| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 34.8 | Very low | 31.2 | Very low | 236 Ų | 236 | 145.5 Ų | 145.5 | 100% | 1.163 | 82% | 0.822 | S | S | * | * | 0 | 116.8 | 0 | -77.2 | 164.2 | 85.8 | 0 | 0 | 106.2 | |||||
| 2 | S | 31.5 | Very low | 31.2 | Very low | 116 Ų | 116 | 148.2 Ų | 148.2 | 81% | 0.811 | 83% | 0.831 | S | S | * | * | trans | -83.3 | 123.2 | 176.8 | -48.8 | 0 | 0 | 0 | 0 | 107.6 | ||||
| 3 | D | 35.7 | Very low | 31.2 | Very low | 162 Ų | 162 | 146.9 Ų | 146.9 | 87% | 0.866 | 82% | 0.821 | S | S | * | * | trans | -132.1 | 116.5 | 156.9 | -85.6 | -40.5 | 0 | 0 | 0 | 108 | ||||
| 4 | V | 32.2 | Very low | 31.1 | Very low | 124 Ų | 124 | 144.2 Ų | 144.2 | 75% | 0.752 | 82% | 0.817 | S | S | * | * | trans | -112.7 | 116.7 | 172.8 | 167 | 0 | 0 | 0 | 0 | 104.9 | ||||
| 5 | N | 34.3 | Very low | 31.3 | Very low | 136 Ų | 136 | 141.3 Ų | 141.3 | 73% | 0.727 | 81% | 0.81 | S | S | * | * | trans | 179 | 101.3 | 152.4 | -88.8 | -35.7 | 0 | 0 | 0 | 106.8 | ||||
| 6 | Q | 29.7 | Very low | 31.4 | Very low | 155 Ų | 155 | 142.3 Ų | 142.3 | 72% | 0.724 | 81% | 0.811 | S | S | * | * | 96 | 129.3 | 87.9 | -88.6 | -161.5 | 82.2 | 0 | 0 | 112.8 | |||||
| 7 | L | 28.5 | Very low | 31.8 | Very low | 148 Ų | 148 | 141.8 Ų | 141.8 | 78% | 0.775 | 81% | 0.812 | S | S | * | * | trans | 75 | 104.6 | 153.5 | -63.9 | 152.7 | 0 | 0 | 0 | 118 | ||||
| 8 | T | 29.9 | Very low | 31.9 | Very low | 129 Ų | 129 | 142.2 Ų | 142.2 | 79% | 0.791 | 81% | 0.81 | S | S | * | * | 174.1 | 109.8 | 100.9 | -57.1 | 0 | 0 | 0 | 0 | 108.7 | |||||
| 9 | N | 26.3 | Very low | 31.9 | Very low | 166 Ų | 166 | 138.9 Ų | 138.9 | 89% | 0.888 | 80% | 0.803 | S | S | * | * | trans | -79.4 | 125.6 | 167.7 | -80.8 | -34.9 | 0 | 0 | 0 | 108.9 | ||||
| 10 | P | 31.7 | Very low | 31.7 | Very low | 108 Ų | 108 | 143.2 Ų | 143.2 | 70% | 0.701 | 81% | 0.807 | S | S | * | * | trans | -82.8 | 138.2 | 178.2 | 31.3 | -31.4 | 0 | 0 | 0 | 112.3 | ||||
| 11 | S | 28.3 | Very low | 31.8 | Very low | 120 Ų | 120 | 141 Ų | 141 | 84% | 0.839 | 80% | 0.799 | S | S | * | * | trans | 26.1 | 95.7 | 137.4 | 168.3 | 0 | 0 | 0 | 0 | 116.5 | ||||
| 12 | L | 31.7 | Very low | 31.6 | Very low | 178 Ų | 178 | 141.1 Ų | 141.1 | 93% | 0.932 | 79% | 0.786 | S | S | * | * | trans | -91.1 | 122.2 | 167.3 | -123.6 | 150.6 | 0 | 0 | 0 | 109.4 | ||||
| 13 | D | 31.1 | Very low | 31.7 | Very low | 132 Ų | 132 | 145.6 Ų | 145.6 | 71% | 0.706 | 79% | 0.791 | S | S | * | * | trans | -66.2 | 143.4 | -169.8 | -157 | -7.2 | 0 | 0 | 0 | 113.4 | ||||
| 14 | S | 29.2 | Very low | 31.6 | Very low | 109 Ų | 109 | 142.2 Ų | 142.2 | 76% | 0.762 | 79% | 0.786 | S | S | * | * | trans | -93.8 | 98.3 | 176.4 | 54.2 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 15 | S | 34.4 | Very low | 31.5 | Very low | 101 Ų | 101 | 139.9 Ų | 139.9 | 71% | 0.706 | 79% | 0.787 | S | S | * | * | trans | -168.9 | 80.7 | 157.4 | 46.4 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 16 | D | 32.5 | Very low | 31.3 | Very low | 156 Ų | 156 | 145 Ų | 145 | 83% | 0.834 | 80% | 0.796 | S | S | * | * | trans | -156.5 | 63.4 | 147.7 | -140 | -6.7 | 0 | 0 | 0 | 110.6 | ||||
| 17 | V | 38.2 | Very low | 31.2 | Very low | 135 Ų | 135 | 143.9 Ų | 143.9 | 82% | 0.818 | 80% | 0.8 | S | S | * | * | trans | -108.3 | 86.7 | 166.7 | 177 | 0 | 0 | 0 | 0 | 106.2 | ||||
| 18 | D | 35 | Very low | 31.5 | Very low | 148 Ų | 148 | 145.2 Ų | 145.2 | 79% | 0.791 | 81% | 0.807 | S | S | * | * | trans | 176.8 | 71.8 | 148.4 | -93.4 | -19.9 | 0 | 0 | 0 | 110.6 | ||||
| 19 | A | 30.1 | Very low | 31.5 | Very low | 81 Ų | 81 | 150 Ų | 150 | 67% | 0.669 | 81% | 0.811 | S | S | * | * | trans | -138 | 127.1 | 164.8 | 0 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 20 | Y | 29 | Very low | 31.5 | Very low | 224 Ų | 224 | 151.4 Ų | 151.4 | 88% | 0.878 | 81% | 0.809 | S | S | * | * | S | Bend | trans | 107 | 137.9 | 174.1 | -71 | -85.8 | 0 | 0 | 0 | 117.4 | ||
| 21 | P | 33.3 | Very low | 31.4 | Very low | 98 Ų | 98 | 153.5 Ų | 153.5 | 64% | 0.636 | 81% | 0.814 | S | S | * | * | -108.9 | 141.2 | -124.2 | 5.1 | 17.9 | 0 | 0 | 0 | 112.3 | F23 | P21-F23 PolarHBondContact O-N 3.11Š| |||
| 22 | R | 30.2 | Very low | 31.8 | Very low | 238 Ų | 238 | 156 Ų | 156 | 90% | 0.898 | 82% | 0.817 | S | S | * | * | trans | -59.6 | 106.3 | 173.2 | -61.6 | 178.9 | -177 | 167.1 | 2.6 | 109.9 | A24 | R22-A24 PolarHBondContact O-N 3.34Š| ||
| 23 | F | 34.6 | Very low | 31.6 | Very low | 209 Ų | 209 | 152.4 Ų | 152.4 | 92% | 0.917 | 81% | 0.807 | S | S | * | * | trans | -63.8 | 103.8 | 165.2 | -86.7 | -86.8 | 0 | 0 | 0 | 108.6 | P21 G25 | P21-F23 PolarHBondContact O-N 3.11Å; F23-G25 PolarHBondContact O-N 3.14Å | ||
| 24 | A | 34.3 | Very low | 31.7 | Very low | 91 Ų | 91 | 152.4 Ų | 152.4 | 75% | 0.752 | 81% | 0.807 | S | S | * | * | trans | -62.6 | 122.5 | 175 | 0 | 0 | 0 | 0 | 0 | 109.8 | R22 R26 | R22-A24 PolarHBondContact O-N 3.34Å; A24-R26 PolarHBondContact O-N 3.19Å; A24-R26 VanDerWaalsContact O-N 3.14Å | ||
| 25 | G | 28.6 | Very low | 31.9 | Very low | 76 Ų | 76 | 155.9 Ų | 155.9 | 78% | 0.784 | 81% | 0.808 | S | S | * | * | trans | -54.6 | 116.6 | 174.8 | 0 | 0 | 0 | 0 | 0 | 111.5 | F23 | F23-G25 PolarHBondContact O-N 3.14Š| ||
| 26 | R | 30.1 | Very low | 31.9 | Very low | 242 Ų | 242 | 158.7 Ų | 158.7 | 91% | 0.913 | 82% | 0.815 | S | S | * | * | trans | -92.2 | 101.4 | 158.6 | -88.3 | -171 | 175.8 | -139.5 | 1.2 | 108.9 | A24 L28 | A24-R26 PolarHBondContact O-N 3.19Å; A24-R26 VanDerWaalsContact O-N 3.14Å; R26-L28 PolarHBondContact O-N 3.04Å | ||
| 27 | T | 28.4 | Very low | 31.9 | Very low | 132 Ų | 132 | 157.1 Ų | 157.1 | 81% | 0.81 | 81% | 0.813 | S | S | * | * | trans | -52.5 | 111.9 | 154.1 | 12.1 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 28 | L | 34.8 | Very low | 31.8 | Very low | 176 Ų | 176 | 156.2 Ų | 156.2 | 92% | 0.921 | 81% | 0.813 | S | S | * | * | trans | -94.6 | 117.2 | 154.2 | -95.2 | 166.6 | 0 | 0 | 0 | 107.6 | R26 | R26-L28 PolarHBondContact O-N 3.04Š| ||
| 29 | R | 29.6 | Very low | 31.8 | Very low | 231 Ų | 231 | 154.9 Ų | 154.9 | 87% | 0.872 | 81% | 0.812 | S | S | * | * | trans | -64.1 | 140.7 | -175.4 | -71 | -178.1 | 176.8 | 170.8 | -1.5 | 111.2 | D31 | R29-D31 PolarHBondContact O-N 3.38Š| ||
| 30 | K | 25.7 | Very low | 32 | Very low | 195 Ų | 195 | 156 Ų | 156 | 85% | 0.848 | 82% | 0.815 | S | S | * | * | trans | -37.8 | 122.5 | 145.2 | -122.1 | 169.7 | 176.9 | 173.9 | 0 | 109.8 | ||||
| 31 | D | 30.9 | Very low | 32.5 | Very low | 152 Ų | 152 | 154.8 Ų | 154.8 | 81% | 0.813 | 81% | 0.814 | S | S | * | * | trans | 172.3 | 103.4 | 137.9 | -82.3 | -20.6 | 0 | 0 | 0 | 109.2 | R29 | R29-D31 PolarHBondContact O-N 3.38Š| ||
| 32 | L | 35.5 | Very low | 32.5 | Very low | 173 Ų | 173 | 158.7 Ų | 158.7 | 91% | 0.906 | 82% | 0.824 | S | S | * | * | trans | -169.9 | 85.8 | 145.7 | -101 | 152.7 | 0 | 0 | 0 | 107.6 | ||||
| 33 | S | 27.7 | Very low | 33 | Very low | 102 Ų | 102 | 152.4 Ų | 152.4 | 71% | 0.713 | 81% | 0.812 | S | S | * | * | trans | -67.5 | 122.6 | 148.3 | 178.1 | 0 | 0 | 0 | 0 | 107 | ||||
| 34 | D | 34.4 | Very low | 32.9 | Very low | 131 Ų | 131 | 151.9 Ų | 151.9 | 70% | 0.701 | 80% | 0.804 | S | S | * | * | trans | 175.7 | 120.8 | 130.8 | -91 | -5.2 | 0 | 0 | 0 | 113.9 | ||||
| 35 | K | 33.3 | Very low | 33.1 | Very low | 183 Ų | 183 | 156.3 Ų | 156.3 | 80% | 0.796 | 81% | 0.806 | S | S | * | * | trans | 78.5 | 120.6 | 146.4 | -59.7 | -167 | -177.8 | -164.5 | 0 | 122.2 | ||||
| 36 | L | 33.6 | Very low | 33.2 | Very low | 160 Ų | 160 | 161.6 Ų | 161.6 | 84% | 0.838 | 80% | 0.803 | S | S | * | * | trans | 98.9 | 122.3 | 147.6 | -118 | 78.2 | 0 | 0 | 0 | 118.1 | ||||
| 37 | P | 33.6 | Very low | 33.5 | Very low | 123 Ų | 123 | 155.3 Ų | 155.3 | 80% | 0.799 | 79% | 0.793 | S | S | * | * | trans | -88.1 | 136.7 | -174.8 | 35.2 | -29.7 | 0 | 0 | 0 | 110.6 | ||||
| 38 | S | 34.3 | Very low | 33.7 | Very low | 116 Ų | 116 | 156.2 Ų | 156.2 | 81% | 0.811 | 79% | 0.793 | S | S | * | * | trans | -118.6 | 141.2 | 165 | -70.9 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 39 | P | 36 | Very low | 33.6 | Very low | 119 Ų | 119 | 153.3 Ų | 153.3 | 77% | 0.773 | 78% | 0.782 | S | S | * | * | trans | -85.2 | 153.7 | -144.2 | 32 | -34.7 | 0 | 0 | 0 | 113.6 | K41 | P39-K41 PolarHBondContact O-N 3.2Š| ||
| 40 | S | 33.8 | Very low | 33.9 | Very low | 106 Ų | 106 | 148.3 Ų | 148.3 | 74% | 0.741 | 77% | 0.771 | S | S | * | * | trans | -27.8 | 118 | 159.1 | -179.5 | 0 | 0 | 0 | 0 | 112.4 | Q42 | S40-Q42 PolarHBondContact O-N 3.37Š| ||
| 41 | K | 39.2 | Very low | 34.1 | Very low | 198 Ų | 198 | 144.3 Ų | 144.3 | 86% | 0.861 | 76% | 0.764 | S | S | * | * | trans | -64 | 89 | 166.1 | -70.9 | 175.8 | 179.3 | 177.3 | 0 | 107.6 | P39 V43 | P39-K41 PolarHBondContact O-N 3.2Å; K41-V43 PolarHBondContact O-N 3.4Å | ||
| 42 | Q | 34.5 | Very low | 34.2 | Very low | 179 Ų | 179 | 142.8 Ų | 142.8 | 84% | 0.836 | 76% | 0.756 | S | S | * | * | trans | -61.4 | 103.1 | 160.4 | -83.2 | -179.5 | -9.1 | 0 | 0 | 107.6 | S40 R44 | S40-Q42 PolarHBondContact O-N 3.37Å; Q42-R44 VanDerWaalsContact C-N 3.29Å; Q42-R44 PolarHBondContact O-N 3.35Å | ||
| 43 | V | 40.7 | Very low | 34 | Very low | 106 Ų | 106 | 139.6 Ų | 139.6 | 64% | 0.642 | 75% | 0.748 | S | S | * | * | trans | -68.5 | 92.5 | 167.7 | 177.9 | 0 | 0 | 0 | 0 | 106.7 | K41 F45 | K41-V43 PolarHBondContact O-N 3.4Å; V43-F45 HydrophobicContact CG1-CD2 4.47Å; V43-F45 HydrophobicContact CG1-CE1 4.4Å; V43-F45 HydrophobicContact CG1-CE2 4.07Å; V43-F45 HydrophobicContact CG1-CZ 4.03Å; V43-F45 PolarHBondContact O-N 3.22Å | ||
| 44 | R | 32.7 | Very low | 34.2 | Very low | 199 Ų | 199 | 141.8 Ų | 141.8 | 75% | 0.751 | 75% | 0.745 | S | S | * | * | trans | -77.5 | 102.4 | 174.9 | -167.6 | 174.3 | -174.6 | 163.5 | 3.1 | 107.7 | Q42 R46 | Q42-R44 VanDerWaalsContact C-N 3.29Å; Q42-R44 PolarHBondContact O-N 3.35Å; R44-R46 PolarHBondContact O-N 3.35Å | ||
| 45 | F | 37.1 | Very low | 34.3 | Very low | 183 Ų | 183 | 143 Ų | 143 | 80% | 0.803 | 75% | 0.751 | S | S | * | * | trans | -64.8 | 104.5 | 168.2 | -66.5 | -83.4 | 0 | 0 | 0 | 108.5 | V43 P47 | V43-F45 HydrophobicContact CG1-CD2 4.47Å; V43-F45 HydrophobicContact CG1-CE1 4.4Å; V43-F45 HydrophobicContact CG1-CE2 4.07Å; V43-F45 HydrophobicContact CG1-CZ 4.03Å; V43-F45 PolarHBondContact O-N 3.22Å; F45-P47 WeakPolarHBondContact O-CD 3.39Å | ||
| 46 | R | 32.3 | Very low | 34.4 | Very low | 188 Ų | 188 | 143.4 Ų | 143.4 | 71% | 0.709 | 76% | 0.756 | S | S | * | * | trans | -84.8 | 115.5 | 162.8 | -76.3 | -91.6 | -176.6 | 158.9 | 0 | 106 | R44 N48 | R44-R46 PolarHBondContact O-N 3.35Å; R46-N48 PolarHBondContact O-N 3.11Å | ||
| 47 | P | 36.4 | Very low | 34.2 | Very low | 110 Ų | 110 | 141.8 Ų | 141.8 | 71% | 0.714 | 75% | 0.747 | S | S | * | * | trans | -62.5 | 120.5 | 170.6 | 23.5 | -29.3 | 0 | 0 | 0 | 107.8 | F45 V49 | F45-P47 WeakPolarHBondContact O-CD 3.39Å; P47-V49 PolarHBondContact O-N 3.12Å | ||
| 48 | N | 32.3 | Very low | 34.2 | Very low | 150 Ų | 150 | 140.7 Ų | 140.7 | 80% | 0.802 | 75% | 0.748 | S | S | * | * | trans | -65.2 | 93.4 | 167.1 | -89.4 | -11.9 | 0 | 0 | 0 | 107.2 | R46 I50 | R46-N48 PolarHBondContact O-N 3.11Å; N48-I50 HydrophobicContact CB-CG1 4.31Å; N48-I50 PolarHBondContact O-N 2.76Å; N48-I50 VanDerWaalsContact O-N 3.07Å | ||
| 49 | V | 32.9 | Very low | 34.4 | Very low | 115 Ų | 115 | 142.3 Ų | 142.3 | 70% | 0.697 | 75% | 0.748 | S | S | * | * | trans | -72.4 | 92.2 | 158.7 | -177.1 | 0 | 0 | 0 | 0 | 105.1 | P47 T51 | P47-V49 PolarHBondContact O-N 3.12Å; V49-T51 HydrophobicContact CG1-CG2 3.82Å; V49-T51 PolarHBondContact O-N 2.92Å | ||
| 50 | I | 34.7 | Very low | 34.1 | Very low | 126 Ų | 126 | 145.6 Ų | 145.6 | 65% | 0.646 | 75% | 0.75 | S | S | * | * | trans | -75.3 | 91.1 | 165.7 | -47.6 | 177.3 | 0 | 0 | 0 | 105.2 | N48 N52 | N48-I50 HydrophobicContact CB-CG1 4.31Å; N48-I50 PolarHBondContact O-N 2.76Å; N48-I50 VanDerWaalsContact O-N 3.07Å; I50-N52 WeakPolarHBondContact CG2-OD1 3.32Å; I50-N52 PolarHBondContact O-N 3.1Å | ||
| 51 | T | 31.1 | Very low | 33.9 | Very low | 112 Ų | 112 | 149.1 Ų | 149.1 | 69% | 0.687 | 76% | 0.757 | S | S | * | * | trans | -67.7 | 92.1 | 161.3 | 50.7 | 0 | 0 | 0 | 0 | 106.6 | V49 S53 | V49-T51 HydrophobicContact CG1-CG2 3.82Å; V49-T51 PolarHBondContact O-N 2.92Å; T51-S53 PolarHBondContact O-N 3.04Å | ||
| 52 | N | 32.7 | Very low | 33.4 | Very low | 120 Ų | 120 | 144.6 Ų | 144.6 | 64% | 0.642 | 75% | 0.75 | S | S | * | * | trans | -68.7 | 87.5 | 166.4 | -77.6 | -19.4 | 0 | 0 | 0 | 107.6 | I50 F54 | I50-N52 WeakPolarHBondContact CG2-OD1 3.32Å; I50-N52 PolarHBondContact O-N 3.1Å; N52-F54 HydrophobicContact CB-CD2 4.16Å; N52-F54 PolarHBondContact O-N 2.86Å | ||
| 53 | S | 30.4 | Very low | 33.2 | Very low | 106 Ų | 106 | 142.7 Ų | 142.7 | 74% | 0.741 | 75% | 0.745 | S | S | * | * | trans | -68.1 | 80.6 | 159.6 | 59.3 | 0 | 0 | 0 | 0 | 107.9 | T51 | T51-S53 PolarHBondContact O-N 3.04Š| ||
| 54 | F | 31.5 | Very low | 32.6 | Very low | 148 Ų | 148 | 144 Ų | 144 | 65% | 0.649 | 75% | 0.749 | S | S | * | * | trans | -134.7 | 46.1 | 174.6 | -80.2 | -77.6 | 0 | 0 | 0 | 110.7 | N52 H56 | N52-F54 HydrophobicContact CB-CD2 4.16Å; N52-F54 PolarHBondContact O-N 2.86Å; F54-H56 PolarHBondContact O-N 3.02Å | ||
| 55 | D | 36.2 | Very low | 32.6 | Very low | 157 Ų | 157 | 143.7 Ų | 143.7 | 84% | 0.84 | 75% | 0.753 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80.1 | 11.1 | 169.8 | -78.9 | -27.2 | 0 | 0 | 0 | 113.6 | ||
| 56 | H | 36.5 | Very low | 32.3 | Very low | 191 Ų | 191 | 139.9 Ų | 139.9 | 88% | 0.884 | 75% | 0.745 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -134.4 | 20.5 | 177.9 | -80.3 | -47 | 0 | 0 | 0 | 115.9 | F54 | F54-H56 PolarHBondContact O-N 3.02Š|
| 57 | L | 28.8 | Very low | 32.6 | Very low | 126 Ų | 126 | 139.4 Ų | 139.4 | 66% | 0.66 | 75% | 0.75 | S | S | * | * | trans | -144.3 | 45 | 174.3 | -129.7 | 114.6 | 0 | 0 | 0 | 113.5 | ||||
| 58 | A | 34.8 | Very low | 32.7 | Very low | 99 Ų | 99 | 140.1 Ų | 140.1 | 82% | 0.818 | 75% | 0.753 | S | S | * | * | trans | -84.4 | -7.2 | 172.8 | 0 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 59 | D | 37 | Very low | 32.6 | Very low | 150 Ų | 150 | 136.1 Ų | 136.1 | 80% | 0.802 | 75% | 0.747 | S | S | * | * | S | Bend | trans | -100.8 | 109.7 | 171.5 | -82.8 | -25.2 | 0 | 0 | 0 | 109.8 | ||
| 60 | K | 30.3 | Very low | 32.9 | Very low | 189 Ų | 189 | 138.6 Ų | 138.6 | 82% | 0.822 | 75% | 0.749 | S | S | * | * | S | Bend | trans | 91.7 | 81 | 175.1 | -52.3 | 176.3 | 179.1 | -170.4 | 0 | 116.2 | ||
| 61 | M | 30.5 | Very low | 33.1 | Very low | 179 Ų | 179 | 139.4 Ų | 139.4 | 88% | 0.882 | 75% | 0.754 | S | S | * | * | -158.2 | 106.6 | 121.8 | -93.2 | -131.5 | -93 | 0 | 0 | 108.9 | L63 | M61-L63 PolarHBondContact O-N 2.89Å; M61-L63 VanDerWaalsContact O-N 3.17Å | |||
| 62 | S | 28.3 | Very low | 33.5 | Very low | 104 Ų | 104 | 142.3 Ų | 142.3 | 73% | 0.727 | 76% | 0.76 | S | S | * | * | trans | -56 | 113.5 | 159 | -58.9 | 0 | 0 | 0 | 0 | 107.6 | D64 | S62-D64 VanDerWaalsContact C-N 3.26Å; S62-D64 PolarHBondContact O-N 3.46Å | ||
| 63 | L | 30.8 | Very low | 33.5 | Very low | 139 Ų | 139 | 142.8 Ų | 142.8 | 73% | 0.728 | 76% | 0.762 | S | S | * | * | trans | -75.7 | 87.5 | 170 | -144.4 | 88.8 | 0 | 0 | 0 | 106.7 | M61 F65 | M61-L63 PolarHBondContact O-N 2.89Å; M61-L63 VanDerWaalsContact O-N 3.17Å; L63-F65 HydrophobicContact CD2-CE1 4.4Å; L63-F65 HydrophobicContact CD2-CE2 4.43Å; L63-F65 HydrophobicContact CD2-CZ 4.04Å; L63-F65 PolarHBondContact O-N 3.47Å; L63-F65 VanDerWaalsContact O-N 3.11Å | ||
| 64 | D | 27.9 | Very low | 33.9 | Very low | 134 Ų | 134 | 142.6 Ų | 142.6 | 72% | 0.717 | 76% | 0.757 | S | S | * | * | trans | -67 | 107.2 | 171.9 | -79.3 | -23.9 | 0 | 0 | 0 | 108.3 | S62 T66 | S62-D64 VanDerWaalsContact C-N 3.26Å; S62-D64 PolarHBondContact O-N 3.46Å; D64-T66 PolarHBondContact O-N 3.45Å | ||
| 65 | F | 32.6 | Very low | 33.9 | Very low | 192 Ų | 192 | 142.5 Ų | 142.5 | 84% | 0.842 | 76% | 0.763 | S | S | * | * | trans | -71.1 | 78.1 | 165.9 | -68.8 | -84 | 0 | 0 | 0 | 108.5 | L63 | L63-F65 HydrophobicContact CD2-CE1 4.4Å; L63-F65 HydrophobicContact CD2-CE2 4.43Å; L63-F65 HydrophobicContact CD2-CZ 4.04Å; L63-F65 PolarHBondContact O-N 3.47Å; L63-F65 VanDerWaalsContact O-N 3.11Å | ||
| 66 | T | 30 | Very low | 33.7 | Very low | 103 Ų | 103 | 141.6 Ų | 141.6 | 63% | 0.632 | 76% | 0.757 | S | S | * | * | trans | -70.5 | 136.1 | 162.1 | 50.8 | 0 | 0 | 0 | 0 | 108.7 | D64 T68 | D64-T66 PolarHBondContact O-N 3.45Å; T66-T68 PolarHBondContact O-N 3.34Å | ||
| 67 | E | 38.7 | Very low | 33.3 | Very low | 177 Ų | 177 | 138.2 Ų | 138.2 | 83% | 0.827 | 75% | 0.75 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -55.2 | 13.7 | -167.4 | -163.1 | 171.7 | 170.5 | 0 | 0 | 117.5 | ||
| 68 | T | 38.4 | Very low | 33.2 | Very low | 125 Ų | 125 | 138 Ų | 138 | 77% | 0.767 | 76% | 0.759 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -117.8 | 16.8 | -176.1 | 52.1 | 0 | 0 | 0 | 0 | 114.8 | T66 | T66-T68 PolarHBondContact O-N 3.34Š|
