| 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 | 30.6 | Very low | 38.4 | Very low | 243 Ų | 243 | 136.3 Ų | 136.3 | 100% | 1.197 | 73% | 0.725 | S | S | * | * | 0 | 133.1 | 0 | -81.4 | 166.2 | 164.3 | 0 | 0 | 107.9 | Q3 | M1-Q3 PolarHBondContact O-N 3.17Š| |||
| 2 | S | 38.8 | Very low | 38.7 | Very low | 122 Ų | 122 | 141.9 Ų | 141.9 | 85% | 0.853 | 73% | 0.729 | S | S | * | * | trans | -67.1 | 103.8 | -167.7 | -168.3 | 0 | 0 | 0 | 0 | 111.6 | Y4 | S2-Y4 PolarHBondContact O-N 3.22Š| ||
| 3 | Q | 34.1 | Very low | 39.1 | Very low | 187 Ų | 187 | 136.5 Ų | 136.5 | 87% | 0.874 | 72% | 0.718 | S | S | * | * | trans | -94.1 | 76.4 | 169.1 | -127.7 | 178.3 | -83.7 | 0 | 0 | 107.9 | M1 A5 | M1-Q3 PolarHBondContact O-N 3.17Å; Q3-A5 PolarHBondContact O-N 3.47Å | ||
| 4 | Y | 36.5 | Very low | 39.5 | Very low | 202 Ų | 202 | 133.9 Ų | 133.9 | 79% | 0.792 | 70% | 0.704 | S | S | * | * | trans | -76.8 | 79.7 | 161.7 | -169.3 | -99.1 | 0 | 0 | 0 | 106.7 | S2 P6 | S2-Y4 PolarHBondContact O-N 3.22Å; Y4-P6 WeakPolarHBondContact O-CD 2.89Å | ||
| 5 | A | 35.8 | Very low | 39.3 | Very low | 67 Ų | 67 | 134.6 Ų | 134.6 | 55% | 0.554 | 71% | 0.709 | S | S | * | * | P | Polyproline II helix | trans | -69.2 | 120.1 | 170.6 | 0 | 0 | 0 | 0 | 0 | 107.2 | Q3 S7 | Q3-A5 PolarHBondContact O-N 3.47Å; A5-S7 PolarHBondContact O-N 3.45Å |
| 6 | P | 39.9 | Very low | 39.4 | Very low | 115 Ų | 115 | 131.4 Ų | 131.4 | 75% | 0.747 | 70% | 0.701 | S | S | * | * | P | Polyproline II helix | trans | -62.4 | 122.8 | 175.7 | 24.7 | -30.3 | 0 | 0 | 0 | 108.3 | Y4 | Y4-P6 WeakPolarHBondContact O-CD 2.89Š|
| 7 | S | 41.8 | Very low | 40.4 | Very low | 66 Ų | 66 | 125.5 Ų | 125.5 | 46% | 0.462 | 67% | 0.673 | S | S | . | * | P | Polyproline II helix | trans | -63.8 | 146.6 | -170 | 36.7 | 0 | 0 | 0 | 0 | 113.1 | A5 D9 F10 | A5-S7 PolarHBondContact O-N 3.45Å; S7-D9 PolarHBondContact O-N 3.18Å; S7-D9 VanDerWaalsContact O-N 3.13Å; S7-F10 PolarHBondContact O-N 2.87Å |
| 8 | P | 43.4 | Very low | 41.6 | Very low | 103 Ų | 103 | 122.9 Ų | 122.9 | 67% | 0.669 | 66% | 0.664 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -66.6 | -11.3 | -173.2 | 26.8 | -34.5 | 0 | 0 | 0 | 115 | K11 R12 | P8-K11 PolarHBondContact O-N 3.4Å; P8-R12 PolarHBondContact O-N 3.4Å |
| 9 | D | 46.3 | Very low | 41.3 | Very low | 111 Ų | 111 | 124.3 Ų | 124.3 | 59% | 0.594 | 67% | 0.665 | S | S | * | * | H | α-helix | trans | -69.9 | -29.8 | 179.4 | -53.6 | -73.8 | 0 | 0 | 0 | 113.1 | S7 K11 R12 A13 | S7-D9 PolarHBondContact O-N 3.18Å; S7-D9 VanDerWaalsContact O-N 3.13Å; D9-K11 VanDerWaalsContact C-N 3.34Å; D9-R12 PolarHBondContact O-N 3.02Å; D9-A13 PolarHBondContact O-N 3.46Å; D9-A13 VanDerWaalsContact O-N 3.15Å |
| 10 | F | 38.6 | Very low | 42 | Very low | 116 Ų | 116 | 120 Ų | 120 | 51% | 0.509 | 65% | 0.648 | S | S | . | * | H | α-helix | trans | -65.3 | -38.7 | 174.8 | -177.3 | -100.3 | 0 | 0 | 0 | 111.6 | S7 A13 L14 L57 | S7-F10 PolarHBondContact O-N 2.87Å; F10-A13 PolarHBondContact O-N 3.07Å; F10-L14 HydrophobicContact CD1-CD1 4.05Å; F10-L14 HydrophobicContact CD1-CD2 4.5Å; F10-L14 HydrophobicContact CD2-CD1 4.06Å; F10-L14 HydrophobicContact CE1-CD1 3.61Å; F10-L14 HydrophobicContact CE1-CD2 3.75Å; F10-L14 HydrophobicContact CE1-CG 4.31Å; F10-L14 HydrophobicContact CE2-CD1 3.62Å; F10-L14 HydrophobicContact CG-CD1 4.26Å; F10-L14 HydrophobicContact CZ-CD1 3.38Å; F10-L14 HydrophobicContact CZ-CD2 4.08Å; F10-L14 HydrophobicContact CZ-CG 4.39Å; F10-L14 WeakPolarHBondContact O-CB 3.28Å; F10-L14 WeakPolarHBondContact O-CD1 3.45Å; F10-L14 PolarHBondContact O-N 3.37Å; F10-L57 HydrophobicContact CE2-CD1 4.1Å |
| 11 | K | 37 | Very low | 41.6 | Very low | 167 Ų | 167 | 121.6 Ų | 121.6 | 73% | 0.726 | 66% | 0.656 | S | S | * | * | H | α-helix | trans | -65.3 | -39 | 177.1 | -93.8 | -170.5 | 168.7 | -163.9 | 0 | 111.9 | P8 D9 L14 D15 | P8-K11 PolarHBondContact O-N 3.4Å; D9-K11 VanDerWaalsContact C-N 3.34Å; K11-L14 PolarHBondContact O-N 3.45Å; K11-D15 VanDerWaalsContact O-CB 3.28Å; K11-D15 WeakPolarHBondContact O-CB 3.49Å; K11-D15 PolarHBondContact O-N 3.22Å |
| 12 | R | 42 | Very low | 42.7 | Very low | 204 Ų | 204 | 115.5 Ų | 115.5 | 77% | 0.77 | 63% | 0.632 | S | S | * | * | H | α-helix | trans | -73.2 | -31 | -179.5 | -167.6 | 172.7 | 171.4 | 155.2 | -2.2 | 112.9 | P8 D9 S16 | P8-R12 PolarHBondContact O-N 3.4Å; D9-R12 PolarHBondContact O-N 3.02Å; R12-S16 PolarHBondContact O-OG 3.15Å; R12-S16 VanDerWaalsContact O-OG 3.07Å |
| 13 | A | 42.9 | Very low | 42.6 | Very low | 71 Ų | 71 | 118.7 Ų | 118.7 | 59% | 0.587 | 63% | 0.634 | S | S | * | * | H | α-helix | trans | -73.5 | -34.1 | 172.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | D9 F10 | D9-A13 PolarHBondContact O-N 3.46Å; D9-A13 VanDerWaalsContact O-N 3.15Å; F10-A13 PolarHBondContact O-N 3.07Å |
| 14 | L | 44.6 | Very low | 43.4 | Very low | 101 Ų | 101 | 117.2 Ų | 117.2 | 53% | 0.529 | 63% | 0.632 | S | S | . | * | H | α-helix | trans | -74.4 | -36.6 | 173 | -102.4 | 74.9 | 0 | 0 | 0 | 113.4 | F10 K11 S16 S17 | F10-L14 HydrophobicContact CD1-CD1 4.05Å; F10-L14 HydrophobicContact CD1-CD2 4.5Å; F10-L14 HydrophobicContact CD2-CD1 4.06Å; F10-L14 HydrophobicContact CE1-CD1 3.61Å; F10-L14 HydrophobicContact CE1-CD2 3.75Å; F10-L14 HydrophobicContact CE1-CG 4.31Å; F10-L14 HydrophobicContact CE2-CD1 3.62Å; F10-L14 HydrophobicContact CG-CD1 4.26Å; F10-L14 HydrophobicContact CZ-CD1 3.38Å; F10-L14 HydrophobicContact CZ-CD2 4.08Å; F10-L14 HydrophobicContact CZ-CG 4.39Å; F10-L14 WeakPolarHBondContact O-CB 3.28Å; F10-L14 WeakPolarHBondContact O-CD1 3.45Å; F10-L14 PolarHBondContact O-N 3.37Å; K11-L14 PolarHBondContact O-N 3.45Å; L14-S16 PolarHBondContact O-N 2.77Å; L14-S17 PolarHBondContact O-N 2.9Å |
