| 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 | 34.2 | Very low | 45.4 | Very low | 218 Ų | 218 | 141.7 Ų | 141.7 | 100% | 1.074 | 78% | 0.779 | S | S | * | * | 0 | 115.4 | 0 | -165.5 | 155.9 | -176.8 | 0 | 0 | 106.1 | |||||
| 2 | E | 42.6 | Very low | 44.4 | Very low | 133 Ų | 133 | 145.4 Ų | 145.4 | 62% | 0.621 | 78% | 0.775 | S | S | * | * | trans | 68.4 | 150.7 | 160.2 | -54.4 | -172.1 | 129.7 | 0 | 0 | 118 | ||||
| 3 | R | 40.3 | Very low | 44.1 | Very low | 206 Ų | 206 | 141.2 Ų | 141.2 | 78% | 0.777 | 76% | 0.757 | S | S | * | * | cis | -153.4 | 164.7 | -11.8 | -119.8 | 179.7 | -101.7 | 134.6 | -12.9 | 109.5 | ||||
| 4 | I | 54.5 | Low | 44 | Very low | 153 Ų | 153 | 140.4 Ų | 140.4 | 79% | 0.785 | 76% | 0.763 | S | S | * | * | trans | -77.3 | 150.6 | -177 | -57.4 | 149.8 | 0 | 0 | 0 | 111.7 | ||||
| 5 | T | 44.1 | Very low | 43.5 | Very low | 145 Ų | 145 | 141.3 Ų | 141.3 | 89% | 0.89 | 76% | 0.757 | S | S | * | * | trans | -140.9 | 146.7 | 146.5 | -50.5 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 6 | S | 42.2 | Very low | 43.2 | Very low | 99 Ų | 99 | 142.9 Ų | 142.9 | 69% | 0.692 | 76% | 0.758 | S | S | * | * | trans | -128 | 167.8 | -173.8 | 79.3 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 7 | A | 42.3 | Very low | 42.6 | Very low | 80 Ų | 80 | 139.6 Ų | 139.6 | 66% | 0.661 | 76% | 0.756 | S | S | * | * | trans | 71.7 | 113.4 | 150.1 | 0 | 0 | 0 | 0 | 0 | 122.4 | ||||
| 8 | Q | 35.8 | Very low | 42.2 | Very low | 189 Ų | 189 | 137.2 Ų | 137.2 | 88% | 0.883 | 75% | 0.751 | S | S | * | * | 95 | 148.8 | 123 | -81 | -168.5 | -99.8 | 0 | 0 | 124.1 | |||||
| 9 | P | 62.4 | Low | 42 | Very low | 104 Ų | 104 | 139.8 Ų | 139.8 | 68% | 0.675 | 76% | 0.76 | S | S | * | * | trans | -100.1 | -178.5 | -175.8 | 45.2 | -39.1 | 0 | 0 | 0 | 112.5 | ||||
| 10 | P | 54.1 | Low | 41.7 | Very low | 118 Ų | 118 | 140.3 Ų | 140.3 | 77% | 0.766 | 76% | 0.762 | S | S | * | * | -148 | -147.3 | 84.6 | 41.7 | -20.7 | 0 | 0 | 0 | 110.9 | |||||
| 11 | P | 46.4 | Very low | 41.7 | Very low | 114 Ų | 114 | 141.5 Ų | 141.5 | 74% | 0.74 | 77% | 0.766 | S | S | * | * | cis | -136.8 | 147.7 | -14.9 | 37.9 | -18.4 | 0 | 0 | 0 | 118.6 | ||||
| 12 | Y | 33.8 | Very low | 42.4 | Very low | 186 Ų | 186 | 136.1 Ų | 136.1 | 73% | 0.729 | 75% | 0.747 | S | S | * | * | trans | 56 | 107.2 | 131.4 | -148.2 | -91.4 | 0 | 0 | 0 | 125.7 | ||||
| 13 | V | 40.9 | Very low | 42.6 | Very low | 91 Ų | 91 | 135.2 Ų | 135.2 | 55% | 0.552 | 75% | 0.747 | S | S | * | * | trans | 2.4 | 151.8 | 141.8 | -120.4 | 0 | 0 | 0 | 0 | 123 | ||||
| 14 | P | 42.2 | Very low | 42.6 | Very low | 129 Ų | 129 | 133.2 Ų | 133.2 | 84% | 0.838 | 75% | 0.749 | S | S | * | * | -122.1 | 166.4 | 109.8 | -6.1 | 26.8 | 0 | 0 | 0 | 118.2 | |||||
| 15 | K | 37 | Very low | 42.4 | Very low | 154 Ų | 154 | 135.4 Ų | 135.4 | 67% | 0.67 | 75% | 0.747 | S | S | * | * | trans | -90.5 | 174.6 | -170.6 | -54.7 | 160.4 | 175.8 | 176.5 | 0 | 112.2 | ||||
| 16 | H | 37.7 | Very low | 42.3 | Very low | 167 Ų | 167 | 138.1 Ų | 138.1 | 77% | 0.773 | 74% | 0.741 | S | S | * | * | cis | -165.2 | 171.6 | 36.9 | -118.9 | -70.7 | 0 | 0 | 0 | 114.2 | ||||
| 17 | A | 33 | Very low | 42.5 | Very low | 87 Ų | 87 | 141.5 Ų | 141.5 | 72% | 0.719 | 75% | 0.75 | S | S | * | * | trans | 98.7 | 80.3 | 166.3 | 0 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 18 | S | 36.7 | Very low | 42.5 | Very low | 97 Ų | 97 | 144 Ų | 144 | 68% | 0.678 | 75% | 0.748 | S | S | * | * | 72.1 | 100.1 | 62.6 | 82.1 | 0 | 0 | 0 | 0 | 116.5 | |||||
| 19 | M | 37 | Very low | 43 | Very low | 186 Ų | 186 | 145.1 Ų | 145.1 | 92% | 0.916 | 75% | 0.746 | S | S | * | * | trans | -145.8 | 133.2 | 135.7 | -81.5 | -130.2 | 75.5 | 0 | 0 | 108 | ||||
| 20 | D | 36.6 | Very low | 42.1 | Very low | 149 Ų | 149 | 145.7 Ų | 145.7 | 80% | 0.797 | 75% | 0.75 | S | S | * | * | trans | -84.7 | 143.1 | -166.9 | -58.3 | -80.3 | 0 | 0 | 0 | 113.9 | ||||
| 21 | I | 41.3 | Very low | 42 | Very low | 166 Ų | 166 | 147.1 Ų | 147.1 | 85% | 0.851 | 75% | 0.749 | S | S | * | * | trans | -120.1 | 110.8 | 164.1 | -61.6 | 169.7 | 0 | 0 | 0 | 106.6 | ||||
| 22 | P | 50.2 | Low | 42.2 | Very low | 105 Ų | 105 | 152.4 Ų | 152.4 | 68% | 0.682 | 76% | 0.756 | S | S | * | * | trans | -77.4 | 127.3 | -177.1 | 28.4 | -32.6 | 0 | 0 | 0 | 112.6 | M24 | P22-M24 PolarHBondContact O-N 3.08Å; P22-M24 VanDerWaalsContact O-N 3.07Å | ||
| 23 | D | 45.1 | Very low | 42.9 | Very low | 114 Ų | 114 | 150.2 Ų | 150.2 | 61% | 0.61 | 75% | 0.754 | S | S | * | * | trans | -62.9 | 97.7 | 166 | 174.8 | 23 | 0 | 0 | 0 | 110.2 | R25 | D23-R25 PolarHBondContact O-N 3.13Å; D23-R25 WeakPolarHBondContact OD1-CG 3.46Å; D23-R25 IonicContact OD2-CZ 3.67Å; D23-R25 IonicContact OD2-NE 2.91Å; D23-R25 PolarHBondContact OD2-NE 3.24Å; D23-R25 IonicContact OD2-NH2 3.54Å | ||
| 24 | M | 42 | Very low | 43.2 | Very low | 165 Ų | 165 | 151.5 Ų | 151.5 | 81% | 0.813 | 77% | 0.766 | S | S | * | * | trans | -97.3 | 80.3 | 171.6 | -72.6 | -66.3 | -88.5 | 0 | 0 | 110.6 | P22 | P22-M24 PolarHBondContact O-N 3.08Å; P22-M24 VanDerWaalsContact O-N 3.07Å | ||
| 25 | R | 49.3 | Very low | 43.3 | Very low | 199 Ų | 199 | 153.2 Ų | 153.2 | 75% | 0.751 | 76% | 0.76 | S | S | * | * | trans | -53.4 | 156.4 | 163.1 | -57.7 | 178.9 | -177.5 | -162.7 | -5.6 | 110.7 | D23 | D23-R25 PolarHBondContact O-N 3.13Å; D23-R25 WeakPolarHBondContact OD1-CG 3.46Å; D23-R25 IonicContact OD2-CZ 3.67Å; D23-R25 IonicContact OD2-NE 2.91Å; D23-R25 PolarHBondContact OD2-NE 3.24Å; D23-R25 IonicContact OD2-NH2 3.54Å | ||
| 26 | R | 42.1 | Very low | 43.6 | Very low | 201 Ų | 201 | 150.7 Ų | 150.7 | 76% | 0.758 | 76% | 0.762 | S | S | * | * | trans | 70.8 | 83.3 | 168.2 | -160.7 | -168.4 | -124 | -145.2 | 8.3 | 113.6 | E28 | R26-E28 WeakPolarHBondContact CD-OE2 3.5Å; R26-E28 HydrophobicContact CG-CB 4.29Å; R26-E28 IonicContact CZ-OE2 3.63Å; R26-E28 IonicContact NE-OE2 3.88Å; R26-E28 IonicContact NH1-OE2 2.69Å; R26-E28 PolarHBondContact NH1-OE2 3.31Å; R26-E28 PolarHBondContact O-N 3.3Å | ||
| 27 | L | 47.3 | Very low | 44.4 | Very low | 170 Ų | 170 | 154.2 Ų | 154.2 | 89% | 0.89 | 77% | 0.768 | S | S | * | * | trans | -64.5 | 85 | 149.8 | -81.1 | 96.7 | 0 | 0 | 0 | 108.5 | Y29 | L27-Y29 PolarHBondContact O-N 2.85Š| ||
| 28 | E | 42.7 | Very low | 45.5 | Very low | 133 Ų | 133 | 162.3 Ų | 162.3 | 62% | 0.621 | 78% | 0.78 | S | S | * | * | trans | -67.7 | 113 | 167.2 | -166.2 | 160.5 | 141 | 0 | 0 | 107.5 | R26 P30 | R26-E28 WeakPolarHBondContact CD-OE2 3.5Å; R26-E28 HydrophobicContact CG-CB 4.29Å; R26-E28 IonicContact CZ-OE2 3.63Å; R26-E28 IonicContact NE-OE2 3.88Å; R26-E28 IonicContact NH1-OE2 2.69Å; R26-E28 PolarHBondContact NH1-OE2 3.31Å; R26-E28 PolarHBondContact O-N 3.3Å; E28-P30 WeakPolarHBondContact O-CD 3.13Å | ||
| 29 | Y | 46.4 | Very low | 45.9 | Very low | 212 Ų | 212 | 160.8 Ų | 160.8 | 83% | 0.831 | 78% | 0.78 | S | S | * | * | trans | -51.1 | 124.8 | 178.3 | -70.2 | -93.9 | 0 | 0 | 0 | 109.6 | L27 I31 | L27-Y29 PolarHBondContact O-N 2.85Å; Y29-I31 VanDerWaalsContact C-N 3.32Å; Y29-I31 PolarHBondContact O-N 2.79Å | ||
| 30 | P | 43.3 | Very low | 46.8 | Very low | 117 Ų | 117 | 161.3 Ų | 161.3 | 76% | 0.76 | 78% | 0.783 | S | S | * | * | trans | -65.7 | 97.1 | 171.5 | -18.8 | 31.9 | 0 | 0 | 0 | 108.6 | E28 Y32 | E28-P30 WeakPolarHBondContact O-CD 3.13Å; P30-Y32 PolarHBondContact O-N 3.04Å | ||
| 31 | I | 51 | Low | 47.6 | Very low | 148 Ų | 148 | 162.5 Ų | 162.5 | 76% | 0.759 | 78% | 0.781 | S | S | * | * | trans | -55.6 | 109.2 | 162.2 | -62.3 | 174.7 | 0 | 0 | 0 | 104.9 | Y29 M33 | Y29-I31 VanDerWaalsContact C-N 3.32Å; Y29-I31 PolarHBondContact O-N 2.79Å; I31-M33 VanDerWaalsContact C-N 3.31Å; I31-M33 PolarHBondContact O-N 3.12Å | ||
| 32 | Y | 51.3 | Low | 48.3 | Very low | 225 Ų | 225 | 157.6 Ų | 157.6 | 88% | 0.882 | 77% | 0.771 | S | S | * | * | trans | -62.1 | 96.8 | -179.4 | -121.9 | -97.9 | 0 | 0 | 0 | 107.9 | P30 C34 | P30-Y32 PolarHBondContact O-N 3.04Å; Y32-C34 VanDerWaalsContact C-N 3.29Å; Y32-C34 PolarHBondContact O-N 3.44Å | ||
| 33 | M | 47.8 | Very low | 48.2 | Very low | 139 Ų | 139 | 162.3 Ų | 162.3 | 69% | 0.685 | 78% | 0.775 | S | S | * | * | trans | -67.7 | 92.1 | 178.1 | -68 | -166.2 | 83.2 | 0 | 0 | 108.1 | I31 K35 | I31-M33 VanDerWaalsContact C-N 3.31Å; I31-M33 PolarHBondContact O-N 3.12Å; M33-K35 HydrophobicContact CB-CG 4.23Å; M33-K35 VanDerWaalsContact CE-CE 3.49Å; M33-K35 PolarHBondContact O-N 3.37Å | ||
| 34 | C | 46.6 | Very low | 48.5 | Very low | 118 Ų | 118 | 160.8 Ų | 160.8 | 80% | 0.797 | 77% | 0.767 | S | S | * | * | trans | -66.8 | 80.4 | 168.2 | -170.1 | 0 | 0 | 0 | 0 | 108.9 | Y32 S36 | Y32-C34 VanDerWaalsContact C-N 3.29Å; Y32-C34 PolarHBondContact O-N 3.44Å; C34-S36 PolarHBondContact O-N 2.95Å | ||
| 35 | K | 44.7 | Very low | 49.1 | Very low | 166 Ų | 166 | 158.2 Ų | 158.2 | 72% | 0.722 | 75% | 0.753 | S | S | * | * | trans | -76.7 | 73.7 | 173.4 | -69.9 | -162.8 | 176.6 | -178.9 | 0 | 109.1 | M33 R37 | M33-K35 HydrophobicContact CB-CG 4.23Å; M33-K35 VanDerWaalsContact CE-CE 3.49Å; M33-K35 PolarHBondContact O-N 3.37Å; K35-R37 PolarHBondContact O-N 2.94Å | ||
| 36 | S | 42.9 | Very low | 49.1 | Very low | 101 Ų | 101 | 153.8 Ų | 153.8 | 71% | 0.706 | 75% | 0.751 | S | S | * | * | trans | -61.5 | 117.6 | 171.9 | -164.2 | 0 | 0 | 0 | 0 | 109.3 | C34 R38 | C34-S36 PolarHBondContact O-N 2.95Å; S36-R38 PolarHBondContact O-N 3.22Å | ||
| 37 | R | 54.7 | Low | 49.9 | Very low | 240 Ų | 240 | 148.4 Ų | 148.4 | 91% | 0.906 | 73% | 0.733 | S | S | * | * | trans | -72.2 | 129.2 | 178.8 | -92.6 | -173.2 | 173 | -121.8 | 4.4 | 109.6 | K35 G39 | K35-R37 PolarHBondContact O-N 2.94Å; R37-G39 PolarHBondContact O-N 3.2Å | ||
| 38 | R | 57.3 | Low | 50.4 | Low | 258 Ų | 258 | 146.4 Ų | 146.4 | 97% | 0.974 | 72% | 0.719 | S | S | * | * | trans | -30.9 | 112.3 | 177.6 | -159.5 | 178.3 | -65.9 | -164.3 | -0.3 | 114.4 | S36 | S36-R38 PolarHBondContact O-N 3.22Š| ||
| 39 | G | 44.2 | Very low | 51.3 | Low | 65 Ų | 65 | 144.6 Ų | 144.6 | 67% | 0.67 | 72% | 0.717 | S | S | * | * | trans | -158.3 | 136.8 | 168.1 | 0 | 0 | 0 | 0 | 0 | 109.7 | R37 K41 | R37-G39 PolarHBondContact O-N 3.2Å; G39-K41 PolarHBondContact O-N 3.12Å; G39-K41 VanDerWaalsContact O-N 3.17Å | ||
| 40 | M | 57 | Low | 52.1 | Low | 197 Ų | 197 | 143.5 Ų | 143.5 | 97% | 0.97 | 71% | 0.713 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.5 | 101.6 | -166.6 | -64 | 120.8 | 64.4 | 0 | 0 | 114.2 | ||
| 41 | K | 53.4 | Low | 53.6 | Low | 173 Ų | 173 | 143.6 Ų | 143.6 | 75% | 0.752 | 70% | 0.702 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -166 | 13.3 | 138.1 | -142 | 160.1 | 175.9 | 175 | 0 | 117.6 | G39 R43 | G39-K41 PolarHBondContact O-N 3.12Å; G39-K41 VanDerWaalsContact O-N 3.17Å; K41-R43 VanDerWaalsContact C-N 3.33Å; K41-R43 PolarHBondContact O-N 3.07Å |
| 42 | G | 55.1 | Low | 55 | Low | 63 Ų | 63 | 141.8 Ų | 141.8 | 65% | 0.649 | 69% | 0.693 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71.2 | 60.5 | -171 | 0 | 0 | 0 | 0 | 0 | 118.5 | E45 | G42-E45 WeakPolarHBondContact CA-OE1 3.35Å; G42-E45 PolarHBondContact N-OE1 3.48Å |
| 43 | R | 48.4 | Very low | 56.8 | Low | 205 Ų | 205 | 134.2 Ų | 134.2 | 77% | 0.774 | 67% | 0.672 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -120.2 | -14.2 | 163.9 | -160.3 | 178.7 | -176.2 | -118.8 | 0.2 | 114 | K41 K47 | K41-R43 VanDerWaalsContact C-N 3.33Å; K41-R43 PolarHBondContact O-N 3.07Å; R43-K47 WeakPolarHBondContact O-CE 3.39Å |
| 44 | D | 51.2 | Low | 59.1 | Low | 82 Ų | 82 | 133.7 Ų | 133.7 | 44% | 0.439 | 67% | 0.667 | S | S | . | * | S | Bend | trans | -101 | -19.9 | 175.8 | -76.7 | -50.7 | 0 | 0 | 0 | 114 | C46 K47 E48 | D44-C46 PolarHBondContact O-N 3.48Å; D44-K47 CarbonylContact O-C 3.56Å; D44-K47 WeakPolarHBondContact O-CA 3.38Å; D44-K47 VanDerWaalsContact O-CB 3.3Å; D44-K47 WeakPolarHBondContact O-CB 3.25Å; D44-K47 PolarHBondContact O-N 3.46Å; D44-K47 WeakPolarHBondContact OD1-CD 3.42Å; D44-K47 IonicContact OD1-NZ 3.55Å; D44-K47 PolarHBondContact OD1-NZ 2.84Å; D44-E48 PolarHBondContact O-N 3.3Å |
| 45 | E | 53.5 | Low | 61.3 | Low | 111 Ų | 111 | 136.6 Ų | 136.6 | 52% | 0.519 | 66% | 0.661 | S | S | . | * | H | α-helix | trans | -58.6 | -49 | -177.7 | -62.9 | 166.9 | -139.6 | 0 | 0 | 112.5 | G42 K47 E48 T49 | G42-E45 WeakPolarHBondContact CA-OE1 3.35Å; G42-E45 PolarHBondContact N-OE1 3.48Å; E45-K47 PolarHBondContact O-N 3.4Å; E45-E48 PolarHBondContact O-N 2.94Å; E45-T49 PolarHBondContact O-N 2.82Å; E45-T49 PolarHBondContact O-OG1 3.36Å |
| 46 | C | 50.9 | Low | 63.7 | Low | 105 Ų | 105 | 134.4 Ų | 134.4 | 71% | 0.709 | 66% | 0.657 | S | S | * | * | H | α-helix | trans | -59.9 | -27.5 | 173.8 | -73.3 | 0 | 0 | 0 | 0 | 113.2 | D44 | D44-C46 PolarHBondContact O-N 3.48Å |
| 47 | K | 57.6 | Low | 66.2 | Low | 89 Ų | 89 | 135.2 Ų | 135.2 | 39% | 0.387 | 65% | 0.652 | S | S | . | * | H | α-helix | trans | -77.5 | -38.7 | 175.4 | -52.6 | -179.5 | -162.1 | 152.6 | 0 | 110.7 | R43 D44 E45 Y50 K51 | R43-K47 WeakPolarHBondContact O-CE 3.39Å; D44-K47 CarbonylContact O-C 3.56Å; D44-K47 WeakPolarHBondContact O-CA 3.38Å; D44-K47 VanDerWaalsContact O-CB 3.3Å; D44-K47 WeakPolarHBondContact O-CB 3.25Å; D44-K47 PolarHBondContact O-N 3.46Å; D44-K47 WeakPolarHBondContact OD1-CD 3.42Å; D44-K47 IonicContact OD1-NZ 3.55Å; D44-K47 PolarHBondContact OD1-NZ 2.84Å; E45-K47 PolarHBondContact O-N 3.4Å; K47-Y50 PolarHBondContact O-N 2.98Å; K47-K51 VanDerWaalsContact O-CB 3.3Å; K47-K51 WeakPolarHBondContact O-CB 3.15Å; K47-K51 WeakPolarHBondContact O-CG 3.32Å; K47-K51 PolarHBondContact O-N 2.91Å |
| 48 | E | 59.3 | Low | 68.2 | Low | 127 Ų | 127 | 125.9 Ų | 125.9 | 59% | 0.593 | 62% | 0.619 | S | S | * | * | H | α-helix | trans | -63 | -41.4 | 175 | -68.8 | -156.8 | 131 | 0 | 0 | 112.2 | D44 E45 Y50 K51 L52 | D44-E48 PolarHBondContact O-N 3.3Å; E45-E48 PolarHBondContact O-N 2.94Å; E48-Y50 VanDerWaalsContact C-N 3.28Å; E48-Y50 PolarHBondContact O-N 2.86Å; E48-K51 PolarHBondContact O-N 3.5Å; E48-L52 PolarHBondContact O-N 2.95Å |
| 49 | T | 60.1 | Low | 70.1 | Confident | 95 Ų | 95 | 119.1 Ų | 119.1 | 58% | 0.583 | 60% | 0.596 | S | S | * | * | H | α-helix | trans | -58.8 | -36.2 | 178.5 | -49.6 | 0 | 0 | 0 | 0 | 112.9 | E45 P53 | E45-T49 PolarHBondContact O-N 2.82Å; E45-T49 PolarHBondContact O-OG1 3.36Å; T49-P53 WeakPolarHBondContact O-CD 3.28Å |
| 50 | Y | 64.1 | Low | 72.6 | Confident | 190 Ų | 190 | 123.7 Ų | 123.7 | 75% | 0.745 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -85 | -27.5 | 172.5 | -83.3 | -91.9 | 0 | 0 | 0 | 113.7 | K47 E48 P53 H54 | K47-Y50 PolarHBondContact O-N 2.98Å; E48-Y50 VanDerWaalsContact C-N 3.28Å; E48-Y50 PolarHBondContact O-N 2.86Å; Y50-P53 WeakPolarHBondContact O-CD 3.42Å; Y50-H54 PolarHBondContact O-N 3.02Å |
| 51 | K | 75.6 | Confident | 74.6 | Confident | 118 Ų | 118 | 121 Ų | 121 | 51% | 0.513 | 58% | 0.577 | S | S | . | * | H | α-helix | trans | -69.3 | -29.6 | 175.8 | -78.1 | 171.3 | -178 | -172.1 | 0 | 113 | K47 E48 H54 R55 | K47-K51 VanDerWaalsContact O-CB 3.3Å; K47-K51 WeakPolarHBondContact O-CB 3.15Å; K47-K51 WeakPolarHBondContact O-CG 3.32Å; K47-K51 PolarHBondContact O-N 2.91Å; E48-K51 PolarHBondContact O-N 3.5Å; K51-H54 PolarHBondContact O-N 3.47Å; K51-R55 WeakPolarHBondContact O-CB 3.28Å; K51-R55 VanDerWaalsContact O-CG 3.24Å; K51-R55 WeakPolarHBondContact O-CG 3.29Å; K51-R55 PolarHBondContact O-N 3.41Å |
| 52 | L | 79.4 | Confident | 76.7 | Confident | 111 Ų | 111 | 118.5 Ų | 118.5 | 58% | 0.581 | 56% | 0.563 | S | S | * | * | H | α-helix | trans | -63.8 | -51.5 | 176.4 | -73 | 170 | 0 | 0 | 0 | 112.4 | E48 H54 R55 L56 | E48-L52 PolarHBondContact O-N 2.95Å; L52-H54 VanDerWaalsContact C-N 3.34Å; L52-H54 PolarHBondContact O-N 3.41Å; L52-R55 PolarHBondContact O-N 3.36Å; L52-L56 PolarHBondContact O-N 2.92Å; L52-L56 VanDerWaalsContact O-N 3.09Å |
| 53 | P | 89.5 | Confident | 78.8 | Confident | 66 Ų | 66 | 119.2 Ų | 119.2 | 43% | 0.429 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -53.6 | -45.8 | 167.7 | -28.2 | 34.2 | 0 | 0 | 0 | 113.3 | T49 Y50 R55 L56 I57 | T49-P53 WeakPolarHBondContact O-CD 3.28Å; Y50-P53 WeakPolarHBondContact O-CD 3.42Å; P53-R55 PolarHBondContact O-N 3.19Å; P53-L56 PolarHBondContact O-N 2.92Å; P53-L56 VanDerWaalsContact O-N 3.16Å; P53-I57 VanDerWaalsContact O-CG1 3.31Å; P53-I57 WeakPolarHBondContact O-CG1 3.17Å; P53-I57 PolarHBondContact O-N 2.88Å |
| 54 | H | 94.8 | Very high | 81.2 | Confident | 128 Ų | 128 | 118.5 Ų | 118.5 | 59% | 0.593 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -61.2 | -44.2 | 179.6 | -173.6 | 81.4 | 0 | 0 | 0 | 112.3 | Y50 K51 L52 L56 I57 E58 | Y50-H54 PolarHBondContact O-N 3.02Å; K51-H54 PolarHBondContact O-N 3.47Å; L52-H54 VanDerWaalsContact C-N 3.34Å; L52-H54 PolarHBondContact O-N 3.41Å; H54-L56 VanDerWaalsContact C-N 3.3Å; H54-L56 PolarHBondContact O-N 3.4Å; H54-I57 PolarHBondContact O-N 3.45Å; H54-E58 VanDerWaalsContact O-CB 3.32Å; H54-E58 WeakPolarHBondContact O-CB 3.2Å; H54-E58 PolarHBondContact O-N 2.91Å |
| 55 | R | 93.2 | Very high | 83.4 | Confident | 178 Ų | 178 | 118 Ų | 118 | 67% | 0.672 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -60.9 | -36.6 | 175 | -73.5 | 173 | 89.4 | -176.4 | 7.2 | 112.2 | K51 L52 P53 K59 | K51-R55 WeakPolarHBondContact O-CB 3.28Å; K51-R55 VanDerWaalsContact O-CG 3.24Å; K51-R55 WeakPolarHBondContact O-CG 3.29Å; K51-R55 PolarHBondContact O-N 3.41Å; L52-R55 PolarHBondContact O-N 3.36Å; P53-R55 PolarHBondContact O-N 3.19Å; R55-K59 VanDerWaalsContact O-CB 3.26Å; R55-K59 WeakPolarHBondContact O-CB 3.47Å; R55-K59 PolarHBondContact O-N 3.49Å |
