| 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 | 58.5 | Low | 55.9 | Low | 243 Ų | 243 | 154.6 Ų | 154.6 | 100% | 1.197 | 81% | 0.81 | S | S | * | * | 0 | 104 | 0 | -75.2 | 171.3 | -175.6 | 0 | 0 | 107.7 | |||||
| 2 | I | 50.1 | Low | 55.7 | Low | 173 Ų | 173 | 157.5 Ų | 157.5 | 89% | 0.887 | 80% | 0.804 | S | S | * | * | trans | -85.8 | 120.6 | 173.5 | 41.2 | 169.6 | 0 | 0 | 0 | 107.7 | S4 | I2-S4 PolarHBondContact O-N 3.18Å; I2-S4 VanDerWaalsContact O-N 3.12Å | ||
| 3 | M | 54.3 | Low | 56.3 | Low | 187 Ų | 187 | 156.8 Ų | 156.8 | 92% | 0.921 | 80% | 0.801 | S | S | * | * | trans | -77.2 | 96 | 176.3 | -68.3 | 179.1 | 67.3 | 0 | 0 | 108.1 | S5 | M3-S5 PolarHBondContact O-N 3.12Š| ||
| 4 | S | 47.8 | Very low | 56.8 | Low | 105 Ų | 105 | 154 Ų | 154 | 73% | 0.734 | 79% | 0.789 | S | S | * | * | trans | -62.4 | 115.1 | 172.1 | -169.6 | 0 | 0 | 0 | 0 | 109.4 | I2 Y6 | I2-S4 PolarHBondContact O-N 3.18Å; I2-S4 VanDerWaalsContact O-N 3.12Å; S4-Y6 PolarHBondContact O-N 3.39Å | ||
| 5 | S | 50.9 | Low | 56.9 | Low | 108 Ų | 108 | 148.2 Ų | 148.2 | 76% | 0.755 | 77% | 0.765 | S | S | * | * | trans | -75.8 | 102.7 | 172.3 | 53 | 0 | 0 | 0 | 0 | 109.4 | M3 L7 | M3-S5 PolarHBondContact O-N 3.12Å; S5-L7 VanDerWaalsContact C-N 3.27Å; S5-L7 PolarHBondContact O-N 3.34Å | ||
| 6 | Y | 55.3 | Low | 57.9 | Low | 196 Ų | 196 | 150.3 Ų | 150.3 | 77% | 0.769 | 77% | 0.767 | S | S | * | * | trans | -68 | 93.3 | 157.6 | -103.9 | -92.5 | 0 | 0 | 0 | 107.4 | S4 M8 | S4-Y6 PolarHBondContact O-N 3.39Å; Y6-M8 VanDerWaalsContact C-N 3.26Å; Y6-M8 HydrophobicContact CD1-CE 4.22Å; Y6-M8 PolarHBondContact O-N 3.28Å; Y6-M8 VanDerWaalsContact O-N 3.13Å | ||
| 7 | L | 66.9 | Low | 58.3 | Low | 138 Ų | 138 | 151.1 Ų | 151.1 | 72% | 0.723 | 76% | 0.764 | S | S | * | * | trans | -75.1 | 94.5 | 159.3 | -154 | 146 | 0 | 0 | 0 | 104 | S5 E9 | S5-L7 VanDerWaalsContact C-N 3.27Å; S5-L7 PolarHBondContact O-N 3.34Å; L7-E9 PolarHBondContact O-N 3.24Å | ||
| 8 | M | 62 | Low | 58.8 | Low | 128 Ų | 128 | 146.4 Ų | 146.4 | 63% | 0.631 | 75% | 0.745 | S | S | * | * | trans | -47.8 | 117.7 | 169.6 | -70.9 | -102 | 93 | 0 | 0 | 106.9 | Y6 S10 | Y6-M8 VanDerWaalsContact C-N 3.26Å; Y6-M8 HydrophobicContact CD1-CE 4.22Å; Y6-M8 PolarHBondContact O-N 3.28Å; Y6-M8 VanDerWaalsContact O-N 3.13Å; M8-S10 PolarHBondContact O-N 3Å; M8-S10 PolarHBondContact O-OG 3.26Å | ||
| 9 | E | 58.4 | Low | 58.9 | Low | 172 Ų | 172 | 143.2 Ų | 143.2 | 80% | 0.804 | 74% | 0.736 | S | S | * | * | trans | -55.2 | 77.6 | 163 | -84.4 | 73.8 | -150.7 | 0 | 0 | 109.3 | L7 | L7-E9 PolarHBondContact O-N 3.24Š| ||
| 10 | S | 53.8 | Low | 58.6 | Low | 91 Ų | 91 | 141.5 Ų | 141.5 | 64% | 0.636 | 74% | 0.735 | S | S | * | * | trans | -77.4 | 119 | 161.7 | -56.7 | 0 | 0 | 0 | 0 | 104.1 | M8 Y12 | M8-S10 PolarHBondContact O-N 3Å; M8-S10 PolarHBondContact O-OG 3.26Å; S10-Y12 PolarHBondContact O-N 3.13Å | ||
| 11 | N | 57.3 | Low | 58.6 | Low | 160 Ų | 160 | 142 Ų | 142 | 86% | 0.856 | 73% | 0.734 | S | S | * | * | trans | -59.2 | 82.6 | 164.3 | -76.2 | -71.1 | 0 | 0 | 0 | 107.6 | I13 | N11-I13 VanDerWaalsContact C-N 3.26Å; N11-I13 PolarHBondContact O-N 3.46Å | ||
| 12 | Y | 53.1 | Low | 58.4 | Low | 189 Ų | 189 | 136.5 Ų | 136.5 | 74% | 0.741 | 71% | 0.706 | S | S | * | * | trans | -72.3 | 90.9 | 175.1 | -167.8 | -90.3 | 0 | 0 | 0 | 105.5 | S10 D14 | S10-Y12 PolarHBondContact O-N 3.13Å; Y12-D14 VanDerWaalsContact C-N 3.29Å; Y12-D14 PolarHBondContact O-N 2.95Å | ||
| 13 | I | 63.6 | Low | 58.6 | Low | 148 Ų | 148 | 136.6 Ų | 136.6 | 76% | 0.759 | 70% | 0.696 | S | S | * | * | trans | -63.2 | 102.6 | 164.2 | -121.3 | 72.3 | 0 | 0 | 0 | 104.5 | N11 P15 | N11-I13 VanDerWaalsContact C-N 3.26Å; N11-I13 PolarHBondContact O-N 3.46Å; I13-P15 WeakPolarHBondContact O-CD 3.31Å | ||
| 14 | D | 63 | Low | 58.6 | Low | 118 Ų | 118 | 131.8 Ų | 131.8 | 63% | 0.631 | 68% | 0.681 | S | S | * | * | trans | -56.6 | 119.3 | 168 | -175 | 27.2 | 0 | 0 | 0 | 106 | Y12 K16 | Y12-D14 VanDerWaalsContact C-N 3.29Å; Y12-D14 PolarHBondContact O-N 2.95Å; D14-K16 PolarHBondContact O-N 3.32Å | ||
| 15 | P | 58.9 | Low | 58.9 | Low | 67 Ų | 67 | 133.7 Ų | 133.7 | 44% | 0.435 | 68% | 0.678 | S | S | . | * | trans | -57.8 | 106.2 | 176.8 | 22.9 | -31.7 | 0 | 0 | 0 | 107.1 | I13 F17 | I13-P15 WeakPolarHBondContact O-CD 3.31Å; P15-F17 HydrophobicContact CB-CE2 4.27Å; P15-F17 HydrophobicContact CG-CE2 3.92Å; P15-F17 WeakPolarHBondContact O-CD2 3.33Å; P15-F17 PolarHBondContact O-N 3.27Å | ||
| 16 | K | 72.1 | Confident | 58.8 | Low | 182 Ų | 182 | 133.9 Ų | 133.9 | 79% | 0.791 | 67% | 0.671 | S | S | * | * | trans | -66.1 | 86.8 | 177.3 | -171.5 | 79 | 174.6 | 178.9 | 0 | 106.8 | D14 P18 | D14-K16 PolarHBondContact O-N 3.32Å; K16-P18 WeakPolarHBondContact O-CD 3.45Å | ||
| 17 | F | 64.4 | Low | 58.5 | Low | 164 Ų | 164 | 131.8 Ų | 131.8 | 72% | 0.719 | 67% | 0.673 | S | S | * | * | P | Polyproline II helix | trans | -56.7 | 125.4 | 168.8 | -75.3 | -82.8 | 0 | 0 | 0 | 106.9 | P15 | P15-F17 HydrophobicContact CB-CE2 4.27Å; P15-F17 HydrophobicContact CG-CE2 3.92Å; P15-F17 WeakPolarHBondContact O-CD2 3.33Å; P15-F17 PolarHBondContact O-N 3.27Å |
| 18 | P | 68.3 | Low | 57.8 | Low | 66 Ų | 66 | 135.3 Ų | 135.3 | 43% | 0.429 | 68% | 0.678 | S | S | . | * | P | Polyproline II helix | trans | -51 | 137 | 177.6 | -25.5 | 32.8 | 0 | 0 | 0 | 109.5 | K16 C20 | K16-P18 WeakPolarHBondContact O-CD 3.45Å; P18-C20 PolarHBondContact O-N 3.03Å |
| 19 | P | 60.7 | Low | 57.4 | Low | 86 Ų | 86 | 136.1 Ų | 136.1 | 56% | 0.558 | 68% | 0.683 | S | S | * | * | P | Polyproline II helix | trans | -49.5 | 131.2 | 172.6 | -22.2 | 31.5 | 0 | 0 | 0 | 109.2 | E21 E22 | P19-E21 PolarHBondContact O-N 3.27Å; P19-E22 PolarHBondContact O-N 3.47Å; P19-E22 VanDerWaalsContact O-N 3.11Å |
| 20 | C | 53.3 | Low | 56.8 | Low | 108 Ų | 108 | 132 Ų | 132 | 73% | 0.73 | 67% | 0.671 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -52.1 | -21.5 | -176 | -170.2 | 0 | 0 | 0 | 0 | 113.4 | P18 E22 Y23 | P18-C20 PolarHBondContact O-N 3.03Å; C20-E22 VanDerWaalsContact C-N 3.26Å; C20-E22 PolarHBondContact O-N 2.99Å; C20-Y23 WeakPolarHBondContact O-CB 3.5Å; C20-Y23 PolarHBondContact O-N 3.18Å; C20-Y23 VanDerWaalsContact O-N 3.11Å |
| 21 | E | 57.8 | Low | 56.5 | Low | 153 Ų | 153 | 134.9 Ų | 134.9 | 72% | 0.715 | 68% | 0.675 | S | S | * | * | H | α-helix | trans | -58.4 | -31.6 | 178 | -71.4 | 178.4 | 153.2 | 0 | 0 | 113.5 | P19 Y23 S24 Q25 | P19-E21 PolarHBondContact O-N 3.27Å; E21-Y23 VanDerWaalsContact C-N 3.28Å; E21-Y23 PolarHBondContact O-N 3.41Å; E21-S24 PolarHBondContact O-N 3.07Å; E21-S24 PolarHBondContact O-OG 3.03Å; E21-Q25 PolarHBondContact O-OE1 3.32Å |
| 22 | E | 54 | Low | 56.1 | Low | 128 Ų | 128 | 134.4 Ų | 134.4 | 60% | 0.598 | 67% | 0.667 | S | S | * | * | H | α-helix | trans | -74.4 | -18.6 | 178.3 | -109.7 | -176.6 | 171.2 | 0 | 0 | 113.7 | P19 C20 Q25 | P19-E22 PolarHBondContact O-N 3.47Å; P19-E22 VanDerWaalsContact O-N 3.11Å; C20-E22 VanDerWaalsContact C-N 3.26Å; C20-E22 PolarHBondContact O-N 2.99Å; E22-Q25 PolarHBondContact O-N 3.07Å |
| 23 | Y | 54.2 | Low | 55.7 | Low | 174 Ų | 174 | 127.9 Ų | 127.9 | 68% | 0.682 | 65% | 0.65 | S | S | * | * | H | α-helix | trans | -76.3 | -23 | 175.6 | -82.7 | -82.9 | 0 | 0 | 0 | 112.9 | C20 E21 | C20-Y23 WeakPolarHBondContact O-CB 3.5Å; C20-Y23 PolarHBondContact O-N 3.18Å; C20-Y23 VanDerWaalsContact O-N 3.11Å; E21-Y23 VanDerWaalsContact C-N 3.28Å; E21-Y23 PolarHBondContact O-N 3.41Å |
| 24 | S | 55.7 | Low | 55.1 | Low | 87 Ų | 87 | 125 Ų | 125 | 61% | 0.608 | 64% | 0.64 | S | S | * | * | H | α-helix | trans | -85.1 | -19.9 | 171.9 | 51 | 0 | 0 | 0 | 0 | 113.5 | E21 | E21-S24 PolarHBondContact O-N 3.07Å; E21-S24 PolarHBondContact O-OG 3.03Å |
| 25 | Q | 53.3 | Low | 54.4 | Low | 145 Ų | 145 | 125.1 Ų | 125.1 | 68% | 0.678 | 64% | 0.637 | S | S | * | * | H | α-helix | trans | -81.6 | -23.6 | -174.3 | -124.4 | 77.3 | 6.6 | 0 | 0 | 113.6 | E21 E22 | E21-Q25 PolarHBondContact O-OE1 3.32Å; E22-Q25 PolarHBondContact O-N 3.07Å |
| 26 | N | 48.6 | Very low | 54 | Low | 111 Ų | 111 | 130.5 Ų | 130.5 | 59% | 0.594 | 65% | 0.65 | S | S | * | * | S | Bend | trans | -99.8 | 113 | 172.6 | -70.9 | -69.4 | 0 | 0 | 0 | 108.3 | Y28 | N26-Y28 PolarHBondContact O-N 3.18Š|
| 27 | N | 50.1 | Low | 52.8 | Low | 152 Ų | 152 | 132.3 Ų | 132.3 | 81% | 0.813 | 65% | 0.653 | S | S | * | * | trans | -56.5 | 36.9 | 172.6 | -92.2 | 47.6 | 0 | 0 | 0 | 114.5 | I29 | N27-I29 VanDerWaalsContact C-N 3.25Å; N27-I29 PolarHBondContact O-N 3.44Å | ||
| 28 | Y | 50.7 | Low | 52.3 | Low | 213 Ų | 213 | 128.5 Ų | 128.5 | 84% | 0.835 | 65% | 0.647 | S | S | * | * | trans | -80.7 | -6.7 | -177.7 | -151.6 | -92.5 | 0 | 0 | 0 | 112.9 | N26 P30 | N26-Y28 PolarHBondContact O-N 3.18Å; Y28-P30 WeakPolarHBondContact O-CD 3.39Å | ||
| 29 | I | 53.8 | Low | 51 | Low | 144 Ų | 144 | 136.1 Ų | 136.1 | 74% | 0.738 | 67% | 0.667 | S | S | * | * | S | Bend | trans | -96.7 | 108.1 | 159.8 | -62.6 | 173.6 | 0 | 0 | 0 | 105.1 | N27 E31 | N27-I29 VanDerWaalsContact C-N 3.25Å; N27-I29 PolarHBondContact O-N 3.44Å; I29-E31 PolarHBondContact O-N 2.81Å |
| 30 | P | 45.9 | Very low | 50.3 | Low | 85 Ų | 85 | 135.6 Ų | 135.6 | 55% | 0.552 | 67% | 0.67 | S | S | * | * | trans | -50.2 | 117.2 | 163.6 | -24 | 34 | 0 | 0 | 0 | 107.1 | Y28 H32 | Y28-P30 WeakPolarHBondContact O-CD 3.39Å; P30-H32 PolarHBondContact O-N 3.08Å | ||
| 31 | E | 48.5 | Very low | 50.3 | Low | 153 Ų | 153 | 142.1 Ų | 142.1 | 72% | 0.715 | 68% | 0.68 | S | S | * | * | trans | -60 | 92.9 | 171.8 | -140.8 | -91.5 | 177.3 | 0 | 0 | 105.1 | I29 S33 | I29-E31 PolarHBondContact O-N 2.81Å; E31-S33 PolarHBondContact O-N 3.24Å | ||
| 32 | H | 48.4 | Very low | 49.4 | Very low | 149 Ų | 149 | 141.7 Ų | 141.7 | 69% | 0.69 | 68% | 0.682 | S | S | * | * | trans | -70.5 | 96.9 | 169.9 | -71 | -51 | 0 | 0 | 0 | 104.4 | P30 | P30-H32 PolarHBondContact O-N 3.08Š| ||
| 33 | S | 44 | Very low | 49.3 | Very low | 53 Ų | 53 | 142.5 Ų | 142.5 | 37% | 0.371 | 70% | 0.696 | S | S | . | * | trans | -46.8 | 143.4 | -179 | 79.2 | 0 | 0 | 0 | 0 | 110.1 | E31 E35 Y36 | E31-S33 PolarHBondContact O-N 3.24Å; S33-E35 WeakPolarHBondContact CB-OE2 3.35Å; S33-E35 PolarHBondContact O-N 3.41Å; S33-E35 PolarHBondContact OG-OE2 3.06Å; S33-Y36 PolarHBondContact O-N 2.86Å | ||
| 34 | P | 51.8 | Low | 48.9 | Very low | 86 Ų | 86 | 137.4 Ų | 137.4 | 56% | 0.558 | 70% | 0.696 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -56.4 | -12.2 | -173.8 | -23.4 | 32.9 | 0 | 0 | 0 | 114.7 | Y36 S38 | P34-Y36 VanDerWaalsContact C-N 3.29Å; P34-Y36 PolarHBondContact O-N 2.64Å; P34-S38 WeakPolarHBondContact O-CB 3.49Å; P34-S38 PolarHBondContact O-N 2.96Å; P34-S38 PolarHBondContact O-OG 3.36Å |
| 35 | E | 49.1 | Very low | 48 | Very low | 122 Ų | 122 | 143.5 Ų | 143.5 | 57% | 0.57 | 71% | 0.707 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -69.1 | -20.5 | 176.5 | -59.6 | 73.9 | -152.7 | 0 | 0 | 113.3 | S33 Y37 S38 R39 | S33-E35 WeakPolarHBondContact CB-OE2 3.35Å; S33-E35 PolarHBondContact O-N 3.41Å; S33-E35 PolarHBondContact OG-OE2 3.06Å; E35-Y37 PolarHBondContact O-N 2.67Å; E35-S38 PolarHBondContact O-N 3.17Å; E35-R39 PolarHBondContact O-N 3.36Å |
| 36 | Y | 48.5 | Very low | 47.8 | Very low | 180 Ų | 180 | 145.8 Ų | 145.8 | 71% | 0.706 | 72% | 0.718 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -65.6 | -38.4 | -179.5 | -167.7 | -94.3 | 0 | 0 | 0 | 112.7 | S33 P34 | S33-Y36 PolarHBondContact O-N 2.86Å; P34-Y36 VanDerWaalsContact C-N 3.29Å; P34-Y36 PolarHBondContact O-N 2.64Å |
| 37 | Y | 48.6 | Very low | 47.6 | Very low | 219 Ų | 219 | 147.8 Ų | 147.8 | 86% | 0.859 | 72% | 0.724 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -88.7 | -13.2 | 174.2 | -78.9 | -81.3 | 0 | 0 | 0 | 113.2 | E35 | E35-Y37 PolarHBondContact O-N 2.67Š|
| 38 | S | 52.7 | Low | 47.6 | Very low | 84 Ų | 84 | 147.5 Ų | 147.5 | 59% | 0.587 | 72% | 0.717 | S | S | * | * | trans | -101.8 | 12 | -173.8 | -52.6 | 0 | 0 | 0 | 0 | 114 | P34 E35 A40 | P34-S38 WeakPolarHBondContact O-CB 3.49Å; P34-S38 PolarHBondContact O-N 2.96Å; P34-S38 PolarHBondContact O-OG 3.36Å; E35-S38 PolarHBondContact O-N 3.17Å; S38-A40 PolarHBondContact O-N 3.16Å | ||
| 39 | R | 42.5 | Very low | 47.3 | Very low | 226 Ų | 226 | 146 Ų | 146 | 85% | 0.853 | 72% | 0.718 | S | S | * | * | trans | -68.2 | 83.6 | 171.4 | -141.2 | -168.9 | -149.5 | -177.1 | 9.3 | 109.8 | E35 | E35-R39 PolarHBondContact O-N 3.36Š| ||
