| 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 | 35.6 | Very low | 41.8 | Very low | 237 Ų | 237 | 136.3 Ų | 136.3 | 100% | 1.167 | 84% | 0.838 | S | S | * | * | 0 | 119.5 | 0 | -88.3 | 159 | -173.5 | 0 | 0 | 106.4 | |||||
| 2 | A | 39.4 | Very low | 42.3 | Very low | 101 Ų | 101 | 133.8 Ų | 133.8 | 84% | 0.835 | 83% | 0.831 | S | S | * | * | 64.7 | 130.7 | 54.1 | 0 | 0 | 0 | 0 | 0 | 111 | |||||
| 3 | A | 39.9 | Very low | 43.1 | Very low | 91 Ų | 91 | 137.2 Ų | 137.2 | 75% | 0.752 | 83% | 0.831 | S | S | * | * | cis | -130.1 | 161.4 | 10.2 | 0 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 4 | R | 42.4 | Very low | 43.5 | Very low | 222 Ų | 222 | 139.6 Ų | 139.6 | 84% | 0.838 | 83% | 0.828 | S | S | * | * | 53.1 | 133.9 | 57.9 | -74.4 | -163.7 | 177.4 | 167.6 | 0.3 | 114.2 | |||||
| 5 | D | 43.4 | Very low | 44.2 | Very low | 143 Ų | 143 | 137.6 Ų | 137.6 | 77% | 0.765 | 82% | 0.824 | S | S | * | * | cis | -144 | -159.3 | -24.5 | -70.9 | -54.3 | 0 | 0 | 0 | 104.6 | ||||
| 6 | A | 41.5 | Very low | 45.2 | Very low | 88 Ų | 88 | 135.9 Ų | 135.9 | 73% | 0.727 | 82% | 0.821 | S | S | * | * | cis | -159.6 | -160.4 | 2 | 0 | 0 | 0 | 0 | 0 | 105.8 | ||||
| 7 | T | 43.5 | Very low | 46.2 | Very low | 127 Ų | 127 | 133.1 Ų | 133.1 | 78% | 0.779 | 82% | 0.816 | S | S | * | * | cis | -156.4 | 132.7 | 1.6 | -55.4 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 8 | S | 39.7 | Very low | 47.3 | Very low | 129 Ų | 129 | 134.4 Ų | 134.4 | 90% | 0.902 | 82% | 0.816 | S | S | * | * | trans | 166.1 | 129.8 | 147.2 | -79.4 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 9 | G | 37 | Very low | 48.4 | Very low | 67 Ų | 67 | 136 Ų | 136 | 69% | 0.691 | 82% | 0.819 | S | S | * | * | cis | -168.9 | 159.7 | -7.2 | 0 | 0 | 0 | 0 | 0 | 112 | ||||
| 10 | S | 49.2 | Very low | 49.5 | Very low | 127 Ų | 127 | 135.9 Ų | 135.9 | 89% | 0.888 | 81% | 0.813 | S | S | * | * | trans | 45.6 | 102.4 | 166.8 | -54 | 0 | 0 | 0 | 0 | 118.6 | ||||
| 11 | L | 48.4 | Very low | 50.3 | Low | 167 Ų | 167 | 135 Ų | 135 | 87% | 0.874 | 81% | 0.811 | S | S | * | * | trans | -62.7 | 140.9 | 159.6 | -163.6 | 74.5 | 0 | 0 | 0 | 109.5 | E13 | L11-E13 PolarHBondContact O-N 3.43Š| ||
| 12 | S | 47.2 | Very low | 51.8 | Low | 107 Ų | 107 | 129 Ų | 129 | 75% | 0.748 | 79% | 0.792 | S | S | * | * | trans | -85.1 | 106 | 176.9 | -172.3 | 0 | 0 | 0 | 0 | 110.7 | E14 | S12-E14 VanDerWaalsContact C-N 3.3Å; S12-E14 PolarHBondContact O-N 3.39Å; S12-E14 VanDerWaalsContact O-N 3.1Å | ||
| 13 | E | 52.9 | Low | 52.8 | Low | 178 Ų | 178 | 130.6 Ų | 130.6 | 83% | 0.832 | 79% | 0.791 | S | S | * | * | trans | -79.9 | 74.7 | 168.5 | -67.4 | -178.3 | 100 | 0 | 0 | 110.2 | L11 S15 | L11-E13 PolarHBondContact O-N 3.43Å; E13-S15 PolarHBondContact O-N 3.34Å | ||
| 14 | E | 49.1 | Very low | 53.7 | Low | 171 Ų | 171 | 130.5 Ų | 130.5 | 80% | 0.799 | 78% | 0.784 | S | S | * | * | trans | -72.7 | 95.9 | 166.1 | 73.8 | 178.6 | 158.7 | 0 | 0 | 109.6 | S12 S16 | S12-E14 VanDerWaalsContact C-N 3.3Å; S12-E14 PolarHBondContact O-N 3.39Å; S12-E14 VanDerWaalsContact O-N 3.1Å; E14-S16 PolarHBondContact O-N 3.5Å; E14-S16 VanDerWaalsContact O-N 3.08Å | ||
| 15 | S | 54.2 | Low | 54.5 | Low | 109 Ų | 109 | 123.1 Ų | 123.1 | 76% | 0.762 | 76% | 0.761 | S | S | * | * | trans | -72.7 | 99.2 | 169.5 | -74 | 0 | 0 | 0 | 0 | 108.7 | E13 A17 | E13-S15 PolarHBondContact O-N 3.34Å; S15-A17 PolarHBondContact O-N 3.31Å | ||
| 16 | S | 59.2 | Low | 55.3 | Low | 110 Ų | 110 | 121.6 Ų | 121.6 | 77% | 0.769 | 76% | 0.757 | S | S | * | * | trans | -72.4 | 51.8 | 175.9 | 50.9 | 0 | 0 | 0 | 0 | 112.9 | E14 L18 | E14-S16 PolarHBondContact O-N 3.5Å; E14-S16 VanDerWaalsContact O-N 3.08Å; S16-L18 PolarHBondContact O-N 2.9Å; S16-L18 VanDerWaalsContact O-N 3.12Å | ||
| 17 | A | 63.3 | Low | 56.2 | Low | 89 Ų | 89 | 125.5 Ų | 125.5 | 74% | 0.736 | 75% | 0.753 | S | S | * | * | trans | -66.8 | 106.6 | 168.6 | 0 | 0 | 0 | 0 | 0 | 108.9 | S15 D19 | S15-A17 PolarHBondContact O-N 3.31Å; A17-D19 PolarHBondContact O-N 2.63Å; A17-D19 VanDerWaalsContact O-N 3.12Å | ||
| 18 | L | 64.7 | Low | 56.8 | Low | 156 Ų | 156 | 124.6 Ų | 124.6 | 82% | 0.817 | 74% | 0.743 | S | S | * | * | trans | -69.8 | 105.5 | 170.6 | -64.6 | 177.7 | 0 | 0 | 0 | 108.5 | S16 L20 | S16-L18 PolarHBondContact O-N 2.9Å; S16-L18 VanDerWaalsContact O-N 3.12Å; L18-L20 PolarHBondContact O-N 3.15Å | ||
| 19 | D | 68.3 | Low | 57.5 | Low | 165 Ų | 165 | 127.2 Ų | 127.2 | 88% | 0.882 | 73% | 0.734 | S | S | * | * | trans | -66.8 | 102.2 | 171.7 | -168.4 | 38.2 | 0 | 0 | 0 | 108.7 | A17 | A17-D19 PolarHBondContact O-N 2.63Å; A17-D19 VanDerWaalsContact O-N 3.12Å | ||
| 20 | L | 70.4 | Confident | 58.4 | Low | 134 Ų | 134 | 129.8 Ų | 129.8 | 70% | 0.702 | 74% | 0.737 | S | S | * | * | P | Polyproline II helix | trans | -76.4 | 136.8 | 179.2 | -65.9 | 177.8 | 0 | 0 | 0 | 108.9 | L18 S22 | L18-L20 PolarHBondContact O-N 3.15Å; L20-S22 PolarHBondContact O-N 3.08Å; L20-S22 VanDerWaalsContact O-N 3.11Å |
| 21 | P | 66.9 | Low | 58.6 | Low | 117 Ų | 117 | 130.4 Ų | 130.4 | 76% | 0.76 | 73% | 0.729 | S | S | * | * | P | Polyproline II helix | trans | -57.5 | 122.9 | 176.4 | 24.8 | -33.7 | 0 | 0 | 0 | 109.4 | V23 | P21-V23 PolarHBondContact O-N 3.23Š|
| 22 | S | 67.7 | Low | 58.5 | Low | 110 Ų | 110 | 130.8 Ų | 130.8 | 77% | 0.769 | 73% | 0.726 | S | S | * | * | P | Polyproline II helix | trans | -50.8 | 129.2 | -177.1 | -173.1 | 0 | 0 | 0 | 0 | 110.8 | L20 C24 | L20-S22 PolarHBondContact O-N 3.08Å; L20-S22 VanDerWaalsContact O-N 3.11Å; S22-C24 PolarHBondContact O-N 3.08Å |
| 23 | V | 60.2 | Low | 58.8 | Low | 136 Ų | 136 | 136.4 Ų | 136.4 | 82% | 0.824 | 73% | 0.731 | S | S | * | * | trans | -64.8 | 105 | -173.3 | -177.3 | 0 | 0 | 0 | 0 | 109.2 | P21 D25 | P21-V23 PolarHBondContact O-N 3.23Å; V23-D25 PolarHBondContact O-N 3.06Å | ||
| 24 | C | 58.9 | Low | 58.2 | Low | 89 Ų | 89 | 133.5 Ų | 133.5 | 60% | 0.601 | 73% | 0.728 | S | S | * | * | trans | -65 | 118 | 173.6 | -58.5 | 0 | 0 | 0 | 0 | 108.6 | S22 V26 | S22-C24 PolarHBondContact O-N 3.08Å; C24-V26 PolarHBondContact O-N 3.46Å | ||
| 25 | D | 58.9 | Low | 58.2 | Low | 67 Ų | 67 | 130.9 Ų | 130.9 | 36% | 0.358 | 73% | 0.728 | S | S | . | * | trans | -61.9 | 121.8 | 173.3 | -176.9 | -0.3 | 0 | 0 | 0 | 108.2 | V23 R27 D28 | V23-D25 PolarHBondContact O-N 3.06Å; D25-R27 PolarHBondContact O-N 3.02Å; D25-R27 WeakPolarHBondContact OD1-CG 3.48Å; D25-R27 PolarHBondContact OD1-N 3.19Å; D25-R27 VanDerWaalsContact OD1-N 3.13Å; D25-R27 IonicContact OD1-NE 3.15Å; D25-R27 IonicContact OD2-CZ 3.97Å; D25-R27 VanDerWaalsContact OD2-CZ 3.31Å; D25-R27 IonicContact OD2-NE 3.76Å; D25-R27 PolarHBondContact OD2-NE 3.03Å; D25-R27 IonicContact OD2-NH2 3.56Å; D25-R27 PolarHBondContact OD2-NH2 3.49Å; D25-D28 PolarHBondContact O-N 3.39Å; D25-D28 VanDerWaalsContact O-N 3.08Å | ||
| 26 | V | 60.4 | Low | 57.8 | Low | 110 Ų | 110 | 134.1 Ų | 134.1 | 67% | 0.667 | 73% | 0.731 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -56.5 | -21.9 | -178.7 | 171.2 | 0 | 0 | 0 | 0 | 111.6 | C24 D28 Y29 | C24-V26 PolarHBondContact O-N 3.46Å; V26-D28 VanDerWaalsContact C-N 3.31Å; V26-D28 PolarHBondContact O-N 3.43Å; V26-Y29 PolarHBondContact O-N 3.42Å |
| 27 | R | 59.2 | Low | 56.8 | Low | 171 Ų | 171 | 136.8 Ų | 136.8 | 65% | 0.645 | 73% | 0.732 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67.6 | -22.4 | 178.8 | -60.1 | -173.2 | -55.2 | 146.4 | 12.7 | 114.5 | D25 Y29 V30 | D25-R27 PolarHBondContact O-N 3.02Å; D25-R27 WeakPolarHBondContact OD1-CG 3.48Å; D25-R27 PolarHBondContact OD1-N 3.19Å; D25-R27 VanDerWaalsContact OD1-N 3.13Å; D25-R27 IonicContact OD1-NE 3.15Å; D25-R27 IonicContact OD2-CZ 3.97Å; D25-R27 VanDerWaalsContact OD2-CZ 3.31Å; D25-R27 IonicContact OD2-NE 3.76Å; D25-R27 PolarHBondContact OD2-NE 3.03Å; D25-R27 IonicContact OD2-NH2 3.56Å; D25-R27 PolarHBondContact OD2-NH2 3.49Å; R27-Y29 VanDerWaalsContact C-N 3.27Å; R27-Y29 PolarHBondContact O-N 2.85Å; R27-V30 WeakPolarHBondContact O-CB 3.01Å; R27-V30 PolarHBondContact O-N 3.19Å |
| 28 | D | 56.4 | Low | 55.6 | Low | 107 Ų | 107 | 136.6 Ų | 136.6 | 57% | 0.572 | 73% | 0.73 | S | S | * | * | H | α-helix | trans | -65.2 | -32.1 | 176.9 | -75.9 | -20.6 | 0 | 0 | 0 | 112.2 | D25 V26 V30 L31 Q32 | D25-D28 PolarHBondContact O-N 3.39Å; D25-D28 VanDerWaalsContact O-N 3.08Å; V26-D28 VanDerWaalsContact C-N 3.31Å; V26-D28 PolarHBondContact O-N 3.43Å; D28-V30 PolarHBondContact O-N 2.9Å; D28-L31 PolarHBondContact O-N 3.17Å; D28-Q32 PolarHBondContact O-N 3.41Å |
| 29 | Y | 54 | Low | 54.5 | Low | 184 Ų | 184 | 136 Ų | 136 | 72% | 0.722 | 73% | 0.728 | S | S | * | * | H | α-helix | trans | -65.2 | -19.6 | 174.1 | -67.2 | -85.7 | 0 | 0 | 0 | 113.5 | V26 R27 | V26-Y29 PolarHBondContact O-N 3.42Å; R27-Y29 VanDerWaalsContact C-N 3.27Å; R27-Y29 PolarHBondContact O-N 2.85Å |
| 30 | V | 56.1 | Low | 53.2 | Low | 122 Ų | 122 | 133.7 Ų | 133.7 | 74% | 0.739 | 72% | 0.724 | S | S | * | * | H | α-helix | trans | -88.2 | -23.9 | 180 | -174.7 | 0 | 0 | 0 | 0 | 111.7 | R27 D28 | R27-V30 WeakPolarHBondContact O-CB 3.01Å; R27-V30 PolarHBondContact O-N 3.19Å; D28-V30 PolarHBondContact O-N 2.9Å |
| 31 | L | 55.2 | Low | 52 | Low | 140 Ų | 140 | 136.4 Ų | 136.4 | 73% | 0.733 | 73% | 0.733 | S | S | * | * | H | α-helix | trans | -97.1 | -12.7 | -175.7 | -73.5 | 172.1 | 0 | 0 | 0 | 114.5 | D28 R33 | D28-L31 PolarHBondContact O-N 3.17Å; L31-R33 PolarHBondContact O-N 2.74Å |
| 32 | Q | 46.2 | Very low | 51 | Low | 174 Ų | 174 | 134.7 Ų | 134.7 | 81% | 0.813 | 73% | 0.729 | S | S | * | * | trans | -75.6 | 69.6 | 178.9 | -163 | 165.3 | 104.7 | 0 | 0 | 112.3 | D28 | D28-Q32 PolarHBondContact O-N 3.41Š| ||
| 33 | R | 53.3 | Low | 49.3 | Very low | 226 Ų | 226 | 138.6 Ų | 138.6 | 85% | 0.853 | 73% | 0.733 | S | S | * | * | trans | -54.4 | 138.2 | 163.8 | -82.8 | -173.8 | 171.8 | -173.2 | -2.1 | 109.6 | L31 S35 | L31-R33 PolarHBondContact O-N 2.74Å; R33-S35 PolarHBondContact O-N 3.46Å | ||
| 34 | P | 39.2 | Very low | 48.2 | Very low | 117 Ų | 117 | 137.1 Ų | 137.1 | 76% | 0.76 | 73% | 0.728 | S | S | * | * | trans | -57 | 123.4 | 163.4 | -22.4 | 33.6 | 0 | 0 | 0 | 110.1 | Q36 | P34-Q36 PolarHBondContact O-N 3.36Å; P34-Q36 VanDerWaalsContact O-N 3.11Å | ||
| 35 | S | 49.8 | Very low | 47.6 | Very low | 116 Ų | 116 | 138.3 Ų | 138.3 | 81% | 0.811 | 74% | 0.738 | S | S | * | * | trans | -73.2 | 97.1 | 168.6 | 54.6 | 0 | 0 | 0 | 0 | 108.7 | R33 | R33-S35 PolarHBondContact O-N 3.46Š| ||
| 36 | Q | 45.6 | Very low | 46.8 | Very low | 177 Ų | 177 | 142.3 Ų | 142.3 | 83% | 0.827 | 76% | 0.758 | S | S | * | * | trans | -129.5 | 105.1 | 174.3 | -175.2 | 171.1 | -11.6 | 0 | 0 | 109.5 | P34 | P34-Q36 PolarHBondContact O-N 3.36Å; P34-Q36 VanDerWaalsContact O-N 3.11Å | ||
| 37 | E | 38.6 | Very low | 45.8 | Very low | 166 Ų | 166 | 144.9 Ų | 144.9 | 78% | 0.776 | 76% | 0.763 | S | S | * | * | trans | -58.9 | 141.7 | 177.4 | -93.3 | 64.7 | -159 | 0 | 0 | 114.1 | ||||
| 38 | A | 37.7 | Very low | 44.9 | Very low | 84 Ų | 84 | 145.2 Ų | 145.2 | 69% | 0.694 | 77% | 0.769 | S | S | * | * | trans | 77.4 | 135 | 154.1 | 0 | 0 | 0 | 0 | 0 | 120.7 | ||||
| 39 | N | 41.5 | Very low | 43.9 | Very low | 145 Ų | 145 | 147.4 Ų | 147.4 | 78% | 0.775 | 78% | 0.776 | S | S | * | * | trans | 60.5 | 101.3 | 157.9 | 71.5 | 93.5 | 0 | 0 | 0 | 120.5 | ||||
| 40 | S | 41.9 | Very low | 43.3 | Very low | 116 Ų | 116 | 144.1 Ų | 144.1 | 81% | 0.811 | 78% | 0.78 | S | S | * | * | -178.8 | 167.4 | 104.9 | -76.4 | 0 | 0 | 0 | 0 | 111.1 | |||||
| 41 | E | 43.3 | Very low | 42.8 | Very low | 190 Ų | 190 | 146.2 Ų | 146.2 | 89% | 0.888 | 79% | 0.786 | S | S | * | * | trans | -100.6 | 158.5 | -166.6 | -61.7 | 173.7 | 106.9 | 0 | 0 | 114.9 | ||||
| 42 | A | 46.1 | Very low | 42.7 | Very low | 81 Ų | 81 | 145.6 Ų | 145.6 | 67% | 0.669 | 79% | 0.79 | S | S | * | * | trans | 66 | 154.5 | 173.5 | 0 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 43 | F | 33.2 | Very low | 42.5 | Very low | 193 Ų | 193 | 143.7 Ų | 143.7 | 85% | 0.846 | 80% | 0.795 | S | S | * | * | cis | -131.1 | 137.3 | 9.8 | -65.6 | -98.9 | 0 | 0 | 0 | 109.8 | ||||
| 44 | S | 37.6 | Very low | 41.8 | Very low | 105 Ų | 105 | 138 Ų | 138 | 73% | 0.734 | 79% | 0.789 | S | S | * | * | 66 | 135.8 | 101 | -158.5 | 0 | 0 | 0 | 0 | 117.9 | |||||
