| 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 | 37.1 | Very low | 46.7 | Very low | 248 Ų | 248 | 141.8 Ų | 141.8 | 100% | 1.222 | 77% | 0.766 | S | S | * | * | 0 | 95.1 | 0 | -82.8 | 177 | 174.5 | 0 | 0 | 107 | |||||
| 2 | E | 49.9 | Very low | 45.9 | Very low | 184 Ų | 184 | 142.6 Ų | 142.6 | 86% | 0.86 | 77% | 0.768 | S | S | * | * | trans | -75.4 | 127.6 | 173.1 | -115.1 | 154.3 | 140.6 | 0 | 0 | 108.7 | P4 | E2-P4 WeakPolarHBondContact O-CD 3.45Š| ||
| 3 | N | 62.1 | Low | 45 | Very low | 115 Ų | 115 | 141.2 Ų | 141.2 | 62% | 0.615 | 77% | 0.768 | S | S | * | * | trans | -76.9 | 117.1 | 179.7 | -176.5 | -9.2 | 0 | 0 | 0 | 109.3 | F5 | N3-F5 PolarHBondContact O-N 3.46Å; N3-F5 PolarHBondContact OD1-N 2.81Å | ||
| 4 | P | 54.9 | Low | 44.3 | Very low | 110 Ų | 110 | 139.6 Ų | 139.6 | 71% | 0.714 | 77% | 0.768 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76.8 | 3.1 | -173 | 30.5 | -34.9 | 0 | 0 | 0 | 115 | E2 | E2-P4 WeakPolarHBondContact O-CD 3.45Š|
| 5 | F | 44.7 | Very low | 43.6 | Very low | 182 Ų | 182 | 139.7 Ų | 139.7 | 80% | 0.798 | 78% | 0.775 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -109.1 | 16.4 | 179 | -59.2 | -76.5 | 0 | 0 | 0 | 113.9 | N3 D7 | N3-F5 PolarHBondContact O-N 3.46Å; N3-F5 PolarHBondContact OD1-N 2.81Å; F5-D7 PolarHBondContact O-N 2.79Å |
| 6 | A | 44.1 | Very low | 42.7 | Very low | 80 Ų | 80 | 140.8 Ų | 140.8 | 66% | 0.661 | 78% | 0.779 | S | S | * | * | trans | -71.5 | 115.8 | 174 | 0 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 7 | D | 40.6 | Very low | 42 | Very low | 119 Ų | 119 | 139.4 Ų | 139.4 | 64% | 0.636 | 78% | 0.781 | S | S | * | * | trans | -56 | 123.9 | 180 | -159.8 | -18.5 | 0 | 0 | 0 | 111.6 | F5 V9 | F5-D7 PolarHBondContact O-N 2.79Å; D7-V9 PolarHBondContact O-N 3.21Å | ||
| 8 | P | 51 | Low | 41.4 | Very low | 107 Ų | 107 | 141.9 Ų | 141.9 | 70% | 0.695 | 79% | 0.785 | S | S | * | * | G | 310 helix | trans | -69.1 | -1 | -169.3 | 23.3 | -33.4 | 0 | 0 | 0 | 116.1 | A10 | P8-A10 VanDerWaalsContact C-N 3.26Å; P8-A10 PolarHBondContact O-N 2.7Å |
| 9 | V | 46.9 | Very low | 41 | Very low | 110 Ų | 110 | 143.2 Ų | 143.2 | 67% | 0.667 | 79% | 0.79 | S | S | * | * | G | 310 helix | trans | -71.4 | -21 | 179.2 | -173.1 | 0 | 0 | 0 | 0 | 112.5 | D7 R11 | D7-V9 PolarHBondContact O-N 3.21Å; V9-R11 VanDerWaalsContact C-N 3.26Å; V9-R11 PolarHBondContact O-N 2.79Å |
| 10 | A | 42.8 | Very low | 40.7 | Very low | 91 Ų | 91 | 142.8 Ų | 142.8 | 75% | 0.752 | 79% | 0.787 | S | S | * | * | G | 310 helix | trans | -77.8 | -2 | -178.8 | 0 | 0 | 0 | 0 | 0 | 115 | P8 | P8-A10 VanDerWaalsContact C-N 3.26Å; P8-A10 PolarHBondContact O-N 2.7Å |
| 11 | R | 39.5 | Very low | 40.3 | Very low | 214 Ų | 214 | 140.9 Ų | 140.9 | 81% | 0.808 | 78% | 0.781 | S | S | * | * | G | 310 helix | trans | -95.5 | 10.6 | 179.6 | -110 | -172.1 | -87.9 | -145.6 | -3.2 | 115.1 | V9 T13 | V9-R11 VanDerWaalsContact C-N 3.26Å; V9-R11 PolarHBondContact O-N 2.79Å; R11-T13 PolarHBondContact O-N 3.19Å |
| 12 | L | 37.5 | Very low | 40.1 | Very low | 151 Ų | 151 | 136.6 Ų | 136.6 | 79% | 0.791 | 76% | 0.758 | S | S | * | * | trans | -97.9 | 82.5 | 174.2 | -60.4 | 177.2 | 0 | 0 | 0 | 110 | ||||
| 13 | T | 33.9 | Very low | 39.5 | Very low | 125 Ų | 125 | 135.2 Ų | 135.2 | 77% | 0.767 | 76% | 0.756 | S | S | * | * | trans | -123 | 131.2 | 156.1 | -9.8 | 0 | 0 | 0 | 0 | 108.3 | R11 | R11-T13 PolarHBondContact O-N 3.19Š| ||
| 14 | P | 35 | Very low | 38.4 | Very low | 118 Ų | 118 | 134.6 Ų | 134.6 | 77% | 0.766 | 76% | 0.76 | S | S | * | * | P | Polyproline II helix | trans | -93.4 | 127.6 | -145.8 | 9.4 | 9.1 | 0 | 0 | 0 | 110.8 | ||
| 15 | T | 33.9 | Very low | 37.5 | Very low | 142 Ų | 142 | 140.2 Ų | 140.2 | 87% | 0.871 | 77% | 0.767 | S | S | * | * | P | Polyproline II helix | trans | -97.4 | 123 | 162.6 | 43.5 | 0 | 0 | 0 | 0 | 108.9 | ||
| 16 | N | 29.5 | Very low | 37.5 | Very low | 157 Ų | 157 | 137.4 Ų | 137.4 | 84% | 0.84 | 77% | 0.765 | S | S | * | * | P | Polyproline II helix | trans | -48.5 | 129.2 | -180 | -68.2 | -37.3 | 0 | 0 | 0 | 113.6 | ||
| 17 | S | 31 | Very low | 37.3 | Very low | 117 Ų | 117 | 140 Ų | 140 | 82% | 0.818 | 77% | 0.767 | S | S | * | * | -175.2 | 142.6 | 123.9 | 32.6 | 0 | 0 | 0 | 0 | 109.3 | D19 | S17-D19 PolarHBondContact O-N 3.13Š| |||
| 18 | H | 30.3 | Very low | 37.6 | Very low | 185 Ų | 185 | 139.1 Ų | 139.1 | 86% | 0.856 | 77% | 0.766 | S | S | * | * | trans | -54.9 | 126.6 | -170.3 | -66.8 | 5.7 | 0 | 0 | 0 | 113.3 | ||||
| 19 | D | 35.1 | Very low | 37.3 | Very low | 165 Ų | 165 | 135.5 Ų | 135.5 | 88% | 0.882 | 75% | 0.749 | S | S | * | * | -163 | 140.7 | 127.7 | -95.8 | -27.9 | 0 | 0 | 0 | 110.7 | S17 | S17-D19 PolarHBondContact O-N 3.13Š| |||
| 20 | N | 34.5 | Very low | 37.4 | Very low | 135 Ų | 135 | 133.9 Ų | 133.9 | 72% | 0.722 | 75% | 0.747 | S | S | * | * | trans | -46.9 | 128.5 | -164.8 | -167.8 | 12.3 | 0 | 0 | 0 | 115.7 | Q22 | N20-Q22 PolarHBondContact O-N 3.24Š| ||
| 21 | P | 32.4 | Very low | 37.6 | Very low | 103 Ų | 103 | 136.6 Ų | 136.6 | 67% | 0.669 | 75% | 0.748 | S | S | * | * | trans | -78.3 | 86.6 | 179.1 | 32.3 | -34 | 0 | 0 | 0 | 111.3 | ||||
| 22 | Q | 32.6 | Very low | 38.2 | Very low | 158 Ų | 158 | 133.2 Ų | 133.2 | 74% | 0.738 | 75% | 0.746 | S | S | * | * | trans | -98.9 | 72.3 | 153.2 | -75 | -76.7 | -65.6 | 0 | 0 | 107.5 | N20 S24 | N20-Q22 PolarHBondContact O-N 3.24Å; Q22-S24 VanDerWaalsContact C-N 3.29Å; Q22-S24 PolarHBondContact O-N 3.47Å | ||
| 23 | I | 37.1 | Very low | 38.8 | Very low | 156 Ų | 156 | 134.9 Ų | 134.9 | 80% | 0.8 | 75% | 0.747 | S | S | * | * | trans | -58.6 | 104.9 | 158.1 | -64.4 | 173.1 | 0 | 0 | 0 | 104.3 | R25 | I23-R25 PolarHBondContact O-N 3.05Š| ||
| 24 | S | 39.4 | Very low | 39.6 | Very low | 102 Ų | 102 | 137.6 Ų | 137.6 | 71% | 0.713 | 74% | 0.744 | S | S | * | * | trans | -61.1 | 84.7 | 176.3 | -60.2 | 0 | 0 | 0 | 0 | 108.6 | Q22 V26 | Q22-S24 VanDerWaalsContact C-N 3.29Å; Q22-S24 PolarHBondContact O-N 3.47Å; S24-V26 PolarHBondContact O-N 3.13Å | ||
| 25 | R | 35.8 | Very low | 40.9 | Very low | 227 Ų | 227 | 136.4 Ų | 136.4 | 86% | 0.857 | 73% | 0.732 | S | S | * | * | trans | -57.1 | 109.1 | 159.7 | -173.1 | 177 | -171.6 | 151.4 | 1.7 | 104.5 | I23 D27 | I23-R25 PolarHBondContact O-N 3.05Å; R25-D27 VanDerWaalsContact C-N 3.34Å; R25-D27 PolarHBondContact O-N 3.25Å | ||
| 26 | V | 44.3 | Very low | 41.8 | Very low | 124 Ų | 124 | 133.5 Ų | 133.5 | 75% | 0.752 | 72% | 0.715 | S | S | * | * | trans | -57.5 | 104.6 | 173.5 | 176.4 | 0 | 0 | 0 | 0 | 106 | S24 T28 | S24-V26 PolarHBondContact O-N 3.13Å; V26-T28 VanDerWaalsContact C-N 3.33Å; V26-T28 PolarHBondContact O-N 2.99Å | ||
| 27 | D | 40.9 | Very low | 42.9 | Very low | 133 Ų | 133 | 134.8 Ų | 134.8 | 71% | 0.711 | 71% | 0.714 | S | S | * | * | trans | -75.8 | 91 | -177.4 | -153.2 | -12.9 | 0 | 0 | 0 | 107.3 | R25 G29 A30 | R25-D27 VanDerWaalsContact C-N 3.34Å; R25-D27 PolarHBondContact O-N 3.25Å; D27-G29 PolarHBondContact O-N 3.1Å; D27-G29 VanDerWaalsContact O-N 3.07Å; D27-A30 PolarHBondContact O-N 3.44Å | ||
| 28 | T | 46.7 | Very low | 43.6 | Very low | 101 Ų | 101 | 135.4 Ų | 135.4 | 62% | 0.62 | 70% | 0.704 | S | S | * | * | G | 310 helix | trans | -62.5 | -12.4 | -179.7 | 51.5 | 0 | 0 | 0 | 0 | 112.2 | V26 A30 L31 | V26-T28 VanDerWaalsContact C-N 3.33Å; V26-T28 PolarHBondContact O-N 2.99Å; T28-A30 PolarHBondContact O-N 3.26Å; T28-L31 PolarHBondContact O-N 3.47Å |
| 29 | G | 44.8 | Very low | 44.1 | Very low | 32 Ų | 32 | 131.5 Ų | 131.5 | 33% | 0.33 | 70% | 0.703 | S | S | . | * | G | 310 helix | trans | -65.8 | -19.2 | 176.6 | 0 | 0 | 0 | 0 | 0 | 114.7 | D27 | D27-G29 PolarHBondContact O-N 3.1Å; D27-G29 VanDerWaalsContact O-N 3.07Å |
| 30 | A | 49.1 | Very low | 44.3 | Very low | 76 Ų | 76 | 129 Ų | 129 | 63% | 0.628 | 69% | 0.694 | S | S | * | * | G | 310 helix | trans | -76.4 | -27.4 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | D27 T28 | D27-A30 PolarHBondContact O-N 3.44Å; T28-A30 PolarHBondContact O-N 3.26Å |
| 31 | L | 46.2 | Very low | 44.5 | Very low | 148 Ų | 148 | 126.8 Ų | 126.8 | 78% | 0.775 | 70% | 0.695 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76.2 | -36 | 179.7 | -127.7 | 92.4 | 0 | 0 | 0 | 111.8 | T28 K33 Y34 | T28-L31 PolarHBondContact O-N 3.47Å; L31-K33 PolarHBondContact O-N 3.48Å; L31-Y34 PolarHBondContact O-N 3.19Å |
| 32 | D | 53 | Low | 44.6 | Very low | 142 Ų | 142 | 130.9 Ų | 130.9 | 76% | 0.759 | 71% | 0.705 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -69.9 | -14.7 | -177.7 | -69 | -26.4 | 0 | 0 | 0 | 113.6 | ||
| 33 | K | 49.4 | Very low | 44.4 | Very low | 186 Ų | 186 | 126.5 Ų | 126.5 | 81% | 0.809 | 70% | 0.702 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -109.8 | -0.2 | -178.3 | -74.1 | 171.8 | -179.3 | 173 | 0 | 114.5 | L31 N35 | L31-K33 PolarHBondContact O-N 3.48Å; K33-N35 PolarHBondContact O-N 3.01Å |
| 34 | Y | 49.6 | Very low | 44.2 | Very low | 182 Ų | 182 | 126.9 Ų | 126.9 | 71% | 0.714 | 71% | 0.706 | S | S | * | * | trans | -91.5 | 97.2 | -180 | -170.8 | -100.4 | 0 | 0 | 0 | 111 | L31 P36 | L31-Y34 PolarHBondContact O-N 3.19Å; Y34-P36 HydrophobicContact CE1-CB 3.92Å; Y34-P36 HydrophobicContact CE1-CG 4.38Å | ||
| 35 | N | 62.9 | Low | 43.6 | Very low | 94 Ų | 94 | 128 Ų | 128 | 50% | 0.503 | 71% | 0.708 | S | S | . | * | trans | -107.5 | 109.8 | 166.7 | -170.7 | 0.5 | 0 | 0 | 0 | 109.8 | K33 F37 E38 | K33-N35 PolarHBondContact O-N 3.01Å; N35-F37 PolarHBondContact O-N 3.04Å; N35-E38 PolarHBondContact O-N 3.43Å | ||
| 36 | P | 52.8 | Low | 43.6 | Very low | 81 Ų | 81 | 127 Ų | 127 | 53% | 0.526 | 71% | 0.71 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -70.9 | -0.2 | -170.4 | 27.2 | -34.8 | 0 | 0 | 0 | 115.3 | Y34 | Y34-P36 HydrophobicContact CE1-CB 3.92Å; Y34-P36 HydrophobicContact CE1-CG 4.38Å |
| 37 | F | 53.6 | Low | 42.8 | Very low | 184 Ų | 184 | 130.3 Ų | 130.3 | 81% | 0.807 | 72% | 0.717 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -109.6 | 0.8 | 179.4 | -59.4 | -73.4 | 0 | 0 | 0 | 114 | N35 A39 | N35-F37 PolarHBondContact O-N 3.04Å; F37-A39 PolarHBondContact O-N 3.48Å |
| 38 | E | 44.6 | Very low | 42.2 | Very low | 130 Ų | 130 | 127.4 Ų | 127.4 | 61% | 0.607 | 72% | 0.719 | S | S | * | * | trans | -87.2 | 93.2 | -179.6 | -155.8 | 160 | -158.4 | 0 | 0 | 109.9 | N35 T40 | N35-E38 PolarHBondContact O-N 3.43Å; E38-T40 HydrophobicContact CG-CG2 4.37Å; E38-T40 PolarHBondContact O-N 2.98Å; E38-T40 PolarHBondContact O-OG1 2.87Å | ||
| 39 | A | 42.1 | Very low | 41.4 | Very low | 103 Ų | 103 | 129.9 Ų | 129.9 | 85% | 0.851 | 73% | 0.728 | S | S | * | * | trans | -68.5 | 75 | 171.3 | 0 | 0 | 0 | 0 | 0 | 109.9 | F37 A41 | F37-A39 PolarHBondContact O-N 3.48Å; A39-A41 PolarHBondContact O-N 3.27Å; A39-A41 VanDerWaalsContact O-N 3.09Å | ||
| 40 | T | 38.7 | Very low | 40.7 | Very low | 112 Ų | 112 | 138 Ų | 138 | 69% | 0.687 | 76% | 0.757 | S | S | * | * | trans | -79.3 | 94.7 | 173.4 | 20.6 | 0 | 0 | 0 | 0 | 109.4 | E38 H42 | E38-T40 HydrophobicContact CG-CG2 4.37Å; E38-T40 PolarHBondContact O-N 2.98Å; E38-T40 PolarHBondContact O-OG1 2.87Å; T40-H42 PolarHBondContact O-N 2.88Å | ||
| 41 | A | 38.8 | Very low | 39.9 | Very low | 89 Ų | 89 | 139.7 Ų | 139.7 | 74% | 0.736 | 76% | 0.76 | S | S | * | * | trans | -66.2 | 101.2 | 161.4 | 0 | 0 | 0 | 0 | 0 | 110.2 | A39 | A39-A41 PolarHBondContact O-N 3.27Å; A39-A41 VanDerWaalsContact O-N 3.09Å | ||
| 42 | H | 33.3 | Very low | 39.2 | Very low | 189 Ų | 189 | 139.4 Ų | 139.4 | 88% | 0.875 | 76% | 0.764 | S | S | * | * | trans | -152.5 | 110.6 | 153 | -82.7 | -52.7 | 0 | 0 | 0 | 104.7 | T40 | T40-H42 PolarHBondContact O-N 2.88Š| ||
| 43 | G | 28.7 | Very low | 38.4 | Very low | 66 Ų | 66 | 138.8 Ų | 138.8 | 68% | 0.68 | 76% | 0.761 | S | S | * | * | cis | 102.8 | 73.4 | 40.1 | 0 | 0 | 0 | 0 | 0 | 107.6 | ||||
| 44 | D | 32.8 | Very low | 37.7 | Very low | 164 Ų | 164 | 135.8 Ų | 135.8 | 88% | 0.877 | 76% | 0.764 | S | S | * | * | trans | -149.7 | 78.5 | 158.9 | -98.1 | -28.8 | 0 | 0 | 0 | 110.5 | ||||
| 45 | T | 27.7 | Very low | 37 | Very low | 124 Ų | 124 | 132.9 Ų | 132.9 | 76% | 0.761 | 76% | 0.764 | S | S | * | * | trans | 14.8 | 100.7 | 132.9 | -37.5 | 0 | 0 | 0 | 0 | 117.9 | ||||
| 46 | K | 34.7 | Very low | 35.9 | Very low | 207 Ų | 207 | 133.2 Ų | 133.2 | 90% | 0.9 | 77% | 0.772 | S | S | * | * | trans | -139.9 | 123 | 132.2 | -77.1 | -163 | 178.9 | 176.2 | 0 | 110.4 | ||||
| 47 | Q | 28.4 | Very low | 35.2 | Very low | 193 Ų | 193 | 134.4 Ų | 134.4 | 90% | 0.902 | 78% | 0.779 | S | S | * | * | trans | -56.4 | 152 | 176.3 | -69.5 | 160.8 | -48.8 | 0 | 0 | 112.8 | ||||
| 48 | G | 29.2 | Very low | 34.6 | Very low | 72 Ų | 72 | 130.8 Ų | 130.8 | 74% | 0.742 | 77% | 0.774 | S | S | * | * | trans | 156.5 | 82.4 | 154.6 | 0 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 49 | N | 29.8 | Very low | 34.3 | Very low | 154 Ų | 154 | 130 Ų | 130 | 82% | 0.824 | 78% | 0.78 | S | S | * | * | trans | 48.3 | 102.4 | 150.4 | -71.7 | -6.3 | 0 | 0 | 0 | 120.3 | T51 | N49-T51 PolarHBondContact O-N 2.71Š| ||
| 50 | H | 28.9 | Very low | 34.3 | Very low | 202 Ų | 202 | 135.9 Ų | 135.9 | 94% | 0.935 | 78% | 0.782 | S | S | * | * | trans | -51.1 | 100.6 | 149.5 | -82.9 | -79.7 | 0 | 0 | 0 | 110.9 | ||||
| 51 | T | 33 | Very low | 34.4 | Very low | 112 Ų | 112 | 134.6 Ų | 134.6 | 69% | 0.687 | 78% | 0.778 | S | S | * | * | trans | -128.8 | 125.6 | 150.8 | 32 | 0 | 0 | 0 | 0 | 107.8 | N49 N53 | N49-T51 PolarHBondContact O-N 2.71Å; T51-N53 PolarHBondContact O-N 2.9Å | ||
| 52 | T | 31.3 | Very low | 34.8 | Very low | 141 Ų | 141 | 133.7 Ų | 133.7 | 87% | 0.865 | 77% | 0.77 | S | S | * | * | trans | -66.5 | 76.3 | -178 | 47.7 | 0 | 0 | 0 | 0 | 110 | ||||
| 53 | N | 36.2 | Very low | 35.5 | Very low | 130 Ų | 130 | 130.5 Ų | 130.5 | 70% | 0.695 | 77% | 0.765 | S | S | * | * | trans | -100.9 | 114.6 | 159.3 | -77.3 | -25 | 0 | 0 | 0 | 106.8 | T51 V55 | T51-N53 PolarHBondContact O-N 2.9Å; N53-V55 PolarHBondContact O-N 3.31Å | ||
| 54 | S | 34.7 | Very low | 36.3 | Very low | 123 Ų | 123 | 136.1 Ų | 136.1 | 86% | 0.86 | 77% | 0.773 | S | S | * | * | trans | -56.7 | 78.7 | 168.8 | 50.6 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 55 | V | 35.7 | Very low | 37.2 | Very low | 121 Ų | 121 | 131.6 Ų | 131.6 | 73% | 0.733 | 76% | 0.758 | S | S | * | * | P | Polyproline II helix | trans | -79.5 | 122.8 | 163.6 | -176.7 | 0 | 0 | 0 | 0 | 105.6 | N53 | N53-V55 PolarHBondContact O-N 3.31Š|
| 56 | P | 38.3 | Very low | 38.6 | Very low | 101 Ų | 101 | 134.4 Ų | 134.4 | 66% | 0.656 | 76% | 0.763 | S | S | * | * | P | Polyproline II helix | trans | -53 | 149.5 | 177 | -19.8 | 29.7 | 0 | 0 | 0 | 110 | ||
| 57 | P | 38.7 | Very low | 39.7 | Very low | 106 Ų | 106 | 133 Ų | 133 | 69% | 0.688 | 76% | 0.756 | S | S | * | * | P | Polyproline II helix | trans | -50.1 | 142.3 | 178.1 | 22.3 | -32.8 | 0 | 0 | 0 | 109.5 | ||
| 58 | P | 40.6 | Very low | 41.5 | Very low | 108 Ų | 108 | 127.5 Ų | 127.5 | 70% | 0.701 | 73% | 0.732 | S | S | * | * | P | Polyproline II helix | trans | -51 | 135.1 | 176.9 | 22.8 | -32.3 | 0 | 0 | 0 | 107.6 | Y60 | P58-Y60 PolarHBondContact O-N 2.75Š|
| 59 | P | 39.3 | Very low | 44 | Very low | 113 Ų | 113 | 128 Ų | 128 | 73% | 0.734 | 72% | 0.722 | S | S | * | * | P | Polyproline II helix | trans | -53.2 | 121 | 176.9 | 21.7 | -30.2 | 0 | 0 | 0 | 105.9 | S61 | P59-S61 PolarHBondContact O-N 2.83Š|
| 60 | Y | 40.5 | Very low | 46.6 | Very low | 226 Ų | 226 | 126 Ų | 126 | 89% | 0.886 | 72% | 0.715 | S | S | * | * | trans | -52.6 | 95.7 | 166.7 | -94.9 | -95 | 0 | 0 | 0 | 105.5 | P58 A62 | P58-Y60 PolarHBondContact O-N 2.75Å; Y60-A62 PolarHBondContact O-N 2.87Å | ||
| 61 | S | 41.5 | Very low | 49.2 | Very low | 85 Ų | 85 | 119.3 Ų | 119.3 | 59% | 0.594 | 69% | 0.694 | S | S | * | * | trans | -66.1 | 99.2 | 166.5 | -85.3 | 0 | 0 | 0 | 0 | 103.8 | P59 T63 Q64 | P59-S61 PolarHBondContact O-N 2.83Å; S61-T63 PolarHBondContact O-N 2.93Å; S61-Q64 PolarHBondContact O-N 2.66Å | ||
| 62 | A | 48.4 | Very low | 51.8 | Low | 70 Ų | 70 | 116 Ų | 116 | 58% | 0.579 | 67% | 0.671 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -56 | 0.7 | 169.7 | 0 | 0 | 0 | 0 | 0 | 112.5 | Y60 Q64 | Y60-A62 PolarHBondContact O-N 2.87Å; A62-Q64 VanDerWaalsContact C-N 3.35Å |
| 63 | T | 46.9 | Very low | 54.4 | Low | 123 Ų | 123 | 113.8 Ų | 113.8 | 76% | 0.755 | 65% | 0.654 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.3 | -14.2 | 178.8 | -21.9 | 0 | 0 | 0 | 0 | 114.5 | S61 | S61-T63 PolarHBondContact O-N 2.93Š|
| 64 | Q | 45.3 | Very low | 57 | Low | 184 Ų | 184 | 113.2 Ų | 113.2 | 86% | 0.86 | 65% | 0.647 | S | S | * | * | S | Bend | trans | -113.4 | -2.5 | 174.6 | -75.8 | -171.6 | 0.7 | 0 | 0 | 115.3 | S61 A62 Q66 | S61-Q64 PolarHBondContact O-N 2.66Å; A62-Q64 VanDerWaalsContact C-N 3.35Å; Q64-Q66 PolarHBondContact O-N 2.81Å |
| 65 | A | 51.8 | Low | 59.6 | Low | 68 Ų | 68 | 113.5 Ų | 113.5 | 56% | 0.562 | 63% | 0.629 | S | S | * | * | S | Bend | trans | -65.4 | 98.6 | 152.3 | 0 | 0 | 0 | 0 | 0 | 104.7 | K67 | A65-K67 PolarHBondContact O-N 3.43Š|
| 66 | Q | 57.4 | Low | 62.3 | Low | 184 Ų | 184 | 113.9 Ų | 113.9 | 86% | 0.86 | 62% | 0.617 | S | S | * | * | trans | -48.8 | 96.5 | 165.2 | -106.5 | 162.6 | -41.1 | 0 | 0 | 105.4 | Q64 I68 | Q64-Q66 PolarHBondContact O-N 2.81Å; Q66-I68 PolarHBondContact O-N 2.66Å | ||
| 67 | K | 58.7 | Low | 64.8 | Low | 176 Ų | 176 | 114 Ų | 114 | 77% | 0.765 | 61% | 0.609 | S | S | * | * | trans | -66.1 | 91.8 | 172.3 | -84.7 | -177.1 | 177.6 | 179.5 | 0 | 103.2 | A65 T69 | A65-K67 PolarHBondContact O-N 3.43Å; K67-T69 VanDerWaalsContact C-N 3.31Å; K67-T69 PolarHBondContact O-N 2.91Å | ||
| 68 | I | 66.2 | Low | 67.3 | Low | 78 Ų | 78 | 116 Ų | 116 | 40% | 0.4 | 61% | 0.607 | S | S | . | * | trans | -58.4 | 109.2 | 167 | -50.6 | -178.4 | 0 | 0 | 0 | 103.3 | Q66 E72 L73 | Q66-I68 PolarHBondContact O-N 2.66Å; I68-E72 HydrophobicContact CG2-CB 3.87Å; I68-E72 HydrophobicContact CG2-CG 3.67Å; I68-L73 HydrophobicContact CB-CD2 4.31Å; I68-L73 HydrophobicContact CB-CG 4.18Å; I68-L73 HydrophobicContact CG2-CB 4.5Å; I68-L73 HydrophobicContact CG2-CD2 3.75Å; I68-L73 HydrophobicContact CG2-CG 3.58Å | ||
| 69 | T | 80.6 | Confident | 69.8 | Low | 84 Ų | 84 | 114.7 Ų | 114.7 | 52% | 0.515 | 59% | 0.592 | S | S | . | * | trans | -63.7 | 150.6 | -179.5 | 53.7 | 0 | 0 | 0 | 0 | 107.8 | K67 A71 E72 L73 | K67-T69 VanDerWaalsContact C-N 3.31Å; K67-T69 PolarHBondContact O-N 2.91Å; T69-A71 PolarHBondContact O-N 2.75Å; T69-A71 VanDerWaalsContact O-N 3.14Å; T69-E72 WeakPolarHBondContact O-CA 3.5Å; T69-E72 PolarHBondContact O-N 3.25Å; T69-E72 WeakPolarHBondContact OG1-CB 3.38Å; T69-E72 PolarHBondContact OG1-N 2.91Å; T69-L73 PolarHBondContact O-N 3.39Å | ||
| 70 | T | 83.7 | Confident | 72.4 | Confident | 111 Ų | 111 | 114.3 Ų | 114.3 | 68% | 0.681 | 58% | 0.583 | S | S | * | * | H | α-helix | trans | -51.5 | -37.5 | 174.8 | 40.1 | 0 | 0 | 0 | 0 | 111.4 | L73 E74 | T70-L73 PolarHBondContact O-N 2.81Å; T70-E74 WeakPolarHBondContact O-CB 3.39Å; T70-E74 WeakPolarHBondContact O-CG 3.44Å; T70-E74 PolarHBondContact O-N 2.87Å |
| 71 | A | 84.9 | Confident | 75 | Confident | 61 Ų | 61 | 107.9 Ų | 107.9 | 50% | 0.504 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -63.5 | -40.4 | 173.4 | 0 | 0 | 0 | 0 | 0 | 113.9 | T69 E74 R75 | T69-A71 PolarHBondContact O-N 2.75Å; T69-A71 VanDerWaalsContact O-N 3.14Å; A71-E74 PolarHBondContact O-N 3.34Å; A71-R75 WeakPolarHBondContact O-CB 3.5Å; A71-R75 PolarHBondContact O-N 2.91Å |
| 72 | E | 87.8 | Confident | 77.5 | Confident | 44 Ų | 44 | 106.8 Ų | 106.8 | 21% | 0.206 | 56% | 0.56 | C | S | . | * | H | α-helix | trans | -70.7 | -35.5 | 175.5 | 178.2 | 62.8 | -167.9 | 0 | 0 | 111.4 | I68 T69 R75 R76 | I68-E72 HydrophobicContact CG2-CB 3.87Å; I68-E72 HydrophobicContact CG2-CG 3.67Å; T69-E72 WeakPolarHBondContact O-CA 3.5Å; T69-E72 PolarHBondContact O-N 3.25Å; T69-E72 WeakPolarHBondContact OG1-CB 3.38Å; T69-E72 PolarHBondContact OG1-N 2.91Å; E72-R75 PolarHBondContact O-N 3.14Å; E72-R75 IonicContact OE1-NH2 3.91Å; E72-R75 PolarHBondContact OE1-NH2 3.49Å; E72-R75 IonicContact OE2-CZ 3.82Å; E72-R75 IonicContact OE2-NE 2.91Å; E72-R75 PolarHBondContact OE2-NE 2.88Å; E72-R75 IonicContact OE2-NH2 2.85Å; E72-R75 PolarHBondContact OE2-NH2 2.85Å; E72-R76 WeakPolarHBondContact O-CB 3.35Å; E72-R76 WeakPolarHBondContact O-CG 3.18Å; E72-R76 PolarHBondContact O-N 2.91Å; E72-R76 IonicContact OE1-CZ 3.74Å; E72-R76 IonicContact OE1-NE 2.66Å; E72-R76 PolarHBondContact OE1-NE 2.89Å; E72-R76 VanDerWaalsContact OE1-NE 3.08Å; E72-R76 IonicContact OE1-NH2 2.74Å |
| 73 | L | 86.1 | Confident | 79.7 | Confident | 94 Ų | 94 | 110.4 Ų | 110.4 | 49% | 0.492 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -62.3 | -46.9 | 171.5 | -75 | 168.1 | 0 | 0 | 0 | 111.3 | I68 T69 T70 R75 R76 Q77 | I68-L73 HydrophobicContact CB-CD2 4.31Å; I68-L73 HydrophobicContact CB-CG 4.18Å; I68-L73 HydrophobicContact CG2-CB 4.5Å; I68-L73 HydrophobicContact CG2-CD2 3.75Å; I68-L73 HydrophobicContact CG2-CG 3.58Å; T69-L73 PolarHBondContact O-N 3.39Å; T70-L73 PolarHBondContact O-N 2.81Å; L73-R75 PolarHBondContact O-N 2.85Å; L73-R76 PolarHBondContact O-N 3.36Å; L73-Q77 WeakPolarHBondContact O-CB 3.41Å; L73-Q77 PolarHBondContact O-N 3.5Å |
| 74 | E | 88.9 | Confident | 81.9 | Confident | 118 Ų | 118 | 107.3 Ų | 107.3 | 55% | 0.551 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -63.6 | -39.8 | 176.8 | -75.9 | 176.2 | -168.4 | 0 | 0 | 112.2 | T70 A71 Q77 K78 | T70-E74 WeakPolarHBondContact O-CB 3.39Å; T70-E74 WeakPolarHBondContact O-CG 3.44Å; T70-E74 PolarHBondContact O-N 2.87Å; A71-E74 PolarHBondContact O-N 3.34Å; E74-Q77 PolarHBondContact O-N 3.36Å; E74-K78 WeakPolarHBondContact O-CG 3.37Å; E74-K78 PolarHBondContact O-N 2.93Å |
| 75 | R | 90.3 | Very high | 84.1 | Confident | 129 Ų | 129 | 101.7 Ų | 101.7 | 49% | 0.487 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -63 | -45.3 | 175.1 | -171.2 | 175.9 | 74.1 | 106.8 | -8.4 | 111.1 | A71 E72 L73 Q77 K78 E79 | A71-R75 WeakPolarHBondContact O-CB 3.5Å; A71-R75 PolarHBondContact O-N 2.91Å; E72-R75 PolarHBondContact O-N 3.14Å; E72-R75 IonicContact OE1-NH2 3.91Å; E72-R75 PolarHBondContact OE1-NH2 3.49Å; E72-R75 IonicContact OE2-CZ 3.82Å; E72-R75 IonicContact OE2-NE 2.91Å; E72-R75 PolarHBondContact OE2-NE 2.88Å; E72-R75 IonicContact OE2-NH2 2.85Å; E72-R75 PolarHBondContact OE2-NH2 2.85Å; L73-R75 PolarHBondContact O-N 2.85Å; R75-Q77 VanDerWaalsContact C-N 3.35Å; R75-Q77 PolarHBondContact O-N 3.32Å; R75-K78 PolarHBondContact O-N 3.45Å; R75-E79 IonicContact CZ-OE1 3.34Å; R75-E79 IonicContact NE-OE1 3.92Å; R75-E79 IonicContact NH1-OE1 2.88Å; R75-E79 PolarHBondContact NH1-OE1 3.19Å; R75-E79 WeakPolarHBondContact O-CB 3.5Å; R75-E79 WeakPolarHBondContact O-CG 3.36Å; R75-E79 PolarHBondContact O-N 2.91Å |
| 76 | R | 92.7 | Very high | 86.1 | Confident | 128 Ų | 128 | 101.3 Ų | 101.3 | 48% | 0.483 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -63.9 | -39.3 | 175.4 | -74.5 | -173.1 | -175 | -159.4 | 1 | 112.2 | E72 L73 E79 L80 | E72-R76 WeakPolarHBondContact O-CB 3.35Å; E72-R76 WeakPolarHBondContact O-CG 3.18Å; E72-R76 PolarHBondContact O-N 2.91Å; E72-R76 IonicContact OE1-CZ 3.74Å; E72-R76 IonicContact OE1-NE 2.66Å; E72-R76 PolarHBondContact OE1-NE 2.89Å; E72-R76 VanDerWaalsContact OE1-NE 3.08Å; E72-R76 IonicContact OE1-NH2 2.74Å; L73-R76 PolarHBondContact O-N 3.36Å; R76-E79 PolarHBondContact O-N 3.08Å; R76-L80 WeakPolarHBondContact O-CB 3.36Å; R76-L80 WeakPolarHBondContact O-CG 3.5Å; R76-L80 PolarHBondContact O-N 2.84Å |
| 77 | Q | 90.7 | Very high | 87.7 | Confident | 104 Ų | 104 | 97.3 Ų | 97.3 | 49% | 0.486 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -62.1 | -46.8 | 175.3 | -170 | 60.9 | 42.9 | 0 | 0 | 110.8 | L73 E74 R75 E79 L80 D81 | L73-Q77 WeakPolarHBondContact O-CB 3.41Å; L73-Q77 PolarHBondContact O-N 3.5Å; E74-Q77 PolarHBondContact O-N 3.36Å; R75-Q77 VanDerWaalsContact C-N 3.35Å; R75-Q77 PolarHBondContact O-N 3.32Å; Q77-E79 PolarHBondContact O-N 3.49Å; Q77-L80 PolarHBondContact O-N 2.87Å; Q77-D81 PolarHBondContact NE2-OD1 2.92Å; Q77-D81 WeakPolarHBondContact O-CB 3.29Å; Q77-D81 PolarHBondContact O-N 3.32Å |
| 78 | K | 92.1 | Very high | 89.3 | Confident | 147 Ų | 147 | 90.9 Ų | 90.9 | 64% | 0.639 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -60.9 | -41.6 | 175 | -73.7 | 175.1 | -178.5 | 172.6 | 0 | 112.8 | E74 R75 A82 | E74-K78 WeakPolarHBondContact O-CG 3.37Å; E74-K78 PolarHBondContact O-N 2.93Å; R75-K78 PolarHBondContact O-N 3.45Å; K78-A82 VanDerWaalsContact O-CB 3.29Å; K78-A82 WeakPolarHBondContact O-CB 3.35Å; K78-A82 PolarHBondContact O-N 2.95Å |
| 79 | E | 93.1 | Very high | 90.5 | Very high | 82 Ų | 82 | 93.2 Ų | 93.2 | 38% | 0.383 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -65.9 | -37.8 | 176.3 | -75.2 | 177.5 | -165.5 | 0 | 0 | 111.9 | R75 R76 Q77 K83 | R75-E79 IonicContact CZ-OE1 3.34Å; R75-E79 IonicContact NE-OE1 3.92Å; R75-E79 IonicContact NH1-OE1 2.88Å; R75-E79 PolarHBondContact NH1-OE1 3.19Å; R75-E79 WeakPolarHBondContact O-CB 3.5Å; R75-E79 WeakPolarHBondContact O-CG 3.36Å; R75-E79 PolarHBondContact O-N 2.91Å; R76-E79 PolarHBondContact O-N 3.08Å; Q77-E79 PolarHBondContact O-N 3.49Å; E79-K83 WeakPolarHBondContact O-CB 3.21Å; E79-K83 VanDerWaalsContact O-CG 3.32Å; E79-K83 WeakPolarHBondContact O-CG 3.34Å; E79-K83 PolarHBondContact O-N 2.84Å |
| 80 | L | 93.2 | Very high | 90.9 | Very high | 105 Ų | 105 | 96.2 Ų | 96.2 | 55% | 0.55 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -69 | -44.8 | 175.9 | -73 | 170.2 | 0 | 0 | 0 | 111.5 | R76 Q77 A82 K83 A84 | R76-L80 WeakPolarHBondContact O-CB 3.36Å; R76-L80 WeakPolarHBondContact O-CG 3.5Å; R76-L80 PolarHBondContact O-N 2.84Å; Q77-L80 PolarHBondContact O-N 2.87Å; L80-A82 VanDerWaalsContact C-N 3.33Å; L80-A82 PolarHBondContact O-N 3.21Å; L80-K83 PolarHBondContact O-N 3.44Å; L80-A84 WeakPolarHBondContact O-CB 3.45Å; L80-A84 PolarHBondContact O-N 2.74Å |
| 81 | D | 94.1 | Very high | 91 | Very high | 91 Ų | 91 | 96.1 Ų | 96.1 | 49% | 0.487 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -63.7 | -40.1 | 177.7 | -65 | -20.8 | 0 | 0 | 0 | 111 | Q77 A84 A85 | Q77-D81 PolarHBondContact NE2-OD1 2.92Å; Q77-D81 WeakPolarHBondContact O-CB 3.29Å; Q77-D81 PolarHBondContact O-N 3.32Å; D81-A84 PolarHBondContact O-N 2.71Å; D81-A85 WeakPolarHBondContact O-CB 3.46Å; D81-A85 PolarHBondContact O-N 3.37Å |
| 82 | A | 93.9 | Very high | 90.9 | Very high | 62 Ų | 62 | 99.3 Ų | 99.3 | 51% | 0.512 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -64.3 | -41.3 | 174.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | K78 L80 A85 E86 | K78-A82 VanDerWaalsContact O-CB 3.29Å; K78-A82 WeakPolarHBondContact O-CB 3.35Å; K78-A82 PolarHBondContact O-N 2.95Å; L80-A82 VanDerWaalsContact C-N 3.33Å; L80-A82 PolarHBondContact O-N 3.21Å; A82-A85 PolarHBondContact O-N 3.47Å; A82-E86 WeakPolarHBondContact O-CB 3.38Å; A82-E86 PolarHBondContact O-N 2.87Å |
