| 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 | 43.4 | Very low | 51 | Low | 229 Ų | 229 | 153 Ų | 153 | 100% | 1.128 | 82% | 0.823 | S | S | * | * | 0 | 94.2 | 0 | -64.3 | 175.2 | -177.6 | 0 | 0 | 106.3 | |||||
| 2 | N | 41.7 | Very low | 50.5 | Low | 154 Ų | 154 | 153.8 Ų | 153.8 | 82% | 0.824 | 82% | 0.821 | S | S | * | * | trans | -88.1 | 114 | -173.8 | -70.5 | 19.6 | 0 | 0 | 0 | 108.8 | N4 | N2-N4 PolarHBondContact O-N 3.47Š| ||
| 3 | L | 57.1 | Low | 50.2 | Low | 152 Ų | 152 | 150.5 Ų | 150.5 | 80% | 0.796 | 81% | 0.814 | S | S | * | * | trans | -82.7 | 97.4 | 176.2 | -71.4 | 157.3 | 0 | 0 | 0 | 108.6 | Y5 | L3-Y5 PolarHBondContact O-N 3Å; L3-Y5 VanDerWaalsContact O-N 3.13Å | ||
| 4 | N | 47.6 | Very low | 50.5 | Low | 151 Ų | 151 | 145.6 Ų | 145.6 | 81% | 0.807 | 80% | 0.804 | S | S | * | * | trans | -73.3 | 97.5 | 169.6 | -74 | -32.6 | 0 | 0 | 0 | 109.3 | N2 T6 | N2-N4 PolarHBondContact O-N 3.47Å; N4-T6 PolarHBondContact O-N 3.06Å | ||
| 5 | Y | 47 | Very low | 50.6 | Low | 225 Ų | 225 | 148.9 Ų | 148.9 | 88% | 0.882 | 81% | 0.811 | S | S | * | * | trans | -78.8 | 92.4 | 164.8 | -96 | -92 | 0 | 0 | 0 | 108.9 | L3 | L3-Y5 PolarHBondContact O-N 3Å; L3-Y5 VanDerWaalsContact O-N 3.13Å | ||
| 6 | T | 60.1 | Low | 51.1 | Low | 129 Ų | 129 | 151.3 Ų | 151.3 | 79% | 0.791 | 80% | 0.804 | S | S | * | * | trans | -85.3 | 110 | 165.9 | -174.3 | 0 | 0 | 0 | 0 | 108.6 | N4 | N4-T6 PolarHBondContact O-N 3.06Š| ||
| 7 | S | 54.4 | Low | 51.6 | Low | 99 Ų | 99 | 149.2 Ų | 149.2 | 69% | 0.692 | 80% | 0.804 | S | S | * | * | trans | -72.9 | 138.6 | 174.1 | -164.8 | 0 | 0 | 0 | 0 | 109.9 | V9 | S7-V9 PolarHBondContact O-N 3.39Š| ||
| 8 | P | 53.9 | Low | 52.4 | Low | 116 Ų | 116 | 147.1 Ų | 147.1 | 75% | 0.753 | 80% | 0.798 | S | S | * | * | trans | -75.9 | 112.4 | 177.1 | 29.1 | -29.1 | 0 | 0 | 0 | 109.5 | P10 | P8-P10 WeakPolarHBondContact O-CD 3.26Š| ||
| 9 | V | 54.4 | Low | 53.6 | Low | 127 Ų | 127 | 141.4 Ų | 141.4 | 77% | 0.77 | 77% | 0.77 | S | S | * | * | trans | -61.5 | 124.7 | 169.8 | 179.1 | 0 | 0 | 0 | 0 | 108.8 | S7 Q11 | S7-V9 PolarHBondContact O-N 3.39Å; V9-Q11 PolarHBondContact O-N 3.27Å; V9-Q11 VanDerWaalsContact O-N 3.17Å | ||
| 10 | P | 50.1 | Low | 54.7 | Low | 112 Ų | 112 | 143.1 Ų | 143.1 | 73% | 0.727 | 77% | 0.77 | S | S | * | * | trans | -66.3 | 115.5 | 171.4 | -14.6 | 28.4 | 0 | 0 | 0 | 108.9 | P8 M12 | P8-P10 WeakPolarHBondContact O-CD 3.26Å; P10-M12 PolarHBondContact O-N 3.06Å; P10-M12 VanDerWaalsContact O-N 3.1Å | ||
| 11 | Q | 51.5 | Low | 55.9 | Low | 189 Ų | 189 | 143.6 Ų | 143.6 | 88% | 0.883 | 77% | 0.766 | S | S | * | * | trans | -61.6 | 113.3 | 171.4 | -68.7 | 179.3 | 6.3 | 0 | 0 | 108.8 | V9 | V9-Q11 PolarHBondContact O-N 3.27Å; V9-Q11 VanDerWaalsContact O-N 3.17Å | ||
| 12 | M | 44.5 | Very low | 57.6 | Low | 163 Ų | 163 | 138.9 Ų | 138.9 | 80% | 0.803 | 74% | 0.743 | S | S | * | * | trans | -59.5 | 133.4 | 168.3 | -69.2 | -98.9 | 78.5 | 0 | 0 | 108.8 | P10 A14 | P10-M12 PolarHBondContact O-N 3.06Å; P10-M12 VanDerWaalsContact O-N 3.1Å; M12-A14 PolarHBondContact O-N 3.3Å | ||
| 13 | P | 47.4 | Very low | 59.3 | Low | 111 Ų | 111 | 139 Ų | 139 | 72% | 0.721 | 74% | 0.739 | S | S | * | * | trans | -65.9 | 114.7 | 175.7 | 26.6 | -31.2 | 0 | 0 | 0 | 108.5 | Q15 | P13-Q15 PolarHBondContact O-N 3.06Š| ||
| 14 | A | 53.8 | Low | 60 | Low | 82 Ų | 82 | 134.5 Ų | 134.5 | 68% | 0.678 | 72% | 0.716 | S | S | * | * | trans | -46.6 | 126.2 | 172.5 | 0 | 0 | 0 | 0 | 0 | 109.8 | M12 R16 | M12-A14 PolarHBondContact O-N 3.3Å; A14-R16 PolarHBondContact O-N 3.41Å | ||
| 15 | Q | 52.6 | Low | 61.4 | Low | 194 Ų | 194 | 132.7 Ų | 132.7 | 91% | 0.907 | 71% | 0.705 | S | S | * | * | trans | -57.8 | 100.6 | 170.6 | -70.8 | -113.4 | -45.7 | 0 | 0 | 107.7 | P13 S17 | P13-Q15 PolarHBondContact O-N 3.06Å; Q15-S17 PolarHBondContact O-N 2.93Å; Q15-S17 VanDerWaalsContact O-N 3.14Å | ||
| 16 | R | 58.5 | Low | 62.6 | Low | 188 Ų | 188 | 128.6 Ų | 128.6 | 71% | 0.709 | 70% | 0.698 | S | S | * | * | trans | -78.6 | 99.7 | 175.8 | -62.9 | -170.5 | -179.4 | -148.3 | -4.4 | 106.9 | A14 T18 | A14-R16 PolarHBondContact O-N 3.41Å; R16-T18 PolarHBondContact O-N 2.82Å | ||
| 17 | S | 59.2 | Low | 63.1 | Low | 115 Ų | 115 | 129.4 Ų | 129.4 | 80% | 0.804 | 70% | 0.697 | S | S | * | * | trans | -51.3 | 114.1 | 164.5 | -84.4 | 0 | 0 | 0 | 0 | 107.8 | Q15 S19 | Q15-S17 PolarHBondContact O-N 2.93Å; Q15-S17 VanDerWaalsContact O-N 3.14Å; S17-S19 VanDerWaalsContact C-N 3.27Å; S17-S19 PolarHBondContact O-N 3.01Å | ||
| 18 | T | 66.4 | Low | 63.9 | Low | 111 Ų | 111 | 130.5 Ų | 130.5 | 68% | 0.681 | 69% | 0.691 | S | S | * | * | trans | -67.1 | 94.2 | 171.7 | 55.4 | 0 | 0 | 0 | 0 | 107 | R16 F20 | R16-T18 PolarHBondContact O-N 2.82Å; T18-F20 WeakPolarHBondContact O-CD2 3.31Å | ||
| 19 | S | 75.3 | Confident | 64.2 | Low | 40 Ų | 40 | 134 Ų | 134 | 28% | 0.28 | 69% | 0.694 | S | S | . | * | trans | -70.4 | 133.6 | 175.1 | 174.3 | 0 | 0 | 0 | 0 | 109.4 | S17 F21 D24 | S17-S19 VanDerWaalsContact C-N 3.27Å; S17-S19 PolarHBondContact O-N 3.01Å; S19-F21 VanDerWaalsContact C-N 3.34Å; S19-F21 VanDerWaalsContact OG-CD2 3.26Å; S19-F21 WeakPolarHBondContact OG-CD2 3.44Å; S19-F21 PolarHBondContact OG-N 3.49Å; S19-D24 WeakPolarHBondContact CB-OD2 3.45Å; S19-D24 PolarHBondContact OG-OD2 3.27Å | ||
| 20 | F | 74.4 | Confident | 64.5 | Low | 175 Ų | 175 | 133.7 Ų | 133.7 | 77% | 0.768 | 69% | 0.694 | S | S | * | * | trans | -95.5 | 10.9 | 177.9 | -68.4 | -83.7 | 0 | 0 | 0 | 112.4 | T18 | T18-F20 WeakPolarHBondContact O-CD2 3.31Š| ||
| 21 | F | 81 | Confident | 64.6 | Low | 154 Ų | 154 | 135.6 Ų | 135.6 | 68% | 0.675 | 69% | 0.691 | S | S | * | * | trans | -63.6 | 139.2 | 170 | -73.1 | -65.2 | 0 | 0 | 0 | 109.7 | S19 E23 D24 I25 | S19-F21 VanDerWaalsContact C-N 3.34Å; S19-F21 VanDerWaalsContact OG-CD2 3.26Å; S19-F21 WeakPolarHBondContact OG-CD2 3.44Å; S19-F21 PolarHBondContact OG-N 3.49Å; F21-E23 PolarHBondContact O-N 3.11Å; F21-D24 PolarHBondContact O-N 2.74Å; F21-I25 PolarHBondContact O-N 3.01Å | ||
| 22 | I | 79.5 | Confident | 64.6 | Low | 129 Ų | 129 | 132.3 Ų | 132.3 | 66% | 0.662 | 69% | 0.686 | S | S | * | * | H | α-helix | trans | -59 | -36.2 | -179.2 | -68 | 159 | 0 | 0 | 0 | 109.9 | D24 I25 L26 | I22-D24 PolarHBondContact O-N 3.22Å; I22-I25 PolarHBondContact O-N 3.35Å; I22-L26 HydrophobicContact CG2-CD1 3.55Å; I22-L26 HydrophobicContact CG2-CG 4.09Å; I22-L26 WeakPolarHBondContact O-CB 3.35Å; I22-L26 WeakPolarHBondContact O-CG 3.35Å; I22-L26 PolarHBondContact O-N 2.96Å |
| 23 | E | 75.8 | Confident | 64.7 | Low | 157 Ų | 157 | 132.5 Ų | 132.5 | 73% | 0.734 | 69% | 0.69 | S | S | * | * | H | α-helix | trans | -61 | -42.4 | 176.4 | -60.6 | -169 | -176.5 | 0 | 0 | 112.1 | F21 L26 L27 | F21-E23 PolarHBondContact O-N 3.11Å; E23-L26 PolarHBondContact O-N 3.41Å; E23-L27 WeakPolarHBondContact O-CB 3.47Å; E23-L27 PolarHBondContact O-N 2.86Å |
| 24 | D | 73.2 | Confident | 65 | Low | 58 Ų | 58 | 138.2 Ų | 138.2 | 31% | 0.31 | 70% | 0.697 | S | S | . | * | H | α-helix | trans | -64.5 | -47.2 | 177.3 | -75.5 | -49.4 | 0 | 0 | 0 | 111 | S19 F21 I22 L26 L27 H28 | S19-D24 WeakPolarHBondContact CB-OD2 3.45Å; S19-D24 PolarHBondContact OG-OD2 3.27Å; F21-D24 PolarHBondContact O-N 2.74Å; I22-D24 PolarHBondContact O-N 3.22Å; D24-L26 VanDerWaalsContact C-N 3.29Å; D24-L26 PolarHBondContact O-N 3.45Å; D24-L27 PolarHBondContact O-N 3.29Å; D24-H28 PolarHBondContact O-N 3Å; D24-H28 PolarHBondContact O-ND1 2.89Å |
| 25 | I | 75.9 | Confident | 64.8 | Low | 112 Ų | 112 | 142.3 Ų | 142.3 | 57% | 0.574 | 70% | 0.702 | S | S | * | * | H | α-helix | trans | -60.9 | -40.9 | 179.9 | -60.4 | 170.9 | 0 | 0 | 0 | 111.3 | F21 I22 | F21-I25 PolarHBondContact O-N 3.01Å; I22-I25 PolarHBondContact O-N 3.35Å |
| 26 | L | 73.4 | Confident | 64.6 | Low | 140 Ų | 140 | 138.6 Ų | 138.6 | 73% | 0.733 | 69% | 0.692 | S | S | * | * | H | α-helix | trans | -73.9 | -30.9 | -179.8 | -67.2 | 176.4 | 0 | 0 | 0 | 112.9 | I22 E23 D24 | I22-L26 HydrophobicContact CG2-CD1 3.55Å; I22-L26 HydrophobicContact CG2-CG 4.09Å; I22-L26 WeakPolarHBondContact O-CB 3.35Å; I22-L26 WeakPolarHBondContact O-CG 3.35Å; I22-L26 PolarHBondContact O-N 2.96Å; E23-L26 PolarHBondContact O-N 3.41Å; D24-L26 VanDerWaalsContact C-N 3.29Å; D24-L26 PolarHBondContact O-N 3.45Å |
| 27 | L | 70.7 | Confident | 63.8 | Low | 146 Ų | 146 | 137.5 Ų | 137.5 | 76% | 0.764 | 69% | 0.693 | S | S | * | * | H | α-helix | trans | -97.5 | -9.7 | -173.2 | -146.8 | 72.1 | 0 | 0 | 0 | 113.6 | E23 D24 K29 | E23-L27 WeakPolarHBondContact O-CB 3.47Å; E23-L27 PolarHBondContact O-N 2.86Å; D24-L27 PolarHBondContact O-N 3.29Å; L27-K29 VanDerWaalsContact C-N 3.28Å; L27-K29 PolarHBondContact O-N 3.46Å |
| 28 | H | 69.9 | Low | 63.4 | Low | 122 Ų | 122 | 140.8 Ų | 140.8 | 57% | 0.565 | 70% | 0.695 | S | S | * | * | trans | -65.4 | 90.3 | 168 | -84.4 | 86 | 0 | 0 | 0 | 109.6 | D24 P30 | D24-H28 PolarHBondContact O-N 3Å; D24-H28 PolarHBondContact O-ND1 2.89Å; H28-P30 WeakPolarHBondContact O-CD 3.22Å; H28-P30 VanDerWaalsContact O-N 3.12Å | ||
| 29 | K | 61.2 | Low | 62.4 | Low | 190 Ų | 190 | 142.1 Ų | 142.1 | 83% | 0.826 | 70% | 0.697 | S | S | * | * | P | Polyproline II helix | trans | -48.2 | 119.4 | 158.5 | -105.5 | 116.7 | 159.1 | 177.4 | 0 | 107 | L27 K31 | L27-K29 VanDerWaalsContact C-N 3.28Å; L27-K29 PolarHBondContact O-N 3.46Å; K29-K31 PolarHBondContact O-N 3.35Å; K29-K31 VanDerWaalsContact O-N 3.09Å |
| 30 | P | 60.7 | Low | 61.1 | Low | 119 Ų | 119 | 146.1 Ų | 146.1 | 77% | 0.773 | 72% | 0.722 | S | S | * | * | P | Polyproline II helix | trans | -56.4 | 124.7 | 168.5 | 24.3 | -31.3 | 0 | 0 | 0 | 106.5 | H28 | H28-P30 WeakPolarHBondContact O-CD 3.22Å; H28-P30 VanDerWaalsContact O-N 3.12Å |
| 31 | K | 52.1 | Low | 59.6 | Low | 153 Ų | 153 | 146.9 Ų | 146.9 | 67% | 0.665 | 73% | 0.725 | S | S | * | * | P | Polyproline II helix | trans | -52.4 | 132.5 | 171.5 | -69 | 170.8 | -177.4 | 168.7 | 0 | 106.3 | K29 L33 | K29-K31 PolarHBondContact O-N 3.35Å; K29-K31 VanDerWaalsContact O-N 3.09Å; K31-L33 PolarHBondContact O-N 3.42Å |
| 32 | P | 50.8 | Low | 58.3 | Low | 120 Ų | 120 | 144.4 Ų | 144.4 | 78% | 0.779 | 73% | 0.728 | S | S | * | * | P | Polyproline II helix | trans | -52.7 | 124.4 | 171.3 | 23.5 | -32 | 0 | 0 | 0 | 106.3 | R34 | P32-R34 PolarHBondContact O-N 3.46Š|
| 33 | L | 47.7 | Very low | 56.5 | Low | 167 Ų | 167 | 142.7 Ų | 142.7 | 87% | 0.874 | 73% | 0.727 | S | S | * | * | trans | -51.5 | 114.2 | 173.6 | -73.1 | 176.4 | 0 | 0 | 0 | 105.7 | K31 E35 | K31-L33 PolarHBondContact O-N 3.42Å; L33-E35 PolarHBondContact O-N 2.92Å | ||
