4 | -64.6 | 175.2 | -179.3 | 172.4 | 0 | 108.1 | D275 | K247-D275 HydrophobicContact CB-CB 4.27Å; K247-D275 PolarHBondContact N-O 3.06Å |
| 248 | Q | 77.8 | Confident | 74.9 | Confident | 81 Ų | 81 | 84 Ų | 84 | 38% | 0.379 | 44% | 0.438 | S | S | . | . | trans | -68.4 | 135.3 | 171.6 | -69.6 | -173.9 | 6 | 0 | 0 | 108.2 | K246 H250 | K246-Q248 PolarHBondContact O-N 3.35Å; Q248-H250 PolarHBondContact O-N 2.78Å | ||
| 249 | E | 65.6 | Low | 73.8 | Confident | 145 Ų | 145 | 87.5 Ų | 87.5 | 68% | 0.678 | 46% | 0.457 | S | S | * | . | trans | -61.4 | 113.3 | 174.3 | -66.7 | -170.2 | 172.4 | 0 | 0 | 108 | F251 | E249-F251 PolarHBondContact O-N 3.13Š| ||
| 250 | H | 57.9 | Low | 72.9 | Confident | 167 Ų | 167 | 92.2 Ų | 92.2 | 77% | 0.773 | 48% | 0.481 | S | S | * | . | trans | -61.7 | 123 | 157.7 | -68.5 | -65.8 | 0 | 0 | 0 | 105.6 | Q248 K252 | Q248-H250 PolarHBondContact O-N 2.78Å; H250-K252 PolarHBondContact O-N 3.05Å | ||
| 251 | F | 46.6 | Very low | 72.2 | Confident | 202 Ų | 202 | 94.1 Ų | 94.1 | 89% | 0.886 | 49% | 0.492 | S | S | * | . | trans | -40.5 | 109.1 | 170.6 | -70.8 | -83.8 | 0 | 0 | 0 | 107.7 | E249 N253 | E249-F251 PolarHBondContact O-N 3.13Å; F251-N253 PolarHBondContact O-N 3.01Å | ||
| 252 | K | 52.7 | Low | 71.5 | Confident | 181 Ų | 181 | 95.6 Ų | 95.6 | 79% | 0.787 | 50% | 0.501 | S | S | * | . | trans | -60.9 | 113.3 | 178.2 | -71.3 | 176.6 | -178.6 | 169.2 | 0 | 104.4 | H250 G254 | H250-K252 PolarHBondContact O-N 3.05Å; K252-G254 PolarHBondContact O-N 3.2Å | ||
| 253 | N | 45.4 | Very low | 70.9 | Confident | 161 Ų | 161 | 104.5 Ų | 104.5 | 86% | 0.861 | 54% | 0.54 | S | S | * | . | trans | -59.9 | 93.2 | 163.7 | -75.4 | -7.8 | 0 | 0 | 0 | 105.2 | F251 C255 | F251-N253 PolarHBondContact O-N 3.01Å; N253-C255 PolarHBondContact O-N 2.69Å | ||
| 254 | G | 47.2 | Very low | 70.3 | Confident | 69 Ų | 69 | 110.7 Ų | 110.7 | 71% | 0.711 | 57% | 0.568 | S | S | * | * | trans | -61.3 | 108.2 | -173.4 | 0 | 0 | 0 | 0 | 0 | 108.4 | K252 A256 | K252-G254 PolarHBondContact O-N 3.2Å; G254-A256 PolarHBondContact O-N 3.1Å | ||
| 255 | C | 50.2 | Low | 69.8 | Low | 86 Ų | 86 | 111.4 Ų | 111.4 | 58% | 0.581 | 57% | 0.571 | S | S | * | * | trans | -70.3 | 114.5 | 160.9 | -174.8 | 0 | 0 | 0 | 0 | 106 | N253 K257 S258 | N253-C255 PolarHBondContact O-N 2.69Å; C255-K257 PolarHBondContact O-N 3.17Å; C255-S258 PolarHBondContact O-N 3.43Å; C255-S258 VanDerWaalsContact O-N 3.13Å | ||
| 256 | A | 57.5 | Low | 69.4 | Low | 110 Ų | 110 | 117.9 Ų | 117.9 | 91% | 0.909 | 60% | 0.602 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -58.2 | -1.5 | 179.3 | 0 | 0 | 0 | 0 | 0 | 114.5 | G254 | G254-A256 PolarHBondContact O-N 3.1Š|
| 257 | K | 59.2 | Low | 69.1 | Low | 188 Ų | 188 | 119.4 Ų | 119.4 | 82% | 0.817 | 61% | 0.61 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -110.8 | 11.7 | -179 | -58.8 | -176.3 | 179.6 | -178.3 | 0 | 114.1 | C255 L259 | C255-K257 PolarHBondContact O-N 3.17Å; K257-L259 PolarHBondContact O-N 3.31Å |
| 258 | S | 65.9 | Low | 69.2 | Low | 74 Ų | 74 | 116 Ų | 116 | 52% | 0.517 | 60% | 0.596 | S | S | . | * | P | Polyproline II helix | trans | -67 | 132.1 | 177.7 | 60.7 | 0 | 0 | 0 | 0 | 111.2 | C255 H260 | C255-S258 PolarHBondContact O-N 3.43Å; C255-S258 VanDerWaalsContact O-N 3.13Å; S258-H260 PolarHBondContact O-N 3.29Å |
| 259 | L | 69.6 | Low | 69.8 | Low | 97 Ų | 97 | 114.4 Ų | 114.4 | 51% | 0.508 | 59% | 0.588 | S | S | . | * | P | Polyproline II helix | trans | -59.5 | 123.9 | 171.2 | -67.9 | 173 | 0 | 0 | 0 | 109.5 | W146 K257 | W146-L259 HydrophobicContact CD2-CD1 3.89Å; W146-L259 HydrophobicContact CE3-CD1 4.09Å; W146-L259 HydrophobicContact CG-CD1 4.21Å; W146-L259 HydrophobicContact CH2-CB 3.99Å; W146-L259 HydrophobicContact CZ2-CB 3.89Å; W146-L259 HydrophobicContact CZ3-CB 4.4Å; K257-L259 PolarHBondContact O-N 3.31Å |
| 260 | H | 76.9 | Confident | 71 | Confident | 160 Ų | 160 | 110.9 Ų | 110.9 | 74% | 0.741 | 57% | 0.572 | S | S | * | * | P | Polyproline II helix | trans | -81 | 129.3 | 174.7 | -73.9 | -80.5 | 0 | 0 | 0 | 110 | W146 S258 | W146-H260 WeakPolarHBondContact CH2-O 3.46Å; S258-H260 PolarHBondContact O-N 3.29Å |
| 261 | L | 80.2 | Confident | 72.6 | Confident | 67 Ų | 67 | 104.3 Ų | 104.3 | 35% | 0.351 | 54% | 0.543 | S | S | . | . | P | Polyproline II helix | trans | -54.2 | 135.7 | 174.8 | -174 | 72.6 | 0 | 0 | 0 | 110.3 | C150 K263 H269 | C150-L261 HydrophobicContact CB-CD1 4.13Å; L261-K263 PolarHBondContact O-N 3.31Å; L261-H269 VanDerWaalsContact CD1-CD2 3.47Å; L261-H269 WeakPolarHBondContact CD1-CD2 3.47Å; L261-H269 HydrophobicContact CD2-CB 3.58Å |
| 262 | P | 82.3 | Confident | 74.6 | Confident | 31 Ų | 31 | 97.8 Ų | 97.8 | 20% | 0.201 | 52% | 0.521 | C | S | . | . | P | Polyproline II helix | trans | -62.4 | 125.7 | 175.5 | -18.5 | 31.8 | 0 | 0 | 0 | 110.2 | W146 C150 Q264 Y265 | W146-P262 HydrophobicContact CH2-CG 4.37Å; W146-P262 HydrophobicContact CZ3-CG 4.46Å; C150-P262 HydrophobicContact CB-CG 4.46Å; P262-Q264 HydrophobicContact CB-CG 4.27Å; P262-Q264 PolarHBondContact O-N 2.95Å; P262-Q264 VanDerWaalsContact O-N 3.14Å; P262-Y265 HydrophobicContact CB-CD2 3.75Å; P262-Y265 HydrophobicContact CB-CE2 4.19Å; P262-Y265 HydrophobicContact CG-CD2 3.95Å; P262-Y265 HydrophobicContact CG-CE2 4.35Å; P262-Y265 PolarHBondContact O-N 3.33Å |
| 263 | K | 84.1 | Confident | 76.5 | Confident | 189 Ų | 189 | 89.8 Ų | 89.8 | 82% | 0.822 | 49% | 0.487 | S | S | * | . | G | 310 helix | trans | -53.8 | -36.8 | -175.6 | -66.1 | -176.5 | 178.3 | -178.5 | 0 | 113.1 | L261 Y265 E266 | L261-K263 PolarHBondContact O-N 3.31Å; K263-Y265 PolarHBondContact O-N 2.9Å; K263-E266 WeakPolarHBondContact O-CB 3.24Å; K263-E266 PolarHBondContact O-N 2.73Å; K263-E266 VanDerWaalsContact O-N 3.08Å |
| 264 | Q | 84.3 | Confident | 78.5 | Confident | 130 Ų | 130 | 84.6 Ų | 84.6 | 61% | 0.607 | 46% | 0.463 | S | S | * | . | G | 310 helix | trans | -62.4 | -13.7 | 178.6 | 69.9 | -162.7 | 38.2 | 0 | 0 | 114.6 | P262 | P262-Q264 HydrophobicContact CB-CG 4.27Å; P262-Q264 PolarHBondContact O-N 2.95Å; P262-Q264 VanDerWaalsContact O-N 3.14Å |
| 265 | Y | 85.3 | Confident | 80.6 | Confident | 27 Ų | 27 | 85 Ų | 85 | 11% | 0.106 | 45% | 0.449 | C | S | . | . | G | 310 helix | trans | -110.7 | 13.8 | 177.3 | -56.3 | -52.7 | 0 | 0 | 0 | 112.9 | C150 T151 P262 K263 E267 V268 H269 | C150-Y265 HydrophobicContact CB-CD2 4.08Å; C150-Y265 WeakPolarHBondContact O-CB 3.08Å; T151-Y265 HydrophobicContact CG2-CE1 4.32Å; T151-Y265 HydrophobicContact CG2-CE2 3.95Å; P262-Y265 HydrophobicContact CB-CD2 3.75Å; P262-Y265 HydrophobicContact CB-CE2 4.19Å; P262-Y265 HydrophobicContact CG-CD2 3.95Å; P262-Y265 HydrophobicContact CG-CE2 4.35Å; P262-Y265 PolarHBondContact O-N 3.33Å; K263-Y265 PolarHBondContact O-N 2.9Å; Y265-E267 VanDerWaalsContact C-N 3.28Å; Y265-E267 PolarHBondContact O-N 3.01Å; Y265-V268 HydrophobicContact CD1-CG2 4.45Å; Y265-V268 VanDerWaalsContact O-CB 3.32Å; Y265-V268 WeakPolarHBondContact O-CB 3.43Å; Y265-V268 PolarHBondContact O-N 3.31Å; Y265-H269 PolarHBondContact O-CD2 2.92Å; Y265-H269 VanDerWaalsContact O-CD2 3.28Å; Y265-H269 PolarHBondContact O-N 3.18Å |
| 266 | E | 87 | Confident | 82.6 | Confident | 137 Ų | 137 | 81.2 Ų | 81.2 | 64% | 0.64 | 42% | 0.423 | S | S | * | . | H | α-helix | trans | -53.3 | -44.7 | -178.5 | -175.6 | 168.6 | -170.2 | 0 | 0 | 112.6 | K263 V268 H269 M270 | K263-E266 WeakPolarHBondContact O-CB 3.24Å; K263-E266 PolarHBondContact O-N 2.73Å; K263-E266 VanDerWaalsContact O-N 3.08Å; E266-V268 VanDerWaalsContact C-N 3.27Å; E266-V268 PolarHBondContact O-N 2.68Å; E266-H269 PolarHBondContact O-N 3.43Å; E266-H269 VanDerWaalsContact O-N 3.15Å; E266-M270 PolarHBondContact O-N 3.31Å |
| 267 | E | 87.3 | Confident | 84.3 | Confident | 128 Ų | 128 | 76 Ų | 76 | 60% | 0.598 | 38% | 0.381 | S | S | * | . | H | α-helix | trans | -63.1 | -31.4 | 178.2 | -61.9 | -166.4 | 138.4 | 0 | 0 | 113.5 | C183 Y265 H269 | C183-E267 WeakPolarHBondContact CA-O 3.46Å; C183-E267 PolarHBondContact N-O 2.96Å; Y265-E267 VanDerWaalsContact C-N 3.28Å; Y265-E267 PolarHBondContact O-N 3.01Å; E267-H269 VanDerWaalsContact C-N 3.31Å; E267-H269 PolarHBondContact O-N 2.99Å |
| 268 | V | 90.5 | Very high | 86 | Confident | 7 Ų | 7 | 67.1 Ų | 67.1 | 4% | 0.042 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -65.5 | -38.2 | 177.5 | 175.6 | 0 | 0 | 0 | 0 | 110.5 | A152 L184 R185 Y265 E266 | A152-V268 HydrophobicContact CB-CG2 3.83Å; L184-V268 HydrophobicContact CB-CG1 4.22Å; L184-V268 HydrophobicContact CD2-CG1 4.32Å; L184-V268 PolarHBondContact N-O 3.01Å; R185-V268 HydrophobicContact CB-CG1 4.38Å; R185-V268 VanDerWaalsContact CB-O 3.22Å; R185-V268 WeakPolarHBondContact CB-O 3.17Å; R185-V268 PolarHBondContact N-O 3.03Å; Y265-V268 HydrophobicContact CD1-CG2 4.45Å; Y265-V268 VanDerWaalsContact O-CB 3.32Å; Y265-V268 WeakPolarHBondContact O-CB 3.43Å; Y265-V268 PolarHBondContact O-N 3.31Å; E266-V268 VanDerWaalsContact C-N 3.27Å; E266-V268 PolarHBondContact O-N 2.68Å |