| 69 | G | 31.5 | Very low | 32.8 | Very low | 66 Ų | 66 | 137.9 Ų | 137.9 | 68% | 0.68 | 75% | 0.752 | S | S | * | * | trans | -95.8 | 20.4 | -178.9 | 0 | 0 | 0 | 0 | 0 | 116.8 | ||||
| 70 | F | 38.1 | Very low | 32.6 | Very low | 167 Ų | 167 | 140.3 Ų | 140.3 | 73% | 0.732 | 76% | 0.756 | S | S | * | * | G | 310 helix | trans | -87.9 | 1.3 | -172.6 | -91.2 | -77 | 0 | 0 | 0 | 116.3 | E72 | F70-E72 PolarHBondContact O-N 2.73Š|
| 71 | D | 40 | Very low | 32.3 | Very low | 143 Ų | 143 | 134.5 Ų | 134.5 | 77% | 0.765 | 75% | 0.75 | S | S | * | * | G | 310 helix | trans | -87.4 | 2.1 | -176.6 | -71.4 | -23.8 | 0 | 0 | 0 | 115.3 | ||
| 72 | E | 38.6 | Very low | 32.1 | Very low | 174 Ų | 174 | 134 Ų | 134 | 81% | 0.813 | 75% | 0.75 | S | S | * | * | G | 310 helix | trans | -103.4 | -8.4 | 179.1 | -110.2 | -176.8 | 178.1 | 0 | 0 | 115.6 | F70 | F70-E72 PolarHBondContact O-N 2.73Š|
| 73 | L | 33 | Very low | 32 | Very low | 130 Ų | 130 | 134.3 Ų | 134.3 | 68% | 0.681 | 75% | 0.753 | S | S | * | * | S | Bend | trans | -103.9 | -0.8 | -178.7 | -68.5 | 177.6 | 0 | 0 | 0 | 115.1 | N75 I76 | L73-N75 VanDerWaalsContact C-N 3.29Å; L73-N75 PolarHBondContact O-N 3.34Å; L73-I76 HydrophobicContact CD2-CD1 4.3Å |
| 74 | T | 38.7 | Very low | 31.8 | Very low | 101 Ų | 101 | 135 Ų | 135 | 62% | 0.62 | 76% | 0.757 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81.9 | -1.7 | 173.4 | 31.4 | 0 | 0 | 0 | 0 | 114.2 | ||
| 75 | N | 30.7 | Very low | 31.8 | Very low | 146 Ų | 146 | 134.3 Ų | 134.3 | 78% | 0.781 | 76% | 0.763 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -106.6 | 25.7 | 178 | -72.2 | -33.9 | 0 | 0 | 0 | 114.8 | L73 | L73-N75 VanDerWaalsContact C-N 3.29Å; L73-N75 PolarHBondContact O-N 3.34Å |
| 76 | I | 31.8 | Very low | 31.6 | Very low | 138 Ų | 138 | 132.4 Ų | 132.4 | 71% | 0.708 | 76% | 0.76 | S | S | * | * | trans | -114.3 | 57.5 | 166.3 | -39.3 | 176.9 | 0 | 0 | 0 | 109.2 | L73 | L73-I76 HydrophobicContact CD2-CD1 4.3Š| ||
| 77 | T | 28.4 | Very low | 31.4 | Very low | 121 Ų | 121 | 132.8 Ų | 132.8 | 74% | 0.742 | 77% | 0.767 | S | S | * | * | S | Bend | trans | -137.8 | 116 | 161.1 | -20.8 | 0 | 0 | 0 | 0 | 106.4 | ||
| 78 | S | 27.9 | Very low | 31 | Very low | 122 Ų | 122 | 131.4 Ų | 131.4 | 85% | 0.853 | 76% | 0.763 | S | S | * | * | trans | 105.5 | 85.2 | 176.5 | 79 | 0 | 0 | 0 | 0 | 116.9 | ||||
| 79 | S | 26 | Very low | 30.5 | Very low | 96 Ų | 96 | 132.9 Ų | 132.9 | 67% | 0.671 | 77% | 0.766 | S | S | * | * | trans | -161.1 | 121.2 | 135.1 | -131.6 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 80 | F | 31.9 | Very low | 30.1 | Very low | 200 Ų | 200 | 140.6 Ų | 140.6 | 88% | 0.877 | 78% | 0.775 | S | S | * | * | trans | 73.4 | 113.5 | 170.7 | -50.4 | -76.3 | 0 | 0 | 0 | 115.6 | ||||
| 81 | G | 25.3 | Very low | 29.6 | Very low | 68 Ų | 68 | 140 Ų | 140 | 70% | 0.701 | 78% | 0.779 | S | S | * | * | cis | 100.4 | 107.5 | 30.1 | 0 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 82 | N | 26.3 | Very low | 29 | Very low | 167 Ų | 167 | 144.4 Ų | 144.4 | 89% | 0.893 | 79% | 0.785 | S | S | * | * | trans | -1.8 | 117.7 | 168.8 | -64.8 | -13.2 | 0 | 0 | 0 | 117.3 | ||||
| 83 | S | 26.3 | Very low | 28.3 | Very low | 111 Ų | 111 | 145.6 Ų | 145.6 | 78% | 0.776 | 78% | 0.783 | S | S | * | * | trans | -156.3 | 102.6 | 152.6 | -60.5 | 0 | 0 | 0 | 0 | 110 | ||||
| 84 | D | 26.1 | Very low | 28.2 | Very low | 155 Ų | 155 | 145.3 Ų | 145.3 | 83% | 0.829 | 79% | 0.789 | S | S | * | * | trans | 51.8 | 116.8 | 147.1 | -55.5 | -24.2 | 0 | 0 | 0 | 121.9 | I86 | D84-I86 PolarHBondContact O-N 2.96Š| ||
| 85 | S | 26.7 | Very low | 28 | Very low | 119 Ų | 119 | 145.4 Ų | 145.4 | 83% | 0.832 | 79% | 0.792 | S | S | * | * | trans | -46.9 | 111 | 166.3 | -45.5 | 0 | 0 | 0 | 0 | 113.2 | S87 | S85-S87 PolarHBondContact O-N 3.22Å; S85-S87 VanDerWaalsContact O-N 3.12Å | ||
| 86 | I | 29.4 | Very low | 28.1 | Very low | 151 Ų | 151 | 146.2 Ų | 146.2 | 77% | 0.774 | 80% | 0.796 | S | S | * | * | trans | -71.8 | 103.3 | 165.3 | -62.9 | 174.2 | 0 | 0 | 0 | 107.8 | D84 I88 | D84-I86 PolarHBondContact O-N 2.96Å; I86-I88 HydrophobicContact CG2-CD1 3.69Å; I86-I88 HydrophobicContact CG2-CG1 3.74Å | ||
| 87 | S | 25.3 | Very low | 27.9 | Very low | 111 Ų | 111 | 147.1 Ų | 147.1 | 78% | 0.776 | 80% | 0.802 | S | S | * | * | trans | -90.8 | 117.4 | 165.9 | 52.5 | 0 | 0 | 0 | 0 | 108.9 | S85 | S85-S87 PolarHBondContact O-N 3.22Å; S85-S87 VanDerWaalsContact O-N 3.12Å | ||
| 88 | I | 30.2 | Very low | 27.9 | Very low | 148 Ų | 148 | 145.6 Ų | 145.6 | 76% | 0.759 | 80% | 0.802 | S | S | * | * | trans | -127 | 99.9 | 171.1 | -62.1 | 176.7 | 0 | 0 | 0 | 110 | I86 | I86-I88 HydrophobicContact CG2-CD1 3.69Å; I86-I88 HydrophobicContact CG2-CG1 3.74Å | ||
| 89 | L | 27.9 | Very low | 28.3 | Very low | 157 Ų | 157 | 145.8 Ų | 145.8 | 82% | 0.822 | 80% | 0.8 | S | S | * | * | trans | 8.3 | 120.2 | 148.6 | -96.7 | 129.8 | 0 | 0 | 0 | 121 | ||||
| 90 | R | 23.3 | Very low | 28.6 | Very low | 228 Ų | 228 | 148.2 Ų | 148.2 | 86% | 0.86 | 81% | 0.811 | S | S | * | * | trans | -76.2 | 109.8 | 164.5 | -168.3 | 179.5 | -167.9 | 165 | 2.7 | 110.1 | ||||
| 91 | N | 27.8 | Very low | 28.4 | Very low | 154 Ų | 154 | 147.1 Ų | 147.1 | 82% | 0.824 | 81% | 0.809 | S | S | * | * | trans | -71.1 | 130.9 | 167.9 | -85.7 | -18.6 | 0 | 0 | 0 | 110.4 | ||||
| 92 | R | 27.8 | Very low | 28.5 | Very low | 236 Ų | 236 | 151.6 Ų | 151.6 | 89% | 0.891 | 82% | 0.817 | S | S | * | * | trans | -81.3 | 136.2 | 176.8 | -70.8 | 178 | 178.7 | 162.7 | -1 | 110.7 | ||||
| 93 | Y | 24.1 | Very low | 28.4 | Very low | 199 Ų | 199 | 150.6 Ų | 150.6 | 78% | 0.78 | 81% | 0.806 | S | S | * | * | trans | -3.5 | 161.2 | 153.8 | -65 | -87.2 | 0 | 0 | 0 | 121.4 | ||||
| 94 | P | 29.8 | Very low | 28.6 | Very low | 124 Ų | 124 | 155.5 Ų | 155.5 | 81% | 0.805 | 81% | 0.814 | S | S | * | * | -125.6 | 159.3 | 91.8 | 37.9 | -31.4 | 0 | 0 | 0 | 113.8 | |||||
| 95 | P | 34.7 | Very low | 28.5 | Very low | 103 Ų | 103 | 156.7 Ų | 156.7 | 67% | 0.669 | 81% | 0.808 | S | S | * | * | trans | -97.3 | 131.2 | -174 | 35.4 | -26.4 | 0 | 0 | 0 | 111.8 | ||||
| 96 | D | 32.2 | Very low | 28.4 | Very low | 162 Ų | 162 | 157 Ų | 157 | 87% | 0.866 | 81% | 0.809 | S | S | * | * | trans | -125.1 | 131.1 | 159.7 | -87.7 | -37.8 | 0 | 0 | 0 | 110 | ||||
| 97 | N | 28.3 | Very low | 28.2 | Very low | 157 Ų | 157 | 158.6 Ų | 158.6 | 84% | 0.84 | 81% | 0.811 | S | S | * | * | trans | -55 | 156.7 | 172.3 | -51.2 | -71 | 0 | 0 | 0 | 110.4 | ||||
| 98 | A | 28.3 | Very low | 28.4 | Very low | 89 Ų | 89 | 162.3 Ų | 162.3 | 74% | 0.736 | 82% | 0.816 | S | S | * | * | cis | -165.5 | 172 | 28.7 | 0 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 99 | P | 36.7 | Very low | 28.3 | Very low | 127 Ų | 127 | 160.8 Ų | 160.8 | 83% | 0.825 | 81% | 0.813 | S | S | * | * | trans | -96 | 136.5 | -148.4 | 35.9 | -32.5 | 0 | 0 | 0 | 114.6 | ||||
| 100 | T | 31.5 | Very low | 28.3 | Very low | 146 Ų | 146 | 160.8 Ų | 160.8 | 90% | 0.896 | 81% | 0.813 | S | S | * | * | trans | -103.7 | 109.9 | 155.2 | 3.2 | 0 | 0 | 0 | 0 | 109 | N102 | T100-N102 PolarHBondContact O-N 3.22Š| ||
| 101 | Q | 28.7 | Very low | 28.5 | Very low | 178 Ų | 178 | 159.4 Ų | 159.4 | 83% | 0.832 | 81% | 0.81 | S | S | * | * | trans | -56.6 | 106.7 | 172.5 | -176.2 | 172.1 | 5.2 | 0 | 0 | 110.4 | ||||
| 102 | N | 27.7 | Very low | 28.6 | Very low | 162 Ų | 162 | 159.1 Ų | 159.1 | 87% | 0.866 | 81% | 0.808 | S | S | * | * | trans | -139.7 | 108.1 | 152.6 | -111.4 | -23.4 | 0 | 0 | 0 | 109.3 | T100 F104 | T100-N102 PolarHBondContact O-N 3.22Å; N102-F104 PolarHBondContact O-N 2.96Å | ||
| 103 | Q | 24.6 | Very low | 28.7 | Very low | 145 Ų | 145 | 153.4 Ų | 153.4 | 68% | 0.678 | 80% | 0.799 | S | S | * | * | trans | -62.6 | 120 | 168.1 | -72.7 | 166.3 | -49.5 | 0 | 0 | 108.6 | ||||
| 104 | F | 28.7 | Very low | 29.1 | Very low | 214 Ų | 214 | 148.1 Ų | 148.1 | 94% | 0.939 | 79% | 0.791 | S | S | * | * | trans | -147.1 | 120.3 | 136.3 | -100.3 | -75.4 | 0 | 0 | 0 | 109.4 | N102 | N102-F104 PolarHBondContact O-N 2.96Š| ||
| 105 | Y | 24.2 | Very low | 29.2 | Very low | 181 Ų | 181 | 150.8 Ų | 150.8 | 71% | 0.71 | 79% | 0.793 | S | S | * | * | trans | -76.7 | 112.9 | -178.5 | -83.6 | -104.1 | 0 | 0 | 0 | 110.3 | ||||
| 106 | C | 24.5 | Very low | 29.2 | Very low | 125 Ų | 125 | 150.2 Ų | 150.2 | 85% | 0.845 | 80% | 0.796 | S | S | * | * | trans | -98.3 | 94.2 | 152.9 | -81.8 | 0 | 0 | 0 | 0 | 108.5 | Q108 | C106-Q108 PolarHBondContact O-N 3.47Š| ||
| 107 | K | 26.1 | Very low | 29.2 | Very low | 185 Ų | 185 | 149 Ų | 149 | 80% | 0.804 | 79% | 0.787 | S | S | * | * | trans | -66.4 | 109.5 | 161.8 | -68 | -178.3 | 176.8 | -178.4 | 0 | 107.7 | ||||
| 108 | Q | 29.2 | Very low | 29.5 | Very low | 189 Ų | 189 | 148.7 Ų | 148.7 | 88% | 0.883 | 78% | 0.781 | S | S | * | * | trans | -113.7 | 115.5 | 152.5 | -151.9 | 160.5 | 40.8 | 0 | 0 | 107.8 | C106 L110 | C106-Q108 PolarHBondContact O-N 3.47Å; Q108-L110 PolarHBondContact O-N 3.05Å; Q108-L110 VanDerWaalsContact O-N 3.16Å | ||
| 109 | T | 28.7 | Very low | 29.7 | Very low | 116 Ų | 116 | 151.6 Ų | 151.6 | 71% | 0.712 | 78% | 0.784 | S | S | * | * | trans | -61.2 | 105.1 | 178.8 | 45.1 | 0 | 0 | 0 | 0 | 109.7 | Y111 | T109-Y111 VanDerWaalsContact C-N 3.34Å; T109-Y111 PolarHBondContact O-N 3.26Å | ||
| 110 | L | 26.6 | Very low | 29.5 | Very low | 157 Ų | 157 | 151.7 Ų | 151.7 | 82% | 0.822 | 78% | 0.778 | S | S | * | * | trans | -84.1 | 85.9 | 156.8 | -161.9 | 111.3 | 0 | 0 | 0 | 106.4 | Q108 | Q108-L110 PolarHBondContact O-N 3.05Å; Q108-L110 VanDerWaalsContact O-N 3.16Å | ||
| 111 | Y | 27.9 | Very low | 29.9 | Very low | 199 Ų | 199 | 149.1 Ų | 149.1 | 78% | 0.78 | 76% | 0.761 | S | S | * | * | trans | -114 | 132.7 | 163.7 | -89.8 | -82.8 | 0 | 0 | 0 | 107.7 | T109 | T109-Y111 VanDerWaalsContact C-N 3.34Å; T109-Y111 PolarHBondContact O-N 3.26Å | ||
| 112 | D | 29.7 | Very low | 30.3 | Very low | 148 Ų | 148 | 147.6 Ų | 147.6 | 79% | 0.791 | 76% | 0.759 | S | S | * | * | S | Bend | trans | 75.6 | 67.7 | 167.4 | -62.8 | -14.1 | 0 | 0 | 0 | 120.4 | ||
| 113 | V | 30.7 | Very low | 30.6 | Very low | 116 Ų | 116 | 149 Ų | 149 | 70% | 0.703 | 76% | 0.757 | S | S | * | * | S | Bend | trans | -154.7 | 54.6 | 131.3 | -162.4 | 0 | 0 | 0 | 0 | 110.8 | ||
| 114 | S | 32.7 | Very low | 30.8 | Very low | 87 Ų | 87 | 150.5 Ų | 150.5 | 61% | 0.608 | 77% | 0.767 | S | S | * | * | S | Bend | trans | -122.5 | -10.3 | 170.7 | -59.9 | 0 | 0 | 0 | 0 | 114.8 | ||
| 115 | E | 32.4 | Very low | 30.8 | Very low | 181 Ų | 181 | 145 Ų | 145 | 85% | 0.846 | 75% | 0.754 | S | S | * | * | S | Bend | trans | -97.8 | -20.9 | -179.1 | -153.7 | 170.6 | -174.4 | 0 | 0 | 114.2 | ||
| 116 | A | 33.8 | Very low | 31 | Very low | 90 Ų | 90 | 144.2 Ų | 144.2 | 74% | 0.744 | 76% | 0.761 | S | S | * | * | S | Bend | trans | -80.8 | -20.7 | 177.8 | 0 | 0 | 0 | 0 | 0 | 113.9 | ||
| 117 | M | 32.6 | Very low | 31.2 | Very low | 137 Ų | 137 | 146.5 Ų | 146.5 | 68% | 0.675 | 77% | 0.765 | S | S | * | * | S | Bend | trans | -100.8 | -11.3 | -172.6 | -90.2 | -175.3 | 62.4 | 0 | 0 | 114.9 | N119 N120 | M117-N119 PolarHBondContact O-N 3.12Å; M117-N120 PolarHBondContact O-N 3.23Å |
| 118 | E | 34.8 | Very low | 31.2 | Very low | 150 Ų | 150 | 143.2 Ų | 143.2 | 70% | 0.701 | 77% | 0.765 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -68.8 | -17.9 | -180 | -142.1 | 172 | -172.1 | 0 | 0 | 112.6 | ||
| 119 | N | 31.5 | Very low | 31.2 | Very low | 151 Ų | 151 | 140.4 Ų | 140.4 | 81% | 0.807 | 76% | 0.76 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -96.4 | 5.2 | 180 | -83.4 | -27.3 | 0 | 0 | 0 | 116.6 | M117 | M117-N119 PolarHBondContact O-N 3.12Š|
| 120 | N | 32.2 | Very low | 31.1 | Very low | 129 Ų | 129 | 141.6 Ų | 141.6 | 69% | 0.69 | 76% | 0.762 | S | S | * | * | S | Bend | trans | -107.3 | 0.3 | 172 | -105.3 | -25.8 | 0 | 0 | 0 | 114.6 | M117 N122 | M117-N120 PolarHBondContact O-N 3.23Å; N120-N122 PolarHBondContact O-N 2.98Å |
| 121 | V | 41.2 | Very low | 31.3 | Very low | 91 Ų | 91 | 140.3 Ų | 140.3 | 55% | 0.552 | 76% | 0.761 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -68.7 | -17.4 | -178.6 | -176.4 | 0 | 0 | 0 | 0 | 112.7 | ||
| 122 | N | 36.2 | Very low | 31.2 | Very low | 146 Ų | 146 | 139 Ų | 139 | 78% | 0.781 | 76% | 0.762 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -93.5 | 7.6 | -175.3 | -66.7 | -21.1 | 0 | 0 | 0 | 115.9 | N120 | N120-N122 PolarHBondContact O-N 2.98Š|
| 123 | K | 34 | Very low | 31.1 | Very low | 192 Ų | 192 | 137.3 Ų | 137.3 | 84% | 0.835 | 76% | 0.761 | S | S | * | * | S | Bend | trans | -122.5 | 2.4 | 179.5 | -90.1 | -173.4 | 179 | 179.2 | 0 | 117.5 | ||
| 124 | M | 28.5 | Very low | 30.7 | Very low | 177 Ų | 177 | 139.9 Ų | 139.9 | 87% | 0.872 | 77% | 0.765 | S | S | * | * | S | Bend | trans | -127.1 | 6.5 | 174.9 | -88.3 | 178 | 54.4 | 0 | 0 | 115.6 | N126 | M124-N126 PolarHBondContact O-N 3.48Š|
| 125 | C | 29.3 | Very low | 30.6 | Very low | 99 Ų | 99 | 143.7 Ų | 143.7 | 67% | 0.669 | 78% | 0.777 | S | S | * | * | trans | -81.9 | 92.6 | 163.6 | -73 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 126 | N | 29.4 | Very low | 30.4 | Very low | 163 Ų | 163 | 145.2 Ų | 145.2 | 87% | 0.872 | 78% | 0.781 | S | S | * | * | trans | -179.3 | 42 | 145.6 | -89.4 | -22.1 | 0 | 0 | 0 | 113.1 | M124 | M124-N126 PolarHBondContact O-N 3.48Š| ||
| 127 | L | 26.9 | Very low | 30.2 | Very low | 174 Ų | 174 | 144 Ų | 144 | 91% | 0.911 | 78% | 0.777 | S | S | * | * | trans | -128.7 | 63.9 | 162 | -88.6 | 154.6 | 0 | 0 | 0 | 108.5 | ||||
| 128 | S | 26.3 | Very low | 30 | Very low | 116 Ų | 116 | 142.9 Ų | 142.9 | 81% | 0.811 | 78% | 0.783 | S | S | * | * | trans | -102.1 | 95.5 | 160.3 | -165.3 | 0 | 0 | 0 | 0 | 106.7 | ||||
| 129 | V | 29.3 | Very low | 29.7 | Very low | 129 Ų | 129 | 141.9 Ų | 141.9 | 78% | 0.782 | 79% | 0.791 | S | S | * | * | trans | -138.7 | 119 | 158.5 | 176.9 | 0 | 0 | 0 | 0 | 106.6 | T131 | V129-T131 PolarHBondContact O-N 3.01Š| ||
| 130 | D | 27.5 | Very low | 29.8 | Very low | 141 Ų | 141 | 142.9 Ų | 142.9 | 75% | 0.754 | 79% | 0.791 | S | S | * | * | trans | -45.4 | 125.6 | 175.2 | -64.4 | -62.6 | 0 | 0 | 0 | 112.8 | ||||
| 131 | T | 30.7 | Very low | 29.9 | Very low | 131 Ų | 131 | 142.3 Ų | 142.3 | 80% | 0.804 | 80% | 0.797 | S | S | * | * | trans | -122.8 | 90.5 | 148.5 | 48.1 | 0 | 0 | 0 | 0 | 108.1 | V129 C133 | V129-T131 PolarHBondContact O-N 3.01Å; T131-C133 PolarHBondContact O-N 3.13Å; T131-C133 VanDerWaalsContact O-N 3.12Å | ||
| 132 | E | 25 | Very low | 29.6 | Very low | 171 Ų | 171 | 144.3 Ų | 144.3 | 80% | 0.799 | 81% | 0.809 | S | S | * | * | trans | -55.7 | 103.7 | 156.7 | -76.8 | -179.6 | 137.7 | 0 | 0 | 109.1 | ||||
| 133 | C | 27.8 | Very low | 29.5 | Very low | 112 Ų | 112 | 142.4 Ų | 142.4 | 76% | 0.757 | 81% | 0.807 | S | S | * | * | trans | -103.4 | 93.9 | 161.5 | -85.5 | 0 | 0 | 0 | 0 | 108.5 | T131 L135 | T131-C133 PolarHBondContact O-N 3.13Å; T131-C133 VanDerWaalsContact O-N 3.12Å; C133-L135 PolarHBondContact O-N 2.99Å; C133-L135 VanDerWaalsContact O-N 3.11Å | ||
| 134 | H | 22.3 | Very low | 30 | Very low | 170 Ų | 170 | 142.7 Ų | 142.7 | 79% | 0.787 | 81% | 0.808 | S | S | * | * | trans | -55.2 | 104.3 | 163.3 | -97.6 | -85.2 | 0 | 0 | 0 | 110.4 | ||||
| 135 | L | 32 | Very low | 30.3 | Very low | 168 Ų | 168 | 143 Ų | 143 | 88% | 0.88 | 81% | 0.813 | S | S | * | * | trans | -123.3 | 100.4 | 161.7 | -85 | 165.3 | 0 | 0 | 0 | 110.1 | C133 G137 | C133-L135 PolarHBondContact O-N 2.99Å; C133-L135 VanDerWaalsContact O-N 3.11Å; L135-G137 PolarHBondContact O-N 3.02Å | ||
| 136 | K | 26.6 | Very low | 30.6 | Very low | 213 Ų | 213 | 146.9 Ų | 146.9 | 93% | 0.926 | 82% | 0.818 | S | S | * | * | trans | -74.7 | 100.3 | 176.1 | -163.6 | 174.7 | -174.5 | 180 | 0 | 107.8 | ||||
| 137 | G | 29.7 | Very low | 30.8 | Very low | 63 Ų | 63 | 145.2 Ų | 145.2 | 65% | 0.649 | 81% | 0.814 | S | S | * | * | trans | -143.4 | 102.5 | 177.8 | 0 | 0 | 0 | 0 | 0 | 110.6 | L135 C139 | L135-G137 PolarHBondContact O-N 3.02Å; G137-C139 PolarHBondContact O-N 3.03Å | ||
| 138 | S | 28.1 | Very low | 31.4 | Very low | 114 Ų | 114 | 143.6 Ų | 143.6 | 80% | 0.797 | 81% | 0.812 | S | S | * | * | trans | -64.3 | 108.4 | 175.6 | 170.2 | 0 | 0 | 0 | 0 | 110.1 | Q140 | S138-Q140 PolarHBondContact O-N 3.12Š| ||
| 139 | C | 29.8 | Very low | 31.9 | Very low | 129 Ų | 129 | 144 Ų | 144 | 87% | 0.872 | 81% | 0.805 | S | S | * | * | trans | -84.6 | 98.8 | 166.4 | -71.4 | 0 | 0 | 0 | 0 | 108.4 | G137 S141 | G137-C139 PolarHBondContact O-N 3.03Å; C139-S141 PolarHBondContact O-N 3.19Å | ||
| 140 | Q | 33 | Very low | 32.6 | Very low | 173 Ų | 173 | 145.6 Ų | 145.6 | 81% | 0.808 | 80% | 0.803 | S | S | * | * | trans | -62.4 | 124.6 | 164.2 | -82.3 | 175.2 | -11.9 | 0 | 0 | 108.8 | S138 V142 | S138-Q140 PolarHBondContact O-N 3.12Å; Q140-V142 PolarHBondContact O-N 3.24Å | ||
| 141 | S | 33.6 | Very low | 33 | Very low | 116 Ų | 116 | 146 Ų | 146 | 81% | 0.811 | 81% | 0.805 | S | S | * | * | trans | -60.4 | 121.8 | 174.5 | 40.9 | 0 | 0 | 0 | 0 | 110.4 | C139 S143 | C139-S141 PolarHBondContact O-N 3.19Å; S141-S143 PolarHBondContact O-N 3.25Å | ||