| 34 | R | 52.6 | Low | 55.3 | Low | 231 Ų | 231 | 139.4 Ų | 139.4 | 87% | 0.872 | 72% | 0.721 | S | S | * | * | trans | -53.4 | 115.1 | 170.9 | -146.7 | -167.3 | -170.5 | -167.2 | 2.9 | 104.6 | P32 V36 | P32-R34 PolarHBondContact O-N 3.46Å; R34-V36 PolarHBondContact O-N 3.43Å | ||
| 35 | E | 49.2 | Very low | 54.3 | Low | 168 Ų | 168 | 144.8 Ų | 144.8 | 79% | 0.785 | 75% | 0.749 | S | S | * | * | trans | -51.3 | 105.8 | 171.9 | -87.8 | 179.9 | 142 | 0 | 0 | 107.1 | L33 F37 | L33-E35 PolarHBondContact O-N 2.92Å; E35-F37 VanDerWaalsContact C-N 3.31Å; E35-F37 PolarHBondContact O-N 2.91Å; E35-F37 VanDerWaalsContact O-N 3.09Å | ||
| 36 | V | 49.7 | Very low | 53.1 | Low | 115 Ų | 115 | 143.6 Ų | 143.6 | 70% | 0.697 | 76% | 0.756 | S | S | * | * | trans | -76.1 | 98.6 | 167.7 | -176.8 | 0 | 0 | 0 | 0 | 104 | R34 H38 | R34-V36 PolarHBondContact O-N 3.43Å; V36-H38 PolarHBondContact O-N 3.19Å | ||
| 37 | F | 41.2 | Very low | 52.2 | Low | 166 Ų | 166 | 142 Ų | 142 | 73% | 0.728 | 76% | 0.756 | S | S | * | * | trans | -50.1 | 110.2 | 162.6 | -93.5 | -96.4 | 0 | 0 | 0 | 107.6 | E35 L39 | E35-F37 VanDerWaalsContact C-N 3.31Å; E35-F37 PolarHBondContact O-N 2.91Å; E35-F37 VanDerWaalsContact O-N 3.09Å; F37-L39 PolarHBondContact O-N 3.02Å | ||
| 38 | H | 50.6 | Low | 51.4 | Low | 183 Ų | 183 | 145.5 Ų | 145.5 | 85% | 0.847 | 76% | 0.76 | S | S | * | * | trans | -69.6 | 77.5 | 163.3 | -74.2 | -86.2 | 0 | 0 | 0 | 107.8 | V36 | V36-H38 PolarHBondContact O-N 3.19Š| ||
| 39 | L | 45.8 | Very low | 50.4 | Low | 139 Ų | 139 | 148.1 Ų | 148.1 | 73% | 0.728 | 77% | 0.774 | S | S | * | * | trans | -72.6 | 134 | 156.4 | -74.4 | 166.6 | 0 | 0 | 0 | 106.8 | F37 F41 | F37-L39 PolarHBondContact O-N 3.02Å; L39-F41 VanDerWaalsContact C-N 3.32Å; L39-F41 PolarHBondContact O-N 3.04Å | ||
| 40 | P | 48.5 | Very low | 50 | Low | 124 Ų | 124 | 144.6 Ų | 144.6 | 81% | 0.805 | 77% | 0.77 | S | S | * | * | trans | -66.8 | 97.1 | 177.3 | 28.2 | -32.3 | 0 | 0 | 0 | 107.8 | S42 | P40-S42 PolarHBondContact O-N 3.1Š| ||
| 41 | F | 41.3 | Very low | 49.4 | Very low | 191 Ų | 191 | 146.6 Ų | 146.6 | 84% | 0.838 | 77% | 0.774 | S | S | * | * | trans | -68.4 | 94.3 | 165.9 | -155.8 | -95.7 | 0 | 0 | 0 | 106.1 | L39 S43 | L39-F41 VanDerWaalsContact C-N 3.32Å; L39-F41 PolarHBondContact O-N 3.04Å; F41-S43 PolarHBondContact O-N 3.31Å | ||
| 42 | S | 54.3 | Low | 49.5 | Very low | 103 Ų | 103 | 146.4 Ų | 146.4 | 72% | 0.72 | 78% | 0.779 | S | S | * | * | trans | -60.3 | 89 | 162.1 | 178.2 | 0 | 0 | 0 | 0 | 107.3 | P40 S44 | P40-S42 PolarHBondContact O-N 3.1Å; S42-S44 PolarHBondContact O-N 3.21Å | ||
| 43 | S | 41.8 | Very low | 49.6 | Very low | 92 Ų | 92 | 149.5 Ų | 149.5 | 64% | 0.643 | 78% | 0.784 | S | S | * | * | trans | -75.6 | 78.3 | 162.8 | 42 | 0 | 0 | 0 | 0 | 107.6 | F41 L45 | F41-S43 PolarHBondContact O-N 3.31Å; S43-L45 PolarHBondContact O-N 3.14Å; S43-L45 VanDerWaalsContact O-N 3.08Å | ||
| 44 | S | 51.3 | Low | 49.9 | Very low | 89 Ų | 89 | 152.2 Ų | 152.2 | 62% | 0.622 | 78% | 0.784 | S | S | * | * | trans | -61.2 | 102 | 162.2 | -172.8 | 0 | 0 | 0 | 0 | 108.5 | S42 A46 | S42-S44 PolarHBondContact O-N 3.21Å; S44-A46 VanDerWaalsContact C-N 3.29Å | ||
| 45 | L | 51.8 | Low | 50 | Low | 170 Ų | 170 | 144.2 Ų | 144.2 | 89% | 0.89 | 77% | 0.773 | S | S | * | * | trans | -99 | 24.3 | 161.6 | -67 | 177.1 | 0 | 0 | 0 | 110.9 | S43 S47 | S43-L45 PolarHBondContact O-N 3.14Å; S43-L45 VanDerWaalsContact O-N 3.08Å; L45-S47 PolarHBondContact O-N 2.89Å | ||
| 46 | A | 51.4 | Low | 50.2 | Low | 87 Ų | 87 | 147 Ų | 147 | 72% | 0.719 | 78% | 0.778 | S | S | * | * | trans | -93.4 | 71.7 | 172.9 | 0 | 0 | 0 | 0 | 0 | 109.8 | S44 | S44-A46 VanDerWaalsContact C-N 3.29Š| ||
| 47 | S | 53.3 | Low | 50.5 | Low | 106 Ų | 106 | 146.2 Ų | 146.2 | 74% | 0.741 | 78% | 0.776 | S | S | * | * | trans | -166 | 138.5 | 153.8 | -156.3 | 0 | 0 | 0 | 0 | 109.8 | L45 | L45-S47 PolarHBondContact O-N 2.89Š| ||
| 48 | R | 55 | Low | 51.3 | Low | 221 Ų | 221 | 146.6 Ų | 146.6 | 83% | 0.834 | 78% | 0.784 | S | S | * | * | trans | 88.9 | 62.8 | 176.9 | -51.9 | 178.1 | 151.5 | -113.6 | -7.8 | 115.3 | ||||
| 49 | M | 48.5 | Very low | 52.4 | Low | 177 Ų | 177 | 144.1 Ų | 144.1 | 87% | 0.872 | 78% | 0.775 | S | S | * | * | trans | -106.3 | 124.1 | 141.9 | -76.9 | -72.3 | 105.8 | 0 | 0 | 108.1 | L51 | M49-L51 PolarHBondContact O-N 3.39Š| ||
| 50 | P | 53.1 | Low | 53.1 | Low | 115 Ų | 115 | 143.5 Ų | 143.5 | 75% | 0.747 | 78% | 0.779 | S | S | * | * | trans | -60.6 | 129 | 173.2 | -18.4 | 30.3 | 0 | 0 | 0 | 110.3 | L52 | P50-L52 PolarHBondContact O-N 2.93Š| ||
| 51 | L | 47.6 | Very low | 53.7 | Low | 162 Ų | 162 | 143.5 Ų | 143.5 | 85% | 0.848 | 78% | 0.777 | S | S | * | * | trans | -67.6 | 115.8 | 168.3 | -157.6 | -167 | 0 | 0 | 0 | 107.5 | M49 | M49-L51 PolarHBondContact O-N 3.39Š| ||
| 52 | L | 53.7 | Low | 54.3 | Low | 148 Ų | 148 | 140.2 Ų | 140.2 | 78% | 0.775 | 78% | 0.775 | S | S | * | * | trans | -84.6 | 132.1 | 165.2 | -86.3 | 149.8 | 0 | 0 | 0 | 108.8 | P50 Y54 | P50-L52 PolarHBondContact O-N 2.93Å; L52-Y54 PolarHBondContact O-N 2.97Å | ||
| 53 | E | 53.9 | Low | 54.4 | Low | 186 Ų | 186 | 143.1 Ų | 143.1 | 87% | 0.869 | 78% | 0.78 | S | S | * | * | S | Bend | trans | -63 | 10.7 | -176.3 | -171.5 | 164.8 | -178.3 | 0 | 0 | 115.4 | ||
| 54 | Y | 52.3 | Low | 54.7 | Low | 223 Ų | 223 | 146.5 Ų | 146.5 | 88% | 0.875 | 79% | 0.79 | S | S | * | * | S | Bend | trans | -130.7 | 101.9 | 171.4 | -106.6 | -100.2 | 0 | 0 | 0 | 109.5 | L52 | L52-Y54 PolarHBondContact O-N 2.97Š|
| 55 | G | 56.5 | Low | 54.7 | Low | 63 Ų | 63 | 145.8 Ų | 145.8 | 65% | 0.649 | 79% | 0.79 | S | S | * | * | trans | -66.7 | 129.8 | -174.5 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 56 | Y | 53 | Low | 54.4 | Low | 226 Ų | 226 | 143.8 Ų | 143.8 | 89% | 0.886 | 79% | 0.787 | S | S | * | * | trans | -169 | 114.9 | 140.7 | -99.9 | -75.5 | 0 | 0 | 0 | 107.8 | ||||
| 57 | P | 56.3 | Low | 54.2 | Low | 100 Ų | 100 | 147.8 Ų | 147.8 | 65% | 0.649 | 79% | 0.791 | S | S | * | * | trans | -74 | 131.1 | 168.4 | 19.2 | -13.7 | 0 | 0 | 0 | 109.7 | M59 | P57-M59 HydrophobicContact CB-CE 3.45Å; P57-M59 VanDerWaalsContact CB-CE 3.45Å; P57-M59 HydrophobicContact CG-CE 3.47Å; P57-M59 VanDerWaalsContact CG-CE 3.47Å; P57-M59 WeakPolarHBondContact O-CE 3.46Å; P57-M59 PolarHBondContact O-N 2.92Å | ||
| 58 | L | 57.7 | Low | 54.1 | Low | 173 Ų | 173 | 147.9 Ų | 147.9 | 91% | 0.906 | 79% | 0.789 | S | S | * | * | trans | -74.4 | 108.3 | 171.5 | -167.8 | 78.2 | 0 | 0 | 0 | 108.2 | ||||
| 59 | M | 72.4 | Confident | 53.5 | Low | 132 Ų | 132 | 145.1 Ų | 145.1 | 65% | 0.65 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -77.5 | 129 | 171.8 | -33.9 | -81.3 | 101.7 | 0 | 0 | 108.5 | P57 T61 | P57-M59 HydrophobicContact CB-CE 3.45Å; P57-M59 VanDerWaalsContact CB-CE 3.45Å; P57-M59 HydrophobicContact CG-CE 3.47Å; P57-M59 VanDerWaalsContact CG-CE 3.47Å; P57-M59 WeakPolarHBondContact O-CE 3.46Å; P57-M59 PolarHBondContact O-N 2.92Å; M59-T61 PolarHBondContact O-N 3.02Å |
| 60 | P | 61.1 | Low | 53.5 | Low | 125 Ų | 125 | 145.5 Ų | 145.5 | 81% | 0.812 | 78% | 0.784 | S | S | * | * | P | Polyproline II helix | trans | -73.6 | 125.5 | 162.5 | -7.5 | 24 | 0 | 0 | 0 | 109.1 | ||
| 61 | T | 61.4 | Low | 53.6 | Low | 124 Ų | 124 | 148.1 Ų | 148.1 | 76% | 0.761 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -65.8 | 129.7 | 175.9 | 38.1 | 0 | 0 | 0 | 0 | 111.7 | M59 | M59-T61 PolarHBondContact O-N 3.02Š|
| 62 | P | 53.9 | Low | 53.8 | Low | 123 Ų | 123 | 148.4 Ų | 148.4 | 80% | 0.799 | 79% | 0.787 | S | S | * | * | P | Polyproline II helix | trans | -85.7 | 122.2 | 166.4 | 31.4 | -29.1 | 0 | 0 | 0 | 109.8 | ||
| 63 | I | 56.5 | Low | 53.6 | Low | 163 Ų | 163 | 149 Ų | 149 | 84% | 0.836 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -102 | 120.6 | 165.5 | -56.2 | -179 | 0 | 0 | 0 | 109.4 | ||
| 64 | L | 47.6 | Very low | 53.2 | Low | 164 Ų | 164 | 149.1 Ų | 149.1 | 86% | 0.859 | 78% | 0.783 | S | S | * | * | trans | -40.9 | 128.2 | 169.5 | -117 | 59.5 | 0 | 0 | 0 | 114.9 | ||||
| 65 | A | 52 | Low | 53 | Low | 74 Ų | 74 | 143.3 Ų | 143.3 | 61% | 0.612 | 77% | 0.773 | S | S | * | * | 161.6 | 129.3 | 109.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | |||||
| 66 | P | 46 | Very low | 52.3 | Low | 128 Ų | 128 | 147.4 Ų | 147.4 | 83% | 0.831 | 78% | 0.78 | S | S | * | * | P | Polyproline II helix | trans | -86.4 | 127.1 | 178.1 | 33.5 | -29.3 | 0 | 0 | 0 | 111.1 | ||
| 67 | H | 46.6 | Very low | 52.1 | Low | 171 Ų | 171 | 143.9 Ų | 143.9 | 79% | 0.792 | 77% | 0.772 | S | S | * | * | P | Polyproline II helix | trans | -87 | 134.7 | 169.7 | -72.3 | 74.6 | 0 | 0 | 0 | 109.7 | ||
| 68 | P | 51.3 | Low | 52 | Low | 108 Ų | 108 | 146.1 Ų | 146.1 | 70% | 0.701 | 77% | 0.773 | S | S | * | * | P | Polyproline II helix | trans | -72.4 | 142.5 | -174.1 | 29.3 | -33.2 | 0 | 0 | 0 | 112 | H70 | P68-H70 PolarHBondContact O-N 2.71Š|
| 69 | H | 42.9 | Very low | 51.4 | Low | 163 Ų | 163 | 145.7 Ų | 145.7 | 76% | 0.755 | 77% | 0.766 | S | S | * | * | P | Polyproline II helix | trans | -61.3 | 118.7 | 178.5 | -70.6 | -97.2 | 0 | 0 | 0 | 112.1 | ||
| 70 | H | 48.7 | Very low | 50.2 | Low | 184 Ų | 184 | 149.3 Ų | 149.3 | 85% | 0.852 | 77% | 0.774 | S | S | * | * | trans | -90.5 | 109.8 | 154.8 | -74.9 | -76.1 | 0 | 0 | 0 | 109 | P68 L72 | P68-H70 PolarHBondContact O-N 2.71Å; H70-L72 PolarHBondContact O-N 3.39Å | ||
| 71 | H | 53.4 | Low | 49.6 | Very low | 171 Ų | 171 | 152.2 Ų | 152.2 | 79% | 0.792 | 77% | 0.774 | S | S | * | * | trans | -73 | 103.2 | 169.7 | -59.1 | -95.5 | 0 | 0 | 0 | 109 | ||||
| 72 | L | 52.9 | Low | 48.9 | Very low | 167 Ų | 167 | 154.4 Ų | 154.4 | 87% | 0.874 | 77% | 0.774 | S | S | * | * | trans | -139.6 | 86.4 | 159.6 | -157.2 | 60.3 | 0 | 0 | 0 | 112.3 | H70 | H70-L72 PolarHBondContact O-N 3.39Š| ||
| 73 | H | 49.9 | Very low | 48.2 | Very low | 160 Ų | 160 | 155.4 Ų | 155.4 | 74% | 0.741 | 78% | 0.778 | S | S | * | * | trans | -31.4 | 121 | 154 | -177 | 88.1 | 0 | 0 | 0 | 114.5 | ||||
| 74 | K | 45.1 | Very low | 47.9 | Very low | 189 Ų | 189 | 153.5 Ų | 153.5 | 82% | 0.822 | 78% | 0.779 | S | S | * | * | -170.9 | 114.9 | 127.3 | -101 | 168.8 | -177.9 | -174.8 | 0 | 111.4 | |||||
| 75 | P | 48.6 | Very low | 48.1 | Very low | 102 Ų | 102 | 148.9 Ų | 148.9 | 66% | 0.662 | 77% | 0.771 | S | S | * | * | trans | -77.7 | 122.9 | 166.9 | 30.3 | -29 | 0 | 0 | 0 | 109.3 | H77 | P75-H77 PolarHBondContact O-N 3.35Š| ||
| 76 | D | 41.4 | Very low | 48.3 | Very low | 149 Ų | 149 | 153.6 Ų | 153.6 | 80% | 0.797 | 78% | 0.782 | S | S | * | * | trans | -72 | 129.1 | 171.5 | -161.3 | -112.6 | 0 | 0 | 0 | 109.6 | H78 | D76-H78 PolarHBondContact O-CE1 3.35Å; D76-H78 PolarHBondContact O-N 3.08Å | ||
