| 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 | 40.8 | Very low | 40.3 | Very low | 235 Ų | 235 | 184.8 Ų | 184.8 | 100% | 1.158 | 89% | 0.887 | S | S | * | * | 0 | 113.5 | 0 | -84.8 | 171.4 | 147.3 | 0 | 0 | 106.3 | |||||
| 2 | D | 35.1 | Very low | 39.9 | Very low | 170 Ų | 170 | 185.7 Ų | 185.7 | 91% | 0.909 | 89% | 0.889 | S | S | * | * | trans | -159.6 | 97.5 | 169.1 | -92.6 | -59.8 | 0 | 0 | 0 | 106.8 | ||||
| 3 | E | 44.2 | Very low | 39.5 | Very low | 204 Ų | 204 | 185.6 Ų | 185.6 | 95% | 0.953 | 88% | 0.883 | S | S | * | * | trans | -105.3 | 129.3 | 173.9 | -72.6 | -160.9 | 108.3 | 0 | 0 | 110.1 | ||||
| 4 | R | 46 | Very low | 39.8 | Very low | 245 Ų | 245 | 184.4 Ų | 184.4 | 93% | 0.925 | 88% | 0.879 | S | S | * | * | trans | -117.4 | 127.4 | 173.5 | -176.9 | 177.2 | -72.5 | -170.6 | -2.2 | 109.5 | ||||
| 5 | I | 46.5 | Very low | 39.6 | Very low | 158 Ų | 158 | 183.5 Ų | 183.5 | 81% | 0.81 | 87% | 0.874 | S | S | * | * | P | Polyproline II helix | trans | -62.4 | 142.9 | -171.9 | -61.8 | 164.9 | 0 | 0 | 0 | 112 | ||
| 6 | P | 50.1 | Low | 39.5 | Very low | 121 Ų | 121 | 184.4 Ų | 184.4 | 79% | 0.786 | 88% | 0.876 | S | S | * | * | P | Polyproline II helix | trans | -84.9 | 157.5 | -176.6 | 34 | -36.8 | 0 | 0 | 0 | 114.8 | ||
| 7 | H | 32.2 | Very low | 39.8 | Very low | 181 Ų | 181 | 178 Ų | 178 | 84% | 0.838 | 86% | 0.862 | S | S | * | * | P | Polyproline II helix | trans | -95.5 | 116.1 | 175.1 | -178 | -60.5 | 0 | 0 | 0 | 110.2 | ||
| 8 | L | 39.1 | Very low | 40.2 | Very low | 169 Ų | 169 | 177.2 Ų | 177.2 | 89% | 0.885 | 86% | 0.862 | S | S | * | * | P | Polyproline II helix | trans | -76.6 | 151.1 | 176.8 | -99.4 | 164.8 | 0 | 0 | 0 | 112.1 | ||
| 9 | Q | 38.7 | Very low | 40.5 | Very low | 184 Ų | 184 | 178.3 Ų | 178.3 | 86% | 0.86 | 86% | 0.863 | S | S | * | * | trans | -117.6 | 142.2 | -165.4 | -152.9 | 162.3 | 28.8 | 0 | 0 | 112 | ||||
| 10 | D | 36.5 | Very low | 40.9 | Very low | 158 Ų | 158 | 177.2 Ų | 177.2 | 85% | 0.845 | 86% | 0.86 | S | S | * | * | trans | -67.7 | 119.8 | -177.1 | 176.8 | 24.4 | 0 | 0 | 0 | 112.8 | ||||
| 11 | R | 34.6 | Very low | 41.4 | Very low | 208 Ų | 208 | 172.3 Ų | 172.3 | 79% | 0.785 | 86% | 0.856 | S | S | * | * | trans | -170.9 | 106.4 | 156.6 | -154 | 170.7 | 179.5 | 170.7 | -1.7 | 113.6 | ||||
| 12 | Q | 34.6 | Very low | 41.6 | Very low | 195 Ų | 195 | 167.8 Ų | 167.8 | 91% | 0.911 | 83% | 0.834 | S | S | * | * | trans | -132.9 | 113.1 | 147.8 | -75.5 | -160.5 | -39.8 | 0 | 0 | 109.9 | ||||
| 13 | F | 35.2 | Very low | 42.1 | Very low | 185 Ų | 185 | 167.6 Ų | 167.6 | 81% | 0.811 | 83% | 0.833 | S | S | * | * | trans | -84.4 | 149.6 | 180 | -125.2 | -108.2 | 0 | 0 | 0 | 110.3 | ||||
| 14 | M | 42.9 | Very low | 42.3 | Very low | 169 Ų | 169 | 166 Ų | 166 | 83% | 0.833 | 82% | 0.823 | S | S | * | * | trans | -62.3 | 166.7 | 174.7 | -173.1 | 171.7 | 68 | 0 | 0 | 112.2 | ||||
| 15 | E | 37 | Very low | 42.8 | Very low | 171 Ų | 171 | 159.4 Ų | 159.4 | 80% | 0.799 | 81% | 0.812 | S | S | * | * | trans | 101.5 | 100 | 162.8 | -159.7 | 169.3 | -167 | 0 | 0 | 117 | ||||
| 16 | H | 39.1 | Very low | 43.4 | Very low | 197 Ų | 197 | 157.6 Ų | 157.6 | 91% | 0.912 | 81% | 0.811 | S | S | * | * | trans | -156.4 | 120.5 | 131 | -101.1 | -63.9 | 0 | 0 | 0 | 109 | ||||
| 17 | A | 43.3 | Very low | 43.8 | Very low | 76 Ų | 76 | 158.9 Ų | 158.9 | 63% | 0.628 | 81% | 0.81 | S | S | * | * | trans | -87.2 | 147.4 | -176.1 | 0 | 0 | 0 | 0 | 0 | 112.7 | F19 | A17-F19 PolarHBondContact O-N 2.74Š| ||
| 18 | D | 48.1 | Very low | 44.7 | Very low | 164 Ų | 164 | 160.2 Ų | 160.2 | 88% | 0.877 | 81% | 0.809 | S | S | * | * | trans | 42.3 | 76.7 | 134.8 | -51.2 | -26.7 | 0 | 0 | 0 | 117.8 | ||||
| 19 | F | 45.2 | Very low | 45.2 | Very low | 197 Ų | 197 | 159.1 Ų | 159.1 | 86% | 0.864 | 80% | 0.801 | S | S | * | * | trans | -136.3 | 78.2 | 158.6 | -160.2 | -92.4 | 0 | 0 | 0 | 111.4 | A17 | A17-F19 PolarHBondContact O-N 2.74Š| ||
| 20 | L | 49.1 | Very low | 45.4 | Very low | 156 Ų | 156 | 154.5 Ų | 154.5 | 82% | 0.817 | 79% | 0.788 | S | S | * | * | S | Bend | trans | 171.3 | 97.2 | 149.7 | -94.2 | 165.4 | 0 | 0 | 0 | 108 | M22 | L20-M22 PolarHBondContact O-N 2.73Š|
| 21 | G | 50.6 | Low | 45.8 | Very low | 75 Ų | 75 | 154.7 Ų | 154.7 | 77% | 0.773 | 78% | 0.782 | S | S | * | * | trans | -66.1 | 94.3 | -177 | 0 | 0 | 0 | 0 | 0 | 113 | ||||
| 22 | M | 46.4 | Very low | 46.7 | Very low | 141 Ų | 141 | 150 Ų | 150 | 70% | 0.695 | 78% | 0.781 | S | S | * | * | trans | -123.4 | 91.8 | 169.2 | -70.3 | -87.7 | 89.1 | 0 | 0 | 108.5 | L20 F24 | L20-M22 PolarHBondContact O-N 2.73Å; M22-F24 VanDerWaalsContact C-N 3.33Å; M22-F24 HydrophobicContact CB-CD2 3.98Å; M22-F24 HydrophobicContact CB-CE2 3.89Å; M22-F24 PolarHBondContact O-N 2.79Å | ||
| 23 | D | 44.6 | Very low | 47.8 | Very low | 166 Ų | 166 | 150.3 Ų | 150.3 | 89% | 0.888 | 78% | 0.779 | S | S | * | * | trans | -64.9 | 87.4 | 174.1 | -73.4 | -70.6 | 0 | 0 | 0 | 111.2 | P25 | D23-P25 WeakPolarHBondContact O-CD 3.28Š| ||
| 24 | F | 48 | Very low | 48.7 | Very low | 169 Ų | 169 | 152.7 Ų | 152.7 | 74% | 0.741 | 78% | 0.783 | S | S | * | * | trans | -88 | 116.1 | 167.2 | -81.7 | -83 | 0 | 0 | 0 | 109.7 | M22 P26 | M22-F24 VanDerWaalsContact C-N 3.33Å; M22-F24 HydrophobicContact CB-CD2 3.98Å; M22-F24 HydrophobicContact CB-CE2 3.89Å; M22-F24 PolarHBondContact O-N 2.79Å; F24-P26 WeakPolarHBondContact O-CD 3.31Å | ||
| 25 | P | 56.7 | Low | 49.3 | Very low | 107 Ų | 107 | 148.3 Ų | 148.3 | 70% | 0.695 | 78% | 0.781 | S | S | * | * | trans | -66.3 | 116.8 | 179.8 | -19.8 | 32.3 | 0 | 0 | 0 | 111.4 | D23 L27 | D23-P25 WeakPolarHBondContact O-CD 3.28Å; P25-L27 PolarHBondContact O-N 3.14Å | ||
| 26 | P | 59.5 | Low | 50.2 | Low | 120 Ų | 120 | 147.2 Ų | 147.2 | 78% | 0.779 | 78% | 0.779 | S | S | * | * | trans | -83.6 | 49.9 | 179.6 | 35.8 | -34.2 | 0 | 0 | 0 | 110.8 | F24 | F24-P26 WeakPolarHBondContact O-CD 3.31Š| ||
| 27 | L | 57.6 | Low | 50.9 | Low | 148 Ų | 148 | 147.7 Ų | 147.7 | 78% | 0.775 | 78% | 0.778 | S | S | * | * | trans | -111.2 | 57 | -171.4 | -68.3 | -178.2 | 0 | 0 | 0 | 113.2 | P25 | P25-L27 PolarHBondContact O-N 3.14Š| ||
| 28 | Y | 52.1 | Low | 51.1 | Low | 210 Ų | 210 | 154.1 Ų | 154.1 | 82% | 0.824 | 79% | 0.786 | S | S | * | * | trans | -157.2 | 72.1 | 138.3 | -133.1 | -98 | 0 | 0 | 0 | 113 | C30 | Y28-C30 VanDerWaalsContact C-N 3.31Å; Y28-C30 HydrophobicContact CD1-CB 4.24Å; Y28-C30 PolarHBondContact O-N 3.38Å | ||
| 29 | M | 49.8 | Very low | 51.3 | Low | 146 Ų | 146 | 154.8 Ų | 154.8 | 72% | 0.719 | 78% | 0.784 | S | S | * | * | trans | -62.5 | 98.5 | 154.1 | -83.4 | -145.3 | 90.3 | 0 | 0 | 108.4 | K31 | M29-K31 PolarHBondContact O-N 3.25Š| ||
| 30 | C | 41.8 | Very low | 51.8 | Low | 87 Ų | 87 | 148.6 Ų | 148.6 | 59% | 0.588 | 76% | 0.76 | S | S | * | * | trans | -69.4 | 83.4 | 171 | -166.6 | 0 | 0 | 0 | 0 | 109.8 | Y28 S32 | Y28-C30 VanDerWaalsContact C-N 3.31Å; Y28-C30 HydrophobicContact CD1-CB 4.24Å; Y28-C30 PolarHBondContact O-N 3.38Å; C30-S32 PolarHBondContact O-N 3.09Å | ||
| 31 | K | 44.9 | Very low | 52 | Low | 162 Ų | 162 | 144.4 Ų | 144.4 | 70% | 0.704 | 74% | 0.744 | S | S | * | * | trans | -69.8 | 83.8 | 168.6 | -66.6 | -77.4 | -176.5 | 175.8 | 0 | 107.8 | M29 K33 | M29-K31 PolarHBondContact O-N 3.25Å; K31-K33 PolarHBondContact O-N 3.21Å | ||
| 32 | S | 53.5 | Low | 52.3 | Low | 109 Ų | 109 | 144.2 Ų | 144.2 | 76% | 0.762 | 74% | 0.742 | S | S | * | * | trans | -66.6 | 68.2 | 174.3 | -67.3 | 0 | 0 | 0 | 0 | 112 | C30 | C30-S32 PolarHBondContact O-N 3.09Š| ||
| 33 | K | 58.2 | Low | 52.9 | Low | 202 Ų | 202 | 143.4 Ų | 143.4 | 88% | 0.878 | 74% | 0.735 | S | S | * | * | trans | -109.2 | 67.3 | 175.2 | -159.5 | -174.9 | -176.5 | -175.9 | 0 | 110.8 | K31 | K31-K33 PolarHBondContact O-N 3.21Š| ||
| 34 | R | 55.3 | Low | 53.6 | Low | 234 Ų | 234 | 138.9 Ų | 138.9 | 88% | 0.883 | 71% | 0.711 | S | S | * | * | S | Bend | trans | -139 | 111.5 | 155.6 | -168.6 | 168.4 | -69.4 | 178.9 | -0.7 | 108 | I36 | R34-I36 PolarHBondContact O-N 2.83Š|
| 35 | G | 54.9 | Low | 54.2 | Low | 78 Ų | 78 | 133.9 Ų | 133.9 | 80% | 0.804 | 70% | 0.701 | S | S | * | * | trans | -68.9 | 116.5 | -171.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | K37 | G35-K37 PolarHBondContact O-N 3.26Å; G35-K37 VanDerWaalsContact O-N 3.12Å | ||
| 36 | I | 56.2 | Low | 54.7 | Low | 147 Ų | 147 | 137.4 Ų | 137.4 | 75% | 0.754 | 70% | 0.701 | S | S | * | * | trans | -81.4 | 74.3 | 161.3 | -164.1 | 76.5 | 0 | 0 | 0 | 108.3 | R34 R38 | R34-I36 PolarHBondContact O-N 2.83Å; I36-R38 PolarHBondContact O-N 3.29Å | ||
| 37 | K | 53.2 | Low | 55.2 | Low | 207 Ų | 207 | 136.8 Ų | 136.8 | 90% | 0.9 | 69% | 0.686 | S | S | * | * | trans | -75.5 | 75.9 | 169.5 | -169.1 | -175.3 | 177.8 | -177.5 | 0 | 109.2 | G35 | G35-K37 PolarHBondContact O-N 3.26Å; G35-K37 VanDerWaalsContact O-N 3.12Å | ||
| 38 | R | 47 | Very low | 56.2 | Low | 211 Ų | 211 | 135 Ų | 135 | 80% | 0.796 | 68% | 0.677 | S | S | * | * | trans | -128.1 | 113.6 | 153.6 | -72.3 | -157.1 | -174.9 | -147.1 | 5.3 | 108.7 | I36 D40 | I36-R38 PolarHBondContact O-N 3.29Å; R38-D40 PolarHBondContact O-N 3.45Å; R38-D40 VanDerWaalsContact O-N 3.09Å | ||
| 39 | E | 53.8 | Low | 57.9 | Low | 178 Ų | 178 | 128 Ų | 128 | 83% | 0.832 | 66% | 0.657 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79.2 | 88.2 | -176.5 | -175.8 | -97.5 | 128.3 | 0 | 0 | 109.4 | ||
| 40 | D | 54.3 | Low | 60 | Low | 67 Ų | 67 | 126.6 Ų | 126.6 | 36% | 0.358 | 65% | 0.648 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -153.9 | -2.5 | 151.3 | -160.1 | -137.8 | 0 | 0 | 0 | 112.1 | R38 G42 K43 | R38-D40 PolarHBondContact O-N 3.45Å; R38-D40 VanDerWaalsContact O-N 3.09Å; D40-G42 PolarHBondContact O-N 3.49Å; D40-K43 PolarHBondContact O-N 2.8Å; D40-K43 VanDerWaalsContact O-N 3.12Å; D40-K43 WeakPolarHBondContact OD2-CD 3.37Å; D40-K43 IonicContact OD2-NZ 2.59Å; D40-K43 PolarHBondContact OD2-NZ 3.39Å |
| 41 | S | 53.6 | Low | 62.4 | Low | 68 Ų | 68 | 131.1 Ų | 131.1 | 48% | 0.476 | 65% | 0.653 | S | S | . | * | H | α-helix | trans | -62.4 | -16.6 | -172.3 | -55 | 0 | 0 | 0 | 0 | 115.6 | K43 D44 A45 | S41-K43 VanDerWaalsContact C-N 3.28Å; S41-K43 PolarHBondContact O-N 3.25Å; S41-D44 PolarHBondContact O-N 2.98Å; S41-A45 WeakPolarHBondContact O-CB 3.37Å; S41-A45 PolarHBondContact O-N 3.49Å |
| 42 | G | 57.1 | Low | 64.8 | Low | 71 Ų | 71 | 129.1 Ų | 129.1 | 73% | 0.732 | 65% | 0.65 | S | S | * | * | H | α-helix | trans | -64.5 | -32.2 | 174.9 | 0 | 0 | 0 | 0 | 0 | 113.1 | D40 | D40-G42 PolarHBondContact O-N 3.49Å |
| 43 | K | 59.1 | Low | 66.8 | Low | 125 Ų | 125 | 129.6 Ų | 129.6 | 54% | 0.543 | 64% | 0.642 | S | S | . | * | H | α-helix | trans | -84.2 | -38.9 | 177.8 | -56.7 | 174.6 | -158.8 | 131.7 | 0 | 110.7 | D40 S41 Y46 K47 | D40-K43 PolarHBondContact O-N 2.8Å; D40-K43 VanDerWaalsContact O-N 3.12Å; D40-K43 WeakPolarHBondContact OD2-CD 3.37Å; D40-K43 IonicContact OD2-NZ 2.59Å; D40-K43 PolarHBondContact OD2-NZ 3.39Å; S41-K43 VanDerWaalsContact C-N 3.28Å; S41-K43 PolarHBondContact O-N 3.25Å; K43-Y46 PolarHBondContact O-N 3.31Å; K43-K47 WeakPolarHBondContact O-CG 3.49Å; K43-K47 PolarHBondContact O-N 3.05Å |
| 44 | D | 58.4 | Low | 68.6 | Low | 71 Ų | 71 | 122.2 Ų | 122.2 | 38% | 0.38 | 61% | 0.611 | S | S | . | * | H | α-helix | trans | -73.3 | -29.3 | 178.7 | -76.6 | -24.6 | 0 | 0 | 0 | 113.8 | S41 Y46 K47 L48 | S41-D44 PolarHBondContact O-N 2.98Å; D44-Y46 PolarHBondContact O-N 3.2Å; D44-K47 PolarHBondContact O-N 3.47Å; D44-K47 VanDerWaalsContact O-N 3.14Å; D44-K47 WeakPolarHBondContact OD1-CD 3.44Å; D44-L48 WeakPolarHBondContact O-CG 3.46Å; D44-L48 PolarHBondContact O-N 2.81Å |
| 45 | A | 61.3 | Low | 70.6 | Confident | 64 Ų | 64 | 116.5 Ų | 116.5 | 53% | 0.529 | 59% | 0.592 | S | S | . | * | H | α-helix | trans | -61.5 | -27.3 | 174.7 | 0 | 0 | 0 | 0 | 0 | 113.2 | S41 P49 | S41-A45 WeakPolarHBondContact O-CB 3.37Å; S41-A45 PolarHBondContact O-N 3.49Å; A45-P49 WeakPolarHBondContact O-CD 3.31Å; A45-P49 WeakPolarHBondContact O-CG 3.38Å |
| 46 | Y | 66.3 | Low | 72.6 | Confident | 180 Ų | 180 | 120.6 Ų | 120.6 | 71% | 0.706 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -88.4 | -33.6 | 171.8 | -170.3 | -101.2 | 0 | 0 | 0 | 112.4 | K43 D44 L48 P49 H50 | K43-Y46 PolarHBondContact O-N 3.31Å; D44-Y46 PolarHBondContact O-N 3.2Å; Y46-L48 VanDerWaalsContact C-N 3.34Å; Y46-L48 PolarHBondContact O-N 3.27Å; Y46-P49 WeakPolarHBondContact O-CD 3.44Å; Y46-H50 PolarHBondContact O-N 3.38Å; Y46-H50 VanDerWaalsContact O-N 3.17Å |
| 47 | K | 72 | Confident | 74.6 | Confident | 107 Ų | 107 | 120.2 Ų | 120.2 | 47% | 0.465 | 58% | 0.577 | S | S | . | * | H | α-helix | trans | -67.2 | -30.4 | 176.2 | -68.9 | 168.9 | -179.1 | -174.3 | 0 | 113.1 | K43 D44 H50 R51 | K43-K47 WeakPolarHBondContact O-CG 3.49Å; K43-K47 PolarHBondContact O-N 3.05Å; D44-K47 PolarHBondContact O-N 3.47Å; D44-K47 VanDerWaalsContact O-N 3.14Å; D44-K47 WeakPolarHBondContact OD1-CD 3.44Å; K47-H50 PolarHBondContact O-N 2.93Å; K47-R51 WeakPolarHBondContact O-CB 3.48Å; K47-R51 VanDerWaalsContact O-CG 3.23Å; K47-R51 WeakPolarHBondContact O-CG 3.5Å; K47-R51 PolarHBondContact O-N 2.94Å |
| 48 | L | 77.1 | Confident | 76.7 | Confident | 111 Ų | 111 | 116.1 Ų | 116.1 | 58% | 0.581 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -64.5 | -52.7 | 177.4 | -77 | 167.3 | 0 | 0 | 0 | 112.4 | D44 Y46 H50 R51 L52 | D44-L48 WeakPolarHBondContact O-CG 3.46Å; D44-L48 PolarHBondContact O-N 2.81Å; Y46-L48 VanDerWaalsContact C-N 3.34Å; Y46-L48 PolarHBondContact O-N 3.27Å; L48-H50 VanDerWaalsContact C-N 3.34Å; L48-H50 PolarHBondContact O-N 3.41Å; L48-R51 PolarHBondContact O-N 2.99Å; L48-L52 PolarHBondContact O-N 3.37Å |
| 49 | P | 88.5 | Confident | 79.1 | Confident | 63 Ų | 63 | 109.9 Ų | 109.9 | 41% | 0.409 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -53.9 | -45.9 | 167.7 | -27.8 | 34.3 | 0 | 0 | 0 | 113.2 | A45 Y46 R51 L52 I53 | A45-P49 WeakPolarHBondContact O-CD 3.31Å; A45-P49 WeakPolarHBondContact O-CG 3.38Å; Y46-P49 WeakPolarHBondContact O-CD 3.44Å; P49-R51 PolarHBondContact O-N 3.42Å; P49-L52 PolarHBondContact O-N 2.94Å; P49-L52 VanDerWaalsContact O-N 3.12Å; P49-I53 VanDerWaalsContact O-CG1 3.3Å; P49-I53 WeakPolarHBondContact O-CG1 3.4Å; P49-I53 PolarHBondContact O-N 3.38Å |
| 50 | H | 93.8 | Very high | 81.3 | Confident | 116 Ų | 116 | 109.7 Ų | 109.7 | 54% | 0.537 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -61.2 | -44.1 | 180 | -172.4 | 76.5 | 0 | 0 | 0 | 112.3 | Y46 K47 L48 L52 I53 E54 | Y46-H50 PolarHBondContact O-N 3.38Å; Y46-H50 VanDerWaalsContact O-N 3.17Å; K47-H50 PolarHBondContact O-N 2.93Å; L48-H50 VanDerWaalsContact C-N 3.34Å; L48-H50 PolarHBondContact O-N 3.41Å; H50-L52 VanDerWaalsContact C-N 3.3Å; H50-L52 PolarHBondContact O-N 3.46Å; H50-I53 PolarHBondContact O-N 3.23Å; H50-E54 WeakPolarHBondContact O-CB 3.25Å; H50-E54 PolarHBondContact O-N 3.38Å |
| 51 | R | 92.1 | Very high | 83.3 | Confident | 183 Ų | 183 | 109.7 Ų | 109.7 | 69% | 0.691 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -62.1 | -34.9 | 174.3 | -73.8 | 174.4 | 95 | 179.2 | 7.2 | 112.3 | K47 L48 P49 K55 | K47-R51 WeakPolarHBondContact O-CB 3.48Å; K47-R51 VanDerWaalsContact O-CG 3.23Å; K47-R51 WeakPolarHBondContact O-CG 3.5Å; K47-R51 PolarHBondContact O-N 2.94Å; L48-R51 PolarHBondContact O-N 2.99Å; P49-R51 PolarHBondContact O-N 3.42Å; R51-K55 VanDerWaalsContact O-CB 3.25Å; R51-K55 WeakPolarHBondContact O-CB 3.48Å; R51-K55 PolarHBondContact O-N 3.44Å |
| 52 | L | 94.9 | Very high | 85.4 | Confident | 120 Ų | 120 | 109.7 Ų | 109.7 | 63% | 0.628 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -73.8 | -42.7 | 178.2 | -173.2 | 63.8 | 0 | 0 | 0 | 112.2 | L48 P49 H50 K55 K56 | L48-L52 PolarHBondContact O-N 3.37Å; P49-L52 PolarHBondContact O-N 2.94Å; P49-L52 VanDerWaalsContact O-N 3.12Å; H50-L52 VanDerWaalsContact C-N 3.3Å; H50-L52 PolarHBondContact O-N 3.46Å; L52-K55 PolarHBondContact O-N 3.16Å; L52-K56 PolarHBondContact O-N 2.86Å |
| 53 | I | 95.1 | Very high | 87.4 | Confident | 118 Ų | 118 | 112 Ų | 112 | 61% | 0.605 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -61.5 | -48.8 | 175.3 | -67.9 | 163.3 | 0 | 0 | 0 | 110.2 | P49 H50 K55 K56 R57 | P49-I53 VanDerWaalsContact O-CG1 3.3Å; P49-I53 WeakPolarHBondContact O-CG1 3.4Å; P49-I53 PolarHBondContact O-N 3.38Å; H50-I53 PolarHBondContact O-N 3.23Å; I53-K55 VanDerWaalsContact C-N 3.34Å; I53-K55 PolarHBondContact O-N 3.26Å; I53-K56 PolarHBondContact O-N 2.97Å; I53-R57 PolarHBondContact O-N 3.43Å |
| 54 | E | 96.9 | Very high | 89.3 | Confident | 47 Ų | 47 | 108.5 Ų | 108.5 | 22% | 0.22 | 51% | 0.507 | C | S | . | . | H | α-helix | trans | -68.6 | -31.3 | 178.6 | 167.8 | 52.9 | -161.5 | 0 | 0 | 112.1 | H50 R57 R58 | H50-E54 WeakPolarHBondContact O-CB 3.25Å; H50-E54 PolarHBondContact O-N 3.38Å; E54-R57 PolarHBondContact O-N 3.4Å; E54-R57 IonicContact OE1-NH1 2.75Å; E54-R57 PolarHBondContact OE1-NH1 2.89Å; E54-R57 WeakPolarHBondContact OE2-CD 3.38Å; E54-R57 IonicContact OE2-CZ 2.81Å; E54-R57 IonicContact OE2-NE 3.23Å; E54-R57 IonicContact OE2-NH1 3.95Å; E54-R57 PolarHBondContact OE2-NH1 3Å; E54-R58 WeakPolarHBondContact O-CG 3.13Å; E54-R58 PolarHBondContact O-N 3.4Å; E54-R58 WeakPolarHBondContact OE1-CD 3.34Å; E54-R58 WeakPolarHBondContact OE1-CG 3.31Å; E54-R58 IonicContact OE1-CZ 3.16Å; E54-R58 IonicContact OE1-NE 3.12Å; E54-R58 IonicContact OE1-NH1 2.78Å; E54-R58 PolarHBondContact OE1-NH1 2.94Å |
| 55 | K | 96.4 | Very high | 91.1 | Very high | 114 Ų | 114 | 106.5 Ų | 106.5 | 50% | 0.496 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -60 | -53.6 | 167.3 | -177.2 | -175.1 | 173 | -173 | 0 | 110.5 | R51 L52 I53 R57 R58 D59 | R51-K55 VanDerWaalsContact O-CB 3.25Å; R51-K55 WeakPolarHBondContact O-CB 3.48Å; R51-K55 PolarHBondContact O-N 3.44Å; L52-K55 PolarHBondContact O-N 3.16Å; I53-K55 VanDerWaalsContact C-N 3.34Å; I53-K55 PolarHBondContact O-N 3.26Å; K55-R57 VanDerWaalsContact C-N 3.25Å; K55-R57 PolarHBondContact O-N 2.84Å; K55-R58 PolarHBondContact O-N 3.44Å; K55-D59 WeakPolarHBondContact CE-OD2 3.49Å; K55-D59 WeakPolarHBondContact CG-OD2 3.49Å; K55-D59 PolarHBondContact O-N 2.84Å |
