| 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 | 48.6 | Very low | 55.1 | Low | 237 Ų | 237 | 148.7 Ų | 148.7 | 100% | 1.167 | 87% | 0.871 | S | S | * | * | 0 | 119.3 | 0 | -62.2 | -128.3 | -115.6 | 0 | 0 | 107.6 | |||||
| 2 | P | 49 | Very low | 55.4 | Low | 136 Ų | 136 | 156.8 Ų | 156.8 | 88% | 0.883 | 88% | 0.876 | S | S | * | * | P | Polyproline II helix | trans | -79.2 | 133 | 179.7 | 30.8 | -30.4 | 0 | 0 | 0 | 110.7 | ||
| 3 | L | 54.5 | Low | 56.1 | Low | 179 Ų | 179 | 160.5 Ų | 160.5 | 94% | 0.937 | 88% | 0.877 | S | S | * | * | P | Polyproline II helix | trans | -72.6 | 129.6 | -179.8 | -140.6 | 73.5 | 0 | 0 | 0 | 109.7 | ||
| 4 | G | 52.4 | Low | 56.7 | Low | 71 Ų | 71 | 163.2 Ų | 163.2 | 73% | 0.732 | 88% | 0.876 | S | S | * | * | P | Polyproline II helix | trans | -65.1 | 151.9 | -173 | 0 | 0 | 0 | 0 | 0 | 115 | ||
| 5 | T | 62.8 | Low | 56.4 | Low | 140 Ų | 140 | 159.9 Ų | 159.9 | 86% | 0.859 | 87% | 0.866 | S | S | * | * | P | Polyproline II helix | trans | -64.6 | 138.5 | 177.3 | -21.7 | 0 | 0 | 0 | 0 | 111.3 | ||
| 6 | P | 60.7 | Low | 56.4 | Low | 122 Ų | 122 | 156.4 Ų | 156.4 | 79% | 0.792 | 86% | 0.858 | S | S | * | * | P | Polyproline II helix | trans | -77.2 | 145.6 | 178.2 | 30 | -32.7 | 0 | 0 | 0 | 112.4 | ||
| 7 | A | 53.8 | Low | 56.7 | Low | 92 Ų | 92 | 158.1 Ų | 158.1 | 76% | 0.76 | 86% | 0.855 | S | S | * | * | P | Polyproline II helix | trans | -69.1 | 150 | -178.5 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||
| 8 | P | 56.3 | Low | 57.2 | Low | 127 Ų | 127 | 157.4 Ų | 157.4 | 83% | 0.825 | 85% | 0.849 | S | S | * | * | P | Polyproline II helix | trans | -76.5 | 142.3 | -176.6 | 29.9 | -33.1 | 0 | 0 | 0 | 113.2 | N10 | P8-N10 PolarHBondContact O-N 3.48Š|
| 9 | L | 59.4 | Low | 57.3 | Low | 170 Ų | 170 | 157.1 Ų | 157.1 | 89% | 0.89 | 85% | 0.845 | S | S | * | * | P | Polyproline II helix | trans | -69.9 | 119.2 | 179.6 | -133.4 | 98 | 0 | 0 | 0 | 111.3 | K11 | L9-K11 PolarHBondContact O-N 2.79Š|
| 10 | N | 51.3 | Low | 57.6 | Low | 161 Ų | 161 | 154.7 Ų | 154.7 | 86% | 0.861 | 84% | 0.836 | S | S | * | * | trans | -68.1 | 115.8 | 173.6 | -104.3 | -34 | 0 | 0 | 0 | 110.7 | P8 R12 | P8-N10 PolarHBondContact O-N 3.48Å; N10-R12 PolarHBondContact O-N 3.13Å | ||
| 11 | K | 57.3 | Low | 57.5 | Low | 201 Ų | 201 | 152.6 Ų | 152.6 | 87% | 0.874 | 83% | 0.825 | S | S | * | * | trans | -73.5 | 110.8 | 174.1 | -65.8 | -176.2 | -179.1 | 179 | 0 | 109.7 | L9 K13 | L9-K11 PolarHBondContact O-N 2.79Å; K11-K13 PolarHBondContact O-N 3.27Å | ||
| 12 | R | 58.8 | Low | 58.1 | Low | 246 Ų | 246 | 147.2 Ų | 147.2 | 93% | 0.928 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -61.6 | 124.1 | 171.2 | -73.7 | 171.4 | 92.2 | 150.7 | 1.4 | 109.6 | N10 | N10-R12 PolarHBondContact O-N 3.13Š|
| 13 | K | 64 | Low | 58.6 | Low | 205 Ų | 205 | 144.6 Ų | 144.6 | 89% | 0.891 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -72 | 130.5 | 168.8 | -66.7 | -174.6 | 178.6 | -177.8 | 0 | 108.9 | K11 | K11-K13 PolarHBondContact O-N 3.27Š|
| 14 | K | 64.7 | Low | 58.4 | Low | 198 Ų | 198 | 144 Ų | 144 | 86% | 0.861 | 78% | 0.777 | S | S | * | * | P | Polyproline II helix | trans | -72.5 | 138.6 | 174.8 | -60.9 | -178 | -176.8 | -179.3 | 0 | 109.1 | S16 | K14-S16 PolarHBondContact O-N 3.04Š|
| 15 | P | 52.3 | Low | 58.4 | Low | 113 Ų | 113 | 146.4 Ų | 146.4 | 73% | 0.734 | 77% | 0.772 | S | S | * | * | P | Polyproline II helix | trans | -70.7 | 120.6 | 169.9 | 28.8 | -31.5 | 0 | 0 | 0 | 109.2 | K17 | P15-K17 PolarHBondContact O-N 3.14Š|
| 16 | S | 57.4 | Low | 57.6 | Low | 105 Ų | 105 | 144.7 Ų | 144.7 | 73% | 0.734 | 77% | 0.765 | S | S | * | * | trans | -71.2 | 101.7 | 170.8 | 48.2 | 0 | 0 | 0 | 0 | 108.9 | K14 I18 | K14-S16 PolarHBondContact O-N 3.04Å; S16-I18 PolarHBondContact O-N 3.02Å | ||
| 17 | K | 60.5 | Low | 57.2 | Low | 185 Ų | 185 | 147.2 Ų | 147.2 | 80% | 0.804 | 77% | 0.767 | S | S | * | * | trans | -76.4 | 105.9 | 164.2 | -65 | -177.1 | -178.7 | -176.3 | 0 | 106.7 | P15 I19 | P15-K17 PolarHBondContact O-N 3.14Å; K17-I19 PolarHBondContact O-N 3.17Å | ||
| 18 | I | 65.6 | Low | 57 | Low | 145 Ų | 145 | 150 Ų | 150 | 74% | 0.744 | 77% | 0.769 | S | S | * | * | trans | -81.1 | 104.8 | 171 | -60.1 | 169 | 0 | 0 | 0 | 105.3 | S16 | S16-I18 PolarHBondContact O-N 3.02Š| ||
| 19 | I | 59.7 | Low | 56.6 | Low | 152 Ų | 152 | 153.5 Ų | 153.5 | 78% | 0.779 | 77% | 0.774 | S | S | * | * | trans | -92.4 | 104.3 | 168.1 | -59.5 | 173 | 0 | 0 | 0 | 105 | K17 D21 | K17-I19 PolarHBondContact O-N 3.17Å; I19-D21 PolarHBondContact O-N 3.3Å | ||
| 20 | T | 63.7 | Low | 56 | Low | 108 Ų | 108 | 154.7 Ų | 154.7 | 66% | 0.663 | 77% | 0.772 | S | S | * | * | trans | -78.6 | 106.1 | 172.9 | -34.2 | 0 | 0 | 0 | 0 | 107.4 | ||||
| 21 | D | 54.6 | Low | 56 | Low | 112 Ų | 112 | 155.2 Ų | 155.2 | 60% | 0.599 | 77% | 0.77 | S | S | * | * | trans | -79.1 | 117.2 | 175 | -171.5 | -7.7 | 0 | 0 | 0 | 109.2 | I19 S23 | I19-D21 PolarHBondContact O-N 3.3Å; D21-S23 VanDerWaalsContact CG-OG 3.23Å; D21-S23 WeakPolarHBondContact OD1-CB 2.92Å; D21-S23 PolarHBondContact OD1-N 2.7Å; D21-S23 PolarHBondContact OD1-OG 3.05Å; D21-S23 PolarHBondContact OD2-OG 2.84Å | ||
| 22 | L | 60.6 | Low | 55.7 | Low | 124 Ų | 124 | 153.6 Ų | 153.6 | 65% | 0.649 | 77% | 0.77 | S | S | * | * | trans | -100.2 | 15.3 | -178 | -69 | 166.1 | 0 | 0 | 0 | 112.4 | H24 I25 | L22-H24 PolarHBondContact O-N 3Å; L22-H24 VanDerWaalsContact O-N 3.14Å; L22-I25 HydrophobicContact CD2-CD1 3.76Å | ||
| 23 | S | 59.8 | Low | 54.8 | Low | 81 Ų | 81 | 147.9 Ų | 147.9 | 57% | 0.566 | 75% | 0.754 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -69.8 | -3.5 | -177 | 57 | 0 | 0 | 0 | 0 | 115.6 | D21 | D21-S23 VanDerWaalsContact CG-OG 3.23Å; D21-S23 WeakPolarHBondContact OD1-CB 2.92Å; D21-S23 PolarHBondContact OD1-N 2.7Å; D21-S23 PolarHBondContact OD1-OG 3.05Å; D21-S23 PolarHBondContact OD2-OG 2.84Å |
| 24 | H | 51.7 | Low | 54.1 | Low | 165 Ų | 165 | 144.4 Ų | 144.4 | 76% | 0.764 | 75% | 0.752 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -107.9 | 10.1 | -177.1 | -66.8 | -56 | 0 | 0 | 0 | 115.7 | L22 S26 | L22-H24 PolarHBondContact O-N 3Å; L22-H24 VanDerWaalsContact O-N 3.14Å; H24-S26 VanDerWaalsContact C-N 3.33Å; H24-S26 PolarHBondContact O-N 3.05Å |
| 25 | I | 52.3 | Low | 53.4 | Low | 122 Ų | 122 | 142.7 Ų | 142.7 | 63% | 0.626 | 75% | 0.747 | S | S | * | * | trans | -85.2 | 82 | 175.6 | -55.5 | 169.8 | 0 | 0 | 0 | 108.6 | L22 Q27 | L22-I25 HydrophobicContact CD2-CD1 3.76Å; I25-Q27 PolarHBondContact O-N 3.36Å | ||
| 26 | S | 46 | Very low | 53.1 | Low | 104 Ų | 104 | 141.8 Ų | 141.8 | 73% | 0.727 | 75% | 0.749 | S | S | * | * | trans | -66.9 | 112.9 | 163.2 | 47.1 | 0 | 0 | 0 | 0 | 108.7 | H24 D28 | H24-S26 VanDerWaalsContact C-N 3.33Å; H24-S26 PolarHBondContact O-N 3.05Å; S26-D28 PolarHBondContact O-N 3.34Å; S26-D28 VanDerWaalsContact O-N 3.13Å | ||
| 27 | Q | 51.3 | Low | 53.1 | Low | 176 Ų | 176 | 141.4 Ų | 141.4 | 82% | 0.822 | 75% | 0.746 | S | S | * | * | trans | -71.4 | 94.1 | 162.6 | -72.3 | 176.5 | -41.2 | 0 | 0 | 107.2 | I25 | I25-Q27 PolarHBondContact O-N 3.36Š| ||
| 28 | D | 49.2 | Very low | 53 | Low | 149 Ų | 149 | 141.4 Ų | 141.4 | 80% | 0.797 | 75% | 0.749 | S | S | * | * | trans | 160.9 | 94.1 | 152.1 | -84.6 | -22.9 | 0 | 0 | 0 | 107.8 | S26 | S26-D28 PolarHBondContact O-N 3.34Å; S26-D28 VanDerWaalsContact O-N 3.13Å | ||
| 29 | E | 47.8 | Very low | 52.8 | Low | 201 Ų | 201 | 142.7 Ų | 142.7 | 94% | 0.939 | 75% | 0.75 | S | S | * | * | trans | -167.8 | 108 | 134.7 | -105.7 | 170.3 | -160.8 | 0 | 0 | 108.4 | ||||
| 30 | F | 47.9 | Very low | 53 | Low | 195 Ų | 195 | 142.4 Ų | 142.4 | 86% | 0.855 | 75% | 0.75 | S | S | * | * | trans | -72.1 | 142.9 | 168.9 | -143.6 | -110.1 | 0 | 0 | 0 | 107.5 | ||||
| 31 | E | 51.1 | Low | 53.1 | Low | 172 Ų | 172 | 143.2 Ų | 143.2 | 80% | 0.804 | 75% | 0.749 | S | S | * | * | S | Bend | trans | 90 | 124.7 | 169.5 | -64 | -175.2 | 143.4 | 0 | 0 | 119.3 | ||
| 32 | L | 50.8 | Low | 53.6 | Low | 167 Ų | 167 | 139.9 Ų | 139.9 | 87% | 0.874 | 74% | 0.741 | S | S | * | * | trans | 87.7 | 71.9 | 158.5 | -60.4 | 160.9 | 0 | 0 | 0 | 118.5 | ||||
| 33 | E | 40.8 | Very low | 54.2 | Low | 127 Ų | 127 | 140.9 Ų | 140.9 | 59% | 0.593 | 75% | 0.753 | S | S | * | * | trans | -167.2 | 110 | 148.7 | -116.8 | -69.6 | 162.8 | 0 | 0 | 110.8 | E35 | E33-E35 VanDerWaalsContact C-N 3.25Å; E33-E35 PolarHBondContact O-N 2.79Å; E33-E35 VanDerWaalsContact OE2-CA 3.23Å; E33-E35 WeakPolarHBondContact OE2-CA 3.23Å; E33-E35 WeakPolarHBondContact OE2-CB 3.14Å; E33-E35 PolarHBondContact OE2-N 2.88Å | ||
| 34 | P | 47.4 | Very low | 54.6 | Low | 131 Ų | 131 | 144.7 Ų | 144.7 | 85% | 0.851 | 76% | 0.759 | S | S | * | * | S | Bend | trans | -84.7 | 12.3 | 174.4 | 35 | -33.2 | 0 | 0 | 0 | 113.5 | ||
| 35 | E | 50.4 | Low | 55 | Low | 162 Ų | 162 | 145 Ų | 145 | 76% | 0.757 | 76% | 0.764 | S | S | * | * | trans | -114.4 | 14.9 | -169.3 | -144.7 | 166.5 | 171.8 | 0 | 0 | 114 | E33 | E33-E35 VanDerWaalsContact C-N 3.25Å; E33-E35 PolarHBondContact O-N 2.79Å; E33-E35 VanDerWaalsContact OE2-CA 3.23Å; E33-E35 WeakPolarHBondContact OE2-CA 3.23Å; E33-E35 WeakPolarHBondContact OE2-CB 3.14Å; E33-E35 PolarHBondContact OE2-N 2.88Å | ||
| 36 | A | 47.5 | Very low | 55.5 | Low | 94 Ų | 94 | 147.1 Ų | 147.1 | 78% | 0.777 | 76% | 0.764 | S | S | * | * | S | Bend | trans | -111.3 | 13.8 | -179.8 | 0 | 0 | 0 | 0 | 0 | 115.3 | ||
| 37 | S | 56.5 | Low | 56 | Low | 97 Ų | 97 | 147.9 Ų | 147.9 | 68% | 0.678 | 77% | 0.765 | S | S | * | * | trans | -113.9 | 38 | 171.4 | 80.4 | 0 | 0 | 0 | 0 | 112.6 | F39 | S37-F39 PolarHBondContact O-N 2.77Š| ||
| 38 | E | 58.9 | Low | 56.4 | Low | 185 Ų | 185 | 145.1 Ų | 145.1 | 86% | 0.864 | 76% | 0.762 | S | S | * | * | trans | -77.5 | 76.8 | 159.3 | -168.4 | 169.2 | -164.9 | 0 | 0 | 108.1 | D40 | E38-D40 PolarHBondContact O-N 3.2Š| ||
| 39 | F | 61.5 | Low | 57.2 | Low | 172 Ų | 172 | 143.8 Ų | 143.8 | 75% | 0.754 | 75% | 0.749 | S | S | * | * | trans | -61.5 | 115.8 | 162.2 | -95.1 | -91.6 | 0 | 0 | 0 | 107.2 | S37 L41 | S37-F39 PolarHBondContact O-N 2.77Å; F39-L41 VanDerWaalsContact C-N 3.29Å; F39-L41 HydrophobicContact CB-CD2 4.26Å; F39-L41 PolarHBondContact O-N 2.95Å | ||
| 40 | D | 62.3 | Low | 58 | Low | 147 Ų | 147 | 142.5 Ų | 142.5 | 79% | 0.786 | 74% | 0.744 | S | S | * | * | trans | -63.9 | 94.9 | 166.8 | -178.4 | 8 | 0 | 0 | 0 | 108 | E38 G42 | E38-D40 PolarHBondContact O-N 3.2Å; D40-G42 PolarHBondContact O-N 2.83Å; D40-G42 PolarHBondContact OD1-N 2.89Å | ||
| 41 | L | 66 | Low | 58.8 | Low | 125 Ų | 125 | 139.3 Ų | 139.3 | 65% | 0.654 | 73% | 0.734 | S | S | * | * | trans | -71.1 | 10.9 | 179.2 | -65.3 | 175.7 | 0 | 0 | 0 | 112.4 | F39 | F39-L41 VanDerWaalsContact C-N 3.29Å; F39-L41 HydrophobicContact CB-CD2 4.26Å; F39-L41 PolarHBondContact O-N 2.95Å | ||
| 42 | G | 66.1 | Low | 59.5 | Low | 41 Ų | 41 | 135.3 Ų | 135.3 | 42% | 0.423 | 72% | 0.716 | S | S | . | * | trans | 58.9 | -176.4 | -171.4 | 0 | 0 | 0 | 0 | 0 | 111.3 | D40 K44 | D40-G42 PolarHBondContact O-N 2.83Å; D40-G42 PolarHBondContact OD1-N 2.89Å; G42-K44 PolarHBondContact O-N 3.03Å | ||
| 43 | T | 72.5 | Confident | 60.1 | Low | 145 Ų | 145 | 134.4 Ų | 134.4 | 89% | 0.89 | 71% | 0.712 | S | S | * | * | S | Bend | trans | -59 | 101.2 | 173.7 | -52.4 | 0 | 0 | 0 | 0 | 109.3 | I45 | T43-I45 PolarHBondContact O-N 2.85Š|
| 44 | K | 67.9 | Low | 61.3 | Low | 162 Ų | 162 | 135 Ų | 135 | 70% | 0.704 | 72% | 0.715 | S | S | * | * | trans | -50.5 | 109.2 | 174.4 | -66.7 | -178.2 | -178.2 | 178.7 | 0 | 107.9 | G42 R46 | G42-K44 PolarHBondContact O-N 3.03Å; K44-R46 PolarHBondContact O-N 3.31Å | ||
| 45 | I | 61.8 | Low | 62.3 | Low | 170 Ų | 170 | 132.5 Ų | 132.5 | 87% | 0.872 | 69% | 0.691 | S | S | * | * | trans | -61.6 | 92.7 | 161.8 | 29.9 | 170.8 | 0 | 0 | 0 | 105.7 | T43 T47 | T43-I45 PolarHBondContact O-N 2.85Å; I45-T47 PolarHBondContact O-N 3.01Å | ||
| 46 | R | 62.3 | Low | 63.1 | Low | 167 Ų | 167 | 126.6 Ų | 126.6 | 63% | 0.63 | 67% | 0.665 | S | S | * | * | trans | -43.3 | 125.8 | 175.2 | 176.5 | -172.5 | 171.4 | 132.4 | 20.2 | 107.8 | K44 K49 | K44-R46 PolarHBondContact O-N 3.31Å; R46-K49 VanDerWaalsContact CZ-CG 3.47Å | ||
| 47 | T | 56.3 | Low | 64.1 | Low | 121 Ų | 121 | 126.1 Ų | 126.1 | 74% | 0.742 | 66% | 0.656 | S | S | * | * | trans | -41.7 | 129.3 | 171.2 | 2.9 | 0 | 0 | 0 | 0 | 108.5 | I45 K49 | I45-T47 PolarHBondContact O-N 3.01Å; T47-K49 PolarHBondContact O-N 3.15Å | ||