| 77 | H | 49.3 | Very low | 48.6 | Very low | 152 Ų | 152 | 157 Ų | 157 | 70% | 0.704 | 79% | 0.787 | S | S | * | * | trans | -67.9 | 109.2 | -162.6 | -136.4 | -34.4 | 0 | 0 | 0 | 110.4 | P75 Q79 | P75-H77 PolarHBondContact O-N 3.35Å; H77-Q79 PolarHBondContact O-N 2.87Å | ||
| 78 | H | 53.8 | Low | 49.2 | Very low | 147 Ų | 147 | 156.6 Ų | 156.6 | 68% | 0.681 | 79% | 0.788 | S | S | * | * | trans | -65.4 | 91.2 | 162.5 | -23.4 | -65.9 | 0 | 0 | 0 | 107.3 | D76 Y80 | D76-H78 PolarHBondContact O-CE1 3.35Å; D76-H78 PolarHBondContact O-N 3.08Å; H78-Y80 WeakPolarHBondContact O-CD2 3.13Å; H78-Y80 WeakPolarHBondContact O-CE2 3.4Å; H78-Y80 PolarHBondContact O-N 3.37Å | ||
| 79 | Q | 45.1 | Very low | 49.1 | Very low | 164 Ų | 164 | 157 Ų | 157 | 77% | 0.766 | 79% | 0.79 | S | S | * | * | trans | -67.6 | 102.4 | 171.3 | -83.2 | -172 | -27.4 | 0 | 0 | 108.2 | H77 F81 | H77-Q79 PolarHBondContact O-N 2.87Å; Q79-F81 PolarHBondContact O-N 3.5Å; Q79-F81 VanDerWaalsContact O-N 3.1Å | ||
| 80 | Y | 46.8 | Very low | 49.7 | Very low | 208 Ų | 208 | 152.5 Ų | 152.5 | 82% | 0.816 | 79% | 0.788 | S | S | * | * | trans | -44.2 | 111.1 | 165 | -59.2 | -85.3 | 0 | 0 | 0 | 110.5 | H78 F82 | H78-Y80 WeakPolarHBondContact O-CD2 3.13Å; H78-Y80 WeakPolarHBondContact O-CE2 3.4Å; H78-Y80 PolarHBondContact O-N 3.37Å; Y80-F82 PolarHBondContact O-N 2.96Å | ||
| 81 | F | 48.1 | Very low | 49.7 | Very low | 185 Ų | 185 | 151.2 Ų | 151.2 | 81% | 0.811 | 79% | 0.787 | S | S | * | * | trans | -68.8 | 99.2 | 160.8 | -93.3 | -99.3 | 0 | 0 | 0 | 107.9 | Q79 | Q79-F81 PolarHBondContact O-N 3.5Å; Q79-F81 VanDerWaalsContact O-N 3.1Å | ||
| 82 | F | 47 | Very low | 49.9 | Very low | 171 Ų | 171 | 152.5 Ų | 152.5 | 75% | 0.75 | 79% | 0.79 | S | S | * | * | trans | 48 | 103.1 | 153.4 | -57.3 | -79.8 | 0 | 0 | 0 | 119.4 | Y80 | Y80-F82 PolarHBondContact O-N 2.96Š| ||
| 83 | T | 39.4 | Very low | 49.7 | Very low | 144 Ų | 144 | 152.4 Ų | 152.4 | 88% | 0.883 | 79% | 0.785 | S | S | * | * | trans | -111.1 | 122.1 | 140.4 | 70.6 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 84 | S | 49.1 | Very low | 49.7 | Very low | 123 Ų | 123 | 153.1 Ų | 153.1 | 86% | 0.86 | 79% | 0.789 | S | S | * | * | trans | -90.9 | 128.3 | 167.6 | -75.3 | 0 | 0 | 0 | 0 | 108 | ||||
| 85 | G | 52.7 | Low | 49.9 | Very low | 67 Ų | 67 | 150.9 Ų | 150.9 | 69% | 0.691 | 78% | 0.781 | S | S | * | * | trans | 175.1 | -6 | 174.1 | 0 | 0 | 0 | 0 | 0 | 118 | ||||
| 86 | M | 55.3 | Low | 49.9 | Very low | 173 Ų | 173 | 150.9 Ų | 150.9 | 85% | 0.852 | 78% | 0.781 | S | S | * | * | trans | -127.6 | 105.2 | 174.7 | -62.9 | -102.9 | 73.1 | 0 | 0 | 108.9 | M88 | M86-M88 PolarHBondContact O-N 3.11Š| ||
| 87 | Q | 52.8 | Low | 50.1 | Low | 199 Ų | 199 | 151.9 Ų | 151.9 | 93% | 0.93 | 78% | 0.781 | S | S | * | * | trans | -63.4 | 114.5 | 168.3 | -69.7 | 177.9 | 56.6 | 0 | 0 | 107.9 | ||||
| 88 | M | 59.4 | Low | 50.3 | Low | 162 Ų | 162 | 151.2 Ų | 151.2 | 80% | 0.798 | 78% | 0.782 | S | S | * | * | P | Polyproline II helix | trans | -101.7 | 135.8 | 167.6 | -68.1 | -60.7 | -70.7 | 0 | 0 | 108.9 | M86 | M86-M88 PolarHBondContact O-N 3.11Š|
| 89 | P | 49.8 | Very low | 50.4 | Low | 116 Ų | 116 | 150.5 Ų | 150.5 | 75% | 0.753 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -63.2 | 143.9 | -173.1 | -17 | 29.9 | 0 | 0 | 0 | 112 | L91 | P89-L91 PolarHBondContact O-N 2.9Š|
| 90 | G | 54.4 | Low | 50.9 | Low | 70 Ų | 70 | 146 Ų | 146 | 72% | 0.722 | 79% | 0.787 | S | S | * | * | P | Polyproline II helix | trans | -55.2 | 116.3 | -177.7 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||
| 91 | L | 50.4 | Low | 51.4 | Low | 156 Ų | 156 | 144.8 Ų | 144.8 | 82% | 0.817 | 79% | 0.786 | S | S | * | * | trans | -127.6 | 60.7 | 156 | -69.2 | 175.1 | 0 | 0 | 0 | 107.8 | P89 Q93 | P89-L91 PolarHBondContact O-N 2.9Å; L91-Q93 PolarHBondContact O-N 3.13Å | ||
| 92 | F | 55.9 | Low | 51.9 | Low | 198 Ų | 198 | 144.4 Ų | 144.4 | 87% | 0.868 | 79% | 0.787 | S | S | * | * | trans | -71.3 | 70.4 | 156.1 | -82.8 | -86.2 | 0 | 0 | 0 | 108.1 | H94 | F92-H94 PolarHBondContact O-N 3.4Š| ||
| 93 | Q | 48.8 | Very low | 52.6 | Low | 165 Ų | 165 | 141.9 Ų | 141.9 | 77% | 0.771 | 79% | 0.789 | S | S | * | * | trans | -76 | 107.5 | 156.6 | -163.3 | 96.4 | 34.8 | 0 | 0 | 105.3 | L91 H95 | L91-Q93 PolarHBondContact O-N 3.13Å; Q93-H95 PolarHBondContact O-N 2.82Å | ||
| 94 | H | 51.1 | Low | 53.9 | Low | 176 Ų | 176 | 146.3 Ų | 146.3 | 82% | 0.815 | 79% | 0.789 | S | S | * | * | trans | -57.2 | 102.8 | 166.5 | -81.7 | -95.8 | 0 | 0 | 0 | 108.5 | F92 P96 | F92-H94 PolarHBondContact O-N 3.4Å; H94-P96 VanDerWaalsContact O-CD 3.31Å; H94-P96 WeakPolarHBondContact O-CD 3.44Å | ||
| 95 | H | 48 | Very low | 55 | Low | 142 Ų | 142 | 151.4 Ų | 151.4 | 66% | 0.657 | 79% | 0.79 | S | S | * | * | trans | -92 | 104.4 | 165.8 | -165.1 | -80.9 | 0 | 0 | 0 | 107.4 | Q93 | Q93-H95 PolarHBondContact O-N 2.82Š| ||
| 96 | P | 48.5 | Very low | 56.3 | Low | 102 Ų | 102 | 159.4 Ų | 159.4 | 66% | 0.662 | 80% | 0.799 | S | S | * | * | trans | -67.2 | 153.9 | 160.2 | 33.7 | -30.4 | 0 | 0 | 0 | 106.9 | H94 | H94-P96 VanDerWaalsContact O-CD 3.31Å; H94-P96 WeakPolarHBondContact O-CD 3.44Å | ||
| 97 | E | 47.4 | Very low | 57.4 | Low | 170 Ų | 170 | 160.7 Ų | 160.7 | 79% | 0.794 | 80% | 0.8 | S | S | * | * | trans | 85.8 | 54.2 | 175.5 | -55 | -98.4 | 127.8 | 0 | 0 | 117.9 | ||||
| 98 | L | 53.4 | Low | 59 | Low | 138 Ų | 138 | 155.5 Ų | 155.5 | 72% | 0.723 | 79% | 0.791 | S | S | * | * | trans | -132.6 | 106 | 147.6 | -74.8 | -179.6 | 0 | 0 | 0 | 110.7 | ||||
| 99 | P | 54.5 | Low | 60.6 | Low | 132 Ų | 132 | 159.6 Ų | 159.6 | 86% | 0.857 | 80% | 0.798 | S | S | * | * | trans | -78 | 130.3 | 175.8 | 31 | -29.3 | 0 | 0 | 0 | 109.3 | ||||
| 100 | G | 55.8 | Low | 62.5 | Low | 68 Ų | 68 | 158.9 Ų | 158.9 | 70% | 0.701 | 79% | 0.792 | S | S | * | * | trans | 121.4 | 39.7 | 156 | 0 | 0 | 0 | 0 | 0 | 118.5 | ||||
| 101 | K | 57.1 | Low | 64.5 | Low | 183 Ų | 183 | 162.2 Ų | 162.2 | 80% | 0.796 | 80% | 0.798 | S | S | * | * | trans | -132 | 74.9 | 157.9 | 31.3 | -172 | 171.4 | -168.8 | 0 | 110.5 | C103 | K101-C103 VanDerWaalsContact C-N 3.31Å; K101-C103 PolarHBondContact O-N 3.32Å | ||
| 102 | H | 59.7 | Low | 66.7 | Low | 177 Ų | 177 | 156.8 Ų | 156.8 | 82% | 0.819 | 77% | 0.767 | S | S | * | * | trans | -65.4 | 95.8 | 163.6 | -71.6 | 86.5 | 0 | 0 | 0 | 107.6 | R104 | H102-R104 PolarHBondContact O-N 2.92Š| ||
| 103 | C | 61.7 | Low | 68.8 | Low | 118 Ų | 118 | 150.2 Ų | 150.2 | 80% | 0.797 | 75% | 0.746 | S | S | * | * | trans | -48.5 | 109.1 | 157.2 | -177.8 | 0 | 0 | 0 | 0 | 106.2 | K101 R105 | K101-C103 VanDerWaalsContact C-N 3.31Å; K101-C103 PolarHBondContact O-N 3.32Å; C103-R105 PolarHBondContact O-N 2.97Å | ||
| 104 | R | 65.5 | Low | 71.1 | Confident | 237 Ų | 237 | 148.9 Ų | 148.9 | 89% | 0.894 | 74% | 0.744 | S | S | * | * | trans | -64.4 | 90.1 | 176.9 | -80.2 | -160.1 | -163 | -113.8 | 8.5 | 107 | H102 R106 | H102-R104 PolarHBondContact O-N 2.92Å; R104-R106 PolarHBondContact O-N 2.98Å | ||
| 105 | R | 72.6 | Confident | 73.4 | Confident | 231 Ų | 231 | 144.9 Ų | 144.9 | 87% | 0.872 | 74% | 0.736 | S | S | * | * | trans | -53.4 | 113.7 | 175.6 | -163.8 | 172.9 | 68.3 | -164.4 | 2 | 107 | C103 K107 | C103-R105 PolarHBondContact O-N 2.97Å; R105-K107 PolarHBondContact O-N 3.31Å | ||
| 106 | R | 80.3 | Confident | 75.8 | Confident | 234 Ų | 234 | 140 Ų | 140 | 88% | 0.883 | 71% | 0.713 | S | S | * | * | P | Polyproline II helix | trans | -53.7 | 134.5 | 176.4 | -76.9 | -172.9 | -79.1 | 162.4 | -3.8 | 107.9 | R104 A108 | R104-R106 PolarHBondContact O-N 2.98Å; R106-A108 PolarHBondContact O-N 3.03Å |
| 107 | K | 79.4 | Confident | 78.2 | Confident | 201 Ų | 201 | 138.2 Ų | 138.2 | 87% | 0.874 | 70% | 0.698 | S | S | * | * | P | Polyproline II helix | trans | -59.6 | 135.1 | 174.8 | -113.6 | 81.9 | 100.8 | 176.9 | 0 | 108.1 | R105 | R105-K107 PolarHBondContact O-N 3.31Š|
| 108 | A | 86.5 | Confident | 80.6 | Confident | 90 Ų | 90 | 134 Ų | 134 | 74% | 0.744 | 69% | 0.688 | S | S | * | * | P | Polyproline II helix | trans | -56.2 | 146.7 | 172 | 0 | 0 | 0 | 0 | 0 | 109.5 | R106 | R106-A108 PolarHBondContact O-N 3.03Š|
| 109 | R | 91 | Very high | 82.7 | Confident | 248 Ų | 248 | 128.5 Ų | 128.5 | 94% | 0.936 | 66% | 0.664 | S | S | * | * | P | Polyproline II helix | trans | -67.9 | 136.9 | 175.8 | -68.2 | -177.5 | 178.7 | 178.7 | -0.1 | 108.9 | ||
| 110 | T | 91.1 | Very high | 84.9 | Confident | 101 Ų | 101 | 122.2 Ų | 122.2 | 62% | 0.62 | 62% | 0.623 | S | S | * | * | P | Polyproline II helix | trans | -91.8 | 145.2 | 173.3 | 48.1 | 0 | 0 | 0 | 0 | 109.9 | ||
| 111 | V | 95.4 | Very high | 86.9 | Confident | 140 Ų | 140 | 121.3 Ų | 121.3 | 85% | 0.848 | 60% | 0.601 | S | S | * | * | trans | -114.2 | 136.3 | 173.2 | -174.9 | 0 | 0 | 0 | 0 | 107.2 | ||||
| 112 | F | 98.1 | Very high | 88.9 | Confident | 41 Ų | 41 | 119.4 Ų | 119.4 | 18% | 0.18 | 59% | 0.593 | C | S | . | * | trans | -85 | 146.5 | 176.2 | -58.1 | -51.6 | 0 | 0 | 0 | 110.1 | Q116 L117 L144 Q148 W152 | F112-Q116 HydrophobicContact CB-CB 4.24Å; F112-L117 HydrophobicContact CB-CD2 3.88Å; F112-L117 HydrophobicContact CB-CG 4.02Å; F112-L117 HydrophobicContact CD2-CD2 4.09Å; F112-L117 HydrophobicContact CG-CD2 4.47Å; F112-L144 HydrophobicContact CD1-CD1 4.26Å; F112-L144 HydrophobicContact CD1-CD2 3.76Å; F112-L144 HydrophobicContact CE1-CD1 4.19Å; F112-L144 HydrophobicContact CE1-CD2 3.7Å; F112-Q148 HydrophobicContact CE1-CB 4.16Å; F112-Q148 HydrophobicContact CE1-CG 4.25Å; F112-Q148 HydrophobicContact CZ-CB 3.95Å; F112-Q148 HydrophobicContact CZ-CG 4.22Å; F112-W152 AromaticContact CD2-CD1 3.8Å; F112-W152 HydrophobicContact CE2-CB 4.37Å; F112-W152 AromaticContact CE2-CD1 3.67Å; F112-W152 HydrophobicContact CE2-CG 4.38Å | ||
| 113 | S | 98.4 | Very high | 90.7 | Very high | 60 Ų | 60 | 114.4 Ų | 114.4 | 42% | 0.42 | 57% | 0.566 | S | S | . | * | trans | -69.5 | 160.9 | 172.3 | 62.4 | 0 | 0 | 0 | 0 | 111.7 | S115 Q116 L117 | S113-S115 VanDerWaalsContact C-N 3.3Å; S113-S115 PolarHBondContact O-N 3.43Å; S113-Q116 WeakPolarHBondContact O-CB 3.41Å; S113-Q116 PolarHBondContact O-N 3.15Å; S113-Q116 VanDerWaalsContact O-N 3.11Å; S113-Q116 VanDerWaalsContact OG-CD 3.3Å; S113-Q116 VanDerWaalsContact OG-CG 3.26Å; S113-Q116 WeakPolarHBondContact OG-CG 3.28Å; S113-Q116 PolarHBondContact OG-N 3.43Å; S113-Q116 PolarHBondContact OG-OE1 2.88Å; S113-L117 WeakPolarHBondContact O-CG 3.48Å; S113-L117 PolarHBondContact O-N 3.23Å | ||