| 56 | L | 95.6 | Very high | 85.6 | Confident | 121 Ų | 121 | 115.8 Ų | 115.8 | 63% | 0.634 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -72.7 | -43.7 | 178.3 | -174.9 | 63 | 0 | 0 | 0 | 112.4 | L52 P53 H54 K59 K60 | L52-L56 PolarHBondContact O-N 2.92Å; L52-L56 VanDerWaalsContact O-N 3.09Å; P53-L56 PolarHBondContact O-N 2.92Å; P53-L56 VanDerWaalsContact O-N 3.16Å; H54-L56 VanDerWaalsContact C-N 3.3Å; H54-L56 PolarHBondContact O-N 3.4Å; L56-K59 PolarHBondContact O-N 3.36Å; L56-K60 PolarHBondContact O-N 2.62Å |
| 57 | I | 95 | Very high | 87.8 | Confident | 117 Ų | 117 | 115.8 Ų | 115.8 | 60% | 0.6 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -61.1 | -48.3 | 176 | -68 | 163.5 | 0 | 0 | 0 | 110.2 | P53 H54 K59 K60 R61 | P53-I57 VanDerWaalsContact O-CG1 3.31Å; P53-I57 WeakPolarHBondContact O-CG1 3.17Å; P53-I57 PolarHBondContact O-N 2.88Å; H54-I57 PolarHBondContact O-N 3.45Å; I57-K59 PolarHBondContact O-N 3.32Å; I57-K60 PolarHBondContact O-N 2.81Å; I57-R61 PolarHBondContact O-N 3.27Å |
| 58 | E | 97.4 | Very high | 89.8 | Confident | 45 Ų | 45 | 114.3 Ų | 114.3 | 21% | 0.21 | 53% | 0.527 | C | S | . | . | H | α-helix | trans | -69.9 | -30.6 | 179.2 | 168.3 | 53.4 | -162 | 0 | 0 | 112.2 | H54 R61 R62 | H54-E58 VanDerWaalsContact O-CB 3.32Å; H54-E58 WeakPolarHBondContact O-CB 3.2Å; H54-E58 PolarHBondContact O-N 2.91Å; E58-R61 VanDerWaalsContact CD-NH1 3.35Å; E58-R61 PolarHBondContact O-N 2.99Å; E58-R61 IonicContact OE1-NH1 3.99Å; E58-R61 PolarHBondContact OE1-NH1 3.35Å; E58-R61 WeakPolarHBondContact OE2-CD 3.45Å; E58-R61 IonicContact OE2-CZ 3.21Å; E58-R61 IonicContact OE2-NE 2.79Å; E58-R61 IonicContact OE2-NH1 2.81Å; E58-R61 PolarHBondContact OE2-NH1 2.93Å; E58-R62 WeakPolarHBondContact O-CG 3.38Å; E58-R62 PolarHBondContact O-N 2.88Å; E58-R62 WeakPolarHBondContact OE1-CD 3.22Å; E58-R62 WeakPolarHBondContact OE1-CG 3.38Å; E58-R62 IonicContact OE1-CZ 3.77Å; E58-R62 IonicContact OE1-NE 2.75Å; E58-R62 IonicContact OE1-NH1 2.6Å; E58-R62 PolarHBondContact OE1-NH1 3.46Å |
| 59 | K | 96.9 | Very high | 91.6 | Very high | 115 Ų | 115 | 109.5 Ų | 109.5 | 50% | 0.5 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -59.5 | -54.5 | 166.3 | 179.9 | -178 | 174.2 | -173.3 | 0 | 110.5 | R55 L56 I57 R61 R62 D63 | R55-K59 VanDerWaalsContact O-CB 3.26Å; R55-K59 WeakPolarHBondContact O-CB 3.47Å; R55-K59 PolarHBondContact O-N 3.49Å; L56-K59 PolarHBondContact O-N 3.36Å; I57-K59 PolarHBondContact O-N 3.32Å; K59-R61 PolarHBondContact O-N 3.42Å; K59-R62 PolarHBondContact O-N 2.83Å; K59-D63 WeakPolarHBondContact CE-OD2 3.35Å; K59-D63 WeakPolarHBondContact CG-OD2 3.37Å; K59-D63 PolarHBondContact O-N 2.88Å |
| 60 | K | 97.4 | Very high | 93.3 | Very high | 162 Ų | 162 | 106.8 Ų | 106.8 | 70% | 0.704 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -57.3 | -36.7 | 179.1 | -174.2 | 176.2 | -179.5 | 177.7 | 0 | 112.5 | L56 I57 R64 | L56-K60 PolarHBondContact O-N 2.62Å; I57-K60 PolarHBondContact O-N 2.81Å; K60-R64 PolarHBondContact O-N 3.44Å; K60-R64 VanDerWaalsContact O-N 3.1Å |
| 61 | R | 98.3 | Very high | 94.9 | Very high | 140 Ų | 140 | 102.5 Ų | 102.5 | 53% | 0.528 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -63.1 | -48 | 173 | 175.8 | 176.2 | 160.5 | -81.4 | -5.8 | 111.9 | I57 E58 K59 R64 I65 | I57-R61 PolarHBondContact O-N 3.27Å; E58-R61 VanDerWaalsContact CD-NH1 3.35Å; E58-R61 PolarHBondContact O-N 2.99Å; E58-R61 IonicContact OE1-NH1 3.99Å; E58-R61 PolarHBondContact OE1-NH1 3.35Å; E58-R61 WeakPolarHBondContact OE2-CD 3.45Å; E58-R61 IonicContact OE2-CZ 3.21Å; E58-R61 IonicContact OE2-NE 2.79Å; E58-R61 IonicContact OE2-NH1 2.81Å; E58-R61 PolarHBondContact OE2-NH1 2.93Å; K59-R61 PolarHBondContact O-N 3.42Å; R61-R64 PolarHBondContact O-N 3Å; R61-I65 HydrophobicContact CG-CD1 4.02Å; R61-I65 WeakPolarHBondContact O-CG1 3.26Å; R61-I65 PolarHBondContact O-N 3.46Å |
| 62 | R | 98.4 | Very high | 95.9 | Very high | 121 Ų | 121 | 99.6 Ų | 99.6 | 46% | 0.457 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -64.5 | -40.6 | 177.2 | -74 | -172.1 | -64.4 | -110 | 2 | 112.7 | E58 K59 R64 I65 N66 | E58-R62 WeakPolarHBondContact O-CG 3.38Å; E58-R62 PolarHBondContact O-N 2.88Å; E58-R62 WeakPolarHBondContact OE1-CD 3.22Å; E58-R62 WeakPolarHBondContact OE1-CG 3.38Å; E58-R62 IonicContact OE1-CZ 3.77Å; E58-R62 IonicContact OE1-NE 2.75Å; E58-R62 IonicContact OE1-NH1 2.6Å; E58-R62 PolarHBondContact OE1-NH1 3.46Å; K59-R62 PolarHBondContact O-N 2.83Å; R62-R64 VanDerWaalsContact C-N 3.34Å; R62-R64 PolarHBondContact O-N 3.03Å; R62-I65 PolarHBondContact O-N 3.46Å; R62-I65 VanDerWaalsContact O-N 3.15Å; R62-N66 PolarHBondContact O-N 2.86Å; R62-N66 PolarHBondContact O-ND2 2.85Å |
| 63 | D | 98.3 | Very high | 96.6 | Very high | 77 Ų | 77 | 98 Ų | 98 | 41% | 0.412 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -60.7 | -45.7 | 178.1 | -62.8 | -17.2 | 0 | 0 | 0 | 110 | K59 I65 N66 E67 | K59-D63 WeakPolarHBondContact CE-OD2 3.35Å; K59-D63 WeakPolarHBondContact CG-OD2 3.37Å; K59-D63 PolarHBondContact O-N 2.88Å; D63-I65 PolarHBondContact O-N 3.2Å; D63-N66 PolarHBondContact O-N 2.78Å; D63-E67 PolarHBondContact O-N 2.84Å |
| 64 | R | 98.5 | Very high | 96.8 | Very high | 191 Ų | 191 | 99.6 Ų | 99.6 | 72% | 0.721 | 46% | 0.462 | S | S | * | . | H | α-helix | trans | -59.6 | -41 | 172 | 179.2 | -178.2 | 170 | -132.8 | -3.9 | 113.4 | K60 R61 R62 E67 C68 | K60-R64 PolarHBondContact O-N 3.44Å; K60-R64 VanDerWaalsContact O-N 3.1Å; R61-R64 PolarHBondContact O-N 3Å; R62-R64 VanDerWaalsContact C-N 3.34Å; R62-R64 PolarHBondContact O-N 3.03Å; R64-E67 PolarHBondContact O-N 3.49Å; R64-C68 PolarHBondContact O-N 2.96Å; R64-C68 VanDerWaalsContact O-N 3.09Å; R64-C68 PolarHBondContact O-SG 2.98Å; R64-C68 VanDerWaalsContact O-SG 3.35Å |
| 65 | I | 98.4 | Very high | 96.9 | Very high | 71 Ų | 71 | 100 Ų | 100 | 36% | 0.364 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -66 | -41.5 | 177.8 | -70.1 | 165.5 | 0 | 0 | 0 | 110.7 | R61 R62 D63 E67 C68 I69 | R61-I65 HydrophobicContact CG-CD1 4.02Å; R61-I65 WeakPolarHBondContact O-CG1 3.26Å; R61-I65 PolarHBondContact O-N 3.46Å; R62-I65 PolarHBondContact O-N 3.46Å; R62-I65 VanDerWaalsContact O-N 3.15Å; D63-I65 PolarHBondContact O-N 3.2Å; I65-E67 VanDerWaalsContact C-N 3.34Å; I65-C68 PolarHBondContact O-N 3.18Å; I65-I69 HydrophobicContact CG2-CD1 3.87Å; I65-I69 VanDerWaalsContact O-CG1 3.32Å; I65-I69 WeakPolarHBondContact O-CG1 3.27Å; I65-I69 PolarHBondContact O-N 3.07Å |
| 66 | N | 98.2 | Very high | 96.9 | Very high | 64 Ų | 64 | 91.8 Ų | 91.8 | 34% | 0.342 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -62.5 | -41.9 | 176.8 | -66.4 | -30.3 | 0 | 0 | 0 | 111.4 | R62 D63 I69 A70 K90 | R62-N66 PolarHBondContact O-N 2.86Å; R62-N66 PolarHBondContact O-ND2 2.85Å; D63-N66 PolarHBondContact O-N 2.78Å; N66-I69 PolarHBondContact O-N 3.31Å; N66-A70 PolarHBondContact O-N 3.02Å; N66-K90 PolarHBondContact OD1-NZ 3.15Å |
| 67 | E | 98.4 | Very high | 96.8 | Very high | 106 Ų | 106 | 87.2 Ų | 87.2 | 50% | 0.495 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -58.5 | -49.8 | 175 | -174.2 | 59.1 | -141.1 | 0 | 0 | 111.6 | D63 R64 I65 I69 A70 Q71 | D63-E67 PolarHBondContact O-N 2.84Å; R64-E67 PolarHBondContact O-N 3.49Å; I65-E67 VanDerWaalsContact C-N 3.34Å; E67-I69 VanDerWaalsContact C-N 3.3Å; E67-I69 PolarHBondContact O-N 3.37Å; E67-A70 WeakPolarHBondContact O-CB 3.15Å; E67-A70 PolarHBondContact O-N 3.45Å; E67-A70 VanDerWaalsContact O-N 3.14Å; E67-Q71 WeakPolarHBondContact O-CG 3.34Å; E67-Q71 PolarHBondContact O-N 3.01Å; E67-Q71 PolarHBondContact OE1-NE2 3.29Å |
| 68 | C | 98.3 | Very high | 96.6 | Very high | 57 Ų | 57 | 88.7 Ų | 88.7 | 39% | 0.385 | 42% | 0.419 | S | S | . | . | H | α-helix | trans | -60 | -37.6 | 175.6 | -65 | 0 | 0 | 0 | 0 | 112.8 | R64 I65 Q71 L72 | R64-C68 PolarHBondContact O-N 2.96Å; R64-C68 VanDerWaalsContact O-N 3.09Å; R64-C68 PolarHBondContact O-SG 2.98Å; R64-C68 VanDerWaalsContact O-SG 3.35Å; I65-C68 PolarHBondContact O-N 3.18Å; C68-Q71 PolarHBondContact O-N 3.15Å; C68-L72 WeakPolarHBondContact O-CG 3.21Å; C68-L72 PolarHBondContact O-N 3.43Å |
| 69 | I | 97.4 | Very high | 96.1 | Very high | 27 Ų | 27 | 93 Ų | 93 | 14% | 0.138 | 44% | 0.439 | C | S | . | . | H | α-helix | trans | -69.6 | -36.1 | 176.8 | -65.6 | 166 | 0 | 0 | 0 | 111.3 | I65 N66 E67 L72 K73 K90 V93 | I65-I69 HydrophobicContact CG2-CD1 3.87Å; I65-I69 VanDerWaalsContact O-CG1 3.32Å; I65-I69 WeakPolarHBondContact O-CG1 3.27Å; I65-I69 PolarHBondContact O-N 3.07Å; N66-I69 PolarHBondContact O-N 3.31Å; E67-I69 VanDerWaalsContact C-N 3.3Å; E67-I69 PolarHBondContact O-N 3.37Å; I69-L72 PolarHBondContact O-N 2.73Å; I69-K73 WeakPolarHBondContact O-CB 3.49Å; I69-K73 PolarHBondContact O-N 2.84Å; I69-K90 HydrophobicContact CD1-CD 4.14Å; I69-K90 HydrophobicContact CD1-CG 4.42Å; I69-K90 HydrophobicContact CG2-CG 4.25Å; I69-V93 HydrophobicContact CG2-CB 4.31Å; I69-V93 HydrophobicContact CG2-CG1 4.19Å; I69-V93 HydrophobicContact CG2-CG2 4.39Å |
| 70 | A | 96 | Very high | 95.6 | Very high | 38 Ų | 38 | 89.1 Ų | 89.1 | 31% | 0.314 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -63.3 | -46.4 | 173.7 | 0 | 0 | 0 | 0 | 0 | 111.2 | N66 E67 L72 K73 D74 | N66-A70 PolarHBondContact O-N 3.02Å; E67-A70 WeakPolarHBondContact O-CB 3.15Å; E67-A70 PolarHBondContact O-N 3.45Å; E67-A70 VanDerWaalsContact O-N 3.14Å; A70-L72 PolarHBondContact O-N 3.22Å; A70-K73 WeakPolarHBondContact O-CB 3.28Å; A70-K73 PolarHBondContact O-N 3.44Å; A70-K73 VanDerWaalsContact O-N 3.12Å; A70-D74 PolarHBondContact O-N 3.46Å |
| 71 | Q | 97.2 | Very high | 95.1 | Very high | 99 Ų | 99 | 83.9 Ų | 83.9 | 46% | 0.463 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -60.5 | -43.1 | 175.6 | -67.8 | 172 | 5.6 | 0 | 0 | 112.3 | E67 C68 K73 D74 L75 | E67-Q71 WeakPolarHBondContact O-CG 3.34Å; E67-Q71 PolarHBondContact O-N 3.01Å; E67-Q71 PolarHBondContact OE1-NE2 3.29Å; C68-Q71 PolarHBondContact O-N 3.15Å; Q71-K73 VanDerWaalsContact C-N 3.34Å; Q71-K73 PolarHBondContact O-N 3.48Å; Q71-D74 PolarHBondContact O-N 3.46Å; Q71-L75 WeakPolarHBondContact O-CB 3.15Å; Q71-L75 WeakPolarHBondContact O-CG 3.26Å; Q71-L75 PolarHBondContact O-N 2.94Å |
| 72 | L | 96.9 | Very high | 94.4 | Very high | 58 Ų | 58 | 83.6 Ų | 83.6 | 30% | 0.304 | 41% | 0.409 | S | S | . | . | H | α-helix | trans | -60.3 | -43 | 173 | -74.8 | -179.1 | 0 | 0 | 0 | 112.1 | C68 I69 A70 D74 L75 L76 V93 L94 T97 | C68-L72 WeakPolarHBondContact O-CG 3.21Å; C68-L72 PolarHBondContact O-N 3.43Å; I69-L72 PolarHBondContact O-N 2.73Å; A70-L72 PolarHBondContact O-N 3.22Å; L72-D74 VanDerWaalsContact C-N 3.29Å; L72-D74 PolarHBondContact O-N 3.44Å; L72-L75 PolarHBondContact O-N 3.04Å; L72-L76 WeakPolarHBondContact O-CG 3.43Å; L72-L76 PolarHBondContact O-N 3.33Å; L72-V93 HydrophobicContact CB-CG1 3.91Å; L72-L94 HydrophobicContact CD1-CD2 4.1Å; L72-T97 HydrophobicContact CD2-CG2 3.96Å |
| 73 | K | 94.8 | Very high | 93.5 | Very high | 77 Ų | 77 | 82.7 Ų | 82.7 | 34% | 0.335 | 42% | 0.417 | S | S | . | . | H | α-helix | trans | -59.9 | -41.1 | 176.1 | -171.4 | -154.3 | 68.9 | 175.7 | 0 | 111 | I69 A70 Q71 L76 K81 L88 V93 | I69-K73 WeakPolarHBondContact O-CB 3.49Å; I69-K73 PolarHBondContact O-N 2.84Å; A70-K73 WeakPolarHBondContact O-CB 3.28Å; A70-K73 PolarHBondContact O-N 3.44Å; A70-K73 VanDerWaalsContact O-N 3.12Å; Q71-K73 VanDerWaalsContact C-N 3.34Å; Q71-K73 PolarHBondContact O-N 3.48Å; K73-L76 WeakPolarHBondContact O-CB 3.46Å; K73-L76 PolarHBondContact O-N 2.81Å; K73-K81 WeakPolarHBondContact O-CE 3.39Å; K73-L88 HydrophobicContact CD-CB 4.36Å; K73-L88 HydrophobicContact CD-CD1 4.36Å; K73-L88 HydrophobicContact CG-CB 4.16Å; K73-L88 HydrophobicContact CG-CD1 3.57Å; K73-L88 HydrophobicContact CG-CG 4.48Å; K73-V93 HydrophobicContact CB-CG1 4Å; K73-V93 HydrophobicContact CB-CG2 3.91Å; K73-V93 HydrophobicContact CG-CG2 3.94Å |
| 74 | D | 94 | Very high | 92.2 | Very high | 99 Ų | 99 | 81.4 Ų | 81.4 | 53% | 0.529 | 41% | 0.412 | S | S | . | . | H | α-helix | trans | -76.3 | -31.6 | -177 | -64.3 | -20.6 | 0 | 0 | 0 | 112.4 | A70 Q71 L72 L76 K81 | A70-D74 PolarHBondContact O-N 3.46Å; Q71-D74 PolarHBondContact O-N 3.46Å; L72-D74 VanDerWaalsContact C-N 3.29Å; L72-D74 PolarHBondContact O-N 3.44Å; D74-L76 VanDerWaalsContact C-N 3.28Å; D74-L76 PolarHBondContact O-N 3.42Å; D74-K81 PolarHBondContact O-NZ 3.3Å |
| 75 | L | 95.3 | Very high | 91 | Very high | 137 Ų | 137 | 80.3 Ų | 80.3 | 72% | 0.717 | 42% | 0.42 | S | S | * | . | H | α-helix | trans | -70.1 | -16 | 171.7 | -71.3 | 171.3 | 0 | 0 | 0 | 114.3 | Q71 L72 | Q71-L75 WeakPolarHBondContact O-CB 3.15Å; Q71-L75 WeakPolarHBondContact O-CG 3.26Å; Q71-L75 PolarHBondContact O-N 2.94Å; L72-L75 PolarHBondContact O-N 3.04Å |
| 76 | L | 94.6 | Very high | 89.8 | Confident | 5 Ų | 5 | 79.4 Ų | 79.4 | 3% | 0.026 | 43% | 0.428 | C | S | . | . | S | Bend | trans | -65 | 141.5 | 179.3 | -78.3 | 171 | 0 | 0 | 0 | 112.4 | L72 K73 D74 L80 K81 L88 V93 L96 H100 | L72-L76 WeakPolarHBondContact O-CG 3.43Å; L72-L76 PolarHBondContact O-N 3.33Å; K73-L76 WeakPolarHBondContact O-CB 3.46Å; K73-L76 PolarHBondContact O-N 2.81Å; D74-L76 VanDerWaalsContact C-N 3.28Å; D74-L76 PolarHBondContact O-N 3.42Å; L76-L80 HydrophobicContact CD2-CD1 4.35Å; L76-K81 HydrophobicContact CB-CD 4.45Å; L76-K81 HydrophobicContact CB-CG 4Å; L76-K81 WeakPolarHBondContact O-CD 3.35Å; L76-K81 WeakPolarHBondContact O-CE 3.46Å; L76-K81 PolarHBondContact O-NZ 2.78Å; L76-L88 HydrophobicContact CD1-CD1 4.15Å; L76-V93 HydrophobicContact CD1-CG1 4.4Å; L76-L96 HydrophobicContact CD1-CB 3.74Å; L76-L96 HydrophobicContact CD1-CD1 4.21Å; L76-L96 HydrophobicContact CD2-CB 3.85Å; L76-L96 HydrophobicContact CG-CB 4.48Å; L76-H100 HydrophobicContact CD2-CB 4.33Å |
| 77 | P | 92.6 | Very high | 89.1 | Confident | 26 Ų | 26 | 83.8 Ų | 83.8 | 17% | 0.169 | 45% | 0.446 | C | S | . | . | trans | -56.4 | 143.4 | 169.7 | -25.2 | 32.3 | 0 | 0 | 0 | 113.1 | H79 L80 K81 H100 | P77-H79 VanDerWaalsContact C-N 3.3Å; P77-H79 WeakPolarHBondContact CB-CE1 3.13Å; P77-H79 PolarHBondContact O-N 3.27Å; P77-L80 HydrophobicContact CB-CG 4.44Å; P77-L80 HydrophobicContact CG-CD1 4.32Å; P77-L80 PolarHBondContact O-N 3.47Å; P77-K81 PolarHBondContact O-N 3.06Å; P77-K81 VanDerWaalsContact O-N 3.09Å; P77-H100 VanDerWaalsContact CG-CE1 3.47Å; P77-H100 WeakPolarHBondContact CG-CE1 3.25Å | ||
| 78 | E | 90.6 | Very high | 88.7 | Confident | 147 Ų | 147 | 79.7 Ų | 79.7 | 69% | 0.687 | 43% | 0.427 | S | S | * | . | H | α-helix | trans | -56.9 | -41.1 | -179.3 | -64.2 | -174.8 | 168.5 | 0 | 0 | 113 | L80 K81 L82 | E78-L80 PolarHBondContact O-N 2.67Å; E78-K81 WeakPolarHBondContact O-CB 3.32Å; E78-K81 PolarHBondContact O-N 3.15Å; E78-K81 VanDerWaalsContact O-N 3.12Å; E78-L82 WeakPolarHBondContact O-CB 3.27Å; E78-L82 VanDerWaalsContact O-CG 3.27Å; E78-L82 WeakPolarHBondContact O-CG 3.26Å; E78-L82 PolarHBondContact O-N 3.26Å |
| 79 | H | 87.6 | Confident | 88.5 | Confident | 137 Ų | 137 | 83.1 Ų | 83.1 | 63% | 0.634 | 44% | 0.438 | S | S | * | . | H | α-helix | trans | -62.7 | -27.2 | 178 | 61.2 | -99.6 | 0 | 0 | 0 | 113.3 | P77 | P77-H79 VanDerWaalsContact C-N 3.3Å; P77-H79 WeakPolarHBondContact CB-CE1 3.13Å; P77-H79 PolarHBondContact O-N 3.27Å |
| 80 | L | 86.5 | Confident | 88.4 | Confident | 32 Ų | 32 | 87.3 Ų | 87.3 | 17% | 0.168 | 46% | 0.455 | C | S | . | . | H | α-helix | trans | -79.7 | -41.6 | 172.2 | -64.3 | -173.6 | 0 | 0 | 0 | 111.4 | L76 P77 E78 L82 T83 L96 H100 | L76-L80 HydrophobicContact CD2-CD1 4.35Å; P77-L80 HydrophobicContact CB-CG 4.44Å; P77-L80 HydrophobicContact CG-CD1 4.32Å; P77-L80 PolarHBondContact O-N 3.47Å; E78-L80 PolarHBondContact O-N 2.67Å; L80-L82 PolarHBondContact O-N 3.06Å; L80-T83 VanDerWaalsContact O-CG2 3.31Å; L80-T83 WeakPolarHBondContact O-CG2 3.43Å; L80-T83 PolarHBondContact O-N 3.12Å; L80-L96 HydrophobicContact CB-CD1 4.26Å; L80-L96 HydrophobicContact CB-CD2 4.24Å; L80-L96 HydrophobicContact CD2-CD2 4.39Å; L80-L96 WeakPolarHBondContact O-CD1 3.43Å; L80-H100 HydrophobicContact CD1-CB 3.94Å |
| 81 | K | 86.3 | Confident | 88.4 | Confident | 52 Ų | 52 | 88.7 Ų | 88.7 | 23% | 0.226 | 47% | 0.466 | C | S | . | . | H | α-helix | trans | -59.6 | -43.8 | 175.6 | -69.1 | 163.2 | 166.7 | 155.9 | 0 | 112.4 | K73 D74 L76 P77 E78 T83 T84 L88 | K73-K81 WeakPolarHBondContact O-CE 3.39Å; D74-K81 PolarHBondContact O-NZ 3.3Å; L76-K81 HydrophobicContact CB-CD 4.45Å; L76-K81 HydrophobicContact CB-CG 4Å; L76-K81 WeakPolarHBondContact O-CD 3.35Å; L76-K81 WeakPolarHBondContact O-CE 3.46Å; L76-K81 PolarHBondContact O-NZ 2.78Å; P77-K81 PolarHBondContact O-N 3.06Å; P77-K81 VanDerWaalsContact O-N 3.09Å; E78-K81 WeakPolarHBondContact O-CB 3.32Å; E78-K81 PolarHBondContact O-N 3.15Å; E78-K81 VanDerWaalsContact O-N 3.12Å; K81-T83 VanDerWaalsContact C-N 3.27Å; K81-T83 PolarHBondContact O-N 2.74Å; K81-T84 PolarHBondContact O-N 3.32Å; K81-L88 HydrophobicContact CB-CD1 4.4Å; K81-L88 HydrophobicContact CG-CD1 4.01Å |
| 82 | L | 83.3 | Confident | 88.2 | Confident | 134 Ų | 134 | 85.6 Ų | 85.6 | 70% | 0.702 | 45% | 0.454 | S | S | * | . | H | α-helix | trans | -70.6 | -20.9 | -177.7 | -69.4 | 170.7 | 0 | 0 | 0 | 113.3 | E78 L80 T84 | E78-L82 WeakPolarHBondContact O-CB 3.27Å; E78-L82 VanDerWaalsContact O-CG 3.27Å; E78-L82 WeakPolarHBondContact O-CG 3.26Å; E78-L82 PolarHBondContact O-N 3.26Å; L80-L82 PolarHBondContact O-N 3.06Å; L82-T84 PolarHBondContact O-N 2.75Å; L82-T84 VanDerWaalsContact O-N 3.15Å |
| 83 | T | 79.4 | Confident | 88.2 | Confident | 103 Ų | 103 | 82.9 Ų | 82.9 | 63% | 0.632 | 44% | 0.44 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -64.5 | -17.3 | 177 | -133.7 | 0 | 0 | 0 | 0 | 112.9 | L80 K81 L96 | L80-T83 VanDerWaalsContact O-CG2 3.31Å; L80-T83 WeakPolarHBondContact O-CG2 3.43Å; L80-T83 PolarHBondContact O-N 3.12Å; K81-T83 VanDerWaalsContact C-N 3.27Å; K81-T83 PolarHBondContact O-N 2.74Å; T83-L96 HydrophobicContact CG2-CD2 4.47Å |