| 269 | H | 90.8 | Very high | 87.5 | Confident | 47 Ų | 47 | 63.6 Ų | 63.6 | 22% | 0.218 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -98.6 | -7.9 | -173.6 | -66.6 | -85.1 | 0 | 0 | 0 | 114.3 | C150 R185 L261 Y265 E266 E267 N271 | C150-H269 VanDerWaalsContact CA-NE2 3.32Å; C150-H269 WeakPolarHBondContact CA-NE2 3.46Å; C150-H269 PolarHBondContact O-NE2 3.22Å; R185-H269 WeakPolarHBondContact CD-ND1 3.42Å; L261-H269 VanDerWaalsContact CD1-CD2 3.47Å; L261-H269 WeakPolarHBondContact CD1-CD2 3.47Å; L261-H269 HydrophobicContact CD2-CB 3.58Å; Y265-H269 PolarHBondContact O-CD2 2.92Å; Y265-H269 VanDerWaalsContact O-CD2 3.28Å; Y265-H269 PolarHBondContact O-N 3.18Å; E266-H269 PolarHBondContact O-N 3.43Å; E266-H269 VanDerWaalsContact O-N 3.15Å; E267-H269 VanDerWaalsContact C-N 3.31Å; E267-H269 PolarHBondContact O-N 2.99Å; H269-N271 PolarHBondContact O-N 3.44Å |
| 270 | M | 90.8 | Very high | 88.7 | Confident | 70 Ų | 70 | 59.5 Ų | 59.5 | 35% | 0.345 | 30% | 0.295 | S | S | . | . | trans | -54.6 | 130.1 | 172.5 | -176.4 | 171.8 | 58.8 | 0 | 0 | 110.2 | R182 C183 E266 | R182-M270 HydrophobicContact CG-CE 3.39Å; R182-M270 VanDerWaalsContact NE-CE 3.32Å; C183-M270 WeakPolarHBondContact CA-O 3.33Å; C183-M270 VanDerWaalsContact CB-O 3.25Å; C183-M270 WeakPolarHBondContact CB-O 3.48Å; C183-M270 WeakPolarHBondContact SG-CE 3.01Å; C183-M270 PolarHBondContact SG-O 3.5Å; C183-M270 VanDerWaalsContact SG-O 3.37Å; E266-M270 PolarHBondContact O-N 3.31Å | ||
| 271 | N | 91.7 | Very high | 89.7 | Confident | 30 Ų | 30 | 51.9 Ų | 51.9 | 16% | 0.16 | 26% | 0.26 | C | S | . | . | trans | -141.6 | 102 | 174 | -178.4 | 9.1 | 0 | 0 | 0 | 109.4 | A186 H269 D273 S274 | A186-N271 HydrophobicContact CB-CB 4.03Å; H269-N271 PolarHBondContact O-N 3.44Å; N271-D273 PolarHBondContact O-N 3.46Å; N271-D273 PolarHBondContact OD1-N 2.91Å; N271-D273 VanDerWaalsContact OD1-N 3.11Å; N271-S274 PolarHBondContact ND2-N 3.38Å; N271-S274 WeakPolarHBondContact O-CB 3.25Å; N271-S274 PolarHBondContact O-N 2.85Å; N271-S274 PolarHBondContact OD1-N 2.91Å | ||
| 272 | P | 89 | Confident | 90.4 | Very high | 64 Ų | 64 | 48.9 Ų | 48.9 | 42% | 0.416 | 25% | 0.245 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -65.2 | -24.3 | -179.4 | 27.2 | -34.8 | 0 | 0 | 0 | 112.6 | S274 I360 | P272-S274 VanDerWaalsContact C-N 3.33Å; P272-I360 HydrophobicContact CB-CD1 4.4Å |
| 273 | D | 90.9 | Very high | 91 | Very high | 14 Ų | 14 | 47.4 Ų | 47.4 | 8% | 0.075 | 24% | 0.235 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -94.7 | 13.2 | 177.2 | -64.8 | -43.8 | 0 | 0 | 0 | 112.1 | R190 K244 N271 D275 C276 W349 | R190-D273 IonicContact NH1-OD2 2.68Å; K244-D273 IonicContact NZ-OD1 2.6Å; K244-D273 PolarHBondContact NZ-OD1 3.35Å; N271-D273 PolarHBondContact O-N 3.46Å; N271-D273 PolarHBondContact OD1-N 2.91Å; N271-D273 VanDerWaalsContact OD1-N 3.11Å; D273-D275 PolarHBondContact O-N 3.43Å; D273-C276 HydrophobicContact CB-CB 4.29Å; D273-C276 VanDerWaalsContact O-CB 3.27Å; D273-C276 WeakPolarHBondContact O-CB 3.37Å; D273-C276 PolarHBondContact O-N 2.87Å; D273-W349 HydrophobicContact CB-CB 3.73Å; D273-W349 VanDerWaalsContact O-CB 3.27Å; D273-W349 WeakPolarHBondContact O-CB 3.45Å |
| 274 | S | 88.8 | Confident | 91.4 | Very high | 52 Ų | 52 | 40.4 Ų | 40.4 | 36% | 0.364 | 21% | 0.207 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -53.4 | 136 | 170.6 | -168.9 | 0 | 0 | 0 | 0 | 109.3 | N271 P272 C276 | N271-S274 PolarHBondContact ND2-N 3.38Å; N271-S274 WeakPolarHBondContact O-CB 3.25Å; N271-S274 PolarHBondContact O-N 2.85Å; N271-S274 PolarHBondContact OD1-N 2.91Å; P272-S274 VanDerWaalsContact C-N 3.33Å; S274-C276 PolarHBondContact O-N 2.97Å |
| 275 | D | 89.8 | Confident | 91.7 | Very high | 76 Ų | 76 | 38.8 Ų | 38.8 | 41% | 0.406 | 20% | 0.202 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 61.9 | 12.4 | 179.3 | -51.9 | -66.8 | 0 | 0 | 0 | 114.7 | K247 D273 | K247-D275 HydrophobicContact CB-CB 4.27Å; K247-D275 PolarHBondContact N-O 3.06Å; D273-D275 PolarHBondContact O-N 3.43Å |
| 276 | C | 92.9 | Very high | 92.1 | Very high | 7 Ų | 7 | 43 Ų | 43 | 5% | 0.047 | 22% | 0.219 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -94.1 | 146.1 | 173.8 | -61.8 | 0 | 0 | 0 | 0 | 111.7 | F245 D273 S274 W349 Y354 | F245-C276 CarbonylContact O-C 3.58Å; F245-C276 WeakPolarHBondContact O-CA 3.25Å; D273-C276 HydrophobicContact CB-CB 4.29Å; D273-C276 VanDerWaalsContact O-CB 3.27Å; D273-C276 WeakPolarHBondContact O-CB 3.37Å; D273-C276 PolarHBondContact O-N 2.87Å; S274-C276 PolarHBondContact O-N 2.97Å; C276-W349 PolarHBondContact O-N 2.79Å; C276-Y354 WeakPolarHBondContact CB-OH 3.29Å |
| 277 | C | 93.6 | Very high | 92.5 | Very high | 2 Ų | 2 | 38 Ų | 38 | 1% | 0.014 | 20% | 0.196 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -144.2 | 155.4 | 172.1 | 51.9 | 0 | 0 | 0 | 0 | 109.2 | L217 K244 F245 L346 M347 | L217-C277 WeakPolarHBondContact CD2-SG 3.19Å; K244-C277 CarbonylContact C-O 3.51Å; K244-C277 WeakPolarHBondContact CA-O 3.23Å; F245-C277 PolarHBondContact N-O 3.44Å; F245-C277 PolarHBondContact O-N 2.97Å; C277-L346 HydrophobicContact CB-CD1 4.15Å; C277-M347 CarbonylContact C-O 3.56Å; C277-M347 VanDerWaalsContact CA-O 3.25Å; C277-M347 WeakPolarHBondContact CA-O 3.35Å |
| 278 | V | 95.3 | Very high | 92.8 | Very high | 0 Ų | 0 | 40.4 Ų | 40.4 | 0% | 0 | 21% | 0.205 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -117.5 | 122.5 | 177.1 | 172.8 | 0 | 0 | 0 | 0 | 108.6 | W226 N242 F243 K244 M347 Y354 P355 | W226-V278 HydrophobicContact CH2-CG1 4.1Å; W226-V278 HydrophobicContact CH2-CG2 4.17Å; W226-V278 HydrophobicContact CZ2-CG1 4.49Å; N242-V278 HydrophobicContact CB-CG1 4.42Å; F243-V278 CarbonylContact O-C 3.57Å; F243-V278 WeakPolarHBondContact O-CA 2.94Å; K244-V278 HydrophobicContact CB-CG2 4.05Å; K244-V278 HydrophobicContact CG-CG2 4.18Å; V278-M347 HydrophobicContact CB-CE 4.2Å; V278-M347 HydrophobicContact CG1-CE 3.79Å; V278-M347 PolarHBondContact N-O 2.69Å; V278-M347 PolarHBondContact O-N 2.73Å; V278-Y354 HydrophobicContact CB-CD2 4.36Å; V278-Y354 HydrophobicContact CB-CE2 4.13Å; V278-Y354 HydrophobicContact CG2-CD2 4.02Å; V278-Y354 HydrophobicContact CG2-CE2 3.46Å; V278-Y354 VanDerWaalsContact CG2-CE2 3.46Å; V278-P355 HydrophobicContact CG2-CG 4.41Å |
| 279 | L | 96 | Very high | 93 | Very high | 0 Ų | 0 | 41 Ų | 41 | 0% | 0 | 21% | 0.207 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -87.9 | 118.5 | 164.9 | 177.3 | 65.1 | 0 | 0 | 0 | 107.9 | L217 N242 F243 F245 V281 F300 L315 V344 | L217-L279 HydrophobicContact CD1-CB 3.99Å; L217-L279 HydrophobicContact CD1-CD1 4.31Å; L217-L279 HydrophobicContact CD1-CD2 4.04Å; L217-L279 HydrophobicContact CD1-CG 4.33Å; N242-L279 CarbonylContact C-O 3.58Å; N242-L279 WeakPolarHBondContact CA-O 3.46Å; F243-L279 HydrophobicContact CB-CB 4.36Å; F243-L279 HydrophobicContact CD2-CD2 4.38Å; F243-L279 PolarHBondContact N-O 2.89Å; F243-L279 PolarHBondContact O-N 2.84Å; F245-L279 HydrophobicContact CD2-CB 4.22Å; F245-L279 HydrophobicContact CE2-CB 3.83Å; F245-L279 HydrophobicContact CE2-CD2 4.19Å; L279-V281 HydrophobicContact CD1-CG2 4.29Å; L279-V281 HydrophobicContact CD2-CG2 4.3Å; L279-V281 HydrophobicContact CG-CG2 4.04Å; L279-F300 HydrophobicContact CD1-CE1 4.23Å; L279-F300 HydrophobicContact CD1-CZ 3.92Å; L279-F300 HydrophobicContact CD2-CE2 4.48Å; L279-F300 HydrophobicContact CD2-CZ 4.32Å; L279-L315 HydrophobicContact CD2-CD1 4.07Å; L279-L315 HydrophobicContact CD2-CD2 3.97Å; L279-V344 HydrophobicContact CD1-CG1 3.77Å |
| 280 | Q | 96 | Very high | 93.2 | Very high | 11 Ų | 11 | 41.4 Ų | 41.4 | 5% | 0.051 | 21% | 0.214 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -110.1 | 122.9 | 171.9 | -179.3 | -177.4 | -60.8 | 0 | 0 | 109 | E240 F241 N242 V344 K345 M347 | E240-Q280 HydrophobicContact CB-CG 4.39Å; E240-Q280 HydrophobicContact CG-CG 4.35Å; E240-Q280 PolarHBondContact OE1-NE2 3.22Å; F241-Q280 WeakPolarHBondContact O-CA 3.21Å; N242-Q280 WeakPolarHBondContact OD1-CG 3.46Å; N242-Q280 PolarHBondContact OD1-OE1 3.48Å; Q280-V344 WeakPolarHBondContact O-CA 3.45Å; Q280-K345 HydrophobicContact CB-CB 4.43Å; Q280-K345 PolarHBondContact N-O 3.17Å; Q280-K345 PolarHBondContact O-N 2.87Å; Q280-M347 HydrophobicContact CB-CE 3.44Å; Q280-M347 VanDerWaalsContact CB-CE 3.44Å; Q280-M347 HydrophobicContact CG-CE 4.42Å |