| 48 | P | 59.1 | Low | 65 | Low | 118 Ų | 118 | 125.2 Ų | 125.2 | 77% | 0.766 | 64% | 0.643 | S | S | * | * | trans | -49.9 | 115.6 | -176.1 | -24.7 | 31.7 | 0 | 0 | 0 | 108 | E50 | P48-E50 VanDerWaalsContact C-N 3.35Å; P48-E50 PolarHBondContact O-N 2.81Å | ||
| 49 | K | 66.2 | Low | 65.6 | Low | 120 Ų | 120 | 121.4 Ų | 121.4 | 52% | 0.522 | 63% | 0.627 | S | S | . | * | trans | -52.9 | 108.5 | 173.1 | -96 | 163.2 | 135 | 153.2 | 0 | 105.1 | R46 T47 I51 | R46-K49 VanDerWaalsContact CZ-CG 3.47Å; T47-K49 PolarHBondContact O-N 3.15Å; K49-I51 PolarHBondContact O-N 3.15Å | ||
| 50 | E | 65.6 | Low | 66.4 | Low | 175 Ų | 175 | 122 Ų | 122 | 82% | 0.818 | 63% | 0.629 | S | S | * | * | trans | -48.3 | 116.1 | 159.4 | -65.8 | -178.9 | -179.4 | 0 | 0 | 104.9 | P48 M52 | P48-E50 VanDerWaalsContact C-N 3.35Å; P48-E50 PolarHBondContact O-N 2.81Å; E50-M52 PolarHBondContact O-N 3.19Å | ||
| 51 | I | 64.6 | Low | 67.5 | Low | 127 Ų | 127 | 119.2 Ų | 119.2 | 65% | 0.651 | 61% | 0.614 | S | S | * | * | trans | -42.5 | 106.7 | 174.4 | 21.7 | 168.6 | 0 | 0 | 0 | 107.2 | K49 L53 L56 | K49-I51 PolarHBondContact O-N 3.15Å; I51-L53 PolarHBondContact O-N 2.69Å; I51-L56 HydrophobicContact CB-CD1 4.4Å; I51-L56 HydrophobicContact CD1-CD1 4.35Å | ||
| 52 | M | 64.7 | Low | 68.3 | Low | 88 Ų | 88 | 123.3 Ų | 123.3 | 43% | 0.433 | 62% | 0.62 | S | S | . | * | trans | -62.6 | 118.5 | -176.6 | -63.2 | -164.7 | -64.4 | 0 | 0 | 106.3 | E50 E54 E55 L56 | E50-M52 PolarHBondContact O-N 3.19Å; M52-E54 PolarHBondContact O-N 3.32Å; M52-E55 HydrophobicContact CB-CB 4.36Å; M52-E55 HydrophobicContact CB-CG 4.01Å; M52-E55 HydrophobicContact CE-CG 3.78Å; M52-E55 WeakPolarHBondContact CE-OE1 3.21Å; M52-E55 WeakPolarHBondContact O-CA 3.16Å; M52-E55 WeakPolarHBondContact O-CB 3.17Å; M52-E55 PolarHBondContact O-N 3.38Å; M52-L56 PolarHBondContact O-N 3.33Å | ||
| 53 | L | 64.1 | Low | 69.3 | Low | 149 Ų | 149 | 123 Ų | 123 | 78% | 0.78 | 62% | 0.618 | S | S | * | * | H | α-helix | trans | -52.5 | -29.2 | 178.3 | -71.7 | 169.6 | 0 | 0 | 0 | 111.2 | I51 L56 S57 | I51-L53 PolarHBondContact O-N 2.69Å; L53-L56 PolarHBondContact O-N 3.35Å; L53-S57 PolarHBondContact O-N 3.17Å |
| 54 | E | 66.6 | Low | 70 | Confident | 140 Ų | 140 | 116.2 Ų | 116.2 | 65% | 0.654 | 58% | 0.576 | S | S | * | * | H | α-helix | trans | -60.7 | -44.1 | 171.5 | -167.8 | 177 | 175.5 | 0 | 0 | 113.2 | M52 L56 S57 L58 | M52-E54 PolarHBondContact O-N 3.32Å; E54-L56 VanDerWaalsContact C-N 3.29Å; E54-L56 PolarHBondContact O-N 3.3Å; E54-S57 PolarHBondContact O-N 2.75Å; E54-S57 VanDerWaalsContact O-N 3.15Å; E54-S57 PolarHBondContact O-OG 3.04Å; E54-L58 WeakPolarHBondContact O-CD1 3.39Å; E54-L58 PolarHBondContact O-N 3.28Å |
| 55 | E | 68 | Low | 70.9 | Confident | 77 Ų | 77 | 112.5 Ų | 112.5 | 36% | 0.36 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -64.8 | -31.9 | 176.2 | -71.4 | -177.3 | 174.3 | 0 | 0 | 112.7 | M52 S57 S64 | M52-E55 HydrophobicContact CB-CB 4.36Å; M52-E55 HydrophobicContact CB-CG 4.01Å; M52-E55 HydrophobicContact CE-CG 3.78Å; M52-E55 WeakPolarHBondContact CE-OE1 3.21Å; M52-E55 WeakPolarHBondContact O-CA 3.16Å; M52-E55 WeakPolarHBondContact O-CB 3.17Å; M52-E55 PolarHBondContact O-N 3.38Å; E55-S57 VanDerWaalsContact C-N 3.34Å; E55-S64 WeakPolarHBondContact O-CB 2.99Å |
| 56 | L | 66.5 | Low | 72.3 | Confident | 39 Ų | 39 | 109 Ų | 109 | 20% | 0.204 | 54% | 0.541 | C | S | . | . | H | α-helix | trans | -75.3 | -22.6 | 176.3 | -67.8 | 177.8 | 0 | 0 | 0 | 112.9 | I51 M52 L53 E54 S64 F67 | I51-L56 HydrophobicContact CB-CD1 4.4Å; I51-L56 HydrophobicContact CD1-CD1 4.35Å; M52-L56 PolarHBondContact O-N 3.33Å; L53-L56 PolarHBondContact O-N 3.35Å; E54-L56 VanDerWaalsContact C-N 3.29Å; E54-L56 PolarHBondContact O-N 3.3Å; L56-S64 VanDerWaalsContact O-CB 3.23Å; L56-S64 WeakPolarHBondContact O-CB 3.41Å; L56-F67 HydrophobicContact CB-CD1 4.41Å; L56-F67 HydrophobicContact CD2-CB 4.21Å; L56-F67 HydrophobicContact CD2-CG 4.34Å |
| 57 | S | 68.8 | Low | 73.5 | Confident | 84 Ų | 84 | 106 Ų | 106 | 59% | 0.587 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -78.9 | -26.7 | 174.9 | 80.1 | 0 | 0 | 0 | 0 | 112.9 | L53 E54 E55 M59 | L53-S57 PolarHBondContact O-N 3.17Å; E54-S57 PolarHBondContact O-N 2.75Å; E54-S57 VanDerWaalsContact O-N 3.15Å; E54-S57 PolarHBondContact O-OG 3.04Å; E55-S57 VanDerWaalsContact C-N 3.34Å; S57-M59 PolarHBondContact O-N 3.24Å |
| 58 | L | 76.1 | Confident | 74.9 | Confident | 77 Ų | 77 | 104.6 Ų | 104.6 | 40% | 0.403 | 52% | 0.516 | S | S | . | . | trans | -71.8 | 111.5 | -176.4 | -84.2 | 151.1 | 0 | 0 | 0 | 112 | E54 K60 S64 | E54-L58 WeakPolarHBondContact O-CD1 3.39Å; E54-L58 PolarHBondContact O-N 3.28Å; L58-K60 PolarHBondContact O-N 3.49Å; L58-S64 WeakPolarHBondContact O-CB 3.18Å; L58-S64 PolarHBondContact O-OG 2.88Å | ||
| 59 | M | 69.6 | Low | 76.3 | Confident | 106 Ų | 106 | 106 Ų | 106 | 52% | 0.522 | 51% | 0.506 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -68.7 | 11.3 | 180 | -68.7 | -66.9 | -68 | 0 | 0 | 115.6 | S57 K65 K68 | S57-M59 PolarHBondContact O-N 3.24Å; M59-K65 WeakPolarHBondContact O-CE 3.36Å; M59-K68 HydrophobicContact CE-CD 4.14Å; M59-K68 HydrophobicContact SD-CD 3.5Å; M59-K68 WeakPolarHBondContact SD-CD 3.47Å |
| 60 | K | 79.8 | Confident | 77.5 | Confident | 185 Ų | 185 | 108.4 Ų | 108.4 | 80% | 0.804 | 51% | 0.512 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -96.4 | -34.9 | -177.7 | -62.2 | -179.6 | -178.5 | 178.5 | 0 | 112.3 | L58 | L58-K60 PolarHBondContact O-N 3.49Š|
| 61 | N | 84.6 | Confident | 78.5 | Confident | 87 Ų | 87 | 104.5 Ų | 104.5 | 47% | 0.465 | 49% | 0.494 | S | S | . | . | S | Bend | trans | -77.5 | 148.6 | -177.9 | -169.1 | -53.2 | 0 | 0 | 0 | 111.9 | G63 S64 K65 | N61-G63 PolarHBondContact OD1-N 2.85Å; N61-S64 PolarHBondContact O-OG 3.22Å; N61-K65 WeakPolarHBondContact O-CG 3.46Å; N61-K65 PolarHBondContact O-N 2.53Å |
| 62 | R | 83.9 | Confident | 79.6 | Confident | 211 Ų | 211 | 103.4 Ų | 103.4 | 80% | 0.796 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -65.9 | -38.9 | 174.3 | -174.9 | 178.6 | 176.6 | -173.5 | -0.7 | 111.8 | K65 M66 | R62-K65 PolarHBondContact O-N 2.86Å; R62-M66 VanDerWaalsContact O-CG 3.31Å; R62-M66 WeakPolarHBondContact O-CG 3.49Å; R62-M66 PolarHBondContact O-N 3.31Å |
| 63 | G | 85.8 | Confident | 80.9 | Confident | 36 Ų | 36 | 106.5 Ų | 106.5 | 37% | 0.371 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -61.7 | -47.3 | 178.7 | 0 | 0 | 0 | 0 | 0 | 112.8 | N61 K65 M66 F67 | N61-G63 PolarHBondContact OD1-N 2.85Å; G63-K65 PolarHBondContact O-N 3.34Å; G63-M66 PolarHBondContact O-N 3.36Å; G63-F67 WeakPolarHBondContact O-CB 3.5Å; G63-F67 PolarHBondContact O-N 3.42Å |
| 64 | S | 86.7 | Confident | 81.9 | Confident | 2 Ų | 2 | 102.9 Ų | 102.9 | 1% | 0.014 | 48% | 0.477 | C | S | . | . | H | α-helix | trans | -63.6 | -39.7 | 176.1 | 57.9 | 0 | 0 | 0 | 0 | 112.9 | E55 L56 L58 N61 M66 F67 K68 | E55-S64 WeakPolarHBondContact O-CB 2.99Å; L56-S64 VanDerWaalsContact O-CB 3.23Å; L56-S64 WeakPolarHBondContact O-CB 3.41Å; L58-S64 WeakPolarHBondContact O-CB 3.18Å; L58-S64 PolarHBondContact O-OG 2.88Å; N61-S64 PolarHBondContact O-OG 3.22Å; S64-M66 PolarHBondContact O-N 3.47Å; S64-F67 PolarHBondContact O-N 3.27Å; S64-K68 WeakPolarHBondContact O-CB 3.31Å; S64-K68 PolarHBondContact O-N 2.83Å |
| 65 | K | 88.2 | Confident | 82.6 | Confident | 83 Ų | 83 | 101.2 Ų | 101.2 | 36% | 0.361 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -63 | -41.6 | 173.3 | -71.6 | 175.9 | -174 | 177.3 | 0 | 112.1 | M59 N61 R62 G63 R69 | M59-K65 WeakPolarHBondContact O-CE 3.36Å; N61-K65 WeakPolarHBondContact O-CG 3.46Å; N61-K65 PolarHBondContact O-N 2.53Å; R62-K65 PolarHBondContact O-N 2.86Å; G63-K65 PolarHBondContact O-N 3.34Å; K65-R69 WeakPolarHBondContact O-CB 3.23Å; K65-R69 WeakPolarHBondContact O-CG 2.85Å; K65-R69 PolarHBondContact O-N 3.46Å |
| 66 | M | 90.1 | Very high | 83 | Confident | 96 Ų | 96 | 103 Ų | 103 | 47% | 0.473 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -66.9 | -40.3 | 177.2 | -74.7 | -65.1 | -69.3 | 0 | 0 | 111.6 | R62 G63 S64 R70 | R62-M66 VanDerWaalsContact O-CG 3.31Å; R62-M66 WeakPolarHBondContact O-CG 3.49Å; R62-M66 PolarHBondContact O-N 3.31Å; G63-M66 PolarHBondContact O-N 3.36Å; S64-M66 PolarHBondContact O-N 3.47Å; M66-R70 VanDerWaalsContact O-CB 3.27Å; M66-R70 WeakPolarHBondContact O-CB 3.47Å; M66-R70 PolarHBondContact O-N 2.98Å |
| 67 | F | 87.8 | Confident | 83.5 | Confident | 104 Ų | 104 | 106.9 Ų | 106.9 | 46% | 0.456 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -60.5 | -50.8 | 174.1 | 178.5 | -103.2 | 0 | 0 | 0 | 111.2 | L56 G63 S64 R69 R70 Q71 | L56-F67 HydrophobicContact CB-CD1 4.41Å; L56-F67 HydrophobicContact CD2-CB 4.21Å; L56-F67 HydrophobicContact CD2-CG 4.34Å; G63-F67 WeakPolarHBondContact O-CB 3.5Å; G63-F67 PolarHBondContact O-N 3.42Å; S64-F67 PolarHBondContact O-N 3.27Å; F67-R69 PolarHBondContact O-N 2.91Å; F67-R70 CarbonylContact O-C 3.58Å; F67-R70 WeakPolarHBondContact O-CA 3.45Å; F67-R70 WeakPolarHBondContact O-CB 3.32Å; F67-R70 PolarHBondContact O-N 3.32Å; F67-Q71 PolarHBondContact O-N 3.06Å |
| 68 | K | 85.6 | Confident | 83.8 | Confident | 92 Ų | 92 | 107.4 Ų | 107.4 | 40% | 0.4 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -63.4 | -40.9 | 178.6 | -164.8 | 167.7 | -171.7 | 168.6 | 0 | 113.1 | M59 S64 R70 Q71 Q72 | M59-K68 HydrophobicContact CE-CD 4.14Å; M59-K68 HydrophobicContact SD-CD 3.5Å; M59-K68 WeakPolarHBondContact SD-CD 3.47Å; S64-K68 WeakPolarHBondContact O-CB 3.31Å; S64-K68 PolarHBondContact O-N 2.83Å; K68-R70 VanDerWaalsContact C-N 3.3Å; K68-R70 PolarHBondContact O-N 3.44Å; K68-Q71 WeakPolarHBondContact O-CB 3.38Å; K68-Q71 PolarHBondContact O-N 3.5Å; K68-Q72 WeakPolarHBondContact O-CG 3.41Å; K68-Q72 PolarHBondContact O-N 2.95Å |
| 69 | R | 88.3 | Confident | 83.2 | Confident | 147 Ų | 147 | 112.5 Ų | 112.5 | 56% | 0.555 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -65.7 | -32.8 | 172.7 | -75.3 | -179.3 | -178.8 | 141.6 | -2.5 | 112.5 | K65 F67 R73 | K65-R69 WeakPolarHBondContact O-CB 3.23Å; K65-R69 WeakPolarHBondContact O-CG 2.85Å; K65-R69 PolarHBondContact O-N 3.46Å; F67-R69 PolarHBondContact O-N 2.91Å; R69-R73 WeakPolarHBondContact O-CB 3.36Å; R69-R73 VanDerWaalsContact O-CG 3.3Å; R69-R73 WeakPolarHBondContact O-CG 3.46Å; R69-R73 PolarHBondContact O-N 3.07Å; R69-R73 VanDerWaalsContact O-N 3.08Å; R69-R73 PolarHBondContact O-NE 2.91Å |
| 70 | R | 91.6 | Very high | 82.9 | Confident | 172 Ų | 172 | 111.6 Ų | 111.6 | 65% | 0.649 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -69.8 | -42.1 | 174.3 | -170.4 | 172.4 | -177 | 132.3 | 0.8 | 110.4 | M66 F67 K68 R73 V74 | M66-R70 VanDerWaalsContact O-CB 3.27Å; M66-R70 WeakPolarHBondContact O-CB 3.47Å; M66-R70 PolarHBondContact O-N 2.98Å; F67-R70 CarbonylContact O-C 3.58Å; F67-R70 WeakPolarHBondContact O-CA 3.45Å; F67-R70 WeakPolarHBondContact O-CB 3.32Å; F67-R70 PolarHBondContact O-N 3.32Å; K68-R70 VanDerWaalsContact C-N 3.3Å; K68-R70 PolarHBondContact O-N 3.44Å; R70-R73 PolarHBondContact O-N 3.35Å; R70-V74 VanDerWaalsContact O-CG2 3.32Å; R70-V74 WeakPolarHBondContact O-CG2 3.46Å; R70-V74 PolarHBondContact O-N 3.29Å |
| 71 | Q | 87.3 | Confident | 81.9 | Confident | 92 Ų | 92 | 107.1 Ų | 107.1 | 43% | 0.43 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -59 | -49.1 | 173.7 | -171.6 | 180 | 6.7 | 0 | 0 | 111.6 | F67 K68 R73 V74 E75 | F67-Q71 PolarHBondContact O-N 3.06Å; K68-Q71 WeakPolarHBondContact O-CB 3.38Å; K68-Q71 PolarHBondContact O-N 3.5Å; Q71-R73 VanDerWaalsContact C-N 3.31Å; Q71-R73 PolarHBondContact O-N 3.17Å; Q71-V74 CarbonylContact O-C 3.57Å; Q71-V74 WeakPolarHBondContact O-CA 3.26Å; Q71-V74 WeakPolarHBondContact O-CB 3.46Å; Q71-V74 PolarHBondContact O-N 3.28Å; Q71-E75 WeakPolarHBondContact CG-OE1 3.27Å; Q71-E75 PolarHBondContact NE2-OE1 3.08Å; Q71-E75 WeakPolarHBondContact O-CG 3.32Å; Q71-E75 PolarHBondContact O-N 2.8Å |
| 72 | Q | 87 | Confident | 80.6 | Confident | 104 Ų | 104 | 107.7 Ų | 107.7 | 49% | 0.486 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -59.5 | -39.6 | 175.6 | -73.5 | 174.5 | -12.5 | 0 | 0 | 112.8 | K68 V74 K76 | K68-Q72 WeakPolarHBondContact O-CG 3.41Å; K68-Q72 PolarHBondContact O-N 2.95Å; Q72-V74 VanDerWaalsContact C-N 3.3Å; Q72-K76 WeakPolarHBondContact O-CB 3.4Å; Q72-K76 PolarHBondContact O-N 3.42Å |