| 142 | V | 35 | Very low | 33.5 | Very low | 134 Ų | 134 | 145.3 Ų | 145.3 | 81% | 0.812 | 80% | 0.803 | S | S | * | * | trans | -71.2 | 110.1 | 175 | -167.2 | 0 | 0 | 0 | 0 | 107.5 | Q140 F144 | Q140-V142 PolarHBondContact O-N 3.24Å; V142-F144 PolarHBondContact O-N 3.47Å | ||
| 143 | S | 34.6 | Very low | 34 | Very low | 106 Ų | 106 | 146 Ų | 146 | 74% | 0.741 | 81% | 0.806 | S | S | * | * | trans | -66.7 | 126.8 | 177.2 | 62.2 | 0 | 0 | 0 | 0 | 110.4 | S141 L145 | S141-S143 PolarHBondContact O-N 3.25Å; S143-L145 PolarHBondContact O-N 3.25Å | ||
| 144 | F | 44.7 | Very low | 34.3 | Very low | 197 Ų | 197 | 149.2 Ų | 149.2 | 86% | 0.864 | 81% | 0.81 | S | S | * | * | trans | -59.1 | 131.6 | 169.1 | -67.6 | -86.6 | 0 | 0 | 0 | 110.5 | V142 K146 | V142-F144 PolarHBondContact O-N 3.47Å; F144-K146 PolarHBondContact O-N 3.07Å | ||
| 145 | L | 35.7 | Very low | 35.1 | Very low | 183 Ų | 183 | 147 Ų | 147 | 96% | 0.958 | 81% | 0.811 | S | S | * | * | trans | -50.7 | 107.1 | 172.4 | -81.7 | 136.7 | 0 | 0 | 0 | 109.8 | S143 | S143-L145 PolarHBondContact O-N 3.25Š| ||
| 146 | K | 33.9 | Very low | 35.3 | Very low | 181 Ų | 181 | 147 Ų | 147 | 79% | 0.787 | 81% | 0.81 | S | S | * | * | trans | -88.5 | 116.7 | 177.8 | -164.5 | 172.2 | -179.8 | 177 | 0 | 107.9 | F144 | F144-K146 PolarHBondContact O-N 3.07Š| ||
| 147 | T | 33.8 | Very low | 35.5 | Very low | 129 Ų | 129 | 142.4 Ų | 142.4 | 79% | 0.791 | 80% | 0.803 | S | S | * | * | trans | -71 | 131.6 | 172.3 | 45.4 | 0 | 0 | 0 | 0 | 109.9 | D149 | T147-D149 PolarHBondContact O-N 3.38Å; T147-D149 VanDerWaalsContact O-N 3.1Å | ||
| 148 | T | 40.5 | Very low | 35.6 | Very low | 140 Ų | 140 | 145.2 Ų | 145.2 | 86% | 0.859 | 81% | 0.812 | S | S | * | * | S | Bend | trans | -80.5 | 79.5 | -172.9 | -45.3 | 0 | 0 | 0 | 0 | 111.1 | ||
| 149 | D | 37.4 | Very low | 35.7 | Very low | 125 Ų | 125 | 146.1 Ų | 146.1 | 67% | 0.668 | 82% | 0.817 | S | S | * | * | trans | 175.2 | 102.8 | 159.4 | -114.4 | -29.7 | 0 | 0 | 0 | 104.2 | T147 | T147-D149 PolarHBondContact O-N 3.38Å; T147-D149 VanDerWaalsContact O-N 3.1Å | ||
| 150 | H | 42.7 | Very low | 35.6 | Very low | 161 Ų | 161 | 142.6 Ų | 142.6 | 75% | 0.745 | 80% | 0.803 | S | S | * | * | cis | -151.5 | 126.4 | 48.2 | -48.7 | -71.4 | 0 | 0 | 0 | 106.6 | P152 | H150-P152 WeakPolarHBondContact O-CD 3.11Š| ||
| 151 | L | 37 | Very low | 35.9 | Very low | 149 Ų | 149 | 140.1 Ų | 140.1 | 78% | 0.78 | 80% | 0.802 | S | S | * | * | trans | -70.7 | 125.3 | 169.4 | -69.6 | 174.5 | 0 | 0 | 0 | 107.8 | Q153 | L151-Q153 PolarHBondContact O-N 2.84Š| ||
| 152 | P | 40.1 | Very low | 36 | Very low | 118 Ų | 118 | 141.5 Ų | 141.5 | 77% | 0.766 | 81% | 0.805 | S | S | * | * | trans | -62.8 | 112.7 | 164.5 | 24.3 | -28.9 | 0 | 0 | 0 | 107.4 | H150 Q154 | H150-P152 WeakPolarHBondContact O-CD 3.11Å; P152-Q154 PolarHBondContact O-N 3.35Å | ||
| 153 | Q | 35.1 | Very low | 35.6 | Very low | 184 Ų | 184 | 144.6 Ų | 144.6 | 86% | 0.86 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -57.1 | 122.5 | 170 | -75.3 | -176.2 | -7.5 | 0 | 0 | 107.8 | L151 | L151-Q153 PolarHBondContact O-N 2.84Š|
| 154 | Q | 35 | Very low | 35.1 | Very low | 180 Ų | 180 | 144.5 Ų | 144.5 | 84% | 0.841 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -57.4 | 131.2 | 167.9 | -84.2 | -168.8 | -41.7 | 0 | 0 | 108.5 | P152 L156 | P152-Q154 PolarHBondContact O-N 3.35Å; Q154-L156 PolarHBondContact O-N 3.1Å; Q154-L156 VanDerWaalsContact O-N 3.14Å |
| 155 | P | 38.3 | Very low | 34.2 | Very low | 125 Ų | 125 | 139.3 Ų | 139.3 | 81% | 0.812 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -57.8 | 120.2 | 172.1 | -21.2 | 31.8 | 0 | 0 | 0 | 109.3 | ||
| 156 | L | 37.4 | Very low | 33.7 | Very low | 166 Ų | 166 | 139.3 Ų | 139.3 | 87% | 0.869 | 78% | 0.783 | S | S | * | * | P | Polyproline II helix | trans | -54.1 | 135.6 | 170.9 | -79.5 | 149.8 | 0 | 0 | 0 | 109 | Q154 S158 | Q154-L156 PolarHBondContact O-N 3.1Å; Q154-L156 VanDerWaalsContact O-N 3.14Å; L156-S158 PolarHBondContact O-N 3.04Å |
| 157 | P | 31.3 | Very low | 33.6 | Very low | 118 Ų | 118 | 138.4 Ų | 138.4 | 77% | 0.766 | 79% | 0.787 | S | S | * | * | P | Polyproline II helix | trans | -63.3 | 131.1 | -172.4 | 23.4 | -31.6 | 0 | 0 | 0 | 111.6 | C159 | P157-C159 PolarHBondContact O-N 2.88Å; P157-C159 VanDerWaalsContact O-N 3.11Å |
| 158 | S | 29.9 | Very low | 33 | Very low | 121 Ų | 121 | 138.2 Ų | 138.2 | 85% | 0.846 | 79% | 0.79 | S | S | * | * | trans | -41.2 | 105.6 | 167.8 | -179.2 | 0 | 0 | 0 | 0 | 112.8 | L156 | L156-S158 PolarHBondContact O-N 3.04Š| ||
| 159 | C | 31.8 | Very low | 32.6 | Very low | 133 Ų | 133 | 137.4 Ų | 137.4 | 90% | 0.899 | 79% | 0.787 | S | S | * | * | trans | -94.9 | 109.5 | 143.9 | -88.6 | 0 | 0 | 0 | 0 | 104.6 | P157 | P157-C159 PolarHBondContact O-N 2.88Å; P157-C159 VanDerWaalsContact O-N 3.11Å | ||
| 160 | G | 26.2 | Very low | 32.1 | Very low | 56 Ų | 56 | 136.1 Ų | 136.1 | 58% | 0.577 | 79% | 0.788 | S | S | * | * | 112.6 | 125.2 | 55.5 | 0 | 0 | 0 | 0 | 0 | 107 | |||||
| 161 | P | 39.2 | Very low | 31.5 | Very low | 120 Ų | 120 | 135.9 Ų | 135.9 | 78% | 0.779 | 79% | 0.792 | S | S | * | * | trans | -88 | 130.7 | -161.6 | 33.7 | -32.3 | 0 | 0 | 0 | 112 | ||||
| 162 | V | 36.1 | Very low | 31.2 | Very low | 145 Ų | 145 | 133 Ų | 133 | 88% | 0.879 | 79% | 0.789 | S | S | * | * | trans | -119 | 89.3 | 163.7 | -173.2 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 163 | Y | 27.9 | Very low | 30.6 | Very low | 199 Ų | 199 | 136.6 Ų | 136.6 | 78% | 0.78 | 79% | 0.793 | S | S | * | * | trans | 14.6 | 126.5 | 139 | -89.5 | -91.6 | 0 | 0 | 0 | 118.9 | ||||
| 164 | S | 23.1 | Very low | 30.2 | Very low | 104 Ų | 104 | 133 Ų | 133 | 73% | 0.727 | 79% | 0.788 | S | S | * | * | 83.1 | 115.8 | 126.3 | -84.1 | 0 | 0 | 0 | 0 | 121.1 | |||||
| 165 | S | 25.9 | Very low | 30.2 | Very low | 89 Ų | 89 | 129.7 Ų | 129.7 | 62% | 0.622 | 79% | 0.785 | S | S | * | * | 89 | 111.8 | 115.7 | -174.5 | 0 | 0 | 0 | 0 | 117.9 | |||||
| 166 | K | 26.1 | Very low | 29.8 | Very low | 183 Ų | 183 | 128.8 Ų | 128.8 | 80% | 0.796 | 78% | 0.781 | S | S | * | * | trans | 54.9 | 103 | 139 | -62.7 | 177 | 179.9 | -179.5 | 0 | 115.5 | ||||
| 167 | N | 30.9 | Very low | 29.6 | Very low | 162 Ų | 162 | 127.1 Ų | 127.1 | 87% | 0.866 | 77% | 0.773 | S | S | * | * | trans | -151.6 | 97.1 | 136.4 | -84.4 | -39.7 | 0 | 0 | 0 | 108.5 | ||||
| 168 | C | 21.2 | Very low | 29.8 | Very low | 125 Ų | 125 | 129.5 Ų | 129.5 | 85% | 0.845 | 77% | 0.774 | S | S | * | * | trans | -73.6 | 134.6 | 146.2 | -62 | 0 | 0 | 0 | 0 | 107.2 | ||||
| 169 | P | 31.7 | Very low | 30.1 | Very low | 122 Ų | 122 | 131.3 Ų | 131.3 | 79% | 0.792 | 77% | 0.774 | S | S | * | * | trans | -108.9 | 107.3 | 141 | 24.4 | -9.1 | 0 | 0 | 0 | 107.6 | ||||
| 170 | S | 27 | Very low | 30.5 | Very low | 99 Ų | 99 | 130.2 Ų | 130.2 | 69% | 0.692 | 77% | 0.766 | S | S | * | * | trans | -56 | 125.7 | 145.7 | 41.4 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 171 | D | 30.7 | Very low | 30.9 | Very low | 155 Ų | 155 | 139.1 Ų | 139.1 | 83% | 0.829 | 78% | 0.782 | S | S | * | * | -177.2 | 120 | 129.6 | -88.6 | -27.1 | 0 | 0 | 0 | 112.7 | |||||
| 172 | A | 29.9 | Very low | 30.6 | Very low | 88 Ų | 88 | 141.9 Ų | 141.9 | 73% | 0.727 | 79% | 0.785 | S | S | * | * | trans | 65.5 | 119.2 | 131.2 | 0 | 0 | 0 | 0 | 0 | 121.9 | ||||
| 173 | K | 27.8 | Very low | 30.8 | Very low | 194 Ų | 194 | 142.2 Ų | 142.2 | 84% | 0.843 | 78% | 0.78 | S | S | * | * | trans | 90.8 | 102.8 | 136.9 | -77 | -175.7 | 174.3 | -177.5 | 0 | 120.5 | ||||
| 174 | S | 26.4 | Very low | 31.4 | Very low | 109 Ų | 109 | 138 Ų | 138 | 76% | 0.762 | 78% | 0.778 | S | S | * | * | 54.5 | 108.6 | 120.7 | 77.1 | 0 | 0 | 0 | 0 | 120.4 | |||||
| 175 | S | 35 | Very low | 31.9 | Very low | 110 Ų | 110 | 138.3 Ų | 138.3 | 77% | 0.769 | 78% | 0.775 | S | S | * | * | -160 | 101.4 | 124.4 | 60.4 | 0 | 0 | 0 | 0 | 105.5 | |||||
| 176 | S | 30.1 | Very low | 32.4 | Very low | 106 Ų | 106 | 143.7 Ų | 143.7 | 74% | 0.741 | 78% | 0.783 | S | S | * | * | 12.7 | 91.7 | 93.2 | -170 | 0 | 0 | 0 | 0 | 111.9 | |||||
| 177 | D | 34.3 | Very low | 32.8 | Very low | 131 Ų | 131 | 139 Ų | 139 | 70% | 0.701 | 77% | 0.774 | S | S | * | * | 179 | 139.6 | 119.2 | -84.9 | -11.7 | 0 | 0 | 0 | 109.7 | |||||
| 178 | Q | 35.6 | Very low | 32.9 | Very low | 169 Ų | 169 | 141.1 Ų | 141.1 | 79% | 0.79 | 78% | 0.776 | S | S | * | * | trans | 77.6 | 70 | 172.1 | -44.7 | -61.2 | -55.1 | 0 | 0 | 115.4 | ||||
| 179 | D | 34.3 | Very low | 33.6 | Very low | 158 Ų | 158 | 140.2 Ų | 140.2 | 85% | 0.845 | 77% | 0.766 | S | S | * | * | trans | -51.8 | 126.7 | 141.8 | -94.8 | -41.6 | 0 | 0 | 0 | 107.9 | R181 | D179-R181 PolarHBondContact O-N 2.84Š| ||
| 180 | P | 41.4 | Very low | 33.8 | Very low | 110 Ų | 110 | 142.3 Ų | 142.3 | 71% | 0.714 | 77% | 0.765 | S | S | * | * | trans | -61.4 | 126.3 | 178.5 | 24.1 | -30.6 | 0 | 0 | 0 | 108.1 | E182 | P180-E182 PolarHBondContact O-N 2.89Š| ||
| 181 | R | 33.9 | Very low | 34.2 | Very low | 243 Ų | 243 | 143.8 Ų | 143.8 | 92% | 0.917 | 78% | 0.776 | S | S | * | * | trans | -37.5 | 114.6 | 173.1 | -87 | -152.5 | -100.1 | -176.4 | -8.5 | 110 | D179 L183 | D179-R181 PolarHBondContact O-N 2.84Å; R181-L183 PolarHBondContact O-N 3.19Å | ||
| 182 | E | 33.9 | Very low | 34.6 | Very low | 179 Ų | 179 | 144.8 Ų | 144.8 | 84% | 0.836 | 78% | 0.775 | S | S | * | * | trans | -55.3 | 110.4 | 167.6 | -65.6 | -171.6 | 168.5 | 0 | 0 | 107.6 | P180 | P180-E182 PolarHBondContact O-N 2.89Š| ||
| 183 | L | 40.1 | Very low | 35 | Very low | 151 Ų | 151 | 145.1 Ų | 145.1 | 79% | 0.791 | 77% | 0.772 | S | S | * | * | trans | -61.4 | 147.8 | 161.8 | -75.9 | 164.8 | 0 | 0 | 0 | 107.5 | R181 T185 | R181-L183 PolarHBondContact O-N 3.19Å; L183-T185 PolarHBondContact O-N 2.83Å | ||
| 184 | P | 39.7 | Very low | 35.6 | Very low | 112 Ų | 112 | 144 Ų | 144 | 73% | 0.727 | 78% | 0.775 | S | S | * | * | trans | -51.2 | 112 | -176 | -23.8 | 31.9 | 0 | 0 | 0 | 110.5 | Y186 | P184-Y186 VanDerWaalsContact C-N 3.28Å; P184-Y186 PolarHBondContact O-N 3.05Å | ||
| 185 | T | 33.2 | Very low | 36.1 | Very low | 110 Ų | 110 | 142.3 Ų | 142.3 | 68% | 0.675 | 76% | 0.763 | S | S | * | * | trans | -60 | 97 | 168.2 | -55.7 | 0 | 0 | 0 | 0 | 106.5 | L183 S187 | L183-T185 PolarHBondContact O-N 2.83Å; T185-S187 VanDerWaalsContact C-N 3.3Å; T185-S187 PolarHBondContact O-N 3.01Å | ||
| 186 | Y | 37.6 | Very low | 36.2 | Very low | 201 Ų | 201 | 144.4 Ų | 144.4 | 79% | 0.788 | 76% | 0.764 | S | S | * | * | trans | -63 | 104.4 | 159.9 | -107 | -88.8 | 0 | 0 | 0 | 105.4 | P184 F188 | P184-Y186 VanDerWaalsContact C-N 3.28Å; P184-Y186 PolarHBondContact O-N 3.05Å; Y186-F188 VanDerWaalsContact C-N 3.28Å; Y186-F188 PolarHBondContact O-N 2.95Å | ||
| 187 | S | 35.2 | Very low | 36.8 | Very low | 86 Ų | 86 | 143.8 Ų | 143.8 | 60% | 0.601 | 76% | 0.76 | S | S | * | * | trans | -53.4 | 99.5 | 164 | -57.7 | 0 | 0 | 0 | 0 | 107.3 | T185 T189 | T185-S187 VanDerWaalsContact C-N 3.3Å; T185-S187 PolarHBondContact O-N 3.01Å; S187-T189 PolarHBondContact O-N 2.85Å | ||
| 188 | F | 33.1 | Very low | 37.2 | Very low | 205 Ų | 205 | 143 Ų | 143 | 90% | 0.899 | 77% | 0.765 | S | S | * | * | trans | -71.7 | 65.2 | 163.7 | -107.6 | -89.4 | 0 | 0 | 0 | 107.4 | Y186 H190 | Y186-F188 VanDerWaalsContact C-N 3.28Å; Y186-F188 PolarHBondContact O-N 2.95Å; F188-H190 PolarHBondContact O-N 3.25Å | ||
| 189 | T | 34.5 | Very low | 37.4 | Very low | 106 Ų | 106 | 141.6 Ų | 141.6 | 65% | 0.65 | 76% | 0.762 | S | S | * | * | trans | -84.2 | 102.5 | 168.1 | 46.1 | 0 | 0 | 0 | 0 | 107.7 | S187 | S187-T189 PolarHBondContact O-N 2.85Š| ||
| 190 | H | 35.9 | Very low | 37.8 | Very low | 167 Ų | 167 | 139.7 Ų | 139.7 | 77% | 0.773 | 76% | 0.756 | S | S | * | * | trans | 51.9 | 117.3 | 149.2 | -59.4 | -73.1 | 0 | 0 | 0 | 118.2 | F188 E192 | F188-H190 PolarHBondContact O-N 3.25Å; H190-E192 VanDerWaalsContact C-N 3.26Å; H190-E192 PolarHBondContact O-N 3.33Å | ||
| 191 | S | 35.9 | Very low | 37.6 | Very low | 130 Ų | 130 | 141.8 Ų | 141.8 | 91% | 0.909 | 76% | 0.761 | S | S | * | * | trans | -34.6 | 85.4 | 150.2 | -47.4 | 0 | 0 | 0 | 0 | 112.4 | S193 | S191-S193 VanDerWaalsContact C-N 3.34Å; S191-S193 PolarHBondContact O-N 3.28Å; S191-S193 VanDerWaalsContact O-N 3.09Å | ||
| 192 | E | 38.3 | Very low | 37.7 | Very low | 176 Ų | 176 | 138.2 Ų | 138.2 | 82% | 0.822 | 76% | 0.76 | S | S | * | * | trans | -67 | 104 | 153.6 | -77.6 | -177.1 | 167.9 | 0 | 0 | 105.6 | H190 L194 | H190-E192 VanDerWaalsContact C-N 3.26Å; H190-E192 PolarHBondContact O-N 3.33Å; E192-L194 PolarHBondContact O-N 3.17Å | ||
| 193 | S | 39.5 | Very low | 37.8 | Very low | 95 Ų | 95 | 134.7 Ų | 134.7 | 66% | 0.664 | 76% | 0.755 | S | S | * | * | trans | -39.2 | 110 | 163.9 | 48.3 | 0 | 0 | 0 | 0 | 109.7 | S191 S195 | S191-S193 VanDerWaalsContact C-N 3.34Å; S191-S193 PolarHBondContact O-N 3.28Å; S191-S193 VanDerWaalsContact O-N 3.09Å; S193-S195 PolarHBondContact O-N 2.74Å | ||
| 194 | L | 40.8 | Very low | 37.7 | Very low | 170 Ų | 170 | 132.8 Ų | 132.8 | 89% | 0.89 | 75% | 0.753 | S | S | * | * | trans | -64.1 | 83.8 | 164.3 | -66.4 | 174.3 | 0 | 0 | 0 | 107.2 | E192 L196 | E192-L194 PolarHBondContact O-N 3.17Å; L194-L196 PolarHBondContact O-N 2.96Å | ||
| 195 | S | 35.5 | Very low | 37.5 | Very low | 74 Ų | 74 | 135 Ų | 135 | 52% | 0.517 | 76% | 0.758 | S | S | . | * | trans | -69.1 | 120.6 | 176.6 | -68 | 0 | 0 | 0 | 0 | 108.6 | S193 S197 | S193-S195 PolarHBondContact O-N 2.74Å; S195-S197 PolarHBondContact O-N 3.43Å | ||
| 196 | L | 38.7 | Very low | 37.7 | Very low | 153 Ų | 153 | 137.8 Ų | 137.8 | 80% | 0.801 | 77% | 0.769 | S | S | * | * | G | 310 helix | trans | -68.6 | 14.8 | 179.3 | -67.1 | 170.7 | 0 | 0 | 0 | 114.2 | L194 S198 | L194-L196 PolarHBondContact O-N 2.96Å; L196-S198 PolarHBondContact O-N 3.23Å |
| 197 | S | 40.7 | Very low | 37.7 | Very low | 94 Ų | 94 | 132.6 Ų | 132.6 | 66% | 0.657 | 76% | 0.762 | S | S | * | * | G | 310 helix | trans | -76.3 | -5.7 | -177.4 | -45.3 | 0 | 0 | 0 | 0 | 113.7 | S195 L199 | S195-S197 PolarHBondContact O-N 3.43Å; S197-L199 VanDerWaalsContact C-N 3.28Å; S197-L199 PolarHBondContact O-N 3.03Å |
| 198 | S | 42.9 | Very low | 37.6 | Very low | 113 Ų | 113 | 135.7 Ų | 135.7 | 79% | 0.79 | 77% | 0.771 | S | S | * | * | G | 310 helix | trans | -81.7 | 3.1 | -179.3 | -43.9 | 0 | 0 | 0 | 0 | 114.6 | L196 | L196-S198 PolarHBondContact O-N 3.23Š|
| 199 | L | 41.6 | Very low | 37.7 | Very low | 140 Ų | 140 | 132.7 Ų | 132.7 | 73% | 0.733 | 77% | 0.77 | S | S | * | * | G | 310 helix | trans | -105.2 | 10.4 | -173.3 | -74.5 | 174 | 0 | 0 | 0 | 115.4 | S197 | S197-L199 VanDerWaalsContact C-N 3.28Å; S197-L199 PolarHBondContact O-N 3.03Å |
| 200 | T | 41.2 | Very low | 37.7 | Very low | 118 Ų | 118 | 133.6 Ų | 133.6 | 72% | 0.724 | 78% | 0.776 | S | S | * | * | trans | -111.9 | 7 | -172.8 | 40.1 | 0 | 0 | 0 | 0 | 117.6 | L202 | T200-L202 PolarHBondContact O-N 3.01Å; T200-L202 VanDerWaalsContact O-N 3.17Å | ||
| 201 | D | 37.5 | Very low | 37.7 | Very low | 154 Ų | 154 | 130.7 Ų | 130.7 | 82% | 0.824 | 77% | 0.774 | S | S | * | * | trans | -89.1 | 76.7 | 173.5 | -73.9 | -19.7 | 0 | 0 | 0 | 111.9 | ||||
| 202 | L | 36.1 | Very low | 37.6 | Very low | 168 Ų | 168 | 133.7 Ų | 133.7 | 88% | 0.88 | 77% | 0.771 | S | S | * | * | trans | -114.7 | 38.4 | 172.3 | -70.1 | 177.3 | 0 | 0 | 0 | 112.6 | T200 | T200-L202 PolarHBondContact O-N 3.01Å; T200-L202 VanDerWaalsContact O-N 3.17Å | ||
| 203 | S | 36.4 | Very low | 37.4 | Very low | 105 Ų | 105 | 131 Ų | 131 | 73% | 0.734 | 77% | 0.77 | S | S | * | * | trans | -98.8 | 7 | -179.8 | 60.3 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 204 | C | 37.7 | Very low | 37.1 | Very low | 111 Ų | 111 | 133.9 Ų | 133.9 | 75% | 0.75 | 78% | 0.779 | S | S | * | * | trans | -132.1 | 51.3 | -170.8 | -57.9 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 205 | L | 36.1 | Very low | 37.4 | Very low | 160 Ų | 160 | 131.1 Ų | 131.1 | 84% | 0.838 | 77% | 0.771 | S | S | * | * | trans | -129.6 | 93 | 166.9 | -127.9 | 78.8 | 0 | 0 | 0 | 111 | S207 | L205-S207 PolarHBondContact O-N 3.32Š| ||
| 206 | D | 36.2 | Very low | 37.4 | Very low | 168 Ų | 168 | 130.3 Ų | 130.3 | 90% | 0.898 | 77% | 0.774 | S | S | * | * | trans | -66.6 | 126 | 173.6 | -148.3 | 0.1 | 0 | 0 | 0 | 109.2 | ||||
| 207 | S | 38.9 | Very low | 37.5 | Very low | 91 Ų | 91 | 130.8 Ų | 130.8 | 64% | 0.636 | 78% | 0.777 | S | S | * | * | S | Bend | trans | -79.3 | 120.5 | 179 | -57.2 | 0 | 0 | 0 | 0 | 107.6 | L205 | L205-S207 PolarHBondContact O-N 3.32Š|
| 208 | N | 32.6 | Very low | 37.6 | Very low | 151 Ų | 151 | 130.3 Ų | 130.3 | 81% | 0.807 | 78% | 0.78 | S | S | * | * | trans | 154.2 | 44.1 | 146.8 | -72.8 | -20.9 | 0 | 0 | 0 | 116.2 | ||||
| 209 | T | 36 | Very low | 37.7 | Very low | 142 Ų | 142 | 131.3 Ų | 131.3 | 87% | 0.871 | 78% | 0.781 | S | S | * | * | trans | -126.2 | 77.4 | 161.1 | 42.7 | 0 | 0 | 0 | 0 | 111.7 | S211 | T209-S211 PolarHBondContact O-N 3.4Š| ||