| 281 | V | 96.4 | Very high | 93.2 | Very high | 0 Ų | 0 | 43.5 Ų | 43.5 | 0% | 0 | 23% | 0.231 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -117.5 | 122.7 | 174.6 | -176.1 | 0 | 0 | 0 | 0 | 108.3 | E240 F241 L279 T283 V313 L338 V341 V344 | E240-V281 WeakPolarHBondContact CA-O 3.34Å; F241-V281 HydrophobicContact CB-CB 4.48Å; F241-V281 PolarHBondContact N-O 2.86Å; F241-V281 PolarHBondContact O-N 3.43Å; L279-V281 HydrophobicContact CD1-CG2 4.29Å; L279-V281 HydrophobicContact CD2-CG2 4.3Å; L279-V281 HydrophobicContact CG-CG2 4.04Å; V281-T283 HydrophobicContact CG1-CG2 4.34Å; V281-V313 HydrophobicContact CG1-CB 4.39Å; V281-V313 HydrophobicContact CG1-CG2 4.1Å; V281-V313 HydrophobicContact CG2-CG1 4.29Å; V281-V313 HydrophobicContact CG2-CG2 4.39Å; V281-L338 HydrophobicContact CB-CD1 3.61Å; V281-L338 HydrophobicContact CG1-CB 4.21Å; V281-L338 HydrophobicContact CG1-CD1 3.56Å; V281-L338 HydrophobicContact CG2-CD1 3.98Å; V281-V341 HydrophobicContact CG1-CG1 3.82Å; V281-V341 HydrophobicContact CG1-CG2 3.9Å; V281-V344 HydrophobicContact CG1-CG2 4.31Å; V281-V344 HydrophobicContact CG2-CG1 4.47Å; V281-V344 HydrophobicContact CG2-CG2 4.44Å |
| 282 | T | 95.4 | Very high | 93.4 | Very high | 5 Ų | 5 | 42.1 Ų | 42.1 | 3% | 0.031 | 22% | 0.223 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -100.4 | 128.1 | 176.8 | -51.3 | 0 | 0 | 0 | 0 | 109.3 | L238 W239 E240 H342 S343 | L238-T282 HydrophobicContact CB-CG2 3.97Å; L238-T282 HydrophobicContact CD1-CG2 4.18Å; L238-T282 HydrophobicContact CG-CG2 4.5Å; W239-T282 CarbonylContact O-C 3.51Å; W239-T282 VanDerWaalsContact O-CA 3.27Å; W239-T282 WeakPolarHBondContact O-CA 3.32Å; E240-T282 HydrophobicContact CG-CG2 4.15Å; E240-T282 WeakPolarHBondContact CG-OG1 3.22Å; T282-H342 HydrophobicContact CG2-CB 4.3Å; T282-H342 PolarHBondContact O-N 3.25Å; T282-S343 WeakPolarHBondContact CB-OG 3.35Å; T282-S343 PolarHBondContact N-O 3.11Å; T282-S343 PolarHBondContact O-N 2.94Å; T282-S343 PolarHBondContact OG1-OG 3.39Å |
| 283 | T | 95.2 | Very high | 93.6 | Very high | 0 Ų | 0 | 43.5 Ų | 43.5 | 0% | 0 | 23% | 0.225 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -120.3 | 160.8 | 178.5 | 59.4 | 0 | 0 | 0 | 0 | 111.5 | W239 F241 V281 N285 I287 L338 P340 V341 | W239-T283 PolarHBondContact N-O 3.4Å; W239-T283 PolarHBondContact O-N 3.08Å; W239-T283 PolarHBondContact O-OG1 3.32Å; F241-T283 HydrophobicContact CD2-CG2 4.22Å; F241-T283 HydrophobicContact CE2-CG2 4.27Å; F241-T283 VanDerWaalsContact CE2-OG1 3.28Å; F241-T283 WeakPolarHBondContact CE2-OG1 3.32Å; V281-T283 HydrophobicContact CG1-CG2 4.34Å; T283-N285 PolarHBondContact OG1-O 3.21Å; T283-I287 HydrophobicContact CG2-CD1 4.1Å; T283-L338 HydrophobicContact CG2-CB 3.92Å; T283-P340 VanDerWaalsContact CA-O 3.25Å; T283-P340 WeakPolarHBondContact CA-O 3.32Å; T283-P340 VanDerWaalsContact CB-O 3.32Å; T283-P340 WeakPolarHBondContact CB-O 3.47Å; T283-V341 HydrophobicContact CG2-CG2 4.32Å |
| 284 | L | 91.6 | Very high | 93.7 | Very high | 42 Ų | 42 | 44.5 Ų | 44.5 | 22% | 0.22 | 24% | 0.239 | C | C | . | . | S | Bend | trans | -77.4 | -28.4 | 175.7 | -53 | 179.9 | 0 | 0 | 0 | 112.4 | L238 P340 H342 | L238-L284 HydrophobicContact CD2-CD2 3.57Å; L284-P340 HydrophobicContact CB-CG 3.9Å; L284-P340 HydrophobicContact CD1-CB 4.22Å; L284-P340 HydrophobicContact CD1-CG 3.74Å; L284-P340 HydrophobicContact CG-CB 4.49Å; L284-P340 HydrophobicContact CG-CG 3.91Å; L284-P340 PolarHBondContact N-O 3.49Å; L284-H342 HydrophobicContact CD2-CB 4.23Å |
| 285 | N | 91.3 | Very high | 94 | Very high | 95 Ų | 95 | 43 Ų | 43 | 51% | 0.508 | 23% | 0.227 | S | C | . | . | S | Bend | trans | -119.4 | 153.7 | -177.9 | -63.9 | -41.7 | 0 | 0 | 0 | 110.9 | T283 | T283-N285 PolarHBondContact OG1-O 3.21Š|
| 286 | Y | 93.9 | Very high | 94.2 | Very high | 117 Ų | 117 | 39.6 Ų | 39.6 | 46% | 0.459 | 21% | 0.209 | S | C | . | . | trans | -69.7 | 134.5 | 164.3 | -177 | -103.6 | 0 | 0 | 0 | 109 | V227 W239 F241 F288 | V227-Y286 HydrophobicContact CG1-CD2 4.33Å; V227-Y286 HydrophobicContact CG1-CE2 4.08Å; W239-Y286 AromaticContact CD2-CD2 3.84Å; W239-Y286 HydrophobicContact CD2-CD2 3.84Å; W239-Y286 HydrophobicContact CD2-CG 4.32Å; W239-Y286 AromaticContact CE3-CD2 3.52Å; W239-Y286 HydrophobicContact CE3-CD2 3.52Å; W239-Y286 HydrophobicContact CE3-CE2 4.32Å; W239-Y286 HydrophobicContact CE3-CG 4.36Å; W239-Y286 HydrophobicContact CG-CD2 4.49Å; W239-Y286 HydrophobicContact CH2-CD2 4.13Å; W239-Y286 HydrophobicContact CH2-CG 4.46Å; W239-Y286 HydrophobicContact CZ2-CD2 4.45Å; W239-Y286 HydrophobicContact CZ2-CG 4.47Å; W239-Y286 AromaticContact CZ3-CD2 3.66Å; W239-Y286 HydrophobicContact CZ3-CD2 3.66Å; W239-Y286 HydrophobicContact CZ3-CE2 4.26Å; W239-Y286 HydrophobicContact CZ3-CG 4.41Å; F241-Y286 HydrophobicContact CZ-CD2 4.45Å; Y286-F288 AromaticContact CE1-CD2 4Å; Y286-F288 HydrophobicContact CE1-CD2 4Å | ||
| 287 | I | 94.7 | Very high | 94.2 | Very high | 32 Ų | 32 | 39.3 Ų | 39.3 | 16% | 0.164 | 21% | 0.206 | C | C | . | . | trans | -127.6 | 125.8 | -178.3 | -57.4 | 173.2 | 0 | 0 | 0 | 107 | F241 T283 I289 L338 D339 | F241-I287 VanDerWaalsContact CE1-O 3.28Å; F241-I287 WeakPolarHBondContact CE1-O 3.34Å; F241-I287 HydrophobicContact CZ-CB 3.99Å; F241-I287 WeakPolarHBondContact CZ-O 3.27Å; T283-I287 HydrophobicContact CG2-CD1 4.1Å; I287-I289 HydrophobicContact CG2-CG2 4.19Å; I287-I289 PolarHBondContact O-N 2.99Å; I287-L338 HydrophobicContact CB-CD2 4.31Å; I287-L338 HydrophobicContact CD1-CB 4.36Å; I287-L338 HydrophobicContact CD1-CD2 4.09Å; I287-L338 HydrophobicContact CG2-CD2 4.43Å; I287-D339 WeakPolarHBondContact CD1-O 3.02Å | ||
| 288 | F | 94.1 | Very high | 94.1 | Very high | 177 Ų | 177 | 39.9 Ų | 39.9 | 78% | 0.776 | 21% | 0.21 | S | C | * | . | trans | -74.5 | 126.2 | 174.5 | -145.5 | -84.6 | 0 | 0 | 0 | 109 | Y286 | Y286-F288 AromaticContact CE1-CD2 4Å; Y286-F288 HydrophobicContact CE1-CD2 4Å | ||
| 289 | I | 94.7 | Very high | 93.9 | Very high | 20 Ų | 20 | 41.2 Ų | 41.2 | 10% | 0.103 | 22% | 0.217 | C | C | . | . | trans | -123.7 | 148.9 | 179.2 | 74 | 163.2 | 0 | 0 | 0 | 110.6 | F225 F241 F243 I287 V336 L338 | F225-I289 HydrophobicContact CD1-CD1 4.27Å; F225-I289 HydrophobicContact CD2-CD1 4.07Å; F225-I289 HydrophobicContact CE1-CD1 3.6Å; F225-I289 HydrophobicContact CE1-CG1 3.84Å; F225-I289 HydrophobicContact CE2-CD1 3.39Å; F225-I289 HydrophobicContact CE2-CG1 4.39Å; F225-I289 HydrophobicContact CG-CD1 4.46Å; F225-I289 HydrophobicContact CZ-CD1 3.1Å; F225-I289 HydrophobicContact CZ-CG1 3.62Å; F241-I289 HydrophobicContact CD1-CD1 4.24Å; F241-I289 HydrophobicContact CD1-CG2 4.42Å; F241-I289 HydrophobicContact CE1-CG2 4.07Å; F243-I289 HydrophobicContact CE1-CD1 3.75Å; F243-I289 HydrophobicContact CZ-CD1 3.66Å; I287-I289 HydrophobicContact CG2-CG2 4.19Å; I287-I289 PolarHBondContact O-N 2.99Å; I289-V336 HydrophobicContact CB-CG1 4.04Å; I289-V336 HydrophobicContact CB-CG2 4.33Å; I289-V336 HydrophobicContact CD1-CG1 4.02Å; I289-V336 HydrophobicContact CD1-CG2 4.35Å; I289-V336 HydrophobicContact CG2-CG1 3.72Å; I289-L338 HydrophobicContact CG2-CD2 3.99Å | ||
| 290 | P | 94.3 | Very high | 93.8 | Very high | 56 Ų | 56 | 41.7 Ų | 41.7 | 36% | 0.364 | 22% | 0.219 | S | C | . | . | trans | -65.2 | 160.2 | 173.6 | 27.7 | -36.4 | 0 | 0 | 0 | 112 | V292 T334 V336 | P290-V292 HydrophobicContact CG-CG1 4.46Å; P290-V292 PolarHBondContact O-N 3.45Å; P290-T334 HydrophobicContact CB-CG2 3.7Å; P290-T334 HydrophobicContact CG-CG2 3.34Å; P290-V336 HydrophobicContact CG-CG2 4.08Å | ||
| 291 | V | 92.3 | Very high | 93.7 | Very high | 114 Ų | 114 | 42.7 Ų | 42.7 | 69% | 0.691 | 23% | 0.226 | S | C | * | . | trans | -70 | 120.7 | 172.3 | -179.8 | 0 | 0 | 0 | 0 | 109.1 | M293 | V291-M293 HydrophobicContact CG1-CB 4.43Å; V291-M293 HydrophobicContact CG1-CE 4.11Å | ||
| 292 | V | 94.6 | Very high | 93.6 | Very high | 0 Ų | 0 | 43.7 Ų | 43.7 | 0% | 0 | 23% | 0.231 | C | C | . | . | trans | -118.7 | 4.1 | -178.7 | -64.3 | 0 | 0 | 0 | 0 | 113.3 | C222 F243 P290 G294 L295 F317 T334 V336 | C222-V292 WeakPolarHBondContact CB-O 3.4Å; F243-V292 HydrophobicContact CD1-CG2 4.06Å; F243-V292 HydrophobicContact CE1-CG2 3.89Å; P290-V292 HydrophobicContact CG-CG1 4.46Å; P290-V292 PolarHBondContact O-N 3.45Å; V292-G294 PolarHBondContact O-N 2.71Å; V292-L295 HydrophobicContact CB-CD1 4.35Å; V292-L295 HydrophobicContact CG1-CD1 4.41Å; V292-L295 WeakPolarHBondContact O-CB 3.37Å; V292-L295 PolarHBondContact O-N 3.18Å; V292-L295 VanDerWaalsContact O-N 3.13Å; V292-F317 HydrophobicContact CB-CD1 4.04Å; V292-F317 HydrophobicContact CB-CD2 3.95Å; V292-F317 HydrophobicContact CB-CE1 4.08Å; V292-F317 HydrophobicContact CB-CE2 4.01Å; V292-F317 HydrophobicContact CB-CG 3.96Å; V292-F317 HydrophobicContact CB-CZ 4.08Å; V292-F317 HydrophobicContact CG1-CB 4.42Å; V292-F317 HydrophobicContact CG1-CD2 3.55Å; V292-F317 HydrophobicContact CG1-CE2 3.8Å; V292-F317 HydrophobicContact CG1-CG 3.93Å; V292-F317 HydrophobicContact CG1-CZ 4.38Å; V292-F317 HydrophobicContact CG2-CE1 4.16Å; V292-F317 HydrophobicContact CG2-CE2 4.08Å; V292-F317 HydrophobicContact CG2-CZ 3.88Å; V292-T334 HydrophobicContact CG1-CG2 3.94Å; V292-V336 HydrophobicContact CG1-CG2 3.75Å | ||