| 56 | K | 97.1 | Very high | 92.7 | Very high | 164 Ų | 164 | 104.8 Ų | 104.8 | 71% | 0.713 | 48% | 0.484 | S | S | * | . | H | α-helix | trans | -57.4 | -37.6 | 179 | -173.4 | 178.1 | -179.9 | -179.9 | 0 | 112.3 | L52 I53 R60 | L52-K56 PolarHBondContact O-N 2.86Å; I53-K56 PolarHBondContact O-N 2.97Å; K56-R60 PolarHBondContact O-N 3.19Å; K56-R60 VanDerWaalsContact O-N 3.11Å |
| 57 | R | 98.2 | Very high | 94.2 | Very high | 140 Ų | 140 | 101.1 Ų | 101.1 | 53% | 0.528 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -62 | -48.2 | 173.3 | 175.3 | 177.3 | 160.2 | -82.1 | -6.8 | 111.8 | I53 E54 K55 R60 I61 | I53-R57 PolarHBondContact O-N 3.43Å; E54-R57 PolarHBondContact O-N 3.4Å; E54-R57 IonicContact OE1-NH1 2.75Å; E54-R57 PolarHBondContact OE1-NH1 2.89Å; E54-R57 WeakPolarHBondContact OE2-CD 3.38Å; E54-R57 IonicContact OE2-CZ 2.81Å; E54-R57 IonicContact OE2-NE 3.23Å; E54-R57 IonicContact OE2-NH1 3.95Å; E54-R57 PolarHBondContact OE2-NH1 3Å; K55-R57 VanDerWaalsContact C-N 3.25Å; K55-R57 PolarHBondContact O-N 2.84Å; R57-R60 PolarHBondContact O-N 3.18Å; R57-I61 HydrophobicContact CG-CD1 4Å; R57-I61 WeakPolarHBondContact O-CG1 3.31Å; R57-I61 PolarHBondContact O-N 3.16Å |
| 58 | R | 98.3 | Very high | 95.3 | Very high | 121 Ų | 121 | 98.8 Ų | 98.8 | 46% | 0.457 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -64.9 | -39.7 | 177.5 | -73.5 | -170.2 | -62.1 | -107.3 | 1.2 | 112.8 | E54 K55 R60 I61 N62 | E54-R58 WeakPolarHBondContact O-CG 3.13Å; E54-R58 PolarHBondContact O-N 3.4Å; E54-R58 WeakPolarHBondContact OE1-CD 3.34Å; E54-R58 WeakPolarHBondContact OE1-CG 3.31Å; E54-R58 IonicContact OE1-CZ 3.16Å; E54-R58 IonicContact OE1-NE 3.12Å; E54-R58 IonicContact OE1-NH1 2.78Å; E54-R58 PolarHBondContact OE1-NH1 2.94Å; K55-R58 PolarHBondContact O-N 3.44Å; R58-R60 VanDerWaalsContact C-N 3.35Å; R58-R60 PolarHBondContact O-N 3.05Å; R58-I61 PolarHBondContact O-N 2.91Å; R58-N62 PolarHBondContact O-N 2.94Å; R58-N62 PolarHBondContact O-ND2 3.49Å; R58-N62 VanDerWaalsContact O-ND2 3.14Å |
| 59 | D | 97.8 | Very high | 96.1 | Very high | 79 Ų | 79 | 96.6 Ų | 96.6 | 42% | 0.422 | 45% | 0.452 | S | S | . | . | H | α-helix | trans | -60.6 | -46.3 | 178.4 | -63.4 | -17.9 | 0 | 0 | 0 | 110 | K55 I61 N62 E63 | K55-D59 WeakPolarHBondContact CE-OD2 3.49Å; K55-D59 WeakPolarHBondContact CG-OD2 3.49Å; K55-D59 PolarHBondContact O-N 2.84Å; D59-I61 PolarHBondContact O-N 3.31Å; D59-N62 PolarHBondContact O-N 3.14Å; D59-E63 PolarHBondContact O-N 3.05Å |
| 60 | R | 98.4 | Very high | 96.4 | Very high | 174 Ų | 174 | 99 Ų | 99 | 66% | 0.657 | 46% | 0.461 | S | S | * | . | H | α-helix | trans | -61 | -40.3 | 172.4 | -179 | 177.6 | 174.6 | -108.1 | -1.3 | 113.6 | K56 R57 R58 N62 E63 C64 | K56-R60 PolarHBondContact O-N 3.19Å; K56-R60 VanDerWaalsContact O-N 3.11Å; R57-R60 PolarHBondContact O-N 3.18Å; R58-R60 VanDerWaalsContact C-N 3.35Å; R58-R60 PolarHBondContact O-N 3.05Å; R60-N62 VanDerWaalsContact C-N 3.34Å; R60-E63 PolarHBondContact O-N 3.3Å; R60-C64 PolarHBondContact O-N 2.79Å; R60-C64 PolarHBondContact O-SG 3.49Å; R60-C64 VanDerWaalsContact O-SG 3.36Å |
| 61 | I | 97.9 | Very high | 96.4 | Very high | 68 Ų | 68 | 99.9 Ų | 99.9 | 35% | 0.349 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -64.1 | -41.9 | 176.5 | -70.7 | 166 | 0 | 0 | 0 | 110.6 | R57 R58 D59 E63 C64 I65 | R57-I61 HydrophobicContact CG-CD1 4Å; R57-I61 WeakPolarHBondContact O-CG1 3.31Å; R57-I61 PolarHBondContact O-N 3.16Å; R58-I61 PolarHBondContact O-N 2.91Å; D59-I61 PolarHBondContact O-N 3.31Å; I61-E63 VanDerWaalsContact C-N 3.35Å; I61-C64 PolarHBondContact O-N 3.33Å; I61-I65 HydrophobicContact CG2-CD1 3.84Å; I61-I65 VanDerWaalsContact O-CG1 3.31Å; I61-I65 WeakPolarHBondContact O-CG1 3.43Å; I61-I65 PolarHBondContact O-N 2.79Å |
| 62 | N | 97.7 | Very high | 96.5 | Very high | 67 Ų | 67 | 91.4 Ų | 91.4 | 36% | 0.358 | 44% | 0.438 | S | S | . | . | H | α-helix | trans | -65.7 | -38.1 | 177.8 | -64.9 | -32 | 0 | 0 | 0 | 111.9 | R58 D59 R60 I65 G66 K86 | R58-N62 PolarHBondContact O-N 2.94Å; R58-N62 PolarHBondContact O-ND2 3.49Å; R58-N62 VanDerWaalsContact O-ND2 3.14Å; D59-N62 PolarHBondContact O-N 3.14Å; R60-N62 VanDerWaalsContact C-N 3.34Å; N62-I65 PolarHBondContact O-N 3.39Å; N62-G66 PolarHBondContact O-N 2.92Å; N62-K86 PolarHBondContact OD1-NZ 3.08Å |
| 63 | E | 98.1 | Very high | 96.4 | Very high | 121 Ų | 121 | 87 Ų | 87 | 57% | 0.565 | 42% | 0.416 | S | S | * | . | H | α-helix | trans | -60.2 | -49.4 | 173.4 | -179.4 | 176.5 | -145.6 | 0 | 0 | 111.6 | D59 R60 I61 I65 G66 Q67 | D59-E63 PolarHBondContact O-N 3.05Å; R60-E63 PolarHBondContact O-N 3.3Å; I61-E63 VanDerWaalsContact C-N 3.35Å; E63-I65 VanDerWaalsContact C-N 3.33Å; E63-I65 PolarHBondContact O-N 3.48Å; E63-G66 WeakPolarHBondContact O-CA 3.15Å; E63-G66 PolarHBondContact O-N 3.45Å; E63-G66 VanDerWaalsContact O-N 3.09Å; E63-Q67 WeakPolarHBondContact O-CG 3.4Å; E63-Q67 PolarHBondContact O-N 3.14Å |
| 64 | C | 98.1 | Very high | 96.2 | Very high | 51 Ų | 51 | 86.9 Ų | 86.9 | 35% | 0.345 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -62.4 | -37.1 | 175.9 | -64 | 0 | 0 | 0 | 0 | 112.8 | R60 I61 G66 Q67 L68 | R60-C64 PolarHBondContact O-N 2.79Å; R60-C64 PolarHBondContact O-SG 3.49Å; R60-C64 VanDerWaalsContact O-SG 3.36Å; I61-C64 PolarHBondContact O-N 3.33Å; C64-G66 VanDerWaalsContact C-N 3.32Å; C64-Q67 PolarHBondContact O-N 2.99Å; C64-L68 WeakPolarHBondContact O-CG 3.38Å; C64-L68 PolarHBondContact O-N 3.3Å |
| 65 | I | 96.8 | Very high | 95.7 | Very high | 28 Ų | 28 | 91.1 Ų | 91.1 | 14% | 0.144 | 43% | 0.432 | C | S | . | . | H | α-helix | trans | -67.3 | -34.4 | 174.3 | -66.5 | 167.1 | 0 | 0 | 0 | 111.1 | I61 N62 E63 L68 K69 K86 V89 | I61-I65 HydrophobicContact CG2-CD1 3.84Å; I61-I65 VanDerWaalsContact O-CG1 3.31Å; I61-I65 WeakPolarHBondContact O-CG1 3.43Å; I61-I65 PolarHBondContact O-N 2.79Å; N62-I65 PolarHBondContact O-N 3.39Å; E63-I65 VanDerWaalsContact C-N 3.33Å; E63-I65 PolarHBondContact O-N 3.48Å; I65-L68 PolarHBondContact O-N 2.89Å; I65-K69 PolarHBondContact O-N 3.41Å; I65-K86 HydrophobicContact CD1-CD 4.16Å; I65-K86 HydrophobicContact CG2-CB 4.47Å; I65-K86 HydrophobicContact CG2-CG 4.26Å; I65-V89 HydrophobicContact CG2-CB 4.4Å; I65-V89 HydrophobicContact CG2-CG1 4.25Å |
| 66 | G | 95.4 | Very high | 95.3 | Very high | 29 Ų | 29 | 87.4 Ų | 87.4 | 30% | 0.299 | 42% | 0.418 | S | S | . | . | H | α-helix | trans | -61.3 | -49.7 | 170.6 | 0 | 0 | 0 | 0 | 0 | 112 | N62 E63 C64 L68 K69 D70 | N62-G66 PolarHBondContact O-N 2.92Å; E63-G66 WeakPolarHBondContact O-CA 3.15Å; E63-G66 PolarHBondContact O-N 3.45Å; E63-G66 VanDerWaalsContact O-N 3.09Å; C64-G66 VanDerWaalsContact C-N 3.32Å; G66-L68 VanDerWaalsContact C-N 3.33Å; G66-L68 PolarHBondContact O-N 3.45Å; G66-K69 WeakPolarHBondContact O-CA 3.47Å; G66-K69 VanDerWaalsContact O-CB 3.31Å; G66-K69 WeakPolarHBondContact O-CB 3.25Å; G66-K69 PolarHBondContact O-N 2.86Å; G66-D70 PolarHBondContact O-N 3.13Å |
| 67 | Q | 96.7 | Very high | 94.8 | Very high | 103 Ų | 103 | 80.9 Ų | 80.9 | 48% | 0.481 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -58.5 | -42.5 | 176.2 | -68.6 | 169.9 | -12 | 0 | 0 | 112.3 | E63 C64 K69 D70 L71 | E63-Q67 WeakPolarHBondContact O-CG 3.4Å; E63-Q67 PolarHBondContact O-N 3.14Å; C64-Q67 PolarHBondContact O-N 2.99Å; Q67-K69 VanDerWaalsContact C-N 3.35Å; Q67-K69 PolarHBondContact O-N 3.38Å; Q67-D70 PolarHBondContact O-N 2.88Å; Q67-L71 WeakPolarHBondContact O-CB 3.36Å; Q67-L71 VanDerWaalsContact O-CG 3.3Å; Q67-L71 WeakPolarHBondContact O-CG 3.45Å; Q67-L71 PolarHBondContact O-N 2.75Å |
| 68 | L | 96.4 | Very high | 94.1 | Very high | 57 Ų | 57 | 80.3 Ų | 80.3 | 30% | 0.298 | 40% | 0.396 | S | S | . | . | H | α-helix | trans | -61.3 | -42.1 | 173.3 | -72.1 | -179.6 | 0 | 0 | 0 | 112 | C64 I65 G66 D70 L71 L72 V89 L90 T93 | C64-L68 WeakPolarHBondContact O-CG 3.38Å; C64-L68 PolarHBondContact O-N 3.3Å; I65-L68 PolarHBondContact O-N 2.89Å; G66-L68 VanDerWaalsContact C-N 3.33Å; G66-L68 PolarHBondContact O-N 3.45Å; L68-D70 VanDerWaalsContact C-N 3.32Å; L68-D70 PolarHBondContact O-N 3.01Å; L68-L71 PolarHBondContact O-N 2.98Å; L68-L72 WeakPolarHBondContact O-CG 3.35Å; L68-L72 PolarHBondContact O-N 3.46Å; L68-V89 HydrophobicContact CB-CG1 3.95Å; L68-L90 HydrophobicContact CD1-CD2 4.11Å; L68-T93 HydrophobicContact CD1-CG2 4.49Å; L68-T93 HydrophobicContact CD2-CG2 3.99Å |
| 69 | K | 94.3 | Very high | 93.2 | Very high | 66 Ų | 66 | 79.2 Ų | 79.2 | 29% | 0.287 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -58.9 | -44.1 | 174.9 | -178.6 | -178.1 | 174.7 | 176 | 0 | 111.2 | I65 G66 Q67 L72 K77 G82 L84 V89 | I65-K69 PolarHBondContact O-N 3.41Å; G66-K69 WeakPolarHBondContact O-CA 3.47Å; G66-K69 VanDerWaalsContact O-CB 3.31Å; G66-K69 WeakPolarHBondContact O-CB 3.25Å; G66-K69 PolarHBondContact O-N 2.86Å; Q67-K69 VanDerWaalsContact C-N 3.35Å; Q67-K69 PolarHBondContact O-N 3.38Å; K69-L72 WeakPolarHBondContact O-CB 3.2Å; K69-L72 PolarHBondContact O-N 2.94Å; K69-K77 WeakPolarHBondContact O-CE 3.19Å; K69-G82 PolarHBondContact NZ-O 2.86Å; K69-L84 HydrophobicContact CD-CB 4.19Å; K69-L84 HydrophobicContact CD-CD1 4.28Å; K69-L84 HydrophobicContact CG-CB 4.46Å; K69-L84 HydrophobicContact CG-CD1 3.79Å; K69-V89 HydrophobicContact CB-CG1 4.07Å; K69-V89 HydrophobicContact CB-CG2 3.97Å; K69-V89 HydrophobicContact CD-CG2 4.48Å; K69-V89 HydrophobicContact CG-CG2 4.21Å |
| 70 | D | 93.7 | Very high | 92.2 | Very high | 113 Ų | 113 | 77.7 Ų | 77.7 | 60% | 0.604 | 40% | 0.401 | S | S | * | . | H | α-helix | trans | -70.8 | -35.7 | -176.3 | -64.3 | -27 | 0 | 0 | 0 | 112.2 | G66 Q67 L68 L72 K77 | G66-D70 PolarHBondContact O-N 3.13Å; Q67-D70 PolarHBondContact O-N 2.88Å; L68-D70 VanDerWaalsContact C-N 3.32Å; L68-D70 PolarHBondContact O-N 3.01Å; D70-L72 VanDerWaalsContact C-N 3.27Å; D70-L72 PolarHBondContact O-N 2.9Å; D70-K77 PolarHBondContact O-NZ 3.49Å |
| 71 | L | 94.9 | Very high | 91.1 | Very high | 135 Ų | 135 | 77.6 Ų | 77.6 | 71% | 0.707 | 41% | 0.412 | S | S | * | . | H | α-helix | trans | -69.4 | -15.5 | 175 | -71.7 | 170.6 | 0 | 0 | 0 | 114.4 | Q67 L68 | Q67-L71 WeakPolarHBondContact O-CB 3.36Å; Q67-L71 VanDerWaalsContact O-CG 3.3Å; Q67-L71 WeakPolarHBondContact O-CG 3.45Å; Q67-L71 PolarHBondContact O-N 2.75Å; L68-L71 PolarHBondContact O-N 2.98Å |
| 72 | L | 94.3 | Very high | 89.8 | Confident | 5 Ų | 5 | 76.1 Ų | 76.1 | 3% | 0.026 | 41% | 0.414 | C | S | . | . | S | Bend | trans | -66 | 141 | 178 | -76.6 | 171 | 0 | 0 | 0 | 112 | L68 K69 D70 L76 K77 L84 V89 L92 H96 | L68-L72 WeakPolarHBondContact O-CG 3.35Å; L68-L72 PolarHBondContact O-N 3.46Å; K69-L72 WeakPolarHBondContact O-CB 3.2Å; K69-L72 PolarHBondContact O-N 2.94Å; D70-L72 VanDerWaalsContact C-N 3.27Å; D70-L72 PolarHBondContact O-N 2.9Å; L72-L76 HydrophobicContact CD2-CD1 4.4Å; L72-K77 HydrophobicContact CB-CD 4.5Å; L72-K77 HydrophobicContact CB-CG 4.06Å; L72-K77 WeakPolarHBondContact O-CD 3.24Å; L72-K77 WeakPolarHBondContact O-CE 3.21Å; L72-K77 PolarHBondContact O-NZ 3.29Å; L72-L84 HydrophobicContact CD1-CD1 4.11Å; L72-V89 HydrophobicContact CD1-CG1 4.43Å; L72-L92 HydrophobicContact CD1-CB 3.77Å; L72-L92 HydrophobicContact CD1-CD1 4.24Å; L72-L92 HydrophobicContact CD2-CB 3.89Å; L72-H96 HydrophobicContact CD2-CB 4.29Å |
| 73 | P | 92.6 | Very high | 89.2 | Confident | 28 Ų | 28 | 80 Ų | 80 | 18% | 0.182 | 43% | 0.43 | C | S | . | . | trans | -56.2 | 140.5 | 169.1 | -25.8 | 32.8 | 0 | 0 | 0 | 113.3 | H75 L76 K77 | P73-H75 VanDerWaalsContact C-N 3.27Å; P73-H75 WeakPolarHBondContact CB-CE1 3.44Å; P73-H75 PolarHBondContact O-N 3.01Å; P73-L76 HydrophobicContact CB-CG 4.45Å; P73-L76 HydrophobicContact CG-CD1 4.33Å; P73-L76 WeakPolarHBondContact O-CB 3.46Å; P73-L76 PolarHBondContact O-N 3.14Å; P73-K77 PolarHBondContact O-N 3.49Å; P73-K77 VanDerWaalsContact O-N 3.15Å | ||
| 74 | E | 90.1 | Very high | 88.7 | Confident | 115 Ų | 115 | 75 Ų | 75 | 54% | 0.537 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -56.1 | -37.3 | -178.9 | -65.8 | -53.2 | 132.7 | 0 | 0 | 113.5 | L76 K77 L78 | E74-L76 VanDerWaalsContact C-N 3.26Å; E74-L76 PolarHBondContact O-N 3.16Å; E74-K77 PolarHBondContact O-N 3.38Å; E74-K77 VanDerWaalsContact OE1-CD 3.32Å; E74-K77 WeakPolarHBondContact OE1-CD 3.37Å; E74-K77 IonicContact OE1-NZ 3.71Å; E74-K77 PolarHBondContact OE1-NZ 2.89Å; E74-K77 WeakPolarHBondContact OE2-CD 3.47Å; E74-L78 WeakPolarHBondContact O-CB 3.41Å; E74-L78 VanDerWaalsContact O-CG 3.25Å; E74-L78 WeakPolarHBondContact O-CG 3.37Å; E74-L78 PolarHBondContact O-N 3.48Å |
| 75 | H | 87.4 | Confident | 88.5 | Confident | 135 Ų | 135 | 78.6 Ų | 78.6 | 63% | 0.625 | 42% | 0.419 | S | S | * | . | H | α-helix | trans | -63.8 | -29.4 | 177 | 62.5 | -98.3 | 0 | 0 | 0 | 113.1 | P73 S79 | P73-H75 VanDerWaalsContact C-N 3.27Å; P73-H75 WeakPolarHBondContact CB-CE1 3.44Å; P73-H75 PolarHBondContact O-N 3.01Å; H75-S79 PolarHBondContact O-N 2.79Å |
| 76 | L | 86.4 | Confident | 88.4 | Confident | 36 Ų | 36 | 82.9 Ų | 82.9 | 19% | 0.188 | 44% | 0.436 | C | S | . | . | H | α-helix | trans | -78 | -38.9 | 173.2 | -63 | -174.9 | 0 | 0 | 0 | 111.5 | L72 P73 E74 S79 L92 H96 | L72-L76 HydrophobicContact CD2-CD1 4.4Å; P73-L76 HydrophobicContact CB-CG 4.45Å; P73-L76 HydrophobicContact CG-CD1 4.33Å; P73-L76 WeakPolarHBondContact O-CB 3.46Å; P73-L76 PolarHBondContact O-N 3.14Å; E74-L76 VanDerWaalsContact C-N 3.26Å; E74-L76 PolarHBondContact O-N 3.16Å; L76-S79 WeakPolarHBondContact O-CB 3.49Å; L76-S79 PolarHBondContact O-N 3.43Å; L76-L92 HydrophobicContact CB-CD1 4.26Å; L76-L92 HydrophobicContact CB-CD2 4.28Å; L76-L92 HydrophobicContact CD2-CD2 4.47Å; L76-L92 WeakPolarHBondContact O-CD1 3.38Å; L76-H96 HydrophobicContact CD1-CB 4.03Å |
| 77 | K | 86.8 | Confident | 88.4 | Confident | 28 Ų | 28 | 84.6 Ų | 84.6 | 12% | 0.122 | 45% | 0.448 | C | S | . | . | H | α-helix | trans | -61.7 | -43.9 | 175.2 | -69.4 | 162.2 | 167.2 | 154.7 | 0 | 112.3 | K69 D70 L72 P73 E74 S79 T80 G82 L84 | K69-K77 WeakPolarHBondContact O-CE 3.19Å; D70-K77 PolarHBondContact O-NZ 3.49Å; L72-K77 HydrophobicContact CB-CD 4.5Å; L72-K77 HydrophobicContact CB-CG 4.06Å; L72-K77 WeakPolarHBondContact O-CD 3.24Å; L72-K77 WeakPolarHBondContact O-CE 3.21Å; L72-K77 PolarHBondContact O-NZ 3.29Å; P73-K77 PolarHBondContact O-N 3.49Å; P73-K77 VanDerWaalsContact O-N 3.15Å; E74-K77 PolarHBondContact O-N 3.38Å; E74-K77 VanDerWaalsContact OE1-CD 3.32Å; E74-K77 WeakPolarHBondContact OE1-CD 3.37Å; E74-K77 IonicContact OE1-NZ 3.71Å; E74-K77 PolarHBondContact OE1-NZ 2.89Å; E74-K77 WeakPolarHBondContact OE2-CD 3.47Å; K77-S79 VanDerWaalsContact C-N 3.34Å; K77-S79 PolarHBondContact O-N 2.91Å; K77-T80 PolarHBondContact O-N 3.06Å; K77-T80 PolarHBondContact O-OG1 2.82Å; K77-G82 PolarHBondContact O-N 3.47Å; K77-L84 HydrophobicContact CB-CD1 4.35Å; K77-L84 HydrophobicContact CG-CD1 3.95Å |
| 78 | L | 83.6 | Confident | 88.3 | Confident | 128 Ų | 128 | 81.5 Ų | 81.5 | 67% | 0.67 | 44% | 0.436 | S | S | * | . | H | α-helix | trans | -71.1 | -26.8 | -177.2 | -69.7 | 169.7 | 0 | 0 | 0 | 113.2 | E74 T80 L81 | E74-L78 WeakPolarHBondContact O-CB 3.41Å; E74-L78 VanDerWaalsContact O-CG 3.25Å; E74-L78 WeakPolarHBondContact O-CG 3.37Å; E74-L78 PolarHBondContact O-N 3.48Å; L78-T80 PolarHBondContact O-N 3.32Å; L78-L81 PolarHBondContact O-N 3.26Å |
| 79 | S | 80.2 | Confident | 88.3 | Confident | 97 Ų | 97 | 78.9 Ų | 78.9 | 68% | 0.678 | 42% | 0.422 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -55.7 | -23.6 | 175.6 | -170.1 | 0 | 0 | 0 | 0 | 113.5 | H75 L76 K77 | H75-S79 PolarHBondContact O-N 2.79Å; L76-S79 WeakPolarHBondContact O-CB 3.49Å; L76-S79 PolarHBondContact O-N 3.43Å; K77-S79 VanDerWaalsContact C-N 3.34Å; K77-S79 PolarHBondContact O-N 2.91Å |
| 80 | T | 76.6 | Confident | 88.4 | Confident | 48 Ų | 48 | 80 Ų | 80 | 29% | 0.294 | 43% | 0.431 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -125.7 | 39.3 | -172 | 56.6 | 0 | 0 | 0 | 0 | 113.1 | K77 L78 G82 L84 V88 | K77-T80 PolarHBondContact O-N 3.06Å; K77-T80 PolarHBondContact O-OG1 2.82Å; L78-T80 PolarHBondContact O-N 3.32Å; T80-G82 PolarHBondContact O-N 3.39Å; T80-L84 WeakPolarHBondContact OG1-CD2 3.5Å; T80-V88 HydrophobicContact CG2-CG1 3.89Å |
| 81 | L | 75.1 | Confident | 88.5 | Confident | 171 Ų | 171 | 79.4 Ų | 79.4 | 90% | 0.895 | 42% | 0.424 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 59.5 | 19.6 | 173.1 | -155.8 | 77.3 | 0 | 0 | 0 | 114.4 | L78 H83 | L78-L81 PolarHBondContact O-N 3.26Å; L81-H83 PolarHBondContact O-N 2.99Å |
| 82 | G | 71.7 | Confident | 88.5 | Confident | 38 Ų | 38 | 73.5 Ų | 73.5 | 39% | 0.392 | 39% | 0.393 | S | S | . | . | S | Bend | trans | 70.1 | -23.4 | 179.1 | 0 | 0 | 0 | 0 | 0 | 116.3 | K69 K77 T80 L84 | K69-G82 PolarHBondContact NZ-O 2.86Å; K77-G82 PolarHBondContact O-N 3.47Å; T80-G82 PolarHBondContact O-N 3.39Å; G82-L84 VanDerWaalsContact C-N 3.29Å; G82-L84 PolarHBondContact O-N 2.98Å |
| 83 | H | 84 | Confident | 88.6 | Confident | 148 Ų | 148 | 74.2 Ų | 74.2 | 69% | 0.685 | 40% | 0.398 | S | S | * | . | trans | -84 | 72.2 | 173.1 | -163.4 | 79.3 | 0 | 0 | 0 | 111.4 | L81 E85 | L81-H83 PolarHBondContact O-N 2.99Å; H83-E85 PolarHBondContact O-N 2.78Å | ||
| 84 | L | 88.5 | Confident | 88.9 | Confident | 15 Ų | 15 | 77.7 Ų | 77.7 | 8% | 0.079 | 41% | 0.414 | C | S | . | . | trans | -66.6 | 110.8 | 174.7 | -74.1 | 169.6 | 0 | 0 | 0 | 111.9 | K69 L72 K77 T80 G82 V88 V89 L92 | K69-L84 HydrophobicContact CD-CB 4.19Å; K69-L84 HydrophobicContact CD-CD1 4.28Å; K69-L84 HydrophobicContact CG-CB 4.46Å; K69-L84 HydrophobicContact CG-CD1 3.79Å; L72-L84 HydrophobicContact CD1-CD1 4.11Å; K77-L84 HydrophobicContact CB-CD1 4.35Å; K77-L84 HydrophobicContact CG-CD1 3.95Å; T80-L84 WeakPolarHBondContact OG1-CD2 3.5Å; G82-L84 VanDerWaalsContact C-N 3.29Å; G82-L84 PolarHBondContact O-N 2.98Å; L84-V88 HydrophobicContact CD2-CB 4.08Å; L84-V88 HydrophobicContact CD2-CG1 3.46Å; L84-V88 VanDerWaalsContact CD2-CG1 3.46Å; L84-V89 HydrophobicContact CB-CG2 3.68Å; L84-V89 HydrophobicContact CD1-CG2 4.43Å; L84-L92 HydrophobicContact CD2-CD1 3.45Å; L84-L92 VanDerWaalsContact CD2-CD1 3.45Å | ||