| 84 | T | 72.2 | Confident | 88.3 | Confident | 50 Ų | 50 | 83.6 Ų | 83.6 | 31% | 0.307 | 45% | 0.447 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -136.2 | 58.4 | -178.4 | 44 | 0 | 0 | 0 | 0 | 112.3 | K81 L82 G86 L88 V92 | K81-T84 PolarHBondContact O-N 3.32Å; L82-T84 PolarHBondContact O-N 2.75Å; L82-T84 VanDerWaalsContact O-N 3.15Å; T84-G86 PolarHBondContact O-N 3.27Å; T84-L88 WeakPolarHBondContact OG1-CD2 3.4Å; T84-V92 HydrophobicContact CG2-CG1 4.11Å |
| 85 | L | 72.8 | Confident | 88.4 | Confident | 167 Ų | 167 | 83.7 Ų | 83.7 | 87% | 0.874 | 44% | 0.444 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 51.3 | 22 | 163.1 | -153.3 | 127.1 | 0 | 0 | 0 | 116.2 | H87 | L85-H87 PolarHBondContact O-N 3.21Š|
| 86 | G | 72.4 | Confident | 88.4 | Confident | 52 Ų | 52 | 77.5 Ų | 77.5 | 54% | 0.536 | 41% | 0.412 | S | S | . | . | S | Bend | trans | 70.1 | -29 | -178.1 | 0 | 0 | 0 | 0 | 0 | 116.1 | T84 L88 | T84-G86 PolarHBondContact O-N 3.27Å; G86-L88 PolarHBondContact O-N 2.81Å; G86-L88 VanDerWaalsContact O-N 3.13Å |
| 87 | H | 84.8 | Confident | 88.5 | Confident | 157 Ų | 157 | 78.5 Ų | 78.5 | 73% | 0.727 | 42% | 0.418 | S | S | * | . | trans | -85.7 | 79.8 | 176.1 | -164.3 | 78.2 | 0 | 0 | 0 | 111.4 | L85 E89 | L85-H87 PolarHBondContact O-N 3.21Å; H87-E89 PolarHBondContact O-N 2.87Å | ||
| 88 | L | 89.1 | Confident | 88.7 | Confident | 19 Ų | 19 | 81.8 Ų | 81.8 | 10% | 0.099 | 43% | 0.434 | C | S | . | . | trans | -73.3 | 111.8 | 177.5 | -73.4 | 167.6 | 0 | 0 | 0 | 111.8 | K73 L76 K81 T84 G86 V92 V93 L96 | K73-L88 HydrophobicContact CD-CB 4.36Å; K73-L88 HydrophobicContact CD-CD1 4.36Å; K73-L88 HydrophobicContact CG-CB 4.16Å; K73-L88 HydrophobicContact CG-CD1 3.57Å; K73-L88 HydrophobicContact CG-CG 4.48Å; L76-L88 HydrophobicContact CD1-CD1 4.15Å; K81-L88 HydrophobicContact CB-CD1 4.4Å; K81-L88 HydrophobicContact CG-CD1 4.01Å; T84-L88 WeakPolarHBondContact OG1-CD2 3.4Å; G86-L88 PolarHBondContact O-N 2.81Å; G86-L88 VanDerWaalsContact O-N 3.13Å; L88-V92 HydrophobicContact CD2-CB 4.13Å; L88-V92 HydrophobicContact CD2-CG1 3.5Å; L88-V92 VanDerWaalsContact CD2-CG1 3.5Å; L88-V93 HydrophobicContact CB-CG2 3.66Å; L88-V93 HydrophobicContact CD1-CG2 4.45Å; L88-L96 HydrophobicContact CD2-CD1 3.5Å; L88-L96 VanDerWaalsContact CD2-CD1 3.5Å | ||
| 89 | E | 93.8 | Very high | 89 | Confident | 130 Ų | 130 | 79.5 Ų | 79.5 | 61% | 0.607 | 42% | 0.422 | S | S | * | . | trans | -62.8 | 154 | 165.5 | -61.7 | -172.5 | 176.7 | 0 | 0 | 111.2 | H87 A91 V92 V93 | H87-E89 PolarHBondContact O-N 2.87Å; E89-A91 VanDerWaalsContact C-N 3.26Å; E89-A91 PolarHBondContact O-N 3.37Å; E89-A91 VanDerWaalsContact O-N 3.17Å; E89-V92 HydrophobicContact CB-CG2 4.14Å; E89-V92 WeakPolarHBondContact O-CA 3.18Å; E89-V92 PolarHBondContact O-N 3.13Å; E89-V93 PolarHBondContact O-N 2.82Å | ||
| 90 | K | 95.7 | Very high | 89.4 | Confident | 114 Ų | 114 | 75.3 Ų | 75.3 | 50% | 0.496 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -55.5 | -37.9 | -177.5 | -65.3 | -176.9 | 169.4 | -179.3 | 0 | 113.7 | N66 I69 L94 | N66-K90 PolarHBondContact OD1-NZ 3.15Å; I69-K90 HydrophobicContact CD1-CD 4.14Å; I69-K90 HydrophobicContact CD1-CG 4.42Å; I69-K90 HydrophobicContact CG2-CG 4.25Å; K90-L94 WeakPolarHBondContact O-CG 3.23Å; K90-L94 PolarHBondContact O-N 3.31Å |
| 91 | A | 95.6 | Very high | 90 | Very high | 67 Ų | 67 | 77.3 Ų | 77.3 | 55% | 0.554 | 42% | 0.416 | S | S | * | . | H | α-helix | trans | -66 | -43.4 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.4 | E89 L94 E95 | E89-A91 VanDerWaalsContact C-N 3.26Å; E89-A91 PolarHBondContact O-N 3.37Å; E89-A91 VanDerWaalsContact O-N 3.17Å; A91-L94 PolarHBondContact O-N 2.87Å; A91-E95 PolarHBondContact O-N 2.71Å |
| 92 | V | 94.9 | Very high | 90.5 | Very high | 34 Ų | 34 | 81.3 Ų | 81.3 | 21% | 0.206 | 43% | 0.433 | C | S | . | . | H | α-helix | trans | -66.4 | -38.7 | 179 | -173.5 | 0 | 0 | 0 | 0 | 111.2 | T84 L88 E89 L94 E95 L96 | T84-V92 HydrophobicContact CG2-CG1 4.11Å; L88-V92 HydrophobicContact CD2-CB 4.13Å; L88-V92 HydrophobicContact CD2-CG1 3.5Å; L88-V92 VanDerWaalsContact CD2-CG1 3.5Å; E89-V92 HydrophobicContact CB-CG2 4.14Å; E89-V92 WeakPolarHBondContact O-CA 3.18Å; E89-V92 PolarHBondContact O-N 3.13Å; V92-L94 PolarHBondContact O-N 2.97Å; V92-E95 PolarHBondContact O-N 3.39Å; V92-L96 HydrophobicContact CG1-CD1 3.92Å; V92-L96 HydrophobicContact CG1-CG 4.09Å; V92-L96 WeakPolarHBondContact O-CB 3.48Å; V92-L96 VanDerWaalsContact O-CG 3.29Å; V92-L96 WeakPolarHBondContact O-CG 3.4Å; V92-L96 PolarHBondContact O-N 3.4Å |
| 93 | V | 95.6 | Very high | 91.2 | Very high | 2 Ų | 2 | 79 Ų | 79 | 1% | 0.012 | 43% | 0.425 | C | S | . | . | H | α-helix | trans | -54.7 | -52.4 | 171.6 | 178.4 | 0 | 0 | 0 | 0 | 110.4 | I69 L72 K73 L76 L88 E89 E95 L96 T97 | I69-V93 HydrophobicContact CG2-CB 4.31Å; I69-V93 HydrophobicContact CG2-CG1 4.19Å; I69-V93 HydrophobicContact CG2-CG2 4.39Å; L72-V93 HydrophobicContact CB-CG1 3.91Å; K73-V93 HydrophobicContact CB-CG1 4Å; K73-V93 HydrophobicContact CB-CG2 3.91Å; K73-V93 HydrophobicContact CG-CG2 3.94Å; L76-V93 HydrophobicContact CD1-CG1 4.4Å; L88-V93 HydrophobicContact CB-CG2 3.66Å; L88-V93 HydrophobicContact CD1-CG2 4.45Å; E89-V93 PolarHBondContact O-N 2.82Å; V93-E95 PolarHBondContact O-N 2.95Å; V93-L96 PolarHBondContact O-N 3.24Å; V93-T97 WeakPolarHBondContact O-CB 3.37Å; V93-T97 PolarHBondContact O-N 2.98Å; V93-T97 PolarHBondContact O-OG1 3.38Å |
| 94 | L | 97.1 | Very high | 92.1 | Very high | 92 Ų | 92 | 78 Ų | 78 | 48% | 0.482 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -63.7 | -40.5 | -178.5 | -65.8 | 172.6 | 0 | 0 | 0 | 112.5 | L72 K90 A91 V92 T97 L98 | L72-L94 HydrophobicContact CD1-CD2 4.1Å; K90-L94 WeakPolarHBondContact O-CG 3.23Å; K90-L94 PolarHBondContact O-N 3.31Å; A91-L94 PolarHBondContact O-N 2.87Å; V92-L94 PolarHBondContact O-N 2.97Å; L94-T97 PolarHBondContact O-N 3.41Å; L94-L98 WeakPolarHBondContact O-CB 3.15Å; L94-L98 PolarHBondContact O-N 3.49Å |
| 95 | E | 95.8 | Very high | 93.3 | Very high | 101 Ų | 101 | 78.8 Ų | 78.8 | 47% | 0.472 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -65.3 | -46.1 | 177.8 | -167.9 | -168.1 | 151.2 | 0 | 0 | 112 | A91 V92 V93 T97 L98 K99 | A91-E95 PolarHBondContact O-N 2.71Å; V92-E95 PolarHBondContact O-N 3.39Å; V93-E95 PolarHBondContact O-N 2.95Å; E95-T97 VanDerWaalsContact C-N 3.34Å; E95-L98 PolarHBondContact O-N 2.82Å; E95-K99 WeakPolarHBondContact O-CG 3.32Å; E95-K99 PolarHBondContact O-N 3.34Å; E95-K99 WeakPolarHBondContact OE1-CE 3.26Å; E95-K99 IonicContact OE1-NZ 2.62Å; E95-K99 PolarHBondContact OE1-NZ 3.46Å |
| 96 | L | 95.7 | Very high | 94.5 | Very high | 7 Ų | 7 | 73.5 Ų | 73.5 | 4% | 0.037 | 40% | 0.403 | C | S | . | . | H | α-helix | trans | -66.1 | -37 | 176.3 | -67.3 | 179.3 | 0 | 0 | 0 | 111.5 | L76 L80 T83 L88 V92 V93 K99 H100 | L76-L96 HydrophobicContact CD1-CB 3.74Å; L76-L96 HydrophobicContact CD1-CD1 4.21Å; L76-L96 HydrophobicContact CD2-CB 3.85Å; L76-L96 HydrophobicContact CG-CB 4.48Å; L80-L96 HydrophobicContact CB-CD1 4.26Å; L80-L96 HydrophobicContact CB-CD2 4.24Å; L80-L96 HydrophobicContact CD2-CD2 4.39Å; L80-L96 WeakPolarHBondContact O-CD1 3.43Å; T83-L96 HydrophobicContact CG2-CD2 4.47Å; L88-L96 HydrophobicContact CD2-CD1 3.5Å; L88-L96 VanDerWaalsContact CD2-CD1 3.5Å; V92-L96 HydrophobicContact CG1-CD1 3.92Å; V92-L96 HydrophobicContact CG1-CG 4.09Å; V92-L96 WeakPolarHBondContact O-CB 3.48Å; V92-L96 VanDerWaalsContact O-CG 3.29Å; V92-L96 WeakPolarHBondContact O-CG 3.4Å; V92-L96 PolarHBondContact O-N 3.4Å; V93-L96 PolarHBondContact O-N 3.24Å; L96-K99 HydrophobicContact CD2-CD 4.39Å; L96-K99 PolarHBondContact O-N 2.89Å; L96-H100 WeakPolarHBondContact O-CB 3.29Å; L96-H100 PolarHBondContact O-N 3.25Å |
| 97 | T | 97.2 | Very high | 95.7 | Very high | 26 Ų | 26 | 74.6 Ų | 74.6 | 16% | 0.16 | 40% | 0.399 | C | S | . | . | H | α-helix | trans | -62.4 | -44.7 | 174.4 | -62.6 | 0 | 0 | 0 | 0 | 110.2 | L72 V93 L94 E95 K99 H100 V101 | L72-T97 HydrophobicContact CD2-CG2 3.96Å; V93-T97 WeakPolarHBondContact O-CB 3.37Å; V93-T97 PolarHBondContact O-N 2.98Å; V93-T97 PolarHBondContact O-OG1 3.38Å; L94-T97 PolarHBondContact O-N 3.41Å; E95-T97 VanDerWaalsContact C-N 3.34Å; T97-K99 PolarHBondContact O-N 2.86Å; T97-H100 PolarHBondContact O-N 2.87Å; T97-V101 HydrophobicContact CG2-CG2 4.35Å; T97-V101 WeakPolarHBondContact O-CG2 3.32Å; T97-V101 PolarHBondContact O-N 2.79Å |
| 98 | L | 97.3 | Very high | 96.4 | Very high | 94 Ų | 94 | 72.3 Ų | 72.3 | 49% | 0.492 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -62.7 | -41.9 | 176.7 | -178.2 | 62.5 | 0 | 0 | 0 | 112.2 | L94 E95 K102 | L94-L98 WeakPolarHBondContact O-CB 3.15Å; L94-L98 PolarHBondContact O-N 3.49Å; E95-L98 PolarHBondContact O-N 2.82Å; L98-K102 HydrophobicContact CD1-CD 4.48Å; L98-K102 HydrophobicContact CG-CD 4.39Å; L98-K102 WeakPolarHBondContact O-CB 3.37Å; L98-K102 VanDerWaalsContact O-CG 3.31Å; L98-K102 WeakPolarHBondContact O-CG 3.37Å; L98-K102 PolarHBondContact O-N 3.37Å |
| 99 | K | 96.1 | Very high | 96.8 | Very high | 99 Ų | 99 | 77 Ų | 77 | 43% | 0.43 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -60.6 | -48 | 174 | -73.2 | 172.7 | -174.7 | 169.6 | 0 | 111 | E95 L96 T97 K102 T103 | E95-K99 WeakPolarHBondContact O-CG 3.32Å; E95-K99 PolarHBondContact O-N 3.34Å; E95-K99 WeakPolarHBondContact OE1-CE 3.26Å; E95-K99 IonicContact OE1-NZ 2.62Å; E95-K99 PolarHBondContact OE1-NZ 3.46Å; L96-K99 HydrophobicContact CD2-CD 4.39Å; L96-K99 PolarHBondContact O-N 2.89Å; T97-K99 PolarHBondContact O-N 2.86Å; K99-K102 PolarHBondContact O-N 3.05Å; K99-T103 PolarHBondContact O-N 3.19Å; K99-T103 PolarHBondContact O-OG1 3.24Å |
| 100 | H | 96.8 | Very high | 97 | Very high | 49 Ų | 49 | 77.3 Ų | 77.3 | 23% | 0.227 | 41% | 0.414 | C | S | . | . | H | α-helix | trans | -61.9 | -47.4 | 179.6 | -175.9 | 43 | 0 | 0 | 0 | 112.4 | L76 P77 L80 L96 T97 K102 T103 L104 | L76-H100 HydrophobicContact CD2-CB 4.33Å; P77-H100 VanDerWaalsContact CG-CE1 3.47Å; P77-H100 WeakPolarHBondContact CG-CE1 3.25Å; L80-H100 HydrophobicContact CD1-CB 3.94Å; L96-H100 WeakPolarHBondContact O-CB 3.29Å; L96-H100 PolarHBondContact O-N 3.25Å; T97-H100 PolarHBondContact O-N 2.87Å; H100-K102 PolarHBondContact O-N 2.86Å; H100-T103 WeakPolarHBondContact O-CB 3.32Å; H100-T103 PolarHBondContact O-N 3.27Å; H100-L104 WeakPolarHBondContact O-CG 3.49Å; H100-L104 PolarHBondContact O-N 2.81Å |
| 101 | V | 98 | Very high | 97 | Very high | 74 Ų | 74 | 77.3 Ų | 77.3 | 45% | 0.448 | 42% | 0.416 | S | S | . | . | H | α-helix | trans | -60.3 | -44.5 | 177.5 | 171 | 0 | 0 | 0 | 0 | 111 | T97 T103 L104 S105 | T97-V101 HydrophobicContact CG2-CG2 4.35Å; T97-V101 WeakPolarHBondContact O-CG2 3.32Å; T97-V101 PolarHBondContact O-N 2.79Å; V101-T103 VanDerWaalsContact C-N 3.33Å; V101-T103 PolarHBondContact O-N 2.84Å; V101-L104 PolarHBondContact O-N 3.02Å; V101-S105 PolarHBondContact O-N 2.96Å; V101-S105 PolarHBondContact O-OG 2.76Å |
| 102 | K | 97.9 | Very high | 97.1 | Very high | 136 Ų | 136 | 79.4 Ų | 79.4 | 59% | 0.591 | 41% | 0.414 | S | S | * | . | H | α-helix | trans | -59.5 | -41.9 | 174.9 | -75.5 | 177.4 | 176.3 | -175.2 | 0 | 112.5 | L98 K99 H100 S105 A106 | L98-K102 HydrophobicContact CD1-CD 4.48Å; L98-K102 HydrophobicContact CG-CD 4.39Å; L98-K102 WeakPolarHBondContact O-CB 3.37Å; L98-K102 VanDerWaalsContact O-CG 3.31Å; L98-K102 WeakPolarHBondContact O-CG 3.37Å; L98-K102 PolarHBondContact O-N 3.37Å; K99-K102 PolarHBondContact O-N 3.05Å; H100-K102 PolarHBondContact O-N 2.86Å; K102-S105 PolarHBondContact O-N 3.15Å; K102-A106 PolarHBondContact O-N 3.4Å |
| 103 | T | 97.4 | Very high | 97.2 | Very high | 86 Ų | 86 | 83.4 Ų | 83.4 | 53% | 0.528 | 43% | 0.431 | S | S | . | . | H | α-helix | trans | -63.9 | -43.7 | 175.4 | -55.5 | 0 | 0 | 0 | 0 | 111.7 | K99 H100 V101 A106 V107 | K99-T103 PolarHBondContact O-N 3.19Å; K99-T103 PolarHBondContact O-OG1 3.24Å; H100-T103 WeakPolarHBondContact O-CB 3.32Å; H100-T103 PolarHBondContact O-N 3.27Å; V101-T103 VanDerWaalsContact C-N 3.33Å; V101-T103 PolarHBondContact O-N 2.84Å; T103-A106 PolarHBondContact O-N 3.48Å; T103-V107 WeakPolarHBondContact O-CG2 3.28Å; T103-V107 PolarHBondContact O-N 3.12Å |
| 104 | L | 97.9 | Very high | 97.2 | Very high | 83 Ų | 83 | 90 Ų | 90 | 44% | 0.435 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -61.6 | -44.9 | 175.4 | -70.7 | 177.5 | 0 | 0 | 0 | 111.8 | H100 V101 A106 V107 L108 | H100-L104 WeakPolarHBondContact O-CG 3.49Å; H100-L104 PolarHBondContact O-N 2.81Å; V101-L104 PolarHBondContact O-N 3.02Å; L104-A106 VanDerWaalsContact C-N 3.35Å; L104-A106 PolarHBondContact O-N 3.29Å; L104-V107 PolarHBondContact O-N 3.09Å; L104-L108 WeakPolarHBondContact O-CG 3.23Å; L104-L108 PolarHBondContact O-N 3.4Å |
| 105 | S | 98 | Very high | 97.1 | Very high | 66 Ų | 66 | 88.9 Ų | 88.9 | 46% | 0.462 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -58.5 | -44.4 | 175.9 | -62.8 | 0 | 0 | 0 | 0 | 112.2 | V101 K102 V107 L108 E109 | V101-S105 PolarHBondContact O-N 2.96Å; V101-S105 PolarHBondContact O-OG 2.76Å; K102-S105 PolarHBondContact O-N 3.15Å; S105-V107 PolarHBondContact O-N 2.88Å; S105-L108 PolarHBondContact O-N 3.28Å; S105-E109 WeakPolarHBondContact O-CB 3.16Å; S105-E109 PolarHBondContact O-N 2.89Å |
| 106 | A | 98.3 | Very high | 97.1 | Very high | 55 Ų | 55 | 87.7 Ų | 87.7 | 46% | 0.455 | 45% | 0.452 | S | S | . | . | H | α-helix | trans | -63.9 | -38.6 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.7 | K102 T103 L104 E109 Q110 | K102-A106 PolarHBondContact O-N 3.4Å; T103-A106 PolarHBondContact O-N 3.48Å; L104-A106 VanDerWaalsContact C-N 3.35Å; L104-A106 PolarHBondContact O-N 3.29Å; A106-E109 PolarHBondContact O-N 3.42Å; A106-Q110 WeakPolarHBondContact O-CB 3.27Å; A106-Q110 PolarHBondContact O-N 2.96Å |
| 107 | V | 97.7 | Very high | 97 | Very high | 76 Ų | 76 | 89.6 Ų | 89.6 | 46% | 0.461 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -68.2 | -39.6 | 175.6 | 171.2 | 0 | 0 | 0 | 0 | 111.7 | T103 L104 S105 Q110 Q111 | T103-V107 WeakPolarHBondContact O-CG2 3.28Å; T103-V107 PolarHBondContact O-N 3.12Å; L104-V107 PolarHBondContact O-N 3.09Å; S105-V107 PolarHBondContact O-N 2.88Å; V107-Q110 PolarHBondContact O-N 3.01Å; V107-Q111 WeakPolarHBondContact O-CB 3.34Å; V107-Q111 PolarHBondContact O-N 2.73Å |
| 108 | L | 97.9 | Very high | 96.8 | Very high | 109 Ų | 109 | 92.8 Ų | 92.8 | 57% | 0.571 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -65.7 | -41.5 | 175 | -70.2 | 172.6 | 0 | 0 | 0 | 111.5 | L104 S105 Q111 Q112 | L104-L108 WeakPolarHBondContact O-CG 3.23Å; L104-L108 PolarHBondContact O-N 3.4Å; S105-L108 PolarHBondContact O-N 3.28Å; L108-Q111 PolarHBondContact O-N 3.23Å; L108-Q112 WeakPolarHBondContact O-CB 3.37Å; L108-Q112 PolarHBondContact O-N 3.33Å |
| 109 | E | 97.6 | Very high | 96.5 | Very high | 118 Ų | 118 | 93.5 Ų | 93.5 | 55% | 0.551 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -63.4 | -46.4 | 174.9 | -171.6 | -177.9 | 174.1 | 0 | 0 | 111.4 | S105 A106 Q111 Q112 Q113 | S105-E109 WeakPolarHBondContact O-CB 3.16Å; S105-E109 PolarHBondContact O-N 2.89Å; A106-E109 PolarHBondContact O-N 3.42Å; E109-Q111 VanDerWaalsContact C-N 3.3Å; E109-Q111 PolarHBondContact O-N 3.44Å; E109-Q112 PolarHBondContact O-N 3.39Å; E109-Q113 WeakPolarHBondContact O-CG 3.25Å; E109-Q113 PolarHBondContact O-N 3.33Å; E109-Q113 PolarHBondContact OE1-NE2 3.48Å |
| 110 | Q | 97.6 | Very high | 96 | Very high | 135 Ų | 135 | 95.4 Ų | 95.4 | 63% | 0.631 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -60.1 | -40.2 | 175 | -173.5 | -174.1 | 2.2 | 0 | 0 | 111.8 | A106 V107 K114 | A106-Q110 WeakPolarHBondContact O-CB 3.27Å; A106-Q110 PolarHBondContact O-N 2.96Å; V107-Q110 PolarHBondContact O-N 3.01Å; Q110-K114 WeakPolarHBondContact O-CB 3.33Å; Q110-K114 PolarHBondContact O-N 2.89Å |
| 111 | Q | 97.5 | Very high | 95.4 | Very high | 115 Ų | 115 | 97.7 Ų | 97.7 | 54% | 0.537 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -64.8 | -43.9 | 175.2 | -176.2 | 178.9 | 91.4 | 0 | 0 | 111.2 | V107 L108 E109 K114 I115 | V107-Q111 WeakPolarHBondContact O-CB 3.34Å; V107-Q111 PolarHBondContact O-N 2.73Å; L108-Q111 PolarHBondContact O-N 3.23Å; E109-Q111 VanDerWaalsContact C-N 3.3Å; E109-Q111 PolarHBondContact O-N 3.44Å; Q111-K114 PolarHBondContact O-N 2.87Å; Q111-I115 HydrophobicContact CG-CD1 4.05Å; Q111-I115 WeakPolarHBondContact O-CG1 3.34Å; Q111-I115 PolarHBondContact O-N 3.19Å |
| 112 | Q | 97.3 | Very high | 94.4 | Very high | 110 Ų | 110 | 100 Ų | 100 | 51% | 0.514 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -62.3 | -45 | 176.4 | -175.9 | 60.4 | 42.3 | 0 | 0 | 111.6 | L108 E109 K114 I115 V116 | L108-Q112 WeakPolarHBondContact O-CB 3.37Å; L108-Q112 PolarHBondContact O-N 3.33Å; E109-Q112 PolarHBondContact O-N 3.39Å; Q112-K114 VanDerWaalsContact C-N 3.31Å; Q112-K114 PolarHBondContact O-N 2.91Å; Q112-I115 PolarHBondContact O-N 2.88Å; Q112-V116 WeakPolarHBondContact O-CG2 3.46Å; Q112-V116 PolarHBondContact O-N 3.13Å |
| 113 | Q | 96.8 | Very high | 92.8 | Very high | 119 Ų | 119 | 98.9 Ų | 98.9 | 56% | 0.556 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -59.9 | -41.1 | 174.7 | -71 | 176.3 | 11.5 | 0 | 0 | 111.4 | E109 V116 A117 | E109-Q113 WeakPolarHBondContact O-CG 3.25Å; E109-Q113 PolarHBondContact O-N 3.33Å; E109-Q113 PolarHBondContact OE1-NE2 3.48Å; Q113-V116 PolarHBondContact O-N 2.82Å; Q113-A117 WeakPolarHBondContact O-CB 3.36Å; Q113-A117 PolarHBondContact O-N 3.38Å |
