| 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 | 55.3 | Low | 58.2 | Low | 227 Ų | 227 | 148.6 Ų | 148.6 | 100% | 1.118 | 73% | 0.727 | S | S | * | * | 0 | -10.5 | 0 | -72.3 | -163.3 | -110.4 | 0 | 0 | 114.7 | |||||
| 2 | F | 54.2 | Low | 58.2 | Low | 178 Ų | 178 | 146.8 Ų | 146.8 | 78% | 0.781 | 73% | 0.732 | S | S | * | * | G | 310 helix | trans | -87.1 | -3.4 | -178.6 | -70.1 | -78.1 | 0 | 0 | 0 | 116.3 | R4 L5 | F2-R4 VanDerWaalsContact C-N 3.26Å; F2-R4 PolarHBondContact O-N 3.26Å; F2-L5 HydrophobicContact CD1-CD1 4.48Å |
| 3 | Q | 58.7 | Low | 58 | Low | 178 Ų | 178 | 144.7 Ų | 144.7 | 83% | 0.832 | 74% | 0.735 | S | S | * | * | G | 310 helix | trans | -75.3 | -8.6 | -178.6 | -66.7 | -175.9 | 16.7 | 0 | 0 | 114.4 | ||
| 4 | R | 59.6 | Low | 58.2 | Low | 213 Ų | 213 | 141.7 Ų | 141.7 | 80% | 0.804 | 73% | 0.734 | S | S | * | * | G | 310 helix | trans | -91.7 | -9.6 | -177.4 | -59.3 | -174.1 | 86.8 | 164.4 | 5.2 | 114.1 | F2 | F2-R4 VanDerWaalsContact C-N 3.26Å; F2-R4 PolarHBondContact O-N 3.26Å |
| 5 | L | 61.2 | Low | 58 | Low | 106 Ų | 106 | 139.4 Ų | 139.4 | 56% | 0.555 | 73% | 0.731 | S | S | * | * | S | Bend | trans | -91.5 | -24.3 | -177.6 | -67.5 | 169.7 | 0 | 0 | 0 | 112.9 | F2 S7 L8 | F2-L5 HydrophobicContact CD1-CD1 4.48Å; L5-S7 VanDerWaalsContact C-N 3.33Å; L5-S7 PolarHBondContact O-N 3.24Å; L5-L8 PolarHBondContact O-N 3.27Å |
| 6 | T | 59.6 | Low | 57.2 | Low | 88 Ų | 88 | 136.9 Ų | 136.9 | 54% | 0.54 | 73% | 0.726 | S | S | . | * | H | α-helix | trans | -74.5 | -21.5 | -177.4 | 52.3 | 0 | 0 | 0 | 0 | 113.4 | F10 | T6-F10 PolarHBondContact O-N 3.12Å; T6-F10 VanDerWaalsContact O-N 3.11Å |
| 7 | S | 59 | Low | 57 | Low | 70 Ų | 70 | 140.1 Ų | 140.1 | 49% | 0.49 | 74% | 0.736 | S | S | . | * | H | α-helix | trans | -76.1 | -22.6 | 176.7 | 65.4 | 0 | 0 | 0 | 0 | 113.3 | L5 S11 | L5-S7 VanDerWaalsContact C-N 3.33Å; L5-S7 PolarHBondContact O-N 3.24Å; S7-S11 PolarHBondContact O-N 3.11Å; S7-S11 PolarHBondContact O-OG 3.39Å |
| 8 | L | 60.6 | Low | 56.1 | Low | 140 Ų | 140 | 138.7 Ų | 138.7 | 73% | 0.733 | 73% | 0.729 | S | S | * | * | H | α-helix | trans | -80 | -26.4 | 176.5 | -78.9 | 165.5 | 0 | 0 | 0 | 112.4 | L5 | L5-L8 PolarHBondContact O-N 3.27Å |
| 9 | F | 62.4 | Low | 56 | Low | 176 Ų | 176 | 137.4 Ų | 137.4 | 77% | 0.772 | 73% | 0.729 | S | S | * | * | H | α-helix | trans | -95 | -24.4 | 179.2 | -80.1 | -84.6 | 0 | 0 | 0 | 114.2 | ||
| 10 | F | 61.2 | Low | 55.7 | Low | 166 Ų | 166 | 138.6 Ų | 138.6 | 73% | 0.728 | 74% | 0.736 | S | S | * | * | trans | -124.7 | 33.2 | -178.1 | -66.1 | -84.3 | 0 | 0 | 0 | 112.9 | T6 T12 | T6-F10 PolarHBondContact O-N 3.12Å; T6-F10 VanDerWaalsContact O-N 3.11Å; F10-T12 VanDerWaalsContact C-N 3.28Å; F10-T12 PolarHBondContact O-N 3.1Å | ||
| 11 | S | 48.7 | Very low | 54.8 | Low | 93 Ų | 93 | 136.9 Ų | 136.9 | 65% | 0.65 | 73% | 0.734 | S | S | * | * | trans | -65.6 | 95.1 | 162.2 | -78.2 | 0 | 0 | 0 | 0 | 108.2 | S7 P13 | S7-S11 PolarHBondContact O-N 3.11Å; S7-S11 PolarHBondContact O-OG 3.39Å; S11-P13 WeakPolarHBondContact O-CD 3.43Å | ||
| 12 | T | 58 | Low | 54.6 | Low | 127 Ų | 127 | 131 Ų | 131 | 78% | 0.779 | 71% | 0.713 | S | S | * | * | P | Polyproline II helix | trans | -61.7 | 119.3 | 159.6 | 36.4 | 0 | 0 | 0 | 0 | 107.3 | F10 S14 | F10-T12 VanDerWaalsContact C-N 3.28Å; F10-T12 PolarHBondContact O-N 3.1Å; T12-S14 PolarHBondContact O-N 3.2Å |
| 13 | P | 55.4 | Low | 54.4 | Low | 119 Ų | 119 | 131.9 Ų | 131.9 | 77% | 0.773 | 71% | 0.711 | S | S | * | * | P | Polyproline II helix | trans | -60.5 | 133.5 | 166.4 | 26.8 | -31.4 | 0 | 0 | 0 | 107.6 | S11 | S11-P13 WeakPolarHBondContact O-CD 3.43Š|
| 14 | S | 61.6 | Low | 54.4 | Low | 103 Ų | 103 | 125.8 Ų | 125.8 | 72% | 0.72 | 69% | 0.691 | S | S | * | * | P | Polyproline II helix | trans | -53.9 | 136.7 | 165.5 | 49.6 | 0 | 0 | 0 | 0 | 108.2 | T12 | T12-S14 PolarHBondContact O-N 3.2Š|
| 15 | P | 54.1 | Low | 54 | Low | 107 Ų | 107 | 122.7 Ų | 122.7 | 70% | 0.695 | 68% | 0.684 | S | S | * | * | P | Polyproline II helix | trans | -56.7 | 135.8 | 173.9 | 25.5 | -32.5 | 0 | 0 | 0 | 108.2 | E17 | P15-E17 PolarHBondContact O-N 2.92Å; P15-E17 VanDerWaalsContact O-N 3.12Å |
| 16 | P | 45.6 | Very low | 53.7 | Low | 100 Ų | 100 | 121.7 Ų | 121.7 | 65% | 0.649 | 68% | 0.682 | S | S | * | * | P | Polyproline II helix | trans | -59.3 | 120 | 167.1 | 25.5 | -30.3 | 0 | 0 | 0 | 107.1 | D18 | P16-D18 PolarHBondContact O-N 2.85Š|
| 17 | E | 53.4 | Low | 53.4 | Low | 191 Ų | 191 | 120.1 Ų | 120.1 | 89% | 0.893 | 67% | 0.674 | S | S | * | * | trans | -68.1 | 89.9 | 157.5 | -67.4 | -156.7 | 139.5 | 0 | 0 | 106 | P15 P19 | P15-E17 PolarHBondContact O-N 2.92Å; P15-E17 VanDerWaalsContact O-N 3.12Å; E17-P19 VanDerWaalsContact O-CD 3.27Å; E17-P19 WeakPolarHBondContact O-CD 3.46Å | ||
| 18 | D | 41.8 | Very low | 53.2 | Low | 115 Ų | 115 | 125.6 Ų | 125.6 | 62% | 0.615 | 69% | 0.692 | S | S | * | * | trans | -87.4 | 106.6 | 164.4 | -70.4 | -38.8 | 0 | 0 | 0 | 107.2 | P16 D20 | P16-D18 PolarHBondContact O-N 2.85Å; D18-D20 VanDerWaalsContact C-N 3.34Å; D18-D20 PolarHBondContact O-N 3.14Å; D18-D20 VanDerWaalsContact O-N 3.11Å | ||
| 19 | P | 54 | Low | 52.9 | Low | 113 Ų | 113 | 126.6 Ų | 126.6 | 73% | 0.734 | 69% | 0.693 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.9 | 91.6 | 166.8 | 32.5 | -28.1 | 0 | 0 | 0 | 106.9 | E17 | E17-P19 VanDerWaalsContact O-CD 3.27Å; E17-P19 WeakPolarHBondContact O-CD 3.46Å |
| 20 | D | 49.3 | Very low | 52.7 | Low | 161 Ų | 161 | 123.4 Ų | 123.4 | 86% | 0.861 | 68% | 0.684 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 159.6 | 46.4 | 151.1 | -81.4 | -25.8 | 0 | 0 | 0 | 112 | D18 | D18-D20 VanDerWaalsContact C-N 3.34Å; D18-D20 PolarHBondContact O-N 3.14Å; D18-D20 VanDerWaalsContact O-N 3.11Å |
| 21 | C | 38 | Very low | 52.3 | Low | 104 Ų | 104 | 124 Ų | 124 | 70% | 0.703 | 69% | 0.689 | S | S | * | * | trans | -91 | 116.8 | 156.2 | -75 | 0 | 0 | 0 | 0 | 107.8 | R23 | C21-R23 PolarHBondContact O-N 2.7Š| ||
| 22 | P | 50.7 | Low | 52.7 | Low | 102 Ų | 102 | 123.7 Ų | 123.7 | 66% | 0.662 | 68% | 0.683 | S | S | * | * | trans | -59.1 | 118 | 170.6 | 24.2 | -30.3 | 0 | 0 | 0 | 106.9 | A24 P41 | P22-A24 VanDerWaalsContact C-N 3.32Å; P22-A24 PolarHBondContact O-N 2.66Å; P22-P41 HydrophobicContact CB-CG 4.48Å | ||
| 23 | R | 50.2 | Low | 52.8 | Low | 198 Ų | 198 | 124.8 Ų | 124.8 | 75% | 0.747 | 68% | 0.684 | S | S | * | * | trans | -63.5 | 96.8 | 179.8 | -170 | 175.9 | -166.6 | 176 | 2.7 | 107.3 | C21 F25 | C21-R23 PolarHBondContact O-N 2.7Å; R23-F25 HydrophobicContact CB-CE2 4.34Å; R23-F25 HydrophobicContact CB-CZ 4.43Å; R23-F25 HydrophobicContact CG-CE1 4.43Å; R23-F25 HydrophobicContact CG-CZ 4.34Å; R23-F25 WeakPolarHBondContact O-CD2 3.15Å; R23-F25 WeakPolarHBondContact O-CE2 3.49Å; R23-F25 PolarHBondContact O-N 3.08Å; R23-F25 VanDerWaalsContact O-N 3.08Å | ||
| 24 | A | 57.9 | Low | 53.3 | Low | 50 Ų | 50 | 122.8 Ų | 122.8 | 41% | 0.413 | 69% | 0.685 | S | S | . | * | trans | -61.9 | 111.8 | 168.2 | 0 | 0 | 0 | 0 | 0 | 106.7 | P22 I38 | P22-A24 VanDerWaalsContact C-N 3.32Å; P22-A24 PolarHBondContact O-N 2.66Å; A24-I38 HydrophobicContact CB-CG2 3.82Å | ||
| 25 | F | 52.3 | Low | 53.8 | Low | 148 Ų | 148 | 128 Ų | 128 | 65% | 0.649 | 69% | 0.689 | S | S | * | * | B | Isolated β-bridge | trans | -79 | 123 | 175.1 | -67.6 | -88.3 | 0 | 0 | 0 | 106.9 | R23 | R23-F25 HydrophobicContact CB-CE2 4.34Å; R23-F25 HydrophobicContact CB-CZ 4.43Å; R23-F25 HydrophobicContact CG-CE1 4.43Å; R23-F25 HydrophobicContact CG-CZ 4.34Å; R23-F25 WeakPolarHBondContact O-CD2 3.15Å; R23-F25 WeakPolarHBondContact O-CE2 3.49Å; R23-F25 PolarHBondContact O-N 3.08Å; R23-F25 VanDerWaalsContact O-N 3.08Å |
| 26 | V | 54.8 | Low | 54.5 | Low | 85 Ų | 85 | 129.1 Ų | 129.1 | 52% | 0.515 | 69% | 0.689 | S | S | . | * | trans | -91 | 110.2 | 168.4 | -180 | 0 | 0 | 0 | 0 | 105.5 | E28 L36 | V26-E28 PolarHBondContact O-N 2.87Å; V26-L36 HydrophobicContact CG1-CD2 4.13Å | ||
| 27 | S | 53.5 | Low | 55.5 | Low | 54 Ų | 54 | 128.6 Ų | 128.6 | 38% | 0.378 | 68% | 0.679 | S | S | . | * | trans | -68.8 | 120.4 | 171.6 | 25.3 | 0 | 0 | 0 | 0 | 108.6 | E29 | S27-E29 PolarHBondContact O-N 2.67Å; S27-E29 VanDerWaalsContact O-N 3.13Å | ||
| 28 | E | 53 | Low | 56.5 | Low | 186 Ų | 186 | 124 Ų | 124 | 87% | 0.869 | 66% | 0.66 | S | S | * | * | S | Bend | trans | -77.4 | 12.7 | 179.3 | -151.1 | 176.5 | 174.4 | 0 | 0 | 112.2 | V26 | V26-E28 PolarHBondContact O-N 2.87Š|
| 29 | E | 55.3 | Low | 57.9 | Low | 160 Ų | 160 | 123.5 Ų | 123.5 | 75% | 0.748 | 66% | 0.658 | S | S | * | * | S | Bend | trans | -118.2 | 39.3 | -172.4 | 62.8 | 179 | -175.5 | 0 | 0 | 112.7 | S27 | S27-E29 PolarHBondContact O-N 2.67Å; S27-E29 VanDerWaalsContact O-N 3.13Å |
| 30 | D | 57 | Low | 58.6 | Low | 110 Ų | 110 | 124.7 Ų | 124.7 | 59% | 0.588 | 66% | 0.657 | S | S | * | * | trans | -171.2 | 68.9 | 155.9 | -91.8 | -37 | 0 | 0 | 0 | 110.1 | V32 | D30-V32 HydrophobicContact CB-CG1 4.48Å; D30-V32 PolarHBondContact O-N 3.37Å | ||
| 31 | E | 53.2 | Low | 59.2 | Low | 179 Ų | 179 | 120.5 Ų | 120.5 | 84% | 0.836 | 64% | 0.639 | S | S | * | * | trans | -74.5 | 62.2 | 160.9 | -67.9 | -169.6 | 156.6 | 0 | 0 | 109.7 | ||||