| 114 | D | 98.3 | Very high | 92.5 | Very high | 137 Ų | 137 | 109 Ų | 109 | 73% | 0.733 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -61.5 | -38 | -179.5 | -63.4 | -31.4 | 0 | 0 | 0 | 112.6 | Q116 L117 S118 | D114-Q116 VanDerWaalsContact C-N 3.34Å; D114-Q116 PolarHBondContact O-N 2.97Å; D114-L117 PolarHBondContact O-N 2.79Å; D114-S118 WeakPolarHBondContact O-CB 3.29Å; D114-S118 PolarHBondContact O-N 2.62Å |
| 115 | S | 98.3 | Very high | 94.1 | Very high | 93 Ų | 93 | 103.6 Ų | 103.6 | 65% | 0.65 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -60.9 | -42.6 | 174.6 | 176 | 0 | 0 | 0 | 0 | 111.9 | S113 S118 G119 | S113-S115 VanDerWaalsContact C-N 3.3Å; S113-S115 PolarHBondContact O-N 3.43Å; S115-S118 PolarHBondContact O-N 2.86Å; S115-G119 PolarHBondContact O-N 3.16Å |
| 116 | Q | 98.6 | Very high | 95.3 | Very high | 38 Ų | 38 | 98.4 Ų | 98.4 | 18% | 0.178 | 50% | 0.502 | C | S | . | . | H | α-helix | trans | -65.6 | -43.1 | 176 | -72 | 169.2 | -36.6 | 0 | 0 | 111.7 | F112 S113 D114 G119 L120 L142 | F112-Q116 HydrophobicContact CB-CB 4.24Å; S113-Q116 WeakPolarHBondContact O-CB 3.41Å; S113-Q116 PolarHBondContact O-N 3.15Å; S113-Q116 VanDerWaalsContact O-N 3.11Å; S113-Q116 VanDerWaalsContact OG-CD 3.3Å; S113-Q116 VanDerWaalsContact OG-CG 3.26Å; S113-Q116 WeakPolarHBondContact OG-CG 3.28Å; S113-Q116 PolarHBondContact OG-N 3.43Å; S113-Q116 PolarHBondContact OG-OE1 2.88Å; D114-Q116 VanDerWaalsContact C-N 3.34Å; D114-Q116 PolarHBondContact O-N 2.97Å; Q116-G119 PolarHBondContact O-N 3.47Å; Q116-L120 WeakPolarHBondContact O-CB 3.35Å; Q116-L120 WeakPolarHBondContact O-CD1 3.43Å; Q116-L120 VanDerWaalsContact O-CG 3.22Å; Q116-L120 WeakPolarHBondContact O-CG 3.4Å; Q116-L120 PolarHBondContact O-N 3.36Å; Q116-L142 PolarHBondContact NE2-O 3.06Å |
| 117 | L | 98.6 | Very high | 96.1 | Very high | 65 Ų | 65 | 90 Ų | 90 | 34% | 0.34 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -62.6 | -43.6 | 177.3 | -68.5 | 175.2 | 0 | 0 | 0 | 111.7 | F112 S113 D114 L120 E121 | F112-L117 HydrophobicContact CB-CD2 3.88Å; F112-L117 HydrophobicContact CB-CG 4.02Å; F112-L117 HydrophobicContact CD2-CD2 4.09Å; F112-L117 HydrophobicContact CG-CD2 4.47Å; S113-L117 WeakPolarHBondContact O-CG 3.48Å; S113-L117 PolarHBondContact O-N 3.23Å; D114-L117 PolarHBondContact O-N 2.79Å; L117-L120 PolarHBondContact O-N 3.26Å; L117-E121 WeakPolarHBondContact O-CB 3.42Å; L117-E121 PolarHBondContact O-N 2.97Å |
| 118 | S | 98.6 | Very high | 97 | Very high | 82 Ų | 82 | 85.6 Ų | 85.6 | 57% | 0.573 | 45% | 0.451 | S | S | * | . | H | α-helix | trans | -60.9 | -46 | 176.7 | -178.4 | 0 | 0 | 0 | 0 | 111.7 | D114 S115 L120 E121 K122 | D114-S118 WeakPolarHBondContact O-CB 3.29Å; D114-S118 PolarHBondContact O-N 2.62Å; S115-S118 PolarHBondContact O-N 2.86Å; S118-L120 PolarHBondContact O-N 3.36Å; S118-E121 PolarHBondContact O-N 3.43Å; S118-K122 WeakPolarHBondContact O-CB 3.44Å; S118-K122 PolarHBondContact O-N 3.26Å |
| 119 | G | 98.5 | Very high | 97.6 | Very high | 22 Ų | 22 | 88.7 Ų | 88.7 | 23% | 0.227 | 45% | 0.445 | C | S | . | . | H | α-helix | trans | -62.6 | -40.8 | 176.6 | 0 | 0 | 0 | 0 | 0 | 113.5 | S115 Q116 R123 | S115-G119 PolarHBondContact O-N 3.16Å; Q116-G119 PolarHBondContact O-N 3.47Å; G119-R123 PolarHBondContact O-N 3.17Å |
| 120 | L | 98.8 | Very high | 97.9 | Very high | 0 Ų | 0 | 78.1 Ų | 78.1 | 0% | 0 | 41% | 0.406 | C | S | . | . | H | α-helix | trans | -64.6 | -43.2 | 175.7 | -71.9 | 165.8 | 0 | 0 | 0 | 111.8 | Q116 L117 S118 F124 L138 L142 L144 V149 W152 F153 | Q116-L120 WeakPolarHBondContact O-CB 3.35Å; Q116-L120 WeakPolarHBondContact O-CD1 3.43Å; Q116-L120 VanDerWaalsContact O-CG 3.22Å; Q116-L120 WeakPolarHBondContact O-CG 3.4Å; Q116-L120 PolarHBondContact O-N 3.36Å; L117-L120 PolarHBondContact O-N 3.26Å; S118-L120 PolarHBondContact O-N 3.36Å; L120-F124 WeakPolarHBondContact O-CB 3.35Å; L120-F124 PolarHBondContact O-N 2.96Å; L120-L138 HydrophobicContact CD2-CD2 4.02Å; L120-L142 HydrophobicContact CD2-CD1 3.85Å; L120-L142 HydrophobicContact CG-CD1 3.69Å; L120-L144 HydrophobicContact CD1-CD1 4.09Å; L120-V149 HydrophobicContact CD2-CG1 4.31Å; L120-V149 HydrophobicContact CD2-CG2 4.43Å; L120-W152 HydrophobicContact CB-CD2 3.92Å; L120-W152 HydrophobicContact CB-CE3 3.84Å; L120-W152 HydrophobicContact CB-CH2 3.65Å; L120-W152 HydrophobicContact CB-CZ2 3.69Å; L120-W152 HydrophobicContact CB-CZ3 3.72Å; L120-W152 HydrophobicContact CD1-CB 4.42Å; L120-W152 HydrophobicContact CD1-CD2 3.78Å; L120-W152 HydrophobicContact CD1-CE3 4.39Å; L120-W152 HydrophobicContact CD1-CG 3.76Å; L120-W152 HydrophobicContact CD2-CD2 4.38Å; L120-W152 HydrophobicContact CD2-CE3 4.22Å; L120-W152 HydrophobicContact CG-CD2 4.24Å; L120-W152 HydrophobicContact CG-CE3 4.37Å; L120-F153 HydrophobicContact CD2-CE2 4Å |
| 121 | E | 98.7 | Very high | 98.3 | Very high | 50 Ų | 50 | 75.8 Ų | 75.8 | 23% | 0.234 | 39% | 0.394 | C | S | . | . | H | α-helix | trans | -66.8 | -46 | 179.2 | -164.2 | 66.3 | -143.8 | 0 | 0 | 111.4 | L117 S118 R123 F124 E125 W152 R156 | L117-E121 WeakPolarHBondContact O-CB 3.42Å; L117-E121 PolarHBondContact O-N 2.97Å; S118-E121 PolarHBondContact O-N 3.43Å; E121-R123 VanDerWaalsContact C-N 3.31Å; E121-R123 PolarHBondContact O-N 2.68Å; E121-F124 WeakPolarHBondContact O-CA 3.49Å; E121-F124 WeakPolarHBondContact O-CB 3.36Å; E121-F124 PolarHBondContact O-N 2.91Å; E121-E125 WeakPolarHBondContact O-CG 3.46Å; E121-E125 PolarHBondContact O-N 2.81Å; E121-W152 HydrophobicContact CB-CH2 4.43Å; E121-W152 WeakPolarHBondContact OE2-CH2 3.36Å; E121-R156 VanDerWaalsContact CD-NE 3.29Å; E121-R156 IonicContact OE1-CZ 3.85Å; E121-R156 IonicContact OE1-NE 2.91Å; E121-R156 PolarHBondContact OE1-NE 2.86Å; E121-R156 IonicContact OE1-NH2 3.97Å; E121-R156 PolarHBondContact OE1-NH2 3.32Å; E121-R156 WeakPolarHBondContact OE2-CD 3.47Å; E121-R156 IonicContact OE2-CZ 2.97Å; E121-R156 IonicContact OE2-NE 2.68Å; E121-R156 PolarHBondContact OE2-NE 3.07Å; E121-R156 IonicContact OE2-NH2 3.17Å |
| 122 | K | 98.6 | Very high | 98.4 | Very high | 143 Ų | 143 | 73.3 Ų | 73.3 | 62% | 0.622 | 38% | 0.38 | S | S | * | . | H | α-helix | trans | -55.2 | -45.5 | 176.3 | -177 | 178 | -178.1 | 178.2 | 0 | 112 | S118 F124 | S118-K122 WeakPolarHBondContact O-CB 3.44Å; S118-K122 PolarHBondContact O-N 3.26Å; K122-F124 VanDerWaalsContact C-N 3.33Å |
| 123 | R | 98.5 | Very high | 98.5 | Very high | 71 Ų | 71 | 75.6 Ų | 75.6 | 27% | 0.268 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -68.5 | -34.4 | 176.8 | -173.1 | 62.1 | 178.6 | -157.5 | 3.5 | 111.8 | G119 E121 I126 Q127 L130 E134 L138 F153 | G119-R123 PolarHBondContact O-N 3.17Å; E121-R123 VanDerWaalsContact C-N 3.31Å; E121-R123 PolarHBondContact O-N 2.68Å; R123-I126 PolarHBondContact O-N 2.79Å; R123-Q127 PolarHBondContact O-N 3.37Å; R123-L130 HydrophobicContact CG-CD2 4.09Å; R123-E134 IonicContact NH2-OE1 2.81Å; R123-E134 PolarHBondContact NH2-OE1 3.32Å; R123-L138 HydrophobicContact CB-CD1 4.31Å; R123-L138 HydrophobicContact CB-CD2 4.14Å; R123-L138 HydrophobicContact CG-CD2 4.02Å; R123-F153 HydrophobicContact CB-CZ 4.42Å; R123-F153 HydrophobicContact CG-CZ 4.31Å |
| 124 | F | 98.8 | Very high | 98.5 | Very high | 4 Ų | 4 | 74.6 Ų | 74.6 | 2% | 0.018 | 39% | 0.387 | C | S | . | . | H | α-helix | trans | -66.8 | -36.8 | 179.8 | -176.9 | -96.4 | 0 | 0 | 0 | 113.5 | L120 E121 K122 I126 Q127 R128 W152 F153 R156 R157 H160 | L120-F124 WeakPolarHBondContact O-CB 3.35Å; L120-F124 PolarHBondContact O-N 2.96Å; E121-F124 WeakPolarHBondContact O-CA 3.49Å; E121-F124 WeakPolarHBondContact O-CB 3.36Å; E121-F124 PolarHBondContact O-N 2.91Å; K122-F124 VanDerWaalsContact C-N 3.33Å; F124-I126 VanDerWaalsContact C-N 3.31Å; F124-Q127 CarbonylContact O-C 3.37Å; F124-Q127 PolarHBondContact O-N 3.45Å; F124-R128 HydrophobicContact CE1-CG 4.13Å; F124-R128 HydrophobicContact CE2-CB 4.03Å; F124-R128 HydrophobicContact CE2-CG 4.08Å; F124-R128 HydrophobicContact CZ-CB 4.21Å; F124-R128 HydrophobicContact CZ-CG 3.82Å; F124-W152 HydrophobicContact CB-CH2 4.36Å; F124-W152 HydrophobicContact CB-CZ3 4.1Å; F124-W152 HydrophobicContact CD2-CZ3 4.48Å; F124-W152 HydrophobicContact CG-CZ3 4.43Å; F124-F153 HydrophobicContact CB-CE1 4.22Å; F124-F153 HydrophobicContact CB-CZ 4.32Å; F124-F153 AromaticContact CD2-CD1 3.85Å; F124-F153 HydrophobicContact CD2-CD1 3.85Å; F124-F153 AromaticContact CD2-CE1 3.8Å; F124-F153 HydrophobicContact CD2-CE1 3.8Å; F124-F153 HydrophobicContact CE2-CD1 4.49Å; F124-R156 HydrophobicContact CD1-CG 3.66Å; F124-R156 HydrophobicContact CD2-CB 4.26Å; F124-R156 HydrophobicContact CD2-CG 3.69Å; F124-R156 HydrophobicContact CE1-CG 3.65Å; F124-R156 HydrophobicContact CE2-CB 4.14Å; F124-R156 HydrophobicContact CE2-CG 3.69Å; F124-R156 HydrophobicContact CG-CG 3.68Å; F124-R156 HydrophobicContact CZ-CB 4.43Å; F124-R156 HydrophobicContact CZ-CG 3.67Å; F124-R157 HydrophobicContact CE2-CG 3.72Å; F124-R157 HydrophobicContact CZ-CG 4.11Å; F124-H160 HydrophobicContact CE1-CB 4.43Å; F124-H160 HydrophobicContact CZ-CB 4.32Å |
| 125 | E | 98.4 | Very high | 98.5 | Very high | 124 Ų | 124 | 70.3 Ų | 70.3 | 58% | 0.579 | 36% | 0.361 | S | S | * | . | H | α-helix | trans | -59.2 | -44.9 | 175.7 | -73 | 170.3 | -179.7 | 0 | 0 | 111.3 | E121 R128 | E121-E125 WeakPolarHBondContact O-CG 3.46Å; E121-E125 PolarHBondContact O-N 2.81Å; E125-R128 PolarHBondContact O-NH1 2.9Å |
| 126 | I | 98.2 | Very high | 98.5 | Very high | 122 Ų | 122 | 68.8 Ų | 68.8 | 63% | 0.626 | 35% | 0.348 | S | S | * | . | H | α-helix | trans | -69.5 | -47.7 | 177 | -57.9 | 165 | 0 | 0 | 0 | 110.3 | R123 F124 | R123-I126 PolarHBondContact O-N 2.79Å; F124-I126 VanDerWaalsContact C-N 3.31Å |
| 127 | Q | 98.3 | Very high | 98.5 | Very high | 57 Ų | 57 | 73 Ų | 73 | 27% | 0.266 | 37% | 0.367 | S | S | . | . | trans | -143.1 | 111.8 | -172.2 | -167.4 | 175.7 | -56.6 | 0 | 0 | 112.4 | R123 F124 Y129 L130 E134 F153 | R123-Q127 PolarHBondContact O-N 3.37Å; F124-Q127 CarbonylContact O-C 3.37Å; F124-Q127 PolarHBondContact O-N 3.45Å; Q127-Y129 VanDerWaalsContact C-N 3.3Å; Q127-Y129 VanDerWaalsContact CG-O 3.27Å; Q127-Y129 WeakPolarHBondContact CG-O 3.25Å; Q127-Y129 PolarHBondContact NE2-O 3.41Å; Q127-Y129 PolarHBondContact O-N 3.34Å; Q127-L130 HydrophobicContact CG-CD2 4.48Å; Q127-E134 PolarHBondContact NE2-OE1 3.18Å; Q127-E134 PolarHBondContact NE2-OE2 2.99Å; Q127-E134 PolarHBondContact OE1-OE1 3.24Å; Q127-E134 VanDerWaalsContact OE1-OE1 3.06Å; Q127-F153 WeakPolarHBondContact O-CE1 3.44Å | ||