| 73 | R | 91.8 | Very high | 79.3 | Confident | 153 Ų | 153 | 102 Ų | 102 | 58% | 0.577 | 47% | 0.474 | S | S | * | . | H | α-helix | trans | -65 | -36 | 174.4 | -77.3 | -175.2 | -66.8 | 163.6 | -0.5 | 112 | R69 R70 Q71 F77 | R69-R73 WeakPolarHBondContact O-CB 3.36Å; R69-R73 VanDerWaalsContact O-CG 3.3Å; R69-R73 WeakPolarHBondContact O-CG 3.46Å; R69-R73 PolarHBondContact O-N 3.07Å; R69-R73 VanDerWaalsContact O-N 3.08Å; R69-R73 PolarHBondContact O-NE 2.91Å; R70-R73 PolarHBondContact O-N 3.35Å; Q71-R73 VanDerWaalsContact C-N 3.31Å; Q71-R73 PolarHBondContact O-N 3.17Å; R73-F77 WeakPolarHBondContact O-CB 3.49Å; R73-F77 PolarHBondContact O-N 3.37Å |
| 74 | V | 86.6 | Confident | 77.6 | Confident | 73 Ų | 73 | 105.6 Ų | 105.6 | 44% | 0.442 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -71.1 | -48.1 | 176.8 | 169.8 | 0 | 0 | 0 | 0 | 110.9 | R70 Q71 Q72 K76 F77 I78 | R70-V74 VanDerWaalsContact O-CG2 3.32Å; R70-V74 WeakPolarHBondContact O-CG2 3.46Å; R70-V74 PolarHBondContact O-N 3.29Å; Q71-V74 CarbonylContact O-C 3.57Å; Q71-V74 WeakPolarHBondContact O-CA 3.26Å; Q71-V74 WeakPolarHBondContact O-CB 3.46Å; Q71-V74 PolarHBondContact O-N 3.28Å; Q72-V74 VanDerWaalsContact C-N 3.3Å; V74-K76 VanDerWaalsContact C-N 3.33Å; V74-K76 PolarHBondContact O-N 3.21Å; V74-F77 WeakPolarHBondContact O-CB 3.45Å; V74-F77 PolarHBondContact O-N 2.87Å; V74-F77 VanDerWaalsContact O-N 3.14Å; V74-I78 HydrophobicContact CG1-CD1 3.71Å; V74-I78 HydrophobicContact CG1-CG1 4.37Å; V74-I78 VanDerWaalsContact O-CG1 3.26Å; V74-I78 WeakPolarHBondContact O-CG1 3.48Å; V74-I78 PolarHBondContact O-N 2.81Å |
| 75 | E | 79.7 | Confident | 76 | Confident | 105 Ų | 105 | 110.4 Ų | 110.4 | 49% | 0.491 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -58.5 | -45.4 | 176.1 | -72.6 | 168.5 | -174.5 | 0 | 0 | 111.1 | Q71 I78 Y79 | Q71-E75 WeakPolarHBondContact CG-OE1 3.27Å; Q71-E75 PolarHBondContact NE2-OE1 3.08Å; Q71-E75 WeakPolarHBondContact O-CG 3.32Å; Q71-E75 PolarHBondContact O-N 2.8Å; E75-I78 PolarHBondContact O-N 2.94Å; E75-Y79 WeakPolarHBondContact O-CB 3.46Å; E75-Y79 PolarHBondContact O-N 3.14Å |
| 76 | K | 78.3 | Confident | 74.1 | Confident | 116 Ų | 116 | 115.2 Ų | 115.2 | 50% | 0.504 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -63.7 | -41.2 | 174.5 | -174.9 | 172.5 | -171.9 | -75.5 | 0 | 112.1 | Q72 V74 Y79 E80 | Q72-K76 WeakPolarHBondContact O-CB 3.4Å; Q72-K76 PolarHBondContact O-N 3.42Å; V74-K76 VanDerWaalsContact C-N 3.33Å; V74-K76 PolarHBondContact O-N 3.21Å; K76-Y79 PolarHBondContact O-N 3.33Å; K76-E80 WeakPolarHBondContact CE-OE1 3.17Å; K76-E80 HydrophobicContact CG-CG 4.14Å; K76-E80 WeakPolarHBondContact CG-OE2 3.38Å; K76-E80 IonicContact NZ-OE1 2.76Å; K76-E80 PolarHBondContact NZ-OE1 3.01Å; K76-E80 IonicContact NZ-OE2 3.13Å; K76-E80 PolarHBondContact NZ-OE2 3.41Å; K76-E80 VanDerWaalsContact O-CB 3.23Å; K76-E80 WeakPolarHBondContact O-CB 3.14Å; K76-E80 VanDerWaalsContact O-CG 3.28Å; K76-E80 WeakPolarHBondContact O-CG 3.04Å; K76-E80 PolarHBondContact O-N 3.25Å |
| 77 | F | 77.1 | Confident | 72.5 | Confident | 120 Ų | 120 | 114.2 Ų | 114.2 | 53% | 0.526 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -62.2 | -44.5 | 175.1 | 175.9 | -93.7 | 0 | 0 | 0 | 111.1 | R73 V74 E80 N81 | R73-F77 WeakPolarHBondContact O-CB 3.49Å; R73-F77 PolarHBondContact O-N 3.37Å; V74-F77 WeakPolarHBondContact O-CB 3.45Å; V74-F77 PolarHBondContact O-N 2.87Å; V74-F77 VanDerWaalsContact O-N 3.14Å; F77-E80 PolarHBondContact O-N 3.08Å; F77-N81 HydrophobicContact CD2-CB 4.44Å; F77-N81 WeakPolarHBondContact CD2-ND2 3.3Å; F77-N81 HydrophobicContact CE1-CB 4.35Å; F77-N81 HydrophobicContact CE2-CB 4.13Å; F77-N81 VanDerWaalsContact CE2-ND2 3.3Å; F77-N81 WeakPolarHBondContact CE2-ND2 3.23Å; F77-N81 WeakPolarHBondContact CE2-OD1 3.49Å; F77-N81 HydrophobicContact CZ-CB 4.08Å; F77-N81 WeakPolarHBondContact O-CB 3.28Å; F77-N81 PolarHBondContact O-N 2.92Å; F77-N81 PolarHBondContact O-ND2 2.93Å |
| 78 | I | 73.4 | Confident | 70.9 | Confident | 94 Ų | 94 | 113.7 Ų | 113.7 | 48% | 0.482 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -61.1 | -47.8 | 178 | -68.4 | 165.9 | 0 | 0 | 0 | 110 | V74 E75 N82 | V74-I78 HydrophobicContact CG1-CD1 3.71Å; V74-I78 HydrophobicContact CG1-CG1 4.37Å; V74-I78 VanDerWaalsContact O-CG1 3.26Å; V74-I78 WeakPolarHBondContact O-CG1 3.48Å; V74-I78 PolarHBondContact O-N 2.81Å; E75-I78 PolarHBondContact O-N 2.94Å; I78-N82 WeakPolarHBondContact O-CB 3.45Å; I78-N82 PolarHBondContact O-N 3.45Å; I78-N82 PolarHBondContact O-ND2 3.31Å |
| 79 | Y | 64.3 | Low | 69.4 | Low | 185 Ų | 185 | 115.1 Ų | 115.1 | 73% | 0.725 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -65.5 | -40.8 | 178.1 | -177.5 | -98.1 | 0 | 0 | 0 | 113.7 | E75 K76 | E75-Y79 WeakPolarHBondContact O-CB 3.46Å; E75-Y79 PolarHBondContact O-N 3.14Å; K76-Y79 PolarHBondContact O-N 3.33Å |
| 80 | E | 62.2 | Low | 67.8 | Low | 87 Ų | 87 | 109.9 Ų | 109.9 | 41% | 0.407 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -82.8 | -25.5 | -176.9 | -70 | -179.5 | 159.8 | 0 | 0 | 113.6 | K76 F77 | K76-E80 WeakPolarHBondContact CE-OE1 3.17Å; K76-E80 HydrophobicContact CG-CG 4.14Å; K76-E80 WeakPolarHBondContact CG-OE2 3.38Å; K76-E80 IonicContact NZ-OE1 2.76Å; K76-E80 PolarHBondContact NZ-OE1 3.01Å; K76-E80 IonicContact NZ-OE2 3.13Å; K76-E80 PolarHBondContact NZ-OE2 3.41Å; K76-E80 VanDerWaalsContact O-CB 3.23Å; K76-E80 WeakPolarHBondContact O-CB 3.14Å; K76-E80 VanDerWaalsContact O-CG 3.28Å; K76-E80 WeakPolarHBondContact O-CG 3.04Å; K76-E80 PolarHBondContact O-N 3.25Å; F77-E80 PolarHBondContact O-N 3.08Å |
| 81 | N | 59.3 | Low | 65.9 | Low | 91 Ų | 91 | 106.9 Ų | 106.9 | 49% | 0.487 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -102.4 | -14 | -178.2 | -65.1 | -100 | 0 | 0 | 0 | 112.9 | F77 | F77-N81 HydrophobicContact CD2-CB 4.44Å; F77-N81 WeakPolarHBondContact CD2-ND2 3.3Å; F77-N81 HydrophobicContact CE1-CB 4.35Å; F77-N81 HydrophobicContact CE2-CB 4.13Å; F77-N81 VanDerWaalsContact CE2-ND2 3.3Å; F77-N81 WeakPolarHBondContact CE2-ND2 3.23Å; F77-N81 WeakPolarHBondContact CE2-OD1 3.49Å; F77-N81 HydrophobicContact CZ-CB 4.08Å; F77-N81 WeakPolarHBondContact O-CB 3.28Å; F77-N81 PolarHBondContact O-N 2.92Å; F77-N81 PolarHBondContact O-ND2 2.93Å |
| 82 | N | 58.3 | Low | 64.6 | Low | 98 Ų | 98 | 106.4 Ų | 106.4 | 52% | 0.524 | 54% | 0.537 | S | S | . | . | S | Bend | trans | -126.5 | 87.9 | 166.1 | -53.7 | -92.6 | 0 | 0 | 0 | 106 | I78 D84 | I78-N82 WeakPolarHBondContact O-CB 3.45Å; I78-N82 PolarHBondContact O-N 3.45Å; I78-N82 PolarHBondContact O-ND2 3.31Å; N82-D84 PolarHBondContact O-N 3.36Å |
| 83 | P | 55.7 | Low | 63.1 | Low | 91 Ų | 91 | 106 Ų | 106 | 59% | 0.591 | 54% | 0.538 | S | S | * | . | trans | -57.1 | 115 | 160.9 | 26.8 | -30.6 | 0 | 0 | 0 | 104.4 | V85 | P83-V85 PolarHBondContact O-N 2.88Š| ||
| 84 | D | 51.1 | Low | 61.2 | Low | 112 Ų | 112 | 105.3 Ų | 105.3 | 60% | 0.599 | 54% | 0.54 | S | S | * | . | trans | -41.6 | 115.8 | 179.2 | -114.4 | -31.6 | 0 | 0 | 0 | 107.5 | N82 F86 T87 | N82-D84 PolarHBondContact O-N 3.36Å; D84-F86 PolarHBondContact O-N 2.9Å; D84-T87 HydrophobicContact CB-CG2 4.13Å; D84-T87 PolarHBondContact O-N 2.94Å; D84-T87 PolarHBondContact O-OG1 2.94Å | ||
| 85 | V | 52.4 | Low | 59.9 | Low | 103 Ų | 103 | 108.6 Ų | 108.6 | 62% | 0.624 | 55% | 0.55 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -61.2 | -0.6 | -177.7 | 176 | 0 | 0 | 0 | 0 | 111.1 | P83 | P83-V85 PolarHBondContact O-N 2.88Š|
| 86 | F | 48 | Very low | 58.8 | Low | 184 Ų | 184 | 110 Ų | 110 | 81% | 0.807 | 56% | 0.555 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -114.8 | 14.9 | 177.4 | -58.4 | -76.3 | 0 | 0 | 0 | 114.3 | D84 | D84-F86 PolarHBondContact O-N 2.9Š|
| 87 | T | 55.9 | Low | 57.5 | Low | 75 Ų | 75 | 113.3 Ų | 113.3 | 46% | 0.46 | 57% | 0.569 | S | S | . | * | S | Bend | trans | -72 | 139.5 | 166 | 45.6 | 0 | 0 | 0 | 0 | 110.1 | D84 N89 S90 | D84-T87 HydrophobicContact CB-CG2 4.13Å; D84-T87 PolarHBondContact O-N 2.94Å; D84-T87 PolarHBondContact O-OG1 2.94Å; T87-N89 PolarHBondContact O-N 2.84Å; T87-S90 WeakPolarHBondContact O-CB 3.05Å; T87-S90 PolarHBondContact O-N 3.44Å |
| 88 | S | 55.5 | Low | 56.2 | Low | 94 Ų | 94 | 111.6 Ų | 111.6 | 66% | 0.657 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -52.2 | -23.3 | -168.1 | 53.9 | 0 | 0 | 0 | 0 | 115.7 | ||
| 89 | N | 54.3 | Low | 54.8 | Low | 121 Ų | 121 | 112.5 Ų | 112.5 | 65% | 0.647 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -83.3 | -18.3 | 179.4 | -63.8 | -4.7 | 0 | 0 | 0 | 113.4 | T87 | T87-N89 PolarHBondContact O-N 2.84Å |
| 90 | S | 54.1 | Low | 54.1 | Low | 38 Ų | 38 | 109.2 Ų | 109.2 | 27% | 0.266 | 58% | 0.584 | S | S | . | * | H | α-helix | trans | -79.7 | -28.2 | -179.9 | -175.2 | 0 | 0 | 0 | 0 | 112.9 | T87 D92 D93 F94 | T87-S90 WeakPolarHBondContact O-CB 3.05Å; T87-S90 PolarHBondContact O-N 3.44Å; S90-D92 VanDerWaalsContact C-N 3.27Å; S90-D92 PolarHBondContact O-N 2.84Å; S90-D93 PolarHBondContact O-N 3.44Å; S90-F94 PolarHBondContact O-N 2.95Å |
| 91 | M | 52.8 | Low | 53.3 | Low | 109 Ų | 109 | 113.3 Ų | 113.3 | 54% | 0.537 | 61% | 0.608 | S | S | . | * | H | α-helix | trans | -64.1 | -36.8 | 175.1 | -90.8 | -90.1 | 91 | 0 | 0 | 111.4 | D93 F94 Q95 | M91-D93 VanDerWaalsContact C-N 3.31Å; M91-D93 PolarHBondContact O-N 2.76Å; M91-F94 HydrophobicContact CE-CB 4.34Å; M91-F94 PolarHBondContact O-N 2.91Å; M91-Q95 PolarHBondContact O-N 3.05Å; M91-Q95 VanDerWaalsContact O-N 3.12Å |
| 92 | D | 58.8 | Low | 52.7 | Low | 81 Ų | 81 | 112.4 Ų | 112.4 | 43% | 0.433 | 62% | 0.62 | S | S | . | * | H | α-helix | trans | -65.2 | -34.9 | 178.2 | -70.3 | -24 | 0 | 0 | 0 | 111.8 | S90 K96 | S90-D92 VanDerWaalsContact C-N 3.27Å; S90-D92 PolarHBondContact O-N 2.84Å; D92-K96 WeakPolarHBondContact O-CE 3.49Å; D92-K96 WeakPolarHBondContact O-CG 3.17Å; D92-K96 PolarHBondContact O-NZ 2.63Å |
| 93 | D | 55.6 | Low | 51.6 | Low | 97 Ų | 97 | 110.9 Ų | 110.9 | 52% | 0.519 | 63% | 0.628 | S | S | . | * | H | α-helix | trans | -70.9 | -35.5 | 175.4 | -81.4 | -22.1 | 0 | 0 | 0 | 112.9 | S90 M91 K96 F97 | S90-D93 PolarHBondContact O-N 3.44Å; M91-D93 VanDerWaalsContact C-N 3.31Å; M91-D93 PolarHBondContact O-N 2.76Å; D93-K96 PolarHBondContact O-N 2.81Å; D93-K96 WeakPolarHBondContact OD1-CE 3.3Å; D93-K96 IonicContact OD1-NZ 2.63Å; D93-F97 PolarHBondContact O-N 3.09Å |
| 94 | F | 51.3 | Low | 51.3 | Low | 137 Ų | 137 | 116 Ų | 116 | 60% | 0.601 | 64% | 0.644 | S | S | * | * | H | α-helix | trans | -70.3 | -35.9 | 177 | -142.1 | -97 | 0 | 0 | 0 | 112.1 | S90 M91 K96 F97 V98 | S90-F94 PolarHBondContact O-N 2.95Å; M91-F94 HydrophobicContact CE-CB 4.34Å; M91-F94 PolarHBondContact O-N 2.91Å; F94-K96 VanDerWaalsContact C-N 3.25Å; F94-K96 PolarHBondContact O-N 3.1Å; F94-F97 PolarHBondContact O-N 2.88Å; F94-V98 HydrophobicContact CD1-CG2 4.23Å; F94-V98 HydrophobicContact CE1-CG2 4.29Å; F94-V98 PolarHBondContact O-N 2.9Å |
| 95 | Q | 59.9 | Low | 50.8 | Low | 142 Ų | 142 | 116.9 Ų | 116.9 | 66% | 0.664 | 65% | 0.653 | S | S | * | * | H | α-helix | trans | -66.7 | -23 | 174.7 | -74.3 | -178.3 | -11.1 | 0 | 0 | 113.7 | M91 | M91-Q95 PolarHBondContact O-N 3.05Å; M91-Q95 VanDerWaalsContact O-N 3.12Å |
| 96 | K | 57.3 | Low | 50.3 | Low | 136 Ų | 136 | 114.9 Ų | 114.9 | 59% | 0.591 | 65% | 0.653 | S | S | * | * | H | α-helix | trans | -79.5 | -26.1 | 175.9 | -23.5 | -176.8 | -167.7 | -57.4 | 0 | 112.1 | D92 D93 F94 | D92-K96 WeakPolarHBondContact O-CE 3.49Å; D92-K96 WeakPolarHBondContact O-CG 3.17Å; D92-K96 PolarHBondContact O-NZ 2.63Å; D93-K96 PolarHBondContact O-N 2.81Å; D93-K96 WeakPolarHBondContact OD1-CE 3.3Å; D93-K96 IonicContact OD1-NZ 2.63Å; F94-K96 VanDerWaalsContact C-N 3.25Å; F94-K96 PolarHBondContact O-N 3.1Å |
| 97 | F | 49.9 | Very low | 50.4 | Low | 185 Ų | 185 | 109.9 Ų | 109.9 | 81% | 0.811 | 65% | 0.654 | S | S | * | * | H | α-helix | trans | -95.3 | -12.9 | -174.3 | -105.1 | -83.8 | 0 | 0 | 0 | 114.4 | D93 F94 P99 | D93-F97 PolarHBondContact O-N 3.09Å; F94-F97 PolarHBondContact O-N 2.88Å; F97-P99 WeakPolarHBondContact O-CD 2.88Å |
| 98 | V | 50 | Low | 49.7 | Very low | 84 Ų | 84 | 114.8 Ų | 114.8 | 51% | 0.509 | 67% | 0.671 | S | S | . | * | S | Bend | trans | -96.4 | 111.2 | 169.8 | -178 | 0 | 0 | 0 | 0 | 107.6 | F94 S100 | F94-V98 HydrophobicContact CD1-CG2 4.23Å; F94-V98 HydrophobicContact CE1-CG2 4.29Å; F94-V98 PolarHBondContact O-N 2.9Å; V98-S100 PolarHBondContact O-N 2.96Å |
| 99 | P | 44.4 | Very low | 49 | Very low | 113 Ų | 113 | 119.7 Ų | 119.7 | 73% | 0.734 | 68% | 0.681 | S | S | * | * | trans | -55.9 | 118.2 | 166.5 | -20 | 31.8 | 0 | 0 | 0 | 107.3 | F97 L101 | F97-P99 WeakPolarHBondContact O-CD 2.88Å; P99-L101 PolarHBondContact O-N 2.84Å | ||