| 293 | M | 94.6 | Very high | 93.4 | Very high | 94 Ų | 94 | 47.9 Ų | 47.9 | 46% | 0.463 | 25% | 0.253 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -62.3 | 133.9 | 175.5 | -67.5 | -174.7 | -68.6 | 0 | 0 | 109.9 | L224 F225 V291 L295 | L224-M293 HydrophobicContact CD1-SD 4.21Å; F225-M293 HydrophobicContact CB-CG 4.2Å; V291-M293 HydrophobicContact CG1-CB 4.43Å; V291-M293 HydrophobicContact CG1-CE 4.11Å; M293-L295 VanDerWaalsContact C-N 3.29Å |
| 294 | G | 92.9 | Very high | 93.2 | Very high | 34 Ų | 34 | 51.4 Ų | 51.4 | 35% | 0.351 | 28% | 0.275 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 88.7 | -17 | -174.9 | 0 | 0 | 0 | 0 | 0 | 114.4 | K221 C222 V292 | K221-G294 WeakPolarHBondContact CE-O 3.36Å; C222-G294 PolarHBondContact O-N 3.12Å; V292-G294 PolarHBondContact O-N 2.71Å |
| 295 | L | 94 | Very high | 93.1 | Very high | 22 Ų | 22 | 49.6 Ų | 49.6 | 12% | 0.115 | 27% | 0.265 | C | S | . | . | P | Polyproline II helix | trans | -85.9 | 155.9 | -178.6 | -54 | -178.3 | 0 | 0 | 0 | 112.3 | C222 V292 M293 F317 D319 | C222-L295 PolarHBondContact N-O 3.16Å; V292-L295 HydrophobicContact CB-CD1 4.35Å; V292-L295 HydrophobicContact CG1-CD1 4.41Å; V292-L295 WeakPolarHBondContact O-CB 3.37Å; V292-L295 PolarHBondContact O-N 3.18Å; V292-L295 VanDerWaalsContact O-N 3.13Å; M293-L295 VanDerWaalsContact C-N 3.29Å; L295-F317 HydrophobicContact CB-CB 3.7Å; L295-F317 HydrophobicContact CB-CD1 4.12Å; L295-F317 HydrophobicContact CB-CG 4.32Å; L295-F317 HydrophobicContact CD1-CB 3.72Å; L295-F317 HydrophobicContact CG-CB 4.38Å; L295-D319 WeakPolarHBondContact CD2-OD1 3.43Å |
| 296 | T | 93.9 | Very high | 92.8 | Very high | 4 Ų | 4 | 51 Ų | 51 | 3% | 0.025 | 28% | 0.278 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -94.7 | 130.5 | 177.2 | -58.1 | 0 | 0 | 0 | 0 | 110.5 | T298 F317 Q318 P321 | T296-T298 PolarHBondContact O-N 2.62Å; T296-F317 CarbonylContact O-C 3.59Å; T296-F317 VanDerWaalsContact O-CA 3.29Å; T296-F317 WeakPolarHBondContact O-CA 3.49Å; T296-Q318 PolarHBondContact N-O 3.15Å; T296-Q318 PolarHBondContact O-N 3.08Å; T296-P321 HydrophobicContact CG2-CB 4.19Å |
| 297 | L | 93.6 | Very high | 92.5 | Very high | 0 Ų | 0 | 49 Ų | 49 | 0% | 0 | 28% | 0.275 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -74.4 | 119.5 | 176.3 | -173.2 | 72.6 | 0 | 0 | 0 | 110.5 | L217 N219 S220 F245 L299 F300 L315 F317 | L217-L297 HydrophobicContact CB-CD2 3.57Å; L217-L297 HydrophobicContact CD1-CD2 4.3Å; N219-L297 WeakPolarHBondContact CA-O 3.39Å; N219-L297 PolarHBondContact N-O 3.45Å; S220-L297 PolarHBondContact O-N 3.06Å; F245-L297 HydrophobicContact CD1-CB 4.44Å; F245-L297 HydrophobicContact CE1-CB 3.77Å; F245-L297 HydrophobicContact CE1-CD2 4.08Å; F245-L297 HydrophobicContact CE1-CG 4.37Å; F245-L297 HydrophobicContact CE2-CD2 4.49Å; F245-L297 HydrophobicContact CZ-CB 4.36Å; F245-L297 HydrophobicContact CZ-CD1 4.39Å; F245-L297 HydrophobicContact CZ-CD2 3.92Å; F245-L297 HydrophobicContact CZ-CG 4.47Å; L297-L299 VanDerWaalsContact CD1-O 3.3Å; L297-L299 WeakPolarHBondContact CD1-O 3.33Å; L297-F300 HydrophobicContact CD2-CB 4.15Å; L297-L315 HydrophobicContact CD1-CB 3.83Å; L297-L315 HydrophobicContact CD1-CD2 3.9Å; L297-L315 HydrophobicContact CD1-CG 4.37Å; L297-F317 HydrophobicContact CB-CD1 4.39Å; L297-F317 HydrophobicContact CB-CE1 4.27Å; L297-F317 HydrophobicContact CD1-CD1 4.16Å; L297-F317 HydrophobicContact CD1-CD2 4.48Å; L297-F317 HydrophobicContact CD1-CE1 3.79Å; L297-F317 HydrophobicContact CD1-CE2 4.14Å; L297-F317 HydrophobicContact CD1-CG 4.5Å; L297-F317 HydrophobicContact CD1-CZ 3.78Å |
| 298 | T | 91.6 | Very high | 92.1 | Very high | 15 Ų | 15 | 54.3 Ų | 54.3 | 9% | 0.092 | 30% | 0.301 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -112.5 | -21 | -177.7 | 59.6 | 0 | 0 | 0 | 0 | 113.1 | T296 V316 Q318 L322 | T296-T298 PolarHBondContact O-N 2.62Å; T298-V316 PolarHBondContact N-O 3.15Å; T298-V316 PolarHBondContact OG1-O 3.15Å; T298-Q318 HydrophobicContact CG2-CB 3.88Å; T298-Q318 HydrophobicContact CG2-CG 3.95Å; T298-L322 HydrophobicContact CG2-CD1 4.12Å; T298-L322 HydrophobicContact CG2-CG 3.81Å |
| 299 | L | 91.2 | Very high | 91.7 | Very high | 28 Ų | 28 | 56 Ų | 56 | 15% | 0.147 | 30% | 0.302 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -137 | 136 | 171 | -171.6 | 69.6 | 0 | 0 | 0 | 109.9 | L297 T301 L315 V316 | L297-L299 VanDerWaalsContact CD1-O 3.3Å; L297-L299 WeakPolarHBondContact CD1-O 3.33Å; L299-T301 HydrophobicContact CD1-CG2 3.91Å; L299-T301 HydrophobicContact CD2-CG2 4.36Å; L299-T301 HydrophobicContact CG-CG2 4.05Å; L299-L315 CarbonylContact O-C 3.56Å; L299-L315 VanDerWaalsContact O-CA 3.31Å; L299-L315 WeakPolarHBondContact O-CA 3.49Å; L299-V316 HydrophobicContact CB-CB 3.7Å; L299-V316 HydrophobicContact CB-CG2 3.78Å; L299-V316 HydrophobicContact CD2-CG2 3.73Å; L299-V316 HydrophobicContact CG-CG2 4.34Å; L299-V316 PolarHBondContact N-O 3.26Å; L299-V316 PolarHBondContact O-N 2.96Å |
| 300 | F | 93.5 | Very high | 91.4 | Very high | 9 Ų | 9 | 57.7 Ų | 57.7 | 4% | 0.039 | 31% | 0.31 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -132.3 | 129.5 | 162.9 | 176 | -160 | 0 | 0 | 0 | 106.3 | T213 P214 L217 L218 L279 L297 I302 V313 R314 L315 V344 | T213-F300 HydrophobicContact CG2-CB 4.41Å; T213-F300 HydrophobicContact CG2-CD1 4.11Å; T213-F300 HydrophobicContact CG2-CD2 4.24Å; T213-F300 HydrophobicContact CG2-CE1 4.46Å; T213-F300 HydrophobicContact CG2-CG 3.99Å; T213-F300 WeakPolarHBondContact CG2-O 3.35Å; P214-F300 HydrophobicContact CB-CE1 4.05Å; P214-F300 HydrophobicContact CG-CE1 3.93Å; P214-F300 WeakPolarHBondContact O-CD1 3.38Å; L217-F300 HydrophobicContact CD1-CD1 4.03Å; L217-F300 HydrophobicContact CD1-CE1 4.05Å; L218-F300 HydrophobicContact CD2-CB 4.5Å; L279-F300 HydrophobicContact CD1-CE1 4.23Å; L279-F300 HydrophobicContact CD1-CZ 3.92Å; L279-F300 HydrophobicContact CD2-CE2 4.48Å; L279-F300 HydrophobicContact CD2-CZ 4.32Å; L297-F300 HydrophobicContact CD2-CB 4.15Å; F300-I302 HydrophobicContact CE2-CD1 4.14Å; F300-I302 HydrophobicContact CE2-CG1 3.65Å; F300-I302 HydrophobicContact CZ-CD1 3.89Å; F300-I302 HydrophobicContact CZ-CG1 3.93Å; F300-V313 HydrophobicContact CD2-CG1 4.32Å; F300-V313 HydrophobicContact CE2-CG1 3.9Å; F300-R314 WeakPolarHBondContact CA-O 3.18Å; F300-L315 HydrophobicContact CB-CD2 3.99Å; F300-L315 HydrophobicContact CD2-CD2 3.37Å; F300-L315 HydrophobicContact CE2-CD2 4.05Å; F300-L315 HydrophobicContact CG-CD2 3.81Å; F300-V344 HydrophobicContact CZ-CG1 4.2Å |
| 301 | T | 93.9 | Very high | 91.3 | Very high | 32 Ų | 32 | 58.5 Ų | 58.5 | 20% | 0.196 | 31% | 0.308 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -142.4 | 138.1 | 173.9 | 55.2 | 0 | 0 | 0 | 0 | 110.5 | L299 V313 R314 | L299-T301 HydrophobicContact CD1-CG2 3.91Å; L299-T301 HydrophobicContact CD2-CG2 4.36Å; L299-T301 HydrophobicContact CG-CG2 4.05Å; T301-V313 WeakPolarHBondContact O-CA 3.39Å; T301-R314 PolarHBondContact N-O 2.77Å; T301-R314 PolarHBondContact O-N 2.72Å |
| 302 | I | 94 | Very high | 91.4 | Very high | 22 Ų | 22 | 57.1 Ų | 57.1 | 11% | 0.113 | 29% | 0.291 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -112.2 | 113.7 | 169.6 | -50.3 | 177 | 0 | 0 | 0 | 106.8 | P210 T213 F300 H311 R312 V313 V344 | P210-I302 HydrophobicContact CG-CD1 3.48Å; P210-I302 VanDerWaalsContact CG-CD1 3.48Å; T213-I302 HydrophobicContact CG2-CG1 4.44Å; T213-I302 PolarHBondContact OG1-N 2.9Å; F300-I302 HydrophobicContact CE2-CD1 4.14Å; F300-I302 HydrophobicContact CE2-CG1 3.65Å; F300-I302 HydrophobicContact CZ-CD1 3.89Å; F300-I302 HydrophobicContact CZ-CG1 3.93Å; I302-H311 HydrophobicContact CG2-CB 4.32Å; I302-R312 WeakPolarHBondContact CA-O 3.22Å; I302-V313 HydrophobicContact CG1-CG2 4.21Å; I302-V344 HydrophobicContact CD1-CB 4.33Å; I302-V344 HydrophobicContact CD1-CG1 4.06Å; I302-V344 HydrophobicContact CD1-CG2 4.3Å |