| 85 | E | 93.7 | Very high | 89.1 | Confident | 128 Ų | 128 | 77.4 Ų | 77.4 | 60% | 0.598 | 41% | 0.411 | S | S | * | . | trans | -66.1 | 157.8 | 164.6 | -60.9 | -168.7 | 168.9 | 0 | 0 | 111.3 | H83 A87 V88 V89 | H83-E85 PolarHBondContact O-N 2.78Å; E85-A87 VanDerWaalsContact C-N 3.29Å; E85-A87 PolarHBondContact O-N 3.42Å; E85-V88 HydrophobicContact CB-CG2 4.14Å; E85-V88 PolarHBondContact O-N 3.36Å; E85-V89 WeakPolarHBondContact O-CG2 3.47Å; E85-V89 PolarHBondContact O-N 2.94Å | ||
| 86 | K | 94.9 | Very high | 89.5 | Confident | 117 Ų | 117 | 73.3 Ų | 73.3 | 51% | 0.509 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -58.6 | -37.6 | -176.1 | -61.1 | -172.7 | -175.5 | -179.3 | 0 | 113.6 | N62 I65 L90 | N62-K86 PolarHBondContact OD1-NZ 3.08Å; I65-K86 HydrophobicContact CD1-CD 4.16Å; I65-K86 HydrophobicContact CG2-CB 4.47Å; I65-K86 HydrophobicContact CG2-CG 4.26Å; K86-L90 WeakPolarHBondContact O-CG 3.42Å; K86-L90 PolarHBondContact O-N 2.86Å |
| 87 | A | 95.3 | Very high | 90.1 | Very high | 66 Ų | 66 | 76 Ų | 76 | 55% | 0.545 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -65.1 | -44.3 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.2 | E85 L90 E91 | E85-A87 VanDerWaalsContact C-N 3.29Å; E85-A87 PolarHBondContact O-N 3.42Å; A87-L90 PolarHBondContact O-N 2.7Å; A87-E91 PolarHBondContact O-N 2.9Å |
| 88 | V | 94.8 | Very high | 90.6 | Very high | 38 Ų | 38 | 79.2 Ų | 79.2 | 23% | 0.23 | 43% | 0.425 | C | S | . | . | H | α-helix | trans | -66.2 | -38.3 | 179.4 | -172.1 | 0 | 0 | 0 | 0 | 111.6 | T80 L84 E85 L90 E91 L92 | T80-V88 HydrophobicContact CG2-CG1 3.89Å; L84-V88 HydrophobicContact CD2-CB 4.08Å; L84-V88 HydrophobicContact CD2-CG1 3.46Å; L84-V88 VanDerWaalsContact CD2-CG1 3.46Å; E85-V88 HydrophobicContact CB-CG2 4.14Å; E85-V88 PolarHBondContact O-N 3.36Å; V88-L90 VanDerWaalsContact C-N 3.34Å; V88-L90 PolarHBondContact O-N 2.79Å; V88-E91 PolarHBondContact O-N 3.13Å; V88-L92 HydrophobicContact CG1-CD1 4.04Å; V88-L92 HydrophobicContact CG1-CG 4.2Å; V88-L92 WeakPolarHBondContact O-CB 3.31Å; V88-L92 VanDerWaalsContact O-CG 3.31Å; V88-L92 WeakPolarHBondContact O-CG 3.38Å; V88-L92 PolarHBondContact O-N 2.91Å |
| 89 | V | 95.1 | Very high | 91.2 | Very high | 2 Ų | 2 | 75.7 Ų | 75.7 | 1% | 0.012 | 42% | 0.415 | C | S | . | . | H | α-helix | trans | -56.1 | -49.1 | 171.3 | 176.7 | 0 | 0 | 0 | 0 | 110.7 | I65 L68 K69 L72 L84 E85 T93 | I65-V89 HydrophobicContact CG2-CB 4.4Å; I65-V89 HydrophobicContact CG2-CG1 4.25Å; L68-V89 HydrophobicContact CB-CG1 3.95Å; K69-V89 HydrophobicContact CB-CG1 4.07Å; K69-V89 HydrophobicContact CB-CG2 3.97Å; K69-V89 HydrophobicContact CD-CG2 4.48Å; K69-V89 HydrophobicContact CG-CG2 4.21Å; L72-V89 HydrophobicContact CD1-CG1 4.43Å; L84-V89 HydrophobicContact CB-CG2 3.68Å; L84-V89 HydrophobicContact CD1-CG2 4.43Å; E85-V89 WeakPolarHBondContact O-CG2 3.47Å; E85-V89 PolarHBondContact O-N 2.94Å; V89-T93 VanDerWaalsContact O-CB 3.32Å; V89-T93 WeakPolarHBondContact O-CB 3.48Å; V89-T93 PolarHBondContact O-N 2.78Å; V89-T93 PolarHBondContact O-OG1 2.98Å |
| 90 | L | 96.9 | Very high | 92 | Very high | 90 Ų | 90 | 75 Ų | 75 | 47% | 0.471 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -66.2 | -40.9 | -178.5 | -66.6 | 171.8 | 0 | 0 | 0 | 112 | L68 K86 A87 V88 T93 L94 | L68-L90 HydrophobicContact CD1-CD2 4.11Å; K86-L90 WeakPolarHBondContact O-CG 3.42Å; K86-L90 PolarHBondContact O-N 2.86Å; A87-L90 PolarHBondContact O-N 2.7Å; V88-L90 VanDerWaalsContact C-N 3.34Å; V88-L90 PolarHBondContact O-N 2.79Å; L90-T93 PolarHBondContact O-N 3.28Å; L90-L94 PolarHBondContact O-N 3.46Å |
| 91 | E | 95.6 | Very high | 93 | Very high | 99 Ų | 99 | 76.9 Ų | 76.9 | 46% | 0.463 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -65.4 | -45.4 | 177.7 | -167.9 | -166.9 | 146.2 | 0 | 0 | 112.2 | A87 V88 T93 L94 K95 | A87-E91 PolarHBondContact O-N 2.9Å; V88-E91 PolarHBondContact O-N 3.13Å; E91-T93 VanDerWaalsContact C-N 3.31Å; E91-T93 PolarHBondContact O-N 2.59Å; E91-L94 PolarHBondContact O-N 2.98Å; E91-K95 WeakPolarHBondContact O-CG 3.3Å; E91-K95 PolarHBondContact O-N 3.05Å; E91-K95 WeakPolarHBondContact OE1-CE 3.4Å; E91-K95 IonicContact OE1-NZ 3.49Å; E91-K95 PolarHBondContact OE1-NZ 2.74Å |
| 92 | L | 95.5 | Very high | 94 | Very high | 11 Ų | 11 | 70.9 Ų | 70.9 | 6% | 0.058 | 39% | 0.389 | C | S | . | . | H | α-helix | trans | -66.6 | -34.6 | 175.4 | -68 | 179.4 | 0 | 0 | 0 | 111.9 | L72 L76 L84 V88 K95 H96 | L72-L92 HydrophobicContact CD1-CB 3.77Å; L72-L92 HydrophobicContact CD1-CD1 4.24Å; L72-L92 HydrophobicContact CD2-CB 3.89Å; L76-L92 HydrophobicContact CB-CD1 4.26Å; L76-L92 HydrophobicContact CB-CD2 4.28Å; L76-L92 HydrophobicContact CD2-CD2 4.47Å; L76-L92 WeakPolarHBondContact O-CD1 3.38Å; L84-L92 HydrophobicContact CD2-CD1 3.45Å; L84-L92 VanDerWaalsContact CD2-CD1 3.45Å; V88-L92 HydrophobicContact CG1-CD1 4.04Å; V88-L92 HydrophobicContact CG1-CG 4.2Å; V88-L92 WeakPolarHBondContact O-CB 3.31Å; V88-L92 VanDerWaalsContact O-CG 3.31Å; V88-L92 WeakPolarHBondContact O-CG 3.38Å; V88-L92 PolarHBondContact O-N 2.91Å; L92-K95 HydrophobicContact CD2-CD 4.37Å; L92-K95 PolarHBondContact O-N 3.16Å; L92-H96 WeakPolarHBondContact O-CB 3.48Å; L92-H96 PolarHBondContact O-N 3.12Å |
| 93 | T | 96.8 | Very high | 95.2 | Very high | 20 Ų | 20 | 73.2 Ų | 73.2 | 12% | 0.123 | 40% | 0.396 | C | S | . | . | H | α-helix | trans | -63.1 | -44.8 | 174.3 | -59.4 | 0 | 0 | 0 | 0 | 110.1 | L68 V89 L90 E91 H96 L97 | L68-T93 HydrophobicContact CD1-CG2 4.49Å; L68-T93 HydrophobicContact CD2-CG2 3.99Å; V89-T93 VanDerWaalsContact O-CB 3.32Å; V89-T93 WeakPolarHBondContact O-CB 3.48Å; V89-T93 PolarHBondContact O-N 2.78Å; V89-T93 PolarHBondContact O-OG1 2.98Å; L90-T93 PolarHBondContact O-N 3.28Å; E91-T93 VanDerWaalsContact C-N 3.31Å; E91-T93 PolarHBondContact O-N 2.59Å; T93-H96 PolarHBondContact O-N 3.41Å; T93-L97 HydrophobicContact CG2-CD1 4.02Å; T93-L97 HydrophobicContact CG2-CG 4.38Å; T93-L97 WeakPolarHBondContact O-CB 3.09Å; T93-L97 VanDerWaalsContact O-CG 3.31Å; T93-L97 WeakPolarHBondContact O-CG 3.49Å; T93-L97 PolarHBondContact O-N 2.96Å |
| 94 | L | 97.1 | Very high | 95.8 | Very high | 101 Ų | 101 | 70.3 Ų | 70.3 | 53% | 0.529 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -62.1 | -44.8 | 175.7 | -178.6 | 62 | 0 | 0 | 0 | 111.9 | L90 E91 H96 L97 N98 | L90-L94 PolarHBondContact O-N 3.46Å; E91-L94 PolarHBondContact O-N 2.98Å; L94-H96 VanDerWaalsContact C-N 3.33Å; L94-H96 PolarHBondContact O-N 2.68Å; L94-L97 PolarHBondContact O-N 3.29Å; L94-N98 WeakPolarHBondContact O-CB 3.32Å; L94-N98 VanDerWaalsContact O-CG 3.26Å; L94-N98 PolarHBondContact O-N 2.96Å |
| 95 | K | 95.4 | Very high | 96.2 | Very high | 109 Ų | 109 | 74.7 Ų | 74.7 | 47% | 0.474 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -59.4 | -42.8 | 175 | -73.4 | 173.1 | -178.3 | 171.7 | 0 | 111.9 | E91 L92 A99 | E91-K95 WeakPolarHBondContact O-CG 3.3Å; E91-K95 PolarHBondContact O-N 3.05Å; E91-K95 WeakPolarHBondContact OE1-CE 3.4Å; E91-K95 IonicContact OE1-NZ 3.49Å; E91-K95 PolarHBondContact OE1-NZ 2.74Å; L92-K95 HydrophobicContact CD2-CD 4.37Å; L92-K95 PolarHBondContact O-N 3.16Å; K95-A99 PolarHBondContact O-N 3.01Å; K95-A99 VanDerWaalsContact O-N 3.09Å |
| 96 | H | 96.3 | Very high | 96.3 | Very high | 50 Ų | 50 | 74.7 Ų | 74.7 | 23% | 0.231 | 41% | 0.409 | C | S | . | . | H | α-helix | trans | -66.8 | -45.2 | 177.6 | -175.6 | 40.9 | 0 | 0 | 0 | 112.3 | L72 L76 L92 T93 L94 N98 A99 L100 | L72-H96 HydrophobicContact CD2-CB 4.29Å; L76-H96 HydrophobicContact CD1-CB 4.03Å; L92-H96 WeakPolarHBondContact O-CB 3.48Å; L92-H96 PolarHBondContact O-N 3.12Å; T93-H96 PolarHBondContact O-N 3.41Å; L94-H96 VanDerWaalsContact C-N 3.33Å; L94-H96 PolarHBondContact O-N 2.68Å; H96-N98 PolarHBondContact O-N 3.49Å; H96-A99 PolarHBondContact O-N 2.88Å; H96-L100 WeakPolarHBondContact O-CG 3.27Å; H96-L100 PolarHBondContact O-N 2.88Å |
| 97 | L | 97.4 | Very high | 96.3 | Very high | 92 Ų | 92 | 74.9 Ų | 74.9 | 48% | 0.482 | 41% | 0.411 | S | S | . | . | H | α-helix | trans | -61 | -43.7 | 176.4 | -72.5 | 173.1 | 0 | 0 | 0 | 111.7 | T93 L94 A99 L100 T101 | T93-L97 HydrophobicContact CG2-CD1 4.02Å; T93-L97 HydrophobicContact CG2-CG 4.38Å; T93-L97 WeakPolarHBondContact O-CB 3.09Å; T93-L97 VanDerWaalsContact O-CG 3.31Å; T93-L97 WeakPolarHBondContact O-CG 3.49Å; T93-L97 PolarHBondContact O-N 2.96Å; L94-L97 PolarHBondContact O-N 3.29Å; L97-A99 VanDerWaalsContact C-N 3.32Å; L97-A99 PolarHBondContact O-N 3.21Å; L97-L100 PolarHBondContact O-N 3.49Å; L97-T101 WeakPolarHBondContact O-CB 3.44Å; L97-T101 PolarHBondContact O-N 3.46Å; L97-T101 PolarHBondContact O-OG1 3.45Å |
| 98 | N | 97.2 | Very high | 96.3 | Very high | 96 Ų | 96 | 77.1 Ų | 77.1 | 51% | 0.513 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -61.8 | -40.2 | 176.2 | -71.3 | -8.7 | 0 | 0 | 0 | 111.9 | L94 H96 T101 A102 | L94-N98 WeakPolarHBondContact O-CB 3.32Å; L94-N98 VanDerWaalsContact O-CG 3.26Å; L94-N98 PolarHBondContact O-N 2.96Å; H96-N98 PolarHBondContact O-N 3.49Å; N98-T101 PolarHBondContact O-N 3.06Å; N98-A102 WeakPolarHBondContact O-CB 3.32Å; N98-A102 PolarHBondContact O-N 3.39Å |
| 99 | A | 96.4 | Very high | 96.3 | Very high | 54 Ų | 54 | 80.3 Ų | 80.3 | 45% | 0.446 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -64.8 | -42.1 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | K95 H96 L97 A102 V103 | K95-A99 PolarHBondContact O-N 3.01Å; K95-A99 VanDerWaalsContact O-N 3.09Å; H96-A99 PolarHBondContact O-N 2.88Å; L97-A99 VanDerWaalsContact C-N 3.32Å; L97-A99 PolarHBondContact O-N 3.21Å; A99-A102 PolarHBondContact O-N 3.17Å; A99-V103 WeakPolarHBondContact O-CG2 3.25Å; A99-V103 PolarHBondContact O-N 3.48Å |
| 100 | L | 97.3 | Very high | 96 | Very high | 83 Ų | 83 | 87.3 Ų | 87.3 | 44% | 0.435 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -64.6 | -41 | 175.5 | -71.5 | 177 | 0 | 0 | 0 | 112.3 | H96 L97 V103 T104 | H96-L100 WeakPolarHBondContact O-CG 3.27Å; H96-L100 PolarHBondContact O-N 2.88Å; L97-L100 PolarHBondContact O-N 3.49Å; L100-V103 PolarHBondContact O-N 3.04Å; L100-T104 WeakPolarHBondContact O-CB 2.99Å; L100-T104 PolarHBondContact O-N 2.92Å; L100-T104 PolarHBondContact O-OG1 3.25Å |
| 101 | T | 97.4 | Very high | 95.8 | Very high | 87 Ų | 87 | 86.3 Ų | 86.3 | 53% | 0.534 | 45% | 0.447 | S | S | . | . | H | α-helix | trans | -62 | -47 | 174.8 | -60.7 | 0 | 0 | 0 | 0 | 110.8 | L97 N98 V103 T104 E105 | L97-T101 WeakPolarHBondContact O-CB 3.44Å; L97-T101 PolarHBondContact O-N 3.46Å; L97-T101 PolarHBondContact O-OG1 3.45Å; N98-T101 PolarHBondContact O-N 3.06Å; T101-V103 PolarHBondContact O-N 3.49Å; T101-T104 WeakPolarHBondContact O-CB 3.4Å; T101-T104 PolarHBondContact O-N 3.13Å; T101-T104 VanDerWaalsContact O-N 3.15Å; T101-E105 WeakPolarHBondContact O-CB 3.4Å; T101-E105 PolarHBondContact O-N 3.11Å |
| 102 | A | 97.4 | Very high | 95.5 | Very high | 44 Ų | 44 | 84.4 Ų | 84.4 | 36% | 0.364 | 44% | 0.44 | S | S | . | . | H | α-helix | trans | -60.8 | -41.4 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.7 | N98 A99 E105 Q106 | N98-A102 WeakPolarHBondContact O-CB 3.32Å; N98-A102 PolarHBondContact O-N 3.39Å; A99-A102 PolarHBondContact O-N 3.17Å; A102-E105 PolarHBondContact O-N 3.37Å; A102-Q106 WeakPolarHBondContact O-CB 3.43Å; A102-Q106 WeakPolarHBondContact O-CG 3.28Å; A102-Q106 PolarHBondContact O-N 3.49Å |
| 103 | V | 96.8 | Very high | 95.1 | Very high | 87 Ų | 87 | 86 Ų | 86 | 53% | 0.527 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -65.2 | -40.4 | 174.7 | 170.3 | 0 | 0 | 0 | 0 | 111.4 | A99 L100 T101 Q106 Q107 | A99-V103 WeakPolarHBondContact O-CG2 3.25Å; A99-V103 PolarHBondContact O-N 3.48Å; L100-V103 PolarHBondContact O-N 3.04Å; T101-V103 PolarHBondContact O-N 3.49Å; V103-Q106 PolarHBondContact O-N 3.49Å; V103-Q107 WeakPolarHBondContact O-CB 3.04Å; V103-Q107 PolarHBondContact O-N 2.88Å |
| 104 | T | 96.8 | Very high | 94.5 | Very high | 87 Ų | 87 | 89.9 Ų | 89.9 | 53% | 0.534 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -66.4 | -40.7 | 178.2 | -58 | 0 | 0 | 0 | 0 | 111.1 | L100 T101 Q107 H108 | L100-T104 WeakPolarHBondContact O-CB 2.99Å; L100-T104 PolarHBondContact O-N 2.92Å; L100-T104 PolarHBondContact O-OG1 3.25Å; T101-T104 WeakPolarHBondContact O-CB 3.4Å; T101-T104 PolarHBondContact O-N 3.13Å; T101-T104 VanDerWaalsContact O-N 3.15Å; T104-Q107 PolarHBondContact O-N 2.89Å; T104-H108 WeakPolarHBondContact O-CB 3.41Å; T104-H108 PolarHBondContact O-N 3.36Å |
| 105 | E | 95.8 | Very high | 93.9 | Very high | 107 Ų | 107 | 91.9 Ų | 91.9 | 50% | 0.5 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -65.7 | -46.3 | 175.3 | -165.9 | -172 | 160.6 | 0 | 0 | 111.3 | T101 A102 Q107 H108 Q109 | T101-E105 WeakPolarHBondContact O-CB 3.4Å; T101-E105 PolarHBondContact O-N 3.11Å; A102-E105 PolarHBondContact O-N 3.37Å; E105-Q107 VanDerWaalsContact C-N 3.29Å; E105-Q107 PolarHBondContact O-N 3.46Å; E105-H108 WeakPolarHBondContact O-CB 2.9Å; E105-H108 PolarHBondContact O-N 2.8Å; E105-H108 VanDerWaalsContact O-N 3.1Å; E105-Q109 HydrophobicContact CG-CG 4.49Å; E105-Q109 WeakPolarHBondContact O-CB 3.5Å; E105-Q109 VanDerWaalsContact O-CG 3.32Å; E105-Q109 WeakPolarHBondContact O-CG 3.27Å; E105-Q109 PolarHBondContact O-N 3.13Å; E105-Q109 PolarHBondContact OE1-NE2 3.46Å |
| 106 | Q | 95.1 | Very high | 93.1 | Very high | 129 Ų | 129 | 92.7 Ų | 92.7 | 60% | 0.603 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -58.7 | -40.8 | 173.7 | -75.5 | 179.2 | -0.2 | 0 | 0 | 112.1 | A102 V103 K110 | A102-Q106 WeakPolarHBondContact O-CB 3.43Å; A102-Q106 WeakPolarHBondContact O-CG 3.28Å; A102-Q106 PolarHBondContact O-N 3.49Å; V103-Q106 PolarHBondContact O-N 3.49Å; Q106-K110 VanDerWaalsContact O-CB 3.32Å; Q106-K110 WeakPolarHBondContact O-CB 3.28Å; Q106-K110 PolarHBondContact O-N 2.75Å |
| 107 | Q | 95.7 | Very high | 91.2 | Very high | 120 Ų | 120 | 93.1 Ų | 93.1 | 56% | 0.561 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -64.8 | -41.3 | 174.8 | -173.3 | 179.1 | 0.8 | 0 | 0 | 111.4 | V103 T104 E105 K110 I111 | V103-Q107 WeakPolarHBondContact O-CB 3.04Å; V103-Q107 PolarHBondContact O-N 2.88Å; T104-Q107 PolarHBondContact O-N 2.89Å; E105-Q107 VanDerWaalsContact C-N 3.29Å; E105-Q107 PolarHBondContact O-N 3.46Å; Q107-K110 PolarHBondContact O-N 3.46Å; Q107-I111 HydrophobicContact CG-CD1 4.08Å; Q107-I111 VanDerWaalsContact O-CG1 3.27Å; Q107-I111 WeakPolarHBondContact O-CG1 3.46Å; Q107-I111 PolarHBondContact O-N 3.37Å |
| 108 | H | 95.4 | Very high | 88.9 | Confident | 113 Ų | 113 | 93.7 Ų | 93.7 | 52% | 0.523 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -65.2 | -46.9 | 177.2 | -174.6 | 55.7 | 0 | 0 | 0 | 112 | T104 E105 K110 I111 I112 | T104-H108 WeakPolarHBondContact O-CB 3.41Å; T104-H108 PolarHBondContact O-N 3.36Å; E105-H108 WeakPolarHBondContact O-CB 2.9Å; E105-H108 PolarHBondContact O-N 2.8Å; E105-H108 VanDerWaalsContact O-N 3.1Å; H108-K110 VanDerWaalsContact C-N 3.29Å; H108-K110 PolarHBondContact O-N 2.82Å; H108-I111 PolarHBondContact O-N 2.92Å; H108-I111 VanDerWaalsContact O-N 3.13Å; H108-I112 WeakPolarHBondContact NE2-CD1 3.49Å; H108-I112 WeakPolarHBondContact O-CG1 3.48Å; H108-I112 PolarHBondContact O-N 3.37Å |
| 109 | Q | 94 | Very high | 86.7 | Confident | 106 Ų | 106 | 98.7 Ų | 98.7 | 50% | 0.495 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -57.1 | -42.3 | 173.2 | -69.6 | 174.2 | 8.8 | 0 | 0 | 111.3 | E105 I112 A113 | E105-Q109 HydrophobicContact CG-CG 4.49Å; E105-Q109 WeakPolarHBondContact O-CB 3.5Å; E105-Q109 VanDerWaalsContact O-CG 3.32Å; E105-Q109 WeakPolarHBondContact O-CG 3.27Å; E105-Q109 PolarHBondContact O-N 3.13Å; E105-Q109 PolarHBondContact OE1-NE2 3.46Å; Q109-I112 PolarHBondContact O-N 3.46Å; Q109-A113 WeakPolarHBondContact O-CB 3.44Å; Q109-A113 PolarHBondContact O-N 3.15Å |
| 110 | K | 90.4 | Very high | 84.3 | Confident | 148 Ų | 148 | 100.5 Ų | 100.5 | 64% | 0.643 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -65 | -39.4 | 175.3 | -174.6 | 174.8 | -178.2 | 176.6 | 0 | 112.7 | Q106 Q107 H108 A113 L114 | Q106-K110 VanDerWaalsContact O-CB 3.32Å; Q106-K110 WeakPolarHBondContact O-CB 3.28Å; Q106-K110 PolarHBondContact O-N 2.75Å; Q107-K110 PolarHBondContact O-N 3.46Å; H108-K110 VanDerWaalsContact C-N 3.29Å; H108-K110 PolarHBondContact O-N 2.82Å; K110-A113 PolarHBondContact O-N 2.94Å; K110-L114 HydrophobicContact CG-CD1 4.38Å; K110-L114 VanDerWaalsContact O-CG 3.27Å; K110-L114 WeakPolarHBondContact O-CG 3.32Å; K110-L114 PolarHBondContact O-N 3.38Å; K110-L114 VanDerWaalsContact O-N 3.11Å |
| 111 | I | 91.6 | Very high | 82.2 | Confident | 69 Ų | 69 | 102.1 Ų | 102.1 | 35% | 0.354 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -64.5 | -45.1 | 174.4 | -70.5 | 162.4 | 0 | 0 | 0 | 110.2 | Q107 H108 A113 L114 Q115 | Q107-I111 HydrophobicContact CG-CD1 4.08Å; Q107-I111 VanDerWaalsContact O-CG1 3.27Å; Q107-I111 WeakPolarHBondContact O-CG1 3.46Å; Q107-I111 PolarHBondContact O-N 3.37Å; H108-I111 PolarHBondContact O-N 2.92Å; H108-I111 VanDerWaalsContact O-N 3.13Å; I111-A113 PolarHBondContact O-N 2.96Å; I111-L114 PolarHBondContact O-N 3.26Å; I111-Q115 HydrophobicContact CG2-CG 4.28Å; I111-Q115 WeakPolarHBondContact O-CB 3.38Å; I111-Q115 VanDerWaalsContact O-CG 3.31Å; I111-Q115 WeakPolarHBondContact O-CG 3.04Å; I111-Q115 PolarHBondContact O-N 3.38Å |
| 112 | I | 90.2 | Very high | 79.9 | Confident | 59 Ų | 59 | 101.1 Ų | 101.1 | 30% | 0.303 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -60.6 | -45 | 176.5 | -71.2 | 169.2 | 0 | 0 | 0 | 110.9 | H108 Q109 L114 Q115 N116 | H108-I112 WeakPolarHBondContact NE2-CD1 3.49Å; H108-I112 WeakPolarHBondContact O-CG1 3.48Å; H108-I112 PolarHBondContact O-N 3.37Å; Q109-I112 PolarHBondContact O-N 3.46Å; I112-L114 VanDerWaalsContact C-N 3.31Å; I112-L114 PolarHBondContact O-N 3.06Å; I112-Q115 PolarHBondContact O-N 3.15Å; I112-Q115 VanDerWaalsContact O-N 3.13Å; I112-N116 VanDerWaalsContact CG2-ND2 3.25Å; I112-N116 WeakPolarHBondContact CG2-ND2 3.47Å; I112-N116 VanDerWaalsContact O-CB 3.28Å; I112-N116 WeakPolarHBondContact O-CB 3.32Å; I112-N116 PolarHBondContact O-N 3.04Å; I112-N116 PolarHBondContact O-OD1 2.94Å |