| 32 | V | 58.6 | Low | 60.1 | Low | 85 Ų | 85 | 123.1 Ų | 123.1 | 52% | 0.515 | 65% | 0.646 | S | S | . | * | trans | -90.7 | 114.5 | 171.2 | -52.7 | 0 | 0 | 0 | 0 | 108.1 | D30 G34 | D30-V32 HydrophobicContact CB-CG1 4.48Å; D30-V32 PolarHBondContact O-N 3.37Å; V32-G34 PolarHBondContact O-N 3.27Å | ||
| 33 | D | 59 | Low | 60.3 | Low | 150 Ų | 150 | 123.1 Ų | 123.1 | 80% | 0.802 | 65% | 0.648 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 61.1 | 42.3 | 171.2 | -63.3 | -31.2 | 0 | 0 | 0 | 117.5 | W35 | D33-W35 PolarHBondContact O-N 3.49Š|
| 34 | G | 65.5 | Low | 60.3 | Low | 77 Ų | 77 | 124.7 Ų | 124.7 | 79% | 0.794 | 66% | 0.656 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 65.4 | 11.9 | 160.6 | 0 | 0 | 0 | 0 | 0 | 116.4 | V32 | V32-G34 PolarHBondContact O-N 3.27Š|
| 35 | W | 73.6 | Confident | 60.2 | Low | 212 Ų | 212 | 126.3 Ų | 126.3 | 80% | 0.803 | 67% | 0.669 | S | S | * | * | trans | -107.1 | 126.8 | 168.3 | -63.6 | 96.6 | 0 | 0 | 0 | 108.7 | D33 | D33-W35 PolarHBondContact O-N 3.49Š| ||
| 36 | L | 66.9 | Low | 60.2 | Low | 131 Ų | 131 | 123.4 Ų | 123.4 | 69% | 0.686 | 67% | 0.672 | S | S | * | * | trans | -81.7 | 122.2 | 172 | -86.4 | 77.6 | 0 | 0 | 0 | 109.1 | V26 | V26-L36 HydrophobicContact CG1-CD2 4.13Š| ||
| 37 | I | 68.5 | Low | 60.2 | Low | 89 Ų | 89 | 124.7 Ų | 124.7 | 46% | 0.456 | 68% | 0.682 | S | S | . | * | trans | -84.2 | 122.8 | 171.7 | -63 | 144.8 | 0 | 0 | 0 | 107.4 | ||||
| 38 | I | 72.8 | Confident | 60.1 | Low | 94 Ų | 94 | 128 Ų | 128 | 48% | 0.482 | 70% | 0.703 | S | S | . | * | trans | -113.8 | 110.8 | 179.3 | -54.7 | 176 | 0 | 0 | 0 | 107.9 | A24 L40 | A24-I38 HydrophobicContact CB-CG2 3.82Å; I38-L40 HydrophobicContact CB-CD1 4.48Å; I38-L40 HydrophobicContact CG2-CD1 3.94Å; I38-L40 PolarHBondContact O-N 3.09Å | ||
| 39 | D | 71.2 | Confident | 59.8 | Low | 106 Ų | 106 | 124.5 Ų | 124.5 | 57% | 0.567 | 70% | 0.699 | S | S | * | * | B | Isolated β-bridge | trans | -81.6 | 112 | 173.6 | -68.2 | -32.5 | 0 | 0 | 0 | 109.5 | ||
| 40 | L | 69.5 | Low | 59.5 | Low | 138 Ų | 138 | 123.6 Ų | 123.6 | 72% | 0.723 | 71% | 0.706 | S | S | * | * | trans | -86.8 | 136.4 | 170.3 | -80 | 81.8 | 0 | 0 | 0 | 109.1 | I38 | I38-L40 HydrophobicContact CB-CD1 4.48Å; I38-L40 HydrophobicContact CG2-CD1 3.94Å; I38-L40 PolarHBondContact O-N 3.09Å | ||
| 41 | P | 61.5 | Low | 59.4 | Low | 73 Ų | 73 | 121.8 Ų | 121.8 | 47% | 0.474 | 71% | 0.714 | S | S | . | * | trans | -67.7 | 140.2 | 176.4 | 27.3 | -33 | 0 | 0 | 0 | 111.1 | P22 S43 | P22-P41 HydrophobicContact CB-CG 4.48Å; P41-S43 PolarHBondContact O-N 2.73Å | ||
| 42 | D | 57.7 | Low | 58.8 | Low | 159 Ų | 159 | 118 Ų | 118 | 85% | 0.85 | 71% | 0.714 | S | S | * | * | G | 310 helix | trans | -59.6 | 6 | 179.5 | -72 | -37.2 | 0 | 0 | 0 | 115.3 | Y44 A45 | D42-Y44 PolarHBondContact O-N 3.22Å; D42-Y44 VanDerWaalsContact O-N 3.16Å; D42-A45 PolarHBondContact O-N 3.32Å |
| 43 | S | 53.5 | Low | 58.1 | Low | 102 Ų | 102 | 119 Ų | 119 | 71% | 0.713 | 73% | 0.731 | S | S | * | * | G | 310 helix | trans | -75.1 | 2.7 | -175.5 | 57.2 | 0 | 0 | 0 | 0 | 115 | P41 | P41-S43 PolarHBondContact O-N 2.73Š|
| 44 | Y | 51.8 | Low | 57.6 | Low | 231 Ų | 231 | 117.9 Ų | 117.9 | 91% | 0.906 | 73% | 0.734 | S | S | * | * | G | 310 helix | trans | -96.4 | 18.2 | 169.6 | -154.8 | -98.7 | 0 | 0 | 0 | 113.2 | D42 A46 | D42-Y44 PolarHBondContact O-N 3.22Å; D42-Y44 VanDerWaalsContact O-N 3.16Å; Y44-A46 PolarHBondContact O-N 2.87Å; Y44-A46 VanDerWaalsContact O-N 3.16Å |
| 45 | A | 53.9 | Low | 56.7 | Low | 84 Ų | 84 | 118.7 Ų | 118.7 | 69% | 0.694 | 73% | 0.734 | S | S | * | * | trans | -71.7 | 105.9 | 165 | 0 | 0 | 0 | 0 | 0 | 109.4 | D42 | D42-A45 PolarHBondContact O-N 3.32Š| ||
| 46 | A | 52.5 | Low | 55.4 | Low | 86 Ų | 86 | 114.6 Ų | 114.6 | 71% | 0.711 | 73% | 0.734 | S | S | * | * | P | Polyproline II helix | trans | -51 | 141 | 173.8 | 0 | 0 | 0 | 0 | 0 | 111.2 | Y44 | Y44-A46 PolarHBondContact O-N 2.87Å; Y44-A46 VanDerWaalsContact O-N 3.16Å |
| 47 | P | 55.8 | Low | 54.8 | Low | 113 Ų | 113 | 113.5 Ų | 113.5 | 73% | 0.734 | 74% | 0.744 | S | S | * | * | P | Polyproline II helix | trans | -63.6 | 140.5 | -179.6 | 26.3 | -33.3 | 0 | 0 | 0 | 110.4 | S49 | P47-S49 PolarHBondContact O-N 2.88Š|
| 48 | P | 51.5 | Low | 54.1 | Low | 124 Ų | 124 | 113 Ų | 113 | 81% | 0.805 | 76% | 0.76 | S | S | * | * | P | Polyproline II helix | trans | -68.4 | 119.9 | 174.9 | 27.2 | -32.1 | 0 | 0 | 0 | 109.8 | ||
| 49 | S | 45.8 | Very low | 53.1 | Low | 112 Ų | 112 | 119.4 Ų | 119.4 | 78% | 0.783 | 78% | 0.779 | S | S | * | * | P | Polyproline II helix | trans | -55.4 | 132.1 | 170.6 | -63.2 | 0 | 0 | 0 | 0 | 110.9 | P47 G51 | P47-S49 PolarHBondContact O-N 2.88Å; S49-G51 PolarHBondContact O-N 2.78Å |
| 50 | P | 48.8 | Very low | 52.6 | Low | 140 Ų | 140 | 119.7 Ų | 119.7 | 91% | 0.909 | 79% | 0.786 | S | S | * | * | S | Bend | trans | -80.9 | 92.5 | 178.3 | 32.3 | -30.7 | 0 | 0 | 0 | 108.8 | ||
| 51 | G | 55 | Low | 52.3 | Low | 72 Ų | 72 | 118.3 Ų | 118.3 | 74% | 0.742 | 79% | 0.786 | S | S | * | * | trans | 168.8 | 60.6 | 178.4 | 0 | 0 | 0 | 0 | 0 | 115.5 | S49 | S49-G51 PolarHBondContact O-N 2.78Š| ||
| 52 | A | 42.2 | Very low | 52.1 | Low | 101 Ų | 101 | 120.8 Ų | 120.8 | 84% | 0.835 | 80% | 0.801 | S | S | * | * | trans | -156 | 116.4 | 154.7 | 0 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 53 | A | 42.7 | Very low | 51.8 | Low | 106 Ų | 106 | 117.1 Ų | 117.1 | 88% | 0.876 | 79% | 0.794 | S | S | * | * | trans | -62.4 | 150.7 | 178.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 54 | S | 48.6 | Very low | 51.6 | Low | 126 Ų | 126 | 117.5 Ų | 117.5 | 88% | 0.881 | 79% | 0.794 | S | S | * | * | trans | -56.9 | 137.7 | 176.2 | -58 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 55 | A | 46.6 | Very low | 51.9 | Low | 94 Ų | 94 | 110.7 Ų | 110.7 | 78% | 0.777 | 78% | 0.78 | S | S | * | * | trans | 145 | 164.6 | 132.9 | 0 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 56 | P | 45.9 | Very low | 51.8 | Low | 126 Ų | 126 | 113 Ų | 113 | 82% | 0.818 | 78% | 0.78 | S | S | * | * | -106.9 | 167.4 | -52.7 | 35.1 | -22.3 | 0 | 0 | 0 | 111.4 | |||||
| 57 | A | 55 | Low | 51.8 | Low | 107 Ų | 107 | 117.1 Ų | 117.1 | 88% | 0.884 | 79% | 0.786 | S | S | * | * | trans | -59.6 | 138.1 | 177.8 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 58 | G | 54.3 | Low | 52 | Low | 78 Ų | 78 | 117.6 Ų | 117.6 | 80% | 0.804 | 78% | 0.783 | S | S | * | * | trans | 135.9 | 37.5 | 154.7 | 0 | 0 | 0 | 0 | 0 | 118.9 | ||||
| 59 | R | 51 | Low | 52.4 | Low | 230 Ų | 230 | 119.1 Ų | 119.1 | 87% | 0.868 | 78% | 0.779 | S | S | * | * | trans | -167.2 | 127.2 | 149.6 | -158.9 | 167.4 | 176.1 | 179.1 | -2.5 | 109.8 | ||||
| 60 | P | 60.7 | Low | 53.4 | Low | 112 Ų | 112 | 119.4 Ų | 119.4 | 73% | 0.727 | 78% | 0.781 | S | S | * | * | P | Polyproline II helix | trans | -64.5 | 136.4 | 170.4 | 26.4 | -30.9 | 0 | 0 | 0 | 109 | ||
| 61 | P | 63.9 | Low | 54.1 | Low | 109 Ų | 109 | 122.8 Ų | 122.8 | 71% | 0.708 | 78% | 0.776 | S | S | * | * | P | Polyproline II helix | trans | -58.7 | 143.1 | 168.3 | 26.1 | -32.4 | 0 | 0 | 0 | 108.6 | A63 | P61-A63 PolarHBondContact O-N 3.44Å; P61-A63 VanDerWaalsContact O-N 3.12Å |
| 62 | P | 56.3 | Low | 54.4 | Low | 124 Ų | 124 | 127.8 Ų | 127.8 | 81% | 0.805 | 78% | 0.777 | S | S | * | * | P | Polyproline II helix | trans | -55.5 | 125.7 | 166.5 | 25.7 | -31.3 | 0 | 0 | 0 | 106.6 | ||
| 63 | A | 51.8 | Low | 55.9 | Low | 83 Ų | 83 | 128.8 Ų | 128.8 | 69% | 0.686 | 77% | 0.773 | S | S | * | * | P | Polyproline II helix | trans | -46.4 | 140 | 177.4 | 0 | 0 | 0 | 0 | 0 | 109.1 | P61 S65 | P61-A63 PolarHBondContact O-N 3.44Å; P61-A63 VanDerWaalsContact O-N 3.12Å; A63-S65 PolarHBondContact O-N 3Å |
| 64 | P | 50.7 | Low | 57.3 | Low | 110 Ų | 110 | 129.7 Ų | 129.7 | 71% | 0.714 | 77% | 0.768 | S | S | * | * | P | Polyproline II helix | trans | -54.4 | 118.4 | 160.2 | 25.8 | -30.9 | 0 | 0 | 0 | 105.1 | L66 | P64-L66 PolarHBondContact O-N 3.47Š|
| 65 | S | 56.2 | Low | 58.3 | Low | 87 Ų | 87 | 126.7 Ų | 126.7 | 61% | 0.608 | 75% | 0.745 | S | S | * | * | trans | -65.2 | 73 | 166.3 | 49.7 | 0 | 0 | 0 | 0 | 107.1 | A63 M67 | A63-S65 PolarHBondContact O-N 3Å; S65-M67 PolarHBondContact O-N 2.89Å | ||
| 66 | L | 53.5 | Low | 59.6 | Low | 134 Ų | 134 | 126 Ų | 126 | 70% | 0.702 | 73% | 0.733 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77.2 | 35.3 | 177.2 | -168.5 | 121.5 | 0 | 0 | 0 | 110 | P64 | P64-L66 PolarHBondContact O-N 3.47Š|
| 67 | M | 50.8 | Low | 60.4 | Low | 171 Ų | 171 | 123.7 Ų | 123.7 | 84% | 0.842 | 73% | 0.725 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -141.3 | 24.9 | 179.8 | -65.1 | -64.9 | 154.4 | 0 | 0 | 110.7 | S65 | S65-M67 PolarHBondContact O-N 2.89Š|
| 68 | D | 60.2 | Low | 60.6 | Low | 124 Ų | 124 | 124 Ų | 124 | 66% | 0.663 | 72% | 0.719 | S | S | * | * | S | Bend | trans | -116.1 | 8.3 | -174.6 | -126.4 | 21.9 | 0 | 0 | 0 | 115.3 | ||
| 69 | E | 60.2 | Low | 60.9 | Low | 155 Ų | 155 | 128.3 Ų | 128.3 | 72% | 0.724 | 72% | 0.716 | S | S | * | * | S | Bend | trans | -142.2 | 112.2 | 174.6 | -51 | 80.4 | -177.3 | 0 | 0 | 110.7 | ||
| 70 | S | 67.3 | Low | 61.1 | Low | 118 Ų | 118 | 122.5 Ų | 122.5 | 83% | 0.825 | 71% | 0.706 | S | S | * | * | trans | 127.9 | 65.1 | 152.1 | -161.5 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 71 | W | 63.2 | Low | 60.9 | Low | 211 Ų | 211 | 120.8 Ų | 120.8 | 80% | 0.799 | 70% | 0.701 | S | S | * | * | trans | -130.3 | 14.4 | 148.5 | 67.4 | -85.6 | 0 | 0 | 0 | 112.8 | V73 | W71-V73 PolarHBondContact O-N 3.29Š| ||