| 114 | K | 96.2 | Very high | 90.9 | Very high | 141 Ų | 141 | 99.6 Ų | 99.6 | 61% | 0.613 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -65.7 | -40.6 | 175.7 | -173.3 | 177.4 | -179.2 | -179.5 | 0 | 112.5 | Q110 Q111 Q112 A117 L118 | Q110-K114 WeakPolarHBondContact O-CB 3.33Å; Q110-K114 PolarHBondContact O-N 2.89Å; Q111-K114 PolarHBondContact O-N 2.87Å; Q112-K114 VanDerWaalsContact C-N 3.31Å; Q112-K114 PolarHBondContact O-N 2.91Å; K114-A117 PolarHBondContact O-N 3.39Å; K114-L118 HydrophobicContact CG-CD1 4.21Å; K114-L118 VanDerWaalsContact O-CG 3.32Å; K114-L118 WeakPolarHBondContact O-CG 3.41Å; K114-L118 PolarHBondContact O-N 3.43Å |
| 115 | I | 95.1 | Very high | 88.8 | Confident | 67 Ų | 67 | 97.7 Ų | 97.7 | 34% | 0.344 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -62.5 | -46.2 | 174.9 | -69.5 | 164.2 | 0 | 0 | 0 | 110 | Q111 Q112 A117 L118 Q119 | Q111-I115 HydrophobicContact CG-CD1 4.05Å; Q111-I115 WeakPolarHBondContact O-CG1 3.34Å; Q111-I115 PolarHBondContact O-N 3.19Å; Q112-I115 PolarHBondContact O-N 2.88Å; I115-A117 VanDerWaalsContact C-N 3.35Å; I115-A117 PolarHBondContact O-N 3.34Å; I115-L118 PolarHBondContact O-N 3.18Å; I115-Q119 HydrophobicContact CG2-CG 4.32Å; I115-Q119 WeakPolarHBondContact O-CB 3.27Å; I115-Q119 VanDerWaalsContact O-CG 3.28Å; I115-Q119 WeakPolarHBondContact O-CG 3.4Å; I115-Q119 PolarHBondContact O-N 3.03Å |
| 116 | V | 94.4 | Very high | 86.8 | Confident | 76 Ų | 76 | 100.4 Ų | 100.4 | 46% | 0.461 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -64.5 | -37.6 | 178.1 | 172.2 | 0 | 0 | 0 | 0 | 111.9 | Q112 Q113 Q119 K120 | Q112-V116 WeakPolarHBondContact O-CG2 3.46Å; Q112-V116 PolarHBondContact O-N 3.13Å; Q113-V116 PolarHBondContact O-N 2.82Å; V116-Q119 PolarHBondContact O-N 3.03Å; V116-K120 WeakPolarHBondContact O-CB 3.17Å; V116-K120 PolarHBondContact O-N 3.39Å |
| 117 | A | 94.1 | Very high | 84.4 | Confident | 47 Ų | 47 | 102.9 Ų | 102.9 | 39% | 0.388 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -63 | -50.6 | 173.7 | 0 | 0 | 0 | 0 | 0 | 111.5 | Q113 K114 I115 Q119 K120 D121 | Q113-A117 WeakPolarHBondContact O-CB 3.36Å; Q113-A117 PolarHBondContact O-N 3.38Å; K114-A117 PolarHBondContact O-N 3.39Å; I115-A117 VanDerWaalsContact C-N 3.35Å; I115-A117 PolarHBondContact O-N 3.34Å; A117-Q119 VanDerWaalsContact C-N 3.31Å; A117-Q119 PolarHBondContact O-N 3.36Å; A117-K120 CarbonylContact O-C 3.58Å; A117-K120 WeakPolarHBondContact O-CA 3.24Å; A117-K120 WeakPolarHBondContact O-CB 3.17Å; A117-K120 PolarHBondContact O-N 3.45Å; A117-D121 VanDerWaalsContact O-CG 3.24Å; A117-D121 PolarHBondContact O-N 2.88Å |
| 118 | L | 93.4 | Very high | 82.2 | Confident | 94 Ų | 94 | 102.6 Ų | 102.6 | 49% | 0.492 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -62.9 | -36.5 | 177.1 | -69 | 171.1 | 0 | 0 | 0 | 112.7 | K114 I115 D121 L122 | K114-L118 HydrophobicContact CG-CD1 4.21Å; K114-L118 VanDerWaalsContact O-CG 3.32Å; K114-L118 WeakPolarHBondContact O-CG 3.41Å; K114-L118 PolarHBondContact O-N 3.43Å; I115-L118 PolarHBondContact O-N 3.18Å; L118-D121 PolarHBondContact O-N 3.22Å; L118-L122 PolarHBondContact O-N 2.92Å |
| 119 | Q | 90.1 | Very high | 79.9 | Confident | 108 Ų | 108 | 101.5 Ų | 101.5 | 51% | 0.505 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -65.3 | -39.1 | 172.2 | -77.8 | 176.6 | -30.3 | 0 | 0 | 111.5 | I115 V116 A117 Q123 | I115-Q119 HydrophobicContact CG2-CG 4.32Å; I115-Q119 WeakPolarHBondContact O-CB 3.27Å; I115-Q119 VanDerWaalsContact O-CG 3.28Å; I115-Q119 WeakPolarHBondContact O-CG 3.4Å; I115-Q119 PolarHBondContact O-N 3.03Å; V116-Q119 PolarHBondContact O-N 3.03Å; A117-Q119 VanDerWaalsContact C-N 3.31Å; A117-Q119 PolarHBondContact O-N 3.36Å; Q119-Q123 WeakPolarHBondContact O-CB 3.42Å; Q119-Q123 VanDerWaalsContact O-CG 3.23Å; Q119-Q123 WeakPolarHBondContact O-CG 3.39Å; Q119-Q123 PolarHBondContact O-N 2.85Å |
| 120 | K | 86.8 | Confident | 77.7 | Confident | 139 Ų | 139 | 98.8 Ų | 98.8 | 60% | 0.604 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -65.2 | -40.7 | 173.8 | -175.3 | -177.1 | 175.4 | -174.3 | 0 | 111.1 | V116 A117 Q123 I124 | V116-K120 WeakPolarHBondContact O-CB 3.17Å; V116-K120 PolarHBondContact O-N 3.39Å; A117-K120 CarbonylContact O-C 3.58Å; A117-K120 WeakPolarHBondContact O-CA 3.24Å; A117-K120 WeakPolarHBondContact O-CB 3.17Å; A117-K120 PolarHBondContact O-N 3.45Å; K120-Q123 CarbonylContact O-C 3.6Å; K120-Q123 PolarHBondContact O-N 2.89Å; K120-I124 HydrophobicContact CG-CD1 4.04Å; K120-I124 HydrophobicContact CG-CG1 4.48Å; K120-I124 VanDerWaalsContact O-CG1 3.24Å; K120-I124 WeakPolarHBondContact O-CG1 3.5Å; K120-I124 PolarHBondContact O-N 3.41Å |
| 121 | D | 82.6 | Confident | 75.6 | Confident | 97 Ų | 97 | 94.7 Ų | 94.7 | 52% | 0.519 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -65.4 | -41.4 | 178.2 | -61.2 | -24 | 0 | 0 | 0 | 111.3 | A117 L118 I124 G125 | A117-D121 VanDerWaalsContact O-CG 3.24Å; A117-D121 PolarHBondContact O-N 2.88Å; L118-D121 PolarHBondContact O-N 3.22Å; D121-I124 PolarHBondContact O-N 3.01Å; D121-G125 PolarHBondContact O-N 3.48Å |
| 122 | L | 77.3 | Confident | 73.6 | Confident | 124 Ų | 124 | 92.1 Ų | 92.1 | 65% | 0.649 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -64.4 | -44.3 | 170 | -109.7 | 71.6 | 0 | 0 | 0 | 112.2 | L118 I124 G125 D126 | L118-L122 PolarHBondContact O-N 2.92Å; L122-I124 PolarHBondContact O-N 3.49Å; L122-G125 CarbonylContact O-C 3.46Å; L122-G125 VanDerWaalsContact O-CA 3.25Å; L122-G125 WeakPolarHBondContact O-CA 3.38Å; L122-G125 PolarHBondContact O-N 3.04Å; L122-D126 PolarHBondContact O-N 3.24Å |
| 123 | Q | 64.1 | Low | 71.8 | Confident | 111 Ų | 111 | 89.9 Ų | 89.9 | 52% | 0.519 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -72 | -12.6 | 178.6 | -75.3 | -131.7 | 99.3 | 0 | 0 | 113.6 | Q119 K120 N127 | Q119-Q123 WeakPolarHBondContact O-CB 3.42Å; Q119-Q123 VanDerWaalsContact O-CG 3.23Å; Q119-Q123 WeakPolarHBondContact O-CG 3.39Å; Q119-Q123 PolarHBondContact O-N 2.85Å; K120-Q123 CarbonylContact O-C 3.6Å; K120-Q123 PolarHBondContact O-N 2.89Å; Q123-N127 WeakPolarHBondContact CB-ND2 2.98Å; Q123-N127 VanDerWaalsContact CD-ND2 3.29Å; Q123-N127 WeakPolarHBondContact O-CA 3.34Å; Q123-N127 WeakPolarHBondContact O-CB 3.39Å; Q123-N127 PolarHBondContact O-N 2.92Å; Q123-N127 PolarHBondContact O-ND2 3.43Å; Q123-N127 PolarHBondContact OE1-ND2 3.44Å |
| 124 | I | 58.1 | Low | 70.5 | Confident | 101 Ų | 101 | 86.2 Ų | 86.2 | 52% | 0.518 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -76.8 | -28.4 | 164 | -73.5 | 161.3 | 0 | 0 | 0 | 110.1 | K120 D121 L122 V128 | K120-I124 HydrophobicContact CG-CD1 4.04Å; K120-I124 HydrophobicContact CG-CG1 4.48Å; K120-I124 VanDerWaalsContact O-CG1 3.24Å; K120-I124 WeakPolarHBondContact O-CG1 3.5Å; K120-I124 PolarHBondContact O-N 3.41Å; D121-I124 PolarHBondContact O-N 3.01Å; L122-I124 PolarHBondContact O-N 3.49Å; I124-V128 WeakPolarHBondContact O-CG2 2.84Å |
| 125 | G | 54.3 | Low | 69.4 | Low | 44 Ų | 44 | 82.7 Ų | 82.7 | 45% | 0.454 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -69.6 | -41.5 | 165.9 | 0 | 0 | 0 | 0 | 0 | 113.2 | D121 L122 | D121-G125 PolarHBondContact O-N 3.48Å; L122-G125 CarbonylContact O-C 3.46Å; L122-G125 VanDerWaalsContact O-CA 3.25Å; L122-G125 WeakPolarHBondContact O-CA 3.38Å; L122-G125 PolarHBondContact O-N 3.04Å |
| 126 | D | 55.6 | Low | 68.8 | Low | 122 Ų | 122 | 82.9 Ų | 82.9 | 65% | 0.652 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -95.5 | -19.2 | -172 | -63.9 | -29.2 | 0 | 0 | 0 | 115.4 | L122 | L122-D126 PolarHBondContact O-N 3.24Å |
| 127 | N | 48.7 | Very low | 68.2 | Low | 108 Ų | 108 | 85.5 Ų | 85.5 | 58% | 0.578 | 50% | 0.5 | S | S | * | . | trans | -105.8 | 13 | 175.5 | -62.5 | -92.5 | 0 | 0 | 0 | 114 | Q123 G129 | Q123-N127 WeakPolarHBondContact CB-ND2 2.98Å; Q123-N127 VanDerWaalsContact CD-ND2 3.29Å; Q123-N127 WeakPolarHBondContact O-CA 3.34Å; Q123-N127 WeakPolarHBondContact O-CB 3.39Å; Q123-N127 PolarHBondContact O-N 2.92Å; Q123-N127 PolarHBondContact O-ND2 3.43Å; Q123-N127 PolarHBondContact OE1-ND2 3.44Å; N127-G129 VanDerWaalsContact C-N 3.31Å; N127-G129 PolarHBondContact O-N 3.46Å | ||
| 128 | V | 51.7 | Low | 67.7 | Low | 69 Ų | 69 | 89.5 Ų | 89.5 | 42% | 0.418 | 51% | 0.512 | S | S | . | . | S | Bend | trans | -64.1 | 112 | 135.3 | -157.5 | 0 | 0 | 0 | 0 | 103.5 | I124 D130 T134 | I124-V128 WeakPolarHBondContact O-CG2 2.84Å; V128-D130 HydrophobicContact CB-CB 4.33Å; V128-D130 HydrophobicContact CG1-CB 3.59Å; V128-D130 PolarHBondContact O-N 2.97Å; V128-T134 HydrophobicContact CB-CG2 4.5Å |
| 129 | G | 49.3 | Very low | 67.5 | Low | 87 Ų | 87 | 91.2 Ų | 91.2 | 90% | 0.897 | 52% | 0.516 | S | S | * | . | S | Bend | trans | -71.1 | 45 | -178.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | N127 | N127-G129 VanDerWaalsContact C-N 3.31Å; N127-G129 PolarHBondContact O-N 3.46Å |
| 130 | D | 50.5 | Low | 67.4 | Low | 60 Ų | 60 | 87.9 Ų | 87.9 | 32% | 0.321 | 50% | 0.499 | S | S | . | . | trans | -164.9 | 47.6 | -151.3 | -144.4 | -12.3 | 0 | 0 | 0 | 110.2 | V128 A132 E133 T134 | V128-D130 HydrophobicContact CB-CB 4.33Å; V128-D130 HydrophobicContact CG1-CB 3.59Å; V128-D130 PolarHBondContact O-N 2.97Å; D130-A132 PolarHBondContact O-N 3.47Å; D130-A132 VanDerWaalsContact O-N 3.13Å; D130-E133 HydrophobicContact CB-CB 4.45Å; D130-E133 VanDerWaalsContact CG-CB 3.47Å; D130-E133 VanDerWaalsContact CG-CG 3.43Å; D130-E133 PolarHBondContact O-N 3.48Å; D130-E133 WeakPolarHBondContact OD1-CB 3.42Å; D130-E133 VanDerWaalsContact OD1-CG 3.26Å; D130-E133 WeakPolarHBondContact OD1-CG 3.5Å; D130-E133 PolarHBondContact OD1-N 2.96Å; D130-E133 WeakPolarHBondContact OD2-CB 3.44Å; D130-E133 WeakPolarHBondContact OD2-CG 3.47Å; D130-T134 PolarHBondContact O-N 3.12Å; D130-T134 PolarHBondContact O-OG1 2.92Å | ||
| 131 | G | 53.4 | Low | 67.4 | Low | 49 Ų | 49 | 84.7 Ų | 84.7 | 51% | 0.505 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -56.3 | -16.1 | 160.1 | 0 | 0 | 0 | 0 | 0 | 112 | T134 S135 | G131-T134 WeakPolarHBondContact CA-OG1 3.34Å; G131-S135 WeakPolarHBondContact O-CB 3.43Å; G131-S135 PolarHBondContact O-N 3.31Å; G131-S135 PolarHBondContact O-OG 3.36Å |
| 132 | A | 56.2 | Low | 67.8 | Low | 62 Ų | 62 | 82 Ų | 82 | 51% | 0.512 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -69.3 | -69.1 | 169 | 0 | 0 | 0 | 0 | 0 | 110.9 | D130 T134 S135 E136 | D130-A132 PolarHBondContact O-N 3.47Å; D130-A132 VanDerWaalsContact O-N 3.13Å; A132-T134 VanDerWaalsContact C-N 3.3Å; A132-T134 PolarHBondContact O-N 2.94Å; A132-S135 PolarHBondContact O-N 2.92Å; A132-S135 VanDerWaalsContact O-N 3.12Å; A132-S135 PolarHBondContact O-OG 2.9Å; A132-E136 WeakPolarHBondContact O-CB 3.31Å; A132-E136 PolarHBondContact O-N 2.88Å |
| 133 | E | 58.7 | Low | 68.6 | Low | 62 Ų | 62 | 78.7 Ų | 78.7 | 29% | 0.29 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -58.6 | -39.6 | -178 | -69.3 | -55.8 | 136.7 | 0 | 0 | 112.3 | D130 S135 E136 E137 | D130-E133 HydrophobicContact CB-CB 4.45Å; D130-E133 VanDerWaalsContact CG-CB 3.47Å; D130-E133 VanDerWaalsContact CG-CG 3.43Å; D130-E133 PolarHBondContact O-N 3.48Å; D130-E133 WeakPolarHBondContact OD1-CB 3.42Å; D130-E133 VanDerWaalsContact OD1-CG 3.26Å; D130-E133 WeakPolarHBondContact OD1-CG 3.5Å; D130-E133 PolarHBondContact OD1-N 2.96Å; D130-E133 WeakPolarHBondContact OD2-CB 3.44Å; D130-E133 WeakPolarHBondContact OD2-CG 3.47Å; E133-S135 PolarHBondContact O-N 3.45Å; E133-E136 CarbonylContact O-C 3.57Å; E133-E136 PolarHBondContact O-N 3.43Å; E133-E137 WeakPolarHBondContact O-CB 3.33Å; E133-E137 WeakPolarHBondContact O-CG 3.43Å; E133-E137 PolarHBondContact O-N 3.34Å |
| 134 | T | 70.1 | Confident | 69.8 | Low | 43 Ų | 43 | 77.9 Ų | 77.9 | 26% | 0.264 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -67.8 | -35.6 | 178.2 | 52.5 | 0 | 0 | 0 | 0 | 113.5 | V128 D130 G131 A132 M138 | V128-T134 HydrophobicContact CB-CG2 4.5Å; D130-T134 PolarHBondContact O-N 3.12Å; D130-T134 PolarHBondContact O-OG1 2.92Å; G131-T134 WeakPolarHBondContact CA-OG1 3.34Å; A132-T134 VanDerWaalsContact C-N 3.3Å; A132-T134 PolarHBondContact O-N 2.94Å; T134-M138 VanDerWaalsContact O-CE 3.23Å; T134-M138 WeakPolarHBondContact O-CE 3.32Å; T134-M138 WeakPolarHBondContact O-CG 3.48Å; T134-M138 PolarHBondContact O-N 3.46Å; T134-M138 VanDerWaalsContact O-N 3.15Å |
| 135 | S | 73.7 | Confident | 71.5 | Confident | 67 Ų | 67 | 78.6 Ų | 78.6 | 47% | 0.469 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -78.3 | -29.6 | 173.3 | 70.6 | 0 | 0 | 0 | 0 | 112.7 | G131 A132 E133 M138 F139 | G131-S135 WeakPolarHBondContact O-CB 3.43Å; G131-S135 PolarHBondContact O-N 3.31Å; G131-S135 PolarHBondContact O-OG 3.36Å; A132-S135 PolarHBondContact O-N 2.92Å; A132-S135 VanDerWaalsContact O-N 3.12Å; A132-S135 PolarHBondContact O-OG 2.9Å; E133-S135 PolarHBondContact O-N 3.45Å; S135-M138 PolarHBondContact O-N 2.89Å; S135-F139 WeakPolarHBondContact O-CB 3.5Å; S135-F139 PolarHBondContact O-N 3.37Å |
| 136 | E | 81.3 | Confident | 73.3 | Confident | 70 Ų | 70 | 80.2 Ų | 80.2 | 33% | 0.327 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -69.9 | -41.6 | 172.4 | 175 | 155.9 | 167.7 | 0 | 0 | 111.3 | A132 E133 F139 R140 | A132-E136 WeakPolarHBondContact O-CB 3.31Å; A132-E136 PolarHBondContact O-N 2.88Å; E133-E136 CarbonylContact O-C 3.57Å; E133-E136 PolarHBondContact O-N 3.43Å; E136-F139 CarbonylContact O-C 3.54Å; E136-F139 PolarHBondContact O-N 3.48Å; E136-R140 HydrophobicContact CG-CG 4.12Å; E136-R140 VanDerWaalsContact O-CB 3.27Å; E136-R140 WeakPolarHBondContact O-CB 3.33Å; E136-R140 WeakPolarHBondContact O-CD 3.39Å; E136-R140 WeakPolarHBondContact O-CG 3.49Å; E136-R140 PolarHBondContact O-N 2.95Å; E136-R140 WeakPolarHBondContact OE1-CD 3.48Å; E136-R140 IonicContact OE1-CZ 2.73Å; E136-R140 IonicContact OE1-NH1 3.7Å; E136-R140 PolarHBondContact OE1-NH1 2.87Å |
| 137 | E | 82.7 | Confident | 75.1 | Confident | 132 Ų | 132 | 75 Ų | 75 | 62% | 0.617 | 44% | 0.441 | S | S | * | . | H | α-helix | trans | -62.3 | -41.4 | 171 | -79.5 | -164.1 | 131 | 0 | 0 | 111.7 | E133 R140 S141 | E133-E137 WeakPolarHBondContact O-CB 3.33Å; E133-E137 WeakPolarHBondContact O-CG 3.43Å; E133-E137 PolarHBondContact O-N 3.34Å; E137-R140 PolarHBondContact O-N 3.05Å; E137-S141 VanDerWaalsContact O-CB 3.26Å; E137-S141 WeakPolarHBondContact O-CB 3.35Å; E137-S141 PolarHBondContact O-N 3.32Å; E137-S141 PolarHBondContact O-OG 3.42Å |
| 138 | M | 83.9 | Confident | 77.1 | Confident | 130 Ų | 130 | 75.8 Ų | 75.8 | 64% | 0.64 | 44% | 0.436 | S | S | * | . | H | α-helix | trans | -63.2 | -41 | 172.5 | -78.4 | -172.7 | -86.4 | 0 | 0 | 111.9 | T134 S135 S141 G142 | T134-M138 VanDerWaalsContact O-CE 3.23Å; T134-M138 WeakPolarHBondContact O-CE 3.32Å; T134-M138 WeakPolarHBondContact O-CG 3.48Å; T134-M138 PolarHBondContact O-N 3.46Å; T134-M138 VanDerWaalsContact O-N 3.15Å; S135-M138 PolarHBondContact O-N 2.89Å; M138-S141 WeakPolarHBondContact CA-OG 3.4Å; M138-S141 PolarHBondContact O-OG 3.29Å; M138-G142 PolarHBondContact O-N 3.14Å |
| 139 | F | 88.6 | Confident | 79.1 | Confident | 130 Ų | 130 | 77 Ų | 77 | 57% | 0.57 | 44% | 0.438 | S | S | * | . | H | α-helix | trans | -65.3 | -46.2 | 174 | 173.3 | -98.9 | 0 | 0 | 0 | 112.2 | S135 E136 G142 F143 V179 | S135-F139 WeakPolarHBondContact O-CB 3.5Å; S135-F139 PolarHBondContact O-N 3.37Å; E136-F139 CarbonylContact O-C 3.54Å; E136-F139 PolarHBondContact O-N 3.48Å; F139-G142 PolarHBondContact O-N 3.44Å; F139-F143 VanDerWaalsContact O-CB 3.28Å; F139-F143 WeakPolarHBondContact O-CB 3.34Å; F139-F143 PolarHBondContact O-N 2.86Å; F139-V179 HydrophobicContact CE1-CG1 4.41Å |
| 140 | R | 88.1 | Confident | 81 | Confident | 39 Ų | 39 | 75.4 Ų | 75.4 | 15% | 0.147 | 41% | 0.411 | C | S | . | . | H | α-helix | trans | -66.2 | -40.6 | -178.9 | -73.7 | 161.7 | 74.4 | 143.4 | -9.7 | 111.4 | E136 E137 H144 V179 L180 | E136-R140 HydrophobicContact CG-CG 4.12Å; E136-R140 VanDerWaalsContact O-CB 3.27Å; E136-R140 WeakPolarHBondContact O-CB 3.33Å; E136-R140 WeakPolarHBondContact O-CD 3.39Å; E136-R140 WeakPolarHBondContact O-CG 3.49Å; E136-R140 PolarHBondContact O-N 2.95Å; E136-R140 WeakPolarHBondContact OE1-CD 3.48Å; E136-R140 IonicContact OE1-CZ 2.73Å; E136-R140 IonicContact OE1-NH1 3.7Å; E136-R140 PolarHBondContact OE1-NH1 2.87Å; E137-R140 PolarHBondContact O-N 3.05Å; R140-H144 WeakPolarHBondContact O-CB 3.42Å; R140-H144 PolarHBondContact O-N 3.32Å; R140-V179 HydrophobicContact CG-CG1 3.87Å; R140-V179 PolarHBondContact NE-O 2.91Å; R140-V179 PolarHBondContact NH1-O 2.93Å; R140-L180 PolarHBondContact NH2-O 2.95Å |
| 141 | S | 87.1 | Confident | 82.8 | Confident | 71 Ų | 71 | 74.8 Ų | 74.8 | 50% | 0.497 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -66.8 | -41.4 | 173.6 | 60.3 | 0 | 0 | 0 | 0 | 112.2 | E137 M138 H144 F145 | E137-S141 VanDerWaalsContact O-CB 3.26Å; E137-S141 WeakPolarHBondContact O-CB 3.35Å; E137-S141 PolarHBondContact O-N 3.32Å; E137-S141 PolarHBondContact O-OG 3.42Å; M138-S141 WeakPolarHBondContact CA-OG 3.4Å; M138-S141 PolarHBondContact O-OG 3.29Å; S141-H144 PolarHBondContact O-N 2.6Å; S141-F145 WeakPolarHBondContact O-CB 3.38Å; S141-F145 PolarHBondContact O-N 3.06Å |
| 142 | G | 91.3 | Very high | 84.5 | Confident | 40 Ų | 40 | 78 Ų | 78 | 41% | 0.412 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -64.2 | -45.4 | 173.7 | 0 | 0 | 0 | 0 | 0 | 113.4 | M138 F139 F145 C146 | M138-G142 PolarHBondContact O-N 3.14Å; F139-G142 PolarHBondContact O-N 3.44Å; G142-F145 PolarHBondContact O-N 2.97Å; G142-C146 PolarHBondContact O-N 2.9Å |