| 113 | A | 86.7 | Confident | 77.9 | Confident | 46 Ų | 46 | 101.5 Ų | 101.5 | 38% | 0.38 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -59.3 | -41.4 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | Q109 K110 I111 D118 | Q109-A113 WeakPolarHBondContact O-CB 3.44Å; Q109-A113 PolarHBondContact O-N 3.15Å; K110-A113 PolarHBondContact O-N 2.94Å; I111-A113 PolarHBondContact O-N 2.96Å; A113-D118 PolarHBondContact O-N 3.41Å |
| 114 | L | 84.2 | Confident | 75.9 | Confident | 100 Ų | 100 | 102.7 Ų | 102.7 | 52% | 0.524 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -68.7 | -33 | 175.2 | -68.1 | 168.7 | 0 | 0 | 0 | 113 | K110 I111 I112 L121 | K110-L114 HydrophobicContact CG-CD1 4.38Å; K110-L114 VanDerWaalsContact O-CG 3.27Å; K110-L114 WeakPolarHBondContact O-CG 3.32Å; K110-L114 PolarHBondContact O-N 3.38Å; K110-L114 VanDerWaalsContact O-N 3.11Å; I111-L114 PolarHBondContact O-N 3.26Å; I112-L114 VanDerWaalsContact C-N 3.31Å; I112-L114 PolarHBondContact O-N 3.06Å; L114-L121 HydrophobicContact CD2-CD1 3.7Å; L114-L121 HydrophobicContact CD2-CG 4.39Å |
| 115 | Q | 84.1 | Confident | 74.2 | Confident | 143 Ų | 143 | 104.1 Ų | 104.1 | 67% | 0.668 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -80.1 | -36.9 | 179.7 | -75.8 | 177.4 | -13.6 | 0 | 0 | 113.2 | I111 I112 G117 | I111-Q115 HydrophobicContact CG2-CG 4.28Å; I111-Q115 WeakPolarHBondContact O-CB 3.38Å; I111-Q115 VanDerWaalsContact O-CG 3.31Å; I111-Q115 WeakPolarHBondContact O-CG 3.04Å; I111-Q115 PolarHBondContact O-N 3.38Å; I112-Q115 PolarHBondContact O-N 3.15Å; I112-Q115 VanDerWaalsContact O-N 3.13Å; Q115-G117 PolarHBondContact O-N 3.09Å |
| 116 | N | 78.4 | Confident | 72.6 | Confident | 127 Ų | 127 | 102.7 Ų | 102.7 | 68% | 0.679 | 53% | 0.534 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -71.1 | 7.9 | -179 | -72.7 | -1.1 | 0 | 0 | 0 | 113.5 | I112 D118 | I112-N116 VanDerWaalsContact CG2-ND2 3.25Å; I112-N116 WeakPolarHBondContact CG2-ND2 3.47Å; I112-N116 VanDerWaalsContact O-CB 3.28Å; I112-N116 WeakPolarHBondContact O-CB 3.32Å; I112-N116 PolarHBondContact O-N 3.04Å; I112-N116 PolarHBondContact O-OD1 2.94Å; N116-D118 VanDerWaalsContact C-N 3.33Å; N116-D118 PolarHBondContact O-N 3.24Å |
| 117 | G | 56.3 | Low | 71.4 | Confident | 58 Ų | 58 | 100.3 Ų | 100.3 | 60% | 0.598 | 53% | 0.528 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 72.8 | 24.4 | 175.9 | 0 | 0 | 0 | 0 | 0 | 113.6 | Q115 R119 | Q115-G117 PolarHBondContact O-N 3.09Å; G117-R119 PolarHBondContact O-N 3.41Å |
| 118 | D | 49.2 | Very low | 70.4 | Confident | 105 Ų | 105 | 100 Ų | 100 | 56% | 0.561 | 53% | 0.531 | S | S | * | . | trans | -71.3 | 73.8 | 164.3 | -163.5 | -7.4 | 0 | 0 | 0 | 109.8 | A113 N116 S120 L121 | A113-D118 PolarHBondContact O-N 3.41Å; N116-D118 VanDerWaalsContact C-N 3.33Å; N116-D118 PolarHBondContact O-N 3.24Å; D118-S120 PolarHBondContact O-N 2.92Å; D118-S120 WeakPolarHBondContact OD1-CB 3.4Å; D118-S120 PolarHBondContact OD1-N 3.19Å; D118-L121 PolarHBondContact O-N 3.23Å | ||
| 119 | R | 51.8 | Low | 69.9 | Low | 200 Ų | 200 | 96.9 Ų | 96.9 | 76% | 0.755 | 52% | 0.518 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -74.2 | 34.8 | 168.2 | -160.3 | -169.9 | -91.9 | -114.9 | 7.8 | 110.2 | G117 L121 K122 | G117-R119 PolarHBondContact O-N 3.41Å; R119-L121 VanDerWaalsContact C-C 3.45Å; R119-L121 VanDerWaalsContact CG-O 3.3Å; R119-L121 WeakPolarHBondContact CG-O 3.31Å; R119-L121 CarbonylContact O-C 3.12Å; R119-K122 PolarHBondContact O-N 3.47Å |
| 120 | S | 46.7 | Very low | 69.3 | Low | 92 Ų | 92 | 94.8 Ų | 94.8 | 64% | 0.643 | 51% | 0.51 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -71.5 | -0.5 | 146.4 | -161.5 | 0 | 0 | 0 | 0 | 112 | D118 K122 | D118-S120 PolarHBondContact O-N 2.92Å; D118-S120 WeakPolarHBondContact OD1-CB 3.4Å; D118-S120 PolarHBondContact OD1-N 3.19Å; S120-K122 PolarHBondContact O-N 2.6Å |
| 121 | L | 51.6 | Low | 69.1 | Low | 117 Ų | 117 | 90.4 Ų | 90.4 | 61% | 0.613 | 50% | 0.501 | S | S | * | . | -67.3 | 65.3 | 128.4 | -65.9 | -172.2 | 0 | 0 | 0 | 110.6 | L114 D118 R119 | L114-L121 HydrophobicContact CD2-CD1 3.7Å; L114-L121 HydrophobicContact CD2-CG 4.39Å; D118-L121 PolarHBondContact O-N 3.23Å; R119-L121 VanDerWaalsContact C-C 3.45Å; R119-L121 VanDerWaalsContact CG-O 3.3Å; R119-L121 WeakPolarHBondContact CG-O 3.31Å; R119-L121 CarbonylContact O-C 3.12Å | |||
| 122 | K | 50.5 | Low | 69 | Low | 66 Ų | 66 | 91.3 Ų | 91.3 | 29% | 0.287 | 50% | 0.503 | S | S | . | . | trans | -47.7 | 123.7 | 148.1 | -82.8 | -175 | 175 | -172 | 0 | 104.9 | R119 S120 H126 D130 | R119-K122 PolarHBondContact O-N 3.47Å; S120-K122 PolarHBondContact O-N 2.6Å; K122-H126 HydrophobicContact CB-CB 3.79Å; K122-H126 HydrophobicContact CD-CB 4.29Å; K122-H126 WeakPolarHBondContact CD-ND1 3.22Å; K122-H126 WeakPolarHBondContact CE-CE1 3.49Å; K122-H126 WeakPolarHBondContact CE-NE2 3.3Å; K122-H126 HydrophobicContact CG-CB 3.99Å; K122-H126 PolarHBondContact NZ-CE1 3.35Å; K122-H126 VanDerWaalsContact NZ-CE1 3.28Å; K122-D130 WeakPolarHBondContact CD-OD2 3.31Å; K122-D130 WeakPolarHBondContact CE-OD2 3.41Å; K122-D130 IonicContact NZ-OD1 2.73Å; K122-D130 PolarHBondContact NZ-OD1 3.02Å; K122-D130 IonicContact NZ-OD2 2.83Å; K122-D130 PolarHBondContact NZ-OD2 2.98Å | ||
| 123 | P | 55.1 | Low | 68.9 | Low | 52 Ų | 52 | 90.1 Ų | 90.1 | 34% | 0.338 | 50% | 0.496 | S | S | . | . | trans | -52.2 | 156.7 | 174.5 | 21.7 | -32.7 | 0 | 0 | 0 | 108.3 | I125 H126 T127 | P123-I125 HydrophobicContact CB-CB 4.36Å; P123-I125 HydrophobicContact CG-CB 4.34Å; P123-I125 CarbonylContact O-C 3.48Å; P123-I125 PolarHBondContact O-N 3.45Å; P123-H126 HydrophobicContact CG-CB 3.93Å; P123-H126 PolarHBondContact O-N 3.04Å; P123-T127 PolarHBondContact O-N 3.35Å; P123-T127 VanDerWaalsContact O-N 3.13Å | ||
| 124 | P | 55.2 | Low | 69.1 | Low | 112 Ų | 112 | 91 Ų | 91 | 73% | 0.727 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -49.6 | -31.1 | 177 | 17 | -29.9 | 0 | 0 | 0 | 112.1 | T127 D128 | P124-T127 PolarHBondContact O-N 2.87Å; P124-D128 WeakPolarHBondContact O-CB 3.31Å; P124-D128 PolarHBondContact O-N 2.94Å |
| 125 | I | 59.7 | Low | 69.4 | Low | 118 Ų | 118 | 88.2 Ų | 88.2 | 61% | 0.605 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -54 | -49 | 167.6 | -55.1 | 170.8 | 0 | 0 | 0 | 113.6 | P123 D128 L129 | P123-I125 HydrophobicContact CB-CB 4.36Å; P123-I125 HydrophobicContact CG-CB 4.34Å; P123-I125 CarbonylContact O-C 3.48Å; P123-I125 PolarHBondContact O-N 3.45Å; I125-D128 PolarHBondContact O-N 3.27Å; I125-L129 HydrophobicContact CG2-CD1 4.07Å; I125-L129 WeakPolarHBondContact O-CB 3.46Å; I125-L129 WeakPolarHBondContact O-CG 3.49Å; I125-L129 PolarHBondContact O-N 3.37Å |
| 126 | H | 63.2 | Low | 69.9 | Low | 77 Ų | 77 | 83.5 Ų | 83.5 | 36% | 0.356 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -79.8 | -27.5 | -177.5 | -168.9 | -13.3 | 0 | 0 | 0 | 112.4 | K122 P123 D130 | K122-H126 HydrophobicContact CB-CB 3.79Å; K122-H126 HydrophobicContact CD-CB 4.29Å; K122-H126 WeakPolarHBondContact CD-ND1 3.22Å; K122-H126 WeakPolarHBondContact CE-CE1 3.49Å; K122-H126 WeakPolarHBondContact CE-NE2 3.3Å; K122-H126 HydrophobicContact CG-CB 3.99Å; K122-H126 PolarHBondContact NZ-CE1 3.35Å; K122-H126 VanDerWaalsContact NZ-CE1 3.28Å; P123-H126 HydrophobicContact CG-CB 3.93Å; P123-H126 PolarHBondContact O-N 3.04Å; H126-D130 IonicContact CE1-OD1 3.59Å; H126-D130 PolarHBondContact CE1-OD1 2.98Å; H126-D130 IonicContact ND1-OD1 3.83Å; H126-D130 PolarHBondContact ND1-OD1 3.5Å; H126-D130 VanDerWaalsContact ND1-OD1 3.12Å; H126-D130 PolarHBondContact O-N 3.32Å |
| 127 | T | 68.7 | Low | 70.5 | Confident | 79 Ų | 79 | 82 Ų | 82 | 49% | 0.485 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -68.4 | -38.9 | 168.4 | -49.5 | 0 | 0 | 0 | 0 | 111.2 | P123 P124 D130 A131 | P123-T127 PolarHBondContact O-N 3.35Å; P123-T127 VanDerWaalsContact O-N 3.13Å; P124-T127 PolarHBondContact O-N 2.87Å; T127-D130 PolarHBondContact O-N 3.44Å; T127-A131 WeakPolarHBondContact O-CB 3.41Å; T127-A131 PolarHBondContact O-N 2.74Å |
| 128 | D | 75.1 | Confident | 72.3 | Confident | 113 Ų | 113 | 82.7 Ų | 82.7 | 60% | 0.604 | 45% | 0.453 | S | S | * | . | H | α-helix | trans | -66.6 | -41.1 | 172.8 | -172.9 | 40.8 | 0 | 0 | 0 | 111.6 | P124 I125 A131 F132 | P124-D128 WeakPolarHBondContact O-CB 3.31Å; P124-D128 PolarHBondContact O-N 2.94Å; I125-D128 PolarHBondContact O-N 3.27Å; D128-A131 WeakPolarHBondContact O-CB 3.35Å; D128-A131 PolarHBondContact O-N 3.45Å; D128-F132 WeakPolarHBondContact O-CB 3.37Å; D128-F132 PolarHBondContact O-N 2.8Å |
| 129 | L | 84.3 | Confident | 74.4 | Confident | 48 Ų | 48 | 81.1 Ų | 81.1 | 25% | 0.251 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -63.8 | -39.9 | 171.5 | -72 | 168.9 | 0 | 0 | 0 | 112.2 | I125 A131 F132 H133 | I125-L129 HydrophobicContact CG2-CD1 4.07Å; I125-L129 WeakPolarHBondContact O-CB 3.46Å; I125-L129 WeakPolarHBondContact O-CG 3.49Å; I125-L129 PolarHBondContact O-N 3.37Å; L129-A131 VanDerWaalsContact C-N 3.33Å; L129-A131 PolarHBondContact O-N 2.81Å; L129-F132 PolarHBondContact O-N 3.1Å; L129-H133 VanDerWaalsContact O-CB 3.31Å; L129-H133 WeakPolarHBondContact O-CB 3.47Å; L129-H133 PolarHBondContact O-CD2 3.38Å; L129-H133 PolarHBondContact O-N 3.36Å |
| 130 | D | 82.4 | Confident | 76.3 | Confident | 62 Ų | 62 | 72.5 Ų | 72.5 | 33% | 0.332 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -62.1 | -41.7 | 173.6 | -71.8 | -12 | 0 | 0 | 0 | 111.4 | K122 H126 T127 H133 S134 | K122-D130 WeakPolarHBondContact CD-OD2 3.31Å; K122-D130 WeakPolarHBondContact CE-OD2 3.41Å; K122-D130 IonicContact NZ-OD1 2.73Å; K122-D130 PolarHBondContact NZ-OD1 3.02Å; K122-D130 IonicContact NZ-OD2 2.83Å; K122-D130 PolarHBondContact NZ-OD2 2.98Å; H126-D130 IonicContact CE1-OD1 3.59Å; H126-D130 PolarHBondContact CE1-OD1 2.98Å; H126-D130 IonicContact ND1-OD1 3.83Å; H126-D130 PolarHBondContact ND1-OD1 3.5Å; H126-D130 VanDerWaalsContact ND1-OD1 3.12Å; H126-D130 PolarHBondContact O-N 3.32Å; T127-D130 PolarHBondContact O-N 3.44Å; D130-H133 PolarHBondContact O-N 3.49Å; D130-S134 WeakPolarHBondContact O-CB 3.43Å; D130-S134 PolarHBondContact O-N 3.48Å; D130-S134 PolarHBondContact O-OG 3.44Å |
| 131 | A | 86.3 | Confident | 78.3 | Confident | 56 Ų | 56 | 74.3 Ų | 74.3 | 46% | 0.463 | 42% | 0.418 | S | S | . | . | H | α-helix | trans | -64.3 | -42.2 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111.5 | T127 D128 L129 S134 G135 | T127-A131 WeakPolarHBondContact O-CB 3.41Å; T127-A131 PolarHBondContact O-N 2.74Å; D128-A131 WeakPolarHBondContact O-CB 3.35Å; D128-A131 PolarHBondContact O-N 3.45Å; L129-A131 VanDerWaalsContact C-N 3.33Å; L129-A131 PolarHBondContact O-N 2.81Å; A131-S134 WeakPolarHBondContact CA-OG 3.48Å; A131-S134 PolarHBondContact O-OG 3.46Å; A131-G135 PolarHBondContact O-N 2.87Å |
| 132 | F | 88.9 | Confident | 80.3 | Confident | 88 Ų | 88 | 74.4 Ų | 74.4 | 39% | 0.386 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -63.8 | -45.3 | 173.3 | 178.2 | -104.2 | 0 | 0 | 0 | 112 | D128 L129 S134 G135 F136 F174 | D128-F132 WeakPolarHBondContact O-CB 3.37Å; D128-F132 PolarHBondContact O-N 2.8Å; L129-F132 PolarHBondContact O-N 3.1Å; F132-S134 PolarHBondContact O-N 2.69Å; F132-G135 PolarHBondContact O-N 2.87Å; F132-F136 VanDerWaalsContact O-CB 3.25Å; F132-F136 WeakPolarHBondContact O-CB 3.48Å; F132-F136 PolarHBondContact O-N 3.3Å; F132-F174 HydrophobicContact CE1-CB 4.42Å; F132-F174 HydrophobicContact CE1-CD1 4.29Å; F132-F174 AromaticContact CE1-CD2 3.96Å; F132-F174 HydrophobicContact CE1-CD2 3.96Å; F132-F174 HydrophobicContact CE1-CE2 4.28Å; F132-F174 AromaticContact CE1-CG 3.97Å; F132-F174 HydrophobicContact CE1-CG 3.97Å; F132-F174 HydrophobicContact CZ-CD2 4.44Å; F132-F174 HydrophobicContact CZ-CE2 4.31Å; F132-F174 HydrophobicContact CZ-CZ 4.42Å |
| 133 | H | 89.6 | Confident | 82.3 | Confident | 33 Ų | 33 | 74.1 Ų | 74.1 | 15% | 0.153 | 42% | 0.419 | C | S | . | . | H | α-helix | trans | -65.7 | -39.3 | -179.9 | -80.8 | -128.4 | 0 | 0 | 0 | 111.7 | L129 D130 Q137 L171 Q175 | L129-H133 VanDerWaalsContact O-CB 3.31Å; L129-H133 WeakPolarHBondContact O-CB 3.47Å; L129-H133 PolarHBondContact O-CD2 3.38Å; L129-H133 PolarHBondContact O-N 3.36Å; D130-H133 PolarHBondContact O-N 3.49Å; H133-Q137 WeakPolarHBondContact O-CB 3.32Å; H133-Q137 PolarHBondContact O-N 2.91Å; H133-L171 HydrophobicContact CB-CD1 4.28Å; H133-Q175 PolarHBondContact CE1-NE2 2.88Å |
| 134 | S | 89 | Confident | 83.8 | Confident | 66 Ų | 66 | 74.1 Ų | 74.1 | 46% | 0.462 | 42% | 0.416 | S | S | . | . | H | α-helix | trans | -71.1 | -40.6 | 175.3 | 53.7 | 0 | 0 | 0 | 0 | 112.3 | D130 A131 F132 Q137 T138 | D130-S134 WeakPolarHBondContact O-CB 3.43Å; D130-S134 PolarHBondContact O-N 3.48Å; D130-S134 PolarHBondContact O-OG 3.44Å; A131-S134 WeakPolarHBondContact CA-OG 3.48Å; A131-S134 PolarHBondContact O-OG 3.46Å; F132-S134 PolarHBondContact O-N 2.69Å; S134-Q137 PolarHBondContact O-N 2.92Å; S134-T138 WeakPolarHBondContact O-CB 3.25Å; S134-T138 PolarHBondContact O-N 3.37Å; S134-T138 PolarHBondContact O-OG1 3.23Å |
| 135 | G | 92.5 | Very high | 85.4 | Confident | 40 Ų | 40 | 74 Ų | 74 | 41% | 0.412 | 41% | 0.405 | S | S | . | . | H | α-helix | trans | -60.9 | -46.5 | 171.1 | 0 | 0 | 0 | 0 | 0 | 112.6 | A131 F132 T138 C139 | A131-G135 PolarHBondContact O-N 2.87Å; F132-G135 PolarHBondContact O-N 2.87Å; G135-T138 PolarHBondContact O-N 2.97Å; G135-T138 VanDerWaalsContact O-N 3.16Å; G135-C139 PolarHBondContact O-N 3.46Å |
| 136 | F | 93.4 | Very high | 86.8 | Confident | 45 Ų | 45 | 76 Ų | 76 | 20% | 0.197 | 41% | 0.406 | C | S | . | . | H | α-helix | trans | -61.8 | -45.2 | 176.4 | -175.5 | -84.8 | 0 | 0 | 0 | 111.8 | F132 T138 C139 A140 L167 V170 L171 | F132-F136 VanDerWaalsContact O-CB 3.25Å; F132-F136 WeakPolarHBondContact O-CB 3.48Å; F132-F136 PolarHBondContact O-N 3.3Å; F136-T138 VanDerWaalsContact C-N 3.27Å; F136-T138 PolarHBondContact O-N 3.01Å; F136-C139 PolarHBondContact O-N 2.86Å; F136-A140 VanDerWaalsContact O-CB 3.25Å; F136-A140 WeakPolarHBondContact O-CB 3.5Å; F136-A140 PolarHBondContact O-N 2.91Å; F136-L167 HydrophobicContact CE1-CB 4.41Å; F136-L167 HydrophobicContact CE1-CD2 4.44Å; F136-L167 HydrophobicContact CZ-CD2 3.95Å; F136-V170 HydrophobicContact CE2-CG1 3.97Å; F136-V170 HydrophobicContact CZ-CB 4.24Å; F136-V170 HydrophobicContact CZ-CG1 3.81Å; F136-L171 HydrophobicContact CD1-CB 4.23Å; F136-L171 HydrophobicContact CD1-CD1 3.82Å; F136-L171 HydrophobicContact CD1-CD2 4.48Å; F136-L171 HydrophobicContact CD1-CG 4.41Å; F136-L171 HydrophobicContact CE1-CB 3.96Å; F136-L171 HydrophobicContact CE1-CD1 4.39Å; F136-L171 HydrophobicContact CG-CD1 4.31Å |
| 137 | Q | 91.7 | Very high | 88 | Confident | 95 Ų | 95 | 73.5 Ų | 73.5 | 44% | 0.444 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -61.4 | -35.4 | 174 | -85.4 | -155.1 | 21.4 | 0 | 0 | 112.9 | H133 S134 K141 L171 | H133-Q137 WeakPolarHBondContact O-CB 3.32Å; H133-Q137 PolarHBondContact O-N 2.91Å; S134-Q137 PolarHBondContact O-N 2.92Å; Q137-K141 WeakPolarHBondContact O-CD 3.48Å; Q137-K141 VanDerWaalsContact O-CG 3.24Å; Q137-K141 WeakPolarHBondContact O-CG 3.32Å; Q137-K141 PolarHBondContact O-N 3.39Å; Q137-L171 HydrophobicContact CG-CD2 4.21Å |
| 138 | T | 93.1 | Very high | 88.8 | Confident | 73 Ų | 73 | 72.4 Ų | 72.4 | 45% | 0.448 | 39% | 0.391 | S | S | . | . | H | α-helix | trans | -69 | -49.8 | 179.1 | -55.5 | 0 | 0 | 0 | 0 | 110.3 | S134 G135 F136 A140 K141 E142 | S134-T138 WeakPolarHBondContact O-CB 3.25Å; S134-T138 PolarHBondContact O-N 3.37Å; S134-T138 PolarHBondContact O-OG1 3.23Å; G135-T138 PolarHBondContact O-N 2.97Å; G135-T138 VanDerWaalsContact O-N 3.16Å; F136-T138 VanDerWaalsContact C-N 3.27Å; F136-T138 PolarHBondContact O-N 3.01Å; T138-A140 VanDerWaalsContact C-N 3.34Å; T138-A140 PolarHBondContact O-N 3.03Å; T138-K141 WeakPolarHBondContact O-CB 3.39Å; T138-K141 PolarHBondContact O-N 2.92Å; T138-K141 VanDerWaalsContact O-N 3.14Å; T138-E142 PolarHBondContact O-N 3.31Å |
| 139 | C | 93.9 | Very high | 89.3 | Confident | 71 Ų | 71 | 73.5 Ų | 73.5 | 48% | 0.48 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -57.2 | -43.6 | 172.8 | 179.5 | 0 | 0 | 0 | 0 | 112.4 | G135 F136 K141 E142 V143 | G135-C139 PolarHBondContact O-N 3.46Å; F136-C139 PolarHBondContact O-N 2.86Å; C139-K141 VanDerWaalsContact C-N 3.32Å; C139-K141 PolarHBondContact O-N 3.42Å; C139-E142 PolarHBondContact O-N 2.99Å; C139-V143 WeakPolarHBondContact O-CG2 3.42Å; C139-V143 PolarHBondContact O-N 3.23Å |
| 140 | A | 91.6 | Very high | 89.2 | Confident | 20 Ų | 20 | 73.8 Ų | 73.8 | 17% | 0.165 | 40% | 0.402 | C | S | . | . | H | α-helix | trans | -60.4 | -39.4 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.7 | F136 T138 L144 L167 | F136-A140 VanDerWaalsContact O-CB 3.25Å; F136-A140 WeakPolarHBondContact O-CB 3.5Å; F136-A140 PolarHBondContact O-N 2.91Å; T138-A140 VanDerWaalsContact C-N 3.34Å; T138-A140 PolarHBondContact O-N 3.03Å; A140-L144 PolarHBondContact O-N 2.93Å; A140-L167 HydrophobicContact CB-CD1 4Å |
| 141 | K | 89.8 | Confident | 89.1 | Confident | 129 Ų | 129 | 76.2 Ų | 76.2 | 56% | 0.561 | 41% | 0.411 | S | S | * | . | H | α-helix | trans | -68 | -43.1 | 174.6 | -72.6 | 165.7 | -172.3 | 170.6 | 0 | 111.6 | Q137 T138 C139 L144 Q145 | Q137-K141 WeakPolarHBondContact O-CD 3.48Å; Q137-K141 VanDerWaalsContact O-CG 3.24Å; Q137-K141 WeakPolarHBondContact O-CG 3.32Å; Q137-K141 PolarHBondContact O-N 3.39Å; T138-K141 WeakPolarHBondContact O-CB 3.39Å; T138-K141 PolarHBondContact O-N 2.92Å; T138-K141 VanDerWaalsContact O-N 3.14Å; C139-K141 VanDerWaalsContact C-N 3.32Å; C139-K141 PolarHBondContact O-N 3.42Å; K141-L144 WeakPolarHBondContact O-CB 3.31Å; K141-L144 PolarHBondContact O-N 3.45Å; K141-Q145 WeakPolarHBondContact O-CB 3.45Å; K141-Q145 PolarHBondContact O-N 2.92Å |
| 142 | E | 92.8 | Very high | 88.8 | Confident | 119 Ų | 119 | 79.2 Ų | 79.2 | 56% | 0.556 | 42% | 0.42 | S | S | * | . | H | α-helix | trans | -62.9 | -41.5 | 176.8 | -73.1 | -178 | 168.4 | 0 | 0 | 112.3 | T138 C139 L144 Q145 Y146 | T138-E142 PolarHBondContact O-N 3.31Å; C139-E142 PolarHBondContact O-N 2.99Å; E142-L144 PolarHBondContact O-N 2.95Å; E142-Q145 PolarHBondContact O-N 2.96Å; E142-Y146 WeakPolarHBondContact O-CB 3.44Å; E142-Y146 PolarHBondContact O-N 2.92Å |