| 83 | K | 95.1 | Very high | 90.8 | Very high | 146 Ų | 146 | 102.5 Ų | 102.5 | 64% | 0.635 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -67.2 | -37.4 | 174.9 | -76.9 | 177.8 | -179.7 | 177.6 | 0 | 112.1 | E79 L80 L87 | E79-K83 WeakPolarHBondContact O-CB 3.21Å; E79-K83 VanDerWaalsContact O-CG 3.32Å; E79-K83 WeakPolarHBondContact O-CG 3.34Å; E79-K83 PolarHBondContact O-N 2.84Å; L80-K83 PolarHBondContact O-N 3.44Å; K83-L87 VanDerWaalsContact O-CB 3.29Å; K83-L87 WeakPolarHBondContact O-CB 3.35Å; K83-L87 PolarHBondContact O-N 3.34Å |
| 84 | A | 92.5 | Very high | 90.6 | Very high | 58 Ų | 58 | 103.7 Ų | 103.7 | 48% | 0.479 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -65.4 | -42.1 | 175.5 | 0 | 0 | 0 | 0 | 0 | 111.4 | L80 D81 L87 A88 | L80-A84 WeakPolarHBondContact O-CB 3.45Å; L80-A84 PolarHBondContact O-N 2.74Å; D81-A84 PolarHBondContact O-N 2.71Å; A84-L87 PolarHBondContact O-N 2.83Å; A84-A88 WeakPolarHBondContact O-CB 3.46Å; A84-A88 PolarHBondContact O-N 2.95Å |
| 85 | A | 92.5 | Very high | 90.1 | Very high | 65 Ų | 65 | 105.5 Ų | 105.5 | 54% | 0.537 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -65.1 | -42.5 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | D81 A82 A88 R89 | D81-A85 WeakPolarHBondContact O-CB 3.46Å; D81-A85 PolarHBondContact O-N 3.37Å; A82-A85 PolarHBondContact O-N 3.47Å; A85-A88 PolarHBondContact O-N 3.47Å; A85-R89 PolarHBondContact O-N 2.92Å |
| 86 | E | 93.1 | Very high | 89.6 | Confident | 60 Ų | 60 | 105.5 Ų | 105.5 | 28% | 0.28 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -64.8 | -40 | 175.4 | 177.6 | 60.5 | -164.2 | 0 | 0 | 111.8 | A82 R89 R90 | A82-E86 WeakPolarHBondContact O-CB 3.38Å; A82-E86 PolarHBondContact O-N 2.87Å; E86-R89 PolarHBondContact O-N 3.46Å; E86-R89 IonicContact OE1-CZ 3.95Å; E86-R89 IonicContact OE1-NH2 2.79Å; E86-R89 PolarHBondContact OE1-NH2 3Å; E86-R89 IonicContact OE2-CZ 2.92Å; E86-R89 VanDerWaalsContact OE2-CZ 3.22Å; E86-R89 IonicContact OE2-NE 2.74Å; E86-R89 PolarHBondContact OE2-NE 2.85Å; E86-R89 IonicContact OE2-NH2 3.44Å; E86-R89 PolarHBondContact OE2-NH2 2.84Å; E86-R90 WeakPolarHBondContact O-CG 3.46Å; E86-R90 PolarHBondContact O-N 2.85Å; E86-R90 VanDerWaalsContact O-N 3.1Å; E86-R90 IonicContact OE1-CZ 3.19Å; E86-R90 IonicContact OE1-NE 3.67Å; E86-R90 PolarHBondContact OE1-NE 3.43Å; E86-R90 IonicContact OE1-NH2 3.83Å; E86-R90 PolarHBondContact OE1-NH2 3.46Å; E86-R90 VanDerWaalsContact OE1-NH2 3.13Å |
| 87 | L | 91.2 | Very high | 88.8 | Confident | 100 Ų | 100 | 107.7 Ų | 107.7 | 52% | 0.524 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -64.8 | -45.3 | 176.6 | -170 | 69.5 | 0 | 0 | 0 | 111 | K83 A84 R89 R90 E91 | K83-L87 VanDerWaalsContact O-CB 3.29Å; K83-L87 WeakPolarHBondContact O-CB 3.35Å; K83-L87 PolarHBondContact O-N 3.34Å; A84-L87 PolarHBondContact O-N 2.83Å; L87-R89 VanDerWaalsContact C-N 3.33Å; L87-R89 PolarHBondContact O-N 3.35Å; L87-R90 PolarHBondContact O-N 3.23Å; L87-R90 VanDerWaalsContact O-N 3.16Å; L87-E91 WeakPolarHBondContact O-CG 3.29Å; L87-E91 PolarHBondContact O-N 3.34Å |
| 88 | A | 92 | Very high | 87.9 | Confident | 42 Ų | 42 | 107.9 Ų | 107.9 | 35% | 0.347 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -59 | -43.1 | 176.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | A84 A85 R90 E91 E92 | A84-A88 WeakPolarHBondContact O-CB 3.46Å; A84-A88 PolarHBondContact O-N 2.95Å; A85-A88 PolarHBondContact O-N 3.47Å; A88-R90 PolarHBondContact O-N 3.04Å; A88-E91 PolarHBondContact O-N 2.96Å; A88-E92 WeakPolarHBondContact O-CG 3.13Å; A88-E92 PolarHBondContact O-N 3.2Å |
| 89 | R | 91 | Very high | 86.9 | Confident | 127 Ų | 127 | 105.6 Ų | 105.6 | 48% | 0.479 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -60.3 | -44.3 | 175.3 | -172.2 | -174.6 | 67.3 | 169.5 | 0 | 112 | A85 E86 L87 E92 E93 | A85-R89 PolarHBondContact O-N 2.92Å; E86-R89 PolarHBondContact O-N 3.46Å; E86-R89 IonicContact OE1-CZ 3.95Å; E86-R89 IonicContact OE1-NH2 2.79Å; E86-R89 PolarHBondContact OE1-NH2 3Å; E86-R89 IonicContact OE2-CZ 2.92Å; E86-R89 VanDerWaalsContact OE2-CZ 3.22Å; E86-R89 IonicContact OE2-NE 2.74Å; E86-R89 PolarHBondContact OE2-NE 2.85Å; E86-R89 IonicContact OE2-NH2 3.44Å; E86-R89 PolarHBondContact OE2-NH2 2.84Å; L87-R89 VanDerWaalsContact C-N 3.33Å; L87-R89 PolarHBondContact O-N 3.35Å; R89-E92 PolarHBondContact O-N 3.43Å; R89-E93 IonicContact NE-OE1 3.08Å; R89-E93 WeakPolarHBondContact O-CG 3.16Å; R89-E93 PolarHBondContact O-N 2.85Å |
| 90 | R | 90.7 | Very high | 85.9 | Confident | 147 Ų | 147 | 109.3 Ų | 109.3 | 56% | 0.555 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -66.8 | -38 | 177.7 | -71 | -179.9 | -173.6 | -161.1 | 0.2 | 112.3 | E86 L87 A88 E92 E93 Q94 | E86-R90 WeakPolarHBondContact O-CG 3.46Å; E86-R90 PolarHBondContact O-N 2.85Å; E86-R90 VanDerWaalsContact O-N 3.1Å; E86-R90 IonicContact OE1-CZ 3.19Å; E86-R90 IonicContact OE1-NE 3.67Å; E86-R90 PolarHBondContact OE1-NE 3.43Å; E86-R90 IonicContact OE1-NH2 3.83Å; E86-R90 PolarHBondContact OE1-NH2 3.46Å; E86-R90 VanDerWaalsContact OE1-NH2 3.13Å; L87-R90 PolarHBondContact O-N 3.23Å; L87-R90 VanDerWaalsContact O-N 3.16Å; A88-R90 PolarHBondContact O-N 3.04Å; R90-E92 VanDerWaalsContact C-N 3.34Å; R90-E93 PolarHBondContact O-N 3.27Å; R90-Q94 VanDerWaalsContact O-CB 3.26Å; R90-Q94 WeakPolarHBondContact O-CB 3.29Å; R90-Q94 PolarHBondContact O-N 2.92Å |
| 91 | E | 84.7 | Confident | 84.5 | Confident | 109 Ų | 109 | 110.2 Ų | 110.2 | 51% | 0.509 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -63.1 | -41.6 | 174 | -74.3 | 178.2 | -178.7 | 0 | 0 | 110.9 | L87 A88 Q94 R95 | L87-E91 WeakPolarHBondContact O-CG 3.29Å; L87-E91 PolarHBondContact O-N 3.34Å; A88-E91 PolarHBondContact O-N 2.96Å; E91-Q94 PolarHBondContact O-N 3.45Å; E91-R95 WeakPolarHBondContact O-CB 3.12Å; E91-R95 VanDerWaalsContact O-CG 3.22Å; E91-R95 WeakPolarHBondContact O-CG 3.29Å; E91-R95 PolarHBondContact O-N 3.22Å |
| 92 | E | 83.8 | Confident | 82.9 | Confident | 127 Ų | 127 | 112.4 Ų | 112.4 | 59% | 0.593 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -63.7 | -46.9 | 174 | -73.6 | 177.9 | -178.9 | 0 | 0 | 112.5 | A88 R89 R90 Q94 R95 M96 | A88-E92 WeakPolarHBondContact O-CG 3.13Å; A88-E92 PolarHBondContact O-N 3.2Å; R89-E92 PolarHBondContact O-N 3.43Å; R90-E92 VanDerWaalsContact C-N 3.34Å; E92-Q94 VanDerWaalsContact C-N 3.28Å; E92-Q94 PolarHBondContact O-N 3.07Å; E92-R95 PolarHBondContact O-N 2.88Å; E92-M96 WeakPolarHBondContact O-CG 3.38Å; E92-M96 PolarHBondContact O-N 3.46Å |
| 93 | E | 85.7 | Confident | 81.1 | Confident | 112 Ų | 112 | 112.5 Ų | 112.5 | 52% | 0.523 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -59.6 | -40.6 | 175.5 | -74.1 | 174 | -169.2 | 0 | 0 | 111.8 | R89 R90 M96 R97 | R89-E93 IonicContact NE-OE1 3.08Å; R89-E93 WeakPolarHBondContact O-CG 3.16Å; R89-E93 PolarHBondContact O-N 2.85Å; R90-E93 PolarHBondContact O-N 3.27Å; E93-M96 PolarHBondContact O-N 3.15Å; E93-R97 WeakPolarHBondContact O-CB 3.46Å; E93-R97 PolarHBondContact O-N 2.88Å |
| 94 | Q | 81.5 | Confident | 79.1 | Confident | 118 Ų | 118 | 111.1 Ų | 111.1 | 55% | 0.551 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -67 | -42.9 | 175.8 | -174.2 | 171.8 | -31.1 | 0 | 0 | 111.4 | R90 E91 E92 M96 R97 E98 | R90-Q94 VanDerWaalsContact O-CB 3.26Å; R90-Q94 WeakPolarHBondContact O-CB 3.29Å; R90-Q94 PolarHBondContact O-N 2.92Å; E91-Q94 PolarHBondContact O-N 3.45Å; E92-Q94 VanDerWaalsContact C-N 3.28Å; E92-Q94 PolarHBondContact O-N 3.07Å; Q94-M96 VanDerWaalsContact C-N 3.35Å; Q94-M96 PolarHBondContact O-N 3.23Å; Q94-R97 PolarHBondContact O-N 2.97Å; Q94-E98 PolarHBondContact NE2-OE1 2.91Å; Q94-E98 VanDerWaalsContact NE2-OE1 3.11Å; Q94-E98 WeakPolarHBondContact O-CG 3.31Å; Q94-E98 PolarHBondContact O-N 3.47Å |
| 95 | R | 77.8 | Confident | 77.1 | Confident | 156 Ų | 156 | 110.7 Ų | 110.7 | 59% | 0.589 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -60.5 | -43.7 | 175.1 | -74.8 | 179.8 | 90 | -128.3 | -3.5 | 111.5 | E91 E92 R97 E98 E99 | E91-R95 WeakPolarHBondContact O-CB 3.12Å; E91-R95 VanDerWaalsContact O-CG 3.22Å; E91-R95 WeakPolarHBondContact O-CG 3.29Å; E91-R95 PolarHBondContact O-N 3.22Å; E92-R95 PolarHBondContact O-N 2.88Å; R95-R97 VanDerWaalsContact C-N 3.31Å; R95-R97 PolarHBondContact O-N 3.47Å; R95-E98 PolarHBondContact O-N 3.36Å; R95-E99 WeakPolarHBondContact O-CB 3.33Å; R95-E99 WeakPolarHBondContact O-CG 3.39Å; R95-E99 PolarHBondContact O-N 3.26Å |
| 96 | M | 79.9 | Confident | 75 | Confident | 129 Ų | 129 | 117.1 Ų | 117.1 | 64% | 0.635 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -59.6 | -42.4 | 175 | -73.6 | -68.5 | -147 | 0 | 0 | 111.7 | E92 E93 Q94 E99 Q100 | E92-M96 WeakPolarHBondContact O-CG 3.38Å; E92-M96 PolarHBondContact O-N 3.46Å; E93-M96 PolarHBondContact O-N 3.15Å; Q94-M96 VanDerWaalsContact C-N 3.35Å; Q94-M96 PolarHBondContact O-N 3.23Å; M96-E99 PolarHBondContact O-N 3.04Å; M96-Q100 WeakPolarHBondContact O-CB 3.32Å; M96-Q100 PolarHBondContact O-N 3.02Å |
| 97 | R | 76.2 | Confident | 72.9 | Confident | 175 Ų | 175 | 117.9 Ų | 117.9 | 66% | 0.66 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -67.3 | -38.2 | 177 | -168.3 | 176.4 | -175.5 | 167.5 | 1.8 | 112.4 | E93 Q94 R95 Q100 N101 | E93-R97 WeakPolarHBondContact O-CB 3.46Å; E93-R97 PolarHBondContact O-N 2.88Å; Q94-R97 PolarHBondContact O-N 2.97Å; R95-R97 VanDerWaalsContact C-N 3.31Å; R95-R97 PolarHBondContact O-N 3.47Å; R97-Q100 PolarHBondContact O-N 3.27Å; R97-N101 WeakPolarHBondContact O-CB 3.23Å; R97-N101 PolarHBondContact O-N 3.14Å |
| 98 | E | 72.9 | Confident | 71 | Confident | 107 Ų | 107 | 116 Ų | 116 | 50% | 0.5 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -66.7 | -38.1 | 174.5 | -73.9 | 174.9 | -167.7 | 0 | 0 | 111.9 | Q94 R95 R102 | Q94-E98 PolarHBondContact NE2-OE1 2.91Å; Q94-E98 VanDerWaalsContact NE2-OE1 3.11Å; Q94-E98 WeakPolarHBondContact O-CG 3.31Å; Q94-E98 PolarHBondContact O-N 3.47Å; R95-E98 PolarHBondContact O-N 3.36Å; E98-R102 WeakPolarHBondContact O-CB 3.44Å; E98-R102 PolarHBondContact O-N 3.02Å |
| 99 | E | 70.7 | Confident | 69.3 | Low | 99 Ų | 99 | 118.6 Ų | 118.6 | 46% | 0.463 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -66.6 | -41.8 | 173.6 | -74.7 | 177.5 | -177.2 | 0 | 0 | 111.7 | R95 M96 R102 | R95-E99 WeakPolarHBondContact O-CB 3.33Å; R95-E99 WeakPolarHBondContact O-CG 3.39Å; R95-E99 PolarHBondContact O-N 3.26Å; M96-E99 PolarHBondContact O-N 3.04Å; E99-R102 VanDerWaalsContact O-CB 3.31Å; E99-R102 WeakPolarHBondContact O-CB 3.46Å; E99-R102 PolarHBondContact O-N 3.35Å |
| 100 | Q | 71.8 | Confident | 68 | Low | 161 Ų | 161 | 114.9 Ų | 114.9 | 75% | 0.752 | 58% | 0.579 | S | S | * | * | H | α-helix | trans | -66.7 | -40.6 | 176.4 | -173.1 | 177.9 | 30 | 0 | 0 | 112.7 | M96 R97 R102 | M96-Q100 WeakPolarHBondContact O-CB 3.32Å; M96-Q100 PolarHBondContact O-N 3.02Å; R97-Q100 PolarHBondContact O-N 3.27Å; Q100-R102 VanDerWaalsContact C-N 3.27Å; Q100-R102 PolarHBondContact O-N 3Å |
| 101 | N | 62.5 | Low | 66.9 | Low | 123 Ų | 123 | 110.2 Ų | 110.2 | 66% | 0.658 | 57% | 0.571 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82 | -2.8 | 177.3 | -83.9 | 7.3 | 0 | 0 | 0 | 113.4 | R97 | R97-N101 WeakPolarHBondContact O-CB 3.23Å; R97-N101 PolarHBondContact O-N 3.14Å |
| 102 | R | 61.7 | Low | 66.1 | Low | 138 Ų | 138 | 110.8 Ų | 110.8 | 52% | 0.521 | 57% | 0.572 | S | S | . | * | S | Bend | trans | -68.1 | 127.4 | 175.4 | -171.2 | -175 | -67.7 | -153.1 | 2.6 | 108.6 | E98 E99 Q100 V104 | E98-R102 WeakPolarHBondContact O-CB 3.44Å; E98-R102 PolarHBondContact O-N 3.02Å; E99-R102 VanDerWaalsContact O-CB 3.31Å; E99-R102 WeakPolarHBondContact O-CB 3.46Å; E99-R102 PolarHBondContact O-N 3.35Å; Q100-R102 VanDerWaalsContact C-N 3.27Å; Q100-R102 PolarHBondContact O-N 3Å; R102-V104 PolarHBondContact O-N 3.39Å |
| 103 | P | 56.5 | Low | 66 | Low | 64 Ų | 64 | 108 Ų | 108 | 42% | 0.416 | 56% | 0.561 | S | S | . | * | trans | -65.4 | 105.5 | 174.6 | 23.6 | -29.5 | 0 | 0 | 0 | 109.9 | S105 Y128 | P103-S105 PolarHBondContact O-N 2.93Å; P103-Y128 HydrophobicContact CG-CE2 4.49Å; P103-Y128 WeakPolarHBondContact CG-OH 3.27Å | ||
| 104 | V | 53.2 | Low | 65.6 | Low | 116 Ų | 116 | 104.1 Ų | 104.1 | 70% | 0.703 | 54% | 0.542 | S | S | * | . | trans | -81.8 | 99.3 | 170.2 | -178.8 | 0 | 0 | 0 | 0 | 107.3 | R102 | R102-V104 PolarHBondContact O-N 3.39Š| ||
| 105 | S | 49.2 | Very low | 65.1 | Low | 49 Ų | 49 | 100 Ų | 100 | 34% | 0.343 | 53% | 0.525 | S | S | . | . | trans | -77.7 | 153.8 | 160.6 | -94.2 | 0 | 0 | 0 | 0 | 109.9 | P103 G107 G108 V109 A111 | P103-S105 PolarHBondContact O-N 2.93Å; S105-G107 PolarHBondContact O-N 2.91Å; S105-G107 VanDerWaalsContact O-N 3.09Å; S105-G108 PolarHBondContact O-N 3.43Å; S105-V109 VanDerWaalsContact CB-O 3.3Å; S105-V109 WeakPolarHBondContact CB-O 3.44Å; S105-A111 WeakPolarHBondContact OG-CB 3.28Å | ||
| 106 | Q | 48.9 | Very low | 64.6 | Low | 200 Ų | 200 | 97.2 Ų | 97.2 | 94% | 0.935 | 53% | 0.527 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -39.1 | 115.9 | -179.4 | -74 | 179.1 | -18.5 | 0 | 0 | 111.1 | ||
| 107 | G | 48.6 | Very low | 63.8 | Low | 76 Ų | 76 | 94.5 Ų | 94.5 | 78% | 0.784 | 52% | 0.515 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 94.8 | 10.4 | 178.8 | 0 | 0 | 0 | 0 | 0 | 116.6 | S105 V109 | S105-G107 PolarHBondContact O-N 2.91Å; S105-G107 VanDerWaalsContact O-N 3.09Å; G107-V109 PolarHBondContact O-N 2.81Å |
| 108 | G | 51 | Low | 63.2 | Low | 61 Ų | 61 | 89.2 Ų | 89.2 | 63% | 0.629 | 50% | 0.504 | S | S | * | . | S | Bend | trans | 76.5 | 3.7 | 175.3 | 0 | 0 | 0 | 0 | 0 | 114.4 | S105 | S105-G108 PolarHBondContact O-N 3.43Š|
| 109 | V | 56.8 | Low | 63 | Low | 96 Ų | 96 | 90.3 Ų | 90.3 | 58% | 0.582 | 52% | 0.523 | S | S | * | . | P | Polyproline II helix | trans | -93.4 | 119.8 | 173.6 | -177.2 | 0 | 0 | 0 | 0 | 108.1 | S105 G107 A111 | S105-V109 VanDerWaalsContact CB-O 3.3Å; S105-V109 WeakPolarHBondContact CB-O 3.44Å; G107-V109 PolarHBondContact O-N 2.81Å; V109-A111 PolarHBondContact O-N 3.01Å; V109-A111 VanDerWaalsContact O-N 3.13Å |
| 110 | I | 63.7 | Low | 63.1 | Low | 50 Ų | 50 | 93.9 Ų | 93.9 | 26% | 0.256 | 54% | 0.537 | S | S | . | . | P | Polyproline II helix | trans | -55.8 | 119.4 | 172.8 | -60 | 171.5 | 0 | 0 | 0 | 108 | K112 Y128 | I110-K112 PolarHBondContact O-N 3.34Å; I110-K112 VanDerWaalsContact O-N 3.16Å; I110-Y128 HydrophobicContact CG2-CD1 3.77Å; I110-Y128 HydrophobicContact CG2-CD2 3.34Å; I110-Y128 HydrophobicContact CG2-CE1 4.06Å; I110-Y128 HydrophobicContact CG2-CE2 3.65Å; I110-Y128 HydrophobicContact CG2-CG 3.38Å |
| 111 | A | 67.6 | Low | 62.5 | Low | 48 Ų | 48 | 88.1 Ų | 88.1 | 40% | 0.397 | 51% | 0.514 | S | S | . | . | P | Polyproline II helix | trans | -61.7 | 120.4 | 179.2 | 0 | 0 | 0 | 0 | 0 | 110.1 | S105 V109 N113 Y128 | S105-A111 WeakPolarHBondContact OG-CB 3.28Å; V109-A111 PolarHBondContact O-N 3.01Å; V109-A111 VanDerWaalsContact O-N 3.13Å; A111-N113 PolarHBondContact O-N 2.87Å; A111-Y128 WeakPolarHBondContact O-CD2 3.5Å |
| 112 | K | 68.6 | Low | 62.8 | Low | 121 Ų | 121 | 88.2 Ų | 88.2 | 53% | 0.526 | 52% | 0.522 | S | S | . | . | P | Polyproline II helix | trans | -64.8 | 130.4 | 174.7 | -60.1 | 174.9 | 176.9 | 108.8 | 0 | 108.3 | I110 P125 C126 | I110-K112 PolarHBondContact O-N 3.34Å; I110-K112 VanDerWaalsContact O-N 3.16Å; K112-P125 HydrophobicContact CB-CB 3.94Å; K112-P125 WeakPolarHBondContact CB-O 3.45Å; K112-P125 WeakPolarHBondContact CD-O 3.46Å; K112-P125 VanDerWaalsContact O-CB 3.31Å; K112-P125 WeakPolarHBondContact O-CB 3.32Å; K112-C126 WeakPolarHBondContact CD-O 3.46Å |
| 113 | N | 80.6 | Confident | 62.7 | Low | 68 Ų | 68 | 85 Ų | 85 | 36% | 0.364 | 52% | 0.52 | S | S | . | . | trans | -121.7 | -3.2 | -172.9 | 68 | -14.4 | 0 | 0 | 0 | 113.5 | A111 F127 Y128 Q129 | A111-N113 PolarHBondContact O-N 2.87Å; N113-F127 PolarHBondContact N-O 3.46Å; N113-F127 PolarHBondContact OD1-O 3.04Å; N113-Y128 WeakPolarHBondContact OD1-CA 3.39Å; N113-Q129 PolarHBondContact ND2-O 2.85Å; N113-Q129 PolarHBondContact OD1-N 3.1Å; N113-Q129 PolarHBondContact OD1-O 3.26Å | ||
| 114 | W | 78 | Confident | 63.1 | Low | 32 Ų | 32 | 87.1 Ų | 87.1 | 12% | 0.121 | 53% | 0.531 | C | S | . | . | B | Isolated β-bridge | trans | -138.1 | 143 | -174.9 | -162.8 | 95.3 | 0 | 0 | 0 | 112.2 | P125 C126 F127 Q129 Y147 W150 Y195 | W114-P125 CarbonylContact O-C 3.56Å; W114-C126 PolarHBondContact O-N 3.28Å; W114-F127 HydrophobicContact CB-CB 4.46Å; W114-F127 HydrophobicContact CE3-CB 4.35Å; W114-F127 AromaticContact CE3-CD2 3.91Å; W114-F127 HydrophobicContact CE3-CD2 3.91Å; W114-F127 HydrophobicContact CZ3-CD2 4.1Å; W114-F127 PolarHBondContact N-O 3.41Å; W114-F127 WeakPolarHBondContact O-CB 3.29Å; W114-F127 PolarHBondContact O-N 3.43Å; W114-Q129 HydrophobicContact CB-CB 4.14Å; W114-Q129 HydrophobicContact CG-CB 4.46Å; W114-Y147 HydrophobicContact CZ2-CE2 4.42Å; W114-Y147 AromaticContact NE1-CE2 3.81Å; W114-Y147 PolarHBondContact NE1-OH 3.03Å; W114-W150 AromaticContact CH2-CH2 3.62Å; W114-W150 HydrophobicContact CH2-CH2 3.62Å; W114-W150 HydrophobicContact CH2-CZ2 4.18Å; W114-W150 HydrophobicContact CH2-CZ3 4.19Å; W114-W150 AromaticContact CZ2-CH2 3.48Å; W114-W150 HydrophobicContact CZ2-CH2 3.48Å; W114-W150 VanDerWaalsContact CZ2-CH2 3.48Å; W114-W150 HydrophobicContact CZ2-CZ2 4.42Å; W114-W150 AromaticContact CZ2-CZ3 3.61Å; W114-W150 HydrophobicContact CZ2-CZ3 3.61Å; W114-Y195 HydrophobicContact CD2-CE2 4.12Å; W114-Y195 AromaticContact CD2-CZ 3.91Å; W114-Y195 AromaticContact CE2-CE2 3.89Å; W114-Y195 AromaticContact CE3-CE1 3.74Å; W114-Y195 HydrophobicContact CE3-CE1 3.74Å; W114-Y195 AromaticContact CE3-CE2 3.87Å; W114-Y195 HydrophobicContact CE3-CE2 3.87Å; W114-Y195 AromaticContact CE3-CZ 3.34Å; W114-Y195 VanDerWaalsContact CE3-OH 3.26Å; W114-Y195 AromaticContact CH2-CD1 3.86Å; W114-Y195 HydrophobicContact CH2-CD1 3.86Å; W114-Y195 AromaticContact CH2-CD2 3.27Å; W114-Y195 HydrophobicContact CH2-CD2 3.27Å; W114-Y195 AromaticContact CH2-CE1 3.79Å; W114-Y195 HydrophobicContact CH2-CE1 3.79Å; W114-Y195 AromaticContact CH2-CE2 3.17Å; W114-Y195 HydrophobicContact CH2-CE2 3.17Å; W114-Y195 AromaticContact CH2-CG 3.63Å; W114-Y195 HydrophobicContact CH2-CG 3.63Å; W114-Y195 AromaticContact CH2-CZ 3.46Å; W114-Y195 VanDerWaalsContact CH2-CZ 3.46Å; W114-Y195 AromaticContact CZ2-CD2 3.76Å; W114-Y195 HydrophobicContact CZ2-CD2 3.76Å; W114-Y195 AromaticContact CZ2-CE2 3.42Å; W114-Y195 HydrophobicContact CZ2-CE2 3.42Å; W114-Y195 VanDerWaalsContact CZ2-CE2 3.42Å; W114-Y195 AromaticContact CZ2-CZ 3.98Å; W114-Y195 AromaticContact CZ3-CD1 3.62Å; W114-Y195 HydrophobicContact CZ3-CD1 3.62Å; W114-Y195 AromaticContact CZ3-CD2 3.82Å; W114-Y195 HydrophobicContact CZ3-CD2 3.82Å; W114-Y195 AromaticContact CZ3-CE1 3.21Å; W114-Y195 HydrophobicContact CZ3-CE1 3.21Å; W114-Y195 AromaticContact CZ3-CE2 3.42Å; W114-Y195 HydrophobicContact CZ3-CE2 3.42Å; W114-Y195 VanDerWaalsContact CZ3-CE2 3.42Å; W114-Y195 AromaticContact CZ3-CG 3.91Å; W114-Y195 HydrophobicContact CZ3-CG 3.91Å; W114-Y195 AromaticContact CZ3-CZ 3.11Å |
| 115 | P | 71.9 | Confident | 63.8 | Low | 30 Ų | 30 | 83.8 Ų | 83.8 | 20% | 0.195 | 51% | 0.512 | C | S | . | . | S | Bend | cis | -69.2 | 144.9 | -7.3 | 27.2 | -31.5 | 0 | 0 | 0 | 111.3 | L117 | P115-L117 VanDerWaalsContact C-N 3.26Å; P115-L117 HydrophobicContact CB-CD2 4.42Å; P115-L117 HydrophobicContact CB-CG 4.18Å; P115-L117 HydrophobicContact CG-CD1 3.92Å; P115-L117 HydrophobicContact CG-CD2 4.45Å; P115-L117 HydrophobicContact CG-CG 3.94Å; P115-L117 PolarHBondContact O-N 3.34Å |
| 116 | P | 66 | Low | 64.9 | Low | 98 Ų | 98 | 84.7 Ų | 84.7 | 64% | 0.636 | 52% | 0.518 | S | S | * | . | trans | -74.2 | 85.6 | 174.6 | 31.2 | -33.3 | 0 | 0 | 0 | 108.2 | ||||
| 117 | L | 62.5 | Low | 66.1 | Low | 72 Ų | 72 | 78 Ų | 78 | 38% | 0.377 | 49% | 0.486 | S | S | . | . | trans | -87.5 | 140.2 | 176.1 | -63.5 | 172.9 | 0 | 0 | 0 | 109.2 | P115 C121 C123 | P115-L117 VanDerWaalsContact C-N 3.26Å; P115-L117 HydrophobicContact CB-CD2 4.42Å; P115-L117 HydrophobicContact CB-CG 4.18Å; P115-L117 HydrophobicContact CG-CD1 3.92Å; P115-L117 HydrophobicContact CG-CD2 4.45Å; P115-L117 HydrophobicContact CG-CG 3.94Å; P115-L117 PolarHBondContact O-N 3.34Å; L117-C121 HydrophobicContact CB-CB 3.93Å; L117-C121 HydrophobicContact CD1-CB 4.36Å; L117-C123 HydrophobicContact CD1-CB 3.39Å; L117-C123 WeakPolarHBondContact CD1-O 3.2Å | ||
| 118 | P | 64.4 | Low | 67.3 | Low | 65 Ų | 65 | 76.4 Ų | 76.4 | 42% | 0.422 | 46% | 0.456 | S | S | . | . | trans | -59.5 | 148.9 | 171.6 | 26.1 | -34 | 0 | 0 | 0 | 109.8 | F120 C121 | P118-F120 HydrophobicContact CB-CD1 3.59Å; P118-F120 HydrophobicContact CB-CE1 3.32Å; P118-F120 HydrophobicContact CB-CZ 4.05Å; P118-F120 HydrophobicContact CG-CD1 3.74Å; P118-F120 HydrophobicContact CG-CE1 3.1Å; P118-F120 HydrophobicContact CG-CE2 4.04Å; P118-F120 HydrophobicContact CG-CG 4.44Å; P118-F120 HydrophobicContact CG-CZ 3.27Å; P118-F120 PolarHBondContact O-N 3.37Å; P118-C121 WeakPolarHBondContact O-CB 3.46Å; P118-C121 PolarHBondContact O-N 2.88Å | ||
| 119 | S | 67.9 | Low | 68.5 | Low | 130 Ų | 130 | 74.2 Ų | 74.2 | 91% | 0.909 | 43% | 0.43 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -58.1 | -15 | -170.4 | 54.9 | 0 | 0 | 0 | 0 | 115.4 | C121 | S119-C121 VanDerWaalsContact C-N 3.34Š|
| 120 | F | 72.8 | Confident | 69.6 | Low | 173 Ų | 173 | 71.8 Ų | 71.8 | 76% | 0.759 | 41% | 0.414 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -77.3 | -16.5 | 175.1 | 68.4 | -104.4 | 0 | 0 | 0 | 113.8 | P118 | P118-F120 HydrophobicContact CB-CD1 3.59Å; P118-F120 HydrophobicContact CB-CE1 3.32Å; P118-F120 HydrophobicContact CB-CZ 4.05Å; P118-F120 HydrophobicContact CG-CD1 3.74Å; P118-F120 HydrophobicContact CG-CE1 3.1Å; P118-F120 HydrophobicContact CG-CE2 4.04Å; P118-F120 HydrophobicContact CG-CG 4.44Å; P118-F120 HydrophobicContact CG-CZ 3.27Å; P118-F120 PolarHBondContact O-N 3.37Å |
| 121 | C | 60.1 | Low | 70.3 | Confident | 40 Ų | 40 | 70.4 Ų | 70.4 | 27% | 0.27 | 41% | 0.406 | S | S | . | . | S | Bend | trans | -83.8 | 124.7 | 178.5 | -166.4 | 0 | 0 | 0 | 0 | 109.5 | L117 P118 S119 C123 | L117-C121 HydrophobicContact CB-CB 3.93Å; L117-C121 HydrophobicContact CD1-CB 4.36Å; P118-C121 WeakPolarHBondContact O-CB 3.46Å; P118-C121 PolarHBondContact O-N 2.88Å; S119-C121 VanDerWaalsContact C-N 3.34Å; C121-C123 PolarHBondContact O-N 2.84Å |
| 122 | P | 68.1 | Low | 70.9 | Confident | 126 Ų | 126 | 73.8 Ų | 73.8 | 82% | 0.818 | 41% | 0.414 | S | S | * | . | S | Bend | trans | -67.9 | -8.1 | -178.7 | 26.8 | -34.1 | 0 | 0 | 0 | 113.6 | T124 | P122-T124 PolarHBondContact O-N 3.4Š|
| 123 | C | 60.4 | Low | 71.4 | Confident | 71 Ų | 71 | 72.4 Ų | 72.4 | 48% | 0.48 | 42% | 0.416 | S | S | . | . | trans | -77.4 | 107.2 | 174.6 | -63.4 | 0 | 0 | 0 | 0 | 109.1 | L117 C121 | L117-C123 HydrophobicContact CD1-CB 3.39Å; L117-C123 WeakPolarHBondContact CD1-O 3.2Å; C121-C123 PolarHBondContact O-N 2.84Å | ||
| 124 | T | 64.2 | Low | 71.4 | Confident | 107 Ų | 107 | 70.4 Ų | 70.4 | 66% | 0.656 | 41% | 0.405 | S | S | * | . | trans | -64.7 | 153.3 | 168 | 53.6 | 0 | 0 | 0 | 0 | 110.1 | P122 C126 | P122-T124 PolarHBondContact O-N 3.4Å; T124-C126 PolarHBondContact O-N 2.9Å; T124-C126 PolarHBondContact O-SG 3.44Å; T124-C126 VanDerWaalsContact O-SG 3.4Å | ||
| 125 | P | 69.4 | Low | 71.6 | Confident | 46 Ų | 46 | 69.1 Ų | 69.1 | 30% | 0.299 | 40% | 0.4 | S | S | . | . | trans | -51 | 117.3 | 170.6 | -27.2 | 35.4 | 0 | 0 | 0 | 109.9 | K112 W114 | K112-P125 HydrophobicContact CB-CB 3.94Å; K112-P125 WeakPolarHBondContact CB-O 3.45Å; K112-P125 WeakPolarHBondContact CD-O 3.46Å; K112-P125 VanDerWaalsContact O-CB 3.31Å; K112-P125 WeakPolarHBondContact O-CB 3.32Å; W114-P125 CarbonylContact O-C 3.56Å | ||
| 126 | C | 71.7 | Confident | 72.2 | Confident | 68 Ų | 68 | 70.9 Ų | 70.9 | 46% | 0.459 | 41% | 0.41 | S | S | . | . | trans | -82 | -21.4 | -175.4 | -64.9 | 0 | 0 | 0 | 0 | 112.5 | K112 W114 T124 | K112-C126 WeakPolarHBondContact CD-O 3.46Å; W114-C126 PolarHBondContact O-N 3.28Å; T124-C126 PolarHBondContact O-N 2.9Å; T124-C126 PolarHBondContact O-SG 3.44Å; T124-C126 VanDerWaalsContact O-SG 3.4Å | ||
| 127 | F | 74.7 | Confident | 72.9 | Confident | 60 Ų | 60 | 70.2 Ų | 70.2 | 26% | 0.263 | 41% | 0.405 | S | S | . | . | B | Isolated β-bridge | trans | -136.7 | 139 | -161.5 | -68 | -49 | 0 | 0 | 0 | 111.4 | N113 W114 Y195 R200 | N113-F127 PolarHBondContact N-O 3.46Å; N113-F127 PolarHBondContact OD1-O 3.04Å; W114-F127 HydrophobicContact CB-CB 4.46Å; W114-F127 HydrophobicContact CE3-CB 4.35Å; W114-F127 AromaticContact CE3-CD2 3.91Å; W114-F127 HydrophobicContact CE3-CD2 3.91Å; W114-F127 HydrophobicContact CZ3-CD2 4.1Å; W114-F127 PolarHBondContact N-O 3.41Å; W114-F127 WeakPolarHBondContact O-CB 3.29Å; W114-F127 PolarHBondContact O-N 3.43Å; F127-Y195 AromaticContact CD2-CE1 3.66Å; F127-Y195 HydrophobicContact CD2-CE1 3.66Å; F127-Y195 HydrophobicContact CE2-CD1 4.28Å; F127-Y195 AromaticContact CE2-CE1 3.78Å; F127-Y195 HydrophobicContact CE2-CE1 3.78Å; F127-Y195 HydrophobicContact CG-CE1 4.46Å; F127-R200 VanDerWaalsContact CG-CZ 3.48Å |
| 128 | Y | 72.9 | Confident | 73.9 | Confident | 42 Ų | 42 | 73 Ų | 73 | 17% | 0.165 | 42% | 0.417 | C | S | . | . | trans | -83.7 | 131.9 | 158.4 | -173.6 | -109.2 | 0 | 0 | 0 | 108.9 | P103 I110 A111 N113 N130 E134 | P103-Y128 HydrophobicContact CG-CE2 4.49Å; P103-Y128 WeakPolarHBondContact CG-OH 3.27Å; I110-Y128 HydrophobicContact CG2-CD1 3.77Å; I110-Y128 HydrophobicContact CG2-CD2 3.34Å; I110-Y128 HydrophobicContact CG2-CE1 4.06Å; I110-Y128 HydrophobicContact CG2-CE2 3.65Å; I110-Y128 HydrophobicContact CG2-CG 3.38Å; A111-Y128 WeakPolarHBondContact O-CD2 3.5Å; N113-Y128 WeakPolarHBondContact OD1-CA 3.39Å; Y128-N130 HydrophobicContact CE1-CB 4.08Å; Y128-E134 WeakPolarHBondContact CD1-OE1 3.27Å; Y128-E134 HydrophobicContact CE1-CG 3.97Å; Y128-E134 WeakPolarHBondContact CE1-OE1 3.47Å | ||
| 129 | Q | 75.7 | Confident | 75.1 | Confident | 15 Ų | 15 | 72.9 Ų | 72.9 | 7% | 0.07 | 41% | 0.408 | C | S | . | . | trans | -149.6 | 113.2 | 173.8 | -178.3 | 142.2 | 57.9 | 0 | 0 | 109.1 | N113 W114 Y195 F199 Y203 | N113-Q129 PolarHBondContact ND2-O 2.85Å; N113-Q129 PolarHBondContact OD1-N 3.1Å; N113-Q129 PolarHBondContact OD1-O 3.26Å; W114-Q129 HydrophobicContact CB-CB 4.14Å; W114-Q129 HydrophobicContact CG-CB 4.46Å; Q129-Y195 PolarHBondContact OE1-OH 3.13Å; Q129-F199 VanDerWaalsContact NE2-CE1 3.29Å; Q129-Y203 HydrophobicContact CG-CE2 4.03Å; Q129-Y203 VanDerWaalsContact NE2-CG 3.28Å | ||