| 72 | F | 61.3 | Low | 60.5 | Low | 177 Ų | 177 | 125.1 Ų | 125.1 | 78% | 0.776 | 71% | 0.712 | S | S | * | * | trans | -74.2 | 77 | 169.7 | -66.8 | -71.5 | 0 | 0 | 0 | 110 | T74 | F72-T74 PolarHBondContact O-N 3.47Š| ||
| 73 | V | 74.4 | Confident | 60.3 | Low | 123 Ų | 123 | 121.9 Ų | 121.9 | 75% | 0.745 | 70% | 0.701 | S | S | * | * | trans | -66.7 | 111.5 | 161.2 | 178.5 | 0 | 0 | 0 | 0 | 106 | W71 P75 | W71-V73 PolarHBondContact O-N 3.29Å; V73-P75 VanDerWaalsContact O-CD 3.28Å; V73-P75 WeakPolarHBondContact O-CD 3.46Å; V73-P75 VanDerWaalsContact O-N 3.08Å | ||
| 74 | T | 72 | Confident | 60.5 | Low | 125 Ų | 125 | 124.6 Ų | 124.6 | 77% | 0.767 | 71% | 0.712 | S | S | * | * | P | Polyproline II helix | trans | -58.6 | 116.1 | 167.1 | -52.1 | 0 | 0 | 0 | 0 | 106.9 | F72 | F72-T74 PolarHBondContact O-N 3.47Š|
| 75 | P | 69.7 | Low | 60.7 | Low | 62 Ų | 62 | 122.8 Ų | 122.8 | 40% | 0.403 | 71% | 0.713 | S | S | . | * | P | Polyproline II helix | trans | -61.6 | 142.6 | -178.5 | 26.6 | -33.5 | 0 | 0 | 0 | 108 | V73 F79 | V73-P75 VanDerWaalsContact O-CD 3.28Å; V73-P75 WeakPolarHBondContact O-CD 3.46Å; V73-P75 VanDerWaalsContact O-N 3.08Å; P75-F79 HydrophobicContact CB-CB 3.83Å; P75-F79 HydrophobicContact CB-CD2 4.5Å; P75-F79 HydrophobicContact CB-CG 4.13Å; P75-F79 HydrophobicContact CG-CB 4.36Å |
| 76 | P | 73.7 | Confident | 60.6 | Low | 79 Ų | 79 | 126.3 Ų | 126.3 | 51% | 0.513 | 72% | 0.724 | S | S | . | * | P | Polyproline II helix | trans | -47.6 | 146.4 | 179.8 | -29.2 | 35.7 | 0 | 0 | 0 | 111.2 | C78 F79 | P76-C78 WeakPolarHBondContact CB-SG 3.04Å; P76-C78 PolarHBondContact O-N 2.93Å; P76-F79 WeakPolarHBondContact O-CB 3.4Å; P76-F79 PolarHBondContact O-N 2.93Å |
| 77 | A | 63 | Low | 60.9 | Low | 79 Ų | 79 | 122.5 Ų | 122.5 | 65% | 0.653 | 72% | 0.718 | S | S | * | * | G | 310 helix | trans | -55.2 | -16.4 | -176.7 | 0 | 0 | 0 | 0 | 0 | 114.5 | F79 T80 A81 | A77-F79 PolarHBondContact O-N 3.33Å; A77-T80 PolarHBondContact O-N 2.8Å; A77-A81 WeakPolarHBondContact O-CB 3.43Å; A77-A81 PolarHBondContact O-N 2.82Å |
| 78 | C | 58.3 | Low | 61 | Low | 112 Ų | 112 | 121.1 Ų | 121.1 | 76% | 0.757 | 72% | 0.721 | S | S | * | * | G | 310 helix | trans | -68.4 | -9.8 | 169.1 | 27.1 | 0 | 0 | 0 | 0 | 115 | P76 | P76-C78 WeakPolarHBondContact CB-SG 3.04Å; P76-C78 PolarHBondContact O-N 2.93Å |
| 79 | F | 60.8 | Low | 60.6 | Low | 170 Ų | 170 | 118 Ų | 118 | 75% | 0.746 | 71% | 0.713 | S | S | * | * | G | 310 helix | trans | -94.8 | -20.4 | 173.5 | -95.3 | -93.8 | 0 | 0 | 0 | 113.6 | P75 P76 A77 | P75-F79 HydrophobicContact CB-CB 3.83Å; P75-F79 HydrophobicContact CB-CD2 4.5Å; P75-F79 HydrophobicContact CB-CG 4.13Å; P75-F79 HydrophobicContact CG-CB 4.36Å; P76-F79 WeakPolarHBondContact O-CB 3.4Å; P76-F79 PolarHBondContact O-N 2.93Å; A77-F79 PolarHBondContact O-N 3.33Å |
| 80 | T | 55.6 | Low | 60.5 | Low | 107 Ų | 107 | 121.8 Ų | 121.8 | 66% | 0.656 | 72% | 0.721 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -113.4 | 1.5 | -176.6 | 54.2 | 0 | 0 | 0 | 0 | 114 | A77 E82 | A77-T80 PolarHBondContact O-N 2.8Å; T80-E82 PolarHBondContact O-N 3.4Å |
| 81 | A | 55.1 | Low | 60.2 | Low | 76 Ų | 76 | 124.2 Ų | 124.2 | 63% | 0.628 | 72% | 0.724 | S | S | * | * | trans | -82.8 | 75.7 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | A77 G83 | A77-A81 WeakPolarHBondContact O-CB 3.43Å; A77-A81 PolarHBondContact O-N 2.82Å; A81-G83 PolarHBondContact O-N 3.12Å | ||
| 82 | E | 56.6 | Low | 60.3 | Low | 200 Ų | 200 | 122.4 Ų | 122.4 | 94% | 0.935 | 72% | 0.724 | S | S | * | * | trans | -74.2 | 76.8 | 146.1 | -156.1 | -177.9 | -157.9 | 0 | 0 | 106.9 | T80 | T80-E82 PolarHBondContact O-N 3.4Š| ||
| 83 | G | 51.8 | Low | 60.4 | Low | 56 Ų | 56 | 118.1 Ų | 118.1 | 58% | 0.577 | 72% | 0.716 | S | S | * | * | trans | -97.5 | 121.7 | 179.9 | 0 | 0 | 0 | 0 | 0 | 110.4 | A81 G85 | A81-G83 PolarHBondContact O-N 3.12Å; G83-G85 PolarHBondContact O-N 3.1Å | ||
| 84 | P | 55.4 | Low | 60.3 | Low | 140 Ų | 140 | 114.9 Ų | 114.9 | 91% | 0.909 | 70% | 0.699 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -64.3 | 118.8 | 176.2 | -18 | 30 | 0 | 0 | 0 | 110.6 | ||
| 85 | G | 56.5 | Low | 60.1 | Low | 73 Ų | 73 | 114.2 Ų | 114.2 | 75% | 0.753 | 70% | 0.697 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 139.7 | 1.9 | 158.6 | 0 | 0 | 0 | 0 | 0 | 119.5 | G83 | G83-G85 PolarHBondContact O-N 3.1Š|
| 86 | L | 53 | Low | 59.7 | Low | 160 Ų | 160 | 116.9 Ų | 116.9 | 84% | 0.838 | 71% | 0.707 | S | S | * | * | trans | -107.3 | 95 | 166.1 | -98.6 | 73.9 | 0 | 0 | 0 | 109.5 | ||||
| 87 | G | 59.7 | Low | 59.4 | Low | 55 Ų | 55 | 116.6 Ų | 116.6 | 57% | 0.567 | 70% | 0.699 | S | S | * | * | trans | -54.3 | 171.3 | 160.1 | 0 | 0 | 0 | 0 | 0 | 110.8 | A89 | G87-A89 VanDerWaalsContact C-N 3.26Å; G87-A89 PolarHBondContact O-N 2.82Å | ||
| 88 | P | 53.1 | Low | 59.7 | Low | 141 Ų | 141 | 119.2 Ų | 119.2 | 92% | 0.916 | 70% | 0.702 | S | S | * | * | trans | -57 | 89.6 | -165.3 | 25.1 | -34.1 | 0 | 0 | 0 | 110.5 | R90 | P88-R90 PolarHBondContact O-N 3.31Å; P88-R90 VanDerWaalsContact O-N 3.09Å | ||
| 89 | A | 52.3 | Low | 60.4 | Low | 60 Ų | 60 | 119.9 Ų | 119.9 | 50% | 0.496 | 70% | 0.697 | S | S | . | * | trans | -61.1 | 120.1 | 173.6 | 0 | 0 | 0 | 0 | 0 | 103.2 | G87 L91 | G87-A89 VanDerWaalsContact C-N 3.26Å; G87-A89 PolarHBondContact O-N 2.82Å; A89-L91 PolarHBondContact O-N 3.44Å | ||
| 90 | R | 57.4 | Low | 61 | Low | 233 Ų | 233 | 118.4 Ų | 118.4 | 88% | 0.879 | 70% | 0.696 | S | S | * | * | trans | -43.7 | 99.2 | 169.7 | -79.6 | 165.3 | 57.9 | -166.9 | -1.1 | 106.7 | P88 Q92 | P88-R90 PolarHBondContact O-N 3.31Å; P88-R90 VanDerWaalsContact O-N 3.09Å; R90-Q92 PolarHBondContact O-N 2.79Å | ||
| 91 | L | 61.5 | Low | 61.6 | Low | 169 Ų | 169 | 119.9 Ų | 119.9 | 89% | 0.885 | 70% | 0.699 | S | S | * | * | trans | -63.4 | 99.4 | 176.5 | -72.8 | 169.7 | 0 | 0 | 0 | 103.1 | A89 S93 | A89-L91 PolarHBondContact O-N 3.44Å; L91-S93 PolarHBondContact O-N 3.28Å; L91-S93 VanDerWaalsContact O-N 3.14Å | ||
| 92 | Q | 65.8 | Low | 62.4 | Low | 174 Ų | 174 | 124.2 Ų | 124.2 | 81% | 0.813 | 71% | 0.706 | S | S | * | * | P | Polyproline II helix | trans | -57.6 | 125.6 | 173.8 | -71.3 | -165.1 | 13.5 | 0 | 0 | 105.3 | R90 S94 | R90-Q92 PolarHBondContact O-N 2.79Å; Q92-S94 PolarHBondContact O-N 3.46Å |
| 93 | S | 63.5 | Low | 62.7 | Low | 87 Ų | 87 | 120 Ų | 120 | 61% | 0.608 | 69% | 0.686 | S | S | * | * | P | Polyproline II helix | trans | -58.8 | 117.6 | -175.2 | 83.8 | 0 | 0 | 0 | 0 | 106 | L91 E97 | L91-S93 PolarHBondContact O-N 3.28Å; L91-S93 VanDerWaalsContact O-N 3.14Å; S93-E97 VanDerWaalsContact CA-CD 3.47Å; S93-E97 VanDerWaalsContact CA-OE1 3.23Å; S93-E97 WeakPolarHBondContact CA-OE1 3.3Å; S93-E97 WeakPolarHBondContact CA-OE2 3.31Å; S93-E97 WeakPolarHBondContact CB-OE1 3.29Å; S93-E97 WeakPolarHBondContact CB-OE2 3.38Å; S93-E97 PolarHBondContact OG-OE1 3Å |
| 94 | S | 70.8 | Confident | 63.4 | Low | 54 Ų | 54 | 123.4 Ų | 123.4 | 38% | 0.378 | 70% | 0.698 | S | S | . | * | P | Polyproline II helix | trans | -77.2 | 135.8 | -167.6 | 170.7 | 0 | 0 | 0 | 0 | 107.5 | Q92 L96 E97 | Q92-S94 PolarHBondContact O-N 3.46Å; S94-L96 PolarHBondContact O-N 3.07Å; S94-E97 VanDerWaalsContact N-CD 3.3Å; S94-E97 PolarHBondContact N-OE1 2.9Å; S94-E97 PolarHBondContact N-OE2 3.44Å; S94-E97 VanDerWaalsContact O-CB 3.25Å; S94-E97 WeakPolarHBondContact O-CB 3.42Å; S94-E97 WeakPolarHBondContact O-CG 3.46Å; S94-E97 PolarHBondContact O-N 3.09Å |
| 95 | P | 68.5 | Low | 63.5 | Low | 111 Ų | 111 | 122.1 Ų | 122.1 | 72% | 0.721 | 69% | 0.693 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -59.6 | -6.6 | 179 | 22.7 | -32.3 | 0 | 0 | 0 | 114.6 | ||
| 96 | L | 62.3 | Low | 63.7 | Low | 118 Ų | 118 | 124.4 Ų | 124.4 | 62% | 0.618 | 69% | 0.685 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81.9 | -14.8 | 170.1 | -63 | 175.3 | 0 | 0 | 0 | 113.8 | S94 D98 L99 | S94-L96 PolarHBondContact O-N 3.07Å; L96-D98 VanDerWaalsContact C-N 3.3Å; L96-L99 HydrophobicContact CD2-CD1 3.75Å; L96-L99 WeakPolarHBondContact O-CB 3.3Å; L96-L99 PolarHBondContact O-N 2.96Å |
| 97 | E | 66.9 | Low | 63.8 | Low | 74 Ų | 74 | 121.3 Ų | 121.3 | 35% | 0.346 | 68% | 0.676 | S | S | . | * | G | 310 helix | trans | -69.6 | -29 | 176.4 | 78.2 | -154 | 164.6 | 0 | 0 | 112 | S93 S94 L99 L100 | S93-E97 VanDerWaalsContact CA-CD 3.47Å; S93-E97 VanDerWaalsContact CA-OE1 3.23Å; S93-E97 WeakPolarHBondContact CA-OE1 3.3Å; S93-E97 WeakPolarHBondContact CA-OE2 3.31Å; S93-E97 WeakPolarHBondContact CB-OE1 3.29Å; S93-E97 WeakPolarHBondContact CB-OE2 3.38Å; S93-E97 PolarHBondContact OG-OE1 3Å; S94-E97 VanDerWaalsContact N-CD 3.3Å; S94-E97 PolarHBondContact N-OE1 2.9Å; S94-E97 PolarHBondContact N-OE2 3.44Å; S94-E97 VanDerWaalsContact O-CB 3.25Å; S94-E97 WeakPolarHBondContact O-CB 3.42Å; S94-E97 WeakPolarHBondContact O-CG 3.46Å; S94-E97 PolarHBondContact O-N 3.09Å; E97-L99 PolarHBondContact O-N 3.25Å; E97-L100 WeakPolarHBondContact O-CB 3.32Å; E97-L100 WeakPolarHBondContact O-CG 3.46Å; E97-L100 PolarHBondContact O-N 3.09Å |