| 143 | V | 91.6 | Very high | 88.4 | Confident | 60 Ų | 60 | 77 Ų | 77 | 36% | 0.364 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -61.3 | -44.4 | 174.7 | 169.4 | 0 | 0 | 0 | 0 | 111.1 | C139 Y146 L147 L163 | C139-V143 WeakPolarHBondContact O-CG2 3.42Å; C139-V143 PolarHBondContact O-N 3.23Å; V143-Y146 PolarHBondContact O-N 3.46Å; V143-L147 HydrophobicContact CG1-CD1 4.01Å; V143-L147 WeakPolarHBondContact O-CB 3.39Å; V143-L147 VanDerWaalsContact O-CG 3.31Å; V143-L147 WeakPolarHBondContact O-CG 3.48Å; V143-L147 PolarHBondContact O-N 2.92Å; V143-L163 HydrophobicContact CG1-CD2 4.29Å |
| 144 | L | 87.9 | Confident | 87.7 | Confident | 53 Ų | 53 | 78.7 Ų | 78.7 | 28% | 0.277 | 42% | 0.422 | S | S | . | . | H | α-helix | trans | -62.1 | -44.3 | 174.1 | -107.1 | 65.5 | 0 | 0 | 0 | 112.2 | A140 K141 E142 L147 S148 L163 I164 L167 | A140-L144 PolarHBondContact O-N 2.93Å; K141-L144 WeakPolarHBondContact O-CB 3.31Å; K141-L144 PolarHBondContact O-N 3.45Å; E142-L144 PolarHBondContact O-N 2.95Å; L144-L147 PolarHBondContact O-N 3.4Å; L144-S148 WeakPolarHBondContact O-CB 3.45Å; L144-S148 PolarHBondContact O-N 3.5Å; L144-S148 PolarHBondContact O-OG 3.02Å; L144-L163 HydrophobicContact CD1-CD2 4.06Å; L144-L163 HydrophobicContact CD1-CG 4.4Å; L144-I164 HydrophobicContact CD1-CG1 4.1Å; L144-I164 HydrophobicContact CD2-CD1 3.91Å; L144-I164 HydrophobicContact CD2-CG1 3.73Å; L144-I164 HydrophobicContact CG-CG1 4.38Å; L144-L167 HydrophobicContact CD1-CD1 4.27Å |
| 145 | Q | 88.6 | Confident | 86.8 | Confident | 110 Ų | 110 | 80.4 Ų | 80.4 | 51% | 0.514 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -62.5 | -44.9 | 178.7 | -172.8 | 173.2 | 21.4 | 0 | 0 | 110.9 | K141 E142 S148 Q149 | K141-Q145 WeakPolarHBondContact O-CB 3.45Å; K141-Q145 PolarHBondContact O-N 2.92Å; E142-Q145 PolarHBondContact O-N 2.96Å; Q145-S148 PolarHBondContact O-N 3.37Å; Q145-S148 PolarHBondContact O-OG 3.19Å; Q145-Q149 WeakPolarHBondContact O-CG 3.43Å; Q145-Q149 PolarHBondContact O-N 3.26Å |
| 146 | Y | 89.6 | Confident | 85.8 | Confident | 159 Ų | 159 | 88.9 Ų | 88.9 | 62% | 0.624 | 46% | 0.459 | S | S | * | . | H | α-helix | trans | -59.8 | -49.5 | 174.3 | 178.4 | -97.8 | 0 | 0 | 0 | 112 | E142 V143 S148 Q149 A150 | E142-Y146 WeakPolarHBondContact O-CB 3.44Å; E142-Y146 PolarHBondContact O-N 2.92Å; V143-Y146 PolarHBondContact O-N 3.46Å; Y146-S148 VanDerWaalsContact C-N 3.32Å; Y146-S148 PolarHBondContact O-N 3.36Å; Y146-Q149 PolarHBondContact O-N 3.09Å; Y146-Q149 VanDerWaalsContact O-N 3.14Å; Y146-A150 HydrophobicContact CD1-CB 4.44Å; Y146-A150 HydrophobicContact CD2-CB 4.41Å; Y146-A150 HydrophobicContact CE1-CB 4.05Å; Y146-A150 HydrophobicContact CE2-CB 4.02Å; Y146-A150 VanDerWaalsContact O-CB 3.28Å; Y146-A150 WeakPolarHBondContact O-CB 3.42Å; Y146-A150 PolarHBondContact O-N 3.46Å |
| 147 | L | 87.1 | Confident | 85.2 | Confident | 24 Ų | 24 | 89.2 Ų | 89.2 | 13% | 0.126 | 46% | 0.461 | C | S | . | . | H | α-helix | trans | -64 | -35.4 | 179.5 | -70.1 | 170.4 | 0 | 0 | 0 | 112.7 | V143 L144 E151 N152 W153 L163 | V143-L147 HydrophobicContact CG1-CD1 4.01Å; V143-L147 WeakPolarHBondContact O-CB 3.39Å; V143-L147 VanDerWaalsContact O-CG 3.31Å; V143-L147 WeakPolarHBondContact O-CG 3.48Å; V143-L147 PolarHBondContact O-N 2.92Å; L144-L147 PolarHBondContact O-N 3.4Å; L147-E151 CarbonylContact O-C 3.5Å; L147-E151 WeakPolarHBondContact O-CA 3.37Å; L147-E151 PolarHBondContact O-N 3.24Å; L147-E151 VanDerWaalsContact O-N 3.09Å; L147-N152 PolarHBondContact O-N 3.36Å; L147-W153 HydrophobicContact CB-CB 4.42Å; L147-W153 HydrophobicContact CB-CD2 4.32Å; L147-W153 HydrophobicContact CB-CG 4.26Å; L147-W153 HydrophobicContact CD1-CE3 4.27Å; L147-W153 HydrophobicContact CD1-CZ3 4.24Å; L147-W153 PolarHBondContact O-N 2.96Å; L147-L163 HydrophobicContact CD1-CD2 3.41Å; L147-L163 VanDerWaalsContact CD1-CD2 3.41Å |
| 148 | S | 86.3 | Confident | 84.8 | Confident | 56 Ų | 56 | 91.2 Ų | 91.2 | 39% | 0.392 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -69.6 | -29.5 | 174 | 68.5 | 0 | 0 | 0 | 0 | 113.8 | L144 Q145 Y146 N152 | L144-S148 WeakPolarHBondContact O-CB 3.45Å; L144-S148 PolarHBondContact O-N 3.5Å; L144-S148 PolarHBondContact O-OG 3.02Å; Q145-S148 PolarHBondContact O-N 3.37Å; Q145-S148 PolarHBondContact O-OG 3.19Å; Y146-S148 VanDerWaalsContact C-N 3.32Å; Y146-S148 PolarHBondContact O-N 3.36Å; S148-N152 VanDerWaalsContact O-CA 3.31Å; S148-N152 WeakPolarHBondContact O-CA 3.31Å |
| 149 | Q | 85.8 | Confident | 84.3 | Confident | 137 Ų | 137 | 93.7 Ų | 93.7 | 64% | 0.64 | 47% | 0.472 | S | S | * | . | H | α-helix | trans | -89.3 | -41.9 | 179.1 | -70.1 | 178.6 | 23.8 | 0 | 0 | 113.2 | Q145 Y146 | Q145-Q149 WeakPolarHBondContact O-CG 3.43Å; Q145-Q149 PolarHBondContact O-N 3.26Å; Y146-Q149 PolarHBondContact O-N 3.09Å; Y146-Q149 VanDerWaalsContact O-N 3.14Å |
| 150 | A | 81.9 | Confident | 83.8 | Confident | 54 Ų | 54 | 91 Ų | 91 | 45% | 0.446 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -83.8 | -40.5 | -175.3 | 0 | 0 | 0 | 0 | 0 | 112.8 | Y146 | Y146-A150 HydrophobicContact CD1-CB 4.44Å; Y146-A150 HydrophobicContact CD2-CB 4.41Å; Y146-A150 HydrophobicContact CE1-CB 4.05Å; Y146-A150 HydrophobicContact CE2-CB 4.02Å; Y146-A150 VanDerWaalsContact O-CB 3.28Å; Y146-A150 WeakPolarHBondContact O-CB 3.42Å; Y146-A150 PolarHBondContact O-N 3.46Å |
| 151 | E | 79.4 | Confident | 83.5 | Confident | 112 Ų | 112 | 91.7 Ų | 91.7 | 52% | 0.523 | 46% | 0.459 | S | S | . | . | S | Bend | trans | -113.2 | 3.7 | -176.6 | -66.2 | -169.9 | -162.3 | 0 | 0 | 113.4 | L147 W153 | L147-E151 CarbonylContact O-C 3.5Å; L147-E151 WeakPolarHBondContact O-CA 3.37Å; L147-E151 PolarHBondContact O-N 3.24Å; L147-E151 VanDerWaalsContact O-N 3.09Å; E151-W153 HydrophobicContact CB-CG 4.48Å; E151-W153 PolarHBondContact O-N 2.97Å; E151-W153 PolarHBondContact OE2-NE1 3.06Å |
| 152 | N | 80.7 | Confident | 83.5 | Confident | 120 Ų | 120 | 91.5 Ų | 91.5 | 64% | 0.642 | 46% | 0.46 | S | S | * | . | trans | 55.2 | 29.2 | -178 | -62.9 | -86.4 | 0 | 0 | 0 | 114.2 | L147 S148 T154 | L147-N152 PolarHBondContact O-N 3.36Å; S148-N152 VanDerWaalsContact O-CA 3.31Å; S148-N152 WeakPolarHBondContact O-CA 3.31Å; N152-T154 PolarHBondContact O-N 3.41Å | ||
| 153 | W | 81.4 | Confident | 83.3 | Confident | 40 Ų | 40 | 87.9 Ų | 87.9 | 15% | 0.152 | 45% | 0.445 | C | S | . | . | trans | -59.4 | 111 | 180 | -80.1 | 35.9 | 0 | 0 | 0 | 110.6 | L147 E151 E157 R159 C160 L163 | L147-W153 HydrophobicContact CB-CB 4.42Å; L147-W153 HydrophobicContact CB-CD2 4.32Å; L147-W153 HydrophobicContact CB-CG 4.26Å; L147-W153 HydrophobicContact CD1-CE3 4.27Å; L147-W153 HydrophobicContact CD1-CZ3 4.24Å; L147-W153 PolarHBondContact O-N 2.96Å; E151-W153 HydrophobicContact CB-CG 4.48Å; E151-W153 PolarHBondContact O-N 2.97Å; E151-W153 PolarHBondContact OE2-NE1 3.06Å; W153-E157 WeakPolarHBondContact CA-OE1 3.38Å; W153-R159 HydrophobicContact CE3-CB 4.23Å; W153-R159 HydrophobicContact CH2-CB 3.8Å; W153-R159 HydrophobicContact CZ2-CB 4.41Å; W153-R159 HydrophobicContact CZ3-CB 3.7Å; W153-C160 HydrophobicContact CE3-CB 3.94Å; W153-L163 HydrophobicContact CZ3-CD2 4.32Å | ||
| 154 | T | 74.6 | Confident | 83.1 | Confident | 70 Ų | 70 | 87.6 Ų | 87.6 | 43% | 0.429 | 44% | 0.44 | S | S | . | . | trans | -81.6 | 149.1 | 179.5 | 64 | 0 | 0 | 0 | 0 | 110.7 | N152 R156 E157 | N152-T154 PolarHBondContact O-N 3.41Å; T154-R156 PolarHBondContact O-N 3.4Å; T154-E157 PolarHBondContact N-OE1 3.14Å; T154-E157 WeakPolarHBondContact O-CB 3.44Å; T154-E157 PolarHBondContact O-N 2.69Å; T154-E157 PolarHBondContact OG1-OE1 2.9Å | ||
| 155 | A | 69.7 | Low | 83.2 | Confident | 101 Ų | 101 | 89.3 Ų | 89.3 | 84% | 0.835 | 45% | 0.45 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -61.1 | -9.2 | 175.7 | 0 | 0 | 0 | 0 | 0 | 114.2 | ||
| 156 | R | 70.4 | Confident | 83.3 | Confident | 219 Ų | 219 | 89.3 Ų | 89.3 | 83% | 0.826 | 45% | 0.45 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -85.2 | -16.2 | 174.1 | -168.3 | 177.1 | -68.5 | 120.2 | -2.2 | 112.8 | T154 | T154-R156 PolarHBondContact O-N 3.4Š|
| 157 | E | 82.1 | Confident | 83.4 | Confident | 51 Ų | 51 | 83.2 Ų | 83.2 | 24% | 0.238 | 43% | 0.428 | C | S | . | . | trans | -74.7 | 131 | 180 | -79.7 | 173.9 | -110.3 | 0 | 0 | 112.6 | W153 T154 R159 C160 A161 | W153-E157 WeakPolarHBondContact CA-OE1 3.38Å; T154-E157 PolarHBondContact N-OE1 3.14Å; T154-E157 WeakPolarHBondContact O-CB 3.44Å; T154-E157 PolarHBondContact O-N 2.69Å; T154-E157 PolarHBondContact OG1-OE1 2.9Å; E157-R159 PolarHBondContact O-N 3.5Å; E157-R159 VanDerWaalsContact O-N 3.16Å; E157-R159 IonicContact OE2-CZ 3.53Å; E157-R159 IonicContact OE2-NE 3.76Å; E157-R159 PolarHBondContact OE2-NE 3.46Å; E157-R159 IonicContact OE2-NH2 2.73Å; E157-R159 PolarHBondContact OE2-NH2 3.04Å; E157-C160 HydrophobicContact CB-CB 4.43Å; E157-C160 WeakPolarHBondContact O-CB 3.48Å; E157-C160 PolarHBondContact O-N 3.2Å; E157-A161 PolarHBondContact O-N 2.88Å | ||
| 158 | Q | 82.8 | Confident | 83.4 | Confident | 137 Ų | 137 | 87.7 Ų | 87.7 | 64% | 0.64 | 45% | 0.448 | S | S | * | . | H | α-helix | trans | -58.1 | -31.1 | 177.5 | -63 | -59.6 | -49.7 | 0 | 0 | 112.4 | A161 Q162 | Q158-A161 PolarHBondContact O-N 3.11Å; Q158-Q162 VanDerWaalsContact O-CB 3.31Å; Q158-Q162 WeakPolarHBondContact O-CB 3.35Å; Q158-Q162 WeakPolarHBondContact O-CG 3.47Å; Q158-Q162 PolarHBondContact O-N 3.04Å |
| 159 | R | 82.1 | Confident | 83.6 | Confident | 125 Ų | 125 | 91.5 Ų | 91.5 | 47% | 0.472 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -65.4 | -40.7 | 176.3 | -60.4 | -176.7 | -63.3 | 155.3 | 5.1 | 112.3 | W153 E157 Q162 L163 | W153-R159 HydrophobicContact CE3-CB 4.23Å; W153-R159 HydrophobicContact CH2-CB 3.8Å; W153-R159 HydrophobicContact CZ2-CB 4.41Å; W153-R159 HydrophobicContact CZ3-CB 3.7Å; E157-R159 PolarHBondContact O-N 3.5Å; E157-R159 VanDerWaalsContact O-N 3.16Å; E157-R159 IonicContact OE2-CZ 3.53Å; E157-R159 IonicContact OE2-NE 3.76Å; E157-R159 PolarHBondContact OE2-NE 3.46Å; E157-R159 IonicContact OE2-NH2 2.73Å; E157-R159 PolarHBondContact OE2-NH2 3.04Å; R159-Q162 PolarHBondContact O-N 3.02Å; R159-L163 WeakPolarHBondContact O-CB 3.25Å; R159-L163 PolarHBondContact O-N 3.48Å |
| 160 | C | 84.1 | Confident | 83.7 | Confident | 14 Ų | 14 | 86.4 Ų | 86.4 | 10% | 0.095 | 44% | 0.435 | C | S | . | . | H | α-helix | trans | -65 | -47.4 | 175.5 | -171.1 | 0 | 0 | 0 | 0 | 110.6 | W153 E157 Q162 L163 I164 | W153-C160 HydrophobicContact CE3-CB 3.94Å; E157-C160 HydrophobicContact CB-CB 4.43Å; E157-C160 WeakPolarHBondContact O-CB 3.48Å; E157-C160 PolarHBondContact O-N 3.2Å; C160-Q162 VanDerWaalsContact C-N 3.34Å; C160-Q162 PolarHBondContact O-N 3.35Å; C160-L163 PolarHBondContact O-N 2.89Å; C160-I164 VanDerWaalsContact O-CG1 3.31Å; C160-I164 WeakPolarHBondContact O-CG1 3.34Å; C160-I164 PolarHBondContact O-N 3.21Å |
| 161 | A | 85.4 | Confident | 84 | Confident | 35 Ų | 35 | 85 Ų | 85 | 29% | 0.289 | 42% | 0.42 | S | S | . | . | H | α-helix | trans | -61 | -39.3 | 175 | 0 | 0 | 0 | 0 | 0 | 112.9 | E157 Q158 N165 | E157-A161 PolarHBondContact O-N 2.88Å; Q158-A161 PolarHBondContact O-N 3.11Å; A161-N165 WeakPolarHBondContact O-CB 3.33Å; A161-N165 PolarHBondContact O-N 2.94Å; A161-N165 PolarHBondContact O-ND2 3.47Å |
| 162 | Q | 89.1 | Confident | 84.2 | Confident | 125 Ų | 125 | 82.4 Ų | 82.4 | 58% | 0.584 | 42% | 0.418 | S | S | * | . | H | α-helix | trans | -64.3 | -43.1 | 175.7 | -76.5 | 164.5 | 8.1 | 0 | 0 | 112 | Q158 R159 C160 N165 H166 | Q158-Q162 VanDerWaalsContact O-CB 3.31Å; Q158-Q162 WeakPolarHBondContact O-CB 3.35Å; Q158-Q162 WeakPolarHBondContact O-CG 3.47Å; Q158-Q162 PolarHBondContact O-N 3.04Å; R159-Q162 PolarHBondContact O-N 3.02Å; C160-Q162 VanDerWaalsContact C-N 3.34Å; C160-Q162 PolarHBondContact O-N 3.35Å; Q162-N165 PolarHBondContact O-N 2.94Å; Q162-H166 WeakPolarHBondContact O-CB 3.46Å; Q162-H166 PolarHBondContact O-N 2.73Å |
| 163 | L | 89.3 | Confident | 84.2 | Confident | 44 Ų | 44 | 84 Ų | 84 | 23% | 0.23 | 42% | 0.421 | C | S | . | . | H | α-helix | trans | -63.2 | -47.3 | 176.9 | 179.4 | 61.2 | 0 | 0 | 0 | 111.8 | V143 L144 L147 W153 R159 C160 N165 H166 L167 | V143-L163 HydrophobicContact CG1-CD2 4.29Å; L144-L163 HydrophobicContact CD1-CD2 4.06Å; L144-L163 HydrophobicContact CD1-CG 4.4Å; L147-L163 HydrophobicContact CD1-CD2 3.41Å; L147-L163 VanDerWaalsContact CD1-CD2 3.41Å; W153-L163 HydrophobicContact CZ3-CD2 4.32Å; R159-L163 WeakPolarHBondContact O-CB 3.25Å; R159-L163 PolarHBondContact O-N 3.48Å; C160-L163 PolarHBondContact O-N 2.89Å; L163-N165 VanDerWaalsContact C-N 3.35Å; L163-N165 PolarHBondContact O-N 3.26Å; L163-H166 WeakPolarHBondContact O-CB 3.3Å; L163-H166 PolarHBondContact O-N 2.95Å; L163-H166 VanDerWaalsContact O-N 3.13Å; L163-L167 HydrophobicContact CD1-CD1 4.13Å; L163-L167 HydrophobicContact CD1-CG 4.26Å; L163-L167 HydrophobicContact CG-CD1 4.03Å; L163-L167 WeakPolarHBondContact O-CG 3.37Å; L163-L167 PolarHBondContact O-N 2.92Å |
| 164 | I | 87.6 | Confident | 83.7 | Confident | 53 Ų | 53 | 86.8 Ų | 86.8 | 27% | 0.272 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -58.1 | -48 | 176.2 | -65.4 | 163.4 | 0 | 0 | 0 | 110.6 | L144 C160 H166 L167 H168 | L144-I164 HydrophobicContact CD1-CG1 4.1Å; L144-I164 HydrophobicContact CD2-CD1 3.91Å; L144-I164 HydrophobicContact CD2-CG1 3.73Å; L144-I164 HydrophobicContact CG-CG1 4.38Å; C160-I164 VanDerWaalsContact O-CG1 3.31Å; C160-I164 WeakPolarHBondContact O-CG1 3.34Å; C160-I164 PolarHBondContact O-N 3.21Å; I164-H166 VanDerWaalsContact C-N 3.28Å; I164-H166 PolarHBondContact O-N 2.81Å; I164-L167 PolarHBondContact O-N 3.42Å; I164-H168 VanDerWaalsContact CG2-CE1 3.48Å; I164-H168 WeakPolarHBondContact CG2-CE1 3.23Å; I164-H168 WeakPolarHBondContact O-CB 3.43Å; I164-H168 VanDerWaalsContact O-CG 3.32Å; I164-H168 PolarHBondContact O-N 2.88Å |
| 165 | N | 88.9 | Confident | 83.3 | Confident | 89 Ų | 89 | 88.4 Ų | 88.4 | 48% | 0.476 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -63.4 | -33.6 | 177.4 | -82.5 | -70.9 | 0 | 0 | 0 | 112.6 | A161 Q162 L163 K169 | A161-N165 WeakPolarHBondContact O-CB 3.33Å; A161-N165 PolarHBondContact O-N 2.94Å; A161-N165 PolarHBondContact O-ND2 3.47Å; Q162-N165 PolarHBondContact O-N 2.94Å; L163-N165 VanDerWaalsContact C-N 3.35Å; L163-N165 PolarHBondContact O-N 3.26Å; N165-K169 WeakPolarHBondContact O-CB 3.21Å; N165-K169 WeakPolarHBondContact O-CG 3.4Å; N165-K169 PolarHBondContact O-N 3.39Å |
| 166 | H | 91.1 | Very high | 82.7 | Confident | 111 Ų | 111 | 88.9 Ų | 88.9 | 51% | 0.514 | 43% | 0.432 | S | S | . | . | H | α-helix | trans | -67.9 | -48.1 | 174.1 | -176.8 | 64.9 | 0 | 0 | 0 | 111.3 | Q162 L163 I164 H168 K169 V170 | Q162-H166 WeakPolarHBondContact O-CB 3.46Å; Q162-H166 PolarHBondContact O-N 2.73Å; L163-H166 WeakPolarHBondContact O-CB 3.3Å; L163-H166 PolarHBondContact O-N 2.95Å; L163-H166 VanDerWaalsContact O-N 3.13Å; I164-H166 VanDerWaalsContact C-N 3.28Å; I164-H166 PolarHBondContact O-N 2.81Å; H166-H168 VanDerWaalsContact C-N 3.34Å; H166-H168 PolarHBondContact O-N 3.23Å; H166-K169 PolarHBondContact O-N 3.12Å; H166-K169 VanDerWaalsContact O-N 3.14Å; H166-V170 WeakPolarHBondContact O-CG2 3.41Å; H166-V170 PolarHBondContact O-N 3.44Å |
| 167 | L | 90.7 | Very high | 81.7 | Confident | 31 Ų | 31 | 86 Ų | 86 | 16% | 0.162 | 43% | 0.433 | C | S | . | . | H | α-helix | trans | -61.2 | -40.2 | 177.6 | -67.6 | 168.5 | 0 | 0 | 0 | 111.9 | F136 A140 L144 L163 I164 V170 L171 | F136-L167 HydrophobicContact CE1-CB 4.41Å; F136-L167 HydrophobicContact CE1-CD2 4.44Å; F136-L167 HydrophobicContact CZ-CD2 3.95Å; A140-L167 HydrophobicContact CB-CD1 4Å; L144-L167 HydrophobicContact CD1-CD1 4.27Å; L163-L167 HydrophobicContact CD1-CD1 4.13Å; L163-L167 HydrophobicContact CD1-CG 4.26Å; L163-L167 HydrophobicContact CG-CD1 4.03Å; L163-L167 WeakPolarHBondContact O-CG 3.37Å; L163-L167 PolarHBondContact O-N 2.92Å; I164-L167 PolarHBondContact O-N 3.42Å; L167-V170 PolarHBondContact O-N 3.35Å; L167-L171 WeakPolarHBondContact O-CB 3.43Å; L167-L171 PolarHBondContact O-N 3.17Å |
| 168 | H | 87.7 | Confident | 79.6 | Confident | 117 Ų | 117 | 86.9 Ų | 86.9 | 54% | 0.542 | 45% | 0.449 | S | S | . | . | H | α-helix | trans | -66.4 | -39.3 | 173.3 | -69.1 | 173.1 | 0 | 0 | 0 | 112.8 | I164 H166 L171 A172 | I164-H168 VanDerWaalsContact CG2-CE1 3.48Å; I164-H168 WeakPolarHBondContact CG2-CE1 3.23Å; I164-H168 WeakPolarHBondContact O-CB 3.43Å; I164-H168 VanDerWaalsContact O-CG 3.32Å; I164-H168 PolarHBondContact O-N 2.88Å; H166-H168 VanDerWaalsContact C-N 3.34Å; H166-H168 PolarHBondContact O-N 3.23Å; H168-L171 PolarHBondContact O-N 2.86Å; H168-A172 WeakPolarHBondContact O-CB 3.37Å; H168-A172 PolarHBondContact O-N 2.9Å |
| 169 | K | 90.4 | Very high | 77.7 | Confident | 137 Ų | 137 | 85.4 Ų | 85.4 | 60% | 0.596 | 45% | 0.451 | S | S | * | . | H | α-helix | trans | -64.5 | -41.5 | 174.1 | -78.6 | 172.7 | -179.3 | -176 | 0 | 112.1 | N165 H166 A172 Q173 | N165-K169 WeakPolarHBondContact O-CB 3.21Å; N165-K169 WeakPolarHBondContact O-CG 3.4Å; N165-K169 PolarHBondContact O-N 3.39Å; H166-K169 PolarHBondContact O-N 3.12Å; H166-K169 VanDerWaalsContact O-N 3.14Å; K169-A172 PolarHBondContact O-N 3.06Å; K169-Q173 WeakPolarHBondContact O-CG 3.12Å; K169-Q173 PolarHBondContact O-N 2.92Å |
| 170 | V | 88.5 | Confident | 75.6 | Confident | 30 Ų | 30 | 85.3 Ų | 85.3 | 18% | 0.182 | 47% | 0.467 | C | S | . | . | H | α-helix | trans | -63.2 | -47.2 | 175.4 | 169.9 | 0 | 0 | 0 | 0 | 110.1 | F136 H166 L167 A172 Q173 F174 | F136-V170 HydrophobicContact CE2-CG1 3.97Å; F136-V170 HydrophobicContact CZ-CB 4.24Å; F136-V170 HydrophobicContact CZ-CG1 3.81Å; H166-V170 WeakPolarHBondContact O-CG2 3.41Å; H166-V170 PolarHBondContact O-N 3.44Å; L167-V170 PolarHBondContact O-N 3.35Å; V170-A172 VanDerWaalsContact C-N 3.27Å; V170-A172 PolarHBondContact O-N 2.83Å; V170-Q173 WeakPolarHBondContact O-CB 2.94Å; V170-Q173 PolarHBondContact O-N 3.44Å; V170-Q173 VanDerWaalsContact O-N 3.08Å; V170-F174 HydrophobicContact CG1-CD2 4.29Å; V170-F174 HydrophobicContact CG1-CE2 3.7Å; V170-F174 WeakPolarHBondContact O-CD2 3.48Å; V170-F174 PolarHBondContact O-N 3.42Å |