| 100 | S | 49.9 | Very low | 48.4 | Very low | 115 Ų | 115 | 121.3 Ų | 121.3 | 80% | 0.804 | 69% | 0.688 | S | S | * | * | trans | -52.2 | 92.9 | 168.8 | -179.6 | 0 | 0 | 0 | 0 | 108.6 | V98 G102 | V98-S100 PolarHBondContact O-N 2.96Å; S100-G102 PolarHBondContact O-N 3.23Å | ||
| 101 | L | 44.5 | Very low | 48.2 | Very low | 173 Ų | 173 | 127.1 Ų | 127.1 | 91% | 0.906 | 72% | 0.716 | S | S | * | * | trans | -79.4 | 105.2 | 159.1 | -164.4 | 71.1 | 0 | 0 | 0 | 104.3 | P99 | P99-L101 PolarHBondContact O-N 2.84Š| ||
| 102 | G | 46.7 | Very low | 47.7 | Very low | 72 Ų | 72 | 128.3 Ų | 128.3 | 74% | 0.742 | 73% | 0.729 | S | S | * | * | S | Bend | trans | -43.7 | 136.7 | -164 | 0 | 0 | 0 | 0 | 0 | 115.5 | S100 | S100-G102 PolarHBondContact O-N 3.23Š|
| 103 | G | 35.2 | Very low | 46.6 | Very low | 66 Ų | 66 | 127.8 Ų | 127.8 | 68% | 0.68 | 74% | 0.743 | S | S | * | * | trans | 175.6 | 85 | 173 | 0 | 0 | 0 | 0 | 0 | 111 | V105 | G103-V105 PolarHBondContact O-N 3.35Å; G103-V105 VanDerWaalsContact O-N 3.1Å | ||
| 104 | Q | 49.6 | Very low | 45.6 | Very low | 200 Ų | 200 | 126 Ų | 126 | 94% | 0.935 | 75% | 0.747 | S | S | * | * | trans | -64.3 | 101.7 | 165.6 | 176.1 | -174.3 | -23 | 0 | 0 | 109.1 | ||||
| 105 | V | 40.4 | Very low | 44.8 | Very low | 130 Ų | 130 | 128.2 Ų | 128.2 | 79% | 0.788 | 76% | 0.759 | S | S | * | * | trans | -148 | 106.8 | 163.7 | -179.7 | 0 | 0 | 0 | 0 | 105.2 | G103 | G103-V105 PolarHBondContact O-N 3.35Å; G103-V105 VanDerWaalsContact O-N 3.1Å | ||
| 106 | G | 42.1 | Very low | 43.7 | Very low | 60 Ų | 60 | 129.1 Ų | 129.1 | 62% | 0.619 | 76% | 0.763 | S | S | * | * | 77.7 | 104.3 | 77.1 | 0 | 0 | 0 | 0 | 0 | 108.2 | Q108 | G106-Q108 PolarHBondContact O-N 3.27Å; G106-Q108 VanDerWaalsContact O-N 3.17Å | |||
| 107 | G | 50 | Low | 43 | Very low | 80 Ų | 80 | 129 Ų | 129 | 83% | 0.825 | 77% | 0.774 | S | S | * | * | trans | -51.4 | 119.5 | -171.5 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 108 | Q | 41.5 | Very low | 42.3 | Very low | 178 Ų | 178 | 125.2 Ų | 125.2 | 83% | 0.832 | 77% | 0.77 | S | S | * | * | trans | -152.8 | 110.2 | 161.3 | -121 | 163.9 | -21.8 | 0 | 0 | 108.8 | G106 I110 | G106-Q108 PolarHBondContact O-N 3.27Å; G106-Q108 VanDerWaalsContact O-N 3.17Å; Q108-I110 PolarHBondContact O-N 3.29Å | ||
| 109 | F | 40.1 | Very low | 42 | Very low | 197 Ų | 197 | 130.5 Ų | 130.5 | 86% | 0.864 | 79% | 0.786 | S | S | * | * | trans | -60.1 | 123.1 | 177 | -53.9 | -86.4 | 0 | 0 | 0 | 109.4 | N111 | F109-N111 PolarHBondContact O-N 3.21Š| ||
| 110 | I | 43.3 | Very low | 41.4 | Very low | 155 Ų | 155 | 133.4 Ų | 133.4 | 80% | 0.795 | 79% | 0.79 | S | S | * | * | trans | -74.8 | 97.2 | 171.1 | -50.8 | 172.3 | 0 | 0 | 0 | 106.6 | Q108 V112 | Q108-I110 PolarHBondContact O-N 3.29Å; I110-V112 HydrophobicContact CG2-CG2 3.86Å; I110-V112 PolarHBondContact O-N 3.33Å; I110-V112 VanDerWaalsContact O-N 3.08Å | ||
| 111 | N | 49.2 | Very low | 40.8 | Very low | 159 Ų | 159 | 133.7 Ų | 133.7 | 85% | 0.85 | 79% | 0.787 | S | S | * | * | trans | -69.9 | 94.3 | 167.4 | -108 | -30.3 | 0 | 0 | 0 | 108.5 | F109 G113 | F109-N111 PolarHBondContact O-N 3.21Å; N111-G113 PolarHBondContact O-N 3.48Å | ||
| 112 | V | 41.6 | Very low | 40.2 | Very low | 134 Ų | 134 | 137.1 Ų | 137.1 | 81% | 0.812 | 79% | 0.788 | S | S | * | * | trans | -84.1 | 90.9 | 165.6 | -179.8 | 0 | 0 | 0 | 0 | 107.2 | I110 G114 | I110-V112 HydrophobicContact CG2-CG2 3.86Å; I110-V112 PolarHBondContact O-N 3.33Å; I110-V112 VanDerWaalsContact O-N 3.08Å; V112-G114 PolarHBondContact O-N 3.36Å | ||
| 113 | G | 36.1 | Very low | 39.7 | Very low | 70 Ų | 70 | 140.6 Ų | 140.6 | 72% | 0.722 | 79% | 0.785 | S | S | * | * | trans | -66 | 123.8 | -176 | 0 | 0 | 0 | 0 | 0 | 113.4 | N111 | N111-G113 PolarHBondContact O-N 3.48Š| ||
| 114 | G | 35.3 | Very low | 39.8 | Very low | 59 Ų | 59 | 145.9 Ų | 145.9 | 61% | 0.608 | 80% | 0.796 | S | S | * | * | trans | -70.4 | 128.8 | 162.3 | 0 | 0 | 0 | 0 | 0 | 111 | V112 H116 | V112-G114 PolarHBondContact O-N 3.36Å; G114-H116 PolarHBondContact O-N 3.12Å; G114-H116 VanDerWaalsContact O-N 3.15Å; G114-H116 PolarHBondContact O-ND1 2.77Å | ||
| 115 | H | 33.9 | Very low | 39.1 | Very low | 185 Ų | 185 | 145.5 Ų | 145.5 | 86% | 0.856 | 79% | 0.788 | S | S | * | * | trans | -60.9 | 107.5 | 173.9 | -171.9 | 56.3 | 0 | 0 | 0 | 110.2 | ||||
| 116 | H | 35.8 | Very low | 38.7 | Very low | 160 Ų | 160 | 147.9 Ų | 147.9 | 74% | 0.741 | 80% | 0.795 | S | S | * | * | trans | -114.8 | 129 | 166.5 | 49.9 | -83.2 | 0 | 0 | 0 | 109.1 | G114 S118 | G114-H116 PolarHBondContact O-N 3.12Å; G114-H116 VanDerWaalsContact O-N 3.15Å; G114-H116 PolarHBondContact O-ND1 2.77Å; H116-S118 PolarHBondContact O-N 3.43Å | ||
| 117 | V | 42.8 | Very low | 38.3 | Very low | 134 Ų | 134 | 147.9 Ų | 147.9 | 81% | 0.812 | 80% | 0.795 | S | S | * | * | trans | -69.4 | 114.9 | 177.6 | -172.8 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 118 | S | 36.3 | Very low | 37.7 | Very low | 106 Ų | 106 | 150.1 Ų | 150.1 | 74% | 0.741 | 80% | 0.798 | S | S | * | * | trans | -139.1 | 124.8 | 163.9 | -167.1 | 0 | 0 | 0 | 0 | 110.2 | H116 | H116-S118 PolarHBondContact O-N 3.43Š| ||
| 119 | K | 44.2 | Very low | 37.7 | Very low | 194 Ų | 194 | 147.3 Ų | 147.3 | 84% | 0.843 | 80% | 0.798 | S | S | * | * | trans | -65.7 | 162.8 | 170.2 | -65.5 | 176.1 | 177.1 | 178 | 0 | 109.4 | ||||
| 120 | E | 31.7 | Very low | 38.1 | Very low | 175 Ų | 175 | 143.4 Ų | 143.4 | 82% | 0.818 | 79% | 0.793 | S | S | * | * | trans | 107.2 | 95.4 | 157.1 | -150.1 | 160.7 | -158.1 | 0 | 0 | 116.8 | ||||
| 121 | T | 36.6 | Very low | 37.8 | Very low | 121 Ų | 121 | 142.6 Ų | 142.6 | 74% | 0.742 | 80% | 0.795 | S | S | * | * | 42.4 | 97.2 | 123.7 | -36.1 | 0 | 0 | 0 | 0 | 117.7 | |||||
| 122 | R | 31.8 | Very low | 37.2 | Very low | 245 Ų | 245 | 143.6 Ų | 143.6 | 93% | 0.925 | 79% | 0.794 | S | S | * | * | -172.1 | 130.2 | 116.1 | -106.2 | 177.6 | -172.3 | -179.4 | 3.5 | 112.7 | |||||
| 123 | H | 35.3 | Very low | 37.2 | Very low | 144 Ų | 144 | 141.2 Ų | 141.2 | 67% | 0.667 | 80% | 0.797 | S | S | * | * | trans | -73.7 | 130.7 | 174.1 | -165 | -100.4 | 0 | 0 | 0 | 110.6 | Y125 | H123-Y125 AromaticContact CE1-CD2 3.17Å; H123-Y125 WeakPolarHBondContact CE1-CD2 3.18Å; H123-Y125 AromaticContact CE1-CE2 3.14Å; H123-Y125 WeakPolarHBondContact CE1-CE2 3.27Å; H123-Y125 AromaticContact ND1-CD2 3.72Å; H123-Y125 AromaticContact NE2-CD2 3.59Å; H123-Y125 AromaticContact NE2-CE2 3.16Å; H123-Y125 WeakPolarHBondContact NE2-CE2 3.43Å | ||
| 124 | L | 38 | Very low | 37.5 | Very low | 177 Ų | 177 | 141.4 Ų | 141.4 | 93% | 0.927 | 80% | 0.799 | S | S | * | * | trans | -147.7 | 117.6 | 146.9 | -88.7 | 176.1 | 0 | 0 | 0 | 108.8 | ||||
| 125 | Y | 35.6 | Very low | 38 | Very low | 192 Ų | 192 | 142.8 Ų | 142.8 | 75% | 0.753 | 81% | 0.805 | S | S | * | * | trans | -68.4 | 142.1 | 178.9 | -98.7 | -127.5 | 0 | 0 | 0 | 112.3 | H123 | H123-Y125 AromaticContact CE1-CD2 3.17Å; H123-Y125 WeakPolarHBondContact CE1-CD2 3.18Å; H123-Y125 AromaticContact CE1-CE2 3.14Å; H123-Y125 WeakPolarHBondContact CE1-CE2 3.27Å; H123-Y125 AromaticContact ND1-CD2 3.72Å; H123-Y125 AromaticContact NE2-CD2 3.59Å; H123-Y125 AromaticContact NE2-CE2 3.16Å; H123-Y125 WeakPolarHBondContact NE2-CE2 3.43Å | ||
| 126 | L | 32.5 | Very low | 38.5 | Very low | 180 Ų | 180 | 140.2 Ų | 140.2 | 94% | 0.942 | 80% | 0.804 | S | S | * | * | trans | -163.2 | 114.1 | 130.1 | -165.6 | 58.3 | 0 | 0 | 0 | 111.8 | ||||
| 127 | G | 32.5 | Very low | 39.6 | Very low | 61 Ų | 61 | 138.8 Ų | 138.8 | 63% | 0.629 | 81% | 0.806 | S | S | * | * | S | Bend | trans | 106.8 | 89.3 | 149.5 | 0 | 0 | 0 | 0 | 0 | 119.1 | ||
| 128 | S | 38.4 | Very low | 40.6 | Very low | 127 Ų | 127 | 137.4 Ų | 137.4 | 89% | 0.888 | 80% | 0.8 | S | S | * | * | trans | 91.2 | 114.7 | 142 | -48.9 | 0 | 0 | 0 | 0 | 120 | ||||
| 129 | S | 41.2 | Very low | 41.9 | Very low | 118 Ų | 118 | 138 Ų | 138 | 83% | 0.825 | 80% | 0.801 | S | S | * | * | trans | -88.4 | -169.9 | 175 | -45.3 | 0 | 0 | 0 | 0 | 112 | ||||
| 130 | P | 47.4 | Very low | 42.5 | Very low | 115 Ų | 115 | 134.9 Ų | 134.9 | 75% | 0.747 | 80% | 0.801 | S | S | * | * | -125.9 | 149.1 | -88.2 | 36.1 | -18.7 | 0 | 0 | 0 | 113 | |||||
| 131 | V | 37.4 | Very low | 43.3 | Very low | 138 Ų | 138 | 136.2 Ų | 136.2 | 84% | 0.836 | 80% | 0.804 | S | S | * | * | trans | -137.3 | 97.7 | 154.4 | -179.9 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 132 | E | 36.5 | Very low | 43.6 | Very low | 181 Ų | 181 | 136.7 Ų | 136.7 | 85% | 0.846 | 81% | 0.809 | S | S | * | * | trans | 49.7 | 108.6 | 133.3 | -138.2 | 164.8 | -171.4 | 0 | 0 | 118.5 | ||||
| 133 | G | 42.7 | Very low | 44 | Very low | 84 Ų | 84 | 128.9 Ų | 128.9 | 87% | 0.866 | 81% | 0.805 | S | S | * | * | trans | -66.7 | 137.5 | 172.9 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 134 | G | 40.8 | Very low | 44.2 | Very low | 74 Ų | 74 | 127.7 Ų | 127.7 | 76% | 0.763 | 81% | 0.813 | S | S | * | * | trans | -148.6 | 129.8 | 165.1 | 0 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 135 | A | 47.3 | Very low | 44.5 | Very low | 88 Ų | 88 | 129.7 Ų | 129.7 | 73% | 0.727 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -59 | 149 | 176.8 | 0 | 0 | 0 | 0 | 0 | 111.7 | V137 | A135-V137 PolarHBondContact O-N 3.15Š|
| 136 | P | 44.4 | Very low | 44.3 | Very low | 130 Ų | 130 | 124 Ų | 124 | 84% | 0.844 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -67.3 | 118.7 | -176.9 | 27.1 | -33.4 | 0 | 0 | 0 | 110.9 | ||
| 137 | V | 58.6 | Low | 44.4 | Very low | 131 Ų | 131 | 120.7 Ų | 120.7 | 79% | 0.794 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -76.5 | 132.3 | 176 | -179.1 | 0 | 0 | 0 | 0 | 109.5 | A135 | A135-V137 PolarHBondContact O-N 3.15Š|
| 138 | P | 64.1 | Low | 44.3 | Very low | 104 Ų | 104 | 121.9 Ų | 121.9 | 68% | 0.675 | 83% | 0.825 | S | S | * | * | P | Polyproline II helix | trans | -71.3 | 151.6 | 177.2 | 29.2 | -34.6 | 0 | 0 | 0 | 112 | ||
| 139 | P | 63 | Low | 43.9 | Very low | 119 Ų | 119 | 119.3 Ų | 119.3 | 77% | 0.773 | 82% | 0.818 | S | S | * | * | P | Polyproline II helix | trans | -67.4 | 144.8 | -178.3 | 27.1 | -34.1 | 0 | 0 | 0 | 112.4 | ||
| 140 | P | 56 | Low | 43.4 | Very low | 129 Ų | 129 | 119.3 Ų | 119.3 | 84% | 0.838 | 83% | 0.825 | S | S | * | * | P | Polyproline II helix | trans | -71.5 | 138.5 | -178.5 | 27.5 | -32.5 | 0 | 0 | 0 | 112.3 | ||
| 141 | K | 49 | Very low | 42.5 | Very low | 202 Ų | 202 | 117.8 Ų | 117.8 | 88% | 0.878 | 83% | 0.831 | S | S | * | * | P | Polyproline II helix | trans | -73.1 | 147 | 176.8 | -78.5 | 176.3 | 178.6 | 167.2 | 0 | 111.7 | ||
| 142 | P | 42.5 | Very low | 42.1 | Very low | 131 Ų | 131 | 115.3 Ų | 115.3 | 85% | 0.851 | 83% | 0.833 | S | S | * | * | S | Bend | trans | -82.9 | 131.2 | -177.9 | 29.9 | -26.2 | 0 | 0 | 0 | 111.8 | ||
| 143 | G | 41.4 | Very low | 42 | Very low | 81 Ų | 81 | 111.9 Ų | 111.9 | 84% | 0.835 | 84% | 0.836 | S | S | * | * | trans | 103.6 | 91.8 | 160.4 | 0 | 0 | 0 | 0 | 0 | 116.1 | ||||
| 144 | S | 40 | Very low | 41.3 | Very low | 120 Ų | 120 | 112 Ų | 112 | 84% | 0.839 | 84% | 0.837 | S | S | * | * | trans | -160.9 | 106.2 | 148.4 | 177.7 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 145 | K | 42.6 | Very low | 40.7 | Very low | 218 Ų | 218 | 112.1 Ų | 112.1 | 95% | 0.948 | 84% | 0.838 | S | S | * | * | trans | -82.5 | 126.9 | 168.6 | -76.3 | -178.4 | 174.8 | 179.9 | 0 | 107.8 | ||||
| 146 | G | 33.2 | Very low | 40.1 | Very low | 72 Ų | 72 | 113.2 Ų | 113.2 | 74% | 0.742 | 85% | 0.847 | S | S | * | * | trans | -172.9 | 84.4 | 174.7 | 0 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 147 | A | 33.7 | Very low | 39.2 | Very low | 112 Ų | 112 | 110.8 Ų | 110.8 | 93% | 0.926 | 85% | 0.846 | S | S | * | * | trans | 55.3 | 128 | 144.8 | 0 | 0 | 0 | 0 | 0 | 123.1 | ||||
| 148 | G | 29.8 | Very low | 37.8 | Very low | 86 Ų | 86 | 108.7 Ų | 108.7 | 89% | 0.887 | 85% | 0.851 | S | S | * | * | trans | 118.3 | 121.1 | 152.6 | 0 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 149 | G | 30.8 | Very low | 36.2 | Very low | 72 Ų | 72 | 108.9 Ų | 108.9 | 74% | 0.742 | 86% | 0.861 | S | S | * | * | cis | 177.5 | 170.8 | 3.1 | 0 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 150 | A | 30.6 | Very low | 34.5 | Very low | 118 Ų | 118 | 106.9 Ų | 106.9 | 98% | 0.975 | 86% | 0.862 | S | S | * | * | trans | 64.9 | 136.2 | 171.5 | 0 | 0 | 0 | 0 | 0 | 117 | ||||