| 143 | F | 92.7 | Very high | 86 | Confident | 56 Ų | 56 | 81.3 Ų | 81.3 | 25% | 0.246 | 41% | 0.409 | C | S | . | . | H | α-helix | trans | -59.1 | -49 | 173.2 | 173.6 | -88.8 | 0 | 0 | 0 | 111 | F139 F145 C146 A147 V175 A176 V179 | F139-F143 VanDerWaalsContact O-CB 3.28Å; F139-F143 WeakPolarHBondContact O-CB 3.34Å; F139-F143 PolarHBondContact O-N 2.86Å; F143-F145 VanDerWaalsContact C-N 3.33Å; F143-F145 PolarHBondContact O-N 3.45Å; F143-C146 PolarHBondContact O-N 3.23Å; F143-A147 HydrophobicContact CE1-CB 4.25Å; F143-A147 VanDerWaalsContact O-CB 3.27Å; F143-A147 WeakPolarHBondContact O-CB 3.29Å; F143-A147 PolarHBondContact O-N 3.14Å; F143-V175 HydrophobicContact CE2-CG1 4.02Å; F143-V175 HydrophobicContact CZ-CB 4.33Å; F143-V175 HydrophobicContact CZ-CG1 3.72Å; F143-A176 HydrophobicContact CE1-CB 3.92Å; F143-V179 HydrophobicContact CD1-CG1 4.09Å; F143-V179 HydrophobicContact CE1-CB 4.46Å; F143-V179 HydrophobicContact CG-CG1 4.44Å |
| 144 | H | 90.8 | Very high | 87.3 | Confident | 93 Ų | 93 | 79.5 Ų | 79.5 | 43% | 0.431 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -63.5 | -37.2 | 178.7 | 179.8 | -101.6 | 0 | 0 | 0 | 112.3 | R140 S141 R148 | R140-H144 WeakPolarHBondContact O-CB 3.42Å; R140-H144 PolarHBondContact O-N 3.32Å; S141-H144 PolarHBondContact O-N 2.6Å; H144-R148 VanDerWaalsContact O-CB 3.22Å; H144-R148 WeakPolarHBondContact O-CB 3.31Å; H144-R148 PolarHBondContact O-N 3.32Å |
| 145 | F | 92.1 | Very high | 87.9 | Confident | 117 Ų | 117 | 81.5 Ų | 81.5 | 51% | 0.513 | 42% | 0.422 | S | S | . | . | H | α-helix | trans | -62.3 | -49.1 | 173.6 | -168.4 | -80.5 | 0 | 0 | 0 | 111.4 | S141 G142 F143 R148 E149 | S141-F145 WeakPolarHBondContact O-CB 3.38Å; S141-F145 PolarHBondContact O-N 3.06Å; G142-F145 PolarHBondContact O-N 2.97Å; F143-F145 VanDerWaalsContact C-N 3.33Å; F143-F145 PolarHBondContact O-N 3.45Å; F145-R148 PolarHBondContact O-N 3.05Å; F145-E149 PolarHBondContact O-N 3.09Å |
| 146 | C | 93.9 | Very high | 88.2 | Confident | 78 Ų | 78 | 82 Ų | 82 | 53% | 0.527 | 43% | 0.425 | S | S | . | . | H | α-helix | trans | -62.2 | -47.5 | 177.3 | -174.5 | 0 | 0 | 0 | 0 | 112 | G142 F143 R148 E149 V150 | G142-C146 PolarHBondContact O-N 2.9Å; F143-C146 PolarHBondContact O-N 3.23Å; C146-R148 VanDerWaalsContact C-N 3.35Å; C146-R148 PolarHBondContact O-N 3.39Å; C146-E149 PolarHBondContact O-N 2.97Å; C146-V150 WeakPolarHBondContact O-CG2 3.12Å; C146-V150 PolarHBondContact O-N 3.1Å |
| 147 | A | 92.3 | Very high | 87.9 | Confident | 11 Ų | 11 | 81.9 Ų | 81.9 | 9% | 0.091 | 43% | 0.425 | C | S | . | . | H | α-helix | trans | -57.2 | -46.7 | 176.7 | 0 | 0 | 0 | 0 | 0 | 111.5 | F143 E149 V150 L151 I172 | F143-A147 HydrophobicContact CE1-CB 4.25Å; F143-A147 VanDerWaalsContact O-CB 3.27Å; F143-A147 WeakPolarHBondContact O-CB 3.29Å; F143-A147 PolarHBondContact O-N 3.14Å; A147-E149 PolarHBondContact O-N 3.17Å; A147-V150 PolarHBondContact O-N 3.45Å; A147-L151 WeakPolarHBondContact O-CB 3.08Å; A147-L151 WeakPolarHBondContact O-CG 3.39Å; A147-L151 PolarHBondContact O-N 3.48Å; A147-I172 HydrophobicContact CB-CG2 3.64Å |
| 148 | R | 90.8 | Very high | 86.9 | Confident | 125 Ų | 125 | 84.2 Ų | 84.2 | 47% | 0.472 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -62.1 | -40.7 | 177 | -175.9 | 179 | 64.1 | -156.8 | -3.3 | 112.3 | H144 F145 C146 L151 H152 | H144-R148 VanDerWaalsContact O-CB 3.22Å; H144-R148 WeakPolarHBondContact O-CB 3.31Å; H144-R148 PolarHBondContact O-N 3.32Å; F145-R148 PolarHBondContact O-N 3.05Å; C146-R148 VanDerWaalsContact C-N 3.35Å; C146-R148 PolarHBondContact O-N 3.39Å; R148-L151 PolarHBondContact O-N 3.23Å; R148-H152 VanDerWaalsContact O-CB 3.28Å; R148-H152 WeakPolarHBondContact O-CB 3.41Å; R148-H152 PolarHBondContact O-N 3.26Å |
| 149 | E | 92.8 | Very high | 85.8 | Confident | 95 Ų | 95 | 84.4 Ų | 84.4 | 44% | 0.444 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -67.3 | -40.9 | 178 | -163.4 | 58.8 | -130.4 | 0 | 0 | 111.8 | F145 C146 A147 L151 H152 Y153 | F145-E149 PolarHBondContact O-N 3.09Å; C146-E149 PolarHBondContact O-N 2.97Å; A147-E149 PolarHBondContact O-N 3.17Å; E149-L151 PolarHBondContact O-N 3.28Å; E149-H152 PolarHBondContact O-N 3.25Å; E149-H152 IonicContact OE1-ND1 3.79Å; E149-H152 PolarHBondContact OE1-ND1 2.93Å; E149-Y153 WeakPolarHBondContact O-CB 3.37Å; E149-Y153 PolarHBondContact O-N 2.87Å |
| 150 | V | 90.9 | Very high | 84.3 | Confident | 54 Ų | 54 | 81.3 Ų | 81.3 | 33% | 0.327 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -63.7 | -42 | 174.1 | 175.2 | 0 | 0 | 0 | 0 | 111.2 | C146 A147 Y153 L154 I172 | C146-V150 WeakPolarHBondContact O-CG2 3.12Å; C146-V150 PolarHBondContact O-N 3.1Å; A147-V150 PolarHBondContact O-N 3.45Å; V150-Y153 PolarHBondContact O-N 3.43Å; V150-L154 HydrophobicContact CG1-CD1 3.97Å; V150-L154 HydrophobicContact CG1-CG 4.42Å; V150-L154 WeakPolarHBondContact O-CB 3.45Å; V150-L154 VanDerWaalsContact O-CG 3.25Å; V150-L154 WeakPolarHBondContact O-CG 3.44Å; V150-L154 PolarHBondContact O-N 3.35Å; V150-I172 HydrophobicContact CB-CD1 4.11Å; V150-I172 HydrophobicContact CG1-CD1 3.49Å; V150-I172 VanDerWaalsContact CG1-CD1 3.49Å |
| 151 | L | 88.5 | Confident | 83 | Confident | 46 Ų | 46 | 90.5 Ų | 90.5 | 24% | 0.241 | 47% | 0.474 | C | S | . | . | H | α-helix | trans | -63.9 | -40.7 | 175.2 | -69.3 | 173 | 0 | 0 | 0 | 112 | A147 R148 E149 L154 A155 I169 I172 | A147-L151 WeakPolarHBondContact O-CB 3.08Å; A147-L151 WeakPolarHBondContact O-CG 3.39Å; A147-L151 PolarHBondContact O-N 3.48Å; R148-L151 PolarHBondContact O-N 3.23Å; E149-L151 PolarHBondContact O-N 3.28Å; L151-L154 PolarHBondContact O-N 3.05Å; L151-A155 WeakPolarHBondContact O-CB 3.5Å; L151-A155 PolarHBondContact O-N 3.09Å; L151-I169 HydrophobicContact CD2-CB 3.93Å; L151-I169 HydrophobicContact CD2-CG1 3.66Å; L151-I169 HydrophobicContact CD2-CG2 3.82Å; L151-I172 HydrophobicContact CD1-CG2 4.22Å; L151-I172 HydrophobicContact CD2-CB 4.49Å; L151-I172 HydrophobicContact CD2-CG2 4.36Å; L151-I172 HydrophobicContact CG-CG2 4.2Å |
| 152 | H | 87.9 | Confident | 81.6 | Confident | 117 Ų | 117 | 94.9 Ų | 94.9 | 54% | 0.542 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -64.2 | -46.5 | 175.9 | 178 | -115 | 0 | 0 | 0 | 111.7 | R148 E149 L154 A155 S156 | R148-H152 VanDerWaalsContact O-CB 3.28Å; R148-H152 WeakPolarHBondContact O-CB 3.41Å; R148-H152 PolarHBondContact O-N 3.26Å; E149-H152 PolarHBondContact O-N 3.25Å; E149-H152 IonicContact OE1-ND1 3.79Å; E149-H152 PolarHBondContact OE1-ND1 2.93Å; H152-L154 PolarHBondContact O-N 2.68Å; H152-A155 PolarHBondContact O-N 2.9Å; H152-S156 PolarHBondContact O-N 3.24Å; H152-S156 PolarHBondContact O-OG 3.48Å |
| 153 | Y | 87.4 | Confident | 80.2 | Confident | 132 Ų | 132 | 98.7 Ų | 98.7 | 52% | 0.518 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -57.5 | -49.4 | 174 | 179.8 | -107.8 | 0 | 0 | 0 | 111.7 | E149 V150 A155 S156 Q157 | E149-Y153 WeakPolarHBondContact O-CB 3.37Å; E149-Y153 PolarHBondContact O-N 2.87Å; V150-Y153 PolarHBondContact O-N 3.43Å; Y153-A155 VanDerWaalsContact C-N 3.3Å; Y153-A155 PolarHBondContact O-N 2.87Å; Y153-S156 PolarHBondContact O-N 3.15Å; Y153-S156 VanDerWaalsContact O-N 3.12Å; Y153-S156 PolarHBondContact O-OG 3.23Å; Y153-Q157 HydrophobicContact CD1-CG 4.43Å; Y153-Q157 VanDerWaalsContact CE1-CD 3.47Å; Y153-Q157 HydrophobicContact CE1-CG 4.03Å; Y153-Q157 HydrophobicContact CE2-CG 4.16Å; Y153-Q157 WeakPolarHBondContact O-CG 3.39Å; Y153-Q157 PolarHBondContact O-N 2.94Å; Y153-Q157 PolarHBondContact OH-OE1 3.02Å |
| 154 | L | 85.9 | Confident | 79.3 | Confident | 24 Ų | 24 | 99.9 Ų | 99.9 | 13% | 0.126 | 51% | 0.514 | C | S | . | . | H | α-helix | trans | -63.6 | -32.5 | 177.9 | -70.4 | 172.6 | 0 | 0 | 0 | 113.1 | V150 L151 H152 P165 V168 I169 | V150-L154 HydrophobicContact CG1-CD1 3.97Å; V150-L154 HydrophobicContact CG1-CG 4.42Å; V150-L154 WeakPolarHBondContact O-CB 3.45Å; V150-L154 VanDerWaalsContact O-CG 3.25Å; V150-L154 WeakPolarHBondContact O-CG 3.44Å; V150-L154 PolarHBondContact O-N 3.35Å; L151-L154 PolarHBondContact O-N 3.05Å; H152-L154 PolarHBondContact O-N 2.68Å; L154-P165 HydrophobicContact CD2-CB 4.33Å; L154-V168 HydrophobicContact CD1-CB 4.03Å; L154-V168 HydrophobicContact CD1-CG1 3.72Å; L154-I169 HydrophobicContact CD1-CG1 4.09Å |
| 155 | A | 83.3 | Confident | 78.6 | Confident | 85 Ų | 85 | 98.3 Ų | 98.3 | 70% | 0.702 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -73.2 | -29.7 | 173.7 | 0 | 0 | 0 | 0 | 0 | 113.1 | L151 H152 Y153 | L151-A155 WeakPolarHBondContact O-CB 3.5Å; L151-A155 PolarHBondContact O-N 3.09Å; H152-A155 PolarHBondContact O-N 2.9Å; Y153-A155 VanDerWaalsContact C-N 3.3Å; Y153-A155 PolarHBondContact O-N 2.87Å |
| 156 | S | 80.9 | Confident | 78 | Confident | 78 Ų | 78 | 96.3 Ų | 96.3 | 55% | 0.545 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -83.2 | -15.4 | 176.5 | 73.1 | 0 | 0 | 0 | 0 | 114.5 | H152 Y153 E158 | H152-S156 PolarHBondContact O-N 3.24Å; H152-S156 PolarHBondContact O-OG 3.48Å; Y153-S156 PolarHBondContact O-N 3.15Å; Y153-S156 VanDerWaalsContact O-N 3.12Å; Y153-S156 PolarHBondContact O-OG 3.23Å; S156-E158 PolarHBondContact O-N 3.01Å; S156-E158 VanDerWaalsContact O-N 3.13Å |
| 157 | Q | 74.1 | Confident | 77.5 | Confident | 67 Ų | 67 | 98.9 Ų | 98.9 | 31% | 0.313 | 52% | 0.516 | S | S | . | . | trans | -81.2 | 91.2 | -179.9 | -82.4 | -159.3 | 104.2 | 0 | 0 | 112.2 | Y153 T159 S160 | Y153-Q157 HydrophobicContact CD1-CG 4.43Å; Y153-Q157 VanDerWaalsContact CE1-CD 3.47Å; Y153-Q157 HydrophobicContact CE1-CG 4.03Å; Y153-Q157 HydrophobicContact CE2-CG 4.16Å; Y153-Q157 WeakPolarHBondContact O-CG 3.39Å; Y153-Q157 PolarHBondContact O-N 2.94Å; Y153-Q157 PolarHBondContact OH-OE1 3.02Å; Q157-T159 PolarHBondContact O-N 3.35Å; Q157-S160 PolarHBondContact OE1-OG 2.95Å | ||
| 158 | E | 60.6 | Low | 77.2 | Confident | 180 Ų | 180 | 101 Ų | 101 | 84% | 0.841 | 53% | 0.527 | S | S | * | . | trans | -79.6 | 103.8 | 167.2 | -165.2 | 154.5 | -155.7 | 0 | 0 | 110.5 | S156 | S156-E158 PolarHBondContact O-N 3.01Å; S156-E158 VanDerWaalsContact O-N 3.13Å | ||
| 159 | T | 62.6 | Low | 77 | Confident | 135 Ų | 135 | 97.3 Ų | 97.3 | 83% | 0.828 | 52% | 0.517 | S | S | * | . | trans | 70.8 | 66.3 | 166.8 | 68.6 | 0 | 0 | 0 | 0 | 119 | Q157 | Q157-T159 PolarHBondContact O-N 3.35Š| ||
| 160 | S | 55.8 | Low | 76.8 | Confident | 65 Ų | 65 | 96.1 Ų | 96.1 | 46% | 0.455 | 52% | 0.519 | S | S | . | . | trans | -105.7 | 130.1 | 150.4 | 58.3 | 0 | 0 | 0 | 0 | 110.2 | Q157 | Q157-S160 PolarHBondContact OE1-OG 2.95Š| ||
| 161 | R | 61.4 | Low | 76.7 | Confident | 232 Ų | 232 | 99.2 Ų | 99.2 | 88% | 0.875 | 53% | 0.53 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -73.9 | 158.2 | -177.6 | -60.4 | -177.8 | -175.6 | -167.3 | 0.4 | 110.3 | ||
| 162 | D | 58 | Low | 76.8 | Confident | 163 Ų | 163 | 98.2 Ų | 98.2 | 87% | 0.872 | 52% | 0.524 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 84.6 | -1.6 | 167 | -46.7 | -28.1 | 0 | 0 | 0 | 118.9 | ||
| 163 | L | 61.7 | Low | 76.8 | Confident | 120 Ų | 120 | 98 Ų | 98 | 63% | 0.628 | 52% | 0.524 | S | S | * | . | trans | -113.2 | 133.1 | 161.1 | -66 | 176.2 | 0 | 0 | 0 | 110 | P165 | L163-P165 WeakPolarHBondContact O-CD 3.45Š| ||
| 164 | T | 73.3 | Confident | 77 | Confident | 81 Ų | 81 | 97.7 Ų | 97.7 | 50% | 0.497 | 53% | 0.525 | S | S | . | . | trans | -88.8 | 98.6 | 169.3 | 45 | 0 | 0 | 0 | 0 | 108.2 | S166 H167 | T164-S166 PolarHBondContact O-N 2.91Å; T164-S166 VanDerWaalsContact O-N 3.12Å; T164-H167 PolarHBondContact O-N 3.4Å; T164-H167 PolarHBondContact OG1-ND1 3.34Å | ||
| 165 | P | 75.6 | Confident | 77.2 | Confident | 59 Ų | 59 | 98.3 Ų | 98.3 | 38% | 0.383 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -60.3 | -30.3 | -173.6 | 25.3 | -35.5 | 0 | 0 | 0 | 111.4 | L154 L163 H167 V168 I169 | L154-P165 HydrophobicContact CD2-CB 4.33Å; L163-P165 WeakPolarHBondContact O-CD 3.45Å; P165-H167 PolarHBondContact O-N 3.16Å; P165-V168 PolarHBondContact O-N 3.5Å; P165-I169 HydrophobicContact CB-CD1 4.17Å; P165-I169 WeakPolarHBondContact O-CB 3.37Å; P165-I169 WeakPolarHBondContact O-CD1 3.36Å; P165-I169 WeakPolarHBondContact O-CG1 3.47Å; P165-I169 PolarHBondContact O-N 3.31Å |
| 166 | S | 80.6 | Confident | 77.4 | Confident | 75 Ų | 75 | 95.1 Ų | 95.1 | 52% | 0.524 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -53.9 | -42.3 | 173.9 | 50.1 | 0 | 0 | 0 | 0 | 114.3 | T164 S170 | T164-S166 PolarHBondContact O-N 2.91Å; T164-S166 VanDerWaalsContact O-N 3.12Å; S166-S170 WeakPolarHBondContact O-CB 3.32Å; S166-S170 PolarHBondContact O-N 3.09Å |
| 167 | H | 83.7 | Confident | 77.7 | Confident | 133 Ų | 133 | 93.4 Ų | 93.4 | 62% | 0.616 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -70.4 | -39.4 | 178.1 | -75.3 | 109.7 | 0 | 0 | 0 | 111.8 | T164 P165 H171 | T164-H167 PolarHBondContact O-N 3.4Å; T164-H167 PolarHBondContact OG1-ND1 3.34Å; P165-H167 PolarHBondContact O-N 3.16Å; H167-H171 VanDerWaalsContact O-CB 3.28Å; H167-H171 WeakPolarHBondContact O-CB 3.49Å; H167-H171 PolarHBondContact O-N 3.39Å |
| 168 | V | 85.9 | Confident | 78.3 | Confident | 54 Ų | 54 | 94.8 Ų | 94.8 | 33% | 0.327 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -69.6 | -44.3 | 178.8 | -177.5 | 0 | 0 | 0 | 0 | 110.8 | L154 P165 H171 I172 | L154-V168 HydrophobicContact CD1-CB 4.03Å; L154-V168 HydrophobicContact CD1-CG1 3.72Å; P165-V168 PolarHBondContact O-N 3.5Å; V168-H171 PolarHBondContact O-N 3.44Å; V168-I172 HydrophobicContact CG1-CD1 3.78Å; V168-I172 HydrophobicContact CG1-CG1 4.41Å; V168-I172 WeakPolarHBondContact O-CB 3.41Å; V168-I172 VanDerWaalsContact O-CG1 3.29Å; V168-I172 WeakPolarHBondContact O-CG1 3.41Å; V168-I172 PolarHBondContact O-N 3.21Å |
| 169 | I | 86.9 | Confident | 79.5 | Confident | 48 Ų | 48 | 87.6 Ų | 87.6 | 25% | 0.246 | 47% | 0.469 | C | S | . | . | H | α-helix | trans | -58.4 | -50 | 174.6 | -69.1 | 163.3 | 0 | 0 | 0 | 110.4 | L151 L154 P165 H171 I172 Q173 | L151-I169 HydrophobicContact CD2-CB 3.93Å; L151-I169 HydrophobicContact CD2-CG1 3.66Å; L151-I169 HydrophobicContact CD2-CG2 3.82Å; L154-I169 HydrophobicContact CD1-CG1 4.09Å; P165-I169 HydrophobicContact CB-CD1 4.17Å; P165-I169 WeakPolarHBondContact O-CB 3.37Å; P165-I169 WeakPolarHBondContact O-CD1 3.36Å; P165-I169 WeakPolarHBondContact O-CG1 3.47Å; P165-I169 PolarHBondContact O-N 3.31Å; I169-H171 PolarHBondContact O-N 2.81Å; I169-I172 PolarHBondContact O-N 2.95Å; I169-Q173 HydrophobicContact CG2-CG 4.48Å; I169-Q173 WeakPolarHBondContact O-CB 3.38Å; I169-Q173 VanDerWaalsContact O-CG 3.26Å; I169-Q173 WeakPolarHBondContact O-CG 3.26Å; I169-Q173 PolarHBondContact O-N 2.93Å |
| 170 | S | 87.3 | Confident | 80.1 | Confident | 71 Ų | 71 | 85.2 Ų | 85.2 | 50% | 0.497 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -61.7 | -40.9 | 178.1 | -179.1 | 0 | 0 | 0 | 0 | 112.3 | S166 Q173 K174 | S166-S170 WeakPolarHBondContact O-CB 3.32Å; S166-S170 PolarHBondContact O-N 3.09Å; S170-Q173 PolarHBondContact O-N 2.73Å; S170-K174 WeakPolarHBondContact O-CB 3.35Å; S170-K174 PolarHBondContact O-N 2.95Å |
| 171 | H | 89.6 | Confident | 80.8 | Confident | 119 Ų | 119 | 88.3 Ų | 88.3 | 55% | 0.551 | 46% | 0.457 | S | S | * | . | H | α-helix | trans | -64.7 | -47.5 | 175.8 | -178.1 | 59.6 | 0 | 0 | 0 | 112.2 | H167 V168 I169 Q173 K174 V175 | H167-H171 VanDerWaalsContact O-CB 3.28Å; H167-H171 WeakPolarHBondContact O-CB 3.49Å; H167-H171 PolarHBondContact O-N 3.39Å; V168-H171 PolarHBondContact O-N 3.44Å; I169-H171 PolarHBondContact O-N 2.81Å; H171-Q173 VanDerWaalsContact C-N 3.33Å; H171-Q173 PolarHBondContact O-N 3.42Å; H171-K174 PolarHBondContact O-N 3.38Å; H171-V175 WeakPolarHBondContact O-CG2 3.31Å; H171-V175 PolarHBondContact O-N 3.37Å |
| 172 | I | 90.4 | Very high | 80.7 | Confident | 24 Ų | 24 | 83.8 Ų | 83.8 | 12% | 0.123 | 45% | 0.451 | C | S | . | . | H | α-helix | trans | -61.6 | -42 | 177.6 | -69.5 | 169.7 | 0 | 0 | 0 | 110.9 | A147 V150 L151 V168 I169 V175 A176 | A147-I172 HydrophobicContact CB-CG2 3.64Å; V150-I172 HydrophobicContact CB-CD1 4.11Å; V150-I172 HydrophobicContact CG1-CD1 3.49Å; V150-I172 VanDerWaalsContact CG1-CD1 3.49Å; L151-I172 HydrophobicContact CD1-CG2 4.22Å; L151-I172 HydrophobicContact CD2-CB 4.49Å; L151-I172 HydrophobicContact CD2-CG2 4.36Å; L151-I172 HydrophobicContact CG-CG2 4.2Å; V168-I172 HydrophobicContact CG1-CD1 3.78Å; V168-I172 HydrophobicContact CG1-CG1 4.41Å; V168-I172 WeakPolarHBondContact O-CB 3.41Å; V168-I172 VanDerWaalsContact O-CG1 3.29Å; V168-I172 WeakPolarHBondContact O-CG1 3.41Å; V168-I172 PolarHBondContact O-N 3.21Å; I169-I172 PolarHBondContact O-N 2.95Å; I172-V175 PolarHBondContact O-N 2.84Å; I172-A176 WeakPolarHBondContact O-CB 3.24Å; I172-A176 PolarHBondContact O-N 2.91Å |
| 173 | Q | 88.8 | Confident | 80.5 | Confident | 114 Ų | 114 | 82.3 Ų | 82.3 | 53% | 0.533 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -64.1 | -39.7 | 175.8 | -73.8 | 171.8 | -16.5 | 0 | 0 | 112.2 | I169 S170 H171 A177 | I169-Q173 HydrophobicContact CG2-CG 4.48Å; I169-Q173 WeakPolarHBondContact O-CB 3.38Å; I169-Q173 VanDerWaalsContact O-CG 3.26Å; I169-Q173 WeakPolarHBondContact O-CG 3.26Å; I169-Q173 PolarHBondContact O-N 2.93Å; S170-Q173 PolarHBondContact O-N 2.73Å; H171-Q173 VanDerWaalsContact C-N 3.33Å; H171-Q173 PolarHBondContact O-N 3.42Å; Q173-A177 PolarHBondContact O-N 3.24Å |
| 174 | K | 90.9 | Very high | 79.8 | Confident | 125 Ų | 125 | 81 Ų | 81 | 54% | 0.543 | 44% | 0.44 | S | S | . | . | H | α-helix | trans | -64.5 | -49.1 | 175 | -171.4 | -174.2 | -177.3 | -109.1 | 0 | 111.9 | S170 H171 A176 A177 E178 | S170-K174 WeakPolarHBondContact O-CB 3.35Å; S170-K174 PolarHBondContact O-N 2.95Å; H171-K174 PolarHBondContact O-N 3.38Å; K174-A176 VanDerWaalsContact C-N 3.3Å; K174-A176 PolarHBondContact O-N 3.25Å; K174-A177 WeakPolarHBondContact O-CB 3.32Å; K174-A177 PolarHBondContact O-N 3.44Å; K174-E178 WeakPolarHBondContact CE-OE1 2.97Å; K174-E178 IonicContact NZ-OE1 3.4Å; K174-E178 PolarHBondContact NZ-OE1 3.32Å; K174-E178 WeakPolarHBondContact O-CG 3.43Å; K174-E178 PolarHBondContact O-N 3.46Å |