| 45 | S | 44.6 | Very low | 42.4 | Very low | 114 Ų | 114 | 137.4 Ų | 137.4 | 80% | 0.797 | 79% | 0.788 | S | S | * | * | trans | 70.7 | 87.9 | 160.3 | -51.2 | 0 | 0 | 0 | 0 | 118.4 | ||||
| 46 | L | 43.7 | Very low | 42.4 | Very low | 151 Ų | 151 | 139.5 Ų | 139.5 | 79% | 0.791 | 79% | 0.79 | S | S | * | * | trans | -106.2 | 106.4 | 157.7 | 176.5 | 64.4 | 0 | 0 | 0 | 109 | F48 | L46-F48 HydrophobicContact CD2-CD2 4.08Å; L46-F48 HydrophobicContact CD2-CE2 3.86Å; L46-F48 HydrophobicContact CG-CD2 4.18Å; L46-F48 HydrophobicContact CG-CE2 4.43Å; L46-F48 PolarHBondContact O-N 3.14Å | ||
| 47 | E | 38.9 | Very low | 42.9 | Very low | 163 Ų | 163 | 137.6 Ų | 137.6 | 76% | 0.762 | 79% | 0.791 | S | S | * | * | trans | -95.8 | 87.3 | -172.5 | -159.1 | 163.2 | -122.8 | 0 | 0 | 111.5 | H49 | E47-H49 PolarHBondContact O-N 2.69Å; E47-H49 VanDerWaalsContact O-N 3.09Å; E47-H49 PolarHBondContact O-ND1 2.71Å; E47-H49 IonicContact OE2-CE1 3.84Å | ||
| 48 | F | 40 | Very low | 43.1 | Very low | 178 Ų | 178 | 137 Ų | 137 | 78% | 0.781 | 79% | 0.793 | S | S | * | * | trans | -60.9 | 108.7 | 179.5 | -109.4 | -91.8 | 0 | 0 | 0 | 111.5 | L46 S50 | L46-F48 HydrophobicContact CD2-CD2 4.08Å; L46-F48 HydrophobicContact CD2-CE2 3.86Å; L46-F48 HydrophobicContact CG-CD2 4.18Å; L46-F48 HydrophobicContact CG-CE2 4.43Å; L46-F48 PolarHBondContact O-N 3.14Å; F48-S50 PolarHBondContact O-N 2.79Å | ||
| 49 | H | 36 | Very low | 43.7 | Very low | 153 Ų | 153 | 138.6 Ų | 138.6 | 71% | 0.708 | 80% | 0.796 | S | S | * | * | trans | -87.9 | 105.2 | 173.9 | -78.6 | 57.1 | 0 | 0 | 0 | 110.2 | E47 | E47-H49 PolarHBondContact O-N 2.69Å; E47-H49 VanDerWaalsContact O-N 3.09Å; E47-H49 PolarHBondContact O-ND1 2.71Å; E47-H49 IonicContact OE2-CE1 3.84Å | ||
| 50 | S | 40.1 | Very low | 43.5 | Very low | 115 Ų | 115 | 138.4 Ų | 138.4 | 80% | 0.804 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -68 | 130.5 | 178.3 | -58.6 | 0 | 0 | 0 | 0 | 112.1 | F48 | F48-S50 PolarHBondContact O-N 2.79Š|
| 51 | L | 45.4 | Very low | 43.4 | Very low | 167 Ų | 167 | 139.7 Ų | 139.7 | 87% | 0.874 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -80.2 | 127.7 | 167 | -63.3 | 175.5 | 0 | 0 | 0 | 109.7 | ||
| 52 | P | 53.3 | Low | 43.6 | Very low | 127 Ų | 127 | 135.5 Ų | 135.5 | 83% | 0.825 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -75.9 | 132.1 | 175.3 | 30.2 | -33 | 0 | 0 | 0 | 111.2 | ||
| 53 | C | 42.7 | Very low | 43.3 | Very low | 133 Ų | 133 | 139.2 Ų | 139.2 | 90% | 0.899 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -100.6 | 124.6 | 173.8 | -177 | 0 | 0 | 0 | 0 | 110.3 | ||
| 54 | S | 39.3 | Very low | 43.8 | Very low | 106 Ų | 106 | 138 Ų | 138 | 74% | 0.741 | 80% | 0.8 | S | S | * | * | trans | -166.7 | 140.3 | 175.3 | -159.2 | 0 | 0 | 0 | 0 | 108 | ||||
| 55 | S | 51 | Low | 44 | Very low | 105 Ų | 105 | 140.6 Ų | 140.6 | 73% | 0.734 | 81% | 0.805 | S | S | * | * | cis | -164.8 | 166.7 | -8.7 | 33.3 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 56 | D | 50.7 | Low | 43.9 | Very low | 160 Ų | 160 | 141.6 Ų | 141.6 | 86% | 0.856 | 81% | 0.807 | S | S | * | * | trans | -48.8 | 146 | 176.8 | -81.2 | -69.2 | 0 | 0 | 0 | 116 | ||||
| 57 | V | 55.5 | Low | 43.6 | Very low | 138 Ų | 138 | 142.7 Ų | 142.7 | 84% | 0.836 | 81% | 0.808 | S | S | * | * | trans | -138.4 | 134.3 | 146.8 | -72.6 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 58 | D | 42.1 | Very low | 44.1 | Very low | 154 Ų | 154 | 143 Ų | 143 | 82% | 0.824 | 81% | 0.809 | S | S | * | * | trans | -84.5 | 133.9 | -170.5 | -171.7 | 33.2 | 0 | 0 | 0 | 112.2 | ||||
| 59 | P | 51.1 | Low | 44.3 | Very low | 116 Ų | 116 | 140.4 Ų | 140.4 | 75% | 0.753 | 80% | 0.804 | S | S | * | * | trans | -100.9 | 83.2 | -172.6 | 37.7 | -33.5 | 0 | 0 | 0 | 113.6 | ||||
| 60 | D | 36.9 | Very low | 45.2 | Very low | 142 Ų | 142 | 140 Ų | 140 | 76% | 0.759 | 81% | 0.807 | S | S | * | * | trans | -153.1 | 120 | 161.1 | -136.2 | -21.7 | 0 | 0 | 0 | 114.6 | ||||
| 61 | T | 40.5 | Very low | 45.3 | Very low | 142 Ų | 142 | 138.4 Ų | 138.4 | 87% | 0.871 | 80% | 0.795 | S | S | * | * | -179 | 141.3 | 128.5 | 22.1 | 0 | 0 | 0 | 0 | 110.6 | |||||
| 62 | S | 46.3 | Very low | 45.5 | Very low | 102 Ų | 102 | 140.9 Ų | 140.9 | 71% | 0.713 | 79% | 0.793 | S | S | * | * | trans | -86.6 | 155 | -176.6 | 56.9 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 63 | N | 39.8 | Very low | 45.1 | Very low | 159 Ų | 159 | 140.6 Ų | 140.6 | 85% | 0.85 | 79% | 0.789 | S | S | * | * | -159.7 | 159.4 | 127 | -112.3 | -77.7 | 0 | 0 | 0 | 111.8 | |||||
| 64 | L | 44.6 | Very low | 45.4 | Very low | 169 Ų | 169 | 140.1 Ų | 140.1 | 89% | 0.885 | 79% | 0.787 | S | S | * | * | trans | -110.4 | 120.6 | -175.1 | -73.4 | 163.1 | 0 | 0 | 0 | 110.9 | ||||
| 65 | N | 40.8 | Very low | 45.8 | Very low | 159 Ų | 159 | 141.3 Ų | 141.3 | 85% | 0.85 | 78% | 0.781 | S | S | * | * | trans | -146.7 | 125 | 151.1 | 61.6 | -44.1 | 0 | 0 | 0 | 112 | ||||
| 66 | T | 44.1 | Very low | 45.8 | Very low | 134 Ų | 134 | 143.5 Ų | 143.5 | 82% | 0.822 | 79% | 0.785 | S | S | * | * | trans | -73.2 | 128.2 | -179.4 | -51.3 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 67 | E | 37.4 | Very low | 45.7 | Very low | 175 Ų | 175 | 145.8 Ų | 145.8 | 82% | 0.818 | 79% | 0.788 | S | S | * | * | trans | -151 | 129 | 134.5 | -123.8 | 177.5 | 152.9 | 0 | 0 | 112.6 | N69 | E67-N69 PolarHBondContact O-N 2.68Š| ||
| 68 | Q | 49.3 | Very low | 45.7 | Very low | 170 Ų | 170 | 150.6 Ų | 150.6 | 79% | 0.794 | 79% | 0.791 | S | S | * | * | trans | -87.9 | 90.3 | -171.1 | -179.7 | -176.3 | -26.9 | 0 | 0 | 110.3 | ||||
| 69 | N | 43.3 | Very low | 46.2 | Very low | 123 Ų | 123 | 149.2 Ų | 149.2 | 66% | 0.658 | 78% | 0.783 | S | S | * | * | trans | -116.8 | 93.7 | 173.4 | -80.7 | -76.1 | 0 | 0 | 0 | 111.1 | E67 S71 | E67-N69 PolarHBondContact O-N 2.68Å; N69-S71 PolarHBondContact O-N 2.72Å | ||
| 70 | N | 54.3 | Low | 45.8 | Very low | 145 Ų | 145 | 149.3 Ų | 149.3 | 78% | 0.775 | 78% | 0.777 | S | S | * | * | trans | -74.1 | 61.5 | 173.4 | 50.9 | -83.7 | 0 | 0 | 0 | 112.2 | ||||
| 71 | S | 42 | Very low | 46.7 | Very low | 81 Ų | 81 | 146.5 Ų | 146.5 | 57% | 0.566 | 77% | 0.767 | S | S | * | * | trans | -79.2 | 120.4 | 173.9 | -68.6 | 0 | 0 | 0 | 0 | 111 | N69 T73 | N69-S71 PolarHBondContact O-N 2.72Å; S71-T73 PolarHBondContact O-N 2.75Å | ||
| 72 | W | 51.6 | Low | 47.1 | Very low | 218 Ų | 218 | 144 Ų | 144 | 83% | 0.826 | 76% | 0.76 | S | S | * | * | trans | -72.4 | 87.5 | 171.9 | -178.9 | -83 | 0 | 0 | 0 | 109.7 | E75 | W72-E75 PolarHBondContact NE1-OE2 2.94Š| ||
| 73 | T | 44.9 | Very low | 47.2 | Very low | 121 Ų | 121 | 145.2 Ų | 145.2 | 74% | 0.742 | 76% | 0.763 | S | S | * | * | trans | -130 | 56.1 | 178.7 | 58.8 | 0 | 0 | 0 | 0 | 111.4 | S71 | S71-T73 PolarHBondContact O-N 2.75Š| ||
| 74 | S | 47.6 | Very low | 47.8 | Very low | 123 Ų | 123 | 142.9 Ų | 142.9 | 86% | 0.86 | 75% | 0.745 | S | S | * | * | trans | -127.8 | 28.5 | 169.9 | -152.5 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 75 | E | 48.3 | Very low | 48.1 | Very low | 131 Ų | 131 | 137.5 Ų | 137.5 | 61% | 0.612 | 73% | 0.731 | S | S | * | * | trans | -117.7 | 168.4 | 160 | -70.6 | 179.4 | 103.3 | 0 | 0 | 108.2 | W72 | W72-E75 PolarHBondContact NE1-OE2 2.94Š| ||
| 76 | N | 50.4 | Low | 48.5 | Very low | 152 Ų | 152 | 138.3 Ų | 138.3 | 81% | 0.813 | 73% | 0.729 | S | S | * | * | trans | 87.1 | 8.9 | -176.3 | -48.8 | -45.2 | 0 | 0 | 0 | 118.5 | W78 | N76-W78 PolarHBondContact O-N 3.11Š| ||
| 77 | F | 48.9 | Very low | 49 | Very low | 208 Ų | 208 | 135.1 Ų | 135.1 | 91% | 0.912 | 71% | 0.712 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.6 | 4.6 | 166.6 | -106.3 | -73.2 | 0 | 0 | 0 | 114.6 | ||
| 78 | W | 55.6 | Low | 49.9 | Very low | 239 Ų | 239 | 131.7 Ų | 131.7 | 91% | 0.905 | 70% | 0.696 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -111.1 | -0.7 | -173 | -82.5 | 110.1 | 0 | 0 | 0 | 115.7 | N76 | N76-W78 PolarHBondContact O-N 3.11Š|
| 79 | L | 52.5 | Low | 50.5 | Low | 125 Ų | 125 | 131.9 Ų | 131.9 | 65% | 0.654 | 70% | 0.695 | S | S | * | * | trans | -140.8 | 94.3 | 176.6 | -71.8 | 175.8 | 0 | 0 | 0 | 111.1 | ||||
| 80 | D | 42.7 | Very low | 51.8 | Low | 118 Ų | 118 | 133 Ų | 133 | 63% | 0.631 | 70% | 0.696 | S | S | * | * | trans | -100.6 | 103.1 | 144.7 | -174.6 | -3.4 | 0 | 0 | 0 | 108.7 | A82 | D80-A82 PolarHBondContact O-N 3.18Å; D80-A82 WeakPolarHBondContact OD1-CB 3.5Å; D80-A82 PolarHBondContact OD1-N 2.85Å | ||
| 81 | P | 54.7 | Low | 52.6 | Low | 83 Ų | 83 | 131.1 Ų | 131.1 | 54% | 0.539 | 68% | 0.682 | S | S | . | * | G | 310 helix | trans | -71.6 | -7.8 | 176.6 | -17.5 | 32.9 | 0 | 0 | 0 | 114 | V83 K84 | P81-V83 PolarHBondContact O-N 3.13Å; P81-K84 WeakPolarHBondContact O-CB 3.14Å; P81-K84 PolarHBondContact O-N 3.45Å |
| 82 | A | 49.7 | Very low | 54.5 | Low | 88 Ų | 88 | 130.9 Ų | 130.9 | 73% | 0.727 | 68% | 0.675 | S | S | * | * | G | 310 helix | trans | -68.3 | -19.2 | -173.4 | 0 | 0 | 0 | 0 | 0 | 114.2 | D80 | D80-A82 PolarHBondContact O-N 3.18Å; D80-A82 WeakPolarHBondContact OD1-CB 3.5Å; D80-A82 PolarHBondContact OD1-N 2.85Å |
| 83 | V | 49.5 | Very low | 56.1 | Low | 128 Ų | 128 | 124 Ų | 124 | 78% | 0.776 | 65% | 0.654 | S | S | * | * | G | 310 helix | trans | -98.4 | 2.2 | 174.2 | -174.3 | 0 | 0 | 0 | 0 | 111.8 | P81 G85 | P81-V83 PolarHBondContact O-N 3.13Å; V83-G85 PolarHBondContact O-N 3.39Å |
| 84 | K | 51.8 | Low | 58.4 | Low | 111 Ų | 111 | 123.8 Ų | 123.8 | 48% | 0.483 | 65% | 0.645 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -86.2 | 100.4 | -174.4 | -169.7 | 172 | -75.9 | -123.3 | 0 | 111.8 | P81 E88 | P81-K84 WeakPolarHBondContact O-CB 3.14Å; P81-K84 PolarHBondContact O-N 3.45Å; K84-E88 VanDerWaalsContact CD-OE1 3.27Å; K84-E88 WeakPolarHBondContact CD-OE1 3.33Å; K84-E88 WeakPolarHBondContact CD-OE2 3.45Å; K84-E88 VanDerWaalsContact CE-OE1 3.31Å; K84-E88 WeakPolarHBondContact CE-OE1 3.49Å; K84-E88 HydrophobicContact CG-CG 4.13Å; K84-E88 WeakPolarHBondContact CG-OE2 3.28Å; K84-E88 IonicContact NZ-OE1 3.58Å; K84-E88 PolarHBondContact NZ-OE1 3.01Å |
| 85 | G | 51.6 | Low | 60.4 | Low | 56 Ų | 56 | 123.3 Ų | 123.3 | 58% | 0.577 | 63% | 0.632 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -175.6 | -9.1 | 176.1 | 0 | 0 | 0 | 0 | 0 | 118 | V83 | V83-G85 PolarHBondContact O-N 3.39Š|
| 86 | Q | 47.8 | Very low | 62.4 | Low | 176 Ų | 176 | 121.6 Ų | 121.6 | 82% | 0.822 | 62% | 0.62 | S | S | * | * | S | Bend | trans | -122.9 | -50.4 | 176.4 | -64 | -70.9 | -102.9 | 0 | 0 | 112.8 | E88 | Q86-E88 PolarHBondContact O-N 3.09Š|
| 87 | S | 55 | Low | 64.4 | Low | 67 Ų | 67 | 119.6 Ų | 119.6 | 47% | 0.469 | 60% | 0.604 | S | S | . | * | H | α-helix | trans | -62.9 | -41.2 | -169.7 | -155.1 | 0 | 0 | 0 | 0 | 115.3 | K89 E90 E91 | S87-K89 PolarHBondContact O-N 3.16Å; S87-E90 PolarHBondContact O-N 2.91Å; S87-E91 WeakPolarHBondContact CB-OE1 3.48Å; S87-E91 PolarHBondContact O-N 3.43Å; S87-E91 VanDerWaalsContact O-N 3.16Å; S87-E91 PolarHBondContact OG-OE1 3.29Å |
| 88 | E | 57.3 | Low | 66.6 | Low | 102 Ų | 102 | 112.3 Ų | 112.3 | 48% | 0.477 | 58% | 0.579 | S | S | . | * | H | α-helix | trans | -58.3 | -28.8 | -167.1 | -60.8 | -171.3 | 117.8 | 0 | 0 | 115.3 | K84 Q86 D92 | K84-E88 VanDerWaalsContact CD-OE1 3.27Å; K84-E88 WeakPolarHBondContact CD-OE1 3.33Å; K84-E88 WeakPolarHBondContact CD-OE2 3.45Å; K84-E88 VanDerWaalsContact CE-OE1 3.31Å; K84-E88 WeakPolarHBondContact CE-OE1 3.49Å; K84-E88 HydrophobicContact CG-CG 4.13Å; K84-E88 WeakPolarHBondContact CG-OE2 3.28Å; K84-E88 IonicContact NZ-OE1 3.58Å; K84-E88 PolarHBondContact NZ-OE1 3.01Å; Q86-E88 PolarHBondContact O-N 3.09Å; E88-D92 PolarHBondContact O-N 3.4Å |
| 89 | K | 60.4 | Low | 68.4 | Low | 175 Ų | 175 | 104.7 Ų | 104.7 | 76% | 0.761 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -76.5 | -35.3 | 176.4 | -80 | -173.3 | 173.9 | -179.6 | 0 | 112.7 | S87 D93 | S87-K89 PolarHBondContact O-N 3.16Å; K89-D93 WeakPolarHBondContact O-CB 3.15Å; K89-D93 PolarHBondContact O-N 2.95Å; K89-D93 VanDerWaalsContact O-N 3.09Å |
| 90 | E | 70.8 | Confident | 70.3 | Confident | 147 Ų | 147 | 102 Ų | 102 | 69% | 0.687 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -72.2 | -39.8 | -178.8 | -172.2 | 158.1 | -162.2 | 0 | 0 | 110.6 | S87 D93 E94 | S87-E90 PolarHBondContact O-N 2.91Å; E90-D93 PolarHBondContact O-N 3.5Å; E90-E94 PolarHBondContact O-N 3.12Å |