| 151 | G | 28.6 | Very low | 33.2 | Very low | 83 Ų | 83 | 110.1 Ų | 110.1 | 86% | 0.856 | 87% | 0.866 | S | S | * | * | cis | 174.3 | 150.2 | 5.7 | 0 | 0 | 0 | 0 | 0 | 106.7 | ||||
| 152 | G | 29.4 | Very low | 32.2 | Very low | 87 Ų | 87 | 104.2 Ų | 104.2 | 90% | 0.897 | 86% | 0.862 | S | S | * | * | trans | 168.5 | 97.4 | 177.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 153 | A | 32.7 | Very low | 31.4 | Very low | 109 Ų | 109 | 101.8 Ų | 101.8 | 90% | 0.901 | 86% | 0.862 | S | S | * | * | trans | -96.6 | 150.8 | 179.1 | 0 | 0 | 0 | 0 | 0 | 112 | ||||
| 154 | G | 29.3 | Very low | 30.8 | Very low | 85 Ų | 85 | 106.5 Ų | 106.5 | 88% | 0.876 | 87% | 0.867 | S | S | * | * | trans | 107.5 | 123.3 | 162.4 | 0 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 155 | G | 28.5 | Very low | 30.3 | Very low | 77 Ų | 77 | 105.5 Ų | 105.5 | 79% | 0.794 | 87% | 0.865 | S | S | * | * | cis | -170.9 | 173.7 | 8.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 156 | A | 33.1 | Very low | 29.7 | Very low | 112 Ų | 112 | 98.5 Ų | 98.5 | 93% | 0.926 | 86% | 0.855 | S | S | * | * | trans | -50.9 | 162.7 | -179 | 0 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 157 | G | 27.3 | Very low | 29.6 | Very low | 79 Ų | 79 | 101.7 Ų | 101.7 | 81% | 0.814 | 86% | 0.86 | S | S | * | * | cis | 157.4 | 158.7 | 13.2 | 0 | 0 | 0 | 0 | 0 | 107.4 | ||||
| 158 | G | 27.5 | Very low | 29.4 | Very low | 87 Ų | 87 | 104.7 Ų | 104.7 | 90% | 0.897 | 86% | 0.855 | S | S | * | * | trans | 159.5 | 118.2 | 172.5 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 159 | A | 31.4 | Very low | 29.5 | Very low | 107 Ų | 107 | 104.3 Ų | 104.3 | 88% | 0.884 | 85% | 0.851 | S | S | * | * | trans | -108.8 | 167.2 | -167.4 | 0 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 160 | G | 27.7 | Very low | 29.8 | Very low | 77 Ų | 77 | 108.7 Ų | 108.7 | 79% | 0.794 | 86% | 0.855 | S | S | * | * | trans | 93.8 | 145.4 | 158.2 | 0 | 0 | 0 | 0 | 0 | 115.2 | ||||
| 161 | E | 27.2 | Very low | 29.8 | Very low | 197 Ų | 197 | 112.7 Ų | 112.7 | 92% | 0.921 | 85% | 0.851 | S | S | * | * | cis | -175.1 | 149.4 | -6 | 171.3 | 177.5 | 161.3 | 0 | 0 | 106.5 | ||||
| 162 | G | 28.1 | Very low | 30 | Very low | 78 Ų | 78 | 112.6 Ų | 112.6 | 80% | 0.804 | 85% | 0.85 | S | S | * | * | trans | 96.9 | 122.3 | 146.9 | 0 | 0 | 0 | 0 | 0 | 118.8 | ||||
| 163 | G | 25.6 | Very low | 30.1 | Very low | 81 Ų | 81 | 116.3 Ų | 116.3 | 84% | 0.835 | 84% | 0.844 | S | S | * | * | trans | 153.4 | 88.7 | 158.1 | 0 | 0 | 0 | 0 | 0 | 115.9 | ||||
| 164 | L | 30.2 | Very low | 30.2 | Very low | 180 Ų | 180 | 115.1 Ų | 115.1 | 94% | 0.942 | 84% | 0.842 | S | S | * | * | trans | -64 | 137.3 | 176.4 | -55.9 | 153.4 | 0 | 0 | 0 | 112.3 | ||||
| 165 | A | 29 | Very low | 30.3 | Very low | 98 Ų | 98 | 116 Ų | 116 | 81% | 0.81 | 83% | 0.831 | S | S | * | * | trans | -171.4 | 117.6 | 143.3 | 0 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 166 | G | 30.2 | Very low | 30.4 | Very low | 72 Ų | 72 | 123.6 Ų | 123.6 | 74% | 0.742 | 84% | 0.836 | S | S | * | * | trans | -67.5 | 157.9 | 165.4 | 0 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 167 | V | 31.5 | Very low | 30.7 | Very low | 138 Ų | 138 | 123.4 Ų | 123.4 | 84% | 0.836 | 83% | 0.827 | S | S | * | * | 174.9 | 133.6 | 128.5 | 154 | 0 | 0 | 0 | 0 | 108.9 | |||||
| 168 | E | 28.8 | Very low | 31.1 | Very low | 176 Ų | 176 | 124.7 Ų | 124.7 | 82% | 0.822 | 82% | 0.824 | S | S | * | * | trans | -7.3 | 155 | 161.3 | -69.6 | 179.2 | 122.4 | 0 | 0 | 121.9 | ||||
| 169 | G | 32.8 | Very low | 31.6 | Very low | 77 Ų | 77 | 126 Ų | 126 | 79% | 0.794 | 82% | 0.819 | S | S | * | * | trans | -57.2 | 138.1 | -175.8 | 0 | 0 | 0 | 0 | 0 | 115.4 | K171 | G169-K171 PolarHBondContact O-N 3.16Š| ||
| 170 | I | 35.5 | Very low | 31.8 | Very low | 164 Ų | 164 | 131.2 Ų | 131.2 | 84% | 0.841 | 82% | 0.822 | S | S | * | * | trans | -90.7 | 98 | 177.1 | -60.6 | -178.6 | 0 | 0 | 0 | 108.8 | G172 | I170-G172 PolarHBondContact O-N 3.15Š| ||
| 171 | K | 32.2 | Very low | 32 | Very low | 202 Ų | 202 | 131 Ų | 131 | 88% | 0.878 | 82% | 0.821 | S | S | * | * | trans | -63.9 | 117.2 | 148.9 | -96.4 | 176.7 | 173.1 | 174.4 | 0 | 107.2 | G169 E173 | G169-K171 PolarHBondContact O-N 3.16Å; K171-E173 PolarHBondContact O-N 2.79Å | ||
| 172 | G | 31.8 | Very low | 32.7 | Very low | 81 Ų | 81 | 127 Ų | 127 | 84% | 0.835 | 82% | 0.82 | S | S | * | * | trans | -68.4 | 99.1 | 170 | 0 | 0 | 0 | 0 | 0 | 110.3 | I170 | I170-G172 PolarHBondContact O-N 3.15Š| ||
| 173 | E | 31.9 | Very low | 33 | Very low | 165 Ų | 165 | 126.6 Ų | 126.6 | 77% | 0.771 | 82% | 0.817 | S | S | * | * | trans | -93.5 | 108.4 | 166.2 | -140 | -155.7 | -154.9 | 0 | 0 | 108.5 | K171 T175 | K171-E173 PolarHBondContact O-N 2.79Å; E173-T175 PolarHBondContact O-N 2.81Å; E173-T175 PolarHBondContact OE2-OG1 3.03Å | ||
| 174 | G | 33.7 | Very low | 34.1 | Very low | 84 Ų | 84 | 132.2 Ų | 132.2 | 87% | 0.866 | 82% | 0.818 | S | S | * | * | trans | -89.1 | 82.2 | 170.1 | 0 | 0 | 0 | 0 | 0 | 109.7 | W176 | G174-W176 PolarHBondContact O-N 3.14Š| ||
| 175 | T | 32.3 | Very low | 34.6 | Very low | 105 Ų | 105 | 131.2 Ų | 131.2 | 64% | 0.644 | 81% | 0.814 | S | S | * | * | trans | -82.4 | 109.1 | 173.4 | -72.8 | 0 | 0 | 0 | 0 | 109.3 | E173 | E173-T175 PolarHBondContact O-N 2.81Å; E173-T175 PolarHBondContact OE2-OG1 3.03Å | ||
| 176 | W | 31.1 | Very low | 35.6 | Very low | 235 Ų | 235 | 130 Ų | 130 | 89% | 0.89 | 81% | 0.811 | S | S | * | * | trans | -88.6 | 110.6 | 171.4 | -178.7 | -92.4 | 0 | 0 | 0 | 110.1 | G174 | G174-W176 PolarHBondContact O-N 3.14Š| ||
| 177 | S | 39 | Very low | 36.3 | Very low | 108 Ų | 108 | 136.1 Ų | 136.1 | 76% | 0.755 | 82% | 0.817 | S | S | * | * | P | Polyproline II helix | trans | -74.7 | 117 | 174.7 | 48.1 | 0 | 0 | 0 | 0 | 111.3 | ||
| 178 | S | 36.2 | Very low | 37 | Very low | 106 Ų | 106 | 133.5 Ų | 133.5 | 74% | 0.741 | 82% | 0.818 | S | S | * | * | P | Polyproline II helix | trans | -101 | 134.3 | 166.8 | -168.8 | 0 | 0 | 0 | 0 | 110.8 | ||
| 179 | S | 37.3 | Very low | 38.3 | Very low | 114 Ų | 114 | 134.4 Ų | 134.4 | 80% | 0.797 | 82% | 0.82 | S | S | * | * | P | Polyproline II helix | trans | -50.8 | 139.2 | -172.4 | 43.3 | 0 | 0 | 0 | 0 | 115.9 | G181 | S179-G181 PolarHBondContact O-N 3.5Š|
| 180 | K | 36.5 | Very low | 39.2 | Very low | 217 Ų | 217 | 138.5 Ų | 138.5 | 94% | 0.943 | 82% | 0.82 | S | S | * | * | trans | -65.1 | 113.3 | 173.9 | -172.3 | 169.4 | -177.2 | 174 | 0 | 111.1 | ||||
| 181 | G | 30.9 | Very low | 40.2 | Very low | 74 Ų | 74 | 137.8 Ų | 137.8 | 76% | 0.763 | 82% | 0.817 | S | S | * | * | trans | -132.1 | 111.1 | 165.8 | 0 | 0 | 0 | 0 | 0 | 108.9 | S179 | S179-G181 PolarHBondContact O-N 3.5Š| ||
| 182 | A | 41.6 | Very low | 41.4 | Very low | 111 Ų | 111 | 133 Ų | 133 | 92% | 0.917 | 80% | 0.804 | S | S | * | * | trans | -74.5 | 127.4 | 179.8 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 183 | G | 35.1 | Very low | 42.7 | Very low | 70 Ų | 70 | 134.6 Ų | 134.6 | 72% | 0.722 | 80% | 0.798 | S | S | * | * | trans | -163.3 | 107.8 | 167.8 | 0 | 0 | 0 | 0 | 0 | 108.4 | D185 | G183-D185 PolarHBondContact O-N 3.18Š| ||
| 184 | K | 48.6 | Very low | 44 | Very low | 199 Ų | 199 | 129.5 Ų | 129.5 | 87% | 0.865 | 78% | 0.784 | S | S | * | * | trans | -57.9 | 130.8 | 166.1 | -90.3 | 172.4 | 166.3 | 175.9 | 0 | 107.7 | ||||
| 185 | D | 41.6 | Very low | 45.8 | Very low | 159 Ų | 159 | 135.6 Ų | 135.6 | 85% | 0.85 | 79% | 0.786 | S | S | * | * | 172 | 144.4 | 127.6 | -74.7 | -21.5 | 0 | 0 | 0 | 109.1 | G183 | G183-D185 PolarHBondContact O-N 3.18Š| |||
| 186 | G | 49.8 | Very low | 48 | Very low | 74 Ų | 74 | 135.6 Ų | 135.6 | 76% | 0.763 | 79% | 0.786 | S | S | * | * | trans | -62 | 172.4 | -160.5 | 0 | 0 | 0 | 0 | 0 | 117 | ||||
| 187 | K | 43.5 | Very low | 50.4 | Low | 200 Ų | 200 | 133.1 Ų | 133.1 | 87% | 0.87 | 78% | 0.778 | S | S | * | * | trans | 92 | 85 | -174.7 | -53.8 | -172.1 | -173.8 | -172.8 | 0 | 112.5 | K189 | K187-K189 PolarHBondContact O-N 3.35Š| ||
| 188 | G | 46.1 | Very low | 52.3 | Low | 83 Ų | 83 | 133.7 Ų | 133.7 | 86% | 0.856 | 77% | 0.771 | S | S | * | * | trans | -51.3 | 109.2 | 164.5 | 0 | 0 | 0 | 0 | 0 | 109.1 | M190 | G188-M190 VanDerWaalsContact C-N 3.35Å; G188-M190 PolarHBondContact O-N 2.74Å | ||
| 189 | K | 57.4 | Low | 54.5 | Low | 195 Ų | 195 | 129.9 Ų | 129.9 | 85% | 0.848 | 75% | 0.745 | S | S | * | * | trans | -65.9 | 103.1 | 167.8 | -63.9 | 178.1 | -176 | 176.7 | 0 | 105.1 | K187 L191 | K187-K189 PolarHBondContact O-N 3.35Å; K189-L191 VanDerWaalsContact C-N 3.28Å; K189-L191 PolarHBondContact O-N 2.74Å | ||
| 190 | M | 50.8 | Low | 56.7 | Low | 162 Ų | 162 | 128.4 Ų | 128.4 | 80% | 0.798 | 73% | 0.733 | S | S | * | * | trans | -55.8 | 99.5 | 166.9 | 179.9 | 170 | 126.4 | 0 | 0 | 106.1 | G188 V192 | G188-M190 VanDerWaalsContact C-N 3.35Å; G188-M190 PolarHBondContact O-N 2.74Å; M190-V192 HydrophobicContact CE-CG2 3.41Å; M190-V192 VanDerWaalsContact CE-CG2 3.41Å; M190-V192 HydrophobicContact CG-CG2 3.94Å; M190-V192 PolarHBondContact O-N 3.02Å; M190-V192 HydrophobicContact SD-CG2 4.48Å | ||
| 191 | L | 58 | Low | 58.8 | Low | 149 Ų | 149 | 126.7 Ų | 126.7 | 78% | 0.78 | 72% | 0.72 | S | S | * | * | trans | -70.8 | 90.5 | 172.6 | -144.3 | 96.6 | 0 | 0 | 0 | 104.8 | K189 V193 | K189-L191 VanDerWaalsContact C-N 3.28Å; K189-L191 PolarHBondContact O-N 2.74Å; L191-V193 HydrophobicContact CD2-CG2 4.22Å; L191-V193 PolarHBondContact O-N 3.47Å | ||
| 192 | V | 55.6 | Low | 61.2 | Low | 101 Ų | 101 | 127.4 Ų | 127.4 | 61% | 0.612 | 70% | 0.704 | S | S | * | * | trans | -67.5 | 90.4 | 171.7 | -176 | 0 | 0 | 0 | 0 | 105.6 | M190 A194 | M190-V192 HydrophobicContact CE-CG2 3.41Å; M190-V192 VanDerWaalsContact CE-CG2 3.41Å; M190-V192 HydrophobicContact CG-CG2 3.94Å; M190-V192 PolarHBondContact O-N 3.02Å; M190-V192 HydrophobicContact SD-CG2 4.48Å; V192-A194 PolarHBondContact O-N 3.33Å | ||
| 193 | V | 60 | Low | 63.2 | Low | 116 Ų | 116 | 130.4 Ų | 130.4 | 70% | 0.703 | 70% | 0.696 | S | S | * | * | trans | -68.3 | 84.1 | 162.5 | -179.3 | 0 | 0 | 0 | 0 | 104.9 | L191 K195 | L191-V193 HydrophobicContact CD2-CG2 4.22Å; L191-V193 PolarHBondContact O-N 3.47Å; V193-K195 PolarHBondContact O-N 3.35Å; V193-K195 VanDerWaalsContact O-N 3.1Å | ||
| 194 | A | 60.2 | Low | 65.5 | Low | 58 Ų | 58 | 130 Ų | 130 | 48% | 0.479 | 69% | 0.686 | S | S | . | * | trans | -57.4 | 118.6 | 167.3 | 0 | 0 | 0 | 0 | 0 | 105.5 | V192 T196 | V192-A194 PolarHBondContact O-N 3.33Å; A194-T196 HydrophobicContact CB-CG2 4.1Å; A194-T196 PolarHBondContact O-N 3.33Å | ||
| 195 | K | 71.4 | Confident | 67.2 | Low | 211 Ų | 211 | 122 Ų | 122 | 92% | 0.917 | 65% | 0.652 | S | S | * | * | trans | -65.4 | 81.5 | 163.8 | -79.5 | 171.4 | 175.6 | 168.3 | 0 | 106 | V193 | V193-K195 PolarHBondContact O-N 3.35Å; V193-K195 VanDerWaalsContact O-N 3.1Å | ||
| 196 | T | 77.6 | Confident | 69.2 | Low | 105 Ų | 105 | 123 Ų | 123 | 64% | 0.644 | 65% | 0.649 | S | S | * | * | P | Polyproline II helix | trans | -67.3 | 133.7 | 173.6 | 46.2 | 0 | 0 | 0 | 0 | 106.8 | A194 I198 | A194-T196 HydrophobicContact CB-CG2 4.1Å; A194-T196 PolarHBondContact O-N 3.33Å; T196-I198 PolarHBondContact O-N 3.23Å; T196-I198 VanDerWaalsContact O-N 3.15Å |
| 197 | Y | 81.5 | Confident | 70.7 | Confident | 184 Ų | 184 | 121.7 Ų | 121.7 | 72% | 0.722 | 64% | 0.636 | S | S | * | * | P | Polyproline II helix | trans | -56.3 | 121.9 | 172 | 171.2 | -97.3 | 0 | 0 | 0 | 108.2 | P200 | Y197-P200 WeakPolarHBondContact OH-CD 3.25Š|
| 198 | I | 78.3 | Confident | 72.8 | Confident | 119 Ų | 119 | 116.5 Ų | 116.5 | 61% | 0.61 | 62% | 0.617 | S | S | * | * | P | Polyproline II helix | trans | -98.2 | 123.9 | 171.3 | -63.8 | 172.3 | 0 | 0 | 0 | 105.6 | T196 E202 | T196-I198 PolarHBondContact O-N 3.23Å; T196-I198 VanDerWaalsContact O-N 3.15Å; I198-E202 HydrophobicContact CG2-CB 4.43Å; I198-E202 WeakPolarHBondContact CG2-OE2 2.8Å |
| 199 | S | 81.9 | Confident | 74.6 | Confident | 27 Ų | 27 | 120.6 Ų | 120.6 | 19% | 0.189 | 61% | 0.614 | C | S | . | * | P | Polyproline II helix | trans | -65.9 | 131.3 | -179 | 179.1 | 0 | 0 | 0 | 0 | 109.1 | W201 E202 | S199-W201 PolarHBondContact O-N 3.35Å; S199-W201 PolarHBondContact OG-N 2.84Å; S199-E202 PolarHBondContact N-OE2 3.08Å; S199-E202 WeakPolarHBondContact O-CB 3.49Å; S199-E202 PolarHBondContact O-N 2.99Å |