| 210 | T | 33.1 | Very low | 38.1 | Very low | 126 Ų | 126 | 131.1 Ų | 131.1 | 77% | 0.773 | 78% | 0.78 | S | S | * | * | trans | -56.7 | 106.1 | 159.4 | 45.6 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 211 | S | 36 | Very low | 38.2 | Very low | 105 Ų | 105 | 131.6 Ų | 131.6 | 73% | 0.734 | 78% | 0.778 | S | S | * | * | trans | -130.6 | 98.9 | 160.5 | 172.2 | 0 | 0 | 0 | 0 | 108.4 | T209 C213 | T209-S211 PolarHBondContact O-N 3.4Å; S211-C213 PolarHBondContact O-N 3.36Å | ||
| 212 | F | 33.6 | Very low | 38.8 | Very low | 193 Ų | 193 | 132.5 Ų | 132.5 | 85% | 0.846 | 78% | 0.775 | S | S | * | * | P | Polyproline II helix | trans | -58.9 | 123.1 | 174.7 | -78.5 | -103.2 | 0 | 0 | 0 | 111.2 | ||
| 213 | C | 35.4 | Very low | 39.3 | Very low | 120 Ų | 120 | 129.4 Ų | 129.4 | 81% | 0.811 | 77% | 0.767 | S | S | * | * | P | Polyproline II helix | trans | -101.2 | 123.8 | 165.8 | -73.5 | 0 | 0 | 0 | 0 | 109.7 | S211 | S211-C213 PolarHBondContact O-N 3.36Š|
| 214 | N | 32.9 | Very low | 39.7 | Very low | 156 Ų | 156 | 132 Ų | 132 | 83% | 0.834 | 77% | 0.768 | S | S | * | * | P | Polyproline II helix | trans | -60.3 | 142.8 | 178.6 | -89 | -46.7 | 0 | 0 | 0 | 112.3 | G216 | N214-G216 VanDerWaalsContact C-N 3.32Å; N214-G216 PolarHBondContact O-N 2.95Å |
| 215 | P | 47.2 | Very low | 40 | Very low | 111 Ų | 111 | 131.5 Ų | 131.5 | 72% | 0.721 | 76% | 0.764 | S | S | * | * | S | Bend | trans | -88.8 | 59.3 | -170.3 | 37 | -35.5 | 0 | 0 | 0 | 112.6 | ||
| 216 | G | 35.4 | Very low | 40.8 | Very low | 58 Ų | 58 | 129.5 Ų | 129.5 | 60% | 0.598 | 76% | 0.758 | S | S | * | * | S | Bend | trans | -99.2 | -47.1 | -178.2 | 0 | 0 | 0 | 0 | 0 | 115.7 | N214 | N214-G216 VanDerWaalsContact C-N 3.32Å; N214-G216 PolarHBondContact O-N 2.95Å |
| 217 | D | 40.1 | Very low | 41.6 | Very low | 162 Ų | 162 | 128.8 Ų | 128.8 | 87% | 0.866 | 75% | 0.747 | S | S | * | * | S | Bend | trans | -143.9 | 27.3 | -161.9 | -75.6 | -46 | 0 | 0 | 0 | 114.8 | T219 | D217-T219 PolarHBondContact O-N 2.96Š|
| 218 | A | 43.9 | Very low | 42.3 | Very low | 85 Ų | 85 | 130.9 Ų | 130.9 | 70% | 0.702 | 75% | 0.751 | S | S | * | * | trans | -93.4 | 91.7 | -180 | 0 | 0 | 0 | 0 | 0 | 111.3 | L220 | A218-L220 PolarHBondContact O-N 2.9Š| ||
| 219 | T | 44.1 | Very low | 44 | Very low | 134 Ų | 134 | 127.7 Ų | 127.7 | 82% | 0.822 | 74% | 0.737 | S | S | * | * | trans | -38.9 | 106.2 | 151.2 | -44.4 | 0 | 0 | 0 | 0 | 108.3 | D217 N221 | D217-T219 PolarHBondContact O-N 2.96Å; T219-N221 PolarHBondContact O-N 3.46Å | ||
| 220 | L | 49.4 | Very low | 45.8 | Very low | 135 Ų | 135 | 126.3 Ų | 126.3 | 71% | 0.707 | 73% | 0.728 | S | S | * | * | trans | -63.9 | 95.6 | -174.3 | -72.6 | 170.8 | 0 | 0 | 0 | 109.3 | A218 F222 | A218-L220 PolarHBondContact O-N 2.9Å; L220-F222 HydrophobicContact CB-CE2 4.4Å; L220-F222 HydrophobicContact CB-CZ 4.4Å; L220-F222 WeakPolarHBondContact O-CD2 3.28Å; L220-F222 PolarHBondContact O-N 3.5Å | ||
| 221 | N | 44.9 | Very low | 48 | Very low | 129 Ų | 129 | 128 Ų | 128 | 69% | 0.69 | 73% | 0.725 | S | S | * | * | trans | -85.8 | 100.2 | 176.7 | -150.4 | -18.4 | 0 | 0 | 0 | 107.3 | T219 S223 | T219-N221 PolarHBondContact O-N 3.46Å; N221-S223 PolarHBondContact O-N 3.07Å | ||
| 222 | F | 49.9 | Very low | 50.2 | Low | 172 Ų | 172 | 125.2 Ų | 125.2 | 75% | 0.754 | 71% | 0.708 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -66.4 | 2.2 | -175.9 | -67.6 | -81.2 | 0 | 0 | 0 | 114.3 | L220 Q224 | L220-F222 HydrophobicContact CB-CE2 4.4Å; L220-F222 HydrophobicContact CB-CZ 4.4Å; L220-F222 WeakPolarHBondContact O-CD2 3.28Å; L220-F222 PolarHBondContact O-N 3.5Å; F222-Q224 VanDerWaalsContact C-N 3.35Å; F222-Q224 PolarHBondContact O-N 3.3Å |
| 223 | S | 46.8 | Very low | 52.6 | Low | 103 Ų | 103 | 120.1 Ų | 120.1 | 72% | 0.72 | 69% | 0.69 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -83.5 | -0.6 | -175.1 | -54 | 0 | 0 | 0 | 0 | 114.9 | N221 | N221-S223 PolarHBondContact O-N 3.07Š|
| 224 | Q | 43.9 | Very low | 55.1 | Low | 159 Ų | 159 | 120.7 Ų | 120.7 | 74% | 0.743 | 68% | 0.68 | S | S | * | * | S | Bend | trans | -136.4 | 133.8 | 171.8 | -82 | -179 | -10.3 | 0 | 0 | 112.1 | F222 V226 | F222-Q224 VanDerWaalsContact C-N 3.35Å; F222-Q224 PolarHBondContact O-N 3.3Å; Q224-V226 PolarHBondContact O-N 2.94Å; Q224-V226 VanDerWaalsContact O-N 3.08Å |
| 225 | P | 44.5 | Very low | 57.6 | Low | 102 Ų | 102 | 119 Ų | 119 | 66% | 0.662 | 67% | 0.667 | S | S | * | * | trans | -70.5 | 105.5 | 177.3 | 27.5 | -31.7 | 0 | 0 | 0 | 109.6 | F227 | P225-F227 HydrophobicContact CB-CD2 4.44Å; P225-F227 HydrophobicContact CB-CE2 3.95Å; P225-F227 HydrophobicContact CB-CZ 4.49Å; P225-F227 HydrophobicContact CG-CE2 3.9Å; P225-F227 VanDerWaalsContact O-CD2 3.24Å; P225-F227 WeakPolarHBondContact O-CD2 3.47Å; P225-F227 PolarHBondContact O-N 3.34Å | ||
| 226 | V | 53 | Low | 59.5 | Low | 117 Ų | 117 | 118.8 Ų | 118.8 | 71% | 0.709 | 66% | 0.657 | S | S | * | * | trans | -80 | 101.5 | 176.1 | -178.8 | 0 | 0 | 0 | 0 | 108.8 | Q224 N228 | Q224-V226 PolarHBondContact O-N 2.94Å; Q224-V226 VanDerWaalsContact O-N 3.08Å; V226-N228 PolarHBondContact O-N 2.87Å; V226-N228 VanDerWaalsContact O-N 3.08Å | ||
| 227 | F | 52.1 | Low | 62.1 | Low | 153 Ų | 153 | 121.6 Ų | 121.6 | 67% | 0.671 | 66% | 0.657 | S | S | * | * | S | Bend | trans | -74.6 | 90.7 | 176.4 | -73.4 | -88.3 | 0 | 0 | 0 | 110.7 | P225 | P225-F227 HydrophobicContact CB-CD2 4.44Å; P225-F227 HydrophobicContact CB-CE2 3.95Å; P225-F227 HydrophobicContact CB-CZ 4.49Å; P225-F227 HydrophobicContact CG-CE2 3.9Å; P225-F227 VanDerWaalsContact O-CD2 3.24Å; P225-F227 WeakPolarHBondContact O-CD2 3.47Å; P225-F227 PolarHBondContact O-N 3.34Å |
| 228 | N | 53.5 | Low | 64.4 | Low | 136 Ų | 136 | 120.5 Ų | 120.5 | 73% | 0.727 | 64% | 0.644 | S | S | * | * | trans | -170.1 | 67.6 | 155.1 | -82 | -35.3 | 0 | 0 | 0 | 107.6 | V226 A232 | V226-N228 PolarHBondContact O-N 2.87Å; V226-N228 VanDerWaalsContact O-N 3.08Å; N228-A232 WeakPolarHBondContact O-CB 3.45Å | ||
| 229 | T | 68.1 | Low | 66.7 | Low | 84 Ų | 84 | 119.5 Ų | 119.5 | 52% | 0.515 | 63% | 0.632 | S | S | . | * | H | α-helix | trans | -73.5 | -36.9 | -150.6 | 53.4 | 0 | 0 | 0 | 0 | 114.4 | L233 | T229-L233 WeakPolarHBondContact O-CB 3.47Å; T229-L233 VanDerWaalsContact O-CD1 3.32Å; T229-L233 WeakPolarHBondContact O-CD1 3.25Å; T229-L233 WeakPolarHBondContact O-CG 3.35Å; T229-L233 PolarHBondContact O-N 3Å |
| 230 | T | 74.3 | Confident | 68.8 | Low | 112 Ų | 112 | 118.3 Ų | 118.3 | 69% | 0.687 | 62% | 0.62 | S | S | * | * | H | α-helix | trans | -69.8 | -46.5 | -170.6 | 7 | 0 | 0 | 0 | 0 | 113.8 | L233 E234 | T230-L233 PolarHBondContact O-N 3.07Å; T230-E234 WeakPolarHBondContact O-CB 3.36Å; T230-E234 PolarHBondContact O-N 2.97Å |
| 231 | K | 79.5 | Confident | 70.7 | Confident | 163 Ų | 163 | 114.8 Ų | 114.8 | 71% | 0.709 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -71.8 | -36.9 | 179.1 | -74.8 | -171.1 | 179.4 | -178.8 | 0 | 112.3 | E234 Q235 | K231-E234 PolarHBondContact O-N 2.85Å; K231-Q235 WeakPolarHBondContact O-CB 3.44Å; K231-Q235 WeakPolarHBondContact O-CG 3.48Å; K231-Q235 PolarHBondContact O-N 3.17Å |
| 232 | A | 81.1 | Confident | 72.6 | Confident | 46 Ų | 46 | 115.8 Ų | 115.8 | 38% | 0.38 | 60% | 0.601 | S | S | . | * | H | α-helix | trans | -63.2 | -46.2 | 174.3 | 0 | 0 | 0 | 0 | 0 | 110.6 | N228 E234 Q235 E236 | N228-A232 WeakPolarHBondContact O-CB 3.45Å; A232-E234 PolarHBondContact O-N 3.35Å; A232-Q235 PolarHBondContact O-N 3.12Å; A232-E236 WeakPolarHBondContact O-CB 3.15Å; A232-E236 PolarHBondContact O-N 3.29Å |
| 233 | L | 85.5 | Confident | 74.3 | Confident | 86 Ų | 86 | 114.8 Ų | 114.8 | 45% | 0.45 | 60% | 0.596 | S | S | . | * | H | α-helix | trans | -63.1 | -41.6 | 175.1 | -73.1 | 169.3 | 0 | 0 | 0 | 111.9 | T229 T230 Q235 E236 I237 | T229-L233 WeakPolarHBondContact O-CB 3.47Å; T229-L233 VanDerWaalsContact O-CD1 3.32Å; T229-L233 WeakPolarHBondContact O-CD1 3.25Å; T229-L233 WeakPolarHBondContact O-CG 3.35Å; T229-L233 PolarHBondContact O-N 3Å; T230-L233 PolarHBondContact O-N 3.07Å; L233-Q235 VanDerWaalsContact C-N 3.35Å; L233-Q235 PolarHBondContact O-N 3.2Å; L233-E236 PolarHBondContact O-N 2.89Å; L233-I237 WeakPolarHBondContact O-CB 3.33Å; L233-I237 WeakPolarHBondContact O-CG1 3.17Å; L233-I237 PolarHBondContact O-N 3.22Å |
| 234 | E | 86.5 | Confident | 75.9 | Confident | 131 Ų | 131 | 114 Ų | 114 | 61% | 0.612 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -62.6 | -42.7 | 176.6 | -172.2 | -175 | 175.1 | 0 | 0 | 111.5 | T230 K231 A232 K238 | T230-E234 WeakPolarHBondContact O-CB 3.36Å; T230-E234 PolarHBondContact O-N 2.97Å; K231-E234 PolarHBondContact O-N 2.85Å; A232-E234 PolarHBondContact O-N 3.35Å; E234-K238 VanDerWaalsContact O-CB 3.25Å; E234-K238 WeakPolarHBondContact O-CB 3.48Å; E234-K238 PolarHBondContact O-N 3.12Å |
| 235 | Q | 85 | Confident | 77.6 | Confident | 122 Ų | 122 | 110.7 Ų | 110.7 | 57% | 0.57 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -65 | -39.4 | 174.3 | -75.8 | -177.3 | -10.1 | 0 | 0 | 112.1 | K231 A232 L233 K238 S239 | K231-Q235 WeakPolarHBondContact O-CB 3.44Å; K231-Q235 WeakPolarHBondContact O-CG 3.48Å; K231-Q235 PolarHBondContact O-N 3.17Å; A232-Q235 PolarHBondContact O-N 3.12Å; L233-Q235 VanDerWaalsContact C-N 3.35Å; L233-Q235 PolarHBondContact O-N 3.2Å; Q235-K238 PolarHBondContact O-N 2.86Å; Q235-S239 WeakPolarHBondContact O-CB 3.31Å; Q235-S239 PolarHBondContact O-N 3.25Å |
| 236 | E | 87.8 | Confident | 79 | Confident | 105 Ų | 105 | 110.6 Ų | 110.6 | 49% | 0.491 | 57% | 0.568 | S | S | . | * | H | α-helix | trans | -64.9 | -47 | 176.3 | -171.3 | 176.9 | -177.7 | 0 | 0 | 111.3 | A232 L233 K238 S239 L240 | A232-E236 WeakPolarHBondContact O-CB 3.15Å; A232-E236 PolarHBondContact O-N 3.29Å; L233-E236 PolarHBondContact O-N 2.89Å; E236-K238 VanDerWaalsContact C-N 3.33Å; E236-K238 PolarHBondContact O-N 3.28Å; E236-S239 WeakPolarHBondContact O-CB 3.37Å; E236-S239 PolarHBondContact O-N 3.16Å; E236-S239 VanDerWaalsContact O-N 3.17Å; E236-L240 WeakPolarHBondContact O-CB 3.35Å; E236-L240 PolarHBondContact O-N 3.49Å |
| 237 | I | 89.4 | Confident | 79.5 | Confident | 118 Ų | 118 | 108 Ų | 108 | 61% | 0.605 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -59.7 | -45.3 | 175 | -69.5 | 165 | 0 | 0 | 0 | 110.1 | L233 S239 L240 S241 | L233-I237 WeakPolarHBondContact O-CB 3.33Å; L233-I237 WeakPolarHBondContact O-CG1 3.17Å; L233-I237 PolarHBondContact O-N 3.22Å; I237-S239 VanDerWaalsContact C-N 3.33Å; I237-S239 PolarHBondContact O-N 3.43Å; I237-L240 PolarHBondContact O-N 3.1Å; I237-S241 WeakPolarHBondContact O-CB 3.43Å; I237-S241 PolarHBondContact O-N 3.47Å |
| 238 | K | 90 | Very high | 80 | Confident | 138 Ų | 138 | 105 Ų | 105 | 60% | 0.6 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -68.2 | -31.8 | 178.1 | -169.5 | 173.8 | -177.2 | 174 | 0 | 112.5 | E234 Q235 E236 R242 | E234-K238 VanDerWaalsContact O-CB 3.25Å; E234-K238 WeakPolarHBondContact O-CB 3.48Å; E234-K238 PolarHBondContact O-N 3.12Å; Q235-K238 PolarHBondContact O-N 2.86Å; E236-K238 VanDerWaalsContact C-N 3.33Å; E236-K238 PolarHBondContact O-N 3.28Å; K238-R242 WeakPolarHBondContact O-CB 3.46Å; K238-R242 WeakPolarHBondContact O-CG 3.29Å; K238-R242 PolarHBondContact O-N 2.95Å; K238-R242 PolarHBondContact O-NE 2.74Å |
| 239 | S | 91 | Very high | 80.2 | Confident | 65 Ų | 65 | 107 Ų | 107 | 46% | 0.455 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -70.3 | -48.4 | 174.6 | -169.5 | 0 | 0 | 0 | 0 | 110.9 | Q235 E236 I237 R242 K243 | Q235-S239 WeakPolarHBondContact O-CB 3.31Å; Q235-S239 PolarHBondContact O-N 3.25Å; E236-S239 WeakPolarHBondContact O-CB 3.37Å; E236-S239 PolarHBondContact O-N 3.16Å; E236-S239 VanDerWaalsContact O-N 3.17Å; I237-S239 VanDerWaalsContact C-N 3.33Å; I237-S239 PolarHBondContact O-N 3.43Å; S239-R242 PolarHBondContact O-N 3.38Å; S239-K243 PolarHBondContact O-N 3.09Å |
| 240 | L | 88.7 | Confident | 79.6 | Confident | 109 Ų | 109 | 109.3 Ų | 109.3 | 57% | 0.571 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -64.9 | -42.1 | 178.7 | -168.8 | 65.1 | 0 | 0 | 0 | 111.4 | E236 I237 R242 K243 V244 | E236-L240 WeakPolarHBondContact O-CB 3.35Å; E236-L240 PolarHBondContact O-N 3.49Å; I237-L240 PolarHBondContact O-N 3.1Å; L240-R242 VanDerWaalsContact C-N 3.34Å; L240-R242 PolarHBondContact O-N 2.98Å; L240-K243 PolarHBondContact O-N 2.7Å; L240-K243 VanDerWaalsContact O-N 3.11Å; L240-V244 WeakPolarHBondContact O-CG2 3.33Å; L240-V244 PolarHBondContact O-N 3.45Å |
| 241 | S | 89.3 | Confident | 78.7 | Confident | 61 Ų | 61 | 112 Ų | 112 | 43% | 0.427 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -60.9 | -41.4 | 174.9 | -176 | 0 | 0 | 0 | 0 | 111.8 | I237 N245 | I237-S241 WeakPolarHBondContact O-CB 3.43Å; I237-S241 PolarHBondContact O-N 3.47Å; S241-N245 WeakPolarHBondContact O-CB 3.42Å; S241-N245 PolarHBondContact O-N 3.06Å; S241-N245 PolarHBondContact O-ND2 3.48Å |
| 242 | R | 85.5 | Confident | 77.9 | Confident | 149 Ų | 149 | 114 Ų | 114 | 56% | 0.562 | 57% | 0.574 | S | S | * | * | H | α-helix | trans | -63.9 | -41.8 | 171.4 | -81.8 | -173.6 | -69.8 | 171.3 | 0.6 | 112.3 | K238 S239 L240 N245 N246 | K238-R242 WeakPolarHBondContact O-CB 3.46Å; K238-R242 WeakPolarHBondContact O-CG 3.29Å; K238-R242 PolarHBondContact O-N 2.95Å; K238-R242 PolarHBondContact O-NE 2.74Å; S239-R242 PolarHBondContact O-N 3.38Å; L240-R242 VanDerWaalsContact C-N 3.34Å; L240-R242 PolarHBondContact O-N 2.98Å; R242-N245 PolarHBondContact O-N 3.36Å; R242-N246 WeakPolarHBondContact O-CB 3.38Å; R242-N246 PolarHBondContact O-N 2.96Å; R242-N246 PolarHBondContact O-ND2 3.37Å |
| 243 | K | 85.5 | Confident | 77.2 | Confident | 151 Ų | 151 | 114.3 Ų | 114.3 | 66% | 0.657 | 57% | 0.571 | S | S | * | * | H | α-helix | trans | -63.2 | -42.4 | 178.9 | -166.4 | 174.8 | -178.1 | -178.8 | 0 | 111.7 | S239 L240 N246 A247 | S239-K243 PolarHBondContact O-N 3.09Å; L240-K243 PolarHBondContact O-N 2.7Å; L240-K243 VanDerWaalsContact O-N 3.11Å; K243-N246 PolarHBondContact O-N 3.11Å; K243-A247 WeakPolarHBondContact O-CB 3.36Å; K243-A247 PolarHBondContact O-N 3.46Å |
| 244 | V | 80 | Confident | 76.6 | Confident | 86 Ų | 86 | 115.6 Ų | 115.6 | 52% | 0.521 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -66.5 | -43.2 | 176.4 | 173.2 | 0 | 0 | 0 | 0 | 111.5 | L240 N246 A247 S248 | L240-V244 WeakPolarHBondContact O-CG2 3.33Å; L240-V244 PolarHBondContact O-N 3.45Å; V244-N246 VanDerWaalsContact C-N 3.28Å; V244-N246 PolarHBondContact O-N 3.01Å; V244-A247 PolarHBondContact O-N 2.9Å; V244-S248 PolarHBondContact O-N 3.3Å |
| 245 | N | 79.9 | Confident | 76.3 | Confident | 91 Ų | 91 | 116.3 Ų | 116.3 | 49% | 0.487 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -69.7 | -24.6 | 177.9 | -70.1 | -20.2 | 0 | 0 | 0 | 113.6 | S241 R242 S248 | S241-N245 WeakPolarHBondContact O-CB 3.42Å; S241-N245 PolarHBondContact O-N 3.06Å; S241-N245 PolarHBondContact O-ND2 3.48Å; R242-N245 PolarHBondContact O-N 3.36Å; N245-S248 PolarHBondContact O-OG 2.92Å |
| 246 | N | 73.2 | Confident | 76.1 | Confident | 99 Ų | 99 | 115.2 Ų | 115.2 | 53% | 0.529 | 58% | 0.579 | S | S | . | * | H | α-helix | trans | -83.6 | -39.3 | 172.9 | -70.1 | -10.2 | 0 | 0 | 0 | 111.2 | R242 K243 V244 S248 K249 E250 | R242-N246 WeakPolarHBondContact O-CB 3.38Å; R242-N246 PolarHBondContact O-N 2.96Å; R242-N246 PolarHBondContact O-ND2 3.37Å; K243-N246 PolarHBondContact O-N 3.11Å; V244-N246 VanDerWaalsContact C-N 3.28Å; V244-N246 PolarHBondContact O-N 3.01Å; N246-S248 PolarHBondContact O-N 3.41Å; N246-K249 CarbonylContact O-C 3.55Å; N246-K249 WeakPolarHBondContact O-CA 3.3Å; N246-K249 PolarHBondContact O-N 2.74Å; N246-E250 PolarHBondContact O-N 3.36Å |
| 247 | A | 64 | Low | 75.8 | Confident | 62 Ų | 62 | 116.7 Ų | 116.7 | 51% | 0.512 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -64.5 | -25.8 | 174.4 | 0 | 0 | 0 | 0 | 0 | 112.6 | K243 V244 K249 | K243-A247 WeakPolarHBondContact O-CB 3.36Å; K243-A247 PolarHBondContact O-N 3.46Å; V244-A247 PolarHBondContact O-N 2.9Å; A247-K249 VanDerWaalsContact C-N 3.28Å |
| 248 | S | 61.3 | Low | 75.6 | Confident | 92 Ų | 92 | 115.6 Ų | 115.6 | 64% | 0.643 | 57% | 0.574 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.7 | -15.7 | 170.6 | 67.8 | 0 | 0 | 0 | 0 | 113.6 | V244 N245 N246 | V244-S248 PolarHBondContact O-N 3.3Å; N245-S248 PolarHBondContact O-OG 2.92Å; N246-S248 PolarHBondContact O-N 3.41Å |
| 249 | K | 58.1 | Low | 75.3 | Confident | 176 Ų | 176 | 113 Ų | 113 | 77% | 0.765 | 57% | 0.565 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -98.9 | -30.3 | 175.1 | -76.1 | -175.8 | 177.2 | -178.3 | 0 | 113.4 | N246 A247 H251 | N246-K249 CarbonylContact O-C 3.55Å; N246-K249 WeakPolarHBondContact O-CA 3.3Å; N246-K249 PolarHBondContact O-N 2.74Å; A247-K249 VanDerWaalsContact C-N 3.28Å; K249-H251 PolarHBondContact O-N 3Å; K249-H251 VanDerWaalsContact O-N 3.08Å |
| 250 | E | 55.8 | Low | 75.1 | Confident | 133 Ų | 133 | 112.6 Ų | 112.6 | 62% | 0.621 | 57% | 0.565 | S | S | * | * | S | Bend | trans | -72.7 | 96.3 | 164 | -94.8 | 179 | 155.1 | 0 | 0 | 107.6 | N246 Y252 | N246-E250 PolarHBondContact O-N 3.36Å; E250-Y252 PolarHBondContact O-N 2.8Å |