| 91 | E | 72.1 | Confident | 72.8 | Confident | 104 Ų | 104 | 102.8 Ų | 102.8 | 49% | 0.486 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -61.7 | -48.2 | 173 | -68.5 | 167.5 | -128.4 | 0 | 0 | 112.6 | S87 D93 E94 L95 | S87-E91 WeakPolarHBondContact CB-OE1 3.48Å; S87-E91 PolarHBondContact O-N 3.43Å; S87-E91 VanDerWaalsContact O-N 3.16Å; S87-E91 PolarHBondContact OG-OE1 3.29Å; E91-D93 VanDerWaalsContact C-N 3.34Å; E91-D93 PolarHBondContact O-N 2.86Å; E91-E94 PolarHBondContact O-N 3.24Å; E91-L95 WeakPolarHBondContact O-CB 3.35Å; E91-L95 WeakPolarHBondContact O-CG 3.13Å; E91-L95 PolarHBondContact O-N 2.98Å |
| 92 | D | 80.4 | Confident | 74.7 | Confident | 76 Ų | 76 | 102.4 Ų | 102.4 | 41% | 0.406 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -62.6 | -39.2 | 176.2 | 171.6 | 49 | 0 | 0 | 0 | 112.1 | E88 R96 | E88-D92 PolarHBondContact O-N 3.4Å; D92-R96 WeakPolarHBondContact O-CB 3.11Å; D92-R96 PolarHBondContact O-N 3.41Å; D92-R96 IonicContact OD1-CZ 2.74Å; D92-R96 IonicContact OD1-NH1 2.69Å; D92-R96 IonicContact OD1-NH2 3.38Å; D92-R96 PolarHBondContact OD1-NH2 3.33Å; D92-R96 IonicContact OD2-CZ 3.95Å; D92-R96 IonicContact OD2-NH1 2.79Å; D92-R96 PolarHBondContact OD2-NH1 2.73Å; D92-R96 IonicContact OD2-NH2 3.14Å; D92-R96 PolarHBondContact OD2-NH2 3.38Å |
| 93 | D | 86.2 | Confident | 76.8 | Confident | 74 Ų | 74 | 99.1 Ų | 99.1 | 40% | 0.396 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -70.6 | -29.9 | 173.7 | -92 | -20.5 | 0 | 0 | 0 | 113.3 | K89 E90 E91 R96 K97 | K89-D93 WeakPolarHBondContact O-CB 3.15Å; K89-D93 PolarHBondContact O-N 2.95Å; K89-D93 VanDerWaalsContact O-N 3.09Å; E90-D93 PolarHBondContact O-N 3.5Å; E91-D93 VanDerWaalsContact C-N 3.34Å; E91-D93 PolarHBondContact O-N 2.86Å; D93-R96 IonicContact OD1-CZ 3.36Å; D93-R96 IonicContact OD1-NH1 3.77Å; D93-R96 PolarHBondContact OD1-NH1 2.97Å; D93-K97 WeakPolarHBondContact O-CD 3.3Å; D93-K97 WeakPolarHBondContact O-CE 3.41Å; D93-K97 WeakPolarHBondContact O-CG 3.48Å; D93-K97 PolarHBondContact O-N 2.92Å; D93-K97 VanDerWaalsContact O-N 3.13Å |
| 94 | E | 92.2 | Very high | 78.9 | Confident | 117 Ų | 117 | 97.7 Ų | 97.7 | 55% | 0.547 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -69.4 | -48.5 | 169.1 | 178.2 | 159.5 | -147.1 | 0 | 0 | 112.2 | E90 E91 R96 K97 S98 | E90-E94 PolarHBondContact O-N 3.12Å; E91-E94 PolarHBondContact O-N 3.24Å; E94-R96 PolarHBondContact O-N 2.99Å; E94-K97 CarbonylContact O-C 3.58Å; E94-K97 WeakPolarHBondContact O-CB 3.49Å; E94-K97 PolarHBondContact O-N 2.89Å; E94-K97 VanDerWaalsContact O-N 3.11Å; E94-S98 WeakPolarHBondContact O-CB 3.47Å; E94-S98 PolarHBondContact O-N 3.43Å |
| 95 | L | 91.3 | Very high | 80.7 | Confident | 113 Ų | 113 | 99.2 Ų | 99.2 | 59% | 0.592 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -56.2 | -41.8 | 176.9 | -72.4 | 171.1 | 0 | 0 | 0 | 111.1 | E91 S98 L99 | E91-L95 WeakPolarHBondContact O-CB 3.35Å; E91-L95 WeakPolarHBondContact O-CG 3.13Å; E91-L95 PolarHBondContact O-N 2.98Å; L95-S98 PolarHBondContact O-N 3.32Å; L95-L99 WeakPolarHBondContact O-CG 3.28Å; L95-L99 PolarHBondContact O-N 3.15Å |
| 96 | R | 89.5 | Confident | 82.5 | Confident | 95 Ų | 95 | 101.9 Ų | 101.9 | 36% | 0.358 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -57.9 | -52.3 | 173 | -178 | 170.8 | -65.8 | 117.1 | 14.3 | 112.2 | D92 D93 E94 S98 L99 D100 | D92-R96 WeakPolarHBondContact O-CB 3.11Å; D92-R96 PolarHBondContact O-N 3.41Å; D92-R96 IonicContact OD1-CZ 2.74Å; D92-R96 IonicContact OD1-NH1 2.69Å; D92-R96 IonicContact OD1-NH2 3.38Å; D92-R96 PolarHBondContact OD1-NH2 3.33Å; D92-R96 IonicContact OD2-CZ 3.95Å; D92-R96 IonicContact OD2-NH1 2.79Å; D92-R96 PolarHBondContact OD2-NH1 2.73Å; D92-R96 IonicContact OD2-NH2 3.14Å; D92-R96 PolarHBondContact OD2-NH2 3.38Å; D93-R96 IonicContact OD1-CZ 3.36Å; D93-R96 IonicContact OD1-NH1 3.77Å; D93-R96 PolarHBondContact OD1-NH1 2.97Å; E94-R96 PolarHBondContact O-N 2.99Å; R96-S98 VanDerWaalsContact C-N 3.27Å; R96-S98 PolarHBondContact O-N 2.89Å; R96-L99 PolarHBondContact O-N 3.16Å; R96-D100 PolarHBondContact O-N 3.08Å |
| 97 | K | 92.9 | Very high | 84.4 | Confident | 110 Ų | 110 | 93.6 Ų | 93.6 | 48% | 0.478 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -59.1 | -37.8 | 174.6 | -66.3 | 156 | -155.9 | 153.2 | 0 | 111.4 | D93 E94 D100 R101 | D93-K97 WeakPolarHBondContact O-CD 3.3Å; D93-K97 WeakPolarHBondContact O-CE 3.41Å; D93-K97 WeakPolarHBondContact O-CG 3.48Å; D93-K97 PolarHBondContact O-N 2.92Å; D93-K97 VanDerWaalsContact O-N 3.13Å; E94-K97 CarbonylContact O-C 3.58Å; E94-K97 WeakPolarHBondContact O-CB 3.49Å; E94-K97 PolarHBondContact O-N 2.89Å; E94-K97 VanDerWaalsContact O-N 3.11Å; K97-D100 PolarHBondContact O-N 3.1Å; K97-R101 WeakPolarHBondContact O-CG 3.38Å; K97-R101 PolarHBondContact O-N 3.24Å |
| 98 | S | 95.1 | Very high | 85.8 | Confident | 54 Ų | 54 | 95.1 Ų | 95.1 | 38% | 0.378 | 45% | 0.447 | S | S | . | . | H | α-helix | trans | -68.1 | -42.4 | -180 | -142.4 | 0 | 0 | 0 | 0 | 112.6 | E94 L95 R96 R101 F102 | E94-S98 WeakPolarHBondContact O-CB 3.47Å; E94-S98 PolarHBondContact O-N 3.43Å; L95-S98 PolarHBondContact O-N 3.32Å; R96-S98 VanDerWaalsContact C-N 3.27Å; R96-S98 PolarHBondContact O-N 2.89Å; S98-R101 VanDerWaalsContact CB-NH2 3.32Å; S98-R101 PolarHBondContact O-N 2.95Å; S98-R101 PolarHBondContact OG-NH2 3.31Å; S98-F102 PolarHBondContact O-N 3.1Å |
| 99 | L | 92.8 | Very high | 86.7 | Confident | 80 Ų | 80 | 94.1 Ų | 94.1 | 42% | 0.419 | 45% | 0.449 | S | S | . | . | H | α-helix | trans | -64.5 | -39.6 | 172 | -72.4 | 171.5 | 0 | 0 | 0 | 112 | L95 R96 F102 Y103 | L95-L99 WeakPolarHBondContact O-CG 3.28Å; L95-L99 PolarHBondContact O-N 3.15Å; R96-L99 PolarHBondContact O-N 3.16Å; L99-F102 WeakPolarHBondContact O-CB 3.21Å; L99-F102 PolarHBondContact O-N 2.93Å; L99-Y103 HydrophobicContact CB-CD2 4.43Å; L99-Y103 HydrophobicContact CB-CE2 4.12Å; L99-Y103 HydrophobicContact CD2-CE2 4.49Å; L99-Y103 WeakPolarHBondContact O-CD2 3.31Å; L99-Y103 PolarHBondContact O-N 3.17Å |
| 100 | D | 92.8 | Very high | 87.2 | Confident | 67 Ų | 67 | 92.8 Ų | 92.8 | 36% | 0.358 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -64 | -40.3 | 174.2 | -78.9 | -53.5 | 0 | 0 | 0 | 112.4 | R96 K97 F102 Y103 E104 R143 | R96-D100 PolarHBondContact O-N 3.08Å; K97-D100 PolarHBondContact O-N 3.1Å; D100-F102 VanDerWaalsContact C-N 3.34Å; D100-F102 PolarHBondContact O-N 3.23Å; D100-Y103 PolarHBondContact O-N 3.43Å; D100-E104 WeakPolarHBondContact O-CB 3.47Å; D100-E104 PolarHBondContact O-N 3.43Å; D100-E104 VanDerWaalsContact O-N 3.14Å; D100-R143 IonicContact OD1-CZ 3.92Å; D100-R143 IonicContact OD1-NH1 2.73Å; D100-R143 PolarHBondContact OD1-NH1 3.48Å; D100-R143 IonicContact OD1-NH2 2.66Å; D100-R143 PolarHBondContact OD1-NH2 2.9Å; D100-R143 VanDerWaalsContact OD1-NH2 3.14Å; D100-R143 IonicContact OD2-CZ 3.69Å; D100-R143 IonicContact OD2-NH1 2.82Å; D100-R143 IonicContact OD2-NH2 3.73Å; D100-R143 PolarHBondContact OD2-NH2 3.03Å |
| 101 | R | 95.4 | Very high | 87 | Confident | 136 Ų | 136 | 92.1 Ų | 92.1 | 51% | 0.513 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -59.2 | -42.8 | 170.5 | -70.6 | -179.7 | -60.3 | -125.3 | 6.3 | 111.8 | K97 S98 E104 M105 | K97-R101 WeakPolarHBondContact O-CG 3.38Å; K97-R101 PolarHBondContact O-N 3.24Å; S98-R101 VanDerWaalsContact CB-NH2 3.32Å; S98-R101 PolarHBondContact O-N 2.95Å; S98-R101 PolarHBondContact OG-NH2 3.31Å; R101-E104 PolarHBondContact O-N 2.99Å; R101-M105 VanDerWaalsContact O-CB 3.3Å; R101-M105 WeakPolarHBondContact O-CB 3.49Å; R101-M105 PolarHBondContact O-N 3.14Å |
| 102 | F | 94.6 | Very high | 86.6 | Confident | 75 Ų | 75 | 91.1 Ų | 91.1 | 33% | 0.329 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -62.6 | -50.5 | 177.6 | 173.3 | -90.3 | 0 | 0 | 0 | 112.5 | S98 L99 D100 E104 M105 F106 M147 V150 | S98-F102 PolarHBondContact O-N 3.1Å; L99-F102 WeakPolarHBondContact O-CB 3.21Å; L99-F102 PolarHBondContact O-N 2.93Å; D100-F102 VanDerWaalsContact C-N 3.34Å; D100-F102 PolarHBondContact O-N 3.23Å; F102-E104 PolarHBondContact O-N 3.27Å; F102-M105 PolarHBondContact O-N 3.46Å; F102-F106 AromaticContact CD2-CD2 3.4Å; F102-F106 HydrophobicContact CD2-CD2 3.4Å; F102-F106 VanDerWaalsContact CD2-CD2 3.4Å; F102-F106 AromaticContact CD2-CE2 3.58Å; F102-F106 HydrophobicContact CD2-CE2 3.58Å; F102-F106 AromaticContact CE2-CD2 3.47Å; F102-F106 HydrophobicContact CE2-CD2 3.47Å; F102-F106 VanDerWaalsContact CE2-CD2 3.47Å; F102-F106 AromaticContact CE2-CE2 3.76Å; F102-F106 HydrophobicContact CE2-CE2 3.76Å; F102-F106 HydrophobicContact CE2-CG 4.3Å; F102-F106 HydrophobicContact CG-CD2 4.05Å; F102-F106 HydrophobicContact CZ-CD2 4.18Å; F102-F106 WeakPolarHBondContact O-CD2 3.28Å; F102-F106 PolarHBondContact O-N 3.31Å; F102-M147 HydrophobicContact CE1-CE 4.22Å; F102-V150 HydrophobicContact CE1-CG1 4.27Å; F102-V150 HydrophobicContact CE1-CG2 4.18Å; F102-V150 HydrophobicContact CZ-CG1 4.12Å |
| 103 | Y | 93.4 | Very high | 85.8 | Confident | 18 Ų | 18 | 91 Ų | 91 | 7% | 0.071 | 48% | 0.477 | C | S | . | . | H | α-helix | trans | -69.5 | -17 | -178.8 | -67.9 | -56.3 | 0 | 0 | 0 | 114.4 | L99 D100 G107 Q146 M147 R149 V150 | L99-Y103 HydrophobicContact CB-CD2 4.43Å; L99-Y103 HydrophobicContact CB-CE2 4.12Å; L99-Y103 HydrophobicContact CD2-CE2 4.49Å; L99-Y103 WeakPolarHBondContact O-CD2 3.31Å; L99-Y103 PolarHBondContact O-N 3.17Å; D100-Y103 PolarHBondContact O-N 3.43Å; Y103-G107 WeakPolarHBondContact O-CA 3.29Å; Y103-G107 PolarHBondContact O-N 3.48Å; Y103-Q146 HydrophobicContact CD1-CB 3.6Å; Y103-Q146 HydrophobicContact CD2-CB 4.2Å; Y103-Q146 HydrophobicContact CE1-CB 4.02Å; Y103-Q146 HydrophobicContact CG-CB 3.71Å; Y103-Q146 HydrophobicContact CG-CG 4.37Å; Y103-M147 HydrophobicContact CE1-CB 3.96Å; Y103-M147 HydrophobicContact CE1-CE 3.88Å; Y103-M147 HydrophobicContact CE1-SD 4.32Å; Y103-R149 PolarHBondContact O-NH2 3.45Å; Y103-V150 HydrophobicContact CD1-CG2 4.04Å |
| 104 | E | 92.9 | Very high | 84.6 | Confident | 98 Ų | 98 | 91.5 Ų | 91.5 | 46% | 0.458 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -84.3 | -51.4 | 169.4 | -164.5 | 57 | -150 | 0 | 0 | 110.7 | D100 R101 F102 F106 G107 H108 | D100-E104 WeakPolarHBondContact O-CB 3.47Å; D100-E104 PolarHBondContact O-N 3.43Å; D100-E104 VanDerWaalsContact O-N 3.14Å; R101-E104 PolarHBondContact O-N 2.99Å; F102-E104 PolarHBondContact O-N 3.27Å; E104-F106 PolarHBondContact O-N 3.48Å; E104-G107 PolarHBondContact O-N 2.93Å; E104-G107 VanDerWaalsContact O-N 3.17Å; E104-H108 PolarHBondContact O-CD2 3.23Å; E104-H108 PolarHBondContact O-NE2 2.97Å; E104-H108 IonicContact OE1-CD2 2.75Å; E104-H108 IonicContact OE1-CE1 2.63Å; E104-H108 PolarHBondContact OE1-CE1 2.94Å; E104-H108 IonicContact OE1-NE2 2.9Å; E104-H108 PolarHBondContact OE1-NE2 3.34Å |
| 105 | M | 91.1 | Very high | 83.9 | Confident | 143 Ų | 143 | 89.8 Ų | 89.8 | 70% | 0.704 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -58.1 | -48.8 | -178.5 | -170.7 | 67 | 70.6 | 0 | 0 | 113.2 | R101 F102 | R101-M105 VanDerWaalsContact O-CB 3.3Å; R101-M105 WeakPolarHBondContact O-CB 3.49Å; R101-M105 PolarHBondContact O-N 3.14Å; F102-M105 PolarHBondContact O-N 3.46Å |
| 106 | F | 89.3 | Confident | 83.4 | Confident | 113 Ų | 113 | 89.3 Ų | 89.3 | 50% | 0.496 | 49% | 0.49 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -94.2 | 2.4 | 179.3 | -56.7 | -77.7 | 0 | 0 | 0 | 112.8 | F102 E104 H108 V150 N153 | F102-F106 AromaticContact CD2-CD2 3.4Å; F102-F106 HydrophobicContact CD2-CD2 3.4Å; F102-F106 VanDerWaalsContact CD2-CD2 3.4Å; F102-F106 AromaticContact CD2-CE2 3.58Å; F102-F106 HydrophobicContact CD2-CE2 3.58Å; F102-F106 AromaticContact CE2-CD2 3.47Å; F102-F106 HydrophobicContact CE2-CD2 3.47Å; F102-F106 VanDerWaalsContact CE2-CD2 3.47Å; F102-F106 AromaticContact CE2-CE2 3.76Å; F102-F106 HydrophobicContact CE2-CE2 3.76Å; F102-F106 HydrophobicContact CE2-CG 4.3Å; F102-F106 HydrophobicContact CG-CD2 4.05Å; F102-F106 HydrophobicContact CZ-CD2 4.18Å; F102-F106 WeakPolarHBondContact O-CD2 3.28Å; F102-F106 PolarHBondContact O-N 3.31Å; E104-F106 PolarHBondContact O-N 3.48Å; F106-H108 VanDerWaalsContact C-N 3.3Å; F106-H108 PolarHBondContact O-N 2.99Å; F106-V150 HydrophobicContact CB-CB 4.49Å; F106-V150 HydrophobicContact CB-CG1 3.81Å; F106-V150 HydrophobicContact CB-CG2 4Å; F106-N153 PolarHBondContact O-ND2 3Å; F106-N153 VanDerWaalsContact O-ND2 3.1Å |