| 200 | P | 84.2 | Confident | 76 | Confident | 83 Ų | 83 | 114.1 Ų | 114.1 | 54% | 0.539 | 60% | 0.603 | S | S | . | * | H | α-helix | trans | -53.5 | -26.1 | 173.1 | -27.5 | 35.3 | 0 | 0 | 0 | 113 | Y197 K203 A204 | Y197-P200 WeakPolarHBondContact OH-CD 3.25Å; P200-K203 PolarHBondContact O-N 3.01Å; P200-A204 PolarHBondContact O-N 2.96Å |
| 201 | W | 80.9 | Confident | 77.5 | Confident | 180 Ų | 180 | 110.2 Ų | 110.2 | 68% | 0.682 | 59% | 0.585 | S | S | * | * | H | α-helix | trans | -68.5 | -34.2 | 174.9 | -64.1 | 103 | 0 | 0 | 0 | 113.3 | S199 K203 A204 M205 | S199-W201 PolarHBondContact O-N 3.35Å; S199-W201 PolarHBondContact OG-N 2.84Å; W201-K203 VanDerWaalsContact C-N 3.29Å; W201-K203 PolarHBondContact O-N 3.14Å; W201-A204 PolarHBondContact O-N 3.21Å; W201-M205 WeakPolarHBondContact O-CB 3.17Å; W201-M205 VanDerWaalsContact O-CG 3.26Å; W201-M205 WeakPolarHBondContact O-CG 3.09Å; W201-M205 PolarHBondContact O-N 3.24Å |
| 202 | E | 82.3 | Confident | 78.6 | Confident | 89 Ų | 89 | 106.7 Ų | 106.7 | 42% | 0.416 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -63.7 | -38.3 | 173.8 | -68.3 | 165.5 | 161.6 | 0 | 0 | 110.6 | I198 S199 | I198-E202 HydrophobicContact CG2-CB 4.43Å; I198-E202 WeakPolarHBondContact CG2-OE2 2.8Å; S199-E202 PolarHBondContact N-OE2 3.08Å; S199-E202 WeakPolarHBondContact O-CB 3.49Å; S199-E202 PolarHBondContact O-N 2.99Å |
| 203 | K | 82.8 | Confident | 79.9 | Confident | 175 Ų | 175 | 106 Ų | 106 | 76% | 0.761 | 57% | 0.571 | S | S | * | * | H | α-helix | trans | -71 | -32.1 | 175.1 | -169.9 | 173.3 | -178.1 | 176.6 | 0 | 112.7 | P200 W201 | P200-K203 PolarHBondContact O-N 3.01Å; W201-K203 VanDerWaalsContact C-N 3.29Å; W201-K203 PolarHBondContact O-N 3.14Å |
| 204 | A | 82.4 | Confident | 80.9 | Confident | 62 Ų | 62 | 104.9 Ų | 104.9 | 51% | 0.512 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -74.5 | -34.1 | 178.7 | 0 | 0 | 0 | 0 | 0 | 112.8 | P200 W201 K206 | P200-A204 PolarHBondContact O-N 2.96Å; W201-A204 PolarHBondContact O-N 3.21Å; A204-K206 VanDerWaalsContact C-N 3.28Å; A204-K206 PolarHBondContact O-N 3.13Å |
| 205 | M | 85.8 | Confident | 82 | Confident | 30 Ų | 30 | 106 Ų | 106 | 15% | 0.148 | 56% | 0.562 | C | S | . | * | S | Bend | trans | -74.7 | -11.7 | 179.3 | -70.4 | 173.5 | -178.9 | 0 | 0 | 113.7 | W201 G207 D208 L211 L212 | W201-M205 WeakPolarHBondContact O-CB 3.17Å; W201-M205 VanDerWaalsContact O-CG 3.26Å; W201-M205 WeakPolarHBondContact O-CG 3.09Å; W201-M205 PolarHBondContact O-N 3.24Å; M205-G207 PolarHBondContact O-N 3.17Å; M205-D208 VanDerWaalsContact O-CB 3.28Å; M205-D208 WeakPolarHBondContact O-CB 2.96Å; M205-D208 PolarHBondContact O-N 2.81Å; M205-L211 HydrophobicContact CB-CB 4.45Å; M205-L211 HydrophobicContact CG-CB 4.04Å; M205-L211 HydrophobicContact CG-CD1 4.23Å; M205-L211 HydrophobicContact SD-CB 4.19Å; M205-L212 HydrophobicContact SD-CD2 4.45Å |
| 206 | K | 82.8 | Confident | 82.2 | Confident | 180 Ų | 180 | 104.3 Ų | 104.3 | 78% | 0.783 | 56% | 0.555 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 49 | 22.3 | 169.5 | -68.5 | 175.7 | 177.7 | -75.1 | 0 | 116.7 | A204 | A204-K206 VanDerWaalsContact C-N 3.28Å; A204-K206 PolarHBondContact O-N 3.13Å |
| 207 | G | 80.5 | Confident | 82.1 | Confident | 47 Ų | 47 | 104.8 Ų | 104.8 | 49% | 0.485 | 56% | 0.562 | S | S | . | * | T | Hydrogen-bonded Turn | trans | 85.9 | 9.9 | -176.4 | 0 | 0 | 0 | 0 | 0 | 114.9 | M205 E209 | M205-G207 PolarHBondContact O-N 3.17Å; G207-E209 PolarHBondContact O-N 3.13Å |
| 208 | D | 87.7 | Confident | 81.8 | Confident | 90 Ų | 90 | 103.5 Ų | 103.5 | 48% | 0.481 | 56% | 0.563 | S | S | . | * | trans | -62.6 | 107 | 176.9 | -70.6 | -22.9 | 0 | 0 | 0 | 110.2 | M205 G210 L211 L212 | M205-D208 VanDerWaalsContact O-CB 3.28Å; M205-D208 WeakPolarHBondContact O-CB 2.96Å; M205-D208 PolarHBondContact O-N 2.81Å; D208-G210 PolarHBondContact O-N 3.43Å; D208-L211 HydrophobicContact CB-CB 4.24Å; D208-L211 HydrophobicContact CB-CD1 4.13Å; D208-L211 HydrophobicContact CB-CG 4.28Å; D208-L211 PolarHBondContact O-N 3.12Å; D208-L212 WeakPolarHBondContact O-CG 3.21Å; D208-L212 PolarHBondContact O-N 3.47Å | ||
| 209 | E | 85.1 | Confident | 81.8 | Confident | 170 Ų | 170 | 105.8 Ų | 105.8 | 79% | 0.794 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -57.8 | -35.9 | -173 | -63 | -176.4 | 170.3 | 0 | 0 | 112.6 | G207 L211 A213 | G207-E209 PolarHBondContact O-N 3.13Å; E209-L211 PolarHBondContact O-N 2.97Å; E209-A213 WeakPolarHBondContact O-CB 3.47Å; E209-A213 PolarHBondContact O-N 3.14Å |
| 210 | G | 87.1 | Confident | 81.6 | Confident | 58 Ų | 58 | 109.9 Ų | 109.9 | 60% | 0.598 | 60% | 0.599 | S | S | * | * | H | α-helix | trans | -66.3 | -34.6 | 177.1 | 0 | 0 | 0 | 0 | 0 | 113.7 | D208 | D208-G210 PolarHBondContact O-N 3.43Å |
| 211 | L | 80.9 | Confident | 81.4 | Confident | 81 Ų | 81 | 108.4 Ų | 108.4 | 42% | 0.424 | 60% | 0.598 | S | S | . | * | H | α-helix | trans | -82.5 | -39.5 | 178 | -67.6 | 177.1 | 0 | 0 | 0 | 111.2 | M205 D208 E209 A213 T214 L215 | M205-L211 HydrophobicContact CB-CB 4.45Å; M205-L211 HydrophobicContact CG-CB 4.04Å; M205-L211 HydrophobicContact CG-CD1 4.23Å; M205-L211 HydrophobicContact SD-CB 4.19Å; D208-L211 HydrophobicContact CB-CB 4.24Å; D208-L211 HydrophobicContact CB-CD1 4.13Å; D208-L211 HydrophobicContact CB-CG 4.28Å; D208-L211 PolarHBondContact O-N 3.12Å; E209-L211 PolarHBondContact O-N 2.97Å; L211-A213 VanDerWaalsContact C-N 3.26Å; L211-A213 PolarHBondContact O-N 3.18Å; L211-T214 PolarHBondContact O-N 3.04Å; L211-T214 PolarHBondContact O-OG1 3.41Å; L211-L215 PolarHBondContact O-N 3.32Å |
| 212 | L | 82.1 | Confident | 81.4 | Confident | 74 Ų | 74 | 106.1 Ų | 106.1 | 39% | 0.387 | 61% | 0.607 | S | S | . | * | H | α-helix | trans | -59.5 | -37.3 | 175.2 | -70.2 | 178.5 | 0 | 0 | 0 | 112.1 | M205 D208 T214 L215 | M205-L212 HydrophobicContact SD-CD2 4.45Å; D208-L212 WeakPolarHBondContact O-CG 3.21Å; D208-L212 PolarHBondContact O-N 3.47Å; L212-T214 PolarHBondContact O-N 3.36Å; L212-L215 VanDerWaalsContact O-CB 3.29Å; L212-L215 WeakPolarHBondContact O-CB 3.17Å; L212-L215 PolarHBondContact O-N 3.19Å |
| 213 | A | 81.8 | Confident | 81.1 | Confident | 86 Ų | 86 | 109.3 Ų | 109.3 | 71% | 0.711 | 63% | 0.625 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62.5 | -23.3 | 175.2 | 0 | 0 | 0 | 0 | 0 | 113.7 | E209 L211 | E209-A213 WeakPolarHBondContact O-CB 3.47Å; E209-A213 PolarHBondContact O-N 3.14Å; L211-A213 VanDerWaalsContact C-N 3.26Å; L211-A213 PolarHBondContact O-N 3.18Å |
| 214 | T | 82.7 | Confident | 80.8 | Confident | 93 Ų | 93 | 109 Ų | 109 | 57% | 0.571 | 63% | 0.626 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86 | -13.3 | 176.7 | 69.9 | 0 | 0 | 0 | 0 | 113.3 | L211 L212 K216 | L211-T214 PolarHBondContact O-N 3.04Å; L211-T214 PolarHBondContact O-OG1 3.41Å; L212-T214 PolarHBondContact O-N 3.36Å; T214-K216 PolarHBondContact O-N 3.38Å; T214-K216 VanDerWaalsContact O-N 3.11Å |
| 215 | L | 81.9 | Confident | 80.2 | Confident | 82 Ų | 82 | 117.6 Ų | 117.6 | 43% | 0.429 | 65% | 0.646 | S | S | . | * | trans | -70 | 109.2 | 179.6 | -172.1 | 72.3 | 0 | 0 | 0 | 109.2 | L211 L212 S217 | L211-L215 PolarHBondContact O-N 3.32Å; L212-L215 VanDerWaalsContact O-CB 3.29Å; L212-L215 WeakPolarHBondContact O-CB 3.17Å; L212-L215 PolarHBondContact O-N 3.19Å; L215-S217 PolarHBondContact O-N 2.91Å | ||
| 216 | K | 75.8 | Confident | 79.8 | Confident | 175 Ų | 175 | 124.6 Ų | 124.6 | 76% | 0.761 | 68% | 0.675 | S | S | * | * | trans | -80.9 | 108.8 | 170.6 | -63.5 | -178.1 | -178.7 | 179.3 | 0 | 107.9 | T214 E218 | T214-K216 PolarHBondContact O-N 3.38Å; T214-K216 VanDerWaalsContact O-N 3.11Å; K216-E218 PolarHBondContact O-N 3.35Å | ||
| 217 | S | 75.3 | Confident | 79.5 | Confident | 115 Ų | 115 | 123.8 Ų | 123.8 | 80% | 0.804 | 68% | 0.679 | S | S | * | * | S | Bend | trans | -67 | -14.5 | 178.2 | 52.1 | 0 | 0 | 0 | 0 | 113.5 | L215 | L215-S217 PolarHBondContact O-N 2.91Š|
| 218 | E | 75.5 | Confident | 79.1 | Confident | 157 Ų | 157 | 127.8 Ų | 127.8 | 73% | 0.734 | 69% | 0.689 | S | S | * | * | S | Bend | trans | -122.2 | 134.1 | -177.8 | -64.6 | -179.3 | -179.1 | 0 | 0 | 110.3 | K216 | K216-E218 PolarHBondContact O-N 3.35Š|
| 219 | M | 78.6 | Confident | 78.4 | Confident | 168 Ų | 168 | 127 Ų | 127 | 83% | 0.828 | 69% | 0.689 | S | S | * | * | P | Polyproline II helix | trans | -66.9 | 135.3 | 168.4 | -179.4 | 170.3 | 41.5 | 0 | 0 | 108 | G221 | M219-G221 PolarHBondContact O-N 3.16Å; M219-G221 VanDerWaalsContact O-N 3.08Å |
| 220 | P | 78.1 | Confident | 77.6 | Confident | 113 Ų | 113 | 128.7 Ų | 128.7 | 73% | 0.734 | 69% | 0.694 | S | S | * | * | P | Polyproline II helix | trans | -48.4 | 123.8 | 171.8 | -25.8 | 33.6 | 0 | 0 | 0 | 109.4 | ||
| 221 | G | 79 | Confident | 76.6 | Confident | 51 Ų | 51 | 133.3 Ų | 133.3 | 53% | 0.526 | 69% | 0.694 | S | S | . | * | P | Polyproline II helix | trans | -56 | 160.2 | -175.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | M219 I223 | M219-G221 PolarHBondContact O-N 3.16Å; M219-G221 VanDerWaalsContact O-N 3.08Å; G221-I223 PolarHBondContact O-N 2.78Å |
| 222 | P | 81.1 | Confident | 75.9 | Confident | 133 Ų | 133 | 139.6 Ų | 139.6 | 86% | 0.864 | 72% | 0.718 | S | S | * | * | P | Polyproline II helix | trans | -50 | 117 | 175.4 | -25 | 33.9 | 0 | 0 | 0 | 109.7 | E224 | P222-E224 PolarHBondContact O-N 3.25Å; P222-E224 VanDerWaalsContact O-N 3.12Å |
| 223 | I | 75.5 | Confident | 74.9 | Confident | 155 Ų | 155 | 138.6 Ų | 138.6 | 80% | 0.795 | 72% | 0.717 | S | S | * | * | P | Polyproline II helix | trans | -53.9 | 122.5 | 179.2 | -61.7 | 169 | 0 | 0 | 0 | 107.2 | G221 R225 | G221-I223 PolarHBondContact O-N 2.78Å; I223-R225 PolarHBondContact O-N 2.77Å |
| 224 | E | 77.5 | Confident | 73.9 | Confident | 168 Ų | 168 | 143.2 Ų | 143.2 | 79% | 0.785 | 72% | 0.721 | S | S | * | * | trans | -52.7 | 113.2 | 175.2 | -76.1 | -174.5 | 171 | 0 | 0 | 108.5 | P222 K226 | P222-E224 PolarHBondContact O-N 3.25Å; P222-E224 VanDerWaalsContact O-N 3.12Å; E224-K226 VanDerWaalsContact C-N 3.3Å; E224-K226 PolarHBondContact O-N 3Å | ||
| 225 | R | 70.1 | Confident | 72.9 | Confident | 243 Ų | 243 | 146 Ų | 146 | 92% | 0.917 | 73% | 0.733 | S | S | * | * | trans | -73.5 | 92.6 | 175.4 | -65.8 | -168 | -179.9 | 115.3 | 0.4 | 107.1 | I223 D227 | I223-R225 PolarHBondContact O-N 2.77Å; R225-D227 PolarHBondContact O-N 3.48Å | ||
| 226 | K | 76.9 | Confident | 72 | Confident | 178 Ų | 178 | 150.6 Ų | 150.6 | 77% | 0.774 | 75% | 0.745 | S | S | * | * | trans | -56.6 | 133.6 | 165.8 | -64.5 | -163.7 | 176.9 | -174.2 | 0 | 108 | E224 L228 | E224-K226 VanDerWaalsContact C-N 3.3Å; E224-K226 PolarHBondContact O-N 3Å; K226-L228 PolarHBondContact O-N 2.93Å | ||
| 227 | D | 76.3 | Confident | 70.9 | Confident | 162 Ų | 162 | 150.1 Ų | 150.1 | 87% | 0.866 | 75% | 0.747 | S | S | * | * | trans | -54.6 | 112.4 | 176.3 | -83.8 | -25.3 | 0 | 0 | 0 | 108.9 | R225 | R225-D227 PolarHBondContact O-N 3.48Š| ||
| 228 | L | 72 | Confident | 70 | Confident | 131 Ų | 131 | 148.3 Ų | 148.3 | 69% | 0.686 | 74% | 0.739 | S | S | * | * | trans | -60.7 | 140.2 | 177.1 | -70.5 | 167.3 | 0 | 0 | 0 | 108.3 | K226 K230 | K226-L228 PolarHBondContact O-N 2.93Å; L228-K230 PolarHBondContact O-N 3.19Å | ||
| 229 | P | 73.1 | Confident | 69.3 | Low | 74 Ų | 74 | 146.5 Ų | 146.5 | 48% | 0.481 | 73% | 0.732 | S | S | . | * | trans | -55.1 | 132.5 | 172.8 | -15.8 | 25.5 | 0 | 0 | 0 | 108.6 | Y231 | P229-Y231 HydrophobicContact CB-CD2 3.93Å; P229-Y231 HydrophobicContact CB-CE1 4.4Å; P229-Y231 HydrophobicContact CB-CE2 3.45Å; P229-Y231 VanDerWaalsContact CB-CE2 3.45Å; P229-Y231 HydrophobicContact CG-CD2 4.45Å; P229-Y231 HydrophobicContact CG-CE2 3.62Å; P229-Y231 VanDerWaalsContact O-CD2 3.27Å; P229-Y231 WeakPolarHBondContact O-CD2 3.46Å; P229-Y231 PolarHBondContact O-N 3.06Å | ||
| 230 | K | 69.4 | Low | 68.2 | Low | 206 Ų | 206 | 143 Ų | 143 | 90% | 0.896 | 72% | 0.722 | S | S | * | * | trans | -72.9 | 65.4 | -178.9 | -65.1 | 173.3 | -175 | 174.1 | 0 | 109.6 | L228 K232 | L228-K230 PolarHBondContact O-N 3.19Å; K230-K232 PolarHBondContact O-N 3.07Å | ||
| 231 | Y | 65.5 | Low | 67.2 | Low | 155 Ų | 155 | 146.9 Ų | 146.9 | 61% | 0.608 | 72% | 0.723 | S | S | * | * | trans | -61.9 | 129.6 | 172.5 | -64 | -72.5 | 0 | 0 | 0 | 108.5 | P229 S233 | P229-Y231 HydrophobicContact CB-CD2 3.93Å; P229-Y231 HydrophobicContact CB-CE1 4.4Å; P229-Y231 HydrophobicContact CB-CE2 3.45Å; P229-Y231 VanDerWaalsContact CB-CE2 3.45Å; P229-Y231 HydrophobicContact CG-CD2 4.45Å; P229-Y231 HydrophobicContact CG-CE2 3.62Å; P229-Y231 VanDerWaalsContact O-CD2 3.27Å; P229-Y231 WeakPolarHBondContact O-CD2 3.46Å; P229-Y231 PolarHBondContact O-N 3.06Å; Y231-S233 PolarHBondContact O-N 3.46Å | ||