| 171 | L | 86.9 | Confident | 73.3 | Confident | 25 Ų | 25 | 92.4 Ų | 92.4 | 13% | 0.131 | 50% | 0.503 | C | S | . | . | H | α-helix | trans | -60.5 | -34.1 | 175.5 | -172.5 | 62.2 | 0 | 0 | 0 | 113 | H133 F136 Q137 L167 H168 F174 | H133-L171 HydrophobicContact CB-CD1 4.28Å; F136-L171 HydrophobicContact CD1-CB 4.23Å; F136-L171 HydrophobicContact CD1-CD1 3.82Å; F136-L171 HydrophobicContact CD1-CD2 4.48Å; F136-L171 HydrophobicContact CD1-CG 4.41Å; F136-L171 HydrophobicContact CE1-CB 3.96Å; F136-L171 HydrophobicContact CE1-CD1 4.39Å; F136-L171 HydrophobicContact CG-CD1 4.31Å; Q137-L171 HydrophobicContact CG-CD2 4.21Å; L167-L171 WeakPolarHBondContact O-CB 3.43Å; L167-L171 PolarHBondContact O-N 3.17Å; H168-L171 PolarHBondContact O-N 2.86Å; L171-F174 PolarHBondContact O-N 2.89Å |
| 172 | A | 84.1 | Confident | 71 | Confident | 56 Ų | 56 | 99.3 Ų | 99.3 | 46% | 0.463 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -72.5 | -28.1 | 175.3 | 0 | 0 | 0 | 0 | 0 | 113.3 | H168 K169 V170 F174 Q175 | H168-A172 WeakPolarHBondContact O-CB 3.37Å; H168-A172 PolarHBondContact O-N 2.9Å; K169-A172 PolarHBondContact O-N 3.06Å; V170-A172 VanDerWaalsContact C-N 3.27Å; V170-A172 PolarHBondContact O-N 2.83Å; A172-F174 VanDerWaalsContact C-N 3.26Å; A172-F174 PolarHBondContact O-N 3.45Å; A172-Q175 WeakPolarHBondContact O-CB 3.32Å; A172-Q175 PolarHBondContact O-N 3.26Å |
| 173 | Q | 81.3 | Confident | 68.7 | Low | 153 Ų | 153 | 102.3 Ų | 102.3 | 72% | 0.715 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -70.7 | -20.2 | 175.1 | -73.1 | 169.7 | 11.5 | 0 | 0 | 113.2 | K169 V170 Q175 | K169-Q173 WeakPolarHBondContact O-CG 3.12Å; K169-Q173 PolarHBondContact O-N 2.92Å; V170-Q173 WeakPolarHBondContact O-CB 2.94Å; V170-Q173 PolarHBondContact O-N 3.44Å; V170-Q173 VanDerWaalsContact O-N 3.08Å; Q173-Q175 VanDerWaalsContact C-N 3.35Å |
| 174 | F | 70.6 | Confident | 66.1 | Low | 100 Ų | 100 | 109.2 Ų | 109.2 | 44% | 0.439 | 57% | 0.574 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -86.4 | -1.3 | 174.3 | -68.2 | -68.9 | 0 | 0 | 0 | 113.9 | F132 V170 L171 A172 | F132-F174 HydrophobicContact CE1-CB 4.42Å; F132-F174 HydrophobicContact CE1-CD1 4.29Å; F132-F174 AromaticContact CE1-CD2 3.96Å; F132-F174 HydrophobicContact CE1-CD2 3.96Å; F132-F174 HydrophobicContact CE1-CE2 4.28Å; F132-F174 AromaticContact CE1-CG 3.97Å; F132-F174 HydrophobicContact CE1-CG 3.97Å; F132-F174 HydrophobicContact CZ-CD2 4.44Å; F132-F174 HydrophobicContact CZ-CE2 4.31Å; F132-F174 HydrophobicContact CZ-CZ 4.42Å; V170-F174 HydrophobicContact CG1-CD2 4.29Å; V170-F174 HydrophobicContact CG1-CE2 3.7Å; V170-F174 WeakPolarHBondContact O-CD2 3.48Å; V170-F174 PolarHBondContact O-N 3.42Å; L171-F174 PolarHBondContact O-N 2.89Å; A172-F174 VanDerWaalsContact C-N 3.26Å; A172-F174 PolarHBondContact O-N 3.45Å |
| 175 | Q | 67.4 | Low | 63.3 | Low | 104 Ų | 104 | 113.9 Ų | 113.9 | 49% | 0.486 | 60% | 0.599 | S | S | . | * | S | Bend | trans | -77.2 | 129.9 | 173.3 | -69.5 | -70 | -4.5 | 0 | 0 | 110.8 | H133 A172 Q173 D177 | H133-Q175 PolarHBondContact CE1-NE2 2.88Å; A172-Q175 WeakPolarHBondContact O-CB 3.32Å; A172-Q175 PolarHBondContact O-N 3.26Å; Q173-Q175 VanDerWaalsContact C-N 3.35Å; Q175-D177 PolarHBondContact O-N 3.48Å |
| 176 | P | 55.2 | Low | 61.3 | Low | 111 Ų | 111 | 115.2 Ų | 115.2 | 72% | 0.721 | 61% | 0.612 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77 | 12.1 | -170.3 | 30.9 | -36.7 | 0 | 0 | 0 | 115.9 | ||
| 177 | D | 50.5 | Low | 58.3 | Low | 157 Ų | 157 | 115 Ų | 115 | 84% | 0.84 | 63% | 0.63 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -138.7 | 43.4 | -173.2 | -157.8 | 21.6 | 0 | 0 | 0 | 113.5 | Q175 | Q175-D177 PolarHBondContact O-N 3.48Š|
| 178 | A | 38.8 | Very low | 55.4 | Low | 71 Ų | 71 | 117.3 Ų | 117.3 | 59% | 0.587 | 66% | 0.661 | S | S | * | * | trans | -109.5 | 124.4 | 168.7 | 0 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 179 | P | 41.1 | Very low | 52.7 | Low | 105 Ų | 105 | 119.8 Ų | 119.8 | 68% | 0.682 | 68% | 0.679 | S | S | * | * | trans | -65 | 147.9 | 174.6 | 28.2 | -34.4 | 0 | 0 | 0 | 110.1 | L181 | P179-L181 PolarHBondContact O-N 2.85Š| ||
| 180 | P | 38.7 | Very low | 49.9 | Very low | 124 Ų | 124 | 117.5 Ų | 117.5 | 81% | 0.805 | 69% | 0.685 | S | S | * | * | trans | -70.8 | 93.5 | -178.5 | 29.5 | -34.6 | 0 | 0 | 0 | 110.1 | Q182 | P180-Q182 PolarHBondContact O-N 3.14Å; P180-Q182 VanDerWaalsContact O-N 3.16Å | ||
| 181 | L | 36.8 | Very low | 47.4 | Very low | 162 Ų | 162 | 125.2 Ų | 125.2 | 85% | 0.848 | 72% | 0.719 | S | S | * | * | P | Polyproline II helix | trans | -63.8 | 118.8 | 164.7 | -72.3 | -165.3 | 0 | 0 | 0 | 108.4 | P179 | P179-L181 PolarHBondContact O-N 2.85Š|
| 182 | Q | 36.6 | Very low | 44.5 | Very low | 181 Ų | 181 | 131.8 Ų | 131.8 | 85% | 0.846 | 75% | 0.754 | S | S | * | * | P | Polyproline II helix | trans | -55.6 | 143.1 | 177.3 | -68.1 | -176.3 | -54.8 | 0 | 0 | 110.7 | P180 Q184 | P180-Q182 PolarHBondContact O-N 3.14Å; P180-Q182 VanDerWaalsContact O-N 3.16Å; Q182-Q184 PolarHBondContact O-N 3.24Å; Q182-Q184 VanDerWaalsContact O-N 3.14Å |
| 183 | H | 41.5 | Very low | 41.9 | Very low | 188 Ų | 188 | 132.9 Ų | 132.9 | 87% | 0.87 | 76% | 0.763 | S | S | * | * | P | Polyproline II helix | trans | -54.1 | 116.7 | 163 | -120 | 75.2 | 0 | 0 | 0 | 109.3 | ||
| 184 | Q | 33.2 | Very low | 39.6 | Very low | 188 Ų | 188 | 134.3 Ų | 134.3 | 88% | 0.879 | 77% | 0.77 | S | S | * | * | trans | -138.8 | 108.8 | 165.1 | -151 | 171.9 | 24.2 | 0 | 0 | 110.4 | Q182 | Q182-Q184 PolarHBondContact O-N 3.24Å; Q182-Q184 VanDerWaalsContact O-N 3.14Å | ||
| 185 | L | 28.8 | Very low | 37.6 | Very low | 151 Ų | 151 | 138.7 Ų | 138.7 | 79% | 0.791 | 79% | 0.789 | S | S | * | * | trans | -111.2 | 154.1 | 161 | -93.2 | 135.5 | 0 | 0 | 0 | 108 | ||||
| 186 | P | 48.5 | Very low | 35.7 | Very low | 118 Ų | 118 | 139.7 Ų | 139.7 | 77% | 0.766 | 81% | 0.807 | S | S | * | * | trans | -103.3 | 154.8 | -151.5 | 38.1 | -35.6 | 0 | 0 | 0 | 114.8 | ||||
| 187 | A | 27.3 | Very low | 34.6 | Very low | 106 Ų | 106 | 140.8 Ų | 140.8 | 88% | 0.876 | 81% | 0.807 | S | S | * | * | trans | -173.3 | 137.7 | 148.4 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 188 | G | 29.1 | Very low | 33.5 | Very low | 80 Ų | 80 | 139.5 Ų | 139.5 | 83% | 0.825 | 81% | 0.809 | S | S | * | * | trans | 95.2 | 117.1 | 137.8 | 0 | 0 | 0 | 0 | 0 | 120.2 | ||||
| 189 | D | 30.7 | Very low | 33.3 | Very low | 169 Ų | 169 | 143.9 Ų | 143.9 | 90% | 0.904 | 82% | 0.817 | S | S | * | * | trans | -58.7 | 145.3 | 167.8 | -72.3 | -100.9 | 0 | 0 | 0 | 115.7 | ||||
| 190 | A | 33.3 | Very low | 32.8 | Very low | 88 Ų | 88 | 144.9 Ų | 144.9 | 73% | 0.727 | 82% | 0.822 | S | S | * | * | 156.8 | 125.4 | 107.4 | 0 | 0 | 0 | 0 | 0 | 115.5 | |||||
| 191 | Q | 34.3 | Very low | 32.7 | Very low | 192 Ų | 192 | 145.1 Ų | 145.1 | 90% | 0.897 | 82% | 0.816 | S | S | * | * | trans | 56.6 | 109 | 145.5 | -61.8 | -168.8 | -43.3 | 0 | 0 | 123.8 | ||||
| 192 | D | 27.3 | Very low | 33.3 | Very low | 164 Ų | 164 | 143.6 Ų | 143.6 | 88% | 0.877 | 82% | 0.818 | S | S | * | * | 75.1 | 155.1 | 117.2 | -154.2 | -136.2 | 0 | 0 | 0 | 123.7 | |||||
| 193 | A | 29.4 | Very low | 33.3 | Very low | 78 Ų | 78 | 141 Ų | 141 | 65% | 0.645 | 81% | 0.814 | S | S | * | * | trans | 84 | 84.7 | 162.9 | 0 | 0 | 0 | 0 | 0 | 121.4 | ||||
| 194 | Q | 32.1 | Very low | 33.5 | Very low | 184 Ų | 184 | 137.4 Ų | 137.4 | 86% | 0.86 | 81% | 0.807 | S | S | * | * | 71.7 | 94.3 | 115.5 | -161.3 | 160.7 | -104.5 | 0 | 0 | 122.7 | |||||
| 195 | K | 28.4 | Very low | 33.9 | Very low | 191 Ų | 191 | 135.3 Ų | 135.3 | 83% | 0.83 | 81% | 0.807 | S | S | * | * | 51.2 | 113.4 | 118.2 | -159.9 | -178.1 | -170.2 | -179.7 | 0 | 120.6 | |||||
| 196 | S | 28.9 | Very low | 35 | Very low | 126 Ų | 126 | 134.9 Ų | 134.9 | 88% | 0.881 | 80% | 0.804 | S | S | * | * | trans | -156.5 | 157.5 | 135.1 | 46 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 197 | D | 30.8 | Very low | 34.8 | Very low | 133 Ų | 133 | 137.9 Ų | 137.9 | 71% | 0.711 | 81% | 0.808 | S | S | * | * | trans | -94.3 | 164.8 | -161.8 | -129.5 | -60.1 | 0 | 0 | 0 | 114.3 | ||||
| 198 | C | 27.4 | Very low | 35 | Very low | 131 Ų | 131 | 144.1 Ų | 144.1 | 89% | 0.885 | 81% | 0.809 | S | S | * | * | trans | 169.9 | 75.8 | 133.5 | -93.7 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 199 | Q | 34.2 | Very low | 35.4 | Very low | 162 Ų | 162 | 146.3 Ų | 146.3 | 76% | 0.757 | 81% | 0.806 | S | S | * | * | trans | -11.7 | 132.7 | 146 | -179.8 | -173.9 | 28.3 | 0 | 0 | 119.4 | ||||
| 200 | T | 32.2 | Very low | 35.7 | Very low | 127 Ų | 127 | 147.3 Ų | 147.3 | 78% | 0.779 | 81% | 0.806 | S | S | * | * | trans | -145 | 107.2 | 138.4 | 54.6 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 201 | N | 36.1 | Very low | 35.7 | Very low | 128 Ų | 128 | 146.9 Ų | 146.9 | 68% | 0.684 | 81% | 0.809 | S | S | * | * | trans | 59.4 | 85.1 | 136.9 | -53 | -41.4 | 0 | 0 | 0 | 121.2 | ||||
| 202 | C | 48.4 | Very low | 35.8 | Very low | 130 Ų | 130 | 141 Ų | 141 | 88% | 0.878 | 80% | 0.8 | S | S | * | * | trans | -115.9 | 122.2 | 143.3 | -70.6 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 203 | V | 38.3 | Very low | 36.1 | Very low | 127 Ų | 127 | 142.3 Ų | 142.3 | 77% | 0.77 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -99.2 | 117.8 | 178 | 179.1 | 0 | 0 | 0 | 0 | 109.5 | V205 | V203-V205 PolarHBondContact O-N 3.46Š|
| 204 | P | 45.3 | Very low | 36.8 | Very low | 113 Ų | 113 | 146.6 Ų | 146.6 | 73% | 0.734 | 81% | 0.812 | S | S | * | * | P | Polyproline II helix | trans | -74.9 | 122.5 | 170 | 30 | -31.4 | 0 | 0 | 0 | 109.8 | I206 | P204-I206 PolarHBondContact O-N 2.79Š|
| 205 | V | 41.2 | Very low | 37.4 | Very low | 144 Ų | 144 | 144.7 Ų | 144.7 | 87% | 0.873 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -73 | 127.1 | 170.9 | 173.3 | 0 | 0 | 0 | 0 | 109.1 | V203 | V203-V205 PolarHBondContact O-N 3.46Š|
| 206 | I | 51.7 | Low | 38.3 | Very low | 141 Ų | 141 | 144.5 Ų | 144.5 | 72% | 0.723 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -68.7 | 127.1 | -163.7 | -65.6 | 157.8 | 0 | 0 | 0 | 112.4 | P204 R208 | P204-I206 PolarHBondContact O-N 2.79Å; I206-R208 HydrophobicContact CG2-CG 4.23Å |
| 207 | Q | 43.6 | Very low | 39.5 | Very low | 181 Ų | 181 | 145.5 Ų | 145.5 | 85% | 0.846 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -77.6 | 118.9 | 161.6 | -166.3 | 173.3 | 22.6 | 0 | 0 | 108.4 | ||
| 208 | R | 32.6 | Very low | 40.3 | Very low | 238 Ų | 238 | 146 Ų | 146 | 90% | 0.898 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -96.7 | 128.7 | 176.5 | -93 | -170 | 178.7 | 136.8 | -0.1 | 111.6 | I206 | I206-R208 HydrophobicContact CG2-CG 4.23Š|
| 209 | T | 37.7 | Very low | 41.3 | Very low | 126 Ų | 126 | 145.2 Ų | 145.2 | 77% | 0.773 | 80% | 0.799 | S | S | * | * | trans | -118.1 | 114.3 | 174.6 | 50.6 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 210 | Q | 36.3 | Very low | 42.1 | Very low | 190 Ų | 190 | 144.9 Ų | 144.9 | 89% | 0.888 | 80% | 0.803 | S | S | * | * | trans | -151.4 | 129.2 | 159.1 | -63.5 | -176.3 | -5.1 | 0 | 0 | 103.8 | ||||
| 211 | G | 33.8 | Very low | 43.1 | Very low | 78 Ų | 78 | 144.4 Ų | 144.4 | 80% | 0.804 | 80% | 0.8 | S | S | * | * | cis | 82.8 | 99.8 | 15.2 | 0 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 212 | G | 36.3 | Very low | 43.2 | Very low | 68 Ų | 68 | 145.2 Ų | 145.2 | 70% | 0.701 | 80% | 0.804 | S | S | * | * | cis | 152.6 | 101.1 | -11.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 213 | E | 33.7 | Very low | 43.5 | Very low | 193 Ų | 193 | 145 Ų | 145 | 90% | 0.902 | 80% | 0.804 | S | S | * | * | trans | -157.5 | 178 | 177.6 | 42.2 | -148.3 | 106.3 | 0 | 0 | 113.3 | ||||
| 214 | L | 44.8 | Very low | 44 | Very low | 168 Ų | 168 | 141.4 Ų | 141.4 | 88% | 0.88 | 79% | 0.792 | S | S | * | * | trans | -105.4 | 149.8 | -148.2 | -63.2 | 156.8 | 0 | 0 | 0 | 113.7 | ||||
| 215 | N | 44.8 | Very low | 43.9 | Very low | 143 Ų | 143 | 147 Ų | 147 | 77% | 0.765 | 80% | 0.801 | S | S | * | * | trans | 51.4 | 104.4 | 141.1 | -176.6 | 93.8 | 0 | 0 | 0 | 118.8 | ||||
| 216 | E | 47.1 | Very low | 44.3 | Very low | 188 Ų | 188 | 142.9 Ų | 142.9 | 88% | 0.879 | 79% | 0.787 | S | S | * | * | trans | -153 | 139.3 | 142.3 | 52.3 | -160.4 | 152.8 | 0 | 0 | 111.6 | ||||
| 217 | N | 53.1 | Low | 43.9 | Very low | 147 Ų | 147 | 139.1 Ų | 139.1 | 79% | 0.786 | 78% | 0.784 | S | S | * | * | trans | -98.8 | 134.3 | 168.1 | -57 | -58.7 | 0 | 0 | 0 | 107.5 | ||||
| 218 | D | 48.2 | Very low | 44 | Very low | 144 Ų | 144 | 138.2 Ų | 138.2 | 77% | 0.77 | 78% | 0.779 | S | S | * | * | trans | -162 | 115.1 | 146.5 | -107.2 | -25.2 | 0 | 0 | 0 | 107.6 | ||||
| 219 | T | 48.9 | Very low | 44.5 | Very low | 113 Ų | 113 | 130.7 Ų | 130.7 | 69% | 0.693 | 77% | 0.768 | S | S | * | * | 64.1 | 105.6 | 90.8 | 67.5 | 0 | 0 | 0 | 0 | 114.4 | |||||
| 220 | D | 49.3 | Very low | 44.6 | Very low | 156 Ų | 156 | 132 Ų | 132 | 83% | 0.834 | 77% | 0.765 | S | S | * | * | trans | -148.2 | 91 | 139.1 | -136.9 | -17.9 | 0 | 0 | 0 | 107.8 | ||||
| 221 | T | 54.1 | Low | 44.6 | Very low | 117 Ų | 117 | 130.8 Ų | 130.8 | 72% | 0.718 | 76% | 0.757 | S | S | * | * | 54.8 | 124.5 | 91.6 | 19.9 | 0 | 0 | 0 | 0 | 118.2 | |||||
| 222 | D | 38.2 | Very low | 44.7 | Very low | 145 Ų | 145 | 132 Ų | 132 | 78% | 0.775 | 75% | 0.754 | S | S | * | * | trans | 69.9 | 88.6 | 143.2 | -157 | 26 | 0 | 0 | 0 | 121.1 | ||||
| 223 | S | 53.9 | Low | 44.5 | Very low | 125 Ų | 125 | 136.3 Ų | 136.3 | 87% | 0.874 | 76% | 0.76 | S | S | * | * | -161.5 | 130.5 | 109.2 | -157.5 | 0 | 0 | 0 | 0 | 109.8 | |||||
| 224 | G | 50.5 | Low | 44.8 | Very low | 51 Ų | 51 | 129.7 Ų | 129.7 | 53% | 0.526 | 74% | 0.744 | S | S | . | * | cis | 140.3 | 87.4 | 3.2 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 225 | Y | 43.1 | Very low | 44.3 | Very low | 231 Ų | 231 | 131 Ų | 131 | 91% | 0.906 | 74% | 0.743 | S | S | * | * | trans | 68.5 | 140.7 | 147.1 | -150 | -98.4 | 0 | 0 | 0 | 118.5 | ||||
| 226 | G | 48.7 | Very low | 43.8 | Very low | 57 Ų | 57 | 131.7 Ų | 131.7 | 59% | 0.588 | 75% | 0.746 | S | S | * | * | cis | 164.6 | 152.1 | -4.4 | 0 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 227 | G | 42.9 | Very low | 43.4 | Very low | 63 Ų | 63 | 132.1 Ų | 132.1 | 65% | 0.649 | 75% | 0.745 | S | S | * | * | trans | 79.1 | 158.6 | 155.2 | 0 | 0 | 0 | 0 | 0 | 119.5 | ||||
| 228 | E | 45.5 | Very low | 42.4 | Very low | 161 Ų | 161 | 134.1 Ų | 134.1 | 75% | 0.752 | 75% | 0.75 | S | S | * | * | cis | -153.8 | 162 | -6.6 | -67.2 | -64.1 | 126.1 | 0 | 0 | 109 | ||||
| 229 | A | 44.2 | Very low | 41.4 | Very low | 80 Ų | 80 | 132.7 Ų | 132.7 | 66% | 0.661 | 75% | 0.75 | S | S | * | * | trans | 42.7 | 140.6 | 137.9 | 0 | 0 | 0 | 0 | 0 | 122.1 | ||||
| 230 | E | 40 | Very low | 40.6 | Very low | 155 Ų | 155 | 134.1 Ų | 134.1 | 72% | 0.724 | 75% | 0.749 | S | S | * | * | cis | 180 | -175.3 | 4.7 | -109.5 | -169.9 | 116.3 | 0 | 0 | 108.2 | ||||
| 231 | K | 36 | Very low | 39.8 | Very low | 164 Ų | 164 | 136.8 Ų | 136.8 | 71% | 0.713 | 75% | 0.747 | S | S | * | * | trans | 84.8 | 90.6 | 154.6 | -41 | -160.7 | -176.8 | -174.4 | 0 | 116.1 | ||||
| 232 | S | 35.8 | Very low | 38.8 | Very low | 104 Ų | 104 | 137.2 Ų | 137.2 | 73% | 0.727 | 75% | 0.745 | S | S | * | * | 83 | 119.8 | 74.7 | 68.9 | 0 | 0 | 0 | 0 | 114.3 | |||||
| 233 | D | 32.3 | Very low | 38.6 | Very low | 157 Ų | 157 | 139.6 Ų | 139.6 | 84% | 0.84 | 75% | 0.749 | S | S | * | * | -170.9 | 166.8 | 93 | -145 | -91.6 | 0 | 0 | 0 | 110 | |||||
| 234 | G | 39.9 | Very low | 37.5 | Very low | 55 Ų | 55 | 138.5 Ų | 138.5 | 57% | 0.567 | 75% | 0.747 | S | S | * | * | trans | -124.3 | 169.6 | -170.6 | 0 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 235 | K | 33.3 | Very low | 36.6 | Very low | 196 Ų | 196 | 142.8 Ų | 142.8 | 85% | 0.852 | 76% | 0.762 | S | S | * | * | trans | -169.8 | 115.9 | 147.8 | -119.1 | 160.7 | -173.5 | 135.7 | 0 | 114.1 | ||||
| 236 | D | 35.3 | Very low | 36.2 | Very low | 156 Ų | 156 | 141.3 Ų | 141.3 | 83% | 0.834 | 76% | 0.761 | S | S | * | * | trans | -68.7 | 143.7 | 156.9 | -63.7 | -73.3 | 0 | 0 | 0 | 111.3 | ||||
| 237 | K | 38.1 | Very low | 35.7 | Very low | 197 Ų | 197 | 145.8 Ų | 145.8 | 86% | 0.857 | 77% | 0.77 | S | S | * | * | trans | -150.9 | 108.6 | 151.3 | -80.7 | -151 | 174 | -170.5 | 0 | 111.2 | ||||
| 238 | E | 32.2 | Very low | 35.4 | Very low | 190 Ų | 190 | 152.1 Ų | 152.1 | 89% | 0.888 | 78% | 0.779 | S | S | * | * | trans | -72.5 | 143.3 | 159 | -176.9 | -172.6 | 170.5 | 0 | 0 | 110.7 | ||||
| 239 | C | 26.4 | Very low | 34.6 | Very low | 114 Ų | 114 | 151.8 Ų | 151.8 | 77% | 0.77 | 78% | 0.778 | S | S | * | * | trans | -176.3 | 138.3 | 136.1 | -168.7 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 240 | E | 32.8 | Very low | 34.2 | Very low | 143 Ų | 143 | 155.3 Ų | 155.3 | 67% | 0.668 | 78% | 0.781 | S | S | * | * | trans | -50.8 | 152.8 | 170.8 | -64.9 | 175.7 | 66.9 | 0 | 0 | 115 | N242 | E240-N242 PolarHBondContact OE1-ND2 2.9Š| ||
| 241 | R | 31.6 | Very low | 33.6 | Very low | 211 Ų | 211 | 157.9 Ų | 157.9 | 80% | 0.796 | 79% | 0.79 | S | S | * | * | -156 | 110.3 | 124.1 | -171.3 | 155.2 | -74.6 | 127.8 | -1.9 | 113.5 | |||||
| 242 | N | 33.8 | Very low | 33.5 | Very low | 127 Ų | 127 | 152.4 Ų | 152.4 | 68% | 0.679 | 78% | 0.779 | S | S | * | * | trans | -44.7 | 137.5 | 160.1 | -74 | -79.8 | 0 | 0 | 0 | 113.3 | E240 | E240-N242 PolarHBondContact OE1-ND2 2.9Š| ||
| 243 | K | 34.4 | Very low | 33.1 | Very low | 195 Ų | 195 | 154.7 Ų | 154.7 | 85% | 0.848 | 78% | 0.783 | S | S | * | * | trans | -158.8 | 128.7 | 151.4 | -111.7 | 160.8 | -167.9 | -176.6 | 0 | 112.4 | ||||
| 244 | A | 30.1 | Very low | 33 | Very low | 101 Ų | 101 | 154 Ų | 154 | 84% | 0.835 | 78% | 0.78 | S | S | * | * | trans | -70 | 143.4 | -169.1 | 0 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 245 | V | 32.6 | Very low | 32.7 | Very low | 141 Ų | 141 | 162.6 Ų | 162.6 | 86% | 0.855 | 80% | 0.795 | S | S | * | * | trans | -86.5 | 122.6 | 160.8 | 176.3 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 246 | K | 33.5 | Very low | 32.6 | Very low | 200 Ų | 200 | 158.4 Ų | 158.4 | 87% | 0.87 | 80% | 0.797 | S | S | * | * | trans | -102.9 | 111.3 | -178.5 | -163.8 | 168.2 | -173.7 | 171.9 | 0 | 110.4 | ||||