| 40 | A | 44.3 | Very low | 46.7 | Very low | 75 Ų | 75 | 146.2 Ų | 146.2 | 62% | 0.62 | 72% | 0.715 | S | S | * | * | trans | -51.9 | 153.6 | 160.7 | 0 | 0 | 0 | 0 | 0 | 109.3 | S38 D42 | S38-A40 PolarHBondContact O-N 3.16Å; A40-D42 PolarHBondContact O-N 3.07Å | ||
| 41 | R | 54.2 | Low | 46.9 | Very low | 246 Ų | 246 | 150.1 Ų | 150.1 | 93% | 0.928 | 73% | 0.726 | S | S | * | * | trans | -58.7 | 97.1 | -178.8 | -66.3 | -177.5 | 169.5 | -175.5 | -3.2 | 111 | ||||
| 42 | D | 38.3 | Very low | 46.8 | Very low | 144 Ų | 144 | 150.4 Ų | 150.4 | 77% | 0.77 | 73% | 0.732 | S | S | * | * | trans | -89.4 | 106.3 | 164.2 | -86.2 | -56.7 | 0 | 0 | 0 | 110.6 | A40 G44 | A40-D42 PolarHBondContact O-N 3.07Å; D42-G44 PolarHBondContact O-N 2.85Å | ||
| 43 | T | 52.6 | Low | 46.6 | Very low | 145 Ų | 145 | 153.9 Ų | 153.9 | 89% | 0.89 | 74% | 0.741 | S | S | * | * | trans | -42.9 | 106.5 | 153.3 | -2.3 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 44 | G | 46 | Very low | 47.1 | Very low | 67 Ų | 67 | 156.8 Ų | 156.8 | 69% | 0.691 | 76% | 0.758 | S | S | * | * | trans | 166.1 | 9.3 | 173 | 0 | 0 | 0 | 0 | 0 | 120.4 | D42 | D42-G44 PolarHBondContact O-N 2.85Š| ||
| 45 | Y | 36.8 | Very low | 47.6 | Very low | 214 Ų | 214 | 158 Ų | 158 | 84% | 0.839 | 77% | 0.766 | S | S | * | * | trans | -122.9 | 101 | 174.2 | -105.8 | -96.2 | 0 | 0 | 0 | 111.8 | H47 | Y45-H47 AromaticContact CD1-CD2 3.97Å; Y45-H47 PolarHBondContact O-N 3.37Å | ||
| 46 | Q | 49.4 | Very low | 47.6 | Very low | 193 Ų | 193 | 158.3 Ų | 158.3 | 90% | 0.902 | 78% | 0.779 | S | S | * | * | trans | -66.2 | 108.2 | 159.8 | -79 | -139.6 | -62.1 | 0 | 0 | 108.8 | ||||
| 47 | H | 43 | Very low | 47.3 | Very low | 153 Ų | 153 | 160.5 Ų | 160.5 | 71% | 0.708 | 79% | 0.786 | S | S | * | * | trans | -110.8 | 100.8 | 156.2 | -102.5 | -80.5 | 0 | 0 | 0 | 109 | Y45 H49 | Y45-H47 AromaticContact CD1-CD2 3.97Å; Y45-H47 PolarHBondContact O-N 3.37Å; H47-H49 PolarHBondContact O-N 3.3Å | ||
| 48 | H | 50.8 | Low | 47.4 | Very low | 147 Ų | 147 | 155.3 Ų | 155.3 | 68% | 0.681 | 79% | 0.788 | S | S | * | * | trans | -64.3 | 96.8 | 166.9 | -174.9 | 75.8 | 0 | 0 | 0 | 109.2 | ||||
| 49 | H | 44.8 | Very low | 47.1 | Very low | 182 Ų | 182 | 154.6 Ų | 154.6 | 84% | 0.843 | 78% | 0.783 | S | S | * | * | trans | -140.1 | 124.2 | 152 | -83 | -73 | 0 | 0 | 0 | 109.9 | H47 | H47-H49 PolarHBondContact O-N 3.3Š| ||
| 50 | Q | 40.3 | Very low | 46.9 | Very low | 147 Ų | 147 | 154.9 Ų | 154.9 | 69% | 0.687 | 79% | 0.786 | S | S | * | * | trans | -95.1 | 135.8 | -158.2 | -164.2 | 164.2 | 31.3 | 0 | 0 | 108.9 | ||||
| 51 | E | 50.3 | Low | 46.9 | Very low | 167 Ų | 167 | 160.5 Ų | 160.5 | 78% | 0.78 | 80% | 0.799 | S | S | * | * | trans | 61.4 | 89.5 | 140.3 | -56.9 | -69.7 | 121.9 | 0 | 0 | 119.3 | ||||
| 52 | L | 46.8 | Very low | 46.2 | Very low | 160 Ų | 160 | 156.6 Ų | 156.6 | 84% | 0.838 | 79% | 0.791 | S | S | * | * | trans | -144.4 | 11.8 | 158.3 | -104 | 166.5 | 0 | 0 | 0 | 115.8 | ||||
| 53 | Y | 45 | Very low | 46.3 | Very low | 222 Ų | 222 | 158.8 Ų | 158.8 | 87% | 0.871 | 79% | 0.789 | S | S | * | * | trans | -135.5 | 120.2 | 173.4 | -77.5 | -80.9 | 0 | 0 | 0 | 111.8 | ||||
| 54 | P | 53.5 | Low | 45.8 | Very low | 114 Ų | 114 | 159.6 Ų | 159.6 | 74% | 0.74 | 78% | 0.782 | S | S | * | * | P | Polyproline II helix | trans | -65.2 | 140 | 170.6 | -11.9 | 25.7 | 0 | 0 | 0 | 110 | ||
| 55 | P | 62.9 | Low | 45.3 | Very low | 112 Ų | 112 | 165.5 Ų | 165.5 | 73% | 0.727 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -67.8 | 154 | 175.4 | 27.2 | -32.4 | 0 | 0 | 0 | 111.3 | R57 | P55-R57 PolarHBondContact O-N 2.87Š|
| 56 | P | 48 | Very low | 45.9 | Very low | 128 Ų | 128 | 161.9 Ų | 161.9 | 83% | 0.831 | 78% | 0.78 | S | S | * | * | P | Polyproline II helix | trans | -64.9 | 122.5 | 176 | 1.9 | 8.8 | 0 | 0 | 0 | 109.3 | A58 | P56-A58 PolarHBondContact O-N 3.48Å; P56-A58 VanDerWaalsContact O-N 3.12Å |
| 57 | R | 43.4 | Very low | 45.3 | Very low | 226 Ų | 226 | 159.1 Ų | 159.1 | 85% | 0.853 | 78% | 0.781 | S | S | * | * | trans | -65.5 | 113.4 | 176.1 | -155.8 | -173.9 | -173.5 | 169.4 | 3.3 | 109.3 | P55 S59 | P55-R57 PolarHBondContact O-N 2.87Å; R57-S59 PolarHBondContact O-N 3.33Å | ||
| 58 | A | 49.9 | Very low | 45.5 | Very low | 109 Ų | 109 | 154.7 Ų | 154.7 | 90% | 0.901 | 77% | 0.77 | S | S | * | * | trans | -69.5 | 80.9 | 165.9 | 0 | 0 | 0 | 0 | 0 | 109.5 | P56 | P56-A58 PolarHBondContact O-N 3.48Å; P56-A58 VanDerWaalsContact O-N 3.12Å | ||
| 59 | S | 47.3 | Very low | 44.8 | Very low | 70 Ų | 70 | 153.4 Ų | 153.4 | 49% | 0.49 | 78% | 0.778 | S | S | . | * | trans | -164.5 | 75.3 | 165.1 | 62.6 | 0 | 0 | 0 | 0 | 109.5 | R57 | R57-S59 PolarHBondContact O-N 3.33Š| ||
| 60 | Y | 37.8 | Very low | 44.7 | Very low | 232 Ų | 232 | 152.6 Ų | 152.6 | 91% | 0.91 | 78% | 0.778 | S | S | * | * | trans | -124.8 | 112.3 | 153.3 | -110.6 | -91.4 | 0 | 0 | 0 | 107.5 | E62 | Y60-E62 PolarHBondContact O-N 2.91Š| ||
| 61 | Q | 43.5 | Very low | 44.8 | Very low | 192 Ų | 192 | 151.3 Ų | 151.3 | 90% | 0.897 | 78% | 0.783 | S | S | * | * | trans | -60.6 | 120.9 | 170.2 | -73.9 | 170.2 | -27.1 | 0 | 0 | 108.1 | R63 | Q61-R63 PolarHBondContact O-N 3.05Š| ||
| 62 | E | 39.5 | Very low | 44.3 | Very low | 165 Ų | 165 | 150.5 Ų | 150.5 | 77% | 0.771 | 78% | 0.779 | S | S | * | * | trans | -59.2 | 99.7 | 169.7 | -171.5 | -173.6 | 154.8 | 0 | 0 | 108.9 | Y60 Q64 | Y60-E62 PolarHBondContact O-N 2.91Å; E62-Q64 PolarHBondContact O-N 3.1Å | ||
| 63 | R | 41.5 | Very low | 44.5 | Very low | 190 Ų | 190 | 147.3 Ų | 147.3 | 72% | 0.717 | 77% | 0.768 | S | S | * | * | trans | -81.7 | 98 | 167.2 | -168.4 | -174.1 | -103.7 | -111.1 | 9.2 | 107.1 | Q61 Y65 | Q61-R63 PolarHBondContact O-N 3.05Å; R63-Y65 HydrophobicContact CB-CE2 4.09Å; R63-Y65 VanDerWaalsContact CD-CE1 3.49Å; R63-Y65 WeakPolarHBondContact CD-OH 3.48Å; R63-Y65 HydrophobicContact CG-CE1 4.2Å; R63-Y65 HydrophobicContact CG-CE2 4.14Å; R63-Y65 WeakPolarHBondContact O-CD2 3.36Å; R63-Y65 PolarHBondContact O-N 2.92Å | ||
| 64 | Q | 41.2 | Very low | 43.7 | Very low | 161 Ų | 161 | 143.5 Ų | 143.5 | 75% | 0.752 | 76% | 0.763 | S | S | * | * | trans | -59.8 | 105.3 | 167.7 | -74.6 | 172.6 | -28 | 0 | 0 | 108.9 | E62 N66 | E62-Q64 PolarHBondContact O-N 3.1Å; Q64-N66 PolarHBondContact O-N 3.41Å | ||
| 65 | Y | 35.8 | Very low | 43.3 | Very low | 192 Ų | 192 | 143.7 Ų | 143.7 | 75% | 0.753 | 76% | 0.762 | S | S | * | * | trans | -83.7 | 97.5 | 168.3 | -65.5 | -82.7 | 0 | 0 | 0 | 108.4 | R63 C67 | R63-Y65 HydrophobicContact CB-CE2 4.09Å; R63-Y65 VanDerWaalsContact CD-CE1 3.49Å; R63-Y65 WeakPolarHBondContact CD-OH 3.48Å; R63-Y65 HydrophobicContact CG-CE1 4.2Å; R63-Y65 HydrophobicContact CG-CE2 4.14Å; R63-Y65 WeakPolarHBondContact O-CD2 3.36Å; R63-Y65 PolarHBondContact O-N 2.92Å; Y65-C67 PolarHBondContact O-N 2.8Å | ||
| 66 | N | 48.4 | Very low | 42.7 | Very low | 138 Ų | 138 | 144 Ų | 144 | 74% | 0.738 | 76% | 0.764 | S | S | * | * | trans | -70.4 | 108.6 | 169.6 | -179.7 | 54.7 | 0 | 0 | 0 | 109.7 | Q64 A68 | Q64-N66 PolarHBondContact O-N 3.41Å; N66-A68 VanDerWaalsContact C-N 3.32Å; N66-A68 PolarHBondContact O-N 3.28Å | ||
| 67 | C | 37.3 | Very low | 42.1 | Very low | 134 Ų | 134 | 148.7 Ų | 148.7 | 91% | 0.905 | 77% | 0.765 | S | S | * | * | trans | -89 | 65 | 175 | 62.7 | 0 | 0 | 0 | 0 | 111.2 | Y65 | Y65-C67 PolarHBondContact O-N 2.8Š| ||
| 68 | A | 48.6 | Very low | 41.6 | Very low | 60 Ų | 60 | 141.2 Ų | 141.2 | 50% | 0.496 | 76% | 0.758 | S | S | . | * | trans | -144.4 | 92.8 | 169.6 | 0 | 0 | 0 | 0 | 0 | 108.9 | N66 | N66-A68 VanDerWaalsContact C-N 3.32Å; N66-A68 PolarHBondContact O-N 3.28Å | ||
| 69 | S | 34.5 | Very low | 41.1 | Very low | 120 Ų | 120 | 144.6 Ų | 144.6 | 84% | 0.839 | 76% | 0.755 | S | S | * | * | trans | 174.3 | 94.6 | 152.6 | -75 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 70 | I | 43.8 | Very low | 40.2 | Very low | 165 Ų | 165 | 145 Ų | 145 | 85% | 0.846 | 77% | 0.771 | S | S | * | * | trans | -89.6 | 132.6 | 161.6 | -64.8 | 176.8 | 0 | 0 | 0 | 106.9 | ||||
| 71 | P | 41.3 | Very low | 40.2 | Very low | 120 Ų | 120 | 141.9 Ų | 141.9 | 78% | 0.779 | 77% | 0.768 | S | S | * | * | trans | -111.9 | 113.3 | 148.2 | 14.9 | 4.3 | 0 | 0 | 0 | 110.2 | ||||
| 72 | E | 40.7 | Very low | 40.7 | Very low | 151 Ų | 151 | 137.5 Ų | 137.5 | 71% | 0.706 | 76% | 0.756 | S | S | * | * | trans | -63 | 160.9 | 142.2 | -103.4 | -95.7 | 130.3 | 0 | 0 | 108.5 | ||||
| 73 | P | 49.9 | Very low | 40.4 | Very low | 93 Ų | 93 | 137.7 Ų | 137.7 | 60% | 0.604 | 76% | 0.756 | S | S | * | * | cis | -139.6 | -175 | 34.3 | 33.8 | -7.7 | 0 | 0 | 0 | 112.1 | ||||
| 74 | D | 29.8 | Very low | 40.2 | Very low | 142 Ų | 142 | 133.6 Ų | 133.6 | 76% | 0.759 | 76% | 0.757 | S | S | * | * | -160.7 | 144.6 | 51.2 | -84.7 | -54.8 | 0 | 0 | 0 | 112.5 | |||||
| 75 | T | 43.9 | Very low | 39.7 | Very low | 118 Ų | 118 | 130.2 Ų | 130.2 | 72% | 0.724 | 76% | 0.757 | S | S | * | * | trans | -84.7 | 166 | 160.9 | 57.2 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 76 | P | 49.9 | Very low | 39.7 | Very low | 118 Ų | 118 | 129.1 Ų | 129.1 | 77% | 0.766 | 76% | 0.758 | S | S | * | * | -145.7 | 135 | 104.1 | 32.9 | -14.9 | 0 | 0 | 0 | 116.1 | |||||
| 77 | R | 37 | Very low | 39.1 | Very low | 227 Ų | 227 | 128.3 Ų | 128.3 | 86% | 0.857 | 75% | 0.753 | S | S | * | * | 76.8 | 119.8 | 115.1 | -163.9 | 172.3 | 169.9 | -177.9 | -2.9 | 121.1 | |||||
| 78 | G | 31.4 | Very low | 39 | Very low | 69 Ų | 69 | 128.5 Ų | 128.5 | 71% | 0.711 | 75% | 0.745 | S | S | * | * | trans | 133.1 | 128.5 | 149.7 | 0 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 79 | H | 39.4 | Very low | 38.2 | Very low | 179 Ų | 179 | 131.6 Ų | 131.6 | 83% | 0.829 | 76% | 0.757 | S | S | * | * | cis | 173.9 | 138.6 | -9 | -118.4 | 44.6 | 0 | 0 | 0 | 104.5 | ||||
| 80 | G | 29.1 | Very low | 38 | Very low | 80 Ų | 80 | 129.2 Ų | 129.2 | 83% | 0.825 | 75% | 0.752 | S | S | * | * | trans | 103.2 | 106.2 | 151.7 | 0 | 0 | 0 | 0 | 0 | 120.1 | ||||
| 81 | I | 38.1 | Very low | 37.5 | Very low | 166 Ų | 166 | 131.7 Ų | 131.7 | 85% | 0.851 | 76% | 0.756 | S | S | * | * | trans | -106.8 | 167.9 | 142.3 | -28.8 | -175.6 | 0 | 0 | 0 | 104.1 | ||||
| 82 | P | 53.9 | Low | 37.1 | Very low | 99 Ų | 99 | 130 Ų | 130 | 64% | 0.643 | 76% | 0.761 | S | S | * | * | cis | -145.3 | -171.4 | 6.2 | 23 | 7.6 | 0 | 0 | 0 | 117.2 | ||||
| 83 | H | 32.5 | Very low | 36.7 | Very low | 169 Ų | 169 | 131.4 Ų | 131.4 | 78% | 0.782 | 77% | 0.768 | S | S | * | * | trans | 107.7 | 127.4 | 150.5 | -84.9 | -85.1 | 0 | 0 | 0 | 123.3 | ||||
| 84 | S | 37.9 | Very low | 36.4 | Very low | 104 Ų | 104 | 132.7 Ų | 132.7 | 73% | 0.727 | 78% | 0.776 | S | S | * | * | trans | 67 | 113.5 | 135.8 | -81 | 0 | 0 | 0 | 0 | 124.5 | ||||
| 85 | A | 30.6 | Very low | 36.4 | Very low | 91 Ų | 91 | 130 Ų | 130 | 75% | 0.752 | 77% | 0.774 | S | S | * | * | 65.4 | 125.7 | 110.7 | 0 | 0 | 0 | 0 | 0 | 123 | |||||
| 86 | H | 35.7 | Very low | 35.8 | Very low | 168 Ų | 168 | 129.8 Ų | 129.8 | 78% | 0.778 | 78% | 0.777 | S | S | * | * | trans | 90.9 | 142.8 | 130.9 | -146.8 | -136.8 | 0 | 0 | 0 | 120.9 | ||||
| 87 | L | 34.8 | Very low | 34.7 | Very low | 122 Ų | 122 | 130.7 Ų | 130.7 | 64% | 0.639 | 79% | 0.785 | S | S | * | * | trans | 85.2 | 132.6 | 159.3 | -63.4 | 175.1 | 0 | 0 | 0 | 117.7 | ||||
| 88 | L | 36.4 | Very low | 34.3 | Very low | 138 Ų | 138 | 128.8 Ų | 128.8 | 72% | 0.723 | 79% | 0.785 | S | S | * | * | cis | -167.2 | 150.8 | 18.1 | -100.4 | 152.6 | 0 | 0 | 0 | 112.8 | ||||
| 89 | T | 31.6 | Very low | 34.4 | Very low | 124 Ų | 124 | 131.1 Ų | 131.1 | 76% | 0.761 | 79% | 0.786 | S | S | * | * | trans | 68.8 | 129.2 | 131.1 | -70 | 0 | 0 | 0 | 0 | 124.2 | ||||
| 90 | G | 31.1 | Very low | 34.6 | Very low | 70 Ų | 70 | 128.6 Ų | 128.6 | 72% | 0.722 | 79% | 0.785 | S | S | * | * | trans | 157.1 | 64.5 | 149.4 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 91 | K | 32.7 | Very low | 34.6 | Very low | 217 Ų | 217 | 133 Ų | 133 | 94% | 0.943 | 78% | 0.784 | S | S | * | * | 43.7 | 112.3 | 102.3 | -106.3 | 167.4 | 174.4 | 173.6 | 0 | 115.9 | |||||