| 251 | H | 55.3 | Low | 75 | Confident | 170 Ų | 170 | 111.8 Ų | 111.8 | 79% | 0.787 | 56% | 0.558 | S | S | * | * | trans | -37.9 | 128.1 | 158.5 | -92.5 | -87.9 | 0 | 0 | 0 | 108.6 | K249 T253 | K249-H251 PolarHBondContact O-N 3Å; K249-H251 VanDerWaalsContact O-N 3.08Å; H251-T253 VanDerWaalsContact O-CA 3.32Å; H251-T253 WeakPolarHBondContact O-CA 3.43Å; H251-T253 PolarHBondContact O-N 3.45Å | ||
| 252 | Y | 63.8 | Low | 75.1 | Confident | 205 Ų | 205 | 115.3 Ų | 115.3 | 80% | 0.804 | 56% | 0.562 | S | S | * | * | S | Bend | trans | -28 | 101.1 | 173.7 | -64.9 | -85.6 | 0 | 0 | 0 | 108.7 | E250 D254 | E250-Y252 PolarHBondContact O-N 2.8Å; Y252-D254 PolarHBondContact O-N 3.34Å |
| 253 | T | 66.7 | Low | 75.1 | Confident | 51 Ų | 51 | 111.9 Ų | 111.9 | 31% | 0.313 | 56% | 0.558 | S | S | . | * | trans | -55.4 | 138.6 | -167.3 | 33.7 | 0 | 0 | 0 | 0 | 106.9 | H251 E255 I256 | H251-T253 VanDerWaalsContact O-CA 3.32Å; H251-T253 WeakPolarHBondContact O-CA 3.43Å; H251-T253 PolarHBondContact O-N 3.45Å; T253-E255 CarbonylContact O-C 3.54Å; T253-E255 PolarHBondContact O-N 2.78Å; T253-I256 PolarHBondContact O-N 3.46Å | ||
| 254 | D | 72.5 | Confident | 75.1 | Confident | 113 Ų | 113 | 108.9 Ų | 108.9 | 60% | 0.604 | 55% | 0.552 | S | S | * | * | H | α-helix | trans | -48 | -25.1 | 179.1 | -75.1 | -48.7 | 0 | 0 | 0 | 111.9 | Y252 R257 L258 | Y252-D254 PolarHBondContact O-N 3.34Å; D254-R257 PolarHBondContact O-N 2.82Å; D254-L258 VanDerWaalsContact O-CB 3.3Å; D254-L258 WeakPolarHBondContact O-CB 3.21Å; D254-L258 WeakPolarHBondContact O-CG 3.38Å; D254-L258 PolarHBondContact O-N 2.92Å |
| 255 | E | 80.3 | Confident | 75.2 | Confident | 146 Ų | 146 | 108.4 Ų | 108.4 | 68% | 0.682 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -53.4 | -48.7 | 168.4 | -168.1 | 173.4 | -161.2 | 0 | 0 | 115.1 | T253 R257 L258 E259 | T253-E255 CarbonylContact O-C 3.54Å; T253-E255 PolarHBondContact O-N 2.78Å; E255-R257 VanDerWaalsContact C-N 3.3Å; E255-R257 PolarHBondContact O-N 3.41Å; E255-L258 PolarHBondContact O-N 3.44Å; E255-E259 WeakPolarHBondContact O-CB 3.42Å; E255-E259 PolarHBondContact O-N 2.98Å |
| 256 | I | 79.4 | Confident | 75.3 | Confident | 100 Ų | 100 | 109.4 Ų | 109.4 | 51% | 0.513 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -64 | -40.2 | 178.2 | -62.8 | 174.6 | 0 | 0 | 0 | 110.1 | T253 E259 A260 | T253-I256 PolarHBondContact O-N 3.46Å; I256-E259 PolarHBondContact O-N 2.76Å; I256-A260 WeakPolarHBondContact O-CB 3.36Å; I256-A260 PolarHBondContact O-N 2.98Å |
| 257 | R | 82.2 | Confident | 75.5 | Confident | 136 Ų | 136 | 107.4 Ų | 107.4 | 51% | 0.513 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -66.2 | -45.3 | 178.1 | -168 | -172.6 | 67.1 | 70.8 | 3.6 | 110.8 | D254 E255 E259 A260 E261 | D254-R257 PolarHBondContact O-N 2.82Å; E255-R257 VanDerWaalsContact C-N 3.3Å; E255-R257 PolarHBondContact O-N 3.41Å; R257-E259 VanDerWaalsContact C-N 3.33Å; R257-A260 PolarHBondContact O-N 3.47Å; R257-E261 IonicContact NH1-OE2 3.2Å; R257-E261 PolarHBondContact NH1-OE2 2.86Å; R257-E261 VanDerWaalsContact O-CB 3.31Å; R257-E261 WeakPolarHBondContact O-CB 3.39Å; R257-E261 PolarHBondContact O-N 3.21Å |
| 258 | L | 84.6 | Confident | 76 | Confident | 95 Ų | 95 | 107.7 Ų | 107.7 | 50% | 0.497 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -65.1 | -36.4 | 176.9 | -73.4 | 169.2 | 0 | 0 | 0 | 111.8 | D254 E255 E261 R262 | D254-L258 VanDerWaalsContact O-CB 3.3Å; D254-L258 WeakPolarHBondContact O-CB 3.21Å; D254-L258 WeakPolarHBondContact O-CG 3.38Å; D254-L258 PolarHBondContact O-N 2.92Å; E255-L258 PolarHBondContact O-N 3.44Å; L258-E261 PolarHBondContact O-N 2.66Å; L258-R262 WeakPolarHBondContact O-CB 3.47Å; L258-R262 PolarHBondContact O-N 3.3Å |
| 259 | E | 85.2 | Confident | 76.4 | Confident | 84 Ų | 84 | 109.8 Ų | 109.8 | 39% | 0.393 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -70.9 | -42.7 | 177.5 | -177.5 | 60 | -166.8 | 0 | 0 | 111.6 | E255 I256 R257 E261 R262 V263 | E255-E259 WeakPolarHBondContact O-CB 3.42Å; E255-E259 PolarHBondContact O-N 2.98Å; I256-E259 PolarHBondContact O-N 2.76Å; R257-E259 VanDerWaalsContact C-N 3.33Å; E259-E261 VanDerWaalsContact C-N 3.32Å; E259-E261 PolarHBondContact O-N 3.41Å; E259-R262 WeakPolarHBondContact O-CB 3.47Å; E259-R262 PolarHBondContact O-N 2.99Å; E259-R262 IonicContact OE1-CZ 2.7Å; E259-R262 IonicContact OE1-NE 3.38Å; E259-R262 PolarHBondContact OE1-NE 3.5Å; E259-R262 IonicContact OE1-NH2 3.6Å; E259-R262 PolarHBondContact OE1-NH2 2.87Å; E259-R262 IonicContact OE2-CZ 3.33Å; E259-R262 IonicContact OE2-NE 3.11Å; E259-R262 PolarHBondContact OE2-NE 3.2Å; E259-R262 IonicContact OE2-NH2 2.66Å; E259-R262 PolarHBondContact OE2-NH2 3.46Å; E259-V263 WeakPolarHBondContact O-CG2 3.43Å; E259-V263 PolarHBondContact O-N 2.66Å |
| 260 | A | 85.4 | Confident | 76.7 | Confident | 56 Ų | 56 | 106.4 Ų | 106.4 | 46% | 0.463 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -61.2 | -42.4 | 172.3 | 0 | 0 | 0 | 0 | 0 | 111.5 | I256 R257 R262 V263 V264 | I256-A260 WeakPolarHBondContact O-CB 3.36Å; I256-A260 PolarHBondContact O-N 2.98Å; R257-A260 PolarHBondContact O-N 3.47Å; A260-R262 VanDerWaalsContact C-N 3.35Å; A260-V263 PolarHBondContact O-N 2.97Å; A260-V264 WeakPolarHBondContact O-CG2 3.16Å; A260-V264 PolarHBondContact O-N 3Å; A260-V264 VanDerWaalsContact O-N 3.1Å |
| 261 | E | 87.2 | Confident | 76.6 | Confident | 92 Ų | 92 | 105.5 Ų | 105.5 | 43% | 0.43 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -63.3 | -39.4 | 175.7 | -170 | 172.8 | 176.9 | 0 | 0 | 111.6 | R257 L258 E259 N265 | R257-E261 IonicContact NH1-OE2 3.2Å; R257-E261 PolarHBondContact NH1-OE2 2.86Å; R257-E261 VanDerWaalsContact O-CB 3.31Å; R257-E261 WeakPolarHBondContact O-CB 3.39Å; R257-E261 PolarHBondContact O-N 3.21Å; L258-E261 PolarHBondContact O-N 2.66Å; E259-E261 VanDerWaalsContact C-N 3.32Å; E259-E261 PolarHBondContact O-N 3.41Å; E261-N265 WeakPolarHBondContact O-CB 3.37Å; E261-N265 VanDerWaalsContact O-CG 3.24Å; E261-N265 PolarHBondContact O-N 3.33Å; E261-N265 PolarHBondContact O-ND2 2.82Å; E261-N265 VanDerWaalsContact O-ND2 3.12Å |
| 262 | R | 90.4 | Very high | 76.4 | Confident | 134 Ų | 134 | 103.1 Ų | 103.1 | 51% | 0.506 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -61.2 | -48.4 | 174.1 | -173 | -178.1 | 77.3 | 101 | 0.5 | 112 | L258 E259 A260 V264 N265 E266 | L258-R262 WeakPolarHBondContact O-CB 3.47Å; L258-R262 PolarHBondContact O-N 3.3Å; E259-R262 WeakPolarHBondContact O-CB 3.47Å; E259-R262 PolarHBondContact O-N 2.99Å; E259-R262 IonicContact OE1-CZ 2.7Å; E259-R262 IonicContact OE1-NE 3.38Å; E259-R262 PolarHBondContact OE1-NE 3.5Å; E259-R262 IonicContact OE1-NH2 3.6Å; E259-R262 PolarHBondContact OE1-NH2 2.87Å; E259-R262 IonicContact OE2-CZ 3.33Å; E259-R262 IonicContact OE2-NE 3.11Å; E259-R262 PolarHBondContact OE2-NE 3.2Å; E259-R262 IonicContact OE2-NH2 2.66Å; E259-R262 PolarHBondContact OE2-NH2 3.46Å; A260-R262 VanDerWaalsContact C-N 3.35Å; R262-V264 PolarHBondContact O-N 3.43Å; R262-N265 PolarHBondContact O-N 3.32Å; R262-E266 WeakPolarHBondContact O-CB 3.4Å; R262-E266 PolarHBondContact O-N 3.42Å |
| 263 | V | 85.7 | Confident | 75.7 | Confident | 78 Ų | 78 | 98.4 Ų | 98.4 | 47% | 0.473 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -63.2 | -41.9 | -178.9 | 172 | 0 | 0 | 0 | 0 | 111.6 | E259 A260 E266 A267 | E259-V263 WeakPolarHBondContact O-CG2 3.43Å; E259-V263 PolarHBondContact O-N 2.66Å; A260-V263 PolarHBondContact O-N 2.97Å; V263-E266 PolarHBondContact O-N 2.79Å; V263-A267 WeakPolarHBondContact O-CB 3.46Å; V263-A267 PolarHBondContact O-N 3.11Å |
| 264 | V | 86.1 | Confident | 74.9 | Confident | 87 Ų | 87 | 99 Ų | 99 | 53% | 0.527 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -65.1 | -45.5 | 176.5 | 173 | 0 | 0 | 0 | 0 | 110.8 | A260 R262 E266 A267 C268 | A260-V264 WeakPolarHBondContact O-CG2 3.16Å; A260-V264 PolarHBondContact O-N 3Å; A260-V264 VanDerWaalsContact O-N 3.1Å; R262-V264 PolarHBondContact O-N 3.43Å; V264-E266 PolarHBondContact O-N 3.17Å; V264-A267 PolarHBondContact O-N 3.21Å; V264-C268 PolarHBondContact O-N 3.48Å; V264-C268 PolarHBondContact O-SG 3.39Å; V264-C268 VanDerWaalsContact O-SG 3.35Å |
| 265 | N | 82.6 | Confident | 73.7 | Confident | 77 Ų | 77 | 100.6 Ų | 100.6 | 41% | 0.412 | 57% | 0.568 | S | S | . | * | H | α-helix | trans | -65.3 | -37.3 | 179.1 | -74.2 | -29.9 | 0 | 0 | 0 | 112.4 | E261 R262 C268 N269 | E261-N265 WeakPolarHBondContact O-CB 3.37Å; E261-N265 VanDerWaalsContact O-CG 3.24Å; E261-N265 PolarHBondContact O-N 3.33Å; E261-N265 PolarHBondContact O-ND2 2.82Å; E261-N265 VanDerWaalsContact O-ND2 3.12Å; R262-N265 PolarHBondContact O-N 3.32Å; N265-C268 PolarHBondContact O-N 3.37Å; N265-N269 VanDerWaalsContact O-CB 3.25Å; N265-N269 WeakPolarHBondContact O-CB 3.38Å; N265-N269 PolarHBondContact O-N 2.95Å; N265-N269 PolarHBondContact O-ND2 3.32Å |
| 266 | E | 82.6 | Confident | 72.1 | Confident | 111 Ų | 111 | 100.5 Ų | 100.5 | 52% | 0.519 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -63.7 | -44.4 | 174 | -174.8 | 175.8 | 173.6 | 0 | 0 | 111.8 | R262 V263 V264 C268 N269 T270 | R262-E266 WeakPolarHBondContact O-CB 3.4Å; R262-E266 PolarHBondContact O-N 3.42Å; V263-E266 PolarHBondContact O-N 2.79Å; V264-E266 PolarHBondContact O-N 3.17Å; E266-C268 VanDerWaalsContact C-N 3.29Å; E266-C268 PolarHBondContact O-N 2.92Å; E266-N269 PolarHBondContact O-N 2.96Å; E266-T270 WeakPolarHBondContact O-CG2 3.31Å; E266-T270 PolarHBondContact O-N 3.37Å; E266-T270 PolarHBondContact O-OG1 3.02Å |
| 267 | A | 76.6 | Confident | 70.5 | Confident | 58 Ų | 58 | 100 Ų | 100 | 48% | 0.479 | 58% | 0.577 | S | S | . | * | H | α-helix | trans | -63.4 | -34.3 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | V263 V264 T270 L271 | V263-A267 WeakPolarHBondContact O-CB 3.46Å; V263-A267 PolarHBondContact O-N 3.11Å; V264-A267 PolarHBondContact O-N 3.21Å; A267-T270 PolarHBondContact O-OG1 3.47Å; A267-T270 VanDerWaalsContact O-OG1 3.1Å; A267-L271 WeakPolarHBondContact O-CG 3.46Å |
| 268 | C | 73.4 | Confident | 69 | Low | 68 Ų | 68 | 101.6 Ų | 101.6 | 46% | 0.459 | 59% | 0.594 | S | S | . | * | H | α-helix | trans | -78.2 | -36.9 | 176.2 | -69 | 0 | 0 | 0 | 0 | 113.2 | V264 N265 E266 T270 L271 | V264-C268 PolarHBondContact O-N 3.48Å; V264-C268 PolarHBondContact O-SG 3.39Å; V264-C268 VanDerWaalsContact O-SG 3.35Å; N265-C268 PolarHBondContact O-N 3.37Å; E266-C268 VanDerWaalsContact C-N 3.29Å; E266-C268 PolarHBondContact O-N 2.92Å; C268-T270 VanDerWaalsContact C-N 3.35Å; C268-L271 VanDerWaalsContact O-CB 3.28Å; C268-L271 WeakPolarHBondContact O-CB 3.44Å; C268-L271 WeakPolarHBondContact O-CG 3.32Å; C268-L271 PolarHBondContact O-N 3.32Å |
| 269 | N | 70 | Confident | 66.9 | Low | 136 Ų | 136 | 103 Ų | 103 | 73% | 0.727 | 60% | 0.603 | S | S | * | * | H | α-helix | trans | -75.9 | -22 | -179.1 | -72.2 | -32.3 | 0 | 0 | 0 | 113.3 | N265 E266 L271 | N265-N269 VanDerWaalsContact O-CB 3.25Å; N265-N269 WeakPolarHBondContact O-CB 3.38Å; N265-N269 PolarHBondContact O-N 2.95Å; N265-N269 PolarHBondContact O-ND2 3.32Å; E266-N269 PolarHBondContact O-N 2.96Å; N269-L271 PolarHBondContact O-N 3.5Å |
| 270 | T | 64 | Low | 65 | Low | 104 Ų | 104 | 104.2 Ų | 104.2 | 64% | 0.638 | 62% | 0.618 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76 | -8.5 | 171.4 | 48.7 | 0 | 0 | 0 | 0 | 112.8 | E266 A267 C268 | E266-T270 WeakPolarHBondContact O-CG2 3.31Å; E266-T270 PolarHBondContact O-N 3.37Å; E266-T270 PolarHBondContact O-OG1 3.02Å; A267-T270 PolarHBondContact O-OG1 3.47Å; A267-T270 VanDerWaalsContact O-OG1 3.1Å; C268-T270 VanDerWaalsContact C-N 3.35Å |
| 271 | L | 54.6 | Low | 63.2 | Low | 115 Ų | 115 | 108.9 Ų | 108.9 | 60% | 0.602 | 63% | 0.634 | S | S | * | * | S | Bend | trans | -75 | 127.5 | 173.3 | -58.5 | 170.1 | 0 | 0 | 0 | 108.8 | A267 C268 N269 A273 | A267-L271 WeakPolarHBondContact O-CG 3.46Å; C268-L271 VanDerWaalsContact O-CB 3.28Å; C268-L271 WeakPolarHBondContact O-CB 3.44Å; C268-L271 WeakPolarHBondContact O-CG 3.32Å; C268-L271 PolarHBondContact O-N 3.32Å; N269-L271 PolarHBondContact O-N 3.5Å; L271-A273 PolarHBondContact O-N 2.92Å; L271-A273 VanDerWaalsContact O-N 3.13Å |
| 272 | P | 51.9 | Low | 61.1 | Low | 119 Ų | 119 | 110.8 Ų | 110.8 | 77% | 0.773 | 65% | 0.646 | S | S | * | * | trans | -59.2 | 124.2 | 174.8 | 23.3 | -30.5 | 0 | 0 | 0 | 108.6 | G274 | P272-G274 PolarHBondContact O-N 3.38Š| ||
| 273 | A | 49.3 | Very low | 59.2 | Low | 106 Ų | 106 | 111.3 Ų | 111.3 | 88% | 0.876 | 66% | 0.658 | S | S | * | * | trans | -65.5 | 75.3 | 168.7 | 0 | 0 | 0 | 0 | 0 | 108.7 | L271 | L271-A273 PolarHBondContact O-N 2.92Å; L271-A273 VanDerWaalsContact O-N 3.13Å | ||
| 274 | G | 48.3 | Very low | 57.3 | Low | 65 Ų | 65 | 114.6 Ų | 114.6 | 67% | 0.67 | 67% | 0.673 | S | S | * | * | trans | -93.5 | 108.2 | 174.6 | 0 | 0 | 0 | 0 | 0 | 108.3 | P272 N276 | P272-G274 PolarHBondContact O-N 3.38Å; G274-N276 PolarHBondContact O-N 2.82Å | ||
| 275 | D | 48.3 | Very low | 55.6 | Low | 145 Ų | 145 | 114.9 Ų | 114.9 | 78% | 0.775 | 68% | 0.677 | S | S | * | * | trans | -51.6 | 127.1 | 175.9 | -69.5 | -39.3 | 0 | 0 | 0 | 111.4 | ||||
| 276 | N | 45.4 | Very low | 53.8 | Low | 144 Ų | 144 | 122.1 Ų | 122.1 | 77% | 0.77 | 70% | 0.698 | S | S | * | * | S | Bend | trans | 78.1 | 126 | 158.3 | -48.5 | -42.9 | 0 | 0 | 0 | 118.5 | G274 | G274-N276 PolarHBondContact O-N 2.82Š|
| 277 | S | 46.8 | Very low | 52.5 | Low | 89 Ų | 89 | 123.9 Ų | 123.9 | 62% | 0.622 | 71% | 0.709 | S | S | * | * | S | Bend | trans | 75.9 | 98.8 | 156.5 | 71.6 | 0 | 0 | 0 | 0 | 117.5 | N279 | S277-N279 VanDerWaalsContact C-N 3.34Å; S277-N279 PolarHBondContact O-N 2.9Å |
| 278 | I | 49.7 | Very low | 51.3 | Low | 170 Ų | 170 | 126.9 Ų | 126.9 | 87% | 0.872 | 72% | 0.722 | S | S | * | * | 36.2 | 60.3 | 128.2 | -40.5 | 161.8 | 0 | 0 | 0 | 113.6 | |||||
| 279 | N | 41.7 | Very low | 50.7 | Low | 126 Ų | 126 | 128.7 Ų | 128.7 | 67% | 0.674 | 73% | 0.731 | S | S | * | * | trans | -122.9 | 104.6 | 163.8 | -86.9 | -39.7 | 0 | 0 | 0 | 107.3 | S277 L281 | S277-N279 VanDerWaalsContact C-N 3.34Å; S277-N279 PolarHBondContact O-N 2.9Å; N279-L281 PolarHBondContact O-N 3.03Å | ||
| 280 | P | 45.6 | Very low | 50.1 | Low | 109 Ų | 109 | 129.9 Ų | 129.9 | 71% | 0.708 | 74% | 0.737 | S | S | * | * | trans | -63.4 | 129.3 | 179.4 | 26.9 | -31.9 | 0 | 0 | 0 | 109 | I282 | P280-I282 PolarHBondContact O-N 2.96Š| ||
| 281 | L | 46.6 | Very low | 50 | Low | 153 Ų | 153 | 128.5 Ų | 128.5 | 80% | 0.801 | 73% | 0.728 | S | S | * | * | trans | 36.8 | 71 | 154.4 | -76.4 | 148.8 | 0 | 0 | 0 | 115 | N279 L283 | N279-L281 PolarHBondContact O-N 3.03Å; L281-L283 PolarHBondContact O-N 2.84Å | ||
| 282 | I | 44.4 | Very low | 50.4 | Low | 133 Ų | 133 | 126.4 Ų | 126.4 | 68% | 0.682 | 72% | 0.722 | S | S | * | * | trans | -77.1 | 83.9 | 159.8 | -56.8 | 177 | 0 | 0 | 0 | 106.8 | P280 N284 | P280-I282 PolarHBondContact O-N 2.96Å; I282-N284 PolarHBondContact O-N 3.12Å | ||
| 283 | L | 49 | Very low | 51.1 | Low | 145 Ų | 145 | 130.3 Ų | 130.3 | 76% | 0.759 | 73% | 0.73 | S | S | * | * | trans | -56 | 118.6 | 162 | -72.9 | 165.1 | 0 | 0 | 0 | 107.1 | L281 P285 | L281-L283 PolarHBondContact O-N 2.84Å; L283-P285 WeakPolarHBondContact O-CD 3.43Å | ||
| 284 | N | 45.5 | Very low | 51.8 | Low | 146 Ų | 146 | 132.4 Ų | 132.4 | 78% | 0.781 | 73% | 0.726 | S | S | * | * | trans | -35.3 | 102 | -179.7 | -84.4 | -46.5 | 0 | 0 | 0 | 112.7 | I282 R286 | I282-N284 PolarHBondContact O-N 3.12Å; N284-R286 PolarHBondContact O-N 2.86Å | ||
| 285 | P | 50.3 | Low | 52.4 | Low | 94 Ų | 94 | 133.4 Ų | 133.4 | 61% | 0.61 | 72% | 0.719 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.6 | 30.3 | -179.4 | 33.8 | -32.9 | 0 | 0 | 0 | 111.6 | L283 I287 | L283-P285 WeakPolarHBondContact O-CD 3.43Å; P285-I287 PolarHBondContact O-N 2.78Å |
| 286 | R | 44.7 | Very low | 53 | Low | 228 Ų | 228 | 130 Ų | 130 | 86% | 0.86 | 71% | 0.706 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76.3 | -2.1 | -178.4 | -94.1 | -172.9 | 162.3 | 153 | -2 | 114.3 | N284 T288 | N284-R286 PolarHBondContact O-N 2.86Å; R286-T288 PolarHBondContact O-N 3.08Å |
| 287 | I | 55.4 | Low | 53.8 | Low | 148 Ų | 148 | 127 Ų | 127 | 76% | 0.759 | 69% | 0.694 | S | S | * | * | trans | -96.8 | 77.6 | 163.4 | -54.9 | 178.7 | 0 | 0 | 0 | 107 | P285 V289 | P285-I287 PolarHBondContact O-N 2.78Å; I287-V289 VanDerWaalsContact C-N 3.26Å; I287-V289 HydrophobicContact CG2-CG2 3.66Å; I287-V289 PolarHBondContact O-N 3.13Å | ||
| 288 | T | 52 | Low | 54.6 | Low | 122 Ų | 122 | 130.9 Ų | 130.9 | 75% | 0.748 | 70% | 0.696 | S | S | * | * | trans | -73.1 | 90.6 | 160.7 | 51.9 | 0 | 0 | 0 | 0 | 106.5 | R286 N290 | R286-T288 PolarHBondContact O-N 3.08Å; T288-N290 PolarHBondContact O-N 2.87Å; T288-N290 VanDerWaalsContact O-N 3.12Å | ||
| 289 | V | 60.4 | Low | 55.1 | Low | 106 Ų | 106 | 130.6 Ų | 130.6 | 64% | 0.642 | 69% | 0.691 | S | S | * | * | trans | -66.4 | 111.5 | 163.9 | -174.3 | 0 | 0 | 0 | 0 | 105 | I287 V291 | I287-V289 VanDerWaalsContact C-N 3.26Å; I287-V289 HydrophobicContact CG2-CG2 3.66Å; I287-V289 PolarHBondContact O-N 3.13Å; V289-V291 HydrophobicContact CB-CG2 4.07Å; V289-V291 HydrophobicContact CG1-CG2 3.62Å; V289-V291 PolarHBondContact O-N 3.48Å | ||