| 107 | G | 86.9 | Confident | 83 | Confident | 2 Ų | 2 | 86.2 Ų | 86.2 | 2% | 0.021 | 48% | 0.481 | C | S | . | . | S | Bend | trans | -77.8 | -10.4 | -178.2 | 0 | 0 | 0 | 0 | 0 | 115.1 | Y103 E104 R149 N153 | Y103-G107 WeakPolarHBondContact O-CA 3.29Å; Y103-G107 PolarHBondContact O-N 3.48Å; E104-G107 PolarHBondContact O-N 2.93Å; E104-G107 VanDerWaalsContact O-N 3.17Å; G107-R149 WeakPolarHBondContact O-CD 3.3Å; G107-R149 WeakPolarHBondContact O-CG 3.47Å; G107-R149 PolarHBondContact O-NE 3.46Å; G107-R149 PolarHBondContact O-NH1 3.29Å; G107-N153 PolarHBondContact O-ND2 3.38Å |
| 108 | H | 84.6 | Confident | 82.6 | Confident | 98 Ų | 98 | 81.7 Ų | 81.7 | 45% | 0.454 | 46% | 0.463 | S | S | . | . | S | Bend | trans | -108.1 | 146.1 | -178.3 | -58.7 | -62.8 | 0 | 0 | 0 | 111.7 | E104 F106 N153 | E104-H108 PolarHBondContact O-CD2 3.23Å; E104-H108 PolarHBondContact O-NE2 2.97Å; E104-H108 IonicContact OE1-CD2 2.75Å; E104-H108 IonicContact OE1-CE1 2.63Å; E104-H108 PolarHBondContact OE1-CE1 2.94Å; E104-H108 IonicContact OE1-NE2 2.9Å; E104-H108 PolarHBondContact OE1-NE2 3.34Å; F106-H108 VanDerWaalsContact C-N 3.3Å; F106-H108 PolarHBondContact O-N 2.99Å; H108-N153 VanDerWaalsContact C-ND2 3.34Å; H108-N153 PolarHBondContact N-ND2 3.12Å; H108-N153 PolarHBondContact O-ND2 2.84Å |
| 109 | P | 76 | Confident | 82.1 | Confident | 81 Ų | 81 | 81.4 Ų | 81.4 | 53% | 0.526 | 47% | 0.465 | S | S | . | . | trans | -62.7 | 141 | 176.3 | -21.6 | 33.1 | 0 | 0 | 0 | 112.1 | ||||
| 110 | Q | 72 | Confident | 81.9 | Confident | 148 Ų | 148 | 80.5 Ų | 80.5 | 69% | 0.692 | 47% | 0.465 | S | S | * | . | trans | -71.4 | 133.8 | 176.2 | -163.2 | 171.8 | 18.3 | 0 | 0 | 110.7 | G112 S113 | Q110-G112 PolarHBondContact O-N 2.9Å; Q110-S113 PolarHBondContact O-OG 3.34Å | ||
| 111 | P | 65.6 | Low | 81.7 | Confident | 132 Ų | 132 | 77.3 Ų | 77.3 | 86% | 0.857 | 45% | 0.448 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -61.3 | 112.3 | 179.2 | -24.9 | 34.9 | 0 | 0 | 0 | 112.1 | ||
| 112 | G | 63.8 | Low | 81.4 | Confident | 83 Ų | 83 | 71.2 Ų | 71.2 | 86% | 0.856 | 43% | 0.426 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 125.2 | -16.6 | 173.2 | 0 | 0 | 0 | 0 | 0 | 116.4 | Q110 | Q110-G112 PolarHBondContact O-N 2.9Š|
| 113 | S | 63.9 | Low | 81.2 | Confident | 73 Ų | 73 | 75.1 Ų | 75.1 | 51% | 0.51 | 44% | 0.443 | S | S | . | . | trans | -101.7 | 17.4 | -173.2 | 60.1 | 0 | 0 | 0 | 0 | 115.4 | Q110 N115 | Q110-S113 PolarHBondContact O-OG 3.34Å; S113-N115 PolarHBondContact O-N 3.36Å | ||
| 114 | A | 61.3 | Low | 81.1 | Confident | 85 Ų | 85 | 75 Ų | 75 | 70% | 0.702 | 44% | 0.444 | S | S | * | . | trans | -74.4 | 83 | -164.8 | 0 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 115 | N | 77.6 | Confident | 81.2 | Confident | 81 Ų | 81 | 70.3 Ų | 70.3 | 43% | 0.433 | 42% | 0.423 | S | S | . | . | trans | -65.8 | 133.5 | 160 | 176.3 | -33.8 | 0 | 0 | 0 | 109.5 | S113 V117 S118 A119 | S113-N115 PolarHBondContact O-N 3.36Å; N115-V117 VanDerWaalsContact C-N 3.27Å; N115-V117 PolarHBondContact O-N 2.85Å; N115-V117 WeakPolarHBondContact OD1-CB 3.47Å; N115-V117 PolarHBondContact OD1-N 3.31Å; N115-S118 PolarHBondContact O-N 3.22Å; N115-S118 PolarHBondContact O-OG 2.8Å; N115-S118 VanDerWaalsContact O-OG 3.1Å; N115-A119 PolarHBondContact O-N 3.29Å | ||
| 116 | P | 80.6 | Confident | 81.3 | Confident | 104 Ų | 104 | 65.4 Ų | 65.4 | 68% | 0.675 | 40% | 0.402 | S | S | * | . | H | α-helix | trans | -59.9 | -32.5 | -178.7 | 23.6 | -34.5 | 0 | 0 | 0 | 113.9 | S120 | P116-S120 WeakPolarHBondContact O-CB 3.21Å; P116-S120 PolarHBondContact O-N 2.93Å |
| 117 | V | 81.5 | Confident | 81.5 | Confident | 29 Ų | 29 | 66.6 Ų | 66.6 | 18% | 0.176 | 41% | 0.409 | C | S | . | . | H | α-helix | trans | -71.1 | -45.2 | 179.4 | -172.3 | 0 | 0 | 0 | 0 | 110.7 | N115 A119 S120 V121 L205 | N115-V117 VanDerWaalsContact C-N 3.27Å; N115-V117 PolarHBondContact O-N 2.85Å; N115-V117 WeakPolarHBondContact OD1-CB 3.47Å; N115-V117 PolarHBondContact OD1-N 3.31Å; V117-A119 VanDerWaalsContact C-N 3.35Å; V117-A119 PolarHBondContact O-N 2.66Å; V117-S120 WeakPolarHBondContact O-CB 3.01Å; V117-S120 PolarHBondContact O-N 3.23Å; V117-S120 VanDerWaalsContact O-N 3.15Å; V117-V121 WeakPolarHBondContact O-CG2 3.21Å; V117-V121 PolarHBondContact O-N 3.37Å; V117-L205 HydrophobicContact CG1-CD1 4.23Å |
| 118 | S | 83.2 | Confident | 81.8 | Confident | 15 Ų | 15 | 68.7 Ų | 68.7 | 11% | 0.105 | 42% | 0.418 | C | S | . | . | H | α-helix | trans | -67.9 | -35.1 | 176.7 | 62.7 | 0 | 0 | 0 | 0 | 112.1 | N115 S120 V121 C122 C157 | N115-S118 PolarHBondContact O-N 3.22Å; N115-S118 PolarHBondContact O-OG 2.8Å; N115-S118 VanDerWaalsContact O-OG 3.1Å; S118-S120 VanDerWaalsContact C-N 3.31Å; S118-S120 PolarHBondContact O-N 2.86Å; S118-V121 PolarHBondContact O-N 3.47Å; S118-C122 WeakPolarHBondContact O-CB 3.43Å; S118-C122 PolarHBondContact O-N 2.95Å; S118-C122 PolarHBondContact O-SG 2.56Å; S118-C157 VanDerWaalsContact CA-SG 3.57Å |
| 119 | A | 85.1 | Confident | 82.3 | Confident | 49 Ų | 49 | 64.2 Ų | 64.2 | 41% | 0.405 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -60.2 | -40.1 | 170.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | N115 V117 K123 | N115-A119 PolarHBondContact O-N 3.29Å; V117-A119 VanDerWaalsContact C-N 3.35Å; V117-A119 PolarHBondContact O-N 2.66Å; A119-K123 VanDerWaalsContact O-CB 3.28Å; A119-K123 WeakPolarHBondContact O-CB 3.3Å; A119-K123 PolarHBondContact O-N 3.01Å |
| 120 | S | 87.7 | Confident | 83.2 | Confident | 60 Ų | 60 | 64.5 Ų | 64.5 | 42% | 0.42 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -65.1 | -44.7 | 174.7 | -160.5 | 0 | 0 | 0 | 0 | 112.1 | P116 V117 S118 K123 C124 | P116-S120 WeakPolarHBondContact O-CB 3.21Å; P116-S120 PolarHBondContact O-N 2.93Å; V117-S120 WeakPolarHBondContact O-CB 3.01Å; V117-S120 PolarHBondContact O-N 3.23Å; V117-S120 VanDerWaalsContact O-N 3.15Å; S118-S120 VanDerWaalsContact C-N 3.31Å; S118-S120 PolarHBondContact O-N 2.86Å; S120-K123 PolarHBondContact O-N 3.33Å; S120-C124 WeakPolarHBondContact O-CB 3.45Å; S120-C124 PolarHBondContact O-N 2.91Å |
| 121 | V | 89.3 | Confident | 84.2 | Confident | 1 Ų | 1 | 63.5 Ų | 63.5 | 1% | 0.006 | 39% | 0.393 | C | S | . | . | H | α-helix | trans | -59.5 | -52.1 | 174.4 | 171.8 | 0 | 0 | 0 | 0 | 111.2 | V117 S118 K123 C124 L125 F152 L196 V201 | V117-V121 WeakPolarHBondContact O-CG2 3.21Å; V117-V121 PolarHBondContact O-N 3.37Å; S118-V121 PolarHBondContact O-N 3.47Å; V121-K123 VanDerWaalsContact C-N 3.3Å; V121-K123 PolarHBondContact O-N 2.73Å; V121-C124 WeakPolarHBondContact O-CB 3.46Å; V121-C124 PolarHBondContact O-N 3.02Å; V121-C124 VanDerWaalsContact O-N 3.12Å; V121-L125 HydrophobicContact CG1-CD1 3.69Å; V121-L125 HydrophobicContact CG1-CG 4.22Å; V121-L125 VanDerWaalsContact O-CG 3.3Å; V121-L125 WeakPolarHBondContact O-CG 3.44Å; V121-L125 PolarHBondContact O-N 3.03Å; V121-F152 HydrophobicContact CG1-CB 4.27Å; V121-F152 HydrophobicContact CG1-CD1 3.81Å; V121-F152 HydrophobicContact CG1-CD2 3.75Å; V121-F152 HydrophobicContact CG1-CE1 4.02Å; V121-F152 HydrophobicContact CG1-CE2 3.99Å; V121-F152 HydrophobicContact CG1-CG 3.67Å; V121-F152 HydrophobicContact CG1-CZ 4.12Å; V121-L196 HydrophobicContact CG1-CD1 3.95Å; V121-L196 HydrophobicContact CG1-CD2 4.03Å; V121-V201 HydrophobicContact CB-CG1 4.39Å; V121-V201 HydrophobicContact CG2-CB 4.36Å; V121-V201 HydrophobicContact CG2-CG1 3.6Å |
| 122 | C | 89.4 | Confident | 85.6 | Confident | 8 Ų | 8 | 57.8 Ų | 57.8 | 5% | 0.054 | 36% | 0.355 | C | S | . | . | H | α-helix | trans | -65.5 | -31 | -178.7 | -69.5 | 0 | 0 | 0 | 0 | 113 | S118 S126 N153 | S118-C122 WeakPolarHBondContact O-CB 3.43Å; S118-C122 PolarHBondContact O-N 2.95Å; S118-C122 PolarHBondContact O-SG 2.56Å; C122-S126 VanDerWaalsContact O-CB 3.28Å; C122-S126 WeakPolarHBondContact O-CB 3.34Å; C122-S126 PolarHBondContact O-N 3.12Å; C122-S126 PolarHBondContact O-OG 3.29Å; C122-N153 PolarHBondContact SG-OD1 3.09Å |
| 123 | K | 90.3 | Very high | 86.8 | Confident | 157 Ų | 157 | 61.5 Ų | 61.5 | 68% | 0.683 | 34% | 0.343 | S | S | * | . | H | α-helix | trans | -64.7 | -48.8 | 169.3 | -179.3 | -178 | 176.5 | -175.8 | 0 | 111.5 | A119 S120 V121 L125 S126 Q127 | A119-K123 VanDerWaalsContact O-CB 3.28Å; A119-K123 WeakPolarHBondContact O-CB 3.3Å; A119-K123 PolarHBondContact O-N 3.01Å; S120-K123 PolarHBondContact O-N 3.33Å; V121-K123 VanDerWaalsContact C-N 3.3Å; V121-K123 PolarHBondContact O-N 2.73Å; K123-L125 PolarHBondContact O-N 3.14Å; K123-S126 PolarHBondContact O-N 3.49Å; K123-Q127 PolarHBondContact O-N 3.27Å |
| 124 | C | 92.2 | Very high | 87.9 | Confident | 15 Ų | 15 | 61.8 Ų | 61.8 | 10% | 0.101 | 36% | 0.358 | C | S | . | . | H | α-helix | trans | -61.4 | -43.5 | 178.5 | -172 | 0 | 0 | 0 | 0 | 112.2 | S120 V121 Q127 K128 L196 V201 | S120-C124 WeakPolarHBondContact O-CB 3.45Å; S120-C124 PolarHBondContact O-N 2.91Å; V121-C124 WeakPolarHBondContact O-CB 3.46Å; V121-C124 PolarHBondContact O-N 3.02Å; V121-C124 VanDerWaalsContact O-N 3.12Å; C124-Q127 PolarHBondContact O-N 3.37Å; C124-K128 PolarHBondContact O-N 2.97Å; C124-K128 VanDerWaalsContact O-N 3.08Å; C124-L196 HydrophobicContact CB-CD2 4.49Å; C124-V201 HydrophobicContact CB-CG2 4.09Å |
| 125 | L | 93.2 | Very high | 89.2 | Confident | 0 Ų | 0 | 62.7 Ų | 62.7 | 0% | 0 | 35% | 0.347 | C | S | . | . | H | α-helix | trans | -63.3 | -42.9 | 174.6 | -66.3 | 170 | 0 | 0 | 0 | 111.3 | V121 K123 Q127 K128 I129 F145 A148 R149 F152 I192 L196 | V121-L125 HydrophobicContact CG1-CD1 3.69Å; V121-L125 HydrophobicContact CG1-CG 4.22Å; V121-L125 VanDerWaalsContact O-CG 3.3Å; V121-L125 WeakPolarHBondContact O-CG 3.44Å; V121-L125 PolarHBondContact O-N 3.03Å; K123-L125 PolarHBondContact O-N 3.14Å; L125-Q127 VanDerWaalsContact C-N 3.34Å; L125-Q127 PolarHBondContact O-N 2.91Å; L125-K128 PolarHBondContact O-N 3.29Å; L125-K128 VanDerWaalsContact O-N 3.08Å; L125-I129 VanDerWaalsContact O-CG1 3.28Å; L125-I129 WeakPolarHBondContact O-CG1 3.47Å; L125-I129 PolarHBondContact O-N 3.43Å; L125-F145 HydrophobicContact CD2-CD1 3.66Å; L125-F145 HydrophobicContact CD2-CE1 4.03Å; L125-A148 HydrophobicContact CD1-CB 4.35Å; L125-A148 HydrophobicContact CD2-CB 4.38Å; L125-R149 HydrophobicContact CB-CB 4.49Å; L125-R149 HydrophobicContact CD1-CB 4.49Å; L125-F152 HydrophobicContact CD1-CB 4.47Å; L125-F152 HydrophobicContact CD1-CD2 3.49Å; L125-F152 VanDerWaalsContact CD1-CD2 3.49Å; L125-F152 HydrophobicContact CD1-CE2 4.11Å; L125-F152 HydrophobicContact CD1-CG 4.27Å; L125-I192 HydrophobicContact CD2-CG2 4.01Å; L125-L196 HydrophobicContact CD2-CD1 4.35Å; L125-L196 HydrophobicContact CD2-CD2 4.09Å; L125-L196 HydrophobicContact CD2-CG 4.36Å; L125-L196 HydrophobicContact CG-CD2 4.25Å |
| 126 | S | 93.1 | Very high | 89.5 | Confident | 39 Ų | 39 | 65.3 Ų | 65.3 | 27% | 0.273 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -63.9 | -37.6 | 178.1 | -61.4 | 0 | 0 | 0 | 0 | 112.6 | C122 K123 K128 I129 T130 R149 | C122-S126 VanDerWaalsContact O-CB 3.28Å; C122-S126 WeakPolarHBondContact O-CB 3.34Å; C122-S126 PolarHBondContact O-N 3.12Å; C122-S126 PolarHBondContact O-OG 3.29Å; K123-S126 PolarHBondContact O-N 3.49Å; S126-K128 VanDerWaalsContact C-N 3.32Å; S126-I129 PolarHBondContact O-N 3.4Å; S126-T130 PolarHBondContact O-N 3.4Å; S126-T130 PolarHBondContact O-OG1 2.85Å; S126-R149 WeakPolarHBondContact OG-CD 3.49Å |
| 127 | Q | 93.9 | Very high | 89.8 | Confident | 138 Ų | 138 | 65.2 Ų | 65.2 | 65% | 0.645 | 36% | 0.359 | S | S | * | . | H | α-helix | trans | -64.9 | -34.5 | 171.7 | -176.8 | 176.2 | -11.6 | 0 | 0 | 112.4 | K123 C124 L125 T130 Q131 | K123-Q127 PolarHBondContact O-N 3.27Å; C124-Q127 PolarHBondContact O-N 3.37Å; L125-Q127 VanDerWaalsContact C-N 3.34Å; L125-Q127 PolarHBondContact O-N 2.91Å; Q127-T130 PolarHBondContact O-OG1 3.16Å; Q127-T130 VanDerWaalsContact O-OG1 3.06Å; Q127-Q131 PolarHBondContact O-N 3.27Å; Q127-Q131 VanDerWaalsContact O-N 3.15Å |