| 130 | N | 79.8 | Confident | 76.1 | Confident | 45 Ų | 45 | 69.3 Ų | 69.3 | 24% | 0.241 | 38% | 0.376 | C | S | . | . | trans | -134 | 101.9 | 170.2 | -172.1 | -20.4 | 0 | 0 | 0 | 109.2 | Y128 E132 T133 E134 Y203 | Y128-N130 HydrophobicContact CE1-CB 4.08Å; N130-E132 PolarHBondContact O-N 2.85Å; N130-E132 PolarHBondContact OD1-N 2.94Å; N130-T133 VanDerWaalsContact CB-OG1 3.28Å; N130-T133 WeakPolarHBondContact CB-OG1 3.29Å; N130-T133 PolarHBondContact ND2-OG1 3.19Å; N130-T133 PolarHBondContact OD1-N 3.3Å; N130-E134 WeakPolarHBondContact O-CB 3.41Å; N130-E134 WeakPolarHBondContact O-CG 3.39Å; N130-E134 PolarHBondContact O-N 2.78Å; N130-E134 VanDerWaalsContact O-N 3.07Å; N130-Y203 PolarHBondContact N-OH 3.31Å; N130-Y203 VanDerWaalsContact N-OH 3.08Å; N130-Y203 PolarHBondContact O-OH 2.86Å | ||
| 131 | I | 80.1 | Confident | 77 | Confident | 21 Ų | 21 | 71.5 Ų | 71.5 | 11% | 0.108 | 38% | 0.379 | C | S | . | . | H | α-helix | trans | -66.2 | -25.4 | -178.6 | -59 | 165.6 | 0 | 0 | 0 | 110.7 | I135 V143 K144 Y147 Y203 | I131-I135 HydrophobicContact CG2-CB 4.36Å; I131-I135 HydrophobicContact CG2-CG1 4.09Å; I131-I135 WeakPolarHBondContact O-CB 3.35Å; I131-V143 HydrophobicContact CD1-CG1 4.36Å; I131-V143 HydrophobicContact CG1-CG1 4.19Å; I131-V143 HydrophobicContact CG2-CB 4.32Å; I131-V143 HydrophobicContact CG2-CG1 4.1Å; I131-K144 HydrophobicContact CD1-CG 4.14Å; I131-K144 HydrophobicContact CG2-CG 3.78Å; I131-Y147 HydrophobicContact CD1-CG 4.44Å; I131-Y203 HydrophobicContact CB-CE2 4.49Å; I131-Y203 HydrophobicContact CG1-CD2 4.38Å; I131-Y203 HydrophobicContact CG1-CE2 3.78Å |
| 132 | E | 79.4 | Confident | 78.6 | Confident | 119 Ų | 119 | 70.3 Ų | 70.3 | 56% | 0.556 | 37% | 0.371 | S | S | * | . | H | α-helix | trans | -82.3 | -31.5 | -173.8 | -52.7 | -156.3 | 149.9 | 0 | 0 | 113.1 | N130 K140 K144 | N130-E132 PolarHBondContact O-N 2.85Å; N130-E132 PolarHBondContact OD1-N 2.94Å; E132-K140 WeakPolarHBondContact O-CE 3.46Å; E132-K140 PolarHBondContact O-NZ 3.02Å; E132-K144 IonicContact OE1-NZ 2.86Å; E132-K144 PolarHBondContact OE1-NZ 3.13Å |
| 133 | T | 78.2 | Confident | 79.9 | Confident | 92 Ų | 92 | 64.3 Ų | 64.3 | 56% | 0.564 | 33% | 0.332 | S | S | * | . | H | α-helix | trans | -97.1 | -35.3 | -179.8 | 58.2 | 0 | 0 | 0 | 0 | 112.7 | N130 | N130-T133 VanDerWaalsContact CB-OG1 3.28Å; N130-T133 WeakPolarHBondContact CB-OG1 3.29Å; N130-T133 PolarHBondContact ND2-OG1 3.19Å; N130-T133 PolarHBondContact OD1-N 3.3Å |
| 134 | E | 80.5 | Confident | 81.5 | Confident | 27 Ų | 27 | 64.2 Ų | 64.2 | 13% | 0.126 | 32% | 0.324 | C | S | . | . | H | α-helix | trans | -95.6 | -15.8 | -171.2 | -52.4 | -164.1 | 128.7 | 0 | 0 | 114.4 | Y128 N130 Y203 R207 | Y128-E134 WeakPolarHBondContact CD1-OE1 3.27Å; Y128-E134 HydrophobicContact CE1-CG 3.97Å; Y128-E134 WeakPolarHBondContact CE1-OE1 3.47Å; N130-E134 WeakPolarHBondContact O-CB 3.41Å; N130-E134 WeakPolarHBondContact O-CG 3.39Å; N130-E134 PolarHBondContact O-N 2.78Å; N130-E134 VanDerWaalsContact O-N 3.07Å; E134-Y203 WeakPolarHBondContact CB-OH 3.42Å; E134-Y203 WeakPolarHBondContact OE2-CE1 3.43Å; E134-Y203 PolarHBondContact OE2-OH 3.13Å; E134-R207 HydrophobicContact CB-CG 4.39Å; E134-R207 WeakPolarHBondContact O-CG 3.38Å; E134-R207 IonicContact OE1-CZ 2.81Å; E134-R207 IonicContact OE1-NE 3.13Å; E134-R207 IonicContact OE1-NH1 3.22Å; E134-R207 PolarHBondContact OE1-NH1 3.29Å; E134-R207 IonicContact OE1-NH2 3.44Å; E134-R207 PolarHBondContact OE1-NH2 3.33Å; E134-R207 IonicContact OE2-CZ 3.43Å; E134-R207 IonicContact OE2-NH1 2.85Å; E134-R207 PolarHBondContact OE2-NH1 3.37Å |
| 135 | I | 83.7 | Confident | 83 | Confident | 4 Ų | 4 | 62.6 Ų | 62.6 | 2% | 0.021 | 31% | 0.308 | C | S | . | . | S | Bend | trans | -104.1 | 131.8 | -179.7 | -55.5 | -61.9 | 0 | 0 | 0 | 109.7 | I131 K140 V143 Y203 F206 R207 | I131-I135 HydrophobicContact CG2-CB 4.36Å; I131-I135 HydrophobicContact CG2-CG1 4.09Å; I131-I135 WeakPolarHBondContact O-CB 3.35Å; I135-K140 HydrophobicContact CB-CG 4.21Å; I135-K140 HydrophobicContact CG2-CG 4.17Å; I135-K140 WeakPolarHBondContact O-CE 3.4Å; I135-V143 HydrophobicContact CD1-CG2 4.42Å; I135-V143 HydrophobicContact CG1-CG1 4.3Å; I135-V143 HydrophobicContact CG1-CG2 4.44Å; I135-V143 HydrophobicContact CG2-CB 4.49Å; I135-V143 HydrophobicContact CG2-CG2 4Å; I135-Y203 HydrophobicContact CD1-CD2 3.95Å; I135-Y203 HydrophobicContact CD1-CE2 3.77Å; I135-Y203 HydrophobicContact CD1-CG 4.44Å; I135-Y203 HydrophobicContact CG1-CD2 4.24Å; I135-Y203 HydrophobicContact CG1-CE2 3.72Å; I135-F206 HydrophobicContact CD1-CB 4.27Å; I135-F206 HydrophobicContact CG2-CB 4.47Å; I135-R207 HydrophobicContact CD1-CB 3.78Å |
| 136 | V | 82.7 | Confident | 84.3 | Confident | 68 Ų | 68 | 60.4 Ų | 60.4 | 41% | 0.412 | 29% | 0.293 | S | S | . | . | trans | -55.3 | 134.6 | 176.8 | -150.6 | 0 | 0 | 0 | 0 | 109.6 | E138 Y139 K140 | V136-E138 WeakPolarHBondContact CG1-OE2 3.32Å; V136-E138 PolarHBondContact O-N 3.2Å; V136-Y139 HydrophobicContact CB-CD2 4.17Å; V136-Y139 HydrophobicContact CG2-CD2 4.43Å; V136-Y139 PolarHBondContact O-N 3.3Å; V136-K140 PolarHBondContact O-N 2.82Å | ||
| 137 | P | 82.5 | Confident | 85.4 | Confident | 83 Ų | 83 | 59.5 Ų | 59.5 | 54% | 0.539 | 28% | 0.281 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -49.4 | -35 | -170 | -32.2 | 37.8 | 0 | 0 | 0 | 116.1 | Y139 K140 | P137-Y139 VanDerWaalsContact C-N 3.3Å; P137-Y139 PolarHBondContact O-N 2.87Å; P137-K140 PolarHBondContact O-N 2.69Å |
| 138 | E | 83.1 | Confident | 86.4 | Confident | 132 Ų | 132 | 63.3 Ų | 63.3 | 62% | 0.617 | 29% | 0.294 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -65.8 | -32.8 | -178 | -56.4 | 70.7 | -148.9 | 0 | 0 | 111.8 | V136 | V136-E138 WeakPolarHBondContact CG1-OE2 3.32Å; V136-E138 PolarHBondContact O-N 3.2Å |
| 139 | Y | 88.5 | Confident | 87.6 | Confident | 61 Ų | 61 | 61.6 Ų | 61.6 | 24% | 0.239 | 29% | 0.288 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -99.7 | -6.2 | -176.3 | -54.7 | -56.2 | 0 | 0 | 0 | 114 | V136 P137 R141 V142 V143 F206 I284 T288 | V136-Y139 HydrophobicContact CB-CD2 4.17Å; V136-Y139 HydrophobicContact CG2-CD2 4.43Å; V136-Y139 PolarHBondContact O-N 3.3Å; P137-Y139 VanDerWaalsContact C-N 3.3Å; P137-Y139 PolarHBondContact O-N 2.87Å; Y139-R141 VanDerWaalsContact C-N 3.27Å; Y139-R141 PolarHBondContact O-N 3.44Å; Y139-V142 PolarHBondContact O-N 3.18Å; Y139-V142 VanDerWaalsContact O-N 3.11Å; Y139-V143 PolarHBondContact O-N 2.97Å; Y139-F206 AromaticContact CD1-CD1 3.83Å; Y139-F206 HydrophobicContact CD1-CD1 3.83Å; Y139-F206 AromaticContact CD1-CE1 3.6Å; Y139-F206 HydrophobicContact CD1-CE1 3.6Å; Y139-F206 AromaticContact CD2-CD1 3.89Å; Y139-F206 HydrophobicContact CD2-CD1 3.89Å; Y139-F206 HydrophobicContact CD2-CE1 4.45Å; Y139-F206 HydrophobicContact CE1-CE1 4.16Å; Y139-F206 AromaticContact CG-CD1 3.47Å; Y139-F206 HydrophobicContact CG-CD1 3.47Å; Y139-F206 VanDerWaalsContact CG-CD1 3.47Å; Y139-F206 AromaticContact CG-CE1 3.78Å; Y139-F206 HydrophobicContact CG-CE1 3.78Å; Y139-F206 HydrophobicContact CG-CG 4.49Å; Y139-I284 HydrophobicContact CD1-CG2 4.22Å; Y139-I284 HydrophobicContact CE1-CG2 3.71Å; Y139-T288 WeakPolarHBondContact OH-CG2 3.27Å |
| 140 | K | 90.3 | Very high | 88.6 | Confident | 56 Ų | 56 | 61.6 Ų | 61.6 | 24% | 0.243 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -53.1 | -43.8 | 179.7 | -73 | -178.3 | -178.9 | 179 | 0 | 112.5 | E132 I135 V136 P137 V142 V143 K144 | E132-K140 WeakPolarHBondContact O-CE 3.46Å; E132-K140 PolarHBondContact O-NZ 3.02Å; I135-K140 HydrophobicContact CB-CG 4.21Å; I135-K140 HydrophobicContact CG2-CG 4.17Å; I135-K140 WeakPolarHBondContact O-CE 3.4Å; V136-K140 PolarHBondContact O-N 2.82Å; P137-K140 PolarHBondContact O-N 2.69Å; K140-V142 PolarHBondContact O-N 3.3Å; K140-V143 PolarHBondContact O-N 3.07Å; K140-K144 WeakPolarHBondContact O-CB 3.4Å; K140-K144 VanDerWaalsContact O-CG 3.28Å; K140-K144 WeakPolarHBondContact O-CG 3.24Å; K140-K144 PolarHBondContact O-N 3.26Å |
| 141 | R | 91.6 | Very high | 89.4 | Confident | 218 Ų | 218 | 62.6 Ų | 62.6 | 82% | 0.823 | 29% | 0.292 | S | S | * | . | H | α-helix | trans | -63.3 | -43.1 | -179.4 | -65.9 | -177.9 | -172.9 | 142.3 | 1.1 | 111.7 | Y139 K144 F145 | Y139-R141 VanDerWaalsContact C-N 3.27Å; Y139-R141 PolarHBondContact O-N 3.44Å; R141-K144 PolarHBondContact O-N 3.27Å; R141-F145 WeakPolarHBondContact O-CB 3.34Å; R141-F145 PolarHBondContact O-N 3.22Å |
| 142 | V | 93.4 | Very high | 90.2 | Very high | 16 Ų | 16 | 64.3 Ų | 64.3 | 10% | 0.097 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -65.2 | -43.8 | -179.6 | 180 | 0 | 0 | 0 | 0 | 110.6 | Y139 K140 F145 G146 F206 Y277 V281 I284 | Y139-V142 PolarHBondContact O-N 3.18Å; Y139-V142 VanDerWaalsContact O-N 3.11Å; K140-V142 PolarHBondContact O-N 3.3Å; V142-F145 PolarHBondContact O-N 3.27Å; V142-G146 PolarHBondContact O-N 3.06Å; V142-F206 HydrophobicContact CG1-CE2 4.02Å; V142-F206 HydrophobicContact CG1-CZ 3.95Å; V142-Y277 HydrophobicContact CG1-CE2 4.01Å; V142-Y277 PolarHBondContact O-OH 2.95Å; V142-V281 HydrophobicContact CG1-CG2 3.95Å; V142-I284 HydrophobicContact CB-CD1 4.43Å; V142-I284 HydrophobicContact CG1-CD1 3.96Å; V142-I284 HydrophobicContact CG2-CD1 3.67Å |
| 143 | V | 95 | Very high | 91 | Very high | 0 Ų | 0 | 58.9 Ų | 58.9 | 0% | 0 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -70.2 | -42.2 | 178.2 | 177.3 | 0 | 0 | 0 | 0 | 111.7 | I131 I135 Y139 K140 F145 G146 Y147 Y203 F206 | I131-V143 HydrophobicContact CD1-CG1 4.36Å; I131-V143 HydrophobicContact CG1-CG1 4.19Å; I131-V143 HydrophobicContact CG2-CB 4.32Å; I131-V143 HydrophobicContact CG2-CG1 4.1Å; I135-V143 HydrophobicContact CD1-CG2 4.42Å; I135-V143 HydrophobicContact CG1-CG1 4.3Å; I135-V143 HydrophobicContact CG1-CG2 4.44Å; I135-V143 HydrophobicContact CG2-CB 4.49Å; I135-V143 HydrophobicContact CG2-CG2 4Å; Y139-V143 PolarHBondContact O-N 2.97Å; K140-V143 PolarHBondContact O-N 3.07Å; V143-F145 VanDerWaalsContact C-N 3.32Å; V143-F145 PolarHBondContact O-N 3.44Å; V143-G146 PolarHBondContact O-N 3.13Å; V143-Y147 PolarHBondContact O-N 2.8Å; V143-Y203 HydrophobicContact CG1-CD2 3.75Å; V143-Y203 HydrophobicContact CG1-CE2 4.34Å; V143-F206 HydrophobicContact CG2-CB 3.67Å; V143-F206 HydrophobicContact CG2-CD2 3.6Å; V143-F206 HydrophobicContact CG2-CE2 4.44Å; V143-F206 HydrophobicContact CG2-CG 3.79Å |
| 144 | K | 94.3 | Very high | 91.9 | Very high | 69 Ų | 69 | 55.1 Ų | 55.1 | 30% | 0.3 | 26% | 0.259 | S | S | . | . | H | α-helix | trans | -59.1 | -44.2 | 173.9 | -76.6 | -173.1 | 178.3 | -169.9 | 0 | 110.9 | I131 E132 K140 R141 Y147 Y148 | I131-K144 HydrophobicContact CD1-CG 4.14Å; I131-K144 HydrophobicContact CG2-CG 3.78Å; E132-K144 IonicContact OE1-NZ 2.86Å; E132-K144 PolarHBondContact OE1-NZ 3.13Å; K140-K144 WeakPolarHBondContact O-CB 3.4Å; K140-K144 VanDerWaalsContact O-CG 3.28Å; K140-K144 WeakPolarHBondContact O-CG 3.24Å; K140-K144 PolarHBondContact O-N 3.26Å; R141-K144 PolarHBondContact O-N 3.27Å; K144-Y147 WeakPolarHBondContact O-CB 3.13Å; K144-Y147 PolarHBondContact O-N 2.74Å; K144-Y148 HydrophobicContact CB-CE2 4.38Å; K144-Y148 WeakPolarHBondContact O-CD2 3.22Å; K144-Y148 PolarHBondContact O-N 2.85Å |
| 145 | F | 95.9 | Very high | 92.7 | Very high | 72 Ų | 72 | 57 Ų | 57 | 32% | 0.316 | 27% | 0.274 | S | S | . | . | H | α-helix | trans | -60.4 | -46.6 | 175.8 | -176.8 | -86.5 | 0 | 0 | 0 | 111.8 | R141 V142 V143 Y147 Y148 L149 L273 W276 Y277 | R141-F145 WeakPolarHBondContact O-CB 3.34Å; R141-F145 PolarHBondContact O-N 3.22Å; V142-F145 PolarHBondContact O-N 3.27Å; V143-F145 VanDerWaalsContact C-N 3.32Å; V143-F145 PolarHBondContact O-N 3.44Å; F145-Y147 VanDerWaalsContact C-N 3.27Å; F145-Y147 PolarHBondContact O-N 3.19Å; F145-Y148 PolarHBondContact O-N 2.83Å; F145-L149 HydrophobicContact CE1-CD2 4.38Å; F145-L149 WeakPolarHBondContact O-CB 3.34Å; F145-L149 PolarHBondContact O-N 3.35Å; F145-L273 HydrophobicContact CE1-CG 4.33Å; F145-L273 HydrophobicContact CE2-CD2 4.5Å; F145-L273 HydrophobicContact CZ-CD1 3.73Å; F145-L273 HydrophobicContact CZ-CD2 3.81Å; F145-L273 HydrophobicContact CZ-CG 3.72Å; F145-W276 HydrophobicContact CD1-CZ3 4.45Å; F145-W276 HydrophobicContact CE1-CE3 4.32Å; F145-W276 AromaticContact CE1-CZ3 3.77Å; F145-W276 HydrophobicContact CE1-CZ3 3.77Å; F145-W276 HydrophobicContact CE2-CZ3 4.47Å; F145-W276 HydrophobicContact CZ-CE3 4.34Å; F145-W276 AromaticContact CZ-CZ3 3.77Å; F145-W276 HydrophobicContact CZ-CZ3 3.77Å; F145-Y277 AromaticContact CD1-CD2 3.34Å; F145-Y277 HydrophobicContact CD1-CD2 3.34Å; F145-Y277 AromaticContact CD1-CE2 3.51Å; F145-Y277 HydrophobicContact CD1-CE2 3.51Å; F145-Y277 HydrophobicContact CD1-CG 4.12Å; F145-Y277 AromaticContact CE1-CD2 3.57Å; F145-Y277 HydrophobicContact CE1-CD2 3.57Å; F145-Y277 HydrophobicContact CE1-CE2 4.22Å; F145-Y277 HydrophobicContact CE1-CG 4.03Å; F145-Y277 HydrophobicContact CG-CE2 4.44Å |
| 146 | G | 96.4 | Very high | 93.4 | Very high | 0 Ų | 0 | 57.1 Ų | 57.1 | 0% | 0 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -59 | -37.4 | 175.3 | 0 | 0 | 0 | 0 | 0 | 113 | V142 V143 L149 W150 W198 Y277 | V142-G146 PolarHBondContact O-N 3.06Å; V143-G146 PolarHBondContact O-N 3.13Å; G146-L149 PolarHBondContact O-N 2.86Å; G146-W150 PolarHBondContact O-N 2.85Å; G146-W198 WeakPolarHBondContact O-CH2 3.46Å; G146-Y277 WeakPolarHBondContact CA-OH 3.32Å |
| 147 | Y | 95.1 | Very high | 94.1 | Very high | 50 Ų | 50 | 54 Ų | 54 | 20% | 0.196 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -64.3 | -48.2 | 175.2 | 177.5 | -108.4 | 0 | 0 | 0 | 112.1 | W114 I131 V143 K144 F145 L149 W150 L151 F199 | W114-Y147 HydrophobicContact CZ2-CE2 4.42Å; W114-Y147 AromaticContact NE1-CE2 3.81Å; W114-Y147 PolarHBondContact NE1-OH 3.03Å; I131-Y147 HydrophobicContact CD1-CG 4.44Å; V143-Y147 PolarHBondContact O-N 2.8Å; K144-Y147 WeakPolarHBondContact O-CB 3.13Å; K144-Y147 PolarHBondContact O-N 2.74Å; F145-Y147 VanDerWaalsContact C-N 3.27Å; F145-Y147 PolarHBondContact O-N 3.19Å; Y147-L149 VanDerWaalsContact C-N 3.3Å; Y147-L149 PolarHBondContact O-N 3.16Å; Y147-W150 HydrophobicContact CD2-CE3 4.27Å; Y147-W150 HydrophobicContact CE2-CE3 4.09Å; Y147-W150 HydrophobicContact CE2-CZ3 4.08Å; Y147-W150 WeakPolarHBondContact O-CB 3.42Å; Y147-W150 PolarHBondContact O-N 3.39Å; Y147-L151 WeakPolarHBondContact O-CB 3.37Å; Y147-L151 PolarHBondContact O-N 2.83Å; Y147-F199 AromaticContact CD2-CE1 3.77Å; Y147-F199 HydrophobicContact CD2-CE1 3.77Å; Y147-F199 HydrophobicContact CD2-CE2 4.23Å; Y147-F199 AromaticContact CD2-CZ 3.55Å; Y147-F199 HydrophobicContact CD2-CZ 3.55Å; Y147-F199 HydrophobicContact CG-CE2 4.44Å; Y147-F199 HydrophobicContact CG-CZ 4.02Å |
| 148 | Y | 95.6 | Very high | 94.8 | Very high | 140 Ų | 140 | 53.3 Ų | 53.3 | 55% | 0.549 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -65.9 | -35.1 | 177.1 | -69.9 | -59.8 | 0 | 0 | 0 | 112 | K144 F145 L151 S152 | K144-Y148 HydrophobicContact CB-CE2 4.38Å; K144-Y148 WeakPolarHBondContact O-CD2 3.22Å; K144-Y148 PolarHBondContact O-N 2.85Å; F145-Y148 PolarHBondContact O-N 2.83Å; Y148-L151 HydrophobicContact CD1-CD2 4.45Å; Y148-L151 PolarHBondContact O-N 3.4Å; Y148-S152 WeakPolarHBondContact O-CB 3.26Å; Y148-S152 PolarHBondContact O-N 2.88Å; Y148-S152 PolarHBondContact O-OG 3.45Å |
| 149 | L | 97.5 | Very high | 95.6 | Very high | 6 Ų | 6 | 50.4 Ų | 50.4 | 3% | 0.031 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -61.9 | -45 | 174.3 | -173.6 | 68 | 0 | 0 | 0 | 111.5 | F145 G146 Y147 S152 Y153 F221 I270 L273 Y277 | F145-L149 HydrophobicContact CE1-CD2 4.38Å; F145-L149 WeakPolarHBondContact O-CB 3.34Å; F145-L149 PolarHBondContact O-N 3.35Å; G146-L149 PolarHBondContact O-N 2.86Å; Y147-L149 VanDerWaalsContact C-N 3.3Å; Y147-L149 PolarHBondContact O-N 3.16Å; L149-S152 PolarHBondContact O-N 3.19Å; L149-Y153 PolarHBondContact O-N 3.09Å; L149-F221 HydrophobicContact CD2-CZ 3.98Å; L149-I270 HydrophobicContact CD1-CG2 4.07Å; L149-L273 HydrophobicContact CD1-CB 4.21Å; L149-L273 HydrophobicContact CD1-CD2 3.76Å; L149-L273 HydrophobicContact CD1-CG 3.97Å; L149-Y277 HydrophobicContact CD2-CD1 3.91Å; L149-Y277 HydrophobicContact CD2-CG 4.04Å |
| 150 | W | 97.1 | Very high | 96 | Very high | 15 Ų | 15 | 47.6 Ų | 47.6 | 6% | 0.057 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -60.1 | -45.2 | 172.4 | 172.4 | 77.3 | 0 | 0 | 0 | 111.9 | W114 G146 Y147 S152 Y153 A154 V191 S194 Y195 W198 | W114-W150 AromaticContact CH2-CH2 3.62Å; W114-W150 HydrophobicContact CH2-CH2 3.62Å; W114-W150 HydrophobicContact CH2-CZ2 4.18Å; W114-W150 HydrophobicContact CH2-CZ3 4.19Å; W114-W150 AromaticContact CZ2-CH2 3.48Å; W114-W150 HydrophobicContact CZ2-CH2 3.48Å; W114-W150 VanDerWaalsContact CZ2-CH2 3.48Å; W114-W150 HydrophobicContact CZ2-CZ2 4.42Å; W114-W150 AromaticContact CZ2-CZ3 3.61Å; W114-W150 HydrophobicContact CZ2-CZ3 3.61Å; G146-W150 PolarHBondContact O-N 2.85Å; Y147-W150 HydrophobicContact CD2-CE3 4.27Å; Y147-W150 HydrophobicContact CE2-CE3 4.09Å; Y147-W150 HydrophobicContact CE2-CZ3 4.08Å; Y147-W150 WeakPolarHBondContact O-CB 3.42Å; Y147-W150 PolarHBondContact O-N 3.39Å; W150-S152 PolarHBondContact O-N 2.86Å; W150-Y153 WeakPolarHBondContact O-CB 3.4Å; W150-Y153 PolarHBondContact O-N 3.4Å; W150-A154 PolarHBondContact O-N 3.32Å; W150-V191 HydrophobicContact CZ2-CG1 4.08Å; W150-V191 PolarHBondContact NE1-O 2.66Å; W150-S194 PolarHBondContact NE1-OG 3.46Å; W150-Y195 HydrophobicContact CD2-CD2 4.14Å; W150-Y195 AromaticContact CE2-CD2 3.9Å; W150-Y195 HydrophobicContact CE3-CD2 4.34Å; W150-Y195 HydrophobicContact CH2-CD2 4.12Å; W150-Y195 AromaticContact CZ2-CD2 3.9Å; W150-Y195 HydrophobicContact CZ2-CD2 3.9Å; W150-Y195 HydrophobicContact CZ2-CG 4.14Å; W150-Y195 HydrophobicContact CZ3-CD2 4.34Å; W150-W198 HydrophobicContact CB-CH2 3.71Å; W150-W198 HydrophobicContact CB-CZ2 3.59Å; W150-W198 AromaticContact CD1-CZ2 3.92Å; W150-W198 HydrophobicContact CG-CZ2 4.15Å |
| 151 | L | 95.5 | Very high | 96.4 | Very high | 65 Ų | 65 | 46.3 Ų | 46.3 | 34% | 0.34 | 22% | 0.223 | S | C | . | . | H | α-helix | trans | -63.4 | -42.5 | 178.9 | -174.5 | 63.1 | 0 | 0 | 0 | 111.7 | Y147 Y148 Y153 A154 C155 | Y147-L151 WeakPolarHBondContact O-CB 3.37Å; Y147-L151 PolarHBondContact O-N 2.83Å; Y148-L151 HydrophobicContact CD1-CD2 4.45Å; Y148-L151 PolarHBondContact O-N 3.4Å; L151-Y153 VanDerWaalsContact C-N 3.32Å; L151-Y153 PolarHBondContact O-N 3.37Å; L151-A154 PolarHBondContact O-N 3.38Å; L151-C155 WeakPolarHBondContact O-CB 3.27Å; L151-C155 PolarHBondContact O-N 2.88Å; L151-C155 PolarHBondContact O-SG 3.11Å; L151-C155 VanDerWaalsContact O-SG 3.33Å |
| 152 | S | 97.5 | Very high | 96.6 | Very high | 58 Ų | 58 | 41.1 Ų | 41.1 | 41% | 0.406 | 21% | 0.207 | S | C | . | . | H | α-helix | trans | -61.4 | -39.7 | 174.6 | -63.9 | 0 | 0 | 0 | 0 | 111.7 | Y148 L149 W150 C155 L156 | Y148-S152 WeakPolarHBondContact O-CB 3.26Å; Y148-S152 PolarHBondContact O-N 2.88Å; Y148-S152 PolarHBondContact O-OG 3.45Å; L149-S152 PolarHBondContact O-N 3.19Å; W150-S152 PolarHBondContact O-N 2.86Å; S152-C155 PolarHBondContact O-N 2.94Å; S152-L156 VanDerWaalsContact O-CB 3.29Å; S152-L156 WeakPolarHBondContact O-CB 3.46Å; S152-L156 PolarHBondContact O-N 3.24Å |
| 153 | Y | 97.6 | Very high | 96.8 | Very high | 5 Ų | 5 | 40.7 Ų | 40.7 | 2% | 0.02 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -63.6 | -43.9 | 173.4 | 177 | -108.6 | 0 | 0 | 0 | 112 | L149 W150 L151 L156 L157 C190 Q224 M228 Q231 | L149-Y153 PolarHBondContact O-N 3.09Å; W150-Y153 WeakPolarHBondContact O-CB 3.4Å; W150-Y153 PolarHBondContact O-N 3.4Å; L151-Y153 VanDerWaalsContact C-N 3.32Å; L151-Y153 PolarHBondContact O-N 3.37Å; Y153-L156 WeakPolarHBondContact O-CB 3.46Å; Y153-L156 PolarHBondContact O-N 3.41Å; Y153-L157 HydrophobicContact CD1-CD1 4.27Å; Y153-L157 HydrophobicContact CE1-CD1 3.57Å; Y153-L157 HydrophobicContact CE1-CG 4.15Å; Y153-L157 HydrophobicContact CE2-CD1 4.36Å; Y153-L157 HydrophobicContact CE2-CD2 4.13Å; Y153-L157 HydrophobicContact CE2-CG 4.15Å; Y153-L157 WeakPolarHBondContact O-CG 3.32Å; Y153-L157 PolarHBondContact O-N 3.18Å; Y153-C190 HydrophobicContact CE1-CB 4.46Å; Y153-Q224 VanDerWaalsContact CE1-NE2 3.32Å; Y153-Q224 PolarHBondContact OH-NE2 3.25Å; Y153-M228 HydrophobicContact CD2-CE 3.88Å; Y153-M228 HydrophobicContact CD2-CG 4.26Å; Y153-M228 HydrophobicContact CD2-SD 4.1Å; Y153-M228 HydrophobicContact CE2-CE 4.33Å; Y153-M228 HydrophobicContact CE2-CG 3.78Å; Y153-M228 HydrophobicContact CE2-SD 4.17Å; Y153-Q231 PolarHBondContact OH-NE2 3.14Å; Y153-Q231 VanDerWaalsContact OH-NE2 3.13Å; Y153-Q231 PolarHBondContact OH-OE1 2.99Å |
| 154 | A | 96.8 | Very high | 96.9 | Very high | 12 Ų | 12 | 40.7 Ų | 40.7 | 10% | 0.099 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -62.1 | -45.1 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | W150 L151 L156 L157 L158 V191 | W150-A154 PolarHBondContact O-N 3.32Å; L151-A154 PolarHBondContact O-N 3.38Å; A154-L156 VanDerWaalsContact C-N 3.32Å; A154-L156 PolarHBondContact O-N 2.98Å; A154-L157 PolarHBondContact O-N 3.46Å; A154-L158 PolarHBondContact O-N 3.29Å; A154-L158 VanDerWaalsContact O-N 3.08Å; A154-V191 HydrophobicContact CB-CG1 3.99Å; A154-V191 HydrophobicContact CB-CG2 4.04Å |
| 155 | C | 97.3 | Very high | 97 | Very high | 68 Ų | 68 | 41.2 Ų | 41.2 | 46% | 0.459 | 21% | 0.209 | S | C | . | . | H | α-helix | trans | -60.8 | -40.7 | 173.7 | -70 | 0 | 0 | 0 | 0 | 111.8 | L151 S152 L158 V159 | L151-C155 WeakPolarHBondContact O-CB 3.27Å; L151-C155 PolarHBondContact O-N 2.88Å; L151-C155 PolarHBondContact O-SG 3.11Å; L151-C155 VanDerWaalsContact O-SG 3.33Å; S152-C155 PolarHBondContact O-N 2.94Å; C155-L158 WeakPolarHBondContact O-CB 3.27Å; C155-L158 PolarHBondContact O-N 3.4Å; C155-V159 WeakPolarHBondContact O-CG2 3.08Å; C155-V159 PolarHBondContact O-N 3.44Å |
| 156 | L | 97.9 | Very high | 97 | Very high | 6 Ų | 6 | 40.8 Ų | 40.8 | 3% | 0.031 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -63.5 | -43.2 | 176.7 | 176.1 | 60.1 | 0 | 0 | 0 | 111.8 | S152 Y153 A154 L158 V159 N160 V263 I266 F267 I270 | S152-L156 VanDerWaalsContact O-CB 3.29Å; S152-L156 WeakPolarHBondContact O-CB 3.46Å; S152-L156 PolarHBondContact O-N 3.24Å; Y153-L156 WeakPolarHBondContact O-CB 3.46Å; Y153-L156 PolarHBondContact O-N 3.41Å; A154-L156 VanDerWaalsContact C-N 3.32Å; A154-L156 PolarHBondContact O-N 2.98Å; L156-L158 PolarHBondContact O-N 3.48Å; L156-V159 PolarHBondContact O-N 3.14Å; L156-N160 VanDerWaalsContact O-CB 3.27Å; L156-N160 WeakPolarHBondContact O-CB 3.32Å; L156-N160 PolarHBondContact O-N 3.04Å; L156-V263 HydrophobicContact CD1-CG1 4.22Å; L156-I266 HydrophobicContact CD1-CB 3.89Å; L156-I266 HydrophobicContact CD1-CG2 3.72Å; L156-I266 HydrophobicContact CD2-CG2 4.13Å; L156-I266 HydrophobicContact CG-CG2 4.39Å; L156-F267 HydrophobicContact CD1-CD2 4.26Å; L156-F267 HydrophobicContact CD1-CE2 4.3Å; L156-F267 HydrophobicContact CD2-CB 4.12Å; L156-F267 HydrophobicContact CD2-CD1 3.34Å; L156-F267 HydrophobicContact CD2-CD2 4.1Å; L156-F267 HydrophobicContact CD2-CE1 3.61Å; L156-F267 HydrophobicContact CD2-CE2 4.36Å; L156-F267 HydrophobicContact CD2-CG 3.58Å; L156-F267 HydrophobicContact CD2-CZ 4.13Å; L156-F267 HydrophobicContact CG-CD1 4.13Å; L156-F267 HydrophobicContact CG-CD2 4.33Å; L156-F267 HydrophobicContact CG-CE1 3.96Å; L156-F267 HydrophobicContact CG-CE2 4.2Å; L156-F267 HydrophobicContact CG-CG 4.28Å; L156-F267 HydrophobicContact CG-CZ 4Å; L156-I270 HydrophobicContact CB-CD1 4.15Å; L156-I270 HydrophobicContact CD2-CD1 3.88Å |
| 157 | L | 97.8 | Very high | 96.9 | Very high | 1 Ų | 1 | 40.9 Ų | 40.9 | 1% | 0.005 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -62 | -33.9 | 174.9 | -68.7 | -174.9 | 0 | 0 | 0 | 111.9 | Y153 A154 L161 V186 F187 C190 V191 F267 | Y153-L157 HydrophobicContact CD1-CD1 4.27Å; Y153-L157 HydrophobicContact CE1-CD1 3.57Å; Y153-L157 HydrophobicContact CE1-CG 4.15Å; Y153-L157 HydrophobicContact CE2-CD1 4.36Å; Y153-L157 HydrophobicContact CE2-CD2 4.13Å; Y153-L157 HydrophobicContact CE2-CG 4.15Å; Y153-L157 WeakPolarHBondContact O-CG 3.32Å; Y153-L157 PolarHBondContact O-N 3.18Å; A154-L157 PolarHBondContact O-N 3.46Å; L157-L161 WeakPolarHBondContact O-CB 3.4Å; L157-L161 PolarHBondContact O-N 3.31Å; L157-V186 HydrophobicContact CD1-CG1 4.29Å; L157-V186 HydrophobicContact CD2-CG1 3.92Å; L157-F187 HydrophobicContact CB-CD2 3.78Å; L157-C190 HydrophobicContact CD1-CB 3.96Å; L157-V191 HydrophobicContact CD1-CG2 3.93Å; L157-F267 HydrophobicContact CD2-CE1 4.12Å; L157-F267 HydrophobicContact CD2-CZ 3.99Å |
| 158 | L | 97.7 | Very high | 96.9 | Very high | 69 Ų | 69 | 43.5 Ų | 43.5 | 36% | 0.361 | 22% | 0.222 | S | C | . | . | H | α-helix | trans | -67 | -46.6 | 174 | -176 | 63.2 | 0 | 0 | 0 | 112 | A154 C155 L156 N160 L161 F162 F187 | A154-L158 PolarHBondContact O-N 3.29Å; A154-L158 VanDerWaalsContact O-N 3.08Å; C155-L158 WeakPolarHBondContact O-CB 3.27Å; C155-L158 PolarHBondContact O-N 3.4Å; L156-L158 PolarHBondContact O-N 3.48Å; L158-N160 VanDerWaalsContact C-N 3.29Å; L158-N160 PolarHBondContact O-N 3.41Å; L158-L161 WeakPolarHBondContact O-CB 3.4Å; L158-L161 PolarHBondContact O-N 3.11Å; L158-F162 HydrophobicContact CD1-CD2 4.24Å; L158-F162 HydrophobicContact CD1-CE2 3.7Å; L158-F162 HydrophobicContact CD1-CZ 4.49Å; L158-F162 HydrophobicContact CD2-CE2 4.4Å; L158-F162 HydrophobicContact CG-CD2 4.13Å; L158-F162 HydrophobicContact CG-CE2 3.8Å; L158-F162 VanDerWaalsContact O-CD2 3.24Å; L158-F162 WeakPolarHBondContact O-CD2 3.34Å; L158-F162 PolarHBondContact O-N 3.33Å; L158-F187 HydrophobicContact CB-CD2 4.44Å; L158-F187 HydrophobicContact CB-CE2 3.79Å; L158-F187 HydrophobicContact CB-CZ 4.41Å; L158-F187 HydrophobicContact CD1-CE2 4.12Å; L158-F187 HydrophobicContact CD1-CZ 3.99Å |
| 159 | V | 98.1 | Very high | 96.9 | Very high | 72 Ų | 72 | 41 Ų | 41 | 44% | 0.436 | 23% | 0.23 | S | C | . | . | H | α-helix | trans | -62.8 | -39.5 | 175.8 | 177.3 | 0 | 0 | 0 | 0 | 110.8 | C155 L156 F162 T163 V263 | C155-V159 WeakPolarHBondContact O-CG2 3.08Å; C155-V159 PolarHBondContact O-N 3.44Å; L156-V159 PolarHBondContact O-N 3.14Å; V159-F162 PolarHBondContact O-N 3.22Å; V159-T163 WeakPolarHBondContact O-CB 3.49Å; V159-T163 PolarHBondContact O-N 3.11Å; V159-T163 PolarHBondContact O-OG1 3.47Å; V159-V263 HydrophobicContact CG1-CG2 3.82Å |
| 160 | N | 97.8 | Very high | 96.7 | Very high | 2 Ų | 2 | 42.6 Ų | 42.6 | 1% | 0.011 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -60.7 | -43.3 | 173.4 | 176.1 | 77.3 | 0 | 0 | 0 | 111.6 | L156 L158 F162 T163 A164 G239 S240 C241 V263 F267 | L156-N160 VanDerWaalsContact O-CB 3.27Å; L156-N160 WeakPolarHBondContact O-CB 3.32Å; L156-N160 PolarHBondContact O-N 3.04Å; L158-N160 VanDerWaalsContact C-N 3.29Å; L158-N160 PolarHBondContact O-N 3.41Å; N160-F162 PolarHBondContact O-N 3.06Å; N160-T163 PolarHBondContact O-N 3.12Å; N160-A164 WeakPolarHBondContact O-CB 3.4Å; N160-A164 PolarHBondContact O-N 3.02Å; N160-G239 PolarHBondContact ND2-O 3.39Å; N160-S240 WeakPolarHBondContact OD1-CA 3.31Å; N160-C241 PolarHBondContact OD1-N 3.46Å; N160-V263 HydrophobicContact CB-CG1 4.06Å; N160-F267 HydrophobicContact CB-CE2 3.96Å; N160-F267 HydrophobicContact CB-CZ 4.1Å |