| 98 | D | 68.8 | Low | 63.6 | Low | 133 Ų | 133 | 123.8 Ų | 123.8 | 71% | 0.711 | 68% | 0.68 | S | S | * | * | G | 310 helix | trans | -71.9 | -11.7 | 175.3 | -80.3 | -12.3 | 0 | 0 | 0 | 112.7 | L96 | L96-D98 VanDerWaalsContact C-N 3.3Š|
| 99 | L | 73.4 | Confident | 63.3 | Low | 126 Ų | 126 | 126.5 Ų | 126.5 | 66% | 0.66 | 67% | 0.674 | S | S | * | * | G | 310 helix | trans | -79.7 | -11.6 | 169.3 | -55 | 178.9 | 0 | 0 | 0 | 111.8 | L96 E97 I101 | L96-L99 HydrophobicContact CD2-CD1 3.75Å; L96-L99 WeakPolarHBondContact O-CB 3.3Å; L96-L99 PolarHBondContact O-N 2.96Å; E97-L99 PolarHBondContact O-N 3.25Å; L99-I101 VanDerWaalsContact C-N 3.27Å; L99-I101 PolarHBondContact O-N 3.33Å |
| 100 | L | 72.6 | Confident | 63.3 | Low | 140 Ų | 140 | 129.7 Ų | 129.7 | 73% | 0.733 | 69% | 0.687 | S | S | * | * | S | Bend | trans | -78.5 | 83.1 | 170.9 | -55.1 | 174.1 | 0 | 0 | 0 | 108.1 | E97 E102 | E97-L100 WeakPolarHBondContact O-CB 3.32Å; E97-L100 WeakPolarHBondContact O-CG 3.46Å; E97-L100 PolarHBondContact O-N 3.09Å; L100-E102 PolarHBondContact O-N 3.08Å |
| 101 | I | 68.2 | Low | 62.9 | Low | 137 Ų | 137 | 124.7 Ų | 124.7 | 70% | 0.703 | 68% | 0.682 | S | S | * | * | trans | -60.5 | 108.5 | 171 | 43.4 | 165.6 | 0 | 0 | 0 | 109.5 | L99 H103 | L99-I101 VanDerWaalsContact C-N 3.27Å; L99-I101 PolarHBondContact O-N 3.33Å; I101-H103 PolarHBondContact O-N 3.41Å | ||
| 102 | E | 72 | Confident | 62.2 | Low | 168 Ų | 168 | 118.9 Ų | 118.9 | 79% | 0.785 | 66% | 0.664 | S | S | * | * | trans | -56.9 | 103.3 | 171.9 | -172.1 | -175.8 | 170 | 0 | 0 | 108.6 | L100 | L100-E102 PolarHBondContact O-N 3.08Š| ||
| 103 | H | 63.6 | Low | 61.6 | Low | 111 Ų | 111 | 116.7 Ų | 116.7 | 51% | 0.514 | 67% | 0.667 | S | S | . | * | trans | -72.7 | 137.4 | 172.4 | -125 | -105.7 | 0 | 0 | 0 | 107.5 | I101 S105 M106 | I101-H103 PolarHBondContact O-N 3.41Å; H103-S105 PolarHBondContact O-N 3.12Å; H103-M106 PolarHBondContact O-N 3.19Å | ||
| 104 | P | 66.3 | Low | 60.6 | Low | 128 Ų | 128 | 117.7 Ų | 117.7 | 83% | 0.831 | 67% | 0.67 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62.5 | -6.5 | -177.1 | 24.1 | -34.6 | 0 | 0 | 0 | 114.7 | ||
| 105 | S | 58.7 | Low | 59.8 | Low | 113 Ų | 113 | 123.4 Ų | 123.4 | 79% | 0.79 | 69% | 0.694 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -94.6 | -4.6 | 172.7 | -46.3 | 0 | 0 | 0 | 0 | 113.6 | H103 | H103-S105 PolarHBondContact O-N 3.12Š|
| 106 | M | 60.6 | Low | 58.6 | Low | 121 Ų | 121 | 123 Ų | 123 | 60% | 0.596 | 69% | 0.69 | S | S | * | * | trans | -110.8 | 66.2 | -173.1 | -161.4 | 118.6 | 67.8 | 0 | 0 | 110.8 | H103 V108 | H103-M106 PolarHBondContact O-N 3.19Å; M106-V108 VanDerWaalsContact C-N 3.27Å; M106-V108 HydrophobicContact CG-CG2 3.94Å; M106-V108 PolarHBondContact O-N 3.48Å | ||
| 107 | S | 55.1 | Low | 58.2 | Low | 94 Ų | 94 | 125.7 Ų | 125.7 | 66% | 0.657 | 70% | 0.704 | S | S | * | * | trans | -73.1 | 86.7 | 163.8 | 57.1 | 0 | 0 | 0 | 0 | 108.9 | Y109 | S107-Y109 PolarHBondContact O-N 3.06Š| ||
| 108 | V | 54.6 | Low | 57.1 | Low | 107 Ų | 107 | 128.8 Ų | 128.8 | 65% | 0.648 | 72% | 0.718 | S | S | * | * | trans | -81.1 | 103.8 | 159.9 | 179.2 | 0 | 0 | 0 | 0 | 105.8 | M106 V110 | M106-V108 VanDerWaalsContact C-N 3.27Å; M106-V108 HydrophobicContact CG-CG2 3.94Å; M106-V108 PolarHBondContact O-N 3.48Å; V108-V110 VanDerWaalsContact C-N 3.34Å; V108-V110 PolarHBondContact O-N 3.11Å | ||
| 109 | Y | 46.9 | Very low | 56.5 | Low | 198 Ų | 198 | 128.4 Ų | 128.4 | 78% | 0.776 | 72% | 0.723 | S | S | * | * | trans | -60.4 | 106.8 | 158.3 | -67.6 | -83.4 | 0 | 0 | 0 | 106.4 | S107 T111 | S107-Y109 PolarHBondContact O-N 3.06Å; Y109-T111 PolarHBondContact O-N 2.64Å | ||
| 110 | V | 52.3 | Low | 54.6 | Low | 128 Ų | 128 | 124.8 Ų | 124.8 | 78% | 0.776 | 72% | 0.716 | S | S | * | * | trans | -67.8 | 81 | 154.9 | 179.3 | 0 | 0 | 0 | 0 | 105.2 | V108 G112 | V108-V110 VanDerWaalsContact C-N 3.34Å; V108-V110 PolarHBondContact O-N 3.11Å; V110-G112 PolarHBondContact O-N 3.44Å | ||
| 111 | T | 48.6 | Very low | 53.4 | Low | 127 Ų | 127 | 124 Ų | 124 | 78% | 0.779 | 72% | 0.72 | S | S | * | * | trans | -65.5 | 95.8 | 157.1 | -59.1 | 0 | 0 | 0 | 0 | 104.1 | Y109 S113 | Y109-T111 PolarHBondContact O-N 2.64Å; T111-S113 PolarHBondContact O-N 3.34Å | ||
| 112 | G | 47.5 | Very low | 52.3 | Low | 48 Ų | 48 | 123.5 Ų | 123.5 | 50% | 0.495 | 73% | 0.725 | S | S | . | * | trans | -46.8 | 139 | -173.3 | 0 | 0 | 0 | 0 | 0 | 111.5 | V110 T114 | V110-G112 PolarHBondContact O-N 3.44Å; G112-T114 VanDerWaalsContact C-N 3.33Å; G112-T114 PolarHBondContact O-N 2.9Å | ||
| 113 | S | 52 | Low | 50.9 | Low | 127 Ų | 127 | 121 Ų | 121 | 89% | 0.888 | 73% | 0.726 | S | S | * | * | S | Bend | trans | -48.4 | 95.4 | 170.6 | -64.6 | 0 | 0 | 0 | 0 | 111 | T111 | T111-S113 PolarHBondContact O-N 3.34Š|
| 114 | T | 42.4 | Very low | 50 | Low | 109 Ų | 109 | 121.6 Ų | 121.6 | 67% | 0.669 | 74% | 0.74 | S | S | * | * | trans | -160.9 | 83.4 | 159 | -80.2 | 0 | 0 | 0 | 0 | 106.1 | G112 V116 | G112-T114 VanDerWaalsContact C-N 3.33Å; G112-T114 PolarHBondContact O-N 2.9Å; T114-V116 HydrophobicContact CG2-CB 3.44Å; T114-V116 VanDerWaalsContact CG2-CB 3.44Å; T114-V116 HydrophobicContact CG2-CG2 3.28Å; T114-V116 PolarHBondContact O-N 3.36Å | ||
| 115 | I | 55.3 | Low | 49.1 | Very low | 173 Ų | 173 | 121.7 Ų | 121.7 | 89% | 0.887 | 73% | 0.733 | S | S | * | * | trans | -69.7 | 74.3 | 149.2 | 36.2 | 167.1 | 0 | 0 | 0 | 106.7 | L117 | I115-L117 PolarHBondContact O-N 3.42Š| ||
| 116 | V | 42.6 | Very low | 48.6 | Very low | 102 Ų | 102 | 122 Ų | 122 | 62% | 0.618 | 73% | 0.732 | S | S | * | * | trans | -81.4 | 98.2 | 159.2 | 153.9 | 0 | 0 | 0 | 0 | 104.9 | T114 E118 | T114-V116 HydrophobicContact CG2-CB 3.44Å; T114-V116 VanDerWaalsContact CG2-CB 3.44Å; T114-V116 HydrophobicContact CG2-CG2 3.28Å; T114-V116 PolarHBondContact O-N 3.36Å; V116-E118 VanDerWaalsContact C-N 3.26Å; V116-E118 HydrophobicContact CG1-CB 3.53Å; V116-E118 HydrophobicContact CG1-CG 4.24Å; V116-E118 PolarHBondContact O-N 2.84Å | ||
| 117 | L | 53.7 | Low | 47.7 | Very low | 176 Ų | 176 | 122.9 Ų | 122.9 | 92% | 0.921 | 74% | 0.739 | S | S | * | * | trans | -56.8 | 96.9 | 150.1 | -80.6 | 148.8 | 0 | 0 | 0 | 106.4 | I115 | I115-L117 PolarHBondContact O-N 3.42Š| ||
| 118 | E | 44.2 | Very low | 47 | Very low | 139 Ų | 139 | 123.2 Ų | 123.2 | 65% | 0.65 | 75% | 0.747 | S | S | * | * | trans | -126.8 | 123.2 | 167.4 | -145.4 | -76.9 | 135.1 | 0 | 0 | 107.9 | V116 G120 | V116-E118 VanDerWaalsContact C-N 3.26Å; V116-E118 HydrophobicContact CG1-CB 3.53Å; V116-E118 HydrophobicContact CG1-CG 4.24Å; V116-E118 PolarHBondContact O-N 2.84Å; E118-G120 PolarHBondContact O-N 3.13Å | ||
| 119 | P | 55.1 | Low | 46.5 | Very low | 125 Ų | 125 | 122.4 Ų | 122.4 | 81% | 0.812 | 75% | 0.752 | S | S | * | * | trans | -81.8 | 92.5 | 176.3 | 32.6 | -29 | 0 | 0 | 0 | 109.4 | ||||
| 120 | G | 35.4 | Very low | 46.5 | Very low | 49 Ų | 49 | 120.4 Ų | 120.4 | 51% | 0.505 | 75% | 0.754 | S | S | . | * | trans | -118.3 | 145.2 | 176.9 | 0 | 0 | 0 | 0 | 0 | 113.1 | E118 | E118-G120 PolarHBondContact O-N 3.13Š| ||
| 121 | P | 46.6 | Very low | 46.4 | Very low | 125 Ų | 125 | 120.5 Ų | 120.5 | 81% | 0.812 | 76% | 0.757 | S | S | * | * | P | Polyproline II helix | trans | -76.9 | 161.5 | -142.6 | 28.6 | -31.9 | 0 | 0 | 0 | 116.6 | S123 | P121-S123 PolarHBondContact O-N 3.48Š|
| 122 | P | 44.3 | Very low | 46.1 | Very low | 125 Ų | 125 | 122.1 Ų | 122.1 | 81% | 0.812 | 76% | 0.761 | S | S | * | * | P | Polyproline II helix | trans | -68.8 | 128.5 | -168.2 | 27.4 | -34.9 | 0 | 0 | 0 | 113.2 | ||
| 123 | S | 44.1 | Very low | 45.7 | Very low | 116 Ų | 116 | 123.8 Ų | 123.8 | 81% | 0.811 | 78% | 0.778 | S | S | * | * | P | Polyproline II helix | trans | -58.4 | 135.4 | 163.9 | -85.7 | 0 | 0 | 0 | 0 | 110.8 | P121 L125 | P121-S123 PolarHBondContact O-N 3.48Å; S123-L125 PolarHBondContact O-N 3Å |
| 124 | P | 43.1 | Very low | 44.8 | Very low | 124 Ų | 124 | 124.6 Ų | 124.6 | 81% | 0.805 | 77% | 0.773 | S | S | * | * | P | Polyproline II helix | trans | -75.4 | 116.3 | 176.2 | 28.2 | -30 | 0 | 0 | 0 | 110.8 | ||
| 125 | L | 47.9 | Very low | 44.8 | Very low | 129 Ų | 129 | 126.7 Ų | 126.7 | 68% | 0.675 | 78% | 0.779 | S | S | * | * | P | Polyproline II helix | trans | -58 | 138.7 | 159.9 | -166 | 82.6 | 0 | 0 | 0 | 109.9 | S123 D127 | S123-L125 PolarHBondContact O-N 3Å; L125-D127 HydrophobicContact CD2-CB 3.87Å; L125-D127 VanDerWaalsContact CD2-CG 3.42Å; L125-D127 WeakPolarHBondContact CD2-OD2 3.34Å |
| 126 | P | 49 | Very low | 43.9 | Very low | 121 Ų | 121 | 124.4 Ų | 124.4 | 79% | 0.786 | 78% | 0.778 | S | S | * | * | trans | -99.1 | 86.4 | 155.4 | 33.3 | -22.5 | 0 | 0 | 0 | 108.5 | ||||
| 127 | D | 41.3 | Very low | 43.6 | Very low | 139 Ų | 139 | 128.9 Ų | 128.9 | 74% | 0.743 | 79% | 0.792 | S | S | * | * | trans | -84.7 | 110.4 | 149.6 | -90.7 | -17.6 | 0 | 0 | 0 | 106.4 | L125 | L125-D127 HydrophobicContact CD2-CB 3.87Å; L125-D127 VanDerWaalsContact CD2-CG 3.42Å; L125-D127 WeakPolarHBondContact CD2-OD2 3.34Å | ||
| 128 | A | 40.7 | Very low | 42.8 | Very low | 100 Ų | 100 | 124 Ų | 124 | 83% | 0.826 | 79% | 0.785 | S | S | * | * | trans | -148.3 | 109.8 | 164.9 | 0 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 129 | A | 42.4 | Very low | 42.3 | Very low | 90 Ų | 90 | 125.6 Ų | 125.6 | 74% | 0.744 | 79% | 0.792 | S | S | * | * | trans | -32.4 | 144.8 | 167.3 | 0 | 0 | 0 | 0 | 0 | 117.7 | ||||