| 232 | K | 65.7 | Low | 66.6 | Low | 213 Ų | 213 | 146.6 Ų | 146.6 | 93% | 0.926 | 72% | 0.72 | S | S | * | * | trans | -67.8 | 83.9 | 174.1 | -70.4 | -73.2 | -179.5 | -174.5 | 0 | 108.6 | K230 F234 | K230-K232 PolarHBondContact O-N 3.07Å; K232-F234 PolarHBondContact O-N 3Å | ||
| 233 | S | 60.8 | Low | 65.8 | Low | 52 Ų | 52 | 141 Ų | 141 | 36% | 0.364 | 69% | 0.686 | S | S | . | * | trans | -76.7 | 122.1 | 169.3 | 55.7 | 0 | 0 | 0 | 0 | 108.6 | Y231 N235 R236 | Y231-S233 PolarHBondContact O-N 3.46Å; S233-N235 PolarHBondContact O-N 3.35Å; S233-R236 PolarHBondContact O-N 2.65Å; S233-R236 WeakPolarHBondContact OG-CB 3.19Å; S233-R236 VanDerWaalsContact OG-CD 3.25Å; S233-R236 WeakPolarHBondContact OG-CD 3.28Å; S233-R236 WeakPolarHBondContact OG-CG 3.44Å; S233-R236 PolarHBondContact OG-N 3.22Å | ||
| 234 | F | 61.1 | Low | 64.9 | Low | 183 Ų | 183 | 141.5 Ų | 141.5 | 80% | 0.803 | 68% | 0.683 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -55.9 | -19.8 | 172.6 | -167.6 | -98.1 | 0 | 0 | 0 | 112.7 | K232 | K232-F234 PolarHBondContact O-N 3Š|
| 235 | N | 62.8 | Low | 64.2 | Low | 151 Ų | 151 | 141.9 Ų | 141.9 | 81% | 0.807 | 69% | 0.685 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -103.6 | -0.5 | -176.4 | -61.1 | -24.9 | 0 | 0 | 0 | 114.9 | S233 | S233-N235 PolarHBondContact O-N 3.35Š|
| 236 | R | 61.8 | Low | 63.7 | Low | 180 Ų | 180 | 136.9 Ų | 136.9 | 68% | 0.679 | 67% | 0.67 | S | S | * | * | S | Bend | trans | -98.2 | 91.6 | 167.1 | -75.9 | 170.9 | 136.8 | 163.7 | -5.7 | 108 | S233 | S233-R236 PolarHBondContact O-N 2.65Å; S233-R236 WeakPolarHBondContact OG-CB 3.19Å; S233-R236 VanDerWaalsContact OG-CD 3.25Å; S233-R236 WeakPolarHBondContact OG-CD 3.28Å; S233-R236 WeakPolarHBondContact OG-CG 3.44Å; S233-R236 PolarHBondContact OG-N 3.22Å |
| 237 | M | 52.7 | Low | 62.7 | Low | 164 Ų | 164 | 130.2 Ų | 130.2 | 81% | 0.808 | 65% | 0.648 | S | S | * | * | trans | 51.7 | 72.1 | 170.9 | -48.9 | -64.6 | -80 | 0 | 0 | 111.7 | M239 | M237-M239 PolarHBondContact O-N 3.11Š| ||
| 238 | A | 56 | Low | 61.8 | Low | 77 Ų | 77 | 127.6 Ų | 127.6 | 64% | 0.636 | 63% | 0.634 | S | S | * | * | trans | -56.1 | 104 | 150.6 | 0 | 0 | 0 | 0 | 0 | 105 | P240 | A238-P240 WeakPolarHBondContact O-CD 3.4Š| ||
| 239 | M | 61.3 | Low | 61.3 | Low | 119 Ų | 119 | 128.7 Ų | 128.7 | 59% | 0.586 | 64% | 0.635 | S | S | * | * | trans | -76.3 | 97.5 | 166 | -66.1 | -176.4 | 114.2 | 0 | 0 | 104.1 | M237 Y241 G242 | M237-M239 PolarHBondContact O-N 3.11Å; M239-Y241 PolarHBondContact O-N 3.08Å; M239-Y241 VanDerWaalsContact O-N 3.14Å; M239-G242 PolarHBondContact O-N 3.35Å | ||
| 240 | P | 56.3 | Low | 60.5 | Low | 95 Ų | 95 | 131.7 Ų | 131.7 | 62% | 0.617 | 65% | 0.647 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -57.5 | 129.6 | 172 | 30.9 | -33.9 | 0 | 0 | 0 | 105.2 | A238 | A238-P240 WeakPolarHBondContact O-CD 3.4Š|
| 241 | Y | 55.7 | Low | 59.8 | Low | 195 Ų | 195 | 128.9 Ų | 128.9 | 77% | 0.765 | 64% | 0.639 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 76.6 | 12.3 | -175.3 | -34.9 | -68.5 | 0 | 0 | 0 | 117.6 | M239 G243 | M239-Y241 PolarHBondContact O-N 3.08Å; M239-Y241 VanDerWaalsContact O-N 3.14Å; Y241-G243 PolarHBondContact O-N 2.97Å |
| 242 | G | 66.4 | Low | 59.3 | Low | 45 Ų | 45 | 130.7 Ų | 130.7 | 46% | 0.464 | 65% | 0.65 | S | S | . | * | S | Bend | trans | 73.8 | 23.3 | 165 | 0 | 0 | 0 | 0 | 0 | 116 | M239 | M239-G242 PolarHBondContact O-N 3.35Š|
| 243 | G | 64.8 | Low | 58.9 | Low | 14 Ų | 14 | 128.4 Ų | 128.4 | 14% | 0.144 | 64% | 0.64 | C | S | . | * | trans | 94.1 | 158.7 | 175.4 | 0 | 0 | 0 | 0 | 0 | 113.9 | Y241 E245 K246 A247 | Y241-G243 PolarHBondContact O-N 2.97Å; G243-E245 PolarHBondContact O-N 3.32Å; G243-K246 PolarHBondContact O-N 3.17Å; G243-A247 PolarHBondContact O-N 3.42Å | ||
| 244 | F | 57.9 | Low | 58.6 | Low | 166 Ų | 166 | 134.7 Ų | 134.7 | 73% | 0.728 | 66% | 0.664 | S | S | * | * | H | α-helix | trans | -58.3 | -30.6 | -173.5 | -167.1 | -96.2 | 0 | 0 | 0 | 113.1 | K246 A247 N248 | F244-K246 VanDerWaalsContact C-N 3.29Å; F244-K246 PolarHBondContact O-N 3.23Å; F244-A247 PolarHBondContact O-N 3.46Å; F244-N248 PolarHBondContact O-N 3.43Å; F244-N248 VanDerWaalsContact O-N 3.17Å |
| 245 | E | 61.8 | Low | 58.1 | Low | 176 Ų | 176 | 132.8 Ų | 132.8 | 82% | 0.822 | 66% | 0.661 | S | S | * | * | H | α-helix | trans | -54.5 | -42.2 | 173.4 | -123.2 | 99.5 | -157.8 | 0 | 0 | 113 | G243 | G243-E245 PolarHBondContact O-N 3.32Å |
| 246 | K | 59.2 | Low | 57.6 | Low | 138 Ų | 138 | 130.3 Ų | 130.3 | 60% | 0.6 | 65% | 0.653 | S | S | * | * | H | α-helix | trans | -86 | -25.2 | -176.9 | -77.3 | -178.6 | 176.8 | 164.8 | 0 | 113 | G243 F244 N248 L250 | G243-K246 PolarHBondContact O-N 3.17Å; F244-K246 VanDerWaalsContact C-N 3.29Å; F244-K246 PolarHBondContact O-N 3.23Å; K246-N248 VanDerWaalsContact C-N 3.34Å; K246-L250 WeakPolarHBondContact O-CD1 3.26Å; K246-L250 WeakPolarHBondContact O-CG 3.29Å |
| 247 | A | 55.9 | Low | 57.1 | Low | 39 Ų | 39 | 131.2 Ų | 131.2 | 32% | 0.322 | 67% | 0.665 | S | S | . | * | H | α-helix | trans | -67.3 | -36.6 | 172.9 | 0 | 0 | 0 | 0 | 0 | 111.6 | G243 F244 Q249 L250 M251 | G243-A247 PolarHBondContact O-N 3.42Å; F244-A247 PolarHBondContact O-N 3.46Å; A247-Q249 VanDerWaalsContact C-N 3.33Å; A247-Q249 PolarHBondContact O-N 3.45Å; A247-L250 PolarHBondContact O-N 2.93Å; A247-M251 PolarHBondContact O-N 2.88Å |
| 248 | N | 57.8 | Low | 56.7 | Low | 106 Ų | 106 | 129.7 Ų | 129.7 | 57% | 0.567 | 67% | 0.665 | S | S | * | * | H | α-helix | trans | -68.2 | -31.5 | -179.9 | -126.7 | -10.9 | 0 | 0 | 0 | 112.9 | F244 K246 L250 M251 | F244-N248 PolarHBondContact O-N 3.43Å; F244-N248 VanDerWaalsContact O-N 3.17Å; K246-N248 VanDerWaalsContact C-N 3.34Å; N248-L250 PolarHBondContact O-N 2.77Å; N248-M251 PolarHBondContact O-N 2.95Å |
| 249 | Q | 60.7 | Low | 56.2 | Low | 154 Ų | 154 | 134.4 Ų | 134.4 | 72% | 0.72 | 67% | 0.674 | S | S | * | * | H | α-helix | trans | -70.3 | -21.1 | 176.9 | -156.3 | 80 | 41 | 0 | 0 | 113.3 | A247 | A247-Q249 VanDerWaalsContact C-N 3.33Å; A247-Q249 PolarHBondContact O-N 3.45Å |
| 250 | L | 56.5 | Low | 55.7 | Low | 138 Ų | 138 | 136.1 Ų | 136.1 | 72% | 0.723 | 69% | 0.691 | S | S | * | * | H | α-helix | trans | -92.8 | -16 | -178.2 | -63.1 | 164.9 | 0 | 0 | 0 | 112.3 | K246 A247 N248 K252 | K246-L250 WeakPolarHBondContact O-CD1 3.26Å; K246-L250 WeakPolarHBondContact O-CG 3.29Å; A247-L250 PolarHBondContact O-N 2.93Å; N248-L250 PolarHBondContact O-N 2.77Å; L250-K252 PolarHBondContact O-N 3.41Å |
| 251 | M | 56.1 | Low | 54.7 | Low | 147 Ų | 147 | 137.5 Ų | 137.5 | 72% | 0.724 | 70% | 0.698 | S | S | * | * | trans | -85.7 | 82.1 | 172.5 | -70.3 | -124.7 | 132.1 | 0 | 0 | 110 | A247 N248 F253 | A247-M251 PolarHBondContact O-N 2.88Å; N248-M251 PolarHBondContact O-N 2.95Å; M251-F253 PolarHBondContact O-N 3.19Å | ||
| 252 | K | 54.6 | Low | 54.1 | Low | 192 Ų | 192 | 137.4 Ų | 137.4 | 84% | 0.835 | 70% | 0.701 | S | S | * | * | trans | -88.4 | 21.7 | 168.9 | -50.5 | -165.7 | -175.9 | -169.1 | 0 | 112.8 | L250 | L250-K252 PolarHBondContact O-N 3.41Š| ||
| 253 | F | 56.9 | Low | 53.1 | Low | 165 Ų | 165 | 144.6 Ų | 144.6 | 72% | 0.724 | 72% | 0.723 | S | S | * | * | trans | -98.4 | 104.2 | 174.1 | -167.6 | -99 | 0 | 0 | 0 | 107.4 | M251 L255 | M251-F253 PolarHBondContact O-N 3.19Å; F253-L255 PolarHBondContact O-N 3.05Å | ||
| 254 | Q | 54.3 | Low | 52.4 | Low | 184 Ų | 184 | 152.4 Ų | 152.4 | 86% | 0.86 | 76% | 0.756 | S | S | * | * | trans | -64.4 | 106.9 | 170.1 | -78 | 177.5 | -30.7 | 0 | 0 | 107.9 | P256 | Q254-P256 WeakPolarHBondContact O-CD 3.5Š| ||
| 255 | L | 50 | Low | 52.3 | Low | 143 Ų | 143 | 150 Ų | 150 | 75% | 0.749 | 76% | 0.757 | S | S | * | * | trans | -71.2 | 123 | 163.9 | -104.9 | 151.2 | 0 | 0 | 0 | 107.6 | F253 E257 | F253-L255 PolarHBondContact O-N 3.05Å; L255-E257 PolarHBondContact O-N 2.89Å | ||
| 256 | P | 53.8 | Low | 52 | Low | 99 Ų | 99 | 150.3 Ų | 150.3 | 64% | 0.643 | 76% | 0.758 | S | S | * | * | trans | -60.5 | 136.7 | 169.7 | -20.4 | 32.7 | 0 | 0 | 0 | 109.9 | Q254 T258 | Q254-P256 WeakPolarHBondContact O-CD 3.5Å; P256-T258 PolarHBondContact O-N 3.43Å; P256-T258 VanDerWaalsContact O-N 3.14Å | ||
| 257 | E | 49.7 | Very low | 51.7 | Low | 200 Ų | 200 | 149.2 Ų | 149.2 | 94% | 0.935 | 77% | 0.765 | S | S | * | * | trans | -58.2 | 114.8 | 173.8 | -71.4 | 175.9 | 164.1 | 0 | 0 | 109.4 | L255 | L255-E257 PolarHBondContact O-N 2.89Š| ||
| 258 | T | 45.2 | Very low | 51.5 | Low | 132 Ų | 132 | 151.5 Ų | 151.5 | 81% | 0.81 | 78% | 0.784 | S | S | * | * | trans | -111.2 | 120.9 | 169.4 | 53.9 | 0 | 0 | 0 | 0 | 109.2 | P256 | P256-T258 PolarHBondContact O-N 3.43Å; P256-T258 VanDerWaalsContact O-N 3.14Å | ||
| 259 | E | 46.3 | Very low | 51.4 | Low | 176 Ų | 176 | 152.1 Ų | 152.1 | 82% | 0.822 | 79% | 0.791 | S | S | * | * | trans | -54 | 143.7 | -176.2 | -59 | 174.2 | 173 | 0 | 0 | 113.1 | T261 | E259-T261 PolarHBondContact O-N 3.36Å; E259-T261 PolarHBondContact O-OG1 3.41Å | ||
| 260 | V | 50.4 | Low | 51 | Low | 154 Ų | 154 | 150.4 Ų | 150.4 | 93% | 0.933 | 79% | 0.791 | S | S | * | * | trans | -47.1 | 101.8 | 177.1 | 178.9 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 261 | T | 33.8 | Very low | 50.9 | Low | 124 Ų | 124 | 152.4 Ų | 152.4 | 76% | 0.761 | 79% | 0.79 | S | S | * | * | trans | -124.7 | 105.3 | 171.9 | -50 | 0 | 0 | 0 | 0 | 109.2 | E259 | E259-T261 PolarHBondContact O-N 3.36Å; E259-T261 PolarHBondContact O-OG1 3.41Å | ||
| 262 | K | 44.2 | Very low | 50.9 | Low | 193 Ų | 193 | 153.3 Ų | 153.3 | 84% | 0.839 | 79% | 0.793 | S | S | * | * | trans | 12.4 | 114.3 | 161.1 | -60.4 | 174.2 | -176.5 | 174.3 | 0 | 116.7 | E264 | K262-E264 PolarHBondContact O-N 3Š| ||
| 263 | E | 45.6 | Very low | 51 | Low | 197 Ų | 197 | 149.8 Ų | 149.8 | 92% | 0.921 | 78% | 0.779 | S | S | * | * | trans | -57.6 | 115.3 | 161.3 | -70 | -172.2 | 156.7 | 0 | 0 | 110.2 | ||||
| 264 | E | 50.1 | Low | 50.9 | Low | 178 Ų | 178 | 146.5 Ų | 146.5 | 83% | 0.832 | 77% | 0.769 | S | S | * | * | trans | -90.3 | 121.2 | 157.2 | -173.9 | -175.3 | 177 | 0 | 0 | 107 | K262 E266 | K262-E264 PolarHBondContact O-N 3Å; E264-E266 PolarHBondContact O-N 3.04Å; E264-E266 VanDerWaalsContact O-N 3.17Å | ||
| 265 | P | 56.2 | Low | 51.1 | Low | 115 Ų | 115 | 144.3 Ų | 144.3 | 75% | 0.747 | 76% | 0.761 | S | S | * | * | trans | -70.9 | 113.9 | -179.4 | 26.8 | -31.3 | 0 | 0 | 0 | 109.9 | ||||
| 266 | E | 54.3 | Low | 51.7 | Low | 183 Ų | 183 | 141.5 Ų | 141.5 | 86% | 0.855 | 75% | 0.754 | S | S | * | * | trans | -55.1 | 135.2 | 166.5 | -83.9 | -164.3 | 145 | 0 | 0 | 109.6 | E264 A268 | E264-E266 PolarHBondContact O-N 3.04Å; E264-E266 VanDerWaalsContact O-N 3.17Å; E266-A268 PolarHBondContact O-N 2.81Å; E266-A268 VanDerWaalsContact O-N 3.15Å | ||
| 267 | P | 52.8 | Low | 51.9 | Low | 115 Ų | 115 | 141.8 Ų | 141.8 | 75% | 0.747 | 76% | 0.757 | S | S | * | * | trans | -62.9 | 123.2 | 177.4 | 26.3 | -32.5 | 0 | 0 | 0 | 108.7 | V269 | P267-V269 PolarHBondContact O-N 2.84Š| ||
| 268 | A | 52.7 | Low | 52.4 | Low | 86 Ų | 86 | 138.6 Ų | 138.6 | 71% | 0.711 | 74% | 0.736 | S | S | * | * | trans | -50.9 | 109 | 172.5 | 0 | 0 | 0 | 0 | 0 | 108.8 | E266 V270 | E266-A268 PolarHBondContact O-N 2.81Å; E266-A268 VanDerWaalsContact O-N 3.15Å; A268-V270 HydrophobicContact CB-CG2 4.23Å; A268-V270 PolarHBondContact O-N 3.26Å | ||
| 269 | V | 55 | Low | 53.4 | Low | 119 Ų | 119 | 138.8 Ų | 138.8 | 72% | 0.721 | 74% | 0.74 | S | S | * | * | trans | -68.5 | 85.4 | 165.8 | -177.2 | 0 | 0 | 0 | 0 | 105.7 | P267 Y271 | P267-V269 PolarHBondContact O-N 2.84Å; V269-Y271 HydrophobicContact CG1-CD2 3.86Å; V269-Y271 HydrophobicContact CG1-CE2 3.77Å; V269-Y271 PolarHBondContact O-N 3.06Å | ||
| 270 | V | 51.9 | Low | 54.4 | Low | 119 Ų | 119 | 133.2 Ų | 133.2 | 72% | 0.721 | 72% | 0.721 | S | S | * | * | trans | -67.5 | 91.1 | 170.6 | -179.7 | 0 | 0 | 0 | 0 | 105.6 | A268 Q272 | A268-V270 HydrophobicContact CB-CG2 4.23Å; A268-V270 PolarHBondContact O-N 3.26Å; V270-Q272 PolarHBondContact O-N 2.9Å | ||
| 271 | Y | 54.2 | Low | 54.9 | Low | 180 Ų | 180 | 135.6 Ų | 135.6 | 71% | 0.706 | 72% | 0.719 | S | S | * | * | trans | -58.6 | 106.3 | 162.8 | -89.2 | -89.9 | 0 | 0 | 0 | 106.8 | V269 H273 | V269-Y271 HydrophobicContact CG1-CD2 3.86Å; V269-Y271 HydrophobicContact CG1-CE2 3.77Å; V269-Y271 PolarHBondContact O-N 3.06Å; Y271-H273 PolarHBondContact O-N 3.15Å | ||