| 161 | L | 97.7 | Very high | 96.4 | Very high | 29 Ų | 29 | 43.1 Ų | 43.1 | 15% | 0.152 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -59.3 | -46.2 | 175.7 | 175.5 | 62.7 | 0 | 0 | 0 | 112.1 | L157 L158 A164 M165 F180 A183 I184 F187 | L157-L161 WeakPolarHBondContact O-CB 3.4Å; L157-L161 PolarHBondContact O-N 3.31Å; L158-L161 WeakPolarHBondContact O-CB 3.4Å; L158-L161 PolarHBondContact O-N 3.11Å; L161-A164 PolarHBondContact O-N 3.48Å; L161-M165 WeakPolarHBondContact O-CB 3.34Å; L161-M165 PolarHBondContact O-N 2.84Å; L161-F180 HydrophobicContact CD1-CD2 4.08Å; L161-F180 HydrophobicContact CD1-CE2 3.73Å; L161-A183 HydrophobicContact CD1-CB 4.07Å; L161-I184 HydrophobicContact CD1-CB 4.37Å; L161-I184 HydrophobicContact CD1-CG1 3.55Å; L161-F187 HydrophobicContact CD2-CD1 4.28Å; L161-F187 HydrophobicContact CD2-CG 4.34Å |
| 162 | F | 97.7 | Very high | 96 | Very high | 108 Ų | 108 | 46.6 Ų | 46.6 | 47% | 0.474 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -65.1 | -39.5 | 175.6 | -76.4 | -65.7 | 0 | 0 | 0 | 112.5 | L158 V159 N160 A164 M165 I166 | L158-F162 HydrophobicContact CD1-CD2 4.24Å; L158-F162 HydrophobicContact CD1-CE2 3.7Å; L158-F162 HydrophobicContact CD1-CZ 4.49Å; L158-F162 HydrophobicContact CD2-CE2 4.4Å; L158-F162 HydrophobicContact CG-CD2 4.13Å; L158-F162 HydrophobicContact CG-CE2 3.8Å; L158-F162 VanDerWaalsContact O-CD2 3.24Å; L158-F162 WeakPolarHBondContact O-CD2 3.34Å; L158-F162 PolarHBondContact O-N 3.33Å; V159-F162 PolarHBondContact O-N 3.22Å; N160-F162 PolarHBondContact O-N 3.06Å; F162-A164 VanDerWaalsContact C-N 3.34Å; F162-M165 HydrophobicContact CD1-CE 3.84Å; F162-M165 HydrophobicContact CE1-CE 4.47Å; F162-M165 WeakPolarHBondContact O-CB 3.45Å; F162-M165 PolarHBondContact O-N 3.23Å; F162-I166 WeakPolarHBondContact O-CG1 3.1Å; F162-I166 PolarHBondContact O-N 2.97Å |
| 163 | T | 96.9 | Very high | 95.5 | Very high | 7 Ų | 7 | 45 Ų | 45 | 4% | 0.043 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -65.8 | -40.1 | 177.2 | -54.7 | 0 | 0 | 0 | 0 | 110.9 | V159 N160 I166 Y167 C241 M259 V263 | V159-T163 WeakPolarHBondContact O-CB 3.49Å; V159-T163 PolarHBondContact O-N 3.11Å; V159-T163 PolarHBondContact O-OG1 3.47Å; N160-T163 PolarHBondContact O-N 3.12Å; T163-I166 PolarHBondContact O-N 2.86Å; T163-Y167 WeakPolarHBondContact O-CB 3.48Å; T163-Y167 PolarHBondContact O-N 3.18Å; T163-C241 HydrophobicContact CG2-CB 4.06Å; T163-M259 HydrophobicContact CG2-CB 4.24Å; T163-V263 HydrophobicContact CG2-CG2 4.29Å; T163-V263 WeakPolarHBondContact OG1-CG2 3.3Å |
| 164 | A | 96.3 | Very high | 94.9 | Very high | 0 Ų | 0 | 55.8 Ų | 55.8 | 0% | 0 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -63.9 | -39.1 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | N160 L161 F162 Y167 F168 L179 F180 A183 | N160-A164 WeakPolarHBondContact O-CB 3.4Å; N160-A164 PolarHBondContact O-N 3.02Å; L161-A164 PolarHBondContact O-N 3.48Å; F162-A164 VanDerWaalsContact C-N 3.34Å; A164-Y167 WeakPolarHBondContact O-CB 3.04Å; A164-Y167 PolarHBondContact O-N 3.37Å; A164-F168 WeakPolarHBondContact O-CB 3.35Å; A164-F168 PolarHBondContact O-N 2.89Å; A164-L179 VanDerWaalsContact CA-CD2 3.47Å; A164-L179 HydrophobicContact CB-CD2 3.36Å; A164-F180 HydrophobicContact CB-CD2 4.42Å; A164-A183 HydrophobicContact CB-CB 3.79Å |
| 165 | M | 96.2 | Very high | 94.5 | Very high | 80 Ų | 80 | 58.4 Ų | 58.4 | 39% | 0.394 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -63.2 | -46.8 | 173.4 | -176.8 | -171.9 | 72 | 0 | 0 | 111.6 | L161 F162 Y167 F168 A169 F180 | L161-M165 WeakPolarHBondContact O-CB 3.34Å; L161-M165 PolarHBondContact O-N 2.84Å; F162-M165 HydrophobicContact CD1-CE 3.84Å; F162-M165 HydrophobicContact CE1-CE 4.47Å; F162-M165 WeakPolarHBondContact O-CB 3.45Å; F162-M165 PolarHBondContact O-N 3.23Å; M165-Y167 VanDerWaalsContact C-N 3.32Å; M165-Y167 PolarHBondContact O-N 3.42Å; M165-F168 PolarHBondContact O-N 3.24Å; M165-A169 WeakPolarHBondContact O-CB 3.48Å; M165-A169 PolarHBondContact O-N 2.92Å; M165-F180 HydrophobicContact CB-CD2 3.87Å; M165-F180 HydrophobicContact CB-CE2 3.64Å; M165-F180 HydrophobicContact CB-CZ 4.3Å; M165-F180 HydrophobicContact CG-CE2 4.05Å; M165-F180 HydrophobicContact CG-CZ 4.21Å |
| 166 | I | 96.1 | Very high | 94.2 | Very high | 64 Ų | 64 | 55.2 Ų | 55.2 | 33% | 0.328 | 30% | 0.3 | S | S | . | . | H | α-helix | trans | -64.9 | -38.7 | 177.2 | -67.9 | 167.8 | 0 | 0 | 0 | 110.7 | F162 T163 A169 G170 I256 M259 | F162-I166 WeakPolarHBondContact O-CG1 3.1Å; F162-I166 PolarHBondContact O-N 2.97Å; T163-I166 PolarHBondContact O-N 2.86Å; I166-A169 PolarHBondContact O-N 2.95Å; I166-G170 WeakPolarHBondContact O-CA 3.4Å; I166-G170 PolarHBondContact O-N 3.44Å; I166-I256 HydrophobicContact CG2-CG1 4.27Å; I166-M259 HydrophobicContact CD1-CE 3.5Å; I166-M259 HydrophobicContact CG2-SD 4.47Å |
| 167 | Y | 95.2 | Very high | 93.9 | Very high | 2 Ų | 2 | 56.3 Ų | 56.3 | 1% | 0.008 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -57.9 | -54.4 | 172.5 | -175.2 | -79.7 | 0 | 0 | 0 | 110.2 | T163 A164 M165 A169 G170 T171 Y175 L179 T245 V249 I256 | T163-Y167 WeakPolarHBondContact O-CB 3.48Å; T163-Y167 PolarHBondContact O-N 3.18Å; A164-Y167 WeakPolarHBondContact O-CB 3.04Å; A164-Y167 PolarHBondContact O-N 3.37Å; M165-Y167 VanDerWaalsContact C-N 3.32Å; M165-Y167 PolarHBondContact O-N 3.42Å; Y167-A169 VanDerWaalsContact C-N 3.34Å; Y167-A169 PolarHBondContact O-N 2.98Å; Y167-G170 PolarHBondContact O-N 3.04Å; Y167-T171 HydrophobicContact CD1-CG2 3.53Å; Y167-T171 HydrophobicContact CD2-CG2 4.3Å; Y167-T171 HydrophobicContact CE1-CG2 3.29Å; Y167-T171 HydrophobicContact CE2-CG2 4.12Å; Y167-T171 HydrophobicContact CG-CG2 4.01Å; Y167-T171 WeakPolarHBondContact O-CG2 3.48Å; Y167-T171 PolarHBondContact O-N 2.96Å; Y167-Y175 HydrophobicContact CE1-CD2 4.38Å; Y167-Y175 HydrophobicContact CE1-CE2 4.21Å; Y167-Y175 AromaticContact CZ-CE2 3.87Å; Y167-Y175 WeakPolarHBondContact OH-CE2 3.44Å; Y167-Y175 PolarHBondContact OH-OH 2.68Å; Y167-L179 HydrophobicContact CD1-CD2 4.24Å; Y167-L179 HydrophobicContact CG-CD2 4.33Å; Y167-T245 HydrophobicContact CD2-CG2 4.31Å; Y167-T245 HydrophobicContact CE2-CG2 4.02Å; Y167-V249 HydrophobicContact CD2-CG1 4.31Å; Y167-V249 HydrophobicContact CD2-CG2 4.35Å; Y167-V249 HydrophobicContact CE2-CB 3.74Å; Y167-V249 HydrophobicContact CE2-CG1 3.91Å; Y167-V249 HydrophobicContact CE2-CG2 3.72Å; Y167-I256 HydrophobicContact CD2-CG2 3.71Å; Y167-I256 HydrophobicContact CG-CG2 4.31Å |
| 168 | F | 95.1 | Very high | 93.7 | Very high | 104 Ų | 104 | 58.4 Ų | 58.4 | 46% | 0.456 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -58.7 | -42.6 | -179.9 | 174.5 | -127.6 | 0 | 0 | 0 | 113.3 | A164 M165 G176 F180 | A164-F168 WeakPolarHBondContact O-CB 3.35Å; A164-F168 PolarHBondContact O-N 2.89Å; M165-F168 PolarHBondContact O-N 3.24Å; F168-G176 VanDerWaalsContact CD2-C 3.46Å; F168-F180 HydrophobicContact CB-CB 3.89Å; F168-F180 HydrophobicContact CB-CG 4.46Å; F168-F180 HydrophobicContact CD1-CB 4.43Å; F168-F180 AromaticContact CD1-CD1 3.87Å; F168-F180 HydrophobicContact CD1-CD1 3.87Å; F168-F180 HydrophobicContact CD1-CG 4.41Å; F168-F180 HydrophobicContact CE1-CD1 4.42Å; F168-F180 HydrophobicContact CG-CB 4.28Å |
| 169 | A | 94.8 | Very high | 93.6 | Very high | 88 Ų | 88 | 55.2 Ų | 55.2 | 73% | 0.727 | 31% | 0.312 | S | S | * | . | H | α-helix | trans | -75.5 | -31.3 | -179.7 | 0 | 0 | 0 | 0 | 0 | 113.4 | M165 I166 Y167 | M165-A169 WeakPolarHBondContact O-CB 3.48Å; M165-A169 PolarHBondContact O-N 2.92Å; I166-A169 PolarHBondContact O-N 2.95Å; Y167-A169 VanDerWaalsContact C-N 3.34Å; Y167-A169 PolarHBondContact O-N 2.98Å |
| 170 | G | 93.4 | Very high | 93.5 | Very high | 40 Ų | 40 | 54.2 Ų | 54.2 | 41% | 0.412 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -99 | -10.4 | -170.7 | 0 | 0 | 0 | 0 | 0 | 115.2 | I166 Y167 | I166-G170 WeakPolarHBondContact O-CA 3.4Å; I166-G170 PolarHBondContact O-N 3.44Å; Y167-G170 PolarHBondContact O-N 3.04Å |
| 171 | T | 90.4 | Very high | 93.4 | Very high | 26 Ų | 26 | 55.6 Ų | 55.6 | 16% | 0.16 | 32% | 0.316 | C | S | . | . | trans | -122 | 140.9 | 174.1 | -173.9 | 0 | 0 | 0 | 0 | 112.2 | Y167 S173 | Y167-T171 HydrophobicContact CD1-CG2 3.53Å; Y167-T171 HydrophobicContact CD2-CG2 4.3Å; Y167-T171 HydrophobicContact CE1-CG2 3.29Å; Y167-T171 HydrophobicContact CE2-CG2 4.12Å; Y167-T171 HydrophobicContact CG-CG2 4.01Å; Y167-T171 WeakPolarHBondContact O-CG2 3.48Å; Y167-T171 PolarHBondContact O-N 2.96Å; T171-S173 PolarHBondContact O-N 3.31Å; T171-S173 VanDerWaalsContact O-N 3.11Å; T171-S173 PolarHBondContact OG1-N 3.31Å | ||
| 172 | S | 88.1 | Confident | 93.3 | Very high | 137 Ų | 137 | 56.4 Ų | 56.4 | 96% | 0.958 | 32% | 0.322 | S | S | * | . | trans | -77.4 | 20.2 | 170.5 | -49.5 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 173 | S | 86.2 | Confident | 93.3 | Very high | 26 Ų | 26 | 51.3 Ų | 51.3 | 18% | 0.182 | 30% | 0.3 | C | S | . | . | trans | -69.9 | 128.9 | -179 | -176 | 0 | 0 | 0 | 0 | 111.3 | T171 Y175 G176 | T171-S173 PolarHBondContact O-N 3.31Å; T171-S173 VanDerWaalsContact O-N 3.11Å; T171-S173 PolarHBondContact OG1-N 3.31Å; S173-Y175 PolarHBondContact O-N 2.96Å; S173-Y175 VanDerWaalsContact O-N 3.12Å; S173-Y175 VanDerWaalsContact OG-CD1 3.22Å; S173-Y175 WeakPolarHBondContact OG-CD1 3.32Å; S173-Y175 WeakPolarHBondContact OG-CE1 3.45Å; S173-Y175 WeakPolarHBondContact OG-CE2 3.38Å; S173-G176 PolarHBondContact O-N 3.47Å | ||
| 174 | Y | 86 | Confident | 93.3 | Very high | 230 Ų | 230 | 53.8 Ų | 53.8 | 90% | 0.902 | 31% | 0.312 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -55.7 | -31.2 | 179.5 | 176.1 | -98.8 | 0 | 0 | 0 | 113.5 | ||
| 175 | Y | 87.9 | Confident | 93.3 | Very high | 68 Ų | 68 | 58.6 Ų | 58.6 | 27% | 0.267 | 34% | 0.337 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -94.4 | 6.5 | -179.8 | 55.8 | -94 | 0 | 0 | 0 | 114.2 | Y167 S173 S178 L179 I236 N237 | Y167-Y175 HydrophobicContact CE1-CD2 4.38Å; Y167-Y175 HydrophobicContact CE1-CE2 4.21Å; Y167-Y175 AromaticContact CZ-CE2 3.87Å; Y167-Y175 WeakPolarHBondContact OH-CE2 3.44Å; Y167-Y175 PolarHBondContact OH-OH 2.68Å; S173-Y175 PolarHBondContact O-N 2.96Å; S173-Y175 VanDerWaalsContact O-N 3.12Å; S173-Y175 VanDerWaalsContact OG-CD1 3.22Å; S173-Y175 WeakPolarHBondContact OG-CD1 3.32Å; S173-Y175 WeakPolarHBondContact OG-CE1 3.45Å; S173-Y175 WeakPolarHBondContact OG-CE2 3.38Å; Y175-S178 WeakPolarHBondContact CA-OG 3.42Å; Y175-S178 PolarHBondContact O-OG 2.91Å; Y175-L179 WeakPolarHBondContact O-CB 3.49Å; Y175-L179 PolarHBondContact O-N 3.19Å; Y175-L179 VanDerWaalsContact O-N 3.12Å; Y175-I236 HydrophobicContact CD2-CG2 4.07Å; Y175-I236 HydrophobicContact CE2-CG2 4.5Å; Y175-I236 HydrophobicContact CG-CG2 4.13Å; Y175-N237 WeakPolarHBondContact CB-OD1 3.3Å |
| 176 | G | 90.6 | Very high | 93.3 | Very high | 0 Ų | 0 | 56.1 Ų | 56.1 | 0% | 0 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -63.5 | -41 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | F168 S173 L179 F180 | F168-G176 VanDerWaalsContact CD2-C 3.46Å; S173-G176 PolarHBondContact O-N 3.47Å; G176-L179 PolarHBondContact O-N 3.07Å; G176-F180 PolarHBondContact O-N 3.01Å |
| 177 | G | 92.9 | Very high | 93.3 | Very high | 30 Ų | 30 | 55.8 Ų | 55.8 | 31% | 0.309 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -67 | -41.5 | -179 | 0 | 0 | 0 | 0 | 0 | 113 | F180 G181 | G177-F180 PolarHBondContact O-N 3.48Å; G177-G181 PolarHBondContact O-N 3.09Å |
| 178 | S | 93.7 | Very high | 93.4 | Very high | 45 Ų | 45 | 60.8 Ų | 60.8 | 32% | 0.315 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -65.4 | -41 | 174.6 | 44.5 | 0 | 0 | 0 | 0 | 111.7 | Y175 F180 G181 V182 N237 | Y175-S178 WeakPolarHBondContact CA-OG 3.42Å; Y175-S178 PolarHBondContact O-OG 2.91Å; S178-F180 PolarHBondContact O-N 3.46Å; S178-G181 PolarHBondContact O-N 3.4Å; S178-V182 WeakPolarHBondContact O-CB 3.28Å; S178-V182 VanDerWaalsContact O-CG2 3.26Å; S178-V182 WeakPolarHBondContact O-CG2 3.49Å; S178-V182 PolarHBondContact O-N 3.27Å; S178-N237 WeakPolarHBondContact CB-OD1 3.38Å; S178-N237 PolarHBondContact OG-OD1 3.03Å |
| 179 | L | 94.7 | Very high | 93.3 | Very high | 2 Ų | 2 | 60.7 Ų | 60.7 | 1% | 0.01 | 35% | 0.352 | C | S | . | . | H | α-helix | trans | -60 | -45.6 | 175.6 | -178.7 | 139.3 | 0 | 0 | 0 | 111.5 | A164 Y167 Y175 G176 A183 G239 T245 | A164-L179 VanDerWaalsContact CA-CD2 3.47Å; A164-L179 HydrophobicContact CB-CD2 3.36Å; Y167-L179 HydrophobicContact CD1-CD2 4.24Å; Y167-L179 HydrophobicContact CG-CD2 4.33Å; Y175-L179 WeakPolarHBondContact O-CB 3.49Å; Y175-L179 PolarHBondContact O-N 3.19Å; Y175-L179 VanDerWaalsContact O-N 3.12Å; G176-L179 PolarHBondContact O-N 3.07Å; L179-A183 WeakPolarHBondContact O-CB 3.44Å; L179-A183 PolarHBondContact O-N 3.34Å; L179-A183 VanDerWaalsContact O-N 3.08Å; L179-G239 WeakPolarHBondContact O-CA 3.04Å; L179-T245 HydrophobicContact CD1-CG2 3.65Å |
| 180 | F | 95.5 | Very high | 93.3 | Very high | 51 Ų | 51 | 57.9 Ų | 57.9 | 22% | 0.224 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -66.8 | -46.9 | 176.2 | 176.3 | -126.5 | 0 | 0 | 0 | 112.9 | L161 A164 M165 F168 G176 G177 S178 V182 A183 I184 | L161-F180 HydrophobicContact CD1-CD2 4.08Å; L161-F180 HydrophobicContact CD1-CE2 3.73Å; A164-F180 HydrophobicContact CB-CD2 4.42Å; M165-F180 HydrophobicContact CB-CD2 3.87Å; M165-F180 HydrophobicContact CB-CE2 3.64Å; M165-F180 HydrophobicContact CB-CZ 4.3Å; M165-F180 HydrophobicContact CG-CE2 4.05Å; M165-F180 HydrophobicContact CG-CZ 4.21Å; F168-F180 HydrophobicContact CB-CB 3.89Å; F168-F180 HydrophobicContact CB-CG 4.46Å; F168-F180 HydrophobicContact CD1-CB 4.43Å; F168-F180 AromaticContact CD1-CD1 3.87Å; F168-F180 HydrophobicContact CD1-CD1 3.87Å; F168-F180 HydrophobicContact CD1-CG 4.41Å; F168-F180 HydrophobicContact CE1-CD1 4.42Å; F168-F180 HydrophobicContact CG-CB 4.28Å; G176-F180 PolarHBondContact O-N 3.01Å; G177-F180 PolarHBondContact O-N 3.48Å; S178-F180 PolarHBondContact O-N 3.46Å; F180-V182 PolarHBondContact O-N 2.88Å; F180-A183 WeakPolarHBondContact O-CB 3.37Å; F180-A183 PolarHBondContact O-N 3.23Å; F180-A183 VanDerWaalsContact O-N 3.16Å; F180-I184 HydrophobicContact CD1-CD1 4.39Å; F180-I184 HydrophobicContact CD2-CD1 4.49Å; F180-I184 HydrophobicContact CD2-CG1 4.47Å; F180-I184 HydrophobicContact CE1-CD1 3.91Å; F180-I184 HydrophobicContact CE2-CD1 4.02Å; F180-I184 HydrophobicContact CE2-CG1 4.08Å; F180-I184 HydrophobicContact CZ-CD1 3.72Å; F180-I184 HydrophobicContact CZ-CG1 4.27Å; F180-I184 PolarHBondContact O-N 3.42Å; F180-I184 VanDerWaalsContact O-N 3.12Å |
| 181 | G | 95.4 | Very high | 93.3 | Very high | 30 Ų | 30 | 57.2 Ų | 57.2 | 31% | 0.309 | 31% | 0.314 | S | S | . | . | H | α-helix | trans | -59.9 | -43.8 | -180 | 0 | 0 | 0 | 0 | 0 | 113 | G177 S178 I184 L185 | G177-G181 PolarHBondContact O-N 3.09Å; S178-G181 PolarHBondContact O-N 3.4Å; G181-I184 PolarHBondContact O-N 2.93Å; G181-L185 PolarHBondContact O-N 3.48Å |
| 182 | V | 96.8 | Very high | 93.5 | Very high | 46 Ų | 46 | 59.2 Ų | 59.2 | 28% | 0.279 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -69.8 | -34.3 | 177 | 179.6 | 0 | 0 | 0 | 0 | 111.2 | S178 F180 I184 L185 V186 | S178-V182 WeakPolarHBondContact O-CB 3.28Å; S178-V182 VanDerWaalsContact O-CG2 3.26Å; S178-V182 WeakPolarHBondContact O-CG2 3.49Å; S178-V182 PolarHBondContact O-N 3.27Å; F180-V182 PolarHBondContact O-N 2.88Å; V182-I184 VanDerWaalsContact C-N 3.3Å; V182-I184 PolarHBondContact O-N 3.46Å; V182-L185 PolarHBondContact O-N 3.25Å; V182-V186 HydrophobicContact CG1-CG2 4.05Å; V182-V186 WeakPolarHBondContact O-CB 3.45Å; V182-V186 VanDerWaalsContact O-CG2 3.3Å; V182-V186 WeakPolarHBondContact O-CG2 3.28Å; V182-V186 PolarHBondContact O-N 3.46Å |
| 183 | A | 97.2 | Very high | 93.7 | Very high | 1 Ų | 1 | 55.2 Ų | 55.2 | 1% | 0.008 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -60.3 | -38.2 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | L161 A164 L179 F180 F187 G239 | L161-A183 HydrophobicContact CD1-CB 4.07Å; A164-A183 HydrophobicContact CB-CB 3.79Å; L179-A183 WeakPolarHBondContact O-CB 3.44Å; L179-A183 PolarHBondContact O-N 3.34Å; L179-A183 VanDerWaalsContact O-N 3.08Å; F180-A183 WeakPolarHBondContact O-CB 3.37Å; F180-A183 PolarHBondContact O-N 3.23Å; F180-A183 VanDerWaalsContact O-N 3.16Å; A183-F187 WeakPolarHBondContact O-CB 3.39Å; A183-F187 PolarHBondContact O-N 2.98Å; A183-G239 VanDerWaalsContact CB-O 3.31Å; A183-G239 WeakPolarHBondContact CB-O 3.02Å |
| 184 | I | 97.1 | Very high | 94.1 | Very high | 59 Ų | 59 | 54 Ų | 54 | 30% | 0.303 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -61.3 | -49.7 | 174.2 | -64.6 | 167.1 | 0 | 0 | 0 | 110.3 | L161 F180 G181 V182 F187 I188 | L161-I184 HydrophobicContact CD1-CB 4.37Å; L161-I184 HydrophobicContact CD1-CG1 3.55Å; F180-I184 HydrophobicContact CD1-CD1 4.39Å; F180-I184 HydrophobicContact CD2-CD1 4.49Å; F180-I184 HydrophobicContact CD2-CG1 4.47Å; F180-I184 HydrophobicContact CE1-CD1 3.91Å; F180-I184 HydrophobicContact CE2-CD1 4.02Å; F180-I184 HydrophobicContact CE2-CG1 4.08Å; F180-I184 HydrophobicContact CZ-CD1 3.72Å; F180-I184 HydrophobicContact CZ-CG1 4.27Å; F180-I184 PolarHBondContact O-N 3.42Å; F180-I184 VanDerWaalsContact O-N 3.12Å; G181-I184 PolarHBondContact O-N 2.93Å; V182-I184 VanDerWaalsContact C-N 3.3Å; V182-I184 PolarHBondContact O-N 3.46Å; I184-F187 PolarHBondContact O-N 3.12Å; I184-I188 HydrophobicContact CG2-CD1 3.72Å; I184-I188 HydrophobicContact CG2-CG1 4.46Å; I184-I188 WeakPolarHBondContact O-CG1 3.45Å; I184-I188 PolarHBondContact O-N 2.8Å |
| 185 | L | 96.4 | Very high | 94.5 | Very high | 102 Ų | 102 | 43.2 Ų | 43.2 | 53% | 0.534 | 25% | 0.249 | S | C | . | . | H | α-helix | trans | -62.3 | -45.5 | -179.2 | -66.7 | 176.3 | 0 | 0 | 0 | 111.5 | G181 V182 F187 I188 I189 | G181-L185 PolarHBondContact O-N 3.48Å; V182-L185 PolarHBondContact O-N 3.25Å; L185-F187 VanDerWaalsContact C-N 3.34Å; L185-F187 PolarHBondContact O-N 3.28Å; L185-I188 PolarHBondContact O-N 2.96Å; L185-I189 VanDerWaalsContact O-CB 3.3Å; L185-I189 WeakPolarHBondContact O-CB 3.25Å; L185-I189 WeakPolarHBondContact O-CG1 3.46Å; L185-I189 PolarHBondContact O-N 3.47Å |
| 186 | V | 96.1 | Very high | 94.7 | Very high | 27 Ų | 27 | 43.4 Ų | 43.4 | 16% | 0.164 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -59.6 | -44.6 | 176.1 | 169.3 | 0 | 0 | 0 | 0 | 110.5 | L157 V182 C190 | L157-V186 HydrophobicContact CD1-CG1 4.29Å; L157-V186 HydrophobicContact CD2-CG1 3.92Å; V182-V186 HydrophobicContact CG1-CG2 4.05Å; V182-V186 WeakPolarHBondContact O-CB 3.45Å; V182-V186 VanDerWaalsContact O-CG2 3.3Å; V182-V186 WeakPolarHBondContact O-CG2 3.28Å; V182-V186 PolarHBondContact O-N 3.46Å; V186-C190 HydrophobicContact CG1-CB 4.39Å; V186-C190 WeakPolarHBondContact O-CA 3.3Å; V186-C190 WeakPolarHBondContact O-CB 3.32Å; V186-C190 PolarHBondContact O-N 3.24Å; V186-C190 PolarHBondContact O-SG 3.23Å; V186-C190 VanDerWaalsContact O-SG 3.37Å |
| 187 | F | 96.9 | Very high | 94.9 | Very high | 57 Ų | 57 | 45.8 Ų | 45.8 | 25% | 0.25 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -62.2 | -51.7 | 178.2 | 180 | -103.1 | 0 | 0 | 0 | 112.1 | L157 L158 L161 A183 I184 L185 I189 V191 | L157-F187 HydrophobicContact CB-CD2 3.78Å; L158-F187 HydrophobicContact CB-CD2 4.44Å; L158-F187 HydrophobicContact CB-CE2 3.79Å; L158-F187 HydrophobicContact CB-CZ 4.41Å; L158-F187 HydrophobicContact CD1-CE2 4.12Å; L158-F187 HydrophobicContact CD1-CZ 3.99Å; L161-F187 HydrophobicContact CD2-CD1 4.28Å; L161-F187 HydrophobicContact CD2-CG 4.34Å; A183-F187 WeakPolarHBondContact O-CB 3.39Å; A183-F187 PolarHBondContact O-N 2.98Å; I184-F187 PolarHBondContact O-N 3.12Å; L185-F187 VanDerWaalsContact C-N 3.34Å; L185-F187 PolarHBondContact O-N 3.28Å; F187-I189 PolarHBondContact O-N 3.4Å; F187-V191 HydrophobicContact CD2-CG2 3.94Å; F187-V191 HydrophobicContact CE2-CG2 3.97Å; F187-V191 WeakPolarHBondContact O-CB 3.5Å; F187-V191 WeakPolarHBondContact O-CG2 3.04Å; F187-V191 PolarHBondContact O-N 2.98Å |
| 188 | I | 95.5 | Very high | 95 | Very high | 108 Ų | 108 | 44.6 Ų | 44.6 | 55% | 0.554 | 26% | 0.259 | S | S | * | . | H | α-helix | trans | -66.9 | -35.9 | -175.6 | -67 | 175 | 0 | 0 | 0 | 111.9 | I184 L185 P192 | I184-I188 HydrophobicContact CG2-CD1 3.72Å; I184-I188 HydrophobicContact CG2-CG1 4.46Å; I184-I188 WeakPolarHBondContact O-CG1 3.45Å; I184-I188 PolarHBondContact O-N 2.8Å; L185-I188 PolarHBondContact O-N 2.96Å; I188-P192 WeakPolarHBondContact O-CD 3.43Å; I188-P192 WeakPolarHBondContact O-CG 3.18Å |
| 189 | I | 94.6 | Very high | 95.1 | Very high | 101 Ų | 101 | 42.5 Ų | 42.5 | 52% | 0.518 | 24% | 0.244 | S | C | . | . | H | α-helix | trans | -88.7 | -48.7 | -176.7 | -62.6 | 171.1 | 0 | 0 | 0 | 111.1 | L185 F187 V191 P192 S193 | L185-I189 VanDerWaalsContact O-CB 3.3Å; L185-I189 WeakPolarHBondContact O-CB 3.25Å; L185-I189 WeakPolarHBondContact O-CG1 3.46Å; L185-I189 PolarHBondContact O-N 3.47Å; F187-I189 PolarHBondContact O-N 3.4Å; I189-V191 PolarHBondContact O-N 2.74Å; I189-P192 WeakPolarHBondContact O-CD 3.31Å; I189-P192 WeakPolarHBondContact O-CG 3.37Å; I189-S193 WeakPolarHBondContact O-CB 3.49Å; I189-S193 PolarHBondContact O-N 2.94Å |
| 190 | C | 94 | Very high | 94.9 | Very high | 29 Ų | 29 | 44.2 Ų | 44.2 | 20% | 0.196 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -73.3 | -30.6 | -171 | -61.8 | 0 | 0 | 0 | 0 | 112.9 | Y153 L157 V186 S194 | Y153-C190 HydrophobicContact CE1-CB 4.46Å; L157-C190 HydrophobicContact CD1-CB 3.96Å; V186-C190 HydrophobicContact CG1-CB 4.39Å; V186-C190 WeakPolarHBondContact O-CA 3.3Å; V186-C190 WeakPolarHBondContact O-CB 3.32Å; V186-C190 PolarHBondContact O-N 3.24Å; V186-C190 PolarHBondContact O-SG 3.23Å; V186-C190 VanDerWaalsContact O-SG 3.37Å; C190-S194 WeakPolarHBondContact O-CB 3.5Å; C190-S194 PolarHBondContact O-N 2.92Å; C190-S194 PolarHBondContact O-OG 2.92Å |
| 191 | V | 93.7 | Very high | 94.9 | Very high | 26 Ų | 26 | 42.5 Ų | 42.5 | 16% | 0.158 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -62.8 | -56.2 | 177.5 | 174.4 | 0 | 0 | 0 | 0 | 112 | W150 A154 L157 F187 I189 S194 Y195 | W150-V191 HydrophobicContact CZ2-CG1 4.08Å; W150-V191 PolarHBondContact NE1-O 2.66Å; A154-V191 HydrophobicContact CB-CG1 3.99Å; A154-V191 HydrophobicContact CB-CG2 4.04Å; L157-V191 HydrophobicContact CD1-CG2 3.93Å; F187-V191 HydrophobicContact CD2-CG2 3.94Å; F187-V191 HydrophobicContact CE2-CG2 3.97Å; F187-V191 WeakPolarHBondContact O-CB 3.5Å; F187-V191 WeakPolarHBondContact O-CG2 3.04Å; F187-V191 PolarHBondContact O-N 2.98Å; I189-V191 PolarHBondContact O-N 2.74Å; V191-S194 PolarHBondContact O-OG 3.48Å; V191-Y195 PolarHBondContact O-N 3.31Å |
| 192 | P | 93.5 | Very high | 94.8 | Very high | 68 Ų | 68 | 41 Ų | 41 | 44% | 0.442 | 23% | 0.23 | S | C | . | . | H | α-helix | trans | -68.5 | -38.4 | 177.1 | 26.2 | -33.7 | 0 | 0 | 0 | 112.4 | I188 I189 Y195 V196 | I188-P192 WeakPolarHBondContact O-CD 3.43Å; I188-P192 WeakPolarHBondContact O-CG 3.18Å; I189-P192 WeakPolarHBondContact O-CD 3.31Å; I189-P192 WeakPolarHBondContact O-CG 3.37Å; P192-Y195 PolarHBondContact O-N 3.16Å; P192-V196 WeakPolarHBondContact O-CG2 3.26Å; P192-V196 PolarHBondContact O-N 3.35Å |
| 193 | S | 93.7 | Very high | 94.6 | Very high | 53 Ų | 53 | 39.1 Ų | 39.1 | 37% | 0.371 | 22% | 0.218 | S | C | . | . | H | α-helix | trans | -61.8 | -46.9 | 178.3 | 179.2 | 0 | 0 | 0 | 0 | 111.6 | I189 Y195 V196 C197 | I189-S193 WeakPolarHBondContact O-CB 3.49Å; I189-S193 PolarHBondContact O-N 2.94Å; S193-Y195 VanDerWaalsContact C-N 3.3Å; S193-Y195 PolarHBondContact O-N 2.74Å; S193-V196 PolarHBondContact O-N 3.01Å; S193-C197 WeakPolarHBondContact O-CB 3.48Å; S193-C197 PolarHBondContact O-N 3.01Å; S193-C197 PolarHBondContact O-SG 3.09Å |
| 194 | S | 94.5 | Very high | 94.3 | Very high | 1 Ų | 1 | 44.1 Ų | 44.1 | 1% | 0.007 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -61.3 | -38.2 | 177.8 | 62.9 | 0 | 0 | 0 | 0 | 112.4 | W150 C190 V191 W198 F199 | W150-S194 PolarHBondContact NE1-OG 3.46Å; C190-S194 WeakPolarHBondContact O-CB 3.5Å; C190-S194 PolarHBondContact O-N 2.92Å; C190-S194 PolarHBondContact O-OG 2.92Å; V191-S194 PolarHBondContact O-OG 3.48Å; S194-W198 VanDerWaalsContact O-CG 3.31Å; S194-W198 PolarHBondContact O-N 2.91Å; S194-W198 PolarHBondContact O-NE1 3.36Å; S194-W198 VanDerWaalsContact O-NE1 3.14Å; S194-F199 PolarHBondContact O-N 3.06Å |
| 195 | Y | 93.7 | Very high | 94 | Very high | 4 Ų | 4 | 41.3 Ų | 41.3 | 2% | 0.016 | 23% | 0.225 | C | C | . | . | I | π-helix | trans | -62.4 | -51.5 | 174.5 | -178.8 | -97.2 | 0 | 0 | 0 | 111.6 | W114 F127 Q129 W150 V191 P192 S193 F199 R200 | W114-Y195 HydrophobicContact CD2-CE2 4.12Å; W114-Y195 AromaticContact CD2-CZ 3.91Å; W114-Y195 AromaticContact CE2-CE2 3.89Å; W114-Y195 AromaticContact CE3-CE1 3.74Å; W114-Y195 HydrophobicContact CE3-CE1 3.74Å; W114-Y195 AromaticContact CE3-CE2 3.87Å; W114-Y195 HydrophobicContact CE3-CE2 3.87Å; W114-Y195 AromaticContact CE3-CZ 3.34Å; W114-Y195 VanDerWaalsContact CE3-OH 3.26Å; W114-Y195 AromaticContact CH2-CD1 3.86Å; W114-Y195 HydrophobicContact CH2-CD1 3.86Å; W114-Y195 AromaticContact CH2-CD2 3.27Å; W114-Y195 HydrophobicContact CH2-CD2 3.27Å; W114-Y195 AromaticContact CH2-CE1 3.79Å; W114-Y195 HydrophobicContact CH2-CE1 3.79Å; W114-Y195 AromaticContact CH2-CE2 3.17Å; W114-Y195 HydrophobicContact CH2-CE2 3.17Å; W114-Y195 AromaticContact CH2-CG 3.63Å; W114-Y195 HydrophobicContact CH2-CG 3.63Å; W114-Y195 AromaticContact CH2-CZ 3.46Å; W114-Y195 VanDerWaalsContact CH2-CZ 3.46Å; W114-Y195 AromaticContact CZ2-CD2 3.76Å; W114-Y195 HydrophobicContact CZ2-CD2 3.76Å; W114-Y195 AromaticContact CZ2-CE2 3.42Å; W114-Y195 HydrophobicContact CZ2-CE2 3.42Å; W114-Y195 VanDerWaalsContact CZ2-CE2 3.42Å; W114-Y195 AromaticContact CZ2-CZ 3.98Å; W114-Y195 AromaticContact CZ3-CD1 3.62Å; W114-Y195 HydrophobicContact CZ3-CD1 3.62Å; W114-Y195 AromaticContact CZ3-CD2 3.82Å; W114-Y195 HydrophobicContact CZ3-CD2 3.82Å; W114-Y195 AromaticContact CZ3-CE1 3.21Å; W114-Y195 HydrophobicContact CZ3-CE1 3.21Å; W114-Y195 AromaticContact CZ3-CE2 3.42Å; W114-Y195 HydrophobicContact CZ3-CE2 3.42Å; W114-Y195 VanDerWaalsContact CZ3-CE2 3.42Å; W114-Y195 AromaticContact CZ3-CG 3.91Å; W114-Y195 HydrophobicContact CZ3-CG 3.91Å; W114-Y195 AromaticContact CZ3-CZ 3.11Å; F127-Y195 AromaticContact CD2-CE1 3.66Å; F127-Y195 HydrophobicContact CD2-CE1 3.66Å; F127-Y195 HydrophobicContact CE2-CD1 4.28Å; F127-Y195 AromaticContact CE2-CE1 3.78Å; F127-Y195 HydrophobicContact CE2-CE1 3.78Å; F127-Y195 HydrophobicContact CG-CE1 4.46Å; Q129-Y195 PolarHBondContact OE1-OH 3.13Å; W150-Y195 HydrophobicContact CD2-CD2 4.14Å; W150-Y195 AromaticContact CE2-CD2 3.9Å; W150-Y195 HydrophobicContact CE3-CD2 4.34Å; W150-Y195 HydrophobicContact CH2-CD2 4.12Å; W150-Y195 AromaticContact CZ2-CD2 3.9Å; W150-Y195 HydrophobicContact CZ2-CD2 3.9Å; W150-Y195 HydrophobicContact CZ2-CG 4.14Å; W150-Y195 HydrophobicContact CZ3-CD2 4.34Å; V191-Y195 PolarHBondContact O-N 3.31Å; P192-Y195 PolarHBondContact O-N 3.16Å; S193-Y195 VanDerWaalsContact C-N 3.3Å; S193-Y195 PolarHBondContact O-N 2.74Å; Y195-F199 AromaticContact CD2-CD1 3.56Å; Y195-F199 HydrophobicContact CD2-CD1 3.56Å; Y195-F199 HydrophobicContact CD2-CE1 4.24Å; Y195-F199 HydrophobicContact CD2-CG 4.42Å; Y195-F199 AromaticContact CE2-CD1 3.35Å; Y195-F199 HydrophobicContact CE2-CD1 3.35Å; Y195-F199 AromaticContact CE2-CE1 3.63Å; Y195-F199 HydrophobicContact CE2-CE1 3.63Å; Y195-F199 PolarHBondContact O-N 3.22Å; Y195-R200 HydrophobicContact CD1-CG 3.89Å; Y195-R200 HydrophobicContact CE1-CG 3.51Å; Y195-R200 VanDerWaalsContact CE1-NE 3.32Å; Y195-R200 WeakPolarHBondContact O-CB 3.36Å; Y195-R200 WeakPolarHBondContact O-CG 3.04Å; Y195-R200 PolarHBondContact O-N 3.43Å; Y195-R200 PolarHBondContact OH-NE 3.4Å |