| 247 | I | 39.1 | Very low | 32.5 | Very low | 152 Ų | 152 | 155.4 Ų | 155.4 | 78% | 0.779 | 79% | 0.794 | S | S | * | * | trans | -67 | 137.6 | 171.2 | -66.1 | 168.5 | 0 | 0 | 0 | 109.4 | ||||
| 248 | K | 36 | Very low | 32.6 | Very low | 195 Ų | 195 | 155.6 Ų | 155.6 | 85% | 0.848 | 80% | 0.795 | S | S | * | * | trans | -158.8 | 99.3 | 163.9 | -170.5 | 172.7 | -176.8 | -176.7 | 0 | 105.7 | ||||
| 249 | Q | 29.6 | Very low | 32.6 | Very low | 154 Ų | 154 | 155.4 Ų | 155.4 | 72% | 0.72 | 79% | 0.791 | S | S | * | * | 68.1 | 135.1 | 61.7 | -156 | 171.2 | 11.1 | 0 | 0 | 113.2 | |||||
| 250 | E | 35.9 | Very low | 32.8 | Very low | 155 Ų | 155 | 157 Ų | 157 | 72% | 0.724 | 80% | 0.798 | S | S | * | * | trans | -68.9 | 162.6 | -153.5 | 58.1 | -109.9 | 114.6 | 0 | 0 | 118.6 | ||||
| 251 | F | 26.6 | Very low | 32.9 | Very low | 209 Ų | 209 | 159.6 Ų | 159.6 | 92% | 0.917 | 81% | 0.807 | S | S | * | * | trans | -153.1 | 143 | 141.4 | -162.2 | -99.6 | 0 | 0 | 0 | 110 | ||||
| 252 | G | 34.7 | Very low | 32.8 | Very low | 48 Ų | 48 | 157.2 Ų | 157.2 | 50% | 0.495 | 81% | 0.807 | S | S | . | * | trans | -115.6 | -172.3 | -176.3 | 0 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 253 | D | 27.6 | Very low | 32.3 | Very low | 152 Ų | 152 | 156.4 Ų | 156.4 | 81% | 0.813 | 81% | 0.81 | S | S | * | * | trans | 62.2 | 151.7 | 179.2 | -86.9 | -64.9 | 0 | 0 | 0 | 117.2 | ||||
| 254 | D | 29.8 | Very low | 31.8 | Very low | 142 Ų | 142 | 158 Ų | 158 | 76% | 0.759 | 81% | 0.811 | S | S | * | * | cis | -148.3 | 175.9 | 12.5 | -150.3 | -42.1 | 0 | 0 | 0 | 111.9 | ||||
| 255 | R | 33 | Very low | 31.8 | Very low | 236 Ų | 236 | 158.5 Ų | 158.5 | 89% | 0.891 | 81% | 0.808 | S | S | * | * | trans | -77.8 | 154.3 | -178.3 | -71.5 | 170.5 | 159.3 | 147.6 | -6.4 | 114.9 | ||||
| 256 | A | 31 | Very low | 31.6 | Very low | 108 Ų | 108 | 155.5 Ų | 155.5 | 89% | 0.893 | 81% | 0.806 | S | S | * | * | trans | -154.6 | 137.3 | 143.1 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 257 | A | 33.1 | Very low | 31.4 | Very low | 94 Ų | 94 | 153.8 Ų | 153.8 | 78% | 0.777 | 81% | 0.806 | S | S | * | * | trans | -103.9 | 154.9 | -168.7 | 0 | 0 | 0 | 0 | 0 | 115.2 | ||||
| 258 | K | 40.3 | Very low | 30.9 | Very low | 200 Ų | 200 | 151.2 Ų | 151.2 | 87% | 0.87 | 81% | 0.807 | S | S | * | * | trans | -135.9 | 86.7 | 155.6 | -75.7 | -169.6 | -179 | 173.4 | 0 | 113.9 | ||||
| 259 | K | 33.4 | Very low | 30.5 | Very low | 186 Ų | 186 | 149.2 Ų | 149.2 | 81% | 0.809 | 81% | 0.806 | S | S | * | * | trans | 4 | 127.5 | 137.8 | 49.4 | -174.9 | 169 | -173.6 | 0 | 118.3 | ||||
| 260 | T | 30.4 | Very low | 31.4 | Very low | 149 Ų | 149 | 146.4 Ų | 146.4 | 91% | 0.914 | 80% | 0.801 | S | S | * | * | trans | -141.2 | 140.9 | 134 | -74.3 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 261 | K | 34 | Very low | 31.1 | Very low | 197 Ų | 197 | 146.1 Ų | 146.1 | 86% | 0.857 | 81% | 0.81 | S | S | * | * | trans | -129 | 120.5 | -166.4 | 174.7 | -174.6 | -178 | -179.2 | 0 | 108.3 | ||||
| 262 | M | 30.2 | Very low | 31.4 | Very low | 160 Ų | 160 | 145.2 Ų | 145.2 | 79% | 0.788 | 80% | 0.801 | S | S | * | * | trans | -150.6 | 117.7 | 159.2 | -155.2 | 63.6 | 170.6 | 0 | 0 | 109.5 | ||||
| 263 | C | 23.3 | Very low | 31.7 | Very low | 110 Ų | 110 | 148.8 Ų | 148.8 | 74% | 0.743 | 82% | 0.815 | S | S | * | * | trans | -136.9 | 133.9 | 170.2 | -178.5 | 0 | 0 | 0 | 0 | 106 | ||||
| 264 | W | 24.5 | Very low | 31.7 | Very low | 229 Ų | 229 | 146 Ų | 146 | 87% | 0.867 | 80% | 0.801 | S | S | * | * | trans | -116.9 | 128 | 163.2 | -91.5 | 72.3 | 0 | 0 | 0 | 107.2 | ||||
| 265 | S | 29.3 | Very low | 32.1 | Very low | 111 Ų | 111 | 146.1 Ų | 146.1 | 78% | 0.776 | 81% | 0.806 | S | S | * | * | trans | -137.1 | 134 | 169.1 | -177.8 | 0 | 0 | 0 | 0 | 107.1 | ||||
| 266 | G | 28.3 | Very low | 32.2 | Very low | 79 Ų | 79 | 139 Ų | 139 | 81% | 0.814 | 80% | 0.798 | S | S | * | * | trans | -159.5 | 114.7 | -177.4 | 0 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 267 | N | 28.6 | Very low | 32.6 | Very low | 163 Ų | 163 | 142.8 Ų | 142.8 | 87% | 0.872 | 79% | 0.794 | S | S | * | * | trans | -109.1 | 139.8 | -164.6 | -144.8 | -6.1 | 0 | 0 | 0 | 109.7 | ||||
| 268 | A | 28.6 | Very low | 32.8 | Very low | 98 Ų | 98 | 145.9 Ų | 145.9 | 81% | 0.81 | 79% | 0.794 | S | S | * | * | trans | 170 | 140.6 | 144.1 | 0 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 269 | D | 29.2 | Very low | 32.7 | Very low | 153 Ų | 153 | 144 Ų | 144 | 82% | 0.818 | 79% | 0.794 | S | S | * | * | trans | -78.6 | -171.7 | 177 | -138 | 4.5 | 0 | 0 | 0 | 112.1 | ||||
| 270 | P | 47.2 | Very low | 32.9 | Very low | 96 Ų | 96 | 141 Ų | 141 | 62% | 0.623 | 80% | 0.796 | S | S | * | * | cis | -132.2 | 162.4 | -21.6 | 36.7 | -20.6 | 0 | 0 | 0 | 115.2 | ||||
| 271 | T | 30.8 | Very low | 33.2 | Very low | 149 Ų | 149 | 141.2 Ų | 141.2 | 91% | 0.914 | 79% | 0.791 | S | S | * | * | trans | -173.3 | 128.7 | 141.5 | 10.5 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 272 | R | 31.8 | Very low | 33.5 | Very low | 190 Ų | 190 | 139.7 Ų | 139.7 | 72% | 0.717 | 79% | 0.789 | S | S | * | * | trans | -101.6 | 160.2 | 165.1 | -136.7 | -168 | 152.8 | 176.5 | -8.9 | 107.9 | D274 | R272-D274 IonicContact CZ-OD1 2.68Å; R272-D274 IonicContact NH2-OD1 2.6Å; R272-D274 PolarHBondContact NH2-OD1 2.72Å | ||
| 273 | P | 41.1 | Very low | 33.7 | Very low | 123 Ų | 123 | 135.2 Ų | 135.2 | 80% | 0.799 | 78% | 0.784 | S | S | * | * | -124.1 | 142.6 | 55.5 | 7.2 | 17.9 | 0 | 0 | 0 | 112.7 | |||||
| 274 | D | 28.6 | Very low | 34.4 | Very low | 94 Ų | 94 | 138.4 Ų | 138.4 | 50% | 0.503 | 79% | 0.793 | S | S | . | * | 82.1 | 115.6 | 76.2 | -162.7 | 43.1 | 0 | 0 | 0 | 116.3 | R272 A276 | R272-D274 IonicContact CZ-OD1 2.68Å; R272-D274 IonicContact NH2-OD1 2.6Å; R272-D274 PolarHBondContact NH2-OD1 2.72Å; D274-A276 PolarHBondContact OD1-N 3.12Å | |||
| 275 | V | 36.8 | Very low | 35.1 | Very low | 144 Ų | 144 | 133.5 Ų | 133.5 | 87% | 0.873 | 79% | 0.794 | S | S | * | * | trans | -156.3 | 66.6 | 145.8 | -88.2 | 0 | 0 | 0 | 0 | 108.5 | F277 | V275-F277 VanDerWaalsContact C-N 3.35Å; V275-F277 PolarHBondContact O-N 3.25Å | ||
| 276 | A | 36.3 | Very low | 35.3 | Very low | 87 Ų | 87 | 131.9 Ų | 131.9 | 72% | 0.719 | 79% | 0.794 | S | S | * | * | trans | -80.2 | 85 | 162.6 | 0 | 0 | 0 | 0 | 0 | 109.2 | D274 | D274-A276 PolarHBondContact OD1-N 3.12Š| ||
| 277 | F | 39.3 | Very low | 35.7 | Very low | 187 Ų | 187 | 135.8 Ų | 135.8 | 82% | 0.82 | 80% | 0.802 | S | S | * | * | trans | -129.5 | 139.1 | 174.6 | -151.1 | -103.2 | 0 | 0 | 0 | 111.1 | V275 | V275-F277 VanDerWaalsContact C-N 3.35Å; V275-F277 PolarHBondContact O-N 3.25Å | ||
| 278 | M | 37.2 | Very low | 35.9 | Very low | 158 Ų | 158 | 131.2 Ų | 131.2 | 78% | 0.778 | 79% | 0.793 | S | S | * | * | S | Bend | trans | 69.9 | 75.9 | -173.6 | -45.5 | -157.4 | -54.9 | 0 | 0 | 116.2 | ||
| 279 | N | 38.2 | Very low | 36.8 | Very low | 162 Ų | 162 | 135.8 Ų | 135.8 | 87% | 0.866 | 80% | 0.798 | S | S | * | * | S | Bend | -174.5 | 70.8 | 125.1 | -94.8 | -35.3 | 0 | 0 | 0 | 112.3 | |||
| 280 | S | 37.9 | Very low | 37 | Very low | 122 Ų | 122 | 137.1 Ų | 137.1 | 85% | 0.853 | 80% | 0.799 | S | S | * | * | trans | -171.7 | 106 | 156.5 | -86.8 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 281 | L | 36.4 | Very low | 36.7 | Very low | 154 Ų | 154 | 137.7 Ų | 137.7 | 81% | 0.806 | 80% | 0.801 | S | S | * | * | trans | -157.1 | 128.3 | 146.8 | -153.3 | 71.9 | 0 | 0 | 0 | 110.1 | ||||
| 282 | M | 39.5 | Very low | 37.7 | Very low | 164 Ų | 164 | 136.8 Ų | 136.8 | 81% | 0.808 | 80% | 0.798 | S | S | * | * | trans | 57.9 | 101.8 | 178 | -45.1 | -45.3 | -173.9 | 0 | 0 | 115.7 | ||||
| 283 | G | 34.1 | Very low | 38.2 | Very low | 66 Ų | 66 | 135 Ų | 135 | 68% | 0.68 | 80% | 0.801 | S | S | * | * | cis | 81 | 106.5 | 7.2 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 284 | L | 39.6 | Very low | 37.9 | Very low | 178 Ų | 178 | 134.9 Ų | 134.9 | 93% | 0.932 | 80% | 0.801 | S | S | * | * | trans | -174.8 | 134.3 | 140.9 | -101.6 | 168.6 | 0 | 0 | 0 | 110 | ||||
| 285 | S | 38.1 | Very low | 39.3 | Very low | 126 Ų | 126 | 138 Ų | 138 | 88% | 0.881 | 81% | 0.814 | S | S | * | * | trans | -73.8 | 145.5 | 171.7 | -56.9 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 286 | G | 34.4 | Very low | 39.6 | Very low | 77 Ų | 77 | 136.4 Ų | 136.4 | 79% | 0.794 | 81% | 0.808 | S | S | * | * | trans | -153.3 | 125.7 | 174 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 287 | V | 36.9 | Very low | 39.8 | Very low | 161 Ų | 161 | 141.9 Ų | 141.9 | 98% | 0.976 | 82% | 0.815 | S | S | * | * | trans | -78.1 | 132.9 | 174.7 | -179.6 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 288 | G | 32.3 | Very low | 40 | Very low | 66 Ų | 66 | 143.4 Ų | 143.4 | 68% | 0.68 | 82% | 0.817 | S | S | * | * | trans | 155.6 | 132.6 | 167.7 | 0 | 0 | 0 | 0 | 0 | 115.7 | Q290 | G288-Q290 PolarHBondContact O-N 3.43Š| ||
| 289 | Q | 46.4 | Very low | 40.3 | Very low | 194 Ų | 194 | 146 Ų | 146 | 91% | 0.907 | 82% | 0.824 | S | S | * | * | trans | -28.6 | 122.5 | 164.7 | -62.3 | -69.7 | -25.6 | 0 | 0 | 114.3 | ||||
| 290 | Q | 34.7 | Very low | 40.5 | Very low | 181 Ų | 181 | 146.4 Ų | 146.4 | 85% | 0.846 | 83% | 0.825 | S | S | * | * | trans | -107.4 | 105.9 | 172.8 | -165.8 | 173.8 | 21.5 | 0 | 0 | 111 | G288 | G288-Q290 PolarHBondContact O-N 3.43Š| ||
| 291 | T | 40.8 | Very low | 40.4 | Very low | 109 Ų | 109 | 147.6 Ų | 147.6 | 67% | 0.669 | 82% | 0.822 | S | S | * | * | trans | -74.4 | 147.5 | 169.8 | 46.7 | 0 | 0 | 0 | 0 | 111.1 | I293 | T291-I293 PolarHBondContact O-N 3.49Š| ||
| 292 | P | 50.6 | Low | 40.8 | Very low | 130 Ų | 130 | 146 Ų | 146 | 84% | 0.844 | 82% | 0.821 | S | S | * | * | trans | -74.6 | 115.3 | 177.6 | 29.5 | -32.9 | 0 | 0 | 0 | 110.9 | C294 | P292-C294 PolarHBondContact O-N 3.09Š| ||
| 293 | I | 43.3 | Very low | 40.7 | Very low | 153 Ų | 153 | 143.6 Ų | 143.6 | 79% | 0.785 | 82% | 0.82 | S | S | * | * | trans | -78.4 | 110.9 | 176.4 | 10.9 | 175 | 0 | 0 | 0 | 110.3 | T291 | T291-I293 PolarHBondContact O-N 3.49Š| ||
| 294 | C | 35.5 | Very low | 40.8 | Very low | 119 Ų | 119 | 145.1 Ų | 145.1 | 80% | 0.804 | 83% | 0.826 | S | S | * | * | trans | -76.3 | 128.7 | 172 | -178.2 | 0 | 0 | 0 | 0 | 110.5 | P292 | P292-C294 PolarHBondContact O-N 3.09Š| ||
| 295 | M | 57.1 | Low | 40.6 | Very low | 159 Ų | 159 | 141.5 Ų | 141.5 | 78% | 0.783 | 82% | 0.822 | S | S | * | * | trans | -115 | 122 | 171.3 | -75.2 | -68.6 | -75.5 | 0 | 0 | 109.8 | ||||
| 296 | P | 43.5 | Very low | 40.5 | Very low | 112 Ų | 112 | 140 Ų | 140 | 73% | 0.727 | 82% | 0.818 | S | S | * | * | trans | -81.1 | 128.4 | -176.9 | 30.9 | -33.4 | 0 | 0 | 0 | 112.2 | Y298 | P296-Y298 PolarHBondContact O-N 2.89Š| ||
| 297 | F | 40.3 | Very low | 40.8 | Very low | 201 Ų | 201 | 142 Ų | 142 | 88% | 0.882 | 82% | 0.816 | S | S | * | * | trans | -80.2 | 106.6 | 172.3 | -76.2 | -90.5 | 0 | 0 | 0 | 111.8 | ||||
| 298 | Y | 43.8 | Very low | 40.8 | Very low | 219 Ų | 219 | 144.4 Ų | 144.4 | 86% | 0.859 | 81% | 0.809 | S | S | * | * | trans | -154.2 | 104.9 | 154.3 | -80.5 | -67.6 | 0 | 0 | 0 | 111.4 | P296 | P296-Y298 PolarHBondContact O-N 2.89Š| ||
| 299 | F | 43.7 | Very low | 41.8 | Very low | 212 Ų | 212 | 148.8 Ų | 148.8 | 93% | 0.93 | 81% | 0.814 | S | S | * | * | trans | -177.9 | 66.2 | 145 | -107.4 | -65.5 | 0 | 0 | 0 | 112.4 | ||||
| 300 | I | 42.7 | Very low | 41.6 | Very low | 172 Ų | 172 | 143.5 Ų | 143.5 | 88% | 0.882 | 80% | 0.797 | S | S | * | * | trans | -135.1 | 123.5 | 157.6 | -57.1 | -177.9 | 0 | 0 | 0 | 108.2 | ||||
| 301 | N | 34.4 | Very low | 42 | Very low | 146 Ų | 146 | 144.9 Ų | 144.9 | 78% | 0.781 | 80% | 0.8 | S | S | * | * | trans | -103.9 | 124.4 | -172.1 | -171.1 | -20.2 | 0 | 0 | 0 | 109.8 | S303 | N301-S303 PolarHBondContact O-N 3.12Š| ||
| 302 | P | 44.7 | Very low | 42.3 | Very low | 121 Ų | 121 | 148.7 Ų | 148.7 | 79% | 0.786 | 81% | 0.808 | S | S | * | * | trans | -99.6 | 84.7 | -171.9 | 36.9 | -32.7 | 0 | 0 | 0 | 113.2 | ||||
| 303 | S | 38.1 | Very low | 41.8 | Very low | 114 Ų | 114 | 148.8 Ų | 148.8 | 80% | 0.797 | 80% | 0.801 | S | S | * | * | trans | -164.7 | 104.3 | 155.5 | -165.2 | 0 | 0 | 0 | 0 | 113.7 | N301 | N301-S303 PolarHBondContact O-N 3.12Š| ||
| 304 | A | 36.8 | Very low | 42 | Very low | 98 Ų | 98 | 151 Ų | 151 | 81% | 0.81 | 81% | 0.805 | S | S | * | * | trans | -179.2 | 126.9 | 137.5 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 305 | A | 35.2 | Very low | 42.6 | Very low | 101 Ų | 101 | 149.6 Ų | 149.6 | 84% | 0.835 | 80% | 0.796 | S | S | * | * | trans | 73.6 | 126.8 | 148.1 | 0 | 0 | 0 | 0 | 0 | 123 | ||||
| 306 | A | 34.5 | Very low | 41.9 | Very low | 96 Ų | 96 | 149.3 Ų | 149.3 | 79% | 0.793 | 80% | 0.798 | S | S | * | * | trans | 75.3 | 108.8 | 149.4 | 0 | 0 | 0 | 0 | 0 | 120.6 | ||||
| 307 | P | 41.2 | Very low | 41.9 | Very low | 118 Ų | 118 | 151.1 Ų | 151.1 | 77% | 0.766 | 80% | 0.8 | S | S | * | * | trans | -86.2 | 121.4 | 162.3 | 33.3 | -29.1 | 0 | 0 | 0 | 111.4 | ||||
| 308 | Y | 37.3 | Very low | 42.1 | Very low | 212 Ų | 212 | 151.3 Ų | 151.3 | 83% | 0.831 | 80% | 0.804 | S | S | * | * | trans | -85.2 | 116 | 162.9 | 177.1 | -97.1 | 0 | 0 | 0 | 109 | ||||
| 309 | M | 53 | Low | 42.3 | Very low | 158 Ų | 158 | 149.5 Ų | 149.5 | 78% | 0.778 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -98.4 | 122.2 | 177 | -78.6 | -69.7 | -174.9 | 0 | 0 | 110.8 | ||
| 310 | P | 41.6 | Very low | 42.5 | Very low | 83 Ų | 83 | 149.1 Ų | 149.1 | 54% | 0.539 | 79% | 0.794 | S | S | . | * | P | Polyproline II helix | trans | -66.8 | 138 | 166.3 | -18.7 | 32.9 | 0 | 0 | 0 | 111.3 | F312 | P310-F312 PolarHBondContact O-N 3.01Š|
| 311 | F | 44.8 | Very low | 42.4 | Very low | 209 Ų | 209 | 149.7 Ų | 149.7 | 92% | 0.917 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -69.9 | 122.7 | -180 | -147.6 | -97.9 | 0 | 0 | 0 | 110.4 | ||
| 312 | F | 45.3 | Very low | 42.3 | Very low | 190 Ų | 190 | 152.4 Ų | 152.4 | 83% | 0.833 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -101.1 | 131.7 | 169.7 | -86.7 | -82.3 | 0 | 0 | 0 | 110.7 | P310 | P310-F312 PolarHBondContact O-N 3.01Š|
| 313 | D | 40.6 | Very low | 42.4 | Very low | 131 Ų | 131 | 152.3 Ų | 152.3 | 70% | 0.701 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -69.1 | 148.5 | -179.9 | -177 | 35 | 0 | 0 | 0 | 112.3 | S315 | D313-S315 PolarHBondContact OD2-OG 2.75Š|
| 314 | K | 47.9 | Very low | 42 | Very low | 201 Ų | 201 | 151.3 Ų | 151.3 | 87% | 0.874 | 79% | 0.794 | S | S | * | * | S | Bend | trans | -114.2 | 56 | -155.6 | -160.7 | 178.2 | -178 | -179.8 | 0 | 112 | ||
| 315 | S | 48.3 | Very low | 41.7 | Very low | 88 Ų | 88 | 151.2 Ų | 151.2 | 62% | 0.615 | 79% | 0.793 | S | S | * | * | S | Bend | trans | -139.1 | 1.5 | -170.7 | 62 | 0 | 0 | 0 | 0 | 116.9 | D313 | D313-S315 PolarHBondContact OD2-OG 2.75Š|
| 316 | N | 42.2 | Very low | 41.6 | Very low | 153 Ų | 153 | 151.4 Ų | 151.4 | 82% | 0.818 | 79% | 0.794 | S | S | * | * | S | Bend | trans | -149.5 | 47.3 | -175.5 | -144.8 | -97.5 | 0 | 0 | 0 | 117.3 | ||
| 317 | I | 43.6 | Very low | 41.4 | Very low | 151 Ų | 151 | 150.8 Ų | 150.8 | 77% | 0.774 | 79% | 0.79 | S | S | * | * | trans | -126.3 | -16.4 | 179.4 | -48.5 | 179.7 | 0 | 0 | 0 | 113.6 | K319 | I317-K319 PolarHBondContact O-N 3.23Š| ||
| 318 | E | 45 | Very low | 41.1 | Very low | 205 Ų | 205 | 153.4 Ų | 153.4 | 96% | 0.958 | 80% | 0.796 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74 | 14.9 | -172.4 | -61.4 | -170.1 | 148.7 | 0 | 0 | 116.5 | ||
| 319 | K | 48.2 | Very low | 40.9 | Very low | 181 Ų | 181 | 148.4 Ų | 148.4 | 79% | 0.787 | 80% | 0.799 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -108.1 | -13.5 | -175.8 | -111.6 | -177.3 | -178.7 | -179.1 | 0 | 117.4 | I317 | I317-K319 PolarHBondContact O-N 3.23Š|
| 320 | Y | 48.1 | Very low | 39.9 | Very low | 204 Ų | 204 | 146.3 Ų | 146.3 | 80% | 0.8 | 80% | 0.799 | S | S | * | * | S | Bend | trans | -144.8 | 100.9 | 177.7 | -67.7 | -78.3 | 0 | 0 | 0 | 111.8 | ||
| 321 | M | 39.2 | Very low | 40.1 | Very low | 183 Ų | 183 | 148 Ų | 148 | 90% | 0.901 | 81% | 0.81 | S | S | * | * | trans | 148.8 | 114.9 | 142.5 | -80.5 | -59.4 | 167 | 0 | 0 | 110.3 | ||||
| 322 | Y | 33.5 | Very low | 39.5 | Very low | 204 Ų | 204 | 146.5 Ų | 146.5 | 80% | 0.8 | 80% | 0.804 | S | S | * | * | trans | -137.8 | 110.4 | 169.4 | -168.4 | -89.8 | 0 | 0 | 0 | 109.6 | A324 | Y322-A324 HydrophobicContact CE1-CB 4.3Š| ||
| 323 | P | 45.5 | Very low | 39.3 | Very low | 118 Ų | 118 | 143.4 Ų | 143.4 | 77% | 0.766 | 80% | 0.803 | S | S | * | * | trans | -88.8 | 126.5 | 162.3 | -2.9 | 22.6 | 0 | 0 | 0 | 109.1 | ||||
| 324 | A | 30.3 | Very low | 39.3 | Very low | 94 Ų | 94 | 148.2 Ų | 148.2 | 78% | 0.777 | 81% | 0.811 | S | S | * | * | trans | -69.9 | 137.9 | -179.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | Y322 | Y322-A324 HydrophobicContact CE1-CB 4.3Š| ||
| 325 | A | 31.4 | Very low | 38.6 | Very low | 95 Ų | 95 | 147 Ų | 147 | 79% | 0.785 | 81% | 0.813 | S | S | * | * | trans | -107.7 | 128.6 | 176.9 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 326 | A | 32.2 | Very low | 37.7 | Very low | 105 Ų | 105 | 152.9 Ų | 152.9 | 87% | 0.868 | 82% | 0.823 | S | S | * | * | trans | 172.9 | 139.8 | 155.7 | 0 | 0 | 0 | 0 | 0 | 107.4 | ||||
| 327 | A | 30.2 | Very low | 37.8 | Very low | 84 Ų | 84 | 150.9 Ų | 150.9 | 69% | 0.694 | 82% | 0.819 | S | S | * | * | cis | -151.3 | 145.5 | 9.6 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 328 | L | 34.8 | Very low | 37.1 | Very low | 173 Ų | 173 | 147.2 Ų | 147.2 | 91% | 0.906 | 81% | 0.811 | S | S | * | * | trans | 43.5 | 108.4 | 135.3 | -54.3 | 173.4 | 0 | 0 | 0 | 120.7 | ||||
| 329 | A | 32.7 | Very low | 36.6 | Very low | 107 Ų | 107 | 145.5 Ų | 145.5 | 88% | 0.884 | 80% | 0.803 | S | S | * | * | -179.2 | 129 | 113.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | |||||