| 128 | R | 98.1 | Very high | 98.5 | Very high | 110 Ų | 110 | 71 Ų | 71 | 42% | 0.415 | 36% | 0.357 | S | S | . | . | S | Bend | trans | -75.6 | -15.8 | -175 | -69.6 | 167.4 | 166.7 | 76 | -5.1 | 114.1 | F124 E125 R157 H160 | F124-R128 HydrophobicContact CE1-CG 4.13Å; F124-R128 HydrophobicContact CE2-CB 4.03Å; F124-R128 HydrophobicContact CE2-CG 4.08Å; F124-R128 HydrophobicContact CZ-CB 4.21Å; F124-R128 HydrophobicContact CZ-CG 3.82Å; E125-R128 PolarHBondContact O-NH1 2.9Å; R128-R157 WeakPolarHBondContact O-CD 3.38Å; R128-H160 PolarHBondContact NE-CE1 3.09Å |
| 129 | Y | 98.5 | Very high | 98.5 | Very high | 155 Ų | 155 | 67.3 Ų | 67.3 | 61% | 0.608 | 33% | 0.331 | S | S | * | . | S | Bend | trans | -136.3 | 121.2 | -177.5 | -64.6 | -104.2 | 0 | 0 | 0 | 109.6 | Q127 R157 | Q127-Y129 VanDerWaalsContact C-N 3.3Å; Q127-Y129 VanDerWaalsContact CG-O 3.27Å; Q127-Y129 WeakPolarHBondContact CG-O 3.25Å; Q127-Y129 PolarHBondContact NE2-O 3.41Å; Q127-Y129 PolarHBondContact O-N 3.34Å; Y129-R157 VanDerWaalsContact CD1-NH1 3.27Å |
| 130 | L | 98.4 | Very high | 98.5 | Very high | 25 Ų | 25 | 71.2 Ų | 71.2 | 13% | 0.131 | 35% | 0.351 | C | S | . | . | trans | -96.4 | 135.8 | 177.8 | -59.1 | -179.9 | 0 | 0 | 0 | 111 | R123 Q127 E134 R135 L138 V149 F153 | R123-L130 HydrophobicContact CG-CD2 4.09Å; Q127-L130 HydrophobicContact CG-CD2 4.48Å; L130-E134 HydrophobicContact CB-CB 4.4Å; L130-E134 HydrophobicContact CD2-CB 4.3Å; L130-R135 HydrophobicContact CB-CB 4.49Å; L130-L138 HydrophobicContact CD1-CD2 3.72Å; L130-V149 HydrophobicContact CD1-CG1 4.07Å; L130-F153 HydrophobicContact CD1-CD1 4.18Å; L130-F153 HydrophobicContact CD1-CD2 4.02Å; L130-F153 HydrophobicContact CD1-CE1 3.76Å; L130-F153 HydrophobicContact CD1-CE2 3.59Å; L130-F153 HydrophobicContact CD1-CG 4.31Å; L130-F153 HydrophobicContact CD1-CZ 3.46Å; L130-F153 VanDerWaalsContact CD1-CZ 3.46Å; L130-F153 HydrophobicContact CD2-CE1 4.07Å; L130-F153 HydrophobicContact CD2-CZ 4.23Å; L130-F153 HydrophobicContact CG-CD1 3.97Å; L130-F153 HydrophobicContact CG-CE1 3.59Å; L130-F153 HydrophobicContact CG-CE2 4.35Å; L130-F153 HydrophobicContact CG-CZ 3.82Å | ||
| 131 | S | 98.5 | Very high | 98.5 | Very high | 52 Ų | 52 | 74.9 Ų | 74.9 | 36% | 0.364 | 38% | 0.381 | S | S | . | . | trans | -67.7 | 170.4 | 162.9 | 69.9 | 0 | 0 | 0 | 0 | 110.7 | P133 E134 R135 | S131-P133 WeakPolarHBondContact OG-CD 3.42Å; S131-P133 WeakPolarHBondContact OG-CG 3.27Å; S131-E134 VanDerWaalsContact CB-OE2 3.25Å; S131-E134 WeakPolarHBondContact CB-OE2 3.49Å; S131-E134 PolarHBondContact N-OE2 2.82Å; S131-E134 VanDerWaalsContact OG-CD 3.26Å; S131-E134 VanDerWaalsContact OG-CG 3.27Å; S131-E134 WeakPolarHBondContact OG-CG 3.48Å; S131-E134 PolarHBondContact OG-OE2 3.15Å; S131-R135 WeakPolarHBondContact O-CB 3.42Å; S131-R135 PolarHBondContact O-N 3.32Å; S131-R135 VanDerWaalsContact O-N 3.15Å | ||
| 132 | T | 98.4 | Very high | 98.5 | Very high | 88 Ų | 88 | 73.8 Ų | 73.8 | 54% | 0.54 | 38% | 0.377 | S | S | . | . | H | α-helix | trans | -58 | -51.9 | 177.1 | -55.5 | 0 | 0 | 0 | 0 | 113.1 | E134 R135 V136 | T132-E134 PolarHBondContact O-N 2.8Å; T132-R135 WeakPolarHBondContact O-CB 3.43Å; T132-R135 PolarHBondContact O-N 2.9Å; T132-V136 WeakPolarHBondContact O-CG2 3.35Å; T132-V136 PolarHBondContact O-N 3.48Å |
| 133 | P | 98.4 | Very high | 98.5 | Very high | 89 Ų | 89 | 72.1 Ų | 72.1 | 58% | 0.578 | 38% | 0.383 | S | S | * | . | H | α-helix | trans | -62.1 | -42 | -178.5 | 22.9 | -33.7 | 0 | 0 | 0 | 113 | S131 R135 V136 E137 | S131-P133 WeakPolarHBondContact OG-CD 3.42Å; S131-P133 WeakPolarHBondContact OG-CG 3.27Å; P133-R135 VanDerWaalsContact C-N 3.26Å; P133-R135 PolarHBondContact O-N 3.43Å; P133-V136 WeakPolarHBondContact O-CB 3.48Å; P133-V136 PolarHBondContact O-N 3.28Å; P133-V136 VanDerWaalsContact O-N 3.1Å; P133-E137 PolarHBondContact O-N 3.48Å |
| 134 | E | 98.6 | Very high | 98.5 | Very high | 39 Ų | 39 | 69.7 Ų | 69.7 | 18% | 0.182 | 38% | 0.375 | C | S | . | . | H | α-helix | trans | -65.1 | -32.1 | 179.3 | -61.8 | 171.2 | 106.6 | 0 | 0 | 112.6 | R123 Q127 L130 S131 T132 L138 | R123-E134 IonicContact NH2-OE1 2.81Å; R123-E134 PolarHBondContact NH2-OE1 3.32Å; Q127-E134 PolarHBondContact NE2-OE1 3.18Å; Q127-E134 PolarHBondContact NE2-OE2 2.99Å; Q127-E134 PolarHBondContact OE1-OE1 3.24Å; Q127-E134 VanDerWaalsContact OE1-OE1 3.06Å; L130-E134 HydrophobicContact CB-CB 4.4Å; L130-E134 HydrophobicContact CD2-CB 4.3Å; S131-E134 VanDerWaalsContact CB-OE2 3.25Å; S131-E134 WeakPolarHBondContact CB-OE2 3.49Å; S131-E134 PolarHBondContact N-OE2 2.82Å; S131-E134 VanDerWaalsContact OG-CD 3.26Å; S131-E134 VanDerWaalsContact OG-CG 3.27Å; S131-E134 WeakPolarHBondContact OG-CG 3.48Å; S131-E134 PolarHBondContact OG-OE2 3.15Å; T132-E134 PolarHBondContact O-N 2.8Å; E134-L138 WeakPolarHBondContact O-CB 3.38Å; E134-L138 PolarHBondContact O-N 3.15Å |
| 135 | R | 98.8 | Very high | 98.4 | Very high | 48 Ų | 48 | 72.1 Ų | 72.1 | 18% | 0.181 | 39% | 0.392 | C | S | . | . | H | α-helix | trans | -66.3 | -40.9 | 174.3 | -170.4 | -166.9 | -56.1 | 142.7 | 10.4 | 111.4 | L130 S131 T132 P133 E137 A139 E146 V149 | L130-R135 HydrophobicContact CB-CB 4.49Å; S131-R135 WeakPolarHBondContact O-CB 3.42Å; S131-R135 PolarHBondContact O-N 3.32Å; S131-R135 VanDerWaalsContact O-N 3.15Å; T132-R135 WeakPolarHBondContact O-CB 3.43Å; T132-R135 PolarHBondContact O-N 2.9Å; P133-R135 VanDerWaalsContact C-N 3.26Å; P133-R135 PolarHBondContact O-N 3.43Å; R135-E137 VanDerWaalsContact C-N 3.34Å; R135-A139 WeakPolarHBondContact O-CB 3.48Å; R135-A139 PolarHBondContact O-N 3.41Å; R135-E146 WeakPolarHBondContact CD-O 3.46Å; R135-E146 HydrophobicContact CG-CB 4.34Å; R135-E146 HydrophobicContact CG-CG 4.48Å; R135-V149 HydrophobicContact CG-CB 4.05Å; R135-V149 HydrophobicContact CG-CG1 3.87Å |
| 136 | V | 98.8 | Very high | 98.5 | Very high | 61 Ų | 61 | 70 Ų | 70 | 37% | 0.37 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -62.7 | -44.8 | 177.2 | 175.1 | 0 | 0 | 0 | 0 | 110.1 | T132 P133 A139 T140 E146 | T132-V136 WeakPolarHBondContact O-CG2 3.35Å; T132-V136 PolarHBondContact O-N 3.48Å; P133-V136 WeakPolarHBondContact O-CB 3.48Å; P133-V136 PolarHBondContact O-N 3.28Å; P133-V136 VanDerWaalsContact O-N 3.1Å; V136-A139 PolarHBondContact O-N 3.09Å; V136-T140 PolarHBondContact O-N 3.25Å; V136-T140 PolarHBondContact O-OG1 3.35Å; V136-E146 VanDerWaalsContact CG2-CD 3.49Å; V136-E146 HydrophobicContact CG2-CG 4.08Å |
| 137 | E | 98.6 | Very high | 98.4 | Very high | 127 Ų | 127 | 68.9 Ų | 68.9 | 59% | 0.593 | 38% | 0.382 | S | S | * | . | H | α-helix | trans | -59.3 | -51.7 | 177.2 | -172 | -170.7 | 160.3 | 0 | 0 | 111.5 | P133 R135 A139 T140 A141 | P133-E137 PolarHBondContact O-N 3.48Å; R135-E137 VanDerWaalsContact C-N 3.34Å; E137-A139 VanDerWaalsContact C-N 3.35Å; E137-A139 PolarHBondContact O-N 3.44Å; E137-T140 PolarHBondContact O-N 3.22Å; E137-A141 PolarHBondContact O-N 3.24Å |
| 138 | L | 98.6 | Very high | 98.4 | Very high | 22 Ų | 22 | 68.9 Ų | 68.9 | 12% | 0.115 | 38% | 0.381 | C | S | . | . | H | α-helix | trans | -65.2 | -38.2 | -179.6 | -173.8 | 62.8 | 0 | 0 | 0 | 112.6 | L120 R123 L130 E134 T140 A141 L142 V149 F153 | L120-L138 HydrophobicContact CD2-CD2 4.02Å; R123-L138 HydrophobicContact CB-CD1 4.31Å; R123-L138 HydrophobicContact CB-CD2 4.14Å; R123-L138 HydrophobicContact CG-CD2 4.02Å; L130-L138 HydrophobicContact CD1-CD2 3.72Å; E134-L138 WeakPolarHBondContact O-CB 3.38Å; E134-L138 PolarHBondContact O-N 3.15Å; L138-T140 VanDerWaalsContact C-N 3.31Å; L138-T140 PolarHBondContact O-N 3.37Å; L138-A141 PolarHBondContact O-N 3.07Å; L138-L142 HydrophobicContact CD1-CD1 3.73Å; L138-L142 HydrophobicContact CD1-CG 4.08Å; L138-L142 HydrophobicContact CG-CD1 4.06Å; L138-L142 PolarHBondContact O-N 3.1Å; L138-V149 HydrophobicContact CD2-CG1 3.91Å; L138-V149 HydrophobicContact CG-CG1 4.48Å; L138-F153 HydrophobicContact CD2-CE2 3.67Å; L138-F153 HydrophobicContact CD2-CZ 4Å |
| 139 | A | 98.7 | Very high | 98.5 | Very high | 5 Ų | 5 | 63.6 Ų | 63.6 | 4% | 0.041 | 36% | 0.362 | C | S | . | . | H | α-helix | trans | -59.7 | -44.6 | 175.4 | 0 | 0 | 0 | 0 | 0 | 111 | R135 V136 E137 S143 L144 E146 V149 | R135-A139 WeakPolarHBondContact O-CB 3.48Å; R135-A139 PolarHBondContact O-N 3.41Å; V136-A139 PolarHBondContact O-N 3.09Å; E137-A139 VanDerWaalsContact C-N 3.35Å; E137-A139 PolarHBondContact O-N 3.44Å; A139-S143 PolarHBondContact O-N 3.25Å; A139-L144 CarbonylContact C-O 3.49Å; A139-L144 WeakPolarHBondContact CB-O 3.27Å; A139-L144 PolarHBondContact O-N 3.48Å; A139-L144 VanDerWaalsContact O-O 3.12Å; A139-E146 HydrophobicContact CB-CG 4.24Å; A139-V149 HydrophobicContact CB-CG2 3.96Å |
| 140 | T | 98.6 | Very high | 98.5 | Very high | 103 Ų | 103 | 61.6 Ų | 61.6 | 63% | 0.632 | 36% | 0.356 | S | S | * | . | H | α-helix | trans | -64.6 | -47.8 | 177.2 | -53.1 | 0 | 0 | 0 | 0 | 111 | V136 E137 L138 L142 S143 | V136-T140 PolarHBondContact O-N 3.25Å; V136-T140 PolarHBondContact O-OG1 3.35Å; E137-T140 PolarHBondContact O-N 3.22Å; L138-T140 VanDerWaalsContact C-N 3.31Å; L138-T140 PolarHBondContact O-N 3.37Å; T140-L142 VanDerWaalsContact C-N 3.3Å; T140-L142 PolarHBondContact O-N 3.01Å; T140-S143 PolarHBondContact O-N 3.48Å |
| 141 | A | 98.4 | Very high | 98.5 | Very high | 77 Ų | 77 | 63.9 Ų | 63.9 | 64% | 0.636 | 37% | 0.371 | S | S | * | . | H | α-helix | trans | -60.4 | -35.8 | -179.1 | 0 | 0 | 0 | 0 | 0 | 113.4 | E137 L138 | E137-A141 PolarHBondContact O-N 3.24Å; L138-A141 PolarHBondContact O-N 3.07Å |
| 142 | L | 98.3 | Very high | 98.5 | Very high | 28 Ų | 28 | 63 Ų | 63 | 15% | 0.147 | 36% | 0.36 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -100.1 | 4.5 | -177.4 | -59.3 | -179 | 0 | 0 | 0 | 114 | Q116 L120 L138 T140 L144 | Q116-L142 PolarHBondContact NE2-O 3.06Å; L120-L142 HydrophobicContact CD2-CD1 3.85Å; L120-L142 HydrophobicContact CG-CD1 3.69Å; L138-L142 HydrophobicContact CD1-CD1 3.73Å; L138-L142 HydrophobicContact CD1-CG 4.08Å; L138-L142 HydrophobicContact CG-CD1 4.06Å; L138-L142 PolarHBondContact O-N 3.1Å; T140-L142 VanDerWaalsContact C-N 3.3Å; T140-L142 PolarHBondContact O-N 3.01Å; L142-L144 VanDerWaalsContact C-N 3.3Å; L142-L144 HydrophobicContact CB-CD1 4.2Å; L142-L144 HydrophobicContact CB-CG 4.2Å; L142-L144 PolarHBondContact O-N 2.82Å |
| 143 | S | 98.4 | Very high | 98.5 | Very high | 107 Ų | 107 | 59.2 Ų | 59.2 | 75% | 0.748 | 34% | 0.336 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 52.6 | 45.8 | -174.9 | -59.9 | 0 | 0 | 0 | 0 | 113 | A139 T140 | A139-S143 PolarHBondContact O-N 3.25Å; T140-S143 PolarHBondContact O-N 3.48Å |