| 175 | V | 89.6 | Confident | 77.8 | Confident | 36 Ų | 36 | 81.6 Ų | 81.6 | 22% | 0.218 | 45% | 0.447 | C | S | . | . | H | α-helix | trans | -65.3 | -36.7 | 179 | 177.4 | 0 | 0 | 0 | 0 | 110.6 | F143 H171 I172 E178 V179 | F143-V175 HydrophobicContact CE2-CG1 4.02Å; F143-V175 HydrophobicContact CZ-CB 4.33Å; F143-V175 HydrophobicContact CZ-CG1 3.72Å; H171-V175 WeakPolarHBondContact O-CG2 3.31Å; H171-V175 PolarHBondContact O-N 3.37Å; I172-V175 PolarHBondContact O-N 2.84Å; V175-E178 PolarHBondContact O-N 2.99Å; V175-V179 HydrophobicContact CG1-CG2 4.16Å; V175-V179 WeakPolarHBondContact O-CB 3.14Å; V175-V179 VanDerWaalsContact O-CG2 3.26Å; V175-V179 WeakPolarHBondContact O-CG2 3.3Å; V175-V179 PolarHBondContact O-N 3.05Å |
| 176 | A | 88.3 | Confident | 76.3 | Confident | 18 Ų | 18 | 84.8 Ų | 84.8 | 15% | 0.149 | 47% | 0.468 | C | S | . | . | H | α-helix | trans | -62.2 | -41.1 | 172.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | F143 I172 K174 V179 L180 | F143-A176 HydrophobicContact CE1-CB 3.92Å; I172-A176 WeakPolarHBondContact O-CB 3.24Å; I172-A176 PolarHBondContact O-N 2.91Å; K174-A176 VanDerWaalsContact C-N 3.3Å; K174-A176 PolarHBondContact O-N 3.25Å; A176-V179 PolarHBondContact O-N 2.91Å; A176-L180 VanDerWaalsContact O-CB 3.25Å; A176-L180 WeakPolarHBondContact O-CB 3.19Å; A176-L180 WeakPolarHBondContact O-CD1 3.47Å; A176-L180 WeakPolarHBondContact O-CG 3.34Å; A176-L180 PolarHBondContact O-N 2.82Å |
| 177 | A | 87.1 | Confident | 74 | Confident | 42 Ų | 42 | 89.3 Ų | 89.3 | 35% | 0.347 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -64.3 | -42.4 | 173.8 | 0 | 0 | 0 | 0 | 0 | 112 | Q173 K174 L180 H181 | Q173-A177 PolarHBondContact O-N 3.24Å; K174-A177 WeakPolarHBondContact O-CB 3.32Å; K174-A177 PolarHBondContact O-N 3.44Å; A177-L180 PolarHBondContact O-N 3.5Å; A177-H181 WeakPolarHBondContact O-CB 3.35Å; A177-H181 PolarHBondContact O-CD2 3.27Å; A177-H181 PolarHBondContact O-N 3.21Å |
| 178 | E | 86.8 | Confident | 72 | Confident | 96 Ų | 96 | 87.9 Ų | 87.9 | 45% | 0.449 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -62.7 | -44.6 | 176.1 | -70.4 | 170.6 | -177.6 | 0 | 0 | 111.8 | K174 V175 L180 N182 | K174-E178 WeakPolarHBondContact CE-OE1 2.97Å; K174-E178 IonicContact NZ-OE1 3.4Å; K174-E178 PolarHBondContact NZ-OE1 3.32Å; K174-E178 WeakPolarHBondContact O-CG 3.43Å; K174-E178 PolarHBondContact O-N 3.46Å; V175-E178 PolarHBondContact O-N 2.99Å; E178-L180 VanDerWaalsContact C-N 3.3Å; E178-L180 PolarHBondContact O-N 3.02Å; E178-N182 PolarHBondContact O-N 3.07Å |
| 179 | V | 84.4 | Confident | 69.4 | Low | 30 Ų | 30 | 92.5 Ų | 92.5 | 18% | 0.182 | 51% | 0.506 | C | S | . | . | H | α-helix | trans | -67.7 | -26.4 | 176.4 | 169.2 | 0 | 0 | 0 | 0 | 112.7 | F139 R140 F143 V175 A176 | F139-V179 HydrophobicContact CE1-CG1 4.41Å; R140-V179 HydrophobicContact CG-CG1 3.87Å; R140-V179 PolarHBondContact NE-O 2.91Å; R140-V179 PolarHBondContact NH1-O 2.93Å; F143-V179 HydrophobicContact CD1-CG1 4.09Å; F143-V179 HydrophobicContact CE1-CB 4.46Å; F143-V179 HydrophobicContact CG-CG1 4.44Å; V175-V179 HydrophobicContact CG1-CG2 4.16Å; V175-V179 WeakPolarHBondContact O-CB 3.14Å; V175-V179 VanDerWaalsContact O-CG2 3.26Å; V175-V179 WeakPolarHBondContact O-CG2 3.3Å; V175-V179 PolarHBondContact O-N 3.05Å; A176-V179 PolarHBondContact O-N 2.91Å |
| 180 | L | 76.9 | Confident | 66.8 | Low | 84 Ų | 84 | 102.5 Ų | 102.5 | 44% | 0.44 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -91.1 | -20.7 | 178.9 | -70.5 | 170.8 | 0 | 0 | 0 | 114.4 | R140 A176 A177 E178 | R140-L180 PolarHBondContact NH2-O 2.95Å; A176-L180 VanDerWaalsContact O-CB 3.25Å; A176-L180 WeakPolarHBondContact O-CB 3.19Å; A176-L180 WeakPolarHBondContact O-CD1 3.47Å; A176-L180 WeakPolarHBondContact O-CG 3.34Å; A176-L180 PolarHBondContact O-N 2.82Å; A177-L180 PolarHBondContact O-N 3.5Å; E178-L180 VanDerWaalsContact C-N 3.3Å; E178-L180 PolarHBondContact O-N 3.02Å |
| 181 | H | 69.9 | Low | 64.5 | Low | 131 Ų | 131 | 104.5 Ų | 104.5 | 61% | 0.606 | 55% | 0.554 | S | S | * | * | H | α-helix | trans | -104.3 | 1 | -175.9 | -69.7 | -51.7 | 0 | 0 | 0 | 115 | A177 E183 S184 | A177-H181 WeakPolarHBondContact O-CB 3.35Å; A177-H181 PolarHBondContact O-CD2 3.27Å; A177-H181 PolarHBondContact O-N 3.21Å; H181-E183 PolarHBondContact O-N 3.44Å; H181-S184 PolarHBondContact O-N 3.17Å |
| 182 | N | 58.6 | Low | 61.7 | Low | 137 Ų | 137 | 104.2 Ų | 104.2 | 73% | 0.733 | 57% | 0.566 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -68.8 | -7 | -171.7 | -131.2 | 29.9 | 0 | 0 | 0 | 115.1 | E178 | E178-N182 PolarHBondContact O-N 3.07Š|
| 183 | E | 53.8 | Low | 59 | Low | 132 Ų | 132 | 107.6 Ų | 107.6 | 62% | 0.617 | 60% | 0.597 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.9 | -16 | 176 | -86.2 | -153.6 | 80.9 | 0 | 0 | 115.1 | H181 | H181-E183 PolarHBondContact O-N 3.44Š|
| 184 | S | 47.8 | Very low | 56.3 | Low | 93 Ų | 93 | 113.7 Ų | 113.7 | 65% | 0.65 | 62% | 0.615 | S | S | * | * | S | Bend | trans | -130 | 63.3 | -166.6 | 67.7 | 0 | 0 | 0 | 0 | 115 | H181 | H181-S184 PolarHBondContact O-N 3.17Š|
| 185 | S | 31.7 | Very low | 53.4 | Low | 93 Ų | 93 | 116.8 Ų | 116.8 | 65% | 0.65 | 63% | 0.632 | S | S | * | * | trans | -155.5 | 100.6 | 161.1 | -164.7 | 0 | 0 | 0 | 0 | 114.8 | Q187 | S185-Q187 PolarHBondContact O-N 2.93Å; S185-Q187 VanDerWaalsContact O-N 3.15Å | ||
| 186 | P | 42.6 | Very low | 50.6 | Low | 126 Ų | 126 | 120.4 Ų | 120.4 | 82% | 0.818 | 66% | 0.659 | S | S | * | * | trans | -71.5 | 101.3 | 157.1 | -3.8 | 20.8 | 0 | 0 | 0 | 108.4 | P188 | P186-P188 VanDerWaalsContact O-CD 3.29Å; P186-P188 WeakPolarHBondContact O-CD 3.3Å | ||
| 187 | Q | 32.3 | Very low | 48 | Very low | 170 Ų | 170 | 126.6 Ų | 126.6 | 79% | 0.794 | 69% | 0.689 | S | S | * | * | trans | -63 | 119.2 | 175.7 | -103.2 | -92.7 | -28.9 | 0 | 0 | 111.3 | S185 | S185-Q187 PolarHBondContact O-N 2.93Å; S185-Q187 VanDerWaalsContact O-N 3.15Å | ||
| 188 | P | 41.9 | Very low | 45.4 | Very low | 103 Ų | 103 | 132.4 Ų | 132.4 | 67% | 0.669 | 71% | 0.709 | S | S | * | * | trans | -90.1 | 117.6 | 174.4 | 33.1 | -28.3 | 0 | 0 | 0 | 111.5 | P186 | P186-P188 VanDerWaalsContact O-CD 3.29Å; P186-P188 WeakPolarHBondContact O-CD 3.3Å | ||
| 189 | N | 32 | Very low | 43 | Very low | 150 Ų | 150 | 131.5 Ų | 131.5 | 80% | 0.802 | 72% | 0.719 | S | S | * | * | trans | 55.4 | 118.7 | 157.1 | -68.5 | -29.5 | 0 | 0 | 0 | 120 | ||||
| 190 | R | 32.8 | Very low | 40.5 | Very low | 259 Ų | 259 | 139.2 Ų | 139.2 | 98% | 0.977 | 75% | 0.749 | S | S | * | * | trans | -117.6 | 125.6 | 132.3 | -99.1 | -169.6 | 173.7 | -160.8 | -0.2 | 110.1 | ||||
| 191 | S | 37.5 | Very low | 38.4 | Very low | 112 Ų | 112 | 146.6 Ų | 146.6 | 78% | 0.783 | 77% | 0.771 | S | S | * | * | trans | -100.9 | 149.9 | -173.3 | 48.9 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 192 | S | 32.7 | Very low | 36.9 | Very low | 114 Ų | 114 | 146.2 Ų | 146.2 | 80% | 0.797 | 78% | 0.781 | S | S | * | * | trans | -164 | 112.1 | 139.9 | 60.9 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 193 | A | 33.5 | Very low | 35.5 | Very low | 95 Ų | 95 | 145.9 Ų | 145.9 | 79% | 0.785 | 78% | 0.784 | S | S | * | * | trans | 50.2 | 117.2 | 145.7 | 0 | 0 | 0 | 0 | 0 | 121.8 | ||||
| 194 | R | 30.3 | Very low | 34.2 | Very low | 241 Ų | 241 | 151.5 Ų | 151.5 | 91% | 0.909 | 80% | 0.799 | S | S | * | * | -168.5 | 106.3 | 94.4 | -97.5 | -179.5 | -174.5 | -157.5 | 0.5 | 113.5 | |||||
| 195 | E | 30.6 | Very low | 33.6 | Very low | 190 Ų | 190 | 155.9 Ų | 155.9 | 89% | 0.888 | 81% | 0.809 | S | S | * | * | trans | 7.4 | 123.1 | 132.7 | -171.3 | 171.5 | -141.3 | 0 | 0 | 119.5 | ||||
| 196 | S | 32.2 | Very low | 34 | Very low | 113 Ų | 113 | 156.6 Ų | 156.6 | 79% | 0.79 | 81% | 0.812 | S | S | * | * | -177.7 | 150.3 | 112.3 | -169 | 0 | 0 | 0 | 0 | 113.1 | |||||
| 197 | D | 32.6 | Very low | 33.2 | Very low | 147 Ų | 147 | 156.2 Ų | 156.2 | 79% | 0.786 | 81% | 0.812 | S | S | * | * | trans | -56.3 | 172.8 | 168 | -75.1 | -75.6 | 0 | 0 | 0 | 114.9 | ||||
| 198 | E | 32.1 | Very low | 33.2 | Very low | 164 Ų | 164 | 152.6 Ų | 152.6 | 77% | 0.766 | 81% | 0.811 | S | S | * | * | cis | -151.2 | 170.5 | 21.7 | -156.7 | 175.4 | 106.3 | 0 | 0 | 113.1 | K200 | E198-K200 IonicContact OE1-NZ 3.94Š| ||
| 199 | A | 37.5 | Very low | 32.8 | Very low | 78 Ų | 78 | 155.7 Ų | 155.7 | 65% | 0.645 | 82% | 0.821 | S | S | * | * | trans | -90.3 | 154.3 | -177.3 | 0 | 0 | 0 | 0 | 0 | 115.9 | ||||
| 200 | K | 31.3 | Very low | 33.1 | Very low | 191 Ų | 191 | 154.2 Ų | 154.2 | 83% | 0.83 | 82% | 0.82 | S | S | * | * | 177.7 | 140.3 | 126 | -93.5 | 147.8 | -167.4 | 154.7 | 0 | 113.3 | E198 | E198-K200 IonicContact OE1-NZ 3.94Š| |||
| 201 | R | 32.9 | Very low | 33 | Very low | 239 Ų | 239 | 151 Ų | 151 | 90% | 0.902 | 82% | 0.816 | S | S | * | * | trans | -106.4 | 157.6 | 161.1 | -63.9 | -177.6 | 169.7 | 178.5 | -2.4 | 108 | ||||
| 202 | P | 37.6 | Very low | 32.9 | Very low | 123 Ų | 123 | 149.9 Ų | 149.9 | 80% | 0.799 | 81% | 0.813 | S | S | * | * | -148.5 | 139.8 | 81.2 | 34.8 | -14.6 | 0 | 0 | 0 | 117.9 | |||||
| 203 | V | 29 | Very low | 33.3 | Very low | 131 Ų | 131 | 150.1 Ų | 150.1 | 79% | 0.794 | 81% | 0.812 | S | S | * | * | trans | 27.8 | 116.9 | 137.7 | -171.3 | 0 | 0 | 0 | 0 | 120.4 | ||||
| 204 | R | 26.7 | Very low | 33.5 | Very low | 250 Ų | 250 | 150.3 Ų | 150.3 | 94% | 0.943 | 81% | 0.813 | S | S | * | * | -163.2 | 137.6 | 127.5 | -107.2 | 170.3 | -176.1 | 175.1 | 1.5 | 111.3 | |||||
| 205 | Q | 36 | Very low | 34.5 | Very low | 185 Ų | 185 | 149.7 Ų | 149.7 | 86% | 0.864 | 81% | 0.811 | S | S | * | * | trans | -114.2 | 177.7 | 169.3 | -81.1 | -170 | -1.9 | 0 | 0 | 108.6 | ||||
| 206 | P | 39.5 | Very low | 35.4 | Very low | 108 Ų | 108 | 148.4 Ų | 148.4 | 70% | 0.701 | 81% | 0.81 | S | S | * | * | cis | -126.7 | 167.6 | -10.7 | 34.1 | -17.9 | 0 | 0 | 0 | 114.2 | ||||
| 207 | S | 26.6 | Very low | 36.7 | Very low | 118 Ų | 118 | 148.9 Ų | 148.9 | 83% | 0.825 | 81% | 0.812 | S | S | * | * | 164.8 | 153.3 | 129.6 | 48 | 0 | 0 | 0 | 0 | 114.6 | |||||
| 208 | A | 30.9 | Very low | 37.7 | Very low | 94 Ų | 94 | 148.2 Ų | 148.2 | 78% | 0.777 | 81% | 0.813 | S | S | * | * | trans | 66.4 | 113.2 | 157.4 | 0 | 0 | 0 | 0 | 0 | 121.3 | ||||
| 209 | L | 34.3 | Very low | 38.6 | Very low | 167 Ų | 167 | 145.8 Ų | 145.8 | 87% | 0.874 | 81% | 0.812 | S | S | * | * | trans | 28.1 | 127.4 | 141 | -110.6 | 76.5 | 0 | 0 | 0 | 121.4 | ||||
| 210 | P | 37.7 | Very low | 39.3 | Very low | 120 Ų | 120 | 148.3 Ų | 148.3 | 78% | 0.779 | 82% | 0.819 | S | S | * | * | trans | -106.1 | 123.9 | 155.3 | 34.8 | -23.2 | 0 | 0 | 0 | 111.9 | ||||
| 211 | E | 31.8 | Very low | 40.4 | Very low | 192 Ų | 192 | 146.4 Ų | 146.4 | 90% | 0.897 | 82% | 0.816 | S | S | * | * | trans | -154.4 | 130.1 | 147.8 | -127.8 | 177.3 | 157.8 | 0 | 0 | 112.4 | ||||
| 212 | A | 34.9 | Very low | 41.1 | Very low | 88 Ų | 88 | 143.4 Ų | 143.4 | 73% | 0.727 | 81% | 0.812 | S | S | * | * | trans | -112.5 | 160.8 | 174.1 | 0 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 213 | P | 42 | Very low | 41.4 | Very low | 119 Ų | 119 | 148.7 Ų | 148.7 | 77% | 0.773 | 82% | 0.816 | S | S | * | * | trans | -82.2 | 135.8 | -138.2 | 29.3 | -36.7 | 0 | 0 | 0 | 115.7 | ||||
| 214 | A | 37.3 | Very low | 41.8 | Very low | 98 Ų | 98 | 147.1 Ų | 147.1 | 81% | 0.81 | 81% | 0.807 | S | S | * | * | trans | -61.4 | 145.3 | 167.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 215 | R | 50.5 | Low | 42.4 | Very low | 229 Ų | 229 | 141.3 Ų | 141.3 | 86% | 0.864 | 80% | 0.803 | S | S | * | * | trans | -119.3 | 122.8 | 166.3 | -68.7 | -173.2 | 180 | -123.5 | 1 | 109.8 | ||||
| 216 | N | 50.8 | Low | 42.5 | Very low | 163 Ų | 163 | 140 Ų | 140 | 87% | 0.872 | 80% | 0.797 | S | S | * | * | trans | 59.7 | 73.6 | 165 | -60 | -34 | 0 | 0 | 0 | 117.5 | ||||
| 217 | C | 58.1 | Low | 42.4 | Very low | 123 Ų | 123 | 144 Ų | 144 | 83% | 0.831 | 81% | 0.806 | S | S | * | * | trans | -119.1 | 127.9 | 151.5 | -69.7 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 218 | V | 53.9 | Low | 42.8 | Very low | 132 Ų | 132 | 141.7 Ų | 141.7 | 80% | 0.8 | 80% | 0.8 | S | S | * | * | trans | -77.6 | 130.7 | 172.5 | 179 | 0 | 0 | 0 | 0 | 108.2 | V220 | V218-V220 PolarHBondContact O-N 2.79Å; V218-V220 VanDerWaalsContact O-N 3.09Å | ||
| 219 | P | 51.3 | Low | 43.2 | Very low | 114 Ų | 114 | 144.5 Ų | 144.5 | 74% | 0.74 | 81% | 0.808 | S | S | * | * | trans | -69.1 | 110.5 | -179.5 | 26.3 | -32.8 | 0 | 0 | 0 | 110.9 | I221 | P219-I221 PolarHBondContact O-N 3.45Š| ||
| 220 | V | 52.3 | Low | 43.2 | Very low | 130 Ų | 130 | 139.8 Ų | 139.8 | 79% | 0.788 | 80% | 0.8 | S | S | * | * | trans | -68.8 | 119.4 | 166.2 | 176.2 | 0 | 0 | 0 | 0 | 108 | V218 Q222 | V218-V220 PolarHBondContact O-N 2.79Å; V218-V220 VanDerWaalsContact O-N 3.09Å; V220-Q222 PolarHBondContact O-N 3.07Å | ||
| 221 | I | 53.8 | Low | 43.6 | Very low | 152 Ų | 152 | 142.1 Ų | 142.1 | 78% | 0.779 | 80% | 0.801 | S | S | * | * | trans | -66.8 | 100.7 | 178.8 | -60.2 | 171.8 | 0 | 0 | 0 | 108.9 | P219 R223 | P219-I221 PolarHBondContact O-N 3.45Å; I221-R223 PolarHBondContact O-N 3.29Å | ||
| 222 | Q | 48.3 | Very low | 44.3 | Very low | 175 Ų | 175 | 141.6 Ų | 141.6 | 82% | 0.818 | 80% | 0.798 | S | S | * | * | trans | -71 | 113.4 | 166.1 | -67.5 | -177.5 | -3 | 0 | 0 | 108.5 | V220 T224 | V220-Q222 PolarHBondContact O-N 3.07Å; Q222-T224 PolarHBondContact O-N 2.82Å | ||
| 223 | R | 43.1 | Very low | 45.2 | Very low | 235 Ų | 235 | 143.6 Ų | 143.6 | 89% | 0.887 | 81% | 0.806 | S | S | * | * | trans | -74.8 | 114.5 | 165.7 | -81.2 | -176.8 | 168.5 | 143.4 | -2.7 | 108.4 | I221 C225 | I221-R223 PolarHBondContact O-N 3.29Å; R223-C225 PolarHBondContact O-N 2.81Å | ||
| 224 | T | 37.4 | Very low | 45.4 | Very low | 98 Ų | 98 | 141.3 Ų | 141.3 | 60% | 0.601 | 81% | 0.805 | S | S | * | * | trans | -72.4 | 121.5 | 175.9 | 45.6 | 0 | 0 | 0 | 0 | 110.7 | Q222 H226 | Q222-T224 PolarHBondContact O-N 2.82Å; T224-H226 VanDerWaalsContact CB-NE2 3.35Å; T224-H226 WeakPolarHBondContact CB-NE2 3.38Å; T224-H226 PolarHBondContact O-N 2.75Å; T224-H226 PolarHBondContact OG1-CD2 2.76Å; T224-H226 VanDerWaalsContact OG1-CD2 3.25Å; T224-H226 PolarHBondContact OG1-NE2 3.2Å | ||
| 225 | C | 39.8 | Very low | 45.8 | Very low | 127 Ų | 127 | 142.1 Ų | 142.1 | 86% | 0.858 | 80% | 0.804 | S | S | * | * | trans | -77 | 98.2 | 166.7 | -65.3 | 0 | 0 | 0 | 0 | 108.8 | R223 | R223-C225 PolarHBondContact O-N 2.81Š| ||
| 226 | H | 38.3 | Very low | 46.2 | Very low | 158 Ų | 158 | 139 Ų | 139 | 73% | 0.731 | 81% | 0.805 | S | S | * | * | trans | -86.4 | 113.3 | 171.4 | -70.2 | -76.4 | 0 | 0 | 0 | 110.4 | T224 | T224-H226 VanDerWaalsContact CB-NE2 3.35Å; T224-H226 WeakPolarHBondContact CB-NE2 3.38Å; T224-H226 PolarHBondContact O-N 2.75Å; T224-H226 PolarHBondContact OG1-CD2 2.76Å; T224-H226 VanDerWaalsContact OG1-CD2 3.25Å; T224-H226 PolarHBondContact OG1-NE2 3.2Å | ||
| 227 | H | 37.4 | Very low | 46.7 | Very low | 192 Ų | 192 | 136.8 Ų | 136.8 | 89% | 0.889 | 80% | 0.797 | S | S | * | * | trans | -80 | 131.6 | 154.9 | -76.6 | -5.9 | 0 | 0 | 0 | 108.5 | ||||
| 228 | G | 34.4 | Very low | 46.8 | Very low | 69 Ų | 69 | 138 Ų | 138 | 71% | 0.711 | 80% | 0.796 | S | S | * | * | trans | 152.5 | 102.1 | 174.3 | 0 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 229 | T | 39.7 | Very low | 47.1 | Very low | 153 Ų | 153 | 138.8 Ų | 138.8 | 94% | 0.939 | 80% | 0.801 | S | S | * | * | trans | -10.1 | 137.1 | 148.5 | 42.4 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 230 | G | 34.4 | Very low | 47.6 | Very low | 68 Ų | 68 | 140 Ų | 140 | 70% | 0.701 | 80% | 0.801 | S | S | * | * | trans | 149.2 | 107.5 | 157.3 | 0 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 231 | E | 46.5 | Very low | 47.7 | Very low | 170 Ų | 170 | 139.3 Ų | 139.3 | 79% | 0.794 | 80% | 0.802 | S | S | * | * | trans | -44.8 | 141.6 | 168.7 | 51.4 | -104.4 | 58.6 | 0 | 0 | 116.8 | ||||
| 232 | Q | 45.3 | Very low | 47.7 | Very low | 181 Ų | 181 | 135.4 Ų | 135.4 | 85% | 0.846 | 80% | 0.8 | S | S | * | * | 177.9 | 130.1 | 111.4 | -94.5 | 173.5 | 29.7 | 0 | 0 | 114.9 | |||||
| 233 | S | 54.8 | Low | 47.6 | Very low | 129 Ų | 129 | 138.1 Ų | 138.1 | 90% | 0.902 | 80% | 0.804 | S | S | * | * | trans | 38.2 | 122.5 | 151 | -81.2 | 0 | 0 | 0 | 0 | 122.6 | ||||
| 234 | G | 46.1 | Very low | 48.1 | Very low | 72 Ų | 72 | 130.4 Ų | 130.4 | 74% | 0.742 | 80% | 0.797 | S | S | * | * | trans | -167.7 | 38.5 | 168.7 | 0 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 235 | S | 46.3 | Very low | 48.5 | Very low | 114 Ų | 114 | 129.5 Ų | 129.5 | 80% | 0.797 | 81% | 0.808 | S | S | * | * | trans | 30.4 | 106.5 | 164.2 | 60.9 | 0 | 0 | 0 | 0 | 119.1 | ||||
| 236 | D | 57.9 | Low | 48.9 | Very low | 165 Ų | 165 | 131.6 Ų | 131.6 | 88% | 0.882 | 81% | 0.805 | S | S | * | * | trans | -116.4 | 137.1 | 144 | -165 | 6 | 0 | 0 | 0 | 107.7 | ||||
| 237 | T | 61.3 | Low | 49 | Very low | 115 Ų | 115 | 133.5 Ų | 133.5 | 71% | 0.706 | 81% | 0.814 | S | S | * | * | trans | -98.6 | 123.3 | -163.9 | 46.7 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 238 | D | 60.3 | Low | 49 | Very low | 150 Ų | 150 | 131.5 Ų | 131.5 | 80% | 0.802 | 81% | 0.81 | S | S | * | * | trans | -51.4 | 141.5 | 163.6 | -97.5 | -44.7 | 0 | 0 | 0 | 112.2 | ||||
| 239 | T | 60.5 | Low | 49.2 | Very low | 147 Ų | 147 | 137.2 Ų | 137.2 | 90% | 0.902 | 82% | 0.815 | S | S | * | * | trans | -131 | 68.1 | 150.5 | 17.5 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 240 | D | 60.8 | Low | 49.2 | Very low | 139 Ų | 139 | 135.7 Ų | 135.7 | 74% | 0.743 | 81% | 0.808 | S | S | * | * | trans | -70.1 | 129.4 | 153.4 | 172.3 | 37.8 | 0 | 0 | 0 | 109.9 | ||||
| 241 | S | 54.5 | Low | 49 | Very low | 117 Ų | 117 | 141.9 Ų | 141.9 | 82% | 0.818 | 82% | 0.815 | S | S | * | * | trans | -174.5 | 119.8 | 133.7 | -158.3 | 0 | 0 | 0 | 0 | 110 | ||||