| 290 | N | 58.8 | Low | 55.9 | Low | 160 Ų | 160 | 131.6 Ų | 131.6 | 86% | 0.856 | 70% | 0.696 | S | S | * | * | trans | -71.6 | 72.1 | 175.7 | -152.1 | 21.8 | 0 | 0 | 0 | 107.6 | T288 P292 | T288-N290 PolarHBondContact O-N 2.87Å; T288-N290 VanDerWaalsContact O-N 3.12Å; N290-P292 WeakPolarHBondContact O-CD 3.33Å | ||
| 291 | V | 60.4 | Low | 56.8 | Low | 75 Ų | 75 | 132.6 Ų | 132.6 | 46% | 0.455 | 70% | 0.695 | S | S | . | * | trans | -73.4 | 117.2 | 173 | -173.6 | 0 | 0 | 0 | 0 | 105.6 | V289 E293 T297 | V289-V291 HydrophobicContact CB-CG2 4.07Å; V289-V291 HydrophobicContact CG1-CG2 3.62Å; V289-V291 PolarHBondContact O-N 3.48Å; V291-E293 PolarHBondContact O-N 3.08Å; V291-T297 HydrophobicContact CG1-CG2 3.73Å | ||
| 292 | P | 63.6 | Low | 58 | Low | 71 Ų | 71 | 132 Ų | 132 | 46% | 0.461 | 69% | 0.691 | S | S | . | * | trans | -59.4 | 135 | 175.1 | -16.3 | 28.8 | 0 | 0 | 0 | 109 | N290 N294 V295 | N290-P292 WeakPolarHBondContact O-CD 3.33Å; P292-N294 PolarHBondContact O-N 3.09Å; P292-V295 HydrophobicContact CB-CG2 4.07Å; P292-V295 HydrophobicContact CG-CG2 3.97Å; P292-V295 PolarHBondContact O-N 3.14Å | ||
| 293 | E | 66.4 | Low | 59.2 | Low | 202 Ų | 202 | 132.5 Ų | 132.5 | 94% | 0.944 | 70% | 0.695 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -54.3 | -16.6 | -178.4 | -71.9 | -178 | 160.5 | 0 | 0 | 113.7 | V291 | V291-E293 PolarHBondContact O-N 3.08Š|
| 294 | N | 64 | Low | 60.3 | Low | 149 Ų | 149 | 132.7 Ų | 132.7 | 80% | 0.797 | 70% | 0.696 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -101.8 | -3.8 | -173.3 | -13 | 44.1 | 0 | 0 | 0 | 113.7 | P292 | P292-N294 PolarHBondContact O-N 3.09Š|
| 295 | V | 61 | Low | 61.9 | Low | 87 Ų | 87 | 132.1 Ų | 132.1 | 53% | 0.527 | 70% | 0.698 | S | S | . | * | trans | -93.8 | 102.7 | 175.2 | -178 | 0 | 0 | 0 | 0 | 107.6 | P292 T297 | P292-V295 HydrophobicContact CB-CG2 4.07Å; P292-V295 HydrophobicContact CG-CG2 3.97Å; P292-V295 PolarHBondContact O-N 3.14Å; V295-T297 PolarHBondContact O-N 2.76Å | ||
| 296 | S | 60.5 | Low | 63.4 | Low | 72 Ų | 72 | 132.3 Ų | 132.3 | 50% | 0.503 | 70% | 0.697 | S | S | . | * | trans | -58.6 | 102 | 166 | -179.7 | 0 | 0 | 0 | 0 | 107.9 | Y298 | S296-Y298 PolarHBondContact O-N 3.2Š| ||
| 297 | T | 63.2 | Low | 65.4 | Low | 83 Ų | 83 | 126 Ų | 126 | 51% | 0.509 | 68% | 0.68 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -66.8 | -1 | 177.6 | 47.8 | 0 | 0 | 0 | 0 | 112.9 | V291 V295 | V291-T297 HydrophobicContact CG1-CG2 3.73Å; V295-T297 PolarHBondContact O-N 2.76Å |
| 298 | Y | 62.7 | Low | 67 | Low | 170 Ų | 170 | 126.3 Ų | 126.3 | 67% | 0.667 | 68% | 0.679 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -126.5 | 43.1 | -174.9 | -54.1 | -75.8 | 0 | 0 | 0 | 111.2 | S296 N300 L301 | S296-Y298 PolarHBondContact O-N 3.2Å; Y298-N300 VanDerWaalsContact C-N 3.25Å; Y298-N300 PolarHBondContact O-N 2.88Å; Y298-L301 HydrophobicContact CD1-CD2 4.35Å |
| 299 | E | 60 | Low | 68.8 | Low | 164 Ų | 164 | 124 Ų | 124 | 77% | 0.766 | 67% | 0.668 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72.8 | -19 | 174.9 | -115.6 | 179.5 | -174.1 | 0 | 0 | 113.2 | ||
| 300 | N | 59.9 | Low | 70.3 | Confident | 146 Ų | 146 | 122.4 Ų | 122.4 | 78% | 0.781 | 65% | 0.653 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -131.1 | 57.5 | -176.7 | -62.4 | -53.2 | 0 | 0 | 0 | 111.7 | Y298 I302 | Y298-N300 VanDerWaalsContact C-N 3.25Å; Y298-N300 PolarHBondContact O-N 2.88Å; N300-I302 VanDerWaalsContact C-N 3.32Å; N300-I302 PolarHBondContact O-N 2.73Å |
| 301 | L | 64.3 | Low | 71.7 | Confident | 131 Ų | 131 | 119.4 Ų | 119.4 | 69% | 0.686 | 64% | 0.636 | S | S | * | * | trans | -64 | 106.3 | 154.4 | -64.8 | 178.3 | 0 | 0 | 0 | 105.3 | Y298 D303 | Y298-L301 HydrophobicContact CD1-CD2 4.35Å; L301-D303 PolarHBondContact O-N 3.39Å | ||
| 302 | I | 70.6 | Confident | 73.4 | Confident | 140 Ų | 140 | 119.4 Ų | 119.4 | 72% | 0.718 | 64% | 0.636 | S | S | * | * | trans | -54.7 | 118 | 168.9 | -64.3 | 168.2 | 0 | 0 | 0 | 104.8 | N300 L304 | N300-I302 VanDerWaalsContact C-N 3.32Å; N300-I302 PolarHBondContact O-N 2.73Å; I302-L304 HydrophobicContact CG2-CD2 4.18Å; I302-L304 PolarHBondContact O-N 3.35Å | ||
| 303 | D | 70.3 | Confident | 74.9 | Confident | 144 Ų | 144 | 121.6 Ų | 121.6 | 77% | 0.77 | 64% | 0.635 | S | S | * | * | trans | -60.6 | 94.1 | 171.9 | -72.8 | -34.2 | 0 | 0 | 0 | 107.3 | L301 T305 | L301-D303 PolarHBondContact O-N 3.39Å; D303-T305 VanDerWaalsContact C-N 3.29Å; D303-T305 PolarHBondContact O-N 3.04Å | ||
| 304 | L | 72.4 | Confident | 76.3 | Confident | 149 Ų | 149 | 116 Ų | 116 | 78% | 0.78 | 61% | 0.611 | S | S | * | * | trans | -73.9 | 91.4 | 173.8 | -68.5 | 175.5 | 0 | 0 | 0 | 106.4 | I302 V306 | I302-L304 HydrophobicContact CG2-CD2 4.18Å; I302-L304 PolarHBondContact O-N 3.35Å; L304-V306 PolarHBondContact O-N 3.44Å | ||
| 305 | T | 79.4 | Confident | 77.8 | Confident | 133 Ų | 133 | 112.7 Ų | 112.7 | 82% | 0.816 | 59% | 0.591 | S | S | * | * | trans | -74 | 117 | 169.4 | 53.5 | 0 | 0 | 0 | 0 | 108.2 | D303 | D303-T305 VanDerWaalsContact C-N 3.29Å; D303-T305 PolarHBondContact O-N 3.04Å | ||
| 306 | V | 81.6 | Confident | 79.5 | Confident | 98 Ų | 98 | 117.1 Ų | 117.1 | 59% | 0.594 | 60% | 0.598 | S | S | * | * | trans | -90.5 | 118.4 | 174.2 | 176.5 | 0 | 0 | 0 | 0 | 107.3 | L304 E308 I311 | L304-V306 PolarHBondContact O-N 3.44Å; V306-E308 PolarHBondContact O-N 3.3Å; V306-I311 HydrophobicContact CG1-CD1 3.22Å; V306-I311 HydrophobicContact CG1-CG1 4.17Å | ||
| 307 | D | 86 | Confident | 81.3 | Confident | 95 Ų | 95 | 119 Ų | 119 | 51% | 0.508 | 60% | 0.599 | S | S | . | * | trans | -76.6 | 102.7 | 172 | -176.2 | 3.8 | 0 | 0 | 0 | 109.6 | S309 E310 I311 | D307-S309 PolarHBondContact O-N 3Å; D307-S309 WeakPolarHBondContact OD1-CA 3.46Å; D307-S309 WeakPolarHBondContact OD1-CB 3.38Å; D307-S309 PolarHBondContact OD1-N 3.32Å; D307-S309 PolarHBondContact OD1-OG 3.14Å; D307-E310 HydrophobicContact CB-CB 3.95Å; D307-E310 PolarHBondContact O-N 3.45Å; D307-E310 VanDerWaalsContact O-N 3.12Å; D307-I311 PolarHBondContact O-N 3.4Å; D307-I311 VanDerWaalsContact O-N 3.17Å | ||
| 308 | E | 89.2 | Confident | 82.9 | Confident | 156 Ų | 156 | 121.4 Ų | 121.4 | 73% | 0.729 | 60% | 0.599 | S | S | * | * | H | α-helix | trans | -56 | -31.2 | 175.4 | -63.9 | -177.6 | 173.5 | 0 | 0 | 112 | V306 I311 V312 | V306-E308 PolarHBondContact O-N 3.3Å; E308-I311 PolarHBondContact O-N 3Å; E308-V312 WeakPolarHBondContact O-CG2 3.24Å; E308-V312 PolarHBondContact O-N 2.98Å |
| 309 | S | 89.2 | Confident | 84.4 | Confident | 74 Ų | 74 | 116.3 Ų | 116.3 | 52% | 0.517 | 58% | 0.583 | S | S | . | * | H | α-helix | trans | -68.8 | -40.1 | 178.9 | -51 | 0 | 0 | 0 | 0 | 111.5 | D307 V312 R313 | D307-S309 PolarHBondContact O-N 3Å; D307-S309 WeakPolarHBondContact OD1-CA 3.46Å; D307-S309 WeakPolarHBondContact OD1-CB 3.38Å; D307-S309 PolarHBondContact OD1-N 3.32Å; D307-S309 PolarHBondContact OD1-OG 3.14Å; S309-V312 PolarHBondContact O-N 3.47Å; S309-R313 WeakPolarHBondContact O-CB 3.28Å; S309-R313 PolarHBondContact O-N 2.87Å |
| 310 | E | 92.6 | Very high | 86.1 | Confident | 72 Ų | 72 | 111.3 Ų | 111.3 | 34% | 0.336 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -67.1 | -40 | 177.2 | -179.7 | 61.1 | -175.4 | 0 | 0 | 111.2 | D307 V312 R313 L314 | D307-E310 HydrophobicContact CB-CB 3.95Å; D307-E310 PolarHBondContact O-N 3.45Å; D307-E310 VanDerWaalsContact O-N 3.12Å; E310-V312 PolarHBondContact O-N 3.27Å; E310-R313 VanDerWaalsContact CD-NH2 3.31Å; E310-R313 PolarHBondContact O-N 3.32Å; E310-R313 IonicContact OE1-CZ 3.75Å; E310-R313 IonicContact OE1-NE 3.71Å; E310-R313 IonicContact OE1-NH2 2.78Å; E310-R313 PolarHBondContact OE1-NH2 3.47Å; E310-R313 IonicContact OE2-CZ 3.9Å; E310-R313 IonicContact OE2-NE 2.87Å; E310-R313 PolarHBondContact OE2-NE 2.85Å; E310-R313 IonicContact OE2-NH2 3.43Å; E310-R313 PolarHBondContact OE2-NH2 2.95Å; E310-L314 HydrophobicContact CG-CD1 4.06Å; E310-L314 HydrophobicContact CG-CG 4.47Å; E310-L314 WeakPolarHBondContact O-CB 3.45Å; E310-L314 WeakPolarHBondContact O-CG 3.22Å; E310-L314 PolarHBondContact O-N 2.96Å |
| 311 | I | 88.8 | Confident | 87.8 | Confident | 96 Ų | 96 | 106.2 Ų | 106.2 | 49% | 0.492 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -58.2 | -49.7 | 172.9 | -67.6 | 178.1 | 0 | 0 | 0 | 110.6 | V306 D307 E308 R313 L314 E315 | V306-I311 HydrophobicContact CG1-CD1 3.22Å; V306-I311 HydrophobicContact CG1-CG1 4.17Å; D307-I311 PolarHBondContact O-N 3.4Å; D307-I311 VanDerWaalsContact O-N 3.17Å; E308-I311 PolarHBondContact O-N 3Å; I311-R313 VanDerWaalsContact C-N 3.31Å; I311-R313 PolarHBondContact O-N 2.74Å; I311-L314 PolarHBondContact O-N 2.76Å; I311-E315 WeakPolarHBondContact O-CB 3.43Å; I311-E315 PolarHBondContact O-N 2.93Å |
| 312 | V | 95.2 | Very high | 89.3 | Confident | 75 Ų | 75 | 105.4 Ų | 105.4 | 46% | 0.455 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -63.1 | -39.5 | -179.8 | 171.6 | 0 | 0 | 0 | 0 | 111.2 | E308 S309 E310 R316 | E308-V312 WeakPolarHBondContact O-CG2 3.24Å; E308-V312 PolarHBondContact O-N 2.98Å; S309-V312 PolarHBondContact O-N 3.47Å; E310-V312 PolarHBondContact O-N 3.27Å; V312-R316 WeakPolarHBondContact O-CB 3.37Å; V312-R316 VanDerWaalsContact O-CG 3.29Å; V312-R316 WeakPolarHBondContact O-CG 3.35Å; V312-R316 PolarHBondContact O-N 3.43Å |
| 313 | R | 95.7 | Very high | 90.3 | Very high | 118 Ų | 118 | 107.1 Ų | 107.1 | 45% | 0.445 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -63.7 | -48.4 | 177.8 | -169.3 | -167.5 | 67.7 | 69.4 | -1 | 111.4 | S309 E310 I311 E315 R316 Q317 | S309-R313 WeakPolarHBondContact O-CB 3.28Å; S309-R313 PolarHBondContact O-N 2.87Å; E310-R313 VanDerWaalsContact CD-NH2 3.31Å; E310-R313 PolarHBondContact O-N 3.32Å; E310-R313 IonicContact OE1-CZ 3.75Å; E310-R313 IonicContact OE1-NE 3.71Å; E310-R313 IonicContact OE1-NH2 2.78Å; E310-R313 PolarHBondContact OE1-NH2 3.47Å; E310-R313 IonicContact OE2-CZ 3.9Å; E310-R313 IonicContact OE2-NE 2.87Å; E310-R313 PolarHBondContact OE2-NE 2.85Å; E310-R313 IonicContact OE2-NH2 3.43Å; E310-R313 PolarHBondContact OE2-NH2 2.95Å; I311-R313 VanDerWaalsContact C-N 3.31Å; I311-R313 PolarHBondContact O-N 2.74Å; R313-E315 VanDerWaalsContact C-N 3.34Å; R313-E315 PolarHBondContact O-N 3.42Å; R313-R316 PolarHBondContact O-N 2.84Å; R313-Q317 VanDerWaalsContact NH1-OE1 3.11Å; R313-Q317 WeakPolarHBondContact O-CB 3.18Å; R313-Q317 PolarHBondContact O-N 2.83Å |
| 314 | L | 95.5 | Very high | 91.4 | Very high | 84 Ų | 84 | 106.4 Ų | 106.4 | 44% | 0.44 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -63.4 | -39.7 | 179 | -73 | 172.9 | 0 | 0 | 0 | 111.7 | E310 I311 Q317 R318 | E310-L314 HydrophobicContact CG-CD1 4.06Å; E310-L314 HydrophobicContact CG-CG 4.47Å; E310-L314 WeakPolarHBondContact O-CB 3.45Å; E310-L314 WeakPolarHBondContact O-CG 3.22Å; E310-L314 PolarHBondContact O-N 2.96Å; I311-L314 PolarHBondContact O-N 2.76Å; L314-Q317 WeakPolarHBondContact O-CB 3.47Å; L314-Q317 PolarHBondContact O-N 3.33Å; L314-R318 WeakPolarHBondContact O-CB 3.4Å; L314-R318 PolarHBondContact O-N 3.03Å |
| 315 | E | 96.4 | Very high | 92.3 | Very high | 80 Ų | 80 | 108.1 Ų | 108.1 | 37% | 0.374 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -69.4 | -41 | 178.8 | -173.8 | 57.1 | -161.7 | 0 | 0 | 112.1 | I311 R313 Q317 R318 I319 | I311-E315 WeakPolarHBondContact O-CB 3.43Å; I311-E315 PolarHBondContact O-N 2.93Å; R313-E315 VanDerWaalsContact C-N 3.34Å; R313-E315 PolarHBondContact O-N 3.42Å; E315-Q317 VanDerWaalsContact C-N 3.29Å; E315-Q317 PolarHBondContact O-N 2.88Å; E315-R318 WeakPolarHBondContact O-CB 3.48Å; E315-R318 PolarHBondContact O-N 3.41Å; E315-R318 IonicContact OE1-CZ 3.44Å; E315-R318 IonicContact OE1-NE 3.82Å; E315-R318 PolarHBondContact OE1-NE 3.27Å; E315-R318 VanDerWaalsContact OE1-NE 3.11Å; E315-R318 IonicContact OE1-NH2 2.66Å; E315-R318 PolarHBondContact OE1-NH2 2.94Å; E315-R318 IonicContact OE2-CZ 2.74Å; E315-R318 IonicContact OE2-NE 3.49Å; E315-R318 PolarHBondContact OE2-NE 3.4Å; E315-R318 IonicContact OE2-NH2 3Å; E315-I319 HydrophobicContact CG-CD1 4.25Å; E315-I319 WeakPolarHBondContact O-CG1 2.88Å; E315-I319 PolarHBondContact O-N 2.87Å |
| 316 | R | 96.7 | Very high | 92.8 | Very high | 180 Ų | 180 | 107 Ų | 107 | 68% | 0.679 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -60 | -41.5 | 171.9 | -74.5 | 176.9 | -174.1 | -82.7 | -0.5 | 111.7 | V312 R313 I319 A320 | V312-R316 WeakPolarHBondContact O-CB 3.37Å; V312-R316 VanDerWaalsContact O-CG 3.29Å; V312-R316 WeakPolarHBondContact O-CG 3.35Å; V312-R316 PolarHBondContact O-N 3.43Å; R313-R316 PolarHBondContact O-N 2.84Å; R316-I319 PolarHBondContact O-N 3.41Å; R316-A320 WeakPolarHBondContact O-CB 3.41Å; R316-A320 PolarHBondContact O-N 3.35Å |
| 317 | Q | 97 | Very high | 93.1 | Very high | 111 Ų | 111 | 108.1 Ų | 108.1 | 52% | 0.519 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -63.8 | -42 | 176.1 | -174.6 | 176.1 | 8.5 | 0 | 0 | 111.5 | R313 L314 E315 A320 A321 | R313-Q317 VanDerWaalsContact NH1-OE1 3.11Å; R313-Q317 WeakPolarHBondContact O-CB 3.18Å; R313-Q317 PolarHBondContact O-N 2.83Å; L314-Q317 WeakPolarHBondContact O-CB 3.47Å; L314-Q317 PolarHBondContact O-N 3.33Å; E315-Q317 VanDerWaalsContact C-N 3.29Å; E315-Q317 PolarHBondContact O-N 2.88Å; Q317-A320 PolarHBondContact O-N 2.98Å; Q317-A321 WeakPolarHBondContact O-CB 3.38Å; Q317-A321 PolarHBondContact O-N 3.46Å |
| 318 | R | 97 | Very high | 93.1 | Very high | 134 Ų | 134 | 108 Ų | 108 | 51% | 0.506 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -59.4 | -47.9 | 176 | -167.5 | -172.8 | 74.7 | 81.8 | 2.4 | 111.6 | L314 E315 A321 Q322 | L314-R318 WeakPolarHBondContact O-CB 3.4Å; L314-R318 PolarHBondContact O-N 3.03Å; E315-R318 WeakPolarHBondContact O-CB 3.48Å; E315-R318 PolarHBondContact O-N 3.41Å; E315-R318 IonicContact OE1-CZ 3.44Å; E315-R318 IonicContact OE1-NE 3.82Å; E315-R318 PolarHBondContact OE1-NE 3.27Å; E315-R318 VanDerWaalsContact OE1-NE 3.11Å; E315-R318 IonicContact OE1-NH2 2.66Å; E315-R318 PolarHBondContact OE1-NH2 2.94Å; E315-R318 IonicContact OE2-CZ 2.74Å; E315-R318 IonicContact OE2-NE 3.49Å; E315-R318 PolarHBondContact OE2-NE 3.4Å; E315-R318 IonicContact OE2-NH2 3Å; R318-A321 PolarHBondContact O-N 2.97Å; R318-Q322 PolarHBondContact O-N 2.92Å |
| 319 | I | 95.3 | Very high | 92.7 | Very high | 63 Ų | 63 | 102.9 Ų | 102.9 | 32% | 0.323 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -64.2 | -43.5 | 178.5 | -66 | 166.4 | 0 | 0 | 0 | 111.1 | E315 R316 A321 Q322 R323 | E315-I319 HydrophobicContact CG-CD1 4.25Å; E315-I319 WeakPolarHBondContact O-CG1 2.88Å; E315-I319 PolarHBondContact O-N 2.87Å; R316-I319 PolarHBondContact O-N 3.41Å; I319-A321 PolarHBondContact O-N 3.32Å; I319-Q322 PolarHBondContact O-N 3.32Å; I319-R323 WeakPolarHBondContact O-CG 3.35Å; I319-R323 PolarHBondContact O-N 3.5Å |
| 320 | A | 95.1 | Very high | 92.1 | Very high | 58 Ų | 58 | 103.2 Ų | 103.2 | 48% | 0.479 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -62.7 | -42.4 | 177.3 | 0 | 0 | 0 | 0 | 0 | 111.9 | R316 Q317 R323 K324 | R316-A320 WeakPolarHBondContact O-CB 3.41Å; R316-A320 PolarHBondContact O-N 3.35Å; Q317-A320 PolarHBondContact O-N 2.98Å; A320-R323 PolarHBondContact O-N 3.4Å; A320-K324 WeakPolarHBondContact O-CB 3.48Å; A320-K324 PolarHBondContact O-N 2.93Å |
| 321 | A | 95.5 | Very high | 91.2 | Very high | 40 Ų | 40 | 109.4 Ų | 109.4 | 33% | 0.331 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -63.8 | -40.9 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112 | Q317 R318 I319 K324 R325 | Q317-A321 WeakPolarHBondContact O-CB 3.38Å; Q317-A321 PolarHBondContact O-N 3.46Å; R318-A321 PolarHBondContact O-N 2.97Å; I319-A321 PolarHBondContact O-N 3.32Å; A321-K324 PolarHBondContact O-N 3.43Å; A321-R325 WeakPolarHBondContact O-CG 3.32Å; A321-R325 PolarHBondContact O-N 2.88Å |
| 322 | Q | 94.8 | Very high | 90.1 | Very high | 114 Ų | 114 | 113.2 Ų | 113.2 | 53% | 0.533 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -63.2 | -45.8 | 175.6 | -172.9 | 178.2 | -0.1 | 0 | 0 | 111.8 | R318 I319 K324 R325 L326 | R318-Q322 PolarHBondContact O-N 2.92Å; I319-Q322 PolarHBondContact O-N 3.32Å; Q322-K324 VanDerWaalsContact C-N 3.34Å; Q322-K324 PolarHBondContact O-N 2.88Å; Q322-R325 PolarHBondContact O-N 3.05Å; Q322-L326 PolarHBondContact O-N 3.3Å |
| 323 | R | 93.6 | Very high | 88.5 | Confident | 175 Ų | 175 | 116 Ų | 116 | 66% | 0.66 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -60 | -42.9 | 175.6 | -73.1 | 177.2 | 179.3 | 178.4 | -0.5 | 112 | I319 A320 L326 L327 | I319-R323 WeakPolarHBondContact O-CG 3.35Å; I319-R323 PolarHBondContact O-N 3.5Å; A320-R323 PolarHBondContact O-N 3.4Å; R323-L326 PolarHBondContact O-N 2.99Å; R323-L327 WeakPolarHBondContact O-CG 3.07Å; R323-L327 PolarHBondContact O-N 3.22Å |