| 303 | N | 92.4 | Very high | 91.5 | Very high | 92 Ų | 92 | 57.1 Ų | 57.1 | 49% | 0.492 | 29% | 0.291 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -122.9 | 174.4 | -179.7 | -65.6 | -4.5 | 0 | 0 | 0 | 109.7 | H311 R312 | N303-H311 CarbonylContact O-C 3.38Å; N303-H311 WeakPolarHBondContact O-CA 3.18Å; N303-R312 PolarHBondContact N-O 2.94Å; N303-R312 PolarHBondContact O-N 3.19Å |
| 304 | V | 90.5 | Very high | 91.5 | Very high | 75 Ų | 75 | 56 Ų | 56 | 46% | 0.455 | 28% | 0.281 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -75.8 | 143 | 167.4 | -171.2 | 0 | 0 | 0 | 0 | 109.2 | M308 | V304-M308 HydrophobicContact CB-SD 4.25Å; V304-M308 HydrophobicContact CG1-CB 4.36Å; V304-M308 HydrophobicContact CG1-CE 4.25Å; V304-M308 HydrophobicContact CG1-SD 3.7Å |
| 305 | S | 89.5 | Confident | 91.7 | Very high | 3 Ų | 3 | 54.4 Ų | 54.4 | 2% | 0.021 | 27% | 0.265 | C | S | . | . | trans | -65.2 | 166.3 | 172.4 | 53.6 | 0 | 0 | 0 | 0 | 111.9 | D307 M308 H310 D339 | S305-D307 VanDerWaalsContact C-N 3.27Å; S305-D307 WeakPolarHBondContact CB-OD1 3.42Å; S305-D307 PolarHBondContact O-N 3.22Å; S305-D307 PolarHBondContact OG-OD1 3.24Å; S305-M308 PolarHBondContact O-N 3.13Å; S305-H310 PolarHBondContact N-O 3.07Å; S305-H310 VanDerWaalsContact OG-C 3.27Å; S305-H310 WeakPolarHBondContact OG-CA 3.19Å; S305-H310 WeakPolarHBondContact OG-CB 3.29Å; S305-H310 PolarHBondContact OG-N 2.96Å; S305-H310 PolarHBondContact OG-O 3.43Å; S305-D339 VanDerWaalsContact CB-OD1 3.25Å; S305-D339 WeakPolarHBondContact CB-OD1 3.47Å | ||
| 306 | T | 85.2 | Confident | 91.7 | Very high | 126 Ų | 126 | 54 Ų | 54 | 77% | 0.773 | 26% | 0.263 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -65.7 | -29.5 | -179.6 | 50.2 | 0 | 0 | 0 | 0 | 113.4 | M308 | T306-M308 PolarHBondContact O-N 3.24Š|
| 307 | D | 86.4 | Confident | 91.7 | Very high | 73 Ų | 73 | 53.9 Ų | 53.9 | 39% | 0.39 | 26% | 0.262 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -77.5 | -3.9 | 175.5 | 71 | -7 | 0 | 0 | 0 | 113.1 | S305 R309 H310 | S305-D307 VanDerWaalsContact C-N 3.27Å; S305-D307 WeakPolarHBondContact CB-OD1 3.42Å; S305-D307 PolarHBondContact O-N 3.22Å; S305-D307 PolarHBondContact OG-OD1 3.24Å; D307-R309 WeakPolarHBondContact O-CG 3.43Å; D307-R309 PolarHBondContact O-N 2.8Å; D307-R309 VanDerWaalsContact O-N 3.11Å; D307-R309 PolarHBondContact OD1-N 3.45Å; D307-H310 IonicContact OD1-ND1 3.66Å; D307-H310 IonicContact OD2-CE1 3.56Å; D307-H310 IonicContact OD2-ND1 2.98Å; D307-H310 PolarHBondContact OD2-ND1 3.16Å |
| 308 | M | 86.7 | Confident | 91.6 | Very high | 145 Ų | 145 | 56.3 Ų | 56.3 | 71% | 0.714 | 27% | 0.274 | S | S | * | . | S | Bend | trans | 59.8 | 12.7 | -177 | -59.6 | -68 | -72.6 | 0 | 0 | 115.2 | V304 S305 T306 | V304-M308 HydrophobicContact CB-SD 4.25Å; V304-M308 HydrophobicContact CG1-CB 4.36Å; V304-M308 HydrophobicContact CG1-CE 4.25Å; V304-M308 HydrophobicContact CG1-SD 3.7Å; S305-M308 PolarHBondContact O-N 3.13Å; T306-M308 PolarHBondContact O-N 3.24Å |
| 309 | R | 86.3 | Confident | 91.4 | Very high | 211 Ų | 211 | 62.6 Ų | 62.6 | 80% | 0.796 | 31% | 0.307 | S | S | * | . | S | Bend | trans | -103.6 | -23.3 | -176.5 | -68 | 171.3 | -176.8 | -135.7 | -0.1 | 113 | D307 | D307-R309 WeakPolarHBondContact O-CG 3.43Å; D307-R309 PolarHBondContact O-N 2.8Å; D307-R309 VanDerWaalsContact O-N 3.11Å; D307-R309 PolarHBondContact OD1-N 3.45Å |
| 310 | H | 88.6 | Confident | 90.8 | Very high | 57 Ų | 57 | 64.7 Ų | 64.7 | 26% | 0.264 | 32% | 0.324 | S | S | . | . | S | Bend | trans | -127.3 | 172.5 | -172.3 | -56.8 | 98.7 | 0 | 0 | 0 | 111.2 | S305 D307 P340 | S305-H310 PolarHBondContact N-O 3.07Å; S305-H310 VanDerWaalsContact OG-C 3.27Å; S305-H310 WeakPolarHBondContact OG-CA 3.19Å; S305-H310 WeakPolarHBondContact OG-CB 3.29Å; S305-H310 PolarHBondContact OG-N 2.96Å; S305-H310 PolarHBondContact OG-O 3.43Å; D307-H310 IonicContact OD1-ND1 3.66Å; D307-H310 IonicContact OD2-CE1 3.56Å; D307-H310 IonicContact OD2-ND1 2.98Å; D307-H310 PolarHBondContact OD2-ND1 3.16Å; H310-P340 HydrophobicContact CB-CB 3.53Å; H310-P340 VanDerWaalsContact CG-CB 3.4Å |
| 311 | H | 92.3 | Very high | 89.8 | Confident | 73 Ų | 73 | 66.1 Ų | 66.1 | 34% | 0.338 | 33% | 0.334 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -94.1 | 155.1 | 166.9 | -68.7 | 73.5 | 0 | 0 | 0 | 109.5 | L209 I302 N303 V341 | L209-H311 HydrophobicContact CD1-CB 4.46Å; L209-H311 VanDerWaalsContact CD1-ND1 3.32Å; L209-H311 WeakPolarHBondContact CD1-ND1 3.46Å; L209-H311 HydrophobicContact CD2-CB 4.44Å; I302-H311 HydrophobicContact CG2-CB 4.32Å; N303-H311 CarbonylContact O-C 3.38Å; N303-H311 WeakPolarHBondContact O-CA 3.18Å; H311-V341 HydrophobicContact CB-CB 4.16Å; H311-V341 VanDerWaalsContact O-CB 3.23Å; H311-V341 WeakPolarHBondContact O-CB 3.48Å; H311-V341 WeakPolarHBondContact O-CG2 3.34Å; H311-V341 PolarHBondContact O-N 3.49Å |
| 312 | R | 94.3 | Very high | 88.6 | Confident | 84 Ų | 84 | 68.6 Ų | 68.6 | 32% | 0.317 | 35% | 0.345 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -126.4 | 126.5 | 175.6 | 172.8 | 176 | 177.6 | -172.9 | 3.7 | 108.6 | I302 N303 V337 L338 D339 | I302-R312 WeakPolarHBondContact CA-O 3.22Å; N303-R312 PolarHBondContact N-O 2.94Å; N303-R312 PolarHBondContact O-N 3.19Å; R312-V337 HydrophobicContact CG-CG1 4.14Å; R312-L338 WeakPolarHBondContact CA-O 3.33Å; R312-D339 HydrophobicContact CB-CB 4.28Å; R312-D339 HydrophobicContact CG-CB 4.04Å |
| 313 | V | 96.1 | Very high | 87.3 | Confident | 0 Ų | 0 | 74 Ų | 74 | 0% | 0 | 37% | 0.37 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -100 | 129.5 | 173 | 168.5 | 0 | 0 | 0 | 0 | 108.8 | V281 F300 T301 I302 L315 V337 L338 V341 V344 | V281-V313 HydrophobicContact CG1-CB 4.39Å; V281-V313 HydrophobicContact CG1-CG2 4.1Å; V281-V313 HydrophobicContact CG2-CG1 4.29Å; V281-V313 HydrophobicContact CG2-CG2 4.39Å; F300-V313 HydrophobicContact CD2-CG1 4.32Å; F300-V313 HydrophobicContact CE2-CG1 3.9Å; T301-V313 WeakPolarHBondContact O-CA 3.39Å; I302-V313 HydrophobicContact CG1-CG2 4.21Å; V313-L315 HydrophobicContact CG1-CD2 4.18Å; V313-L315 HydrophobicContact CG1-CG 4.06Å; V313-V337 WeakPolarHBondContact O-CA 3.44Å; V313-L338 HydrophobicContact CB-CB 4.27Å; V313-L338 PolarHBondContact N-O 2.98Å; V313-L338 PolarHBondContact O-N 2.79Å; V313-V341 HydrophobicContact CB-CG2 4.14Å; V313-V341 HydrophobicContact CG2-CG1 4.33Å; V313-V341 HydrophobicContact CG2-CG2 3.89Å; V313-V344 HydrophobicContact CG2-CG2 3.58Å |
| 314 | R | 95.4 | Very high | 85.6 | Confident | 72 Ų | 72 | 81.8 Ų | 81.8 | 27% | 0.272 | 39% | 0.393 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -120.6 | 128.4 | 170.9 | -178.8 | -175.4 | -173.8 | -159.9 | 3.6 | 109.4 | F300 T301 Q335 V336 V337 | F300-R314 WeakPolarHBondContact CA-O 3.18Å; T301-R314 PolarHBondContact N-O 2.77Å; T301-R314 PolarHBondContact O-N 2.72Å; R314-Q335 VanDerWaalsContact NE-OE1 3.16Å; R314-V336 WeakPolarHBondContact CA-O 3.38Å; R314-V337 HydrophobicContact CG-CG2 4.27Å |
| 315 | L | 95.7 | Very high | 84 | Confident | 0 Ų | 0 | 82 Ų | 82 | 0% | 0 | 41% | 0.41 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -119.6 | 138.5 | 174.4 | -54.7 | 171.9 | 0 | 0 | 0 | 108.4 | F243 L279 L297 L299 F300 V313 F317 Q335 V336 | F243-L315 HydrophobicContact CD2-CD1 4.32Å; F243-L315 HydrophobicContact CE1-CD1 4.38Å; F243-L315 HydrophobicContact CE2-CD1 4.03Å; F243-L315 HydrophobicContact CZ-CD1 4.06Å; L279-L315 HydrophobicContact CD2-CD1 4.07Å; L279-L315 HydrophobicContact CD2-CD2 3.97Å; L297-L315 HydrophobicContact CD1-CB 3.83Å; L297-L315 HydrophobicContact CD1-CD2 3.9Å; L297-L315 HydrophobicContact CD1-CG 4.37Å; L299-L315 CarbonylContact O-C 3.56Å; L299-L315 VanDerWaalsContact O-CA 3.31Å; L299-L315 WeakPolarHBondContact O-CA 3.49Å; F300-L315 HydrophobicContact CB-CD2 3.99Å; F300-L315 HydrophobicContact CD2-CD2 3.37Å; F300-L315 HydrophobicContact CE2-CD2 4.05Å; F300-L315 HydrophobicContact CG-CD2 3.81Å; V313-L315 HydrophobicContact CG1-CD2 4.18Å; V313-L315 HydrophobicContact CG1-CG 4.06Å; L315-F317 HydrophobicContact CB-CD2 4.27Å; L315-F317 HydrophobicContact CB-CE2 3.5Å; L315-F317 HydrophobicContact CB-CZ 4.06Å; L315-F317 HydrophobicContact CD1-CE2 4.13Å; L315-F317 HydrophobicContact CD1-CZ 4.07Å; L315-F317 HydrophobicContact CG-CE2 4.45Å; L315-Q335 WeakPolarHBondContact O-CA 3.32Å; L315-V336 HydrophobicContact CB-CB 4.25Å; L315-V336 PolarHBondContact N-O 2.94Å; L315-V336 PolarHBondContact O-N 3.23Å |
| 316 | V | 94.6 | Very high | 82.5 | Confident | 14 Ų | 14 | 90.3 Ų | 90.3 | 9% | 0.085 | 45% | 0.446 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -124 | 130.2 | 172.3 | -175.3 | 0 | 0 | 0 | 0 | 108.5 | T298 L299 Q335 | T298-V316 PolarHBondContact N-O 3.15Å; T298-V316 PolarHBondContact OG1-O 3.15Å; L299-V316 HydrophobicContact CB-CB 3.7Å; L299-V316 HydrophobicContact CB-CG2 3.78Å; L299-V316 HydrophobicContact CD2-CG2 3.73Å; L299-V316 HydrophobicContact CG-CG2 4.34Å; L299-V316 PolarHBondContact N-O 3.26Å; L299-V316 PolarHBondContact O-N 2.96Å; V316-Q335 HydrophobicContact CG2-CG 4.2Å |