| 242 | G | 54.5 | Low | 48.3 | Very low | 70 Ų | 70 | 138.8 Ų | 138.8 | 72% | 0.722 | 82% | 0.819 | S | S | * | * | trans | -161.9 | 2 | -176.8 | 0 | 0 | 0 | 0 | 0 | 119.6 | ||||
| 243 | Y | 46.8 | Very low | 47.7 | Very low | 231 Ų | 231 | 138.8 Ų | 138.8 | 91% | 0.906 | 82% | 0.819 | S | S | * | * | trans | 21.6 | 118.8 | 157.5 | -165.1 | -94.8 | 0 | 0 | 0 | 121.4 | ||||
| 244 | G | 53.3 | Low | 46.2 | Very low | 73 Ų | 73 | 144 Ų | 144 | 75% | 0.753 | 82% | 0.819 | S | S | * | * | 108.8 | 120.1 | 127.1 | 0 | 0 | 0 | 0 | 0 | 119.7 | |||||
| 245 | G | 44.8 | Very low | 45.6 | Very low | 80 Ų | 80 | 144.9 Ų | 144.9 | 83% | 0.825 | 81% | 0.814 | S | S | * | * | trans | 154.3 | 94.9 | 161.8 | 0 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 246 | E | 49.7 | Very low | 44.8 | Very low | 171 Ų | 171 | 147 Ų | 147 | 80% | 0.799 | 81% | 0.811 | S | S | * | * | trans | -60.8 | 157 | 167 | -71.4 | -166.5 | 106.8 | 0 | 0 | 112.4 | ||||
| 247 | H | 40.2 | Very low | 43.5 | Very low | 198 Ų | 198 | 146.9 Ų | 146.9 | 92% | 0.917 | 81% | 0.811 | S | S | * | * | trans | -148.6 | 140.4 | 135.6 | -91.6 | -58.9 | 0 | 0 | 0 | 111.8 | ||||
| 248 | D | 36.5 | Very low | 42 | Very low | 149 Ų | 149 | 146.9 Ų | 146.9 | 80% | 0.797 | 81% | 0.806 | S | S | * | * | trans | -55.7 | 156.7 | -174.7 | -97 | -71.9 | 0 | 0 | 0 | 117 | ||||
| 249 | K | 39.8 | Very low | 40.6 | Very low | 190 Ų | 190 | 146.7 Ų | 146.7 | 83% | 0.826 | 80% | 0.801 | S | S | * | * | trans | -69.6 | 166.4 | 164.5 | -62.2 | 174 | 179.8 | 172.2 | 0 | 110.2 | ||||
| 250 | P | 38.5 | Very low | 39.2 | Very low | 120 Ų | 120 | 150.4 Ų | 150.4 | 78% | 0.779 | 80% | 0.798 | S | S | * | * | -140.5 | 133.8 | 98.9 | 30.3 | -14.4 | 0 | 0 | 0 | 116 | |||||
| 251 | K | 30.7 | Very low | 37.7 | Very low | 198 Ų | 198 | 153.1 Ų | 153.1 | 86% | 0.861 | 81% | 0.806 | S | S | * | * | trans | 46.2 | 101.2 | 143 | -61.4 | -178.1 | 178.1 | -179.8 | 0 | 119 | ||||
| 252 | A | 31.9 | Very low | 36.6 | Very low | 106 Ų | 106 | 151 Ų | 151 | 88% | 0.876 | 80% | 0.803 | S | S | * | * | trans | -81.9 | 132.2 | 139.6 | 0 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 253 | Q | 31.9 | Very low | 35.4 | Very low | 180 Ų | 180 | 156.9 Ų | 156.9 | 84% | 0.841 | 81% | 0.811 | S | S | * | * | trans | -96.9 | 100.2 | 174.3 | 179 | 177.9 | -4.8 | 0 | 0 | 108.6 | ||||
| 254 | W | 24.4 | Very low | 34.6 | Very low | 238 Ų | 238 | 149.9 Ų | 149.9 | 90% | 0.902 | 80% | 0.802 | S | S | * | * | trans | -113.2 | 114.4 | 166.1 | -169.5 | -72.7 | 0 | 0 | 0 | 107.4 | ||||
| 255 | S | 32.3 | Very low | 33.9 | Very low | 92 Ų | 92 | 156.2 Ų | 156.2 | 64% | 0.643 | 81% | 0.808 | S | S | * | * | trans | -98.5 | 114.6 | 176.2 | -67.1 | 0 | 0 | 0 | 0 | 109 | ||||
| 256 | E | 30.8 | Very low | 34.1 | Very low | 158 Ų | 158 | 157.7 Ų | 157.7 | 74% | 0.738 | 80% | 0.804 | S | S | * | * | trans | -75.3 | 141.6 | 168 | -167.6 | 174.4 | 124.6 | 0 | 0 | 109.6 | ||||
| 257 | N | 30.8 | Very low | 33.8 | Very low | 163 Ų | 163 | 155.1 Ų | 155.1 | 87% | 0.872 | 80% | 0.802 | S | S | * | * | trans | -161.1 | 148.7 | 159.5 | -96.9 | -36.3 | 0 | 0 | 0 | 110.8 | ||||
| 258 | N | 28.7 | Very low | 33.3 | Very low | 115 Ų | 115 | 150 Ų | 150 | 62% | 0.615 | 79% | 0.794 | S | S | * | * | trans | -74 | 156.7 | -157.8 | -80.2 | 15.6 | 0 | 0 | 0 | 118.2 | ||||
| 259 | E | 30.7 | Very low | 33.1 | Very low | 146 Ų | 146 | 147.3 Ų | 147.3 | 68% | 0.682 | 79% | 0.787 | S | S | * | * | trans | 30.3 | 120.6 | 132 | -45.1 | 166 | 109.4 | 0 | 0 | 119.6 | ||||
| 260 | R | 31.6 | Very low | 32.7 | Very low | 224 Ų | 224 | 145.5 Ų | 145.5 | 85% | 0.845 | 78% | 0.781 | S | S | * | * | 176.2 | 141.6 | 94.2 | -89.5 | -178.2 | -160.5 | -150 | 0.3 | 114 | |||||
| 261 | E | 29.4 | Very low | 32.7 | Very low | 196 Ų | 196 | 149.2 Ų | 149.2 | 92% | 0.916 | 78% | 0.78 | S | S | * | * | trans | -16.1 | 142.4 | 148.9 | -170.7 | 174.9 | -153.8 | 0 | 0 | 119.1 | ||||
| 262 | G | 31.3 | Very low | 32.9 | Very low | 72 Ų | 72 | 146.5 Ų | 146.5 | 74% | 0.742 | 77% | 0.773 | S | S | * | * | trans | 151.1 | 115.7 | 158.4 | 0 | 0 | 0 | 0 | 0 | 119 | ||||
| 263 | E | 29.1 | Very low | 32.9 | Very low | 194 Ų | 194 | 147.7 Ų | 147.7 | 91% | 0.907 | 77% | 0.769 | S | S | * | * | trans | 46.4 | 112.6 | 150.5 | -79.6 | -172.2 | 98.2 | 0 | 0 | 125.4 | ||||
| 264 | A | 31.2 | Very low | 32.8 | Very low | 85 Ų | 85 | 142.3 Ų | 142.3 | 70% | 0.702 | 76% | 0.762 | S | S | * | * | 46 | 120.5 | 111.7 | 0 | 0 | 0 | 0 | 0 | 124.5 | |||||
| 265 | K | 37.7 | Very low | 33.1 | Very low | 205 Ų | 205 | 138 Ų | 138 | 89% | 0.891 | 76% | 0.761 | S | S | * | * | trans | 86.9 | 150.9 | 137 | -88.7 | -171.2 | 173.2 | 176.5 | 0 | 122.3 | ||||
| 266 | P | 48.6 | Very low | 33.2 | Very low | 112 Ų | 112 | 139.7 Ų | 139.7 | 73% | 0.727 | 77% | 0.768 | S | S | * | * | trans | -97.4 | -174.8 | -175.2 | 47 | -40 | 0 | 0 | 0 | 110.7 | ||||
| 267 | P | 44.3 | Very low | 33.4 | Very low | 116 Ų | 116 | 142 Ų | 142 | 75% | 0.753 | 78% | 0.775 | S | S | * | * | cis | -158 | -175.2 | 41.6 | 46 | -22.6 | 0 | 0 | 0 | 120.8 | ||||
| 268 | A | 28.9 | Very low | 33.5 | Very low | 92 Ų | 92 | 142.3 Ų | 142.3 | 76% | 0.76 | 77% | 0.772 | S | S | * | * | trans | 87.9 | 132.9 | 135.8 | 0 | 0 | 0 | 0 | 0 | 123.3 | ||||
| 269 | S | 31.7 | Very low | 33.6 | Very low | 92 Ų | 92 | 146 Ų | 146 | 64% | 0.643 | 79% | 0.785 | S | S | * | * | trans | 91.3 | 123.5 | 136.5 | -114.6 | 0 | 0 | 0 | 0 | 121.7 | ||||
| 270 | E | 32.2 | Very low | 33.5 | Very low | 152 Ų | 152 | 142.8 Ų | 142.8 | 71% | 0.71 | 79% | 0.791 | S | S | * | * | trans | 68.3 | 144.9 | 131.8 | -74.9 | 174.4 | 136.1 | 0 | 0 | 120.5 | ||||
| 271 | R | 38.1 | Very low | 33.4 | Very low | 198 Ų | 198 | 138.6 Ų | 138.6 | 75% | 0.747 | 79% | 0.785 | S | S | * | * | cis | -170.7 | 174.5 | -21.6 | -137.9 | -179.8 | -170.9 | 177.6 | 2.6 | 107.3 | ||||
| 272 | I | 35.4 | Very low | 33.8 | Very low | 140 Ų | 140 | 137 Ų | 137 | 72% | 0.718 | 78% | 0.778 | S | S | * | * | trans | 82.3 | 114.9 | 148 | -73.6 | 160.8 | 0 | 0 | 0 | 119.7 | ||||
| 273 | V | 31.8 | Very low | 34.2 | Very low | 131 Ų | 131 | 139 Ų | 139 | 79% | 0.794 | 78% | 0.778 | S | S | * | * | trans | 63.1 | 117.9 | 142.7 | 177.8 | 0 | 0 | 0 | 0 | 118 | ||||
| 274 | G | 29.4 | Very low | 34.3 | Very low | 67 Ų | 67 | 141.2 Ų | 141.2 | 69% | 0.691 | 78% | 0.778 | S | S | * | * | cis | 102.5 | 95.4 | 35.8 | 0 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 275 | V | 31.3 | Very low | 34.4 | Very low | 147 Ų | 147 | 141.8 Ų | 141.8 | 89% | 0.891 | 78% | 0.782 | S | S | * | * | trans | -131.5 | 125.4 | 165.6 | 172.9 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 276 | V | 33.3 | Very low | 34.4 | Very low | 128 Ų | 128 | 140.1 Ų | 140.1 | 78% | 0.776 | 78% | 0.775 | S | S | * | * | trans | -75.3 | 140.9 | 175.9 | 164.8 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 277 | K | 35.8 | Very low | 33.5 | Very low | 207 Ų | 207 | 145.4 Ų | 145.4 | 90% | 0.9 | 78% | 0.78 | S | S | * | * | trans | -143.8 | 131.4 | 146.4 | -151 | 168.8 | -176.6 | 178.7 | 0 | 111.1 | ||||
| 278 | Q | 32.6 | Very low | 32.7 | Very low | 169 Ų | 169 | 147.3 Ų | 147.3 | 79% | 0.79 | 78% | 0.784 | S | S | * | * | trans | -110.5 | 174.1 | -174.1 | -168.5 | 176.1 | 28 | 0 | 0 | 109.8 | ||||
| 279 | E | 30.3 | Very low | 32.6 | Very low | 194 Ų | 194 | 154.8 Ų | 154.8 | 91% | 0.907 | 79% | 0.792 | S | S | * | * | trans | 77.7 | 145.3 | 177.4 | -56.5 | -167 | 108.7 | 0 | 0 | 116.3 | ||||
| 280 | G | 29.4 | Very low | 32.5 | Very low | 77 Ų | 77 | 155.3 Ų | 155.3 | 79% | 0.794 | 79% | 0.791 | S | S | * | * | cis | -158.9 | -171.3 | 9.1 | 0 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 281 | D | 29.2 | Very low | 32.2 | Very low | 137 Ų | 137 | 155 Ų | 155 | 73% | 0.733 | 79% | 0.794 | S | S | * | * | trans | -104.1 | 155.5 | -147.5 | -169.7 | 34.7 | 0 | 0 | 0 | 117.7 | ||||
| 282 | Q | 37.4 | Very low | 31.7 | Very low | 162 Ų | 162 | 149.4 Ų | 149.4 | 76% | 0.757 | 79% | 0.786 | S | S | * | * | trans | 64.6 | 150.6 | 155.9 | -92.4 | 179.9 | 80.6 | 0 | 0 | 124.5 | ||||
| 283 | P | 39.9 | Very low | 31.3 | Very low | 115 Ų | 115 | 151.4 Ų | 151.4 | 75% | 0.747 | 79% | 0.792 | S | S | * | * | trans | -96.7 | 161.9 | -176.5 | 39.7 | -34.1 | 0 | 0 | 0 | 113.8 | ||||
| 284 | R | 31.5 | Very low | 31.2 | Very low | 240 Ų | 240 | 152.6 Ų | 152.6 | 91% | 0.906 | 79% | 0.794 | S | S | * | * | trans | -101.7 | 112 | 175.1 | -80.9 | -175.4 | 166 | -175.8 | -1.7 | 113.3 | ||||
| 285 | A | 34.3 | Very low | 31.2 | Very low | 96 Ų | 96 | 158.9 Ų | 158.9 | 79% | 0.793 | 81% | 0.805 | S | S | * | * | trans | -88.1 | 142.7 | 163.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 286 | K | 36.6 | Very low | 31.1 | Very low | 171 Ų | 171 | 159.3 Ų | 159.3 | 74% | 0.743 | 80% | 0.799 | S | S | * | * | trans | -147.8 | 105 | 161.8 | -73.9 | -164.8 | -179.7 | 178.2 | 0 | 114.4 | ||||
| 287 | R | 30.8 | Very low | 31 | Very low | 222 Ų | 222 | 159.9 Ų | 159.9 | 84% | 0.838 | 80% | 0.798 | S | S | * | * | trans | 58.6 | 105.7 | 134.9 | -50.7 | -174.6 | -165.2 | 175.3 | 2.2 | 121.4 | ||||
| 288 | L | 27.6 | Very low | 30.4 | Very low | 157 Ų | 157 | 155.3 Ų | 155.3 | 82% | 0.822 | 79% | 0.791 | S | S | * | * | 30.5 | 126.6 | 106.6 | -164.9 | 76.3 | 0 | 0 | 0 | 120 | V290 | L288-V290 HydrophobicContact CD1-CG2 3.96Å; L288-V290 HydrophobicContact CG-CG2 4.34Å | |||
| 289 | R | 25.5 | Very low | 30 | Very low | 249 Ų | 249 | 156.1 Ų | 156.1 | 94% | 0.94 | 79% | 0.793 | S | S | * | * | trans | -146.3 | 155.7 | 143.1 | -156.3 | 170.6 | -175.4 | 126.5 | 1.4 | 109.3 | ||||
| 290 | V | 30.4 | Very low | 30.1 | Very low | 102 Ų | 102 | 155.3 Ų | 155.3 | 62% | 0.618 | 79% | 0.789 | S | S | * | * | trans | -132 | 164.6 | -162.4 | 159.6 | 0 | 0 | 0 | 0 | 110.8 | L288 | L288-V290 HydrophobicContact CD1-CG2 3.96Å; L288-V290 HydrophobicContact CG-CG2 4.34Å | ||
| 291 | D | 25.6 | Very low | 30.9 | Very low | 146 Ų | 146 | 157.2 Ų | 157.2 | 78% | 0.781 | 79% | 0.787 | S | S | * | * | trans | 69.8 | 153.9 | 174.8 | -88.3 | 33.4 | 0 | 0 | 0 | 116.2 | ||||
| 292 | S | 26.9 | Very low | 30.9 | Very low | 81 Ų | 81 | 155.7 Ų | 155.7 | 57% | 0.566 | 79% | 0.794 | S | S | * | * | cis | -171.4 | 173 | -8.7 | -102 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 293 | E | 28.4 | Very low | 30.4 | Very low | 181 Ų | 181 | 152 Ų | 152 | 85% | 0.846 | 80% | 0.799 | S | S | * | * | cis | -158.7 | -163.3 | -5.7 | 49.1 | -142.4 | 105.7 | 0 | 0 | 109.6 | ||||
| 294 | D | 29.2 | Very low | 30.2 | Very low | 157 Ų | 157 | 151.2 Ų | 151.2 | 84% | 0.84 | 80% | 0.802 | S | S | * | * | trans | -73.7 | 150.4 | -179.7 | -83.1 | -74.3 | 0 | 0 | 0 | 115.6 | ||||
| 295 | E | 29.5 | Very low | 30.7 | Very low | 198 Ų | 198 | 146.1 Ų | 146.1 | 93% | 0.925 | 80% | 0.8 | S | S | * | * | trans | -158.3 | 156.6 | 134.5 | -129.2 | -172.6 | 137.9 | 0 | 0 | 113.6 | ||||
| 296 | M | 29.2 | Very low | 30.4 | Very low | 156 Ų | 156 | 145.1 Ų | 145.1 | 77% | 0.768 | 80% | 0.799 | S | S | * | * | trans | -139 | 147.7 | -169.4 | 177.1 | 170 | 52.9 | 0 | 0 | 110 | ||||
| 297 | L | 30.2 | Very low | 30.1 | Very low | 141 Ų | 141 | 142.7 Ų | 142.7 | 74% | 0.738 | 80% | 0.804 | S | S | * | * | trans | 137.6 | 150.6 | 144.6 | -72.9 | 174.3 | 0 | 0 | 0 | 117.4 | ||||
| 298 | S | 23.9 | Very low | 30.4 | Very low | 110 Ų | 110 | 142.9 Ų | 142.9 | 77% | 0.769 | 81% | 0.806 | S | S | * | * | trans | 80.6 | 149.9 | 159.4 | 80.8 | 0 | 0 | 0 | 0 | 119.4 | ||||
| 299 | F | 24.3 | Very low | 31.3 | Very low | 187 Ų | 187 | 142.1 Ų | 142.1 | 82% | 0.82 | 81% | 0.808 | S | S | * | * | cis | -178.2 | 155.2 | -41.3 | -110.1 | -68.2 | 0 | 0 | 0 | 105 | ||||
| 300 | H | 33.2 | Very low | 31.5 | Very low | 177 Ų | 177 | 137.6 Ų | 137.6 | 82% | 0.819 | 80% | 0.802 | S | S | * | * | trans | -73.5 | -173.7 | -175.2 | -63 | -78.4 | 0 | 0 | 0 | 113.7 | ||||
| 301 | P | 45.5 | Very low | 31.6 | Very low | 117 Ų | 117 | 138.9 Ų | 138.9 | 76% | 0.76 | 81% | 0.81 | S | S | * | * | cis | -149.5 | -174.5 | 9.5 | 45.6 | -25 | 0 | 0 | 0 | 119.8 | ||||
| 302 | A | 28.1 | Very low | 31.8 | Very low | 105 Ų | 105 | 137.2 Ų | 137.2 | 87% | 0.868 | 81% | 0.81 | S | S | * | * | trans | 75.9 | 137.8 | 143.1 | 0 | 0 | 0 | 0 | 0 | 122.2 | ||||
| 303 | G | 27.3 | Very low | 32.5 | Very low | 85 Ų | 85 | 138.3 Ų | 138.3 | 88% | 0.876 | 82% | 0.815 | S | S | * | * | trans | 163.1 | 62.4 | 170.6 | 0 | 0 | 0 | 0 | 0 | 116.5 | ||||
| 304 | A | 35.8 | Very low | 32.9 | Very low | 97 Ų | 97 | 137.5 Ų | 137.5 | 80% | 0.802 | 82% | 0.816 | S | S | * | * | trans | -103 | 144 | 161.3 | 0 | 0 | 0 | 0 | 0 | 109 | ||||
| 305 | P | 41.6 | Very low | 33.2 | Very low | 133 Ų | 133 | 138.9 Ų | 138.9 | 86% | 0.864 | 82% | 0.818 | S | S | * | * | -140 | 175.5 | 88.4 | 36 | -19.9 | 0 | 0 | 0 | 111.6 | |||||
| 306 | G | 29.1 | Very low | 33.4 | Very low | 76 Ų | 76 | 134.2 Ų | 134.2 | 78% | 0.784 | 81% | 0.805 | S | S | * | * | cis | 155.8 | 135.1 | 0.9 | 0 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 307 | S | 30.7 | Very low | 34.2 | Very low | 120 Ų | 120 | 132.7 Ų | 132.7 | 84% | 0.839 | 81% | 0.806 | S | S | * | * | trans | -142.9 | 111.6 | 177.5 | -169.8 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 308 | Y | 36.2 | Very low | 34.6 | Very low | 225 Ų | 225 | 135.5 Ų | 135.5 | 88% | 0.882 | 81% | 0.813 | S | S | * | * | trans | -86.7 | 131 | 171.1 | -101.4 | -108.5 | 0 | 0 | 0 | 109.3 | ||||
| 309 | V | 47.8 | Very low | 35.2 | Very low | 142 Ų | 142 | 136 Ų | 136 | 86% | 0.861 | 82% | 0.815 | S | S | * | * | trans | -131.6 | 143.8 | 144.2 | -73.2 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 310 | N | 28.8 | Very low | 36.5 | Very low | 154 Ų | 154 | 134.5 Ų | 134.5 | 82% | 0.824 | 82% | 0.815 | S | S | * | * | trans | -89.4 | 152 | -159.7 | -162.2 | 6.4 | 0 | 0 | 0 | 112.4 | ||||
| 311 | V | 31.8 | Very low | 37.1 | Very low | 128 Ų | 128 | 131.7 Ų | 131.7 | 78% | 0.776 | 81% | 0.813 | S | S | * | * | trans | -80.9 | 130 | 172.4 | 178.3 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 312 | S | 30 | Very low | 36.9 | Very low | 112 Ų | 112 | 135.6 Ų | 135.6 | 78% | 0.783 | 82% | 0.818 | S | S | * | * | trans | -105.6 | 129.2 | 168.7 | -168.7 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 313 | P | 41.1 | Very low | 37.7 | Very low | 103 Ų | 103 | 141.3 Ų | 141.3 | 67% | 0.669 | 82% | 0.818 | S | S | * | * | trans | -91.5 | 116.1 | -174.1 | 33.4 | -31.1 | 0 | 0 | 0 | 111.7 | ||||
| 314 | N | 37.4 | Very low | 38.4 | Very low | 164 Ų | 164 | 144.9 Ų | 144.9 | 88% | 0.877 | 82% | 0.817 | S | S | * | * | trans | 178.3 | 96.1 | 151 | -98.2 | -46.4 | 0 | 0 | 0 | 112.1 | ||||
| 315 | Q | 34.9 | Very low | 39.4 | Very low | 186 Ų | 186 | 147.3 Ų | 147.3 | 87% | 0.869 | 82% | 0.815 | S | S | * | * | trans | -172.6 | 153.1 | 142 | -107.1 | -172 | -6.9 | 0 | 0 | 111.4 | ||||
| 316 | P | 35.7 | Very low | 39.3 | Very low | 100 Ų | 100 | 146.2 Ų | 146.2 | 65% | 0.649 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -84.9 | 163 | -176.6 | 35.5 | -34.5 | 0 | 0 | 0 | 112.9 | ||
| 317 | P | 45.1 | Very low | 40.1 | Very low | 124 Ų | 124 | 148.8 Ų | 148.8 | 81% | 0.805 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -77.1 | 132.8 | -170.7 | 30.6 | -35.2 | 0 | 0 | 0 | 113.3 | ||
| 318 | F | 37.5 | Very low | 40.6 | Very low | 200 Ų | 200 | 148.7 Ų | 148.7 | 88% | 0.877 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -86.6 | 132.2 | 165.9 | -91.6 | -89 | 0 | 0 | 0 | 110.9 | ||
| 319 | C | 36.6 | Very low | 41 | Very low | 121 Ų | 121 | 144.3 Ų | 144.3 | 82% | 0.818 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -76.8 | 139.5 | -176.4 | -59.2 | 0 | 0 | 0 | 0 | 112.4 | ||
| 320 | L | 52.8 | Low | 41.1 | Very low | 156 Ų | 156 | 142.4 Ų | 142.4 | 82% | 0.817 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -82.9 | 138.6 | 168.3 | -70.7 | 165.6 | 0 | 0 | 0 | 110.1 | ||
| 321 | P | 45.1 | Very low | 41.9 | Very low | 118 Ų | 118 | 140.1 Ų | 140.1 | 77% | 0.766 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -70.7 | 135 | 176.8 | 29.1 | -33.5 | 0 | 0 | 0 | 111 | ||
| 322 | F | 41.8 | Very low | 42.2 | Very low | 198 Ų | 198 | 138.5 Ų | 138.5 | 87% | 0.868 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -68.1 | 131.9 | -175.9 | -65.4 | -94.2 | 0 | 0 | 0 | 112.2 | L324 | F322-L324 PolarHBondContact O-N 3.29Š|
| 323 | Y | 45.5 | Very low | 42.8 | Very low | 225 Ų | 225 | 138.8 Ų | 138.8 | 88% | 0.882 | 82% | 0.817 | S | S | * | * | trans | -66.9 | 110.2 | 159.3 | -79.6 | -90.2 | 0 | 0 | 0 | 108.9 | I325 | Y323-I325 PolarHBondContact O-N 2.91Š| ||
| 324 | L | 41.5 | Very low | 43.1 | Very low | 161 Ų | 161 | 138.3 Ų | 138.3 | 84% | 0.843 | 82% | 0.822 | S | S | * | * | trans | -81.2 | 102.8 | 173.6 | -155.3 | 79.8 | 0 | 0 | 0 | 109.4 | F322 P326 | F322-L324 PolarHBondContact O-N 3.29Å; L324-P326 WeakPolarHBondContact O-CD 3.38Å | ||
| 325 | I | 57 | Low | 43.6 | Very low | 147 Ų | 147 | 140.4 Ų | 140.4 | 75% | 0.754 | 82% | 0.819 | S | S | * | * | trans | -77.8 | 119.2 | 170.1 | -61.8 | 168.3 | 0 | 0 | 0 | 107.7 | Y323 P327 | Y323-I325 PolarHBondContact O-N 2.91Å; I325-P327 WeakPolarHBondContact O-CD 3.38Å | ||
| 326 | P | 38.4 | Very low | 44.3 | Very low | 111 Ų | 111 | 138.9 Ų | 138.9 | 72% | 0.721 | 82% | 0.816 | S | S | * | * | trans | -73.2 | 126.3 | 174.9 | -13.8 | 29.7 | 0 | 0 | 0 | 110.3 | L324 S328 | L324-P326 WeakPolarHBondContact O-CD 3.38Å; P326-S328 PolarHBondContact O-N 3.48Å | ||
| 327 | P | 46.4 | Very low | 44.8 | Very low | 129 Ų | 129 | 139.3 Ų | 139.3 | 84% | 0.838 | 82% | 0.819 | S | S | * | * | trans | -89.5 | 102 | 174.9 | 33.4 | -29.7 | 0 | 0 | 0 | 110.4 | I325 | I325-P327 WeakPolarHBondContact O-CD 3.38Š| ||