| 128 | K | 94.6 | Very high | 90.2 | Very high | 47 Ų | 47 | 67.5 Ų | 67.5 | 20% | 0.204 | 37% | 0.368 | C | S | . | . | H | α-helix | trans | -72.7 | -40.4 | 175.1 | -167.7 | 57.9 | 175.8 | -179.5 | 0 | 112.2 | C124 L125 S126 T130 Q131 L132 F145 F195 | C124-K128 PolarHBondContact O-N 2.97Å; C124-K128 VanDerWaalsContact O-N 3.08Å; L125-K128 PolarHBondContact O-N 3.29Å; L125-K128 VanDerWaalsContact O-N 3.08Å; S126-K128 VanDerWaalsContact C-N 3.32Å; K128-T130 VanDerWaalsContact C-N 3.33Å; K128-T130 PolarHBondContact O-N 2.92Å; K128-Q131 PolarHBondContact O-N 3.03Å; K128-L132 HydrophobicContact CG-CD1 4.2Å; K128-L132 WeakPolarHBondContact O-CG 3.17Å; K128-L132 PolarHBondContact O-N 2.94Å; K128-F145 HydrophobicContact CB-CD1 4.25Å; K128-F145 HydrophobicContact CB-CE1 4.37Å; K128-F145 HydrophobicContact CG-CD1 3.94Å; K128-F145 HydrophobicContact CG-CD2 3.93Å; K128-F145 HydrophobicContact CG-CE1 3.8Å; K128-F145 HydrophobicContact CG-CE2 3.79Å; K128-F145 HydrophobicContact CG-CG 4.03Å; K128-F145 HydrophobicContact CG-CZ 3.74Å; K128-F195 HydrophobicContact CB-CE1 4.02Å; K128-F195 HydrophobicContact CB-CE2 4.5Å; K128-F195 HydrophobicContact CB-CZ 3.75Å; K128-F195 HydrophobicContact CD-CE2 3.81Å; K128-F195 HydrophobicContact CD-CZ 3.92Å; K128-F195 HydrophobicContact CG-CE1 4.19Å; K128-F195 HydrophobicContact CG-CE2 4.14Å; K128-F195 HydrophobicContact CG-CZ 3.84Å |
| 129 | I | 94.3 | Very high | 90.6 | Very high | 4 Ų | 4 | 72.1 Ų | 72.1 | 2% | 0.021 | 39% | 0.386 | C | S | . | . | H | α-helix | trans | -59.5 | -42.1 | 174.2 | -70.2 | 163.8 | 0 | 0 | 0 | 111 | L125 S126 L132 R133 L142 F145 Q146 R149 | L125-I129 VanDerWaalsContact O-CG1 3.28Å; L125-I129 WeakPolarHBondContact O-CG1 3.47Å; L125-I129 PolarHBondContact O-N 3.43Å; S126-I129 PolarHBondContact O-N 3.4Å; I129-L132 PolarHBondContact O-N 3.3Å; I129-R133 PolarHBondContact O-N 3.44Å; I129-L142 HydrophobicContact CB-CD1 4.42Å; I129-L142 HydrophobicContact CG2-CD1 3.89Å; I129-F145 HydrophobicContact CG1-CB 3.83Å; I129-Q146 HydrophobicContact CD1-CG 4.15Å; I129-Q146 HydrophobicContact CG1-CG 4.27Å; I129-Q146 HydrophobicContact CG2-CG 4.27Å; I129-R149 HydrophobicContact CD1-CB 4.08Å |
| 130 | T | 94.2 | Very high | 90.9 | Very high | 87 Ų | 87 | 78.1 Ų | 78.1 | 53% | 0.534 | 40% | 0.399 | S | S | . | . | H | α-helix | trans | -70.8 | -33.6 | 176.2 | 51.1 | 0 | 0 | 0 | 0 | 112.9 | S126 Q127 K128 L132 R133 | S126-T130 PolarHBondContact O-N 3.4Å; S126-T130 PolarHBondContact O-OG1 2.85Å; Q127-T130 PolarHBondContact O-OG1 3.16Å; Q127-T130 VanDerWaalsContact O-OG1 3.06Å; K128-T130 VanDerWaalsContact C-N 3.33Å; K128-T130 PolarHBondContact O-N 2.92Å; T130-L132 VanDerWaalsContact C-N 3.33Å; T130-L132 PolarHBondContact O-N 3.15Å; T130-R133 WeakPolarHBondContact O-CB 3.31Å; T130-R133 PolarHBondContact O-N 2.86Å |
| 131 | Q | 94.3 | Very high | 91.2 | Very high | 126 Ų | 126 | 76.3 Ų | 76.3 | 59% | 0.589 | 39% | 0.388 | S | S | * | . | H | α-helix | trans | -63.5 | -36.8 | 171.6 | -171.1 | -174.4 | 40.7 | 0 | 0 | 112.7 | Q127 K128 R133 | Q127-Q131 PolarHBondContact O-N 3.27Å; Q127-Q131 VanDerWaalsContact O-N 3.15Å; K128-Q131 PolarHBondContact O-N 3.03Å; Q131-R133 VanDerWaalsContact C-N 3.34Å |
| 132 | L | 93.4 | Very high | 91.4 | Very high | 12 Ų | 12 | 77.8 Ų | 77.8 | 6% | 0.063 | 40% | 0.395 | C | S | . | . | H | α-helix | trans | -84.3 | -6.3 | -178.9 | -63 | 174.2 | 0 | 0 | 0 | 113.5 | K128 I129 T130 G134 Q135 Q138 A141 L142 F145 | K128-L132 HydrophobicContact CG-CD1 4.2Å; K128-L132 WeakPolarHBondContact O-CG 3.17Å; K128-L132 PolarHBondContact O-N 2.94Å; I129-L132 PolarHBondContact O-N 3.3Å; T130-L132 VanDerWaalsContact C-N 3.33Å; T130-L132 PolarHBondContact O-N 3.15Å; L132-G134 PolarHBondContact O-N 3.1Å; L132-Q135 WeakPolarHBondContact O-CB 3.27Å; L132-Q135 PolarHBondContact O-N 3.02Å; L132-Q138 HydrophobicContact CD2-CB 4.04Å; L132-Q138 HydrophobicContact CD2-CG 4.24Å; L132-A141 HydrophobicContact CD1-CB 4.14Å; L132-L142 HydrophobicContact CB-CB 4.16Å; L132-L142 HydrophobicContact CB-CD1 4.05Å; L132-F145 HydrophobicContact CD1-CD2 3.48Å; L132-F145 VanDerWaalsContact CD1-CD2 3.48Å; L132-F145 HydrophobicContact CD1-CE2 4.02Å; L132-F145 HydrophobicContact CD1-CG 4.36Å |
| 133 | R | 90.7 | Very high | 91.6 | Very high | 161 Ų | 161 | 80.2 Ų | 80.2 | 61% | 0.608 | 40% | 0.404 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -69.2 | 130.9 | 179 | -168.7 | -179.8 | -65.1 | -92.8 | 4.7 | 110.4 | I129 T130 Q131 Q135 | I129-R133 PolarHBondContact O-N 3.44Å; T130-R133 WeakPolarHBondContact O-CB 3.31Å; T130-R133 PolarHBondContact O-N 2.86Å; Q131-R133 VanDerWaalsContact C-N 3.34Å; R133-Q135 VanDerWaalsContact C-N 3.26Å; R133-Q135 PolarHBondContact O-N 3.48Å |
| 134 | G | 85.6 | Confident | 91.7 | Very high | 79 Ų | 79 | 73.6 Ų | 73.6 | 81% | 0.814 | 38% | 0.377 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 79.4 | -0.7 | -177.6 | 0 | 0 | 0 | 0 | 0 | 115 | L132 E136 | L132-G134 PolarHBondContact O-N 3.1Å; G134-E136 PolarHBondContact O-N 3.32Å |
| 135 | Q | 88.9 | Confident | 91.8 | Very high | 104 Ų | 104 | 73.6 Ų | 73.6 | 49% | 0.486 | 38% | 0.375 | S | S | . | . | trans | -86 | 92.1 | 172.6 | -67 | -93.5 | -64.4 | 0 | 0 | 109.5 | L132 R133 S137 Q138 | L132-Q135 WeakPolarHBondContact O-CB 3.27Å; L132-Q135 PolarHBondContact O-N 3.02Å; R133-Q135 VanDerWaalsContact C-N 3.26Å; R133-Q135 PolarHBondContact O-N 3.48Å; Q135-S137 PolarHBondContact O-N 3.47Å; Q135-S137 VanDerWaalsContact O-N 3.17Å; Q135-Q138 HydrophobicContact CB-CB 3.81Å; Q135-Q138 HydrophobicContact CB-CG 3.99Å; Q135-Q138 PolarHBondContact O-N 2.86Å | ||
| 136 | E | 83.2 | Confident | 91.9 | Very high | 137 Ų | 137 | 74.2 Ų | 74.2 | 64% | 0.64 | 38% | 0.378 | S | S | * | . | G | 310 helix | trans | -53.7 | -37.3 | -175.2 | -174.9 | 62.8 | -168.5 | 0 | 0 | 113.5 | G134 Q138 K139 | G134-E136 PolarHBondContact O-N 3.32Å; E136-Q138 VanDerWaalsContact C-N 3.3Å; E136-Q138 PolarHBondContact O-N 3.29Å; E136-K139 WeakPolarHBondContact O-CG 3.17Å; E136-K139 WeakPolarHBondContact OE1-CE 3.19Å; E136-K139 IonicContact OE1-NZ 2.72Å; E136-K139 PolarHBondContact OE1-NZ 3.16Å; E136-K139 WeakPolarHBondContact OE2-CE 3.14Å; E136-K139 IonicContact OE2-NZ 3.68Å; E136-K139 PolarHBondContact OE2-NZ 3.09Å |
| 137 | S | 88.7 | Confident | 92 | Very high | 102 Ų | 102 | 75.1 Ų | 75.1 | 71% | 0.713 | 38% | 0.379 | S | S | * | . | G | 310 helix | trans | -74.9 | -11.2 | 177.3 | 55.3 | 0 | 0 | 0 | 0 | 114.9 | Q135 | Q135-S137 PolarHBondContact O-N 3.47Å; Q135-S137 VanDerWaalsContact O-N 3.17Å |
| 138 | Q | 90.1 | Very high | 91.9 | Very high | 77 Ų | 77 | 68.6 Ų | 68.6 | 36% | 0.36 | 35% | 0.348 | S | S | . | . | G | 310 helix | trans | -109.6 | 16.1 | -174.6 | -64.2 | -64.6 | -31.3 | 0 | 0 | 113.2 | L132 Q135 E136 Y140 A141 L142 | L132-Q138 HydrophobicContact CD2-CB 4.04Å; L132-Q138 HydrophobicContact CD2-CG 4.24Å; Q135-Q138 HydrophobicContact CB-CB 3.81Å; Q135-Q138 HydrophobicContact CB-CG 3.99Å; Q135-Q138 PolarHBondContact O-N 2.86Å; E136-Q138 VanDerWaalsContact C-N 3.3Å; E136-Q138 PolarHBondContact O-N 3.29Å; Q138-Y140 VanDerWaalsContact C-N 3.28Å; Q138-Y140 PolarHBondContact O-N 3.49Å; Q138-A141 PolarHBondContact O-N 3.28Å; Q138-A141 VanDerWaalsContact O-N 3.15Å; Q138-L142 WeakPolarHBondContact O-CB 3.24Å; Q138-L142 PolarHBondContact O-N 3.49Å |
| 139 | K | 90.9 | Very high | 91.8 | Very high | 112 Ų | 112 | 67.4 Ų | 67.4 | 49% | 0.487 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -51.1 | -41.7 | 179 | -80.7 | 174.3 | 169 | 172.6 | 0 | 113.8 | E136 R143 | E136-K139 WeakPolarHBondContact O-CG 3.17Å; E136-K139 WeakPolarHBondContact OE1-CE 3.19Å; E136-K139 IonicContact OE1-NZ 2.72Å; E136-K139 PolarHBondContact OE1-NZ 3.16Å; E136-K139 WeakPolarHBondContact OE2-CE 3.14Å; E136-K139 IonicContact OE2-NZ 3.68Å; E136-K139 PolarHBondContact OE2-NZ 3.09Å; K139-R143 VanDerWaalsContact O-CG 3.29Å; K139-R143 WeakPolarHBondContact O-CG 3.16Å; K139-R143 PolarHBondContact O-N 2.93Å; K139-R143 VanDerWaalsContact O-N 3.1Å |
| 140 | Y | 91.6 | Very high | 91.8 | Very high | 175 Ų | 175 | 67.9 Ų | 67.9 | 69% | 0.686 | 35% | 0.346 | S | S | * | . | H | α-helix | trans | -62.7 | -55.1 | 176 | 179.4 | -96.4 | 0 | 0 | 0 | 111.5 | Q138 L142 R143 S144 | Q138-Y140 VanDerWaalsContact C-N 3.28Å; Q138-Y140 PolarHBondContact O-N 3.49Å; Y140-L142 VanDerWaalsContact C-N 3.31Å; Y140-L142 PolarHBondContact O-N 3.37Å; Y140-R143 WeakPolarHBondContact O-CB 3.37Å; Y140-R143 PolarHBondContact O-N 3.2Å; Y140-R143 VanDerWaalsContact O-N 3.08Å; Y140-S144 PolarHBondContact O-N 3.36Å; Y140-S144 PolarHBondContact O-OG 3.1Å |
| 141 | A | 93.3 | Very high | 91.6 | Very high | 22 Ų | 22 | 64.4 Ų | 64.4 | 18% | 0.182 | 32% | 0.324 | C | S | . | . | H | α-helix | trans | -57.5 | -43 | 179.4 | 0 | 0 | 0 | 0 | 0 | 112 | L132 Q138 R143 S144 F145 | L132-A141 HydrophobicContact CD1-CB 4.14Å; Q138-A141 PolarHBondContact O-N 3.28Å; Q138-A141 VanDerWaalsContact O-N 3.15Å; A141-R143 VanDerWaalsContact C-N 3.35Å; A141-R143 PolarHBondContact O-N 3Å; A141-S144 PolarHBondContact O-N 3.48Å; A141-F145 WeakPolarHBondContact O-CD2 3.37Å; A141-F145 PolarHBondContact O-N 3.34Å |
| 142 | L | 93.9 | Very high | 91.3 | Very high | 31 Ų | 31 | 58.5 Ų | 58.5 | 16% | 0.162 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -55.4 | -47.9 | 174.8 | 175.8 | 61.8 | 0 | 0 | 0 | 111.6 | I129 L132 Q138 Y140 F145 Q146 | I129-L142 HydrophobicContact CB-CD1 4.42Å; I129-L142 HydrophobicContact CG2-CD1 3.89Å; L132-L142 HydrophobicContact CB-CB 4.16Å; L132-L142 HydrophobicContact CB-CD1 4.05Å; Q138-L142 WeakPolarHBondContact O-CB 3.24Å; Q138-L142 PolarHBondContact O-N 3.49Å; Y140-L142 VanDerWaalsContact C-N 3.31Å; Y140-L142 PolarHBondContact O-N 3.37Å; L142-F145 PolarHBondContact O-N 3.16Å; L142-Q146 HydrophobicContact CD1-CG 4.46Å; L142-Q146 VanDerWaalsContact O-CG 3.31Å; L142-Q146 WeakPolarHBondContact O-CG 3.5Å; L142-Q146 PolarHBondContact O-N 3.19Å |
| 143 | R | 93.1 | Very high | 91.1 | Very high | 60 Ų | 60 | 59 Ų | 59 | 23% | 0.226 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -64.2 | -41.5 | 177.2 | -71.1 | -74.8 | -176.2 | -128.3 | 9 | 112 | D100 K139 Y140 A141 Q146 M147 | D100-R143 IonicContact OD1-CZ 3.92Å; D100-R143 IonicContact OD1-NH1 2.73Å; D100-R143 PolarHBondContact OD1-NH1 3.48Å; D100-R143 IonicContact OD1-NH2 2.66Å; D100-R143 PolarHBondContact OD1-NH2 2.9Å; D100-R143 VanDerWaalsContact OD1-NH2 3.14Å; D100-R143 IonicContact OD2-CZ 3.69Å; D100-R143 IonicContact OD2-NH1 2.82Å; D100-R143 IonicContact OD2-NH2 3.73Å; D100-R143 PolarHBondContact OD2-NH2 3.03Å; K139-R143 VanDerWaalsContact O-CG 3.29Å; K139-R143 WeakPolarHBondContact O-CG 3.16Å; K139-R143 PolarHBondContact O-N 2.93Å; K139-R143 VanDerWaalsContact O-N 3.1Å; Y140-R143 WeakPolarHBondContact O-CB 3.37Å; Y140-R143 PolarHBondContact O-N 3.2Å; Y140-R143 VanDerWaalsContact O-N 3.08Å; A141-R143 VanDerWaalsContact C-N 3.35Å; A141-R143 PolarHBondContact O-N 3Å; R143-Q146 PolarHBondContact O-N 2.99Å; R143-M147 PolarHBondContact O-N 2.91Å |
| 144 | S | 93.1 | Very high | 90.9 | Very high | 18 Ų | 18 | 60.1 Ų | 60.1 | 13% | 0.126 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -61.9 | -45.1 | 175.3 | -52.7 | 0 | 0 | 0 | 0 | 111.7 | Y140 A141 Q146 M147 A148 I192 | Y140-S144 PolarHBondContact O-N 3.36Å; Y140-S144 PolarHBondContact O-OG 3.1Å; A141-S144 PolarHBondContact O-N 3.48Å; S144-Q146 PolarHBondContact O-N 3.38Å; S144-M147 PolarHBondContact O-N 3.27Å; S144-A148 PolarHBondContact O-N 3.14Å; S144-I192 VanDerWaalsContact C-CD1 3.4Å; S144-I192 WeakPolarHBondContact O-CD1 3.44Å |