| 330 | S | 32.9 | Very low | 35.8 | Very low | 113 Ų | 113 | 141.8 Ų | 141.8 | 79% | 0.79 | 81% | 0.806 | S | S | * | * | trans | -94 | 170.6 | 166.7 | 55.2 | 0 | 0 | 0 | 0 | 110 | ||||
| 331 | P | 45.5 | Very low | 35 | Very low | 118 Ų | 118 | 137.3 Ų | 137.3 | 77% | 0.766 | 80% | 0.804 | S | S | * | * | cis | -137.5 | 179.2 | 16.6 | 41.3 | -21.9 | 0 | 0 | 0 | 117.4 | ||||
| 332 | F | 32.6 | Very low | 34.8 | Very low | 179 Ų | 179 | 132.7 Ų | 132.7 | 79% | 0.785 | 80% | 0.796 | S | S | * | * | trans | -59.1 | 159.7 | 166.3 | -82 | -93.7 | 0 | 0 | 0 | 112.8 | ||||
| 333 | P | 41.5 | Very low | 34.8 | Very low | 124 Ų | 124 | 127.4 Ų | 127.4 | 81% | 0.805 | 79% | 0.794 | S | S | * | * | -136.5 | 157.8 | 99.5 | 34.4 | -21.6 | 0 | 0 | 0 | 115.4 | |||||
| 334 | W | 39.3 | Very low | 34.3 | Very low | 233 Ų | 233 | 126.7 Ų | 126.7 | 88% | 0.883 | 80% | 0.798 | S | S | * | * | trans | -63.7 | 154.9 | 171.6 | -71.4 | 15.4 | 0 | 0 | 0 | 113.3 | ||||
| 335 | L | 32.8 | Very low | 34.6 | Very low | 175 Ų | 175 | 126.8 Ų | 126.8 | 92% | 0.916 | 80% | 0.799 | S | S | * | * | trans | -166.7 | 125.9 | 140.5 | -102 | 154.8 | 0 | 0 | 0 | 111.4 | ||||
| 336 | Y | 29.7 | Very low | 34.8 | Very low | 211 Ų | 211 | 126.7 Ų | 126.7 | 83% | 0.827 | 80% | 0.798 | S | S | * | * | trans | -101.2 | 164.5 | 157.8 | -131.1 | -117.3 | 0 | 0 | 0 | 106.2 | ||||
| 337 | P | 44.8 | Very low | 34.9 | Very low | 111 Ų | 111 | 126.2 Ų | 126.2 | 72% | 0.721 | 79% | 0.794 | S | S | * | * | cis | -153.2 | 169.6 | 38.3 | 42.5 | -21.3 | 0 | 0 | 0 | 120.4 | ||||
| 338 | A | 28.8 | Very low | 35.2 | Very low | 75 Ų | 75 | 127.3 Ų | 127.3 | 62% | 0.62 | 80% | 0.803 | S | S | * | * | trans | 64.9 | 149.5 | 153.1 | 0 | 0 | 0 | 0 | 0 | 118 | ||||
| 339 | H | 35.2 | Very low | 35.1 | Very low | 169 Ų | 169 | 124 Ų | 124 | 78% | 0.782 | 80% | 0.801 | S | S | * | * | cis | -169.4 | 146.9 | 23.8 | 39.9 | -74.6 | 0 | 0 | 0 | 111.6 | ||||
| 340 | A | 30 | Very low | 35.1 | Very low | 103 Ų | 103 | 123.3 Ų | 123.3 | 85% | 0.851 | 80% | 0.795 | S | S | * | * | trans | 59.8 | 159.7 | 162 | 0 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 341 | S | 31.7 | Very low | 34.9 | Very low | 109 Ų | 109 | 122 Ų | 122 | 76% | 0.762 | 79% | 0.791 | S | S | * | * | cis | -157.4 | 165.6 | -2.3 | 98.7 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 342 | A | 35.1 | Very low | 34.3 | Very low | 87 Ų | 87 | 126.1 Ų | 126.1 | 72% | 0.719 | 80% | 0.797 | S | S | * | * | trans | 62.1 | 112.8 | 163 | 0 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 343 | A | 33.4 | Very low | 34.9 | Very low | 93 Ų | 93 | 123.3 Ų | 123.3 | 77% | 0.769 | 80% | 0.797 | S | S | * | * | 67.1 | 108.9 | 82.1 | 0 | 0 | 0 | 0 | 0 | 113 | |||||
| 344 | A | 35.2 | Very low | 34.3 | Very low | 103 Ų | 103 | 121 Ų | 121 | 85% | 0.851 | 80% | 0.795 | S | S | * | * | 66.8 | 130.8 | 73.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | |||||
| 345 | A | 36.8 | Very low | 34 | Very low | 95 Ų | 95 | 118 Ų | 118 | 79% | 0.785 | 80% | 0.796 | S | S | * | * | cis | -159.2 | -175.8 | 3.6 | 0 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 346 | A | 35.7 | Very low | 33.8 | Very low | 93 Ų | 93 | 115.2 Ų | 115.2 | 77% | 0.769 | 79% | 0.791 | S | S | * | * | trans | -31.9 | 141.9 | 160.5 | 0 | 0 | 0 | 0 | 0 | 115 | ||||
| 347 | A | 34.7 | Very low | 33.8 | Very low | 96 Ų | 96 | 109.6 Ų | 109.6 | 79% | 0.793 | 79% | 0.788 | S | S | * | * | cis | 99.2 | 140.1 | 41 | 0 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 348 | A | 35.7 | Very low | 33.3 | Very low | 106 Ų | 106 | 112.3 Ų | 112.3 | 88% | 0.876 | 79% | 0.79 | S | S | * | * | trans | 75.8 | 114.8 | 161 | 0 | 0 | 0 | 0 | 0 | 120.9 | ||||
| 349 | A | 33 | Very low | 33.3 | Very low | 104 Ų | 104 | 116.7 Ų | 116.7 | 86% | 0.86 | 80% | 0.803 | S | S | * | * | 175.8 | 161.6 | 126.9 | 0 | 0 | 0 | 0 | 0 | 109 | |||||
| 350 | A | 32.2 | Very low | 33 | Very low | 93 Ų | 93 | 111.7 Ų | 111.7 | 77% | 0.769 | 80% | 0.797 | S | S | * | * | cis | 167.4 | 137.9 | -37.5 | 0 | 0 | 0 | 0 | 0 | 107.1 | ||||
| 351 | A | 29.8 | Very low | 32.8 | Very low | 84 Ų | 84 | 112.2 Ų | 112.2 | 69% | 0.694 | 80% | 0.802 | S | S | * | * | trans | 69.2 | 113.6 | 159.6 | 0 | 0 | 0 | 0 | 0 | 121.9 | ||||
| 352 | F | 32 | Very low | 32.7 | Very low | 205 Ų | 205 | 111.7 Ų | 111.7 | 90% | 0.899 | 80% | 0.804 | S | S | * | * | 44.7 | 163.4 | 116.5 | -63.9 | -63.3 | 0 | 0 | 0 | 122.6 | |||||
| 353 | P | 45.7 | Very low | 32.6 | Very low | 121 Ų | 121 | 111.7 Ų | 111.7 | 79% | 0.786 | 80% | 0.803 | S | S | * | * | cis | -139.5 | 166.5 | -26.8 | 35 | -16.3 | 0 | 0 | 0 | 116.2 | ||||
| 354 | G | 27.8 | Very low | 32.4 | Very low | 74 Ų | 74 | 116 Ų | 116 | 76% | 0.763 | 81% | 0.808 | S | S | * | * | trans | 103.4 | 144 | 130.8 | 0 | 0 | 0 | 0 | 0 | 122.7 | ||||
| 355 | L | 33.8 | Very low | 32.6 | Very low | 171 Ų | 171 | 115.8 Ų | 115.8 | 90% | 0.895 | 80% | 0.798 | S | S | * | * | trans | 83.2 | 103.3 | 149.2 | -60.1 | 176.9 | 0 | 0 | 0 | 123.3 | ||||
| 356 | S | 29.1 | Very low | 32.3 | Very low | 117 Ų | 117 | 119.6 Ų | 119.6 | 82% | 0.818 | 80% | 0.796 | S | S | * | * | 86.1 | 156.6 | 111.4 | -146.6 | 0 | 0 | 0 | 0 | 123.8 | |||||
| 357 | A | 30.4 | Very low | 31.9 | Very low | 92 Ų | 92 | 120.5 Ų | 120.5 | 76% | 0.76 | 79% | 0.788 | S | S | * | * | trans | 81.7 | 87.5 | 155.7 | 0 | 0 | 0 | 0 | 0 | 121.6 | ||||
| 358 | H | 33.6 | Very low | 31.7 | Very low | 168 Ų | 168 | 120.5 Ų | 120.5 | 78% | 0.778 | 78% | 0.783 | S | S | * | * | trans | -33.6 | 137.1 | 145.6 | 169.8 | -75.6 | 0 | 0 | 0 | 118.3 | ||||
| 359 | L | 29.5 | Very low | 31.3 | Very low | 167 Ų | 167 | 124.2 Ų | 124.2 | 87% | 0.874 | 78% | 0.782 | S | S | * | * | trans | 173.6 | 143.7 | 143 | -95 | 150.3 | 0 | 0 | 0 | 107.1 | ||||
| 360 | G | 28.5 | Very low | 31.1 | Very low | 65 Ų | 65 | 126.4 Ų | 126.4 | 67% | 0.67 | 78% | 0.778 | S | S | * | * | cis | 154 | 126.6 | 1.5 | 0 | 0 | 0 | 0 | 0 | 107.6 | ||||
| 361 | A | 25.8 | Very low | 31.1 | Very low | 114 Ų | 114 | 129.3 Ų | 129.3 | 94% | 0.942 | 78% | 0.776 | S | S | * | * | trans | -142.5 | 132.5 | -178 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 362 | A | 28.7 | Very low | 31 | Very low | 98 Ų | 98 | 131.5 Ų | 131.5 | 81% | 0.81 | 78% | 0.776 | S | S | * | * | trans | -121.6 | 148.9 | -176.3 | 0 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 363 | A | 32.9 | Very low | 31 | Very low | 86 Ų | 86 | 128.8 Ų | 128.8 | 71% | 0.711 | 77% | 0.771 | S | S | * | * | trans | 64.6 | 122.9 | 152.8 | 0 | 0 | 0 | 0 | 0 | 120.9 | ||||
| 364 | Q | 29.6 | Very low | 30.3 | Very low | 185 Ų | 185 | 127.7 Ų | 127.7 | 86% | 0.864 | 77% | 0.766 | S | S | * | * | trans | -141.2 | 159.1 | 134 | -82.5 | -52.3 | -81.1 | 0 | 0 | 110.3 | ||||
| 365 | P | 39.6 | Very low | 30.5 | Very low | 98 Ų | 98 | 127.4 Ų | 127.4 | 64% | 0.636 | 76% | 0.763 | S | S | * | * | trans | -133.3 | -169.5 | -149.1 | 42.2 | -24.6 | 0 | 0 | 0 | 116.1 | ||||
| 366 | K | 29.4 | Very low | 30.6 | Very low | 174 Ų | 174 | 124.4 Ų | 124.4 | 76% | 0.757 | 76% | 0.756 | S | S | * | * | trans | 74.9 | 154.5 | 162.1 | -76.4 | 177 | 153.9 | -112.1 | 0 | 117.2 | ||||
| 367 | D | 27.2 | Very low | 30.9 | Very low | 112 Ų | 112 | 129.6 Ų | 129.6 | 60% | 0.599 | 76% | 0.758 | S | S | * | * | cis | -159.9 | 161 | -4.9 | -112.9 | -28.5 | 0 | 0 | 0 | 106.3 | ||||
| 368 | S | 31.6 | Very low | 30.8 | Very low | 96 Ų | 96 | 134.2 Ų | 134.2 | 67% | 0.671 | 76% | 0.764 | S | S | * | * | cis | -176.4 | 147.9 | -16 | -122.5 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 369 | Q | 27.1 | Very low | 30.9 | Very low | 184 Ų | 184 | 130.5 Ų | 130.5 | 86% | 0.86 | 76% | 0.762 | S | S | * | * | trans | -170.4 | 117.1 | 153.6 | -109.3 | 177.9 | -100.5 | 0 | 0 | 115.4 | ||||
| 370 | L | 28.8 | Very low | 30.9 | Very low | 151 Ų | 151 | 131.1 Ų | 131.1 | 79% | 0.791 | 76% | 0.761 | S | S | * | * | trans | 31.2 | 131.1 | 133.6 | -64 | 167.4 | 0 | 0 | 0 | 119.1 | ||||
| 371 | Q | 31.6 | Very low | 31.1 | Very low | 154 Ų | 154 | 132.1 Ų | 132.1 | 72% | 0.72 | 76% | 0.763 | S | S | * | * | -172.4 | 157.3 | 53.2 | -132.5 | 176.6 | -50.9 | 0 | 0 | 113.7 | |||||
| 372 | D | 27.7 | Very low | 31.3 | Very low | 129 Ų | 129 | 132.7 Ų | 132.7 | 69% | 0.69 | 76% | 0.76 | S | S | * | * | trans | 51.2 | 116.7 | 151.8 | -58.9 | -25 | 0 | 0 | 0 | 120.8 | ||||
| 373 | D | 32.5 | Very low | 31.6 | Very low | 149 Ų | 149 | 133 Ų | 133 | 80% | 0.797 | 76% | 0.756 | S | S | * | * | 91.5 | 129.4 | 81.3 | -167.1 | -96.9 | 0 | 0 | 0 | 110.9 | |||||
| 374 | S | 31.2 | Very low | 32.2 | Very low | 97 Ų | 97 | 133.8 Ų | 133.8 | 68% | 0.678 | 75% | 0.754 | S | S | * | * | cis | -147.3 | 155.1 | 21.4 | 5.1 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 375 | G | 32.3 | Very low | 32.3 | Very low | 69 Ų | 69 | 132.9 Ų | 132.9 | 71% | 0.711 | 75% | 0.75 | S | S | * | * | 76.7 | 131.7 | 90.4 | 0 | 0 | 0 | 0 | 0 | 113.9 | |||||
| 376 | S | 34.9 | Very low | 31.9 | Very low | 107 Ų | 107 | 136.4 Ų | 136.4 | 75% | 0.748 | 76% | 0.757 | S | S | * | * | cis | -165.8 | 151 | 4.8 | -62.5 | 0 | 0 | 0 | 0 | 112 | ||||
| 377 | R | 35.2 | Very low | 32 | Very low | 226 Ų | 226 | 137.1 Ų | 137.1 | 85% | 0.853 | 76% | 0.763 | S | S | * | * | trans | 66.1 | 123.2 | 150.1 | -68.9 | 166.5 | 177 | 171.4 | -1.8 | 117.9 | ||||
| 378 | E | 29.8 | Very low | 32.3 | Very low | 190 Ų | 190 | 139.9 Ų | 139.9 | 89% | 0.888 | 77% | 0.773 | S | S | * | * | cis | 61.4 | 127.8 | 48.7 | -53.3 | -156.5 | 138.9 | 0 | 0 | 113.3 | ||||
| 379 | A | 34.6 | Very low | 32.3 | Very low | 89 Ų | 89 | 142.5 Ų | 142.5 | 74% | 0.736 | 77% | 0.774 | S | S | * | * | cis | -154.7 | -164.4 | -5.9 | 0 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 380 | E | 30.3 | Very low | 32.7 | Very low | 180 Ų | 180 | 139.2 Ų | 139.2 | 84% | 0.841 | 77% | 0.767 | S | S | * | * | cis | -156 | 146.1 | 11.1 | -141.9 | -161.9 | 119 | 0 | 0 | 112.9 | ||||
| 381 | A | 32 | Very low | 33.7 | Very low | 86 Ų | 86 | 138.3 Ų | 138.3 | 71% | 0.711 | 77% | 0.77 | S | S | * | * | trans | 48.6 | 114.5 | 138.8 | 0 | 0 | 0 | 0 | 0 | 124.2 | ||||
| 382 | S | 30.8 | Very low | 33.7 | Very low | 126 Ų | 126 | 135.2 Ų | 135.2 | 88% | 0.881 | 77% | 0.771 | S | S | * | * | -164.1 | 150.9 | 116.2 | -171.2 | 0 | 0 | 0 | 0 | 111.6 | |||||
| 383 | S | 34.3 | Very low | 34.2 | Very low | 104 Ų | 104 | 134.5 Ų | 134.5 | 73% | 0.727 | 78% | 0.776 | S | S | * | * | trans | -97 | -176.6 | 179.9 | -126.3 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 384 | P | 46.7 | Very low | 34.4 | Very low | 103 Ų | 103 | 134.8 Ų | 134.8 | 67% | 0.669 | 78% | 0.777 | S | S | * | * | -131.9 | -160.1 | -51.7 | 30.5 | -8.5 | 0 | 0 | 0 | 112 | |||||
| 385 | E | 30.9 | Very low | 34.7 | Very low | 167 Ų | 167 | 138.1 Ų | 138.1 | 78% | 0.78 | 79% | 0.787 | S | S | * | * | trans | 102.1 | 128.9 | 148.1 | -81.3 | -176.1 | 165.6 | 0 | 0 | 122.6 | ||||
| 386 | E | 31 | Very low | 35.1 | Very low | 171 Ų | 171 | 138.5 Ų | 138.5 | 80% | 0.799 | 79% | 0.791 | S | S | * | * | trans | 57.6 | 116.3 | 141.9 | -50.2 | -91.6 | 97 | 0 | 0 | 120.8 | ||||
| 387 | H | 32.6 | Very low | 35.3 | Very low | 190 Ų | 190 | 143.2 Ų | 143.2 | 88% | 0.88 | 80% | 0.802 | S | S | * | * | -161.9 | 129 | 128.3 | -133.4 | -70.4 | 0 | 0 | 0 | 113.2 | |||||
| 388 | E | 32 | Very low | 35.3 | Very low | 170 Ų | 170 | 136.4 Ų | 136.4 | 79% | 0.794 | 80% | 0.802 | S | S | * | * | trans | -117.3 | 177.1 | 159.3 | -144.1 | -162.7 | 139.2 | 0 | 0 | 110 | ||||
| 389 | E | 32.2 | Very low | 35.6 | Very low | 151 Ų | 151 | 134.4 Ų | 134.4 | 71% | 0.706 | 80% | 0.797 | S | S | * | * | trans | 80.3 | 113.6 | 156.8 | -115.6 | -170.4 | 113.4 | 0 | 0 | 122.9 | ||||
| 390 | T | 35.1 | Very low | 35.9 | Very low | 115 Ų | 115 | 136 Ų | 136 | 71% | 0.706 | 80% | 0.797 | S | S | * | * | trans | 68.5 | 132.9 | 141.6 | 45.9 | 0 | 0 | 0 | 0 | 123.4 | ||||
| 391 | P | 49.6 | Very low | 36.2 | Very low | 131 Ų | 131 | 134.4 Ų | 134.4 | 85% | 0.851 | 80% | 0.795 | S | S | * | * | trans | -95 | 164.5 | 163.5 | 38.7 | -32.9 | 0 | 0 | 0 | 112.8 | ||||
| 392 | A | 31.9 | Very low | 36.4 | Very low | 89 Ų | 89 | 136.8 Ų | 136.8 | 74% | 0.736 | 80% | 0.795 | S | S | * | * | trans | -124.1 | 152.5 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 393 | S | 37.4 | Very low | 36.6 | Very low | 114 Ų | 114 | 136.8 Ų | 136.8 | 80% | 0.797 | 79% | 0.79 | S | S | * | * | trans | 42.1 | 133.7 | 148.8 | -47.3 | 0 | 0 | 0 | 0 | 121.5 | ||||
| 394 | D | 38.5 | Very low | 36.6 | Very low | 155 Ų | 155 | 137 Ų | 137 | 83% | 0.829 | 79% | 0.792 | S | S | * | * | -174.2 | 143.5 | 99.9 | -155.9 | -139.1 | 0 | 0 | 0 | 111.4 | |||||
| 395 | D | 37.8 | Very low | 37 | Very low | 167 Ų | 167 | 137.2 Ų | 137.2 | 89% | 0.893 | 79% | 0.793 | S | S | * | * | trans | -114.8 | 129.9 | 173.3 | -84.7 | -67.8 | 0 | 0 | 0 | 109.1 | ||||
| 396 | G | 39.7 | Very low | 37 | Very low | 77 Ų | 77 | 135.8 Ų | 135.8 | 79% | 0.794 | 79% | 0.791 | S | S | * | * | trans | -144.9 | 129.9 | -177 | 0 | 0 | 0 | 0 | 0 | 114 | ||||
| 397 | E | 38.8 | Very low | 37.2 | Very low | 207 Ų | 207 | 133.4 Ų | 133.4 | 97% | 0.967 | 79% | 0.793 | S | S | * | * | trans | -81.6 | 156.3 | -175.3 | -55.8 | 176.5 | 109.2 | 0 | 0 | 113.6 | ||||
| 398 | G | 36.3 | Very low | 37.3 | Very low | 83 Ų | 83 | 133.4 Ų | 133.4 | 86% | 0.856 | 79% | 0.791 | S | S | * | * | trans | -179.3 | 133.9 | 170.8 | 0 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 399 | D | 34.5 | Very low | 37.3 | Very low | 148 Ų | 148 | 133.1 Ų | 133.1 | 79% | 0.791 | 80% | 0.795 | S | S | * | * | trans | -126.3 | 152.6 | -163.7 | -171.2 | -148.7 | 0 | 0 | 0 | 112.7 | ||||
| 400 | V | 41.4 | Very low | 37.4 | Very low | 121 Ų | 121 | 131.2 Ų | 131.2 | 73% | 0.733 | 80% | 0.798 | S | S | * | * | trans | 47.5 | 145.7 | 174 | -99.2 | 0 | 0 | 0 | 0 | 119.6 | ||||
| 401 | D | 36.4 | Very low | 38.1 | Very low | 148 Ų | 148 | 130.8 Ų | 130.8 | 79% | 0.791 | 80% | 0.797 | S | S | * | * | -164 | -166 | 57.6 | -160.9 | -104.6 | 0 | 0 | 0 | 113 | |||||
| 402 | D | 35.6 | Very low | 37.3 | Very low | 135 Ų | 135 | 132 Ų | 132 | 72% | 0.722 | 79% | 0.791 | S | S | * | * | trans | -104 | -174.1 | -155.2 | -163.4 | -88.6 | 0 | 0 | 0 | 114.7 | ||||
| 403 | T | 36.1 | Very low | 37.4 | Very low | 126 Ų | 126 | 135 Ų | 135 | 77% | 0.773 | 79% | 0.79 | S | S | * | * | trans | 94.3 | 120.3 | 156.5 | 4.2 | 0 | 0 | 0 | 0 | 121.8 | ||||
| 404 | S | 34.1 | Very low | 37.4 | Very low | 109 Ų | 109 | 137.5 Ų | 137.5 | 76% | 0.762 | 79% | 0.789 | S | S | * | * | trans | -81.1 | -173.5 | 167.2 | -97.7 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 405 | P | 56 | Low | 37.2 | Very low | 108 Ų | 108 | 137.9 Ų | 137.9 | 70% | 0.701 | 79% | 0.79 | S | S | * | * | cis | -138.3 | -159.2 | -29.5 | 35.4 | -14 | 0 | 0 | 0 | 113.3 | ||||
| 406 | D | 30.4 | Very low | 37.1 | Very low | 137 Ų | 137 | 135.3 Ų | 135.3 | 73% | 0.733 | 79% | 0.786 | S | S | * | * | trans | 84.2 | 109.5 | 148.8 | -110.8 | -60.5 | 0 | 0 | 0 | 120.6 | ||||
| 407 | S | 35.1 | Very low | 37.2 | Very low | 121 Ų | 121 | 136 Ų | 136 | 85% | 0.846 | 78% | 0.784 | S | S | * | * | -173.3 | 133.1 | 118.6 | -83.9 | 0 | 0 | 0 | 0 | 114.9 | |||||
| 408 | K | 34.1 | Very low | 37.4 | Very low | 189 Ų | 189 | 132.6 Ų | 132.6 | 82% | 0.822 | 78% | 0.781 | S | S | * | * | trans | -39.6 | 146.5 | 171.3 | -62.4 | 156.6 | 174.5 | 167.1 | 0 | 116.6 | ||||
| 409 | N | 32.4 | Very low | 38.1 | Very low | 165 Ų | 165 | 137 Ų | 137 | 88% | 0.882 | 78% | 0.78 | S | S | * | * | -161.4 | 131.4 | 118.4 | -128.4 | -20.4 | 0 | 0 | 0 | 115.7 | |||||
| 410 | S | 34 | Very low | 38.7 | Very low | 111 Ų | 111 | 136.2 Ų | 136.2 | 78% | 0.776 | 78% | 0.78 | S | S | * | * | trans | -174.8 | 141.5 | 163.5 | -153.1 | 0 | 0 | 0 | 0 | 106.7 | ||||
| 411 | P | 50.2 | Low | 39.2 | Very low | 105 Ų | 105 | 139.3 Ų | 139.3 | 68% | 0.682 | 81% | 0.807 | S | S | * | * | -156.6 | -179 | 83.1 | 40.9 | -20.9 | 0 | 0 | 0 | 117.5 | |||||
| 412 | Q | 32.6 | Very low | 39.4 | Very low | 157 Ų | 157 | 138.9 Ų | 138.9 | 73% | 0.734 | 81% | 0.808 | S | S | * | * | trans | 72.8 | 146.1 | 155.9 | -99.1 | 176.3 | -92.7 | 0 | 0 | 118.3 | ||||
| 413 | E | 33.3 | Very low | 39.6 | Very low | 152 Ų | 152 | 139.1 Ų | 139.1 | 71% | 0.71 | 81% | 0.813 | S | S | * | * | cis | -136.5 | 144.3 | 9.8 | -60.4 | -163.3 | 117.8 | 0 | 0 | 110 | ||||
| 414 | Q | 37.6 | Very low | 39.8 | Very low | 167 Ų | 167 | 139.8 Ų | 139.8 | 78% | 0.78 | 82% | 0.815 | S | S | * | * | 88.6 | 154.9 | 62.6 | -133 | -174.5 | 34.1 | 0 | 0 | 115.6 | |||||
| 415 | L | 34.8 | Very low | 40.1 | Very low | 162 Ų | 162 | 141.6 Ų | 141.6 | 85% | 0.848 | 82% | 0.818 | S | S | * | * | trans | 88.4 | 141.5 | -178.3 | -53.3 | 176.5 | 0 | 0 | 0 | 117.3 | ||||
| 416 | S | 35.8 | Very low | 39.1 | Very low | 114 Ų | 114 | 143.8 Ų | 143.8 | 80% | 0.797 | 83% | 0.825 | S | S | * | * | cis | -161.8 | 162.4 | -24.1 | -166.1 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 417 | A | 42.3 | Very low | 39.7 | Very low | 91 Ų | 91 | 144.2 Ų | 144.2 | 75% | 0.752 | 83% | 0.832 | S | S | * | * | trans | -88.5 | 153.7 | -178 | 0 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 418 | C | 42.4 | Very low | 40 | Very low | 135 Ų | 135 | 145.9 Ų | 145.9 | 91% | 0.912 | 83% | 0.831 | S | S | * | * | trans | -82.5 | 144.9 | 169.6 | -67.7 | 0 | 0 | 0 | 0 | 112 | ||||
| 419 | Q | 51.5 | Low | 40.5 | Very low | 177 Ų | 177 | 142.5 Ų | 142.5 | 83% | 0.827 | 83% | 0.831 | S | S | * | * | trans | -112.8 | -178.4 | 174.5 | -80.6 | -173.9 | 23.9 | 0 | 0 | 111 | ||||
| 420 | T | 46.7 | Very low | 41.2 | Very low | 131 Ų | 131 | 140.7 Ų | 140.7 | 80% | 0.804 | 83% | 0.827 | S | S | * | * | trans | 91.6 | 137.5 | 164.5 | 82.1 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 421 | S | 52.6 | Low | 41.8 | Very low | 186 Ų | 186 | 143.4 Ų | 143.4 | 100% | 1.301 | 83% | 0.832 | S | S | * | * | cis | -149.2 | 0 | -3 | -150.2 | 0 | 0 | 0 | 0 | 113.6 |
Retrieved 421 of 421 residues in 126.5 ms
(Link to these results)