| 130 | L | 47.4 | Very low | 41.6 | Very low | 157 Ų | 157 | 126.4 Ų | 126.4 | 82% | 0.822 | 79% | 0.789 | S | S | * | * | trans | 41.5 | 131.5 | 139.4 | -55 | 174.6 | 0 | 0 | 0 | 120.2 | ||||
| 131 | P | 49.7 | Very low | 41.8 | Very low | 130 Ų | 130 | 128.3 Ų | 128.3 | 84% | 0.844 | 80% | 0.8 | S | S | * | * | trans | -103.6 | 106.7 | 156.7 | 33.9 | -20.1 | 0 | 0 | 0 | 110.7 | ||||
| 132 | D | 43.5 | Very low | 41.9 | Very low | 161 Ų | 161 | 128.5 Ų | 128.5 | 86% | 0.861 | 80% | 0.801 | S | S | * | * | trans | -114.7 | 124.5 | 150.9 | -85.6 | -41.3 | 0 | 0 | 0 | 106.3 | ||||
| 133 | G | 38.4 | Very low | 41.7 | Very low | 83 Ų | 83 | 127.8 Ų | 127.8 | 86% | 0.856 | 81% | 0.806 | S | S | * | * | trans | 165.5 | 88.1 | 179.2 | 0 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 134 | D | 34.5 | Very low | 41.4 | Very low | 143 Ų | 143 | 126.1 Ų | 126.1 | 77% | 0.765 | 81% | 0.807 | S | S | * | * | trans | -68.2 | 150.8 | 177.2 | -161.7 | 19.4 | 0 | 0 | 0 | 113.6 | ||||
| 135 | L | 41.5 | Very low | 41.8 | Very low | 153 Ų | 153 | 132 Ų | 132 | 80% | 0.801 | 81% | 0.813 | S | S | * | * | trans | 13.9 | 132.8 | 160.6 | -60.2 | 160 | 0 | 0 | 0 | 121.1 | ||||
| 136 | S | 37.4 | Very low | 41.7 | Very low | 125 Ų | 125 | 133 Ų | 133 | 87% | 0.874 | 81% | 0.814 | S | S | * | * | -179.1 | 143.8 | 117.7 | -167.9 | 0 | 0 | 0 | 0 | 114 | |||||
| 137 | E | 35.9 | Very low | 42 | Very low | 196 Ų | 196 | 131.4 Ų | 131.4 | 92% | 0.916 | 80% | 0.804 | S | S | * | * | trans | -62.9 | 152.5 | -178.1 | -162.3 | 171.6 | 129.8 | 0 | 0 | 115.4 | ||||
| 138 | G | 36.9 | Very low | 42.2 | Very low | 74 Ų | 74 | 135.1 Ų | 135.1 | 76% | 0.763 | 81% | 0.807 | S | S | * | * | trans | 177.2 | 73.5 | 176.9 | 0 | 0 | 0 | 0 | 0 | 116.8 | ||||
| 139 | E | 34 | Very low | 42.7 | Very low | 173 Ų | 173 | 134.5 Ų | 134.5 | 81% | 0.808 | 80% | 0.802 | S | S | * | * | trans | 16.9 | 137 | 145.2 | -137 | -173 | 140.1 | 0 | 0 | 123.8 | ||||
| 140 | L | 40 | Very low | 43 | Very low | 142 Ų | 142 | 134.1 Ų | 134.1 | 74% | 0.743 | 80% | 0.799 | S | S | * | * | trans | 98.5 | 106.1 | 139.1 | -130.2 | 105.5 | 0 | 0 | 0 | 122.5 | ||||
| 141 | A | 38.6 | Very low | 43.3 | Very low | 88 Ų | 88 | 136.6 Ų | 136.6 | 73% | 0.727 | 80% | 0.797 | S | S | * | * | trans | 94.9 | 139.9 | 137.2 | 0 | 0 | 0 | 0 | 0 | 121.8 | ||||
| 142 | P | 50.1 | Low | 43.5 | Very low | 129 Ų | 129 | 139.4 Ų | 139.4 | 84% | 0.838 | 80% | 0.799 | S | S | * | * | trans | -100.3 | 128 | -174.7 | 37 | -26.2 | 0 | 0 | 0 | 112.1 | ||||
| 143 | A | 39.5 | Very low | 44.2 | Very low | 110 Ų | 110 | 136.9 Ų | 136.9 | 91% | 0.909 | 79% | 0.789 | S | S | * | * | trans | -153.5 | 117.5 | 167.6 | 0 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 144 | G | 37.7 | Very low | 45.3 | Very low | 81 Ų | 81 | 134 Ų | 134 | 84% | 0.835 | 76% | 0.757 | S | S | * | * | trans | 149.3 | 65.9 | 171.4 | 0 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 145 | R | 51.8 | Low | 46.6 | Very low | 247 Ų | 247 | 131 Ų | 131 | 93% | 0.932 | 75% | 0.746 | S | S | * | * | trans | -72 | 120.7 | 154.4 | -78.3 | -178.5 | 165.3 | 152.6 | -2.7 | 107.4 | ||||
| 146 | E | 46.3 | Very low | 47.6 | Very low | 152 Ų | 152 | 130 Ų | 130 | 71% | 0.71 | 74% | 0.741 | S | S | * | * | -157 | 138.8 | 116.1 | -105.7 | -74.5 | 109.6 | 0 | 0 | 110.4 | |||||
| 147 | P | 55 | Low | 48.9 | Very low | 86 Ų | 86 | 129 Ų | 129 | 56% | 0.558 | 73% | 0.731 | S | S | * | * | trans | -88.7 | 150.1 | -179.7 | 36.4 | -25.1 | 0 | 0 | 0 | 110.2 | ||||
| 148 | R | 45.7 | Very low | 50.3 | Low | 218 Ų | 218 | 122 Ų | 122 | 82% | 0.823 | 71% | 0.707 | S | S | * | * | trans | 167.6 | 79.3 | 134.7 | -89.6 | 154.5 | -176.4 | 156.4 | 1.9 | 107 | A150 | R148-A150 PolarHBondContact O-N 3.46Š| ||
| 149 | A | 49.4 | Very low | 51.7 | Low | 86 Ų | 86 | 125.9 Ų | 125.9 | 71% | 0.711 | 70% | 0.698 | S | S | * | * | trans | -59.4 | 90.8 | 142.8 | 0 | 0 | 0 | 0 | 0 | 106.3 | R151 | A149-R151 HydrophobicContact CB-CG 4.27Å; A149-R151 PolarHBondContact O-N 3Å | ||
| 150 | A | 48.9 | Very low | 53.5 | Low | 83 Ų | 83 | 120 Ų | 120 | 69% | 0.686 | 68% | 0.68 | S | S | * | * | trans | -67.7 | 72.3 | 161.1 | 0 | 0 | 0 | 0 | 0 | 106.6 | R148 H152 | R148-A150 PolarHBondContact O-N 3.46Å; A150-H152 VanDerWaalsContact C-N 3.34Å; A150-H152 PolarHBondContact O-N 3.22Å | ||
| 151 | R | 54 | Low | 55.1 | Low | 208 Ų | 208 | 115.9 Ų | 115.9 | 79% | 0.785 | 67% | 0.666 | S | S | * | * | trans | -57 | 107.6 | 159.6 | -67.5 | 179.1 | 176.3 | 172.2 | -1.2 | 103.9 | A149 V153 | A149-R151 HydrophobicContact CB-CG 4.27Å; A149-R151 PolarHBondContact O-N 3Å; R151-V153 HydrophobicContact CB-CG2 3.94Å; R151-V153 PolarHBondContact O-N 3.25Å | ||
| 152 | H | 53.5 | Low | 56.8 | Low | 189 Ų | 189 | 117.6 Ų | 117.6 | 88% | 0.875 | 66% | 0.662 | S | S | * | * | trans | -61 | 84 | 154.3 | -74.9 | -77 | 0 | 0 | 0 | 105.9 | A150 A154 | A150-H152 VanDerWaalsContact C-N 3.34Å; A150-H152 PolarHBondContact O-N 3.22Å; H152-A154 PolarHBondContact O-N 2.9Å | ||
| 153 | V | 60.1 | Low | 58 | Low | 109 Ų | 109 | 117.6 Ų | 117.6 | 66% | 0.661 | 65% | 0.654 | S | S | * | * | trans | -67.2 | 84.3 | 164.3 | -179.9 | 0 | 0 | 0 | 0 | 103.9 | R151 | R151-V153 HydrophobicContact CB-CG2 3.94Å; R151-V153 PolarHBondContact O-N 3.25Å | ||
| 154 | A | 60.5 | Low | 59.9 | Low | 22 Ų | 22 | 117.5 Ų | 117.5 | 18% | 0.182 | 64% | 0.635 | C | S | . | * | trans | -51.5 | 141.6 | 164.2 | 0 | 0 | 0 | 0 | 0 | 107.4 | H152 L156 | H152-A154 PolarHBondContact O-N 2.9Å; A154-L156 VanDerWaalsContact C-N 3.28Å; A154-L156 PolarHBondContact O-N 3.01Å | ||
| 155 | P | 61.7 | Low | 61.9 | Low | 81 Ų | 81 | 119.9 Ų | 119.9 | 53% | 0.526 | 62% | 0.622 | S | S | . | * | trans | -64.3 | 93.8 | -177.8 | 25 | -31.7 | 0 | 0 | 0 | 108.8 | A158 R159 | P155-A158 HydrophobicContact CB-CB 4.08Å; P155-A158 HydrophobicContact CG-CB 4.09Å; P155-A158 PolarHBondContact O-N 3.38Å; P155-A158 VanDerWaalsContact O-N 3.11Å; P155-R159 PolarHBondContact O-N 3.49Å | ||
| 156 | L | 63.6 | Low | 63.5 | Low | 132 Ų | 132 | 111 Ų | 111 | 69% | 0.691 | 60% | 0.601 | S | S | * | * | H | α-helix | trans | -47.9 | -40.5 | 173.5 | -67.6 | 172.5 | 0 | 0 | 0 | 112.1 | A154 A160 | A154-L156 VanDerWaalsContact C-N 3.28Å; A154-L156 PolarHBondContact O-N 3.01Å; L156-A160 VanDerWaalsContact O-CB 3.28Å; L156-A160 WeakPolarHBondContact O-CB 3.44Å; L156-A160 PolarHBondContact O-N 2.88Å |
| 157 | P | 64.4 | Low | 65.7 | Low | 102 Ų | 102 | 104.6 Ų | 104.6 | 66% | 0.662 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -69 | -35.6 | 178.7 | 24.8 | -34.5 | 0 | 0 | 0 | 113.9 | A160 A161 | P157-A160 PolarHBondContact O-N 3.25Å; P157-A161 WeakPolarHBondContact O-CB 3.47Å; P157-A161 PolarHBondContact O-N 2.94Å |
| 158 | A | 64.5 | Low | 67.4 | Low | 50 Ų | 50 | 104.7 Ų | 104.7 | 41% | 0.413 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -70.7 | -40.4 | -180 | 0 | 0 | 0 | 0 | 0 | 111.6 | P155 A161 L162 | P155-A158 HydrophobicContact CB-CB 4.08Å; P155-A158 HydrophobicContact CG-CB 4.09Å; P155-A158 PolarHBondContact O-N 3.38Å; P155-A158 VanDerWaalsContact O-N 3.11Å; A158-A161 PolarHBondContact O-N 3.5Å; A158-L162 WeakPolarHBondContact O-CG 3.24Å; A158-L162 PolarHBondContact O-N 3.41Å; A158-L162 VanDerWaalsContact O-N 3.09Å |
| 159 | R | 66.6 | Low | 69.7 | Low | 155 Ų | 155 | 98.9 Ų | 98.9 | 59% | 0.585 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -68 | -36.8 | 174.5 | -69.4 | -177.4 | 172.4 | 170.4 | -0.5 | 112 | P155 L162 L163 | P155-R159 PolarHBondContact O-N 3.49Å; R159-L162 PolarHBondContact O-N 3.06Å; R159-L163 WeakPolarHBondContact O-CG 3.49Å; R159-L163 PolarHBondContact O-N 3.4Å |
| 160 | A | 72.1 | Confident | 71.8 | Confident | 51 Ų | 51 | 101.8 Ų | 101.8 | 42% | 0.421 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -64 | -43.3 | 173.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | L156 P157 L162 L163 E164 | L156-A160 VanDerWaalsContact O-CB 3.28Å; L156-A160 WeakPolarHBondContact O-CB 3.44Å; L156-A160 PolarHBondContact O-N 2.88Å; P157-A160 PolarHBondContact O-N 3.25Å; A160-L162 PolarHBondContact O-N 2.9Å; A160-L163 PolarHBondContact O-N 3.35Å; A160-E164 WeakPolarHBondContact O-CB 3.38Å; A160-E164 PolarHBondContact O-N 2.89Å |
| 161 | A | 73.3 | Confident | 74 | Confident | 54 Ų | 54 | 104.6 Ų | 104.6 | 45% | 0.446 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -62.5 | -40.8 | 176 | 0 | 0 | 0 | 0 | 0 | 112.3 | P157 A158 E164 K165 | P157-A161 WeakPolarHBondContact O-CB 3.47Å; P157-A161 PolarHBondContact O-N 2.94Å; A158-A161 PolarHBondContact O-N 3.5Å; A161-E164 PolarHBondContact O-N 3.15Å; A161-K165 VanDerWaalsContact O-CG 3.27Å; A161-K165 WeakPolarHBondContact O-CG 3.41Å; A161-K165 PolarHBondContact O-N 3.15Å |
| 162 | L | 73.8 | Confident | 76 | Confident | 124 Ų | 124 | 100.9 Ų | 100.9 | 65% | 0.649 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -64.8 | -42.2 | 175.8 | -70.1 | 170.8 | 0 | 0 | 0 | 112.3 | A158 R159 A160 K165 A166 | A158-L162 WeakPolarHBondContact O-CG 3.24Å; A158-L162 PolarHBondContact O-N 3.41Å; A158-L162 VanDerWaalsContact O-N 3.09Å; R159-L162 PolarHBondContact O-N 3.06Å; A160-L162 PolarHBondContact O-N 2.9Å; L162-K165 PolarHBondContact O-N 3.12Å; L162-A166 PolarHBondContact O-N 2.95Å |