| 145 | F | 94.3 | Very high | 90.8 | Very high | 14 Ų | 14 | 57.9 Ų | 57.9 | 6% | 0.061 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -65.3 | -36.6 | 176.1 | -83 | -70 | 0 | 0 | 0 | 112.7 | L125 K128 I129 L132 A141 L142 R149 I192 F195 | L125-F145 HydrophobicContact CD2-CD1 3.66Å; L125-F145 HydrophobicContact CD2-CE1 4.03Å; K128-F145 HydrophobicContact CB-CD1 4.25Å; K128-F145 HydrophobicContact CB-CE1 4.37Å; K128-F145 HydrophobicContact CG-CD1 3.94Å; K128-F145 HydrophobicContact CG-CD2 3.93Å; K128-F145 HydrophobicContact CG-CE1 3.8Å; K128-F145 HydrophobicContact CG-CE2 3.79Å; K128-F145 HydrophobicContact CG-CG 4.03Å; K128-F145 HydrophobicContact CG-CZ 3.74Å; I129-F145 HydrophobicContact CG1-CB 3.83Å; L132-F145 HydrophobicContact CD1-CD2 3.48Å; L132-F145 VanDerWaalsContact CD1-CD2 3.48Å; L132-F145 HydrophobicContact CD1-CE2 4.02Å; L132-F145 HydrophobicContact CD1-CG 4.36Å; A141-F145 WeakPolarHBondContact O-CD2 3.37Å; A141-F145 PolarHBondContact O-N 3.34Å; L142-F145 PolarHBondContact O-N 3.16Å; F145-R149 PolarHBondContact O-N 2.88Å; F145-R149 VanDerWaalsContact O-N 3.09Å; F145-I192 HydrophobicContact CD1-CD1 4.33Å; F145-I192 HydrophobicContact CD1-CG1 4.13Å; F145-I192 HydrophobicContact CD1-CG2 4.41Å; F145-I192 HydrophobicContact CE1-CB 4.36Å; F145-I192 HydrophobicContact CE1-CG1 3.88Å; F145-I192 HydrophobicContact CE1-CG2 4.14Å; F145-I192 HydrophobicContact CZ-CG1 4.08Å; F145-F195 HydrophobicContact CE1-CB 4.34Å; F145-F195 AromaticContact CE1-CD1 3.51Å; F145-F195 HydrophobicContact CE1-CD1 3.51Å; F145-F195 AromaticContact CE1-CE1 3.96Å; F145-F195 HydrophobicContact CE1-CE1 3.96Å; F145-F195 AromaticContact CE1-CG 3.97Å; F145-F195 HydrophobicContact CE1-CG 3.97Å; F145-F195 HydrophobicContact CZ-CB 4.1Å; F145-F195 AromaticContact CZ-CD1 3.97Å; F145-F195 HydrophobicContact CZ-CD1 3.97Å; F145-F195 HydrophobicContact CZ-CD2 4.49Å; F145-F195 AromaticContact CZ-CG 3.92Å; F145-F195 HydrophobicContact CZ-CG 3.92Å |
| 146 | Q | 94.4 | Very high | 90.7 | Very high | 13 Ų | 13 | 53.8 Ų | 53.8 | 6% | 0.061 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -63.1 | -44.9 | 171.8 | -74.4 | 176.3 | -58.2 | 0 | 0 | 112.1 | Y103 I129 L142 R143 S144 R149 V150 | Y103-Q146 HydrophobicContact CD1-CB 3.6Å; Y103-Q146 HydrophobicContact CD2-CB 4.2Å; Y103-Q146 HydrophobicContact CE1-CB 4.02Å; Y103-Q146 HydrophobicContact CG-CB 3.71Å; Y103-Q146 HydrophobicContact CG-CG 4.37Å; I129-Q146 HydrophobicContact CD1-CG 4.15Å; I129-Q146 HydrophobicContact CG1-CG 4.27Å; I129-Q146 HydrophobicContact CG2-CG 4.27Å; L142-Q146 HydrophobicContact CD1-CG 4.46Å; L142-Q146 VanDerWaalsContact O-CG 3.31Å; L142-Q146 WeakPolarHBondContact O-CG 3.5Å; L142-Q146 PolarHBondContact O-N 3.19Å; R143-Q146 PolarHBondContact O-N 2.99Å; S144-Q146 PolarHBondContact O-N 3.38Å; Q146-R149 WeakPolarHBondContact O-CB 3.42Å; Q146-R149 PolarHBondContact O-N 3.38Å; Q146-V150 PolarHBondContact O-N 3.32Å |
| 147 | M | 94.8 | Very high | 90.7 | Very high | 59 Ų | 59 | 47.7 Ų | 47.7 | 29% | 0.291 | 23% | 0.231 | S | C | . | . | H | α-helix | trans | -63.7 | -43.1 | 177 | -176.5 | 57.5 | 78.8 | 0 | 0 | 111.9 | F102 Y103 R143 S144 R149 V150 I151 | F102-M147 HydrophobicContact CE1-CE 4.22Å; Y103-M147 HydrophobicContact CE1-CB 3.96Å; Y103-M147 HydrophobicContact CE1-CE 3.88Å; Y103-M147 HydrophobicContact CE1-SD 4.32Å; R143-M147 PolarHBondContact O-N 2.91Å; S144-M147 PolarHBondContact O-N 3.27Å; M147-R149 VanDerWaalsContact C-N 3.31Å; M147-R149 PolarHBondContact O-N 2.97Å; M147-V150 WeakPolarHBondContact O-CB 3.49Å; M147-V150 PolarHBondContact O-N 3.04Å; M147-V150 VanDerWaalsContact O-N 3.16Å; M147-I151 HydrophobicContact CG-CD1 3.99Å; M147-I151 WeakPolarHBondContact O-CG1 3.35Å; M147-I151 PolarHBondContact O-N 3.06Å; M147-I151 HydrophobicContact SD-CD1 4.45Å |
| 148 | A | 93.4 | Very high | 90.3 | Very high | 0 Ų | 0 | 45.9 Ų | 45.9 | 0% | 0 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -58.6 | -42.5 | 174 | 0 | 0 | 0 | 0 | 0 | 112.2 | L125 S144 V150 I151 F152 L188 I192 | L125-A148 HydrophobicContact CD1-CB 4.35Å; L125-A148 HydrophobicContact CD2-CB 4.38Å; S144-A148 PolarHBondContact O-N 3.14Å; A148-V150 VanDerWaalsContact C-N 3.31Å; A148-V150 PolarHBondContact O-N 3.16Å; A148-I151 PolarHBondContact O-N 3.36Å; A148-I151 VanDerWaalsContact O-N 3.14Å; A148-F152 HydrophobicContact CB-CD2 4.38Å; A148-F152 HydrophobicContact CB-CE2 4.43Å; A148-F152 WeakPolarHBondContact O-CD2 3.48Å; A148-F152 PolarHBondContact O-N 3.11Å; A148-L188 HydrophobicContact CB-CD2 3.46Å; A148-L188 VanDerWaalsContact CB-CD2 3.46Å; A148-I192 HydrophobicContact CB-CD1 3.68Å; A148-I192 HydrophobicContact CB-CG2 3.8Å |
| 149 | R | 92.7 | Very high | 89.8 | Confident | 22 Ų | 22 | 42.3 Ų | 42.3 | 8% | 0.083 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -57.6 | -43.2 | 175.7 | -173.9 | 176.2 | 70.1 | 152 | 7.8 | 111.8 | Y103 G107 L125 S126 I129 F145 Q146 M147 F152 N153 | Y103-R149 PolarHBondContact O-NH2 3.45Å; G107-R149 WeakPolarHBondContact O-CD 3.3Å; G107-R149 WeakPolarHBondContact O-CG 3.47Å; G107-R149 PolarHBondContact O-NE 3.46Å; G107-R149 PolarHBondContact O-NH1 3.29Å; L125-R149 HydrophobicContact CB-CB 4.49Å; L125-R149 HydrophobicContact CD1-CB 4.49Å; S126-R149 WeakPolarHBondContact OG-CD 3.49Å; I129-R149 HydrophobicContact CD1-CB 4.08Å; F145-R149 PolarHBondContact O-N 2.88Å; F145-R149 VanDerWaalsContact O-N 3.09Å; Q146-R149 WeakPolarHBondContact O-CB 3.42Å; Q146-R149 PolarHBondContact O-N 3.38Å; M147-R149 VanDerWaalsContact C-N 3.31Å; M147-R149 PolarHBondContact O-N 2.97Å; R149-F152 PolarHBondContact O-N 2.93Å; R149-N153 WeakPolarHBondContact O-CB 3.41Å; R149-N153 PolarHBondContact O-N 2.99Å; R149-N153 PolarHBondContact O-ND2 3.25Å |
| 150 | V | 92.8 | Very high | 89.1 | Confident | 15 Ų | 15 | 38.4 Ų | 38.4 | 9% | 0.091 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -60.7 | -46.6 | 174.5 | 173.6 | 0 | 0 | 0 | 0 | 111.4 | F102 Y103 F106 Q146 M147 A148 N153 R154 | F102-V150 HydrophobicContact CE1-CG1 4.27Å; F102-V150 HydrophobicContact CE1-CG2 4.18Å; F102-V150 HydrophobicContact CZ-CG1 4.12Å; Y103-V150 HydrophobicContact CD1-CG2 4.04Å; F106-V150 HydrophobicContact CB-CB 4.49Å; F106-V150 HydrophobicContact CB-CG1 3.81Å; F106-V150 HydrophobicContact CB-CG2 4Å; Q146-V150 PolarHBondContact O-N 3.32Å; M147-V150 WeakPolarHBondContact O-CB 3.49Å; M147-V150 PolarHBondContact O-N 3.04Å; M147-V150 VanDerWaalsContact O-N 3.16Å; A148-V150 VanDerWaalsContact C-N 3.31Å; A148-V150 PolarHBondContact O-N 3.16Å; V150-N153 PolarHBondContact O-N 2.9Å; V150-R154 PolarHBondContact O-N 3.12Å; V150-R154 VanDerWaalsContact O-N 3.12Å |
| 151 | I | 90.9 | Very high | 88.1 | Confident | 13 Ų | 13 | 35.2 Ų | 35.2 | 7% | 0.067 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -62.1 | -46 | 179.5 | -66.5 | 166.6 | 0 | 0 | 0 | 111.2 | M147 A148 N153 R154 D155 V159 G187 L188 | M147-I151 HydrophobicContact CG-CD1 3.99Å; M147-I151 WeakPolarHBondContact O-CG1 3.35Å; M147-I151 PolarHBondContact O-N 3.06Å; M147-I151 HydrophobicContact SD-CD1 4.45Å; A148-I151 PolarHBondContact O-N 3.36Å; A148-I151 VanDerWaalsContact O-N 3.14Å; I151-N153 PolarHBondContact O-N 3.34Å; I151-R154 PolarHBondContact O-N 3.24Å; I151-D155 WeakPolarHBondContact O-CB 3.18Å; I151-D155 PolarHBondContact O-N 3.22Å; I151-V159 HydrophobicContact CG2-CB 4.3Å; I151-V159 HydrophobicContact CG2-CG1 4.29Å; I151-V159 HydrophobicContact CG2-CG2 3.88Å; I151-G187 VanDerWaalsContact CD1-C 3.5Å; I151-G187 WeakPolarHBondContact CD1-O 3.46Å; I151-L188 HydrophobicContact CB-CD2 4.43Å; I151-L188 HydrophobicContact CD1-CD2 4Å; I151-L188 HydrophobicContact CD1-CG 4.09Å; I151-L188 HydrophobicContact CG2-CD1 4.42Å; I151-L188 HydrophobicContact CG2-CD2 4.43Å; I151-L188 HydrophobicContact CG2-CG 4.37Å |
| 152 | F | 88.6 | Confident | 86.6 | Confident | 2 Ų | 2 | 39.3 Ų | 39.3 | 1% | 0.009 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -69.8 | -28.4 | 178.7 | -77.7 | -70.3 | 0 | 0 | 0 | 113.8 | V121 L125 A148 R149 G156 V159 L160 L188 L196 | V121-F152 HydrophobicContact CG1-CB 4.27Å; V121-F152 HydrophobicContact CG1-CD1 3.81Å; V121-F152 HydrophobicContact CG1-CD2 3.75Å; V121-F152 HydrophobicContact CG1-CE1 4.02Å; V121-F152 HydrophobicContact CG1-CE2 3.99Å; V121-F152 HydrophobicContact CG1-CG 3.67Å; V121-F152 HydrophobicContact CG1-CZ 4.12Å; L125-F152 HydrophobicContact CD1-CB 4.47Å; L125-F152 HydrophobicContact CD1-CD2 3.49Å; L125-F152 VanDerWaalsContact CD1-CD2 3.49Å; L125-F152 HydrophobicContact CD1-CE2 4.11Å; L125-F152 HydrophobicContact CD1-CG 4.27Å; A148-F152 HydrophobicContact CB-CD2 4.38Å; A148-F152 HydrophobicContact CB-CE2 4.43Å; A148-F152 WeakPolarHBondContact O-CD2 3.48Å; A148-F152 PolarHBondContact O-N 3.11Å; R149-F152 PolarHBondContact O-N 2.93Å; F152-G156 WeakPolarHBondContact CD1-O 3.43Å; F152-G156 WeakPolarHBondContact O-CA 3.45Å; F152-G156 PolarHBondContact O-N 3.39Å; F152-G156 VanDerWaalsContact O-N 3.12Å; F152-V159 HydrophobicContact CD1-CG1 3.85Å; F152-V159 HydrophobicContact CE1-CG1 3.46Å; F152-V159 VanDerWaalsContact CE1-CG1 3.46Å; F152-V159 HydrophobicContact CZ-CG1 3.98Å; F152-L160 HydrophobicContact CE1-CD1 3.65Å; F152-L160 HydrophobicContact CE1-CD2 4.42Å; F152-L160 HydrophobicContact CE1-CG 3.76Å; F152-L160 HydrophobicContact CZ-CD1 3.87Å; F152-L160 HydrophobicContact CZ-CD2 4Å; F152-L160 HydrophobicContact CZ-CG 3.86Å; F152-L188 HydrophobicContact CE2-CD1 4.3Å; F152-L188 HydrophobicContact CE2-CD2 4Å; F152-L188 HydrophobicContact CZ-CD1 4.21Å; F152-L196 HydrophobicContact CE2-CD1 3.67Å; F152-L196 HydrophobicContact CZ-CD1 3.75Å |
| 153 | N | 88.1 | Confident | 84.7 | Confident | 22 Ų | 22 | 43.5 Ų | 43.5 | 12% | 0.118 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -69.6 | -34.2 | 171.5 | -70.9 | -24.5 | 0 | 0 | 0 | 112.5 | F106 G107 H108 C122 R149 V150 I151 | F106-N153 PolarHBondContact O-ND2 3Å; F106-N153 VanDerWaalsContact O-ND2 3.1Å; G107-N153 PolarHBondContact O-ND2 3.38Å; H108-N153 VanDerWaalsContact C-ND2 3.34Å; H108-N153 PolarHBondContact N-ND2 3.12Å; H108-N153 PolarHBondContact O-ND2 2.84Å; C122-N153 PolarHBondContact SG-OD1 3.09Å; R149-N153 WeakPolarHBondContact O-CB 3.41Å; R149-N153 PolarHBondContact O-N 2.99Å; R149-N153 PolarHBondContact O-ND2 3.25Å; V150-N153 PolarHBondContact O-N 2.9Å; I151-N153 PolarHBondContact O-N 3.34Å |
| 154 | R | 86.7 | Confident | 82.7 | Confident | 185 Ų | 185 | 42.6 Ų | 42.6 | 70% | 0.698 | 21% | 0.209 | S | C | * | . | H | α-helix | trans | -86.3 | -48.6 | -176.6 | -166.1 | -165.4 | 70.7 | -168.1 | -4.2 | 113 | V150 I151 | V150-R154 PolarHBondContact O-N 3.12Å; V150-R154 VanDerWaalsContact O-N 3.12Å; I151-R154 PolarHBondContact O-N 3.24Å |
| 155 | D | 84.6 | Confident | 80.7 | Confident | 32 Ų | 32 | 49.8 Ų | 49.8 | 17% | 0.171 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -98.8 | -8.3 | -173.1 | -63.9 | 1.9 | 0 | 0 | 0 | 112.6 | I151 S158 V159 R162 | I151-D155 WeakPolarHBondContact O-CB 3.18Å; I151-D155 PolarHBondContact O-N 3.22Å; D155-S158 WeakPolarHBondContact O-CB 3.49Å; D155-S158 PolarHBondContact O-OG 2.81Å; D155-V159 HydrophobicContact CB-CB 4.22Å; D155-R162 IonicContact OD2-CZ 3.31Å; D155-R162 IonicContact OD2-NH1 2.9Å; D155-R162 IonicContact OD2-NH2 3.45Å; D155-R162 PolarHBondContact OD2-NH2 3.14Å |
| 156 | G | 85.6 | Confident | 78.6 | Confident | 19 Ų | 19 | 53 Ų | 53 | 20% | 0.196 | 26% | 0.256 | C | S | . | . | G | 310 helix | trans | 61 | -157.8 | -168.4 | 0 | 0 | 0 | 0 | 0 | 112 | F152 S158 V159 | F152-G156 WeakPolarHBondContact CD1-O 3.43Å; F152-G156 WeakPolarHBondContact O-CA 3.45Å; F152-G156 PolarHBondContact O-N 3.39Å; F152-G156 VanDerWaalsContact O-N 3.12Å; G156-S158 PolarHBondContact O-N 3.27Å; G156-V159 WeakPolarHBondContact O-CG1 3.31Å |
| 157 | C | 83.8 | Confident | 76.6 | Confident | 9 Ų | 9 | 57.9 Ų | 57.9 | 6% | 0.061 | 29% | 0.287 | C | S | . | . | G | 310 helix | trans | -75.1 | -4.6 | 173.4 | -62.7 | 0 | 0 | 0 | 0 | 113.6 | S118 V159 L160 L205 | S118-C157 VanDerWaalsContact CA-SG 3.57Å; C157-V159 PolarHBondContact O-N 3.1Å; C157-V159 VanDerWaalsContact O-N 3.14Å; C157-L160 WeakPolarHBondContact O-CB 3.38Å; C157-L160 PolarHBondContact O-N 2.96Å; C157-L205 HydrophobicContact CB-CD1 3.62Å; C157-L205 HydrophobicContact CB-CD2 4.49Å |
| 158 | S | 79.8 | Confident | 74.7 | Confident | 64 Ų | 64 | 60 Ų | 60 | 45% | 0.448 | 30% | 0.296 | S | S | . | . | G | 310 helix | trans | -59.9 | -26.5 | 179.2 | 77.1 | 0 | 0 | 0 | 0 | 112.8 | D155 G156 L160 Q161 R162 | D155-S158 WeakPolarHBondContact O-CB 3.49Å; D155-S158 PolarHBondContact O-OG 2.81Å; G156-S158 PolarHBondContact O-N 3.27Å; S158-L160 VanDerWaalsContact C-N 3.27Å; S158-L160 PolarHBondContact O-N 3.28Å; S158-Q161 PolarHBondContact O-N 2.79Å; S158-R162 PolarHBondContact O-N 3.27Å |