| 15 | D | 37.6 | Very low | 43.9 | Very low | 144 Ų | 144 | 113.6 Ų | 113.6 | 77% | 0.77 | 63% | 0.627 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -68.3 | -15.8 | -179.8 | -154.7 | -110.2 | 0 | 0 | 0 | 112.4 | K11 S17 | K11-D15 VanDerWaalsContact O-CB 3.28Å; K11-D15 WeakPolarHBondContact O-CB 3.49Å; K11-D15 PolarHBondContact O-N 3.22Å; D15-S17 VanDerWaalsContact C-N 3.34Å; D15-S17 PolarHBondContact O-N 3.35Å |
| 16 | S | 40.4 | Very low | 44.7 | Very low | 84 Ų | 84 | 118.1 Ų | 118.1 | 59% | 0.587 | 63% | 0.634 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84.9 | 6.1 | 179.4 | -62.9 | 0 | 0 | 0 | 0 | 115 | R12 L14 | R12-S16 PolarHBondContact O-OG 3.15Å; R12-S16 VanDerWaalsContact O-OG 3.07Å; L14-S16 PolarHBondContact O-N 2.77Å |
| 17 | S | 56.4 | Low | 44.6 | Very low | 31 Ų | 31 | 116.7 Ų | 116.7 | 22% | 0.217 | 62% | 0.623 | C | S | . | * | trans | -150.5 | 113.9 | 178.4 | -129.4 | 0 | 0 | 0 | 0 | 110.7 | L14 D15 K35 W39 | L14-S17 PolarHBondContact O-N 2.9Å; D15-S17 VanDerWaalsContact C-N 3.34Å; D15-S17 PolarHBondContact O-N 3.35Å; S17-K35 PolarHBondContact OG-O 3.04Å; S17-W39 WeakPolarHBondContact O-CZ3 3.08Å | ||
| 18 | P | 62 | Low | 45.2 | Very low | 79 Ų | 79 | 121.3 Ų | 121.3 | 51% | 0.513 | 64% | 0.637 | S | S | . | * | trans | -136.5 | 150 | 145.6 | -2.9 | 28.3 | 0 | 0 | 0 | 113.3 | W39 | P18-W39 HydrophobicContact CB-CE3 4Å; P18-W39 HydrophobicContact CB-CH2 4.01Å; P18-W39 HydrophobicContact CB-CZ3 3.24Å; P18-W39 HydrophobicContact CG-CZ3 3.82Å | ||
| 19 | E | 36.8 | Very low | 44.8 | Very low | 149 Ų | 149 | 125.2 Ų | 125.2 | 70% | 0.696 | 65% | 0.647 | S | S | * | * | cis | -156.2 | 160.3 | 28.1 | -58.4 | -172.3 | 89.3 | 0 | 0 | 112.1 | ||||
| 20 | A | 53.9 | Low | 44.9 | Very low | 37 Ų | 37 | 127.3 Ų | 127.3 | 31% | 0.306 | 66% | 0.658 | S | S | . | * | trans | -81.5 | 149.2 | 176.2 | 0 | 0 | 0 | 0 | 0 | 113.4 | L40 | A20-L40 HydrophobicContact CB-CD1 4.22Å; A20-L40 HydrophobicContact CB-CD2 3.3Å; A20-L40 HydrophobicContact CB-CG 3.53Å | ||
| 21 | N | 34 | Very low | 44.9 | Very low | 154 Ų | 154 | 128 Ų | 128 | 82% | 0.824 | 67% | 0.671 | S | S | * | * | trans | -142.5 | 125.1 | 147.7 | -77.2 | -61.9 | 0 | 0 | 0 | 110.6 | ||||
| 22 | T | 54.7 | Low | 45.7 | Very low | 115 Ų | 115 | 125.3 Ų | 125.3 | 71% | 0.706 | 67% | 0.671 | S | S | * | * | trans | -65.8 | 143.9 | 167.9 | -56.2 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 23 | E | 36 | Very low | 45.6 | Very low | 189 Ų | 189 | 120.6 Ų | 120.6 | 88% | 0.883 | 67% | 0.665 | S | S | * | * | 166.9 | 146.7 | 127.6 | -85.4 | 162.3 | 126.2 | 0 | 0 | 110.9 | |||||
| 24 | D | 51.2 | Low | 45.8 | Very low | 156 Ų | 156 | 122.5 Ų | 122.5 | 83% | 0.834 | 67% | 0.671 | S | S | * | * | trans | -23.8 | 145.1 | 164.9 | -163.9 | -124.3 | 0 | 0 | 0 | 117.4 | ||||
| 25 | D | 47 | Very low | 45.9 | Very low | 127 Ų | 127 | 123.6 Ų | 123.6 | 68% | 0.679 | 67% | 0.672 | S | S | * | * | trans | 76.9 | 128.9 | 155.5 | -157.3 | -127.3 | 0 | 0 | 0 | 120.9 | ||||
| 26 | K | 51.8 | Low | 46.1 | Very low | 161 Ų | 161 | 120.3 Ų | 120.3 | 70% | 0.7 | 65% | 0.654 | S | S | * | * | trans | 50.7 | 134.8 | 151.6 | -94 | 174.7 | 68 | 71.4 | 0 | 122.9 | ||||
| 27 | T | 38.4 | Very low | 46.4 | Very low | 85 Ų | 85 | 125 Ų | 125 | 52% | 0.521 | 66% | 0.66 | S | S | . | * | trans | 88.9 | 113 | 138.9 | -61.1 | 0 | 0 | 0 | 0 | 116.7 | ||||
| 28 | E | 53.6 | Low | 46.2 | Very low | 163 Ų | 163 | 128.8 Ų | 128.8 | 76% | 0.762 | 68% | 0.677 | S | S | * | * | trans | 22.1 | 124.5 | 134 | -55.5 | 159.8 | 95.7 | 0 | 0 | 116.5 | ||||
| 29 | E | 36.6 | Very low | 45.6 | Very low | 186 Ų | 186 | 129.9 Ų | 129.9 | 87% | 0.869 | 67% | 0.672 | S | S | * | * | 171.4 | 132 | 117.7 | -88.1 | -179.4 | 118 | 0 | 0 | 113 | |||||
| 30 | D | 48 | Very low | 46.1 | Very low | 154 Ų | 154 | 125 Ų | 125 | 82% | 0.824 | 65% | 0.65 | S | S | * | * | trans | -2.2 | 108.5 | 155.6 | -165.4 | -105.2 | 0 | 0 | 0 | 119 | ||||
| 31 | V | 38.5 | Very low | 45.9 | Very low | 130 Ų | 130 | 127 Ų | 127 | 79% | 0.788 | 66% | 0.658 | S | S | * | * | trans | -161.6 | 137.9 | 147.3 | -115.1 | 0 | 0 | 0 | 0 | 113.3 | T33 | V31-T33 PolarHBondContact O-N 3.47Š| ||
| 32 | P | 52.5 | Low | 46.9 | Very low | 111 Ų | 111 | 123.4 Ų | 123.4 | 72% | 0.721 | 64% | 0.638 | S | S | * | * | trans | -94.7 | 94.8 | -176 | 34.9 | -28.3 | 0 | 0 | 0 | 111.3 | ||||
| 33 | T | 41.5 | Very low | 46.7 | Very low | 106 Ų | 106 | 121.4 Ų | 121.4 | 65% | 0.65 | 63% | 0.626 | S | S | * | * | trans | -169.5 | 127.7 | 152.3 | 33.7 | 0 | 0 | 0 | 0 | 112.5 | V31 K35 | V31-T33 PolarHBondContact O-N 3.47Å; T33-K35 PolarHBondContact O-N 2.82Å | ||
| 34 | P | 46.2 | Very low | 47.4 | Very low | 111 Ų | 111 | 116.5 Ų | 116.5 | 72% | 0.721 | 61% | 0.612 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -91.1 | 49.2 | -170.7 | 36.7 | -37.9 | 0 | 0 | 0 | 114.7 | ||
| 35 | K | 46.3 | Very low | 47.3 | Very low | 124 Ų | 124 | 110.5 Ų | 110.5 | 54% | 0.539 | 58% | 0.582 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -112.4 | -23 | -171.1 | -80.2 | 175.1 | 168.6 | 175.9 | 0 | 116.8 | S17 T33 | S17-K35 PolarHBondContact OG-O 3.04Å; T33-K35 PolarHBondContact O-N 2.82Å |
| 36 | N | 43.3 | Very low | 47.6 | Very low | 74 Ų | 74 | 110.1 Ų | 110.1 | 40% | 0.396 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -97.7 | -24.5 | -169.6 | -54.8 | -18 | 0 | 0 | 0 | 112.4 | L40 | N36-L40 WeakPolarHBondContact O-CD1 3.47Å |
| 37 | Y | 45.8 | Very low | 47.1 | Very low | 183 Ų | 183 | 107.1 Ų | 107.1 | 72% | 0.718 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -81.3 | -23.2 | -179.8 | -75.6 | -92.7 | 0 | 0 | 0 | 114.2 | T41 | Y37-T41 VanDerWaalsContact O-CB 3.26Å; Y37-T41 WeakPolarHBondContact O-CB 3.49Å; Y37-T41 PolarHBondContact O-N 3.31Å; Y37-T41 PolarHBondContact O-OG1 3.35Å |