| 163 | L | 75.6 | Confident | 78 | Confident | 129 Ų | 129 | 98.2 Ų | 98.2 | 68% | 0.675 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -66.5 | -37.8 | 176.5 | -71.5 | 172.2 | 0 | 0 | 0 | 112.4 | R159 A160 A166 G167 | R159-L163 WeakPolarHBondContact O-CG 3.49Å; R159-L163 PolarHBondContact O-N 3.4Å; A160-L163 PolarHBondContact O-N 3.35Å; L163-A166 PolarHBondContact O-N 3.08Å; L163-G167 PolarHBondContact O-N 3.29Å |
| 164 | E | 79.3 | Confident | 79.6 | Confident | 108 Ų | 108 | 98.4 Ų | 98.4 | 51% | 0.505 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -62.1 | -43 | 172.9 | -85.6 | -59.8 | 138.2 | 0 | 0 | 111.9 | A160 A161 G167 Q168 R171 | A160-E164 WeakPolarHBondContact O-CB 3.38Å; A160-E164 PolarHBondContact O-N 2.89Å; A161-E164 PolarHBondContact O-N 3.15Å; E164-G167 PolarHBondContact O-N 3.01Å; E164-Q168 VanDerWaalsContact O-CG 3.27Å; E164-Q168 WeakPolarHBondContact O-CG 3.49Å; E164-Q168 PolarHBondContact O-N 3.09Å; E164-R171 IonicContact OE2-NH2 3.82Å |
| 165 | K | 80.9 | Confident | 81.3 | Confident | 132 Ų | 132 | 99.9 Ų | 99.9 | 57% | 0.574 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -64.5 | -42.8 | 175.5 | -66.2 | -65.9 | 175.8 | -173.8 | 0 | 111.7 | A161 L162 G167 Q168 V169 | A161-K165 VanDerWaalsContact O-CG 3.27Å; A161-K165 WeakPolarHBondContact O-CG 3.41Å; A161-K165 PolarHBondContact O-N 3.15Å; L162-K165 PolarHBondContact O-N 3.12Å; K165-G167 VanDerWaalsContact C-N 3.31Å; K165-G167 PolarHBondContact O-N 2.97Å; K165-Q168 PolarHBondContact O-N 3.05Å; K165-V169 WeakPolarHBondContact O-CG2 3.47Å; K165-V169 PolarHBondContact O-N 2.92Å |
| 166 | A | 85.6 | Confident | 82.9 | Confident | 59 Ų | 59 | 104.2 Ų | 104.2 | 49% | 0.488 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -61.3 | -39.7 | 173.9 | 0 | 0 | 0 | 0 | 0 | 112 | L162 L163 V169 R170 | L162-A166 PolarHBondContact O-N 2.95Å; L163-A166 PolarHBondContact O-N 3.08Å; A166-V169 PolarHBondContact O-N 3.36Å; A166-R170 WeakPolarHBondContact O-CB 3.16Å; A166-R170 PolarHBondContact O-N 3.45Å |
| 167 | G | 91.9 | Very high | 84.4 | Confident | 19 Ų | 19 | 103.3 Ų | 103.3 | 20% | 0.196 | 53% | 0.526 | C | S | . | . | H | α-helix | trans | -64 | -41.2 | 174.7 | 0 | 0 | 0 | 0 | 0 | 113 | L163 E164 K165 R170 R171 | L163-G167 PolarHBondContact O-N 3.29Å; E164-G167 PolarHBondContact O-N 3.01Å; K165-G167 VanDerWaalsContact C-N 3.31Å; K165-G167 PolarHBondContact O-N 2.97Å; G167-R170 PolarHBondContact O-N 3.46Å; G167-R171 WeakPolarHBondContact O-CG 3.45Å; G167-R171 PolarHBondContact O-N 3.41Å |
| 168 | Q | 90.1 | Very high | 85.7 | Confident | 88 Ų | 88 | 105.4 Ų | 105.4 | 41% | 0.411 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -63.1 | -47.4 | 175.8 | -72.4 | 170 | 22.3 | 0 | 0 | 111.6 | E164 K165 R170 R171 L172 | E164-Q168 VanDerWaalsContact O-CG 3.27Å; E164-Q168 WeakPolarHBondContact O-CG 3.49Å; E164-Q168 PolarHBondContact O-N 3.09Å; K165-Q168 PolarHBondContact O-N 3.05Å; Q168-R170 PolarHBondContact O-N 3.45Å; Q168-R171 PolarHBondContact O-N 3.44Å; Q168-L172 PolarHBondContact O-N 3.32Å |
| 169 | V | 93.2 | Very high | 86.9 | Confident | 96 Ų | 96 | 105.7 Ų | 105.7 | 58% | 0.582 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -61 | -44.6 | 177.7 | 173.6 | 0 | 0 | 0 | 0 | 110.9 | K165 A166 R171 L172 Q173 | K165-V169 WeakPolarHBondContact O-CG2 3.47Å; K165-V169 PolarHBondContact O-N 2.92Å; A166-V169 PolarHBondContact O-N 3.36Å; V169-R171 VanDerWaalsContact C-N 3.34Å; V169-R171 PolarHBondContact O-N 2.94Å; V169-L172 PolarHBondContact O-N 2.86Å; V169-Q173 WeakPolarHBondContact O-CB 3.49Å; V169-Q173 PolarHBondContact O-N 3.43Å |
| 170 | R | 93.8 | Very high | 88 | Confident | 147 Ų | 147 | 102.5 Ų | 102.5 | 56% | 0.555 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -61.6 | -38.9 | 176.6 | -176.3 | 179.7 | 173.9 | -141.2 | 2.3 | 112.6 | A166 G167 Q168 R174 | A166-R170 WeakPolarHBondContact O-CB 3.16Å; A166-R170 PolarHBondContact O-N 3.45Å; G167-R170 PolarHBondContact O-N 3.46Å; Q168-R170 PolarHBondContact O-N 3.45Å; R170-R174 WeakPolarHBondContact O-CB 3.46Å; R170-R174 VanDerWaalsContact O-CG 3.25Å; R170-R174 WeakPolarHBondContact O-CG 3.48Å; R170-R174 PolarHBondContact O-N 3.47Å |
| 171 | R | 94.8 | Very high | 88.8 | Confident | 142 Ų | 142 | 109 Ų | 109 | 54% | 0.536 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -64.7 | -45.5 | 175.6 | -76.9 | -175.5 | -73.1 | -99.3 | 6.8 | 111.3 | E164 G167 Q168 V169 R174 A175 | E164-R171 IonicContact OE2-NH2 3.82Å; G167-R171 WeakPolarHBondContact O-CG 3.45Å; G167-R171 PolarHBondContact O-N 3.41Å; Q168-R171 PolarHBondContact O-N 3.44Å; V169-R171 VanDerWaalsContact C-N 3.34Å; V169-R171 PolarHBondContact O-N 2.94Å; R171-R174 PolarHBondContact O-N 3.32Å; R171-A175 WeakPolarHBondContact O-CB 3.5Å; R171-A175 PolarHBondContact O-N 3.26Å |
| 172 | L | 95.9 | Very high | 89.5 | Confident | 129 Ų | 129 | 112.8 Ų | 112.8 | 68% | 0.675 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -64.1 | -45.1 | 178 | -179.5 | 60.3 | 0 | 0 | 0 | 112 | Q168 V169 R174 A175 R176 | Q168-L172 PolarHBondContact O-N 3.32Å; V169-L172 PolarHBondContact O-N 2.86Å; L172-R174 VanDerWaalsContact C-N 3.33Å; L172-R174 PolarHBondContact O-N 2.93Å; L172-A175 WeakPolarHBondContact O-CB 3.42Å; L172-A175 PolarHBondContact O-N 3.01Å; L172-A175 VanDerWaalsContact O-N 3.15Å; L172-R176 WeakPolarHBondContact O-CB 3.27Å; L172-R176 PolarHBondContact O-N 2.99Å |
| 173 | Q | 95.6 | Very high | 89.9 | Confident | 133 Ų | 133 | 111.4 Ų | 111.4 | 62% | 0.621 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -59.4 | -43.9 | 176.7 | -172.2 | -176.8 | 14 | 0 | 0 | 111.5 | V169 A175 R176 Q177 | V169-Q173 WeakPolarHBondContact O-CB 3.49Å; V169-Q173 PolarHBondContact O-N 3.43Å; Q173-A175 PolarHBondContact O-N 2.83Å; Q173-R176 PolarHBondContact O-N 2.69Å; Q173-Q177 WeakPolarHBondContact O-CB 3.41Å; Q173-Q177 PolarHBondContact O-N 3.01Å |
| 174 | R | 95.6 | Very high | 90.2 | Very high | 114 Ų | 114 | 112 Ų | 112 | 43% | 0.43 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -65.8 | -35.8 | 175.5 | -74.5 | 177 | 176.6 | -131.6 | -10.9 | 112.9 | R170 R171 L172 R178 | R170-R174 WeakPolarHBondContact O-CB 3.46Å; R170-R174 VanDerWaalsContact O-CG 3.25Å; R170-R174 WeakPolarHBondContact O-CG 3.48Å; R170-R174 PolarHBondContact O-N 3.47Å; R171-R174 PolarHBondContact O-N 3.32Å; L172-R174 VanDerWaalsContact C-N 3.33Å; L172-R174 PolarHBondContact O-N 2.93Å; R174-R178 WeakPolarHBondContact O-CG 3.35Å; R174-R178 PolarHBondContact O-N 3.11Å; R174-R178 VanDerWaalsContact O-N 3.15Å |
| 175 | A | 95.2 | Very high | 90.8 | Very high | 53 Ų | 53 | 108.9 Ų | 108.9 | 44% | 0.438 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -66.1 | -44.5 | 175 | 0 | 0 | 0 | 0 | 0 | 110.9 | R171 L172 Q173 R178 A179 | R171-A175 WeakPolarHBondContact O-CB 3.5Å; R171-A175 PolarHBondContact O-N 3.26Å; L172-A175 WeakPolarHBondContact O-CB 3.42Å; L172-A175 PolarHBondContact O-N 3.01Å; L172-A175 VanDerWaalsContact O-N 3.15Å; Q173-A175 PolarHBondContact O-N 2.83Å; A175-R178 PolarHBondContact O-N 3.42Å; A175-A179 PolarHBondContact O-N 3.11Å |
| 176 | R | 94.9 | Very high | 91.3 | Very high | 171 Ų | 171 | 106.3 Ų | 106.3 | 65% | 0.645 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -60.9 | -48.3 | 175.6 | -177.7 | 174.7 | 175.7 | 157.5 | 0.8 | 112.1 | L172 Q173 R178 A179 E180 | L172-R176 WeakPolarHBondContact O-CB 3.27Å; L172-R176 PolarHBondContact O-N 2.99Å; Q173-R176 PolarHBondContact O-N 2.69Å; R176-R178 VanDerWaalsContact C-N 3.27Å; R176-R178 PolarHBondContact O-N 2.95Å; R176-A179 WeakPolarHBondContact O-CB 3.45Å; R176-A179 PolarHBondContact O-N 3.16Å; R176-A179 VanDerWaalsContact O-N 3.09Å; R176-E180 HydrophobicContact CG-CG 4.41Å; R176-E180 WeakPolarHBondContact CG-OE1 3.35Å; R176-E180 IonicContact CZ-OE1 3.7Å; R176-E180 IonicContact NE-OE1 2.84Å; R176-E180 PolarHBondContact NE-OE1 3.2Å; R176-E180 IonicContact NH2-OE1 3.65Å; R176-E180 WeakPolarHBondContact O-CG 3.4Å; R176-E180 PolarHBondContact O-N 3Å |
| 177 | Q | 94.4 | Very high | 91.7 | Very high | 113 Ų | 113 | 110.1 Ų | 110.1 | 53% | 0.528 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -57.6 | -40.5 | 176.9 | -171.4 | -173.2 | 19.2 | 0 | 0 | 111.8 | Q173 R181 | Q173-Q177 WeakPolarHBondContact O-CB 3.41Å; Q173-Q177 PolarHBondContact O-N 3.01Å; Q177-R181 VanDerWaalsContact O-CG 3.3Å; Q177-R181 WeakPolarHBondContact O-CG 3.36Å; Q177-R181 PolarHBondContact O-N 3.01Å |
| 178 | R | 91.8 | Very high | 91.8 | Very high | 147 Ų | 147 | 110.3 Ų | 110.3 | 56% | 0.555 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -65 | -45 | 175.5 | -74.2 | -177.1 | -178.3 | 103.4 | -7.1 | 111.7 | R174 A175 R176 E180 R181 H182 | R174-R178 WeakPolarHBondContact O-CG 3.35Å; R174-R178 PolarHBondContact O-N 3.11Å; R174-R178 VanDerWaalsContact O-N 3.15Å; A175-R178 PolarHBondContact O-N 3.42Å; R176-R178 VanDerWaalsContact C-N 3.27Å; R176-R178 PolarHBondContact O-N 2.95Å; R178-E180 VanDerWaalsContact C-N 3.34Å; R178-E180 PolarHBondContact O-N 2.98Å; R178-R181 PolarHBondContact O-N 2.79Å; R178-H182 PolarHBondContact O-CD2 3.16Å; R178-H182 PolarHBondContact O-N 2.78Å; R178-H182 VanDerWaalsContact O-N 3.08Å |