| 317 | F | 94.3 | Very high | 81 | Confident | 0 Ų | 0 | 94 Ų | 94 | 0% | 0 | 45% | 0.451 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -116.7 | 145.7 | -177.1 | -64 | -93.8 | 0 | 0 | 0 | 110.8 | C222 F243 F245 V292 L295 T296 L297 L315 G333 T334 V336 | C222-F317 HydrophobicContact CB-CD1 4.46Å; C222-F317 HydrophobicContact CB-CE1 3.95Å; F243-F317 HydrophobicContact CD1-CZ 4.31Å; F243-F317 HydrophobicContact CE1-CZ 4.45Å; F245-F317 AromaticContact CE1-CE1 3.79Å; F245-F317 HydrophobicContact CE1-CE1 3.79Å; F245-F317 HydrophobicContact CE1-CZ 4.42Å; F245-F317 AromaticContact CZ-CE1 3.98Å; F245-F317 HydrophobicContact CZ-CE1 3.98Å; F245-F317 HydrophobicContact CZ-CZ 4.15Å; V292-F317 HydrophobicContact CB-CD1 4.04Å; V292-F317 HydrophobicContact CB-CD2 3.95Å; V292-F317 HydrophobicContact CB-CE1 4.08Å; V292-F317 HydrophobicContact CB-CE2 4.01Å; V292-F317 HydrophobicContact CB-CG 3.96Å; V292-F317 HydrophobicContact CB-CZ 4.08Å; V292-F317 HydrophobicContact CG1-CB 4.42Å; V292-F317 HydrophobicContact CG1-CD2 3.55Å; V292-F317 HydrophobicContact CG1-CE2 3.8Å; V292-F317 HydrophobicContact CG1-CG 3.93Å; V292-F317 HydrophobicContact CG1-CZ 4.38Å; V292-F317 HydrophobicContact CG2-CE1 4.16Å; V292-F317 HydrophobicContact CG2-CE2 4.08Å; V292-F317 HydrophobicContact CG2-CZ 3.88Å; L295-F317 HydrophobicContact CB-CB 3.7Å; L295-F317 HydrophobicContact CB-CD1 4.12Å; L295-F317 HydrophobicContact CB-CG 4.32Å; L295-F317 HydrophobicContact CD1-CB 3.72Å; L295-F317 HydrophobicContact CG-CB 4.38Å; T296-F317 CarbonylContact O-C 3.59Å; T296-F317 VanDerWaalsContact O-CA 3.29Å; T296-F317 WeakPolarHBondContact O-CA 3.49Å; L297-F317 HydrophobicContact CB-CD1 4.39Å; L297-F317 HydrophobicContact CB-CE1 4.27Å; L297-F317 HydrophobicContact CD1-CD1 4.16Å; L297-F317 HydrophobicContact CD1-CD2 4.48Å; L297-F317 HydrophobicContact CD1-CE1 3.79Å; L297-F317 HydrophobicContact CD1-CE2 4.14Å; L297-F317 HydrophobicContact CD1-CG 4.5Å; L297-F317 HydrophobicContact CD1-CZ 3.78Å; L315-F317 HydrophobicContact CB-CD2 4.27Å; L315-F317 HydrophobicContact CB-CE2 3.5Å; L315-F317 HydrophobicContact CB-CZ 4.06Å; L315-F317 HydrophobicContact CD1-CE2 4.13Å; L315-F317 HydrophobicContact CD1-CZ 4.07Å; L315-F317 HydrophobicContact CG-CE2 4.45Å; F317-G333 CarbonylContact O-C 3.48Å; F317-G333 WeakPolarHBondContact O-CA 3.31Å; F317-T334 PolarHBondContact N-O 2.79Å; F317-T334 PolarHBondContact O-N 3.45Å; F317-V336 HydrophobicContact CD2-CG2 4.24Å; F317-V336 HydrophobicContact CE2-CB 4.27Å; F317-V336 HydrophobicContact CE2-CG2 3.87Å |
| 318 | Q | 92.1 | Very high | 79.6 | Confident | 52 Ų | 52 | 101 Ų | 101 | 24% | 0.243 | 47% | 0.472 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -139.3 | 159.4 | 177.5 | -67.6 | -177.5 | -15.6 | 0 | 0 | 110.6 | T296 T298 S320 | T296-Q318 PolarHBondContact N-O 3.15Å; T296-Q318 PolarHBondContact O-N 3.08Å; T298-Q318 HydrophobicContact CG2-CB 3.88Å; T298-Q318 HydrophobicContact CG2-CG 3.95Å; Q318-S320 VanDerWaalsContact C-N 3.26Å; Q318-S320 PolarHBondContact O-N 3.38Å |
| 319 | D | 86.8 | Confident | 77.8 | Confident | 147 Ų | 147 | 97.3 Ų | 97.3 | 79% | 0.786 | 47% | 0.471 | S | S | * | . | S | Bend | trans | -66.7 | -26.5 | 179.3 | -64 | -53 | 0 | 0 | 0 | 113.3 | L295 | L295-D319 WeakPolarHBondContact CD2-OD1 3.43Š|
| 320 | S | 78.3 | Confident | 76.1 | Confident | 72 Ų | 72 | 93.8 Ų | 93.8 | 50% | 0.503 | 47% | 0.468 | S | S | . | . | S | Bend | trans | -130.4 | 149.7 | -177.9 | 64.5 | 0 | 0 | 0 | 0 | 112.6 | Q318 | Q318-S320 VanDerWaalsContact C-N 3.26Å; Q318-S320 PolarHBondContact O-N 3.38Å |
| 321 | P | 73.1 | Confident | 74.6 | Confident | 38 Ų | 38 | 98.1 Ų | 98.1 | 25% | 0.247 | 49% | 0.488 | C | S | . | . | P | Polyproline II helix | trans | -62 | 149.8 | 173.8 | 27.8 | -35.4 | 0 | 0 | 0 | 111.5 | N219 T296 Q323 | N219-P321 HydrophobicContact CB-CB 4.38Å; T296-P321 HydrophobicContact CG2-CB 4.19Å; P321-Q323 PolarHBondContact O-N 3.15Å |
| 322 | L | 68.8 | Low | 73.4 | Confident | 85 Ų | 85 | 98.3 Ų | 98.3 | 45% | 0.445 | 51% | 0.51 | S | S | . | . | P | Polyproline II helix | trans | -69.1 | 119.2 | 176.7 | -73.8 | 170.8 | 0 | 0 | 0 | 109.9 | N219 T298 R324 | N219-L322 PolarHBondContact OD1-N 2.8Å; T298-L322 HydrophobicContact CG2-CD1 4.12Å; T298-L322 HydrophobicContact CG2-CG 3.81Å; L322-R324 PolarHBondContact O-N 3.21Å |
| 323 | Q | 65.4 | Low | 72.9 | Confident | 134 Ų | 134 | 94.9 Ų | 94.9 | 63% | 0.626 | 50% | 0.501 | S | S | * | . | P | Polyproline II helix | trans | -66.9 | 126.4 | 172.2 | -68.2 | -65.9 | -21.4 | 0 | 0 | 109.8 | P321 G325 K326 | P321-Q323 PolarHBondContact O-N 3.15Å; Q323-G325 PolarHBondContact O-N 3.3Å; Q323-G325 VanDerWaalsContact O-N 3.11Å; Q323-K326 PolarHBondContact O-N 2.98Å |
| 324 | R | 57.5 | Low | 72.8 | Confident | 257 Ų | 257 | 97.5 Ų | 97.5 | 97% | 0.97 | 52% | 0.517 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -57.1 | 117.1 | -179.3 | -174.7 | -176.4 | -99 | -149.5 | -2.8 | 109.2 | L322 | L322-R324 PolarHBondContact O-N 3.21Š|
| 325 | G | 56.9 | Low | 72.7 | Confident | 80 Ų | 80 | 97.5 Ų | 97.5 | 83% | 0.825 | 52% | 0.52 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 106.8 | -10.4 | 175.3 | 0 | 0 | 0 | 0 | 0 | 116.3 | Q323 | Q323-G325 PolarHBondContact O-N 3.3Å; Q323-G325 VanDerWaalsContact O-N 3.11Å |
| 326 | K | 57.3 | Low | 72.8 | Confident | 176 Ų | 176 | 97.6 Ų | 97.6 | 77% | 0.765 | 52% | 0.52 | S | S | * | . | trans | -75.6 | 129.1 | 168.4 | -78.7 | -171.6 | 176.8 | -177.6 | 0 | 109.8 | Q323 | Q323-K326 PolarHBondContact O-N 2.98Š| ||
| 327 | K | 54.4 | Low | 72.8 | Confident | 204 Ų | 204 | 99.1 Ų | 99.1 | 89% | 0.887 | 53% | 0.529 | S | S | * | . | trans | -54.5 | 150.5 | 170.9 | -70.3 | -176.4 | 178.5 | 179.4 | 0 | 109.2 | G329 | K327-G329 PolarHBondContact O-N 3.38Š| ||
| 328 | R | 56.2 | Low | 72.9 | Confident | 221 Ų | 221 | 99.1 Ų | 99.1 | 83% | 0.834 | 53% | 0.529 | S | S | * | . | trans | -62.1 | 69.1 | 169.4 | -70.7 | -176.5 | -177.3 | -146.3 | 0.9 | 109.6 | D330 | R328-D330 PolarHBondContact O-N 3.32Š| ||
| 329 | G | 48.7 | Very low | 73.1 | Confident | 66 Ų | 66 | 98.8 Ų | 98.8 | 68% | 0.68 | 53% | 0.529 | S | S | * | . | trans | -75.7 | 111.4 | 174.8 | 0 | 0 | 0 | 0 | 0 | 108.2 | K327 | K327-G329 PolarHBondContact O-N 3.38Š| ||
| 330 | D | 51.1 | Low | 73.4 | Confident | 138 Ų | 138 | 92.7 Ų | 92.7 | 74% | 0.738 | 50% | 0.498 | S | S | * | . | trans | 43.9 | 142 | 169.4 | -135.2 | -1.1 | 0 | 0 | 0 | 120.8 | R328 G332 | R328-D330 PolarHBondContact O-N 3.32Å; D330-G332 PolarHBondContact O-N 3.37Å | ||
| 331 | Q | 57.8 | Low | 74.2 | Confident | 147 Ų | 147 | 89.4 Ų | 89.4 | 69% | 0.687 | 48% | 0.475 | S | S | * | . | trans | -79.3 | 39.6 | -157.9 | -59.9 | 167.4 | 55.1 | 0 | 0 | 114.5 | G333 | Q331-G333 VanDerWaalsContact C-N 3.28Å; Q331-G333 PolarHBondContact O-N 3.38Å; Q331-G333 VanDerWaalsContact O-N 3.11Å | ||
| 332 | G | 67.7 | Low | 75.1 | Confident | 77 Ų | 77 | 91.3 Ų | 91.3 | 79% | 0.794 | 48% | 0.48 | S | S | * | . | trans | -82.3 | 28.6 | -171.5 | 0 | 0 | 0 | 0 | 0 | 116.6 | D330 | D330-G332 PolarHBondContact O-N 3.37Š| ||
| 333 | G | 83.1 | Confident | 76.2 | Confident | 12 Ų | 12 | 87.7 Ų | 87.7 | 12% | 0.124 | 46% | 0.462 | C | S | . | . | S | Bend | trans | -103.3 | 149.5 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.7 | F317 Q331 Q335 | F317-G333 CarbonylContact O-C 3.48Å; F317-G333 WeakPolarHBondContact O-CA 3.31Å; Q331-G333 VanDerWaalsContact C-N 3.28Å; Q331-G333 PolarHBondContact O-N 3.38Å; Q331-G333 VanDerWaalsContact O-N 3.11Å; G333-Q335 VanDerWaalsContact O-CG 3.31Å; G333-Q335 WeakPolarHBondContact O-CG 3.35Å; G333-Q335 PolarHBondContact O-N 3.47Å |
| 334 | T | 93.3 | Very high | 77.6 | Confident | 56 Ų | 56 | 81.6 Ų | 81.6 | 34% | 0.344 | 43% | 0.434 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -61.3 | 118.3 | 172.6 | -55.6 | 0 | 0 | 0 | 0 | 109.4 | P290 V292 F317 | P290-T334 HydrophobicContact CB-CG2 3.7Å; P290-T334 HydrophobicContact CG-CG2 3.34Å; V292-T334 HydrophobicContact CG1-CG2 3.94Å; F317-T334 PolarHBondContact N-O 2.79Å; F317-T334 PolarHBondContact O-N 3.45Å |
| 335 | Q | 94.7 | Very high | 79.3 | Confident | 72 Ų | 72 | 73 Ų | 73 | 34% | 0.336 | 40% | 0.404 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -99.1 | 135.3 | -177.3 | -52.9 | -166.9 | 27.8 | 0 | 0 | 110.8 | R314 L315 V316 G333 | R314-Q335 VanDerWaalsContact NE-OE1 3.16Å; L315-Q335 WeakPolarHBondContact O-CA 3.32Å; V316-Q335 HydrophobicContact CG2-CG 4.2Å; G333-Q335 VanDerWaalsContact O-CG 3.31Å; G333-Q335 WeakPolarHBondContact O-CG 3.35Å; G333-Q335 PolarHBondContact O-N 3.47Å |