| 38 | L | 52.2 | Low | 47.8 | Very low | 110 Ų | 110 | 109.1 Ų | 109.1 | 58% | 0.576 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -74.1 | -43.1 | -177.7 | -79.8 | 168.1 | 0 | 0 | 0 | 112.5 | T41 I42 | L38-T41 PolarHBondContact O-N 3.35Å; L38-I42 WeakPolarHBondContact O-CD1 3.37Å; L38-I42 WeakPolarHBondContact O-CG1 3.18Å; L38-I42 PolarHBondContact O-N 2.93Å |
| 39 | W | 48.6 | Very low | 47.6 | Very low | 103 Ų | 103 | 102.7 Ų | 102.7 | 39% | 0.39 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -65.4 | -47.2 | 172.8 | -176.6 | -7.5 | 0 | 0 | 0 | 110.4 | S17 P18 T41 I42 V43 | S17-W39 WeakPolarHBondContact O-CZ3 3.08Å; P18-W39 HydrophobicContact CB-CE3 4Å; P18-W39 HydrophobicContact CB-CH2 4.01Å; P18-W39 HydrophobicContact CB-CZ3 3.24Å; P18-W39 HydrophobicContact CG-CZ3 3.82Å; W39-T41 PolarHBondContact O-N 3.01Å; W39-I42 WeakPolarHBondContact O-CB 3.26Å; W39-I42 PolarHBondContact O-N 2.68Å; W39-V43 VanDerWaalsContact NE1-CG2 3.27Å; W39-V43 PolarHBondContact O-N 3.43Å |
| 40 | L | 47.4 | Very low | 48.2 | Very low | 46 Ų | 46 | 102.2 Ų | 102.2 | 24% | 0.241 | 55% | 0.553 | C | S | . | * | H | α-helix | trans | -53.2 | -41.8 | 173.8 | -86.8 | 166.4 | 0 | 0 | 0 | 112.6 | A20 N36 V43 S44 | A20-L40 HydrophobicContact CB-CD1 4.22Å; A20-L40 HydrophobicContact CB-CD2 3.3Å; A20-L40 HydrophobicContact CB-CG 3.53Å; N36-L40 WeakPolarHBondContact O-CD1 3.47Å; L40-V43 PolarHBondContact O-N 3.13Å; L40-S44 WeakPolarHBondContact O-CB 3.36Å; L40-S44 PolarHBondContact O-N 2.95Å |
| 41 | T | 50.1 | Low | 48.5 | Very low | 78 Ų | 78 | 96 Ų | 96 | 48% | 0.479 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -67 | -42.1 | 176.4 | -60.6 | 0 | 0 | 0 | 0 | 112 | Y37 L38 W39 C45 | Y37-T41 VanDerWaalsContact O-CB 3.26Å; Y37-T41 WeakPolarHBondContact O-CB 3.49Å; Y37-T41 PolarHBondContact O-N 3.31Å; Y37-T41 PolarHBondContact O-OG1 3.35Å; L38-T41 PolarHBondContact O-N 3.35Å; W39-T41 PolarHBondContact O-N 3.01Å; T41-C45 WeakPolarHBondContact O-CB 3.38Å; T41-C45 PolarHBondContact O-N 3.36Å; T41-C45 PolarHBondContact O-SG 3.4Å |
| 42 | I | 54.6 | Low | 49.3 | Very low | 79 Ų | 79 | 92.9 Ų | 92.9 | 41% | 0.405 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -61.5 | -46.5 | 175.3 | -69.6 | 161.2 | 0 | 0 | 0 | 110.6 | L38 W39 C45 F46 | L38-I42 WeakPolarHBondContact O-CD1 3.37Å; L38-I42 WeakPolarHBondContact O-CG1 3.18Å; L38-I42 PolarHBondContact O-N 2.93Å; W39-I42 WeakPolarHBondContact O-CB 3.26Å; W39-I42 PolarHBondContact O-N 2.68Å; I42-C45 WeakPolarHBondContact O-CB 3.49Å; I42-C45 PolarHBondContact O-N 3.06Å; I42-F46 HydrophobicContact CG2-CE2 3.98Å; I42-F46 WeakPolarHBondContact O-CD2 3.02Å; I42-F46 WeakPolarHBondContact O-CE2 3.38Å |
| 43 | V | 52 | Low | 49.5 | Very low | 74 Ų | 74 | 88.8 Ų | 88.8 | 45% | 0.448 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -70.2 | -42.6 | 179.7 | 165.3 | 0 | 0 | 0 | 0 | 112.2 | W39 L40 C45 F46 | W39-V43 VanDerWaalsContact NE1-CG2 3.27Å; W39-V43 PolarHBondContact O-N 3.43Å; L40-V43 PolarHBondContact O-N 3.13Å; V43-C45 PolarHBondContact O-N 3.12Å; V43-F46 WeakPolarHBondContact O-CB 3.43Å; V43-F46 PolarHBondContact O-N 3.47Å |
| 44 | S | 50.8 | Low | 50.5 | Low | 85 Ų | 85 | 87.5 Ų | 87.5 | 59% | 0.594 | 46% | 0.46 | S | S | * | . | H | α-helix | trans | -63 | -30 | 175.3 | -175.4 | 0 | 0 | 0 | 0 | 111.7 | L40 F46 C47 | L40-S44 WeakPolarHBondContact O-CB 3.36Å; L40-S44 PolarHBondContact O-N 2.95Å; S44-F46 PolarHBondContact O-N 3.19Å; S44-C47 PolarHBondContact O-N 3.45Å |
| 45 | C | 49 | Very low | 50.8 | Low | 31 Ų | 31 | 84 Ų | 84 | 21% | 0.209 | 44% | 0.437 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -71.1 | -9.6 | 172.3 | -73.4 | 0 | 0 | 0 | 0 | 113.8 | T41 I42 V43 A49 I52 N53 | T41-C45 WeakPolarHBondContact O-CB 3.38Å; T41-C45 PolarHBondContact O-N 3.36Å; T41-C45 PolarHBondContact O-SG 3.4Å; I42-C45 WeakPolarHBondContact O-CB 3.49Å; I42-C45 PolarHBondContact O-N 3.06Å; V43-C45 PolarHBondContact O-N 3.12Å; C45-A49 CarbonylContact O-C 3.07Å; C45-A49 VanDerWaalsContact O-CA 3.29Å; C45-A49 WeakPolarHBondContact O-CA 3.43Å; C45-A49 WeakPolarHBondContact O-CB 2.84Å; C45-A49 PolarHBondContact O-N 3.43Å; C45-I52 HydrophobicContact CB-CG2 3.99Å; C45-N53 HydrophobicContact CB-CB 4.45Å |
| 46 | F | 51.9 | Low | 51.3 | Low | 119 Ų | 119 | 80.6 Ų | 80.6 | 52% | 0.522 | 43% | 0.432 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -82 | -15.9 | 172.8 | -76.6 | -90.3 | 0 | 0 | 0 | 113.7 | I42 V43 S44 N53 | I42-F46 HydrophobicContact CG2-CE2 3.98Å; I42-F46 WeakPolarHBondContact O-CD2 3.02Å; I42-F46 WeakPolarHBondContact O-CE2 3.38Å; V43-F46 WeakPolarHBondContact O-CB 3.43Å; V43-F46 PolarHBondContact O-N 3.47Å; S44-F46 PolarHBondContact O-N 3.19Å; F46-N53 WeakPolarHBondContact CE1-ND2 3.45Å; F46-N53 WeakPolarHBondContact CE2-ND2 3.04Å; F46-N53 WeakPolarHBondContact CZ-ND2 3.18Å |
| 47 | C | 41.9 | Very low | 52.1 | Low | 98 Ų | 98 | 81 Ų | 81 | 66% | 0.662 | 43% | 0.434 | S | S | * | . | S | Bend | trans | -94.5 | 137 | 169.2 | -167.5 | 0 | 0 | 0 | 0 | 107.1 | S44 A49 | S44-C47 PolarHBondContact O-N 3.45Å; C47-A49 PolarHBondContact O-N 3.06Å |
| 48 | P | 52.1 | Low | 52.8 | Low | 127 Ų | 127 | 74.5 Ų | 74.5 | 83% | 0.825 | 41% | 0.413 | S | S | * | . | S | Bend | -53.6 | 14.5 | -79.4 | -1.8 | 22.7 | 0 | 0 | 0 | 117 | Y50 | P48-Y50 PolarHBondContact O-N 3.45Š| |
| 49 | A | 50.4 | Low | 53.1 | Low | 27 Ų | 27 | 76.5 Ų | 76.5 | 22% | 0.223 | 42% | 0.417 | C | S | . | . | trans | -93.1 | 52.2 | -163.4 | 0 | 0 | 0 | 0 | 0 | 115.6 | C45 C47 P51 I52 | C45-A49 CarbonylContact O-C 3.07Å; C45-A49 VanDerWaalsContact O-CA 3.29Å; C45-A49 WeakPolarHBondContact O-CA 3.43Å; C45-A49 WeakPolarHBondContact O-CB 2.84Å; C45-A49 PolarHBondContact O-N 3.43Å; C47-A49 PolarHBondContact O-N 3.06Å; A49-P51 VanDerWaalsContact C-N 3.31Å; A49-P51 VanDerWaalsContact O-N 3.12Å; A49-I52 HydrophobicContact CB-CB 4.12Å; A49-I52 HydrophobicContact CB-CG1 4.22Å; A49-I52 PolarHBondContact O-N 3.49Å | ||