| 324 | K | 93.4 | Very high | 86.4 | Confident | 129 Ų | 129 | 117 Ų | 117 | 56% | 0.561 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -61.4 | -46 | 176.5 | -178.8 | 175.6 | 171.8 | 177.6 | 0 | 111.8 | A320 A321 Q322 L326 L327 E328 | A320-K324 WeakPolarHBondContact O-CB 3.48Å; A320-K324 PolarHBondContact O-N 2.93Å; A321-K324 PolarHBondContact O-N 3.43Å; Q322-K324 VanDerWaalsContact C-N 3.34Å; Q322-K324 PolarHBondContact O-N 2.88Å; K324-L326 VanDerWaalsContact C-N 3.33Å; K324-L326 PolarHBondContact O-N 2.73Å; K324-L327 PolarHBondContact O-N 2.75Å; K324-E328 WeakPolarHBondContact CE-OE1 3.34Å; K324-E328 IonicContact NZ-OE1 3.92Å; K324-E328 WeakPolarHBondContact O-CG 3.19Å; K324-E328 PolarHBondContact O-N 3.07Å |
| 325 | R | 91.1 | Very high | 84.4 | Confident | 186 Ų | 186 | 119 Ų | 119 | 70% | 0.702 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -60.7 | -40.9 | 176.9 | -73.2 | 177.1 | -172.1 | 168.4 | 2.7 | 112.3 | A321 Q322 E328 A329 | A321-R325 WeakPolarHBondContact O-CG 3.32Å; A321-R325 PolarHBondContact O-N 2.88Å; Q322-R325 PolarHBondContact O-N 3.05Å; R325-E328 PolarHBondContact O-N 2.85Å; R325-A329 WeakPolarHBondContact O-CB 3.37Å; R325-A329 PolarHBondContact O-N 2.95Å |
| 326 | L | 89.8 | Confident | 82 | Confident | 109 Ų | 109 | 124.4 Ų | 124.4 | 57% | 0.571 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -62.7 | -45.7 | 176.8 | -175.3 | 68.6 | 0 | 0 | 0 | 111.5 | Q322 R323 K324 E328 A329 N330 | Q322-L326 PolarHBondContact O-N 3.3Å; R323-L326 PolarHBondContact O-N 2.99Å; K324-L326 VanDerWaalsContact C-N 3.33Å; K324-L326 PolarHBondContact O-N 2.73Å; L326-E328 PolarHBondContact O-N 3.39Å; L326-A329 PolarHBondContact O-N 3.47Å; L326-N330 WeakPolarHBondContact O-CB 3.5Å; L326-N330 VanDerWaalsContact O-CG 3.27Å; L326-N330 PolarHBondContact O-N 2.82Å; L326-N330 PolarHBondContact O-ND2 2.86Å |
| 327 | L | 87.3 | Confident | 80 | Confident | 122 Ų | 122 | 121.2 Ų | 121.2 | 64% | 0.639 | 58% | 0.579 | S | S | * | * | H | α-helix | trans | -63.2 | -41.3 | 176.3 | -70.6 | 170.2 | 0 | 0 | 0 | 112.2 | R323 K324 N330 R331 | R323-L327 WeakPolarHBondContact O-CG 3.07Å; R323-L327 PolarHBondContact O-N 3.22Å; K324-L327 PolarHBondContact O-N 2.75Å; L327-N330 PolarHBondContact O-N 2.86Å; L327-R331 WeakPolarHBondContact O-CB 3.35Å; L327-R331 PolarHBondContact O-N 2.97Å |
| 328 | E | 86.1 | Confident | 77.8 | Confident | 93 Ų | 93 | 123.4 Ų | 123.4 | 44% | 0.435 | 59% | 0.594 | S | S | . | * | H | α-helix | trans | -66.6 | -37.1 | 176.1 | -74.2 | 176.2 | -175.9 | 0 | 0 | 112.6 | K324 R325 L326 R331 K332 | K324-E328 WeakPolarHBondContact CE-OE1 3.34Å; K324-E328 IonicContact NZ-OE1 3.92Å; K324-E328 WeakPolarHBondContact O-CG 3.19Å; K324-E328 PolarHBondContact O-N 3.07Å; R325-E328 PolarHBondContact O-N 2.85Å; L326-E328 PolarHBondContact O-N 3.39Å; E328-R331 PolarHBondContact O-N 3.36Å; E328-K332 WeakPolarHBondContact O-CG 3.44Å; E328-K332 PolarHBondContact O-N 3.25Å; E328-K332 VanDerWaalsContact O-N 3.17Å |
| 329 | A | 81.6 | Confident | 75.9 | Confident | 48 Ų | 48 | 125 Ų | 125 | 40% | 0.397 | 61% | 0.607 | S | S | . | * | H | α-helix | trans | -64.7 | -46.4 | 173.6 | 0 | 0 | 0 | 0 | 0 | 111.1 | R325 L326 R331 K332 Q333 | R325-A329 WeakPolarHBondContact O-CB 3.37Å; R325-A329 PolarHBondContact O-N 2.95Å; L326-A329 PolarHBondContact O-N 3.47Å; A329-R331 VanDerWaalsContact C-N 3.29Å; A329-R331 PolarHBondContact O-N 2.87Å; A329-K332 PolarHBondContact O-N 3.29Å; A329-K332 VanDerWaalsContact O-N 3.12Å; A329-Q333 PolarHBondContact O-N 3.44Å; A329-Q333 VanDerWaalsContact O-N 3.11Å |
| 330 | N | 76.6 | Confident | 74.4 | Confident | 80 Ų | 80 | 127 Ų | 127 | 43% | 0.428 | 62% | 0.624 | S | S | . | * | H | α-helix | trans | -62.1 | -36.6 | 175.2 | -69.7 | -22.5 | 0 | 0 | 0 | 111.8 | L326 L327 K332 Q333 N334 | L326-N330 WeakPolarHBondContact O-CB 3.5Å; L326-N330 VanDerWaalsContact O-CG 3.27Å; L326-N330 PolarHBondContact O-N 2.82Å; L326-N330 PolarHBondContact O-ND2 2.86Å; L327-N330 PolarHBondContact O-N 2.86Å; N330-K332 VanDerWaalsContact C-N 3.29Å; N330-K332 PolarHBondContact O-N 3.46Å; N330-Q333 PolarHBondContact O-N 3.29Å; N330-Q333 VanDerWaalsContact O-N 3.14Å; N330-N334 PolarHBondContact O-N 3.31Å; N330-N334 VanDerWaalsContact O-N 3.08Å |
| 331 | R | 71.7 | Confident | 73.1 | Confident | 203 Ų | 203 | 133.1 Ų | 133.1 | 77% | 0.766 | 64% | 0.643 | S | S | * | * | H | α-helix | trans | -65.8 | -30.9 | 175.9 | -156.7 | -175.3 | 94.1 | 103 | 0.1 | 112.8 | L327 E328 A329 | L327-R331 WeakPolarHBondContact O-CB 3.35Å; L327-R331 PolarHBondContact O-N 2.97Å; E328-R331 PolarHBondContact O-N 3.36Å; A329-R331 VanDerWaalsContact C-N 3.29Å; A329-R331 PolarHBondContact O-N 2.87Å |
| 332 | K | 65.8 | Low | 71.9 | Confident | 175 Ų | 175 | 136.2 Ų | 136.2 | 76% | 0.761 | 66% | 0.66 | S | S | * | * | H | α-helix | trans | -77.1 | -24.7 | 174.3 | -69.2 | 177.7 | -175.8 | -177.6 | 0 | 112.4 | E328 A329 N330 | E328-K332 WeakPolarHBondContact O-CG 3.44Å; E328-K332 PolarHBondContact O-N 3.25Å; E328-K332 VanDerWaalsContact O-N 3.17Å; A329-K332 PolarHBondContact O-N 3.29Å; A329-K332 VanDerWaalsContact O-N 3.12Å; N330-K332 VanDerWaalsContact C-N 3.29Å; N330-K332 PolarHBondContact O-N 3.46Å |
| 333 | Q | 61.5 | Low | 71 | Confident | 134 Ų | 134 | 135.3 Ų | 135.3 | 63% | 0.626 | 66% | 0.658 | S | S | * | * | H | α-helix | trans | -82.9 | -13.9 | 174 | -72.5 | -171.4 | -10.4 | 0 | 0 | 114 | A329 N330 I335 | A329-Q333 PolarHBondContact O-N 3.44Å; A329-Q333 VanDerWaalsContact O-N 3.11Å; N330-Q333 PolarHBondContact O-N 3.29Å; N330-Q333 VanDerWaalsContact O-N 3.14Å; Q333-I335 PolarHBondContact O-N 2.83Å |
| 334 | N | 52.3 | Low | 70 | Confident | 139 Ų | 139 | 133.7 Ų | 133.7 | 74% | 0.743 | 66% | 0.662 | S | S | * | * | trans | -71.4 | 62.7 | 154.9 | -85.2 | -17 | 0 | 0 | 0 | 109.5 | N330 K336 | N330-N334 PolarHBondContact O-N 3.31Å; N330-N334 VanDerWaalsContact O-N 3.08Å; N334-K336 PolarHBondContact O-N 3.48Å | ||
| 335 | I | 54 | Low | 69 | Low | 126 Ų | 126 | 133.4 Ų | 133.4 | 65% | 0.646 | 67% | 0.666 | S | S | * | * | trans | -45 | 129.1 | 143.9 | -66 | 166 | 0 | 0 | 0 | 104.5 | Q333 V337 | Q333-I335 PolarHBondContact O-N 2.83Å; I335-V337 PolarHBondContact O-N 2.91Å | ||
| 336 | K | 45.7 | Very low | 68.1 | Low | 194 Ų | 194 | 131.6 Ų | 131.6 | 84% | 0.843 | 67% | 0.666 | S | S | * | * | trans | -57.6 | 80.9 | 166 | -68.5 | 178.2 | 174.9 | -171.7 | 0 | 107.7 | N334 D338 | N334-K336 PolarHBondContact O-N 3.48Å; K336-D338 PolarHBondContact O-N 3.38Å | ||
| 337 | V | 55.3 | Low | 67.4 | Low | 113 Ų | 113 | 134 Ų | 134 | 69% | 0.685 | 67% | 0.672 | S | S | * | * | trans | -63.8 | 117 | 146.9 | -179.6 | 0 | 0 | 0 | 0 | 101.7 | I335 E339 | I335-V337 PolarHBondContact O-N 2.91Å; V337-E339 PolarHBondContact O-N 3Å | ||
| 338 | D | 50.4 | Low | 66.5 | Low | 156 Ų | 156 | 133.1 Ų | 133.1 | 83% | 0.834 | 66% | 0.663 | S | S | * | * | trans | -60.1 | 80.4 | 162.6 | -83.8 | -36.2 | 0 | 0 | 0 | 105.7 | K336 P340 | K336-D338 PolarHBondContact O-N 3.38Å; D338-P340 WeakPolarHBondContact O-CD 3.17Å | ||
| 339 | E | 56.9 | Low | 65.8 | Low | 168 Ų | 168 | 131 Ų | 131 | 79% | 0.785 | 66% | 0.655 | S | S | * | * | P | Polyproline II helix | trans | -71.1 | 117.7 | 172.2 | -156.9 | 172.9 | -157.5 | 0 | 0 | 104.4 | V337 | V337-E339 PolarHBondContact O-N 3Š|
| 340 | P | 63.4 | Low | 65.5 | Low | 106 Ų | 106 | 133.6 Ų | 133.6 | 69% | 0.688 | 67% | 0.667 | S | S | * | * | P | Polyproline II helix | trans | -57.6 | 151.1 | 175.7 | 24.7 | -31.8 | 0 | 0 | 0 | 109.1 | D338 | D338-P340 WeakPolarHBondContact O-CD 3.17Š|
| 341 | E | 69.3 | Low | 65.4 | Low | 185 Ų | 185 | 136.5 Ų | 136.5 | 86% | 0.864 | 68% | 0.683 | S | S | * | * | P | Polyproline II helix | trans | -46.2 | 125.9 | 176.4 | -173.3 | 175.5 | -178.5 | 0 | 0 | 109.5 | D343 | E341-D343 PolarHBondContact O-N 2.88Š|
| 342 | P | 69.4 | Low | 65.5 | Low | 106 Ų | 106 | 136.7 Ų | 136.7 | 69% | 0.688 | 68% | 0.684 | S | S | * | * | trans | -61 | 114.6 | -172.4 | 22.4 | -32.8 | 0 | 0 | 0 | 109.9 | L344 | P342-L344 PolarHBondContact O-N 3.18Å; P342-L344 VanDerWaalsContact O-N 3.17Å | ||
| 343 | D | 75.9 | Confident | 66 | Low | 94 Ų | 94 | 132.1 Ų | 132.1 | 50% | 0.503 | 67% | 0.665 | S | S | . | * | trans | -74.7 | 105.7 | 175.8 | -176.7 | 3.7 | 0 | 0 | 0 | 108.9 | E341 L345 E346 | E341-D343 PolarHBondContact O-N 2.88Å; D343-L345 PolarHBondContact O-N 3.11Å; D343-L345 WeakPolarHBondContact OD1-CB 3.34Å; D343-L345 PolarHBondContact OD1-N 3.25Å; D343-E346 HydrophobicContact CB-CB 4.19Å; D343-E346 VanDerWaalsContact O-CB 3.28Å; D343-E346 WeakPolarHBondContact O-CB 3.2Å; D343-E346 PolarHBondContact O-N 3.44Å | ||
| 344 | L | 71.8 | Confident | 66.4 | Low | 141 Ų | 141 | 131 Ų | 131 | 74% | 0.738 | 67% | 0.667 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -59 | -20 | 177.2 | -61.4 | 177.3 | 0 | 0 | 0 | 112.5 | P342 | P342-L344 PolarHBondContact O-N 3.18Å; P342-L344 VanDerWaalsContact O-N 3.17Å |
| 345 | L | 72.7 | Confident | 67.1 | Low | 123 Ų | 123 | 131.7 Ų | 131.7 | 64% | 0.644 | 66% | 0.66 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87.4 | -11.7 | 176.1 | -95.2 | 64.5 | 0 | 0 | 0 | 113.7 | D343 F347 F348 | D343-L345 PolarHBondContact O-N 3.11Å; D343-L345 WeakPolarHBondContact OD1-CB 3.34Å; D343-L345 PolarHBondContact OD1-N 3.25Å; L345-F347 PolarHBondContact O-N 2.82Å; L345-F348 HydrophobicContact CG-CB 4.42Å; L345-F348 CarbonylContact O-C 3.59Å; L345-F348 WeakPolarHBondContact O-CA 3.35Å; L345-F348 WeakPolarHBondContact O-CB 3.45Å; L345-F348 PolarHBondContact O-N 3.36Å |
| 346 | E | 73.4 | Confident | 67.4 | Low | 149 Ų | 149 | 134 Ų | 134 | 70% | 0.696 | 67% | 0.668 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -59.1 | -37 | 178 | -174.8 | 177.2 | -180 | 0 | 0 | 111.3 | D343 F348 | D343-E346 HydrophobicContact CB-CB 4.19Å; D343-E346 VanDerWaalsContact O-CB 3.28Å; D343-E346 WeakPolarHBondContact O-CB 3.2Å; D343-E346 PolarHBondContact O-N 3.44Å; E346-F348 VanDerWaalsContact C-N 3.34Å |
| 347 | F | 73.8 | Confident | 68.3 | Low | 158 Ų | 158 | 129.9 Ų | 129.9 | 69% | 0.693 | 66% | 0.664 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.6 | -18.1 | 174.8 | -57.7 | -73.1 | 0 | 0 | 0 | 112.9 | L345 D349 H353 | L345-F347 PolarHBondContact O-N 2.82Å; F347-D349 PolarHBondContact O-N 2.97Å; F347-D349 VanDerWaalsContact O-N 3.13Å; F347-H353 PolarHBondContact O-CE1 3.19Å; F347-H353 PolarHBondContact O-ND1 2.8Å |
| 348 | F | 69 | Low | 68.6 | Low | 104 Ų | 104 | 129.3 Ų | 129.3 | 46% | 0.456 | 66% | 0.66 | S | S | . | * | trans | -83.9 | 83.5 | 177.9 | -101.5 | -100.2 | 0 | 0 | 0 | 110.6 | L345 E346 P350 Y355 | L345-F348 HydrophobicContact CG-CB 4.42Å; L345-F348 CarbonylContact O-C 3.59Å; L345-F348 WeakPolarHBondContact O-CA 3.35Å; L345-F348 WeakPolarHBondContact O-CB 3.45Å; L345-F348 PolarHBondContact O-N 3.36Å; E346-F348 VanDerWaalsContact C-N 3.34Å; F348-P350 VanDerWaalsContact O-CD 3.24Å; F348-P350 WeakPolarHBondContact O-CD 3.24Å; F348-Y355 HydrophobicContact CD1-CE2 4.28Å; F348-Y355 HydrophobicContact CE1-CD2 4.44Å; F348-Y355 AromaticContact CE1-CE2 3.37Å; F348-Y355 HydrophobicContact CE1-CE2 3.37Å; F348-Y355 AromaticContact CE1-CZ 3.89Å; F348-Y355 AromaticContact CZ-CE2 3.78Å; F348-Y355 HydrophobicContact CZ-CE2 3.78Å; F348-Y355 AromaticContact CZ-CZ 3.79Å; F348-Y355 WeakPolarHBondContact CZ-OH 3.42Å | ||
| 349 | D | 72 | Confident | 68.7 | Low | 50 Ų | 50 | 128.2 Ų | 128.2 | 27% | 0.267 | 65% | 0.654 | S | S | . | * | trans | -79.4 | 111.8 | 161.2 | 176.5 | 1.7 | 0 | 0 | 0 | 109.5 | F347 N351 R352 H353 | F347-D349 PolarHBondContact O-N 2.97Å; F347-D349 VanDerWaalsContact O-N 3.13Å; D349-N351 PolarHBondContact O-N 2.79Å; D349-N351 VanDerWaalsContact O-N 3.1Å; D349-N351 WeakPolarHBondContact OD1-CA 3.38Å; D349-N351 VanDerWaalsContact OD1-CB 3.25Å; D349-N351 WeakPolarHBondContact OD1-CB 3.32Å; D349-N351 PolarHBondContact OD1-N 2.83Å; D349-N351 PolarHBondContact OD1-ND2 3.45Å; D349-R352 HydrophobicContact CB-CB 4.05Å; D349-R352 HydrophobicContact CB-CG 4.42Å; D349-R352 PolarHBondContact O-N 3.47Å; D349-R352 VanDerWaalsContact O-N 3.08Å; D349-R352 VanDerWaalsContact OD2-CD 3.24Å; D349-R352 WeakPolarHBondContact OD2-CD 3.25Å; D349-R352 WeakPolarHBondContact OD2-CG 3.01Å; D349-R352 IonicContact OD2-NE 3.41Å; D349-H353 PolarHBondContact N-ND1 3.08Å; D349-H353 WeakPolarHBondContact O-CA 3.48Å; D349-H353 VanDerWaalsContact O-CB 3.31Å; D349-H353 WeakPolarHBondContact O-CB 3.19Å; D349-H353 PolarHBondContact O-N 3.43Å; D349-H353 PolarHBondContact O-ND1 3.24Å | ||
| 350 | P | 74.5 | Confident | 68.7 | Low | 101 Ų | 101 | 126.3 Ų | 126.3 | 66% | 0.656 | 65% | 0.649 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -61 | -21.1 | 179 | -21.7 | 34.9 | 0 | 0 | 0 | 113.6 | F348 V354 | F348-P350 VanDerWaalsContact O-CD 3.24Å; F348-P350 WeakPolarHBondContact O-CD 3.24Å; P350-V354 WeakPolarHBondContact O-CG2 3.44Å |
| 351 | N | 75.8 | Confident | 68.1 | Low | 142 Ų | 142 | 127.6 Ų | 127.6 | 76% | 0.759 | 65% | 0.646 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.2 | -27.1 | 178.3 | -52 | -68.5 | 0 | 0 | 0 | 112.5 | D349 | D349-N351 PolarHBondContact O-N 2.79Å; D349-N351 VanDerWaalsContact O-N 3.1Å; D349-N351 WeakPolarHBondContact OD1-CA 3.38Å; D349-N351 VanDerWaalsContact OD1-CB 3.25Å; D349-N351 WeakPolarHBondContact OD1-CB 3.32Å; D349-N351 PolarHBondContact OD1-N 2.83Å; D349-N351 PolarHBondContact OD1-ND2 3.45Å |
| 352 | R | 73.6 | Confident | 67.3 | Low | 206 Ų | 206 | 124 Ų | 124 | 78% | 0.777 | 64% | 0.641 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -96.3 | -38.8 | 175.5 | -73.8 | 173.8 | 177.7 | -95.2 | 1 | 112.5 | D349 V354 | D349-R352 HydrophobicContact CB-CB 4.05Å; D349-R352 HydrophobicContact CB-CG 4.42Å; D349-R352 PolarHBondContact O-N 3.47Å; D349-R352 VanDerWaalsContact O-N 3.08Å; D349-R352 VanDerWaalsContact OD2-CD 3.24Å; D349-R352 WeakPolarHBondContact OD2-CD 3.25Å; D349-R352 WeakPolarHBondContact OD2-CG 3.01Å; D349-R352 IonicContact OD2-NE 3.41Å; R352-V354 PolarHBondContact O-N 3.17Å |
| 353 | H | 75.2 | Confident | 66.4 | Low | 80 Ų | 80 | 128 Ų | 128 | 37% | 0.37 | 65% | 0.648 | S | S | . | * | trans | -93.2 | 53.5 | -179.4 | -54.1 | 92.8 | 0 | 0 | 0 | 110.2 | F347 D349 Y355 | F347-H353 PolarHBondContact O-CE1 3.19Å; F347-H353 PolarHBondContact O-ND1 2.8Å; D349-H353 PolarHBondContact N-ND1 3.08Å; D349-H353 WeakPolarHBondContact O-CA 3.48Å; D349-H353 VanDerWaalsContact O-CB 3.31Å; D349-H353 WeakPolarHBondContact O-CB 3.19Å; D349-H353 PolarHBondContact O-N 3.43Å; D349-H353 PolarHBondContact O-ND1 3.24Å; H353-Y355 VanDerWaalsContact C-N 3.33Å; H353-Y355 HydrophobicContact CB-CE2 4.08Å; H353-Y355 WeakPolarHBondContact O-CD2 3.31Å; H353-Y355 PolarHBondContact O-N 2.78Å; H353-Y355 VanDerWaalsContact O-N 3.07Å | ||
| 354 | V | 70.9 | Confident | 65.1 | Low | 110 Ų | 110 | 126.7 Ų | 126.7 | 67% | 0.667 | 66% | 0.657 | S | S | * | * | trans | -75.1 | 95.7 | 163.2 | -178.4 | 0 | 0 | 0 | 0 | 106.3 | P350 R352 Q356 | P350-V354 WeakPolarHBondContact O-CG2 3.44Å; R352-V354 PolarHBondContact O-N 3.17Å; V354-Q356 PolarHBondContact O-N 3.11Å | ||
| 355 | Y | 65.5 | Low | 64 | Low | 154 Ų | 154 | 126.4 Ų | 126.4 | 60% | 0.604 | 65% | 0.654 | S | S | * | * | trans | -61.9 | 107.7 | 168 | -66.6 | -90.1 | 0 | 0 | 0 | 107.3 | F348 H353 S357 | F348-Y355 HydrophobicContact CD1-CE2 4.28Å; F348-Y355 HydrophobicContact CE1-CD2 4.44Å; F348-Y355 AromaticContact CE1-CE2 3.37Å; F348-Y355 HydrophobicContact CE1-CE2 3.37Å; F348-Y355 AromaticContact CE1-CZ 3.89Å; F348-Y355 AromaticContact CZ-CE2 3.78Å; F348-Y355 HydrophobicContact CZ-CE2 3.78Å; F348-Y355 AromaticContact CZ-CZ 3.79Å; F348-Y355 WeakPolarHBondContact CZ-OH 3.42Å; H353-Y355 VanDerWaalsContact C-N 3.33Å; H353-Y355 HydrophobicContact CB-CE2 4.08Å; H353-Y355 WeakPolarHBondContact O-CD2 3.31Å; H353-Y355 PolarHBondContact O-N 2.78Å; H353-Y355 VanDerWaalsContact O-N 3.07Å; Y355-S357 PolarHBondContact O-N 3.12Å | ||
| 356 | Q | 61.5 | Low | 62.8 | Low | 175 Ų | 175 | 131.3 Ų | 131.3 | 82% | 0.818 | 66% | 0.664 | S | S | * | * | trans | -65.7 | 93.7 | 159.6 | -170.9 | 175.2 | 20.3 | 0 | 0 | 105.7 | V354 V358 | V354-Q356 PolarHBondContact O-N 3.11Å; Q356-V358 VanDerWaalsContact C-N 3.27Å; Q356-V358 PolarHBondContact O-N 3.14Å | ||
| 357 | S | 64.5 | Low | 61.7 | Low | 107 Ų | 107 | 128.7 Ų | 128.7 | 75% | 0.748 | 66% | 0.662 | S | S | * | * | trans | -62.3 | 99.7 | 166.7 | 51.7 | 0 | 0 | 0 | 0 | 106.3 | Y355 N359 | Y355-S357 PolarHBondContact O-N 3.12Å; S357-N359 PolarHBondContact O-N 2.84Å | ||
| 358 | V | 60.4 | Low | 60.3 | Low | 101 Ų | 101 | 129.1 Ų | 129.1 | 61% | 0.612 | 67% | 0.671 | S | S | * | * | trans | -61.9 | 110.1 | 161.5 | -75.3 | 0 | 0 | 0 | 0 | 104.9 | Q356 L360 | Q356-V358 VanDerWaalsContact C-N 3.27Å; Q356-V358 PolarHBondContact O-N 3.14Å; V358-L360 HydrophobicContact CG2-CD2 4.1Å; V358-L360 HydrophobicContact CG2-CG 4.11Å; V358-L360 PolarHBondContact O-N 3.38Å | ||
| 359 | N | 54.4 | Low | 59.4 | Low | 132 Ų | 132 | 130.7 Ų | 130.7 | 71% | 0.706 | 68% | 0.683 | S | S | * | * | trans | -64.5 | 87.4 | 169 | -170.2 | -1.8 | 0 | 0 | 0 | 105.9 | S357 Q361 | S357-N359 PolarHBondContact O-N 2.84Å; N359-Q361 PolarHBondContact O-N 3.08Å | ||