| 144 | L | 98.1 | Very high | 98.5 | Very high | 21 Ų | 21 | 59.1 Ų | 59.1 | 11% | 0.11 | 33% | 0.328 | C | S | . | . | trans | -117.3 | 162 | 176.9 | -65.7 | 179.4 | 0 | 0 | 0 | 110.3 | F112 L120 A139 L142 Q148 V149 | F112-L144 HydrophobicContact CD1-CD1 4.26Å; F112-L144 HydrophobicContact CD1-CD2 3.76Å; F112-L144 HydrophobicContact CE1-CD1 4.19Å; F112-L144 HydrophobicContact CE1-CD2 3.7Å; L120-L144 HydrophobicContact CD1-CD1 4.09Å; A139-L144 CarbonylContact C-O 3.49Å; A139-L144 WeakPolarHBondContact CB-O 3.27Å; A139-L144 PolarHBondContact O-N 3.48Å; A139-L144 VanDerWaalsContact O-O 3.12Å; L142-L144 VanDerWaalsContact C-N 3.3Å; L142-L144 HydrophobicContact CB-CD1 4.2Å; L142-L144 HydrophobicContact CB-CG 4.2Å; L142-L144 PolarHBondContact O-N 2.82Å; L144-Q148 HydrophobicContact CB-CB 4.49Å; L144-V149 HydrophobicContact CB-CG2 4.13Å; L144-V149 HydrophobicContact CD1-CG2 4.44Å | ||
| 145 | S | 98.4 | Very high | 98.5 | Very high | 54 Ų | 54 | 62 Ų | 62 | 38% | 0.378 | 34% | 0.344 | S | S | . | . | trans | -78.9 | 150.3 | 167.7 | 65.3 | 0 | 0 | 0 | 0 | 111.3 | T147 Q148 V149 | S145-T147 PolarHBondContact O-N 3.2Å; S145-T147 VanDerWaalsContact O-N 3.13Å; S145-Q148 WeakPolarHBondContact O-CB 3.33Å; S145-Q148 PolarHBondContact O-N 3.26Å; S145-Q148 VanDerWaalsContact OG-CG 3.28Å; S145-Q148 WeakPolarHBondContact OG-CG 3.48Å; S145-Q148 PolarHBondContact OG-N 3.27Å; S145-Q148 PolarHBondContact OG-OE1 3.35Å; S145-V149 PolarHBondContact O-N 3.12Å; S145-V149 VanDerWaalsContact O-N 3.08Å | ||
| 146 | E | 98.5 | Very high | 98.5 | Very high | 81 Ų | 81 | 61.5 Ų | 61.5 | 38% | 0.379 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -52.3 | -37.5 | 173 | -72.3 | -178.2 | -111.2 | 0 | 0 | 112.5 | R135 V136 A139 Q148 V149 K150 | R135-E146 WeakPolarHBondContact CD-O 3.46Å; R135-E146 HydrophobicContact CG-CB 4.34Å; R135-E146 HydrophobicContact CG-CG 4.48Å; V136-E146 VanDerWaalsContact CG2-CD 3.49Å; V136-E146 HydrophobicContact CG2-CG 4.08Å; A139-E146 HydrophobicContact CB-CG 4.24Å; E146-Q148 VanDerWaalsContact C-N 3.35Å; E146-Q148 PolarHBondContact O-N 3.48Å; E146-V149 PolarHBondContact O-N 3.07Å; E146-K150 VanDerWaalsContact O-CB 3.29Å; E146-K150 WeakPolarHBondContact O-CB 3.33Å; E146-K150 PolarHBondContact O-N 3.07Å |
| 147 | T | 98.1 | Very high | 98.5 | Very high | 98 Ų | 98 | 61.5 Ų | 61.5 | 60% | 0.601 | 34% | 0.336 | S | S | * | . | H | α-helix | trans | -64.6 | -41 | 178.4 | -62.5 | 0 | 0 | 0 | 0 | 111.2 | S145 K150 T151 | S145-T147 PolarHBondContact O-N 3.2Å; S145-T147 VanDerWaalsContact O-N 3.13Å; T147-K150 PolarHBondContact O-N 3.11Å; T147-T151 WeakPolarHBondContact O-CB 3.47Å; T147-T151 PolarHBondContact O-N 3.25Å; T147-T151 PolarHBondContact O-OG1 3.29Å; T147-T151 VanDerWaalsContact O-OG1 3.11Å |
| 148 | Q | 98.3 | Very high | 98.5 | Very high | 56 Ų | 56 | 60 Ų | 60 | 26% | 0.262 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -63 | -45.4 | 175.5 | -75.9 | 164.5 | -59.4 | 0 | 0 | 111.4 | F112 L144 S145 E146 T151 W152 | F112-Q148 HydrophobicContact CE1-CB 4.16Å; F112-Q148 HydrophobicContact CE1-CG 4.25Å; F112-Q148 HydrophobicContact CZ-CB 3.95Å; F112-Q148 HydrophobicContact CZ-CG 4.22Å; L144-Q148 HydrophobicContact CB-CB 4.49Å; S145-Q148 WeakPolarHBondContact O-CB 3.33Å; S145-Q148 PolarHBondContact O-N 3.26Å; S145-Q148 VanDerWaalsContact OG-CG 3.28Å; S145-Q148 WeakPolarHBondContact OG-CG 3.48Å; S145-Q148 PolarHBondContact OG-N 3.27Å; S145-Q148 PolarHBondContact OG-OE1 3.35Å; E146-Q148 VanDerWaalsContact C-N 3.35Å; E146-Q148 PolarHBondContact O-N 3.48Å; Q148-T151 PolarHBondContact O-N 3.18Å; Q148-W152 WeakPolarHBondContact O-CB 3.5Å; Q148-W152 PolarHBondContact O-N 2.94Å |
| 149 | V | 98.6 | Very high | 98.4 | Very high | 0 Ų | 0 | 65 Ų | 65 | 0% | 0 | 35% | 0.351 | C | S | . | . | H | α-helix | trans | -60.8 | -47.3 | 176.3 | 178.7 | 0 | 0 | 0 | 0 | 110.5 | L120 L130 R135 L138 A139 L144 S145 E146 T151 W152 F153 | L120-V149 HydrophobicContact CD2-CG1 4.31Å; L120-V149 HydrophobicContact CD2-CG2 4.43Å; L130-V149 HydrophobicContact CD1-CG1 4.07Å; R135-V149 HydrophobicContact CG-CB 4.05Å; R135-V149 HydrophobicContact CG-CG1 3.87Å; L138-V149 HydrophobicContact CD2-CG1 3.91Å; L138-V149 HydrophobicContact CG-CG1 4.48Å; A139-V149 HydrophobicContact CB-CG2 3.96Å; L144-V149 HydrophobicContact CB-CG2 4.13Å; L144-V149 HydrophobicContact CD1-CG2 4.44Å; S145-V149 PolarHBondContact O-N 3.12Å; S145-V149 VanDerWaalsContact O-N 3.08Å; E146-V149 PolarHBondContact O-N 3.07Å; V149-T151 PolarHBondContact O-N 3.46Å; V149-W152 PolarHBondContact O-N 3.25Å; V149-F153 HydrophobicContact CG1-CD2 3.84Å; V149-F153 HydrophobicContact CG1-CE2 3.99Å; V149-F153 WeakPolarHBondContact O-CD2 3.46Å; V149-F153 PolarHBondContact O-N 3.46Å |
| 150 | K | 98.4 | Very high | 98.3 | Very high | 113 Ų | 113 | 67.5 Ų | 67.5 | 49% | 0.491 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -56.5 | -49.7 | 176.7 | -179.9 | -178.5 | 176.1 | -179.7 | 0 | 111.9 | E146 T147 F153 Q154 | E146-K150 VanDerWaalsContact O-CB 3.29Å; E146-K150 WeakPolarHBondContact O-CB 3.33Å; E146-K150 PolarHBondContact O-N 3.07Å; T147-K150 PolarHBondContact O-N 3.11Å; K150-F153 PolarHBondContact O-N 3.34Å; K150-Q154 WeakPolarHBondContact O-CB 3.19Å; K150-Q154 PolarHBondContact O-N 3.36Å |
| 151 | T | 98.4 | Very high | 98.3 | Very high | 72 Ų | 72 | 68.4 Ų | 68.4 | 44% | 0.442 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -64.4 | -41.2 | 179.6 | -64.9 | 0 | 0 | 0 | 0 | 111.4 | T147 Q148 V149 Q154 N155 | T147-T151 WeakPolarHBondContact O-CB 3.47Å; T147-T151 PolarHBondContact O-N 3.25Å; T147-T151 PolarHBondContact O-OG1 3.29Å; T147-T151 VanDerWaalsContact O-OG1 3.11Å; Q148-T151 PolarHBondContact O-N 3.18Å; V149-T151 PolarHBondContact O-N 3.46Å; T151-Q154 WeakPolarHBondContact O-CB 3.35Å; T151-Q154 PolarHBondContact O-N 2.91Å; T151-N155 WeakPolarHBondContact O-CB 3.4Å; T151-N155 VanDerWaalsContact O-CG 3.23Å; T151-N155 PolarHBondContact O-N 3.34Å; T151-N155 PolarHBondContact O-ND2 3.36Å |
| 152 | W | 98.5 | Very high | 98.1 | Very high | 33 Ų | 33 | 72.6 Ų | 72.6 | 13% | 0.125 | 36% | 0.36 | C | S | . | . | H | α-helix | trans | -62.8 | -47.7 | 177 | -170.6 | 99.3 | 0 | 0 | 0 | 111.4 | F112 L120 E121 F124 Q148 V149 Q154 N155 R156 | F112-W152 AromaticContact CD2-CD1 3.8Å; F112-W152 HydrophobicContact CE2-CB 4.37Å; F112-W152 AromaticContact CE2-CD1 3.67Å; F112-W152 HydrophobicContact CE2-CG 4.38Å; L120-W152 HydrophobicContact CB-CD2 3.92Å; L120-W152 HydrophobicContact CB-CE3 3.84Å; L120-W152 HydrophobicContact CB-CH2 3.65Å; L120-W152 HydrophobicContact CB-CZ2 3.69Å; L120-W152 HydrophobicContact CB-CZ3 3.72Å; L120-W152 HydrophobicContact CD1-CB 4.42Å; L120-W152 HydrophobicContact CD1-CD2 3.78Å; L120-W152 HydrophobicContact CD1-CE3 4.39Å; L120-W152 HydrophobicContact CD1-CG 3.76Å; L120-W152 HydrophobicContact CD2-CD2 4.38Å; L120-W152 HydrophobicContact CD2-CE3 4.22Å; L120-W152 HydrophobicContact CG-CD2 4.24Å; L120-W152 HydrophobicContact CG-CE3 4.37Å; E121-W152 HydrophobicContact CB-CH2 4.43Å; E121-W152 WeakPolarHBondContact OE2-CH2 3.36Å; F124-W152 HydrophobicContact CB-CH2 4.36Å; F124-W152 HydrophobicContact CB-CZ3 4.1Å; F124-W152 HydrophobicContact CD2-CZ3 4.48Å; F124-W152 HydrophobicContact CG-CZ3 4.43Å; Q148-W152 WeakPolarHBondContact O-CB 3.5Å; Q148-W152 PolarHBondContact O-N 2.94Å; V149-W152 PolarHBondContact O-N 3.25Å; W152-Q154 VanDerWaalsContact C-N 3.32Å; W152-Q154 PolarHBondContact O-N 2.97Å; W152-N155 PolarHBondContact O-N 3.19Å; W152-N155 VanDerWaalsContact O-N 3.15Å; W152-R156 HydrophobicContact CD2-CB 4.48Å; W152-R156 HydrophobicContact CE3-CB 3.97Å; W152-R156 HydrophobicContact CH2-CB 4.03Å; W152-R156 HydrophobicContact CH2-CG 3.72Å; W152-R156 HydrophobicContact CZ2-CG 4.45Å; W152-R156 HydrophobicContact CZ3-CB 3.72Å; W152-R156 HydrophobicContact CZ3-CG 3.76Å; W152-R156 WeakPolarHBondContact O-CB 3.48Å; W152-R156 PolarHBondContact O-N 3.35Å |
| 153 | F | 98.8 | Very high | 97.9 | Very high | 9 Ų | 9 | 75.2 Ų | 75.2 | 4% | 0.039 | 37% | 0.372 | C | S | . | . | H | α-helix | trans | -62.8 | -35.9 | 176.8 | -91.6 | -103.7 | 0 | 0 | 0 | 112.7 | L120 R123 F124 Q127 L130 L138 V149 K150 R157 | L120-F153 HydrophobicContact CD2-CE2 4Å; R123-F153 HydrophobicContact CB-CZ 4.42Å; R123-F153 HydrophobicContact CG-CZ 4.31Å; F124-F153 HydrophobicContact CB-CE1 4.22Å; F124-F153 HydrophobicContact CB-CZ 4.32Å; F124-F153 AromaticContact CD2-CD1 3.85Å; F124-F153 HydrophobicContact CD2-CD1 3.85Å; F124-F153 AromaticContact CD2-CE1 3.8Å; F124-F153 HydrophobicContact CD2-CE1 3.8Å; F124-F153 HydrophobicContact CE2-CD1 4.49Å; Q127-F153 WeakPolarHBondContact O-CE1 3.44Å; L130-F153 HydrophobicContact CD1-CD1 4.18Å; L130-F153 HydrophobicContact CD1-CD2 4.02Å; L130-F153 HydrophobicContact CD1-CE1 3.76Å; L130-F153 HydrophobicContact CD1-CE2 3.59Å; L130-F153 HydrophobicContact CD1-CG 4.31Å; L130-F153 HydrophobicContact CD1-CZ 3.46Å; L130-F153 VanDerWaalsContact CD1-CZ 3.46Å; L130-F153 HydrophobicContact CD2-CE1 4.07Å; L130-F153 HydrophobicContact CD2-CZ 4.23Å; L130-F153 HydrophobicContact CG-CD1 3.97Å; L130-F153 HydrophobicContact CG-CE1 3.59Å; L130-F153 HydrophobicContact CG-CE2 4.35Å; L130-F153 HydrophobicContact CG-CZ 3.82Å; L138-F153 HydrophobicContact CD2-CE2 3.67Å; L138-F153 HydrophobicContact CD2-CZ 4Å; V149-F153 HydrophobicContact CG1-CD2 3.84Å; V149-F153 HydrophobicContact CG1-CE2 3.99Å; V149-F153 WeakPolarHBondContact O-CD2 3.46Å; V149-F153 PolarHBondContact O-N 3.46Å; K150-F153 PolarHBondContact O-N 3.34Å; F153-R157 WeakPolarHBondContact O-CG 3.07Å; F153-R157 PolarHBondContact O-N 3.4Å; F153-R157 VanDerWaalsContact O-N 3.09Å; F153-R157 PolarHBondContact O-NE 2.65Å |
| 154 | Q | 98.7 | Very high | 97.6 | Very high | 87 Ų | 87 | 75.2 Ų | 75.2 | 41% | 0.407 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -60.6 | -52.1 | 171.8 | -169.1 | 82.9 | 40.5 | 0 | 0 | 110.7 | K150 T151 W152 R156 R157 M158 | K150-Q154 WeakPolarHBondContact O-CB 3.19Å; K150-Q154 PolarHBondContact O-N 3.36Å; T151-Q154 WeakPolarHBondContact O-CB 3.35Å; T151-Q154 PolarHBondContact O-N 2.91Å; W152-Q154 VanDerWaalsContact C-N 3.32Å; W152-Q154 PolarHBondContact O-N 2.97Å; Q154-R156 VanDerWaalsContact C-N 3.34Å; Q154-R156 PolarHBondContact O-N 3.24Å; Q154-R157 PolarHBondContact O-N 3.21Å; Q154-M158 WeakPolarHBondContact O-CG 2.91Å; Q154-M158 PolarHBondContact O-N 2.5Å; Q154-M158 VanDerWaalsContact O-N 3.15Å |
| 155 | N | 98.4 | Very high | 97.3 | Very high | 100 Ų | 100 | 82.8 Ų | 82.8 | 54% | 0.535 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -63.1 | -41.1 | -179.3 | -68.9 | -18.7 | 0 | 0 | 0 | 111.7 | T151 W152 M158 K159 | T151-N155 WeakPolarHBondContact O-CB 3.4Å; T151-N155 VanDerWaalsContact O-CG 3.23Å; T151-N155 PolarHBondContact O-N 3.34Å; T151-N155 PolarHBondContact O-ND2 3.36Å; W152-N155 PolarHBondContact O-N 3.19Å; W152-N155 VanDerWaalsContact O-N 3.15Å; N155-M158 PolarHBondContact O-N 3.3Å; N155-K159 PolarHBondContact O-N 3.34Å |