| 50 | Y | 48.6 | Very low | 53.5 | Low | 176 Ų | 176 | 75.1 Ų | 75.1 | 69% | 0.69 | 42% | 0.423 | S | S | * | . | H | α-helix | trans | -45.5 | -38.8 | 172.9 | -158.6 | -98.2 | 0 | 0 | 0 | 116 | P48 I54 | P48-Y50 PolarHBondContact O-N 3.45Å; Y50-I54 HydrophobicContact CD1-CD1 4.27Å; Y50-I54 HydrophobicContact CE1-CD1 4.11Å |
| 51 | P | 54.3 | Low | 54 | Low | 23 Ų | 23 | 77.7 Ų | 77.7 | 15% | 0.149 | 44% | 0.436 | C | S | . | . | H | α-helix | trans | -79.9 | -30 | -179.5 | 31.2 | -37.9 | 0 | 0 | 0 | 115 | A49 N53 I54 V55 I96 I97 | A49-P51 VanDerWaalsContact C-N 3.31Å; A49-P51 VanDerWaalsContact O-N 3.12Å; P51-N53 VanDerWaalsContact C-N 3.29Å; P51-N53 PolarHBondContact O-N 3.26Å; P51-I54 PolarHBondContact O-N 3.45Å; P51-V55 PolarHBondContact O-N 3.49Å; P51-I96 HydrophobicContact CB-CB 4.39Å; P51-I96 HydrophobicContact CB-CG2 4.45Å; P51-I96 HydrophobicContact CG-CB 3.96Å; P51-I96 HydrophobicContact CG-CG2 3.69Å; P51-I97 HydrophobicContact CG-CG1 4.42Å |
| 52 | I | 55.3 | Low | 54.4 | Low | 65 Ų | 65 | 77.6 Ų | 77.6 | 33% | 0.333 | 43% | 0.431 | S | S | . | . | H | α-helix | trans | -61.8 | -43.4 | -179.9 | -82.5 | -80.4 | 0 | 0 | 0 | 109.9 | C45 A49 I54 V55 A56 I97 | C45-I52 HydrophobicContact CB-CG2 3.99Å; A49-I52 HydrophobicContact CB-CB 4.12Å; A49-I52 HydrophobicContact CB-CG1 4.22Å; A49-I52 PolarHBondContact O-N 3.49Å; I52-I54 VanDerWaalsContact C-N 3.29Å; I52-I54 PolarHBondContact O-N 2.95Å; I52-V55 PolarHBondContact O-N 2.87Å; I52-V55 VanDerWaalsContact O-N 3.15Å; I52-A56 PolarHBondContact O-N 2.94Å; I52-A56 VanDerWaalsContact O-N 3.12Å; I52-I97 HydrophobicContact CD1-CD1 3.32Å; I52-I97 HydrophobicContact CD1-CG1 4.24Å; I52-I97 HydrophobicContact CG1-CD1 3.49Å; I52-I97 VanDerWaalsContact CG1-CD1 3.49Å; I52-I97 HydrophobicContact CG1-CG1 3.88Å |
| 53 | N | 58 | Low | 54.1 | Low | 25 Ų | 25 | 76.9 Ų | 76.9 | 13% | 0.134 | 43% | 0.433 | C | S | . | . | H | α-helix | trans | -68.1 | -31.1 | -175.6 | -163.9 | 36.3 | 0 | 0 | 0 | 112.3 | C45 F46 P51 L57 | C45-N53 HydrophobicContact CB-CB 4.45Å; F46-N53 WeakPolarHBondContact CE1-ND2 3.45Å; F46-N53 WeakPolarHBondContact CE2-ND2 3.04Å; F46-N53 WeakPolarHBondContact CZ-ND2 3.18Å; P51-N53 VanDerWaalsContact C-N 3.29Å; P51-N53 PolarHBondContact O-N 3.26Å; N53-L57 WeakPolarHBondContact O-CB 3.37Å; N53-L57 PolarHBondContact O-N 2.95Å |
| 54 | I | 60.5 | Low | 54.2 | Low | 79 Ų | 79 | 79.3 Ų | 79.3 | 41% | 0.405 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -66.8 | -37.6 | 174 | -62.7 | 178.9 | 0 | 0 | 0 | 110.9 | Y50 P51 I52 L57 V58 | Y50-I54 HydrophobicContact CD1-CD1 4.27Å; Y50-I54 HydrophobicContact CE1-CD1 4.11Å; P51-I54 PolarHBondContact O-N 3.45Å; I52-I54 VanDerWaalsContact C-N 3.29Å; I52-I54 PolarHBondContact O-N 2.95Å; I54-L57 PolarHBondContact O-N 3.4Å; I54-V58 HydrophobicContact CG2-CG2 4.44Å; I54-V58 WeakPolarHBondContact O-CG2 3.29Å; I54-V58 PolarHBondContact O-N 3.12Å |
| 55 | V | 54.3 | Low | 54.3 | Low | 39 Ų | 39 | 80.7 Ų | 80.7 | 24% | 0.236 | 44% | 0.443 | C | S | . | . | H | α-helix | trans | -69.6 | -41.9 | 178.5 | 178.7 | 0 | 0 | 0 | 0 | 111.6 | P51 I52 L57 V58 F59 I90 | P51-V55 PolarHBondContact O-N 3.49Å; I52-V55 PolarHBondContact O-N 2.87Å; I52-V55 VanDerWaalsContact O-N 3.15Å; V55-L57 VanDerWaalsContact C-N 3.32Å; V55-L57 PolarHBondContact O-N 2.98Å; V55-V58 PolarHBondContact O-N 3.22Å; V55-F59 WeakPolarHBondContact O-CB 3.48Å; V55-F59 PolarHBondContact O-N 2.95Å; V55-I90 HydrophobicContact CG1-CG1 3.77Å |
| 56 | A | 55.9 | Low | 54.4 | Low | 52 Ų | 52 | 83 Ų | 83 | 43% | 0.43 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -61.3 | -42.5 | 174.8 | 0 | 0 | 0 | 0 | 0 | 111.5 | I52 F59 S60 | I52-A56 PolarHBondContact O-N 2.94Å; I52-A56 VanDerWaalsContact O-N 3.12Å; A56-F59 PolarHBondContact O-N 3.36Å; A56-S60 WeakPolarHBondContact O-CB 3.4Å; A56-S60 PolarHBondContact O-N 3.19Å |
| 57 | L | 59.8 | Low | 54.3 | Low | 83 Ų | 83 | 87.3 Ų | 87.3 | 44% | 0.435 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -61.4 | -46.4 | 174.7 | -164 | 92 | 0 | 0 | 0 | 111.6 | F10 N53 I54 V55 F59 S60 I61 | F10-L57 HydrophobicContact CE2-CD1 4.1Å; N53-L57 WeakPolarHBondContact O-CB 3.37Å; N53-L57 PolarHBondContact O-N 2.95Å; I54-L57 PolarHBondContact O-N 3.4Å; V55-L57 VanDerWaalsContact C-N 3.32Å; V55-L57 PolarHBondContact O-N 2.98Å; L57-F59 PolarHBondContact O-N 3.4Å; L57-S60 WeakPolarHBondContact O-CB 3.19Å; L57-S60 PolarHBondContact O-N 3.25Å; L57-I61 HydrophobicContact CD2-CD1 4Å; L57-I61 HydrophobicContact CG-CD1 3.94Å; L57-I61 WeakPolarHBondContact O-CD1 3.37Å; L57-I61 WeakPolarHBondContact O-CG1 3.46Å; L57-I61 PolarHBondContact O-N 2.88Å |
| 58 | V | 61.3 | Low | 54.8 | Low | 46 Ų | 46 | 89.8 Ų | 89.8 | 28% | 0.279 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -64.6 | -39.8 | 179.4 | 170.7 | 0 | 0 | 0 | 0 | 112.1 | I54 V55 I61 M62 A86 | I54-V58 HydrophobicContact CG2-CG2 4.44Å; I54-V58 WeakPolarHBondContact O-CG2 3.29Å; I54-V58 PolarHBondContact O-N 3.12Å; V55-V58 PolarHBondContact O-N 3.22Å; V58-I61 PolarHBondContact O-N 3.46Å; V58-M62 WeakPolarHBondContact O-CB 3.5Å; V58-M62 PolarHBondContact O-N 3.12Å; V58-A86 HydrophobicContact CG1-CB 4.22Å |
| 59 | F | 57.6 | Low | 54.6 | Low | 151 Ų | 151 | 86.3 Ų | 86.3 | 66% | 0.662 | 46% | 0.455 | S | S | * | . | H | α-helix | trans | -67.4 | -37.7 | 175.3 | -172.3 | -101.2 | 0 | 0 | 0 | 111.9 | V55 A56 L57 M62 S63 | V55-F59 WeakPolarHBondContact O-CB 3.48Å; V55-F59 PolarHBondContact O-N 2.95Å; A56-F59 PolarHBondContact O-N 3.36Å; L57-F59 PolarHBondContact O-N 3.4Å; F59-M62 PolarHBondContact O-N 3.36Å; F59-S63 WeakPolarHBondContact O-CB 3.35Å; F59-S63 PolarHBondContact O-N 3.3Å; F59-S63 PolarHBondContact O-OG 3.18Å |