| 196 | V | 92.8 | Very high | 93.7 | Very high | 72 Ų | 72 | 36.7 Ų | 36.7 | 44% | 0.436 | 20% | 0.201 | S | C | . | . | I | π-helix | trans | -73 | -40 | -174 | 174.5 | 0 | 0 | 0 | 0 | 112.2 | P192 S193 R200 P201 | P192-V196 WeakPolarHBondContact O-CG2 3.26Å; P192-V196 PolarHBondContact O-N 3.35Å; S193-V196 PolarHBondContact O-N 3.01Å; V196-R200 WeakPolarHBondContact O-CB 3.47Å; V196-P201 VanDerWaalsContact O-CD 3.25Å; V196-P201 WeakPolarHBondContact O-CD 3.47Å |
| 197 | C | 93.5 | Very high | 93.3 | Very high | 50 Ų | 50 | 41 Ų | 41 | 34% | 0.338 | 21% | 0.214 | S | C | . | . | I | π-helix | trans | -87.7 | -26.2 | -168.3 | -60.8 | 0 | 0 | 0 | 0 | 113.1 | S193 P201 V220 | S193-C197 WeakPolarHBondContact O-CB 3.48Å; S193-C197 PolarHBondContact O-N 3.01Å; S193-C197 PolarHBondContact O-SG 3.09Å; C197-P201 WeakPolarHBondContact O-CG 3.41Å; C197-V220 HydrophobicContact CB-CG1 3.66Å; C197-V220 WeakPolarHBondContact O-CB 3.36Å; C197-V220 WeakPolarHBondContact O-CG1 3.09Å |
| 198 | W | 95.9 | Very high | 92.6 | Very high | 5 Ų | 5 | 42 Ų | 42 | 2% | 0.019 | 23% | 0.227 | C | C | . | . | I | π-helix | trans | -126.5 | -45.1 | 177.1 | 75.3 | -104.3 | 0 | 0 | 0 | 114.4 | G146 W150 S194 R200 P201 L202 F217 V220 F221 | G146-W198 WeakPolarHBondContact O-CH2 3.46Å; W150-W198 HydrophobicContact CB-CH2 3.71Å; W150-W198 HydrophobicContact CB-CZ2 3.59Å; W150-W198 AromaticContact CD1-CZ2 3.92Å; W150-W198 HydrophobicContact CG-CZ2 4.15Å; S194-W198 VanDerWaalsContact O-CG 3.31Å; S194-W198 PolarHBondContact O-N 2.91Å; S194-W198 PolarHBondContact O-NE1 3.36Å; S194-W198 VanDerWaalsContact O-NE1 3.14Å; W198-R200 PolarHBondContact O-N 3.44Å; W198-P201 WeakPolarHBondContact O-CD 3.47Å; W198-L202 HydrophobicContact CE3-CD2 4.38Å; W198-L202 HydrophobicContact CZ3-CD2 4Å; W198-L202 VanDerWaalsContact O-CB 3.31Å; W198-L202 WeakPolarHBondContact O-CB 3.42Å; W198-L202 PolarHBondContact O-N 3.2Å; W198-F217 HydrophobicContact CB-CD2 4.31Å; W198-F217 HydrophobicContact CE3-CD2 4.13Å; W198-F217 AromaticContact CE3-CE2 3.71Å; W198-F217 HydrophobicContact CE3-CE2 3.71Å; W198-F217 HydrophobicContact CZ3-CE2 4.26Å; W198-V220 HydrophobicContact CB-CB 4.32Å; W198-V220 HydrophobicContact CB-CG1 3.97Å; W198-F221 HydrophobicContact CB-CB 4.11Å; W198-F221 HydrophobicContact CB-CD2 4.25Å; W198-F221 AromaticContact CD2-CD2 3.45Å; W198-F221 HydrophobicContact CD2-CD2 3.45Å; W198-F221 VanDerWaalsContact CD2-CD2 3.45Å; W198-F221 AromaticContact CD2-CE2 3.84Å; W198-F221 HydrophobicContact CD2-CE2 3.84Å; W198-F221 HydrophobicContact CD2-CG 4.37Å; W198-F221 AromaticContact CE2-CD2 3.78Å; W198-F221 AromaticContact CE2-CE2 3.76Å; W198-F221 AromaticContact CE3-CD2 3.7Å; W198-F221 HydrophobicContact CE3-CD2 3.7Å; W198-F221 AromaticContact CE3-CE2 3.95Å; W198-F221 HydrophobicContact CE3-CE2 3.95Å; W198-F221 HydrophobicContact CE3-CG 4.35Å; W198-F221 HydrophobicContact CG-CB 4.48Å; W198-F221 AromaticContact CG-CD2 3.71Å; W198-F221 HydrophobicContact CG-CD2 3.71Å; W198-F221 HydrophobicContact CG-CE2 4.49Å; W198-F221 HydrophobicContact CH2-CD2 4.49Å; W198-F221 AromaticContact CH2-CE2 3.92Å; W198-F221 HydrophobicContact CH2-CE2 3.92Å; W198-F221 HydrophobicContact CZ2-CD2 4.3Å; W198-F221 AromaticContact CZ2-CE2 3.81Å; W198-F221 HydrophobicContact CZ2-CE2 3.81Å; W198-F221 HydrophobicContact CZ3-CD2 4.22Å; W198-F221 AromaticContact CZ3-CE2 3.99Å; W198-F221 HydrophobicContact CZ3-CE2 3.99Å |
| 199 | F | 95.2 | Very high | 91.7 | Very high | 0 Ų | 0 | 40.3 Ų | 40.3 | 0% | 0 | 22% | 0.22 | C | C | . | . | I | π-helix | trans | -69.2 | -37.2 | -176 | 176.3 | -103.7 | 0 | 0 | 0 | 111.6 | Q129 Y147 S194 Y195 L202 Y203 | Q129-F199 VanDerWaalsContact NE2-CE1 3.29Å; Y147-F199 AromaticContact CD2-CE1 3.77Å; Y147-F199 HydrophobicContact CD2-CE1 3.77Å; Y147-F199 HydrophobicContact CD2-CE2 4.23Å; Y147-F199 AromaticContact CD2-CZ 3.55Å; Y147-F199 HydrophobicContact CD2-CZ 3.55Å; Y147-F199 HydrophobicContact CG-CE2 4.44Å; Y147-F199 HydrophobicContact CG-CZ 4.02Å; S194-F199 PolarHBondContact O-N 3.06Å; Y195-F199 AromaticContact CD2-CD1 3.56Å; Y195-F199 HydrophobicContact CD2-CD1 3.56Å; Y195-F199 HydrophobicContact CD2-CE1 4.24Å; Y195-F199 HydrophobicContact CD2-CG 4.42Å; Y195-F199 AromaticContact CE2-CD1 3.35Å; Y195-F199 HydrophobicContact CE2-CD1 3.35Å; Y195-F199 AromaticContact CE2-CE1 3.63Å; Y195-F199 HydrophobicContact CE2-CE1 3.63Å; Y195-F199 PolarHBondContact O-N 3.22Å; F199-L202 HydrophobicContact CD2-CD2 4.22Å; F199-L202 WeakPolarHBondContact O-CB 3.49Å; F199-L202 PolarHBondContact O-N 3.02Å; F199-Y203 WeakPolarHBondContact O-CB 3.31Å; F199-Y203 PolarHBondContact O-N 3.47Å |
| 200 | R | 92 | Very high | 91.1 | Very high | 38 Ų | 38 | 36.2 Ų | 36.2 | 14% | 0.143 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -64.7 | -50.7 | 174.7 | -80 | -56.8 | -146 | 99.1 | -39.1 | 113.1 | F127 Y195 V196 W198 L202 Y203 K204 | F127-R200 VanDerWaalsContact CG-CZ 3.48Å; Y195-R200 HydrophobicContact CD1-CG 3.89Å; Y195-R200 HydrophobicContact CE1-CG 3.51Å; Y195-R200 VanDerWaalsContact CE1-NE 3.32Å; Y195-R200 WeakPolarHBondContact O-CB 3.36Å; Y195-R200 WeakPolarHBondContact O-CG 3.04Å; Y195-R200 PolarHBondContact O-N 3.43Å; Y195-R200 PolarHBondContact OH-NE 3.4Å; V196-R200 WeakPolarHBondContact O-CB 3.47Å; W198-R200 PolarHBondContact O-N 3.44Å; R200-L202 VanDerWaalsContact C-N 3.29Å; R200-L202 PolarHBondContact O-N 2.99Å; R200-Y203 PolarHBondContact O-N 2.9Å; R200-K204 WeakPolarHBondContact O-CG 3.41Å; R200-K204 PolarHBondContact O-N 3.41Å |
| 201 | P | 93.6 | Very high | 90.7 | Very high | 15 Ų | 15 | 34.9 Ų | 34.9 | 10% | 0.097 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -54.7 | -43.1 | 171.6 | -32.5 | 38.2 | 0 | 0 | 0 | 113 | V196 C197 W198 Y203 K204 A205 V216 F217 | V196-P201 VanDerWaalsContact O-CD 3.25Å; V196-P201 WeakPolarHBondContact O-CD 3.47Å; C197-P201 WeakPolarHBondContact O-CG 3.41Å; W198-P201 WeakPolarHBondContact O-CD 3.47Å; P201-Y203 PolarHBondContact O-N 2.98Å; P201-K204 PolarHBondContact O-N 2.96Å; P201-A205 VanDerWaalsContact O-CB 3.28Å; P201-A205 WeakPolarHBondContact O-CB 2.96Å; P201-A205 PolarHBondContact O-N 3.18Å; P201-V216 HydrophobicContact CB-CB 4.31Å; P201-V216 HydrophobicContact CB-CG1 4Å; P201-V216 HydrophobicContact CG-CG1 3.84Å; P201-F217 HydrophobicContact CB-CB 4.31Å |
| 202 | L | 94.8 | Very high | 90.5 | Very high | 0 Ų | 0 | 36 Ų | 36 | 0% | 0 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -58 | -48.3 | 175.1 | 178.5 | 72.5 | 0 | 0 | 0 | 112.5 | W198 F199 R200 K204 A205 F206 F217 Y277 V281 | W198-L202 HydrophobicContact CE3-CD2 4.38Å; W198-L202 HydrophobicContact CZ3-CD2 4Å; W198-L202 VanDerWaalsContact O-CB 3.31Å; W198-L202 WeakPolarHBondContact O-CB 3.42Å; W198-L202 PolarHBondContact O-N 3.2Å; F199-L202 HydrophobicContact CD2-CD2 4.22Å; F199-L202 WeakPolarHBondContact O-CB 3.49Å; F199-L202 PolarHBondContact O-N 3.02Å; R200-L202 VanDerWaalsContact C-N 3.29Å; R200-L202 PolarHBondContact O-N 2.99Å; L202-K204 VanDerWaalsContact C-N 3.34Å; L202-K204 PolarHBondContact O-N 3.27Å; L202-A205 WeakPolarHBondContact O-CB 3.38Å; L202-A205 PolarHBondContact O-N 3.28Å; L202-F206 HydrophobicContact CD1-CD2 3.85Å; L202-F206 HydrophobicContact CD1-CE2 3.55Å; L202-F206 HydrophobicContact CG-CD2 4.25Å; L202-F206 HydrophobicContact CG-CE2 4.37Å; L202-F206 WeakPolarHBondContact O-CD2 3.03Å; L202-F206 PolarHBondContact O-N 3.48Å; L202-F206 VanDerWaalsContact O-N 3.12Å; L202-F217 HydrophobicContact CB-CD2 3.66Å; L202-F217 HydrophobicContact CB-CE2 4.07Å; L202-F217 HydrophobicContact CB-CG 4.1Å; L202-F217 HydrophobicContact CD1-CD1 3.95Å; L202-F217 HydrophobicContact CD1-CD2 3.93Å; L202-F217 HydrophobicContact CD1-CE1 3.86Å; L202-F217 HydrophobicContact CD1-CE2 3.83Å; L202-F217 HydrophobicContact CD1-CG 3.98Å; L202-F217 HydrophobicContact CD1-CZ 3.78Å; L202-F217 HydrophobicContact CD2-CE2 4.07Å; L202-F217 HydrophobicContact CG-CD2 4.25Å; L202-F217 HydrophobicContact CG-CE2 4.22Å; L202-Y277 HydrophobicContact CD2-CE1 3.96Å; L202-Y277 WeakPolarHBondContact CD2-OH 3.33Å; L202-V281 HydrophobicContact CD1-CG1 3.98Å; L202-V281 HydrophobicContact CD1-CG2 4.34Å |
| 203 | Y | 92.5 | Very high | 90.3 | Very high | 6 Ų | 6 | 34.5 Ų | 34.5 | 2% | 0.024 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -59.7 | -45.5 | 177.9 | -176.1 | -96.5 | 0 | 0 | 0 | 111.5 | Q129 N130 I131 E134 I135 V143 F199 R200 P201 R207 | Q129-Y203 HydrophobicContact CG-CE2 4.03Å; Q129-Y203 VanDerWaalsContact NE2-CG 3.28Å; N130-Y203 PolarHBondContact N-OH 3.31Å; N130-Y203 VanDerWaalsContact N-OH 3.08Å; N130-Y203 PolarHBondContact O-OH 2.86Å; I131-Y203 HydrophobicContact CB-CE2 4.49Å; I131-Y203 HydrophobicContact CG1-CD2 4.38Å; I131-Y203 HydrophobicContact CG1-CE2 3.78Å; E134-Y203 WeakPolarHBondContact CB-OH 3.42Å; E134-Y203 WeakPolarHBondContact OE2-CE1 3.43Å; E134-Y203 PolarHBondContact OE2-OH 3.13Å; I135-Y203 HydrophobicContact CD1-CD2 3.95Å; I135-Y203 HydrophobicContact CD1-CE2 3.77Å; I135-Y203 HydrophobicContact CD1-CG 4.44Å; I135-Y203 HydrophobicContact CG1-CD2 4.24Å; I135-Y203 HydrophobicContact CG1-CE2 3.72Å; V143-Y203 HydrophobicContact CG1-CD2 3.75Å; V143-Y203 HydrophobicContact CG1-CE2 4.34Å; F199-Y203 WeakPolarHBondContact O-CB 3.31Å; F199-Y203 PolarHBondContact O-N 3.47Å; R200-Y203 PolarHBondContact O-N 2.9Å; P201-Y203 PolarHBondContact O-N 2.98Å; Y203-R207 VanDerWaalsContact O-CB 3.28Å; Y203-R207 WeakPolarHBondContact O-CB 3.16Å; Y203-R207 PolarHBondContact O-N 2.8Å |
| 204 | K | 90.2 | Very high | 90.3 | Very high | 105 Ų | 105 | 32.2 Ų | 32.2 | 46% | 0.457 | 17% | 0.167 | S | C | . | . | H | α-helix | trans | -62.8 | -42.4 | 175.8 | -71.9 | -179.4 | 177.7 | -175.7 | 0 | 111.8 | R200 P201 L202 F206 R207 S208 N213 | R200-K204 WeakPolarHBondContact O-CG 3.41Å; R200-K204 PolarHBondContact O-N 3.41Å; P201-K204 PolarHBondContact O-N 2.96Å; L202-K204 VanDerWaalsContact C-N 3.34Å; L202-K204 PolarHBondContact O-N 3.27Å; K204-F206 VanDerWaalsContact C-N 3.35Å; K204-F206 PolarHBondContact O-N 2.92Å; K204-R207 PolarHBondContact O-N 3.33Å; K204-S208 PolarHBondContact O-N 3.45Å; K204-S208 PolarHBondContact O-OG 3Å; K204-S208 VanDerWaalsContact O-OG 3.12Å; K204-N213 HydrophobicContact CB-CB 4.34Å |
| 205 | A | 91.4 | Very high | 90.3 | Very high | 0 Ų | 0 | 35.2 Ų | 35.2 | 0% | 0 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -57.9 | -46.6 | -179.7 | 0 | 0 | 0 | 0 | 0 | 111.7 | P201 L202 N209 S210 N213 F214 | P201-A205 VanDerWaalsContact O-CB 3.28Å; P201-A205 WeakPolarHBondContact O-CB 2.96Å; P201-A205 PolarHBondContact O-N 3.18Å; L202-A205 WeakPolarHBondContact O-CB 3.38Å; L202-A205 PolarHBondContact O-N 3.28Å; A205-N209 WeakPolarHBondContact O-CA 3.48Å; A205-N209 PolarHBondContact O-N 2.91Å; A205-S210 PolarHBondContact O-N 3.42Å; A205-N213 HydrophobicContact CB-CB 3.72Å; A205-F214 HydrophobicContact CB-CB 4.45Å; A205-F214 HydrophobicContact CB-CD1 3.75Å; A205-F214 HydrophobicContact CB-CD2 3.71Å; A205-F214 HydrophobicContact CB-CE1 3.78Å; A205-F214 HydrophobicContact CB-CE2 3.75Å; A205-F214 HydrophobicContact CB-CG 3.7Å; A205-F214 HydrophobicContact CB-CZ 3.78Å |
| 206 | F | 90.3 | Very high | 90.3 | Very high | 6 Ų | 6 | 37.9 Ų | 37.9 | 3% | 0.026 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -78.7 | -23.6 | 177.9 | -78.4 | -66.2 | 0 | 0 | 0 | 114.5 | I135 Y139 V142 V143 L202 K204 F214 V281 I284 | I135-F206 HydrophobicContact CD1-CB 4.27Å; I135-F206 HydrophobicContact CG2-CB 4.47Å; Y139-F206 AromaticContact CD1-CD1 3.83Å; Y139-F206 HydrophobicContact CD1-CD1 3.83Å; Y139-F206 AromaticContact CD1-CE1 3.6Å; Y139-F206 HydrophobicContact CD1-CE1 3.6Å; Y139-F206 AromaticContact CD2-CD1 3.89Å; Y139-F206 HydrophobicContact CD2-CD1 3.89Å; Y139-F206 HydrophobicContact CD2-CE1 4.45Å; Y139-F206 HydrophobicContact CE1-CE1 4.16Å; Y139-F206 AromaticContact CG-CD1 3.47Å; Y139-F206 HydrophobicContact CG-CD1 3.47Å; Y139-F206 VanDerWaalsContact CG-CD1 3.47Å; Y139-F206 AromaticContact CG-CE1 3.78Å; Y139-F206 HydrophobicContact CG-CE1 3.78Å; Y139-F206 HydrophobicContact CG-CG 4.49Å; V142-F206 HydrophobicContact CG1-CE2 4.02Å; V142-F206 HydrophobicContact CG1-CZ 3.95Å; V143-F206 HydrophobicContact CG2-CB 3.67Å; V143-F206 HydrophobicContact CG2-CD2 3.6Å; V143-F206 HydrophobicContact CG2-CE2 4.44Å; V143-F206 HydrophobicContact CG2-CG 3.79Å; L202-F206 HydrophobicContact CD1-CD2 3.85Å; L202-F206 HydrophobicContact CD1-CE2 3.55Å; L202-F206 HydrophobicContact CG-CD2 4.25Å; L202-F206 HydrophobicContact CG-CE2 4.37Å; L202-F206 WeakPolarHBondContact O-CD2 3.03Å; L202-F206 PolarHBondContact O-N 3.48Å; L202-F206 VanDerWaalsContact O-N 3.12Å; K204-F206 VanDerWaalsContact C-N 3.35Å; K204-F206 PolarHBondContact O-N 2.92Å; F206-F214 HydrophobicContact CD1-CE1 4.34Å; F206-F214 AromaticContact CD1-CZ 3.85Å; F206-F214 HydrophobicContact CD1-CZ 3.85Å; F206-F214 HydrophobicContact CD2-CE1 4.18Å; F206-F214 HydrophobicContact CD2-CZ 4.34Å; F206-F214 AromaticContact CE1-CE1 3.98Å; F206-F214 HydrophobicContact CE1-CE1 3.98Å; F206-F214 AromaticContact CE1-CZ 3.76Å; F206-F214 HydrophobicContact CE1-CZ 3.76Å; F206-F214 AromaticContact CE2-CE1 3.82Å; F206-F214 HydrophobicContact CE2-CE1 3.82Å; F206-F214 HydrophobicContact CE2-CZ 4.28Å; F206-F214 HydrophobicContact CG-CE1 4.44Å; F206-F214 HydrophobicContact CG-CZ 4.15Å; F206-F214 AromaticContact CZ-CE1 3.71Å; F206-F214 HydrophobicContact CZ-CE1 3.71Å; F206-F214 HydrophobicContact CZ-CZ 4Å; F206-V281 HydrophobicContact CE2-CG1 3.96Å; F206-V281 HydrophobicContact CZ-CG1 3.99Å; F206-I284 HydrophobicContact CE1-CG2 4.01Å; F206-I284 HydrophobicContact CZ-CG2 4.34Å |
| 207 | R | 86.9 | Confident | 90.5 | Very high | 118 Ų | 118 | 34.4 Ų | 34.4 | 45% | 0.445 | 18% | 0.176 | S | C | . | . | H | α-helix | trans | -71.4 | -52.9 | 174.1 | 174.8 | 176.8 | 178 | 163.5 | 11.5 | 112.1 | E134 I135 Y203 K204 | E134-R207 HydrophobicContact CB-CG 4.39Å; E134-R207 WeakPolarHBondContact O-CG 3.38Å; E134-R207 IonicContact OE1-CZ 2.81Å; E134-R207 IonicContact OE1-NE 3.13Å; E134-R207 IonicContact OE1-NH1 3.22Å; E134-R207 PolarHBondContact OE1-NH1 3.29Å; E134-R207 IonicContact OE1-NH2 3.44Å; E134-R207 PolarHBondContact OE1-NH2 3.33Å; E134-R207 IonicContact OE2-CZ 3.43Å; E134-R207 IonicContact OE2-NH1 2.85Å; E134-R207 PolarHBondContact OE2-NH1 3.37Å; I135-R207 HydrophobicContact CD1-CB 3.78Å; Y203-R207 VanDerWaalsContact O-CB 3.28Å; Y203-R207 WeakPolarHBondContact O-CB 3.16Å; Y203-R207 PolarHBondContact O-N 2.8Å; K204-R207 PolarHBondContact O-N 3.33Å |
| 208 | S | 82 | Confident | 90.6 | Very high | 76 Ų | 76 | 33.4 Ų | 33.4 | 53% | 0.531 | 17% | 0.166 | S | C | . | . | H | α-helix | trans | -104.9 | 8.1 | -171.7 | 70.9 | 0 | 0 | 0 | 0 | 113.4 | K204 S210 | K204-S208 PolarHBondContact O-N 3.45Å; K204-S208 PolarHBondContact O-OG 3Å; K204-S208 VanDerWaalsContact O-OG 3.12Å; S208-S210 PolarHBondContact O-N 3.07Å; S208-S210 VanDerWaalsContact O-N 3.11Å; S208-S210 WeakPolarHBondContact OG-CB 3.45Å |
| 209 | N | 77.2 | Confident | 90.6 | Very high | 74 Ų | 74 | 38.8 Ų | 38.8 | 40% | 0.396 | 19% | 0.194 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 48 | 37.9 | -174.6 | -164.4 | 22.1 | 0 | 0 | 0 | 113.5 | A205 K294 | A205-N209 WeakPolarHBondContact O-CA 3.48Å; A205-N209 PolarHBondContact O-N 2.91Å; N209-K294 PolarHBondContact ND2-NZ 3.12Å; N209-K294 PolarHBondContact O-NZ 3.37Å; N209-K294 VanDerWaalsContact O-NZ 3.11Å |
| 210 | S | 81.5 | Confident | 90.8 | Very high | 15 Ų | 15 | 41 Ų | 41 | 11% | 0.105 | 21% | 0.207 | C | C | . | . | trans | -90.2 | 118.8 | -174.6 | 171.3 | 0 | 0 | 0 | 0 | 111.5 | A205 S208 I212 N213 F214 E298 | A205-S210 PolarHBondContact O-N 3.42Å; S208-S210 PolarHBondContact O-N 3.07Å; S208-S210 VanDerWaalsContact O-N 3.11Å; S208-S210 WeakPolarHBondContact OG-CB 3.45Å; S210-I212 VanDerWaalsContact C-N 3.33Å; S210-I212 PolarHBondContact O-N 2.88Å; S210-N213 VanDerWaalsContact CB-ND2 3.32Å; S210-N213 WeakPolarHBondContact CB-ND2 3.4Å; S210-N213 PolarHBondContact O-N 3.02Å; S210-N213 PolarHBondContact OG-ND2 2.76Å; S210-F214 WeakPolarHBondContact O-CD2 3.45Å; S210-F214 PolarHBondContact O-N 3.28Å; S210-E298 VanDerWaalsContact C-OE2 3.3Å; S210-E298 WeakPolarHBondContact CA-OE2 3.39Å; S210-E298 WeakPolarHBondContact CB-OE2 3.24Å; S210-E298 PolarHBondContact OG-OE2 3.4Å | ||
| 211 | S | 86.4 | Confident | 91 | Very high | 0 Ų | 0 | 39.2 Ų | 39.2 | 0% | 0 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -62.3 | -37.1 | -178.9 | -51.3 | 0 | 0 | 0 | 0 | 112.3 | N213 F214 F215 K294 E298 | S211-N213 VanDerWaalsContact C-N 3.34Å; S211-N213 PolarHBondContact O-N 2.67Å; S211-F214 WeakPolarHBondContact O-CB 3.28Å; S211-F214 PolarHBondContact O-N 3.33Å; S211-F215 WeakPolarHBondContact O-CD2 3.45Å; S211-F215 PolarHBondContact O-N 2.78Å; S211-K294 WeakPolarHBondContact OG-CD 3.38Å; S211-E298 WeakPolarHBondContact CB-OE1 3.37Å; S211-E298 VanDerWaalsContact N-CD 3.32Å; S211-E298 PolarHBondContact N-OE1 2.93Å; S211-E298 PolarHBondContact N-OE2 2.98Å; S211-E298 PolarHBondContact OG-OE1 3.22Å |
| 212 | I | 88.1 | Confident | 91.2 | Very high | 50 Ų | 50 | 39.6 Ų | 39.6 | 26% | 0.256 | 21% | 0.207 | S | C | . | . | H | α-helix | trans | -62.6 | -43.1 | 178.4 | -61.3 | 166.3 | 0 | 0 | 0 | 111 | S210 F214 F215 V216 A295 E298 F299 | S210-I212 VanDerWaalsContact C-N 3.33Å; S210-I212 PolarHBondContact O-N 2.88Å; I212-F214 VanDerWaalsContact C-N 3.28Å; I212-F214 PolarHBondContact O-N 2.99Å; I212-F215 PolarHBondContact O-N 3.08Å; I212-F215 VanDerWaalsContact O-N 3.14Å; I212-V216 WeakPolarHBondContact O-CG2 3.38Å; I212-V216 PolarHBondContact O-N 3.24Å; I212-A295 HydrophobicContact CG1-CB 4.17Å; I212-E298 HydrophobicContact CD1-CB 4Å; I212-E298 HydrophobicContact CG1-CB 4.43Å; I212-F299 HydrophobicContact CD1-CB 3.63Å; I212-F299 HydrophobicContact CD1-CD2 4.15Å; I212-F299 HydrophobicContact CD1-CG 4.41Å; I212-F299 HydrophobicContact CG1-CB 4.49Å |
| 213 | N | 91 | Very high | 91.4 | Very high | 37 Ų | 37 | 43.6 Ų | 43.6 | 20% | 0.198 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -65.4 | -33.9 | 178.9 | -72.4 | -71.4 | 0 | 0 | 0 | 111.6 | K204 A205 S210 S211 F217 | K204-N213 HydrophobicContact CB-CB 4.34Å; A205-N213 HydrophobicContact CB-CB 3.72Å; S210-N213 VanDerWaalsContact CB-ND2 3.32Å; S210-N213 WeakPolarHBondContact CB-ND2 3.4Å; S210-N213 PolarHBondContact O-N 3.02Å; S210-N213 PolarHBondContact OG-ND2 2.76Å; S211-N213 VanDerWaalsContact C-N 3.34Å; S211-N213 PolarHBondContact O-N 2.67Å; N213-F217 WeakPolarHBondContact O-CB 3.22Å; N213-F217 PolarHBondContact O-N 2.79Å |
| 214 | F | 93.1 | Very high | 91.6 | Very high | 4 Ų | 4 | 44.4 Ų | 44.4 | 2% | 0.018 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -62.5 | -46 | 169.7 | -79.9 | -67.5 | 0 | 0 | 0 | 112.1 | A205 F206 S210 S211 I212 V216 F217 F218 V281 Y285 | A205-F214 HydrophobicContact CB-CB 4.45Å; A205-F214 HydrophobicContact CB-CD1 3.75Å; A205-F214 HydrophobicContact CB-CD2 3.71Å; A205-F214 HydrophobicContact CB-CE1 3.78Å; A205-F214 HydrophobicContact CB-CE2 3.75Å; A205-F214 HydrophobicContact CB-CG 3.7Å; A205-F214 HydrophobicContact CB-CZ 3.78Å; F206-F214 HydrophobicContact CD1-CE1 4.34Å; F206-F214 AromaticContact CD1-CZ 3.85Å; F206-F214 HydrophobicContact CD1-CZ 3.85Å; F206-F214 HydrophobicContact CD2-CE1 4.18Å; F206-F214 HydrophobicContact CD2-CZ 4.34Å; F206-F214 AromaticContact CE1-CE1 3.98Å; F206-F214 HydrophobicContact CE1-CE1 3.98Å; F206-F214 AromaticContact CE1-CZ 3.76Å; F206-F214 HydrophobicContact CE1-CZ 3.76Å; F206-F214 AromaticContact CE2-CE1 3.82Å; F206-F214 HydrophobicContact CE2-CE1 3.82Å; F206-F214 HydrophobicContact CE2-CZ 4.28Å; F206-F214 HydrophobicContact CG-CE1 4.44Å; F206-F214 HydrophobicContact CG-CZ 4.15Å; F206-F214 AromaticContact CZ-CE1 3.71Å; F206-F214 HydrophobicContact CZ-CE1 3.71Å; F206-F214 HydrophobicContact CZ-CZ 4Å; S210-F214 WeakPolarHBondContact O-CD2 3.45Å; S210-F214 PolarHBondContact O-N 3.28Å; S211-F214 WeakPolarHBondContact O-CB 3.28Å; S211-F214 PolarHBondContact O-N 3.33Å; I212-F214 VanDerWaalsContact C-N 3.28Å; I212-F214 PolarHBondContact O-N 2.99Å; F214-V216 PolarHBondContact O-N 3.29Å; F214-F217 WeakPolarHBondContact O-CB 3.41Å; F214-F217 PolarHBondContact O-N 3.26Å; F214-F218 HydrophobicContact CB-CD2 4.42Å; F214-F218 HydrophobicContact CB-CE2 3.86Å; F214-F218 HydrophobicContact CB-CZ 4.45Å; F214-F218 HydrophobicContact CD1-CE2 4.39Å; F214-F218 HydrophobicContact CD1-CZ 4.15Å; F214-F218 WeakPolarHBondContact O-CD2 3.16Å; F214-F218 WeakPolarHBondContact O-CG 3.02Å; F214-F218 PolarHBondContact O-N 2.84Å; F214-V281 HydrophobicContact CD1-CG1 4.35Å; F214-V281 HydrophobicContact CE1-CG1 4.15Å; F214-Y285 HydrophobicContact CB-CD2 3.75Å; F214-Y285 HydrophobicContact CB-CE2 3.87Å; F214-Y285 HydrophobicContact CB-CG 4.46Å; F214-Y285 HydrophobicContact CD1-CD2 4.16Å; F214-Y285 AromaticContact CD2-CD2 3.62Å; F214-Y285 HydrophobicContact CD2-CD2 3.62Å; F214-Y285 AromaticContact CD2-CE2 3.99Å; F214-Y285 HydrophobicContact CD2-CE2 3.99Å; F214-Y285 HydrophobicContact CE2-CD2 4.25Å; F214-Y285 AromaticContact CG-CD2 3.57Å; F214-Y285 HydrophobicContact CG-CD2 3.57Å; F214-Y285 HydrophobicContact CG-CE2 4.08Å; F214-Y285 HydrophobicContact CG-CG 4.37Å |
| 215 | F | 93.2 | Very high | 92 | Very high | 64 Ų | 64 | 40 Ų | 40 | 28% | 0.281 | 22% | 0.217 | S | C | . | . | H | α-helix | trans | -59.9 | -46 | 177.4 | -76.7 | -66.4 | 0 | 0 | 0 | 112.6 | S211 I212 F217 F218 I219 Y285 F292 A295 | S211-F215 WeakPolarHBondContact O-CD2 3.45Å; S211-F215 PolarHBondContact O-N 2.78Å; I212-F215 PolarHBondContact O-N 3.08Å; I212-F215 VanDerWaalsContact O-N 3.14Å; F215-F217 VanDerWaalsContact C-N 3.32Å; F215-F217 PolarHBondContact O-N 2.87Å; F215-F218 PolarHBondContact O-N 2.97Å; F215-I219 WeakPolarHBondContact O-CG1 3.39Å; F215-I219 PolarHBondContact O-N 2.95Å; F215-I219 VanDerWaalsContact O-N 3.09Å; F215-Y285 VanDerWaalsContact CE2-OH 3.27Å; F215-Y285 WeakPolarHBondContact CE2-OH 3.42Å; F215-Y285 HydrophobicContact CZ-CE1 4.45Å; F215-Y285 VanDerWaalsContact CZ-OH 3.27Å; F215-Y285 WeakPolarHBondContact CZ-OH 3.37Å; F215-F292 HydrophobicContact CE2-CD2 4.39Å; F215-F292 HydrophobicContact CZ-CB 4.41Å; F215-F292 HydrophobicContact CZ-CD2 4.03Å; F215-A295 HydrophobicContact CD2-CB 3.8Å; F215-A295 HydrophobicContact CE2-CB 3.48Å; F215-A295 VanDerWaalsContact CE2-CB 3.48Å |
| 216 | V | 94.5 | Very high | 92.3 | Very high | 60 Ų | 60 | 45 Ų | 45 | 36% | 0.364 | 24% | 0.244 | S | C | . | . | H | α-helix | trans | -59.2 | -46.2 | 175.3 | 174.7 | 0 | 0 | 0 | 0 | 110.4 | P201 I212 F214 F218 I219 V220 | P201-V216 HydrophobicContact CB-CB 4.31Å; P201-V216 HydrophobicContact CB-CG1 4Å; P201-V216 HydrophobicContact CG-CG1 3.84Å; I212-V216 WeakPolarHBondContact O-CG2 3.38Å; I212-V216 PolarHBondContact O-N 3.24Å; F214-V216 PolarHBondContact O-N 3.29Å; V216-F218 PolarHBondContact O-N 3.4Å; V216-I219 PolarHBondContact O-N 3.01Å; V216-V220 HydrophobicContact CG1-CG2 4.23Å; V216-V220 WeakPolarHBondContact O-CB 3.4Å; V216-V220 VanDerWaalsContact O-CG2 3.32Å; V216-V220 WeakPolarHBondContact O-CG2 3.39Å; V216-V220 PolarHBondContact O-N 3.47Å |
| 217 | F | 96.1 | Very high | 92.5 | Very high | 0 Ų | 0 | 46.9 Ų | 46.9 | 0% | 0 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -56.9 | -50 | 175.6 | 164.2 | -104.4 | 0 | 0 | 0 | 111.9 | W198 P201 L202 N213 F214 F215 I219 V220 F221 Y277 V281 | W198-F217 HydrophobicContact CB-CD2 4.31Å; W198-F217 HydrophobicContact CE3-CD2 4.13Å; W198-F217 AromaticContact CE3-CE2 3.71Å; W198-F217 HydrophobicContact CE3-CE2 3.71Å; W198-F217 HydrophobicContact CZ3-CE2 4.26Å; P201-F217 HydrophobicContact CB-CB 4.31Å; L202-F217 HydrophobicContact CB-CD2 3.66Å; L202-F217 HydrophobicContact CB-CE2 4.07Å; L202-F217 HydrophobicContact CB-CG 4.1Å; L202-F217 HydrophobicContact CD1-CD1 3.95Å; L202-F217 HydrophobicContact CD1-CD2 3.93Å; L202-F217 HydrophobicContact CD1-CE1 3.86Å; L202-F217 HydrophobicContact CD1-CE2 3.83Å; L202-F217 HydrophobicContact CD1-CG 3.98Å; L202-F217 HydrophobicContact CD1-CZ 3.78Å; L202-F217 HydrophobicContact CD2-CE2 4.07Å; L202-F217 HydrophobicContact CG-CD2 4.25Å; L202-F217 HydrophobicContact CG-CE2 4.22Å; N213-F217 WeakPolarHBondContact O-CB 3.22Å; N213-F217 PolarHBondContact O-N 2.79Å; F214-F217 WeakPolarHBondContact O-CB 3.41Å; F214-F217 PolarHBondContact O-N 3.26Å; F215-F217 VanDerWaalsContact C-N 3.32Å; F215-F217 PolarHBondContact O-N 2.87Å; F217-I219 PolarHBondContact O-N 3.43Å; F217-V220 PolarHBondContact O-N 3.25Å; F217-F221 HydrophobicContact CD2-CB 3.89Å; F217-F221 HydrophobicContact CD2-CG 4.35Å; F217-F221 HydrophobicContact CE1-CD1 4.46Å; F217-F221 HydrophobicContact CE2-CB 3.59Å; F217-F221 AromaticContact CE2-CD1 3.67Å; F217-F221 HydrophobicContact CE2-CD1 3.67Å; F217-F221 HydrophobicContact CE2-CD2 4.23Å; F217-F221 HydrophobicContact CE2-CE1 4.42Å; F217-F221 AromaticContact CE2-CG 3.57Å; F217-F221 HydrophobicContact CE2-CG 3.57Å; F217-F221 HydrophobicContact CZ-CB 4.06Å; F217-F221 AromaticContact CZ-CD1 3.51Å; F217-F221 HydrophobicContact CZ-CD1 3.51Å; F217-F221 HydrophobicContact CZ-CE1 4.17Å; F217-F221 AromaticContact CZ-CG 3.92Å; F217-F221 HydrophobicContact CZ-CG 3.92Å; F217-F221 WeakPolarHBondContact O-CA 3.47Å; F217-F221 WeakPolarHBondContact O-CB 3.25Å; F217-F221 PolarHBondContact O-N 3.47Å; F217-Y277 HydrophobicContact CZ-CD1 4.45Å; F217-Y277 HydrophobicContact CZ-CE1 4.14Å; F217-V281 HydrophobicContact CD1-CG1 4.08Å; F217-V281 HydrophobicContact CE1-CB 3.87Å; F217-V281 HydrophobicContact CE1-CG1 3.53Å; F217-V281 HydrophobicContact CE1-CG2 4.3Å; F217-V281 HydrophobicContact CZ-CB 4.41Å; F217-V281 HydrophobicContact CZ-CG1 4.36Å; F217-V281 HydrophobicContact CZ-CG2 4.39Å |