| 92 | G | 33.1 | Very low | 34.4 | Very low | 86 Ų | 86 | 133.5 Ų | 133.5 | 89% | 0.887 | 79% | 0.788 | S | S | * | * | trans | 176.6 | 78.1 | 167.7 | 0 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 93 | Q | 32.7 | Very low | 33.6 | Very low | 179 Ų | 179 | 133.1 Ų | 133.1 | 84% | 0.836 | 79% | 0.787 | S | S | * | * | trans | -123.1 | 147.9 | 160.8 | -146.7 | -170.4 | 1.8 | 0 | 0 | 106.4 | ||||
| 94 | P | 43.5 | Very low | 33.7 | Very low | 121 Ų | 121 | 133 Ų | 133 | 79% | 0.786 | 79% | 0.79 | S | S | * | * | -149.8 | 165.6 | 100.2 | 35.9 | -17.6 | 0 | 0 | 0 | 116.7 | |||||
| 95 | A | 30.1 | Very low | 34 | Very low | 85 Ų | 85 | 133.2 Ų | 133.2 | 70% | 0.702 | 79% | 0.791 | S | S | * | * | trans | 64.8 | 109 | 154 | 0 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 96 | S | 30.3 | Very low | 34.9 | Very low | 113 Ų | 113 | 134.8 Ų | 134.8 | 79% | 0.79 | 79% | 0.793 | S | S | * | * | 67.6 | 112.9 | 63.2 | -160.8 | 0 | 0 | 0 | 0 | 114.4 | |||||
| 97 | C | 27 | Very low | 35 | Very low | 138 Ų | 138 | 131.1 Ų | 131.1 | 93% | 0.932 | 79% | 0.792 | S | S | * | * | trans | -153.5 | 151.8 | 147.1 | -93.6 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 98 | E | 28.7 | Very low | 35.7 | Very low | 186 Ų | 186 | 131.6 Ų | 131.6 | 87% | 0.869 | 80% | 0.8 | S | S | * | * | trans | -93.8 | 162.6 | -150 | -160.2 | 171.3 | 109 | 0 | 0 | 114.2 | ||||
| 99 | T | 33 | Very low | 36.5 | Very low | 118 Ų | 118 | 130.6 Ų | 130.6 | 72% | 0.724 | 80% | 0.802 | S | S | * | * | trans | -51.3 | 160.2 | 174.2 | 2.4 | 0 | 0 | 0 | 0 | 115.7 | ||||
| 100 | P | 43.6 | Very low | 37.3 | Very low | 126 Ų | 126 | 130.3 Ų | 130.3 | 82% | 0.818 | 80% | 0.802 | S | S | * | * | -138.1 | 153.1 | 87 | 26.7 | -6.7 | 0 | 0 | 0 | 115.7 | |||||
| 101 | Q | 29.3 | Very low | 38 | Very low | 173 Ų | 173 | 131.9 Ų | 131.9 | 81% | 0.808 | 81% | 0.809 | S | S | * | * | trans | -50.6 | 143.8 | 170.3 | -72.9 | -151.2 | -62 | 0 | 0 | 113.2 | ||||
| 102 | L | 34.1 | Very low | 38.2 | Very low | 177 Ų | 177 | 126 Ų | 126 | 93% | 0.927 | 80% | 0.8 | S | S | * | * | trans | -145 | 131.9 | 130.4 | -84.2 | -179.3 | 0 | 0 | 0 | 110.9 | ||||
| 103 | S | 36.1 | Very low | 38.7 | Very low | 90 Ų | 90 | 126.7 Ų | 126.7 | 63% | 0.629 | 80% | 0.797 | S | S | * | * | trans | -57 | 149 | 170.7 | 179.6 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 104 | M | 36.5 | Very low | 39.1 | Very low | 168 Ų | 168 | 123.9 Ų | 123.9 | 83% | 0.828 | 80% | 0.798 | S | S | * | * | trans | 168.5 | 110.7 | 131.8 | -83.9 | -76.6 | 95.1 | 0 | 0 | 110.6 | ||||
| 105 | S | 43 | Very low | 39 | Very low | 108 Ų | 108 | 122.7 Ų | 122.7 | 76% | 0.755 | 80% | 0.798 | S | S | * | * | trans | -74.1 | 157.6 | 155.2 | -63.6 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 106 | P | 50.3 | Low | 39.1 | Very low | 124 Ų | 124 | 123.5 Ų | 123.5 | 81% | 0.805 | 80% | 0.798 | S | S | * | * | -139.2 | 133.2 | 102.9 | 17.6 | 4.3 | 0 | 0 | 0 | 112 | |||||
| 107 | A | 37.7 | Very low | 39.7 | Very low | 91 Ų | 91 | 125.7 Ų | 125.7 | 75% | 0.752 | 80% | 0.8 | S | S | * | * | 79.3 | 100.4 | 81.6 | 0 | 0 | 0 | 0 | 0 | 113.6 | |||||
| 108 | T | 49.2 | Very low | 40.4 | Very low | 132 Ų | 132 | 128 Ų | 128 | 81% | 0.81 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -50.5 | 134 | 161.2 | -30.4 | 0 | 0 | 0 | 0 | 111.3 | ||
| 109 | P | 52.4 | Low | 40.8 | Very low | 116 Ų | 116 | 123.4 Ų | 123.4 | 75% | 0.753 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -77.9 | 136.5 | 165.7 | 28.9 | -29 | 0 | 0 | 0 | 110.2 | ||
| 110 | P | 50.1 | Low | 41.3 | Very low | 119 Ų | 119 | 123.1 Ų | 123.1 | 77% | 0.773 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -80.7 | 155.7 | -178 | 32.6 | -33.3 | 0 | 0 | 0 | 112.1 | A112 | P110-A112 PolarHBondContact O-N 2.78Š|
| 111 | A | 44.3 | Very low | 41.3 | Very low | 103 Ų | 103 | 123.1 Ų | 123.1 | 85% | 0.851 | 79% | 0.79 | S | S | * | * | trans | -54.4 | 114.6 | 167.7 | 0 | 0 | 0 | 0 | 0 | 110.5 | A113 | A111-A113 PolarHBondContact O-N 3.12Š| ||
| 112 | A | 38.1 | Very low | 42.1 | Very low | 93 Ų | 93 | 122.2 Ų | 122.2 | 77% | 0.769 | 79% | 0.785 | S | S | * | * | trans | -78.8 | 111.2 | 168.3 | 0 | 0 | 0 | 0 | 0 | 108.8 | P110 S114 | P110-A112 PolarHBondContact O-N 2.78Å; A112-S114 PolarHBondContact O-N 3Å | ||
| 113 | A | 43.5 | Very low | 42.7 | Very low | 100 Ų | 100 | 122.5 Ų | 122.5 | 83% | 0.826 | 78% | 0.782 | S | S | * | * | trans | -67.5 | 112 | 158.8 | 0 | 0 | 0 | 0 | 0 | 108.2 | A111 A115 | A111-A113 PolarHBondContact O-N 3.12Å; A113-A115 PolarHBondContact O-N 3.04Å | ||
| 114 | S | 40.5 | Very low | 43.5 | Very low | 121 Ų | 121 | 123.2 Ų | 123.2 | 85% | 0.846 | 78% | 0.784 | S | S | * | * | trans | -84.5 | 91.3 | 164.8 | -84.1 | 0 | 0 | 0 | 0 | 109 | A112 | A112-S114 PolarHBondContact O-N 3Š| ||
| 115 | A | 40.9 | Very low | 43.9 | Very low | 96 Ų | 96 | 122.2 Ų | 122.2 | 79% | 0.793 | 78% | 0.782 | S | S | * | * | trans | -89.1 | 110.6 | 147.9 | 0 | 0 | 0 | 0 | 0 | 107.2 | A113 | A113-A115 PolarHBondContact O-N 3.04Š| ||
| 116 | C | 32.5 | Very low | 43.7 | Very low | 102 Ų | 102 | 122 Ų | 122 | 69% | 0.689 | 78% | 0.781 | S | S | * | * | trans | -145.8 | 104.7 | 160.4 | -174.6 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 117 | N | 43.9 | Very low | 43.7 | Very low | 159 Ų | 159 | 122.5 Ų | 122.5 | 85% | 0.85 | 78% | 0.781 | S | S | * | * | trans | -67.8 | 128.6 | 160.6 | -65.4 | -65.9 | 0 | 0 | 0 | 108 | ||||
| 118 | Q | 40.2 | Very low | 44.2 | Very low | 186 Ų | 186 | 124.4 Ų | 124.4 | 87% | 0.869 | 78% | 0.784 | S | S | * | * | trans | -147.7 | 146 | 152.1 | -135 | 165.5 | 91.3 | 0 | 0 | 111.5 | ||||
| 119 | A | 38.2 | Very low | 44.3 | Very low | 89 Ų | 89 | 122.9 Ų | 122.9 | 74% | 0.736 | 78% | 0.778 | S | S | * | * | trans | -68.7 | 156 | -154.5 | 0 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 120 | T | 42.8 | Very low | 44.3 | Very low | 113 Ų | 113 | 122 Ų | 122 | 69% | 0.693 | 77% | 0.774 | S | S | * | * | trans | -50.3 | 144.1 | 162.4 | 34.9 | 0 | 0 | 0 | 0 | 113 | ||||
| 121 | P | 44 | Very low | 44.7 | Very low | 126 Ų | 126 | 125.6 Ų | 125.6 | 82% | 0.818 | 78% | 0.778 | S | S | * | * | trans | -110.8 | 115 | 135.7 | 30 | -19.4 | 0 | 0 | 0 | 108.8 | ||||
| 122 | E | 46 | Very low | 45.7 | Very low | 153 Ų | 153 | 128.4 Ų | 128.4 | 72% | 0.715 | 77% | 0.774 | S | S | * | * | trans | -65.6 | 121.1 | 171.7 | -59.9 | -80 | 113 | 0 | 0 | 110.1 | ||||
| 123 | H | 46.9 | Very low | 47.6 | Very low | 184 Ų | 184 | 128.9 Ų | 128.9 | 85% | 0.852 | 77% | 0.769 | S | S | * | * | trans | -174.8 | 156.2 | 144.3 | -107 | -67.6 | 0 | 0 | 0 | 110.5 | ||||
| 124 | P | 51.9 | Low | 49.6 | Very low | 105 Ų | 105 | 129.1 Ų | 129.1 | 68% | 0.682 | 76% | 0.76 | S | S | * | * | -110.7 | 154.3 | -111 | 34.7 | -21.4 | 0 | 0 | 0 | 113.7 | |||||
| 125 | N | 45.2 | Very low | 51.9 | Low | 146 Ų | 146 | 127.3 Ų | 127.3 | 78% | 0.781 | 74% | 0.744 | S | S | * | * | trans | 44.3 | 88.3 | 152 | -156.2 | 32.3 | 0 | 0 | 0 | 117 | ||||
| 126 | S | 39.9 | Very low | 54.2 | Low | 105 Ų | 105 | 128.9 Ų | 128.9 | 73% | 0.734 | 73% | 0.73 | S | S | * | * | trans | -140.2 | 111.3 | 147.9 | -78.2 | 0 | 0 | 0 | 0 | 108.2 | V128 | S126-V128 VanDerWaalsContact C-N 3.25Å; S126-V128 PolarHBondContact O-N 3.18Å | ||
| 127 | T | 49 | Very low | 56.8 | Low | 133 Ų | 133 | 128.8 Ų | 128.8 | 82% | 0.816 | 73% | 0.728 | S | S | * | * | trans | -59.3 | 84.2 | 171.9 | 37.9 | 0 | 0 | 0 | 0 | 109.7 | S129 | T127-S129 PolarHBondContact O-N 2.92Š| ||
| 128 | V | 48.5 | Very low | 59 | Low | 132 Ų | 132 | 130.5 Ų | 130.5 | 80% | 0.8 | 72% | 0.723 | S | S | * | * | trans | -73.1 | 85 | 169.1 | -176.5 | 0 | 0 | 0 | 0 | 107 | S126 S130 | S126-V128 VanDerWaalsContact C-N 3.25Å; S126-V128 PolarHBondContact O-N 3.18Å; V128-S130 PolarHBondContact O-N 3.03Å | ||
| 129 | S | 52.5 | Low | 61.2 | Low | 100 Ų | 100 | 125.5 Ų | 125.5 | 70% | 0.699 | 70% | 0.7 | S | S | * | * | trans | -55.1 | 105.3 | 164 | -177.9 | 0 | 0 | 0 | 0 | 107.3 | T127 K131 | T127-S129 PolarHBondContact O-N 2.92Å; S129-K131 VanDerWaalsContact C-N 3.34Å; S129-K131 PolarHBondContact O-N 2.95Å | ||
| 130 | S | 50.6 | Low | 63.4 | Low | 96 Ų | 96 | 127.4 Ų | 127.4 | 67% | 0.671 | 69% | 0.692 | S | S | * | * | trans | -60.9 | 93 | 179.5 | 53.9 | 0 | 0 | 0 | 0 | 109.2 | V128 Q132 | V128-S130 PolarHBondContact O-N 3.03Å; S130-Q132 PolarHBondContact O-N 2.82Å | ||
| 131 | K | 60.1 | Low | 65.2 | Low | 196 Ų | 196 | 128.7 Ų | 128.7 | 85% | 0.852 | 69% | 0.688 | S | S | * | * | trans | -66.8 | 99.9 | 173.9 | -64.1 | -171.7 | -178 | -179.8 | 0 | 107.7 | S129 | S129-K131 VanDerWaalsContact C-N 3.34Å; S129-K131 PolarHBondContact O-N 2.95Å | ||
| 132 | Q | 64.6 | Low | 66.6 | Low | 162 Ų | 162 | 129.7 Ų | 129.7 | 76% | 0.757 | 69% | 0.685 | S | S | * | * | trans | -51.5 | 131.7 | 170.3 | -74.4 | -76 | -5.6 | 0 | 0 | 108.8 | S130 V134 | S130-Q132 PolarHBondContact O-N 2.82Å; Q132-V134 PolarHBondContact O-N 2.94Å | ||
| 133 | P | 78.9 | Confident | 67.5 | Low | 103 Ų | 103 | 130.3 Ų | 130.3 | 67% | 0.669 | 69% | 0.687 | S | S | * | * | trans | -60.3 | 130.7 | -178.8 | 23.3 | -31.9 | 0 | 0 | 0 | 110.4 | V135 | P133-V135 PolarHBondContact O-N 3.09Å; P133-V135 VanDerWaalsContact O-N 3.16Å | ||
| 134 | V | 85.3 | Confident | 67.9 | Low | 104 Ų | 104 | 124 Ų | 124 | 63% | 0.63 | 66% | 0.662 | S | S | * | * | trans | -68.2 | 112.1 | -179.9 | 178.4 | 0 | 0 | 0 | 0 | 109.5 | Q132 Y136 M139 | Q132-V134 PolarHBondContact O-N 2.94Å; V134-Y136 HydrophobicContact CG1-CD1 4.4Å; V134-Y136 HydrophobicContact CG1-CE1 4.03Å; V134-Y136 PolarHBondContact O-N 3.26Å; V134-M139 WeakPolarHBondContact O-CE 3.15Å | ||
| 135 | V | 87.6 | Confident | 67.9 | Low | 84 Ų | 84 | 124.7 Ų | 124.7 | 51% | 0.509 | 67% | 0.669 | S | S | . | * | trans | -89.5 | 99.2 | 177 | -175.4 | 0 | 0 | 0 | 0 | 111 | P133 M139 K140 | P133-V135 PolarHBondContact O-N 3.09Å; P133-V135 VanDerWaalsContact O-N 3.16Å; V135-M139 HydrophobicContact CG1-CB 4.08Å; V135-M139 HydrophobicContact CG1-CE 4.42Å; V135-K140 HydrophobicContact CG1-CG 4.02Å | ||
| 136 | Y | 90 | Very high | 68.3 | Low | 129 Ų | 129 | 124.2 Ų | 124.2 | 51% | 0.506 | 67% | 0.672 | S | S | . | * | trans | -62.4 | 150.6 | 174.3 | -59.9 | -70.6 | 0 | 0 | 0 | 113.1 | V134 W138 M139 | V134-Y136 HydrophobicContact CG1-CD1 4.4Å; V134-Y136 HydrophobicContact CG1-CE1 4.03Å; V134-Y136 PolarHBondContact O-N 3.26Å; Y136-W138 VanDerWaalsContact C-N 3.27Å; Y136-W138 VanDerWaalsContact CB-NE1 3.31Å; Y136-W138 AromaticContact CD2-NE1 3.95Å; Y136-W138 AromaticContact CG-NE1 3.82Å; Y136-W138 PolarHBondContact O-N 2.71Å; Y136-W138 VanDerWaalsContact O-N 3.14Å; Y136-M139 HydrophobicContact CD2-CE 3.43Å; Y136-M139 VanDerWaalsContact CD2-CE 3.43Å; Y136-M139 HydrophobicContact CD2-SD 4.45Å; Y136-M139 HydrophobicContact CE2-CE 4.33Å; Y136-M139 HydrophobicContact CG-CE 4.06Å; Y136-M139 WeakPolarHBondContact O-CB 3.36Å; Y136-M139 PolarHBondContact O-N 3.27Å | ||
| 137 | P | 87.8 | Confident | 68.8 | Low | 100 Ų | 100 | 124.9 Ų | 124.9 | 65% | 0.649 | 67% | 0.671 | S | S | * | * | G | 310 helix | trans | -54.3 | -34.8 | -177.6 | -29.1 | 36.1 | 0 | 0 | 0 | 115.4 | M139 K140 | P137-M139 VanDerWaalsContact C-N 3.28Å; P137-M139 PolarHBondContact O-N 3.46Å; P137-K140 WeakPolarHBondContact O-CB 3.4Å; P137-K140 PolarHBondContact O-N 3Å |
| 138 | W | 88.3 | Confident | 68.9 | Low | 194 Ų | 194 | 124.7 Ų | 124.7 | 74% | 0.735 | 67% | 0.665 | S | S | * | * | G | 310 helix | trans | -71 | -22.5 | 178.4 | 65.8 | -94.3 | 0 | 0 | 0 | 113.5 | Y136 K140 | Y136-W138 VanDerWaalsContact C-N 3.27Å; Y136-W138 VanDerWaalsContact CB-NE1 3.31Å; Y136-W138 AromaticContact CD2-NE1 3.95Å; Y136-W138 AromaticContact CG-NE1 3.82Å; Y136-W138 PolarHBondContact O-N 2.71Å; Y136-W138 VanDerWaalsContact O-N 3.14Å; W138-K140 VanDerWaalsContact C-N 3.27Å |
| 139 | M | 87.4 | Confident | 69.2 | Low | 81 Ų | 81 | 125 Ų | 125 | 40% | 0.399 | 67% | 0.673 | S | S | . | * | G | 310 helix | trans | -79.9 | -12.4 | 175.3 | -63 | -167.1 | -63.1 | 0 | 0 | 112.1 | V134 V135 Y136 P137 | V134-M139 WeakPolarHBondContact O-CE 3.15Å; V135-M139 HydrophobicContact CG1-CB 4.08Å; V135-M139 HydrophobicContact CG1-CE 4.42Å; Y136-M139 HydrophobicContact CD2-CE 3.43Å; Y136-M139 VanDerWaalsContact CD2-CE 3.43Å; Y136-M139 HydrophobicContact CD2-SD 4.45Å; Y136-M139 HydrophobicContact CE2-CE 4.33Å; Y136-M139 HydrophobicContact CG-CE 4.06Å; Y136-M139 WeakPolarHBondContact O-CB 3.36Å; Y136-M139 PolarHBondContact O-N 3.27Å; P137-M139 VanDerWaalsContact C-N 3.28Å; P137-M139 PolarHBondContact O-N 3.46Å |