| 60 | S | 57.6 | Low | 55 | Low | 75 Ų | 75 | 88.7 Ų | 88.7 | 52% | 0.524 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -66.1 | -37.7 | 173.5 | -154.6 | 0 | 0 | 0 | 0 | 112.3 | A56 L57 S63 L64 | A56-S60 WeakPolarHBondContact O-CB 3.4Å; A56-S60 PolarHBondContact O-N 3.19Å; L57-S60 WeakPolarHBondContact O-CB 3.19Å; L57-S60 PolarHBondContact O-N 3.25Å; S60-S63 WeakPolarHBondContact CA-OG 3.46Å; S60-S63 PolarHBondContact O-OG 3.18Å; S60-L64 WeakPolarHBondContact O-CB 3.38Å; S60-L64 PolarHBondContact O-N 3.46Å |
| 61 | I | 57.8 | Low | 55.2 | Low | 100 Ų | 100 | 85.9 Ų | 85.9 | 51% | 0.513 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -69.5 | -41.1 | 174.8 | -66.7 | 159 | 0 | 0 | 0 | 110.8 | L57 V58 L64 N65 | L57-I61 HydrophobicContact CD2-CD1 4Å; L57-I61 HydrophobicContact CG-CD1 3.94Å; L57-I61 WeakPolarHBondContact O-CD1 3.37Å; L57-I61 WeakPolarHBondContact O-CG1 3.46Å; L57-I61 PolarHBondContact O-N 2.88Å; V58-I61 PolarHBondContact O-N 3.46Å; I61-L64 PolarHBondContact O-N 3.36Å; I61-N65 WeakPolarHBondContact O-CB 3.42Å; I61-N65 PolarHBondContact O-N 2.96Å |
| 62 | M | 59.3 | Low | 55.2 | Low | 76 Ų | 76 | 93 Ų | 93 | 37% | 0.374 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -66 | -40.2 | 179 | -178.2 | 176.9 | -75.3 | 0 | 0 | 112.3 | V58 F59 S66 A86 | V58-M62 WeakPolarHBondContact O-CB 3.5Å; V58-M62 PolarHBondContact O-N 3.12Å; F59-M62 PolarHBondContact O-N 3.36Å; M62-S66 PolarHBondContact O-N 3.4Å; M62-A86 HydrophobicContact CE-CB 3.44Å; M62-A86 VanDerWaalsContact CE-CB 3.44Å |
| 63 | S | 47.8 | Very low | 55.3 | Low | 63 Ų | 63 | 98.5 Ų | 98.5 | 44% | 0.441 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -67.9 | -36.9 | 176.5 | 51.8 | 0 | 0 | 0 | 0 | 112.2 | F59 S60 S66 Y67 | F59-S63 WeakPolarHBondContact O-CB 3.35Å; F59-S63 PolarHBondContact O-N 3.3Å; F59-S63 PolarHBondContact O-OG 3.18Å; S60-S63 WeakPolarHBondContact CA-OG 3.46Å; S60-S63 PolarHBondContact O-OG 3.18Å; S63-S66 PolarHBondContact O-N 3.02Å; S63-Y67 PolarHBondContact O-N 3.39Å |
| 64 | L | 53.8 | Low | 55.1 | Low | 126 Ų | 126 | 99.9 Ų | 99.9 | 66% | 0.66 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -69.7 | -38.9 | 176.3 | -153.6 | 72.4 | 0 | 0 | 0 | 112.3 | S60 I61 S66 Y67 N68 | S60-L64 WeakPolarHBondContact O-CB 3.38Å; S60-L64 PolarHBondContact O-N 3.46Å; I61-L64 PolarHBondContact O-N 3.36Å; L64-S66 VanDerWaalsContact C-N 3.26Å; L64-S66 PolarHBondContact O-N 3.38Å; L64-Y67 PolarHBondContact O-N 3.36Å; L64-N68 PolarHBondContact O-N 3.3Å |
| 65 | N | 53.2 | Low | 54.8 | Low | 113 Ų | 113 | 97.7 Ų | 97.7 | 60% | 0.604 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -69.4 | -23 | 178.7 | -159.2 | 71.6 | 0 | 0 | 0 | 113.1 | I61 | I61-N65 WeakPolarHBondContact O-CB 3.42Å; I61-N65 PolarHBondContact O-N 2.96Å |
| 66 | S | 50.9 | Low | 54.9 | Low | 79 Ų | 79 | 104.3 Ų | 104.3 | 55% | 0.552 | 56% | 0.563 | S | S | * | * | H | α-helix | trans | -84 | -16.7 | 174.7 | -168 | 0 | 0 | 0 | 0 | 113.6 | M62 S63 L64 | M62-S66 PolarHBondContact O-N 3.4Å; S63-S66 PolarHBondContact O-N 3.02Å; L64-S66 VanDerWaalsContact C-N 3.26Å; L64-S66 PolarHBondContact O-N 3.38Å |
| 67 | Y | 50.5 | Low | 55 | Low | 211 Ų | 211 | 111.8 Ų | 111.8 | 83% | 0.827 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -90.9 | -25.8 | -176.4 | -156.9 | -92.9 | 0 | 0 | 0 | 112.7 | S63 L64 | S63-Y67 PolarHBondContact O-N 3.39Å; L64-Y67 PolarHBondContact O-N 3.36Å |
| 68 | N | 51 | Low | 54.7 | Low | 150 Ų | 150 | 114.2 Ų | 114.2 | 80% | 0.802 | 59% | 0.593 | S | S | * | * | S | Bend | trans | -96.3 | -5.3 | -176.2 | -152.9 | 73.9 | 0 | 0 | 0 | 113.8 | L64 G70 | L64-N68 PolarHBondContact O-N 3.3Å; N68-G70 PolarHBondContact O-N 3.38Å |
| 69 | D | 48.1 | Very low | 54.5 | Low | 53 Ų | 53 | 113.7 Ų | 113.7 | 28% | 0.283 | 60% | 0.598 | S | S | . | * | trans | -95.4 | 79.5 | -176 | -153.6 | -103.9 | 0 | 0 | 0 | 109.5 | D71 Y72 A75 | D69-D71 PolarHBondContact O-N 3.15Å; D69-D71 VanDerWaalsContact O-N 3.12Å; D69-Y72 WeakPolarHBondContact O-CE2 3.2Å; D69-A75 WeakPolarHBondContact OD1-CB 3.21Å | ||
| 70 | G | 58.9 | Low | 54.8 | Low | 78 Ų | 78 | 112.6 Ų | 112.6 | 80% | 0.804 | 59% | 0.589 | S | S | * | * | S | Bend | trans | -70.5 | 16.9 | 168.5 | 0 | 0 | 0 | 0 | 0 | 113.8 | N68 | N68-G70 PolarHBondContact O-N 3.38Š|
| 71 | D | 52.4 | Low | 54.9 | Low | 117 Ų | 117 | 114 Ų | 114 | 63% | 0.626 | 59% | 0.59 | S | S | * | * | trans | -145.3 | 76.4 | -175.3 | -154.4 | -68 | 0 | 0 | 0 | 111.5 | D69 E73 | D69-D71 PolarHBondContact O-N 3.15Å; D69-D71 VanDerWaalsContact O-N 3.12Å; D71-E73 PolarHBondContact O-N 2.94Å | ||
| 72 | Y | 55.4 | Low | 55.1 | Low | 172 Ų | 172 | 111.4 Ų | 111.4 | 68% | 0.675 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -63.4 | -7.3 | -166.7 | -80.3 | -98.4 | 0 | 0 | 0 | 116.9 | D69 | D69-Y72 WeakPolarHBondContact O-CE2 3.2Å |
| 73 | E | 56.5 | Low | 55.3 | Low | 181 Ų | 181 | 114.2 Ų | 114.2 | 85% | 0.846 | 59% | 0.594 | S | S | * | * | H | α-helix | trans | -85.9 | -34.6 | -171.8 | -75.1 | -172.3 | 65 | 0 | 0 | 113.2 | D71 | D71-E73 PolarHBondContact O-N 2.94Å |
| 74 | G | 53.8 | Low | 56.3 | Low | 54 Ų | 54 | 119.9 Ų | 119.9 | 56% | 0.557 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -80.8 | -39.8 | 178.5 | 0 | 0 | 0 | 0 | 0 | 113.7 | R76 R77 | G74-R76 VanDerWaalsContact C-N 3.25Å; G74-R76 PolarHBondContact O-N 3Å; G74-R77 PolarHBondContact O-N 3.2Å |
| 75 | A | 53.8 | Low | 56.9 | Low | 32 Ų | 32 | 118.8 Ų | 118.8 | 26% | 0.264 | 61% | 0.605 | S | S | . | * | H | α-helix | trans | -67 | -23.8 | -176.4 | 0 | 0 | 0 | 0 | 0 | 113.5 | D69 R77 L78 G79 | D69-A75 WeakPolarHBondContact OD1-CB 3.21Å; A75-R77 PolarHBondContact O-N 3.07Å; A75-R77 VanDerWaalsContact O-N 3.17Å; A75-L78 PolarHBondContact O-N 2.82Å; A75-G79 WeakPolarHBondContact O-CA 3.26Å; A75-G79 PolarHBondContact O-N 3.49Å |
| 76 | R | 57.7 | Low | 57.4 | Low | 178 Ų | 178 | 114.1 Ų | 114.1 | 67% | 0.672 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -64.5 | -23.1 | -177.3 | -133.1 | -175.1 | -179 | -121.9 | -2.9 | 114.1 | G74 R80 | G74-R76 VanDerWaalsContact C-N 3.25Å; G74-R76 PolarHBondContact O-N 3Å; R76-R80 PolarHBondContact O-NH2 3.38Å |