| 218 | F | 96.5 | Very high | 93 | Very high | 29 Ų | 29 | 41.4 Ų | 41.4 | 13% | 0.127 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -62.4 | -41.5 | -176.8 | -66 | -47.9 | 0 | 0 | 0 | 112.9 | F214 F215 V216 G222 V281 H282 Y285 | F214-F218 HydrophobicContact CB-CD2 4.42Å; F214-F218 HydrophobicContact CB-CE2 3.86Å; F214-F218 HydrophobicContact CB-CZ 4.45Å; F214-F218 HydrophobicContact CD1-CE2 4.39Å; F214-F218 HydrophobicContact CD1-CZ 4.15Å; F214-F218 WeakPolarHBondContact O-CD2 3.16Å; F214-F218 WeakPolarHBondContact O-CG 3.02Å; F214-F218 PolarHBondContact O-N 2.84Å; F215-F218 PolarHBondContact O-N 2.97Å; V216-F218 PolarHBondContact O-N 3.4Å; F218-G222 WeakPolarHBondContact O-CA 3.03Å; F218-G222 PolarHBondContact O-N 2.83Å; F218-V281 HydrophobicContact CE1-CB 4.28Å; F218-V281 HydrophobicContact CE1-CG1 3.87Å; F218-V281 HydrophobicContact CZ-CG1 4.16Å; F218-H282 HydrophobicContact CD1-CB 4.29Å; F218-H282 HydrophobicContact CE1-CB 3.65Å; F218-H282 HydrophobicContact CZ-CB 3.99Å; F218-Y285 AromaticContact CE2-CD1 3.77Å; F218-Y285 HydrophobicContact CE2-CD1 3.77Å; F218-Y285 HydrophobicContact CE2-CD2 4.41Å; F218-Y285 HydrophobicContact CE2-CE1 4.35Å; F218-Y285 AromaticContact CE2-CG 3.81Å; F218-Y285 HydrophobicContact CE2-CG 3.81Å; F218-Y285 HydrophobicContact CZ-CD1 4.27Å; F218-Y285 HydrophobicContact CZ-CG 4.04Å |
| 219 | I | 96.9 | Very high | 93.7 | Very high | 118 Ų | 118 | 41.2 Ų | 41.2 | 61% | 0.605 | 23% | 0.227 | S | C | * | . | H | α-helix | trans | -67.4 | -53.4 | 179.6 | -65.7 | 167.7 | 0 | 0 | 0 | 109.9 | F215 V216 F217 G222 V223 | F215-I219 WeakPolarHBondContact O-CG1 3.39Å; F215-I219 PolarHBondContact O-N 2.95Å; F215-I219 VanDerWaalsContact O-N 3.09Å; V216-I219 PolarHBondContact O-N 3.01Å; F217-I219 PolarHBondContact O-N 3.43Å; I219-G222 PolarHBondContact O-N 2.84Å; I219-V223 WeakPolarHBondContact O-CG2 3.38Å; I219-V223 PolarHBondContact O-N 3.19Å |
| 220 | V | 97.6 | Very high | 94.6 | Very high | 46 Ų | 46 | 40.1 Ų | 40.1 | 28% | 0.279 | 22% | 0.221 | S | C | . | . | H | α-helix | trans | -67.8 | -43.4 | -175.6 | 179.4 | 0 | 0 | 0 | 0 | 111.3 | C197 W198 V216 F217 G222 V223 Q224 | C197-V220 HydrophobicContact CB-CG1 3.66Å; C197-V220 WeakPolarHBondContact O-CB 3.36Å; C197-V220 WeakPolarHBondContact O-CG1 3.09Å; W198-V220 HydrophobicContact CB-CB 4.32Å; W198-V220 HydrophobicContact CB-CG1 3.97Å; V216-V220 HydrophobicContact CG1-CG2 4.23Å; V216-V220 WeakPolarHBondContact O-CB 3.4Å; V216-V220 VanDerWaalsContact O-CG2 3.32Å; V216-V220 WeakPolarHBondContact O-CG2 3.39Å; V216-V220 PolarHBondContact O-N 3.47Å; F217-V220 PolarHBondContact O-N 3.25Å; V220-G222 VanDerWaalsContact C-N 3.3Å; V220-G222 PolarHBondContact O-N 3.15Å; V220-V223 PolarHBondContact O-N 3.37Å; V220-Q224 WeakPolarHBondContact O-CB 3.26Å; V220-Q224 PolarHBondContact O-N 3.45Å |
| 221 | F | 98.1 | Very high | 95.3 | Very high | 1 Ų | 1 | 39.8 Ų | 39.8 | 0% | 0.004 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -69.8 | -30.6 | 178.8 | -164.9 | -123.6 | 0 | 0 | 0 | 111.8 | L149 W198 F217 Q224 V225 S274 Y277 L278 | L149-F221 HydrophobicContact CD2-CZ 3.98Å; W198-F221 HydrophobicContact CB-CB 4.11Å; W198-F221 HydrophobicContact CB-CD2 4.25Å; W198-F221 AromaticContact CD2-CD2 3.45Å; W198-F221 HydrophobicContact CD2-CD2 3.45Å; W198-F221 VanDerWaalsContact CD2-CD2 3.45Å; W198-F221 AromaticContact CD2-CE2 3.84Å; W198-F221 HydrophobicContact CD2-CE2 3.84Å; W198-F221 HydrophobicContact CD2-CG 4.37Å; W198-F221 AromaticContact CE2-CD2 3.78Å; W198-F221 AromaticContact CE2-CE2 3.76Å; W198-F221 AromaticContact CE3-CD2 3.7Å; W198-F221 HydrophobicContact CE3-CD2 3.7Å; W198-F221 AromaticContact CE3-CE2 3.95Å; W198-F221 HydrophobicContact CE3-CE2 3.95Å; W198-F221 HydrophobicContact CE3-CG 4.35Å; W198-F221 HydrophobicContact CG-CB 4.48Å; W198-F221 AromaticContact CG-CD2 3.71Å; W198-F221 HydrophobicContact CG-CD2 3.71Å; W198-F221 HydrophobicContact CG-CE2 4.49Å; W198-F221 HydrophobicContact CH2-CD2 4.49Å; W198-F221 AromaticContact CH2-CE2 3.92Å; W198-F221 HydrophobicContact CH2-CE2 3.92Å; W198-F221 HydrophobicContact CZ2-CD2 4.3Å; W198-F221 AromaticContact CZ2-CE2 3.81Å; W198-F221 HydrophobicContact CZ2-CE2 3.81Å; W198-F221 HydrophobicContact CZ3-CD2 4.22Å; W198-F221 AromaticContact CZ3-CE2 3.99Å; W198-F221 HydrophobicContact CZ3-CE2 3.99Å; F217-F221 HydrophobicContact CD2-CB 3.89Å; F217-F221 HydrophobicContact CD2-CG 4.35Å; F217-F221 HydrophobicContact CE1-CD1 4.46Å; F217-F221 HydrophobicContact CE2-CB 3.59Å; F217-F221 AromaticContact CE2-CD1 3.67Å; F217-F221 HydrophobicContact CE2-CD1 3.67Å; F217-F221 HydrophobicContact CE2-CD2 4.23Å; F217-F221 HydrophobicContact CE2-CE1 4.42Å; F217-F221 AromaticContact CE2-CG 3.57Å; F217-F221 HydrophobicContact CE2-CG 3.57Å; F217-F221 HydrophobicContact CZ-CB 4.06Å; F217-F221 AromaticContact CZ-CD1 3.51Å; F217-F221 HydrophobicContact CZ-CD1 3.51Å; F217-F221 HydrophobicContact CZ-CE1 4.17Å; F217-F221 AromaticContact CZ-CG 3.92Å; F217-F221 HydrophobicContact CZ-CG 3.92Å; F217-F221 WeakPolarHBondContact O-CA 3.47Å; F217-F221 WeakPolarHBondContact O-CB 3.25Å; F217-F221 PolarHBondContact O-N 3.47Å; F221-Q224 HydrophobicContact CD2-CB 4.15Å; F221-Q224 HydrophobicContact CD2-CG 4.19Å; F221-Q224 HydrophobicContact CE2-CG 4.38Å; F221-Q224 WeakPolarHBondContact O-CB 3.39Å; F221-Q224 PolarHBondContact O-N 2.87Å; F221-V225 HydrophobicContact CE1-CG2 4.4Å; F221-V225 WeakPolarHBondContact O-CG2 3.33Å; F221-V225 PolarHBondContact O-N 2.96Å; F221-S274 WeakPolarHBondContact CE1-O 3.49Å; F221-Y277 AromaticContact CE1-CD1 3.76Å; F221-Y277 HydrophobicContact CE1-CD1 3.76Å; F221-Y277 HydrophobicContact CZ-CD1 4.04Å; F221-L278 HydrophobicContact CD1-CB 3.79Å; F221-L278 HydrophobicContact CD1-CD1 3.9Å; F221-L278 HydrophobicContact CD1-CG 4.06Å; F221-L278 HydrophobicContact CE1-CB 3.88Å |
| 222 | G | 97.7 | Very high | 95.8 | Very high | 22 Ų | 22 | 40.2 Ų | 40.2 | 23% | 0.227 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -59.7 | -48.6 | 169.3 | 0 | 0 | 0 | 0 | 0 | 112 | F218 I219 V220 Q224 V225 L226 | F218-G222 WeakPolarHBondContact O-CA 3.03Å; F218-G222 PolarHBondContact O-N 2.83Å; I219-G222 PolarHBondContact O-N 2.84Å; V220-G222 VanDerWaalsContact C-N 3.3Å; V220-G222 PolarHBondContact O-N 3.15Å; G222-Q224 VanDerWaalsContact C-N 3.34Å; G222-Q224 PolarHBondContact O-N 3.49Å; G222-V225 PolarHBondContact O-N 3.39Å; G222-L226 PolarHBondContact O-N 3.47Å |
| 223 | V | 97.8 | Very high | 96.3 | Very high | 85 Ų | 85 | 41.4 Ų | 41.4 | 52% | 0.515 | 23% | 0.226 | S | C | . | . | H | α-helix | trans | -62.6 | -40.5 | 174.2 | 175.8 | 0 | 0 | 0 | 0 | 111.3 | I219 V220 V225 L226 V227 | I219-V223 WeakPolarHBondContact O-CG2 3.38Å; I219-V223 PolarHBondContact O-N 3.19Å; V220-V223 PolarHBondContact O-N 3.37Å; V223-V225 VanDerWaalsContact C-N 3.33Å; V223-V225 PolarHBondContact O-N 2.9Å; V223-L226 WeakPolarHBondContact O-CB 3.28Å; V223-L226 PolarHBondContact O-N 2.89Å; V223-L226 VanDerWaalsContact O-N 3.13Å; V223-V227 WeakPolarHBondContact O-CG2 3.32Å; V223-V227 PolarHBondContact O-N 3.26Å |
| 224 | Q | 97.2 | Very high | 96.4 | Very high | 22 Ų | 22 | 39.6 Ų | 39.6 | 10% | 0.103 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -57.5 | -44.4 | 175.4 | 179.6 | 68.3 | 33.1 | 0 | 0 | 111.7 | Y153 V220 F221 G222 L226 V227 M228 | Y153-Q224 VanDerWaalsContact CE1-NE2 3.32Å; Y153-Q224 PolarHBondContact OH-NE2 3.25Å; V220-Q224 WeakPolarHBondContact O-CB 3.26Å; V220-Q224 PolarHBondContact O-N 3.45Å; F221-Q224 HydrophobicContact CD2-CB 4.15Å; F221-Q224 HydrophobicContact CD2-CG 4.19Å; F221-Q224 HydrophobicContact CE2-CG 4.38Å; F221-Q224 WeakPolarHBondContact O-CB 3.39Å; F221-Q224 PolarHBondContact O-N 2.87Å; G222-Q224 VanDerWaalsContact C-N 3.34Å; G222-Q224 PolarHBondContact O-N 3.49Å; Q224-L226 VanDerWaalsContact C-N 3.32Å; Q224-L226 PolarHBondContact O-N 3.26Å; Q224-V227 PolarHBondContact O-N 3.45Å; Q224-M228 HydrophobicContact CG-SD 4.05Å; Q224-M228 VanDerWaalsContact O-CG 3.25Å; Q224-M228 WeakPolarHBondContact O-CG 3.48Å; Q224-M228 PolarHBondContact O-N 2.73Å |
| 225 | V | 98.2 | Very high | 96.2 | Very high | 13 Ų | 13 | 43 Ų | 43 | 8% | 0.079 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -61.5 | -41.2 | 176.2 | 170.9 | 0 | 0 | 0 | 0 | 110.9 | F221 G222 V223 V227 M228 I229 A275 L278 | F221-V225 HydrophobicContact CE1-CG2 4.4Å; F221-V225 WeakPolarHBondContact O-CG2 3.33Å; F221-V225 PolarHBondContact O-N 2.96Å; G222-V225 PolarHBondContact O-N 3.39Å; V223-V225 VanDerWaalsContact C-N 3.33Å; V223-V225 PolarHBondContact O-N 2.9Å; V225-V227 PolarHBondContact O-N 2.95Å; V225-M228 PolarHBondContact O-N 3.03Å; V225-I229 HydrophobicContact CG1-CD1 4.3Å; V225-I229 WeakPolarHBondContact O-CG1 3.43Å; V225-I229 PolarHBondContact O-N 3.13Å; V225-A275 HydrophobicContact CG1-CB 4.17Å; V225-L278 HydrophobicContact CG2-CD1 4.37Å |
| 226 | L | 97.1 | Very high | 95.6 | Very high | 106 Ų | 106 | 43.8 Ų | 43.8 | 56% | 0.555 | 24% | 0.241 | S | C | * | . | H | α-helix | trans | -61.8 | -43.1 | 175.3 | -63.3 | 176.8 | 0 | 0 | 0 | 112.2 | G222 V223 Q224 M228 I229 I230 | G222-L226 PolarHBondContact O-N 3.47Å; V223-L226 WeakPolarHBondContact O-CB 3.28Å; V223-L226 PolarHBondContact O-N 2.89Å; V223-L226 VanDerWaalsContact O-N 3.13Å; Q224-L226 VanDerWaalsContact C-N 3.32Å; Q224-L226 PolarHBondContact O-N 3.26Å; L226-M228 VanDerWaalsContact C-N 3.29Å; L226-M228 PolarHBondContact O-N 3.42Å; L226-I229 HydrophobicContact CD2-CD1 4.37Å; L226-I229 WeakPolarHBondContact O-CB 3.12Å; L226-I229 PolarHBondContact O-N 3.19Å; L226-I230 WeakPolarHBondContact O-CG1 3.05Å; L226-I230 PolarHBondContact O-N 2.95Å; L226-I230 VanDerWaalsContact O-N 3.13Å |
| 227 | V | 95.5 | Very high | 95.1 | Very high | 44 Ų | 44 | 44.4 Ų | 44.4 | 27% | 0.267 | 24% | 0.242 | S | C | . | . | H | α-helix | trans | -59.9 | -41.4 | 174.4 | 171.6 | 0 | 0 | 0 | 0 | 110.8 | V223 Q224 V225 I230 Q231 | V223-V227 WeakPolarHBondContact O-CG2 3.32Å; V223-V227 PolarHBondContact O-N 3.26Å; Q224-V227 PolarHBondContact O-N 3.45Å; V225-V227 PolarHBondContact O-N 2.95Å; V227-I230 PolarHBondContact O-N 3.03Å; V227-Q231 HydrophobicContact CG1-CG 4.48Å; V227-Q231 WeakPolarHBondContact O-CG 3.49Å; V227-Q231 PolarHBondContact O-N 3.23Å |
| 228 | M | 97.2 | Very high | 94.8 | Very high | 3 Ų | 3 | 50.6 Ų | 50.6 | 2% | 0.015 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -69.2 | -31.8 | 178.9 | -67.1 | 171.4 | 65.8 | 0 | 0 | 113.1 | Y153 Q224 V225 L226 Q231 S232 I270 T271 | Y153-M228 HydrophobicContact CD2-CE 3.88Å; Y153-M228 HydrophobicContact CD2-CG 4.26Å; Y153-M228 HydrophobicContact CD2-SD 4.1Å; Y153-M228 HydrophobicContact CE2-CE 4.33Å; Y153-M228 HydrophobicContact CE2-CG 3.78Å; Y153-M228 HydrophobicContact CE2-SD 4.17Å; Q224-M228 HydrophobicContact CG-SD 4.05Å; Q224-M228 VanDerWaalsContact O-CG 3.25Å; Q224-M228 WeakPolarHBondContact O-CG 3.48Å; Q224-M228 PolarHBondContact O-N 2.73Å; V225-M228 PolarHBondContact O-N 3.03Å; L226-M228 VanDerWaalsContact C-N 3.29Å; L226-M228 PolarHBondContact O-N 3.42Å; M228-Q231 PolarHBondContact O-N 3.48Å; M228-S232 WeakPolarHBondContact O-CB 3.41Å; M228-S232 PolarHBondContact O-N 3.25Å; M228-S232 PolarHBondContact O-OG 3.48Å; M228-I270 HydrophobicContact CE-CB 4.26Å; M228-I270 HydrophobicContact CE-CG2 3.57Å; M228-T271 HydrophobicContact CB-CG2 4.2Å; M228-T271 WeakPolarHBondContact CB-OG1 3.38Å; M228-T271 PolarHBondContact O-OG1 3.48Å |
| 229 | I | 97.4 | Very high | 94.6 | Very high | 73 Ų | 73 | 49.2 Ų | 49.2 | 37% | 0.374 | 26% | 0.26 | S | S | . | . | H | α-helix | trans | -61.2 | -47.1 | 169.7 | -68.1 | 167.4 | 0 | 0 | 0 | 110 | V225 L226 Q231 S232 I233 T271 | V225-I229 HydrophobicContact CG1-CD1 4.3Å; V225-I229 WeakPolarHBondContact O-CG1 3.43Å; V225-I229 PolarHBondContact O-N 3.13Å; L226-I229 HydrophobicContact CD2-CD1 4.37Å; L226-I229 WeakPolarHBondContact O-CB 3.12Å; L226-I229 PolarHBondContact O-N 3.19Å; I229-Q231 VanDerWaalsContact C-N 3.34Å; I229-Q231 PolarHBondContact O-N 3.39Å; I229-S232 WeakPolarHBondContact O-CB 3.04Å; I229-S232 PolarHBondContact O-N 2.86Å; I229-I233 HydrophobicContact CG2-CD1 4.14Å; I229-I233 WeakPolarHBondContact O-CG1 3.32Å; I229-I233 PolarHBondContact O-N 3.45Å; I229-T271 HydrophobicContact CB-CG2 4.47Å; I229-T271 HydrophobicContact CG1-CG2 3.51Å |
| 230 | I | 95.8 | Very high | 94.5 | Very high | 51 Ų | 51 | 43.7 Ų | 43.7 | 26% | 0.262 | 23% | 0.232 | S | C | . | . | H | α-helix | trans | -61.5 | -42.9 | 178.1 | -64.7 | 167.1 | 0 | 0 | 0 | 111 | L226 V227 S232 I233 G234 I235 W238 | L226-I230 WeakPolarHBondContact O-CG1 3.05Å; L226-I230 PolarHBondContact O-N 2.95Å; L226-I230 VanDerWaalsContact O-N 3.13Å; V227-I230 PolarHBondContact O-N 3.03Å; I230-S232 VanDerWaalsContact C-N 3.35Å; I230-S232 PolarHBondContact O-N 3.5Å; I230-I233 PolarHBondContact O-N 3.11Å; I230-G234 PolarHBondContact O-N 2.9Å; I230-I235 HydrophobicContact CG2-CD1 4.01Å; I230-I235 HydrophobicContact CG2-CG1 4.47Å; I230-W238 HydrophobicContact CD1-CH2 4.43Å; I230-W238 HydrophobicContact CD1-CZ3 4.45Å; I230-W238 HydrophobicContact CG2-CD2 4.03Å; I230-W238 HydrophobicContact CG2-CE3 3.59Å; I230-W238 HydrophobicContact CG2-CH2 4.29Å; I230-W238 HydrophobicContact CG2-CZ3 3.74Å |
| 231 | Q | 96.3 | Very high | 94.4 | Very high | 8 Ų | 8 | 41.5 Ų | 41.5 | 4% | 0.037 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -63.6 | -38.7 | 176.1 | -71.3 | 171.1 | -9.7 | 0 | 0 | 112.5 | Y153 V227 M228 I229 I233 G234 S240 F267 | Y153-Q231 PolarHBondContact OH-NE2 3.14Å; Y153-Q231 VanDerWaalsContact OH-NE2 3.13Å; Y153-Q231 PolarHBondContact OH-OE1 2.99Å; V227-Q231 HydrophobicContact CG1-CG 4.48Å; V227-Q231 WeakPolarHBondContact O-CG 3.49Å; V227-Q231 PolarHBondContact O-N 3.23Å; M228-Q231 PolarHBondContact O-N 3.48Å; I229-Q231 VanDerWaalsContact C-N 3.34Å; I229-Q231 PolarHBondContact O-N 3.39Å; Q231-I233 VanDerWaalsContact C-N 3.34Å; Q231-I233 PolarHBondContact O-N 2.93Å; Q231-G234 PolarHBondContact O-N 3.3Å; Q231-S240 WeakPolarHBondContact O-CB 3.48Å; Q231-S240 PolarHBondContact O-OG 3.43Å; Q231-F267 HydrophobicContact CB-CD1 3.89Å; Q231-F267 HydrophobicContact CB-CE1 3.77Å; Q231-F267 HydrophobicContact CB-CZ 4.26Å; Q231-F267 HydrophobicContact CG-CE1 4.38Å; Q231-F267 VanDerWaalsContact OE1-CE1 3.26Å |
| 232 | S | 97.5 | Very high | 94.2 | Very high | 9 Ų | 9 | 41.5 Ų | 41.5 | 6% | 0.063 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -62.3 | -42.5 | 176.1 | -58 | 0 | 0 | 0 | 0 | 111.4 | M228 I229 I230 G234 G242 W243 F267 T268 T271 | M228-S232 WeakPolarHBondContact O-CB 3.41Å; M228-S232 PolarHBondContact O-N 3.25Å; M228-S232 PolarHBondContact O-OG 3.48Å; I229-S232 WeakPolarHBondContact O-CB 3.04Å; I229-S232 PolarHBondContact O-N 2.86Å; I230-S232 VanDerWaalsContact C-N 3.35Å; I230-S232 PolarHBondContact O-N 3.5Å; S232-G234 VanDerWaalsContact C-N 3.32Å; S232-G234 PolarHBondContact O-N 2.7Å; S232-G242 VanDerWaalsContact O-CA 3.29Å; S232-G242 WeakPolarHBondContact O-CA 3.41Å; S232-W243 PolarHBondContact O-N 3.43Å; S232-F267 VanDerWaalsContact OG-C 3.29Å; S232-F267 PolarHBondContact OG-O 2.99Å; S232-T268 PolarHBondContact OG-N 2.99Å; S232-T271 PolarHBondContact OG-OG1 2.87Å; S232-T271 VanDerWaalsContact OG-OG1 3.1Å |
| 233 | I | 97 | Very high | 94.2 | Very high | 74 Ų | 74 | 45.5 Ų | 45.5 | 38% | 0.379 | 23% | 0.226 | S | C | . | . | H | α-helix | trans | -62.6 | -41.9 | 175.4 | -67.3 | 166.5 | 0 | 0 | 0 | 110.3 | I229 I230 Q231 I235 W243 I244 | I229-I233 HydrophobicContact CG2-CD1 4.14Å; I229-I233 WeakPolarHBondContact O-CG1 3.32Å; I229-I233 PolarHBondContact O-N 3.45Å; I230-I233 PolarHBondContact O-N 3.11Å; Q231-I233 VanDerWaalsContact C-N 3.34Å; Q231-I233 PolarHBondContact O-N 2.93Å; I233-I235 HydrophobicContact CG2-CG1 4.11Å; I233-W243 PolarHBondContact O-N 3.22Å; I233-I244 HydrophobicContact CG2-CD1 3.49Å; I233-I244 VanDerWaalsContact CG2-CD1 3.49Å; I233-I244 HydrophobicContact CG2-CG1 4.14Å; I233-I244 WeakPolarHBondContact O-CG1 3.44Å; I233-I244 PolarHBondContact O-N 2.95Å |
| 234 | G | 92.8 | Very high | 94.1 | Very high | 0 Ų | 0 | 45.1 Ų | 45.1 | 0% | 0 | 22% | 0.221 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 75.3 | 51.3 | 177.3 | 0 | 0 | 0 | 0 | 0 | 113 | I230 Q231 S232 I236 T245 | I230-G234 PolarHBondContact O-N 2.9Å; Q231-G234 PolarHBondContact O-N 3.3Å; S232-G234 VanDerWaalsContact C-N 3.32Å; S232-G234 PolarHBondContact O-N 2.7Å; G234-I236 PolarHBondContact O-N 2.92Å; G234-T245 PolarHBondContact O-OG1 3.37Å |
| 235 | I | 89.4 | Confident | 93.9 | Very high | 74 Ų | 74 | 44.2 Ų | 44.2 | 38% | 0.379 | 22% | 0.217 | S | C | . | . | trans | -54.5 | 136.7 | 175.8 | -57.9 | 179 | 0 | 0 | 0 | 109.3 | I230 I233 N237 W238 | I230-I235 HydrophobicContact CG2-CD1 4.01Å; I230-I235 HydrophobicContact CG2-CG1 4.47Å; I233-I235 HydrophobicContact CG2-CG1 4.11Å; I235-N237 PolarHBondContact O-N 3.27Å; I235-W238 HydrophobicContact CB-CB 4.44Å; I235-W238 HydrophobicContact CB-CG 4.27Å; I235-W238 WeakPolarHBondContact O-CB 3.46Å; I235-W238 PolarHBondContact O-N 3.31Å; I235-W238 VanDerWaalsContact O-N 3.07Å | ||
| 236 | I | 81 | Confident | 93.7 | Very high | 82 Ų | 82 | 43.6 Ų | 43.6 | 42% | 0.421 | 21% | 0.213 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -55 | 132.8 | -178.9 | -57.9 | 173.5 | 0 | 0 | 0 | 109 | Y175 G234 W238 I244 | Y175-I236 HydrophobicContact CD2-CG2 4.07Å; Y175-I236 HydrophobicContact CE2-CG2 4.5Å; Y175-I236 HydrophobicContact CG-CG2 4.13Å; G234-I236 PolarHBondContact O-N 2.92Å; I236-W238 PolarHBondContact O-N 2.69Å; I236-I244 HydrophobicContact CG1-CG2 4.28Å |
| 237 | N | 83.3 | Confident | 93.7 | Very high | 73 Ų | 73 | 43.5 Ų | 43.5 | 39% | 0.39 | 21% | 0.212 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 70.9 | 10.5 | -176.6 | -56.2 | -41.6 | 0 | 0 | 0 | 117.5 | Y175 S178 I235 G239 | Y175-N237 WeakPolarHBondContact CB-OD1 3.3Å; S178-N237 WeakPolarHBondContact CB-OD1 3.38Å; S178-N237 PolarHBondContact OG-OD1 3.03Å; I235-N237 PolarHBondContact O-N 3.27Å; N237-G239 VanDerWaalsContact C-N 3.34Å |
| 238 | W | 90 | Very high | 93.5 | Very high | 129 Ų | 129 | 44 Ų | 44 | 49% | 0.489 | 22% | 0.221 | S | C | . | . | S | Bend | trans | -90 | 6.8 | 174 | -91.7 | 63.2 | 0 | 0 | 0 | 115 | I230 I235 I236 S240 | I230-W238 HydrophobicContact CD1-CH2 4.43Å; I230-W238 HydrophobicContact CD1-CZ3 4.45Å; I230-W238 HydrophobicContact CG2-CD2 4.03Å; I230-W238 HydrophobicContact CG2-CE3 3.59Å; I230-W238 HydrophobicContact CG2-CH2 4.29Å; I230-W238 HydrophobicContact CG2-CZ3 3.74Å; I235-W238 HydrophobicContact CB-CB 4.44Å; I235-W238 HydrophobicContact CB-CG 4.27Å; I235-W238 WeakPolarHBondContact O-CB 3.46Å; I235-W238 PolarHBondContact O-N 3.31Å; I235-W238 VanDerWaalsContact O-N 3.07Å; I236-W238 PolarHBondContact O-N 2.69Å; W238-S240 VanDerWaalsContact C-N 3.25Å; W238-S240 PolarHBondContact O-N 2.83Å |
| 239 | G | 92.5 | Very high | 93.3 | Very high | 1 Ų | 1 | 44 Ų | 44 | 1% | 0.01 | 22% | 0.221 | C | C | . | . | S | Bend | trans | 73.7 | 10.4 | 176.5 | 0 | 0 | 0 | 0 | 0 | 115.3 | N160 L179 A183 N237 | N160-G239 PolarHBondContact ND2-O 3.39Å; L179-G239 WeakPolarHBondContact O-CA 3.04Å; A183-G239 VanDerWaalsContact CB-O 3.31Å; A183-G239 WeakPolarHBondContact CB-O 3.02Å; N237-G239 VanDerWaalsContact C-N 3.34Å |
| 240 | S | 95.3 | Very high | 93.2 | Very high | 2 Ų | 2 | 42.4 Ų | 42.4 | 1% | 0.014 | 22% | 0.215 | C | C | . | . | trans | -114.3 | 129.1 | 177.2 | 53.8 | 0 | 0 | 0 | 0 | 111.8 | N160 Q231 W238 G242 T245 | N160-S240 WeakPolarHBondContact OD1-CA 3.31Å; Q231-S240 WeakPolarHBondContact O-CB 3.48Å; Q231-S240 PolarHBondContact O-OG 3.43Å; W238-S240 VanDerWaalsContact C-N 3.25Å; W238-S240 PolarHBondContact O-N 2.83Å; S240-G242 PolarHBondContact O-N 3.33Å; S240-T245 PolarHBondContact O-OG1 3.49Å | ||
| 241 | C | 95.3 | Very high | 93.1 | Very high | 0 Ų | 0 | 49.2 Ų | 49.2 | 0% | 0 | 24% | 0.243 | C | C | . | . | trans | -77.9 | 61.2 | 169.7 | -60.6 | 0 | 0 | 0 | 0 | 110.4 | N160 T163 V263 A264 | N160-C241 PolarHBondContact OD1-N 3.46Å; T163-C241 HydrophobicContact CG2-CB 4.06Å; C241-V263 HydrophobicContact CB-CB 4.42Å; C241-V263 HydrophobicContact CB-CG1 4.13Å; C241-A264 PolarHBondContact O-N 3.13Å | ||
| 242 | G | 95.1 | Very high | 93 | Very high | 0 Ų | 0 | 52.5 Ų | 52.5 | 0% | 0 | 27% | 0.267 | C | S | . | . | trans | -83.2 | -169.1 | 176.7 | 0 | 0 | 0 | 0 | 0 | 113 | S232 S240 I244 T245 G246 A264 | S232-G242 VanDerWaalsContact O-CA 3.29Å; S232-G242 WeakPolarHBondContact O-CA 3.41Å; S240-G242 PolarHBondContact O-N 3.33Å; G242-I244 PolarHBondContact O-N 2.86Å; G242-T245 PolarHBondContact O-N 2.94Å; G242-G246 PolarHBondContact O-N 3.04Å; G242-A264 VanDerWaalsContact C-CB 3.47Å | ||
| 243 | W | 97.3 | Very high | 92.9 | Very high | 106 Ų | 106 | 54.7 Ų | 54.7 | 40% | 0.402 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -56.5 | -45.5 | -173.7 | -73.9 | 105 | 0 | 0 | 0 | 113.5 | S232 I233 G246 L247 L261 A264 T268 | S232-W243 PolarHBondContact O-N 3.43Å; I233-W243 PolarHBondContact O-N 3.22Å; W243-G246 PolarHBondContact O-N 3.43Å; W243-L247 WeakPolarHBondContact O-CB 3.38Å; W243-L247 VanDerWaalsContact O-CG 3.24Å; W243-L247 WeakPolarHBondContact O-CG 3.48Å; W243-L247 PolarHBondContact O-N 3.32Å; W243-L261 HydrophobicContact CE3-CD2 3.68Å; W243-L261 HydrophobicContact CZ3-CD2 3.86Å; W243-A264 HydrophobicContact CD2-CB 4.03Å; W243-A264 HydrophobicContact CG-CB 4.04Å; W243-T268 PolarHBondContact NE1-OG1 3.23Å |
| 244 | I | 95.3 | Very high | 92.8 | Very high | 77 Ų | 77 | 55 Ų | 55 | 40% | 0.395 | 28% | 0.284 | S | S | . | . | H | α-helix | trans | -62.1 | -49.6 | -179.2 | -64.9 | 174.6 | 0 | 0 | 0 | 110.4 | I233 I236 G242 G246 L247 A248 | I233-I244 HydrophobicContact CG2-CD1 3.49Å; I233-I244 VanDerWaalsContact CG2-CD1 3.49Å; I233-I244 HydrophobicContact CG2-CG1 4.14Å; I233-I244 WeakPolarHBondContact O-CG1 3.44Å; I233-I244 PolarHBondContact O-N 2.95Å; I236-I244 HydrophobicContact CG1-CG2 4.28Å; G242-I244 PolarHBondContact O-N 2.86Å; I244-G246 PolarHBondContact O-N 2.89Å; I244-L247 PolarHBondContact O-N 3.06Å; I244-A248 VanDerWaalsContact O-CB 3.24Å; I244-A248 WeakPolarHBondContact O-CB 3.42Å; I244-A248 PolarHBondContact O-N 3.25Å |
| 245 | T | 93.2 | Very high | 93 | Very high | 4 Ų | 4 | 60.1 Ų | 60.1 | 3% | 0.025 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -58.6 | -46.4 | 177.7 | -57.8 | 0 | 0 | 0 | 0 | 111.9 | Y167 L179 G234 S240 G242 A248 V249 | Y167-T245 HydrophobicContact CD2-CG2 4.31Å; Y167-T245 HydrophobicContact CE2-CG2 4.02Å; L179-T245 HydrophobicContact CD1-CG2 3.65Å; G234-T245 PolarHBondContact O-OG1 3.37Å; S240-T245 PolarHBondContact O-OG1 3.49Å; G242-T245 PolarHBondContact O-N 2.94Å; T245-A248 PolarHBondContact O-N 3.47Å; T245-V249 WeakPolarHBondContact O-CG1 3.43Å; T245-V249 PolarHBondContact O-N 3.42Å |
| 246 | G | 94.5 | Very high | 93.3 | Very high | 0 Ų | 0 | 57.3 Ų | 57.3 | 0% | 0 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -64.9 | -46.7 | -179.3 | 0 | 0 | 0 | 0 | 0 | 113 | G242 W243 I244 A248 V249 V250 | G242-G246 PolarHBondContact O-N 3.04Å; W243-G246 PolarHBondContact O-N 3.43Å; I244-G246 PolarHBondContact O-N 2.89Å; G246-A248 VanDerWaalsContact C-N 3.3Å; G246-A248 PolarHBondContact O-N 2.94Å; G246-V249 PolarHBondContact O-N 3.2Å; G246-V250 WeakPolarHBondContact O-CB 3.38Å; G246-V250 PolarHBondContact O-N 2.84Å |
| 247 | L | 95.2 | Very high | 94 | Very high | 103 Ų | 103 | 53.4 Ų | 53.4 | 54% | 0.539 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -66.7 | -30.9 | 177.9 | -68.4 | 173.2 | 0 | 0 | 0 | 112.6 | W243 I244 L261 | W243-L247 WeakPolarHBondContact O-CB 3.38Å; W243-L247 VanDerWaalsContact O-CG 3.24Å; W243-L247 WeakPolarHBondContact O-CG 3.48Å; W243-L247 PolarHBondContact O-N 3.32Å; I244-L247 PolarHBondContact O-N 3.06Å; L247-L261 HydrophobicContact CD2-CD2 4.05Å; L247-L261 HydrophobicContact CG-CD2 4.06Å |
| 248 | A | 92.6 | Very high | 94.7 | Very high | 55 Ų | 55 | 53.7 Ų | 53.7 | 46% | 0.455 | 29% | 0.285 | S | S | . | . | H | α-helix | trans | -68.4 | -35 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.8 | I244 T245 G246 | I244-A248 VanDerWaalsContact O-CB 3.24Å; I244-A248 WeakPolarHBondContact O-CB 3.42Å; I244-A248 PolarHBondContact O-N 3.25Å; T245-A248 PolarHBondContact O-N 3.47Å; G246-A248 VanDerWaalsContact C-N 3.3Å; G246-A248 PolarHBondContact O-N 2.94Å |
| 249 | V | 93 | Very high | 95 | Very high | 2 Ų | 2 | 50.6 Ų | 50.6 | 1% | 0.012 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -99.6 | -20 | -173.2 | 74.8 | 0 | 0 | 0 | 0 | 114.1 | Y167 T245 G246 K251 S252 N253 I256 | Y167-V249 HydrophobicContact CD2-CG1 4.31Å; Y167-V249 HydrophobicContact CD2-CG2 4.35Å; Y167-V249 HydrophobicContact CE2-CB 3.74Å; Y167-V249 HydrophobicContact CE2-CG1 3.91Å; Y167-V249 HydrophobicContact CE2-CG2 3.72Å; T245-V249 WeakPolarHBondContact O-CG1 3.43Å; T245-V249 PolarHBondContact O-N 3.42Å; G246-V249 PolarHBondContact O-N 3.2Å; V249-K251 PolarHBondContact O-N 3.41Å; V249-K251 VanDerWaalsContact O-N 3.12Å; V249-S252 PolarHBondContact O-N 3.33Å; V249-S252 VanDerWaalsContact O-N 3.09Å; V249-S252 PolarHBondContact O-OG 2.95Å; V249-S252 VanDerWaalsContact O-OG 3.05Å; V249-N253 HydrophobicContact CG2-CB 4.12Å; V249-N253 CarbonylContact O-C 3.44Å; V249-N253 PolarHBondContact O-N 3.45Å; V249-I256 HydrophobicContact CG1-CG2 4.28Å; V249-I256 HydrophobicContact CG2-CG2 4.43Å |
| 250 | V | 94.9 | Very high | 95.2 | Very high | 41 Ų | 41 | 50.5 Ų | 50.5 | 25% | 0.248 | 28% | 0.276 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -59 | -29.5 | -174.7 | 71.5 | 0 | 0 | 0 | 0 | 113.9 | G246 P254 L261 | G246-V250 WeakPolarHBondContact O-CB 3.38Å; G246-V250 PolarHBondContact O-N 2.84Å; V250-P254 VanDerWaalsContact O-CA 3.27Å; V250-P254 WeakPolarHBondContact O-CA 3.38Å; V250-L261 HydrophobicContact CG2-CD1 4.38Å |
| 251 | K | 93.5 | Very high | 95.3 | Very high | 194 Ų | 194 | 52.2 Ų | 52.2 | 84% | 0.843 | 29% | 0.285 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -74.1 | -39.2 | 177.3 | -68.9 | -175 | 178 | 178.3 | 0 | 112.7 | V249 | V249-K251 PolarHBondContact O-N 3.41Å; V249-K251 VanDerWaalsContact O-N 3.12Å |
| 252 | S | 94 | Very high | 95.4 | Very high | 77 Ų | 77 | 57.2 Ų | 57.2 | 54% | 0.538 | 31% | 0.311 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -84.8 | -40.1 | -178 | 54.8 | 0 | 0 | 0 | 0 | 112.6 | V249 | V249-S252 PolarHBondContact O-N 3.33Å; V249-S252 VanDerWaalsContact O-N 3.09Å; V249-S252 PolarHBondContact O-OG 2.95Å; V249-S252 VanDerWaalsContact O-OG 3.05Å |
| 253 | N | 95.2 | Very high | 95.6 | Very high | 55 Ų | 55 | 57.3 Ų | 57.3 | 29% | 0.294 | 31% | 0.312 | S | S | . | . | trans | -134.3 | 87.9 | 178.5 | -71.9 | -59.3 | 0 | 0 | 0 | 109.3 | V249 V255 I256 G257 | V249-N253 HydrophobicContact CG2-CB 4.12Å; V249-N253 CarbonylContact O-C 3.44Å; V249-N253 PolarHBondContact O-N 3.45Å; N253-V255 VanDerWaalsContact C-N 3.31Å; N253-V255 PolarHBondContact O-N 3.32Å; N253-I256 HydrophobicContact CB-CB 4.17Å; N253-I256 HydrophobicContact CB-CD1 4.02Å; N253-I256 HydrophobicContact CB-CG1 4.2Å; N253-I256 PolarHBondContact O-N 3.42Å; N253-G257 PolarHBondContact O-N 3.49Å | ||