| 140 | K | 83.6 | Confident | 69.3 | Low | 130 Ų | 130 | 123.1 Ų | 123.1 | 57% | 0.565 | 67% | 0.669 | S | S | * | * | S | Bend | trans | -79.1 | 130.8 | 176 | -59.2 | -177.9 | 177.4 | 178.8 | 0 | 109.5 | V135 P137 W138 I142 | V135-K140 HydrophobicContact CG1-CG 4.02Å; P137-K140 WeakPolarHBondContact O-CB 3.4Å; P137-K140 PolarHBondContact O-N 3Å; W138-K140 VanDerWaalsContact C-N 3.27Å; K140-I142 PolarHBondContact O-N 3.14Å |
| 141 | K | 80.3 | Confident | 69.1 | Low | 139 Ų | 139 | 127.9 Ų | 127.9 | 60% | 0.604 | 67% | 0.674 | S | S | * | * | trans | -71.9 | 98.5 | 178.8 | -68.5 | 176.3 | 69.6 | -155.6 | 0 | 110.5 | H143 V144 | K141-H143 PolarHBondContact O-N 3.44Å; K141-H143 VanDerWaalsContact O-N 3.07Å; K141-V144 HydrophobicContact CB-CG2 4.23Å; K141-V144 PolarHBondContact O-N 2.8Å | ||
| 142 | I | 74.8 | Confident | 68.9 | Low | 147 Ų | 147 | 126.5 Ų | 126.5 | 75% | 0.754 | 68% | 0.676 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -58 | -24.3 | -175.5 | -61.1 | 163.2 | 0 | 0 | 0 | 113.6 | K140 V144 | K140-I142 PolarHBondContact O-N 3.14Å; I142-V144 VanDerWaalsContact C-N 3.28Å; I142-V144 PolarHBondContact O-N 3.23Å |
| 143 | H | 63.6 | Low | 68.4 | Low | 166 Ų | 166 | 120.8 Ų | 120.8 | 77% | 0.769 | 66% | 0.66 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.3 | 0.3 | -175.1 | -76.7 | -73.9 | 0 | 0 | 0 | 116 | K141 | K141-H143 PolarHBondContact O-N 3.44Å; K141-H143 VanDerWaalsContact O-N 3.07Å |
| 144 | V | 55.8 | Low | 67.4 | Low | 52 Ų | 52 | 123.1 Ų | 123.1 | 32% | 0.315 | 67% | 0.673 | S | S | . | * | S | Bend | trans | -109.2 | -19.6 | -165.7 | 171 | 0 | 0 | 0 | 0 | 114.2 | K141 I142 T146 E155 | K141-V144 HydrophobicContact CB-CG2 4.23Å; K141-V144 PolarHBondContact O-N 2.8Å; I142-V144 VanDerWaalsContact C-N 3.28Å; I142-V144 PolarHBondContact O-N 3.23Å; V144-T146 PolarHBondContact O-N 3.39Å; V144-E155 WeakPolarHBondContact CG1-OE2 3.47Å; V144-E155 VanDerWaalsContact CG2-OE2 3.23Å; V144-E155 WeakPolarHBondContact CG2-OE2 3.46Å |
| 145 | S | 51.5 | Low | 66.1 | Low | 119 Ų | 119 | 122.4 Ų | 122.4 | 83% | 0.832 | 66% | 0.663 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -88.1 | -6.6 | -161.8 | -115.6 | 0 | 0 | 0 | 0 | 117.6 | ||
| 146 | T | 55.1 | Low | 64.8 | Low | 137 Ų | 137 | 124 Ų | 124 | 84% | 0.84 | 68% | 0.675 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -97.5 | -7.1 | -165 | -134.2 | 0 | 0 | 0 | 0 | 116.6 | V144 | V144-T146 PolarHBondContact O-N 3.39Š|
| 147 | V | 50.5 | Low | 64 | Low | 118 Ų | 118 | 126.4 Ų | 126.4 | 72% | 0.715 | 69% | 0.688 | S | S | * | * | S | Bend | trans | -134.8 | -9.6 | -175 | -70.6 | 0 | 0 | 0 | 0 | 118.9 | ||
| 148 | N | 50.2 | Low | 63.5 | Low | 129 Ų | 129 | 132.1 Ų | 132.1 | 69% | 0.69 | 70% | 0.696 | S | S | * | * | trans | -164.9 | 105.4 | 169.7 | -98.7 | -21.5 | 0 | 0 | 0 | 112.3 | G150 | N148-G150 PolarHBondContact O-N 3.46Å; N148-G150 VanDerWaalsContact O-N 3.15Å | ||
| 149 | S | 55.4 | Low | 63.3 | Low | 140 Ų | 140 | 128.2 Ų | 128.2 | 98% | 0.979 | 70% | 0.699 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79.8 | 17.7 | 179.8 | -158.8 | 0 | 0 | 0 | 0 | 114.1 | ||
| 150 | G | 53.8 | Low | 63.4 | Low | 59 Ų | 59 | 135.6 Ų | 135.6 | 61% | 0.608 | 72% | 0.722 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -126.6 | 0 | -167.9 | 0 | 0 | 0 | 0 | 0 | 117.2 | N148 | N148-G150 PolarHBondContact O-N 3.46Å; N148-G150 VanDerWaalsContact O-N 3.15Å |
| 151 | Y | 46.1 | Very low | 63.9 | Low | 197 Ų | 197 | 135.1 Ų | 135.1 | 77% | 0.773 | 73% | 0.731 | S | S | * | * | trans | -111.6 | 95.6 | -179.4 | -102.7 | -94.5 | 0 | 0 | 0 | 112.3 | G153 | Y151-G153 PolarHBondContact O-N 3.42Å; Y151-G153 VanDerWaalsContact O-N 3.17Å | ||
| 152 | N | 57.2 | Low | 64.6 | Low | 167 Ų | 167 | 132.6 Ų | 132.6 | 89% | 0.893 | 74% | 0.735 | S | S | * | * | trans | -78.4 | 85.8 | 166.2 | -50 | -30.5 | 0 | 0 | 0 | 107.8 | ||||
| 153 | G | 53.4 | Low | 65.8 | Low | 42 Ų | 42 | 129 Ų | 129 | 43% | 0.433 | 71% | 0.713 | S | S | . | * | S | Bend | trans | -178.3 | 100.1 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | Y151 E155 | Y151-G153 PolarHBondContact O-N 3.42Å; Y151-G153 VanDerWaalsContact O-N 3.17Å; G153-E155 PolarHBondContact O-N 2.95Å; G153-E155 VanDerWaalsContact O-N 3.08Å |
| 154 | T | 58.3 | Low | 67.4 | Low | 152 Ų | 152 | 124.7 Ų | 124.7 | 93% | 0.933 | 70% | 0.698 | S | S | * | * | trans | 37 | 62.3 | 157.9 | 53.4 | 0 | 0 | 0 | 0 | 115 | ||||
| 155 | E | 57.2 | Low | 69.4 | Low | 88 Ų | 88 | 131.9 Ų | 131.9 | 41% | 0.411 | 72% | 0.72 | S | S | . | * | P | Polyproline II helix | trans | -66.6 | 138.2 | -177.1 | -101.1 | -162.2 | 149.8 | 0 | 0 | 112.5 | V144 G153 K157 | V144-E155 WeakPolarHBondContact CG1-OE2 3.47Å; V144-E155 VanDerWaalsContact CG2-OE2 3.23Å; V144-E155 WeakPolarHBondContact CG2-OE2 3.46Å; G153-E155 PolarHBondContact O-N 2.95Å; G153-E155 VanDerWaalsContact O-N 3.08Å; E155-K157 PolarHBondContact O-N 2.85Å |
| 156 | P | 60.2 | Low | 71.7 | Confident | 118 Ų | 118 | 132.8 Ų | 132.8 | 77% | 0.766 | 71% | 0.711 | S | S | * | * | P | Polyproline II helix | trans | -61.9 | 123.1 | -178.8 | -17.2 | 28.9 | 0 | 0 | 0 | 110.5 | R158 | P156-R158 PolarHBondContact O-N 2.98Å; P156-R158 VanDerWaalsContact O-N 3.1Å |
| 157 | K | 73.5 | Confident | 73.7 | Confident | 179 Ų | 179 | 127.6 Ų | 127.6 | 78% | 0.778 | 68% | 0.677 | S | S | * | * | P | Polyproline II helix | trans | -54.2 | 123 | 160.1 | -78.6 | 85.9 | 169.2 | -173.5 | 0 | 106.1 | E155 S159 | E155-K157 PolarHBondContact O-N 2.85Å; K157-S159 PolarHBondContact O-N 3.49Å |
| 158 | R | 76.8 | Confident | 76 | Confident | 220 Ų | 220 | 124.2 Ų | 124.2 | 83% | 0.83 | 66% | 0.657 | S | S | * | * | trans | -48.4 | 106.9 | 173.3 | -101.4 | -175.8 | -179.9 | 175.1 | 1.6 | 108.2 | P156 R160 | P156-R158 PolarHBondContact O-N 2.98Å; P156-R158 VanDerWaalsContact O-N 3.1Å; R158-R160 PolarHBondContact O-N 3.48Å | ||
| 159 | S | 84.3 | Confident | 78.3 | Confident | 113 Ų | 113 | 121.8 Ų | 121.8 | 79% | 0.79 | 64% | 0.643 | S | S | * | * | P | Polyproline II helix | trans | -66 | 132.9 | 180 | -175 | 0 | 0 | 0 | 0 | 108.5 | K157 | K157-S159 PolarHBondContact O-N 3.49Š|
| 160 | R | 90.6 | Very high | 80.4 | Confident | 236 Ų | 236 | 118.1 Ų | 118.1 | 89% | 0.891 | 61% | 0.611 | S | S | * | * | P | Polyproline II helix | trans | -85.2 | 118.5 | 177.4 | -71.2 | 178.8 | 175.9 | -96.7 | 1.9 | 108.2 | R158 | R158-R160 PolarHBondContact O-N 3.48Š|
| 161 | T | 93.6 | Very high | 82.5 | Confident | 120 Ų | 120 | 115.3 Ų | 115.3 | 74% | 0.736 | 58% | 0.582 | S | S | * | * | P | Polyproline II helix | trans | -74.9 | 127.6 | 168.8 | -44.5 | 0 | 0 | 0 | 0 | 109.5 | ||
| 162 | A | 95.6 | Very high | 85 | Confident | 85 Ų | 85 | 109.2 Ų | 109.2 | 70% | 0.702 | 56% | 0.56 | S | S | * | * | P | Polyproline II helix | trans | -84.1 | 146 | 172.5 | 0 | 0 | 0 | 0 | 0 | 110.5 | ||
| 163 | Y | 98.3 | Very high | 87 | Confident | 72 Ų | 72 | 107 Ų | 107 | 28% | 0.282 | 54% | 0.543 | S | S | . | . | P | Polyproline II helix | trans | -79.6 | 146.5 | 170.9 | -60 | -49.5 | 0 | 0 | 0 | 110.3 | L195 W203 | Y163-L195 HydrophobicContact CD1-CD1 4.11Å; Y163-L195 HydrophobicContact CD1-CD2 3.9Å; Y163-L195 HydrophobicContact CE1-CD1 4.04Å; Y163-L195 HydrophobicContact CE1-CD2 3.71Å; Y163-W203 AromaticContact CD2-CD1 3.85Å; Y163-W203 AromaticContact CE2-CD1 3.62Å |
| 164 | T | 98.6 | Very high | 89.1 | Confident | 75 Ų | 75 | 105.7 Ų | 105.7 | 46% | 0.46 | 53% | 0.525 | S | S | . | . | P | Polyproline II helix | trans | -69.1 | 159.3 | 174.8 | 74.5 | 0 | 0 | 0 | 0 | 110.4 | Q166 Q167 V168 | T164-Q166 VanDerWaalsContact C-N 3.27Å; T164-Q166 PolarHBondContact O-N 2.84Å; T164-Q167 PolarHBondContact O-N 3.07Å; T164-Q167 VanDerWaalsContact OG1-CG 3.31Å; T164-Q167 WeakPolarHBondContact OG1-CG 3.38Å; T164-Q167 PolarHBondContact OG1-N 3.45Å; T164-V168 WeakPolarHBondContact O-CG2 3.28Å; T164-V168 PolarHBondContact O-N 3.15Å |
| 165 | R | 98.3 | Very high | 91 | Very high | 203 Ų | 203 | 98.5 Ų | 98.5 | 77% | 0.766 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -56.6 | -42.7 | 177.6 | -174.7 | 171.4 | -177.4 | -87.2 | -1 | 112 | V168 L169 | R165-V168 PolarHBondContact O-N 3.33Å; R165-L169 HydrophobicContact CG-CD1 4.18Å; R165-L169 WeakPolarHBondContact O-CG 3.33Å; R165-L169 PolarHBondContact O-N 2.83Å |
| 166 | Q | 98.3 | Very high | 93 | Very high | 138 Ų | 138 | 100.1 Ų | 100.1 | 65% | 0.645 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -61 | -45.5 | 177.5 | -178.5 | -176.3 | -14 | 0 | 0 | 111.9 | T164 V168 L169 E170 | T164-Q166 VanDerWaalsContact C-N 3.27Å; T164-Q166 PolarHBondContact O-N 2.84Å; Q166-V168 VanDerWaalsContact C-N 3.32Å; Q166-V168 PolarHBondContact O-N 3.26Å; Q166-L169 PolarHBondContact O-N 3.41Å; Q166-E170 PolarHBondContact O-N 3.38Å; Q166-E170 VanDerWaalsContact O-N 3.07Å |
| 167 | Q | 98.5 | Very high | 94.8 | Very high | 29 Ų | 29 | 103.6 Ų | 103.6 | 14% | 0.136 | 49% | 0.487 | C | S | . | . | H | α-helix | trans | -59.3 | -44.3 | 177.3 | -72.6 | 171.9 | -26.7 | 0 | 0 | 111.4 | T164 L171 L193 | T164-Q167 PolarHBondContact O-N 3.07Å; T164-Q167 VanDerWaalsContact OG1-CG 3.31Å; T164-Q167 WeakPolarHBondContact OG1-CG 3.38Å; T164-Q167 PolarHBondContact OG1-N 3.45Å; Q167-L171 WeakPolarHBondContact O-CB 3.39Å; Q167-L171 WeakPolarHBondContact O-CD1 3.35Å; Q167-L171 WeakPolarHBondContact O-CG 3.48Å; Q167-L171 PolarHBondContact O-N 2.88Å; Q167-L193 HydrophobicContact CG-CB 4.32Å; Q167-L193 PolarHBondContact NE2-O 3.49Å |
| 168 | V | 98.5 | Very high | 95.9 | Very high | 47 Ų | 47 | 98.4 Ų | 98.4 | 29% | 0.285 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -62.4 | -44.6 | 178.4 | 176.9 | 0 | 0 | 0 | 0 | 111.2 | T164 R165 Q166 L171 E172 | T164-V168 WeakPolarHBondContact O-CG2 3.28Å; T164-V168 PolarHBondContact O-N 3.15Å; R165-V168 PolarHBondContact O-N 3.33Å; Q166-V168 VanDerWaalsContact C-N 3.32Å; Q166-V168 PolarHBondContact O-N 3.26Å; V168-L171 PolarHBondContact O-N 2.67Å; V168-E172 HydrophobicContact CG1-CG 4.36Å; V168-E172 WeakPolarHBondContact O-CB 3.34Å; V168-E172 WeakPolarHBondContact O-CG 3.48Å; V168-E172 PolarHBondContact O-N 3.41Å |
| 169 | L | 98.5 | Very high | 96.9 | Very high | 78 Ų | 78 | 92.3 Ų | 92.3 | 41% | 0.408 | 45% | 0.445 | S | S | . | . | H | α-helix | trans | -63.1 | -45.3 | -179 | -70.8 | 172.9 | 0 | 0 | 0 | 112.5 | R165 Q166 E172 K173 | R165-L169 HydrophobicContact CG-CD1 4.18Å; R165-L169 WeakPolarHBondContact O-CG 3.33Å; R165-L169 PolarHBondContact O-N 2.83Å; Q166-L169 PolarHBondContact O-N 3.41Å; L169-E172 PolarHBondContact O-N 3.11Å; L169-K173 WeakPolarHBondContact O-CB 3.5Å; L169-K173 PolarHBondContact O-N 3.46Å |
| 170 | E | 98.5 | Very high | 97.6 | Very high | 63 Ų | 63 | 93.7 Ų | 93.7 | 29% | 0.294 | 43% | 0.434 | S | S | . | . | H | α-helix | trans | -65.8 | -38.8 | 177 | -72.6 | -64.3 | 153.4 | 0 | 0 | 111.7 | Q166 E172 K173 E174 L193 | Q166-E170 PolarHBondContact O-N 3.38Å; Q166-E170 VanDerWaalsContact O-N 3.07Å; E170-E172 VanDerWaalsContact C-N 3.35Å; E170-E172 PolarHBondContact O-N 2.91Å; E170-K173 PolarHBondContact O-N 2.82Å; E170-K173 IonicContact OE1-NZ 3.07Å; E170-K173 IonicContact OE2-NZ 3.54Å; E170-K173 PolarHBondContact OE2-NZ 3.09Å; E170-E174 WeakPolarHBondContact O-CB 3.19Å; E170-E174 WeakPolarHBondContact O-CG 3.5Å; E170-E174 PolarHBondContact O-N 3.32Å; E170-L193 HydrophobicContact CB-CD1 4.06Å; E170-L193 HydrophobicContact CB-CD2 3.67Å; E170-L193 HydrophobicContact CB-CG 4.44Å; E170-L193 HydrophobicContact CG-CD2 3.92Å |