| 77 | R | 57.8 | Low | 58.4 | Low | 209 Ų | 209 | 113.8 Ų | 113.8 | 79% | 0.789 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -88.3 | -39 | -178.8 | -150.4 | 165.1 | 79.8 | -156.6 | 6 | 111.9 | G74 A75 | G74-R77 PolarHBondContact O-N 3.2Å; A75-R77 PolarHBondContact O-N 3.07Å; A75-R77 VanDerWaalsContact O-N 3.17Å |
| 78 | L | 53 | Low | 59.4 | Low | 134 Ų | 134 | 106 Ų | 106 | 70% | 0.702 | 55% | 0.552 | S | S | * | * | H | α-helix | trans | -77 | -36.3 | 173.1 | -111.6 | 66.9 | 0 | 0 | 0 | 112.2 | A75 R80 N81 A82 | A75-L78 PolarHBondContact O-N 2.82Å; L78-R80 PolarHBondContact O-N 3.49Å; L78-N81 PolarHBondContact O-N 3.26Å; L78-A82 PolarHBondContact O-N 2.7Å |
| 79 | G | 56.9 | Low | 60 | Low | 36 Ų | 36 | 100.1 Ų | 100.1 | 37% | 0.371 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -63.5 | -25.6 | 179.7 | 0 | 0 | 0 | 0 | 0 | 114 | A75 A82 K83 | A75-G79 WeakPolarHBondContact O-CA 3.26Å; A75-G79 PolarHBondContact O-N 3.49Å; G79-A82 PolarHBondContact O-N 3.26Å; G79-K83 WeakPolarHBondContact O-CB 3.25Å; G79-K83 PolarHBondContact O-N 3.47Å |
| 80 | R | 65.1 | Low | 60.9 | Low | 128 Ų | 128 | 101.8 Ų | 101.8 | 48% | 0.483 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -69.5 | -41.3 | 176.1 | -146 | 147.1 | -52.4 | 168.9 | 18.4 | 112.1 | R76 L78 K83 W84 | R76-R80 PolarHBondContact O-NH2 3.38Å; L78-R80 PolarHBondContact O-N 3.49Å; R80-K83 PolarHBondContact O-N 2.9Å; R80-W84 VanDerWaalsContact O-CD1 3.25Å; R80-W84 PolarHBondContact O-N 2.84Å |
| 81 | N | 58.3 | Low | 61.7 | Low | 103 Ų | 103 | 102.8 Ų | 102.8 | 55% | 0.551 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -70.4 | -39.9 | 175.5 | -59.8 | -26.3 | 0 | 0 | 0 | 110.3 | L78 K83 W84 V85 | L78-N81 PolarHBondContact O-N 3.26Å; N81-K83 VanDerWaalsContact C-N 3.28Å; N81-K83 PolarHBondContact O-N 2.87Å; N81-W84 PolarHBondContact O-N 3.44Å; N81-V85 WeakPolarHBondContact O-CG2 3.33Å; N81-V85 PolarHBondContact O-N 3.35Å |
| 82 | A | 63.3 | Low | 62.7 | Low | 47 Ų | 47 | 102.3 Ų | 102.3 | 39% | 0.388 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -60.7 | -37.2 | 173.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | L78 G79 V85 A86 | L78-A82 PolarHBondContact O-N 2.7Å; G79-A82 PolarHBondContact O-N 3.26Å; A82-V85 PolarHBondContact O-N 2.88Å; A82-A86 VanDerWaalsContact O-CB 3.31Å; A82-A86 WeakPolarHBondContact O-CB 3.1Å; A82-A86 PolarHBondContact O-N 2.83Å |
| 83 | K | 63.7 | Low | 63.1 | Low | 134 Ų | 134 | 94.3 Ų | 94.3 | 58% | 0.583 | 48% | 0.482 | S | S | * | . | H | α-helix | trans | -64.3 | -43.2 | 174.9 | -166.5 | -179.2 | 176.3 | 81.3 | 0 | 111.8 | G79 R80 N81 A86 I87 | G79-K83 WeakPolarHBondContact O-CB 3.25Å; G79-K83 PolarHBondContact O-N 3.47Å; R80-K83 PolarHBondContact O-N 2.9Å; N81-K83 VanDerWaalsContact C-N 3.28Å; N81-K83 PolarHBondContact O-N 2.87Å; K83-A86 PolarHBondContact O-N 3.24Å; K83-I87 HydrophobicContact CG-CD1 4.04Å; K83-I87 WeakPolarHBondContact O-CB 3.38Å; K83-I87 WeakPolarHBondContact O-CD1 3.31Å; K83-I87 WeakPolarHBondContact O-CG1 3.21Å; K83-I87 PolarHBondContact O-N 2.87Å |
| 84 | W | 68.1 | Low | 63.6 | Low | 183 Ų | 183 | 91.5 Ų | 91.5 | 69% | 0.693 | 47% | 0.473 | S | S | * | . | H | α-helix | trans | -62.4 | -43.2 | 174.4 | -83.9 | 105.9 | 0 | 0 | 0 | 112.3 | R80 N81 I87 A88 | R80-W84 VanDerWaalsContact O-CD1 3.25Å; R80-W84 PolarHBondContact O-N 2.84Å; N81-W84 PolarHBondContact O-N 3.44Å; W84-I87 PolarHBondContact O-N 2.67Å; W84-A88 WeakPolarHBondContact O-CB 3.39Å; W84-A88 PolarHBondContact O-N 3.42Å |
| 85 | V | 66.3 | Low | 64.7 | Low | 103 Ų | 103 | 94 Ų | 94 | 62% | 0.624 | 47% | 0.473 | S | S | * | . | H | α-helix | trans | -65.5 | -39.9 | 177.1 | 174 | 0 | 0 | 0 | 0 | 111.4 | N81 A82 A88 S89 | N81-V85 WeakPolarHBondContact O-CG2 3.33Å; N81-V85 PolarHBondContact O-N 3.35Å; A82-V85 PolarHBondContact O-N 2.88Å; V85-A88 PolarHBondContact O-N 2.94Å; V85-S89 WeakPolarHBondContact O-CB 3.24Å; V85-S89 PolarHBondContact O-N 3.35Å |
| 86 | A | 63.8 | Low | 65.5 | Low | 14 Ų | 14 | 96.2 Ų | 96.2 | 12% | 0.116 | 48% | 0.479 | C | S | . | . | H | α-helix | trans | -65.6 | -42.6 | 176 | 0 | 0 | 0 | 0 | 0 | 112.5 | V58 M62 A82 K83 S89 I90 | V58-A86 HydrophobicContact CG1-CB 4.22Å; M62-A86 HydrophobicContact CE-CB 3.44Å; M62-A86 VanDerWaalsContact CE-CB 3.44Å; A82-A86 VanDerWaalsContact O-CB 3.31Å; A82-A86 WeakPolarHBondContact O-CB 3.1Å; A82-A86 PolarHBondContact O-N 2.83Å; K83-A86 PolarHBondContact O-N 3.24Å; A86-S89 PolarHBondContact O-N 3.02Å; A86-I90 PolarHBondContact O-N 3.49Å |
| 87 | I | 71.1 | Confident | 66.1 | Low | 73 Ų | 73 | 90.5 Ų | 90.5 | 37% | 0.374 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -63.7 | -45 | 175.5 | -68 | 162.4 | 0 | 0 | 0 | 110.4 | K83 W84 S89 I90 I91 | K83-I87 HydrophobicContact CG-CD1 4.04Å; K83-I87 WeakPolarHBondContact O-CB 3.38Å; K83-I87 WeakPolarHBondContact O-CD1 3.31Å; K83-I87 WeakPolarHBondContact O-CG1 3.21Å; K83-I87 PolarHBondContact O-N 2.87Å; W84-I87 PolarHBondContact O-N 2.67Å; I87-S89 VanDerWaalsContact C-N 3.33Å; I87-S89 PolarHBondContact O-N 3.1Å; I87-I90 WeakPolarHBondContact O-CB 3.25Å; I87-I90 PolarHBondContact O-N 3.32Å; I87-I91 HydrophobicContact CG2-CD1 4.1Å; I87-I91 WeakPolarHBondContact O-CG1 3.35Å; I87-I91 PolarHBondContact O-N 3.43Å |
| 88 | A | 72.1 | Confident | 66.9 | Low | 46 Ų | 46 | 82.5 Ų | 82.5 | 38% | 0.38 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -59.8 | -43.8 | 176.9 | 0 | 0 | 0 | 0 | 0 | 111.6 | W84 V85 I90 I91 I92 | W84-A88 WeakPolarHBondContact O-CB 3.39Å; W84-A88 PolarHBondContact O-N 3.42Å; V85-A88 PolarHBondContact O-N 2.94Å; A88-I90 VanDerWaalsContact C-N 3.35Å; A88-I90 PolarHBondContact O-N 3.16Å; A88-I91 PolarHBondContact O-N 2.92Å; A88-I92 WeakPolarHBondContact O-CD1 3.42Å; A88-I92 VanDerWaalsContact O-CG1 3.25Å; A88-I92 WeakPolarHBondContact O-CG1 3.35Å; A88-I92 PolarHBondContact O-N 3.47Å |