| 272 | Q | 56.7 | Low | 56.5 | Low | 166 Ų | 166 | 136.9 Ų | 136.9 | 78% | 0.776 | 72% | 0.721 | S | S | * | * | trans | -68.5 | 78.8 | 173.3 | -159.3 | 177.6 | -19.8 | 0 | 0 | 107.6 | V270 D274 | V270-Q272 PolarHBondContact O-N 2.9Å; Q272-D274 PolarHBondContact O-N 2.92Å | ||
| 273 | H | 56.6 | Low | 57.8 | Low | 117 Ų | 117 | 135.8 Ų | 135.8 | 54% | 0.542 | 71% | 0.712 | S | S | . | * | trans | -79.7 | 99.5 | 168 | -81.1 | -59.6 | 0 | 0 | 0 | 106.9 | Y271 I275 | Y271-H273 PolarHBondContact O-N 3.15Å; H273-I275 VanDerWaalsContact C-N 3.35Å; H273-I275 WeakPolarHBondContact O-CG1 3.36Å; H273-I275 PolarHBondContact O-N 3.14Å | ||
| 274 | D | 55.9 | Low | 59 | Low | 97 Ų | 97 | 132.4 Ų | 132.4 | 52% | 0.519 | 71% | 0.705 | S | S | . | * | trans | -46.8 | 99.4 | 172.2 | -68.1 | -36.1 | 0 | 0 | 0 | 110.2 | Q272 S276 C277 | Q272-D274 PolarHBondContact O-N 2.92Å; D274-S276 PolarHBondContact O-N 3.49Å; D274-S276 VanDerWaalsContact O-N 3.16Å; D274-C277 PolarHBondContact O-N 3.17Å; D274-C277 VanDerWaalsContact O-N 3.14Å | ||
| 275 | I | 58.5 | Low | 59.7 | Low | 137 Ų | 137 | 129.6 Ų | 129.6 | 70% | 0.703 | 70% | 0.702 | S | S | * | * | G | 310 helix | trans | -67.9 | -19.3 | -171.1 | -39 | 173 | 0 | 0 | 0 | 109.6 | H273 C277 R278 | H273-I275 VanDerWaalsContact C-N 3.35Å; H273-I275 WeakPolarHBondContact O-CG1 3.36Å; H273-I275 PolarHBondContact O-N 3.14Å; I275-C277 VanDerWaalsContact C-N 3.31Å; I275-C277 PolarHBondContact O-N 3.15Å; I275-R278 PolarHBondContact O-N 3.35Å |
| 276 | S | 62 | Low | 60.2 | Low | 84 Ų | 84 | 131.3 Ų | 131.3 | 59% | 0.587 | 70% | 0.703 | S | S | * | * | G | 310 helix | trans | -66.6 | -26 | 175.6 | 50 | 0 | 0 | 0 | 0 | 114.2 | D274 | D274-S276 PolarHBondContact O-N 3.49Å; D274-S276 VanDerWaalsContact O-N 3.16Å |
| 277 | C | 57.3 | Low | 60.6 | Low | 106 Ų | 106 | 125 Ų | 125 | 72% | 0.716 | 69% | 0.688 | S | S | * | * | G | 310 helix | trans | -96.6 | -1.9 | -179 | -64.5 | 0 | 0 | 0 | 0 | 112.9 | D274 I275 P279 | D274-C277 PolarHBondContact O-N 3.17Å; D274-C277 VanDerWaalsContact O-N 3.14Å; I275-C277 VanDerWaalsContact C-N 3.31Å; I275-C277 PolarHBondContact O-N 3.15Å; C277-P279 WeakPolarHBondContact O-CD 3.35Å |
| 278 | R | 61.7 | Low | 60.9 | Low | 132 Ų | 132 | 131.7 Ų | 131.7 | 50% | 0.498 | 70% | 0.698 | S | S | . | * | S | Bend | trans | -71 | 130.2 | 175.4 | -64.5 | -176.5 | -176.7 | -128.1 | 4.1 | 109.1 | I275 S280 | I275-R278 PolarHBondContact O-N 3.35Å; R278-S280 VanDerWaalsContact C-N 3.32Å; R278-S280 PolarHBondContact O-N 3.48Å |
| 279 | P | 66.3 | Low | 60.8 | Low | 137 Ų | 137 | 133.3 Ų | 133.3 | 89% | 0.89 | 70% | 0.699 | S | S | * | * | trans | -61.3 | 95.6 | 168.9 | -20.2 | 32.2 | 0 | 0 | 0 | 108.8 | C277 | C277-P279 WeakPolarHBondContact O-CD 3.35Š| ||
| 280 | S | 66.6 | Low | 60.2 | Low | 59 Ų | 59 | 134 Ų | 134 | 41% | 0.413 | 70% | 0.704 | S | S | . | * | trans | -87.3 | 121.3 | 176.7 | 63.5 | 0 | 0 | 0 | 0 | 108.8 | R278 N282 R283 | R278-S280 VanDerWaalsContact C-N 3.32Å; R278-S280 PolarHBondContact O-N 3.48Å; S280-N282 PolarHBondContact O-N 3.22Å; S280-N282 VanDerWaalsContact O-N 3.13Å; S280-R283 PolarHBondContact O-N 2.74Å; S280-R283 VanDerWaalsContact O-N 3.17Å | ||
| 281 | F | 60.5 | Low | 59.8 | Low | 203 Ų | 203 | 133 Ų | 133 | 89% | 0.89 | 70% | 0.702 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62.9 | -13.7 | 172.4 | -175 | -99.5 | 0 | 0 | 0 | 112.5 | ||
| 282 | N | 67.2 | Low | 59.7 | Low | 152 Ų | 152 | 132 Ų | 132 | 81% | 0.813 | 71% | 0.709 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89.6 | 4.9 | 177.7 | -62.2 | -20.4 | 0 | 0 | 0 | 113.7 | S280 | S280-N282 PolarHBondContact O-N 3.22Å; S280-N282 VanDerWaalsContact O-N 3.13Å |
| 283 | R | 72.7 | Confident | 59 | Low | 169 Ų | 169 | 132.1 Ų | 132.1 | 64% | 0.638 | 71% | 0.71 | S | S | * | * | S | Bend | trans | -78.6 | 128.7 | 169 | -104.7 | 173.4 | 158.8 | 154.1 | -6 | 109 | S280 | S280-R283 PolarHBondContact O-N 2.74Å; S280-R283 VanDerWaalsContact O-N 3.17Å |
| 284 | T | 70.1 | Confident | 58.6 | Low | 126 Ų | 126 | 132.7 Ų | 132.7 | 77% | 0.773 | 72% | 0.723 | S | S | * | * | P | Polyproline II helix | trans | -52.4 | 129.4 | 172.8 | -38.3 | 0 | 0 | 0 | 0 | 108.8 | I286 | T284-I286 PolarHBondContact O-N 3.1Š|
| 285 | P | 64.1 | Low | 57.8 | Low | 120 Ų | 120 | 133.1 Ų | 133.1 | 78% | 0.779 | 73% | 0.734 | S | S | * | * | P | Polyproline II helix | trans | -57.5 | 117.1 | -179.6 | 21.8 | -32 | 0 | 0 | 0 | 108.9 | G287 | P285-G287 PolarHBondContact O-N 2.96Å; P285-G287 VanDerWaalsContact O-N 3.14Å |
| 286 | I | 66.6 | Low | 57.1 | Low | 150 Ų | 150 | 132 Ų | 132 | 77% | 0.769 | 74% | 0.739 | S | S | * | * | trans | -71.2 | 110.1 | 170.3 | -60.7 | 170.8 | 0 | 0 | 0 | 104.2 | T284 | T284-I286 PolarHBondContact O-N 3.1Š| ||
| 287 | G | 63.4 | Low | 56.5 | Low | 52 Ų | 52 | 135.1 Ų | 135.1 | 54% | 0.536 | 75% | 0.747 | S | S | . | * | trans | -52.6 | 159.1 | 179.2 | 0 | 0 | 0 | 0 | 0 | 111.1 | P285 V289 | P285-G287 PolarHBondContact O-N 2.96Å; P285-G287 VanDerWaalsContact O-N 3.14Å; G287-V289 VanDerWaalsContact C-N 3.26Å; G287-V289 PolarHBondContact O-N 3.21Å | ||
| 288 | W | 58.4 | Low | 55.5 | Low | 255 Ų | 255 | 137.1 Ų | 137.1 | 97% | 0.966 | 75% | 0.746 | S | S | * | * | trans | -65.2 | 92.7 | 172.6 | -68.4 | 59.7 | 0 | 0 | 0 | 107.6 | T290 | W288-T290 PolarHBondContact O-N 3.05Å; W288-T290 VanDerWaalsContact O-N 3.09Å | ||
| 289 | V | 50.2 | Low | 54.7 | Low | 120 Ų | 120 | 138.7 Ų | 138.7 | 73% | 0.727 | 76% | 0.761 | S | S | * | * | trans | -69.9 | 105.9 | 172.1 | -179.3 | 0 | 0 | 0 | 0 | 105.8 | G287 S291 | G287-V289 VanDerWaalsContact C-N 3.26Å; G287-V289 PolarHBondContact O-N 3.21Å; V289-S291 VanDerWaalsContact C-N 3.27Å; V289-S291 PolarHBondContact O-N 3Å | ||
| 290 | T | 43.7 | Very low | 53.4 | Low | 133 Ų | 133 | 139.6 Ų | 139.6 | 82% | 0.816 | 75% | 0.753 | S | S | * | * | trans | -67.7 | 94.2 | 164.7 | 52.3 | 0 | 0 | 0 | 0 | 106.4 | W288 N292 | W288-T290 PolarHBondContact O-N 3.05Å; W288-T290 VanDerWaalsContact O-N 3.09Å; T290-N292 PolarHBondContact O-N 3.37Å | ||
| 291 | S | 42.6 | Very low | 52.5 | Low | 99 Ų | 99 | 141.3 Ų | 141.3 | 69% | 0.692 | 77% | 0.771 | S | S | * | * | trans | -61.6 | 107.7 | 176.7 | 53.2 | 0 | 0 | 0 | 0 | 109.2 | V289 | V289-S291 VanDerWaalsContact C-N 3.27Å; V289-S291 PolarHBondContact O-N 3Å | ||
| 292 | N | 52 | Low | 51.7 | Low | 159 Ų | 159 | 139.1 Ų | 139.1 | 85% | 0.85 | 77% | 0.768 | S | S | * | * | trans | -118.4 | 51.9 | 154.2 | -160 | 45 | 0 | 0 | 0 | 109.3 | T290 | T290-N292 PolarHBondContact O-N 3.37Š| ||
| 293 | E | 42.2 | Very low | 50.5 | Low | 168 Ų | 168 | 135.9 Ų | 135.9 | 79% | 0.785 | 76% | 0.763 | S | S | * | * | S | Bend | trans | -168.3 | 142.6 | 158 | -111.3 | 173.1 | 180 | 0 | 0 | 110.4 | S295 | E293-S295 PolarHBondContact O-N 2.82Å; E293-S295 VanDerWaalsContact O-N 3.15Å |
| 294 | P | 48.9 | Very low | 49.1 | Very low | 128 Ų | 128 | 134.4 Ų | 134.4 | 83% | 0.831 | 77% | 0.772 | S | S | * | * | trans | -80 | 97.9 | -172.9 | 31.6 | -32.5 | 0 | 0 | 0 | 111 | S296 | P294-S296 PolarHBondContact O-N 3.49Å; P294-S296 VanDerWaalsContact O-N 3.15Å | ||
| 295 | S | 39.2 | Very low | 48 | Very low | 107 Ų | 107 | 134.1 Ų | 134.1 | 75% | 0.748 | 77% | 0.773 | S | S | * | * | trans | -75.3 | 100.6 | 168 | 53.2 | 0 | 0 | 0 | 0 | 109.7 | E293 I297 | E293-S295 PolarHBondContact O-N 2.82Å; E293-S295 VanDerWaalsContact O-N 3.15Å; S295-I297 PolarHBondContact O-N 2.83Å; S295-I297 VanDerWaalsContact O-N 3.16Å | ||
| 296 | S | 44.3 | Very low | 46.6 | Very low | 114 Ų | 114 | 138.1 Ų | 138.1 | 80% | 0.797 | 78% | 0.778 | S | S | * | * | trans | -58 | 110.2 | 171.4 | 55.7 | 0 | 0 | 0 | 0 | 110.6 | P294 H298 | P294-S296 PolarHBondContact O-N 3.49Å; P294-S296 VanDerWaalsContact O-N 3.15Å; S296-H298 PolarHBondContact O-N 2.86Å | ||
| 297 | I | 48 | Very low | 45.6 | Very low | 149 Ų | 149 | 137.8 Ų | 137.8 | 76% | 0.764 | 78% | 0.778 | S | S | * | * | trans | -77.5 | 107.2 | 163 | -61.4 | 173.4 | 0 | 0 | 0 | 106.1 | S295 M299 | S295-I297 PolarHBondContact O-N 2.83Å; S295-I297 VanDerWaalsContact O-N 3.16Å; I297-M299 HydrophobicContact CG2-CG 4.09Å; I297-M299 PolarHBondContact O-N 2.83Å | ||
| 298 | H | 36.5 | Very low | 44.6 | Very low | 147 Ų | 147 | 138.1 Ų | 138.1 | 68% | 0.681 | 78% | 0.782 | S | S | * | * | trans | -73.8 | 103.6 | 172.4 | 172.5 | 79 | 0 | 0 | 0 | 108.9 | S296 E300 | S296-H298 PolarHBondContact O-N 2.86Å; H298-E300 WeakPolarHBondContact CE1-CG 3.22Å; H298-E300 IonicContact CE1-OE1 3.24Å; H298-E300 PolarHBondContact CE1-OE1 3.42Å; H298-E300 WeakPolarHBondContact NE2-CG 3.45Å; H298-E300 IonicContact NE2-OE1 3.89Å; H298-E300 PolarHBondContact NE2-OE1 2.98Å | ||
| 299 | M | 45 | Very low | 44 | Very low | 166 Ų | 166 | 134.4 Ų | 134.4 | 82% | 0.818 | 78% | 0.775 | S | S | * | * | trans | -110.6 | 112.1 | 160.3 | -63.5 | -163 | 85 | 0 | 0 | 106.8 | I297 A301 | I297-M299 HydrophobicContact CG2-CG 4.09Å; I297-M299 PolarHBondContact O-N 2.83Å; M299-A301 PolarHBondContact O-N 2.95Å; M299-A301 VanDerWaalsContact O-N 3.08Å | ||
| 300 | E | 39.1 | Very low | 43.9 | Very low | 155 Ų | 155 | 135.4 Ų | 135.4 | 72% | 0.724 | 78% | 0.782 | S | S | * | * | trans | -69.5 | 103.5 | 171.1 | -62.7 | -161.2 | 154.7 | 0 | 0 | 108.9 | H298 | H298-E300 WeakPolarHBondContact CE1-CG 3.22Å; H298-E300 IonicContact CE1-OE1 3.24Å; H298-E300 PolarHBondContact CE1-OE1 3.42Å; H298-E300 WeakPolarHBondContact NE2-CG 3.45Å; H298-E300 IonicContact NE2-OE1 3.89Å; H298-E300 PolarHBondContact NE2-OE1 2.98Å | ||
| 301 | A | 48.3 | Very low | 44.1 | Very low | 95 Ų | 95 | 136.3 Ų | 136.3 | 79% | 0.785 | 78% | 0.781 | S | S | * | * | trans | -99.7 | 91.1 | 157.7 | 0 | 0 | 0 | 0 | 0 | 106.1 | M299 | M299-A301 PolarHBondContact O-N 2.95Å; M299-A301 VanDerWaalsContact O-N 3.08Å | ||
| 302 | D | 42.3 | Very low | 44.3 | Very low | 158 Ų | 158 | 139.4 Ų | 139.4 | 85% | 0.845 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -66.2 | 135.4 | -178.4 | -138.5 | -3.7 | 0 | 0 | 0 | 110.4 | ||
| 303 | A | 43.9 | Very low | 43.6 | Very low | 84 Ų | 84 | 143.5 Ų | 143.5 | 69% | 0.694 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -79 | 143.3 | -152.5 | 0 | 0 | 0 | 0 | 0 | 114.4 | ||
| 304 | V | 41.4 | Very low | 43.7 | Very low | 137 Ų | 137 | 142.3 Ų | 142.3 | 83% | 0.83 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -88.9 | 126.6 | 157.7 | -177.9 | 0 | 0 | 0 | 0 | 107.3 | F306 | V304-F306 PolarHBondContact O-N 3.48Š|
| 305 | P | 48.5 | Very low | 43.4 | Very low | 121 Ų | 121 | 143 Ų | 143 | 79% | 0.786 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -69 | 124.5 | -175.6 | -14.4 | 28.2 | 0 | 0 | 0 | 110.9 | ||
| 306 | F | 35.1 | Very low | 43.6 | Very low | 203 Ų | 203 | 145 Ų | 145 | 89% | 0.89 | 81% | 0.808 | S | S | * | * | trans | -92.7 | 104.3 | 168.2 | -162.7 | -99.5 | 0 | 0 | 0 | 108.7 | V304 | V304-F306 PolarHBondContact O-N 3.48Š| ||
| 307 | D | 45.7 | Very low | 43.6 | Very low | 143 Ų | 143 | 146.8 Ų | 146.8 | 77% | 0.765 | 81% | 0.809 | S | S | * | * | trans | -54.5 | 136.5 | 160 | -174.1 | 22.6 | 0 | 0 | 0 | 110.3 | ||||
| 308 | G | 42.3 | Very low | 43.3 | Very low | 60 Ų | 60 | 146.7 Ų | 146.7 | 62% | 0.619 | 81% | 0.812 | S | S | * | * | trans | 174.8 | 73.9 | -172 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 309 | E | 46 | Very low | 43.8 | Very low | 177 Ų | 177 | 146.7 Ų | 146.7 | 83% | 0.827 | 82% | 0.82 | S | S | * | * | trans | -44.2 | 133.5 | 159.6 | -57.6 | 174.7 | 155 | 0 | 0 | 111.7 | ||||
| 310 | T | 46.8 | Very low | 43.7 | Very low | 141 Ų | 141 | 145.3 Ų | 145.3 | 87% | 0.865 | 82% | 0.82 | S | S | * | * | trans | -176.3 | 110.4 | 132.4 | 21.1 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 311 | D | 47.3 | Very low | 44 | Very low | 151 Ų | 151 | 144.5 Ų | 144.5 | 81% | 0.807 | 83% | 0.828 | S | S | * | * | trans | 17.8 | 148.3 | 136.1 | -130.4 | -9.1 | 0 | 0 | 0 | 123.5 | ||||
| 312 | E | 48.1 | Very low | 43.7 | Very low | 164 Ų | 164 | 148.7 Ų | 148.7 | 77% | 0.766 | 83% | 0.831 | S | S | * | * | trans | 78.3 | 92.8 | 161.3 | -54.8 | -166.4 | 179.6 | 0 | 0 | 120.7 | ||||
| 313 | L | 36.9 | Very low | 43.8 | Very low | 245 Ų | 245 | 147.8 Ų | 147.8 | 100% | 1.283 | 83% | 0.83 | S | S | * | * | 172.3 | 0 | 103.8 | -109.5 | 150 | 0 | 0 | 0 | 112.4 |
Retrieved 313 of 313 residues in 128.3 ms
(Link to these results)