| 171 | L | 98.6 | Very high | 97.9 | Very high | 0 Ų | 0 | 83.8 Ų | 83.8 | 0% | 0 | 40% | 0.398 | C | S | . | . | H | α-helix | trans | -63.5 | -40.2 | 174.3 | -71.2 | 167.2 | 0 | 0 | 0 | 112.2 | Q167 V168 F175 I189 L193 L195 I200 W203 F204 | Q167-L171 WeakPolarHBondContact O-CB 3.39Å; Q167-L171 WeakPolarHBondContact O-CD1 3.35Å; Q167-L171 WeakPolarHBondContact O-CG 3.48Å; Q167-L171 PolarHBondContact O-N 2.88Å; V168-L171 PolarHBondContact O-N 2.67Å; L171-F175 WeakPolarHBondContact O-CB 3.45Å; L171-F175 PolarHBondContact O-N 3.33Å; L171-I189 HydrophobicContact CD2-CG2 4.18Å; L171-L193 HydrophobicContact CD1-CD1 4.44Å; L171-L193 HydrophobicContact CD2-CD1 3.89Å; L171-L193 HydrophobicContact CG-CD1 3.71Å; L171-L195 HydrophobicContact CD1-CD1 4.32Å; L171-I200 HydrophobicContact CD2-CD1 3.77Å; L171-W203 HydrophobicContact CB-CD2 3.94Å; L171-W203 HydrophobicContact CB-CE3 3.93Å; L171-W203 HydrophobicContact CB-CH2 3.63Å; L171-W203 HydrophobicContact CB-CZ2 3.61Å; L171-W203 HydrophobicContact CB-CZ3 3.78Å; L171-W203 HydrophobicContact CD1-CD2 3.86Å; L171-W203 HydrophobicContact CD1-CG 3.83Å; L171-W203 HydrophobicContact CD1-CZ2 4.48Å; L171-W203 HydrophobicContact CD2-CD2 4.4Å; L171-W203 HydrophobicContact CD2-CE3 4.33Å; L171-W203 HydrophobicContact CG-CD2 4.3Å; L171-W203 WeakPolarHBondContact O-CZ3 3.48Å; L171-F204 HydrophobicContact CD2-CE2 4.06Å |
| 172 | E | 98.6 | Very high | 98.2 | Very high | 69 Ų | 69 | 82.1 Ų | 82.1 | 32% | 0.322 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -66.3 | -45.3 | 175 | -75.6 | -171.4 | 171.9 | 0 | 0 | 111.6 | V168 L169 E170 E174 F175 H176 W203 | V168-E172 HydrophobicContact CG1-CG 4.36Å; V168-E172 WeakPolarHBondContact O-CB 3.34Å; V168-E172 WeakPolarHBondContact O-CG 3.48Å; V168-E172 PolarHBondContact O-N 3.41Å; L169-E172 PolarHBondContact O-N 3.11Å; E170-E172 VanDerWaalsContact C-N 3.35Å; E170-E172 PolarHBondContact O-N 2.91Å; E172-E174 VanDerWaalsContact C-N 3.34Å; E172-E174 PolarHBondContact O-N 3.24Å; E172-F175 WeakPolarHBondContact O-CB 3.35Å; E172-F175 PolarHBondContact O-N 3.07Å; E172-F175 VanDerWaalsContact O-N 3.14Å; E172-H176 PolarHBondContact O-N 3.45Å; E172-H176 PolarHBondContact O-ND1 3.39Å; E172-W203 HydrophobicContact CG-CH2 3.91Å; E172-W203 HydrophobicContact CG-CZ2 4.02Å |
| 173 | K | 98.6 | Very high | 98.3 | Very high | 121 Ų | 121 | 84.8 Ų | 84.8 | 53% | 0.526 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -54.9 | -49.4 | 174.7 | 172.8 | -179.3 | 154.8 | -152.9 | 0 | 111.2 | L169 E170 F175 H176 Y177 | L169-K173 WeakPolarHBondContact O-CB 3.5Å; L169-K173 PolarHBondContact O-N 3.46Å; E170-K173 PolarHBondContact O-N 2.82Å; E170-K173 IonicContact OE1-NZ 3.07Å; E170-K173 IonicContact OE2-NZ 3.54Å; E170-K173 PolarHBondContact OE2-NZ 3.09Å; K173-F175 VanDerWaalsContact C-N 3.33Å; K173-F175 PolarHBondContact O-N 3.07Å; K173-H176 PolarHBondContact O-N 3.22Å; K173-Y177 PolarHBondContact O-N 3.15Å; K173-Y177 VanDerWaalsContact O-N 3.09Å |
| 174 | E | 98.4 | Very high | 98.3 | Very high | 13 Ų | 13 | 90.2 Ų | 90.2 | 6% | 0.061 | 40% | 0.4 | C | S | . | . | H | α-helix | trans | -62.9 | -37.9 | 176.6 | -73.2 | -63.6 | 132.2 | 0 | 0 | 112.6 | E170 E172 H176 Y177 N178 R185 I189 F204 | E170-E174 WeakPolarHBondContact O-CB 3.19Å; E170-E174 WeakPolarHBondContact O-CG 3.5Å; E170-E174 PolarHBondContact O-N 3.32Å; E172-E174 VanDerWaalsContact C-N 3.34Å; E172-E174 PolarHBondContact O-N 3.24Å; E174-H176 VanDerWaalsContact C-N 3.33Å; E174-H176 PolarHBondContact O-N 3.01Å; E174-Y177 PolarHBondContact O-N 2.8Å; E174-N178 PolarHBondContact O-N 3.38Å; E174-R185 IonicContact OE1-CZ 3.4Å; E174-R185 IonicContact OE1-NE 2.83Å; E174-R185 IonicContact OE1-NH2 3.15Å; E174-R185 PolarHBondContact OE1-NH2 3.29Å; E174-R185 IonicContact OE2-CZ 2.91Å; E174-R185 IonicContact OE2-NE 2.67Å; E174-R185 PolarHBondContact OE2-NE 2.96Å; E174-R185 IonicContact OE2-NH2 3.81Å; E174-R185 PolarHBondContact OE2-NH2 2.9Å; E174-R185 VanDerWaalsContact OE2-NH2 3.15Å; E174-I189 HydrophobicContact CB-CD1 4.04Å; E174-I189 HydrophobicContact CG-CD1 3.65Å; E174-I189 HydrophobicContact CG-CG1 4.06Å; E174-F204 HydrophobicContact CB-CZ 4.06Å |
| 175 | F | 98.6 | Very high | 98.3 | Very high | 2 Ų | 2 | 90.7 Ų | 90.7 | 1% | 0.009 | 39% | 0.393 | C | S | . | . | H | α-helix | trans | -65.3 | -35.7 | 177.7 | -177.5 | -98.4 | 0 | 0 | 0 | 113.2 | L171 E172 K173 N178 R179 W203 F204 R207 R208 W211 | L171-F175 WeakPolarHBondContact O-CB 3.45Å; L171-F175 PolarHBondContact O-N 3.33Å; E172-F175 WeakPolarHBondContact O-CB 3.35Å; E172-F175 PolarHBondContact O-N 3.07Å; E172-F175 VanDerWaalsContact O-N 3.14Å; K173-F175 VanDerWaalsContact C-N 3.33Å; K173-F175 PolarHBondContact O-N 3.07Å; F175-N178 CarbonylContact O-C 3.46Å; F175-N178 VanDerWaalsContact O-C 3.3Å; F175-R179 HydrophobicContact CE1-CG 4.19Å; F175-R179 HydrophobicContact CE2-CB 4.05Å; F175-R179 HydrophobicContact CE2-CG 4.1Å; F175-R179 HydrophobicContact CZ-CB 4.27Å; F175-R179 HydrophobicContact CZ-CG 3.86Å; F175-R179 PolarHBondContact O-N 3.22Å; F175-W203 HydrophobicContact CB-CH2 4.43Å; F175-W203 HydrophobicContact CB-CZ3 4.11Å; F175-F204 HydrophobicContact CB-CE1 4.18Å; F175-F204 HydrophobicContact CB-CZ 4.27Å; F175-F204 AromaticContact CD2-CD1 3.96Å; F175-F204 HydrophobicContact CD2-CD1 3.96Å; F175-F204 AromaticContact CD2-CE1 3.89Å; F175-F204 HydrophobicContact CD2-CE1 3.89Å; F175-R207 HydrophobicContact CB-CG 4.41Å; F175-R207 HydrophobicContact CD1-CG 3.73Å; F175-R207 HydrophobicContact CD2-CB 4.19Å; F175-R207 HydrophobicContact CD2-CG 3.58Å; F175-R207 HydrophobicContact CE1-CG 3.8Å; F175-R207 HydrophobicContact CE2-CB 4.18Å; F175-R207 HydrophobicContact CE2-CG 3.66Å; F175-R207 HydrophobicContact CG-CG 3.61Å; F175-R207 HydrophobicContact CZ-CG 3.77Å; F175-R208 HydrophobicContact CE2-CG 3.75Å; F175-R208 HydrophobicContact CZ-CG 4.32Å; F175-W211 HydrophobicContact CE1-CB 4.28Å; F175-W211 HydrophobicContact CE1-CG 4.23Å; F175-W211 HydrophobicContact CZ-CB 3.99Å; F175-W211 HydrophobicContact CZ-CG 4.12Å |
| 176 | H | 98 | Very high | 98.3 | Very high | 121 Ų | 121 | 83.7 Ų | 83.7 | 56% | 0.56 | 37% | 0.367 | S | S | * | . | H | α-helix | trans | -68.9 | -40 | 173.9 | -70.1 | 93 | 0 | 0 | 0 | 111.2 | E172 K173 E174 | E172-H176 PolarHBondContact O-N 3.45Å; E172-H176 PolarHBondContact O-ND1 3.39Å; K173-H176 PolarHBondContact O-N 3.22Å; E174-H176 VanDerWaalsContact C-N 3.33Å; E174-H176 PolarHBondContact O-N 3.01Å |
| 177 | Y | 98.3 | Very high | 98.3 | Very high | 191 Ų | 191 | 79.8 Ų | 79.8 | 75% | 0.749 | 35% | 0.35 | S | S | * | . | H | α-helix | trans | -62.6 | -50.1 | 175.1 | -179.8 | -105.5 | 0 | 0 | 0 | 111.8 | K173 E174 | K173-Y177 PolarHBondContact O-N 3.15Å; K173-Y177 VanDerWaalsContact O-N 3.09Å; E174-Y177 PolarHBondContact O-N 2.8Å |
| 178 | N | 97.1 | Very high | 98.3 | Very high | 70 Ų | 70 | 81.5 Ų | 81.5 | 37% | 0.374 | 36% | 0.358 | S | S | . | . | trans | -146.5 | 121.7 | 174.2 | -168.8 | -13.3 | 0 | 0 | 0 | 111.3 | E174 F175 Y180 | E174-N178 PolarHBondContact O-N 3.38Å; F175-N178 CarbonylContact O-C 3.46Å; F175-N178 VanDerWaalsContact O-C 3.3Å; N178-Y180 PolarHBondContact ND2-O 2.89Å; N178-Y180 PolarHBondContact O-N 2.79Å; N178-Y180 VanDerWaalsContact O-N 3.11Å; N178-Y180 PolarHBondContact OD1-N 2.75Å; N178-Y180 PolarHBondContact OD1-O 2.82Å | ||
| 179 | R | 97.8 | Very high | 98.3 | Very high | 92 Ų | 92 | 79.7 Ų | 79.7 | 35% | 0.347 | 35% | 0.347 | S | S | . | . | S | Bend | trans | -65.3 | -15.4 | 179.5 | -70.6 | 178.4 | 162.7 | 70.5 | 2.7 | 113.4 | F175 R208 W211 | F175-R179 HydrophobicContact CE1-CG 4.19Å; F175-R179 HydrophobicContact CE2-CB 4.05Å; F175-R179 HydrophobicContact CE2-CG 4.1Å; F175-R179 HydrophobicContact CZ-CB 4.27Å; F175-R179 HydrophobicContact CZ-CG 3.86Å; F175-R179 PolarHBondContact O-N 3.22Å; R179-R208 WeakPolarHBondContact O-CD 3.16Å; R179-W211 VanDerWaalsContact NE-CE2 3.26Å |
| 180 | Y | 98.3 | Very high | 98.3 | Very high | 143 Ų | 143 | 76.2 Ų | 76.2 | 56% | 0.561 | 33% | 0.329 | S | S | * | . | S | Bend | trans | -133 | 130.9 | -179 | -62.9 | -103.1 | 0 | 0 | 0 | 110.1 | N178 | N178-Y180 PolarHBondContact ND2-O 2.89Å; N178-Y180 PolarHBondContact O-N 2.79Å; N178-Y180 VanDerWaalsContact O-N 3.11Å; N178-Y180 PolarHBondContact OD1-N 2.75Å; N178-Y180 PolarHBondContact OD1-O 2.82Å |
| 181 | L | 98.3 | Very high | 98.3 | Very high | 27 Ų | 27 | 80 Ų | 80 | 14% | 0.141 | 35% | 0.347 | C | S | . | . | trans | -93.8 | 138.1 | 179.2 | -62.1 | 179.5 | 0 | 0 | 0 | 112.2 | R185 I189 I200 F204 | L181-R185 HydrophobicContact CD2-CG 3.96Å; L181-I189 HydrophobicContact CD1-CD1 3.83Å; L181-I189 HydrophobicContact CD2-CD1 3.79Å; L181-I189 HydrophobicContact CG-CD1 4.48Å; L181-I200 HydrophobicContact CD1-CG2 3.48Å; L181-I200 VanDerWaalsContact CD1-CG2 3.48Å; L181-F204 HydrophobicContact CD1-CD1 4.17Å; L181-F204 HydrophobicContact CD1-CD2 3.65Å; L181-F204 HydrophobicContact CD1-CE1 3.96Å; L181-F204 HydrophobicContact CD1-CE2 3.45Å; L181-F204 VanDerWaalsContact CD1-CE2 3.45Å; L181-F204 HydrophobicContact CD1-CG 4.03Å; L181-F204 HydrophobicContact CD1-CZ 3.61Å; L181-F204 HydrophobicContact CD2-CE1 3.75Å; L181-F204 HydrophobicContact CD2-CE2 4.39Å; L181-F204 HydrophobicContact CD2-CZ 3.69Å; L181-F204 HydrophobicContact CG-CD1 3.81Å; L181-F204 HydrophobicContact CG-CD2 4.23Å; L181-F204 HydrophobicContact CG-CE1 3.52Å; L181-F204 HydrophobicContact CG-CE2 3.99Å; L181-F204 HydrophobicContact CG-CG 4.16Å; L181-F204 HydrophobicContact CG-CZ 3.63Å | ||
| 182 | T | 98.6 | Very high | 98.3 | Very high | 86 Ų | 86 | 85.1 Ų | 85.1 | 53% | 0.528 | 38% | 0.378 | S | S | . | . | trans | -71.4 | 166.7 | 163.4 | 65.5 | 0 | 0 | 0 | 0 | 110.9 | R185 R186 | T182-R185 WeakPolarHBondContact OG1-CB 3.49Å; T182-R185 PolarHBondContact OG1-N 3.18Å; T182-R186 WeakPolarHBondContact O-CB 3.23Å; T182-R186 PolarHBondContact O-N 3.38Å; T182-R186 VanDerWaalsContact O-N 3.14Å | ||
| 183 | R | 98.3 | Very high | 98.3 | Very high | 141 Ų | 141 | 82.3 Ų | 82.3 | 53% | 0.532 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -59.3 | -49 | 177.9 | 180 | 68 | -178.8 | 91.4 | -9.8 | 111.7 | R186 I187 E197 | R183-R186 WeakPolarHBondContact O-CB 3.13Å; R183-R186 PolarHBondContact O-N 2.85Å; R183-I187 WeakPolarHBondContact O-CG1 3.27Å; R183-I187 PolarHBondContact O-N 2.86Å; R183-E197 IonicContact CZ-OE1 2.89Å; R183-E197 VanDerWaalsContact CZ-OE1 3.26Å; R183-E197 IonicContact CZ-OE2 2.68Å; R183-E197 IonicContact NE-OE2 3.63Å; R183-E197 IonicContact NH1-OE1 3.2Å; R183-E197 PolarHBondContact NH1-OE1 3.47Å; R183-E197 IonicContact NH1-OE2 3.45Å; R183-E197 PolarHBondContact NH1-OE2 3.01Å; R183-E197 IonicContact NH2-OE1 3.04Å; R183-E197 PolarHBondContact NH2-OE1 2.91Å; R183-E197 IonicContact NH2-OE2 3.87Å; R183-E197 PolarHBondContact NH2-OE2 3.21Å |
| 184 | R | 98.3 | Very high | 98.3 | Very high | 185 Ų | 185 | 82.6 Ų | 82.6 | 70% | 0.698 | 38% | 0.377 | S | S | * | . | H | α-helix | trans | -60.7 | -51.1 | -179.9 | 177.6 | 176.8 | 170.9 | 163.7 | 2.3 | 111.4 | R186 I187 E188 | R184-R186 PolarHBondContact O-N 2.91Å; R184-I187 WeakPolarHBondContact O-CB 3.34Å; R184-I187 PolarHBondContact O-N 2.9Å; R184-E188 WeakPolarHBondContact CG-OE1 3.41Å; R184-E188 IonicContact NE-OE1 2.8Å; R184-E188 PolarHBondContact NE-OE1 3.31Å; R184-E188 VanDerWaalsContact NE-OE1 3.07Å; R184-E188 PolarHBondContact O-N 3.43Å |
| 185 | R | 98.4 | Very high | 98.2 | Very high | 85 Ų | 85 | 82.9 Ų | 82.9 | 32% | 0.321 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -60.5 | -35 | -178.5 | -172.6 | 55.8 | 176.3 | 176.7 | -1.1 | 112.5 | E174 L181 T182 I187 E188 I189 | E174-R185 IonicContact OE1-CZ 3.4Å; E174-R185 IonicContact OE1-NE 2.83Å; E174-R185 IonicContact OE1-NH2 3.15Å; E174-R185 PolarHBondContact OE1-NH2 3.29Å; E174-R185 IonicContact OE2-CZ 2.91Å; E174-R185 IonicContact OE2-NE 2.67Å; E174-R185 PolarHBondContact OE2-NE 2.96Å; E174-R185 IonicContact OE2-NH2 3.81Å; E174-R185 PolarHBondContact OE2-NH2 2.9Å; E174-R185 VanDerWaalsContact OE2-NH2 3.15Å; L181-R185 HydrophobicContact CD2-CG 3.96Å; T182-R185 WeakPolarHBondContact OG1-CB 3.49Å; T182-R185 PolarHBondContact OG1-N 3.18Å; R185-I187 VanDerWaalsContact C-N 3.33Å; R185-I187 PolarHBondContact O-N 3.44Å; R185-E188 VanDerWaalsContact CD-OE2 3.27Å; R185-E188 WeakPolarHBondContact CD-OE2 3.49Å; R185-E188 IonicContact CZ-OE2 3.66Å; R185-E188 IonicContact NE-OE2 3.88Å; R185-E188 IonicContact NH1-OE2 3.26Å; R185-E188 PolarHBondContact NH1-OE2 2.84Å; R185-E188 PolarHBondContact O-N 2.86Å; R185-I189 HydrophobicContact CG-CD1 3.89Å; R185-I189 HydrophobicContact CG-CG1 4.46Å; R185-I189 WeakPolarHBondContact O-CG1 3.38Å; R185-I189 PolarHBondContact O-N 3.36Å; R185-I189 VanDerWaalsContact O-N 3.09Å |