| 336 | V | 96.1 | Very high | 81 | Confident | 1 Ų | 1 | 72 Ų | 72 | 1% | 0.006 | 38% | 0.379 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -117.8 | 123.9 | 169.1 | 176.1 | 0 | 0 | 0 | 0 | 107.6 | F243 I289 P290 V292 R314 L315 F317 L338 | F243-V336 HydrophobicContact CZ-CG1 4.3Å; I289-V336 HydrophobicContact CB-CG1 4.04Å; I289-V336 HydrophobicContact CB-CG2 4.33Å; I289-V336 HydrophobicContact CD1-CG1 4.02Å; I289-V336 HydrophobicContact CD1-CG2 4.35Å; I289-V336 HydrophobicContact CG2-CG1 3.72Å; P290-V336 HydrophobicContact CG-CG2 4.08Å; V292-V336 HydrophobicContact CG1-CG2 3.75Å; R314-V336 WeakPolarHBondContact CA-O 3.38Å; L315-V336 HydrophobicContact CB-CB 4.25Å; L315-V336 PolarHBondContact N-O 2.94Å; L315-V336 PolarHBondContact O-N 3.23Å; F317-V336 HydrophobicContact CD2-CG2 4.24Å; F317-V336 HydrophobicContact CE2-CB 4.27Å; F317-V336 HydrophobicContact CE2-CG2 3.87Å; V336-L338 HydrophobicContact CG1-CD2 4.27Å; V336-L338 HydrophobicContact CG1-CG 4.21Å |
| 337 | V | 96.1 | Very high | 82.7 | Confident | 46 Ų | 46 | 63.7 Ų | 63.7 | 28% | 0.279 | 34% | 0.343 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -119.5 | 124.4 | 176.9 | 176.1 | 0 | 0 | 0 | 0 | 108.2 | R312 V313 R314 D339 | R312-V337 HydrophobicContact CG-CG1 4.14Å; V313-V337 WeakPolarHBondContact O-CA 3.44Å; R314-V337 HydrophobicContact CG-CG2 4.27Å; V337-D339 HydrophobicContact CG1-CB 4.48Å |
| 338 | L | 96.4 | Very high | 84.5 | Confident | 0 Ų | 0 | 56.6 Ų | 56.6 | 0% | 0 | 32% | 0.315 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -115.4 | 117.2 | 175.4 | -57.8 | 174.7 | 0 | 0 | 0 | 108 | F241 F243 V281 T283 I287 I289 R312 V313 V336 V341 | F241-L338 HydrophobicContact CB-CD1 3.97Å; F241-L338 HydrophobicContact CD1-CD2 3.89Å; F241-L338 HydrophobicContact CD2-CD1 4.47Å; F241-L338 HydrophobicContact CD2-CD2 4.08Å; F241-L338 HydrophobicContact CE1-CD2 4.05Å; F241-L338 HydrophobicContact CE2-CD2 4.24Å; F241-L338 HydrophobicContact CG-CD1 4.11Å; F241-L338 HydrophobicContact CG-CD2 3.92Å; F241-L338 HydrophobicContact CZ-CD2 4.24Å; F243-L338 HydrophobicContact CE2-CD1 4.28Å; V281-L338 HydrophobicContact CB-CD1 3.61Å; V281-L338 HydrophobicContact CG1-CB 4.21Å; V281-L338 HydrophobicContact CG1-CD1 3.56Å; V281-L338 HydrophobicContact CG2-CD1 3.98Å; T283-L338 HydrophobicContact CG2-CB 3.92Å; I287-L338 HydrophobicContact CB-CD2 4.31Å; I287-L338 HydrophobicContact CD1-CB 4.36Å; I287-L338 HydrophobicContact CD1-CD2 4.09Å; I287-L338 HydrophobicContact CG2-CD2 4.43Å; I289-L338 HydrophobicContact CG2-CD2 3.99Å; R312-L338 WeakPolarHBondContact CA-O 3.33Å; V313-L338 HydrophobicContact CB-CB 4.27Å; V313-L338 PolarHBondContact N-O 2.98Å; V313-L338 PolarHBondContact O-N 2.79Å; V336-L338 HydrophobicContact CG1-CD2 4.27Å; V336-L338 HydrophobicContact CG1-CG 4.21Å; L338-V341 HydrophobicContact CB-CG2 4.15Å; L338-V341 WeakPolarHBondContact O-CG2 3.34Å |
| 339 | D | 94.8 | Very high | 86.3 | Confident | 45 Ų | 45 | 47.9 Ų | 47.9 | 24% | 0.241 | 28% | 0.282 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -158.6 | 125.1 | -175.9 | -166.7 | -6 | 0 | 0 | 0 | 108.2 | I287 S305 R312 V337 | I287-D339 WeakPolarHBondContact CD1-O 3.02Å; S305-D339 VanDerWaalsContact CB-OD1 3.25Å; S305-D339 WeakPolarHBondContact CB-OD1 3.47Å; R312-D339 HydrophobicContact CB-CB 4.28Å; R312-D339 HydrophobicContact CG-CB 4.04Å; V337-D339 HydrophobicContact CG1-CB 4.48Å |
| 340 | P | 94.1 | Very high | 88.3 | Confident | 19 Ų | 19 | 48.1 Ų | 48.1 | 12% | 0.123 | 26% | 0.262 | C | S | . | . | E | Extended strand (participates in β ladder) | cis | -86.1 | 136.9 | 1.3 | 33 | -34.6 | 0 | 0 | 0 | 113.6 | T283 L284 H310 | T283-P340 VanDerWaalsContact CA-O 3.25Å; T283-P340 WeakPolarHBondContact CA-O 3.32Å; T283-P340 VanDerWaalsContact CB-O 3.32Å; T283-P340 WeakPolarHBondContact CB-O 3.47Å; L284-P340 HydrophobicContact CB-CG 3.9Å; L284-P340 HydrophobicContact CD1-CB 4.22Å; L284-P340 HydrophobicContact CD1-CG 3.74Å; L284-P340 HydrophobicContact CG-CB 4.49Å; L284-P340 HydrophobicContact CG-CG 3.91Å; L284-P340 PolarHBondContact N-O 3.49Å; H310-P340 HydrophobicContact CB-CB 3.53Å; H310-P340 VanDerWaalsContact CG-CB 3.4Å |
| 341 | V | 94.3 | Very high | 90.3 | Very high | 4 Ų | 4 | 42.6 Ų | 42.6 | 2% | 0.024 | 23% | 0.232 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -92.7 | 129.4 | 178.7 | 178.8 | 0 | 0 | 0 | 0 | 110.8 | L209 V281 T283 H311 V313 L338 V344 | L209-V341 HydrophobicContact CD2-CG1 4.36Å; V281-V341 HydrophobicContact CG1-CG1 3.82Å; V281-V341 HydrophobicContact CG1-CG2 3.9Å; T283-V341 HydrophobicContact CG2-CG2 4.32Å; H311-V341 HydrophobicContact CB-CB 4.16Å; H311-V341 VanDerWaalsContact O-CB 3.23Å; H311-V341 WeakPolarHBondContact O-CB 3.48Å; H311-V341 WeakPolarHBondContact O-CG2 3.34Å; H311-V341 PolarHBondContact O-N 3.49Å; V313-V341 HydrophobicContact CB-CG2 4.14Å; V313-V341 HydrophobicContact CG2-CG1 4.33Å; V313-V341 HydrophobicContact CG2-CG2 3.89Å; L338-V341 HydrophobicContact CB-CG2 4.15Å; L338-V341 WeakPolarHBondContact O-CG2 3.34Å; V341-V344 HydrophobicContact CG1-CG2 3.66Å |
| 342 | H | 91.8 | Very high | 91.9 | Very high | 78 Ų | 78 | 37 Ų | 37 | 36% | 0.361 | 21% | 0.208 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -89.2 | -44.1 | 173.3 | -177.9 | 72.5 | 0 | 0 | 0 | 112.2 | T282 L284 | T282-H342 HydrophobicContact CG2-CB 4.3Å; T282-H342 PolarHBondContact O-N 3.25Å; L284-H342 HydrophobicContact CD2-CB 4.23Å |
| 343 | S | 92.9 | Very high | 92.9 | Very high | 9 Ų | 9 | 38.1 Ų | 38.1 | 6% | 0.063 | 20% | 0.196 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -154.5 | 153.1 | -179.9 | 68.6 | 0 | 0 | 0 | 0 | 112.4 | A208 T282 | A208-S343 CarbonylContact O-C 3.57Å; A208-S343 WeakPolarHBondContact O-CA 3.24Å; A208-S343 VanDerWaalsContact O-CB 3.28Å; A208-S343 WeakPolarHBondContact O-CB 3.28Å; T282-S343 WeakPolarHBondContact CB-OG 3.35Å; T282-S343 PolarHBondContact N-O 3.11Å; T282-S343 PolarHBondContact O-N 2.94Å; T282-S343 PolarHBondContact OG1-OG 3.39Å |
| 344 | V | 94.6 | Very high | 93.3 | Very high | 5 Ų | 5 | 37.9 Ų | 37.9 | 3% | 0.03 | 19% | 0.191 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -130.9 | 122 | 175.8 | -179.8 | 0 | 0 | 0 | 0 | 108.9 | A208 L209 L279 Q280 V281 F300 I302 V313 V341 | A208-V344 PolarHBondContact O-N 2.97Å; A208-V344 VanDerWaalsContact O-O 3.12Å; L209-V344 HydrophobicContact CD2-CB 3.99Å; L209-V344 HydrophobicContact CD2-CG2 3.68Å; L279-V344 HydrophobicContact CD1-CG1 3.77Å; Q280-V344 WeakPolarHBondContact O-CA 3.45Å; V281-V344 HydrophobicContact CG1-CG2 4.31Å; V281-V344 HydrophobicContact CG2-CG1 4.47Å; V281-V344 HydrophobicContact CG2-CG2 4.44Å; F300-V344 HydrophobicContact CZ-CG1 4.2Å; I302-V344 HydrophobicContact CD1-CB 4.33Å; I302-V344 HydrophobicContact CD1-CG1 4.06Å; I302-V344 HydrophobicContact CD1-CG2 4.3Å; V313-V344 HydrophobicContact CG2-CG2 3.58Å; V341-V344 HydrophobicContact CG1-CG2 3.66Å |
| 345 | K | 93.1 | Very high | 92.9 | Very high | 77 Ų | 77 | 36.8 Ų | 36.8 | 34% | 0.335 | 19% | 0.185 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -123.2 | 130.7 | 178.2 | -63 | 179.5 | -177.3 | 176.2 | 0 | 110 | Q280 M347 | Q280-K345 HydrophobicContact CB-CB 4.43Å; Q280-K345 PolarHBondContact N-O 3.17Å; Q280-K345 PolarHBondContact O-N 2.87Å; K345-M347 HydrophobicContact CB-CG 4.5Å |
| 346 | L | 93 | Very high | 91.7 | Very high | 59 Ų | 59 | 36.4 Ų | 36.4 | 31% | 0.309 | 19% | 0.19 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -107.1 | 117.7 | 169.2 | 179.8 | 59 | 0 | 0 | 0 | 108.5 | P214 T216 L217 C277 | P214-L346 HydrophobicContact CB-CD2 4.01Å; P214-L346 HydrophobicContact CG-CD2 4.48Å; T216-L346 WeakPolarHBondContact OG1-CD2 3.4Å; L217-L346 HydrophobicContact CD1-CD1 3.99Å; L217-L346 HydrophobicContact CD2-CD1 3.76Å; L217-L346 HydrophobicContact CG-CD1 4.02Å; L217-L346 HydrophobicContact CG-CD2 4.41Å; C277-L346 HydrophobicContact CB-CD1 4.15Å |
| 347 | M | 92.9 | Very high | 89.9 | Confident | 1 Ų | 1 | 39.1 Ų | 39.1 | 1% | 0.005 | 20% | 0.204 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -116.9 | 116.6 | -173.8 | -64.8 | 170.8 | -73.9 | 0 | 0 | 109.8 | C277 V278 Q280 K345 H351 L353 Y354 | C277-M347 CarbonylContact C-O 3.56Å; C277-M347 VanDerWaalsContact CA-O 3.25Å; C277-M347 WeakPolarHBondContact CA-O 3.35Å; V278-M347 HydrophobicContact CB-CE 4.2Å; V278-M347 HydrophobicContact CG1-CE 3.79Å; V278-M347 PolarHBondContact N-O 2.69Å; V278-M347 PolarHBondContact O-N 2.73Å; Q280-M347 HydrophobicContact CB-CE 3.44Å; Q280-M347 VanDerWaalsContact CB-CE 3.44Å; Q280-M347 HydrophobicContact CG-CE 4.42Å; K345-M347 HydrophobicContact CB-CG 4.5Å; M347-H351 HydrophobicContact CB-CB 3.93Å; M347-H351 HydrophobicContact CG-CB 4.39Å; M347-L353 HydrophobicContact SD-CB 3.79Å; M347-Y354 HydrophobicContact CB-CD2 4.45Å |