| 328 | S | 40.9 | Very low | 44.7 | Very low | 118 Ų | 118 | 142 Ų | 142 | 83% | 0.825 | 82% | 0.823 | S | S | * | * | trans | -156.5 | 142.8 | 143.9 | -156.8 | 0 | 0 | 0 | 0 | 112 | P326 | P326-S328 PolarHBondContact O-N 3.48Š| ||
| 329 | T | 44.9 | Very low | 45.4 | Very low | 134 Ų | 134 | 140.1 Ų | 140.1 | 82% | 0.822 | 82% | 0.821 | S | S | * | * | trans | -89.7 | 160.1 | -171.8 | 39.2 | 0 | 0 | 0 | 0 | 113 | ||||
| 330 | A | 49.8 | Very low | 45.8 | Very low | 101 Ų | 101 | 143.4 Ų | 143.4 | 84% | 0.835 | 83% | 0.825 | S | S | * | * | S | Bend | trans | 73.7 | 59.8 | 158.2 | 0 | 0 | 0 | 0 | 0 | 119.7 | ||
| 331 | A | 45.1 | Very low | 45.6 | Very low | 106 Ų | 106 | 145.3 Ų | 145.3 | 88% | 0.876 | 83% | 0.826 | S | S | * | * | S | Bend | trans | -157 | 32.7 | 156.2 | 0 | 0 | 0 | 0 | 0 | 116.5 | ||
| 332 | A | 39.5 | Very low | 45.8 | Very low | 95 Ų | 95 | 145.5 Ų | 145.5 | 79% | 0.785 | 83% | 0.829 | S | S | * | * | trans | -149.1 | 24.6 | -176.6 | 0 | 0 | 0 | 0 | 0 | 117 | A334 | A332-A334 PolarHBondContact O-N 3.17Š| ||
| 333 | A | 42.2 | Very low | 45.5 | Very low | 117 Ų | 117 | 147 Ų | 147 | 97% | 0.967 | 83% | 0.829 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -83.3 | 42 | -177.5 | 0 | 0 | 0 | 0 | 0 | 114.2 | ||
| 334 | A | 47.6 | Very low | 45.2 | Very low | 93 Ų | 93 | 145.6 Ų | 145.6 | 77% | 0.769 | 82% | 0.823 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -132.6 | -2.1 | -171.7 | 0 | 0 | 0 | 0 | 0 | 116.1 | A332 | A332-A334 PolarHBondContact O-N 3.17Š|
| 335 | Y | 48 | Very low | 45.3 | Very low | 208 Ų | 208 | 144.2 Ų | 144.2 | 82% | 0.816 | 82% | 0.824 | S | S | * | * | S | Bend | trans | -148.9 | 57.8 | -174.9 | -148.2 | -93 | 0 | 0 | 0 | 115.7 | ||
| 336 | L | 48.8 | Very low | 44.3 | Very low | 155 Ų | 155 | 140.5 Ų | 140.5 | 81% | 0.812 | 82% | 0.822 | S | S | * | * | trans | -149.6 | 83.5 | 158.5 | -78.9 | -172.9 | 0 | 0 | 0 | 112.6 | ||||
| 337 | P | 46.5 | Very low | 44.3 | Very low | 109 Ų | 109 | 139.1 Ų | 139.1 | 71% | 0.708 | 83% | 0.828 | S | S | * | * | trans | -82.1 | 151.1 | 155.2 | 33.4 | -29.8 | 0 | 0 | 0 | 110.8 | ||||
| 338 | M | 43.3 | Very low | 43.9 | Very low | 180 Ų | 180 | 141.3 Ų | 141.3 | 89% | 0.887 | 83% | 0.829 | S | S | * | * | S | Bend | trans | 74.8 | 41.5 | 168.7 | -64.8 | -178.9 | 46.2 | 0 | 0 | 120.4 | ||
| 339 | L | 51.9 | Low | 44 | Very low | 160 Ų | 160 | 141.1 Ų | 141.1 | 84% | 0.838 | 83% | 0.825 | S | S | * | * | trans | -122.8 | 33.7 | 159.9 | -73.3 | 176.9 | 0 | 0 | 0 | 113.9 | ||||
| 340 | E | 46 | Very low | 44.2 | Very low | 191 Ų | 191 | 141.8 Ų | 141.8 | 89% | 0.893 | 82% | 0.822 | S | S | * | * | S | Bend | trans | -104.2 | 3.5 | -176.8 | -148.2 | 177 | -148.5 | 0 | 0 | 114.3 | ||
| 341 | K | 47.8 | Very low | 43.8 | Very low | 196 Ų | 196 | 144.8 Ų | 144.8 | 85% | 0.852 | 82% | 0.821 | S | S | * | * | S | Bend | trans | -132.6 | 109.7 | 173.7 | -85.4 | 177.6 | 175 | 172.1 | 0 | 110.3 | ||
| 342 | C | 49.3 | Very low | 43.9 | Very low | 121 Ų | 121 | 150.3 Ų | 150.3 | 82% | 0.818 | 82% | 0.82 | S | S | * | * | trans | 150.3 | 48.1 | 147.2 | -80.3 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 343 | W | 36.3 | Very low | 44 | Very low | 231 Ų | 231 | 151.5 Ų | 151.5 | 88% | 0.875 | 82% | 0.82 | S | S | * | * | S | Bend | trans | -133.5 | 115.8 | 162.2 | -78.9 | 81.6 | 0 | 0 | 0 | 112 | ||
| 344 | Y | 38.5 | Very low | 43.5 | Very low | 194 Ų | 194 | 149.4 Ų | 149.4 | 76% | 0.761 | 81% | 0.81 | S | S | * | * | trans | 64.6 | 118.2 | 164.9 | -79.7 | -94.1 | 0 | 0 | 0 | 122.2 | ||||
| 345 | P | 44.3 | Very low | 43.2 | Very low | 132 Ų | 132 | 152.9 Ų | 152.9 | 86% | 0.857 | 82% | 0.815 | S | S | * | * | trans | -93.6 | 115.2 | 149.9 | 33.7 | -24.2 | 0 | 0 | 0 | 110.4 | ||||
| 346 | G | 34.7 | Very low | 42.6 | Very low | 69 Ų | 69 | 147.9 Ų | 147.9 | 71% | 0.711 | 82% | 0.817 | S | S | * | * | trans | 169.9 | 99.8 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 347 | G | 38.5 | Very low | 42 | Very low | 82 Ų | 82 | 144 Ų | 144 | 85% | 0.845 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -75 | 133.1 | 178.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | ||
| 348 | M | 38 | Very low | 42.2 | Very low | 176 Ų | 176 | 144.6 Ų | 144.6 | 87% | 0.867 | 82% | 0.818 | S | S | * | * | P | Polyproline II helix | trans | -100.7 | 128.1 | 169.3 | -72.2 | -70.3 | -165.9 | 0 | 0 | 109.7 | I350 | M348-I350 PolarHBondContact O-N 2.78Š|
| 349 | P | 44.1 | Very low | 41.8 | Very low | 113 Ų | 113 | 144 Ų | 144 | 73% | 0.734 | 82% | 0.815 | S | S | * | * | P | Polyproline II helix | trans | -79 | 118 | 175.8 | 30.5 | -31.8 | 0 | 0 | 0 | 110.8 | M351 | P349-M351 PolarHBondContact O-N 2.91Š|
| 350 | I | 48.5 | Very low | 41.4 | Very low | 148 Ų | 148 | 141.9 Ų | 141.9 | 76% | 0.759 | 81% | 0.811 | S | S | * | * | trans | -82.2 | 107.4 | 170.8 | -62.4 | 176.5 | 0 | 0 | 0 | 108.5 | M348 Y352 | M348-I350 PolarHBondContact O-N 2.78Å; I350-Y352 HydrophobicContact CG2-CD2 3.97Å | ||
| 351 | M | 40.3 | Very low | 40.6 | Very low | 164 Ų | 164 | 136.8 Ų | 136.8 | 81% | 0.808 | 81% | 0.81 | S | S | * | * | trans | -101.3 | 115.3 | 171.5 | -66.3 | -71.5 | -76.7 | 0 | 0 | 109.4 | P349 | P349-M351 PolarHBondContact O-N 2.91Š| ||
| 352 | Y | 48 | Very low | 39.9 | Very low | 222 Ų | 222 | 135.7 Ų | 135.7 | 87% | 0.871 | 81% | 0.812 | S | S | * | * | trans | -118.6 | 113 | 172.3 | -111.4 | -80.4 | 0 | 0 | 0 | 110.1 | I350 | I350-Y352 HydrophobicContact CG2-CD2 3.97Š| ||
| 353 | P | 41.2 | Very low | 39.9 | Very low | 120 Ų | 120 | 135.4 Ų | 135.4 | 78% | 0.779 | 81% | 0.809 | S | S | * | * | trans | -97.6 | 133.2 | 178 | -8.7 | 28.4 | 0 | 0 | 0 | 115.4 | ||||
| 354 | G | 32.2 | Very low | 39.6 | Very low | 73 Ų | 73 | 130.2 Ų | 130.2 | 75% | 0.753 | 81% | 0.808 | S | S | * | * | trans | 84.1 | 140.1 | 160 | 0 | 0 | 0 | 0 | 0 | 116.9 | ||||
| 355 | L | 41.3 | Very low | 39.3 | Very low | 167 Ų | 167 | 127.4 Ų | 127.4 | 87% | 0.874 | 80% | 0.802 | S | S | * | * | cis | -127.5 | 144.8 | 3.3 | -79.3 | 67.4 | 0 | 0 | 0 | 108.6 | ||||
| 356 | A | 35.2 | Very low | 39.3 | Very low | 103 Ų | 103 | 127 Ų | 127 | 85% | 0.851 | 80% | 0.799 | S | S | * | * | 50.3 | 129.4 | 74.5 | 0 | 0 | 0 | 0 | 0 | 114.9 | |||||
| 357 | G | 36.5 | Very low | 39.5 | Very low | 73 Ų | 73 | 129.4 Ų | 129.4 | 75% | 0.753 | 80% | 0.795 | S | S | * | * | cis | -165.7 | -161.1 | 12.2 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 358 | P | 49.3 | Very low | 39.9 | Very low | 122 Ų | 122 | 131.2 Ų | 131.2 | 79% | 0.792 | 79% | 0.792 | S | S | * | * | trans | -134.2 | 179.5 | -134.1 | 45.3 | -32 | 0 | 0 | 0 | 120.9 | ||||
| 359 | M | 36.1 | Very low | 39.8 | Very low | 167 Ų | 167 | 127 Ų | 127 | 82% | 0.823 | 78% | 0.78 | S | S | * | * | trans | 85.1 | 172.4 | 160.5 | -56.7 | -63.5 | -79.6 | 0 | 0 | 119.1 | ||||
| 360 | P | 43.2 | Very low | 39.4 | Very low | 116 Ų | 116 | 126.2 Ų | 126.2 | 75% | 0.753 | 78% | 0.776 | S | S | * | * | -137 | 169.4 | -75.8 | 42.3 | -25.9 | 0 | 0 | 0 | 115.9 | |||||
| 361 | G | 29.8 | Very low | 38.7 | Very low | 84 Ų | 84 | 127.4 Ų | 127.4 | 87% | 0.866 | 78% | 0.784 | S | S | * | * | trans | 152.8 | 141.5 | 161.4 | 0 | 0 | 0 | 0 | 0 | 119.3 | ||||
| 362 | L | 33.1 | Very low | 38.5 | Very low | 172 Ų | 172 | 126.1 Ų | 126.1 | 90% | 0.901 | 78% | 0.779 | S | S | * | * | trans | -96.8 | -176.4 | -179.9 | -81.6 | 163 | 0 | 0 | 0 | 112.6 | ||||
| 363 | P | 49.4 | Very low | 37.8 | Very low | 115 Ų | 115 | 123.6 Ų | 123.6 | 75% | 0.747 | 78% | 0.777 | S | S | * | * | cis | -135.4 | 176.6 | -26.6 | 32.8 | -13.4 | 0 | 0 | 0 | 114.8 | ||||
| 364 | S | 28.6 | Very low | 37.6 | Very low | 123 Ų | 123 | 122.2 Ų | 122.2 | 86% | 0.86 | 77% | 0.771 | S | S | * | * | 175 | 141.9 | 122.7 | -169 | 0 | 0 | 0 | 0 | 113.9 | |||||
| 365 | E | 33.4 | Very low | 38.3 | Very low | 135 Ų | 135 | 124.9 Ų | 124.9 | 63% | 0.631 | 78% | 0.775 | S | S | * | * | trans | -82.5 | 178.7 | 172.2 | -119.2 | -149.8 | 92.7 | 0 | 0 | 112.1 | L367 | E365-L367 WeakPolarHBondContact OE1-CD1 3.42Å; E365-L367 PolarHBondContact OE1-N 2.69Å; E365-L367 VanDerWaalsContact OE1-N 3.08Å | ||
| 366 | P | 43.9 | Very low | 37.8 | Very low | 122 Ų | 122 | 128.6 Ų | 128.6 | 79% | 0.792 | 78% | 0.777 | S | S | * | * | cis | -134.8 | 166.7 | 27.5 | 33 | -9.5 | 0 | 0 | 0 | 121.7 | ||||
| 367 | L | 38.1 | Very low | 37.7 | Very low | 120 Ų | 120 | 128.5 Ų | 128.5 | 63% | 0.628 | 78% | 0.776 | S | S | * | * | trans | -56.7 | 179.4 | 171.1 | -84.8 | 160.6 | 0 | 0 | 0 | 116 | E365 | E365-L367 WeakPolarHBondContact OE1-CD1 3.42Å; E365-L367 PolarHBondContact OE1-N 2.69Å; E365-L367 VanDerWaalsContact OE1-N 3.08Å | ||
| 368 | P | 47.3 | Very low | 37.3 | Very low | 121 Ų | 121 | 129 Ų | 129 | 79% | 0.786 | 78% | 0.782 | S | S | * | * | cis | -127.3 | 154.6 | 16.9 | 29.6 | -6.7 | 0 | 0 | 0 | 116.5 | ||||
| 369 | S | 37.1 | Very low | 36.5 | Very low | 88 Ų | 88 | 128.7 Ų | 128.7 | 62% | 0.615 | 78% | 0.783 | S | S | * | * | 87.5 | 104.8 | 52.5 | -112.4 | 0 | 0 | 0 | 0 | 116.5 | |||||
| 370 | S | 34.3 | Very low | 37.2 | Very low | 95 Ų | 95 | 125.9 Ų | 125.9 | 66% | 0.664 | 78% | 0.777 | S | S | * | * | trans | 41.8 | 138.8 | 136.4 | 65.6 | 0 | 0 | 0 | 0 | 122.2 | ||||
| 371 | L | 33.3 | Very low | 36.6 | Very low | 174 Ų | 174 | 126.9 Ų | 126.9 | 91% | 0.911 | 78% | 0.78 | S | S | * | * | -170.4 | 156.8 | 101.6 | -98.7 | 167.4 | 0 | 0 | 0 | 114.2 | |||||
| 372 | L | 37.1 | Very low | 36.6 | Very low | 136 Ų | 136 | 127.5 Ų | 127.5 | 71% | 0.712 | 78% | 0.778 | S | S | * | * | trans | -108.9 | 143.4 | -176.4 | -164.1 | 168.8 | 0 | 0 | 0 | 107.7 | ||||
| 373 | M | 33.5 | Very low | 36.4 | Very low | 169 Ų | 169 | 125 Ų | 125 | 83% | 0.833 | 77% | 0.774 | S | S | * | * | trans | -167 | 159.6 | 148.1 | -105.2 | -39.7 | 102.2 | 0 | 0 | 116.2 | ||||
| 374 | S | 37 | Very low | 36.3 | Very low | 92 Ų | 92 | 124.9 Ų | 124.9 | 64% | 0.643 | 77% | 0.773 | S | S | * | * | trans | -80.3 | 173.7 | 177.6 | -168.1 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 375 | P | 45.8 | Very low | 36.4 | Very low | 129 Ų | 129 | 124.6 Ų | 124.6 | 84% | 0.838 | 77% | 0.766 | S | S | * | * | -149.3 | 175.9 | 97.5 | 38.2 | -20.7 | 0 | 0 | 0 | 116.2 | |||||
| 376 | R | 30.9 | Very low | 36.3 | Very low | 244 Ų | 244 | 123 Ų | 123 | 92% | 0.921 | 78% | 0.776 | S | S | * | * | trans | -137.4 | 151.5 | 171.6 | 179.7 | 176.8 | 179.7 | 147.6 | 2 | 111.6 | ||||
| 377 | A | 33.9 | Very low | 35.8 | Very low | 101 Ų | 101 | 125.5 Ų | 125.5 | 84% | 0.835 | 78% | 0.777 | S | S | * | * | trans | 106.6 | 122.6 | 156.5 | 0 | 0 | 0 | 0 | 0 | 117.4 | ||||
| 378 | G | 27.9 | Very low | 35.4 | Very low | 84 Ų | 84 | 130.1 Ų | 130.1 | 87% | 0.866 | 79% | 0.786 | S | S | * | * | trans | 164 | 120.9 | 173 | 0 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 379 | S | 33 | Very low | 34.7 | Very low | 116 Ų | 116 | 131.4 Ų | 131.4 | 81% | 0.811 | 79% | 0.785 | S | S | * | * | trans | -151.8 | 152.1 | 173 | -164.6 | 0 | 0 | 0 | 0 | 105 | ||||
| 380 | P | 50.5 | Low | 35.4 | Very low | 107 Ų | 107 | 132.4 Ų | 132.4 | 70% | 0.695 | 79% | 0.789 | S | S | * | * | cis | -153.2 | -169 | 37.7 | 45.9 | -24.4 | 0 | 0 | 0 | 117.9 | ||||
| 381 | V | 30.7 | Very low | 35.5 | Very low | 137 Ų | 137 | 135.2 Ų | 135.2 | 83% | 0.83 | 79% | 0.794 | S | S | * | * | trans | 61.6 | 111.9 | 159.8 | 179.4 | 0 | 0 | 0 | 0 | 118.9 | ||||
| 382 | A | 29.5 | Very low | 35.5 | Very low | 98 Ų | 98 | 133.7 Ų | 133.7 | 81% | 0.81 | 79% | 0.786 | S | S | * | * | 172.2 | 136.6 | 117.2 | 0 | 0 | 0 | 0 | 0 | 112.8 | |||||
| 383 | S | 30.4 | Very low | 35.4 | Very low | 118 Ų | 118 | 131.9 Ų | 131.9 | 83% | 0.825 | 79% | 0.785 | S | S | * | * | trans | -123.1 | 167 | 159.2 | -134 | 0 | 0 | 0 | 0 | 106 | ||||
| 384 | P | 46.6 | Very low | 36.2 | Very low | 113 Ų | 113 | 129.5 Ų | 129.5 | 73% | 0.734 | 78% | 0.782 | S | S | * | * | cis | -145.6 | -156.7 | 28.2 | 41.6 | -19 | 0 | 0 | 0 | 115.3 | ||||
| 385 | V | 30.3 | Very low | 36.3 | Very low | 118 Ų | 118 | 131.1 Ų | 131.1 | 72% | 0.715 | 79% | 0.788 | S | S | * | * | trans | 114.1 | 94.4 | 159.9 | -173.3 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 386 | A | 30.9 | Very low | 36 | Very low | 100 Ų | 100 | 132.7 Ų | 132.7 | 83% | 0.826 | 79% | 0.789 | S | S | * | * | trans | -119.5 | 135.3 | 155.7 | 0 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 387 | H | 33.5 | Very low | 36.5 | Very low | 175 Ų | 175 | 129.9 Ų | 129.9 | 81% | 0.81 | 79% | 0.786 | S | S | * | * | trans | -90.1 | 125.6 | -179.6 | -91.5 | -68.4 | 0 | 0 | 0 | 112.4 | ||||
| 388 | R | 30.3 | Very low | 36.8 | Very low | 217 Ų | 217 | 134.8 Ų | 134.8 | 82% | 0.819 | 79% | 0.788 | S | S | * | * | trans | 5.2 | 125 | 157.3 | -68.7 | -175 | 171 | -145.6 | -2.1 | 119.1 | ||||
| 389 | I | 32.7 | Very low | 37.1 | Very low | 149 Ų | 149 | 135.3 Ų | 135.3 | 76% | 0.764 | 78% | 0.784 | S | S | * | * | 67.7 | 125.2 | 71.2 | -66.3 | 171.1 | 0 | 0 | 0 | 111 | |||||
| 390 | P | 51.6 | Low | 37.2 | Very low | 109 Ų | 109 | 137.7 Ų | 137.7 | 71% | 0.708 | 79% | 0.787 | S | S | * | * | -151.5 | 159.9 | 67.9 | 40.9 | -21.1 | 0 | 0 | 0 | 121.7 | |||||
| 391 | M | 36 | Very low | 36.6 | Very low | 154 Ų | 154 | 144 Ų | 144 | 76% | 0.759 | 80% | 0.797 | S | S | * | * | trans | 64.2 | 146.2 | 147.3 | -74 | -2 | -137.9 | 0 | 0 | 119.8 | ||||
| 392 | D | 33.2 | Very low | 36.8 | Very low | 142 Ų | 142 | 145.9 Ų | 145.9 | 76% | 0.759 | 80% | 0.797 | S | S | * | * | cis | -143.2 | 168.3 | 8.5 | -102.9 | -40.2 | 0 | 0 | 0 | 113 | ||||
| 393 | S | 36 | Very low | 37 | Very low | 98 Ų | 98 | 146.8 Ų | 146.8 | 69% | 0.685 | 79% | 0.792 | S | S | * | * | trans | -126.1 | 159.4 | 170.2 | -162.8 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 394 | P | 49.8 | Very low | 37.2 | Very low | 119 Ų | 119 | 146.3 Ų | 146.3 | 77% | 0.773 | 79% | 0.788 | S | S | * | * | -151.7 | 155.7 | 95.3 | 37.3 | -19.2 | 0 | 0 | 0 | 117.3 | |||||
| 395 | T | 38.8 | Very low | 37.3 | Very low | 125 Ų | 125 | 146.3 Ų | 146.3 | 77% | 0.767 | 79% | 0.788 | S | S | * | * | trans | -63.1 | 141.3 | 159 | 41.5 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 396 | L | 39.2 | Very low | 37.8 | Very low | 163 Ų | 163 | 148.9 Ų | 148.9 | 85% | 0.853 | 80% | 0.797 | S | S | * | * | trans | -146.1 | 81.4 | 158 | -112.7 | 175.8 | 0 | 0 | 0 | 113.3 | ||||
| 397 | H | 41.8 | Very low | 38 | Very low | 185 Ų | 185 | 151.4 Ų | 151.4 | 86% | 0.856 | 80% | 0.797 | S | S | * | * | trans | -100.9 | 115 | 157.3 | -83.9 | -85.1 | 0 | 0 | 0 | 108.9 | ||||
| 398 | K | 39.6 | Very low | 38.6 | Very low | 204 Ų | 204 | 151.3 Ų | 151.3 | 89% | 0.887 | 80% | 0.801 | S | S | * | * | trans | 136.2 | 80.3 | 161.1 | -81 | 177.8 | 171.5 | 178.4 | 0 | 113.9 | ||||
| 399 | A | 35.4 | Very low | 39 | Very low | 95 Ų | 95 | 149 Ų | 149 | 79% | 0.785 | 80% | 0.8 | S | S | * | * | trans | -170 | 118 | 145.2 | 0 | 0 | 0 | 0 | 0 | 104.7 | ||||
| 400 | L | 35 | Very low | 39.6 | Very low | 165 Ų | 165 | 148.7 Ų | 148.7 | 86% | 0.864 | 81% | 0.805 | S | S | * | * | -156.9 | 122.7 | 76.5 | -150 | 74.5 | 0 | 0 | 0 | 111.1 | |||||
| 401 | R | 37.8 | Very low | 39.3 | Very low | 241 Ų | 241 | 152.2 Ų | 152.2 | 91% | 0.909 | 81% | 0.809 | S | S | * | * | trans | -134.5 | 146 | 157.6 | -84 | -109.9 | -102.6 | -165.5 | -6.3 | 105.4 | ||||
| 402 | Q | 33.9 | Very low | 39.6 | Very low | 175 Ų | 175 | 156.2 Ų | 156.2 | 82% | 0.818 | 83% | 0.834 | S | S | * | * | trans | 76.8 | 143.9 | -176.2 | -55.6 | -178.5 | -9.4 | 0 | 0 | 113.7 | ||||
| 403 | V | 34.5 | Very low | 39.9 | Very low | 118 Ų | 118 | 156.9 Ų | 156.9 | 72% | 0.715 | 84% | 0.838 | S | S | * | * | cis | -160.1 | 125.5 | -0.8 | 118.1 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 404 | S | 33.3 | Very low | 40.2 | Very low | 107 Ų | 107 | 160 Ų | 160 | 75% | 0.748 | 85% | 0.846 | S | S | * | * | 87.1 | 158.4 | 115.3 | -61.5 | 0 | 0 | 0 | 0 | 118.3 | |||||
| 405 | P | 49.3 | Very low | 39.6 | Very low | 113 Ų | 113 | 162.3 Ų | 162.3 | 73% | 0.734 | 85% | 0.85 | S | S | * | * | trans | -104.7 | 167.7 | -161.9 | 40.4 | -34.7 | 0 | 0 | 0 | 114.7 | ||||
| 406 | L | 41 | Very low | 39.7 | Very low | 173 Ų | 173 | 164.5 Ų | 164.5 | 91% | 0.906 | 86% | 0.855 | S | S | * | * | trans | -133.1 | 126.8 | 163 | -83.4 | 169.7 | 0 | 0 | 0 | 111.2 | ||||
| 407 | N | 35.9 | Very low | 39.7 | Very low | 152 Ų | 152 | 164.6 Ų | 164.6 | 81% | 0.813 | 86% | 0.855 | S | S | * | * | trans | -77.5 | 151 | 160 | -80.7 | -102 | 0 | 0 | 0 | 108.4 | ||||
| 408 | L | 45 | Very low | 39.5 | Very low | 173 Ų | 173 | 163.2 Ų | 163.2 | 91% | 0.906 | 85% | 0.854 | S | S | * | * | trans | -144.2 | 132.1 | 149.7 | -111.5 | 166.9 | 0 | 0 | 0 | 110.6 | ||||
| 409 | E | 38.6 | Very low | 39.5 | Very low | 168 Ų | 168 | 160.3 Ų | 160.3 | 79% | 0.785 | 85% | 0.852 | S | S | * | * | trans | -75.4 | 133.7 | -175.3 | -176.8 | 177.1 | 108 | 0 | 0 | 110.5 | ||||
| 410 | T | 45.6 | Very low | 39.9 | Very low | 144 Ų | 144 | 165.3 Ų | 165.3 | 88% | 0.883 | 86% | 0.857 | S | S | * | * | trans | -108.1 | 114.4 | 166.3 | 48.3 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 411 | K | 45 | Very low | 40.3 | Very low | 182 Ų | 182 | 165.3 Ų | 165.3 | 79% | 0.791 | 86% | 0.857 | S | S | * | * | trans | -118.6 | 111.2 | 170.3 | 173.6 | -176.6 | 178.3 | 176.5 | 0 | 108.2 | ||||
| 412 | D | 43.3 | Very low | 40.5 | Very low | 238 Ų | 238 | 158.5 Ų | 158.5 | 100% | 1.273 | 85% | 0.852 | S | S | * | * | trans | -153.8 | 0 | 142.8 | -135.3 | -84.1 | 0 | 0 | 0 | 107.3 |
Retrieved 412 of 412 residues in 50.2 ms
(Link to these results)