| 89 | S | 64.2 | Low | 68.2 | Low | 27 Ų | 27 | 80.8 Ų | 80.8 | 19% | 0.189 | 44% | 0.435 | C | S | . | . | H | α-helix | trans | -60.9 | -40.8 | 175.2 | -176.5 | 0 | 0 | 0 | 0 | 112.6 | V85 A86 I87 G93 | V85-S89 WeakPolarHBondContact O-CB 3.24Å; V85-S89 PolarHBondContact O-N 3.35Å; A86-S89 PolarHBondContact O-N 3.02Å; I87-S89 VanDerWaalsContact C-N 3.33Å; I87-S89 PolarHBondContact O-N 3.1Å; S89-G93 PolarHBondContact O-N 2.97Å |
| 90 | I | 66.2 | Low | 68.9 | Low | 88 Ų | 88 | 82.1 Ų | 82.1 | 45% | 0.451 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -61.6 | -48.2 | 176.1 | -88.8 | 167.3 | 0 | 0 | 0 | 111 | V55 A86 I87 A88 I92 G93 L94 | V55-I90 HydrophobicContact CG1-CG1 3.77Å; A86-I90 PolarHBondContact O-N 3.49Å; I87-I90 WeakPolarHBondContact O-CB 3.25Å; I87-I90 PolarHBondContact O-N 3.32Å; A88-I90 VanDerWaalsContact C-N 3.35Å; A88-I90 PolarHBondContact O-N 3.16Å; I90-I92 PolarHBondContact O-N 3.1Å; I90-G93 PolarHBondContact O-N 3.41Å; I90-L94 WeakPolarHBondContact O-CB 3.26Å; I90-L94 PolarHBondContact O-N 3.29Å |
| 91 | I | 75.9 | Confident | 69.2 | Low | 99 Ų | 99 | 79.9 Ų | 79.9 | 51% | 0.508 | 44% | 0.441 | S | S | . | . | H | α-helix | trans | -62.9 | -44.7 | -178.1 | -66.9 | 176.8 | 0 | 0 | 0 | 110.7 | I87 A88 L94 L95 | I87-I91 HydrophobicContact CG2-CD1 4.1Å; I87-I91 WeakPolarHBondContact O-CG1 3.35Å; I87-I91 PolarHBondContact O-N 3.43Å; A88-I91 PolarHBondContact O-N 2.92Å; I91-L94 PolarHBondContact O-N 2.96Å; I91-L95 HydrophobicContact CG2-CD1 4.41Å; I91-L95 WeakPolarHBondContact O-CG 3.4Å; I91-L95 PolarHBondContact O-N 2.97Å; I91-L95 VanDerWaalsContact O-N 3.1Å |
| 92 | I | 73.4 | Confident | 70.2 | Confident | 107 Ų | 107 | 77.5 Ų | 77.5 | 55% | 0.549 | 44% | 0.436 | S | S | . | . | H | α-helix | trans | -63.5 | -43.7 | 178.2 | -65.9 | 162.4 | 0 | 0 | 0 | 110.5 | A88 I90 L94 L95 I96 | A88-I92 WeakPolarHBondContact O-CD1 3.42Å; A88-I92 VanDerWaalsContact O-CG1 3.25Å; A88-I92 WeakPolarHBondContact O-CG1 3.35Å; A88-I92 PolarHBondContact O-N 3.47Å; I90-I92 PolarHBondContact O-N 3.1Å; I92-L94 PolarHBondContact O-N 3.47Å; I92-L95 PolarHBondContact O-N 3.46Å; I92-I96 VanDerWaalsContact O-CG1 3.31Å; I92-I96 WeakPolarHBondContact O-CG1 3.31Å; I92-I96 PolarHBondContact O-N 3.2Å; I92-I96 VanDerWaalsContact O-N 3.16Å |
| 93 | G | 63.2 | Low | 70.9 | Confident | 4 Ų | 4 | 78.8 Ų | 78.8 | 4% | 0.041 | 44% | 0.439 | C | S | . | . | H | α-helix | trans | -62.3 | -42.8 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112.9 | S89 I90 I96 I97 | S89-G93 PolarHBondContact O-N 2.97Å; I90-G93 PolarHBondContact O-N 3.41Å; G93-I96 PolarHBondContact O-N 3.38Å; G93-I97 VanDerWaalsContact O-CD1 3.26Å; G93-I97 WeakPolarHBondContact O-CD1 3.42Å; G93-I97 VanDerWaalsContact O-CG1 3.25Å; G93-I97 WeakPolarHBondContact O-CG1 3.5Å; G93-I97 PolarHBondContact O-N 3.44Å; G93-I97 VanDerWaalsContact O-N 3.1Å |
| 94 | L | 67.6 | Low | 71.3 | Confident | 123 Ų | 123 | 77.7 Ų | 77.7 | 64% | 0.644 | 44% | 0.436 | S | S | * | . | H | α-helix | trans | -65.9 | -39.3 | -179.6 | -141.9 | 148.2 | 0 | 0 | 0 | 112.3 | I90 I91 I92 G98 | I90-L94 WeakPolarHBondContact O-CB 3.26Å; I90-L94 PolarHBondContact O-N 3.29Å; I91-L94 PolarHBondContact O-N 2.96Å; I92-L94 PolarHBondContact O-N 3.47Å; L94-G98 PolarHBondContact O-N 3.4Å |
| 95 | L | 77.1 | Confident | 71.5 | Confident | 107 Ų | 107 | 76.5 Ų | 76.5 | 56% | 0.56 | 44% | 0.436 | S | S | * | . | H | α-helix | trans | -62.1 | -45.6 | 173.7 | -78 | 174.8 | 0 | 0 | 0 | 112.3 | I91 I92 I97 G98 I99 | I91-L95 HydrophobicContact CG2-CD1 4.41Å; I91-L95 WeakPolarHBondContact O-CG 3.4Å; I91-L95 PolarHBondContact O-N 2.97Å; I91-L95 VanDerWaalsContact O-N 3.1Å; I92-L95 PolarHBondContact O-N 3.46Å; L95-I97 PolarHBondContact O-N 2.92Å; L95-G98 PolarHBondContact O-N 2.86Å; L95-I99 WeakPolarHBondContact O-CB 3.4Å; L95-I99 WeakPolarHBondContact O-CD1 3.5Å; L95-I99 WeakPolarHBondContact O-CG1 3.21Å; L95-I99 PolarHBondContact O-N 3.43Å |
| 96 | I | 71.6 | Confident | 71.8 | Confident | 77 Ų | 77 | 76.5 Ų | 76.5 | 40% | 0.395 | 44% | 0.436 | S | S | . | . | H | α-helix | trans | -65.7 | -40.6 | -178.4 | -62.3 | -76.5 | 0 | 0 | 0 | 111.1 | P51 I92 G93 S100 | P51-I96 HydrophobicContact CB-CB 4.39Å; P51-I96 HydrophobicContact CB-CG2 4.45Å; P51-I96 HydrophobicContact CG-CB 3.96Å; P51-I96 HydrophobicContact CG-CG2 3.69Å; I92-I96 VanDerWaalsContact O-CG1 3.31Å; I92-I96 WeakPolarHBondContact O-CG1 3.31Å; I92-I96 PolarHBondContact O-N 3.2Å; I92-I96 VanDerWaalsContact O-N 3.16Å; G93-I96 PolarHBondContact O-N 3.38Å; I96-S100 WeakPolarHBondContact O-CB 3.36Å; I96-S100 PolarHBondContact O-N 3.49Å; I96-S100 PolarHBondContact O-OG 2.78Å |
| 97 | I | 68.9 | Low | 71.9 | Confident | 58 Ų | 58 | 85.4 Ų | 85.4 | 30% | 0.297 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -62.2 | -49.4 | 175.3 | -60.6 | 152.2 | 0 | 0 | 0 | 110.1 | P51 I52 G93 L95 I99 S100 C101 | P51-I97 HydrophobicContact CG-CG1 4.42Å; I52-I97 HydrophobicContact CD1-CD1 3.32Å; I52-I97 HydrophobicContact CD1-CG1 4.24Å; I52-I97 HydrophobicContact CG1-CD1 3.49Å; I52-I97 VanDerWaalsContact CG1-CD1 3.49Å; I52-I97 HydrophobicContact CG1-CG1 3.88Å; G93-I97 VanDerWaalsContact O-CD1 3.26Å; G93-I97 WeakPolarHBondContact O-CD1 3.42Å; G93-I97 VanDerWaalsContact O-CG1 3.25Å; G93-I97 WeakPolarHBondContact O-CG1 3.5Å; G93-I97 PolarHBondContact O-N 3.44Å; G93-I97 VanDerWaalsContact O-N 3.1Å; L95-I97 PolarHBondContact O-N 2.92Å; I97-I99 PolarHBondContact O-N 3.38Å; I97-S100 PolarHBondContact O-N 3.04Å; I97-C101 WeakPolarHBondContact O-CB 3.44Å; I97-C101 PolarHBondContact O-N 3.25Å; I97-C101 PolarHBondContact O-SG 3.21Å; I97-C101 VanDerWaalsContact O-SG 3.38Å |