| 254 | P | 95.5 | Very high | 95.6 | Very high | 79 Ų | 79 | 52.3 Ų | 52.3 | 51% | 0.513 | 29% | 0.293 | S | S | . | . | H | α-helix | trans | -55.9 | -40.3 | -174.5 | -28.3 | 35.1 | 0 | 0 | 0 | 114.1 | V250 G257 V258 | V250-P254 VanDerWaalsContact O-CA 3.27Å; V250-P254 WeakPolarHBondContact O-CA 3.38Å; P254-G257 PolarHBondContact O-N 3.03Å; P254-V258 VanDerWaalsContact O-CG2 3.31Å; P254-V258 WeakPolarHBondContact O-CG2 3.28Å; P254-V258 PolarHBondContact O-N 2.95Å |
| 255 | V | 96.7 | Very high | 95.8 | Very high | 108 Ų | 108 | 50.9 Ų | 50.9 | 66% | 0.655 | 29% | 0.29 | S | S | * | . | H | α-helix | trans | -62 | -51.7 | -179.9 | -179.9 | 0 | 0 | 0 | 0 | 111.2 | N253 G257 V258 M259 | N253-V255 VanDerWaalsContact C-N 3.31Å; N253-V255 PolarHBondContact O-N 3.32Å; V255-G257 VanDerWaalsContact C-N 3.29Å; V255-G257 PolarHBondContact O-N 3.22Å; V255-V258 PolarHBondContact O-N 3.05Å; V255-M259 HydrophobicContact CG1-SD 4.26Å; V255-M259 VanDerWaalsContact O-CG 3.31Å; V255-M259 WeakPolarHBondContact O-CG 3.26Å; V255-M259 PolarHBondContact O-N 3.22Å |
| 256 | I | 95.6 | Very high | 96 | Very high | 15 Ų | 15 | 54.3 Ų | 54.3 | 8% | 0.077 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -63.7 | -37.9 | 178.9 | -56.8 | 177.9 | 0 | 0 | 0 | 110.7 | I166 Y167 V249 N253 M259 S260 | I166-I256 HydrophobicContact CG2-CG1 4.27Å; Y167-I256 HydrophobicContact CD2-CG2 3.71Å; Y167-I256 HydrophobicContact CG-CG2 4.31Å; V249-I256 HydrophobicContact CG1-CG2 4.28Å; V249-I256 HydrophobicContact CG2-CG2 4.43Å; N253-I256 HydrophobicContact CB-CB 4.17Å; N253-I256 HydrophobicContact CB-CD1 4.02Å; N253-I256 HydrophobicContact CB-CG1 4.2Å; N253-I256 PolarHBondContact O-N 3.42Å; I256-M259 PolarHBondContact O-N 2.89Å; I256-S260 WeakPolarHBondContact O-CB 3.35Å; I256-S260 PolarHBondContact O-N 3.33Å; I256-S260 PolarHBondContact O-OG 2.87Å |
| 257 | G | 95.9 | Very high | 96.2 | Very high | 0 Ų | 0 | 54.3 Ų | 54.3 | 0% | 0 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -62.1 | -48.6 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.8 | N253 P254 V255 M259 S260 L261 | N253-G257 PolarHBondContact O-N 3.49Å; P254-G257 PolarHBondContact O-N 3.03Å; V255-G257 VanDerWaalsContact C-N 3.29Å; V255-G257 PolarHBondContact O-N 3.22Å; G257-M259 PolarHBondContact O-N 2.77Å; G257-S260 PolarHBondContact O-N 2.68Å; G257-L261 WeakPolarHBondContact O-CB 3.43Å; G257-L261 VanDerWaalsContact O-CG 3.27Å; G257-L261 WeakPolarHBondContact O-CG 3.4Å; G257-L261 PolarHBondContact O-N 3.24Å |
| 258 | V | 97.7 | Very high | 96.3 | Very high | 80 Ų | 80 | 52.3 Ų | 52.3 | 49% | 0.485 | 30% | 0.299 | S | S | . | . | H | α-helix | trans | -60.6 | -45.1 | 176.6 | 170.8 | 0 | 0 | 0 | 0 | 110.9 | P254 V255 S260 L261 L262 | P254-V258 VanDerWaalsContact O-CG2 3.31Å; P254-V258 WeakPolarHBondContact O-CG2 3.28Å; P254-V258 PolarHBondContact O-N 2.95Å; V255-V258 PolarHBondContact O-N 3.05Å; V258-S260 VanDerWaalsContact C-N 3.33Å; V258-S260 PolarHBondContact O-N 3.1Å; V258-L261 PolarHBondContact O-N 3.34Å; V258-L262 HydrophobicContact CG1-CD1 4.34Å; V258-L262 WeakPolarHBondContact O-CG 3.5Å; V258-L262 PolarHBondContact O-N 3.46Å |
| 259 | M | 97 | Very high | 96.6 | Very high | 63 Ų | 63 | 52.8 Ų | 52.8 | 31% | 0.31 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -58.6 | -44.6 | 176.1 | -67.5 | 176.9 | 71.1 | 0 | 0 | 112 | T163 I166 V255 I256 G257 L262 V263 | T163-M259 HydrophobicContact CG2-CB 4.24Å; I166-M259 HydrophobicContact CD1-CE 3.5Å; I166-M259 HydrophobicContact CG2-SD 4.47Å; V255-M259 HydrophobicContact CG1-SD 4.26Å; V255-M259 VanDerWaalsContact O-CG 3.31Å; V255-M259 WeakPolarHBondContact O-CG 3.26Å; V255-M259 PolarHBondContact O-N 3.22Å; I256-M259 PolarHBondContact O-N 2.89Å; G257-M259 PolarHBondContact O-N 2.77Å; M259-L262 PolarHBondContact O-N 3.49Å; M259-V263 PolarHBondContact O-N 3.37Å; M259-V263 VanDerWaalsContact O-N 3.1Å |
| 260 | S | 96.2 | Very high | 96.8 | Very high | 0 Ų | 0 | 53.5 Ų | 53.5 | 0% | 0 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -65.2 | -40.1 | 177.7 | -58.1 | 0 | 0 | 0 | 0 | 112 | I256 G257 V258 V263 A264 | I256-S260 WeakPolarHBondContact O-CB 3.35Å; I256-S260 PolarHBondContact O-N 3.33Å; I256-S260 PolarHBondContact O-OG 2.87Å; G257-S260 PolarHBondContact O-N 2.68Å; V258-S260 VanDerWaalsContact C-N 3.33Å; V258-S260 PolarHBondContact O-N 3.1Å; S260-V263 PolarHBondContact O-N 2.69Å; S260-A264 WeakPolarHBondContact O-CB 3.45Å; S260-A264 PolarHBondContact O-N 3.45Å |
| 261 | L | 97.9 | Very high | 97 | Very high | 38 Ų | 38 | 52 Ų | 52 | 20% | 0.199 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -67.5 | -35.2 | 177.2 | -70.1 | 171.3 | 0 | 0 | 0 | 112.4 | W243 L247 V250 G257 V258 A264 S265 | W243-L261 HydrophobicContact CE3-CD2 3.68Å; W243-L261 HydrophobicContact CZ3-CD2 3.86Å; L247-L261 HydrophobicContact CD2-CD2 4.05Å; L247-L261 HydrophobicContact CG-CD2 4.06Å; V250-L261 HydrophobicContact CG2-CD1 4.38Å; G257-L261 WeakPolarHBondContact O-CB 3.43Å; G257-L261 VanDerWaalsContact O-CG 3.27Å; G257-L261 WeakPolarHBondContact O-CG 3.4Å; G257-L261 PolarHBondContact O-N 3.24Å; V258-L261 PolarHBondContact O-N 3.34Å; L261-A264 PolarHBondContact O-N 3.21Å; L261-S265 WeakPolarHBondContact O-CB 3.45Å; L261-S265 PolarHBondContact O-N 2.84Å |
| 262 | L | 98.1 | Very high | 97.2 | Very high | 104 Ų | 104 | 44.9 Ų | 44.9 | 55% | 0.545 | 28% | 0.28 | S | S | . | . | H | α-helix | trans | -61.6 | -47.5 | 171 | -71.1 | 172.9 | 0 | 0 | 0 | 110.8 | V258 M259 A264 S265 I266 | V258-L262 HydrophobicContact CG1-CD1 4.34Å; V258-L262 WeakPolarHBondContact O-CG 3.5Å; V258-L262 PolarHBondContact O-N 3.46Å; M259-L262 PolarHBondContact O-N 3.49Å; L262-A264 PolarHBondContact O-N 3Å; L262-S265 PolarHBondContact O-N 3.24Å; L262-S265 PolarHBondContact O-OG 3.49Å; L262-I266 WeakPolarHBondContact O-CG1 3.06Å; L262-I266 PolarHBondContact O-N 2.95Å |
| 263 | V | 98 | Very high | 97.4 | Very high | 3 Ų | 3 | 44.7 Ų | 44.7 | 2% | 0.018 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -58.9 | -45.3 | 174.6 | 171.6 | 0 | 0 | 0 | 0 | 111.6 | L156 V159 N160 T163 C241 M259 S260 S265 I266 F267 | L156-V263 HydrophobicContact CD1-CG1 4.22Å; V159-V263 HydrophobicContact CG1-CG2 3.82Å; N160-V263 HydrophobicContact CB-CG1 4.06Å; T163-V263 HydrophobicContact CG2-CG2 4.29Å; T163-V263 WeakPolarHBondContact OG1-CG2 3.3Å; C241-V263 HydrophobicContact CB-CB 4.42Å; C241-V263 HydrophobicContact CB-CG1 4.13Å; M259-V263 PolarHBondContact O-N 3.37Å; M259-V263 VanDerWaalsContact O-N 3.1Å; S260-V263 PolarHBondContact O-N 2.69Å; V263-S265 VanDerWaalsContact C-N 3.32Å; V263-S265 PolarHBondContact O-N 2.92Å; V263-I266 PolarHBondContact O-N 3.3Å; V263-F267 HydrophobicContact CG1-CD2 3.62Å; V263-F267 HydrophobicContact CG1-CE2 3.53Å; V263-F267 WeakPolarHBondContact O-CD2 3.49Å; V263-F267 PolarHBondContact O-N 3.42Å |
| 264 | A | 98.1 | Very high | 97.6 | Very high | 0 Ų | 0 | 42.2 Ų | 42.2 | 0% | 0 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -58.7 | -41.4 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.8 | C241 G242 W243 S260 L261 L262 F267 T268 | C241-A264 PolarHBondContact O-N 3.13Å; G242-A264 VanDerWaalsContact C-CB 3.47Å; W243-A264 HydrophobicContact CD2-CB 4.03Å; W243-A264 HydrophobicContact CG-CB 4.04Å; S260-A264 WeakPolarHBondContact O-CB 3.45Å; S260-A264 PolarHBondContact O-N 3.45Å; L261-A264 PolarHBondContact O-N 3.21Å; L262-A264 PolarHBondContact O-N 3Å; A264-F267 PolarHBondContact O-N 3.46Å; A264-T268 WeakPolarHBondContact O-CB 3.26Å; A264-T268 PolarHBondContact O-N 2.79Å; A264-T268 PolarHBondContact O-OG1 2.93Å |
| 265 | S | 98.2 | Very high | 97.7 | Very high | 48 Ų | 48 | 40.2 Ų | 40.2 | 34% | 0.336 | 25% | 0.249 | S | C | . | . | H | α-helix | trans | -64.3 | -41.2 | 176.7 | 76 | 0 | 0 | 0 | 0 | 112.2 | L261 L262 V263 T268 A269 | L261-S265 WeakPolarHBondContact O-CB 3.45Å; L261-S265 PolarHBondContact O-N 2.84Å; L262-S265 PolarHBondContact O-N 3.24Å; L262-S265 PolarHBondContact O-OG 3.49Å; V263-S265 VanDerWaalsContact C-N 3.32Å; V263-S265 PolarHBondContact O-N 2.92Å; S265-T268 PolarHBondContact O-N 3.31Å; S265-A269 WeakPolarHBondContact O-CB 3.41Å; S265-A269 PolarHBondContact O-N 3.34Å |
| 266 | I | 98.2 | Very high | 97.8 | Very high | 76 Ų | 76 | 41.3 Ų | 41.3 | 39% | 0.39 | 24% | 0.241 | S | C | . | . | H | α-helix | trans | -69.5 | -41.6 | 178.4 | -59.3 | 166.1 | 0 | 0 | 0 | 109.9 | L156 L262 V263 T268 A269 I270 | L156-I266 HydrophobicContact CD1-CB 3.89Å; L156-I266 HydrophobicContact CD1-CG2 3.72Å; L156-I266 HydrophobicContact CD2-CG2 4.13Å; L156-I266 HydrophobicContact CG-CG2 4.39Å; L262-I266 WeakPolarHBondContact O-CG1 3.06Å; L262-I266 PolarHBondContact O-N 2.95Å; V263-I266 PolarHBondContact O-N 3.3Å; I266-T268 VanDerWaalsContact C-N 3.3Å; I266-T268 PolarHBondContact O-N 2.83Å; I266-A269 PolarHBondContact O-N 2.95Å; I266-I270 HydrophobicContact CG2-CD1 3.83Å; I266-I270 HydrophobicContact CG2-CG1 4.12Å; I266-I270 WeakPolarHBondContact O-CB 3.42Å; I266-I270 VanDerWaalsContact O-CG1 3.32Å; I266-I270 WeakPolarHBondContact O-CG1 3.35Å; I266-I270 PolarHBondContact O-N 3.36Å |
| 267 | F | 97.9 | Very high | 97.9 | Very high | 0 Ų | 0 | 40.6 Ų | 40.6 | 0% | 0 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -53.4 | -48.2 | 170.4 | -92.6 | -63 | 0 | 0 | 0 | 111.6 | L156 L157 N160 Q231 S232 V263 A264 I270 T271 | L156-F267 HydrophobicContact CD1-CD2 4.26Å; L156-F267 HydrophobicContact CD1-CE2 4.3Å; L156-F267 HydrophobicContact CD2-CB 4.12Å; L156-F267 HydrophobicContact CD2-CD1 3.34Å; L156-F267 HydrophobicContact CD2-CD2 4.1Å; L156-F267 HydrophobicContact CD2-CE1 3.61Å; L156-F267 HydrophobicContact CD2-CE2 4.36Å; L156-F267 HydrophobicContact CD2-CG 3.58Å; L156-F267 HydrophobicContact CD2-CZ 4.13Å; L156-F267 HydrophobicContact CG-CD1 4.13Å; L156-F267 HydrophobicContact CG-CD2 4.33Å; L156-F267 HydrophobicContact CG-CE1 3.96Å; L156-F267 HydrophobicContact CG-CE2 4.2Å; L156-F267 HydrophobicContact CG-CG 4.28Å; L156-F267 HydrophobicContact CG-CZ 4Å; L157-F267 HydrophobicContact CD2-CE1 4.12Å; L157-F267 HydrophobicContact CD2-CZ 3.99Å; N160-F267 HydrophobicContact CB-CE2 3.96Å; N160-F267 HydrophobicContact CB-CZ 4.1Å; Q231-F267 HydrophobicContact CB-CD1 3.89Å; Q231-F267 HydrophobicContact CB-CE1 3.77Å; Q231-F267 HydrophobicContact CB-CZ 4.26Å; Q231-F267 HydrophobicContact CG-CE1 4.38Å; Q231-F267 VanDerWaalsContact OE1-CE1 3.26Å; S232-F267 VanDerWaalsContact OG-C 3.29Å; S232-F267 PolarHBondContact OG-O 2.99Å; V263-F267 HydrophobicContact CG1-CD2 3.62Å; V263-F267 HydrophobicContact CG1-CE2 3.53Å; V263-F267 WeakPolarHBondContact O-CD2 3.49Å; V263-F267 PolarHBondContact O-N 3.42Å; A264-F267 PolarHBondContact O-N 3.46Å; F267-I270 PolarHBondContact O-N 2.78Å; F267-T271 VanDerWaalsContact O-CB 3.26Å; F267-T271 WeakPolarHBondContact O-CB 3.22Å; F267-T271 PolarHBondContact O-N 3.33Å; F267-T271 PolarHBondContact O-OG1 3.21Å |
| 268 | T | 98.3 | Very high | 98 | Very high | 60 Ų | 60 | 42.4 Ų | 42.4 | 37% | 0.368 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -63.1 | -45.6 | -179.6 | -53.9 | 0 | 0 | 0 | 0 | 111.3 | S232 W243 A264 S265 I266 T271 G272 | S232-T268 PolarHBondContact OG-N 2.99Å; W243-T268 PolarHBondContact NE1-OG1 3.23Å; A264-T268 WeakPolarHBondContact O-CB 3.26Å; A264-T268 PolarHBondContact O-N 2.79Å; A264-T268 PolarHBondContact O-OG1 2.93Å; S265-T268 PolarHBondContact O-N 3.31Å; I266-T268 VanDerWaalsContact C-N 3.3Å; I266-T268 PolarHBondContact O-N 2.83Å; T268-T271 PolarHBondContact O-N 3.22Å; T268-G272 PolarHBondContact O-N 2.97Å |
| 269 | A | 98.4 | Very high | 98 | Very high | 65 Ų | 65 | 43.3 Ų | 43.3 | 54% | 0.537 | 25% | 0.249 | S | C | . | . | H | α-helix | trans | -63.1 | -47.4 | 179.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | S265 I266 T271 G272 L273 | S265-A269 WeakPolarHBondContact O-CB 3.41Å; S265-A269 PolarHBondContact O-N 3.34Å; I266-A269 PolarHBondContact O-N 2.95Å; A269-T271 VanDerWaalsContact C-N 3.31Å; A269-T271 PolarHBondContact O-N 3.42Å; A269-G272 PolarHBondContact O-N 3.28Å; A269-L273 WeakPolarHBondContact O-CB 3.46Å; A269-L273 PolarHBondContact O-N 2.93Å |
| 270 | I | 98.1 | Very high | 98 | Very high | 17 Ų | 17 | 43.4 Ų | 43.4 | 9% | 0.087 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -66.9 | -35.2 | 178.2 | -61.5 | -173.6 | 0 | 0 | 0 | 110.5 | L149 L156 M228 I266 F267 L273 S274 | L149-I270 HydrophobicContact CD1-CG2 4.07Å; L156-I270 HydrophobicContact CB-CD1 4.15Å; L156-I270 HydrophobicContact CD2-CD1 3.88Å; M228-I270 HydrophobicContact CE-CB 4.26Å; M228-I270 HydrophobicContact CE-CG2 3.57Å; I266-I270 HydrophobicContact CG2-CD1 3.83Å; I266-I270 HydrophobicContact CG2-CG1 4.12Å; I266-I270 WeakPolarHBondContact O-CB 3.42Å; I266-I270 VanDerWaalsContact O-CG1 3.32Å; I266-I270 WeakPolarHBondContact O-CG1 3.35Å; I266-I270 PolarHBondContact O-N 3.36Å; F267-I270 PolarHBondContact O-N 2.78Å; I270-L273 PolarHBondContact O-N 3.38Å; I270-S274 VanDerWaalsContact O-CB 3.28Å; I270-S274 WeakPolarHBondContact O-CB 3.5Å; I270-S274 PolarHBondContact O-N 2.9Å; I270-S274 PolarHBondContact O-OG 3.34Å |
| 271 | T | 98.4 | Very high | 97.9 | Very high | 11 Ų | 11 | 43.4 Ų | 43.4 | 7% | 0.067 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -61.9 | -48.1 | 173.7 | -59.6 | 0 | 0 | 0 | 0 | 111.5 | M228 I229 S232 F267 T268 A269 L273 S274 A275 | M228-T271 HydrophobicContact CB-CG2 4.2Å; M228-T271 WeakPolarHBondContact CB-OG1 3.38Å; M228-T271 PolarHBondContact O-OG1 3.48Å; I229-T271 HydrophobicContact CB-CG2 4.47Å; I229-T271 HydrophobicContact CG1-CG2 3.51Å; S232-T271 PolarHBondContact OG-OG1 2.87Å; S232-T271 VanDerWaalsContact OG-OG1 3.1Å; F267-T271 VanDerWaalsContact O-CB 3.26Å; F267-T271 WeakPolarHBondContact O-CB 3.22Å; F267-T271 PolarHBondContact O-N 3.33Å; F267-T271 PolarHBondContact O-OG1 3.21Å; T268-T271 PolarHBondContact O-N 3.22Å; A269-T271 VanDerWaalsContact C-N 3.31Å; A269-T271 PolarHBondContact O-N 3.42Å; T271-L273 PolarHBondContact O-N 2.92Å; T271-S274 PolarHBondContact O-N 2.9Å; T271-A275 PolarHBondContact O-N 3.46Å |
| 272 | G | 98.4 | Very high | 97.8 | Very high | 44 Ų | 44 | 44.6 Ų | 44.6 | 45% | 0.454 | 25% | 0.252 | S | S | . | . | H | α-helix | trans | -60.8 | -43.5 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | T268 A269 S274 A275 W276 | T268-G272 PolarHBondContact O-N 2.97Å; A269-G272 PolarHBondContact O-N 3.28Å; G272-S274 VanDerWaalsContact C-N 3.3Å; G272-S274 PolarHBondContact O-N 3.29Å; G272-A275 PolarHBondContact O-N 3.22Å; G272-W276 WeakPolarHBondContact O-CB 3.44Å; G272-W276 PolarHBondContact O-N 3.5Å |
| 273 | L | 98.3 | Very high | 97.5 | Very high | 73 Ų | 73 | 48.3 Ų | 48.3 | 38% | 0.382 | 26% | 0.259 | S | S | . | . | H | α-helix | trans | -63.4 | -36.4 | 176 | -165.3 | 61.7 | 0 | 0 | 0 | 112.2 | F145 L149 A269 I270 T271 W276 Y277 | F145-L273 HydrophobicContact CE1-CG 4.33Å; F145-L273 HydrophobicContact CE2-CD2 4.5Å; F145-L273 HydrophobicContact CZ-CD1 3.73Å; F145-L273 HydrophobicContact CZ-CD2 3.81Å; F145-L273 HydrophobicContact CZ-CG 3.72Å; L149-L273 HydrophobicContact CD1-CB 4.21Å; L149-L273 HydrophobicContact CD1-CD2 3.76Å; L149-L273 HydrophobicContact CD1-CG 3.97Å; A269-L273 WeakPolarHBondContact O-CB 3.46Å; A269-L273 PolarHBondContact O-N 2.93Å; I270-L273 PolarHBondContact O-N 3.38Å; T271-L273 PolarHBondContact O-N 2.92Å; L273-W276 HydrophobicContact CD1-CE3 4.15Å; L273-Y277 VanDerWaalsContact O-CB 3.26Å; L273-Y277 WeakPolarHBondContact O-CB 3.29Å; L273-Y277 PolarHBondContact O-N 3.28Å |
| 274 | S | 98.4 | Very high | 97.2 | Very high | 2 Ų | 2 | 49.3 Ų | 49.3 | 1% | 0.014 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -70.6 | -41.9 | 177.3 | -59 | 0 | 0 | 0 | 0 | 112.2 | F221 I270 T271 G272 Y277 L278 | F221-S274 WeakPolarHBondContact CE1-O 3.49Å; I270-S274 VanDerWaalsContact O-CB 3.28Å; I270-S274 WeakPolarHBondContact O-CB 3.5Å; I270-S274 PolarHBondContact O-N 2.9Å; I270-S274 PolarHBondContact O-OG 3.34Å; T271-S274 PolarHBondContact O-N 2.9Å; G272-S274 VanDerWaalsContact C-N 3.3Å; G272-S274 PolarHBondContact O-N 3.29Å; S274-Y277 PolarHBondContact O-N 2.79Å; S274-L278 WeakPolarHBondContact O-CB 3.49Å; S274-L278 PolarHBondContact O-N 2.93Å |
| 275 | A | 98.4 | Very high | 96.8 | Very high | 37 Ų | 37 | 49.9 Ų | 49.9 | 31% | 0.306 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -62.2 | -45.2 | 173.7 | 0 | 0 | 0 | 0 | 0 | 111.4 | V225 T271 G272 Y277 L278 I279 | V225-A275 HydrophobicContact CG1-CB 4.17Å; T271-A275 PolarHBondContact O-N 3.46Å; G272-A275 PolarHBondContact O-N 3.22Å; A275-Y277 VanDerWaalsContact C-N 3.34Å; A275-Y277 PolarHBondContact O-N 3.5Å; A275-L278 PolarHBondContact O-N 2.93Å; A275-I279 WeakPolarHBondContact O-CG1 3.43Å; A275-I279 PolarHBondContact O-N 3.18Å; A275-I279 VanDerWaalsContact O-N 3.15Å |
| 276 | W | 98.3 | Very high | 96.3 | Very high | 131 Ų | 131 | 56 Ų | 56 | 50% | 0.496 | 28% | 0.282 | S | S | . | . | H | α-helix | trans | -59 | -45 | 173 | 171.5 | 85.8 | 0 | 0 | 0 | 111.8 | F145 G272 L273 L278 I279 H280 | F145-W276 HydrophobicContact CD1-CZ3 4.45Å; F145-W276 HydrophobicContact CE1-CE3 4.32Å; F145-W276 AromaticContact CE1-CZ3 3.77Å; F145-W276 HydrophobicContact CE1-CZ3 3.77Å; F145-W276 HydrophobicContact CE2-CZ3 4.47Å; F145-W276 HydrophobicContact CZ-CE3 4.34Å; F145-W276 AromaticContact CZ-CZ3 3.77Å; F145-W276 HydrophobicContact CZ-CZ3 3.77Å; G272-W276 WeakPolarHBondContact O-CB 3.44Å; G272-W276 PolarHBondContact O-N 3.5Å; L273-W276 HydrophobicContact CD1-CE3 4.15Å; W276-L278 PolarHBondContact O-N 3Å; W276-I279 PolarHBondContact O-N 3.46Å; W276-H280 HydrophobicContact CZ2-CB 4.38Å; W276-H280 WeakPolarHBondContact O-CB 3.41Å; W276-H280 PolarHBondContact O-N 3.49Å |
| 277 | Y | 98.4 | Very high | 95.6 | Very high | 1 Ų | 1 | 57 Ų | 57 | 0% | 0.004 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -62.9 | -41.8 | -180 | -176.4 | -111.6 | 0 | 0 | 0 | 112.3 | V142 F145 G146 L149 L202 F217 F221 L273 S274 A275 I279 H280 V281 | V142-Y277 HydrophobicContact CG1-CE2 4.01Å; V142-Y277 PolarHBondContact O-OH 2.95Å; F145-Y277 AromaticContact CD1-CD2 3.34Å; F145-Y277 HydrophobicContact CD1-CD2 3.34Å; F145-Y277 AromaticContact CD1-CE2 3.51Å; F145-Y277 HydrophobicContact CD1-CE2 3.51Å; F145-Y277 HydrophobicContact CD1-CG 4.12Å; F145-Y277 AromaticContact CE1-CD2 3.57Å; F145-Y277 HydrophobicContact CE1-CD2 3.57Å; F145-Y277 HydrophobicContact CE1-CE2 4.22Å; F145-Y277 HydrophobicContact CE1-CG 4.03Å; F145-Y277 HydrophobicContact CG-CE2 4.44Å; G146-Y277 WeakPolarHBondContact CA-OH 3.32Å; L149-Y277 HydrophobicContact CD2-CD1 3.91Å; L149-Y277 HydrophobicContact CD2-CG 4.04Å; L202-Y277 HydrophobicContact CD2-CE1 3.96Å; L202-Y277 WeakPolarHBondContact CD2-OH 3.33Å; F217-Y277 HydrophobicContact CZ-CD1 4.45Å; F217-Y277 HydrophobicContact CZ-CE1 4.14Å; F221-Y277 AromaticContact CE1-CD1 3.76Å; F221-Y277 HydrophobicContact CE1-CD1 3.76Å; F221-Y277 HydrophobicContact CZ-CD1 4.04Å; L273-Y277 VanDerWaalsContact O-CB 3.26Å; L273-Y277 WeakPolarHBondContact O-CB 3.29Å; L273-Y277 PolarHBondContact O-N 3.28Å; S274-Y277 PolarHBondContact O-N 2.79Å; A275-Y277 VanDerWaalsContact C-N 3.34Å; A275-Y277 PolarHBondContact O-N 3.5Å; Y277-I279 VanDerWaalsContact C-N 3.34Å; Y277-I279 PolarHBondContact O-N 3.38Å; Y277-H280 PolarHBondContact O-N 3.44Å; Y277-V281 HydrophobicContact CD1-CG2 4.24Å; Y277-V281 HydrophobicContact CD2-CG2 4.19Å; Y277-V281 HydrophobicContact CE1-CG2 3.79Å; Y277-V281 HydrophobicContact CE2-CG2 3.75Å; Y277-V281 HydrophobicContact CG-CG2 4.43Å; Y277-V281 WeakPolarHBondContact O-CG2 3.4Å; Y277-V281 PolarHBondContact O-N 3.41Å |
| 278 | L | 98.1 | Very high | 94.7 | Very high | 38 Ų | 38 | 59.4 Ų | 59.4 | 20% | 0.199 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -56.7 | -49.2 | 174.5 | -173.1 | 156.3 | 0 | 0 | 0 | 110.7 | F221 V225 S274 A275 W276 H280 H282 | F221-L278 HydrophobicContact CD1-CB 3.79Å; F221-L278 HydrophobicContact CD1-CD1 3.9Å; F221-L278 HydrophobicContact CD1-CG 4.06Å; F221-L278 HydrophobicContact CE1-CB 3.88Å; V225-L278 HydrophobicContact CG2-CD1 4.37Å; S274-L278 WeakPolarHBondContact O-CB 3.49Å; S274-L278 PolarHBondContact O-N 2.93Å; A275-L278 PolarHBondContact O-N 2.93Å; W276-L278 PolarHBondContact O-N 3Å; L278-H280 VanDerWaalsContact C-N 3.33Å; L278-H280 PolarHBondContact O-N 2.89Å; L278-H282 VanDerWaalsContact O-CB 3.26Å; L278-H282 WeakPolarHBondContact O-CB 3.41Å; L278-H282 PolarHBondContact O-N 3.43Å |
| 279 | I | 97.2 | Very high | 93.2 | Very high | 99 Ų | 99 | 59.5 Ų | 59.5 | 51% | 0.508 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -62.7 | -42.2 | 177.7 | -65.1 | 165.5 | 0 | 0 | 0 | 110.6 | A275 W276 Y277 H282 R283 | A275-I279 WeakPolarHBondContact O-CG1 3.43Å; A275-I279 PolarHBondContact O-N 3.18Å; A275-I279 VanDerWaalsContact O-N 3.15Å; W276-I279 PolarHBondContact O-N 3.46Å; Y277-I279 VanDerWaalsContact C-N 3.34Å; Y277-I279 PolarHBondContact O-N 3.38Å; I279-H282 PolarHBondContact O-N 3.34Å; I279-R283 HydrophobicContact CG2-CG 4.5Å; I279-R283 WeakPolarHBondContact O-CG 3.49Å; I279-R283 PolarHBondContact O-N 3.33Å |
| 280 | H | 96 | Very high | 91.6 | Very high | 64 Ų | 64 | 56.9 Ų | 56.9 | 30% | 0.296 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -62.5 | -49.6 | -179.9 | -179.9 | 65 | 0 | 0 | 0 | 112.3 | W276 Y277 L278 H282 R283 I284 | W276-H280 HydrophobicContact CZ2-CB 4.38Å; W276-H280 WeakPolarHBondContact O-CB 3.41Å; W276-H280 PolarHBondContact O-N 3.49Å; Y277-H280 PolarHBondContact O-N 3.44Å; L278-H280 VanDerWaalsContact C-N 3.33Å; L278-H280 PolarHBondContact O-N 2.89Å; H280-H282 VanDerWaalsContact C-N 3.3Å; H280-H282 PolarHBondContact O-N 2.89Å; H280-R283 WeakPolarHBondContact O-CB 3.29Å; H280-R283 PolarHBondContact O-N 3.29Å; H280-I284 WeakPolarHBondContact O-CG1 3.42Å; H280-I284 PolarHBondContact O-N 3.3Å |
| 281 | V | 95.6 | Very high | 89.7 | Confident | 0 Ų | 0 | 59 Ų | 59 | 0% | 0 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -62.9 | -39.6 | 176.5 | 176.1 | 0 | 0 | 0 | 0 | 110.9 | V142 L202 F206 F214 F217 F218 Y277 R283 I284 Y285 | V142-V281 HydrophobicContact CG1-CG2 3.95Å; L202-V281 HydrophobicContact CD1-CG1 3.98Å; L202-V281 HydrophobicContact CD1-CG2 4.34Å; F206-V281 HydrophobicContact CE2-CG1 3.96Å; F206-V281 HydrophobicContact CZ-CG1 3.99Å; F214-V281 HydrophobicContact CD1-CG1 4.35Å; F214-V281 HydrophobicContact CE1-CG1 4.15Å; F217-V281 HydrophobicContact CD1-CG1 4.08Å; F217-V281 HydrophobicContact CE1-CB 3.87Å; F217-V281 HydrophobicContact CE1-CG1 3.53Å; F217-V281 HydrophobicContact CE1-CG2 4.3Å; F217-V281 HydrophobicContact CZ-CB 4.41Å; F217-V281 HydrophobicContact CZ-CG1 4.36Å; F217-V281 HydrophobicContact CZ-CG2 4.39Å; F218-V281 HydrophobicContact CE1-CB 4.28Å; F218-V281 HydrophobicContact CE1-CG1 3.87Å; F218-V281 HydrophobicContact CZ-CG1 4.16Å; Y277-V281 HydrophobicContact CD1-CG2 4.24Å; Y277-V281 HydrophobicContact CD2-CG2 4.19Å; Y277-V281 HydrophobicContact CE1-CG2 3.79Å; Y277-V281 HydrophobicContact CE2-CG2 3.75Å; Y277-V281 HydrophobicContact CG-CG2 4.43Å; Y277-V281 WeakPolarHBondContact O-CG2 3.4Å; Y277-V281 PolarHBondContact O-N 3.41Å; V281-R283 VanDerWaalsContact C-N 3.32Å; V281-R283 PolarHBondContact O-N 2.8Å; V281-I284 WeakPolarHBondContact O-CB 3.41Å; V281-I284 PolarHBondContact O-N 2.86Å; V281-Y285 PolarHBondContact O-N 2.88Å |
| 282 | H | 94.1 | Very high | 87.7 | Confident | 63 Ų | 63 | 64.9 Ų | 64.9 | 29% | 0.292 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -63.7 | -36.6 | 176.3 | 178.7 | -103.7 | 0 | 0 | 0 | 112.8 | F218 L278 I279 H280 Y285 R286 | F218-H282 HydrophobicContact CD1-CB 4.29Å; F218-H282 HydrophobicContact CE1-CB 3.65Å; F218-H282 HydrophobicContact CZ-CB 3.99Å; L278-H282 VanDerWaalsContact O-CB 3.26Å; L278-H282 WeakPolarHBondContact O-CB 3.41Å; L278-H282 PolarHBondContact O-N 3.43Å; I279-H282 PolarHBondContact O-N 3.34Å; H280-H282 VanDerWaalsContact C-N 3.3Å; H280-H282 PolarHBondContact O-N 2.89Å; H282-Y285 PolarHBondContact O-N 2.94Å; H282-R286 PolarHBondContact CE1-NH1 3.19Å; H282-R286 PolarHBondContact NE2-NH1 3.3Å; H282-R286 PolarHBondContact O-N 3.07Å |
| 283 | R | 92.6 | Very high | 86.2 | Confident | 183 Ų | 183 | 64.7 Ų | 64.7 | 69% | 0.691 | 34% | 0.341 | S | S | * | . | H | α-helix | trans | -64.9 | -42.2 | 172.4 | -73.3 | 176.4 | 70.2 | 172.7 | 3.6 | 112 | I279 H280 V281 R286 S287 | I279-R283 HydrophobicContact CG2-CG 4.5Å; I279-R283 WeakPolarHBondContact O-CG 3.49Å; I279-R283 PolarHBondContact O-N 3.33Å; H280-R283 WeakPolarHBondContact O-CB 3.29Å; H280-R283 PolarHBondContact O-N 3.29Å; V281-R283 VanDerWaalsContact C-N 3.32Å; V281-R283 PolarHBondContact O-N 2.8Å; R283-R286 PolarHBondContact O-N 2.8Å; R283-S287 PolarHBondContact O-N 2.82Å; R283-S287 PolarHBondContact O-OG 3.35Å |
| 284 | I | 91.6 | Very high | 84.9 | Confident | 24 Ų | 24 | 64.4 Ų | 64.4 | 12% | 0.123 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -59.2 | -50.2 | 174.5 | -66.1 | 164.2 | 0 | 0 | 0 | 109.8 | Y139 V142 F206 H280 V281 R286 S287 T288 | Y139-I284 HydrophobicContact CD1-CG2 4.22Å; Y139-I284 HydrophobicContact CE1-CG2 3.71Å; V142-I284 HydrophobicContact CB-CD1 4.43Å; V142-I284 HydrophobicContact CG1-CD1 3.96Å; V142-I284 HydrophobicContact CG2-CD1 3.67Å; F206-I284 HydrophobicContact CE1-CG2 4.01Å; F206-I284 HydrophobicContact CZ-CG2 4.34Å; H280-I284 WeakPolarHBondContact O-CG1 3.42Å; H280-I284 PolarHBondContact O-N 3.3Å; V281-I284 WeakPolarHBondContact O-CB 3.41Å; V281-I284 PolarHBondContact O-N 2.86Å; I284-R286 VanDerWaalsContact C-N 3.3Å; I284-R286 PolarHBondContact O-N 2.89Å; I284-S287 WeakPolarHBondContact CA-OG 3.31Å; I284-S287 PolarHBondContact O-N 3.26Å; I284-S287 PolarHBondContact O-OG 3.49Å; I284-T288 WeakPolarHBondContact O-CG2 3.44Å; I284-T288 PolarHBondContact O-N 2.64Å |
| 285 | Y | 89.9 | Confident | 83.5 | Confident | 12 Ų | 12 | 64.7 Ų | 64.7 | 5% | 0.047 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -56.3 | -41.1 | 177.4 | 173.8 | -102.6 | 0 | 0 | 0 | 113 | F214 F215 F218 V281 H282 T288 A290 | F214-Y285 HydrophobicContact CB-CD2 3.75Å; F214-Y285 HydrophobicContact CB-CE2 3.87Å; F214-Y285 HydrophobicContact CB-CG 4.46Å; F214-Y285 HydrophobicContact CD1-CD2 4.16Å; F214-Y285 AromaticContact CD2-CD2 3.62Å; F214-Y285 HydrophobicContact CD2-CD2 3.62Å; F214-Y285 AromaticContact CD2-CE2 3.99Å; F214-Y285 HydrophobicContact CD2-CE2 3.99Å; F214-Y285 HydrophobicContact CE2-CD2 4.25Å; F214-Y285 AromaticContact CG-CD2 3.57Å; F214-Y285 HydrophobicContact CG-CD2 3.57Å; F214-Y285 HydrophobicContact CG-CE2 4.08Å; F214-Y285 HydrophobicContact CG-CG 4.37Å; F215-Y285 VanDerWaalsContact CE2-OH 3.27Å; F215-Y285 WeakPolarHBondContact CE2-OH 3.42Å; F215-Y285 HydrophobicContact CZ-CE1 4.45Å; F215-Y285 VanDerWaalsContact CZ-OH 3.27Å; F215-Y285 WeakPolarHBondContact CZ-OH 3.37Å; F218-Y285 AromaticContact CE2-CD1 3.77Å; F218-Y285 HydrophobicContact CE2-CD1 3.77Å; F218-Y285 HydrophobicContact CE2-CD2 4.41Å; F218-Y285 HydrophobicContact CE2-CE1 4.35Å; F218-Y285 AromaticContact CE2-CG 3.81Å; F218-Y285 HydrophobicContact CE2-CG 3.81Å; F218-Y285 HydrophobicContact CZ-CD1 4.27Å; F218-Y285 HydrophobicContact CZ-CG 4.04Å; V281-Y285 PolarHBondContact O-N 2.88Å; H282-Y285 PolarHBondContact O-N 2.94Å; Y285-T288 PolarHBondContact O-OG1 3.12Å; Y285-A290 HydrophobicContact CD2-CB 3.83Å; Y285-A290 HydrophobicContact CE2-CB 3.37Å; Y285-A290 PolarHBondContact OH-O 3.46Å |