| 186 | R | 98.5 | Very high | 98.2 | Very high | 56 Ų | 56 | 85.5 Ų | 85.5 | 21% | 0.211 | 40% | 0.397 | C | S | . | . | H | α-helix | trans | -61.2 | -39.5 | 175.1 | -171.2 | -175.3 | -52.1 | -172.1 | 4.3 | 113 | T182 R183 R184 A190 E197 I200 | T182-R186 WeakPolarHBondContact O-CB 3.23Å; T182-R186 PolarHBondContact O-N 3.38Å; T182-R186 VanDerWaalsContact O-N 3.14Å; R183-R186 WeakPolarHBondContact O-CB 3.13Å; R183-R186 PolarHBondContact O-N 2.85Å; R184-R186 PolarHBondContact O-N 2.91Å; R186-A190 WeakPolarHBondContact O-CB 3.43Å; R186-A190 PolarHBondContact O-N 3.42Å; R186-E197 HydrophobicContact CG-CB 4.28Å; R186-E197 HydrophobicContact CG-CG 4.49Å; R186-I200 HydrophobicContact CG-CB 4.12Å; R186-I200 HydrophobicContact CG-CG2 3.96Å |
| 187 | I | 98.6 | Very high | 98.2 | Very high | 56 Ų | 56 | 82.6 Ų | 82.6 | 29% | 0.287 | 38% | 0.384 | S | S | . | . | H | α-helix | trans | -64.2 | -48.2 | 176.9 | -57.7 | 169.3 | 0 | 0 | 0 | 109.5 | R183 R184 R185 I189 A190 H191 | R183-I187 WeakPolarHBondContact O-CG1 3.27Å; R183-I187 PolarHBondContact O-N 2.86Å; R184-I187 WeakPolarHBondContact O-CB 3.34Å; R184-I187 PolarHBondContact O-N 2.9Å; R185-I187 VanDerWaalsContact C-N 3.33Å; R185-I187 PolarHBondContact O-N 3.44Å; I187-I189 VanDerWaalsContact C-N 3.35Å; I187-I189 PolarHBondContact O-N 2.94Å; I187-A190 WeakPolarHBondContact O-CB 3.2Å; I187-A190 PolarHBondContact O-N 3.14Å; I187-H191 VanDerWaalsContact CG2-CE1 3.5Å; I187-H191 WeakPolarHBondContact CG2-CE1 3.37Å; I187-H191 PolarHBondContact O-N 3.16Å |
| 188 | E | 98.4 | Very high | 98.2 | Very high | 66 Ų | 66 | 81.8 Ų | 81.8 | 31% | 0.308 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -57.6 | -46.8 | -178 | -65.2 | 169.8 | -175.1 | 0 | 0 | 111.6 | R184 R185 T192 | R184-E188 WeakPolarHBondContact CG-OE1 3.41Å; R184-E188 IonicContact NE-OE1 2.8Å; R184-E188 PolarHBondContact NE-OE1 3.31Å; R184-E188 VanDerWaalsContact NE-OE1 3.07Å; R184-E188 PolarHBondContact O-N 3.43Å; R185-E188 VanDerWaalsContact CD-OE2 3.27Å; R185-E188 WeakPolarHBondContact CD-OE2 3.49Å; R185-E188 IonicContact CZ-OE2 3.66Å; R185-E188 IonicContact NE-OE2 3.88Å; R185-E188 IonicContact NH1-OE2 3.26Å; R185-E188 PolarHBondContact NH1-OE2 2.84Å; R185-E188 PolarHBondContact O-N 2.86Å; E188-T192 WeakPolarHBondContact O-CB 3.19Å; E188-T192 PolarHBondContact O-N 3.32Å; E188-T192 VanDerWaalsContact O-N 3.12Å; E188-T192 PolarHBondContact O-OG1 2.96Å |
| 189 | I | 98.4 | Very high | 98.3 | Very high | 9 Ų | 9 | 81.2 Ų | 81.2 | 5% | 0.046 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -67.8 | -41.3 | 178.3 | -61.7 | 164.6 | 0 | 0 | 0 | 111.1 | L171 E174 L181 R185 I187 H191 T192 L193 I200 | L171-I189 HydrophobicContact CD2-CG2 4.18Å; E174-I189 HydrophobicContact CB-CD1 4.04Å; E174-I189 HydrophobicContact CG-CD1 3.65Å; E174-I189 HydrophobicContact CG-CG1 4.06Å; L181-I189 HydrophobicContact CD1-CD1 3.83Å; L181-I189 HydrophobicContact CD2-CD1 3.79Å; L181-I189 HydrophobicContact CG-CD1 4.48Å; R185-I189 HydrophobicContact CG-CD1 3.89Å; R185-I189 HydrophobicContact CG-CG1 4.46Å; R185-I189 WeakPolarHBondContact O-CG1 3.38Å; R185-I189 PolarHBondContact O-N 3.36Å; R185-I189 VanDerWaalsContact O-N 3.09Å; I187-I189 VanDerWaalsContact C-N 3.35Å; I187-I189 PolarHBondContact O-N 2.94Å; I189-H191 VanDerWaalsContact C-N 3.33Å; I189-H191 PolarHBondContact O-N 3.4Å; I189-T192 PolarHBondContact O-N 2.95Å; I189-L193 HydrophobicContact CG2-CD1 3.65Å; I189-L193 HydrophobicContact CG2-CG 4.12Å; I189-L193 WeakPolarHBondContact O-CB 3.4Å; I189-L193 WeakPolarHBondContact O-CG 3.43Å; I189-L193 PolarHBondContact O-N 3.37Å; I189-I200 HydrophobicContact CG2-CD1 3.91Å |
| 190 | A | 98.5 | Very high | 98.3 | Very high | 4 Ų | 4 | 76.8 Ų | 76.8 | 3% | 0.033 | 36% | 0.358 | C | S | . | . | H | α-helix | trans | -56.9 | -46.6 | 179.1 | 0 | 0 | 0 | 0 | 0 | 111.6 | R186 I187 V194 L195 E197 I200 | R186-A190 WeakPolarHBondContact O-CB 3.43Å; R186-A190 PolarHBondContact O-N 3.42Å; I187-A190 WeakPolarHBondContact O-CB 3.2Å; I187-A190 PolarHBondContact O-N 3.14Å; A190-V194 WeakPolarHBondContact O-CA 3.35Å; A190-V194 PolarHBondContact O-N 3.25Å; A190-L195 CarbonylContact C-O 3.3Å; A190-L195 WeakPolarHBondContact CA-O 3.41Å; A190-L195 WeakPolarHBondContact CB-O 3.25Å; A190-L195 PolarHBondContact O-N 3.41Å; A190-L195 VanDerWaalsContact O-O 3.1Å; A190-E197 HydrophobicContact CB-CG 4.22Å; A190-I200 HydrophobicContact CB-CG1 4.11Å |
| 191 | H | 98.4 | Very high | 98.3 | Very high | 144 Ų | 144 | 75 Ų | 75 | 67% | 0.667 | 35% | 0.353 | S | S | * | . | H | α-helix | trans | -66.2 | -45.2 | 177.5 | -65.5 | 178.4 | 0 | 0 | 0 | 111.9 | I187 I189 L193 V194 | I187-H191 VanDerWaalsContact CG2-CE1 3.5Å; I187-H191 WeakPolarHBondContact CG2-CE1 3.37Å; I187-H191 PolarHBondContact O-N 3.16Å; I189-H191 VanDerWaalsContact C-N 3.33Å; I189-H191 PolarHBondContact O-N 3.4Å; H191-L193 VanDerWaalsContact C-N 3.31Å; H191-L193 PolarHBondContact O-N 3.05Å; H191-V194 PolarHBondContact O-N 3.23Å |
| 192 | T | 98.1 | Very high | 98.3 | Very high | 107 Ų | 107 | 76.5 Ų | 76.5 | 66% | 0.656 | 36% | 0.36 | S | S | * | . | H | α-helix | trans | -62.5 | -37.3 | -178.2 | -53.8 | 0 | 0 | 0 | 0 | 112.4 | E188 I189 | E188-T192 WeakPolarHBondContact O-CB 3.19Å; E188-T192 PolarHBondContact O-N 3.32Å; E188-T192 VanDerWaalsContact O-N 3.12Å; E188-T192 PolarHBondContact O-OG1 2.96Å; I189-T192 PolarHBondContact O-N 2.95Å |
| 193 | L | 98 | Very high | 98.3 | Very high | 9 Ų | 9 | 73.8 Ų | 73.8 | 5% | 0.047 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -97.3 | -0.9 | -176.1 | -59.6 | -173.7 | 0 | 0 | 0 | 114 | Q167 E170 L171 I189 H191 L195 | Q167-L193 HydrophobicContact CG-CB 4.32Å; Q167-L193 PolarHBondContact NE2-O 3.49Å; E170-L193 HydrophobicContact CB-CD1 4.06Å; E170-L193 HydrophobicContact CB-CD2 3.67Å; E170-L193 HydrophobicContact CB-CG 4.44Å; E170-L193 HydrophobicContact CG-CD2 3.92Å; L171-L193 HydrophobicContact CD1-CD1 4.44Å; L171-L193 HydrophobicContact CD2-CD1 3.89Å; L171-L193 HydrophobicContact CG-CD1 3.71Å; I189-L193 HydrophobicContact CG2-CD1 3.65Å; I189-L193 HydrophobicContact CG2-CG 4.12Å; I189-L193 WeakPolarHBondContact O-CB 3.4Å; I189-L193 WeakPolarHBondContact O-CG 3.43Å; I189-L193 PolarHBondContact O-N 3.37Å; H191-L193 VanDerWaalsContact C-N 3.31Å; H191-L193 PolarHBondContact O-N 3.05Å; L193-L195 VanDerWaalsContact C-N 3.28Å; L193-L195 HydrophobicContact CB-CD1 4.2Å; L193-L195 HydrophobicContact CB-CG 4.2Å; L193-L195 PolarHBondContact O-N 3.39Å |
| 194 | V | 98.3 | Very high | 98.4 | Very high | 127 Ų | 127 | 67.5 Ų | 67.5 | 77% | 0.77 | 32% | 0.317 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 53.3 | 47.9 | -174.9 | -161.9 | 0 | 0 | 0 | 0 | 111 | A190 H191 | A190-V194 WeakPolarHBondContact O-CA 3.35Å; A190-V194 PolarHBondContact O-N 3.25Å; H191-V194 PolarHBondContact O-N 3.23Å |
| 195 | L | 97.8 | Very high | 98.4 | Very high | 19 Ų | 19 | 63 Ų | 63 | 10% | 0.099 | 30% | 0.304 | C | S | . | . | trans | -123.5 | 149.1 | 176.8 | -66.8 | 179 | 0 | 0 | 0 | 109.5 | Y163 L171 A190 L193 Q199 I200 | Y163-L195 HydrophobicContact CD1-CD1 4.11Å; Y163-L195 HydrophobicContact CD1-CD2 3.9Å; Y163-L195 HydrophobicContact CE1-CD1 4.04Å; Y163-L195 HydrophobicContact CE1-CD2 3.71Å; L171-L195 HydrophobicContact CD1-CD1 4.32Å; A190-L195 CarbonylContact C-O 3.3Å; A190-L195 WeakPolarHBondContact CA-O 3.41Å; A190-L195 WeakPolarHBondContact CB-O 3.25Å; A190-L195 PolarHBondContact O-N 3.41Å; A190-L195 VanDerWaalsContact O-O 3.1Å; L193-L195 VanDerWaalsContact C-N 3.28Å; L193-L195 HydrophobicContact CB-CD1 4.2Å; L193-L195 HydrophobicContact CB-CG 4.2Å; L193-L195 PolarHBondContact O-N 3.39Å; L195-Q199 HydrophobicContact CB-CB 4.39Å; L195-I200 HydrophobicContact CB-CD1 3.91Å; L195-I200 HydrophobicContact CB-CG1 4.46Å; L195-I200 HydrophobicContact CD1-CD1 3.93Å | ||
| 196 | S | 98.4 | Very high | 98.4 | Very high | 57 Ų | 57 | 63.8 Ų | 63.8 | 40% | 0.399 | 32% | 0.315 | S | S | . | . | trans | -67.4 | 149 | 172 | 64.8 | 0 | 0 | 0 | 0 | 111.3 | R198 Q199 I200 | S196-R198 PolarHBondContact O-N 3.06Å; S196-Q199 WeakPolarHBondContact O-CA 3.28Å; S196-Q199 WeakPolarHBondContact O-CB 3.42Å; S196-Q199 PolarHBondContact O-N 3.02Å; S196-Q199 VanDerWaalsContact OG-CG 3.28Å; S196-Q199 WeakPolarHBondContact OG-CG 3.46Å; S196-Q199 PolarHBondContact OG-N 2.94Å; S196-Q199 PolarHBondContact OG-OE1 3.11Å; S196-I200 PolarHBondContact O-N 3.03Å; S196-I200 VanDerWaalsContact O-N 3.11Å | ||
| 197 | E | 98.4 | Very high | 98.3 | Very high | 60 Ų | 60 | 63.1 Ų | 63.1 | 28% | 0.28 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -53.6 | -32.9 | 173.5 | -64.9 | -168.6 | -147.1 | 0 | 0 | 113.3 | R183 R186 A190 I200 K201 | R183-E197 IonicContact CZ-OE1 2.89Å; R183-E197 VanDerWaalsContact CZ-OE1 3.26Å; R183-E197 IonicContact CZ-OE2 2.68Å; R183-E197 IonicContact NE-OE2 3.63Å; R183-E197 IonicContact NH1-OE1 3.2Å; R183-E197 PolarHBondContact NH1-OE1 3.47Å; R183-E197 IonicContact NH1-OE2 3.45Å; R183-E197 PolarHBondContact NH1-OE2 3.01Å; R183-E197 IonicContact NH2-OE1 3.04Å; R183-E197 PolarHBondContact NH2-OE1 2.91Å; R183-E197 IonicContact NH2-OE2 3.87Å; R183-E197 PolarHBondContact NH2-OE2 3.21Å; R186-E197 HydrophobicContact CG-CB 4.28Å; R186-E197 HydrophobicContact CG-CG 4.49Å; A190-E197 HydrophobicContact CB-CG 4.22Å; E197-I200 PolarHBondContact O-N 3.22Å; E197-K201 WeakPolarHBondContact O-CB 3.42Å; E197-K201 PolarHBondContact O-N 2.92Å |
| 198 | R | 98 | Very high | 98.3 | Very high | 174 Ų | 174 | 63.5 Ų | 63.5 | 66% | 0.657 | 31% | 0.31 | S | S | * | . | H | α-helix | trans | -64.1 | -42.9 | 176 | -176.5 | 179.1 | -177.1 | -82.8 | -2.2 | 111.2 | S196 K201 I202 | S196-R198 PolarHBondContact O-N 3.06Å; R198-K201 WeakPolarHBondContact O-CB 3.36Å; R198-K201 PolarHBondContact O-N 3.39Å; R198-I202 HydrophobicContact CG-CD1 3.92Å; R198-I202 VanDerWaalsContact NH1-CD1 3.26Å; R198-I202 VanDerWaalsContact O-CG1 3.3Å; R198-I202 WeakPolarHBondContact O-CG1 3.4Å; R198-I202 PolarHBondContact O-N 3.34Å |
| 199 | Q | 98.3 | Very high | 98.3 | Very high | 58 Ų | 58 | 65.3 Ų | 65.3 | 27% | 0.271 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -62.9 | -45 | 175.6 | -76 | 163.2 | -53.5 | 0 | 0 | 110.8 | L195 S196 K201 I202 W203 | L195-Q199 HydrophobicContact CB-CB 4.39Å; S196-Q199 WeakPolarHBondContact O-CA 3.28Å; S196-Q199 WeakPolarHBondContact O-CB 3.42Å; S196-Q199 PolarHBondContact O-N 3.02Å; S196-Q199 VanDerWaalsContact OG-CG 3.28Å; S196-Q199 WeakPolarHBondContact OG-CG 3.46Å; S196-Q199 PolarHBondContact OG-N 2.94Å; S196-Q199 PolarHBondContact OG-OE1 3.11Å; Q199-K201 VanDerWaalsContact C-N 3.32Å; Q199-K201 PolarHBondContact O-N 3.14Å; Q199-I202 PolarHBondContact O-N 3.2Å; Q199-W203 WeakPolarHBondContact O-CB 3.39Å; Q199-W203 PolarHBondContact O-N 2.68Å |
| 200 | I | 98.5 | Very high | 98.2 | Very high | 0 Ų | 0 | 70.7 Ų | 70.7 | 0% | 0 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -57.7 | -46.6 | 174.5 | -54 | -58.9 | 0 | 0 | 0 | 110.6 | L171 L181 R186 I189 A190 L195 S196 E197 I202 W203 F204 | L171-I200 HydrophobicContact CD2-CD1 3.77Å; L181-I200 HydrophobicContact CD1-CG2 3.48Å; L181-I200 VanDerWaalsContact CD1-CG2 3.48Å; R186-I200 HydrophobicContact CG-CB 4.12Å; R186-I200 HydrophobicContact CG-CG2 3.96Å; I189-I200 HydrophobicContact CG2-CD1 3.91Å; A190-I200 HydrophobicContact CB-CG1 4.11Å; L195-I200 HydrophobicContact CB-CD1 3.91Å; L195-I200 HydrophobicContact CB-CG1 4.46Å; L195-I200 HydrophobicContact CD1-CD1 3.93Å; S196-I200 PolarHBondContact O-N 3.03Å; S196-I200 VanDerWaalsContact O-N 3.11Å; E197-I200 PolarHBondContact O-N 3.22Å; I200-I202 PolarHBondContact O-N 2.98Å; I200-W203 PolarHBondContact O-N 3.27Å; I200-F204 HydrophobicContact CG2-CD2 4.07Å; I200-F204 HydrophobicContact CG2-CE2 4.26Å; I200-F204 WeakPolarHBondContact O-CD2 3.3Å; I200-F204 PolarHBondContact O-N 3Å |
| 201 | K | 98.3 | Very high | 98.1 | Very high | 105 Ų | 105 | 74.5 Ų | 74.5 | 46% | 0.457 | 36% | 0.356 | S | S | . | . | H | α-helix | trans | -58.1 | -48.8 | 177.6 | -171.4 | 179.6 | 80.2 | 174.4 | 0 | 112.1 | E197 R198 Q199 F204 Q205 | E197-K201 WeakPolarHBondContact O-CB 3.42Å; E197-K201 PolarHBondContact O-N 2.92Å; R198-K201 WeakPolarHBondContact O-CB 3.36Å; R198-K201 PolarHBondContact O-N 3.39Å; Q199-K201 VanDerWaalsContact C-N 3.32Å; Q199-K201 PolarHBondContact O-N 3.14Å; K201-F204 PolarHBondContact O-N 3.01Å; K201-Q205 WeakPolarHBondContact O-CB 3.44Å; K201-Q205 PolarHBondContact O-N 2.88Å |