| 156 | R | 98.6 | Very high | 96.7 | Very high | 38 Ų | 38 | 87 Ų | 87 | 14% | 0.143 | 40% | 0.402 | C | S | . | . | H | α-helix | trans | -63.1 | -44 | 179.8 | -175.1 | 64.6 | -171.3 | 99.6 | -4.1 | 112 | E121 F124 W152 Q154 M158 K159 H160 | E121-R156 VanDerWaalsContact CD-NE 3.29Å; E121-R156 IonicContact OE1-CZ 3.85Å; E121-R156 IonicContact OE1-NE 2.91Å; E121-R156 PolarHBondContact OE1-NE 2.86Å; E121-R156 IonicContact OE1-NH2 3.97Å; E121-R156 PolarHBondContact OE1-NH2 3.32Å; E121-R156 WeakPolarHBondContact OE2-CD 3.47Å; E121-R156 IonicContact OE2-CZ 2.97Å; E121-R156 IonicContact OE2-NE 2.68Å; E121-R156 PolarHBondContact OE2-NE 3.07Å; E121-R156 IonicContact OE2-NH2 3.17Å; F124-R156 HydrophobicContact CD1-CG 3.66Å; F124-R156 HydrophobicContact CD2-CB 4.26Å; F124-R156 HydrophobicContact CD2-CG 3.69Å; F124-R156 HydrophobicContact CE1-CG 3.65Å; F124-R156 HydrophobicContact CE2-CB 4.14Å; F124-R156 HydrophobicContact CE2-CG 3.69Å; F124-R156 HydrophobicContact CG-CG 3.68Å; F124-R156 HydrophobicContact CZ-CB 4.43Å; F124-R156 HydrophobicContact CZ-CG 3.67Å; W152-R156 HydrophobicContact CD2-CB 4.48Å; W152-R156 HydrophobicContact CE3-CB 3.97Å; W152-R156 HydrophobicContact CH2-CB 4.03Å; W152-R156 HydrophobicContact CH2-CG 3.72Å; W152-R156 HydrophobicContact CZ2-CG 4.45Å; W152-R156 HydrophobicContact CZ3-CB 3.72Å; W152-R156 HydrophobicContact CZ3-CG 3.76Å; W152-R156 WeakPolarHBondContact O-CB 3.48Å; W152-R156 PolarHBondContact O-N 3.35Å; Q154-R156 VanDerWaalsContact C-N 3.34Å; Q154-R156 PolarHBondContact O-N 3.24Å; R156-M158 PolarHBondContact O-N 3.38Å; R156-K159 PolarHBondContact O-N 3.44Å; R156-H160 WeakPolarHBondContact O-CB 3.34Å; R156-H160 PolarHBondContact O-N 2.93Å |
| 157 | R | 98.6 | Very high | 95.9 | Very high | 60 Ų | 60 | 86.9 Ų | 86.9 | 23% | 0.226 | 41% | 0.407 | C | S | . | . | H | α-helix | trans | -60.6 | -42.2 | 173.5 | -74.4 | -178.2 | -70.8 | 154.8 | -0.5 | 112.2 | F124 R128 Y129 F153 Q154 K159 H160 K161 | F124-R157 HydrophobicContact CE2-CG 3.72Å; F124-R157 HydrophobicContact CZ-CG 4.11Å; R128-R157 WeakPolarHBondContact O-CD 3.38Å; Y129-R157 VanDerWaalsContact CD1-NH1 3.27Å; F153-R157 WeakPolarHBondContact O-CG 3.07Å; F153-R157 PolarHBondContact O-N 3.4Å; F153-R157 VanDerWaalsContact O-N 3.09Å; F153-R157 PolarHBondContact O-NE 2.65Å; Q154-R157 PolarHBondContact O-N 3.21Å; R157-K159 VanDerWaalsContact C-N 3.34Å; R157-K159 PolarHBondContact O-N 3.44Å; R157-H160 PolarHBondContact O-N 2.8Å; R157-K161 WeakPolarHBondContact O-CB 3.26Å; R157-K161 PolarHBondContact O-N 2.87Å |
| 158 | M | 98.4 | Very high | 94.7 | Very high | 97 Ų | 97 | 88.7 Ų | 88.7 | 48% | 0.478 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -62.5 | -42.3 | 177.2 | -66 | -57.4 | -70.4 | 0 | 0 | 111.9 | Q154 N155 R156 K162 | Q154-M158 WeakPolarHBondContact O-CG 2.91Å; Q154-M158 PolarHBondContact O-N 2.5Å; Q154-M158 VanDerWaalsContact O-N 3.15Å; N155-M158 PolarHBondContact O-N 3.3Å; R156-M158 PolarHBondContact O-N 3.38Å; M158-K162 PolarHBondContact O-N 3.04Å; M158-K162 VanDerWaalsContact O-N 3.07Å |
| 159 | K | 97.7 | Very high | 93.3 | Very high | 127 Ų | 127 | 91.6 Ų | 91.6 | 55% | 0.552 | 43% | 0.426 | S | S | * | . | H | α-helix | trans | -62.3 | -47.2 | 174.3 | -174.6 | -177.9 | 178.2 | -172.8 | 0 | 111.5 | N155 R156 R157 K161 K162 Q163 | N155-K159 PolarHBondContact O-N 3.34Å; R156-K159 PolarHBondContact O-N 3.44Å; R157-K159 VanDerWaalsContact C-N 3.34Å; R157-K159 PolarHBondContact O-N 3.44Å; K159-K161 PolarHBondContact O-N 3.04Å; K159-K162 WeakPolarHBondContact O-CB 3.45Å; K159-K162 PolarHBondContact O-N 3.14Å; K159-K162 VanDerWaalsContact O-N 3.12Å; K159-Q163 WeakPolarHBondContact O-CG 2.94Å; K159-Q163 PolarHBondContact O-N 2.83Å |
| 160 | H | 97.1 | Very high | 91.5 | Very high | 57 Ų | 57 | 96.9 Ų | 96.9 | 26% | 0.264 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -59.6 | -45.8 | 179 | -177.9 | -137.9 | 0 | 0 | 0 | 111.7 | F124 R128 R156 R157 K162 Q163 L164 | F124-H160 HydrophobicContact CE1-CB 4.43Å; F124-H160 HydrophobicContact CZ-CB 4.32Å; R128-H160 PolarHBondContact NE-CE1 3.09Å; R156-H160 WeakPolarHBondContact O-CB 3.34Å; R156-H160 PolarHBondContact O-N 2.93Å; R157-H160 PolarHBondContact O-N 2.8Å; H160-K162 VanDerWaalsContact C-N 3.3Å; H160-K162 PolarHBondContact O-N 2.88Å; H160-Q163 WeakPolarHBondContact O-CB 3.4Å; H160-Q163 PolarHBondContact O-N 2.97Å; H160-L164 PolarHBondContact O-N 2.85Å |
| 161 | K | 96.9 | Very high | 89.5 | Confident | 122 Ų | 122 | 99 Ų | 99 | 53% | 0.53 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -58.9 | -40.3 | 174.2 | -175.9 | 176.6 | 66.8 | 176.1 | 0 | 112.3 | R157 K159 R165 | R157-K161 WeakPolarHBondContact O-CB 3.26Å; R157-K161 PolarHBondContact O-N 2.87Å; K159-K161 PolarHBondContact O-N 3.04Å; K161-R165 WeakPolarHBondContact O-CG 3.45Å; K161-R165 PolarHBondContact O-N 2.82Å |
| 162 | K | 95.8 | Very high | 87.5 | Confident | 164 Ų | 164 | 104 Ų | 104 | 71% | 0.713 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -67 | -39.2 | 177.7 | -174.7 | 176.6 | -179.8 | -178.1 | 0 | 111.9 | M158 K159 H160 R165 K166 | M158-K162 PolarHBondContact O-N 3.04Å; M158-K162 VanDerWaalsContact O-N 3.07Å; K159-K162 WeakPolarHBondContact O-CB 3.45Å; K159-K162 PolarHBondContact O-N 3.14Å; K159-K162 VanDerWaalsContact O-N 3.12Å; H160-K162 VanDerWaalsContact C-N 3.3Å; H160-K162 PolarHBondContact O-N 2.88Å; K162-R165 PolarHBondContact O-N 2.91Å; K162-K166 PolarHBondContact O-N 2.96Å |
| 163 | Q | 94.1 | Very high | 85 | Confident | 83 Ų | 83 | 109.1 Ų | 109.1 | 39% | 0.388 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -62.1 | -46.5 | 177 | -72.5 | 168.8 | -30.3 | 0 | 0 | 111.1 | K159 H160 R165 K166 T167 | K159-Q163 WeakPolarHBondContact O-CG 2.94Å; K159-Q163 PolarHBondContact O-N 2.83Å; H160-Q163 WeakPolarHBondContact O-CB 3.4Å; H160-Q163 PolarHBondContact O-N 2.97Å; Q163-R165 VanDerWaalsContact C-N 3.3Å; Q163-R165 PolarHBondContact O-N 3.21Å; Q163-K166 PolarHBondContact O-N 3.06Å; Q163-K166 VanDerWaalsContact O-N 3.11Å; Q163-T167 PolarHBondContact O-N 3.5Å; Q163-T167 PolarHBondContact O-OG1 3.09Å |
| 164 | L | 92 | Very high | 82.8 | Confident | 108 Ų | 108 | 114 Ų | 114 | 57% | 0.565 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -61.7 | -35.5 | -179 | -166.3 | 64.6 | 0 | 0 | 0 | 113.3 | H160 | H160-L164 PolarHBondContact O-N 2.85Å |
| 165 | R | 90.3 | Very high | 80.3 | Confident | 180 Ų | 180 | 116.7 Ų | 116.7 | 68% | 0.679 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -69.1 | -38.3 | 175.6 | -67.3 | -178.7 | 72.7 | -157.9 | 2.4 | 112.5 | K161 K162 Q163 Q168 | K161-R165 WeakPolarHBondContact O-CG 3.45Å; K161-R165 PolarHBondContact O-N 2.82Å; K162-R165 PolarHBondContact O-N 2.91Å; Q163-R165 VanDerWaalsContact C-N 3.3Å; Q163-R165 PolarHBondContact O-N 3.21Å; R165-Q168 PolarHBondContact O-N 3.1Å |
| 166 | K | 86.8 | Confident | 78.1 | Confident | 142 Ų | 142 | 119.6 Ų | 119.6 | 62% | 0.617 | 58% | 0.576 | S | S | * | * | H | α-helix | trans | -65.3 | -41.1 | -179.8 | -175.7 | 171.8 | 175.5 | 178.7 | 0 | 111.3 | K162 Q163 Q168 D169 D170 | K162-K166 PolarHBondContact O-N 2.96Å; Q163-K166 PolarHBondContact O-N 3.06Å; Q163-K166 VanDerWaalsContact O-N 3.11Å; K166-Q168 VanDerWaalsContact C-N 3.25Å; K166-Q168 PolarHBondContact O-N 3.32Å; K166-D169 PolarHBondContact O-N 2.88Å; K166-D170 PolarHBondContact O-N 3.17Å |
| 167 | T | 80.8 | Confident | 76.1 | Confident | 79 Ų | 79 | 125.8 Ų | 125.8 | 49% | 0.485 | 61% | 0.611 | S | S | . | * | H | α-helix | trans | -63.8 | -28.7 | 178.7 | -50.5 | 0 | 0 | 0 | 0 | 113.1 | Q163 | Q163-T167 PolarHBondContact O-N 3.5Å; Q163-T167 PolarHBondContact O-OG1 3.09Å |
| 168 | Q | 74.6 | Confident | 73.6 | Confident | 135 Ų | 135 | 130.5 Ų | 130.5 | 63% | 0.631 | 64% | 0.64 | S | S | * | * | H | α-helix | trans | -73 | -30.9 | 175.6 | -76 | -171.3 | -2.4 | 0 | 0 | 113.6 | R165 K166 | R165-Q168 PolarHBondContact O-N 3.1Å; K166-Q168 VanDerWaalsContact C-N 3.25Å; K166-Q168 PolarHBondContact O-N 3.32Å |
| 169 | D | 67 | Low | 71.2 | Confident | 117 Ų | 117 | 137.5 Ų | 137.5 | 63% | 0.626 | 66% | 0.661 | S | S | * | * | H | α-helix | trans | -74.7 | -32.4 | 179.3 | -67.3 | -31.9 | 0 | 0 | 0 | 111.3 | K166 | K166-D169 PolarHBondContact O-N 2.88Å |
| 170 | D | 61.3 | Low | 68.7 | Low | 112 Ų | 112 | 136.9 Ų | 136.9 | 60% | 0.599 | 67% | 0.673 | S | S | * | * | H | α-helix | trans | -74.8 | -22.9 | 179.6 | -66 | -32.7 | 0 | 0 | 0 | 113 | K166 K172 | K166-D170 PolarHBondContact O-N 3.17Å; D170-K172 VanDerWaalsContact C-N 3.33Å; D170-K172 PolarHBondContact O-N 2.86Å |
| 171 | Q | 57.5 | Low | 66.3 | Low | 157 Ų | 157 | 143.2 Ų | 143.2 | 73% | 0.734 | 71% | 0.705 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80.5 | -4.1 | 178.5 | -76 | -171.4 | 3.3 | 0 | 0 | 114.9 | ||
| 172 | K | 56 | Low | 63.6 | Low | 177 Ų | 177 | 146.9 Ų | 146.9 | 77% | 0.77 | 72% | 0.724 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -90.1 | -1.3 | 178.6 | -94.5 | -176.3 | 177.5 | -179.1 | 0 | 115.4 | D170 | D170-K172 VanDerWaalsContact C-N 3.33Å; D170-K172 PolarHBondContact O-N 2.86Å |
| 173 | N | 46.8 | Very low | 60.6 | Low | 140 Ų | 140 | 146.7 Ų | 146.7 | 75% | 0.749 | 73% | 0.731 | S | S | * | * | trans | -130.6 | 82.6 | 176.6 | -73.3 | -37.7 | 0 | 0 | 0 | 111.7 | N175 | N173-N175 VanDerWaalsContact C-N 3.32Å; N173-N175 PolarHBondContact O-N 2.97Å | ||
| 174 | P | 51.6 | Low | 58 | Low | 112 Ų | 112 | 148 Ų | 148 | 73% | 0.727 | 75% | 0.749 | S | S | * | * | trans | -85.2 | 12.7 | 177 | 33.3 | -33.2 | 0 | 0 | 0 | 115 | ||||
| 175 | N | 46.7 | Very low | 55.4 | Low | 144 Ų | 144 | 147.9 Ų | 147.9 | 77% | 0.77 | 76% | 0.757 | S | S | * | * | S | Bend | trans | -110.8 | 7.3 | -165.4 | -80.4 | -15.8 | 0 | 0 | 0 | 118.3 | N173 | N173-N175 VanDerWaalsContact C-N 3.32Å; N173-N175 PolarHBondContact O-N 2.97Å |
| 176 | D | 51.6 | Low | 53 | Low | 160 Ų | 160 | 148.7 Ų | 148.7 | 86% | 0.856 | 77% | 0.769 | S | S | * | * | trans | -137.7 | 55.1 | 179.6 | -75 | -54.3 | 0 | 0 | 0 | 113.6 | ||||
| 177 | I | 57.6 | Low | 50.8 | Low | 169 Ų | 169 | 147.8 Ų | 147.8 | 87% | 0.867 | 78% | 0.78 | S | S | * | * | trans | -127.6 | 63 | 165.1 | -41.2 | -177.8 | 0 | 0 | 0 | 110.2 | ||||
| 178 | D | 44.8 | Very low | 48.9 | Very low | 158 Ų | 158 | 152.1 Ų | 152.1 | 85% | 0.845 | 80% | 0.795 | S | S | * | * | trans | -143.8 | 71.9 | 158.9 | -171.3 | 24.7 | 0 | 0 | 0 | 110.2 | ||||
| 179 | R | 48.5 | Very low | 47.5 | Very low | 244 Ų | 244 | 152.5 Ų | 152.5 | 92% | 0.921 | 80% | 0.801 | S | S | * | * | S | Bend | trans | -164.2 | 34.7 | 162.7 | -135.4 | -177.6 | -178.2 | -166 | -0.3 | 118.6 | ||