| 286 | R | 87.6 | Confident | 82.3 | Confident | 176 Ų | 176 | 69.2 Ų | 69.2 | 66% | 0.664 | 35% | 0.352 | S | S | * | . | H | α-helix | trans | -68.8 | -33.6 | 175.1 | -101.6 | -171.7 | 159.8 | 84 | -5.9 | 113.6 | H282 R283 I284 T288 | H282-R286 PolarHBondContact CE1-NH1 3.19Å; H282-R286 PolarHBondContact NE2-NH1 3.3Å; H282-R286 PolarHBondContact O-N 3.07Å; R283-R286 PolarHBondContact O-N 2.8Å; I284-R286 VanDerWaalsContact C-N 3.3Å; I284-R286 PolarHBondContact O-N 2.89Å; R286-T288 VanDerWaalsContact C-N 3.33Å |
| 287 | S | 84.4 | Confident | 81.4 | Confident | 96 Ų | 96 | 68.7 Ų | 68.7 | 67% | 0.671 | 36% | 0.355 | S | S | * | . | H | α-helix | trans | -72.6 | -24 | -179.8 | 68.6 | 0 | 0 | 0 | 0 | 113.8 | R283 I284 G289 | R283-S287 PolarHBondContact O-N 2.82Å; R283-S287 PolarHBondContact O-OG 3.35Å; I284-S287 WeakPolarHBondContact CA-OG 3.31Å; I284-S287 PolarHBondContact O-N 3.26Å; I284-S287 PolarHBondContact O-OG 3.49Å; S287-G289 VanDerWaalsContact C-N 3.25Å; S287-G289 PolarHBondContact O-N 3.2Å |
| 288 | T | 77.7 | Confident | 80.4 | Confident | 52 Ų | 52 | 70.6 Ų | 70.6 | 32% | 0.319 | 36% | 0.364 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -82.6 | 2.1 | -179.6 | 57.1 | 0 | 0 | 0 | 0 | 113.7 | Y139 I284 Y285 R286 A290 | Y139-T288 WeakPolarHBondContact OH-CG2 3.27Å; I284-T288 WeakPolarHBondContact O-CG2 3.44Å; I284-T288 PolarHBondContact O-N 2.64Å; Y285-T288 PolarHBondContact O-OG1 3.12Å; R286-T288 VanDerWaalsContact C-N 3.33Å; T288-A290 PolarHBondContact O-N 3.08Å |
| 289 | G | 67.4 | Low | 79.3 | Confident | 61 Ų | 61 | 75 Ų | 75 | 63% | 0.629 | 38% | 0.382 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 69.3 | 5.9 | -176.7 | 0 | 0 | 0 | 0 | 0 | 114.3 | S287 S291 | S287-G289 VanDerWaalsContact C-N 3.25Å; S287-G289 PolarHBondContact O-N 3.2Å; G289-S291 PolarHBondContact O-N 2.95Å |
| 290 | A | 63.8 | Low | 78.3 | Confident | 11 Ų | 11 | 72.6 Ų | 72.6 | 9% | 0.091 | 38% | 0.377 | C | S | . | . | trans | -65.3 | 121.7 | 174.5 | 0 | 0 | 0 | 0 | 0 | 109.5 | Y285 T288 | Y285-A290 HydrophobicContact CD2-CB 3.83Å; Y285-A290 HydrophobicContact CE2-CB 3.37Å; Y285-A290 PolarHBondContact OH-O 3.46Å; T288-A290 PolarHBondContact O-N 3.08Å | ||
| 291 | S | 59 | Low | 77.3 | Confident | 62 Ų | 62 | 74.1 Ų | 74.1 | 43% | 0.434 | 39% | 0.387 | S | S | . | . | trans | -123 | 167.9 | -175.5 | 75.7 | 0 | 0 | 0 | 0 | 111.5 | G289 G293 K294 A295 | G289-S291 PolarHBondContact O-N 2.95Å; S291-G293 PolarHBondContact O-N 3.44Å; S291-G293 VanDerWaalsContact O-N 3.13Å; S291-G293 PolarHBondContact OG-N 2.89Å; S291-K294 PolarHBondContact O-N 3.42Å; S291-A295 PolarHBondContact O-N 3.16Å | ||
| 292 | F | 57.5 | Low | 76 | Confident | 133 Ų | 133 | 75.9 Ų | 75.9 | 58% | 0.583 | 41% | 0.405 | S | S | * | . | H | α-helix | trans | -54.7 | -28.1 | 171.2 | -170.5 | -110.8 | 0 | 0 | 0 | 112.4 | F215 A295 K296 | F215-F292 HydrophobicContact CE2-CD2 4.39Å; F215-F292 HydrophobicContact CZ-CB 4.41Å; F215-F292 HydrophobicContact CZ-CD2 4.03Å; F292-A295 PolarHBondContact O-N 3.33Å; F292-K296 HydrophobicContact CD1-CD 4.21Å; F292-K296 HydrophobicContact CE1-CD 4.02Å; F292-K296 HydrophobicContact CE1-CG 4.36Å; F292-K296 PolarHBondContact O-N 2.95Å |
| 293 | G | 65.1 | Low | 75 | Confident | 40 Ų | 40 | 75.5 Ų | 75.5 | 41% | 0.412 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -63.2 | -49.2 | 173.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | S291 A295 K296 E297 | S291-G293 PolarHBondContact O-N 3.44Å; S291-G293 VanDerWaalsContact O-N 3.13Å; S291-G293 PolarHBondContact OG-N 2.89Å; G293-A295 VanDerWaalsContact C-N 3.28Å; G293-A295 PolarHBondContact O-N 2.88Å; G293-K296 WeakPolarHBondContact O-CB 3.34Å; G293-K296 PolarHBondContact O-N 3.48Å; G293-K296 VanDerWaalsContact O-N 3.14Å; G293-E297 PolarHBondContact O-N 3.48Å |
| 294 | K | 71.8 | Confident | 74 | Confident | 68 Ų | 68 | 71.6 Ų | 71.6 | 30% | 0.296 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -60.6 | -38.1 | 176.2 | -169 | -175.8 | 175.9 | -159.7 | 0 | 111.7 | N209 S211 S291 E297 E298 | N209-K294 PolarHBondContact ND2-NZ 3.12Å; N209-K294 PolarHBondContact O-NZ 3.37Å; N209-K294 VanDerWaalsContact O-NZ 3.11Å; S211-K294 WeakPolarHBondContact OG-CD 3.38Å; S291-K294 PolarHBondContact O-N 3.42Å; K294-E297 PolarHBondContact O-N 3.04Å; K294-E298 VanDerWaalsContact CE-OE1 3.24Å; K294-E298 WeakPolarHBondContact CE-OE1 3.5Å; K294-E298 HydrophobicContact CG-CG 4.47Å; K294-E298 IonicContact NZ-OE1 3.55Å; K294-E298 WeakPolarHBondContact O-CB 3.41Å; K294-E298 VanDerWaalsContact O-CG 3.32Å; K294-E298 WeakPolarHBondContact O-CG 3.41Å; K294-E298 PolarHBondContact O-N 3.08Å |
| 295 | A | 70.1 | Confident | 73 | Confident | 8 Ų | 8 | 74.3 Ų | 74.3 | 7% | 0.066 | 42% | 0.424 | C | S | . | . | H | α-helix | trans | -66.1 | -38.5 | 175.3 | 0 | 0 | 0 | 0 | 0 | 113.5 | I212 F215 S291 F292 G293 E297 F299 | I212-A295 HydrophobicContact CG1-CB 4.17Å; F215-A295 HydrophobicContact CD2-CB 3.8Å; F215-A295 HydrophobicContact CE2-CB 3.48Å; F215-A295 VanDerWaalsContact CE2-CB 3.48Å; S291-A295 PolarHBondContact O-N 3.16Å; F292-A295 PolarHBondContact O-N 3.33Å; G293-A295 VanDerWaalsContact C-N 3.28Å; G293-A295 PolarHBondContact O-N 2.88Å; A295-E297 VanDerWaalsContact C-N 3.33Å; A295-F299 VanDerWaalsContact O-CB 3.27Å; A295-F299 WeakPolarHBondContact O-CB 3.24Å; A295-F299 PolarHBondContact O-N 3.3Å |
| 296 | K | 72.7 | Confident | 72.1 | Confident | 132 Ų | 132 | 77.2 Ų | 77.2 | 57% | 0.574 | 44% | 0.441 | S | S | * | . | H | α-helix | trans | -63 | -42.3 | 173.3 | -80.3 | 180 | 163.9 | 176.8 | 0 | 111.5 | F292 G293 F299 A300 | F292-K296 HydrophobicContact CD1-CD 4.21Å; F292-K296 HydrophobicContact CE1-CD 4.02Å; F292-K296 HydrophobicContact CE1-CG 4.36Å; F292-K296 PolarHBondContact O-N 2.95Å; G293-K296 WeakPolarHBondContact O-CB 3.34Å; G293-K296 PolarHBondContact O-N 3.48Å; G293-K296 VanDerWaalsContact O-N 3.14Å; K296-F299 PolarHBondContact O-N 3.38Å; K296-A300 VanDerWaalsContact O-CB 3.31Å; K296-A300 WeakPolarHBondContact O-CB 3.33Å; K296-A300 PolarHBondContact O-N 3.44Å |
| 297 | E | 78.1 | Confident | 71.5 | Confident | 120 Ų | 120 | 73.7 Ų | 73.7 | 56% | 0.561 | 44% | 0.441 | S | S | * | . | H | α-helix | trans | -65 | -47.6 | 176.6 | -174 | 179.7 | -174.5 | 0 | 0 | 111.5 | G293 K294 A295 F299 A300 N301 | G293-E297 PolarHBondContact O-N 3.48Å; K294-E297 PolarHBondContact O-N 3.04Å; A295-E297 VanDerWaalsContact C-N 3.33Å; E297-F299 VanDerWaalsContact C-N 3.27Å; E297-F299 PolarHBondContact O-N 2.87Å; E297-A300 PolarHBondContact O-N 3.44Å; E297-N301 VanDerWaalsContact O-CB 3.29Å; E297-N301 WeakPolarHBondContact O-CB 3.41Å; E297-N301 PolarHBondContact O-N 3.45Å; E297-N301 PolarHBondContact O-ND2 3.35Å |
| 298 | E | 77.6 | Confident | 71 | Confident | 41 Ų | 41 | 75.9 Ų | 75.9 | 19% | 0.192 | 44% | 0.438 | C | S | . | . | H | α-helix | trans | -59.3 | -37.8 | 174.1 | -75.6 | 175.8 | -146.8 | 0 | 0 | 112 | S210 S211 I212 K294 G302 | S210-E298 VanDerWaalsContact C-OE2 3.3Å; S210-E298 WeakPolarHBondContact CA-OE2 3.39Å; S210-E298 WeakPolarHBondContact CB-OE2 3.24Å; S210-E298 PolarHBondContact OG-OE2 3.4Å; S211-E298 WeakPolarHBondContact CB-OE1 3.37Å; S211-E298 VanDerWaalsContact N-CD 3.32Å; S211-E298 PolarHBondContact N-OE1 2.93Å; S211-E298 PolarHBondContact N-OE2 2.98Å; S211-E298 PolarHBondContact OG-OE1 3.22Å; I212-E298 HydrophobicContact CD1-CB 4Å; I212-E298 HydrophobicContact CG1-CB 4.43Å; K294-E298 VanDerWaalsContact CE-OE1 3.24Å; K294-E298 WeakPolarHBondContact CE-OE1 3.5Å; K294-E298 HydrophobicContact CG-CG 4.47Å; K294-E298 IonicContact NZ-OE1 3.55Å; K294-E298 WeakPolarHBondContact O-CB 3.41Å; K294-E298 VanDerWaalsContact O-CG 3.32Å; K294-E298 WeakPolarHBondContact O-CG 3.41Å; K294-E298 PolarHBondContact O-N 3.08Å; E298-G302 PolarHBondContact O-N 3.23Å |
| 299 | F | 74.9 | Confident | 70.7 | Confident | 130 Ų | 130 | 76.4 Ų | 76.4 | 57% | 0.57 | 44% | 0.439 | S | S | * | . | H | α-helix | trans | -71.3 | -46 | 179.6 | -177.5 | -99.5 | 0 | 0 | 0 | 110.5 | I212 A295 K296 E297 G302 V303 | I212-F299 HydrophobicContact CD1-CB 3.63Å; I212-F299 HydrophobicContact CD1-CD2 4.15Å; I212-F299 HydrophobicContact CD1-CG 4.41Å; I212-F299 HydrophobicContact CG1-CB 4.49Å; A295-F299 VanDerWaalsContact O-CB 3.27Å; A295-F299 WeakPolarHBondContact O-CB 3.24Å; A295-F299 PolarHBondContact O-N 3.3Å; K296-F299 PolarHBondContact O-N 3.38Å; E297-F299 VanDerWaalsContact C-N 3.27Å; E297-F299 PolarHBondContact O-N 2.87Å; F299-G302 PolarHBondContact O-N 3.39Å; F299-V303 HydrophobicContact CD1-CG2 4.1Å; F299-V303 HydrophobicContact CE1-CG2 3.71Å; F299-V303 HydrophobicContact CE2-CG2 4.19Å; F299-V303 HydrophobicContact CG-CG2 4.5Å; F299-V303 HydrophobicContact CZ-CG2 3.77Å; F299-V303 WeakPolarHBondContact O-CB 3.5Å; F299-V303 VanDerWaalsContact O-CG2 3.27Å; F299-V303 WeakPolarHBondContact O-CG2 3.36Å; F299-V303 PolarHBondContact O-N 3.3Å |
| 300 | A | 76.2 | Confident | 70.8 | Confident | 48 Ų | 48 | 81 Ų | 81 | 40% | 0.397 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -59.8 | -46.9 | 175.6 | 0 | 0 | 0 | 0 | 0 | 111 | K296 E297 G302 V303 V304 | K296-A300 VanDerWaalsContact O-CB 3.31Å; K296-A300 WeakPolarHBondContact O-CB 3.33Å; K296-A300 PolarHBondContact O-N 3.44Å; E297-A300 PolarHBondContact O-N 3.44Å; A300-G302 VanDerWaalsContact C-N 3.34Å; A300-G302 PolarHBondContact O-N 2.92Å; A300-V303 PolarHBondContact O-N 3.07Å; A300-V304 WeakPolarHBondContact O-CB 3.44Å; A300-V304 VanDerWaalsContact O-CG2 3.23Å; A300-V304 WeakPolarHBondContact O-CG2 3.44Å; A300-V304 PolarHBondContact O-N 3.1Å |
| 301 | N | 75.4 | Confident | 71.4 | Confident | 97 Ų | 97 | 83.3 Ų | 83.3 | 52% | 0.519 | 45% | 0.452 | S | S | . | . | H | α-helix | trans | -63.6 | -39.6 | 176.7 | -69.7 | -14.9 | 0 | 0 | 0 | 111.7 | E297 V304 S305 | E297-N301 VanDerWaalsContact O-CB 3.29Å; E297-N301 WeakPolarHBondContact O-CB 3.41Å; E297-N301 PolarHBondContact O-N 3.45Å; E297-N301 PolarHBondContact O-ND2 3.35Å; N301-V304 PolarHBondContact O-N 3.12Å; N301-S305 WeakPolarHBondContact O-CB 3.46Å; N301-S305 PolarHBondContact O-N 3.2Å; N301-S305 PolarHBondContact O-OG 2.67Å |
| 302 | G | 68.7 | Low | 72.2 | Confident | 36 Ų | 36 | 82.4 Ų | 82.4 | 37% | 0.371 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -61.3 | -48.8 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | E298 F299 A300 V304 S305 D306 | E298-G302 PolarHBondContact O-N 3.23Å; F299-G302 PolarHBondContact O-N 3.39Å; A300-G302 VanDerWaalsContact C-N 3.34Å; A300-G302 PolarHBondContact O-N 2.92Å; G302-V304 VanDerWaalsContact C-N 3.34Å; G302-V304 PolarHBondContact O-N 2.8Å; G302-S305 PolarHBondContact O-N 3.37Å; G302-S305 PolarHBondContact O-OG 3.29Å; G302-D306 PolarHBondContact O-N 3.35Å |
| 303 | V | 72.3 | Confident | 72.9 | Confident | 56 Ų | 56 | 79 Ų | 79 | 34% | 0.339 | 44% | 0.442 | S | S | . | . | H | α-helix | trans | -62.4 | -39.9 | 177.2 | 171.2 | 0 | 0 | 0 | 0 | 111.4 | F299 A300 S305 D306 I309 | F299-V303 HydrophobicContact CD1-CG2 4.1Å; F299-V303 HydrophobicContact CE1-CG2 3.71Å; F299-V303 HydrophobicContact CE2-CG2 4.19Å; F299-V303 HydrophobicContact CG-CG2 4.5Å; F299-V303 HydrophobicContact CZ-CG2 3.77Å; F299-V303 WeakPolarHBondContact O-CB 3.5Å; F299-V303 VanDerWaalsContact O-CG2 3.27Å; F299-V303 WeakPolarHBondContact O-CG2 3.36Å; F299-V303 PolarHBondContact O-N 3.3Å; A300-V303 PolarHBondContact O-N 3.07Å; V303-S305 VanDerWaalsContact C-N 3.35Å; V303-D306 PolarHBondContact O-N 3.28Å; V303-I309 HydrophobicContact CG1-CG1 4.25Å; V303-I309 HydrophobicContact CG1-CG2 4.14Å; V303-I309 VanDerWaalsContact O-CB 3.28Å; V303-I309 WeakPolarHBondContact O-CB 3.48Å; V303-I309 WeakPolarHBondContact O-CG2 3.35Å |
| 304 | V | 73.1 | Confident | 73.3 | Confident | 100 Ų | 100 | 82.5 Ų | 82.5 | 61% | 0.606 | 45% | 0.451 | S | S | * | . | H | α-helix | trans | -68.9 | -33.5 | 176.9 | 171.4 | 0 | 0 | 0 | 0 | 112 | A300 N301 G302 D306 R310 | A300-V304 WeakPolarHBondContact O-CB 3.44Å; A300-V304 VanDerWaalsContact O-CG2 3.23Å; A300-V304 WeakPolarHBondContact O-CG2 3.44Å; A300-V304 PolarHBondContact O-N 3.1Å; N301-V304 PolarHBondContact O-N 3.12Å; G302-V304 VanDerWaalsContact C-N 3.34Å; G302-V304 PolarHBondContact O-N 2.8Å; V304-D306 VanDerWaalsContact C-N 3.32Å; V304-R310 WeakPolarHBondContact O-CG 3.43Å |
| 305 | S | 70.8 | Confident | 73.5 | Confident | 81 Ų | 81 | 85.9 Ų | 85.9 | 57% | 0.566 | 47% | 0.468 | S | S | * | . | H | α-helix | trans | -76.3 | -17.1 | 179 | 71.9 | 0 | 0 | 0 | 0 | 114.1 | N301 G302 V303 P307 | N301-S305 WeakPolarHBondContact O-CB 3.46Å; N301-S305 PolarHBondContact O-N 3.2Å; N301-S305 PolarHBondContact O-OG 2.67Å; G302-S305 PolarHBondContact O-N 3.37Å; G302-S305 PolarHBondContact O-OG 3.29Å; V303-S305 VanDerWaalsContact C-N 3.35Å; S305-P307 WeakPolarHBondContact O-CD 2.98Å |
| 306 | D | 71.1 | Confident | 73.8 | Confident | 73 Ų | 73 | 88.3 Ų | 88.3 | 39% | 0.39 | 49% | 0.488 | S | S | . | . | trans | -64.2 | 120.7 | -177.3 | -167.4 | -40.1 | 0 | 0 | 0 | 110.4 | G302 V303 V304 F308 I309 R310 | G302-D306 PolarHBondContact O-N 3.35Å; V303-D306 PolarHBondContact O-N 3.28Å; V304-D306 VanDerWaalsContact C-N 3.32Å; D306-F308 PolarHBondContact O-N 3.26Å; D306-F308 VanDerWaalsContact O-N 3.15Å; D306-F308 VanDerWaalsContact OD1-CB 3.32Å; D306-F308 WeakPolarHBondContact OD1-CB 2.99Å; D306-F308 PolarHBondContact OD1-N 2.91Å; D306-I309 HydrophobicContact CB-CB 4.12Å; D306-I309 HydrophobicContact CB-CG1 3.85Å; D306-I309 PolarHBondContact O-N 2.8Å; D306-R310 WeakPolarHBondContact O-CG 3.46Å; D306-R310 PolarHBondContact O-N 3.44Å | ||
| 307 | P | 73.3 | Confident | 74 | Confident | 103 Ų | 103 | 83.7 Ų | 83.7 | 67% | 0.669 | 48% | 0.478 | S | S | * | . | H | α-helix | trans | -53.3 | -34.7 | 178 | -26 | 34.2 | 0 | 0 | 0 | 113.6 | S305 R310 S311 | S305-P307 WeakPolarHBondContact O-CD 2.98Å; P307-R310 PolarHBondContact O-N 3.36Å; P307-S311 WeakPolarHBondContact O-CB 3.22Å; P307-S311 PolarHBondContact O-N 3Å; P307-S311 PolarHBondContact O-OG 2.83Å |
| 308 | F | 73.9 | Confident | 74 | Confident | 141 Ų | 141 | 83 Ų | 83 | 62% | 0.618 | 48% | 0.477 | S | S | * | . | H | α-helix | trans | -70.3 | -38.9 | 179.1 | 179.2 | -99.1 | 0 | 0 | 0 | 112 | D306 S311 S312 | D306-F308 PolarHBondContact O-N 3.26Å; D306-F308 VanDerWaalsContact O-N 3.15Å; D306-F308 VanDerWaalsContact OD1-CB 3.32Å; D306-F308 WeakPolarHBondContact OD1-CB 2.99Å; D306-F308 PolarHBondContact OD1-N 2.91Å; F308-S311 WeakPolarHBondContact CA-OG 3.44Å; F308-S311 PolarHBondContact O-OG 3.5Å; F308-S312 VanDerWaalsContact O-CB 3.29Å; F308-S312 WeakPolarHBondContact O-CB 3.46Å; F308-S312 PolarHBondContact O-N 2.92Å; F308-S312 PolarHBondContact O-OG 3.43Å |
| 309 | I | 71.4 | Confident | 73.9 | Confident | 64 Ų | 64 | 87.5 Ų | 87.5 | 33% | 0.328 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -73.4 | -36.7 | 175.3 | -57.6 | -63 | 0 | 0 | 0 | 110.1 | V303 D306 S312 A313 | V303-I309 HydrophobicContact CG1-CG1 4.25Å; V303-I309 HydrophobicContact CG1-CG2 4.14Å; V303-I309 VanDerWaalsContact O-CB 3.28Å; V303-I309 WeakPolarHBondContact O-CB 3.48Å; V303-I309 WeakPolarHBondContact O-CG2 3.35Å; D306-I309 HydrophobicContact CB-CB 4.12Å; D306-I309 HydrophobicContact CB-CG1 3.85Å; D306-I309 PolarHBondContact O-N 2.8Å; I309-S312 PolarHBondContact O-N 3.3Å; I309-A313 WeakPolarHBondContact O-CB 3.32Å; I309-A313 PolarHBondContact O-N 3.3Å |
| 310 | R | 70.1 | Confident | 74 | Confident | 158 Ų | 158 | 84.1 Ų | 84.1 | 60% | 0.596 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -62.4 | -44.9 | 172.3 | -70.3 | -174.8 | 68.4 | -174.6 | 1.5 | 111.7 | V304 D306 P307 L314 | V304-R310 WeakPolarHBondContact O-CG 3.43Å; D306-R310 WeakPolarHBondContact O-CG 3.46Å; D306-R310 PolarHBondContact O-N 3.44Å; P307-R310 PolarHBondContact O-N 3.36Å; R310-L314 WeakPolarHBondContact O-CB 3.24Å; R310-L314 WeakPolarHBondContact O-CD1 3.21Å; R310-L314 WeakPolarHBondContact O-CG 3.43Å; R310-L314 PolarHBondContact O-N 2.95Å |
| 311 | S | 76.4 | Confident | 74 | Confident | 58 Ų | 58 | 86 Ų | 86 | 41% | 0.406 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -64.5 | -41.6 | 176.4 | 61.7 | 0 | 0 | 0 | 0 | 111.4 | P307 F308 L314 E315 | P307-S311 WeakPolarHBondContact O-CB 3.22Å; P307-S311 PolarHBondContact O-N 3Å; P307-S311 PolarHBondContact O-OG 2.83Å; F308-S311 WeakPolarHBondContact CA-OG 3.44Å; F308-S311 PolarHBondContact O-OG 3.5Å; S311-L314 PolarHBondContact O-N 3.06Å; S311-E315 VanDerWaalsContact O-CB 3.29Å; S311-E315 WeakPolarHBondContact O-CB 3.43Å; S311-E315 PolarHBondContact O-N 3.42Å |
| 312 | S | 75.1 | Confident | 73.9 | Confident | 43 Ų | 43 | 90 Ų | 90 | 30% | 0.301 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -68.8 | -40 | 178.3 | -56.5 | 0 | 0 | 0 | 0 | 112.6 | F308 I309 E315 A316 | F308-S312 VanDerWaalsContact O-CB 3.29Å; F308-S312 WeakPolarHBondContact O-CB 3.46Å; F308-S312 PolarHBondContact O-N 2.92Å; F308-S312 PolarHBondContact O-OG 3.43Å; I309-S312 PolarHBondContact O-N 3.3Å; S312-E315 PolarHBondContact O-N 3.42Å; S312-A316 VanDerWaalsContact O-CB 3.29Å; S312-A316 WeakPolarHBondContact O-CB 3.27Å; S312-A316 PolarHBondContact O-N 3.06Å |
| 313 | A | 72.2 | Confident | 74.1 | Confident | 62 Ų | 62 | 93.8 Ų | 93.8 | 51% | 0.512 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -69.8 | -38 | 176.3 | 0 | 0 | 0 | 0 | 0 | 111.4 | I309 G317 | I309-A313 WeakPolarHBondContact O-CB 3.32Å; I309-A313 PolarHBondContact O-N 3.3Å; A313-G317 PolarHBondContact O-N 2.92Å |
| 314 | L | 75.3 | Confident | 74 | Confident | 114 Ų | 114 | 94.3 Ų | 94.3 | 60% | 0.597 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -61.9 | -45.7 | 170 | -76 | 167 | 0 | 0 | 0 | 110.6 | R310 S311 G317 L318 | R310-L314 WeakPolarHBondContact O-CB 3.24Å; R310-L314 WeakPolarHBondContact O-CD1 3.21Å; R310-L314 WeakPolarHBondContact O-CG 3.43Å; R310-L314 PolarHBondContact O-N 2.95Å; S311-L314 PolarHBondContact O-N 3.06Å; L314-G317 PolarHBondContact O-N 3.35Å; L314-L318 WeakPolarHBondContact O-CB 3.48Å; L314-L318 WeakPolarHBondContact O-CG 3.37Å; L314-L318 PolarHBondContact O-N 3.37Å |
| 315 | E | 75.8 | Confident | 74 | Confident | 138 Ų | 138 | 94.6 Ų | 94.6 | 65% | 0.645 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -64 | -44.8 | 178.1 | -174.2 | 171.8 | -172.8 | 0 | 0 | 112.4 | S311 S312 L318 F319 | S311-E315 VanDerWaalsContact O-CB 3.29Å; S311-E315 WeakPolarHBondContact O-CB 3.43Å; S311-E315 PolarHBondContact O-N 3.42Å; S312-E315 PolarHBondContact O-N 3.42Å; E315-L318 PolarHBondContact O-N 2.94Å; E315-F319 WeakPolarHBondContact O-CB 2.94Å; E315-F319 PolarHBondContact O-N 3.35Å |
| 316 | A | 75.7 | Confident | 73.8 | Confident | 60 Ų | 60 | 95.2 Ų | 95.2 | 50% | 0.496 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -65.1 | -40 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | S312 F319 A320 | S312-A316 VanDerWaalsContact O-CB 3.29Å; S312-A316 WeakPolarHBondContact O-CB 3.27Å; S312-A316 PolarHBondContact O-N 3.06Å; A316-F319 PolarHBondContact O-N 2.97Å; A316-A320 WeakPolarHBondContact O-CB 3.42Å; A316-A320 PolarHBondContact O-N 3.4Å |
| 317 | G | 75.9 | Confident | 73.1 | Confident | 35 Ų | 35 | 96.1 Ų | 96.1 | 36% | 0.361 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -63.3 | -40.8 | 174.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | A313 L314 T321 | A313-G317 PolarHBondContact O-N 2.92Å; L314-G317 PolarHBondContact O-N 3.35Å; G317-T321 WeakPolarHBondContact O-CB 3.43Å; G317-T321 PolarHBondContact O-N 2.8Å; G317-T321 PolarHBondContact O-OG1 2.93Å |
| 318 | L | 78.1 | Confident | 72.2 | Confident | 104 Ų | 104 | 93.2 Ų | 93.2 | 55% | 0.545 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -64.7 | -40.8 | 173.1 | -71.3 | 168.6 | 0 | 0 | 0 | 111.8 | L314 E315 T321 R322 | L314-L318 WeakPolarHBondContact O-CB 3.48Å; L314-L318 WeakPolarHBondContact O-CG 3.37Å; L314-L318 PolarHBondContact O-N 3.37Å; E315-L318 PolarHBondContact O-N 2.94Å; L318-T321 PolarHBondContact O-N 3.41Å; L318-R322 WeakPolarHBondContact O-CG 3.38Å; L318-R322 PolarHBondContact O-N 3.47Å |
| 319 | F | 76.8 | Confident | 71.3 | Confident | 137 Ų | 137 | 92.6 Ų | 92.6 | 60% | 0.601 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -63.9 | -47.2 | 175.9 | -173.9 | -89.9 | 0 | 0 | 0 | 112.2 | E315 A316 T321 R322 Q323 | E315-F319 WeakPolarHBondContact O-CB 2.94Å; E315-F319 PolarHBondContact O-N 3.35Å; A316-F319 PolarHBondContact O-N 2.97Å; F319-T321 VanDerWaalsContact C-N 3.33Å; F319-T321 PolarHBondContact O-N 3.23Å; F319-R322 PolarHBondContact O-N 3.47Å; F319-Q323 PolarHBondContact O-N 3.04Å |
| 320 | A | 76.1 | Confident | 70.4 | Confident | 58 Ų | 58 | 95.1 Ų | 95.1 | 48% | 0.479 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -62.1 | -40.2 | 177 | 0 | 0 | 0 | 0 | 0 | 112 | A316 R322 Q323 A324 | A316-A320 WeakPolarHBondContact O-CB 3.42Å; A316-A320 PolarHBondContact O-N 3.4Å; A320-R322 VanDerWaalsContact C-N 3.34Å; A320-R322 PolarHBondContact O-N 3.24Å; A320-Q323 PolarHBondContact O-N 2.86Å; A320-A324 PolarHBondContact O-N 2.99Å |
| 321 | T | 77.6 | Confident | 69.6 | Low | 88 Ų | 88 | 91.9 Ų | 91.9 | 54% | 0.54 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -61.8 | -42.3 | 175.2 | -55 | 0 | 0 | 0 | 0 | 111.1 | G317 L318 F319 Q323 A324 T325 | G317-T321 WeakPolarHBondContact O-CB 3.43Å; G317-T321 PolarHBondContact O-N 2.8Å; G317-T321 PolarHBondContact O-OG1 2.93Å; L318-T321 PolarHBondContact O-N 3.41Å; F319-T321 VanDerWaalsContact C-N 3.33Å; F319-T321 PolarHBondContact O-N 3.23Å; T321-Q323 VanDerWaalsContact C-N 3.35Å; T321-Q323 PolarHBondContact O-N 3.35Å; T321-A324 PolarHBondContact O-N 3.29Å; T321-T325 WeakPolarHBondContact O-CG2 3.31Å; T321-T325 PolarHBondContact O-N 2.83Å; T321-T325 VanDerWaalsContact O-N 3.1Å; T321-T325 PolarHBondContact O-OG1 3.36Å |
| 322 | R | 73 | Confident | 68.4 | Low | 180 Ų | 180 | 97 Ų | 97 | 68% | 0.679 | 60% | 0.596 | S | S | * | * | H | α-helix | trans | -66 | -33.7 | 176.5 | -74.4 | 176.1 | 179.9 | 169.9 | 1.5 | 113.4 | L318 F319 A320 T325 S326 | L318-R322 WeakPolarHBondContact O-CG 3.38Å; L318-R322 PolarHBondContact O-N 3.47Å; F319-R322 PolarHBondContact O-N 3.47Å; A320-R322 VanDerWaalsContact C-N 3.34Å; A320-R322 PolarHBondContact O-N 3.24Å; R322-T325 WeakPolarHBondContact CA-OG1 3.27Å; R322-T325 PolarHBondContact O-OG1 3.5Å; R322-T325 VanDerWaalsContact O-OG1 3.05Å; R322-S326 WeakPolarHBondContact O-CB 3.31Å; R322-S326 PolarHBondContact O-N 2.93Å; R322-S326 VanDerWaalsContact O-N 3.13Å; R322-S326 PolarHBondContact O-OG 3.49Å |
| 323 | Q | 72.8 | Confident | 66.7 | Low | 117 Ų | 117 | 106 Ų | 106 | 55% | 0.547 | 62% | 0.623 | S | S | . | * | H | α-helix | trans | -75.1 | -35.6 | 177.9 | -167 | 168 | 0.7 | 0 | 0 | 112.2 | F319 A320 T321 S326 S327 | F319-Q323 PolarHBondContact O-N 3.04Å; A320-Q323 PolarHBondContact O-N 2.86Å; T321-Q323 VanDerWaalsContact C-N 3.35Å; T321-Q323 PolarHBondContact O-N 3.35Å; Q323-S326 PolarHBondContact O-N 3.11Å; Q323-S326 PolarHBondContact O-OG 3.12Å; Q323-S326 VanDerWaalsContact O-OG 3.13Å; Q323-S327 PolarHBondContact O-N 2.82Å; Q323-S327 PolarHBondContact O-OG 3.05Å |
| 324 | A | 69.9 | Low | 65.5 | Low | 67 Ų | 67 | 112.1 Ų | 112.1 | 55% | 0.554 | 66% | 0.662 | S | S | * | * | H | α-helix | trans | -67.2 | -35.3 | 173.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | A320 T321 | A320-A324 PolarHBondContact O-N 2.99Å; T321-A324 PolarHBondContact O-N 3.29Å |
| 325 | T | 72.4 | Confident | 65 | Low | 106 Ų | 106 | 112 Ų | 112 | 65% | 0.65 | 67% | 0.666 | S | S | * | * | H | α-helix | trans | -76.7 | -28.3 | 176.6 | 57.1 | 0 | 0 | 0 | 0 | 113.2 | T321 R322 | T321-T325 WeakPolarHBondContact O-CG2 3.31Å; T321-T325 PolarHBondContact O-N 2.83Å; T321-T325 VanDerWaalsContact O-N 3.1Å; T321-T325 PolarHBondContact O-OG1 3.36Å; R322-T325 WeakPolarHBondContact CA-OG1 3.27Å; R322-T325 PolarHBondContact O-OG1 3.5Å; R322-T325 VanDerWaalsContact O-OG1 3.05Å |
| 326 | S | 67.2 | Low | 64.5 | Low | 94 Ų | 94 | 110.6 Ų | 110.6 | 66% | 0.657 | 67% | 0.667 | S | S | * | * | H | α-helix | trans | -81.9 | -20.7 | 178.2 | 67.4 | 0 | 0 | 0 | 0 | 114.4 | R322 Q323 | R322-S326 WeakPolarHBondContact O-CB 3.31Å; R322-S326 PolarHBondContact O-N 2.93Å; R322-S326 VanDerWaalsContact O-N 3.13Å; R322-S326 PolarHBondContact O-OG 3.49Å; Q323-S326 PolarHBondContact O-N 3.11Å; Q323-S326 PolarHBondContact O-OG 3.12Å; Q323-S326 VanDerWaalsContact O-OG 3.13Å |
| 327 | S | 57 | Low | 63.8 | Low | 91 Ų | 91 | 113.4 Ų | 113.4 | 64% | 0.636 | 68% | 0.676 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -93.5 | 10.4 | 174.5 | 48.7 | 0 | 0 | 0 | 0 | 113.7 | Q323 | Q323-S327 PolarHBondContact O-N 2.82Å; Q323-S327 PolarHBondContact O-OG 3.05Å |
| 328 | G | 54.1 | Low | 63.1 | Low | 42 Ų | 42 | 118.1 Ų | 118.1 | 43% | 0.433 | 70% | 0.695 | S | S | . | * | S | Bend | trans | -59 | 143.4 | 168.6 | 0 | 0 | 0 | 0 | 0 | 111.2 | S330 | G328-S330 PolarHBondContact O-N 3.09Š|
| 329 | P | 53.6 | Low | 62.2 | Low | 128 Ų | 128 | 118.9 Ų | 118.9 | 83% | 0.831 | 70% | 0.704 | S | S | * | * | trans | -56.3 | 126 | -158.8 | -16.1 | 25.6 | 0 | 0 | 0 | 110.9 | A331 | P329-A331 VanDerWaalsContact C-N 3.31Å; P329-A331 PolarHBondContact O-N 3.25Å | ||
| 330 | S | 53 | Low | 61.2 | Low | 117 Ų | 117 | 117.7 Ų | 117.7 | 82% | 0.818 | 71% | 0.711 | S | S | * | * | trans | -52.5 | 102.9 | 164.7 | -62.8 | 0 | 0 | 0 | 0 | 107.4 | G328 N332 | G328-S330 PolarHBondContact O-N 3.09Å; S330-N332 PolarHBondContact O-N 2.88Å | ||
| 331 | A | 54.1 | Low | 60.2 | Low | 91 Ų | 91 | 122 Ų | 122 | 75% | 0.752 | 73% | 0.728 | S | S | * | * | trans | -59.6 | 94.8 | 168 | 0 | 0 | 0 | 0 | 0 | 105.8 | P329 R333 | P329-A331 VanDerWaalsContact C-N 3.31Å; P329-A331 PolarHBondContact O-N 3.25Å; A331-R333 PolarHBondContact O-N 3.28Å | ||
| 332 | N | 49.8 | Very low | 58.8 | Low | 164 Ų | 164 | 124.6 Ų | 124.6 | 88% | 0.877 | 74% | 0.742 | S | S | * | * | trans | -68.7 | 91.4 | 175.4 | -146.4 | 18.9 | 0 | 0 | 0 | 106 | S330 S334 | S330-N332 PolarHBondContact O-N 2.88Å; N332-S334 PolarHBondContact O-N 3.32Å | ||
| 333 | R | 40.5 | Very low | 57.6 | Low | 232 Ų | 232 | 120 Ų | 120 | 88% | 0.875 | 75% | 0.747 | S | S | * | * | trans | -62.5 | 117.7 | 159.6 | -83.7 | -179.3 | -179.7 | 168.3 | 0.1 | 107.7 | A331 | A331-R333 PolarHBondContact O-N 3.28Š| ||
| 334 | S | 47.2 | Very low | 56.3 | Low | 191 Ų | 191 | 120.3 Ų | 120.3 | 100% | 1.336 | 77% | 0.765 | S | S | * | * | 178.7 | 0 | 115.6 | 56.6 | 0 | 0 | 0 | 0 | 109.4 | N332 | N332-S334 PolarHBondContact O-N 3.32Š|
Retrieved 334 of 334 residues in 513.8 ms
(Link to these results)