| 202 | I | 98.4 | Very high | 97.9 | Very high | 58 Ų | 58 | 71.8 Ų | 71.8 | 30% | 0.297 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -65.4 | -42.4 | -179.5 | -70.5 | 169 | 0 | 0 | 0 | 110.5 | R198 Q199 I200 F204 Q205 N206 | R198-I202 HydrophobicContact CG-CD1 3.92Å; R198-I202 VanDerWaalsContact NH1-CD1 3.26Å; R198-I202 VanDerWaalsContact O-CG1 3.3Å; R198-I202 WeakPolarHBondContact O-CG1 3.4Å; R198-I202 PolarHBondContact O-N 3.34Å; Q199-I202 PolarHBondContact O-N 3.2Å; I200-I202 PolarHBondContact O-N 2.98Å; I202-F204 PolarHBondContact O-N 3.4Å; I202-Q205 WeakPolarHBondContact O-CB 3.49Å; I202-Q205 PolarHBondContact O-N 3.11Å; I202-N206 VanDerWaalsContact O-CG 3.28Å; I202-N206 PolarHBondContact O-N 3.28Å; I202-N206 PolarHBondContact O-ND2 3.11Å |
| 203 | W | 98.5 | Very high | 97.7 | Very high | 30 Ų | 30 | 74.3 Ų | 74.3 | 11% | 0.114 | 34% | 0.344 | C | S | . | . | H | α-helix | trans | -60.6 | -47.6 | 178.3 | -168.4 | 101.2 | 0 | 0 | 0 | 111.2 | Y163 L171 E172 F175 Q199 I200 Q205 N206 R207 | Y163-W203 AromaticContact CD2-CD1 3.85Å; Y163-W203 AromaticContact CE2-CD1 3.62Å; L171-W203 HydrophobicContact CB-CD2 3.94Å; L171-W203 HydrophobicContact CB-CE3 3.93Å; L171-W203 HydrophobicContact CB-CH2 3.63Å; L171-W203 HydrophobicContact CB-CZ2 3.61Å; L171-W203 HydrophobicContact CB-CZ3 3.78Å; L171-W203 HydrophobicContact CD1-CD2 3.86Å; L171-W203 HydrophobicContact CD1-CG 3.83Å; L171-W203 HydrophobicContact CD1-CZ2 4.48Å; L171-W203 HydrophobicContact CD2-CD2 4.4Å; L171-W203 HydrophobicContact CD2-CE3 4.33Å; L171-W203 HydrophobicContact CG-CD2 4.3Å; L171-W203 WeakPolarHBondContact O-CZ3 3.48Å; E172-W203 HydrophobicContact CG-CH2 3.91Å; E172-W203 HydrophobicContact CG-CZ2 4.02Å; F175-W203 HydrophobicContact CB-CH2 4.43Å; F175-W203 HydrophobicContact CB-CZ3 4.11Å; Q199-W203 WeakPolarHBondContact O-CB 3.39Å; Q199-W203 PolarHBondContact O-N 2.68Å; I200-W203 PolarHBondContact O-N 3.27Å; W203-Q205 VanDerWaalsContact C-N 3.32Å; W203-Q205 PolarHBondContact O-N 3.34Å; W203-N206 PolarHBondContact O-N 3.14Å; W203-R207 HydrophobicContact CE3-CB 3.92Å; W203-R207 HydrophobicContact CE3-CG 4.46Å; W203-R207 HydrophobicContact CH2-CB 4.08Å; W203-R207 HydrophobicContact CH2-CG 3.79Å; W203-R207 HydrophobicContact CZ3-CB 3.66Å; W203-R207 HydrophobicContact CZ3-CG 3.7Å; W203-R207 WeakPolarHBondContact O-CB 3.46Å; W203-R207 PolarHBondContact O-N 3.2Å |
| 204 | F | 98.7 | Very high | 97.4 | Very high | 8 Ų | 8 | 77.9 Ų | 77.9 | 4% | 0.035 | 36% | 0.364 | C | S | . | . | H | α-helix | trans | -65.3 | -32.6 | 176.5 | -90.7 | -104 | 0 | 0 | 0 | 113 | L171 E174 F175 L181 I200 K201 I202 R208 | L171-F204 HydrophobicContact CD2-CE2 4.06Å; E174-F204 HydrophobicContact CB-CZ 4.06Å; F175-F204 HydrophobicContact CB-CE1 4.18Å; F175-F204 HydrophobicContact CB-CZ 4.27Å; F175-F204 AromaticContact CD2-CD1 3.96Å; F175-F204 HydrophobicContact CD2-CD1 3.96Å; F175-F204 AromaticContact CD2-CE1 3.89Å; F175-F204 HydrophobicContact CD2-CE1 3.89Å; L181-F204 HydrophobicContact CD1-CD1 4.17Å; L181-F204 HydrophobicContact CD1-CD2 3.65Å; L181-F204 HydrophobicContact CD1-CE1 3.96Å; L181-F204 HydrophobicContact CD1-CE2 3.45Å; L181-F204 VanDerWaalsContact CD1-CE2 3.45Å; L181-F204 HydrophobicContact CD1-CG 4.03Å; L181-F204 HydrophobicContact CD1-CZ 3.61Å; L181-F204 HydrophobicContact CD2-CE1 3.75Å; L181-F204 HydrophobicContact CD2-CE2 4.39Å; L181-F204 HydrophobicContact CD2-CZ 3.69Å; L181-F204 HydrophobicContact CG-CD1 3.81Å; L181-F204 HydrophobicContact CG-CD2 4.23Å; L181-F204 HydrophobicContact CG-CE1 3.52Å; L181-F204 HydrophobicContact CG-CE2 3.99Å; L181-F204 HydrophobicContact CG-CG 4.16Å; L181-F204 HydrophobicContact CG-CZ 3.63Å; I200-F204 HydrophobicContact CG2-CD2 4.07Å; I200-F204 HydrophobicContact CG2-CE2 4.26Å; I200-F204 WeakPolarHBondContact O-CD2 3.3Å; I200-F204 PolarHBondContact O-N 3Å; K201-F204 PolarHBondContact O-N 3.01Å; I202-F204 PolarHBondContact O-N 3.4Å; F204-R208 WeakPolarHBondContact O-CB 3.5Å; F204-R208 VanDerWaalsContact O-CG 3.28Å; F204-R208 WeakPolarHBondContact O-CG 3.07Å; F204-R208 PolarHBondContact O-N 3.37Å; F204-R208 PolarHBondContact O-NE 3.24Å |
| 205 | Q | 98.6 | Very high | 96.9 | Very high | 91 Ų | 91 | 77.7 Ų | 77.7 | 43% | 0.425 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -62.6 | -51.5 | 171.7 | -166.3 | 94.6 | 41.2 | 0 | 0 | 110.7 | K201 I202 W203 R207 R208 M209 | K201-Q205 WeakPolarHBondContact O-CB 3.44Å; K201-Q205 PolarHBondContact O-N 2.88Å; I202-Q205 WeakPolarHBondContact O-CB 3.49Å; I202-Q205 PolarHBondContact O-N 3.11Å; W203-Q205 VanDerWaalsContact C-N 3.32Å; W203-Q205 PolarHBondContact O-N 3.34Å; Q205-R207 VanDerWaalsContact C-N 3.34Å; Q205-R207 PolarHBondContact O-N 3.22Å; Q205-R208 PolarHBondContact O-N 3.38Å; Q205-M209 WeakPolarHBondContact O-CG 3.44Å; Q205-M209 PolarHBondContact O-N 2.92Å |
| 206 | N | 98.2 | Very high | 95.7 | Very high | 102 Ų | 102 | 85.7 Ų | 85.7 | 55% | 0.545 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -62.6 | -42.8 | 179.6 | -68.4 | -17.4 | 0 | 0 | 0 | 111.3 | I202 W203 R208 M209 K210 | I202-N206 VanDerWaalsContact O-CG 3.28Å; I202-N206 PolarHBondContact O-N 3.28Å; I202-N206 PolarHBondContact O-ND2 3.11Å; W203-N206 PolarHBondContact O-N 3.14Å; N206-R208 PolarHBondContact O-N 3.46Å; N206-M209 PolarHBondContact O-N 3.06Å; N206-K210 PolarHBondContact O-N 2.66Å |
| 207 | R | 98.3 | Very high | 94 | Very high | 42 Ų | 42 | 89.7 Ų | 89.7 | 16% | 0.158 | 40% | 0.399 | C | S | . | . | H | α-helix | trans | -63.4 | -42.6 | 179.7 | -174 | 64.7 | -173.1 | 116 | -8.1 | 111.9 | F175 W203 Q205 K210 W211 | F175-R207 HydrophobicContact CB-CG 4.41Å; F175-R207 HydrophobicContact CD1-CG 3.73Å; F175-R207 HydrophobicContact CD2-CB 4.19Å; F175-R207 HydrophobicContact CD2-CG 3.58Å; F175-R207 HydrophobicContact CE1-CG 3.8Å; F175-R207 HydrophobicContact CE2-CB 4.18Å; F175-R207 HydrophobicContact CE2-CG 3.66Å; F175-R207 HydrophobicContact CG-CG 3.61Å; F175-R207 HydrophobicContact CZ-CG 3.77Å; W203-R207 HydrophobicContact CE3-CB 3.92Å; W203-R207 HydrophobicContact CE3-CG 4.46Å; W203-R207 HydrophobicContact CH2-CB 4.08Å; W203-R207 HydrophobicContact CH2-CG 3.79Å; W203-R207 HydrophobicContact CZ3-CB 3.66Å; W203-R207 HydrophobicContact CZ3-CG 3.7Å; W203-R207 WeakPolarHBondContact O-CB 3.46Å; W203-R207 PolarHBondContact O-N 3.2Å; Q205-R207 VanDerWaalsContact C-N 3.34Å; Q205-R207 PolarHBondContact O-N 3.22Å; R207-K210 PolarHBondContact O-N 3.27Å; R207-W211 WeakPolarHBondContact O-CB 3.5Å; R207-W211 PolarHBondContact O-N 3Å |
| 208 | R | 98 | Very high | 92.3 | Very high | 64 Ų | 64 | 92.3 Ų | 92.3 | 24% | 0.242 | 42% | 0.421 | C | S | . | . | H | α-helix | trans | -63.2 | -40.5 | 173.7 | -74.9 | -177.7 | -66.6 | 155.1 | -0.2 | 112.3 | F175 R179 F204 Q205 N206 W211 K212 | F175-R208 HydrophobicContact CE2-CG 3.75Å; F175-R208 HydrophobicContact CZ-CG 4.32Å; R179-R208 WeakPolarHBondContact O-CD 3.16Å; F204-R208 WeakPolarHBondContact O-CB 3.5Å; F204-R208 VanDerWaalsContact O-CG 3.28Å; F204-R208 WeakPolarHBondContact O-CG 3.07Å; F204-R208 PolarHBondContact O-N 3.37Å; F204-R208 PolarHBondContact O-NE 3.24Å; Q205-R208 PolarHBondContact O-N 3.38Å; N206-R208 PolarHBondContact O-N 3.46Å; R208-W211 PolarHBondContact O-N 3.29Å; R208-K212 VanDerWaalsContact O-CB 3.25Å; R208-K212 WeakPolarHBondContact O-CB 3.17Å; R208-K212 PolarHBondContact O-N 3.19Å |
| 209 | M | 97.8 | Very high | 90 | Very high | 103 Ų | 103 | 90.5 Ų | 90.5 | 51% | 0.507 | 43% | 0.425 | S | S | . | . | H | α-helix | trans | -62.7 | -43.8 | 175.8 | -71.9 | -58.9 | -148 | 0 | 0 | 112 | Q205 N206 K212 K213 | Q205-M209 WeakPolarHBondContact O-CG 3.44Å; Q205-M209 PolarHBondContact O-N 2.92Å; N206-M209 PolarHBondContact O-N 3.06Å; M209-K212 PolarHBondContact O-N 3.26Å; M209-K213 PolarHBondContact O-N 2.75Å |
| 210 | K | 96.4 | Very high | 87.8 | Confident | 122 Ų | 122 | 94 Ų | 94 | 53% | 0.53 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -61.8 | -50.3 | 174.6 | -177.7 | 177.3 | 177.6 | -173.3 | 0 | 111.3 | N206 R207 K212 K213 D214 | N206-K210 PolarHBondContact O-N 2.66Å; R207-K210 PolarHBondContact O-N 3.27Å; K210-K212 VanDerWaalsContact C-N 3.29Å; K210-K212 PolarHBondContact O-N 3.43Å; K210-K213 WeakPolarHBondContact O-CB 3.17Å; K210-K213 PolarHBondContact O-N 2.94Å; K210-D214 WeakPolarHBondContact CG-OD2 3.22Å; K210-D214 PolarHBondContact O-N 3.05Å |
| 211 | W | 95.8 | Very high | 85.7 | Confident | 84 Ų | 84 | 102.4 Ų | 102.4 | 32% | 0.318 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -55.1 | -45.5 | 176.2 | -177 | 82.1 | 0 | 0 | 0 | 111.7 | F175 R179 R207 R208 K213 D214 H215 | F175-W211 HydrophobicContact CE1-CB 4.28Å; F175-W211 HydrophobicContact CE1-CG 4.23Å; F175-W211 HydrophobicContact CZ-CB 3.99Å; F175-W211 HydrophobicContact CZ-CG 4.12Å; R179-W211 VanDerWaalsContact NE-CE2 3.26Å; R207-W211 WeakPolarHBondContact O-CB 3.5Å; R207-W211 PolarHBondContact O-N 3Å; R208-W211 PolarHBondContact O-N 3.29Å; W211-K213 VanDerWaalsContact C-N 3.31Å; W211-K213 PolarHBondContact O-N 2.99Å; W211-D214 PolarHBondContact O-N 2.83Å; W211-H215 AromaticContact CD1-CD2 3.17Å; W211-H215 AromaticContact CD1-NE2 3.28Å; W211-H215 VanDerWaalsContact CD1-NE2 3.28Å; W211-H215 AromaticContact CD2-CD2 3.78Å; W211-H215 AromaticContact CE2-CD2 3.35Å; W211-H215 AromaticContact CE2-CG 3.9Å; W211-H215 AromaticContact CE2-NE2 3.79Å; W211-H215 AromaticContact CG-CD2 3.66Å; W211-H215 HydrophobicContact CZ2-CB 4.42Å; W211-H215 AromaticContact NE1-CD2 2.9Å; W211-H215 PolarHBondContact NE1-CD2 3.48Å; W211-H215 AromaticContact NE1-CE1 3.85Å; W211-H215 AromaticContact NE1-CG 3.8Å; W211-H215 AromaticContact NE1-NE2 2.91Å; W211-H215 PolarHBondContact NE1-NE2 3.45Å; W211-H215 WeakPolarHBondContact O-CB 3.45Å; W211-H215 PolarHBondContact O-CD2 2.83Å; W211-H215 PolarHBondContact O-N 3.45Å |
| 212 | K | 95.1 | Very high | 83.6 | Confident | 87 Ų | 87 | 103.4 Ų | 103.4 | 38% | 0.378 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -59.1 | -41.5 | 175.8 | -173.3 | -174.6 | 69.8 | 173.6 | 0 | 111.9 | R208 M209 K210 R216 | R208-K212 VanDerWaalsContact O-CB 3.25Å; R208-K212 WeakPolarHBondContact O-CB 3.17Å; R208-K212 PolarHBondContact O-N 3.19Å; M209-K212 PolarHBondContact O-N 3.26Å; K210-K212 VanDerWaalsContact C-N 3.29Å; K210-K212 PolarHBondContact O-N 3.43Å; K212-R216 VanDerWaalsContact CG-CD 3.49Å; K212-R216 HydrophobicContact CG-CG 4.17Å; K212-R216 WeakPolarHBondContact O-CB 3.4Å; K212-R216 WeakPolarHBondContact O-CD 3.5Å; K212-R216 WeakPolarHBondContact O-CG 2.88Å; K212-R216 PolarHBondContact O-N 2.53Å |
| 213 | K | 94.6 | Very high | 81.1 | Confident | 160 Ų | 160 | 112 Ų | 112 | 70% | 0.696 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -66.3 | -46.1 | 177.5 | -176.2 | 177.7 | 176.8 | 178.3 | 0 | 111.3 | M209 K210 W211 H215 | M209-K213 PolarHBondContact O-N 2.75Å; K210-K213 WeakPolarHBondContact O-CB 3.17Å; K210-K213 PolarHBondContact O-N 2.94Å; W211-K213 VanDerWaalsContact C-N 3.31Å; W211-K213 PolarHBondContact O-N 2.99Å; K213-H215 VanDerWaalsContact C-N 3.34Å; K213-H215 PolarHBondContact O-N 3.43Å |
| 214 | D | 91.6 | Very high | 78.6 | Confident | 85 Ų | 85 | 115.3 Ų | 115.3 | 46% | 0.455 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -68.6 | -31.9 | -175.6 | -58.5 | -16 | 0 | 0 | 0 | 112 | K210 W211 | K210-D214 WeakPolarHBondContact CG-OD2 3.22Å; K210-D214 PolarHBondContact O-N 3.05Å; W211-D214 PolarHBondContact O-N 2.83Å |
| 215 | H | 86.8 | Confident | 76.2 | Confident | 122 Ų | 122 | 120.7 Ų | 120.7 | 57% | 0.565 | 60% | 0.596 | S | S | * | * | H | α-helix | trans | -101.3 | -2.3 | -176.3 | -70.3 | -79.1 | 0 | 0 | 0 | 115.6 | W211 K213 | W211-H215 AromaticContact CD1-CD2 3.17Å; W211-H215 AromaticContact CD1-NE2 3.28Å; W211-H215 VanDerWaalsContact CD1-NE2 3.28Å; W211-H215 AromaticContact CD2-CD2 3.78Å; W211-H215 AromaticContact CE2-CD2 3.35Å; W211-H215 AromaticContact CE2-CG 3.9Å; W211-H215 AromaticContact CE2-NE2 3.79Å; W211-H215 AromaticContact CG-CD2 3.66Å; W211-H215 HydrophobicContact CZ2-CB 4.42Å; W211-H215 AromaticContact NE1-CD2 2.9Å; W211-H215 PolarHBondContact NE1-CD2 3.48Å; W211-H215 AromaticContact NE1-CE1 3.85Å; W211-H215 AromaticContact NE1-CG 3.8Å; W211-H215 AromaticContact NE1-NE2 2.91Å; W211-H215 PolarHBondContact NE1-NE2 3.45Å; W211-H215 WeakPolarHBondContact O-CB 3.45Å; W211-H215 PolarHBondContact O-CD2 2.83Å; W211-H215 PolarHBondContact O-N 3.45Å; K213-H215 VanDerWaalsContact C-N 3.34Å; K213-H215 PolarHBondContact O-N 3.43Å |