| 159 | V | 79.3 | Confident | 72.9 | Confident | 1 Ų | 1 | 70.2 Ų | 70.2 | 1% | 0.006 | 34% | 0.341 | C | S | . | . | G | 310 helix | trans | -55.2 | -40.6 | 171.6 | 66 | 0 | 0 | 0 | 0 | 112.1 | I151 F152 D155 G156 C157 R162 N185 L188 | I151-V159 HydrophobicContact CG2-CB 4.3Å; I151-V159 HydrophobicContact CG2-CG1 4.29Å; I151-V159 HydrophobicContact CG2-CG2 3.88Å; F152-V159 HydrophobicContact CD1-CG1 3.85Å; F152-V159 HydrophobicContact CE1-CG1 3.46Å; F152-V159 VanDerWaalsContact CE1-CG1 3.46Å; F152-V159 HydrophobicContact CZ-CG1 3.98Å; D155-V159 HydrophobicContact CB-CB 4.22Å; G156-V159 WeakPolarHBondContact O-CG1 3.31Å; C157-V159 PolarHBondContact O-N 3.1Å; C157-V159 VanDerWaalsContact O-N 3.14Å; V159-R162 VanDerWaalsContact O-CB 3.25Å; V159-R162 WeakPolarHBondContact O-CB 3.47Å; V159-R162 PolarHBondContact O-N 3.2Å; V159-N185 HydrophobicContact CG2-CB 3.97Å; V159-N185 VanDerWaalsContact CG2-OD1 3.31Å; V159-N185 WeakPolarHBondContact CG2-OD1 3.47Å; V159-N185 VanDerWaalsContact O-CG 3.32Å; V159-N185 PolarHBondContact O-ND2 3.45Å; V159-N185 PolarHBondContact O-OD1 3.36Å; V159-L188 HydrophobicContact CG1-CD1 4.03Å; V159-L188 HydrophobicContact CG2-CD1 3.59Å |
| 160 | L | 77.2 | Confident | 70.9 | Confident | 30 Ų | 30 | 78.3 Ų | 78.3 | 16% | 0.157 | 37% | 0.373 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -71.4 | -32.9 | 179.9 | -66.5 | 167.9 | 0 | 0 | 0 | 112.2 | F152 C157 S158 R162 I193 M202 L205 | F152-L160 HydrophobicContact CE1-CD1 3.65Å; F152-L160 HydrophobicContact CE1-CD2 4.42Å; F152-L160 HydrophobicContact CE1-CG 3.76Å; F152-L160 HydrophobicContact CZ-CD1 3.87Å; F152-L160 HydrophobicContact CZ-CD2 4Å; F152-L160 HydrophobicContact CZ-CG 3.86Å; C157-L160 WeakPolarHBondContact O-CB 3.38Å; C157-L160 PolarHBondContact O-N 2.96Å; S158-L160 VanDerWaalsContact C-N 3.27Å; S158-L160 PolarHBondContact O-N 3.28Å; L160-R162 PolarHBondContact O-N 3.31Å; L160-I193 HydrophobicContact CD2-CD1 3.6Å; L160-M202 HydrophobicContact CD1-CE 3.88Å; L160-M202 HydrophobicContact CD1-CG 4.15Å; L160-M202 HydrophobicContact CD1-SD 3.78Å; L160-M202 HydrophobicContact CD2-CE 3.69Å; L160-M202 HydrophobicContact CD2-SD 4.16Å; L160-M202 HydrophobicContact CG-CE 4.44Å; L160-L205 HydrophobicContact CB-CD2 4.09Å; L160-L205 HydrophobicContact CD1-CD2 3.91Å |
| 161 | Q | 69.1 | Low | 68.9 | Low | 108 Ų | 108 | 82.6 Ų | 82.6 | 51% | 0.505 | 40% | 0.401 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -82.2 | -0.3 | 176.9 | -67.1 | 178.4 | -14.2 | 0 | 0 | 112.8 | S158 H163 L205 | S158-Q161 PolarHBondContact O-N 2.79Å; Q161-H163 PolarHBondContact O-N 3.14Å; Q161-H163 PolarHBondContact O-ND1 3.17Å; Q161-L205 PolarHBondContact NE2-OXT 3.4Å; Q161-L205 VanDerWaalsContact NE2-OXT 3.1Å |
| 162 | R | 62.5 | Low | 67.3 | Low | 108 Ų | 108 | 87.8 Ų | 87.8 | 41% | 0.408 | 43% | 0.428 | S | S | . | . | trans | -79.7 | 62.1 | -173.8 | -160.3 | -172 | -65.2 | 143.6 | -9 | 112.4 | D155 S158 V159 L160 S164 N185 | D155-R162 IonicContact OD2-CZ 3.31Å; D155-R162 IonicContact OD2-NH1 2.9Å; D155-R162 IonicContact OD2-NH2 3.45Å; D155-R162 PolarHBondContact OD2-NH2 3.14Å; S158-R162 PolarHBondContact O-N 3.27Å; V159-R162 VanDerWaalsContact O-CB 3.25Å; V159-R162 WeakPolarHBondContact O-CB 3.47Å; V159-R162 PolarHBondContact O-N 3.2Å; L160-R162 PolarHBondContact O-N 3.31Å; R162-S164 PolarHBondContact O-N 3.04Å; R162-N185 PolarHBondContact NH1-OD1 3.2Å | ||
| 163 | H | 53.8 | Low | 65.6 | Low | 119 Ų | 119 | 96.3 Ų | 96.3 | 55% | 0.551 | 47% | 0.468 | S | S | * | . | trans | -51.1 | 120.2 | 168.8 | 52.9 | -82.9 | 0 | 0 | 0 | 109.9 | Q161 K165 | Q161-H163 PolarHBondContact O-N 3.14Å; Q161-H163 PolarHBondContact O-ND1 3.17Å; H163-K165 PolarHBondContact O-N 2.64Å | ||
| 164 | S | 52 | Low | 64.1 | Low | 42 Ų | 42 | 104.8 Ų | 104.8 | 29% | 0.294 | 51% | 0.507 | S | S | . | . | trans | -66 | 101 | 179.5 | 167 | 0 | 0 | 0 | 0 | 110 | R162 D166 K183 | R162-S164 PolarHBondContact O-N 3.04Å; S164-D166 VanDerWaalsContact C-N 3.28Å; S164-D166 PolarHBondContact O-N 3.43Å; S164-K183 WeakPolarHBondContact OG-CD 3.18Å | ||
| 165 | K | 51.1 | Low | 62.4 | Low | 168 Ų | 168 | 99 Ų | 99 | 73% | 0.73 | 51% | 0.505 | S | S | * | . | trans | -76.2 | 87 | 158.8 | -70.3 | -170.1 | 178.6 | -176.7 | 0 | 109.3 | H163 T167 | H163-K165 PolarHBondContact O-N 2.64Å; K165-T167 PolarHBondContact O-N 2.73Å | ||
| 166 | D | 49.1 | Very low | 60.4 | Low | 81 Ų | 81 | 103 Ų | 103 | 43% | 0.433 | 54% | 0.535 | S | S | . | . | trans | 22.9 | 68.7 | 144.5 | -64 | 12.9 | 0 | 0 | 0 | 116.2 | S164 H168 | S164-D166 VanDerWaalsContact C-N 3.28Å; S164-D166 PolarHBondContact O-N 3.43Å; D166-H168 PolarHBondContact O-N 3.23Å; D166-H168 IonicContact OD1-CD2 2.68Å; D166-H168 IonicContact OD1-NE2 2.71Å; D166-H168 IonicContact OD2-CD2 3.79Å; D166-H168 IonicContact OD2-NE2 3.64Å | ||
| 167 | T | 52.7 | Low | 58.3 | Low | 116 Ų | 116 | 109.4 Ų | 109.4 | 71% | 0.712 | 57% | 0.571 | S | S | * | * | trans | -76.3 | 60.9 | 152.9 | 3.9 | 0 | 0 | 0 | 0 | 108.4 | K165 | K165-T167 PolarHBondContact O-N 2.73Š| ||
| 168 | H | 54.9 | Low | 56.6 | Low | 105 Ų | 105 | 112.5 Ų | 112.5 | 49% | 0.486 | 59% | 0.593 | S | S | . | * | trans | -92.9 | 133.3 | 172.9 | -69 | -47.1 | 0 | 0 | 0 | 109.1 | D166 Y170 | D166-H168 PolarHBondContact O-N 3.23Å; D166-H168 IonicContact OD1-CD2 2.68Å; D166-H168 IonicContact OD1-NE2 2.71Å; D166-H168 IonicContact OD2-CD2 3.79Å; D166-H168 IonicContact OD2-NE2 3.64Å; H168-Y170 WeakPolarHBondContact CB-O 3.4Å; H168-Y170 PolarHBondContact O-N 3.06Å | ||
| 169 | F | 56 | Low | 55.3 | Low | 213 Ų | 213 | 117.3 Ų | 117.3 | 93% | 0.934 | 61% | 0.612 | S | S | * | * | S | Bend | trans | -80.6 | 14 | 172.6 | -72 | -87.8 | 0 | 0 | 0 | 112.7 | ||
| 170 | Y | 50 | Low | 54 | Low | 193 Ų | 193 | 123 Ų | 123 | 76% | 0.757 | 64% | 0.643 | S | S | * | * | S | Bend | trans | -151.4 | 148.8 | -179.2 | -157.1 | -101 | 0 | 0 | 0 | 110 | H168 | H168-Y170 WeakPolarHBondContact CB-O 3.4Å; H168-Y170 PolarHBondContact O-N 3.06Å |
| 171 | P | 52.1 | Low | 52.8 | Low | 104 Ų | 104 | 128.7 Ų | 128.7 | 68% | 0.675 | 67% | 0.673 | S | S | * | * | P | Polyproline II helix | trans | -60.7 | 142.1 | 175.7 | -24.1 | 35.1 | 0 | 0 | 0 | 113.1 | ||
| 172 | L | 57.4 | Low | 52.5 | Low | 123 Ų | 123 | 129.1 Ų | 129.1 | 64% | 0.644 | 68% | 0.675 | S | S | * | * | P | Polyproline II helix | trans | -78.2 | 119.5 | 170.8 | -178.8 | 69 | 0 | 0 | 0 | 109.4 | ||
| 173 | E | 52.4 | Low | 52.6 | Low | 181 Ų | 181 | 129.3 Ų | 129.3 | 85% | 0.846 | 68% | 0.679 | S | S | * | * | P | Polyproline II helix | trans | -75.5 | 141.5 | 161.6 | -76.1 | -156 | 153.5 | 0 | 0 | 110.1 | G175 | E173-G175 VanDerWaalsContact C-N 3.27Å; E173-G175 PolarHBondContact O-N 3.37Å |
| 174 | E | 55.6 | Low | 52.9 | Low | 200 Ų | 200 | 127.9 Ų | 127.9 | 94% | 0.935 | 68% | 0.681 | S | S | * | * | trans | -82.1 | 61.9 | -158.8 | -158 | 162.5 | -165.2 | 0 | 0 | 113.5 | S176 | E174-S176 PolarHBondContact O-N 3.38Š| ||
| 175 | G | 50.8 | Low | 53.6 | Low | 64 Ų | 64 | 127 Ų | 127 | 66% | 0.66 | 67% | 0.673 | S | S | * | * | trans | -91.5 | 90.3 | -176.7 | 0 | 0 | 0 | 0 | 0 | 114.6 | E173 | E173-G175 VanDerWaalsContact C-N 3.27Å; E173-G175 PolarHBondContact O-N 3.37Å | ||
| 176 | S | 44.1 | Very low | 54.3 | Low | 114 Ų | 114 | 124.6 Ų | 124.6 | 80% | 0.797 | 67% | 0.674 | S | S | * | * | trans | 32.4 | 98.6 | 160.6 | 62.2 | 0 | 0 | 0 | 0 | 117.7 | E174 S178 | E174-S176 PolarHBondContact O-N 3.38Å; S176-S178 PolarHBondContact O-N 3.38Å | ||
| 177 | T | 41.2 | Very low | 55.4 | Low | 155 Ų | 155 | 123 Ų | 123 | 95% | 0.951 | 68% | 0.677 | S | S | * | * | trans | -63.5 | 91.5 | 178.4 | 38.9 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 178 | S | 48.3 | Very low | 57 | Low | 74 Ų | 74 | 118.1 Ų | 118.1 | 52% | 0.517 | 65% | 0.646 | S | S | . | * | trans | -68.5 | 126.9 | 164.2 | 173.2 | 0 | 0 | 0 | 0 | 110.5 | S176 N180 D181 | S176-S178 PolarHBondContact O-N 3.38Å; S178-N180 PolarHBondContact O-N 3.16Å; S178-N180 PolarHBondContact OG-N 3.13Å; S178-D181 PolarHBondContact O-N 2.87Å; S178-D181 VanDerWaalsContact O-N 3.16Å | ||
| 179 | L | 52.5 | Low | 58.5 | Low | 165 Ų | 165 | 114.4 Ų | 114.4 | 86% | 0.864 | 63% | 0.632 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -64.1 | 5.1 | 177 | -134 | 172.2 | 0 | 0 | 0 | 113.9 | ||
| 180 | N | 50.6 | Low | 60 | Low | 121 Ų | 121 | 110 Ų | 110 | 65% | 0.647 | 61% | 0.612 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -110.9 | -9.7 | 178.4 | -104.2 | -68.7 | 0 | 0 | 0 | 114.6 | S178 E182 K190 | S178-N180 PolarHBondContact O-N 3.16Å; S178-N180 PolarHBondContact OG-N 3.13Å; N180-E182 VanDerWaalsContact C-N 3.29Å; N180-K190 PolarHBondContact O-NZ 2.98Å |
| 181 | D | 52.8 | Low | 61.9 | Low | 149 Ų | 149 | 105.9 Ų | 105.9 | 80% | 0.797 | 60% | 0.603 | S | S | * | * | trans | -95.8 | 21.8 | -178.3 | -144.5 | 17.4 | 0 | 0 | 0 | 112.6 | S178 K183 | S178-D181 PolarHBondContact O-N 2.87Å; S178-D181 VanDerWaalsContact O-N 3.16Å; D181-K183 PolarHBondContact O-N 2.83Å | ||
| 182 | E | 63.3 | Low | 63.7 | Low | 117 Ų | 117 | 101 Ų | 101 | 55% | 0.547 | 57% | 0.571 | S | S | . | * | P | Polyproline II helix | trans | -68.4 | 122.3 | 173.9 | -173.6 | 171.3 | -135.9 | 0 | 0 | 110.4 | N180 P184 | N180-E182 VanDerWaalsContact C-N 3.29Å; E182-P184 VanDerWaalsContact O-N 3.16Å |
| 183 | K | 63.3 | Low | 65.2 | Low | 112 Ų | 112 | 97.4 Ų | 97.4 | 49% | 0.487 | 55% | 0.553 | S | S | . | * | P | Polyproline II helix | trans | -55.5 | 116.9 | -179.7 | -169.2 | -179.4 | -169.8 | 172.8 | 0 | 109.9 | S164 D181 N185 | S164-K183 WeakPolarHBondContact OG-CD 3.18Å; D181-K183 PolarHBondContact O-N 2.83Å; K183-N185 PolarHBondContact O-N 2.86Å |
| 184 | P | 60.9 | Low | 66.9 | Low | 89 Ų | 89 | 95.4 Ų | 95.4 | 58% | 0.578 | 54% | 0.543 | S | S | * | . | P | Polyproline II helix | trans | -65.8 | 135.1 | -169.2 | 25.4 | -34.5 | 0 | 0 | 0 | 111.5 | E182 P186 | E182-P184 VanDerWaalsContact O-N 3.16Å; P184-P186 WeakPolarHBondContact O-CD 3.18Å |
| 185 | N | 66 | Low | 68.5 | Low | 24 Ų | 24 | 87.1 Ų | 87.1 | 13% | 0.128 | 50% | 0.504 | C | S | . | . | P | Polyproline II helix | trans | -59.7 | 121.6 | 173.5 | -94.3 | -75.9 | 0 | 0 | 0 | 110.2 | V159 R162 K183 G187 L188 | V159-N185 HydrophobicContact CG2-CB 3.97Å; V159-N185 VanDerWaalsContact CG2-OD1 3.31Å; V159-N185 WeakPolarHBondContact CG2-OD1 3.47Å; V159-N185 VanDerWaalsContact O-CG 3.32Å; V159-N185 PolarHBondContact O-ND2 3.45Å; V159-N185 PolarHBondContact O-OD1 3.36Å; R162-N185 PolarHBondContact NH1-OD1 3.2Å; K183-N185 PolarHBondContact O-N 2.86Å; N185-G187 PolarHBondContact O-N 3.35Å; N185-G187 VanDerWaalsContact O-N 3.14Å; N185-L188 HydrophobicContact CB-CB 4.27Å; N185-L188 HydrophobicContact CB-CD1 4.11Å; N185-L188 HydrophobicContact CB-CG 4.46Å; N185-L188 PolarHBondContact O-N 2.76Å |
| 186 | P | 65.9 | Low | 70.3 | Confident | 117 Ų | 117 | 84.1 Ų | 84.1 | 76% | 0.76 | 47% | 0.473 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -55.4 | 121.2 | -178.4 | -28.2 | 36.2 | 0 | 0 | 0 | 112.1 | P184 | P184-P186 WeakPolarHBondContact O-CD 3.18Š|
| 187 | G | 72.8 | Confident | 72.2 | Confident | 48 Ų | 48 | 83 Ų | 83 | 50% | 0.495 | 46% | 0.457 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 91.3 | -4.4 | -178.7 | 0 | 0 | 0 | 0 | 0 | 116.3 | I151 N185 | I151-G187 VanDerWaalsContact CD1-C 3.5Å; I151-G187 WeakPolarHBondContact CD1-O 3.46Å; N185-G187 PolarHBondContact O-N 3.35Å; N185-G187 VanDerWaalsContact O-N 3.14Å |
| 188 | L | 86.1 | Confident | 74.4 | Confident | 13 Ų | 13 | 82.6 Ų | 82.6 | 7% | 0.068 | 45% | 0.445 | C | S | . | . | trans | -106.8 | 118.3 | 170.1 | -66.9 | -179.7 | 0 | 0 | 0 | 110.7 | A148 I151 F152 V159 N185 I193 | A148-L188 HydrophobicContact CB-CD2 3.46Å; A148-L188 VanDerWaalsContact CB-CD2 3.46Å; I151-L188 HydrophobicContact CB-CD2 4.43Å; I151-L188 HydrophobicContact CD1-CD2 4Å; I151-L188 HydrophobicContact CD1-CG 4.09Å; I151-L188 HydrophobicContact CG2-CD1 4.42Å; I151-L188 HydrophobicContact CG2-CD2 4.43Å; I151-L188 HydrophobicContact CG2-CG 4.37Å; F152-L188 HydrophobicContact CE2-CD1 4.3Å; F152-L188 HydrophobicContact CE2-CD2 4Å; F152-L188 HydrophobicContact CZ-CD1 4.21Å; V159-L188 HydrophobicContact CG1-CD1 4.03Å; V159-L188 HydrophobicContact CG2-CD1 3.59Å; N185-L188 HydrophobicContact CB-CB 4.27Å; N185-L188 HydrophobicContact CB-CD1 4.11Å; N185-L188 HydrophobicContact CB-CG 4.46Å; N185-L188 PolarHBondContact O-N 2.76Å; L188-I193 HydrophobicContact CB-CD1 4.33Å; L188-I193 HydrophobicContact CD1-CD1 4.17Å | ||