| 179 | A | 90 | Very high | 91.9 | Very high | 56 Ų | 56 | 108.8 Ų | 108.8 | 46% | 0.463 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -58.9 | -45.1 | 176.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | A175 R176 R181 H182 T183 | A175-A179 PolarHBondContact O-N 3.11Å; R176-A179 WeakPolarHBondContact O-CB 3.45Å; R176-A179 PolarHBondContact O-N 3.16Å; R176-A179 VanDerWaalsContact O-N 3.09Å; A179-R181 PolarHBondContact O-N 3.33Å; A179-H182 WeakPolarHBondContact O-CB 3.3Å; A179-H182 PolarHBondContact O-N 3.28Å; A179-H182 VanDerWaalsContact O-N 3.07Å; A179-T183 PolarHBondContact O-N 3.28Å; A179-T183 VanDerWaalsContact O-N 3.09Å |
| 180 | E | 90.4 | Very high | 91.9 | Very high | 87 Ų | 87 | 108.9 Ų | 108.9 | 41% | 0.407 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -63.7 | -36.8 | 177.3 | -70.4 | 171.1 | -179.8 | 0 | 0 | 112.4 | R176 R178 H182 T183 L184 | R176-E180 HydrophobicContact CG-CG 4.41Å; R176-E180 WeakPolarHBondContact CG-OE1 3.35Å; R176-E180 IonicContact CZ-OE1 3.7Å; R176-E180 IonicContact NE-OE1 2.84Å; R176-E180 PolarHBondContact NE-OE1 3.2Å; R176-E180 IonicContact NH2-OE1 3.65Å; R176-E180 WeakPolarHBondContact O-CG 3.4Å; R176-E180 PolarHBondContact O-N 3Å; R178-E180 VanDerWaalsContact C-N 3.34Å; R178-E180 PolarHBondContact O-N 2.98Å; E180-H182 VanDerWaalsContact C-N 3.28Å; E180-H182 PolarHBondContact O-N 2.72Å; E180-T183 WeakPolarHBondContact CA-OG1 3.27Å; E180-T183 PolarHBondContact O-N 2.97Å; E180-T183 PolarHBondContact O-OG1 2.82Å; E180-L184 PolarHBondContact O-N 2.9Å |
| 181 | R | 88.8 | Confident | 91.8 | Very high | 188 Ų | 188 | 109.3 Ų | 109.3 | 71% | 0.709 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -64.9 | -32.8 | 172.4 | -72.5 | -178.3 | 80 | 175.3 | 6.7 | 112.5 | Q177 R178 A179 S185 | Q177-R181 VanDerWaalsContact O-CG 3.3Å; Q177-R181 WeakPolarHBondContact O-CG 3.36Å; Q177-R181 PolarHBondContact O-N 3.01Å; R178-R181 PolarHBondContact O-N 2.79Å; A179-R181 PolarHBondContact O-N 3.33Å; R181-S185 WeakPolarHBondContact O-CB 3.35Å; R181-S185 PolarHBondContact O-N 2.75Å; R181-S185 VanDerWaalsContact O-N 3.12Å |
| 182 | H | 87.4 | Confident | 91.7 | Very high | 134 Ų | 134 | 107 Ų | 107 | 62% | 0.62 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -73.7 | -33 | 176.9 | -72.7 | -65.2 | 0 | 0 | 0 | 112.4 | R178 A179 E180 S185 A188 | R178-H182 PolarHBondContact O-CD2 3.16Å; R178-H182 PolarHBondContact O-N 2.78Å; R178-H182 VanDerWaalsContact O-N 3.08Å; A179-H182 WeakPolarHBondContact O-CB 3.3Å; A179-H182 PolarHBondContact O-N 3.28Å; A179-H182 VanDerWaalsContact O-N 3.07Å; E180-H182 VanDerWaalsContact C-N 3.28Å; E180-H182 PolarHBondContact O-N 2.72Å; H182-S185 WeakPolarHBondContact O-CB 3.1Å; H182-A188 VanDerWaalsContact O-CB 3.24Å; H182-A188 WeakPolarHBondContact O-CB 3.47Å |
| 183 | T | 83.5 | Confident | 91.5 | Very high | 94 Ų | 94 | 104.1 Ų | 104.1 | 58% | 0.577 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -70.6 | -37.9 | 176.9 | 53.7 | 0 | 0 | 0 | 0 | 112.6 | A179 E180 | A179-T183 PolarHBondContact O-N 3.28Å; A179-T183 VanDerWaalsContact O-N 3.09Å; E180-T183 WeakPolarHBondContact CA-OG1 3.27Å; E180-T183 PolarHBondContact O-N 2.97Å; E180-T183 PolarHBondContact O-OG1 2.82Å |
| 184 | L | 80.3 | Confident | 91.2 | Very high | 142 Ų | 142 | 105.2 Ų | 105.2 | 74% | 0.743 | 51% | 0.506 | S | S | * | . | S | Bend | trans | -93.6 | 6.4 | 179.2 | -57.2 | 178.8 | 0 | 0 | 0 | 113.2 | E180 A186 | E180-L184 PolarHBondContact O-N 2.9Å; L184-A186 PolarHBondContact O-N 2.87Å |
| 185 | S | 91.9 | Very high | 90.9 | Very high | 42 Ų | 42 | 102.3 Ų | 102.3 | 29% | 0.294 | 51% | 0.507 | S | S | . | . | trans | -63.1 | 137.4 | 179.7 | 179.8 | 0 | 0 | 0 | 0 | 110.7 | R181 H182 K187 A188 V189 | R181-S185 WeakPolarHBondContact O-CB 3.35Å; R181-S185 PolarHBondContact O-N 2.75Å; R181-S185 VanDerWaalsContact O-N 3.12Å; H182-S185 WeakPolarHBondContact O-CB 3.1Å; S185-K187 PolarHBondContact O-N 2.81Å; S185-A188 WeakPolarHBondContact O-CA 3.38Å; S185-A188 WeakPolarHBondContact O-CB 3.49Å; S185-A188 PolarHBondContact O-N 2.78Å; S185-V189 PolarHBondContact O-N 2.98Å | ||
| 186 | A | 92.1 | Very high | 90.4 | Very high | 79 Ų | 79 | 107.4 Ų | 107.4 | 65% | 0.653 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -48.9 | -38.7 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | L184 Q190 | L184-A186 PolarHBondContact O-N 2.87Å; A186-Q190 WeakPolarHBondContact O-CB 3.39Å; A186-Q190 PolarHBondContact O-N 3.41Å |
| 187 | K | 95 | Very high | 89.8 | Confident | 139 Ų | 139 | 106.2 Ų | 106.2 | 60% | 0.604 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -68.1 | -36 | 176.4 | -65.4 | -175.7 | 179 | 179.2 | 0 | 112.8 | S185 R191 | S185-K187 PolarHBondContact O-N 2.81Å; K187-R191 WeakPolarHBondContact O-CB 3.25Å; K187-R191 WeakPolarHBondContact O-CG 3.4Å; K187-R191 VanDerWaalsContact O-CZ 3.25Å; K187-R191 PolarHBondContact O-N 2.63Å; K187-R191 VanDerWaalsContact O-N 3.1Å; K187-R191 PolarHBondContact O-NE 3.06Å |
| 188 | A | 92.3 | Very high | 88.6 | Confident | 23 Ų | 23 | 105 Ų | 105 | 19% | 0.19 | 52% | 0.52 | C | S | . | . | H | α-helix | trans | -70.3 | -45.8 | 176.7 | 0 | 0 | 0 | 0 | 0 | 110.9 | H182 S185 R191 Q192 | H182-A188 VanDerWaalsContact O-CB 3.24Å; H182-A188 WeakPolarHBondContact O-CB 3.47Å; S185-A188 WeakPolarHBondContact O-CA 3.38Å; S185-A188 WeakPolarHBondContact O-CB 3.49Å; S185-A188 PolarHBondContact O-N 2.78Å; A188-R191 PolarHBondContact O-N 2.98Å; A188-Q192 WeakPolarHBondContact O-CB 3.41Å; A188-Q192 PolarHBondContact O-N 2.85Å |
| 189 | V | 92.3 | Very high | 87.6 | Confident | 56 Ų | 56 | 107 Ų | 107 | 34% | 0.339 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -61.7 | -45.8 | 174.8 | 176.2 | 0 | 0 | 0 | 0 | 111.1 | S185 R191 Q192 N193 | S185-V189 PolarHBondContact O-N 2.98Å; V189-R191 PolarHBondContact O-N 3.14Å; V189-Q192 CarbonylContact O-C 3.59Å; V189-Q192 WeakPolarHBondContact O-CB 3.27Å; V189-Q192 PolarHBondContact O-N 2.97Å; V189-Q192 VanDerWaalsContact O-N 3.12Å; V189-N193 WeakPolarHBondContact O-CB 3.32Å; V189-N193 PolarHBondContact O-N 3.24Å |
| 190 | Q | 93.2 | Very high | 86.4 | Confident | 98 Ų | 98 | 109.3 Ų | 109.3 | 46% | 0.458 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -60.8 | -42.2 | 177.3 | -174.6 | -179.6 | 19.1 | 0 | 0 | 112.2 | A186 Q192 N193 R194 | A186-Q190 WeakPolarHBondContact O-CB 3.39Å; A186-Q190 PolarHBondContact O-N 3.41Å; Q190-Q192 VanDerWaalsContact C-N 3.34Å; Q190-N193 PolarHBondContact O-N 3.07Å; Q190-R194 WeakPolarHBondContact O-CB 3.28Å; Q190-R194 VanDerWaalsContact O-CG 3.3Å; Q190-R194 WeakPolarHBondContact O-CG 3.32Å; Q190-R194 PolarHBondContact O-N 2.95Å |
| 191 | R | 92.1 | Very high | 85.1 | Confident | 155 Ų | 155 | 116.9 Ų | 116.9 | 59% | 0.585 | 56% | 0.563 | S | S | * | * | H | α-helix | trans | -63.6 | -40.6 | 173.9 | -78.7 | -176.2 | -71.1 | -96.2 | 2.1 | 111.8 | K187 A188 V189 A195 | K187-R191 WeakPolarHBondContact O-CB 3.25Å; K187-R191 WeakPolarHBondContact O-CG 3.4Å; K187-R191 VanDerWaalsContact O-CZ 3.25Å; K187-R191 PolarHBondContact O-N 2.63Å; K187-R191 VanDerWaalsContact O-N 3.1Å; K187-R191 PolarHBondContact O-NE 3.06Å; A188-R191 PolarHBondContact O-N 2.98Å; V189-R191 PolarHBondContact O-N 3.14Å; R191-A195 VanDerWaalsContact O-CB 3.31Å; R191-A195 WeakPolarHBondContact O-CB 3.39Å; R191-A195 PolarHBondContact O-N 2.96Å |
| 192 | Q | 92.5 | Very high | 83.8 | Confident | 94 Ų | 94 | 118.8 Ų | 118.8 | 44% | 0.439 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -65.1 | -44.7 | 176.9 | -174.1 | -176.5 | 2.8 | 0 | 0 | 111.7 | A188 V189 Q190 A195 R196 | A188-Q192 WeakPolarHBondContact O-CB 3.41Å; A188-Q192 PolarHBondContact O-N 2.85Å; V189-Q192 CarbonylContact O-C 3.59Å; V189-Q192 WeakPolarHBondContact O-CB 3.27Å; V189-Q192 PolarHBondContact O-N 2.97Å; V189-Q192 VanDerWaalsContact O-N 3.12Å; Q190-Q192 VanDerWaalsContact C-N 3.34Å; Q192-A195 PolarHBondContact O-N 2.8Å; Q192-R196 VanDerWaalsContact O-CG 3.3Å; Q192-R196 WeakPolarHBondContact O-CG 3.39Å; Q192-R196 PolarHBondContact O-N 3.46Å |
| 193 | N | 91.8 | Very high | 82.5 | Confident | 68 Ų | 68 | 116.1 Ų | 116.1 | 36% | 0.364 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -64.5 | -46.2 | 177.6 | -70.4 | -5.6 | 0 | 0 | 0 | 110.7 | V189 Q190 A195 R196 E197 | V189-N193 WeakPolarHBondContact O-CB 3.32Å; V189-N193 PolarHBondContact O-N 3.24Å; Q190-N193 PolarHBondContact O-N 3.07Å; N193-A195 VanDerWaalsContact C-N 3.29Å; N193-A195 PolarHBondContact O-N 2.68Å; N193-R196 CarbonylContact O-C 3.56Å; N193-R196 WeakPolarHBondContact O-CA 3.25Å; N193-R196 WeakPolarHBondContact O-CB 2.99Å; N193-R196 PolarHBondContact O-N 2.7Å; N193-E197 WeakPolarHBondContact O-CB 3.17Å; N193-E197 VanDerWaalsContact O-CG 3.29Å; N193-E197 WeakPolarHBondContact O-CG 3.06Å; N193-E197 PolarHBondContact O-N 3.09Å |
| 194 | R | 90.6 | Very high | 81.4 | Confident | 156 Ų | 156 | 120.2 Ų | 120.2 | 59% | 0.589 | 58% | 0.576 | S | S | * | * | H | α-helix | trans | -56.6 | -42.2 | 171.3 | -76.4 | 179.6 | 175.7 | -176.7 | -1 | 112.2 | Q190 R196 E197 S198 | Q190-R194 WeakPolarHBondContact O-CB 3.28Å; Q190-R194 VanDerWaalsContact O-CG 3.3Å; Q190-R194 WeakPolarHBondContact O-CG 3.32Å; Q190-R194 PolarHBondContact O-N 2.95Å; R194-R196 VanDerWaalsContact C-N 3.31Å; R194-R196 PolarHBondContact O-N 2.85Å; R194-E197 PolarHBondContact O-N 2.6Å; R194-S198 WeakPolarHBondContact O-CA 2.77Å; R194-S198 WeakPolarHBondContact O-CB 2.99Å; R194-S198 PolarHBondContact O-N 3.36Å; R194-S198 PolarHBondContact O-OG 2.76Å; R194-S198 VanDerWaalsContact O-OG 3.09Å |