| 180 | S | 44.3 | Very low | 45.9 | Very low | 114 Ų | 114 | 154.4 Ų | 154.4 | 80% | 0.797 | 81% | 0.811 | S | S | * | * | S | Bend | trans | -158.3 | 65.1 | 173.5 | 52.3 | 0 | 0 | 0 | 0 | 113.9 | ||
| 181 | M | 46.4 | Very low | 45.1 | Very low | 191 Ų | 191 | 156.4 Ų | 156.4 | 94% | 0.941 | 82% | 0.817 | S | S | * | * | trans | -155.1 | 48.8 | 156.6 | -146.8 | 130.5 | 166 | 0 | 0 | 113 | ||||
| 182 | E | 40.7 | Very low | 44.3 | Very low | 198 Ų | 198 | 158.1 Ų | 158.1 | 93% | 0.925 | 82% | 0.822 | S | S | * | * | trans | -123 | 90.8 | 162.6 | -79.4 | -170.4 | 161.2 | 0 | 0 | 108.7 | ||||
| 183 | N | 33.1 | Very low | 43.4 | Very low | 161 Ų | 161 | 156.5 Ų | 156.5 | 86% | 0.861 | 82% | 0.822 | S | S | * | * | trans | -174.9 | 92.8 | 143.2 | -156.1 | 64.4 | 0 | 0 | 0 | 110 | ||||
| 184 | S | 38.7 | Very low | 42.9 | Very low | 109 Ų | 109 | 155.7 Ų | 155.7 | 76% | 0.762 | 82% | 0.822 | S | S | * | * | trans | -172.6 | 94 | 139.4 | -163.7 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 185 | S | 38.2 | Very low | 42.4 | Very low | 106 Ų | 106 | 157.2 Ų | 157.2 | 74% | 0.741 | 82% | 0.824 | S | S | * | * | trans | 35.6 | 109.3 | 136.8 | -51.2 | 0 | 0 | 0 | 0 | 120.4 | ||||
| 186 | E | 39.3 | Very low | 42.4 | Very low | 198 Ų | 198 | 157.5 Ų | 157.5 | 93% | 0.925 | 83% | 0.825 | S | S | * | * | trans | -2.9 | 130.3 | 141.2 | -57.6 | 179.5 | 130 | 0 | 0 | 119.2 | ||||
| 187 | S | 41.4 | Very low | 42.3 | Very low | 123 Ų | 123 | 156.4 Ų | 156.4 | 86% | 0.86 | 82% | 0.824 | S | S | * | * | -152.5 | 108.9 | 130 | 46.9 | 0 | 0 | 0 | 0 | 110.9 | |||||
| 188 | E | 41.3 | Very low | 41.7 | Very low | 169 Ų | 169 | 155 Ų | 155 | 79% | 0.79 | 82% | 0.818 | S | S | * | * | trans | -44.6 | 152.1 | 154.7 | -88.9 | -171.3 | 126.7 | 0 | 0 | 112.4 | ||||
| 189 | L | 43.8 | Very low | 41.6 | Very low | 144 Ų | 144 | 152.1 Ų | 152.1 | 75% | 0.754 | 81% | 0.811 | S | S | * | * | cis | -163.5 | 151 | 10.7 | -88.1 | 146.4 | 0 | 0 | 0 | 106.3 | ||||
| 190 | N | 33.9 | Very low | 41.5 | Very low | 156 Ų | 156 | 144.1 Ų | 144.1 | 83% | 0.834 | 80% | 0.804 | S | S | * | * | -176.7 | 134.5 | 117.6 | -150 | 10.3 | 0 | 0 | 0 | 112.5 | |||||
| 191 | E | 43.9 | Very low | 41.8 | Very low | 154 Ų | 154 | 146.3 Ų | 146.3 | 72% | 0.72 | 81% | 0.805 | S | S | * | * | trans | -62.1 | 148.3 | -179.6 | -69.3 | 166.8 | 63.4 | 0 | 0 | 114.9 | ||||
| 192 | K | 41.1 | Very low | 41.9 | Very low | 193 Ų | 193 | 144.2 Ų | 144.2 | 84% | 0.839 | 80% | 0.798 | S | S | * | * | -177.8 | 134.1 | 104.1 | -98.3 | 170.8 | 179.8 | 176.6 | 0 | 113.7 | |||||
| 193 | N | 36.8 | Very low | 42.6 | Very low | 144 Ų | 144 | 140.8 Ų | 140.8 | 77% | 0.77 | 79% | 0.793 | S | S | * | * | trans | -20.6 | 140.7 | 165.1 | -66.8 | -45.8 | 0 | 0 | 0 | 118.2 | ||||
| 194 | T | 38.2 | Very low | 43.4 | Very low | 122 Ų | 122 | 139.3 Ų | 139.3 | 75% | 0.748 | 79% | 0.785 | S | S | * | * | -169.7 | 122.8 | 107.7 | 43 | 0 | 0 | 0 | 0 | 110.8 | |||||
| 195 | D | 40.3 | Very low | 43.5 | Very low | 145 Ų | 145 | 139.6 Ų | 139.6 | 78% | 0.775 | 79% | 0.787 | S | S | * | * | trans | 54.4 | 101 | 135.1 | -47.9 | -44.3 | 0 | 0 | 0 | 121.3 | ||||
| 196 | D | 47.3 | Very low | 43.8 | Very low | 149 Ų | 149 | 143.9 Ų | 143.9 | 80% | 0.797 | 79% | 0.788 | S | S | * | * | 18.8 | 105.4 | 124.7 | -143.7 | -49 | 0 | 0 | 0 | 118.1 | |||||
| 197 | V | 47.8 | Very low | 44.4 | Very low | 138 Ų | 138 | 142 Ų | 142 | 84% | 0.836 | 78% | 0.782 | S | S | * | * | trans | -149.9 | 108.1 | 136.2 | -173.1 | 0 | 0 | 0 | 0 | 110 | ||||
| 198 | N | 46.3 | Very low | 45 | Very low | 138 Ų | 138 | 144.5 Ų | 144.5 | 74% | 0.738 | 78% | 0.784 | S | S | * | * | trans | -54.8 | 125 | 158 | 172.3 | 29 | 0 | 0 | 0 | 112.3 | ||||
| 199 | S | 41.4 | Very low | 45.6 | Very low | 99 Ų | 99 | 144.6 Ų | 144.6 | 69% | 0.692 | 79% | 0.785 | S | S | * | * | trans | -169.9 | 113.2 | 143.3 | -81.1 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 200 | G | 47.1 | Very low | 46 | Very low | 76 Ų | 76 | 146 Ų | 146 | 78% | 0.784 | 79% | 0.787 | S | S | * | * | trans | -65.1 | 138.6 | 165.9 | 0 | 0 | 0 | 0 | 0 | 111 | ||||
| 201 | I | 49.8 | Very low | 46.5 | Very low | 160 Ų | 160 | 145.5 Ų | 145.5 | 82% | 0.821 | 79% | 0.785 | S | S | * | * | trans | -135.2 | 113.2 | 167.9 | -61.9 | -179.6 | 0 | 0 | 0 | 107.6 | ||||
| 202 | D | 49.7 | Very low | 47.1 | Very low | 146 Ų | 146 | 146.1 Ų | 146.1 | 78% | 0.781 | 79% | 0.787 | S | S | * | * | trans | -53.3 | 142.5 | 166.8 | -110.9 | -62.6 | 0 | 0 | 0 | 111.9 | D204 | D202-D204 PolarHBondContact O-N 3.08Š| ||
| 203 | P | 55 | Low | 47.8 | Very low | 126 Ų | 126 | 143.7 Ų | 143.7 | 82% | 0.818 | 78% | 0.784 | S | S | * | * | S | Bend | trans | -94.8 | 69 | 174.5 | 37.4 | -29.4 | 0 | 0 | 0 | 110.3 | ||
| 204 | D | 49.8 | Very low | 48.9 | Very low | 130 Ų | 130 | 144 Ų | 144 | 70% | 0.695 | 79% | 0.785 | S | S | * | * | trans | -159.2 | 94.5 | 164.1 | -147.7 | 8.5 | 0 | 0 | 0 | 112 | D202 | D202-D204 PolarHBondContact O-N 3.08Š| ||
| 205 | S | 40.9 | Very low | 49.9 | Very low | 115 Ų | 115 | 144 Ų | 144 | 80% | 0.804 | 79% | 0.785 | S | S | * | * | trans | -159.8 | 80.1 | 160.9 | -159.7 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 206 | Y | 44.3 | Very low | 50.6 | Low | 196 Ų | 196 | 144.2 Ų | 144.2 | 77% | 0.769 | 79% | 0.786 | S | S | * | * | trans | -83.4 | 106.5 | 158.7 | 74.2 | -77.1 | 0 | 0 | 0 | 106.9 | ||||
| 207 | M | 52.2 | Low | 50.9 | Low | 160 Ų | 160 | 144.8 Ų | 144.8 | 79% | 0.788 | 79% | 0.788 | S | S | * | * | trans | -135.7 | 87.1 | 161.1 | -74.5 | -66.8 | 179.3 | 0 | 0 | 105.6 | E209 | M207-E209 PolarHBondContact O-N 3.35Š| ||
| 208 | L | 53.9 | Low | 51.2 | Low | 175 Ų | 175 | 145.8 Ų | 145.8 | 92% | 0.916 | 78% | 0.783 | S | S | * | * | trans | -79.7 | 101 | 158.4 | -82.7 | 170.7 | 0 | 0 | 0 | 105.4 | E210 | L208-E210 PolarHBondContact O-N 3.24Š| ||
| 209 | E | 54.4 | Low | 51.4 | Low | 171 Ų | 171 | 146 Ų | 146 | 80% | 0.799 | 78% | 0.784 | S | S | * | * | trans | -63 | 121.5 | 160.7 | -69.9 | -145.6 | 158.8 | 0 | 0 | 108.2 | M207 N211 | M207-E209 PolarHBondContact O-N 3.35Å; E209-N211 PolarHBondContact O-N 3.41Å | ||
| 210 | E | 52.7 | Low | 52.1 | Low | 173 Ų | 173 | 148.4 Ų | 148.4 | 81% | 0.808 | 79% | 0.789 | S | S | * | * | trans | -62.6 | 118.6 | 165.1 | -74.7 | 174.2 | 138.2 | 0 | 0 | 107.5 | L208 E212 | L208-E210 PolarHBondContact O-N 3.24Å; E210-E212 PolarHBondContact O-N 2.84Å | ||
| 211 | N | 44.5 | Very low | 52.3 | Low | 146 Ų | 146 | 152.1 Ų | 152.1 | 78% | 0.781 | 79% | 0.79 | S | S | * | * | trans | -74.7 | 100.7 | 163.8 | -69.4 | -90.4 | 0 | 0 | 0 | 106.2 | E209 D213 | E209-N211 PolarHBondContact O-N 3.41Å; N211-D213 VanDerWaalsContact C-N 3.35Å; N211-D213 PolarHBondContact O-N 3.34Å | ||
| 212 | E | 55 | Low | 52.2 | Low | 166 Ų | 166 | 149.5 Ų | 149.5 | 78% | 0.776 | 79% | 0.785 | S | S | * | * | trans | -79.9 | 83.6 | 165 | -63.1 | -173.7 | 143.1 | 0 | 0 | 108.3 | E210 D214 | E210-E212 PolarHBondContact O-N 2.84Å; E212-D214 PolarHBondContact O-N 3.22Å | ||
| 213 | D | 55.9 | Low | 52.7 | Low | 143 Ų | 143 | 148.1 Ų | 148.1 | 77% | 0.765 | 79% | 0.786 | S | S | * | * | trans | -90.6 | 89.9 | 161.3 | -73.7 | -50.1 | 0 | 0 | 0 | 108.1 | N211 V215 | N211-D213 VanDerWaalsContact C-N 3.35Å; N211-D213 PolarHBondContact O-N 3.34Å; D213-V215 PolarHBondContact O-N 3.13Å; D213-V215 VanDerWaalsContact O-N 3.16Å | ||
| 214 | D | 60 | Low | 53 | Low | 149 Ų | 149 | 147.2 Ų | 147.2 | 80% | 0.797 | 78% | 0.78 | S | S | * | * | trans | -56.8 | 107.2 | 160.8 | -89 | -48 | 0 | 0 | 0 | 109.1 | E212 | E212-D214 PolarHBondContact O-N 3.22Š| ||
| 215 | V | 59.7 | Low | 53.3 | Low | 124 Ų | 124 | 149.4 Ų | 149.4 | 75% | 0.752 | 79% | 0.787 | S | S | * | * | trans | -92.8 | 94.3 | 161.9 | -83.5 | 0 | 0 | 0 | 0 | 108.7 | D213 I217 | D213-V215 PolarHBondContact O-N 3.13Å; D213-V215 VanDerWaalsContact O-N 3.16Å; V215-I217 PolarHBondContact O-N 3.31Å; V215-I217 VanDerWaalsContact O-N 3.14Å | ||
| 216 | D | 54.8 | Low | 54 | Low | 148 Ų | 148 | 155 Ų | 155 | 79% | 0.791 | 79% | 0.79 | S | S | * | * | trans | -54 | 110.6 | 159.2 | -90 | -34.3 | 0 | 0 | 0 | 109.1 | ||||
| 217 | I | 54.8 | Low | 54.6 | Low | 162 Ų | 162 | 150.7 Ų | 150.7 | 83% | 0.831 | 79% | 0.788 | S | S | * | * | trans | -109.4 | 77.3 | 160 | -61.9 | 172.1 | 0 | 0 | 0 | 105.8 | V215 | V215-I217 PolarHBondContact O-N 3.31Å; V215-I217 VanDerWaalsContact O-N 3.14Å | ||
| 218 | E | 53.2 | Low | 54.5 | Low | 158 Ų | 158 | 155 Ų | 155 | 74% | 0.738 | 81% | 0.813 | S | S | * | * | trans | -92.8 | 155.2 | 155 | -68.3 | -139.5 | 137.1 | 0 | 0 | 110 | ||||
| 219 | D | 50.8 | Low | 54.5 | Low | 143 Ų | 143 | 154 Ų | 154 | 77% | 0.765 | 81% | 0.808 | S | S | * | * | trans | 94.7 | 84.3 | 164 | -60.3 | -47.1 | 0 | 0 | 0 | 119.8 | ||||
| 220 | D | 55.5 | Low | 54.6 | Low | 149 Ų | 149 | 153.1 Ų | 153.1 | 80% | 0.797 | 81% | 0.809 | S | S | * | * | 61.3 | 157.4 | 107.7 | -130 | -27 | 0 | 0 | 0 | 121.1 | |||||
| 221 | I | 52.2 | Low | 54.7 | Low | 154 Ų | 154 | 152 Ų | 152 | 79% | 0.79 | 81% | 0.809 | S | S | * | * | trans | 85.6 | 116.3 | 171.8 | -66 | 153.6 | 0 | 0 | 0 | 114.2 | ||||
| 222 | C | 48 | Very low | 55.3 | Low | 106 Ų | 106 | 152.4 Ų | 152.4 | 72% | 0.716 | 81% | 0.81 | S | S | * | * | cis | -162.9 | 132.5 | 32 | -159.5 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 223 | S | 58.3 | Low | 55.3 | Low | 117 Ų | 117 | 151.5 Ų | 151.5 | 82% | 0.818 | 81% | 0.813 | S | S | * | * | trans | -70.4 | 143.3 | 150.7 | -73 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 224 | P | 61.2 | Low | 55.2 | Low | 107 Ų | 107 | 152.1 Ų | 152.1 | 70% | 0.695 | 82% | 0.816 | S | S | * | * | -137.7 | 146.4 | 120.8 | 33.2 | -19.4 | 0 | 0 | 0 | 114.3 | |||||
| 225 | E | 57.9 | Low | 54.9 | Low | 176 Ų | 176 | 152.3 Ų | 152.3 | 82% | 0.822 | 82% | 0.817 | S | S | * | * | trans | 70.8 | 107.1 | 147.4 | -85.7 | -168.5 | 116.5 | 0 | 0 | 121.2 | ||||
| 226 | R | 55.5 | Low | 54.5 | Low | 232 Ų | 232 | 154.5 Ų | 154.5 | 88% | 0.875 | 82% | 0.822 | S | S | * | * | -29.4 | 136.2 | 129.9 | -66.5 | 175.5 | 176.9 | -134.4 | -2.3 | 112.3 | |||||
| 227 | S | 56 | Low | 54.5 | Low | 105 Ų | 105 | 155 Ų | 155 | 73% | 0.734 | 83% | 0.825 | S | S | * | * | trans | -158.7 | 112.2 | 134 | -86.8 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 228 | L | 50.6 | Low | 54.5 | Low | 251 Ų | 251 | 154.4 Ų | 154.4 | 100% | 1.314 | 82% | 0.824 | S | S | * | * | trans | 48.6 | 0 | 151.8 | -68.4 | 158.9 | 0 | 0 | 0 | 119.6 |
Retrieved 228 of 228 residues in 289.2 ms
(Link to these results)