| 360 | L | 55.6 | Low | 58.3 | Low | 128 Ų | 128 | 133.6 Ų | 133.6 | 67% | 0.67 | 71% | 0.705 | S | S | * | * | trans | -65.8 | 86 | 173.1 | -68.4 | 177 | 0 | 0 | 0 | 105.7 | V358 S362 | V358-L360 HydrophobicContact CG2-CD2 4.1Å; V358-L360 HydrophobicContact CG2-CG 4.11Å; V358-L360 PolarHBondContact O-N 3.38Å; L360-S362 PolarHBondContact O-N 3Å | ||
| 361 | Q | 50.2 | Low | 57.2 | Low | 134 Ų | 134 | 133.3 Ų | 133.3 | 63% | 0.626 | 70% | 0.701 | S | S | * | * | trans | -59.7 | 110 | 165.9 | -66.3 | -144 | -6.3 | 0 | 0 | 106 | N359 K363 | N359-Q361 PolarHBondContact O-N 3.08Å; Q361-K363 PolarHBondContact O-N 3.38Å | ||
| 362 | S | 54.1 | Low | 56 | Low | 109 Ų | 109 | 131.6 Ų | 131.6 | 76% | 0.762 | 69% | 0.692 | S | S | * | * | trans | -64.9 | 12.4 | -179.9 | 52.2 | 0 | 0 | 0 | 0 | 113.7 | L360 G364 | L360-S362 PolarHBondContact O-N 3Å; S362-G364 PolarHBondContact O-N 3.17Å | ||
| 363 | K | 49.4 | Very low | 55.1 | Low | 190 Ų | 190 | 130.1 Ų | 130.1 | 83% | 0.826 | 69% | 0.693 | S | S | * | * | S | Bend | trans | -74.6 | 76.1 | 168.9 | -75.8 | 178.4 | 176.8 | 174.5 | 0 | 109.7 | Q361 | Q361-K363 PolarHBondContact O-N 3.38Š|
| 364 | G | 48.9 | Very low | 54.4 | Low | 67 Ų | 67 | 132.2 Ų | 132.2 | 69% | 0.691 | 72% | 0.715 | S | S | * | * | S | Bend | trans | 147.5 | -7.6 | 158.8 | 0 | 0 | 0 | 0 | 0 | 117.8 | S362 R366 | S362-G364 PolarHBondContact O-N 3.17Å; G364-R366 PolarHBondContact O-N 3.41Å |
| 365 | I | 48.2 | Very low | 54 | Low | 135 Ų | 135 | 128.4 Ų | 128.4 | 69% | 0.692 | 70% | 0.695 | S | S | * | * | trans | -78.8 | 94.7 | 172.9 | -48.3 | 175.3 | 0 | 0 | 0 | 106.7 | S367 | I365-S367 PolarHBondContact O-N 3.17Š| ||
| 366 | R | 47.9 | Very low | 54.3 | Low | 226 Ų | 226 | 124.4 Ų | 124.4 | 85% | 0.853 | 69% | 0.69 | S | S | * | * | trans | -51.4 | 117.3 | 164 | -68.8 | -173.4 | -174.3 | 178.4 | 2.3 | 105.8 | G364 L368 | G364-R366 PolarHBondContact O-N 3.41Å; R366-L368 PolarHBondContact O-N 3.04Å | ||
| 367 | S | 49.6 | Very low | 55 | Low | 94 Ų | 94 | 122.3 Ų | 122.3 | 66% | 0.657 | 69% | 0.685 | S | S | * | * | trans | -53.6 | 104.7 | 178.3 | 55.7 | 0 | 0 | 0 | 0 | 108.6 | I365 L369 | I365-S367 PolarHBondContact O-N 3.17Å; S367-L369 PolarHBondContact O-N 3.08Å; S367-L369 VanDerWaalsContact O-N 3.12Å | ||
| 368 | L | 45.4 | Very low | 55.7 | Low | 166 Ų | 166 | 123.1 Ų | 123.1 | 87% | 0.869 | 68% | 0.68 | S | S | * | * | trans | -78.5 | 29.5 | 166.5 | -66.2 | 174.9 | 0 | 0 | 0 | 110.4 | R366 P370 | R366-L368 PolarHBondContact O-N 3.04Å; L368-P370 VanDerWaalsContact O-CD 3.31Å; L368-P370 WeakPolarHBondContact O-CD 3.23Å | ||
| 369 | L | 49.4 | Very low | 56.4 | Low | 137 Ų | 137 | 123.7 Ų | 123.7 | 72% | 0.717 | 68% | 0.68 | S | S | * | * | S | Bend | trans | -64.2 | 117.9 | 159.7 | -95.2 | 148.2 | 0 | 0 | 0 | 105.1 | S367 T371 | S367-L369 PolarHBondContact O-N 3.08Å; S367-L369 VanDerWaalsContact O-N 3.12Å; L369-T371 PolarHBondContact O-N 3.1Å |
| 370 | P | 50.5 | Low | 57.5 | Low | 111 Ų | 111 | 118.8 Ų | 118.8 | 72% | 0.721 | 65% | 0.654 | S | S | * | * | trans | -50.4 | 119.2 | 173.2 | -20 | 30.2 | 0 | 0 | 0 | 106.1 | L368 L372 | L368-P370 VanDerWaalsContact O-CD 3.31Å; L368-P370 WeakPolarHBondContact O-CD 3.23Å; P370-L372 VanDerWaalsContact C-N 3.3Å; P370-L372 PolarHBondContact O-N 3.18Å | ||
| 371 | T | 50.1 | Low | 58.6 | Low | 95 Ų | 95 | 117.2 Ų | 117.2 | 58% | 0.583 | 65% | 0.647 | S | S | * | * | trans | -62.2 | 103 | 178.9 | -43.2 | 0 | 0 | 0 | 0 | 105.7 | L369 H373 C374 | L369-T371 PolarHBondContact O-N 3.1Å; T371-H373 HydrophobicContact CG2-CB 3.78Å; T371-H373 PolarHBondContact O-N 3Å; T371-C374 PolarHBondContact O-N 3.04Å; T371-C374 VanDerWaalsContact O-N 3.08Å | ||
| 372 | L | 51.3 | Low | 59.9 | Low | 106 Ų | 106 | 115.7 Ų | 115.7 | 56% | 0.555 | 65% | 0.646 | S | S | * | * | G | 310 helix | trans | -54 | -11.6 | 177.3 | -86.9 | 161.6 | 0 | 0 | 0 | 112.1 | P370 C374 A375 V380 | P370-L372 VanDerWaalsContact C-N 3.3Å; P370-L372 PolarHBondContact O-N 3.18Å; L372-C374 PolarHBondContact O-N 3.13Å; L372-A375 PolarHBondContact O-N 2.87Å; L372-A375 VanDerWaalsContact O-N 3.13Å; L372-V380 HydrophobicContact CD2-CG2 4.46Å |
| 373 | H | 53.9 | Low | 61 | Low | 176 Ų | 176 | 115.9 Ų | 115.9 | 82% | 0.815 | 63% | 0.634 | S | S | * | * | G | 310 helix | trans | -58.3 | -20 | 170 | -79.6 | -48.2 | 0 | 0 | 0 | 115.6 | T371 | T371-H373 HydrophobicContact CG2-CB 3.78Å; T371-H373 PolarHBondContact O-N 3Å |
| 374 | C | 60 | Low | 62.4 | Low | 123 Ų | 123 | 112.5 Ų | 112.5 | 83% | 0.831 | 62% | 0.621 | S | S | * | * | G | 310 helix | trans | -93.1 | -5.7 | 176.7 | -61.7 | 0 | 0 | 0 | 0 | 113.5 | T371 L372 | T371-C374 PolarHBondContact O-N 3.04Å; T371-C374 VanDerWaalsContact O-N 3.08Å; L372-C374 PolarHBondContact O-N 3.13Å |
| 375 | A | 62.9 | Low | 63.6 | Low | 30 Ų | 30 | 115.6 Ų | 115.6 | 25% | 0.248 | 62% | 0.617 | C | S | . | * | S | Bend | trans | -80.6 | 143 | 175.2 | 0 | 0 | 0 | 0 | 0 | 109.6 | L372 L379 V380 | L372-A375 PolarHBondContact O-N 2.87Å; L372-A375 VanDerWaalsContact O-N 3.13Å; A375-L379 HydrophobicContact CB-CB 4.31Å; A375-L379 HydrophobicContact CB-CD2 4.23Å; A375-V380 HydrophobicContact CB-CG2 3.82Å |
| 376 | S | 72.4 | Confident | 65 | Low | 70 Ų | 70 | 115.2 Ų | 115.2 | 49% | 0.49 | 61% | 0.61 | S | S | . | * | trans | -61.2 | 148 | 170.2 | 56.2 | 0 | 0 | 0 | 0 | 110 | D378 L379 V380 | S376-D378 PolarHBondContact O-N 3.36Å; S376-D378 VanDerWaalsContact O-N 3.09Å; S376-L379 WeakPolarHBondContact O-CB 3.39Å; S376-L379 PolarHBondContact O-N 3.44Å; S376-V380 PolarHBondContact O-N 3.25Å; S376-V380 VanDerWaalsContact O-N 3.14Å | ||
| 377 | D | 77.1 | Confident | 66.4 | Low | 132 Ų | 132 | 107.7 Ų | 107.7 | 71% | 0.706 | 59% | 0.586 | S | S | * | * | H | α-helix | trans | -53.8 | -32.6 | 178.5 | -71 | -27.6 | 0 | 0 | 0 | 111.8 | L379 V380 N381 | D377-L379 PolarHBondContact O-N 3.27Å; D377-V380 PolarHBondContact O-N 3.07Å; D377-N381 WeakPolarHBondContact O-CB 3.44Å; D377-N381 VanDerWaalsContact O-CG 3.27Å; D377-N381 PolarHBondContact O-N 3.35Å; D377-N381 PolarHBondContact O-ND2 2.88Å |
| 378 | D | 77.4 | Confident | 67.4 | Low | 123 Ų | 123 | 106 Ų | 106 | 66% | 0.658 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -60 | -44 | 173.7 | -65 | -25.3 | 0 | 0 | 0 | 112.4 | S376 N381 V382 | S376-D378 PolarHBondContact O-N 3.36Å; S376-D378 VanDerWaalsContact O-N 3.09Å; D378-N381 PolarHBondContact O-N 2.69Å; D378-V382 VanDerWaalsContact O-CG2 3.28Å; D378-V382 WeakPolarHBondContact O-CG2 3.44Å; D378-V382 PolarHBondContact O-N 3.31Å |
| 379 | L | 76.2 | Confident | 68.4 | Low | 114 Ų | 114 | 100.6 Ų | 100.6 | 60% | 0.597 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -71 | -38.3 | -178.7 | -145.4 | 103.7 | 0 | 0 | 0 | 111.2 | A375 S376 D377 V382 F383 | A375-L379 HydrophobicContact CB-CB 4.31Å; A375-L379 HydrophobicContact CB-CD2 4.23Å; S376-L379 WeakPolarHBondContact O-CB 3.39Å; S376-L379 PolarHBondContact O-N 3.44Å; D377-L379 PolarHBondContact O-N 3.27Å; L379-V382 PolarHBondContact O-N 2.96Å; L379-F383 WeakPolarHBondContact O-CB 3.25Å; L379-F383 PolarHBondContact O-N 2.9Å |
| 380 | V | 76.9 | Confident | 69 | Low | 28 Ų | 28 | 98.2 Ų | 98.2 | 17% | 0.17 | 54% | 0.541 | C | S | . | . | H | α-helix | trans | -64.1 | -44 | 175.2 | 179.6 | 0 | 0 | 0 | 0 | 110.1 | L372 A375 S376 D377 F383 Q384 | L372-V380 HydrophobicContact CD2-CG2 4.46Å; A375-V380 HydrophobicContact CB-CG2 3.82Å; S376-V380 PolarHBondContact O-N 3.25Å; S376-V380 VanDerWaalsContact O-N 3.14Å; D377-V380 PolarHBondContact O-N 3.07Å; V380-F383 PolarHBondContact O-N 3.42Å; V380-Q384 HydrophobicContact CG1-CG 4.39Å; V380-Q384 WeakPolarHBondContact O-CB 3.31Å; V380-Q384 WeakPolarHBondContact O-CG 3.37Å; V380-Q384 PolarHBondContact O-N 3.48Å |
| 381 | N | 78.8 | Confident | 69.4 | Low | 96 Ų | 96 | 100.4 Ų | 100.4 | 51% | 0.513 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -63.3 | -42 | 176.4 | -78.1 | -26.7 | 0 | 0 | 0 | 112.1 | D377 D378 F383 Q384 H385 | D377-N381 WeakPolarHBondContact O-CB 3.44Å; D377-N381 VanDerWaalsContact O-CG 3.27Å; D377-N381 PolarHBondContact O-N 3.35Å; D377-N381 PolarHBondContact O-ND2 2.88Å; D378-N381 PolarHBondContact O-N 2.69Å; N381-F383 VanDerWaalsContact C-N 3.33Å; N381-F383 PolarHBondContact O-N 3.26Å; N381-Q384 PolarHBondContact O-N 2.94Å; N381-H385 WeakPolarHBondContact O-CB 3.35Å; N381-H385 PolarHBondContact O-N 3.42Å |
| 382 | V | 78.6 | Confident | 69.7 | Low | 102 Ų | 102 | 98.6 Ų | 98.6 | 62% | 0.618 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -61.9 | -42.5 | 174.8 | 170.3 | 0 | 0 | 0 | 0 | 111 | D378 L379 H385 K386 | D378-V382 VanDerWaalsContact O-CG2 3.28Å; D378-V382 WeakPolarHBondContact O-CG2 3.44Å; D378-V382 PolarHBondContact O-N 3.31Å; L379-V382 PolarHBondContact O-N 2.96Å; V382-H385 PolarHBondContact O-N 3.41Å; V382-K386 WeakPolarHBondContact O-CB 3.1Å; V382-K386 PolarHBondContact O-N 2.79Å |
| 383 | F | 76.4 | Confident | 69.8 | Low | 113 Ų | 113 | 100.3 Ų | 100.3 | 50% | 0.496 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -67.8 | -43.7 | 179.7 | -167.6 | -104.9 | 0 | 0 | 0 | 112 | L379 V380 N381 K386 I387 | L379-F383 WeakPolarHBondContact O-CB 3.25Å; L379-F383 PolarHBondContact O-N 2.9Å; V380-F383 PolarHBondContact O-N 3.42Å; N381-F383 VanDerWaalsContact C-N 3.33Å; N381-F383 PolarHBondContact O-N 3.26Å; F383-K386 PolarHBondContact O-N 2.84Å; F383-I387 HydrophobicContact CD1-CD1 3.58Å; F383-I387 HydrophobicContact CD1-CG1 4.45Å; F383-I387 HydrophobicContact CE1-CD1 3.24Å; F383-I387 HydrophobicContact CE1-CG1 4.27Å; F383-I387 HydrophobicContact CG-CD1 4.44Å; F383-I387 HydrophobicContact CZ-CD1 3.84Å; F383-I387 WeakPolarHBondContact O-CG1 3.24Å; F383-I387 PolarHBondContact O-N 3.06Å |
| 384 | Q | 79.2 | Confident | 69.6 | Low | 119 Ų | 119 | 101.3 Ų | 101.3 | 56% | 0.556 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -64.6 | -41.5 | 174.9 | -73.1 | -174.7 | 8.6 | 0 | 0 | 112 | V380 N381 I387 A388 | V380-Q384 HydrophobicContact CG1-CG 4.39Å; V380-Q384 WeakPolarHBondContact O-CB 3.31Å; V380-Q384 WeakPolarHBondContact O-CG 3.37Å; V380-Q384 PolarHBondContact O-N 3.48Å; N381-Q384 PolarHBondContact O-N 2.94Å; Q384-I387 PolarHBondContact O-N 3.03Å; Q384-A388 WeakPolarHBondContact O-CB 3.44Å; Q384-A388 PolarHBondContact O-N 3.3Å |
| 385 | H | 74.1 | Confident | 69.3 | Low | 131 Ų | 131 | 101.2 Ų | 101.2 | 61% | 0.606 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -63.2 | -42.7 | 175.4 | -173.4 | -81.8 | 0 | 0 | 0 | 111.2 | N381 V382 A388 C389 | N381-H385 WeakPolarHBondContact O-CB 3.35Å; N381-H385 PolarHBondContact O-N 3.42Å; V382-H385 PolarHBondContact O-N 3.41Å; H385-A388 PolarHBondContact O-N 2.86Å; H385-C389 PolarHBondContact CE1-SG 3.08Å; H385-C389 PolarHBondContact ND1-SG 3.49Å; H385-C389 VanDerWaalsContact ND1-SG 3.44Å; H385-C389 WeakPolarHBondContact O-CB 3.36Å; H385-C389 PolarHBondContact O-N 3.5Å; H385-C389 PolarHBondContact O-SG 2.85Å |
| 386 | K | 78 | Confident | 68.8 | Low | 128 Ų | 128 | 104.8 Ų | 104.8 | 56% | 0.557 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -61.7 | -46.6 | 176.2 | -174 | 173.2 | -178.1 | 177.2 | 0 | 111.7 | V382 F383 A388 C389 D390 | V382-K386 WeakPolarHBondContact O-CB 3.1Å; V382-K386 PolarHBondContact O-N 2.79Å; F383-K386 PolarHBondContact O-N 2.84Å; K386-A388 VanDerWaalsContact C-N 3.35Å; K386-A388 PolarHBondContact O-N 2.65Å; K386-C389 PolarHBondContact O-N 3.34Å; K386-D390 WeakPolarHBondContact O-CB 3.49Å; K386-D390 VanDerWaalsContact O-CG 3.29Å; K386-D390 PolarHBondContact O-N 2.94Å |
| 387 | I | 76.2 | Confident | 67.4 | Low | 68 Ų | 68 | 108.3 Ų | 108.3 | 35% | 0.349 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -59.3 | -47.1 | 175.3 | -72.4 | 173.7 | 0 | 0 | 0 | 110.5 | F383 Q384 C389 D390 Y391 | F383-I387 HydrophobicContact CD1-CD1 3.58Å; F383-I387 HydrophobicContact CD1-CG1 4.45Å; F383-I387 HydrophobicContact CE1-CD1 3.24Å; F383-I387 HydrophobicContact CE1-CG1 4.27Å; F383-I387 HydrophobicContact CG-CD1 4.44Å; F383-I387 HydrophobicContact CZ-CD1 3.84Å; F383-I387 WeakPolarHBondContact O-CG1 3.24Å; F383-I387 PolarHBondContact O-N 3.06Å; Q384-I387 PolarHBondContact O-N 3.03Å; I387-C389 VanDerWaalsContact C-N 3.34Å; I387-C389 PolarHBondContact O-N 3.17Å; I387-D390 PolarHBondContact O-N 3.42Å; I387-Y391 HydrophobicContact CG2-CD2 3.5Å; I387-Y391 HydrophobicContact CG2-CE2 3.58Å; I387-Y391 VanDerWaalsContact O-CD2 3.23Å; I387-Y391 WeakPolarHBondContact O-CD2 3.36Å; I387-Y391 PolarHBondContact O-N 3.27Å |
| 388 | A | 69.7 | Low | 65.8 | Low | 57 Ų | 57 | 110.3 Ų | 110.3 | 47% | 0.471 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -62.9 | -39.1 | 178.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | Q384 H385 K386 S392 | Q384-A388 WeakPolarHBondContact O-CB 3.44Å; Q384-A388 PolarHBondContact O-N 3.3Å; H385-A388 PolarHBondContact O-N 2.86Å; K386-A388 VanDerWaalsContact C-N 3.35Å; K386-A388 PolarHBondContact O-N 2.65Å; A388-S392 WeakPolarHBondContact O-CB 3.45Å; A388-S392 PolarHBondContact O-N 3.36Å; A388-S392 PolarHBondContact O-OG 3.29Å |
| 389 | C | 66.4 | Low | 65.2 | Low | 54 Ų | 54 | 109.7 Ų | 109.7 | 37% | 0.365 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -63.9 | -45 | 173.2 | -74.6 | 0 | 0 | 0 | 0 | 112 | H385 K386 I387 S392 F393 | H385-C389 PolarHBondContact CE1-SG 3.08Å; H385-C389 PolarHBondContact ND1-SG 3.49Å; H385-C389 VanDerWaalsContact ND1-SG 3.44Å; H385-C389 WeakPolarHBondContact O-CB 3.36Å; H385-C389 PolarHBondContact O-N 3.5Å; H385-C389 PolarHBondContact O-SG 2.85Å; K386-C389 PolarHBondContact O-N 3.34Å; I387-C389 VanDerWaalsContact C-N 3.34Å; I387-C389 PolarHBondContact O-N 3.17Å; C389-S392 VanDerWaalsContact CA-OG 3.31Å; C389-S392 WeakPolarHBondContact CA-OG 3.28Å; C389-S392 PolarHBondContact O-N 3.37Å; C389-S392 PolarHBondContact O-OG 2.9Å; C389-S392 VanDerWaalsContact O-OG 3.07Å; C389-F393 PolarHBondContact O-N 3.22Å |
| 390 | D | 63.5 | Low | 64.7 | Low | 86 Ų | 86 | 109.5 Ų | 109.5 | 46% | 0.46 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -63.6 | -44.5 | 178.4 | -70.2 | -15 | 0 | 0 | 0 | 110 | K386 I387 F393 W394 | K386-D390 WeakPolarHBondContact O-CB 3.49Å; K386-D390 VanDerWaalsContact O-CG 3.29Å; K386-D390 PolarHBondContact O-N 2.94Å; I387-D390 PolarHBondContact O-N 3.42Å; D390-F393 WeakPolarHBondContact O-CB 3.37Å; D390-F393 PolarHBondContact O-N 3.32Å; D390-W394 PolarHBondContact O-N 2.92Å |
| 391 | Y | 58.3 | Low | 64 | Low | 157 Ų | 157 | 114 Ų | 114 | 62% | 0.616 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -66.8 | -36 | 176.8 | -85.4 | -73.4 | 0 | 0 | 0 | 113.6 | I387 W394 L395 | I387-Y391 HydrophobicContact CG2-CD2 3.5Å; I387-Y391 HydrophobicContact CG2-CE2 3.58Å; I387-Y391 VanDerWaalsContact O-CD2 3.23Å; I387-Y391 WeakPolarHBondContact O-CD2 3.36Å; I387-Y391 PolarHBondContact O-N 3.27Å; Y391-W394 PolarHBondContact O-N 3.47Å; Y391-L395 PolarHBondContact O-N 3.03Å |
| 392 | S | 56.8 | Low | 63.1 | Low | 57 Ų | 57 | 115.1 Ų | 115.1 | 40% | 0.399 | 59% | 0.591 | S | S | . | * | H | α-helix | trans | -72.1 | -29.7 | 176.5 | 45.2 | 0 | 0 | 0 | 0 | 112.8 | A388 C389 W394 L395 C396 | A388-S392 WeakPolarHBondContact O-CB 3.45Å; A388-S392 PolarHBondContact O-N 3.36Å; A388-S392 PolarHBondContact O-OG 3.29Å; C389-S392 VanDerWaalsContact CA-OG 3.31Å; C389-S392 WeakPolarHBondContact CA-OG 3.28Å; C389-S392 PolarHBondContact O-N 3.37Å; C389-S392 PolarHBondContact O-OG 2.9Å; C389-S392 VanDerWaalsContact O-OG 3.07Å; S392-W394 VanDerWaalsContact C-N 3.27Å; S392-W394 PolarHBondContact O-N 3.2Å; S392-L395 PolarHBondContact O-N 3.49Å; S392-C396 PolarHBondContact O-N 2.7Å |
| 393 | F | 53.7 | Low | 62.1 | Low | 143 Ų | 143 | 115.9 Ų | 115.9 | 63% | 0.627 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -59.5 | -38.9 | 169.2 | -173.9 | -96.6 | 0 | 0 | 0 | 111.6 | C389 D390 | C389-F393 PolarHBondContact O-N 3.22Å; D390-F393 WeakPolarHBondContact O-CB 3.37Å; D390-F393 PolarHBondContact O-N 3.32Å |
| 394 | W | 49.3 | Very low | 61.2 | Low | 197 Ų | 197 | 116.1 Ų | 116.1 | 75% | 0.746 | 60% | 0.596 | S | S | * | * | H | α-helix | trans | -77.6 | -18.7 | 177.9 | -68 | 110.4 | 0 | 0 | 0 | 115 | D390 Y391 S392 | D390-W394 PolarHBondContact O-N 2.92Å; Y391-W394 PolarHBondContact O-N 3.47Å; S392-W394 VanDerWaalsContact C-N 3.27Å; S392-W394 PolarHBondContact O-N 3.2Å |
| 395 | L | 53.9 | Low | 59.9 | Low | 121 Ų | 121 | 115.9 Ų | 115.9 | 63% | 0.634 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -94.4 | -16.2 | -176.7 | -87.9 | 155.2 | 0 | 0 | 0 | 114.1 | Y391 S392 | Y391-L395 PolarHBondContact O-N 3.03Å; S392-L395 PolarHBondContact O-N 3.49Å |
| 396 | C | 51.6 | Low | 58.8 | Low | 105 Ų | 105 | 114.7 Ų | 114.7 | 71% | 0.709 | 60% | 0.598 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87.7 | -5 | -179.7 | -72.4 | 0 | 0 | 0 | 0 | 114.6 | S392 | S392-C396 PolarHBondContact O-N 2.7Š|
| 397 | D | 43.5 | Very low | 57.2 | Low | 143 Ų | 143 | 113.6 Ų | 113.6 | 77% | 0.765 | 60% | 0.601 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -106 | 21.4 | 179.1 | -80.7 | -11 | 0 | 0 | 0 | 113.7 | ||
| 398 | T | 43.6 | Very low | 55.5 | Low | 175 Ų | 175 | 117.7 Ų | 117.7 | 100% | 1.074 | 62% | 0.624 | S | S | * | * | trans | -123 | 0 | 164.6 | 49.3 | 0 | 0 | 0 | 0 | 110.2 |
Retrieved 398 of 398 residues in 266.3 ms
(Link to these results)