| 348 | D | 92.3 | Very high | 87.5 | Confident | 55 Ų | 55 | 41.6 Ų | 41.6 | 29% | 0.294 | 22% | 0.221 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -68.7 | 162.2 | 168.4 | -70.8 | -42.5 | 0 | 0 | 0 | 111.1 | W350 H351 Y354 | D348-W350 HydrophobicContact CB-CD2 4.18Å; D348-W350 HydrophobicContact CB-CG 4.33Å; D348-W350 HydrophobicContact CB-CZ2 3.99Å; D348-W350 VanDerWaalsContact CB-NE1 3.34Å; D348-W350 PolarHBondContact O-N 2.89Å; D348-W350 WeakPolarHBondContact OD2-CZ2 3.33Å; D348-H351 WeakPolarHBondContact O-CB 3.31Å; D348-H351 PolarHBondContact O-N 2.93Å; D348-Y354 WeakPolarHBondContact O-CD2 3.17Å |
| 349 | W | 92.8 | Very high | 84.5 | Confident | 39 Ų | 39 | 51.5 Ų | 51.5 | 15% | 0.148 | 26% | 0.26 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -53.6 | -24.4 | -178.8 | 66 | -97.4 | 0 | 0 | 0 | 115.3 | A186 I189 R190 D273 C276 Y354 | A186-W349 HydrophobicContact CB-CH2 4.42Å; A186-W349 HydrophobicContact CB-CZ3 3.9Å; I189-W349 HydrophobicContact CB-CH2 4.08Å; I189-W349 HydrophobicContact CB-CZ3 4.41Å; I189-W349 HydrophobicContact CD1-CH2 4.04Å; I189-W349 HydrophobicContact CG2-CH2 3.78Å; I189-W349 HydrophobicContact CG2-CZ3 4.21Å; R190-W349 HydrophobicContact CG-CE3 4.29Å; R190-W349 HydrophobicContact CG-CZ3 4.17Å; D273-W349 HydrophobicContact CB-CB 3.73Å; D273-W349 VanDerWaalsContact O-CB 3.27Å; D273-W349 WeakPolarHBondContact O-CB 3.45Å; C276-W349 PolarHBondContact O-N 2.79Å; W349-Y354 HydrophobicContact CB-CE2 4.38Å |
| 350 | W | 92.6 | Very high | 81.8 | Confident | 70 Ų | 70 | 56 Ų | 56 | 27% | 0.265 | 28% | 0.282 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -88 | -9.6 | 179.9 | 51.3 | -100.7 | 0 | 0 | 0 | 113.7 | I189 R190 F193 I203 D348 | I189-W350 HydrophobicContact CG2-CB 3.9Å; R190-W350 HydrophobicContact CG-CB 4.46Å; F193-W350 AromaticContact CD1-CE3 3.97Å; F193-W350 HydrophobicContact CD1-CE3 3.97Å; F193-W350 AromaticContact CD1-CZ3 3.93Å; F193-W350 HydrophobicContact CD1-CZ3 3.93Å; F193-W350 HydrophobicContact CD2-CB 4.34Å; F193-W350 HydrophobicContact CD2-CD2 4.48Å; F193-W350 AromaticContact CD2-CE3 3.74Å; F193-W350 HydrophobicContact CD2-CE3 3.74Å; F193-W350 HydrophobicContact CD2-CZ3 4.5Å; F193-W350 WeakPolarHBondContact CD2-O 3.25Å; F193-W350 HydrophobicContact CE1-CD2 4.5Å; F193-W350 AromaticContact CE1-CE3 3.46Å; F193-W350 HydrophobicContact CE1-CE3 3.46Å; F193-W350 VanDerWaalsContact CE1-CE3 3.46Å; F193-W350 HydrophobicContact CE1-CH2 4.21Å; F193-W350 AromaticContact CE1-CZ3 3.27Å; F193-W350 HydrophobicContact CE1-CZ3 3.27Å; F193-W350 HydrophobicContact CE2-CB 3.96Å; F193-W350 AromaticContact CE2-CD2 3.72Å; F193-W350 HydrophobicContact CE2-CD2 3.72Å; F193-W350 AromaticContact CE2-CE3 3.23Å; F193-W350 HydrophobicContact CE2-CE3 3.23Å; F193-W350 HydrophobicContact CE2-CG 4.06Å; F193-W350 AromaticContact CE2-CZ3 3.98Å; F193-W350 HydrophobicContact CE2-CZ3 3.98Å; F193-W350 HydrophobicContact CG-CE3 4.09Å; F193-W350 HydrophobicContact CG-CZ3 4.49Å; F193-W350 AromaticContact CZ-CD2 3.72Å; F193-W350 HydrophobicContact CZ-CD2 3.72Å; F193-W350 AromaticContact CZ-CE3 3.06Å; F193-W350 HydrophobicContact CZ-CE3 3.06Å; F193-W350 HydrophobicContact CZ-CG 4.47Å; F193-W350 HydrophobicContact CZ-CH2 4.15Å; F193-W350 AromaticContact CZ-CZ3 3.32Å; F193-W350 HydrophobicContact CZ-CZ3 3.32Å; I203-W350 HydrophobicContact CD1-CZ3 4.43Å; D348-W350 HydrophobicContact CB-CD2 4.18Å; D348-W350 HydrophobicContact CB-CG 4.33Å; D348-W350 HydrophobicContact CB-CZ2 3.99Å; D348-W350 VanDerWaalsContact CB-NE1 3.34Å; D348-W350 PolarHBondContact O-N 2.89Å; D348-W350 WeakPolarHBondContact OD2-CZ2 3.33Å |
| 351 | H | 92.4 | Very high | 81.2 | Confident | 23 Ų | 23 | 57.8 Ų | 57.8 | 11% | 0.106 | 29% | 0.29 | C | S | . | . | trans | -64.4 | 140.8 | -176.1 | -169.1 | -84.3 | 0 | 0 | 0 | 111.1 | I203 M347 D348 L353 Y354 | I203-H351 WeakPolarHBondContact CG2-NE2 3.33Å; M347-H351 HydrophobicContact CB-CB 3.93Å; M347-H351 HydrophobicContact CG-CB 4.39Å; D348-H351 WeakPolarHBondContact O-CB 3.31Å; D348-H351 PolarHBondContact O-N 2.93Å; H351-L353 VanDerWaalsContact C-N 3.3Å; H351-L353 PolarHBondContact ND1-N 2.85Å; H351-L353 VanDerWaalsContact ND1-N 3.14Å; H351-L353 PolarHBondContact O-N 2.91Å; H351-Y354 WeakPolarHBondContact O-CB 3.37Å; H351-Y354 PolarHBondContact O-N 2.89Å | ||
| 352 | P | 90.9 | Very high | 80.5 | Confident | 29 Ų | 29 | 60.6 Ų | 60.6 | 19% | 0.188 | 30% | 0.304 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -65.8 | -31.2 | -175.9 | 24.8 | -34.9 | 0 | 0 | 0 | 113 | F193 H194 I203 Y354 | F193-P352 HydrophobicContact CB-CB 4.48Å; F193-P352 HydrophobicContact CB-CG 4.39Å; H194-P352 WeakPolarHBondContact CE1-CB 3.32Å; H194-P352 WeakPolarHBondContact NE2-CB 3.31Å; I203-P352 HydrophobicContact CD1-CG 3.59Å; P352-Y354 PolarHBondContact O-N 2.89Å |
| 353 | L | 89.8 | Confident | 79.9 | Confident | 101 Ų | 101 | 59.7 Ų | 59.7 | 53% | 0.529 | 30% | 0.301 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -82.6 | 1.7 | 172.4 | -55.2 | -179.8 | 0 | 0 | 0 | 113.3 | M347 H351 | M347-L353 HydrophobicContact SD-CB 3.79Å; H351-L353 VanDerWaalsContact C-N 3.3Å; H351-L353 PolarHBondContact ND1-N 2.85Å; H351-L353 VanDerWaalsContact ND1-N 3.14Å; H351-L353 PolarHBondContact O-N 2.91Å |
| 354 | Y | 90.5 | Very high | 79.2 | Confident | 7 Ų | 7 | 62.6 Ų | 62.6 | 3% | 0.027 | 32% | 0.315 | C | S | . | . | S | Bend | trans | -64.4 | 125.9 | 176.9 | -168.3 | -85.8 | 0 | 0 | 0 | 109.3 | R190 K244 C276 V278 M347 D348 W349 H351 P352 S356 | R190-Y354 PolarHBondContact NH2-O 3.45Å; K244-Y354 WeakPolarHBondContact CE-OH 3.34Å; C276-Y354 WeakPolarHBondContact CB-OH 3.29Å; V278-Y354 HydrophobicContact CB-CD2 4.36Å; V278-Y354 HydrophobicContact CB-CE2 4.13Å; V278-Y354 HydrophobicContact CG2-CD2 4.02Å; V278-Y354 HydrophobicContact CG2-CE2 3.46Å; V278-Y354 VanDerWaalsContact CG2-CE2 3.46Å; M347-Y354 HydrophobicContact CB-CD2 4.45Å; D348-Y354 WeakPolarHBondContact O-CD2 3.17Å; W349-Y354 HydrophobicContact CB-CE2 4.38Å; H351-Y354 WeakPolarHBondContact O-CB 3.37Å; H351-Y354 PolarHBondContact O-N 2.89Å; P352-Y354 PolarHBondContact O-N 2.89Å; Y354-S356 PolarHBondContact O-N 3.4Å |
| 355 | P | 84.9 | Confident | 78.2 | Confident | 33 Ų | 33 | 66.3 Ų | 66.3 | 21% | 0.214 | 33% | 0.333 | C | S | . | . | trans | -54.3 | 124.1 | -174.7 | -22.4 | 28.7 | 0 | 0 | 0 | 112.2 | W226 V278 L357 | W226-P355 HydrophobicContact CH2-CG 3.83Å; W226-P355 HydrophobicContact CZ2-CB 4.17Å; W226-P355 HydrophobicContact CZ2-CG 3.47Å; W226-P355 VanDerWaalsContact CZ2-CG 3.47Å; V278-P355 HydrophobicContact CG2-CG 4.41Å; P355-L357 PolarHBondContact O-N 3.13Å | ||
| 356 | S | 69.8 | Low | 77.2 | Confident | 63 Ų | 63 | 65.5 Ų | 65.5 | 44% | 0.441 | 33% | 0.333 | S | S | . | . | trans | -80.4 | 88 | 164.3 | 42.6 | 0 | 0 | 0 | 0 | 108 | Y354 P358 | Y354-S356 PolarHBondContact O-N 3.4Å; S356-P358 VanDerWaalsContact O-CD 3.28Å; S356-P358 WeakPolarHBondContact O-CD 3.36Å | ||
| 357 | L | 57.7 | Low | 76.1 | Confident | 58 Ų | 58 | 66 Ų | 66 | 30% | 0.304 | 34% | 0.335 | S | S | . | . | trans | -60.7 | 122.3 | 173 | -71.7 | 171.1 | 0 | 0 | 0 | 108.6 | R172 L224 P355 Y359 | R172-L357 VanDerWaalsContact CZ-O 3.24Å; R172-L357 PolarHBondContact NH1-O 3.09Å; R172-L357 PolarHBondContact NH2-O 3.09Å; L224-L357 HydrophobicContact CD2-CD1 3.97Å; L224-L357 HydrophobicContact CD2-CD2 4.16Å; P355-L357 PolarHBondContact O-N 3.13Å; L357-Y359 PolarHBondContact O-N 3.24Å; L357-Y359 VanDerWaalsContact O-N 3.1Å | ||
| 358 | P | 45.2 | Very low | 74.8 | Confident | 98 Ų | 98 | 71 Ų | 71 | 64% | 0.636 | 36% | 0.36 | S | S | * | . | S | Bend | trans | -69.7 | -4.2 | -174.2 | 20.9 | -27.1 | 0 | 0 | 0 | 114.4 | S356 | S356-P358 VanDerWaalsContact O-CD 3.28Å; S356-P358 WeakPolarHBondContact O-CD 3.36Å |
| 359 | Y | 35.1 | Very low | 73.3 | Confident | 208 Ų | 208 | 72.3 Ų | 72.3 | 82% | 0.816 | 37% | 0.366 | S | S | * | . | trans | -127.8 | 85.2 | -174.6 | -60.1 | -78.3 | 0 | 0 | 0 | 111.7 | L357 | L357-Y359 PolarHBondContact O-N 3.24Å; L357-Y359 VanDerWaalsContact O-N 3.1Å | ||
| 360 | I | 38.1 | Very low | 71.6 | Confident | 139 Ų | 139 | 75.4 Ų | 75.4 | 71% | 0.713 | 39% | 0.385 | S | S | * | . | trans | -145.6 | 0 | 147.8 | -57.4 | -176.2 | 0 | 0 | 0 | 107.5 | P272 | P272-I360 HydrophobicContact CB-CD1 4.4Š|
Retrieved 360 of 360 residues in 93.5 ms
(Link to these results)