| 98 | G | 74.5 | Confident | 71.4 | Confident | 42 Ų | 42 | 87.6 Ų | 87.6 | 43% | 0.433 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -58.4 | -46.3 | -180 | 0 | 0 | 0 | 0 | 0 | 112.5 | L94 L95 A102 | L94-G98 PolarHBondContact O-N 3.4Å; L95-G98 PolarHBondContact O-N 2.86Å; G98-A102 VanDerWaalsContact O-CB 3.26Å; G98-A102 WeakPolarHBondContact O-CB 3.24Å; G98-A102 PolarHBondContact O-N 3.39Å |
| 99 | I | 80.4 | Confident | 70.3 | Confident | 98 Ų | 98 | 91.5 Ų | 91.5 | 50% | 0.503 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -65.5 | -44.3 | 177.4 | -64.5 | 162.8 | 0 | 0 | 0 | 110.6 | L95 I97 A102 V103 | L95-I99 WeakPolarHBondContact O-CB 3.4Å; L95-I99 WeakPolarHBondContact O-CD1 3.5Å; L95-I99 WeakPolarHBondContact O-CG1 3.21Å; L95-I99 PolarHBondContact O-N 3.43Å; I97-I99 PolarHBondContact O-N 3.38Å; I99-A102 PolarHBondContact O-N 3.47Å; I99-V103 HydrophobicContact CG2-CG2 4.15Å; I99-V103 WeakPolarHBondContact O-CB 3.4Å; I99-V103 VanDerWaalsContact O-CG2 3.24Å; I99-V103 WeakPolarHBondContact O-CG2 3.19Å; I99-V103 PolarHBondContact O-N 3.02Å |
| 100 | S | 73.1 | Confident | 70.6 | Confident | 64 Ų | 64 | 94.8 Ų | 94.8 | 45% | 0.448 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -64.4 | -43.4 | -179.6 | -59.4 | 0 | 0 | 0 | 0 | 111.8 | I96 I97 H104 | I96-S100 WeakPolarHBondContact O-CB 3.36Å; I96-S100 PolarHBondContact O-N 3.49Å; I96-S100 PolarHBondContact O-OG 2.78Å; I97-S100 PolarHBondContact O-N 3.04Å; S100-H104 WeakPolarHBondContact O-CB 3.45Å; S100-H104 PolarHBondContact O-N 3.39Å |
| 101 | C | 71.3 | Confident | 70.9 | Confident | 80 Ų | 80 | 95.1 Ų | 95.1 | 54% | 0.541 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -62.6 | -47 | 174.4 | -74.8 | 0 | 0 | 0 | 0 | 111.3 | I97 H104 F105 | I97-C101 WeakPolarHBondContact O-CB 3.44Å; I97-C101 PolarHBondContact O-N 3.25Å; I97-C101 PolarHBondContact O-SG 3.21Å; I97-C101 VanDerWaalsContact O-SG 3.38Å; C101-H104 PolarHBondContact O-N 2.94Å; C101-F105 VanDerWaalsContact O-CB 3.24Å; C101-F105 WeakPolarHBondContact O-CB 3.49Å; C101-F105 PolarHBondContact O-N 3.04Å |
| 102 | A | 78.1 | Confident | 70.6 | Confident | 53 Ų | 53 | 94.9 Ų | 94.9 | 44% | 0.438 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -61.6 | -46.5 | 178.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | G98 I99 F105 T106 | G98-A102 VanDerWaalsContact O-CB 3.26Å; G98-A102 WeakPolarHBondContact O-CB 3.24Å; G98-A102 PolarHBondContact O-N 3.39Å; I99-A102 PolarHBondContact O-N 3.47Å; A102-F105 PolarHBondContact O-N 3.33Å; A102-T106 VanDerWaalsContact O-CB 3.25Å; A102-T106 WeakPolarHBondContact O-CB 3.39Å; A102-T106 PolarHBondContact O-N 2.92Å; A102-T106 PolarHBondContact O-OG1 3.26Å |
| 103 | V | 78 | Confident | 70.4 | Confident | 75 Ų | 75 | 94.2 Ų | 94.2 | 46% | 0.455 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -65.8 | -44.7 | 178.5 | 171.1 | 0 | 0 | 0 | 0 | 111.1 | I99 F105 T106 R107 | I99-V103 HydrophobicContact CG2-CG2 4.15Å; I99-V103 WeakPolarHBondContact O-CB 3.4Å; I99-V103 VanDerWaalsContact O-CG2 3.24Å; I99-V103 WeakPolarHBondContact O-CG2 3.19Å; I99-V103 PolarHBondContact O-N 3.02Å; V103-F105 PolarHBondContact O-N 2.96Å; V103-T106 PolarHBondContact O-N 2.89Å; V103-R107 WeakPolarHBondContact O-CB 3.25Å; V103-R107 PolarHBondContact O-N 2.97Å |
| 104 | H | 71.6 | Confident | 70.9 | Confident | 111 Ų | 111 | 99.8 Ų | 99.8 | 51% | 0.514 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -61.1 | -44.4 | 177.2 | -177.7 | -84.9 | 0 | 0 | 0 | 111.6 | S100 C101 T106 R107 N108 | S100-H104 WeakPolarHBondContact O-CB 3.45Å; S100-H104 PolarHBondContact O-N 3.39Å; C101-H104 PolarHBondContact O-N 2.94Å; H104-T106 VanDerWaalsContact C-N 3.33Å; H104-T106 PolarHBondContact O-N 3.17Å; H104-R107 PolarHBondContact O-N 3.41Å; H104-N108 PolarHBondContact CE1-ND2 3.21Å; H104-N108 WeakPolarHBondContact O-CB 3.37Å; H104-N108 PolarHBondContact O-N 3.38Å |
| 105 | F | 73.5 | Confident | 71.1 | Confident | 158 Ų | 158 | 98.3 Ų | 98.3 | 69% | 0.693 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -65.2 | -37.7 | 176.7 | -162.5 | -93.3 | 0 | 0 | 0 | 112 | C101 A102 V103 A109 | C101-F105 VanDerWaalsContact O-CB 3.24Å; C101-F105 WeakPolarHBondContact O-CB 3.49Å; C101-F105 PolarHBondContact O-N 3.04Å; A102-F105 PolarHBondContact O-N 3.33Å; V103-F105 PolarHBondContact O-N 2.96Å; F105-A109 WeakPolarHBondContact O-CB 3.35Å; F105-A109 PolarHBondContact O-N 3.19Å |
| 106 | T | 72.6 | Confident | 70.7 | Confident | 102 Ų | 102 | 97.6 Ų | 97.6 | 63% | 0.626 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -73.8 | -29.6 | 177.8 | -55.3 | 0 | 0 | 0 | 0 | 112.8 | A102 V103 H104 | A102-T106 VanDerWaalsContact O-CB 3.25Å; A102-T106 WeakPolarHBondContact O-CB 3.39Å; A102-T106 PolarHBondContact O-N 2.92Å; A102-T106 PolarHBondContact O-OG1 3.26Å; V103-T106 PolarHBondContact O-N 2.89Å; H104-T106 VanDerWaalsContact C-N 3.33Å; H104-T106 PolarHBondContact O-N 3.17Å |
| 107 | R | 64.9 | Low | 70.6 | Confident | 201 Ų | 201 | 99.2 Ų | 99.2 | 76% | 0.758 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -80.9 | -22.4 | 176.3 | -114.2 | 170.3 | 58.7 | -179.5 | -1.6 | 113.5 | V103 H104 | V103-R107 WeakPolarHBondContact O-CB 3.25Å; V103-R107 PolarHBondContact O-N 2.97Å; H104-R107 PolarHBondContact O-N 3.41Å |
| 108 | N | 60.2 | Low | 70.7 | Confident | 120 Ų | 120 | 102.7 Ų | 102.7 | 64% | 0.642 | 59% | 0.592 | S | S | * | * | trans | -98.1 | 0.3 | 178.8 | -79.3 | 24.4 | 0 | 0 | 0 | 113.3 | H104 | H104-N108 PolarHBondContact CE1-ND2 3.21Å; H104-N108 WeakPolarHBondContact O-CB 3.37Å; H104-N108 PolarHBondContact O-N 3.38Å | ||
| 109 | A | 50.6 | Low | 70.4 | Confident | 128 Ų | 128 | 108.2 Ų | 108.2 | 100% | 1.058 | 61% | 0.607 | S | S | * | * | trans | -105.5 | 0 | 172.6 | 0 | 0 | 0 | 0 | 0 | 110.2 | F105 | F105-A109 WeakPolarHBondContact O-CB 3.35Å; F105-A109 PolarHBondContact O-N 3.19Å |
Retrieved 109 of 109 residues in 174.3 ms
(Link to these results)