| 195 | A | 88.3 | Confident | 80.5 | Confident | 53 Ų | 53 | 119.8 Ų | 119.8 | 44% | 0.438 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -67.7 | -30 | 176.3 | 0 | 0 | 0 | 0 | 0 | 113 | R191 Q192 N193 S198 R199 | R191-A195 VanDerWaalsContact O-CB 3.31Å; R191-A195 WeakPolarHBondContact O-CB 3.39Å; R191-A195 PolarHBondContact O-N 2.96Å; Q192-A195 PolarHBondContact O-N 2.8Å; N193-A195 VanDerWaalsContact C-N 3.29Å; N193-A195 PolarHBondContact O-N 2.68Å; A195-S198 WeakPolarHBondContact CA-OG 3.23Å; A195-S198 PolarHBondContact O-OG 2.81Å; A195-R199 WeakPolarHBondContact O-CG 3.42Å; A195-R199 PolarHBondContact O-N 2.97Å |
| 196 | R | 85 | Confident | 79 | Confident | 161 Ų | 161 | 126.5 Ų | 126.5 | 61% | 0.608 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -75.4 | -39.5 | 175 | -74.1 | 174.4 | 177.5 | -80.2 | 3.1 | 111.8 | Q192 N193 R194 R199 | Q192-R196 VanDerWaalsContact O-CG 3.3Å; Q192-R196 WeakPolarHBondContact O-CG 3.39Å; Q192-R196 PolarHBondContact O-N 3.46Å; N193-R196 CarbonylContact O-C 3.56Å; N193-R196 WeakPolarHBondContact O-CA 3.25Å; N193-R196 WeakPolarHBondContact O-CB 2.99Å; N193-R196 PolarHBondContact O-N 2.7Å; R194-R196 VanDerWaalsContact C-N 3.31Å; R194-R196 PolarHBondContact O-N 2.85Å; R196-R199 WeakPolarHBondContact O-CB 3.43Å |
| 197 | E | 83 | Confident | 77.5 | Confident | 146 Ų | 146 | 124.8 Ų | 124.8 | 68% | 0.682 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -77.5 | -30.7 | 177.9 | -69 | 163.2 | -161.8 | 0 | 0 | 112 | N193 R194 R199 | N193-E197 WeakPolarHBondContact O-CB 3.17Å; N193-E197 VanDerWaalsContact O-CG 3.29Å; N193-E197 WeakPolarHBondContact O-CG 3.06Å; N193-E197 PolarHBondContact O-N 3.09Å; R194-E197 PolarHBondContact O-N 2.6Å; E197-R199 VanDerWaalsContact C-N 3.26Å; E197-R199 PolarHBondContact O-N 2.83Å |
| 198 | S | 69.3 | Low | 75.9 | Confident | 87 Ų | 87 | 123.5 Ų | 123.5 | 61% | 0.608 | 60% | 0.6 | S | S | * | * | S | Bend | trans | -78.1 | -10.4 | 173.9 | 78.2 | 0 | 0 | 0 | 0 | 112.7 | R194 A195 P200 | R194-S198 WeakPolarHBondContact O-CA 2.77Å; R194-S198 WeakPolarHBondContact O-CB 2.99Å; R194-S198 PolarHBondContact O-N 3.36Å; R194-S198 PolarHBondContact O-OG 2.76Å; R194-S198 VanDerWaalsContact O-OG 3.09Å; A195-S198 WeakPolarHBondContact CA-OG 3.23Å; A195-S198 PolarHBondContact O-OG 2.81Å; S198-P200 WeakPolarHBondContact O-CD 3.28Å; S198-P200 VanDerWaalsContact O-N 3.09Å |
| 199 | R | 69.5 | Low | 74.5 | Confident | 188 Ų | 188 | 132 Ų | 132 | 71% | 0.709 | 63% | 0.633 | S | S | * | * | S | Bend | trans | -63.4 | 113.8 | 159.8 | -71.9 | -176.2 | -179.9 | -158.4 | -2.3 | 104.2 | A195 R196 E197 R201 | A195-R199 WeakPolarHBondContact O-CG 3.42Å; A195-R199 PolarHBondContact O-N 2.97Å; R196-R199 WeakPolarHBondContact O-CB 3.43Å; E197-R199 VanDerWaalsContact C-N 3.26Å; E197-R199 PolarHBondContact O-N 2.83Å; R199-R201 PolarHBondContact O-N 3.22Å |
| 200 | P | 64.9 | Low | 73.2 | Confident | 106 Ų | 106 | 136.3 Ų | 136.3 | 69% | 0.688 | 65% | 0.653 | S | S | * | * | trans | -55 | 118.7 | 173.6 | 23.7 | -30.4 | 0 | 0 | 0 | 104.7 | S198 R202 | S198-P200 WeakPolarHBondContact O-CD 3.28Å; S198-P200 VanDerWaalsContact O-N 3.09Å; P200-R202 PolarHBondContact O-N 3.45Å | ||
| 201 | R | 64.3 | Low | 72 | Confident | 245 Ų | 245 | 141 Ų | 141 | 93% | 0.925 | 67% | 0.667 | S | S | * | * | trans | -55.9 | 92.8 | 152.7 | -75.1 | -170.6 | 178.6 | -157.8 | 1.9 | 102.1 | R199 S203 | R199-R201 PolarHBondContact O-N 3.22Å; R201-S203 PolarHBondContact O-N 2.97Å | ||
| 202 | R | 60.2 | Low | 70.9 | Confident | 229 Ų | 229 | 141.5 Ų | 141.5 | 86% | 0.864 | 68% | 0.677 | S | S | * | * | trans | -67.6 | 79.9 | -175.7 | -165.7 | -177 | -169.3 | -157.5 | 4.4 | 103.6 | P200 K204 | P200-R202 PolarHBondContact O-N 3.45Å; R202-K204 PolarHBondContact O-N 2.96Å; R202-K204 VanDerWaalsContact O-N 3.08Å | ||
| 203 | S | 60.5 | Low | 69.9 | Low | 77 Ų | 77 | 141.8 Ų | 141.8 | 54% | 0.538 | 69% | 0.686 | S | S | . | * | trans | -49.9 | 121 | 153.6 | 53 | 0 | 0 | 0 | 0 | 102.9 | R201 N205 | R201-S203 PolarHBondContact O-N 2.97Å; S203-N205 PolarHBondContact O-N 2.78Å | ||
| 204 | K | 60.8 | Low | 68.8 | Low | 180 Ų | 180 | 143.9 Ų | 143.9 | 78% | 0.783 | 71% | 0.705 | S | S | * | * | trans | -71.6 | 62.6 | 179.6 | -170.9 | 162.9 | 177.1 | 177.1 | 0 | 107.3 | R202 Q206 | R202-K204 PolarHBondContact O-N 2.96Å; R202-K204 VanDerWaalsContact O-N 3.08Å; K204-Q206 PolarHBondContact O-N 3.12Å; K204-Q206 VanDerWaalsContact O-N 3.14Å | ||
| 205 | N | 60.5 | Low | 67.7 | Low | 133 Ų | 133 | 145.4 Ų | 145.4 | 71% | 0.711 | 72% | 0.719 | S | S | * | * | trans | -78.3 | 99 | 169.2 | -69.5 | 1.6 | 0 | 0 | 0 | 104.4 | S203 G207 | S203-N205 PolarHBondContact O-N 2.78Å; N205-G207 PolarHBondContact O-N 3.03Å | ||
| 206 | Q | 60.2 | Low | 66.8 | Low | 184 Ų | 184 | 153 Ų | 153 | 86% | 0.86 | 74% | 0.736 | S | S | * | * | trans | -64 | 84.3 | 165.2 | -62.9 | -142.4 | 53.4 | 0 | 0 | 107.9 | K204 | K204-Q206 PolarHBondContact O-N 3.12Å; K204-Q206 VanDerWaalsContact O-N 3.14Å | ||
| 207 | G | 61.3 | Low | 66.2 | Low | 42 Ų | 42 | 153.8 Ų | 153.8 | 43% | 0.433 | 75% | 0.747 | S | S | . | * | trans | -125.1 | 104 | 170.5 | 0 | 0 | 0 | 0 | 0 | 107.6 | N205 F209 | N205-G207 PolarHBondContact O-N 3.03Å; G207-F209 VanDerWaalsContact C-N 3.27Å; G207-F209 WeakPolarHBondContact O-CD2 3.45Å; G207-F209 PolarHBondContact O-N 3.26Å | ||
| 208 | S | 62.5 | Low | 65.4 | Low | 112 Ų | 112 | 154.4 Ų | 154.4 | 78% | 0.783 | 75% | 0.748 | S | S | * | * | trans | -68.2 | 86.2 | 170.3 | 58.3 | 0 | 0 | 0 | 0 | 109 | I210 | S208-I210 PolarHBondContact O-N 3.06Å; S208-I210 VanDerWaalsContact O-N 3.11Å | ||
| 209 | F | 60.8 | Low | 65 | Low | 201 Ų | 201 | 157.4 Ų | 157.4 | 88% | 0.882 | 76% | 0.757 | S | S | * | * | trans | -80 | 91.5 | 168.2 | -71.3 | -79.7 | 0 | 0 | 0 | 108.3 | G207 Y211 | G207-F209 VanDerWaalsContact C-N 3.27Å; G207-F209 WeakPolarHBondContact O-CD2 3.45Å; G207-F209 PolarHBondContact O-N 3.26Å; F209-Y211 PolarHBondContact O-N 3.06Å | ||
| 210 | I | 65.5 | Low | 64.5 | Low | 148 Ų | 148 | 162.1 Ų | 162.1 | 76% | 0.759 | 78% | 0.777 | S | S | * | * | trans | -69.5 | 118.7 | 163.7 | -61.5 | -173.8 | 0 | 0 | 0 | 106.5 | S208 Q212 | S208-I210 PolarHBondContact O-N 3.06Å; S208-I210 VanDerWaalsContact O-N 3.11Å; I210-Q212 PolarHBondContact O-N 3.41Å; I210-Q212 VanDerWaalsContact O-N 3.1Å | ||
| 211 | Y | 68.2 | Low | 64.5 | Low | 195 Ų | 195 | 165 Ų | 165 | 77% | 0.765 | 78% | 0.781 | S | S | * | * | trans | -66.2 | 107 | 170.9 | 178.4 | -102.4 | 0 | 0 | 0 | 108.6 | F209 P213 | F209-Y211 PolarHBondContact O-N 3.06Å; Y211-P213 WeakPolarHBondContact O-CD 3.19Å | ||
| 212 | Q | 70.2 | Confident | 64.5 | Low | 167 Ų | 167 | 160.7 Ų | 160.7 | 78% | 0.78 | 77% | 0.773 | S | S | * | * | P | Polyproline II helix | trans | -84.9 | 116.2 | 175.6 | -147.8 | 175.3 | -7.6 | 0 | 0 | 107.8 | I210 C214 | I210-Q212 PolarHBondContact O-N 3.41Å; I210-Q212 VanDerWaalsContact O-N 3.1Å; Q212-C214 PolarHBondContact O-N 3.31Å |
| 213 | P | 70.4 | Confident | 64.8 | Low | 99 Ų | 99 | 156.9 Ų | 156.9 | 64% | 0.643 | 77% | 0.768 | S | S | * | * | P | Polyproline II helix | trans | -65.4 | 121.2 | 179.9 | 24.2 | -30.9 | 0 | 0 | 0 | 109.7 | Y211 Q215 | Y211-P213 WeakPolarHBondContact O-CD 3.19Å; P213-Q215 PolarHBondContact O-N 3.32Å |
| 214 | C | 68.4 | Low | 65 | Low | 112 Ų | 112 | 161.6 Ų | 161.6 | 76% | 0.757 | 78% | 0.782 | S | S | * | * | P | Polyproline II helix | trans | -63.5 | 121.1 | 174.3 | -44.1 | 0 | 0 | 0 | 0 | 108.5 | Q212 R216 | Q212-C214 PolarHBondContact O-N 3.31Å; C214-R216 PolarHBondContact O-N 3.47Å; C214-R216 VanDerWaalsContact O-N 3.12Å |
| 215 | Q | 67.4 | Low | 65.3 | Low | 188 Ų | 188 | 160.5 Ų | 160.5 | 88% | 0.879 | 78% | 0.782 | S | S | * | * | P | Polyproline II helix | trans | -58.9 | 118 | 176.4 | -74.1 | -178.1 | 2.7 | 0 | 0 | 109.5 | P213 Q217 | P213-Q215 PolarHBondContact O-N 3.32Å; Q215-Q217 PolarHBondContact O-N 3.22Å |
| 216 | R | 70.3 | Confident | 65.6 | Low | 214 Ų | 214 | 162.3 Ų | 162.3 | 81% | 0.808 | 79% | 0.787 | S | S | * | * | trans | -67.2 | 115.8 | 169.9 | -87.1 | 178.5 | 164.2 | -116.3 | 0.1 | 108.2 | C214 F218 | C214-R216 PolarHBondContact O-N 3.47Å; C214-R216 VanDerWaalsContact O-N 3.12Å; R216-F218 HydrophobicContact CB-CE2 4.38Å; R216-F218 PolarHBondContact O-N 3.24Å | ||
| 217 | Q | 71.6 | Confident | 66 | Low | 176 Ų | 176 | 160.8 Ų | 160.8 | 82% | 0.822 | 78% | 0.781 | S | S | * | * | trans | -71.3 | 111.3 | 168.5 | -64.1 | -174.3 | -21.9 | 0 | 0 | 108 | Q215 | Q215-Q217 PolarHBondContact O-N 3.22Š| ||
| 218 | F | 66.7 | Low | 66.4 | Low | 160 Ų | 160 | 169.9 Ų | 169.9 | 70% | 0.702 | 81% | 0.808 | S | S | * | * | trans | -83 | 114.2 | 167.3 | -77.1 | -87.4 | 0 | 0 | 0 | 107.6 | R216 Y220 | R216-F218 HydrophobicContact CB-CE2 4.38Å; R216-F218 PolarHBondContact O-N 3.24Å; F218-Y220 HydrophobicContact CB-CE2 4.45Å | ||
| 219 | N | 61.7 | Low | 66.7 | Low | 149 Ų | 149 | 174.8 Ų | 174.8 | 80% | 0.797 | 81% | 0.81 | S | S | * | * | trans | -86.7 | 118.6 | 166.1 | -64.5 | -56.7 | 0 | 0 | 0 | 107.1 | ||||
| 220 | Y | 59.3 | Low | 67.2 | Low | 288 Ų | 288 | 172.4 Ų | 172.4 | 100% | 1.129 | 80% | 0.804 | S | S | * | * | trans | -87 | 0 | 167.9 | -76.7 | -85.6 | 0 | 0 | 0 | 109.9 | F218 | F218-Y220 HydrophobicContact CB-CE2 4.45Š|
Retrieved 220 of 220 residues in 113.5 ms
(Link to these results)