| 216 | R | 73.6 | Confident | 73.4 | Confident | 187 Ų | 187 | 120.8 Ų | 120.8 | 71% | 0.706 | 61% | 0.607 | S | S | * | * | S | Bend | trans | -95.9 | 1.8 | 177.4 | -77 | -174.1 | 177.4 | -132 | -3.9 | 114.5 | K212 P218 | K212-R216 VanDerWaalsContact CG-CD 3.49Å; K212-R216 HydrophobicContact CG-CG 4.17Å; K212-R216 WeakPolarHBondContact O-CB 3.4Å; K212-R216 WeakPolarHBondContact O-CD 3.5Å; K212-R216 WeakPolarHBondContact O-CG 2.88Å; K212-R216 PolarHBondContact O-N 2.53Å; R216-P218 WeakPolarHBondContact O-CD 3.41Å |
| 217 | L | 61.6 | Low | 70.9 | Confident | 141 Ų | 141 | 121 Ų | 121 | 74% | 0.738 | 62% | 0.616 | S | S | * | * | S | Bend | trans | -92.6 | 103 | 168.4 | -67.6 | 165.5 | 0 | 0 | 0 | 107.6 | N219 | L217-N219 PolarHBondContact O-N 3.29Å; L217-N219 VanDerWaalsContact O-N 3.14Å |
| 218 | P | 62.5 | Low | 68.2 | Low | 116 Ų | 116 | 124.8 Ų | 124.8 | 75% | 0.753 | 65% | 0.649 | S | S | * | * | trans | -65.8 | 114.7 | 168.3 | 27.6 | -31.4 | 0 | 0 | 0 | 108.3 | R216 T220 | R216-P218 WeakPolarHBondContact O-CD 3.41Å; P218-T220 PolarHBondContact O-N 3.22Å | ||
| 219 | N | 51.1 | Low | 65.4 | Low | 136 Ų | 136 | 126.6 Ų | 126.6 | 73% | 0.727 | 67% | 0.672 | S | S | * | * | trans | 40.8 | 75 | 143.7 | -162.9 | 71.9 | 0 | 0 | 0 | 116.8 | L217 | L217-N219 PolarHBondContact O-N 3.29Å; L217-N219 VanDerWaalsContact O-N 3.14Å | ||
| 220 | T | 52.2 | Low | 62.8 | Low | 131 Ų | 131 | 127.3 Ų | 127.3 | 80% | 0.804 | 69% | 0.687 | S | S | * | * | trans | -97.6 | 79.6 | 144.2 | 56.8 | 0 | 0 | 0 | 0 | 108.1 | P218 V222 | P218-T220 PolarHBondContact O-N 3.22Å; T220-V222 PolarHBondContact O-N 2.69Å | ||
| 221 | K | 54 | Low | 60 | Low | 177 Ų | 177 | 126.9 Ų | 126.9 | 77% | 0.77 | 70% | 0.699 | S | S | * | * | trans | -60.5 | 79.9 | 157.7 | 176.7 | 94.7 | 176.9 | -170.4 | 0 | 107.9 | ||||
| 222 | V | 54.2 | Low | 57.5 | Low | 125 Ų | 125 | 128.1 Ų | 128.1 | 76% | 0.758 | 72% | 0.721 | S | S | * | * | trans | -170.6 | 75.9 | 157.6 | -92.8 | 0 | 0 | 0 | 0 | 109.8 | T220 | T220-V222 PolarHBondContact O-N 2.69Š| ||
| 223 | R | 45.8 | Very low | 54.8 | Low | 240 Ų | 240 | 129.9 Ų | 129.9 | 91% | 0.906 | 74% | 0.744 | S | S | * | * | -167.4 | 85.4 | 129.7 | -147.9 | 90.3 | 168.4 | -153.1 | -2.9 | 107.3 | S225 | R223-S225 PolarHBondContact O-N 2.91Š| |||
| 224 | S | 46.8 | Very low | 52.1 | Low | 99 Ų | 99 | 126 Ų | 126 | 69% | 0.692 | 75% | 0.749 | S | S | * | * | trans | -47.7 | 112 | 157.5 | -29.9 | 0 | 0 | 0 | 0 | 107.8 | S226 | S224-S226 PolarHBondContact O-N 3.22Å; S224-S226 VanDerWaalsContact O-N 3.16Å | ||
| 225 | S | 47.2 | Very low | 49.5 | Very low | 120 Ų | 120 | 127.9 Ų | 127.9 | 84% | 0.839 | 77% | 0.769 | S | S | * | * | trans | -81.1 | 67.2 | 151.3 | 60.6 | 0 | 0 | 0 | 0 | 106.8 | R223 S227 | R223-S225 PolarHBondContact O-N 2.91Å; S225-S227 PolarHBondContact O-N 3.12Å | ||
| 226 | S | 40.9 | Very low | 47.2 | Very low | 93 Ų | 93 | 129.8 Ų | 129.8 | 65% | 0.65 | 78% | 0.784 | S | S | * | * | trans | -69.5 | 101.3 | 157.7 | 49.9 | 0 | 0 | 0 | 0 | 105.9 | S224 S228 | S224-S226 PolarHBondContact O-N 3.22Å; S224-S226 VanDerWaalsContact O-N 3.16Å; S226-S228 VanDerWaalsContact C-N 3.35Å; S226-S228 PolarHBondContact O-N 2.93Å | ||
| 227 | S | 44 | Very low | 45.6 | Very low | 107 Ų | 107 | 127.9 Ų | 127.9 | 75% | 0.748 | 79% | 0.793 | S | S | * | * | trans | -53.7 | 105 | 155.5 | 47.7 | 0 | 0 | 0 | 0 | 107.4 | S225 S229 | S225-S227 PolarHBondContact O-N 3.12Å; S227-S229 PolarHBondContact O-N 3.23Å | ||
| 228 | S | 41.6 | Very low | 44.4 | Very low | 121 Ų | 121 | 124.6 Ų | 124.6 | 85% | 0.846 | 79% | 0.793 | S | S | * | * | trans | -56.1 | 99.8 | 170.5 | 46.7 | 0 | 0 | 0 | 0 | 109.2 | S226 | S226-S228 VanDerWaalsContact C-N 3.35Å; S226-S228 PolarHBondContact O-N 2.93Å | ||
| 229 | S | 40.7 | Very low | 43.2 | Very low | 103 Ų | 103 | 124.7 Ų | 124.7 | 72% | 0.72 | 80% | 0.796 | S | S | * | * | trans | -107.8 | 109.9 | 155.1 | 45.7 | 0 | 0 | 0 | 0 | 106.7 | S227 S231 | S227-S229 PolarHBondContact O-N 3.23Å; S229-S231 PolarHBondContact O-N 3.26Å | ||
| 230 | S | 42 | Very low | 42.5 | Very low | 118 Ų | 118 | 123 Ų | 123 | 83% | 0.825 | 80% | 0.802 | S | S | * | * | trans | -59.5 | 120.9 | 166.4 | 45.7 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 231 | S | 38.4 | Very low | 41.9 | Very low | 112 Ų | 112 | 121.5 Ų | 121.5 | 78% | 0.783 | 80% | 0.802 | S | S | * | * | trans | -163.1 | 117.1 | 141.4 | 16.4 | 0 | 0 | 0 | 0 | 110.2 | S229 | S229-S231 PolarHBondContact O-N 3.26Š| ||
| 232 | S | 42.2 | Very low | 40.8 | Very low | 111 Ų | 111 | 117 Ų | 117 | 78% | 0.776 | 81% | 0.806 | S | S | * | * | trans | -44.5 | 137.5 | 162.4 | 46.5 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 233 | S | 38.5 | Very low | 39.9 | Very low | 123 Ų | 123 | 114.4 Ų | 114.4 | 86% | 0.86 | 81% | 0.805 | S | S | * | * | -176.6 | 122.3 | 129.2 | -75.6 | 0 | 0 | 0 | 0 | 109 | |||||
| 234 | G | 37.6 | Very low | 39.6 | Very low | 79 Ų | 79 | 110.5 Ų | 110.5 | 81% | 0.814 | 81% | 0.807 | S | S | * | * | trans | -88.2 | 161.4 | -179.1 | 0 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 235 | S | 38.2 | Very low | 39.2 | Very low | 125 Ų | 125 | 110.6 Ų | 110.6 | 87% | 0.874 | 81% | 0.814 | S | S | * | * | trans | -168.3 | 118.9 | 147.3 | 44.8 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 236 | N | 39.3 | Very low | 38.6 | Very low | 162 Ų | 162 | 108.9 Ų | 108.9 | 87% | 0.866 | 81% | 0.807 | S | S | * | * | trans | -61 | 144.9 | 169.6 | -72.5 | -24.4 | 0 | 0 | 0 | 111.7 | ||||
| 237 | T | 38.3 | Very low | 38.6 | Very low | 146 Ų | 146 | 111 Ų | 111 | 90% | 0.896 | 82% | 0.816 | S | S | * | * | trans | -159.4 | 122.5 | 131.3 | 47.5 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 238 | G | 37.6 | Very low | 38.2 | Very low | 72 Ų | 72 | 111.2 Ų | 111.2 | 74% | 0.742 | 82% | 0.817 | S | S | * | * | trans | -98.1 | 162.7 | 174.3 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 239 | S | 37.6 | Very low | 38 | Very low | 118 Ų | 118 | 109.8 Ų | 109.8 | 83% | 0.825 | 81% | 0.813 | S | S | * | * | trans | 172.2 | 110.9 | 148.9 | -76.5 | 0 | 0 | 0 | 0 | 106.2 | ||||
| 240 | A | 36.4 | Very low | 37.9 | Very low | 102 Ų | 102 | 111 Ų | 111 | 84% | 0.843 | 82% | 0.817 | S | S | * | * | 50.9 | 135.4 | 75.6 | 0 | 0 | 0 | 0 | 0 | 112.7 | |||||
| 241 | A | 37.7 | Very low | 37.8 | Very low | 98 Ų | 98 | 109.8 Ų | 109.8 | 81% | 0.81 | 81% | 0.808 | S | S | * | * | cis | -176.2 | 160.4 | -9.4 | 0 | 0 | 0 | 0 | 0 | 106.7 | ||||
| 242 | G | 32.1 | Very low | 37.9 | Very low | 83 Ų | 83 | 111.4 Ų | 111.4 | 86% | 0.856 | 81% | 0.813 | S | S | * | * | trans | 78.2 | 132.9 | 160.4 | 0 | 0 | 0 | 0 | 0 | 115.8 | ||||
| 243 | G | 34.6 | Very low | 37.6 | Very low | 70 Ų | 70 | 110 Ų | 110 | 72% | 0.722 | 82% | 0.816 | S | S | * | * | cis | 107.8 | 115 | 27.1 | 0 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 244 | V | 40.2 | Very low | 37.7 | Very low | 158 Ų | 158 | 108.8 Ų | 108.8 | 96% | 0.958 | 81% | 0.814 | S | S | * | * | trans | 167.8 | 150.2 | 136.1 | -82 | 0 | 0 | 0 | 0 | 112 | ||||
| 245 | A | 37.3 | Very low | 38.6 | Very low | 101 Ų | 101 | 111.1 Ų | 111.1 | 84% | 0.835 | 81% | 0.814 | S | S | * | * | trans | -87.6 | 164.1 | -179 | 0 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 246 | A | 35.9 | Very low | 38.9 | Very low | 85 Ų | 85 | 112 Ų | 112 | 70% | 0.702 | 81% | 0.81 | S | S | * | * | trans | 164.2 | 110.5 | 145 | 0 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 247 | V | 39.4 | Very low | 39 | Very low | 136 Ų | 136 | 111.7 Ų | 111.7 | 82% | 0.824 | 80% | 0.803 | S | S | * | * | 65.3 | 124.8 | 91 | -57.5 | 0 | 0 | 0 | 0 | 117.9 | |||||
| 248 | S | 36 | Very low | 39.1 | Very low | 112 Ų | 112 | 111.1 Ų | 111.1 | 78% | 0.783 | 79% | 0.793 | S | S | * | * | trans | 97.6 | 118.1 | 142.3 | -57.6 | 0 | 0 | 0 | 0 | 122.1 | ||||
| 249 | A | 37.4 | Very low | 39.5 | Very low | 92 Ų | 92 | 114.6 Ų | 114.6 | 76% | 0.76 | 80% | 0.8 | S | S | * | * | trans | 63.8 | 144.5 | 138.9 | 0 | 0 | 0 | 0 | 0 | 118.1 | ||||
| 250 | T | 38.6 | Very low | 39.5 | Very low | 129 Ų | 129 | 112 Ų | 112 | 79% | 0.791 | 79% | 0.793 | S | S | * | * | cis | -165.9 | 160 | 39.6 | -56.3 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 251 | S | 40.4 | Very low | 39.8 | Very low | 91 Ų | 91 | 111.7 Ų | 111.7 | 64% | 0.636 | 79% | 0.79 | S | S | * | * | trans | -48.6 | 152.5 | 173.7 | 54.6 | 0 | 0 | 0 | 0 | 118.8 | ||||
| 252 | T | 40.8 | Very low | 40.2 | Very low | 147 Ų | 147 | 116.8 Ų | 116.8 | 90% | 0.902 | 80% | 0.797 | S | S | * | * | trans | 147.2 | 130 | 140.4 | 37.2 | 0 | 0 | 0 | 0 | 107.4 | ||||
| 253 | G | 35.1 | Very low | 40.6 | Very low | 82 Ų | 82 | 120.7 Ų | 120.7 | 85% | 0.845 | 79% | 0.792 | S | S | * | * | cis | 126.6 | 101.1 | 34.8 | 0 | 0 | 0 | 0 | 0 | 105.5 | ||||
| 254 | A | 41 | Very low | 41 | Very low | 97 Ų | 97 | 120.9 Ų | 120.9 | 80% | 0.802 | 80% | 0.795 | S | S | * | * | trans | -153.4 | 160.2 | -179.3 | 0 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 255 | P | 56.7 | Low | 41.7 | Very low | 128 Ų | 128 | 120 Ų | 120 | 83% | 0.831 | 78% | 0.78 | S | S | * | * | cis | -124.1 | 162.1 | -29.2 | 33.1 | -16.9 | 0 | 0 | 0 | 112.7 | ||||
| 256 | D | 45.4 | Very low | 42.1 | Very low | 144 Ų | 144 | 122.3 Ų | 122.3 | 77% | 0.77 | 78% | 0.778 | S | S | * | * | trans | -83.5 | 156.9 | 176.1 | -145.2 | -26.3 | 0 | 0 | 0 | 112.4 | ||||
| 257 | E | 40.4 | Very low | 42.5 | Very low | 154 Ų | 154 | 124.7 Ų | 124.7 | 72% | 0.72 | 78% | 0.778 | S | S | * | * | trans | -20.3 | 168.8 | 166.9 | -83 | -154.9 | 88.9 | 0 | 0 | 120.5 | ||||
| 258 | L | 40.3 | Very low | 43.1 | Very low | 134 Ų | 134 | 124.1 Ų | 124.1 | 70% | 0.702 | 78% | 0.775 | S | S | * | * | cis | 169.1 | 130.7 | -14.2 | -163.4 | 117.7 | 0 | 0 | 0 | 105.1 | ||||
| 259 | T | 45.9 | Very low | 43.7 | Very low | 145 Ų | 145 | 130.4 Ų | 130.4 | 89% | 0.89 | 78% | 0.781 | S | S | * | * | trans | -156.3 | 104.8 | 153.6 | 48.3 | 0 | 0 | 0 | 0 | 106 | ||||
| 260 | G | 38.5 | Very low | 44 | Very low | 65 Ų | 65 | 137.5 Ų | 137.5 | 67% | 0.67 | 81% | 0.805 | S | S | * | * | 91.8 | 79.2 | 87.5 | 0 | 0 | 0 | 0 | 0 | 109.4 | |||||
| 261 | A | 42.3 | Very low | 44.3 | Very low | 94 Ų | 94 | 137.9 Ų | 137.9 | 78% | 0.777 | 81% | 0.806 | S | S | * | * | 66.8 | 106.8 | 98.6 | 0 | 0 | 0 | 0 | 0 | 114 | |||||
| 262 | Q | 45.1 | Very low | 44.5 | Very low | 205 Ų | 205 | 140.4 Ų | 140.4 | 96% | 0.958 | 82% | 0.815 | S | S | * | * | trans | -151.1 | 126.7 | 135 | -106.7 | 171.8 | 48.9 | 0 | 0 | 110.5 | ||||
| 263 | H | 40.4 | Very low | 44.7 | Very low | 165 Ų | 165 | 140 Ų | 140 | 76% | 0.764 | 81% | 0.81 | S | S | * | * | trans | -85.5 | 149 | -170.5 | 175.5 | 79.1 | 0 | 0 | 0 | 110.3 | E265 | H263-E265 IonicContact CE1-OE1 4Å; H263-E265 PolarHBondContact CE1-OE1 3.18Å; H263-E265 IonicContact ND1-OE1 2.82Å | ||
| 264 | G | 43.3 | Very low | 45.3 | Very low | 75 Ų | 75 | 143.4 Ų | 143.4 | 77% | 0.773 | 81% | 0.808 | S | S | * | * | trans | 171.9 | 74 | 178.1 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 265 | E | 54.8 | Low | 45.6 | Very low | 140 Ų | 140 | 146.3 Ų | 146.3 | 65% | 0.654 | 81% | 0.808 | S | S | * | * | trans | -83.7 | 138 | 178.5 | -48.8 | -173.9 | -178.1 | 0 | 0 | 110.5 | H263 | H263-E265 IonicContact CE1-OE1 4Å; H263-E265 PolarHBondContact CE1-OE1 3.18Å; H263-E265 IonicContact ND1-OE1 2.82Å | ||
| 266 | D | 46.1 | Very low | 44.8 | Very low | 148 Ų | 148 | 147.5 Ų | 147.5 | 79% | 0.791 | 81% | 0.807 | S | S | * | * | trans | 175.5 | 102.8 | 139.4 | -106.2 | -35.7 | 0 | 0 | 0 | 106.9 | ||||
| 267 | I | 45.3 | Very low | 44.8 | Very low | 135 Ų | 135 | 147.8 Ų | 147.8 | 69% | 0.692 | 81% | 0.81 | S | S | * | * | 43.5 | 103.5 | 75.7 | -54 | 179.4 | 0 | 0 | 0 | 109.4 | |||||
| 268 | T | 51.2 | Low | 45.1 | Very low | 124 Ų | 124 | 147.3 Ų | 147.3 | 76% | 0.761 | 82% | 0.816 | S | S | * | * | -156.3 | 117.8 | 91.9 | -52.4 | 0 | 0 | 0 | 0 | 110.4 | |||||
| 269 | R | 48.9 | Very low | 45.5 | Very low | 244 Ų | 244 | 148.4 Ų | 148.4 | 92% | 0.921 | 83% | 0.826 | S | S | * | * | trans | -82.6 | 126.8 | 158.2 | -86.7 | 179.5 | 158 | 147.1 | -3.9 | 108.3 | ||||
| 270 | L | 44.3 | Very low | 45.5 | Very low | 241 Ų | 241 | 148.7 Ų | 148.7 | 100% | 1.262 | 82% | 0.82 | S | S | * | * | trans | -145.9 | 0 | 144.5 | -104.2 | 156.4 | 0 | 0 | 0 | 107 |
Retrieved 270 of 270 residues in 94.8 ms
(Link to these results)