| 189 | S | 87.4 | Confident | 75.9 | Confident | 26 Ų | 26 | 83.4 Ų | 83.4 | 18% | 0.182 | 44% | 0.44 | C | S | . | . | trans | -79.9 | 153 | 174.5 | 79.2 | 0 | 0 | 0 | 0 | 111.9 | D191 I192 I193 | S189-D191 PolarHBondContact O-N 3.08Å; S189-D191 VanDerWaalsContact O-N 3.16Å; S189-D191 PolarHBondContact OG-OD2 3.2Å; S189-I192 PolarHBondContact O-N 3.25Å; S189-I193 PolarHBondContact O-N 2.9Å | ||
| 190 | K | 87.4 | Confident | 76.6 | Confident | 120 Ų | 120 | 79.4 Ų | 79.4 | 52% | 0.522 | 42% | 0.42 | S | S | . | . | H | α-helix | trans | -55.7 | -33.8 | 179.5 | -67.8 | -162.3 | 173 | -161.8 | 0 | 112.1 | N180 I192 I193 H194 | N180-K190 PolarHBondContact O-NZ 2.98Å; K190-I192 VanDerWaalsContact C-N 3.28Å; K190-I192 PolarHBondContact O-N 2.82Å; K190-I193 PolarHBondContact O-N 3.44Å; K190-H194 PolarHBondContact O-N 2.87Å |
| 191 | D | 88.5 | Confident | 77.2 | Confident | 107 Ų | 107 | 74.5 Ų | 74.5 | 57% | 0.572 | 39% | 0.394 | S | S | * | . | H | α-helix | trans | -61.1 | -34.1 | 178.5 | -36.6 | -69.1 | 0 | 0 | 0 | 113.2 | S189 F195 | S189-D191 PolarHBondContact O-N 3.08Å; S189-D191 VanDerWaalsContact O-N 3.16Å; S189-D191 PolarHBondContact OG-OD2 3.2Å; D191-F195 VanDerWaalsContact O-CB 3.24Å; D191-F195 WeakPolarHBondContact O-CB 3.46Å; D191-F195 PolarHBondContact O-N 2.96Å |
| 192 | I | 90.8 | Very high | 77.7 | Confident | 1 Ų | 1 | 68.9 Ų | 68.9 | 1% | 0.005 | 36% | 0.364 | C | S | . | . | H | α-helix | trans | -76.3 | -39.6 | -179.1 | -60.4 | 179.2 | 0 | 0 | 0 | 110.2 | L125 S144 F145 A148 S189 K190 F195 L196 | L125-I192 HydrophobicContact CD2-CG2 4.01Å; S144-I192 VanDerWaalsContact C-CD1 3.4Å; S144-I192 WeakPolarHBondContact O-CD1 3.44Å; F145-I192 HydrophobicContact CD1-CD1 4.33Å; F145-I192 HydrophobicContact CD1-CG1 4.13Å; F145-I192 HydrophobicContact CD1-CG2 4.41Å; F145-I192 HydrophobicContact CE1-CB 4.36Å; F145-I192 HydrophobicContact CE1-CG1 3.88Å; F145-I192 HydrophobicContact CE1-CG2 4.14Å; F145-I192 HydrophobicContact CZ-CG1 4.08Å; A148-I192 HydrophobicContact CB-CD1 3.68Å; A148-I192 HydrophobicContact CB-CG2 3.8Å; S189-I192 PolarHBondContact O-N 3.25Å; K190-I192 VanDerWaalsContact C-N 3.28Å; K190-I192 PolarHBondContact O-N 2.82Å; I192-F195 PolarHBondContact O-N 3.06Å; I192-L196 HydrophobicContact CG2-CD1 4.12Å; I192-L196 HydrophobicContact CG2-CG 4.48Å; I192-L196 WeakPolarHBondContact O-CB 3.43Å; I192-L196 WeakPolarHBondContact O-CG 3.48Å; I192-L196 PolarHBondContact O-N 3.46Å |
| 193 | I | 87.8 | Confident | 77.5 | Confident | 49 Ų | 49 | 70.7 Ų | 70.7 | 25% | 0.251 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -59.5 | -50.3 | 171.6 | -51.8 | -56.7 | 0 | 0 | 0 | 109.3 | L160 L188 S189 K190 F195 L196 L197 M202 | L160-I193 HydrophobicContact CD2-CD1 3.6Å; L188-I193 HydrophobicContact CB-CD1 4.33Å; L188-I193 HydrophobicContact CD1-CD1 4.17Å; S189-I193 PolarHBondContact O-N 2.9Å; K190-I193 PolarHBondContact O-N 3.44Å; I193-F195 PolarHBondContact O-N 2.98Å; I193-L196 PolarHBondContact O-N 2.96Å; I193-L197 HydrophobicContact CG2-CD1 4.09Å; I193-L197 WeakPolarHBondContact O-CB 3.25Å; I193-L197 VanDerWaalsContact O-CG 3.31Å; I193-L197 WeakPolarHBondContact O-CG 3.31Å; I193-L197 PolarHBondContact O-N 2.95Å; I193-M202 HydrophobicContact CG2-CE 4.19Å |
| 194 | H | 88.4 | Confident | 76.9 | Confident | 138 Ų | 138 | 72.1 Ų | 72.1 | 64% | 0.639 | 38% | 0.382 | S | S | * | . | H | α-helix | trans | -59.9 | -41.8 | 177.8 | -121.6 | -72.5 | 0 | 0 | 0 | 113 | K190 Q198 | K190-H194 PolarHBondContact O-N 2.87Å; H194-Q198 WeakPolarHBondContact O-CB 3.37Å; H194-Q198 PolarHBondContact O-N 2.88Å |
| 195 | F | 90.9 | Very high | 76.6 | Confident | 27 Ų | 27 | 72.4 Ų | 72.4 | 12% | 0.118 | 38% | 0.379 | C | S | . | . | H | α-helix | trans | -63 | -49 | 175.6 | 169.6 | -99.8 | 0 | 0 | 0 | 111.8 | K128 F145 D191 I192 I193 L197 Q198 Q199 | K128-F195 HydrophobicContact CB-CE1 4.02Å; K128-F195 HydrophobicContact CB-CE2 4.5Å; K128-F195 HydrophobicContact CB-CZ 3.75Å; K128-F195 HydrophobicContact CD-CE2 3.81Å; K128-F195 HydrophobicContact CD-CZ 3.92Å; K128-F195 HydrophobicContact CG-CE1 4.19Å; K128-F195 HydrophobicContact CG-CE2 4.14Å; K128-F195 HydrophobicContact CG-CZ 3.84Å; F145-F195 HydrophobicContact CE1-CB 4.34Å; F145-F195 AromaticContact CE1-CD1 3.51Å; F145-F195 HydrophobicContact CE1-CD1 3.51Å; F145-F195 AromaticContact CE1-CE1 3.96Å; F145-F195 HydrophobicContact CE1-CE1 3.96Å; F145-F195 AromaticContact CE1-CG 3.97Å; F145-F195 HydrophobicContact CE1-CG 3.97Å; F145-F195 HydrophobicContact CZ-CB 4.1Å; F145-F195 AromaticContact CZ-CD1 3.97Å; F145-F195 HydrophobicContact CZ-CD1 3.97Å; F145-F195 HydrophobicContact CZ-CD2 4.49Å; F145-F195 AromaticContact CZ-CG 3.92Å; F145-F195 HydrophobicContact CZ-CG 3.92Å; D191-F195 VanDerWaalsContact O-CB 3.24Å; D191-F195 WeakPolarHBondContact O-CB 3.46Å; D191-F195 PolarHBondContact O-N 2.96Å; I192-F195 PolarHBondContact O-N 3.06Å; I193-F195 PolarHBondContact O-N 2.98Å; F195-L197 VanDerWaalsContact C-N 3.33Å; F195-L197 PolarHBondContact O-N 2.95Å; F195-Q198 PolarHBondContact O-N 3.25Å; F195-Q198 VanDerWaalsContact O-N 3.16Å; F195-Q199 HydrophobicContact CD1-CG 4.43Å; F195-Q199 HydrophobicContact CD2-CG 4.07Å; F195-Q199 HydrophobicContact CE1-CG 4.07Å; F195-Q199 HydrophobicContact CE2-CG 3.64Å; F195-Q199 HydrophobicContact CG-CG 4.44Å; F195-Q199 HydrophobicContact CZ-CG 3.65Å; F195-Q199 VanDerWaalsContact O-CG 3.3Å; F195-Q199 WeakPolarHBondContact O-CG 3.36Å; F195-Q199 PolarHBondContact O-N 3.25Å |
| 196 | L | 88.4 | Confident | 77.1 | Confident | 0 Ų | 0 | 74.8 Ų | 74.8 | 0% | 0 | 39% | 0.391 | C | S | . | . | H | α-helix | trans | -65.8 | -34.6 | -178.9 | -73.6 | 174.7 | 0 | 0 | 0 | 112.5 | V121 C124 L125 F152 I192 I193 V201 M202 | V121-L196 HydrophobicContact CG1-CD1 3.95Å; V121-L196 HydrophobicContact CG1-CD2 4.03Å; C124-L196 HydrophobicContact CB-CD2 4.49Å; L125-L196 HydrophobicContact CD2-CD1 4.35Å; L125-L196 HydrophobicContact CD2-CD2 4.09Å; L125-L196 HydrophobicContact CD2-CG 4.36Å; L125-L196 HydrophobicContact CG-CD2 4.25Å; F152-L196 HydrophobicContact CE2-CD1 3.67Å; F152-L196 HydrophobicContact CZ-CD1 3.75Å; I192-L196 HydrophobicContact CG2-CD1 4.12Å; I192-L196 HydrophobicContact CG2-CG 4.48Å; I192-L196 WeakPolarHBondContact O-CB 3.43Å; I192-L196 WeakPolarHBondContact O-CG 3.48Å; I192-L196 PolarHBondContact O-N 3.46Å; I193-L196 PolarHBondContact O-N 2.96Å; L196-V201 PolarHBondContact O-N 2.8Å; L196-M202 HydrophobicContact CB-CE 3.39Å; L196-M202 HydrophobicContact CB-CG 4.47Å; L196-M202 HydrophobicContact CD1-CE 4.19Å; L196-M202 HydrophobicContact CG-CE 4.45Å |
| 197 | L | 84.3 | Confident | 77.7 | Confident | 91 Ų | 91 | 72.6 Ų | 72.6 | 48% | 0.476 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -63 | -47.9 | 169.3 | -71.7 | 169.4 | 0 | 0 | 0 | 111.5 | I193 F195 Q199 N200 M202 | I193-L197 HydrophobicContact CG2-CD1 4.09Å; I193-L197 WeakPolarHBondContact O-CB 3.25Å; I193-L197 VanDerWaalsContact O-CG 3.31Å; I193-L197 WeakPolarHBondContact O-CG 3.31Å; I193-L197 PolarHBondContact O-N 2.95Å; F195-L197 VanDerWaalsContact C-N 3.33Å; F195-L197 PolarHBondContact O-N 2.95Å; L197-Q199 VanDerWaalsContact C-N 3.3Å; L197-Q199 PolarHBondContact O-N 3.11Å; L197-N200 PolarHBondContact O-N 3.29Å; L197-M202 HydrophobicContact CD2-CB 4.23Å; L197-M202 HydrophobicContact CD2-CE 4.36Å; L197-M202 HydrophobicContact CD2-CG 4.33Å; L197-M202 HydrophobicContact CD2-SD 3.65Å; L197-M202 HydrophobicContact CG-CE 4.04Å; L197-M202 HydrophobicContact CG-SD 4Å |
| 198 | Q | 85.9 | Confident | 77.9 | Confident | 146 Ų | 146 | 73.9 Ų | 73.9 | 68% | 0.682 | 37% | 0.365 | S | S | * | . | H | α-helix | trans | -62.4 | -35.3 | 179 | -172.2 | -176.3 | 16.5 | 0 | 0 | 112.7 | H194 F195 N200 | H194-Q198 WeakPolarHBondContact O-CB 3.37Å; H194-Q198 PolarHBondContact O-N 2.88Å; F195-Q198 PolarHBondContact O-N 3.25Å; F195-Q198 VanDerWaalsContact O-N 3.16Å; Q198-N200 PolarHBondContact O-N 2.82Å; Q198-N200 PolarHBondContact O-ND2 3.12Å |
| 199 | Q | 80.6 | Confident | 77.5 | Confident | 92 Ų | 92 | 77.5 Ų | 77.5 | 43% | 0.43 | 38% | 0.382 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -76.8 | 4.6 | 175.8 | -63.4 | -59.7 | -40.2 | 0 | 0 | 113.4 | F195 L197 V201 | F195-Q199 HydrophobicContact CD1-CG 4.43Å; F195-Q199 HydrophobicContact CD2-CG 4.07Å; F195-Q199 HydrophobicContact CE1-CG 4.07Å; F195-Q199 HydrophobicContact CE2-CG 3.64Å; F195-Q199 HydrophobicContact CG-CG 4.44Å; F195-Q199 HydrophobicContact CZ-CG 3.65Å; F195-Q199 VanDerWaalsContact O-CG 3.3Å; F195-Q199 WeakPolarHBondContact O-CG 3.36Å; F195-Q199 PolarHBondContact O-N 3.25Å; L197-Q199 VanDerWaalsContact C-N 3.3Å; L197-Q199 PolarHBondContact O-N 3.11Å; Q199-V201 HydrophobicContact CB-CG2 3.76Å; Q199-V201 PolarHBondContact O-N 3.1Å; Q199-V201 VanDerWaalsContact O-N 3.12Å |
| 200 | N | 66.3 | Low | 76.8 | Confident | 81 Ų | 81 | 80.8 Ų | 80.8 | 43% | 0.433 | 40% | 0.395 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 63.4 | 4.8 | -179.5 | -55.7 | -80 | 0 | 0 | 0 | 115.7 | L197 Q198 M202 K203 | L197-N200 PolarHBondContact O-N 3.29Å; Q198-N200 PolarHBondContact O-N 2.82Å; Q198-N200 PolarHBondContact O-ND2 3.12Å; N200-M202 PolarHBondContact O-N 3.12Å; N200-M202 VanDerWaalsContact O-N 3.14Å; N200-K203 HydrophobicContact CB-CD 4.04Å; N200-K203 HydrophobicContact CB-CG 4.37Å; N200-K203 WeakPolarHBondContact O-CB 3.36Å; N200-K203 PolarHBondContact O-N 3.03Å; N200-K203 WeakPolarHBondContact OD1-CE 3.14Å; N200-K203 PolarHBondContact OD1-NZ 3.08Å |
| 201 | V | 64.3 | Low | 76.1 | Confident | 18 Ų | 18 | 78.1 Ų | 78.1 | 11% | 0.109 | 39% | 0.386 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -68.9 | -17.6 | -170.6 | -161.8 | 0 | 0 | 0 | 0 | 112.8 | V121 C124 L196 Q199 | V121-V201 HydrophobicContact CB-CG1 4.39Å; V121-V201 HydrophobicContact CG2-CB 4.36Å; V121-V201 HydrophobicContact CG2-CG1 3.6Å; C124-V201 HydrophobicContact CB-CG2 4.09Å; L196-V201 PolarHBondContact O-N 2.8Å; Q199-V201 HydrophobicContact CB-CG2 3.76Å; Q199-V201 PolarHBondContact O-N 3.1Å; Q199-V201 VanDerWaalsContact O-N 3.12Å |
| 202 | M | 62.5 | Low | 75.3 | Confident | 31 Ų | 31 | 76.1 Ų | 76.1 | 15% | 0.153 | 37% | 0.373 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -94 | 5.6 | 174.2 | -51.9 | -168.2 | -159.7 | 0 | 0 | 114.5 | L160 I193 L196 L197 N200 D204 | L160-M202 HydrophobicContact CD1-CE 3.88Å; L160-M202 HydrophobicContact CD1-CG 4.15Å; L160-M202 HydrophobicContact CD1-SD 3.78Å; L160-M202 HydrophobicContact CD2-CE 3.69Å; L160-M202 HydrophobicContact CD2-SD 4.16Å; L160-M202 HydrophobicContact CG-CE 4.44Å; I193-M202 HydrophobicContact CG2-CE 4.19Å; L196-M202 HydrophobicContact CB-CE 3.39Å; L196-M202 HydrophobicContact CB-CG 4.47Å; L196-M202 HydrophobicContact CD1-CE 4.19Å; L196-M202 HydrophobicContact CG-CE 4.45Å; L197-M202 HydrophobicContact CD2-CB 4.23Å; L197-M202 HydrophobicContact CD2-CE 4.36Å; L197-M202 HydrophobicContact CD2-CG 4.33Å; L197-M202 HydrophobicContact CD2-SD 3.65Å; L197-M202 HydrophobicContact CG-CE 4.04Å; L197-M202 HydrophobicContact CG-SD 4Å; N200-M202 PolarHBondContact O-N 3.12Å; N200-M202 VanDerWaalsContact O-N 3.14Å; M202-D204 PolarHBondContact O-N 3.02Å |
| 203 | K | 59.3 | Low | 74.1 | Confident | 154 Ų | 154 | 81.8 Ų | 81.8 | 67% | 0.67 | 40% | 0.401 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -73.6 | -15.5 | -177.6 | -77.1 | -170.6 | 171.2 | 168.2 | 0 | 114.4 | N200 | N200-K203 HydrophobicContact CB-CD 4.04Å; N200-K203 HydrophobicContact CB-CG 4.37Å; N200-K203 WeakPolarHBondContact O-CB 3.36Å; N200-K203 PolarHBondContact O-N 3.03Å; N200-K203 WeakPolarHBondContact OD1-CE 3.14Å; N200-K203 PolarHBondContact OD1-NZ 3.08Å |
| 204 | D | 50.2 | Low | 72.9 | Confident | 142 Ų | 142 | 84.6 Ų | 84.6 | 76% | 0.759 | 41% | 0.414 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -113.7 | 30.2 | -178.4 | -48.4 | -45 | 0 | 0 | 0 | 111.7 | M202 | M202-D204 PolarHBondContact O-N 3.02Š|
| 205 | L | 53.9 | Low | 71.5 | Confident | 95 Ų | 95 | 79.7 Ų | 79.7 | 50% | 0.497 | 39% | 0.393 | S | S | . | . | trans | -110.8 | 0 | -173.3 | -175.5 | 68.2 | 0 | 0 | 0 | 113.6 | V117 C157 L160 Q161 | V117-L205 HydrophobicContact CG1-CD1 4.23Å; C157-L205 HydrophobicContact CB-CD1 3.62Å; C157-L205 HydrophobicContact CB-CD2 4.49Å; L160-L205 HydrophobicContact CB-CD2 4.09Å; L160-L205 HydrophobicContact CD1-CD2 3.91Å; Q161-L205 PolarHBondContact NE2-OXT 3.4Å; Q161-L205 VanDerWaalsContact NE2-OXT 3.1Å |
Retrieved 205 of 205 residues in 163.8 ms
(Link to these results)